################################### # 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 31299 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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-13C HSQC' . . . 31299 1 2 '2D 1H-15N HSQC' . . . 31299 1 3 '3D CBCA(CO)NH' . . . 31299 1 4 '3D HNCACB' . . . 31299 1 5 '3D C(CO)NH' . . . 31299 1 6 '3D 1H-15N NOESY' . . . 31299 1 7 '3D 1H-13C NOESY aromatic' . . . 31299 1 8 '3D 1H-13C NOESY aliphatic' . . . 31299 1 9 '3D H(CCO)NH' . . . 31299 1 10 '3D HCCH-TOCSY' . . . 31299 1 11 '3D HBHA(CO)NH' . . . 31299 1 12 '2D CBHDHE' . . . 31299 1 13 '2D CBHD' . . . 31299 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 GLY H H 1 8.449345017 0.001285021589 . 1 . . . . A 1 GLY H . 31299 1 2 . 1 . 1 2 2 GLY HA2 H 1 4.168500887 0.006243951697 . 1 . . . . A 1 GLY HA2 . 31299 1 3 . 1 . 1 2 2 GLY CA C 13 44.54554503 0.03798199932 . 1 . . . . A 1 GLY CA . 31299 1 4 . 1 . 1 2 2 GLY N N 15 108.8642161 0.003902150262 . 1 . . . . A 1 GLY N . 31299 1 5 . 1 . 1 3 3 PRO HA H 1 4.43478386 0.01503227455 . 1 . . . . A 2 PRO HA . 31299 1 6 . 1 . 1 3 3 PRO HB2 H 1 1.938960404 0.001323384716 . 1 . . . . A 2 PRO HB2 . 31299 1 7 . 1 . 1 3 3 PRO HB3 H 1 2.296215083 0.001534715211 . 1 . . . . A 2 PRO HB3 . 31299 1 8 . 1 . 1 3 3 PRO HG2 H 1 2.02544676 0.001895311336 . 1 . . . . A 2 PRO HG2 . 31299 1 9 . 1 . 1 3 3 PRO HG3 H 1 2.025401896 0.00190071236 . 1 . . . . A 2 PRO HG3 . 31299 1 10 . 1 . 1 3 3 PRO HD2 H 1 3.628032535 0.001597137308 . 1 . . . . A 2 PRO HD2 . 31299 1 11 . 1 . 1 3 3 PRO HD3 H 1 3.628293042 0.001620169026 . 1 . . . . A 2 PRO HD3 . 31299 1 12 . 1 . 1 3 3 PRO CA C 13 63.21781959 0.02072385825 . 1 . . . . A 2 PRO CA . 31299 1 13 . 1 . 1 3 3 PRO CB C 13 32.16700099 0.01881242916 . 1 . . . . A 2 PRO CB . 31299 1 14 . 1 . 1 3 3 PRO CG C 13 27.23949079 0.0002711799372 . 1 . . . . A 2 PRO CG . 31299 1 15 . 1 . 1 3 3 PRO CD C 13 49.69981143 0.00175913946 . 1 . . . . A 2 PRO CD . 31299 1 16 . 1 . 1 4 4 ALA H H 1 8.414356577 0.003197907435 . 1 . . . . A 3 ALA H . 31299 1 17 . 1 . 1 4 4 ALA HA H 1 4.343943968 0.002084645259 . 1 . . . . A 3 ALA HA . 31299 1 18 . 1 . 1 4 4 ALA HB1 H 1 1.398695559 0.002931972772 . 1 . . . . A 3 ALA HB1 . 31299 1 19 . 1 . 1 4 4 ALA HB2 H 1 1.398695559 0.002931972772 . 1 . . . . A 3 ALA HB2 . 31299 1 20 . 1 . 1 4 4 ALA HB3 H 1 1.398695559 0.002931972772 . 1 . . . . A 3 ALA HB3 . 31299 1 21 . 1 . 1 4 4 ALA CA C 13 52.45781485 0.02152894968 . 1 . . . . A 3 ALA CA . 31299 1 22 . 1 . 1 4 4 ALA CB C 13 19.26728384 0.03226550835 . 1 . . . . A 3 ALA CB . 31299 1 23 . 1 . 1 4 4 ALA N N 15 124.0962536 0.00979256091 . 1 . . . . A 3 ALA N . 31299 1 24 . 1 . 1 5 5 SER H H 1 8.197622624 0.002544618117 . 1 . . . . A 4 SER H . 31299 1 25 . 1 . 1 5 5 SER HA H 1 4.456004586 0.002149728127 . 1 . . . . A 4 SER HA . 31299 1 26 . 1 . 1 5 5 SER HB2 H 1 3.826427239 0.003611196059 . 1 . . . . A 4 SER HB2 . 31299 1 27 . 1 . 1 5 5 SER HB3 H 1 3.826427239 0.003611196059 . 1 . . . . A 4 SER HB3 . 31299 1 28 . 1 . 1 5 5 SER CA C 13 58.03745628 0.05875712127 . 1 . . . . A 4 SER CA . 31299 1 29 . 1 . 1 5 5 SER CB C 13 63.87078562 0.05525645946 . 1 . . . . A 4 SER CB . 31299 1 30 . 1 . 1 5 5 SER N N 15 115.2752351 0.01025762457 . 1 . . . . A 4 SER N . 31299 1 31 . 1 . 1 6 6 VAL H H 1 8.100757167 0.001269941569 . 1 . . . . A 5 VAL H . 31299 1 32 . 1 . 1 6 6 VAL HA H 1 4.455248762 0.01060823853 . 1 . . . . A 5 VAL HA . 31299 1 33 . 1 . 1 6 6 VAL HB H 1 2.082688025 0.004067797031 . 1 . . . . A 5 VAL HB . 31299 1 34 . 1 . 1 6 6 VAL HG11 H 1 0.9835847532 0.005989078855 . 1 . . . . A 5 VAL HG11 . 31299 1 35 . 1 . 1 6 6 VAL HG12 H 1 0.9835847532 0.005989078855 . 1 . . . . A 5 VAL HG12 . 31299 1 36 . 1 . 1 6 6 VAL HG13 H 1 0.9835847532 0.005989078855 . 1 . . . . A 5 VAL HG13 . 31299 1 37 . 1 . 1 6 6 VAL HG21 H 1 0.9371857568 0.0001796746599 . 1 . . . . A 5 VAL HG21 . 31299 1 38 . 1 . 1 6 6 VAL HG22 H 1 0.9371857568 0.0001796746599 . 1 . . . . A 5 VAL HG22 . 31299 1 39 . 1 . 1 6 6 VAL HG23 H 1 0.9371857568 0.0001796746599 . 1 . . . . A 5 VAL HG23 . 31299 1 40 . 1 . 1 6 6 VAL CA C 13 59.87802715 0.04895244339 . 1 . . . . A 5 VAL CA . 31299 1 41 . 1 . 1 6 6 VAL CB C 13 32.82693796 0.01169711739 . 1 . . . . A 5 VAL CB . 31299 1 42 . 1 . 1 6 6 VAL CG1 C 13 21.17888352 0.003383097621 . 1 . . . . A 5 VAL CG1 . 31299 1 43 . 1 . 1 6 6 VAL CG2 C 13 21.18022435 0.00222194064 . 1 . . . . A 5 VAL CG2 . 31299 1 44 . 1 . 1 6 6 VAL N N 15 123.0823717 0.01987921616 . 1 . . . . A 5 VAL N . 31299 1 45 . 1 . 1 7 7 PRO HA H 1 4.690019027 0.005680185827 . 1 . . . . A 6 PRO HA . 31299 1 46 . 1 . 1 7 7 PRO HB2 H 1 1.894276239 0.004271948723 . 2 . . . . A 6 PRO HB2 . 31299 1 47 . 1 . 1 7 7 PRO HB3 H 1 1.894276239 0.004271948723 . 2 . . . . A 6 PRO HB3 . 31299 1 48 . 1 . 1 7 7 PRO HG2 H 1 2.316364999 0.007849281925 . 2 . . . . A 6 PRO HG2 . 31299 1 49 . 1 . 1 7 7 PRO HG3 H 1 2.316364999 0.007849281925 . 2 . . . . A 6 PRO HG3 . 31299 1 50 . 1 . 1 7 7 PRO HD2 H 1 3.878480934 0.002474350335 . 2 . . . . A 6 PRO HD2 . 31299 1 51 . 1 . 1 7 7 PRO HD3 H 1 3.878480934 0.002474350335 . 2 . . . . A 6 PRO HD3 . 31299 1 52 . 1 . 1 7 7 PRO CA C 13 63.1421995 0.1241770166 . 1 . . . . A 6 PRO CA . 31299 1 53 . 1 . 1 7 7 PRO CB C 13 32.56596121 . . 1 . . . . A 6 PRO CB . 31299 1 54 . 1 . 1 7 7 PRO CG C 13 27.7828128 0.0000004768 . 1 . . . . A 6 PRO CG . 31299 1 55 . 1 . 1 7 7 PRO CD C 13 51.01474656 0.02978158003 . 1 . . . . A 6 PRO CD . 31299 1 56 . 1 . 1 8 8 THR H H 1 9.051236035 0.003556068435 . 1 . . . . A 7 THR H . 31299 1 57 . 1 . 1 8 8 THR HA H 1 4.696242337 0.004162137444 . 1 . . . . A 7 THR HA . 31299 1 58 . 1 . 1 8 8 THR HB H 1 4.026440044 0.001713795663 . 1 . . . . A 7 THR HB . 31299 1 59 . 1 . 1 8 8 THR HG21 H 1 1.217572062 0.006564613016 . 1 . . . . A 7 THR HG21 . 31299 1 60 . 1 . 1 8 8 THR HG22 H 1 1.217572062 0.006564613016 . 1 . . . . A 7 THR HG22 . 31299 1 61 . 1 . 1 8 8 THR HG23 H 1 1.217572062 0.006564613016 . 1 . . . . A 7 THR HG23 . 31299 1 62 . 1 . 1 8 8 THR CA C 13 62.42268222 0.04177968533 . 1 . . . . A 7 THR CA . 31299 1 63 . 1 . 1 8 8 THR CB C 13 72.47726793 0.04234701884 . 1 . . . . A 7 THR CB . 31299 1 64 . 1 . 1 8 8 THR CG2 C 13 21.8189435 0.02242897187 . 1 . . . . A 7 THR CG2 . 31299 1 65 . 1 . 1 8 8 THR N N 15 117.8583233 0.007439428314 . 1 . . . . A 7 THR N . 31299 1 66 . 1 . 1 9 9 THR H H 1 8.874279897 0.002059358181 . 1 . . . . A 8 THR H . 31299 1 67 . 1 . 1 9 9 THR HA H 1 4.766408401 0.004065783358 . 1 . . . . A 8 THR HA . 31299 1 68 . 1 . 1 9 9 THR HB H 1 3.869580171 0.004685403396 . 1 . . . . A 8 THR HB . 31299 1 69 . 1 . 1 9 9 THR HG21 H 1 1.072775667 0.003800504382 . 1 . . . . A 8 THR HG21 . 31299 1 70 . 1 . 1 9 9 THR HG22 H 1 1.072775667 0.003800504382 . 1 . . . . A 8 THR HG22 . 31299 1 71 . 1 . 1 9 9 THR HG23 H 1 1.072775667 0.003800504382 . 1 . . . . A 8 THR HG23 . 31299 1 72 . 1 . 1 9 9 THR CA C 13 63.19182567 . . 1 . . . . A 8 THR CA . 31299 1 73 . 1 . 1 9 9 THR CB C 13 69.28618371 0.03417866436 . 1 . . . . A 8 THR CB . 31299 1 74 . 1 . 1 9 9 THR CG2 C 13 23.06469392 0.02412026861 . 1 . . . . A 8 THR CG2 . 31299 1 75 . 1 . 1 9 9 THR N N 15 126.0688141 0.006546146107 . 1 . . . . A 8 THR N . 31299 1 76 . 1 . 1 10 10 CYS H H 1 8.88465702 0.00217021448 . 1 . . . . A 9 CYS H . 31299 1 77 . 1 . 1 10 10 CYS HA H 1 5.217792592 0.005887202883 . 1 . . . . A 9 CYS HA . 31299 1 78 . 1 . 1 10 10 CYS HB2 H 1 2.496979947 0.00537003733 . 2 . . . . A 9 CYS HB2 . 31299 1 79 . 1 . 1 10 10 CYS HB3 H 1 2.496979947 0.00537003733 . 2 . . . . A 9 CYS HB3 . 31299 1 80 . 1 . 1 10 10 CYS CA C 13 51.41686433 0.04656629674 . 1 . . . . A 9 CYS CA . 31299 1 81 . 1 . 1 10 10 CYS CB C 13 41.61427011 0.00520175591 . 1 . . . . A 9 CYS CB . 31299 1 82 . 1 . 1 10 10 CYS N N 15 120.8769911 0.004916752636 . 1 . . . . A 9 CYS N . 31299 1 83 . 1 . 1 11 11 CYS H H 1 7.773321071 0.001802268949 . 1 . . . . A 10 CYS H . 31299 1 84 . 1 . 1 11 11 CYS HA H 1 5.011702641 0.00696571181 . 1 . . . . A 10 CYS HA . 31299 1 85 . 1 . 1 11 11 CYS HB2 H 1 2.576718179 0.02282713639 . 2 . . . . A 10 CYS HB2 . 31299 1 86 . 1 . 1 11 11 CYS HB3 H 1 2.576718179 0.02282713639 . 2 . . . . A 10 CYS HB3 . 31299 1 87 . 1 . 1 11 11 CYS CA C 13 55.23721699 0.04593493349 . 1 . . . . A 10 CYS CA . 31299 1 88 . 1 . 1 11 11 CYS CB C 13 43.63981275 . . 1 . . . . A 10 CYS CB . 31299 1 89 . 1 . 1 11 11 CYS N N 15 117.2005639 0.004756378733 . 1 . . . . A 10 CYS N . 31299 1 90 . 1 . 1 12 12 PHE H H 1 9.628301641 0.002483960491 . 1 . . . . A 11 PHE H . 31299 1 91 . 1 . 1 12 12 PHE HA H 1 4.446668898 0.004779327842 . 1 . . . . A 11 PHE HA . 31299 1 92 . 1 . 1 12 12 PHE HB2 H 1 3.283172161 0.000011478 . 2 . . . . A 11 PHE HB2 . 31299 1 93 . 1 . 1 12 12 PHE HB3 H 1 3.283172161 0.000011478 . 2 . . . . A 11 PHE HB3 . 31299 1 94 . 1 . 1 12 12 PHE HD1 H 1 7.232917378 0.001179279001 . 3 . . . . A 11 PHE HD1 . 31299 1 95 . 1 . 1 12 12 PHE HD2 H 1 7.232917378 0.001179279001 . 3 . . . . A 11 PHE HD2 . 31299 1 96 . 1 . 1 12 12 PHE HE1 H 1 7.295100069 0.006903328265 . 3 . . . . A 11 PHE HE1 . 31299 1 97 . 1 . 1 12 12 PHE HE2 H 1 7.295100069 0.006903328265 . 3 . . . . A 11 PHE HE2 . 31299 1 98 . 1 . 1 12 12 PHE HZ H 1 7.263359674 0.001685039566 . 1 . . . . A 11 PHE HZ . 31299 1 99 . 1 . 1 12 12 PHE CA C 13 59.49949687 0.002410308117 . 1 . . . . A 11 PHE CA . 31299 1 100 . 1 . 1 12 12 PHE CB C 13 39.67770736 0.03483813771 . 1 . . . . A 11 PHE CB . 31299 1 101 . 1 . 1 12 12 PHE CD1 C 13 131.9809317 0.006383534852 . 3 . . . . A 11 PHE CD1 . 31299 1 102 . 1 . 1 12 12 PHE CD2 C 13 131.9809317 0.006383534852 . 3 . . . . A 11 PHE CD2 . 31299 1 103 . 1 . 1 12 12 PHE CE1 C 13 131.6499976 0.04406798616 . 3 . . . . A 11 PHE CE1 . 31299 1 104 . 1 . 1 12 12 PHE CE2 C 13 131.6499976 0.04406798616 . 3 . . . . A 11 PHE CE2 . 31299 1 105 . 1 . 1 12 12 PHE CZ C 13 129.8241027 0.02271998209 . 1 . . . . A 11 PHE CZ . 31299 1 106 . 1 . 1 12 12 PHE N N 15 124.4303607 0.01852648115 . 1 . . . . A 11 PHE N . 31299 1 107 . 1 . 1 13 13 ASN H H 1 7.624381724 0.001586490534 . 1 . . . . A 12 ASN H . 31299 1 108 . 1 . 1 13 13 ASN HA H 1 4.826096694 0.002526791767 . 1 . . . . A 12 ASN HA . 31299 1 109 . 1 . 1 13 13 ASN HB2 H 1 2.610434207 0.003350509307 . 1 . . . . A 12 ASN HB2 . 31299 1 110 . 1 . 1 13 13 ASN HB3 H 1 2.755562176 0.005916595251 . 1 . . . . A 12 ASN HB3 . 31299 1 111 . 1 . 1 13 13 ASN HD21 H 1 7.702201956 0.0003518861155 . 1 . . . . A 12 ASN HD21 . 31299 1 112 . 1 . 1 13 13 ASN HD22 H 1 6.995948161 0.001493432679 . 1 . . . . A 12 ASN HD22 . 31299 1 113 . 1 . 1 13 13 ASN CA C 13 52.90152536 0.0002497197609 . 1 . . . . A 12 ASN CA . 31299 1 114 . 1 . 1 13 13 ASN CB C 13 41.58682799 0.002053577157 . 1 . . . . A 12 ASN CB . 31299 1 115 . 1 . 1 13 13 ASN N N 15 117.0852016 0.03485965921 . 1 . . . . A 12 ASN N . 31299 1 116 . 1 . 1 13 13 ASN ND2 N 15 113.4724086 0.002624305174 . 1 . . . . A 12 ASN ND2 . 31299 1 117 . 1 . 1 14 14 LEU H H 1 8.422870714 0.0008286645104 . 1 . . . . A 13 LEU H . 31299 1 118 . 1 . 1 14 14 LEU HA H 1 4.357462604 0.002671124326 . 1 . . . . A 13 LEU HA . 31299 1 119 . 1 . 1 14 14 LEU HB2 H 1 1.792509189 0.008405326556 . 1 . . . . A 13 LEU HB2 . 31299 1 120 . 1 . 1 14 14 LEU HB3 H 1 1.268704774 0.006192880823 . 1 . . . . A 13 LEU HB3 . 31299 1 121 . 1 . 1 14 14 LEU HG H 1 1.49125045 0.005851848287 . 1 . . . . A 13 LEU HG . 31299 1 122 . 1 . 1 14 14 LEU HD11 H 1 0.7935812854 0.01105171131 . 1 . . . . A 13 LEU HD11 . 31299 1 123 . 1 . 1 14 14 LEU HD12 H 1 0.7935812854 0.01105171131 . 1 . . . . A 13 LEU HD12 . 31299 1 124 . 1 . 1 14 14 LEU HD13 H 1 0.7935812854 0.01105171131 . 1 . . . . A 13 LEU HD13 . 31299 1 125 . 1 . 1 14 14 LEU HD21 H 1 0.5563320335 0.01098088028 . 1 . . . . A 13 LEU HD21 . 31299 1 126 . 1 . 1 14 14 LEU HD22 H 1 0.5563320335 0.01098088028 . 1 . . . . A 13 LEU HD22 . 31299 1 127 . 1 . 1 14 14 LEU HD23 H 1 0.5563320335 0.01098088028 . 1 . . . . A 13 LEU HD23 . 31299 1 128 . 1 . 1 14 14 LEU CA C 13 53.34950919 0.005235543362 . 1 . . . . A 13 LEU CA . 31299 1 129 . 1 . 1 14 14 LEU CB C 13 43.4959733 0.05719574706 . 1 . . . . A 13 LEU CB . 31299 1 130 . 1 . 1 14 14 LEU CG C 13 26.98419756 0.0009200828435 . 1 . . . . A 13 LEU CG . 31299 1 131 . 1 . 1 14 14 LEU CD1 C 13 25.18258198 0.002031346106 . 1 . . . . A 13 LEU CD1 . 31299 1 132 . 1 . 1 14 14 LEU CD2 C 13 23.22305627 . . 1 . . . . A 13 LEU CD2 . 31299 1 133 . 1 . 1 14 14 LEU N N 15 120.1729578 0.005113929111 . 1 . . . . A 13 LEU N . 31299 1 134 . 1 . 1 15 15 ALA H H 1 8.903848598 0.001190431594 . 1 . . . . A 14 ALA H . 31299 1 135 . 1 . 1 15 15 ALA HA H 1 4.42903574 0.004374118821 . 1 . . . . A 14 ALA HA . 31299 1 136 . 1 . 1 15 15 ALA HB1 H 1 1.63339365 0.005890684873 . 1 . . . . A 14 ALA HB1 . 31299 1 137 . 1 . 1 15 15 ALA HB2 H 1 1.63339365 0.005890684873 . 1 . . . . A 14 ALA HB2 . 31299 1 138 . 1 . 1 15 15 ALA HB3 H 1 1.63339365 0.005890684873 . 1 . . . . A 14 ALA HB3 . 31299 1 139 . 1 . 1 15 15 ALA CA C 13 52.97327446 0.1275177477 . 1 . . . . A 14 ALA CA . 31299 1 140 . 1 . 1 15 15 ALA CB C 13 19.1531881 0.05321502668 . 1 . . . . A 14 ALA CB . 31299 1 141 . 1 . 1 15 15 ALA N N 15 125.311216 0.008359515002 . 1 . . . . A 14 ALA N . 31299 1 142 . 1 . 1 16 16 ASN H H 1 8.677881235 0.00260439856 . 1 . . . . A 15 ASN H . 31299 1 143 . 1 . 1 16 16 ASN HA H 1 4.9873256 0.00437781847 . 1 . . . . A 15 ASN HA . 31299 1 144 . 1 . 1 16 16 ASN HB2 H 1 2.925849554 0.002812920763 . 1 . . . . A 15 ASN HB2 . 31299 1 145 . 1 . 1 16 16 ASN HB3 H 1 2.926591348 0.003284916712 . 1 . . . . A 15 ASN HB3 . 31299 1 146 . 1 . 1 16 16 ASN HD21 H 1 7.712719141 0.0009178644949 . 1 . . . . A 15 ASN HD21 . 31299 1 147 . 1 . 1 16 16 ASN HD22 H 1 6.974392042 0.002878807314 . 1 . . . . A 15 ASN HD22 . 31299 1 148 . 1 . 1 16 16 ASN CA C 13 53.6883379 0.07931400544 . 1 . . . . A 15 ASN CA . 31299 1 149 . 1 . 1 16 16 ASN CB C 13 39.82805235 0.05725394423 . 1 . . . . A 15 ASN CB . 31299 1 150 . 1 . 1 16 16 ASN N N 15 120.1370148 0.006880227423 . 1 . . . . A 15 ASN N . 31299 1 151 . 1 . 1 16 16 ASN ND2 N 15 113.1518885 0.015371416 . 1 . . . . A 15 ASN ND2 . 31299 1 152 . 1 . 1 17 17 ARG H H 1 7.675904119 0.00366158132 . 1 . . . . A 16 ARG H . 31299 1 153 . 1 . 1 17 17 ARG HA H 1 4.261870217 0.003130945931 . 1 . . . . A 16 ARG HA . 31299 1 154 . 1 . 1 17 17 ARG HB2 H 1 1.651456358 0.007677046459 . 1 . . . . A 16 ARG HB2 . 31299 1 155 . 1 . 1 17 17 ARG HB3 H 1 1.650689395 0.002873047841 . 1 . . . . A 16 ARG HB3 . 31299 1 156 . 1 . 1 17 17 ARG HG2 H 1 1.518624617 0.007780217 . 1 . . . . A 16 ARG HG2 . 31299 1 157 . 1 . 1 17 17 ARG HG3 H 1 1.518807518 0.007850776811 . 1 . . . . A 16 ARG HG3 . 31299 1 158 . 1 . 1 17 17 ARG HD2 H 1 3.146627921 0.002636663783 . 1 . . . . A 16 ARG HD2 . 31299 1 159 . 1 . 1 17 17 ARG HD3 H 1 3.146783083 0.002659399664 . 1 . . . . A 16 ARG HD3 . 31299 1 160 . 1 . 1 17 17 ARG CA C 13 54.96599579 0.03118421985 . 1 . . . . A 16 ARG CA . 31299 1 161 . 1 . 1 17 17 ARG CB C 13 31.88208312 0.02680772516 . 1 . . . . A 16 ARG CB . 31299 1 162 . 1 . 1 17 17 ARG CG C 13 26.86833928 0.03033891654 . 1 . . . . A 16 ARG CG . 31299 1 163 . 1 . 1 17 17 ARG CD C 13 43.42081102 0.03722241609 . 1 . . . . A 16 ARG CD . 31299 1 164 . 1 . 1 17 17 ARG N N 15 120.2424816 0.01579323177 . 1 . . . . A 16 ARG N . 31299 1 165 . 1 . 1 17 17 ARG NE N 15 85.15703738 . . 1 . . . . A 16 ARG NE . 31299 1 166 . 1 . 1 18 18 LYS H H 1 7.557136236 0.004766710761 . 1 . . . . A 17 LYS H . 31299 1 167 . 1 . 1 18 18 LYS HA H 1 1.318501466 0.005997423402 . 1 . . . . A 17 LYS HA . 31299 1 168 . 1 . 1 18 18 LYS HB2 H 1 0.8261608852 0.006239620138 . 1 . . . . A 17 LYS HB2 . 31299 1 169 . 1 . 1 18 18 LYS HB3 H 1 0.826236148 0.006450182935 . 1 . . . . A 17 LYS HB3 . 31299 1 170 . 1 . 1 18 18 LYS HG2 H 1 0.6442690575 0.005105367957 . 1 . . . . A 17 LYS HG2 . 31299 1 171 . 1 . 1 18 18 LYS HG3 H 1 0.388435832 0.005405993177 . 1 . . . . A 17 LYS HG3 . 31299 1 172 . 1 . 1 18 18 LYS HD2 H 1 1.397985481 0.001393282084 . 1 . . . . A 17 LYS HD2 . 31299 1 173 . 1 . 1 18 18 LYS HD3 H 1 1.372919059 0.0006768204383 . 1 . . . . A 17 LYS HD3 . 31299 1 174 . 1 . 1 18 18 LYS HE2 H 1 2.780093289 0.005016585364 . 1 . . . . A 17 LYS HE2 . 31299 1 175 . 1 . 1 18 18 LYS HE3 H 1 2.778705778 0.003136650444 . 1 . . . . A 17 LYS HE3 . 31299 1 176 . 1 . 1 18 18 LYS CA C 13 56.0197047 0.04738726691 . 1 . . . . A 17 LYS CA . 31299 1 177 . 1 . 1 18 18 LYS CB C 13 32.54671963 0.047775122 . 1 . . . . A 17 LYS CB . 31299 1 178 . 1 . 1 18 18 LYS CG C 13 23.94815992 0.01686831255 . 1 . . . . A 17 LYS CG . 31299 1 179 . 1 . 1 18 18 LYS CD C 13 29.41774058 0.03632885746 . 1 . . . . A 17 LYS CD . 31299 1 180 . 1 . 1 18 18 LYS CE C 13 42.04287072 0.02797460187 . 1 . . . . A 17 LYS CE . 31299 1 181 . 1 . 1 18 18 LYS N N 15 121.1854993 0.005651624789 . 1 . . . . A 17 LYS N . 31299 1 182 . 1 . 1 19 19 ILE H H 1 5.32657362 0.00378046766 . 1 . . . . A 18 ILE H . 31299 1 183 . 1 . 1 19 19 ILE HA H 1 4.174951873 0.002937642303 . 1 . . . . A 18 ILE HA . 31299 1 184 . 1 . 1 19 19 ILE HB H 1 1.351450194 0.006195100293 . 1 . . . . A 18 ILE HB . 31299 1 185 . 1 . 1 19 19 ILE HG12 H 1 1.042247318 0.006508779521 . 1 . . . . A 18 ILE HG12 . 31299 1 186 . 1 . 1 19 19 ILE HG13 H 1 1.473058695 0.006341692729 . 1 . . . . A 18 ILE HG13 . 31299 1 187 . 1 . 1 19 19 ILE HG21 H 1 0.8008125422 0.003736390674 . 1 . . . . A 18 ILE HG21 . 31299 1 188 . 1 . 1 19 19 ILE HG22 H 1 0.8008125422 0.003736390674 . 1 . . . . A 18 ILE HG22 . 31299 1 189 . 1 . 1 19 19 ILE HG23 H 1 0.8008125422 0.003736390674 . 1 . . . . A 18 ILE HG23 . 31299 1 190 . 1 . 1 19 19 ILE HD11 H 1 0.7868446181 0.006017374835 . 1 . . . . A 18 ILE HD11 . 31299 1 191 . 1 . 1 19 19 ILE HD12 H 1 0.7868446181 0.006017374835 . 1 . . . . A 18 ILE HD12 . 31299 1 192 . 1 . 1 19 19 ILE HD13 H 1 0.7868446181 0.006017374835 . 1 . . . . A 18 ILE HD13 . 31299 1 193 . 1 . 1 19 19 ILE CA C 13 56.98292507 0.05397858803 . 1 . . . . A 18 ILE CA . 31299 1 194 . 1 . 1 19 19 ILE CB C 13 40.65815601 0.000916058292 . 1 . . . . A 18 ILE CB . 31299 1 195 . 1 . 1 19 19 ILE CG1 C 13 26.7219778 0.01512893932 . 1 . . . . A 18 ILE CG1 . 31299 1 196 . 1 . 1 19 19 ILE CG2 C 13 16.65074729 0.0161621917 . 1 . . . . A 18 ILE CG2 . 31299 1 197 . 1 . 1 19 19 ILE CD1 C 13 13.69632958 0.02869742095 . 1 . . . . A 18 ILE CD1 . 31299 1 198 . 1 . 1 19 19 ILE N N 15 125.7114811 0.006876532789 . 1 . . . . A 18 ILE N . 31299 1 199 . 1 . 1 20 20 PRO HA H 1 4.139348822 0.00810428195 . 1 . . . . A 19 PRO HA . 31299 1 200 . 1 . 1 20 20 PRO HB2 H 1 1.674199905 0.003792603106 . 1 . . . . A 19 PRO HB2 . 31299 1 201 . 1 . 1 20 20 PRO HB3 H 1 2.32598591 0.003492431138 . 1 . . . . A 19 PRO HB3 . 31299 1 202 . 1 . 1 20 20 PRO HG2 H 1 1.944475493 0.001714338569 . 1 . . . . A 19 PRO HG2 . 31299 1 203 . 1 . 1 20 20 PRO HG3 H 1 1.876274242 0.001965782837 . 1 . . . . A 19 PRO HG3 . 31299 1 204 . 1 . 1 20 20 PRO HD2 H 1 3.749878811 0.003100737615 . 1 . . . . A 19 PRO HD2 . 31299 1 205 . 1 . 1 20 20 PRO HD3 H 1 3.380914722 0.004348309579 . 1 . . . . A 19 PRO HD3 . 31299 1 206 . 1 . 1 20 20 PRO CA C 13 63.16870073 0.04570460669 . 1 . . . . A 19 PRO CA . 31299 1 207 . 1 . 1 20 20 PRO CB C 13 32.36222598 0.0373791965 . 1 . . . . A 19 PRO CB . 31299 1 208 . 1 . 1 20 20 PRO CG C 13 27.80145366 0.0498195488 . 1 . . . . A 19 PRO CG . 31299 1 209 . 1 . 1 20 20 PRO CD C 13 51.18513759 0.03586712108 . 1 . . . . A 19 PRO CD . 31299 1 210 . 1 . 1 21 21 LEU H H 1 8.05675759 0.004575119351 . 1 . . . . A 20 LEU H . 31299 1 211 . 1 . 1 21 21 LEU HA H 1 3.645410486 0.004166565695 . 1 . . . . A 20 LEU HA . 31299 1 212 . 1 . 1 21 21 LEU HB2 H 1 1.35362767 0.003351507605 . 1 . . . . A 20 LEU HB2 . 31299 1 213 . 1 . 1 21 21 LEU HB3 H 1 0.8352661806 0.005628572219 . 1 . . . . A 20 LEU HB3 . 31299 1 214 . 1 . 1 21 21 LEU HG H 1 1.481866201 0.003299222076 . 1 . . . . A 20 LEU HG . 31299 1 215 . 1 . 1 21 21 LEU HD11 H 1 0.5229047219 0.008952174802 . 1 . . . . A 20 LEU HD11 . 31299 1 216 . 1 . 1 21 21 LEU HD12 H 1 0.5229047219 0.008952174802 . 1 . . . . A 20 LEU HD12 . 31299 1 217 . 1 . 1 21 21 LEU HD13 H 1 0.5229047219 0.008952174802 . 1 . . . . A 20 LEU HD13 . 31299 1 218 . 1 . 1 21 21 LEU HD21 H 1 0.4831044498 0.006890031128 . 1 . . . . A 20 LEU HD21 . 31299 1 219 . 1 . 1 21 21 LEU HD22 H 1 0.4831044498 0.006890031128 . 1 . . . . A 20 LEU HD22 . 31299 1 220 . 1 . 1 21 21 LEU HD23 H 1 0.4831044498 0.006890031128 . 1 . . . . A 20 LEU HD23 . 31299 1 221 . 1 . 1 21 21 LEU CA C 13 58.15032999 0.02917775854 . 1 . . . . A 20 LEU CA . 31299 1 222 . 1 . 1 21 21 LEU CB C 13 41.51324005 0.0285103368 . 1 . . . . A 20 LEU CB . 31299 1 223 . 1 . 1 21 21 LEU CG C 13 26.37554204 0.01788542218 . 1 . . . . A 20 LEU CG . 31299 1 224 . 1 . 1 21 21 LEU CD1 C 13 24.1983261 0.03984405743 . 1 . . . . A 20 LEU CD1 . 31299 1 225 . 1 . 1 21 21 LEU CD2 C 13 23.27648615 0.0442980307 . 1 . . . . A 20 LEU CD2 . 31299 1 226 . 1 . 1 21 21 LEU N N 15 124.3090654 0.004184053232 . 1 . . . . A 20 LEU N . 31299 1 227 . 1 . 1 22 22 GLN H H 1 8.576789558 0.009787688409 . 1 . . . . A 21 GLN H . 31299 1 228 . 1 . 1 22 22 GLN HA H 1 4.173262815 0.003918953721 . 1 . . . . A 21 GLN HA . 31299 1 229 . 1 . 1 22 22 GLN HB2 H 1 2.108482624 0.001533992455 . 1 . . . . A 21 GLN HB2 . 31299 1 230 . 1 . 1 22 22 GLN HB3 H 1 2.061974823 0.003259469712 . 1 . . . . A 21 GLN HB3 . 31299 1 231 . 1 . 1 22 22 GLN HG2 H 1 2.430293515 0.002006658171 . 1 . . . . A 21 GLN HG2 . 31299 1 232 . 1 . 1 22 22 GLN HG3 H 1 2.391019366 0.001838582391 . 1 . . . . A 21 GLN HG3 . 31299 1 233 . 1 . 1 22 22 GLN HE21 H 1 7.530490548 0.0005429868312 . 1 . . . . A 21 GLN HE21 . 31299 1 234 . 1 . 1 22 22 GLN HE22 H 1 6.878009224 0.0005665389661 . 1 . . . . A 21 GLN HE22 . 31299 1 235 . 1 . 1 22 22 GLN CA C 13 58.04172249 0.008902610759 . 1 . . . . A 21 GLN CA . 31299 1 236 . 1 . 1 22 22 GLN CB C 13 27.68338406 0.01503657176 . 1 . . . . A 21 GLN CB . 31299 1 237 . 1 . 1 22 22 GLN CG C 13 33.8667993 0.0256269176 . 1 . . . . A 21 GLN CG . 31299 1 238 . 1 . 1 22 22 GLN N N 15 113.4039707 0.02476457424 . 1 . . . . A 21 GLN N . 31299 1 239 . 1 . 1 22 22 GLN NE2 N 15 112.0758985 0.002799976099 . 1 . . . . A 21 GLN NE2 . 31299 1 240 . 1 . 1 23 23 ARG H H 1 7.867848495 0.005305164082 . 1 . . . . A 22 ARG H . 31299 1 241 . 1 . 1 23 23 ARG HA H 1 4.343434712 0.003855407147 . 1 . . . . A 22 ARG HA . 31299 1 242 . 1 . 1 23 23 ARG HB2 H 1 2.117188723 0.004778522744 . 1 . . . . A 22 ARG HB2 . 31299 1 243 . 1 . 1 23 23 ARG HB3 H 1 1.750728941 0.01592346586 . 1 . . . . A 22 ARG HB3 . 31299 1 244 . 1 . 1 23 23 ARG HG2 H 1 1.675970153 0.001286835358 . 1 . . . . A 22 ARG HG2 . 31299 1 245 . 1 . 1 23 23 ARG HG3 H 1 1.676652023 . . 1 . . . . A 22 ARG HG3 . 31299 1 246 . 1 . 1 23 23 ARG HD2 H 1 3.176568063 0.006160081357 . 1 . . . . A 22 ARG HD2 . 31299 1 247 . 1 . 1 23 23 ARG HD3 H 1 3.12643465 0.001996550579 . 1 . . . . A 22 ARG HD3 . 31299 1 248 . 1 . 1 23 23 ARG CA C 13 55.97159076 0.006666618887 . 1 . . . . A 22 ARG CA . 31299 1 249 . 1 . 1 23 23 ARG CB C 13 30.9068431 0.02273989526 . 1 . . . . A 22 ARG CB . 31299 1 250 . 1 . 1 23 23 ARG CG C 13 27.6860661 0.02757281255 . 1 . . . . A 22 ARG CG . 31299 1 251 . 1 . 1 23 23 ARG CD C 13 43.41933347 0.01844866607 . 1 . . . . A 22 ARG CD . 31299 1 252 . 1 . 1 23 23 ARG N N 15 115.7288388 0.003489471518 . 1 . . . . A 22 ARG N . 31299 1 253 . 1 . 1 23 23 ARG NE N 15 84.69885452 . . 1 . . . . A 22 ARG NE . 31299 1 254 . 1 . 1 24 24 LEU H H 1 7.671524695 0.005347090175 . 1 . . . . A 23 LEU H . 31299 1 255 . 1 . 1 24 24 LEU HA H 1 4.326029789 0.005021015791 . 1 . . . . A 23 LEU HA . 31299 1 256 . 1 . 1 24 24 LEU HB2 H 1 2.234965194 0.005302824221 . 1 . . . . A 23 LEU HB2 . 31299 1 257 . 1 . 1 24 24 LEU HB3 H 1 1.34225328 0.006986973176 . 1 . . . . A 23 LEU HB3 . 31299 1 258 . 1 . 1 24 24 LEU HG H 1 1.733884482 0.005993070121 . 1 . . . . A 23 LEU HG . 31299 1 259 . 1 . 1 24 24 LEU HD11 H 1 0.5249344895 0.004347889921 . 1 . . . . A 23 LEU HD11 . 31299 1 260 . 1 . 1 24 24 LEU HD12 H 1 0.5249344895 0.004347889921 . 1 . . . . A 23 LEU HD12 . 31299 1 261 . 1 . 1 24 24 LEU HD13 H 1 0.5249344895 0.004347889921 . 1 . . . . A 23 LEU HD13 . 31299 1 262 . 1 . 1 24 24 LEU HD21 H 1 0.6336052146 0.01857611984 . 1 . . . . A 23 LEU HD21 . 31299 1 263 . 1 . 1 24 24 LEU HD22 H 1 0.6336052146 0.01857611984 . 1 . . . . A 23 LEU HD22 . 31299 1 264 . 1 . 1 24 24 LEU HD23 H 1 0.6336052146 0.01857611984 . 1 . . . . A 23 LEU HD23 . 31299 1 265 . 1 . 1 24 24 LEU CA C 13 55.48448408 0.03131656932 . 1 . . . . A 23 LEU CA . 31299 1 266 . 1 . 1 24 24 LEU CB C 13 44.39421886 0.05439777677 . 1 . . . . A 23 LEU CB . 31299 1 267 . 1 . 1 24 24 LEU CG C 13 25.57675179 0.008072003651 . 1 . . . . A 23 LEU CG . 31299 1 268 . 1 . 1 24 24 LEU CD1 C 13 22.95404051 . . 1 . . . . A 23 LEU CD1 . 31299 1 269 . 1 . 1 24 24 LEU CD2 C 13 25.66005983 0.05583322914 . 1 . . . . A 23 LEU CD2 . 31299 1 270 . 1 . 1 24 24 LEU N N 15 118.9602665 0.01428369718 . 1 . . . . A 23 LEU N . 31299 1 271 . 1 . 1 25 25 GLU H H 1 9.194607789 0.004876308056 . 1 . . . . A 24 GLU H . 31299 1 272 . 1 . 1 25 25 GLU HA H 1 4.65773727 0.004241818524 . 1 . . . . A 24 GLU HA . 31299 1 273 . 1 . 1 25 25 GLU HB2 H 1 1.909205585 0.003871052116 . 1 . . . . A 24 GLU HB2 . 31299 1 274 . 1 . 1 25 25 GLU HB3 H 1 1.685110762 0.004040330373 . 1 . . . . A 24 GLU HB3 . 31299 1 275 . 1 . 1 25 25 GLU HG2 H 1 2.17981131 0.003863315106 . 1 . . . . A 24 GLU HG2 . 31299 1 276 . 1 . 1 25 25 GLU HG3 H 1 2.179207181 0.003908600905 . 1 . . . . A 24 GLU HG3 . 31299 1 277 . 1 . 1 25 25 GLU CA C 13 57.42296002 0.02145914261 . 1 . . . . A 24 GLU CA . 31299 1 278 . 1 . 1 25 25 GLU CB C 13 32.89094126 0.01671046985 . 1 . . . . A 24 GLU CB . 31299 1 279 . 1 . 1 25 25 GLU CG C 13 35.96750965 0.008978961707 . 1 . . . . A 24 GLU CG . 31299 1 280 . 1 . 1 25 25 GLU N N 15 120.5206175 0.01133296522 . 1 . . . . A 24 GLU N . 31299 1 281 . 1 . 1 26 26 SER H H 1 8.172159125 0.004574645934 . 1 . . . . A 25 SER H . 31299 1 282 . 1 . 1 26 26 SER HA H 1 4.763031541 0.009272250512 . 1 . . . . A 25 SER HA . 31299 1 283 . 1 . 1 26 26 SER HB2 H 1 4.083879431 0.003198696713 . 1 . . . . A 25 SER HB2 . 31299 1 284 . 1 . 1 26 26 SER HB3 H 1 3.975992988 0.005181605307 . 1 . . . . A 25 SER HB3 . 31299 1 285 . 1 . 1 26 26 SER CA C 13 58.33025184 0.02580805704 . 1 . . . . A 25 SER CA . 31299 1 286 . 1 . 1 26 26 SER CB C 13 64.36473387 0.04054114077 . 1 . . . . A 25 SER CB . 31299 1 287 . 1 . 1 26 26 SER N N 15 109.4589756 0.02841105867 . 1 . . . . A 25 SER N . 31299 1 288 . 1 . 1 27 27 TYR H H 1 8.624611036 0.003477034684 . 1 . . . . A 26 TYR H . 31299 1 289 . 1 . 1 27 27 TYR HA H 1 5.756056191 0.007051970817 . 1 . . . . A 26 TYR HA . 31299 1 290 . 1 . 1 27 27 TYR HB2 H 1 2.286433259 0.009479889091 . 1 . . . . A 26 TYR HB2 . 31299 1 291 . 1 . 1 27 27 TYR HB3 H 1 2.826105326 0.0208255805 . 1 . . . . A 26 TYR HB3 . 31299 1 292 . 1 . 1 27 27 TYR HD1 H 1 6.677084582 0.001418477525 . 1 . . . . A 26 TYR HD1 . 31299 1 293 . 1 . 1 27 27 TYR HD2 H 1 6.677084582 0.001418477528 . 1 . . . . A 26 TYR HD2 . 31299 1 294 . 1 . 1 27 27 TYR HE1 H 1 6.781283564 0.006886292027 . 1 . . . . A 26 TYR HE1 . 31299 1 295 . 1 . 1 27 27 TYR HE2 H 1 6.781283564 0.006886292027 . 1 . . . . A 26 TYR HE2 . 31299 1 296 . 1 . 1 27 27 TYR CA C 13 56.66792966 0.04512771207 . 1 . . . . A 26 TYR CA . 31299 1 297 . 1 . 1 27 27 TYR CB C 13 42.53991634 0.1448651009 . 1 . . . . A 26 TYR CB . 31299 1 298 . 1 . 1 27 27 TYR CD1 C 13 132.1587753 0.009415024483 . 1 . . . . A 26 TYR CD1 . 31299 1 299 . 1 . 1 27 27 TYR CD2 C 13 132.1638557 0.01263357719 . 1 . . . . A 26 TYR CD2 . 31299 1 300 . 1 . 1 27 27 TYR CE1 C 13 118.7193567 0.02542931619 . 1 . . . . A 26 TYR CE1 . 31299 1 301 . 1 . 1 27 27 TYR CE2 C 13 118.7196317 0.0260267926 . 1 . . . . A 26 TYR CE2 . 31299 1 302 . 1 . 1 27 27 TYR N N 15 115.6963186 0.005881134839 . 1 . . . . A 26 TYR N . 31299 1 303 . 1 . 1 28 28 ARG H H 1 8.639521533 0.007439470261 . 1 . . . . A 27 ARG H . 31299 1 304 . 1 . 1 28 28 ARG HA H 1 4.513016885 0.008929777616 . 1 . . . . A 27 ARG HA . 31299 1 305 . 1 . 1 28 28 ARG HB2 H 1 1.720761034 0.01036788067 . 1 . . . . A 27 ARG HB2 . 31299 1 306 . 1 . 1 28 28 ARG HB3 H 1 1.721009413 0.01070408585 . 1 . . . . A 27 ARG HB3 . 31299 1 307 . 1 . 1 28 28 ARG HG2 H 1 1.410584322 0.007803892937 . 1 . . . . A 27 ARG HG2 . 31299 1 308 . 1 . 1 28 28 ARG HG3 H 1 1.409585149 0.007906048334 . 1 . . . . A 27 ARG HG3 . 31299 1 309 . 1 . 1 28 28 ARG HD2 H 1 3.111145538 0.007568962874 . 1 . . . . A 27 ARG HD2 . 31299 1 310 . 1 . 1 28 28 ARG HD3 H 1 3.111039723 0.007762679476 . 1 . . . . A 27 ARG HD3 . 31299 1 311 . 1 . 1 28 28 ARG CA C 13 54.39226242 0.0119553715 . 1 . . . . A 27 ARG CA . 31299 1 312 . 1 . 1 28 28 ARG CB C 13 33.58022853 0.04194278777 . 1 . . . . A 27 ARG CB . 31299 1 313 . 1 . 1 28 28 ARG CG C 13 26.67482197 0.04734430378 . 1 . . . . A 27 ARG CG . 31299 1 314 . 1 . 1 28 28 ARG CD C 13 43.74976308 0.005049569769 . 1 . . . . A 27 ARG CD . 31299 1 315 . 1 . 1 28 28 ARG N N 15 117.8118046 0.01631448114 . 1 . . . . A 27 ARG N . 31299 1 316 . 1 . 1 28 28 ARG NE N 15 85.47129368 . . 1 . . . . A 27 ARG NE . 31299 1 317 . 1 . 1 29 29 ARG H H 1 8.918650325 0.004787133296 . 1 . . . . A 28 ARG H . 31299 1 318 . 1 . 1 29 29 ARG HA H 1 4.712174061 0.009565441213 . 1 . . . . A 28 ARG HA . 31299 1 319 . 1 . 1 29 29 ARG HB2 H 1 1.706992792 0.001353173297 . 1 . . . . A 28 ARG HB2 . 31299 1 320 . 1 . 1 29 29 ARG HB3 H 1 1.828100798 0.01226170687 . 1 . . . . A 28 ARG HB3 . 31299 1 321 . 1 . 1 29 29 ARG HG2 H 1 1.530603127 0.003567484045 . 1 . . . . A 28 ARG HG2 . 31299 1 322 . 1 . 1 29 29 ARG HG3 H 1 1.530987433 . . 1 . . . . A 28 ARG HG3 . 31299 1 323 . 1 . 1 29 29 ARG HD2 H 1 3.211027138 0.007869666516 . 1 . . . . A 28 ARG HD2 . 31299 1 324 . 1 . 1 29 29 ARG HD3 H 1 3.210886675 0.007811674153 . 1 . . . . A 28 ARG HD3 . 31299 1 325 . 1 . 1 29 29 ARG HE H 1 7.336625443 0.005365104165 . 1 . . . . A 28 ARG HE . 31299 1 326 . 1 . 1 29 29 ARG CA C 13 56.01281646 0.02311702155 . 1 . . . . A 28 ARG CA . 31299 1 327 . 1 . 1 29 29 ARG CB C 13 31.79668625 0.03656245398 . 1 . . . . A 28 ARG CB . 31299 1 328 . 1 . 1 29 29 ARG CG C 13 28.69662027 0.004481944506 . 1 . . . . A 28 ARG CG . 31299 1 329 . 1 . 1 29 29 ARG CD C 13 43.40353256 0.0207575659 . 1 . . . . A 28 ARG CD . 31299 1 330 . 1 . 1 29 29 ARG N N 15 121.4922334 0.02428155235 . 1 . . . . A 28 ARG N . 31299 1 331 . 1 . 1 29 29 ARG NE N 15 84.49346039 . . 1 . . . . A 28 ARG NE . 31299 1 332 . 1 . 1 30 30 ILE H H 1 8.406651148 0.002448147463 . 1 . . . . A 29 ILE H . 31299 1 333 . 1 . 1 30 30 ILE HA H 1 4.376353358 0.004145166155 . 1 . . . . A 29 ILE HA . 31299 1 334 . 1 . 1 30 30 ILE HB H 1 1.917814638 0.007992079774 . 1 . . . . A 29 ILE HB . 31299 1 335 . 1 . 1 30 30 ILE HG12 H 1 1.190045239 0.001011339461 . 1 . . . . A 29 ILE HG12 . 31299 1 336 . 1 . 1 30 30 ILE HG13 H 1 1.40939647 0.001014202889 . 1 . . . . A 29 ILE HG13 . 31299 1 337 . 1 . 1 30 30 ILE HG21 H 1 1.009914995 0.004896822345 . 1 . . . . A 29 ILE HG21 . 31299 1 338 . 1 . 1 30 30 ILE HG22 H 1 1.009914995 0.004896822345 . 1 . . . . A 29 ILE HG22 . 31299 1 339 . 1 . 1 30 30 ILE HG23 H 1 1.009914995 0.004896822345 . 1 . . . . A 29 ILE HG23 . 31299 1 340 . 1 . 1 30 30 ILE HD11 H 1 0.8451919341 0.004677082154 . 1 . . . . A 29 ILE HD11 . 31299 1 341 . 1 . 1 30 30 ILE HD12 H 1 0.8451919341 0.004677082154 . 1 . . . . A 29 ILE HD12 . 31299 1 342 . 1 . 1 30 30 ILE HD13 H 1 0.8451919341 0.004677082154 . 1 . . . . A 29 ILE HD13 . 31299 1 343 . 1 . 1 30 30 ILE CA C 13 60.42200934 0.02209856909 . 1 . . . . A 29 ILE CA . 31299 1 344 . 1 . 1 30 30 ILE CB C 13 38.33098731 0.05506605084 . 1 . . . . A 29 ILE CB . 31299 1 345 . 1 . 1 30 30 ILE CG1 C 13 27.18988225 0.006504827343 . 1 . . . . A 29 ILE CG1 . 31299 1 346 . 1 . 1 30 30 ILE CG2 C 13 18.18241569 0.005939409088 . 1 . . . . A 29 ILE CG2 . 31299 1 347 . 1 . 1 30 30 ILE CD1 C 13 13.02069434 0.1016168967 . 1 . . . . A 29 ILE CD1 . 31299 1 348 . 1 . 1 30 30 ILE N N 15 122.8388461 0.02583284573 . 1 . . . . A 29 ILE N . 31299 1 349 . 1 . 1 31 31 THR H H 1 8.43975752 0.002377675251 . 1 . . . . A 30 THR H . 31299 1 350 . 1 . 1 31 31 THR HA H 1 4.465004243 0.002210796665 . 1 . . . . A 30 THR HA . 31299 1 351 . 1 . 1 31 31 THR HB H 1 4.349474533 0.004269023226 . 1 . . . . A 30 THR HB . 31299 1 352 . 1 . 1 31 31 THR HG21 H 1 1.128311148 0.01135060046 . 1 . . . . A 30 THR HG21 . 31299 1 353 . 1 . 1 31 31 THR HG22 H 1 1.128311148 0.01135060046 . 1 . . . . A 30 THR HG22 . 31299 1 354 . 1 . 1 31 31 THR HG23 H 1 1.128311148 0.01135060046 . 1 . . . . A 30 THR HG23 . 31299 1 355 . 1 . 1 31 31 THR CA C 13 61.04247072 0.03004839748 . 1 . . . . A 30 THR CA . 31299 1 356 . 1 . 1 31 31 THR CB C 13 70.1064076 0.0656563728 . 1 . . . . A 30 THR CB . 31299 1 357 . 1 . 1 31 31 THR CG2 C 13 21.5916025 0.0005544114299 . 1 . . . . A 30 THR CG2 . 31299 1 358 . 1 . 1 31 31 THR N N 15 117.4030586 0.006617300958 . 1 . . . . A 30 THR N . 31299 1 359 . 1 . 1 32 32 SER H H 1 7.860618054 0.001167248657 . 1 . . . . A 31 SER H . 31299 1 360 . 1 . 1 32 32 SER HA H 1 4.367228446 0.002840730448 . 1 . . . . A 31 SER HA . 31299 1 361 . 1 . 1 32 32 SER HB2 H 1 4.028872485 0.007041446869 . 1 . . . . A 31 SER HB2 . 31299 1 362 . 1 . 1 32 32 SER HB3 H 1 3.714618231 0.01161692879 . 1 . . . . A 31 SER HB3 . 31299 1 363 . 1 . 1 32 32 SER CA C 13 58.28432844 0.02829539527 . 1 . . . . A 31 SER CA . 31299 1 364 . 1 . 1 32 32 SER CB C 13 64.0913183 0.03083122876 . 1 . . . . A 31 SER CB . 31299 1 365 . 1 . 1 32 32 SER N N 15 117.123093 0.01175963646 . 1 . . . . A 31 SER N . 31299 1 366 . 1 . 1 33 33 GLY H H 1 8.841305698 0.002095549575 . 1 . . . . A 32 GLY H . 31299 1 367 . 1 . 1 33 33 GLY HA2 H 1 3.975155912 0.003275949534 . 1 . . . . A 32 GLY HA2 . 31299 1 368 . 1 . 1 33 33 GLY HA3 H 1 3.974428636 0.002773728753 . 1 . . . . A 32 GLY HA3 . 31299 1 369 . 1 . 1 33 33 GLY CA C 13 46.18321522 0.1085925976 . 1 . . . . A 32 GLY CA . 31299 1 370 . 1 . 1 33 33 GLY N N 15 114.3870783 0.01114533098 . 1 . . . . A 32 GLY N . 31299 1 371 . 1 . 1 34 34 LYS H H 1 8.122185694 0.000879007551 . 1 . . . . A 33 LYS H . 31299 1 372 . 1 . 1 34 34 LYS HA H 1 4.249863918 0.005601171278 . 1 . . . . A 33 LYS HA . 31299 1 373 . 1 . 1 34 34 LYS HB2 H 1 1.896626268 0.003169394044 . 1 . . . . A 33 LYS HB2 . 31299 1 374 . 1 . 1 34 34 LYS HB3 H 1 1.680775942 0.004920550376 . 1 . . . . A 33 LYS HB3 . 31299 1 375 . 1 . 1 34 34 LYS HG2 H 1 1.090939719 0.01049921643 . 2 . . . . A 33 LYS HG2 . 31299 1 376 . 1 . 1 34 34 LYS HG3 H 1 1.090939719 0.01049921643 . 2 . . . . A 33 LYS HG3 . 31299 1 377 . 1 . 1 34 34 LYS HD2 H 1 1.417546556 0.002192645467 . 1 . . . . A 33 LYS HD2 . 31299 1 378 . 1 . 1 34 34 LYS HD3 H 1 1.405549048 0.00922929911 . 1 . . . . A 33 LYS HD3 . 31299 1 379 . 1 . 1 34 34 LYS CA C 13 56.64019385 0.03579223861 . 1 . . . . A 33 LYS CA . 31299 1 380 . 1 . 1 34 34 LYS CB C 13 32.48841728 0.08039387868 . 1 . . . . A 33 LYS CB . 31299 1 381 . 1 . 1 34 34 LYS CG C 13 24.98570163 0.001731237239 . 1 . . . . A 33 LYS CG . 31299 1 382 . 1 . 1 34 34 LYS CD C 13 28.87457959 0.005277515146 . 1 . . . . A 33 LYS CD . 31299 1 383 . 1 . 1 34 34 LYS N N 15 118.9602115 0.004833661747 . 1 . . . . A 33 LYS N . 31299 1 384 . 1 . 1 35 35 CYS H H 1 7.56669305 0.001813695465 . 1 . . . . A 34 CYS H . 31299 1 385 . 1 . 1 35 35 CYS HA H 1 5.152023825 0.006231117124 . 1 . . . . A 34 CYS HA . 31299 1 386 . 1 . 1 35 35 CYS HB2 H 1 3.418736146 0.007156800623 . 2 . . . . A 34 CYS HB2 . 31299 1 387 . 1 . 1 35 35 CYS HB3 H 1 2.631087395 0.005623901793 . 2 . . . . A 34 CYS HB3 . 31299 1 388 . 1 . 1 35 35 CYS CA C 13 50.97072632 0.0241320098 . 1 . . . . A 34 CYS CA . 31299 1 389 . 1 . 1 35 35 CYS CB C 13 37.2193207 0.02466817967 . 1 . . . . A 34 CYS CB . 31299 1 390 . 1 . 1 35 35 CYS N N 15 117.0968018 0.0120477442 . 1 . . . . A 34 CYS N . 31299 1 391 . 1 . 1 36 36 PRO HA H 1 4.351079064 0.003689030884 . 1 . . . . A 35 PRO HA . 31299 1 392 . 1 . 1 36 36 PRO HB2 H 1 2.376073732 0.008897511477 . 1 . . . . A 35 PRO HB2 . 31299 1 393 . 1 . 1 36 36 PRO HB3 H 1 1.995863086 0.002860883185 . 1 . . . . A 35 PRO HB3 . 31299 1 394 . 1 . 1 36 36 PRO HG2 H 1 1.897959332 0.003796454601 . 1 . . . . A 35 PRO HG2 . 31299 1 395 . 1 . 1 36 36 PRO HG3 H 1 1.897959332 0.003796454601 . 1 . . . . A 35 PRO HG3 . 31299 1 396 . 1 . 1 36 36 PRO HD2 H 1 3.864094137 0.005552912613 . 1 . . . . A 35 PRO HD2 . 31299 1 397 . 1 . 1 36 36 PRO HD3 H 1 3.579868006 0.006213220404 . 1 . . . . A 35 PRO HD3 . 31299 1 398 . 1 . 1 36 36 PRO CA C 13 64.66021213 0.01993974785 . 1 . . . . A 35 PRO CA . 31299 1 399 . 1 . 1 36 36 PRO CB C 13 32.03498284 0.009852575246 . 1 . . . . A 35 PRO CB . 31299 1 400 . 1 . 1 36 36 PRO CG C 13 27.61487748 . . 1 . . . . A 35 PRO CG . 31299 1 401 . 1 . 1 36 36 PRO CD C 13 50.39389602 0.02048603451 . 1 . . . . A 35 PRO CD . 31299 1 402 . 1 . 1 37 37 GLN H H 1 7.11628384 0.002382078605 . 1 . . . . A 36 GLN H . 31299 1 403 . 1 . 1 37 37 GLN HA H 1 4.582309395 0.002075127876 . 1 . . . . A 36 GLN HA . 31299 1 404 . 1 . 1 37 37 GLN HB2 H 1 2.037927442 0.002210188113 . 1 . . . . A 36 GLN HB2 . 31299 1 405 . 1 . 1 37 37 GLN HB3 H 1 1.939495908 0.002484288253 . 1 . . . . A 36 GLN HB3 . 31299 1 406 . 1 . 1 37 37 GLN HG2 H 1 2.146001219 0.002436940455 . 1 . . . . A 36 GLN HG2 . 31299 1 407 . 1 . 1 37 37 GLN HG3 H 1 2.146012451 0.001632210772 . 1 . . . . A 36 GLN HG3 . 31299 1 408 . 1 . 1 37 37 GLN HE21 H 1 7.099910705 0.001023138036 . 1 . . . . A 36 GLN HE21 . 31299 1 409 . 1 . 1 37 37 GLN HE22 H 1 6.617704886 0.0003767856126 . 1 . . . . A 36 GLN HE22 . 31299 1 410 . 1 . 1 37 37 GLN CA C 13 54.0963198 0.03239740923 . 1 . . . . A 36 GLN CA . 31299 1 411 . 1 . 1 37 37 GLN CB C 13 31.17150362 0.02432577685 . 1 . . . . A 36 GLN CB . 31299 1 412 . 1 . 1 37 37 GLN CG C 13 33.14204444 0.1466110026 . 1 . . . . A 36 GLN CG . 31299 1 413 . 1 . 1 37 37 GLN N N 15 112.3235903 0.007455822268 . 1 . . . . A 36 GLN N . 31299 1 414 . 1 . 1 37 37 GLN NE2 N 15 109.197259 0.00385757642 . 1 . . . . A 36 GLN NE2 . 31299 1 415 . 1 . 1 38 38 LYS H H 1 8.5806564 0.005608460993 . 1 . . . . A 37 LYS H . 31299 1 416 . 1 . 1 38 38 LYS HA H 1 4.230590154 0.004340381132 . 1 . . . . A 37 LYS HA . 31299 1 417 . 1 . 1 38 38 LYS HB2 H 1 1.784235606 0.004855562429 . 1 . . . . A 37 LYS HB2 . 31299 1 418 . 1 . 1 38 38 LYS HB3 H 1 1.785153521 0.005887358903 . 1 . . . . A 37 LYS HB3 . 31299 1 419 . 1 . 1 38 38 LYS HG2 H 1 1.333943717 0.002250824612 . 1 . . . . A 37 LYS HG2 . 31299 1 420 . 1 . 1 38 38 LYS HG3 H 1 1.333928162 0.002244026873 . 1 . . . . A 37 LYS HG3 . 31299 1 421 . 1 . 1 38 38 LYS HD2 H 1 1.522557328 0.005339566108 . 1 . . . . A 37 LYS HD2 . 31299 1 422 . 1 . 1 38 38 LYS HD3 H 1 1.523842402 0.004203556633 . 1 . . . . A 37 LYS HD3 . 31299 1 423 . 1 . 1 38 38 LYS HE2 H 1 2.961996354 0.003174850562 . 1 . . . . A 37 LYS HE2 . 31299 1 424 . 1 . 1 38 38 LYS HE3 H 1 2.961906018 0.003383162351 . 1 . . . . A 37 LYS HE3 . 31299 1 425 . 1 . 1 38 38 LYS CA C 13 56.5961057 0.01795985242 . 1 . . . . A 37 LYS CA . 31299 1 426 . 1 . 1 38 38 LYS CB C 13 31.88151784 0.03858359235 . 1 . . . . A 37 LYS CB . 31299 1 427 . 1 . 1 38 38 LYS CG C 13 25.50904507 0.004275044603 . 1 . . . . A 37 LYS CG . 31299 1 428 . 1 . 1 38 38 LYS CD C 13 29.26026009 0.03204020567 . 1 . . . . A 37 LYS CD . 31299 1 429 . 1 . 1 38 38 LYS CE C 13 42.07654614 0.0004706505945 . 1 . . . . A 37 LYS CE . 31299 1 430 . 1 . 1 38 38 LYS N N 15 124.1408364 0.007967958559 . 1 . . . . A 37 LYS N . 31299 1 431 . 1 . 1 39 39 ALA H H 1 7.826213153 0.001234646675 . 1 . . . . A 38 ALA H . 31299 1 432 . 1 . 1 39 39 ALA HA H 1 4.738177524 0.005849903385 . 1 . . . . A 38 ALA HA . 31299 1 433 . 1 . 1 39 39 ALA HB1 H 1 1.312414045 0.01323843369 . 1 . . . . A 38 ALA HB1 . 31299 1 434 . 1 . 1 39 39 ALA HB2 H 1 1.312414045 0.01323843369 . 1 . . . . A 38 ALA HB2 . 31299 1 435 . 1 . 1 39 39 ALA HB3 H 1 1.312414045 0.01323843369 . 1 . . . . A 38 ALA HB3 . 31299 1 436 . 1 . 1 39 39 ALA CA C 13 51.40674487 0.0206486074 . 1 . . . . A 38 ALA CA . 31299 1 437 . 1 . 1 39 39 ALA CB C 13 23.22222447 0.04364872058 . 1 . . . . A 38 ALA CB . 31299 1 438 . 1 . 1 39 39 ALA N N 15 121.6097853 0.009274281154 . 1 . . . . A 38 ALA N . 31299 1 439 . 1 . 1 40 40 VAL H H 1 8.445603584 0.003587506307 . 1 . . . . A 39 VAL H . 31299 1 440 . 1 . 1 40 40 VAL HA H 1 4.47693004 0.00835998147 . 1 . . . . A 39 VAL HA . 31299 1 441 . 1 . 1 40 40 VAL HB H 1 1.377355924 0.006092121676 . 1 . . . . A 39 VAL HB . 31299 1 442 . 1 . 1 40 40 VAL HG11 H 1 0.1831854456 0.005275437286 . 1 . . . . A 39 VAL HG11 . 31299 1 443 . 1 . 1 40 40 VAL HG12 H 1 0.1831854456 0.005275437286 . 1 . . . . A 39 VAL HG12 . 31299 1 444 . 1 . 1 40 40 VAL HG13 H 1 0.1831854456 0.005275437286 . 1 . . . . A 39 VAL HG13 . 31299 1 445 . 1 . 1 40 40 VAL HG21 H 1 0.5090552215 0.006914300475 . 1 . . . . A 39 VAL HG21 . 31299 1 446 . 1 . 1 40 40 VAL HG22 H 1 0.5090552215 0.006914300475 . 1 . . . . A 39 VAL HG22 . 31299 1 447 . 1 . 1 40 40 VAL HG23 H 1 0.5090552215 0.006914300475 . 1 . . . . A 39 VAL HG23 . 31299 1 448 . 1 . 1 40 40 VAL CA C 13 61.02480436 0.04182564596 . 1 . . . . A 39 VAL CA . 31299 1 449 . 1 . 1 40 40 VAL CB C 13 34.9374235 0.06963514786 . 1 . . . . A 39 VAL CB . 31299 1 450 . 1 . 1 40 40 VAL CG1 C 13 21.34612835 0.1884062619 . 1 . . . . A 39 VAL CG1 . 31299 1 451 . 1 . 1 40 40 VAL CG2 C 13 21.3879264 0.1918149403 . 1 . . . . A 39 VAL CG2 . 31299 1 452 . 1 . 1 40 40 VAL N N 15 119.1348611 0.02929002811 . 1 . . . . A 39 VAL N . 31299 1 453 . 1 . 1 41 41 ILE H H 1 8.805473158 0.002801380441 . 1 . . . . A 40 ILE H . 31299 1 454 . 1 . 1 41 41 ILE HA H 1 4.829240003 0.01076265778 . 1 . . . . A 40 ILE HA . 31299 1 455 . 1 . 1 41 41 ILE HB H 1 1.551842283 0.009489810281 . 1 . . . . A 40 ILE HB . 31299 1 456 . 1 . 1 41 41 ILE HG12 H 1 0.9369702208 0.004191652729 . 1 . . . . A 40 ILE HG12 . 31299 1 457 . 1 . 1 41 41 ILE HG13 H 1 1.44684635 0.003950390487 . 1 . . . . A 40 ILE HG13 . 31299 1 458 . 1 . 1 41 41 ILE HG21 H 1 0.7495038478 0.01235506636 . 1 . . . . A 40 ILE HG21 . 31299 1 459 . 1 . 1 41 41 ILE HG22 H 1 0.7495038478 0.01235506636 . 1 . . . . A 40 ILE HG22 . 31299 1 460 . 1 . 1 41 41 ILE HG23 H 1 0.7495038478 0.01235506636 . 1 . . . . A 40 ILE HG23 . 31299 1 461 . 1 . 1 41 41 ILE HD11 H 1 0.6877485358 0.0008002233192 . 1 . . . . A 40 ILE HD11 . 31299 1 462 . 1 . 1 41 41 ILE HD12 H 1 0.6877485358 0.0008002233192 . 1 . . . . A 40 ILE HD12 . 31299 1 463 . 1 . 1 41 41 ILE HD13 H 1 0.6877485358 0.0008002233192 . 1 . . . . A 40 ILE HD13 . 31299 1 464 . 1 . 1 41 41 ILE CA C 13 59.79637989 0.009629874395 . 1 . . . . A 40 ILE CA . 31299 1 465 . 1 . 1 41 41 ILE CB C 13 39.99415175 0.03462649076 . 1 . . . . A 40 ILE CB . 31299 1 466 . 1 . 1 41 41 ILE CG1 C 13 27.95746527 0.01826030257 . 1 . . . . A 40 ILE CG1 . 31299 1 467 . 1 . 1 41 41 ILE CG2 C 13 17.96043101 0.06808516075 . 1 . . . . A 40 ILE CG2 . 31299 1 468 . 1 . 1 41 41 ILE CD1 C 13 14.09920742 0.00209155772 . 1 . . . . A 40 ILE CD1 . 31299 1 469 . 1 . 1 41 41 ILE N N 15 123.3451051 0.0340735893 . 1 . . . . A 40 ILE N . 31299 1 470 . 1 . 1 42 42 PHE H H 1 9.4731948 0.004021766498 . 1 . . . . A 41 PHE H . 31299 1 471 . 1 . 1 42 42 PHE HA H 1 5.246769383 0.007562427972 . 1 . . . . A 41 PHE HA . 31299 1 472 . 1 . 1 42 42 PHE HB2 H 1 3.038346626 0.008538153171 . 1 . . . . A 41 PHE HB2 . 31299 1 473 . 1 . 1 42 42 PHE HB3 H 1 2.888751665 0.006378211435 . 1 . . . . A 41 PHE HB3 . 31299 1 474 . 1 . 1 42 42 PHE HD1 H 1 7.167216961 0.00819239809 . 3 . . . . A 41 PHE HD1 . 31299 1 475 . 1 . 1 42 42 PHE HD2 H 1 7.167216961 0.00819239809 . 3 . . . . A 41 PHE HD2 . 31299 1 476 . 1 . 1 42 42 PHE HE1 H 1 6.729815256 0.008369054861 . 1 . . . . A 41 PHE HE1 . 31299 1 477 . 1 . 1 42 42 PHE HE2 H 1 6.729819762 0.008268873378 . 1 . . . . A 41 PHE HE2 . 31299 1 478 . 1 . 1 42 42 PHE HZ H 1 7.071364821 0.001079002871 . 1 . . . . A 41 PHE HZ . 31299 1 479 . 1 . 1 42 42 PHE CA C 13 58.03251381 0.01804625968 . 1 . . . . A 41 PHE CA . 31299 1 480 . 1 . 1 42 42 PHE CB C 13 41.69893852 0.0059720874 . 1 . . . . A 41 PHE CB . 31299 1 481 . 1 . 1 42 42 PHE CD1 C 13 132.0075573 0.01430421877 . 1 . . . . A 41 PHE CD1 . 31299 1 482 . 1 . 1 42 42 PHE CD2 C 13 132.0079112 0.01444577956 . 1 . . . . A 41 PHE CD2 . 31299 1 483 . 1 . 1 42 42 PHE CE1 C 13 130.5038398 0.02501029715 . 1 . . . . A 41 PHE CE1 . 31299 1 484 . 1 . 1 42 42 PHE CE2 C 13 130.5038398 0.02501029715 . 1 . . . . A 41 PHE CE2 . 31299 1 485 . 1 . 1 42 42 PHE CZ C 13 129.2922786 0.01055443926 . 1 . . . . A 41 PHE CZ . 31299 1 486 . 1 . 1 42 42 PHE N N 15 126.9413973 0.01787233998 . 1 . . . . A 41 PHE N . 31299 1 487 . 1 . 1 43 43 LYS H H 1 8.939765079 0.004936742358 . 1 . . . . A 42 LYS H . 31299 1 488 . 1 . 1 43 43 LYS HA H 1 5.396487664 0.008881478604 . 1 . . . . A 42 LYS HA . 31299 1 489 . 1 . 1 43 43 LYS HB2 H 1 1.938833351 0.003249195333 . 1 . . . . A 42 LYS HB2 . 31299 1 490 . 1 . 1 43 43 LYS HB3 H 1 1.728048048 0.002553899606 . 1 . . . . A 42 LYS HB3 . 31299 1 491 . 1 . 1 43 43 LYS HG2 H 1 1.451698047 0.005204285143 . 2 . . . . A 42 LYS HG2 . 31299 1 492 . 1 . 1 43 43 LYS HG3 H 1 1.451698047 0.005204285143 . 2 . . . . A 42 LYS HG3 . 31299 1 493 . 1 . 1 43 43 LYS HD2 H 1 1.537356125 0.0008493280959 . 2 . . . . A 42 LYS HD2 . 31299 1 494 . 1 . 1 43 43 LYS HD3 H 1 1.537356125 0.0008493280959 . 2 . . . . A 42 LYS HD3 . 31299 1 495 . 1 . 1 43 43 LYS HE2 H 1 2.930263676 0.00599227547 . 1 . . . . A 42 LYS HE2 . 31299 1 496 . 1 . 1 43 43 LYS HE3 H 1 2.924978999 0.004555224273 . 1 . . . . A 42 LYS HE3 . 31299 1 497 . 1 . 1 43 43 LYS CA C 13 54.77586181 0.03086393609 . 1 . . . . A 42 LYS CA . 31299 1 498 . 1 . 1 43 43 LYS CB C 13 33.64043268 0.01963704532 . 1 . . . . A 42 LYS CB . 31299 1 499 . 1 . 1 43 43 LYS CG C 13 24.34175325 0.02312715001 . 1 . . . . A 42 LYS CG . 31299 1 500 . 1 . 1 43 43 LYS CD C 13 28.77733832 0.0003782722458 . 1 . . . . A 42 LYS CD . 31299 1 501 . 1 . 1 43 43 LYS CE C 13 41.63712329 0.01834670949 . 1 . . . . A 42 LYS CE . 31299 1 502 . 1 . 1 43 43 LYS N N 15 123.3292981 0.01345015714 . 1 . . . . A 42 LYS N . 31299 1 503 . 1 . 1 44 44 THR H H 1 9.186856466 0.002642638688 . 1 . . . . A 43 THR H . 31299 1 504 . 1 . 1 44 44 THR HA H 1 5.285749453 0.006911490994 . 1 . . . . A 43 THR HA . 31299 1 505 . 1 . 1 44 44 THR HB H 1 4.84835944 0.01328765489 . 1 . . . . A 43 THR HB . 31299 1 506 . 1 . 1 44 44 THR HG21 H 1 1.272909992 0.001707999296 . 1 . . . . A 43 THR HG21 . 31299 1 507 . 1 . 1 44 44 THR HG22 H 1 1.272909992 0.001707999296 . 1 . . . . A 43 THR HG22 . 31299 1 508 . 1 . 1 44 44 THR HG23 H 1 1.272909992 0.001707999296 . 1 . . . . A 43 THR HG23 . 31299 1 509 . 1 . 1 44 44 THR CA C 13 60.29427609 0.03451883278 . 1 . . . . A 43 THR CA . 31299 1 510 . 1 . 1 44 44 THR CB C 13 72.10056168 0.03208153288 . 1 . . . . A 43 THR CB . 31299 1 511 . 1 . 1 44 44 THR CG2 C 13 21.41353458 0.01652913528 . 1 . . . . A 43 THR CG2 . 31299 1 512 . 1 . 1 44 44 THR N N 15 116.7511296 0.01750229978 . 1 . . . . A 43 THR N . 31299 1 513 . 1 . 1 45 45 LYS H H 1 8.719433827 0.006672371636 . 1 . . . . A 44 LYS H . 31299 1 514 . 1 . 1 45 45 LYS HA H 1 4.206315541 0.002739004089 . 1 . . . . A 44 LYS HA . 31299 1 515 . 1 . 1 45 45 LYS HB2 H 1 2.036637635 0.005893876876 . 2 . . . . A 44 LYS HB2 . 31299 1 516 . 1 . 1 45 45 LYS HB3 H 1 2.036637635 0.005893876876 . 2 . . . . A 44 LYS HB3 . 31299 1 517 . 1 . 1 45 45 LYS HG2 H 1 1.455650855 0.003788113438 . 1 . . . . A 44 LYS HG2 . 31299 1 518 . 1 . 1 45 45 LYS HG3 H 1 1.382877699 0.00162627146 . 1 . . . . A 44 LYS HG3 . 31299 1 519 . 1 . 1 45 45 LYS HE2 H 1 3.002004045 0.007877509936 . 1 . . . . A 44 LYS HE2 . 31299 1 520 . 1 . 1 45 45 LYS HE3 H 1 3.000713461 0.007309425224 . 1 . . . . A 44 LYS HE3 . 31299 1 521 . 1 . 1 45 45 LYS CA C 13 58.59638896 0.03955668096 . 1 . . . . A 44 LYS CA . 31299 1 522 . 1 . 1 45 45 LYS CB C 13 32.68621345 0.003590188758 . 1 . . . . A 44 LYS CB . 31299 1 523 . 1 . 1 45 45 LYS CG C 13 26.47531026 0.04692116745 . 1 . . . . A 44 LYS CG . 31299 1 524 . 1 . 1 45 45 LYS CD C 13 29.40520226 0.003005935834 . 1 . . . . A 44 LYS CD . 31299 1 525 . 1 . 1 45 45 LYS CE C 13 42.33029767 0.0106066773 . 1 . . . . A 44 LYS CE . 31299 1 526 . 1 . 1 45 45 LYS N N 15 120.1001341 0.01145768527 . 1 . . . . A 44 LYS N . 31299 1 527 . 1 . 1 46 46 LEU H H 1 7.658314295 0.003960142195 . 1 . . . . A 45 LEU H . 31299 1 528 . 1 . 1 46 46 LEU HA H 1 4.468790059 0.003111536177 . 1 . . . . A 45 LEU HA . 31299 1 529 . 1 . 1 46 46 LEU HB2 H 1 1.782605615 0.001943989823 . 1 . . . . A 45 LEU HB2 . 31299 1 530 . 1 . 1 46 46 LEU HB3 H 1 1.651673114 0.001853897508 . 1 . . . . A 45 LEU HB3 . 31299 1 531 . 1 . 1 46 46 LEU HG H 1 1.618103691 0.004399512676 . 1 . . . . A 45 LEU HG . 31299 1 532 . 1 . 1 46 46 LEU HD11 H 1 0.9430999931 0.004003595566 . 1 . . . . A 45 LEU HD11 . 31299 1 533 . 1 . 1 46 46 LEU HD12 H 1 0.9430999931 0.004003595566 . 1 . . . . A 45 LEU HD12 . 31299 1 534 . 1 . 1 46 46 LEU HD13 H 1 0.9430999931 0.004003595566 . 1 . . . . A 45 LEU HD13 . 31299 1 535 . 1 . 1 46 46 LEU HD21 H 1 0.8699165953 0.00487099618 . 1 . . . . A 45 LEU HD21 . 31299 1 536 . 1 . 1 46 46 LEU HD22 H 1 0.8699165953 0.00487099618 . 1 . . . . A 45 LEU HD22 . 31299 1 537 . 1 . 1 46 46 LEU HD23 H 1 0.8699165953 0.00487099618 . 1 . . . . A 45 LEU HD23 . 31299 1 538 . 1 . 1 46 46 LEU CA C 13 54.65921395 0.01013039803 . 1 . . . . A 45 LEU CA . 31299 1 539 . 1 . 1 46 46 LEU CB C 13 40.76218536 0.03727278724 . 1 . . . . A 45 LEU CB . 31299 1 540 . 1 . 1 46 46 LEU CG C 13 27.53093209 0.0009517814806 . 1 . . . . A 45 LEU CG . 31299 1 541 . 1 . 1 46 46 LEU CD1 C 13 25.03599965 0.004611617244 . 1 . . . . A 45 LEU CD1 . 31299 1 542 . 1 . 1 46 46 LEU CD2 C 13 22.96714718 0.00218988341 . 1 . . . . A 45 LEU CD2 . 31299 1 543 . 1 . 1 46 46 LEU N N 15 118.5615093 0.01246144907 . 1 . . . . A 45 LEU N . 31299 1 544 . 1 . 1 47 47 ALA H H 1 8.046333708 0.00453950936 . 1 . . . . A 46 ALA H . 31299 1 545 . 1 . 1 47 47 ALA HA H 1 3.955967214 0.007867770669 . 1 . . . . A 46 ALA HA . 31299 1 546 . 1 . 1 47 47 ALA HB1 H 1 1.459628016 0.003709095718 . 1 . . . . A 46 ALA HB1 . 31299 1 547 . 1 . 1 47 47 ALA HB2 H 1 1.459628016 0.003709095718 . 1 . . . . A 46 ALA HB2 . 31299 1 548 . 1 . 1 47 47 ALA HB3 H 1 1.459628016 0.003709095718 . 1 . . . . A 46 ALA HB3 . 31299 1 549 . 1 . 1 47 47 ALA CA C 13 53.05525669 0.03253689572 . 1 . . . . A 46 ALA CA . 31299 1 550 . 1 . 1 47 47 ALA CB C 13 16.65928411 0.02497795608 . 1 . . . . A 46 ALA CB . 31299 1 551 . 1 . 1 47 47 ALA N N 15 118.9149924 0.1044440129 . 1 . . . . A 46 ALA N . 31299 1 552 . 1 . 1 48 48 LYS H H 1 7.264568682 0.005608674253 . 1 . . . . A 47 LYS H . 31299 1 553 . 1 . 1 48 48 LYS HA H 1 4.553465308 0.00537107326 . 1 . . . . A 47 LYS HA . 31299 1 554 . 1 . 1 48 48 LYS HB2 H 1 1.800961556 0.003835212731 . 1 . . . . A 47 LYS HB2 . 31299 1 555 . 1 . 1 48 48 LYS HB3 H 1 1.729391858 0.0009616605431 . 1 . . . . A 47 LYS HB3 . 31299 1 556 . 1 . 1 48 48 LYS HG2 H 1 1.304541934 0.001366732683 . 2 . . . . A 47 LYS HG2 . 31299 1 557 . 1 . 1 48 48 LYS HG3 H 1 1.304541934 0.001366732683 . 2 . . . . A 47 LYS HG3 . 31299 1 558 . 1 . 1 48 48 LYS HD2 H 1 1.423760551 0.006004426027 . 2 . . . . A 47 LYS HD2 . 31299 1 559 . 1 . 1 48 48 LYS HD3 H 1 1.423760551 0.006004426027 . 2 . . . . A 47 LYS HD3 . 31299 1 560 . 1 . 1 48 48 LYS HE3 H 1 3.006130599 0.001781526648 . 1 . . . . A 47 LYS HE3 . 31299 1 561 . 1 . 1 48 48 LYS CA C 13 54.94702041 0.04482433611 . 1 . . . . A 47 LYS CA . 31299 1 562 . 1 . 1 48 48 LYS CB C 13 33.72916933 0.03297246437 . 1 . . . . A 47 LYS CB . 31299 1 563 . 1 . 1 48 48 LYS CG C 13 24.84733917 0.003221023886 . 1 . . . . A 47 LYS CG . 31299 1 564 . 1 . 1 48 48 LYS CD C 13 28.89354231 0.001017882213 . 1 . . . . A 47 LYS CD . 31299 1 565 . 1 . 1 48 48 LYS CE C 13 42.23674084 0.008092924485 . 1 . . . . A 47 LYS CE . 31299 1 566 . 1 . 1 48 48 LYS N N 15 117.5103963 0.007718005699 . 1 . . . . A 47 LYS N . 31299 1 567 . 1 . 1 49 49 ASP H H 1 8.341325428 0.003198941788 . 1 . . . . A 48 ASP H . 31299 1 568 . 1 . 1 49 49 ASP HA H 1 5.590836377 0.003825599515 . 1 . . . . A 48 ASP HA . 31299 1 569 . 1 . 1 49 49 ASP HB2 H 1 2.592600557 0.01019787958 . 1 . . . . A 48 ASP HB2 . 31299 1 570 . 1 . 1 49 49 ASP HB3 H 1 2.395109087 0.002559896661 . 1 . . . . A 48 ASP HB3 . 31299 1 571 . 1 . 1 49 49 ASP CA C 13 53.57300145 0.04826504026 . 1 . . . . A 48 ASP CA . 31299 1 572 . 1 . 1 49 49 ASP CB C 13 42.05416851 0.01366957988 . 1 . . . . A 48 ASP CB . 31299 1 573 . 1 . 1 49 49 ASP N N 15 122.7401232 0.0194493778 . 1 . . . . A 48 ASP N . 31299 1 574 . 1 . 1 50 50 ILE H H 1 9.407071121 0.002142433017 . 1 . . . . A 49 ILE H . 31299 1 575 . 1 . 1 50 50 ILE HA H 1 4.462500022 0.003704448933 . 1 . . . . A 49 ILE HA . 31299 1 576 . 1 . 1 50 50 ILE HB H 1 1.918070826 0.01067684895 . 1 . . . . A 49 ILE HB . 31299 1 577 . 1 . 1 50 50 ILE HG12 H 1 1.19609999 0.005972430683 . 1 . . . . A 49 ILE HG12 . 31299 1 578 . 1 . 1 50 50 ILE HG13 H 1 1.514961271 0.003546481166 . 1 . . . . A 49 ILE HG13 . 31299 1 579 . 1 . 1 50 50 ILE HG21 H 1 1.126671552 0.004275494598 . 1 . . . . A 49 ILE HG21 . 31299 1 580 . 1 . 1 50 50 ILE HG22 H 1 1.126671552 0.004275494598 . 1 . . . . A 49 ILE HG22 . 31299 1 581 . 1 . 1 50 50 ILE HG23 H 1 1.126671552 0.004275494598 . 1 . . . . A 49 ILE HG23 . 31299 1 582 . 1 . 1 50 50 ILE HD11 H 1 0.8586057623 0.009980163208 . 1 . . . . A 49 ILE HD11 . 31299 1 583 . 1 . 1 50 50 ILE HD12 H 1 0.8586057623 0.009980163208 . 1 . . . . A 49 ILE HD12 . 31299 1 584 . 1 . 1 50 50 ILE HD13 H 1 0.8586057623 0.009980163208 . 1 . . . . A 49 ILE HD13 . 31299 1 585 . 1 . 1 50 50 ILE CA C 13 60.26803673 0.1652004522 . 1 . . . . A 49 ILE CA . 31299 1 586 . 1 . 1 50 50 ILE CB C 13 41.64242762 0.04392825146 . 1 . . . . A 49 ILE CB . 31299 1 587 . 1 . 1 50 50 ILE CG1 C 13 27.22242072 0.003857354084 . 1 . . . . A 49 ILE CG1 . 31299 1 588 . 1 . 1 50 50 ILE CG2 C 13 17.76353666 0.02298697747 . 1 . . . . A 49 ILE CG2 . 31299 1 589 . 1 . 1 50 50 ILE N N 15 123.3309791 0.008712621786 . 1 . . . . A 49 ILE N . 31299 1 590 . 1 . 1 51 51 CYS H H 1 8.930306845 0.004378891217 . 1 . . . . A 50 CYS H . 31299 1 591 . 1 . 1 51 51 CYS HA H 1 5.301408785 0.006387860935 . 1 . . . . A 50 CYS HA . 31299 1 592 . 1 . 1 51 51 CYS HB2 H 1 3.608322576 0.006892008884 . 1 . . . . A 50 CYS HB2 . 31299 1 593 . 1 . 1 51 51 CYS HB3 H 1 2.816572176 0.01499321552 . 1 . . . . A 50 CYS HB3 . 31299 1 594 . 1 . 1 51 51 CYS CA C 13 57.28232195 0.03400159672 . 1 . . . . A 50 CYS CA . 31299 1 595 . 1 . 1 51 51 CYS CB C 13 45.79855544 0.02969162657 . 1 . . . . A 50 CYS CB . 31299 1 596 . 1 . 1 51 51 CYS N N 15 126.7814711 0.01333114819 . 1 . . . . A 50 CYS N . 31299 1 597 . 1 . 1 52 52 ALA H H 1 9.673745929 0.001551626359 . 1 . . . . A 51 ALA H . 31299 1 598 . 1 . 1 52 52 ALA HA H 1 4.859864941 0.007417762202 . 1 . . . . A 51 ALA HA . 31299 1 599 . 1 . 1 52 52 ALA HB1 H 1 1.362484221 0.007892253702 . 1 . . . . A 51 ALA HB1 . 31299 1 600 . 1 . 1 52 52 ALA HB2 H 1 1.362484221 0.007892253702 . 1 . . . . A 51 ALA HB2 . 31299 1 601 . 1 . 1 52 52 ALA HB3 H 1 1.362484221 0.007892253702 . 1 . . . . A 51 ALA HB3 . 31299 1 602 . 1 . 1 52 52 ALA CA C 13 51.52109134 0.01468674592 . 1 . . . . A 51 ALA CA . 31299 1 603 . 1 . 1 52 52 ALA CB C 13 24.38859781 0.06290399071 . 1 . . . . A 51 ALA CB . 31299 1 604 . 1 . 1 52 52 ALA N N 15 125.5087221 0.02906212541 . 1 . . . . A 51 ALA N . 31299 1 605 . 1 . 1 53 53 ASP H H 1 8.609544936 0.003539601167 . 1 . . . . A 52 ASP H . 31299 1 606 . 1 . 1 53 53 ASP HA H 1 4.756982464 0.007003045763 . 1 . . . . A 52 ASP HA . 31299 1 607 . 1 . 1 53 53 ASP HB2 H 1 2.932195177 0.008532581021 . 1 . . . . A 52 ASP HB2 . 31299 1 608 . 1 . 1 53 53 ASP HB3 H 1 2.516809035 0.01157558013 . 1 . . . . A 52 ASP HB3 . 31299 1 609 . 1 . 1 53 53 ASP CA C 13 50.9323856 0.06161726475 . 1 . . . . A 52 ASP CA . 31299 1 610 . 1 . 1 53 53 ASP CB C 13 43.18127294 0.08781790809 . 1 . . . . A 52 ASP CB . 31299 1 611 . 1 . 1 53 53 ASP N N 15 120.643648 0.005505857769 . 1 . . . . A 52 ASP N . 31299 1 612 . 1 . 1 54 54 PRO HA H 1 4.031014783 0.006668813441 . 1 . . . . A 53 PRO HA . 31299 1 613 . 1 . 1 54 54 PRO HB2 H 1 1.945991187 0.00258973405 . 1 . . . . A 53 PRO HB2 . 31299 1 614 . 1 . 1 54 54 PRO HB3 H 1 1.945148959 0.001301754844 . 1 . . . . A 53 PRO HB3 . 31299 1 615 . 1 . 1 54 54 PRO HG2 H 1 1.811129676 0.002438171289 . 1 . . . . A 53 PRO HG2 . 31299 1 616 . 1 . 1 54 54 PRO HG3 H 1 1.751042347 0.002444059927 . 1 . . . . A 53 PRO HG3 . 31299 1 617 . 1 . 1 54 54 PRO HD2 H 1 4.099031357 0.001128425416 . 1 . . . . A 53 PRO HD2 . 31299 1 618 . 1 . 1 54 54 PRO HD3 H 1 4.099031357 0.001128425416 . 1 . . . . A 53 PRO HD3 . 31299 1 619 . 1 . 1 54 54 PRO CA C 13 63.66123166 0.02992882359 . 1 . . . . A 53 PRO CA . 31299 1 620 . 1 . 1 54 54 PRO CB C 13 31.83030979 0.04338245115 . 1 . . . . A 53 PRO CB . 31299 1 621 . 1 . 1 54 54 PRO CG C 13 26.67319338 0.04428184295 . 1 . . . . A 53 PRO CG . 31299 1 622 . 1 . 1 54 54 PRO CD C 13 50.96505696 0.009061002213 . 1 . . . . A 53 PRO CD . 31299 1 623 . 1 . 1 55 55 LYS H H 1 8.298303445 0.003196782361 . 1 . . . . A 54 LYS H . 31299 1 624 . 1 . 1 55 55 LYS HA H 1 4.000868298 0.004324569143 . 1 . . . . A 54 LYS HA . 31299 1 625 . 1 . 1 55 55 LYS HB2 H 1 1.762023589 0.00169392709 . 1 . . . . A 54 LYS HB2 . 31299 1 626 . 1 . 1 55 55 LYS HB3 H 1 1.762155274 0.001946649914 . 1 . . . . A 54 LYS HB3 . 31299 1 627 . 1 . 1 55 55 LYS HG2 H 1 1.401491106 0.002616470223 . 2 . . . . A 54 LYS HG2 . 31299 1 628 . 1 . 1 55 55 LYS HG3 H 1 1.401491106 0.002616470223 . 2 . . . . A 54 LYS HG3 . 31299 1 629 . 1 . 1 55 55 LYS HD2 H 1 1.691974112 0.001054706256 . 1 . . . . A 54 LYS HD2 . 31299 1 630 . 1 . 1 55 55 LYS HD3 H 1 1.691775179 0.00114213975 . 1 . . . . A 54 LYS HD3 . 31299 1 631 . 1 . 1 55 55 LYS HE2 H 1 3.007811196 0.005389110957 . 1 . . . . A 54 LYS HE2 . 31299 1 632 . 1 . 1 55 55 LYS HE3 H 1 3.007586601 0.005147739443 . 1 . . . . A 54 LYS HE3 . 31299 1 633 . 1 . 1 55 55 LYS CA C 13 57.42933851 0.04443345632 . 1 . . . . A 54 LYS CA . 31299 1 634 . 1 . 1 55 55 LYS CB C 13 32.08480988 0.02296834155 . 1 . . . . A 54 LYS CB . 31299 1 635 . 1 . 1 55 55 LYS CG C 13 25.23713007 0.01123607337 . 1 . . . . A 54 LYS CG . 31299 1 636 . 1 . 1 55 55 LYS CD C 13 28.90710897 0.04735104266 . 1 . . . . A 54 LYS CD . 31299 1 637 . 1 . 1 55 55 LYS CE C 13 41.51868676 0.009760080974 . 1 . . . . A 54 LYS CE . 31299 1 638 . 1 . 1 55 55 LYS N N 15 117.4442613 0.0286153263 . 1 . . . . A 54 LYS N . 31299 1 639 . 1 . 1 56 56 LYS H H 1 7.535529756 0.009444139057 . 1 . . . . A 55 LYS H . 31299 1 640 . 1 . 1 56 56 LYS HA H 1 4.312903905 0.005331997142 . 1 . . . . A 55 LYS HA . 31299 1 641 . 1 . 1 56 56 LYS HB2 H 1 1.63955016 0.005330945649 . 1 . . . . A 55 LYS HB2 . 31299 1 642 . 1 . 1 56 56 LYS HB3 H 1 1.639515248 0.005460250412 . 1 . . . . A 55 LYS HB3 . 31299 1 643 . 1 . 1 56 56 LYS HG2 H 1 1.662591657 0.003906752424 . 1 . . . . A 55 LYS HG2 . 31299 1 644 . 1 . 1 56 56 LYS HG3 H 1 1.478222652 0.00781058602 . 1 . . . . A 55 LYS HG3 . 31299 1 645 . 1 . 1 56 56 LYS HD2 H 1 1.837089151 0.003698836902 . 1 . . . . A 55 LYS HD2 . 31299 1 646 . 1 . 1 56 56 LYS HD3 H 1 1.837314187 0.003626608453 . 1 . . . . A 55 LYS HD3 . 31299 1 647 . 1 . 1 56 56 LYS HE2 H 1 3.22434351 0.005670000959 . 1 . . . . A 55 LYS HE2 . 31299 1 648 . 1 . 1 56 56 LYS HE3 H 1 3.224027922 0.006107208578 . 1 . . . . A 55 LYS HE3 . 31299 1 649 . 1 . 1 56 56 LYS CA C 13 54.66721225 0.04218460864 . 1 . . . . A 55 LYS CA . 31299 1 650 . 1 . 1 56 56 LYS CB C 13 32.79066417 0.02722727806 . 1 . . . . A 55 LYS CB . 31299 1 651 . 1 . 1 56 56 LYS CG C 13 25.19465035 0.03585073797 . 1 . . . . A 55 LYS CG . 31299 1 652 . 1 . 1 56 56 LYS CD C 13 28.59653754 0.05534499934 . 1 . . . . A 55 LYS CD . 31299 1 653 . 1 . 1 56 56 LYS CE C 13 42.55835423 0.01849811828 . 1 . . . . A 55 LYS CE . 31299 1 654 . 1 . 1 56 56 LYS N N 15 118.5026644 0.01872277585 . 1 . . . . A 55 LYS N . 31299 1 655 . 1 . 1 57 57 LYS H H 1 8.885919216 0.004853708464 . 1 . . . . A 56 LYS H . 31299 1 656 . 1 . 1 57 57 LYS HA H 1 3.851066256 0.006258187897 . 1 . . . . A 56 LYS HA . 31299 1 657 . 1 . 1 57 57 LYS HB2 H 1 2.030937829 0.00485347886 . 1 . . . . A 56 LYS HB2 . 31299 1 658 . 1 . 1 57 57 LYS HB3 H 1 1.95395547 0.002334345128 . 1 . . . . A 56 LYS HB3 . 31299 1 659 . 1 . 1 57 57 LYS HG2 H 1 1.474131805 0.007560226333 . 1 . . . . A 56 LYS HG2 . 31299 1 660 . 1 . 1 57 57 LYS HG3 H 1 1.471077407 0.008660520566 . 1 . . . . A 56 LYS HG3 . 31299 1 661 . 1 . 1 57 57 LYS HD2 H 1 1.781049308 0.00527382249 . 1 . . . . A 56 LYS HD2 . 31299 1 662 . 1 . 1 57 57 LYS HD3 H 1 1.659220844 0.001602602944 . 1 . . . . A 56 LYS HD3 . 31299 1 663 . 1 . 1 57 57 LYS HE2 H 1 3.074459647 0.005131476797 . 1 . . . . A 56 LYS HE2 . 31299 1 664 . 1 . 1 57 57 LYS HE3 H 1 3.074258509 0.005022783044 . 1 . . . . A 56 LYS HE3 . 31299 1 665 . 1 . 1 57 57 LYS CA C 13 59.9515986 0.02357431291 . 1 . . . . A 56 LYS CA . 31299 1 666 . 1 . 1 57 57 LYS CB C 13 31.82317424 0.01948310915 . 1 . . . . A 56 LYS CB . 31299 1 667 . 1 . 1 57 57 LYS CG C 13 24.77038363 0.001910496082 . 1 . . . . A 56 LYS CG . 31299 1 668 . 1 . 1 57 57 LYS CD C 13 28.75244423 0.01666239685 . 1 . . . . A 56 LYS CD . 31299 1 669 . 1 . 1 57 57 LYS CE C 13 42.30742166 0.06188100912 . 1 . . . . A 56 LYS CE . 31299 1 670 . 1 . 1 57 57 LYS N N 15 126.8233929 0.005008142561 . 1 . . . . A 56 LYS N . 31299 1 671 . 1 . 1 58 58 TRP H H 1 8.582330375 0.005466369356 . 1 . . . . A 57 TRP H . 31299 1 672 . 1 . 1 58 58 TRP HA H 1 4.557958078 0.00480067808 . 1 . . . . A 57 TRP HA . 31299 1 673 . 1 . 1 58 58 TRP HB2 H 1 3.456528643 0.005623600198 . 1 . . . . A 57 TRP HB2 . 31299 1 674 . 1 . 1 58 58 TRP HB3 H 1 3.285231005 0.004876831238 . 1 . . . . A 57 TRP HB3 . 31299 1 675 . 1 . 1 58 58 TRP HD1 H 1 7.669879294 0.01258492726 . 1 . . . . A 57 TRP HD1 . 31299 1 676 . 1 . 1 58 58 TRP HE1 H 1 10.29882271 0.001062961093 . 1 . . . . A 57 TRP HE1 . 31299 1 677 . 1 . 1 58 58 TRP HE3 H 1 7.240272733 0.01049670126 . 1 . . . . A 57 TRP HE3 . 31299 1 678 . 1 . 1 58 58 TRP HZ2 H 1 7.212995567 0.002125816165 . 1 . . . . A 57 TRP HZ2 . 31299 1 679 . 1 . 1 58 58 TRP HZ3 H 1 6.453218165 . . 1 . . . . A 57 TRP HZ3 . 31299 1 680 . 1 . 1 58 58 TRP HH2 H 1 6.789659467 0.008958305252 . 1 . . . . A 57 TRP HH2 . 31299 1 681 . 1 . 1 58 58 TRP CA C 13 59.57103908 0.06763416088 . 1 . . . . A 57 TRP CA . 31299 1 682 . 1 . 1 58 58 TRP CB C 13 27.00245662 0.05847907094 . 1 . . . . A 57 TRP CB . 31299 1 683 . 1 . 1 58 58 TRP CD1 C 13 128.5397353 0.02724031219 . 1 . . . . A 57 TRP CD1 . 31299 1 684 . 1 . 1 58 58 TRP CE3 C 13 121.201692 0.08120176605 . 1 . . . . A 57 TRP CE3 . 31299 1 685 . 1 . 1 58 58 TRP CZ2 C 13 115.7067808 0.01411554132 . 1 . . . . A 57 TRP CZ2 . 31299 1 686 . 1 . 1 58 58 TRP CZ3 C 13 120.6724443 . . 1 . . . . A 57 TRP CZ3 . 31299 1 687 . 1 . 1 58 58 TRP CH2 C 13 124.0875722 0.001656936054 . 1 . . . . A 57 TRP CH2 . 31299 1 688 . 1 . 1 58 58 TRP N N 15 115.1725341 0.003734157302 . 1 . . . . A 57 TRP N . 31299 1 689 . 1 . 1 59 59 VAL H H 1 6.236288667 0.003060259847 . 1 . . . . A 58 VAL H . 31299 1 690 . 1 . 1 59 59 VAL HA H 1 2.911356328 0.007729285669 . 1 . . . . A 58 VAL HA . 31299 1 691 . 1 . 1 59 59 VAL HB H 1 1.960760571 0.006052361579 . 1 . . . . A 58 VAL HB . 31299 1 692 . 1 . 1 59 59 VAL HG11 H 1 0.4973593353 0.007615485814 . 1 . . . . A 58 VAL HG11 . 31299 1 693 . 1 . 1 59 59 VAL HG12 H 1 0.4973593353 0.007615485814 . 1 . . . . A 58 VAL HG12 . 31299 1 694 . 1 . 1 59 59 VAL HG13 H 1 0.4973593353 0.007615485814 . 1 . . . . A 58 VAL HG13 . 31299 1 695 . 1 . 1 59 59 VAL HG21 H 1 -0.6125780443 0.00648236865 . 1 . . . . A 58 VAL HG21 . 31299 1 696 . 1 . 1 59 59 VAL HG22 H 1 -0.6125780443 0.00648236865 . 1 . . . . A 58 VAL HG22 . 31299 1 697 . 1 . 1 59 59 VAL HG23 H 1 -0.6125780443 0.00648236865 . 1 . . . . A 58 VAL HG23 . 31299 1 698 . 1 . 1 59 59 VAL CA C 13 66.01202293 0.05489054838 . 1 . . . . A 58 VAL CA . 31299 1 699 . 1 . 1 59 59 VAL CB C 13 31.03234033 0.01499019469 . 1 . . . . A 58 VAL CB . 31299 1 700 . 1 . 1 59 59 VAL CG1 C 13 21.16234581 0.1719931876 . 1 . . . . A 58 VAL CG1 . 31299 1 701 . 1 . 1 59 59 VAL CG2 C 13 21.51344332 0.1225906587 . 1 . . . . A 58 VAL CG2 . 31299 1 702 . 1 . 1 59 59 VAL N N 15 126.5582935 0.01934027606 . 1 . . . . A 58 VAL N . 31299 1 703 . 1 . 1 60 60 GLN H H 1 7.471478385 0.004070174236 . 1 . . . . A 59 GLN H . 31299 1 704 . 1 . 1 60 60 GLN HA H 1 3.908668437 0.01003818148 . 1 . . . . A 59 GLN HA . 31299 1 705 . 1 . 1 60 60 GLN HB2 H 1 2.116304702 0.004557068518 . 1 . . . . A 59 GLN HB2 . 31299 1 706 . 1 . 1 60 60 GLN HB3 H 1 2.116351904 0.004128501403 . 1 . . . . A 59 GLN HB3 . 31299 1 707 . 1 . 1 60 60 GLN HG2 H 1 2.412576434 0.007467740706 . 1 . . . . A 59 GLN HG2 . 31299 1 708 . 1 . 1 60 60 GLN HG3 H 1 2.320027214 0.001505393062 . 1 . . . . A 59 GLN HG3 . 31299 1 709 . 1 . 1 60 60 GLN HE21 H 1 7.453050256 0.0001196874328 . 1 . . . . A 59 GLN HE21 . 31299 1 710 . 1 . 1 60 60 GLN HE22 H 1 6.658600235 0.0001789217862 . 1 . . . . A 59 GLN HE22 . 31299 1 711 . 1 . 1 60 60 GLN CA C 13 59.20246743 0.01975853915 . 1 . . . . A 59 GLN CA . 31299 1 712 . 1 . 1 60 60 GLN CB C 13 27.75769722 0.03869665859 . 1 . . . . A 59 GLN CB . 31299 1 713 . 1 . 1 60 60 GLN CG C 13 33.26835764 0.03754292974 . 1 . . . . A 59 GLN CG . 31299 1 714 . 1 . 1 60 60 GLN N N 15 120.4344655 0.0124024012 . 1 . . . . A 59 GLN N . 31299 1 715 . 1 . 1 60 60 GLN NE2 N 15 111.2065429 0.01259710654 . 1 . . . . A 59 GLN NE2 . 31299 1 716 . 1 . 1 61 61 ASP H H 1 9.007079166 0.004222444477 . 1 . . . . A 60 ASP H . 31299 1 717 . 1 . 1 61 61 ASP HA H 1 4.368844377 0.004448972349 . 1 . . . . A 60 ASP HA . 31299 1 718 . 1 . 1 61 61 ASP HB2 H 1 2.687223632 0.002323029214 . 1 . . . . A 60 ASP HB2 . 31299 1 719 . 1 . 1 61 61 ASP HB3 H 1 2.781030157 0.004062812427 . 1 . . . . A 60 ASP HB3 . 31299 1 720 . 1 . 1 61 61 ASP CA C 13 57.39706217 0.01917111703 . 1 . . . . A 60 ASP CA . 31299 1 721 . 1 . 1 61 61 ASP CB C 13 39.9292014 0.005967871889 . 1 . . . . A 60 ASP CB . 31299 1 722 . 1 . 1 61 61 ASP N N 15 120.0364435 0.005739299986 . 1 . . . . A 60 ASP N . 31299 1 723 . 1 . 1 62 62 SER H H 1 7.986345048 0.002711987786 . 1 . . . . A 61 SER H . 31299 1 724 . 1 . 1 62 62 SER HA H 1 4.21345883 0.008513718646 . 1 . . . . A 61 SER HA . 31299 1 725 . 1 . 1 62 62 SER HB2 H 1 3.48715668 0.005438646477 . 1 . . . . A 61 SER HB2 . 31299 1 726 . 1 . 1 62 62 SER HB3 H 1 3.48715668 0.005438646477 . 1 . . . . A 61 SER HB3 . 31299 1 727 . 1 . 1 62 62 SER CA C 13 63.08719833 0.1566056996 . 1 . . . . A 61 SER CA . 31299 1 728 . 1 . 1 62 62 SER CB C 13 63.46568837 0.04676795355 . 1 . . . . A 61 SER CB . 31299 1 729 . 1 . 1 62 62 SER N N 15 118.6459577 0.008197851323 . 1 . . . . A 61 SER N . 31299 1 730 . 1 . 1 63 63 MET H H 1 8.108304784 0.007469278937 . 1 . . . . A 62 MET H . 31299 1 731 . 1 . 1 63 63 MET HA H 1 3.620809155 0.006821558238 . 1 . . . . A 62 MET HA . 31299 1 732 . 1 . 1 63 63 MET HB2 H 1 1.650790639 0.002864434565 . 1 . . . . A 62 MET HB2 . 31299 1 733 . 1 . 1 63 63 MET HB3 H 1 2.013775904 0.003375645163 . 1 . . . . A 62 MET HB3 . 31299 1 734 . 1 . 1 63 63 MET HG2 H 1 2.234421777 0.01057935415 . 1 . . . . A 62 MET HG2 . 31299 1 735 . 1 . 1 63 63 MET HG3 H 1 0.449492486 0.01418092569 . 1 . . . . A 62 MET HG3 . 31299 1 736 . 1 . 1 63 63 MET CA C 13 60.32730464 0.07099429074 . 1 . . . . A 62 MET CA . 31299 1 737 . 1 . 1 63 63 MET CB C 13 34.09182848 0.01223055074 . 1 . . . . A 62 MET CB . 31299 1 738 . 1 . 1 63 63 MET CG C 13 30.54199713 0.0369040263 . 1 . . . . A 62 MET CG . 31299 1 739 . 1 . 1 63 63 MET N N 15 121.0352094 0.01234639323 . 1 . . . . A 62 MET N . 31299 1 740 . 1 . 1 64 64 LYS H H 1 7.613773695 0.003880779604 . 1 . . . . A 63 LYS H . 31299 1 741 . 1 . 1 64 64 LYS HA H 1 4.073516763 0.004977049741 . 1 . . . . A 63 LYS HA . 31299 1 742 . 1 . 1 64 64 LYS HB2 H 1 1.924329555 0.003297861067 . 1 . . . . A 63 LYS HB2 . 31299 1 743 . 1 . 1 64 64 LYS HB3 H 1 1.924188504 0.003257429427 . 1 . . . . A 63 LYS HB3 . 31299 1 744 . 1 . 1 64 64 LYS HG2 H 1 1.613485406 0.004000537833 . 1 . . . . A 63 LYS HG2 . 31299 1 745 . 1 . 1 64 64 LYS HG3 H 1 1.464529365 0.002795866335 . 1 . . . . A 63 LYS HG3 . 31299 1 746 . 1 . 1 64 64 LYS HD2 H 1 1.728135231 0.005981764524 . 1 . . . . A 63 LYS HD2 . 31299 1 747 . 1 . 1 64 64 LYS HD3 H 1 1.728096497 0.005977217576 . 1 . . . . A 63 LYS HD3 . 31299 1 748 . 1 . 1 64 64 LYS HE2 H 1 2.985708646 0.003386880415 . 1 . . . . A 63 LYS HE2 . 31299 1 749 . 1 . 1 64 64 LYS HE3 H 1 2.985522901 0.003135339622 . 1 . . . . A 63 LYS HE3 . 31299 1 750 . 1 . 1 64 64 LYS CA C 13 59.67711784 0.02128888135 . 1 . . . . A 63 LYS CA . 31299 1 751 . 1 . 1 64 64 LYS CB C 13 32.22983252 0.016468242 . 1 . . . . A 63 LYS CB . 31299 1 752 . 1 . 1 64 64 LYS CG C 13 25.06913801 0.01008325626 . 1 . . . . A 63 LYS CG . 31299 1 753 . 1 . 1 64 64 LYS CD C 13 29.28026281 0.002888434149 . 1 . . . . A 63 LYS CD . 31299 1 754 . 1 . 1 64 64 LYS CE C 13 42.10394978 0.0009742049215 . 1 . . . . A 63 LYS CE . 31299 1 755 . 1 . 1 64 64 LYS N N 15 117.2587705 0.0155222171 . 1 . . . . A 63 LYS N . 31299 1 756 . 1 . 1 65 65 TYR H H 1 7.802713212 0.001790538892 . 1 . . . . A 64 TYR H . 31299 1 757 . 1 . 1 65 65 TYR HA H 1 4.259094765 0.006093723032 . 1 . . . . A 64 TYR HA . 31299 1 758 . 1 . 1 65 65 TYR HB2 H 1 3.212775022 0.006615760614 . 1 . . . . A 64 TYR HB2 . 31299 1 759 . 1 . 1 65 65 TYR HB3 H 1 3.215108258 0.00618844188 . 1 . . . . A 64 TYR HB3 . 31299 1 760 . 1 . 1 65 65 TYR HD1 H 1 7.050353565 0.00914402414 . 1 . . . . A 64 TYR HD1 . 31299 1 761 . 1 . 1 65 65 TYR HD2 H 1 7.050353565 0.00914402414 . 1 . . . . A 64 TYR HD2 . 31299 1 762 . 1 . 1 65 65 TYR HE1 H 1 6.809071101 0.007701250197 . 1 . . . . A 64 TYR HE1 . 31299 1 763 . 1 . 1 65 65 TYR HE2 H 1 6.809677033 0.00848812873 . 1 . . . . A 64 TYR HE2 . 31299 1 764 . 1 . 1 65 65 TYR CA C 13 60.95419585 0.06815923592 . 1 . . . . A 64 TYR CA . 31299 1 765 . 1 . 1 65 65 TYR CB C 13 38.6141906 0.01110471935 . 1 . . . . A 64 TYR CB . 31299 1 766 . 1 . 1 65 65 TYR CD1 C 13 133.6810723 0.01268035209 . 1 . . . . A 64 TYR CD1 . 31299 1 767 . 1 . 1 65 65 TYR CD2 C 13 133.6810723 0.01268035238 . 1 . . . . A 64 TYR CD2 . 31299 1 768 . 1 . 1 65 65 TYR CE1 C 13 118.3131025 0.04092873705 . 1 . . . . A 64 TYR CE1 . 31299 1 769 . 1 . 1 65 65 TYR CE2 C 13 118.3126419 0.03999542209 . 1 . . . . A 64 TYR CE2 . 31299 1 770 . 1 . 1 65 65 TYR N N 15 118.9851798 0.005051885518 . 1 . . . . A 64 TYR N . 31299 1 771 . 1 . 1 66 66 LEU H H 1 8.132549514 0.002745747295 . 1 . . . . A 65 LEU H . 31299 1 772 . 1 . 1 66 66 LEU HA H 1 3.981594421 0.007100060172 . 1 . . . . A 65 LEU HA . 31299 1 773 . 1 . 1 66 66 LEU HB2 H 1 2.268146315 0.005369894068 . 1 . . . . A 65 LEU HB2 . 31299 1 774 . 1 . 1 66 66 LEU HB3 H 1 1.743705773 0.009128629695 . 1 . . . . A 65 LEU HB3 . 31299 1 775 . 1 . 1 66 66 LEU HD11 H 1 1.160687837 0.01032695583 . 1 . . . . A 65 LEU HD11 . 31299 1 776 . 1 . 1 66 66 LEU HD12 H 1 1.160687837 0.01032695583 . 1 . . . . A 65 LEU HD12 . 31299 1 777 . 1 . 1 66 66 LEU HD13 H 1 1.160687837 0.01032695583 . 1 . . . . A 65 LEU HD13 . 31299 1 778 . 1 . 1 66 66 LEU HD21 H 1 0.8819280856 0.009512152986 . 1 . . . . A 65 LEU HD21 . 31299 1 779 . 1 . 1 66 66 LEU HD22 H 1 0.8819280856 0.009512152986 . 1 . . . . A 65 LEU HD22 . 31299 1 780 . 1 . 1 66 66 LEU HD23 H 1 0.8819280856 0.009512152986 . 1 . . . . A 65 LEU HD23 . 31299 1 781 . 1 . 1 66 66 LEU CA C 13 57.53903369 0.01613961769 . 1 . . . . A 65 LEU CA . 31299 1 782 . 1 . 1 66 66 LEU CB C 13 41.73989289 0.05107198511 . 1 . . . . A 65 LEU CB . 31299 1 783 . 1 . 1 66 66 LEU CG C 13 27.0799937 . . 1 . . . . A 65 LEU CG . 31299 1 784 . 1 . 1 66 66 LEU CD1 C 13 24.45707397 . . 1 . . . . A 65 LEU CD1 . 31299 1 785 . 1 . 1 66 66 LEU CD2 C 13 22.42570517 . . 1 . . . . A 65 LEU CD2 . 31299 1 786 . 1 . 1 66 66 LEU N N 15 120.0615823 0.03061909136 . 1 . . . . A 65 LEU N . 31299 1 787 . 1 . 1 67 67 ASP H H 1 8.768515688 0.004076862071 . 1 . . . . A 66 ASP H . 31299 1 788 . 1 . 1 67 67 ASP HA H 1 4.543590032 0.004945055996 . 1 . . . . A 66 ASP HA . 31299 1 789 . 1 . 1 67 67 ASP HB2 H 1 2.934356212 0.004942356429 . 1 . . . . A 66 ASP HB2 . 31299 1 790 . 1 . 1 67 67 ASP HB3 H 1 2.757027476 0.002512875548 . 1 . . . . A 66 ASP HB3 . 31299 1 791 . 1 . 1 67 67 ASP CA C 13 56.89760078 0.07859099538 . 1 . . . . A 66 ASP CA . 31299 1 792 . 1 . 1 67 67 ASP CB C 13 40.33606713 0.01707216075 . 1 . . . . A 66 ASP CB . 31299 1 793 . 1 . 1 67 67 ASP N N 15 120.7811106 0.007894963208 . 1 . . . . A 66 ASP N . 31299 1 794 . 1 . 1 68 68 GLN H H 1 7.576134897 0.002957315404 . 1 . . . . A 67 GLN H . 31299 1 795 . 1 . 1 68 68 GLN HA H 1 4.235152467 0.002778426501 . 1 . . . . A 67 GLN HA . 31299 1 796 . 1 . 1 68 68 GLN HB2 H 1 2.120304769 0.004437008925 . 1 . . . . A 67 GLN HB2 . 31299 1 797 . 1 . 1 68 68 GLN HB3 H 1 2.119224873 0.004721171972 . 1 . . . . A 67 GLN HB3 . 31299 1 798 . 1 . 1 68 68 GLN HG2 H 1 2.589467638 0.003143803653 . 1 . . . . A 67 GLN HG2 . 31299 1 799 . 1 . 1 68 68 GLN HG3 H 1 2.407852412 0.007004800753 . 1 . . . . A 67 GLN HG3 . 31299 1 800 . 1 . 1 68 68 GLN HE21 H 1 7.397562843 0.0004860946655 . 2 . . . . A 67 GLN HE21 . 31299 1 801 . 1 . 1 68 68 GLN HE22 H 1 6.81939147 0.000230783027 . 2 . . . . A 67 GLN HE22 . 31299 1 802 . 1 . 1 68 68 GLN CA C 13 56.82364463 0.0783620545 . 1 . . . . A 67 GLN CA . 31299 1 803 . 1 . 1 68 68 GLN CB C 13 28.92318007 0.006934969608 . 1 . . . . A 67 GLN CB . 31299 1 804 . 1 . 1 68 68 GLN CG C 13 34.19799715 0.0279700466 . 1 . . . . A 67 GLN CG . 31299 1 805 . 1 . 1 68 68 GLN N N 15 116.9703778 0.01574410141 . 1 . . . . A 67 GLN N . 31299 1 806 . 1 . 1 68 68 GLN NE2 N 15 111.6118487 0.007265399021 . 1 . . . . A 67 GLN NE2 . 31299 1 807 . 1 . 1 69 69 LYS H H 1 7.553874446 0.002734076823 . 1 . . . . A 68 LYS H . 31299 1 808 . 1 . 1 69 69 LYS HA H 1 4.200505275 0.005200630658 . 1 . . . . A 68 LYS HA . 31299 1 809 . 1 . 1 69 69 LYS HB2 H 1 1.788950886 0.006472450647 . 1 . . . . A 68 LYS HB2 . 31299 1 810 . 1 . 1 69 69 LYS HB3 H 1 1.686060439 0.0050121102 . 1 . . . . A 68 LYS HB3 . 31299 1 811 . 1 . 1 69 69 LYS HG2 H 1 1.361394995 0.003295251983 . 2 . . . . A 68 LYS HG2 . 31299 1 812 . 1 . 1 69 69 LYS HG3 H 1 1.361394995 0.003295251983 . 2 . . . . A 68 LYS HG3 . 31299 1 813 . 1 . 1 69 69 LYS HD2 H 1 1.613478346 0.002299546292 . 1 . . . . A 68 LYS HD2 . 31299 1 814 . 1 . 1 69 69 LYS HD3 H 1 1.613201994 0.002233931787 . 1 . . . . A 68 LYS HD3 . 31299 1 815 . 1 . 1 69 69 LYS HE2 H 1 2.957656654 0.003129498929 . 1 . . . . A 68 LYS HE2 . 31299 1 816 . 1 . 1 69 69 LYS HE3 H 1 2.957156813 0.002950957107 . 1 . . . . A 68 LYS HE3 . 31299 1 817 . 1 . 1 69 69 LYS CA C 13 56.57563857 0.001110342124 . 1 . . . . A 68 LYS CA . 31299 1 818 . 1 . 1 69 69 LYS CB C 13 32.73769812 0.02931659007 . 1 . . . . A 68 LYS CB . 31299 1 819 . 1 . 1 69 69 LYS CG C 13 24.36749912 0.001660726617 . 1 . . . . A 68 LYS CG . 31299 1 820 . 1 . 1 69 69 LYS CD C 13 29.0633102 0.04878063446 . 1 . . . . A 68 LYS CD . 31299 1 821 . 1 . 1 69 69 LYS CE C 13 42.10117933 0.002674303102 . 1 . . . . A 68 LYS CE . 31299 1 822 . 1 . 1 69 69 LYS N N 15 119.6582141 0.01131160677 . 1 . . . . A 68 LYS N . 31299 1 823 . 1 . 1 70 70 SER H H 1 7.994529914 0.004143197445 . 1 . . . . A 69 SER H . 31299 1 824 . 1 . 1 70 70 SER HA H 1 4.756277865 0.005172139014 . 1 . . . . A 69 SER HA . 31299 1 825 . 1 . 1 70 70 SER HB2 H 1 3.913871655 0.0009184718222 . 1 . . . . A 69 SER HB2 . 31299 1 826 . 1 . 1 70 70 SER HB3 H 1 3.856010561 0.001241983139 . 1 . . . . A 69 SER HB3 . 31299 1 827 . 1 . 1 70 70 SER CA C 13 56.40832777 0.001618558394 . 1 . . . . A 69 SER CA . 31299 1 828 . 1 . 1 70 70 SER CB C 13 63.48690042 0.05734150864 . 1 . . . . A 69 SER CB . 31299 1 829 . 1 . 1 70 70 SER N N 15 117.2117964 0.005681223047 . 1 . . . . A 69 SER N . 31299 1 stop_ save_