################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 52244 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'H2A Chemical Shifts' _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N TROSY' . . . 52244 1 2 '2D 1H-15N TROSY' . . . 52244 1 3 '2D 1H-15N TROSY' . . . 52244 1 4 '3D HNCO' . . . 52244 1 5 '3D HNCO' . . . 52244 1 6 '3D HN(CA)CO' . . . 52244 1 7 '3D HNCA' . . . 52244 1 8 '3D HN(CO)CA' . . . 52244 1 9 '3D HNCACB' . . . 52244 1 10 '3D HN(CO)CACB' . . . 52244 1 11 '3D HN(CO)CACB' . . . 52244 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $software_3 . . 52244 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 3 3 ARG C C 13 177.140000 0 . . . . . . . 3 ARG CO . 52244 1 2 . 1 . 1 4 4 GLY H H 1 8.509710 0 . . . . . . . 4 GLY HN . 52244 1 3 . 1 . 1 4 4 GLY C C 13 174.330000 0 . . . . . . . 4 GLY CO . 52244 1 4 . 1 . 1 4 4 GLY CA C 13 45.250000 0 . . . . . . . 4 GLY CA . 52244 1 5 . 1 . 1 4 4 GLY N N 15 110.360390 0 . . . . . . . 4 GLY N . 52244 1 6 . 1 . 1 5 5 LYS H H 1 8.250240 0 . . . . . . . 5 LYS HN . 52244 1 7 . 1 . 1 5 5 LYS C C 13 177.010000 0 . . . . . . . 5 LYS CO . 52244 1 8 . 1 . 1 5 5 LYS CA C 13 56.510000 0 . . . . . . . 5 LYS CA . 52244 1 9 . 1 . 1 5 5 LYS N N 15 121.331150 0 . . . . . . . 5 LYS N . 52244 1 10 . 1 . 1 6 6 GLN H H 1 8.483920 0 . . . . . . . 6 GLN HN . 52244 1 11 . 1 . 1 6 6 GLN C C 13 173.660000 0 . . . . . . . 6 GLN CO . 52244 1 12 . 1 . 1 6 6 GLN CA C 13 56.020000 0 . . . . . . . 6 GLN CA . 52244 1 13 . 1 . 1 6 6 GLN N N 15 121.675380 0 . . . . . . . 6 GLN N . 52244 1 14 . 1 . 1 7 7 GLY H H 1 8.421980 0 . . . . . . . 7 GLY HN . 52244 1 15 . 1 . 1 7 7 GLY C C 13 174.790000 0 . . . . . . . 7 GLY CO . 52244 1 16 . 1 . 1 7 7 GLY N N 15 110.583200 0 . . . . . . . 7 GLY N . 52244 1 17 . 1 . 1 8 8 GLY H H 1 8.275400 0 . . . . . . . 8 GLY HN . 52244 1 18 . 1 . 1 8 8 GLY CA C 13 45.330000 0 . . . . . . . 8 GLY CA . 52244 1 19 . 1 . 1 8 8 GLY N N 15 109.096220 0 . . . . . . . 8 GLY N . 52244 1 20 . 1 . 1 11 11 ARG C C 13 176.120230 0 . . . . . . . 11 ARG CO . 52244 1 21 . 1 . 1 11 11 ARG CA C 13 55.790000 0 . . . . . . . 11 ARG CA . 52244 1 22 . 1 . 1 12 12 ALA H H 1 8.312440 0 . . . . . . . 12 ALA HN . 52244 1 23 . 1 . 1 12 12 ALA C C 13 177.721520 0 . . . . . . . 12 ALA CO . 52244 1 24 . 1 . 1 12 12 ALA CA C 13 52.296380 0 . . . . . . . 12 ALA CA . 52244 1 25 . 1 . 1 12 12 ALA CB C 13 18.360000 0 . . . . . . . 12 ALA CB . 52244 1 26 . 1 . 1 12 12 ALA N N 15 125.741680 0 . . . . . . . 12 ALA N . 52244 1 27 . 1 . 1 13 13 LYS H H 1 8.192090 0 . . . . . . . 13 LYS HN . 52244 1 28 . 1 . 1 13 13 LYS C C 13 176.597080 0 . . . . . . . 13 LYS CO . 52244 1 29 . 1 . 1 13 13 LYS CA C 13 55.790000 0 . . . . . . . 13 LYS CA . 52244 1 30 . 1 . 1 13 13 LYS N N 15 120.569860 0 . . . . . . . 13 LYS N . 52244 1 31 . 1 . 1 14 14 ALA H H 1 8.351200 0 . . . . . . . 14 ALA HN . 52244 1 32 . 1 . 1 14 14 ALA C C 13 177.973470 0 . . . . . . . 14 ALA CO . 52244 1 33 . 1 . 1 14 14 ALA CA C 13 52.326530 0 . . . . . . . 14 ALA CA . 52244 1 34 . 1 . 1 14 14 ALA N N 15 125.522770 0 . . . . . . . 14 ALA N . 52244 1 35 . 1 . 1 15 15 LYS H H 1 8.326430 0 . . . . . . . 15 LYS HN . 52244 1 36 . 1 . 1 15 15 LYS C C 13 177.000000 0 . . . . . . . 15 LYS CO . 52244 1 37 . 1 . 1 15 15 LYS CA C 13 56.090100 0 . . . . . . . 15 LYS CA . 52244 1 38 . 1 . 1 15 15 LYS N N 15 120.823660 0 . . . . . . . 15 LYS N . 52244 1 39 . 1 . 1 16 16 THR H H 1 8.089870 0 . . . . . . . 16 THR HN . 52244 1 40 . 1 . 1 16 16 THR C C 13 176.180000 0 . . . . . . . 16 THR CO . 52244 1 41 . 1 . 1 16 16 THR CA C 13 61.780000 0 . . . . . . . 16 THR CA . 52244 1 42 . 1 . 1 16 16 THR N N 15 115.246090 0 . . . . . . . 16 THR N . 52244 1 43 . 1 . 1 17 17 ARG H H 1 8.574000 0 . . . . . . . 17 ARG HN . 52244 1 44 . 1 . 1 17 17 ARG C C 13 176.770000 0 . . . . . . . 17 ARG CO . 52244 1 45 . 1 . 1 17 17 ARG CA C 13 56.300000 0 . . . . . . . 17 ARG CA . 52244 1 46 . 1 . 1 17 17 ARG CB C 13 32.170000 0 . . . . . . . 17 ARG CB . 52244 1 47 . 1 . 1 17 17 ARG N N 15 121.780000 0 . . . . . . . 17 ARG N . 52244 1 48 . 1 . 1 21 21 ALA C C 13 177.568810 0 . . . . . . . 21 ALA CO . 52244 1 49 . 1 . 1 21 21 ALA CA C 13 52.200000 0 . . . . . . . 21 ALA CA . 52244 1 50 . 1 . 1 22 22 GLY H H 1 7.970720 0 . . . . . . . 22 GLY HN . 52244 1 51 . 1 . 1 22 22 GLY C C 13 173.537830 0 . . . . . . . 22 GLY CO . 52244 1 52 . 1 . 1 22 22 GLY CA C 13 44.297500 0 . . . . . . . 22 GLY CA . 52244 1 53 . 1 . 1 22 22 GLY N N 15 107.609760 0 . . . . . . . 22 GLY N . 52244 1 54 . 1 . 1 23 23 LEU H H 1 8.023150 0 . . . . . . . 23 LEU HN . 52244 1 55 . 1 . 1 23 23 LEU C C 13 175.688310 0 . . . . . . . 23 LEU CO . 52244 1 56 . 1 . 1 23 23 LEU CA C 13 54.965450 0 . . . . . . . 23 LEU CA . 52244 1 57 . 1 . 1 23 23 LEU CB C 13 41.574780 0 . . . . . . . 23 LEU CB . 52244 1 58 . 1 . 1 23 23 LEU N N 15 121.739220 0 . . . . . . . 23 LEU N . 52244 1 59 . 1 . 1 24 24 GLN H H 1 7.764230 0 . . . . . . . 24 GLN HN . 52244 1 60 . 1 . 1 24 24 GLN C C 13 175.510000 0 . . . . . . . 24 GLN CO . 52244 1 61 . 1 . 1 24 24 GLN CA C 13 51.904660 0 . . . . . . . 24 GLN CA . 52244 1 62 . 1 . 1 24 24 GLN N N 15 122.223510 0 . . . . . . . 24 GLN N . 52244 1 63 . 1 . 1 26 26 PRO C C 13 176.256320 0 . . . . . . . 26 PRO CO . 52244 1 64 . 1 . 1 26 26 PRO CA C 13 61.526150 0 . . . . . . . 26 PRO CA . 52244 1 65 . 1 . 1 26 26 PRO CB C 13 30.180000 0 . . . . . . . 26 PRO CB . 52244 1 66 . 1 . 1 27 27 VAL H H 1 8.205320 0 . . . . . . . 27 VAL HN . 52244 1 67 . 1 . 1 27 27 VAL C C 13 177.510000 0 . . . . . . . 27 VAL CO . 52244 1 68 . 1 . 1 27 27 VAL CA C 13 66.542950 0 . . . . . . . 27 VAL CA . 52244 1 69 . 1 . 1 27 27 VAL CB C 13 30.787090 0 . . . . . . . 27 VAL CB . 52244 1 70 . 1 . 1 27 27 VAL N N 15 128.228220 0 . . . . . . . 27 VAL N . 52244 1 71 . 1 . 1 28 28 GLY H H 1 8.774060 0 . . . . . . . 28 GLY HN . 52244 1 72 . 1 . 1 28 28 GLY C C 13 177.369930 0 . . . . . . . 28 GLY CO . 52244 1 73 . 1 . 1 28 28 GLY N N 15 107.177950 0 . . . . . . . 28 GLY N . 52244 1 74 . 1 . 1 29 29 ARG H H 1 7.270080 0 . . . . . . . 29 ARG HN . 52244 1 75 . 1 . 1 29 29 ARG CB C 13 28.640000 0 . . . . . . . 29 ARG CB . 52244 1 76 . 1 . 1 29 29 ARG N N 15 121.766310 0 . . . . . . . 29 ARG N . 52244 1 77 . 1 . 1 30 30 VAL H H 1 7.800180 0 . . . . . . . 30 VAL HN . 52244 1 78 . 1 . 1 30 30 VAL C C 13 177.497360 0 . . . . . . . 30 VAL CO . 52244 1 79 . 1 . 1 30 30 VAL CA C 13 66.706880 0 . . . . . . . 30 VAL CA . 52244 1 80 . 1 . 1 30 30 VAL CB C 13 30.220000 0 . . . . . . . 30 VAL CB . 52244 1 81 . 1 . 1 30 30 VAL N N 15 119.850700 0 . . . . . . . 30 VAL N . 52244 1 82 . 1 . 1 31 31 HIS H H 1 8.793400 0 . . . . . . . 31 HIS HN . 52244 1 83 . 1 . 1 31 31 HIS C C 13 177.406980 0 . . . . . . . 31 HIS CO . 52244 1 84 . 1 . 1 31 31 HIS CA C 13 59.300350 0 . . . . . . . 31 HIS CA . 52244 1 85 . 1 . 1 31 31 HIS CB C 13 30.775490 0 . . . . . . . 31 HIS CB . 52244 1 86 . 1 . 1 31 31 HIS N N 15 120.268580 0 . . . . . . . 31 HIS N . 52244 1 87 . 1 . 1 32 32 ARG H H 1 8.001900 0 . . . . . . . 32 ARG HN . 52244 1 88 . 1 . 1 32 32 ARG C C 13 181.290140 0 . . . . . . . 32 ARG CO . 52244 1 89 . 1 . 1 32 32 ARG CA C 13 59.269350 0 . . . . . . . 32 ARG CA . 52244 1 90 . 1 . 1 32 32 ARG CB C 13 28.760150 0 . . . . . . . 32 ARG CB . 52244 1 91 . 1 . 1 32 32 ARG N N 15 118.859920 0 . . . . . . . 32 ARG N . 52244 1 92 . 1 . 1 33 33 LEU H H 1 8.444290 0 . . . . . . . 33 LEU HN . 52244 1 93 . 1 . 1 33 33 LEU C C 13 178.796540 0 . . . . . . . 33 LEU CO . 52244 1 94 . 1 . 1 33 33 LEU CA C 13 57.353270 0 . . . . . . . 33 LEU CA . 52244 1 95 . 1 . 1 33 33 LEU CB C 13 41.970000 0 . . . . . . . 33 LEU CB . 52244 1 96 . 1 . 1 33 33 LEU N N 15 119.688980 0 . . . . . . . 33 LEU N . 52244 1 97 . 1 . 1 34 34 LEU H H 1 8.426360 0 . . . . . . . 34 LEU HN . 52244 1 98 . 1 . 1 34 34 LEU C C 13 178.975000 0 . . . . . . . 34 LEU CO . 52244 1 99 . 1 . 1 34 34 LEU CA C 13 57.592710 0 . . . . . . . 34 LEU CA . 52244 1 100 . 1 . 1 34 34 LEU CB C 13 41.400000 0 . . . . . . . 34 LEU CB . 52244 1 101 . 1 . 1 34 34 LEU N N 15 119.747530 0 . . . . . . . 34 LEU N . 52244 1 102 . 1 . 1 35 35 ARG H H 1 8.142320 0 . . . . . . . 35 ARG HN . 52244 1 103 . 1 . 1 35 35 ARG C C 13 179.494510 0 . . . . . . . 35 ARG CO . 52244 1 104 . 1 . 1 35 35 ARG CA C 13 58.502280 0 . . . . . . . 35 ARG CA . 52244 1 105 . 1 . 1 35 35 ARG CB C 13 29.421230 0 . . . . . . . 35 ARG CB . 52244 1 106 . 1 . 1 35 35 ARG N N 15 118.416550 0 . . . . . . . 35 ARG N . 52244 1 107 . 1 . 1 36 36 LYS H H 1 8.767860 0 . . . . . . . 36 LYS HN . 52244 1 108 . 1 . 1 36 36 LYS C C 13 177.956190 0 . . . . . . . 36 LYS CO . 52244 1 109 . 1 . 1 36 36 LYS CA C 13 57.312030 0 . . . . . . . 36 LYS CA . 52244 1 110 . 1 . 1 36 36 LYS CB C 13 31.440000 0 . . . . . . . 36 LYS CB . 52244 1 111 . 1 . 1 36 36 LYS N N 15 119.711750 0 . . . . . . . 36 LYS N . 52244 1 112 . 1 . 1 37 37 GLY H H 1 7.531920 0 . . . . . . . 37 GLY HN . 52244 1 113 . 1 . 1 37 37 GLY C C 13 172.911490 0 . . . . . . . 37 GLY CO . 52244 1 114 . 1 . 1 37 37 GLY CA C 13 44.949870 0 . . . . . . . 37 GLY CA . 52244 1 115 . 1 . 1 37 37 GLY N N 15 103.980320 0 . . . . . . . 37 GLY N . 52244 1 116 . 1 . 1 38 38 ASN H H 1 7.849530 0 . . . . . . . 38 ASN HN . 52244 1 117 . 1 . 1 38 38 ASN C C 13 174.666080 0 . . . . . . . 38 ASN CO . 52244 1 118 . 1 . 1 38 38 ASN CA C 13 53.729340 0 . . . . . . . 38 ASN CA . 52244 1 119 . 1 . 1 38 38 ASN CB C 13 36.280000 0 . . . . . . . 38 ASN CB . 52244 1 120 . 1 . 1 38 38 ASN N N 15 115.301890 0 . . . . . . . 38 ASN N . 52244 1 121 . 1 . 1 39 39 TYR H H 1 7.968490 0 . . . . . . . 39 TYR HN . 52244 1 122 . 1 . 1 39 39 TYR C C 13 176.346860 0 . . . . . . . 39 TYR CO . 52244 1 123 . 1 . 1 39 39 TYR CA C 13 59.761190 0 . . . . . . . 39 TYR CA . 52244 1 124 . 1 . 1 39 39 TYR CB C 13 38.222060 0 . . . . . . . 39 TYR CB . 52244 1 125 . 1 . 1 39 39 TYR N N 15 117.364560 0 . . . . . . . 39 TYR N . 52244 1 126 . 1 . 1 40 40 ALA H H 1 8.080130 0 . . . . . . . 40 ALA HN . 52244 1 127 . 1 . 1 40 40 ALA C C 13 175.740490 0 . . . . . . . 40 ALA CO . 52244 1 128 . 1 . 1 40 40 ALA CA C 13 51.302530 0 . . . . . . . 40 ALA CA . 52244 1 129 . 1 . 1 40 40 ALA CB C 13 20.849280 0 . . . . . . . 40 ALA CB . 52244 1 130 . 1 . 1 40 40 ALA N N 15 118.968720 0 . . . . . . . 40 ALA N . 52244 1 131 . 1 . 1 41 41 GLU H H 1 8.494940 0 . . . . . . . 41 GLU HN . 52244 1 132 . 1 . 1 41 41 GLU C C 13 177.058260 0 . . . . . . . 41 GLU CO . 52244 1 133 . 1 . 1 41 41 GLU CA C 13 58.750700 0 . . . . . . . 41 GLU CA . 52244 1 134 . 1 . 1 41 41 GLU CB C 13 29.450000 0 . . . . . . . 41 GLU CB . 52244 1 135 . 1 . 1 41 41 GLU N N 15 120.518360 0 . . . . . . . 41 GLU N . 52244 1 136 . 1 . 1 42 42 ARG H H 1 7.982420 0 . . . . . . . 42 ARG HN . 52244 1 137 . 1 . 1 42 42 ARG C C 13 174.203380 0 . . . . . . . 42 ARG CO . 52244 1 138 . 1 . 1 42 42 ARG CA C 13 54.209000 0 . . . . . . . 42 ARG CA . 52244 1 139 . 1 . 1 42 42 ARG CB C 13 32.762350 0 . . . . . . . 42 ARG CB . 52244 1 140 . 1 . 1 42 42 ARG N N 15 115.668770 0 . . . . . . . 42 ARG N . 52244 1 141 . 1 . 1 43 43 VAL H H 1 8.600030 0 . . . . . . . 43 VAL HN . 52244 1 142 . 1 . 1 43 43 VAL C C 13 176.442100 0 . . . . . . . 43 VAL CO . 52244 1 143 . 1 . 1 43 43 VAL CA C 13 60.503370 0 . . . . . . . 43 VAL CA . 52244 1 144 . 1 . 1 43 43 VAL CB C 13 33.323820 0 . . . . . . . 43 VAL CB . 52244 1 145 . 1 . 1 43 43 VAL N N 15 122.021570 0 . . . . . . . 43 VAL N . 52244 1 146 . 1 . 1 44 44 GLY H H 1 9.163290 0 . . . . . . . 44 GLY HN . 52244 1 147 . 1 . 1 44 44 GLY C C 13 174.246850 0 . . . . . . . 44 GLY CO . 52244 1 148 . 1 . 1 44 44 GLY CA C 13 45.055550 0 . . . . . . . 44 GLY CA . 52244 1 149 . 1 . 1 44 44 GLY N N 15 116.280980 0 . . . . . . . 44 GLY N . 52244 1 150 . 1 . 1 45 45 ALA H H 1 8.487320 0 . . . . . . . 45 ALA HN . 52244 1 151 . 1 . 1 45 45 ALA C C 13 179.268920 0 . . . . . . . 45 ALA CO . 52244 1 152 . 1 . 1 45 45 ALA CA C 13 54.547950 0 . . . . . . . 45 ALA CA . 52244 1 153 . 1 . 1 45 45 ALA CB C 13 18.300000 0 . . . . . . . 45 ALA CB . 52244 1 154 . 1 . 1 45 45 ALA N N 15 122.488880 0 . . . . . . . 45 ALA N . 52244 1 155 . 1 . 1 46 46 GLY H H 1 8.667620 0 . . . . . . . 46 GLY HN . 52244 1 156 . 1 . 1 46 46 GLY C C 13 175.450800 0 . . . . . . . 46 GLY CO . 52244 1 157 . 1 . 1 46 46 GLY CA C 13 45.30037344 0 . . . . . . . 46 GLY CA . 52244 1 158 . 1 . 1 46 46 GLY N N 15 105.347280 0 . . . . . . . 46 GLY N . 52244 1 159 . 1 . 1 47 47 ALA H H 1 7.470660 0 . . . . . . . 47 ALA HN . 52244 1 160 . 1 . 1 47 47 ALA C C 13 175.150000 0 . . . . . . . 47 ALA CO . 52244 1 161 . 1 . 1 47 47 ALA CA C 13 56.108930 0 . . . . . . . 47 ALA CA . 52244 1 162 . 1 . 1 47 47 ALA CB C 13 15.252590 0 . . . . . . . 47 ALA CB . 52244 1 163 . 1 . 1 47 47 ALA N N 15 124.338180 0 . . . . . . . 47 ALA N . 52244 1 164 . 1 . 1 48 48 PRO C C 13 177.293670 0 . . . . . . . 48 PRO CO . 52244 1 165 . 1 . 1 48 48 PRO CA C 13 64.670000 0 . . . . . . . 48 PRO CA . 52244 1 166 . 1 . 1 48 48 PRO CB C 13 30.720000 0 . . . . . . . 48 PRO CB . 52244 1 167 . 1 . 1 49 49 VAL H H 1 6.294230 0 . . . . . . . 49 VAL HN . 52244 1 168 . 1 . 1 49 49 VAL C C 13 176.217950 0 . . . . . . . 49 VAL CO . 52244 1 169 . 1 . 1 49 49 VAL CA C 13 65.264210 0 . . . . . . . 49 VAL CA . 52244 1 170 . 1 . 1 49 49 VAL CB C 13 30.745570 0 . . . . . . . 49 VAL CB . 52244 1 171 . 1 . 1 49 49 VAL N N 15 118.504450 0 . . . . . . . 49 VAL N . 52244 1 172 . 1 . 1 50 50 TYR H H 1 7.893740 0 . . . . . . . 50 TYR HN . 52244 1 173 . 1 . 1 50 50 TYR C C 13 178.801170 0 . . . . . . . 50 TYR CO . 52244 1 174 . 1 . 1 50 50 TYR CA C 13 60.037760 0 . . . . . . . 50 TYR CA . 52244 1 175 . 1 . 1 50 50 TYR CB C 13 37.660000 0 . . . . . . . 50 TYR CB . 52244 1 176 . 1 . 1 50 50 TYR N N 15 120.192120 0 . . . . . . . 50 TYR N . 52244 1 177 . 1 . 1 51 51 LEU H H 1 8.262690 0 . . . . . . . 51 LEU HN . 52244 1 178 . 1 . 1 51 51 LEU C C 13 177.792130 0 . . . . . . . 51 LEU CO . 52244 1 179 . 1 . 1 51 51 LEU CA C 13 57.538380 0 . . . . . . . 51 LEU CA . 52244 1 180 . 1 . 1 51 51 LEU CB C 13 41.177750 0 . . . . . . . 51 LEU CB . 52244 1 181 . 1 . 1 51 51 LEU N N 15 115.735210 0 . . . . . . . 51 LEU N . 52244 1 182 . 1 . 1 52 52 ALA H H 1 8.503660 0 . . . . . . . 52 ALA HN . 52244 1 183 . 1 . 1 52 52 ALA C C 13 178.520000 0 . . . . . . . 52 ALA CO . 52244 1 184 . 1 . 1 52 52 ALA CA C 13 55.794780 0 . . . . . . . 52 ALA CA . 52244 1 185 . 1 . 1 52 52 ALA CB C 13 17.568400 0 . . . . . . . 52 ALA CB . 52244 1 186 . 1 . 1 52 52 ALA N N 15 120.969410 0 . . . . . . . 52 ALA N . 52244 1 187 . 1 . 1 53 53 ALA H H 1 7.825690 0 . . . . . . . 53 ALA HN . 52244 1 188 . 1 . 1 53 53 ALA C C 13 180.714450 0 . . . . . . . 53 ALA CO . 52244 1 189 . 1 . 1 53 53 ALA CA C 13 54.545100 0 . . . . . . . 53 ALA CA . 52244 1 190 . 1 . 1 53 53 ALA CB C 13 18.099220 0 . . . . . . . 53 ALA CB . 52244 1 191 . 1 . 1 53 53 ALA N N 15 118.587080 0 . . . . . . . 53 ALA N . 52244 1 192 . 1 . 1 54 54 VAL H H 1 7.913690 0 . . . . . . . 54 VAL HN . 52244 1 193 . 1 . 1 54 54 VAL C C 13 177.262200 0 . . . . . . . 54 VAL CO . 52244 1 194 . 1 . 1 54 54 VAL CA C 13 66.825810 0 . . . . . . . 54 VAL CA . 52244 1 195 . 1 . 1 54 54 VAL CB C 13 30.780000 0 . . . . . . . 54 VAL CB . 52244 1 196 . 1 . 1 54 54 VAL N N 15 120.146760 0 . . . . . . . 54 VAL N . 52244 1 197 . 1 . 1 55 55 LEU H H 1 8.270830 0 . . . . . . . 55 LEU HN . 52244 1 198 . 1 . 1 55 55 LEU C C 13 179.294660 0 . . . . . . . 55 LEU CO . 52244 1 199 . 1 . 1 55 55 LEU CA C 13 57.330020 0 . . . . . . . 55 LEU CA . 52244 1 200 . 1 . 1 55 55 LEU CB C 13 40.019370 0 . . . . . . . 55 LEU CB . 52244 1 201 . 1 . 1 55 55 LEU N N 15 118.349590 0 . . . . . . . 55 LEU N . 52244 1 202 . 1 . 1 56 56 GLU H H 1 8.100940 0 . . . . . . . 56 GLU HN . 52244 1 203 . 1 . 1 56 56 GLU C C 13 176.896360 0 . . . . . . . 56 GLU CO . 52244 1 204 . 1 . 1 56 56 GLU CA C 13 59.748210 0 . . . . . . . 56 GLU CA . 52244 1 205 . 1 . 1 56 56 GLU N N 15 122.798200 0 . . . . . . . 56 GLU N . 52244 1 206 . 1 . 1 57 57 TYR H H 1 7.872200 0 . . . . . . . 57 TYR HN . 52244 1 207 . 1 . 1 57 57 TYR C C 13 176.700800 0 . . . . . . . 57 TYR CO . 52244 1 208 . 1 . 1 57 57 TYR CA C 13 60.469650 0 . . . . . . . 57 TYR CA . 52244 1 209 . 1 . 1 57 57 TYR CB C 13 37.220000 0 . . . . . . . 57 TYR CB . 52244 1 210 . 1 . 1 57 57 TYR N N 15 119.894880 0 . . . . . . . 57 TYR N . 52244 1 211 . 1 . 1 58 58 LEU H H 1 8.031770 0 . . . . . . . 58 LEU HN . 52244 1 212 . 1 . 1 58 58 LEU C C 13 178.260000 0 . . . . . . . 58 LEU CO . 52244 1 213 . 1 . 1 58 58 LEU CA C 13 57.083890 0 . . . . . . . 58 LEU CA . 52244 1 214 . 1 . 1 58 58 LEU CB C 13 41.509660 0 . . . . . . . 58 LEU CB . 52244 1 215 . 1 . 1 58 58 LEU N N 15 117.337630 0 . . . . . . . 58 LEU N . 52244 1 216 . 1 . 1 59 59 THR H H 1 7.748710 0 . . . . . . . 59 THR HN . 52244 1 217 . 1 . 1 59 59 THR C C 13 175.414900 0 . . . . . . . 59 THR CO . 52244 1 218 . 1 . 1 59 59 THR N N 15 115.055400 0 . . . . . . . 59 THR N . 52244 1 219 . 1 . 1 60 60 ALA H H 1 8.418440 0 . . . . . . . 60 ALA HN . 52244 1 220 . 1 . 1 60 60 ALA C C 13 179.257830 0 . . . . . . . 60 ALA CO . 52244 1 221 . 1 . 1 60 60 ALA CA C 13 55.543090 0 . . . . . . . 60 ALA CA . 52244 1 222 . 1 . 1 60 60 ALA CB C 13 17.050000 0 . . . . . . . 60 ALA CB . 52244 1 223 . 1 . 1 60 60 ALA N N 15 123.693310 0 . . . . . . . 60 ALA N . 52244 1 224 . 1 . 1 61 61 GLU H H 1 7.956330 0 . . . . . . . 61 GLU HN . 52244 1 225 . 1 . 1 61 61 GLU C C 13 179.000000 0 . . . . . . . 61 GLU CO . 52244 1 226 . 1 . 1 61 61 GLU CA C 13 58.785550 0 . . . . . . . 61 GLU CA . 52244 1 227 . 1 . 1 61 61 GLU CB C 13 28.290000 0 . . . . . . . 61 GLU CB . 52244 1 228 . 1 . 1 61 61 GLU N N 15 119.093420 0 . . . . . . . 61 GLU N . 52244 1 229 . 1 . 1 62 62 ILE H H 1 7.882130 0 . . . . . . . 62 ILE HN . 52244 1 230 . 1 . 1 62 62 ILE C C 13 178.166950 0 . . . . . . . 62 ILE CO . 52244 1 231 . 1 . 1 62 62 ILE CA C 13 65.310000 0 . . . . . . . 62 ILE CA . 52244 1 232 . 1 . 1 62 62 ILE CB C 13 38.247650 0 . . . . . . . 62 ILE CB . 52244 1 233 . 1 . 1 62 62 ILE N N 15 117.026110 0 . . . . . . . 62 ILE N . 52244 1 234 . 1 . 1 63 63 LEU H H 1 8.457040 0 . . . . . . . 63 LEU HN . 52244 1 235 . 1 . 1 63 63 LEU C C 13 179.992000 0 . . . . . . . 63 LEU CO . 52244 1 236 . 1 . 1 63 63 LEU CA C 13 57.251000 0 . . . . . . . 63 LEU CA . 52244 1 237 . 1 . 1 63 63 LEU CB C 13 40.920000 0 . . . . . . . 63 LEU CB . 52244 1 238 . 1 . 1 63 63 LEU N N 15 117.070630 0 . . . . . . . 63 LEU N . 52244 1 239 . 1 . 1 64 64 GLU H H 1 8.911430 0 . . . . . . . 64 GLU HN . 52244 1 240 . 1 . 1 64 64 GLU C C 13 179.787010 0 . . . . . . . 64 GLU CO . 52244 1 241 . 1 . 1 64 64 GLU CA C 13 59.315290 0 . . . . . . . 64 GLU CA . 52244 1 242 . 1 . 1 64 64 GLU CB C 13 28.208100 0 . . . . . . . 64 GLU CB . 52244 1 243 . 1 . 1 64 64 GLU N N 15 122.282210 0 . . . . . . . 64 GLU N . 52244 1 244 . 1 . 1 65 65 LEU H H 1 7.521830 0 . . . . . . . 65 LEU HN . 52244 1 245 . 1 . 1 65 65 LEU C C 13 180.842760 0 . . . . . . . 65 LEU CO . 52244 1 246 . 1 . 1 65 65 LEU CA C 13 57.470370 0 . . . . . . . 65 LEU CA . 52244 1 247 . 1 . 1 65 65 LEU CB C 13 41.400050 0 . . . . . . . 65 LEU CB . 52244 1 248 . 1 . 1 65 65 LEU N N 15 118.939010 0 . . . . . . . 65 LEU N . 52244 1 249 . 1 . 1 66 66 ALA H H 1 9.323530 0 . . . . . . . 66 ALA HN . 52244 1 250 . 1 . 1 66 66 ALA C C 13 179.583130 0 . . . . . . . 66 ALA CO . 52244 1 251 . 1 . 1 66 66 ALA CA C 13 54.566160 0 . . . . . . . 66 ALA CA . 52244 1 252 . 1 . 1 66 66 ALA CB C 13 18.285220 0 . . . . . . . 66 ALA CB . 52244 1 253 . 1 . 1 66 66 ALA N N 15 124.309770 0 . . . . . . . 66 ALA N . 52244 1 254 . 1 . 1 67 67 GLY H H 1 8.885130 0 . . . . . . . 67 GLY HN . 52244 1 255 . 1 . 1 67 67 GLY C C 13 175.811370 0 . . . . . . . 67 GLY CO . 52244 1 256 . 1 . 1 67 67 GLY CA C 13 45.12801801 0 . . . . . . . 67 GLY CA . 52244 1 257 . 1 . 1 67 67 GLY N N 15 105.916130 0 . . . . . . . 67 GLY N . 52244 1 258 . 1 . 1 68 68 ASN H H 1 7.698580 0 . . . . . . . 68 ASN HN . 52244 1 259 . 1 . 1 68 68 ASN C C 13 176.907550 0 . . . . . . . 68 ASN CO . 52244 1 260 . 1 . 1 68 68 ASN CA C 13 55.046520 0 . . . . . . . 68 ASN CA . 52244 1 261 . 1 . 1 68 68 ASN CB C 13 36.430100 0 . . . . . . . 68 ASN CB . 52244 1 262 . 1 . 1 68 68 ASN N N 15 122.854990 0 . . . . . . . 68 ASN N . 52244 1 263 . 1 . 1 69 69 ALA H H 1 7.477710 0 . . . . . . . 69 ALA HN . 52244 1 264 . 1 . 1 69 69 ALA C C 13 180.131610 0 . . . . . . . 69 ALA CO . 52244 1 265 . 1 . 1 69 69 ALA CA C 13 54.480900 0 . . . . . . . 69 ALA CA . 52244 1 266 . 1 . 1 69 69 ALA CB C 13 16.412540 0 . . . . . . . 69 ALA CB . 52244 1 267 . 1 . 1 69 69 ALA N N 15 123.208270 0 . . . . . . . 69 ALA N . 52244 1 268 . 1 . 1 70 70 ALA H H 1 7.733960 0 . . . . . . . 70 ALA HN . 52244 1 269 . 1 . 1 70 70 ALA C C 13 179.065190 0 . . . . . . . 70 ALA CO . 52244 1 270 . 1 . 1 70 70 ALA CA C 13 54.810380 0 . . . . . . . 70 ALA CA . 52244 1 271 . 1 . 1 70 70 ALA CB C 13 16.441650 0 . . . . . . . 70 ALA CB . 52244 1 272 . 1 . 1 70 70 ALA N N 15 122.389910 0 . . . . . . . 70 ALA N . 52244 1 273 . 1 . 1 71 71 ARG H H 1 7.574670 0 . . . . . . . 71 ARG HN . 52244 1 274 . 1 . 1 71 71 ARG C C 13 181.444330 0 . . . . . . . 71 ARG CO . 52244 1 275 . 1 . 1 71 71 ARG CA C 13 58.788850 0 . . . . . . . 71 ARG CA . 52244 1 276 . 1 . 1 71 71 ARG CB C 13 31.483610 0 . . . . . . . 71 ARG CB . 52244 1 277 . 1 . 1 71 71 ARG N N 15 119.497290 0 . . . . . . . 71 ARG N . 52244 1 278 . 1 . 1 72 72 ASP H H 1 8.476380 0 . . . . . . . 72 ASP HN . 52244 1 279 . 1 . 1 72 72 ASP C C 13 176.824030 0 . . . . . . . 72 ASP CO . 52244 1 280 . 1 . 1 72 72 ASP CA C 13 56.666730 0 . . . . . . . 72 ASP CA . 52244 1 281 . 1 . 1 72 72 ASP CB C 13 39.574480 0 . . . . . . . 72 ASP CB . 52244 1 282 . 1 . 1 72 72 ASP N N 15 122.604130 0 . . . . . . . 72 ASP N . 52244 1 283 . 1 . 1 73 73 ASN H H 1 7.369010 0 . . . . . . . 73 ASN HN . 52244 1 284 . 1 . 1 73 73 ASN C C 13 173.276530 0 . . . . . . . 73 ASN CO . 52244 1 285 . 1 . 1 73 73 ASN CA C 13 52.527190 0 . . . . . . . 73 ASN CA . 52244 1 286 . 1 . 1 73 73 ASN CB C 13 40.095290 0 . . . . . . . 73 ASN CB . 52244 1 287 . 1 . 1 73 73 ASN N N 15 116.908570 0 . . . . . . . 73 ASN N . 52244 1 288 . 1 . 1 74 74 LYS H H 1 8.088450 0 . . . . . . . 74 LYS HN . 52244 1 289 . 1 . 1 74 74 LYS C C 13 175.498680 0 . . . . . . . 74 LYS CO . 52244 1 290 . 1 . 1 74 74 LYS CA C 13 56.556210 0 . . . . . . . 74 LYS CA . 52244 1 291 . 1 . 1 74 74 LYS CB C 13 27.750000 0 . . . . . . . 74 LYS CB . 52244 1 292 . 1 . 1 74 74 LYS N N 15 115.545980 0 . . . . . . . 74 LYS N . 52244 1 293 . 1 . 1 75 75 LYS H H 1 8.173640 0 . . . . . . . 75 LYS HN . 52244 1 294 . 1 . 1 75 75 LYS C C 13 177.070000 0 . . . . . . . 75 LYS CO . 52244 1 295 . 1 . 1 75 75 LYS CA C 13 52.671840 0 . . . . . . . 75 LYS CA . 52244 1 296 . 1 . 1 75 75 LYS CB C 13 27.624900 0 . . . . . . . 75 LYS CB . 52244 1 297 . 1 . 1 75 75 LYS N N 15 117.019590 0 . . . . . . . 75 LYS N . 52244 1 298 . 1 . 1 76 76 THR C C 13 173.724760 0 . . . . . . . 76 THR CO . 52244 1 299 . 1 . 1 76 76 THR CA C 13 60.900000 0 . . . . . . . 76 THR CA . 52244 1 300 . 1 . 1 76 76 THR CB C 13 68.530000 0 . . . . . . . 76 THR CB . 52244 1 301 . 1 . 1 77 77 ARG H H 1 7.088780 0 . . . . . . . 77 ARG HN . 52244 1 302 . 1 . 1 77 77 ARG C C 13 173.957630 0 . . . . . . . 77 ARG CO . 52244 1 303 . 1 . 1 77 77 ARG CA C 13 54.305830 0 . . . . . . . 77 ARG CA . 52244 1 304 . 1 . 1 77 77 ARG CB C 13 32.562260 0 . . . . . . . 77 ARG CB . 52244 1 305 . 1 . 1 77 77 ARG N N 15 118.983790 0 . . . . . . . 77 ARG N . 52244 1 306 . 1 . 1 78 78 ILE H H 1 8.467610 0 . . . . . . . 78 ILE HN . 52244 1 307 . 1 . 1 78 78 ILE C C 13 175.006250 0 . . . . . . . 78 ILE CO . 52244 1 308 . 1 . 1 78 78 ILE CA C 13 61.007700 0 . . . . . . . 78 ILE CA . 52244 1 309 . 1 . 1 78 78 ILE CB C 13 39.090000 0 . . . . . . . 78 ILE CB . 52244 1 310 . 1 . 1 78 78 ILE N N 15 124.474010 0 . . . . . . . 78 ILE N . 52244 1 311 . 1 . 1 79 79 ILE H H 1 8.970640 0 . . . . . . . 79 ILE HN . 52244 1 312 . 1 . 1 79 79 ILE C C 13 176.010000 0 . . . . . . . 79 ILE CO . 52244 1 313 . 1 . 1 79 79 ILE CA C 13 58.824160 0 . . . . . . . 79 ILE CA . 52244 1 314 . 1 . 1 79 79 ILE CB C 13 35.888160 0 . . . . . . . 79 ILE CB . 52244 1 315 . 1 . 1 79 79 ILE N N 15 124.864320 0 . . . . . . . 79 ILE N . 52244 1 316 . 1 . 1 81 81 ARG C C 13 177.753840 0 . . . . . . . 81 ARG CO . 52244 1 317 . 1 . 1 81 81 ARG CA C 13 58.580000 0 . . . . . . . 81 ARG CA . 52244 1 318 . 1 . 1 81 81 ARG CB C 13 29.080000 0 . . . . . . . 81 ARG CB . 52244 1 319 . 1 . 1 82 82 HIS H H 1 7.319050 0 . . . . . . . 82 HIS HN . 52244 1 320 . 1 . 1 82 82 HIS C C 13 178.333930 0 . . . . . . . 82 HIS CO . 52244 1 321 . 1 . 1 82 82 HIS CA C 13 58.054010 0 . . . . . . . 82 HIS CA . 52244 1 322 . 1 . 1 82 82 HIS CB C 13 31.567740 0 . . . . . . . 82 HIS CB . 52244 1 323 . 1 . 1 82 82 HIS N N 15 117.751680 0 . . . . . . . 82 HIS N . 52244 1 324 . 1 . 1 83 83 LEU H H 1 7.108700 0 . . . . . . . 83 LEU HN . 52244 1 325 . 1 . 1 83 83 LEU C C 13 177.728150 0 . . . . . . . 83 LEU CO . 52244 1 326 . 1 . 1 83 83 LEU CA C 13 57.508980 0 . . . . . . . 83 LEU CA . 52244 1 327 . 1 . 1 83 83 LEU CB C 13 41.180000 0 . . . . . . . 83 LEU CB . 52244 1 328 . 1 . 1 83 83 LEU N N 15 117.089920 0 . . . . . . . 83 LEU N . 52244 1 329 . 1 . 1 84 84 GLN H H 1 8.133040 0 . . . . . . . 84 GLN HN . 52244 1 330 . 1 . 1 84 84 GLN C C 13 178.559200 0 . . . . . . . 84 GLN CO . 52244 1 331 . 1 . 1 84 84 GLN CA C 13 58.744280 0 . . . . . . . 84 GLN CA . 52244 1 332 . 1 . 1 84 84 GLN CB C 13 27.660000 0 . . . . . . . 84 GLN CB . 52244 1 333 . 1 . 1 84 84 GLN N N 15 116.767970 0 . . . . . . . 84 GLN N . 52244 1 334 . 1 . 1 85 85 LEU H H 1 8.122730 0 . . . . . . . 85 LEU HN . 52244 1 335 . 1 . 1 85 85 LEU C C 13 178.341290 0 . . . . . . . 85 LEU CO . 52244 1 336 . 1 . 1 85 85 LEU CA C 13 57.555070 0 . . . . . . . 85 LEU CA . 52244 1 337 . 1 . 1 85 85 LEU CB C 13 41.091960 0 . . . . . . . 85 LEU CB . 52244 1 338 . 1 . 1 85 85 LEU N N 15 119.471910 0 . . . . . . . 85 LEU N . 52244 1 339 . 1 . 1 86 86 ALA H H 1 7.751040 0 . . . . . . . 86 ALA HN . 52244 1 340 . 1 . 1 86 86 ALA C C 13 179.180000 0 . . . . . . . 86 ALA CO . 52244 1 341 . 1 . 1 86 86 ALA CA C 13 54.193690 0 . . . . . . . 86 ALA CA . 52244 1 342 . 1 . 1 86 86 ALA CB C 13 17.682700 0 . . . . . . . 86 ALA CB . 52244 1 343 . 1 . 1 86 86 ALA N N 15 119.848430 0 . . . . . . . 86 ALA N . 52244 1 344 . 1 . 1 87 87 VAL C C 13 176.417920 0 . . . . . . . 87 VAL CO . 52244 1 345 . 1 . 1 87 87 VAL CA C 13 65.086910 0 . . . . . . . 87 VAL CA . 52244 1 346 . 1 . 1 87 87 VAL CB C 13 31.270000 0 . . . . . . . 87 VAL CB . 52244 1 347 . 1 . 1 88 88 ARG H H 1 7.862910 0 . . . . . . . 88 ARG HN . 52244 1 348 . 1 . 1 88 88 ARG C C 13 174.698040 0 . . . . . . . 88 ARG CO . 52244 1 349 . 1 . 1 88 88 ARG CA C 13 57.760640 0 . . . . . . . 88 ARG CA . 52244 1 350 . 1 . 1 88 88 ARG CB C 13 29.530000 0 . . . . . . . 88 ARG CB . 52244 1 351 . 1 . 1 88 88 ARG N N 15 115.027940 0 . . . . . . . 88 ARG N . 52244 1 352 . 1 . 1 89 89 ASN H H 1 7.722120 0 . . . . . . . 89 ASN HN . 52244 1 353 . 1 . 1 89 89 ASN C C 13 173.962630 0 . . . . . . . 89 ASN CO . 52244 1 354 . 1 . 1 89 89 ASN CA C 13 53.210000 0 . . . . . . . 89 ASN CA . 52244 1 355 . 1 . 1 89 89 ASN CB C 13 38.237330 0 . . . . . . . 89 ASN CB . 52244 1 356 . 1 . 1 89 89 ASN N N 15 113.358700 0 . . . . . . . 89 ASN N . 52244 1 357 . 1 . 1 90 90 ASP H H 1 7.303310 0 . . . . . . . 90 ASP HN . 52244 1 358 . 1 . 1 90 90 ASP C C 13 174.274940 0 . . . . . . . 90 ASP CO . 52244 1 359 . 1 . 1 90 90 ASP CA C 13 53.026960 0 . . . . . . . 90 ASP CA . 52244 1 360 . 1 . 1 90 90 ASP CB C 13 43.901850 0 . . . . . . . 90 ASP CB . 52244 1 361 . 1 . 1 90 90 ASP N N 15 122.565890 0 . . . . . . . 90 ASP N . 52244 1 362 . 1 . 1 91 91 GLU H H 1 8.877960 0 . . . . . . . 91 GLU HN . 52244 1 363 . 1 . 1 91 91 GLU C C 13 179.220260 0 . . . . . . . 91 GLU CO . 52244 1 364 . 1 . 1 91 91 GLU CA C 13 59.568750 0 . . . . . . . 91 GLU CA . 52244 1 365 . 1 . 1 91 91 GLU CB C 13 28.944740 0 . . . . . . . 91 GLU CB . 52244 1 366 . 1 . 1 91 91 GLU N N 15 126.277660 0 . . . . . . . 91 GLU N . 52244 1 367 . 1 . 1 92 92 GLU H H 1 8.085730 0 . . . . . . . 92 GLU HN . 52244 1 368 . 1 . 1 92 92 GLU C C 13 178.961890 0 . . . . . . . 92 GLU CO . 52244 1 369 . 1 . 1 92 92 GLU CA C 13 59.704240 0 . . . . . . . 92 GLU CA . 52244 1 370 . 1 . 1 92 92 GLU CB C 13 28.570000 0 . . . . . . . 92 GLU CB . 52244 1 371 . 1 . 1 92 92 GLU N N 15 117.701750 0 . . . . . . . 92 GLU N . 52244 1 372 . 1 . 1 93 93 LEU H H 1 9.120820 0 . . . . . . . 93 LEU HN . 52244 1 373 . 1 . 1 93 93 LEU C C 13 179.207290 0 . . . . . . . 93 LEU CO . 52244 1 374 . 1 . 1 93 93 LEU CA C 13 57.704950 0 . . . . . . . 93 LEU CA . 52244 1 375 . 1 . 1 93 93 LEU CB C 13 40.786600 0 . . . . . . . 93 LEU CB . 52244 1 376 . 1 . 1 93 93 LEU N N 15 120.928930 0 . . . . . . . 93 LEU N . 52244 1 377 . 1 . 1 94 94 ASN H H 1 9.058340 0 . . . . . . . 94 ASN HN . 52244 1 378 . 1 . 1 94 94 ASN C C 13 179.030000 0 . . . . . . . 94 ASN CO . 52244 1 379 . 1 . 1 94 94 ASN CA C 13 56.819860 0 . . . . . . . 94 ASN CA . 52244 1 380 . 1 . 1 94 94 ASN CB C 13 38.252190 0 . . . . . . . 94 ASN CB . 52244 1 381 . 1 . 1 94 94 ASN N N 15 119.149170 0 . . . . . . . 94 ASN N . 52244 1 382 . 1 . 1 96 96 LEU C C 13 178.185130 0 . . . . . . . 96 LEU CO . 52244 1 383 . 1 . 1 96 96 LEU CA C 13 57.300000 0 . . . . . . . 96 LEU CA . 52244 1 384 . 1 . 1 96 96 LEU CB C 13 42.190000 0 . . . . . . . 96 LEU CB . 52244 1 385 . 1 . 1 97 97 LEU H H 1 8.683230 0 . . . . . . . 97 LEU HN . 52244 1 386 . 1 . 1 97 97 LEU C C 13 178.719950 0 . . . . . . . 97 LEU CO . 52244 1 387 . 1 . 1 97 97 LEU CA C 13 55.046270 0 . . . . . . . 97 LEU CA . 52244 1 388 . 1 . 1 97 97 LEU CB C 13 41.400000 0 . . . . . . . 97 LEU CB . 52244 1 389 . 1 . 1 97 97 LEU N N 15 116.829930 0 . . . . . . . 97 LEU N . 52244 1 390 . 1 . 1 98 98 GLY H H 1 8.020570 0 . . . . . . . 98 GLY HN . 52244 1 391 . 1 . 1 98 98 GLY C C 13 178.520000 0 . . . . . . . 98 GLY CO . 52244 1 392 . 1 . 1 98 98 GLY CA C 13 46.300020 0 . . . . . . . 98 GLY CA . 52244 1 393 . 1 . 1 98 98 GLY N N 15 109.106380 0 . . . . . . . 98 GLY N . 52244 1 394 . 1 . 1 99 99 ARG H H 1 8.075690 0 . . . . . . . 99 ARG HN . 52244 1 395 . 1 . 1 99 99 ARG CB C 13 28.970000 0 . . . . . . . 99 ARG CB . 52244 1 396 . 1 . 1 99 99 ARG N N 15 118.280440 0 . . . . . . . 99 ARG N . 52244 1 397 . 1 . 1 100 100 VAL H H 1 7.801090 0 . . . . . . . 100 VAL HN . 52244 1 398 . 1 . 1 100 100 VAL CB C 13 30.160000 0 . . . . . . . 100 VAL CB . 52244 1 399 . 1 . 1 100 100 VAL N N 15 119.637340 0 . . . . . . . 100 VAL N . 52244 1 400 . 1 . 1 101 101 THR H H 1 8.172800 0 . . . . . . . 101 THR HN . 52244 1 401 . 1 . 1 101 101 THR C C 13 174.683800 0 . . . . . . . 101 THR CO . 52244 1 402 . 1 . 1 101 101 THR CA C 13 62.491840 0 . . . . . . . 101 THR CA . 52244 1 403 . 1 . 1 101 101 THR CB C 13 69.150000 0 . . . . . . . 101 THR CB . 52244 1 404 . 1 . 1 101 101 THR N N 15 119.188500 0 . . . . . . . 101 THR N . 52244 1 405 . 1 . 1 102 102 ILE H H 1 8.143020 0 . . . . . . . 102 ILE HN . 52244 1 406 . 1 . 1 102 102 ILE C C 13 175.975210 0 . . . . . . . 102 ILE CO . 52244 1 407 . 1 . 1 102 102 ILE CA C 13 60.782510 0 . . . . . . . 102 ILE CA . 52244 1 408 . 1 . 1 102 102 ILE CB C 13 37.760000 0 . . . . . . . 102 ILE CB . 52244 1 409 . 1 . 1 102 102 ILE N N 15 123.865990 0 . . . . . . . 102 ILE N . 52244 1 410 . 1 . 1 103 103 ALA H H 1 8.194010 0 . . . . . . . 103 ALA HN . 52244 1 411 . 1 . 1 103 103 ALA C C 13 177.495730 0 . . . . . . . 103 ALA CO . 52244 1 412 . 1 . 1 103 103 ALA CA C 13 52.295470 0 . . . . . . . 103 ALA CA . 52244 1 413 . 1 . 1 103 103 ALA CB C 13 18.310240 0 . . . . . . . 103 ALA CB . 52244 1 414 . 1 . 1 103 103 ALA N N 15 127.278610 0 . . . . . . . 103 ALA N . 52244 1 415 . 1 . 1 104 104 GLN H H 1 8.268780 0 . . . . . . . 104 GLN HN . 52244 1 416 . 1 . 1 104 104 GLN C C 13 176.720000 0 . . . . . . . 104 GLN CO . 52244 1 417 . 1 . 1 104 104 GLN CA C 13 55.546020 0 . . . . . . . 104 GLN CA . 52244 1 418 . 1 . 1 104 104 GLN N N 15 119.586770 0 . . . . . . . 104 GLN N . 52244 1 419 . 1 . 1 105 105 GLY H H 1 8.338600 0 . . . . . . . 105 GLY HN . 52244 1 420 . 1 . 1 105 105 GLY C C 13 174.500870 0 . . . . . . . 105 GLY CO . 52244 1 421 . 1 . 1 105 105 GLY CA C 13 45.000000 0 . . . . . . . 105 GLY CA . 52244 1 422 . 1 . 1 105 105 GLY N N 15 109.987800 0 . . . . . . . 105 GLY N . 52244 1 423 . 1 . 1 106 106 GLY H H 1 8.204600 0 . . . . . . . 106 GLY HN . 52244 1 424 . 1 . 1 106 106 GLY C C 13 173.781870 0 . . . . . . . 106 GLY CO . 52244 1 425 . 1 . 1 106 106 GLY CA C 13 44.781710 0 . . . . . . . 106 GLY CA . 52244 1 426 . 1 . 1 106 106 GLY N N 15 108.987170 0 . . . . . . . 106 GLY N . 52244 1 427 . 1 . 1 107 107 VAL H H 1 7.935700 0 . . . . . . . 107 VAL HN . 52244 1 428 . 1 . 1 107 107 VAL C C 13 176.032290 0 . . . . . . . 107 VAL CO . 52244 1 429 . 1 . 1 107 107 VAL CA C 13 61.604200 0 . . . . . . . 107 VAL CA . 52244 1 430 . 1 . 1 107 107 VAL CB C 13 32.020000 0 . . . . . . . 107 VAL CB . 52244 1 431 . 1 . 1 107 107 VAL N N 15 119.181710 0 . . . . . . . 107 VAL N . 52244 1 432 . 1 . 1 108 108 LEU H H 1 8.302980 0 . . . . . . . 108 LEU HN . 52244 1 433 . 1 . 1 108 108 LEU C C 13 175.200000 0 . . . . . . . 108 LEU CO . 52244 1 434 . 1 . 1 108 108 LEU CA C 13 52.559330 0 . . . . . . . 108 LEU CA . 52244 1 435 . 1 . 1 108 108 LEU CB C 13 40.733620 0 . . . . . . . 108 LEU CB . 52244 1 436 . 1 . 1 108 108 LEU N N 15 127.208950 0 . . . . . . . 108 LEU N . 52244 1 437 . 1 . 1 109 109 PRO C C 13 176.511480 0 . . . . . . . 109 PRO CO . 52244 1 438 . 1 . 1 109 109 PRO CA C 13 62.720000 0 . . . . . . . 109 PRO CA . 52244 1 439 . 1 . 1 110 110 ASN H H 1 8.416340 0 . . . . . . . 110 ASN HN . 52244 1 440 . 1 . 1 110 110 ASN C C 13 175.360350 0 . . . . . . . 110 ASN CO . 52244 1 441 . 1 . 1 110 110 ASN CA C 13 52.904180 0 . . . . . . . 110 ASN CA . 52244 1 442 . 1 . 1 110 110 ASN CB C 13 38.350000 0 . . . . . . . 110 ASN CB . 52244 1 443 . 1 . 1 110 110 ASN N N 15 118.827050 0 . . . . . . . 110 ASN N . 52244 1 444 . 1 . 1 111 111 ILE H H 1 8.074600 0 . . . . . . . 111 ILE HN . 52244 1 445 . 1 . 1 111 111 ILE C C 13 176.203240 0 . . . . . . . 111 ILE CO . 52244 1 446 . 1 . 1 111 111 ILE CA C 13 60.826260 0 . . . . . . . 111 ILE CA . 52244 1 447 . 1 . 1 111 111 ILE CB C 13 37.998120 0 . . . . . . . 111 ILE CB . 52244 1 448 . 1 . 1 111 111 ILE N N 15 121.417500 0 . . . . . . . 111 ILE N . 52244 1 449 . 1 . 1 112 112 GLN H H 1 8.375010 0 . . . . . . . 112 GLN HN . 52244 1 450 . 1 . 1 112 112 GLN C C 13 176.070000 0 . . . . . . . 112 GLN CO . 52244 1 451 . 1 . 1 112 112 GLN CA C 13 55.656360 0 . . . . . . . 112 GLN CA . 52244 1 452 . 1 . 1 112 112 GLN CB C 13 28.390880 0 . . . . . . . 112 GLN CB . 52244 1 453 . 1 . 1 112 112 GLN N N 15 123.887860 0 . . . . . . . 112 GLN N . 52244 1 454 . 1 . 1 113 113 SER H H 1 8.241800 0 . . . . . . . 113 SER HN . 52244 1 455 . 1 . 1 113 113 SER C C 13 174.519710 0 . . . . . . . 113 SER CO . 52244 1 456 . 1 . 1 113 113 SER CA C 13 58.264880 0 . . . . . . . 113 SER CA . 52244 1 457 . 1 . 1 113 113 SER CB C 13 63.860000 0 . . . . . . . 113 SER CB . 52244 1 458 . 1 . 1 113 113 SER N N 15 117.444650 0 . . . . . . . 113 SER N . 52244 1 459 . 1 . 1 114 114 VAL H H 1 8.009230 0 . . . . . . . 114 VAL HN . 52244 1 460 . 1 . 1 114 114 VAL C C 13 175.758690 0 . . . . . . . 114 VAL CO . 52244 1 461 . 1 . 1 114 114 VAL CA C 13 61.792760 0 . . . . . . . 114 VAL CA . 52244 1 462 . 1 . 1 114 114 VAL CB C 13 31.800000 0 . . . . . . . 114 VAL CB . 52244 1 463 . 1 . 1 114 114 VAL N N 15 121.587060 0 . . . . . . . 114 VAL N . 52244 1 464 . 1 . 1 115 115 LEU H H 1 8.150930 0 . . . . . . . 115 LEU HN . 52244 1 465 . 1 . 1 115 115 LEU C C 13 176.694210 0 . . . . . . . 115 LEU CO . 52244 1 466 . 1 . 1 115 115 LEU CA C 13 54.441600 0 . . . . . . . 115 LEU CA . 52244 1 467 . 1 . 1 115 115 LEU CB C 13 41.301070 0 . . . . . . . 115 LEU CB . 52244 1 468 . 1 . 1 115 115 LEU N N 15 125.411310 0 . . . . . . . 115 LEU N . 52244 1 469 . 1 . 1 116 116 LEU H H 1 8.078590 0 . . . . . . . 116 LEU HN . 52244 1 470 . 1 . 1 116 116 LEU C C 13 175.010000 0 . . . . . . . 116 LEU CO . 52244 1 471 . 1 . 1 116 116 LEU CA C 13 52.414890 0 . . . . . . . 116 LEU CA . 52244 1 472 . 1 . 1 116 116 LEU CB C 13 40.770000 0 . . . . . . . 116 LEU CB . 52244 1 473 . 1 . 1 116 116 LEU N N 15 124.772090 0 . . . . . . . 116 LEU N . 52244 1 474 . 1 . 1 117 117 PRO C C 13 176.862860 0 . . . . . . . 117 PRO CO . 52244 1 475 . 1 . 1 117 117 PRO CA C 13 62.544390 0 . . . . . . . 117 PRO CA . 52244 1 476 . 1 . 1 117 117 PRO CB C 13 31.280000 0 . . . . . . . 117 PRO CB . 52244 1 477 . 1 . 1 118 118 LYS H H 1 8.341350 0 . . . . . . . 118 LYS HN . 52244 1 478 . 1 . 1 118 118 LYS C C 13 176.770000 0 . . . . . . . 118 LYS CO . 52244 1 479 . 1 . 1 118 118 LYS CA C 13 55.795250 0 . . . . . . . 118 LYS CA . 52244 1 480 . 1 . 1 118 118 LYS CB C 13 32.053870 0 . . . . . . . 118 LYS CB . 52244 1 481 . 1 . 1 118 118 LYS N N 15 122.145800 0 . . . . . . . 118 LYS N . 52244 1 482 . 1 . 1 119 119 LYS C C 13 176.940000 0 . . . . . . . 119 LYS CO . 52244 1 483 . 1 . 1 119 119 LYS CA C 13 56.510000 0 . . . . . . . 119 LYS CA . 52244 1 484 . 1 . 1 120 120 THR H H 1 8.146830 0 . . . . . . . 120 THR HN . 52244 1 485 . 1 . 1 120 120 THR C C 13 174.570000 0 . . . . . . . 120 THR CO . 52244 1 486 . 1 . 1 120 120 THR CA C 13 61.930000 0 . . . . . . . 120 THR CA . 52244 1 487 . 1 . 1 120 120 THR N N 15 115.969120 0 . . . . . . . 120 THR N . 52244 1 488 . 1 . 1 121 121 GLU H H 1 8.466790 0 . . . . . . . 121 GLU HN . 52244 1 489 . 1 . 1 121 121 GLU C C 13 176.680000 0 . . . . . . . 121 GLU CO . 52244 1 490 . 1 . 1 121 121 GLU CA C 13 56.490000 0 . . . . . . . 121 GLU CA . 52244 1 491 . 1 . 1 121 121 GLU N N 15 124.025500 0 . . . . . . . 121 GLU N . 52244 1 492 . 1 . 1 122 122 SER H H 1 8.207930 0 . . . . . . . 122 SER HN . 52244 1 493 . 1 . 1 122 122 SER CA C 13 61.940000 0 . . . . . . . 122 SER CA . 52244 1 494 . 1 . 1 122 122 SER N N 15 116.620040 0 . . . . . . . 122 SER N . 52244 1 495 . 1 . 1 126 126 ALA C C 13 177.766840 0 . . . . . . . 126 ALA CO . 52244 1 496 . 1 . 1 126 126 ALA CA C 13 52.279910 0 . . . . . . . 126 ALA CA . 52244 1 497 . 1 . 1 127 127 LYS H H 1 8.277940 0 . . . . . . . 127 LYS HN . 52244 1 498 . 1 . 1 127 127 LYS C C 13 176.760000 0 . . . . . . . 127 LYS CO . 52244 1 499 . 1 . 1 127 127 LYS CA C 13 55.829580 0 . . . . . . . 127 LYS CA . 52244 1 500 . 1 . 1 127 127 LYS N N 15 120.909590 0 . . . . . . . 127 LYS N . 52244 1 501 . 1 . 1 128 128 SER C C 13 173.527220 0 . . . . . . . 128 SER CO . 52244 1 502 . 1 . 1 128 128 SER CA C 13 58.215900 0 . . . . . . . 128 SER CA . 52244 1 503 . 1 . 1 128 128 SER CB C 13 63.878540 0 . . . . . . . 128 SER CB . 52244 1 504 . 1 . 1 129 129 LYS H H 1 7.925310 0 . . . . . . . 129 LYS HN . 52244 1 505 . 1 . 1 129 129 LYS C C 13 181.320000 0 . . . . . . . 129 LYS CO . 52244 1 506 . 1 . 1 129 129 LYS CA C 13 57.533580 0 . . . . . . . 129 LYS CA . 52244 1 507 . 1 . 1 129 129 LYS CB C 13 32.659790 0 . . . . . . . 129 LYS CB . 52244 1 508 . 1 . 1 129 129 LYS N N 15 128.218350 0 . . . . . . . 129 LYS N . 52244 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 52244 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name 'H2B Chemical Shifts' _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 12 '2D 1H-15N TROSY' . . . 52244 2 13 '2D 1H-15N TROSY' . . . 52244 2 14 '2D 1H-15N TROSY' . . . 52244 2 15 '3D HNCO' . . . 52244 2 16 '3D HNCO' . . . 52244 2 17 '3D HN(CA)CO' . . . 52244 2 18 '3D HN(CO)CA' . . . 52244 2 19 '3D HN(CO)CA' . . . 52244 2 20 '3D HNCA' . . . 52244 2 21 '3D HN(CO)CACB' . . . 52244 2 22 '3D HNCACB' . . . 52244 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $software_3 . . 52244 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 . 2 1 1 PRO C C 13 176.780000 0 . . . . . . . 1 Pro CO . 52244 2 2 . 2 . 2 1 1 PRO CA C 13 62.540000 0 . . . . . . . 1 Pro CA . 52244 2 3 . 2 . 2 1 1 PRO CB C 13 31.330000 0 . . . . . . . 1 Pro CB . 52244 2 4 . 2 . 2 2 2 GLU H H 1 8.540000 0 . . . . . . . 2 Glu HN . 52244 2 5 . 2 . 2 2 2 GLU C C 13 174.610000 0 . . . . . . . 2 Glu CO . 52244 2 6 . 2 . 2 2 2 GLU CA C 13 54.030000 0 . . . . . . . 2 Glu CA . 52244 2 7 . 2 . 2 2 2 GLU CB C 13 28.810000 0 . . . . . . . 2 Glu CB . 52244 2 8 . 2 . 2 2 2 GLU N N 15 123.580000 0 . . . . . . . 2 Glu N . 52244 2 9 . 2 . 2 3 3 PRO C C 13 176.740000 0 . . . . . . . 3 Pro CO . 52244 2 10 . 2 . 2 3 3 PRO CA C 13 62.710000 0 . . . . . . . 3 Pro CA . 52244 2 11 . 2 . 2 3 3 PRO CB C 13 31.310000 0 . . . . . . . 3 Pro CB . 52244 2 12 . 2 . 2 4 4 ALA H H 1 8.360000 0 . . . . . . . 4 Ala HN . 52244 2 13 . 2 . 2 4 4 ALA C C 13 177.980000 0 . . . . . . . 4 Ala CO . 52244 2 14 . 2 . 2 4 4 ALA CA C 13 52.040000 0 . . . . . . . 4 Ala CA . 52244 2 15 . 2 . 2 4 4 ALA CB C 13 18.370000 0 . . . . . . . 4 Ala CB . 52244 2 16 . 2 . 2 4 4 ALA N N 15 124.730000 0 . . . . . . . 4 Ala N . 52244 2 17 . 2 . 2 5 5 LYS H H 1 8.290000 0 . . . . . . . 5 Lys HN . 52244 2 18 . 2 . 2 5 5 LYS CA C 13 55.750000 0 . . . . . . . 5 Lys CA . 52244 2 19 . 2 . 2 5 5 LYS CB C 13 32.020000 0 . . . . . . . 5 Lys CB . 52244 2 20 . 2 . 2 5 5 LYS N N 15 121.360000 0 . . . . . . . 5 Lys N . 52244 2 21 . 2 . 2 6 6 SER C C 13 173.710000 0 . . . . . . . 6 Ser CO . 52244 2 22 . 2 . 2 6 6 SER CA C 13 57.700000 0 . . . . . . . 6 Ser CA . 52244 2 23 . 2 . 2 7 7 ALA H H 1 8.270000 0 . . . . . . . 7 Ala HN . 52244 2 24 . 2 . 2 7 7 ALA CA C 13 50.080000 0 . . . . . . . 7 Ala CA . 52244 2 25 . 2 . 2 7 7 ALA CB C 13 19.550000 0 . . . . . . . 7 Ala CB . 52244 2 26 . 2 . 2 7 7 ALA N N 15 127.630000 0 . . . . . . . 7 Ala N . 52244 2 27 . 2 . 2 8 8 PRO C C 13 176.390000 0 . . . . . . . 8 Pro CO . 52244 2 28 . 2 . 2 8 8 PRO CA C 13 62.410000 0 . . . . . . . 8 Pro CA . 52244 2 29 . 2 . 2 8 8 PRO CB C 13 31.260000 0 . . . . . . . 8 Pro CB . 52244 2 30 . 2 . 2 9 9 ALA H H 1 8.340000 0 . . . . . . . 9 Ala HN . 52244 2 31 . 2 . 2 9 9 ALA C C 13 175.670000 0 . . . . . . . 9 Ala CO . 52244 2 32 . 2 . 2 9 9 ALA CA C 13 49.960000 0 . . . . . . . 9 Ala CA . 52244 2 33 . 2 . 2 9 9 ALA CB C 13 17.320000 0 . . . . . . . 9 Ala CB . 52244 2 34 . 2 . 2 9 9 ALA N N 15 126.290000 0 . . . . . . . 9 Ala N . 52244 2 35 . 2 . 2 16 16 LYS C C 13 176.230000 0 . . . . . . . 16 Lys CO . 52244 2 36 . 2 . 2 16 16 LYS CA C 13 55.770000 0 . . . . . . . 16 Lys CA . 52244 2 37 . 2 . 2 17 17 ALA H H 1 8.290000 0 . . . . . . . 17 Ala HN . 52244 2 38 . 2 . 2 17 17 ALA C C 13 177.670000 0 . . . . . . . 17 Ala CO . 52244 2 39 . 2 . 2 17 17 ALA CA C 13 51.920000 0 . . . . . . . 17 Ala CA . 52244 2 40 . 2 . 2 17 17 ALA CB C 13 18.370000 0 . . . . . . . 17 Ala CB . 52244 2 41 . 2 . 2 17 17 ALA N N 15 126.580000 0 . . . . . . . 17 Ala N . 52244 2 42 . 2 . 2 18 18 VAL H H 1 8.160000 0 . . . . . . . 18 Val HN . 52244 2 43 . 2 . 2 18 18 VAL C C 13 176.490000 0 . . . . . . . 18 Val CO . 52244 2 44 . 2 . 2 18 18 VAL CA C 13 61.780000 0 . . . . . . . 18 Val CA . 52244 2 45 . 2 . 2 18 18 VAL CB C 13 32.000000 0 . . . . . . . 18 Val CB . 52244 2 46 . 2 . 2 18 18 VAL N N 15 120.740000 0 . . . . . . . 18 Val N . 52244 2 47 . 2 . 2 19 19 THR C C 13 177.000000 0 . . . . . . . 19 Thr CO . 52244 2 48 . 2 . 2 19 19 THR CA C 13 62.530000 0 . . . . . . . 19 Thr CA . 52244 2 49 . 2 . 2 20 20 LYS H H 1 8.380000 0 . . . . . . . 20 Lys HN . 52244 2 50 . 2 . 2 20 20 LYS C C 13 176.960000 0 . . . . . . . 20 Lys CO . 52244 2 51 . 2 . 2 20 20 LYS CA C 13 55.820000 0 . . . . . . . 20 Lys CA . 52244 2 52 . 2 . 2 20 20 LYS CB C 13 32.020000 0 . . . . . . . 20 Lys CB . 52244 2 53 . 2 . 2 20 20 LYS N N 15 122.580000 0 . . . . . . . 20 Lys N . 52244 2 54 . 2 . 2 26 26 GLY H H 1 8.320000 0 . . . . . . . 26 Gly HN . 52244 2 55 . 2 . 2 26 26 GLY N N 15 110.030000 0 . . . . . . . 26 Gly N . 52244 2 56 . 2 . 2 34 34 LYS C C 13 176.290000 0 . . . . . . . 34 Lys CO . 52244 2 57 . 2 . 2 34 34 LYS CA C 13 55.330000 0 . . . . . . . 34 Lys CA . 52244 2 58 . 2 . 2 34 34 LYS CB C 13 32.030000 0 . . . . . . . 34 Lys CB . 52244 2 59 . 2 . 2 35 35 GLU H H 1 8.190000 0 . . . . . . . 35 Glu HN . 52244 2 60 . 2 . 2 35 35 GLU C C 13 176.220000 0 . . . . . . . 35 Glu CO . 52244 2 61 . 2 . 2 35 35 GLU CA C 13 55.470000 0 . . . . . . . 35 Glu CA . 52244 2 62 . 2 . 2 35 35 GLU CB C 13 29.530000 0 . . . . . . . 35 Glu CB . 52244 2 63 . 2 . 2 35 35 GLU N N 15 123.960000 0 . . . . . . . 35 Glu N . 52244 2 64 . 2 . 2 38 38 ALA C C 13 175.950000 0 . . . . . . . 38 Ala CO . 52244 2 65 . 2 . 2 39 39 ILE H H 1 9.550000 0 . . . . . . . 39 Ile HN . 52244 2 66 . 2 . 2 39 39 ILE C C 13 175.710000 0 . . . . . . . 39 Ile CO . 52244 2 67 . 2 . 2 39 39 ILE CA C 13 57.520000 0 . . . . . . . 39 Ile CA . 52244 2 68 . 2 . 2 39 39 ILE N N 15 127.570000 0 . . . . . . . 39 Ile N . 52244 2 69 . 2 . 2 40 40 TYR C C 13 177.700000 0 . . . . . . . 40 Tyr CO . 52244 2 70 . 2 . 2 41 41 VAL H H 1 8.300000 0 . . . . . . . 41 Val HN . 52244 2 71 . 2 . 2 41 41 VAL C C 13 177.950000 0 . . . . . . . 41 Val CO . 52244 2 72 . 2 . 2 41 41 VAL CA C 13 57.900000 0 . . . . . . . 41 Val CA . 52244 2 73 . 2 . 2 41 41 VAL CB C 13 30.170000 0 . . . . . . . 41 Val CB . 52244 2 74 . 2 . 2 41 41 VAL N N 15 120.300000 0 . . . . . . . 41 Val N . 52244 2 75 . 2 . 2 42 42 TYR H H 1 8.330000 0 . . . . . . . 42 Tyr HN . 52244 2 76 . 2 . 2 42 42 TYR C C 13 177.950000 0 . . . . . . . 42 Tyr CO . 52244 2 77 . 2 . 2 42 42 TYR CA C 13 61.820000 0 . . . . . . . 42 Tyr CA . 52244 2 78 . 2 . 2 42 42 TYR N N 15 118.500000 0 . . . . . . . 42 Tyr N . 52244 2 79 . 2 . 2 43 43 LYS H H 1 7.420000 0 . . . . . . . 43 Lys HN . 52244 2 80 . 2 . 2 43 43 LYS C C 13 179.740000 0 . . . . . . . 43 Lys CO . 52244 2 81 . 2 . 2 43 43 LYS CA C 13 59.680000 0 . . . . . . . 43 Lys CA . 52244 2 82 . 2 . 2 43 43 LYS CB C 13 31.680000 0 . . . . . . . 43 Lys CB . 52244 2 83 . 2 . 2 43 43 LYS N N 15 117.840000 0 . . . . . . . 43 Lys N . 52244 2 84 . 2 . 2 44 44 VAL H H 1 7.910000 0 . . . . . . . 44 Val HN . 52244 2 85 . 2 . 2 44 44 VAL C C 13 178.390000 0 . . . . . . . 44 Val CO . 52244 2 86 . 2 . 2 44 44 VAL CA C 13 65.750000 0 . . . . . . . 44 Val CA . 52244 2 87 . 2 . 2 44 44 VAL CB C 13 30.730000 0 . . . . . . . 44 Val CB . 52244 2 88 . 2 . 2 44 44 VAL N N 15 120.240000 0 . . . . . . . 44 Val N . 52244 2 89 . 2 . 2 45 45 LEU H H 1 8.570000 0 . . . . . . . 45 Leu HN . 52244 2 90 . 2 . 2 45 45 LEU C C 13 177.320000 0 . . . . . . . 45 Leu CO . 52244 2 91 . 2 . 2 45 45 LEU CA C 13 57.760000 0 . . . . . . . 45 Leu CA . 52244 2 92 . 2 . 2 45 45 LEU CB C 13 39.970000 0 . . . . . . . 45 Leu CB . 52244 2 93 . 2 . 2 45 45 LEU N N 15 122.170000 0 . . . . . . . 45 Leu N . 52244 2 94 . 2 . 2 46 46 LYS H H 1 7.680000 0 . . . . . . . 46 Lys HN . 52244 2 95 . 2 . 2 46 46 LYS C C 13 177.670000 0 . . . . . . . 46 Lys CO . 52244 2 96 . 2 . 2 46 46 LYS CA C 13 57.080000 0 . . . . . . . 46 Lys CA . 52244 2 97 . 2 . 2 46 46 LYS CB C 13 30.870000 0 . . . . . . . 46 Lys CB . 52244 2 98 . 2 . 2 46 46 LYS N N 15 114.940000 0 . . . . . . . 46 Lys N . 52244 2 99 . 2 . 2 47 47 GLN H H 1 7.300000 0 . . . . . . . 47 Gln HN . 52244 2 100 . 2 . 2 47 47 GLN C C 13 177.700000 0 . . . . . . . 47 Gln CO . 52244 2 101 . 2 . 2 47 47 GLN CA C 13 57.270000 0 . . . . . . . 47 Gln CA . 52244 2 102 . 2 . 2 47 47 GLN CB C 13 28.450000 0 . . . . . . . 47 Gln CB . 52244 2 103 . 2 . 2 47 47 GLN N N 15 115.300000 0 . . . . . . . 47 Gln N . 52244 2 104 . 2 . 2 48 48 VAL H H 1 7.620000 0 . . . . . . . 48 Val HN . 52244 2 105 . 2 . 2 48 48 VAL C C 13 175.660000 0 . . . . . . . 48 Val CO . 52244 2 106 . 2 . 2 48 48 VAL CA C 13 63.500000 0 . . . . . . . 48 Val CA . 52244 2 107 . 2 . 2 48 48 VAL CB C 13 32.190000 0 . . . . . . . 48 Val CB . 52244 2 108 . 2 . 2 48 48 VAL N N 15 114.420000 0 . . . . . . . 48 Val N . 52244 2 109 . 2 . 2 49 49 HIS H H 1 8.800000 0 . . . . . . . 49 His HN . 52244 2 110 . 2 . 2 49 49 HIS C C 13 172.830000 0 . . . . . . . 49 His CO . 52244 2 111 . 2 . 2 49 49 HIS CA C 13 53.980000 0 . . . . . . . 49 His CA . 52244 2 112 . 2 . 2 49 49 HIS CB C 13 32.060000 0 . . . . . . . 49 His CB . 52244 2 113 . 2 . 2 49 49 HIS N N 15 119.690000 0 . . . . . . . 49 His N . 52244 2 114 . 2 . 2 50 50 PRO C C 13 177.480000 0 . . . . . . . 50 Pro CO . 52244 2 115 . 2 . 2 50 50 PRO CA C 13 64.990000 0 . . . . . . . 50 Pro CA . 52244 2 116 . 2 . 2 51 51 ASP H H 1 8.400000 0 . . . . . . . 51 Asp HN . 52244 2 117 . 2 . 2 51 51 ASP C C 13 176.020000 0 . . . . . . . 51 Asp CO . 52244 2 118 . 2 . 2 51 51 ASP CA C 13 53.420000 0 . . . . . . . 51 Asp CA . 52244 2 119 . 2 . 2 51 51 ASP CB C 13 40.770000 0 . . . . . . . 51 Asp CB . 52244 2 120 . 2 . 2 51 51 ASP N N 15 116.040000 0 . . . . . . . 51 Asp N . 52244 2 121 . 2 . 2 52 52 THR H H 1 7.790000 0 . . . . . . . 52 Thr HN . 52244 2 122 . 2 . 2 52 52 THR C C 13 173.580000 0 . . . . . . . 52 Thr CO . 52244 2 123 . 2 . 2 52 52 THR CA C 13 62.360000 0 . . . . . . . 52 Thr CA . 52244 2 124 . 2 . 2 52 52 THR CB C 13 69.880000 0 . . . . . . . 52 Thr CB . 52244 2 125 . 2 . 2 52 52 THR N N 15 119.620000 0 . . . . . . . 52 Thr N . 52244 2 126 . 2 . 2 53 53 GLY H H 1 8.500000 0 . . . . . . . 53 Gly HN . 52244 2 127 . 2 . 2 53 53 GLY C C 13 173.080000 0 . . . . . . . 53 Gly CO . 52244 2 128 . 2 . 2 53 53 GLY CA C 13 43.200000 0 . . . . . . . 53 Gly CA . 52244 2 129 . 2 . 2 53 53 GLY N N 15 113.350000 0 . . . . . . . 53 Gly N . 52244 2 130 . 2 . 2 54 54 ILE H H 1 8.800000 0 . . . . . . . 54 Ile HN . 52244 2 131 . 2 . 2 54 54 ILE C C 13 173.100000 0 . . . . . . . 54 Ile CO . 52244 2 132 . 2 . 2 54 54 ILE CA C 13 59.580000 0 . . . . . . . 54 Ile CA . 52244 2 133 . 2 . 2 54 54 ILE CB C 13 39.600000 0 . . . . . . . 54 Ile CB . 52244 2 134 . 2 . 2 54 54 ILE N N 15 118.080000 0 . . . . . . . 54 Ile N . 52244 2 135 . 2 . 2 55 55 SER H H 1 8.940000 0 . . . . . . . 55 Ser HN . 52244 2 136 . 2 . 2 55 55 SER C C 13 174.950000 0 . . . . . . . 55 Ser CO . 52244 2 137 . 2 . 2 55 55 SER CA C 13 57.290000 0 . . . . . . . 55 Ser CA . 52244 2 138 . 2 . 2 55 55 SER CB C 13 65.200000 0 . . . . . . . 55 Ser CB . 52244 2 139 . 2 . 2 55 55 SER N N 15 125.240000 0 . . . . . . . 55 Ser N . 52244 2 140 . 2 . 2 57 57 LYS C C 13 179.780000 0 . . . . . . . 57 Lys CO . 52244 2 141 . 2 . 2 57 57 LYS CA C 13 58.790000 0 . . . . . . . 57 Lys CA . 52244 2 142 . 2 . 2 57 57 LYS CB C 13 31.730000 0 . . . . . . . 57 Lys CB . 52244 2 143 . 2 . 2 58 58 ALA H H 1 7.580000 0 . . . . . . . 58 Ala HN . 52244 2 144 . 2 . 2 58 58 ALA C C 13 178.740000 0 . . . . . . . 58 Ala CO . 52244 2 145 . 2 . 2 58 58 ALA CA C 13 54.530000 0 . . . . . . . 58 Ala CA . 52244 2 146 . 2 . 2 58 58 ALA CB C 13 17.630000 0 . . . . . . . 58 Ala CB . 52244 2 147 . 2 . 2 58 58 ALA N N 15 121.640000 0 . . . . . . . 58 Ala N . 52244 2 148 . 2 . 2 59 59 MET H H 1 8.800000 0 . . . . . . . 59 Met HN . 52244 2 149 . 2 . 2 59 59 MET C C 13 178.010000 0 . . . . . . . 59 Met CO . 52244 2 150 . 2 . 2 59 59 MET CA C 13 57.000000 0 . . . . . . . 59 Met CA . 52244 2 151 . 2 . 2 59 59 MET CB C 13 30.260000 0 . . . . . . . 59 Met CB . 52244 2 152 . 2 . 2 59 59 MET N N 15 120.320000 0 . . . . . . . 59 Met N . 52244 2 153 . 2 . 2 60 60 SER H H 1 7.940000 0 . . . . . . . 60 Ser HN . 52244 2 154 . 2 . 2 60 60 SER C C 13 177.660000 0 . . . . . . . 60 Ser CO . 52244 2 155 . 2 . 2 60 60 SER CA C 13 61.520000 0 . . . . . . . 60 Ser CA . 52244 2 156 . 2 . 2 60 60 SER N N 15 115.880000 0 . . . . . . . 60 Ser N . 52244 2 157 . 2 . 2 61 61 ILE H H 1 7.330000 0 . . . . . . . 61 Ile HN . 52244 2 158 . 2 . 2 61 61 ILE C C 13 178.000000 0 . . . . . . . 61 Ile CO . 52244 2 159 . 2 . 2 61 61 ILE CA C 13 64.750000 0 . . . . . . . 61 Ile CA . 52244 2 160 . 2 . 2 61 61 ILE CB C 13 36.360000 0 . . . . . . . 61 Ile CB . 52244 2 161 . 2 . 2 61 61 ILE N N 15 123.400000 0 . . . . . . . 61 Ile N . 52244 2 162 . 2 . 2 62 62 MET H H 1 7.970000 0 . . . . . . . 62 Met HN . 52244 2 163 . 2 . 2 62 62 MET C C 13 178.760000 0 . . . . . . . 62 Met CO . 52244 2 164 . 2 . 2 62 62 MET CA C 13 55.810000 0 . . . . . . . 62 Met CA . 52244 2 165 . 2 . 2 62 62 MET CB C 13 28.300000 0 . . . . . . . 62 Met CB . 52244 2 166 . 2 . 2 62 62 MET N N 15 118.740000 0 . . . . . . . 62 Met N . 52244 2 167 . 2 . 2 63 63 ASN H H 1 8.750000 0 . . . . . . . 63 Asn HN . 52244 2 168 . 2 . 2 63 63 ASN C C 13 178.710000 0 . . . . . . . 63 Asn CO . 52244 2 169 . 2 . 2 63 63 ASN CA C 13 56.850000 0 . . . . . . . 63 Asn CA . 52244 2 170 . 2 . 2 63 63 ASN CB C 13 38.920000 0 . . . . . . . 63 Asn CB . 52244 2 171 . 2 . 2 63 63 ASN N N 15 118.180000 0 . . . . . . . 63 Asn N . 52244 2 172 . 2 . 2 64 64 SER H H 1 8.190000 0 . . . . . . . 64 Ser HN . 52244 2 173 . 2 . 2 64 64 SER CA C 13 62.300000 0 . . . . . . . 64 Ser CA . 52244 2 174 . 2 . 2 64 64 SER N N 15 118.870000 0 . . . . . . . 64 Ser N . 52244 2 175 . 2 . 2 65 65 PHE C C 13 177.210000 0 . . . . . . . 65 Phe CO . 52244 2 176 . 2 . 2 66 66 VAL H H 1 8.360000 0 . . . . . . . 66 Val HN . 52244 2 177 . 2 . 2 66 66 VAL C C 13 177.800000 0 . . . . . . . 66 Val CO . 52244 2 178 . 2 . 2 66 66 VAL CA C 13 67.230000 0 . . . . . . . 66 Val CA . 52244 2 179 . 2 . 2 66 66 VAL CB C 13 30.750000 0 . . . . . . . 66 Val CB . 52244 2 180 . 2 . 2 66 66 VAL N N 15 118.260000 0 . . . . . . . 66 Val N . 52244 2 181 . 2 . 2 67 67 ASN H H 1 8.090000 0 . . . . . . . 67 Asn HN . 52244 2 182 . 2 . 2 67 67 ASN C C 13 177.000000 0 . . . . . . . 67 Asn CO . 52244 2 183 . 2 . 2 67 67 ASN CA C 13 57.250000 0 . . . . . . . 67 Asn CA . 52244 2 184 . 2 . 2 67 67 ASN CB C 13 39.490000 0 . . . . . . . 67 Asn CB . 52244 2 185 . 2 . 2 67 67 ASN N N 15 115.830000 0 . . . . . . . 67 Asn N . 52244 2 186 . 2 . 2 68 68 ASP H H 1 8.280000 0 . . . . . . . 68 Asp HN . 52244 2 187 . 2 . 2 68 68 ASP CA C 13 57.770000 0 . . . . . . . 68 Asp CA . 52244 2 188 . 2 . 2 68 68 ASP CB C 13 30.150000 0 . . . . . . . 68 Asp CB . 52244 2 189 . 2 . 2 68 68 ASP N N 15 120.260000 0 . . . . . . . 68 Asp N . 52244 2 190 . 2 . 2 69 69 VAL H H 1 8.190000 0 . . . . . . . 69 Val HN . 52244 2 191 . 2 . 2 69 69 VAL C C 13 177.700000 0 . . . . . . . 69 Val CO . 52244 2 192 . 2 . 2 69 69 VAL CA C 13 66.840000 0 . . . . . . . 69 Val CA . 52244 2 193 . 2 . 2 69 69 VAL CB C 13 30.220000 0 . . . . . . . 69 Val CB . 52244 2 194 . 2 . 2 69 69 VAL N N 15 118.550000 0 . . . . . . . 69 Val N . 52244 2 195 . 2 . 2 70 70 PHE H H 1 8.570000 0 . . . . . . . 70 Phe HN . 52244 2 196 . 2 . 2 70 70 PHE C C 13 176.190000 0 . . . . . . . 70 Phe CO . 52244 2 197 . 2 . 2 70 70 PHE CA C 13 62.360000 0 . . . . . . . 70 Phe CA . 52244 2 198 . 2 . 2 70 70 PHE CB C 13 38.150000 0 . . . . . . . 70 Phe CB . 52244 2 199 . 2 . 2 70 70 PHE N N 15 120.490000 0 . . . . . . . 70 Phe N . 52244 2 200 . 2 . 2 71 71 GLU H H 1 8.360000 0 . . . . . . . 71 Glu HN . 52244 2 201 . 2 . 2 71 71 GLU C C 13 180.570000 0 . . . . . . . 71 Glu CO . 52244 2 202 . 2 . 2 71 71 GLU CA C 13 59.150000 0 . . . . . . . 71 Glu CA . 52244 2 203 . 2 . 2 71 71 GLU CB C 13 28.850000 0 . . . . . . . 71 Glu CB . 52244 2 204 . 2 . 2 71 71 GLU N N 15 117.870000 0 . . . . . . . 71 Glu N . 52244 2 205 . 2 . 2 72 72 ARG C C 13 179.630000 0 . . . . . . . 72 Arg CO . 52244 2 206 . 2 . 2 72 72 ARG CA C 13 58.890000 0 . . . . . . . 72 Arg CA . 52244 2 207 . 2 . 2 72 72 ARG CB C 13 30.130000 0 . . . . . . . 72 Arg CB . 52244 2 208 . 2 . 2 73 73 ILE H H 1 8.390000 0 . . . . . . . 73 Ile HN . 52244 2 209 . 2 . 2 73 73 ILE C C 13 177.040000 0 . . . . . . . 73 Ile CO . 52244 2 210 . 2 . 2 73 73 ILE CA C 13 64.940000 0 . . . . . . . 73 Ile CA . 52244 2 211 . 2 . 2 73 73 ILE CB C 13 36.390000 0 . . . . . . . 73 Ile CB . 52244 2 212 . 2 . 2 73 73 ILE N N 15 119.830000 0 . . . . . . . 73 Ile N . 52244 2 213 . 2 . 2 74 74 ALA H H 1 8.610000 0 . . . . . . . 74 Ala HN . 52244 2 214 . 2 . 2 74 74 ALA C C 13 179.250000 0 . . . . . . . 74 Ala CO . 52244 2 215 . 2 . 2 74 74 ALA CA C 13 55.250000 0 . . . . . . . 74 Ala CA . 52244 2 216 . 2 . 2 74 74 ALA CB C 13 15.670000 0 . . . . . . . 74 Ala CB . 52244 2 217 . 2 . 2 74 74 ALA N N 15 122.290000 0 . . . . . . . 74 Ala N . 52244 2 218 . 2 . 2 75 75 GLY H H 1 8.120000 0 . . . . . . . 75 Gly HN . 52244 2 219 . 2 . 2 75 75 GLY C C 13 176.910000 0 . . . . . . . 75 Gly CO . 52244 2 220 . 2 . 2 75 75 GLY CA C 13 46.520000 0 . . . . . . . 75 Gly CA . 52244 2 221 . 2 . 2 75 75 GLY N N 15 103.990000 0 . . . . . . . 75 Gly N . 52244 2 222 . 2 . 2 76 76 GLU H H 1 7.710000 0 . . . . . . . 76 Glu HN . 52244 2 223 . 2 . 2 76 76 GLU C C 13 178.310000 0 . . . . . . . 76 Glu CO . 52244 2 224 . 2 . 2 76 76 GLU CA C 13 57.800000 0 . . . . . . . 76 Glu CA . 52244 2 225 . 2 . 2 76 76 GLU CB C 13 28.930000 0 . . . . . . . 76 Glu CB . 52244 2 226 . 2 . 2 76 76 GLU N N 15 124.370000 0 . . . . . . . 76 Glu N . 52244 2 227 . 2 . 2 77 77 ALA H H 1 8.730000 0 . . . . . . . 77 Ala HN . 52244 2 228 . 2 . 2 77 77 ALA C C 13 178.890000 0 . . . . . . . 77 Ala CO . 52244 2 229 . 2 . 2 77 77 ALA CA C 13 54.770000 0 . . . . . . . 77 Ala CA . 52244 2 230 . 2 . 2 77 77 ALA CB C 13 16.980000 0 . . . . . . . 77 Ala CB . 52244 2 231 . 2 . 2 77 77 ALA N N 15 122.080000 0 . . . . . . . 77 Ala N . 52244 2 232 . 2 . 2 78 78 SER H H 1 8.210000 0 . . . . . . . 78 Ser HN . 52244 2 233 . 2 . 2 78 78 SER C C 13 177.420000 0 . . . . . . . 78 Ser CO . 52244 2 234 . 2 . 2 78 78 SER CA C 13 60.790000 0 . . . . . . . 78 Ser CA . 52244 2 235 . 2 . 2 78 78 SER CB C 13 63.220000 0 . . . . . . . 78 Ser CB . 52244 2 236 . 2 . 2 78 78 SER N N 15 111.250000 0 . . . . . . . 78 Ser N . 52244 2 237 . 2 . 2 79 79 ARG H H 1 7.800000 0 . . . . . . . 79 Arg HN . 52244 2 238 . 2 . 2 79 79 ARG C C 13 179.500000 0 . . . . . . . 79 Arg CO . 52244 2 239 . 2 . 2 79 79 ARG CA C 13 59.520000 0 . . . . . . . 79 Arg CA . 52244 2 240 . 2 . 2 79 79 ARG CB C 13 28.940000 0 . . . . . . . 79 Arg CB . 52244 2 241 . 2 . 2 79 79 ARG N N 15 122.790000 0 . . . . . . . 79 Arg N . 52244 2 242 . 2 . 2 80 80 LEU H H 1 8.300000 0 . . . . . . . 80 Leu HN . 52244 2 243 . 2 . 2 80 80 LEU C C 13 179.960000 0 . . . . . . . 80 Leu CO . 52244 2 244 . 2 . 2 80 80 LEU CA C 13 57.300000 0 . . . . . . . 80 Leu CA . 52244 2 245 . 2 . 2 80 80 LEU CB C 13 41.150000 0 . . . . . . . 80 Leu CB . 52244 2 246 . 2 . 2 80 80 LEU N N 15 119.920000 0 . . . . . . . 80 Leu N . 52244 2 247 . 2 . 2 81 81 ALA H H 1 8.350000 0 . . . . . . . 81 Ala HN . 52244 2 248 . 2 . 2 81 81 ALA C C 13 179.430000 0 . . . . . . . 81 Ala CO . 52244 2 249 . 2 . 2 81 81 ALA CA C 13 54.720000 0 . . . . . . . 81 Ala CA . 52244 2 250 . 2 . 2 81 81 ALA CB C 13 17.010000 0 . . . . . . . 81 Ala CB . 52244 2 251 . 2 . 2 81 81 ALA N N 15 122.770000 0 . . . . . . . 81 Ala N . 52244 2 252 . 2 . 2 82 82 HIS H H 1 7.990000 0 . . . . . . . 82 His HN . 52244 2 253 . 2 . 2 82 82 HIS C C 13 178.490000 0 . . . . . . . 82 His CO . 52244 2 254 . 2 . 2 82 82 HIS CA C 13 59.030000 0 . . . . . . . 82 His CA . 52244 2 255 . 2 . 2 82 82 HIS CB C 13 28.950000 0 . . . . . . . 82 His CB . 52244 2 256 . 2 . 2 82 82 HIS N N 15 116.400000 0 . . . . . . . 82 His N . 52244 2 257 . 2 . 2 83 83 TYR H H 1 8.390000 0 . . . . . . . 83 Tyr HN . 52244 2 258 . 2 . 2 83 83 TYR C C 13 176.680000 0 . . . . . . . 83 Tyr CO . 52244 2 259 . 2 . 2 83 83 TYR CA C 13 59.950000 0 . . . . . . . 83 Tyr CA . 52244 2 260 . 2 . 2 83 83 TYR CB C 13 37.560000 0 . . . . . . . 83 Tyr CB . 52244 2 261 . 2 . 2 83 83 TYR N N 15 121.090000 0 . . . . . . . 83 Tyr N . 52244 2 262 . 2 . 2 84 84 ASN H H 1 7.680000 0 . . . . . . . 84 Asn HN . 52244 2 263 . 2 . 2 84 84 ASN C C 13 174.000000 0 . . . . . . . 84 Asn CO . 52244 2 264 . 2 . 2 84 84 ASN CA C 13 52.740000 0 . . . . . . . 84 Asn CA . 52244 2 265 . 2 . 2 84 84 ASN CB C 13 38.950000 0 . . . . . . . 84 Asn CB . 52244 2 266 . 2 . 2 84 84 ASN N N 15 115.890000 0 . . . . . . . 84 Asn N . 52244 2 267 . 2 . 2 87 87 SER C C 13 173.050000 0 . . . . . . . 87 Ser CO . 52244 2 268 . 2 . 2 87 87 SER CA C 13 58.070000 0 . . . . . . . 87 Ser CA . 52244 2 269 . 2 . 2 87 87 SER CB C 13 62.820000 0 . . . . . . . 87 Ser CB . 52244 2 270 . 2 . 2 88 88 THR H H 1 7.370000 0 . . . . . . . 88 Thr HN . 52244 2 271 . 2 . 2 88 88 THR C C 13 173.820000 0 . . . . . . . 88 Thr CO . 52244 2 272 . 2 . 2 88 88 THR CA C 13 59.850000 0 . . . . . . . 88 Thr CA . 52244 2 273 . 2 . 2 88 88 THR CB C 13 70.840000 0 . . . . . . . 88 Thr CB . 52244 2 274 . 2 . 2 88 88 THR N N 15 115.850000 0 . . . . . . . 88 Thr N . 52244 2 275 . 2 . 2 89 89 ILE H H 1 8.040000 0 . . . . . . . 89 Ile HN . 52244 2 276 . 2 . 2 89 89 ILE C C 13 173.550000 0 . . . . . . . 89 Ile CO . 52244 2 277 . 2 . 2 89 89 ILE CA C 13 61.240000 0 . . . . . . . 89 Ile CA . 52244 2 278 . 2 . 2 89 89 ILE CB C 13 38.820000 0 . . . . . . . 89 Ile CB . 52244 2 279 . 2 . 2 89 89 ILE N N 15 123.810000 0 . . . . . . . 89 Ile N . 52244 2 280 . 2 . 2 90 90 THR H H 1 9.280000 0 . . . . . . . 90 Thr HN . 52244 2 281 . 2 . 2 90 90 THR C C 13 176.220000 0 . . . . . . . 90 Thr CO . 52244 2 282 . 2 . 2 90 90 THR CA C 13 59.820000 0 . . . . . . . 90 Thr CA . 52244 2 283 . 2 . 2 90 90 THR CB C 13 73.100000 0 . . . . . . . 90 Thr CB . 52244 2 284 . 2 . 2 90 90 THR N N 15 121.060000 0 . . . . . . . 90 Thr N . 52244 2 285 . 2 . 2 91 91 SER C C 13 174.470000 0 . . . . . . . 91 Ser CO . 52244 2 286 . 2 . 2 91 91 SER CA C 13 62.030000 0 . . . . . . . 91 Ser CA . 52244 2 287 . 2 . 2 92 92 ARG H H 1 7.830000 0 . . . . . . . 92 Arg HN . 52244 2 288 . 2 . 2 92 92 ARG C C 13 178.440000 0 . . . . . . . 92 Arg CO . 52244 2 289 . 2 . 2 92 92 ARG CA C 13 58.950000 0 . . . . . . . 92 Arg CA . 52244 2 290 . 2 . 2 92 92 ARG CB C 13 28.860000 0 . . . . . . . 92 Arg CB . 52244 2 291 . 2 . 2 92 92 ARG N N 15 122.580000 0 . . . . . . . 92 Arg N . 52244 2 292 . 2 . 2 93 93 GLU H H 1 7.440000 0 . . . . . . . 93 Glu HN . 52244 2 293 . 2 . 2 93 93 GLU C C 13 178.470000 0 . . . . . . . 93 Glu CO . 52244 2 294 . 2 . 2 93 93 GLU CA C 13 61.090000 0 . . . . . . . 93 Glu CA . 52244 2 295 . 2 . 2 93 93 GLU CB C 13 28.410000 0 . . . . . . . 93 Glu CB . 52244 2 296 . 2 . 2 93 93 GLU N N 15 119.560000 0 . . . . . . . 93 Glu N . 52244 2 297 . 2 . 2 94 94 ILE H H 1 7.110000 0 . . . . . . . 94 Ile HN . 52244 2 298 . 2 . 2 94 94 ILE C C 13 176.320000 0 . . . . . . . 94 Ile CO . 52244 2 299 . 2 . 2 94 94 ILE CA C 13 61.890000 0 . . . . . . . 94 Ile CA . 52244 2 300 . 2 . 2 94 94 ILE CB C 13 33.640000 0 . . . . . . . 94 Ile CB . 52244 2 301 . 2 . 2 94 94 ILE N N 15 116.360000 0 . . . . . . . 94 Ile N . 52244 2 302 . 2 . 2 95 95 GLN H H 1 7.920000 0 . . . . . . . 95 Gln HN . 52244 2 303 . 2 . 2 95 95 GLN C C 13 177.320000 0 . . . . . . . 95 Gln CO . 52244 2 304 . 2 . 2 95 95 GLN CA C 13 59.650000 0 . . . . . . . 95 Gln CA . 52244 2 305 . 2 . 2 95 95 GLN CB C 13 28.290000 0 . . . . . . . 95 Gln CB . 52244 2 306 . 2 . 2 95 95 GLN N N 15 119.770000 0 . . . . . . . 95 Gln N . 52244 2 307 . 2 . 2 96 96 THR H H 1 8.060000 0 . . . . . . . 96 Thr HN . 52244 2 308 . 2 . 2 96 96 THR C C 13 175.720000 0 . . . . . . . 96 Thr CO . 52244 2 309 . 2 . 2 96 96 THR CA C 13 66.370000 0 . . . . . . . 96 Thr CA . 52244 2 310 . 2 . 2 96 96 THR CB C 13 68.180000 0 . . . . . . . 96 Thr CB . 52244 2 311 . 2 . 2 96 96 THR N N 15 115.850000 0 . . . . . . . 96 Thr N . 52244 2 312 . 2 . 2 97 97 ALA H H 1 7.840000 0 . . . . . . . 97 Ala HN . 52244 2 313 . 2 . 2 97 97 ALA C C 13 178.980000 0 . . . . . . . 97 Ala CO . 52244 2 314 . 2 . 2 97 97 ALA CA C 13 55.480000 0 . . . . . . . 97 Ala CA . 52244 2 315 . 2 . 2 97 97 ALA CB C 13 18.890000 0 . . . . . . . 97 Ala CB . 52244 2 316 . 2 . 2 97 97 ALA N N 15 123.370000 0 . . . . . . . 97 Ala N . 52244 2 317 . 2 . 2 98 98 VAL H H 1 8.480000 0 . . . . . . . 98 Val HN . 52244 2 318 . 2 . 2 98 98 VAL C C 13 177.050000 0 . . . . . . . 98 Val CO . 52244 2 319 . 2 . 2 98 98 VAL CA C 13 66.820000 0 . . . . . . . 98 Val CA . 52244 2 320 . 2 . 2 98 98 VAL CB C 13 30.200000 0 . . . . . . . 98 Val CB . 52244 2 321 . 2 . 2 98 98 VAL N N 15 118.310000 0 . . . . . . . 98 Val N . 52244 2 322 . 2 . 2 99 99 ARG H H 1 7.860000 0 . . . . . . . 99 Arg HN . 52244 2 323 . 2 . 2 99 99 ARG C C 13 178.240000 0 . . . . . . . 99 Arg CO . 52244 2 324 . 2 . 2 99 99 ARG CA C 13 58.850000 0 . . . . . . . 99 Arg CA . 52244 2 325 . 2 . 2 99 99 ARG CB C 13 29.340000 0 . . . . . . . 99 Arg CB . 52244 2 326 . 2 . 2 99 99 ARG N N 15 117.270000 0 . . . . . . . 99 Arg N . 52244 2 327 . 2 . 2 100 100 LEU H H 1 7.740000 0 . . . . . . . 100 Leu HN . 52244 2 328 . 2 . 2 100 100 LEU C C 13 179.160000 0 . . . . . . . 100 Leu CO . 52244 2 329 . 2 . 2 100 100 LEU CA C 13 56.460000 0 . . . . . . . 100 Leu CA . 52244 2 330 . 2 . 2 100 100 LEU CB C 13 41.730000 0 . . . . . . . 100 Leu CB . 52244 2 331 . 2 . 2 100 100 LEU N N 15 118.180000 0 . . . . . . . 100 Leu N . 52244 2 332 . 2 . 2 101 101 LEU H H 1 7.840000 0 . . . . . . . 101 Leu HN . 52244 2 333 . 2 . 2 101 101 LEU CA C 13 55.700000 0 . . . . . . . 101 Leu CA . 52244 2 334 . 2 . 2 101 101 LEU CB C 13 43.640000 0 . . . . . . . 101 Leu CB . 52244 2 335 . 2 . 2 101 101 LEU N N 15 117.910000 0 . . . . . . . 101 Leu N . 52244 2 336 . 2 . 2 103 103 PRO C C 13 177.030000 0 . . . . . . . 103 Pro CO . 52244 2 337 . 2 . 2 103 103 PRO CA C 13 61.860000 0 . . . . . . . 103 Pro CA . 52244 2 338 . 2 . 2 103 103 PRO CB C 13 31.320000 0 . . . . . . . 103 Pro CB . 52244 2 339 . 2 . 2 104 104 GLY H H 1 8.140000 0 . . . . . . . 104 Gly HN . 52244 2 340 . 2 . 2 104 104 GLY C C 13 176.170000 0 . . . . . . . 104 Gly CO . 52244 2 341 . 2 . 2 104 104 GLY CA C 13 47.460000 0 . . . . . . . 104 Gly CA . 52244 2 342 . 2 . 2 104 104 GLY N N 15 105.700000 0 . . . . . . . 104 Gly N . 52244 2 343 . 2 . 2 105 105 GLU H H 1 10.170000 0 . . . . . . . 105 Glu HN . 52244 2 344 . 2 . 2 105 105 GLU C C 13 178.740000 0 . . . . . . . 105 Glu CO . 52244 2 345 . 2 . 2 105 105 GLU CA C 13 58.480000 0 . . . . . . . 105 Glu CA . 52244 2 346 . 2 . 2 105 105 GLU CB C 13 28.290000 0 . . . . . . . 105 Glu CB . 52244 2 347 . 2 . 2 105 105 GLU N N 15 128.820000 0 . . . . . . . 105 Glu N . 52244 2 348 . 2 . 2 106 106 LEU C C 13 179.310000 0 . . . . . . . 106 Leu CO . 52244 2 349 . 2 . 2 106 106 LEU CA C 13 57.300000 0 . . . . . . . 106 Leu CA . 52244 2 350 . 2 . 2 106 106 LEU CB C 13 41.650000 0 . . . . . . . 106 Leu CB . 52244 2 351 . 2 . 2 107 107 ALA H H 1 7.610000 0 . . . . . . . 107 Ala HN . 52244 2 352 . 2 . 2 107 107 ALA C C 13 179.100000 0 . . . . . . . 107 Ala CO . 52244 2 353 . 2 . 2 107 107 ALA CA C 13 54.890000 0 . . . . . . . 107 Ala CA . 52244 2 354 . 2 . 2 107 107 ALA CB C 13 17.830000 0 . . . . . . . 107 Ala CB . 52244 2 355 . 2 . 2 107 107 ALA N N 15 118.590000 0 . . . . . . . 107 Ala N . 52244 2 356 . 2 . 2 108 108 LYS H H 1 7.190000 0 . . . . . . . 108 Lys HN . 52244 2 357 . 2 . 2 108 108 LYS C C 13 180.010000 0 . . . . . . . 108 Lys CO . 52244 2 358 . 2 . 2 108 108 LYS CA C 13 59.170000 0 . . . . . . . 108 Lys CA . 52244 2 359 . 2 . 2 108 108 LYS CB C 13 31.330000 0 . . . . . . . 108 Lys CB . 52244 2 360 . 2 . 2 108 108 LYS N N 15 117.050000 0 . . . . . . . 108 Lys N . 52244 2 361 . 2 . 2 109 109 HIS H H 1 7.970000 0 . . . . . . . 109 His HN . 52244 2 362 . 2 . 2 109 109 HIS C C 13 177.270000 0 . . . . . . . 109 His CO . 52244 2 363 . 2 . 2 109 109 HIS CA C 13 58.640000 0 . . . . . . . 109 His CA . 52244 2 364 . 2 . 2 109 109 HIS CB C 13 29.210000 0 . . . . . . . 109 His CB . 52244 2 365 . 2 . 2 109 109 HIS N N 15 118.880000 0 . . . . . . . 109 His N . 52244 2 366 . 2 . 2 110 110 ALA H H 1 8.440000 0 . . . . . . . 110 Ala HN . 52244 2 367 . 2 . 2 110 110 ALA C C 13 179.070000 0 . . . . . . . 110 Ala CO . 52244 2 368 . 2 . 2 110 110 ALA CA C 13 55.280000 0 . . . . . . . 110 Ala CA . 52244 2 369 . 2 . 2 110 110 ALA CB C 13 18.440000 0 . . . . . . . 110 Ala CB . 52244 2 370 . 2 . 2 110 110 ALA N N 15 123.230000 0 . . . . . . . 110 Ala N . 52244 2 371 . 2 . 2 111 111 VAL H H 1 8.170000 0 . . . . . . . 111 Val HN . 52244 2 372 . 2 . 2 111 111 VAL C C 13 179.800000 0 . . . . . . . 111 Val CO . 52244 2 373 . 2 . 2 111 111 VAL CA C 13 64.110000 0 . . . . . . . 111 Val CA . 52244 2 374 . 2 . 2 111 111 VAL CB C 13 30.670000 0 . . . . . . . 111 Val CB . 52244 2 375 . 2 . 2 111 111 VAL N N 15 117.170000 0 . . . . . . . 111 Val N . 52244 2 376 . 2 . 2 112 112 SER H H 1 7.450000 0 . . . . . . . 112 Ser HN . 52244 2 377 . 2 . 2 112 112 SER C C 13 177.170000 0 . . . . . . . 112 Ser CO . 52244 2 378 . 2 . 2 112 112 SER CA C 13 61.250000 0 . . . . . . . 112 Ser CA . 52244 2 379 . 2 . 2 112 112 SER CB C 13 62.570000 0 . . . . . . . 112 Ser CB . 52244 2 380 . 2 . 2 112 112 SER N N 15 117.760000 0 . . . . . . . 112 Ser N . 52244 2 381 . 2 . 2 113 113 GLU H H 1 8.140000 0 . . . . . . . 113 Glu HN . 52244 2 382 . 2 . 2 113 113 GLU C C 13 180.080000 0 . . . . . . . 113 Glu CO . 52244 2 383 . 2 . 2 113 113 GLU CA C 13 58.340000 0 . . . . . . . 113 Glu CA . 52244 2 384 . 2 . 2 113 113 GLU CB C 13 27.830000 0 . . . . . . . 113 Glu CB . 52244 2 385 . 2 . 2 113 113 GLU N N 15 119.870000 0 . . . . . . . 113 Glu N . 52244 2 386 . 2 . 2 114 114 GLY H H 1 8.640000 0 . . . . . . . 114 Gly HN . 52244 2 387 . 2 . 2 114 114 GLY C C 13 174.700000 0 . . . . . . . 114 Gly CO . 52244 2 388 . 2 . 2 114 114 GLY CA C 13 46.360000 0 . . . . . . . 114 Gly CA . 52244 2 389 . 2 . 2 114 114 GLY N N 15 109.570000 0 . . . . . . . 114 Gly N . 52244 2 390 . 2 . 2 115 115 THR H H 1 7.990000 0 . . . . . . . 115 Thr HN . 52244 2 391 . 2 . 2 115 115 THR C C 13 177.490000 0 . . . . . . . 115 Thr CO . 52244 2 392 . 2 . 2 115 115 THR CA C 13 66.270000 0 . . . . . . . 115 Thr CA . 52244 2 393 . 2 . 2 115 115 THR CB C 13 68.420000 0 . . . . . . . 115 Thr CB . 52244 2 394 . 2 . 2 115 115 THR N N 15 116.860000 0 . . . . . . . 115 Thr N . 52244 2 395 . 2 . 2 116 116 LYS H H 1 7.920000 0 . . . . . . . 116 Lys HN . 52244 2 396 . 2 . 2 116 116 LYS C C 13 178.800000 0 . . . . . . . 116 Lys CO . 52244 2 397 . 2 . 2 116 116 LYS CA C 13 59.260000 0 . . . . . . . 116 Lys CA . 52244 2 398 . 2 . 2 116 116 LYS CB C 13 31.360000 0 . . . . . . . 116 Lys CB . 52244 2 399 . 2 . 2 116 116 LYS N N 15 123.030000 0 . . . . . . . 116 Lys N . 52244 2 400 . 2 . 2 117 117 ALA H H 1 7.680000 0 . . . . . . . 117 Ala HN . 52244 2 401 . 2 . 2 117 117 ALA C C 13 179.900000 0 . . . . . . . 117 Ala CO . 52244 2 402 . 2 . 2 117 117 ALA CA C 13 54.740000 0 . . . . . . . 117 Ala CA . 52244 2 403 . 2 . 2 117 117 ALA CB C 13 18.260000 0 . . . . . . . 117 Ala CB . 52244 2 404 . 2 . 2 117 117 ALA N N 15 121.680000 0 . . . . . . . 117 Ala N . 52244 2 405 . 2 . 2 118 118 VAL H H 1 8.080000 0 . . . . . . . 118 Val HN . 52244 2 406 . 2 . 2 118 118 VAL C C 13 178.910000 0 . . . . . . . 118 Val CO . 52244 2 407 . 2 . 2 118 118 VAL CA C 13 66.500000 0 . . . . . . . 118 Val CA . 52244 2 408 . 2 . 2 118 118 VAL CB C 13 30.760000 0 . . . . . . . 118 Val CB . 52244 2 409 . 2 . 2 118 118 VAL N N 15 117.900000 0 . . . . . . . 118 Val N . 52244 2 410 . 2 . 2 119 119 THR H H 1 8.010000 0 . . . . . . . 119 Thr HN . 52244 2 411 . 2 . 2 119 119 THR C C 13 175.970000 0 . . . . . . . 119 Thr CO . 52244 2 412 . 2 . 2 119 119 THR CA C 13 65.810000 0 . . . . . . . 119 Thr CA . 52244 2 413 . 2 . 2 119 119 THR CB C 13 68.360000 0 . . . . . . . 119 Thr CB . 52244 2 414 . 2 . 2 119 119 THR N N 15 117.300000 0 . . . . . . . 119 Thr N . 52244 2 415 . 2 . 2 120 120 LYS H H 1 7.820000 0 . . . . . . . 120 Lys HN . 52244 2 416 . 2 . 2 120 120 LYS C C 13 178.250000 0 . . . . . . . 120 Lys CO . 52244 2 417 . 2 . 2 120 120 LYS CA C 13 58.240000 0 . . . . . . . 120 Lys CA . 52244 2 418 . 2 . 2 120 120 LYS CB C 13 31.950000 0 . . . . . . . 120 Lys CB . 52244 2 419 . 2 . 2 120 120 LYS N N 15 121.360000 0 . . . . . . . 120 Lys N . 52244 2 420 . 2 . 2 121 121 TYR H H 1 8.200000 0 . . . . . . . 121 Tyr HN . 52244 2 421 . 2 . 2 121 121 TYR C C 13 176.840000 0 . . . . . . . 121 Tyr CO . 52244 2 422 . 2 . 2 121 121 TYR CA C 13 59.480000 0 . . . . . . . 121 Tyr CA . 52244 2 423 . 2 . 2 121 121 TYR CB C 13 38.360000 0 . . . . . . . 121 Tyr CB . 52244 2 424 . 2 . 2 121 121 TYR N N 15 118.170000 0 . . . . . . . 121 Tyr N . 52244 2 425 . 2 . 2 122 122 THR H H 1 7.920000 0 . . . . . . . 122 Thr HN . 52244 2 426 . 2 . 2 122 122 THR C C 13 174.630000 0 . . . . . . . 122 Thr CO . 52244 2 427 . 2 . 2 122 122 THR CA C 13 62.240000 0 . . . . . . . 122 Thr CA . 52244 2 428 . 2 . 2 122 122 THR CB C 13 69.530000 0 . . . . . . . 122 Thr CB . 52244 2 429 . 2 . 2 122 122 THR N N 15 112.440000 0 . . . . . . . 122 Thr N . 52244 2 430 . 2 . 2 123 123 SER H H 1 7.930000 0 . . . . . . . 123 Ser HN . 52244 2 431 . 2 . 2 123 123 SER C C 13 174.030000 0 . . . . . . . 123 Ser CO . 52244 2 432 . 2 . 2 123 123 SER CA C 13 58.340000 0 . . . . . . . 123 Ser CA . 52244 2 433 . 2 . 2 123 123 SER CB C 13 63.240000 0 . . . . . . . 123 Ser CB . 52244 2 434 . 2 . 2 123 123 SER N N 15 117.560000 0 . . . . . . . 123 Ser N . 52244 2 435 . 2 . 2 124 124 ALA H H 1 8.050000 0 . . . . . . . 124 Ala HN . 52244 2 436 . 2 . 2 124 124 ALA C C 13 176.600000 0 . . . . . . . 124 Ala CO . 52244 2 437 . 2 . 2 124 124 ALA CA C 13 52.240000 0 . . . . . . . 124 Ala CA . 52244 2 438 . 2 . 2 124 124 ALA CB C 13 18.490000 0 . . . . . . . 124 Ala CB . 52244 2 439 . 2 . 2 124 124 ALA N N 15 126.700000 0 . . . . . . . 124 Ala N . 52244 2 440 . 2 . 2 125 125 LYS H H 1 7.810000 0 . . . . . . . 125 Lys HN . 52244 2 441 . 2 . 2 125 125 LYS C C 13 181.470000 0 . . . . . . . 125 Lys CO . 52244 2 442 . 2 . 2 125 125 LYS CA C 13 57.220000 0 . . . . . . . 125 Lys CA . 52244 2 443 . 2 . 2 125 125 LYS CB C 13 32.710000 0 . . . . . . . 125 Lys CB . 52244 2 444 . 2 . 2 125 125 LYS N N 15 126.210000 0 . . . . . . . 125 Lys N . 52244 2 stop_ save_