################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 53420 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'VL_ipilimumab chemical shifts' _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-13C HMQC' . . . 53420 1 2 '2D 1H-13C HMQC' . . . 53420 1 3 '2D 1H-13C HMQC' . . . 53420 1 4 '2D 1H-13C HMQC' . . . 53420 1 5 '2D 1H-13C HMQC' . . . 53420 1 6 '2D 1H-13C HMQC' . . . 53420 1 7 '2D 1H-15N TROSY' . . . 53420 1 8 '3D HCCH-TOCSY' . . . 53420 1 9 '3D HN(COCA)CB' . . . 53420 1 10 '3D HCCH-TOCSY' . . . 53420 1 11 '3D HN(CA)CO' . . . 53420 1 12 '3D HNCA' . . . 53420 1 13 '3D HN(CO)CA' . . . 53420 1 14 HN(CA)CB . . . 53420 1 15 '3D HNCO' . . . 53420 1 16 'NOESY HCH' . . . 53420 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 53420 1 4 $software_4 . . 53420 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 13 13 GLY C C 13 174.13 0.08 . 1 . . . . . -13 GLY C . 53420 1 2 . 1 . 1 13 13 GLY CA C 13 45.35 0.08 . 1 . . . . . -13 GLY CA . 53420 1 3 . 1 . 1 14 14 ILE H H 1 8.16 0.08 . 1 . . . . . -12 ILE H . 53420 1 4 . 1 . 1 14 14 ILE HG21 H 1 0.9 0.08 . 1 . . . . . -12 ILE MG . 53420 1 5 . 1 . 1 14 14 ILE HG22 H 1 0.9 0.08 . 1 . . . . . -12 ILE MG . 53420 1 6 . 1 . 1 14 14 ILE HG23 H 1 0.9 0.08 . 1 . . . . . -12 ILE MG . 53420 1 7 . 1 . 1 14 14 ILE HD11 H 1 0.82 0.08 . 1 . . . . . -12 ILE MD . 53420 1 8 . 1 . 1 14 14 ILE HD12 H 1 0.82 0.08 . 1 . . . . . -12 ILE MD . 53420 1 9 . 1 . 1 14 14 ILE HD13 H 1 0.82 0.08 . 1 . . . . . -12 ILE MD . 53420 1 10 . 1 . 1 14 14 ILE C C 13 176.42 0.08 . 1 . . . . . -12 ILE C . 53420 1 11 . 1 . 1 14 14 ILE CA C 13 61.48 0.08 . 1 . . . . . -12 ILE CA . 53420 1 12 . 1 . 1 14 14 ILE CB C 13 38.79 0.08 . 1 . . . . . -12 ILE CB . 53420 1 13 . 1 . 1 14 14 ILE CG2 C 13 17.65 0.08 . 1 . . . . . -12 ILE CG2 . 53420 1 14 . 1 . 1 14 14 ILE CD1 C 13 13.15 0.08 . 1 . . . . . -12 ILE CD1 . 53420 1 15 . 1 . 1 14 14 ILE N N 15 120.11 0.08 . 1 . . . . . -12 ILE N . 53420 1 16 . 1 . 1 15 15 GLU H H 1 8.55 0.08 . 1 . . . . . -11 GLU H . 53420 1 17 . 1 . 1 15 15 GLU C C 13 177.01 0.08 . 1 . . . . . -11 GLU C . 53420 1 18 . 1 . 1 15 15 GLU CA C 13 57.02 0.08 . 1 . . . . . -11 GLU CA . 53420 1 19 . 1 . 1 15 15 GLU CB C 13 30.09 0.08 . 1 . . . . . -11 GLU CB . 53420 1 20 . 1 . 1 15 15 GLU N N 15 124.59 0.08 . 1 . . . . . -11 GLU N . 53420 1 21 . 1 . 1 16 16 GLY H H 1 8.39 0.08 . 1 . . . . . -10 GLY H . 53420 1 22 . 1 . 1 16 16 GLY C C 13 174.3 0.08 . 1 . . . . . -10 GLY C . 53420 1 23 . 1 . 1 16 16 GLY CA C 13 45.57 0.08 . 1 . . . . . -10 GLY CA . 53420 1 24 . 1 . 1 16 16 GLY N N 15 109.93 0.08 . 1 . . . . . -10 GLY N . 53420 1 25 . 1 . 1 20 20 GLU C C 13 176.25 0.08 . 1 . . . . . -6 GLU C . 53420 1 26 . 1 . 1 20 20 GLU CA C 13 57.17 0.08 . 1 . . . . . -6 GLU CA . 53420 1 27 . 1 . 1 21 21 ASN H H 1 8.34 0.08 . 1 . . . . . -5 ASN H . 53420 1 28 . 1 . 1 21 21 ASN C C 13 174.84 0.08 . 1 . . . . . -5 ASN C . 53420 1 29 . 1 . 1 21 21 ASN CA C 13 53.39 0.08 . 1 . . . . . -5 ASN CA . 53420 1 30 . 1 . 1 21 21 ASN CB C 13 38.88 0.08 . 1 . . . . . -5 ASN CB . 53420 1 31 . 1 . 1 21 21 ASN N N 15 118.82 0.08 . 1 . . . . . -5 ASN N . 53420 1 32 . 1 . 1 22 22 LEU H H 1 7.99 0.08 . 1 . . . . . -4 LEU H . 53420 1 33 . 1 . 1 22 22 LEU HD11 H 1 0.87 0.08 . 1 . . . . . -4 LEU MD1 . 53420 1 34 . 1 . 1 22 22 LEU HD12 H 1 0.87 0.08 . 1 . . . . . -4 LEU MD1 . 53420 1 35 . 1 . 1 22 22 LEU HD13 H 1 0.87 0.08 . 1 . . . . . -4 LEU MD1 . 53420 1 36 . 1 . 1 22 22 LEU HD21 H 1 0.8 0.08 . 1 . . . . . -4 LEU MD2 . 53420 1 37 . 1 . 1 22 22 LEU HD22 H 1 0.8 0.08 . 1 . . . . . -4 LEU MD2 . 53420 1 38 . 1 . 1 22 22 LEU HD23 H 1 0.8 0.08 . 1 . . . . . -4 LEU MD2 . 53420 1 39 . 1 . 1 22 22 LEU C C 13 176.71 0.08 . 1 . . . . . -4 LEU C . 53420 1 40 . 1 . 1 22 22 LEU CA C 13 55.44 0.08 . 1 . . . . . -4 LEU CA . 53420 1 41 . 1 . 1 22 22 LEU CB C 13 42.41 0.08 . 1 . . . . . -4 LEU CB . 53420 1 42 . 1 . 1 22 22 LEU CD1 C 13 24.98 0.08 . 1 . . . . . -4 LEU CD1 . 53420 1 43 . 1 . 1 22 22 LEU CD2 C 13 23.48 0.08 . 1 . . . . . -4 LEU CD2 . 53420 1 44 . 1 . 1 22 22 LEU N N 15 121.89 0.08 . 1 . . . . . -4 LEU N . 53420 1 45 . 1 . 1 23 23 TYR H H 1 7.95 0.08 . 1 . . . . . -3 TYR H . 53420 1 46 . 1 . 1 23 23 TYR C C 13 175.3 0.08 . 1 . . . . . -3 TYR C . 53420 1 47 . 1 . 1 23 23 TYR CA C 13 57.58 0.08 . 1 . . . . . -3 TYR CA . 53420 1 48 . 1 . 1 23 23 TYR CB C 13 38.81 0.08 . 1 . . . . . -3 TYR CB . 53420 1 49 . 1 . 1 23 23 TYR N N 15 119.49 0.08 . 1 . . . . . -3 TYR N . 53420 1 50 . 1 . 1 24 24 PHE H H 1 8.07 0.08 . 1 . . . . . -2 PHE H . 53420 1 51 . 1 . 1 24 24 PHE C C 13 175.18 0.08 . 1 . . . . . -2 PHE C . 53420 1 52 . 1 . 1 24 24 PHE CA C 13 57.61 0.08 . 1 . . . . . -2 PHE CA . 53420 1 53 . 1 . 1 24 24 PHE CB C 13 39.83 0.08 . 1 . . . . . -2 PHE CB . 53420 1 54 . 1 . 1 24 24 PHE N N 15 121.91 0.08 . 1 . . . . . -2 PHE N . 53420 1 55 . 1 . 1 25 25 GLN H H 1 8.26 0.08 . 1 . . . . . -1 GLN H . 53420 1 56 . 1 . 1 25 25 GLN C C 13 175.59 0.08 . 1 . . . . . -1 GLN C . 53420 1 57 . 1 . 1 25 25 GLN CA C 13 55.83 0.08 . 1 . . . . . -1 GLN CA . 53420 1 58 . 1 . 1 25 25 GLN CB C 13 29.55 0.08 . 1 . . . . . -1 GLN CB . 53420 1 59 . 1 . 1 25 25 GLN N N 15 123.04 0.08 . 1 . . . . . -1 GLN N . 53420 1 60 . 1 . 1 26 26 GLY H H 1 7.54 0.08 . 1 . . . . . 0 GLY H . 53420 1 61 . 1 . 1 26 26 GLY C C 13 173.23 0.08 . 1 . . . . . 0 GLY C . 53420 1 62 . 1 . 1 26 26 GLY CA C 13 45.03 0.08 . 1 . . . . . 0 GLY CA . 53420 1 63 . 1 . 1 26 26 GLY N N 15 109.19 0.08 . 1 . . . . . 0 GLY N . 53420 1 64 . 1 . 1 27 27 GLU C C 13 176.04 0.08 . 1 . . . . . 1 GLU C . 53420 1 65 . 1 . 1 27 27 GLU CA C 13 55.8 0.08 . 1 . . . . . 1 GLU CA . 53420 1 66 . 1 . 1 27 27 GLU CB C 13 30.78 0.08 . 1 . . . . . 1 GLU CB . 53420 1 67 . 1 . 1 28 28 ILE H H 1 8.73 0.08 . 1 . . . . . 2 ILE H . 53420 1 68 . 1 . 1 28 28 ILE HG21 H 1 0.75 0.08 . 1 . . . . . 2 ILE MG . 53420 1 69 . 1 . 1 28 28 ILE HG22 H 1 0.75 0.08 . 1 . . . . . 2 ILE MG . 53420 1 70 . 1 . 1 28 28 ILE HG23 H 1 0.75 0.08 . 1 . . . . . 2 ILE MG . 53420 1 71 . 1 . 1 28 28 ILE HD11 H 1 0.61 0.08 . 1 . . . . . 2 ILE MD . 53420 1 72 . 1 . 1 28 28 ILE HD12 H 1 0.61 0.08 . 1 . . . . . 2 ILE MD . 53420 1 73 . 1 . 1 28 28 ILE HD13 H 1 0.61 0.08 . 1 . . . . . 2 ILE MD . 53420 1 74 . 1 . 1 28 28 ILE C C 13 175.1 0.08 . 1 . . . . . 2 ILE C . 53420 1 75 . 1 . 1 28 28 ILE CA C 13 62.39 0.08 . 1 . . . . . 2 ILE CA . 53420 1 76 . 1 . 1 28 28 ILE CB C 13 37.37 0.08 . 1 . . . . . 2 ILE CB . 53420 1 77 . 1 . 1 28 28 ILE CG2 C 13 17.87 0.08 . 1 . . . . . 2 ILE CG2 . 53420 1 78 . 1 . 1 28 28 ILE CD1 C 13 12.85 0.08 . 1 . . . . . 2 ILE CD1 . 53420 1 79 . 1 . 1 28 28 ILE N N 15 123.73 0.08 . 1 . . . . . 2 ILE N . 53420 1 80 . 1 . 1 29 29 VAL H H 1 8.48 0.08 . 1 . . . . . 3 VAL H . 53420 1 81 . 1 . 1 29 29 VAL HG11 H 1 0.93 0.08 . 1 . . . . . 3 VAL MG1 . 53420 1 82 . 1 . 1 29 29 VAL HG12 H 1 0.93 0.08 . 1 . . . . . 3 VAL MG1 . 53420 1 83 . 1 . 1 29 29 VAL HG13 H 1 0.93 0.08 . 1 . . . . . 3 VAL MG1 . 53420 1 84 . 1 . 1 29 29 VAL HG21 H 1 0.98 0.08 . 1 . . . . . 3 VAL MG2 . 53420 1 85 . 1 . 1 29 29 VAL HG22 H 1 0.98 0.08 . 1 . . . . . 3 VAL MG2 . 53420 1 86 . 1 . 1 29 29 VAL HG23 H 1 0.98 0.08 . 1 . . . . . 3 VAL MG2 . 53420 1 87 . 1 . 1 29 29 VAL C C 13 176.16 0.08 . 1 . . . . . 3 VAL C . 53420 1 88 . 1 . 1 29 29 VAL CA C 13 62.04 0.08 . 1 . . . . . 3 VAL CA . 53420 1 89 . 1 . 1 29 29 VAL CB C 13 33.57 0.08 . 1 . . . . . 3 VAL CB . 53420 1 90 . 1 . 1 29 29 VAL CG1 C 13 21.18 0.08 . 1 . . . . . 3 VAL CG1 . 53420 1 91 . 1 . 1 29 29 VAL CG2 C 13 21.38 0.08 . 1 . . . . . 3 VAL CG2 . 53420 1 92 . 1 . 1 29 29 VAL N N 15 130.85 0.08 . 1 . . . . . 3 VAL N . 53420 1 93 . 1 . 1 30 30 LEU H H 1 9.17 0.08 . 1 . . . . . 4 LEU H . 53420 1 94 . 1 . 1 30 30 LEU HD11 H 1 0.69 0.08 . 1 . . . . . 4 LEU MD1 . 53420 1 95 . 1 . 1 30 30 LEU HD12 H 1 0.69 0.08 . 1 . . . . . 4 LEU MD1 . 53420 1 96 . 1 . 1 30 30 LEU HD13 H 1 0.69 0.08 . 1 . . . . . 4 LEU MD1 . 53420 1 97 . 1 . 1 30 30 LEU HD21 H 1 0.6 0.08 . 1 . . . . . 4 LEU MD2 . 53420 1 98 . 1 . 1 30 30 LEU HD22 H 1 0.6 0.08 . 1 . . . . . 4 LEU MD2 . 53420 1 99 . 1 . 1 30 30 LEU HD23 H 1 0.6 0.08 . 1 . . . . . 4 LEU MD2 . 53420 1 100 . 1 . 1 30 30 LEU C C 13 176.1 0.08 . 1 . . . . . 4 LEU C . 53420 1 101 . 1 . 1 30 30 LEU CA C 13 53.04 0.08 . 1 . . . . . 4 LEU CA . 53420 1 102 . 1 . 1 30 30 LEU CB C 13 42.61 0.08 . 1 . . . . . 4 LEU CB . 53420 1 103 . 1 . 1 30 30 LEU CD1 C 13 20.7 0.08 . 1 . . . . . 4 LEU CD1 . 53420 1 104 . 1 . 1 30 30 LEU CD2 C 13 24.05 0.08 . 1 . . . . . 4 LEU CD2 . 53420 1 105 . 1 . 1 30 30 LEU N N 15 130.96 0.08 . 1 . . . . . 4 LEU N . 53420 1 106 . 1 . 1 31 31 THR H H 1 9.56 0.08 . 1 . . . . . 5 THR H . 53420 1 107 . 1 . 1 31 31 THR HG21 H 1 1.23 0.08 . 1 . . . . . 5 THR MG . 53420 1 108 . 1 . 1 31 31 THR HG22 H 1 1.23 0.08 . 1 . . . . . 5 THR MG . 53420 1 109 . 1 . 1 31 31 THR HG23 H 1 1.23 0.08 . 1 . . . . . 5 THR MG . 53420 1 110 . 1 . 1 31 31 THR C C 13 175.29 0.08 . 1 . . . . . 5 THR C . 53420 1 111 . 1 . 1 31 31 THR CA C 13 61.88 0.08 . 1 . . . . . 5 THR CA . 53420 1 112 . 1 . 1 31 31 THR CB C 13 70.25 0.08 . 1 . . . . . 5 THR CB . 53420 1 113 . 1 . 1 31 31 THR CG2 C 13 21.47 0.08 . 1 . . . . . 5 THR CG2 . 53420 1 114 . 1 . 1 31 31 THR N N 15 119.27 0.08 . 1 . . . . . 5 THR N . 53420 1 115 . 1 . 1 32 32 GLN H H 1 9.96 0.08 . 1 . . . . . 6 GLN H . 53420 1 116 . 1 . 1 32 32 GLN C C 13 175.3 0.08 . 1 . . . . . 6 GLN C . 53420 1 117 . 1 . 1 32 32 GLN CA C 13 55.77 0.08 . 1 . . . . . 6 GLN CA . 53420 1 118 . 1 . 1 32 32 GLN N N 15 130.23 0.08 . 1 . . . . . 6 GLN N . 53420 1 119 . 1 . 1 33 33 SER H H 1 8.38 0.08 . 1 . . . . . 7 SER H . 53420 1 120 . 1 . 1 33 33 SER C C 13 171.76 0.08 . 1 . . . . . 7 SER C . 53420 1 121 . 1 . 1 33 33 SER CA C 13 55.83 0.08 . 1 . . . . . 7 SER CA . 53420 1 122 . 1 . 1 33 33 SER N N 15 116.21 0.08 . 1 . . . . . 7 SER N . 53420 1 123 . 1 . 1 35 35 GLY C C 13 175.16 0.08 . 1 . . . . . 9 GLY C . 53420 1 124 . 1 . 1 35 35 GLY CA C 13 47.67 0.08 . 1 . . . . . 9 GLY CA . 53420 1 125 . 1 . 1 36 36 THR H H 1 7.81 0.08 . 1 . . . . . 10 THR H . 53420 1 126 . 1 . 1 36 36 THR HG21 H 1 1.14 0.08 . 1 . . . . . 10 THR MG . 53420 1 127 . 1 . 1 36 36 THR HG22 H 1 1.14 0.08 . 1 . . . . . 10 THR MG . 53420 1 128 . 1 . 1 36 36 THR HG23 H 1 1.14 0.08 . 1 . . . . . 10 THR MG . 53420 1 129 . 1 . 1 36 36 THR C C 13 172.46 0.08 . 1 . . . . . 10 THR C . 53420 1 130 . 1 . 1 36 36 THR CA C 13 61.28 0.08 . 1 . . . . . 10 THR CA . 53420 1 131 . 1 . 1 36 36 THR CB C 13 72.13 0.08 . 1 . . . . . 10 THR CB . 53420 1 132 . 1 . 1 36 36 THR CG2 C 13 21.64 0.08 . 1 . . . . . 10 THR CG2 . 53420 1 133 . 1 . 1 36 36 THR N N 15 115.41 0.08 . 1 . . . . . 10 THR N . 53420 1 134 . 1 . 1 37 37 LEU H H 1 9.16 0.08 . 1 . . . . . 11 LEU H . 53420 1 135 . 1 . 1 37 37 LEU HD11 H 1 0.94 0.08 . 1 . . . . . 11 LEU MD1 . 53420 1 136 . 1 . 1 37 37 LEU HD12 H 1 0.94 0.08 . 1 . . . . . 11 LEU MD1 . 53420 1 137 . 1 . 1 37 37 LEU HD13 H 1 0.94 0.08 . 1 . . . . . 11 LEU MD1 . 53420 1 138 . 1 . 1 37 37 LEU HD21 H 1 1.01 0.08 . 1 . . . . . 11 LEU MD2 . 53420 1 139 . 1 . 1 37 37 LEU HD22 H 1 1.01 0.08 . 1 . . . . . 11 LEU MD2 . 53420 1 140 . 1 . 1 37 37 LEU HD23 H 1 1.01 0.08 . 1 . . . . . 11 LEU MD2 . 53420 1 141 . 1 . 1 37 37 LEU C C 13 173.98 0.08 . 1 . . . . . 11 LEU C . 53420 1 142 . 1 . 1 37 37 LEU CA C 13 53.83 0.08 . 1 . . . . . 11 LEU CA . 53420 1 143 . 1 . 1 37 37 LEU CB C 13 46.32 0.08 . 1 . . . . . 11 LEU CB . 53420 1 144 . 1 . 1 37 37 LEU CD1 C 13 24.92 0.08 . 1 . . . . . 11 LEU CD1 . 53420 1 145 . 1 . 1 37 37 LEU CD2 C 13 25.65 0.08 . 1 . . . . . 11 LEU CD2 . 53420 1 146 . 1 . 1 37 37 LEU N N 15 127.68 0.08 . 1 . . . . . 11 LEU N . 53420 1 147 . 1 . 1 38 38 SER C C 13 173.95 0.08 . 1 . . . . . 12 SER C . 53420 1 148 . 1 . 1 38 38 SER CA C 13 56.35 0.08 . 1 . . . . . 12 SER CA . 53420 1 149 . 1 . 1 38 38 SER CB C 13 62.92 0.08 . 1 . . . . . 12 SER CB . 53420 1 150 . 1 . 1 39 39 LEU H H 1 8.59 0.08 . 1 . . . . . 13 LEU H . 53420 1 151 . 1 . 1 39 39 LEU HD11 H 1 0.82 0.08 . 1 . . . . . 13 LEU MD1 . 53420 1 152 . 1 . 1 39 39 LEU HD12 H 1 0.82 0.08 . 1 . . . . . 13 LEU MD1 . 53420 1 153 . 1 . 1 39 39 LEU HD13 H 1 0.82 0.08 . 1 . . . . . 13 LEU MD1 . 53420 1 154 . 1 . 1 39 39 LEU HD21 H 1 1.03 0.08 . 1 . . . . . 13 LEU MD2 . 53420 1 155 . 1 . 1 39 39 LEU HD22 H 1 1.03 0.08 . 1 . . . . . 13 LEU MD2 . 53420 1 156 . 1 . 1 39 39 LEU HD23 H 1 1.03 0.08 . 1 . . . . . 13 LEU MD2 . 53420 1 157 . 1 . 1 39 39 LEU C C 13 175.55 0.08 . 1 . . . . . 13 LEU C . 53420 1 158 . 1 . 1 39 39 LEU CA C 13 53.28 0.08 . 1 . . . . . 13 LEU CA . 53420 1 159 . 1 . 1 39 39 LEU CB C 13 48.25 0.08 . 1 . . . . . 13 LEU CB . 53420 1 160 . 1 . 1 39 39 LEU CD1 C 13 28.01 0.08 . 1 . . . . . 13 LEU CD1 . 53420 1 161 . 1 . 1 39 39 LEU CD2 C 13 23.52 0.08 . 1 . . . . . 13 LEU CD2 . 53420 1 162 . 1 . 1 39 39 LEU N N 15 125.89 0.08 . 1 . . . . . 13 LEU N . 53420 1 163 . 1 . 1 40 40 SER H H 1 9.09 0.08 . 1 . . . . . 14 SER H . 53420 1 164 . 1 . 1 40 40 SER C C 13 171.79 0.08 . 1 . . . . . 14 SER C . 53420 1 165 . 1 . 1 40 40 SER CA C 13 56.96 0.08 . 1 . . . . . 14 SER CA . 53420 1 166 . 1 . 1 40 40 SER CB C 13 63.14 0.08 . 1 . . . . . 14 SER CB . 53420 1 167 . 1 . 1 40 40 SER N N 15 117.78 0.08 . 1 . . . . . 14 SER N . 53420 1 168 . 1 . 1 41 41 PRO C C 13 176.97 0.08 . 1 . . . . . 15 PRO C . 53420 1 169 . 1 . 1 41 41 PRO CA C 13 64.17 0.08 . 1 . . . . . 15 PRO CA . 53420 1 170 . 1 . 1 41 41 PRO CB C 13 31.35 0.08 . 1 . . . . . 15 PRO CB . 53420 1 171 . 1 . 1 42 42 GLY H H 1 9.73 0.08 . 1 . . . . . 16 GLY H . 53420 1 172 . 1 . 1 42 42 GLY C C 13 174.35 0.08 . 1 . . . . . 16 GLY C . 53420 1 173 . 1 . 1 42 42 GLY CA C 13 44.84 0.08 . 1 . . . . . 16 GLY CA . 53420 1 174 . 1 . 1 42 42 GLY N N 15 113.14 0.08 . 1 . . . . . 16 GLY N . 53420 1 175 . 1 . 1 43 43 GLU H H 1 7.59 0.08 . 1 . . . . . 17 GLU H . 53420 1 176 . 1 . 1 43 43 GLU C C 13 173.81 0.08 . 1 . . . . . 17 GLU C . 53420 1 177 . 1 . 1 43 43 GLU CA C 13 57.02 0.08 . 1 . . . . . 17 GLU CA . 53420 1 178 . 1 . 1 43 43 GLU CB C 13 31.5 0.08 . 1 . . . . . 17 GLU CB . 53420 1 179 . 1 . 1 43 43 GLU N N 15 119.86 0.08 . 1 . . . . . 17 GLU N . 53420 1 180 . 1 . 1 44 44 ARG H H 1 8.06 0.08 . 1 . . . . . 18 ARG H . 53420 1 181 . 1 . 1 44 44 ARG C C 13 175.25 0.08 . 1 . . . . . 18 ARG C . 53420 1 182 . 1 . 1 44 44 ARG CA C 13 54.84 0.08 . 1 . . . . . 18 ARG CA . 53420 1 183 . 1 . 1 44 44 ARG CB C 13 32.29 0.08 . 1 . . . . . 18 ARG CB . 53420 1 184 . 1 . 1 44 44 ARG N N 15 120.36 0.08 . 1 . . . . . 18 ARG N . 53420 1 185 . 1 . 1 45 45 ALA H H 1 8.53 0.08 . 1 . . . . . 19 ALA H . 53420 1 186 . 1 . 1 45 45 ALA HB1 H 1 0.97 0.08 . 1 . . . . . 19 ALA MB . 53420 1 187 . 1 . 1 45 45 ALA HB2 H 1 0.97 0.08 . 1 . . . . . 19 ALA MB . 53420 1 188 . 1 . 1 45 45 ALA HB3 H 1 0.97 0.08 . 1 . . . . . 19 ALA MB . 53420 1 189 . 1 . 1 45 45 ALA C C 13 175.44 0.08 . 1 . . . . . 19 ALA C . 53420 1 190 . 1 . 1 45 45 ALA CA C 13 50.27 0.08 . 1 . . . . . 19 ALA CA . 53420 1 191 . 1 . 1 45 45 ALA CB C 13 22.47 0.08 . 1 . . . . . 19 ALA CB . 53420 1 192 . 1 . 1 45 45 ALA N N 15 126.76 0.08 . 1 . . . . . 19 ALA N . 53420 1 193 . 1 . 1 46 46 THR H H 1 8.02 0.08 . 1 . . . . . 20 THR H . 53420 1 194 . 1 . 1 46 46 THR HG21 H 1 1.01 0.08 . 1 . . . . . 20 THR MG . 53420 1 195 . 1 . 1 46 46 THR HG22 H 1 1.01 0.08 . 1 . . . . . 20 THR MG . 53420 1 196 . 1 . 1 46 46 THR HG23 H 1 1.01 0.08 . 1 . . . . . 20 THR MG . 53420 1 197 . 1 . 1 46 46 THR C C 13 172.5 0.08 . 1 . . . . . 20 THR C . 53420 1 198 . 1 . 1 46 46 THR CA C 13 62.21 0.08 . 1 . . . . . 20 THR CA . 53420 1 199 . 1 . 1 46 46 THR CB C 13 70.32 0.08 . 1 . . . . . 20 THR CB . 53420 1 200 . 1 . 1 46 46 THR CG2 C 13 21.59 0.08 . 1 . . . . . 20 THR CG2 . 53420 1 201 . 1 . 1 46 46 THR N N 15 116.8 0.08 . 1 . . . . . 20 THR N . 53420 1 202 . 1 . 1 47 47 LEU H H 1 9.27 0.08 . 1 . . . . . 21 LEU H . 53420 1 203 . 1 . 1 47 47 LEU HD11 H 1 0.39 0.08 . 1 . . . . . 21 LEU MD1 . 53420 1 204 . 1 . 1 47 47 LEU HD12 H 1 0.39 0.08 . 1 . . . . . 21 LEU MD1 . 53420 1 205 . 1 . 1 47 47 LEU HD13 H 1 0.39 0.08 . 1 . . . . . 21 LEU MD1 . 53420 1 206 . 1 . 1 47 47 LEU HD21 H 1 0.62 0.08 . 1 . . . . . 21 LEU MD2 . 53420 1 207 . 1 . 1 47 47 LEU HD22 H 1 0.62 0.08 . 1 . . . . . 21 LEU MD2 . 53420 1 208 . 1 . 1 47 47 LEU HD23 H 1 0.62 0.08 . 1 . . . . . 21 LEU MD2 . 53420 1 209 . 1 . 1 47 47 LEU C C 13 175.46 0.08 . 1 . . . . . 21 LEU C . 53420 1 210 . 1 . 1 47 47 LEU CA C 13 55.5 0.08 . 1 . . . . . 21 LEU CA . 53420 1 211 . 1 . 1 47 47 LEU CB C 13 42.52 0.08 . 1 . . . . . 21 LEU CB . 53420 1 212 . 1 . 1 47 47 LEU CD1 C 13 24.88 0.08 . 1 . . . . . 21 LEU CD1 . 53420 1 213 . 1 . 1 47 47 LEU CD2 C 13 27.32 0.08 . 1 . . . . . 21 LEU CD2 . 53420 1 214 . 1 . 1 47 47 LEU N N 15 129.8 0.08 . 1 . . . . . 21 LEU N . 53420 1 215 . 1 . 1 48 48 SER H H 1 8.61 0.08 . 1 . . . . . 22 SER H . 53420 1 216 . 1 . 1 48 48 SER C C 13 174.98 0.08 . 1 . . . . . 22 SER C . 53420 1 217 . 1 . 1 48 48 SER CA C 13 58.14 0.08 . 1 . . . . . 22 SER CA . 53420 1 218 . 1 . 1 48 48 SER CB C 13 65.28 0.08 . 1 . . . . . 22 SER CB . 53420 1 219 . 1 . 1 48 48 SER N N 15 114.36 0.08 . 1 . . . . . 22 SER N . 53420 1 220 . 1 . 1 50 50 ARG H H 1 8.87 0.08 . 1 . . . . . 24 ARG H . 53420 1 221 . 1 . 1 50 50 ARG C C 13 175.08 0.08 . 1 . . . . . 24 ARG C . 53420 1 222 . 1 . 1 50 50 ARG CA C 13 54.18 0.08 . 1 . . . . . 24 ARG CA . 53420 1 223 . 1 . 1 50 50 ARG CB C 13 32.76 0.08 . 1 . . . . . 24 ARG CB . 53420 1 224 . 1 . 1 50 50 ARG N N 15 128.27 0.08 . 1 . . . . . 24 ARG N . 53420 1 225 . 1 . 1 51 51 ALA H H 1 9.39 0.08 . 1 . . . . . 25 ALA H . 53420 1 226 . 1 . 1 51 51 ALA HB1 H 1 1.45 0.08 . 1 . . . . . 25 ALA MB . 53420 1 227 . 1 . 1 51 51 ALA HB2 H 1 1.45 0.08 . 1 . . . . . 25 ALA MB . 53420 1 228 . 1 . 1 51 51 ALA HB3 H 1 1.45 0.08 . 1 . . . . . 25 ALA MB . 53420 1 229 . 1 . 1 51 51 ALA C C 13 178.14 0.08 . 1 . . . . . 25 ALA C . 53420 1 230 . 1 . 1 51 51 ALA CA C 13 50.34 0.08 . 1 . . . . . 25 ALA CA . 53420 1 231 . 1 . 1 51 51 ALA CB C 13 23.32 0.08 . 1 . . . . . 25 ALA CB . 53420 1 232 . 1 . 1 51 51 ALA N N 15 128.53 0.08 . 1 . . . . . 25 ALA N . 53420 1 233 . 1 . 1 52 52 SER H H 1 8.56 0.08 . 1 . . . . . 26 SER H . 53420 1 234 . 1 . 1 52 52 SER C C 13 173.71 0.08 . 1 . . . . . 26 SER C . 53420 1 235 . 1 . 1 52 52 SER CA C 13 60.5 0.08 . 1 . . . . . 26 SER CA . 53420 1 236 . 1 . 1 52 52 SER CB C 13 62.83 0.08 . 1 . . . . . 26 SER CB . 53420 1 237 . 1 . 1 52 52 SER N N 15 114.86 0.08 . 1 . . . . . 26 SER N . 53420 1 238 . 1 . 1 53 53 GLN H H 1 7.34 0.08 . 1 . . . . . 27 GLN H . 53420 1 239 . 1 . 1 53 53 GLN C C 13 173.09 0.08 . 1 . . . . . 27 GLN C . 53420 1 240 . 1 . 1 53 53 GLN CA C 13 53.75 0.08 . 1 . . . . . 27 GLN CA . 53420 1 241 . 1 . 1 53 53 GLN CB C 13 32.72 0.08 . 1 . . . . . 27 GLN CB . 53420 1 242 . 1 . 1 53 53 GLN N N 15 117.45 0.08 . 1 . . . . . 27 GLN N . 53420 1 243 . 1 . 1 54 54 SER H H 1 8.18 0.08 . 1 . . . . . 28 SER H . 53420 1 244 . 1 . 1 54 54 SER C C 13 174.34 0.08 . 1 . . . . . 28 SER C . 53420 1 245 . 1 . 1 54 54 SER CA C 13 59.71 0.08 . 1 . . . . . 28 SER CA . 53420 1 246 . 1 . 1 54 54 SER CB C 13 63.18 0.08 . 1 . . . . . 28 SER CB . 53420 1 247 . 1 . 1 54 54 SER N N 15 112.61 0.08 . 1 . . . . . 28 SER N . 53420 1 248 . 1 . 1 55 55 VAL H H 1 8.38 0.08 . 1 . . . . . 29 VAL H . 53420 1 249 . 1 . 1 55 55 VAL HG11 H 1 0.77 0.08 . 1 . . . . . 29 VAL MG1 . 53420 1 250 . 1 . 1 55 55 VAL HG12 H 1 0.77 0.08 . 1 . . . . . 29 VAL MG1 . 53420 1 251 . 1 . 1 55 55 VAL HG13 H 1 0.77 0.08 . 1 . . . . . 29 VAL MG1 . 53420 1 252 . 1 . 1 55 55 VAL HG21 H 1 0.84 0.08 . 1 . . . . . 29 VAL MG2 . 53420 1 253 . 1 . 1 55 55 VAL HG22 H 1 0.84 0.08 . 1 . . . . . 29 VAL MG2 . 53420 1 254 . 1 . 1 55 55 VAL HG23 H 1 0.84 0.08 . 1 . . . . . 29 VAL MG2 . 53420 1 255 . 1 . 1 55 55 VAL C C 13 176.35 0.08 . 1 . . . . . 29 VAL C . 53420 1 256 . 1 . 1 55 55 VAL CA C 13 61.48 0.08 . 1 . . . . . 29 VAL CA . 53420 1 257 . 1 . 1 55 55 VAL CB C 13 33.6 0.08 . 1 . . . . . 29 VAL CB . 53420 1 258 . 1 . 1 55 55 VAL CG1 C 13 21.74 0.08 . 1 . . . . . 29 VAL CG1 . 53420 1 259 . 1 . 1 55 55 VAL CG2 C 13 21.3 0.08 . 1 . . . . . 29 VAL CG2 . 53420 1 260 . 1 . 1 55 55 VAL N N 15 125.44 0.08 . 1 . . . . . 29 VAL N . 53420 1 261 . 1 . 1 60 60 LEU HD11 H 1 0.02 0.08 . 1 . . . . . 34 LEU MD1 . 53420 1 262 . 1 . 1 60 60 LEU HD12 H 1 0.02 0.08 . 1 . . . . . 34 LEU MD1 . 53420 1 263 . 1 . 1 60 60 LEU HD13 H 1 0.02 0.08 . 1 . . . . . 34 LEU MD1 . 53420 1 264 . 1 . 1 60 60 LEU HD21 H 1 0.12 0.08 . 1 . . . . . 34 LEU MD2 . 53420 1 265 . 1 . 1 60 60 LEU HD22 H 1 0.12 0.08 . 1 . . . . . 34 LEU MD2 . 53420 1 266 . 1 . 1 60 60 LEU HD23 H 1 0.12 0.08 . 1 . . . . . 34 LEU MD2 . 53420 1 267 . 1 . 1 60 60 LEU CD1 C 13 23.01 0.08 . 1 . . . . . 34 LEU CD1 . 53420 1 268 . 1 . 1 60 60 LEU CD2 C 13 22.66 0.08 . 1 . . . . . 34 LEU CD2 . 53420 1 269 . 1 . 1 61 61 ALA HB1 H 1 1.44 0.08 . 1 . . . . . 35 ALA MB . 53420 1 270 . 1 . 1 61 61 ALA HB2 H 1 1.44 0.08 . 1 . . . . . 35 ALA MB . 53420 1 271 . 1 . 1 61 61 ALA HB3 H 1 1.44 0.08 . 1 . . . . . 35 ALA MB . 53420 1 272 . 1 . 1 61 61 ALA CB C 13 23.75 0.08 . 1 . . . . . 35 ALA C . 53420 1 273 . 1 . 1 67 67 PRO CA C 13 64.2 0.08 . 1 . . . . . 41 PRO CA . 53420 1 274 . 1 . 1 68 68 GLY H H 1 8.62 0.08 . 1 . . . . . 42 GLY H . 53420 1 275 . 1 . 1 68 68 GLY C C 13 174.02 0.08 . 1 . . . . . 42 GLY C . 53420 1 276 . 1 . 1 68 68 GLY CA C 13 45.85 0.08 . 1 . . . . . 42 GLY CA . 53420 1 277 . 1 . 1 68 68 GLY N N 15 112.99 0.08 . 1 . . . . . 42 GLY N . 53420 1 278 . 1 . 1 69 69 GLN H H 1 8.04 0.08 . 1 . . . . . 43 GLN H . 53420 1 279 . 1 . 1 69 69 GLN C C 13 174.82 0.08 . 1 . . . . . 43 GLN C . 53420 1 280 . 1 . 1 69 69 GLN CA C 13 54.02 0.08 . 1 . . . . . 43 GLN CA . 53420 1 281 . 1 . 1 69 69 GLN CB C 13 32.17 0.08 . 1 . . . . . 43 GLN CB . 53420 1 282 . 1 . 1 69 69 GLN N N 15 119.19 0.08 . 1 . . . . . 43 GLN N . 53420 1 283 . 1 . 1 70 70 ALA H H 1 8.35 0.08 . 1 . . . . . 44 ALA H . 53420 1 284 . 1 . 1 70 70 ALA HB1 H 1 1.28 0.08 . 1 . . . . . 44 ALA MB . 53420 1 285 . 1 . 1 70 70 ALA HB2 H 1 1.28 0.08 . 1 . . . . . 44 ALA MB . 53420 1 286 . 1 . 1 70 70 ALA HB3 H 1 1.28 0.08 . 1 . . . . . 44 ALA MB . 53420 1 287 . 1 . 1 70 70 ALA C C 13 175.5 0.08 . 1 . . . . . 44 ALA C . 53420 1 288 . 1 . 1 70 70 ALA CA C 13 50.34 0.08 . 1 . . . . . 44 ALA CA . 53420 1 289 . 1 . 1 70 70 ALA CB C 13 18.96 0.08 . 1 . . . . . 44 ALA CB . 53420 1 290 . 1 . 1 70 70 ALA N N 15 121.76 0.08 . 1 . . . . . 44 ALA N . 53420 1 291 . 1 . 1 73 73 LEU HD11 H 1 0.38 0.08 . 1 . . . . . 47 LEU MD1 . 53420 1 292 . 1 . 1 73 73 LEU HD12 H 1 0.38 0.08 . 1 . . . . . 47 LEU MD1 . 53420 1 293 . 1 . 1 73 73 LEU HD13 H 1 0.38 0.08 . 1 . . . . . 47 LEU MD1 . 53420 1 294 . 1 . 1 73 73 LEU HD21 H 1 0.35 0.08 . 1 . . . . . 47 LEU MD2 . 53420 1 295 . 1 . 1 73 73 LEU HD22 H 1 0.35 0.08 . 1 . . . . . 47 LEU MD2 . 53420 1 296 . 1 . 1 73 73 LEU HD23 H 1 0.35 0.08 . 1 . . . . . 47 LEU MD2 . 53420 1 297 . 1 . 1 73 73 LEU CD1 C 13 23.12 0.08 . 1 . . . . . 47 LEU CD1 . 53420 1 298 . 1 . 1 73 73 LEU CD2 C 13 27.48 0.08 . 1 . . . . . 47 LEU CD2 . 53420 1 299 . 1 . 1 74 74 LEU HD11 H 1 0.69 0.08 . 1 . . . . . 48 LEU MD1 . 53420 1 300 . 1 . 1 74 74 LEU HD12 H 1 0.69 0.08 . 1 . . . . . 48 LEU MD1 . 53420 1 301 . 1 . 1 74 74 LEU HD13 H 1 0.69 0.08 . 1 . . . . . 48 LEU MD1 . 53420 1 302 . 1 . 1 74 74 LEU HD21 H 1 0.38 0.08 . 1 . . . . . 48 LEU MD2 . 53420 1 303 . 1 . 1 74 74 LEU HD22 H 1 0.38 0.08 . 1 . . . . . 48 LEU MD2 . 53420 1 304 . 1 . 1 74 74 LEU HD23 H 1 0.38 0.08 . 1 . . . . . 48 LEU MD2 . 53420 1 305 . 1 . 1 74 74 LEU C C 13 175.92 0.08 . 1 . . . . . 48 LEU C . 53420 1 306 . 1 . 1 74 74 LEU CA C 13 54.98 0.08 . 1 . . . . . 48 LEU CA . 53420 1 307 . 1 . 1 74 74 LEU CD1 C 13 27.15 0.08 . 1 . . . . . 48 LEU CD1 . 53420 1 308 . 1 . 1 74 74 LEU CD2 C 13 23.12 0.08 . 1 . . . . . 48 LEU CD2 . 53420 1 309 . 1 . 1 75 75 ILE H H 1 7.12 0.08 . 1 . . . . . 49 ILE H . 53420 1 310 . 1 . 1 75 75 ILE HG21 H 1 0.63 0.08 . 1 . . . . . 49 ILE MG . 53420 1 311 . 1 . 1 75 75 ILE HG22 H 1 0.63 0.08 . 1 . . . . . 49 ILE MG . 53420 1 312 . 1 . 1 75 75 ILE HG23 H 1 0.63 0.08 . 1 . . . . . 49 ILE MG . 53420 1 313 . 1 . 1 75 75 ILE HD11 H 1 0.49 0.08 . 1 . . . . . 49 ILE MD . 53420 1 314 . 1 . 1 75 75 ILE HD12 H 1 0.49 0.08 . 1 . . . . . 49 ILE MD . 53420 1 315 . 1 . 1 75 75 ILE HD13 H 1 0.49 0.08 . 1 . . . . . 49 ILE MD . 53420 1 316 . 1 . 1 75 75 ILE C C 13 173.88 0.08 . 1 . . . . . 49 ILE C . 53420 1 317 . 1 . 1 75 75 ILE CA C 13 56.76 0.08 . 1 . . . . . 49 ILE CA . 53420 1 318 . 1 . 1 75 75 ILE CB C 13 43.19 0.08 . 1 . . . . . 49 ILE CB . 53420 1 319 . 1 . 1 75 75 ILE CG2 C 13 17.67 0.08 . 1 . . . . . 49 ILE CG2 . 53420 1 320 . 1 . 1 75 75 ILE CD1 C 13 11.6 0.08 . 1 . . . . . 49 ILE CD1 . 53420 1 321 . 1 . 1 75 75 ILE N N 15 117.4 0.08 . 1 . . . . . 49 ILE N . 53420 1 322 . 1 . 1 76 76 TYR H H 1 9.08 0.08 . 1 . . . . . 50 TYR H . 53420 1 323 . 1 . 1 76 76 TYR C C 13 173.25 0.08 . 1 . . . . . 50 TYR C . 53420 1 324 . 1 . 1 76 76 TYR CA C 13 55.19 0.08 . 1 . . . . . 50 TYR CA . 53420 1 325 . 1 . 1 76 76 TYR CB C 13 40.55 0.08 . 1 . . . . . 50 TYR CB . 53420 1 326 . 1 . 1 76 76 TYR N N 15 122.37 0.08 . 1 . . . . . 50 TYR N . 53420 1 327 . 1 . 1 77 77 GLY H H 1 7.92 0.08 . 1 . . . . . 51 GLY H . 53420 1 328 . 1 . 1 77 77 GLY C C 13 177.93 0.08 . 1 . . . . . 51 GLY C . 53420 1 329 . 1 . 1 77 77 GLY CA C 13 48.54 0.08 . 1 . . . . . 51 GLY CA . 53420 1 330 . 1 . 1 77 77 GLY N N 15 110.32 0.08 . 1 . . . . . 51 GLY N . 53420 1 331 . 1 . 1 78 78 ALA H H 1 9.1 0.08 . 1 . . . . . 52 ALA H . 53420 1 332 . 1 . 1 78 78 ALA HB1 H 1 1.42 0.08 . 1 . . . . . 52 ALA MB . 53420 1 333 . 1 . 1 78 78 ALA HB2 H 1 1.42 0.08 . 1 . . . . . 52 ALA MB . 53420 1 334 . 1 . 1 78 78 ALA HB3 H 1 1.42 0.08 . 1 . . . . . 52 ALA MB . 53420 1 335 . 1 . 1 78 78 ALA C C 13 178.7 0.08 . 1 . . . . . 52 ALA C . 53420 1 336 . 1 . 1 78 78 ALA CA C 13 57.68 0.08 . 1 . . . . . 52 ALA CA . 53420 1 337 . 1 . 1 78 78 ALA CB C 13 19.24 0.08 . 1 . . . . . 52 ALA CB . 53420 1 338 . 1 . 1 78 78 ALA N N 15 116.62 0.08 . 1 . . . . . 52 ALA N . 53420 1 339 . 1 . 1 79 79 PHE H H 1 8.2 0.08 . 1 . . . . . 53 PHE H . 53420 1 340 . 1 . 1 79 79 PHE C C 13 177.32 0.08 . 1 . . . . . 53 PHE C . 53420 1 341 . 1 . 1 79 79 PHE CA C 13 56.1 0.08 . 1 . . . . . 53 PHE CA . 53420 1 342 . 1 . 1 79 79 PHE CB C 13 42.11 0.08 . 1 . . . . . 53 PHE CB . 53420 1 343 . 1 . 1 79 79 PHE N N 15 114.48 0.08 . 1 . . . . . 53 PHE N . 53420 1 344 . 1 . 1 80 80 SER H H 1 8.15 0.08 . 1 . . . . . 54 SER H . 53420 1 345 . 1 . 1 80 80 SER C C 13 172.12 0.08 . 1 . . . . . 54 SER C . 53420 1 346 . 1 . 1 80 80 SER CA C 13 59.17 0.08 . 1 . . . . . 54 SER CA . 53420 1 347 . 1 . 1 80 80 SER CB C 13 62.51 0.08 . 1 . . . . . 54 SER CB . 53420 1 348 . 1 . 1 80 80 SER N N 15 119.28 0.08 . 1 . . . . . 54 SER N . 53420 1 349 . 1 . 1 81 81 ARG H H 1 8.64 0.08 . 1 . . . . . 55 ARG H . 53420 1 350 . 1 . 1 81 81 ARG C C 13 177.19 0.08 . 1 . . . . . 55 ARG C . 53420 1 351 . 1 . 1 81 81 ARG CA C 13 56.49 0.08 . 1 . . . . . 55 ARG CA . 53420 1 352 . 1 . 1 81 81 ARG CB C 13 31.69 0.08 . 1 . . . . . 55 ARG CB . 53420 1 353 . 1 . 1 81 81 ARG N N 15 125.28 0.08 . 1 . . . . . 55 ARG N . 53420 1 354 . 1 . 1 82 82 ALA H H 1 7.96 0.08 . 1 . . . . . 56 ALA H . 53420 1 355 . 1 . 1 82 82 ALA HB1 H 1 1.17 0.08 . 1 . . . . . 56 ALA MB . 53420 1 356 . 1 . 1 82 82 ALA HB2 H 1 1.17 0.08 . 1 . . . . . 56 ALA MB . 53420 1 357 . 1 . 1 82 82 ALA HB3 H 1 1.17 0.08 . 1 . . . . . 56 ALA MB . 53420 1 358 . 1 . 1 82 82 ALA C C 13 176.66 0.08 . 1 . . . . . 56 ALA C . 53420 1 359 . 1 . 1 82 82 ALA CA C 13 51.76 0.08 . 1 . . . . . 56 ALA CA . 53420 1 360 . 1 . 1 82 82 ALA CB C 13 18.75 0.08 . 1 . . . . . 56 ALA CB . 53420 1 361 . 1 . 1 82 82 ALA N N 15 126.32 0.08 . 1 . . . . . 56 ALA N . 53420 1 362 . 1 . 1 83 83 THR H H 1 7.88 0.08 . 1 . . . . . 57 THR H . 53420 1 363 . 1 . 1 83 83 THR HG21 H 1 1.16 0.08 . 1 . . . . . 57 THR MG . 53420 1 364 . 1 . 1 83 83 THR HG22 H 1 1.16 0.08 . 1 . . . . . 57 THR MG . 53420 1 365 . 1 . 1 83 83 THR HG23 H 1 1.16 0.08 . 1 . . . . . 57 THR MG . 53420 1 366 . 1 . 1 83 83 THR CA C 13 64.6 0.08 . 1 . . . . . 57 THR CA . 53420 1 367 . 1 . 1 83 83 THR CB C 13 69.25 0.08 . 1 . . . . . 57 THR CB . 53420 1 368 . 1 . 1 83 83 THR CG2 C 13 21.74 0.08 . 1 . . . . . 57 THR CG2 . 53420 1 369 . 1 . 1 83 83 THR N N 15 116.64 0.08 . 1 . . . . . 57 THR N . 53420 1 370 . 1 . 1 85 85 ILE HG21 H 1 0.97 0.08 . 1 . . . . . 59 ILE MG . 53420 1 371 . 1 . 1 85 85 ILE HG22 H 1 0.97 0.08 . 1 . . . . . 59 ILE MG . 53420 1 372 . 1 . 1 85 85 ILE HG23 H 1 0.97 0.08 . 1 . . . . . 59 ILE MG . 53420 1 373 . 1 . 1 85 85 ILE HD11 H 1 0.66 0.08 . 1 . . . . . 59 ILE MD . 53420 1 374 . 1 . 1 85 85 ILE HD12 H 1 0.66 0.08 . 1 . . . . . 59 ILE MD . 53420 1 375 . 1 . 1 85 85 ILE HD13 H 1 0.66 0.08 . 1 . . . . . 59 ILE MD . 53420 1 376 . 1 . 1 85 85 ILE CG2 C 13 16.2 0.08 . 1 . . . . . 59 ILE CG2 . 53420 1 377 . 1 . 1 85 85 ILE CD1 C 13 8.51 0.08 . 1 . . . . . 59 ILE CD1 . 53420 1 378 . 1 . 1 87 87 ASP C C 13 176.22 0.08 . 1 . . . . . 61 ASP C . 53420 1 379 . 1 . 1 87 87 ASP CA C 13 55.83 0.08 . 1 . . . . . 61 ASP CA . 53420 1 380 . 1 . 1 88 88 ARG H H 1 7.06 0.08 . 1 . . . . . 62 ARG H . 53420 1 381 . 1 . 1 88 88 ARG C C 13 175.64 0.08 . 1 . . . . . 62 ARG C . 53420 1 382 . 1 . 1 88 88 ARG CA C 13 56.73 0.08 . 1 . . . . . 62 ARG CA . 53420 1 383 . 1 . 1 88 88 ARG CB C 13 29.46 0.08 . 1 . . . . . 62 ARG CB . 53420 1 384 . 1 . 1 88 88 ARG N N 15 113.64 0.08 . 1 . . . . . 62 ARG N . 53420 1 385 . 1 . 1 89 89 PHE H H 1 7.58 0.08 . 1 . . . . . 63 PHE H . 53420 1 386 . 1 . 1 89 89 PHE C C 13 174.63 0.08 . 1 . . . . . 63 PHE C . 53420 1 387 . 1 . 1 89 89 PHE CA C 13 57.96 0.08 . 1 . . . . . 63 PHE CA . 53420 1 388 . 1 . 1 89 89 PHE CB C 13 40.26 0.08 . 1 . . . . . 63 PHE CB . 53420 1 389 . 1 . 1 89 89 PHE N N 15 119.86 0.08 . 1 . . . . . 63 PHE N . 53420 1 390 . 1 . 1 90 90 SER H H 1 8.79 0.08 . 1 . . . . . 64 SER H . 53420 1 391 . 1 . 1 90 90 SER C C 13 172.75 0.08 . 1 . . . . . 64 SER C . 53420 1 392 . 1 . 1 90 90 SER CA C 13 57.38 0.08 . 1 . . . . . 64 SER CA . 53420 1 393 . 1 . 1 90 90 SER CB C 13 65.64 0.08 . 1 . . . . . 64 SER CB . 53420 1 394 . 1 . 1 90 90 SER N N 15 115.27 0.08 . 1 . . . . . 64 SER N . 53420 1 395 . 1 . 1 91 91 GLY H H 1 9.11 0.08 . 1 . . . . . 65 GLY H . 53420 1 396 . 1 . 1 91 91 GLY C C 13 172.46 0.08 . 1 . . . . . 65 GLY C . 53420 1 397 . 1 . 1 91 91 GLY CA C 13 44.02 0.08 . 1 . . . . . 65 GLY CA . 53420 1 398 . 1 . 1 91 91 GLY N N 15 112.84 0.08 . 1 . . . . . 65 GLY N . 53420 1 399 . 1 . 1 92 92 SER H H 1 8.98 0.08 . 1 . . . . . 66 SER H . 53420 1 400 . 1 . 1 92 92 SER C C 13 174.07 0.08 . 1 . . . . . 66 SER C . 53420 1 401 . 1 . 1 92 92 SER CA C 13 57.47 0.08 . 1 . . . . . 66 SER CA . 53420 1 402 . 1 . 1 92 92 SER CB C 13 65.86 0.08 . 1 . . . . . 66 SER CB . 53420 1 403 . 1 . 1 92 92 SER N N 15 113.94 0.08 . 1 . . . . . 66 SER N . 53420 1 404 . 1 . 1 93 93 GLY C C 13 171.9 0.08 . 1 . . . . . 67 GLY C . 53420 1 405 . 1 . 1 93 93 GLY CA C 13 45.57 0.08 . 1 . . . . . 67 GLY CA . 53420 1 406 . 1 . 1 94 94 SER H H 1 7.19 0.08 . 1 . . . . . 68 SER H . 53420 1 407 . 1 . 1 94 94 SER C C 13 174.17 0.08 . 1 . . . . . 68 SER C . 53420 1 408 . 1 . 1 94 94 SER CA C 13 58.29 0.08 . 1 . . . . . 68 SER CA . 53420 1 409 . 1 . 1 94 94 SER CB C 13 64.58 0.08 . 1 . . . . . 68 SER CB . 53420 1 410 . 1 . 1 94 94 SER N N 15 108.66 0.08 . 1 . . . . . 68 SER N . 53420 1 411 . 1 . 1 95 95 GLY H H 1 8.83 0.08 . 1 . . . . . 69 GLY H . 53420 1 412 . 1 . 1 95 95 GLY C C 13 172.89 0.08 . 1 . . . . . 69 GLY C . 53420 1 413 . 1 . 1 95 95 GLY CA C 13 48.03 0.08 . 1 . . . . . 69 GLY CA . 53420 1 414 . 1 . 1 95 95 GLY N N 15 111.26 0.08 . 1 . . . . . 69 GLY N . 53420 1 415 . 1 . 1 96 96 THR H H 1 8.31 0.08 . 1 . . . . . 70 THR H . 53420 1 416 . 1 . 1 96 96 THR HG21 H 1 0.93 0.08 . 1 . . . . . 70 THR MG . 53420 1 417 . 1 . 1 96 96 THR HG22 H 1 0.93 0.08 . 1 . . . . . 70 THR MG . 53420 1 418 . 1 . 1 96 96 THR HG23 H 1 0.93 0.08 . 1 . . . . . 70 THR MG . 53420 1 419 . 1 . 1 96 96 THR C C 13 173.92 0.08 . 1 . . . . . 70 THR C . 53420 1 420 . 1 . 1 96 96 THR CA C 13 61.24 0.08 . 1 . . . . . 70 THR CA . 53420 1 421 . 1 . 1 96 96 THR CB C 13 70.65 0.08 . 1 . . . . . 70 THR CB . 53420 1 422 . 1 . 1 96 96 THR CG2 C 13 20.98 0.08 . 1 . . . . . 70 THR CG2 . 53420 1 423 . 1 . 1 96 96 THR N N 15 115.32 0.08 . 1 . . . . . 70 THR N . 53420 1 424 . 1 . 1 97 97 ASP H H 1 7.37 0.08 . 1 . . . . . 71 ASP H . 53420 1 425 . 1 . 1 97 97 ASP C C 13 173.26 0.08 . 1 . . . . . 71 ASP C . 53420 1 426 . 1 . 1 97 97 ASP CA C 13 54.59 0.08 . 1 . . . . . 71 ASP CA . 53420 1 427 . 1 . 1 97 97 ASP N N 15 122.25 0.08 . 1 . . . . . 71 ASP N . 53420 1 428 . 1 . 1 98 98 PHE H H 1 8.75 0.08 . 1 . . . . . 72 PHE H . 53420 1 429 . 1 . 1 98 98 PHE C C 13 175.75 0.08 . 1 . . . . . 72 PHE C . 53420 1 430 . 1 . 1 98 98 PHE CA C 13 57.28 0.08 . 1 . . . . . 72 PHE CA . 53420 1 431 . 1 . 1 98 98 PHE N N 15 122.56 0.08 . 1 . . . . . 72 PHE N . 53420 1 432 . 1 . 1 99 99 THR H H 1 8.99 0.08 . 1 . . . . . 73 THR H . 53420 1 433 . 1 . 1 99 99 THR HG21 H 1 1.03 0.08 . 1 . . . . . 73 THR MG . 53420 1 434 . 1 . 1 99 99 THR HG22 H 1 1.03 0.08 . 1 . . . . . 73 THR MG . 53420 1 435 . 1 . 1 99 99 THR HG23 H 1 1.03 0.08 . 1 . . . . . 73 THR MG . 53420 1 436 . 1 . 1 99 99 THR C C 13 172.33 0.08 . 1 . . . . . 73 THR C . 53420 1 437 . 1 . 1 99 99 THR CA C 13 61.1 0.08 . 1 . . . . . 73 THR CA . 53420 1 438 . 1 . 1 99 99 THR CB C 13 73.02 0.08 . 1 . . . . . 73 THR CB . 53420 1 439 . 1 . 1 99 99 THR CG2 C 13 22 0.08 . 1 . . . . . 73 THR CG2 . 53420 1 440 . 1 . 1 99 99 THR N N 15 116.77 0.08 . 1 . . . . . 73 THR N . 53420 1 441 . 1 . 1 100 100 LEU H H 1 8.48 0.08 . 1 . . . . . 74 LEU H . 53420 1 442 . 1 . 1 100 100 LEU HD11 H 1 0.28 0.08 . 1 . . . . . 74 LEU MD1 . 53420 1 443 . 1 . 1 100 100 LEU HD12 H 1 0.28 0.08 . 1 . . . . . 74 LEU MD1 . 53420 1 444 . 1 . 1 100 100 LEU HD13 H 1 0.28 0.08 . 1 . . . . . 74 LEU MD1 . 53420 1 445 . 1 . 1 100 100 LEU HD21 H 1 0.23 0.08 . 1 . . . . . 74 LEU MD2 . 53420 1 446 . 1 . 1 100 100 LEU HD22 H 1 0.23 0.08 . 1 . . . . . 74 LEU MD2 . 53420 1 447 . 1 . 1 100 100 LEU HD23 H 1 0.23 0.08 . 1 . . . . . 74 LEU MD2 . 53420 1 448 . 1 . 1 100 100 LEU C C 13 174.38 0.08 . 1 . . . . . 74 LEU C . 53420 1 449 . 1 . 1 100 100 LEU CA C 13 53.14 0.08 . 1 . . . . . 74 LEU CA . 53420 1 450 . 1 . 1 100 100 LEU CB C 13 41.34 0.08 . 1 . . . . . 74 LEU CB . 53420 1 451 . 1 . 1 100 100 LEU CD1 C 13 23.8 0.08 . 1 . . . . . 74 LEU CD1 . 53420 1 452 . 1 . 1 100 100 LEU CD2 C 13 26.68 0.08 . 1 . . . . . 74 LEU CD2 . 53420 1 453 . 1 . 1 100 100 LEU N N 15 127.92 0.08 . 1 . . . . . 74 LEU N . 53420 1 454 . 1 . 1 101 101 THR H H 1 8.97 0.08 . 1 . . . . . 75 THR H . 53420 1 455 . 1 . 1 101 101 THR HG21 H 1 0.9 0.08 . 1 . . . . . 75 THR MG . 53420 1 456 . 1 . 1 101 101 THR HG22 H 1 0.9 0.08 . 1 . . . . . 75 THR MG . 53420 1 457 . 1 . 1 101 101 THR HG23 H 1 0.9 0.08 . 1 . . . . . 75 THR MG . 53420 1 458 . 1 . 1 101 101 THR C C 13 173.47 0.08 . 1 . . . . . 75 THR C . 53420 1 459 . 1 . 1 101 101 THR CA C 13 60.96 0.08 . 1 . . . . . 75 THR CA . 53420 1 460 . 1 . 1 101 101 THR CB C 13 70.42 0.08 . 1 . . . . . 75 THR CB . 53420 1 461 . 1 . 1 101 101 THR CG2 C 13 20.71 0.08 . 1 . . . . . 75 THR CG2 . 53420 1 462 . 1 . 1 101 101 THR N N 15 122.8 0.08 . 1 . . . . . 75 THR N . 53420 1 463 . 1 . 1 102 102 ILE H H 1 8.8 0.08 . 1 . . . . . 76 ILE H . 53420 1 464 . 1 . 1 102 102 ILE HG21 H 1 0.04 0.08 . 1 . . . . . 76 ILE MG . 53420 1 465 . 1 . 1 102 102 ILE HG22 H 1 0.04 0.08 . 1 . . . . . 76 ILE MG . 53420 1 466 . 1 . 1 102 102 ILE HG23 H 1 0.04 0.08 . 1 . . . . . 76 ILE MG . 53420 1 467 . 1 . 1 102 102 ILE HD11 H 1 0.23 0.08 . 1 . . . . . 76 ILE MD . 53420 1 468 . 1 . 1 102 102 ILE HD12 H 1 0.23 0.08 . 1 . . . . . 76 ILE MD . 53420 1 469 . 1 . 1 102 102 ILE HD13 H 1 0.23 0.08 . 1 . . . . . 76 ILE MD . 53420 1 470 . 1 . 1 102 102 ILE C C 13 176.59 0.08 . 1 . . . . . 76 ILE C . 53420 1 471 . 1 . 1 102 102 ILE CA C 13 59.94 0.08 . 1 . . . . . 76 ILE CA . 53420 1 472 . 1 . 1 102 102 ILE CB C 13 38.01 0.08 . 1 . . . . . 76 ILE CB . 53420 1 473 . 1 . 1 102 102 ILE CG2 C 13 17.27 0.08 . 1 . . . . . 76 ILE CG2 . 53420 1 474 . 1 . 1 102 102 ILE CD1 C 13 12.96 0.08 . 1 . . . . . 76 ILE CD1 . 53420 1 475 . 1 . 1 102 102 ILE N N 15 126.6 0.08 . 1 . . . . . 76 ILE N . 53420 1 476 . 1 . 1 103 103 SER H H 1 8.83 0.08 . 1 . . . . . 77 SER H . 53420 1 477 . 1 . 1 103 103 SER CA C 13 61.23 0.08 . 1 . . . . . 77 SER CA . 53420 1 478 . 1 . 1 103 103 SER CB C 13 62.67 0.08 . 1 . . . . . 77 SER CB . 53420 1 479 . 1 . 1 103 103 SER N N 15 121.34 0.08 . 1 . . . . . 77 SER N . 53420 1 480 . 1 . 1 105 105 LEU HD11 H 1 0.5 0.08 . 1 . . . . . 79 LEU MD1 . 53420 1 481 . 1 . 1 105 105 LEU HD12 H 1 0.5 0.08 . 1 . . . . . 79 LEU MD1 . 53420 1 482 . 1 . 1 105 105 LEU HD13 H 1 0.5 0.08 . 1 . . . . . 79 LEU MD1 . 53420 1 483 . 1 . 1 105 105 LEU HD21 H 1 0.32 0.08 . 1 . . . . . 79 LEU MD2 . 53420 1 484 . 1 . 1 105 105 LEU HD22 H 1 0.32 0.08 . 1 . . . . . 79 LEU MD2 . 53420 1 485 . 1 . 1 105 105 LEU HD23 H 1 0.32 0.08 . 1 . . . . . 79 LEU MD2 . 53420 1 486 . 1 . 1 105 105 LEU CD1 C 13 27.8 0.08 . 1 . . . . . 79 LEU CD1 . 53420 1 487 . 1 . 1 105 105 LEU CD2 C 13 25.54 0.08 . 1 . . . . . 79 LEU CD2 . 53420 1 488 . 1 . 1 109 109 ASP C C 13 177.42 0.08 . 1 . . . . . 83 ASP C . 53420 1 489 . 1 . 1 109 109 ASP CA C 13 54.71 0.08 . 1 . . . . . 83 ASP CA . 53420 1 490 . 1 . 1 110 110 PHE H H 1 7.11 0.08 . 1 . . . . . 84 PHE H . 53420 1 491 . 1 . 1 110 110 PHE C C 13 174.35 0.08 . 1 . . . . . 84 PHE C . 53420 1 492 . 1 . 1 110 110 PHE CA C 13 60.72 0.08 . 1 . . . . . 84 PHE CA . 53420 1 493 . 1 . 1 110 110 PHE N N 15 121.49 0.08 . 1 . . . . . 84 PHE N . 53420 1 494 . 1 . 1 111 111 ALA H H 1 8.22 0.08 . 1 . . . . . 85 ALA H . 53420 1 495 . 1 . 1 111 111 ALA HB1 H 1 1.01 0.08 . 1 . . . . . 85 ALA MB . 53420 1 496 . 1 . 1 111 111 ALA HB2 H 1 1.01 0.08 . 1 . . . . . 85 ALA MB . 53420 1 497 . 1 . 1 111 111 ALA HB3 H 1 1.01 0.08 . 1 . . . . . 85 ALA MB . 53420 1 498 . 1 . 1 111 111 ALA C C 13 174.21 0.08 . 1 . . . . . 85 ALA C . 53420 1 499 . 1 . 1 111 111 ALA CA C 13 51.53 0.08 . 1 . . . . . 85 ALA CA . 53420 1 500 . 1 . 1 111 111 ALA CB C 13 20.75 0.08 . 1 . . . . . 85 ALA CB . 53420 1 501 . 1 . 1 111 111 ALA N N 15 128.23 0.08 . 1 . . . . . 85 ALA N . 53420 1 502 . 1 . 1 112 112 VAL H H 1 7.6 0.08 . 1 . . . . . 86 VAL H . 53420 1 503 . 1 . 1 112 112 VAL HG11 H 1 0.31 0.08 . 1 . . . . . 86 VAL MG1 . 53420 1 504 . 1 . 1 112 112 VAL HG12 H 1 0.31 0.08 . 1 . . . . . 86 VAL MG1 . 53420 1 505 . 1 . 1 112 112 VAL HG13 H 1 0.31 0.08 . 1 . . . . . 86 VAL MG1 . 53420 1 506 . 1 . 1 112 112 VAL HG21 H 1 0.89 0.08 . 1 . . . . . 86 VAL MG2 . 53420 1 507 . 1 . 1 112 112 VAL HG22 H 1 0.89 0.08 . 1 . . . . . 86 VAL MG2 . 53420 1 508 . 1 . 1 112 112 VAL HG23 H 1 0.89 0.08 . 1 . . . . . 86 VAL MG2 . 53420 1 509 . 1 . 1 112 112 VAL C C 13 174.24 0.08 . 1 . . . . . 86 VAL C . 53420 1 510 . 1 . 1 112 112 VAL CA C 13 61.84 0.08 . 1 . . . . . 86 VAL CA . 53420 1 511 . 1 . 1 112 112 VAL CB C 13 32.83 0.08 . 1 . . . . . 86 VAL CB . 53420 1 512 . 1 . 1 112 112 VAL CG1 C 13 20.9 0.08 . 1 . . . . . 86 VAL CG1 . 53420 1 513 . 1 . 1 112 112 VAL CG2 C 13 22.5 0.08 . 1 . . . . . 86 VAL CG2 . 53420 1 514 . 1 . 1 112 112 VAL N N 15 118.35 0.08 . 1 . . . . . 86 VAL N . 53420 1 515 . 1 . 1 113 113 TYR H H 1 8.64 0.08 . 1 . . . . . 87 TYR H . 53420 1 516 . 1 . 1 113 113 TYR C C 13 176.56 0.08 . 1 . . . . . 87 TYR C . 53420 1 517 . 1 . 1 113 113 TYR CA C 13 56.42 0.08 . 1 . . . . . 87 TYR CA . 53420 1 518 . 1 . 1 113 113 TYR N N 15 123.49 0.08 . 1 . . . . . 87 TYR N . 53420 1 519 . 1 . 1 114 114 TYR H H 1 9.4 0.08 . 1 . . . . . 88 TYR H . 53420 1 520 . 1 . 1 114 114 TYR CA C 13 57.36 0.08 . 1 . . . . . 88 TYR CA . 53420 1 521 . 1 . 1 114 114 TYR N N 15 120.88 0.08 . 1 . . . . . 88 TYR N . 53420 1 522 . 1 . 1 118 118 TYR C C 13 173.88 0.08 . 1 . . . . . 92 TYR C . 53420 1 523 . 1 . 1 118 118 TYR CA C 13 54.38 0.08 . 1 . . . . . 92 TYR CA . 53420 1 524 . 1 . 1 119 119 GLY H H 1 7.99 0.08 . 1 . . . . . 93 GLY H . 53420 1 525 . 1 . 1 119 119 GLY C C 13 174.04 0.08 . 1 . . . . . 93 GLY C . 53420 1 526 . 1 . 1 119 119 GLY CA C 13 46.14 0.08 . 1 . . . . . 93 GLY CA . 53420 1 527 . 1 . 1 119 119 GLY N N 15 107.59 0.08 . 1 . . . . . 93 GLY N . 53420 1 528 . 1 . 1 120 120 SER H H 1 8.51 0.08 . 1 . . . . . 94 SER H . 53420 1 529 . 1 . 1 120 120 SER C C 13 172.85 0.08 . 1 . . . . . 94 SER C . 53420 1 530 . 1 . 1 120 120 SER CA C 13 56.88 0.08 . 1 . . . . . 94 SER CA . 53420 1 531 . 1 . 1 120 120 SER N N 15 117.04 0.08 . 1 . . . . . 94 SER N . 53420 1 532 . 1 . 1 121 121 SER H H 1 8.4 0.08 . 1 . . . . . 95 SER H . 53420 1 533 . 1 . 1 121 121 SER CA C 13 55.89 0.08 . 1 . . . . . 95 SER CA . 53420 1 534 . 1 . 1 121 121 SER CB C 13 63.73 0.08 . 1 . . . . . 95 SER CB . 53420 1 535 . 1 . 1 121 121 SER N N 15 119 0.08 . 1 . . . . . 95 SER N . 53420 1 536 . 1 . 1 124 124 THR H H 1 7.9 0.08 . 1 . . . . . 98 THR H . 53420 1 537 . 1 . 1 124 124 THR HG21 H 1 1.43 0.08 . 1 . . . . . 98 THR MG . 53420 1 538 . 1 . 1 124 124 THR HG22 H 1 1.43 0.08 . 1 . . . . . 98 THR MG . 53420 1 539 . 1 . 1 124 124 THR HG23 H 1 1.43 0.08 . 1 . . . . . 98 THR MG . 53420 1 540 . 1 . 1 124 124 THR C C 13 172.55 0.08 . 1 . . . . . 98 THR C . 53420 1 541 . 1 . 1 124 124 THR CA C 13 59.55 0.08 . 1 . . . . . 98 THR CA . 53420 1 542 . 1 . 1 124 124 THR CB C 13 73.71 0.08 . 1 . . . . . 98 THR CB . 53420 1 543 . 1 . 1 124 124 THR CG2 C 13 23.96 0.08 . 1 . . . . . 98 THR CG2 . 53420 1 544 . 1 . 1 124 124 THR N N 15 111.64 0.08 . 1 . . . . . 98 THR N . 53420 1 545 . 1 . 1 125 125 PHE H H 1 8.74 0.08 . 1 . . . . . 99 PHE H . 53420 1 546 . 1 . 1 125 125 PHE C C 13 179.45 0.08 . 1 . . . . . 99 PHE C . 53420 1 547 . 1 . 1 125 125 PHE CA C 13 56.98 0.08 . 1 . . . . . 99 PHE CA . 53420 1 548 . 1 . 1 125 125 PHE N N 15 118.83 0.08 . 1 . . . . . 99 PHE N . 53420 1 549 . 1 . 1 126 126 GLY H H 1 8.93 0.08 . 1 . . . . . 100 GLY H . 53420 1 550 . 1 . 1 126 126 GLY CA C 13 45.17 0.08 . 1 . . . . . 100 GLY CA . 53420 1 551 . 1 . 1 126 126 GLY N N 15 108.19 0.08 . 1 . . . . . 100 GLY N . 53420 1 552 . 1 . 1 129 129 THR HG21 H 1 1.06 0.08 . 1 . . . . . 103 THR MG . 53420 1 553 . 1 . 1 129 129 THR HG22 H 1 1.06 0.08 . 1 . . . . . 103 THR MG . 53420 1 554 . 1 . 1 129 129 THR HG23 H 1 1.06 0.08 . 1 . . . . . 103 THR MG . 53420 1 555 . 1 . 1 129 129 THR C C 13 174.06 0.08 . 1 . . . . . 103 THR C . 53420 1 556 . 1 . 1 129 129 THR CA C 13 62.2 0.08 . 1 . . . . . 103 THR CA . 53420 1 557 . 1 . 1 129 129 THR CB C 13 73.07 0.08 . 1 . . . . . 103 THR CB . 53420 1 558 . 1 . 1 129 129 THR CG2 C 13 21.96 0.08 . 1 . . . . . 103 THR CG2 . 53420 1 559 . 1 . 1 130 130 LYS H H 1 8.52 0.08 . 1 . . . . . 104 LYS H . 53420 1 560 . 1 . 1 130 130 LYS C C 13 173.9 0.08 . 1 . . . . . 104 LYS C . 53420 1 561 . 1 . 1 130 130 LYS CA C 13 56.31 0.08 . 1 . . . . . 104 LYS CA . 53420 1 562 . 1 . 1 130 130 LYS CB C 13 33.56 0.08 . 1 . . . . . 104 LYS CB . 53420 1 563 . 1 . 1 130 130 LYS N N 15 128.73 0.08 . 1 . . . . . 104 LYS N . 53420 1 564 . 1 . 1 131 131 VAL H H 1 8.84 0.08 . 1 . . . . . 105 VAL H . 53420 1 565 . 1 . 1 131 131 VAL HG11 H 1 0.79 0.08 . 1 . . . . . 105 VAL MG1 . 53420 1 566 . 1 . 1 131 131 VAL HG12 H 1 0.79 0.08 . 1 . . . . . 105 VAL MG1 . 53420 1 567 . 1 . 1 131 131 VAL HG13 H 1 0.79 0.08 . 1 . . . . . 105 VAL MG1 . 53420 1 568 . 1 . 1 131 131 VAL HG21 H 1 0.94 0.08 . 1 . . . . . 105 VAL MG2 . 53420 1 569 . 1 . 1 131 131 VAL HG22 H 1 0.94 0.08 . 1 . . . . . 105 VAL MG2 . 53420 1 570 . 1 . 1 131 131 VAL HG23 H 1 0.94 0.08 . 1 . . . . . 105 VAL MG2 . 53420 1 571 . 1 . 1 131 131 VAL C C 13 174.83 0.08 . 1 . . . . . 105 VAL C . 53420 1 572 . 1 . 1 131 131 VAL CA C 13 62.3 0.08 . 1 . . . . . 105 VAL CA . 53420 1 573 . 1 . 1 131 131 VAL CB C 13 32.33 0.08 . 1 . . . . . 105 VAL CB . 53420 1 574 . 1 . 1 131 131 VAL CG1 C 13 21.38 0.08 . 1 . . . . . 105 VAL CG1 . 53420 1 575 . 1 . 1 131 131 VAL CG2 C 13 22.91 0.08 . 1 . . . . . 105 VAL CG2 . 53420 1 576 . 1 . 1 131 131 VAL N N 15 128.7 0.08 . 1 . . . . . 105 VAL N . 53420 1 577 . 1 . 1 132 132 GLU H H 1 9.3 0.08 . 1 . . . . . 106 GLU H . 53420 1 578 . 1 . 1 132 132 GLU C C 13 174.03 0.08 . 1 . . . . . 106 GLU C . 53420 1 579 . 1 . 1 132 132 GLU CA C 13 54.14 0.08 . 1 . . . . . 106 GLU CA . 53420 1 580 . 1 . 1 132 132 GLU CB C 13 33.71 0.08 . 1 . . . . . 106 GLU CB . 53420 1 581 . 1 . 1 132 132 GLU N N 15 127.5 0.08 . 1 . . . . . 106 GLU N . 53420 1 582 . 1 . 1 133 133 ILE H H 1 7.81 0.08 . 1 . . . . . 107 ILE H . 53420 1 583 . 1 . 1 133 133 ILE HG21 H 1 0.63 0.08 . 1 . . . . . 107 ILE MG . 53420 1 584 . 1 . 1 133 133 ILE HG22 H 1 0.63 0.08 . 1 . . . . . 107 ILE MG . 53420 1 585 . 1 . 1 133 133 ILE HG23 H 1 0.63 0.08 . 1 . . . . . 107 ILE MG . 53420 1 586 . 1 . 1 133 133 ILE HD11 H 1 0.59 0.08 . 1 . . . . . 107 ILE MD . 53420 1 587 . 1 . 1 133 133 ILE HD12 H 1 0.59 0.08 . 1 . . . . . 107 ILE MD . 53420 1 588 . 1 . 1 133 133 ILE HD13 H 1 0.59 0.08 . 1 . . . . . 107 ILE MD . 53420 1 589 . 1 . 1 133 133 ILE C C 13 176.41 0.08 . 1 . . . . . 107 ILE C . 53420 1 590 . 1 . 1 133 133 ILE CA C 13 60.38 0.08 . 1 . . . . . 107 ILE CA . 53420 1 591 . 1 . 1 133 133 ILE CB C 13 38.29 0.08 . 1 . . . . . 107 ILE CB . 53420 1 592 . 1 . 1 133 133 ILE CG2 C 13 16.63 0.08 . 1 . . . . . 107 ILE CG2 . 53420 1 593 . 1 . 1 133 133 ILE CD1 C 13 13.29 0.08 . 1 . . . . . 107 ILE CD1 . 53420 1 594 . 1 . 1 133 133 ILE N N 15 121.93 0.08 . 1 . . . . . 107 ILE N . 53420 1 595 . 1 . 1 134 134 LYS H H 1 7.89 0.08 . 1 . . . . . 108 LYS H . 53420 1 596 . 1 . 1 134 134 LYS C C 13 175.76 0.08 . 1 . . . . . 108 LYS C . 53420 1 597 . 1 . 1 134 134 LYS CA C 13 56.47 0.08 . 1 . . . . . 108 LYS CA . 53420 1 598 . 1 . 1 134 134 LYS CB C 13 33.34 0.08 . 1 . . . . . 108 LYS CB . 53420 1 599 . 1 . 1 134 134 LYS N N 15 129.29 0.08 . 1 . . . . . 108 LYS N . 53420 1 600 . 1 . 1 135 135 ARG H H 1 8.51 0.08 . 1 . . . . . 109 ARG H . 53420 1 601 . 1 . 1 135 135 ARG C C 13 175.59 0.08 . 1 . . . . . 109 ARG C . 53420 1 602 . 1 . 1 135 135 ARG CA C 13 56.18 0.08 . 1 . . . . . 109 ARG CA . 53420 1 603 . 1 . 1 135 135 ARG CB C 13 31.01 0.08 . 1 . . . . . 109 ARG CB . 53420 1 604 . 1 . 1 135 135 ARG N N 15 126.45 0.08 . 1 . . . . . 109 ARG N . 53420 1 605 . 1 . 1 136 136 THR H H 1 7.69 0.08 . 1 . . . . . 110 THR H . 53420 1 606 . 1 . 1 136 136 THR HG21 H 1 1.14 0.08 . 1 . . . . . 110 THR MG . 53420 1 607 . 1 . 1 136 136 THR HG22 H 1 1.14 0.08 . 1 . . . . . 110 THR MG . 53420 1 608 . 1 . 1 136 136 THR HG23 H 1 1.14 0.08 . 1 . . . . . 110 THR MG . 53420 1 609 . 1 . 1 136 136 THR C C 13 179.03 0.08 . 1 . . . . . 110 THR C . 53420 1 610 . 1 . 1 136 136 THR CA C 13 63.02 0.08 . 1 . . . . . 110 THR CA . 53420 1 611 . 1 . 1 136 136 THR CB C 13 70.71 0.08 . 1 . . . . . 110 THR CB . 53420 1 612 . 1 . 1 136 136 THR CG2 C 13 22.07 0.08 . 1 . . . . . 110 THR CG2 . 53420 1 613 . 1 . 1 136 136 THR N N 15 120.34 0.08 . 1 . . . . . 110 THR N . 53420 1 stop_ save_