################################### # 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_CD79a_cyt_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode CD79a_cyt_assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 19644 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 19644 1 2 '3D HN(ca)CO' 1 $sample_1 isotropic 19644 1 3 '3D HNCA' 1 $sample_1 isotropic 19644 1 4 '3D HNCACB' 1 $sample_1 isotropic 19644 1 5 '3D HNCO' . . isotropic 19644 1 6 '3D HN(CO)CA' 1 $sample_1 isotropic 19644 1 7 '3D HN(COCA)CB' 1 $sample_1 isotropic 19644 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 $TANSY 2 $Automated_processing_analysis_and_validation 19644 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 LEU C C 13 177.202 . . . . . . . 2 Leu C . 19644 1 2 . 1 1 1 1 LEU CA C 13 55.4056 . . . . . . . 2 Leu Ca . 19644 1 3 . 1 1 1 1 LEU CB C 13 42.4992 . . . . . . . 2 Leu Cb . 19644 1 4 . 1 1 2 2 ARG H H 1 8.44162 . . . . . . . 3 Arg H . 19644 1 5 . 1 1 2 2 ARG C C 13 176.144 . . . . . . . 3 Arg C . 19644 1 6 . 1 1 2 2 ARG CA C 13 56.0734 . . . . . . . 3 Arg Ca . 19644 1 7 . 1 1 2 2 ARG CB C 13 31.047 . . . . . . . 3 Arg Cb . 19644 1 8 . 1 1 2 2 ARG N N 15 123.126 . . . . . . . 3 Arg N . 19644 1 9 . 1 1 3 3 LYS H H 1 8.3404 . . . . . . . 4 Lys H . 19644 1 10 . 1 1 3 3 LYS C C 13 176.672 . . . . . . . 4 Lys C . 19644 1 11 . 1 1 3 3 LYS CA C 13 56.2921 . . . . . . . 4 Lys Ca . 19644 1 12 . 1 1 3 3 LYS CB C 13 32.9889 . . . . . . . 4 Lys Cb . 19644 1 13 . 1 1 3 3 LYS N N 15 123.823 . . . . . . . 4 Lys N . 19644 1 14 . 1 1 4 4 ARG H H 1 8.3947 . . . . . . . 5 Arg H . 19644 1 15 . 1 1 4 4 ARG N N 15 123.21 . . . . . . . 5 Arg N . 19644 1 16 . 1 1 5 5 TRP C C 13 176.424 . . . . . . . 6 Trp C . 19644 1 17 . 1 1 5 5 TRP CA C 13 57.3848 . . . . . . . 6 Trp Ca . 19644 1 18 . 1 1 5 5 TRP CB C 13 29.5604 . . . . . . . 6 Trp Cb . 19644 1 19 . 1 1 6 6 GLN H H 1 8.16638 . . . . . . . 7 Gln H . 19644 1 20 . 1 1 6 6 GLN C C 13 175.742 . . . . . . . 7 Gln C . 19644 1 21 . 1 1 6 6 GLN CA C 13 56.5057 . . . . . . . 7 Gln Ca . 19644 1 22 . 1 1 6 6 GLN CB C 13 29.3984 . . . . . . . 7 Gln Cb . 19644 1 23 . 1 1 6 6 GLN N N 15 122.105 . . . . . . . 7 Gln N . 19644 1 24 . 1 1 7 7 ASN H H 1 8.21553 . . . . . . . 8 Asn H . 19644 1 25 . 1 1 7 7 ASN C C 13 175.542 . . . . . . . 8 Asn C . 19644 1 26 . 1 1 7 7 ASN CA C 13 53.6875 . . . . . . . 8 Asn Ca . 19644 1 27 . 1 1 7 7 ASN CB C 13 38.8042 . . . . . . . 8 Asn Cb . 19644 1 28 . 1 1 7 7 ASN N N 15 119.434 . . . . . . . 8 Asn N . 19644 1 29 . 1 1 8 8 GLU H H 1 8.41856 . . . . . . . 9 Glu H . 19644 1 30 . 1 1 8 8 GLU C C 13 176.807 . . . . . . . 9 Glu C . 19644 1 31 . 1 1 8 8 GLU CA C 13 57.4413 . . . . . . . 9 Glu Ca . 19644 1 32 . 1 1 8 8 GLU CB C 13 30.0509 . . . . . . . 9 Glu Cb . 19644 1 33 . 1 1 8 8 GLU N N 15 121.957 . . . . . . . 9 Glu N . 19644 1 34 . 1 1 9 9 LYS H H 1 8.21675 . . . . . . . 10 Lys H . 19644 1 35 . 1 1 9 9 LYS C C 13 176.691 . . . . . . . 10 Lys C . 19644 1 36 . 1 1 9 9 LYS CA C 13 56.5919 . . . . . . . 10 Lys Ca . 19644 1 37 . 1 1 9 9 LYS CB C 13 32.5738 . . . . . . . 10 Lys Cb . 19644 1 38 . 1 1 9 9 LYS N N 15 121.844 . . . . . . . 10 Lys N . 19644 1 39 . 1 1 10 10 LEU H H 1 8.04453 . . . . . . . 11 Leu H . 19644 1 40 . 1 1 10 10 LEU C C 13 177.825 . . . . . . . 11 Leu C . 19644 1 41 . 1 1 10 10 LEU CA C 13 55.2192 . . . . . . . 11 Leu Ca . 19644 1 42 . 1 1 10 10 LEU CB C 13 42.5335 . . . . . . . 11 Leu Cb . 19644 1 43 . 1 1 10 10 LEU N N 15 122.567 . . . . . . . 11 Leu N . 19644 1 44 . 1 1 11 11 GLY H H 1 8.26158 . . . . . . . 12 Gly H . 19644 1 45 . 1 1 11 11 GLY C C 13 174.312 . . . . . . . 12 Gly C . 19644 1 46 . 1 1 11 11 GLY CA C 13 45.4192 . . . . . . . 12 Gly Ca . 19644 1 47 . 1 1 11 11 GLY N N 15 110.053 . . . . . . . 12 Gly N . 19644 1 48 . 1 1 12 12 LEU H H 1 8.07564 . . . . . . . 13 Leu H . 19644 1 49 . 1 1 12 12 LEU C C 13 177.296 . . . . . . . 13 Leu C . 19644 1 50 . 1 1 12 12 LEU CA C 13 55.2447 . . . . . . . 13 Leu Ca . 19644 1 51 . 1 1 12 12 LEU CB C 13 42.4091 . . . . . . . 13 Leu Cb . 19644 1 52 . 1 1 12 12 LEU N N 15 122.069 . . . . . . . 13 Leu N . 19644 1 53 . 1 1 13 13 ASP H H 1 8.41467 . . . . . . . 14 Asp H . 19644 1 54 . 1 1 13 13 ASP C C 13 176.005 . . . . . . . 14 Asp C . 19644 1 55 . 1 1 13 13 ASP CA C 13 54.2545 . . . . . . . 14 Asp Ca . 19644 1 56 . 1 1 13 13 ASP CB C 13 41.336 . . . . . . . 14 Asp Cb . 19644 1 57 . 1 1 13 13 ASP N N 15 121.664 . . . . . . . 14 Asp N . 19644 1 58 . 1 1 14 14 ALA H H 1 8.19135 . . . . . . . 15 Ala H . 19644 1 59 . 1 1 14 14 ALA C C 13 178.259 . . . . . . . 15 Ala C . 19644 1 60 . 1 1 14 14 ALA CA C 13 52.8766 . . . . . . . 15 Ala Ca . 19644 1 61 . 1 1 14 14 ALA CB C 13 19.3741 . . . . . . . 15 Ala Cb . 19644 1 62 . 1 1 14 14 ALA N N 15 125.047 . . . . . . . 15 Ala N . 19644 1 63 . 1 1 15 15 GLY H H 1 8.38537 . . . . . . . 16 Gly H . 19644 1 64 . 1 1 15 15 GLY C C 13 174.072 . . . . . . . 16 Gly C . 19644 1 65 . 1 1 15 15 GLY CA C 13 45.2846 . . . . . . . 16 Gly Ca . 19644 1 66 . 1 1 15 15 GLY N N 15 108.762 . . . . . . . 16 Gly N . 19644 1 67 . 1 1 16 16 ASP H H 1 8.17531 . . . . . . . 17 Asp H . 19644 1 68 . 1 1 16 16 ASP C C 13 176.288 . . . . . . . 17 Asp C . 19644 1 69 . 1 1 16 16 ASP CA C 13 54.4058 . . . . . . . 17 Asp Ca . 19644 1 70 . 1 1 16 16 ASP CB C 13 41.4514 . . . . . . . 17 Asp Cb . 19644 1 71 . 1 1 16 16 ASP N N 15 121.103 . . . . . . . 17 Asp N . 19644 1 72 . 1 1 17 17 GLU H H 1 8.3939 . . . . . . . 18 Glu H . 19644 1 73 . 1 1 17 17 GLU C C 13 176.058 . . . . . . . 18 Glu C . 19644 1 74 . 1 1 17 17 GLU CA C 13 56.6568 . . . . . . . 18 Glu Ca . 19644 1 75 . 1 1 17 17 GLU CB C 13 30.4017 . . . . . . . 18 Glu Cb . 19644 1 76 . 1 1 17 17 GLU N N 15 121.263 . . . . . . . 18 Glu N . 19644 1 77 . 1 1 18 18 TYR H H 1 8.19135 . . . . . . . 19 Tyr H . 19644 1 78 . 1 1 18 18 TYR C C 13 175.643 . . . . . . . 19 Tyr C . 19644 1 79 . 1 1 18 18 TYR CA C 13 57.7951 . . . . . . . 19 Tyr Ca . 19644 1 80 . 1 1 18 18 TYR CB C 13 39.1512 . . . . . . . 19 Tyr Cb . 19644 1 81 . 1 1 18 18 TYR N N 15 121.51 . . . . . . . 19 Tyr N . 19644 1 82 . 1 1 19 19 GLU H H 1 8.22961 . . . . . . . 20 Glu H . 19644 1 83 . 1 1 19 19 GLU C C 13 175.712 . . . . . . . 20 Glu C . 19644 1 84 . 1 1 19 19 GLU CA C 13 56.2199 . . . . . . . 20 Glu Ca . 19644 1 85 . 1 1 19 19 GLU CB C 13 30.8472 . . . . . . . 20 Glu Cb . 19644 1 86 . 1 1 19 19 GLU N N 15 123.524 . . . . . . . 20 Glu N . 19644 1 87 . 1 1 20 20 ASP H H 1 8.31016 . . . . . . . 21 Asp H . 19644 1 88 . 1 1 20 20 ASP C C 13 176.538 . . . . . . . 21 Asp C . 19644 1 89 . 1 1 20 20 ASP CA C 13 54.3884 . . . . . . . 21 Asp Ca . 19644 1 90 . 1 1 20 20 ASP CB C 13 41.4393 . . . . . . . 21 Asp Cb . 19644 1 91 . 1 1 20 20 ASP N N 15 122.692 . . . . . . . 21 Asp N . 19644 1 92 . 1 1 21 21 GLU H H 1 8.50953 . . . . . . . 22 Glu H . 19644 1 93 . 1 1 21 21 GLU C C 13 176.527 . . . . . . . 22 Glu C . 19644 1 94 . 1 1 21 21 GLU CA C 13 57.1914 . . . . . . . 22 Glu Ca . 19644 1 95 . 1 1 21 21 GLU CB C 13 30.2102 . . . . . . . 22 Glu Cb . 19644 1 96 . 1 1 21 21 GLU N N 15 123.092 . . . . . . . 22 Glu N . 19644 1 97 . 1 1 22 22 ASN H H 1 8.524 . . . . . . . 23 Asn H . 19644 1 98 . 1 1 22 22 ASN C C 13 175.331 . . . . . . . 23 Asn C . 19644 1 99 . 1 1 22 22 ASN CA C 13 53.5272 . . . . . . . 23 Asn Ca . 19644 1 100 . 1 1 22 22 ASN CB C 13 38.779 . . . . . . . 23 Asn Cb . 19644 1 101 . 1 1 22 22 ASN N N 15 119.92 . . . . . . . 23 Asn N . 19644 1 102 . 1 1 23 23 LEU H H 1 7.99065 . . . . . . . 24 Leu H . 19644 1 103 . 1 1 23 23 LEU C C 13 177.203 . . . . . . . 24 Leu C . 19644 1 104 . 1 1 23 23 LEU CA C 13 55.5577 . . . . . . . 24 Leu Ca . 19644 1 105 . 1 1 23 23 LEU CB C 13 42.2071 . . . . . . . 24 Leu Cb . 19644 1 106 . 1 1 23 23 LEU N N 15 122.665 . . . . . . . 24 Leu N . 19644 1 107 . 1 1 24 24 TYR H H 1 8.04912 . . . . . . . 25 Tyr H . 19644 1 108 . 1 1 24 24 TYR C C 13 175.966 . . . . . . . 25 Tyr C . 19644 1 109 . 1 1 24 24 TYR CA C 13 57.7508 . . . . . . . 25 Tyr Ca . 19644 1 110 . 1 1 24 24 TYR CB C 13 38.5613 . . . . . . . 25 Tyr Cb . 19644 1 111 . 1 1 24 24 TYR N N 15 120.358 . . . . . . . 25 Tyr N . 19644 1 112 . 1 1 25 25 GLU H H 1 8.16132 . . . . . . . 26 Glu H . 19644 1 113 . 1 1 25 25 GLU C C 13 176.827 . . . . . . . 26 Glu C . 19644 1 114 . 1 1 25 25 GLU CA C 13 56.8864 . . . . . . . 26 Glu Ca . 19644 1 115 . 1 1 25 25 GLU CB C 13 30.182 . . . . . . . 26 Glu Cb . 19644 1 116 . 1 1 25 25 GLU N N 15 123.345 . . . . . . . 26 Glu N . 19644 1 117 . 1 1 26 26 GLY H H 1 8.07034 . . . . . . . 27 Gly H . 19644 1 118 . 1 1 26 26 GLY C C 13 173.957 . . . . . . . 27 Gly C . 19644 1 119 . 1 1 26 26 GLY CA C 13 45.3647 . . . . . . . 27 Gly Ca . 19644 1 120 . 1 1 26 26 GLY N N 15 110.335 . . . . . . . 27 Gly N . 19644 1 121 . 1 1 27 27 LEU H H 1 7.94574 . . . . . . . 28 Leu H . 19644 1 122 . 1 1 27 27 LEU C C 13 176.925 . . . . . . . 28 Leu C . 19644 1 123 . 1 1 27 27 LEU CA C 13 55.0708 . . . . . . . 28 Leu Ca . 19644 1 124 . 1 1 27 27 LEU CB C 13 42.7054 . . . . . . . 28 Leu Cb . 19644 1 125 . 1 1 27 27 LEU N N 15 121.741 . . . . . . . 28 Leu N . 19644 1 126 . 1 1 28 28 ASN H H 1 8.53813 . . . . . . . 29 Asn H . 19644 1 127 . 1 1 28 28 ASN C C 13 175.319 . . . . . . . 29 Asn C . 19644 1 128 . 1 1 28 28 ASN CA C 13 53.0634 . . . . . . . 29 Asn Ca . 19644 1 129 . 1 1 28 28 ASN CB C 13 38.6264 . . . . . . . 29 Asn Cb . 19644 1 130 . 1 1 28 28 ASN N N 15 120.586 . . . . . . . 29 Asn N . 19644 1 131 . 1 1 29 29 LEU H H 1 8.31475 . . . . . . . 30 Leu H . 19644 1 132 . 1 1 29 29 LEU C C 13 177.477 . . . . . . . 30 Leu C . 19644 1 133 . 1 1 29 29 LEU CA C 13 55.4867 . . . . . . . 30 Leu Ca . 19644 1 134 . 1 1 29 29 LEU CB C 13 42.1247 . . . . . . . 30 Leu Cb . 19644 1 135 . 1 1 29 29 LEU N N 15 123.859 . . . . . . . 30 Leu N . 19644 1 136 . 1 1 30 30 ASP H H 1 8.27495 . . . . . . . 31 Asp H . 19644 1 137 . 1 1 30 30 ASP C C 13 176.205 . . . . . . . 31 Asp C . 19644 1 138 . 1 1 30 30 ASP CA C 13 54.7432 . . . . . . . 31 Asp Ca . 19644 1 139 . 1 1 30 30 ASP CB C 13 41.1284 . . . . . . . 31 Asp Cb . 19644 1 140 . 1 1 30 30 ASP N N 15 120.926 . . . . . . . 31 Asp N . 19644 1 141 . 1 1 31 31 ASP H H 1 8.11874 . . . . . . . 32 Asp H . 19644 1 142 . 1 1 31 31 ASP C C 13 176.644 . . . . . . . 32 Asp C . 19644 1 143 . 1 1 31 31 ASP CA C 13 54.483 . . . . . . . 32 Asp Ca . 19644 1 144 . 1 1 31 31 ASP CB C 13 41.151 . . . . . . . 32 Asp Cb . 19644 1 145 . 1 1 31 31 ASP N N 15 121.104 . . . . . . . 32 Asp N . 19644 1 146 . 1 1 32 32 CYS H H 1 8.33711 . . . . . . . 33 Cys H . 19644 1 147 . 1 1 32 32 CYS C C 13 175.335 . . . . . . . 33 Cys C . 19644 1 148 . 1 1 32 32 CYS CA C 13 59.2254 . . . . . . . 33 Cys Ca . 19644 1 149 . 1 1 32 32 CYS CB C 13 28.045 . . . . . . . 33 Cys Cb . 19644 1 150 . 1 1 32 32 CYS N N 15 120.544 . . . . . . . 33 Cys N . 19644 1 151 . 1 1 33 33 SER H H 1 8.41953 . . . . . . . 34 Ser H . 19644 1 152 . 1 1 33 33 SER C C 13 174.927 . . . . . . . 34 Ser C . 19644 1 153 . 1 1 33 33 SER CA C 13 59.5557 . . . . . . . 34 Ser Ca . 19644 1 154 . 1 1 33 33 SER CB C 13 63.5135 . . . . . . . 34 Ser Cb . 19644 1 155 . 1 1 33 33 SER N N 15 118.955 . . . . . . . 34 Ser N . 19644 1 156 . 1 1 34 34 MET H H 1 8.1814 . . . . . . . 35 Met H . 19644 1 157 . 1 1 34 34 MET C C 13 176.071 . . . . . . . 35 Met C . 19644 1 158 . 1 1 34 34 MET CA C 13 56.0894 . . . . . . . 35 Met Ca . 19644 1 159 . 1 1 34 34 MET CB C 13 32.4001 . . . . . . . 35 Met Cb . 19644 1 160 . 1 1 34 34 MET N N 15 122.041 . . . . . . . 35 Met N . 19644 1 161 . 1 1 35 35 TYR H H 1 7.94973 . . . . . . . 36 Tyr H . 19644 1 162 . 1 1 35 35 TYR C C 13 175.964 . . . . . . . 36 Tyr C . 19644 1 163 . 1 1 35 35 TYR CA C 13 58.0498 . . . . . . . 36 Tyr Ca . 19644 1 164 . 1 1 35 35 TYR CB C 13 38.7248 . . . . . . . 36 Tyr Cb . 19644 1 165 . 1 1 35 35 TYR N N 15 120.9 . . . . . . . 36 Tyr N . 19644 1 166 . 1 1 36 36 GLU H H 1 8.15165 . . . . . . . 37 Glu H . 19644 1 167 . 1 1 36 36 GLU C C 13 176.046 . . . . . . . 37 Glu C . 19644 1 168 . 1 1 36 36 GLU CA C 13 56.7764 . . . . . . . 37 Glu Ca . 19644 1 169 . 1 1 36 36 GLU CB C 13 30.6847 . . . . . . . 37 Glu Cb . 19644 1 170 . 1 1 36 36 GLU N N 15 122.765 . . . . . . . 37 Glu N . 19644 1 171 . 1 1 37 37 ASP H H 1 8.31534 . . . . . . . 38 Asp H . 19644 1 172 . 1 1 37 37 ASP C C 13 177.136 . . . . . . . 38 Asp C . 19644 1 173 . 1 1 37 37 ASP CA C 13 54.4697 . . . . . . . 38 Asp Ca . 19644 1 174 . 1 1 37 37 ASP CB C 13 41.0617 . . . . . . . 38 Asp Cb . 19644 1 175 . 1 1 37 37 ASP N N 15 122.176 . . . . . . . 38 Asp N . 19644 1 176 . 1 1 38 38 ILE H H 1 8.12394 . . . . . . . 39 Ile H . 19644 1 177 . 1 1 38 38 ILE C C 13 177.149 . . . . . . . 39 Ile C . 19644 1 178 . 1 1 38 38 ILE CA C 13 62.1252 . . . . . . . 39 Ile Ca . 19644 1 179 . 1 1 38 38 ILE CB C 13 38.5208 . . . . . . . 39 Ile Cb . 19644 1 180 . 1 1 38 38 ILE N N 15 122.159 . . . . . . . 39 Ile N . 19644 1 181 . 1 1 39 39 SER H H 1 8.35497 . . . . . . . 40 Ser H . 19644 1 182 . 1 1 39 39 SER C C 13 175.303 . . . . . . . 40 Ser C . 19644 1 183 . 1 1 39 39 SER CA C 13 59.5312 . . . . . . . 40 Ser Ca . 19644 1 184 . 1 1 39 39 SER CB C 13 63.4157 . . . . . . . 40 Ser Cb . 19644 1 185 . 1 1 39 39 SER N N 15 119.148 . . . . . . . 40 Ser N . 19644 1 186 . 1 1 40 40 ARG H H 1 8.07456 . . . . . . . 41 Arg H . 19644 1 187 . 1 1 40 40 ARG C C 13 177.093 . . . . . . . 41 Arg C . 19644 1 188 . 1 1 40 40 ARG CA C 13 56.6938 . . . . . . . 41 Arg Ca . 19644 1 189 . 1 1 40 40 ARG CB C 13 30.5431 . . . . . . . 41 Arg Cb . 19644 1 190 . 1 1 40 40 ARG N N 15 122.997 . . . . . . . 41 Arg N . 19644 1 191 . 1 1 41 41 GLY H H 1 8.16898 . . . . . . . 42 Gly H . 19644 1 192 . 1 1 41 41 GLY C C 13 174.436 . . . . . . . 42 Gly C . 19644 1 193 . 1 1 41 41 GLY CA C 13 45.4192 . . . . . . . 42 Gly Ca . 19644 1 194 . 1 1 41 41 GLY N N 15 109.359 . . . . . . . 42 Gly N . 19644 1 195 . 1 1 42 42 LEU H H 1 8.06499 . . . . . . . 43 Leu H . 19644 1 196 . 1 1 42 42 LEU C C 13 177.811 . . . . . . . 43 Leu C . 19644 1 197 . 1 1 42 42 LEU CA C 13 55.2414 . . . . . . . 43 Leu Ca . 19644 1 198 . 1 1 42 42 LEU CB C 13 42.245 . . . . . . . 43 Leu Cb . 19644 1 199 . 1 1 42 42 LEU N N 15 122.064 . . . . . . . 43 Leu N . 19644 1 200 . 1 1 43 43 GLN H H 1 8.39943 . . . . . . . 44 Gln H . 19644 1 201 . 1 1 43 43 GLN C C 13 176.605 . . . . . . . 44 Gln C . 19644 1 202 . 1 1 43 43 GLN CA C 13 56.1796 . . . . . . . 44 Gln Ca . 19644 1 203 . 1 1 43 43 GLN CB C 13 29.321 . . . . . . . 44 Gln Cb . 19644 1 204 . 1 1 43 43 GLN N N 15 121.428 . . . . . . . 44 Gln N . 19644 1 205 . 1 1 44 44 GLY H H 1 8.39174 . . . . . . . 45 Gly H . 19644 1 206 . 1 1 44 44 GLY C C 13 174.246 . . . . . . . 45 Gly C . 19644 1 207 . 1 1 44 44 GLY CA C 13 45.42 . . . . . . . 45 Gly Ca . 19644 1 208 . 1 1 44 44 GLY N N 15 110.613 . . . . . . . 45 Gly N . 19644 1 209 . 1 1 45 45 THR H H 1 7.98442 . . . . . . . 46 Thr H . 19644 1 210 . 1 1 45 45 THR C C 13 174.442 . . . . . . . 46 Thr C . 19644 1 211 . 1 1 45 45 THR CA C 13 61.8921 . . . . . . . 46 Thr Ca . 19644 1 212 . 1 1 45 45 THR CB C 13 69.9897 . . . . . . . 46 Thr Cb . 19644 1 213 . 1 1 45 45 THR N N 15 114.194 . . . . . . . 46 Thr N . 19644 1 214 . 1 1 46 46 TYR H H 1 8.26009 . . . . . . . 47 Tyr H . 19644 1 215 . 1 1 46 46 TYR C C 13 175.533 . . . . . . . 47 Tyr C . 19644 1 216 . 1 1 46 46 TYR CA C 13 58.1342 . . . . . . . 47 Tyr Ca . 19644 1 217 . 1 1 46 46 TYR CB C 13 38.7405 . . . . . . . 47 Tyr Cb . 19644 1 218 . 1 1 46 46 TYR N N 15 123.395 . . . . . . . 47 Tyr N . 19644 1 219 . 1 1 47 47 GLN H H 1 8.1158 . . . . . . . 48 Gln H . 19644 1 220 . 1 1 47 47 GLN C C 13 174.958 . . . . . . . 48 Gln C . 19644 1 221 . 1 1 47 47 GLN CA C 13 55.4763 . . . . . . . 48 Gln Ca . 19644 1 222 . 1 1 47 47 GLN CB C 13 29.9421 . . . . . . . 48 Gln Cb . 19644 1 223 . 1 1 47 47 GLN N N 15 123.178 . . . . . . . 48 Gln N . 19644 1 224 . 1 1 48 48 ASP H H 1 8.31529 . . . . . . . 49 Asp H . 19644 1 225 . 1 1 48 48 ASP C C 13 176.65 . . . . . . . 49 Asp C . 19644 1 226 . 1 1 48 48 ASP CA C 13 54.1721 . . . . . . . 49 Asp Ca . 19644 1 227 . 1 1 48 48 ASP CB C 13 41.2388 . . . . . . . 49 Asp Cb . 19644 1 228 . 1 1 48 48 ASP N N 15 123.016 . . . . . . . 49 Asp N . 19644 1 229 . 1 1 49 49 VAL H H 1 8.18335 . . . . . . . 50 Val H . 19644 1 230 . 1 1 49 49 VAL C C 13 177.092 . . . . . . . 50 Val C . 19644 1 231 . 1 1 49 49 VAL CA C 13 62.8287 . . . . . . . 50 Val Ca . 19644 1 232 . 1 1 49 49 VAL CB C 13 32.2621 . . . . . . . 50 Val Cb . 19644 1 233 . 1 1 49 49 VAL N N 15 121.374 . . . . . . . 50 Val N . 19644 1 234 . 1 1 50 50 GLY H H 1 8.50282 . . . . . . . 51 Gly H . 19644 1 235 . 1 1 50 50 GLY C C 13 174.496 . . . . . . . 51 Gly C . 19644 1 236 . 1 1 50 50 GLY CA C 13 45.5241 . . . . . . . 51 Gly Ca . 19644 1 237 . 1 1 50 50 GLY N N 15 112.49 . . . . . . . 51 Gly N . 19644 1 238 . 1 1 51 51 SER H H 1 8.09732 . . . . . . . 52 Ser H . 19644 1 239 . 1 1 51 51 SER C C 13 174.604 . . . . . . . 52 Ser C . 19644 1 240 . 1 1 51 51 SER CA C 13 58.4286 . . . . . . . 52 Ser Ca . 19644 1 241 . 1 1 51 51 SER CB C 13 63.8443 . . . . . . . 52 Ser Cb . 19644 1 242 . 1 1 51 51 SER N N 15 116.258 . . . . . . . 52 Ser N . 19644 1 243 . 1 1 52 52 LEU H H 1 8.16728 . . . . . . . 53 Leu H . 19644 1 244 . 1 1 52 52 LEU C C 13 177.064 . . . . . . . 53 Leu C . 19644 1 245 . 1 1 52 52 LEU CA C 13 55.3252 . . . . . . . 53 Leu Ca . 19644 1 246 . 1 1 52 52 LEU CB C 13 42.4188 . . . . . . . 53 Leu Cb . 19644 1 247 . 1 1 52 52 LEU N N 15 124.19 . . . . . . . 53 Leu N . 19644 1 248 . 1 1 53 53 ASN H H 1 8.44669 . . . . . . . 54 Asn H . 19644 1 249 . 1 1 53 53 ASN C C 13 175.286 . . . . . . . 54 Asn C . 19644 1 250 . 1 1 53 53 ASN CA C 13 53.0888 . . . . . . . 54 Asn Ca . 19644 1 251 . 1 1 53 53 ASN CB C 13 38.7797 . . . . . . . 54 Asn Cb . 19644 1 252 . 1 1 53 53 ASN N N 15 120.605 . . . . . . . 54 Asn N . 19644 1 253 . 1 1 54 54 ILE H H 1 8.12865 . . . . . . . 55 Ile H . 19644 1 254 . 1 1 54 54 ILE C C 13 176.823 . . . . . . . 55 Ile C . 19644 1 255 . 1 1 54 54 ILE CA C 13 61.67 . . . . . . . 55 Ile Ca . 19644 1 256 . 1 1 54 54 ILE CB C 13 38.5803 . . . . . . . 55 Ile Cb . 19644 1 257 . 1 1 54 54 ILE N N 15 121.917 . . . . . . . 55 Ile N . 19644 1 258 . 1 1 55 55 GLY H H 1 8.43546 . . . . . . . 56 Gly H . 19644 1 259 . 1 1 55 55 GLY C C 13 173.904 . . . . . . . 56 Gly C . 19644 1 260 . 1 1 55 55 GLY CA C 13 45.1851 . . . . . . . 56 Gly Ca . 19644 1 261 . 1 1 55 55 GLY N N 15 113.011 . . . . . . . 56 Gly N . 19644 1 262 . 1 1 56 56 ASP H H 1 8.15994 . . . . . . . 57 Asp H . 19644 1 263 . 1 1 56 56 ASP C C 13 176.464 . . . . . . . 57 Asp C . 19644 1 264 . 1 1 56 56 ASP CA C 13 54.3931 . . . . . . . 57 Asp Ca . 19644 1 265 . 1 1 56 56 ASP CB C 13 41.1912 . . . . . . . 57 Asp Cb . 19644 1 266 . 1 1 56 56 ASP N N 15 121.51 . . . . . . . 57 Asp N . 19644 1 267 . 1 1 57 57 VAL H H 1 8.05652 . . . . . . . 58 Val H . 19644 1 268 . 1 1 57 57 VAL C C 13 176.157 . . . . . . . 58 Val C . 19644 1 269 . 1 1 57 57 VAL CA C 13 62.4849 . . . . . . . 58 Val Ca . 19644 1 270 . 1 1 57 57 VAL CB C 13 32.7981 . . . . . . . 58 Val Cb . 19644 1 271 . 1 1 57 57 VAL N N 15 121.407 . . . . . . . 58 Val N . 19644 1 272 . 1 1 58 58 GLN H H 1 8.49507 . . . . . . . 59 Gln H . 19644 1 273 . 1 1 58 58 GLN C C 13 175.78 . . . . . . . 59 Gln C . 19644 1 274 . 1 1 58 58 GLN CA C 13 55.5503 . . . . . . . 59 Gln Ca . 19644 1 275 . 1 1 58 58 GLN CB C 13 29.4002 . . . . . . . 59 Gln Cb . 19644 1 276 . 1 1 58 58 GLN N N 15 125.193 . . . . . . . 59 Gln N . 19644 1 277 . 1 1 59 59 LEU H H 1 8.28166 . . . . . . . 60 Leu H . 19644 1 278 . 1 1 59 59 LEU C C 13 177.33 . . . . . . . 60 Leu C . 19644 1 279 . 1 1 59 59 LEU CA C 13 55.1111 . . . . . . . 60 Leu Ca . 19644 1 280 . 1 1 59 59 LEU CB C 13 42.5675 . . . . . . . 60 Leu Cb . 19644 1 281 . 1 1 59 59 LEU N N 15 124.984 . . . . . . . 60 Leu N . 19644 1 282 . 1 1 60 60 GLU H H 1 8.35544 . . . . . . . 61 Glu H . 19644 1 283 . 1 1 60 60 GLU C C 13 176.005 . . . . . . . 61 Glu C . 19644 1 284 . 1 1 60 60 GLU CA C 13 56.3822 . . . . . . . 61 Glu Ca . 19644 1 285 . 1 1 60 60 GLU CB C 13 30.3595 . . . . . . . 61 Glu Cb . 19644 1 286 . 1 1 60 60 GLU N N 15 122.699 . . . . . . . 61 Glu N . 19644 1 287 . 1 1 61 61 LYS H H 1 8.34205 . . . . . . . 62 Lys H . 19644 1 288 . 1 1 61 61 LYS N N 15 125.192 . . . . . . . 62 Lys N . 19644 1 stop_ save_