################################### # 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 16594 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCO' . . . 16594 1 2 '3D CBCA(CO)NH' . . . 16594 1 3 '3D HBHA(CO)NH' . . . 16594 1 4 '3D HNCA' . . . 16594 1 5 '3D C(CO)NH' . . . 16594 1 6 '3D H(CCO)NH' . . . 16594 1 7 '3D HCCH-TOCSY' . . . 16594 1 8 '3D CCH-TOCSY' . . . 16594 1 9 '3D 1H-15N NOESY' . . . 16594 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 4 $FAWN . . 16594 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 LEU H H 1 8.247 0.04 . 1 . . . . . 1 LEU H . 16594 1 2 . 1 1 1 1 LEU HA H 1 4.315 0.04 . 1 . . . . . 1 LEU HA . 16594 1 3 . 1 1 1 1 LEU HB2 H 1 1.556 0.04 . 2 . . . . . 1 LEU HB2 . 16594 1 4 . 1 1 1 1 LEU HB3 H 1 1.556 0.04 . 2 . . . . . 1 LEU HB3 . 16594 1 5 . 1 1 1 1 LEU HD11 H 1 0.881 0.04 . 1 . . . . . 1 LEU HD1 . 16594 1 6 . 1 1 1 1 LEU HD12 H 1 0.881 0.04 . 1 . . . . . 1 LEU HD1 . 16594 1 7 . 1 1 1 1 LEU HD13 H 1 0.881 0.04 . 1 . . . . . 1 LEU HD1 . 16594 1 8 . 1 1 1 1 LEU HD21 H 1 0.840 0.04 . 1 . . . . . 1 LEU HD2 . 16594 1 9 . 1 1 1 1 LEU HD22 H 1 0.840 0.04 . 1 . . . . . 1 LEU HD2 . 16594 1 10 . 1 1 1 1 LEU HD23 H 1 0.840 0.04 . 1 . . . . . 1 LEU HD2 . 16594 1 11 . 1 1 1 1 LEU HG H 1 1.578 0.04 . 1 . . . . . 1 LEU HG . 16594 1 12 . 1 1 1 1 LEU C C 13 177.369 0.4 . 1 . . . . . 1 LEU C . 16594 1 13 . 1 1 1 1 LEU CA C 13 55.290 0.40 . 1 . . . . . 1 LEU CA . 16594 1 14 . 1 1 1 1 LEU CB C 13 42.810 0.40 . 1 . . . . . 1 LEU CB . 16594 1 15 . 1 1 1 1 LEU CD1 C 13 24.870 0.40 . 1 . . . . . 1 LEU CD1 . 16594 1 16 . 1 1 1 1 LEU CD2 C 13 23.520 0.40 . 1 . . . . . 1 LEU CD2 . 16594 1 17 . 1 1 1 1 LEU CG C 13 26.880 0.40 . 1 . . . . . 1 LEU CG . 16594 1 18 . 1 1 1 1 LEU N N 15 126.186 0.40 . 1 . . . . . 1 LEU N . 16594 1 19 . 1 1 2 2 ALA H H 1 8.460 0.04 . 1 . . . . . 2 ALA H . 16594 1 20 . 1 1 2 2 ALA HA H 1 4.304 0.04 . 1 . . . . . 2 ALA HA . 16594 1 21 . 1 1 2 2 ALA HB1 H 1 1.363 0.04 . 1 . . . . . 2 ALA HB . 16594 1 22 . 1 1 2 2 ALA HB2 H 1 1.363 0.04 . 1 . . . . . 2 ALA HB . 16594 1 23 . 1 1 2 2 ALA HB3 H 1 1.363 0.04 . 1 . . . . . 2 ALA HB . 16594 1 24 . 1 1 2 2 ALA C C 13 178.183 0.4 . 1 . . . . . 2 ALA C . 16594 1 25 . 1 1 2 2 ALA CA C 13 52.760 0.40 . 1 . . . . . 2 ALA CA . 16594 1 26 . 1 1 2 2 ALA CB C 13 19.150 0.40 . 1 . . . . . 2 ALA CB . 16594 1 27 . 1 1 2 2 ALA N N 15 125.375 0.40 . 1 . . . . . 2 ALA N . 16594 1 28 . 1 1 3 3 GLY H H 1 8.343 0.04 . 1 . . . . . 3 GLY H . 16594 1 29 . 1 1 3 3 GLY N N 15 108.577 0.40 . 1 . . . . . 3 GLY N . 16594 1 30 . 1 1 5 5 LYS HA H 1 4.355 0.04 . 1 . . . . . 5 LYS HA . 16594 1 31 . 1 1 5 5 LYS HB2 H 1 1.829 0.04 . 2 . . . . . 5 LYS HB2 . 16594 1 32 . 1 1 5 5 LYS HB3 H 1 1.729 0.04 . 2 . . . . . 5 LYS HB3 . 16594 1 33 . 1 1 5 5 LYS HD2 H 1 1.646 0.04 . 2 . . . . . 5 LYS HD2 . 16594 1 34 . 1 1 5 5 LYS HD3 H 1 1.646 0.04 . 2 . . . . . 5 LYS HD3 . 16594 1 35 . 1 1 5 5 LYS HE2 H 1 2.956 0.04 . 2 . . . . . 5 LYS HE2 . 16594 1 36 . 1 1 5 5 LYS HE3 H 1 2.956 0.04 . 2 . . . . . 5 LYS HE3 . 16594 1 37 . 1 1 5 5 LYS HG2 H 1 1.400 0.04 . 2 . . . . . 5 LYS HG2 . 16594 1 38 . 1 1 5 5 LYS HG3 H 1 1.400 0.04 . 2 . . . . . 5 LYS HG3 . 16594 1 39 . 1 1 5 5 LYS CA C 13 56.170 0.40 . 1 . . . . . 5 LYS CA . 16594 1 40 . 1 1 5 5 LYS CB C 13 33.170 0.40 . 1 . . . . . 5 LYS CB . 16594 1 41 . 1 1 5 5 LYS CD C 13 29.070 0.40 . 1 . . . . . 5 LYS CD . 16594 1 42 . 1 1 5 5 LYS CE C 13 41.900 0.40 . 1 . . . . . 5 LYS CE . 16594 1 43 . 1 1 5 5 LYS CG C 13 24.940 0.40 . 1 . . . . . 5 LYS CG . 16594 1 44 . 1 1 6 6 SER HA H 1 4.429 0.04 . 1 . . . . . 6 SER HA . 16594 1 45 . 1 1 6 6 SER HB2 H 1 3.851 0.04 . 2 . . . . . 6 SER HB2 . 16594 1 46 . 1 1 6 6 SER HB3 H 1 3.851 0.04 . 2 . . . . . 6 SER HB3 . 16594 1 47 . 1 1 6 6 SER CA C 13 58.390 0.40 . 1 . . . . . 6 SER CA . 16594 1 48 . 1 1 6 6 SER CB C 13 64.040 0.40 . 1 . . . . . 6 SER CB . 16594 1 49 . 1 1 7 7 MET HA H 1 4.435 0.04 . 1 . . . . . 7 MET HA . 16594 1 50 . 1 1 7 7 MET HB2 H 1 2.004 0.04 . 2 . . . . . 7 MET HB2 . 16594 1 51 . 1 1 7 7 MET HB3 H 1 1.946 0.04 . 2 . . . . . 7 MET HB3 . 16594 1 52 . 1 1 7 7 MET HE1 H 1 1.890 0.04 . 1 . . . . . 7 MET HE . 16594 1 53 . 1 1 7 7 MET HE2 H 1 1.890 0.04 . 1 . . . . . 7 MET HE . 16594 1 54 . 1 1 7 7 MET HE3 H 1 1.890 0.04 . 1 . . . . . 7 MET HE . 16594 1 55 . 1 1 7 7 MET HG2 H 1 2.495 0.04 . 2 . . . . . 7 MET HG2 . 16594 1 56 . 1 1 7 7 MET HG3 H 1 2.433 0.04 . 2 . . . . . 7 MET HG3 . 16594 1 57 . 1 1 7 7 MET CA C 13 55.610 0.40 . 1 . . . . . 7 MET CA . 16594 1 58 . 1 1 7 7 MET CB C 13 33.550 0.40 . 1 . . . . . 7 MET CB . 16594 1 59 . 1 1 7 7 MET CE C 13 16.990 0.40 . 1 . . . . . 7 MET CE . 16594 1 60 . 1 1 7 7 MET CG C 13 31.510 0.40 . 1 . . . . . 7 MET CG . 16594 1 61 . 1 1 8 8 ASN HA H 1 4.837 0.04 . 1 . . . . . 8 ASN HA . 16594 1 62 . 1 1 8 8 ASN HB2 H 1 2.992 0.04 . 2 . . . . . 8 ASN HB2 . 16594 1 63 . 1 1 8 8 ASN HB3 H 1 2.847 0.04 . 2 . . . . . 8 ASN HB3 . 16594 1 64 . 1 1 8 8 ASN HD21 H 1 7.583 0.04 . 1 . . . . . 8 ASN HD21 . 16594 1 65 . 1 1 8 8 ASN HD22 H 1 6.924 0.04 . 2 . . . . . 8 ASN HD22 . 16594 1 66 . 1 1 8 8 ASN C C 13 175.910 0.4 . 1 . . . . . 8 ASN C . 16594 1 67 . 1 1 8 8 ASN CA C 13 52.310 0.40 . 1 . . . . . 8 ASN CA . 16594 1 68 . 1 1 8 8 ASN CB C 13 38.190 0.40 . 1 . . . . . 8 ASN CB . 16594 1 69 . 1 1 8 8 ASN ND2 N 15 112.400 0.04 . 1 . . . . . 8 ASN ND2 . 16594 1 70 . 1 1 9 9 VAL H H 1 8.400 0.04 . 1 . . . . . 9 VAL H . 16594 1 71 . 1 1 9 9 VAL HA H 1 3.908 0.04 . 1 . . . . . 9 VAL HA . 16594 1 72 . 1 1 9 9 VAL HB H 1 2.107 0.04 . 1 . . . . . 9 VAL HB . 16594 1 73 . 1 1 9 9 VAL HG11 H 1 0.931 0.04 . 1 . . . . . 9 VAL HG1 . 16594 1 74 . 1 1 9 9 VAL HG12 H 1 0.931 0.04 . 1 . . . . . 9 VAL HG1 . 16594 1 75 . 1 1 9 9 VAL HG13 H 1 0.931 0.04 . 1 . . . . . 9 VAL HG1 . 16594 1 76 . 1 1 9 9 VAL HG21 H 1 1.003 0.04 . 1 . . . . . 9 VAL HG2 . 16594 1 77 . 1 1 9 9 VAL HG22 H 1 1.003 0.04 . 1 . . . . . 9 VAL HG2 . 16594 1 78 . 1 1 9 9 VAL HG23 H 1 1.003 0.04 . 1 . . . . . 9 VAL HG2 . 16594 1 79 . 1 1 9 9 VAL C C 13 176.738 0.4 . 1 . . . . . 9 VAL C . 16594 1 80 . 1 1 9 9 VAL CA C 13 65.550 0.40 . 1 . . . . . 9 VAL CA . 16594 1 81 . 1 1 9 9 VAL CB C 13 31.970 0.40 . 1 . . . . . 9 VAL CB . 16594 1 82 . 1 1 9 9 VAL CG1 C 13 21.780 0.40 . 1 . . . . . 9 VAL CG1 . 16594 1 83 . 1 1 9 9 VAL CG2 C 13 21.780 0.40 . 1 . . . . . 9 VAL CG2 . 16594 1 84 . 1 1 9 9 VAL N N 15 121.216 0.40 . 1 . . . . . 9 VAL N . 16594 1 85 . 1 1 10 10 GLU H H 1 8.596 0.04 . 1 . . . . . 10 GLU H . 16594 1 86 . 1 1 10 10 GLU HA H 1 4.077 0.04 . 1 . . . . . 10 GLU HA . 16594 1 87 . 1 1 10 10 GLU HB2 H 1 2.036 0.04 . 2 . . . . . 10 GLU HB2 . 16594 1 88 . 1 1 10 10 GLU HB3 H 1 1.951 0.04 . 2 . . . . . 10 GLU HB3 . 16594 1 89 . 1 1 10 10 GLU HG2 H 1 2.267 0.04 . 2 . . . . . 10 GLU HG2 . 16594 1 90 . 1 1 10 10 GLU HG3 H 1 2.267 0.04 . 2 . . . . . 10 GLU HG3 . 16594 1 91 . 1 1 10 10 GLU C C 13 178.985 0.4 . 1 . . . . . 10 GLU C . 16594 1 92 . 1 1 10 10 GLU CA C 13 59.390 0.40 . 1 . . . . . 10 GLU CA . 16594 1 93 . 1 1 10 10 GLU CB C 13 29.000 0.40 . 1 . . . . . 10 GLU CB . 16594 1 94 . 1 1 10 10 GLU CG C 13 36.750 0.40 . 1 . . . . . 10 GLU CG . 16594 1 95 . 1 1 10 10 GLU N N 15 121.274 0.40 . 1 . . . . . 10 GLU N . 16594 1 96 . 1 1 11 11 SER H H 1 7.841 0.04 . 1 . . . . . 11 SER H . 16594 1 97 . 1 1 11 11 SER HA H 1 4.138 0.04 . 1 . . . . . 11 SER HA . 16594 1 98 . 1 1 11 11 SER HB2 H 1 3.695 0.04 . 2 . . . . . 11 SER HB2 . 16594 1 99 . 1 1 11 11 SER HB3 H 1 3.695 0.04 . 2 . . . . . 11 SER HB3 . 16594 1 100 . 1 1 11 11 SER C C 13 176.817 0.4 . 1 . . . . . 11 SER C . 16594 1 101 . 1 1 11 11 SER CA C 13 60.790 0.40 . 1 . . . . . 11 SER CA . 16594 1 102 . 1 1 11 11 SER CB C 13 62.470 0.40 . 1 . . . . . 11 SER CB . 16594 1 103 . 1 1 11 11 SER N N 15 115.238 0.40 . 1 . . . . . 11 SER N . 16594 1 104 . 1 1 12 12 TYR H H 1 7.284 0.04 . 1 . . . . . 12 TYR H . 16594 1 105 . 1 1 12 12 TYR HA H 1 4.104 0.04 . 1 . . . . . 12 TYR HA . 16594 1 106 . 1 1 12 12 TYR HB2 H 1 2.609 0.04 . 2 . . . . . 12 TYR HB2 . 16594 1 107 . 1 1 12 12 TYR HB3 H 1 2.455 0.04 . 2 . . . . . 12 TYR HB3 . 16594 1 108 . 1 1 12 12 TYR HD1 H 1 6.996 0.04 . 1 . . . . . 12 TYR HD1 . 16594 1 109 . 1 1 12 12 TYR HD2 H 1 6.996 0.04 . 1 . . . . . 12 TYR HD2 . 16594 1 110 . 1 1 12 12 TYR HE1 H 1 6.714 0.04 . 1 . . . . . 12 TYR HE1 . 16594 1 111 . 1 1 12 12 TYR HE2 H 1 6.714 0.04 . 1 . . . . . 12 TYR HE2 . 16594 1 112 . 1 1 12 12 TYR C C 13 177.132 0.4 . 1 . . . . . 12 TYR C . 16594 1 113 . 1 1 12 12 TYR CA C 13 62.060 0.40 . 1 . . . . . 12 TYR CA . 16594 1 114 . 1 1 12 12 TYR CB C 13 38.710 0.40 . 1 . . . . . 12 TYR CB . 16594 1 115 . 1 1 12 12 TYR CD1 C 13 132.500 0.40 . 1 . . . . . 12 TYR CD1 . 16594 1 116 . 1 1 12 12 TYR CE1 C 13 118.803 0.40 . 1 . . . . . 12 TYR CE1 . 16594 1 117 . 1 1 12 12 TYR N N 15 120.370 0.40 . 1 . . . . . 12 TYR N . 16594 1 118 . 1 1 13 13 GLU H H 1 8.490 0.04 . 1 . . . . . 13 GLU H . 16594 1 119 . 1 1 13 13 GLU HA H 1 3.432 0.04 . 1 . . . . . 13 GLU HA . 16594 1 120 . 1 1 13 13 GLU HB2 H 1 2.089 0.04 . 2 . . . . . 13 GLU HB2 . 16594 1 121 . 1 1 13 13 GLU HB3 H 1 1.890 0.04 . 2 . . . . . 13 GLU HB3 . 16594 1 122 . 1 1 13 13 GLU HG2 H 1 2.089 0.04 . 2 . . . . . 13 GLU HG2 . 16594 1 123 . 1 1 13 13 GLU HG3 H 1 2.041 0.04 . 2 . . . . . 13 GLU HG3 . 16594 1 124 . 1 1 13 13 GLU C C 13 177.303 0.4 . 1 . . . . . 13 GLU C . 16594 1 125 . 1 1 13 13 GLU CA C 13 60.660 0.40 . 1 . . . . . 13 GLU CA . 16594 1 126 . 1 1 13 13 GLU CB C 13 29.200 0.40 . 1 . . . . . 13 GLU CB . 16594 1 127 . 1 1 13 13 GLU CG C 13 36.000 0.40 . 1 . . . . . 13 GLU CG . 16594 1 128 . 1 1 13 13 GLU N N 15 120.162 0.40 . 1 . . . . . 13 GLU N . 16594 1 129 . 1 1 14 14 LYS H H 1 7.454 0.04 . 1 . . . . . 14 LYS H . 16594 1 130 . 1 1 14 14 LYS HA H 1 3.900 0.04 . 1 . . . . . 14 LYS HA . 16594 1 131 . 1 1 14 14 LYS HB2 H 1 1.859 0.04 . 2 . . . . . 14 LYS HB2 . 16594 1 132 . 1 1 14 14 LYS HB3 H 1 1.859 0.04 . 2 . . . . . 14 LYS HB3 . 16594 1 133 . 1 1 14 14 LYS HD2 H 1 1.654 0.04 . 2 . . . . . 14 LYS HD2 . 16594 1 134 . 1 1 14 14 LYS HD3 H 1 1.590 0.04 . 2 . . . . . 14 LYS HD3 . 16594 1 135 . 1 1 14 14 LYS HE2 H 1 2.951 0.04 . 2 . . . . . 14 LYS HE2 . 16594 1 136 . 1 1 14 14 LYS HE3 H 1 2.951 0.04 . 2 . . . . . 14 LYS HE3 . 16594 1 137 . 1 1 14 14 LYS HG2 H 1 1.442 0.04 . 2 . . . . . 14 LYS HG2 . 16594 1 138 . 1 1 14 14 LYS HG3 H 1 1.355 0.04 . 2 . . . . . 14 LYS HG3 . 16594 1 139 . 1 1 14 14 LYS C C 13 178.249 0.4 . 1 . . . . . 14 LYS C . 16594 1 140 . 1 1 14 14 LYS CA C 13 59.620 0.40 . 1 . . . . . 14 LYS CA . 16594 1 141 . 1 1 14 14 LYS CB C 13 32.420 0.40 . 1 . . . . . 14 LYS CB . 16594 1 142 . 1 1 14 14 LYS CD C 13 28.910 0.40 . 1 . . . . . 14 LYS CD . 16594 1 143 . 1 1 14 14 LYS CE C 13 42.290 0.40 . 1 . . . . . 14 LYS CE . 16594 1 144 . 1 1 14 14 LYS CG C 13 25.060 0.40 . 1 . . . . . 14 LYS CG . 16594 1 145 . 1 1 14 14 LYS N N 15 117.838 0.40 . 1 . . . . . 14 LYS N . 16594 1 146 . 1 1 15 15 ILE H H 1 7.409 0.04 . 1 . . . . . 15 ILE H . 16594 1 147 . 1 1 15 15 ILE HA H 1 3.822 0.04 . 1 . . . . . 15 ILE HA . 16594 1 148 . 1 1 15 15 ILE HB H 1 1.906 0.04 . 1 . . . . . 15 ILE HB . 16594 1 149 . 1 1 15 15 ILE HD11 H 1 0.766 0.04 . 1 . . . . . 15 ILE HD1 . 16594 1 150 . 1 1 15 15 ILE HD12 H 1 0.766 0.04 . 1 . . . . . 15 ILE HD1 . 16594 1 151 . 1 1 15 15 ILE HD13 H 1 0.766 0.04 . 1 . . . . . 15 ILE HD1 . 16594 1 152 . 1 1 15 15 ILE HG12 H 1 1.686 0.04 . 2 . . . . . 15 ILE HG12 . 16594 1 153 . 1 1 15 15 ILE HG13 H 1 1.156 0.04 . 2 . . . . . 15 ILE HG13 . 16594 1 154 . 1 1 15 15 ILE HG21 H 1 0.997 0.04 . 1 . . . . . 15 ILE HG2 . 16594 1 155 . 1 1 15 15 ILE HG22 H 1 0.997 0.04 . 1 . . . . . 15 ILE HG2 . 16594 1 156 . 1 1 15 15 ILE HG23 H 1 0.997 0.04 . 1 . . . . . 15 ILE HG2 . 16594 1 157 . 1 1 15 15 ILE C C 13 179.668 0.4 . 1 . . . . . 15 ILE C . 16594 1 158 . 1 1 15 15 ILE CA C 13 65.030 0.40 . 1 . . . . . 15 ILE CA . 16594 1 159 . 1 1 15 15 ILE CB C 13 38.950 0.40 . 1 . . . . . 15 ILE CB . 16594 1 160 . 1 1 15 15 ILE CD1 C 13 13.570 0.40 . 1 . . . . . 15 ILE CD1 . 16594 1 161 . 1 1 15 15 ILE CG1 C 13 29.150 0.40 . 1 . . . . . 15 ILE CG1 . 16594 1 162 . 1 1 15 15 ILE CG2 C 13 17.190 0.40 . 1 . . . . . 15 ILE CG2 . 16594 1 163 . 1 1 15 15 ILE N N 15 118.597 0.40 . 1 . . . . . 15 ILE N . 16594 1 164 . 1 1 16 16 LEU H H 1 8.407 0.04 . 1 . . . . . 16 LEU H . 16594 1 165 . 1 1 16 16 LEU HA H 1 3.992 0.04 . 1 . . . . . 16 LEU HA . 16594 1 166 . 1 1 16 16 LEU HB2 H 1 2.086 0.04 . 2 . . . . . 16 LEU HB2 . 16594 1 167 . 1 1 16 16 LEU HB3 H 1 1.206 0.04 . 2 . . . . . 16 LEU HB3 . 16594 1 168 . 1 1 16 16 LEU HD11 H 1 0.716 0.04 . 1 . . . . . 16 LEU HD1 . 16594 1 169 . 1 1 16 16 LEU HD12 H 1 0.716 0.04 . 1 . . . . . 16 LEU HD1 . 16594 1 170 . 1 1 16 16 LEU HD13 H 1 0.716 0.04 . 1 . . . . . 16 LEU HD1 . 16594 1 171 . 1 1 16 16 LEU HD21 H 1 0.989 0.04 . 1 . . . . . 16 LEU HD2 . 16594 1 172 . 1 1 16 16 LEU HD22 H 1 0.989 0.04 . 1 . . . . . 16 LEU HD2 . 16594 1 173 . 1 1 16 16 LEU HD23 H 1 0.989 0.04 . 1 . . . . . 16 LEU HD2 . 16594 1 174 . 1 1 16 16 LEU HG H 1 1.837 0.04 . 1 . . . . . 16 LEU HG . 16594 1 175 . 1 1 16 16 LEU C C 13 178.512 0.4 . 1 . . . . . 16 LEU C . 16594 1 176 . 1 1 16 16 LEU CA C 13 58.230 0.40 . 1 . . . . . 16 LEU CA . 16594 1 177 . 1 1 16 16 LEU CB C 13 42.130 0.40 . 1 . . . . . 16 LEU CB . 16594 1 178 . 1 1 16 16 LEU CD1 C 13 26.520 0.40 . 1 . . . . . 16 LEU CD1 . 16594 1 179 . 1 1 16 16 LEU CD2 C 13 24.590 0.40 . 1 . . . . . 16 LEU CD2 . 16594 1 180 . 1 1 16 16 LEU CG C 13 27.540 0.40 . 1 . . . . . 16 LEU CG . 16594 1 181 . 1 1 16 16 LEU N N 15 120.642 0.40 . 1 . . . . . 16 LEU N . 16594 1 182 . 1 1 17 17 ARG H H 1 8.789 0.04 . 1 . . . . . 17 ARG H . 16594 1 183 . 1 1 17 17 ARG HA H 1 3.917 0.04 . 1 . . . . . 17 ARG HA . 16594 1 184 . 1 1 17 17 ARG HB2 H 1 1.936 0.04 . 2 . . . . . 17 ARG HB2 . 16594 1 185 . 1 1 17 17 ARG HB3 H 1 1.784 0.04 . 2 . . . . . 17 ARG HB3 . 16594 1 186 . 1 1 17 17 ARG HD2 H 1 3.165 0.04 . 2 . . . . . 17 ARG HD2 . 16594 1 187 . 1 1 17 17 ARG HD3 H 1 3.070 0.04 . 2 . . . . . 17 ARG HD3 . 16594 1 188 . 1 1 17 17 ARG HG2 H 1 1.869 0.04 . 2 . . . . . 17 ARG HG2 . 16594 1 189 . 1 1 17 17 ARG HG3 H 1 1.606 0.04 . 2 . . . . . 17 ARG HG3 . 16594 1 190 . 1 1 17 17 ARG C C 13 179.602 0.4 . 1 . . . . . 17 ARG C . 16594 1 191 . 1 1 17 17 ARG CA C 13 60.080 0.40 . 1 . . . . . 17 ARG CA . 16594 1 192 . 1 1 17 17 ARG CB C 13 29.620 0.40 . 1 . . . . . 17 ARG CB . 16594 1 193 . 1 1 17 17 ARG CD C 13 42.920 0.40 . 1 . . . . . 17 ARG CD . 16594 1 194 . 1 1 17 17 ARG CG C 13 28.920 0.40 . 1 . . . . . 17 ARG CG . 16594 1 195 . 1 1 17 17 ARG N N 15 119.196 0.40 . 1 . . . . . 17 ARG N . 16594 1 196 . 1 1 18 18 ASP H H 1 8.638 0.04 . 1 . . . . . 18 ASP H . 16594 1 197 . 1 1 18 18 ASP HA H 1 4.418 0.04 . 1 . . . . . 18 ASP HA . 16594 1 198 . 1 1 18 18 ASP HB2 H 1 2.841 0.04 . 2 . . . . . 18 ASP HB2 . 16594 1 199 . 1 1 18 18 ASP HB3 H 1 2.614 0.04 . 2 . . . . . 18 ASP HB3 . 16594 1 200 . 1 1 18 18 ASP C C 13 179.116 0.4 . 1 . . . . . 18 ASP C . 16594 1 201 . 1 1 18 18 ASP CA C 13 57.330 0.40 . 1 . . . . . 18 ASP CA . 16594 1 202 . 1 1 18 18 ASP CB C 13 39.700 0.40 . 1 . . . . . 18 ASP CB . 16594 1 203 . 1 1 18 18 ASP N N 15 121.383 0.40 . 1 . . . . . 18 ASP N . 16594 1 204 . 1 1 19 19 ARG H H 1 7.947 0.04 . 1 . . . . . 19 ARG H . 16594 1 205 . 1 1 19 19 ARG HA H 1 4.180 0.04 . 1 . . . . . 19 ARG HA . 16594 1 206 . 1 1 19 19 ARG HB2 H 1 2.079 0.04 . 2 . . . . . 19 ARG HB2 . 16594 1 207 . 1 1 19 19 ARG HB3 H 1 2.034 0.04 . 2 . . . . . 19 ARG HB3 . 16594 1 208 . 1 1 19 19 ARG HD2 H 1 3.375 0.04 . 2 . . . . . 19 ARG HD2 . 16594 1 209 . 1 1 19 19 ARG HD3 H 1 3.054 0.04 . 2 . . . . . 19 ARG HD3 . 16594 1 210 . 1 1 19 19 ARG HG2 H 1 1.877 0.04 . 2 . . . . . 19 ARG HG2 . 16594 1 211 . 1 1 19 19 ARG HG3 H 1 1.565 0.04 . 2 . . . . . 19 ARG HG3 . 16594 1 212 . 1 1 19 19 ARG C C 13 177.855 0.4 . 1 . . . . . 19 ARG C . 16594 1 213 . 1 1 19 19 ARG CA C 13 57.680 0.40 . 1 . . . . . 19 ARG CA . 16594 1 214 . 1 1 19 19 ARG CB C 13 29.540 0.40 . 1 . . . . . 19 ARG CB . 16594 1 215 . 1 1 19 19 ARG CD C 13 42.690 0.40 . 1 . . . . . 19 ARG CD . 16594 1 216 . 1 1 19 19 ARG CG C 13 27.290 0.40 . 1 . . . . . 19 ARG CG . 16594 1 217 . 1 1 19 19 ARG N N 15 121.506 0.40 . 1 . . . . . 19 ARG N . 16594 1 218 . 1 1 20 20 GLN H H 1 8.691 0.04 . 1 . . . . . 20 GLN H . 16594 1 219 . 1 1 20 20 GLN HA H 1 3.589 0.04 . 1 . . . . . 20 GLN HA . 16594 1 220 . 1 1 20 20 GLN HB2 H 1 2.368 0.04 . 2 . . . . . 20 GLN HB2 . 16594 1 221 . 1 1 20 20 GLN HB3 H 1 2.083 0.04 . 2 . . . . . 20 GLN HB3 . 16594 1 222 . 1 1 20 20 GLN HE21 H 1 7.864 0.04 . 1 . . . . . 20 GLN HE21 . 16594 1 223 . 1 1 20 20 GLN HE22 H 1 6.597 0.04 . 2 . . . . . 20 GLN HE22 . 16594 1 224 . 1 1 20 20 GLN HG2 H 1 2.174 0.04 . 2 . . . . . 20 GLN HG2 . 16594 1 225 . 1 1 20 20 GLN HG3 H 1 1.903 0.04 . 2 . . . . . 20 GLN HG3 . 16594 1 226 . 1 1 20 20 GLN C C 13 176.896 0.4 . 1 . . . . . 20 GLN C . 16594 1 227 . 1 1 20 20 GLN CA C 13 59.620 0.40 . 1 . . . . . 20 GLN CA . 16594 1 228 . 1 1 20 20 GLN CB C 13 30.020 0.40 . 1 . . . . . 20 GLN CB . 16594 1 229 . 1 1 20 20 GLN CG C 13 34.260 0.40 . 1 . . . . . 20 GLN CG . 16594 1 230 . 1 1 20 20 GLN N N 15 120.162 0.40 . 1 . . . . . 20 GLN N . 16594 1 231 . 1 1 20 20 GLN NE2 N 15 113.309 0.04 . 1 . . . . . 20 GLN NE2 . 16594 1 232 . 1 1 21 21 ARG H H 1 7.959 0.04 . 1 . . . . . 21 ARG H . 16594 1 233 . 1 1 21 21 ARG HA H 1 3.973 0.04 . 1 . . . . . 21 ARG HA . 16594 1 234 . 1 1 21 21 ARG HB2 H 1 1.975 0.04 . 2 . . . . . 21 ARG HB2 . 16594 1 235 . 1 1 21 21 ARG HB3 H 1 1.975 0.04 . 2 . . . . . 21 ARG HB3 . 16594 1 236 . 1 1 21 21 ARG HD2 H 1 3.223 0.04 . 2 . . . . . 21 ARG HD2 . 16594 1 237 . 1 1 21 21 ARG HD3 H 1 3.223 0.04 . 2 . . . . . 21 ARG HD3 . 16594 1 238 . 1 1 21 21 ARG HG2 H 1 1.826 0.04 . 2 . . . . . 21 ARG HG2 . 16594 1 239 . 1 1 21 21 ARG HG3 H 1 1.606 0.04 . 2 . . . . . 21 ARG HG3 . 16594 1 240 . 1 1 21 21 ARG C C 13 178.985 0.4 . 1 . . . . . 21 ARG C . 16594 1 241 . 1 1 21 21 ARG CA C 13 59.800 0.40 . 1 . . . . . 21 ARG CA . 16594 1 242 . 1 1 21 21 ARG CB C 13 29.980 0.40 . 1 . . . . . 21 ARG CB . 16594 1 243 . 1 1 21 21 ARG CD C 13 43.420 0.40 . 1 . . . . . 21 ARG CD . 16594 1 244 . 1 1 21 21 ARG CG C 13 27.770 0.40 . 1 . . . . . 21 ARG CG . 16594 1 245 . 1 1 21 21 ARG N N 15 117.219 0.40 . 1 . . . . . 21 ARG N . 16594 1 246 . 1 1 22 22 GLU H H 1 7.700 0.04 . 1 . . . . . 22 GLU H . 16594 1 247 . 1 1 22 22 GLU HA H 1 4.076 0.04 . 1 . . . . . 22 GLU HA . 16594 1 248 . 1 1 22 22 GLU HB2 H 1 2.158 0.04 . 2 . . . . . 22 GLU HB2 . 16594 1 249 . 1 1 22 22 GLU HB3 H 1 2.126 0.04 . 2 . . . . . 22 GLU HB3 . 16594 1 250 . 1 1 22 22 GLU HG2 H 1 2.283 0.04 . 2 . . . . . 22 GLU HG2 . 16594 1 251 . 1 1 22 22 GLU HG3 H 1 2.283 0.04 . 2 . . . . . 22 GLU HG3 . 16594 1 252 . 1 1 22 22 GLU C C 13 179.090 0.4 . 1 . . . . . 22 GLU C . 16594 1 253 . 1 1 22 22 GLU CA C 13 58.950 0.40 . 1 . . . . . 22 GLU CA . 16594 1 254 . 1 1 22 22 GLU CB C 13 29.580 0.40 . 1 . . . . . 22 GLU CB . 16594 1 255 . 1 1 22 22 GLU CG C 13 35.700 0.40 . 1 . . . . . 22 GLU CG . 16594 1 256 . 1 1 22 22 GLU N N 15 119.703 0.40 . 1 . . . . . 22 GLU N . 16594 1 257 . 1 1 23 23 LEU H H 1 8.264 0.04 . 1 . . . . . 23 LEU H . 16594 1 258 . 1 1 23 23 LEU HA H 1 3.979 0.04 . 1 . . . . . 23 LEU HA . 16594 1 259 . 1 1 23 23 LEU HB2 H 1 1.848 0.04 . 2 . . . . . 23 LEU HB2 . 16594 1 260 . 1 1 23 23 LEU HB3 H 1 1.209 0.04 . 2 . . . . . 23 LEU HB3 . 16594 1 261 . 1 1 23 23 LEU HD11 H 1 0.706 0.04 . 1 . . . . . 23 LEU HD1 . 16594 1 262 . 1 1 23 23 LEU HD12 H 1 0.706 0.04 . 1 . . . . . 23 LEU HD1 . 16594 1 263 . 1 1 23 23 LEU HD13 H 1 0.706 0.04 . 1 . . . . . 23 LEU HD1 . 16594 1 264 . 1 1 23 23 LEU HD21 H 1 0.761 0.04 . 1 . . . . . 23 LEU HD2 . 16594 1 265 . 1 1 23 23 LEU HD22 H 1 0.761 0.04 . 1 . . . . . 23 LEU HD2 . 16594 1 266 . 1 1 23 23 LEU HD23 H 1 0.761 0.04 . 1 . . . . . 23 LEU HD2 . 16594 1 267 . 1 1 23 23 LEU HG H 1 1.585 0.04 . 1 . . . . . 23 LEU HG . 16594 1 268 . 1 1 23 23 LEU C C 13 179.234 0.4 . 1 . . . . . 23 LEU C . 16594 1 269 . 1 1 23 23 LEU CA C 13 57.990 0.40 . 1 . . . . . 23 LEU CA . 16594 1 270 . 1 1 23 23 LEU CB C 13 42.370 0.40 . 1 . . . . . 23 LEU CB . 16594 1 271 . 1 1 23 23 LEU CD1 C 13 25.670 0.40 . 1 . . . . . 23 LEU CD1 . 16594 1 272 . 1 1 23 23 LEU CD2 C 13 22.660 0.40 . 1 . . . . . 23 LEU CD2 . 16594 1 273 . 1 1 23 23 LEU CG C 13 27.530 0.40 . 1 . . . . . 23 LEU CG . 16594 1 274 . 1 1 23 23 LEU N N 15 119.988 0.40 . 1 . . . . . 23 LEU N . 16594 1 275 . 1 1 24 24 TYR H H 1 8.688 0.04 . 1 . . . . . 24 TYR H . 16594 1 276 . 1 1 24 24 TYR HA H 1 4.084 0.04 . 1 . . . . . 24 TYR HA . 16594 1 277 . 1 1 24 24 TYR HB2 H 1 3.107 0.04 . 2 . . . . . 24 TYR HB2 . 16594 1 278 . 1 1 24 24 TYR HB3 H 1 3.028 0.04 . 2 . . . . . 24 TYR HB3 . 16594 1 279 . 1 1 24 24 TYR HD1 H 1 6.980 0.04 . 1 . . . . . 24 TYR HD1 . 16594 1 280 . 1 1 24 24 TYR HD2 H 1 6.980 0.04 . 1 . . . . . 24 TYR HD2 . 16594 1 281 . 1 1 24 24 TYR HE1 H 1 6.674 0.04 . 1 . . . . . 24 TYR HE1 . 16594 1 282 . 1 1 24 24 TYR HE2 H 1 6.674 0.04 . 1 . . . . . 24 TYR HE2 . 16594 1 283 . 1 1 24 24 TYR C C 13 178.630 0.4 . 1 . . . . . 24 TYR C . 16594 1 284 . 1 1 24 24 TYR CA C 13 61.670 0.40 . 1 . . . . . 24 TYR CA . 16594 1 285 . 1 1 24 24 TYR CB C 13 37.780 0.40 . 1 . . . . . 24 TYR CB . 16594 1 286 . 1 1 24 24 TYR CD1 C 13 132.194 0.40 . 1 . . . . . 24 TYR CD1 . 16594 1 287 . 1 1 24 24 TYR CE1 C 13 118.202 0.40 . 1 . . . . . 24 TYR CE1 . 16594 1 288 . 1 1 24 24 TYR N N 15 119.101 0.40 . 1 . . . . . 24 TYR N . 16594 1 289 . 1 1 25 25 ARG H H 1 7.945 0.04 . 1 . . . . . 25 ARG H . 16594 1 290 . 1 1 25 25 ARG HA H 1 4.043 0.04 . 1 . . . . . 25 ARG HA . 16594 1 291 . 1 1 25 25 ARG HB2 H 1 1.972 0.04 . 2 . . . . . 25 ARG HB2 . 16594 1 292 . 1 1 25 25 ARG HB3 H 1 1.972 0.04 . 2 . . . . . 25 ARG HB3 . 16594 1 293 . 1 1 25 25 ARG HD2 H 1 3.210 0.04 . 2 . . . . . 25 ARG HD2 . 16594 1 294 . 1 1 25 25 ARG HD3 H 1 3.159 0.04 . 2 . . . . . 25 ARG HD3 . 16594 1 295 . 1 1 25 25 ARG HG2 H 1 1.830 0.04 . 2 . . . . . 25 ARG HG2 . 16594 1 296 . 1 1 25 25 ARG HG3 H 1 1.606 0.04 . 2 . . . . . 25 ARG HG3 . 16594 1 297 . 1 1 25 25 ARG C C 13 178.683 0.4 . 1 . . . . . 25 ARG C . 16594 1 298 . 1 1 25 25 ARG CA C 13 59.460 0.40 . 1 . . . . . 25 ARG CA . 16594 1 299 . 1 1 25 25 ARG CB C 13 30.160 0.40 . 1 . . . . . 25 ARG CB . 16594 1 300 . 1 1 25 25 ARG CD C 13 43.280 0.40 . 1 . . . . . 25 ARG CD . 16594 1 301 . 1 1 25 25 ARG CG C 13 27.740 0.40 . 1 . . . . . 25 ARG CG . 16594 1 302 . 1 1 25 25 ARG N N 15 118.297 0.40 . 1 . . . . . 25 ARG N . 16594 1 303 . 1 1 26 26 ARG H H 1 7.726 0.04 . 1 . . . . . 26 ARG H . 16594 1 304 . 1 1 26 26 ARG HA H 1 4.067 0.04 . 1 . . . . . 26 ARG HA . 16594 1 305 . 1 1 26 26 ARG HB2 H 1 1.899 0.04 . 2 . . . . . 26 ARG HB2 . 16594 1 306 . 1 1 26 26 ARG HB3 H 1 1.899 0.04 . 2 . . . . . 26 ARG HB3 . 16594 1 307 . 1 1 26 26 ARG HD2 H 1 3.126 0.04 . 2 . . . . . 26 ARG HD2 . 16594 1 308 . 1 1 26 26 ARG HD3 H 1 3.126 0.04 . 2 . . . . . 26 ARG HD3 . 16594 1 309 . 1 1 26 26 ARG HG2 H 1 1.819 0.04 . 2 . . . . . 26 ARG HG2 . 16594 1 310 . 1 1 26 26 ARG HG3 H 1 1.636 0.04 . 2 . . . . . 26 ARG HG3 . 16594 1 311 . 1 1 26 26 ARG C C 13 177.986 0.4 . 1 . . . . . 26 ARG C . 16594 1 312 . 1 1 26 26 ARG CA C 13 58.300 0.40 . 1 . . . . . 26 ARG CA . 16594 1 313 . 1 1 26 26 ARG CB C 13 30.670 0.40 . 1 . . . . . 26 ARG CB . 16594 1 314 . 1 1 26 26 ARG CD C 13 43.900 0.40 . 1 . . . . . 26 ARG CD . 16594 1 315 . 1 1 26 26 ARG CG C 13 27.420 0.40 . 1 . . . . . 26 ARG CG . 16594 1 316 . 1 1 26 26 ARG N N 15 118.100 0.40 . 1 . . . . . 26 ARG N . 16594 1 317 . 1 1 27 27 LEU H H 1 7.971 0.04 . 1 . . . . . 27 LEU H . 16594 1 318 . 1 1 27 27 LEU HA H 1 4.095 0.04 . 1 . . . . . 27 LEU HA . 16594 1 319 . 1 1 27 27 LEU HB2 H 1 1.541 0.04 . 2 . . . . . 27 LEU HB2 . 16594 1 320 . 1 1 27 27 LEU HB3 H 1 1.376 0.04 . 2 . . . . . 27 LEU HB3 . 16594 1 321 . 1 1 27 27 LEU HD11 H 1 0.708 0.04 . 1 . . . . . 27 LEU HD1 . 16594 1 322 . 1 1 27 27 LEU HD12 H 1 0.708 0.04 . 1 . . . . . 27 LEU HD1 . 16594 1 323 . 1 1 27 27 LEU HD13 H 1 0.708 0.04 . 1 . . . . . 27 LEU HD1 . 16594 1 324 . 1 1 27 27 LEU HD21 H 1 0.745 0.04 . 1 . . . . . 27 LEU HD2 . 16594 1 325 . 1 1 27 27 LEU HD22 H 1 0.745 0.04 . 1 . . . . . 27 LEU HD2 . 16594 1 326 . 1 1 27 27 LEU HD23 H 1 0.745 0.04 . 1 . . . . . 27 LEU HD2 . 16594 1 327 . 1 1 27 27 LEU HG H 1 1.540 0.04 . 1 . . . . . 27 LEU HG . 16594 1 328 . 1 1 27 27 LEU C C 13 177.461 0.4 . 1 . . . . . 27 LEU C . 16594 1 329 . 1 1 27 27 LEU CA C 13 56.260 0.40 . 1 . . . . . 27 LEU CA . 16594 1 330 . 1 1 27 27 LEU CB C 13 42.260 0.40 . 1 . . . . . 27 LEU CB . 16594 1 331 . 1 1 27 27 LEU CD1 C 13 25.450 0.40 . 1 . . . . . 27 LEU CD1 . 16594 1 332 . 1 1 27 27 LEU CD2 C 13 23.650 0.40 . 1 . . . . . 27 LEU CD2 . 16594 1 333 . 1 1 27 27 LEU CG C 13 26.780 0.40 . 1 . . . . . 27 LEU CG . 16594 1 334 . 1 1 27 27 LEU N N 15 118.633 0.40 . 1 . . . . . 27 LEU N . 16594 1 335 . 1 1 28 28 HIS H H 1 7.863 0.04 . 1 . . . . . 28 HIS H . 16594 1 336 . 1 1 28 28 HIS HA H 1 4.482 0.04 . 1 . . . . . 28 HIS HA . 16594 1 337 . 1 1 28 28 HIS HB2 H 1 3.130 0.04 . 2 . . . . . 28 HIS HB2 . 16594 1 338 . 1 1 28 28 HIS HB3 H 1 2.905 0.04 . 2 . . . . . 28 HIS HB3 . 16594 1 339 . 1 1 28 28 HIS HD2 H 1 6.743 0.04 . 1 . . . . . 28 HIS HD2 . 16594 1 340 . 1 1 28 28 HIS HE1 H 1 7.887 0.04 . 1 . . . . . 28 HIS HE1 . 16594 1 341 . 1 1 28 28 HIS C C 13 174.741 0.4 . 1 . . . . . 28 HIS C . 16594 1 342 . 1 1 28 28 HIS CA C 13 56.310 0.40 . 1 . . . . . 28 HIS CA . 16594 1 343 . 1 1 28 28 HIS CB C 13 29.300 0.40 . 1 . . . . . 28 HIS CB . 16594 1 344 . 1 1 28 28 HIS CD2 C 13 119.995 0.40 . 1 . . . . . 28 HIS CD2 . 16594 1 345 . 1 1 28 28 HIS CE1 C 13 137.397 0.40 . 1 . . . . . 28 HIS CE1 . 16594 1 346 . 1 1 28 28 HIS N N 15 116.767 0.40 . 1 . . . . . 28 HIS N . 16594 1 347 . 1 1 29 29 LYS H H 1 7.893 0.04 . 1 . . . . . 29 LYS H . 16594 1 348 . 1 1 29 29 LYS HA H 1 4.172 0.04 . 1 . . . . . 29 LYS HA . 16594 1 349 . 1 1 29 29 LYS HB2 H 1 1.793 0.04 . 2 . . . . . 29 LYS HB2 . 16594 1 350 . 1 1 29 29 LYS HB3 H 1 1.739 0.04 . 2 . . . . . 29 LYS HB3 . 16594 1 351 . 1 1 29 29 LYS HD2 H 1 1.591 0.04 . 2 . . . . . 29 LYS HD2 . 16594 1 352 . 1 1 29 29 LYS HD3 H 1 1.591 0.04 . 2 . . . . . 29 LYS HD3 . 16594 1 353 . 1 1 29 29 LYS HE2 H 1 2.913 0.04 . 2 . . . . . 29 LYS HE2 . 16594 1 354 . 1 1 29 29 LYS HE3 H 1 2.913 0.04 . 2 . . . . . 29 LYS HE3 . 16594 1 355 . 1 1 29 29 LYS HG2 H 1 1.342 0.04 . 2 . . . . . 29 LYS HG2 . 16594 1 356 . 1 1 29 29 LYS HG3 H 1 1.308 0.04 . 2 . . . . . 29 LYS HG3 . 16594 1 357 . 1 1 29 29 LYS C C 13 176.357 0.4 . 1 . . . . . 29 LYS C . 16594 1 358 . 1 1 29 29 LYS CA C 13 56.830 0.40 . 1 . . . . . 29 LYS CA . 16594 1 359 . 1 1 29 29 LYS CB C 13 32.000 0.40 . 1 . . . . . 29 LYS CB . 16594 1 360 . 1 1 29 29 LYS CD C 13 29.120 0.40 . 1 . . . . . 29 LYS CD . 16594 1 361 . 1 1 29 29 LYS CE C 13 42.160 0.40 . 1 . . . . . 29 LYS CE . 16594 1 362 . 1 1 29 29 LYS CG C 13 24.730 0.40 . 1 . . . . . 29 LYS CG . 16594 1 363 . 1 1 29 29 LYS N N 15 120.331 0.40 . 1 . . . . . 29 LYS N . 16594 1 364 . 1 1 30 30 ILE H H 1 7.995 0.04 . 1 . . . . . 30 ILE H . 16594 1 365 . 1 1 30 30 ILE HA H 1 4.085 0.04 . 1 . . . . . 30 ILE HA . 16594 1 366 . 1 1 30 30 ILE HB H 1 1.811 0.04 . 1 . . . . . 30 ILE HB . 16594 1 367 . 1 1 30 30 ILE HD11 H 1 0.809 0.04 . 1 . . . . . 30 ILE HD1 . 16594 1 368 . 1 1 30 30 ILE HD12 H 1 0.809 0.04 . 1 . . . . . 30 ILE HD1 . 16594 1 369 . 1 1 30 30 ILE HD13 H 1 0.809 0.04 . 1 . . . . . 30 ILE HD1 . 16594 1 370 . 1 1 30 30 ILE HG12 H 1 1.431 0.04 . 2 . . . . . 30 ILE HG12 . 16594 1 371 . 1 1 30 30 ILE HG13 H 1 1.121 0.04 . 2 . . . . . 30 ILE HG13 . 16594 1 372 . 1 1 30 30 ILE HG21 H 1 0.854 0.04 . 1 . . . . . 30 ILE HG2 . 16594 1 373 . 1 1 30 30 ILE HG22 H 1 0.854 0.04 . 1 . . . . . 30 ILE HG2 . 16594 1 374 . 1 1 30 30 ILE HG23 H 1 0.854 0.04 . 1 . . . . . 30 ILE HG2 . 16594 1 375 . 1 1 30 30 ILE C C 13 176.344 0.4 . 1 . . . . . 30 ILE C . 16594 1 376 . 1 1 30 30 ILE CA C 13 61.440 0.40 . 1 . . . . . 30 ILE CA . 16594 1 377 . 1 1 30 30 ILE CB C 13 39.020 0.40 . 1 . . . . . 30 ILE CB . 16594 1 378 . 1 1 30 30 ILE CD1 C 13 13.070 0.40 . 1 . . . . . 30 ILE CD1 . 16594 1 379 . 1 1 30 30 ILE CG1 C 13 27.420 0.40 . 1 . . . . . 30 ILE CG1 . 16594 1 380 . 1 1 30 30 ILE CG2 C 13 17.510 0.40 . 1 . . . . . 30 ILE CG2 . 16594 1 381 . 1 1 30 30 ILE N N 15 120.440 0.40 . 1 . . . . . 30 ILE N . 16594 1 382 . 1 1 31 31 GLU H H 1 8.367 0.04 . 1 . . . . . 31 GLU H . 16594 1 383 . 1 1 31 31 GLU HA H 1 4.159 0.04 . 1 . . . . . 31 GLU HA . 16594 1 384 . 1 1 31 31 GLU HB2 H 1 1.991 0.04 . 2 . . . . . 31 GLU HB2 . 16594 1 385 . 1 1 31 31 GLU HB3 H 1 1.901 0.04 . 2 . . . . . 31 GLU HB3 . 16594 1 386 . 1 1 31 31 GLU HG2 H 1 2.225 0.04 . 2 . . . . . 31 GLU HG2 . 16594 1 387 . 1 1 31 31 GLU HG3 H 1 2.181 0.04 . 2 . . . . . 31 GLU HG3 . 16594 1 388 . 1 1 31 31 GLU C C 13 176.265 0.4 . 1 . . . . . 31 GLU C . 16594 1 389 . 1 1 31 31 GLU CA C 13 56.890 0.40 . 1 . . . . . 31 GLU CA . 16594 1 390 . 1 1 31 31 GLU CB C 13 30.050 0.40 . 1 . . . . . 31 GLU CB . 16594 1 391 . 1 1 31 31 GLU CG C 13 36.220 0.40 . 1 . . . . . 31 GLU CG . 16594 1 392 . 1 1 31 31 GLU N N 15 124.043 0.40 . 1 . . . . . 31 GLU N . 16594 1 393 . 1 1 32 32 ALA H H 1 8.138 0.04 . 1 . . . . . 32 ALA H . 16594 1 394 . 1 1 32 32 ALA HA H 1 4.175 0.04 . 1 . . . . . 32 ALA HA . 16594 1 395 . 1 1 32 32 ALA HB1 H 1 1.257 0.04 . 1 . . . . . 32 ALA HB . 16594 1 396 . 1 1 32 32 ALA HB2 H 1 1.257 0.04 . 1 . . . . . 32 ALA HB . 16594 1 397 . 1 1 32 32 ALA HB3 H 1 1.257 0.04 . 1 . . . . . 32 ALA HB . 16594 1 398 . 1 1 32 32 ALA C C 13 177.198 0.4 . 1 . . . . . 32 ALA C . 16594 1 399 . 1 1 32 32 ALA CA C 13 52.620 0.40 . 1 . . . . . 32 ALA CA . 16594 1 400 . 1 1 32 32 ALA CB C 13 19.490 0.40 . 1 . . . . . 32 ALA CB . 16594 1 401 . 1 1 32 32 ALA N N 15 124.170 0.40 . 1 . . . . . 32 ALA N . 16594 1 402 . 1 1 33 33 ASP H H 1 8.157 0.04 . 1 . . . . . 33 ASP H . 16594 1 403 . 1 1 33 33 ASP HA H 1 4.467 0.04 . 1 . . . . . 33 ASP HA . 16594 1 404 . 1 1 33 33 ASP HB2 H 1 2.511 0.04 . 2 . . . . . 33 ASP HB2 . 16594 1 405 . 1 1 33 33 ASP HB3 H 1 2.511 0.04 . 2 . . . . . 33 ASP HB3 . 16594 1 406 . 1 1 33 33 ASP C C 13 175.910 0.4 . 1 . . . . . 33 ASP C . 16594 1 407 . 1 1 33 33 ASP CA C 13 54.500 0.40 . 1 . . . . . 33 ASP CA . 16594 1 408 . 1 1 33 33 ASP CB C 13 40.750 0.40 . 1 . . . . . 33 ASP CB . 16594 1 409 . 1 1 33 33 ASP N N 15 118.904 0.40 . 1 . . . . . 33 ASP N . 16594 1 410 . 1 1 34 34 PHE H H 1 7.884 0.04 . 1 . . . . . 34 PHE H . 16594 1 411 . 1 1 34 34 PHE HA H 1 4.514 0.04 . 1 . . . . . 34 PHE HA . 16594 1 412 . 1 1 34 34 PHE HB2 H 1 3.070 0.04 . 2 . . . . . 34 PHE HB2 . 16594 1 413 . 1 1 34 34 PHE HB3 H 1 2.993 0.04 . 2 . . . . . 34 PHE HB3 . 16594 1 414 . 1 1 34 34 PHE HD1 H 1 7.175 0.04 . 1 . . . . . 34 PHE HD1 . 16594 1 415 . 1 1 34 34 PHE HD2 H 1 7.175 0.04 . 1 . . . . . 34 PHE HD2 . 16594 1 416 . 1 1 34 34 PHE HE1 H 1 7.267 0.04 . 1 . . . . . 34 PHE HE1 . 16594 1 417 . 1 1 34 34 PHE HE2 H 1 7.267 0.04 . 1 . . . . . 34 PHE HE2 . 16594 1 418 . 1 1 34 34 PHE C C 13 175.319 0.4 . 1 . . . . . 34 PHE C . 16594 1 419 . 1 1 34 34 PHE CA C 13 57.610 0.40 . 1 . . . . . 34 PHE CA . 16594 1 420 . 1 1 34 34 PHE CB C 13 39.840 0.40 . 1 . . . . . 34 PHE CB . 16594 1 421 . 1 1 34 34 PHE CD1 C 13 131.697 0.40 . 1 . . . . . 34 PHE CD1 . 16594 1 422 . 1 1 34 34 PHE CE1 C 13 131.697 0.40 . 1 . . . . . 34 PHE CE1 . 16594 1 423 . 1 1 34 34 PHE N N 15 119.439 0.40 . 1 . . . . . 34 PHE N . 16594 1 424 . 1 1 35 35 GLU H H 1 8.084 0.04 . 1 . . . . . 35 GLU H . 16594 1 425 . 1 1 35 35 GLU HA H 1 4.190 0.04 . 1 . . . . . 35 GLU HA . 16594 1 426 . 1 1 35 35 GLU HB2 H 1 1.916 0.04 . 2 . . . . . 35 GLU HB2 . 16594 1 427 . 1 1 35 35 GLU HB3 H 1 1.806 0.04 . 2 . . . . . 35 GLU HB3 . 16594 1 428 . 1 1 35 35 GLU HG2 H 1 2.108 0.04 . 2 . . . . . 35 GLU HG2 . 16594 1 429 . 1 1 35 35 GLU HG3 H 1 2.108 0.04 . 2 . . . . . 35 GLU HG3 . 16594 1 430 . 1 1 35 35 GLU C C 13 175.634 0.4 . 1 . . . . . 35 GLU C . 16594 1 431 . 1 1 35 35 GLU CA C 13 56.140 0.40 . 1 . . . . . 35 GLU CA . 16594 1 432 . 1 1 35 35 GLU CB C 13 30.810 0.40 . 1 . . . . . 35 GLU CB . 16594 1 433 . 1 1 35 35 GLU CG C 13 36.030 0.40 . 1 . . . . . 35 GLU CG . 16594 1 434 . 1 1 35 35 GLU N N 15 122.340 0.40 . 1 . . . . . 35 GLU N . 16594 1 435 . 1 1 36 36 GLU H H 1 8.172 0.04 . 1 . . . . . 36 GLU H . 16594 1 436 . 1 1 36 36 GLU HA H 1 4.442 0.04 . 1 . . . . . 36 GLU HA . 16594 1 437 . 1 1 36 36 GLU HB2 H 1 1.957 0.04 . 2 . . . . . 36 GLU HB2 . 16594 1 438 . 1 1 36 36 GLU HB3 H 1 1.832 0.04 . 2 . . . . . 36 GLU HB3 . 16594 1 439 . 1 1 36 36 GLU HG2 H 1 2.230 0.04 . 2 . . . . . 36 GLU HG2 . 16594 1 440 . 1 1 36 36 GLU HG3 H 1 2.230 0.04 . 2 . . . . . 36 GLU HG3 . 16594 1 441 . 1 1 36 36 GLU CA C 13 54.300 0.40 . 1 . . . . . 36 GLU CA . 16594 1 442 . 1 1 36 36 GLU CB C 13 29.490 0.40 . 1 . . . . . 36 GLU CB . 16594 1 443 . 1 1 36 36 GLU CG C 13 35.900 0.40 . 1 . . . . . 36 GLU CG . 16594 1 444 . 1 1 36 36 GLU N N 15 123.278 0.40 . 1 . . . . . 36 GLU N . 16594 1 445 . 1 1 37 37 PRO HA H 1 4.339 0.04 . 1 . . . . . 37 PRO HA . 16594 1 446 . 1 1 37 37 PRO HB2 H 1 2.214 0.04 . 2 . . . . . 37 PRO HB2 . 16594 1 447 . 1 1 37 37 PRO HB3 H 1 1.816 0.04 . 2 . . . . . 37 PRO HB3 . 16594 1 448 . 1 1 37 37 PRO HD2 H 1 3.759 0.04 . 2 . . . . . 37 PRO HD2 . 16594 1 449 . 1 1 37 37 PRO HD3 H 1 3.639 0.04 . 2 . . . . . 37 PRO HD3 . 16594 1 450 . 1 1 37 37 PRO HG2 H 1 1.991 0.04 . 2 . . . . . 37 PRO HG2 . 16594 1 451 . 1 1 37 37 PRO HG3 H 1 1.941 0.04 . 2 . . . . . 37 PRO HG3 . 16594 1 452 . 1 1 37 37 PRO C C 13 175.818 0.4 . 1 . . . . . 37 PRO C . 16594 1 453 . 1 1 37 37 PRO CA C 13 62.800 0.40 . 1 . . . . . 37 PRO CA . 16594 1 454 . 1 1 37 37 PRO CB C 13 31.900 0.40 . 1 . . . . . 37 PRO CB . 16594 1 455 . 1 1 37 37 PRO CD C 13 50.650 0.40 . 1 . . . . . 37 PRO CD . 16594 1 456 . 1 1 37 37 PRO CG C 13 27.380 0.40 . 1 . . . . . 37 PRO CG . 16594 1 457 . 1 1 38 38 ARG H H 1 8.412 0.04 . 1 . . . . . 38 ARG H . 16594 1 458 . 1 1 38 38 ARG HA H 1 4.255 0.04 . 1 . . . . . 38 ARG HA . 16594 1 459 . 1 1 38 38 ARG HB2 H 1 1.737 0.04 . 2 . . . . . 38 ARG HB2 . 16594 1 460 . 1 1 38 38 ARG HB3 H 1 1.671 0.04 . 2 . . . . . 38 ARG HB3 . 16594 1 461 . 1 1 38 38 ARG HD2 H 1 3.110 0.04 . 2 . . . . . 38 ARG HD2 . 16594 1 462 . 1 1 38 38 ARG HD3 H 1 3.110 0.04 . 2 . . . . . 38 ARG HD3 . 16594 1 463 . 1 1 38 38 ARG HG2 H 1 1.546 0.04 . 2 . . . . . 38 ARG HG2 . 16594 1 464 . 1 1 38 38 ARG HG3 H 1 1.546 0.04 . 2 . . . . . 38 ARG HG3 . 16594 1 465 . 1 1 38 38 ARG C C 13 175.818 0.4 . 1 . . . . . 38 ARG C . 16594 1 466 . 1 1 38 38 ARG CA C 13 55.350 0.40 . 1 . . . . . 38 ARG CA . 16594 1 467 . 1 1 38 38 ARG CB C 13 31.010 0.40 . 1 . . . . . 38 ARG CB . 16594 1 468 . 1 1 38 38 ARG CD C 13 43.000 0.40 . 1 . . . . . 38 ARG CD . 16594 1 469 . 1 1 38 38 ARG CG C 13 27.300 0.40 . 1 . . . . . 38 ARG CG . 16594 1 470 . 1 1 38 38 ARG N N 15 121.791 0.40 . 1 . . . . . 38 ARG N . 16594 1 471 . 1 1 39 39 ASN H H 1 8.624 0.04 . 1 . . . . . 39 ASN H . 16594 1 472 . 1 1 39 39 ASN HA H 1 4.906 0.04 . 1 . . . . . 39 ASN HA . 16594 1 473 . 1 1 39 39 ASN HB2 H 1 2.841 0.04 . 2 . . . . . 39 ASN HB2 . 16594 1 474 . 1 1 39 39 ASN HB3 H 1 2.666 0.04 . 2 . . . . . 39 ASN HB3 . 16594 1 475 . 1 1 39 39 ASN HD21 H 1 7.646 0.04 . 1 . . . . . 39 ASN HD21 . 16594 1 476 . 1 1 39 39 ASN HD22 H 1 6.958 0.04 . 2 . . . . . 39 ASN HD22 . 16594 1 477 . 1 1 39 39 ASN CA C 13 51.100 0.40 . 1 . . . . . 39 ASN CA . 16594 1 478 . 1 1 39 39 ASN CB C 13 38.560 0.40 . 1 . . . . . 39 ASN CB . 16594 1 479 . 1 1 39 39 ASN N N 15 121.594 0.40 . 1 . . . . . 39 ASN N . 16594 1 480 . 1 1 39 39 ASN ND2 N 15 113.556 0.04 . 1 . . . . . 39 ASN ND2 . 16594 1 481 . 1 1 40 40 PRO HA H 1 4.310 0.04 . 1 . . . . . 40 PRO HA . 16594 1 482 . 1 1 40 40 PRO HB2 H 1 2.221 0.04 . 2 . . . . . 40 PRO HB2 . 16594 1 483 . 1 1 40 40 PRO HB3 H 1 1.917 0.04 . 2 . . . . . 40 PRO HB3 . 16594 1 484 . 1 1 40 40 PRO HD2 H 1 3.759 0.04 . 2 . . . . . 40 PRO HD2 . 16594 1 485 . 1 1 40 40 PRO HD3 H 1 3.721 0.04 . 2 . . . . . 40 PRO HD3 . 16594 1 486 . 1 1 40 40 PRO HG2 H 1 1.956 0.04 . 2 . . . . . 40 PRO HG2 . 16594 1 487 . 1 1 40 40 PRO HG3 H 1 1.956 0.04 . 2 . . . . . 40 PRO HG3 . 16594 1 488 . 1 1 40 40 PRO C C 13 176.896 0.4 . 1 . . . . . 40 PRO C . 16594 1 489 . 1 1 40 40 PRO CA C 13 63.970 0.40 . 1 . . . . . 40 PRO CA . 16594 1 490 . 1 1 40 40 PRO CB C 13 32.210 0.40 . 1 . . . . . 40 PRO CB . 16594 1 491 . 1 1 40 40 PRO CD C 13 50.630 0.40 . 1 . . . . . 40 PRO CD . 16594 1 492 . 1 1 40 40 PRO CG C 13 27.480 0.40 . 1 . . . . . 40 PRO CG . 16594 1 493 . 1 1 41 41 ASP H H 1 8.219 0.04 . 1 . . . . . 41 ASP H . 16594 1 494 . 1 1 41 41 ASP HA H 1 4.516 0.04 . 1 . . . . . 41 ASP HA . 16594 1 495 . 1 1 41 41 ASP HB2 H 1 2.649 0.04 . 2 . . . . . 41 ASP HB2 . 16594 1 496 . 1 1 41 41 ASP HB3 H 1 2.537 0.04 . 2 . . . . . 41 ASP HB3 . 16594 1 497 . 1 1 41 41 ASP C C 13 176.252 0.4 . 1 . . . . . 41 ASP C . 16594 1 498 . 1 1 41 41 ASP CA C 13 54.740 0.40 . 1 . . . . . 41 ASP CA . 16594 1 499 . 1 1 41 41 ASP CB C 13 41.100 0.40 . 1 . . . . . 41 ASP CB . 16594 1 500 . 1 1 41 41 ASP N N 15 118.818 0.40 . 1 . . . . . 41 ASP N . 16594 1 501 . 1 1 42 42 ASP H H 1 7.949 0.04 . 1 . . . . . 42 ASP H . 16594 1 502 . 1 1 42 42 ASP HA H 1 4.516 0.04 . 1 . . . . . 42 ASP HA . 16594 1 503 . 1 1 42 42 ASP HB2 H 1 2.677 0.04 . 2 . . . . . 42 ASP HB2 . 16594 1 504 . 1 1 42 42 ASP HB3 H 1 2.585 0.04 . 2 . . . . . 42 ASP HB3 . 16594 1 505 . 1 1 42 42 ASP C C 13 176.567 0.4 . 1 . . . . . 42 ASP C . 16594 1 506 . 1 1 42 42 ASP CA C 13 54.910 0.40 . 1 . . . . . 42 ASP CA . 16594 1 507 . 1 1 42 42 ASP CB C 13 41.100 0.40 . 1 . . . . . 42 ASP CB . 16594 1 508 . 1 1 42 42 ASP N N 15 120.104 0.40 . 1 . . . . . 42 ASP N . 16594 1 509 . 1 1 43 43 GLU H H 1 8.179 0.04 . 1 . . . . . 43 GLU H . 16594 1 510 . 1 1 43 43 GLU HA H 1 4.153 0.04 . 1 . . . . . 43 GLU HA . 16594 1 511 . 1 1 43 43 GLU HB2 H 1 1.994 0.04 . 2 . . . . . 43 GLU HB2 . 16594 1 512 . 1 1 43 43 GLU HB3 H 1 1.904 0.04 . 2 . . . . . 43 GLU HB3 . 16594 1 513 . 1 1 43 43 GLU HG2 H 1 2.225 0.04 . 2 . . . . . 43 GLU HG2 . 16594 1 514 . 1 1 43 43 GLU HG3 H 1 2.197 0.04 . 2 . . . . . 43 GLU HG3 . 16594 1 515 . 1 1 43 43 GLU C C 13 176.488 0.4 . 1 . . . . . 43 GLU C . 16594 1 516 . 1 1 43 43 GLU CA C 13 57.070 0.40 . 1 . . . . . 43 GLU CA . 16594 1 517 . 1 1 43 43 GLU CB C 13 30.430 0.40 . 1 . . . . . 43 GLU CB . 16594 1 518 . 1 1 43 43 GLU CG C 13 36.430 0.40 . 1 . . . . . 43 GLU CG . 16594 1 519 . 1 1 43 43 GLU N N 15 121.153 0.40 . 1 . . . . . 43 GLU N . 16594 1 520 . 1 1 44 44 ASP H H 1 8.325 0.04 . 1 . . . . . 44 ASP H . 16594 1 521 . 1 1 44 44 ASP HA H 1 4.517 0.04 . 1 . . . . . 44 ASP HA . 16594 1 522 . 1 1 44 44 ASP HB2 H 1 2.667 0.04 . 2 . . . . . 44 ASP HB2 . 16594 1 523 . 1 1 44 44 ASP HB3 H 1 2.576 0.04 . 2 . . . . . 44 ASP HB3 . 16594 1 524 . 1 1 44 44 ASP C C 13 176.462 0.4 . 1 . . . . . 44 ASP C . 16594 1 525 . 1 1 44 44 ASP CA C 13 54.360 0.40 . 1 . . . . . 44 ASP CA . 16594 1 526 . 1 1 44 44 ASP CB C 13 41.030 0.40 . 1 . . . . . 44 ASP CB . 16594 1 527 . 1 1 44 44 ASP N N 15 121.100 0.40 . 1 . . . . . 44 ASP N . 16594 1 528 . 1 1 45 45 ARG H H 1 8.106 0.04 . 1 . . . . . 45 ARG H . 16594 1 529 . 1 1 45 45 ARG HA H 1 4.252 0.04 . 1 . . . . . 45 ARG HA . 16594 1 530 . 1 1 45 45 ARG HB2 H 1 1.838 0.04 . 2 . . . . . 45 ARG HB2 . 16594 1 531 . 1 1 45 45 ARG HB3 H 1 1.702 0.04 . 2 . . . . . 45 ARG HB3 . 16594 1 532 . 1 1 45 45 ARG HD2 H 1 3.123 0.04 . 2 . . . . . 45 ARG HD2 . 16594 1 533 . 1 1 45 45 ARG HD3 H 1 3.123 0.04 . 2 . . . . . 45 ARG HD3 . 16594 1 534 . 1 1 45 45 ARG HG2 H 1 1.575 0.04 . 2 . . . . . 45 ARG HG2 . 16594 1 535 . 1 1 45 45 ARG HG3 H 1 1.575 0.04 . 2 . . . . . 45 ARG HG3 . 16594 1 536 . 1 1 45 45 ARG C C 13 176.475 0.4 . 1 . . . . . 45 ARG C . 16594 1 537 . 1 1 45 45 ARG CA C 13 56.000 0.40 . 1 . . . . . 45 ARG CA . 16594 1 538 . 1 1 45 45 ARG CB C 13 30.360 0.40 . 1 . . . . . 45 ARG CB . 16594 1 539 . 1 1 45 45 ARG CD C 13 43.280 0.40 . 1 . . . . . 45 ARG CD . 16594 1 540 . 1 1 45 45 ARG CG C 13 27.060 0.40 . 1 . . . . . 45 ARG CG . 16594 1 541 . 1 1 45 45 ARG N N 15 121.258 0.40 . 1 . . . . . 45 ARG N . 16594 1 542 . 1 1 46 46 ALA H H 1 8.235 0.04 . 1 . . . . . 46 ALA H . 16594 1 543 . 1 1 46 46 ALA HA H 1 4.220 0.04 . 1 . . . . . 46 ALA HA . 16594 1 544 . 1 1 46 46 ALA HB1 H 1 1.366 0.04 . 1 . . . . . 46 ALA HB . 16594 1 545 . 1 1 46 46 ALA HB2 H 1 1.366 0.04 . 1 . . . . . 46 ALA HB . 16594 1 546 . 1 1 46 46 ALA HB3 H 1 1.366 0.04 . 1 . . . . . 46 ALA HB . 16594 1 547 . 1 1 46 46 ALA C C 13 178.196 0.4 . 1 . . . . . 46 ALA C . 16594 1 548 . 1 1 46 46 ALA CA C 13 53.070 0.40 . 1 . . . . . 46 ALA CA . 16594 1 549 . 1 1 46 46 ALA CB C 13 18.840 0.40 . 1 . . . . . 46 ALA CB . 16594 1 550 . 1 1 46 46 ALA N N 15 124.506 0.40 . 1 . . . . . 46 ALA N . 16594 1 551 . 1 1 47 47 SER H H 1 8.150 0.04 . 1 . . . . . 47 SER H . 16594 1 552 . 1 1 47 47 SER HA H 1 4.331 0.04 . 1 . . . . . 47 SER HA . 16594 1 553 . 1 1 47 47 SER HB2 H 1 3.851 0.04 . 2 . . . . . 47 SER HB2 . 16594 1 554 . 1 1 47 47 SER HB3 H 1 3.819 0.04 . 2 . . . . . 47 SER HB3 . 16594 1 555 . 1 1 47 47 SER C C 13 174.727 0.4 . 1 . . . . . 47 SER C . 16594 1 556 . 1 1 47 47 SER CA C 13 58.820 0.40 . 1 . . . . . 47 SER CA . 16594 1 557 . 1 1 47 47 SER CB C 13 63.520 0.40 . 1 . . . . . 47 SER CB . 16594 1 558 . 1 1 47 47 SER N N 15 114.398 0.40 . 1 . . . . . 47 SER N . 16594 1 559 . 1 1 48 48 GLU H H 1 8.235 0.04 . 1 . . . . . 48 GLU H . 16594 1 560 . 1 1 48 48 GLU HA H 1 4.244 0.04 . 1 . . . . . 48 GLU HA . 16594 1 561 . 1 1 48 48 GLU HB2 H 1 2.028 0.04 . 2 . . . . . 48 GLU HB2 . 16594 1 562 . 1 1 48 48 GLU HB3 H 1 1.838 0.04 . 2 . . . . . 48 GLU HB3 . 16594 1 563 . 1 1 48 48 GLU HG2 H 1 2.211 0.04 . 2 . . . . . 48 GLU HG2 . 16594 1 564 . 1 1 48 48 GLU HG3 H 1 2.211 0.04 . 2 . . . . . 48 GLU HG3 . 16594 1 565 . 1 1 48 48 GLU C C 13 176.396 0.4 . 1 . . . . . 48 GLU C . 16594 1 566 . 1 1 48 48 GLU CA C 13 56.550 0.40 . 1 . . . . . 48 GLU CA . 16594 1 567 . 1 1 48 48 GLU CB C 13 30.330 0.40 . 1 . . . . . 48 GLU CB . 16594 1 568 . 1 1 48 48 GLU CG C 13 36.270 0.40 . 1 . . . . . 48 GLU CG . 16594 1 569 . 1 1 48 48 GLU N N 15 122.340 0.40 . 1 . . . . . 48 GLU N . 16594 1 570 . 1 1 49 49 ARG H H 1 8.174 0.04 . 1 . . . . . 49 ARG H . 16594 1 571 . 1 1 49 49 ARG HA H 1 4.339 0.04 . 1 . . . . . 49 ARG HA . 16594 1 572 . 1 1 49 49 ARG HB2 H 1 1.819 0.04 . 2 . . . . . 49 ARG HB2 . 16594 1 573 . 1 1 49 49 ARG HB3 H 1 1.718 0.04 . 2 . . . . . 49 ARG HB3 . 16594 1 574 . 1 1 49 49 ARG HD2 H 1 3.130 0.04 . 2 . . . . . 49 ARG HD2 . 16594 1 575 . 1 1 49 49 ARG HD3 H 1 3.130 0.04 . 2 . . . . . 49 ARG HD3 . 16594 1 576 . 1 1 49 49 ARG HG2 H 1 1.580 0.04 . 2 . . . . . 49 ARG HG2 . 16594 1 577 . 1 1 49 49 ARG HG3 H 1 1.580 0.04 . 2 . . . . . 49 ARG HG3 . 16594 1 578 . 1 1 49 49 ARG C C 13 176.344 0.4 . 1 . . . . . 49 ARG C . 16594 1 579 . 1 1 49 49 ARG CA C 13 55.900 0.40 . 1 . . . . . 49 ARG CA . 16594 1 580 . 1 1 49 49 ARG CB C 13 30.980 0.40 . 1 . . . . . 49 ARG CB . 16594 1 581 . 1 1 49 49 ARG CD C 13 43.370 0.40 . 1 . . . . . 49 ARG CD . 16594 1 582 . 1 1 49 49 ARG CG C 13 27.060 0.40 . 1 . . . . . 49 ARG CG . 16594 1 583 . 1 1 49 49 ARG N N 15 121.431 0.40 . 1 . . . . . 49 ARG N . 16594 1 584 . 1 1 50 50 SER H H 1 8.389 0.04 . 1 . . . . . 50 SER H . 16594 1 585 . 1 1 50 50 SER HA H 1 4.392 0.04 . 1 . . . . . 50 SER HA . 16594 1 586 . 1 1 50 50 SER HB2 H 1 3.875 0.04 . 2 . . . . . 50 SER HB2 . 16594 1 587 . 1 1 50 50 SER HB3 H 1 3.820 0.04 . 2 . . . . . 50 SER HB3 . 16594 1 588 . 1 1 50 50 SER C C 13 174.517 0.4 . 1 . . . . . 50 SER C . 16594 1 589 . 1 1 50 50 SER CA C 13 58.230 0.40 . 1 . . . . . 50 SER CA . 16594 1 590 . 1 1 50 50 SER CB C 13 64.010 0.40 . 1 . . . . . 50 SER CB . 16594 1 591 . 1 1 50 50 SER N N 15 117.321 0.40 . 1 . . . . . 50 SER N . 16594 1 592 . 1 1 51 51 ASN H H 1 8.488 0.04 . 1 . . . . . 51 ASN H . 16594 1 593 . 1 1 51 51 ASN HA H 1 4.657 0.04 . 1 . . . . . 51 ASN HA . 16594 1 594 . 1 1 51 51 ASN HB2 H 1 2.807 0.04 . 2 . . . . . 51 ASN HB2 . 16594 1 595 . 1 1 51 51 ASN HB3 H 1 2.727 0.04 . 2 . . . . . 51 ASN HB3 . 16594 1 596 . 1 1 51 51 ASN HD21 H 1 7.580 0.04 . 1 . . . . . 51 ASN HD21 . 16594 1 597 . 1 1 51 51 ASN HD22 H 1 6.873 0.04 . 2 . . . . . 51 ASN HD22 . 16594 1 598 . 1 1 51 51 ASN C C 13 175.122 0.4 . 1 . . . . . 51 ASN C . 16594 1 599 . 1 1 51 51 ASN CA C 13 53.780 0.40 . 1 . . . . . 51 ASN CA . 16594 1 600 . 1 1 51 51 ASN CB C 13 38.770 0.40 . 1 . . . . . 51 ASN CB . 16594 1 601 . 1 1 51 51 ASN N N 15 120.903 0.40 . 1 . . . . . 51 ASN N . 16594 1 602 . 1 1 51 51 ASN ND2 N 15 113.009 0.04 . 1 . . . . . 51 ASN ND2 . 16594 1 603 . 1 1 52 52 ASP H H 1 8.231 0.04 . 1 . . . . . 52 ASP H . 16594 1 604 . 1 1 52 52 ASP HA H 1 4.517 0.04 . 1 . . . . . 52 ASP HA . 16594 1 605 . 1 1 52 52 ASP HB2 H 1 2.640 0.04 . 2 . . . . . 52 ASP HB2 . 16594 1 606 . 1 1 52 52 ASP HB3 H 1 2.542 0.04 . 2 . . . . . 52 ASP HB3 . 16594 1 607 . 1 1 52 52 ASP C C 13 176.291 0.4 . 1 . . . . . 52 ASP C . 16594 1 608 . 1 1 52 52 ASP CA C 13 54.500 0.40 . 1 . . . . . 52 ASP CA . 16594 1 609 . 1 1 52 52 ASP CB C 13 41.170 0.40 . 1 . . . . . 52 ASP CB . 16594 1 610 . 1 1 52 52 ASP N N 15 120.236 0.40 . 1 . . . . . 52 ASP N . 16594 1 611 . 1 1 53 53 GLU H H 1 8.139 0.04 . 1 . . . . . 53 GLU H . 16594 1 612 . 1 1 53 53 GLU HA H 1 4.194 0.04 . 1 . . . . . 53 GLU HA . 16594 1 613 . 1 1 53 53 GLU HB2 H 1 1.917 0.04 . 2 . . . . . 53 GLU HB2 . 16594 1 614 . 1 1 53 53 GLU HB3 H 1 1.917 0.04 . 2 . . . . . 53 GLU HB3 . 16594 1 615 . 1 1 53 53 GLU HG2 H 1 2.201 0.04 . 2 . . . . . 53 GLU HG2 . 16594 1 616 . 1 1 53 53 GLU HG3 H 1 2.201 0.04 . 2 . . . . . 53 GLU HG3 . 16594 1 617 . 1 1 53 53 GLU C C 13 176.606 0.4 . 1 . . . . . 53 GLU C . 16594 1 618 . 1 1 53 53 GLU CA C 13 56.930 0.40 . 1 . . . . . 53 GLU CA . 16594 1 619 . 1 1 53 53 GLU CB C 13 30.500 0.40 . 1 . . . . . 53 GLU CB . 16594 1 620 . 1 1 53 53 GLU CG C 13 36.320 0.40 . 1 . . . . . 53 GLU CG . 16594 1 621 . 1 1 53 53 GLU N N 15 120.655 0.40 . 1 . . . . . 53 GLU N . 16594 1 622 . 1 1 54 54 VAL H H 1 8.061 0.04 . 1 . . . . . 54 VAL H . 16594 1 623 . 1 1 54 54 VAL HA H 1 3.978 0.04 . 1 . . . . . 54 VAL HA . 16594 1 624 . 1 1 54 54 VAL HB H 1 2.031 0.04 . 1 . . . . . 54 VAL HB . 16594 1 625 . 1 1 54 54 VAL HG11 H 1 0.864 0.04 . 1 . . . . . 54 VAL HG1 . 16594 1 626 . 1 1 54 54 VAL HG12 H 1 0.864 0.04 . 1 . . . . . 54 VAL HG1 . 16594 1 627 . 1 1 54 54 VAL HG13 H 1 0.864 0.04 . 1 . . . . . 54 VAL HG1 . 16594 1 628 . 1 1 54 54 VAL HG21 H 1 0.893 0.04 . 1 . . . . . 54 VAL HG2 . 16594 1 629 . 1 1 54 54 VAL HG22 H 1 0.893 0.04 . 1 . . . . . 54 VAL HG2 . 16594 1 630 . 1 1 54 54 VAL HG23 H 1 0.893 0.04 . 1 . . . . . 54 VAL HG2 . 16594 1 631 . 1 1 54 54 VAL C C 13 176.278 0.4 . 1 . . . . . 54 VAL C . 16594 1 632 . 1 1 54 54 VAL CA C 13 62.880 0.40 . 1 . . . . . 54 VAL CA . 16594 1 633 . 1 1 54 54 VAL CB C 13 32.660 0.40 . 1 . . . . . 54 VAL CB . 16594 1 634 . 1 1 54 54 VAL CG1 C 13 21.320 0.40 . 1 . . . . . 54 VAL CG1 . 16594 1 635 . 1 1 54 54 VAL CG2 C 13 20.760 0.40 . 1 . . . . . 54 VAL CG2 . 16594 1 636 . 1 1 54 54 VAL N N 15 121.320 0.40 . 1 . . . . . 54 VAL N . 16594 1 637 . 1 1 55 55 LEU H H 1 8.209 0.04 . 1 . . . . . 55 LEU H . 16594 1 638 . 1 1 55 55 LEU HA H 1 4.273 0.04 . 1 . . . . . 55 LEU HA . 16594 1 639 . 1 1 55 55 LEU HB2 H 1 1.617 0.04 . 2 . . . . . 55 LEU HB2 . 16594 1 640 . 1 1 55 55 LEU HB3 H 1 1.504 0.04 . 2 . . . . . 55 LEU HB3 . 16594 1 641 . 1 1 55 55 LEU HD11 H 1 0.846 0.04 . 1 . . . . . 55 LEU HD1 . 16594 1 642 . 1 1 55 55 LEU HD12 H 1 0.846 0.04 . 1 . . . . . 55 LEU HD1 . 16594 1 643 . 1 1 55 55 LEU HD13 H 1 0.846 0.04 . 1 . . . . . 55 LEU HD1 . 16594 1 644 . 1 1 55 55 LEU HD21 H 1 0.787 0.04 . 1 . . . . . 55 LEU HD2 . 16594 1 645 . 1 1 55 55 LEU HD22 H 1 0.787 0.04 . 1 . . . . . 55 LEU HD2 . 16594 1 646 . 1 1 55 55 LEU HD23 H 1 0.787 0.04 . 1 . . . . . 55 LEU HD2 . 16594 1 647 . 1 1 55 55 LEU HG H 1 1.573 0.04 . 1 . . . . . 55 LEU HG . 16594 1 648 . 1 1 55 55 LEU C C 13 177.355 0.4 . 1 . . . . . 55 LEU C . 16594 1 649 . 1 1 55 55 LEU CA C 13 55.290 0.40 . 1 . . . . . 55 LEU CA . 16594 1 650 . 1 1 55 55 LEU CB C 13 42.190 0.40 . 1 . . . . . 55 LEU CB . 16594 1 651 . 1 1 55 55 LEU CD1 C 13 25.230 0.40 . 1 . . . . . 55 LEU CD1 . 16594 1 652 . 1 1 55 55 LEU CD2 C 13 23.490 0.40 . 1 . . . . . 55 LEU CD2 . 16594 1 653 . 1 1 55 55 LEU CG C 13 27.030 0.40 . 1 . . . . . 55 LEU CG . 16594 1 654 . 1 1 55 55 LEU N N 15 125.139 0.40 . 1 . . . . . 55 LEU N . 16594 1 655 . 1 1 56 56 ASP H H 1 8.204 0.04 . 1 . . . . . 56 ASP H . 16594 1 656 . 1 1 56 56 ASP HA H 1 4.516 0.04 . 1 . . . . . 56 ASP HA . 16594 1 657 . 1 1 56 56 ASP HB2 H 1 2.641 0.04 . 2 . . . . . 56 ASP HB2 . 16594 1 658 . 1 1 56 56 ASP HB3 H 1 2.641 0.04 . 2 . . . . . 56 ASP HB3 . 16594 1 659 . 1 1 56 56 ASP C C 13 176.633 0.4 . 1 . . . . . 56 ASP C . 16594 1 660 . 1 1 56 56 ASP CA C 13 54.360 0.40 . 1 . . . . . 56 ASP CA . 16594 1 661 . 1 1 56 56 ASP CB C 13 41.070 0.40 . 1 . . . . . 56 ASP CB . 16594 1 662 . 1 1 56 56 ASP N N 15 121.154 0.40 . 1 . . . . . 56 ASP N . 16594 1 663 . 1 1 57 57 GLU H H 1 8.316 0.04 . 1 . . . . . 57 GLU H . 16594 1 664 . 1 1 57 57 GLU HA H 1 4.164 0.04 . 1 . . . . . 57 GLU HA . 16594 1 665 . 1 1 57 57 GLU HB2 H 1 2.015 0.04 . 2 . . . . . 57 GLU HB2 . 16594 1 666 . 1 1 57 57 GLU HB3 H 1 1.951 0.04 . 2 . . . . . 57 GLU HB3 . 16594 1 667 . 1 1 57 57 GLU HG2 H 1 2.229 0.04 . 2 . . . . . 57 GLU HG2 . 16594 1 668 . 1 1 57 57 GLU HG3 H 1 2.179 0.04 . 2 . . . . . 57 GLU HG3 . 16594 1 669 . 1 1 57 57 GLU C C 13 177.158 0.4 . 1 . . . . . 57 GLU C . 16594 1 670 . 1 1 57 57 GLU CA C 13 57.650 0.40 . 1 . . . . . 57 GLU CA . 16594 1 671 . 1 1 57 57 GLU CB C 13 30.020 0.40 . 1 . . . . . 57 GLU CB . 16594 1 672 . 1 1 57 57 GLU CG C 13 36.350 0.40 . 1 . . . . . 57 GLU CG . 16594 1 673 . 1 1 57 57 GLU N N 15 120.771 0.40 . 1 . . . . . 57 GLU N . 16594 1 674 . 1 1 58 58 LEU H H 1 8.204 0.04 . 1 . . . . . 58 LEU H . 16594 1 675 . 1 1 58 58 LEU HA H 1 4.231 0.04 . 1 . . . . . 58 LEU HA . 16594 1 676 . 1 1 58 58 LEU HB2 H 1 1.665 0.04 . 2 . . . . . 58 LEU HB2 . 16594 1 677 . 1 1 58 58 LEU HB3 H 1 1.554 0.04 . 2 . . . . . 58 LEU HB3 . 16594 1 678 . 1 1 58 58 LEU HD11 H 1 0.851 0.04 . 1 . . . . . 58 LEU HD1 . 16594 1 679 . 1 1 58 58 LEU HD12 H 1 0.851 0.04 . 1 . . . . . 58 LEU HD1 . 16594 1 680 . 1 1 58 58 LEU HD13 H 1 0.851 0.04 . 1 . . . . . 58 LEU HD1 . 16594 1 681 . 1 1 58 58 LEU HD21 H 1 0.790 0.04 . 1 . . . . . 58 LEU HD2 . 16594 1 682 . 1 1 58 58 LEU HD22 H 1 0.790 0.04 . 1 . . . . . 58 LEU HD2 . 16594 1 683 . 1 1 58 58 LEU HD23 H 1 0.790 0.04 . 1 . . . . . 58 LEU HD2 . 16594 1 684 . 1 1 58 58 LEU HG H 1 1.622 0.04 . 1 . . . . . 58 LEU HG . 16594 1 685 . 1 1 58 58 LEU C C 13 178.538 0.4 . 1 . . . . . 58 LEU C . 16594 1 686 . 1 1 58 58 LEU CA C 13 55.690 0.40 . 1 . . . . . 58 LEU CA . 16594 1 687 . 1 1 58 58 LEU CB C 13 42.230 0.40 . 1 . . . . . 58 LEU CB . 16594 1 688 . 1 1 58 58 LEU CD1 C 13 25.040 0.40 . 1 . . . . . 58 LEU CD1 . 16594 1 689 . 1 1 58 58 LEU CD2 C 13 23.700 0.40 . 1 . . . . . 58 LEU CD2 . 16594 1 690 . 1 1 58 58 LEU CG C 13 27.020 0.40 . 1 . . . . . 58 LEU CG . 16594 1 691 . 1 1 58 58 LEU N N 15 120.716 0.40 . 1 . . . . . 58 LEU N . 16594 1 692 . 1 1 59 59 GLY H H 1 8.212 0.04 . 1 . . . . . 59 GLY H . 16594 1 693 . 1 1 59 59 GLY HA2 H 1 3.917 0.04 . 2 . . . . . 59 GLY HA2 . 16594 1 694 . 1 1 59 59 GLY HA3 H 1 3.917 0.04 . 2 . . . . . 59 GLY HA3 . 16594 1 695 . 1 1 59 59 GLY C C 13 174.294 0.4 . 1 . . . . . 59 GLY C . 16594 1 696 . 1 1 59 59 GLY CA C 13 45.550 0.40 . 1 . . . . . 59 GLY CA . 16594 1 697 . 1 1 59 59 GLY N N 15 108.670 0.40 . 1 . . . . . 59 GLY N . 16594 1 698 . 1 1 60 60 GLN H H 1 8.310 0.04 . 1 . . . . . 60 GLN H . 16594 1 699 . 1 1 60 60 GLN HA H 1 4.079 0.04 . 1 . . . . . 60 GLN HA . 16594 1 700 . 1 1 60 60 GLN HB2 H 1 2.046 0.04 . 2 . . . . . 60 GLN HB2 . 16594 1 701 . 1 1 60 60 GLN HB3 H 1 2.046 0.04 . 2 . . . . . 60 GLN HB3 . 16594 1 702 . 1 1 60 60 GLN HE21 H 1 7.621 0.04 . 1 . . . . . 60 GLN HE21 . 16594 1 703 . 1 1 60 60 GLN HE22 H 1 6.780 0.04 . 2 . . . . . 60 GLN HE22 . 16594 1 704 . 1 1 60 60 GLN HG2 H 1 2.343 0.04 . 2 . . . . . 60 GLN HG2 . 16594 1 705 . 1 1 60 60 GLN HG3 H 1 2.319 0.04 . 2 . . . . . 60 GLN HG3 . 16594 1 706 . 1 1 60 60 GLN C C 13 177.171 0.4 . 1 . . . . . 60 GLN C . 16594 1 707 . 1 1 60 60 GLN CA C 13 57.590 0.40 . 1 . . . . . 60 GLN CA . 16594 1 708 . 1 1 60 60 GLN CB C 13 28.960 0.40 . 1 . . . . . 60 GLN CB . 16594 1 709 . 1 1 60 60 GLN CG C 13 33.720 0.40 . 1 . . . . . 60 GLN CG . 16594 1 710 . 1 1 60 60 GLN N N 15 120.662 0.40 . 1 . . . . . 60 GLN N . 16594 1 711 . 1 1 60 60 GLN NE2 N 15 113.419 0.04 . 1 . . . . . 60 GLN NE2 . 16594 1 712 . 1 1 61 61 VAL H H 1 8.136 0.04 . 1 . . . . . 61 VAL H . 16594 1 713 . 1 1 61 61 VAL HA H 1 3.971 0.04 . 1 . . . . . 61 VAL HA . 16594 1 714 . 1 1 61 61 VAL HB H 1 2.073 0.04 . 1 . . . . . 61 VAL HB . 16594 1 715 . 1 1 61 61 VAL HG11 H 1 0.941 0.04 . 1 . . . . . 61 VAL HG1 . 16594 1 716 . 1 1 61 61 VAL HG12 H 1 0.941 0.04 . 1 . . . . . 61 VAL HG1 . 16594 1 717 . 1 1 61 61 VAL HG13 H 1 0.941 0.04 . 1 . . . . . 61 VAL HG1 . 16594 1 718 . 1 1 61 61 VAL HG21 H 1 0.994 0.04 . 1 . . . . . 61 VAL HG2 . 16594 1 719 . 1 1 61 61 VAL HG22 H 1 0.994 0.04 . 1 . . . . . 61 VAL HG2 . 16594 1 720 . 1 1 61 61 VAL HG23 H 1 0.994 0.04 . 1 . . . . . 61 VAL HG2 . 16594 1 721 . 1 1 61 61 VAL C C 13 178.262 0.4 . 1 . . . . . 61 VAL C . 16594 1 722 . 1 1 61 61 VAL CA C 13 64.420 0.40 . 1 . . . . . 61 VAL CA . 16594 1 723 . 1 1 61 61 VAL CB C 13 32.110 0.40 . 1 . . . . . 61 VAL CB . 16594 1 724 . 1 1 61 61 VAL CG1 C 13 20.750 0.40 . 1 . . . . . 61 VAL CG1 . 16594 1 725 . 1 1 61 61 VAL CG2 C 13 21.590 0.40 . 1 . . . . . 61 VAL CG2 . 16594 1 726 . 1 1 61 61 VAL N N 15 119.154 0.40 . 1 . . . . . 61 VAL N . 16594 1 727 . 1 1 62 62 GLY H H 1 8.183 0.04 . 1 . . . . . 62 GLY H . 16594 1 728 . 1 1 62 62 GLY HA2 H 1 3.966 0.04 . 2 . . . . . 62 GLY HA2 . 16594 1 729 . 1 1 62 62 GLY HA3 H 1 3.783 0.04 . 2 . . . . . 62 GLY HA3 . 16594 1 730 . 1 1 62 62 GLY C C 13 174.872 0.4 . 1 . . . . . 62 GLY C . 16594 1 731 . 1 1 62 62 GLY CA C 13 46.780 0.40 . 1 . . . . . 62 GLY CA . 16594 1 732 . 1 1 62 62 GLY N N 15 110.813 0.40 . 1 . . . . . 62 GLY N . 16594 1 733 . 1 1 63 63 GLN H H 1 8.235 0.04 . 1 . . . . . 63 GLN H . 16594 1 734 . 1 1 63 63 GLN HA H 1 3.966 0.04 . 1 . . . . . 63 GLN HA . 16594 1 735 . 1 1 63 63 GLN HB2 H 1 2.095 0.04 . 2 . . . . . 63 GLN HB2 . 16594 1 736 . 1 1 63 63 GLN HB3 H 1 2.020 0.04 . 2 . . . . . 63 GLN HB3 . 16594 1 737 . 1 1 63 63 GLN HE21 H 1 7.359 0.04 . 1 . . . . . 63 GLN HE21 . 16594 1 738 . 1 1 63 63 GLN HE22 H 1 6.773 0.04 . 2 . . . . . 63 GLN HE22 . 16594 1 739 . 1 1 63 63 GLN HG2 H 1 2.356 0.04 . 2 . . . . . 63 GLN HG2 . 16594 1 740 . 1 1 63 63 GLN HG3 H 1 2.307 0.04 . 2 . . . . . 63 GLN HG3 . 16594 1 741 . 1 1 63 63 GLN C C 13 178.170 0.4 . 1 . . . . . 63 GLN C . 16594 1 742 . 1 1 63 63 GLN CA C 13 58.990 0.40 . 1 . . . . . 63 GLN CA . 16594 1 743 . 1 1 63 63 GLN CB C 13 28.500 0.40 . 1 . . . . . 63 GLN CB . 16594 1 744 . 1 1 63 63 GLN CG C 13 33.750 0.40 . 1 . . . . . 63 GLN CG . 16594 1 745 . 1 1 63 63 GLN N N 15 120.667 0.40 . 1 . . . . . 63 GLN N . 16594 1 746 . 1 1 63 63 GLN NE2 N 15 111.600 0.04 . 1 . . . . . 63 GLN NE2 . 16594 1 747 . 1 1 64 64 ASP H H 1 8.386 0.04 . 1 . . . . . 64 ASP H . 16594 1 748 . 1 1 64 64 ASP HA H 1 4.347 0.04 . 1 . . . . . 64 ASP HA . 16594 1 749 . 1 1 64 64 ASP HB2 H 1 2.731 0.04 . 2 . . . . . 64 ASP HB2 . 16594 1 750 . 1 1 64 64 ASP HB3 H 1 2.592 0.04 . 2 . . . . . 64 ASP HB3 . 16594 1 751 . 1 1 64 64 ASP C C 13 178.669 0.4 . 1 . . . . . 64 ASP C . 16594 1 752 . 1 1 64 64 ASP CA C 13 56.860 0.40 . 1 . . . . . 64 ASP CA . 16594 1 753 . 1 1 64 64 ASP CB C 13 39.970 0.40 . 1 . . . . . 64 ASP CB . 16594 1 754 . 1 1 64 64 ASP N N 15 120.058 0.40 . 1 . . . . . 64 ASP N . 16594 1 755 . 1 1 65 65 GLU H H 1 7.992 0.04 . 1 . . . . . 65 GLU H . 16594 1 756 . 1 1 65 65 GLU HA H 1 3.542 0.04 . 1 . . . . . 65 GLU HA . 16594 1 757 . 1 1 65 65 GLU HB2 H 1 1.906 0.04 . 2 . . . . . 65 GLU HB2 . 16594 1 758 . 1 1 65 65 GLU HB3 H 1 1.835 0.04 . 2 . . . . . 65 GLU HB3 . 16594 1 759 . 1 1 65 65 GLU HG2 H 1 1.798 0.04 . 2 . . . . . 65 GLU HG2 . 16594 1 760 . 1 1 65 65 GLU HG3 H 1 1.798 0.04 . 2 . . . . . 65 GLU HG3 . 16594 1 761 . 1 1 65 65 GLU C C 13 177.842 0.4 . 1 . . . . . 65 GLU C . 16594 1 762 . 1 1 65 65 GLU CA C 13 59.560 0.40 . 1 . . . . . 65 GLU CA . 16594 1 763 . 1 1 65 65 GLU CB C 13 29.100 0.40 . 1 . . . . . 65 GLU CB . 16594 1 764 . 1 1 65 65 GLU CG C 13 36.050 0.40 . 1 . . . . . 65 GLU CG . 16594 1 765 . 1 1 65 65 GLU N N 15 123.846 0.40 . 1 . . . . . 65 GLU N . 16594 1 766 . 1 1 66 66 LEU H H 1 8.100 0.04 . 1 . . . . . 66 LEU H . 16594 1 767 . 1 1 66 66 LEU HA H 1 3.783 0.04 . 1 . . . . . 66 LEU HA . 16594 1 768 . 1 1 66 66 LEU HB2 H 1 1.681 0.04 . 2 . . . . . 66 LEU HB2 . 16594 1 769 . 1 1 66 66 LEU HB3 H 1 1.626 0.04 . 2 . . . . . 66 LEU HB3 . 16594 1 770 . 1 1 66 66 LEU HD11 H 1 0.785 0.04 . 1 . . . . . 66 LEU HD1 . 16594 1 771 . 1 1 66 66 LEU HD12 H 1 0.785 0.04 . 1 . . . . . 66 LEU HD1 . 16594 1 772 . 1 1 66 66 LEU HD13 H 1 0.785 0.04 . 1 . . . . . 66 LEU HD1 . 16594 1 773 . 1 1 66 66 LEU HD21 H 1 0.766 0.04 . 1 . . . . . 66 LEU HD2 . 16594 1 774 . 1 1 66 66 LEU HD22 H 1 0.766 0.04 . 1 . . . . . 66 LEU HD2 . 16594 1 775 . 1 1 66 66 LEU HD23 H 1 0.766 0.04 . 1 . . . . . 66 LEU HD2 . 16594 1 776 . 1 1 66 66 LEU HG H 1 1.612 0.04 . 1 . . . . . 66 LEU HG . 16594 1 777 . 1 1 66 66 LEU C C 13 178.893 0.4 . 1 . . . . . 66 LEU C . 16594 1 778 . 1 1 66 66 LEU CA C 13 58.610 0.40 . 1 . . . . . 66 LEU CA . 16594 1 779 . 1 1 66 66 LEU CB C 13 41.510 0.40 . 1 . . . . . 66 LEU CB . 16594 1 780 . 1 1 66 66 LEU CD1 C 13 24.780 0.40 . 1 . . . . . 66 LEU CD1 . 16594 1 781 . 1 1 66 66 LEU CD2 C 13 25.630 0.40 . 1 . . . . . 66 LEU CD2 . 16594 1 782 . 1 1 66 66 LEU CG C 13 26.770 0.40 . 1 . . . . . 66 LEU CG . 16594 1 783 . 1 1 66 66 LEU N N 15 119.444 0.40 . 1 . . . . . 66 LEU N . 16594 1 784 . 1 1 67 67 ARG H H 1 7.870 0.04 . 1 . . . . . 67 ARG H . 16594 1 785 . 1 1 67 67 ARG HA H 1 4.095 0.04 . 1 . . . . . 67 ARG HA . 16594 1 786 . 1 1 67 67 ARG HB2 H 1 1.906 0.04 . 2 . . . . . 67 ARG HB2 . 16594 1 787 . 1 1 67 67 ARG HB3 H 1 1.859 0.04 . 2 . . . . . 67 ARG HB3 . 16594 1 788 . 1 1 67 67 ARG HD2 H 1 3.229 0.04 . 2 . . . . . 67 ARG HD2 . 16594 1 789 . 1 1 67 67 ARG HD3 H 1 3.191 0.04 . 2 . . . . . 67 ARG HD3 . 16594 1 790 . 1 1 67 67 ARG HG2 H 1 1.659 0.04 . 2 . . . . . 67 ARG HG2 . 16594 1 791 . 1 1 67 67 ARG HG3 H 1 1.659 0.04 . 2 . . . . . 67 ARG HG3 . 16594 1 792 . 1 1 67 67 ARG C C 13 179.484 0.4 . 1 . . . . . 67 ARG C . 16594 1 793 . 1 1 67 67 ARG CA C 13 59.490 0.40 . 1 . . . . . 67 ARG CA . 16594 1 794 . 1 1 67 67 ARG CB C 13 30.230 0.40 . 1 . . . . . 67 ARG CB . 16594 1 795 . 1 1 67 67 ARG CD C 13 43.470 0.40 . 1 . . . . . 67 ARG CD . 16594 1 796 . 1 1 67 67 ARG CG C 13 28.050 0.40 . 1 . . . . . 67 ARG CG . 16594 1 797 . 1 1 67 67 ARG N N 15 118.088 0.40 . 1 . . . . . 67 ARG N . 16594 1 798 . 1 1 68 68 ALA H H 1 7.820 0.04 . 1 . . . . . 68 ALA H . 16594 1 799 . 1 1 68 68 ALA HA H 1 4.188 0.04 . 1 . . . . . 68 ALA HA . 16594 1 800 . 1 1 68 68 ALA HB1 H 1 1.308 0.04 . 1 . . . . . 68 ALA HB . 16594 1 801 . 1 1 68 68 ALA HB2 H 1 1.308 0.04 . 1 . . . . . 68 ALA HB . 16594 1 802 . 1 1 68 68 ALA HB3 H 1 1.308 0.04 . 1 . . . . . 68 ALA HB . 16594 1 803 . 1 1 68 68 ALA C C 13 181.626 0.4 . 1 . . . . . 68 ALA C . 16594 1 804 . 1 1 68 68 ALA CA C 13 54.840 0.40 . 1 . . . . . 68 ALA CA . 16594 1 805 . 1 1 68 68 ALA CB C 13 18.400 0.40 . 1 . . . . . 68 ALA CB . 16594 1 806 . 1 1 68 68 ALA N N 15 123.318 0.40 . 1 . . . . . 68 ALA N . 16594 1 807 . 1 1 69 69 ILE H H 1 8.643 0.04 . 1 . . . . . 69 ILE H . 16594 1 808 . 1 1 69 69 ILE HA H 1 3.539 0.04 . 1 . . . . . 69 ILE HA . 16594 1 809 . 1 1 69 69 ILE HB H 1 1.882 0.04 . 1 . . . . . 69 ILE HB . 16594 1 810 . 1 1 69 69 ILE HD11 H 1 0.766 0.04 . 1 . . . . . 69 ILE HD1 . 16594 1 811 . 1 1 69 69 ILE HD12 H 1 0.766 0.04 . 1 . . . . . 69 ILE HD1 . 16594 1 812 . 1 1 69 69 ILE HD13 H 1 0.766 0.04 . 1 . . . . . 69 ILE HD1 . 16594 1 813 . 1 1 69 69 ILE HG12 H 1 1.570 0.04 . 2 . . . . . 69 ILE HG12 . 16594 1 814 . 1 1 69 69 ILE HG13 H 1 0.775 0.04 . 2 . . . . . 69 ILE HG13 . 16594 1 815 . 1 1 69 69 ILE HG21 H 1 0.897 0.04 . 1 . . . . . 69 ILE HG2 . 16594 1 816 . 1 1 69 69 ILE HG22 H 1 0.897 0.04 . 1 . . . . . 69 ILE HG2 . 16594 1 817 . 1 1 69 69 ILE HG23 H 1 0.897 0.04 . 1 . . . . . 69 ILE HG2 . 16594 1 818 . 1 1 69 69 ILE C C 13 177.290 0.4 . 1 . . . . . 69 ILE C . 16594 1 819 . 1 1 69 69 ILE CA C 13 66.370 0.40 . 1 . . . . . 69 ILE CA . 16594 1 820 . 1 1 69 69 ILE CB C 13 38.090 0.40 . 1 . . . . . 69 ILE CB . 16594 1 821 . 1 1 69 69 ILE CD1 C 13 14.680 0.40 . 1 . . . . . 69 ILE CD1 . 16594 1 822 . 1 1 69 69 ILE CG1 C 13 30.320 0.40 . 1 . . . . . 69 ILE CG1 . 16594 1 823 . 1 1 69 69 ILE CG2 C 13 17.810 0.40 . 1 . . . . . 69 ILE CG2 . 16594 1 824 . 1 1 69 69 ILE N N 15 122.954 0.40 . 1 . . . . . 69 ILE N . 16594 1 825 . 1 1 70 70 ASP H H 1 8.415 0.04 . 1 . . . . . 70 ASP H . 16594 1 826 . 1 1 70 70 ASP HA H 1 4.336 0.04 . 1 . . . . . 70 ASP HA . 16594 1 827 . 1 1 70 70 ASP HB2 H 1 2.821 0.04 . 2 . . . . . 70 ASP HB2 . 16594 1 828 . 1 1 70 70 ASP HB3 H 1 2.585 0.04 . 2 . . . . . 70 ASP HB3 . 16594 1 829 . 1 1 70 70 ASP C C 13 179.786 0.4 . 1 . . . . . 70 ASP C . 16594 1 830 . 1 1 70 70 ASP CA C 13 58.130 0.40 . 1 . . . . . 70 ASP CA . 16594 1 831 . 1 1 70 70 ASP CB C 13 40.310 0.40 . 1 . . . . . 70 ASP CB . 16594 1 832 . 1 1 70 70 ASP N N 15 121.571 0.40 . 1 . . . . . 70 ASP N . 16594 1 833 . 1 1 71 71 ALA H H 1 7.869 0.04 . 1 . . . . . 71 ALA H . 16594 1 834 . 1 1 71 71 ALA HA H 1 4.215 0.04 . 1 . . . . . 71 ALA HA . 16594 1 835 . 1 1 71 71 ALA HB1 H 1 1.495 0.04 . 1 . . . . . 71 ALA HB . 16594 1 836 . 1 1 71 71 ALA HB2 H 1 1.495 0.04 . 1 . . . . . 71 ALA HB . 16594 1 837 . 1 1 71 71 ALA HB3 H 1 1.495 0.04 . 1 . . . . . 71 ALA HB . 16594 1 838 . 1 1 71 71 ALA C C 13 180.246 0.4 . 1 . . . . . 71 ALA C . 16594 1 839 . 1 1 71 71 ALA CA C 13 54.500 0.40 . 1 . . . . . 71 ALA CA . 16594 1 840 . 1 1 71 71 ALA CB C 13 17.680 0.40 . 1 . . . . . 71 ALA CB . 16594 1 841 . 1 1 71 71 ALA N N 15 121.459 0.40 . 1 . . . . . 71 ALA N . 16594 1 842 . 1 1 72 72 ALA H H 1 8.263 0.04 . 1 . . . . . 72 ALA H . 16594 1 843 . 1 1 72 72 ALA HA H 1 4.045 0.04 . 1 . . . . . 72 ALA HA . 16594 1 844 . 1 1 72 72 ALA HB1 H 1 1.753 0.04 . 1 . . . . . 72 ALA HB . 16594 1 845 . 1 1 72 72 ALA HB2 H 1 1.753 0.04 . 1 . . . . . 72 ALA HB . 16594 1 846 . 1 1 72 72 ALA HB3 H 1 1.753 0.04 . 1 . . . . . 72 ALA HB . 16594 1 847 . 1 1 72 72 ALA C C 13 179.668 0.4 . 1 . . . . . 72 ALA C . 16594 1 848 . 1 1 72 72 ALA CA C 13 55.560 0.40 . 1 . . . . . 72 ALA CA . 16594 1 849 . 1 1 72 72 ALA CB C 13 19.870 0.40 . 1 . . . . . 72 ALA CB . 16594 1 850 . 1 1 72 72 ALA N N 15 123.378 0.40 . 1 . . . . . 72 ALA N . 16594 1 851 . 1 1 73 73 LEU H H 1 8.790 0.04 . 1 . . . . . 73 LEU H . 16594 1 852 . 1 1 73 73 LEU HA H 1 3.920 0.04 . 1 . . . . . 73 LEU HA . 16594 1 853 . 1 1 73 73 LEU HB2 H 1 2.026 0.04 . 2 . . . . . 73 LEU HB2 . 16594 1 854 . 1 1 73 73 LEU HB3 H 1 1.382 0.04 . 2 . . . . . 73 LEU HB3 . 16594 1 855 . 1 1 73 73 LEU HD11 H 1 0.767 0.04 . 1 . . . . . 73 LEU HD1 . 16594 1 856 . 1 1 73 73 LEU HD12 H 1 0.767 0.04 . 1 . . . . . 73 LEU HD1 . 16594 1 857 . 1 1 73 73 LEU HD13 H 1 0.767 0.04 . 1 . . . . . 73 LEU HD1 . 16594 1 858 . 1 1 73 73 LEU HD21 H 1 0.860 0.04 . 1 . . . . . 73 LEU HD2 . 16594 1 859 . 1 1 73 73 LEU HD22 H 1 0.860 0.04 . 1 . . . . . 73 LEU HD2 . 16594 1 860 . 1 1 73 73 LEU HD23 H 1 0.860 0.04 . 1 . . . . . 73 LEU HD2 . 16594 1 861 . 1 1 73 73 LEU HG H 1 1.708 0.04 . 1 . . . . . 73 LEU HG . 16594 1 862 . 1 1 73 73 LEU C C 13 180.286 0.4 . 1 . . . . . 73 LEU C . 16594 1 863 . 1 1 73 73 LEU CA C 13 58.130 0.40 . 1 . . . . . 73 LEU CA . 16594 1 864 . 1 1 73 73 LEU CB C 13 41.200 0.40 . 1 . . . . . 73 LEU CB . 16594 1 865 . 1 1 73 73 LEU CD1 C 13 26.360 0.40 . 1 . . . . . 73 LEU CD1 . 16594 1 866 . 1 1 73 73 LEU CD2 C 13 23.970 0.40 . 1 . . . . . 73 LEU CD2 . 16594 1 867 . 1 1 73 73 LEU CG C 13 27.560 0.40 . 1 . . . . . 73 LEU CG . 16594 1 868 . 1 1 73 73 LEU N N 15 119.015 0.40 . 1 . . . . . 73 LEU N . 16594 1 869 . 1 1 74 74 ALA H H 1 7.931 0.04 . 1 . . . . . 74 ALA H . 16594 1 870 . 1 1 74 74 ALA HA H 1 4.273 0.04 . 1 . . . . . 74 ALA HA . 16594 1 871 . 1 1 74 74 ALA HB1 H 1 1.506 0.04 . 1 . . . . . 74 ALA HB . 16594 1 872 . 1 1 74 74 ALA HB2 H 1 1.506 0.04 . 1 . . . . . 74 ALA HB . 16594 1 873 . 1 1 74 74 ALA HB3 H 1 1.506 0.04 . 1 . . . . . 74 ALA HB . 16594 1 874 . 1 1 74 74 ALA C C 13 180.811 0.4 . 1 . . . . . 74 ALA C . 16594 1 875 . 1 1 74 74 ALA CA C 13 54.960 0.40 . 1 . . . . . 74 ALA CA . 16594 1 876 . 1 1 74 74 ALA CB C 13 17.690 0.40 . 1 . . . . . 74 ALA CB . 16594 1 877 . 1 1 74 74 ALA N N 15 124.135 0.40 . 1 . . . . . 74 ALA N . 16594 1 878 . 1 1 75 75 ARG H H 1 7.898 0.04 . 1 . . . . . 75 ARG H . 16594 1 879 . 1 1 75 75 ARG HA H 1 4.138 0.04 . 1 . . . . . 75 ARG HA . 16594 1 880 . 1 1 75 75 ARG HB2 H 1 2.415 0.04 . 2 . . . . . 75 ARG HB2 . 16594 1 881 . 1 1 75 75 ARG HB3 H 1 1.511 0.04 . 2 . . . . . 75 ARG HB3 . 16594 1 882 . 1 1 75 75 ARG HD2 H 1 3.297 0.04 . 2 . . . . . 75 ARG HD2 . 16594 1 883 . 1 1 75 75 ARG HD3 H 1 2.950 0.04 . 2 . . . . . 75 ARG HD3 . 16594 1 884 . 1 1 75 75 ARG HG2 H 1 2.092 0.04 . 2 . . . . . 75 ARG HG2 . 16594 1 885 . 1 1 75 75 ARG HG3 H 1 1.231 0.04 . 2 . . . . . 75 ARG HG3 . 16594 1 886 . 1 1 75 75 ARG C C 13 179.721 0.4 . 1 . . . . . 75 ARG C . 16594 1 887 . 1 1 75 75 ARG CA C 13 60.170 0.40 . 1 . . . . . 75 ARG CA . 16594 1 888 . 1 1 75 75 ARG CB C 13 29.970 0.40 . 1 . . . . . 75 ARG CB . 16594 1 889 . 1 1 75 75 ARG CD C 13 44.580 0.40 . 1 . . . . . 75 ARG CD . 16594 1 890 . 1 1 75 75 ARG CG C 13 28.840 0.40 . 1 . . . . . 75 ARG CG . 16594 1 891 . 1 1 75 75 ARG N N 15 120.143 0.40 . 1 . . . . . 75 ARG N . 16594 1 892 . 1 1 76 76 ILE H H 1 8.061 0.04 . 1 . . . . . 76 ILE H . 16594 1 893 . 1 1 76 76 ILE HA H 1 3.697 0.04 . 1 . . . . . 76 ILE HA . 16594 1 894 . 1 1 76 76 ILE HB H 1 1.969 0.04 . 1 . . . . . 76 ILE HB . 16594 1 895 . 1 1 76 76 ILE HD11 H 1 0.188 0.04 . 1 . . . . . 76 ILE HD1 . 16594 1 896 . 1 1 76 76 ILE HD12 H 1 0.188 0.04 . 1 . . . . . 76 ILE HD1 . 16594 1 897 . 1 1 76 76 ILE HD13 H 1 0.188 0.04 . 1 . . . . . 76 ILE HD1 . 16594 1 898 . 1 1 76 76 ILE HG12 H 1 1.596 0.04 . 2 . . . . . 76 ILE HG12 . 16594 1 899 . 1 1 76 76 ILE HG13 H 1 0.252 0.04 . 2 . . . . . 76 ILE HG13 . 16594 1 900 . 1 1 76 76 ILE HG21 H 1 0.698 0.04 . 1 . . . . . 76 ILE HG2 . 16594 1 901 . 1 1 76 76 ILE HG22 H 1 0.698 0.04 . 1 . . . . . 76 ILE HG2 . 16594 1 902 . 1 1 76 76 ILE HG23 H 1 0.698 0.04 . 1 . . . . . 76 ILE HG2 . 16594 1 903 . 1 1 76 76 ILE C C 13 179.392 0.4 . 1 . . . . . 76 ILE C . 16594 1 904 . 1 1 76 76 ILE CA C 13 66.060 0.40 . 1 . . . . . 76 ILE CA . 16594 1 905 . 1 1 76 76 ILE CB C 13 37.240 0.40 . 1 . . . . . 76 ILE CB . 16594 1 906 . 1 1 76 76 ILE CD1 C 13 12.900 0.40 . 1 . . . . . 76 ILE CD1 . 16594 1 907 . 1 1 76 76 ILE CG1 C 13 30.900 0.40 . 1 . . . . . 76 ILE CG1 . 16594 1 908 . 1 1 76 76 ILE CG2 C 13 16.480 0.40 . 1 . . . . . 76 ILE CG2 . 16594 1 909 . 1 1 76 76 ILE N N 15 121.537 0.40 . 1 . . . . . 76 ILE N . 16594 1 910 . 1 1 77 77 ALA H H 1 7.735 0.04 . 1 . . . . . 77 ALA H . 16594 1 911 . 1 1 77 77 ALA HA H 1 4.132 0.04 . 1 . . . . . 77 ALA HA . 16594 1 912 . 1 1 77 77 ALA HB1 H 1 1.506 0.04 . 1 . . . . . 77 ALA HB . 16594 1 913 . 1 1 77 77 ALA HB2 H 1 1.506 0.04 . 1 . . . . . 77 ALA HB . 16594 1 914 . 1 1 77 77 ALA HB3 H 1 1.506 0.04 . 1 . . . . . 77 ALA HB . 16594 1 915 . 1 1 77 77 ALA C C 13 179.326 0.4 . 1 . . . . . 77 ALA C . 16594 1 916 . 1 1 77 77 ALA CA C 13 54.910 0.40 . 1 . . . . . 77 ALA CA . 16594 1 917 . 1 1 77 77 ALA CB C 13 17.950 0.40 . 1 . . . . . 77 ALA CB . 16594 1 918 . 1 1 77 77 ALA N N 15 122.664 0.40 . 1 . . . . . 77 ALA N . 16594 1 919 . 1 1 78 78 SER H H 1 7.999 0.04 . 1 . . . . . 78 SER H . 16594 1 920 . 1 1 78 78 SER HA H 1 4.472 0.04 . 1 . . . . . 78 SER HA . 16594 1 921 . 1 1 78 78 SER HB2 H 1 4.074 0.04 . 2 . . . . . 78 SER HB2 . 16594 1 922 . 1 1 78 78 SER HB3 H 1 3.950 0.04 . 2 . . . . . 78 SER HB3 . 16594 1 923 . 1 1 78 78 SER C C 13 174.675 0.4 . 1 . . . . . 78 SER C . 16594 1 924 . 1 1 78 78 SER CA C 13 59.260 0.40 . 1 . . . . . 78 SER CA . 16594 1 925 . 1 1 78 78 SER CB C 13 64.070 0.40 . 1 . . . . . 78 SER CB . 16594 1 926 . 1 1 78 78 SER N N 15 111.061 0.40 . 1 . . . . . 78 SER N . 16594 1 927 . 1 1 79 79 GLY H H 1 7.844 0.04 . 1 . . . . . 79 GLY H . 16594 1 928 . 1 1 79 79 GLY HA2 H 1 4.233 0.04 . 2 . . . . . 79 GLY HA2 . 16594 1 929 . 1 1 79 79 GLY HA3 H 1 4.087 0.04 . 2 . . . . . 79 GLY HA3 . 16594 1 930 . 1 1 79 79 GLY C C 13 175.687 0.4 . 1 . . . . . 79 GLY C . 16594 1 931 . 1 1 79 79 GLY CA C 13 46.470 0.40 . 1 . . . . . 79 GLY CA . 16594 1 932 . 1 1 79 79 GLY N N 15 109.909 0.40 . 1 . . . . . 79 GLY N . 16594 1 933 . 1 1 80 80 THR H H 1 8.408 0.04 . 1 . . . . . 80 THR H . 16594 1 934 . 1 1 80 80 THR HA H 1 4.504 0.04 . 1 . . . . . 80 THR HA . 16594 1 935 . 1 1 80 80 THR HB H 1 4.395 0.04 . 1 . . . . . 80 THR HB . 16594 1 936 . 1 1 80 80 THR HG21 H 1 1.011 0.04 . 1 . . . . . 80 THR HG2 . 16594 1 937 . 1 1 80 80 THR HG22 H 1 1.011 0.04 . 1 . . . . . 80 THR HG2 . 16594 1 938 . 1 1 80 80 THR HG23 H 1 1.011 0.04 . 1 . . . . . 80 THR HG2 . 16594 1 939 . 1 1 80 80 THR C C 13 174.793 0.4 . 1 . . . . . 80 THR C . 16594 1 940 . 1 1 80 80 THR CA C 13 60.280 0.40 . 1 . . . . . 80 THR CA . 16594 1 941 . 1 1 80 80 THR CB C 13 69.000 0.40 . 1 . . . . . 80 THR CB . 16594 1 942 . 1 1 80 80 THR CG2 C 13 21.800 0.40 . 1 . . . . . 80 THR CG2 . 16594 1 943 . 1 1 80 80 THR N N 15 109.416 0.40 . 1 . . . . . 80 THR N . 16594 1 944 . 1 1 81 81 PHE H H 1 7.610 0.04 . 1 . . . . . 81 PHE H . 16594 1 945 . 1 1 81 81 PHE HA H 1 3.944 0.04 . 1 . . . . . 81 PHE HA . 16594 1 946 . 1 1 81 81 PHE HB2 H 1 2.930 0.04 . 2 . . . . . 81 PHE HB2 . 16594 1 947 . 1 1 81 81 PHE HB3 H 1 2.539 0.04 . 2 . . . . . 81 PHE HB3 . 16594 1 948 . 1 1 81 81 PHE HD1 H 1 6.926 0.04 . 1 . . . . . 81 PHE HD1 . 16594 1 949 . 1 1 81 81 PHE HD2 H 1 6.926 0.04 . 1 . . . . . 81 PHE HD2 . 16594 1 950 . 1 1 81 81 PHE C C 13 176.462 0.4 . 1 . . . . . 81 PHE C . 16594 1 951 . 1 1 81 81 PHE CA C 13 59.940 0.40 . 1 . . . . . 81 PHE CA . 16594 1 952 . 1 1 81 81 PHE CB C 13 39.700 0.40 . 1 . . . . . 81 PHE CB . 16594 1 953 . 1 1 81 81 PHE CD1 C 13 131.400 0.40 . 1 . . . . . 81 PHE CD1 . 16594 1 954 . 1 1 81 81 PHE N N 15 123.672 0.40 . 1 . . . . . 81 PHE N . 16594 1 955 . 1 1 82 82 GLY H H 1 8.827 0.04 . 1 . . . . . 82 GLY H . 16594 1 956 . 1 1 82 82 GLY HA2 H 1 4.000 0.04 . 2 . . . . . 82 GLY HA2 . 16594 1 957 . 1 1 82 82 GLY HA3 H 1 2.606 0.04 . 2 . . . . . 82 GLY HA3 . 16594 1 958 . 1 1 82 82 GLY C C 13 172.388 0.4 . 1 . . . . . 82 GLY C . 16594 1 959 . 1 1 82 82 GLY CA C 13 44.590 0.40 . 1 . . . . . 82 GLY CA . 16594 1 960 . 1 1 82 82 GLY N N 15 115.493 0.40 . 1 . . . . . 82 GLY N . 16594 1 961 . 1 1 83 83 THR H H 1 7.265 0.04 . 1 . . . . . 83 THR H . 16594 1 962 . 1 1 83 83 THR HA H 1 4.418 0.04 . 1 . . . . . 83 THR HA . 16594 1 963 . 1 1 83 83 THR HB H 1 3.812 0.04 . 1 . . . . . 83 THR HB . 16594 1 964 . 1 1 83 83 THR HG21 H 1 0.931 0.04 . 1 . . . . . 83 THR HG2 . 16594 1 965 . 1 1 83 83 THR HG22 H 1 0.931 0.04 . 1 . . . . . 83 THR HG2 . 16594 1 966 . 1 1 83 83 THR HG23 H 1 0.931 0.04 . 1 . . . . . 83 THR HG2 . 16594 1 967 . 1 1 83 83 THR C C 13 173.808 0.4 . 1 . . . . . 83 THR C . 16594 1 968 . 1 1 83 83 THR CA C 13 61.180 0.40 . 1 . . . . . 83 THR CA . 16594 1 969 . 1 1 83 83 THR CB C 13 70.020 0.40 . 1 . . . . . 83 THR CB . 16594 1 970 . 1 1 83 83 THR CG2 C 13 21.520 0.40 . 1 . . . . . 83 THR CG2 . 16594 1 971 . 1 1 83 83 THR N N 15 115.366 0.40 . 1 . . . . . 83 THR N . 16594 1 972 . 1 1 84 84 CYS H H 1 9.410 0.04 . 1 . . . . . 84 CYS H . 16594 1 973 . 1 1 84 84 CYS HA H 1 4.339 0.04 . 1 . . . . . 84 CYS HA . 16594 1 974 . 1 1 84 84 CYS HB2 H 1 3.353 0.04 . 2 . . . . . 84 CYS HB2 . 16594 1 975 . 1 1 84 84 CYS HB3 H 1 2.714 0.04 . 2 . . . . . 84 CYS HB3 . 16594 1 976 . 1 1 84 84 CYS C C 13 177.986 0.4 . 1 . . . . . 84 CYS C . 16594 1 977 . 1 1 84 84 CYS CA C 13 60.080 0.40 . 1 . . . . . 84 CYS CA . 16594 1 978 . 1 1 84 84 CYS CB C 13 30.630 0.40 . 1 . . . . . 84 CYS CB . 16594 1 979 . 1 1 84 84 CYS N N 15 131.144 0.40 . 1 . . . . . 84 CYS N . 16594 1 980 . 1 1 85 85 VAL H H 1 8.461 0.04 . 1 . . . . . 85 VAL H . 16594 1 981 . 1 1 85 85 VAL HA H 1 3.918 0.04 . 1 . . . . . 85 VAL HA . 16594 1 982 . 1 1 85 85 VAL HB H 1 2.185 0.04 . 1 . . . . . 85 VAL HB . 16594 1 983 . 1 1 85 85 VAL HG11 H 1 1.019 0.04 . 1 . . . . . 85 VAL HG1 . 16594 1 984 . 1 1 85 85 VAL HG12 H 1 1.019 0.04 . 1 . . . . . 85 VAL HG1 . 16594 1 985 . 1 1 85 85 VAL HG13 H 1 1.019 0.04 . 1 . . . . . 85 VAL HG1 . 16594 1 986 . 1 1 85 85 VAL HG21 H 1 0.835 0.04 . 1 . . . . . 85 VAL HG2 . 16594 1 987 . 1 1 85 85 VAL HG22 H 1 0.835 0.04 . 1 . . . . . 85 VAL HG2 . 16594 1 988 . 1 1 85 85 VAL HG23 H 1 0.835 0.04 . 1 . . . . . 85 VAL HG2 . 16594 1 989 . 1 1 85 85 VAL C C 13 175.608 0.4 . 1 . . . . . 85 VAL C . 16594 1 990 . 1 1 85 85 VAL CA C 13 64.080 0.40 . 1 . . . . . 85 VAL CA . 16594 1 991 . 1 1 85 85 VAL CB C 13 31.730 0.40 . 1 . . . . . 85 VAL CB . 16594 1 992 . 1 1 85 85 VAL CG1 C 13 20.930 0.40 . 1 . . . . . 85 VAL CG1 . 16594 1 993 . 1 1 85 85 VAL CG2 C 13 20.230 0.40 . 1 . . . . . 85 VAL CG2 . 16594 1 994 . 1 1 85 85 VAL N N 15 126.221 0.40 . 1 . . . . . 85 VAL N . 16594 1 995 . 1 1 86 86 LYS H H 1 8.924 0.04 . 1 . . . . . 86 LYS H . 16594 1 996 . 1 1 86 86 LYS HA H 1 4.496 0.04 . 1 . . . . . 86 LYS HA . 16594 1 997 . 1 1 86 86 LYS HB2 H 1 2.436 0.04 . 2 . . . . . 86 LYS HB2 . 16594 1 998 . 1 1 86 86 LYS HB3 H 1 1.940 0.04 . 2 . . . . . 86 LYS HB3 . 16594 1 999 . 1 1 86 86 LYS HD2 H 1 1.617 0.04 . 2 . . . . . 86 LYS HD2 . 16594 1 1000 . 1 1 86 86 LYS HD3 H 1 1.540 0.04 . 2 . . . . . 86 LYS HD3 . 16594 1 1001 . 1 1 86 86 LYS HE2 H 1 2.826 0.04 . 2 . . . . . 86 LYS HE2 . 16594 1 1002 . 1 1 86 86 LYS HE3 H 1 2.826 0.04 . 2 . . . . . 86 LYS HE3 . 16594 1 1003 . 1 1 86 86 LYS HG2 H 1 1.387 0.04 . 2 . . . . . 86 LYS HG2 . 16594 1 1004 . 1 1 86 86 LYS HG3 H 1 1.387 0.04 . 2 . . . . . 86 LYS HG3 . 16594 1 1005 . 1 1 86 86 LYS C C 13 177.277 0.4 . 1 . . . . . 86 LYS C . 16594 1 1006 . 1 1 86 86 LYS CA C 13 58.500 0.40 . 1 . . . . . 86 LYS CA . 16594 1 1007 . 1 1 86 86 LYS CB C 13 33.780 0.40 . 1 . . . . . 86 LYS CB . 16594 1 1008 . 1 1 86 86 LYS CD C 13 28.660 0.40 . 1 . . . . . 86 LYS CD . 16594 1 1009 . 1 1 86 86 LYS CE C 13 42.040 0.40 . 1 . . . . . 86 LYS CE . 16594 1 1010 . 1 1 86 86 LYS CG C 13 25.670 0.40 . 1 . . . . . 86 LYS CG . 16594 1 1011 . 1 1 86 86 LYS N N 15 123.551 0.40 . 1 . . . . . 86 LYS N . 16594 1 1012 . 1 1 87 87 CYS H H 1 8.264 0.04 . 1 . . . . . 87 CYS H . 16594 1 1013 . 1 1 87 87 CYS HA H 1 4.925 0.04 . 1 . . . . . 87 CYS HA . 16594 1 1014 . 1 1 87 87 CYS HB2 H 1 3.176 0.04 . 2 . . . . . 87 CYS HB2 . 16594 1 1015 . 1 1 87 87 CYS HB3 H 1 2.468 0.04 . 2 . . . . . 87 CYS HB3 . 16594 1 1016 . 1 1 87 87 CYS C C 13 177.211 0.4 . 1 . . . . . 87 CYS C . 16594 1 1017 . 1 1 87 87 CYS CA C 13 58.980 0.40 . 1 . . . . . 87 CYS CA . 16594 1 1018 . 1 1 87 87 CYS CB C 13 33.100 0.40 . 1 . . . . . 87 CYS CB . 16594 1 1019 . 1 1 87 87 CYS N N 15 117.502 0.40 . 1 . . . . . 87 CYS N . 16594 1 1020 . 1 1 88 88 GLY H H 1 7.655 0.04 . 1 . . . . . 88 GLY H . 16594 1 1021 . 1 1 88 88 GLY HA2 H 1 4.159 0.04 . 2 . . . . . 88 GLY HA2 . 16594 1 1022 . 1 1 88 88 GLY HA3 H 1 3.729 0.04 . 2 . . . . . 88 GLY HA3 . 16594 1 1023 . 1 1 88 88 GLY C C 13 173.558 0.4 . 1 . . . . . 88 GLY C . 16594 1 1024 . 1 1 88 88 GLY CA C 13 46.300 0.40 . 1 . . . . . 88 GLY CA . 16594 1 1025 . 1 1 88 88 GLY N N 15 111.948 0.40 . 1 . . . . . 88 GLY N . 16594 1 1026 . 1 1 89 89 LYS H H 1 8.721 0.04 . 1 . . . . . 89 LYS H . 16594 1 1027 . 1 1 89 89 LYS HA H 1 4.315 0.04 . 1 . . . . . 89 LYS HA . 16594 1 1028 . 1 1 89 89 LYS HB2 H 1 1.935 0.04 . 2 . . . . . 89 LYS HB2 . 16594 1 1029 . 1 1 89 89 LYS HB3 H 1 1.742 0.04 . 2 . . . . . 89 LYS HB3 . 16594 1 1030 . 1 1 89 89 LYS HD2 H 1 1.734 0.04 . 2 . . . . . 89 LYS HD2 . 16594 1 1031 . 1 1 89 89 LYS HD3 H 1 1.734 0.04 . 2 . . . . . 89 LYS HD3 . 16594 1 1032 . 1 1 89 89 LYS HE2 H 1 3.070 0.04 . 2 . . . . . 89 LYS HE2 . 16594 1 1033 . 1 1 89 89 LYS HE3 H 1 3.070 0.04 . 2 . . . . . 89 LYS HE3 . 16594 1 1034 . 1 1 89 89 LYS HG2 H 1 1.509 0.04 . 2 . . . . . 89 LYS HG2 . 16594 1 1035 . 1 1 89 89 LYS HG3 H 1 1.461 0.04 . 2 . . . . . 89 LYS HG3 . 16594 1 1036 . 1 1 89 89 LYS C C 13 176.659 0.4 . 1 . . . . . 89 LYS C . 16594 1 1037 . 1 1 89 89 LYS CA C 13 56.860 0.40 . 1 . . . . . 89 LYS CA . 16594 1 1038 . 1 1 89 89 LYS CB C 13 33.540 0.40 . 1 . . . . . 89 LYS CB . 16594 1 1039 . 1 1 89 89 LYS CD C 13 29.500 0.40 . 1 . . . . . 89 LYS CD . 16594 1 1040 . 1 1 89 89 LYS CE C 13 41.980 0.40 . 1 . . . . . 89 LYS CE . 16594 1 1041 . 1 1 89 89 LYS CG C 13 25.450 0.40 . 1 . . . . . 89 LYS CG . 16594 1 1042 . 1 1 89 89 LYS N N 15 123.614 0.40 . 1 . . . . . 89 LYS N . 16594 1 1043 . 1 1 90 90 ARG H H 1 8.415 0.04 . 1 . . . . . 90 ARG H . 16594 1 1044 . 1 1 90 90 ARG HA H 1 4.299 0.04 . 1 . . . . . 90 ARG HA . 16594 1 1045 . 1 1 90 90 ARG HB2 H 1 1.696 0.04 . 2 . . . . . 90 ARG HB2 . 16594 1 1046 . 1 1 90 90 ARG HB3 H 1 1.696 0.04 . 2 . . . . . 90 ARG HB3 . 16594 1 1047 . 1 1 90 90 ARG HD2 H 1 3.114 0.04 . 2 . . . . . 90 ARG HD2 . 16594 1 1048 . 1 1 90 90 ARG HD3 H 1 3.114 0.04 . 2 . . . . . 90 ARG HD3 . 16594 1 1049 . 1 1 90 90 ARG HG2 H 1 1.633 0.04 . 2 . . . . . 90 ARG HG2 . 16594 1 1050 . 1 1 90 90 ARG HG3 H 1 1.575 0.04 . 2 . . . . . 90 ARG HG3 . 16594 1 1051 . 1 1 90 90 ARG C C 13 176.041 0.4 . 1 . . . . . 90 ARG C . 16594 1 1052 . 1 1 90 90 ARG CA C 13 56.030 0.40 . 1 . . . . . 90 ARG CA . 16594 1 1053 . 1 1 90 90 ARG CB C 13 29.470 0.40 . 1 . . . . . 90 ARG CB . 16594 1 1054 . 1 1 90 90 ARG CD C 13 42.700 0.40 . 1 . . . . . 90 ARG CD . 16594 1 1055 . 1 1 90 90 ARG CG C 13 26.690 0.40 . 1 . . . . . 90 ARG CG . 16594 1 1056 . 1 1 90 90 ARG N N 15 121.880 0.40 . 1 . . . . . 90 ARG N . 16594 1 1057 . 1 1 91 91 ILE H H 1 8.334 0.04 . 1 . . . . . 91 ILE H . 16594 1 1058 . 1 1 91 91 ILE HA H 1 3.668 0.04 . 1 . . . . . 91 ILE HA . 16594 1 1059 . 1 1 91 91 ILE HB H 1 1.069 0.04 . 1 . . . . . 91 ILE HB . 16594 1 1060 . 1 1 91 91 ILE HD11 H 1 0.236 0.04 . 1 . . . . . 91 ILE HD1 . 16594 1 1061 . 1 1 91 91 ILE HD12 H 1 0.236 0.04 . 1 . . . . . 91 ILE HD1 . 16594 1 1062 . 1 1 91 91 ILE HD13 H 1 0.236 0.04 . 1 . . . . . 91 ILE HD1 . 16594 1 1063 . 1 1 91 91 ILE HG12 H 1 1.387 0.04 . 2 . . . . . 91 ILE HG12 . 16594 1 1064 . 1 1 91 91 ILE HG13 H 1 0.292 0.04 . 2 . . . . . 91 ILE HG13 . 16594 1 1065 . 1 1 91 91 ILE HG21 H 1 0.910 0.04 . 1 . . . . . 91 ILE HG2 . 16594 1 1066 . 1 1 91 91 ILE HG22 H 1 0.910 0.04 . 1 . . . . . 91 ILE HG2 . 16594 1 1067 . 1 1 91 91 ILE HG23 H 1 0.910 0.04 . 1 . . . . . 91 ILE HG2 . 16594 1 1068 . 1 1 91 91 ILE C C 13 175.003 0.4 . 1 . . . . . 91 ILE C . 16594 1 1069 . 1 1 91 91 ILE CA C 13 61.810 0.40 . 1 . . . . . 91 ILE CA . 16594 1 1070 . 1 1 91 91 ILE CB C 13 38.920 0.40 . 1 . . . . . 91 ILE CB . 16594 1 1071 . 1 1 91 91 ILE CD1 C 13 13.460 0.40 . 1 . . . . . 91 ILE CD1 . 16594 1 1072 . 1 1 91 91 ILE CG1 C 13 28.870 0.40 . 1 . . . . . 91 ILE CG1 . 16594 1 1073 . 1 1 91 91 ILE CG2 C 13 17.660 0.40 . 1 . . . . . 91 ILE CG2 . 16594 1 1074 . 1 1 91 91 ILE N N 15 128.410 0.40 . 1 . . . . . 91 ILE N . 16594 1 1075 . 1 1 92 92 SER H H 1 8.551 0.04 . 1 . . . . . 92 SER H . 16594 1 1076 . 1 1 92 92 SER HA H 1 4.180 0.04 . 1 . . . . . 92 SER HA . 16594 1 1077 . 1 1 92 92 SER HB2 H 1 4.231 0.04 . 2 . . . . . 92 SER HB2 . 16594 1 1078 . 1 1 92 92 SER HB3 H 1 4.048 0.04 . 2 . . . . . 92 SER HB3 . 16594 1 1079 . 1 1 92 92 SER C C 13 175.108 0.4 . 1 . . . . . 92 SER C . 16594 1 1080 . 1 1 92 92 SER CA C 13 58.460 0.40 . 1 . . . . . 92 SER CA . 16594 1 1081 . 1 1 92 92 SER CB C 13 64.180 0.40 . 1 . . . . . 92 SER CB . 16594 1 1082 . 1 1 92 92 SER N N 15 124.170 0.40 . 1 . . . . . 92 SER N . 16594 1 1083 . 1 1 93 93 GLU H H 1 8.912 0.04 . 1 . . . . . 93 GLU H . 16594 1 1084 . 1 1 93 93 GLU HA H 1 3.939 0.04 . 1 . . . . . 93 GLU HA . 16594 1 1085 . 1 1 93 93 GLU HB2 H 1 2.086 0.04 . 2 . . . . . 93 GLU HB2 . 16594 1 1086 . 1 1 93 93 GLU HB3 H 1 2.086 0.04 . 2 . . . . . 93 GLU HB3 . 16594 1 1087 . 1 1 93 93 GLU HG2 H 1 2.434 0.04 . 2 . . . . . 93 GLU HG2 . 16594 1 1088 . 1 1 93 93 GLU HG3 H 1 2.291 0.04 . 2 . . . . . 93 GLU HG3 . 16594 1 1089 . 1 1 93 93 GLU C C 13 178.144 0.4 . 1 . . . . . 93 GLU C . 16594 1 1090 . 1 1 93 93 GLU CA C 13 60.080 0.40 . 1 . . . . . 93 GLU CA . 16594 1 1091 . 1 1 93 93 GLU CB C 13 29.960 0.40 . 1 . . . . . 93 GLU CB . 16594 1 1092 . 1 1 93 93 GLU CG C 13 37.220 0.40 . 1 . . . . . 93 GLU CG . 16594 1 1093 . 1 1 93 93 GLU N N 15 123.996 0.40 . 1 . . . . . 93 GLU N . 16594 1 1094 . 1 1 94 94 ASP H H 1 8.311 0.04 . 1 . . . . . 94 ASP H . 16594 1 1095 . 1 1 94 94 ASP HA H 1 4.252 0.04 . 1 . . . . . 94 ASP HA . 16594 1 1096 . 1 1 94 94 ASP HB2 H 1 2.568 0.04 . 2 . . . . . 94 ASP HB2 . 16594 1 1097 . 1 1 94 94 ASP HB3 H 1 2.478 0.04 . 2 . . . . . 94 ASP HB3 . 16594 1 1098 . 1 1 94 94 ASP C C 13 178.472 0.4 . 1 . . . . . 94 ASP C . 16594 1 1099 . 1 1 94 94 ASP CA C 13 57.240 0.40 . 1 . . . . . 94 ASP CA . 16594 1 1100 . 1 1 94 94 ASP CB C 13 40.420 0.40 . 1 . . . . . 94 ASP CB . 16594 1 1101 . 1 1 94 94 ASP N N 15 116.432 0.40 . 1 . . . . . 94 ASP N . 16594 1 1102 . 1 1 95 95 ARG H H 1 7.365 0.04 . 1 . . . . . 95 ARG H . 16594 1 1103 . 1 1 95 95 ARG HA H 1 4.067 0.04 . 1 . . . . . 95 ARG HA . 16594 1 1104 . 1 1 95 95 ARG HB2 H 1 1.845 0.04 . 2 . . . . . 95 ARG HB2 . 16594 1 1105 . 1 1 95 95 ARG HB3 H 1 1.567 0.04 . 2 . . . . . 95 ARG HB3 . 16594 1 1106 . 1 1 95 95 ARG HD2 H 1 3.250 0.04 . 2 . . . . . 95 ARG HD2 . 16594 1 1107 . 1 1 95 95 ARG HD3 H 1 3.250 0.04 . 2 . . . . . 95 ARG HD3 . 16594 1 1108 . 1 1 95 95 ARG HG2 H 1 1.723 0.04 . 2 . . . . . 95 ARG HG2 . 16594 1 1109 . 1 1 95 95 ARG HG3 H 1 1.066 0.04 . 2 . . . . . 95 ARG HG3 . 16594 1 1110 . 1 1 95 95 ARG C C 13 177.237 0.4 . 1 . . . . . 95 ARG C . 16594 1 1111 . 1 1 95 95 ARG CA C 13 58.870 0.40 . 1 . . . . . 95 ARG CA . 16594 1 1112 . 1 1 95 95 ARG CB C 13 29.100 0.40 . 1 . . . . . 95 ARG CB . 16594 1 1113 . 1 1 95 95 ARG CD C 13 43.890 0.40 . 1 . . . . . 95 ARG CD . 16594 1 1114 . 1 1 95 95 ARG CG C 13 28.030 0.40 . 1 . . . . . 95 ARG CG . 16594 1 1115 . 1 1 95 95 ARG N N 15 121.517 0.40 . 1 . . . . . 95 ARG N . 16594 1 1116 . 1 1 96 96 LEU H H 1 7.831 0.04 . 1 . . . . . 96 LEU H . 16594 1 1117 . 1 1 96 96 LEU HA H 1 3.735 0.04 . 1 . . . . . 96 LEU HA . 16594 1 1118 . 1 1 96 96 LEU HB2 H 1 1.671 0.04 . 2 . . . . . 96 LEU HB2 . 16594 1 1119 . 1 1 96 96 LEU HB3 H 1 1.125 0.04 . 2 . . . . . 96 LEU HB3 . 16594 1 1120 . 1 1 96 96 LEU HD11 H 1 0.375 0.04 . 1 . . . . . 96 LEU HD1 . 16594 1 1121 . 1 1 96 96 LEU HD12 H 1 0.375 0.04 . 1 . . . . . 96 LEU HD1 . 16594 1 1122 . 1 1 96 96 LEU HD13 H 1 0.375 0.04 . 1 . . . . . 96 LEU HD1 . 16594 1 1123 . 1 1 96 96 LEU HD21 H 1 0.305 0.04 . 1 . . . . . 96 LEU HD2 . 16594 1 1124 . 1 1 96 96 LEU HD22 H 1 0.305 0.04 . 1 . . . . . 96 LEU HD2 . 16594 1 1125 . 1 1 96 96 LEU HD23 H 1 0.305 0.04 . 1 . . . . . 96 LEU HD2 . 16594 1 1126 . 1 1 96 96 LEU HG H 1 1.312 0.04 . 1 . . . . . 96 LEU HG . 16594 1 1127 . 1 1 96 96 LEU C C 13 177.855 0.4 . 1 . . . . . 96 LEU C . 16594 1 1128 . 1 1 96 96 LEU CA C 13 56.930 0.40 . 1 . . . . . 96 LEU CA . 16594 1 1129 . 1 1 96 96 LEU CB C 13 41.300 0.40 . 1 . . . . . 96 LEU CB . 16594 1 1130 . 1 1 96 96 LEU CD1 C 13 25.620 0.40 . 1 . . . . . 96 LEU CD1 . 16594 1 1131 . 1 1 96 96 LEU CD2 C 13 23.010 0.40 . 1 . . . . . 96 LEU CD2 . 16594 1 1132 . 1 1 96 96 LEU CG C 13 26.160 0.40 . 1 . . . . . 96 LEU CG . 16594 1 1133 . 1 1 96 96 LEU N N 15 119.073 0.40 . 1 . . . . . 96 LEU N . 16594 1 1134 . 1 1 97 97 LYS H H 1 8.098 0.04 . 1 . . . . . 97 LYS H . 16594 1 1135 . 1 1 97 97 LYS HA H 1 4.014 0.04 . 1 . . . . . 97 LYS HA . 16594 1 1136 . 1 1 97 97 LYS HB2 H 1 1.867 0.04 . 2 . . . . . 97 LYS HB2 . 16594 1 1137 . 1 1 97 97 LYS HB3 H 1 1.798 0.04 . 2 . . . . . 97 LYS HB3 . 16594 1 1138 . 1 1 97 97 LYS HD2 H 1 1.639 0.04 . 2 . . . . . 97 LYS HD2 . 16594 1 1139 . 1 1 97 97 LYS HD3 H 1 1.639 0.04 . 2 . . . . . 97 LYS HD3 . 16594 1 1140 . 1 1 97 97 LYS HE2 H 1 2.903 0.04 . 2 . . . . . 97 LYS HE2 . 16594 1 1141 . 1 1 97 97 LYS HE3 H 1 2.903 0.04 . 2 . . . . . 97 LYS HE3 . 16594 1 1142 . 1 1 97 97 LYS HG2 H 1 1.699 0.04 . 2 . . . . . 97 LYS HG2 . 16594 1 1143 . 1 1 97 97 LYS HG3 H 1 1.424 0.04 . 2 . . . . . 97 LYS HG3 . 16594 1 1144 . 1 1 97 97 LYS C C 13 178.433 0.4 . 1 . . . . . 97 LYS C . 16594 1 1145 . 1 1 97 97 LYS CA C 13 59.080 0.40 . 1 . . . . . 97 LYS CA . 16594 1 1146 . 1 1 97 97 LYS CB C 13 32.830 0.40 . 1 . . . . . 97 LYS CB . 16594 1 1147 . 1 1 97 97 LYS CD C 13 29.190 0.40 . 1 . . . . . 97 LYS CD . 16594 1 1148 . 1 1 97 97 LYS CE C 13 42.160 0.40 . 1 . . . . . 97 LYS CE . 16594 1 1149 . 1 1 97 97 LYS CG C 13 25.670 0.40 . 1 . . . . . 97 LYS CG . 16594 1 1150 . 1 1 97 97 LYS N N 15 114.647 0.40 . 1 . . . . . 97 LYS N . 16594 1 1151 . 1 1 98 98 ALA H H 1 7.011 0.04 . 1 . . . . . 98 ALA H . 16594 1 1152 . 1 1 98 98 ALA HA H 1 4.196 0.04 . 1 . . . . . 98 ALA HA . 16594 1 1153 . 1 1 98 98 ALA HB1 H 1 1.466 0.04 . 1 . . . . . 98 ALA HB . 16594 1 1154 . 1 1 98 98 ALA HB2 H 1 1.466 0.04 . 1 . . . . . 98 ALA HB . 16594 1 1155 . 1 1 98 98 ALA HB3 H 1 1.466 0.04 . 1 . . . . . 98 ALA HB . 16594 1 1156 . 1 1 98 98 ALA C C 13 178.814 0.4 . 1 . . . . . 98 ALA C . 16594 1 1157 . 1 1 98 98 ALA CA C 13 54.480 0.40 . 1 . . . . . 98 ALA CA . 16594 1 1158 . 1 1 98 98 ALA CB C 13 19.380 0.40 . 1 . . . . . 98 ALA CB . 16594 1 1159 . 1 1 98 98 ALA N N 15 119.536 0.40 . 1 . . . . . 98 ALA N . 16594 1 1160 . 1 1 99 99 VAL H H 1 8.133 0.04 . 1 . . . . . 99 VAL H . 16594 1 1161 . 1 1 99 99 VAL HA H 1 4.098 0.04 . 1 . . . . . 99 VAL HA . 16594 1 1162 . 1 1 99 99 VAL HB H 1 1.749 0.04 . 1 . . . . . 99 VAL HB . 16594 1 1163 . 1 1 99 99 VAL HG11 H 1 0.371 0.04 . 1 . . . . . 99 VAL HG1 . 16594 1 1164 . 1 1 99 99 VAL HG12 H 1 0.371 0.04 . 1 . . . . . 99 VAL HG1 . 16594 1 1165 . 1 1 99 99 VAL HG13 H 1 0.371 0.04 . 1 . . . . . 99 VAL HG1 . 16594 1 1166 . 1 1 99 99 VAL HG21 H 1 0.690 0.04 . 1 . . . . . 99 VAL HG2 . 16594 1 1167 . 1 1 99 99 VAL HG22 H 1 0.690 0.04 . 1 . . . . . 99 VAL HG2 . 16594 1 1168 . 1 1 99 99 VAL HG23 H 1 0.690 0.04 . 1 . . . . . 99 VAL HG2 . 16594 1 1169 . 1 1 99 99 VAL CA C 13 58.260 0.40 . 1 . . . . . 99 VAL CA . 16594 1 1170 . 1 1 99 99 VAL CB C 13 32.530 0.40 . 1 . . . . . 99 VAL CB . 16594 1 1171 . 1 1 99 99 VAL CG1 C 13 22.190 0.40 . 1 . . . . . 99 VAL CG1 . 16594 1 1172 . 1 1 99 99 VAL CG2 C 13 19.470 0.40 . 1 . . . . . 99 VAL CG2 . 16594 1 1173 . 1 1 99 99 VAL N N 15 114.735 0.40 . 1 . . . . . 99 VAL N . 16594 1 1174 . 1 1 100 100 PRO HA H 1 4.761 0.04 . 1 . . . . . 100 PRO HA . 16594 1 1175 . 1 1 100 100 PRO HB2 H 1 2.640 0.04 . 2 . . . . . 100 PRO HB2 . 16594 1 1176 . 1 1 100 100 PRO HB3 H 1 1.816 0.04 . 2 . . . . . 100 PRO HB3 . 16594 1 1177 . 1 1 100 100 PRO HD2 H 1 3.549 0.04 . 2 . . . . . 100 PRO HD2 . 16594 1 1178 . 1 1 100 100 PRO HD3 H 1 3.338 0.04 . 2 . . . . . 100 PRO HD3 . 16594 1 1179 . 1 1 100 100 PRO HG2 H 1 2.229 0.04 . 2 . . . . . 100 PRO HG2 . 16594 1 1180 . 1 1 100 100 PRO HG3 H 1 1.842 0.04 . 2 . . . . . 100 PRO HG3 . 16594 1 1181 . 1 1 100 100 PRO C C 13 175.437 0.4 . 1 . . . . . 100 PRO C . 16594 1 1182 . 1 1 100 100 PRO CA C 13 65.370 0.40 . 1 . . . . . 100 PRO CA . 16594 1 1183 . 1 1 100 100 PRO CB C 13 31.190 0.40 . 1 . . . . . 100 PRO CB . 16594 1 1184 . 1 1 100 100 PRO CD C 13 49.870 0.40 . 1 . . . . . 100 PRO CD . 16594 1 1185 . 1 1 100 100 PRO CG C 13 27.280 0.40 . 1 . . . . . 100 PRO CG . 16594 1 1186 . 1 1 101 101 TYR H H 1 6.053 0.04 . 1 . . . . . 101 TYR H . 16594 1 1187 . 1 1 101 101 TYR HA H 1 4.463 0.04 . 1 . . . . . 101 TYR HA . 16594 1 1188 . 1 1 101 101 TYR HB2 H 1 3.260 0.04 . 2 . . . . . 101 TYR HB2 . 16594 1 1189 . 1 1 101 101 TYR HB3 H 1 2.307 0.04 . 2 . . . . . 101 TYR HB3 . 16594 1 1190 . 1 1 101 101 TYR HD1 H 1 6.773 0.04 . 1 . . . . . 101 TYR HD1 . 16594 1 1191 . 1 1 101 101 TYR HD2 H 1 6.773 0.04 . 1 . . . . . 101 TYR HD2 . 16594 1 1192 . 1 1 101 101 TYR HE1 H 1 6.851 0.04 . 1 . . . . . 101 TYR HE1 . 16594 1 1193 . 1 1 101 101 TYR HE2 H 1 6.851 0.04 . 1 . . . . . 101 TYR HE2 . 16594 1 1194 . 1 1 101 101 TYR C C 13 175.871 0.4 . 1 . . . . . 101 TYR C . 16594 1 1195 . 1 1 101 101 TYR CA C 13 53.920 0.40 . 1 . . . . . 101 TYR CA . 16594 1 1196 . 1 1 101 101 TYR CB C 13 38.230 0.40 . 1 . . . . . 101 TYR CB . 16594 1 1197 . 1 1 101 101 TYR CD1 C 13 132.902 0.40 . 1 . . . . . 101 TYR CD1 . 16594 1 1198 . 1 1 101 101 TYR CE1 C 13 119.214 0.40 . 1 . . . . . 101 TYR CE1 . 16594 1 1199 . 1 1 101 101 TYR N N 15 108.211 0.40 . 1 . . . . . 101 TYR N . 16594 1 1200 . 1 1 102 102 THR H H 1 7.466 0.04 . 1 . . . . . 102 THR H . 16594 1 1201 . 1 1 102 102 THR HA H 1 4.384 0.04 . 1 . . . . . 102 THR HA . 16594 1 1202 . 1 1 102 102 THR HB H 1 4.040 0.04 . 1 . . . . . 102 THR HB . 16594 1 1203 . 1 1 102 102 THR HG21 H 1 1.161 0.04 . 1 . . . . . 102 THR HG2 . 16594 1 1204 . 1 1 102 102 THR HG22 H 1 1.161 0.04 . 1 . . . . . 102 THR HG2 . 16594 1 1205 . 1 1 102 102 THR HG23 H 1 1.161 0.04 . 1 . . . . . 102 THR HG2 . 16594 1 1206 . 1 1 102 102 THR CA C 13 60.030 0.40 . 1 . . . . . 102 THR CA . 16594 1 1207 . 1 1 102 102 THR CB C 13 69.600 0.40 . 1 . . . . . 102 THR CB . 16594 1 1208 . 1 1 102 102 THR CG2 C 13 18.900 0.40 . 1 . . . . . 102 THR CG2 . 16594 1 1209 . 1 1 102 102 THR N N 15 120.556 0.40 . 1 . . . . . 102 THR N . 16594 1 1210 . 1 1 103 103 PRO HA H 1 4.244 0.04 . 1 . . . . . 103 PRO HA . 16594 1 1211 . 1 1 103 103 PRO HB2 H 1 1.742 0.04 . 2 . . . . . 103 PRO HB2 . 16594 1 1212 . 1 1 103 103 PRO HB3 H 1 0.737 0.04 . 2 . . . . . 103 PRO HB3 . 16594 1 1213 . 1 1 103 103 PRO HD2 H 1 3.933 0.04 . 2 . . . . . 103 PRO HD2 . 16594 1 1214 . 1 1 103 103 PRO HD3 H 1 3.422 0.04 . 2 . . . . . 103 PRO HD3 . 16594 1 1215 . 1 1 103 103 PRO HG2 H 1 1.549 0.04 . 2 . . . . . 103 PRO HG2 . 16594 1 1216 . 1 1 103 103 PRO HG3 H 1 0.860 0.04 . 2 . . . . . 103 PRO HG3 . 16594 1 1217 . 1 1 103 103 PRO C C 13 176.344 0.4 . 1 . . . . . 103 PRO C . 16594 1 1218 . 1 1 103 103 PRO CA C 13 62.400 0.40 . 1 . . . . . 103 PRO CA . 16594 1 1219 . 1 1 103 103 PRO CB C 13 32.250 0.40 . 1 . . . . . 103 PRO CB . 16594 1 1220 . 1 1 103 103 PRO CD C 13 51.570 0.40 . 1 . . . . . 103 PRO CD . 16594 1 1221 . 1 1 103 103 PRO CG C 13 26.480 0.40 . 1 . . . . . 103 PRO CG . 16594 1 1222 . 1 1 104 104 PHE H H 1 7.365 0.04 . 1 . . . . . 104 PHE H . 16594 1 1223 . 1 1 104 104 PHE HA H 1 6.207 0.04 . 1 . . . . . 104 PHE HA . 16594 1 1224 . 1 1 104 104 PHE HB2 H 1 3.435 0.04 . 2 . . . . . 104 PHE HB2 . 16594 1 1225 . 1 1 104 104 PHE HB3 H 1 2.463 0.04 . 2 . . . . . 104 PHE HB3 . 16594 1 1226 . 1 1 104 104 PHE HD1 H 1 7.110 0.04 . 1 . . . . . 104 PHE HD1 . 16594 1 1227 . 1 1 104 104 PHE HD2 H 1 7.110 0.04 . 1 . . . . . 104 PHE HD2 . 16594 1 1228 . 1 1 104 104 PHE HE1 H 1 7.268 0.04 . 1 . . . . . 104 PHE HE1 . 16594 1 1229 . 1 1 104 104 PHE HE2 H 1 7.268 0.04 . 1 . . . . . 104 PHE HE2 . 16594 1 1230 . 1 1 104 104 PHE C C 13 176.133 0.4 . 1 . . . . . 104 PHE C . 16594 1 1231 . 1 1 104 104 PHE CA C 13 55.220 0.40 . 1 . . . . . 104 PHE CA . 16594 1 1232 . 1 1 104 104 PHE CB C 13 44.480 0.40 . 1 . . . . . 104 PHE CB . 16594 1 1233 . 1 1 104 104 PHE CD1 C 13 131.002 0.40 . 1 . . . . . 104 PHE CD1 . 16594 1 1234 . 1 1 104 104 PHE CE1 C 13 130.900 0.40 . 1 . . . . . 104 PHE CE1 . 16594 1 1235 . 1 1 104 104 PHE N N 15 115.933 0.40 . 1 . . . . . 104 PHE N . 16594 1 1236 . 1 1 105 105 CYS H H 1 9.248 0.04 . 1 . . . . . 105 CYS H . 16594 1 1237 . 1 1 105 105 CYS HA H 1 4.638 0.04 . 1 . . . . . 105 CYS HA . 16594 1 1238 . 1 1 105 105 CYS HB2 H 1 3.637 0.04 . 2 . . . . . 105 CYS HB2 . 16594 1 1239 . 1 1 105 105 CYS HB3 H 1 2.640 0.04 . 2 . . . . . 105 CYS HB3 . 16594 1 1240 . 1 1 105 105 CYS C C 13 174.254 0.4 . 1 . . . . . 105 CYS C . 16594 1 1241 . 1 1 105 105 CYS CA C 13 58.060 0.40 . 1 . . . . . 105 CYS CA . 16594 1 1242 . 1 1 105 105 CYS CB C 13 31.250 0.40 . 1 . . . . . 105 CYS CB . 16594 1 1243 . 1 1 105 105 CYS N N 15 118.999 0.40 . 1 . . . . . 105 CYS N . 16594 1 1244 . 1 1 106 106 GLN H H 1 8.865 0.04 . 1 . . . . . 106 GLN H . 16594 1 1245 . 1 1 106 106 GLN HA H 1 3.611 0.04 . 1 . . . . . 106 GLN HA . 16594 1 1246 . 1 1 106 106 GLN HB2 H 1 2.213 0.04 . 2 . . . . . 106 GLN HB2 . 16594 1 1247 . 1 1 106 106 GLN HB3 H 1 2.047 0.04 . 2 . . . . . 106 GLN HB3 . 16594 1 1248 . 1 1 106 106 GLN HE21 H 1 7.496 0.04 . 1 . . . . . 106 GLN HE21 . 16594 1 1249 . 1 1 106 106 GLN HE22 H 1 6.898 0.04 . 2 . . . . . 106 GLN HE22 . 16594 1 1250 . 1 1 106 106 GLN HG2 H 1 2.378 0.04 . 2 . . . . . 106 GLN HG2 . 16594 1 1251 . 1 1 106 106 GLN HG3 H 1 2.317 0.04 . 2 . . . . . 106 GLN HG3 . 16594 1 1252 . 1 1 106 106 GLN C C 13 177.250 0.4 . 1 . . . . . 106 GLN C . 16594 1 1253 . 1 1 106 106 GLN CA C 13 59.430 0.40 . 1 . . . . . 106 GLN CA . 16594 1 1254 . 1 1 106 106 GLN CB C 13 28.750 0.40 . 1 . . . . . 106 GLN CB . 16594 1 1255 . 1 1 106 106 GLN CG C 13 33.140 0.40 . 1 . . . . . 106 GLN CG . 16594 1 1256 . 1 1 106 106 GLN N N 15 119.606 0.40 . 1 . . . . . 106 GLN N . 16594 1 1257 . 1 1 106 106 GLN NE2 N 15 113.100 0.04 . 1 . . . . . 106 GLN NE2 . 16594 1 1258 . 1 1 107 107 GLU H H 1 8.134 0.04 . 1 . . . . . 107 GLU H . 16594 1 1259 . 1 1 107 107 GLU HA H 1 3.959 0.04 . 1 . . . . . 107 GLU HA . 16594 1 1260 . 1 1 107 107 GLU HB2 H 1 2.131 0.04 . 2 . . . . . 107 GLU HB2 . 16594 1 1261 . 1 1 107 107 GLU HB3 H 1 2.001 0.04 . 2 . . . . . 107 GLU HB3 . 16594 1 1262 . 1 1 107 107 GLU HG2 H 1 2.245 0.04 . 2 . . . . . 107 GLU HG2 . 16594 1 1263 . 1 1 107 107 GLU HG3 H 1 2.245 0.04 . 2 . . . . . 107 GLU HG3 . 16594 1 1264 . 1 1 107 107 GLU C C 13 179.616 0.4 . 1 . . . . . 107 GLU C . 16594 1 1265 . 1 1 107 107 GLU CA C 13 60.110 0.40 . 1 . . . . . 107 GLU CA . 16594 1 1266 . 1 1 107 107 GLU CB C 13 29.990 0.40 . 1 . . . . . 107 GLU CB . 16594 1 1267 . 1 1 107 107 GLU CG C 13 37.110 0.40 . 1 . . . . . 107 GLU CG . 16594 1 1268 . 1 1 107 107 GLU N N 15 119.554 0.40 . 1 . . . . . 107 GLU N . 16594 1 1269 . 1 1 108 108 CYS H H 1 8.681 0.04 . 1 . . . . . 108 CYS H . 16594 1 1270 . 1 1 108 108 CYS HA H 1 3.783 0.04 . 1 . . . . . 108 CYS HA . 16594 1 1271 . 1 1 108 108 CYS HB2 H 1 2.879 0.04 . 2 . . . . . 108 CYS HB2 . 16594 1 1272 . 1 1 108 108 CYS HB3 H 1 2.560 0.04 . 2 . . . . . 108 CYS HB3 . 16594 1 1273 . 1 1 108 108 CYS C C 13 177.868 0.4 . 1 . . . . . 108 CYS C . 16594 1 1274 . 1 1 108 108 CYS CA C 13 64.110 0.40 . 1 . . . . . 108 CYS CA . 16594 1 1275 . 1 1 108 108 CYS CB C 13 29.270 0.40 . 1 . . . . . 108 CYS CB . 16594 1 1276 . 1 1 108 108 CYS N N 15 123.406 0.40 . 1 . . . . . 108 CYS N . 16594 1 1277 . 1 1 109 109 ALA H H 1 8.094 0.04 . 1 . . . . . 109 ALA H . 16594 1 1278 . 1 1 109 109 ALA HA H 1 3.693 0.04 . 1 . . . . . 109 ALA HA . 16594 1 1279 . 1 1 109 109 ALA HB1 H 1 1.344 0.04 . 1 . . . . . 109 ALA HB . 16594 1 1280 . 1 1 109 109 ALA HB2 H 1 1.344 0.04 . 1 . . . . . 109 ALA HB . 16594 1 1281 . 1 1 109 109 ALA HB3 H 1 1.344 0.04 . 1 . . . . . 109 ALA HB . 16594 1 1282 . 1 1 109 109 ALA C C 13 178.591 0.4 . 1 . . . . . 109 ALA C . 16594 1 1283 . 1 1 109 109 ALA CA C 13 53.710 0.40 . 1 . . . . . 109 ALA CA . 16594 1 1284 . 1 1 109 109 ALA CB C 13 18.430 0.40 . 1 . . . . . 109 ALA CB . 16594 1 1285 . 1 1 109 109 ALA N N 15 120.579 0.40 . 1 . . . . . 109 ALA N . 16594 1 1286 . 1 1 110 110 ALA H H 1 7.402 0.04 . 1 . . . . . 110 ALA H . 16594 1 1287 . 1 1 110 110 ALA HA H 1 4.111 0.04 . 1 . . . . . 110 ALA HA . 16594 1 1288 . 1 1 110 110 ALA HB1 H 1 1.374 0.04 . 1 . . . . . 110 ALA HB . 16594 1 1289 . 1 1 110 110 ALA HB2 H 1 1.374 0.04 . 1 . . . . . 110 ALA HB . 16594 1 1290 . 1 1 110 110 ALA HB3 H 1 1.374 0.04 . 1 . . . . . 110 ALA HB . 16594 1 1291 . 1 1 110 110 ALA C C 13 177.408 0.4 . 1 . . . . . 110 ALA C . 16594 1 1292 . 1 1 110 110 ALA CA C 13 53.000 0.40 . 1 . . . . . 110 ALA CA . 16594 1 1293 . 1 1 110 110 ALA CB C 13 18.710 0.40 . 1 . . . . . 110 ALA CB . 16594 1 1294 . 1 1 110 110 ALA N N 15 118.992 0.40 . 1 . . . . . 110 ALA N . 16594 1 1295 . 1 1 111 111 ALA H H 1 7.247 0.04 . 1 . . . . . 111 ALA H . 16594 1 1296 . 1 1 111 111 ALA HA H 1 4.300 0.04 . 1 . . . . . 111 ALA HA . 16594 1 1297 . 1 1 111 111 ALA HB1 H 1 1.283 0.04 . 1 . . . . . 111 ALA HB . 16594 1 1298 . 1 1 111 111 ALA HB2 H 1 1.283 0.04 . 1 . . . . . 111 ALA HB . 16594 1 1299 . 1 1 111 111 ALA HB3 H 1 1.283 0.04 . 1 . . . . . 111 ALA HB . 16594 1 1300 . 1 1 111 111 ALA C C 13 176.488 0.4 . 1 . . . . . 111 ALA C . 16594 1 1301 . 1 1 111 111 ALA CA C 13 51.840 0.40 . 1 . . . . . 111 ALA CA . 16594 1 1302 . 1 1 111 111 ALA CB C 13 19.210 0.40 . 1 . . . . . 111 ALA CB . 16594 1 1303 . 1 1 111 111 ALA N N 15 120.857 0.40 . 1 . . . . . 111 ALA N . 16594 1 1304 . 1 1 112 112 LEU H H 1 7.214 0.04 . 1 . . . . . 112 LEU H . 16594 1 1305 . 1 1 112 112 LEU HA H 1 3.945 0.04 . 1 . . . . . 112 LEU HA . 16594 1 1306 . 1 1 112 112 LEU HB2 H 1 1.477 0.04 . 2 . . . . . 112 LEU HB2 . 16594 1 1307 . 1 1 112 112 LEU HB3 H 1 1.397 0.04 . 2 . . . . . 112 LEU HB3 . 16594 1 1308 . 1 1 112 112 LEU HD11 H 1 0.584 0.04 . 1 . . . . . 112 LEU HD1 . 16594 1 1309 . 1 1 112 112 LEU HD12 H 1 0.584 0.04 . 1 . . . . . 112 LEU HD1 . 16594 1 1310 . 1 1 112 112 LEU HD13 H 1 0.584 0.04 . 1 . . . . . 112 LEU HD1 . 16594 1 1311 . 1 1 112 112 LEU HD21 H 1 0.573 0.04 . 1 . . . . . 112 LEU HD2 . 16594 1 1312 . 1 1 112 112 LEU HD22 H 1 0.573 0.04 . 1 . . . . . 112 LEU HD2 . 16594 1 1313 . 1 1 112 112 LEU HD23 H 1 0.573 0.04 . 1 . . . . . 112 LEU HD2 . 16594 1 1314 . 1 1 112 112 LEU HG H 1 1.500 0.04 . 1 . . . . . 112 LEU HG . 16594 1 1315 . 1 1 112 112 LEU CA C 13 56.980 0.40 . 1 . . . . . 112 LEU CA . 16594 1 1316 . 1 1 112 112 LEU CB C 13 43.050 0.40 . 1 . . . . . 112 LEU CB . 16594 1 1317 . 1 1 112 112 LEU CD1 C 13 25.250 0.40 . 1 . . . . . 112 LEU CD1 . 16594 1 1318 . 1 1 112 112 LEU CD2 C 13 23.050 0.40 . 1 . . . . . 112 LEU CD2 . 16594 1 1319 . 1 1 112 112 LEU CG C 13 26.530 0.40 . 1 . . . . . 112 LEU CG . 16594 1 1320 . 1 1 112 112 LEU N N 15 126.316 0.40 . 1 . . . . . 112 LEU N . 16594 1 stop_ save_