################################### # 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_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 31080 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_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 [15N,1H] HSQC' . . . 31080 1 2 '2D 1H-15N HSQC NH2' . . . 31080 1 3 '3D HNCO' . . . 31080 1 4 '3D HNCACB' . . . 31080 1 5 '3D C(CO)NH' . . . 31080 1 6 '3D CBCA(CO)NH' . . . 31080 1 7 '3D HNCACO' . . . 31080 1 8 '3D HNHA' . . . 31080 1 9 '3D HNHB' . . . 31080 1 10 '3D H(CCO)NH' . . . 31080 1 11 '3D 15N-EDITED NOESY- HSQC' . . . 31080 1 12 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 1 13 '3D [F1] 13C,15N-FILTERED NOESY-13C-HSQC' . . . 31080 1 14 '3D 13C-EDITED NOESY- HSQC' . . . 31080 1 15 '3D 13Caro-EDITED NOESY- HSQC' . . . 31080 1 16 '2D CT [13C, 1H] HSQC' . . . 31080 1 17 '2D CT 1H-13C AROMATIC HSQC' . . . 31080 1 18 '3D HCCH-TOCSY' . . . 31080 1 19 '3D HCCH-COSY' . . . 31080 1 20 '2D (HB)CB(CGCDCE)HE' . . . 31080 1 21 '2D (HB)CB(CGCD)HD' . . . 31080 1 22 '2D [F1] 13C, 15N- FILTERED NOESY' . . . 31080 1 23 '2D [F2] 13C,15N- FILTERED NOESY' . . . 31080 1 24 '2D [F1,F2] 13C,15N-FILTERED NOESY' . . . 31080 1 25 '2D [F1,F2] 13C,15N-FILTERED TOCSY' . . . 31080 1 26 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 1 27 '3D [F1] 13C, 15N-FILTERED NOESY- 13Caro-HSQC' . . . 31080 1 28 '2D [F1] 13C,15N- FILTERED NOESY' . . . 31080 1 29 '2D [F2] 13C,15N- FILTERED NOESY' . . . 31080 1 30 '2D [F1,F2] 13C,15N-FILTERED NOESY' . . . 31080 1 31 '2D [F1,F2] 13C,15N-FILTERED TOCSY' . . . 31080 1 32 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 1 33 '3D [F1] 13C, 15N-FILTERED NOESY- 13Caro-HSQC' . . . 31080 1 34 '3D [F1] 13C, 15N-FILTERED NOESY- 13Cali-HSQC' . . . 31080 1 35 '2D [15N,1H] HSQC' . . . 31080 1 36 '2D CT [13C, 1H] HSQC' . . . 31080 1 37 '3D HNCACB' . . . 31080 1 38 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 1 39 '3D [F1] 13C,15N-FILTERED NOESY-13C-HSQC' . . . 31080 1 40 '2D [15N,1H] HSQC' . . . 31080 1 41 '2D CT [13C, 1H] HSQC' . . . 31080 1 42 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 1 43 '3D [F1] 13C,15N-FILTERED NOESY-13C-HSQC' . . . 31080 1 44 '2D [F1] 13C, 15N- FILTERED NOESY' . . . 31080 1 45 '2D [F2] 13C, 15N- FILTERED NOESY' . . . 31080 1 46 '2D [F1,F2] 13C,15N-FILTERED NOESY' . . . 31080 1 47 '2D [F1,F2] 13C,15N-FILTERED TOCSY' . . . 31080 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 ALA HA H 1 4.375 0.014 . 1 . . . . A 2 ALA HA . 31080 1 2 . 1 . 1 2 2 ALA HB1 H 1 1.411 0.010 . 1 . . . . A 2 ALA HB1 . 31080 1 3 . 1 . 1 2 2 ALA HB2 H 1 1.411 0.010 . 1 . . . . A 2 ALA HB2 . 31080 1 4 . 1 . 1 2 2 ALA HB3 H 1 1.411 0.010 . 1 . . . . A 2 ALA HB3 . 31080 1 5 . 1 . 1 2 2 ALA C C 13 177.149 0.000 . 1 . . . . A 2 ALA C . 31080 1 6 . 1 . 1 2 2 ALA CA C 13 52.712 0.018 . 1 . . . . A 2 ALA CA . 31080 1 7 . 1 . 1 2 2 ALA CB C 13 19.143 0.072 . 1 . . . . A 2 ALA CB . 31080 1 8 . 1 . 1 3 3 ASP H H 1 8.451 0.025 . 1 . . . . A 3 ASP H . 31080 1 9 . 1 . 1 3 3 ASP HA H 1 4.540 0.010 . 1 . . . . A 3 ASP HA . 31080 1 10 . 1 . 1 3 3 ASP HB2 H 1 2.710 0.010 . 2 . . . . A 3 ASP HB2 . 31080 1 11 . 1 . 1 3 3 ASP HB3 H 1 2.614 0.000 . 2 . . . . A 3 ASP HB3 . 31080 1 12 . 1 . 1 3 3 ASP C C 13 176.435 0.000 . 1 . . . . A 3 ASP C . 31080 1 13 . 1 . 1 3 3 ASP CA C 13 54.768 0.019 . 1 . . . . A 3 ASP CA . 31080 1 14 . 1 . 1 3 3 ASP CB C 13 41.066 0.034 . 1 . . . . A 3 ASP CB . 31080 1 15 . 1 . 1 3 3 ASP N N 15 120.310 0.059 . 1 . . . . A 3 ASP N . 31080 1 16 . 1 . 1 4 4 GLU H H 1 8.420 0.019 . 1 . . . . A 4 GLU H . 31080 1 17 . 1 . 1 4 4 GLU HA H 1 4.260 0.008 . 1 . . . . A 4 GLU HA . 31080 1 18 . 1 . 1 4 4 GLU HB2 H 1 2.052 0.008 . 2 . . . . A 4 GLU HB2 . 31080 1 19 . 1 . 1 4 4 GLU HB3 H 1 1.963 0.009 . 2 . . . . A 4 GLU HB3 . 31080 1 20 . 1 . 1 4 4 GLU HG2 H 1 2.281 0.000 . 1 . . . . A 4 GLU HG2 . 31080 1 21 . 1 . 1 4 4 GLU C C 13 176.465 0.003 . 1 . . . . A 4 GLU C . 31080 1 22 . 1 . 1 4 4 GLU CA C 13 56.771 0.040 . 1 . . . . A 4 GLU CA . 31080 1 23 . 1 . 1 4 4 GLU CB C 13 30.380 0.039 . 1 . . . . A 4 GLU CB . 31080 1 24 . 1 . 1 4 4 GLU CG C 13 36.336 0.017 . 1 . . . . A 4 GLU CG . 31080 1 25 . 1 . 1 4 4 GLU N N 15 120.806 0.089 . 1 . . . . A 4 GLU N . 31080 1 26 . 1 . 1 5 5 GLU H H 1 8.360 0.023 . 1 . . . . A 5 GLU H . 31080 1 27 . 1 . 1 5 5 GLU HA H 1 4.240 0.007 . 1 . . . . A 5 GLU HA . 31080 1 28 . 1 . 1 5 5 GLU HB2 H 1 2.052 0.008 . 2 . . . . A 5 GLU HB2 . 31080 1 29 . 1 . 1 5 5 GLU HB3 H 1 1.961 0.006 . 2 . . . . A 5 GLU HB3 . 31080 1 30 . 1 . 1 5 5 GLU HG2 H 1 2.254 0.000 . 1 . . . . A 5 GLU HG2 . 31080 1 31 . 1 . 1 5 5 GLU C C 13 176.196 0.005 . 1 . . . . A 5 GLU C . 31080 1 32 . 1 . 1 5 5 GLU CA C 13 56.507 0.024 . 1 . . . . A 5 GLU CA . 31080 1 33 . 1 . 1 5 5 GLU CB C 13 30.362 0.046 . 1 . . . . A 5 GLU CB . 31080 1 34 . 1 . 1 5 5 GLU CG C 13 36.377 0.001 . 1 . . . . A 5 GLU CG . 31080 1 35 . 1 . 1 5 5 GLU N N 15 122.025 0.039 . 1 . . . . A 5 GLU N . 31080 1 36 . 1 . 1 6 6 LYS H H 1 8.245 0.021 . 1 . . . . A 6 LYS H . 31080 1 37 . 1 . 1 6 6 LYS HA H 1 4.294 0.012 . 1 . . . . A 6 LYS HA . 31080 1 38 . 1 . 1 6 6 LYS HB2 H 1 1.841 0.010 . 2 . . . . A 6 LYS HB2 . 31080 1 39 . 1 . 1 6 6 LYS HB3 H 1 1.746 0.016 . 2 . . . . A 6 LYS HB3 . 31080 1 40 . 1 . 1 6 6 LYS HG2 H 1 1.476 0.000 . 1 . . . . A 6 LYS HG2 . 31080 1 41 . 1 . 1 6 6 LYS HE2 H 1 3.036 0.000 . 1 . . . . A 6 LYS HE2 . 31080 1 42 . 1 . 1 6 6 LYS C C 13 176.329 0.023 . 1 . . . . A 6 LYS C . 31080 1 43 . 1 . 1 6 6 LYS CA C 13 56.338 0.026 . 1 . . . . A 6 LYS CA . 31080 1 44 . 1 . 1 6 6 LYS CB C 13 32.751 0.043 . 1 . . . . A 6 LYS CB . 31080 1 45 . 1 . 1 6 6 LYS CG C 13 24.680 0.018 . 1 . . . . A 6 LYS CG . 31080 1 46 . 1 . 1 6 6 LYS CD C 13 29.115 0.000 . 1 . . . . A 6 LYS CD . 31080 1 47 . 1 . 1 6 6 LYS CE C 13 42.213 0.021 . 1 . . . . A 6 LYS CE . 31080 1 48 . 1 . 1 6 6 LYS N N 15 123.510 0.050 . 1 . . . . A 6 LYS N . 31080 1 49 . 1 . 1 7 7 LEU H H 1 8.535 0.023 . 1 . . . . A 7 LEU H . 31080 1 50 . 1 . 1 7 7 LEU HA H 1 4.608 0.006 . 1 . . . . A 7 LEU HA . 31080 1 51 . 1 . 1 7 7 LEU HB2 H 1 1.813 0.010 . 2 . . . . A 7 LEU HB2 . 31080 1 52 . 1 . 1 7 7 LEU HB3 H 1 1.412 0.012 . 2 . . . . A 7 LEU HB3 . 31080 1 53 . 1 . 1 7 7 LEU HD11 H 1 0.797 0.000 . 2 . . . . A 7 LEU HD11 . 31080 1 54 . 1 . 1 7 7 LEU HD12 H 1 0.797 0.000 . 2 . . . . A 7 LEU HD12 . 31080 1 55 . 1 . 1 7 7 LEU HD13 H 1 0.797 0.000 . 2 . . . . A 7 LEU HD13 . 31080 1 56 . 1 . 1 7 7 LEU HD21 H 1 1.054 0.000 . 2 . . . . A 7 LEU HD21 . 31080 1 57 . 1 . 1 7 7 LEU HD22 H 1 1.054 0.000 . 2 . . . . A 7 LEU HD22 . 31080 1 58 . 1 . 1 7 7 LEU HD23 H 1 1.054 0.000 . 2 . . . . A 7 LEU HD23 . 31080 1 59 . 1 . 1 7 7 LEU C C 13 174.186 0.000 . 1 . . . . A 7 LEU C . 31080 1 60 . 1 . 1 7 7 LEU CA C 13 52.734 0.034 . 1 . . . . A 7 LEU CA . 31080 1 61 . 1 . 1 7 7 LEU CB C 13 42.149 0.016 . 1 . . . . A 7 LEU CB . 31080 1 62 . 1 . 1 7 7 LEU CD2 C 13 23.548 0.077 . 1 . . . . A 7 LEU CD2 . 31080 1 63 . 1 . 1 7 7 LEU N N 15 124.996 0.050 . 1 . . . . A 7 LEU N . 31080 1 64 . 1 . 1 8 8 PRO HA H 1 4.846 0.000 . 1 . . . . A 8 PRO HA . 31080 1 65 . 1 . 1 8 8 PRO HB2 H 1 2.589 0.000 . 1 . . . . A 8 PRO HB2 . 31080 1 66 . 1 . 1 8 8 PRO HG2 H 1 2.239 0.000 . 1 . . . . A 8 PRO HG2 . 31080 1 67 . 1 . 1 8 8 PRO HD2 H 1 3.519 0.000 . 1 . . . . A 8 PRO HD2 . 31080 1 68 . 1 . 1 9 9 PRO HA H 1 4.374 0.000 . 1 . . . . A 9 PRO HA . 31080 1 69 . 1 . 1 9 9 PRO HB2 H 1 2.367 0.000 . 2 . . . . A 9 PRO HB2 . 31080 1 70 . 1 . 1 9 9 PRO HB3 H 1 1.916 0.018 . 2 . . . . A 9 PRO HB3 . 31080 1 71 . 1 . 1 9 9 PRO HG2 H 1 2.081 0.000 . 2 . . . . A 9 PRO HG2 . 31080 1 72 . 1 . 1 9 9 PRO HG3 H 1 2.176 0.000 . 2 . . . . A 9 PRO HG3 . 31080 1 73 . 1 . 1 9 9 PRO HD2 H 1 3.665 0.000 . 2 . . . . A 9 PRO HD2 . 31080 1 74 . 1 . 1 9 9 PRO HD3 H 1 3.929 0.000 . 2 . . . . A 9 PRO HD3 . 31080 1 75 . 1 . 1 9 9 PRO C C 13 177.013 0.001 . 1 . . . . A 9 PRO C . 31080 1 76 . 1 . 1 9 9 PRO CA C 13 64.360 0.049 . 1 . . . . A 9 PRO CA . 31080 1 77 . 1 . 1 9 9 PRO CB C 13 31.979 0.043 . 1 . . . . A 9 PRO CB . 31080 1 78 . 1 . 1 9 9 PRO CG C 13 27.688 0.105 . 1 . . . . A 9 PRO CG . 31080 1 79 . 1 . 1 9 9 PRO CD C 13 50.509 0.010 . 1 . . . . A 9 PRO CD . 31080 1 80 . 1 . 1 10 10 GLY H H 1 8.710 0.024 . 1 . . . . A 10 GLY H . 31080 1 81 . 1 . 1 10 10 GLY HA2 H 1 4.014 0.006 . 2 . . . . A 10 GLY HA2 . 31080 1 82 . 1 . 1 10 10 GLY HA3 H 1 3.176 0.017 . 2 . . . . A 10 GLY HA3 . 31080 1 83 . 1 . 1 10 10 GLY C C 13 172.861 0.009 . 1 . . . . A 10 GLY C . 31080 1 84 . 1 . 1 10 10 GLY CA C 13 45.007 0.056 . 1 . . . . A 10 GLY CA . 31080 1 85 . 1 . 1 10 10 GLY N N 15 111.842 0.061 . 1 . . . . A 10 GLY N . 31080 1 86 . 1 . 1 11 11 TRP H H 1 7.395 0.026 . 1 . . . . A 11 TRP H . 31080 1 87 . 1 . 1 11 11 TRP HA H 1 5.231 0.011 . 1 . . . . A 11 TRP HA . 31080 1 88 . 1 . 1 11 11 TRP HB2 H 1 3.253 0.011 . 2 . . . . A 11 TRP HB2 . 31080 1 89 . 1 . 1 11 11 TRP HB3 H 1 2.974 0.006 . 2 . . . . A 11 TRP HB3 . 31080 1 90 . 1 . 1 11 11 TRP HD1 H 1 6.959 0.009 . 1 . . . . A 11 TRP HD1 . 31080 1 91 . 1 . 1 11 11 TRP HE1 H 1 10.452 0.026 . 1 . . . . A 11 TRP HE1 . 31080 1 92 . 1 . 1 11 11 TRP HE3 H 1 7.387 0.000 . 1 . . . . A 11 TRP HE3 . 31080 1 93 . 1 . 1 11 11 TRP HZ2 H 1 7.421 0.000 . 1 . . . . A 11 TRP HZ2 . 31080 1 94 . 1 . 1 11 11 TRP HH2 H 1 6.985 0.000 . 1 . . . . A 11 TRP HH2 . 31080 1 95 . 1 . 1 11 11 TRP C C 13 176.354 0.006 . 1 . . . . A 11 TRP C . 31080 1 96 . 1 . 1 11 11 TRP CA C 13 57.307 0.035 . 1 . . . . A 11 TRP CA . 31080 1 97 . 1 . 1 11 11 TRP CB C 13 32.347 0.023 . 1 . . . . A 11 TRP CB . 31080 1 98 . 1 . 1 11 11 TRP CD1 C 13 127.800 0.000 . 1 . . . . A 11 TRP CD1 . 31080 1 99 . 1 . 1 11 11 TRP CE3 C 13 120.404 0.000 . 1 . . . . A 11 TRP CE3 . 31080 1 100 . 1 . 1 11 11 TRP CZ2 C 13 114.902 0.000 . 1 . . . . A 11 TRP CZ2 . 31080 1 101 . 1 . 1 11 11 TRP N N 15 117.547 0.065 . 1 . . . . A 11 TRP N . 31080 1 102 . 1 . 1 11 11 TRP NE1 N 15 129.247 0.028 . 1 . . . . A 11 TRP NE1 . 31080 1 103 . 1 . 1 12 12 GLU H H 1 9.775 0.025 . 1 . . . . A 12 GLU H . 31080 1 104 . 1 . 1 12 12 GLU HA H 1 4.856 0.011 . 1 . . . . A 12 GLU HA . 31080 1 105 . 1 . 1 12 12 GLU HB2 H 1 2.270 0.013 . 2 . . . . A 12 GLU HB2 . 31080 1 106 . 1 . 1 12 12 GLU HB3 H 1 2.205 0.001 . 2 . . . . A 12 GLU HB3 . 31080 1 107 . 1 . 1 12 12 GLU HG2 H 1 2.580 0.001 . 1 . . . . A 12 GLU HG2 . 31080 1 108 . 1 . 1 12 12 GLU C C 13 174.125 0.004 . 1 . . . . A 12 GLU C . 31080 1 109 . 1 . 1 12 12 GLU CA C 13 54.698 0.050 . 1 . . . . A 12 GLU CA . 31080 1 110 . 1 . 1 12 12 GLU CB C 13 34.541 0.037 . 1 . . . . A 12 GLU CB . 31080 1 111 . 1 . 1 12 12 GLU CG C 13 36.411 0.048 . 1 . . . . A 12 GLU CG . 31080 1 112 . 1 . 1 12 12 GLU N N 15 120.435 0.058 . 1 . . . . A 12 GLU N . 31080 1 113 . 1 . 1 13 13 LYS H H 1 8.831 0.024 . 1 . . . . A 13 LYS H . 31080 1 114 . 1 . 1 13 13 LYS HA H 1 4.516 0.008 . 1 . . . . A 13 LYS HA . 31080 1 115 . 1 . 1 13 13 LYS HB2 H 1 1.685 0.030 . 2 . . . . A 13 LYS HB2 . 31080 1 116 . 1 . 1 13 13 LYS HB3 H 1 1.647 0.014 . 2 . . . . A 13 LYS HB3 . 31080 1 117 . 1 . 1 13 13 LYS HG2 H 1 1.226 0.000 . 2 . . . . A 13 LYS HG2 . 31080 1 118 . 1 . 1 13 13 LYS HG3 H 1 1.102 0.000 . 2 . . . . A 13 LYS HG3 . 31080 1 119 . 1 . 1 13 13 LYS HE2 H 1 2.967 0.003 . 1 . . . . A 13 LYS HE2 . 31080 1 120 . 1 . 1 13 13 LYS C C 13 175.614 0.002 . 1 . . . . A 13 LYS C . 31080 1 121 . 1 . 1 13 13 LYS CA C 13 56.096 0.074 . 1 . . . . A 13 LYS CA . 31080 1 122 . 1 . 1 13 13 LYS CB C 13 34.005 0.051 . 1 . . . . A 13 LYS CB . 31080 1 123 . 1 . 1 13 13 LYS CG C 13 25.343 0.059 . 1 . . . . A 13 LYS CG . 31080 1 124 . 1 . 1 13 13 LYS CD C 13 29.853 0.000 . 1 . . . . A 13 LYS CD . 31080 1 125 . 1 . 1 13 13 LYS CE C 13 42.058 0.011 . 1 . . . . A 13 LYS CE . 31080 1 126 . 1 . 1 13 13 LYS N N 15 124.217 0.054 . 1 . . . . A 13 LYS N . 31080 1 127 . 1 . 1 14 14 ARG H H 1 8.696 0.023 . 1 . . . . A 14 ARG H . 31080 1 128 . 1 . 1 14 14 ARG HA H 1 4.365 0.009 . 1 . . . . A 14 ARG HA . 31080 1 129 . 1 . 1 14 14 ARG HB2 H 1 1.175 0.019 . 2 . . . . A 14 ARG HB2 . 31080 1 130 . 1 . 1 14 14 ARG HB3 H 1 0.083 0.009 . 2 . . . . A 14 ARG HB3 . 31080 1 131 . 1 . 1 14 14 ARG HG2 H 1 1.328 0.013 . 2 . . . . A 14 ARG HG2 . 31080 1 132 . 1 . 1 14 14 ARG HG3 H 1 1.206 0.000 . 2 . . . . A 14 ARG HG3 . 31080 1 133 . 1 . 1 14 14 ARG HD2 H 1 2.775 0.017 . 2 . . . . A 14 ARG HD2 . 31080 1 134 . 1 . 1 14 14 ARG HD3 H 1 2.960 0.014 . 2 . . . . A 14 ARG HD3 . 31080 1 135 . 1 . 1 14 14 ARG HE H 1 6.961 0.021 . 1 . . . . A 14 ARG HE . 31080 1 136 . 1 . 1 14 14 ARG HH21 H 1 6.400 0.000 . 1 . . . . A 14 ARG HH21 . 31080 1 137 . 1 . 1 14 14 ARG C C 13 173.041 0.009 . 1 . . . . A 14 ARG C . 31080 1 138 . 1 . 1 14 14 ARG CA C 13 54.064 0.102 . 1 . . . . A 14 ARG CA . 31080 1 139 . 1 . 1 14 14 ARG CB C 13 34.205 0.044 . 1 . . . . A 14 ARG CB . 31080 1 140 . 1 . 1 14 14 ARG CG C 13 28.038 0.031 . 1 . . . . A 14 ARG CG . 31080 1 141 . 1 . 1 14 14 ARG CD C 13 43.259 0.117 . 1 . . . . A 14 ARG CD . 31080 1 142 . 1 . 1 14 14 ARG CZ C 13 159.102 0.000 . 1 . . . . A 14 ARG CZ . 31080 1 143 . 1 . 1 14 14 ARG N N 15 126.219 0.068 . 1 . . . . A 14 ARG N . 31080 1 144 . 1 . 1 14 14 ARG NE N 15 83.831 0.051 . 1 . . . . A 14 ARG NE . 31080 1 145 . 1 . 1 14 14 ARG NH2 N 15 71.869 0.000 . 1 . . . . A 14 ARG NH2 . 31080 1 146 . 1 . 1 15 15 MET H H 1 8.066 0.025 . 1 . . . . A 15 MET H . 31080 1 147 . 1 . 1 15 15 MET HA H 1 4.941 0.008 . 1 . . . . A 15 MET HA . 31080 1 148 . 1 . 1 15 15 MET HB2 H 1 1.789 0.010 . 1 . . . . A 15 MET HB2 . 31080 1 149 . 1 . 1 15 15 MET HG2 H 1 2.456 0.002 . 2 . . . . A 15 MET HG2 . 31080 1 150 . 1 . 1 15 15 MET HG3 H 1 2.333 0.000 . 2 . . . . A 15 MET HG3 . 31080 1 151 . 1 . 1 15 15 MET HE1 H 1 2.029 0.000 . 1 . . . . A 15 MET HE1 . 31080 1 152 . 1 . 1 15 15 MET HE2 H 1 2.029 0.000 . 1 . . . . A 15 MET HE2 . 31080 1 153 . 1 . 1 15 15 MET HE3 H 1 2.029 0.000 . 1 . . . . A 15 MET HE3 . 31080 1 154 . 1 . 1 15 15 MET C C 13 177.170 0.006 . 1 . . . . A 15 MET C . 31080 1 155 . 1 . 1 15 15 MET CA C 13 53.902 0.062 . 1 . . . . A 15 MET CA . 31080 1 156 . 1 . 1 15 15 MET CB C 13 34.640 0.056 . 1 . . . . A 15 MET CB . 31080 1 157 . 1 . 1 15 15 MET CG C 13 31.972 0.028 . 1 . . . . A 15 MET CG . 31080 1 158 . 1 . 1 15 15 MET CE C 13 16.730 0.000 . 1 . . . . A 15 MET CE . 31080 1 159 . 1 . 1 15 15 MET N N 15 116.810 0.047 . 1 . . . . A 15 MET N . 31080 1 160 . 1 . 1 16 16 SER H H 1 9.286 0.022 . 1 . . . . A 16 SER H . 31080 1 161 . 1 . 1 16 16 SER HA H 1 4.987 0.009 . 1 . . . . A 16 SER HA . 31080 1 162 . 1 . 1 16 16 SER HB2 H 1 4.272 0.008 . 2 . . . . A 16 SER HB2 . 31080 1 163 . 1 . 1 16 16 SER HB3 H 1 4.401 0.000 . 2 . . . . A 16 SER HB3 . 31080 1 164 . 1 . 1 16 16 SER CA C 13 57.736 0.018 . 1 . . . . A 16 SER CA . 31080 1 165 . 1 . 1 16 16 SER CB C 13 63.792 0.028 . 1 . . . . A 16 SER CB . 31080 1 166 . 1 . 1 16 16 SER N N 15 120.868 0.054 . 1 . . . . A 16 SER N . 31080 1 167 . 1 . 1 17 17 ARG H H 1 9.295 0.000 . 1 . . . . A 17 ARG H . 31080 1 168 . 1 . 1 17 17 ARG HA H 1 4.086 0.018 . 1 . . . . A 17 ARG HA . 31080 1 169 . 1 . 1 17 17 ARG HB2 H 1 1.997 0.000 . 1 . . . . A 17 ARG HB2 . 31080 1 170 . 1 . 1 17 17 ARG HE H 1 8.313 0.004 . 1 . . . . A 17 ARG HE . 31080 1 171 . 1 . 1 17 17 ARG C C 13 178.290 0.000 . 1 . . . . A 17 ARG C . 31080 1 172 . 1 . 1 17 17 ARG CA C 13 58.594 0.087 . 1 . . . . A 17 ARG CA . 31080 1 173 . 1 . 1 17 17 ARG CB C 13 30.423 0.050 . 1 . . . . A 17 ARG CB . 31080 1 174 . 1 . 1 17 17 ARG CG C 13 26.735 0.038 . 1 . . . . A 17 ARG CG . 31080 1 175 . 1 . 1 17 17 ARG CD C 13 43.360 0.005 . 1 . . . . A 17 ARG CD . 31080 1 176 . 1 . 1 17 17 ARG N N 15 130.880 0.000 . 1 . . . . A 17 ARG N . 31080 1 177 . 1 . 1 17 17 ARG NE N 15 85.521 0.066 . 1 . . . . A 17 ARG NE . 31080 1 178 . 1 . 1 18 18 SER H H 1 8.648 0.024 . 1 . . . . A 18 SER H . 31080 1 179 . 1 . 1 18 18 SER HA H 1 4.423 0.009 . 1 . . . . A 18 SER HA . 31080 1 180 . 1 . 1 18 18 SER HB2 H 1 3.903 0.000 . 2 . . . . A 18 SER HB2 . 31080 1 181 . 1 . 1 18 18 SER HB3 H 1 4.066 0.000 . 2 . . . . A 18 SER HB3 . 31080 1 182 . 1 . 1 18 18 SER C C 13 175.847 0.042 . 1 . . . . A 18 SER C . 31080 1 183 . 1 . 1 18 18 SER CA C 13 60.137 0.009 . 1 . . . . A 18 SER CA . 31080 1 184 . 1 . 1 18 18 SER CB C 13 63.519 0.048 . 1 . . . . A 18 SER CB . 31080 1 185 . 1 . 1 18 18 SER N N 15 112.997 0.069 . 1 . . . . A 18 SER N . 31080 1 186 . 1 . 1 19 19 SER H H 1 7.917 0.022 . 1 . . . . A 19 SER H . 31080 1 187 . 1 . 1 19 19 SER HA H 1 4.757 0.008 . 1 . . . . A 19 SER HA . 31080 1 188 . 1 . 1 19 19 SER HB2 H 1 4.035 0.008 . 2 . . . . A 19 SER HB2 . 31080 1 189 . 1 . 1 19 19 SER HB3 H 1 3.893 0.000 . 2 . . . . A 19 SER HB3 . 31080 1 190 . 1 . 1 19 19 SER C C 13 175.863 0.000 . 1 . . . . A 19 SER C . 31080 1 191 . 1 . 1 19 19 SER CA C 13 58.332 0.068 . 1 . . . . A 19 SER CA . 31080 1 192 . 1 . 1 19 19 SER CB C 13 66.654 0.046 . 1 . . . . A 19 SER CB . 31080 1 193 . 1 . 1 19 19 SER N N 15 112.676 0.071 . 1 . . . . A 19 SER N . 31080 1 194 . 1 . 1 20 20 GLY H H 1 7.950 0.024 . 1 . . . . A 20 GLY H . 31080 1 195 . 1 . 1 20 20 GLY HA2 H 1 4.173 0.009 . 2 . . . . A 20 GLY HA2 . 31080 1 196 . 1 . 1 20 20 GLY HA3 H 1 3.940 0.013 . 2 . . . . A 20 GLY HA3 . 31080 1 197 . 1 . 1 20 20 GLY C C 13 173.141 0.007 . 1 . . . . A 20 GLY C . 31080 1 198 . 1 . 1 20 20 GLY CA C 13 46.437 0.060 . 1 . . . . A 20 GLY CA . 31080 1 199 . 1 . 1 20 20 GLY N N 15 112.396 0.044 . 1 . . . . A 20 GLY N . 31080 1 200 . 1 . 1 21 21 ARG H H 1 7.608 0.027 . 1 . . . . A 21 ARG H . 31080 1 201 . 1 . 1 21 21 ARG HA H 1 4.432 0.007 . 1 . . . . A 21 ARG HA . 31080 1 202 . 1 . 1 21 21 ARG HB2 H 1 1.782 0.002 . 2 . . . . A 21 ARG HB2 . 31080 1 203 . 1 . 1 21 21 ARG HB3 H 1 2.066 0.014 . 2 . . . . A 21 ARG HB3 . 31080 1 204 . 1 . 1 21 21 ARG HG2 H 1 1.682 0.000 . 2 . . . . A 21 ARG HG2 . 31080 1 205 . 1 . 1 21 21 ARG HG3 H 1 1.783 0.000 . 2 . . . . A 21 ARG HG3 . 31080 1 206 . 1 . 1 21 21 ARG HD2 H 1 2.668 0.009 . 2 . . . . A 21 ARG HD2 . 31080 1 207 . 1 . 1 21 21 ARG HD3 H 1 2.866 0.008 . 2 . . . . A 21 ARG HD3 . 31080 1 208 . 1 . 1 21 21 ARG HE H 1 6.672 0.022 . 1 . . . . A 21 ARG HE . 31080 1 209 . 1 . 1 21 21 ARG HH21 H 1 6.111 0.000 . 1 . . . . A 21 ARG HH21 . 31080 1 210 . 1 . 1 21 21 ARG C C 13 176.003 0.002 . 1 . . . . A 21 ARG C . 31080 1 211 . 1 . 1 21 21 ARG CA C 13 56.416 0.014 . 1 . . . . A 21 ARG CA . 31080 1 212 . 1 . 1 21 21 ARG CB C 13 32.947 0.054 . 1 . . . . A 21 ARG CB . 31080 1 213 . 1 . 1 21 21 ARG CG C 13 27.188 0.047 . 1 . . . . A 21 ARG CG . 31080 1 214 . 1 . 1 21 21 ARG CD C 13 43.442 0.017 . 1 . . . . A 21 ARG CD . 31080 1 215 . 1 . 1 21 21 ARG CZ C 13 158.885 0.000 . 1 . . . . A 21 ARG CZ . 31080 1 216 . 1 . 1 21 21 ARG N N 15 119.465 0.059 . 1 . . . . A 21 ARG N . 31080 1 217 . 1 . 1 21 21 ARG NE N 15 83.731 0.051 . 1 . . . . A 21 ARG NE . 31080 1 218 . 1 . 1 22 22 VAL H H 1 8.470 0.025 . 1 . . . . A 22 VAL H . 31080 1 219 . 1 . 1 22 22 VAL HA H 1 4.682 0.007 . 1 . . . . A 22 VAL HA . 31080 1 220 . 1 . 1 22 22 VAL HB H 1 1.977 0.010 . 1 . . . . A 22 VAL HB . 31080 1 221 . 1 . 1 22 22 VAL HG11 H 1 0.805 0.000 . 2 . . . . A 22 VAL HG11 . 31080 1 222 . 1 . 1 22 22 VAL HG12 H 1 0.805 0.000 . 2 . . . . A 22 VAL HG12 . 31080 1 223 . 1 . 1 22 22 VAL HG13 H 1 0.805 0.000 . 2 . . . . A 22 VAL HG13 . 31080 1 224 . 1 . 1 22 22 VAL HG21 H 1 1.049 0.009 . 2 . . . . A 22 VAL HG21 . 31080 1 225 . 1 . 1 22 22 VAL HG22 H 1 1.049 0.009 . 2 . . . . A 22 VAL HG22 . 31080 1 226 . 1 . 1 22 22 VAL HG23 H 1 1.049 0.009 . 2 . . . . A 22 VAL HG23 . 31080 1 227 . 1 . 1 22 22 VAL C C 13 175.268 0.004 . 1 . . . . A 22 VAL C . 31080 1 228 . 1 . 1 22 22 VAL CA C 13 62.462 0.073 . 1 . . . . A 22 VAL CA . 31080 1 229 . 1 . 1 22 22 VAL CB C 13 33.044 0.046 . 1 . . . . A 22 VAL CB . 31080 1 230 . 1 . 1 22 22 VAL CG1 C 13 21.462 0.000 . 2 . . . . A 22 VAL CG1 . 31080 1 231 . 1 . 1 22 22 VAL CG2 C 13 22.209 0.026 . 2 . . . . A 22 VAL CG2 . 31080 1 232 . 1 . 1 22 22 VAL N N 15 124.240 0.075 . 1 . . . . A 22 VAL N . 31080 1 233 . 1 . 1 23 23 TYR H H 1 8.657 0.027 . 1 . . . . A 23 TYR H . 31080 1 234 . 1 . 1 23 23 TYR HA H 1 4.892 0.008 . 1 . . . . A 23 TYR HA . 31080 1 235 . 1 . 1 23 23 TYR HB2 H 1 2.455 0.006 . 2 . . . . A 23 TYR HB2 . 31080 1 236 . 1 . 1 23 23 TYR HB3 H 1 2.779 0.011 . 2 . . . . A 23 TYR HB3 . 31080 1 237 . 1 . 1 23 23 TYR HD1 H 1 6.784 0.000 . 1 . . . . A 23 TYR HD1 . 31080 1 238 . 1 . 1 23 23 TYR HD2 H 1 6.784 0.000 . 1 . . . . A 23 TYR HD2 . 31080 1 239 . 1 . 1 23 23 TYR HE1 H 1 6.261 0.000 . 1 . . . . A 23 TYR HE1 . 31080 1 240 . 1 . 1 23 23 TYR HE2 H 1 6.261 0.000 . 1 . . . . A 23 TYR HE2 . 31080 1 241 . 1 . 1 23 23 TYR C C 13 170.806 0.006 . 1 . . . . A 23 TYR C . 31080 1 242 . 1 . 1 23 23 TYR CA C 13 55.412 0.042 . 1 . . . . A 23 TYR CA . 31080 1 243 . 1 . 1 23 23 TYR CB C 13 39.690 0.030 . 1 . . . . A 23 TYR CB . 31080 1 244 . 1 . 1 23 23 TYR CD1 C 13 133.703 0.000 . 1 . . . . A 23 TYR CD1 . 31080 1 245 . 1 . 1 23 23 TYR CD2 C 13 133.703 0.000 . 1 . . . . A 23 TYR CD2 . 31080 1 246 . 1 . 1 23 23 TYR CE1 C 13 117.858 0.000 . 1 . . . . A 23 TYR CE1 . 31080 1 247 . 1 . 1 23 23 TYR CE2 C 13 117.858 0.000 . 1 . . . . A 23 TYR CE2 . 31080 1 248 . 1 . 1 23 23 TYR N N 15 122.247 0.108 . 1 . . . . A 23 TYR N . 31080 1 249 . 1 . 1 24 24 TYR H H 1 8.904 0.025 . 1 . . . . A 24 TYR H . 31080 1 250 . 1 . 1 24 24 TYR HA H 1 5.325 0.010 . 1 . . . . A 24 TYR HA . 31080 1 251 . 1 . 1 24 24 TYR HB2 H 1 2.973 0.009 . 2 . . . . A 24 TYR HB2 . 31080 1 252 . 1 . 1 24 24 TYR HB3 H 1 2.726 0.018 . 2 . . . . A 24 TYR HB3 . 31080 1 253 . 1 . 1 24 24 TYR HD1 H 1 6.835 0.000 . 1 . . . . A 24 TYR HD1 . 31080 1 254 . 1 . 1 24 24 TYR HD2 H 1 6.835 0.000 . 1 . . . . A 24 TYR HD2 . 31080 1 255 . 1 . 1 24 24 TYR HE1 H 1 6.752 0.000 . 1 . . . . A 24 TYR HE1 . 31080 1 256 . 1 . 1 24 24 TYR HE2 H 1 6.752 0.000 . 1 . . . . A 24 TYR HE2 . 31080 1 257 . 1 . 1 24 24 TYR C C 13 174.331 0.006 . 1 . . . . A 24 TYR C . 31080 1 258 . 1 . 1 24 24 TYR CA C 13 57.388 0.033 . 1 . . . . A 24 TYR CA . 31080 1 259 . 1 . 1 24 24 TYR CB C 13 41.569 0.040 . 1 . . . . A 24 TYR CB . 31080 1 260 . 1 . 1 24 24 TYR CD1 C 13 133.786 0.000 . 1 . . . . A 24 TYR CD1 . 31080 1 261 . 1 . 1 24 24 TYR CD2 C 13 133.786 0.000 . 1 . . . . A 24 TYR CD2 . 31080 1 262 . 1 . 1 24 24 TYR CE1 C 13 117.272 0.000 . 1 . . . . A 24 TYR CE1 . 31080 1 263 . 1 . 1 24 24 TYR CE2 C 13 117.272 0.000 . 1 . . . . A 24 TYR CE2 . 31080 1 264 . 1 . 1 24 24 TYR N N 15 116.583 0.060 . 1 . . . . A 24 TYR N . 31080 1 265 . 1 . 1 25 25 PHE H H 1 9.439 0.026 . 1 . . . . A 25 PHE H . 31080 1 266 . 1 . 1 25 25 PHE HA H 1 5.675 0.010 . 1 . . . . A 25 PHE HA . 31080 1 267 . 1 . 1 25 25 PHE HB2 H 1 2.999 0.000 . 2 . . . . A 25 PHE HB2 . 31080 1 268 . 1 . 1 25 25 PHE HB3 H 1 2.567 0.010 . 2 . . . . A 25 PHE HB3 . 31080 1 269 . 1 . 1 25 25 PHE HD1 H 1 6.937 0.000 . 1 . . . . A 25 PHE HD1 . 31080 1 270 . 1 . 1 25 25 PHE HD2 H 1 6.937 0.000 . 1 . . . . A 25 PHE HD2 . 31080 1 271 . 1 . 1 25 25 PHE HE1 H 1 6.913 0.000 . 1 . . . . A 25 PHE HE1 . 31080 1 272 . 1 . 1 25 25 PHE HE2 H 1 6.913 0.000 . 1 . . . . A 25 PHE HE2 . 31080 1 273 . 1 . 1 25 25 PHE HZ H 1 7.305 0.000 . 1 . . . . A 25 PHE HZ . 31080 1 274 . 1 . 1 25 25 PHE C C 13 172.380 0.003 . 1 . . . . A 25 PHE C . 31080 1 275 . 1 . 1 25 25 PHE CA C 13 55.607 0.023 . 1 . . . . A 25 PHE CA . 31080 1 276 . 1 . 1 25 25 PHE CB C 13 44.553 0.059 . 1 . . . . A 25 PHE CB . 31080 1 277 . 1 . 1 25 25 PHE CD1 C 13 131.538 0.000 . 1 . . . . A 25 PHE CD1 . 31080 1 278 . 1 . 1 25 25 PHE CD2 C 13 131.538 0.000 . 1 . . . . A 25 PHE CD2 . 31080 1 279 . 1 . 1 25 25 PHE N N 15 124.643 0.054 . 1 . . . . A 25 PHE N . 31080 1 280 . 1 . 1 26 26 ASN H H 1 8.234 0.026 . 1 . . . . A 26 ASN H . 31080 1 281 . 1 . 1 26 26 ASN HA H 1 4.287 0.033 . 1 . . . . A 26 ASN HA . 31080 1 282 . 1 . 1 26 26 ASN HB2 H 1 -0.660 0.000 . 2 . . . . A 26 ASN HB2 . 31080 1 283 . 1 . 1 26 26 ASN HB3 H 1 2.035 0.000 . 2 . . . . A 26 ASN HB3 . 31080 1 284 . 1 . 1 26 26 ASN HD21 H 1 6.516 0.005 . 1 . . . . A 26 ASN HD21 . 31080 1 285 . 1 . 1 26 26 ASN HD22 H 1 4.235 0.000 . 1 . . . . A 26 ASN HD22 . 31080 1 286 . 1 . 1 26 26 ASN C C 13 174.613 0.007 . 1 . . . . A 26 ASN C . 31080 1 287 . 1 . 1 26 26 ASN CA C 13 50.546 0.050 . 1 . . . . A 26 ASN CA . 31080 1 288 . 1 . 1 26 26 ASN CB C 13 38.006 0.016 . 1 . . . . A 26 ASN CB . 31080 1 289 . 1 . 1 26 26 ASN N N 15 128.970 0.057 . 1 . . . . A 26 ASN N . 31080 1 290 . 1 . 1 26 26 ASN ND2 N 15 109.403 0.166 . 1 . . . . A 26 ASN ND2 . 31080 1 291 . 1 . 1 27 27 HIS H H 1 8.012 0.024 . 1 . . . . A 27 HIS H . 31080 1 292 . 1 . 1 27 27 HIS HA H 1 4.059 0.005 . 1 . . . . A 27 HIS HA . 31080 1 293 . 1 . 1 27 27 HIS HB2 H 1 3.360 0.006 . 2 . . . . A 27 HIS HB2 . 31080 1 294 . 1 . 1 27 27 HIS HB3 H 1 3.029 0.008 . 2 . . . . A 27 HIS HB3 . 31080 1 295 . 1 . 1 27 27 HIS HD1 H 1 7.020 0.000 . 1 . . . . A 27 HIS HD1 . 31080 1 296 . 1 . 1 27 27 HIS HD2 H 1 7.008 0.000 . 1 . . . . A 27 HIS HD2 . 31080 1 297 . 1 . 1 27 27 HIS C C 13 175.343 0.002 . 1 . . . . A 27 HIS C . 31080 1 298 . 1 . 1 27 27 HIS CA C 13 57.170 0.037 . 1 . . . . A 27 HIS CA . 31080 1 299 . 1 . 1 27 27 HIS CB C 13 28.938 0.036 . 1 . . . . A 27 HIS CB . 31080 1 300 . 1 . 1 27 27 HIS CD2 C 13 120.773 0.000 . 1 . . . . A 27 HIS CD2 . 31080 1 301 . 1 . 1 27 27 HIS N N 15 120.167 0.043 . 1 . . . . A 27 HIS N . 31080 1 302 . 1 . 1 28 28 ILE H H 1 8.276 0.025 . 1 . . . . A 28 ILE H . 31080 1 303 . 1 . 1 28 28 ILE HA H 1 3.856 0.012 . 1 . . . . A 28 ILE HA . 31080 1 304 . 1 . 1 28 28 ILE HB H 1 1.969 0.009 . 1 . . . . A 28 ILE HB . 31080 1 305 . 1 . 1 28 28 ILE HG12 H 1 0.972 0.003 . 2 . . . . A 28 ILE HG12 . 31080 1 306 . 1 . 1 28 28 ILE HG13 H 1 1.255 0.003 . 2 . . . . A 28 ILE HG13 . 31080 1 307 . 1 . 1 28 28 ILE HG21 H 1 0.771 0.002 . 1 . . . . A 28 ILE HG21 . 31080 1 308 . 1 . 1 28 28 ILE HG22 H 1 0.771 0.002 . 1 . . . . A 28 ILE HG22 . 31080 1 309 . 1 . 1 28 28 ILE HG23 H 1 0.771 0.002 . 1 . . . . A 28 ILE HG23 . 31080 1 310 . 1 . 1 28 28 ILE HD11 H 1 0.718 0.011 . 1 . . . . A 28 ILE HD11 . 31080 1 311 . 1 . 1 28 28 ILE HD12 H 1 0.718 0.011 . 1 . . . . A 28 ILE HD12 . 31080 1 312 . 1 . 1 28 28 ILE HD13 H 1 0.718 0.011 . 1 . . . . A 28 ILE HD13 . 31080 1 313 . 1 . 1 28 28 ILE C C 13 177.784 0.005 . 1 . . . . A 28 ILE C . 31080 1 314 . 1 . 1 28 28 ILE CA C 13 63.461 0.054 . 1 . . . . A 28 ILE CA . 31080 1 315 . 1 . 1 28 28 ILE CB C 13 37.142 0.048 . 1 . . . . A 28 ILE CB . 31080 1 316 . 1 . 1 28 28 ILE CG1 C 13 27.880 0.030 . 1 . . . . A 28 ILE CG1 . 31080 1 317 . 1 . 1 28 28 ILE CG2 C 13 17.088 0.024 . 1 . . . . A 28 ILE CG2 . 31080 1 318 . 1 . 1 28 28 ILE CD1 C 13 12.157 0.033 . 1 . . . . A 28 ILE CD1 . 31080 1 319 . 1 . 1 28 28 ILE N N 15 121.942 0.050 . 1 . . . . A 28 ILE N . 31080 1 320 . 1 . 1 29 29 THR H H 1 7.293 0.024 . 1 . . . . A 29 THR H . 31080 1 321 . 1 . 1 29 29 THR HA H 1 4.054 0.009 . 1 . . . . A 29 THR HA . 31080 1 322 . 1 . 1 29 29 THR HB H 1 4.209 0.006 . 1 . . . . A 29 THR HB . 31080 1 323 . 1 . 1 29 29 THR HG21 H 1 0.930 0.010 . 1 . . . . A 29 THR HG21 . 31080 1 324 . 1 . 1 29 29 THR HG22 H 1 0.930 0.010 . 1 . . . . A 29 THR HG22 . 31080 1 325 . 1 . 1 29 29 THR HG23 H 1 0.930 0.010 . 1 . . . . A 29 THR HG23 . 31080 1 326 . 1 . 1 29 29 THR C C 13 175.751 0.002 . 1 . . . . A 29 THR C . 31080 1 327 . 1 . 1 29 29 THR CA C 13 61.346 0.034 . 1 . . . . A 29 THR CA . 31080 1 328 . 1 . 1 29 29 THR CB C 13 69.854 0.060 . 1 . . . . A 29 THR CB . 31080 1 329 . 1 . 1 29 29 THR CG2 C 13 21.306 0.041 . 1 . . . . A 29 THR CG2 . 31080 1 330 . 1 . 1 29 29 THR N N 15 107.883 0.056 . 1 . . . . A 29 THR N . 31080 1 331 . 1 . 1 30 30 ASN H H 1 7.955 0.024 . 1 . . . . A 30 ASN H . 31080 1 332 . 1 . 1 30 30 ASN HA H 1 4.229 0.008 . 1 . . . . A 30 ASN HA . 31080 1 333 . 1 . 1 30 30 ASN HB2 H 1 3.135 0.011 . 2 . . . . A 30 ASN HB2 . 31080 1 334 . 1 . 1 30 30 ASN HB3 H 1 2.856 0.011 . 2 . . . . A 30 ASN HB3 . 31080 1 335 . 1 . 1 30 30 ASN HD21 H 1 7.420 0.028 . 1 . . . . A 30 ASN HD21 . 31080 1 336 . 1 . 1 30 30 ASN HD22 H 1 6.732 0.025 . 1 . . . . A 30 ASN HD22 . 31080 1 337 . 1 . 1 30 30 ASN C C 13 173.088 0.008 . 1 . . . . A 30 ASN C . 31080 1 338 . 1 . 1 30 30 ASN CA C 13 54.981 0.077 . 1 . . . . A 30 ASN CA . 31080 1 339 . 1 . 1 30 30 ASN CB C 13 37.486 0.042 . 1 . . . . A 30 ASN CB . 31080 1 340 . 1 . 1 30 30 ASN N N 15 118.190 0.049 . 1 . . . . A 30 ASN N . 31080 1 341 . 1 . 1 30 30 ASN ND2 N 15 112.050 0.159 . 1 . . . . A 30 ASN ND2 . 31080 1 342 . 1 . 1 31 31 ALA H H 1 7.105 0.025 . 1 . . . . A 31 ALA H . 31080 1 343 . 1 . 1 31 31 ALA HA H 1 4.503 0.010 . 1 . . . . A 31 ALA HA . 31080 1 344 . 1 . 1 31 31 ALA HB1 H 1 1.258 0.007 . 1 . . . . A 31 ALA HB1 . 31080 1 345 . 1 . 1 31 31 ALA HB2 H 1 1.258 0.007 . 1 . . . . A 31 ALA HB2 . 31080 1 346 . 1 . 1 31 31 ALA HB3 H 1 1.258 0.007 . 1 . . . . A 31 ALA HB3 . 31080 1 347 . 1 . 1 31 31 ALA C C 13 175.571 0.002 . 1 . . . . A 31 ALA C . 31080 1 348 . 1 . 1 31 31 ALA CA C 13 52.039 0.025 . 1 . . . . A 31 ALA CA . 31080 1 349 . 1 . 1 31 31 ALA CB C 13 21.047 0.026 . 1 . . . . A 31 ALA CB . 31080 1 350 . 1 . 1 31 31 ALA N N 15 121.244 0.052 . 1 . . . . A 31 ALA N . 31080 1 351 . 1 . 1 32 32 SER H H 1 8.305 0.025 . 1 . . . . A 32 SER H . 31080 1 352 . 1 . 1 32 32 SER HA H 1 6.075 0.017 . 1 . . . . A 32 SER HA . 31080 1 353 . 1 . 1 32 32 SER HB2 H 1 3.994 0.003 . 2 . . . . A 32 SER HB2 . 31080 1 354 . 1 . 1 32 32 SER HB3 H 1 3.915 0.010 . 2 . . . . A 32 SER HB3 . 31080 1 355 . 1 . 1 32 32 SER C C 13 174.034 0.005 . 1 . . . . A 32 SER C . 31080 1 356 . 1 . 1 32 32 SER CA C 13 56.136 0.069 . 1 . . . . A 32 SER CA . 31080 1 357 . 1 . 1 32 32 SER CB C 13 67.251 0.026 . 1 . . . . A 32 SER CB . 31080 1 358 . 1 . 1 32 32 SER N N 15 112.703 0.060 . 1 . . . . A 32 SER N . 31080 1 359 . 1 . 1 33 33 GLN H H 1 9.444 0.025 . 1 . . . . A 33 GLN H . 31080 1 360 . 1 . 1 33 33 GLN HA H 1 4.873 0.013 . 1 . . . . A 33 GLN HA . 31080 1 361 . 1 . 1 33 33 GLN HB2 H 1 2.267 0.021 . 2 . . . . A 33 GLN HB2 . 31080 1 362 . 1 . 1 33 33 GLN HB3 H 1 2.736 0.000 . 2 . . . . A 33 GLN HB3 . 31080 1 363 . 1 . 1 33 33 GLN HG2 H 1 2.553 0.000 . 1 . . . . A 33 GLN HG2 . 31080 1 364 . 1 . 1 33 33 GLN HE21 H 1 7.541 0.000 . 1 . . . . A 33 GLN HE21 . 31080 1 365 . 1 . 1 33 33 GLN HE22 H 1 6.620 0.031 . 1 . . . . A 33 GLN HE22 . 31080 1 366 . 1 . 1 33 33 GLN C C 13 174.571 0.008 . 1 . . . . A 33 GLN C . 31080 1 367 . 1 . 1 33 33 GLN CA C 13 54.638 0.070 . 1 . . . . A 33 GLN CA . 31080 1 368 . 1 . 1 33 33 GLN CB C 13 31.723 0.083 . 1 . . . . A 33 GLN CB . 31080 1 369 . 1 . 1 33 33 GLN CG C 13 31.577 0.000 . 1 . . . . A 33 GLN CG . 31080 1 370 . 1 . 1 33 33 GLN N N 15 115.931 0.061 . 1 . . . . A 33 GLN N . 31080 1 371 . 1 . 1 33 33 GLN NE2 N 15 113.131 0.031 . 1 . . . . A 33 GLN NE2 . 31080 1 372 . 1 . 1 34 34 TRP H H 1 8.853 0.025 . 1 . . . . A 34 TRP H . 31080 1 373 . 1 . 1 34 34 TRP HA H 1 4.949 0.008 . 1 . . . . A 34 TRP HA . 31080 1 374 . 1 . 1 34 34 TRP HB2 H 1 3.552 0.007 . 2 . . . . A 34 TRP HB2 . 31080 1 375 . 1 . 1 34 34 TRP HB3 H 1 3.177 0.005 . 2 . . . . A 34 TRP HB3 . 31080 1 376 . 1 . 1 34 34 TRP HD1 H 1 7.397 0.010 . 1 . . . . A 34 TRP HD1 . 31080 1 377 . 1 . 1 34 34 TRP HE1 H 1 9.600 0.004 . 1 . . . . A 34 TRP HE1 . 31080 1 378 . 1 . 1 34 34 TRP HE3 H 1 8.212 0.000 . 1 . . . . A 34 TRP HE3 . 31080 1 379 . 1 . 1 34 34 TRP HZ2 H 1 7.257 0.000 . 1 . . . . A 34 TRP HZ2 . 31080 1 380 . 1 . 1 34 34 TRP HZ3 H 1 6.848 0.000 . 1 . . . . A 34 TRP HZ3 . 31080 1 381 . 1 . 1 34 34 TRP HH2 H 1 6.941 0.000 . 1 . . . . A 34 TRP HH2 . 31080 1 382 . 1 . 1 34 34 TRP C C 13 177.457 0.005 . 1 . . . . A 34 TRP C . 31080 1 383 . 1 . 1 34 34 TRP CA C 13 59.381 0.069 . 1 . . . . A 34 TRP CA . 31080 1 384 . 1 . 1 34 34 TRP CB C 13 31.072 0.043 . 1 . . . . A 34 TRP CB . 31080 1 385 . 1 . 1 34 34 TRP CD1 C 13 127.782 0.000 . 1 . . . . A 34 TRP CD1 . 31080 1 386 . 1 . 1 34 34 TRP CZ2 C 13 115.701 0.000 . 1 . . . . A 34 TRP CZ2 . 31080 1 387 . 1 . 1 34 34 TRP N N 15 121.555 0.089 . 1 . . . . A 34 TRP N . 31080 1 388 . 1 . 1 34 34 TRP NE1 N 15 128.634 0.010 . 1 . . . . A 34 TRP NE1 . 31080 1 389 . 1 . 1 35 35 GLU H H 1 8.299 0.026 . 1 . . . . A 35 GLU H . 31080 1 390 . 1 . 1 35 35 GLU HA H 1 4.324 0.015 . 1 . . . . A 35 GLU HA . 31080 1 391 . 1 . 1 35 35 GLU HB2 H 1 1.945 0.008 . 2 . . . . A 35 GLU HB2 . 31080 1 392 . 1 . 1 35 35 GLU HB3 H 1 1.847 0.008 . 2 . . . . A 35 GLU HB3 . 31080 1 393 . 1 . 1 35 35 GLU HG2 H 1 2.366 0.000 . 2 . . . . A 35 GLU HG2 . 31080 1 394 . 1 . 1 35 35 GLU HG3 H 1 2.282 0.013 . 2 . . . . A 35 GLU HG3 . 31080 1 395 . 1 . 1 35 35 GLU C C 13 175.872 0.002 . 1 . . . . A 35 GLU C . 31080 1 396 . 1 . 1 35 35 GLU CA C 13 56.466 0.025 . 1 . . . . A 35 GLU CA . 31080 1 397 . 1 . 1 35 35 GLU CB C 13 30.028 0.025 . 1 . . . . A 35 GLU CB . 31080 1 398 . 1 . 1 35 35 GLU CG C 13 36.515 0.011 . 1 . . . . A 35 GLU CG . 31080 1 399 . 1 . 1 35 35 GLU N N 15 117.091 0.066 . 1 . . . . A 35 GLU N . 31080 1 400 . 1 . 1 36 36 ARG H H 1 8.457 0.025 . 1 . . . . A 36 ARG H . 31080 1 401 . 1 . 1 36 36 ARG HA H 1 2.719 0.009 . 1 . . . . A 36 ARG HA . 31080 1 402 . 1 . 1 36 36 ARG HB2 H 1 1.391 0.008 . 1 . . . . A 36 ARG HB2 . 31080 1 403 . 1 . 1 36 36 ARG HG2 H 1 1.197 0.001 . 2 . . . . A 36 ARG HG2 . 31080 1 404 . 1 . 1 36 36 ARG HG3 H 1 0.953 0.001 . 2 . . . . A 36 ARG HG3 . 31080 1 405 . 1 . 1 36 36 ARG HD2 H 1 3.014 0.015 . 2 . . . . A 36 ARG HD2 . 31080 1 406 . 1 . 1 36 36 ARG HD3 H 1 3.180 0.000 . 2 . . . . A 36 ARG HD3 . 31080 1 407 . 1 . 1 36 36 ARG HE H 1 7.222 0.001 . 1 . . . . A 36 ARG HE . 31080 1 408 . 1 . 1 36 36 ARG C C 13 174.638 0.000 . 1 . . . . A 36 ARG C . 31080 1 409 . 1 . 1 36 36 ARG CA C 13 54.148 0.061 . 1 . . . . A 36 ARG CA . 31080 1 410 . 1 . 1 36 36 ARG CB C 13 29.871 0.015 . 1 . . . . A 36 ARG CB . 31080 1 411 . 1 . 1 36 36 ARG CD C 13 43.389 0.050 . 1 . . . . A 36 ARG CD . 31080 1 412 . 1 . 1 36 36 ARG N N 15 125.400 0.098 . 1 . . . . A 36 ARG N . 31080 1 413 . 1 . 1 36 36 ARG NE N 15 85.410 0.147 . 1 . . . . A 36 ARG NE . 31080 1 414 . 1 . 1 37 37 PRO HA H 1 3.865 0.000 . 1 . . . . A 37 PRO HA . 31080 1 415 . 1 . 1 37 37 PRO HB2 H 1 0.807 0.000 . 2 . . . . A 37 PRO HB2 . 31080 1 416 . 1 . 1 37 37 PRO HB3 H 1 0.633 0.000 . 2 . . . . A 37 PRO HB3 . 31080 1 417 . 1 . 1 37 37 PRO HG2 H 1 -0.028 0.006 . 2 . . . . A 37 PRO HG2 . 31080 1 418 . 1 . 1 37 37 PRO HG3 H 1 0.595 0.010 . 2 . . . . A 37 PRO HG3 . 31080 1 419 . 1 . 1 37 37 PRO HD2 H 1 2.503 0.000 . 2 . . . . A 37 PRO HD2 . 31080 1 420 . 1 . 1 37 37 PRO HD3 H 1 2.299 0.000 . 2 . . . . A 37 PRO HD3 . 31080 1 421 . 1 . 1 37 37 PRO C C 13 175.261 0.002 . 1 . . . . A 37 PRO C . 31080 1 422 . 1 . 1 37 37 PRO CA C 13 61.949 0.022 . 1 . . . . A 37 PRO CA . 31080 1 423 . 1 . 1 37 37 PRO CB C 13 31.138 0.044 . 1 . . . . A 37 PRO CB . 31080 1 424 . 1 . 1 37 37 PRO CG C 13 25.823 0.033 . 1 . . . . A 37 PRO CG . 31080 1 425 . 1 . 1 37 37 PRO CD C 13 49.955 0.002 . 1 . . . . A 37 PRO CD . 31080 1 426 . 1 . 1 38 38 SER H H 1 8.051 0.026 . 1 . . . . A 38 SER H . 31080 1 427 . 1 . 1 38 38 SER HA H 1 4.315 0.000 . 1 . . . . A 38 SER HA . 31080 1 428 . 1 . 1 38 38 SER HB2 H 1 3.777 0.027 . 2 . . . . A 38 SER HB2 . 31080 1 429 . 1 . 1 38 38 SER HB3 H 1 3.700 0.010 . 2 . . . . A 38 SER HB3 . 31080 1 430 . 1 . 1 38 38 SER C C 13 174.879 0.013 . 1 . . . . A 38 SER C . 31080 1 431 . 1 . 1 38 38 SER CA C 13 57.661 0.056 . 1 . . . . A 38 SER CA . 31080 1 432 . 1 . 1 38 38 SER CB C 13 64.608 0.025 . 1 . . . . A 38 SER CB . 31080 1 433 . 1 . 1 38 38 SER N N 15 115.227 0.045 . 1 . . . . A 38 SER N . 31080 1 434 . 1 . 1 39 39 GLY H H 1 8.473 0.026 . 1 . . . . A 39 GLY H . 31080 1 435 . 1 . 1 39 39 GLY HA2 H 1 3.959 0.012 . 1 . . . . A 39 GLY HA2 . 31080 1 436 . 1 . 1 39 39 GLY C C 13 173.667 0.002 . 1 . . . . A 39 GLY C . 31080 1 437 . 1 . 1 39 39 GLY CA C 13 45.281 0.053 . 1 . . . . A 39 GLY CA . 31080 1 438 . 1 . 1 39 39 GLY N N 15 110.549 0.058 . 1 . . . . A 39 GLY N . 31080 1 439 . 1 . 1 40 40 ASN H H 1 8.372 0.027 . 1 . . . . A 40 ASN H . 31080 1 440 . 1 . 1 40 40 ASN HA H 1 4.775 0.000 . 1 . . . . A 40 ASN HA . 31080 1 441 . 1 . 1 40 40 ASN HB2 H 1 2.811 0.006 . 2 . . . . A 40 ASN HB2 . 31080 1 442 . 1 . 1 40 40 ASN HB3 H 1 3.081 0.000 . 2 . . . . A 40 ASN HB3 . 31080 1 443 . 1 . 1 40 40 ASN C C 13 175.501 0.001 . 1 . . . . A 40 ASN C . 31080 1 444 . 1 . 1 40 40 ASN CA C 13 53.214 0.059 . 1 . . . . A 40 ASN CA . 31080 1 445 . 1 . 1 40 40 ASN CB C 13 39.082 0.076 . 1 . . . . A 40 ASN CB . 31080 1 446 . 1 . 1 40 40 ASN N N 15 118.648 0.052 . 1 . . . . A 40 ASN N . 31080 1 447 . 1 . 1 41 41 SER H H 1 8.379 0.026 . 1 . . . . A 41 SER H . 31080 1 448 . 1 . 1 41 41 SER HA H 1 4.483 0.016 . 1 . . . . A 41 SER HA . 31080 1 449 . 1 . 1 41 41 SER HB2 H 1 3.933 0.000 . 1 . . . . A 41 SER HB2 . 31080 1 450 . 1 . 1 41 41 SER C C 13 174.771 0.017 . 1 . . . . A 41 SER C . 31080 1 451 . 1 . 1 41 41 SER CA C 13 58.639 0.056 . 1 . . . . A 41 SER CA . 31080 1 452 . 1 . 1 41 41 SER CB C 13 63.790 0.053 . 1 . . . . A 41 SER CB . 31080 1 453 . 1 . 1 41 41 SER N N 15 116.554 0.054 . 1 . . . . A 41 SER N . 31080 1 454 . 1 . 1 42 42 SER H H 1 8.435 0.023 . 1 . . . . A 42 SER H . 31080 1 455 . 1 . 1 42 42 SER HA H 1 4.535 0.010 . 1 . . . . A 42 SER HA . 31080 1 456 . 1 . 1 42 42 SER HB2 H 1 3.926 0.000 . 1 . . . . A 42 SER HB2 . 31080 1 457 . 1 . 1 42 42 SER C C 13 174.791 0.031 . 1 . . . . A 42 SER C . 31080 1 458 . 1 . 1 42 42 SER CA C 13 58.563 0.063 . 1 . . . . A 42 SER CA . 31080 1 459 . 1 . 1 42 42 SER CB C 13 63.811 0.065 . 1 . . . . A 42 SER CB . 31080 1 460 . 1 . 1 42 42 SER N N 15 117.926 0.069 . 1 . . . . A 42 SER N . 31080 1 461 . 1 . 1 43 43 SER H H 1 8.344 0.024 . 1 . . . . A 43 SER H . 31080 1 462 . 1 . 1 43 43 SER HA H 1 4.493 0.006 . 1 . . . . A 43 SER HA . 31080 1 463 . 1 . 1 43 43 SER HB2 H 1 3.919 0.022 . 1 . . . . A 43 SER HB2 . 31080 1 464 . 1 . 1 43 43 SER C C 13 175.069 0.000 . 1 . . . . A 43 SER C . 31080 1 465 . 1 . 1 43 43 SER CA C 13 58.609 0.047 . 1 . . . . A 43 SER CA . 31080 1 466 . 1 . 1 43 43 SER CB C 13 63.866 0.048 . 1 . . . . A 43 SER CB . 31080 1 467 . 1 . 1 43 43 SER N N 15 117.589 0.054 . 1 . . . . A 43 SER N . 31080 1 468 . 1 . 1 44 44 GLY H H 1 8.390 0.024 . 1 . . . . A 44 GLY H . 31080 1 469 . 1 . 1 44 44 GLY HA2 H 1 3.983 0.000 . 1 . . . . A 44 GLY HA2 . 31080 1 470 . 1 . 1 44 44 GLY C C 13 174.638 0.007 . 1 . . . . A 44 GLY C . 31080 1 471 . 1 . 1 44 44 GLY CA C 13 45.498 0.024 . 1 . . . . A 44 GLY CA . 31080 1 472 . 1 . 1 44 44 GLY N N 15 110.707 0.057 . 1 . . . . A 44 GLY N . 31080 1 473 . 1 . 1 45 45 GLY H H 1 8.235 0.029 . 1 . . . . A 45 GLY H . 31080 1 474 . 1 . 1 45 45 GLY HA2 H 1 3.965 0.008 . 1 . . . . A 45 GLY HA2 . 31080 1 475 . 1 . 1 45 45 GLY C C 13 174.399 0.010 . 1 . . . . A 45 GLY C . 31080 1 476 . 1 . 1 45 45 GLY CA C 13 45.258 0.051 . 1 . . . . A 45 GLY CA . 31080 1 477 . 1 . 1 45 45 GLY N N 15 108.639 0.034 . 1 . . . . A 45 GLY N . 31080 1 478 . 1 . 1 46 46 LYS H H 1 8.260 0.026 . 1 . . . . A 46 LYS H . 31080 1 479 . 1 . 1 46 46 LYS HA H 1 4.342 0.026 . 1 . . . . A 46 LYS HA . 31080 1 480 . 1 . 1 46 46 LYS HB2 H 1 1.824 0.021 . 1 . . . . A 46 LYS HB2 . 31080 1 481 . 1 . 1 46 46 LYS HG2 H 1 1.409 0.018 . 1 . . . . A 46 LYS HG2 . 31080 1 482 . 1 . 1 46 46 LYS HD2 H 1 1.704 0.013 . 1 . . . . A 46 LYS HD2 . 31080 1 483 . 1 . 1 46 46 LYS HE2 H 1 2.995 0.001 . 1 . . . . A 46 LYS HE2 . 31080 1 484 . 1 . 1 46 46 LYS C C 13 176.688 0.010 . 1 . . . . A 46 LYS C . 31080 1 485 . 1 . 1 46 46 LYS CA C 13 56.491 0.014 . 1 . . . . A 46 LYS CA . 31080 1 486 . 1 . 1 46 46 LYS CB C 13 32.910 0.056 . 1 . . . . A 46 LYS CB . 31080 1 487 . 1 . 1 46 46 LYS CG C 13 24.662 0.036 . 1 . . . . A 46 LYS CG . 31080 1 488 . 1 . 1 46 46 LYS CD C 13 29.048 0.014 . 1 . . . . A 46 LYS CD . 31080 1 489 . 1 . 1 46 46 LYS CE C 13 42.171 0.053 . 1 . . . . A 46 LYS CE . 31080 1 490 . 1 . 1 46 46 LYS N N 15 120.857 0.089 . 1 . . . . A 46 LYS N . 31080 1 491 . 1 . 1 47 47 ASN H H 1 8.529 0.023 . 1 . . . . A 47 ASN H . 31080 1 492 . 1 . 1 47 47 ASN HA H 1 4.707 0.011 . 1 . . . . A 47 ASN HA . 31080 1 493 . 1 . 1 47 47 ASN HB2 H 1 3.116 0.000 . 2 . . . . A 47 ASN HB2 . 31080 1 494 . 1 . 1 47 47 ASN HB3 H 1 2.859 0.011 . 2 . . . . A 47 ASN HB3 . 31080 1 495 . 1 . 1 47 47 ASN C C 13 175.786 0.001 . 1 . . . . A 47 ASN C . 31080 1 496 . 1 . 1 47 47 ASN CA C 13 53.422 0.069 . 1 . . . . A 47 ASN CA . 31080 1 497 . 1 . 1 47 47 ASN CB C 13 38.894 0.068 . 1 . . . . A 47 ASN CB . 31080 1 498 . 1 . 1 47 47 ASN N N 15 119.298 0.054 . 1 . . . . A 47 ASN N . 31080 1 499 . 1 . 1 48 48 GLY H H 1 8.341 0.028 . 1 . . . . A 48 GLY H . 31080 1 500 . 1 . 1 48 48 GLY HA2 H 1 3.953 0.008 . 1 . . . . A 48 GLY HA2 . 31080 1 501 . 1 . 1 48 48 GLY C C 13 174.293 0.005 . 1 . . . . A 48 GLY C . 31080 1 502 . 1 . 1 48 48 GLY CA C 13 45.648 0.055 . 1 . . . . A 48 GLY CA . 31080 1 503 . 1 . 1 48 48 GLY N N 15 109.219 0.059 . 1 . . . . A 48 GLY N . 31080 1 504 . 1 . 1 49 49 GLN H H 1 8.202 0.027 . 1 . . . . A 49 GLN H . 31080 1 505 . 1 . 1 49 49 GLN HA H 1 4.371 0.009 . 1 . . . . A 49 GLN HA . 31080 1 506 . 1 . 1 49 49 GLN HB2 H 1 2.160 0.013 . 2 . . . . A 49 GLN HB2 . 31080 1 507 . 1 . 1 49 49 GLN HB3 H 1 2.008 0.007 . 2 . . . . A 49 GLN HB3 . 31080 1 508 . 1 . 1 49 49 GLN HG2 H 1 2.360 0.014 . 1 . . . . A 49 GLN HG2 . 31080 1 509 . 1 . 1 49 49 GLN HE21 H 1 7.561 0.026 . 1 . . . . A 49 GLN HE21 . 31080 1 510 . 1 . 1 49 49 GLN HE22 H 1 6.843 0.026 . 1 . . . . A 49 GLN HE22 . 31080 1 511 . 1 . 1 49 49 GLN C C 13 176.457 0.029 . 1 . . . . A 49 GLN C . 31080 1 512 . 1 . 1 49 49 GLN CA C 13 55.990 0.040 . 1 . . . . A 49 GLN CA . 31080 1 513 . 1 . 1 49 49 GLN CB C 13 29.407 0.053 . 1 . . . . A 49 GLN CB . 31080 1 514 . 1 . 1 49 49 GLN CG C 13 33.871 0.035 . 1 . . . . A 49 GLN CG . 31080 1 515 . 1 . 1 49 49 GLN N N 15 119.607 0.048 . 1 . . . . A 49 GLN N . 31080 1 516 . 1 . 1 49 49 GLN NE2 N 15 112.318 0.252 . 1 . . . . A 49 GLN NE2 . 31080 1 517 . 1 . 1 50 50 GLY H H 1 8.429 0.025 . 1 . . . . A 50 GLY H . 31080 1 518 . 1 . 1 50 50 GLY HA2 H 1 3.953 0.008 . 1 . . . . A 50 GLY HA2 . 31080 1 519 . 1 . 1 50 50 GLY C C 13 173.547 0.004 . 1 . . . . A 50 GLY C . 31080 1 520 . 1 . 1 50 50 GLY CA C 13 45.015 0.077 . 1 . . . . A 50 GLY CA . 31080 1 521 . 1 . 1 50 50 GLY N N 15 110.077 0.048 . 1 . . . . A 50 GLY N . 31080 1 522 . 1 . 1 51 51 GLU H H 1 8.216 0.027 . 1 . . . . A 51 GLU H . 31080 1 523 . 1 . 1 51 51 GLU HA H 1 4.659 0.008 . 1 . . . . A 51 GLU HA . 31080 1 524 . 1 . 1 51 51 GLU HB2 H 1 2.039 0.011 . 2 . . . . A 51 GLU HB2 . 31080 1 525 . 1 . 1 51 51 GLU HB3 H 1 2.003 0.003 . 2 . . . . A 51 GLU HB3 . 31080 1 526 . 1 . 1 51 51 GLU HG2 H 1 2.375 0.000 . 1 . . . . A 51 GLU HG2 . 31080 1 527 . 1 . 1 51 51 GLU C C 13 174.291 0.000 . 1 . . . . A 51 GLU C . 31080 1 528 . 1 . 1 51 51 GLU CA C 13 54.256 0.056 . 1 . . . . A 51 GLU CA . 31080 1 529 . 1 . 1 51 51 GLU CB C 13 30.123 0.017 . 1 . . . . A 51 GLU CB . 31080 1 530 . 1 . 1 51 51 GLU N N 15 121.892 0.074 . 1 . . . . A 51 GLU N . 31080 1 531 . 1 . 1 52 52 PRO HA H 1 4.531 0.009 . 1 . . . . A 52 PRO HA . 31080 1 532 . 1 . 1 52 52 PRO HB2 H 1 2.315 0.000 . 2 . . . . A 52 PRO HB2 . 31080 1 533 . 1 . 1 52 52 PRO HB3 H 1 2.015 0.000 . 2 . . . . A 52 PRO HB3 . 31080 1 534 . 1 . 1 52 52 PRO HG2 H 1 1.978 0.000 . 2 . . . . A 52 PRO HG2 . 31080 1 535 . 1 . 1 52 52 PRO HG3 H 1 1.997 0.000 . 2 . . . . A 52 PRO HG3 . 31080 1 536 . 1 . 1 52 52 PRO HD2 H 1 3.831 0.000 . 1 . . . . A 52 PRO HD2 . 31080 1 537 . 1 . 1 52 52 PRO C C 13 176.213 0.001 . 1 . . . . A 52 PRO C . 31080 1 538 . 1 . 1 52 52 PRO CA C 13 62.681 0.066 . 1 . . . . A 52 PRO CA . 31080 1 539 . 1 . 1 52 52 PRO CB C 13 32.196 0.047 . 1 . . . . A 52 PRO CB . 31080 1 540 . 1 . 1 52 52 PRO CG C 13 27.414 0.000 . 1 . . . . A 52 PRO CG . 31080 1 541 . 1 . 1 52 52 PRO CD C 13 50.580 0.000 . 1 . . . . A 52 PRO CD . 31080 1 542 . 1 . 1 53 53 ALA H H 1 8.597 0.024 . 1 . . . . A 53 ALA H . 31080 1 543 . 1 . 1 53 53 ALA HA H 1 4.271 0.009 . 1 . . . . A 53 ALA HA . 31080 1 544 . 1 . 1 53 53 ALA HB1 H 1 1.490 0.006 . 1 . . . . A 53 ALA HB1 . 31080 1 545 . 1 . 1 53 53 ALA HB2 H 1 1.490 0.006 . 1 . . . . A 53 ALA HB2 . 31080 1 546 . 1 . 1 53 53 ALA HB3 H 1 1.490 0.006 . 1 . . . . A 53 ALA HB3 . 31080 1 547 . 1 . 1 53 53 ALA C C 13 177.919 0.005 . 1 . . . . A 53 ALA C . 31080 1 548 . 1 . 1 53 53 ALA CA C 13 53.677 0.039 . 1 . . . . A 53 ALA CA . 31080 1 549 . 1 . 1 53 53 ALA CB C 13 19.317 0.044 . 1 . . . . A 53 ALA CB . 31080 1 550 . 1 . 1 53 53 ALA N N 15 122.921 0.058 . 1 . . . . A 53 ALA N . 31080 1 551 . 1 . 1 54 54 ARG H H 1 7.733 0.025 . 1 . . . . A 54 ARG H . 31080 1 552 . 1 . 1 54 54 ARG HA H 1 5.032 0.011 . 1 . . . . A 54 ARG HA . 31080 1 553 . 1 . 1 54 54 ARG HB2 H 1 1.526 0.000 . 1 . . . . A 54 ARG HB2 . 31080 1 554 . 1 . 1 54 54 ARG HG2 H 1 1.429 0.001 . 1 . . . . A 54 ARG HG2 . 31080 1 555 . 1 . 1 54 54 ARG HD2 H 1 3.000 0.009 . 1 . . . . A 54 ARG HD2 . 31080 1 556 . 1 . 1 54 54 ARG HE H 1 7.175 0.028 . 1 . . . . A 54 ARG HE . 31080 1 557 . 1 . 1 54 54 ARG C C 13 174.558 0.011 . 1 . . . . A 54 ARG C . 31080 1 558 . 1 . 1 54 54 ARG CA C 13 54.542 0.064 . 1 . . . . A 54 ARG CA . 31080 1 559 . 1 . 1 54 54 ARG CB C 13 34.155 0.013 . 1 . . . . A 54 ARG CB . 31080 1 560 . 1 . 1 54 54 ARG CG C 13 26.683 0.012 . 1 . . . . A 54 ARG CG . 31080 1 561 . 1 . 1 54 54 ARG CD C 13 43.773 0.037 . 1 . . . . A 54 ARG CD . 31080 1 562 . 1 . 1 54 54 ARG CZ C 13 159.487 0.000 . 1 . . . . A 54 ARG CZ . 31080 1 563 . 1 . 1 54 54 ARG N N 15 115.854 0.062 . 1 . . . . A 54 ARG N . 31080 1 564 . 1 . 1 54 54 ARG NE N 15 84.234 0.064 . 1 . . . . A 54 ARG NE . 31080 1 565 . 1 . 1 55 55 VAL H H 1 7.893 0.025 . 1 . . . . A 55 VAL H . 31080 1 566 . 1 . 1 55 55 VAL HA H 1 4.335 0.008 . 1 . . . . A 55 VAL HA . 31080 1 567 . 1 . 1 55 55 VAL HB H 1 1.357 0.008 . 1 . . . . A 55 VAL HB . 31080 1 568 . 1 . 1 55 55 VAL HG11 H 1 0.087 0.011 . 2 . . . . A 55 VAL HG11 . 31080 1 569 . 1 . 1 55 55 VAL HG12 H 1 0.087 0.011 . 2 . . . . A 55 VAL HG12 . 31080 1 570 . 1 . 1 55 55 VAL HG13 H 1 0.087 0.011 . 2 . . . . A 55 VAL HG13 . 31080 1 571 . 1 . 1 55 55 VAL HG21 H 1 -0.584 0.010 . 2 . . . . A 55 VAL HG21 . 31080 1 572 . 1 . 1 55 55 VAL HG22 H 1 -0.584 0.010 . 2 . . . . A 55 VAL HG22 . 31080 1 573 . 1 . 1 55 55 VAL HG23 H 1 -0.584 0.010 . 2 . . . . A 55 VAL HG23 . 31080 1 574 . 1 . 1 55 55 VAL C C 13 172.153 0.005 . 1 . . . . A 55 VAL C . 31080 1 575 . 1 . 1 55 55 VAL CA C 13 58.930 0.068 . 1 . . . . A 55 VAL CA . 31080 1 576 . 1 . 1 55 55 VAL CB C 13 35.031 0.055 . 1 . . . . A 55 VAL CB . 31080 1 577 . 1 . 1 55 55 VAL CG1 C 13 20.969 0.000 . 2 . . . . A 55 VAL CG1 . 31080 1 578 . 1 . 1 55 55 VAL CG2 C 13 17.939 0.000 . 2 . . . . A 55 VAL CG2 . 31080 1 579 . 1 . 1 55 55 VAL N N 15 114.037 0.163 . 1 . . . . A 55 VAL N . 31080 1 580 . 1 . 1 56 56 ARG H H 1 8.178 0.028 . 1 . . . . A 56 ARG H . 31080 1 581 . 1 . 1 56 56 ARG HA H 1 4.838 0.016 . 1 . . . . A 56 ARG HA . 31080 1 582 . 1 . 1 56 56 ARG HB2 H 1 1.736 0.002 . 1 . . . . A 56 ARG HB2 . 31080 1 583 . 1 . 1 56 56 ARG HG2 H 1 1.221 0.017 . 2 . . . . A 56 ARG HG2 . 31080 1 584 . 1 . 1 56 56 ARG HG3 H 1 1.391 0.000 . 2 . . . . A 56 ARG HG3 . 31080 1 585 . 1 . 1 56 56 ARG HD2 H 1 2.935 0.000 . 1 . . . . A 56 ARG HD2 . 31080 1 586 . 1 . 1 56 56 ARG HE H 1 7.583 0.004 . 1 . . . . A 56 ARG HE . 31080 1 587 . 1 . 1 56 56 ARG C C 13 175.860 0.014 . 1 . . . . A 56 ARG C . 31080 1 588 . 1 . 1 56 56 ARG CA C 13 54.984 0.055 . 1 . . . . A 56 ARG CA . 31080 1 589 . 1 . 1 56 56 ARG CB C 13 34.277 0.046 . 1 . . . . A 56 ARG CB . 31080 1 590 . 1 . 1 56 56 ARG CG C 13 26.951 0.036 . 1 . . . . A 56 ARG CG . 31080 1 591 . 1 . 1 56 56 ARG CD C 13 44.093 0.000 . 1 . . . . A 56 ARG CD . 31080 1 592 . 1 . 1 56 56 ARG N N 15 121.033 0.068 . 1 . . . . A 56 ARG N . 31080 1 593 . 1 . 1 56 56 ARG NE N 15 84.201 0.041 . 1 . . . . A 56 ARG NE . 31080 1 594 . 1 . 1 57 57 CYS H H 1 7.241 0.028 . 1 . . . . A 57 CYS H . 31080 1 595 . 1 . 1 57 57 CYS HA H 1 5.736 0.011 . 1 . . . . A 57 CYS HA . 31080 1 596 . 1 . 1 57 57 CYS HB2 H 1 3.076 0.035 . 2 . . . . A 57 CYS HB2 . 31080 1 597 . 1 . 1 57 57 CYS HB3 H 1 2.852 0.000 . 2 . . . . A 57 CYS HB3 . 31080 1 598 . 1 . 1 57 57 CYS C C 13 173.088 0.010 . 1 . . . . A 57 CYS C . 31080 1 599 . 1 . 1 57 57 CYS CA C 13 56.090 0.028 . 1 . . . . A 57 CYS CA . 31080 1 600 . 1 . 1 57 57 CYS CB C 13 33.589 0.035 . 1 . . . . A 57 CYS CB . 31080 1 601 . 1 . 1 57 57 CYS N N 15 117.837 0.056 . 1 . . . . A 57 CYS N . 31080 1 602 . 1 . 1 58 58 SER H H 1 9.351 0.023 . 1 . . . . A 58 SER H . 31080 1 603 . 1 . 1 58 58 SER HA H 1 5.884 0.014 . 1 . . . . A 58 SER HA . 31080 1 604 . 1 . 1 58 58 SER HB2 H 1 3.918 0.017 . 2 . . . . A 58 SER HB2 . 31080 1 605 . 1 . 1 58 58 SER HB3 H 1 3.421 0.019 . 2 . . . . A 58 SER HB3 . 31080 1 606 . 1 . 1 58 58 SER C C 13 173.112 0.000 . 1 . . . . A 58 SER C . 31080 1 607 . 1 . 1 58 58 SER CA C 13 56.222 0.036 . 1 . . . . A 58 SER CA . 31080 1 608 . 1 . 1 58 58 SER CB C 13 66.139 0.065 . 1 . . . . A 58 SER CB . 31080 1 609 . 1 . 1 58 58 SER N N 15 116.320 0.059 . 1 . . . . A 58 SER N . 31080 1 610 . 1 . 1 59 59 HIS H H 1 9.706 0.025 . 1 . . . . A 59 HIS H . 31080 1 611 . 1 . 1 59 59 HIS HA H 1 6.211 0.016 . 1 . . . . A 59 HIS HA . 31080 1 612 . 1 . 1 59 59 HIS HB2 H 1 3.233 0.022 . 2 . . . . A 59 HIS HB2 . 31080 1 613 . 1 . 1 59 59 HIS HB3 H 1 3.591 0.011 . 2 . . . . A 59 HIS HB3 . 31080 1 614 . 1 . 1 59 59 HIS HD2 H 1 7.024 0.000 . 1 . . . . A 59 HIS HD2 . 31080 1 615 . 1 . 1 59 59 HIS C C 13 171.774 0.009 . 1 . . . . A 59 HIS C . 31080 1 616 . 1 . 1 59 59 HIS CA C 13 54.546 0.053 . 1 . . . . A 59 HIS CA . 31080 1 617 . 1 . 1 59 59 HIS CB C 13 37.171 0.064 . 1 . . . . A 59 HIS CB . 31080 1 618 . 1 . 1 59 59 HIS CD2 C 13 116.431 0.000 . 1 . . . . A 59 HIS CD2 . 31080 1 619 . 1 . 1 59 59 HIS N N 15 120.266 0.059 . 1 . . . . A 59 HIS N . 31080 1 620 . 1 . 1 60 60 LEU H H 1 8.849 0.027 . 1 . . . . A 60 LEU H . 31080 1 621 . 1 . 1 60 60 LEU HA H 1 3.895 0.000 . 1 . . . . A 60 LEU HA . 31080 1 622 . 1 . 1 60 60 LEU HB2 H 1 1.488 0.004 . 2 . . . . A 60 LEU HB2 . 31080 1 623 . 1 . 1 60 60 LEU HB3 H 1 1.040 0.010 . 2 . . . . A 60 LEU HB3 . 31080 1 624 . 1 . 1 60 60 LEU HG H 1 1.208 0.000 . 1 . . . . A 60 LEU HG . 31080 1 625 . 1 . 1 60 60 LEU HD11 H 1 0.144 0.010 . 2 . . . . A 60 LEU HD11 . 31080 1 626 . 1 . 1 60 60 LEU HD12 H 1 0.144 0.010 . 2 . . . . A 60 LEU HD12 . 31080 1 627 . 1 . 1 60 60 LEU HD13 H 1 0.144 0.010 . 2 . . . . A 60 LEU HD13 . 31080 1 628 . 1 . 1 60 60 LEU HD21 H 1 0.579 0.001 . 2 . . . . A 60 LEU HD21 . 31080 1 629 . 1 . 1 60 60 LEU HD22 H 1 0.579 0.001 . 2 . . . . A 60 LEU HD22 . 31080 1 630 . 1 . 1 60 60 LEU HD23 H 1 0.579 0.001 . 2 . . . . A 60 LEU HD23 . 31080 1 631 . 1 . 1 60 60 LEU C C 13 173.378 0.035 . 1 . . . . A 60 LEU C . 31080 1 632 . 1 . 1 60 60 LEU CA C 13 55.892 0.022 . 1 . . . . A 60 LEU CA . 31080 1 633 . 1 . 1 60 60 LEU CB C 13 45.463 0.049 . 1 . . . . A 60 LEU CB . 31080 1 634 . 1 . 1 60 60 LEU CD1 C 13 26.438 0.000 . 2 . . . . A 60 LEU CD1 . 31080 1 635 . 1 . 1 60 60 LEU CD2 C 13 24.146 0.000 . 2 . . . . A 60 LEU CD2 . 31080 1 636 . 1 . 1 60 60 LEU N N 15 125.094 0.070 . 1 . . . . A 60 LEU N . 31080 1 637 . 1 . 1 61 61 LEU H H 1 8.047 0.028 . 1 . . . . A 61 LEU H . 31080 1 638 . 1 . 1 61 61 LEU HA H 1 4.654 0.000 . 1 . . . . A 61 LEU HA . 31080 1 639 . 1 . 1 61 61 LEU HG H 1 0.978 0.000 . 1 . . . . A 61 LEU HG . 31080 1 640 . 1 . 1 61 61 LEU HD11 H 1 -0.348 0.009 . 2 . . . . A 61 LEU HD11 . 31080 1 641 . 1 . 1 61 61 LEU HD12 H 1 -0.348 0.009 . 2 . . . . A 61 LEU HD12 . 31080 1 642 . 1 . 1 61 61 LEU HD13 H 1 -0.348 0.009 . 2 . . . . A 61 LEU HD13 . 31080 1 643 . 1 . 1 61 61 LEU HD21 H 1 0.707 0.000 . 2 . . . . A 61 LEU HD21 . 31080 1 644 . 1 . 1 61 61 LEU HD22 H 1 0.707 0.000 . 2 . . . . A 61 LEU HD22 . 31080 1 645 . 1 . 1 61 61 LEU HD23 H 1 0.707 0.000 . 2 . . . . A 61 LEU HD23 . 31080 1 646 . 1 . 1 61 61 LEU C C 13 173.914 0.036 . 1 . . . . A 61 LEU C . 31080 1 647 . 1 . 1 61 61 LEU CA C 13 52.519 0.031 . 1 . . . . A 61 LEU CA . 31080 1 648 . 1 . 1 61 61 LEU CB C 13 45.222 0.073 . 1 . . . . A 61 LEU CB . 31080 1 649 . 1 . 1 61 61 LEU CD1 C 13 19.948 0.036 . 2 . . . . A 61 LEU CD1 . 31080 1 650 . 1 . 1 61 61 LEU CD2 C 13 27.135 0.095 . 2 . . . . A 61 LEU CD2 . 31080 1 651 . 1 . 1 61 61 LEU N N 15 127.074 0.110 . 1 . . . . A 61 LEU N . 31080 1 652 . 1 . 1 62 62 VAL H H 1 9.491 0.026 . 1 . . . . A 62 VAL H . 31080 1 653 . 1 . 1 62 62 VAL HA H 1 4.639 0.010 . 1 . . . . A 62 VAL HA . 31080 1 654 . 1 . 1 62 62 VAL HB H 1 1.827 0.013 . 1 . . . . A 62 VAL HB . 31080 1 655 . 1 . 1 62 62 VAL HG11 H 1 1.174 0.010 . 2 . . . . A 62 VAL HG11 . 31080 1 656 . 1 . 1 62 62 VAL HG12 H 1 1.174 0.010 . 2 . . . . A 62 VAL HG12 . 31080 1 657 . 1 . 1 62 62 VAL HG13 H 1 1.174 0.010 . 2 . . . . A 62 VAL HG13 . 31080 1 658 . 1 . 1 62 62 VAL HG21 H 1 0.954 0.013 . 2 . . . . A 62 VAL HG21 . 31080 1 659 . 1 . 1 62 62 VAL HG22 H 1 0.954 0.013 . 2 . . . . A 62 VAL HG22 . 31080 1 660 . 1 . 1 62 62 VAL HG23 H 1 0.954 0.013 . 2 . . . . A 62 VAL HG23 . 31080 1 661 . 1 . 1 62 62 VAL C C 13 176.250 0.014 . 1 . . . . A 62 VAL C . 31080 1 662 . 1 . 1 62 62 VAL CA C 13 61.730 0.037 . 1 . . . . A 62 VAL CA . 31080 1 663 . 1 . 1 62 62 VAL CB C 13 33.162 0.029 . 1 . . . . A 62 VAL CB . 31080 1 664 . 1 . 1 62 62 VAL CG1 C 13 22.495 0.045 . 2 . . . . A 62 VAL CG1 . 31080 1 665 . 1 . 1 62 62 VAL CG2 C 13 21.662 0.046 . 2 . . . . A 62 VAL CG2 . 31080 1 666 . 1 . 1 62 62 VAL N N 15 128.188 0.101 . 1 . . . . A 62 VAL N . 31080 1 667 . 1 . 1 63 63 LYS H H 1 9.128 0.028 . 1 . . . . A 63 LYS H . 31080 1 668 . 1 . 1 63 63 LYS HA H 1 4.167 0.000 . 1 . . . . A 63 LYS HA . 31080 1 669 . 1 . 1 63 63 LYS HB2 H 1 1.652 0.018 . 1 . . . . A 63 LYS HB2 . 31080 1 670 . 1 . 1 63 63 LYS C C 13 174.051 0.007 . 1 . . . . A 63 LYS C . 31080 1 671 . 1 . 1 63 63 LYS CA C 13 56.894 0.048 . 1 . . . . A 63 LYS CA . 31080 1 672 . 1 . 1 63 63 LYS CB C 13 36.497 0.043 . 1 . . . . A 63 LYS CB . 31080 1 673 . 1 . 1 63 63 LYS N N 15 125.374 0.225 . 1 . . . . A 63 LYS N . 31080 1 674 . 1 . 1 64 64 HIS H H 1 8.251 0.029 . 1 . . . . A 64 HIS H . 31080 1 675 . 1 . 1 64 64 HIS HA H 1 4.685 0.010 . 1 . . . . A 64 HIS HA . 31080 1 676 . 1 . 1 64 64 HIS HB2 H 1 3.122 0.010 . 1 . . . . A 64 HIS HB2 . 31080 1 677 . 1 . 1 64 64 HIS HD2 H 1 6.480 0.000 . 1 . . . . A 64 HIS HD2 . 31080 1 678 . 1 . 1 64 64 HIS HE1 H 1 7.493 0.000 . 1 . . . . A 64 HIS HE1 . 31080 1 679 . 1 . 1 64 64 HIS C C 13 176.536 0.006 . 1 . . . . A 64 HIS C . 31080 1 680 . 1 . 1 64 64 HIS CA C 13 54.839 0.050 . 1 . . . . A 64 HIS CA . 31080 1 681 . 1 . 1 64 64 HIS CB C 13 33.725 0.060 . 1 . . . . A 64 HIS CB . 31080 1 682 . 1 . 1 64 64 HIS CD2 C 13 116.160 0.000 . 1 . . . . A 64 HIS CD2 . 31080 1 683 . 1 . 1 64 64 HIS CE1 C 13 139.814 0.000 . 1 . . . . A 64 HIS CE1 . 31080 1 684 . 1 . 1 64 64 HIS N N 15 114.040 0.063 . 1 . . . . A 64 HIS N . 31080 1 685 . 1 . 1 65 65 SER H H 1 9.510 0.024 . 1 . . . . A 65 SER H . 31080 1 686 . 1 . 1 65 65 SER HA H 1 4.137 0.000 . 1 . . . . A 65 SER HA . 31080 1 687 . 1 . 1 65 65 SER HB2 H 1 3.685 0.011 . 2 . . . . A 65 SER HB2 . 31080 1 688 . 1 . 1 65 65 SER HB3 H 1 4.142 0.013 . 2 . . . . A 65 SER HB3 . 31080 1 689 . 1 . 1 65 65 SER C C 13 175.578 0.000 . 1 . . . . A 65 SER C . 31080 1 690 . 1 . 1 65 65 SER CA C 13 61.048 0.115 . 1 . . . . A 65 SER CA . 31080 1 691 . 1 . 1 65 65 SER CB C 13 63.259 0.066 . 1 . . . . A 65 SER CB . 31080 1 692 . 1 . 1 65 65 SER N N 15 113.828 0.064 . 1 . . . . A 65 SER N . 31080 1 693 . 1 . 1 66 66 GLN H H 1 9.184 0.022 . 1 . . . . A 66 GLN H . 31080 1 694 . 1 . 1 66 66 GLN HA H 1 4.693 0.010 . 1 . . . . A 66 GLN HA . 31080 1 695 . 1 . 1 66 66 GLN HB2 H 1 2.629 0.000 . 2 . . . . A 66 GLN HB2 . 31080 1 696 . 1 . 1 66 66 GLN HB3 H 1 2.067 0.000 . 2 . . . . A 66 GLN HB3 . 31080 1 697 . 1 . 1 66 66 GLN HG2 H 1 2.480 0.000 . 1 . . . . A 66 GLN HG2 . 31080 1 698 . 1 . 1 66 66 GLN HE21 H 1 6.906 0.027 . 1 . . . . A 66 GLN HE21 . 31080 1 699 . 1 . 1 66 66 GLN HE22 H 1 7.623 0.025 . 1 . . . . A 66 GLN HE22 . 31080 1 700 . 1 . 1 66 66 GLN C C 13 176.282 0.007 . 1 . . . . A 66 GLN C . 31080 1 701 . 1 . 1 66 66 GLN CA C 13 55.328 0.022 . 1 . . . . A 66 GLN CA . 31080 1 702 . 1 . 1 66 66 GLN CB C 13 29.410 0.055 . 1 . . . . A 66 GLN CB . 31080 1 703 . 1 . 1 66 66 GLN CG C 13 35.104 0.043 . 1 . . . . A 66 GLN CG . 31080 1 704 . 1 . 1 66 66 GLN N N 15 120.521 0.056 . 1 . . . . A 66 GLN N . 31080 1 705 . 1 . 1 66 66 GLN NE2 N 15 112.282 0.167 . 1 . . . . A 66 GLN NE2 . 31080 1 706 . 1 . 1 67 67 SER H H 1 7.845 0.023 . 1 . . . . A 67 SER H . 31080 1 707 . 1 . 1 67 67 SER HA H 1 4.776 0.000 . 1 . . . . A 67 SER HA . 31080 1 708 . 1 . 1 67 67 SER HB2 H 1 3.836 0.000 . 2 . . . . A 67 SER HB2 . 31080 1 709 . 1 . 1 67 67 SER HB3 H 1 3.576 0.000 . 2 . . . . A 67 SER HB3 . 31080 1 710 . 1 . 1 67 67 SER C C 13 176.327 0.046 . 1 . . . . A 67 SER C . 31080 1 711 . 1 . 1 67 67 SER CA C 13 61.800 0.048 . 1 . . . . A 67 SER CA . 31080 1 712 . 1 . 1 67 67 SER CB C 13 63.872 0.043 . 1 . . . . A 67 SER CB . 31080 1 713 . 1 . 1 67 67 SER N N 15 121.424 0.056 . 1 . . . . A 67 SER N . 31080 1 714 . 1 . 1 68 68 ARG H H 1 8.154 0.027 . 1 . . . . A 68 ARG H . 31080 1 715 . 1 . 1 68 68 ARG HA H 1 4.380 0.000 . 1 . . . . A 68 ARG HA . 31080 1 716 . 1 . 1 68 68 ARG HB2 H 1 1.878 0.010 . 1 . . . . A 68 ARG HB2 . 31080 1 717 . 1 . 1 68 68 ARG HD2 H 1 2.561 0.000 . 2 . . . . A 68 ARG HD2 . 31080 1 718 . 1 . 1 68 68 ARG HD3 H 1 2.746 0.000 . 2 . . . . A 68 ARG HD3 . 31080 1 719 . 1 . 1 68 68 ARG HE H 1 6.797 0.000 . 1 . . . . A 68 ARG HE . 31080 1 720 . 1 . 1 68 68 ARG HH21 H 1 6.379 0.000 . 1 . . . . A 68 ARG HH21 . 31080 1 721 . 1 . 1 68 68 ARG C C 13 176.596 0.007 . 1 . . . . A 68 ARG C . 31080 1 722 . 1 . 1 68 68 ARG CA C 13 59.313 0.077 . 1 . . . . A 68 ARG CA . 31080 1 723 . 1 . 1 68 68 ARG CB C 13 29.756 0.013 . 1 . . . . A 68 ARG CB . 31080 1 724 . 1 . 1 68 68 ARG N N 15 122.610 0.142 . 1 . . . . A 68 ARG N . 31080 1 725 . 1 . 1 68 68 ARG NE N 15 85.340 0.000 . 1 . . . . A 68 ARG NE . 31080 1 726 . 1 . 1 69 69 ARG H H 1 8.566 0.028 . 1 . . . . A 69 ARG H . 31080 1 727 . 1 . 1 69 69 ARG HA H 1 4.618 0.000 . 1 . . . . A 69 ARG HA . 31080 1 728 . 1 . 1 69 69 ARG HG2 H 1 1.699 0.000 . 2 . . . . A 69 ARG HG2 . 31080 1 729 . 1 . 1 69 69 ARG HG3 H 1 2.044 0.000 . 2 . . . . A 69 ARG HG3 . 31080 1 730 . 1 . 1 69 69 ARG HD2 H 1 3.174 0.000 . 1 . . . . A 69 ARG HD2 . 31080 1 731 . 1 . 1 69 69 ARG HE H 1 7.744 0.045 . 1 . . . . A 69 ARG HE . 31080 1 732 . 1 . 1 69 69 ARG C C 13 174.250 0.000 . 1 . . . . A 69 ARG C . 31080 1 733 . 1 . 1 69 69 ARG CA C 13 53.148 0.048 . 1 . . . . A 69 ARG CA . 31080 1 734 . 1 . 1 69 69 ARG CB C 13 32.135 0.000 . 1 . . . . A 69 ARG CB . 31080 1 735 . 1 . 1 69 69 ARG CG C 13 26.582 0.000 . 1 . . . . A 69 ARG CG . 31080 1 736 . 1 . 1 69 69 ARG CD C 13 43.562 0.000 . 1 . . . . A 69 ARG CD . 31080 1 737 . 1 . 1 69 69 ARG N N 15 118.024 0.121 . 1 . . . . A 69 ARG N . 31080 1 738 . 1 . 1 69 69 ARG NE N 15 84.933 0.028 . 1 . . . . A 69 ARG NE . 31080 1 739 . 1 . 1 70 70 PRO HA H 1 4.452 0.000 . 1 . . . . A 70 PRO HA . 31080 1 740 . 1 . 1 70 70 PRO HB2 H 1 2.598 0.000 . 2 . . . . A 70 PRO HB2 . 31080 1 741 . 1 . 1 70 70 PRO HB3 H 1 1.978 0.000 . 2 . . . . A 70 PRO HB3 . 31080 1 742 . 1 . 1 70 70 PRO HG2 H 1 1.779 0.000 . 2 . . . . A 70 PRO HG2 . 31080 1 743 . 1 . 1 70 70 PRO HG3 H 1 1.671 0.000 . 2 . . . . A 70 PRO HG3 . 31080 1 744 . 1 . 1 70 70 PRO HD2 H 1 3.031 0.000 . 2 . . . . A 70 PRO HD2 . 31080 1 745 . 1 . 1 70 70 PRO HD3 H 1 3.701 0.000 . 2 . . . . A 70 PRO HD3 . 31080 1 746 . 1 . 1 70 70 PRO C C 13 173.822 0.006 . 1 . . . . A 70 PRO C . 31080 1 747 . 1 . 1 70 70 PRO CA C 13 62.500 0.055 . 1 . . . . A 70 PRO CA . 31080 1 748 . 1 . 1 70 70 PRO CG C 13 27.303 0.067 . 1 . . . . A 70 PRO CG . 31080 1 749 . 1 . 1 70 70 PRO CD C 13 50.370 0.000 . 1 . . . . A 70 PRO CD . 31080 1 750 . 1 . 1 71 71 SER H H 1 9.047 0.027 . 1 . . . . A 71 SER H . 31080 1 751 . 1 . 1 71 71 SER HA H 1 4.429 0.008 . 1 . . . . A 71 SER HA . 31080 1 752 . 1 . 1 71 71 SER HB2 H 1 3.756 0.000 . 2 . . . . A 71 SER HB2 . 31080 1 753 . 1 . 1 71 71 SER HB3 H 1 3.561 0.000 . 2 . . . . A 71 SER HB3 . 31080 1 754 . 1 . 1 71 71 SER C C 13 172.243 0.009 . 1 . . . . A 71 SER C . 31080 1 755 . 1 . 1 71 71 SER CA C 13 58.123 0.058 . 1 . . . . A 71 SER CA . 31080 1 756 . 1 . 1 71 71 SER CB C 13 65.816 0.031 . 1 . . . . A 71 SER CB . 31080 1 757 . 1 . 1 71 71 SER N N 15 121.045 0.054 . 1 . . . . A 71 SER N . 31080 1 758 . 1 . 1 72 72 SER H H 1 8.941 0.026 . 1 . . . . A 72 SER H . 31080 1 759 . 1 . 1 72 72 SER HA H 1 5.045 0.009 . 1 . . . . A 72 SER HA . 31080 1 760 . 1 . 1 72 72 SER HB2 H 1 4.640 0.000 . 2 . . . . A 72 SER HB2 . 31080 1 761 . 1 . 1 72 72 SER HB3 H 1 3.829 0.000 . 2 . . . . A 72 SER HB3 . 31080 1 762 . 1 . 1 72 72 SER C C 13 174.514 0.008 . 1 . . . . A 72 SER C . 31080 1 763 . 1 . 1 72 72 SER CA C 13 56.936 0.043 . 1 . . . . A 72 SER CA . 31080 1 764 . 1 . 1 72 72 SER CB C 13 69.012 0.040 . 1 . . . . A 72 SER CB . 31080 1 765 . 1 . 1 72 72 SER N N 15 118.947 0.119 . 1 . . . . A 72 SER N . 31080 1 766 . 1 . 1 73 73 TRP H H 1 8.614 0.026 . 1 . . . . A 73 TRP H . 31080 1 767 . 1 . 1 73 73 TRP HA H 1 4.384 0.000 . 1 . . . . A 73 TRP HA . 31080 1 768 . 1 . 1 73 73 TRP HB2 H 1 3.577 0.006 . 2 . . . . A 73 TRP HB2 . 31080 1 769 . 1 . 1 73 73 TRP HB3 H 1 3.203 0.000 . 2 . . . . A 73 TRP HB3 . 31080 1 770 . 1 . 1 73 73 TRP HD1 H 1 7.340 0.012 . 1 . . . . A 73 TRP HD1 . 31080 1 771 . 1 . 1 73 73 TRP HE1 H 1 9.963 0.034 . 1 . . . . A 73 TRP HE1 . 31080 1 772 . 1 . 1 73 73 TRP C C 13 176.279 0.007 . 1 . . . . A 73 TRP C . 31080 1 773 . 1 . 1 73 73 TRP CA C 13 58.273 0.051 . 1 . . . . A 73 TRP CA . 31080 1 774 . 1 . 1 73 73 TRP CB C 13 27.143 0.055 . 1 . . . . A 73 TRP CB . 31080 1 775 . 1 . 1 73 73 TRP CD1 C 13 126.075 0.000 . 1 . . . . A 73 TRP CD1 . 31080 1 776 . 1 . 1 73 73 TRP N N 15 118.887 0.048 . 1 . . . . A 73 TRP N . 31080 1 777 . 1 . 1 73 73 TRP NE1 N 15 132.458 0.042 . 1 . . . . A 73 TRP NE1 . 31080 1 778 . 1 . 1 74 74 ARG H H 1 7.022 0.022 . 1 . . . . A 74 ARG H . 31080 1 779 . 1 . 1 74 74 ARG HA H 1 3.541 0.009 . 1 . . . . A 74 ARG HA . 31080 1 780 . 1 . 1 74 74 ARG HB2 H 1 0.955 0.009 . 2 . . . . A 74 ARG HB2 . 31080 1 781 . 1 . 1 74 74 ARG HB3 H 1 0.660 0.000 . 2 . . . . A 74 ARG HB3 . 31080 1 782 . 1 . 1 74 74 ARG HG2 H 1 0.030 0.000 . 2 . . . . A 74 ARG HG2 . 31080 1 783 . 1 . 1 74 74 ARG HG3 H 1 -0.551 0.000 . 2 . . . . A 74 ARG HG3 . 31080 1 784 . 1 . 1 74 74 ARG HD2 H 1 2.672 0.000 . 2 . . . . A 74 ARG HD2 . 31080 1 785 . 1 . 1 74 74 ARG HD3 H 1 2.468 0.000 . 2 . . . . A 74 ARG HD3 . 31080 1 786 . 1 . 1 74 74 ARG HE H 1 6.447 0.001 . 1 . . . . A 74 ARG HE . 31080 1 787 . 1 . 1 74 74 ARG HH21 H 1 6.792 0.000 . 1 . . . . A 74 ARG HH21 . 31080 1 788 . 1 . 1 74 74 ARG C C 13 176.469 0.008 . 1 . . . . A 74 ARG C . 31080 1 789 . 1 . 1 74 74 ARG CA C 13 56.981 0.024 . 1 . . . . A 74 ARG CA . 31080 1 790 . 1 . 1 74 74 ARG CB C 13 30.083 0.017 . 1 . . . . A 74 ARG CB . 31080 1 791 . 1 . 1 74 74 ARG CG C 13 25.912 0.027 . 1 . . . . A 74 ARG CG . 31080 1 792 . 1 . 1 74 74 ARG CD C 13 42.400 0.044 . 1 . . . . A 74 ARG CD . 31080 1 793 . 1 . 1 74 74 ARG N N 15 117.809 0.055 . 1 . . . . A 74 ARG N . 31080 1 794 . 1 . 1 74 74 ARG NE N 15 84.483 0.048 . 1 . . . . A 74 ARG NE . 31080 1 795 . 1 . 1 75 75 GLN H H 1 6.896 0.032 . 1 . . . . A 75 GLN H . 31080 1 796 . 1 . 1 75 75 GLN HA H 1 4.268 0.000 . 1 . . . . A 75 GLN HA . 31080 1 797 . 1 . 1 75 75 GLN HB2 H 1 2.064 0.000 . 2 . . . . A 75 GLN HB2 . 31080 1 798 . 1 . 1 75 75 GLN HB3 H 1 1.717 0.000 . 2 . . . . A 75 GLN HB3 . 31080 1 799 . 1 . 1 75 75 GLN HE21 H 1 6.508 0.027 . 1 . . . . A 75 GLN HE21 . 31080 1 800 . 1 . 1 75 75 GLN HE22 H 1 7.399 0.031 . 1 . . . . A 75 GLN HE22 . 31080 1 801 . 1 . 1 75 75 GLN C C 13 173.215 0.000 . 1 . . . . A 75 GLN C . 31080 1 802 . 1 . 1 75 75 GLN CA C 13 55.817 0.013 . 1 . . . . A 75 GLN CA . 31080 1 803 . 1 . 1 75 75 GLN CB C 13 32.285 0.000 . 1 . . . . A 75 GLN CB . 31080 1 804 . 1 . 1 75 75 GLN N N 15 118.394 0.032 . 1 . . . . A 75 GLN N . 31080 1 805 . 1 . 1 75 75 GLN NE2 N 15 110.851 0.163 . 1 . . . . A 75 GLN NE2 . 31080 1 806 . 1 . 1 76 76 GLU H H 1 8.638 0.000 . 1 . . . . A 76 GLU H . 31080 1 807 . 1 . 1 76 76 GLU C C 13 176.531 0.000 . 1 . . . . A 76 GLU C . 31080 1 808 . 1 . 1 76 76 GLU CA C 13 59.404 0.000 . 1 . . . . A 76 GLU CA . 31080 1 809 . 1 . 1 76 76 GLU CB C 13 29.868 0.000 . 1 . . . . A 76 GLU CB . 31080 1 810 . 1 . 1 77 77 LYS H H 1 7.989 0.027 . 1 . . . . A 77 LYS H . 31080 1 811 . 1 . 1 77 77 LYS HA H 1 4.683 0.018 . 1 . . . . A 77 LYS HA . 31080 1 812 . 1 . 1 77 77 LYS HB2 H 1 1.664 0.000 . 1 . . . . A 77 LYS HB2 . 31080 1 813 . 1 . 1 77 77 LYS HG2 H 1 1.351 0.000 . 2 . . . . A 77 LYS HG2 . 31080 1 814 . 1 . 1 77 77 LYS HG3 H 1 1.217 0.000 . 2 . . . . A 77 LYS HG3 . 31080 1 815 . 1 . 1 77 77 LYS HE2 H 1 2.957 0.000 . 1 . . . . A 77 LYS HE2 . 31080 1 816 . 1 . 1 77 77 LYS C C 13 174.455 0.003 . 1 . . . . A 77 LYS C . 31080 1 817 . 1 . 1 77 77 LYS CA C 13 55.307 0.023 . 1 . . . . A 77 LYS CA . 31080 1 818 . 1 . 1 77 77 LYS CB C 13 33.995 0.075 . 1 . . . . A 77 LYS CB . 31080 1 819 . 1 . 1 77 77 LYS CG C 13 24.651 0.006 . 1 . . . . A 77 LYS CG . 31080 1 820 . 1 . 1 77 77 LYS CD C 13 29.153 0.000 . 1 . . . . A 77 LYS CD . 31080 1 821 . 1 . 1 77 77 LYS N N 15 117.869 0.068 . 1 . . . . A 77 LYS N . 31080 1 822 . 1 . 1 78 78 ILE H H 1 7.835 0.026 . 1 . . . . A 78 ILE H . 31080 1 823 . 1 . 1 78 78 ILE HA H 1 3.861 0.007 . 1 . . . . A 78 ILE HA . 31080 1 824 . 1 . 1 78 78 ILE HB H 1 1.252 0.006 . 1 . . . . A 78 ILE HB . 31080 1 825 . 1 . 1 78 78 ILE HG12 H 1 1.117 0.016 . 1 . . . . A 78 ILE HG12 . 31080 1 826 . 1 . 1 78 78 ILE HG21 H 1 0.546 0.011 . 1 . . . . A 78 ILE HG21 . 31080 1 827 . 1 . 1 78 78 ILE HG22 H 1 0.546 0.011 . 1 . . . . A 78 ILE HG22 . 31080 1 828 . 1 . 1 78 78 ILE HG23 H 1 0.546 0.011 . 1 . . . . A 78 ILE HG23 . 31080 1 829 . 1 . 1 78 78 ILE HD11 H 1 0.673 0.008 . 1 . . . . A 78 ILE HD11 . 31080 1 830 . 1 . 1 78 78 ILE HD12 H 1 0.673 0.008 . 1 . . . . A 78 ILE HD12 . 31080 1 831 . 1 . 1 78 78 ILE HD13 H 1 0.673 0.008 . 1 . . . . A 78 ILE HD13 . 31080 1 832 . 1 . 1 78 78 ILE C C 13 175.554 0.000 . 1 . . . . A 78 ILE C . 31080 1 833 . 1 . 1 78 78 ILE CA C 13 60.966 0.067 . 1 . . . . A 78 ILE CA . 31080 1 834 . 1 . 1 78 78 ILE CB C 13 37.451 0.025 . 1 . . . . A 78 ILE CB . 31080 1 835 . 1 . 1 78 78 ILE CG2 C 13 16.506 0.024 . 1 . . . . A 78 ILE CG2 . 31080 1 836 . 1 . 1 78 78 ILE CD1 C 13 12.764 0.031 . 1 . . . . A 78 ILE CD1 . 31080 1 837 . 1 . 1 78 78 ILE N N 15 126.255 0.074 . 1 . . . . A 78 ILE N . 31080 1 838 . 1 . 1 79 79 THR H H 1 8.166 0.026 . 1 . . . . A 79 THR H . 31080 1 839 . 1 . 1 79 79 THR HA H 1 4.362 0.000 . 1 . . . . A 79 THR HA . 31080 1 840 . 1 . 1 79 79 THR HB H 1 4.423 0.011 . 1 . . . . A 79 THR HB . 31080 1 841 . 1 . 1 79 79 THR HG21 H 1 1.071 0.000 . 1 . . . . A 79 THR HG21 . 31080 1 842 . 1 . 1 79 79 THR HG22 H 1 1.071 0.000 . 1 . . . . A 79 THR HG22 . 31080 1 843 . 1 . 1 79 79 THR HG23 H 1 1.071 0.000 . 1 . . . . A 79 THR HG23 . 31080 1 844 . 1 . 1 79 79 THR C C 13 175.228 0.008 . 1 . . . . A 79 THR C . 31080 1 845 . 1 . 1 79 79 THR CA C 13 60.846 0.063 . 1 . . . . A 79 THR CA . 31080 1 846 . 1 . 1 79 79 THR CB C 13 69.930 0.017 . 1 . . . . A 79 THR CB . 31080 1 847 . 1 . 1 79 79 THR CG2 C 13 21.272 0.028 . 1 . . . . A 79 THR CG2 . 31080 1 848 . 1 . 1 79 79 THR N N 15 116.450 0.076 . 1 . . . . A 79 THR N . 31080 1 849 . 1 . 1 80 80 ARG H H 1 7.541 0.026 . 1 . . . . A 80 ARG H . 31080 1 850 . 1 . 1 80 80 ARG HA H 1 4.607 0.005 . 1 . . . . A 80 ARG HA . 31080 1 851 . 1 . 1 80 80 ARG HB2 H 1 1.988 0.017 . 1 . . . . A 80 ARG HB2 . 31080 1 852 . 1 . 1 80 80 ARG HG2 H 1 1.450 0.000 . 2 . . . . A 80 ARG HG2 . 31080 1 853 . 1 . 1 80 80 ARG HG3 H 1 1.633 0.000 . 2 . . . . A 80 ARG HG3 . 31080 1 854 . 1 . 1 80 80 ARG HE H 1 7.510 0.001 . 1 . . . . A 80 ARG HE . 31080 1 855 . 1 . 1 80 80 ARG C C 13 174.538 0.009 . 1 . . . . A 80 ARG C . 31080 1 856 . 1 . 1 80 80 ARG CA C 13 55.761 0.035 . 1 . . . . A 80 ARG CA . 31080 1 857 . 1 . 1 80 80 ARG CB C 13 30.886 0.033 . 1 . . . . A 80 ARG CB . 31080 1 858 . 1 . 1 80 80 ARG CG C 13 27.975 0.012 . 1 . . . . A 80 ARG CG . 31080 1 859 . 1 . 1 80 80 ARG CD C 13 43.533 0.000 . 1 . . . . A 80 ARG CD . 31080 1 860 . 1 . 1 80 80 ARG N N 15 123.953 0.082 . 1 . . . . A 80 ARG N . 31080 1 861 . 1 . 1 80 80 ARG NE N 15 81.113 0.074 . 1 . . . . A 80 ARG NE . 31080 1 862 . 1 . 1 81 81 THR H H 1 9.000 0.027 . 1 . . . . A 81 THR H . 31080 1 863 . 1 . 1 81 81 THR HA H 1 4.601 0.007 . 1 . . . . A 81 THR HA . 31080 1 864 . 1 . 1 81 81 THR HB H 1 4.851 0.034 . 1 . . . . A 81 THR HB . 31080 1 865 . 1 . 1 81 81 THR HG21 H 1 1.423 0.000 . 1 . . . . A 81 THR HG21 . 31080 1 866 . 1 . 1 81 81 THR HG22 H 1 1.423 0.000 . 1 . . . . A 81 THR HG22 . 31080 1 867 . 1 . 1 81 81 THR HG23 H 1 1.423 0.000 . 1 . . . . A 81 THR HG23 . 31080 1 868 . 1 . 1 81 81 THR C C 13 176.367 0.009 . 1 . . . . A 81 THR C . 31080 1 869 . 1 . 1 81 81 THR CA C 13 61.026 0.062 . 1 . . . . A 81 THR CA . 31080 1 870 . 1 . 1 81 81 THR CB C 13 71.687 0.020 . 1 . . . . A 81 THR CB . 31080 1 871 . 1 . 1 81 81 THR CG2 C 13 22.042 0.031 . 1 . . . . A 81 THR CG2 . 31080 1 872 . 1 . 1 81 81 THR N N 15 113.720 0.074 . 1 . . . . A 81 THR N . 31080 1 873 . 1 . 1 82 82 LYS H H 1 8.871 0.028 . 1 . . . . A 82 LYS H . 31080 1 874 . 1 . 1 82 82 LYS HA H 1 3.423 0.012 . 1 . . . . A 82 LYS HA . 31080 1 875 . 1 . 1 82 82 LYS HB2 H 1 1.375 0.000 . 2 . . . . A 82 LYS HB2 . 31080 1 876 . 1 . 1 82 82 LYS HB3 H 1 1.107 0.000 . 2 . . . . A 82 LYS HB3 . 31080 1 877 . 1 . 1 82 82 LYS HG2 H 1 0.742 0.000 . 2 . . . . A 82 LYS HG2 . 31080 1 878 . 1 . 1 82 82 LYS HG3 H 1 1.052 0.000 . 2 . . . . A 82 LYS HG3 . 31080 1 879 . 1 . 1 82 82 LYS HD2 H 1 1.484 0.000 . 1 . . . . A 82 LYS HD2 . 31080 1 880 . 1 . 1 82 82 LYS HE2 H 1 2.811 0.000 . 1 . . . . A 82 LYS HE2 . 31080 1 881 . 1 . 1 82 82 LYS C C 13 177.710 0.003 . 1 . . . . A 82 LYS C . 31080 1 882 . 1 . 1 82 82 LYS CA C 13 60.459 0.051 . 1 . . . . A 82 LYS CA . 31080 1 883 . 1 . 1 82 82 LYS CB C 13 32.038 0.022 . 1 . . . . A 82 LYS CB . 31080 1 884 . 1 . 1 82 82 LYS CG C 13 24.578 0.071 . 1 . . . . A 82 LYS CG . 31080 1 885 . 1 . 1 82 82 LYS CD C 13 29.768 0.000 . 1 . . . . A 82 LYS CD . 31080 1 886 . 1 . 1 82 82 LYS CE C 13 41.810 0.044 . 1 . . . . A 82 LYS CE . 31080 1 887 . 1 . 1 82 82 LYS N N 15 122.598 0.054 . 1 . . . . A 82 LYS N . 31080 1 888 . 1 . 1 83 83 GLU H H 1 8.520 0.025 . 1 . . . . A 83 GLU H . 31080 1 889 . 1 . 1 83 83 GLU HA H 1 3.898 0.006 . 1 . . . . A 83 GLU HA . 31080 1 890 . 1 . 1 83 83 GLU HB2 H 1 1.902 0.009 . 2 . . . . A 83 GLU HB2 . 31080 1 891 . 1 . 1 83 83 GLU HB3 H 1 2.054 0.018 . 2 . . . . A 83 GLU HB3 . 31080 1 892 . 1 . 1 83 83 GLU HG2 H 1 2.457 0.000 . 2 . . . . A 83 GLU HG2 . 31080 1 893 . 1 . 1 83 83 GLU HG3 H 1 2.212 0.003 . 2 . . . . A 83 GLU HG3 . 31080 1 894 . 1 . 1 83 83 GLU C C 13 179.763 0.001 . 1 . . . . A 83 GLU C . 31080 1 895 . 1 . 1 83 83 GLU CA C 13 60.850 0.060 . 1 . . . . A 83 GLU CA . 31080 1 896 . 1 . 1 83 83 GLU CB C 13 28.659 0.045 . 1 . . . . A 83 GLU CB . 31080 1 897 . 1 . 1 83 83 GLU CG C 13 37.394 0.000 . 1 . . . . A 83 GLU CG . 31080 1 898 . 1 . 1 83 83 GLU N N 15 118.267 0.106 . 1 . . . . A 83 GLU N . 31080 1 899 . 1 . 1 84 84 GLU H H 1 7.923 0.022 . 1 . . . . A 84 GLU H . 31080 1 900 . 1 . 1 84 84 GLU HA H 1 3.961 0.003 . 1 . . . . A 84 GLU HA . 31080 1 901 . 1 . 1 84 84 GLU HB2 H 1 1.898 0.015 . 1 . . . . A 84 GLU HB2 . 31080 1 902 . 1 . 1 84 84 GLU C C 13 179.865 0.009 . 1 . . . . A 84 GLU C . 31080 1 903 . 1 . 1 84 84 GLU CA C 13 59.053 0.031 . 1 . . . . A 84 GLU CA . 31080 1 904 . 1 . 1 84 84 GLU CB C 13 30.104 0.052 . 1 . . . . A 84 GLU CB . 31080 1 905 . 1 . 1 84 84 GLU CG C 13 37.599 0.000 . 1 . . . . A 84 GLU CG . 31080 1 906 . 1 . 1 84 84 GLU N N 15 121.750 0.053 . 1 . . . . A 84 GLU N . 31080 1 907 . 1 . 1 85 85 ALA H H 1 8.639 0.025 . 1 . . . . A 85 ALA H . 31080 1 908 . 1 . 1 85 85 ALA HA H 1 3.982 0.009 . 1 . . . . A 85 ALA HA . 31080 1 909 . 1 . 1 85 85 ALA HB1 H 1 1.424 0.012 . 1 . . . . A 85 ALA HB1 . 31080 1 910 . 1 . 1 85 85 ALA HB2 H 1 1.424 0.012 . 1 . . . . A 85 ALA HB2 . 31080 1 911 . 1 . 1 85 85 ALA HB3 H 1 1.424 0.012 . 1 . . . . A 85 ALA HB3 . 31080 1 912 . 1 . 1 85 85 ALA C C 13 177.922 0.006 . 1 . . . . A 85 ALA C . 31080 1 913 . 1 . 1 85 85 ALA CA C 13 55.056 0.023 . 1 . . . . A 85 ALA CA . 31080 1 914 . 1 . 1 85 85 ALA CB C 13 18.847 0.085 . 1 . . . . A 85 ALA CB . 31080 1 915 . 1 . 1 85 85 ALA N N 15 122.063 0.057 . 1 . . . . A 85 ALA N . 31080 1 916 . 1 . 1 86 86 LEU H H 1 8.160 0.027 . 1 . . . . A 86 LEU H . 31080 1 917 . 1 . 1 86 86 LEU HA H 1 3.884 0.012 . 1 . . . . A 86 LEU HA . 31080 1 918 . 1 . 1 86 86 LEU HB2 H 1 2.010 0.000 . 2 . . . . A 86 LEU HB2 . 31080 1 919 . 1 . 1 86 86 LEU HB3 H 1 1.684 0.000 . 2 . . . . A 86 LEU HB3 . 31080 1 920 . 1 . 1 86 86 LEU HG H 1 1.452 0.000 . 1 . . . . A 86 LEU HG . 31080 1 921 . 1 . 1 86 86 LEU HD11 H 1 1.081 0.004 . 2 . . . . A 86 LEU HD11 . 31080 1 922 . 1 . 1 86 86 LEU HD12 H 1 1.081 0.004 . 2 . . . . A 86 LEU HD12 . 31080 1 923 . 1 . 1 86 86 LEU HD13 H 1 1.081 0.004 . 2 . . . . A 86 LEU HD13 . 31080 1 924 . 1 . 1 86 86 LEU HD21 H 1 1.014 0.011 . 2 . . . . A 86 LEU HD21 . 31080 1 925 . 1 . 1 86 86 LEU HD22 H 1 1.014 0.011 . 2 . . . . A 86 LEU HD22 . 31080 1 926 . 1 . 1 86 86 LEU HD23 H 1 1.014 0.011 . 2 . . . . A 86 LEU HD23 . 31080 1 927 . 1 . 1 86 86 LEU C C 13 177.753 0.018 . 1 . . . . A 86 LEU C . 31080 1 928 . 1 . 1 86 86 LEU CA C 13 57.494 0.036 . 1 . . . . A 86 LEU CA . 31080 1 929 . 1 . 1 86 86 LEU CB C 13 41.450 0.020 . 1 . . . . A 86 LEU CB . 31080 1 930 . 1 . 1 86 86 LEU CG C 13 26.977 0.000 . 1 . . . . A 86 LEU CG . 31080 1 931 . 1 . 1 86 86 LEU CD1 C 13 25.743 0.011 . 2 . . . . A 86 LEU CD1 . 31080 1 932 . 1 . 1 86 86 LEU CD2 C 13 22.949 0.000 . 2 . . . . A 86 LEU CD2 . 31080 1 933 . 1 . 1 86 86 LEU N N 15 120.160 0.065 . 1 . . . . A 86 LEU N . 31080 1 934 . 1 . 1 87 87 GLU H H 1 7.671 0.026 . 1 . . . . A 87 GLU H . 31080 1 935 . 1 . 1 87 87 GLU HA H 1 4.027 0.010 . 1 . . . . A 87 GLU HA . 31080 1 936 . 1 . 1 87 87 GLU HB2 H 1 2.297 0.000 . 2 . . . . A 87 GLU HB2 . 31080 1 937 . 1 . 1 87 87 GLU HB3 H 1 2.057 0.000 . 2 . . . . A 87 GLU HB3 . 31080 1 938 . 1 . 1 87 87 GLU C C 13 180.290 0.002 . 1 . . . . A 87 GLU C . 31080 1 939 . 1 . 1 87 87 GLU CA C 13 59.496 0.059 . 1 . . . . A 87 GLU CA . 31080 1 940 . 1 . 1 87 87 GLU CB C 13 29.262 0.060 . 1 . . . . A 87 GLU CB . 31080 1 941 . 1 . 1 87 87 GLU CG C 13 36.073 0.000 . 1 . . . . A 87 GLU CG . 31080 1 942 . 1 . 1 87 87 GLU N N 15 119.312 0.105 . 1 . . . . A 87 GLU N . 31080 1 943 . 1 . 1 88 88 LEU H H 1 7.753 0.025 . 1 . . . . A 88 LEU H . 31080 1 944 . 1 . 1 88 88 LEU HA H 1 3.610 0.012 . 1 . . . . A 88 LEU HA . 31080 1 945 . 1 . 1 88 88 LEU HB2 H 1 0.984 0.010 . 2 . . . . A 88 LEU HB2 . 31080 1 946 . 1 . 1 88 88 LEU HB3 H 1 1.936 0.000 . 2 . . . . A 88 LEU HB3 . 31080 1 947 . 1 . 1 88 88 LEU HG H 1 1.534 0.010 . 1 . . . . A 88 LEU HG . 31080 1 948 . 1 . 1 88 88 LEU HD11 H 1 0.817 0.000 . 2 . . . . A 88 LEU HD11 . 31080 1 949 . 1 . 1 88 88 LEU HD12 H 1 0.817 0.000 . 2 . . . . A 88 LEU HD12 . 31080 1 950 . 1 . 1 88 88 LEU HD13 H 1 0.817 0.000 . 2 . . . . A 88 LEU HD13 . 31080 1 951 . 1 . 1 88 88 LEU HD21 H 1 0.651 0.002 . 2 . . . . A 88 LEU HD21 . 31080 1 952 . 1 . 1 88 88 LEU HD22 H 1 0.651 0.002 . 2 . . . . A 88 LEU HD22 . 31080 1 953 . 1 . 1 88 88 LEU HD23 H 1 0.651 0.002 . 2 . . . . A 88 LEU HD23 . 31080 1 954 . 1 . 1 88 88 LEU C C 13 178.541 0.017 . 1 . . . . A 88 LEU C . 31080 1 955 . 1 . 1 88 88 LEU CA C 13 57.687 0.058 . 1 . . . . A 88 LEU CA . 31080 1 956 . 1 . 1 88 88 LEU CB C 13 41.556 0.029 . 1 . . . . A 88 LEU CB . 31080 1 957 . 1 . 1 88 88 LEU CD1 C 13 25.328 0.003 . 2 . . . . A 88 LEU CD1 . 31080 1 958 . 1 . 1 88 88 LEU CD2 C 13 22.642 0.000 . 2 . . . . A 88 LEU CD2 . 31080 1 959 . 1 . 1 88 88 LEU N N 15 121.289 0.067 . 1 . . . . A 88 LEU N . 31080 1 960 . 1 . 1 89 89 ILE H H 1 8.016 0.029 . 1 . . . . A 89 ILE H . 31080 1 961 . 1 . 1 89 89 ILE HA H 1 3.632 0.018 . 1 . . . . A 89 ILE HA . 31080 1 962 . 1 . 1 89 89 ILE HB H 1 2.288 0.005 . 1 . . . . A 89 ILE HB . 31080 1 963 . 1 . 1 89 89 ILE HG12 H 1 1.520 0.000 . 2 . . . . A 89 ILE HG12 . 31080 1 964 . 1 . 1 89 89 ILE HG13 H 1 1.198 0.002 . 2 . . . . A 89 ILE HG13 . 31080 1 965 . 1 . 1 89 89 ILE HG21 H 1 0.788 0.002 . 1 . . . . A 89 ILE HG21 . 31080 1 966 . 1 . 1 89 89 ILE HG22 H 1 0.788 0.002 . 1 . . . . A 89 ILE HG22 . 31080 1 967 . 1 . 1 89 89 ILE HG23 H 1 0.788 0.002 . 1 . . . . A 89 ILE HG23 . 31080 1 968 . 1 . 1 89 89 ILE HD11 H 1 0.715 0.001 . 1 . . . . A 89 ILE HD11 . 31080 1 969 . 1 . 1 89 89 ILE HD12 H 1 0.715 0.001 . 1 . . . . A 89 ILE HD12 . 31080 1 970 . 1 . 1 89 89 ILE HD13 H 1 0.715 0.001 . 1 . . . . A 89 ILE HD13 . 31080 1 971 . 1 . 1 89 89 ILE C C 13 177.406 0.002 . 1 . . . . A 89 ILE C . 31080 1 972 . 1 . 1 89 89 ILE CA C 13 62.567 0.077 . 1 . . . . A 89 ILE CA . 31080 1 973 . 1 . 1 89 89 ILE CB C 13 35.394 0.036 . 1 . . . . A 89 ILE CB . 31080 1 974 . 1 . 1 89 89 ILE CG1 C 13 27.103 0.111 . 1 . . . . A 89 ILE CG1 . 31080 1 975 . 1 . 1 89 89 ILE CG2 C 13 16.429 0.009 . 1 . . . . A 89 ILE CG2 . 31080 1 976 . 1 . 1 89 89 ILE CD1 C 13 10.500 0.000 . 1 . . . . A 89 ILE CD1 . 31080 1 977 . 1 . 1 89 89 ILE N N 15 120.230 0.056 . 1 . . . . A 89 ILE N . 31080 1 978 . 1 . 1 90 90 ASN H H 1 8.689 0.024 . 1 . . . . A 90 ASN H . 31080 1 979 . 1 . 1 90 90 ASN HA H 1 4.514 0.011 . 1 . . . . A 90 ASN HA . 31080 1 980 . 1 . 1 90 90 ASN HB2 H 1 2.760 0.000 . 2 . . . . A 90 ASN HB2 . 31080 1 981 . 1 . 1 90 90 ASN HB3 H 1 2.650 0.000 . 2 . . . . A 90 ASN HB3 . 31080 1 982 . 1 . 1 90 90 ASN HD21 H 1 7.248 0.029 . 1 . . . . A 90 ASN HD21 . 31080 1 983 . 1 . 1 90 90 ASN HD22 H 1 6.565 0.003 . 1 . . . . A 90 ASN HD22 . 31080 1 984 . 1 . 1 90 90 ASN C C 13 179.073 0.005 . 1 . . . . A 90 ASN C . 31080 1 985 . 1 . 1 90 90 ASN CA C 13 56.016 0.049 . 1 . . . . A 90 ASN CA . 31080 1 986 . 1 . 1 90 90 ASN CB C 13 37.649 0.057 . 1 . . . . A 90 ASN CB . 31080 1 987 . 1 . 1 90 90 ASN N N 15 118.894 0.058 . 1 . . . . A 90 ASN N . 31080 1 988 . 1 . 1 90 90 ASN ND2 N 15 109.638 0.173 . 1 . . . . A 90 ASN ND2 . 31080 1 989 . 1 . 1 91 91 GLY H H 1 7.941 0.027 . 1 . . . . A 91 GLY H . 31080 1 990 . 1 . 1 91 91 GLY HA2 H 1 3.854 0.010 . 1 . . . . A 91 GLY HA2 . 31080 1 991 . 1 . 1 91 91 GLY C C 13 176.735 0.005 . 1 . . . . A 91 GLY C . 31080 1 992 . 1 . 1 91 91 GLY CA C 13 47.051 0.039 . 1 . . . . A 91 GLY CA . 31080 1 993 . 1 . 1 91 91 GLY N N 15 110.131 0.058 . 1 . . . . A 91 GLY N . 31080 1 994 . 1 . 1 92 92 TYR H H 1 8.109 0.024 . 1 . . . . A 92 TYR H . 31080 1 995 . 1 . 1 92 92 TYR HA H 1 4.428 0.000 . 1 . . . . A 92 TYR HA . 31080 1 996 . 1 . 1 92 92 TYR HB2 H 1 3.157 0.028 . 2 . . . . A 92 TYR HB2 . 31080 1 997 . 1 . 1 92 92 TYR HB3 H 1 2.848 0.016 . 2 . . . . A 92 TYR HB3 . 31080 1 998 . 1 . 1 92 92 TYR HD1 H 1 6.604 0.000 . 1 . . . . A 92 TYR HD1 . 31080 1 999 . 1 . 1 92 92 TYR HD2 H 1 6.604 0.000 . 1 . . . . A 92 TYR HD2 . 31080 1 1000 . 1 . 1 92 92 TYR HE1 H 1 6.132 0.000 . 1 . . . . A 92 TYR HE1 . 31080 1 1001 . 1 . 1 92 92 TYR HE2 H 1 6.132 0.000 . 1 . . . . A 92 TYR HE2 . 31080 1 1002 . 1 . 1 92 92 TYR C C 13 178.109 0.004 . 1 . . . . A 92 TYR C . 31080 1 1003 . 1 . 1 92 92 TYR CA C 13 58.609 0.073 . 1 . . . . A 92 TYR CA . 31080 1 1004 . 1 . 1 92 92 TYR CB C 13 35.941 0.044 . 1 . . . . A 92 TYR CB . 31080 1 1005 . 1 . 1 92 92 TYR CD1 C 13 131.254 0.000 . 1 . . . . A 92 TYR CD1 . 31080 1 1006 . 1 . 1 92 92 TYR CD2 C 13 131.254 0.000 . 1 . . . . A 92 TYR CD2 . 31080 1 1007 . 1 . 1 92 92 TYR CE1 C 13 117.196 0.000 . 1 . . . . A 92 TYR CE1 . 31080 1 1008 . 1 . 1 92 92 TYR CE2 C 13 117.196 0.000 . 1 . . . . A 92 TYR CE2 . 31080 1 1009 . 1 . 1 92 92 TYR N N 15 123.155 0.065 . 1 . . . . A 92 TYR N . 31080 1 1010 . 1 . 1 93 93 ILE H H 1 8.603 0.024 . 1 . . . . A 93 ILE H . 31080 1 1011 . 1 . 1 93 93 ILE HA H 1 3.526 0.009 . 1 . . . . A 93 ILE HA . 31080 1 1012 . 1 . 1 93 93 ILE HB H 1 2.068 0.010 . 1 . . . . A 93 ILE HB . 31080 1 1013 . 1 . 1 93 93 ILE HG21 H 1 0.981 0.011 . 1 . . . . A 93 ILE HG21 . 31080 1 1014 . 1 . 1 93 93 ILE HG22 H 1 0.981 0.011 . 1 . . . . A 93 ILE HG22 . 31080 1 1015 . 1 . 1 93 93 ILE HG23 H 1 0.981 0.011 . 1 . . . . A 93 ILE HG23 . 31080 1 1016 . 1 . 1 93 93 ILE HD11 H 1 1.000 0.000 . 1 . . . . A 93 ILE HD11 . 31080 1 1017 . 1 . 1 93 93 ILE HD12 H 1 1.000 0.000 . 1 . . . . A 93 ILE HD12 . 31080 1 1018 . 1 . 1 93 93 ILE HD13 H 1 1.000 0.000 . 1 . . . . A 93 ILE HD13 . 31080 1 1019 . 1 . 1 93 93 ILE C C 13 177.794 0.007 . 1 . . . . A 93 ILE C . 31080 1 1020 . 1 . 1 93 93 ILE CA C 13 67.111 0.050 . 1 . . . . A 93 ILE CA . 31080 1 1021 . 1 . 1 93 93 ILE CB C 13 38.267 0.032 . 1 . . . . A 93 ILE CB . 31080 1 1022 . 1 . 1 93 93 ILE CG1 C 13 30.705 0.000 . 1 . . . . A 93 ILE CG1 . 31080 1 1023 . 1 . 1 93 93 ILE CG2 C 13 17.237 0.061 . 1 . . . . A 93 ILE CG2 . 31080 1 1024 . 1 . 1 93 93 ILE CD1 C 13 14.096 0.000 . 1 . . . . A 93 ILE CD1 . 31080 1 1025 . 1 . 1 93 93 ILE N N 15 118.884 0.071 . 1 . . . . A 93 ILE N . 31080 1 1026 . 1 . 1 94 94 GLN H H 1 7.761 0.026 . 1 . . . . A 94 GLN H . 31080 1 1027 . 1 . 1 94 94 GLN HA H 1 4.038 0.008 . 1 . . . . A 94 GLN HA . 31080 1 1028 . 1 . 1 94 94 GLN HB2 H 1 2.256 0.000 . 1 . . . . A 94 GLN HB2 . 31080 1 1029 . 1 . 1 94 94 GLN HG2 H 1 2.511 0.000 . 1 . . . . A 94 GLN HG2 . 31080 1 1030 . 1 . 1 94 94 GLN HE21 H 1 6.871 0.027 . 1 . . . . A 94 GLN HE21 . 31080 1 1031 . 1 . 1 94 94 GLN HE22 H 1 7.446 0.026 . 1 . . . . A 94 GLN HE22 . 31080 1 1032 . 1 . 1 94 94 GLN C C 13 179.254 0.006 . 1 . . . . A 94 GLN C . 31080 1 1033 . 1 . 1 94 94 GLN CA C 13 59.144 0.063 . 1 . . . . A 94 GLN CA . 31080 1 1034 . 1 . 1 94 94 GLN CB C 13 28.014 0.035 . 1 . . . . A 94 GLN CB . 31080 1 1035 . 1 . 1 94 94 GLN CG C 13 33.567 0.041 . 1 . . . . A 94 GLN CG . 31080 1 1036 . 1 . 1 94 94 GLN N N 15 117.499 0.072 . 1 . . . . A 94 GLN N . 31080 1 1037 . 1 . 1 94 94 GLN NE2 N 15 111.841 0.182 . 1 . . . . A 94 GLN NE2 . 31080 1 1038 . 1 . 1 95 95 LYS H H 1 8.062 0.026 . 1 . . . . A 95 LYS H . 31080 1 1039 . 1 . 1 95 95 LYS HA H 1 4.096 0.009 . 1 . . . . A 95 LYS HA . 31080 1 1040 . 1 . 1 95 95 LYS HB2 H 1 2.145 0.000 . 1 . . . . A 95 LYS HB2 . 31080 1 1041 . 1 . 1 95 95 LYS HD2 H 1 1.742 0.000 . 1 . . . . A 95 LYS HD2 . 31080 1 1042 . 1 . 1 95 95 LYS C C 13 178.313 0.004 . 1 . . . . A 95 LYS C . 31080 1 1043 . 1 . 1 95 95 LYS CA C 13 59.678 0.041 . 1 . . . . A 95 LYS CA . 31080 1 1044 . 1 . 1 95 95 LYS CB C 13 33.579 0.007 . 1 . . . . A 95 LYS CB . 31080 1 1045 . 1 . 1 95 95 LYS CG C 13 25.822 0.000 . 1 . . . . A 95 LYS CG . 31080 1 1046 . 1 . 1 95 95 LYS N N 15 120.253 0.076 . 1 . . . . A 95 LYS N . 31080 1 1047 . 1 . 1 96 96 ILE H H 1 8.151 0.025 . 1 . . . . A 96 ILE H . 31080 1 1048 . 1 . 1 96 96 ILE HA H 1 4.302 0.013 . 1 . . . . A 96 ILE HA . 31080 1 1049 . 1 . 1 96 96 ILE HB H 1 1.830 0.011 . 1 . . . . A 96 ILE HB . 31080 1 1050 . 1 . 1 96 96 ILE HG21 H 1 1.140 0.001 . 1 . . . . A 96 ILE HG21 . 31080 1 1051 . 1 . 1 96 96 ILE HG22 H 1 1.140 0.001 . 1 . . . . A 96 ILE HG22 . 31080 1 1052 . 1 . 1 96 96 ILE HG23 H 1 1.140 0.001 . 1 . . . . A 96 ILE HG23 . 31080 1 1053 . 1 . 1 96 96 ILE HD11 H 1 0.813 0.011 . 1 . . . . A 96 ILE HD11 . 31080 1 1054 . 1 . 1 96 96 ILE HD12 H 1 0.813 0.011 . 1 . . . . A 96 ILE HD12 . 31080 1 1055 . 1 . 1 96 96 ILE HD13 H 1 0.813 0.011 . 1 . . . . A 96 ILE HD13 . 31080 1 1056 . 1 . 1 96 96 ILE C C 13 181.240 0.012 . 1 . . . . A 96 ILE C . 31080 1 1057 . 1 . 1 96 96 ILE CA C 13 63.903 0.074 . 1 . . . . A 96 ILE CA . 31080 1 1058 . 1 . 1 96 96 ILE CB C 13 39.012 0.065 . 1 . . . . A 96 ILE CB . 31080 1 1059 . 1 . 1 96 96 ILE CG1 C 13 29.640 0.072 . 1 . . . . A 96 ILE CG1 . 31080 1 1060 . 1 . 1 96 96 ILE CG2 C 13 18.145 0.024 . 1 . . . . A 96 ILE CG2 . 31080 1 1061 . 1 . 1 96 96 ILE CD1 C 13 14.858 0.038 . 1 . . . . A 96 ILE CD1 . 31080 1 1062 . 1 . 1 96 96 ILE N N 15 120.042 0.077 . 1 . . . . A 96 ILE N . 31080 1 1063 . 1 . 1 97 97 LYS H H 1 9.012 0.024 . 1 . . . . A 97 LYS H . 31080 1 1064 . 1 . 1 97 97 LYS HA H 1 4.103 0.008 . 1 . . . . A 97 LYS HA . 31080 1 1065 . 1 . 1 97 97 LYS HB2 H 1 1.977 0.000 . 2 . . . . A 97 LYS HB2 . 31080 1 1066 . 1 . 1 97 97 LYS HB3 H 1 1.897 0.015 . 2 . . . . A 97 LYS HB3 . 31080 1 1067 . 1 . 1 97 97 LYS HG2 H 1 1.508 0.007 . 1 . . . . A 97 LYS HG2 . 31080 1 1068 . 1 . 1 97 97 LYS HD2 H 1 1.713 0.000 . 1 . . . . A 97 LYS HD2 . 31080 1 1069 . 1 . 1 97 97 LYS C C 13 178.931 0.001 . 1 . . . . A 97 LYS C . 31080 1 1070 . 1 . 1 97 97 LYS CA C 13 59.869 0.028 . 1 . . . . A 97 LYS CA . 31080 1 1071 . 1 . 1 97 97 LYS CB C 13 32.508 0.016 . 1 . . . . A 97 LYS CB . 31080 1 1072 . 1 . 1 97 97 LYS CG C 13 26.162 0.070 . 1 . . . . A 97 LYS CG . 31080 1 1073 . 1 . 1 97 97 LYS CD C 13 29.412 0.000 . 1 . . . . A 97 LYS CD . 31080 1 1074 . 1 . 1 97 97 LYS N N 15 120.977 0.074 . 1 . . . . A 97 LYS N . 31080 1 1075 . 1 . 1 98 98 SER H H 1 8.131 0.025 . 1 . . . . A 98 SER H . 31080 1 1076 . 1 . 1 98 98 SER HA H 1 4.435 0.015 . 1 . . . . A 98 SER HA . 31080 1 1077 . 1 . 1 98 98 SER HB2 H 1 4.146 0.000 . 2 . . . . A 98 SER HB2 . 31080 1 1078 . 1 . 1 98 98 SER HB3 H 1 4.052 0.000 . 2 . . . . A 98 SER HB3 . 31080 1 1079 . 1 . 1 98 98 SER C C 13 175.604 0.002 . 1 . . . . A 98 SER C . 31080 1 1080 . 1 . 1 98 98 SER CA C 13 59.402 0.091 . 1 . . . . A 98 SER CA . 31080 1 1081 . 1 . 1 98 98 SER CB C 13 64.125 0.040 . 1 . . . . A 98 SER CB . 31080 1 1082 . 1 . 1 98 98 SER N N 15 111.532 0.058 . 1 . . . . A 98 SER N . 31080 1 1083 . 1 . 1 99 99 GLY H H 1 7.802 0.023 . 1 . . . . A 99 GLY H . 31080 1 1084 . 1 . 1 99 99 GLY HA2 H 1 4.254 0.007 . 2 . . . . A 99 GLY HA2 . 31080 1 1085 . 1 . 1 99 99 GLY HA3 H 1 3.912 0.008 . 2 . . . . A 99 GLY HA3 . 31080 1 1086 . 1 . 1 99 99 GLY C C 13 174.398 0.002 . 1 . . . . A 99 GLY C . 31080 1 1087 . 1 . 1 99 99 GLY CA C 13 45.392 0.056 . 1 . . . . A 99 GLY CA . 31080 1 1088 . 1 . 1 99 99 GLY N N 15 110.340 0.059 . 1 . . . . A 99 GLY N . 31080 1 1089 . 1 . 1 100 100 GLU H H 1 8.243 0.029 . 1 . . . . A 100 GLU H . 31080 1 1090 . 1 . 1 100 100 GLU HA H 1 4.040 0.008 . 1 . . . . A 100 GLU HA . 31080 1 1091 . 1 . 1 100 100 GLU HB2 H 1 2.062 0.001 . 1 . . . . A 100 GLU HB2 . 31080 1 1092 . 1 . 1 100 100 GLU HG2 H 1 2.367 0.006 . 1 . . . . A 100 GLU HG2 . 31080 1 1093 . 1 . 1 100 100 GLU C C 13 176.687 0.005 . 1 . . . . A 100 GLU C . 31080 1 1094 . 1 . 1 100 100 GLU CA C 13 59.011 0.042 . 1 . . . . A 100 GLU CA . 31080 1 1095 . 1 . 1 100 100 GLU CB C 13 31.008 0.033 . 1 . . . . A 100 GLU CB . 31080 1 1096 . 1 . 1 100 100 GLU CG C 13 36.861 0.035 . 1 . . . . A 100 GLU CG . 31080 1 1097 . 1 . 1 100 100 GLU N N 15 121.806 0.056 . 1 . . . . A 100 GLU N . 31080 1 1098 . 1 . 1 101 101 GLU H H 1 7.364 0.024 . 1 . . . . A 101 GLU H . 31080 1 1099 . 1 . 1 101 101 GLU HA H 1 4.633 0.011 . 1 . . . . A 101 GLU HA . 31080 1 1100 . 1 . 1 101 101 GLU HB2 H 1 1.984 0.014 . 2 . . . . A 101 GLU HB2 . 31080 1 1101 . 1 . 1 101 101 GLU HB3 H 1 1.355 0.015 . 2 . . . . A 101 GLU HB3 . 31080 1 1102 . 1 . 1 101 101 GLU HG2 H 1 2.230 0.020 . 1 . . . . A 101 GLU HG2 . 31080 1 1103 . 1 . 1 101 101 GLU C C 13 174.157 0.003 . 1 . . . . A 101 GLU C . 31080 1 1104 . 1 . 1 101 101 GLU CA C 13 54.282 0.068 . 1 . . . . A 101 GLU CA . 31080 1 1105 . 1 . 1 101 101 GLU CB C 13 34.272 0.024 . 1 . . . . A 101 GLU CB . 31080 1 1106 . 1 . 1 101 101 GLU CG C 13 36.000 0.040 . 1 . . . . A 101 GLU CG . 31080 1 1107 . 1 . 1 101 101 GLU N N 15 114.320 0.055 . 1 . . . . A 101 GLU N . 31080 1 1108 . 1 . 1 102 102 ASP H H 1 8.324 0.024 . 1 . . . . A 102 ASP H . 31080 1 1109 . 1 . 1 102 102 ASP HA H 1 4.900 0.010 . 1 . . . . A 102 ASP HA . 31080 1 1110 . 1 . 1 102 102 ASP HB2 H 1 2.948 0.021 . 2 . . . . A 102 ASP HB2 . 31080 1 1111 . 1 . 1 102 102 ASP HB3 H 1 2.711 0.014 . 2 . . . . A 102 ASP HB3 . 31080 1 1112 . 1 . 1 102 102 ASP C C 13 175.539 0.005 . 1 . . . . A 102 ASP C . 31080 1 1113 . 1 . 1 102 102 ASP CA C 13 52.417 0.034 . 1 . . . . A 102 ASP CA . 31080 1 1114 . 1 . 1 102 102 ASP CB C 13 43.052 0.054 . 1 . . . . A 102 ASP CB . 31080 1 1115 . 1 . 1 102 102 ASP N N 15 118.561 0.066 . 1 . . . . A 102 ASP N . 31080 1 1116 . 1 . 1 103 103 PHE H H 1 9.064 0.026 . 1 . . . . A 103 PHE H . 31080 1 1117 . 1 . 1 103 103 PHE HA H 1 3.627 0.004 . 1 . . . . A 103 PHE HA . 31080 1 1118 . 1 . 1 103 103 PHE HB2 H 1 3.076 0.042 . 2 . . . . A 103 PHE HB2 . 31080 1 1119 . 1 . 1 103 103 PHE HB3 H 1 3.099 0.051 . 2 . . . . A 103 PHE HB3 . 31080 1 1120 . 1 . 1 103 103 PHE HD1 H 1 7.019 0.000 . 1 . . . . A 103 PHE HD1 . 31080 1 1121 . 1 . 1 103 103 PHE HD2 H 1 7.019 0.000 . 1 . . . . A 103 PHE HD2 . 31080 1 1122 . 1 . 1 103 103 PHE HE1 H 1 6.867 0.000 . 1 . . . . A 103 PHE HE1 . 31080 1 1123 . 1 . 1 103 103 PHE HE2 H 1 6.867 0.000 . 1 . . . . A 103 PHE HE2 . 31080 1 1124 . 1 . 1 103 103 PHE C C 13 176.599 0.003 . 1 . . . . A 103 PHE C . 31080 1 1125 . 1 . 1 103 103 PHE CA C 13 62.760 0.095 . 1 . . . . A 103 PHE CA . 31080 1 1126 . 1 . 1 103 103 PHE CB C 13 40.385 0.104 . 1 . . . . A 103 PHE CB . 31080 1 1127 . 1 . 1 103 103 PHE CD1 C 13 132.014 0.000 . 1 . . . . A 103 PHE CD1 . 31080 1 1128 . 1 . 1 103 103 PHE CD2 C 13 132.014 0.000 . 1 . . . . A 103 PHE CD2 . 31080 1 1129 . 1 . 1 103 103 PHE CE1 C 13 131.592 0.000 . 1 . . . . A 103 PHE CE1 . 31080 1 1130 . 1 . 1 103 103 PHE CE2 C 13 131.592 0.000 . 1 . . . . A 103 PHE CE2 . 31080 1 1131 . 1 . 1 103 103 PHE N N 15 122.329 0.066 . 1 . . . . A 103 PHE N . 31080 1 1132 . 1 . 1 104 104 GLU H H 1 8.964 0.024 . 1 . . . . A 104 GLU H . 31080 1 1133 . 1 . 1 104 104 GLU HA H 1 3.858 0.014 . 1 . . . . A 104 GLU HA . 31080 1 1134 . 1 . 1 104 104 GLU HB2 H 1 2.236 0.011 . 2 . . . . A 104 GLU HB2 . 31080 1 1135 . 1 . 1 104 104 GLU HB3 H 1 2.033 0.007 . 2 . . . . A 104 GLU HB3 . 31080 1 1136 . 1 . 1 104 104 GLU HG2 H 1 2.634 0.016 . 2 . . . . A 104 GLU HG2 . 31080 1 1137 . 1 . 1 104 104 GLU HG3 H 1 2.637 0.000 . 2 . . . . A 104 GLU HG3 . 31080 1 1138 . 1 . 1 104 104 GLU C C 13 179.180 0.003 . 1 . . . . A 104 GLU C . 31080 1 1139 . 1 . 1 104 104 GLU CA C 13 60.593 0.017 . 1 . . . . A 104 GLU CA . 31080 1 1140 . 1 . 1 104 104 GLU CB C 13 29.678 0.053 . 1 . . . . A 104 GLU CB . 31080 1 1141 . 1 . 1 104 104 GLU CG C 13 37.731 0.040 . 1 . . . . A 104 GLU CG . 31080 1 1142 . 1 . 1 104 104 GLU N N 15 116.545 0.060 . 1 . . . . A 104 GLU N . 31080 1 1143 . 1 . 1 105 105 SER H H 1 8.034 0.027 . 1 . . . . A 105 SER H . 31080 1 1144 . 1 . 1 105 105 SER HA H 1 4.148 0.008 . 1 . . . . A 105 SER HA . 31080 1 1145 . 1 . 1 105 105 SER HB2 H 1 4.024 0.000 . 2 . . . . A 105 SER HB2 . 31080 1 1146 . 1 . 1 105 105 SER HB3 H 1 3.952 0.000 . 2 . . . . A 105 SER HB3 . 31080 1 1147 . 1 . 1 105 105 SER C C 13 178.068 0.102 . 1 . . . . A 105 SER C . 31080 1 1148 . 1 . 1 105 105 SER CA C 13 61.286 0.062 . 1 . . . . A 105 SER CA . 31080 1 1149 . 1 . 1 105 105 SER CB C 13 62.727 0.092 . 1 . . . . A 105 SER CB . 31080 1 1150 . 1 . 1 105 105 SER N N 15 115.888 0.077 . 1 . . . . A 105 SER N . 31080 1 1151 . 1 . 1 106 106 LEU H H 1 7.655 0.022 . 1 . . . . A 106 LEU H . 31080 1 1152 . 1 . 1 106 106 LEU HA H 1 3.993 0.012 . 1 . . . . A 106 LEU HA . 31080 1 1153 . 1 . 1 106 106 LEU HB2 H 1 0.719 0.016 . 2 . . . . A 106 LEU HB2 . 31080 1 1154 . 1 . 1 106 106 LEU HB3 H 1 1.460 0.020 . 2 . . . . A 106 LEU HB3 . 31080 1 1155 . 1 . 1 106 106 LEU HG H 1 1.587 0.000 . 1 . . . . A 106 LEU HG . 31080 1 1156 . 1 . 1 106 106 LEU HD11 H 1 0.653 0.011 . 2 . . . . A 106 LEU HD11 . 31080 1 1157 . 1 . 1 106 106 LEU HD12 H 1 0.653 0.011 . 2 . . . . A 106 LEU HD12 . 31080 1 1158 . 1 . 1 106 106 LEU HD13 H 1 0.653 0.011 . 2 . . . . A 106 LEU HD13 . 31080 1 1159 . 1 . 1 106 106 LEU HD21 H 1 0.741 0.000 . 2 . . . . A 106 LEU HD21 . 31080 1 1160 . 1 . 1 106 106 LEU HD22 H 1 0.741 0.000 . 2 . . . . A 106 LEU HD22 . 31080 1 1161 . 1 . 1 106 106 LEU HD23 H 1 0.741 0.000 . 2 . . . . A 106 LEU HD23 . 31080 1 1162 . 1 . 1 106 106 LEU C C 13 178.827 0.058 . 1 . . . . A 106 LEU C . 31080 1 1163 . 1 . 1 106 106 LEU CA C 13 57.477 0.057 . 1 . . . . A 106 LEU CA . 31080 1 1164 . 1 . 1 106 106 LEU CB C 13 41.604 0.044 . 1 . . . . A 106 LEU CB . 31080 1 1165 . 1 . 1 106 106 LEU CD1 C 13 23.000 0.000 . 1 . . . . A 106 LEU CD1 . 31080 1 1166 . 1 . 1 106 106 LEU CD2 C 13 26.659 0.041 . 1 . . . . A 106 LEU CD2 . 31080 1 1167 . 1 . 1 106 106 LEU N N 15 120.825 0.068 . 1 . . . . A 106 LEU N . 31080 1 1168 . 1 . 1 107 107 ALA H H 1 8.775 0.021 . 1 . . . . A 107 ALA H . 31080 1 1169 . 1 . 1 107 107 ALA HA H 1 3.636 0.005 . 1 . . . . A 107 ALA HA . 31080 1 1170 . 1 . 1 107 107 ALA HB1 H 1 1.018 0.012 . 1 . . . . A 107 ALA HB1 . 31080 1 1171 . 1 . 1 107 107 ALA HB2 H 1 1.018 0.012 . 1 . . . . A 107 ALA HB2 . 31080 1 1172 . 1 . 1 107 107 ALA HB3 H 1 1.018 0.012 . 1 . . . . A 107 ALA HB3 . 31080 1 1173 . 1 . 1 107 107 ALA C C 13 178.928 0.002 . 1 . . . . A 107 ALA C . 31080 1 1174 . 1 . 1 107 107 ALA CA C 13 55.567 0.021 . 1 . . . . A 107 ALA CA . 31080 1 1175 . 1 . 1 107 107 ALA CB C 13 16.795 0.031 . 1 . . . . A 107 ALA CB . 31080 1 1176 . 1 . 1 107 107 ALA N N 15 122.590 0.062 . 1 . . . . A 107 ALA N . 31080 1 1177 . 1 . 1 108 108 SER H H 1 7.689 0.026 . 1 . . . . A 108 SER H . 31080 1 1178 . 1 . 1 108 108 SER HA H 1 4.505 0.004 . 1 . . . . A 108 SER HA . 31080 1 1179 . 1 . 1 108 108 SER HB2 H 1 3.938 0.031 . 2 . . . . A 108 SER HB2 . 31080 1 1180 . 1 . 1 108 108 SER HB3 H 1 3.869 0.011 . 2 . . . . A 108 SER HB3 . 31080 1 1181 . 1 . 1 108 108 SER C C 13 174.951 0.008 . 1 . . . . A 108 SER C . 31080 1 1182 . 1 . 1 108 108 SER CA C 13 60.954 0.071 . 1 . . . . A 108 SER CA . 31080 1 1183 . 1 . 1 108 108 SER CB C 13 63.721 0.036 . 1 . . . . A 108 SER CB . 31080 1 1184 . 1 . 1 108 108 SER N N 15 108.561 0.054 . 1 . . . . A 108 SER N . 31080 1 1185 . 1 . 1 109 109 GLN H H 1 6.879 0.022 . 1 . . . . A 109 GLN H . 31080 1 1186 . 1 . 1 109 109 GLN HA H 1 4.152 0.004 . 1 . . . . A 109 GLN HA . 31080 1 1187 . 1 . 1 109 109 GLN HB2 H 1 0.768 0.018 . 2 . . . . A 109 GLN HB2 . 31080 1 1188 . 1 . 1 109 109 GLN HB3 H 1 1.076 0.011 . 2 . . . . A 109 GLN HB3 . 31080 1 1189 . 1 . 1 109 109 GLN HG2 H 1 1.658 0.001 . 2 . . . . A 109 GLN HG2 . 31080 1 1190 . 1 . 1 109 109 GLN HG3 H 1 2.137 0.001 . 2 . . . . A 109 GLN HG3 . 31080 1 1191 . 1 . 1 109 109 GLN HE21 H 1 6.946 0.028 . 1 . . . . A 109 GLN HE21 . 31080 1 1192 . 1 . 1 109 109 GLN HE22 H 1 6.702 0.030 . 1 . . . . A 109 GLN HE22 . 31080 1 1193 . 1 . 1 109 109 GLN C C 13 177.683 0.006 . 1 . . . . A 109 GLN C . 31080 1 1194 . 1 . 1 109 109 GLN CA C 13 57.636 0.017 . 1 . . . . A 109 GLN CA . 31080 1 1195 . 1 . 1 109 109 GLN CB C 13 31.238 0.054 . 1 . . . . A 109 GLN CB . 31080 1 1196 . 1 . 1 109 109 GLN CG C 13 34.747 0.025 . 1 . . . . A 109 GLN CG . 31080 1 1197 . 1 . 1 109 109 GLN N N 15 115.200 0.093 . 1 . . . . A 109 GLN N . 31080 1 1198 . 1 . 1 109 109 GLN NE2 N 15 110.949 0.210 . 1 . . . . A 109 GLN NE2 . 31080 1 1199 . 1 . 1 110 110 PHE H H 1 8.115 0.025 . 1 . . . . A 110 PHE H . 31080 1 1200 . 1 . 1 110 110 PHE HA H 1 4.745 0.015 . 1 . . . . A 110 PHE HA . 31080 1 1201 . 1 . 1 110 110 PHE HB2 H 1 3.381 0.000 . 2 . . . . A 110 PHE HB2 . 31080 1 1202 . 1 . 1 110 110 PHE HB3 H 1 2.166 0.000 . 2 . . . . A 110 PHE HB3 . 31080 1 1203 . 1 . 1 110 110 PHE HD1 H 1 6.937 0.000 . 1 . . . . A 110 PHE HD1 . 31080 1 1204 . 1 . 1 110 110 PHE HD2 H 1 6.937 0.000 . 1 . . . . A 110 PHE HD2 . 31080 1 1205 . 1 . 1 110 110 PHE HE1 H 1 7.140 0.000 . 1 . . . . A 110 PHE HE1 . 31080 1 1206 . 1 . 1 110 110 PHE HE2 H 1 7.140 0.000 . 1 . . . . A 110 PHE HE2 . 31080 1 1207 . 1 . 1 110 110 PHE C C 13 175.044 0.005 . 1 . . . . A 110 PHE C . 31080 1 1208 . 1 . 1 110 110 PHE CA C 13 57.524 0.051 . 1 . . . . A 110 PHE CA . 31080 1 1209 . 1 . 1 110 110 PHE CB C 13 41.292 0.029 . 1 . . . . A 110 PHE CB . 31080 1 1210 . 1 . 1 110 110 PHE CD1 C 13 131.994 0.000 . 1 . . . . A 110 PHE CD1 . 31080 1 1211 . 1 . 1 110 110 PHE CD2 C 13 131.994 0.000 . 1 . . . . A 110 PHE CD2 . 31080 1 1212 . 1 . 1 110 110 PHE N N 15 112.662 0.042 . 1 . . . . A 110 PHE N . 31080 1 1213 . 1 . 1 111 111 SER H H 1 7.840 0.027 . 1 . . . . A 111 SER H . 31080 1 1214 . 1 . 1 111 111 SER HA H 1 4.718 0.002 . 1 . . . . A 111 SER HA . 31080 1 1215 . 1 . 1 111 111 SER HB2 H 1 3.885 0.000 . 1 . . . . A 111 SER HB2 . 31080 1 1216 . 1 . 1 111 111 SER C C 13 175.919 0.010 . 1 . . . . A 111 SER C . 31080 1 1217 . 1 . 1 111 111 SER CA C 13 57.293 0.069 . 1 . . . . A 111 SER CA . 31080 1 1218 . 1 . 1 111 111 SER CB C 13 65.892 0.026 . 1 . . . . A 111 SER CB . 31080 1 1219 . 1 . 1 111 111 SER N N 15 111.428 0.055 . 1 . . . . A 111 SER N . 31080 1 1220 . 1 . 1 112 112 ASP H H 1 9.920 0.026 . 1 . . . . A 112 ASP H . 31080 1 1221 . 1 . 1 112 112 ASP HA H 1 4.581 0.006 . 1 . . . . A 112 ASP HA . 31080 1 1222 . 1 . 1 112 112 ASP HB2 H 1 2.759 0.016 . 1 . . . . A 112 ASP HB2 . 31080 1 1223 . 1 . 1 112 112 ASP C C 13 174.861 0.013 . 1 . . . . A 112 ASP C . 31080 1 1224 . 1 . 1 112 112 ASP CA C 13 56.149 0.048 . 1 . . . . A 112 ASP CA . 31080 1 1225 . 1 . 1 112 112 ASP CB C 13 43.587 0.043 . 1 . . . . A 112 ASP CB . 31080 1 1226 . 1 . 1 112 112 ASP N N 15 125.023 0.067 . 1 . . . . A 112 ASP N . 31080 1 1227 . 1 . 1 113 113 CYS H H 1 8.126 0.022 . 1 . . . . A 113 CYS H . 31080 1 1228 . 1 . 1 113 113 CYS HA H 1 4.612 0.010 . 1 . . . . A 113 CYS HA . 31080 1 1229 . 1 . 1 113 113 CYS HB2 H 1 2.857 0.006 . 2 . . . . A 113 CYS HB2 . 31080 1 1230 . 1 . 1 113 113 CYS HB3 H 1 2.518 0.000 . 2 . . . . A 113 CYS HB3 . 31080 1 1231 . 1 . 1 113 113 CYS C C 13 176.850 0.002 . 1 . . . . A 113 CYS C . 31080 1 1232 . 1 . 1 113 113 CYS CA C 13 60.075 0.022 . 1 . . . . A 113 CYS CA . 31080 1 1233 . 1 . 1 113 113 CYS CB C 13 29.849 0.062 . 1 . . . . A 113 CYS CB . 31080 1 1234 . 1 . 1 113 113 CYS N N 15 123.487 0.059 . 1 . . . . A 113 CYS N . 31080 1 1235 . 1 . 1 114 114 SER H H 1 8.788 0.027 . 1 . . . . A 114 SER H . 31080 1 1236 . 1 . 1 114 114 SER HA H 1 4.122 0.000 . 1 . . . . A 114 SER HA . 31080 1 1237 . 1 . 1 114 114 SER HB2 H 1 4.094 0.004 . 1 . . . . A 114 SER HB2 . 31080 1 1238 . 1 . 1 114 114 SER C C 13 176.451 0.019 . 1 . . . . A 114 SER C . 31080 1 1239 . 1 . 1 114 114 SER CA C 13 62.604 0.000 . 1 . . . . A 114 SER CA . 31080 1 1240 . 1 . 1 114 114 SER CB C 13 62.616 0.048 . 1 . . . . A 114 SER CB . 31080 1 1241 . 1 . 1 114 114 SER N N 15 127.504 0.069 . 1 . . . . A 114 SER N . 31080 1 1242 . 1 . 1 115 115 SER H H 1 10.137 0.027 . 1 . . . . A 115 SER H . 31080 1 1243 . 1 . 1 115 115 SER HB2 H 1 3.864 0.000 . 2 . . . . A 115 SER HB2 . 31080 1 1244 . 1 . 1 115 115 SER HB3 H 1 3.718 0.000 . 2 . . . . A 115 SER HB3 . 31080 1 1245 . 1 . 1 115 115 SER C C 13 177.170 0.000 . 1 . . . . A 115 SER C . 31080 1 1246 . 1 . 1 115 115 SER CA C 13 61.566 0.031 . 1 . . . . A 115 SER CA . 31080 1 1247 . 1 . 1 115 115 SER CB C 13 62.656 0.072 . 1 . . . . A 115 SER CB . 31080 1 1248 . 1 . 1 115 115 SER N N 15 124.114 0.045 . 1 . . . . A 115 SER N . 31080 1 1249 . 1 . 1 116 116 ALA H H 1 8.566 0.025 . 1 . . . . A 116 ALA H . 31080 1 1250 . 1 . 1 116 116 ALA HA H 1 3.809 0.000 . 1 . . . . A 116 ALA HA . 31080 1 1251 . 1 . 1 116 116 ALA HB1 H 1 1.763 0.008 . 1 . . . . A 116 ALA HB1 . 31080 1 1252 . 1 . 1 116 116 ALA HB2 H 1 1.763 0.008 . 1 . . . . A 116 ALA HB2 . 31080 1 1253 . 1 . 1 116 116 ALA HB3 H 1 1.763 0.008 . 1 . . . . A 116 ALA HB3 . 31080 1 1254 . 1 . 1 116 116 ALA C C 13 180.067 0.001 . 1 . . . . A 116 ALA C . 31080 1 1255 . 1 . 1 116 116 ALA CA C 13 56.638 0.007 . 1 . . . . A 116 ALA CA . 31080 1 1256 . 1 . 1 116 116 ALA CB C 13 20.326 0.027 . 1 . . . . A 116 ALA CB . 31080 1 1257 . 1 . 1 116 116 ALA N N 15 132.155 0.070 . 1 . . . . A 116 ALA N . 31080 1 1258 . 1 . 1 117 117 LYS H H 1 7.093 0.025 . 1 . . . . A 117 LYS H . 31080 1 1259 . 1 . 1 117 117 LYS HA H 1 4.000 0.007 . 1 . . . . A 117 LYS HA . 31080 1 1260 . 1 . 1 117 117 LYS HB2 H 1 1.740 0.016 . 1 . . . . A 117 LYS HB2 . 31080 1 1261 . 1 . 1 117 117 LYS HG2 H 1 1.182 0.005 . 2 . . . . A 117 LYS HG2 . 31080 1 1262 . 1 . 1 117 117 LYS HG3 H 1 1.284 0.007 . 2 . . . . A 117 LYS HG3 . 31080 1 1263 . 1 . 1 117 117 LYS HD2 H 1 1.451 0.000 . 1 . . . . A 117 LYS HD2 . 31080 1 1264 . 1 . 1 117 117 LYS HE2 H 1 2.490 0.000 . 2 . . . . A 117 LYS HE2 . 31080 1 1265 . 1 . 1 117 117 LYS HE3 H 1 2.658 0.000 . 2 . . . . A 117 LYS HE3 . 31080 1 1266 . 1 . 1 117 117 LYS C C 13 176.556 0.007 . 1 . . . . A 117 LYS C . 31080 1 1267 . 1 . 1 117 117 LYS CA C 13 57.844 0.043 . 1 . . . . A 117 LYS CA . 31080 1 1268 . 1 . 1 117 117 LYS CB C 13 31.627 0.030 . 1 . . . . A 117 LYS CB . 31080 1 1269 . 1 . 1 117 117 LYS CG C 13 24.617 0.035 . 1 . . . . A 117 LYS CG . 31080 1 1270 . 1 . 1 117 117 LYS CD C 13 28.701 0.014 . 1 . . . . A 117 LYS CD . 31080 1 1271 . 1 . 1 117 117 LYS N N 15 114.194 0.059 . 1 . . . . A 117 LYS N . 31080 1 1272 . 1 . 1 118 118 ALA H H 1 7.733 0.024 . 1 . . . . A 118 ALA H . 31080 1 1273 . 1 . 1 118 118 ALA HA H 1 4.733 0.005 . 1 . . . . A 118 ALA HA . 31080 1 1274 . 1 . 1 118 118 ALA HB1 H 1 1.523 0.010 . 1 . . . . A 118 ALA HB1 . 31080 1 1275 . 1 . 1 118 118 ALA HB2 H 1 1.523 0.010 . 1 . . . . A 118 ALA HB2 . 31080 1 1276 . 1 . 1 118 118 ALA HB3 H 1 1.523 0.010 . 1 . . . . A 118 ALA HB3 . 31080 1 1277 . 1 . 1 118 118 ALA C C 13 177.271 0.001 . 1 . . . . A 118 ALA C . 31080 1 1278 . 1 . 1 118 118 ALA CA C 13 50.783 0.051 . 1 . . . . A 118 ALA CA . 31080 1 1279 . 1 . 1 118 118 ALA CB C 13 18.552 0.034 . 1 . . . . A 118 ALA CB . 31080 1 1280 . 1 . 1 118 118 ALA N N 15 124.264 0.058 . 1 . . . . A 118 ALA N . 31080 1 1281 . 1 . 1 119 119 ARG H H 1 8.053 0.031 . 1 . . . . A 119 ARG H . 31080 1 1282 . 1 . 1 119 119 ARG HA H 1 3.688 0.007 . 1 . . . . A 119 ARG HA . 31080 1 1283 . 1 . 1 119 119 ARG HB2 H 1 2.038 0.013 . 2 . . . . A 119 ARG HB2 . 31080 1 1284 . 1 . 1 119 119 ARG HB3 H 1 2.137 0.000 . 2 . . . . A 119 ARG HB3 . 31080 1 1285 . 1 . 1 119 119 ARG HG2 H 1 1.516 0.000 . 1 . . . . A 119 ARG HG2 . 31080 1 1286 . 1 . 1 119 119 ARG HD2 H 1 3.187 0.000 . 2 . . . . A 119 ARG HD2 . 31080 1 1287 . 1 . 1 119 119 ARG HD3 H 1 3.189 0.000 . 2 . . . . A 119 ARG HD3 . 31080 1 1288 . 1 . 1 119 119 ARG HE H 1 7.308 0.002 . 1 . . . . A 119 ARG HE . 31080 1 1289 . 1 . 1 119 119 ARG C C 13 174.841 0.013 . 1 . . . . A 119 ARG C . 31080 1 1290 . 1 . 1 119 119 ARG CA C 13 57.777 0.057 . 1 . . . . A 119 ARG CA . 31080 1 1291 . 1 . 1 119 119 ARG CB C 13 26.819 0.090 . 1 . . . . A 119 ARG CB . 31080 1 1292 . 1 . 1 119 119 ARG CG C 13 27.525 0.022 . 1 . . . . A 119 ARG CG . 31080 1 1293 . 1 . 1 119 119 ARG CD C 13 43.620 0.033 . 1 . . . . A 119 ARG CD . 31080 1 1294 . 1 . 1 119 119 ARG N N 15 115.262 0.081 . 1 . . . . A 119 ARG N . 31080 1 1295 . 1 . 1 119 119 ARG NE N 15 84.231 0.059 . 1 . . . . A 119 ARG NE . 31080 1 1296 . 1 . 1 120 120 GLY H H 1 8.302 0.026 . 1 . . . . A 120 GLY H . 31080 1 1297 . 1 . 1 120 120 GLY HA2 H 1 4.389 0.007 . 1 . . . . A 120 GLY HA2 . 31080 1 1298 . 1 . 1 120 120 GLY C C 13 173.663 0.007 . 1 . . . . A 120 GLY C . 31080 1 1299 . 1 . 1 120 120 GLY CA C 13 44.911 0.062 . 1 . . . . A 120 GLY CA . 31080 1 1300 . 1 . 1 120 120 GLY N N 15 103.503 0.076 . 1 . . . . A 120 GLY N . 31080 1 1301 . 1 . 1 121 121 ASP H H 1 7.123 0.025 . 1 . . . . A 121 ASP H . 31080 1 1302 . 1 . 1 121 121 ASP HA H 1 4.765 0.007 . 1 . . . . A 121 ASP HA . 31080 1 1303 . 1 . 1 121 121 ASP HB2 H 1 2.840 0.000 . 1 . . . . A 121 ASP HB2 . 31080 1 1304 . 1 . 1 121 121 ASP C C 13 175.198 0.000 . 1 . . . . A 121 ASP C . 31080 1 1305 . 1 . 1 121 121 ASP CA C 13 55.941 0.020 . 1 . . . . A 121 ASP CA . 31080 1 1306 . 1 . 1 121 121 ASP CB C 13 42.086 0.042 . 1 . . . . A 121 ASP CB . 31080 1 1307 . 1 . 1 121 121 ASP N N 15 118.745 0.057 . 1 . . . . A 121 ASP N . 31080 1 1308 . 1 . 1 122 122 LEU H H 1 8.750 0.027 . 1 . . . . A 122 LEU H . 31080 1 1309 . 1 . 1 122 122 LEU HA H 1 4.428 0.014 . 1 . . . . A 122 LEU HA . 31080 1 1310 . 1 . 1 122 122 LEU HB2 H 1 1.386 0.009 . 2 . . . . A 122 LEU HB2 . 31080 1 1311 . 1 . 1 122 122 LEU HB3 H 1 2.019 0.010 . 2 . . . . A 122 LEU HB3 . 31080 1 1312 . 1 . 1 122 122 LEU HG H 1 1.726 0.000 . 1 . . . . A 122 LEU HG . 31080 1 1313 . 1 . 1 122 122 LEU HD11 H 1 0.291 0.017 . 2 . . . . A 122 LEU HD11 . 31080 1 1314 . 1 . 1 122 122 LEU HD12 H 1 0.291 0.017 . 2 . . . . A 122 LEU HD12 . 31080 1 1315 . 1 . 1 122 122 LEU HD13 H 1 0.291 0.017 . 2 . . . . A 122 LEU HD13 . 31080 1 1316 . 1 . 1 122 122 LEU HD21 H 1 0.286 0.000 . 2 . . . . A 122 LEU HD21 . 31080 1 1317 . 1 . 1 122 122 LEU HD22 H 1 0.286 0.000 . 2 . . . . A 122 LEU HD22 . 31080 1 1318 . 1 . 1 122 122 LEU HD23 H 1 0.286 0.000 . 2 . . . . A 122 LEU HD23 . 31080 1 1319 . 1 . 1 122 122 LEU C C 13 178.564 0.000 . 1 . . . . A 122 LEU C . 31080 1 1320 . 1 . 1 122 122 LEU CA C 13 54.479 0.067 . 1 . . . . A 122 LEU CA . 31080 1 1321 . 1 . 1 122 122 LEU CB C 13 43.802 0.075 . 1 . . . . A 122 LEU CB . 31080 1 1322 . 1 . 1 122 122 LEU CD1 C 13 26.504 0.041 . 2 . . . . A 122 LEU CD1 . 31080 1 1323 . 1 . 1 122 122 LEU CD2 C 13 23.012 0.000 . 2 . . . . A 122 LEU CD2 . 31080 1 1324 . 1 . 1 122 122 LEU N N 15 125.544 0.093 . 1 . . . . A 122 LEU N . 31080 1 1325 . 1 . 1 123 123 GLY H H 1 8.162 0.025 . 1 . . . . A 123 GLY H . 31080 1 1326 . 1 . 1 123 123 GLY HA2 H 1 4.338 0.003 . 2 . . . . A 123 GLY HA2 . 31080 1 1327 . 1 . 1 123 123 GLY HA3 H 1 3.587 0.008 . 2 . . . . A 123 GLY HA3 . 31080 1 1328 . 1 . 1 123 123 GLY C C 13 171.132 0.006 . 1 . . . . A 123 GLY C . 31080 1 1329 . 1 . 1 123 123 GLY CA C 13 44.704 0.029 . 1 . . . . A 123 GLY CA . 31080 1 1330 . 1 . 1 123 123 GLY N N 15 107.711 0.069 . 1 . . . . A 123 GLY N . 31080 1 1331 . 1 . 1 124 124 ALA H H 1 8.044 0.026 . 1 . . . . A 124 ALA H . 31080 1 1332 . 1 . 1 124 124 ALA HA H 1 5.360 0.016 . 1 . . . . A 124 ALA HA . 31080 1 1333 . 1 . 1 124 124 ALA HB1 H 1 1.148 0.006 . 1 . . . . A 124 ALA HB1 . 31080 1 1334 . 1 . 1 124 124 ALA HB2 H 1 1.148 0.006 . 1 . . . . A 124 ALA HB2 . 31080 1 1335 . 1 . 1 124 124 ALA HB3 H 1 1.148 0.006 . 1 . . . . A 124 ALA HB3 . 31080 1 1336 . 1 . 1 124 124 ALA C C 13 178.655 0.002 . 1 . . . . A 124 ALA C . 31080 1 1337 . 1 . 1 124 124 ALA CA C 13 50.291 0.097 . 1 . . . . A 124 ALA CA . 31080 1 1338 . 1 . 1 124 124 ALA CB C 13 20.559 0.028 . 1 . . . . A 124 ALA CB . 31080 1 1339 . 1 . 1 124 124 ALA N N 15 119.199 0.056 . 1 . . . . A 124 ALA N . 31080 1 1340 . 1 . 1 125 125 PHE H H 1 8.769 0.026 . 1 . . . . A 125 PHE H . 31080 1 1341 . 1 . 1 125 125 PHE HA H 1 5.104 0.016 . 1 . . . . A 125 PHE HA . 31080 1 1342 . 1 . 1 125 125 PHE HB2 H 1 3.109 0.017 . 1 . . . . A 125 PHE HB2 . 31080 1 1343 . 1 . 1 125 125 PHE HD1 H 1 7.175 0.000 . 1 . . . . A 125 PHE HD1 . 31080 1 1344 . 1 . 1 125 125 PHE HD2 H 1 7.175 0.000 . 1 . . . . A 125 PHE HD2 . 31080 1 1345 . 1 . 1 125 125 PHE C C 13 173.047 0.009 . 1 . . . . A 125 PHE C . 31080 1 1346 . 1 . 1 125 125 PHE CA C 13 55.946 0.050 . 1 . . . . A 125 PHE CA . 31080 1 1347 . 1 . 1 125 125 PHE CB C 13 41.069 0.068 . 1 . . . . A 125 PHE CB . 31080 1 1348 . 1 . 1 125 125 PHE CD1 C 13 133.905 0.000 . 1 . . . . A 125 PHE CD1 . 31080 1 1349 . 1 . 1 125 125 PHE CD2 C 13 133.905 0.000 . 1 . . . . A 125 PHE CD2 . 31080 1 1350 . 1 . 1 125 125 PHE N N 15 117.345 0.057 . 1 . . . . A 125 PHE N . 31080 1 1351 . 1 . 1 126 126 SER H H 1 8.583 0.028 . 1 . . . . A 126 SER H . 31080 1 1352 . 1 . 1 126 126 SER HA H 1 5.419 0.013 . 1 . . . . A 126 SER HA . 31080 1 1353 . 1 . 1 126 126 SER HB2 H 1 4.064 0.013 . 2 . . . . A 126 SER HB2 . 31080 1 1354 . 1 . 1 126 126 SER HB3 H 1 3.988 0.016 . 2 . . . . A 126 SER HB3 . 31080 1 1355 . 1 . 1 126 126 SER C C 13 175.329 0.004 . 1 . . . . A 126 SER C . 31080 1 1356 . 1 . 1 126 126 SER CA C 13 56.785 0.065 . 1 . . . . A 126 SER CA . 31080 1 1357 . 1 . 1 126 126 SER CB C 13 66.604 0.048 . 1 . . . . A 126 SER CB . 31080 1 1358 . 1 . 1 126 126 SER N N 15 113.974 0.067 . 1 . . . . A 126 SER N . 31080 1 1359 . 1 . 1 127 127 ARG H H 1 8.851 0.025 . 1 . . . . A 127 ARG H . 31080 1 1360 . 1 . 1 127 127 ARG HA H 1 3.881 0.000 . 1 . . . . A 127 ARG HA . 31080 1 1361 . 1 . 1 127 127 ARG HB2 H 1 1.590 0.003 . 1 . . . . A 127 ARG HB2 . 31080 1 1362 . 1 . 1 127 127 ARG HG2 H 1 1.066 0.000 . 2 . . . . A 127 ARG HG2 . 31080 1 1363 . 1 . 1 127 127 ARG HG3 H 1 0.585 0.000 . 2 . . . . A 127 ARG HG3 . 31080 1 1364 . 1 . 1 127 127 ARG HD2 H 1 2.662 0.000 . 1 . . . . A 127 ARG HD2 . 31080 1 1365 . 1 . 1 127 127 ARG HE H 1 7.458 0.003 . 1 . . . . A 127 ARG HE . 31080 1 1366 . 1 . 1 127 127 ARG C C 13 177.713 0.017 . 1 . . . . A 127 ARG C . 31080 1 1367 . 1 . 1 127 127 ARG CA C 13 58.620 0.033 . 1 . . . . A 127 ARG CA . 31080 1 1368 . 1 . 1 127 127 ARG CB C 13 29.924 0.120 . 1 . . . . A 127 ARG CB . 31080 1 1369 . 1 . 1 127 127 ARG CG C 13 28.601 0.052 . 1 . . . . A 127 ARG CG . 31080 1 1370 . 1 . 1 127 127 ARG CD C 13 43.424 0.002 . 1 . . . . A 127 ARG CD . 31080 1 1371 . 1 . 1 127 127 ARG N N 15 121.694 0.106 . 1 . . . . A 127 ARG N . 31080 1 1372 . 1 . 1 127 127 ARG NE N 15 85.400 0.066 . 1 . . . . A 127 ARG NE . 31080 1 1373 . 1 . 1 128 128 GLY H H 1 10.152 0.026 . 1 . . . . A 128 GLY H . 31080 1 1374 . 1 . 1 128 128 GLY HA2 H 1 4.371 0.012 . 2 . . . . A 128 GLY HA2 . 31080 1 1375 . 1 . 1 128 128 GLY HA3 H 1 3.823 0.000 . 2 . . . . A 128 GLY HA3 . 31080 1 1376 . 1 . 1 128 128 GLY C C 13 174.455 0.006 . 1 . . . . A 128 GLY C . 31080 1 1377 . 1 . 1 128 128 GLY CA C 13 45.277 0.066 . 1 . . . . A 128 GLY CA . 31080 1 1378 . 1 . 1 128 128 GLY N N 15 112.611 0.079 . 1 . . . . A 128 GLY N . 31080 1 1379 . 1 . 1 129 129 GLN H H 1 7.780 0.028 . 1 . . . . A 129 GLN H . 31080 1 1380 . 1 . 1 129 129 GLN HA H 1 4.411 0.008 . 1 . . . . A 129 GLN HA . 31080 1 1381 . 1 . 1 129 129 GLN HB2 H 1 2.136 0.010 . 2 . . . . A 129 GLN HB2 . 31080 1 1382 . 1 . 1 129 129 GLN HB3 H 1 2.099 0.000 . 2 . . . . A 129 GLN HB3 . 31080 1 1383 . 1 . 1 129 129 GLN HG2 H 1 2.317 0.000 . 1 . . . . A 129 GLN HG2 . 31080 1 1384 . 1 . 1 129 129 GLN HE21 H 1 7.530 0.025 . 1 . . . . A 129 GLN HE21 . 31080 1 1385 . 1 . 1 129 129 GLN HE22 H 1 7.001 0.028 . 1 . . . . A 129 GLN HE22 . 31080 1 1386 . 1 . 1 129 129 GLN C C 13 175.984 0.001 . 1 . . . . A 129 GLN C . 31080 1 1387 . 1 . 1 129 129 GLN CA C 13 58.029 0.020 . 1 . . . . A 129 GLN CA . 31080 1 1388 . 1 . 1 129 129 GLN CB C 13 31.620 0.038 . 1 . . . . A 129 GLN CB . 31080 1 1389 . 1 . 1 129 129 GLN CG C 13 35.273 0.039 . 1 . . . . A 129 GLN CG . 31080 1 1390 . 1 . 1 129 129 GLN N N 15 118.364 0.138 . 1 . . . . A 129 GLN N . 31080 1 1391 . 1 . 1 129 129 GLN NE2 N 15 111.946 0.165 . 1 . . . . A 129 GLN NE2 . 31080 1 1392 . 1 . 1 130 130 MET H H 1 8.994 0.027 . 1 . . . . A 130 MET H . 31080 1 1393 . 1 . 1 130 130 MET HA H 1 4.636 0.000 . 1 . . . . A 130 MET HA . 31080 1 1394 . 1 . 1 130 130 MET HB2 H 1 1.857 0.013 . 2 . . . . A 130 MET HB2 . 31080 1 1395 . 1 . 1 130 130 MET HB3 H 1 1.248 0.000 . 2 . . . . A 130 MET HB3 . 31080 1 1396 . 1 . 1 130 130 MET HE1 H 1 0.928 0.000 . 1 . . . . A 130 MET HE1 . 31080 1 1397 . 1 . 1 130 130 MET HE2 H 1 0.928 0.000 . 1 . . . . A 130 MET HE2 . 31080 1 1398 . 1 . 1 130 130 MET HE3 H 1 0.928 0.000 . 1 . . . . A 130 MET HE3 . 31080 1 1399 . 1 . 1 130 130 MET C C 13 175.561 0.008 . 1 . . . . A 130 MET C . 31080 1 1400 . 1 . 1 130 130 MET CA C 13 52.651 0.033 . 1 . . . . A 130 MET CA . 31080 1 1401 . 1 . 1 130 130 MET CB C 13 33.486 0.073 . 1 . . . . A 130 MET CB . 31080 1 1402 . 1 . 1 130 130 MET CE C 13 17.932 0.000 . 1 . . . . A 130 MET CE . 31080 1 1403 . 1 . 1 130 130 MET N N 15 117.882 0.059 . 1 . . . . A 130 MET N . 31080 1 1404 . 1 . 1 131 131 GLN H H 1 8.150 0.029 . 1 . . . . A 131 GLN H . 31080 1 1405 . 1 . 1 131 131 GLN HA H 1 4.242 0.010 . 1 . . . . A 131 GLN HA . 31080 1 1406 . 1 . 1 131 131 GLN HB2 H 1 2.055 0.010 . 2 . . . . A 131 GLN HB2 . 31080 1 1407 . 1 . 1 131 131 GLN HB3 H 1 1.960 0.010 . 2 . . . . A 131 GLN HB3 . 31080 1 1408 . 1 . 1 131 131 GLN HG2 H 1 2.600 0.009 . 2 . . . . A 131 GLN HG2 . 31080 1 1409 . 1 . 1 131 131 GLN HG3 H 1 2.503 0.008 . 2 . . . . A 131 GLN HG3 . 31080 1 1410 . 1 . 1 131 131 GLN HE21 H 1 7.140 0.036 . 1 . . . . A 131 GLN HE21 . 31080 1 1411 . 1 . 1 131 131 GLN HE22 H 1 7.592 0.000 . 1 . . . . A 131 GLN HE22 . 31080 1 1412 . 1 . 1 131 131 GLN C C 13 178.221 0.018 . 1 . . . . A 131 GLN C . 31080 1 1413 . 1 . 1 131 131 GLN CA C 13 57.039 0.079 . 1 . . . . A 131 GLN CA . 31080 1 1414 . 1 . 1 131 131 GLN CB C 13 29.992 0.089 . 1 . . . . A 131 GLN CB . 31080 1 1415 . 1 . 1 131 131 GLN CG C 13 35.155 0.065 . 1 . . . . A 131 GLN CG . 31080 1 1416 . 1 . 1 131 131 GLN N N 15 117.995 0.054 . 1 . . . . A 131 GLN N . 31080 1 1417 . 1 . 1 131 131 GLN NE2 N 15 112.758 0.207 . 1 . . . . A 131 GLN NE2 . 31080 1 1418 . 1 . 1 132 132 LYS H H 1 9.012 0.028 . 1 . . . . A 132 LYS H . 31080 1 1419 . 1 . 1 132 132 LYS HG2 H 1 1.502 0.000 . 1 . . . . A 132 LYS HG2 . 31080 1 1420 . 1 . 1 132 132 LYS C C 13 173.735 0.000 . 1 . . . . A 132 LYS C . 31080 1 1421 . 1 . 1 132 132 LYS CA C 13 61.260 0.000 . 1 . . . . A 132 LYS CA . 31080 1 1422 . 1 . 1 132 132 LYS N N 15 124.801 0.095 . 1 . . . . A 132 LYS N . 31080 1 1423 . 1 . 1 133 133 PRO HA H 1 4.508 0.014 . 1 . . . . A 133 PRO HA . 31080 1 1424 . 1 . 1 133 133 PRO HB2 H 1 2.567 0.001 . 2 . . . . A 133 PRO HB2 . 31080 1 1425 . 1 . 1 133 133 PRO HB3 H 1 1.873 0.012 . 2 . . . . A 133 PRO HB3 . 31080 1 1426 . 1 . 1 133 133 PRO HG2 H 1 2.265 0.009 . 1 . . . . A 133 PRO HG2 . 31080 1 1427 . 1 . 1 133 133 PRO HD2 H 1 3.919 0.000 . 2 . . . . A 133 PRO HD2 . 31080 1 1428 . 1 . 1 133 133 PRO HD3 H 1 3.758 0.000 . 2 . . . . A 133 PRO HD3 . 31080 1 1429 . 1 . 1 133 133 PRO C C 13 179.950 0.010 . 1 . . . . A 133 PRO C . 31080 1 1430 . 1 . 1 133 133 PRO CA C 13 66.098 0.097 . 1 . . . . A 133 PRO CA . 31080 1 1431 . 1 . 1 133 133 PRO CB C 13 31.243 0.002 . 1 . . . . A 133 PRO CB . 31080 1 1432 . 1 . 1 133 133 PRO CG C 13 27.559 0.000 . 1 . . . . A 133 PRO CG . 31080 1 1433 . 1 . 1 133 133 PRO CD C 13 49.686 0.024 . 1 . . . . A 133 PRO CD . 31080 1 1434 . 1 . 1 134 134 PHE H H 1 7.227 0.032 . 1 . . . . A 134 PHE H . 31080 1 1435 . 1 . 1 134 134 PHE HA H 1 3.683 0.004 . 1 . . . . A 134 PHE HA . 31080 1 1436 . 1 . 1 134 134 PHE HB2 H 1 3.322 0.007 . 1 . . . . A 134 PHE HB2 . 31080 1 1437 . 1 . 1 134 134 PHE HD1 H 1 6.100 0.000 . 1 . . . . A 134 PHE HD1 . 31080 1 1438 . 1 . 1 134 134 PHE HD2 H 1 6.100 0.000 . 1 . . . . A 134 PHE HD2 . 31080 1 1439 . 1 . 1 134 134 PHE HE1 H 1 6.554 0.000 . 1 . . . . A 134 PHE HE1 . 31080 1 1440 . 1 . 1 134 134 PHE HE2 H 1 6.554 0.000 . 1 . . . . A 134 PHE HE2 . 31080 1 1441 . 1 . 1 134 134 PHE C C 13 178.301 0.012 . 1 . . . . A 134 PHE C . 31080 1 1442 . 1 . 1 134 134 PHE CA C 13 61.075 0.018 . 1 . . . . A 134 PHE CA . 31080 1 1443 . 1 . 1 134 134 PHE CB C 13 40.572 0.052 . 1 . . . . A 134 PHE CB . 31080 1 1444 . 1 . 1 134 134 PHE CD1 C 13 130.247 0.000 . 1 . . . . A 134 PHE CD1 . 31080 1 1445 . 1 . 1 134 134 PHE CD2 C 13 130.247 0.000 . 1 . . . . A 134 PHE CD2 . 31080 1 1446 . 1 . 1 134 134 PHE CE1 C 13 129.214 0.000 . 1 . . . . A 134 PHE CE1 . 31080 1 1447 . 1 . 1 134 134 PHE CE2 C 13 129.214 0.000 . 1 . . . . A 134 PHE CE2 . 31080 1 1448 . 1 . 1 134 134 PHE N N 15 117.013 0.069 . 1 . . . . A 134 PHE N . 31080 1 1449 . 1 . 1 135 135 GLU H H 1 8.689 0.030 . 1 . . . . A 135 GLU H . 31080 1 1450 . 1 . 1 135 135 GLU HA H 1 4.052 0.006 . 1 . . . . A 135 GLU HA . 31080 1 1451 . 1 . 1 135 135 GLU HG2 H 1 2.267 0.000 . 1 . . . . A 135 GLU HG2 . 31080 1 1452 . 1 . 1 135 135 GLU C C 13 177.572 0.007 . 1 . . . . A 135 GLU C . 31080 1 1453 . 1 . 1 135 135 GLU CA C 13 60.585 0.069 . 1 . . . . A 135 GLU CA . 31080 1 1454 . 1 . 1 135 135 GLU CB C 13 30.866 0.008 . 1 . . . . A 135 GLU CB . 31080 1 1455 . 1 . 1 135 135 GLU CG C 13 37.643 0.003 . 1 . . . . A 135 GLU CG . 31080 1 1456 . 1 . 1 135 135 GLU N N 15 122.576 0.086 . 1 . . . . A 135 GLU N . 31080 1 1457 . 1 . 1 136 136 ASP H H 1 9.322 0.026 . 1 . . . . A 136 ASP H . 31080 1 1458 . 1 . 1 136 136 ASP HA H 1 4.437 0.000 . 1 . . . . A 136 ASP HA . 31080 1 1459 . 1 . 1 136 136 ASP HB2 H 1 2.645 0.000 . 2 . . . . A 136 ASP HB2 . 31080 1 1460 . 1 . 1 136 136 ASP HB3 H 1 2.625 0.000 . 2 . . . . A 136 ASP HB3 . 31080 1 1461 . 1 . 1 136 136 ASP C C 13 179.334 0.007 . 1 . . . . A 136 ASP C . 31080 1 1462 . 1 . 1 136 136 ASP CA C 13 57.328 0.073 . 1 . . . . A 136 ASP CA . 31080 1 1463 . 1 . 1 136 136 ASP CB C 13 39.575 0.049 . 1 . . . . A 136 ASP CB . 31080 1 1464 . 1 . 1 136 136 ASP N N 15 118.697 0.081 . 1 . . . . A 136 ASP N . 31080 1 1465 . 1 . 1 137 137 ALA H H 1 7.093 0.024 . 1 . . . . A 137 ALA H . 31080 1 1466 . 1 . 1 137 137 ALA HA H 1 4.116 0.012 . 1 . . . . A 137 ALA HA . 31080 1 1467 . 1 . 1 137 137 ALA HB1 H 1 1.334 0.011 . 1 . . . . A 137 ALA HB1 . 31080 1 1468 . 1 . 1 137 137 ALA HB2 H 1 1.334 0.011 . 1 . . . . A 137 ALA HB2 . 31080 1 1469 . 1 . 1 137 137 ALA HB3 H 1 1.334 0.011 . 1 . . . . A 137 ALA HB3 . 31080 1 1470 . 1 . 1 137 137 ALA C C 13 179.332 0.007 . 1 . . . . A 137 ALA C . 31080 1 1471 . 1 . 1 137 137 ALA CA C 13 54.555 0.036 . 1 . . . . A 137 ALA CA . 31080 1 1472 . 1 . 1 137 137 ALA CB C 13 20.052 0.022 . 1 . . . . A 137 ALA CB . 31080 1 1473 . 1 . 1 137 137 ALA N N 15 118.907 0.055 . 1 . . . . A 137 ALA N . 31080 1 1474 . 1 . 1 138 138 SER H H 1 7.815 0.028 . 1 . . . . A 138 SER H . 31080 1 1475 . 1 . 1 138 138 SER HA H 1 3.861 0.015 . 1 . . . . A 138 SER HA . 31080 1 1476 . 1 . 1 138 138 SER HB2 H 1 3.572 0.000 . 1 . . . . A 138 SER HB2 . 31080 1 1477 . 1 . 1 138 138 SER C C 13 174.849 0.013 . 1 . . . . A 138 SER C . 31080 1 1478 . 1 . 1 138 138 SER CA C 13 63.473 0.024 . 1 . . . . A 138 SER CA . 31080 1 1479 . 1 . 1 138 138 SER N N 15 113.541 0.067 . 1 . . . . A 138 SER N . 31080 1 1480 . 1 . 1 139 139 PHE H H 1 8.245 0.028 . 1 . . . . A 139 PHE H . 31080 1 1481 . 1 . 1 139 139 PHE HA H 1 3.888 0.000 . 1 . . . . A 139 PHE HA . 31080 1 1482 . 1 . 1 139 139 PHE HB2 H 1 3.007 0.023 . 2 . . . . A 139 PHE HB2 . 31080 1 1483 . 1 . 1 139 139 PHE HB3 H 1 2.937 0.000 . 2 . . . . A 139 PHE HB3 . 31080 1 1484 . 1 . 1 139 139 PHE HD1 H 1 7.432 0.000 . 1 . . . . A 139 PHE HD1 . 31080 1 1485 . 1 . 1 139 139 PHE HD2 H 1 7.432 0.000 . 1 . . . . A 139 PHE HD2 . 31080 1 1486 . 1 . 1 139 139 PHE HE1 H 1 7.147 0.000 . 1 . . . . A 139 PHE HE1 . 31080 1 1487 . 1 . 1 139 139 PHE HE2 H 1 7.147 0.000 . 1 . . . . A 139 PHE HE2 . 31080 1 1488 . 1 . 1 139 139 PHE HZ H 1 7.112 0.000 . 1 . . . . A 139 PHE HZ . 31080 1 1489 . 1 . 1 139 139 PHE C C 13 176.013 0.012 . 1 . . . . A 139 PHE C . 31080 1 1490 . 1 . 1 139 139 PHE CA C 13 61.206 0.104 . 1 . . . . A 139 PHE CA . 31080 1 1491 . 1 . 1 139 139 PHE CB C 13 38.869 0.061 . 1 . . . . A 139 PHE CB . 31080 1 1492 . 1 . 1 139 139 PHE CD1 C 13 131.575 0.000 . 1 . . . . A 139 PHE CD1 . 31080 1 1493 . 1 . 1 139 139 PHE CD2 C 13 131.575 0.000 . 1 . . . . A 139 PHE CD2 . 31080 1 1494 . 1 . 1 139 139 PHE N N 15 114.989 0.118 . 1 . . . . A 139 PHE N . 31080 1 1495 . 1 . 1 140 140 ALA H H 1 6.988 0.024 . 1 . . . . A 140 ALA H . 31080 1 1496 . 1 . 1 140 140 ALA HA H 1 4.406 0.008 . 1 . . . . A 140 ALA HA . 31080 1 1497 . 1 . 1 140 140 ALA HB1 H 1 1.475 0.009 . 1 . . . . A 140 ALA HB1 . 31080 1 1498 . 1 . 1 140 140 ALA HB2 H 1 1.475 0.009 . 1 . . . . A 140 ALA HB2 . 31080 1 1499 . 1 . 1 140 140 ALA HB3 H 1 1.475 0.009 . 1 . . . . A 140 ALA HB3 . 31080 1 1500 . 1 . 1 140 140 ALA C C 13 177.965 0.016 . 1 . . . . A 140 ALA C . 31080 1 1501 . 1 . 1 140 140 ALA CA C 13 52.240 0.020 . 1 . . . . A 140 ALA CA . 31080 1 1502 . 1 . 1 140 140 ALA CB C 13 19.567 0.067 . 1 . . . . A 140 ALA CB . 31080 1 1503 . 1 . 1 140 140 ALA N N 15 119.213 0.061 . 1 . . . . A 140 ALA N . 31080 1 1504 . 1 . 1 141 141 LEU H H 1 6.899 0.017 . 1 . . . . A 141 LEU H . 31080 1 1505 . 1 . 1 141 141 LEU HA H 1 4.248 0.008 . 1 . . . . A 141 LEU HA . 31080 1 1506 . 1 . 1 141 141 LEU HB2 H 1 1.493 0.015 . 2 . . . . A 141 LEU HB2 . 31080 1 1507 . 1 . 1 141 141 LEU HB3 H 1 1.736 0.011 . 2 . . . . A 141 LEU HB3 . 31080 1 1508 . 1 . 1 141 141 LEU HG H 1 2.075 0.000 . 1 . . . . A 141 LEU HG . 31080 1 1509 . 1 . 1 141 141 LEU HD11 H 1 0.548 0.010 . 2 . . . . A 141 LEU HD11 . 31080 1 1510 . 1 . 1 141 141 LEU HD12 H 1 0.548 0.010 . 2 . . . . A 141 LEU HD12 . 31080 1 1511 . 1 . 1 141 141 LEU HD13 H 1 0.548 0.010 . 2 . . . . A 141 LEU HD13 . 31080 1 1512 . 1 . 1 141 141 LEU HD21 H 1 0.824 0.000 . 2 . . . . A 141 LEU HD21 . 31080 1 1513 . 1 . 1 141 141 LEU HD22 H 1 0.824 0.000 . 2 . . . . A 141 LEU HD22 . 31080 1 1514 . 1 . 1 141 141 LEU HD23 H 1 0.824 0.000 . 2 . . . . A 141 LEU HD23 . 31080 1 1515 . 1 . 1 141 141 LEU C C 13 177.779 0.000 . 1 . . . . A 141 LEU C . 31080 1 1516 . 1 . 1 141 141 LEU CA C 13 54.670 0.013 . 1 . . . . A 141 LEU CA . 31080 1 1517 . 1 . 1 141 141 LEU CB C 13 43.028 0.056 . 1 . . . . A 141 LEU CB . 31080 1 1518 . 1 . 1 141 141 LEU CD1 C 13 22.152 0.029 . 2 . . . . A 141 LEU CD1 . 31080 1 1519 . 1 . 1 141 141 LEU CD2 C 13 26.247 0.001 . 2 . . . . A 141 LEU CD2 . 31080 1 1520 . 1 . 1 141 141 LEU N N 15 119.907 0.079 . 1 . . . . A 141 LEU N . 31080 1 1521 . 1 . 1 142 142 ARG H H 1 8.859 0.020 . 1 . . . . A 142 ARG H . 31080 1 1522 . 1 . 1 142 142 ARG HA H 1 4.376 0.009 . 1 . . . . A 142 ARG HA . 31080 1 1523 . 1 . 1 142 142 ARG HB2 H 1 1.753 0.000 . 2 . . . . A 142 ARG HB2 . 31080 1 1524 . 1 . 1 142 142 ARG HB3 H 1 1.872 0.000 . 2 . . . . A 142 ARG HB3 . 31080 1 1525 . 1 . 1 142 142 ARG HG2 H 1 1.600 0.000 . 2 . . . . A 142 ARG HG2 . 31080 1 1526 . 1 . 1 142 142 ARG HG3 H 1 1.627 0.000 . 2 . . . . A 142 ARG HG3 . 31080 1 1527 . 1 . 1 142 142 ARG HD2 H 1 3.204 0.020 . 1 . . . . A 142 ARG HD2 . 31080 1 1528 . 1 . 1 142 142 ARG HE H 1 7.204 0.003 . 1 . . . . A 142 ARG HE . 31080 1 1529 . 1 . 1 142 142 ARG C C 13 176.943 0.008 . 1 . . . . A 142 ARG C . 31080 1 1530 . 1 . 1 142 142 ARG CA C 13 55.134 0.075 . 1 . . . . A 142 ARG CA . 31080 1 1531 . 1 . 1 142 142 ARG CB C 13 30.894 0.064 . 1 . . . . A 142 ARG CB . 31080 1 1532 . 1 . 1 142 142 ARG CG C 13 27.940 0.010 . 1 . . . . A 142 ARG CG . 31080 1 1533 . 1 . 1 142 142 ARG CD C 13 43.301 0.052 . 1 . . . . A 142 ARG CD . 31080 1 1534 . 1 . 1 142 142 ARG N N 15 122.127 0.050 . 1 . . . . A 142 ARG N . 31080 1 1535 . 1 . 1 142 142 ARG NE N 15 85.031 0.084 . 1 . . . . A 142 ARG NE . 31080 1 1536 . 1 . 1 143 143 THR H H 1 8.477 0.023 . 1 . . . . A 143 THR H . 31080 1 1537 . 1 . 1 143 143 THR HA H 1 3.229 0.002 . 1 . . . . A 143 THR HA . 31080 1 1538 . 1 . 1 143 143 THR HB H 1 3.876 0.005 . 1 . . . . A 143 THR HB . 31080 1 1539 . 1 . 1 143 143 THR HG21 H 1 1.012 0.000 . 1 . . . . A 143 THR HG21 . 31080 1 1540 . 1 . 1 143 143 THR HG22 H 1 1.012 0.000 . 1 . . . . A 143 THR HG22 . 31080 1 1541 . 1 . 1 143 143 THR HG23 H 1 1.012 0.000 . 1 . . . . A 143 THR HG23 . 31080 1 1542 . 1 . 1 143 143 THR C C 13 175.710 0.000 . 1 . . . . A 143 THR C . 31080 1 1543 . 1 . 1 143 143 THR CA C 13 66.402 0.063 . 1 . . . . A 143 THR CA . 31080 1 1544 . 1 . 1 143 143 THR CB C 13 67.525 0.058 . 1 . . . . A 143 THR CB . 31080 1 1545 . 1 . 1 143 143 THR CG2 C 13 22.819 0.042 . 1 . . . . A 143 THR CG2 . 31080 1 1546 . 1 . 1 143 143 THR N N 15 117.049 0.056 . 1 . . . . A 143 THR N . 31080 1 1547 . 1 . 1 144 144 GLY H H 1 8.912 0.022 . 1 . . . . A 144 GLY H . 31080 1 1548 . 1 . 1 144 144 GLY HA2 H 1 4.238 0.008 . 2 . . . . A 144 GLY HA2 . 31080 1 1549 . 1 . 1 144 144 GLY HA3 H 1 3.685 0.000 . 2 . . . . A 144 GLY HA3 . 31080 1 1550 . 1 . 1 144 144 GLY C C 13 173.155 0.004 . 1 . . . . A 144 GLY C . 31080 1 1551 . 1 . 1 144 144 GLY CA C 13 45.142 0.012 . 1 . . . . A 144 GLY CA . 31080 1 1552 . 1 . 1 144 144 GLY N N 15 115.757 0.046 . 1 . . . . A 144 GLY N . 31080 1 1553 . 1 . 1 145 145 GLU H H 1 8.147 0.030 . 1 . . . . A 145 GLU H . 31080 1 1554 . 1 . 1 145 145 GLU HA H 1 4.347 0.008 . 1 . . . . A 145 GLU HA . 31080 1 1555 . 1 . 1 145 145 GLU HB2 H 1 2.194 0.003 . 2 . . . . A 145 GLU HB2 . 31080 1 1556 . 1 . 1 145 145 GLU HB3 H 1 2.248 0.000 . 2 . . . . A 145 GLU HB3 . 31080 1 1557 . 1 . 1 145 145 GLU C C 13 172.959 0.009 . 1 . . . . A 145 GLU C . 31080 1 1558 . 1 . 1 145 145 GLU CA C 13 55.681 0.039 . 1 . . . . A 145 GLU CA . 31080 1 1559 . 1 . 1 145 145 GLU CB C 13 32.283 0.029 . 1 . . . . A 145 GLU CB . 31080 1 1560 . 1 . 1 145 145 GLU CG C 13 36.879 0.000 . 1 . . . . A 145 GLU CG . 31080 1 1561 . 1 . 1 145 145 GLU N N 15 122.154 0.067 . 1 . . . . A 145 GLU N . 31080 1 1562 . 1 . 1 146 146 MET H H 1 8.207 0.028 . 1 . . . . A 146 MET H . 31080 1 1563 . 1 . 1 146 146 MET HA H 1 5.638 0.005 . 1 . . . . A 146 MET HA . 31080 1 1564 . 1 . 1 146 146 MET HB2 H 1 1.820 0.000 . 1 . . . . A 146 MET HB2 . 31080 1 1565 . 1 . 1 146 146 MET HG2 H 1 3.060 0.000 . 2 . . . . A 146 MET HG2 . 31080 1 1566 . 1 . 1 146 146 MET HG3 H 1 2.356 0.000 . 2 . . . . A 146 MET HG3 . 31080 1 1567 . 1 . 1 146 146 MET HE1 H 1 2.242 0.000 . 1 . . . . A 146 MET HE1 . 31080 1 1568 . 1 . 1 146 146 MET HE2 H 1 2.242 0.000 . 1 . . . . A 146 MET HE2 . 31080 1 1569 . 1 . 1 146 146 MET HE3 H 1 2.242 0.000 . 1 . . . . A 146 MET HE3 . 31080 1 1570 . 1 . 1 146 146 MET C C 13 176.301 0.009 . 1 . . . . A 146 MET C . 31080 1 1571 . 1 . 1 146 146 MET CA C 13 53.043 0.063 . 1 . . . . A 146 MET CA . 31080 1 1572 . 1 . 1 146 146 MET CB C 13 37.570 0.043 . 1 . . . . A 146 MET CB . 31080 1 1573 . 1 . 1 146 146 MET CG C 13 31.476 0.019 . 1 . . . . A 146 MET CG . 31080 1 1574 . 1 . 1 146 146 MET CE C 13 17.052 0.000 . 1 . . . . A 146 MET CE . 31080 1 1575 . 1 . 1 146 146 MET N N 15 122.952 0.100 . 1 . . . . A 146 MET N . 31080 1 1576 . 1 . 1 147 147 SER H H 1 9.693 0.024 . 1 . . . . A 147 SER H . 31080 1 1577 . 1 . 1 147 147 SER HA H 1 4.363 0.008 . 1 . . . . A 147 SER HA . 31080 1 1578 . 1 . 1 147 147 SER HB2 H 1 3.733 0.002 . 1 . . . . A 147 SER HB2 . 31080 1 1579 . 1 . 1 147 147 SER C C 13 174.771 0.015 . 1 . . . . A 147 SER C . 31080 1 1580 . 1 . 1 147 147 SER CA C 13 59.343 0.032 . 1 . . . . A 147 SER CA . 31080 1 1581 . 1 . 1 147 147 SER CB C 13 65.217 0.043 . 1 . . . . A 147 SER CB . 31080 1 1582 . 1 . 1 147 147 SER N N 15 123.578 0.063 . 1 . . . . A 147 SER N . 31080 1 1583 . 1 . 1 148 148 GLY H H 1 7.755 0.026 . 1 . . . . A 148 GLY H . 31080 1 1584 . 1 . 1 148 148 GLY HA2 H 1 4.502 0.008 . 2 . . . . A 148 GLY HA2 . 31080 1 1585 . 1 . 1 148 148 GLY HA3 H 1 4.445 0.000 . 2 . . . . A 148 GLY HA3 . 31080 1 1586 . 1 . 1 148 148 GLY C C 13 171.220 0.000 . 1 . . . . A 148 GLY C . 31080 1 1587 . 1 . 1 148 148 GLY CA C 13 44.575 0.007 . 1 . . . . A 148 GLY CA . 31080 1 1588 . 1 . 1 148 148 GLY N N 15 103.226 0.059 . 1 . . . . A 148 GLY N . 31080 1 1589 . 1 . 1 149 149 PRO HA H 1 4.349 0.000 . 1 . . . . A 149 PRO HA . 31080 1 1590 . 1 . 1 149 149 PRO HB2 H 1 1.784 0.000 . 2 . . . . A 149 PRO HB2 . 31080 1 1591 . 1 . 1 149 149 PRO HB3 H 1 1.673 0.000 . 2 . . . . A 149 PRO HB3 . 31080 1 1592 . 1 . 1 149 149 PRO HG2 H 1 2.277 0.000 . 2 . . . . A 149 PRO HG2 . 31080 1 1593 . 1 . 1 149 149 PRO HG3 H 1 1.759 0.000 . 2 . . . . A 149 PRO HG3 . 31080 1 1594 . 1 . 1 149 149 PRO HD2 H 1 3.610 0.000 . 2 . . . . A 149 PRO HD2 . 31080 1 1595 . 1 . 1 149 149 PRO HD3 H 1 3.554 0.000 . 2 . . . . A 149 PRO HD3 . 31080 1 1596 . 1 . 1 149 149 PRO C C 13 176.948 0.006 . 1 . . . . A 149 PRO C . 31080 1 1597 . 1 . 1 149 149 PRO CA C 13 63.761 0.041 . 1 . . . . A 149 PRO CA . 31080 1 1598 . 1 . 1 149 149 PRO CB C 13 31.459 0.077 . 1 . . . . A 149 PRO CB . 31080 1 1599 . 1 . 1 149 149 PRO CG C 13 28.087 0.064 . 1 . . . . A 149 PRO CG . 31080 1 1600 . 1 . 1 149 149 PRO CD C 13 49.069 0.006 . 1 . . . . A 149 PRO CD . 31080 1 1601 . 1 . 1 150 150 VAL H H 1 9.235 0.024 . 1 . . . . A 150 VAL H . 31080 1 1602 . 1 . 1 150 150 VAL HA H 1 4.322 0.012 . 1 . . . . A 150 VAL HA . 31080 1 1603 . 1 . 1 150 150 VAL HB H 1 1.740 0.000 . 1 . . . . A 150 VAL HB . 31080 1 1604 . 1 . 1 150 150 VAL HG11 H 1 0.702 0.000 . 2 . . . . A 150 VAL HG11 . 31080 1 1605 . 1 . 1 150 150 VAL HG12 H 1 0.702 0.000 . 2 . . . . A 150 VAL HG12 . 31080 1 1606 . 1 . 1 150 150 VAL HG13 H 1 0.702 0.000 . 2 . . . . A 150 VAL HG13 . 31080 1 1607 . 1 . 1 150 150 VAL HG21 H 1 0.933 0.000 . 2 . . . . A 150 VAL HG21 . 31080 1 1608 . 1 . 1 150 150 VAL HG22 H 1 0.933 0.000 . 2 . . . . A 150 VAL HG22 . 31080 1 1609 . 1 . 1 150 150 VAL HG23 H 1 0.933 0.000 . 2 . . . . A 150 VAL HG23 . 31080 1 1610 . 1 . 1 150 150 VAL C C 13 174.876 0.007 . 1 . . . . A 150 VAL C . 31080 1 1611 . 1 . 1 150 150 VAL CA C 13 61.611 0.041 . 1 . . . . A 150 VAL CA . 31080 1 1612 . 1 . 1 150 150 VAL CB C 13 35.194 0.013 . 1 . . . . A 150 VAL CB . 31080 1 1613 . 1 . 1 150 150 VAL CG1 C 13 20.382 0.000 . 2 . . . . A 150 VAL CG1 . 31080 1 1614 . 1 . 1 150 150 VAL CG2 C 13 20.806 0.056 . 2 . . . . A 150 VAL CG2 . 31080 1 1615 . 1 . 1 150 150 VAL N N 15 127.567 0.059 . 1 . . . . A 150 VAL N . 31080 1 1616 . 1 . 1 151 151 PHE H H 1 9.081 0.023 . 1 . . . . A 151 PHE H . 31080 1 1617 . 1 . 1 151 151 PHE HA H 1 5.100 0.007 . 1 . . . . A 151 PHE HA . 31080 1 1618 . 1 . 1 151 151 PHE HB2 H 1 3.116 0.010 . 2 . . . . A 151 PHE HB2 . 31080 1 1619 . 1 . 1 151 151 PHE HB3 H 1 3.086 0.012 . 2 . . . . A 151 PHE HB3 . 31080 1 1620 . 1 . 1 151 151 PHE HD1 H 1 7.413 0.000 . 1 . . . . A 151 PHE HD1 . 31080 1 1621 . 1 . 1 151 151 PHE HD2 H 1 7.413 0.000 . 1 . . . . A 151 PHE HD2 . 31080 1 1622 . 1 . 1 151 151 PHE HE1 H 1 7.212 0.000 . 1 . . . . A 151 PHE HE1 . 31080 1 1623 . 1 . 1 151 151 PHE HE2 H 1 7.212 0.000 . 1 . . . . A 151 PHE HE2 . 31080 1 1624 . 1 . 1 151 151 PHE C C 13 175.930 0.003 . 1 . . . . A 151 PHE C . 31080 1 1625 . 1 . 1 151 151 PHE CA C 13 58.003 0.051 . 1 . . . . A 151 PHE CA . 31080 1 1626 . 1 . 1 151 151 PHE CB C 13 39.754 0.048 . 1 . . . . A 151 PHE CB . 31080 1 1627 . 1 . 1 151 151 PHE CD1 C 13 132.448 0.000 . 1 . . . . A 151 PHE CD1 . 31080 1 1628 . 1 . 1 151 151 PHE CD2 C 13 132.448 0.000 . 1 . . . . A 151 PHE CD2 . 31080 1 1629 . 1 . 1 151 151 PHE CE1 C 13 130.955 0.000 . 1 . . . . A 151 PHE CE1 . 31080 1 1630 . 1 . 1 151 151 PHE CE2 C 13 130.955 0.000 . 1 . . . . A 151 PHE CE2 . 31080 1 1631 . 1 . 1 151 151 PHE N N 15 127.782 0.072 . 1 . . . . A 151 PHE N . 31080 1 1632 . 1 . 1 152 152 THR H H 1 9.032 0.025 . 1 . . . . A 152 THR H . 31080 1 1633 . 1 . 1 152 152 THR HA H 1 4.990 0.002 . 1 . . . . A 152 THR HA . 31080 1 1634 . 1 . 1 152 152 THR HB H 1 4.988 0.028 . 1 . . . . A 152 THR HB . 31080 1 1635 . 1 . 1 152 152 THR HG21 H 1 1.276 0.000 . 1 . . . . A 152 THR HG21 . 31080 1 1636 . 1 . 1 152 152 THR HG22 H 1 1.276 0.000 . 1 . . . . A 152 THR HG22 . 31080 1 1637 . 1 . 1 152 152 THR HG23 H 1 1.276 0.000 . 1 . . . . A 152 THR HG23 . 31080 1 1638 . 1 . 1 152 152 THR C C 13 175.590 0.002 . 1 . . . . A 152 THR C . 31080 1 1639 . 1 . 1 152 152 THR CA C 13 60.747 0.027 . 1 . . . . A 152 THR CA . 31080 1 1640 . 1 . 1 152 152 THR CB C 13 72.507 0.028 . 1 . . . . A 152 THR CB . 31080 1 1641 . 1 . 1 152 152 THR CG2 C 13 21.267 0.020 . 1 . . . . A 152 THR CG2 . 31080 1 1642 . 1 . 1 152 152 THR N N 15 113.025 0.062 . 1 . . . . A 152 THR N . 31080 1 1643 . 1 . 1 153 153 ASP H H 1 9.064 0.029 . 1 . . . . A 153 ASP H . 31080 1 1644 . 1 . 1 153 153 ASP HA H 1 4.710 0.002 . 1 . . . . A 153 ASP HA . 31080 1 1645 . 1 . 1 153 153 ASP HB2 H 1 2.876 0.004 . 1 . . . . A 153 ASP HB2 . 31080 1 1646 . 1 . 1 153 153 ASP C C 13 178.467 0.010 . 1 . . . . A 153 ASP C . 31080 1 1647 . 1 . 1 153 153 ASP CA C 13 56.400 0.012 . 1 . . . . A 153 ASP CA . 31080 1 1648 . 1 . 1 153 153 ASP CB C 13 40.412 0.027 . 1 . . . . A 153 ASP CB . 31080 1 1649 . 1 . 1 153 153 ASP N N 15 117.872 0.068 . 1 . . . . A 153 ASP N . 31080 1 1650 . 1 . 1 154 154 SER H H 1 8.927 0.024 . 1 . . . . A 154 SER H . 31080 1 1651 . 1 . 1 154 154 SER HA H 1 4.666 0.000 . 1 . . . . A 154 SER HA . 31080 1 1652 . 1 . 1 154 154 SER HB2 H 1 3.932 0.007 . 2 . . . . A 154 SER HB2 . 31080 1 1653 . 1 . 1 154 154 SER HB3 H 1 3.872 0.014 . 2 . . . . A 154 SER HB3 . 31080 1 1654 . 1 . 1 154 154 SER C C 13 175.620 0.000 . 1 . . . . A 154 SER C . 31080 1 1655 . 1 . 1 154 154 SER CA C 13 61.717 0.060 . 1 . . . . A 154 SER CA . 31080 1 1656 . 1 . 1 154 154 SER CB C 13 63.287 0.089 . 1 . . . . A 154 SER CB . 31080 1 1657 . 1 . 1 154 154 SER N N 15 115.277 0.035 . 1 . . . . A 154 SER N . 31080 1 1658 . 1 . 1 155 155 GLY H H 1 7.687 0.026 . 1 . . . . A 155 GLY H . 31080 1 1659 . 1 . 1 155 155 GLY HA2 H 1 3.952 0.008 . 1 . . . . A 155 GLY HA2 . 31080 1 1660 . 1 . 1 155 155 GLY C C 13 168.776 0.007 . 1 . . . . A 155 GLY C . 31080 1 1661 . 1 . 1 155 155 GLY CA C 13 45.477 0.065 . 1 . . . . A 155 GLY CA . 31080 1 1662 . 1 . 1 155 155 GLY N N 15 110.510 0.050 . 1 . . . . A 155 GLY N . 31080 1 1663 . 1 . 1 156 156 ILE H H 1 8.247 0.032 . 1 . . . . A 156 ILE H . 31080 1 1664 . 1 . 1 156 156 ILE HA H 1 5.000 0.011 . 1 . . . . A 156 ILE HA . 31080 1 1665 . 1 . 1 156 156 ILE HB H 1 1.493 0.014 . 1 . . . . A 156 ILE HB . 31080 1 1666 . 1 . 1 156 156 ILE HG12 H 1 1.639 0.006 . 1 . . . . A 156 ILE HG12 . 31080 1 1667 . 1 . 1 156 156 ILE HG21 H 1 0.438 0.007 . 1 . . . . A 156 ILE HG21 . 31080 1 1668 . 1 . 1 156 156 ILE HG22 H 1 0.438 0.007 . 1 . . . . A 156 ILE HG22 . 31080 1 1669 . 1 . 1 156 156 ILE HG23 H 1 0.438 0.007 . 1 . . . . A 156 ILE HG23 . 31080 1 1670 . 1 . 1 156 156 ILE HD11 H 1 0.763 0.011 . 1 . . . . A 156 ILE HD11 . 31080 1 1671 . 1 . 1 156 156 ILE HD12 H 1 0.763 0.011 . 1 . . . . A 156 ILE HD12 . 31080 1 1672 . 1 . 1 156 156 ILE HD13 H 1 0.763 0.011 . 1 . . . . A 156 ILE HD13 . 31080 1 1673 . 1 . 1 156 156 ILE C C 13 173.693 0.013 . 1 . . . . A 156 ILE C . 31080 1 1674 . 1 . 1 156 156 ILE CA C 13 60.047 0.032 . 1 . . . . A 156 ILE CA . 31080 1 1675 . 1 . 1 156 156 ILE CB C 13 39.254 0.054 . 1 . . . . A 156 ILE CB . 31080 1 1676 . 1 . 1 156 156 ILE CG1 C 13 26.777 0.013 . 1 . . . . A 156 ILE CG1 . 31080 1 1677 . 1 . 1 156 156 ILE CG2 C 13 18.261 0.024 . 1 . . . . A 156 ILE CG2 . 31080 1 1678 . 1 . 1 156 156 ILE CD1 C 13 15.486 0.025 . 1 . . . . A 156 ILE CD1 . 31080 1 1679 . 1 . 1 156 156 ILE N N 15 123.074 0.087 . 1 . . . . A 156 ILE N . 31080 1 1680 . 1 . 1 157 157 HIS H H 1 9.905 0.025 . 1 . . . . A 157 HIS H . 31080 1 1681 . 1 . 1 157 157 HIS HA H 1 5.958 0.008 . 1 . . . . A 157 HIS HA . 31080 1 1682 . 1 . 1 157 157 HIS HB2 H 1 3.060 0.000 . 2 . . . . A 157 HIS HB2 . 31080 1 1683 . 1 . 1 157 157 HIS HB3 H 1 2.893 0.000 . 2 . . . . A 157 HIS HB3 . 31080 1 1684 . 1 . 1 157 157 HIS HD2 H 1 7.090 0.000 . 1 . . . . A 157 HIS HD2 . 31080 1 1685 . 1 . 1 157 157 HIS C C 13 176.811 0.001 . 1 . . . . A 157 HIS C . 31080 1 1686 . 1 . 1 157 157 HIS CA C 13 53.931 0.033 . 1 . . . . A 157 HIS CA . 31080 1 1687 . 1 . 1 157 157 HIS CB C 13 32.085 0.026 . 1 . . . . A 157 HIS CB . 31080 1 1688 . 1 . 1 157 157 HIS CD2 C 13 130.311 0.000 . 1 . . . . A 157 HIS CD2 . 31080 1 1689 . 1 . 1 157 157 HIS N N 15 124.606 0.065 . 1 . . . . A 157 HIS N . 31080 1 1690 . 1 . 1 158 158 ILE H H 1 8.507 0.026 . 1 . . . . A 158 ILE H . 31080 1 1691 . 1 . 1 158 158 ILE HA H 1 4.171 0.009 . 1 . . . . A 158 ILE HA . 31080 1 1692 . 1 . 1 158 158 ILE HB H 1 1.752 0.010 . 1 . . . . A 158 ILE HB . 31080 1 1693 . 1 . 1 158 158 ILE HG12 H 1 1.876 0.000 . 1 . . . . A 158 ILE HG12 . 31080 1 1694 . 1 . 1 158 158 ILE HG21 H 1 1.055 0.000 . 1 . . . . A 158 ILE HG21 . 31080 1 1695 . 1 . 1 158 158 ILE HG22 H 1 1.055 0.000 . 1 . . . . A 158 ILE HG22 . 31080 1 1696 . 1 . 1 158 158 ILE HG23 H 1 1.055 0.000 . 1 . . . . A 158 ILE HG23 . 31080 1 1697 . 1 . 1 158 158 ILE HD11 H 1 1.002 0.000 . 1 . . . . A 158 ILE HD11 . 31080 1 1698 . 1 . 1 158 158 ILE HD12 H 1 1.002 0.000 . 1 . . . . A 158 ILE HD12 . 31080 1 1699 . 1 . 1 158 158 ILE HD13 H 1 1.002 0.000 . 1 . . . . A 158 ILE HD13 . 31080 1 1700 . 1 . 1 158 158 ILE C C 13 175.284 0.002 . 1 . . . . A 158 ILE C . 31080 1 1701 . 1 . 1 158 158 ILE CA C 13 62.431 0.060 . 1 . . . . A 158 ILE CA . 31080 1 1702 . 1 . 1 158 158 ILE CB C 13 41.651 0.063 . 1 . . . . A 158 ILE CB . 31080 1 1703 . 1 . 1 158 158 ILE CG1 C 13 26.776 0.000 . 1 . . . . A 158 ILE CG1 . 31080 1 1704 . 1 . 1 158 158 ILE CG2 C 13 19.322 0.053 . 1 . . . . A 158 ILE CG2 . 31080 1 1705 . 1 . 1 158 158 ILE CD1 C 13 14.686 0.000 . 1 . . . . A 158 ILE CD1 . 31080 1 1706 . 1 . 1 158 158 ILE N N 15 115.788 0.069 . 1 . . . . A 158 ILE N . 31080 1 1707 . 1 . 1 159 159 ILE H H 1 8.844 0.024 . 1 . . . . A 159 ILE H . 31080 1 1708 . 1 . 1 159 159 ILE HA H 1 4.679 0.005 . 1 . . . . A 159 ILE HA . 31080 1 1709 . 1 . 1 159 159 ILE HB H 1 1.283 0.024 . 1 . . . . A 159 ILE HB . 31080 1 1710 . 1 . 1 159 159 ILE HG12 H 1 0.541 0.000 . 1 . . . . A 159 ILE HG12 . 31080 1 1711 . 1 . 1 159 159 ILE HG21 H 1 0.755 0.011 . 1 . . . . A 159 ILE HG21 . 31080 1 1712 . 1 . 1 159 159 ILE HG22 H 1 0.755 0.011 . 1 . . . . A 159 ILE HG22 . 31080 1 1713 . 1 . 1 159 159 ILE HG23 H 1 0.755 0.011 . 1 . . . . A 159 ILE HG23 . 31080 1 1714 . 1 . 1 159 159 ILE HD11 H 1 -0.065 0.009 . 1 . . . . A 159 ILE HD11 . 31080 1 1715 . 1 . 1 159 159 ILE HD12 H 1 -0.065 0.009 . 1 . . . . A 159 ILE HD12 . 31080 1 1716 . 1 . 1 159 159 ILE HD13 H 1 -0.065 0.009 . 1 . . . . A 159 ILE HD13 . 31080 1 1717 . 1 . 1 159 159 ILE C C 13 172.658 0.011 . 1 . . . . A 159 ILE C . 31080 1 1718 . 1 . 1 159 159 ILE CA C 13 60.922 0.062 . 1 . . . . A 159 ILE CA . 31080 1 1719 . 1 . 1 159 159 ILE CB C 13 41.826 0.053 . 1 . . . . A 159 ILE CB . 31080 1 1720 . 1 . 1 159 159 ILE CG1 C 13 27.852 0.045 . 1 . . . . A 159 ILE CG1 . 31080 1 1721 . 1 . 1 159 159 ILE CG2 C 13 18.093 0.072 . 1 . . . . A 159 ILE CG2 . 31080 1 1722 . 1 . 1 159 159 ILE CD1 C 13 14.679 0.034 . 1 . . . . A 159 ILE CD1 . 31080 1 1723 . 1 . 1 159 159 ILE N N 15 125.720 0.054 . 1 . . . . A 159 ILE N . 31080 1 1724 . 1 . 1 160 160 LEU H H 1 8.813 0.021 . 1 . . . . A 160 LEU H . 31080 1 1725 . 1 . 1 160 160 LEU HA H 1 4.822 0.012 . 1 . . . . A 160 LEU HA . 31080 1 1726 . 1 . 1 160 160 LEU HB2 H 1 0.021 0.007 . 2 . . . . A 160 LEU HB2 . 31080 1 1727 . 1 . 1 160 160 LEU HB3 H 1 0.762 0.006 . 2 . . . . A 160 LEU HB3 . 31080 1 1728 . 1 . 1 160 160 LEU HG H 1 1.029 0.000 . 1 . . . . A 160 LEU HG . 31080 1 1729 . 1 . 1 160 160 LEU HD11 H 1 0.466 0.001 . 2 . . . . A 160 LEU HD11 . 31080 1 1730 . 1 . 1 160 160 LEU HD12 H 1 0.466 0.001 . 2 . . . . A 160 LEU HD12 . 31080 1 1731 . 1 . 1 160 160 LEU HD13 H 1 0.466 0.001 . 2 . . . . A 160 LEU HD13 . 31080 1 1732 . 1 . 1 160 160 LEU HD21 H 1 0.325 0.000 . 2 . . . . A 160 LEU HD21 . 31080 1 1733 . 1 . 1 160 160 LEU HD22 H 1 0.325 0.000 . 2 . . . . A 160 LEU HD22 . 31080 1 1734 . 1 . 1 160 160 LEU HD23 H 1 0.325 0.000 . 2 . . . . A 160 LEU HD23 . 31080 1 1735 . 1 . 1 160 160 LEU C C 13 175.380 0.016 . 1 . . . . A 160 LEU C . 31080 1 1736 . 1 . 1 160 160 LEU CA C 13 52.926 0.078 . 1 . . . . A 160 LEU CA . 31080 1 1737 . 1 . 1 160 160 LEU CB C 13 45.573 0.057 . 1 . . . . A 160 LEU CB . 31080 1 1738 . 1 . 1 160 160 LEU CD1 C 13 22.617 0.000 . 2 . . . . A 160 LEU CD1 . 31080 1 1739 . 1 . 1 160 160 LEU CD2 C 13 25.808 0.040 . 2 . . . . A 160 LEU CD2 . 31080 1 1740 . 1 . 1 160 160 LEU N N 15 128.880 0.077 . 1 . . . . A 160 LEU N . 31080 1 1741 . 1 . 1 161 161 ARG H H 1 8.088 0.025 . 1 . . . . A 161 ARG H . 31080 1 1742 . 1 . 1 161 161 ARG HA H 1 5.119 0.014 . 1 . . . . A 161 ARG HA . 31080 1 1743 . 1 . 1 161 161 ARG HB2 H 1 2.072 0.000 . 1 . . . . A 161 ARG HB2 . 31080 1 1744 . 1 . 1 161 161 ARG HG2 H 1 0.784 0.000 . 2 . . . . A 161 ARG HG2 . 31080 1 1745 . 1 . 1 161 161 ARG HG3 H 1 1.109 0.000 . 2 . . . . A 161 ARG HG3 . 31080 1 1746 . 1 . 1 161 161 ARG HD2 H 1 3.199 0.000 . 2 . . . . A 161 ARG HD2 . 31080 1 1747 . 1 . 1 161 161 ARG HD3 H 1 2.860 0.000 . 2 . . . . A 161 ARG HD3 . 31080 1 1748 . 1 . 1 161 161 ARG HE H 1 7.778 0.003 . 1 . . . . A 161 ARG HE . 31080 1 1749 . 1 . 1 161 161 ARG C C 13 176.182 0.006 . 1 . . . . A 161 ARG C . 31080 1 1750 . 1 . 1 161 161 ARG CA C 13 56.508 0.050 . 1 . . . . A 161 ARG CA . 31080 1 1751 . 1 . 1 161 161 ARG CB C 13 30.040 0.015 . 1 . . . . A 161 ARG CB . 31080 1 1752 . 1 . 1 161 161 ARG CG C 13 29.817 0.003 . 1 . . . . A 161 ARG CG . 31080 1 1753 . 1 . 1 161 161 ARG CD C 13 43.019 0.011 . 1 . . . . A 161 ARG CD . 31080 1 1754 . 1 . 1 161 161 ARG N N 15 127.405 0.051 . 1 . . . . A 161 ARG N . 31080 1 1755 . 1 . 1 161 161 ARG NE N 15 88.324 0.052 . 1 . . . . A 161 ARG NE . 31080 1 1756 . 1 . 1 162 162 THR H H 1 9.073 0.026 . 1 . . . . A 162 THR H . 31080 1 1757 . 1 . 1 162 162 THR HA H 1 4.379 0.016 . 1 . . . . A 162 THR HA . 31080 1 1758 . 1 . 1 162 162 THR HB H 1 4.181 0.015 . 1 . . . . A 162 THR HB . 31080 1 1759 . 1 . 1 162 162 THR HG21 H 1 1.025 0.000 . 1 . . . . A 162 THR HG21 . 31080 1 1760 . 1 . 1 162 162 THR HG22 H 1 1.025 0.000 . 1 . . . . A 162 THR HG22 . 31080 1 1761 . 1 . 1 162 162 THR HG23 H 1 1.025 0.000 . 1 . . . . A 162 THR HG23 . 31080 1 1762 . 1 . 1 162 162 THR C C 13 175.425 0.028 . 1 . . . . A 162 THR C . 31080 1 1763 . 1 . 1 162 162 THR CA C 13 62.114 0.038 . 1 . . . . A 162 THR CA . 31080 1 1764 . 1 . 1 162 162 THR CB C 13 69.519 0.023 . 1 . . . . A 162 THR CB . 31080 1 1765 . 1 . 1 162 162 THR CG2 C 13 21.645 0.008 . 1 . . . . A 162 THR CG2 . 31080 1 1766 . 1 . 1 162 162 THR N N 15 121.059 0.068 . 1 . . . . A 162 THR N . 31080 1 1767 . 1 . 1 163 163 GLU H H 1 7.957 0.024 . 1 . . . . A 163 GLU H . 31080 1 1768 . 1 . 1 163 163 GLU HA H 1 4.114 0.004 . 1 . . . . A 163 GLU HA . 31080 1 1769 . 1 . 1 163 163 GLU HB2 H 1 1.963 0.013 . 2 . . . . A 163 GLU HB2 . 31080 1 1770 . 1 . 1 163 163 GLU HB3 H 1 1.761 0.009 . 2 . . . . A 163 GLU HB3 . 31080 1 1771 . 1 . 1 163 163 GLU HG2 H 1 2.371 0.002 . 2 . . . . A 163 GLU HG2 . 31080 1 1772 . 1 . 1 163 163 GLU HG3 H 1 2.174 0.000 . 2 . . . . A 163 GLU HG3 . 31080 1 1773 . 1 . 1 163 163 GLU C C 13 181.359 0.000 . 1 . . . . A 163 GLU C . 31080 1 1774 . 1 . 1 163 163 GLU CA C 13 58.329 0.029 . 1 . . . . A 163 GLU CA . 31080 1 1775 . 1 . 1 163 163 GLU CB C 13 33.482 0.089 . 1 . . . . A 163 GLU CB . 31080 1 1776 . 1 . 1 163 163 GLU N N 15 126.261 0.075 . 1 . . . . A 163 GLU N . 31080 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_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 31080 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name . _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 $chem_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 [15N,1H] HSQC' . . . 31080 2 2 '2D 1H-15N HSQC NH2' . . . 31080 2 3 '3D HNCO' . . . 31080 2 4 '3D HNCACB' . . . 31080 2 5 '3D C(CO)NH' . . . 31080 2 6 '3D CBCA(CO)NH' . . . 31080 2 7 '3D HNCACO' . . . 31080 2 8 '3D HNHA' . . . 31080 2 9 '3D HNHB' . . . 31080 2 10 '3D H(CCO)NH' . . . 31080 2 11 '3D 15N-EDITED NOESY- HSQC' . . . 31080 2 12 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 2 13 '3D [F1] 13C,15N-FILTERED NOESY-13C-HSQC' . . . 31080 2 14 '3D 13C-EDITED NOESY- HSQC' . . . 31080 2 15 '3D 13Caro-EDITED NOESY- HSQC' . . . 31080 2 16 '2D CT [13C, 1H] HSQC' . . . 31080 2 17 '2D CT 1H-13C AROMATIC HSQC' . . . 31080 2 18 '3D HCCH-TOCSY' . . . 31080 2 19 '3D HCCH-COSY' . . . 31080 2 20 '2D (HB)CB(CGCDCE)HE' . . . 31080 2 21 '2D (HB)CB(CGCD)HD' . . . 31080 2 22 '2D [F1] 13C, 15N- FILTERED NOESY' . . . 31080 2 23 '2D [F2] 13C,15N- FILTERED NOESY' . . . 31080 2 24 '2D [F1,F2] 13C,15N-FILTERED NOESY' . . . 31080 2 25 '2D [F1,F2] 13C,15N-FILTERED TOCSY' . . . 31080 2 26 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 2 27 '3D [F1] 13C, 15N-FILTERED NOESY- 13Caro-HSQC' . . . 31080 2 28 '2D [F1] 13C,15N- FILTERED NOESY' . . . 31080 2 29 '2D [F2] 13C,15N- FILTERED NOESY' . . . 31080 2 30 '2D [F1,F2] 13C,15N-FILTERED NOESY' . . . 31080 2 31 '2D [F1,F2] 13C,15N-FILTERED TOCSY' . . . 31080 2 32 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 2 33 '3D [F1] 13C, 15N-FILTERED NOESY- 13Caro-HSQC' . . . 31080 2 34 '3D [F1] 13C, 15N-FILTERED NOESY- 13Cali-HSQC' . . . 31080 2 35 '2D [15N,1H] HSQC' . . . 31080 2 36 '2D CT [13C, 1H] HSQC' . . . 31080 2 37 '3D HNCACB' . . . 31080 2 38 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 2 39 '3D [F1] 13C,15N-FILTERED NOESY-13C-HSQC' . . . 31080 2 40 '2D [15N,1H] HSQC' . . . 31080 2 41 '2D CT [13C, 1H] HSQC' . . . 31080 2 42 '3D [F1] 13C,15N-FILTERED NOESY-15N-HSQC' . . . 31080 2 43 '3D [F1] 13C,15N-FILTERED NOESY-13C-HSQC' . . . 31080 2 44 '2D [F1] 13C, 15N- FILTERED NOESY' . . . 31080 2 45 '2D [F2] 13C, 15N- FILTERED NOESY' . . . 31080 2 46 '2D [F1,F2] 13C,15N-FILTERED NOESY' . . . 31080 2 47 '2D [F1,F2] 13C,15N-FILTERED TOCSY' . . . 31080 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 . 2 3 3 LEU H H 1 7.59 0 . 1 . . . . B 640 LEU H . 31080 2 2 . 2 . 2 3 3 LEU HA H 1 4.283 0.001 . 1 . . . . B 640 LEU HA . 31080 2 3 . 2 . 2 3 3 LEU HB3 H 1 1.451 0 . 1 . . . . B 640 LEU HB3 . 31080 2 4 . 2 . 2 3 3 LEU HG H 1 1.445 0.001 . 1 . . . . B 640 LEU HG . 31080 2 5 . 2 . 2 3 3 LEU HD11 H 1 0.694 0 . 2 . . . . B 640 LEU HD11 . 31080 2 6 . 2 . 2 3 3 LEU HD12 H 1 0.694 0 . 2 . . . . B 640 LEU HD12 . 31080 2 7 . 2 . 2 3 3 LEU HD13 H 1 0.694 0 . 2 . . . . B 640 LEU HD13 . 31080 2 8 . 2 . 2 3 3 LEU HD21 H 1 0.734 0 . 2 . . . . B 640 LEU HD21 . 31080 2 9 . 2 . 2 3 3 LEU HD22 H 1 0.734 0 . 2 . . . . B 640 LEU HD22 . 31080 2 10 . 2 . 2 3 3 LEU HD23 H 1 0.734 0 . 2 . . . . B 640 LEU HD23 . 31080 2 11 . 2 . 2 4 4 TPO H H 1 8.326 0.001 . 1 . . . . B 641 TPO H . 31080 2 12 . 2 . 2 4 4 TPO HG21 H 1 1.66 0 . 1 . . . . B 641 TPO HG21 . 31080 2 13 . 2 . 2 4 4 TPO HG22 H 1 1.66 0 . 1 . . . . B 641 TPO HG22 . 31080 2 14 . 2 . 2 4 4 TPO HG23 H 1 1.66 0 . 1 . . . . B 641 TPO HG23 . 31080 2 15 . 2 . 2 5 5 PRO HA H 1 4.341 0.003 . 1 . . . . B 642 PRO HA . 31080 2 16 . 2 . 2 5 5 PRO HB2 H 1 1.966 0.001 . 2 . . . . B 642 PRO HB2 . 31080 2 17 . 2 . 2 5 5 PRO HB3 H 1 1.091 0 . 2 . . . . B 642 PRO HB3 . 31080 2 18 . 2 . 2 5 5 PRO HG2 H 1 0.921 0.003 . 2 . . . . B 642 PRO HG2 . 31080 2 19 . 2 . 2 5 5 PRO HG3 H 1 0.148 0 . 2 . . . . B 642 PRO HG3 . 31080 2 20 . 2 . 2 5 5 PRO HD2 H 1 3.53 0 . 2 . . . . B 642 PRO HD2 . 31080 2 21 . 2 . 2 5 5 PRO HD3 H 1 3.683 0 . 2 . . . . B 642 PRO HD3 . 31080 2 22 . 2 . 2 5 5 PRO CA C 13 61.302 0.037 . 1 . . . . B 642 PRO CA . 31080 2 23 . 2 . 2 5 5 PRO CB C 13 29.542 0.053 . 1 . . . . B 642 PRO CB . 31080 2 24 . 2 . 2 5 5 PRO CG C 13 26.034 0.087 . 1 . . . . B 642 PRO CG . 31080 2 25 . 2 . 2 5 5 PRO CD C 13 50.087 0.001 . 1 . . . . B 642 PRO CD . 31080 2 26 . 2 . 2 6 6 PRO HA H 1 4.194 0.77 . 1 . . . . B 643 PRO HA . 31080 2 27 . 2 . 2 6 6 PRO HB2 H 1 2.322 0.001 . 2 . . . . B 643 PRO HB2 . 31080 2 28 . 2 . 2 6 6 PRO HB3 H 1 1.937 0.002 . 2 . . . . B 643 PRO HB3 . 31080 2 29 . 2 . 2 6 6 PRO HG2 H 1 1.937 0.001 . 2 . . . . B 643 PRO HG2 . 31080 2 30 . 2 . 2 6 6 PRO HG3 H 1 2.219 0.677 . 2 . . . . B 643 PRO HG3 . 31080 2 31 . 2 . 2 6 6 PRO HD2 H 1 3.543 0.003 . 2 . . . . B 643 PRO HD2 . 31080 2 32 . 2 . 2 6 6 PRO HD3 H 1 3.713 0.002 . 2 . . . . B 643 PRO HD3 . 31080 2 33 . 2 . 2 6 6 PRO CA C 13 62.693 0.011 . 1 . . . . B 643 PRO CA . 31080 2 34 . 2 . 2 6 6 PRO CB C 13 32.175 0.032 . 1 . . . . B 643 PRO CB . 31080 2 35 . 2 . 2 6 6 PRO CG C 13 27.493 0.016 . 1 . . . . B 643 PRO CG . 31080 2 36 . 2 . 2 6 6 PRO CD C 13 50.074 0.022 . 1 . . . . B 643 PRO CD . 31080 2 37 . 2 . 2 7 7 ASP H H 1 8.684 0 . 1 . . . . B 644 ASP H . 31080 2 38 . 2 . 2 7 7 ASP HA H 1 4.673 0 . 1 . . . . B 644 ASP HA . 31080 2 39 . 2 . 2 7 7 ASP HB2 H 1 2.731 0 . 2 . . . . B 644 ASP HB2 . 31080 2 40 . 2 . 2 7 7 ASP HB3 H 1 2.666 0 . 2 . . . . B 644 ASP HB3 . 31080 2 41 . 2 . 2 8 8 GLN H H 1 8.307 0 . 1 . . . . B 645 GLN H . 31080 2 42 . 2 . 2 8 8 GLN HA H 1 4.364 0 . 1 . . . . B 645 GLN HA . 31080 2 43 . 2 . 2 8 8 GLN HB2 H 1 1.94 0 . 2 . . . . B 645 GLN HB2 . 31080 2 44 . 2 . 2 8 8 GLN HB3 H 1 2.102 0 . 2 . . . . B 645 GLN HB3 . 31080 2 45 . 2 . 2 8 8 GLN HG2 H 1 2.38 0 . 1 . . . . B 645 GLN HG2 . 31080 2 46 . 2 . 2 8 8 GLN HE21 H 1 7.6 0 . 1 . . . . B 645 GLN HE21 . 31080 2 47 . 2 . 2 8 8 GLN HE22 H 1 7.001 0 . 1 . . . . B 645 GLN HE22 . 31080 2 48 . 2 . 2 9 9 GLU H H 1 8.507 0 . 1 . . . . B 646 GLU H . 31080 2 49 . 2 . 2 9 9 GLU HA H 1 4.272 0 . 1 . . . . B 646 GLU HA . 31080 2 50 . 2 . 2 9 9 GLU HB2 H 1 1.932 0 . 2 . . . . B 646 GLU HB2 . 31080 2 51 . 2 . 2 9 9 GLU HB3 H 1 2.02 0 . 2 . . . . B 646 GLU HB3 . 31080 2 52 . 2 . 2 9 9 GLU HG2 H 1 2.216 0 . 2 . . . . B 646 GLU HG2 . 31080 2 53 . 2 . 2 9 9 GLU HG3 H 1 2.267 0 . 2 . . . . B 646 GLU HG3 . 31080 2 54 . 2 . 2 10 10 VAL H H 1 8.134 0 . 1 . . . . B 647 VAL H . 31080 2 55 . 2 . 2 10 10 VAL HA H 1 4.044 0.002 . 1 . . . . B 647 VAL HA . 31080 2 56 . 2 . 2 10 10 VAL HB H 1 2.019 0.002 . 1 . . . . B 647 VAL HB . 31080 2 57 . 2 . 2 10 10 VAL HG11 H 1 0.888 0.017 . 2 . . . . B 647 VAL HG11 . 31080 2 58 . 2 . 2 10 10 VAL HG12 H 1 0.888 0.017 . 2 . . . . B 647 VAL HG12 . 31080 2 59 . 2 . 2 10 10 VAL HG13 H 1 0.888 0.017 . 2 . . . . B 647 VAL HG13 . 31080 2 60 . 2 . 2 10 10 VAL HG21 H 1 0.86 0.01 . 2 . . . . B 647 VAL HG21 . 31080 2 61 . 2 . 2 10 10 VAL HG22 H 1 0.86 0.01 . 2 . . . . B 647 VAL HG22 . 31080 2 62 . 2 . 2 10 10 VAL HG23 H 1 0.86 0.01 . 2 . . . . B 647 VAL HG23 . 31080 2 63 . 2 . 2 10 10 VAL CA C 13 62.669 0.034 . 1 . . . . B 647 VAL CA . 31080 2 64 . 2 . 2 10 10 VAL CB C 13 32.682 0.01 . 1 . . . . B 647 VAL CB . 31080 2 65 . 2 . 2 10 10 VAL CG1 C 13 20.921 0.058 . 2 . . . . B 647 VAL CG1 . 31080 2 66 . 2 . 2 10 10 VAL CG2 C 13 21.026 0.048 . 2 . . . . B 647 VAL CG2 . 31080 2 67 . 2 . 2 10 10 VAL N N 15 121.396 0 . 1 . . . . B 647 VAL N . 31080 2 68 . 2 . 2 11 11 ILE H H 1 8.157 0.027 . 1 . . . . B 648 ILE H . 31080 2 69 . 2 . 2 11 11 ILE HA H 1 4.137 0.008 . 1 . . . . B 648 ILE HA . 31080 2 70 . 2 . 2 11 11 ILE HB H 1 1.847 0.001 . 1 . . . . B 648 ILE HB . 31080 2 71 . 2 . 2 11 11 ILE HG12 H 1 1.17 0.017 . 2 . . . . B 648 ILE HG12 . 31080 2 72 . 2 . 2 11 11 ILE HG13 H 1 1.44 0.031 . 2 . . . . B 648 ILE HG13 . 31080 2 73 . 2 . 2 11 11 ILE HG21 H 1 0.874 0.001 . 1 . . . . B 648 ILE HG21 . 31080 2 74 . 2 . 2 11 11 ILE HG22 H 1 0.874 0.001 . 1 . . . . B 648 ILE HG22 . 31080 2 75 . 2 . 2 11 11 ILE HG23 H 1 0.874 0.001 . 1 . . . . B 648 ILE HG23 . 31080 2 76 . 2 . 2 11 11 ILE HD11 H 1 0.819 0.009 . 1 . . . . B 648 ILE HD11 . 31080 2 77 . 2 . 2 11 11 ILE HD12 H 1 0.819 0.009 . 1 . . . . B 648 ILE HD12 . 31080 2 78 . 2 . 2 11 11 ILE HD13 H 1 0.819 0.009 . 1 . . . . B 648 ILE HD13 . 31080 2 79 . 2 . 2 11 11 ILE CA C 13 61.113 0.01 . 1 . . . . B 648 ILE CA . 31080 2 80 . 2 . 2 11 11 ILE CB C 13 38.347 0.009 . 1 . . . . B 648 ILE CB . 31080 2 81 . 2 . 2 11 11 ILE CG1 C 13 27.375 0.013 . 1 . . . . B 648 ILE CG1 . 31080 2 82 . 2 . 2 11 11 ILE CG2 C 13 17.419 0.013 . 1 . . . . B 648 ILE CG2 . 31080 2 83 . 2 . 2 11 11 ILE CD1 C 13 12.593 0.033 . 1 . . . . B 648 ILE CD1 . 31080 2 84 . 2 . 2 11 11 ILE N N 15 124.527 0 . 1 . . . . B 648 ILE N . 31080 2 85 . 2 . 2 12 12 ARG H H 1 8.396 0 . 1 . . . . B 649 ARG H . 31080 2 86 . 2 . 2 12 12 ARG HA H 1 4.343 0 . 1 . . . . B 649 ARG HA . 31080 2 87 . 2 . 2 12 12 ARG HB2 H 1 1.735 0 . 2 . . . . B 649 ARG HB2 . 31080 2 88 . 2 . 2 12 12 ARG HB3 H 1 1.805 0 . 2 . . . . B 649 ARG HB3 . 31080 2 89 . 2 . 2 12 12 ARG HG2 H 1 1.572 0 . 2 . . . . B 649 ARG HG2 . 31080 2 90 . 2 . 2 12 12 ARG HG3 H 1 1.625 0 . 2 . . . . B 649 ARG HG3 . 31080 2 91 . 2 . 2 12 12 ARG HD2 H 1 3.169 0 . 1 . . . . B 649 ARG HD2 . 31080 2 92 . 2 . 2 12 12 ARG HE H 1 7.256 0 . 1 . . . . B 649 ARG HE . 31080 2 93 . 2 . 2 13 13 ASN H H 1 8.487 0 . 1 . . . . B 650 ASN H . 31080 2 94 . 2 . 2 13 13 ASN HA H 1 4.728 0 . 1 . . . . B 650 ASN HA . 31080 2 95 . 2 . 2 13 13 ASN HB2 H 1 2.724 0 . 2 . . . . B 650 ASN HB2 . 31080 2 96 . 2 . 2 13 13 ASN HB3 H 1 2.808 0 . 2 . . . . B 650 ASN HB3 . 31080 2 97 . 2 . 2 13 13 ASN HD21 H 1 6.852 0 . 1 . . . . B 650 ASN HD21 . 31080 2 98 . 2 . 2 13 13 ASN HD22 H 1 7.53 0 . 1 . . . . B 650 ASN HD22 . 31080 2 99 . 2 . 2 14 14 ILE H H 1 8.149 0 . 1 . . . . B 651 ILE H . 31080 2 100 . 2 . 2 14 14 ILE HA H 1 4.183 0 . 1 . . . . B 651 ILE HA . 31080 2 101 . 2 . 2 14 14 ILE HB H 1 1.869 0 . 1 . . . . B 651 ILE HB . 31080 2 102 . 2 . 2 14 14 ILE HG12 H 1 1.141 0.003 . 1 . . . . B 651 ILE HG12 . 31080 2 103 . 2 . 2 14 14 ILE HG13 H 1 1.41 0.008 . 1 . . . . B 651 ILE HG13 . 31080 2 104 . 2 . 2 14 14 ILE HG21 H 1 0.86 0 . 1 . . . . B 651 ILE HG21 . 31080 2 105 . 2 . 2 14 14 ILE HG22 H 1 0.86 0 . 1 . . . . B 651 ILE HG22 . 31080 2 106 . 2 . 2 14 14 ILE HG23 H 1 0.86 0 . 1 . . . . B 651 ILE HG23 . 31080 2 107 . 2 . 2 14 14 ILE HD11 H 1 0.864 0 . 1 . . . . B 651 ILE HD11 . 31080 2 108 . 2 . 2 14 14 ILE HD12 H 1 0.864 0 . 1 . . . . B 651 ILE HD12 . 31080 2 109 . 2 . 2 14 14 ILE HD13 H 1 0.864 0 . 1 . . . . B 651 ILE HD13 . 31080 2 110 . 2 . 2 15 15 ASP H H 1 8.413 0.007 . 1 . . . . B 652 ASP H . 31080 2 111 . 2 . 2 15 15 ASP HA H 1 4.583 0 . 1 . . . . B 652 ASP HA . 31080 2 112 . 2 . 2 15 15 ASP HB2 H 1 2.612 0.002 . 1 . . . . B 652 ASP HB2 . 31080 2 113 . 2 . 2 15 15 ASP HB3 H 1 2.612 0.002 . 1 . . . . B 652 ASP HB3 . 31080 2 114 . 2 . 2 16 16 GLN H H 1 8.37 0.004 . 1 . . . . B 653 GLN H . 31080 2 115 . 2 . 2 16 16 GLN HA H 1 4.305 0.004 . 1 . . . . B 653 GLN HA . 31080 2 116 . 2 . 2 16 16 GLN HB2 H 1 1.969 0.003 . 1 . . . . B 653 GLN HB2 . 31080 2 117 . 2 . 2 16 16 GLN HB3 H 1 2.12 0.006 . 1 . . . . B 653 GLN HB3 . 31080 2 118 . 2 . 2 16 16 GLN HG2 H 1 2.027 0 . 1 . . . . B 653 GLN HG2 . 31080 2 119 . 2 . 2 16 16 GLN HG3 H 1 2.118 0 . 1 . . . . B 653 GLN HG3 . 31080 2 120 . 2 . 2 16 16 GLN HE21 H 1 7.535 0.003 . 1 . . . . B 653 GLN HE21 . 31080 2 121 . 2 . 2 16 16 GLN HE22 H 1 7.539 0 . 1 . . . . B 653 GLN HE22 . 31080 2 122 . 2 . 2 17 17 SER H H 1 8.426 0.003 . 1 . . . . B 654 SER H . 31080 2 123 . 2 . 2 17 17 SER HA H 1 4.337 0 . 1 . . . . B 654 SER HA . 31080 2 124 . 2 . 2 17 17 SER HB2 H 1 3.825 0.005 . 1 . . . . B 654 SER HB2 . 31080 2 125 . 2 . 2 17 17 SER HB3 H 1 3.83 0.015 . 1 . . . . B 654 SER HB3 . 31080 2 126 . 2 . 2 18 18 GLU H H 1 8.353 0.003 . 1 . . . . B 655 GLU H . 31080 2 127 . 2 . 2 18 18 GLU HA H 1 4.156 0.001 . 1 . . . . B 655 GLU HA . 31080 2 128 . 2 . 2 18 18 GLU HB2 H 1 1.846 0.005 . 1 . . . . B 655 GLU HB2 . 31080 2 129 . 2 . 2 18 18 GLU HB3 H 1 1.808 0.018 . 1 . . . . B 655 GLU HB3 . 31080 2 130 . 2 . 2 18 18 GLU HG2 H 1 1.841 0 . 1 . . . . B 655 GLU HG2 . 31080 2 131 . 2 . 2 18 18 GLU HG3 H 1 2.095 0.002 . 1 . . . . B 655 GLU HG3 . 31080 2 132 . 2 . 2 19 19 PHE H H 1 8.073 0.007 . 1 . . . . B 656 PHE H . 31080 2 133 . 2 . 2 19 19 PHE HA H 1 4.502 0.002 . 1 . . . . B 656 PHE HA . 31080 2 134 . 2 . 2 19 19 PHE HB2 H 1 2.95 0.05 . 2 . . . . B 656 PHE HB2 . 31080 2 135 . 2 . 2 19 19 PHE HB3 H 1 3.055 0.08 . 2 . . . . B 656 PHE HB3 . 31080 2 136 . 2 . 2 19 19 PHE HD1 H 1 7.168 0.001 . 1 . . . . B 656 PHE HD1 . 31080 2 137 . 2 . 2 19 19 PHE HD2 H 1 7.168 0.001 . 1 . . . . B 656 PHE HD2 . 31080 2 138 . 2 . 2 19 19 PHE HE1 H 1 7.237 0.003 . 1 . . . . B 656 PHE HE1 . 31080 2 139 . 2 . 2 19 19 PHE HE2 H 1 7.241 0.005 . 1 . . . . B 656 PHE HE2 . 31080 2 140 . 2 . 2 19 19 PHE CA C 13 57.74 0 . 1 . . . . B 656 PHE CA . 31080 2 141 . 2 . 2 19 19 PHE CB C 13 39.539 0.025 . 1 . . . . B 656 PHE CB . 31080 2 142 . 2 . 2 19 19 PHE CD1 C 13 131.734 0 . 1 . . . . B 656 PHE CD1 . 31080 2 143 . 2 . 2 19 19 PHE CD2 C 13 131.734 0 . 1 . . . . B 656 PHE CD2 . 31080 2 144 . 2 . 2 19 19 PHE CE1 C 13 131.546 0 . 1 . . . . B 656 PHE CE1 . 31080 2 145 . 2 . 2 19 19 PHE CE2 C 13 131.546 0 . 1 . . . . B 656 PHE CE2 . 31080 2 146 . 2 . 2 19 19 PHE N N 15 120.063 0 . 1 . . . . B 656 PHE N . 31080 2 147 . 2 . 2 20 20 GLU H H 1 8.087 0.004 . 1 . . . . B 657 GLU H . 31080 2 148 . 2 . 2 20 20 GLU HA H 1 4.126 0.011 . 1 . . . . B 657 GLU HA . 31080 2 149 . 2 . 2 20 20 GLU HB2 H 1 1.823 0.007 . 1 . . . . B 657 GLU HB2 . 31080 2 150 . 2 . 2 20 20 GLU HB3 H 1 1.912 0.002 . 1 . . . . B 657 GLU HB3 . 31080 2 151 . 2 . 2 20 20 GLU HG2 H 1 2.158 0.003 . 1 . . . . B 657 GLU HG2 . 31080 2 152 . 2 . 2 21 21 GLY H H 1 7.628 0.003 . 1 . . . . B 658 GLY H . 31080 2 153 . 2 . 2 21 21 GLY HA2 H 1 3.714 0.005 . 1 . . . . B 658 GLY HA2 . 31080 2 154 . 2 . 2 21 21 GLY HA3 H 1 3.606 0.01 . 1 . . . . B 658 GLY HA3 . 31080 2 155 . 2 . 2 22 22 PHE H H 1 8.063 0 . 1 . . . . B 659 PHE H . 31080 2 156 . 2 . 2 22 22 PHE HA H 1 4.501 0 . 1 . . . . B 659 PHE HA . 31080 2 157 . 2 . 2 22 22 PHE HB2 H 1 2.352 0.017 . 2 . . . . B 659 PHE HB2 . 31080 2 158 . 2 . 2 22 22 PHE HB3 H 1 2.189 0.003 . 2 . . . . B 659 PHE HB3 . 31080 2 159 . 2 . 2 22 22 PHE HD1 H 1 7.108 0.003 . 1 . . . . B 659 PHE HD1 . 31080 2 160 . 2 . 2 22 22 PHE HD2 H 1 7.108 0.003 . 1 . . . . B 659 PHE HD2 . 31080 2 161 . 2 . 2 22 22 PHE HE1 H 1 7.301 0.003 . 1 . . . . B 659 PHE HE1 . 31080 2 162 . 2 . 2 22 22 PHE HE2 H 1 7.301 0.003 . 1 . . . . B 659 PHE HE2 . 31080 2 163 . 2 . 2 22 22 PHE CA C 13 56.053 0 . 1 . . . . B 659 PHE CA . 31080 2 164 . 2 . 2 22 22 PHE CB C 13 39.316 0 . 1 . . . . B 659 PHE CB . 31080 2 165 . 2 . 2 22 22 PHE CD1 C 13 131.743 0 . 1 . . . . B 659 PHE CD1 . 31080 2 166 . 2 . 2 22 22 PHE CD2 C 13 131.743 0 . 1 . . . . B 659 PHE CD2 . 31080 2 167 . 2 . 2 22 22 PHE CE1 C 13 131.632 0 . 1 . . . . B 659 PHE CE1 . 31080 2 168 . 2 . 2 22 22 PHE CE2 C 13 131.632 0 . 1 . . . . B 659 PHE CE2 . 31080 2 169 . 2 . 2 22 22 PHE N N 15 120.07 0 . 1 . . . . B 659 PHE N . 31080 2 170 . 2 . 2 23 23 SEP H H 1 9.488 0.003 . 1 . . . . B 660 SEP H . 31080 2 171 . 2 . 2 23 23 SEP HA H 1 4.368 0.002 . 1 . . . . B 660 SEP HA . 31080 2 172 . 2 . 2 24 24 PHE H H 1 6.963 0.005 . 1 . . . . B 661 PHE H . 31080 2 173 . 2 . 2 24 24 PHE HA H 1 4.629 0.001 . 1 . . . . B 661 PHE HA . 31080 2 174 . 2 . 2 24 24 PHE HB2 H 1 2.97 0.004 . 2 . . . . B 661 PHE HB2 . 31080 2 175 . 2 . 2 24 24 PHE HB3 H 1 2.885 0.004 . 2 . . . . B 661 PHE HB3 . 31080 2 176 . 2 . 2 24 24 PHE HD1 H 1 6.79 0.002 . 1 . . . . B 661 PHE HD1 . 31080 2 177 . 2 . 2 24 24 PHE HD2 H 1 6.79 0.002 . 1 . . . . B 661 PHE HD2 . 31080 2 178 . 2 . 2 24 24 PHE CA C 13 55.628 0.013 . 1 . . . . B 661 PHE CA . 31080 2 179 . 2 . 2 24 24 PHE CB C 13 37.192 0.028 . 1 . . . . B 661 PHE CB . 31080 2 180 . 2 . 2 24 24 PHE CD1 C 13 132.467 0 . 1 . . . . B 661 PHE CD1 . 31080 2 181 . 2 . 2 24 24 PHE CD2 C 13 132.467 0 . 1 . . . . B 661 PHE CD2 . 31080 2 182 . 2 . 2 24 24 PHE N N 15 118.984 0 . 1 . . . . B 661 PHE N . 31080 2 183 . 2 . 2 25 25 NH2 HN1 H 1 8.536 0 . 1 . . . . B 662 NH2 HN1 . 31080 2 184 . 2 . 2 25 25 NH2 HN2 H 1 7.387 0.002 . 1 . . . . B 662 NH2 HN2 . 31080 2 stop_ save_