################################### # 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11340 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11340 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11340 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 1 $XWINNMR . . 11340 1 2 $NMRPipe . . 11340 1 3 $NMRView . . 11340 1 4 $Kujira . . 11340 1 5 $CYANA . . 11340 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 5 5 SER HA H 1 4.526 0.030 . 1 . . . . 5 SER HA . 11340 1 2 . 1 1 5 5 SER HB2 H 1 3.883 0.030 . 1 . . . . 5 SER HB2 . 11340 1 3 . 1 1 5 5 SER HB3 H 1 3.883 0.030 . 1 . . . . 5 SER HB3 . 11340 1 4 . 1 1 5 5 SER C C 13 174.878 0.300 . 1 . . . . 5 SER C . 11340 1 5 . 1 1 5 5 SER CA C 13 58.323 0.300 . 1 . . . . 5 SER CA . 11340 1 6 . 1 1 5 5 SER CB C 13 63.735 0.300 . 1 . . . . 5 SER CB . 11340 1 7 . 1 1 6 6 SER H H 1 8.525 0.030 . 1 . . . . 6 SER H . 11340 1 8 . 1 1 6 6 SER HA H 1 4.480 0.030 . 1 . . . . 6 SER HA . 11340 1 9 . 1 1 6 6 SER HB2 H 1 3.906 0.030 . 1 . . . . 6 SER HB2 . 11340 1 10 . 1 1 6 6 SER HB3 H 1 3.906 0.030 . 1 . . . . 6 SER HB3 . 11340 1 11 . 1 1 6 6 SER C C 13 175.129 0.300 . 1 . . . . 6 SER C . 11340 1 12 . 1 1 6 6 SER CA C 13 58.735 0.300 . 1 . . . . 6 SER CA . 11340 1 13 . 1 1 6 6 SER CB C 13 63.686 0.300 . 1 . . . . 6 SER CB . 11340 1 14 . 1 1 6 6 SER N N 15 118.018 0.300 . 1 . . . . 6 SER N . 11340 1 15 . 1 1 7 7 GLY H H 1 8.500 0.030 . 1 . . . . 7 GLY H . 11340 1 16 . 1 1 7 7 GLY HA2 H 1 3.984 0.030 . 1 . . . . 7 GLY HA2 . 11340 1 17 . 1 1 7 7 GLY HA3 H 1 3.984 0.030 . 1 . . . . 7 GLY HA3 . 11340 1 18 . 1 1 7 7 GLY C C 13 174.313 0.300 . 1 . . . . 7 GLY C . 11340 1 19 . 1 1 7 7 GLY CA C 13 45.510 0.300 . 1 . . . . 7 GLY CA . 11340 1 20 . 1 1 7 7 GLY N N 15 110.994 0.300 . 1 . . . . 7 GLY N . 11340 1 21 . 1 1 8 8 MET H H 1 8.193 0.030 . 1 . . . . 8 MET H . 11340 1 22 . 1 1 8 8 MET HA H 1 4.483 0.030 . 1 . . . . 8 MET HA . 11340 1 23 . 1 1 8 8 MET HB2 H 1 2.098 0.030 . 2 . . . . 8 MET HB2 . 11340 1 24 . 1 1 8 8 MET HB3 H 1 1.963 0.030 . 2 . . . . 8 MET HB3 . 11340 1 25 . 1 1 8 8 MET HE1 H 1 2.080 0.030 . 1 . . . . 8 MET HE . 11340 1 26 . 1 1 8 8 MET HE2 H 1 2.080 0.030 . 1 . . . . 8 MET HE . 11340 1 27 . 1 1 8 8 MET HE3 H 1 2.080 0.030 . 1 . . . . 8 MET HE . 11340 1 28 . 1 1 8 8 MET HG2 H 1 2.081 0.030 . 1 . . . . 8 MET HG2 . 11340 1 29 . 1 1 8 8 MET HG3 H 1 2.081 0.030 . 1 . . . . 8 MET HG3 . 11340 1 30 . 1 1 8 8 MET C C 13 176.318 0.300 . 1 . . . . 8 MET C . 11340 1 31 . 1 1 8 8 MET CA C 13 55.472 0.300 . 1 . . . . 8 MET CA . 11340 1 32 . 1 1 8 8 MET CB C 13 32.888 0.300 . 1 . . . . 8 MET CB . 11340 1 33 . 1 1 8 8 MET CE C 13 16.980 0.300 . 1 . . . . 8 MET CE . 11340 1 34 . 1 1 8 8 MET CG C 13 31.890 0.300 . 1 . . . . 8 MET CG . 11340 1 35 . 1 1 8 8 MET N N 15 119.618 0.300 . 1 . . . . 8 MET N . 11340 1 36 . 1 1 9 9 GLU H H 1 8.550 0.030 . 1 . . . . 9 GLU H . 11340 1 37 . 1 1 9 9 GLU HA H 1 4.220 0.030 . 1 . . . . 9 GLU HA . 11340 1 38 . 1 1 9 9 GLU HB2 H 1 1.932 0.030 . 2 . . . . 9 GLU HB2 . 11340 1 39 . 1 1 9 9 GLU HB3 H 1 2.023 0.030 . 2 . . . . 9 GLU HB3 . 11340 1 40 . 1 1 9 9 GLU HG2 H 1 2.206 0.030 . 1 . . . . 9 GLU HG2 . 11340 1 41 . 1 1 9 9 GLU HG3 H 1 2.206 0.030 . 1 . . . . 9 GLU HG3 . 11340 1 42 . 1 1 9 9 GLU C C 13 176.497 0.300 . 1 . . . . 9 GLU C . 11340 1 43 . 1 1 9 9 GLU CA C 13 57.030 0.300 . 1 . . . . 9 GLU CA . 11340 1 44 . 1 1 9 9 GLU CB C 13 30.100 0.300 . 1 . . . . 9 GLU CB . 11340 1 45 . 1 1 9 9 GLU CG C 13 36.295 0.300 . 1 . . . . 9 GLU CG . 11340 1 46 . 1 1 9 9 GLU N N 15 121.691 0.300 . 1 . . . . 9 GLU N . 11340 1 47 . 1 1 10 10 GLU H H 1 8.400 0.030 . 1 . . . . 10 GLU H . 11340 1 48 . 1 1 10 10 GLU HA H 1 4.272 0.030 . 1 . . . . 10 GLU HA . 11340 1 49 . 1 1 10 10 GLU HB2 H 1 1.904 0.030 . 1 . . . . 10 GLU HB2 . 11340 1 50 . 1 1 10 10 GLU HB3 H 1 1.904 0.030 . 1 . . . . 10 GLU HB3 . 11340 1 51 . 1 1 10 10 GLU HG2 H 1 2.181 0.030 . 2 . . . . 10 GLU HG2 . 11340 1 52 . 1 1 10 10 GLU HG3 H 1 2.259 0.030 . 2 . . . . 10 GLU HG3 . 11340 1 53 . 1 1 10 10 GLU C C 13 176.375 0.300 . 1 . . . . 10 GLU C . 11340 1 54 . 1 1 10 10 GLU CA C 13 56.536 0.300 . 1 . . . . 10 GLU CA . 11340 1 55 . 1 1 10 10 GLU CB C 13 30.301 0.300 . 1 . . . . 10 GLU CB . 11340 1 56 . 1 1 10 10 GLU CG C 13 36.293 0.300 . 1 . . . . 10 GLU CG . 11340 1 57 . 1 1 10 10 GLU N N 15 121.831 0.300 . 1 . . . . 10 GLU N . 11340 1 58 . 1 1 11 11 ILE H H 1 8.174 0.030 . 1 . . . . 11 ILE H . 11340 1 59 . 1 1 11 11 ILE HA H 1 4.139 0.030 . 1 . . . . 11 ILE HA . 11340 1 60 . 1 1 11 11 ILE HB H 1 1.847 0.030 . 1 . . . . 11 ILE HB . 11340 1 61 . 1 1 11 11 ILE HD11 H 1 0.838 0.030 . 1 . . . . 11 ILE HD1 . 11340 1 62 . 1 1 11 11 ILE HD12 H 1 0.838 0.030 . 1 . . . . 11 ILE HD1 . 11340 1 63 . 1 1 11 11 ILE HD13 H 1 0.838 0.030 . 1 . . . . 11 ILE HD1 . 11340 1 64 . 1 1 11 11 ILE HG12 H 1 1.158 0.030 . 2 . . . . 11 ILE HG12 . 11340 1 65 . 1 1 11 11 ILE HG13 H 1 1.466 0.030 . 2 . . . . 11 ILE HG13 . 11340 1 66 . 1 1 11 11 ILE HG21 H 1 0.872 0.030 . 1 . . . . 11 ILE HG2 . 11340 1 67 . 1 1 11 11 ILE HG22 H 1 0.872 0.030 . 1 . . . . 11 ILE HG2 . 11340 1 68 . 1 1 11 11 ILE HG23 H 1 0.872 0.030 . 1 . . . . 11 ILE HG2 . 11340 1 69 . 1 1 11 11 ILE C C 13 176.235 0.300 . 1 . . . . 11 ILE C . 11340 1 70 . 1 1 11 11 ILE CA C 13 61.054 0.300 . 1 . . . . 11 ILE CA . 11340 1 71 . 1 1 11 11 ILE CB C 13 38.626 0.300 . 1 . . . . 11 ILE CB . 11340 1 72 . 1 1 11 11 ILE CD1 C 13 12.794 0.300 . 1 . . . . 11 ILE CD1 . 11340 1 73 . 1 1 11 11 ILE CG1 C 13 27.079 0.300 . 1 . . . . 11 ILE CG1 . 11340 1 74 . 1 1 11 11 ILE CG2 C 13 17.527 0.300 . 1 . . . . 11 ILE CG2 . 11340 1 75 . 1 1 11 11 ILE N N 15 122.293 0.300 . 1 . . . . 11 ILE N . 11340 1 76 . 1 1 12 12 GLN H H 1 8.476 0.030 . 1 . . . . 12 GLN H . 11340 1 77 . 1 1 12 12 GLN HA H 1 4.305 0.030 . 1 . . . . 12 GLN HA . 11340 1 78 . 1 1 12 12 GLN HB2 H 1 1.946 0.030 . 2 . . . . 12 GLN HB2 . 11340 1 79 . 1 1 12 12 GLN HB3 H 1 2.035 0.030 . 2 . . . . 12 GLN HB3 . 11340 1 80 . 1 1 12 12 GLN HE21 H 1 7.516 0.030 . 2 . . . . 12 GLN HE21 . 11340 1 81 . 1 1 12 12 GLN HE22 H 1 6.837 0.030 . 2 . . . . 12 GLN HE22 . 11340 1 82 . 1 1 12 12 GLN HG2 H 1 2.332 0.030 . 1 . . . . 12 GLN HG2 . 11340 1 83 . 1 1 12 12 GLN HG3 H 1 2.332 0.030 . 1 . . . . 12 GLN HG3 . 11340 1 84 . 1 1 12 12 GLN C C 13 176.208 0.300 . 1 . . . . 12 GLN C . 11340 1 85 . 1 1 12 12 GLN CA C 13 55.942 0.300 . 1 . . . . 12 GLN CA . 11340 1 86 . 1 1 12 12 GLN CB C 13 29.432 0.300 . 1 . . . . 12 GLN CB . 11340 1 87 . 1 1 12 12 GLN CG C 13 33.740 0.300 . 1 . . . . 12 GLN CG . 11340 1 88 . 1 1 12 12 GLN N N 15 124.848 0.300 . 1 . . . . 12 GLN N . 11340 1 89 . 1 1 12 12 GLN NE2 N 15 112.619 0.300 . 1 . . . . 12 GLN NE2 . 11340 1 90 . 1 1 13 13 GLY H H 1 8.385 0.030 . 1 . . . . 13 GLY H . 11340 1 91 . 1 1 13 13 GLY HA2 H 1 3.877 0.030 . 1 . . . . 13 GLY HA2 . 11340 1 92 . 1 1 13 13 GLY HA3 H 1 3.877 0.030 . 1 . . . . 13 GLY HA3 . 11340 1 93 . 1 1 13 13 GLY C C 13 173.601 0.300 . 1 . . . . 13 GLY C . 11340 1 94 . 1 1 13 13 GLY CA C 13 45.180 0.300 . 1 . . . . 13 GLY CA . 11340 1 95 . 1 1 13 13 GLY N N 15 110.319 0.300 . 1 . . . . 13 GLY N . 11340 1 96 . 1 1 14 14 TYR H H 1 7.994 0.030 . 1 . . . . 14 TYR H . 11340 1 97 . 1 1 14 14 TYR HA H 1 4.577 0.030 . 1 . . . . 14 TYR HA . 11340 1 98 . 1 1 14 14 TYR HB2 H 1 2.906 0.030 . 2 . . . . 14 TYR HB2 . 11340 1 99 . 1 1 14 14 TYR HB3 H 1 3.059 0.030 . 2 . . . . 14 TYR HB3 . 11340 1 100 . 1 1 14 14 TYR HD1 H 1 7.087 0.030 . 1 . . . . 14 TYR HD1 . 11340 1 101 . 1 1 14 14 TYR HD2 H 1 7.087 0.030 . 1 . . . . 14 TYR HD2 . 11340 1 102 . 1 1 14 14 TYR HE1 H 1 6.802 0.030 . 1 . . . . 14 TYR HE1 . 11340 1 103 . 1 1 14 14 TYR HE2 H 1 6.802 0.030 . 1 . . . . 14 TYR HE2 . 11340 1 104 . 1 1 14 14 TYR C C 13 175.300 0.300 . 1 . . . . 14 TYR C . 11340 1 105 . 1 1 14 14 TYR CA C 13 57.661 0.300 . 1 . . . . 14 TYR CA . 11340 1 106 . 1 1 14 14 TYR CB C 13 39.024 0.300 . 1 . . . . 14 TYR CB . 11340 1 107 . 1 1 14 14 TYR CD1 C 13 133.270 0.300 . 1 . . . . 14 TYR CD1 . 11340 1 108 . 1 1 14 14 TYR CD2 C 13 133.270 0.300 . 1 . . . . 14 TYR CD2 . 11340 1 109 . 1 1 14 14 TYR CE1 C 13 118.225 0.300 . 1 . . . . 14 TYR CE1 . 11340 1 110 . 1 1 14 14 TYR CE2 C 13 118.225 0.300 . 1 . . . . 14 TYR CE2 . 11340 1 111 . 1 1 14 14 TYR N N 15 119.632 0.300 . 1 . . . . 14 TYR N . 11340 1 112 . 1 1 15 15 ASP H H 1 8.392 0.030 . 1 . . . . 15 ASP H . 11340 1 113 . 1 1 15 15 ASP HA H 1 4.590 0.030 . 1 . . . . 15 ASP HA . 11340 1 114 . 1 1 15 15 ASP HB2 H 1 2.536 0.030 . 2 . . . . 15 ASP HB2 . 11340 1 115 . 1 1 15 15 ASP HB3 H 1 2.664 0.030 . 2 . . . . 15 ASP HB3 . 11340 1 116 . 1 1 15 15 ASP C C 13 175.893 0.300 . 1 . . . . 15 ASP C . 11340 1 117 . 1 1 15 15 ASP CA C 13 54.136 0.300 . 1 . . . . 15 ASP CA . 11340 1 118 . 1 1 15 15 ASP CB C 13 41.365 0.300 . 1 . . . . 15 ASP CB . 11340 1 119 . 1 1 15 15 ASP N N 15 122.397 0.300 . 1 . . . . 15 ASP N . 11340 1 120 . 1 1 16 16 VAL H H 1 7.945 0.030 . 1 . . . . 16 VAL H . 11340 1 121 . 1 1 16 16 VAL HA H 1 4.054 0.030 . 1 . . . . 16 VAL HA . 11340 1 122 . 1 1 16 16 VAL HB H 1 2.033 0.030 . 1 . . . . 16 VAL HB . 11340 1 123 . 1 1 16 16 VAL HG11 H 1 0.861 0.030 . 1 . . . . 16 VAL HG1 . 11340 1 124 . 1 1 16 16 VAL HG12 H 1 0.861 0.030 . 1 . . . . 16 VAL HG1 . 11340 1 125 . 1 1 16 16 VAL HG13 H 1 0.861 0.030 . 1 . . . . 16 VAL HG1 . 11340 1 126 . 1 1 16 16 VAL HG21 H 1 0.883 0.030 . 1 . . . . 16 VAL HG2 . 11340 1 127 . 1 1 16 16 VAL HG22 H 1 0.883 0.030 . 1 . . . . 16 VAL HG2 . 11340 1 128 . 1 1 16 16 VAL HG23 H 1 0.883 0.030 . 1 . . . . 16 VAL HG2 . 11340 1 129 . 1 1 16 16 VAL C C 13 175.964 0.300 . 1 . . . . 16 VAL C . 11340 1 130 . 1 1 16 16 VAL CA C 13 62.248 0.300 . 1 . . . . 16 VAL CA . 11340 1 131 . 1 1 16 16 VAL CB C 13 32.867 0.300 . 1 . . . . 16 VAL CB . 11340 1 132 . 1 1 16 16 VAL CG1 C 13 21.314 0.300 . 2 . . . . 16 VAL CG1 . 11340 1 133 . 1 1 16 16 VAL CG2 C 13 20.387 0.300 . 2 . . . . 16 VAL CG2 . 11340 1 134 . 1 1 16 16 VAL N N 15 119.810 0.300 . 1 . . . . 16 VAL N . 11340 1 135 . 1 1 17 17 GLU H H 1 8.369 0.030 . 1 . . . . 17 GLU H . 11340 1 136 . 1 1 17 17 GLU HA H 1 4.202 0.030 . 1 . . . . 17 GLU HA . 11340 1 137 . 1 1 17 17 GLU HB2 H 1 1.843 0.030 . 2 . . . . 17 GLU HB2 . 11340 1 138 . 1 1 17 17 GLU HB3 H 1 1.904 0.030 . 2 . . . . 17 GLU HB3 . 11340 1 139 . 1 1 17 17 GLU HG2 H 1 2.185 0.030 . 2 . . . . 17 GLU HG2 . 11340 1 140 . 1 1 17 17 GLU HG3 H 1 2.068 0.030 . 2 . . . . 17 GLU HG3 . 11340 1 141 . 1 1 17 17 GLU C C 13 175.929 0.300 . 1 . . . . 17 GLU C . 11340 1 142 . 1 1 17 17 GLU CA C 13 56.543 0.300 . 1 . . . . 17 GLU CA . 11340 1 143 . 1 1 17 17 GLU CB C 13 30.323 0.300 . 1 . . . . 17 GLU CB . 11340 1 144 . 1 1 17 17 GLU CG C 13 36.210 0.300 . 1 . . . . 17 GLU CG . 11340 1 145 . 1 1 17 17 GLU N N 15 123.714 0.300 . 1 . . . . 17 GLU N . 11340 1 146 . 1 1 18 18 PHE H H 1 8.099 0.030 . 1 . . . . 18 PHE H . 11340 1 147 . 1 1 18 18 PHE HA H 1 4.608 0.030 . 1 . . . . 18 PHE HA . 11340 1 148 . 1 1 18 18 PHE HB2 H 1 2.967 0.030 . 2 . . . . 18 PHE HB2 . 11340 1 149 . 1 1 18 18 PHE HB3 H 1 3.109 0.030 . 2 . . . . 18 PHE HB3 . 11340 1 150 . 1 1 18 18 PHE HD1 H 1 7.228 0.030 . 1 . . . . 18 PHE HD1 . 11340 1 151 . 1 1 18 18 PHE HD2 H 1 7.228 0.030 . 1 . . . . 18 PHE HD2 . 11340 1 152 . 1 1 18 18 PHE HE1 H 1 7.312 0.030 . 1 . . . . 18 PHE HE1 . 11340 1 153 . 1 1 18 18 PHE HE2 H 1 7.312 0.030 . 1 . . . . 18 PHE HE2 . 11340 1 154 . 1 1 18 18 PHE HZ H 1 7.250 0.030 . 1 . . . . 18 PHE HZ . 11340 1 155 . 1 1 18 18 PHE C C 13 174.835 0.300 . 1 . . . . 18 PHE C . 11340 1 156 . 1 1 18 18 PHE CA C 13 57.391 0.300 . 1 . . . . 18 PHE CA . 11340 1 157 . 1 1 18 18 PHE CB C 13 40.064 0.300 . 1 . . . . 18 PHE CB . 11340 1 158 . 1 1 18 18 PHE CD1 C 13 131.924 0.300 . 1 . . . . 18 PHE CD1 . 11340 1 159 . 1 1 18 18 PHE CD2 C 13 131.924 0.300 . 1 . . . . 18 PHE CD2 . 11340 1 160 . 1 1 18 18 PHE CE1 C 13 131.630 0.300 . 1 . . . . 18 PHE CE1 . 11340 1 161 . 1 1 18 18 PHE CE2 C 13 131.630 0.300 . 1 . . . . 18 PHE CE2 . 11340 1 162 . 1 1 18 18 PHE CZ C 13 129.735 0.300 . 1 . . . . 18 PHE CZ . 11340 1 163 . 1 1 18 18 PHE N N 15 121.046 0.300 . 1 . . . . 18 PHE N . 11340 1 164 . 1 1 19 19 ASP H H 1 8.303 0.030 . 1 . . . . 19 ASP H . 11340 1 165 . 1 1 19 19 ASP HA H 1 4.864 0.030 . 1 . . . . 19 ASP HA . 11340 1 166 . 1 1 19 19 ASP HB2 H 1 2.400 0.030 . 2 . . . . 19 ASP HB2 . 11340 1 167 . 1 1 19 19 ASP HB3 H 1 2.645 0.030 . 2 . . . . 19 ASP HB3 . 11340 1 168 . 1 1 19 19 ASP C C 13 173.114 0.300 . 1 . . . . 19 ASP C . 11340 1 169 . 1 1 19 19 ASP CA C 13 52.316 0.300 . 1 . . . . 19 ASP CA . 11340 1 170 . 1 1 19 19 ASP CB C 13 40.734 0.300 . 1 . . . . 19 ASP CB . 11340 1 171 . 1 1 19 19 ASP N N 15 123.899 0.300 . 1 . . . . 19 ASP N . 11340 1 172 . 1 1 20 20 PRO HA H 1 4.555 0.030 . 1 . . . . 20 PRO HA . 11340 1 173 . 1 1 20 20 PRO HB2 H 1 2.283 0.030 . 2 . . . . 20 PRO HB2 . 11340 1 174 . 1 1 20 20 PRO HB3 H 1 1.870 0.030 . 2 . . . . 20 PRO HB3 . 11340 1 175 . 1 1 20 20 PRO HD2 H 1 3.642 0.030 . 1 . . . . 20 PRO HD2 . 11340 1 176 . 1 1 20 20 PRO HD3 H 1 3.642 0.030 . 1 . . . . 20 PRO HD3 . 11340 1 177 . 1 1 20 20 PRO HG2 H 1 2.007 0.030 . 1 . . . . 20 PRO HG2 . 11340 1 178 . 1 1 20 20 PRO HG3 H 1 2.007 0.030 . 1 . . . . 20 PRO HG3 . 11340 1 179 . 1 1 20 20 PRO CA C 13 61.447 0.300 . 1 . . . . 20 PRO CA . 11340 1 180 . 1 1 20 20 PRO CB C 13 30.897 0.300 . 1 . . . . 20 PRO CB . 11340 1 181 . 1 1 20 20 PRO CD C 13 50.530 0.300 . 1 . . . . 20 PRO CD . 11340 1 182 . 1 1 20 20 PRO CG C 13 27.448 0.300 . 1 . . . . 20 PRO CG . 11340 1 183 . 1 1 21 21 PRO HA H 1 4.408 0.030 . 1 . . . . 21 PRO HA . 11340 1 184 . 1 1 21 21 PRO HB2 H 1 1.907 0.030 . 2 . . . . 21 PRO HB2 . 11340 1 185 . 1 1 21 21 PRO HB3 H 1 2.265 0.030 . 2 . . . . 21 PRO HB3 . 11340 1 186 . 1 1 21 21 PRO HD2 H 1 3.640 0.030 . 2 . . . . 21 PRO HD2 . 11340 1 187 . 1 1 21 21 PRO HD3 H 1 3.794 0.030 . 2 . . . . 21 PRO HD3 . 11340 1 188 . 1 1 21 21 PRO HG2 H 1 2.017 0.030 . 1 . . . . 21 PRO HG2 . 11340 1 189 . 1 1 21 21 PRO HG3 H 1 2.017 0.030 . 1 . . . . 21 PRO HG3 . 11340 1 190 . 1 1 21 21 PRO C C 13 177.044 0.300 . 1 . . . . 21 PRO C . 11340 1 191 . 1 1 21 21 PRO CA C 13 62.723 0.300 . 1 . . . . 21 PRO CA . 11340 1 192 . 1 1 21 21 PRO CB C 13 31.990 0.300 . 1 . . . . 21 PRO CB . 11340 1 193 . 1 1 21 21 PRO CD C 13 50.454 0.300 . 1 . . . . 21 PRO CD . 11340 1 194 . 1 1 21 21 PRO CG C 13 27.576 0.300 . 1 . . . . 21 PRO CG . 11340 1 195 . 1 1 22 22 LEU H H 1 8.368 0.030 . 1 . . . . 22 LEU H . 11340 1 196 . 1 1 22 22 LEU HA H 1 4.260 0.030 . 1 . . . . 22 LEU HA . 11340 1 197 . 1 1 22 22 LEU HB2 H 1 1.551 0.030 . 2 . . . . 22 LEU HB2 . 11340 1 198 . 1 1 22 22 LEU HB3 H 1 1.618 0.030 . 2 . . . . 22 LEU HB3 . 11340 1 199 . 1 1 22 22 LEU HD11 H 1 0.909 0.030 . 1 . . . . 22 LEU HD1 . 11340 1 200 . 1 1 22 22 LEU HD12 H 1 0.909 0.030 . 1 . . . . 22 LEU HD1 . 11340 1 201 . 1 1 22 22 LEU HD13 H 1 0.909 0.030 . 1 . . . . 22 LEU HD1 . 11340 1 202 . 1 1 22 22 LEU HD21 H 1 0.861 0.030 . 1 . . . . 22 LEU HD2 . 11340 1 203 . 1 1 22 22 LEU HD22 H 1 0.861 0.030 . 1 . . . . 22 LEU HD2 . 11340 1 204 . 1 1 22 22 LEU HD23 H 1 0.861 0.030 . 1 . . . . 22 LEU HD2 . 11340 1 205 . 1 1 22 22 LEU HG H 1 1.644 0.030 . 1 . . . . 22 LEU HG . 11340 1 206 . 1 1 22 22 LEU C C 13 177.689 0.300 . 1 . . . . 22 LEU C . 11340 1 207 . 1 1 22 22 LEU CA C 13 55.489 0.300 . 1 . . . . 22 LEU CA . 11340 1 208 . 1 1 22 22 LEU CB C 13 42.467 0.300 . 1 . . . . 22 LEU CB . 11340 1 209 . 1 1 22 22 LEU CD1 C 13 24.809 0.300 . 2 . . . . 22 LEU CD1 . 11340 1 210 . 1 1 22 22 LEU CD2 C 13 23.793 0.300 . 2 . . . . 22 LEU CD2 . 11340 1 211 . 1 1 22 22 LEU CG C 13 27.043 0.300 . 1 . . . . 22 LEU CG . 11340 1 212 . 1 1 22 22 LEU N N 15 123.038 0.300 . 1 . . . . 22 LEU N . 11340 1 213 . 1 1 23 23 GLU H H 1 8.484 0.030 . 1 . . . . 23 GLU H . 11340 1 214 . 1 1 23 23 GLU HA H 1 4.256 0.030 . 1 . . . . 23 GLU HA . 11340 1 215 . 1 1 23 23 GLU HB2 H 1 1.939 0.030 . 2 . . . . 23 GLU HB2 . 11340 1 216 . 1 1 23 23 GLU HB3 H 1 2.031 0.030 . 2 . . . . 23 GLU HB3 . 11340 1 217 . 1 1 23 23 GLU HG2 H 1 2.241 0.030 . 1 . . . . 23 GLU HG2 . 11340 1 218 . 1 1 23 23 GLU HG3 H 1 2.241 0.030 . 1 . . . . 23 GLU HG3 . 11340 1 219 . 1 1 23 23 GLU C C 13 176.523 0.300 . 1 . . . . 23 GLU C . 11340 1 220 . 1 1 23 23 GLU CA C 13 56.670 0.300 . 1 . . . . 23 GLU CA . 11340 1 221 . 1 1 23 23 GLU CB C 13 30.367 0.300 . 1 . . . . 23 GLU CB . 11340 1 222 . 1 1 23 23 GLU CG C 13 36.293 0.300 . 1 . . . . 23 GLU CG . 11340 1 223 . 1 1 23 23 GLU N N 15 121.485 0.300 . 1 . . . . 23 GLU N . 11340 1 224 . 1 1 24 24 SER H H 1 8.299 0.030 . 1 . . . . 24 SER H . 11340 1 225 . 1 1 24 24 SER HA H 1 4.341 0.030 . 1 . . . . 24 SER HA . 11340 1 226 . 1 1 24 24 SER HB2 H 1 3.814 0.030 . 2 . . . . 24 SER HB2 . 11340 1 227 . 1 1 24 24 SER HB3 H 1 3.774 0.030 . 2 . . . . 24 SER HB3 . 11340 1 228 . 1 1 24 24 SER C C 13 174.489 0.300 . 1 . . . . 24 SER C . 11340 1 229 . 1 1 24 24 SER CA C 13 58.643 0.300 . 1 . . . . 24 SER CA . 11340 1 230 . 1 1 24 24 SER CB C 13 63.711 0.300 . 1 . . . . 24 SER CB . 11340 1 231 . 1 1 24 24 SER N N 15 117.101 0.300 . 1 . . . . 24 SER N . 11340 1 232 . 1 1 25 25 LYS H H 1 8.168 0.030 . 1 . . . . 25 LYS H . 11340 1 233 . 1 1 25 25 LYS HA H 1 4.248 0.030 . 1 . . . . 25 LYS HA . 11340 1 234 . 1 1 25 25 LYS HB2 H 1 1.639 0.030 . 2 . . . . 25 LYS HB2 . 11340 1 235 . 1 1 25 25 LYS HB3 H 1 1.605 0.030 . 2 . . . . 25 LYS HB3 . 11340 1 236 . 1 1 25 25 LYS HD2 H 1 1.569 0.030 . 1 . . . . 25 LYS HD2 . 11340 1 237 . 1 1 25 25 LYS HD3 H 1 1.569 0.030 . 1 . . . . 25 LYS HD3 . 11340 1 238 . 1 1 25 25 LYS HE2 H 1 2.877 0.030 . 1 . . . . 25 LYS HE2 . 11340 1 239 . 1 1 25 25 LYS HE3 H 1 2.877 0.030 . 1 . . . . 25 LYS HE3 . 11340 1 240 . 1 1 25 25 LYS HG2 H 1 1.194 0.030 . 1 . . . . 25 LYS HG2 . 11340 1 241 . 1 1 25 25 LYS HG3 H 1 1.194 0.030 . 1 . . . . 25 LYS HG3 . 11340 1 242 . 1 1 25 25 LYS C C 13 175.942 0.300 . 1 . . . . 25 LYS C . 11340 1 243 . 1 1 25 25 LYS CA C 13 56.289 0.300 . 1 . . . . 25 LYS CA . 11340 1 244 . 1 1 25 25 LYS CB C 13 32.683 0.300 . 1 . . . . 25 LYS CB . 11340 1 245 . 1 1 25 25 LYS CD C 13 28.932 0.300 . 1 . . . . 25 LYS CD . 11340 1 246 . 1 1 25 25 LYS CE C 13 42.089 0.300 . 1 . . . . 25 LYS CE . 11340 1 247 . 1 1 25 25 LYS CG C 13 24.619 0.300 . 1 . . . . 25 LYS CG . 11340 1 248 . 1 1 25 25 LYS N N 15 122.447 0.300 . 1 . . . . 25 LYS N . 11340 1 249 . 1 1 26 26 TYR H H 1 8.160 0.030 . 1 . . . . 26 TYR H . 11340 1 250 . 1 1 26 26 TYR HA H 1 4.560 0.030 . 1 . . . . 26 TYR HA . 11340 1 251 . 1 1 26 26 TYR HB2 H 1 2.769 0.030 . 2 . . . . 26 TYR HB2 . 11340 1 252 . 1 1 26 26 TYR HB3 H 1 3.131 0.030 . 2 . . . . 26 TYR HB3 . 11340 1 253 . 1 1 26 26 TYR HD1 H 1 7.067 0.030 . 1 . . . . 26 TYR HD1 . 11340 1 254 . 1 1 26 26 TYR HD2 H 1 7.067 0.030 . 1 . . . . 26 TYR HD2 . 11340 1 255 . 1 1 26 26 TYR HE1 H 1 6.767 0.030 . 1 . . . . 26 TYR HE1 . 11340 1 256 . 1 1 26 26 TYR HE2 H 1 6.767 0.030 . 1 . . . . 26 TYR HE2 . 11340 1 257 . 1 1 26 26 TYR C C 13 174.675 0.300 . 1 . . . . 26 TYR C . 11340 1 258 . 1 1 26 26 TYR CA C 13 57.486 0.300 . 1 . . . . 26 TYR CA . 11340 1 259 . 1 1 26 26 TYR CB C 13 38.941 0.300 . 1 . . . . 26 TYR CB . 11340 1 260 . 1 1 26 26 TYR CD1 C 13 133.247 0.300 . 1 . . . . 26 TYR CD1 . 11340 1 261 . 1 1 26 26 TYR CD2 C 13 133.247 0.300 . 1 . . . . 26 TYR CD2 . 11340 1 262 . 1 1 26 26 TYR CE1 C 13 118.197 0.300 . 1 . . . . 26 TYR CE1 . 11340 1 263 . 1 1 26 26 TYR CE2 C 13 118.197 0.300 . 1 . . . . 26 TYR CE2 . 11340 1 264 . 1 1 26 26 TYR N N 15 121.080 0.300 . 1 . . . . 26 TYR N . 11340 1 265 . 1 1 27 27 GLU H H 1 7.898 0.030 . 1 . . . . 27 GLU H . 11340 1 266 . 1 1 27 27 GLU HA H 1 4.413 0.030 . 1 . . . . 27 GLU HA . 11340 1 267 . 1 1 27 27 GLU HB2 H 1 1.674 0.030 . 2 . . . . 27 GLU HB2 . 11340 1 268 . 1 1 27 27 GLU HB3 H 1 1.601 0.030 . 2 . . . . 27 GLU HB3 . 11340 1 269 . 1 1 27 27 GLU HG2 H 1 1.895 0.030 . 1 . . . . 27 GLU HG2 . 11340 1 270 . 1 1 27 27 GLU HG3 H 1 1.895 0.030 . 1 . . . . 27 GLU HG3 . 11340 1 271 . 1 1 27 27 GLU C C 13 175.028 0.300 . 1 . . . . 27 GLU C . 11340 1 272 . 1 1 27 27 GLU CA C 13 54.894 0.300 . 1 . . . . 27 GLU CA . 11340 1 273 . 1 1 27 27 GLU CB C 13 32.551 0.300 . 1 . . . . 27 GLU CB . 11340 1 274 . 1 1 27 27 GLU CG C 13 36.622 0.300 . 1 . . . . 27 GLU CG . 11340 1 275 . 1 1 27 27 GLU N N 15 121.535 0.300 . 1 . . . . 27 GLU N . 11340 1 276 . 1 1 28 28 CYS H H 1 8.792 0.030 . 1 . . . . 28 CYS H . 11340 1 277 . 1 1 28 28 CYS HA H 1 4.677 0.030 . 1 . . . . 28 CYS HA . 11340 1 278 . 1 1 28 28 CYS HB2 H 1 3.187 0.030 . 2 . . . . 28 CYS HB2 . 11340 1 279 . 1 1 28 28 CYS HB3 H 1 3.770 0.030 . 2 . . . . 28 CYS HB3 . 11340 1 280 . 1 1 28 28 CYS C C 13 176.288 0.300 . 1 . . . . 28 CYS C . 11340 1 281 . 1 1 28 28 CYS CA C 13 56.993 0.300 . 1 . . . . 28 CYS CA . 11340 1 282 . 1 1 28 28 CYS CB C 13 33.812 0.300 . 1 . . . . 28 CYS CB . 11340 1 283 . 1 1 28 28 CYS N N 15 128.731 0.300 . 1 . . . . 28 CYS N . 11340 1 284 . 1 1 29 29 PRO HA H 1 4.507 0.030 . 1 . . . . 29 PRO HA . 11340 1 285 . 1 1 29 29 PRO HB2 H 1 1.805 0.030 . 2 . . . . 29 PRO HB2 . 11340 1 286 . 1 1 29 29 PRO HB3 H 1 2.411 0.030 . 2 . . . . 29 PRO HB3 . 11340 1 287 . 1 1 29 29 PRO HD2 H 1 4.037 0.030 . 2 . . . . 29 PRO HD2 . 11340 1 288 . 1 1 29 29 PRO HD3 H 1 4.269 0.030 . 2 . . . . 29 PRO HD3 . 11340 1 289 . 1 1 29 29 PRO HG2 H 1 1.636 0.030 . 2 . . . . 29 PRO HG2 . 11340 1 290 . 1 1 29 29 PRO HG3 H 1 1.893 0.030 . 2 . . . . 29 PRO HG3 . 11340 1 291 . 1 1 29 29 PRO C C 13 176.983 0.300 . 1 . . . . 29 PRO C . 11340 1 292 . 1 1 29 29 PRO CA C 13 64.208 0.300 . 1 . . . . 29 PRO CA . 11340 1 293 . 1 1 29 29 PRO CB C 13 32.889 0.300 . 1 . . . . 29 PRO CB . 11340 1 294 . 1 1 29 29 PRO CD C 13 52.065 0.300 . 1 . . . . 29 PRO CD . 11340 1 295 . 1 1 29 29 PRO CG C 13 27.263 0.300 . 1 . . . . 29 PRO CG . 11340 1 296 . 1 1 30 30 ILE H H 1 9.082 0.030 . 1 . . . . 30 ILE H . 11340 1 297 . 1 1 30 30 ILE HA H 1 4.068 0.030 . 1 . . . . 30 ILE HA . 11340 1 298 . 1 1 30 30 ILE HB H 1 2.010 0.030 . 1 . . . . 30 ILE HB . 11340 1 299 . 1 1 30 30 ILE HD11 H 1 0.541 0.030 . 1 . . . . 30 ILE HD1 . 11340 1 300 . 1 1 30 30 ILE HD12 H 1 0.541 0.030 . 1 . . . . 30 ILE HD1 . 11340 1 301 . 1 1 30 30 ILE HD13 H 1 0.541 0.030 . 1 . . . . 30 ILE HD1 . 11340 1 302 . 1 1 30 30 ILE HG12 H 1 1.766 0.030 . 2 . . . . 30 ILE HG12 . 11340 1 303 . 1 1 30 30 ILE HG13 H 1 1.051 0.030 . 2 . . . . 30 ILE HG13 . 11340 1 304 . 1 1 30 30 ILE HG21 H 1 0.959 0.030 . 1 . . . . 30 ILE HG2 . 11340 1 305 . 1 1 30 30 ILE HG22 H 1 0.959 0.030 . 1 . . . . 30 ILE HG2 . 11340 1 306 . 1 1 30 30 ILE HG23 H 1 0.959 0.030 . 1 . . . . 30 ILE HG2 . 11340 1 307 . 1 1 30 30 ILE C C 13 176.375 0.300 . 1 . . . . 30 ILE C . 11340 1 308 . 1 1 30 30 ILE CA C 13 64.245 0.300 . 1 . . . . 30 ILE CA . 11340 1 309 . 1 1 30 30 ILE CB C 13 38.830 0.300 . 1 . . . . 30 ILE CB . 11340 1 310 . 1 1 30 30 ILE CD1 C 13 14.561 0.300 . 1 . . . . 30 ILE CD1 . 11340 1 311 . 1 1 30 30 ILE CG1 C 13 27.909 0.300 . 1 . . . . 30 ILE CG1 . 11340 1 312 . 1 1 30 30 ILE CG2 C 13 16.632 0.300 . 1 . . . . 30 ILE CG2 . 11340 1 313 . 1 1 30 30 ILE N N 15 119.000 0.300 . 1 . . . . 30 ILE N . 11340 1 314 . 1 1 31 31 CYS H H 1 8.233 0.030 . 1 . . . . 31 CYS H . 11340 1 315 . 1 1 31 31 CYS HA H 1 4.691 0.030 . 1 . . . . 31 CYS HA . 11340 1 316 . 1 1 31 31 CYS HB2 H 1 3.135 0.030 . 1 . . . . 31 CYS HB2 . 11340 1 317 . 1 1 31 31 CYS HB3 H 1 3.135 0.030 . 1 . . . . 31 CYS HB3 . 11340 1 318 . 1 1 31 31 CYS C C 13 175.923 0.300 . 1 . . . . 31 CYS C . 11340 1 319 . 1 1 31 31 CYS CA C 13 59.154 0.300 . 1 . . . . 31 CYS CA . 11340 1 320 . 1 1 31 31 CYS CB C 13 31.769 0.300 . 1 . . . . 31 CYS CB . 11340 1 321 . 1 1 31 31 CYS N N 15 118.446 0.300 . 1 . . . . 31 CYS N . 11340 1 322 . 1 1 32 32 LEU H H 1 8.186 0.030 . 1 . . . . 32 LEU H . 11340 1 323 . 1 1 32 32 LEU HA H 1 4.118 0.030 . 1 . . . . 32 LEU HA . 11340 1 324 . 1 1 32 32 LEU HB2 H 1 1.594 0.030 . 2 . . . . 32 LEU HB2 . 11340 1 325 . 1 1 32 32 LEU HB3 H 1 2.088 0.030 . 2 . . . . 32 LEU HB3 . 11340 1 326 . 1 1 32 32 LEU HD11 H 1 0.860 0.030 . 1 . . . . 32 LEU HD1 . 11340 1 327 . 1 1 32 32 LEU HD12 H 1 0.860 0.030 . 1 . . . . 32 LEU HD1 . 11340 1 328 . 1 1 32 32 LEU HD13 H 1 0.860 0.030 . 1 . . . . 32 LEU HD1 . 11340 1 329 . 1 1 32 32 LEU HD21 H 1 0.795 0.030 . 1 . . . . 32 LEU HD2 . 11340 1 330 . 1 1 32 32 LEU HD22 H 1 0.795 0.030 . 1 . . . . 32 LEU HD2 . 11340 1 331 . 1 1 32 32 LEU HD23 H 1 0.795 0.030 . 1 . . . . 32 LEU HD2 . 11340 1 332 . 1 1 32 32 LEU HG H 1 1.360 0.030 . 1 . . . . 32 LEU HG . 11340 1 333 . 1 1 32 32 LEU C C 13 175.787 0.300 . 1 . . . . 32 LEU C . 11340 1 334 . 1 1 32 32 LEU CA C 13 56.435 0.300 . 1 . . . . 32 LEU CA . 11340 1 335 . 1 1 32 32 LEU CB C 13 38.092 0.300 . 1 . . . . 32 LEU CB . 11340 1 336 . 1 1 32 32 LEU CD1 C 13 25.496 0.300 . 2 . . . . 32 LEU CD1 . 11340 1 337 . 1 1 32 32 LEU CD2 C 13 22.705 0.300 . 2 . . . . 32 LEU CD2 . 11340 1 338 . 1 1 32 32 LEU CG C 13 27.124 0.300 . 1 . . . . 32 LEU CG . 11340 1 339 . 1 1 32 32 LEU N N 15 118.617 0.300 . 1 . . . . 32 LEU N . 11340 1 340 . 1 1 33 33 MET H H 1 8.234 0.030 . 1 . . . . 33 MET H . 11340 1 341 . 1 1 33 33 MET HA H 1 4.771 0.030 . 1 . . . . 33 MET HA . 11340 1 342 . 1 1 33 33 MET HB2 H 1 2.117 0.030 . 2 . . . . 33 MET HB2 . 11340 1 343 . 1 1 33 33 MET HB3 H 1 2.477 0.030 . 2 . . . . 33 MET HB3 . 11340 1 344 . 1 1 33 33 MET HE1 H 1 2.144 0.030 . 1 . . . . 33 MET HE . 11340 1 345 . 1 1 33 33 MET HE2 H 1 2.144 0.030 . 1 . . . . 33 MET HE . 11340 1 346 . 1 1 33 33 MET HE3 H 1 2.144 0.030 . 1 . . . . 33 MET HE . 11340 1 347 . 1 1 33 33 MET HG2 H 1 2.654 0.030 . 2 . . . . 33 MET HG2 . 11340 1 348 . 1 1 33 33 MET HG3 H 1 2.526 0.030 . 2 . . . . 33 MET HG3 . 11340 1 349 . 1 1 33 33 MET C C 13 174.839 0.300 . 1 . . . . 33 MET C . 11340 1 350 . 1 1 33 33 MET CA C 13 53.721 0.300 . 1 . . . . 33 MET CA . 11340 1 351 . 1 1 33 33 MET CB C 13 35.738 0.300 . 1 . . . . 33 MET CB . 11340 1 352 . 1 1 33 33 MET CE C 13 17.251 0.300 . 1 . . . . 33 MET CE . 11340 1 353 . 1 1 33 33 MET CG C 13 32.549 0.300 . 1 . . . . 33 MET CG . 11340 1 354 . 1 1 33 33 MET N N 15 118.936 0.300 . 1 . . . . 33 MET N . 11340 1 355 . 1 1 34 34 ALA H H 1 8.003 0.030 . 1 . . . . 34 ALA H . 11340 1 356 . 1 1 34 34 ALA HA H 1 4.312 0.030 . 1 . . . . 34 ALA HA . 11340 1 357 . 1 1 34 34 ALA HB1 H 1 1.380 0.030 . 1 . . . . 34 ALA HB . 11340 1 358 . 1 1 34 34 ALA HB2 H 1 1.380 0.030 . 1 . . . . 34 ALA HB . 11340 1 359 . 1 1 34 34 ALA HB3 H 1 1.380 0.030 . 1 . . . . 34 ALA HB . 11340 1 360 . 1 1 34 34 ALA C C 13 177.546 0.300 . 1 . . . . 34 ALA C . 11340 1 361 . 1 1 34 34 ALA CA C 13 52.792 0.300 . 1 . . . . 34 ALA CA . 11340 1 362 . 1 1 34 34 ALA CB C 13 18.608 0.300 . 1 . . . . 34 ALA CB . 11340 1 363 . 1 1 34 34 ALA N N 15 121.328 0.300 . 1 . . . . 34 ALA N . 11340 1 364 . 1 1 35 35 LEU H H 1 7.722 0.030 . 1 . . . . 35 LEU H . 11340 1 365 . 1 1 35 35 LEU HA H 1 4.418 0.030 . 1 . . . . 35 LEU HA . 11340 1 366 . 1 1 35 35 LEU HB2 H 1 1.080 0.030 . 2 . . . . 35 LEU HB2 . 11340 1 367 . 1 1 35 35 LEU HB3 H 1 1.707 0.030 . 2 . . . . 35 LEU HB3 . 11340 1 368 . 1 1 35 35 LEU HD11 H 1 0.678 0.030 . 1 . . . . 35 LEU HD1 . 11340 1 369 . 1 1 35 35 LEU HD12 H 1 0.678 0.030 . 1 . . . . 35 LEU HD1 . 11340 1 370 . 1 1 35 35 LEU HD13 H 1 0.678 0.030 . 1 . . . . 35 LEU HD1 . 11340 1 371 . 1 1 35 35 LEU HD21 H 1 0.841 0.030 . 1 . . . . 35 LEU HD2 . 11340 1 372 . 1 1 35 35 LEU HD22 H 1 0.841 0.030 . 1 . . . . 35 LEU HD2 . 11340 1 373 . 1 1 35 35 LEU HD23 H 1 0.841 0.030 . 1 . . . . 35 LEU HD2 . 11340 1 374 . 1 1 35 35 LEU HG H 1 1.479 0.030 . 1 . . . . 35 LEU HG . 11340 1 375 . 1 1 35 35 LEU C C 13 178.107 0.300 . 1 . . . . 35 LEU C . 11340 1 376 . 1 1 35 35 LEU CA C 13 56.128 0.300 . 1 . . . . 35 LEU CA . 11340 1 377 . 1 1 35 35 LEU CB C 13 44.078 0.300 . 1 . . . . 35 LEU CB . 11340 1 378 . 1 1 35 35 LEU CD1 C 13 26.581 0.300 . 2 . . . . 35 LEU CD1 . 11340 1 379 . 1 1 35 35 LEU CD2 C 13 24.148 0.300 . 2 . . . . 35 LEU CD2 . 11340 1 380 . 1 1 35 35 LEU CG C 13 27.517 0.300 . 1 . . . . 35 LEU CG . 11340 1 381 . 1 1 35 35 LEU N N 15 119.136 0.300 . 1 . . . . 35 LEU N . 11340 1 382 . 1 1 36 36 ARG H H 1 8.652 0.030 . 1 . . . . 36 ARG H . 11340 1 383 . 1 1 36 36 ARG HA H 1 4.560 0.030 . 1 . . . . 36 ARG HA . 11340 1 384 . 1 1 36 36 ARG HB2 H 1 1.867 0.030 . 2 . . . . 36 ARG HB2 . 11340 1 385 . 1 1 36 36 ARG HB3 H 1 2.011 0.030 . 2 . . . . 36 ARG HB3 . 11340 1 386 . 1 1 36 36 ARG HD2 H 1 3.331 0.030 . 2 . . . . 36 ARG HD2 . 11340 1 387 . 1 1 36 36 ARG HD3 H 1 3.232 0.030 . 2 . . . . 36 ARG HD3 . 11340 1 388 . 1 1 36 36 ARG HG2 H 1 1.669 0.030 . 2 . . . . 36 ARG HG2 . 11340 1 389 . 1 1 36 36 ARG HG3 H 1 1.868 0.030 . 2 . . . . 36 ARG HG3 . 11340 1 390 . 1 1 36 36 ARG C C 13 175.839 0.300 . 1 . . . . 36 ARG C . 11340 1 391 . 1 1 36 36 ARG CA C 13 55.186 0.300 . 1 . . . . 36 ARG CA . 11340 1 392 . 1 1 36 36 ARG CB C 13 31.795 0.300 . 1 . . . . 36 ARG CB . 11340 1 393 . 1 1 36 36 ARG CD C 13 43.602 0.300 . 1 . . . . 36 ARG CD . 11340 1 394 . 1 1 36 36 ARG CG C 13 26.670 0.300 . 1 . . . . 36 ARG CG . 11340 1 395 . 1 1 36 36 ARG N N 15 125.774 0.300 . 1 . . . . 36 ARG N . 11340 1 396 . 1 1 37 37 GLU H H 1 9.055 0.030 . 1 . . . . 37 GLU H . 11340 1 397 . 1 1 37 37 GLU HA H 1 3.844 0.030 . 1 . . . . 37 GLU HA . 11340 1 398 . 1 1 37 37 GLU HB2 H 1 2.099 0.030 . 2 . . . . 37 GLU HB2 . 11340 1 399 . 1 1 37 37 GLU HB3 H 1 2.279 0.030 . 2 . . . . 37 GLU HB3 . 11340 1 400 . 1 1 37 37 GLU HG2 H 1 2.286 0.030 . 2 . . . . 37 GLU HG2 . 11340 1 401 . 1 1 37 37 GLU HG3 H 1 2.227 0.030 . 2 . . . . 37 GLU HG3 . 11340 1 402 . 1 1 37 37 GLU C C 13 174.688 0.300 . 1 . . . . 37 GLU C . 11340 1 403 . 1 1 37 37 GLU CA C 13 56.788 0.300 . 1 . . . . 37 GLU CA . 11340 1 404 . 1 1 37 37 GLU CB C 13 27.905 0.300 . 1 . . . . 37 GLU CB . 11340 1 405 . 1 1 37 37 GLU CG C 13 37.071 0.300 . 1 . . . . 37 GLU CG . 11340 1 406 . 1 1 37 37 GLU N N 15 126.291 0.300 . 1 . . . . 37 GLU N . 11340 1 407 . 1 1 38 38 ALA H H 1 8.166 0.030 . 1 . . . . 38 ALA H . 11340 1 408 . 1 1 38 38 ALA HA H 1 4.430 0.030 . 1 . . . . 38 ALA HA . 11340 1 409 . 1 1 38 38 ALA HB1 H 1 1.301 0.030 . 1 . . . . 38 ALA HB . 11340 1 410 . 1 1 38 38 ALA HB2 H 1 1.301 0.030 . 1 . . . . 38 ALA HB . 11340 1 411 . 1 1 38 38 ALA HB3 H 1 1.301 0.030 . 1 . . . . 38 ALA HB . 11340 1 412 . 1 1 38 38 ALA C C 13 178.533 0.300 . 1 . . . . 38 ALA C . 11340 1 413 . 1 1 38 38 ALA CA C 13 52.998 0.300 . 1 . . . . 38 ALA CA . 11340 1 414 . 1 1 38 38 ALA CB C 13 21.330 0.300 . 1 . . . . 38 ALA CB . 11340 1 415 . 1 1 38 38 ALA N N 15 120.828 0.300 . 1 . . . . 38 ALA N . 11340 1 416 . 1 1 39 39 VAL H H 1 9.119 0.030 . 1 . . . . 39 VAL H . 11340 1 417 . 1 1 39 39 VAL HA H 1 4.791 0.030 . 1 . . . . 39 VAL HA . 11340 1 418 . 1 1 39 39 VAL HB H 1 1.999 0.030 . 1 . . . . 39 VAL HB . 11340 1 419 . 1 1 39 39 VAL HG11 H 1 0.969 0.030 . 1 . . . . 39 VAL HG1 . 11340 1 420 . 1 1 39 39 VAL HG12 H 1 0.969 0.030 . 1 . . . . 39 VAL HG1 . 11340 1 421 . 1 1 39 39 VAL HG13 H 1 0.969 0.030 . 1 . . . . 39 VAL HG1 . 11340 1 422 . 1 1 39 39 VAL HG21 H 1 0.907 0.030 . 1 . . . . 39 VAL HG2 . 11340 1 423 . 1 1 39 39 VAL HG22 H 1 0.907 0.030 . 1 . . . . 39 VAL HG2 . 11340 1 424 . 1 1 39 39 VAL HG23 H 1 0.907 0.030 . 1 . . . . 39 VAL HG2 . 11340 1 425 . 1 1 39 39 VAL C C 13 173.594 0.300 . 1 . . . . 39 VAL C . 11340 1 426 . 1 1 39 39 VAL CA C 13 59.296 0.300 . 1 . . . . 39 VAL CA . 11340 1 427 . 1 1 39 39 VAL CB C 13 35.350 0.300 . 1 . . . . 39 VAL CB . 11340 1 428 . 1 1 39 39 VAL CG1 C 13 20.608 0.300 . 2 . . . . 39 VAL CG1 . 11340 1 429 . 1 1 39 39 VAL CG2 C 13 21.773 0.300 . 2 . . . . 39 VAL CG2 . 11340 1 430 . 1 1 39 39 VAL N N 15 116.379 0.300 . 1 . . . . 39 VAL N . 11340 1 431 . 1 1 40 40 GLN H H 1 8.976 0.030 . 1 . . . . 40 GLN H . 11340 1 432 . 1 1 40 40 GLN HA H 1 5.548 0.030 . 1 . . . . 40 GLN HA . 11340 1 433 . 1 1 40 40 GLN HB2 H 1 1.765 0.030 . 2 . . . . 40 GLN HB2 . 11340 1 434 . 1 1 40 40 GLN HB3 H 1 1.865 0.030 . 2 . . . . 40 GLN HB3 . 11340 1 435 . 1 1 40 40 GLN HE21 H 1 6.766 0.030 . 2 . . . . 40 GLN HE21 . 11340 1 436 . 1 1 40 40 GLN HE22 H 1 7.536 0.030 . 2 . . . . 40 GLN HE22 . 11340 1 437 . 1 1 40 40 GLN HG2 H 1 2.029 0.030 . 2 . . . . 40 GLN HG2 . 11340 1 438 . 1 1 40 40 GLN HG3 H 1 2.452 0.030 . 2 . . . . 40 GLN HG3 . 11340 1 439 . 1 1 40 40 GLN C C 13 175.525 0.300 . 1 . . . . 40 GLN C . 11340 1 440 . 1 1 40 40 GLN CA C 13 53.334 0.300 . 1 . . . . 40 GLN CA . 11340 1 441 . 1 1 40 40 GLN CB C 13 32.305 0.300 . 1 . . . . 40 GLN CB . 11340 1 442 . 1 1 40 40 GLN CG C 13 34.247 0.300 . 1 . . . . 40 GLN CG . 11340 1 443 . 1 1 40 40 GLN N N 15 121.694 0.300 . 1 . . . . 40 GLN N . 11340 1 444 . 1 1 40 40 GLN NE2 N 15 111.504 0.300 . 1 . . . . 40 GLN NE2 . 11340 1 445 . 1 1 41 41 THR H H 1 8.766 0.030 . 1 . . . . 41 THR H . 11340 1 446 . 1 1 41 41 THR HA H 1 4.982 0.030 . 1 . . . . 41 THR HA . 11340 1 447 . 1 1 41 41 THR HB H 1 4.787 0.030 . 1 . . . . 41 THR HB . 11340 1 448 . 1 1 41 41 THR HG21 H 1 1.411 0.030 . 1 . . . . 41 THR HG2 . 11340 1 449 . 1 1 41 41 THR HG22 H 1 1.411 0.030 . 1 . . . . 41 THR HG2 . 11340 1 450 . 1 1 41 41 THR HG23 H 1 1.411 0.030 . 1 . . . . 41 THR HG2 . 11340 1 451 . 1 1 41 41 THR C C 13 176.083 0.300 . 1 . . . . 41 THR C . 11340 1 452 . 1 1 41 41 THR CA C 13 59.864 0.300 . 1 . . . . 41 THR CA . 11340 1 453 . 1 1 41 41 THR CB C 13 67.371 0.300 . 1 . . . . 41 THR CB . 11340 1 454 . 1 1 41 41 THR CG2 C 13 23.959 0.300 . 1 . . . . 41 THR CG2 . 11340 1 455 . 1 1 41 41 THR N N 15 113.725 0.300 . 1 . . . . 41 THR N . 11340 1 456 . 1 1 42 42 PRO HA H 1 4.456 0.030 . 1 . . . . 42 PRO HA . 11340 1 457 . 1 1 42 42 PRO HB2 H 1 2.135 0.030 . 2 . . . . 42 PRO HB2 . 11340 1 458 . 1 1 42 42 PRO HB3 H 1 2.523 0.030 . 2 . . . . 42 PRO HB3 . 11340 1 459 . 1 1 42 42 PRO HD2 H 1 4.096 0.030 . 2 . . . . 42 PRO HD2 . 11340 1 460 . 1 1 42 42 PRO HD3 H 1 3.982 0.030 . 2 . . . . 42 PRO HD3 . 11340 1 461 . 1 1 42 42 PRO HG2 H 1 2.164 0.030 . 2 . . . . 42 PRO HG2 . 11340 1 462 . 1 1 42 42 PRO HG3 H 1 2.311 0.030 . 2 . . . . 42 PRO HG3 . 11340 1 463 . 1 1 42 42 PRO C C 13 176.653 0.300 . 1 . . . . 42 PRO C . 11340 1 464 . 1 1 42 42 PRO CA C 13 65.653 0.300 . 1 . . . . 42 PRO CA . 11340 1 465 . 1 1 42 42 PRO CB C 13 31.695 0.300 . 1 . . . . 42 PRO CB . 11340 1 466 . 1 1 42 42 PRO CD C 13 51.087 0.300 . 1 . . . . 42 PRO CD . 11340 1 467 . 1 1 42 42 PRO CG C 13 28.582 0.300 . 1 . . . . 42 PRO CG . 11340 1 468 . 1 1 43 43 CYS H H 1 7.439 0.030 . 1 . . . . 43 CYS H . 11340 1 469 . 1 1 43 43 CYS HA H 1 4.558 0.030 . 1 . . . . 43 CYS HA . 11340 1 470 . 1 1 43 43 CYS HB2 H 1 2.880 0.030 . 2 . . . . 43 CYS HB2 . 11340 1 471 . 1 1 43 43 CYS HB3 H 1 3.393 0.030 . 2 . . . . 43 CYS HB3 . 11340 1 472 . 1 1 43 43 CYS C C 13 174.824 0.300 . 1 . . . . 43 CYS C . 11340 1 473 . 1 1 43 43 CYS CA C 13 56.799 0.300 . 1 . . . . 43 CYS CA . 11340 1 474 . 1 1 43 43 CYS CB C 13 28.503 0.300 . 1 . . . . 43 CYS CB . 11340 1 475 . 1 1 43 43 CYS N N 15 110.328 0.300 . 1 . . . . 43 CYS N . 11340 1 476 . 1 1 44 44 GLY H H 1 8.082 0.030 . 1 . . . . 44 GLY H . 11340 1 477 . 1 1 44 44 GLY HA2 H 1 3.960 0.030 . 2 . . . . 44 GLY HA2 . 11340 1 478 . 1 1 44 44 GLY HA3 H 1 3.633 0.030 . 2 . . . . 44 GLY HA3 . 11340 1 479 . 1 1 44 44 GLY C C 13 174.088 0.300 . 1 . . . . 44 GLY C . 11340 1 480 . 1 1 44 44 GLY CA C 13 45.610 0.300 . 1 . . . . 44 GLY CA . 11340 1 481 . 1 1 44 44 GLY N N 15 110.113 0.300 . 1 . . . . 44 GLY N . 11340 1 482 . 1 1 45 45 HIS H H 1 7.694 0.030 . 1 . . . . 45 HIS H . 11340 1 483 . 1 1 45 45 HIS HA H 1 4.502 0.030 . 1 . . . . 45 HIS HA . 11340 1 484 . 1 1 45 45 HIS HB2 H 1 2.623 0.030 . 2 . . . . 45 HIS HB2 . 11340 1 485 . 1 1 45 45 HIS HB3 H 1 2.902 0.030 . 2 . . . . 45 HIS HB3 . 11340 1 486 . 1 1 45 45 HIS HD2 H 1 7.228 0.030 . 1 . . . . 45 HIS HD2 . 11340 1 487 . 1 1 45 45 HIS HE1 H 1 8.061 0.030 . 1 . . . . 45 HIS HE1 . 11340 1 488 . 1 1 45 45 HIS C C 13 172.291 0.300 . 1 . . . . 45 HIS C . 11340 1 489 . 1 1 45 45 HIS CA C 13 59.477 0.300 . 1 . . . . 45 HIS CA . 11340 1 490 . 1 1 45 45 HIS CB C 13 33.575 0.300 . 1 . . . . 45 HIS CB . 11340 1 491 . 1 1 45 45 HIS CD2 C 13 118.314 0.300 . 1 . . . . 45 HIS CD2 . 11340 1 492 . 1 1 45 45 HIS CE1 C 13 139.172 0.300 . 1 . . . . 45 HIS CE1 . 11340 1 493 . 1 1 45 45 HIS N N 15 120.702 0.300 . 1 . . . . 45 HIS N . 11340 1 494 . 1 1 46 46 ARG H H 1 7.677 0.030 . 1 . . . . 46 ARG H . 11340 1 495 . 1 1 46 46 ARG HA H 1 5.477 0.030 . 1 . . . . 46 ARG HA . 11340 1 496 . 1 1 46 46 ARG HB2 H 1 1.446 0.030 . 1 . . . . 46 ARG HB2 . 11340 1 497 . 1 1 46 46 ARG HB3 H 1 1.446 0.030 . 1 . . . . 46 ARG HB3 . 11340 1 498 . 1 1 46 46 ARG HD2 H 1 2.868 0.030 . 1 . . . . 46 ARG HD2 . 11340 1 499 . 1 1 46 46 ARG HD3 H 1 2.868 0.030 . 1 . . . . 46 ARG HD3 . 11340 1 500 . 1 1 46 46 ARG HG2 H 1 1.323 0.030 . 2 . . . . 46 ARG HG2 . 11340 1 501 . 1 1 46 46 ARG HG3 H 1 1.446 0.030 . 2 . . . . 46 ARG HG3 . 11340 1 502 . 1 1 46 46 ARG C C 13 174.327 0.300 . 1 . . . . 46 ARG C . 11340 1 503 . 1 1 46 46 ARG CA C 13 54.505 0.300 . 1 . . . . 46 ARG CA . 11340 1 504 . 1 1 46 46 ARG CB C 13 33.656 0.300 . 1 . . . . 46 ARG CB . 11340 1 505 . 1 1 46 46 ARG CD C 13 43.582 0.300 . 1 . . . . 46 ARG CD . 11340 1 506 . 1 1 46 46 ARG CG C 13 27.666 0.300 . 1 . . . . 46 ARG CG . 11340 1 507 . 1 1 46 46 ARG N N 15 118.860 0.300 . 1 . . . . 46 ARG N . 11340 1 508 . 1 1 47 47 PHE H H 1 8.392 0.030 . 1 . . . . 47 PHE H . 11340 1 509 . 1 1 47 47 PHE HA H 1 5.283 0.030 . 1 . . . . 47 PHE HA . 11340 1 510 . 1 1 47 47 PHE HB2 H 1 2.258 0.030 . 2 . . . . 47 PHE HB2 . 11340 1 511 . 1 1 47 47 PHE HB3 H 1 3.305 0.030 . 2 . . . . 47 PHE HB3 . 11340 1 512 . 1 1 47 47 PHE HD1 H 1 7.098 0.030 . 1 . . . . 47 PHE HD1 . 11340 1 513 . 1 1 47 47 PHE HD2 H 1 7.098 0.030 . 1 . . . . 47 PHE HD2 . 11340 1 514 . 1 1 47 47 PHE HE1 H 1 7.234 0.030 . 1 . . . . 47 PHE HE1 . 11340 1 515 . 1 1 47 47 PHE HE2 H 1 7.234 0.030 . 1 . . . . 47 PHE HE2 . 11340 1 516 . 1 1 47 47 PHE HZ H 1 7.724 0.030 . 1 . . . . 47 PHE HZ . 11340 1 517 . 1 1 47 47 PHE C C 13 175.607 0.300 . 1 . . . . 47 PHE C . 11340 1 518 . 1 1 47 47 PHE CA C 13 55.335 0.300 . 1 . . . . 47 PHE CA . 11340 1 519 . 1 1 47 47 PHE CB C 13 46.653 0.300 . 1 . . . . 47 PHE CB . 11340 1 520 . 1 1 47 47 PHE CD1 C 13 132.492 0.300 . 1 . . . . 47 PHE CD1 . 11340 1 521 . 1 1 47 47 PHE CD2 C 13 132.492 0.300 . 1 . . . . 47 PHE CD2 . 11340 1 522 . 1 1 47 47 PHE CE1 C 13 130.378 0.300 . 1 . . . . 47 PHE CE1 . 11340 1 523 . 1 1 47 47 PHE CE2 C 13 130.378 0.300 . 1 . . . . 47 PHE CE2 . 11340 1 524 . 1 1 47 47 PHE CZ C 13 130.710 0.300 . 1 . . . . 47 PHE CZ . 11340 1 525 . 1 1 47 47 PHE N N 15 116.047 0.300 . 1 . . . . 47 PHE N . 11340 1 526 . 1 1 48 48 CYS H H 1 8.740 0.030 . 1 . . . . 48 CYS H . 11340 1 527 . 1 1 48 48 CYS HA H 1 4.335 0.030 . 1 . . . . 48 CYS HA . 11340 1 528 . 1 1 48 48 CYS HB2 H 1 3.450 0.030 . 2 . . . . 48 CYS HB2 . 11340 1 529 . 1 1 48 48 CYS HB3 H 1 3.691 0.030 . 2 . . . . 48 CYS HB3 . 11340 1 530 . 1 1 48 48 CYS C C 13 179.162 0.300 . 1 . . . . 48 CYS C . 11340 1 531 . 1 1 48 48 CYS CA C 13 60.266 0.300 . 1 . . . . 48 CYS CA . 11340 1 532 . 1 1 48 48 CYS CB C 13 31.308 0.300 . 1 . . . . 48 CYS CB . 11340 1 533 . 1 1 48 48 CYS N N 15 124.671 0.300 . 1 . . . . 48 CYS N . 11340 1 534 . 1 1 49 49 LYS H H 1 8.281 0.030 . 1 . . . . 49 LYS H . 11340 1 535 . 1 1 49 49 LYS HA H 1 3.858 0.030 . 1 . . . . 49 LYS HA . 11340 1 536 . 1 1 49 49 LYS HB2 H 1 1.878 0.030 . 2 . . . . 49 LYS HB2 . 11340 1 537 . 1 1 49 49 LYS HB3 H 1 2.448 0.030 . 2 . . . . 49 LYS HB3 . 11340 1 538 . 1 1 49 49 LYS HD2 H 1 1.643 0.030 . 1 . . . . 49 LYS HD2 . 11340 1 539 . 1 1 49 49 LYS HD3 H 1 1.643 0.030 . 1 . . . . 49 LYS HD3 . 11340 1 540 . 1 1 49 49 LYS HE2 H 1 2.830 0.030 . 1 . . . . 49 LYS HE2 . 11340 1 541 . 1 1 49 49 LYS HE3 H 1 2.830 0.030 . 1 . . . . 49 LYS HE3 . 11340 1 542 . 1 1 49 49 LYS HG2 H 1 1.207 0.030 . 2 . . . . 49 LYS HG2 . 11340 1 543 . 1 1 49 49 LYS HG3 H 1 1.411 0.030 . 2 . . . . 49 LYS HG3 . 11340 1 544 . 1 1 49 49 LYS C C 13 177.724 0.300 . 1 . . . . 49 LYS C . 11340 1 545 . 1 1 49 49 LYS CA C 13 61.352 0.300 . 1 . . . . 49 LYS CA . 11340 1 546 . 1 1 49 49 LYS CB C 13 32.131 0.300 . 1 . . . . 49 LYS CB . 11340 1 547 . 1 1 49 49 LYS CD C 13 29.708 0.300 . 1 . . . . 49 LYS CD . 11340 1 548 . 1 1 49 49 LYS CE C 13 42.061 0.300 . 1 . . . . 49 LYS CE . 11340 1 549 . 1 1 49 49 LYS CG C 13 25.315 0.300 . 1 . . . . 49 LYS CG . 11340 1 550 . 1 1 49 49 LYS N N 15 126.548 0.300 . 1 . . . . 49 LYS N . 11340 1 551 . 1 1 50 50 ALA H H 1 8.944 0.030 . 1 . . . . 50 ALA H . 11340 1 552 . 1 1 50 50 ALA HA H 1 4.015 0.030 . 1 . . . . 50 ALA HA . 11340 1 553 . 1 1 50 50 ALA HB1 H 1 1.458 0.030 . 1 . . . . 50 ALA HB . 11340 1 554 . 1 1 50 50 ALA HB2 H 1 1.458 0.030 . 1 . . . . 50 ALA HB . 11340 1 555 . 1 1 50 50 ALA HB3 H 1 1.458 0.030 . 1 . . . . 50 ALA HB . 11340 1 556 . 1 1 50 50 ALA C C 13 181.259 0.300 . 1 . . . . 50 ALA C . 11340 1 557 . 1 1 50 50 ALA CA C 13 55.004 0.300 . 1 . . . . 50 ALA CA . 11340 1 558 . 1 1 50 50 ALA CB C 13 18.554 0.300 . 1 . . . . 50 ALA CB . 11340 1 559 . 1 1 50 50 ALA N N 15 115.611 0.300 . 1 . . . . 50 ALA N . 11340 1 560 . 1 1 51 51 CYS H H 1 7.006 0.030 . 1 . . . . 51 CYS H . 11340 1 561 . 1 1 51 51 CYS HA H 1 3.980 0.030 . 1 . . . . 51 CYS HA . 11340 1 562 . 1 1 51 51 CYS HB2 H 1 3.094 0.030 . 2 . . . . 51 CYS HB2 . 11340 1 563 . 1 1 51 51 CYS HB3 H 1 2.904 0.030 . 2 . . . . 51 CYS HB3 . 11340 1 564 . 1 1 51 51 CYS C C 13 177.973 0.300 . 1 . . . . 51 CYS C . 11340 1 565 . 1 1 51 51 CYS CA C 13 63.730 0.300 . 1 . . . . 51 CYS CA . 11340 1 566 . 1 1 51 51 CYS CB C 13 29.830 0.300 . 1 . . . . 51 CYS CB . 11340 1 567 . 1 1 51 51 CYS N N 15 115.868 0.300 . 1 . . . . 51 CYS N . 11340 1 568 . 1 1 52 52 ILE H H 1 8.049 0.030 . 1 . . . . 52 ILE H . 11340 1 569 . 1 1 52 52 ILE HA H 1 3.992 0.030 . 1 . . . . 52 ILE HA . 11340 1 570 . 1 1 52 52 ILE HB H 1 1.171 0.030 . 1 . . . . 52 ILE HB . 11340 1 571 . 1 1 52 52 ILE HD11 H 1 0.042 0.030 . 1 . . . . 52 ILE HD1 . 11340 1 572 . 1 1 52 52 ILE HD12 H 1 0.042 0.030 . 1 . . . . 52 ILE HD1 . 11340 1 573 . 1 1 52 52 ILE HD13 H 1 0.042 0.030 . 1 . . . . 52 ILE HD1 . 11340 1 574 . 1 1 52 52 ILE HG12 H 1 1.066 0.030 . 2 . . . . 52 ILE HG12 . 11340 1 575 . 1 1 52 52 ILE HG13 H 1 0.784 0.030 . 2 . . . . 52 ILE HG13 . 11340 1 576 . 1 1 52 52 ILE HG21 H 1 1.077 0.030 . 1 . . . . 52 ILE HG2 . 11340 1 577 . 1 1 52 52 ILE HG22 H 1 1.077 0.030 . 1 . . . . 52 ILE HG2 . 11340 1 578 . 1 1 52 52 ILE HG23 H 1 1.077 0.030 . 1 . . . . 52 ILE HG2 . 11340 1 579 . 1 1 52 52 ILE C C 13 175.906 0.300 . 1 . . . . 52 ILE C . 11340 1 580 . 1 1 52 52 ILE CA C 13 59.337 0.300 . 1 . . . . 52 ILE CA . 11340 1 581 . 1 1 52 52 ILE CB C 13 37.987 0.300 . 1 . . . . 52 ILE CB . 11340 1 582 . 1 1 52 52 ILE CD1 C 13 12.973 0.300 . 1 . . . . 52 ILE CD1 . 11340 1 583 . 1 1 52 52 ILE CG1 C 13 30.017 0.300 . 1 . . . . 52 ILE CG1 . 11340 1 584 . 1 1 52 52 ILE CG2 C 13 20.613 0.300 . 1 . . . . 52 ILE CG2 . 11340 1 585 . 1 1 52 52 ILE N N 15 118.742 0.300 . 1 . . . . 52 ILE N . 11340 1 586 . 1 1 53 53 ILE H H 1 7.997 0.030 . 1 . . . . 53 ILE H . 11340 1 587 . 1 1 53 53 ILE HA H 1 3.601 0.030 . 1 . . . . 53 ILE HA . 11340 1 588 . 1 1 53 53 ILE HB H 1 1.816 0.030 . 1 . . . . 53 ILE HB . 11340 1 589 . 1 1 53 53 ILE HD11 H 1 0.702 0.030 . 1 . . . . 53 ILE HD1 . 11340 1 590 . 1 1 53 53 ILE HD12 H 1 0.702 0.030 . 1 . . . . 53 ILE HD1 . 11340 1 591 . 1 1 53 53 ILE HD13 H 1 0.702 0.030 . 1 . . . . 53 ILE HD1 . 11340 1 592 . 1 1 53 53 ILE HG12 H 1 1.111 0.030 . 2 . . . . 53 ILE HG12 . 11340 1 593 . 1 1 53 53 ILE HG13 H 1 1.632 0.030 . 2 . . . . 53 ILE HG13 . 11340 1 594 . 1 1 53 53 ILE HG21 H 1 0.800 0.030 . 1 . . . . 53 ILE HG2 . 11340 1 595 . 1 1 53 53 ILE HG22 H 1 0.800 0.030 . 1 . . . . 53 ILE HG2 . 11340 1 596 . 1 1 53 53 ILE HG23 H 1 0.800 0.030 . 1 . . . . 53 ILE HG2 . 11340 1 597 . 1 1 53 53 ILE C C 13 177.933 0.300 . 1 . . . . 53 ILE C . 11340 1 598 . 1 1 53 53 ILE CA C 13 65.529 0.300 . 1 . . . . 53 ILE CA . 11340 1 599 . 1 1 53 53 ILE CB C 13 36.674 0.300 . 1 . . . . 53 ILE CB . 11340 1 600 . 1 1 53 53 ILE CD1 C 13 12.655 0.300 . 1 . . . . 53 ILE CD1 . 11340 1 601 . 1 1 53 53 ILE CG1 C 13 29.687 0.300 . 1 . . . . 53 ILE CG1 . 11340 1 602 . 1 1 53 53 ILE CG2 C 13 16.724 0.300 . 1 . . . . 53 ILE CG2 . 11340 1 603 . 1 1 53 53 ILE N N 15 124.304 0.300 . 1 . . . . 53 ILE N . 11340 1 604 . 1 1 54 54 LYS H H 1 7.194 0.030 . 1 . . . . 54 LYS H . 11340 1 605 . 1 1 54 54 LYS HA H 1 3.903 0.030 . 1 . . . . 54 LYS HA . 11340 1 606 . 1 1 54 54 LYS HB2 H 1 1.956 0.030 . 2 . . . . 54 LYS HB2 . 11340 1 607 . 1 1 54 54 LYS HB3 H 1 1.821 0.030 . 2 . . . . 54 LYS HB3 . 11340 1 608 . 1 1 54 54 LYS HD2 H 1 1.668 0.030 . 1 . . . . 54 LYS HD2 . 11340 1 609 . 1 1 54 54 LYS HD3 H 1 1.668 0.030 . 1 . . . . 54 LYS HD3 . 11340 1 610 . 1 1 54 54 LYS HE2 H 1 2.976 0.030 . 1 . . . . 54 LYS HE2 . 11340 1 611 . 1 1 54 54 LYS HE3 H 1 2.976 0.030 . 1 . . . . 54 LYS HE3 . 11340 1 612 . 1 1 54 54 LYS HG2 H 1 1.365 0.030 . 2 . . . . 54 LYS HG2 . 11340 1 613 . 1 1 54 54 LYS HG3 H 1 1.466 0.030 . 2 . . . . 54 LYS HG3 . 11340 1 614 . 1 1 54 54 LYS C C 13 177.472 0.300 . 1 . . . . 54 LYS C . 11340 1 615 . 1 1 54 54 LYS CA C 13 59.715 0.300 . 1 . . . . 54 LYS CA . 11340 1 616 . 1 1 54 54 LYS CB C 13 32.088 0.300 . 1 . . . . 54 LYS CB . 11340 1 617 . 1 1 54 54 LYS CD C 13 29.475 0.300 . 1 . . . . 54 LYS CD . 11340 1 618 . 1 1 54 54 LYS CE C 13 42.225 0.300 . 1 . . . . 54 LYS CE . 11340 1 619 . 1 1 54 54 LYS CG C 13 24.953 0.300 . 1 . . . . 54 LYS CG . 11340 1 620 . 1 1 54 54 LYS N N 15 119.558 0.300 . 1 . . . . 54 LYS N . 11340 1 621 . 1 1 55 55 SER H H 1 7.722 0.030 . 1 . . . . 55 SER H . 11340 1 622 . 1 1 55 55 SER HA H 1 4.100 0.030 . 1 . . . . 55 SER HA . 11340 1 623 . 1 1 55 55 SER HB2 H 1 3.719 0.030 . 2 . . . . 55 SER HB2 . 11340 1 624 . 1 1 55 55 SER HB3 H 1 4.056 0.030 . 2 . . . . 55 SER HB3 . 11340 1 625 . 1 1 55 55 SER C C 13 177.807 0.300 . 1 . . . . 55 SER C . 11340 1 626 . 1 1 55 55 SER CA C 13 62.014 0.300 . 1 . . . . 55 SER CA . 11340 1 627 . 1 1 55 55 SER CB C 13 64.056 0.300 . 1 . . . . 55 SER CB . 11340 1 628 . 1 1 55 55 SER N N 15 112.707 0.300 . 1 . . . . 55 SER N . 11340 1 629 . 1 1 56 56 ILE H H 1 8.478 0.030 . 1 . . . . 56 ILE H . 11340 1 630 . 1 1 56 56 ILE HA H 1 4.114 0.030 . 1 . . . . 56 ILE HA . 11340 1 631 . 1 1 56 56 ILE HB H 1 1.732 0.030 . 1 . . . . 56 ILE HB . 11340 1 632 . 1 1 56 56 ILE HD11 H 1 0.588 0.030 . 1 . . . . 56 ILE HD1 . 11340 1 633 . 1 1 56 56 ILE HD12 H 1 0.588 0.030 . 1 . . . . 56 ILE HD1 . 11340 1 634 . 1 1 56 56 ILE HD13 H 1 0.588 0.030 . 1 . . . . 56 ILE HD1 . 11340 1 635 . 1 1 56 56 ILE HG12 H 1 0.841 0.030 . 2 . . . . 56 ILE HG12 . 11340 1 636 . 1 1 56 56 ILE HG13 H 1 1.730 0.030 . 2 . . . . 56 ILE HG13 . 11340 1 637 . 1 1 56 56 ILE HG21 H 1 0.533 0.030 . 1 . . . . 56 ILE HG2 . 11340 1 638 . 1 1 56 56 ILE HG22 H 1 0.533 0.030 . 1 . . . . 56 ILE HG2 . 11340 1 639 . 1 1 56 56 ILE HG23 H 1 0.533 0.030 . 1 . . . . 56 ILE HG2 . 11340 1 640 . 1 1 56 56 ILE C C 13 178.707 0.300 . 1 . . . . 56 ILE C . 11340 1 641 . 1 1 56 56 ILE CA C 13 63.570 0.300 . 1 . . . . 56 ILE CA . 11340 1 642 . 1 1 56 56 ILE CB C 13 38.060 0.300 . 1 . . . . 56 ILE CB . 11340 1 643 . 1 1 56 56 ILE CD1 C 13 14.208 0.300 . 1 . . . . 56 ILE CD1 . 11340 1 644 . 1 1 56 56 ILE CG1 C 13 28.929 0.300 . 1 . . . . 56 ILE CG1 . 11340 1 645 . 1 1 56 56 ILE CG2 C 13 17.335 0.300 . 1 . . . . 56 ILE CG2 . 11340 1 646 . 1 1 56 56 ILE N N 15 120.697 0.300 . 1 . . . . 56 ILE N . 11340 1 647 . 1 1 57 57 ARG H H 1 7.672 0.030 . 1 . . . . 57 ARG H . 11340 1 648 . 1 1 57 57 ARG HA H 1 3.968 0.030 . 1 . . . . 57 ARG HA . 11340 1 649 . 1 1 57 57 ARG HB2 H 1 1.947 0.030 . 2 . . . . 57 ARG HB2 . 11340 1 650 . 1 1 57 57 ARG HB3 H 1 1.859 0.030 . 2 . . . . 57 ARG HB3 . 11340 1 651 . 1 1 57 57 ARG HD2 H 1 3.121 0.030 . 1 . . . . 57 ARG HD2 . 11340 1 652 . 1 1 57 57 ARG HD3 H 1 3.121 0.030 . 1 . . . . 57 ARG HD3 . 11340 1 653 . 1 1 57 57 ARG HG2 H 1 1.603 0.030 . 2 . . . . 57 ARG HG2 . 11340 1 654 . 1 1 57 57 ARG HG3 H 1 1.805 0.030 . 2 . . . . 57 ARG HG3 . 11340 1 655 . 1 1 57 57 ARG C C 13 178.184 0.300 . 1 . . . . 57 ARG C . 11340 1 656 . 1 1 57 57 ARG CA C 13 59.059 0.300 . 1 . . . . 57 ARG CA . 11340 1 657 . 1 1 57 57 ARG CB C 13 30.255 0.300 . 1 . . . . 57 ARG CB . 11340 1 658 . 1 1 57 57 ARG CD C 13 43.596 0.300 . 1 . . . . 57 ARG CD . 11340 1 659 . 1 1 57 57 ARG CG C 13 27.214 0.300 . 1 . . . . 57 ARG CG . 11340 1 660 . 1 1 57 57 ARG N N 15 119.289 0.300 . 1 . . . . 57 ARG N . 11340 1 661 . 1 1 58 58 ASP H H 1 8.455 0.030 . 1 . . . . 58 ASP H . 11340 1 662 . 1 1 58 58 ASP HA H 1 4.576 0.030 . 1 . . . . 58 ASP HA . 11340 1 663 . 1 1 58 58 ASP HB2 H 1 2.687 0.030 . 2 . . . . 58 ASP HB2 . 11340 1 664 . 1 1 58 58 ASP HB3 H 1 2.634 0.030 . 2 . . . . 58 ASP HB3 . 11340 1 665 . 1 1 58 58 ASP C C 13 177.460 0.300 . 1 . . . . 58 ASP C . 11340 1 666 . 1 1 58 58 ASP CA C 13 56.214 0.300 . 1 . . . . 58 ASP CA . 11340 1 667 . 1 1 58 58 ASP CB C 13 41.365 0.300 . 1 . . . . 58 ASP CB . 11340 1 668 . 1 1 58 58 ASP N N 15 117.285 0.300 . 1 . . . . 58 ASP N . 11340 1 669 . 1 1 59 59 ALA H H 1 9.007 0.030 . 1 . . . . 59 ALA H . 11340 1 670 . 1 1 59 59 ALA HA H 1 4.589 0.030 . 1 . . . . 59 ALA HA . 11340 1 671 . 1 1 59 59 ALA HB1 H 1 1.445 0.030 . 1 . . . . 59 ALA HB . 11340 1 672 . 1 1 59 59 ALA HB2 H 1 1.445 0.030 . 1 . . . . 59 ALA HB . 11340 1 673 . 1 1 59 59 ALA HB3 H 1 1.445 0.030 . 1 . . . . 59 ALA HB . 11340 1 674 . 1 1 59 59 ALA C C 13 177.757 0.300 . 1 . . . . 59 ALA C . 11340 1 675 . 1 1 59 59 ALA CA C 13 52.271 0.300 . 1 . . . . 59 ALA CA . 11340 1 676 . 1 1 59 59 ALA CB C 13 20.226 0.300 . 1 . . . . 59 ALA CB . 11340 1 677 . 1 1 59 59 ALA N N 15 122.597 0.300 . 1 . . . . 59 ALA N . 11340 1 678 . 1 1 60 60 GLY H H 1 7.554 0.030 . 1 . . . . 60 GLY H . 11340 1 679 . 1 1 60 60 GLY HA2 H 1 3.803 0.030 . 2 . . . . 60 GLY HA2 . 11340 1 680 . 1 1 60 60 GLY HA3 H 1 4.456 0.030 . 2 . . . . 60 GLY HA3 . 11340 1 681 . 1 1 60 60 GLY C C 13 174.422 0.300 . 1 . . . . 60 GLY C . 11340 1 682 . 1 1 60 60 GLY CA C 13 44.084 0.300 . 1 . . . . 60 GLY CA . 11340 1 683 . 1 1 60 60 GLY N N 15 106.705 0.300 . 1 . . . . 60 GLY N . 11340 1 684 . 1 1 61 61 HIS HA H 1 4.532 0.030 . 1 . . . . 61 HIS HA . 11340 1 685 . 1 1 61 61 HIS HB2 H 1 3.552 0.030 . 2 . . . . 61 HIS HB2 . 11340 1 686 . 1 1 61 61 HIS HB3 H 1 3.032 0.030 . 2 . . . . 61 HIS HB3 . 11340 1 687 . 1 1 61 61 HIS HD2 H 1 7.106 0.030 . 1 . . . . 61 HIS HD2 . 11340 1 688 . 1 1 61 61 HIS HE1 H 1 8.154 0.030 . 1 . . . . 61 HIS HE1 . 11340 1 689 . 1 1 61 61 HIS C C 13 175.350 0.300 . 1 . . . . 61 HIS C . 11340 1 690 . 1 1 61 61 HIS CA C 13 56.398 0.300 . 1 . . . . 61 HIS CA . 11340 1 691 . 1 1 61 61 HIS CB C 13 27.179 0.300 . 1 . . . . 61 HIS CB . 11340 1 692 . 1 1 61 61 HIS CD2 C 13 119.496 0.300 . 1 . . . . 61 HIS CD2 . 11340 1 693 . 1 1 61 61 HIS CE1 C 13 137.447 0.300 . 1 . . . . 61 HIS CE1 . 11340 1 694 . 1 1 62 62 LYS H H 1 8.368 0.030 . 1 . . . . 62 LYS H . 11340 1 695 . 1 1 62 62 LYS HA H 1 5.200 0.030 . 1 . . . . 62 LYS HA . 11340 1 696 . 1 1 62 62 LYS HB2 H 1 1.263 0.030 . 2 . . . . 62 LYS HB2 . 11340 1 697 . 1 1 62 62 LYS HB3 H 1 1.521 0.030 . 2 . . . . 62 LYS HB3 . 11340 1 698 . 1 1 62 62 LYS HD2 H 1 1.516 0.030 . 2 . . . . 62 LYS HD2 . 11340 1 699 . 1 1 62 62 LYS HD3 H 1 1.454 0.030 . 2 . . . . 62 LYS HD3 . 11340 1 700 . 1 1 62 62 LYS HE2 H 1 2.892 0.030 . 2 . . . . 62 LYS HE2 . 11340 1 701 . 1 1 62 62 LYS HE3 H 1 2.820 0.030 . 2 . . . . 62 LYS HE3 . 11340 1 702 . 1 1 62 62 LYS HG2 H 1 0.945 0.030 . 1 . . . . 62 LYS HG2 . 11340 1 703 . 1 1 62 62 LYS HG3 H 1 0.945 0.030 . 1 . . . . 62 LYS HG3 . 11340 1 704 . 1 1 62 62 LYS C C 13 174.143 0.300 . 1 . . . . 62 LYS C . 11340 1 705 . 1 1 62 62 LYS CA C 13 54.077 0.300 . 1 . . . . 62 LYS CA . 11340 1 706 . 1 1 62 62 LYS CB C 13 35.597 0.300 . 1 . . . . 62 LYS CB . 11340 1 707 . 1 1 62 62 LYS CD C 13 29.687 0.300 . 1 . . . . 62 LYS CD . 11340 1 708 . 1 1 62 62 LYS CE C 13 42.316 0.300 . 1 . . . . 62 LYS CE . 11340 1 709 . 1 1 62 62 LYS CG C 13 23.507 0.300 . 1 . . . . 62 LYS CG . 11340 1 710 . 1 1 62 62 LYS N N 15 122.014 0.300 . 1 . . . . 62 LYS N . 11340 1 711 . 1 1 63 63 CYS H H 1 9.149 0.030 . 1 . . . . 63 CYS H . 11340 1 712 . 1 1 63 63 CYS HA H 1 4.373 0.030 . 1 . . . . 63 CYS HA . 11340 1 713 . 1 1 63 63 CYS HB2 H 1 2.968 0.030 . 2 . . . . 63 CYS HB2 . 11340 1 714 . 1 1 63 63 CYS HB3 H 1 3.585 0.030 . 2 . . . . 63 CYS HB3 . 11340 1 715 . 1 1 63 63 CYS C C 13 176.020 0.300 . 1 . . . . 63 CYS C . 11340 1 716 . 1 1 63 63 CYS CA C 13 56.257 0.300 . 1 . . . . 63 CYS CA . 11340 1 717 . 1 1 63 63 CYS CB C 13 30.831 0.300 . 1 . . . . 63 CYS CB . 11340 1 718 . 1 1 63 63 CYS N N 15 126.150 0.300 . 1 . . . . 63 CYS N . 11340 1 719 . 1 1 64 64 PRO HA H 1 4.364 0.030 . 1 . . . . 64 PRO HA . 11340 1 720 . 1 1 64 64 PRO HB2 H 1 1.910 0.030 . 2 . . . . 64 PRO HB2 . 11340 1 721 . 1 1 64 64 PRO HB3 H 1 2.123 0.030 . 2 . . . . 64 PRO HB3 . 11340 1 722 . 1 1 64 64 PRO HD2 H 1 3.475 0.030 . 2 . . . . 64 PRO HD2 . 11340 1 723 . 1 1 64 64 PRO HD3 H 1 3.799 0.030 . 2 . . . . 64 PRO HD3 . 11340 1 724 . 1 1 64 64 PRO HG2 H 1 1.733 0.030 . 2 . . . . 64 PRO HG2 . 11340 1 725 . 1 1 64 64 PRO HG3 H 1 1.675 0.030 . 2 . . . . 64 PRO HG3 . 11340 1 726 . 1 1 64 64 PRO C C 13 177.171 0.300 . 1 . . . . 64 PRO C . 11340 1 727 . 1 1 64 64 PRO CA C 13 63.933 0.300 . 1 . . . . 64 PRO CA . 11340 1 728 . 1 1 64 64 PRO CB C 13 31.966 0.300 . 1 . . . . 64 PRO CB . 11340 1 729 . 1 1 64 64 PRO CD C 13 50.619 0.300 . 1 . . . . 64 PRO CD . 11340 1 730 . 1 1 64 64 PRO CG C 13 27.109 0.300 . 1 . . . . 64 PRO CG . 11340 1 731 . 1 1 65 65 VAL H H 1 8.666 0.030 . 1 . . . . 65 VAL H . 11340 1 732 . 1 1 65 65 VAL HA H 1 3.764 0.030 . 1 . . . . 65 VAL HA . 11340 1 733 . 1 1 65 65 VAL HB H 1 1.383 0.030 . 1 . . . . 65 VAL HB . 11340 1 734 . 1 1 65 65 VAL HG11 H 1 0.663 0.030 . 1 . . . . 65 VAL HG1 . 11340 1 735 . 1 1 65 65 VAL HG12 H 1 0.663 0.030 . 1 . . . . 65 VAL HG1 . 11340 1 736 . 1 1 65 65 VAL HG13 H 1 0.663 0.030 . 1 . . . . 65 VAL HG1 . 11340 1 737 . 1 1 65 65 VAL HG21 H 1 0.604 0.030 . 1 . . . . 65 VAL HG2 . 11340 1 738 . 1 1 65 65 VAL HG22 H 1 0.604 0.030 . 1 . . . . 65 VAL HG2 . 11340 1 739 . 1 1 65 65 VAL HG23 H 1 0.604 0.030 . 1 . . . . 65 VAL HG2 . 11340 1 740 . 1 1 65 65 VAL C C 13 176.924 0.300 . 1 . . . . 65 VAL C . 11340 1 741 . 1 1 65 65 VAL CA C 13 65.233 0.300 . 1 . . . . 65 VAL CA . 11340 1 742 . 1 1 65 65 VAL CB C 13 32.318 0.300 . 1 . . . . 65 VAL CB . 11340 1 743 . 1 1 65 65 VAL CG1 C 13 21.452 0.300 . 2 . . . . 65 VAL CG1 . 11340 1 744 . 1 1 65 65 VAL CG2 C 13 21.004 0.300 . 2 . . . . 65 VAL CG2 . 11340 1 745 . 1 1 65 65 VAL N N 15 121.505 0.300 . 1 . . . . 65 VAL N . 11340 1 746 . 1 1 66 66 ASP H H 1 7.364 0.030 . 1 . . . . 66 ASP H . 11340 1 747 . 1 1 66 66 ASP HA H 1 4.875 0.030 . 1 . . . . 66 ASP HA . 11340 1 748 . 1 1 66 66 ASP HB2 H 1 2.645 0.030 . 2 . . . . 66 ASP HB2 . 11340 1 749 . 1 1 66 66 ASP HB3 H 1 3.306 0.030 . 2 . . . . 66 ASP HB3 . 11340 1 750 . 1 1 66 66 ASP C C 13 176.419 0.300 . 1 . . . . 66 ASP C . 11340 1 751 . 1 1 66 66 ASP CA C 13 54.182 0.300 . 1 . . . . 66 ASP CA . 11340 1 752 . 1 1 66 66 ASP CB C 13 43.005 0.300 . 1 . . . . 66 ASP CB . 11340 1 753 . 1 1 66 66 ASP N N 15 114.804 0.300 . 1 . . . . 66 ASP N . 11340 1 754 . 1 1 67 67 ASN H H 1 8.505 0.030 . 1 . . . . 67 ASN H . 11340 1 755 . 1 1 67 67 ASN HA H 1 4.329 0.030 . 1 . . . . 67 ASN HA . 11340 1 756 . 1 1 67 67 ASN HB2 H 1 3.030 0.030 . 1 . . . . 67 ASN HB2 . 11340 1 757 . 1 1 67 67 ASN HB3 H 1 3.030 0.030 . 1 . . . . 67 ASN HB3 . 11340 1 758 . 1 1 67 67 ASN HD21 H 1 6.827 0.030 . 2 . . . . 67 ASN HD21 . 11340 1 759 . 1 1 67 67 ASN HD22 H 1 7.491 0.030 . 2 . . . . 67 ASN HD22 . 11340 1 760 . 1 1 67 67 ASN C C 13 174.327 0.300 . 1 . . . . 67 ASN C . 11340 1 761 . 1 1 67 67 ASN CA C 13 55.609 0.300 . 1 . . . . 67 ASN CA . 11340 1 762 . 1 1 67 67 ASN CB C 13 37.878 0.300 . 1 . . . . 67 ASN CB . 11340 1 763 . 1 1 67 67 ASN N N 15 115.524 0.300 . 1 . . . . 67 ASN N . 11340 1 764 . 1 1 67 67 ASN ND2 N 15 113.617 0.300 . 1 . . . . 67 ASN ND2 . 11340 1 765 . 1 1 68 68 GLU H H 1 8.757 0.030 . 1 . . . . 68 GLU H . 11340 1 766 . 1 1 68 68 GLU HA H 1 4.195 0.030 . 1 . . . . 68 GLU HA . 11340 1 767 . 1 1 68 68 GLU HB2 H 1 2.090 0.030 . 1 . . . . 68 GLU HB2 . 11340 1 768 . 1 1 68 68 GLU HB3 H 1 2.090 0.030 . 1 . . . . 68 GLU HB3 . 11340 1 769 . 1 1 68 68 GLU HG2 H 1 2.309 0.030 . 2 . . . . 68 GLU HG2 . 11340 1 770 . 1 1 68 68 GLU HG3 H 1 2.129 0.030 . 2 . . . . 68 GLU HG3 . 11340 1 771 . 1 1 68 68 GLU C C 13 176.537 0.300 . 1 . . . . 68 GLU C . 11340 1 772 . 1 1 68 68 GLU CA C 13 56.911 0.300 . 1 . . . . 68 GLU CA . 11340 1 773 . 1 1 68 68 GLU CB C 13 29.896 0.300 . 1 . . . . 68 GLU CB . 11340 1 774 . 1 1 68 68 GLU CG C 13 36.619 0.300 . 1 . . . . 68 GLU CG . 11340 1 775 . 1 1 68 68 GLU N N 15 120.717 0.300 . 1 . . . . 68 GLU N . 11340 1 776 . 1 1 69 69 ILE H H 1 8.532 0.030 . 1 . . . . 69 ILE H . 11340 1 777 . 1 1 69 69 ILE HA H 1 4.013 0.030 . 1 . . . . 69 ILE HA . 11340 1 778 . 1 1 69 69 ILE HB H 1 1.811 0.030 . 1 . . . . 69 ILE HB . 11340 1 779 . 1 1 69 69 ILE HD11 H 1 0.945 0.030 . 1 . . . . 69 ILE HD1 . 11340 1 780 . 1 1 69 69 ILE HD12 H 1 0.945 0.030 . 1 . . . . 69 ILE HD1 . 11340 1 781 . 1 1 69 69 ILE HD13 H 1 0.945 0.030 . 1 . . . . 69 ILE HD1 . 11340 1 782 . 1 1 69 69 ILE HG12 H 1 1.305 0.030 . 2 . . . . 69 ILE HG12 . 11340 1 783 . 1 1 69 69 ILE HG13 H 1 1.712 0.030 . 2 . . . . 69 ILE HG13 . 11340 1 784 . 1 1 69 69 ILE HG21 H 1 0.957 0.030 . 1 . . . . 69 ILE HG2 . 11340 1 785 . 1 1 69 69 ILE HG22 H 1 0.957 0.030 . 1 . . . . 69 ILE HG2 . 11340 1 786 . 1 1 69 69 ILE HG23 H 1 0.957 0.030 . 1 . . . . 69 ILE HG2 . 11340 1 787 . 1 1 69 69 ILE C C 13 175.469 0.300 . 1 . . . . 69 ILE C . 11340 1 788 . 1 1 69 69 ILE CA C 13 62.894 0.300 . 1 . . . . 69 ILE CA . 11340 1 789 . 1 1 69 69 ILE CB C 13 37.839 0.300 . 1 . . . . 69 ILE CB . 11340 1 790 . 1 1 69 69 ILE CD1 C 13 12.884 0.300 . 1 . . . . 69 ILE CD1 . 11340 1 791 . 1 1 69 69 ILE CG1 C 13 28.631 0.300 . 1 . . . . 69 ILE CG1 . 11340 1 792 . 1 1 69 69 ILE CG2 C 13 17.385 0.300 . 1 . . . . 69 ILE CG2 . 11340 1 793 . 1 1 69 69 ILE N N 15 122.391 0.300 . 1 . . . . 69 ILE N . 11340 1 794 . 1 1 70 70 LEU H H 1 7.569 0.030 . 1 . . . . 70 LEU H . 11340 1 795 . 1 1 70 70 LEU HA H 1 4.629 0.030 . 1 . . . . 70 LEU HA . 11340 1 796 . 1 1 70 70 LEU HB2 H 1 1.328 0.030 . 2 . . . . 70 LEU HB2 . 11340 1 797 . 1 1 70 70 LEU HB3 H 1 1.241 0.030 . 2 . . . . 70 LEU HB3 . 11340 1 798 . 1 1 70 70 LEU HD11 H 1 0.916 0.030 . 1 . . . . 70 LEU HD1 . 11340 1 799 . 1 1 70 70 LEU HD12 H 1 0.916 0.030 . 1 . . . . 70 LEU HD1 . 11340 1 800 . 1 1 70 70 LEU HD13 H 1 0.916 0.030 . 1 . . . . 70 LEU HD1 . 11340 1 801 . 1 1 70 70 LEU HD21 H 1 0.757 0.030 . 1 . . . . 70 LEU HD2 . 11340 1 802 . 1 1 70 70 LEU HD22 H 1 0.757 0.030 . 1 . . . . 70 LEU HD2 . 11340 1 803 . 1 1 70 70 LEU HD23 H 1 0.757 0.030 . 1 . . . . 70 LEU HD2 . 11340 1 804 . 1 1 70 70 LEU HG H 1 1.356 0.030 . 1 . . . . 70 LEU HG . 11340 1 805 . 1 1 70 70 LEU C C 13 173.202 0.300 . 1 . . . . 70 LEU C . 11340 1 806 . 1 1 70 70 LEU CA C 13 54.009 0.300 . 1 . . . . 70 LEU CA . 11340 1 807 . 1 1 70 70 LEU CB C 13 45.275 0.300 . 1 . . . . 70 LEU CB . 11340 1 808 . 1 1 70 70 LEU CD1 C 13 24.377 0.300 . 2 . . . . 70 LEU CD1 . 11340 1 809 . 1 1 70 70 LEU CD2 C 13 26.027 0.300 . 2 . . . . 70 LEU CD2 . 11340 1 810 . 1 1 70 70 LEU CG C 13 26.870 0.300 . 1 . . . . 70 LEU CG . 11340 1 811 . 1 1 70 70 LEU N N 15 127.778 0.300 . 1 . . . . 70 LEU N . 11340 1 812 . 1 1 71 71 LEU H H 1 8.102 0.030 . 1 . . . . 71 LEU H . 11340 1 813 . 1 1 71 71 LEU HA H 1 4.596 0.030 . 1 . . . . 71 LEU HA . 11340 1 814 . 1 1 71 71 LEU HB2 H 1 1.534 0.030 . 1 . . . . 71 LEU HB2 . 11340 1 815 . 1 1 71 71 LEU HB3 H 1 1.534 0.030 . 1 . . . . 71 LEU HB3 . 11340 1 816 . 1 1 71 71 LEU HD11 H 1 0.845 0.030 . 1 . . . . 71 LEU HD1 . 11340 1 817 . 1 1 71 71 LEU HD12 H 1 0.845 0.030 . 1 . . . . 71 LEU HD1 . 11340 1 818 . 1 1 71 71 LEU HD13 H 1 0.845 0.030 . 1 . . . . 71 LEU HD1 . 11340 1 819 . 1 1 71 71 LEU HD21 H 1 0.738 0.030 . 1 . . . . 71 LEU HD2 . 11340 1 820 . 1 1 71 71 LEU HD22 H 1 0.738 0.030 . 1 . . . . 71 LEU HD2 . 11340 1 821 . 1 1 71 71 LEU HD23 H 1 0.738 0.030 . 1 . . . . 71 LEU HD2 . 11340 1 822 . 1 1 71 71 LEU HG H 1 1.533 0.030 . 1 . . . . 71 LEU HG . 11340 1 823 . 1 1 71 71 LEU C C 13 178.466 0.300 . 1 . . . . 71 LEU C . 11340 1 824 . 1 1 71 71 LEU CA C 13 52.774 0.300 . 1 . . . . 71 LEU CA . 11340 1 825 . 1 1 71 71 LEU CB C 13 43.327 0.300 . 1 . . . . 71 LEU CB . 11340 1 826 . 1 1 71 71 LEU CD1 C 13 25.083 0.300 . 2 . . . . 71 LEU CD1 . 11340 1 827 . 1 1 71 71 LEU CD2 C 13 22.846 0.300 . 2 . . . . 71 LEU CD2 . 11340 1 828 . 1 1 71 71 LEU CG C 13 27.485 0.300 . 1 . . . . 71 LEU CG . 11340 1 829 . 1 1 71 71 LEU N N 15 121.995 0.300 . 1 . . . . 71 LEU N . 11340 1 830 . 1 1 72 72 GLU H H 1 9.185 0.030 . 1 . . . . 72 GLU H . 11340 1 831 . 1 1 72 72 GLU HA H 1 3.690 0.030 . 1 . . . . 72 GLU HA . 11340 1 832 . 1 1 72 72 GLU HB2 H 1 2.018 0.030 . 1 . . . . 72 GLU HB2 . 11340 1 833 . 1 1 72 72 GLU HB3 H 1 2.018 0.030 . 1 . . . . 72 GLU HB3 . 11340 1 834 . 1 1 72 72 GLU HG2 H 1 2.264 0.030 . 1 . . . . 72 GLU HG2 . 11340 1 835 . 1 1 72 72 GLU HG3 H 1 2.264 0.030 . 1 . . . . 72 GLU HG3 . 11340 1 836 . 1 1 72 72 GLU C C 13 177.424 0.300 . 1 . . . . 72 GLU C . 11340 1 837 . 1 1 72 72 GLU CA C 13 60.148 0.300 . 1 . . . . 72 GLU CA . 11340 1 838 . 1 1 72 72 GLU CB C 13 29.521 0.300 . 1 . . . . 72 GLU CB . 11340 1 839 . 1 1 72 72 GLU CG C 13 37.252 0.300 . 1 . . . . 72 GLU CG . 11340 1 840 . 1 1 72 72 GLU N N 15 121.554 0.300 . 1 . . . . 72 GLU N . 11340 1 841 . 1 1 73 73 ASN H H 1 8.169 0.030 . 1 . . . . 73 ASN H . 11340 1 842 . 1 1 73 73 ASN HA H 1 4.526 0.030 . 1 . . . . 73 ASN HA . 11340 1 843 . 1 1 73 73 ASN HB2 H 1 2.692 0.030 . 2 . . . . 73 ASN HB2 . 11340 1 844 . 1 1 73 73 ASN HB3 H 1 3.006 0.030 . 2 . . . . 73 ASN HB3 . 11340 1 845 . 1 1 73 73 ASN HD21 H 1 6.655 0.030 . 2 . . . . 73 ASN HD21 . 11340 1 846 . 1 1 73 73 ASN HD22 H 1 7.508 0.030 . 2 . . . . 73 ASN HD22 . 11340 1 847 . 1 1 73 73 ASN C C 13 175.861 0.300 . 1 . . . . 73 ASN C . 11340 1 848 . 1 1 73 73 ASN CA C 13 53.875 0.300 . 1 . . . . 73 ASN CA . 11340 1 849 . 1 1 73 73 ASN CB C 13 36.993 0.300 . 1 . . . . 73 ASN CB . 11340 1 850 . 1 1 73 73 ASN N N 15 113.216 0.300 . 1 . . . . 73 ASN N . 11340 1 851 . 1 1 73 73 ASN ND2 N 15 110.769 0.300 . 1 . . . . 73 ASN ND2 . 11340 1 852 . 1 1 74 74 GLN H H 1 7.655 0.030 . 1 . . . . 74 GLN H . 11340 1 853 . 1 1 74 74 GLN HA H 1 4.264 0.030 . 1 . . . . 74 GLN HA . 11340 1 854 . 1 1 74 74 GLN HB2 H 1 2.266 0.030 . 2 . . . . 74 GLN HB2 . 11340 1 855 . 1 1 74 74 GLN HB3 H 1 2.174 0.030 . 2 . . . . 74 GLN HB3 . 11340 1 856 . 1 1 74 74 GLN HE21 H 1 6.744 0.030 . 2 . . . . 74 GLN HE21 . 11340 1 857 . 1 1 74 74 GLN HE22 H 1 7.525 0.030 . 2 . . . . 74 GLN HE22 . 11340 1 858 . 1 1 74 74 GLN HG2 H 1 2.332 0.030 . 1 . . . . 74 GLN HG2 . 11340 1 859 . 1 1 74 74 GLN HG3 H 1 2.332 0.030 . 1 . . . . 74 GLN HG3 . 11340 1 860 . 1 1 74 74 GLN C C 13 175.005 0.300 . 1 . . . . 74 GLN C . 11340 1 861 . 1 1 74 74 GLN CA C 13 55.647 0.300 . 1 . . . . 74 GLN CA . 11340 1 862 . 1 1 74 74 GLN CB C 13 29.075 0.300 . 1 . . . . 74 GLN CB . 11340 1 863 . 1 1 74 74 GLN CG C 13 34.539 0.300 . 1 . . . . 74 GLN CG . 11340 1 864 . 1 1 74 74 GLN N N 15 117.932 0.300 . 1 . . . . 74 GLN N . 11340 1 865 . 1 1 74 74 GLN NE2 N 15 111.095 0.300 . 1 . . . . 74 GLN NE2 . 11340 1 866 . 1 1 75 75 LEU H H 1 7.002 0.030 . 1 . . . . 75 LEU H . 11340 1 867 . 1 1 75 75 LEU HA H 1 4.396 0.030 . 1 . . . . 75 LEU HA . 11340 1 868 . 1 1 75 75 LEU HB2 H 1 0.929 0.030 . 2 . . . . 75 LEU HB2 . 11340 1 869 . 1 1 75 75 LEU HB3 H 1 1.696 0.030 . 2 . . . . 75 LEU HB3 . 11340 1 870 . 1 1 75 75 LEU HD11 H 1 0.813 0.030 . 1 . . . . 75 LEU HD1 . 11340 1 871 . 1 1 75 75 LEU HD12 H 1 0.813 0.030 . 1 . . . . 75 LEU HD1 . 11340 1 872 . 1 1 75 75 LEU HD13 H 1 0.813 0.030 . 1 . . . . 75 LEU HD1 . 11340 1 873 . 1 1 75 75 LEU HD21 H 1 0.726 0.030 . 1 . . . . 75 LEU HD2 . 11340 1 874 . 1 1 75 75 LEU HD22 H 1 0.726 0.030 . 1 . . . . 75 LEU HD2 . 11340 1 875 . 1 1 75 75 LEU HD23 H 1 0.726 0.030 . 1 . . . . 75 LEU HD2 . 11340 1 876 . 1 1 75 75 LEU HG H 1 1.673 0.030 . 1 . . . . 75 LEU HG . 11340 1 877 . 1 1 75 75 LEU C C 13 176.347 0.300 . 1 . . . . 75 LEU C . 11340 1 878 . 1 1 75 75 LEU CA C 13 54.363 0.300 . 1 . . . . 75 LEU CA . 11340 1 879 . 1 1 75 75 LEU CB C 13 42.155 0.300 . 1 . . . . 75 LEU CB . 11340 1 880 . 1 1 75 75 LEU CD1 C 13 26.171 0.300 . 2 . . . . 75 LEU CD1 . 11340 1 881 . 1 1 75 75 LEU CD2 C 13 24.080 0.300 . 2 . . . . 75 LEU CD2 . 11340 1 882 . 1 1 75 75 LEU CG C 13 26.258 0.300 . 1 . . . . 75 LEU CG . 11340 1 883 . 1 1 75 75 LEU N N 15 117.730 0.300 . 1 . . . . 75 LEU N . 11340 1 884 . 1 1 76 76 PHE H H 1 8.261 0.030 . 1 . . . . 76 PHE H . 11340 1 885 . 1 1 76 76 PHE HA H 1 5.167 0.030 . 1 . . . . 76 PHE HA . 11340 1 886 . 1 1 76 76 PHE HB2 H 1 2.978 0.030 . 2 . . . . 76 PHE HB2 . 11340 1 887 . 1 1 76 76 PHE HB3 H 1 3.142 0.030 . 2 . . . . 76 PHE HB3 . 11340 1 888 . 1 1 76 76 PHE HD1 H 1 7.261 0.030 . 1 . . . . 76 PHE HD1 . 11340 1 889 . 1 1 76 76 PHE HD2 H 1 7.261 0.030 . 1 . . . . 76 PHE HD2 . 11340 1 890 . 1 1 76 76 PHE HE1 H 1 7.180 0.030 . 1 . . . . 76 PHE HE1 . 11340 1 891 . 1 1 76 76 PHE HE2 H 1 7.180 0.030 . 1 . . . . 76 PHE HE2 . 11340 1 892 . 1 1 76 76 PHE HZ H 1 7.181 0.030 . 1 . . . . 76 PHE HZ . 11340 1 893 . 1 1 76 76 PHE C C 13 173.089 0.300 . 1 . . . . 76 PHE C . 11340 1 894 . 1 1 76 76 PHE CA C 13 54.420 0.300 . 1 . . . . 76 PHE CA . 11340 1 895 . 1 1 76 76 PHE CB C 13 39.435 0.300 . 1 . . . . 76 PHE CB . 11340 1 896 . 1 1 76 76 PHE CD1 C 13 132.743 0.300 . 1 . . . . 76 PHE CD1 . 11340 1 897 . 1 1 76 76 PHE CD2 C 13 132.743 0.300 . 1 . . . . 76 PHE CD2 . 11340 1 898 . 1 1 76 76 PHE CE1 C 13 130.879 0.300 . 1 . . . . 76 PHE CE1 . 11340 1 899 . 1 1 76 76 PHE CE2 C 13 130.879 0.300 . 1 . . . . 76 PHE CE2 . 11340 1 900 . 1 1 76 76 PHE CZ C 13 129.333 0.300 . 1 . . . . 76 PHE CZ . 11340 1 901 . 1 1 76 76 PHE N N 15 120.654 0.300 . 1 . . . . 76 PHE N . 11340 1 902 . 1 1 77 77 PRO HA H 1 4.592 0.030 . 1 . . . . 77 PRO HA . 11340 1 903 . 1 1 77 77 PRO HB2 H 1 1.961 0.030 . 2 . . . . 77 PRO HB2 . 11340 1 904 . 1 1 77 77 PRO HB3 H 1 2.371 0.030 . 2 . . . . 77 PRO HB3 . 11340 1 905 . 1 1 77 77 PRO HD2 H 1 3.795 0.030 . 2 . . . . 77 PRO HD2 . 11340 1 906 . 1 1 77 77 PRO HD3 H 1 3.684 0.030 . 2 . . . . 77 PRO HD3 . 11340 1 907 . 1 1 77 77 PRO HG2 H 1 2.015 0.030 . 2 . . . . 77 PRO HG2 . 11340 1 908 . 1 1 77 77 PRO HG3 H 1 2.076 0.030 . 2 . . . . 77 PRO HG3 . 11340 1 909 . 1 1 77 77 PRO C C 13 176.722 0.300 . 1 . . . . 77 PRO C . 11340 1 910 . 1 1 77 77 PRO CA C 13 63.611 0.300 . 1 . . . . 77 PRO CA . 11340 1 911 . 1 1 77 77 PRO CB C 13 32.331 0.300 . 1 . . . . 77 PRO CB . 11340 1 912 . 1 1 77 77 PRO CD C 13 50.398 0.300 . 1 . . . . 77 PRO CD . 11340 1 913 . 1 1 77 77 PRO CG C 13 27.704 0.300 . 1 . . . . 77 PRO CG . 11340 1 914 . 1 1 78 78 ASP H H 1 8.176 0.030 . 1 . . . . 78 ASP H . 11340 1 915 . 1 1 78 78 ASP HA H 1 4.569 0.030 . 1 . . . . 78 ASP HA . 11340 1 916 . 1 1 78 78 ASP HB2 H 1 2.407 0.030 . 2 . . . . 78 ASP HB2 . 11340 1 917 . 1 1 78 78 ASP HB3 H 1 2.546 0.030 . 2 . . . . 78 ASP HB3 . 11340 1 918 . 1 1 78 78 ASP C C 13 176.115 0.300 . 1 . . . . 78 ASP C . 11340 1 919 . 1 1 78 78 ASP CA C 13 54.580 0.300 . 1 . . . . 78 ASP CA . 11340 1 920 . 1 1 78 78 ASP CB C 13 41.836 0.300 . 1 . . . . 78 ASP CB . 11340 1 921 . 1 1 78 78 ASP N N 15 121.011 0.300 . 1 . . . . 78 ASP N . 11340 1 922 . 1 1 79 79 ASN H H 1 8.295 0.030 . 1 . . . . 79 ASN H . 11340 1 923 . 1 1 79 79 ASN HA H 1 4.635 0.030 . 1 . . . . 79 ASN HA . 11340 1 924 . 1 1 79 79 ASN HB2 H 1 2.733 0.030 . 1 . . . . 79 ASN HB2 . 11340 1 925 . 1 1 79 79 ASN HB3 H 1 2.733 0.030 . 1 . . . . 79 ASN HB3 . 11340 1 926 . 1 1 79 79 ASN HD21 H 1 7.544 0.030 . 2 . . . . 79 ASN HD21 . 11340 1 927 . 1 1 79 79 ASN HD22 H 1 6.851 0.030 . 2 . . . . 79 ASN HD22 . 11340 1 928 . 1 1 79 79 ASN C C 13 175.277 0.300 . 1 . . . . 79 ASN C . 11340 1 929 . 1 1 79 79 ASN CA C 13 53.286 0.300 . 1 . . . . 79 ASN CA . 11340 1 930 . 1 1 79 79 ASN CB C 13 38.721 0.300 . 1 . . . . 79 ASN CB . 11340 1 931 . 1 1 79 79 ASN N N 15 119.550 0.300 . 1 . . . . 79 ASN N . 11340 1 932 . 1 1 79 79 ASN ND2 N 15 112.344 0.300 . 1 . . . . 79 ASN ND2 . 11340 1 933 . 1 1 80 80 PHE H H 1 8.172 0.030 . 1 . . . . 80 PHE H . 11340 1 934 . 1 1 80 80 PHE HA H 1 4.465 0.030 . 1 . . . . 80 PHE HA . 11340 1 935 . 1 1 80 80 PHE HB2 H 1 3.063 0.030 . 2 . . . . 80 PHE HB2 . 11340 1 936 . 1 1 80 80 PHE HB3 H 1 3.142 0.030 . 2 . . . . 80 PHE HB3 . 11340 1 937 . 1 1 80 80 PHE HD1 H 1 7.213 0.030 . 1 . . . . 80 PHE HD1 . 11340 1 938 . 1 1 80 80 PHE HD2 H 1 7.213 0.030 . 1 . . . . 80 PHE HD2 . 11340 1 939 . 1 1 80 80 PHE HE1 H 1 7.300 0.030 . 1 . . . . 80 PHE HE1 . 11340 1 940 . 1 1 80 80 PHE HE2 H 1 7.300 0.030 . 1 . . . . 80 PHE HE2 . 11340 1 941 . 1 1 80 80 PHE HZ H 1 7.250 0.030 . 1 . . . . 80 PHE HZ . 11340 1 942 . 1 1 80 80 PHE C C 13 175.596 0.300 . 1 . . . . 80 PHE C . 11340 1 943 . 1 1 80 80 PHE CA C 13 58.360 0.300 . 1 . . . . 80 PHE CA . 11340 1 944 . 1 1 80 80 PHE CB C 13 39.157 0.300 . 1 . . . . 80 PHE CB . 11340 1 945 . 1 1 80 80 PHE CD1 C 13 131.908 0.300 . 1 . . . . 80 PHE CD1 . 11340 1 946 . 1 1 80 80 PHE CD2 C 13 131.908 0.300 . 1 . . . . 80 PHE CD2 . 11340 1 947 . 1 1 80 80 PHE CE1 C 13 131.355 0.300 . 1 . . . . 80 PHE CE1 . 11340 1 948 . 1 1 80 80 PHE CE2 C 13 131.355 0.300 . 1 . . . . 80 PHE CE2 . 11340 1 949 . 1 1 80 80 PHE CZ C 13 129.735 0.300 . 1 . . . . 80 PHE CZ . 11340 1 950 . 1 1 80 80 PHE N N 15 120.433 0.300 . 1 . . . . 80 PHE N . 11340 1 951 . 1 1 81 81 ALA H H 1 8.020 0.030 . 1 . . . . 81 ALA H . 11340 1 952 . 1 1 81 81 ALA HA H 1 4.217 0.030 . 1 . . . . 81 ALA HA . 11340 1 953 . 1 1 81 81 ALA HB1 H 1 1.313 0.030 . 1 . . . . 81 ALA HB . 11340 1 954 . 1 1 81 81 ALA HB2 H 1 1.313 0.030 . 1 . . . . 81 ALA HB . 11340 1 955 . 1 1 81 81 ALA HB3 H 1 1.313 0.030 . 1 . . . . 81 ALA HB . 11340 1 956 . 1 1 81 81 ALA C C 13 177.324 0.300 . 1 . . . . 81 ALA C . 11340 1 957 . 1 1 81 81 ALA CA C 13 52.512 0.300 . 1 . . . . 81 ALA CA . 11340 1 958 . 1 1 81 81 ALA CB C 13 19.184 0.300 . 1 . . . . 81 ALA CB . 11340 1 959 . 1 1 81 81 ALA N N 15 124.358 0.300 . 1 . . . . 81 ALA N . 11340 1 960 . 1 1 82 82 LYS H H 1 8.059 0.030 . 1 . . . . 82 LYS H . 11340 1 961 . 1 1 82 82 LYS HA H 1 4.229 0.030 . 1 . . . . 82 LYS HA . 11340 1 962 . 1 1 82 82 LYS HB2 H 1 1.810 0.030 . 2 . . . . 82 LYS HB2 . 11340 1 963 . 1 1 82 82 LYS HB3 H 1 1.717 0.030 . 2 . . . . 82 LYS HB3 . 11340 1 964 . 1 1 82 82 LYS HD2 H 1 1.663 0.030 . 1 . . . . 82 LYS HD2 . 11340 1 965 . 1 1 82 82 LYS HD3 H 1 1.663 0.030 . 1 . . . . 82 LYS HD3 . 11340 1 966 . 1 1 82 82 LYS HE2 H 1 2.973 0.030 . 1 . . . . 82 LYS HE2 . 11340 1 967 . 1 1 82 82 LYS HE3 H 1 2.973 0.030 . 1 . . . . 82 LYS HE3 . 11340 1 968 . 1 1 82 82 LYS HG2 H 1 1.418 0.030 . 2 . . . . 82 LYS HG2 . 11340 1 969 . 1 1 82 82 LYS HG3 H 1 1.374 0.030 . 2 . . . . 82 LYS HG3 . 11340 1 970 . 1 1 82 82 LYS C C 13 176.330 0.300 . 1 . . . . 82 LYS C . 11340 1 971 . 1 1 82 82 LYS CA C 13 56.222 0.300 . 1 . . . . 82 LYS CA . 11340 1 972 . 1 1 82 82 LYS CB C 13 32.992 0.300 . 1 . . . . 82 LYS CB . 11340 1 973 . 1 1 82 82 LYS CD C 13 29.113 0.300 . 1 . . . . 82 LYS CD . 11340 1 974 . 1 1 82 82 LYS CE C 13 42.225 0.300 . 1 . . . . 82 LYS CE . 11340 1 975 . 1 1 82 82 LYS CG C 13 24.773 0.300 . 1 . . . . 82 LYS CG . 11340 1 976 . 1 1 82 82 LYS N N 15 120.354 0.300 . 1 . . . . 82 LYS N . 11340 1 977 . 1 1 83 83 ARG H H 1 8.243 0.030 . 1 . . . . 83 ARG H . 11340 1 978 . 1 1 83 83 ARG HA H 1 4.301 0.030 . 1 . . . . 83 ARG HA . 11340 1 979 . 1 1 83 83 ARG HB2 H 1 1.801 0.030 . 2 . . . . 83 ARG HB2 . 11340 1 980 . 1 1 83 83 ARG HB3 H 1 1.723 0.030 . 2 . . . . 83 ARG HB3 . 11340 1 981 . 1 1 83 83 ARG HD2 H 1 3.132 0.030 . 1 . . . . 83 ARG HD2 . 11340 1 982 . 1 1 83 83 ARG HD3 H 1 3.132 0.030 . 1 . . . . 83 ARG HD3 . 11340 1 983 . 1 1 83 83 ARG HG2 H 1 1.581 0.030 . 1 . . . . 83 ARG HG2 . 11340 1 984 . 1 1 83 83 ARG HG3 H 1 1.581 0.030 . 1 . . . . 83 ARG HG3 . 11340 1 985 . 1 1 83 83 ARG C C 13 175.965 0.300 . 1 . . . . 83 ARG C . 11340 1 986 . 1 1 83 83 ARG CA C 13 56.008 0.300 . 1 . . . . 83 ARG CA . 11340 1 987 . 1 1 83 83 ARG CB C 13 30.890 0.300 . 1 . . . . 83 ARG CB . 11340 1 988 . 1 1 83 83 ARG CD C 13 43.381 0.300 . 1 . . . . 83 ARG CD . 11340 1 989 . 1 1 83 83 ARG CG C 13 27.158 0.300 . 1 . . . . 83 ARG CG . 11340 1 990 . 1 1 83 83 ARG N N 15 122.708 0.300 . 1 . . . . 83 ARG N . 11340 1 991 . 1 1 84 84 GLU H H 1 8.459 0.030 . 1 . . . . 84 GLU H . 11340 1 992 . 1 1 84 84 GLU HA H 1 4.276 0.030 . 1 . . . . 84 GLU HA . 11340 1 993 . 1 1 84 84 GLU HB2 H 1 2.016 0.030 . 2 . . . . 84 GLU HB2 . 11340 1 994 . 1 1 84 84 GLU HB3 H 1 1.896 0.030 . 2 . . . . 84 GLU HB3 . 11340 1 995 . 1 1 84 84 GLU HG2 H 1 2.257 0.030 . 1 . . . . 84 GLU HG2 . 11340 1 996 . 1 1 84 84 GLU HG3 H 1 2.257 0.030 . 1 . . . . 84 GLU HG3 . 11340 1 997 . 1 1 84 84 GLU C C 13 175.909 0.300 . 1 . . . . 84 GLU C . 11340 1 998 . 1 1 84 84 GLU CA C 13 56.466 0.300 . 1 . . . . 84 GLU CA . 11340 1 999 . 1 1 84 84 GLU CB C 13 30.449 0.300 . 1 . . . . 84 GLU CB . 11340 1 1000 . 1 1 84 84 GLU CG C 13 36.210 0.300 . 1 . . . . 84 GLU CG . 11340 1 1001 . 1 1 84 84 GLU N N 15 122.641 0.300 . 1 . . . . 84 GLU N . 11340 1 1002 . 1 1 85 85 ILE H H 1 8.206 0.030 . 1 . . . . 85 ILE H . 11340 1 1003 . 1 1 85 85 ILE HA H 1 4.143 0.030 . 1 . . . . 85 ILE HA . 11340 1 1004 . 1 1 85 85 ILE HB H 1 1.851 0.030 . 1 . . . . 85 ILE HB . 11340 1 1005 . 1 1 85 85 ILE HD11 H 1 0.832 0.030 . 1 . . . . 85 ILE HD1 . 11340 1 1006 . 1 1 85 85 ILE HD12 H 1 0.832 0.030 . 1 . . . . 85 ILE HD1 . 11340 1 1007 . 1 1 85 85 ILE HD13 H 1 0.832 0.030 . 1 . . . . 85 ILE HD1 . 11340 1 1008 . 1 1 85 85 ILE HG12 H 1 1.451 0.030 . 2 . . . . 85 ILE HG12 . 11340 1 1009 . 1 1 85 85 ILE HG13 H 1 1.156 0.030 . 2 . . . . 85 ILE HG13 . 11340 1 1010 . 1 1 85 85 ILE HG21 H 1 0.872 0.030 . 1 . . . . 85 ILE HG2 . 11340 1 1011 . 1 1 85 85 ILE HG22 H 1 0.872 0.030 . 1 . . . . 85 ILE HG2 . 11340 1 1012 . 1 1 85 85 ILE HG23 H 1 0.872 0.030 . 1 . . . . 85 ILE HG2 . 11340 1 1013 . 1 1 85 85 ILE C C 13 175.125 0.300 . 1 . . . . 85 ILE C . 11340 1 1014 . 1 1 85 85 ILE CA C 13 61.041 0.300 . 1 . . . . 85 ILE CA . 11340 1 1015 . 1 1 85 85 ILE CB C 13 38.637 0.300 . 1 . . . . 85 ILE CB . 11340 1 1016 . 1 1 85 85 ILE CD1 C 13 12.856 0.300 . 1 . . . . 85 ILE CD1 . 11340 1 1017 . 1 1 85 85 ILE CG1 C 13 27.200 0.300 . 1 . . . . 85 ILE CG1 . 11340 1 1018 . 1 1 85 85 ILE CG2 C 13 17.527 0.300 . 1 . . . . 85 ILE CG2 . 11340 1 1019 . 1 1 85 85 ILE N N 15 122.826 0.300 . 1 . . . . 85 ILE N . 11340 1 1020 . 1 1 86 86 LEU H H 1 7.895 0.030 . 1 . . . . 86 LEU H . 11340 1 1021 . 1 1 86 86 LEU HA H 1 4.202 0.030 . 1 . . . . 86 LEU HA . 11340 1 1022 . 1 1 86 86 LEU HB2 H 1 1.566 0.030 . 1 . . . . 86 LEU HB2 . 11340 1 1023 . 1 1 86 86 LEU HB3 H 1 1.566 0.030 . 1 . . . . 86 LEU HB3 . 11340 1 1024 . 1 1 86 86 LEU HD11 H 1 0.688 0.030 . 1 . . . . 86 LEU HD1 . 11340 1 1025 . 1 1 86 86 LEU HD12 H 1 0.688 0.030 . 1 . . . . 86 LEU HD1 . 11340 1 1026 . 1 1 86 86 LEU HD13 H 1 0.688 0.030 . 1 . . . . 86 LEU HD1 . 11340 1 1027 . 1 1 86 86 LEU HD21 H 1 0.687 0.030 . 1 . . . . 86 LEU HD2 . 11340 1 1028 . 1 1 86 86 LEU HD22 H 1 0.687 0.030 . 1 . . . . 86 LEU HD2 . 11340 1 1029 . 1 1 86 86 LEU HD23 H 1 0.687 0.030 . 1 . . . . 86 LEU HD2 . 11340 1 1030 . 1 1 86 86 LEU HG H 1 1.564 0.030 . 1 . . . . 86 LEU HG . 11340 1 1031 . 1 1 86 86 LEU C C 13 182.312 0.300 . 1 . . . . 86 LEU C . 11340 1 1032 . 1 1 86 86 LEU CA C 13 56.713 0.300 . 1 . . . . 86 LEU CA . 11340 1 1033 . 1 1 86 86 LEU CB C 13 43.479 0.300 . 1 . . . . 86 LEU CB . 11340 1 1034 . 1 1 86 86 LEU CD1 C 13 24.799 0.300 . 2 . . . . 86 LEU CD1 . 11340 1 1035 . 1 1 86 86 LEU CD2 C 13 23.231 0.300 . 2 . . . . 86 LEU CD2 . 11340 1 1036 . 1 1 86 86 LEU CG C 13 27.305 0.300 . 1 . . . . 86 LEU CG . 11340 1 1037 . 1 1 86 86 LEU N N 15 132.545 0.300 . 1 . . . . 86 LEU N . 11340 1 stop_ save_