################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25611 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 25611 1 3 '3D HNCO' . . . 25611 1 5 '3D HNCACB' . . . 25611 1 7 '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' . . . 25611 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 4 $AutoAssign . . 25611 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 GLY HA2 H 1 3.454 0.020 . 2 . . . . A 2 GLY HA2 . 25611 1 2 . 1 1 2 2 GLY HA3 H 1 3.660 0.020 . 2 . . . . A 2 GLY HA3 . 25611 1 3 . 1 1 2 2 GLY C C 13 168.636 0.400 . 1 . . . . A 2 GLY C . 25611 1 4 . 1 1 2 2 GLY CA C 13 42.933 0.400 . 1 . . . . A 2 GLY CA . 25611 1 5 . 1 1 3 3 GLN H H 1 7.989 0.020 . 1 . . . . A 3 GLN H . 25611 1 6 . 1 1 3 3 GLN HA H 1 4.603 0.020 . 1 . . . . A 3 GLN HA . 25611 1 7 . 1 1 3 3 GLN HB2 H 1 1.883 0.020 . 2 . . . . A 3 GLN HB2 . 25611 1 8 . 1 1 3 3 GLN HB3 H 1 1.821 0.020 . 2 . . . . A 3 GLN HB3 . 25611 1 9 . 1 1 3 3 GLN HG2 H 1 2.161 0.020 . 2 . . . . A 3 GLN HG2 . 25611 1 10 . 1 1 3 3 GLN HG3 H 1 2.223 0.020 . 2 . . . . A 3 GLN HG3 . 25611 1 11 . 1 1 3 3 GLN HE21 H 1 7.515 0.020 . 2 . . . . A 3 GLN HE21 . 25611 1 12 . 1 1 3 3 GLN HE22 H 1 6.886 0.020 . 2 . . . . A 3 GLN HE22 . 25611 1 13 . 1 1 3 3 GLN C C 13 173.682 0.400 . 1 . . . . A 3 GLN C . 25611 1 14 . 1 1 3 3 GLN CA C 13 55.895 0.400 . 1 . . . . A 3 GLN CA . 25611 1 15 . 1 1 3 3 GLN CB C 13 31.096 0.400 . 1 . . . . A 3 GLN CB . 25611 1 16 . 1 1 3 3 GLN CG C 13 34.307 0.400 . 1 . . . . A 3 GLN CG . 25611 1 17 . 1 1 3 3 GLN N N 15 118.136 0.400 . 1 . . . . A 3 GLN N . 25611 1 18 . 1 1 3 3 GLN NE2 N 15 111.934 0.400 . 1 . . . . A 3 GLN NE2 . 25611 1 19 . 1 1 4 4 TRP H H 1 8.964 0.020 . 1 . . . . A 4 TRP H . 25611 1 20 . 1 1 4 4 TRP HA H 1 5.145 0.020 . 1 . . . . A 4 TRP HA . 25611 1 21 . 1 1 4 4 TRP HB2 H 1 3.053 0.020 . 2 . . . . A 4 TRP HB2 . 25611 1 22 . 1 1 4 4 TRP HB3 H 1 3.093 0.020 . 2 . . . . A 4 TRP HB3 . 25611 1 23 . 1 1 4 4 TRP HD1 H 1 7.068 0.020 . 1 . . . . A 4 TRP HD1 . 25611 1 24 . 1 1 4 4 TRP HE1 H 1 10.222 0.020 . 1 . . . . A 4 TRP HE1 . 25611 1 25 . 1 1 4 4 TRP HE3 H 1 7.461 0.020 . 1 . . . . A 4 TRP HE3 . 25611 1 26 . 1 1 4 4 TRP HZ2 H 1 7.409 0.020 . 1 . . . . A 4 TRP HZ2 . 25611 1 27 . 1 1 4 4 TRP HZ3 H 1 6.874 0.020 . 1 . . . . A 4 TRP HZ3 . 25611 1 28 . 1 1 4 4 TRP HH2 H 1 7.143 0.020 . 1 . . . . A 4 TRP HH2 . 25611 1 29 . 1 1 4 4 TRP C C 13 175.151 0.400 . 1 . . . . A 4 TRP C . 25611 1 30 . 1 1 4 4 TRP CA C 13 58.000 0.400 . 1 . . . . A 4 TRP CA . 25611 1 31 . 1 1 4 4 TRP CB C 13 32.615 0.400 . 1 . . . . A 4 TRP CB . 25611 1 32 . 1 1 4 4 TRP CD1 C 13 126.698 0.400 . 1 . . . . A 4 TRP CD1 . 25611 1 33 . 1 1 4 4 TRP CE3 C 13 120.136 0.400 . 1 . . . . A 4 TRP CE3 . 25611 1 34 . 1 1 4 4 TRP CZ2 C 13 114.354 0.400 . 1 . . . . A 4 TRP CZ2 . 25611 1 35 . 1 1 4 4 TRP CZ3 C 13 121.570 0.400 . 1 . . . . A 4 TRP CZ3 . 25611 1 36 . 1 1 4 4 TRP CH2 C 13 124.035 0.400 . 1 . . . . A 4 TRP CH2 . 25611 1 37 . 1 1 4 4 TRP N N 15 124.214 0.400 . 1 . . . . A 4 TRP N . 25611 1 38 . 1 1 4 4 TRP NE1 N 15 129.299 0.400 . 1 . . . . A 4 TRP NE1 . 25611 1 39 . 1 1 5 5 GLN H H 1 9.100 0.020 . 1 . . . . A 5 GLN H . 25611 1 40 . 1 1 5 5 GLN HA H 1 5.576 0.020 . 1 . . . . A 5 GLN HA . 25611 1 41 . 1 1 5 5 GLN HB2 H 1 1.947 0.020 . 2 . . . . A 5 GLN HB2 . 25611 1 42 . 1 1 5 5 GLN HB3 H 1 1.904 0.020 . 2 . . . . A 5 GLN HB3 . 25611 1 43 . 1 1 5 5 GLN HG2 H 1 2.125 0.020 . 1 . . . . A 5 GLN HG2 . 25611 1 44 . 1 1 5 5 GLN HG3 H 1 2.125 0.020 . 1 . . . . A 5 GLN HG3 . 25611 1 45 . 1 1 5 5 GLN HE21 H 1 7.377 0.020 . 2 . . . . A 5 GLN HE21 . 25611 1 46 . 1 1 5 5 GLN HE22 H 1 6.891 0.020 . 2 . . . . A 5 GLN HE22 . 25611 1 47 . 1 1 5 5 GLN C C 13 174.670 0.400 . 1 . . . . A 5 GLN C . 25611 1 48 . 1 1 5 5 GLN CA C 13 53.964 0.400 . 1 . . . . A 5 GLN CA . 25611 1 49 . 1 1 5 5 GLN CB C 13 32.615 0.400 . 1 . . . . A 5 GLN CB . 25611 1 50 . 1 1 5 5 GLN CG C 13 34.712 0.400 . 1 . . . . A 5 GLN CG . 25611 1 51 . 1 1 5 5 GLN N N 15 120.419 0.400 . 1 . . . . A 5 GLN N . 25611 1 52 . 1 1 5 5 GLN NE2 N 15 111.028 0.400 . 1 . . . . A 5 GLN NE2 . 25611 1 53 . 1 1 6 6 ILE H H 1 9.324 0.020 . 1 . . . . A 6 ILE H . 25611 1 54 . 1 1 6 6 ILE HA H 1 4.873 0.020 . 1 . . . . A 6 ILE HA . 25611 1 55 . 1 1 6 6 ILE HB H 1 1.728 0.020 . 1 . . . . A 6 ILE HB . 25611 1 56 . 1 1 6 6 ILE HG12 H 1 0.979 0.020 . 2 . . . . A 6 ILE HG12 . 25611 1 57 . 1 1 6 6 ILE HG13 H 1 1.581 0.020 . 2 . . . . A 6 ILE HG13 . 25611 1 58 . 1 1 6 6 ILE HG21 H 1 0.825 0.020 . 1 . . . . A 6 ILE HG21 . 25611 1 59 . 1 1 6 6 ILE HG22 H 1 0.825 0.020 . 1 . . . . A 6 ILE HG22 . 25611 1 60 . 1 1 6 6 ILE HG23 H 1 0.825 0.020 . 1 . . . . A 6 ILE HG23 . 25611 1 61 . 1 1 6 6 ILE HD11 H 1 0.876 0.020 . 1 . . . . A 6 ILE HD11 . 25611 1 62 . 1 1 6 6 ILE HD12 H 1 0.876 0.020 . 1 . . . . A 6 ILE HD12 . 25611 1 63 . 1 1 6 6 ILE HD13 H 1 0.876 0.020 . 1 . . . . A 6 ILE HD13 . 25611 1 64 . 1 1 6 6 ILE C C 13 174.190 0.400 . 1 . . . . A 6 ILE C . 25611 1 65 . 1 1 6 6 ILE CA C 13 59.648 0.400 . 1 . . . . A 6 ILE CA . 25611 1 66 . 1 1 6 6 ILE CB C 13 41.291 0.400 . 1 . . . . A 6 ILE CB . 25611 1 67 . 1 1 6 6 ILE CG1 C 13 27.126 0.400 . 1 . . . . A 6 ILE CG1 . 25611 1 68 . 1 1 6 6 ILE CG2 C 13 18.214 0.400 . 1 . . . . A 6 ILE CG2 . 25611 1 69 . 1 1 6 6 ILE CD1 C 13 14.427 0.400 . 1 . . . . A 6 ILE CD1 . 25611 1 70 . 1 1 6 6 ILE N N 15 123.595 0.400 . 1 . . . . A 6 ILE N . 25611 1 71 . 1 1 7 7 LYS H H 1 8.856 0.020 . 1 . . . . A 7 LYS H . 25611 1 72 . 1 1 7 7 LYS HA H 1 5.344 0.020 . 1 . . . . A 7 LYS HA . 25611 1 73 . 1 1 7 7 LYS HB2 H 1 1.508 0.020 . 2 . . . . A 7 LYS HB2 . 25611 1 74 . 1 1 7 7 LYS HB3 H 1 1.654 0.020 . 2 . . . . A 7 LYS HB3 . 25611 1 75 . 1 1 7 7 LYS HG2 H 1 1.326 0.020 . 1 . . . . A 7 LYS HG2 . 25611 1 76 . 1 1 7 7 LYS HG3 H 1 1.326 0.020 . 1 . . . . A 7 LYS HG3 . 25611 1 77 . 1 1 7 7 LYS HD2 H 1 1.583 0.020 . 1 . . . . A 7 LYS HD2 . 25611 1 78 . 1 1 7 7 LYS HD3 H 1 1.582 0.020 . 1 . . . . A 7 LYS HD3 . 25611 1 79 . 1 1 7 7 LYS HE2 H 1 2.844 0.020 . 2 . . . . A 7 LYS HE2 . 25611 1 80 . 1 1 7 7 LYS HE3 H 1 2.796 0.020 . 2 . . . . A 7 LYS HE3 . 25611 1 81 . 1 1 7 7 LYS C C 13 175.017 0.400 . 1 . . . . A 7 LYS C . 25611 1 82 . 1 1 7 7 LYS CA C 13 54.964 0.400 . 1 . . . . A 7 LYS CA . 25611 1 83 . 1 1 7 7 LYS CB C 13 35.036 0.400 . 1 . . . . A 7 LYS CB . 25611 1 84 . 1 1 7 7 LYS CG C 13 25.192 0.400 . 1 . . . . A 7 LYS CG . 25611 1 85 . 1 1 7 7 LYS CD C 13 29.486 0.400 . 1 . . . . A 7 LYS CD . 25611 1 86 . 1 1 7 7 LYS CE C 13 41.780 0.400 . 1 . . . . A 7 LYS CE . 25611 1 87 . 1 1 7 7 LYS N N 15 126.672 0.400 . 1 . . . . A 7 LYS N . 25611 1 88 . 1 1 8 8 ILE H H 1 8.934 0.020 . 1 . . . . A 8 ILE H . 25611 1 89 . 1 1 8 8 ILE HA H 1 4.910 0.020 . 1 . . . . A 8 ILE HA . 25611 1 90 . 1 1 8 8 ILE HB H 1 1.691 0.020 . 1 . . . . A 8 ILE HB . 25611 1 91 . 1 1 8 8 ILE HG12 H 1 1.501 0.020 . 2 . . . . A 8 ILE HG12 . 25611 1 92 . 1 1 8 8 ILE HG13 H 1 0.970 0.020 . 2 . . . . A 8 ILE HG13 . 25611 1 93 . 1 1 8 8 ILE HG21 H 1 0.860 0.020 . 1 . . . . A 8 ILE HG21 . 25611 1 94 . 1 1 8 8 ILE HG22 H 1 0.860 0.020 . 1 . . . . A 8 ILE HG22 . 25611 1 95 . 1 1 8 8 ILE HG23 H 1 0.860 0.020 . 1 . . . . A 8 ILE HG23 . 25611 1 96 . 1 1 8 8 ILE HD11 H 1 0.709 0.020 . 1 . . . . A 8 ILE HD11 . 25611 1 97 . 1 1 8 8 ILE HD12 H 1 0.709 0.020 . 1 . . . . A 8 ILE HD12 . 25611 1 98 . 1 1 8 8 ILE HD13 H 1 0.709 0.020 . 1 . . . . A 8 ILE HD13 . 25611 1 99 . 1 1 8 8 ILE C C 13 174.430 0.400 . 1 . . . . A 8 ILE C . 25611 1 100 . 1 1 8 8 ILE CA C 13 59.979 0.400 . 1 . . . . A 8 ILE CA . 25611 1 101 . 1 1 8 8 ILE CB C 13 41.386 0.400 . 1 . . . . A 8 ILE CB . 25611 1 102 . 1 1 8 8 ILE CG1 C 13 27.531 0.400 . 1 . . . . A 8 ILE CG1 . 25611 1 103 . 1 1 8 8 ILE CG2 C 13 18.139 0.400 . 1 . . . . A 8 ILE CG2 . 25611 1 104 . 1 1 8 8 ILE CD1 C 13 14.649 0.400 . 1 . . . . A 8 ILE CD1 . 25611 1 105 . 1 1 8 8 ILE N N 15 122.466 0.400 . 1 . . . . A 8 ILE N . 25611 1 106 . 1 1 9 9 TYR H H 1 9.000 0.020 . 1 . . . . A 9 TYR H . 25611 1 107 . 1 1 9 9 TYR HA H 1 5.275 0.020 . 1 . . . . A 9 TYR HA . 25611 1 108 . 1 1 9 9 TYR HB2 H 1 2.940 0.020 . 2 . . . . A 9 TYR HB2 . 25611 1 109 . 1 1 9 9 TYR HB3 H 1 3.045 0.020 . 2 . . . . A 9 TYR HB3 . 25611 1 110 . 1 1 9 9 TYR HD1 H 1 7.079 0.020 . 1 . . . . A 9 TYR HD1 . 25611 1 111 . 1 1 9 9 TYR HD2 H 1 7.079 0.020 . 1 . . . . A 9 TYR HD2 . 25611 1 112 . 1 1 9 9 TYR HE1 H 1 6.681 0.020 . 1 . . . . A 9 TYR HE1 . 25611 1 113 . 1 1 9 9 TYR HE2 H 1 6.681 0.020 . 1 . . . . A 9 TYR HE2 . 25611 1 114 . 1 1 9 9 TYR C C 13 175.390 0.400 . 1 . . . . A 9 TYR C . 25611 1 115 . 1 1 9 9 TYR CA C 13 56.600 0.400 . 1 . . . . A 9 TYR CA . 25611 1 116 . 1 1 9 9 TYR CB C 13 40.120 0.400 . 1 . . . . A 9 TYR CB . 25611 1 117 . 1 1 9 9 TYR CD1 C 13 133.344 0.400 . 1 . . . . A 9 TYR CD1 . 25611 1 118 . 1 1 9 9 TYR CD2 C 13 133.375 0.400 . 1 . . . . A 9 TYR CD2 . 25611 1 119 . 1 1 9 9 TYR CE1 C 13 117.836 0.400 . 1 . . . . A 9 TYR CE1 . 25611 1 120 . 1 1 9 9 TYR CE2 C 13 117.880 0.400 . 1 . . . . A 9 TYR CE2 . 25611 1 121 . 1 1 9 9 TYR N N 15 125.263 0.400 . 1 . . . . A 9 TYR N . 25611 1 122 . 1 1 10 10 SER H H 1 8.206 0.020 . 1 . . . . A 10 SER H . 25611 1 123 . 1 1 10 10 SER HA H 1 4.636 0.020 . 1 . . . . A 10 SER HA . 25611 1 124 . 1 1 10 10 SER HB2 H 1 3.310 0.020 . 2 . . . . A 10 SER HB2 . 25611 1 125 . 1 1 10 10 SER HB3 H 1 3.573 0.020 . 2 . . . . A 10 SER HB3 . 25611 1 126 . 1 1 10 10 SER C C 13 174.083 0.400 . 1 . . . . A 10 SER C . 25611 1 127 . 1 1 10 10 SER CA C 13 57.986 0.400 . 1 . . . . A 10 SER CA . 25611 1 128 . 1 1 10 10 SER CB C 13 64.962 0.400 . 1 . . . . A 10 SER CB . 25611 1 129 . 1 1 10 10 SER N N 15 115.822 0.400 . 1 . . . . A 10 SER N . 25611 1 130 . 1 1 11 11 GLU H H 1 8.812 0.020 . 1 . . . . A 11 GLU H . 25611 1 131 . 1 1 11 11 GLU HA H 1 4.461 0.020 . 1 . . . . A 11 GLU HA . 25611 1 132 . 1 1 11 11 GLU HB2 H 1 2.223 0.020 . 2 . . . . A 11 GLU HB2 . 25611 1 133 . 1 1 11 11 GLU HB3 H 1 1.934 0.020 . 2 . . . . A 11 GLU HB3 . 25611 1 134 . 1 1 11 11 GLU HG2 H 1 2.363 0.020 . 1 . . . . A 11 GLU HG2 . 25611 1 135 . 1 1 11 11 GLU HG3 H 1 2.363 0.020 . 1 . . . . A 11 GLU HG3 . 25611 1 136 . 1 1 11 11 GLU C C 13 175.284 0.400 . 1 . . . . A 11 GLU C . 25611 1 137 . 1 1 11 11 GLU CA C 13 56.717 0.400 . 1 . . . . A 11 GLU CA . 25611 1 138 . 1 1 11 11 GLU CB C 13 29.811 0.400 . 1 . . . . A 11 GLU CB . 25611 1 139 . 1 1 11 11 GLU CG C 13 35.633 0.400 . 1 . . . . A 11 GLU CG . 25611 1 140 . 1 1 11 11 GLU N N 15 123.684 0.400 . 1 . . . . A 11 GLU N . 25611 1 141 . 1 1 12 12 ASN H H 1 8.075 0.020 . 1 . . . . A 12 ASN H . 25611 1 142 . 1 1 12 12 ASN HA H 1 4.791 0.020 . 1 . . . . A 12 ASN HA . 25611 1 143 . 1 1 12 12 ASN HB2 H 1 3.000 0.020 . 2 . . . . A 12 ASN HB2 . 25611 1 144 . 1 1 12 12 ASN HB3 H 1 2.780 0.020 . 2 . . . . A 12 ASN HB3 . 25611 1 145 . 1 1 12 12 ASN HD21 H 1 7.697 0.020 . 2 . . . . A 12 ASN HD21 . 25611 1 146 . 1 1 12 12 ASN HD22 H 1 6.934 0.020 . 2 . . . . A 12 ASN HD22 . 25611 1 147 . 1 1 12 12 ASN CA C 13 55.000 0.400 . 1 . . . . A 12 ASN CA . 25611 1 148 . 1 1 12 12 ASN CB C 13 39.441 0.400 . 1 . . . . A 12 ASN CB . 25611 1 149 . 1 1 12 12 ASN N N 15 115.576 0.400 . 1 . . . . A 12 ASN N . 25611 1 150 . 1 1 12 12 ASN ND2 N 15 113.638 0.400 . 1 . . . . A 12 ASN ND2 . 25611 1 151 . 1 1 13 13 GLU HA H 1 4.253 0.020 . 1 . . . . A 13 GLU HA . 25611 1 152 . 1 1 13 13 GLU HB2 H 1 2.040 0.020 . 1 . . . . A 13 GLU HB2 . 25611 1 153 . 1 1 13 13 GLU HB3 H 1 2.040 0.020 . 1 . . . . A 13 GLU HB3 . 25611 1 154 . 1 1 13 13 GLU HG2 H 1 2.310 0.020 . 1 . . . . A 13 GLU HG2 . 25611 1 155 . 1 1 13 13 GLU HG3 H 1 2.310 0.020 . 1 . . . . A 13 GLU HG3 . 25611 1 156 . 1 1 13 13 GLU CA C 13 59.000 0.400 . 1 . . . . A 13 GLU CA . 25611 1 157 . 1 1 13 13 GLU CB C 13 29.000 0.400 . 1 . . . . A 13 GLU CB . 25611 1 158 . 1 1 13 13 GLU CG C 13 36.010 0.400 . 1 . . . . A 13 GLU CG . 25611 1 159 . 1 1 14 14 ARG HA H 1 4.028 0.020 . 1 . . . . A 14 ARG HA . 25611 1 160 . 1 1 14 14 ARG HB2 H 1 1.905 0.020 . 2 . . . . A 14 ARG HB2 . 25611 1 161 . 1 1 14 14 ARG HB3 H 1 1.872 0.020 . 2 . . . . A 14 ARG HB3 . 25611 1 162 . 1 1 14 14 ARG HG2 H 1 1.578 0.020 . 2 . . . . A 14 ARG HG2 . 25611 1 163 . 1 1 14 14 ARG HG3 H 1 1.702 0.020 . 2 . . . . A 14 ARG HG3 . 25611 1 164 . 1 1 14 14 ARG HD2 H 1 3.213 0.020 . 2 . . . . A 14 ARG HD2 . 25611 1 165 . 1 1 14 14 ARG HD3 H 1 3.218 0.020 . 2 . . . . A 14 ARG HD3 . 25611 1 166 . 1 1 14 14 ARG CA C 13 59.237 0.400 . 1 . . . . A 14 ARG CA . 25611 1 167 . 1 1 14 14 ARG CB C 13 31.000 0.400 . 1 . . . . A 14 ARG CB . 25611 1 168 . 1 1 14 14 ARG CG C 13 26.893 0.400 . 1 . . . . A 14 ARG CG . 25611 1 169 . 1 1 14 14 ARG CD C 13 43.100 0.400 . 1 . . . . A 14 ARG CD . 25611 1 170 . 1 1 15 15 GLU H H 1 7.705 0.020 . 1 . . . . A 15 GLU H . 25611 1 171 . 1 1 15 15 GLU HA H 1 4.048 0.020 . 1 . . . . A 15 GLU HA . 25611 1 172 . 1 1 15 15 GLU HB2 H 1 2.040 0.020 . 2 . . . . A 15 GLU HB2 . 25611 1 173 . 1 1 15 15 GLU HB3 H 1 2.126 0.020 . 2 . . . . A 15 GLU HB3 . 25611 1 174 . 1 1 15 15 GLU HG2 H 1 2.367 0.020 . 2 . . . . A 15 GLU HG2 . 25611 1 175 . 1 1 15 15 GLU HG3 H 1 2.369 0.020 . 2 . . . . A 15 GLU HG3 . 25611 1 176 . 1 1 15 15 GLU C C 13 178.355 0.400 . 1 . . . . A 15 GLU C . 25611 1 177 . 1 1 15 15 GLU CA C 13 59.348 0.400 . 1 . . . . A 15 GLU CA . 25611 1 178 . 1 1 15 15 GLU CB C 13 29.169 0.400 . 1 . . . . A 15 GLU CB . 25611 1 179 . 1 1 15 15 GLU CG C 13 35.167 0.400 . 1 . . . . A 15 GLU CG . 25611 1 180 . 1 1 16 16 PHE H H 1 8.053 0.020 . 1 . . . . A 16 PHE H . 25611 1 181 . 1 1 16 16 PHE HA H 1 4.254 0.020 . 1 . . . . A 16 PHE HA . 25611 1 182 . 1 1 16 16 PHE HB2 H 1 3.165 0.020 . 2 . . . . A 16 PHE HB2 . 25611 1 183 . 1 1 16 16 PHE HB3 H 1 3.215 0.020 . 2 . . . . A 16 PHE HB3 . 25611 1 184 . 1 1 16 16 PHE HD1 H 1 7.118 0.020 . 1 . . . . A 16 PHE HD1 . 25611 1 185 . 1 1 16 16 PHE HD2 H 1 7.118 0.020 . 1 . . . . A 16 PHE HD2 . 25611 1 186 . 1 1 16 16 PHE HE1 H 1 7.067 0.020 . 1 . . . . A 16 PHE HE1 . 25611 1 187 . 1 1 16 16 PHE HE2 H 1 7.067 0.020 . 1 . . . . A 16 PHE HE2 . 25611 1 188 . 1 1 16 16 PHE HZ H 1 7.041 0.020 . 1 . . . . A 16 PHE HZ . 25611 1 189 . 1 1 16 16 PHE C C 13 176.726 0.400 . 1 . . . . A 16 PHE C . 25611 1 190 . 1 1 16 16 PHE CA C 13 60.663 0.400 . 1 . . . . A 16 PHE CA . 25611 1 191 . 1 1 16 16 PHE CB C 13 38.889 0.400 . 1 . . . . A 16 PHE CB . 25611 1 192 . 1 1 16 16 PHE CD1 C 13 131.195 0.400 . 1 . . . . A 16 PHE CD1 . 25611 1 193 . 1 1 16 16 PHE CD2 C 13 131.195 0.400 . 1 . . . . A 16 PHE CD2 . 25611 1 194 . 1 1 16 16 PHE CE1 C 13 129.653 0.400 . 1 . . . . A 16 PHE CE1 . 25611 1 195 . 1 1 16 16 PHE CE2 C 13 129.625 0.400 . 1 . . . . A 16 PHE CE2 . 25611 1 196 . 1 1 16 16 PHE CZ C 13 129.528 0.400 . 1 . . . . A 16 PHE CZ . 25611 1 197 . 1 1 16 16 PHE N N 15 119.437 0.400 . 1 . . . . A 16 PHE N . 25611 1 198 . 1 1 17 17 ARG H H 1 8.247 0.020 . 1 . . . . A 17 ARG H . 25611 1 199 . 1 1 17 17 ARG HA H 1 3.853 0.020 . 1 . . . . A 17 ARG HA . 25611 1 200 . 1 1 17 17 ARG HB2 H 1 1.930 0.020 . 2 . . . . A 17 ARG HB2 . 25611 1 201 . 1 1 17 17 ARG HB3 H 1 2.049 0.020 . 2 . . . . A 17 ARG HB3 . 25611 1 202 . 1 1 17 17 ARG HG2 H 1 1.875 0.020 . 2 . . . . A 17 ARG HG2 . 25611 1 203 . 1 1 17 17 ARG HG3 H 1 1.726 0.020 . 2 . . . . A 17 ARG HG3 . 25611 1 204 . 1 1 17 17 ARG HD2 H 1 3.230 0.020 . 2 . . . . A 17 ARG HD2 . 25611 1 205 . 1 1 17 17 ARG HD3 H 1 3.228 0.020 . 2 . . . . A 17 ARG HD3 . 25611 1 206 . 1 1 17 17 ARG C C 13 179.156 0.400 . 1 . . . . A 17 ARG C . 25611 1 207 . 1 1 17 17 ARG CA C 13 59.149 0.400 . 1 . . . . A 17 ARG CA . 25611 1 208 . 1 1 17 17 ARG CB C 13 29.334 0.400 . 1 . . . . A 17 ARG CB . 25611 1 209 . 1 1 17 17 ARG CG C 13 27.086 0.400 . 1 . . . . A 17 ARG CG . 25611 1 210 . 1 1 17 17 ARG CD C 13 43.100 0.400 . 1 . . . . A 17 ARG CD . 25611 1 211 . 1 1 17 17 ARG N N 15 117.585 0.400 . 1 . . . . A 17 ARG N . 25611 1 212 . 1 1 18 18 GLU H H 1 8.031 0.020 . 1 . . . . A 18 GLU H . 25611 1 213 . 1 1 18 18 GLU HA H 1 4.018 0.020 . 1 . . . . A 18 GLU HA . 25611 1 214 . 1 1 18 18 GLU HB2 H 1 2.010 0.020 . 2 . . . . A 18 GLU HB2 . 25611 1 215 . 1 1 18 18 GLU HB3 H 1 2.184 0.020 . 2 . . . . A 18 GLU HB3 . 25611 1 216 . 1 1 18 18 GLU HG2 H 1 2.525 0.020 . 2 . . . . A 18 GLU HG2 . 25611 1 217 . 1 1 18 18 GLU HG3 H 1 2.310 0.020 . 2 . . . . A 18 GLU HG3 . 25611 1 218 . 1 1 18 18 GLU C C 13 178.809 0.400 . 1 . . . . A 18 GLU C . 25611 1 219 . 1 1 18 18 GLU CA C 13 59.149 0.400 . 1 . . . . A 18 GLU CA . 25611 1 220 . 1 1 18 18 GLU CB C 13 28.737 0.400 . 1 . . . . A 18 GLU CB . 25611 1 221 . 1 1 18 18 GLU CG C 13 35.583 0.400 . 1 . . . . A 18 GLU CG . 25611 1 222 . 1 1 18 18 GLU N N 15 118.621 0.400 . 1 . . . . A 18 GLU N . 25611 1 223 . 1 1 19 19 LEU H H 1 7.986 0.020 . 1 . . . . A 19 LEU H . 25611 1 224 . 1 1 19 19 LEU HA H 1 3.883 0.020 . 1 . . . . A 19 LEU HA . 25611 1 225 . 1 1 19 19 LEU HB2 H 1 1.684 0.020 . 2 . . . . A 19 LEU HB2 . 25611 1 226 . 1 1 19 19 LEU HB3 H 1 1.563 0.020 . 2 . . . . A 19 LEU HB3 . 25611 1 227 . 1 1 19 19 LEU HG H 1 1.395 0.020 . 1 . . . . A 19 LEU HG . 25611 1 228 . 1 1 19 19 LEU HD11 H 1 0.706 0.020 . 2 . . . . A 19 LEU HD11 . 25611 1 229 . 1 1 19 19 LEU HD12 H 1 0.706 0.020 . 2 . . . . A 19 LEU HD12 . 25611 1 230 . 1 1 19 19 LEU HD13 H 1 0.706 0.020 . 2 . . . . A 19 LEU HD13 . 25611 1 231 . 1 1 19 19 LEU HD21 H 1 0.748 0.020 . 2 . . . . A 19 LEU HD21 . 25611 1 232 . 1 1 19 19 LEU HD22 H 1 0.748 0.020 . 2 . . . . A 19 LEU HD22 . 25611 1 233 . 1 1 19 19 LEU HD23 H 1 0.748 0.020 . 2 . . . . A 19 LEU HD23 . 25611 1 234 . 1 1 19 19 LEU C C 13 177.874 0.400 . 1 . . . . A 19 LEU C . 25611 1 235 . 1 1 19 19 LEU CA C 13 57.939 0.400 . 1 . . . . A 19 LEU CA . 25611 1 236 . 1 1 19 19 LEU CB C 13 41.139 0.400 . 1 . . . . A 19 LEU CB . 25611 1 237 . 1 1 19 19 LEU CG C 13 26.770 0.400 . 1 . . . . A 19 LEU CG . 25611 1 238 . 1 1 19 19 LEU CD1 C 13 25.708 0.400 . 1 . . . . A 19 LEU CD1 . 25611 1 239 . 1 1 19 19 LEU CD2 C 13 23.703 0.400 . 1 . . . . A 19 LEU CD2 . 25611 1 240 . 1 1 19 19 LEU N N 15 121.020 0.400 . 1 . . . . A 19 LEU N . 25611 1 241 . 1 1 20 20 ILE H H 1 8.007 0.020 . 1 . . . . A 20 ILE H . 25611 1 242 . 1 1 20 20 ILE HA H 1 3.083 0.020 . 1 . . . . A 20 ILE HA . 25611 1 243 . 1 1 20 20 ILE HB H 1 1.684 0.020 . 1 . . . . A 20 ILE HB . 25611 1 244 . 1 1 20 20 ILE HG12 H 1 0.507 0.020 . 2 . . . . A 20 ILE HG12 . 25611 1 245 . 1 1 20 20 ILE HG13 H 1 1.146 0.020 . 2 . . . . A 20 ILE HG13 . 25611 1 246 . 1 1 20 20 ILE HG21 H 1 0.709 0.020 . 1 . . . . A 20 ILE HG21 . 25611 1 247 . 1 1 20 20 ILE HG22 H 1 0.709 0.020 . 1 . . . . A 20 ILE HG22 . 25611 1 248 . 1 1 20 20 ILE HG23 H 1 0.709 0.020 . 1 . . . . A 20 ILE HG23 . 25611 1 249 . 1 1 20 20 ILE HD11 H 1 0.405 0.020 . 1 . . . . A 20 ILE HD11 . 25611 1 250 . 1 1 20 20 ILE HD12 H 1 0.405 0.020 . 1 . . . . A 20 ILE HD12 . 25611 1 251 . 1 1 20 20 ILE HD13 H 1 0.405 0.020 . 1 . . . . A 20 ILE HD13 . 25611 1 252 . 1 1 20 20 ILE C C 13 177.447 0.400 . 1 . . . . A 20 ILE C . 25611 1 253 . 1 1 20 20 ILE CA C 13 64.891 0.400 . 1 . . . . A 20 ILE CA . 25611 1 254 . 1 1 20 20 ILE CB C 13 36.866 0.400 . 1 . . . . A 20 ILE CB . 25611 1 255 . 1 1 20 20 ILE CG1 C 13 28.878 0.400 . 1 . . . . A 20 ILE CG1 . 25611 1 256 . 1 1 20 20 ILE CG2 C 13 17.070 0.400 . 1 . . . . A 20 ILE CG2 . 25611 1 257 . 1 1 20 20 ILE CD1 C 13 12.472 0.400 . 1 . . . . A 20 ILE CD1 . 25611 1 258 . 1 1 20 20 ILE N N 15 118.908 0.400 . 1 . . . . A 20 ILE N . 25611 1 259 . 1 1 21 21 GLU H H 1 7.747 0.020 . 1 . . . . A 21 GLU H . 25611 1 260 . 1 1 21 21 GLU HA H 1 3.933 0.020 . 1 . . . . A 21 GLU HA . 25611 1 261 . 1 1 21 21 GLU HB2 H 1 2.040 0.020 . 2 . . . . A 21 GLU HB2 . 25611 1 262 . 1 1 21 21 GLU HB3 H 1 2.122 0.020 . 2 . . . . A 21 GLU HB3 . 25611 1 263 . 1 1 21 21 GLU HG2 H 1 2.492 0.020 . 2 . . . . A 21 GLU HG2 . 25611 1 264 . 1 1 21 21 GLU HG3 H 1 2.317 0.020 . 2 . . . . A 21 GLU HG3 . 25611 1 265 . 1 1 21 21 GLU C C 13 178.969 0.400 . 1 . . . . A 21 GLU C . 25611 1 266 . 1 1 21 21 GLU CA C 13 59.098 0.400 . 1 . . . . A 21 GLU CA . 25611 1 267 . 1 1 21 21 GLU CB C 13 28.250 0.400 . 1 . . . . A 21 GLU CB . 25611 1 268 . 1 1 21 21 GLU CG C 13 34.853 0.400 . 1 . . . . A 21 GLU CG . 25611 1 269 . 1 1 21 21 GLU N N 15 117.787 0.400 . 1 . . . . A 21 GLU N . 25611 1 270 . 1 1 22 22 ARG H H 1 7.579 0.020 . 1 . . . . A 22 ARG H . 25611 1 271 . 1 1 22 22 ARG HA H 1 4.125 0.020 . 1 . . . . A 22 ARG HA . 25611 1 272 . 1 1 22 22 ARG HB2 H 1 1.928 0.020 . 1 . . . . A 22 ARG HB2 . 25611 1 273 . 1 1 22 22 ARG HB3 H 1 1.929 0.020 . 1 . . . . A 22 ARG HB3 . 25611 1 274 . 1 1 22 22 ARG HG2 H 1 1.741 0.020 . 2 . . . . A 22 ARG HG2 . 25611 1 275 . 1 1 22 22 ARG HG3 H 1 1.583 0.020 . 2 . . . . A 22 ARG HG3 . 25611 1 276 . 1 1 22 22 ARG HD2 H 1 3.147 0.020 . 2 . . . . A 22 ARG HD2 . 25611 1 277 . 1 1 22 22 ARG HD3 H 1 3.224 0.020 . 2 . . . . A 22 ARG HD3 . 25611 1 278 . 1 1 22 22 ARG HE H 1 7.573 0.020 . 1 . . . . A 22 ARG HE . 25611 1 279 . 1 1 22 22 ARG C C 13 179.556 0.400 . 1 . . . . A 22 ARG C . 25611 1 280 . 1 1 22 22 ARG CA C 13 57.709 0.400 . 1 . . . . A 22 ARG CA . 25611 1 281 . 1 1 22 22 ARG CB C 13 29.283 0.400 . 1 . . . . A 22 ARG CB . 25611 1 282 . 1 1 22 22 ARG CG C 13 26.509 0.400 . 1 . . . . A 22 ARG CG . 25611 1 283 . 1 1 22 22 ARG CD C 13 42.489 0.400 . 1 . . . . A 22 ARG CD . 25611 1 284 . 1 1 22 22 ARG N N 15 117.258 0.400 . 1 . . . . A 22 ARG N . 25611 1 285 . 1 1 22 22 ARG NE N 15 -21.500 0.400 . 1 . . . . A 22 ARG NE . 25611 1 286 . 1 1 23 23 LEU H H 1 8.403 0.020 . 1 . . . . A 23 LEU H . 25611 1 287 . 1 1 23 23 LEU HA H 1 3.917 0.020 . 1 . . . . A 23 LEU HA . 25611 1 288 . 1 1 23 23 LEU HB2 H 1 1.612 0.020 . 2 . . . . A 23 LEU HB2 . 25611 1 289 . 1 1 23 23 LEU HB3 H 1 1.067 0.020 . 2 . . . . A 23 LEU HB3 . 25611 1 290 . 1 1 23 23 LEU HG H 1 1.688 0.020 . 1 . . . . A 23 LEU HG . 25611 1 291 . 1 1 23 23 LEU HD11 H 1 0.607 0.020 . 2 . . . . A 23 LEU HD11 . 25611 1 292 . 1 1 23 23 LEU HD12 H 1 0.607 0.020 . 2 . . . . A 23 LEU HD12 . 25611 1 293 . 1 1 23 23 LEU HD13 H 1 0.607 0.020 . 2 . . . . A 23 LEU HD13 . 25611 1 294 . 1 1 23 23 LEU HD21 H 1 0.316 0.020 . 2 . . . . A 23 LEU HD21 . 25611 1 295 . 1 1 23 23 LEU HD22 H 1 0.316 0.020 . 2 . . . . A 23 LEU HD22 . 25611 1 296 . 1 1 23 23 LEU HD23 H 1 0.316 0.020 . 2 . . . . A 23 LEU HD23 . 25611 1 297 . 1 1 23 23 LEU C C 13 180.090 0.400 . 1 . . . . A 23 LEU C . 25611 1 298 . 1 1 23 23 LEU CA C 13 57.477 0.400 . 1 . . . . A 23 LEU CA . 25611 1 299 . 1 1 23 23 LEU CB C 13 40.795 0.400 . 1 . . . . A 23 LEU CB . 25611 1 300 . 1 1 23 23 LEU CG C 13 25.921 0.400 . 1 . . . . A 23 LEU CG . 25611 1 301 . 1 1 23 23 LEU CD1 C 13 22.174 0.400 . 1 . . . . A 23 LEU CD1 . 25611 1 302 . 1 1 23 23 LEU CD2 C 13 25.617 0.400 . 1 . . . . A 23 LEU CD2 . 25611 1 303 . 1 1 23 23 LEU N N 15 120.111 0.400 . 1 . . . . A 23 LEU N . 25611 1 304 . 1 1 24 24 GLU H H 1 8.400 0.020 . 1 . . . . A 24 GLU H . 25611 1 305 . 1 1 24 24 GLU HA H 1 4.165 0.020 . 1 . . . . A 24 GLU HA . 25611 1 306 . 1 1 24 24 GLU HB2 H 1 2.176 0.020 . 2 . . . . A 24 GLU HB2 . 25611 1 307 . 1 1 24 24 GLU HB3 H 1 2.253 0.020 . 2 . . . . A 24 GLU HB3 . 25611 1 308 . 1 1 24 24 GLU HG2 H 1 2.629 0.020 . 2 . . . . A 24 GLU HG2 . 25611 1 309 . 1 1 24 24 GLU HG3 H 1 2.535 0.020 . 2 . . . . A 24 GLU HG3 . 25611 1 310 . 1 1 24 24 GLU C C 13 177.874 0.400 . 1 . . . . A 24 GLU C . 25611 1 311 . 1 1 24 24 GLU CA C 13 58.389 0.400 . 1 . . . . A 24 GLU CA . 25611 1 312 . 1 1 24 24 GLU CB C 13 28.608 0.400 . 1 . . . . A 24 GLU CB . 25611 1 313 . 1 1 24 24 GLU CG C 13 35.056 0.400 . 1 . . . . A 24 GLU CG . 25611 1 314 . 1 1 24 24 GLU N N 15 117.996 0.400 . 1 . . . . A 24 GLU N . 25611 1 315 . 1 1 25 25 GLU H H 1 7.410 0.020 . 1 . . . . A 25 GLU H . 25611 1 316 . 1 1 25 25 GLU HA H 1 4.301 0.020 . 1 . . . . A 25 GLU HA . 25611 1 317 . 1 1 25 25 GLU HB2 H 1 2.207 0.020 . 2 . . . . A 25 GLU HB2 . 25611 1 318 . 1 1 25 25 GLU HB3 H 1 2.160 0.020 . 2 . . . . A 25 GLU HB3 . 25611 1 319 . 1 1 25 25 GLU HG2 H 1 2.644 0.020 . 2 . . . . A 25 GLU HG2 . 25611 1 320 . 1 1 25 25 GLU HG3 H 1 2.488 0.020 . 2 . . . . A 25 GLU HG3 . 25611 1 321 . 1 1 25 25 GLU C C 13 176.930 0.400 . 1 . . . . A 25 GLU C . 25611 1 322 . 1 1 25 25 GLU CA C 13 56.288 0.400 . 1 . . . . A 25 GLU CA . 25611 1 323 . 1 1 25 25 GLU CB C 13 29.205 0.400 . 1 . . . . A 25 GLU CB . 25611 1 324 . 1 1 25 25 GLU CG C 13 34.408 0.400 . 1 . . . . A 25 GLU CG . 25611 1 325 . 1 1 25 25 GLU N N 15 115.852 0.400 . 1 . . . . A 25 GLU N . 25611 1 326 . 1 1 26 26 GLU H H 1 7.356 0.020 . 1 . . . . A 26 GLU H . 25611 1 327 . 1 1 26 26 GLU HA H 1 4.235 0.020 . 1 . . . . A 26 GLU HA . 25611 1 328 . 1 1 26 26 GLU HB2 H 1 2.048 0.020 . 2 . . . . A 26 GLU HB2 . 25611 1 329 . 1 1 26 26 GLU HB3 H 1 2.191 0.020 . 2 . . . . A 26 GLU HB3 . 25611 1 330 . 1 1 26 26 GLU HG2 H 1 2.389 0.020 . 2 . . . . A 26 GLU HG2 . 25611 1 331 . 1 1 26 26 GLU HG3 H 1 2.511 0.020 . 2 . . . . A 26 GLU HG3 . 25611 1 332 . 1 1 26 26 GLU C C 13 175.792 0.400 . 1 . . . . A 26 GLU C . 25611 1 333 . 1 1 26 26 GLU CA C 13 56.381 0.400 . 1 . . . . A 26 GLU CA . 25611 1 334 . 1 1 26 26 GLU CB C 13 29.025 0.400 . 1 . . . . A 26 GLU CB . 25611 1 335 . 1 1 26 26 GLU CG C 13 34.408 0.400 . 1 . . . . A 26 GLU CG . 25611 1 336 . 1 1 26 26 GLU N N 15 118.759 0.400 . 1 . . . . A 26 GLU N . 25611 1 337 . 1 1 27 27 ARG H H 1 8.009 0.020 . 1 . . . . A 27 ARG H . 25611 1 338 . 1 1 27 27 ARG HA H 1 4.525 0.020 . 1 . . . . A 27 ARG HA . 25611 1 339 . 1 1 27 27 ARG HB2 H 1 1.779 0.020 . 1 . . . . A 27 ARG HB2 . 25611 1 340 . 1 1 27 27 ARG HB3 H 1 1.779 0.020 . 1 . . . . A 27 ARG HB3 . 25611 1 341 . 1 1 27 27 ARG HG2 H 1 1.772 0.020 . 2 . . . . A 27 ARG HG2 . 25611 1 342 . 1 1 27 27 ARG HG3 H 1 1.668 0.020 . 2 . . . . A 27 ARG HG3 . 25611 1 343 . 1 1 27 27 ARG HD2 H 1 3.310 0.020 . 2 . . . . A 27 ARG HD2 . 25611 1 344 . 1 1 27 27 ARG HD3 H 1 3.219 0.020 . 2 . . . . A 27 ARG HD3 . 25611 1 345 . 1 1 27 27 ARG HE H 1 7.272 0.020 . 1 . . . . A 27 ARG HE . 25611 1 346 . 1 1 27 27 ARG CA C 13 53.261 0.400 . 1 . . . . A 27 ARG CA . 25611 1 347 . 1 1 27 27 ARG CB C 13 31.488 0.400 . 1 . . . . A 27 ARG CB . 25611 1 348 . 1 1 27 27 ARG CG C 13 26.681 0.400 . 1 . . . . A 27 ARG CG . 25611 1 349 . 1 1 27 27 ARG CD C 13 43.100 0.400 . 1 . . . . A 27 ARG CD . 25611 1 350 . 1 1 27 27 ARG N N 15 121.906 0.400 . 1 . . . . A 27 ARG N . 25611 1 351 . 1 1 27 27 ARG NE N 15 -21.000 0.400 . 1 . . . . A 27 ARG NE . 25611 1 352 . 1 1 28 28 PRO HA H 1 4.688 0.020 . 1 . . . . A 28 PRO HA . 25611 1 353 . 1 1 28 28 PRO HB2 H 1 2.416 0.020 . 2 . . . . A 28 PRO HB2 . 25611 1 354 . 1 1 28 28 PRO HB3 H 1 2.243 0.020 . 2 . . . . A 28 PRO HB3 . 25611 1 355 . 1 1 28 28 PRO HG2 H 1 1.881 0.020 . 2 . . . . A 28 PRO HG2 . 25611 1 356 . 1 1 28 28 PRO HG3 H 1 1.965 0.020 . 2 . . . . A 28 PRO HG3 . 25611 1 357 . 1 1 28 28 PRO HD2 H 1 3.590 0.020 . 2 . . . . A 28 PRO HD2 . 25611 1 358 . 1 1 28 28 PRO HD3 H 1 3.528 0.020 . 2 . . . . A 28 PRO HD3 . 25611 1 359 . 1 1 28 28 PRO C C 13 176.219 0.400 . 1 . . . . A 28 PRO C . 25611 1 360 . 1 1 28 28 PRO CA C 13 62.818 0.400 . 1 . . . . A 28 PRO CA . 25611 1 361 . 1 1 28 28 PRO CB C 13 34.074 0.400 . 1 . . . . A 28 PRO CB . 25611 1 362 . 1 1 28 28 PRO CG C 13 24.868 0.400 . 1 . . . . A 28 PRO CG . 25611 1 363 . 1 1 28 28 PRO CD C 13 50.105 0.400 . 1 . . . . A 28 PRO CD . 25611 1 364 . 1 1 29 29 SER H H 1 8.640 0.020 . 1 . . . . A 29 SER H . 25611 1 365 . 1 1 29 29 SER HA H 1 4.339 0.020 . 1 . . . . A 29 SER HA . 25611 1 366 . 1 1 29 29 SER HB2 H 1 3.996 0.020 . 2 . . . . A 29 SER HB2 . 25611 1 367 . 1 1 29 29 SER HB3 H 1 3.923 0.020 . 2 . . . . A 29 SER HB3 . 25611 1 368 . 1 1 29 29 SER C C 13 174.530 0.400 . 1 . . . . A 29 SER C . 25611 1 369 . 1 1 29 29 SER CA C 13 60.322 0.400 . 1 . . . . A 29 SER CA . 25611 1 370 . 1 1 29 29 SER CB C 13 63.372 0.400 . 1 . . . . A 29 SER CB . 25611 1 371 . 1 1 29 29 SER N N 15 117.944 0.400 . 1 . . . . A 29 SER N . 25611 1 372 . 1 1 30 30 VAL H H 1 8.336 0.020 . 1 . . . . A 30 VAL H . 25611 1 373 . 1 1 30 30 VAL HA H 1 4.444 0.020 . 1 . . . . A 30 VAL HA . 25611 1 374 . 1 1 30 30 VAL HB H 1 2.019 0.020 . 1 . . . . A 30 VAL HB . 25611 1 375 . 1 1 30 30 VAL HG11 H 1 0.941 0.020 . 2 . . . . A 30 VAL HG11 . 25611 1 376 . 1 1 30 30 VAL HG12 H 1 0.941 0.020 . 2 . . . . A 30 VAL HG12 . 25611 1 377 . 1 1 30 30 VAL HG13 H 1 0.941 0.020 . 2 . . . . A 30 VAL HG13 . 25611 1 378 . 1 1 30 30 VAL HG21 H 1 0.950 0.020 . 2 . . . . A 30 VAL HG21 . 25611 1 379 . 1 1 30 30 VAL HG22 H 1 0.950 0.020 . 2 . . . . A 30 VAL HG22 . 25611 1 380 . 1 1 30 30 VAL HG23 H 1 0.950 0.020 . 2 . . . . A 30 VAL HG23 . 25611 1 381 . 1 1 30 30 VAL C C 13 174.884 0.400 . 1 . . . . A 30 VAL C . 25611 1 382 . 1 1 30 30 VAL CA C 13 60.616 0.400 . 1 . . . . A 30 VAL CA . 25611 1 383 . 1 1 30 30 VAL CB C 13 33.629 0.400 . 1 . . . . A 30 VAL CB . 25611 1 384 . 1 1 30 30 VAL CG1 C 13 21.830 0.400 . 1 . . . . A 30 VAL CG1 . 25611 1 385 . 1 1 30 30 VAL CG2 C 13 20.868 0.400 . 1 . . . . A 30 VAL CG2 . 25611 1 386 . 1 1 30 30 VAL N N 15 121.195 0.400 . 1 . . . . A 30 VAL N . 25611 1 387 . 1 1 31 31 GLN H H 1 8.661 0.020 . 1 . . . . A 31 GLN H . 25611 1 388 . 1 1 31 31 GLN HA H 1 4.550 0.020 . 1 . . . . A 31 GLN HA . 25611 1 389 . 1 1 31 31 GLN HB2 H 1 2.128 0.020 . 2 . . . . A 31 GLN HB2 . 25611 1 390 . 1 1 31 31 GLN HB3 H 1 2.024 0.020 . 2 . . . . A 31 GLN HB3 . 25611 1 391 . 1 1 31 31 GLN HG2 H 1 2.396 0.020 . 2 . . . . A 31 GLN HG2 . 25611 1 392 . 1 1 31 31 GLN HG3 H 1 2.334 0.020 . 2 . . . . A 31 GLN HG3 . 25611 1 393 . 1 1 31 31 GLN HE21 H 1 7.484 0.020 . 2 . . . . A 31 GLN HE21 . 25611 1 394 . 1 1 31 31 GLN HE22 H 1 6.811 0.020 . 2 . . . . A 31 GLN HE22 . 25611 1 395 . 1 1 31 31 GLN C C 13 174.483 0.400 . 1 . . . . A 31 GLN C . 25611 1 396 . 1 1 31 31 GLN CA C 13 55.362 0.400 . 1 . . . . A 31 GLN CA . 25611 1 397 . 1 1 31 31 GLN CB C 13 29.747 0.400 . 1 . . . . A 31 GLN CB . 25611 1 398 . 1 1 31 31 GLN CG C 13 33.720 0.400 . 1 . . . . A 31 GLN CG . 25611 1 399 . 1 1 31 31 GLN N N 15 124.366 0.400 . 1 . . . . A 31 GLN N . 25611 1 400 . 1 1 31 31 GLN NE2 N 15 112.136 0.400 . 1 . . . . A 31 GLN NE2 . 25611 1 401 . 1 1 32 32 TYR H H 1 8.098 0.020 . 1 . . . . A 32 TYR H . 25611 1 402 . 1 1 32 32 TYR HA H 1 5.773 0.020 . 1 . . . . A 32 TYR HA . 25611 1 403 . 1 1 32 32 TYR HB2 H 1 2.730 0.020 . 2 . . . . A 32 TYR HB2 . 25611 1 404 . 1 1 32 32 TYR HB3 H 1 2.822 0.020 . 2 . . . . A 32 TYR HB3 . 25611 1 405 . 1 1 32 32 TYR HD1 H 1 6.710 0.020 . 1 . . . . A 32 TYR HD1 . 25611 1 406 . 1 1 32 32 TYR HD2 H 1 6.710 0.020 . 1 . . . . A 32 TYR HD2 . 25611 1 407 . 1 1 32 32 TYR HE1 H 1 6.702 0.020 . 1 . . . . A 32 TYR HE1 . 25611 1 408 . 1 1 32 32 TYR HE2 H 1 6.702 0.020 . 1 . . . . A 32 TYR HE2 . 25611 1 409 . 1 1 32 32 TYR C C 13 173.869 0.400 . 1 . . . . A 32 TYR C . 25611 1 410 . 1 1 32 32 TYR CA C 13 55.533 0.400 . 1 . . . . A 32 TYR CA . 25611 1 411 . 1 1 32 32 TYR CB C 13 42.044 0.400 . 1 . . . . A 32 TYR CB . 25611 1 412 . 1 1 32 32 TYR CD1 C 13 133.392 0.400 . 1 . . . . A 32 TYR CD1 . 25611 1 413 . 1 1 32 32 TYR CD2 C 13 133.375 0.400 . 1 . . . . A 32 TYR CD2 . 25611 1 414 . 1 1 32 32 TYR CE1 C 13 117.847 0.400 . 1 . . . . A 32 TYR CE1 . 25611 1 415 . 1 1 32 32 TYR CE2 C 13 117.847 0.400 . 1 . . . . A 32 TYR CE2 . 25611 1 416 . 1 1 32 32 TYR N N 15 119.240 0.400 . 1 . . . . A 32 TYR N . 25611 1 417 . 1 1 33 33 THR H H 1 8.741 0.020 . 1 . . . . A 33 THR H . 25611 1 418 . 1 1 33 33 THR HA H 1 4.556 0.020 . 1 . . . . A 33 THR HA . 25611 1 419 . 1 1 33 33 THR HB H 1 4.056 0.020 . 1 . . . . A 33 THR HB . 25611 1 420 . 1 1 33 33 THR HG21 H 1 1.180 0.020 . 1 . . . . A 33 THR HG21 . 25611 1 421 . 1 1 33 33 THR HG22 H 1 1.180 0.020 . 1 . . . . A 33 THR HG22 . 25611 1 422 . 1 1 33 33 THR HG23 H 1 1.180 0.020 . 1 . . . . A 33 THR HG23 . 25611 1 423 . 1 1 33 33 THR C C 13 173.095 0.400 . 1 . . . . A 33 THR C . 25611 1 424 . 1 1 33 33 THR CA C 13 60.711 0.400 . 1 . . . . A 33 THR CA . 25611 1 425 . 1 1 33 33 THR CB C 13 71.828 0.400 . 1 . . . . A 33 THR CB . 25611 1 426 . 1 1 33 33 THR CG2 C 13 21.440 0.400 . 1 . . . . A 33 THR CG2 . 25611 1 427 . 1 1 33 33 THR N N 15 113.095 0.400 . 1 . . . . A 33 THR N . 25611 1 428 . 1 1 34 34 GLU H H 1 9.205 0.020 . 1 . . . . A 34 GLU H . 25611 1 429 . 1 1 34 34 GLU HA H 1 5.520 0.020 . 1 . . . . A 34 GLU HA . 25611 1 430 . 1 1 34 34 GLU HB2 H 1 2.080 0.020 . 2 . . . . A 34 GLU HB2 . 25611 1 431 . 1 1 34 34 GLU HB3 H 1 2.221 0.020 . 2 . . . . A 34 GLU HB3 . 25611 1 432 . 1 1 34 34 GLU HG2 H 1 2.460 0.020 . 2 . . . . A 34 GLU HG2 . 25611 1 433 . 1 1 34 34 GLU HG3 H 1 2.367 0.020 . 2 . . . . A 34 GLU HG3 . 25611 1 434 . 1 1 34 34 GLU C C 13 175.017 0.400 . 1 . . . . A 34 GLU C . 25611 1 435 . 1 1 34 34 GLU CA C 13 54.673 0.400 . 1 . . . . A 34 GLU CA . 25611 1 436 . 1 1 34 34 GLU CB C 13 31.618 0.400 . 1 . . . . A 34 GLU CB . 25611 1 437 . 1 1 34 34 GLU CG C 13 34.367 0.400 . 1 . . . . A 34 GLU CG . 25611 1 438 . 1 1 34 34 GLU N N 15 126.281 0.400 . 1 . . . . A 34 GLU N . 25611 1 439 . 1 1 35 35 THR H H 1 8.866 0.020 . 1 . . . . A 35 THR H . 25611 1 440 . 1 1 35 35 THR HA H 1 4.713 0.020 . 1 . . . . A 35 THR HA . 25611 1 441 . 1 1 35 35 THR HB H 1 4.182 0.020 . 1 . . . . A 35 THR HB . 25611 1 442 . 1 1 35 35 THR HG21 H 1 1.142 0.020 . 1 . . . . A 35 THR HG21 . 25611 1 443 . 1 1 35 35 THR HG22 H 1 1.142 0.020 . 1 . . . . A 35 THR HG22 . 25611 1 444 . 1 1 35 35 THR HG23 H 1 1.142 0.020 . 1 . . . . A 35 THR HG23 . 25611 1 445 . 1 1 35 35 THR C C 13 172.908 0.400 . 1 . . . . A 35 THR C . 25611 1 446 . 1 1 35 35 THR CA C 13 60.514 0.400 . 1 . . . . A 35 THR CA . 25611 1 447 . 1 1 35 35 THR CB C 13 71.081 0.400 . 1 . . . . A 35 THR CB . 25611 1 448 . 1 1 35 35 THR CG2 C 13 21.009 0.400 . 1 . . . . A 35 THR CG2 . 25611 1 449 . 1 1 35 35 THR N N 15 117.827 0.400 . 1 . . . . A 35 THR N . 25611 1 450 . 1 1 36 36 THR H H 1 8.454 0.020 . 1 . . . . A 36 THR H . 25611 1 451 . 1 1 36 36 THR HA H 1 4.980 0.020 . 1 . . . . A 36 THR HA . 25611 1 452 . 1 1 36 36 THR HB H 1 3.988 0.020 . 1 . . . . A 36 THR HB . 25611 1 453 . 1 1 36 36 THR HG21 H 1 1.015 0.020 . 1 . . . . A 36 THR HG21 . 25611 1 454 . 1 1 36 36 THR HG22 H 1 1.015 0.020 . 1 . . . . A 36 THR HG22 . 25611 1 455 . 1 1 36 36 THR HG23 H 1 1.015 0.020 . 1 . . . . A 36 THR HG23 . 25611 1 456 . 1 1 36 36 THR C C 13 173.869 0.400 . 1 . . . . A 36 THR C . 25611 1 457 . 1 1 36 36 THR CA C 13 61.482 0.400 . 1 . . . . A 36 THR CA . 25611 1 458 . 1 1 36 36 THR CB C 13 69.884 0.400 . 1 . . . . A 36 THR CB . 25611 1 459 . 1 1 36 36 THR CG2 C 13 20.908 0.400 . 1 . . . . A 36 THR CG2 . 25611 1 460 . 1 1 36 36 THR N N 15 117.798 0.400 . 1 . . . . A 36 THR N . 25611 1 461 . 1 1 37 37 ARG H H 1 8.450 0.020 . 1 . . . . A 37 ARG H . 25611 1 462 . 1 1 37 37 ARG HA H 1 4.529 0.020 . 1 . . . . A 37 ARG HA . 25611 1 463 . 1 1 37 37 ARG HB2 H 1 1.756 0.020 . 1 . . . . A 37 ARG HB2 . 25611 1 464 . 1 1 37 37 ARG HB3 H 1 1.756 0.020 . 1 . . . . A 37 ARG HB3 . 25611 1 465 . 1 1 37 37 ARG HG2 H 1 1.538 0.020 . 2 . . . . A 37 ARG HG2 . 25611 1 466 . 1 1 37 37 ARG HG3 H 1 1.616 0.020 . 2 . . . . A 37 ARG HG3 . 25611 1 467 . 1 1 37 37 ARG HD2 H 1 3.206 0.020 . 1 . . . . A 37 ARG HD2 . 25611 1 468 . 1 1 37 37 ARG HD3 H 1 3.206 0.020 . 1 . . . . A 37 ARG HD3 . 25611 1 469 . 1 1 37 37 ARG C C 13 176.085 0.400 . 1 . . . . A 37 ARG C . 25611 1 470 . 1 1 37 37 ARG CA C 13 55.281 0.400 . 1 . . . . A 37 ARG CA . 25611 1 471 . 1 1 37 37 ARG CB C 13 31.988 0.400 . 1 . . . . A 37 ARG CB . 25611 1 472 . 1 1 37 37 ARG CG C 13 26.782 0.400 . 1 . . . . A 37 ARG CG . 25611 1 473 . 1 1 37 37 ARG CD C 13 43.100 0.400 . 1 . . . . A 37 ARG CD . 25611 1 474 . 1 1 37 37 ARG N N 15 125.152 0.400 . 1 . . . . A 37 ARG N . 25611 1 475 . 1 1 38 38 ASN H H 1 9.581 0.020 . 1 . . . . A 38 ASN H . 25611 1 476 . 1 1 38 38 ASN HA H 1 4.408 0.020 . 1 . . . . A 38 ASN HA . 25611 1 477 . 1 1 38 38 ASN HB2 H 1 3.055 0.020 . 2 . . . . A 38 ASN HB2 . 25611 1 478 . 1 1 38 38 ASN HB3 H 1 2.782 0.020 . 2 . . . . A 38 ASN HB3 . 25611 1 479 . 1 1 38 38 ASN HD21 H 1 7.611 0.020 . 2 . . . . A 38 ASN HD21 . 25611 1 480 . 1 1 38 38 ASN HD22 H 1 6.942 0.020 . 2 . . . . A 38 ASN HD22 . 25611 1 481 . 1 1 38 38 ASN C C 13 175.017 0.400 . 1 . . . . A 38 ASN C . 25611 1 482 . 1 1 38 38 ASN CA C 13 54.156 0.400 . 1 . . . . A 38 ASN CA . 25611 1 483 . 1 1 38 38 ASN CB C 13 37.252 0.400 . 1 . . . . A 38 ASN CB . 25611 1 484 . 1 1 38 38 ASN N N 15 124.576 0.400 . 1 . . . . A 38 ASN N . 25611 1 485 . 1 1 38 38 ASN ND2 N 15 112.607 0.400 . 1 . . . . A 38 ASN ND2 . 25611 1 486 . 1 1 39 39 GLY H H 1 8.607 0.020 . 1 . . . . A 39 GLY H . 25611 1 487 . 1 1 39 39 GLY HA2 H 1 3.598 0.020 . 2 . . . . A 39 GLY HA2 . 25611 1 488 . 1 1 39 39 GLY HA3 H 1 4.132 0.020 . 2 . . . . A 39 GLY HA3 . 25611 1 489 . 1 1 39 39 GLY C C 13 173.522 0.400 . 1 . . . . A 39 GLY C . 25611 1 490 . 1 1 39 39 GLY CA C 13 45.159 0.400 . 1 . . . . A 39 GLY CA . 25611 1 491 . 1 1 39 39 GLY N N 15 103.892 0.400 . 1 . . . . A 39 GLY N . 25611 1 492 . 1 1 40 40 ARG H H 1 7.794 0.020 . 1 . . . . A 40 ARG H . 25611 1 493 . 1 1 40 40 ARG HA H 1 4.625 0.020 . 1 . . . . A 40 ARG HA . 25611 1 494 . 1 1 40 40 ARG HB2 H 1 1.920 0.020 . 2 . . . . A 40 ARG HB2 . 25611 1 495 . 1 1 40 40 ARG HB3 H 1 1.849 0.020 . 2 . . . . A 40 ARG HB3 . 25611 1 496 . 1 1 40 40 ARG HG2 H 1 1.580 0.020 . 2 . . . . A 40 ARG HG2 . 25611 1 497 . 1 1 40 40 ARG HG3 H 1 1.666 0.020 . 2 . . . . A 40 ARG HG3 . 25611 1 498 . 1 1 40 40 ARG HD2 H 1 3.100 0.020 . 1 . . . . A 40 ARG HD2 . 25611 1 499 . 1 1 40 40 ARG HD3 H 1 3.101 0.020 . 1 . . . . A 40 ARG HD3 . 25611 1 500 . 1 1 40 40 ARG HE H 1 7.181 0.020 . 1 . . . . A 40 ARG HE . 25611 1 501 . 1 1 40 40 ARG C C 13 175.071 0.400 . 1 . . . . A 40 ARG C . 25611 1 502 . 1 1 40 40 ARG CA C 13 55.235 0.400 . 1 . . . . A 40 ARG CA . 25611 1 503 . 1 1 40 40 ARG CB C 13 31.466 0.400 . 1 . . . . A 40 ARG CB . 25611 1 504 . 1 1 40 40 ARG CG C 13 26.630 0.400 . 1 . . . . A 40 ARG CG . 25611 1 505 . 1 1 40 40 ARG CD C 13 43.401 0.400 . 1 . . . . A 40 ARG CD . 25611 1 506 . 1 1 40 40 ARG N N 15 120.550 0.400 . 1 . . . . A 40 ARG N . 25611 1 507 . 1 1 40 40 ARG NE N 15 -21.404 0.400 . 1 . . . . A 40 ARG NE . 25611 1 508 . 1 1 41 41 ARG H H 1 8.670 0.020 . 1 . . . . A 41 ARG H . 25611 1 509 . 1 1 41 41 ARG HA H 1 4.650 0.020 . 1 . . . . A 41 ARG HA . 25611 1 510 . 1 1 41 41 ARG HB2 H 1 1.399 0.020 . 2 . . . . A 41 ARG HB2 . 25611 1 511 . 1 1 41 41 ARG HB3 H 1 1.160 0.020 . 2 . . . . A 41 ARG HB3 . 25611 1 512 . 1 1 41 41 ARG HG2 H 1 1.395 0.020 . 2 . . . . A 41 ARG HG2 . 25611 1 513 . 1 1 41 41 ARG HG3 H 1 1.357 0.020 . 2 . . . . A 41 ARG HG3 . 25611 1 514 . 1 1 41 41 ARG HD2 H 1 2.666 0.020 . 2 . . . . A 41 ARG HD2 . 25611 1 515 . 1 1 41 41 ARG HD3 H 1 2.735 0.020 . 2 . . . . A 41 ARG HD3 . 25611 1 516 . 1 1 41 41 ARG HE H 1 7.429 0.020 . 1 . . . . A 41 ARG HE . 25611 1 517 . 1 1 41 41 ARG C C 13 175.071 0.400 . 1 . . . . A 41 ARG C . 25611 1 518 . 1 1 41 41 ARG CA C 13 55.761 0.400 . 1 . . . . A 41 ARG CA . 25611 1 519 . 1 1 41 41 ARG CB C 13 30.487 0.400 . 1 . . . . A 41 ARG CB . 25611 1 520 . 1 1 41 41 ARG CG C 13 27.213 0.400 . 1 . . . . A 41 ARG CG . 25611 1 521 . 1 1 41 41 ARG CD C 13 42.895 0.400 . 1 . . . . A 41 ARG CD . 25611 1 522 . 1 1 41 41 ARG N N 15 124.986 0.400 . 1 . . . . A 41 ARG N . 25611 1 523 . 1 1 41 41 ARG NE N 15 -20.480 0.400 . 1 . . . . A 41 ARG NE . 25611 1 524 . 1 1 42 42 GLN H H 1 8.798 0.020 . 1 . . . . A 42 GLN H . 25611 1 525 . 1 1 42 42 GLN HA H 1 5.292 0.020 . 1 . . . . A 42 GLN HA . 25611 1 526 . 1 1 42 42 GLN HB2 H 1 1.939 0.020 . 2 . . . . A 42 GLN HB2 . 25611 1 527 . 1 1 42 42 GLN HB3 H 1 1.795 0.020 . 2 . . . . A 42 GLN HB3 . 25611 1 528 . 1 1 42 42 GLN HG2 H 1 1.888 0.020 . 2 . . . . A 42 GLN HG2 . 25611 1 529 . 1 1 42 42 GLN HG3 H 1 2.020 0.020 . 2 . . . . A 42 GLN HG3 . 25611 1 530 . 1 1 42 42 GLN HE21 H 1 6.946 0.020 . 2 . . . . A 42 GLN HE21 . 25611 1 531 . 1 1 42 42 GLN HE22 H 1 7.045 0.020 . 2 . . . . A 42 GLN HE22 . 25611 1 532 . 1 1 42 42 GLN C C 13 174.163 0.400 . 1 . . . . A 42 GLN C . 25611 1 533 . 1 1 42 42 GLN CA C 13 53.814 0.400 . 1 . . . . A 42 GLN CA . 25611 1 534 . 1 1 42 42 GLN CB C 13 32.463 0.400 . 1 . . . . A 42 GLN CB . 25611 1 535 . 1 1 42 42 GLN CG C 13 33.720 0.400 . 1 . . . . A 42 GLN CG . 25611 1 536 . 1 1 42 42 GLN N N 15 121.577 0.400 . 1 . . . . A 42 GLN N . 25611 1 537 . 1 1 42 42 GLN NE2 N 15 111.037 0.400 . 1 . . . . A 42 GLN NE2 . 25611 1 538 . 1 1 43 43 LEU H H 1 9.067 0.020 . 1 . . . . A 43 LEU H . 25611 1 539 . 1 1 43 43 LEU HA H 1 5.338 0.020 . 1 . . . . A 43 LEU HA . 25611 1 540 . 1 1 43 43 LEU HB2 H 1 1.457 0.020 . 2 . . . . A 43 LEU HB2 . 25611 1 541 . 1 1 43 43 LEU HB3 H 1 1.370 0.020 . 2 . . . . A 43 LEU HB3 . 25611 1 542 . 1 1 43 43 LEU HG H 1 1.490 0.020 . 1 . . . . A 43 LEU HG . 25611 1 543 . 1 1 43 43 LEU HD11 H 1 0.566 0.020 . 2 . . . . A 43 LEU HD11 . 25611 1 544 . 1 1 43 43 LEU HD12 H 1 0.566 0.020 . 2 . . . . A 43 LEU HD12 . 25611 1 545 . 1 1 43 43 LEU HD13 H 1 0.566 0.020 . 2 . . . . A 43 LEU HD13 . 25611 1 546 . 1 1 43 43 LEU HD21 H 1 0.564 0.020 . 2 . . . . A 43 LEU HD21 . 25611 1 547 . 1 1 43 43 LEU HD22 H 1 0.564 0.020 . 2 . . . . A 43 LEU HD22 . 25611 1 548 . 1 1 43 43 LEU HD23 H 1 0.564 0.020 . 2 . . . . A 43 LEU HD23 . 25611 1 549 . 1 1 43 43 LEU C C 13 175.525 0.400 . 1 . . . . A 43 LEU C . 25611 1 550 . 1 1 43 43 LEU CA C 13 53.275 0.400 . 1 . . . . A 43 LEU CA . 25611 1 551 . 1 1 43 43 LEU CB C 13 46.125 0.400 . 1 . . . . A 43 LEU CB . 25611 1 552 . 1 1 43 43 LEU CG C 13 27.197 0.400 . 1 . . . . A 43 LEU CG . 25611 1 553 . 1 1 43 43 LEU CD1 C 13 25.070 0.400 . 1 . . . . A 43 LEU CD1 . 25611 1 554 . 1 1 43 43 LEU CD2 C 13 25.121 0.400 . 1 . . . . A 43 LEU CD2 . 25611 1 555 . 1 1 43 43 LEU N N 15 125.904 0.400 . 1 . . . . A 43 LEU N . 25611 1 556 . 1 1 44 44 THR H H 1 8.863 0.020 . 1 . . . . A 44 THR H . 25611 1 557 . 1 1 44 44 THR HA H 1 5.247 0.020 . 1 . . . . A 44 THR HA . 25611 1 558 . 1 1 44 44 THR HB H 1 3.985 0.020 . 1 . . . . A 44 THR HB . 25611 1 559 . 1 1 44 44 THR HG21 H 1 1.048 0.020 . 1 . . . . A 44 THR HG21 . 25611 1 560 . 1 1 44 44 THR HG22 H 1 1.048 0.020 . 1 . . . . A 44 THR HG22 . 25611 1 561 . 1 1 44 44 THR HG23 H 1 1.048 0.020 . 1 . . . . A 44 THR HG23 . 25611 1 562 . 1 1 44 44 THR C C 13 173.843 0.400 . 1 . . . . A 44 THR C . 25611 1 563 . 1 1 44 44 THR CA C 13 61.850 0.400 . 1 . . . . A 44 THR CA . 25611 1 564 . 1 1 44 44 THR CB C 13 69.934 0.400 . 1 . . . . A 44 THR CB . 25611 1 565 . 1 1 44 44 THR CG2 C 13 21.440 0.400 . 1 . . . . A 44 THR CG2 . 25611 1 566 . 1 1 44 44 THR N N 15 119.669 0.400 . 1 . . . . A 44 THR N . 25611 1 567 . 1 1 45 45 ILE H H 1 9.473 0.020 . 1 . . . . A 45 ILE H . 25611 1 568 . 1 1 45 45 ILE HA H 1 4.773 0.020 . 1 . . . . A 45 ILE HA . 25611 1 569 . 1 1 45 45 ILE HB H 1 1.709 0.020 . 1 . . . . A 45 ILE HB . 25611 1 570 . 1 1 45 45 ILE HG12 H 1 1.528 0.020 . 2 . . . . A 45 ILE HG12 . 25611 1 571 . 1 1 45 45 ILE HG13 H 1 0.970 0.020 . 2 . . . . A 45 ILE HG13 . 25611 1 572 . 1 1 45 45 ILE HG21 H 1 0.902 0.020 . 1 . . . . A 45 ILE HG21 . 25611 1 573 . 1 1 45 45 ILE HG22 H 1 0.902 0.020 . 1 . . . . A 45 ILE HG22 . 25611 1 574 . 1 1 45 45 ILE HG23 H 1 0.902 0.020 . 1 . . . . A 45 ILE HG23 . 25611 1 575 . 1 1 45 45 ILE HD11 H 1 0.733 0.020 . 1 . . . . A 45 ILE HD11 . 25611 1 576 . 1 1 45 45 ILE HD12 H 1 0.733 0.020 . 1 . . . . A 45 ILE HD12 . 25611 1 577 . 1 1 45 45 ILE HD13 H 1 0.733 0.020 . 1 . . . . A 45 ILE HD13 . 25611 1 578 . 1 1 45 45 ILE C C 13 174.323 0.400 . 1 . . . . A 45 ILE C . 25611 1 579 . 1 1 45 45 ILE CA C 13 60.209 0.400 . 1 . . . . A 45 ILE CA . 25611 1 580 . 1 1 45 45 ILE CB C 13 41.435 0.400 . 1 . . . . A 45 ILE CB . 25611 1 581 . 1 1 45 45 ILE CG1 C 13 27.650 0.400 . 1 . . . . A 45 ILE CG1 . 25611 1 582 . 1 1 45 45 ILE CG2 C 13 17.505 0.400 . 1 . . . . A 45 ILE CG2 . 25611 1 583 . 1 1 45 45 ILE CD1 C 13 15.237 0.400 . 1 . . . . A 45 ILE CD1 . 25611 1 584 . 1 1 45 45 ILE N N 15 128.542 0.400 . 1 . . . . A 45 ILE N . 25611 1 585 . 1 1 46 46 ARG H H 1 8.834 0.020 . 1 . . . . A 46 ARG H . 25611 1 586 . 1 1 46 46 ARG HA H 1 5.504 0.020 . 1 . . . . A 46 ARG HA . 25611 1 587 . 1 1 46 46 ARG HB2 H 1 1.790 0.020 . 2 . . . . A 46 ARG HB2 . 25611 1 588 . 1 1 46 46 ARG HB3 H 1 1.662 0.020 . 2 . . . . A 46 ARG HB3 . 25611 1 589 . 1 1 46 46 ARG HG2 H 1 1.576 0.020 . 2 . . . . A 46 ARG HG2 . 25611 1 590 . 1 1 46 46 ARG HG3 H 1 1.537 0.020 . 2 . . . . A 46 ARG HG3 . 25611 1 591 . 1 1 46 46 ARG HD2 H 1 3.121 0.020 . 1 . . . . A 46 ARG HD2 . 25611 1 592 . 1 1 46 46 ARG HD3 H 1 3.121 0.020 . 1 . . . . A 46 ARG HD3 . 25611 1 593 . 1 1 46 46 ARG HE H 1 7.203 0.020 . 1 . . . . A 46 ARG HE . 25611 1 594 . 1 1 46 46 ARG C C 13 175.231 0.400 . 1 . . . . A 46 ARG C . 25611 1 595 . 1 1 46 46 ARG CA C 13 54.470 0.400 . 1 . . . . A 46 ARG CA . 25611 1 596 . 1 1 46 46 ARG CB C 13 33.049 0.400 . 1 . . . . A 46 ARG CB . 25611 1 597 . 1 1 46 46 ARG CG C 13 27.592 0.400 . 1 . . . . A 46 ARG CG . 25611 1 598 . 1 1 46 46 ARG CD C 13 43.100 0.400 . 1 . . . . A 46 ARG CD . 25611 1 599 . 1 1 46 46 ARG N N 15 125.510 0.400 . 1 . . . . A 46 ARG N . 25611 1 600 . 1 1 46 46 ARG NE N 15 -21.473 0.400 . 1 . . . . A 46 ARG NE . 25611 1 601 . 1 1 47 47 SER H H 1 8.538 0.020 . 1 . . . . A 47 SER H . 25611 1 602 . 1 1 47 47 SER HA H 1 4.785 0.020 . 1 . . . . A 47 SER HA . 25611 1 603 . 1 1 47 47 SER HB2 H 1 3.858 0.020 . 2 . . . . A 47 SER HB2 . 25611 1 604 . 1 1 47 47 SER HB3 H 1 3.314 0.020 . 2 . . . . A 47 SER HB3 . 25611 1 605 . 1 1 47 47 SER C C 13 173.442 0.400 . 1 . . . . A 47 SER C . 25611 1 606 . 1 1 47 47 SER CA C 13 57.876 0.400 . 1 . . . . A 47 SER CA . 25611 1 607 . 1 1 47 47 SER CB C 13 65.013 0.400 . 1 . . . . A 47 SER CB . 25611 1 608 . 1 1 47 47 SER N N 15 113.644 0.400 . 1 . . . . A 47 SER N . 25611 1 609 . 1 1 48 48 ASN H H 1 8.956 0.020 . 1 . . . . A 48 ASN H . 25611 1 610 . 1 1 48 48 ASN HA H 1 5.499 0.020 . 1 . . . . A 48 ASN HA . 25611 1 611 . 1 1 48 48 ASN HB2 H 1 2.988 0.020 . 2 . . . . A 48 ASN HB2 . 25611 1 612 . 1 1 48 48 ASN HB3 H 1 3.157 0.020 . 2 . . . . A 48 ASN HB3 . 25611 1 613 . 1 1 48 48 ASN HD21 H 1 7.668 0.020 . 2 . . . . A 48 ASN HD21 . 25611 1 614 . 1 1 48 48 ASN HD22 H 1 6.966 0.020 . 2 . . . . A 48 ASN HD22 . 25611 1 615 . 1 1 48 48 ASN C C 13 174.430 0.400 . 1 . . . . A 48 ASN C . 25611 1 616 . 1 1 48 48 ASN CA C 13 53.083 0.400 . 1 . . . . A 48 ASN CA . 25611 1 617 . 1 1 48 48 ASN CB C 13 39.001 0.400 . 1 . . . . A 48 ASN CB . 25611 1 618 . 1 1 48 48 ASN N N 15 124.083 0.400 . 1 . . . . A 48 ASN N . 25611 1 619 . 1 1 48 48 ASN ND2 N 15 111.714 0.400 . 1 . . . . A 48 ASN ND2 . 25611 1 620 . 1 1 49 49 ASP H H 1 8.547 0.020 . 1 . . . . A 49 ASP H . 25611 1 621 . 1 1 49 49 ASP HA H 1 4.960 0.020 . 1 . . . . A 49 ASP HA . 25611 1 622 . 1 1 49 49 ASP HB2 H 1 2.856 0.020 . 2 . . . . A 49 ASP HB2 . 25611 1 623 . 1 1 49 49 ASP HB3 H 1 2.548 0.020 . 2 . . . . A 49 ASP HB3 . 25611 1 624 . 1 1 49 49 ASP C C 13 174.777 0.400 . 1 . . . . A 49 ASP C . 25611 1 625 . 1 1 49 49 ASP CA C 13 52.535 0.400 . 1 . . . . A 49 ASP CA . 25611 1 626 . 1 1 49 49 ASP CB C 13 42.745 0.400 . 1 . . . . A 49 ASP CB . 25611 1 627 . 1 1 49 49 ASP N N 15 121.236 0.400 . 1 . . . . A 49 ASP N . 25611 1 628 . 1 1 50 50 LYS H H 1 8.684 0.020 . 1 . . . . A 50 LYS H . 25611 1 629 . 1 1 50 50 LYS HA H 1 2.878 0.020 . 1 . . . . A 50 LYS HA . 25611 1 630 . 1 1 50 50 LYS HB2 H 1 1.385 0.020 . 2 . . . . A 50 LYS HB2 . 25611 1 631 . 1 1 50 50 LYS HB3 H 1 1.075 0.020 . 2 . . . . A 50 LYS HB3 . 25611 1 632 . 1 1 50 50 LYS HG2 H 1 1.064 0.020 . 2 . . . . A 50 LYS HG2 . 25611 1 633 . 1 1 50 50 LYS HG3 H 1 0.674 0.020 . 2 . . . . A 50 LYS HG3 . 25611 1 634 . 1 1 50 50 LYS HD2 H 1 1.123 0.020 . 2 . . . . A 50 LYS HD2 . 25611 1 635 . 1 1 50 50 LYS HD3 H 1 0.656 0.020 . 2 . . . . A 50 LYS HD3 . 25611 1 636 . 1 1 50 50 LYS HE2 H 1 2.680 0.020 . 2 . . . . A 50 LYS HE2 . 25611 1 637 . 1 1 50 50 LYS HE3 H 1 2.583 0.020 . 2 . . . . A 50 LYS HE3 . 25611 1 638 . 1 1 50 50 LYS C C 13 177.047 0.400 . 1 . . . . A 50 LYS C . 25611 1 639 . 1 1 50 50 LYS CA C 13 58.544 0.400 . 1 . . . . A 50 LYS CA . 25611 1 640 . 1 1 50 50 LYS CB C 13 31.967 0.400 . 1 . . . . A 50 LYS CB . 25611 1 641 . 1 1 50 50 LYS CG C 13 23.886 0.400 . 1 . . . . A 50 LYS CG . 25611 1 642 . 1 1 50 50 LYS CD C 13 27.663 0.400 . 1 . . . . A 50 LYS CD . 25611 1 643 . 1 1 50 50 LYS CE C 13 42.003 0.400 . 1 . . . . A 50 LYS CE . 25611 1 644 . 1 1 50 50 LYS N N 15 128.272 0.400 . 1 . . . . A 50 LYS N . 25611 1 645 . 1 1 51 51 ASN H H 1 8.042 0.020 . 1 . . . . A 51 ASN H . 25611 1 646 . 1 1 51 51 ASN HA H 1 4.287 0.020 . 1 . . . . A 51 ASN HA . 25611 1 647 . 1 1 51 51 ASN HB2 H 1 2.909 0.020 . 2 . . . . A 51 ASN HB2 . 25611 1 648 . 1 1 51 51 ASN HB3 H 1 2.690 0.020 . 2 . . . . A 51 ASN HB3 . 25611 1 649 . 1 1 51 51 ASN HD21 H 1 7.941 0.020 . 2 . . . . A 51 ASN HD21 . 25611 1 650 . 1 1 51 51 ASN HD22 H 1 6.998 0.020 . 2 . . . . A 51 ASN HD22 . 25611 1 651 . 1 1 51 51 ASN C C 13 177.928 0.400 . 1 . . . . A 51 ASN C . 25611 1 652 . 1 1 51 51 ASN CA C 13 56.083 0.400 . 1 . . . . A 51 ASN CA . 25611 1 653 . 1 1 51 51 ASN CB C 13 37.575 0.400 . 1 . . . . A 51 ASN CB . 25611 1 654 . 1 1 51 51 ASN N N 15 114.771 0.400 . 1 . . . . A 51 ASN N . 25611 1 655 . 1 1 51 51 ASN ND2 N 15 114.415 0.400 . 1 . . . . A 51 ASN ND2 . 25611 1 656 . 1 1 52 52 GLU H H 1 7.609 0.020 . 1 . . . . A 52 GLU H . 25611 1 657 . 1 1 52 52 GLU HA H 1 4.006 0.020 . 1 . . . . A 52 GLU HA . 25611 1 658 . 1 1 52 52 GLU HB2 H 1 2.034 0.020 . 2 . . . . A 52 GLU HB2 . 25611 1 659 . 1 1 52 52 GLU HB3 H 1 2.267 0.020 . 2 . . . . A 52 GLU HB3 . 25611 1 660 . 1 1 52 52 GLU HG2 H 1 2.247 0.020 . 2 . . . . A 52 GLU HG2 . 25611 1 661 . 1 1 52 52 GLU HG3 H 1 2.245 0.020 . 2 . . . . A 52 GLU HG3 . 25611 1 662 . 1 1 52 52 GLU C C 13 177.581 0.400 . 1 . . . . A 52 GLU C . 25611 1 663 . 1 1 52 52 GLU CA C 13 58.916 0.400 . 1 . . . . A 52 GLU CA . 25611 1 664 . 1 1 52 52 GLU CB C 13 28.434 0.400 . 1 . . . . A 52 GLU CB . 25611 1 665 . 1 1 52 52 GLU CG C 13 33.891 0.400 . 1 . . . . A 52 GLU CG . 25611 1 666 . 1 1 52 52 GLU N N 15 121.020 0.400 . 1 . . . . A 52 GLU N . 25611 1 667 . 1 1 53 53 VAL H H 1 7.679 0.020 . 1 . . . . A 53 VAL H . 25611 1 668 . 1 1 53 53 VAL HA H 1 3.328 0.020 . 1 . . . . A 53 VAL HA . 25611 1 669 . 1 1 53 53 VAL HB H 1 1.841 0.020 . 1 . . . . A 53 VAL HB . 25611 1 670 . 1 1 53 53 VAL HG11 H 1 0.660 0.020 . 2 . . . . A 53 VAL HG11 . 25611 1 671 . 1 1 53 53 VAL HG12 H 1 0.660 0.020 . 2 . . . . A 53 VAL HG12 . 25611 1 672 . 1 1 53 53 VAL HG13 H 1 0.660 0.020 . 2 . . . . A 53 VAL HG13 . 25611 1 673 . 1 1 53 53 VAL HG21 H 1 0.793 0.020 . 2 . . . . A 53 VAL HG21 . 25611 1 674 . 1 1 53 53 VAL HG22 H 1 0.793 0.020 . 2 . . . . A 53 VAL HG22 . 25611 1 675 . 1 1 53 53 VAL HG23 H 1 0.793 0.020 . 2 . . . . A 53 VAL HG23 . 25611 1 676 . 1 1 53 53 VAL C C 13 176.860 0.400 . 1 . . . . A 53 VAL C . 25611 1 677 . 1 1 53 53 VAL CA C 13 66.555 0.400 . 1 . . . . A 53 VAL CA . 25611 1 678 . 1 1 53 53 VAL CB C 13 30.760 0.400 . 1 . . . . A 53 VAL CB . 25611 1 679 . 1 1 53 53 VAL CG1 C 13 20.716 0.400 . 1 . . . . A 53 VAL CG1 . 25611 1 680 . 1 1 53 53 VAL CG2 C 13 22.539 0.400 . 1 . . . . A 53 VAL CG2 . 25611 1 681 . 1 1 53 53 VAL N N 15 119.048 0.400 . 1 . . . . A 53 VAL N . 25611 1 682 . 1 1 54 54 ASP H H 1 8.153 0.020 . 1 . . . . A 54 ASP H . 25611 1 683 . 1 1 54 54 ASP HA H 1 4.250 0.020 . 1 . . . . A 54 ASP HA . 25611 1 684 . 1 1 54 54 ASP HB2 H 1 2.687 0.020 . 2 . . . . A 54 ASP HB2 . 25611 1 685 . 1 1 54 54 ASP HB3 H 1 2.575 0.020 . 2 . . . . A 54 ASP HB3 . 25611 1 686 . 1 1 54 54 ASP C C 13 178.969 0.400 . 1 . . . . A 54 ASP C . 25611 1 687 . 1 1 54 54 ASP CA C 13 57.245 0.400 . 1 . . . . A 54 ASP CA . 25611 1 688 . 1 1 54 54 ASP CB C 13 39.258 0.400 . 1 . . . . A 54 ASP CB . 25611 1 689 . 1 1 54 54 ASP N N 15 118.766 0.400 . 1 . . . . A 54 ASP N . 25611 1 690 . 1 1 55 55 ARG H H 1 7.675 0.020 . 1 . . . . A 55 ARG H . 25611 1 691 . 1 1 55 55 ARG HA H 1 4.060 0.020 . 1 . . . . A 55 ARG HA . 25611 1 692 . 1 1 55 55 ARG HB2 H 1 1.880 0.020 . 2 . . . . A 55 ARG HB2 . 25611 1 693 . 1 1 55 55 ARG HB3 H 1 1.943 0.020 . 2 . . . . A 55 ARG HB3 . 25611 1 694 . 1 1 55 55 ARG HG2 H 1 1.756 0.020 . 2 . . . . A 55 ARG HG2 . 25611 1 695 . 1 1 55 55 ARG HG3 H 1 1.520 0.020 . 2 . . . . A 55 ARG HG3 . 25611 1 696 . 1 1 55 55 ARG HD2 H 1 3.219 0.020 . 1 . . . . A 55 ARG HD2 . 25611 1 697 . 1 1 55 55 ARG HD3 H 1 3.219 0.020 . 1 . . . . A 55 ARG HD3 . 25611 1 698 . 1 1 55 55 ARG HE H 1 7.516 0.020 . 1 . . . . A 55 ARG HE . 25611 1 699 . 1 1 55 55 ARG C C 13 179.263 0.400 . 1 . . . . A 55 ARG C . 25611 1 700 . 1 1 55 55 ARG CA C 13 59.357 0.400 . 1 . . . . A 55 ARG CA . 25611 1 701 . 1 1 55 55 ARG CB C 13 29.778 0.400 . 1 . . . . A 55 ARG CB . 25611 1 702 . 1 1 55 55 ARG CG C 13 27.310 0.400 . 1 . . . . A 55 ARG CG . 25611 1 703 . 1 1 55 55 ARG CD C 13 43.100 0.400 . 1 . . . . A 55 ARG CD . 25611 1 704 . 1 1 55 55 ARG N N 15 120.845 0.400 . 1 . . . . A 55 ARG N . 25611 1 705 . 1 1 55 55 ARG NE N 15 -23.150 0.400 . 1 . . . . A 55 ARG NE . 25611 1 706 . 1 1 56 56 ILE H H 1 8.302 0.020 . 1 . . . . A 56 ILE H . 25611 1 707 . 1 1 56 56 ILE HA H 1 3.621 0.020 . 1 . . . . A 56 ILE HA . 25611 1 708 . 1 1 56 56 ILE HB H 1 1.872 0.020 . 1 . . . . A 56 ILE HB . 25611 1 709 . 1 1 56 56 ILE HG12 H 1 1.771 0.020 . 2 . . . . A 56 ILE HG12 . 25611 1 710 . 1 1 56 56 ILE HG13 H 1 0.972 0.020 . 2 . . . . A 56 ILE HG13 . 25611 1 711 . 1 1 56 56 ILE HG21 H 1 0.735 0.020 . 1 . . . . A 56 ILE HG21 . 25611 1 712 . 1 1 56 56 ILE HG22 H 1 0.735 0.020 . 1 . . . . A 56 ILE HG22 . 25611 1 713 . 1 1 56 56 ILE HG23 H 1 0.735 0.020 . 1 . . . . A 56 ILE HG23 . 25611 1 714 . 1 1 56 56 ILE HD11 H 1 0.754 0.020 . 1 . . . . A 56 ILE HD11 . 25611 1 715 . 1 1 56 56 ILE HD12 H 1 0.754 0.020 . 1 . . . . A 56 ILE HD12 . 25611 1 716 . 1 1 56 56 ILE HD13 H 1 0.754 0.020 . 1 . . . . A 56 ILE HD13 . 25611 1 717 . 1 1 56 56 ILE C C 13 177.794 0.400 . 1 . . . . A 56 ILE C . 25611 1 718 . 1 1 56 56 ILE CA C 13 64.787 0.400 . 1 . . . . A 56 ILE CA . 25611 1 719 . 1 1 56 56 ILE CB C 13 37.398 0.400 . 1 . . . . A 56 ILE CB . 25611 1 720 . 1 1 56 56 ILE CG1 C 13 28.645 0.400 . 1 . . . . A 56 ILE CG1 . 25611 1 721 . 1 1 56 56 ILE CG2 C 13 17.297 0.400 . 1 . . . . A 56 ILE CG2 . 25611 1 722 . 1 1 56 56 ILE CD1 C 13 13.563 0.400 . 1 . . . . A 56 ILE CD1 . 25611 1 723 . 1 1 56 56 ILE N N 15 121.195 0.400 . 1 . . . . A 56 ILE N . 25611 1 724 . 1 1 57 57 LEU H H 1 8.555 0.020 . 1 . . . . A 57 LEU H . 25611 1 725 . 1 1 57 57 LEU HA H 1 3.823 0.020 . 1 . . . . A 57 LEU HA . 25611 1 726 . 1 1 57 57 LEU HB2 H 1 1.790 0.020 . 2 . . . . A 57 LEU HB2 . 25611 1 727 . 1 1 57 57 LEU HB3 H 1 1.613 0.020 . 2 . . . . A 57 LEU HB3 . 25611 1 728 . 1 1 57 57 LEU HG H 1 1.718 0.020 . 1 . . . . A 57 LEU HG . 25611 1 729 . 1 1 57 57 LEU HD11 H 1 0.830 0.020 . 2 . . . . A 57 LEU HD11 . 25611 1 730 . 1 1 57 57 LEU HD12 H 1 0.830 0.020 . 2 . . . . A 57 LEU HD12 . 25611 1 731 . 1 1 57 57 LEU HD13 H 1 0.830 0.020 . 2 . . . . A 57 LEU HD13 . 25611 1 732 . 1 1 57 57 LEU HD21 H 1 0.810 0.020 . 2 . . . . A 57 LEU HD21 . 25611 1 733 . 1 1 57 57 LEU HD22 H 1 0.810 0.020 . 2 . . . . A 57 LEU HD22 . 25611 1 734 . 1 1 57 57 LEU HD23 H 1 0.810 0.020 . 2 . . . . A 57 LEU HD23 . 25611 1 735 . 1 1 57 57 LEU C C 13 178.969 0.400 . 1 . . . . A 57 LEU C . 25611 1 736 . 1 1 57 57 LEU CA C 13 58.403 0.400 . 1 . . . . A 57 LEU CA . 25611 1 737 . 1 1 57 57 LEU CB C 13 41.141 0.400 . 1 . . . . A 57 LEU CB . 25611 1 738 . 1 1 57 57 LEU CG C 13 26.770 0.400 . 1 . . . . A 57 LEU CG . 25611 1 739 . 1 1 57 57 LEU CD1 C 13 24.868 0.400 . 1 . . . . A 57 LEU CD1 . 25611 1 740 . 1 1 57 57 LEU CD2 C 13 24.100 0.400 . 1 . . . . A 57 LEU CD2 . 25611 1 741 . 1 1 57 57 LEU N N 15 119.554 0.400 . 1 . . . . A 57 LEU N . 25611 1 742 . 1 1 58 58 GLU H H 1 7.693 0.020 . 1 . . . . A 58 GLU H . 25611 1 743 . 1 1 58 58 GLU HA H 1 4.035 0.020 . 1 . . . . A 58 GLU HA . 25611 1 744 . 1 1 58 58 GLU HB2 H 1 2.111 0.020 . 2 . . . . A 58 GLU HB2 . 25611 1 745 . 1 1 58 58 GLU HB3 H 1 2.116 0.020 . 2 . . . . A 58 GLU HB3 . 25611 1 746 . 1 1 58 58 GLU HG2 H 1 2.413 0.020 . 2 . . . . A 58 GLU HG2 . 25611 1 747 . 1 1 58 58 GLU HG3 H 1 2.358 0.020 . 2 . . . . A 58 GLU HG3 . 25611 1 748 . 1 1 58 58 GLU C C 13 178.515 0.400 . 1 . . . . A 58 GLU C . 25611 1 749 . 1 1 58 58 GLU CA C 13 59.113 0.400 . 1 . . . . A 58 GLU CA . 25611 1 750 . 1 1 58 58 GLU CB C 13 28.489 0.400 . 1 . . . . A 58 GLU CB . 25611 1 751 . 1 1 58 58 GLU CG C 13 34.772 0.400 . 1 . . . . A 58 GLU CG . 25611 1 752 . 1 1 58 58 GLU N N 15 117.828 0.400 . 1 . . . . A 58 GLU N . 25611 1 753 . 1 1 59 59 GLU H H 1 7.818 0.020 . 1 . . . . A 59 GLU H . 25611 1 754 . 1 1 59 59 GLU HA H 1 4.038 0.020 . 1 . . . . A 59 GLU HA . 25611 1 755 . 1 1 59 59 GLU HB2 H 1 2.199 0.020 . 2 . . . . A 59 GLU HB2 . 25611 1 756 . 1 1 59 59 GLU HB3 H 1 2.013 0.020 . 2 . . . . A 59 GLU HB3 . 25611 1 757 . 1 1 59 59 GLU HG2 H 1 2.297 0.020 . 2 . . . . A 59 GLU HG2 . 25611 1 758 . 1 1 59 59 GLU HG3 H 1 2.340 0.020 . 2 . . . . A 59 GLU HG3 . 25611 1 759 . 1 1 59 59 GLU C C 13 179.076 0.400 . 1 . . . . A 59 GLU C . 25611 1 760 . 1 1 59 59 GLU CA C 13 58.896 0.400 . 1 . . . . A 59 GLU CA . 25611 1 761 . 1 1 59 59 GLU CB C 13 28.622 0.400 . 1 . . . . A 59 GLU CB . 25611 1 762 . 1 1 59 59 GLU CG C 13 34.772 0.400 . 1 . . . . A 59 GLU CG . 25611 1 763 . 1 1 59 59 GLU N N 15 119.258 0.400 . 1 . . . . A 59 GLU N . 25611 1 764 . 1 1 60 60 VAL H H 1 8.648 0.020 . 1 . . . . A 60 VAL H . 25611 1 765 . 1 1 60 60 VAL HA H 1 3.454 0.020 . 1 . . . . A 60 VAL HA . 25611 1 766 . 1 1 60 60 VAL HB H 1 2.171 0.020 . 1 . . . . A 60 VAL HB . 25611 1 767 . 1 1 60 60 VAL HG11 H 1 0.941 0.020 . 2 . . . . A 60 VAL HG11 . 25611 1 768 . 1 1 60 60 VAL HG12 H 1 0.941 0.020 . 2 . . . . A 60 VAL HG12 . 25611 1 769 . 1 1 60 60 VAL HG13 H 1 0.941 0.020 . 2 . . . . A 60 VAL HG13 . 25611 1 770 . 1 1 60 60 VAL HG21 H 1 0.830 0.020 . 2 . . . . A 60 VAL HG21 . 25611 1 771 . 1 1 60 60 VAL HG22 H 1 0.830 0.020 . 2 . . . . A 60 VAL HG22 . 25611 1 772 . 1 1 60 60 VAL HG23 H 1 0.830 0.020 . 2 . . . . A 60 VAL HG23 . 25611 1 773 . 1 1 60 60 VAL C C 13 177.153 0.400 . 1 . . . . A 60 VAL C . 25611 1 774 . 1 1 60 60 VAL CA C 13 66.286 0.400 . 1 . . . . A 60 VAL CA . 25611 1 775 . 1 1 60 60 VAL CB C 13 31.310 0.400 . 1 . . . . A 60 VAL CB . 25611 1 776 . 1 1 60 60 VAL CG1 C 13 22.842 0.400 . 1 . . . . A 60 VAL CG1 . 25611 1 777 . 1 1 60 60 VAL CG2 C 13 21.310 0.400 . 1 . . . . A 60 VAL CG2 . 25611 1 778 . 1 1 60 60 VAL N N 15 119.251 0.400 . 1 . . . . A 60 VAL N . 25611 1 779 . 1 1 61 61 ARG H H 1 7.976 0.020 . 1 . . . . A 61 ARG H . 25611 1 780 . 1 1 61 61 ARG HA H 1 4.043 0.020 . 1 . . . . A 61 ARG HA . 25611 1 781 . 1 1 61 61 ARG HB2 H 1 1.896 0.020 . 2 . . . . A 61 ARG HB2 . 25611 1 782 . 1 1 61 61 ARG HB3 H 1 1.907 0.020 . 2 . . . . A 61 ARG HB3 . 25611 1 783 . 1 1 61 61 ARG HG2 H 1 1.670 0.020 . 2 . . . . A 61 ARG HG2 . 25611 1 784 . 1 1 61 61 ARG HG3 H 1 1.810 0.020 . 2 . . . . A 61 ARG HG3 . 25611 1 785 . 1 1 61 61 ARG HD2 H 1 3.191 0.020 . 2 . . . . A 61 ARG HD2 . 25611 1 786 . 1 1 61 61 ARG HD3 H 1 3.189 0.020 . 2 . . . . A 61 ARG HD3 . 25611 1 787 . 1 1 61 61 ARG HE H 1 7.299 0.020 . 1 . . . . A 61 ARG HE . 25611 1 788 . 1 1 61 61 ARG C C 13 177.821 0.400 . 1 . . . . A 61 ARG C . 25611 1 789 . 1 1 61 61 ARG CA C 13 58.917 0.400 . 1 . . . . A 61 ARG CA . 25611 1 790 . 1 1 61 61 ARG CB C 13 29.625 0.400 . 1 . . . . A 61 ARG CB . 25611 1 791 . 1 1 61 61 ARG CG C 13 27.947 0.400 . 1 . . . . A 61 ARG CG . 25611 1 792 . 1 1 61 61 ARG CD C 13 43.100 0.400 . 1 . . . . A 61 ARG CD . 25611 1 793 . 1 1 61 61 ARG N N 15 117.466 0.400 . 1 . . . . A 61 ARG N . 25611 1 794 . 1 1 61 61 ARG NE N 15 -21.542 0.400 . 1 . . . . A 61 ARG NE . 25611 1 795 . 1 1 62 62 ARG H H 1 7.551 0.020 . 1 . . . . A 62 ARG H . 25611 1 796 . 1 1 62 62 ARG HA H 1 4.139 0.020 . 1 . . . . A 62 ARG HA . 25611 1 797 . 1 1 62 62 ARG HB2 H 1 1.887 0.020 . 1 . . . . A 62 ARG HB2 . 25611 1 798 . 1 1 62 62 ARG HB3 H 1 1.888 0.020 . 1 . . . . A 62 ARG HB3 . 25611 1 799 . 1 1 62 62 ARG HG2 H 1 1.798 0.020 . 2 . . . . A 62 ARG HG2 . 25611 1 800 . 1 1 62 62 ARG HG3 H 1 1.636 0.020 . 2 . . . . A 62 ARG HG3 . 25611 1 801 . 1 1 62 62 ARG HD2 H 1 3.214 0.020 . 2 . . . . A 62 ARG HD2 . 25611 1 802 . 1 1 62 62 ARG HD3 H 1 3.217 0.020 . 2 . . . . A 62 ARG HD3 . 25611 1 803 . 1 1 62 62 ARG HE H 1 7.464 0.020 . 1 . . . . A 62 ARG HE . 25611 1 804 . 1 1 62 62 ARG C C 13 177.848 0.400 . 1 . . . . A 62 ARG C . 25611 1 805 . 1 1 62 62 ARG CA C 13 57.864 0.400 . 1 . . . . A 62 ARG CA . 25611 1 806 . 1 1 62 62 ARG CB C 13 30.623 0.400 . 1 . . . . A 62 ARG CB . 25611 1 807 . 1 1 62 62 ARG CG C 13 27.542 0.400 . 1 . . . . A 62 ARG CG . 25611 1 808 . 1 1 62 62 ARG CD C 13 43.100 0.400 . 1 . . . . A 62 ARG CD . 25611 1 809 . 1 1 62 62 ARG N N 15 115.261 0.400 . 1 . . . . A 62 ARG N . 25611 1 810 . 1 1 62 62 ARG NE N 15 -21.437 0.400 . 1 . . . . A 62 ARG NE . 25611 1 811 . 1 1 63 63 LYS H H 1 8.019 0.020 . 1 . . . . A 63 LYS H . 25611 1 812 . 1 1 63 63 LYS HA H 1 4.371 0.020 . 1 . . . . A 63 LYS HA . 25611 1 813 . 1 1 63 63 LYS HB2 H 1 1.856 0.020 . 1 . . . . A 63 LYS HB2 . 25611 1 814 . 1 1 63 63 LYS HB3 H 1 1.855 0.020 . 1 . . . . A 63 LYS HB3 . 25611 1 815 . 1 1 63 63 LYS HG2 H 1 1.478 0.020 . 2 . . . . A 63 LYS HG2 . 25611 1 816 . 1 1 63 63 LYS HG3 H 1 1.475 0.020 . 2 . . . . A 63 LYS HG3 . 25611 1 817 . 1 1 63 63 LYS HD2 H 1 1.641 0.020 . 2 . . . . A 63 LYS HD2 . 25611 1 818 . 1 1 63 63 LYS HD3 H 1 1.652 0.020 . 2 . . . . A 63 LYS HD3 . 25611 1 819 . 1 1 63 63 LYS HE2 H 1 2.930 0.020 . 1 . . . . A 63 LYS HE2 . 25611 1 820 . 1 1 63 63 LYS HE3 H 1 2.930 0.020 . 1 . . . . A 63 LYS HE3 . 25611 1 821 . 1 1 63 63 LYS C C 13 176.860 0.400 . 1 . . . . A 63 LYS C . 25611 1 822 . 1 1 63 63 LYS CA C 13 56.561 0.400 . 1 . . . . A 63 LYS CA . 25611 1 823 . 1 1 63 63 LYS CB C 13 33.477 0.400 . 1 . . . . A 63 LYS CB . 25611 1 824 . 1 1 63 63 LYS CG C 13 24.910 0.400 . 1 . . . . A 63 LYS CG . 25611 1 825 . 1 1 63 63 LYS CD C 13 28.068 0.400 . 1 . . . . A 63 LYS CD . 25611 1 826 . 1 1 63 63 LYS CE C 13 41.780 0.400 . 1 . . . . A 63 LYS CE . 25611 1 827 . 1 1 63 63 LYS N N 15 116.374 0.400 . 1 . . . . A 63 LYS N . 25611 1 828 . 1 1 64 64 VAL H H 1 8.476 0.020 . 1 . . . . A 64 VAL H . 25611 1 829 . 1 1 64 64 VAL HA H 1 4.564 0.020 . 1 . . . . A 64 VAL HA . 25611 1 830 . 1 1 64 64 VAL HB H 1 2.273 0.020 . 1 . . . . A 64 VAL HB . 25611 1 831 . 1 1 64 64 VAL HG11 H 1 0.953 0.020 . 2 . . . . A 64 VAL HG11 . 25611 1 832 . 1 1 64 64 VAL HG12 H 1 0.953 0.020 . 2 . . . . A 64 VAL HG12 . 25611 1 833 . 1 1 64 64 VAL HG13 H 1 0.953 0.020 . 2 . . . . A 64 VAL HG13 . 25611 1 834 . 1 1 64 64 VAL HG21 H 1 0.887 0.020 . 2 . . . . A 64 VAL HG21 . 25611 1 835 . 1 1 64 64 VAL HG22 H 1 0.887 0.020 . 2 . . . . A 64 VAL HG22 . 25611 1 836 . 1 1 64 64 VAL HG23 H 1 0.887 0.020 . 2 . . . . A 64 VAL HG23 . 25611 1 837 . 1 1 64 64 VAL CA C 13 60.821 0.400 . 1 . . . . A 64 VAL CA . 25611 1 838 . 1 1 64 64 VAL CB C 13 31.433 0.400 . 1 . . . . A 64 VAL CB . 25611 1 839 . 1 1 64 64 VAL CG1 C 13 23.096 0.400 . 1 . . . . A 64 VAL CG1 . 25611 1 840 . 1 1 64 64 VAL CG2 C 13 20.513 0.400 . 1 . . . . A 64 VAL CG2 . 25611 1 841 . 1 1 64 64 VAL N N 15 118.101 0.400 . 1 . . . . A 64 VAL N . 25611 1 842 . 1 1 65 65 PRO HA H 1 4.462 0.020 . 1 . . . . A 65 PRO HA . 25611 1 843 . 1 1 65 65 PRO HB2 H 1 2.422 0.020 . 2 . . . . A 65 PRO HB2 . 25611 1 844 . 1 1 65 65 PRO HB3 H 1 1.935 0.020 . 2 . . . . A 65 PRO HB3 . 25611 1 845 . 1 1 65 65 PRO HG2 H 1 1.991 0.020 . 2 . . . . A 65 PRO HG2 . 25611 1 846 . 1 1 65 65 PRO HG3 H 1 1.942 0.020 . 2 . . . . A 65 PRO HG3 . 25611 1 847 . 1 1 65 65 PRO HD2 H 1 3.641 0.020 . 2 . . . . A 65 PRO HD2 . 25611 1 848 . 1 1 65 65 PRO HD3 H 1 3.350 0.020 . 2 . . . . A 65 PRO HD3 . 25611 1 849 . 1 1 65 65 PRO C C 13 177.554 0.400 . 1 . . . . A 65 PRO C . 25611 1 850 . 1 1 65 65 PRO CA C 13 64.415 0.400 . 1 . . . . A 65 PRO CA . 25611 1 851 . 1 1 65 65 PRO CB C 13 31.967 0.400 . 1 . . . . A 65 PRO CB . 25611 1 852 . 1 1 65 65 PRO CG C 13 27.140 0.400 . 1 . . . . A 65 PRO CG . 25611 1 853 . 1 1 65 65 PRO CD C 13 50.280 0.400 . 1 . . . . A 65 PRO CD . 25611 1 854 . 1 1 66 66 ASN H H 1 8.587 0.020 . 1 . . . . A 66 ASN H . 25611 1 855 . 1 1 66 66 ASN HA H 1 4.763 0.020 . 1 . . . . A 66 ASN HA . 25611 1 856 . 1 1 66 66 ASN HB2 H 1 2.870 0.020 . 2 . . . . A 66 ASN HB2 . 25611 1 857 . 1 1 66 66 ASN HB3 H 1 2.924 0.020 . 2 . . . . A 66 ASN HB3 . 25611 1 858 . 1 1 66 66 ASN HD21 H 1 7.779 0.020 . 2 . . . . A 66 ASN HD21 . 25611 1 859 . 1 1 66 66 ASN HD22 H 1 7.012 0.020 . 2 . . . . A 66 ASN HD22 . 25611 1 860 . 1 1 66 66 ASN C C 13 175.525 0.400 . 1 . . . . A 66 ASN C . 25611 1 861 . 1 1 66 66 ASN CA C 13 53.153 0.400 . 1 . . . . A 66 ASN CA . 25611 1 862 . 1 1 66 66 ASN CB C 13 38.075 0.400 . 1 . . . . A 66 ASN CB . 25611 1 863 . 1 1 66 66 ASN N N 15 114.861 0.400 . 1 . . . . A 66 ASN N . 25611 1 864 . 1 1 66 66 ASN ND2 N 15 113.716 0.400 . 1 . . . . A 66 ASN ND2 . 25611 1 865 . 1 1 67 67 ALA H H 1 7.888 0.020 . 1 . . . . A 67 ALA H . 25611 1 866 . 1 1 67 67 ALA HA H 1 4.388 0.020 . 1 . . . . A 67 ALA HA . 25611 1 867 . 1 1 67 67 ALA HB1 H 1 1.339 0.020 . 1 . . . . A 67 ALA HB1 . 25611 1 868 . 1 1 67 67 ALA HB2 H 1 1.339 0.020 . 1 . . . . A 67 ALA HB2 . 25611 1 869 . 1 1 67 67 ALA HB3 H 1 1.339 0.020 . 1 . . . . A 67 ALA HB3 . 25611 1 870 . 1 1 67 67 ALA C C 13 177.340 0.400 . 1 . . . . A 67 ALA C . 25611 1 871 . 1 1 67 67 ALA CA C 13 52.729 0.400 . 1 . . . . A 67 ALA CA . 25611 1 872 . 1 1 67 67 ALA CB C 13 18.573 0.400 . 1 . . . . A 67 ALA CB . 25611 1 873 . 1 1 67 67 ALA N N 15 122.886 0.400 . 1 . . . . A 67 ALA N . 25611 1 874 . 1 1 68 68 ARG H H 1 8.459 0.020 . 1 . . . . A 68 ARG H . 25611 1 875 . 1 1 68 68 ARG HA H 1 4.633 0.020 . 1 . . . . A 68 ARG HA . 25611 1 876 . 1 1 68 68 ARG HB2 H 1 1.843 0.020 . 2 . . . . A 68 ARG HB2 . 25611 1 877 . 1 1 68 68 ARG HB3 H 1 1.926 0.020 . 2 . . . . A 68 ARG HB3 . 25611 1 878 . 1 1 68 68 ARG HG2 H 1 1.614 0.020 . 2 . . . . A 68 ARG HG2 . 25611 1 879 . 1 1 68 68 ARG HG3 H 1 1.729 0.020 . 2 . . . . A 68 ARG HG3 . 25611 1 880 . 1 1 68 68 ARG HD2 H 1 3.201 0.020 . 2 . . . . A 68 ARG HD2 . 25611 1 881 . 1 1 68 68 ARG HD3 H 1 3.207 0.020 . 2 . . . . A 68 ARG HD3 . 25611 1 882 . 1 1 68 68 ARG C C 13 174.964 0.400 . 1 . . . . A 68 ARG C . 25611 1 883 . 1 1 68 68 ARG CA C 13 55.338 0.400 . 1 . . . . A 68 ARG CA . 25611 1 884 . 1 1 68 68 ARG CB C 13 30.958 0.400 . 1 . . . . A 68 ARG CB . 25611 1 885 . 1 1 68 68 ARG CG C 13 27.310 0.400 . 1 . . . . A 68 ARG CG . 25611 1 886 . 1 1 68 68 ARG CD C 13 43.100 0.400 . 1 . . . . A 68 ARG CD . 25611 1 887 . 1 1 68 68 ARG N N 15 121.922 0.400 . 1 . . . . A 68 ARG N . 25611 1 888 . 1 1 69 69 VAL H H 1 8.498 0.020 . 1 . . . . A 69 VAL H . 25611 1 889 . 1 1 69 69 VAL HA H 1 5.020 0.020 . 1 . . . . A 69 VAL HA . 25611 1 890 . 1 1 69 69 VAL HB H 1 1.960 0.020 . 1 . . . . A 69 VAL HB . 25611 1 891 . 1 1 69 69 VAL HG11 H 1 0.882 0.020 . 2 . . . . A 69 VAL HG11 . 25611 1 892 . 1 1 69 69 VAL HG12 H 1 0.882 0.020 . 2 . . . . A 69 VAL HG12 . 25611 1 893 . 1 1 69 69 VAL HG13 H 1 0.882 0.020 . 2 . . . . A 69 VAL HG13 . 25611 1 894 . 1 1 69 69 VAL HG21 H 1 0.887 0.020 . 2 . . . . A 69 VAL HG21 . 25611 1 895 . 1 1 69 69 VAL HG22 H 1 0.887 0.020 . 2 . . . . A 69 VAL HG22 . 25611 1 896 . 1 1 69 69 VAL HG23 H 1 0.887 0.020 . 2 . . . . A 69 VAL HG23 . 25611 1 897 . 1 1 69 69 VAL C C 13 175.498 0.400 . 1 . . . . A 69 VAL C . 25611 1 898 . 1 1 69 69 VAL CA C 13 61.025 0.400 . 1 . . . . A 69 VAL CA . 25611 1 899 . 1 1 69 69 VAL CB C 13 34.327 0.400 . 1 . . . . A 69 VAL CB . 25611 1 900 . 1 1 69 69 VAL CG1 C 13 21.380 0.400 . 1 . . . . A 69 VAL CG1 . 25611 1 901 . 1 1 69 69 VAL CG2 C 13 21.310 0.400 . 1 . . . . A 69 VAL CG2 . 25611 1 902 . 1 1 69 69 VAL N N 15 123.012 0.400 . 1 . . . . A 69 VAL N . 25611 1 903 . 1 1 70 70 ARG H H 1 9.037 0.020 . 1 . . . . A 70 ARG H . 25611 1 904 . 1 1 70 70 ARG HA H 1 4.766 0.020 . 1 . . . . A 70 ARG HA . 25611 1 905 . 1 1 70 70 ARG HB2 H 1 1.836 0.020 . 2 . . . . A 70 ARG HB2 . 25611 1 906 . 1 1 70 70 ARG HB3 H 1 1.920 0.020 . 2 . . . . A 70 ARG HB3 . 25611 1 907 . 1 1 70 70 ARG HG2 H 1 1.714 0.020 . 2 . . . . A 70 ARG HG2 . 25611 1 908 . 1 1 70 70 ARG HG3 H 1 1.625 0.020 . 2 . . . . A 70 ARG HG3 . 25611 1 909 . 1 1 70 70 ARG HD2 H 1 3.264 0.020 . 2 . . . . A 70 ARG HD2 . 25611 1 910 . 1 1 70 70 ARG HD3 H 1 3.261 0.020 . 2 . . . . A 70 ARG HD3 . 25611 1 911 . 1 1 70 70 ARG HE H 1 7.262 0.020 . 1 . . . . A 70 ARG HE . 25611 1 912 . 1 1 70 70 ARG C C 13 174.724 0.400 . 1 . . . . A 70 ARG C . 25611 1 913 . 1 1 70 70 ARG CA C 13 55.000 0.400 . 1 . . . . A 70 ARG CA . 25611 1 914 . 1 1 70 70 ARG CB C 13 32.900 0.400 . 1 . . . . A 70 ARG CB . 25611 1 915 . 1 1 70 70 ARG CG C 13 27.310 0.400 . 1 . . . . A 70 ARG CG . 25611 1 916 . 1 1 70 70 ARG CD C 13 43.100 0.400 . 1 . . . . A 70 ARG CD . 25611 1 917 . 1 1 70 70 ARG N N 15 125.842 0.400 . 1 . . . . A 70 ARG N . 25611 1 918 . 1 1 70 70 ARG NE N 15 -20.927 0.400 . 1 . . . . A 70 ARG NE . 25611 1 919 . 1 1 71 71 GLU H H 1 9.178 0.020 . 1 . . . . A 71 GLU H . 25611 1 920 . 1 1 71 71 GLU HA H 1 5.378 0.020 . 1 . . . . A 71 GLU HA . 25611 1 921 . 1 1 71 71 GLU HB2 H 1 2.167 0.020 . 2 . . . . A 71 GLU HB2 . 25611 1 922 . 1 1 71 71 GLU HB3 H 1 1.902 0.020 . 2 . . . . A 71 GLU HB3 . 25611 1 923 . 1 1 71 71 GLU HG2 H 1 2.341 0.020 . 2 . . . . A 71 GLU HG2 . 25611 1 924 . 1 1 71 71 GLU HG3 H 1 2.336 0.020 . 2 . . . . A 71 GLU HG3 . 25611 1 925 . 1 1 71 71 GLU C C 13 175.098 0.400 . 1 . . . . A 71 GLU C . 25611 1 926 . 1 1 71 71 GLU CA C 13 54.704 0.400 . 1 . . . . A 71 GLU CA . 25611 1 927 . 1 1 71 71 GLU CB C 13 30.803 0.400 . 1 . . . . A 71 GLU CB . 25611 1 928 . 1 1 71 71 GLU CG C 13 33.284 0.400 . 1 . . . . A 71 GLU CG . 25611 1 929 . 1 1 71 71 GLU N N 15 126.956 0.400 . 1 . . . . A 71 GLU N . 25611 1 930 . 1 1 72 72 THR H H 1 9.028 0.020 . 1 . . . . A 72 THR H . 25611 1 931 . 1 1 72 72 THR HA H 1 4.670 0.020 . 1 . . . . A 72 THR HA . 25611 1 932 . 1 1 72 72 THR HB H 1 4.139 0.020 . 1 . . . . A 72 THR HB . 25611 1 933 . 1 1 72 72 THR HG21 H 1 1.160 0.020 . 1 . . . . A 72 THR HG21 . 25611 1 934 . 1 1 72 72 THR HG22 H 1 1.160 0.020 . 1 . . . . A 72 THR HG22 . 25611 1 935 . 1 1 72 72 THR HG23 H 1 1.160 0.020 . 1 . . . . A 72 THR HG23 . 25611 1 936 . 1 1 72 72 THR C C 13 172.561 0.400 . 1 . . . . A 72 THR C . 25611 1 937 . 1 1 72 72 THR CA C 13 60.856 0.400 . 1 . . . . A 72 THR CA . 25611 1 938 . 1 1 72 72 THR CB C 13 71.578 0.400 . 1 . . . . A 72 THR CB . 25611 1 939 . 1 1 72 72 THR CG2 C 13 21.718 0.400 . 1 . . . . A 72 THR CG2 . 25611 1 940 . 1 1 72 72 THR N N 15 117.998 0.400 . 1 . . . . A 72 THR N . 25611 1 941 . 1 1 73 73 GLU H H 1 8.549 0.020 . 1 . . . . A 73 GLU H . 25611 1 942 . 1 1 73 73 GLU HA H 1 4.550 0.020 . 1 . . . . A 73 GLU HA . 25611 1 943 . 1 1 73 73 GLU HB2 H 1 1.454 0.020 . 2 . . . . A 73 GLU HB2 . 25611 1 944 . 1 1 73 73 GLU HB3 H 1 1.821 0.020 . 2 . . . . A 73 GLU HB3 . 25611 1 945 . 1 1 73 73 GLU HG2 H 1 1.622 0.020 . 2 . . . . A 73 GLU HG2 . 25611 1 946 . 1 1 73 73 GLU HG3 H 1 1.728 0.020 . 2 . . . . A 73 GLU HG3 . 25611 1 947 . 1 1 73 73 GLU C C 13 176.432 0.400 . 1 . . . . A 73 GLU C . 25611 1 948 . 1 1 73 73 GLU CA C 13 55.219 0.400 . 1 . . . . A 73 GLU CA . 25611 1 949 . 1 1 73 73 GLU CB C 13 30.529 0.400 . 1 . . . . A 73 GLU CB . 25611 1 950 . 1 1 73 73 GLU CG C 13 34.924 0.400 . 1 . . . . A 73 GLU CG . 25611 1 951 . 1 1 73 73 GLU N N 15 123.883 0.400 . 1 . . . . A 73 GLU N . 25611 1 952 . 1 1 74 74 THR H H 1 8.427 0.020 . 1 . . . . A 74 THR H . 25611 1 953 . 1 1 74 74 THR HA H 1 4.309 0.020 . 1 . . . . A 74 THR HA . 25611 1 954 . 1 1 74 74 THR HB H 1 4.148 0.020 . 1 . . . . A 74 THR HB . 25611 1 955 . 1 1 74 74 THR HG21 H 1 1.066 0.020 . 1 . . . . A 74 THR HG21 . 25611 1 956 . 1 1 74 74 THR HG22 H 1 1.066 0.020 . 1 . . . . A 74 THR HG22 . 25611 1 957 . 1 1 74 74 THR HG23 H 1 1.066 0.020 . 1 . . . . A 74 THR HG23 . 25611 1 958 . 1 1 74 74 THR C C 13 174.911 0.400 . 1 . . . . A 74 THR C . 25611 1 959 . 1 1 74 74 THR CA C 13 61.789 0.400 . 1 . . . . A 74 THR CA . 25611 1 960 . 1 1 74 74 THR CB C 13 69.590 0.400 . 1 . . . . A 74 THR CB . 25611 1 961 . 1 1 74 74 THR CG2 C 13 21.440 0.400 . 1 . . . . A 74 THR CG2 . 25611 1 962 . 1 1 74 74 THR N N 15 117.513 0.400 . 1 . . . . A 74 THR N . 25611 1 963 . 1 1 75 75 GLY H H 1 8.400 0.020 . 1 . . . . A 75 GLY H . 25611 1 964 . 1 1 75 75 GLY HA2 H 1 3.930 0.020 . 2 . . . . A 75 GLY HA2 . 25611 1 965 . 1 1 75 75 GLY HA3 H 1 3.933 0.020 . 2 . . . . A 75 GLY HA3 . 25611 1 966 . 1 1 75 75 GLY C C 13 174.270 0.400 . 1 . . . . A 75 GLY C . 25611 1 967 . 1 1 75 75 GLY CA C 13 45.142 0.400 . 1 . . . . A 75 GLY CA . 25611 1 968 . 1 1 75 75 GLY N N 15 111.048 0.400 . 1 . . . . A 75 GLY N . 25611 1 969 . 1 1 76 76 SER H H 1 8.249 0.020 . 1 . . . . A 76 SER H . 25611 1 970 . 1 1 76 76 SER HA H 1 4.369 0.020 . 1 . . . . A 76 SER HA . 25611 1 971 . 1 1 76 76 SER HB2 H 1 3.837 0.020 . 2 . . . . A 76 SER HB2 . 25611 1 972 . 1 1 76 76 SER HB3 H 1 3.801 0.020 . 2 . . . . A 76 SER HB3 . 25611 1 973 . 1 1 76 76 SER C C 13 174.831 0.400 . 1 . . . . A 76 SER C . 25611 1 974 . 1 1 76 76 SER CA C 13 58.402 0.400 . 1 . . . . A 76 SER CA . 25611 1 975 . 1 1 76 76 SER CB C 13 63.701 0.400 . 1 . . . . A 76 SER CB . 25611 1 976 . 1 1 76 76 SER N N 15 115.611 0.400 . 1 . . . . A 76 SER N . 25611 1 977 . 1 1 77 77 LEU H H 1 8.310 0.020 . 1 . . . . A 77 LEU H . 25611 1 978 . 1 1 77 77 LEU HA H 1 4.281 0.020 . 1 . . . . A 77 LEU HA . 25611 1 979 . 1 1 77 77 LEU HB2 H 1 1.518 0.020 . 2 . . . . A 77 LEU HB2 . 25611 1 980 . 1 1 77 77 LEU HB3 H 1 1.592 0.020 . 2 . . . . A 77 LEU HB3 . 25611 1 981 . 1 1 77 77 LEU HG H 1 1.567 0.020 . 1 . . . . A 77 LEU HG . 25611 1 982 . 1 1 77 77 LEU HD11 H 1 0.814 0.020 . 2 . . . . A 77 LEU HD11 . 25611 1 983 . 1 1 77 77 LEU HD12 H 1 0.814 0.020 . 2 . . . . A 77 LEU HD12 . 25611 1 984 . 1 1 77 77 LEU HD13 H 1 0.814 0.020 . 2 . . . . A 77 LEU HD13 . 25611 1 985 . 1 1 77 77 LEU HD21 H 1 0.874 0.020 . 2 . . . . A 77 LEU HD21 . 25611 1 986 . 1 1 77 77 LEU HD22 H 1 0.874 0.020 . 2 . . . . A 77 LEU HD22 . 25611 1 987 . 1 1 77 77 LEU HD23 H 1 0.874 0.020 . 2 . . . . A 77 LEU HD23 . 25611 1 988 . 1 1 77 77 LEU C C 13 177.314 0.400 . 1 . . . . A 77 LEU C . 25611 1 989 . 1 1 77 77 LEU CA C 13 55.022 0.400 . 1 . . . . A 77 LEU CA . 25611 1 990 . 1 1 77 77 LEU CB C 13 41.943 0.400 . 1 . . . . A 77 LEU CB . 25611 1 991 . 1 1 77 77 LEU CG C 13 26.770 0.400 . 1 . . . . A 77 LEU CG . 25611 1 992 . 1 1 77 77 LEU CD1 C 13 23.001 0.400 . 1 . . . . A 77 LEU CD1 . 25611 1 993 . 1 1 77 77 LEU CD2 C 13 24.564 0.400 . 1 . . . . A 77 LEU CD2 . 25611 1 994 . 1 1 77 77 LEU N N 15 123.994 0.400 . 1 . . . . A 77 LEU N . 25611 1 995 . 1 1 78 78 GLU H H 1 8.202 0.020 . 1 . . . . A 78 GLU H . 25611 1 996 . 1 1 78 78 GLU HA H 1 4.150 0.020 . 1 . . . . A 78 GLU HA . 25611 1 997 . 1 1 78 78 GLU HB2 H 1 1.865 0.020 . 2 . . . . A 78 GLU HB2 . 25611 1 998 . 1 1 78 78 GLU HB3 H 1 1.858 0.020 . 2 . . . . A 78 GLU HB3 . 25611 1 999 . 1 1 78 78 GLU HG2 H 1 2.171 0.020 . 2 . . . . A 78 GLU HG2 . 25611 1 1000 . 1 1 78 78 GLU HG3 H 1 2.209 0.020 . 2 . . . . A 78 GLU HG3 . 25611 1 1001 . 1 1 78 78 GLU C C 13 176.192 0.400 . 1 . . . . A 78 GLU C . 25611 1 1002 . 1 1 78 78 GLU CA C 13 56.511 0.400 . 1 . . . . A 78 GLU CA . 25611 1 1003 . 1 1 78 78 GLU CB C 13 29.801 0.400 . 1 . . . . A 78 GLU CB . 25611 1 1004 . 1 1 78 78 GLU CG C 13 35.431 0.400 . 1 . . . . A 78 GLU CG . 25611 1 1005 . 1 1 78 78 GLU N N 15 120.798 0.400 . 1 . . . . A 78 GLU N . 25611 1 1006 . 1 1 79 79 HIS H H 1 8.492 0.020 . 1 . . . . A 79 HIS H . 25611 1 1007 . 1 1 79 79 HIS HA H 1 4.650 0.020 . 1 . . . . A 79 HIS HA . 25611 1 1008 . 1 1 79 79 HIS HB2 H 1 3.212 0.020 . 2 . . . . A 79 HIS HB2 . 25611 1 1009 . 1 1 79 79 HIS HB3 H 1 3.067 0.020 . 2 . . . . A 79 HIS HB3 . 25611 1 1010 . 1 1 79 79 HIS HD2 H 1 7.230 0.020 . 1 . . . . A 79 HIS HD2 . 25611 1 1011 . 1 1 79 79 HIS C C 13 174.163 0.400 . 1 . . . . A 79 HIS C . 25611 1 1012 . 1 1 79 79 HIS CA C 13 55.352 0.400 . 1 . . . . A 79 HIS CA . 25611 1 1013 . 1 1 79 79 HIS CB C 13 28.694 0.400 . 1 . . . . A 79 HIS CB . 25611 1 1014 . 1 1 79 79 HIS CD2 C 13 119.840 0.400 . 1 . . . . A 79 HIS CD2 . 25611 1 1015 . 1 1 79 79 HIS N N 15 118.993 0.400 . 1 . . . . A 79 HIS N . 25611 1 1016 . 1 1 80 80 HIS H H 1 8.545 0.020 . 1 . . . . A 80 HIS H . 25611 1 1017 . 1 1 80 80 HIS HA H 1 4.652 0.020 . 1 . . . . A 80 HIS HA . 25611 1 1018 . 1 1 80 80 HIS HB2 H 1 3.212 0.020 . 2 . . . . A 80 HIS HB2 . 25611 1 1019 . 1 1 80 80 HIS HB3 H 1 3.119 0.020 . 2 . . . . A 80 HIS HB3 . 25611 1 1020 . 1 1 80 80 HIS HD2 H 1 7.250 0.020 . 1 . . . . A 80 HIS HD2 . 25611 1 1021 . 1 1 80 80 HIS C C 13 174.136 0.400 . 1 . . . . A 80 HIS C . 25611 1 1022 . 1 1 80 80 HIS CA C 13 55.057 0.400 . 1 . . . . A 80 HIS CA . 25611 1 1023 . 1 1 80 80 HIS CB C 13 28.548 0.400 . 1 . . . . A 80 HIS CB . 25611 1 1024 . 1 1 80 80 HIS CD2 C 13 119.840 0.400 . 1 . . . . A 80 HIS CD2 . 25611 1 1025 . 1 1 80 80 HIS N N 15 119.027 0.400 . 1 . . . . A 80 HIS N . 25611 1 1026 . 1 1 81 81 HIS H H 1 8.665 0.020 . 1 . . . . A 81 HIS H . 25611 1 1027 . 1 1 81 81 HIS HA H 1 4.671 0.020 . 1 . . . . A 81 HIS HA . 25611 1 1028 . 1 1 81 81 HIS HB2 H 1 3.216 0.020 . 2 . . . . A 81 HIS HB2 . 25611 1 1029 . 1 1 81 81 HIS HB3 H 1 3.134 0.020 . 2 . . . . A 81 HIS HB3 . 25611 1 1030 . 1 1 81 81 HIS HD2 H 1 7.255 0.020 . 1 . . . . A 81 HIS HD2 . 25611 1 1031 . 1 1 81 81 HIS C C 13 174.163 0.400 . 1 . . . . A 81 HIS C . 25611 1 1032 . 1 1 81 81 HIS CA C 13 55.163 0.400 . 1 . . . . A 81 HIS CA . 25611 1 1033 . 1 1 81 81 HIS CB C 13 28.669 0.400 . 1 . . . . A 81 HIS CB . 25611 1 1034 . 1 1 81 81 HIS CD2 C 13 119.840 0.400 . 1 . . . . A 81 HIS CD2 . 25611 1 1035 . 1 1 81 81 HIS N N 15 119.621 0.400 . 1 . . . . A 81 HIS N . 25611 1 1036 . 1 1 82 82 HIS H H 1 8.703 0.020 . 1 . . . . A 82 HIS H . 25611 1 1037 . 1 1 82 82 HIS HA H 1 4.687 0.020 . 1 . . . . A 82 HIS HA . 25611 1 1038 . 1 1 82 82 HIS HB2 H 1 3.214 0.020 . 2 . . . . A 82 HIS HB2 . 25611 1 1039 . 1 1 82 82 HIS HB3 H 1 3.163 0.020 . 2 . . . . A 82 HIS HB3 . 25611 1 1040 . 1 1 82 82 HIS HD2 H 1 7.250 0.020 . 1 . . . . A 82 HIS HD2 . 25611 1 1041 . 1 1 82 82 HIS C C 13 173.896 0.400 . 1 . . . . A 82 HIS C . 25611 1 1042 . 1 1 82 82 HIS CA C 13 55.182 0.400 . 1 . . . . A 82 HIS CA . 25611 1 1043 . 1 1 82 82 HIS CB C 13 28.792 0.400 . 1 . . . . A 82 HIS CB . 25611 1 1044 . 1 1 82 82 HIS CD2 C 13 119.840 0.400 . 1 . . . . A 82 HIS CD2 . 25611 1 1045 . 1 1 82 82 HIS N N 15 120.375 0.400 . 1 . . . . A 82 HIS N . 25611 1 1046 . 1 1 83 83 HIS H H 1 8.597 0.020 . 1 . . . . A 83 HIS H . 25611 1 1047 . 1 1 83 83 HIS HA H 1 4.680 0.020 . 1 . . . . A 83 HIS HA . 25611 1 1048 . 1 1 83 83 HIS HB2 H 1 3.250 0.020 . 2 . . . . A 83 HIS HB2 . 25611 1 1049 . 1 1 83 83 HIS HB3 H 1 3.241 0.020 . 2 . . . . A 83 HIS HB3 . 25611 1 1050 . 1 1 83 83 HIS C C 13 173.442 0.400 . 1 . . . . A 83 HIS C . 25611 1 1051 . 1 1 83 83 HIS CA C 13 55.314 0.400 . 1 . . . . A 83 HIS CA . 25611 1 1052 . 1 1 83 83 HIS CB C 13 28.703 0.400 . 1 . . . . A 83 HIS CB . 25611 1 1053 . 1 1 83 83 HIS N N 15 120.673 0.400 . 1 . . . . A 83 HIS N . 25611 1 1054 . 1 1 84 84 HIS H H 1 8.424 0.020 . 1 . . . . A 84 HIS H . 25611 1 1055 . 1 1 84 84 HIS HA H 1 4.669 0.020 . 1 . . . . A 84 HIS HA . 25611 1 1056 . 1 1 84 84 HIS HB2 H 1 3.154 0.020 . 2 . . . . A 84 HIS HB2 . 25611 1 1057 . 1 1 84 84 HIS HB3 H 1 3.243 0.020 . 2 . . . . A 84 HIS HB3 . 25611 1 1058 . 1 1 84 84 HIS HD2 H 1 7.279 0.020 . 1 . . . . A 84 HIS HD2 . 25611 1 1059 . 1 1 84 84 HIS CA C 13 57.212 0.400 . 1 . . . . A 84 HIS CA . 25611 1 1060 . 1 1 84 84 HIS CB C 13 29.209 0.400 . 1 . . . . A 84 HIS CB . 25611 1 1061 . 1 1 84 84 HIS N N 15 125.673 0.400 . 1 . . . . A 84 HIS N . 25611 1 stop_ save_