################################### # 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 51255 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name larp1 _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 0.006 _Assigned_chem_shift_list.Chem_shift_13C_err 0.09 _Assigned_chem_shift_list.Chem_shift_15N_err 0.05 _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 'compare shifts of automatically picked peaks from different data sets' _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 2 '2D 1H-15N HSQC' . . . 51255 1 3 '3D CBCACONH' . . . 51255 1 4 '3D HNCACB' . . . 51255 1 5 '3D HNCO' . . . 51255 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $software_3 . . 51255 1 4 $software_4 . . 51255 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 10 10 HIS C C 13 175.7545 0.0000 . 1 . . . . . 10 HIS C . 51255 1 2 . 1 . 1 11 11 SER H H 1 8.4388 0.0000 . 1 . . . . . 11 SER H . 51255 1 3 . 1 . 1 11 11 SER CB C 13 63.5521 0.0000 . 1 . . . . . 11 SER CB . 51255 1 4 . 1 . 1 11 11 SER N N 15 116.5107 0.0000 . 1 . . . . . 11 SER N . 51255 1 5 . 1 . 1 12 12 GLN H H 1 8.7869 0.0000 . 1 . . . . . 12 GLN H . 51255 1 6 . 1 . 1 12 12 GLN C C 13 177.3314 0.0000 . 1 . . . . . 12 GLN C . 51255 1 7 . 1 . 1 12 12 GLN CA C 13 58.1025 0.0000 . 1 . . . . . 12 GLN CA . 51255 1 8 . 1 . 1 12 12 GLN CB C 13 29.0703 0.0000 . 1 . . . . . 12 GLN CB . 51255 1 9 . 1 . 1 12 12 GLN N N 15 122.7818 0.0000 . 1 . . . . . 12 GLN N . 51255 1 10 . 1 . 1 13 13 GLU H H 1 8.3065 0.0000 . 1 . . . . . 13 GLU H . 51255 1 11 . 1 . 1 13 13 GLU C C 13 178.6504 0.0000 . 1 . . . . . 13 GLU C . 51255 1 12 . 1 . 1 13 13 GLU CA C 13 59.3454 0.0000 . 1 . . . . . 13 GLU CA . 51255 1 13 . 1 . 1 13 13 GLU CB C 13 29.3019 0.0000 . 1 . . . . . 13 GLU CB . 51255 1 14 . 1 . 1 13 13 GLU N N 15 119.2501 0.0000 . 1 . . . . . 13 GLU N . 51255 1 15 . 1 . 1 14 14 LEU H H 1 7.8491 0.0000 . 1 . . . . . 14 LEU H . 51255 1 16 . 1 . 1 14 14 LEU C C 13 178.3745 0.0000 . 1 . . . . . 14 LEU C . 51255 1 17 . 1 . 1 14 14 LEU CA C 13 57.1672 0.0000 . 1 . . . . . 14 LEU CA . 51255 1 18 . 1 . 1 14 14 LEU CB C 13 41.7287 0.0000 . 1 . . . . . 14 LEU CB . 51255 1 19 . 1 . 1 14 14 LEU N N 15 120.8658 0.0000 . 1 . . . . . 14 LEU N . 51255 1 20 . 1 . 1 15 15 LEU H H 1 7.8667 0.0000 . 1 . . . . . 15 LEU H . 51255 1 21 . 1 . 1 15 15 LEU C C 13 178.8616 0.0000 . 1 . . . . . 15 LEU C . 51255 1 22 . 1 . 1 15 15 LEU CA C 13 58.2269 0.0000 . 1 . . . . . 15 LEU CA . 51255 1 23 . 1 . 1 15 15 LEU CB C 13 41.8060 0.0000 . 1 . . . . . 15 LEU CB . 51255 1 24 . 1 . 1 15 15 LEU N N 15 119.6604 0.0000 . 1 . . . . . 15 LEU N . 51255 1 25 . 1 . 1 16 16 LYS H H 1 8.1937 0.0000 . 1 . . . . . 16 LYS H . 51255 1 26 . 1 . 1 16 16 LYS C C 13 177.9141 0.0000 . 1 . . . . . 16 LYS C . 51255 1 27 . 1 . 1 16 16 LYS CA C 13 61.0968 0.0000 . 1 . . . . . 16 LYS CA . 51255 1 28 . 1 . 1 16 16 LYS CB C 13 32.2247 0.0000 . 1 . . . . . 16 LYS CB . 51255 1 29 . 1 . 1 16 16 LYS N N 15 116.4552 0.0000 . 1 . . . . . 16 LYS N . 51255 1 30 . 1 . 1 17 17 ASP H H 1 7.6439 0.0000 . 1 . . . . . 17 ASP H . 51255 1 31 . 1 . 1 17 17 ASP C C 13 178.4862 0.0000 . 1 . . . . . 17 ASP C . 51255 1 32 . 1 . 1 17 17 ASP CA C 13 58.0399 0.0000 . 1 . . . . . 17 ASP CA . 51255 1 33 . 1 . 1 17 17 ASP CB C 13 41.3289 0.0000 . 1 . . . . . 17 ASP CB . 51255 1 34 . 1 . 1 17 17 ASP N N 15 118.9511 0.0000 . 1 . . . . . 17 ASP N . 51255 1 35 . 1 . 1 18 18 TYR H H 1 8.2695 0.0000 . 1 . . . . . 18 TYR H . 51255 1 36 . 1 . 1 18 18 TYR C C 13 179.5292 0.0000 . 1 . . . . . 18 TYR C . 51255 1 37 . 1 . 1 18 18 TYR CA C 13 60.2914 0.0000 . 1 . . . . . 18 TYR CA . 51255 1 38 . 1 . 1 18 18 TYR CB C 13 37.6635 0.0000 . 1 . . . . . 18 TYR CB . 51255 1 39 . 1 . 1 18 18 TYR N N 15 119.2970 0.0000 . 1 . . . . . 18 TYR N . 51255 1 40 . 1 . 1 19 19 ILE H H 1 8.7813 0.0000 . 1 . . . . . 19 ILE H . 51255 1 41 . 1 . 1 19 19 ILE C C 13 177.0104 0.0000 . 1 . . . . . 19 ILE C . 51255 1 42 . 1 . 1 19 19 ILE CA C 13 65.9097 0.0000 . 1 . . . . . 19 ILE CA . 51255 1 43 . 1 . 1 19 19 ILE CB C 13 38.5880 0.0000 . 1 . . . . . 19 ILE CB . 51255 1 44 . 1 . 1 19 19 ILE N N 15 120.4573 0.0000 . 1 . . . . . 19 ILE N . 51255 1 45 . 1 . 1 20 20 LYS H H 1 8.4535 0.0000 . 1 . . . . . 20 LYS H . 51255 1 46 . 1 . 1 20 20 LYS C C 13 177.9308 0.0000 . 1 . . . . . 20 LYS C . 51255 1 47 . 1 . 1 20 20 LYS CA C 13 60.5671 0.0000 . 1 . . . . . 20 LYS CA . 51255 1 48 . 1 . 1 20 20 LYS CB C 13 32.1192 0.0000 . 1 . . . . . 20 LYS CB . 51255 1 49 . 1 . 1 20 20 LYS N N 15 119.5163 0.0000 . 1 . . . . . 20 LYS N . 51255 1 50 . 1 . 1 21 21 ARG H H 1 8.3285 0.0000 . 1 . . . . . 21 ARG H . 51255 1 51 . 1 . 1 21 21 ARG C C 13 179.6276 0.0000 . 1 . . . . . 21 ARG C . 51255 1 52 . 1 . 1 21 21 ARG CA C 13 59.5817 0.0000 . 1 . . . . . 21 ARG CA . 51255 1 53 . 1 . 1 21 21 ARG CB C 13 30.2320 0.0000 . 1 . . . . . 21 ARG CB . 51255 1 54 . 1 . 1 21 21 ARG N N 15 116.0977 0.0000 . 1 . . . . . 21 ARG N . 51255 1 55 . 1 . 1 22 22 GLN H H 1 8.0767 0.0000 . 1 . . . . . 22 GLN H . 51255 1 56 . 1 . 1 22 22 GLN C C 13 177.4600 0.0000 . 1 . . . . . 22 GLN C . 51255 1 57 . 1 . 1 22 22 GLN CA C 13 57.7704 0.0000 . 1 . . . . . 22 GLN CA . 51255 1 58 . 1 . 1 22 22 GLN CB C 13 28.6253 0.0000 . 1 . . . . . 22 GLN CB . 51255 1 59 . 1 . 1 22 22 GLN N N 15 118.3296 0.0000 . 1 . . . . . 22 GLN N . 51255 1 60 . 1 . 1 23 23 ILE H H 1 8.2895 0.0000 . 1 . . . . . 23 ILE H . 51255 1 61 . 1 . 1 23 23 ILE C C 13 178.3644 0.0000 . 1 . . . . . 23 ILE C . 51255 1 62 . 1 . 1 23 23 ILE CA C 13 65.5224 0.0000 . 1 . . . . . 23 ILE CA . 51255 1 63 . 1 . 1 23 23 ILE CB C 13 37.3259 0.0000 . 1 . . . . . 23 ILE CB . 51255 1 64 . 1 . 1 23 23 ILE N N 15 117.4913 0.0000 . 1 . . . . . 23 ILE N . 51255 1 65 . 1 . 1 24 24 GLU H H 1 9.0202 0.0000 . 1 . . . . . 24 GLU H . 51255 1 66 . 1 . 1 24 24 GLU C C 13 179.4322 0.0000 . 1 . . . . . 24 GLU C . 51255 1 67 . 1 . 1 24 24 GLU CA C 13 60.6703 0.0000 . 1 . . . . . 24 GLU CA . 51255 1 68 . 1 . 1 24 24 GLU CB C 13 29.0575 0.0000 . 1 . . . . . 24 GLU CB . 51255 1 69 . 1 . 1 24 24 GLU N N 15 117.6657 0.0000 . 1 . . . . . 24 GLU N . 51255 1 70 . 1 . 1 25 25 TYR H H 1 7.6453 0.0000 . 1 . . . . . 25 TYR H . 51255 1 71 . 1 . 1 25 25 TYR C C 13 178.7897 0.0000 . 1 . . . . . 25 TYR C . 51255 1 72 . 1 . 1 25 25 TYR CA C 13 62.0679 0.0000 . 1 . . . . . 25 TYR CA . 51255 1 73 . 1 . 1 25 25 TYR CB C 13 37.3960 0.0000 . 1 . . . . . 25 TYR CB . 51255 1 74 . 1 . 1 25 25 TYR N N 15 118.4721 0.0000 . 1 . . . . . 25 TYR N . 51255 1 75 . 1 . 1 26 26 TYR H H 1 7.3977 0.0000 . 1 . . . . . 26 TYR H . 51255 1 76 . 1 . 1 26 26 TYR C C 13 171.5007 0.0000 . 1 . . . . . 26 TYR C . 51255 1 77 . 1 . 1 26 26 TYR CA C 13 60.1219 0.0000 . 1 . . . . . 26 TYR CA . 51255 1 78 . 1 . 1 26 26 TYR CB C 13 37.0387 0.0000 . 1 . . . . . 26 TYR CB . 51255 1 79 . 1 . 1 26 26 TYR N N 15 117.5408 0.0000 . 1 . . . . . 26 TYR N . 51255 1 80 . 1 . 1 27 27 PHE H H 1 7.0858 0.0000 . 1 . . . . . 27 PHE H . 51255 1 81 . 1 . 1 27 27 PHE C C 13 173.2457 0.0000 . 1 . . . . . 27 PHE C . 51255 1 82 . 1 . 1 27 27 PHE CA C 13 57.8617 0.0000 . 1 . . . . . 27 PHE CA . 51255 1 83 . 1 . 1 27 27 PHE CB C 13 39.6336 0.0000 . 1 . . . . . 27 PHE CB . 51255 1 84 . 1 . 1 27 27 PHE N N 15 110.5035 0.0000 . 1 . . . . . 27 PHE N . 51255 1 85 . 1 . 1 28 28 SER H H 1 7.3756 0.0000 . 1 . . . . . 28 SER H . 51255 1 86 . 1 . 1 28 28 SER C C 13 174.2571 0.0000 . 1 . . . . . 28 SER C . 51255 1 87 . 1 . 1 28 28 SER CA C 13 57.7306 0.0000 . 1 . . . . . 28 SER CA . 51255 1 88 . 1 . 1 28 28 SER CB C 13 64.6009 0.0000 . 1 . . . . . 28 SER CB . 51255 1 89 . 1 . 1 28 28 SER N N 15 116.3059 0.0000 . 1 . . . . . 28 SER N . 51255 1 90 . 1 . 1 29 29 VAL H H 1 8.8043 0.0000 . 1 . . . . . 29 VAL H . 51255 1 91 . 1 . 1 29 29 VAL C C 13 176.8713 0.0000 . 1 . . . . . 29 VAL C . 51255 1 92 . 1 . 1 29 29 VAL CA C 13 67.1214 0.0000 . 1 . . . . . 29 VAL CA . 51255 1 93 . 1 . 1 29 29 VAL CB C 13 31.3062 0.0000 . 1 . . . . . 29 VAL CB . 51255 1 94 . 1 . 1 29 29 VAL N N 15 122.9050 0.0000 . 1 . . . . . 29 VAL N . 51255 1 95 . 1 . 1 30 30 ASP H H 1 7.9302 0.0000 . 1 . . . . . 30 ASP H . 51255 1 96 . 1 . 1 30 30 ASP C C 13 178.0295 0.0000 . 1 . . . . . 30 ASP C . 51255 1 97 . 1 . 1 30 30 ASP CA C 13 57.0064 0.0000 . 1 . . . . . 30 ASP CA . 51255 1 98 . 1 . 1 30 30 ASP CB C 13 40.9326 0.0000 . 1 . . . . . 30 ASP CB . 51255 1 99 . 1 . 1 30 30 ASP N N 15 115.0313 0.0000 . 1 . . . . . 30 ASP N . 51255 1 100 . 1 . 1 31 31 ASN H H 1 7.2903 0.0000 . 1 . . . . . 31 ASN H . 51255 1 101 . 1 . 1 31 31 ASN C C 13 177.4567 0.0000 . 1 . . . . . 31 ASN C . 51255 1 102 . 1 . 1 31 31 ASN CA C 13 56.7970 0.0000 . 1 . . . . . 31 ASN CA . 51255 1 103 . 1 . 1 31 31 ASN CB C 13 40.5876 0.0000 . 1 . . . . . 31 ASN CB . 51255 1 104 . 1 . 1 31 31 ASN N N 15 113.3713 0.0000 . 1 . . . . . 31 ASN N . 51255 1 105 . 1 . 1 32 32 LEU H H 1 8.4764 0.0000 . 1 . . . . . 32 LEU H . 51255 1 106 . 1 . 1 32 32 LEU C C 13 177.9185 0.0000 . 1 . . . . . 32 LEU C . 51255 1 107 . 1 . 1 32 32 LEU CA C 13 58.0067 0.0000 . 1 . . . . . 32 LEU CA . 51255 1 108 . 1 . 1 32 32 LEU CB C 13 40.1988 0.0000 . 1 . . . . . 32 LEU CB . 51255 1 109 . 1 . 1 32 32 LEU N N 15 119.0132 0.0000 . 1 . . . . . 32 LEU N . 51255 1 110 . 1 . 1 33 33 GLU H H 1 8.0988 0.0000 . 1 . . . . . 33 GLU H . 51255 1 111 . 1 . 1 33 33 GLU C C 13 176.9536 0.0000 . 1 . . . . . 33 GLU C . 51255 1 112 . 1 . 1 33 33 GLU CA C 13 59.3635 0.0000 . 1 . . . . . 33 GLU CA . 51255 1 113 . 1 . 1 33 33 GLU CB C 13 30.0841 0.0000 . 1 . . . . . 33 GLU CB . 51255 1 114 . 1 . 1 33 33 GLU N N 15 114.6294 0.0000 . 1 . . . . . 33 GLU N . 51255 1 115 . 1 . 1 34 34 ARG H H 1 7.1204 0.0000 . 1 . . . . . 34 ARG H . 51255 1 116 . 1 . 1 34 34 ARG C C 13 175.6010 0.0000 . 1 . . . . . 34 ARG C . 51255 1 117 . 1 . 1 34 34 ARG CA C 13 54.8675 0.0000 . 1 . . . . . 34 ARG CA . 51255 1 118 . 1 . 1 34 34 ARG CB C 13 32.0512 0.0000 . 1 . . . . . 34 ARG CB . 51255 1 119 . 1 . 1 34 34 ARG N N 15 112.1752 0.0000 . 1 . . . . . 34 ARG N . 51255 1 120 . 1 . 1 35 35 ASP H H 1 7.7295 0.0000 . 1 . . . . . 35 ASP H . 51255 1 121 . 1 . 1 35 35 ASP C C 13 175.4931 0.0000 . 1 . . . . . 35 ASP C . 51255 1 122 . 1 . 1 35 35 ASP CA C 13 52.5854 0.0000 . 1 . . . . . 35 ASP CA . 51255 1 123 . 1 . 1 35 35 ASP CB C 13 38.6765 0.0000 . 1 . . . . . 35 ASP CB . 51255 1 124 . 1 . 1 35 35 ASP N N 15 122.6746 0.0000 . 1 . . . . . 35 ASP N . 51255 1 125 . 1 . 1 36 36 PHE H H 1 7.7337 0.0000 . 1 . . . . . 36 PHE H . 51255 1 126 . 1 . 1 36 36 PHE C C 13 177.3091 0.0000 . 1 . . . . . 36 PHE C . 51255 1 127 . 1 . 1 36 36 PHE CA C 13 59.6220 0.0000 . 1 . . . . . 36 PHE CA . 51255 1 128 . 1 . 1 36 36 PHE CB C 13 37.9064 0.0000 . 1 . . . . . 36 PHE CB . 51255 1 129 . 1 . 1 36 36 PHE N N 15 123.0077 0.0000 . 1 . . . . . 36 PHE N . 51255 1 130 . 1 . 1 37 37 PHE H H 1 8.3184 0.0000 . 1 . . . . . 37 PHE H . 51255 1 131 . 1 . 1 37 37 PHE C C 13 177.3285 0.0000 . 1 . . . . . 37 PHE C . 51255 1 132 . 1 . 1 37 37 PHE CA C 13 61.1942 0.0000 . 1 . . . . . 37 PHE CA . 51255 1 133 . 1 . 1 37 37 PHE CB C 13 38.8381 0.0000 . 1 . . . . . 37 PHE CB . 51255 1 134 . 1 . 1 37 37 PHE N N 15 118.6685 0.0000 . 1 . . . . . 37 PHE N . 51255 1 135 . 1 . 1 38 38 LEU H H 1 7.7934 0.0000 . 1 . . . . . 38 LEU H . 51255 1 136 . 1 . 1 38 38 LEU C C 13 179.5754 0.0000 . 1 . . . . . 38 LEU C . 51255 1 137 . 1 . 1 38 38 LEU CA C 13 57.6192 0.0000 . 1 . . . . . 38 LEU CA . 51255 1 138 . 1 . 1 38 38 LEU CB C 13 43.0112 0.0000 . 1 . . . . . 38 LEU CB . 51255 1 139 . 1 . 1 38 38 LEU N N 15 119.1819 0.0000 . 1 . . . . . 38 LEU N . 51255 1 140 . 1 . 1 39 39 ARG H H 1 7.4910 0.0000 . 1 . . . . . 39 ARG H . 51255 1 141 . 1 . 1 39 39 ARG C C 13 179.7983 0.0000 . 1 . . . . . 39 ARG C . 51255 1 142 . 1 . 1 39 39 ARG CA C 13 59.0155 0.0000 . 1 . . . . . 39 ARG CA . 51255 1 143 . 1 . 1 39 39 ARG CB C 13 31.5126 0.0000 . 1 . . . . . 39 ARG CB . 51255 1 144 . 1 . 1 39 39 ARG N N 15 115.4990 0.0000 . 1 . . . . . 39 ARG N . 51255 1 145 . 1 . 1 40 40 ARG H H 1 7.9816 0.0000 . 1 . . . . . 40 ARG H . 51255 1 146 . 1 . 1 40 40 ARG C C 13 177.4589 0.0000 . 1 . . . . . 40 ARG C . 51255 1 147 . 1 . 1 40 40 ARG CA C 13 57.6756 0.0000 . 1 . . . . . 40 ARG CA . 51255 1 148 . 1 . 1 40 40 ARG CB C 13 30.6295 0.0000 . 1 . . . . . 40 ARG CB . 51255 1 149 . 1 . 1 40 40 ARG N N 15 118.3900 0.0000 . 1 . . . . . 40 ARG N . 51255 1 150 . 1 . 1 41 41 LYS H H 1 7.2514 0.0000 . 1 . . . . . 41 LYS H . 51255 1 151 . 1 . 1 41 41 LYS C C 13 176.5948 0.0000 . 1 . . . . . 41 LYS C . 51255 1 152 . 1 . 1 41 41 LYS CA C 13 55.0639 0.0000 . 1 . . . . . 41 LYS CA . 51255 1 153 . 1 . 1 41 41 LYS CB C 13 32.8712 0.0000 . 1 . . . . . 41 LYS CB . 51255 1 154 . 1 . 1 41 41 LYS N N 15 116.4794 0.0000 . 1 . . . . . 41 LYS N . 51255 1 155 . 1 . 1 42 42 MET H H 1 6.9969 0.0000 . 1 . . . . . 42 MET H . 51255 1 156 . 1 . 1 42 42 MET C C 13 176.9070 0.0000 . 1 . . . . . 42 MET C . 51255 1 157 . 1 . 1 42 42 MET CA C 13 56.6275 0.0000 . 1 . . . . . 42 MET CA . 51255 1 158 . 1 . 1 42 42 MET CB C 13 34.4585 0.0000 . 1 . . . . . 42 MET CB . 51255 1 159 . 1 . 1 42 42 MET N N 15 118.9866 0.0000 . 1 . . . . . 42 MET N . 51255 1 160 . 1 . 1 43 43 ASP H H 1 8.3452 0.0000 . 1 . . . . . 43 ASP H . 51255 1 161 . 1 . 1 43 43 ASP C C 13 177.5342 0.0000 . 1 . . . . . 43 ASP C . 51255 1 162 . 1 . 1 43 43 ASP CA C 13 52.5673 0.0000 . 1 . . . . . 43 ASP CA . 51255 1 163 . 1 . 1 43 43 ASP CB C 13 40.9984 0.0000 . 1 . . . . . 43 ASP CB . 51255 1 164 . 1 . 1 43 43 ASP N N 15 120.5154 0.0000 . 1 . . . . . 43 ASP N . 51255 1 165 . 1 . 1 44 44 ALA H H 1 8.2816 0.0000 . 1 . . . . . 44 ALA H . 51255 1 166 . 1 . 1 44 44 ALA C C 13 178.8541 0.0000 . 1 . . . . . 44 ALA C . 51255 1 167 . 1 . 1 44 44 ALA CA C 13 54.9993 0.0000 . 1 . . . . . 44 ALA CA . 51255 1 168 . 1 . 1 44 44 ALA CB C 13 18.6965 0.0000 . 1 . . . . . 44 ALA CB . 51255 1 169 . 1 . 1 44 44 ALA N N 15 117.5987 0.0000 . 1 . . . . . 44 ALA N . 51255 1 170 . 1 . 1 45 45 ASP H H 1 8.0264 0.0000 . 1 . . . . . 45 ASP H . 51255 1 171 . 1 . 1 45 45 ASP C C 13 175.2971 0.0000 . 1 . . . . . 45 ASP C . 51255 1 172 . 1 . 1 45 45 ASP CA C 13 54.1630 0.0000 . 1 . . . . . 45 ASP CA . 51255 1 173 . 1 . 1 45 45 ASP CB C 13 42.6673 0.0000 . 1 . . . . . 45 ASP CB . 51255 1 174 . 1 . 1 45 45 ASP N N 15 114.9952 0.0000 . 1 . . . . . 45 ASP N . 51255 1 175 . 1 . 1 46 46 GLY H H 1 8.3690 0.0000 . 1 . . . . . 46 GLY H . 51255 1 176 . 1 . 1 46 46 GLY C C 13 173.7969 0.0000 . 1 . . . . . 46 GLY C . 51255 1 177 . 1 . 1 46 46 GLY CA C 13 45.1954 0.0000 . 1 . . . . . 46 GLY CA . 51255 1 178 . 1 . 1 46 46 GLY N N 15 105.9296 0.0000 . 1 . . . . . 46 GLY N . 51255 1 179 . 1 . 1 47 47 PHE H H 1 8.3996 0.0000 . 1 . . . . . 47 PHE H . 51255 1 180 . 1 . 1 47 47 PHE C C 13 177.4400 0.0000 . 1 . . . . . 47 PHE C . 51255 1 181 . 1 . 1 47 47 PHE CA C 13 59.2988 0.0000 . 1 . . . . . 47 PHE CA . 51255 1 182 . 1 . 1 47 47 PHE CB C 13 40.7426 0.0000 . 1 . . . . . 47 PHE CB . 51255 1 183 . 1 . 1 47 47 PHE N N 15 117.4062 0.0000 . 1 . . . . . 47 PHE N . 51255 1 184 . 1 . 1 48 48 LEU H H 1 9.2375 0.0000 . 1 . . . . . 48 LEU H . 51255 1 185 . 1 . 1 48 48 LEU CA C 13 52.1142 0.0000 . 1 . . . . . 48 LEU CA . 51255 1 186 . 1 . 1 48 48 LEU CB C 13 45.2425 0.0000 . 1 . . . . . 48 LEU CB . 51255 1 187 . 1 . 1 48 48 LEU N N 15 118.4063 0.0000 . 1 . . . . . 48 LEU N . 51255 1 188 . 1 . 1 49 49 PRO C C 13 179.0587 0.0000 . 1 . . . . . 49 PRO C . 51255 1 189 . 1 . 1 49 49 PRO CA C 13 62.9675 0.0000 . 1 . . . . . 49 PRO CA . 51255 1 190 . 1 . 1 49 49 PRO CB C 13 31.9016 0.0000 . 1 . . . . . 49 PRO CB . 51255 1 191 . 1 . 1 50 50 ILE H H 1 8.8218 0.0000 . 1 . . . . . 50 ILE H . 51255 1 192 . 1 . 1 50 50 ILE C C 13 176.5119 0.0000 . 1 . . . . . 50 ILE C . 51255 1 193 . 1 . 1 50 50 ILE CA C 13 63.8217 0.0000 . 1 . . . . . 50 ILE CA . 51255 1 194 . 1 . 1 50 50 ILE CB C 13 37.6452 0.0000 . 1 . . . . . 50 ILE CB . 51255 1 195 . 1 . 1 50 50 ILE N N 15 126.1948 0.0000 . 1 . . . . . 50 ILE N . 51255 1 196 . 1 . 1 51 51 THR H H 1 8.1552 0.0000 . 1 . . . . . 51 THR H . 51255 1 197 . 1 . 1 51 51 THR C C 13 176.7307 0.0000 . 1 . . . . . 51 THR C . 51255 1 198 . 1 . 1 51 51 THR CA C 13 64.7001 0.0000 . 1 . . . . . 51 THR CA . 51255 1 199 . 1 . 1 51 51 THR CB C 13 68.1665 0.0000 . 1 . . . . . 51 THR CB . 51255 1 200 . 1 . 1 51 51 THR N N 15 110.0772 0.0000 . 1 . . . . . 51 THR N . 51255 1 201 . 1 . 1 52 52 LEU H H 1 7.1098 0.0000 . 1 . . . . . 52 LEU H . 51255 1 202 . 1 . 1 52 52 LEU C C 13 178.7712 0.0000 . 1 . . . . . 52 LEU C . 51255 1 203 . 1 . 1 52 52 LEU CA C 13 57.5142 0.0000 . 1 . . . . . 52 LEU CA . 51255 1 204 . 1 . 1 52 52 LEU CB C 13 41.9412 0.0000 . 1 . . . . . 52 LEU CB . 51255 1 205 . 1 . 1 52 52 LEU N N 15 121.9748 0.0000 . 1 . . . . . 52 LEU N . 51255 1 206 . 1 . 1 53 53 ILE H H 1 6.6294 0.0000 . 1 . . . . . 53 ILE H . 51255 1 207 . 1 . 1 53 53 ILE C C 13 176.6978 0.0000 . 1 . . . . . 53 ILE C . 51255 1 208 . 1 . 1 53 53 ILE CA C 13 61.7189 0.0000 . 1 . . . . . 53 ILE CA . 51255 1 209 . 1 . 1 53 53 ILE CB C 13 36.8302 0.0000 . 1 . . . . . 53 ILE CB . 51255 1 210 . 1 . 1 53 53 ILE N N 15 118.6750 0.0000 . 1 . . . . . 53 ILE N . 51255 1 211 . 1 . 1 54 54 ALA H H 1 8.1743 0.0000 . 1 . . . . . 54 ALA H . 51255 1 212 . 1 . 1 54 54 ALA C C 13 177.0093 0.0000 . 1 . . . . . 54 ALA C . 51255 1 213 . 1 . 1 54 54 ALA CA C 13 53.6289 0.0000 . 1 . . . . . 54 ALA CA . 51255 1 214 . 1 . 1 54 54 ALA CB C 13 18.5880 0.0000 . 1 . . . . . 54 ALA CB . 51255 1 215 . 1 . 1 54 54 ALA N N 15 117.1220 0.0000 . 1 . . . . . 54 ALA N . 51255 1 216 . 1 . 1 55 55 SER H H 1 7.1210 0.0000 . 1 . . . . . 55 SER H . 51255 1 217 . 1 . 1 55 55 SER C C 13 175.0270 0.0000 . 1 . . . . . 55 SER C . 51255 1 218 . 1 . 1 55 55 SER CA C 13 58.9370 0.0000 . 1 . . . . . 55 SER CA . 51255 1 219 . 1 . 1 55 55 SER CB C 13 64.5801 0.0000 . 1 . . . . . 55 SER CB . 51255 1 220 . 1 . 1 55 55 SER N N 15 109.1620 0.0000 . 1 . . . . . 55 SER N . 51255 1 221 . 1 . 1 56 56 PHE H H 1 7.5005 0.0000 . 1 . . . . . 56 PHE H . 51255 1 222 . 1 . 1 56 56 PHE CA C 13 55.1677 0.0000 . 1 . . . . . 56 PHE CA . 51255 1 223 . 1 . 1 56 56 PHE CB C 13 36.7222 0.0000 . 1 . . . . . 56 PHE CB . 51255 1 224 . 1 . 1 56 56 PHE N N 15 123.4177 0.0000 . 1 . . . . . 56 PHE N . 51255 1 225 . 1 . 1 57 57 HIS C C 13 177.5504 0.0000 . 1 . . . . . 57 HIS C . 51255 1 226 . 1 . 1 57 57 HIS CA C 13 60.4697 0.0000 . 1 . . . . . 57 HIS CA . 51255 1 227 . 1 . 1 57 57 HIS CB C 13 29.7890 0.0000 . 1 . . . . . 57 HIS CB . 51255 1 228 . 1 . 1 58 58 ARG H H 1 8.4696 0.0000 . 1 . . . . . 58 ARG H . 51255 1 229 . 1 . 1 58 58 ARG C C 13 177.5161 0.0000 . 1 . . . . . 58 ARG C . 51255 1 230 . 1 . 1 58 58 ARG CA C 13 58.7839 0.0000 . 1 . . . . . 58 ARG CA . 51255 1 231 . 1 . 1 58 58 ARG CB C 13 30.1227 0.0000 . 1 . . . . . 58 ARG CB . 51255 1 232 . 1 . 1 58 58 ARG N N 15 114.4862 0.0000 . 1 . . . . . 58 ARG N . 51255 1 233 . 1 . 1 59 59 VAL H H 1 7.3106 0.0000 . 1 . . . . . 59 VAL H . 51255 1 234 . 1 . 1 59 59 VAL C C 13 177.2701 0.0000 . 1 . . . . . 59 VAL C . 51255 1 235 . 1 . 1 59 59 VAL CA C 13 65.9420 0.0000 . 1 . . . . . 59 VAL CA . 51255 1 236 . 1 . 1 59 59 VAL CB C 13 31.6303 0.0000 . 1 . . . . . 59 VAL CB . 51255 1 237 . 1 . 1 59 59 VAL N N 15 116.6537 0.0000 . 1 . . . . . 59 VAL N . 51255 1 238 . 1 . 1 60 60 GLN H H 1 8.4093 0.0000 . 1 . . . . . 60 GLN H . 51255 1 239 . 1 . 1 60 60 GLN C C 13 176.8207 0.0000 . 1 . . . . . 60 GLN C . 51255 1 240 . 1 . 1 60 60 GLN CA C 13 58.4175 0.0000 . 1 . . . . . 60 GLN CA . 51255 1 241 . 1 . 1 60 60 GLN CB C 13 28.7504 0.0000 . 1 . . . . . 60 GLN CB . 51255 1 242 . 1 . 1 60 60 GLN N N 15 119.7216 0.0000 . 1 . . . . . 60 GLN N . 51255 1 243 . 1 . 1 61 61 ALA H H 1 7.5151 0.0000 . 1 . . . . . 61 ALA H . 51255 1 244 . 1 . 1 61 61 ALA C C 13 178.4684 0.0000 . 1 . . . . . 61 ALA C . 51255 1 245 . 1 . 1 61 61 ALA CA C 13 53.7699 0.0000 . 1 . . . . . 61 ALA CA . 51255 1 246 . 1 . 1 61 61 ALA CB C 13 18.5343 0.0000 . 1 . . . . . 61 ALA CB . 51255 1 247 . 1 . 1 61 61 ALA N N 15 116.4105 0.0000 . 1 . . . . . 61 ALA N . 51255 1 248 . 1 . 1 62 62 LEU H H 1 7.6385 0.0000 . 1 . . . . . 62 LEU H . 51255 1 249 . 1 . 1 62 62 LEU C C 13 176.6853 0.0000 . 1 . . . . . 62 LEU C . 51255 1 250 . 1 . 1 62 62 LEU CA C 13 56.0146 0.0000 . 1 . . . . . 62 LEU CA . 51255 1 251 . 1 . 1 62 62 LEU CB C 13 43.1471 0.0000 . 1 . . . . . 62 LEU CB . 51255 1 252 . 1 . 1 62 62 LEU N N 15 116.7696 0.0000 . 1 . . . . . 62 LEU N . 51255 1 253 . 1 . 1 63 63 THR H H 1 8.1554 0.0000 . 1 . . . . . 63 THR H . 51255 1 254 . 1 . 1 63 63 THR C C 13 170.9388 0.0000 . 1 . . . . . 63 THR C . 51255 1 255 . 1 . 1 63 63 THR CA C 13 62.0932 0.0000 . 1 . . . . . 63 THR CA . 51255 1 256 . 1 . 1 63 63 THR CB C 13 68.2764 0.0000 . 1 . . . . . 63 THR CB . 51255 1 257 . 1 . 1 63 63 THR N N 15 111.1949 0.0000 . 1 . . . . . 63 THR N . 51255 1 258 . 1 . 1 64 64 THR H H 1 8.0550 0.0000 . 1 . . . . . 64 THR H . 51255 1 259 . 1 . 1 64 64 THR C C 13 173.9824 0.0000 . 1 . . . . . 64 THR C . 51255 1 260 . 1 . 1 64 64 THR CA C 13 60.8116 0.0000 . 1 . . . . . 64 THR CA . 51255 1 261 . 1 . 1 64 64 THR CB C 13 68.9000 0.0000 . 1 . . . . . 64 THR CB . 51255 1 262 . 1 . 1 64 64 THR N N 15 113.3034 0.0000 . 1 . . . . . 64 THR N . 51255 1 263 . 1 . 1 65 65 ASP H H 1 8.9253 0.0000 . 1 . . . . . 65 ASP H . 51255 1 264 . 1 . 1 65 65 ASP C C 13 176.2963 0.0000 . 1 . . . . . 65 ASP C . 51255 1 265 . 1 . 1 65 65 ASP CA C 13 52.9356 0.0000 . 1 . . . . . 65 ASP CA . 51255 1 266 . 1 . 1 65 65 ASP CB C 13 40.9349 0.0000 . 1 . . . . . 65 ASP CB . 51255 1 267 . 1 . 1 65 65 ASP N N 15 125.8188 0.0000 . 1 . . . . . 65 ASP N . 51255 1 268 . 1 . 1 66 66 ILE H H 1 8.5927 0.0000 . 1 . . . . . 66 ILE H . 51255 1 269 . 1 . 1 66 66 ILE C C 13 177.2919 0.0000 . 1 . . . . . 66 ILE C . 51255 1 270 . 1 . 1 66 66 ILE CA C 13 63.2759 0.0000 . 1 . . . . . 66 ILE CA . 51255 1 271 . 1 . 1 66 66 ILE CB C 13 37.5204 0.0000 . 1 . . . . . 66 ILE CB . 51255 1 272 . 1 . 1 66 66 ILE N N 15 126.8127 0.0000 . 1 . . . . . 66 ILE N . 51255 1 273 . 1 . 1 67 67 SER H H 1 8.2858 0.0000 . 1 . . . . . 67 SER H . 51255 1 274 . 1 . 1 67 67 SER C C 13 177.5779 0.0000 . 1 . . . . . 67 SER C . 51255 1 275 . 1 . 1 67 67 SER CA C 13 62.3836 0.0000 . 1 . . . . . 67 SER CA . 51255 1 276 . 1 . 1 67 67 SER N N 15 117.0948 0.0000 . 1 . . . . . 67 SER N . 51255 1 277 . 1 . 1 68 68 LEU H H 1 7.4725 0.0000 . 1 . . . . . 68 LEU H . 51255 1 278 . 1 . 1 68 68 LEU C C 13 178.4806 0.0000 . 1 . . . . . 68 LEU C . 51255 1 279 . 1 . 1 68 68 LEU CA C 13 56.9571 0.0000 . 1 . . . . . 68 LEU CA . 51255 1 280 . 1 . 1 68 68 LEU CB C 13 41.7568 0.0000 . 1 . . . . . 68 LEU CB . 51255 1 281 . 1 . 1 68 68 LEU N N 15 125.9321 0.0000 . 1 . . . . . 68 LEU N . 51255 1 282 . 1 . 1 69 69 ILE H H 1 7.4183 0.0000 . 1 . . . . . 69 ILE H . 51255 1 283 . 1 . 1 69 69 ILE C C 13 177.5334 0.0000 . 1 . . . . . 69 ILE C . 51255 1 284 . 1 . 1 69 69 ILE CA C 13 66.1367 0.0000 . 1 . . . . . 69 ILE CA . 51255 1 285 . 1 . 1 69 69 ILE CB C 13 36.9217 0.0000 . 1 . . . . . 69 ILE CB . 51255 1 286 . 1 . 1 69 69 ILE N N 15 119.6171 0.0000 . 1 . . . . . 69 ILE N . 51255 1 287 . 1 . 1 70 70 PHE H H 1 8.0340 0.0000 . 1 . . . . . 70 PHE H . 51255 1 288 . 1 . 1 70 70 PHE C C 13 179.0315 0.0000 . 1 . . . . . 70 PHE C . 51255 1 289 . 1 . 1 70 70 PHE CA C 13 62.1970 0.0000 . 1 . . . . . 70 PHE CA . 51255 1 290 . 1 . 1 70 70 PHE CB C 13 38.9455 0.0000 . 1 . . . . . 70 PHE CB . 51255 1 291 . 1 . 1 70 70 PHE N N 15 116.0422 0.0000 . 1 . . . . . 70 PHE N . 51255 1 292 . 1 . 1 71 71 ALA H H 1 7.8369 0.0000 . 1 . . . . . 71 ALA H . 51255 1 293 . 1 . 1 71 71 ALA C C 13 180.5294 0.0000 . 1 . . . . . 71 ALA C . 51255 1 294 . 1 . 1 71 71 ALA CA C 13 55.1717 0.0000 . 1 . . . . . 71 ALA CA . 51255 1 295 . 1 . 1 71 71 ALA CB C 13 18.5141 0.0000 . 1 . . . . . 71 ALA CB . 51255 1 296 . 1 . 1 71 71 ALA N N 15 119.5717 0.0000 . 1 . . . . . 71 ALA N . 51255 1 297 . 1 . 1 72 72 ALA H H 1 8.5053 0.0000 . 1 . . . . . 72 ALA H . 51255 1 298 . 1 . 1 72 72 ALA C C 13 178.5562 0.0000 . 1 . . . . . 72 ALA C . 51255 1 299 . 1 . 1 72 72 ALA CA C 13 54.4746 0.0000 . 1 . . . . . 72 ALA CA . 51255 1 300 . 1 . 1 72 72 ALA CB C 13 19.3623 0.0000 . 1 . . . . . 72 ALA CB . 51255 1 301 . 1 . 1 72 72 ALA N N 15 119.7765 0.0000 . 1 . . . . . 72 ALA N . 51255 1 302 . 1 . 1 73 73 LEU H H 1 7.4312 0.0000 . 1 . . . . . 73 LEU H . 51255 1 303 . 1 . 1 73 73 LEU C C 13 177.9741 0.0000 . 1 . . . . . 73 LEU C . 51255 1 304 . 1 . 1 73 73 LEU CA C 13 54.3576 0.0000 . 1 . . . . . 73 LEU CA . 51255 1 305 . 1 . 1 73 73 LEU CB C 13 42.6972 0.0000 . 1 . . . . . 73 LEU CB . 51255 1 306 . 1 . 1 73 73 LEU N N 15 112.2270 0.0000 . 1 . . . . . 73 LEU N . 51255 1 307 . 1 . 1 74 74 LYS H H 1 7.4326 0.0000 . 1 . . . . . 74 LYS H . 51255 1 308 . 1 . 1 74 74 LYS C C 13 176.4905 0.0000 . 1 . . . . . 74 LYS C . 51255 1 309 . 1 . 1 74 74 LYS CA C 13 59.5139 0.0000 . 1 . . . . . 74 LYS CA . 51255 1 310 . 1 . 1 74 74 LYS CB C 13 32.6489 0.0000 . 1 . . . . . 74 LYS CB . 51255 1 311 . 1 . 1 74 74 LYS N N 15 121.4477 0.0000 . 1 . . . . . 74 LYS N . 51255 1 312 . 1 . 1 75 75 ASP H H 1 8.1056 0.0000 . 1 . . . . . 75 ASP H . 51255 1 313 . 1 . 1 75 75 ASP C C 13 176.4487 0.0000 . 1 . . . . . 75 ASP C . 51255 1 314 . 1 . 1 75 75 ASP CA C 13 53.3002 0.0000 . 1 . . . . . 75 ASP CA . 51255 1 315 . 1 . 1 75 75 ASP CB C 13 40.6693 0.0000 . 1 . . . . . 75 ASP CB . 51255 1 316 . 1 . 1 75 75 ASP N N 15 115.8154 0.0000 . 1 . . . . . 75 ASP N . 51255 1 317 . 1 . 1 76 76 SER H H 1 7.5554 0.0000 . 1 . . . . . 76 SER H . 51255 1 318 . 1 . 1 76 76 SER C C 13 176.3442 0.0000 . 1 . . . . . 76 SER C . 51255 1 319 . 1 . 1 76 76 SER CA C 13 59.0735 0.0000 . 1 . . . . . 76 SER CA . 51255 1 320 . 1 . 1 76 76 SER CB C 13 64.1525 0.0000 . 1 . . . . . 76 SER CB . 51255 1 321 . 1 . 1 76 76 SER N N 15 112.8888 0.0000 . 1 . . . . . 76 SER N . 51255 1 322 . 1 . 1 77 77 LYS H H 1 9.5844 0.0000 . 1 . . . . . 77 LYS H . 51255 1 323 . 1 . 1 77 77 LYS C C 13 176.6213 0.0000 . 1 . . . . . 77 LYS C . 51255 1 324 . 1 . 1 77 77 LYS CA C 13 56.4281 0.0000 . 1 . . . . . 77 LYS CA . 51255 1 325 . 1 . 1 77 77 LYS CB C 13 32.4985 0.0000 . 1 . . . . . 77 LYS CB . 51255 1 326 . 1 . 1 77 77 LYS N N 15 126.8139 0.0000 . 1 . . . . . 77 LYS N . 51255 1 327 . 1 . 1 78 78 VAL H H 1 8.3634 0.0000 . 1 . . . . . 78 VAL H . 51255 1 328 . 1 . 1 78 78 VAL C C 13 176.5338 0.0000 . 1 . . . . . 78 VAL C . 51255 1 329 . 1 . 1 78 78 VAL CA C 13 64.3514 0.0000 . 1 . . . . . 78 VAL CA . 51255 1 330 . 1 . 1 78 78 VAL CB C 13 35.2316 0.0000 . 1 . . . . . 78 VAL CB . 51255 1 331 . 1 . 1 78 78 VAL N N 15 119.3149 0.0000 . 1 . . . . . 78 VAL N . 51255 1 332 . 1 . 1 79 79 VAL H H 1 7.7498 0.0000 . 1 . . . . . 79 VAL H . 51255 1 333 . 1 . 1 79 79 VAL C C 13 173.6041 0.0000 . 1 . . . . . 79 VAL C . 51255 1 334 . 1 . 1 79 79 VAL CA C 13 58.5834 0.0000 . 1 . . . . . 79 VAL CA . 51255 1 335 . 1 . 1 79 79 VAL CB C 13 34.4965 0.0000 . 1 . . . . . 79 VAL CB . 51255 1 336 . 1 . 1 79 79 VAL N N 15 112.1212 0.0000 . 1 . . . . . 79 VAL N . 51255 1 337 . 1 . 1 80 80 GLU H H 1 8.9570 0.0000 . 1 . . . . . 80 GLU H . 51255 1 338 . 1 . 1 80 80 GLU C C 13 173.6066 0.0000 . 1 . . . . . 80 GLU C . 51255 1 339 . 1 . 1 80 80 GLU CA C 13 53.8218 0.0000 . 1 . . . . . 80 GLU CA . 51255 1 340 . 1 . 1 80 80 GLU CB C 13 33.3477 0.0000 . 1 . . . . . 80 GLU CB . 51255 1 341 . 1 . 1 80 80 GLU N N 15 120.7668 0.0000 . 1 . . . . . 80 GLU N . 51255 1 342 . 1 . 1 81 81 ILE H H 1 8.5027 0.0000 . 1 . . . . . 81 ILE H . 51255 1 343 . 1 . 1 81 81 ILE C C 13 176.6165 0.0000 . 1 . . . . . 81 ILE C . 51255 1 344 . 1 . 1 81 81 ILE CA C 13 59.3768 0.0000 . 1 . . . . . 81 ILE CA . 51255 1 345 . 1 . 1 81 81 ILE CB C 13 39.7758 0.0000 . 1 . . . . . 81 ILE CB . 51255 1 346 . 1 . 1 81 81 ILE N N 15 123.0886 0.0000 . 1 . . . . . 81 ILE N . 51255 1 347 . 1 . 1 82 82 VAL H H 1 8.6768 0.0000 . 1 . . . . . 82 VAL H . 51255 1 348 . 1 . 1 82 82 VAL C C 13 175.0823 0.0000 . 1 . . . . . 82 VAL C . 51255 1 349 . 1 . 1 82 82 VAL CA C 13 61.9597 0.0000 . 1 . . . . . 82 VAL CA . 51255 1 350 . 1 . 1 82 82 VAL CB C 13 34.4117 0.0000 . 1 . . . . . 82 VAL CB . 51255 1 351 . 1 . 1 82 82 VAL N N 15 128.5260 0.0000 . 1 . . . . . 82 VAL N . 51255 1 352 . 1 . 1 83 83 ASP H H 1 9.0737 0.0000 . 1 . . . . . 83 ASP H . 51255 1 353 . 1 . 1 83 83 ASP CA C 13 56.4081 0.0000 . 1 . . . . . 83 ASP CA . 51255 1 354 . 1 . 1 83 83 ASP CB C 13 39.3066 0.0000 . 1 . . . . . 83 ASP CB . 51255 1 355 . 1 . 1 83 83 ASP N N 15 126.8234 0.0000 . 1 . . . . . 83 ASP N . 51255 1 356 . 1 . 1 84 84 GLU C C 13 174.8049 0.0000 . 1 . . . . . 84 GLU C . 51255 1 357 . 1 . 1 84 84 GLU CA C 13 56.42 0.0000 . 1 . . . . . 84 GLU CA . 51255 1 358 . 1 . 1 84 84 GLU CB C 13 28.4541 0.0000 . 1 . . . . . 84 GLU CB . 51255 1 359 . 1 . 1 85 85 LYS H H 1 8.3230 0.0000 . 1 . . . . . 85 LYS H . 51255 1 360 . 1 . 1 85 85 LYS C C 13 173.8639 0.0000 . 1 . . . . . 85 LYS C . 51255 1 361 . 1 . 1 85 85 LYS CA C 13 55.1634 0.0000 . 1 . . . . . 85 LYS CA . 51255 1 362 . 1 . 1 85 85 LYS CB C 13 35.5811 0.0000 . 1 . . . . . 85 LYS CB . 51255 1 363 . 1 . 1 85 85 LYS N N 15 121.0042 0.0000 . 1 . . . . . 85 LYS N . 51255 1 364 . 1 . 1 86 86 VAL H H 1 9.3629 0.0000 . 1 . . . . . 86 VAL H . 51255 1 365 . 1 . 1 86 86 VAL C C 13 173.5137 0.0000 . 1 . . . . . 86 VAL C . 51255 1 366 . 1 . 1 86 86 VAL CA C 13 58.6504 0.0000 . 1 . . . . . 86 VAL CA . 51255 1 367 . 1 . 1 86 86 VAL CB C 13 35.6265 0.0000 . 1 . . . . . 86 VAL CB . 51255 1 368 . 1 . 1 86 86 VAL N N 15 117.1660 0.0000 . 1 . . . . . 86 VAL N . 51255 1 369 . 1 . 1 87 87 ARG H H 1 8.4222 0.0000 . 1 . . . . . 87 ARG H . 51255 1 370 . 1 . 1 87 87 ARG C C 13 173.9708 0.0000 . 1 . . . . . 87 ARG C . 51255 1 371 . 1 . 1 87 87 ARG CA C 13 53.6686 0.0000 . 1 . . . . . 87 ARG CA . 51255 1 372 . 1 . 1 87 87 ARG CB C 13 35.0445 0.0000 . 1 . . . . . 87 ARG CB . 51255 1 373 . 1 . 1 87 87 ARG N N 15 119.3761 0.0000 . 1 . . . . . 87 ARG N . 51255 1 374 . 1 . 1 88 88 ARG H H 1 8.7650 0.0000 . 1 . . . . . 88 ARG H . 51255 1 375 . 1 . 1 88 88 ARG C C 13 174.9323 0.0000 . 1 . . . . . 88 ARG C . 51255 1 376 . 1 . 1 88 88 ARG CA C 13 56.7474 0.0000 . 1 . . . . . 88 ARG CA . 51255 1 377 . 1 . 1 88 88 ARG CB C 13 31.3932 0.0000 . 1 . . . . . 88 ARG CB . 51255 1 378 . 1 . 1 88 88 ARG N N 15 121.3680 0.0000 . 1 . . . . . 88 ARG N . 51255 1 379 . 1 . 1 89 89 ARG H H 1 8.1778 0.0000 . 1 . . . . . 89 ARG H . 51255 1 380 . 1 . 1 89 89 ARG C C 13 177.2779 0.0000 . 1 . . . . . 89 ARG C . 51255 1 381 . 1 . 1 89 89 ARG CA C 13 59.4754 0.0000 . 1 . . . . . 89 ARG CA . 51255 1 382 . 1 . 1 89 89 ARG CB C 13 30.5826 0.0000 . 1 . . . . . 89 ARG CB . 51255 1 383 . 1 . 1 89 89 ARG N N 15 121.5181 0.0000 . 1 . . . . . 89 ARG N . 51255 1 384 . 1 . 1 90 90 GLU H H 1 8.3466 0.0000 . 1 . . . . . 90 GLU H . 51255 1 385 . 1 . 1 90 90 GLU C C 13 174.6549 0.0000 . 1 . . . . . 90 GLU C . 51255 1 386 . 1 . 1 90 90 GLU CA C 13 55.8997 0.0000 . 1 . . . . . 90 GLU CA . 51255 1 387 . 1 . 1 90 90 GLU CB C 13 30.5965 0.0000 . 1 . . . . . 90 GLU CB . 51255 1 388 . 1 . 1 90 90 GLU N N 15 118.4986 0.0000 . 1 . . . . . 90 GLU N . 51255 1 389 . 1 . 1 91 91 GLU H H 1 9.0701 0.0000 . 1 . . . . . 91 GLU H . 51255 1 390 . 1 . 1 91 91 GLU CA C 13 56.4891 0.0000 . 1 . . . . . 91 GLU CA . 51255 1 391 . 1 . 1 91 91 GLU CB C 13 29.8273 0.0000 . 1 . . . . . 91 GLU CB . 51255 1 392 . 1 . 1 91 91 GLU N N 15 122.9257 0.0000 . 1 . . . . . 91 GLU N . 51255 1 393 . 1 . 1 92 92 PRO C C 13 179.6607 0.0000 . 1 . . . . . 92 PRO C . 51255 1 394 . 1 . 1 92 92 PRO CA C 13 65.3729 0.0000 . 1 . . . . . 92 PRO CA . 51255 1 395 . 1 . 1 92 92 PRO CB C 13 31.4142 0.0000 . 1 . . . . . 92 PRO CB . 51255 1 396 . 1 . 1 93 93 GLU H H 1 9.5345 0.0000 . 1 . . . . . 93 GLU H . 51255 1 397 . 1 . 1 93 93 GLU C C 13 176.9021 0.0000 . 1 . . . . . 93 GLU C . 51255 1 398 . 1 . 1 93 93 GLU CA C 13 58.5670 0.0000 . 1 . . . . . 93 GLU CA . 51255 1 399 . 1 . 1 93 93 GLU CB C 13 27.9053 0.0000 . 1 . . . . . 93 GLU CB . 51255 1 400 . 1 . 1 93 93 GLU N N 15 114.6969 0.0000 . 1 . . . . . 93 GLU N . 51255 1 401 . 1 . 1 94 94 LYS H H 1 7.3942 0.0000 . 1 . . . . . 94 LYS H . 51255 1 402 . 1 . 1 94 94 LYS C C 13 177.5937 0.0000 . 1 . . . . . 94 LYS C . 51255 1 403 . 1 . 1 94 94 LYS CA C 13 57.5164 0.0000 . 1 . . . . . 94 LYS CA . 51255 1 404 . 1 . 1 94 94 LYS CB C 13 32.0581 0.0000 . 1 . . . . . 94 LYS CB . 51255 1 405 . 1 . 1 94 94 LYS N N 15 118.7105 0.0000 . 1 . . . . . 94 LYS N . 51255 1 406 . 1 . 1 95 95 TRP H H 1 6.8473 0.0000 . 1 . . . . . 95 TRP H . 51255 1 407 . 1 . 1 95 95 TRP CA C 13 58.8325 0.0000 . 1 . . . . . 95 TRP CA . 51255 1 408 . 1 . 1 95 95 TRP CB C 13 31.1989 0.0000 . 1 . . . . . 95 TRP CB . 51255 1 409 . 1 . 1 95 95 TRP N N 15 120.4909 0.0000 . 1 . . . . . 95 TRP N . 51255 1 410 . 1 . 1 96 96 PRO C C 13 176.4126 0.0000 . 1 . . . . . 96 PRO C . 51255 1 411 . 1 . 1 96 96 PRO CA C 13 65.7065 0.0000 . 1 . . . . . 96 PRO CA . 51255 1 412 . 1 . 1 96 96 PRO CB C 13 31.3969 0.0000 . 1 . . . . . 96 PRO CB . 51255 1 413 . 1 . 1 97 97 LEU H H 1 7.5993 0.0000 . 1 . . . . . 97 LEU H . 51255 1 414 . 1 . 1 97 97 LEU CA C 13 51.1815 0.0000 . 1 . . . . . 97 LEU CA . 51255 1 415 . 1 . 1 97 97 LEU CB C 13 45.8655 0.0000 . 1 . . . . . 97 LEU CB . 51255 1 416 . 1 . 1 97 97 LEU N N 15 125.4650 0.0000 . 1 . . . . . 97 LEU N . 51255 1 stop_ save_