################################### # 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 15700 _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 2 '3D HNCO' . . . 15700 1 3 '3D CBCA(CO)NH' . . . 15700 1 4 '3D HBHA(CO)NH' . . . 15700 1 5 '3D HNCA' . . . 15700 1 6 '3D C(CO)NH' . . . 15700 1 7 '3D H(CCO)NH' . . . 15700 1 8 '3D HCCH-TOCSY' . . . 15700 1 9 '3D CCH-TOCSY' . . . 15700 1 11 '3D 1H-15N NOESY' . . . 15700 1 12 '3D 1H-13C NOESY' . . . 15700 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $ABACUS . . 15700 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 1 1 MET HA H 1 4.459 0.030 . 1 . . . . . 1 MET HA . 15700 1 2 . 1 1 1 1 MET HB2 H 1 2.133 0.030 . 2 . . . . . 1 MET HB2 . 15700 1 3 . 1 1 1 1 MET HB3 H 1 2.035 0.030 . 2 . . . . . 1 MET HB3 . 15700 1 4 . 1 1 1 1 MET HG2 H 1 2.585 0.030 . 2 . . . . . 1 MET HG2 . 15700 1 5 . 1 1 1 1 MET HG3 H 1 2.643 0.030 . 2 . . . . . 1 MET HG3 . 15700 1 6 . 1 1 1 1 MET C C 13 175.848 0.300 . 1 . . . . . 1 MET C . 15700 1 7 . 1 1 1 1 MET CA C 13 55.287 0.400 . 1 . . . . . 1 MET CA . 15700 1 8 . 1 1 1 1 MET CB C 13 32.767 0.400 . 1 . . . . . 1 MET CB . 15700 1 9 . 1 1 1 1 MET CG C 13 32.303 0.400 . 1 . . . . . 1 MET CG . 15700 1 10 . 1 1 2 2 ALA H H 1 8.220 0.030 . 1 . . . . . 2 ALA H . 15700 1 11 . 1 1 2 2 ALA HA H 1 4.321 0.030 . 1 . . . . . 2 ALA HA . 15700 1 12 . 1 1 2 2 ALA HB1 H 1 1.420 0.030 . 1 . . . . . 2 ALA HB . 15700 1 13 . 1 1 2 2 ALA HB2 H 1 1.420 0.030 . 1 . . . . . 2 ALA HB . 15700 1 14 . 1 1 2 2 ALA HB3 H 1 1.420 0.030 . 1 . . . . . 2 ALA HB . 15700 1 15 . 1 1 2 2 ALA C C 13 177.564 0.300 . 1 . . . . . 2 ALA C . 15700 1 16 . 1 1 2 2 ALA CA C 13 52.383 0.400 . 1 . . . . . 2 ALA CA . 15700 1 17 . 1 1 2 2 ALA CB C 13 19.290 0.400 . 1 . . . . . 2 ALA CB . 15700 1 18 . 1 1 2 2 ALA N N 15 125.223 0.400 . 1 . . . . . 2 ALA N . 15700 1 19 . 1 1 3 3 ALA H H 1 8.246 0.030 . 1 . . . . . 3 ALA H . 15700 1 20 . 1 1 3 3 ALA N N 15 123.250 0.400 . 1 . . . . . 3 ALA N . 15700 1 21 . 1 1 5 5 ALA HA H 1 4.415 0.030 . 1 . . . . . 5 ALA HA . 15700 1 22 . 1 1 5 5 ALA HB1 H 1 1.434 0.030 . 1 . . . . . 5 ALA HB . 15700 1 23 . 1 1 5 5 ALA HB2 H 1 1.434 0.030 . 1 . . . . . 5 ALA HB . 15700 1 24 . 1 1 5 5 ALA HB3 H 1 1.434 0.030 . 1 . . . . . 5 ALA HB . 15700 1 25 . 1 1 5 5 ALA C C 13 177.481 0.300 . 1 . . . . . 5 ALA C . 15700 1 26 . 1 1 5 5 ALA CA C 13 52.423 0.400 . 1 . . . . . 5 ALA CA . 15700 1 27 . 1 1 5 5 ALA CB C 13 19.420 0.400 . 1 . . . . . 5 ALA CB . 15700 1 28 . 1 1 6 6 ARG H H 1 8.239 0.030 . 1 . . . . . 6 ARG H . 15700 1 29 . 1 1 6 6 ARG HA H 1 4.371 0.030 . 1 . . . . . 6 ARG HA . 15700 1 30 . 1 1 6 6 ARG HB2 H 1 1.910 0.030 . 2 . . . . . 6 ARG HB2 . 15700 1 31 . 1 1 6 6 ARG HB3 H 1 1.810 0.030 . 2 . . . . . 6 ARG HB3 . 15700 1 32 . 1 1 6 6 ARG HD2 H 1 3.255 0.030 . 2 . . . . . 6 ARG HD2 . 15700 1 33 . 1 1 6 6 ARG HD3 H 1 3.255 0.030 . 2 . . . . . 6 ARG HD3 . 15700 1 34 . 1 1 6 6 ARG HG2 H 1 1.678 0.030 . 2 . . . . . 6 ARG HG2 . 15700 1 35 . 1 1 6 6 ARG HG3 H 1 1.678 0.030 . 2 . . . . . 6 ARG HG3 . 15700 1 36 . 1 1 6 6 ARG C C 13 176.180 0.300 . 1 . . . . . 6 ARG C . 15700 1 37 . 1 1 6 6 ARG CA C 13 56.353 0.400 . 1 . . . . . 6 ARG CA . 15700 1 38 . 1 1 6 6 ARG CB C 13 31.170 0.400 . 1 . . . . . 6 ARG CB . 15700 1 39 . 1 1 6 6 ARG CD C 13 43.320 0.400 . 1 . . . . . 6 ARG CD . 15700 1 40 . 1 1 6 6 ARG CG C 13 27.170 0.400 . 1 . . . . . 6 ARG CG . 15700 1 41 . 1 1 6 6 ARG N N 15 120.436 0.400 . 1 . . . . . 6 ARG N . 15700 1 42 . 1 1 7 7 GLU H H 1 8.535 0.030 . 1 . . . . . 7 GLU H . 15700 1 43 . 1 1 7 7 GLU HA H 1 4.335 0.030 . 1 . . . . . 7 GLU HA . 15700 1 44 . 1 1 7 7 GLU HB2 H 1 2.109 0.030 . 2 . . . . . 7 GLU HB2 . 15700 1 45 . 1 1 7 7 GLU HB3 H 1 1.968 0.030 . 2 . . . . . 7 GLU HB3 . 15700 1 46 . 1 1 7 7 GLU HG2 H 1 2.294 0.030 . 2 . . . . . 7 GLU HG2 . 15700 1 47 . 1 1 7 7 GLU HG3 H 1 2.294 0.030 . 2 . . . . . 7 GLU HG3 . 15700 1 48 . 1 1 7 7 GLU C C 13 176.346 0.300 . 1 . . . . . 7 GLU C . 15700 1 49 . 1 1 7 7 GLU CA C 13 56.740 0.400 . 1 . . . . . 7 GLU CA . 15700 1 50 . 1 1 7 7 GLU CB C 13 30.390 0.400 . 1 . . . . . 7 GLU CB . 15700 1 51 . 1 1 7 7 GLU CG C 13 36.653 0.400 . 1 . . . . . 7 GLU CG . 15700 1 52 . 1 1 7 7 GLU N N 15 122.189 0.400 . 1 . . . . . 7 GLU N . 15700 1 53 . 1 1 8 8 ASP H H 1 8.347 0.030 . 1 . . . . . 8 ASP H . 15700 1 54 . 1 1 8 8 ASP N N 15 121.112 0.400 . 1 . . . . . 8 ASP N . 15700 1 55 . 1 1 9 9 GLY HA2 H 1 3.975 0.030 . 2 . . . . . 9 GLY HA2 . 15700 1 56 . 1 1 9 9 GLY HA3 H 1 3.975 0.030 . 2 . . . . . 9 GLY HA3 . 15700 1 57 . 1 1 9 9 GLY C C 13 174.243 0.300 . 1 . . . . . 9 GLY C . 15700 1 58 . 1 1 9 9 GLY CA C 13 45.933 0.400 . 1 . . . . . 9 GLY CA . 15700 1 59 . 1 1 10 10 ALA H H 1 8.111 0.030 . 1 . . . . . 10 ALA H . 15700 1 60 . 1 1 10 10 ALA N N 15 123.721 0.400 . 1 . . . . . 10 ALA N . 15700 1 61 . 1 1 12 12 GLY HA2 H 1 3.992 0.030 . 2 . . . . . 12 GLY HA2 . 15700 1 62 . 1 1 12 12 GLY HA3 H 1 3.992 0.030 . 2 . . . . . 12 GLY HA3 . 15700 1 63 . 1 1 12 12 GLY C C 13 173.883 0.300 . 1 . . . . . 12 GLY C . 15700 1 64 . 1 1 12 12 GLY CA C 13 45.381 0.400 . 1 . . . . . 12 GLY CA . 15700 1 65 . 1 1 13 13 GLU H H 1 8.224 0.030 . 1 . . . . . 13 GLU H . 15700 1 66 . 1 1 13 13 GLU HA H 1 4.367 0.030 . 1 . . . . . 13 GLU HA . 15700 1 67 . 1 1 13 13 GLU HB2 H 1 2.123 0.030 . 2 . . . . . 13 GLU HB2 . 15700 1 68 . 1 1 13 13 GLU HB3 H 1 2.009 0.030 . 2 . . . . . 13 GLU HB3 . 15700 1 69 . 1 1 13 13 GLU HG2 H 1 2.364 0.030 . 2 . . . . . 13 GLU HG2 . 15700 1 70 . 1 1 13 13 GLU HG3 H 1 2.364 0.030 . 2 . . . . . 13 GLU HG3 . 15700 1 71 . 1 1 13 13 GLU C C 13 176.125 0.300 . 1 . . . . . 13 GLU C . 15700 1 72 . 1 1 13 13 GLU CA C 13 56.349 0.400 . 1 . . . . . 13 GLU CA . 15700 1 73 . 1 1 13 13 GLU CB C 13 29.560 0.400 . 1 . . . . . 13 GLU CB . 15700 1 74 . 1 1 13 13 GLU CG C 13 34.040 0.400 . 1 . . . . . 13 GLU CG . 15700 1 75 . 1 1 13 13 GLU N N 15 120.148 0.400 . 1 . . . . . 13 GLU N . 15700 1 76 . 1 1 14 14 GLU H H 1 8.508 0.030 . 1 . . . . . 14 GLU H . 15700 1 77 . 1 1 14 14 GLU HA H 1 4.302 0.030 . 1 . . . . . 14 GLU HA . 15700 1 78 . 1 1 14 14 GLU HB2 H 1 2.085 0.030 . 2 . . . . . 14 GLU HB2 . 15700 1 79 . 1 1 14 14 GLU HB3 H 1 1.995 0.030 . 2 . . . . . 14 GLU HB3 . 15700 1 80 . 1 1 14 14 GLU HG2 H 1 2.293 0.030 . 2 . . . . . 14 GLU HG2 . 15700 1 81 . 1 1 14 14 GLU HG3 H 1 2.293 0.030 . 2 . . . . . 14 GLU HG3 . 15700 1 82 . 1 1 14 14 GLU C C 13 176.623 0.300 . 1 . . . . . 14 GLU C . 15700 1 83 . 1 1 14 14 GLU CA C 13 56.497 0.400 . 1 . . . . . 14 GLU CA . 15700 1 84 . 1 1 14 14 GLU CB C 13 30.110 0.400 . 1 . . . . . 14 GLU CB . 15700 1 85 . 1 1 14 14 GLU CG C 13 36.370 0.400 . 1 . . . . . 14 GLU CG . 15700 1 86 . 1 1 14 14 GLU N N 15 122.160 0.400 . 1 . . . . . 14 GLU N . 15700 1 87 . 1 1 15 15 ARG H H 1 8.356 0.030 . 1 . . . . . 15 ARG H . 15700 1 88 . 1 1 15 15 ARG HA H 1 4.366 0.030 . 1 . . . . . 15 ARG HA . 15700 1 89 . 1 1 15 15 ARG HB2 H 1 1.917 0.030 . 2 . . . . . 15 ARG HB2 . 15700 1 90 . 1 1 15 15 ARG HB3 H 1 1.812 0.030 . 2 . . . . . 15 ARG HB3 . 15700 1 91 . 1 1 15 15 ARG HD2 H 1 3.234 0.030 . 2 . . . . . 15 ARG HD2 . 15700 1 92 . 1 1 15 15 ARG HD3 H 1 3.234 0.030 . 2 . . . . . 15 ARG HD3 . 15700 1 93 . 1 1 15 15 ARG HG2 H 1 1.679 0.030 . 2 . . . . . 15 ARG HG2 . 15700 1 94 . 1 1 15 15 ARG HG3 H 1 1.679 0.030 . 2 . . . . . 15 ARG HG3 . 15700 1 95 . 1 1 15 15 ARG C C 13 176.844 0.300 . 1 . . . . . 15 ARG C . 15700 1 96 . 1 1 15 15 ARG CA C 13 56.010 0.400 . 1 . . . . . 15 ARG CA . 15700 1 97 . 1 1 15 15 ARG CB C 13 30.890 0.400 . 1 . . . . . 15 ARG CB . 15700 1 98 . 1 1 15 15 ARG CD C 13 43.563 0.400 . 1 . . . . . 15 ARG CD . 15700 1 99 . 1 1 15 15 ARG CG C 13 26.980 0.400 . 1 . . . . . 15 ARG CG . 15700 1 100 . 1 1 15 15 ARG N N 15 121.945 0.400 . 1 . . . . . 15 ARG N . 15700 1 101 . 1 1 16 16 GLY H H 1 8.414 0.030 . 1 . . . . . 16 GLY H . 15700 1 102 . 1 1 16 16 GLY HA2 H 1 4.022 0.030 . 2 . . . . . 16 GLY HA2 . 15700 1 103 . 1 1 16 16 GLY HA3 H 1 4.022 0.030 . 2 . . . . . 16 GLY HA3 . 15700 1 104 . 1 1 16 16 GLY C C 13 174.326 0.300 . 1 . . . . . 16 GLY C . 15700 1 105 . 1 1 16 16 GLY CA C 13 45.620 0.400 . 1 . . . . . 16 GLY CA . 15700 1 106 . 1 1 16 16 GLY N N 15 109.734 0.400 . 1 . . . . . 16 GLY N . 15700 1 107 . 1 1 17 17 GLN H H 1 8.184 0.030 . 1 . . . . . 17 GLN H . 15700 1 108 . 1 1 17 17 GLN HA H 1 4.366 0.030 . 1 . . . . . 17 GLN HA . 15700 1 109 . 1 1 17 17 GLN HB2 H 1 2.128 0.030 . 2 . . . . . 17 GLN HB2 . 15700 1 110 . 1 1 17 17 GLN HB3 H 1 2.005 0.030 . 2 . . . . . 17 GLN HB3 . 15700 1 111 . 1 1 17 17 GLN HG2 H 1 2.364 0.030 . 2 . . . . . 17 GLN HG2 . 15700 1 112 . 1 1 17 17 GLN HG3 H 1 2.364 0.030 . 2 . . . . . 17 GLN HG3 . 15700 1 113 . 1 1 17 17 GLN C C 13 175.544 0.300 . 1 . . . . . 17 GLN C . 15700 1 114 . 1 1 17 17 GLN CA C 13 55.749 0.400 . 1 . . . . . 17 GLN CA . 15700 1 115 . 1 1 17 17 GLN CB C 13 29.367 0.400 . 1 . . . . . 17 GLN CB . 15700 1 116 . 1 1 17 17 GLN CG C 13 33.464 0.400 . 1 . . . . . 17 GLN CG . 15700 1 117 . 1 1 17 17 GLN N N 15 119.546 0.400 . 1 . . . . . 17 GLN N . 15700 1 118 . 1 1 18 18 ARG H H 1 8.366 0.030 . 1 . . . . . 18 ARG H . 15700 1 119 . 1 1 18 18 ARG HA H 1 4.487 0.030 . 1 . . . . . 18 ARG HA . 15700 1 120 . 1 1 18 18 ARG HB2 H 1 1.950 0.030 . 2 . . . . . 18 ARG HB2 . 15700 1 121 . 1 1 18 18 ARG HB3 H 1 1.794 0.030 . 2 . . . . . 18 ARG HB3 . 15700 1 122 . 1 1 18 18 ARG HD2 H 1 3.228 0.030 . 2 . . . . . 18 ARG HD2 . 15700 1 123 . 1 1 18 18 ARG HD3 H 1 3.228 0.030 . 2 . . . . . 18 ARG HD3 . 15700 1 124 . 1 1 18 18 ARG HG2 H 1 1.648 0.030 . 2 . . . . . 18 ARG HG2 . 15700 1 125 . 1 1 18 18 ARG HG3 H 1 1.648 0.030 . 2 . . . . . 18 ARG HG3 . 15700 1 126 . 1 1 18 18 ARG C C 13 176.042 0.300 . 1 . . . . . 18 ARG C . 15700 1 127 . 1 1 18 18 ARG CA C 13 55.735 0.400 . 1 . . . . . 18 ARG CA . 15700 1 128 . 1 1 18 18 ARG CB C 13 31.170 0.400 . 1 . . . . . 18 ARG CB . 15700 1 129 . 1 1 18 18 ARG CD C 13 43.570 0.400 . 1 . . . . . 18 ARG CD . 15700 1 130 . 1 1 18 18 ARG CG C 13 26.937 0.400 . 1 . . . . . 18 ARG CG . 15700 1 131 . 1 1 18 18 ARG N N 15 122.330 0.400 . 1 . . . . . 18 ARG N . 15700 1 132 . 1 1 19 19 GLY H H 1 8.192 0.030 . 1 . . . . . 19 GLY H . 15700 1 133 . 1 1 19 19 GLY HA2 H 1 4.852 0.030 . 2 . . . . . 19 GLY HA2 . 15700 1 134 . 1 1 19 19 GLY HA3 H 1 3.894 0.030 . 2 . . . . . 19 GLY HA3 . 15700 1 135 . 1 1 19 19 GLY C C 13 172.361 0.300 . 1 . . . . . 19 GLY C . 15700 1 136 . 1 1 19 19 GLY CA C 13 45.580 0.400 . 1 . . . . . 19 GLY CA . 15700 1 137 . 1 1 19 19 GLY N N 15 109.658 0.400 . 1 . . . . . 19 GLY N . 15700 1 138 . 1 1 20 20 CYS H H 1 8.843 0.030 . 1 . . . . . 20 CYS H . 15700 1 139 . 1 1 20 20 CYS HA H 1 5.147 0.030 . 1 . . . . . 20 CYS HA . 15700 1 140 . 1 1 20 20 CYS HB2 H 1 3.303 0.030 . 2 . . . . . 20 CYS HB2 . 15700 1 141 . 1 1 20 20 CYS HB3 H 1 3.013 0.030 . 2 . . . . . 20 CYS HB3 . 15700 1 142 . 1 1 20 20 CYS C C 13 175.211 0.300 . 1 . . . . . 20 CYS C . 15700 1 143 . 1 1 20 20 CYS CA C 13 56.712 0.400 . 1 . . . . . 20 CYS CA . 15700 1 144 . 1 1 20 20 CYS CB C 13 33.530 0.400 . 1 . . . . . 20 CYS CB . 15700 1 145 . 1 1 20 20 CYS N N 15 120.185 0.400 . 1 . . . . . 20 CYS N . 15700 1 146 . 1 1 21 21 GLU H H 1 8.981 0.030 . 1 . . . . . 21 GLU H . 15700 1 147 . 1 1 21 21 GLU HA H 1 4.100 0.030 . 1 . . . . . 21 GLU HA . 15700 1 148 . 1 1 21 21 GLU HB2 H 1 1.776 0.030 . 2 . . . . . 21 GLU HB2 . 15700 1 149 . 1 1 21 21 GLU HB3 H 1 1.710 0.030 . 2 . . . . . 21 GLU HB3 . 15700 1 150 . 1 1 21 21 GLU HG2 H 1 1.465 0.030 . 2 . . . . . 21 GLU HG2 . 15700 1 151 . 1 1 21 21 GLU HG3 H 1 1.465 0.030 . 2 . . . . . 21 GLU HG3 . 15700 1 152 . 1 1 21 21 GLU C C 13 176.014 0.300 . 1 . . . . . 21 GLU C . 15700 1 153 . 1 1 21 21 GLU CA C 13 57.134 0.400 . 1 . . . . . 21 GLU CA . 15700 1 154 . 1 1 21 21 GLU CB C 13 28.890 0.400 . 1 . . . . . 21 GLU CB . 15700 1 155 . 1 1 21 21 GLU CG C 13 34.470 0.400 . 1 . . . . . 21 GLU CG . 15700 1 156 . 1 1 21 21 GLU N N 15 116.078 0.400 . 1 . . . . . 21 GLU N . 15700 1 157 . 1 1 22 22 HIS H H 1 9.342 0.030 . 1 . . . . . 22 HIS H . 15700 1 158 . 1 1 22 22 HIS HA H 1 4.210 0.030 . 1 . . . . . 22 HIS HA . 15700 1 159 . 1 1 22 22 HIS HB2 H 1 3.656 0.030 . 2 . . . . . 22 HIS HB2 . 15700 1 160 . 1 1 22 22 HIS HB3 H 1 2.678 0.030 . 2 . . . . . 22 HIS HB3 . 15700 1 161 . 1 1 22 22 HIS C C 13 175.128 0.300 . 1 . . . . . 22 HIS C . 15700 1 162 . 1 1 22 22 HIS CA C 13 58.945 0.400 . 1 . . . . . 22 HIS CA . 15700 1 163 . 1 1 22 22 HIS CB C 13 33.160 0.400 . 1 . . . . . 22 HIS CB . 15700 1 164 . 1 1 22 22 HIS N N 15 122.296 0.400 . 1 . . . . . 22 HIS N . 15700 1 165 . 1 1 23 23 TYR H H 1 7.931 0.030 . 1 . . . . . 23 TYR H . 15700 1 166 . 1 1 23 23 TYR HA H 1 4.856 0.030 . 1 . . . . . 23 TYR HA . 15700 1 167 . 1 1 23 23 TYR HB2 H 1 3.456 0.030 . 2 . . . . . 23 TYR HB2 . 15700 1 168 . 1 1 23 23 TYR HB3 H 1 2.687 0.030 . 2 . . . . . 23 TYR HB3 . 15700 1 169 . 1 1 23 23 TYR HE1 H 1 7.020 0.030 . 1 . . . . . 23 TYR HE1 . 15700 1 170 . 1 1 23 23 TYR HE2 H 1 7.020 0.030 . 1 . . . . . 23 TYR HE2 . 15700 1 171 . 1 1 23 23 TYR C C 13 173.108 0.300 . 1 . . . . . 23 TYR C . 15700 1 172 . 1 1 23 23 TYR CA C 13 57.852 0.400 . 1 . . . . . 23 TYR CA . 15700 1 173 . 1 1 23 23 TYR CB C 13 45.300 0.400 . 1 . . . . . 23 TYR CB . 15700 1 174 . 1 1 23 23 TYR CE1 C 13 119.218 0.400 . 1 . . . . . 23 TYR CE1 . 15700 1 175 . 1 1 23 23 TYR N N 15 115.205 0.400 . 1 . . . . . 23 TYR N . 15700 1 176 . 1 1 24 24 ASP H H 1 8.384 0.030 . 1 . . . . . 24 ASP H . 15700 1 177 . 1 1 24 24 ASP HA H 1 5.160 0.030 . 1 . . . . . 24 ASP HA . 15700 1 178 . 1 1 24 24 ASP HB2 H 1 3.050 0.030 . 2 . . . . . 24 ASP HB2 . 15700 1 179 . 1 1 24 24 ASP HB3 H 1 2.733 0.030 . 2 . . . . . 24 ASP HB3 . 15700 1 180 . 1 1 24 24 ASP C C 13 174.437 0.300 . 1 . . . . . 24 ASP C . 15700 1 181 . 1 1 24 24 ASP CA C 13 53.343 0.400 . 1 . . . . . 24 ASP CA . 15700 1 182 . 1 1 24 24 ASP CB C 13 41.470 0.400 . 1 . . . . . 24 ASP CB . 15700 1 183 . 1 1 24 24 ASP N N 15 122.016 0.400 . 1 . . . . . 24 ASP N . 15700 1 184 . 1 1 25 25 ARG H H 1 7.313 0.030 . 1 . . . . . 25 ARG H . 15700 1 185 . 1 1 25 25 ARG HA H 1 5.331 0.030 . 1 . . . . . 25 ARG HA . 15700 1 186 . 1 1 25 25 ARG HB2 H 1 2.287 0.030 . 2 . . . . . 25 ARG HB2 . 15700 1 187 . 1 1 25 25 ARG HB3 H 1 1.917 0.030 . 2 . . . . . 25 ARG HB3 . 15700 1 188 . 1 1 25 25 ARG HD2 H 1 3.058 0.030 . 2 . . . . . 25 ARG HD2 . 15700 1 189 . 1 1 25 25 ARG HD3 H 1 3.058 0.030 . 2 . . . . . 25 ARG HD3 . 15700 1 190 . 1 1 25 25 ARG HG2 H 1 1.774 0.030 . 2 . . . . . 25 ARG HG2 . 15700 1 191 . 1 1 25 25 ARG HG3 H 1 1.774 0.030 . 2 . . . . . 25 ARG HG3 . 15700 1 192 . 1 1 25 25 ARG C C 13 175.045 0.300 . 1 . . . . . 25 ARG C . 15700 1 193 . 1 1 25 25 ARG CA C 13 54.224 0.400 . 1 . . . . . 25 ARG CA . 15700 1 194 . 1 1 25 25 ARG CB C 13 34.090 0.400 . 1 . . . . . 25 ARG CB . 15700 1 195 . 1 1 25 25 ARG CD C 13 44.630 0.400 . 1 . . . . . 25 ARG CD . 15700 1 196 . 1 1 25 25 ARG CG C 13 23.330 0.400 . 1 . . . . . 25 ARG CG . 15700 1 197 . 1 1 25 25 ARG N N 15 115.898 0.400 . 1 . . . . . 25 ARG N . 15700 1 198 . 1 1 26 26 GLY H H 1 9.387 0.030 . 1 . . . . . 26 GLY H . 15700 1 199 . 1 1 26 26 GLY HA2 H 1 4.622 0.030 . 2 . . . . . 26 GLY HA2 . 15700 1 200 . 1 1 26 26 GLY HA3 H 1 3.788 0.030 . 2 . . . . . 26 GLY HA3 . 15700 1 201 . 1 1 26 26 GLY C C 13 170.978 0.300 . 1 . . . . . 26 GLY C . 15700 1 202 . 1 1 26 26 GLY CA C 13 44.794 0.400 . 1 . . . . . 26 GLY CA . 15700 1 203 . 1 1 26 26 GLY N N 15 105.653 0.400 . 1 . . . . . 26 GLY N . 15700 1 204 . 1 1 27 27 CYS H H 1 6.864 0.030 . 1 . . . . . 27 CYS H . 15700 1 205 . 1 1 27 27 CYS HA H 1 5.195 0.030 . 1 . . . . . 27 CYS HA . 15700 1 206 . 1 1 27 27 CYS HB2 H 1 1.860 0.030 . 2 . . . . . 27 CYS HB2 . 15700 1 207 . 1 1 27 27 CYS HB3 H 1 1.860 0.030 . 2 . . . . . 27 CYS HB3 . 15700 1 208 . 1 1 27 27 CYS C C 13 171.144 0.300 . 1 . . . . . 27 CYS C . 15700 1 209 . 1 1 27 27 CYS CA C 13 52.349 0.400 . 1 . . . . . 27 CYS CA . 15700 1 210 . 1 1 27 27 CYS CB C 13 30.997 0.400 . 1 . . . . . 27 CYS CB . 15700 1 211 . 1 1 27 27 CYS N N 15 110.921 0.400 . 1 . . . . . 27 CYS N . 15700 1 212 . 1 1 28 28 LEU H H 1 8.310 0.030 . 1 . . . . . 28 LEU H . 15700 1 213 . 1 1 28 28 LEU HA H 1 4.651 0.030 . 1 . . . . . 28 LEU HA . 15700 1 214 . 1 1 28 28 LEU HB2 H 1 1.341 0.030 . 2 . . . . . 28 LEU HB2 . 15700 1 215 . 1 1 28 28 LEU HB3 H 1 1.111 0.030 . 2 . . . . . 28 LEU HB3 . 15700 1 216 . 1 1 28 28 LEU HD11 H 1 0.786 0.030 . 2 . . . . . 28 LEU HD1 . 15700 1 217 . 1 1 28 28 LEU HD12 H 1 0.786 0.030 . 2 . . . . . 28 LEU HD1 . 15700 1 218 . 1 1 28 28 LEU HD13 H 1 0.786 0.030 . 2 . . . . . 28 LEU HD1 . 15700 1 219 . 1 1 28 28 LEU HD21 H 1 0.727 0.030 . 2 . . . . . 28 LEU HD2 . 15700 1 220 . 1 1 28 28 LEU HD22 H 1 0.727 0.030 . 2 . . . . . 28 LEU HD2 . 15700 1 221 . 1 1 28 28 LEU HD23 H 1 0.727 0.030 . 2 . . . . . 28 LEU HD2 . 15700 1 222 . 1 1 28 28 LEU HG H 1 1.501 0.030 . 1 . . . . . 28 LEU HG . 15700 1 223 . 1 1 28 28 LEU C C 13 176.827 0.300 . 1 . . . . . 28 LEU C . 15700 1 224 . 1 1 28 28 LEU CA C 13 53.054 0.400 . 1 . . . . . 28 LEU CA . 15700 1 225 . 1 1 28 28 LEU CB C 13 44.200 0.400 . 1 . . . . . 28 LEU CB . 15700 1 226 . 1 1 28 28 LEU CD1 C 13 25.880 0.400 . 1 . . . . . 28 LEU CD1 . 15700 1 227 . 1 1 28 28 LEU CD2 C 13 24.770 0.400 . 1 . . . . . 28 LEU CD2 . 15700 1 228 . 1 1 28 28 LEU CG C 13 27.710 0.400 . 1 . . . . . 28 LEU CG . 15700 1 229 . 1 1 28 28 LEU N N 15 115.519 0.400 . 1 . . . . . 28 LEU N . 15700 1 230 . 1 1 29 29 LEU H H 1 8.800 0.030 . 1 . . . . . 29 LEU H . 15700 1 231 . 1 1 29 29 LEU HA H 1 4.313 0.030 . 1 . . . . . 29 LEU HA . 15700 1 232 . 1 1 29 29 LEU HB2 H 1 1.834 0.030 . 2 . . . . . 29 LEU HB2 . 15700 1 233 . 1 1 29 29 LEU HB3 H 1 1.258 0.030 . 2 . . . . . 29 LEU HB3 . 15700 1 234 . 1 1 29 29 LEU HD11 H 1 1.008 0.030 . 2 . . . . . 29 LEU HD1 . 15700 1 235 . 1 1 29 29 LEU HD12 H 1 1.008 0.030 . 2 . . . . . 29 LEU HD1 . 15700 1 236 . 1 1 29 29 LEU HD13 H 1 1.008 0.030 . 2 . . . . . 29 LEU HD1 . 15700 1 237 . 1 1 29 29 LEU HD21 H 1 0.973 0.030 . 2 . . . . . 29 LEU HD2 . 15700 1 238 . 1 1 29 29 LEU HD22 H 1 0.973 0.030 . 2 . . . . . 29 LEU HD2 . 15700 1 239 . 1 1 29 29 LEU HD23 H 1 0.973 0.030 . 2 . . . . . 29 LEU HD2 . 15700 1 240 . 1 1 29 29 LEU C C 13 175.571 0.300 . 1 . . . . . 29 LEU C . 15700 1 241 . 1 1 29 29 LEU CA C 13 54.388 0.400 . 1 . . . . . 29 LEU CA . 15700 1 242 . 1 1 29 29 LEU CB C 13 42.780 0.400 . 1 . . . . . 29 LEU CB . 15700 1 243 . 1 1 29 29 LEU CD1 C 13 26.424 0.400 . 1 . . . . . 29 LEU CD1 . 15700 1 244 . 1 1 29 29 LEU CD2 C 13 22.527 0.400 . 1 . . . . . 29 LEU CD2 . 15700 1 245 . 1 1 29 29 LEU N N 15 118.712 0.400 . 1 . . . . . 29 LEU N . 15700 1 246 . 1 1 30 30 LYS H H 1 8.009 0.030 . 1 . . . . . 30 LYS H . 15700 1 247 . 1 1 30 30 LYS HA H 1 4.592 0.030 . 1 . . . . . 30 LYS HA . 15700 1 248 . 1 1 30 30 LYS HB2 H 1 1.980 0.030 . 2 . . . . . 30 LYS HB2 . 15700 1 249 . 1 1 30 30 LYS HB3 H 1 0.982 0.030 . 2 . . . . . 30 LYS HB3 . 15700 1 250 . 1 1 30 30 LYS HD2 H 1 1.568 0.030 . 2 . . . . . 30 LYS HD2 . 15700 1 251 . 1 1 30 30 LYS HD3 H 1 1.440 0.030 . 2 . . . . . 30 LYS HD3 . 15700 1 252 . 1 1 30 30 LYS HE2 H 1 2.831 0.030 . 2 . . . . . 30 LYS HE2 . 15700 1 253 . 1 1 30 30 LYS HE3 H 1 2.776 0.030 . 2 . . . . . 30 LYS HE3 . 15700 1 254 . 1 1 30 30 LYS HG2 H 1 1.148 0.030 . 2 . . . . . 30 LYS HG2 . 15700 1 255 . 1 1 30 30 LYS HG3 H 1 0.960 0.030 . 2 . . . . . 30 LYS HG3 . 15700 1 256 . 1 1 30 30 LYS C C 13 174.990 0.300 . 1 . . . . . 30 LYS C . 15700 1 257 . 1 1 30 30 LYS CA C 13 54.999 0.400 . 1 . . . . . 30 LYS CA . 15700 1 258 . 1 1 30 30 LYS CB C 13 32.330 0.400 . 1 . . . . . 30 LYS CB . 15700 1 259 . 1 1 30 30 LYS CD C 13 29.350 0.400 . 1 . . . . . 30 LYS CD . 15700 1 260 . 1 1 30 30 LYS CE C 13 41.760 0.400 . 1 . . . . . 30 LYS CE . 15700 1 261 . 1 1 30 30 LYS CG C 13 25.050 0.400 . 1 . . . . . 30 LYS CG . 15700 1 262 . 1 1 30 30 LYS N N 15 122.310 0.400 . 1 . . . . . 30 LYS N . 15700 1 263 . 1 1 31 31 ALA H H 1 9.238 0.030 . 1 . . . . . 31 ALA H . 15700 1 264 . 1 1 31 31 ALA HA H 1 4.477 0.030 . 1 . . . . . 31 ALA HA . 15700 1 265 . 1 1 31 31 ALA HB1 H 1 1.964 0.030 . 1 . . . . . 31 ALA HB . 15700 1 266 . 1 1 31 31 ALA HB2 H 1 1.964 0.030 . 1 . . . . . 31 ALA HB . 15700 1 267 . 1 1 31 31 ALA HB3 H 1 1.964 0.030 . 1 . . . . . 31 ALA HB . 15700 1 268 . 1 1 31 31 ALA CA C 13 50.190 0.400 . 1 . . . . . 31 ALA CA . 15700 1 269 . 1 1 31 31 ALA CB C 13 21.637 0.400 . 1 . . . . . 31 ALA CB . 15700 1 270 . 1 1 31 31 ALA N N 15 133.864 0.400 . 1 . . . . . 31 ALA N . 15700 1 271 . 1 1 32 32 PRO HA H 1 4.637 0.030 . 1 . . . . . 32 PRO HA . 15700 1 272 . 1 1 32 32 PRO HB2 H 1 2.332 0.030 . 2 . . . . . 32 PRO HB2 . 15700 1 273 . 1 1 32 32 PRO HB3 H 1 2.119 0.030 . 2 . . . . . 32 PRO HB3 . 15700 1 274 . 1 1 32 32 PRO HD2 H 1 3.800 0.030 . 2 . . . . . 32 PRO HD2 . 15700 1 275 . 1 1 32 32 PRO HD3 H 1 4.305 0.030 . 2 . . . . . 32 PRO HD3 . 15700 1 276 . 1 1 32 32 PRO HG2 H 1 2.125 0.030 . 2 . . . . . 32 PRO HG2 . 15700 1 277 . 1 1 32 32 PRO HG3 H 1 2.027 0.030 . 2 . . . . . 32 PRO HG3 . 15700 1 278 . 1 1 32 32 PRO C C 13 175.737 0.300 . 1 . . . . . 32 PRO C . 15700 1 279 . 1 1 32 32 PRO CA C 13 64.259 0.400 . 1 . . . . . 32 PRO CA . 15700 1 280 . 1 1 32 32 PRO CB C 13 31.740 0.400 . 1 . . . . . 32 PRO CB . 15700 1 281 . 1 1 32 32 PRO CD C 13 50.316 0.400 . 1 . . . . . 32 PRO CD . 15700 1 282 . 1 1 32 32 PRO CG C 13 26.880 0.400 . 1 . . . . . 32 PRO CG . 15700 1 283 . 1 1 33 33 CYS H H 1 8.779 0.030 . 1 . . . . . 33 CYS H . 15700 1 284 . 1 1 33 33 CYS HA H 1 4.321 0.030 . 1 . . . . . 33 CYS HA . 15700 1 285 . 1 1 33 33 CYS HB2 H 1 3.194 0.030 . 2 . . . . . 33 CYS HB2 . 15700 1 286 . 1 1 33 33 CYS HB3 H 1 2.723 0.030 . 2 . . . . . 33 CYS HB3 . 15700 1 287 . 1 1 33 33 CYS C C 13 176.733 0.300 . 1 . . . . . 33 CYS C . 15700 1 288 . 1 1 33 33 CYS CA C 13 54.398 0.400 . 1 . . . . . 33 CYS CA . 15700 1 289 . 1 1 33 33 CYS CB C 13 30.697 0.400 . 1 . . . . . 33 CYS CB . 15700 1 290 . 1 1 33 33 CYS N N 15 120.005 0.400 . 1 . . . . . 33 CYS N . 15700 1 291 . 1 1 34 34 CYS H H 1 7.424 0.030 . 1 . . . . . 34 CYS H . 15700 1 292 . 1 1 34 34 CYS HA H 1 4.896 0.030 . 1 . . . . . 34 CYS HA . 15700 1 293 . 1 1 34 34 CYS HB2 H 1 3.330 0.030 . 2 . . . . . 34 CYS HB2 . 15700 1 294 . 1 1 34 34 CYS HB3 H 1 2.894 0.030 . 2 . . . . . 34 CYS HB3 . 15700 1 295 . 1 1 34 34 CYS C C 13 174.935 0.300 . 1 . . . . . 34 CYS C . 15700 1 296 . 1 1 34 34 CYS CA C 13 56.962 0.400 . 1 . . . . . 34 CYS CA . 15700 1 297 . 1 1 34 34 CYS CB C 13 31.067 0.400 . 1 . . . . . 34 CYS CB . 15700 1 298 . 1 1 34 34 CYS N N 15 115.034 0.400 . 1 . . . . . 34 CYS N . 15700 1 299 . 1 1 35 35 ASP H H 1 8.368 0.030 . 1 . . . . . 35 ASP H . 15700 1 300 . 1 1 35 35 ASP HA H 1 4.454 0.030 . 1 . . . . . 35 ASP HA . 15700 1 301 . 1 1 35 35 ASP HB2 H 1 3.013 0.030 . 2 . . . . . 35 ASP HB2 . 15700 1 302 . 1 1 35 35 ASP HB3 H 1 2.730 0.030 . 2 . . . . . 35 ASP HB3 . 15700 1 303 . 1 1 35 35 ASP C C 13 174.354 0.300 . 1 . . . . . 35 ASP C . 15700 1 304 . 1 1 35 35 ASP CA C 13 56.222 0.400 . 1 . . . . . 35 ASP CA . 15700 1 305 . 1 1 35 35 ASP CB C 13 39.730 0.400 . 1 . . . . . 35 ASP CB . 15700 1 306 . 1 1 35 35 ASP N N 15 121.381 0.400 . 1 . . . . . 35 ASP N . 15700 1 307 . 1 1 36 36 LYS H H 1 7.227 0.030 . 1 . . . . . 36 LYS H . 15700 1 308 . 1 1 36 36 LYS HA H 1 4.451 0.030 . 1 . . . . . 36 LYS HA . 15700 1 309 . 1 1 36 36 LYS HB2 H 1 2.070 0.030 . 2 . . . . . 36 LYS HB2 . 15700 1 310 . 1 1 36 36 LYS HB3 H 1 1.649 0.030 . 2 . . . . . 36 LYS HB3 . 15700 1 311 . 1 1 36 36 LYS HD2 H 1 2.047 0.030 . 2 . . . . . 36 LYS HD2 . 15700 1 312 . 1 1 36 36 LYS HD3 H 1 1.745 0.030 . 2 . . . . . 36 LYS HD3 . 15700 1 313 . 1 1 36 36 LYS HE2 H 1 3.080 0.030 . 2 . . . . . 36 LYS HE2 . 15700 1 314 . 1 1 36 36 LYS HE3 H 1 3.080 0.030 . 2 . . . . . 36 LYS HE3 . 15700 1 315 . 1 1 36 36 LYS HG2 H 1 1.331 0.030 . 2 . . . . . 36 LYS HG2 . 15700 1 316 . 1 1 36 36 LYS HG3 H 1 1.710 0.030 . 2 . . . . . 36 LYS HG3 . 15700 1 317 . 1 1 36 36 LYS C C 13 175.433 0.300 . 1 . . . . . 36 LYS C . 15700 1 318 . 1 1 36 36 LYS CA C 13 56.270 0.400 . 1 . . . . . 36 LYS CA . 15700 1 319 . 1 1 36 36 LYS CB C 13 36.620 0.400 . 1 . . . . . 36 LYS CB . 15700 1 320 . 1 1 36 36 LYS CD C 13 29.550 0.400 . 1 . . . . . 36 LYS CD . 15700 1 321 . 1 1 36 36 LYS CE C 13 42.320 0.400 . 1 . . . . . 36 LYS CE . 15700 1 322 . 1 1 36 36 LYS CG C 13 26.150 0.400 . 1 . . . . . 36 LYS CG . 15700 1 323 . 1 1 36 36 LYS N N 15 117.673 0.400 . 1 . . . . . 36 LYS N . 15700 1 324 . 1 1 37 37 LEU H H 1 8.053 0.030 . 1 . . . . . 37 LEU H . 15700 1 325 . 1 1 37 37 LEU HA H 1 5.292 0.030 . 1 . . . . . 37 LEU HA . 15700 1 326 . 1 1 37 37 LEU HB2 H 1 1.580 0.030 . 2 . . . . . 37 LEU HB2 . 15700 1 327 . 1 1 37 37 LEU HB3 H 1 1.054 0.030 . 2 . . . . . 37 LEU HB3 . 15700 1 328 . 1 1 37 37 LEU HD11 H 1 0.762 0.030 . 2 . . . . . 37 LEU HD1 . 15700 1 329 . 1 1 37 37 LEU HD12 H 1 0.762 0.030 . 2 . . . . . 37 LEU HD1 . 15700 1 330 . 1 1 37 37 LEU HD13 H 1 0.762 0.030 . 2 . . . . . 37 LEU HD1 . 15700 1 331 . 1 1 37 37 LEU HD21 H 1 0.576 0.030 . 2 . . . . . 37 LEU HD2 . 15700 1 332 . 1 1 37 37 LEU HD22 H 1 0.576 0.030 . 2 . . . . . 37 LEU HD2 . 15700 1 333 . 1 1 37 37 LEU HD23 H 1 0.576 0.030 . 2 . . . . . 37 LEU HD2 . 15700 1 334 . 1 1 37 37 LEU HG H 1 1.535 0.030 . 1 . . . . . 37 LEU HG . 15700 1 335 . 1 1 37 37 LEU C C 13 176.484 0.300 . 1 . . . . . 37 LEU C . 15700 1 336 . 1 1 37 37 LEU CA C 13 53.348 0.400 . 1 . . . . . 37 LEU CA . 15700 1 337 . 1 1 37 37 LEU CB C 13 42.400 0.400 . 1 . . . . . 37 LEU CB . 15700 1 338 . 1 1 37 37 LEU CD1 C 13 25.540 0.400 . 1 . . . . . 37 LEU CD1 . 15700 1 339 . 1 1 37 37 LEU CD2 C 13 23.850 0.400 . 1 . . . . . 37 LEU CD2 . 15700 1 340 . 1 1 37 37 LEU CG C 13 27.310 0.400 . 1 . . . . . 37 LEU CG . 15700 1 341 . 1 1 37 37 LEU N N 15 120.994 0.400 . 1 . . . . . 37 LEU N . 15700 1 342 . 1 1 38 38 TYR H H 1 8.741 0.030 . 1 . . . . . 38 TYR H . 15700 1 343 . 1 1 38 38 TYR HA H 1 5.002 0.030 . 1 . . . . . 38 TYR HA . 15700 1 344 . 1 1 38 38 TYR HB2 H 1 3.203 0.030 . 2 . . . . . 38 TYR HB2 . 15700 1 345 . 1 1 38 38 TYR HB3 H 1 2.382 0.030 . 2 . . . . . 38 TYR HB3 . 15700 1 346 . 1 1 38 38 TYR HD1 H 1 7.103 0.030 . 1 . . . . . 38 TYR HD1 . 15700 1 347 . 1 1 38 38 TYR HD2 H 1 7.103 0.030 . 1 . . . . . 38 TYR HD2 . 15700 1 348 . 1 1 38 38 TYR HE1 H 1 6.777 0.030 . 1 . . . . . 38 TYR HE1 . 15700 1 349 . 1 1 38 38 TYR HE2 H 1 6.777 0.030 . 1 . . . . . 38 TYR HE2 . 15700 1 350 . 1 1 38 38 TYR C C 13 176.374 0.300 . 1 . . . . . 38 TYR C . 15700 1 351 . 1 1 38 38 TYR CA C 13 57.081 0.400 . 1 . . . . . 38 TYR CA . 15700 1 352 . 1 1 38 38 TYR CB C 13 45.647 0.400 . 1 . . . . . 38 TYR CB . 15700 1 353 . 1 1 38 38 TYR CD1 C 13 132.235 0.400 . 1 . . . . . 38 TYR CD1 . 15700 1 354 . 1 1 38 38 TYR CE1 C 13 119.530 0.400 . 1 . . . . . 38 TYR CE1 . 15700 1 355 . 1 1 38 38 TYR N N 15 121.128 0.400 . 1 . . . . . 38 TYR N . 15700 1 356 . 1 1 39 39 THR H H 1 9.402 0.030 . 1 . . . . . 39 THR H . 15700 1 357 . 1 1 39 39 THR HA H 1 4.098 0.030 . 1 . . . . . 39 THR HA . 15700 1 358 . 1 1 39 39 THR HB H 1 4.536 0.030 . 1 . . . . . 39 THR HB . 15700 1 359 . 1 1 39 39 THR HG21 H 1 1.502 0.030 . 1 . . . . . 39 THR HG2 . 15700 1 360 . 1 1 39 39 THR HG22 H 1 1.502 0.030 . 1 . . . . . 39 THR HG2 . 15700 1 361 . 1 1 39 39 THR HG23 H 1 1.502 0.030 . 1 . . . . . 39 THR HG2 . 15700 1 362 . 1 1 39 39 THR C C 13 173.496 0.300 . 1 . . . . . 39 THR C . 15700 1 363 . 1 1 39 39 THR CA C 13 67.062 0.400 . 1 . . . . . 39 THR CA . 15700 1 364 . 1 1 39 39 THR CB C 13 68.047 0.400 . 1 . . . . . 39 THR CB . 15700 1 365 . 1 1 39 39 THR CG2 C 13 22.930 0.400 . 1 . . . . . 39 THR CG2 . 15700 1 366 . 1 1 39 39 THR N N 15 116.641 0.400 . 1 . . . . . 39 THR N . 15700 1 367 . 1 1 40 40 CYS H H 1 7.317 0.030 . 1 . . . . . 40 CYS H . 15700 1 368 . 1 1 40 40 CYS HA H 1 4.771 0.030 . 1 . . . . . 40 CYS HA . 15700 1 369 . 1 1 40 40 CYS HB2 H 1 3.026 0.030 . 2 . . . . . 40 CYS HB2 . 15700 1 370 . 1 1 40 40 CYS HB3 H 1 4.196 0.030 . 2 . . . . . 40 CYS HB3 . 15700 1 371 . 1 1 40 40 CYS C C 13 175.128 0.300 . 1 . . . . . 40 CYS C . 15700 1 372 . 1 1 40 40 CYS CA C 13 56.577 0.400 . 1 . . . . . 40 CYS CA . 15700 1 373 . 1 1 40 40 CYS CB C 13 35.087 0.400 . 1 . . . . . 40 CYS CB . 15700 1 374 . 1 1 40 40 CYS N N 15 109.059 0.400 . 1 . . . . . 40 CYS N . 15700 1 375 . 1 1 41 41 ARG H H 1 9.201 0.030 . 1 . . . . . 41 ARG H . 15700 1 376 . 1 1 41 41 ARG HA H 1 3.982 0.030 . 1 . . . . . 41 ARG HA . 15700 1 377 . 1 1 41 41 ARG HB2 H 1 2.162 0.030 . 2 . . . . . 41 ARG HB2 . 15700 1 378 . 1 1 41 41 ARG HB3 H 1 1.532 0.030 . 2 . . . . . 41 ARG HB3 . 15700 1 379 . 1 1 41 41 ARG HD2 H 1 3.183 0.030 . 2 . . . . . 41 ARG HD2 . 15700 1 380 . 1 1 41 41 ARG HD3 H 1 3.102 0.030 . 2 . . . . . 41 ARG HD3 . 15700 1 381 . 1 1 41 41 ARG HG2 H 1 1.457 0.030 . 2 . . . . . 41 ARG HG2 . 15700 1 382 . 1 1 41 41 ARG HG3 H 1 1.457 0.030 . 2 . . . . . 41 ARG HG3 . 15700 1 383 . 1 1 41 41 ARG C C 13 175.101 0.300 . 1 . . . . . 41 ARG C . 15700 1 384 . 1 1 41 41 ARG CA C 13 58.591 0.400 . 1 . . . . . 41 ARG CA . 15700 1 385 . 1 1 41 41 ARG CB C 13 29.640 0.400 . 1 . . . . . 41 ARG CB . 15700 1 386 . 1 1 41 41 ARG CD C 13 42.987 0.400 . 1 . . . . . 41 ARG CD . 15700 1 387 . 1 1 41 41 ARG CG C 13 27.230 0.400 . 1 . . . . . 41 ARG CG . 15700 1 388 . 1 1 41 41 ARG N N 15 121.737 0.400 . 1 . . . . . 41 ARG N . 15700 1 389 . 1 1 42 42 LEU H H 1 9.116 0.030 . 1 . . . . . 42 LEU H . 15700 1 390 . 1 1 42 42 LEU HA H 1 4.029 0.030 . 1 . . . . . 42 LEU HA . 15700 1 391 . 1 1 42 42 LEU HB2 H 1 0.763 0.030 . 2 . . . . . 42 LEU HB2 . 15700 1 392 . 1 1 42 42 LEU HB3 H 1 0.654 0.030 . 2 . . . . . 42 LEU HB3 . 15700 1 393 . 1 1 42 42 LEU HD11 H 1 0.761 0.030 . 2 . . . . . 42 LEU HD1 . 15700 1 394 . 1 1 42 42 LEU HD12 H 1 0.761 0.030 . 2 . . . . . 42 LEU HD1 . 15700 1 395 . 1 1 42 42 LEU HD13 H 1 0.761 0.030 . 2 . . . . . 42 LEU HD1 . 15700 1 396 . 1 1 42 42 LEU HD21 H 1 0.761 0.030 . 2 . . . . . 42 LEU HD2 . 15700 1 397 . 1 1 42 42 LEU HD22 H 1 0.761 0.030 . 2 . . . . . 42 LEU HD2 . 15700 1 398 . 1 1 42 42 LEU HD23 H 1 0.761 0.030 . 2 . . . . . 42 LEU HD2 . 15700 1 399 . 1 1 42 42 LEU HG H 1 1.575 0.030 . 1 . . . . . 42 LEU HG . 15700 1 400 . 1 1 42 42 LEU C C 13 179.943 0.300 . 1 . . . . . 42 LEU C . 15700 1 401 . 1 1 42 42 LEU CA C 13 58.005 0.400 . 1 . . . . . 42 LEU CA . 15700 1 402 . 1 1 42 42 LEU CB C 13 38.960 0.400 . 1 . . . . . 42 LEU CB . 15700 1 403 . 1 1 42 42 LEU CD1 C 13 25.293 0.400 . 1 . . . . . 42 LEU CD1 . 15700 1 404 . 1 1 42 42 LEU CD2 C 13 22.530 0.400 . 1 . . . . . 42 LEU CD2 . 15700 1 405 . 1 1 42 42 LEU CG C 13 27.277 0.400 . 1 . . . . . 42 LEU CG . 15700 1 406 . 1 1 42 42 LEU N N 15 126.364 0.400 . 1 . . . . . 42 LEU N . 15700 1 407 . 1 1 43 43 CYS H H 1 8.785 0.030 . 1 . . . . . 43 CYS H . 15700 1 408 . 1 1 43 43 CYS HA H 1 4.187 0.030 . 1 . . . . . 43 CYS HA . 15700 1 409 . 1 1 43 43 CYS HB2 H 1 3.341 0.030 . 2 . . . . . 43 CYS HB2 . 15700 1 410 . 1 1 43 43 CYS HB3 H 1 3.413 0.030 . 2 . . . . . 43 CYS HB3 . 15700 1 411 . 1 1 43 43 CYS C C 13 177.785 0.300 . 1 . . . . . 43 CYS C . 15700 1 412 . 1 1 43 43 CYS CA C 13 66.415 0.400 . 1 . . . . . 43 CYS CA . 15700 1 413 . 1 1 43 43 CYS CB C 13 28.870 0.400 . 1 . . . . . 43 CYS CB . 15700 1 414 . 1 1 43 43 CYS N N 15 124.519 0.400 . 1 . . . . . 43 CYS N . 15700 1 415 . 1 1 44 44 HIS H H 1 7.604 0.030 . 1 . . . . . 44 HIS H . 15700 1 416 . 1 1 44 44 HIS HA H 1 1.983 0.030 . 1 . . . . . 44 HIS HA . 15700 1 417 . 1 1 44 44 HIS HB2 H 1 3.117 0.030 . 2 . . . . . 44 HIS HB2 . 15700 1 418 . 1 1 44 44 HIS HB3 H 1 2.408 0.030 . 2 . . . . . 44 HIS HB3 . 15700 1 419 . 1 1 44 44 HIS HD2 H 1 6.540 0.030 . 1 . . . . . 44 HIS HD2 . 15700 1 420 . 1 1 44 44 HIS C C 13 176.429 0.300 . 1 . . . . . 44 HIS C . 15700 1 421 . 1 1 44 44 HIS CA C 13 58.760 0.400 . 1 . . . . . 44 HIS CA . 15700 1 422 . 1 1 44 44 HIS CB C 13 27.990 0.400 . 1 . . . . . 44 HIS CB . 15700 1 423 . 1 1 44 44 HIS N N 15 117.024 0.400 . 1 . . . . . 44 HIS N . 15700 1 424 . 1 1 45 45 ASP H H 1 8.750 0.030 . 1 . . . . . 45 ASP H . 15700 1 425 . 1 1 45 45 ASP HA H 1 4.116 0.030 . 1 . . . . . 45 ASP HA . 15700 1 426 . 1 1 45 45 ASP HB2 H 1 2.779 0.030 . 2 . . . . . 45 ASP HB2 . 15700 1 427 . 1 1 45 45 ASP HB3 H 1 2.694 0.030 . 2 . . . . . 45 ASP HB3 . 15700 1 428 . 1 1 45 45 ASP C C 13 177.453 0.300 . 1 . . . . . 45 ASP C . 15700 1 429 . 1 1 45 45 ASP CA C 13 56.840 0.400 . 1 . . . . . 45 ASP CA . 15700 1 430 . 1 1 45 45 ASP CB C 13 38.960 0.400 . 1 . . . . . 45 ASP CB . 15700 1 431 . 1 1 45 45 ASP N N 15 120.440 0.400 . 1 . . . . . 45 ASP N . 15700 1 432 . 1 1 46 46 ASN H H 1 7.888 0.030 . 1 . . . . . 46 ASN H . 15700 1 433 . 1 1 46 46 ASN HA H 1 4.612 0.030 . 1 . . . . . 46 ASN HA . 15700 1 434 . 1 1 46 46 ASN HB2 H 1 2.890 0.030 . 2 . . . . . 46 ASN HB2 . 15700 1 435 . 1 1 46 46 ASN HB3 H 1 2.890 0.030 . 2 . . . . . 46 ASN HB3 . 15700 1 436 . 1 1 46 46 ASN HD21 H 1 7.601 0.030 . 2 . . . . . 46 ASN HD21 . 15700 1 437 . 1 1 46 46 ASN HD22 H 1 6.989 0.030 . 2 . . . . . 46 ASN HD22 . 15700 1 438 . 1 1 46 46 ASN C C 13 175.903 0.300 . 1 . . . . . 46 ASN C . 15700 1 439 . 1 1 46 46 ASN CA C 13 54.342 0.400 . 1 . . . . . 46 ASN CA . 15700 1 440 . 1 1 46 46 ASN CB C 13 38.790 0.400 . 1 . . . . . 46 ASN CB . 15700 1 441 . 1 1 46 46 ASN N N 15 115.758 0.400 . 1 . . . . . 46 ASN N . 15700 1 442 . 1 1 46 46 ASN ND2 N 15 110.204 0.400 . 1 . . . . . 46 ASN ND2 . 15700 1 443 . 1 1 47 47 ASN H H 1 7.384 0.030 . 1 . . . . . 47 ASN H . 15700 1 444 . 1 1 47 47 ASN HA H 1 4.893 0.030 . 1 . . . . . 47 ASN HA . 15700 1 445 . 1 1 47 47 ASN HB2 H 1 3.002 0.030 . 2 . . . . . 47 ASN HB2 . 15700 1 446 . 1 1 47 47 ASN HB3 H 1 2.616 0.030 . 2 . . . . . 47 ASN HB3 . 15700 1 447 . 1 1 47 47 ASN HD21 H 1 8.067 0.030 . 2 . . . . . 47 ASN HD21 . 15700 1 448 . 1 1 47 47 ASN HD22 H 1 7.265 0.030 . 2 . . . . . 47 ASN HD22 . 15700 1 449 . 1 1 47 47 ASN C C 13 173.579 0.300 . 1 . . . . . 47 ASN C . 15700 1 450 . 1 1 47 47 ASN CA C 13 53.937 0.400 . 1 . . . . . 47 ASN CA . 15700 1 451 . 1 1 47 47 ASN CB C 13 43.130 0.400 . 1 . . . . . 47 ASN CB . 15700 1 452 . 1 1 47 47 ASN N N 15 116.576 0.400 . 1 . . . . . 47 ASN N . 15700 1 453 . 1 1 47 47 ASN ND2 N 15 116.183 0.400 . 1 . . . . . 47 ASN ND2 . 15700 1 454 . 1 1 48 48 GLU H H 1 7.143 0.030 . 1 . . . . . 48 GLU H . 15700 1 455 . 1 1 48 48 GLU HA H 1 4.572 0.030 . 1 . . . . . 48 GLU HA . 15700 1 456 . 1 1 48 48 GLU HB2 H 1 1.395 0.030 . 2 . . . . . 48 GLU HB2 . 15700 1 457 . 1 1 48 48 GLU HB3 H 1 0.698 0.030 . 2 . . . . . 48 GLU HB3 . 15700 1 458 . 1 1 48 48 GLU HG2 H 1 1.739 0.030 . 2 . . . . . 48 GLU HG2 . 15700 1 459 . 1 1 48 48 GLU HG3 H 1 1.168 0.030 . 2 . . . . . 48 GLU HG3 . 15700 1 460 . 1 1 48 48 GLU C C 13 175.627 0.300 . 1 . . . . . 48 GLU C . 15700 1 461 . 1 1 48 48 GLU CA C 13 53.727 0.400 . 1 . . . . . 48 GLU CA . 15700 1 462 . 1 1 48 48 GLU CB C 13 32.480 0.400 . 1 . . . . . 48 GLU CB . 15700 1 463 . 1 1 48 48 GLU CG C 13 34.110 0.400 . 1 . . . . . 48 GLU CG . 15700 1 464 . 1 1 48 48 GLU N N 15 116.967 0.400 . 1 . . . . . 48 GLU N . 15700 1 465 . 1 1 49 49 ASP H H 1 8.748 0.030 . 1 . . . . . 49 ASP H . 15700 1 466 . 1 1 49 49 ASP HA H 1 4.576 0.030 . 1 . . . . . 49 ASP HA . 15700 1 467 . 1 1 49 49 ASP HB2 H 1 3.154 0.030 . 2 . . . . . 49 ASP HB2 . 15700 1 468 . 1 1 49 49 ASP HB3 H 1 2.668 0.030 . 2 . . . . . 49 ASP HB3 . 15700 1 469 . 1 1 49 49 ASP C C 13 174.796 0.300 . 1 . . . . . 49 ASP C . 15700 1 470 . 1 1 49 49 ASP CA C 13 53.027 0.400 . 1 . . . . . 49 ASP CA . 15700 1 471 . 1 1 49 49 ASP CB C 13 40.340 0.400 . 1 . . . . . 49 ASP CB . 15700 1 472 . 1 1 49 49 ASP N N 15 119.296 0.400 . 1 . . . . . 49 ASP N . 15700 1 473 . 1 1 50 50 HIS H H 1 6.919 0.030 . 1 . . . . . 50 HIS H . 15700 1 474 . 1 1 50 50 HIS HA H 1 4.880 0.030 . 1 . . . . . 50 HIS HA . 15700 1 475 . 1 1 50 50 HIS HB2 H 1 3.266 0.030 . 2 . . . . . 50 HIS HB2 . 15700 1 476 . 1 1 50 50 HIS HB3 H 1 3.216 0.030 . 2 . . . . . 50 HIS HB3 . 15700 1 477 . 1 1 50 50 HIS C C 13 172.942 0.300 . 1 . . . . . 50 HIS C . 15700 1 478 . 1 1 50 50 HIS CA C 13 53.978 0.400 . 1 . . . . . 50 HIS CA . 15700 1 479 . 1 1 50 50 HIS CB C 13 30.330 0.400 . 1 . . . . . 50 HIS CB . 15700 1 480 . 1 1 50 50 HIS N N 15 113.709 0.400 . 1 . . . . . 50 HIS N . 15700 1 481 . 1 1 51 51 GLN H H 1 8.646 0.030 . 1 . . . . . 51 GLN H . 15700 1 482 . 1 1 51 51 GLN HA H 1 4.896 0.030 . 1 . . . . . 51 GLN HA . 15700 1 483 . 1 1 51 51 GLN HB2 H 1 2.028 0.030 . 2 . . . . . 51 GLN HB2 . 15700 1 484 . 1 1 51 51 GLN HB3 H 1 1.958 0.030 . 2 . . . . . 51 GLN HB3 . 15700 1 485 . 1 1 51 51 GLN HG2 H 1 2.366 0.030 . 2 . . . . . 51 GLN HG2 . 15700 1 486 . 1 1 51 51 GLN HG3 H 1 2.265 0.030 . 2 . . . . . 51 GLN HG3 . 15700 1 487 . 1 1 51 51 GLN C C 13 176.512 0.300 . 1 . . . . . 51 GLN C . 15700 1 488 . 1 1 51 51 GLN CA C 13 54.872 0.400 . 1 . . . . . 51 GLN CA . 15700 1 489 . 1 1 51 51 GLN CB C 13 30.950 0.400 . 1 . . . . . 51 GLN CB . 15700 1 490 . 1 1 51 51 GLN CG C 13 35.070 0.400 . 1 . . . . . 51 GLN CG . 15700 1 491 . 1 1 51 51 GLN N N 15 119.379 0.400 . 1 . . . . . 51 GLN N . 15700 1 492 . 1 1 52 52 LEU H H 1 9.646 0.030 . 1 . . . . . 52 LEU H . 15700 1 493 . 1 1 52 52 LEU HA H 1 4.206 0.030 . 1 . . . . . 52 LEU HA . 15700 1 494 . 1 1 52 52 LEU HB2 H 1 1.348 0.030 . 2 . . . . . 52 LEU HB2 . 15700 1 495 . 1 1 52 52 LEU HB3 H 1 -0.110 0.030 . 2 . . . . . 52 LEU HB3 . 15700 1 496 . 1 1 52 52 LEU HD11 H 1 0.646 0.030 . 2 . . . . . 52 LEU HD1 . 15700 1 497 . 1 1 52 52 LEU HD12 H 1 0.646 0.030 . 2 . . . . . 52 LEU HD1 . 15700 1 498 . 1 1 52 52 LEU HD13 H 1 0.646 0.030 . 2 . . . . . 52 LEU HD1 . 15700 1 499 . 1 1 52 52 LEU HD21 H 1 0.534 0.030 . 2 . . . . . 52 LEU HD2 . 15700 1 500 . 1 1 52 52 LEU HD22 H 1 0.534 0.030 . 2 . . . . . 52 LEU HD2 . 15700 1 501 . 1 1 52 52 LEU HD23 H 1 0.534 0.030 . 2 . . . . . 52 LEU HD2 . 15700 1 502 . 1 1 52 52 LEU HG H 1 1.176 0.030 . 1 . . . . . 52 LEU HG . 15700 1 503 . 1 1 52 52 LEU C C 13 175.793 0.300 . 1 . . . . . 52 LEU C . 15700 1 504 . 1 1 52 52 LEU CA C 13 55.450 0.400 . 1 . . . . . 52 LEU CA . 15700 1 505 . 1 1 52 52 LEU CB C 13 41.407 0.400 . 1 . . . . . 52 LEU CB . 15700 1 506 . 1 1 52 52 LEU CD1 C 13 26.300 0.400 . 1 . . . . . 52 LEU CD1 . 15700 1 507 . 1 1 52 52 LEU CD2 C 13 24.577 0.400 . 1 . . . . . 52 LEU CD2 . 15700 1 508 . 1 1 52 52 LEU CG C 13 27.100 0.400 . 1 . . . . . 52 LEU CG . 15700 1 509 . 1 1 52 52 LEU N N 15 128.069 0.400 . 1 . . . . . 52 LEU N . 15700 1 510 . 1 1 53 53 ASP H H 1 9.281 0.030 . 1 . . . . . 53 ASP H . 15700 1 511 . 1 1 53 53 ASP HA H 1 4.725 0.030 . 1 . . . . . 53 ASP HA . 15700 1 512 . 1 1 53 53 ASP HB2 H 1 2.990 0.030 . 2 . . . . . 53 ASP HB2 . 15700 1 513 . 1 1 53 53 ASP HB3 H 1 2.627 0.030 . 2 . . . . . 53 ASP HB3 . 15700 1 514 . 1 1 53 53 ASP C C 13 176.401 0.300 . 1 . . . . . 53 ASP C . 15700 1 515 . 1 1 53 53 ASP CA C 13 52.590 0.400 . 1 . . . . . 53 ASP CA . 15700 1 516 . 1 1 53 53 ASP CB C 13 39.990 0.400 . 1 . . . . . 53 ASP CB . 15700 1 517 . 1 1 53 53 ASP N N 15 128.783 0.400 . 1 . . . . . 53 ASP N . 15700 1 518 . 1 1 54 54 ARG H H 1 8.496 0.030 . 1 . . . . . 54 ARG H . 15700 1 519 . 1 1 54 54 ARG HA H 1 3.859 0.030 . 1 . . . . . 54 ARG HA . 15700 1 520 . 1 1 54 54 ARG HB2 H 1 2.496 0.030 . 2 . . . . . 54 ARG HB2 . 15700 1 521 . 1 1 54 54 ARG HB3 H 1 1.284 0.030 . 2 . . . . . 54 ARG HB3 . 15700 1 522 . 1 1 54 54 ARG HD2 H 1 2.979 0.030 . 2 . . . . . 54 ARG HD2 . 15700 1 523 . 1 1 54 54 ARG HD3 H 1 2.907 0.030 . 2 . . . . . 54 ARG HD3 . 15700 1 524 . 1 1 54 54 ARG HG2 H 1 0.846 0.030 . 2 . . . . . 54 ARG HG2 . 15700 1 525 . 1 1 54 54 ARG HG3 H 1 0.653 0.030 . 2 . . . . . 54 ARG HG3 . 15700 1 526 . 1 1 54 54 ARG C C 13 176.346 0.300 . 1 . . . . . 54 ARG C . 15700 1 527 . 1 1 54 54 ARG CA C 13 57.357 0.400 . 1 . . . . . 54 ARG CA . 15700 1 528 . 1 1 54 54 ARG CB C 13 28.890 0.400 . 1 . . . . . 54 ARG CB . 15700 1 529 . 1 1 54 54 ARG CD C 13 44.057 0.400 . 1 . . . . . 54 ARG CD . 15700 1 530 . 1 1 54 54 ARG CG C 13 23.774 0.400 . 1 . . . . . 54 ARG CG . 15700 1 531 . 1 1 54 54 ARG N N 15 125.813 0.400 . 1 . . . . . 54 ARG N . 15700 1 532 . 1 1 55 55 PHE H H 1 8.005 0.030 . 1 . . . . . 55 PHE H . 15700 1 533 . 1 1 55 55 PHE HA H 1 4.712 0.030 . 1 . . . . . 55 PHE HA . 15700 1 534 . 1 1 55 55 PHE HB2 H 1 3.218 0.030 . 2 . . . . . 55 PHE HB2 . 15700 1 535 . 1 1 55 55 PHE HB3 H 1 3.451 0.030 . 2 . . . . . 55 PHE HB3 . 15700 1 536 . 1 1 55 55 PHE HD1 H 1 7.620 0.030 . 1 . . . . . 55 PHE HD1 . 15700 1 537 . 1 1 55 55 PHE HD2 H 1 7.620 0.030 . 1 . . . . . 55 PHE HD2 . 15700 1 538 . 1 1 55 55 PHE HE1 H 1 7.620 0.030 . 1 . . . . . 55 PHE HE1 . 15700 1 539 . 1 1 55 55 PHE HE2 H 1 7.620 0.030 . 1 . . . . . 55 PHE HE2 . 15700 1 540 . 1 1 55 55 PHE C C 13 177.481 0.300 . 1 . . . . . 55 PHE C . 15700 1 541 . 1 1 55 55 PHE CA C 13 59.080 0.400 . 1 . . . . . 55 PHE CA . 15700 1 542 . 1 1 55 55 PHE CB C 13 37.447 0.400 . 1 . . . . . 55 PHE CB . 15700 1 543 . 1 1 55 55 PHE CD1 C 13 132.078 0.400 . 1 . . . . . 55 PHE CD1 . 15700 1 544 . 1 1 55 55 PHE CE1 C 13 132.078 0.400 . 1 . . . . . 55 PHE CE1 . 15700 1 545 . 1 1 55 55 PHE N N 15 120.168 0.400 . 1 . . . . . 55 PHE N . 15700 1 546 . 1 1 56 56 LYS H H 1 7.681 0.030 . 1 . . . . . 56 LYS H . 15700 1 547 . 1 1 56 56 LYS HA H 1 4.411 0.030 . 1 . . . . . 56 LYS HA . 15700 1 548 . 1 1 56 56 LYS HB2 H 1 2.101 0.030 . 2 . . . . . 56 LYS HB2 . 15700 1 549 . 1 1 56 56 LYS HB3 H 1 1.809 0.030 . 2 . . . . . 56 LYS HB3 . 15700 1 550 . 1 1 56 56 LYS HD2 H 1 1.770 0.030 . 2 . . . . . 56 LYS HD2 . 15700 1 551 . 1 1 56 56 LYS HD3 H 1 1.709 0.030 . 2 . . . . . 56 LYS HD3 . 15700 1 552 . 1 1 56 56 LYS HE2 H 1 3.069 0.030 . 2 . . . . . 56 LYS HE2 . 15700 1 553 . 1 1 56 56 LYS HE3 H 1 3.069 0.030 . 2 . . . . . 56 LYS HE3 . 15700 1 554 . 1 1 56 56 LYS HG2 H 1 1.590 0.030 . 2 . . . . . 56 LYS HG2 . 15700 1 555 . 1 1 56 56 LYS HG3 H 1 1.405 0.030 . 2 . . . . . 56 LYS HG3 . 15700 1 556 . 1 1 56 56 LYS C C 13 175.959 0.300 . 1 . . . . . 56 LYS C . 15700 1 557 . 1 1 56 56 LYS CA C 13 55.459 0.400 . 1 . . . . . 56 LYS CA . 15700 1 558 . 1 1 56 56 LYS CB C 13 33.590 0.400 . 1 . . . . . 56 LYS CB . 15700 1 559 . 1 1 56 56 LYS CD C 13 28.667 0.400 . 1 . . . . . 56 LYS CD . 15700 1 560 . 1 1 56 56 LYS CE C 13 42.010 0.400 . 1 . . . . . 56 LYS CE . 15700 1 561 . 1 1 56 56 LYS CG C 13 25.427 0.400 . 1 . . . . . 56 LYS CG . 15700 1 562 . 1 1 56 56 LYS N N 15 116.937 0.400 . 1 . . . . . 56 LYS N . 15700 1 563 . 1 1 57 57 VAL H H 1 6.553 0.030 . 1 . . . . . 57 VAL H . 15700 1 564 . 1 1 57 57 VAL HA H 1 3.408 0.030 . 1 . . . . . 57 VAL HA . 15700 1 565 . 1 1 57 57 VAL HB H 1 1.457 0.030 . 1 . . . . . 57 VAL HB . 15700 1 566 . 1 1 57 57 VAL HG11 H 1 0.873 0.030 . 2 . . . . . 57 VAL HG1 . 15700 1 567 . 1 1 57 57 VAL HG12 H 1 0.873 0.030 . 2 . . . . . 57 VAL HG1 . 15700 1 568 . 1 1 57 57 VAL HG13 H 1 0.873 0.030 . 2 . . . . . 57 VAL HG1 . 15700 1 569 . 1 1 57 57 VAL HG21 H 1 1.126 0.030 . 2 . . . . . 57 VAL HG2 . 15700 1 570 . 1 1 57 57 VAL HG22 H 1 1.126 0.030 . 2 . . . . . 57 VAL HG2 . 15700 1 571 . 1 1 57 57 VAL HG23 H 1 1.126 0.030 . 2 . . . . . 57 VAL HG2 . 15700 1 572 . 1 1 57 57 VAL C C 13 173.911 0.300 . 1 . . . . . 57 VAL C . 15700 1 573 . 1 1 57 57 VAL CA C 13 65.025 0.400 . 1 . . . . . 57 VAL CA . 15700 1 574 . 1 1 57 57 VAL CB C 13 32.663 0.400 . 1 . . . . . 57 VAL CB . 15700 1 575 . 1 1 57 57 VAL CG1 C 13 20.930 0.400 . 1 . . . . . 57 VAL CG1 . 15700 1 576 . 1 1 57 57 VAL CG2 C 13 23.480 0.400 . 1 . . . . . 57 VAL CG2 . 15700 1 577 . 1 1 57 57 VAL N N 15 119.519 0.400 . 1 . . . . . 57 VAL N . 15700 1 578 . 1 1 58 58 LYS H H 1 9.182 0.030 . 1 . . . . . 58 LYS H . 15700 1 579 . 1 1 58 58 LYS HA H 1 4.489 0.030 . 1 . . . . . 58 LYS HA . 15700 1 580 . 1 1 58 58 LYS HB2 H 1 1.844 0.030 . 2 . . . . . 58 LYS HB2 . 15700 1 581 . 1 1 58 58 LYS HB3 H 1 1.759 0.030 . 2 . . . . . 58 LYS HB3 . 15700 1 582 . 1 1 58 58 LYS HD2 H 1 1.741 0.030 . 2 . . . . . 58 LYS HD2 . 15700 1 583 . 1 1 58 58 LYS HD3 H 1 1.741 0.030 . 2 . . . . . 58 LYS HD3 . 15700 1 584 . 1 1 58 58 LYS HE2 H 1 3.013 0.030 . 2 . . . . . 58 LYS HE2 . 15700 1 585 . 1 1 58 58 LYS HE3 H 1 3.013 0.030 . 2 . . . . . 58 LYS HE3 . 15700 1 586 . 1 1 58 58 LYS HG2 H 1 1.522 0.030 . 2 . . . . . 58 LYS HG2 . 15700 1 587 . 1 1 58 58 LYS HG3 H 1 1.438 0.030 . 2 . . . . . 58 LYS HG3 . 15700 1 588 . 1 1 58 58 LYS C C 13 176.927 0.300 . 1 . . . . . 58 LYS C . 15700 1 589 . 1 1 58 58 LYS CA C 13 55.913 0.400 . 1 . . . . . 58 LYS CA . 15700 1 590 . 1 1 58 58 LYS CB C 13 36.340 0.400 . 1 . . . . . 58 LYS CB . 15700 1 591 . 1 1 58 58 LYS CD C 13 28.890 0.400 . 1 . . . . . 58 LYS CD . 15700 1 592 . 1 1 58 58 LYS CE C 13 42.110 0.400 . 1 . . . . . 58 LYS CE . 15700 1 593 . 1 1 58 58 LYS CG C 13 24.387 0.400 . 1 . . . . . 58 LYS CG . 15700 1 594 . 1 1 58 58 LYS N N 15 124.985 0.400 . 1 . . . . . 58 LYS N . 15700 1 595 . 1 1 59 59 GLU H H 1 8.799 0.030 . 1 . . . . . 59 GLU H . 15700 1 596 . 1 1 59 59 GLU HA H 1 5.209 0.030 . 1 . . . . . 59 GLU HA . 15700 1 597 . 1 1 59 59 GLU HB2 H 1 1.894 0.030 . 2 . . . . . 59 GLU HB2 . 15700 1 598 . 1 1 59 59 GLU HB3 H 1 1.811 0.030 . 2 . . . . . 59 GLU HB3 . 15700 1 599 . 1 1 59 59 GLU HG2 H 1 1.994 0.030 . 2 . . . . . 59 GLU HG2 . 15700 1 600 . 1 1 59 59 GLU HG3 H 1 1.924 0.030 . 2 . . . . . 59 GLU HG3 . 15700 1 601 . 1 1 59 59 GLU C C 13 173.911 0.300 . 1 . . . . . 59 GLU C . 15700 1 602 . 1 1 59 59 GLU CA C 13 54.670 0.400 . 1 . . . . . 59 GLU CA . 15700 1 603 . 1 1 59 59 GLU CB C 13 35.180 0.400 . 1 . . . . . 59 GLU CB . 15700 1 604 . 1 1 59 59 GLU CG C 13 37.177 0.400 . 1 . . . . . 59 GLU CG . 15700 1 605 . 1 1 59 59 GLU N N 15 121.493 0.400 . 1 . . . . . 59 GLU N . 15700 1 606 . 1 1 60 60 VAL H H 1 8.917 0.030 . 1 . . . . . 60 VAL H . 15700 1 607 . 1 1 60 60 VAL HA H 1 4.983 0.030 . 1 . . . . . 60 VAL HA . 15700 1 608 . 1 1 60 60 VAL HB H 1 1.766 0.030 . 1 . . . . . 60 VAL HB . 15700 1 609 . 1 1 60 60 VAL HG11 H 1 0.770 0.030 . 2 . . . . . 60 VAL HG1 . 15700 1 610 . 1 1 60 60 VAL HG12 H 1 0.770 0.030 . 2 . . . . . 60 VAL HG1 . 15700 1 611 . 1 1 60 60 VAL HG13 H 1 0.770 0.030 . 2 . . . . . 60 VAL HG1 . 15700 1 612 . 1 1 60 60 VAL HG21 H 1 0.378 0.030 . 2 . . . . . 60 VAL HG2 . 15700 1 613 . 1 1 60 60 VAL HG22 H 1 0.378 0.030 . 2 . . . . . 60 VAL HG2 . 15700 1 614 . 1 1 60 60 VAL HG23 H 1 0.378 0.030 . 2 . . . . . 60 VAL HG2 . 15700 1 615 . 1 1 60 60 VAL C C 13 173.441 0.300 . 1 . . . . . 60 VAL C . 15700 1 616 . 1 1 60 60 VAL CA C 13 57.497 0.400 . 1 . . . . . 60 VAL CA . 15700 1 617 . 1 1 60 60 VAL CB C 13 35.460 0.400 . 1 . . . . . 60 VAL CB . 15700 1 618 . 1 1 60 60 VAL CG1 C 13 21.657 0.400 . 1 . . . . . 60 VAL CG1 . 15700 1 619 . 1 1 60 60 VAL CG2 C 13 18.280 0.400 . 1 . . . . . 60 VAL CG2 . 15700 1 620 . 1 1 60 60 VAL N N 15 109.266 0.400 . 1 . . . . . 60 VAL N . 15700 1 621 . 1 1 61 61 GLN H H 1 8.970 0.030 . 1 . . . . . 61 GLN H . 15700 1 622 . 1 1 61 61 GLN HA H 1 5.024 0.030 . 1 . . . . . 61 GLN HA . 15700 1 623 . 1 1 61 61 GLN HB2 H 1 1.806 0.030 . 2 . . . . . 61 GLN HB2 . 15700 1 624 . 1 1 61 61 GLN HB3 H 1 1.730 0.030 . 2 . . . . . 61 GLN HB3 . 15700 1 625 . 1 1 61 61 GLN HE21 H 1 6.933 0.030 . 2 . . . . . 61 GLN HE21 . 15700 1 626 . 1 1 61 61 GLN HE22 H 1 6.608 0.030 . 2 . . . . . 61 GLN HE22 . 15700 1 627 . 1 1 61 61 GLN HG2 H 1 1.479 0.030 . 2 . . . . . 61 GLN HG2 . 15700 1 628 . 1 1 61 61 GLN HG3 H 1 1.479 0.030 . 2 . . . . . 61 GLN HG3 . 15700 1 629 . 1 1 61 61 GLN C C 13 175.045 0.300 . 1 . . . . . 61 GLN C . 15700 1 630 . 1 1 61 61 GLN CA C 13 53.128 0.400 . 1 . . . . . 61 GLN CA . 15700 1 631 . 1 1 61 61 GLN CB C 13 33.980 0.400 . 1 . . . . . 61 GLN CB . 15700 1 632 . 1 1 61 61 GLN CG C 13 33.980 0.400 . 1 . . . . . 61 GLN CG . 15700 1 633 . 1 1 61 61 GLN N N 15 118.525 0.400 . 1 . . . . . 61 GLN N . 15700 1 634 . 1 1 61 61 GLN NE2 N 15 109.347 0.400 . 1 . . . . . 61 GLN NE2 . 15700 1 635 . 1 1 62 62 CYS H H 1 7.688 0.030 . 1 . . . . . 62 CYS H . 15700 1 636 . 1 1 62 62 CYS HA H 1 4.210 0.030 . 1 . . . . . 62 CYS HA . 15700 1 637 . 1 1 62 62 CYS HB2 H 1 3.305 0.030 . 2 . . . . . 62 CYS HB2 . 15700 1 638 . 1 1 62 62 CYS HB3 H 1 3.259 0.030 . 2 . . . . . 62 CYS HB3 . 15700 1 639 . 1 1 62 62 CYS C C 13 177.951 0.300 . 1 . . . . . 62 CYS C . 15700 1 640 . 1 1 62 62 CYS CA C 13 59.845 0.400 . 1 . . . . . 62 CYS CA . 15700 1 641 . 1 1 62 62 CYS CB C 13 33.120 0.400 . 1 . . . . . 62 CYS CB . 15700 1 642 . 1 1 62 62 CYS N N 15 128.772 0.400 . 1 . . . . . 62 CYS N . 15700 1 643 . 1 1 63 63 ILE H H 1 8.192 0.030 . 1 . . . . . 63 ILE H . 15700 1 644 . 1 1 63 63 ILE HA H 1 3.984 0.030 . 1 . . . . . 63 ILE HA . 15700 1 645 . 1 1 63 63 ILE HB H 1 1.707 0.030 . 1 . . . . . 63 ILE HB . 15700 1 646 . 1 1 63 63 ILE HD11 H 1 0.891 0.030 . 1 . . . . . 63 ILE HD1 . 15700 1 647 . 1 1 63 63 ILE HD12 H 1 0.891 0.030 . 1 . . . . . 63 ILE HD1 . 15700 1 648 . 1 1 63 63 ILE HD13 H 1 0.891 0.030 . 1 . . . . . 63 ILE HD1 . 15700 1 649 . 1 1 63 63 ILE HG12 H 1 1.354 0.030 . 2 . . . . . 63 ILE HG12 . 15700 1 650 . 1 1 63 63 ILE HG13 H 1 1.223 0.030 . 2 . . . . . 63 ILE HG13 . 15700 1 651 . 1 1 63 63 ILE HG21 H 1 0.857 0.030 . 1 . . . . . 63 ILE HG2 . 15700 1 652 . 1 1 63 63 ILE HG22 H 1 0.857 0.030 . 1 . . . . . 63 ILE HG2 . 15700 1 653 . 1 1 63 63 ILE HG23 H 1 0.857 0.030 . 1 . . . . . 63 ILE HG2 . 15700 1 654 . 1 1 63 63 ILE C C 13 175.433 0.300 . 1 . . . . . 63 ILE C . 15700 1 655 . 1 1 63 63 ILE CA C 13 63.657 0.400 . 1 . . . . . 63 ILE CA . 15700 1 656 . 1 1 63 63 ILE CB C 13 38.506 0.400 . 1 . . . . . 63 ILE CB . 15700 1 657 . 1 1 63 63 ILE CD1 C 13 14.190 0.400 . 1 . . . . . 63 ILE CD1 . 15700 1 658 . 1 1 63 63 ILE CG1 C 13 28.040 0.400 . 1 . . . . . 63 ILE CG1 . 15700 1 659 . 1 1 63 63 ILE CG2 C 13 17.450 0.400 . 1 . . . . . 63 ILE CG2 . 15700 1 660 . 1 1 63 63 ILE N N 15 127.455 0.400 . 1 . . . . . 63 ILE N . 15700 1 661 . 1 1 64 64 ASN H H 1 9.181 0.030 . 1 . . . . . 64 ASN H . 15700 1 662 . 1 1 64 64 ASN HA H 1 4.810 0.030 . 1 . . . . . 64 ASN HA . 15700 1 663 . 1 1 64 64 ASN HB2 H 1 2.950 0.030 . 2 . . . . . 64 ASN HB2 . 15700 1 664 . 1 1 64 64 ASN HB3 H 1 2.673 0.030 . 2 . . . . . 64 ASN HB3 . 15700 1 665 . 1 1 64 64 ASN HD21 H 1 8.107 0.030 . 2 . . . . . 64 ASN HD21 . 15700 1 666 . 1 1 64 64 ASN HD22 H 1 7.090 0.030 . 2 . . . . . 64 ASN HD22 . 15700 1 667 . 1 1 64 64 ASN C C 13 175.931 0.300 . 1 . . . . . 64 ASN C . 15700 1 668 . 1 1 64 64 ASN CA C 13 55.617 0.400 . 1 . . . . . 64 ASN CA . 15700 1 669 . 1 1 64 64 ASN CB C 13 40.640 0.400 . 1 . . . . . 64 ASN CB . 15700 1 670 . 1 1 64 64 ASN N N 15 122.104 0.400 . 1 . . . . . 64 ASN N . 15700 1 671 . 1 1 64 64 ASN ND2 N 15 117.326 0.400 . 1 . . . . . 64 ASN ND2 . 15700 1 672 . 1 1 65 65 CYS H H 1 9.065 0.030 . 1 . . . . . 65 CYS H . 15700 1 673 . 1 1 65 65 CYS HA H 1 4.979 0.030 . 1 . . . . . 65 CYS HA . 15700 1 674 . 1 1 65 65 CYS HB2 H 1 3.313 0.030 . 2 . . . . . 65 CYS HB2 . 15700 1 675 . 1 1 65 65 CYS HB3 H 1 2.645 0.030 . 2 . . . . . 65 CYS HB3 . 15700 1 676 . 1 1 65 65 CYS C C 13 176.291 0.300 . 1 . . . . . 65 CYS C . 15700 1 677 . 1 1 65 65 CYS CA C 13 59.027 0.400 . 1 . . . . . 65 CYS CA . 15700 1 678 . 1 1 65 65 CYS CB C 13 32.030 0.400 . 1 . . . . . 65 CYS CB . 15700 1 679 . 1 1 65 65 CYS N N 15 120.368 0.400 . 1 . . . . . 65 CYS N . 15700 1 680 . 1 1 66 66 GLU H H 1 7.281 0.030 . 1 . . . . . 66 GLU H . 15700 1 681 . 1 1 66 66 GLU HA H 1 4.046 0.030 . 1 . . . . . 66 GLU HA . 15700 1 682 . 1 1 66 66 GLU HB2 H 1 2.192 0.030 . 2 . . . . . 66 GLU HB2 . 15700 1 683 . 1 1 66 66 GLU HB3 H 1 2.371 0.030 . 2 . . . . . 66 GLU HB3 . 15700 1 684 . 1 1 66 66 GLU HG2 H 1 2.002 0.030 . 2 . . . . . 66 GLU HG2 . 15700 1 685 . 1 1 66 66 GLU HG3 H 1 2.002 0.030 . 2 . . . . . 66 GLU HG3 . 15700 1 686 . 1 1 66 66 GLU C C 13 175.211 0.300 . 1 . . . . . 66 GLU C . 15700 1 687 . 1 1 66 66 GLU CA C 13 58.591 0.400 . 1 . . . . . 66 GLU CA . 15700 1 688 . 1 1 66 66 GLU CB C 13 27.067 0.400 . 1 . . . . . 66 GLU CB . 15700 1 689 . 1 1 66 66 GLU CG C 13 37.207 0.400 . 1 . . . . . 66 GLU CG . 15700 1 690 . 1 1 66 66 GLU N N 15 115.012 0.400 . 1 . . . . . 66 GLU N . 15700 1 691 . 1 1 67 67 LYS H H 1 8.481 0.030 . 1 . . . . . 67 LYS H . 15700 1 692 . 1 1 67 67 LYS HA H 1 4.326 0.030 . 1 . . . . . 67 LYS HA . 15700 1 693 . 1 1 67 67 LYS HB2 H 1 2.100 0.030 . 2 . . . . . 67 LYS HB2 . 15700 1 694 . 1 1 67 67 LYS HB3 H 1 1.681 0.030 . 2 . . . . . 67 LYS HB3 . 15700 1 695 . 1 1 67 67 LYS HD2 H 1 1.898 0.030 . 2 . . . . . 67 LYS HD2 . 15700 1 696 . 1 1 67 67 LYS HD3 H 1 1.605 0.030 . 2 . . . . . 67 LYS HD3 . 15700 1 697 . 1 1 67 67 LYS HE2 H 1 3.076 0.030 . 2 . . . . . 67 LYS HE2 . 15700 1 698 . 1 1 67 67 LYS HE3 H 1 3.076 0.030 . 2 . . . . . 67 LYS HE3 . 15700 1 699 . 1 1 67 67 LYS HG2 H 1 1.392 0.030 . 2 . . . . . 67 LYS HG2 . 15700 1 700 . 1 1 67 67 LYS HG3 H 1 1.312 0.030 . 2 . . . . . 67 LYS HG3 . 15700 1 701 . 1 1 67 67 LYS C C 13 177.923 0.300 . 1 . . . . . 67 LYS C . 15700 1 702 . 1 1 67 67 LYS CA C 13 57.628 0.400 . 1 . . . . . 67 LYS CA . 15700 1 703 . 1 1 67 67 LYS CB C 13 33.617 0.400 . 1 . . . . . 67 LYS CB . 15700 1 704 . 1 1 67 67 LYS CD C 13 28.980 0.400 . 1 . . . . . 67 LYS CD . 15700 1 705 . 1 1 67 67 LYS CE C 13 42.190 0.400 . 1 . . . . . 67 LYS CE . 15700 1 706 . 1 1 67 67 LYS CG C 13 25.420 0.400 . 1 . . . . . 67 LYS CG . 15700 1 707 . 1 1 67 67 LYS N N 15 123.514 0.400 . 1 . . . . . 67 LYS N . 15700 1 708 . 1 1 68 68 ILE H H 1 8.867 0.030 . 1 . . . . . 68 ILE H . 15700 1 709 . 1 1 68 68 ILE HA H 1 4.976 0.030 . 1 . . . . . 68 ILE HA . 15700 1 710 . 1 1 68 68 ILE HB H 1 1.826 0.030 . 1 . . . . . 68 ILE HB . 15700 1 711 . 1 1 68 68 ILE HD11 H 1 0.851 0.030 . 1 . . . . . 68 ILE HD1 . 15700 1 712 . 1 1 68 68 ILE HD12 H 1 0.851 0.030 . 1 . . . . . 68 ILE HD1 . 15700 1 713 . 1 1 68 68 ILE HD13 H 1 0.851 0.030 . 1 . . . . . 68 ILE HD1 . 15700 1 714 . 1 1 68 68 ILE HG12 H 1 1.801 0.030 . 2 . . . . . 68 ILE HG12 . 15700 1 715 . 1 1 68 68 ILE HG13 H 1 0.934 0.030 . 2 . . . . . 68 ILE HG13 . 15700 1 716 . 1 1 68 68 ILE HG21 H 1 0.804 0.030 . 1 . . . . . 68 ILE HG2 . 15700 1 717 . 1 1 68 68 ILE HG22 H 1 0.804 0.030 . 1 . . . . . 68 ILE HG2 . 15700 1 718 . 1 1 68 68 ILE HG23 H 1 0.804 0.030 . 1 . . . . . 68 ILE HG2 . 15700 1 719 . 1 1 68 68 ILE C C 13 175.018 0.300 . 1 . . . . . 68 ILE C . 15700 1 720 . 1 1 68 68 ILE CA C 13 60.919 0.400 . 1 . . . . . 68 ILE CA . 15700 1 721 . 1 1 68 68 ILE CB C 13 37.090 0.400 . 1 . . . . . 68 ILE CB . 15700 1 722 . 1 1 68 68 ILE CD1 C 13 12.890 0.400 . 1 . . . . . 68 ILE CD1 . 15700 1 723 . 1 1 68 68 ILE CG1 C 13 28.830 0.400 . 1 . . . . . 68 ILE CG1 . 15700 1 724 . 1 1 68 68 ILE CG2 C 13 17.380 0.400 . 1 . . . . . 68 ILE CG2 . 15700 1 725 . 1 1 68 68 ILE N N 15 133.478 0.400 . 1 . . . . . 68 ILE N . 15700 1 726 . 1 1 69 69 GLN H H 1 9.269 0.030 . 1 . . . . . 69 GLN H . 15700 1 727 . 1 1 69 69 GLN HA H 1 5.036 0.030 . 1 . . . . . 69 GLN HA . 15700 1 728 . 1 1 69 69 GLN HB2 H 1 2.408 0.030 . 2 . . . . . 69 GLN HB2 . 15700 1 729 . 1 1 69 69 GLN HB3 H 1 1.770 0.030 . 2 . . . . . 69 GLN HB3 . 15700 1 730 . 1 1 69 69 GLN HG2 H 1 2.243 0.030 . 2 . . . . . 69 GLN HG2 . 15700 1 731 . 1 1 69 69 GLN HG3 H 1 2.179 0.030 . 2 . . . . . 69 GLN HG3 . 15700 1 732 . 1 1 69 69 GLN C C 13 173.607 0.300 . 1 . . . . . 69 GLN C . 15700 1 733 . 1 1 69 69 GLN CA C 13 53.419 0.400 . 1 . . . . . 69 GLN CA . 15700 1 734 . 1 1 69 69 GLN CB C 13 34.997 0.400 . 1 . . . . . 69 GLN CB . 15700 1 735 . 1 1 69 69 GLN CG C 13 32.780 0.400 . 1 . . . . . 69 GLN CG . 15700 1 736 . 1 1 69 69 GLN N N 15 125.104 0.400 . 1 . . . . . 69 GLN N . 15700 1 737 . 1 1 70 70 HIS H H 1 8.829 0.030 . 1 . . . . . 70 HIS H . 15700 1 738 . 1 1 70 70 HIS HA H 1 4.865 0.030 . 1 . . . . . 70 HIS HA . 15700 1 739 . 1 1 70 70 HIS HB2 H 1 3.268 0.030 . 2 . . . . . 70 HIS HB2 . 15700 1 740 . 1 1 70 70 HIS HB3 H 1 3.220 0.030 . 2 . . . . . 70 HIS HB3 . 15700 1 741 . 1 1 70 70 HIS C C 13 174.852 0.300 . 1 . . . . . 70 HIS C . 15700 1 742 . 1 1 70 70 HIS CA C 13 56.304 0.400 . 1 . . . . . 70 HIS CA . 15700 1 743 . 1 1 70 70 HIS CB C 13 30.050 0.400 . 1 . . . . . 70 HIS CB . 15700 1 744 . 1 1 70 70 HIS N N 15 118.576 0.400 . 1 . . . . . 70 HIS N . 15700 1 745 . 1 1 71 71 ALA H H 1 7.768 0.030 . 1 . . . . . 71 ALA H . 15700 1 746 . 1 1 71 71 ALA HA H 1 3.977 0.030 . 1 . . . . . 71 ALA HA . 15700 1 747 . 1 1 71 71 ALA HB1 H 1 1.365 0.030 . 1 . . . . . 71 ALA HB . 15700 1 748 . 1 1 71 71 ALA HB2 H 1 1.365 0.030 . 1 . . . . . 71 ALA HB . 15700 1 749 . 1 1 71 71 ALA HB3 H 1 1.365 0.030 . 1 . . . . . 71 ALA HB . 15700 1 750 . 1 1 71 71 ALA C C 13 175.433 0.300 . 1 . . . . . 71 ALA C . 15700 1 751 . 1 1 71 71 ALA CA C 13 54.393 0.400 . 1 . . . . . 71 ALA CA . 15700 1 752 . 1 1 71 71 ALA CB C 13 18.000 0.400 . 1 . . . . . 71 ALA CB . 15700 1 753 . 1 1 71 71 ALA N N 15 121.438 0.400 . 1 . . . . . 71 ALA N . 15700 1 754 . 1 1 72 72 GLN H H 1 7.227 0.030 . 1 . . . . . 72 GLN H . 15700 1 755 . 1 1 72 72 GLN HA H 1 4.371 0.030 . 1 . . . . . 72 GLN HA . 15700 1 756 . 1 1 72 72 GLN HB2 H 1 2.660 0.030 . 2 . . . . . 72 GLN HB2 . 15700 1 757 . 1 1 72 72 GLN HB3 H 1 2.078 0.030 . 2 . . . . . 72 GLN HB3 . 15700 1 758 . 1 1 72 72 GLN HE21 H 1 7.857 0.030 . 2 . . . . . 72 GLN HE21 . 15700 1 759 . 1 1 72 72 GLN HE22 H 1 7.183 0.030 . 2 . . . . . 72 GLN HE22 . 15700 1 760 . 1 1 72 72 GLN HG2 H 1 2.658 0.030 . 2 . . . . . 72 GLN HG2 . 15700 1 761 . 1 1 72 72 GLN HG3 H 1 2.431 0.030 . 2 . . . . . 72 GLN HG3 . 15700 1 762 . 1 1 72 72 GLN C C 13 173.053 0.300 . 1 . . . . . 72 GLN C . 15700 1 763 . 1 1 72 72 GLN CA C 13 54.290 0.400 . 1 . . . . . 72 GLN CA . 15700 1 764 . 1 1 72 72 GLN CB C 13 28.623 0.400 . 1 . . . . . 72 GLN CB . 15700 1 765 . 1 1 72 72 GLN CG C 13 29.320 0.400 . 1 . . . . . 72 GLN CG . 15700 1 766 . 1 1 72 72 GLN N N 15 115.858 0.400 . 1 . . . . . 72 GLN N . 15700 1 767 . 1 1 72 72 GLN NE2 N 15 113.301 0.400 . 1 . . . . . 72 GLN NE2 . 15700 1 768 . 1 1 73 73 GLN H H 1 8.481 0.030 . 1 . . . . . 73 GLN H . 15700 1 769 . 1 1 73 73 GLN HA H 1 3.570 0.030 . 1 . . . . . 73 GLN HA . 15700 1 770 . 1 1 73 73 GLN HB2 H 1 2.050 0.030 . 2 . . . . . 73 GLN HB2 . 15700 1 771 . 1 1 73 73 GLN HB3 H 1 1.870 0.030 . 2 . . . . . 73 GLN HB3 . 15700 1 772 . 1 1 73 73 GLN HE21 H 1 7.654 0.030 . 2 . . . . . 73 GLN HE21 . 15700 1 773 . 1 1 73 73 GLN HE22 H 1 6.612 0.030 . 2 . . . . . 73 GLN HE22 . 15700 1 774 . 1 1 73 73 GLN HG2 H 1 2.647 0.030 . 2 . . . . . 73 GLN HG2 . 15700 1 775 . 1 1 73 73 GLN HG3 H 1 2.647 0.030 . 2 . . . . . 73 GLN HG3 . 15700 1 776 . 1 1 73 73 GLN C C 13 174.243 0.300 . 1 . . . . . 73 GLN C . 15700 1 777 . 1 1 73 73 GLN CA C 13 60.206 0.400 . 1 . . . . . 73 GLN CA . 15700 1 778 . 1 1 73 73 GLN CB C 13 28.850 0.400 . 1 . . . . . 73 GLN CB . 15700 1 779 . 1 1 73 73 GLN CG C 13 34.410 0.400 . 1 . . . . . 73 GLN CG . 15700 1 780 . 1 1 73 73 GLN N N 15 116.433 0.400 . 1 . . . . . 73 GLN N . 15700 1 781 . 1 1 73 73 GLN NE2 N 15 110.717 0.400 . 1 . . . . . 73 GLN NE2 . 15700 1 782 . 1 1 74 74 THR H H 1 7.211 0.030 . 1 . . . . . 74 THR H . 15700 1 783 . 1 1 74 74 THR HA H 1 4.160 0.030 . 1 . . . . . 74 THR HA . 15700 1 784 . 1 1 74 74 THR HB H 1 3.485 0.030 . 1 . . . . . 74 THR HB . 15700 1 785 . 1 1 74 74 THR HG21 H 1 0.903 0.030 . 1 . . . . . 74 THR HG2 . 15700 1 786 . 1 1 74 74 THR HG22 H 1 0.903 0.030 . 1 . . . . . 74 THR HG2 . 15700 1 787 . 1 1 74 74 THR HG23 H 1 0.903 0.030 . 1 . . . . . 74 THR HG2 . 15700 1 788 . 1 1 74 74 THR C C 13 171.836 0.300 . 1 . . . . . 74 THR C . 15700 1 789 . 1 1 74 74 THR CA C 13 59.072 0.400 . 1 . . . . . 74 THR CA . 15700 1 790 . 1 1 74 74 THR CB C 13 71.560 0.400 . 1 . . . . . 74 THR CB . 15700 1 791 . 1 1 74 74 THR CG2 C 13 21.900 0.400 . 1 . . . . . 74 THR CG2 . 15700 1 792 . 1 1 74 74 THR N N 15 108.717 0.400 . 1 . . . . . 74 THR N . 15700 1 793 . 1 1 75 75 CYS H H 1 7.676 0.030 . 1 . . . . . 75 CYS H . 15700 1 794 . 1 1 75 75 CYS HA H 1 4.158 0.030 . 1 . . . . . 75 CYS HA . 15700 1 795 . 1 1 75 75 CYS HB2 H 1 3.008 0.030 . 2 . . . . . 75 CYS HB2 . 15700 1 796 . 1 1 75 75 CYS HB3 H 1 2.787 0.030 . 2 . . . . . 75 CYS HB3 . 15700 1 797 . 1 1 75 75 CYS C C 13 178.781 0.300 . 1 . . . . . 75 CYS C . 15700 1 798 . 1 1 75 75 CYS CA C 13 58.661 0.400 . 1 . . . . . 75 CYS CA . 15700 1 799 . 1 1 75 75 CYS CB C 13 30.840 0.400 . 1 . . . . . 75 CYS CB . 15700 1 800 . 1 1 75 75 CYS N N 15 123.108 0.400 . 1 . . . . . 75 CYS N . 15700 1 801 . 1 1 76 76 GLU H H 1 9.203 0.030 . 1 . . . . . 76 GLU H . 15700 1 802 . 1 1 76 76 GLU HA H 1 4.187 0.030 . 1 . . . . . 76 GLU HA . 15700 1 803 . 1 1 76 76 GLU HB2 H 1 2.119 0.030 . 2 . . . . . 76 GLU HB2 . 15700 1 804 . 1 1 76 76 GLU HB3 H 1 2.154 0.030 . 2 . . . . . 76 GLU HB3 . 15700 1 805 . 1 1 76 76 GLU HG2 H 1 2.186 0.030 . 2 . . . . . 76 GLU HG2 . 15700 1 806 . 1 1 76 76 GLU HG3 H 1 2.118 0.030 . 2 . . . . . 76 GLU HG3 . 15700 1 807 . 1 1 76 76 GLU C C 13 175.488 0.300 . 1 . . . . . 76 GLU C . 15700 1 808 . 1 1 76 76 GLU CA C 13 57.306 0.400 . 1 . . . . . 76 GLU CA . 15700 1 809 . 1 1 76 76 GLU CB C 13 29.347 0.400 . 1 . . . . . 76 GLU CB . 15700 1 810 . 1 1 76 76 GLU CG C 13 34.750 0.400 . 1 . . . . . 76 GLU CG . 15700 1 811 . 1 1 76 76 GLU N N 15 129.817 0.400 . 1 . . . . . 76 GLU N . 15700 1 812 . 1 1 77 77 GLU H H 1 9.496 0.030 . 1 . . . . . 77 GLU H . 15700 1 813 . 1 1 77 77 GLU HA H 1 4.599 0.030 . 1 . . . . . 77 GLU HA . 15700 1 814 . 1 1 77 77 GLU HB2 H 1 1.940 0.030 . 2 . . . . . 77 GLU HB2 . 15700 1 815 . 1 1 77 77 GLU HB3 H 1 2.416 0.030 . 2 . . . . . 77 GLU HB3 . 15700 1 816 . 1 1 77 77 GLU HG2 H 1 2.341 0.030 . 2 . . . . . 77 GLU HG2 . 15700 1 817 . 1 1 77 77 GLU HG3 H 1 2.135 0.030 . 2 . . . . . 77 GLU HG3 . 15700 1 818 . 1 1 77 77 GLU C C 13 177.148 0.300 . 1 . . . . . 77 GLU C . 15700 1 819 . 1 1 77 77 GLU CA C 13 57.554 0.400 . 1 . . . . . 77 GLU CA . 15700 1 820 . 1 1 77 77 GLU CB C 13 31.980 0.400 . 1 . . . . . 77 GLU CB . 15700 1 821 . 1 1 77 77 GLU CG C 13 35.737 0.400 . 1 . . . . . 77 GLU CG . 15700 1 822 . 1 1 77 77 GLU N N 15 124.795 0.400 . 1 . . . . . 77 GLU N . 15700 1 823 . 1 1 78 78 CYS H H 1 8.967 0.030 . 1 . . . . . 78 CYS H . 15700 1 824 . 1 1 78 78 CYS HA H 1 5.073 0.030 . 1 . . . . . 78 CYS HA . 15700 1 825 . 1 1 78 78 CYS HB2 H 1 3.355 0.030 . 2 . . . . . 78 CYS HB2 . 15700 1 826 . 1 1 78 78 CYS HB3 H 1 2.671 0.030 . 2 . . . . . 78 CYS HB3 . 15700 1 827 . 1 1 78 78 CYS C C 13 176.374 0.300 . 1 . . . . . 78 CYS C . 15700 1 828 . 1 1 78 78 CYS CA C 13 58.537 0.400 . 1 . . . . . 78 CYS CA . 15700 1 829 . 1 1 78 78 CYS CB C 13 31.597 0.400 . 1 . . . . . 78 CYS CB . 15700 1 830 . 1 1 78 78 CYS N N 15 119.692 0.400 . 1 . . . . . 78 CYS N . 15700 1 831 . 1 1 79 79 SER H H 1 7.474 0.030 . 1 . . . . . 79 SER H . 15700 1 832 . 1 1 79 79 SER HA H 1 4.113 0.030 . 1 . . . . . 79 SER HA . 15700 1 833 . 1 1 79 79 SER HB2 H 1 4.034 0.030 . 2 . . . . . 79 SER HB2 . 15700 1 834 . 1 1 79 79 SER HB3 H 1 4.123 0.030 . 2 . . . . . 79 SER HB3 . 15700 1 835 . 1 1 79 79 SER C C 13 172.915 0.300 . 1 . . . . . 79 SER C . 15700 1 836 . 1 1 79 79 SER CA C 13 60.440 0.400 . 1 . . . . . 79 SER CA . 15700 1 837 . 1 1 79 79 SER CB C 13 61.421 0.400 . 1 . . . . . 79 SER CB . 15700 1 838 . 1 1 79 79 SER N N 15 113.385 0.400 . 1 . . . . . 79 SER N . 15700 1 839 . 1 1 80 80 THR H H 1 7.907 0.030 . 1 . . . . . 80 THR H . 15700 1 840 . 1 1 80 80 THR HA H 1 3.913 0.030 . 1 . . . . . 80 THR HA . 15700 1 841 . 1 1 80 80 THR HB H 1 4.124 0.030 . 1 . . . . . 80 THR HB . 15700 1 842 . 1 1 80 80 THR HG21 H 1 1.257 0.030 . 1 . . . . . 80 THR HG2 . 15700 1 843 . 1 1 80 80 THR HG22 H 1 1.257 0.030 . 1 . . . . . 80 THR HG2 . 15700 1 844 . 1 1 80 80 THR HG23 H 1 1.257 0.030 . 1 . . . . . 80 THR HG2 . 15700 1 845 . 1 1 80 80 THR C C 13 172.306 0.300 . 1 . . . . . 80 THR C . 15700 1 846 . 1 1 80 80 THR CA C 13 65.262 0.400 . 1 . . . . . 80 THR CA . 15700 1 847 . 1 1 80 80 THR CB C 13 69.910 0.400 . 1 . . . . . 80 THR CB . 15700 1 848 . 1 1 80 80 THR CG2 C 13 21.023 0.400 . 1 . . . . . 80 THR CG2 . 15700 1 849 . 1 1 80 80 THR N N 15 120.005 0.400 . 1 . . . . . 80 THR N . 15700 1 850 . 1 1 81 81 LEU H H 1 8.556 0.030 . 1 . . . . . 81 LEU H . 15700 1 851 . 1 1 81 81 LEU HA H 1 4.172 0.030 . 1 . . . . . 81 LEU HA . 15700 1 852 . 1 1 81 81 LEU HB2 H 1 1.935 0.030 . 2 . . . . . 81 LEU HB2 . 15700 1 853 . 1 1 81 81 LEU HB3 H 1 1.507 0.030 . 2 . . . . . 81 LEU HB3 . 15700 1 854 . 1 1 81 81 LEU HD11 H 1 0.932 0.030 . 2 . . . . . 81 LEU HD1 . 15700 1 855 . 1 1 81 81 LEU HD12 H 1 0.932 0.030 . 2 . . . . . 81 LEU HD1 . 15700 1 856 . 1 1 81 81 LEU HD13 H 1 0.932 0.030 . 2 . . . . . 81 LEU HD1 . 15700 1 857 . 1 1 81 81 LEU HD21 H 1 0.957 0.030 . 2 . . . . . 81 LEU HD2 . 15700 1 858 . 1 1 81 81 LEU HD22 H 1 0.957 0.030 . 2 . . . . . 81 LEU HD2 . 15700 1 859 . 1 1 81 81 LEU HD23 H 1 0.957 0.030 . 2 . . . . . 81 LEU HD2 . 15700 1 860 . 1 1 81 81 LEU HG H 1 1.179 0.030 . 1 . . . . . 81 LEU HG . 15700 1 861 . 1 1 81 81 LEU C C 13 177.121 0.300 . 1 . . . . . 81 LEU C . 15700 1 862 . 1 1 81 81 LEU CA C 13 54.996 0.400 . 1 . . . . . 81 LEU CA . 15700 1 863 . 1 1 81 81 LEU CB C 13 42.147 0.400 . 1 . . . . . 81 LEU CB . 15700 1 864 . 1 1 81 81 LEU CD1 C 13 26.140 0.400 . 1 . . . . . 81 LEU CD1 . 15700 1 865 . 1 1 81 81 LEU CD2 C 13 23.480 0.400 . 1 . . . . . 81 LEU CD2 . 15700 1 866 . 1 1 81 81 LEU CG C 13 27.340 0.400 . 1 . . . . . 81 LEU CG . 15700 1 867 . 1 1 81 81 LEU N N 15 128.272 0.400 . 1 . . . . . 81 LEU N . 15700 1 868 . 1 1 82 82 PHE H H 1 9.251 0.030 . 1 . . . . . 82 PHE H . 15700 1 869 . 1 1 82 82 PHE HA H 1 4.576 0.030 . 1 . . . . . 82 PHE HA . 15700 1 870 . 1 1 82 82 PHE HB2 H 1 3.302 0.030 . 2 . . . . . 82 PHE HB2 . 15700 1 871 . 1 1 82 82 PHE HB3 H 1 2.939 0.030 . 2 . . . . . 82 PHE HB3 . 15700 1 872 . 1 1 82 82 PHE HD1 H 1 6.800 0.030 . 1 . . . . . 82 PHE HD1 . 15700 1 873 . 1 1 82 82 PHE HD2 H 1 6.800 0.030 . 1 . . . . . 82 PHE HD2 . 15700 1 874 . 1 1 82 82 PHE C C 13 177.785 0.300 . 1 . . . . . 82 PHE C . 15700 1 875 . 1 1 82 82 PHE CA C 13 56.470 0.400 . 1 . . . . . 82 PHE CA . 15700 1 876 . 1 1 82 82 PHE CB C 13 38.210 0.400 . 1 . . . . . 82 PHE CB . 15700 1 877 . 1 1 82 82 PHE CD1 C 13 132.220 0.400 . 1 . . . . . 82 PHE CD1 . 15700 1 878 . 1 1 82 82 PHE N N 15 129.268 0.400 . 1 . . . . . 82 PHE N . 15700 1 879 . 1 1 83 83 GLY H H 1 7.047 0.030 . 1 . . . . . 83 GLY H . 15700 1 880 . 1 1 83 83 GLY HA2 H 1 4.783 0.030 . 2 . . . . . 83 GLY HA2 . 15700 1 881 . 1 1 83 83 GLY HA3 H 1 3.876 0.030 . 2 . . . . . 83 GLY HA3 . 15700 1 882 . 1 1 83 83 GLY C C 13 171.642 0.300 . 1 . . . . . 83 GLY C . 15700 1 883 . 1 1 83 83 GLY CA C 13 45.826 0.400 . 1 . . . . . 83 GLY CA . 15700 1 884 . 1 1 83 83 GLY N N 15 102.168 0.400 . 1 . . . . . 83 GLY N . 15700 1 885 . 1 1 84 84 GLU H H 1 8.444 0.030 . 1 . . . . . 84 GLU H . 15700 1 886 . 1 1 84 84 GLU HA H 1 4.111 0.030 . 1 . . . . . 84 GLU HA . 15700 1 887 . 1 1 84 84 GLU HB2 H 1 2.284 0.030 . 2 . . . . . 84 GLU HB2 . 15700 1 888 . 1 1 84 84 GLU HB3 H 1 2.342 0.030 . 2 . . . . . 84 GLU HB3 . 15700 1 889 . 1 1 84 84 GLU HG2 H 1 2.537 0.030 . 2 . . . . . 84 GLU HG2 . 15700 1 890 . 1 1 84 84 GLU HG3 H 1 2.463 0.030 . 2 . . . . . 84 GLU HG3 . 15700 1 891 . 1 1 84 84 GLU C C 13 177.259 0.300 . 1 . . . . . 84 GLU C . 15700 1 892 . 1 1 84 84 GLU CA C 13 59.438 0.400 . 1 . . . . . 84 GLU CA . 15700 1 893 . 1 1 84 84 GLU CB C 13 30.670 0.400 . 1 . . . . . 84 GLU CB . 15700 1 894 . 1 1 84 84 GLU CG C 13 36.497 0.400 . 1 . . . . . 84 GLU CG . 15700 1 895 . 1 1 84 84 GLU N N 15 127.546 0.400 . 1 . . . . . 84 GLU N . 15700 1 896 . 1 1 85 85 TYR H H 1 9.344 0.030 . 1 . . . . . 85 TYR H . 15700 1 897 . 1 1 85 85 TYR HA H 1 4.599 0.030 . 1 . . . . . 85 TYR HA . 15700 1 898 . 1 1 85 85 TYR HB2 H 1 2.808 0.030 . 2 . . . . . 85 TYR HB2 . 15700 1 899 . 1 1 85 85 TYR HB3 H 1 2.538 0.030 . 2 . . . . . 85 TYR HB3 . 15700 1 900 . 1 1 85 85 TYR HD1 H 1 7.105 0.030 . 1 . . . . . 85 TYR HD1 . 15700 1 901 . 1 1 85 85 TYR HD2 H 1 7.105 0.030 . 1 . . . . . 85 TYR HD2 . 15700 1 902 . 1 1 85 85 TYR C C 13 173.302 0.300 . 1 . . . . . 85 TYR C . 15700 1 903 . 1 1 85 85 TYR CA C 13 57.261 0.400 . 1 . . . . . 85 TYR CA . 15700 1 904 . 1 1 85 85 TYR CB C 13 40.850 0.400 . 1 . . . . . 85 TYR CB . 15700 1 905 . 1 1 85 85 TYR CD1 C 13 127.642 0.400 . 1 . . . . . 85 TYR CD1 . 15700 1 906 . 1 1 85 85 TYR N N 15 118.936 0.400 . 1 . . . . . 85 TYR N . 15700 1 907 . 1 1 86 86 TYR H H 1 7.323 0.030 . 1 . . . . . 86 TYR H . 15700 1 908 . 1 1 86 86 TYR HA H 1 5.298 0.030 . 1 . . . . . 86 TYR HA . 15700 1 909 . 1 1 86 86 TYR HB2 H 1 2.673 0.030 . 2 . . . . . 86 TYR HB2 . 15700 1 910 . 1 1 86 86 TYR HB3 H 1 2.135 0.030 . 2 . . . . . 86 TYR HB3 . 15700 1 911 . 1 1 86 86 TYR C C 13 172.804 0.300 . 1 . . . . . 86 TYR C . 15700 1 912 . 1 1 86 86 TYR CA C 13 54.041 0.400 . 1 . . . . . 86 TYR CA . 15700 1 913 . 1 1 86 86 TYR CB C 13 40.987 0.400 . 1 . . . . . 86 TYR CB . 15700 1 914 . 1 1 86 86 TYR N N 15 124.965 0.400 . 1 . . . . . 86 TYR N . 15700 1 915 . 1 1 87 87 CYS H H 1 7.046 0.030 . 1 . . . . . 87 CYS H . 15700 1 916 . 1 1 87 87 CYS HA H 1 3.842 0.030 . 1 . . . . . 87 CYS HA . 15700 1 917 . 1 1 87 87 CYS HB2 H 1 2.661 0.030 . 2 . . . . . 87 CYS HB2 . 15700 1 918 . 1 1 87 87 CYS HB3 H 1 2.407 0.030 . 2 . . . . . 87 CYS HB3 . 15700 1 919 . 1 1 87 87 CYS C C 13 174.243 0.300 . 1 . . . . . 87 CYS C . 15700 1 920 . 1 1 87 87 CYS CA C 13 56.377 0.400 . 1 . . . . . 87 CYS CA . 15700 1 921 . 1 1 87 87 CYS CB C 13 33.230 0.400 . 1 . . . . . 87 CYS CB . 15700 1 922 . 1 1 87 87 CYS N N 15 128.735 0.400 . 1 . . . . . 87 CYS N . 15700 1 923 . 1 1 88 88 ASP H H 1 8.002 0.030 . 1 . . . . . 88 ASP H . 15700 1 924 . 1 1 88 88 ASP HA H 1 3.761 0.030 . 1 . . . . . 88 ASP HA . 15700 1 925 . 1 1 88 88 ASP HB2 H 1 2.608 0.030 . 2 . . . . . 88 ASP HB2 . 15700 1 926 . 1 1 88 88 ASP HB3 H 1 2.213 0.030 . 2 . . . . . 88 ASP HB3 . 15700 1 927 . 1 1 88 88 ASP C C 13 173.579 0.300 . 1 . . . . . 88 ASP C . 15700 1 928 . 1 1 88 88 ASP CA C 13 53.958 0.400 . 1 . . . . . 88 ASP CA . 15700 1 929 . 1 1 88 88 ASP CB C 13 41.240 0.400 . 1 . . . . . 88 ASP CB . 15700 1 930 . 1 1 88 88 ASP N N 15 127.013 0.400 . 1 . . . . . 88 ASP N . 15700 1 931 . 1 1 89 89 ILE H H 1 7.972 0.030 . 1 . . . . . 89 ILE H . 15700 1 932 . 1 1 89 89 ILE HA H 1 3.660 0.030 . 1 . . . . . 89 ILE HA . 15700 1 933 . 1 1 89 89 ILE HB H 1 1.049 0.030 . 1 . . . . . 89 ILE HB . 15700 1 934 . 1 1 89 89 ILE HD11 H 1 0.220 0.030 . 1 . . . . . 89 ILE HD1 . 15700 1 935 . 1 1 89 89 ILE HD12 H 1 0.220 0.030 . 1 . . . . . 89 ILE HD1 . 15700 1 936 . 1 1 89 89 ILE HD13 H 1 0.220 0.030 . 1 . . . . . 89 ILE HD1 . 15700 1 937 . 1 1 89 89 ILE HG12 H 1 1.171 0.030 . 2 . . . . . 89 ILE HG12 . 15700 1 938 . 1 1 89 89 ILE HG13 H 1 0.723 0.030 . 2 . . . . . 89 ILE HG13 . 15700 1 939 . 1 1 89 89 ILE HG21 H 1 0.858 0.030 . 1 . . . . . 89 ILE HG2 . 15700 1 940 . 1 1 89 89 ILE HG22 H 1 0.858 0.030 . 1 . . . . . 89 ILE HG2 . 15700 1 941 . 1 1 89 89 ILE HG23 H 1 0.858 0.030 . 1 . . . . . 89 ILE HG2 . 15700 1 942 . 1 1 89 89 ILE C C 13 177.259 0.300 . 1 . . . . . 89 ILE C . 15700 1 943 . 1 1 89 89 ILE CA C 13 63.107 0.400 . 1 . . . . . 89 ILE CA . 15700 1 944 . 1 1 89 89 ILE CB C 13 39.430 0.400 . 1 . . . . . 89 ILE CB . 15700 1 945 . 1 1 89 89 ILE CD1 C 13 12.590 0.400 . 1 . . . . . 89 ILE CD1 . 15700 1 946 . 1 1 89 89 ILE CG1 C 13 27.270 0.400 . 1 . . . . . 89 ILE CG1 . 15700 1 947 . 1 1 89 89 ILE CG2 C 13 17.417 0.400 . 1 . . . . . 89 ILE CG2 . 15700 1 948 . 1 1 89 89 ILE N N 15 120.357 0.400 . 1 . . . . . 89 ILE N . 15700 1 949 . 1 1 90 90 CYS H H 1 8.554 0.030 . 1 . . . . . 90 CYS H . 15700 1 950 . 1 1 90 90 CYS HA H 1 3.677 0.030 . 1 . . . . . 90 CYS HA . 15700 1 951 . 1 1 90 90 CYS HB2 H 1 2.821 0.030 . 2 . . . . . 90 CYS HB2 . 15700 1 952 . 1 1 90 90 CYS HB3 H 1 2.510 0.030 . 2 . . . . . 90 CYS HB3 . 15700 1 953 . 1 1 90 90 CYS C C 13 175.128 0.300 . 1 . . . . . 90 CYS C . 15700 1 954 . 1 1 90 90 CYS CA C 13 60.791 0.400 . 1 . . . . . 90 CYS CA . 15700 1 955 . 1 1 90 90 CYS CB C 13 30.427 0.400 . 1 . . . . . 90 CYS CB . 15700 1 956 . 1 1 90 90 CYS N N 15 119.564 0.400 . 1 . . . . . 90 CYS N . 15700 1 957 . 1 1 91 91 HIS H H 1 7.364 0.030 . 1 . . . . . 91 HIS H . 15700 1 958 . 1 1 91 91 HIS HA H 1 3.512 0.030 . 1 . . . . . 91 HIS HA . 15700 1 959 . 1 1 91 91 HIS HB2 H 1 2.909 0.030 . 2 . . . . . 91 HIS HB2 . 15700 1 960 . 1 1 91 91 HIS HB3 H 1 2.909 0.030 . 2 . . . . . 91 HIS HB3 . 15700 1 961 . 1 1 91 91 HIS HD2 H 1 7.127 0.030 . 1 . . . . . 91 HIS HD2 . 15700 1 962 . 1 1 91 91 HIS HE1 H 1 7.981 0.030 . 1 . . . . . 91 HIS HE1 . 15700 1 963 . 1 1 91 91 HIS C C 13 170.590 0.300 . 1 . . . . . 91 HIS C . 15700 1 964 . 1 1 91 91 HIS CA C 13 58.739 0.400 . 1 . . . . . 91 HIS CA . 15700 1 965 . 1 1 91 91 HIS CB C 13 24.810 0.400 . 1 . . . . . 91 HIS CB . 15700 1 966 . 1 1 91 91 HIS CD2 C 13 119.113 0.400 . 1 . . . . . 91 HIS CD2 . 15700 1 967 . 1 1 91 91 HIS CE1 C 13 140.149 0.400 . 1 . . . . . 91 HIS CE1 . 15700 1 968 . 1 1 91 91 HIS N N 15 111.440 0.400 . 1 . . . . . 91 HIS N . 15700 1 969 . 1 1 92 92 LEU H H 1 6.214 0.030 . 1 . . . . . 92 LEU H . 15700 1 970 . 1 1 92 92 LEU HA H 1 4.191 0.030 . 1 . . . . . 92 LEU HA . 15700 1 971 . 1 1 92 92 LEU HB2 H 1 1.525 0.030 . 2 . . . . . 92 LEU HB2 . 15700 1 972 . 1 1 92 92 LEU HB3 H 1 1.238 0.030 . 2 . . . . . 92 LEU HB3 . 15700 1 973 . 1 1 92 92 LEU HD11 H 1 1.049 0.030 . 2 . . . . . 92 LEU HD1 . 15700 1 974 . 1 1 92 92 LEU HD12 H 1 1.049 0.030 . 2 . . . . . 92 LEU HD1 . 15700 1 975 . 1 1 92 92 LEU HD13 H 1 1.049 0.030 . 2 . . . . . 92 LEU HD1 . 15700 1 976 . 1 1 92 92 LEU HD21 H 1 0.713 0.030 . 2 . . . . . 92 LEU HD2 . 15700 1 977 . 1 1 92 92 LEU HD22 H 1 0.713 0.030 . 2 . . . . . 92 LEU HD2 . 15700 1 978 . 1 1 92 92 LEU HD23 H 1 0.713 0.030 . 2 . . . . . 92 LEU HD2 . 15700 1 979 . 1 1 92 92 LEU HG H 1 1.287 0.030 . 1 . . . . . 92 LEU HG . 15700 1 980 . 1 1 92 92 LEU C C 13 173.911 0.300 . 1 . . . . . 92 LEU C . 15700 1 981 . 1 1 92 92 LEU CA C 13 53.717 0.400 . 1 . . . . . 92 LEU CA . 15700 1 982 . 1 1 92 92 LEU CB C 13 45.360 0.400 . 1 . . . . . 92 LEU CB . 15700 1 983 . 1 1 92 92 LEU CD1 C 13 25.217 0.400 . 1 . . . . . 92 LEU CD1 . 15700 1 984 . 1 1 92 92 LEU CD2 C 13 24.080 0.400 . 1 . . . . . 92 LEU CD2 . 15700 1 985 . 1 1 92 92 LEU CG C 13 27.970 0.400 . 1 . . . . . 92 LEU CG . 15700 1 986 . 1 1 92 92 LEU N N 15 115.684 0.400 . 1 . . . . . 92 LEU N . 15700 1 987 . 1 1 93 93 PHE H H 1 6.669 0.030 . 1 . . . . . 93 PHE H . 15700 1 988 . 1 1 93 93 PHE HA H 1 5.622 0.030 . 1 . . . . . 93 PHE HA . 15700 1 989 . 1 1 93 93 PHE HB2 H 1 3.088 0.030 . 2 . . . . . 93 PHE HB2 . 15700 1 990 . 1 1 93 93 PHE HB3 H 1 2.516 0.030 . 2 . . . . . 93 PHE HB3 . 15700 1 991 . 1 1 93 93 PHE HD1 H 1 6.799 0.030 . 1 . . . . . 93 PHE HD1 . 15700 1 992 . 1 1 93 93 PHE HD2 H 1 6.799 0.030 . 1 . . . . . 93 PHE HD2 . 15700 1 993 . 1 1 93 93 PHE HE1 H 1 7.106 0.030 . 1 . . . . . 93 PHE HE1 . 15700 1 994 . 1 1 93 93 PHE HE2 H 1 7.106 0.030 . 1 . . . . . 93 PHE HE2 . 15700 1 995 . 1 1 93 93 PHE C C 13 175.765 0.300 . 1 . . . . . 93 PHE C . 15700 1 996 . 1 1 93 93 PHE CA C 13 55.387 0.400 . 1 . . . . . 93 PHE CA . 15700 1 997 . 1 1 93 93 PHE CB C 13 42.700 0.400 . 1 . . . . . 93 PHE CB . 15700 1 998 . 1 1 93 93 PHE CD1 C 13 132.339 0.400 . 1 . . . . . 93 PHE CD1 . 15700 1 999 . 1 1 93 93 PHE CE1 C 13 132.239 0.400 . 1 . . . . . 93 PHE CE1 . 15700 1 1000 . 1 1 93 93 PHE N N 15 121.535 0.400 . 1 . . . . . 93 PHE N . 15700 1 1001 . 1 1 94 94 ASP H H 1 9.209 0.030 . 1 . . . . . 94 ASP H . 15700 1 1002 . 1 1 94 94 ASP HA H 1 5.819 0.030 . 1 . . . . . 94 ASP HA . 15700 1 1003 . 1 1 94 94 ASP HB2 H 1 2.972 0.030 . 2 . . . . . 94 ASP HB2 . 15700 1 1004 . 1 1 94 94 ASP HB3 H 1 2.772 0.030 . 2 . . . . . 94 ASP HB3 . 15700 1 1005 . 1 1 94 94 ASP C C 13 175.654 0.300 . 1 . . . . . 94 ASP C . 15700 1 1006 . 1 1 94 94 ASP CA C 13 53.330 0.400 . 1 . . . . . 94 ASP CA . 15700 1 1007 . 1 1 94 94 ASP CB C 13 44.720 0.400 . 1 . . . . . 94 ASP CB . 15700 1 1008 . 1 1 94 94 ASP N N 15 123.504 0.400 . 1 . . . . . 94 ASP N . 15700 1 1009 . 1 1 95 95 LYS H H 1 9.043 0.030 . 1 . . . . . 95 LYS H . 15700 1 1010 . 1 1 95 95 LYS HA H 1 4.527 0.030 . 1 . . . . . 95 LYS HA . 15700 1 1011 . 1 1 95 95 LYS HB2 H 1 2.058 0.030 . 2 . . . . . 95 LYS HB2 . 15700 1 1012 . 1 1 95 95 LYS HB3 H 1 1.919 0.030 . 2 . . . . . 95 LYS HB3 . 15700 1 1013 . 1 1 95 95 LYS HD2 H 1 1.851 0.030 . 2 . . . . . 95 LYS HD2 . 15700 1 1014 . 1 1 95 95 LYS HD3 H 1 1.851 0.030 . 2 . . . . . 95 LYS HD3 . 15700 1 1015 . 1 1 95 95 LYS HE2 H 1 3.128 0.030 . 2 . . . . . 95 LYS HE2 . 15700 1 1016 . 1 1 95 95 LYS HE3 H 1 3.128 0.030 . 2 . . . . . 95 LYS HE3 . 15700 1 1017 . 1 1 95 95 LYS HG2 H 1 1.517 0.030 . 2 . . . . . 95 LYS HG2 . 15700 1 1018 . 1 1 95 95 LYS HG3 H 1 1.645 0.030 . 2 . . . . . 95 LYS HG3 . 15700 1 1019 . 1 1 95 95 LYS C C 13 174.879 0.300 . 1 . . . . . 95 LYS C . 15700 1 1020 . 1 1 95 95 LYS CA C 13 56.620 0.400 . 1 . . . . . 95 LYS CA . 15700 1 1021 . 1 1 95 95 LYS CB C 13 33.720 0.400 . 1 . . . . . 95 LYS CB . 15700 1 1022 . 1 1 95 95 LYS CD C 13 28.997 0.400 . 1 . . . . . 95 LYS CD . 15700 1 1023 . 1 1 95 95 LYS CE C 13 41.697 0.400 . 1 . . . . . 95 LYS CE . 15700 1 1024 . 1 1 95 95 LYS CG C 13 24.540 0.400 . 1 . . . . . 95 LYS CG . 15700 1 1025 . 1 1 95 95 LYS N N 15 120.380 0.400 . 1 . . . . . 95 LYS N . 15700 1 1026 . 1 1 96 96 ASP H H 1 8.999 0.030 . 1 . . . . . 96 ASP H . 15700 1 1027 . 1 1 96 96 ASP HA H 1 4.724 0.030 . 1 . . . . . 96 ASP HA . 15700 1 1028 . 1 1 96 96 ASP HB2 H 1 2.957 0.030 . 2 . . . . . 96 ASP HB2 . 15700 1 1029 . 1 1 96 96 ASP HB3 H 1 2.647 0.030 . 2 . . . . . 96 ASP HB3 . 15700 1 1030 . 1 1 96 96 ASP C C 13 176.401 0.300 . 1 . . . . . 96 ASP C . 15700 1 1031 . 1 1 96 96 ASP CA C 13 56.147 0.400 . 1 . . . . . 96 ASP CA . 15700 1 1032 . 1 1 96 96 ASP CB C 13 40.790 0.400 . 1 . . . . . 96 ASP CB . 15700 1 1033 . 1 1 96 96 ASP N N 15 120.784 0.400 . 1 . . . . . 96 ASP N . 15700 1 1034 . 1 1 97 97 LYS H H 1 9.382 0.030 . 1 . . . . . 97 LYS H . 15700 1 1035 . 1 1 97 97 LYS HA H 1 4.473 0.030 . 1 . . . . . 97 LYS HA . 15700 1 1036 . 1 1 97 97 LYS HB2 H 1 2.131 0.030 . 2 . . . . . 97 LYS HB2 . 15700 1 1037 . 1 1 97 97 LYS HB3 H 1 1.131 0.030 . 2 . . . . . 97 LYS HB3 . 15700 1 1038 . 1 1 97 97 LYS HD2 H 1 1.736 0.030 . 2 . . . . . 97 LYS HD2 . 15700 1 1039 . 1 1 97 97 LYS HD3 H 1 1.636 0.030 . 2 . . . . . 97 LYS HD3 . 15700 1 1040 . 1 1 97 97 LYS HE2 H 1 2.982 0.030 . 2 . . . . . 97 LYS HE2 . 15700 1 1041 . 1 1 97 97 LYS HE3 H 1 2.982 0.030 . 2 . . . . . 97 LYS HE3 . 15700 1 1042 . 1 1 97 97 LYS HG2 H 1 1.308 0.030 . 2 . . . . . 97 LYS HG2 . 15700 1 1043 . 1 1 97 97 LYS HG3 H 1 1.308 0.030 . 2 . . . . . 97 LYS HG3 . 15700 1 1044 . 1 1 97 97 LYS C C 13 175.903 0.300 . 1 . . . . . 97 LYS C . 15700 1 1045 . 1 1 97 97 LYS CA C 13 54.771 0.400 . 1 . . . . . 97 LYS CA . 15700 1 1046 . 1 1 97 97 LYS CB C 13 33.270 0.400 . 1 . . . . . 97 LYS CB . 15700 1 1047 . 1 1 97 97 LYS CD C 13 29.950 0.400 . 1 . . . . . 97 LYS CD . 15700 1 1048 . 1 1 97 97 LYS CE C 13 42.340 0.400 . 1 . . . . . 97 LYS CE . 15700 1 1049 . 1 1 97 97 LYS CG C 13 25.020 0.400 . 1 . . . . . 97 LYS CG . 15700 1 1050 . 1 1 97 97 LYS N N 15 131.617 0.400 . 1 . . . . . 97 LYS N . 15700 1 1051 . 1 1 98 98 LYS H H 1 8.940 0.030 . 1 . . . . . 98 LYS H . 15700 1 1052 . 1 1 98 98 LYS HA H 1 4.118 0.030 . 1 . . . . . 98 LYS HA . 15700 1 1053 . 1 1 98 98 LYS HB2 H 1 2.043 0.030 . 2 . . . . . 98 LYS HB2 . 15700 1 1054 . 1 1 98 98 LYS HB3 H 1 1.850 0.030 . 2 . . . . . 98 LYS HB3 . 15700 1 1055 . 1 1 98 98 LYS HD2 H 1 1.847 0.030 . 2 . . . . . 98 LYS HD2 . 15700 1 1056 . 1 1 98 98 LYS HD3 H 1 1.664 0.030 . 2 . . . . . 98 LYS HD3 . 15700 1 1057 . 1 1 98 98 LYS HE2 H 1 3.014 0.030 . 2 . . . . . 98 LYS HE2 . 15700 1 1058 . 1 1 98 98 LYS HE3 H 1 3.080 0.030 . 2 . . . . . 98 LYS HE3 . 15700 1 1059 . 1 1 98 98 LYS HG2 H 1 1.392 0.030 . 2 . . . . . 98 LYS HG2 . 15700 1 1060 . 1 1 98 98 LYS HG3 H 1 1.392 0.030 . 2 . . . . . 98 LYS HG3 . 15700 1 1061 . 1 1 98 98 LYS C C 13 177.065 0.300 . 1 . . . . . 98 LYS C . 15700 1 1062 . 1 1 98 98 LYS CA C 13 56.297 0.400 . 1 . . . . . 98 LYS CA . 15700 1 1063 . 1 1 98 98 LYS CB C 13 28.467 0.400 . 1 . . . . . 98 LYS CB . 15700 1 1064 . 1 1 98 98 LYS CD C 13 28.980 0.400 . 1 . . . . . 98 LYS CD . 15700 1 1065 . 1 1 98 98 LYS CE C 13 42.177 0.400 . 1 . . . . . 98 LYS CE . 15700 1 1066 . 1 1 98 98 LYS CG C 13 24.950 0.400 . 1 . . . . . 98 LYS CG . 15700 1 1067 . 1 1 98 98 LYS N N 15 115.034 0.400 . 1 . . . . . 98 LYS N . 15700 1 1068 . 1 1 99 99 GLN H H 1 9.266 0.030 . 1 . . . . . 99 GLN H . 15700 1 1069 . 1 1 99 99 GLN HA H 1 4.460 0.030 . 1 . . . . . 99 GLN HA . 15700 1 1070 . 1 1 99 99 GLN HB2 H 1 1.058 0.030 . 2 . . . . . 99 GLN HB2 . 15700 1 1071 . 1 1 99 99 GLN HB3 H 1 0.126 0.030 . 2 . . . . . 99 GLN HB3 . 15700 1 1072 . 1 1 99 99 GLN HG2 H 1 2.058 0.030 . 2 . . . . . 99 GLN HG2 . 15700 1 1073 . 1 1 99 99 GLN HG3 H 1 1.767 0.030 . 2 . . . . . 99 GLN HG3 . 15700 1 1074 . 1 1 99 99 GLN C C 13 174.990 0.300 . 1 . . . . . 99 GLN C . 15700 1 1075 . 1 1 99 99 GLN CA C 13 57.563 0.400 . 1 . . . . . 99 GLN CA . 15700 1 1076 . 1 1 99 99 GLN CB C 13 27.280 0.400 . 1 . . . . . 99 GLN CB . 15700 1 1077 . 1 1 99 99 GLN CG C 13 33.870 0.400 . 1 . . . . . 99 GLN CG . 15700 1 1078 . 1 1 99 99 GLN N N 15 117.717 0.400 . 1 . . . . . 99 GLN N . 15700 1 1079 . 1 1 100 100 TYR H H 1 8.402 0.030 . 1 . . . . . 100 TYR H . 15700 1 1080 . 1 1 100 100 TYR HA H 1 4.935 0.030 . 1 . . . . . 100 TYR HA . 15700 1 1081 . 1 1 100 100 TYR HB2 H 1 3.133 0.030 . 2 . . . . . 100 TYR HB2 . 15700 1 1082 . 1 1 100 100 TYR HB3 H 1 2.952 0.030 . 2 . . . . . 100 TYR HB3 . 15700 1 1083 . 1 1 100 100 TYR HD1 H 1 6.766 0.030 . 1 . . . . . 100 TYR HD1 . 15700 1 1084 . 1 1 100 100 TYR HD2 H 1 6.766 0.030 . 1 . . . . . 100 TYR HD2 . 15700 1 1085 . 1 1 100 100 TYR HE1 H 1 6.485 0.030 . 1 . . . . . 100 TYR HE1 . 15700 1 1086 . 1 1 100 100 TYR HE2 H 1 6.485 0.030 . 1 . . . . . 100 TYR HE2 . 15700 1 1087 . 1 1 100 100 TYR C C 13 171.504 0.300 . 1 . . . . . 100 TYR C . 15700 1 1088 . 1 1 100 100 TYR CA C 13 55.786 0.400 . 1 . . . . . 100 TYR CA . 15700 1 1089 . 1 1 100 100 TYR CB C 13 41.090 0.400 . 1 . . . . . 100 TYR CB . 15700 1 1090 . 1 1 100 100 TYR CD1 C 13 133.120 0.400 . 1 . . . . . 100 TYR CD1 . 15700 1 1091 . 1 1 100 100 TYR CE1 C 13 118.035 0.400 . 1 . . . . . 100 TYR CE1 . 15700 1 1092 . 1 1 100 100 TYR N N 15 115.081 0.400 . 1 . . . . . 100 TYR N . 15700 1 1093 . 1 1 101 101 HIS H H 1 8.829 0.030 . 1 . . . . . 101 HIS H . 15700 1 1094 . 1 1 101 101 HIS HA H 1 4.525 0.030 . 1 . . . . . 101 HIS HA . 15700 1 1095 . 1 1 101 101 HIS HB2 H 1 3.236 0.030 . 2 . . . . . 101 HIS HB2 . 15700 1 1096 . 1 1 101 101 HIS HB3 H 1 3.139 0.030 . 2 . . . . . 101 HIS HB3 . 15700 1 1097 . 1 1 101 101 HIS HD2 H 1 6.485 0.030 . 1 . . . . . 101 HIS HD2 . 15700 1 1098 . 1 1 101 101 HIS HE1 H 1 7.679 0.030 . 1 . . . . . 101 HIS HE1 . 15700 1 1099 . 1 1 101 101 HIS C C 13 174.935 0.300 . 1 . . . . . 101 HIS C . 15700 1 1100 . 1 1 101 101 HIS CA C 13 56.327 0.400 . 1 . . . . . 101 HIS CA . 15700 1 1101 . 1 1 101 101 HIS CB C 13 31.020 0.400 . 1 . . . . . 101 HIS CB . 15700 1 1102 . 1 1 101 101 HIS CD2 C 13 118.035 0.400 . 1 . . . . . 101 HIS CD2 . 15700 1 1103 . 1 1 101 101 HIS CE1 C 13 139.264 0.400 . 1 . . . . . 101 HIS CE1 . 15700 1 1104 . 1 1 101 101 HIS N N 15 120.894 0.400 . 1 . . . . . 101 HIS N . 15700 1 1105 . 1 1 102 102 CYS H H 1 7.427 0.030 . 1 . . . . . 102 CYS H . 15700 1 1106 . 1 1 102 102 CYS HA H 1 4.561 0.030 . 1 . . . . . 102 CYS HA . 15700 1 1107 . 1 1 102 102 CYS HB2 H 1 2.860 0.030 . 2 . . . . . 102 CYS HB2 . 15700 1 1108 . 1 1 102 102 CYS HB3 H 1 2.777 0.030 . 2 . . . . . 102 CYS HB3 . 15700 1 1109 . 1 1 102 102 CYS C C 13 175.765 0.300 . 1 . . . . . 102 CYS C . 15700 1 1110 . 1 1 102 102 CYS CA C 13 57.707 0.400 . 1 . . . . . 102 CYS CA . 15700 1 1111 . 1 1 102 102 CYS CB C 13 29.130 0.400 . 1 . . . . . 102 CYS CB . 15700 1 1112 . 1 1 102 102 CYS N N 15 131.256 0.400 . 1 . . . . . 102 CYS N . 15700 1 1113 . 1 1 103 103 GLU H H 1 9.497 0.030 . 1 . . . . . 103 GLU H . 15700 1 1114 . 1 1 103 103 GLU HA H 1 4.003 0.030 . 1 . . . . . 103 GLU HA . 15700 1 1115 . 1 1 103 103 GLU HB2 H 1 2.058 0.030 . 2 . . . . . 103 GLU HB2 . 15700 1 1116 . 1 1 103 103 GLU HB3 H 1 2.058 0.030 . 2 . . . . . 103 GLU HB3 . 15700 1 1117 . 1 1 103 103 GLU HG2 H 1 2.326 0.030 . 2 . . . . . 103 GLU HG2 . 15700 1 1118 . 1 1 103 103 GLU HG3 H 1 2.256 0.030 . 2 . . . . . 103 GLU HG3 . 15700 1 1119 . 1 1 103 103 GLU C C 13 176.540 0.300 . 1 . . . . . 103 GLU C . 15700 1 1120 . 1 1 103 103 GLU CA C 13 58.796 0.400 . 1 . . . . . 103 GLU CA . 15700 1 1121 . 1 1 103 103 GLU CB C 13 29.280 0.400 . 1 . . . . . 103 GLU CB . 15700 1 1122 . 1 1 103 103 GLU CG C 13 36.060 0.400 . 1 . . . . . 103 GLU CG . 15700 1 1123 . 1 1 103 103 GLU N N 15 129.829 0.400 . 1 . . . . . 103 GLU N . 15700 1 1124 . 1 1 104 104 ASN H H 1 7.832 0.030 . 1 . . . . . 104 ASN H . 15700 1 1125 . 1 1 104 104 ASN HA H 1 4.457 0.030 . 1 . . . . . 104 ASN HA . 15700 1 1126 . 1 1 104 104 ASN HB2 H 1 1.957 0.030 . 2 . . . . . 104 ASN HB2 . 15700 1 1127 . 1 1 104 104 ASN HB3 H 1 0.612 0.030 . 2 . . . . . 104 ASN HB3 . 15700 1 1128 . 1 1 104 104 ASN HD21 H 1 7.068 0.030 . 2 . . . . . 104 ASN HD21 . 15700 1 1129 . 1 1 104 104 ASN HD22 H 1 7.017 0.030 . 2 . . . . . 104 ASN HD22 . 15700 1 1130 . 1 1 104 104 ASN C C 13 176.401 0.300 . 1 . . . . . 104 ASN C . 15700 1 1131 . 1 1 104 104 ASN CA C 13 56.053 0.400 . 1 . . . . . 104 ASN CA . 15700 1 1132 . 1 1 104 104 ASN CB C 13 38.400 0.400 . 1 . . . . . 104 ASN CB . 15700 1 1133 . 1 1 104 104 ASN N N 15 117.703 0.400 . 1 . . . . . 104 ASN N . 15700 1 1134 . 1 1 104 104 ASN ND2 N 15 112.457 0.400 . 1 . . . . . 104 ASN ND2 . 15700 1 1135 . 1 1 105 105 CYS H H 1 9.415 0.030 . 1 . . . . . 105 CYS H . 15700 1 1136 . 1 1 105 105 CYS HA H 1 4.137 0.030 . 1 . . . . . 105 CYS HA . 15700 1 1137 . 1 1 105 105 CYS HB2 H 1 3.001 0.030 . 2 . . . . . 105 CYS HB2 . 15700 1 1138 . 1 1 105 105 CYS HB3 H 1 2.748 0.030 . 2 . . . . . 105 CYS HB3 . 15700 1 1139 . 1 1 105 105 CYS C C 13 176.844 0.300 . 1 . . . . . 105 CYS C . 15700 1 1140 . 1 1 105 105 CYS CA C 13 64.328 0.400 . 1 . . . . . 105 CYS CA . 15700 1 1141 . 1 1 105 105 CYS CB C 13 30.350 0.400 . 1 . . . . . 105 CYS CB . 15700 1 1142 . 1 1 105 105 CYS N N 15 124.939 0.400 . 1 . . . . . 105 CYS N . 15700 1 1143 . 1 1 106 106 GLY H H 1 8.145 0.030 . 1 . . . . . 106 GLY H . 15700 1 1144 . 1 1 106 106 GLY HA2 H 1 3.980 0.030 . 2 . . . . . 106 GLY HA2 . 15700 1 1145 . 1 1 106 106 GLY HA3 H 1 3.502 0.030 . 2 . . . . . 106 GLY HA3 . 15700 1 1146 . 1 1 106 106 GLY C C 13 172.500 0.300 . 1 . . . . . 106 GLY C . 15700 1 1147 . 1 1 106 106 GLY CA C 13 44.968 0.400 . 1 . . . . . 106 GLY CA . 15700 1 1148 . 1 1 106 106 GLY N N 15 106.090 0.400 . 1 . . . . . 106 GLY N . 15700 1 1149 . 1 1 107 107 ILE H H 1 6.465 0.030 . 1 . . . . . 107 ILE H . 15700 1 1150 . 1 1 107 107 ILE HA H 1 4.878 0.030 . 1 . . . . . 107 ILE HA . 15700 1 1151 . 1 1 107 107 ILE HB H 1 1.817 0.030 . 1 . . . . . 107 ILE HB . 15700 1 1152 . 1 1 107 107 ILE HD11 H 1 0.812 0.030 . 1 . . . . . 107 ILE HD1 . 15700 1 1153 . 1 1 107 107 ILE HD12 H 1 0.812 0.030 . 1 . . . . . 107 ILE HD1 . 15700 1 1154 . 1 1 107 107 ILE HD13 H 1 0.812 0.030 . 1 . . . . . 107 ILE HD1 . 15700 1 1155 . 1 1 107 107 ILE HG12 H 1 1.069 0.030 . 2 . . . . . 107 ILE HG12 . 15700 1 1156 . 1 1 107 107 ILE HG13 H 1 0.813 0.030 . 2 . . . . . 107 ILE HG13 . 15700 1 1157 . 1 1 107 107 ILE HG21 H 1 0.982 0.030 . 1 . . . . . 107 ILE HG2 . 15700 1 1158 . 1 1 107 107 ILE HG22 H 1 0.982 0.030 . 1 . . . . . 107 ILE HG2 . 15700 1 1159 . 1 1 107 107 ILE HG23 H 1 0.982 0.030 . 1 . . . . . 107 ILE HG2 . 15700 1 1160 . 1 1 107 107 ILE C C 13 174.824 0.300 . 1 . . . . . 107 ILE C . 15700 1 1161 . 1 1 107 107 ILE CA C 13 58.226 0.400 . 1 . . . . . 107 ILE CA . 15700 1 1162 . 1 1 107 107 ILE CB C 13 44.460 0.400 . 1 . . . . . 107 ILE CB . 15700 1 1163 . 1 1 107 107 ILE CD1 C 13 13.690 0.400 . 1 . . . . . 107 ILE CD1 . 15700 1 1164 . 1 1 107 107 ILE CG1 C 13 25.820 0.400 . 1 . . . . . 107 ILE CG1 . 15700 1 1165 . 1 1 107 107 ILE CG2 C 13 18.980 0.400 . 1 . . . . . 107 ILE CG2 . 15700 1 1166 . 1 1 107 107 ILE N N 15 107.914 0.400 . 1 . . . . . 107 ILE N . 15700 1 1167 . 1 1 108 108 CYS H H 1 7.041 0.030 . 1 . . . . . 108 CYS H . 15700 1 1168 . 1 1 108 108 CYS HA H 1 5.018 0.030 . 1 . . . . . 108 CYS HA . 15700 1 1169 . 1 1 108 108 CYS HB2 H 1 2.652 0.030 . 2 . . . . . 108 CYS HB2 . 15700 1 1170 . 1 1 108 108 CYS HB3 H 1 2.364 0.030 . 2 . . . . . 108 CYS HB3 . 15700 1 1171 . 1 1 108 108 CYS C C 13 175.461 0.300 . 1 . . . . . 108 CYS C . 15700 1 1172 . 1 1 108 108 CYS CA C 13 62.097 0.400 . 1 . . . . . 108 CYS CA . 15700 1 1173 . 1 1 108 108 CYS CB C 13 31.353 0.400 . 1 . . . . . 108 CYS CB . 15700 1 1174 . 1 1 108 108 CYS N N 15 122.441 0.400 . 1 . . . . . 108 CYS N . 15700 1 1175 . 1 1 109 109 ARG H H 1 8.561 0.030 . 1 . . . . . 109 ARG H . 15700 1 1176 . 1 1 109 109 ARG HA H 1 4.239 0.030 . 1 . . . . . 109 ARG HA . 15700 1 1177 . 1 1 109 109 ARG HB2 H 1 1.471 0.030 . 2 . . . . . 109 ARG HB2 . 15700 1 1178 . 1 1 109 109 ARG HB3 H 1 0.577 0.030 . 2 . . . . . 109 ARG HB3 . 15700 1 1179 . 1 1 109 109 ARG HD2 H 1 3.040 0.030 . 2 . . . . . 109 ARG HD2 . 15700 1 1180 . 1 1 109 109 ARG HD3 H 1 2.993 0.030 . 2 . . . . . 109 ARG HD3 . 15700 1 1181 . 1 1 109 109 ARG HG2 H 1 1.208 0.030 . 2 . . . . . 109 ARG HG2 . 15700 1 1182 . 1 1 109 109 ARG HG3 H 1 1.183 0.030 . 2 . . . . . 109 ARG HG3 . 15700 1 1183 . 1 1 109 109 ARG C C 13 174.271 0.300 . 1 . . . . . 109 ARG C . 15700 1 1184 . 1 1 109 109 ARG CA C 13 52.962 0.400 . 1 . . . . . 109 ARG CA . 15700 1 1185 . 1 1 109 109 ARG CB C 13 33.903 0.400 . 1 . . . . . 109 ARG CB . 15700 1 1186 . 1 1 109 109 ARG CD C 13 43.047 0.400 . 1 . . . . . 109 ARG CD . 15700 1 1187 . 1 1 109 109 ARG CG C 13 26.650 0.400 . 1 . . . . . 109 ARG CG . 15700 1 1188 . 1 1 109 109 ARG N N 15 121.163 0.400 . 1 . . . . . 109 ARG N . 15700 1 1189 . 1 1 110 110 ILE H H 1 7.847 0.030 . 1 . . . . . 110 ILE H . 15700 1 1190 . 1 1 110 110 ILE HA H 1 3.531 0.030 . 1 . . . . . 110 ILE HA . 15700 1 1191 . 1 1 110 110 ILE HB H 1 1.868 0.030 . 1 . . . . . 110 ILE HB . 15700 1 1192 . 1 1 110 110 ILE HD11 H 1 0.873 0.030 . 1 . . . . . 110 ILE HD1 . 15700 1 1193 . 1 1 110 110 ILE HD12 H 1 0.873 0.030 . 1 . . . . . 110 ILE HD1 . 15700 1 1194 . 1 1 110 110 ILE HD13 H 1 0.873 0.030 . 1 . . . . . 110 ILE HD1 . 15700 1 1195 . 1 1 110 110 ILE HG12 H 1 1.550 0.030 . 2 . . . . . 110 ILE HG12 . 15700 1 1196 . 1 1 110 110 ILE HG13 H 1 1.288 0.030 . 2 . . . . . 110 ILE HG13 . 15700 1 1197 . 1 1 110 110 ILE HG21 H 1 1.119 0.030 . 1 . . . . . 110 ILE HG2 . 15700 1 1198 . 1 1 110 110 ILE HG22 H 1 1.119 0.030 . 1 . . . . . 110 ILE HG2 . 15700 1 1199 . 1 1 110 110 ILE HG23 H 1 1.119 0.030 . 1 . . . . . 110 ILE HG2 . 15700 1 1200 . 1 1 110 110 ILE C C 13 175.405 0.300 . 1 . . . . . 110 ILE C . 15700 1 1201 . 1 1 110 110 ILE CA C 13 62.201 0.400 . 1 . . . . . 110 ILE CA . 15700 1 1202 . 1 1 110 110 ILE CB C 13 36.860 0.400 . 1 . . . . . 110 ILE CB . 15700 1 1203 . 1 1 110 110 ILE CD1 C 13 12.230 0.400 . 1 . . . . . 110 ILE CD1 . 15700 1 1204 . 1 1 110 110 ILE CG1 C 13 27.677 0.400 . 1 . . . . . 110 ILE CG1 . 15700 1 1205 . 1 1 110 110 ILE CG2 C 13 17.237 0.400 . 1 . . . . . 110 ILE CG2 . 15700 1 1206 . 1 1 110 110 ILE N N 15 118.955 0.400 . 1 . . . . . 110 ILE N . 15700 1 1207 . 1 1 111 111 GLY H H 1 6.928 0.030 . 1 . . . . . 111 GLY H . 15700 1 1208 . 1 1 111 111 GLY HA2 H 1 4.564 0.030 . 2 . . . . . 111 GLY HA2 . 15700 1 1209 . 1 1 111 111 GLY HA3 H 1 4.135 0.030 . 2 . . . . . 111 GLY HA3 . 15700 1 1210 . 1 1 111 111 GLY CA C 13 43.068 0.400 . 1 . . . . . 111 GLY CA . 15700 1 1211 . 1 1 111 111 GLY N N 15 113.782 0.400 . 1 . . . . . 111 GLY N . 15700 1 1212 . 1 1 112 112 PRO HA H 1 4.990 0.030 . 1 . . . . . 112 PRO HA . 15700 1 1213 . 1 1 112 112 PRO HB2 H 1 2.533 0.030 . 2 . . . . . 112 PRO HB2 . 15700 1 1214 . 1 1 112 112 PRO HB3 H 1 2.371 0.030 . 2 . . . . . 112 PRO HB3 . 15700 1 1215 . 1 1 112 112 PRO HD2 H 1 3.840 0.030 . 2 . . . . . 112 PRO HD2 . 15700 1 1216 . 1 1 112 112 PRO HD3 H 1 3.633 0.030 . 2 . . . . . 112 PRO HD3 . 15700 1 1217 . 1 1 112 112 PRO HG2 H 1 1.963 0.030 . 2 . . . . . 112 PRO HG2 . 15700 1 1218 . 1 1 112 112 PRO HG3 H 1 1.963 0.030 . 2 . . . . . 112 PRO HG3 . 15700 1 1219 . 1 1 112 112 PRO C C 13 177.342 0.300 . 1 . . . . . 112 PRO C . 15700 1 1220 . 1 1 112 112 PRO CA C 13 62.920 0.400 . 1 . . . . . 112 PRO CA . 15700 1 1221 . 1 1 112 112 PRO CB C 13 34.807 0.400 . 1 . . . . . 112 PRO CB . 15700 1 1222 . 1 1 112 112 PRO CD C 13 50.667 0.400 . 1 . . . . . 112 PRO CD . 15700 1 1223 . 1 1 112 112 PRO CG C 13 25.800 0.400 . 1 . . . . . 112 PRO CG . 15700 1 1224 . 1 1 113 113 LYS H H 1 8.989 0.030 . 1 . . . . . 113 LYS H . 15700 1 1225 . 1 1 113 113 LYS HA H 1 3.144 0.030 . 1 . . . . . 113 LYS HA . 15700 1 1226 . 1 1 113 113 LYS HB2 H 1 1.412 0.030 . 2 . . . . . 113 LYS HB2 . 15700 1 1227 . 1 1 113 113 LYS HB3 H 1 1.315 0.030 . 2 . . . . . 113 LYS HB3 . 15700 1 1228 . 1 1 113 113 LYS HD2 H 1 1.545 0.030 . 2 . . . . . 113 LYS HD2 . 15700 1 1229 . 1 1 113 113 LYS HD3 H 1 1.496 0.030 . 2 . . . . . 113 LYS HD3 . 15700 1 1230 . 1 1 113 113 LYS HE2 H 1 3.005 0.030 . 2 . . . . . 113 LYS HE2 . 15700 1 1231 . 1 1 113 113 LYS HE3 H 1 2.952 0.030 . 2 . . . . . 113 LYS HE3 . 15700 1 1232 . 1 1 113 113 LYS HG2 H 1 1.197 0.030 . 2 . . . . . 113 LYS HG2 . 15700 1 1233 . 1 1 113 113 LYS HG3 H 1 0.720 0.030 . 2 . . . . . 113 LYS HG3 . 15700 1 1234 . 1 1 113 113 LYS C C 13 177.536 0.300 . 1 . . . . . 113 LYS C . 15700 1 1235 . 1 1 113 113 LYS CA C 13 59.883 0.400 . 1 . . . . . 113 LYS CA . 15700 1 1236 . 1 1 113 113 LYS CB C 13 32.260 0.400 . 1 . . . . . 113 LYS CB . 15700 1 1237 . 1 1 113 113 LYS CD C 13 29.230 0.400 . 1 . . . . . 113 LYS CD . 15700 1 1238 . 1 1 113 113 LYS CE C 13 42.110 0.400 . 1 . . . . . 113 LYS CE . 15700 1 1239 . 1 1 113 113 LYS CG C 13 24.190 0.400 . 1 . . . . . 113 LYS CG . 15700 1 1240 . 1 1 113 113 LYS N N 15 123.545 0.400 . 1 . . . . . 113 LYS N . 15700 1 1241 . 1 1 114 114 GLU H H 1 9.080 0.030 . 1 . . . . . 114 GLU H . 15700 1 1242 . 1 1 114 114 GLU HA H 1 4.199 0.030 . 1 . . . . . 114 GLU HA . 15700 1 1243 . 1 1 114 114 GLU HB2 H 1 2.103 0.030 . 2 . . . . . 114 GLU HB2 . 15700 1 1244 . 1 1 114 114 GLU HB3 H 1 2.062 0.030 . 2 . . . . . 114 GLU HB3 . 15700 1 1245 . 1 1 114 114 GLU HG2 H 1 2.420 0.030 . 2 . . . . . 114 GLU HG2 . 15700 1 1246 . 1 1 114 114 GLU HG3 H 1 2.323 0.030 . 2 . . . . . 114 GLU HG3 . 15700 1 1247 . 1 1 114 114 GLU C C 13 176.374 0.300 . 1 . . . . . 114 GLU C . 15700 1 1248 . 1 1 114 114 GLU CA C 13 58.733 0.400 . 1 . . . . . 114 GLU CA . 15700 1 1249 . 1 1 114 114 GLU CB C 13 28.077 0.400 . 1 . . . . . 114 GLU CB . 15700 1 1250 . 1 1 114 114 GLU CG C 13 36.377 0.400 . 1 . . . . . 114 GLU CG . 15700 1 1251 . 1 1 114 114 GLU N N 15 114.832 0.400 . 1 . . . . . 114 GLU N . 15700 1 1252 . 1 1 115 115 ASP H H 1 7.799 0.030 . 1 . . . . . 115 ASP H . 15700 1 1253 . 1 1 115 115 ASP HA H 1 4.642 0.030 . 1 . . . . . 115 ASP HA . 15700 1 1254 . 1 1 115 115 ASP HB2 H 1 2.641 0.030 . 2 . . . . . 115 ASP HB2 . 15700 1 1255 . 1 1 115 115 ASP HB3 H 1 2.472 0.030 . 2 . . . . . 115 ASP HB3 . 15700 1 1256 . 1 1 115 115 ASP C C 13 176.374 0.300 . 1 . . . . . 115 ASP C . 15700 1 1257 . 1 1 115 115 ASP CA C 13 54.470 0.400 . 1 . . . . . 115 ASP CA . 15700 1 1258 . 1 1 115 115 ASP CB C 13 40.850 0.400 . 1 . . . . . 115 ASP CB . 15700 1 1259 . 1 1 115 115 ASP N N 15 118.858 0.400 . 1 . . . . . 115 ASP N . 15700 1 1260 . 1 1 116 116 PHE H H 1 8.063 0.030 . 1 . . . . . 116 PHE H . 15700 1 1261 . 1 1 116 116 PHE HA H 1 5.239 0.030 . 1 . . . . . 116 PHE HA . 15700 1 1262 . 1 1 116 116 PHE HB2 H 1 2.855 0.030 . 2 . . . . . 116 PHE HB2 . 15700 1 1263 . 1 1 116 116 PHE HB3 H 1 2.783 0.030 . 2 . . . . . 116 PHE HB3 . 15700 1 1264 . 1 1 116 116 PHE C C 13 173.413 0.300 . 1 . . . . . 116 PHE C . 15700 1 1265 . 1 1 116 116 PHE CA C 13 57.708 0.400 . 1 . . . . . 116 PHE CA . 15700 1 1266 . 1 1 116 116 PHE CB C 13 44.557 0.400 . 1 . . . . . 116 PHE CB . 15700 1 1267 . 1 1 116 116 PHE N N 15 120.567 0.400 . 1 . . . . . 116 PHE N . 15700 1 1268 . 1 1 117 117 PHE H H 1 9.439 0.030 . 1 . . . . . 117 PHE H . 15700 1 1269 . 1 1 117 117 PHE HA H 1 5.091 0.030 . 1 . . . . . 117 PHE HA . 15700 1 1270 . 1 1 117 117 PHE HB2 H 1 3.175 0.030 . 2 . . . . . 117 PHE HB2 . 15700 1 1271 . 1 1 117 117 PHE HB3 H 1 3.080 0.030 . 2 . . . . . 117 PHE HB3 . 15700 1 1272 . 1 1 117 117 PHE HD1 H 1 7.064 0.030 . 1 . . . . . 117 PHE HD1 . 15700 1 1273 . 1 1 117 117 PHE HD2 H 1 7.064 0.030 . 1 . . . . . 117 PHE HD2 . 15700 1 1274 . 1 1 117 117 PHE HE1 H 1 7.150 0.030 . 1 . . . . . 117 PHE HE1 . 15700 1 1275 . 1 1 117 117 PHE HE2 H 1 7.150 0.030 . 1 . . . . . 117 PHE HE2 . 15700 1 1276 . 1 1 117 117 PHE HZ H 1 6.790 0.030 . 1 . . . . . 117 PHE HZ . 15700 1 1277 . 1 1 117 117 PHE C C 13 171.614 0.300 . 1 . . . . . 117 PHE C . 15700 1 1278 . 1 1 117 117 PHE CA C 13 55.311 0.400 . 1 . . . . . 117 PHE CA . 15700 1 1279 . 1 1 117 117 PHE CB C 13 41.887 0.400 . 1 . . . . . 117 PHE CB . 15700 1 1280 . 1 1 117 117 PHE CD1 C 13 132.599 0.400 . 1 . . . . . 117 PHE CD1 . 15700 1 1281 . 1 1 117 117 PHE CE1 C 13 131.105 0.400 . 1 . . . . . 117 PHE CE1 . 15700 1 1282 . 1 1 117 117 PHE CZ C 13 128.645 0.400 . 1 . . . . . 117 PHE CZ . 15700 1 1283 . 1 1 117 117 PHE N N 15 118.040 0.400 . 1 . . . . . 117 PHE N . 15700 1 1284 . 1 1 118 118 HIS H H 1 8.779 0.030 . 1 . . . . . 118 HIS H . 15700 1 1285 . 1 1 118 118 HIS HA H 1 4.836 0.030 . 1 . . . . . 118 HIS HA . 15700 1 1286 . 1 1 118 118 HIS HB2 H 1 3.224 0.030 . 2 . . . . . 118 HIS HB2 . 15700 1 1287 . 1 1 118 118 HIS HB3 H 1 3.224 0.030 . 2 . . . . . 118 HIS HB3 . 15700 1 1288 . 1 1 118 118 HIS HD2 H 1 6.405 0.030 . 1 . . . . . 118 HIS HD2 . 15700 1 1289 . 1 1 118 118 HIS C C 13 174.879 0.300 . 1 . . . . . 118 HIS C . 15700 1 1290 . 1 1 118 118 HIS CA C 13 55.322 0.400 . 1 . . . . . 118 HIS CA . 15700 1 1291 . 1 1 118 118 HIS CB C 13 30.950 0.400 . 1 . . . . . 118 HIS CB . 15700 1 1292 . 1 1 118 118 HIS CD2 C 13 118.072 0.400 . 1 . . . . . 118 HIS CD2 . 15700 1 1293 . 1 1 118 118 HIS N N 15 121.208 0.400 . 1 . . . . . 118 HIS N . 15700 1 1294 . 1 1 119 119 CYS H H 1 8.123 0.030 . 1 . . . . . 119 CYS H . 15700 1 1295 . 1 1 119 119 CYS HA H 1 4.529 0.030 . 1 . . . . . 119 CYS HA . 15700 1 1296 . 1 1 119 119 CYS HB2 H 1 2.973 0.030 . 2 . . . . . 119 CYS HB2 . 15700 1 1297 . 1 1 119 119 CYS HB3 H 1 2.564 0.030 . 2 . . . . . 119 CYS HB3 . 15700 1 1298 . 1 1 119 119 CYS C C 13 176.567 0.300 . 1 . . . . . 119 CYS C . 15700 1 1299 . 1 1 119 119 CYS CA C 13 58.957 0.400 . 1 . . . . . 119 CYS CA . 15700 1 1300 . 1 1 119 119 CYS CB C 13 30.090 0.400 . 1 . . . . . 119 CYS CB . 15700 1 1301 . 1 1 119 119 CYS N N 15 131.659 0.400 . 1 . . . . . 119 CYS N . 15700 1 1302 . 1 1 120 120 LEU H H 1 8.970 0.030 . 1 . . . . . 120 LEU H . 15700 1 1303 . 1 1 120 120 LEU N N 15 130.361 0.400 . 1 . . . . . 120 LEU N . 15700 1 1304 . 1 1 121 121 LYS HA H 1 4.299 0.030 . 1 . . . . . 121 LYS HA . 15700 1 1305 . 1 1 121 121 LYS HB2 H 1 2.032 0.030 . 2 . . . . . 121 LYS HB2 . 15700 1 1306 . 1 1 121 121 LYS HB3 H 1 2.133 0.030 . 2 . . . . . 121 LYS HB3 . 15700 1 1307 . 1 1 121 121 LYS HD2 H 1 1.775 0.030 . 2 . . . . . 121 LYS HD2 . 15700 1 1308 . 1 1 121 121 LYS HD3 H 1 1.775 0.030 . 2 . . . . . 121 LYS HD3 . 15700 1 1309 . 1 1 121 121 LYS HE2 H 1 3.047 0.030 . 2 . . . . . 121 LYS HE2 . 15700 1 1310 . 1 1 121 121 LYS HE3 H 1 3.047 0.030 . 2 . . . . . 121 LYS HE3 . 15700 1 1311 . 1 1 121 121 LYS HG2 H 1 1.520 0.030 . 2 . . . . . 121 LYS HG2 . 15700 1 1312 . 1 1 121 121 LYS HG3 H 1 1.520 0.030 . 2 . . . . . 121 LYS HG3 . 15700 1 1313 . 1 1 121 121 LYS CA C 13 58.727 0.400 . 1 . . . . . 121 LYS CA . 15700 1 1314 . 1 1 121 121 LYS CB C 13 33.210 0.400 . 1 . . . . . 121 LYS CB . 15700 1 1315 . 1 1 121 121 LYS CD C 13 28.690 0.400 . 1 . . . . . 121 LYS CD . 15700 1 1316 . 1 1 121 121 LYS CE C 13 42.090 0.400 . 1 . . . . . 121 LYS CE . 15700 1 1317 . 1 1 121 121 LYS CG C 13 25.250 0.400 . 1 . . . . . 121 LYS CG . 15700 1 1318 . 1 1 123 123 ASN HA H 1 4.438 0.030 . 1 . . . . . 123 ASN HA . 15700 1 1319 . 1 1 123 123 ASN HB2 H 1 3.353 0.030 . 2 . . . . . 123 ASN HB2 . 15700 1 1320 . 1 1 123 123 ASN HB3 H 1 2.517 0.030 . 2 . . . . . 123 ASN HB3 . 15700 1 1321 . 1 1 123 123 ASN HD21 H 1 7.500 0.030 . 2 . . . . . 123 ASN HD21 . 15700 1 1322 . 1 1 123 123 ASN HD22 H 1 6.764 0.030 . 2 . . . . . 123 ASN HD22 . 15700 1 1323 . 1 1 123 123 ASN C C 13 172.444 0.300 . 1 . . . . . 123 ASN C . 15700 1 1324 . 1 1 123 123 ASN CA C 13 53.448 0.400 . 1 . . . . . 123 ASN CA . 15700 1 1325 . 1 1 123 123 ASN CB C 13 37.130 0.400 . 1 . . . . . 123 ASN CB . 15700 1 1326 . 1 1 123 123 ASN ND2 N 15 111.650 0.400 . 1 . . . . . 123 ASN ND2 . 15700 1 1327 . 1 1 124 124 LEU H H 1 6.596 0.030 . 1 . . . . . 124 LEU H . 15700 1 1328 . 1 1 124 124 LEU HA H 1 4.576 0.030 . 1 . . . . . 124 LEU HA . 15700 1 1329 . 1 1 124 124 LEU HB2 H 1 1.250 0.030 . 2 . . . . . 124 LEU HB2 . 15700 1 1330 . 1 1 124 124 LEU HB3 H 1 1.179 0.030 . 2 . . . . . 124 LEU HB3 . 15700 1 1331 . 1 1 124 124 LEU HD11 H 1 0.850 0.030 . 2 . . . . . 124 LEU HD1 . 15700 1 1332 . 1 1 124 124 LEU HD12 H 1 0.850 0.030 . 2 . . . . . 124 LEU HD1 . 15700 1 1333 . 1 1 124 124 LEU HD13 H 1 0.850 0.030 . 2 . . . . . 124 LEU HD1 . 15700 1 1334 . 1 1 124 124 LEU HD21 H 1 0.882 0.030 . 2 . . . . . 124 LEU HD2 . 15700 1 1335 . 1 1 124 124 LEU HD22 H 1 0.882 0.030 . 2 . . . . . 124 LEU HD2 . 15700 1 1336 . 1 1 124 124 LEU HD23 H 1 0.882 0.030 . 2 . . . . . 124 LEU HD2 . 15700 1 1337 . 1 1 124 124 LEU HG H 1 1.502 0.030 . 1 . . . . . 124 LEU HG . 15700 1 1338 . 1 1 124 124 LEU C C 13 175.903 0.300 . 1 . . . . . 124 LEU C . 15700 1 1339 . 1 1 124 124 LEU CA C 13 54.043 0.400 . 1 . . . . . 124 LEU CA . 15700 1 1340 . 1 1 124 124 LEU CB C 13 45.837 0.400 . 1 . . . . . 124 LEU CB . 15700 1 1341 . 1 1 124 124 LEU CD1 C 13 25.347 0.400 . 1 . . . . . 124 LEU CD1 . 15700 1 1342 . 1 1 124 124 LEU CD2 C 13 23.687 0.400 . 1 . . . . . 124 LEU CD2 . 15700 1 1343 . 1 1 124 124 LEU CG C 13 26.180 0.400 . 1 . . . . . 124 LEU CG . 15700 1 1344 . 1 1 124 124 LEU N N 15 115.443 0.400 . 1 . . . . . 124 LEU N . 15700 1 1345 . 1 1 125 125 CYS H H 1 6.342 0.030 . 1 . . . . . 125 CYS H . 15700 1 1346 . 1 1 125 125 CYS HA H 1 5.033 0.030 . 1 . . . . . 125 CYS HA . 15700 1 1347 . 1 1 125 125 CYS HB2 H 1 2.410 0.030 . 2 . . . . . 125 CYS HB2 . 15700 1 1348 . 1 1 125 125 CYS HB3 H 1 2.373 0.030 . 2 . . . . . 125 CYS HB3 . 15700 1 1349 . 1 1 125 125 CYS C C 13 175.101 0.300 . 1 . . . . . 125 CYS C . 15700 1 1350 . 1 1 125 125 CYS CA C 13 62.046 0.400 . 1 . . . . . 125 CYS CA . 15700 1 1351 . 1 1 125 125 CYS CB C 13 30.840 0.400 . 1 . . . . . 125 CYS CB . 15700 1 1352 . 1 1 125 125 CYS N N 15 118.685 0.400 . 1 . . . . . 125 CYS N . 15700 1 1353 . 1 1 126 126 LEU H H 1 8.894 0.030 . 1 . . . . . 126 LEU H . 15700 1 1354 . 1 1 126 126 LEU HA H 1 4.565 0.030 . 1 . . . . . 126 LEU HA . 15700 1 1355 . 1 1 126 126 LEU HB2 H 1 1.187 0.030 . 2 . . . . . 126 LEU HB2 . 15700 1 1356 . 1 1 126 126 LEU HB3 H 1 0.826 0.030 . 2 . . . . . 126 LEU HB3 . 15700 1 1357 . 1 1 126 126 LEU HD11 H 1 0.098 0.030 . 2 . . . . . 126 LEU HD1 . 15700 1 1358 . 1 1 126 126 LEU HD12 H 1 0.098 0.030 . 2 . . . . . 126 LEU HD1 . 15700 1 1359 . 1 1 126 126 LEU HD13 H 1 0.098 0.030 . 2 . . . . . 126 LEU HD1 . 15700 1 1360 . 1 1 126 126 LEU HD21 H 1 0.589 0.030 . 2 . . . . . 126 LEU HD2 . 15700 1 1361 . 1 1 126 126 LEU HD22 H 1 0.589 0.030 . 2 . . . . . 126 LEU HD2 . 15700 1 1362 . 1 1 126 126 LEU HD23 H 1 0.589 0.030 . 2 . . . . . 126 LEU HD2 . 15700 1 1363 . 1 1 126 126 LEU HG H 1 0.944 0.030 . 1 . . . . . 126 LEU HG . 15700 1 1364 . 1 1 126 126 LEU C C 13 174.879 0.300 . 1 . . . . . 126 LEU C . 15700 1 1365 . 1 1 126 126 LEU CA C 13 52.751 0.400 . 1 . . . . . 126 LEU CA . 15700 1 1366 . 1 1 126 126 LEU CB C 13 46.090 0.400 . 1 . . . . . 126 LEU CB . 15700 1 1367 . 1 1 126 126 LEU CD1 C 13 25.893 0.400 . 1 . . . . . 126 LEU CD1 . 15700 1 1368 . 1 1 126 126 LEU CD2 C 13 23.880 0.400 . 1 . . . . . 126 LEU CD2 . 15700 1 1369 . 1 1 126 126 LEU CG C 13 26.220 0.400 . 1 . . . . . 126 LEU CG . 15700 1 1370 . 1 1 126 126 LEU N N 15 124.501 0.400 . 1 . . . . . 126 LEU N . 15700 1 1371 . 1 1 127 127 ALA H H 1 8.378 0.030 . 1 . . . . . 127 ALA H . 15700 1 1372 . 1 1 127 127 ALA HA H 1 3.957 0.030 . 1 . . . . . 127 ALA HA . 15700 1 1373 . 1 1 127 127 ALA HB1 H 1 1.382 0.030 . 1 . . . . . 127 ALA HB . 15700 1 1374 . 1 1 127 127 ALA HB2 H 1 1.382 0.030 . 1 . . . . . 127 ALA HB . 15700 1 1375 . 1 1 127 127 ALA HB3 H 1 1.382 0.030 . 1 . . . . . 127 ALA HB . 15700 1 1376 . 1 1 127 127 ALA C C 13 179.085 0.300 . 1 . . . . . 127 ALA C . 15700 1 1377 . 1 1 127 127 ALA CA C 13 52.554 0.400 . 1 . . . . . 127 ALA CA . 15700 1 1378 . 1 1 127 127 ALA CB C 13 18.527 0.400 . 1 . . . . . 127 ALA CB . 15700 1 1379 . 1 1 127 127 ALA N N 15 123.011 0.400 . 1 . . . . . 127 ALA N . 15700 1 1380 . 1 1 128 128 MET H H 1 8.237 0.030 . 1 . . . . . 128 MET H . 15700 1 1381 . 1 1 128 128 MET HE1 H 1 2.036 0.030 . 1 . . . . . 128 MET HE . 15700 1 1382 . 1 1 128 128 MET HE2 H 1 2.036 0.030 . 1 . . . . . 128 MET HE . 15700 1 1383 . 1 1 128 128 MET HE3 H 1 2.036 0.030 . 1 . . . . . 128 MET HE . 15700 1 1384 . 1 1 128 128 MET CE C 13 16.874 0.400 . 1 . . . . . 128 MET CE . 15700 1 1385 . 1 1 128 128 MET N N 15 120.642 0.400 . 1 . . . . . 128 MET N . 15700 1 1386 . 1 1 129 129 ASN HA H 1 4.502 0.030 . 1 . . . . . 129 ASN HA . 15700 1 1387 . 1 1 129 129 ASN HB2 H 1 2.973 0.030 . 2 . . . . . 129 ASN HB2 . 15700 1 1388 . 1 1 129 129 ASN HB3 H 1 2.755 0.030 . 2 . . . . . 129 ASN HB3 . 15700 1 1389 . 1 1 129 129 ASN C C 13 175.931 0.300 . 1 . . . . . 129 ASN C . 15700 1 1390 . 1 1 129 129 ASN CA C 13 55.064 0.400 . 1 . . . . . 129 ASN CA . 15700 1 1391 . 1 1 129 129 ASN CB C 13 36.920 0.400 . 1 . . . . . 129 ASN CB . 15700 1 1392 . 1 1 130 130 LEU H H 1 8.211 0.030 . 1 . . . . . 130 LEU H . 15700 1 1393 . 1 1 130 130 LEU HA H 1 4.489 0.030 . 1 . . . . . 130 LEU HA . 15700 1 1394 . 1 1 130 130 LEU HB2 H 1 2.163 0.030 . 2 . . . . . 130 LEU HB2 . 15700 1 1395 . 1 1 130 130 LEU HB3 H 1 1.744 0.030 . 2 . . . . . 130 LEU HB3 . 15700 1 1396 . 1 1 130 130 LEU HD11 H 1 1.083 0.030 . 2 . . . . . 130 LEU HD1 . 15700 1 1397 . 1 1 130 130 LEU HD12 H 1 1.083 0.030 . 2 . . . . . 130 LEU HD1 . 15700 1 1398 . 1 1 130 130 LEU HD13 H 1 1.083 0.030 . 2 . . . . . 130 LEU HD1 . 15700 1 1399 . 1 1 130 130 LEU HD21 H 1 0.939 0.030 . 2 . . . . . 130 LEU HD2 . 15700 1 1400 . 1 1 130 130 LEU HD22 H 1 0.939 0.030 . 2 . . . . . 130 LEU HD2 . 15700 1 1401 . 1 1 130 130 LEU HD23 H 1 0.939 0.030 . 2 . . . . . 130 LEU HD2 . 15700 1 1402 . 1 1 130 130 LEU HG H 1 1.085 0.030 . 1 . . . . . 130 LEU HG . 15700 1 1403 . 1 1 130 130 LEU C C 13 178.836 0.300 . 1 . . . . . 130 LEU C . 15700 1 1404 . 1 1 130 130 LEU CA C 13 54.653 0.400 . 1 . . . . . 130 LEU CA . 15700 1 1405 . 1 1 130 130 LEU CB C 13 41.887 0.400 . 1 . . . . . 130 LEU CB . 15700 1 1406 . 1 1 130 130 LEU CD1 C 13 25.860 0.400 . 1 . . . . . 130 LEU CD1 . 15700 1 1407 . 1 1 130 130 LEU CD2 C 13 22.527 0.400 . 1 . . . . . 130 LEU CD2 . 15700 1 1408 . 1 1 130 130 LEU CG C 13 27.363 0.400 . 1 . . . . . 130 LEU CG . 15700 1 1409 . 1 1 130 130 LEU N N 15 118.563 0.400 . 1 . . . . . 130 LEU N . 15700 1 1410 . 1 1 131 131 GLN H H 1 7.953 0.030 . 1 . . . . . 131 GLN H . 15700 1 1411 . 1 1 131 131 GLN HA H 1 3.729 0.030 . 1 . . . . . 131 GLN HA . 15700 1 1412 . 1 1 131 131 GLN HB2 H 1 1.932 0.030 . 2 . . . . . 131 GLN HB2 . 15700 1 1413 . 1 1 131 131 GLN HB3 H 1 1.561 0.030 . 2 . . . . . 131 GLN HB3 . 15700 1 1414 . 1 1 131 131 GLN HE21 H 1 7.155 0.030 . 2 . . . . . 131 GLN HE21 . 15700 1 1415 . 1 1 131 131 GLN HE22 H 1 7.155 0.030 . 2 . . . . . 131 GLN HE22 . 15700 1 1416 . 1 1 131 131 GLN HG2 H 1 1.775 0.030 . 2 . . . . . 131 GLN HG2 . 15700 1 1417 . 1 1 131 131 GLN HG3 H 1 1.552 0.030 . 2 . . . . . 131 GLN HG3 . 15700 1 1418 . 1 1 131 131 GLN CA C 13 59.310 0.400 . 1 . . . . . 131 GLN CA . 15700 1 1419 . 1 1 131 131 GLN CB C 13 28.340 0.400 . 1 . . . . . 131 GLN CB . 15700 1 1420 . 1 1 131 131 GLN CG C 13 33.730 0.400 . 1 . . . . . 131 GLN CG . 15700 1 1421 . 1 1 131 131 GLN N N 15 123.929 0.400 . 1 . . . . . 131 GLN N . 15700 1 1422 . 1 1 131 131 GLN NE2 N 15 109.347 0.400 . 1 . . . . . 131 GLN NE2 . 15700 1 1423 . 1 1 132 132 GLY HA2 H 1 4.034 0.030 . 2 . . . . . 132 GLY HA2 . 15700 1 1424 . 1 1 132 132 GLY HA3 H 1 3.865 0.030 . 2 . . . . . 132 GLY HA3 . 15700 1 1425 . 1 1 132 132 GLY C C 13 174.547 0.300 . 1 . . . . . 132 GLY C . 15700 1 1426 . 1 1 132 132 GLY CA C 13 45.902 0.400 . 1 . . . . . 132 GLY CA . 15700 1 1427 . 1 1 133 133 ARG H H 1 7.735 0.030 . 1 . . . . . 133 ARG H . 15700 1 1428 . 1 1 133 133 ARG HA H 1 4.611 0.030 . 1 . . . . . 133 ARG HA . 15700 1 1429 . 1 1 133 133 ARG HB2 H 1 2.031 0.030 . 2 . . . . . 133 ARG HB2 . 15700 1 1430 . 1 1 133 133 ARG HB3 H 1 1.681 0.030 . 2 . . . . . 133 ARG HB3 . 15700 1 1431 . 1 1 133 133 ARG HD2 H 1 3.255 0.030 . 2 . . . . . 133 ARG HD2 . 15700 1 1432 . 1 1 133 133 ARG HD3 H 1 3.255 0.030 . 2 . . . . . 133 ARG HD3 . 15700 1 1433 . 1 1 133 133 ARG HG2 H 1 1.642 0.030 . 2 . . . . . 133 ARG HG2 . 15700 1 1434 . 1 1 133 133 ARG HG3 H 1 1.642 0.030 . 2 . . . . . 133 ARG HG3 . 15700 1 1435 . 1 1 133 133 ARG C C 13 175.461 0.300 . 1 . . . . . 133 ARG C . 15700 1 1436 . 1 1 133 133 ARG CA C 13 54.987 0.400 . 1 . . . . . 133 ARG CA . 15700 1 1437 . 1 1 133 133 ARG CB C 13 31.470 0.400 . 1 . . . . . 133 ARG CB . 15700 1 1438 . 1 1 133 133 ARG CD C 13 43.540 0.400 . 1 . . . . . 133 ARG CD . 15700 1 1439 . 1 1 133 133 ARG CG C 13 27.030 0.400 . 1 . . . . . 133 ARG CG . 15700 1 1440 . 1 1 133 133 ARG N N 15 118.194 0.400 . 1 . . . . . 133 ARG N . 15700 1 1441 . 1 1 134 134 HIS H H 1 7.803 0.030 . 1 . . . . . 134 HIS H . 15700 1 1442 . 1 1 134 134 HIS HE1 H 1 8.140 0.030 . 1 . . . . . 134 HIS HE1 . 15700 1 1443 . 1 1 134 134 HIS CE1 C 13 139.993 0.400 . 1 . . . . . 134 HIS CE1 . 15700 1 1444 . 1 1 134 134 HIS N N 15 118.700 0.400 . 1 . . . . . 134 HIS N . 15700 1 1445 . 1 1 135 135 LYS HA H 1 4.331 0.030 . 1 . . . . . 135 LYS HA . 15700 1 1446 . 1 1 135 135 LYS HB2 H 1 1.788 0.030 . 2 . . . . . 135 LYS HB2 . 15700 1 1447 . 1 1 135 135 LYS HB3 H 1 1.682 0.030 . 2 . . . . . 135 LYS HB3 . 15700 1 1448 . 1 1 135 135 LYS HD2 H 1 1.690 0.030 . 2 . . . . . 135 LYS HD2 . 15700 1 1449 . 1 1 135 135 LYS HD3 H 1 1.690 0.030 . 2 . . . . . 135 LYS HD3 . 15700 1 1450 . 1 1 135 135 LYS HE2 H 1 3.070 0.030 . 2 . . . . . 135 LYS HE2 . 15700 1 1451 . 1 1 135 135 LYS HE3 H 1 3.070 0.030 . 2 . . . . . 135 LYS HE3 . 15700 1 1452 . 1 1 135 135 LYS HG2 H 1 1.435 0.030 . 2 . . . . . 135 LYS HG2 . 15700 1 1453 . 1 1 135 135 LYS HG3 H 1 1.365 0.030 . 2 . . . . . 135 LYS HG3 . 15700 1 1454 . 1 1 135 135 LYS C C 13 174.852 0.300 . 1 . . . . . 135 LYS C . 15700 1 1455 . 1 1 135 135 LYS CA C 13 55.390 0.400 . 1 . . . . . 135 LYS CA . 15700 1 1456 . 1 1 135 135 LYS CB C 13 32.970 0.400 . 1 . . . . . 135 LYS CB . 15700 1 1457 . 1 1 135 135 LYS CD C 13 28.920 0.400 . 1 . . . . . 135 LYS CD . 15700 1 1458 . 1 1 135 135 LYS CE C 13 42.343 0.400 . 1 . . . . . 135 LYS CE . 15700 1 1459 . 1 1 135 135 LYS CG C 13 24.540 0.400 . 1 . . . . . 135 LYS CG . 15700 1 1460 . 1 1 136 136 CYS H H 1 7.801 0.030 . 1 . . . . . 136 CYS H . 15700 1 1461 . 1 1 136 136 CYS HA H 1 4.113 0.030 . 1 . . . . . 136 CYS HA . 15700 1 1462 . 1 1 136 136 CYS HB2 H 1 2.840 0.030 . 2 . . . . . 136 CYS HB2 . 15700 1 1463 . 1 1 136 136 CYS HB3 H 1 2.509 0.030 . 2 . . . . . 136 CYS HB3 . 15700 1 1464 . 1 1 136 136 CYS C C 13 174.879 0.300 . 1 . . . . . 136 CYS C . 15700 1 1465 . 1 1 136 136 CYS CA C 13 60.028 0.400 . 1 . . . . . 136 CYS CA . 15700 1 1466 . 1 1 136 136 CYS CB C 13 30.350 0.400 . 1 . . . . . 136 CYS CB . 15700 1 1467 . 1 1 136 136 CYS N N 15 126.055 0.400 . 1 . . . . . 136 CYS N . 15700 1 1468 . 1 1 137 137 ILE H H 1 7.665 0.030 . 1 . . . . . 137 ILE H . 15700 1 1469 . 1 1 137 137 ILE HA H 1 4.072 0.030 . 1 . . . . . 137 ILE HA . 15700 1 1470 . 1 1 137 137 ILE HB H 1 1.914 0.030 . 1 . . . . . 137 ILE HB . 15700 1 1471 . 1 1 137 137 ILE HD11 H 1 0.919 0.030 . 1 . . . . . 137 ILE HD1 . 15700 1 1472 . 1 1 137 137 ILE HD12 H 1 0.919 0.030 . 1 . . . . . 137 ILE HD1 . 15700 1 1473 . 1 1 137 137 ILE HD13 H 1 0.919 0.030 . 1 . . . . . 137 ILE HD1 . 15700 1 1474 . 1 1 137 137 ILE HG12 H 1 1.463 0.030 . 2 . . . . . 137 ILE HG12 . 15700 1 1475 . 1 1 137 137 ILE HG13 H 1 1.225 0.030 . 2 . . . . . 137 ILE HG13 . 15700 1 1476 . 1 1 137 137 ILE HG21 H 1 0.945 0.030 . 1 . . . . . 137 ILE HG2 . 15700 1 1477 . 1 1 137 137 ILE HG22 H 1 0.945 0.030 . 1 . . . . . 137 ILE HG2 . 15700 1 1478 . 1 1 137 137 ILE HG23 H 1 0.945 0.030 . 1 . . . . . 137 ILE HG2 . 15700 1 1479 . 1 1 137 137 ILE CA C 13 62.829 0.400 . 1 . . . . . 137 ILE CA . 15700 1 1480 . 1 1 137 137 ILE CB C 13 39.740 0.400 . 1 . . . . . 137 ILE CB . 15700 1 1481 . 1 1 137 137 ILE CD1 C 13 13.507 0.400 . 1 . . . . . 137 ILE CD1 . 15700 1 1482 . 1 1 137 137 ILE CG1 C 13 27.370 0.400 . 1 . . . . . 137 ILE CG1 . 15700 1 1483 . 1 1 137 137 ILE CG2 C 13 18.380 0.400 . 1 . . . . . 137 ILE CG2 . 15700 1 1484 . 1 1 137 137 ILE N N 15 125.661 0.400 . 1 . . . . . 137 ILE N . 15700 1 stop_ save_