################################### # 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 53013 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Backbone Shifts of UEVLD' _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 HSQC' . . . 53013 1 3 '3D HNCACB' . . . 53013 1 4 '3D CBCA(CO)NH' . . . 53013 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 53013 1 2 $software_2 . . 53013 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 2 2 MET H H 1 9.143317752 0.05392751219 . 1 . . . . . 1 MET H . 53013 1 2 . 1 . 1 2 2 MET CA C 13 54.58856822 0.005290603572 . 1 . . . . . 1 MET CA . 53013 1 3 . 1 . 1 2 2 MET CB C 13 35.95953825 0.01692967309 . 1 . . . . . 1 MET CB . 53013 1 4 . 1 . 1 2 2 MET N N 15 118.7001346 0.05853247341 . 1 . . . . . 1 MET N . 53013 1 5 . 1 . 1 3 3 GLU H H 1 8.629600463 0.05753818144 . 1 . . . . . 2 GLU H . 53013 1 6 . 1 . 1 3 3 GLU CA C 13 56.57861268 0.05943715054 . 1 . . . . . 2 GLU CA . 53013 1 7 . 1 . 1 3 3 GLU CB C 13 30.29896581 0.02896808794 . 1 . . . . . 2 GLU CB . 53013 1 8 . 1 . 1 3 3 GLU N N 15 121.7460409 0.06773778636 . 1 . . . . . 2 GLU N . 53013 1 9 . 1 . 1 4 4 PHE H H 1 9.404240986 0.05683262234 . 1 . . . . . 3 PHE H . 53013 1 10 . 1 . 1 4 4 PHE CA C 13 61.89913552 0.03326645698 . 1 . . . . . 3 PHE CA . 53013 1 11 . 1 . 1 4 4 PHE CB C 13 39.64558357 0.07041815115 . 1 . . . . . 3 PHE CB . 53013 1 12 . 1 . 1 4 4 PHE N N 15 121.5224198 0.1935398323 . 1 . . . . . 3 PHE N . 53013 1 13 . 1 . 1 5 5 ASP H H 1 5.501079938 0.06605978271 . 1 . . . . . 4 ASP H . 53013 1 14 . 1 . 1 5 5 ASP CA C 13 53.33301311 0.02173958339 . 1 . . . . . 4 ASP CA . 53013 1 15 . 1 . 1 5 5 ASP CB C 13 43.92870188 0.1090708354 . 1 . . . . . 4 ASP CB . 53013 1 16 . 1 . 1 5 5 ASP N N 15 125.3585062 0.145309388 . 1 . . . . . 4 ASP N . 53013 1 17 . 1 . 1 6 6 CYS H H 1 8.707007463 0.05738146618 . 1 . . . . . 5 CYS H . 53013 1 18 . 1 . 1 6 6 CYS CA C 13 63.45602518 0.06336653474 . 1 . . . . . 5 CYS CA . 53013 1 19 . 1 . 1 6 6 CYS CB C 13 26.66959975 0.03499012202 . 1 . . . . . 5 CYS CB . 53013 1 20 . 1 . 1 6 6 CYS N N 15 125.479238 0.1406931475 . 1 . . . . . 5 CYS N . 53013 1 21 . 1 . 1 7 7 GLU H H 1 8.149167525 0.05826025708 . 1 . . . . . 6 GLU H . 53013 1 22 . 1 . 1 7 7 GLU CA C 13 58.39331892 0.08234978372 . 1 . . . . . 6 GLU CA . 53013 1 23 . 1 . 1 7 7 GLU CB C 13 28.40597094 0.0436906953 . 1 . . . . . 6 GLU CB . 53013 1 24 . 1 . 1 7 7 GLU N N 15 117.7386646 0.07853651823 . 1 . . . . . 6 GLU N . 53013 1 25 . 1 . 1 8 8 GLY H H 1 8.623262191 0.05914554528 . 1 . . . . . 7 GLY H . 53013 1 26 . 1 . 1 8 8 GLY CA C 13 46.99624672 0.01255104861 . 1 . . . . . 7 GLY CA . 53013 1 27 . 1 . 1 8 8 GLY N N 15 109.2974004 0.2455031948 . 1 . . . . . 7 GLY N . 53013 1 28 . 1 . 1 9 9 LEU H H 1 7.911565272 0.05353928013 . 1 . . . . . 8 LEU H . 53013 1 29 . 1 . 1 9 9 LEU CA C 13 57.26172806 0.01639052731 . 1 . . . . . 8 LEU CA . 53013 1 30 . 1 . 1 9 9 LEU CB C 13 41.27988959 0.05980055376 . 1 . . . . . 8 LEU CB . 53013 1 31 . 1 . 1 9 9 LEU N N 15 120.6174541 0.1146385285 . 1 . . . . . 8 LEU N . 53013 1 32 . 1 . 1 10 10 ARG H H 1 8.076488347 0.05806860356 . 1 . . . . . 9 ARG H . 53013 1 33 . 1 . 1 10 10 ARG CA C 13 61.06311758 0.06197764521 . 1 . . . . . 9 ARG CA . 53013 1 34 . 1 . 1 10 10 ARG CB C 13 30.00671472 0.03299967259 . 1 . . . . . 9 ARG CB . 53013 1 35 . 1 . 1 10 10 ARG N N 15 119.5507342 0.05720336687 . 1 . . . . . 9 ARG N . 53013 1 36 . 1 . 1 11 11 ARG H H 1 7.462869675 0.06024933651 . 1 . . . . . 10 ARG H . 53013 1 37 . 1 . 1 11 11 ARG CA C 13 58.98932019 0.01085780826 . 1 . . . . . 10 ARG CA . 53013 1 38 . 1 . 1 11 11 ARG CB C 13 30.31476678 0.02510522305 . 1 . . . . . 10 ARG CB . 53013 1 39 . 1 . 1 11 11 ARG N N 15 115.2893434 0.1128962712 . 1 . . . . . 10 ARG N . 53013 1 40 . 1 . 1 12 12 LEU H H 1 7.510798392 0.06209932027 . 1 . . . . . 11 LEU H . 53013 1 41 . 1 . 1 12 12 LEU CA C 13 56.53052687 0.02710679019 . 1 . . . . . 11 LEU CA . 53013 1 42 . 1 . 1 12 12 LEU CB C 13 42.63598446 0.1113694877 . 1 . . . . . 11 LEU CB . 53013 1 43 . 1 . 1 12 12 LEU N N 15 119.4107321 0.07983479192 . 1 . . . . . 11 LEU N . 53013 1 44 . 1 . 1 13 13 LEU H H 1 7.36547623 0.06035324585 . 1 . . . . . 12 LEU H . 53013 1 45 . 1 . 1 13 13 LEU CA C 13 54.2464898 0.09534244212 . 1 . . . . . 12 LEU CA . 53013 1 46 . 1 . 1 13 13 LEU CB C 13 41.57059132 0.03880852837 . 1 . . . . . 12 LEU CB . 53013 1 47 . 1 . 1 13 13 LEU N N 15 117.6358298 0.05281715815 . 1 . . . . . 12 LEU N . 53013 1 48 . 1 . 1 14 14 GLY H H 1 7.745394917 0.06138779454 . 1 . . . . . 13 GLY H . 53013 1 49 . 1 . 1 14 14 GLY CA C 13 48.15459347 0.04377070933 . 1 . . . . . 13 GLY CA . 53013 1 50 . 1 . 1 14 14 GLY N N 15 107.5760472 0.2614160754 . 1 . . . . . 13 GLY N . 53013 1 51 . 1 . 1 15 15 LYS H H 1 8.939042664 0.05644941155 . 1 . . . . . 14 LYS H . 53013 1 52 . 1 . 1 15 15 LYS CA C 13 55.89048792 0.09713342935 . 1 . . . . . 14 LYS CA . 53013 1 53 . 1 . 1 15 15 LYS CB C 13 31.74445393 0.02713869428 . 1 . . . . . 14 LYS CB . 53013 1 54 . 1 . 1 15 15 LYS N N 15 116.7478451 0.1657838036 . 1 . . . . . 14 LYS N . 53013 1 55 . 1 . 1 16 16 TYR H H 1 8.210276284 0.05780716754 . 1 . . . . . 15 TYR H . 53013 1 56 . 1 . 1 16 16 TYR CA C 13 59.32750487 0.09725112783 . 1 . . . . . 15 TYR CA . 53013 1 57 . 1 . 1 16 16 TYR CB C 13 35.74649518 0.05148607693 . 1 . . . . . 15 TYR CB . 53013 1 58 . 1 . 1 16 16 TYR N N 15 124.8548414 0.1377878012 . 1 . . . . . 15 TYR N . 53013 1 59 . 1 . 1 17 17 LYS H H 1 8.058446677 0.05783441937 . 1 . . . . . 16 LYS H . 53013 1 60 . 1 . 1 17 17 LYS CA C 13 59.18498214 0.059566733 . 1 . . . . . 16 LYS CA . 53013 1 61 . 1 . 1 17 17 LYS CB C 13 33.27368627 0.03654884643 . 1 . . . . . 16 LYS CB . 53013 1 62 . 1 . 1 17 17 LYS N N 15 123.4281632 0.1241908031 . 1 . . . . . 16 LYS N . 53013 1 63 . 1 . 1 18 18 PHE H H 1 9.801162512 0.05684089242 . 1 . . . . . 17 PHE H . 53013 1 64 . 1 . 1 18 18 PHE CA C 13 55.45963322 0.09375279376 . 1 . . . . . 17 PHE CA . 53013 1 65 . 1 . 1 18 18 PHE CB C 13 36.61745825 0.0604201821 . 1 . . . . . 17 PHE CB . 53013 1 66 . 1 . 1 18 18 PHE N N 15 120.9416593 0.134183441 . 1 . . . . . 17 PHE N . 53013 1 67 . 1 . 1 19 19 ARG H H 1 7.707500273 0.06194097017 . 1 . . . . . 18 ARG H . 53013 1 68 . 1 . 1 19 19 ARG CA C 13 60.47184009 0.01252619994 . 1 . . . . . 18 ARG CA . 53013 1 69 . 1 . 1 19 19 ARG CB C 13 30.93288987 0.08482830166 . 1 . . . . . 18 ARG CB . 53013 1 70 . 1 . 1 19 19 ARG N N 15 122.7545967 0.08429740006 . 1 . . . . . 18 ARG N . 53013 1 71 . 1 . 1 20 20 ASP H H 1 8.577114396 0.05672404313 . 1 . . . . . 19 ASP H . 53013 1 72 . 1 . 1 20 20 ASP CA C 13 58.26682274 0.02581006284 . 1 . . . . . 19 ASP CA . 53013 1 73 . 1 . 1 20 20 ASP CB C 13 39.36389394 0.01395360007 . 1 . . . . . 19 ASP CB . 53013 1 74 . 1 . 1 20 20 ASP N N 15 118.8433603 0.05017683819 . 1 . . . . . 19 ASP N . 53013 1 75 . 1 . 1 21 21 LEU H H 1 8.320166341 0.05813907163 . 1 . . . . . 20 LEU H . 53013 1 76 . 1 . 1 21 21 LEU CA C 13 58.24341232 0.05061770795 . 1 . . . . . 20 LEU CA . 53013 1 77 . 1 . 1 21 21 LEU CB C 13 42.33466362 0.02232124564 . 1 . . . . . 20 LEU CB . 53013 1 78 . 1 . 1 21 21 LEU N N 15 121.4188803 0.06211505987 . 1 . . . . . 20 LEU N . 53013 1 79 . 1 . 1 22 22 THR H H 1 8.22857276 0.06037312084 . 1 . . . . . 21 THR H . 53013 1 80 . 1 . 1 22 22 THR CA C 13 69.3170007 0.01677053813 . 1 . . . . . 21 THR CA . 53013 1 81 . 1 . 1 22 22 THR CB C 13 68.61066151 0.201777933 . 1 . . . . . 21 THR CB . 53013 1 82 . 1 . 1 22 22 THR N N 15 117.9616129 0.04571657378 . 1 . . . . . 21 THR N . 53013 1 83 . 1 . 1 23 23 VAL H H 1 8.687550422 0.05693253192 . 1 . . . . . 22 VAL H . 53013 1 84 . 1 . 1 23 23 VAL CA C 13 67.89047978 0.0649146658 . 1 . . . . . 22 VAL CA . 53013 1 85 . 1 . 1 23 23 VAL CB C 13 31.60601041 0.0 . 1 . . . . . 22 VAL CB . 53013 1 86 . 1 . 1 23 23 VAL N N 15 120.9084062 0.08546617463 . 1 . . . . . 22 VAL N . 53013 1 87 . 1 . 1 24 24 GLU H H 1 7.834555813 0.05746645547 . 1 . . . . . 23 GLU H . 53013 1 88 . 1 . 1 24 24 GLU CA C 13 59.04673169 0.04180310146 . 1 . . . . . 23 GLU CA . 53013 1 89 . 1 . 1 24 24 GLU CB C 13 28.89149939 0.04171868058 . 1 . . . . . 23 GLU CB . 53013 1 90 . 1 . 1 24 24 GLU N N 15 118.2291514 0.07784928993 . 1 . . . . . 23 GLU N . 53013 1 91 . 1 . 1 25 25 GLU H H 1 7.845060134 0.05952453392 . 1 . . . . . 24 GLU H . 53013 1 92 . 1 . 1 25 25 GLU CA C 13 60.51973511 0.05311617758 . 1 . . . . . 24 GLU CA . 53013 1 93 . 1 . 1 25 25 GLU CB C 13 30.15217193 0.08588273098 . 1 . . . . . 24 GLU CB . 53013 1 94 . 1 . 1 25 25 GLU N N 15 120.1913322 0.04606008942 . 1 . . . . . 24 GLU N . 53013 1 95 . 1 . 1 26 26 LEU H H 1 8.276904269 0.06152925521 . 1 . . . . . 25 LEU H . 53013 1 96 . 1 . 1 26 26 LEU CA C 13 57.51832784 0.06178843686 . 1 . . . . . 25 LEU CA . 53013 1 97 . 1 . 1 26 26 LEU CB C 13 40.65487751 0.09957245601 . 1 . . . . . 25 LEU CB . 53013 1 98 . 1 . 1 26 26 LEU N N 15 119.7648542 0.1151579414 . 1 . . . . . 25 LEU N . 53013 1 99 . 1 . 1 27 27 ARG H H 1 8.576137796 0.05857440721 . 1 . . . . . 26 ARG H . 53013 1 100 . 1 . 1 27 27 ARG CA C 13 59.65970082 0.08931664294 . 1 . . . . . 26 ARG CA . 53013 1 101 . 1 . 1 27 27 ARG CB C 13 30.01916271 0.02155379372 . 1 . . . . . 26 ARG CB . 53013 1 102 . 1 . 1 27 27 ARG N N 15 121.7304933 0.1063749291 . 1 . . . . . 26 ARG N . 53013 1 103 . 1 . 1 28 28 ASN H H 1 7.309997295 0.06172323349 . 1 . . . . . 27 ASN H . 53013 1 104 . 1 . 1 28 28 ASN CA C 13 56.60474625 0.05728285685 . 1 . . . . . 27 ASN CA . 53013 1 105 . 1 . 1 28 28 ASN CB C 13 39.19476322 0.0506777527 . 1 . . . . . 27 ASN CB . 53013 1 106 . 1 . 1 28 28 ASN N N 15 116.8451958 0.1248764903 . 1 . . . . . 27 ASN N . 53013 1 107 . 1 . 1 29 29 VAL H H 1 7.910461848 0.06736198961 . 1 . . . . . 28 VAL H . 53013 1 108 . 1 . 1 29 29 VAL CA C 13 67.51089241 0.06377080082 . 1 . . . . . 28 VAL CA . 53013 1 109 . 1 . 1 29 29 VAL CB C 13 31.09007842 0.03141298235 . 1 . . . . . 28 VAL CB . 53013 1 110 . 1 . 1 29 29 VAL N N 15 120.5774946 0.1772708363 . 1 . . . . . 28 VAL N . 53013 1 111 . 1 . 1 30 30 ASN H H 1 7.862257266 0.05958101765 . 1 . . . . . 29 ASN H . 53013 1 112 . 1 . 1 30 30 ASN CA C 13 55.99713919 0.06122043831 . 1 . . . . . 29 ASN CA . 53013 1 113 . 1 . 1 30 30 ASN CB C 13 38.89054218 0.002603247648 . 1 . . . . . 29 ASN CB . 53013 1 114 . 1 . 1 30 30 ASN N N 15 116.3210093 0.1333500909 . 1 . . . . . 29 ASN N . 53013 1 115 . 1 . 1 31 31 VAL H H 1 6.925717348 0.06304493638 . 1 . . . . . 30 VAL H . 53013 1 116 . 1 . 1 31 31 VAL CA C 13 65.8622987 0.02481437603 . 1 . . . . . 30 VAL CA . 53013 1 117 . 1 . 1 31 31 VAL CB C 13 31.57094405 0.04291621457 . 1 . . . . . 30 VAL CB . 53013 1 118 . 1 . 1 31 31 VAL N N 15 116.5786493 0.09785109134 . 1 . . . . . 30 VAL N . 53013 1 119 . 1 . 1 32 32 PHE H H 1 6.599155651 0.0632177666 . 1 . . . . . 31 PHE H . 53013 1 120 . 1 . 1 32 32 PHE CA C 13 59.69712206 0.04791419038 . 1 . . . . . 31 PHE CA . 53013 1 121 . 1 . 1 32 32 PHE CB C 13 41.59012334 0.01418739173 . 1 . . . . . 31 PHE CB . 53013 1 122 . 1 . 1 32 32 PHE N N 15 115.5992792 0.07826406596 . 1 . . . . . 31 PHE N . 53013 1 123 . 1 . 1 33 33 PHE H H 1 8.409003471 0.05762092183 . 1 . . . . . 32 PHE H . 53013 1 124 . 1 . 1 33 33 PHE CA C 13 55.57512252 0.01111078153 . 1 . . . . . 32 PHE CA . 53013 1 125 . 1 . 1 33 33 PHE CB C 13 38.43091783 0.03308081682 . 1 . . . . . 32 PHE CB . 53013 1 126 . 1 . 1 33 33 PHE N N 15 117.3597933 0.1055219541 . 1 . . . . . 32 PHE N . 53013 1 127 . 1 . 1 34 34 PRO CA C 13 63.80909183 0.07240528879 . 1 . . . . . 33 PRO CA . 53013 1 128 . 1 . 1 34 34 PRO CB C 13 32.3207258 0.03794721933 . 1 . . . . . 33 PRO CB . 53013 1 129 . 1 . 1 35 35 HIS H H 1 8.350145357 0.05812120865 . 1 . . . . . 34 HIS H . 53013 1 130 . 1 . 1 35 35 HIS CA C 13 55.13476015 0.03487194984 . 1 . . . . . 34 HIS CA . 53013 1 131 . 1 . 1 35 35 HIS CB C 13 28.70514368 0.1035687116 . 1 . . . . . 34 HIS CB . 53013 1 132 . 1 . 1 35 35 HIS N N 15 114.2486554 0.1226116583 . 1 . . . . . 34 HIS N . 53013 1 133 . 1 . 1 36 36 PHE H H 1 6.931014961 0.0639479899 . 1 . . . . . 35 PHE H . 53013 1 134 . 1 . 1 36 36 PHE CA C 13 55.53477901 0.04446625509 . 1 . . . . . 35 PHE CA . 53013 1 135 . 1 . 1 36 36 PHE CB C 13 37.42140426 0.01973179356 . 1 . . . . . 35 PHE CB . 53013 1 136 . 1 . 1 36 36 PHE N N 15 119.8836756 0.05738218143 . 1 . . . . . 35 PHE N . 53013 1 137 . 1 . 1 37 37 LYS H H 1 8.342924532 0.05722729245 . 1 . . . . . 36 LYS H . 53013 1 138 . 1 . 1 37 37 LYS CA C 13 54.01447356 0.08750406535 . 1 . . . . . 36 LYS CA . 53013 1 139 . 1 . 1 37 37 LYS CB C 13 34.96337674 0.009004063521 . 1 . . . . . 36 LYS CB . 53013 1 140 . 1 . 1 37 37 LYS N N 15 117.8389204 0.06013062959 . 1 . . . . . 36 LYS N . 53013 1 141 . 1 . 1 38 38 TYR H H 1 9.51226569 0.05594906215 . 1 . . . . . 37 TYR H . 53013 1 142 . 1 . 1 38 38 TYR CA C 13 58.29102625 0.02716145095 . 1 . . . . . 37 TYR CA . 53013 1 143 . 1 . 1 38 38 TYR CB C 13 41.22861346 0.09437206376 . 1 . . . . . 37 TYR CB . 53013 1 144 . 1 . 1 38 38 TYR N N 15 123.5604015 0.1169885167 . 1 . . . . . 37 TYR N . 53013 1 145 . 1 . 1 39 39 SER H H 1 8.960910525 0.05610044102 . 1 . . . . . 38 SER H . 53013 1 146 . 1 . 1 39 39 SER CA C 13 56.84789022 0.04579290923 . 1 . . . . . 38 SER CA . 53013 1 147 . 1 . 1 39 39 SER CB C 13 64.83784904 0.04192342261 . 1 . . . . . 38 SER CB . 53013 1 148 . 1 . 1 39 39 SER N N 15 115.7549177 0.0792524284 . 1 . . . . . 38 SER N . 53013 1 149 . 1 . 1 40 40 MET H H 1 7.808341987 0.05731198935 . 1 . . . . . 39 MET H . 53013 1 150 . 1 . 1 40 40 MET CA C 13 53.53155269 0.05645847422 . 1 . . . . . 39 MET CA . 53013 1 151 . 1 . 1 40 40 MET CB C 13 33.00724585 0.007002973221 . 1 . . . . . 39 MET CB . 53013 1 152 . 1 . 1 40 40 MET N N 15 121.592331 0.1178386969 . 1 . . . . . 39 MET N . 53013 1 153 . 1 . 1 41 41 ASP H H 1 8.553835334 0.06039378279 . 1 . . . . . 40 ASP H . 53013 1 154 . 1 . 1 41 41 ASP CA C 13 53.09395095 0.01645796811 . 1 . . . . . 40 ASP CA . 53013 1 155 . 1 . 1 41 41 ASP CB C 13 46.24940624 0.007930906303 . 1 . . . . . 40 ASP CB . 53013 1 156 . 1 . 1 41 41 ASP N N 15 121.6795477 0.08109861885 . 1 . . . . . 40 ASP N . 53013 1 157 . 1 . 1 42 42 THR H H 1 8.565677873 0.05672420535 . 1 . . . . . 41 THR H . 53013 1 158 . 1 . 1 42 42 THR CA C 13 64.1458772 0.004584038847 . 1 . . . . . 41 THR CA . 53013 1 159 . 1 . 1 42 42 THR CB C 13 69.4013957 0.1001234217 . 1 . . . . . 41 THR CB . 53013 1 160 . 1 . 1 42 42 THR N N 15 117.8304449 0.06516681252 . 1 . . . . . 41 THR N . 53013 1 161 . 1 . 1 43 43 TYR H H 1 9.389100807 0.05644122444 . 1 . . . . . 42 TYR H . 53013 1 162 . 1 . 1 43 43 TYR CA C 13 57.99001273 0.02501075179 . 1 . . . . . 42 TYR CA . 53013 1 163 . 1 . 1 43 43 TYR CB C 13 41.49101705 0.0 . 1 . . . . . 42 TYR CB . 53013 1 164 . 1 . 1 43 43 TYR N N 15 132.0834917 0.2953637853 . 1 . . . . . 42 TYR N . 53013 1 165 . 1 . 1 44 44 VAL H H 1 6.531202798 0.06274879655 . 1 . . . . . 43 VAL H . 53013 1 166 . 1 . 1 44 44 VAL CA C 13 60.9441639 0.02653173875 . 1 . . . . . 43 VAL CA . 53013 1 167 . 1 . 1 44 44 VAL CB C 13 31.91405644 0.07621928755 . 1 . . . . . 43 VAL CB . 53013 1 168 . 1 . 1 44 44 VAL N N 15 125.4342541 0.201100007 . 1 . . . . . 43 VAL N . 53013 1 169 . 1 . 1 45 45 PHE H H 1 8.68811438 0.05574676847 . 1 . . . . . 44 PHE H . 53013 1 170 . 1 . 1 45 45 PHE CA C 13 58.47655502 0.02979763991 . 1 . . . . . 44 PHE CA . 53013 1 171 . 1 . 1 45 45 PHE CB C 13 39.99604284 0.1019853376 . 1 . . . . . 44 PHE CB . 53013 1 172 . 1 . 1 45 45 PHE N N 15 125.7982521 0.1562867456 . 1 . . . . . 44 PHE N . 53013 1 173 . 1 . 1 46 46 LYS H H 1 8.865359089 0.05577358535 . 1 . . . . . 45 LYS H . 53013 1 174 . 1 . 1 46 46 LYS CA C 13 59.01804765 0.02387033202 . 1 . . . . . 45 LYS CA . 53013 1 175 . 1 . 1 46 46 LYS CB C 13 32.23704754 0.02505485371 . 1 . . . . . 45 LYS CB . 53013 1 176 . 1 . 1 46 46 LYS N N 15 121.5943266 0.05819691254 . 1 . . . . . 45 LYS N . 53013 1 177 . 1 . 1 47 47 ASP H H 1 7.774291632 0.05680238771 . 1 . . . . . 46 ASP H . 53013 1 178 . 1 . 1 47 47 ASP CA C 13 53.53656191 0.07748049182 . 1 . . . . . 46 ASP CA . 53013 1 179 . 1 . 1 47 47 ASP CB C 13 39.63848402 0.02053402642 . 1 . . . . . 46 ASP CB . 53013 1 180 . 1 . 1 47 47 ASP N N 15 116.7371516 0.1010580519 . 1 . . . . . 46 ASP N . 53013 1 181 . 1 . 1 48 48 SER H H 1 8.102537187 0.05738808584 . 1 . . . . . 47 SER H . 53013 1 182 . 1 . 1 48 48 SER CA C 13 62.37837336 0.03839836861 . 1 . . . . . 47 SER CA . 53013 1 183 . 1 . 1 48 48 SER N N 15 111.8290008 0.1940794488 . 1 . . . . . 47 SER N . 53013 1 184 . 1 . 1 49 49 SER H H 1 8.278224188 0.05643674144 . 1 . . . . . 48 SER H . 53013 1 185 . 1 . 1 49 49 SER CA C 13 59.27569862 0.02533131994 . 1 . . . . . 48 SER CA . 53013 1 186 . 1 . 1 49 49 SER CB C 13 64.14567261 0.001164724516 . 1 . . . . . 48 SER CB . 53013 1 187 . 1 . 1 49 49 SER N N 15 118.8629592 0.05727069824 . 1 . . . . . 48 SER N . 53013 1 188 . 1 . 1 50 50 GLN H H 1 8.441045488 0.05700657878 . 1 . . . . . 49 GLN H . 53013 1 189 . 1 . 1 50 50 GLN CA C 13 54.35929489 0.01750444946 . 1 . . . . . 49 GLN CA . 53013 1 190 . 1 . 1 50 50 GLN CB C 13 32.89084667 0.08974590862 . 1 . . . . . 49 GLN CB . 53013 1 191 . 1 . 1 50 50 GLN N N 15 116.2948151 0.07619074208 . 1 . . . . . 49 GLN N . 53013 1 192 . 1 . 1 51 51 LYS H H 1 8.65291964 0.05686150846 . 1 . . . . . 50 LYS H . 53013 1 193 . 1 . 1 51 51 LYS CA C 13 55.73752278 0.07130408698 . 1 . . . . . 50 LYS CA . 53013 1 194 . 1 . 1 51 51 LYS CB C 13 38.91735936 0.02666970479 . 1 . . . . . 50 LYS CB . 53013 1 195 . 1 . 1 51 51 LYS N N 15 120.3479806 0.05495123592 . 1 . . . . . 50 LYS N . 53013 1 196 . 1 . 1 52 52 ASP H H 1 8.525797391 0.05717437275 . 1 . . . . . 51 ASP H . 53013 1 197 . 1 . 1 52 52 ASP CA C 13 54.2752237 0.05615054152 . 1 . . . . . 51 ASP CA . 53013 1 198 . 1 . 1 52 52 ASP CB C 13 40.33859037 0.01982258917 . 1 . . . . . 51 ASP CB . 53013 1 199 . 1 . 1 52 52 ASP N N 15 123.9269322 0.1114107584 . 1 . . . . . 51 ASP N . 53013 1 200 . 1 . 1 53 53 LEU H H 1 8.989497413 0.05644970171 . 1 . . . . . 52 LEU H . 53013 1 201 . 1 . 1 53 53 LEU CA C 13 53.2324662 0.09379084074 . 1 . . . . . 52 LEU CA . 53013 1 202 . 1 . 1 53 53 LEU CB C 13 46.239516 0.0213843477 . 1 . . . . . 52 LEU CB . 53013 1 203 . 1 . 1 53 53 LEU N N 15 123.5976548 0.0995075065 . 1 . . . . . 52 LEU N . 53013 1 204 . 1 . 1 54 54 LEU H H 1 8.782074147 0.05652645541 . 1 . . . . . 53 LEU H . 53013 1 205 . 1 . 1 54 54 LEU CA C 13 54.58988667 0.004186291833 . 1 . . . . . 53 LEU CA . 53013 1 206 . 1 . 1 54 54 LEU CB C 13 42.28969145 0.03155851012 . 1 . . . . . 53 LEU CB . 53013 1 207 . 1 . 1 54 54 LEU N N 15 125.1443593 0.1303295129 . 1 . . . . . 53 LEU N . 53013 1 208 . 1 . 1 55 55 ASN H H 1 9.43711796 0.05654713721 . 1 . . . . . 54 ASN H . 53013 1 209 . 1 . 1 55 55 ASN CA C 13 51.39669524 0.006736669912 . 1 . . . . . 54 ASN CA . 53013 1 210 . 1 . 1 55 55 ASN CB C 13 43.45449963 0.08605565379 . 1 . . . . . 54 ASN CB . 53013 1 211 . 1 . 1 55 55 ASN N N 15 121.9101563 0.07669621752 . 1 . . . . . 54 ASN N . 53013 1 212 . 1 . 1 56 56 PHE H H 1 8.31903625 0.06145653495 . 1 . . . . . 55 PHE H . 53013 1 213 . 1 . 1 56 56 PHE CA C 13 53.82249348 0.02909049094 . 1 . . . . . 55 PHE CA . 53013 1 214 . 1 . 1 56 56 PHE CB C 13 41.76618597 0.05547419744 . 1 . . . . . 55 PHE CB . 53013 1 215 . 1 . 1 56 56 PHE N N 15 114.2539881 0.1280512014 . 1 . . . . . 55 PHE N . 53013 1 216 . 1 . 1 57 57 THR H H 1 8.347476895 0.05822742839 . 1 . . . . . 56 THR H . 53013 1 217 . 1 . 1 57 57 THR CA C 13 58.75670286 0.01789437623 . 1 . . . . . 56 THR CA . 53013 1 218 . 1 . 1 57 57 THR CB C 13 72.0093057 0.02323731681 . 1 . . . . . 56 THR CB . 53013 1 219 . 1 . 1 57 57 THR N N 15 110.6362846 0.1642217578 . 1 . . . . . 56 THR N . 53013 1 220 . 1 . 1 58 58 GLY H H 1 7.760133638 0.05878836312 . 1 . . . . . 57 GLY H . 53013 1 221 . 1 . 1 58 58 GLY CA C 13 45.04728143 0.02313379043 . 1 . . . . . 57 GLY CA . 53013 1 222 . 1 . 1 58 58 GLY N N 15 109.1654465 0.2394130927 . 1 . . . . . 57 GLY N . 53013 1 223 . 1 . 1 59 59 THR H H 1 8.165941459 0.05664245932 . 1 . . . . . 58 THR H . 53013 1 224 . 1 . 1 59 59 THR CA C 13 59.71150652 0.05186648078 . 1 . . . . . 58 THR CA . 53013 1 225 . 1 . 1 59 59 THR CB C 13 71.41570968 0.07573685798 . 1 . . . . . 58 THR CB . 53013 1 226 . 1 . 1 59 59 THR N N 15 110.6560095 0.1937928083 . 1 . . . . . 58 THR N . 53013 1 227 . 1 . 1 60 60 ILE H H 1 8.462190708 0.05871018112 . 1 . . . . . 59 ILE H . 53013 1 228 . 1 . 1 60 60 ILE CA C 13 56.52683855 0.01809746437 . 1 . . . . . 59 ILE CA . 53013 1 229 . 1 . 1 60 60 ILE CB C 13 39.63370897 0.009716621107 . 1 . . . . . 59 ILE CB . 53013 1 230 . 1 . 1 60 60 ILE N N 15 115.0328737 0.08917170738 . 1 . . . . . 59 ILE N . 53013 1 231 . 1 . 1 61 61 PRO CA C 13 61.85788906 0.02180515348 . 1 . . . . . 60 PRO CA . 53013 1 232 . 1 . 1 61 61 PRO CB C 13 31.05290006 0.007783715548 . 1 . . . . . 60 PRO CB . 53013 1 233 . 1 . 1 62 62 VAL H H 1 9.054452086 0.05614501389 . 1 . . . . . 61 VAL H . 53013 1 234 . 1 . 1 62 62 VAL CA C 13 61.4506984 0.1801940657 . 1 . . . . . 61 VAL CA . 53013 1 235 . 1 . 1 62 62 VAL CB C 13 35.94123462 0.005217758831 . 1 . . . . . 61 VAL CB . 53013 1 236 . 1 . 1 62 62 VAL N N 15 124.1182454 0.09935884629 . 1 . . . . . 61 VAL N . 53013 1 237 . 1 . 1 63 63 MET H H 1 9.097694644 0.05094601424 . 1 . . . . . 62 MET H . 53013 1 238 . 1 . 1 63 63 MET CA C 13 54.71593324 0.09388683299 . 1 . . . . . 62 MET CA . 53013 1 239 . 1 . 1 63 63 MET CB C 13 32.43407574 0.07418329256 . 1 . . . . . 62 MET CB . 53013 1 240 . 1 . 1 63 63 MET N N 15 128.8813754 0.2057169395 . 1 . . . . . 62 MET N . 53013 1 241 . 1 . 1 64 64 TYR H H 1 9.247954239 0.05685864809 . 1 . . . . . 63 TYR H . 53013 1 242 . 1 . 1 64 64 TYR CA C 13 58.03334963 0.01601284326 . 1 . . . . . 63 TYR CA . 53013 1 243 . 1 . 1 64 64 TYR CB C 13 41.85598658 0.0203972981 . 1 . . . . . 63 TYR CB . 53013 1 244 . 1 . 1 64 64 TYR N N 15 126.8435966 0.1718574351 . 1 . . . . . 63 TYR N . 53013 1 245 . 1 . 1 65 65 GLN H H 1 9.263382747 0.05542155765 . 1 . . . . . 64 GLN H . 53013 1 246 . 1 . 1 65 65 GLN CA C 13 56.55524108 0.0100076254 . 1 . . . . . 64 GLN CA . 53013 1 247 . 1 . 1 65 65 GLN CB C 13 26.19287389 0.04360211319 . 1 . . . . . 64 GLN CB . 53013 1 248 . 1 . 1 65 65 GLN N N 15 127.5445284 0.1880228239 . 1 . . . . . 64 GLN N . 53013 1 249 . 1 . 1 66 66 GLY H H 1 8.328149973 0.05914610201 . 1 . . . . . 65 GLY H . 53013 1 250 . 1 . 1 66 66 GLY CA C 13 45.63729447 0.0192692207 . 1 . . . . . 65 GLY CA . 53013 1 251 . 1 . 1 66 66 GLY N N 15 102.9076827 0.4147272536 . 1 . . . . . 65 GLY N . 53013 1 252 . 1 . 1 67 67 ASN H H 1 7.768031753 0.05798850071 . 1 . . . . . 66 ASN H . 53013 1 253 . 1 . 1 67 67 ASN CA C 13 51.88421274 0.02718282055 . 1 . . . . . 66 ASN CA . 53013 1 254 . 1 . 1 67 67 ASN CB C 13 42.12735537 0.04234580465 . 1 . . . . . 66 ASN CB . 53013 1 255 . 1 . 1 67 67 ASN N N 15 118.7664408 0.07206843984 . 1 . . . . . 66 ASN N . 53013 1 256 . 1 . 1 68 68 THR H H 1 8.381556847 0.05769694509 . 1 . . . . . 67 THR H . 53013 1 257 . 1 . 1 68 68 THR CA C 13 63.12628702 0.04706863586 . 1 . . . . . 67 THR CA . 53013 1 258 . 1 . 1 68 68 THR CB C 13 69.49783178 0.05860516055 . 1 . . . . . 67 THR CB . 53013 1 259 . 1 . 1 68 68 THR N N 15 117.6502831 0.06289990336 . 1 . . . . . 67 THR N . 53013 1 260 . 1 . 1 69 69 TYR H H 1 9.483055287 0.0560562739 . 1 . . . . . 68 TYR H . 53013 1 261 . 1 . 1 69 69 TYR CA C 13 56.82715165 0.03198824713 . 1 . . . . . 68 TYR CA . 53013 1 262 . 1 . 1 69 69 TYR CB C 13 40.35555196 0.00233035832 . 1 . . . . . 68 TYR CB . 53013 1 263 . 1 . 1 69 69 TYR N N 15 127.860627 0.1935256205 . 1 . . . . . 68 TYR N . 53013 1 264 . 1 . 1 70 70 ASN H H 1 8.85549 0.05591909717 . 1 . . . . . 69 ASN H . 53013 1 265 . 1 . 1 70 70 ASN CA C 13 52.33802233 0.03101505856 . 1 . . . . . 69 ASN CA . 53013 1 266 . 1 . 1 70 70 ASN CB C 13 38.70353991 0.03897533387 . 1 . . . . . 69 ASN CB . 53013 1 267 . 1 . 1 70 70 ASN N N 15 123.4340114 0.0928496018 . 1 . . . . . 69 ASN N . 53013 1 268 . 1 . 1 71 71 ILE H H 1 8.878176059 0.05568679328 . 1 . . . . . 70 ILE H . 53013 1 269 . 1 . 1 71 71 ILE CA C 13 59.96489687 0.01327408483 . 1 . . . . . 70 ILE CA . 53013 1 270 . 1 . 1 71 71 ILE CB C 13 38.91995141 0.03165225879 . 1 . . . . . 70 ILE CB . 53013 1 271 . 1 . 1 71 71 ILE N N 15 126.4903752 0.1709064692 . 1 . . . . . 70 ILE N . 53013 1 272 . 1 . 1 72 72 PRO CA C 13 62.18422816 0.001022400916 . 1 . . . . . 71 PRO CA . 53013 1 273 . 1 . 1 72 72 PRO CB C 13 31.77088852 0.001020469453 . 1 . . . . . 71 PRO CB . 53013 1 274 . 1 . 1 73 73 ILE H H 1 8.47420709 0.05240192268 . 1 . . . . . 72 ILE H . 53013 1 275 . 1 . 1 73 73 ILE CA C 13 58.01280755 0.03051701132 . 1 . . . . . 72 ILE CA . 53013 1 276 . 1 . 1 73 73 ILE CB C 13 42.83979416 0.02317014026 . 1 . . . . . 72 ILE CB . 53013 1 277 . 1 . 1 73 73 ILE N N 15 117.8193103 0.06486396419 . 1 . . . . . 72 ILE N . 53013 1 278 . 1 . 1 74 74 ARG H H 1 8.851179885 0.05588180441 . 1 . . . . . 73 ARG H . 53013 1 279 . 1 . 1 74 74 ARG CA C 13 55.76090775 0.04893781466 . 1 . . . . . 73 ARG CA . 53013 1 280 . 1 . 1 74 74 ARG CB C 13 34.0839744 0.1105564532 . 1 . . . . . 73 ARG CB . 53013 1 281 . 1 . 1 74 74 ARG N N 15 123.2160849 0.1124172589 . 1 . . . . . 73 ARG N . 53013 1 282 . 1 . 1 75 75 PHE H H 1 8.397931523 0.05650261886 . 1 . . . . . 74 PHE H . 53013 1 283 . 1 . 1 75 75 PHE CA C 13 54.07250302 0.03824159514 . 1 . . . . . 74 PHE CA . 53013 1 284 . 1 . 1 75 75 PHE CB C 13 40.18375957 0.08946620341 . 1 . . . . . 74 PHE CB . 53013 1 285 . 1 . 1 75 75 PHE N N 15 126.3331645 0.1659004615 . 1 . . . . . 74 PHE N . 53013 1 286 . 1 . 1 76 76 TRP H H 1 9.506249448 0.05572264181 . 1 . . . . . 75 TRP H . 53013 1 287 . 1 . 1 76 76 TRP CA C 13 56.11293838 0.0533102414 . 1 . . . . . 75 TRP CA . 53013 1 288 . 1 . 1 76 76 TRP CB C 13 29.18701466 0.08529012263 . 1 . . . . . 75 TRP CB . 53013 1 289 . 1 . 1 76 76 TRP N N 15 122.4372967 0.08400288719 . 1 . . . . . 75 TRP N . 53013 1 290 . 1 . 1 77 77 ILE H H 1 8.86550493 0.0591581684 . 1 . . . . . 76 ILE H . 53013 1 291 . 1 . 1 77 77 ILE CA C 13 57.80808793 0.04572709205 . 1 . . . . . 76 ILE CA . 53013 1 292 . 1 . 1 77 77 ILE CB C 13 36.4703854 0.0180090368 . 1 . . . . . 76 ILE CB . 53013 1 293 . 1 . 1 77 77 ILE N N 15 122.8113411 0.109714305 . 1 . . . . . 76 ILE N . 53013 1 294 . 1 . 1 78 78 LEU H H 1 9.537753694 0.05262053377 . 1 . . . . . 77 LEU H . 53013 1 295 . 1 . 1 78 78 LEU CA C 13 55.93246516 0.1291787681 . 1 . . . . . 77 LEU CA . 53013 1 296 . 1 . 1 78 78 LEU CB C 13 41.67646954 0.1034121439 . 1 . . . . . 77 LEU CB . 53013 1 297 . 1 . 1 78 78 LEU N N 15 131.4626663 0.2750174393 . 1 . . . . . 77 LEU N . 53013 1 298 . 1 . 1 79 79 ASP H H 1 7.92045573 0.0585411763 . 1 . . . . . 78 ASP H . 53013 1 299 . 1 . 1 79 79 ASP CA C 13 55.4088928 0.1159595799 . 1 . . . . . 78 ASP CA . 53013 1 300 . 1 . 1 79 79 ASP CB C 13 38.82606504 0.04446041061 . 1 . . . . . 78 ASP CB . 53013 1 301 . 1 . 1 79 79 ASP N N 15 115.8930246 0.1061766669 . 1 . . . . . 78 ASP N . 53013 1 302 . 1 . 1 80 80 SER H H 1 7.126331607 0.05985087288 . 1 . . . . . 79 SER H . 53013 1 303 . 1 . 1 80 80 SER CA C 13 56.71346397 0.1056313976 . 1 . . . . . 79 SER CA . 53013 1 304 . 1 . 1 80 80 SER CB C 13 63.13160542 0.02071184576 . 1 . . . . . 79 SER CB . 53013 1 305 . 1 . 1 80 80 SER N N 15 112.1774343 0.207588685 . 1 . . . . . 79 SER N . 53013 1 306 . 1 . 1 81 81 HIS H H 1 8.168868227 0.05806449076 . 1 . . . . . 80 HIS H . 53013 1 307 . 1 . 1 81 81 HIS CA C 13 58.25993385 0.001619629896 . 1 . . . . . 80 HIS CA . 53013 1 308 . 1 . 1 81 81 HIS CB C 13 32.23951434 0.027545989 . 1 . . . . . 80 HIS CB . 53013 1 309 . 1 . 1 81 81 HIS N N 15 125.7976522 0.1634174739 . 1 . . . . . 80 HIS N . 53013 1 310 . 1 . 1 82 82 PRO CA C 13 62.66058967 0.01069359421 . 1 . . . . . 81 PRO CA . 53013 1 311 . 1 . 1 82 82 PRO CB C 13 33.46513129 0.01985864742 . 1 . . . . . 81 PRO CB . 53013 1 312 . 1 . 1 83 83 PHE H H 1 8.955003106 0.05634273404 . 1 . . . . . 82 PHE H . 53013 1 313 . 1 . 1 83 83 PHE CA C 13 60.22923415 0.00854895879 . 1 . . . . . 82 PHE CA . 53013 1 314 . 1 . 1 83 83 PHE CB C 13 37.94561498 0.03131247682 . 1 . . . . . 82 PHE CB . 53013 1 315 . 1 . 1 83 83 PHE N N 15 124.806956 0.1295235759 . 1 . . . . . 82 PHE N . 53013 1 316 . 1 . 1 84 84 ALA H H 1 6.837011337 0.06101069877 . 1 . . . . . 83 ALA H . 53013 1 317 . 1 . 1 84 84 ALA CA C 13 49.19934613 0.01134215074 . 1 . . . . . 83 ALA CA . 53013 1 318 . 1 . 1 84 84 ALA CB C 13 21.23004227 0.001620016438 . 1 . . . . . 83 ALA CB . 53013 1 319 . 1 . 1 84 84 ALA N N 15 122.3784013 0.1095129381 . 1 . . . . . 83 ALA N . 53013 1 320 . 1 . 1 86 86 PRO CA C 13 61.93662285 0.009210884233 . 1 . . . . . 85 PRO CA . 53013 1 321 . 1 . 1 86 86 PRO CB C 13 32.4885264 0.01680438608 . 1 . . . . . 85 PRO CB . 53013 1 322 . 1 . 1 87 87 ILE H H 1 8.291565223 0.05334889623 . 1 . . . . . 86 ILE H . 53013 1 323 . 1 . 1 87 87 ILE CA C 13 61.80518706 0.131782072 . 1 . . . . . 86 ILE CA . 53013 1 324 . 1 . 1 87 87 ILE CB C 13 39.50056065 0.08957678837 . 1 . . . . . 86 ILE CB . 53013 1 325 . 1 . 1 87 87 ILE N N 15 119.8273522 0.03811729154 . 1 . . . . . 86 ILE N . 53013 1 326 . 1 . 1 88 88 CYS H H 1 8.369750244 0.05893014534 . 1 . . . . . 87 CYS H . 53013 1 327 . 1 . 1 88 88 CYS CA C 13 57.24656447 0.1141049585 . 1 . . . . . 87 CYS CA . 53013 1 328 . 1 . 1 88 88 CYS CB C 13 31.81621474 0.03240128852 . 1 . . . . . 87 CYS CB . 53013 1 329 . 1 . 1 88 88 CYS N N 15 124.6453983 0.1339195491 . 1 . . . . . 87 CYS N . 53013 1 330 . 1 . 1 89 89 PHE H H 1 8.937913894 0.05689846931 . 1 . . . . . 88 PHE H . 53013 1 331 . 1 . 1 89 89 PHE CA C 13 56.581018 0.03665099062 . 1 . . . . . 88 PHE CA . 53013 1 332 . 1 . 1 89 89 PHE CB C 13 44.29463151 0.009968200958 . 1 . . . . . 88 PHE CB . 53013 1 333 . 1 . 1 89 89 PHE N N 15 120.6233365 0.2673962547 . 1 . . . . . 88 PHE N . 53013 1 334 . 1 . 1 90 90 LEU H H 1 9.412189768 0.05621284006 . 1 . . . . . 89 LEU H . 53013 1 335 . 1 . 1 90 90 LEU CA C 13 53.87054711 0.01972652266 . 1 . . . . . 89 LEU CA . 53013 1 336 . 1 . 1 90 90 LEU CB C 13 44.96266003 0.09591839934 . 1 . . . . . 89 LEU CB . 53013 1 337 . 1 . 1 90 90 LEU N N 15 119.9799349 0.09600550943 . 1 . . . . . 89 LEU N . 53013 1 338 . 1 . 1 91 91 LYS H H 1 7.897973232 0.05851402026 . 1 . . . . . 90 LYS H . 53013 1 339 . 1 . 1 91 91 LYS CA C 13 52.62509825 0.003859324423 . 1 . . . . . 90 LYS CA . 53013 1 340 . 1 . 1 91 91 LYS CB C 13 34.00554455 0.02186674783 . 1 . . . . . 90 LYS CB . 53013 1 341 . 1 . 1 91 91 LYS N N 15 122.0925535 0.0910727974 . 1 . . . . . 90 LYS N . 53013 1 342 . 1 . 1 92 92 PRO CA C 13 62.25201423 0.04726351531 . 1 . . . . . 91 PRO CA . 53013 1 343 . 1 . 1 92 92 PRO CB C 13 32.16587406 0.0715494978 . 1 . . . . . 91 PRO CB . 53013 1 344 . 1 . 1 93 93 THR H H 1 7.169804291 0.06146460511 . 1 . . . . . 92 THR H . 53013 1 345 . 1 . 1 93 93 THR CA C 13 60.71129191 0.004304563665 . 1 . . . . . 92 THR CA . 53013 1 346 . 1 . 1 93 93 THR CB C 13 69.78484241 0.02077223113 . 1 . . . . . 92 THR CB . 53013 1 347 . 1 . 1 93 93 THR N N 15 110.3260214 0.1889190827 . 1 . . . . . 92 THR N . 53013 1 348 . 1 . 1 94 94 ALA H H 1 8.161066217 0.05768966752 . 1 . . . . . 93 ALA H . 53013 1 349 . 1 . 1 94 94 ALA CA C 13 54.13121374 0.03200743807 . 1 . . . . . 93 ALA CA . 53013 1 350 . 1 . 1 94 94 ALA CB C 13 18.48432000 0.0 . 1 . . . . . 93 ALA CB . 53013 1 351 . 1 . 1 94 94 ALA N N 15 120.2559371 0.08381392527 . 1 . . . . . 93 ALA N . 53013 1 352 . 1 . 1 95 95 ASN H H 1 8.548864363 0.05709348552 . 1 . . . . . 94 ASN H . 53013 1 353 . 1 . 1 95 95 ASN CA C 13 54.08214244 0.007158341136 . 1 . . . . . 94 ASN CA . 53013 1 354 . 1 . 1 95 95 ASN CB C 13 38.65390863 0.009360406475 . 1 . . . . . 94 ASN CB . 53013 1 355 . 1 . 1 95 95 ASN N N 15 113.5150045 0.1597554419 . 1 . . . . . 94 ASN N . 53013 1 356 . 1 . 1 96 96 MET H H 1 7.706442555 0.05972314815 . 1 . . . . . 95 MET H . 53013 1 357 . 1 . 1 96 96 MET CA C 13 54.09179165 0.006127991551 . 1 . . . . . 95 MET CA . 53013 1 358 . 1 . 1 96 96 MET CB C 13 36.27856581 0.09869010394 . 1 . . . . . 95 MET CB . 53013 1 359 . 1 . 1 96 96 MET N N 15 117.7430994 0.06703907265 . 1 . . . . . 95 MET N . 53013 1 360 . 1 . 1 97 97 GLY H H 1 8.262655033 0.05742971598 . 1 . . . . . 96 GLY H . 53013 1 361 . 1 . 1 97 97 GLY CA C 13 42.8025008 0.004801986157 . 1 . . . . . 96 GLY CA . 53013 1 362 . 1 . 1 97 97 GLY N N 15 106.7859774 0.2910404721 . 1 . . . . . 96 GLY N . 53013 1 363 . 1 . 1 98 98 ILE H H 1 8.392578184 0.05748219986 . 1 . . . . . 97 ILE H . 53013 1 364 . 1 . 1 98 98 ILE CA C 13 62.44577033 0.01264716015 . 1 . . . . . 97 ILE CA . 53013 1 365 . 1 . 1 98 98 ILE CB C 13 39.1326966 0.006127985187 . 1 . . . . . 97 ILE CB . 53013 1 366 . 1 . 1 98 98 ILE N N 15 119.089643 0.08180938223 . 1 . . . . . 97 ILE N . 53013 1 367 . 1 . 1 99 99 LEU H H 1 7.880427274 0.05819473432 . 1 . . . . . 98 LEU H . 53013 1 368 . 1 . 1 99 99 LEU CA C 13 52.62540901 0.01264708554 . 1 . . . . . 98 LEU CA . 53013 1 369 . 1 . 1 99 99 LEU CB C 13 42.57260301 0.005656198715 . 1 . . . . . 98 LEU CB . 53013 1 370 . 1 . 1 99 99 LEU N N 15 131.5611234 0.2652330524 . 1 . . . . . 98 LEU N . 53013 1 371 . 1 . 1 100 100 VAL H H 1 7.812785884 0.05914011508 . 1 . . . . . 99 VAL H . 53013 1 372 . 1 . 1 100 100 VAL CA C 13 63.67436885 0.01425566932 . 1 . . . . . 99 VAL CA . 53013 1 373 . 1 . 1 100 100 VAL CB C 13 31.53497979 0.01154819859 . 1 . . . . . 99 VAL CB . 53013 1 374 . 1 . 1 100 100 VAL N N 15 125.300212 0.1278130664 . 1 . . . . . 99 VAL N . 53013 1 375 . 1 . 1 101 101 GLY H H 1 8.594171971 0.05651108198 . 1 . . . . . 100 GLY H . 53013 1 376 . 1 . 1 101 101 GLY CA C 13 45.74170457 0.01181283343 . 1 . . . . . 100 GLY CA . 53013 1 377 . 1 . 1 101 101 GLY N N 15 114.4305158 0.1346328472 . 1 . . . . . 100 GLY N . 53013 1 378 . 1 . 1 102 102 LYS H H 1 8.620866696 0.05718244967 . 1 . . . . . 101 LYS H . 53013 1 379 . 1 . 1 102 102 LYS CA C 13 58.66300606 0.0844135819 . 1 . . . . . 101 LYS CA . 53013 1 380 . 1 . 1 102 102 LYS CB C 13 32.25427955 0.009380488702 . 1 . . . . . 101 LYS CB . 53013 1 381 . 1 . 1 102 102 LYS N N 15 121.5351626 0.08800943278 . 1 . . . . . 101 LYS N . 53013 1 382 . 1 . 1 103 103 HIS H H 1 8.774296966 0.05651195975 . 1 . . . . . 102 HIS H . 53013 1 383 . 1 . 1 103 103 HIS CA C 13 55.73365206 0.08393903875 . 1 . . . . . 102 HIS CA . 53013 1 384 . 1 . 1 103 103 HIS CB C 13 30.31807422 0.01682984866 . 1 . . . . . 102 HIS CB . 53013 1 385 . 1 . 1 103 103 HIS N N 15 112.7833588 0.186151703 . 1 . . . . . 102 HIS N . 53013 1 386 . 1 . 1 104 104 VAL H H 1 7.154126119 0.06211085 . 1 . . . . . 103 VAL H . 53013 1 387 . 1 . 1 104 104 VAL CA C 13 60.68556654 0.02318116454 . 1 . . . . . 103 VAL CA . 53013 1 388 . 1 . 1 104 104 VAL CB C 13 35.73741826 0.03515686029 . 1 . . . . . 103 VAL CB . 53013 1 389 . 1 . 1 104 104 VAL N N 15 117.6635095 0.06775056601 . 1 . . . . . 103 VAL N . 53013 1 390 . 1 . 1 105 105 ASP H H 1 8.237029032 0.0586447283 . 1 . . . . . 104 ASP H . 53013 1 391 . 1 . 1 105 105 ASP CA C 13 52.13334928 0.002818042412 . 1 . . . . . 104 ASP CA . 53013 1 392 . 1 . 1 105 105 ASP CB C 13 43.27963606 0.03587019269 . 1 . . . . . 104 ASP CB . 53013 1 393 . 1 . 1 105 105 ASP N N 15 124.4814713 0.134815722 . 1 . . . . . 104 ASP N . 53013 1 394 . 1 . 1 106 106 ALA H H 1 8.372141629 0.05821227022 . 1 . . . . . 105 ALA H . 53013 1 395 . 1 . 1 106 106 ALA CA C 13 54.71327779 0.1112483773 . 1 . . . . . 105 ALA CA . 53013 1 396 . 1 . 1 106 106 ALA CB C 13 18.41691700 0.0 . 1 . . . . . 105 ALA CB . 53013 1 397 . 1 . 1 106 106 ALA N N 15 116.9559499 0.05629103303 . 1 . . . . . 105 ALA N . 53013 1 398 . 1 . 1 107 107 GLN H H 1 8.016033651 0.05854357015 . 1 . . . . . 106 GLN H . 53013 1 399 . 1 . 1 107 107 GLN CA C 13 56.09100465 0.03006299149 . 1 . . . . . 106 GLN CA . 53013 1 400 . 1 . 1 107 107 GLN CB C 13 29.15561029 0.04087582019 . 1 . . . . . 106 GLN CB . 53013 1 401 . 1 . 1 107 107 GLN N N 15 115.048814 0.1222925273 . 1 . . . . . 106 GLN N . 53013 1 402 . 1 . 1 108 108 GLY H H 1 8.640678931 0.0527995444 . 1 . . . . . 107 GLY H . 53013 1 403 . 1 . 1 108 108 GLY CA C 13 45.50387841 0.005955841179 . 1 . . . . . 107 GLY CA . 53013 1 404 . 1 . 1 108 108 GLY N N 15 109.2717578 0.2556186825 . 1 . . . . . 107 GLY N . 53013 1 405 . 1 . 1 109 109 ARG H H 1 8.412041842 0.05601094906 . 1 . . . . . 108 ARG H . 53013 1 406 . 1 . 1 109 109 ARG CA C 13 56.54853899 0.003490542843 . 1 . . . . . 108 ARG CA . 53013 1 407 . 1 . 1 109 109 ARG CB C 13 29.32377256 0.007526613999 . 1 . . . . . 108 ARG CB . 53013 1 408 . 1 . 1 109 109 ARG N N 15 123.9252454 0.1233786756 . 1 . . . . . 108 ARG N . 53013 1 409 . 1 . 1 110 110 ILE H H 1 7.557184222 0.0611970429 . 1 . . . . . 109 ILE H . 53013 1 410 . 1 . 1 110 110 ILE CA C 13 60.1258732 0.08513850081 . 1 . . . . . 109 ILE CA . 53013 1 411 . 1 . 1 110 110 ILE CB C 13 40.30844567 0.05110532888 . 1 . . . . . 109 ILE CB . 53013 1 412 . 1 . 1 110 110 ILE N N 15 125.0670897 0.150689558 . 1 . . . . . 109 ILE N . 53013 1 413 . 1 . 1 111 111 TYR H H 1 8.783972549 0.05670664962 . 1 . . . . . 110 TYR H . 53013 1 414 . 1 . 1 111 111 TYR CA C 13 57.0403642 0.01234928561 . 1 . . . . . 110 TYR CA . 53013 1 415 . 1 . 1 111 111 TYR CB C 13 40.08453156 0.03882254855 . 1 . . . . . 110 TYR CB . 53013 1 416 . 1 . 1 111 111 TYR N N 15 127.23472 0.1847618588 . 1 . . . . . 110 TYR N . 53013 1 417 . 1 . 1 112 112 LEU H H 1 7.281124927 0.06082597524 . 1 . . . . . 111 LEU H . 53013 1 418 . 1 . 1 112 112 LEU CA C 13 52.13978063 0.009003836853 . 1 . . . . . 111 LEU CA . 53013 1 419 . 1 . 1 112 112 LEU CB C 13 46.48403204 0.006430204294 . 1 . . . . . 111 LEU CB . 53013 1 420 . 1 . 1 112 112 LEU N N 15 120.1776356 0.0482263793 . 1 . . . . . 111 LEU N . 53013 1 421 . 1 . 1 113 113 PRO CA C 13 65.87229224 0.0060639088 . 1 . . . . . 112 PRO CA . 53013 1 422 . 1 . 1 113 113 PRO CB C 13 31.25355181 0.02304053994 . 1 . . . . . 112 PRO CB . 53013 1 423 . 1 . 1 114 114 TYR H H 1 9.395092416 0.05637537263 . 1 . . . . . 113 TYR H . 53013 1 424 . 1 . 1 114 114 TYR CA C 13 61.54607437 0.0879696228 . 1 . . . . . 113 TYR CA . 53013 1 425 . 1 . 1 114 114 TYR CB C 13 38.87998165 0.02310423082 . 1 . . . . . 113 TYR CB . 53013 1 426 . 1 . 1 114 114 TYR N N 15 117.6407267 0.04216938238 . 1 . . . . . 113 TYR N . 53013 1 427 . 1 . 1 115 115 LEU H H 1 7.107482353 0.06124624062 . 1 . . . . . 114 LEU H . 53013 1 428 . 1 . 1 115 115 LEU CA C 13 56.80954774 0.04902560802 . 1 . . . . . 114 LEU CA . 53013 1 429 . 1 . 1 115 115 LEU CB C 13 42.83961245 0.03580966164 . 1 . . . . . 114 LEU CB . 53013 1 430 . 1 . 1 115 115 LEU N N 15 111.711949 0.1898539998 . 1 . . . . . 114 LEU N . 53013 1 431 . 1 . 1 116 116 GLN H H 1 7.904664612 0.05907864292 . 1 . . . . . 115 GLN H . 53013 1 432 . 1 . 1 116 116 GLN CA C 13 58.48107424 0.02344160553 . 1 . . . . . 115 GLN CA . 53013 1 433 . 1 . 1 116 116 GLN CB C 13 29.09196331 0.01728752483 . 1 . . . . . 115 GLN CB . 53013 1 434 . 1 . 1 116 116 GLN N N 15 120.5445129 0.04786885958 . 1 . . . . . 115 GLN N . 53013 1 435 . 1 . 1 117 117 ASN H H 1 8.074239624 0.05874676733 . 1 . . . . . 116 ASN H . 53013 1 436 . 1 . 1 117 117 ASN CA C 13 51.99863917 0.08533881028 . 1 . . . . . 116 ASN CA . 53013 1 437 . 1 . 1 117 117 ASN CB C 13 38.53597249 0.08424525023 . 1 . . . . . 116 ASN CB . 53013 1 438 . 1 . 1 117 117 ASN N N 15 114.4101748 0.09992154171 . 1 . . . . . 116 ASN N . 53013 1 439 . 1 . 1 118 118 TRP H H 1 6.967819415 0.06134512259 . 1 . . . . . 117 TRP H . 53013 1 440 . 1 . 1 118 118 TRP CA C 13 58.88380105 0.08752352787 . 1 . . . . . 117 TRP CA . 53013 1 441 . 1 . 1 118 118 TRP CB C 13 29.58092132 0.01794371076 . 1 . . . . . 117 TRP CB . 53013 1 442 . 1 . 1 118 118 TRP N N 15 122.4130244 0.07876741471 . 1 . . . . . 117 TRP N . 53013 1 443 . 1 . 1 119 119 SER H H 1 8.406344727 0.05800047292 . 1 . . . . . 118 SER H . 53013 1 444 . 1 . 1 119 119 SER CA C 13 57.23921924 0.03444427048 . 1 . . . . . 118 SER CA . 53013 1 445 . 1 . 1 119 119 SER CB C 13 64.15980482 0.01149688757 . 1 . . . . . 118 SER CB . 53013 1 446 . 1 . 1 119 119 SER N N 15 122.65185 0.1179207675 . 1 . . . . . 118 SER N . 53013 1 447 . 1 . 1 120 120 HIS H H 1 9.084312688 0.05612595744 . 1 . . . . . 119 HIS H . 53013 1 448 . 1 . 1 120 120 HIS CA C 13 61.49006518 0.04050781599 . 1 . . . . . 119 HIS CA . 53013 1 449 . 1 . 1 120 120 HIS CB C 13 29.58002107 0.01050248283 . 1 . . . . . 119 HIS CB . 53013 1 450 . 1 . 1 120 120 HIS N N 15 128.930045 0.2253946568 . 1 . . . . . 119 HIS N . 53013 1 451 . 1 . 1 121 121 PRO CA C 13 62.92794525 0.01435462428 . 1 . . . . . 120 PRO CA . 53013 1 452 . 1 . 1 121 121 PRO CB C 13 34.24591046 0.0329005434 . 1 . . . . . 120 PRO CB . 53013 1 453 . 1 . 1 122 122 LYS H H 1 7.704109821 0.05950267343 . 1 . . . . . 121 LYS H . 53013 1 454 . 1 . 1 122 122 LYS CA C 13 59.58880111 0.1165137001 . 1 . . . . . 121 LYS CA . 53013 1 455 . 1 . 1 122 122 LYS CB C 13 32.24788112 0.01349393169 . 1 . . . . . 121 LYS CB . 53013 1 456 . 1 . 1 122 122 LYS N N 15 124.6312632 0.123766068 . 1 . . . . . 121 LYS N . 53013 1 457 . 1 . 1 123 123 SER H H 1 7.75204294 0.05954938187 . 1 . . . . . 122 SER H . 53013 1 458 . 1 . 1 123 123 SER CA C 13 58.40669175 0.1024632578 . 1 . . . . . 122 SER CA . 53013 1 459 . 1 . 1 123 123 SER CB C 13 60.05945904 0.04958612255 . 1 . . . . . 122 SER CB . 53013 1 460 . 1 . 1 123 123 SER N N 15 115.8326563 0.1216894286 . 1 . . . . . 122 SER N . 53013 1 461 . 1 . 1 124 124 VAL H H 1 8.463455754 0.05721147188 . 1 . . . . . 123 VAL H . 53013 1 462 . 1 . 1 124 124 VAL CA C 13 58.78819292 0.03364526956 . 1 . . . . . 123 VAL CA . 53013 1 463 . 1 . 1 124 124 VAL CB C 13 35.95692753 0.009563471449 . 1 . . . . . 123 VAL CB . 53013 1 464 . 1 . 1 124 124 VAL N N 15 115.6231037 0.07695614132 . 1 . . . . . 123 VAL N . 53013 1 465 . 1 . 1 125 125 ILE H H 1 9.376464657 2.56899537 . 1 . . . . . 124 ILE H . 53013 1 466 . 1 . 1 125 125 ILE CA C 13 67.0321649 0.04637703601 . 1 . . . . . 124 ILE CA . 53013 1 467 . 1 . 1 125 125 ILE CB C 13 37.42404188 0.007502467125 . 1 . . . . . 124 ILE CB . 53013 1 468 . 1 . 1 125 125 ILE N N 15 124.3862432 0.1444684305 . 1 . . . . . 124 ILE N . 53013 1 469 . 1 . 1 126 126 VAL H H 1 9.374924846 0.05571963405 . 1 . . . . . 125 VAL H . 53013 1 470 . 1 . 1 126 126 VAL CA C 13 67.59005819 0.01065120736 . 1 . . . . . 125 VAL CA . 53013 1 471 . 1 . 1 126 126 VAL CB C 13 31.52942122 0.007275522622 . 1 . . . . . 125 VAL CB . 53013 1 472 . 1 . 1 126 126 VAL N N 15 117.1172601 0.05955829706 . 1 . . . . . 125 VAL N . 53013 1 473 . 1 . 1 127 127 GLY H H 1 6.894812039 0.06077970695 . 1 . . . . . 126 GLY H . 53013 1 474 . 1 . 1 127 127 GLY CA C 13 46.27050865 0.02505200047 . 1 . . . . . 126 GLY CA . 53013 1 475 . 1 . 1 127 127 GLY N N 15 107.6333161 0.2979894817 . 1 . . . . . 126 GLY N . 53013 1 476 . 1 . 1 128 128 LEU H H 1 7.528416423 0.05961867751 . 1 . . . . . 127 LEU H . 53013 1 477 . 1 . 1 128 128 LEU CA C 13 57.31757217 0.03333902072 . 1 . . . . . 127 LEU CA . 53013 1 478 . 1 . 1 128 128 LEU CB C 13 41.71288853 0.08104864179 . 1 . . . . . 127 LEU CB . 53013 1 479 . 1 . 1 128 128 LEU N N 15 126.1453311 0.1783854983 . 1 . . . . . 127 LEU N . 53013 1 480 . 1 . 1 129 129 ILE H H 1 8.059433062 0.05886106359 . 1 . . . . . 128 ILE H . 53013 1 481 . 1 . 1 129 129 ILE CA C 13 66.10829967 0.004762756188 . 1 . . . . . 128 ILE CA . 53013 1 482 . 1 . 1 129 129 ILE CB C 13 37.65890319 0.01911711526 . 1 . . . . . 128 ILE CB . 53013 1 483 . 1 . 1 129 129 ILE N N 15 118.6508091 0.0329965439 . 1 . . . . . 128 ILE N . 53013 1 484 . 1 . 1 130 130 LYS H H 1 7.654938904 0.05951780325 . 1 . . . . . 129 LYS H . 53013 1 485 . 1 . 1 130 130 LYS CA C 13 60.46954304 0.0060322109 . 1 . . . . . 129 LYS CA . 53013 1 486 . 1 . 1 130 130 LYS CB C 13 32.03868531 0.02331220809 . 1 . . . . . 129 LYS CB . 53013 1 487 . 1 . 1 130 130 LYS N N 15 117.6310207 0.0392237761 . 1 . . . . . 129 LYS N . 53013 1 488 . 1 . 1 131 131 GLU H H 1 7.733658991 0.05886282793 . 1 . . . . . 130 GLU H . 53013 1 489 . 1 . 1 131 131 GLU CA C 13 59.85156946 0.104705008 . 1 . . . . . 130 GLU CA . 53013 1 490 . 1 . 1 131 131 GLU CB C 13 29.06674166 0.01381008586 . 1 . . . . . 130 GLU CB . 53013 1 491 . 1 . 1 131 131 GLU N N 15 120.7717365 0.08700764674 . 1 . . . . . 130 GLU N . 53013 1 492 . 1 . 1 132 132 MET H H 1 8.203491041 0.05819398816 . 1 . . . . . 131 MET H . 53013 1 493 . 1 . 1 132 132 MET CA C 13 59.88223535 0.1040600105 . 1 . . . . . 131 MET CA . 53013 1 494 . 1 . 1 132 132 MET CB C 13 32.99157704 0.04007962598 . 1 . . . . . 131 MET CB . 53013 1 495 . 1 . 1 132 132 MET N N 15 120.1437935 0.07497192232 . 1 . . . . . 131 MET N . 53013 1 496 . 1 . 1 133 133 ILE H H 1 8.146835487 0.05829519609 . 1 . . . . . 132 ILE H . 53013 1 497 . 1 . 1 133 133 ILE CA C 13 66.63505782 0.03141994953 . 1 . . . . . 132 ILE CA . 53013 1 498 . 1 . 1 133 133 ILE CB C 13 39.11188538 0.02921259145 . 1 . . . . . 132 ILE CB . 53013 1 499 . 1 . 1 133 133 ILE N N 15 117.1598591 0.1071409834 . 1 . . . . . 132 ILE N . 53013 1 500 . 1 . 1 134 134 ALA H H 1 7.522167146 0.05265754345 . 1 . . . . . 133 ALA H . 53013 1 501 . 1 . 1 134 134 ALA CA C 13 55.52843553 0.03460215677 . 1 . . . . . 133 ALA CA . 53013 1 502 . 1 . 1 134 134 ALA CB C 13 18.01250000 0.0 . 1 . . . . . 133 ALA CB . 53013 1 503 . 1 . 1 134 134 ALA N N 15 119.3872959 0.08710936052 . 1 . . . . . 133 ALA N . 53013 1 504 . 1 . 1 135 135 LYS H H 1 8.398718674 0.05453446015 . 1 . . . . . 134 LYS H . 53013 1 505 . 1 . 1 135 135 LYS CA C 13 57.52650824 0.002425053619 . 1 . . . . . 134 LYS CA . 53013 1 506 . 1 . 1 135 135 LYS CB C 13 30.28641508 0.02258301097 . 1 . . . . . 134 LYS CB . 53013 1 507 . 1 . 1 135 135 LYS N N 15 116.834281 0.09028062034 . 1 . . . . . 134 LYS N . 53013 1 508 . 1 . 1 136 136 PHE H H 1 8.456434133 0.05812888345 . 1 . . . . . 135 PHE H . 53013 1 509 . 1 . 1 136 136 PHE CA C 13 54.95946646 0.08197629457 . 1 . . . . . 135 PHE CA . 53013 1 510 . 1 . 1 136 136 PHE CB C 13 37.13344131 0.03157986552 . 1 . . . . . 135 PHE CB . 53013 1 511 . 1 . 1 136 136 PHE N N 15 120.8582638 0.05905464581 . 1 . . . . . 135 PHE N . 53013 1 512 . 1 . 1 137 137 GLN H H 1 7.968367837 0.05840583276 . 1 . . . . . 136 GLN H . 53013 1 513 . 1 . 1 137 137 GLN CA C 13 58.25169778 0.04853313089 . 1 . . . . . 136 GLN CA . 53013 1 514 . 1 . 1 137 137 GLN CB C 13 28.73508522 0.08158213792 . 1 . . . . . 136 GLN CB . 53013 1 515 . 1 . 1 137 137 GLN N N 15 114.0813811 0.1285604937 . 1 . . . . . 136 GLN N . 53013 1 516 . 1 . 1 138 138 GLU H H 1 7.373393403 0.06071381618 . 1 . . . . . 137 GLU H . 53013 1 517 . 1 . 1 138 138 GLU CA C 13 58.14617388 0.1019256884 . 1 . . . . . 137 GLU CA . 53013 1 518 . 1 . 1 138 138 GLU CB C 13 30.67611902 0.03103895245 . 1 . . . . . 137 GLU CB . 53013 1 519 . 1 . 1 138 138 GLU N N 15 118.0123467 0.06463652811 . 1 . . . . . 137 GLU N . 53013 1 520 . 1 . 1 139 139 GLU H H 1 7.799160222 0.05993322316 . 1 . . . . . 138 GLU H . 53013 1 521 . 1 . 1 139 139 GLU CA C 13 55.84651014 0.03726733493 . 1 . . . . . 138 GLU CA . 53013 1 522 . 1 . 1 139 139 GLU CB C 13 31.78368107 0.0 . 1 . . . . . 138 GLU CB . 53013 1 523 . 1 . 1 139 139 GLU N N 15 119.8587053 0.04262577344 . 1 . . . . . 138 GLU N . 53013 1 524 . 1 . 1 140 140 LEU H H 1 6.474841169 0.06339656668 . 1 . . . . . 139 LEU H . 53013 1 525 . 1 . 1 140 140 LEU CA C 13 52.85839524 0.00810131381 . 1 . . . . . 139 LEU CA . 53013 1 526 . 1 . 1 140 140 LEU CB C 13 41.82945261 0.001619346852 . 1 . . . . . 139 LEU CB . 53013 1 527 . 1 . 1 140 140 LEU N N 15 130.0932681 0.2336453876 . 1 . . . . . 139 LEU N . 53013 1 528 . 1 . 1 141 141 PRO CA C 13 63.72167466 0.01985877106 . 1 . . . . . 140 PRO CA . 53013 1 529 . 1 . 1 141 141 PRO CB C 13 30.25076793 0.01680462406 . 1 . . . . . 140 PRO CB . 53013 1 530 . 1 . 1 142 142 MET H H 1 6.886625755 0.06212719055 . 1 . . . . . 141 MET H . 53013 1 531 . 1 . 1 142 142 MET CA C 13 53.83718709 0.01819138979 . 1 . . . . . 141 MET CA . 53013 1 532 . 1 . 1 142 142 MET CB C 13 39.33922539 0.032626091 . 1 . . . . . 141 MET CB . 53013 1 533 . 1 . 1 142 142 MET N N 15 115.4385483 0.09136154672 . 1 . . . . . 141 MET N . 53013 1 534 . 1 . 1 143 143 TYR H H 1 8.369139315 0.05899202758 . 1 . . . . . 142 TYR H . 53013 1 535 . 1 . 1 143 143 TYR CA C 13 55.03012586 0.03553423369 . 1 . . . . . 142 TYR CA . 53013 1 536 . 1 . 1 143 143 TYR CB C 13 41.34903603 0.02014440344 . 1 . . . . . 142 TYR CB . 53013 1 537 . 1 . 1 143 143 TYR N N 15 116.3031144 0.08995743159 . 1 . . . . . 142 TYR N . 53013 1 538 . 1 . 1 144 144 SER H H 1 8.73815539 0.05717694033 . 1 . . . . . 143 SER H . 53013 1 539 . 1 . 1 144 144 SER CA C 13 58.7072938 0.0371990545 . 1 . . . . . 143 SER CA . 53013 1 540 . 1 . 1 144 144 SER CB C 13 63.86621796 0.0347238847 . 1 . . . . . 143 SER CB . 53013 1 541 . 1 . 1 144 144 SER N N 15 116.789232 0.06773074546 . 1 . . . . . 143 SER N . 53013 1 542 . 1 . 1 145 145 LEU H H 1 8.104297075 0.05720079642 . 1 . . . . . 144 LEU H . 53013 1 543 . 1 . 1 145 145 LEU CA C 13 55.73300343 0.07260868449 . 1 . . . . . 144 LEU CA . 53013 1 544 . 1 . 1 145 145 LEU CB C 13 41.8850497 0.04697606071 . 1 . . . . . 144 LEU CB . 53013 1 545 . 1 . 1 145 145 LEU N N 15 125.4015816 0.1564181375 . 1 . . . . . 144 LEU N . 53013 1 546 . 1 . 1 146 146 SER H H 1 7.770936545 0.05914643498 . 1 . . . . . 145 SER H . 53013 1 547 . 1 . 1 146 146 SER CA C 13 59.97655138 0.001619574161 . 1 . . . . . 145 SER CA . 53013 1 548 . 1 . 1 146 146 SER CB C 13 65.13288337 0.004859996272 . 1 . . . . . 145 SER CB . 53013 1 549 . 1 . 1 146 146 SER N N 15 119.5594663 0.07584831417 . 1 . . . . . 145 SER N . 53013 1 stop_ save_