################################### # 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_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 7356 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_cond _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D CBCA(CO)NH' 1 $Fenofibric_acid-Rat_FABP2 . 7356 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $SPARKY . . 7356 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ALA CA C 13 52.446 0.400 . 1 . . . . 1 ALA CA . 7356 1 2 . 1 1 1 1 ALA CB C 13 19.341 0.400 . 1 . . . . 1 ALA CB . 7356 1 3 . 1 1 2 2 PHE H H 1 9.344 0.040 . 1 . . . . 2 PHE H . 7356 1 4 . 1 1 2 2 PHE CA C 13 59.630 0.400 . 1 . . . . 2 PHE CA . 7356 1 5 . 1 1 2 2 PHE CB C 13 40.060 0.400 . 1 . . . . 2 PHE CB . 7356 1 6 . 1 1 2 2 PHE N N 15 116.902 0.400 . 1 . . . . 2 PHE N . 7356 1 7 . 1 1 3 3 ASP H H 1 7.925 0.040 . 1 . . . . 3 ASP H . 7356 1 8 . 1 1 3 3 ASP CA C 13 55.249 0.400 . 1 . . . . 3 ASP CA . 7356 1 9 . 1 1 3 3 ASP CB C 13 41.564 0.400 . 1 . . . . 3 ASP CB . 7356 1 10 . 1 1 3 3 ASP N N 15 116.650 0.400 . 1 . . . . 3 ASP N . 7356 1 11 . 1 1 4 4 GLY H H 1 8.523 0.040 . 1 . . . . 4 GLY H . 7356 1 12 . 1 1 4 4 GLY CA C 13 43.800 0.400 . 1 . . . . 4 GLY CA . 7356 1 13 . 1 1 4 4 GLY N N 15 108.673 0.400 . 1 . . . . 4 GLY N . 7356 1 14 . 1 1 5 5 THR H H 1 8.356 0.040 . 1 . . . . 5 THR H . 7356 1 15 . 1 1 5 5 THR CA C 13 62.501 0.400 . 1 . . . . 5 THR CA . 7356 1 16 . 1 1 5 5 THR CB C 13 69.807 0.400 . 1 . . . . 5 THR CB . 7356 1 17 . 1 1 5 5 THR N N 15 116.982 0.400 . 1 . . . . 5 THR N . 7356 1 18 . 1 1 6 6 TRP H H 1 9.370 0.040 . 1 . . . . 6 TRP H . 7356 1 19 . 1 1 6 6 TRP CA C 13 54.773 0.400 . 1 . . . . 6 TRP CA . 7356 1 20 . 1 1 6 6 TRP CB C 13 31.374 0.400 . 1 . . . . 6 TRP CB . 7356 1 21 . 1 1 6 6 TRP N N 15 128.043 0.400 . 1 . . . . 6 TRP N . 7356 1 22 . 1 1 7 7 LYS H H 1 9.535 0.040 . 1 . . . . 7 LYS H . 7356 1 23 . 1 1 7 7 LYS CA C 13 54.710 0.400 . 1 . . . . 7 LYS CA . 7356 1 24 . 1 1 7 7 LYS CB C 13 35.435 0.400 . 1 . . . . 7 LYS CB . 7356 1 25 . 1 1 7 7 LYS N N 15 124.563 0.400 . 1 . . . . 7 LYS N . 7356 1 26 . 1 1 8 8 VAL H H 1 8.844 0.040 . 1 . . . . 8 VAL H . 7356 1 27 . 1 1 8 8 VAL CA C 13 65.007 0.400 . 1 . . . . 8 VAL CA . 7356 1 28 . 1 1 8 8 VAL CB C 13 31.360 0.400 . 1 . . . . 8 VAL CB . 7356 1 29 . 1 1 8 8 VAL N N 15 129.569 0.400 . 1 . . . . 8 VAL N . 7356 1 30 . 1 1 9 9 ASP H H 1 9.713 0.040 . 1 . . . . 9 ASP H . 7356 1 31 . 1 1 9 9 ASP CA C 13 55.426 0.400 . 1 . . . . 9 ASP CA . 7356 1 32 . 1 1 9 9 ASP CB C 13 46.845 0.400 . 1 . . . . 9 ASP CB . 7356 1 33 . 1 1 9 9 ASP N N 15 127.602 0.400 . 1 . . . . 9 ASP N . 7356 1 34 . 1 1 10 10 ARG H H 1 7.767 0.040 . 1 . . . . 10 ARG H . 7356 1 35 . 1 1 10 10 ARG CA C 13 54.878 0.400 . 1 . . . . 10 ARG CA . 7356 1 36 . 1 1 10 10 ARG CB C 13 31.659 0.400 . 1 . . . . 10 ARG CB . 7356 1 37 . 1 1 10 10 ARG N N 15 112.863 0.400 . 1 . . . . 10 ARG N . 7356 1 38 . 1 1 11 11 ASN H H 1 8.695 0.040 . 1 . . . . 11 ASN H . 7356 1 39 . 1 1 11 11 ASN CA C 13 51.245 0.400 . 1 . . . . 11 ASN CA . 7356 1 40 . 1 1 11 11 ASN CB C 13 43.567 0.400 . 1 . . . . 11 ASN CB . 7356 1 41 . 1 1 11 11 ASN N N 15 116.618 0.400 . 1 . . . . 11 ASN N . 7356 1 42 . 1 1 12 12 GLU H H 1 9.465 0.040 . 1 . . . . 12 GLU H . 7356 1 43 . 1 1 12 12 GLU CA C 13 55.825 0.400 . 1 . . . . 12 GLU CA . 7356 1 44 . 1 1 12 12 GLU CB C 13 32.584 0.400 . 1 . . . . 12 GLU CB . 7356 1 45 . 1 1 12 12 GLU N N 15 120.480 0.400 . 1 . . . . 12 GLU N . 7356 1 46 . 1 1 13 13 ASN H H 1 9.393 0.040 . 1 . . . . 13 ASN H . 7356 1 47 . 1 1 13 13 ASN CA C 13 54.289 0.400 . 1 . . . . 13 ASN CA . 7356 1 48 . 1 1 13 13 ASN CB C 13 39.909 0.400 . 1 . . . . 13 ASN CB . 7356 1 49 . 1 1 13 13 ASN N N 15 122.578 0.400 . 1 . . . . 13 ASN N . 7356 1 50 . 1 1 14 14 TYR H H 1 8.412 0.040 . 1 . . . . 14 TYR H . 7356 1 51 . 1 1 14 14 TYR CA C 13 58.727 0.400 . 1 . . . . 14 TYR CA . 7356 1 52 . 1 1 14 14 TYR CB C 13 40.390 0.400 . 1 . . . . 14 TYR CB . 7356 1 53 . 1 1 14 14 TYR N N 15 119.309 0.400 . 1 . . . . 14 TYR N . 7356 1 54 . 1 1 15 15 GLU H H 1 9.032 0.040 . 1 . . . . 15 GLU H . 7356 1 55 . 1 1 15 15 GLU CA C 13 61.600 0.400 . 1 . . . . 15 GLU CA . 7356 1 56 . 1 1 15 15 GLU CB C 13 28.040 0.400 . 1 . . . . 15 GLU CB . 7356 1 57 . 1 1 15 15 GLU N N 15 120.021 0.400 . 1 . . . . 15 GLU N . 7356 1 58 . 1 1 16 16 LYS H H 1 8.321 0.040 . 1 . . . . 16 LYS H . 7356 1 59 . 1 1 16 16 LYS CA C 13 58.440 0.400 . 1 . . . . 16 LYS CA . 7356 1 60 . 1 1 16 16 LYS CB C 13 31.448 0.400 . 1 . . . . 16 LYS CB . 7356 1 61 . 1 1 16 16 LYS N N 15 119.907 0.400 . 1 . . . . 16 LYS N . 7356 1 62 . 1 1 17 17 PHE H H 1 7.826 0.040 . 1 . . . . 17 PHE H . 7356 1 63 . 1 1 17 17 PHE CA C 13 62.847 0.400 . 1 . . . . 17 PHE CA . 7356 1 64 . 1 1 17 17 PHE CB C 13 41.029 0.400 . 1 . . . . 17 PHE CB . 7356 1 65 . 1 1 17 17 PHE N N 15 121.976 0.400 . 1 . . . . 17 PHE N . 7356 1 66 . 1 1 18 18 MET H H 1 8.574 0.040 . 1 . . . . 18 MET H . 7356 1 67 . 1 1 18 18 MET CA C 13 60.073 0.400 . 1 . . . . 18 MET CA . 7356 1 68 . 1 1 18 18 MET CB C 13 35.466 0.400 . 1 . . . . 18 MET CB . 7356 1 69 . 1 1 18 18 MET N N 15 117.813 0.400 . 1 . . . . 18 MET N . 7356 1 70 . 1 1 19 19 GLU H H 1 7.860 0.040 . 1 . . . . 19 GLU H . 7356 1 71 . 1 1 19 19 GLU CA C 13 59.858 0.400 . 1 . . . . 19 GLU CA . 7356 1 72 . 1 1 19 19 GLU CB C 13 29.530 0.400 . 1 . . . . 19 GLU CB . 7356 1 73 . 1 1 19 19 GLU N N 15 118.455 0.400 . 1 . . . . 19 GLU N . 7356 1 74 . 1 1 20 20 LYS H H 1 8.030 0.040 . 1 . . . . 20 LYS H . 7356 1 75 . 1 1 20 20 LYS CA C 13 57.420 0.400 . 1 . . . . 20 LYS CA . 7356 1 76 . 1 1 20 20 LYS CB C 13 31.431 0.400 . 1 . . . . 20 LYS CB . 7356 1 77 . 1 1 20 20 LYS N N 15 123.737 0.400 . 1 . . . . 20 LYS N . 7356 1 78 . 1 1 21 21 MET H H 1 7.708 0.040 . 1 . . . . 21 MET H . 7356 1 79 . 1 1 21 21 MET CA C 13 55.821 0.400 . 1 . . . . 21 MET CA . 7356 1 80 . 1 1 21 21 MET CB C 13 32.617 0.400 . 1 . . . . 21 MET CB . 7356 1 81 . 1 1 21 21 MET N N 15 115.285 0.400 . 1 . . . . 21 MET N . 7356 1 82 . 1 1 22 22 GLY H H 1 7.671 0.040 . 1 . . . . 22 GLY H . 7356 1 83 . 1 1 22 22 GLY CA C 13 45.457 0.400 . 1 . . . . 22 GLY CA . 7356 1 84 . 1 1 22 22 GLY N N 15 107.757 0.400 . 1 . . . . 22 GLY N . 7356 1 85 . 1 1 23 23 ILE H H 1 7.189 0.040 . 1 . . . . 23 ILE H . 7356 1 86 . 1 1 23 23 ILE CA C 13 59.198 0.400 . 1 . . . . 23 ILE CA . 7356 1 87 . 1 1 23 23 ILE CB C 13 36.146 0.400 . 1 . . . . 23 ILE CB . 7356 1 88 . 1 1 23 23 ILE N N 15 120.290 0.400 . 1 . . . . 23 ILE N . 7356 1 89 . 1 1 24 24 ASN H H 1 8.875 0.040 . 1 . . . . 24 ASN H . 7356 1 90 . 1 1 24 24 ASN CA C 13 54.594 0.400 . 1 . . . . 24 ASN CA . 7356 1 91 . 1 1 24 24 ASN CB C 13 40.027 0.400 . 1 . . . . 24 ASN CB . 7356 1 92 . 1 1 24 24 ASN N N 15 127.691 0.400 . 1 . . . . 24 ASN N . 7356 1 93 . 1 1 25 25 VAL H H 1 8.521 0.040 . 1 . . . . 25 VAL H . 7356 1 94 . 1 1 25 25 VAL CA C 13 66.478 0.400 . 1 . . . . 25 VAL CA . 7356 1 95 . 1 1 25 25 VAL CB C 13 32.040 0.400 . 1 . . . . 25 VAL CB . 7356 1 96 . 1 1 25 25 VAL N N 15 122.330 0.400 . 1 . . . . 25 VAL N . 7356 1 97 . 1 1 26 26 VAL H H 1 7.629 0.040 . 1 . . . . 26 VAL H . 7356 1 98 . 1 1 26 26 VAL CA C 13 66.178 0.400 . 1 . . . . 26 VAL CA . 7356 1 99 . 1 1 26 26 VAL CB C 13 31.818 0.400 . 1 . . . . 26 VAL CB . 7356 1 100 . 1 1 26 26 VAL N N 15 120.693 0.400 . 1 . . . . 26 VAL N . 7356 1 101 . 1 1 27 27 LYS H H 1 7.713 0.040 . 1 . . . . 27 LYS H . 7356 1 102 . 1 1 27 27 LYS CA C 13 58.707 0.400 . 1 . . . . 27 LYS CA . 7356 1 103 . 1 1 27 27 LYS CB C 13 32.676 0.400 . 1 . . . . 27 LYS CB . 7356 1 104 . 1 1 27 27 LYS N N 15 118.193 0.400 . 1 . . . . 27 LYS N . 7356 1 105 . 1 1 28 28 ARG H H 1 8.611 0.040 . 1 . . . . 28 ARG H . 7356 1 106 . 1 1 28 28 ARG CA C 13 59.492 0.400 . 1 . . . . 28 ARG CA . 7356 1 107 . 1 1 28 28 ARG CB C 13 30.796 0.400 . 1 . . . . 28 ARG CB . 7356 1 108 . 1 1 28 28 ARG N N 15 119.571 0.400 . 1 . . . . 28 ARG N . 7356 1 109 . 1 1 29 29 LYS H H 1 7.633 0.040 . 1 . . . . 29 LYS H . 7356 1 110 . 1 1 29 29 LYS CA C 13 59.322 0.400 . 1 . . . . 29 LYS CA . 7356 1 111 . 1 1 29 29 LYS CB C 13 32.020 0.400 . 1 . . . . 29 LYS CB . 7356 1 112 . 1 1 29 29 LYS N N 15 119.510 0.400 . 1 . . . . 29 LYS N . 7356 1 113 . 1 1 30 30 LEU H H 1 7.424 0.040 . 1 . . . . 30 LEU H . 7356 1 114 . 1 1 30 30 LEU CA C 13 56.479 0.400 . 1 . . . . 30 LEU CA . 7356 1 115 . 1 1 30 30 LEU CB C 13 42.324 0.400 . 1 . . . . 30 LEU CB . 7356 1 116 . 1 1 30 30 LEU N N 15 117.853 0.400 . 1 . . . . 30 LEU N . 7356 1 117 . 1 1 31 31 GLY H H 1 8.748 0.040 . 1 . . . . 31 GLY H . 7356 1 118 . 1 1 31 31 GLY CA C 13 47.566 0.400 . 1 . . . . 31 GLY CA . 7356 1 119 . 1 1 31 31 GLY N N 15 107.638 0.400 . 1 . . . . 31 GLY N . 7356 1 120 . 1 1 32 32 ALA H H 1 8.014 0.040 . 1 . . . . 32 ALA H . 7356 1 121 . 1 1 32 32 ALA CA C 13 53.801 0.400 . 1 . . . . 32 ALA CA . 7356 1 122 . 1 1 32 32 ALA CB C 13 18.585 0.400 . 1 . . . . 32 ALA CB . 7356 1 123 . 1 1 32 32 ALA N N 15 119.748 0.400 . 1 . . . . 32 ALA N . 7356 1 124 . 1 1 33 33 HIS H H 1 7.433 0.040 . 1 . . . . 33 HIS H . 7356 1 125 . 1 1 33 33 HIS CA C 13 53.824 0.400 . 1 . . . . 33 HIS CA . 7356 1 126 . 1 1 33 33 HIS CB C 13 28.625 0.400 . 1 . . . . 33 HIS CB . 7356 1 127 . 1 1 33 33 HIS N N 15 117.615 0.400 . 1 . . . . 33 HIS N . 7356 1 128 . 1 1 34 34 ASP H H 1 7.136 0.040 . 1 . . . . 34 ASP H . 7356 1 129 . 1 1 34 34 ASP CA C 13 54.777 0.400 . 1 . . . . 34 ASP CA . 7356 1 130 . 1 1 34 34 ASP CB C 13 41.164 0.400 . 1 . . . . 34 ASP CB . 7356 1 131 . 1 1 34 34 ASP N N 15 117.512 0.400 . 1 . . . . 34 ASP N . 7356 1 132 . 1 1 35 35 ASN H H 1 9.244 0.040 . 1 . . . . 35 ASN H . 7356 1 133 . 1 1 35 35 ASN CA C 13 53.718 0.400 . 1 . . . . 35 ASN CA . 7356 1 134 . 1 1 35 35 ASN CB C 13 37.577 0.400 . 1 . . . . 35 ASN CB . 7356 1 135 . 1 1 35 35 ASN N N 15 119.078 0.400 . 1 . . . . 35 ASN N . 7356 1 136 . 1 1 36 36 LEU H H 1 6.959 0.040 . 1 . . . . 36 LEU H . 7356 1 137 . 1 1 36 36 LEU CA C 13 57.112 0.400 . 1 . . . . 36 LEU CA . 7356 1 138 . 1 1 36 36 LEU CB C 13 42.274 0.400 . 1 . . . . 36 LEU CB . 7356 1 139 . 1 1 36 36 LEU N N 15 118.910 0.400 . 1 . . . . 36 LEU N . 7356 1 140 . 1 1 37 37 LYS H H 1 9.588 0.040 . 1 . . . . 37 LYS H . 7356 1 141 . 1 1 37 37 LYS CA C 13 54.752 0.400 . 1 . . . . 37 LYS CA . 7356 1 142 . 1 1 37 37 LYS CB C 13 36.393 0.400 . 1 . . . . 37 LYS CB . 7356 1 143 . 1 1 37 37 LYS N N 15 127.702 0.400 . 1 . . . . 37 LYS N . 7356 1 144 . 1 1 38 38 LEU H H 1 9.356 0.040 . 1 . . . . 38 LEU H . 7356 1 145 . 1 1 38 38 LEU CA C 13 52.567 0.400 . 1 . . . . 38 LEU CA . 7356 1 146 . 1 1 38 38 LEU CB C 13 45.812 0.400 . 1 . . . . 38 LEU CB . 7356 1 147 . 1 1 38 38 LEU N N 15 123.152 0.400 . 1 . . . . 38 LEU N . 7356 1 148 . 1 1 39 39 THR H H 1 9.142 0.040 . 1 . . . . 39 THR H . 7356 1 149 . 1 1 39 39 THR CA C 13 62.478 0.400 . 1 . . . . 39 THR CA . 7356 1 150 . 1 1 39 39 THR CB C 13 70.146 0.400 . 1 . . . . 39 THR CB . 7356 1 151 . 1 1 39 39 THR N N 15 120.992 0.400 . 1 . . . . 39 THR N . 7356 1 152 . 1 1 40 40 ILE H H 1 9.572 0.040 . 1 . . . . 40 ILE H . 7356 1 153 . 1 1 40 40 ILE CA C 13 61.631 0.400 . 1 . . . . 40 ILE CA . 7356 1 154 . 1 1 40 40 ILE CB C 13 40.020 0.400 . 1 . . . . 40 ILE CB . 7356 1 155 . 1 1 40 40 ILE N N 15 129.212 0.400 . 1 . . . . 40 ILE N . 7356 1 156 . 1 1 41 41 THR H H 1 8.773 0.040 . 1 . . . . 41 THR H . 7356 1 157 . 1 1 41 41 THR CA C 13 61.663 0.400 . 1 . . . . 41 THR CA . 7356 1 158 . 1 1 41 41 THR CB C 13 71.506 0.400 . 1 . . . . 41 THR CB . 7356 1 159 . 1 1 41 41 THR N N 15 123.021 0.400 . 1 . . . . 41 THR N . 7356 1 160 . 1 1 42 42 GLN H H 1 8.982 0.040 . 1 . . . . 42 GLN H . 7356 1 161 . 1 1 42 42 GLN CA C 13 54.420 0.400 . 1 . . . . 42 GLN CA . 7356 1 162 . 1 1 42 42 GLN CB C 13 29.615 0.400 . 1 . . . . 42 GLN CB . 7356 1 163 . 1 1 42 42 GLN N N 15 128.747 0.400 . 1 . . . . 42 GLN N . 7356 1 164 . 1 1 43 43 GLU H H 1 8.890 0.040 . 1 . . . . 43 GLU H . 7356 1 165 . 1 1 43 43 GLU CA C 13 54.767 0.400 . 1 . . . . 43 GLU CA . 7356 1 166 . 1 1 43 43 GLU CB C 13 31.296 0.400 . 1 . . . . 43 GLU CB . 7356 1 167 . 1 1 43 43 GLU N N 15 129.529 0.400 . 1 . . . . 43 GLU N . 7356 1 168 . 1 1 44 44 GLY H H 1 9.027 0.040 . 1 . . . . 44 GLY H . 7356 1 169 . 1 1 44 44 GLY CA C 13 47.378 0.400 . 1 . . . . 44 GLY CA . 7356 1 170 . 1 1 44 44 GLY N N 15 117.710 0.400 . 1 . . . . 44 GLY N . 7356 1 171 . 1 1 45 45 ASN H H 1 8.902 0.040 . 1 . . . . 45 ASN H . 7356 1 172 . 1 1 45 45 ASN CA C 13 53.040 0.400 . 1 . . . . 45 ASN CA . 7356 1 173 . 1 1 45 45 ASN CB C 13 38.944 0.400 . 1 . . . . 45 ASN CB . 7356 1 174 . 1 1 45 45 ASN N N 15 125.561 0.400 . 1 . . . . 45 ASN N . 7356 1 175 . 1 1 46 46 LYS H H 1 7.950 0.040 . 1 . . . . 46 LYS H . 7356 1 176 . 1 1 46 46 LYS CA C 13 55.616 0.400 . 1 . . . . 46 LYS CA . 7356 1 177 . 1 1 46 46 LYS CB C 13 34.422 0.400 . 1 . . . . 46 LYS CB . 7356 1 178 . 1 1 46 46 LYS N N 15 120.733 0.400 . 1 . . . . 46 LYS N . 7356 1 179 . 1 1 47 47 PHE H H 1 9.107 0.040 . 1 . . . . 47 PHE H . 7356 1 180 . 1 1 47 47 PHE CA C 13 56.398 0.400 . 1 . . . . 47 PHE CA . 7356 1 181 . 1 1 47 47 PHE CB C 13 42.787 0.400 . 1 . . . . 47 PHE CB . 7356 1 182 . 1 1 47 47 PHE N N 15 126.039 0.400 . 1 . . . . 47 PHE N . 7356 1 183 . 1 1 48 48 THR H H 1 8.316 0.040 . 1 . . . . 48 THR H . 7356 1 184 . 1 1 48 48 THR CA C 13 62.043 0.400 . 1 . . . . 48 THR CA . 7356 1 185 . 1 1 48 48 THR CB C 13 70.037 0.400 . 1 . . . . 48 THR CB . 7356 1 186 . 1 1 48 48 THR N N 15 115.637 0.400 . 1 . . . . 48 THR N . 7356 1 187 . 1 1 49 49 VAL H H 1 9.665 0.040 . 1 . . . . 49 VAL H . 7356 1 188 . 1 1 49 49 VAL CA C 13 60.573 0.400 . 1 . . . . 49 VAL CA . 7356 1 189 . 1 1 49 49 VAL CB C 13 34.282 0.400 . 1 . . . . 49 VAL CB . 7356 1 190 . 1 1 49 49 VAL N N 15 127.998 0.400 . 1 . . . . 49 VAL N . 7356 1 191 . 1 1 50 50 LYS H H 1 9.276 0.040 . 1 . . . . 50 LYS H . 7356 1 192 . 1 1 50 50 LYS CA C 13 55.614 0.400 . 1 . . . . 50 LYS CA . 7356 1 193 . 1 1 50 50 LYS CB C 13 32.107 0.400 . 1 . . . . 50 LYS CB . 7356 1 194 . 1 1 50 50 LYS N N 15 128.300 0.400 . 1 . . . . 50 LYS N . 7356 1 195 . 1 1 51 51 GLU H H 1 9.389 0.040 . 1 . . . . 51 GLU H . 7356 1 196 . 1 1 51 51 GLU CA C 13 55.004 0.400 . 1 . . . . 51 GLU CA . 7356 1 197 . 1 1 51 51 GLU CB C 13 30.817 0.400 . 1 . . . . 51 GLU CB . 7356 1 198 . 1 1 51 51 GLU N N 15 128.781 0.400 . 1 . . . . 51 GLU N . 7356 1 199 . 1 1 52 52 SER H H 1 9.071 0.040 . 1 . . . . 52 SER H . 7356 1 200 . 1 1 52 52 SER CA C 13 56.525 0.400 . 1 . . . . 52 SER CA . 7356 1 201 . 1 1 52 52 SER CB C 13 65.163 0.400 . 1 . . . . 52 SER CB . 7356 1 202 . 1 1 52 52 SER N N 15 121.107 0.400 . 1 . . . . 52 SER N . 7356 1 203 . 1 1 53 53 SER H H 1 9.014 0.040 . 1 . . . . 53 SER H . 7356 1 204 . 1 1 53 53 SER CA C 13 57.169 0.400 . 1 . . . . 53 SER CA . 7356 1 205 . 1 1 53 53 SER CB C 13 67.962 0.400 . 1 . . . . 53 SER CB . 7356 1 206 . 1 1 53 53 SER N N 15 121.105 0.400 . 1 . . . . 53 SER N . 7356 1 207 . 1 1 54 54 ASN H H 1 9.223 0.040 . 1 . . . . 54 ASN H . 7356 1 208 . 1 1 54 54 ASN CA C 13 54.448 0.400 . 1 . . . . 54 ASN CA . 7356 1 209 . 1 1 54 54 ASN CB C 13 37.891 0.400 . 1 . . . . 54 ASN CB . 7356 1 210 . 1 1 54 54 ASN N N 15 115.752 0.400 . 1 . . . . 54 ASN N . 7356 1 211 . 1 1 55 55 PHE H H 1 8.207 0.040 . 1 . . . . 55 PHE H . 7356 1 212 . 1 1 55 55 PHE CA C 13 59.927 0.400 . 1 . . . . 55 PHE CA . 7356 1 213 . 1 1 55 55 PHE CB C 13 40.571 0.400 . 1 . . . . 55 PHE CB . 7356 1 214 . 1 1 55 55 PHE N N 15 114.128 0.400 . 1 . . . . 55 PHE N . 7356 1 215 . 1 1 56 56 ARG H H 1 7.463 0.040 . 1 . . . . 56 ARG H . 7356 1 216 . 1 1 56 56 ARG CA C 13 55.452 0.400 . 1 . . . . 56 ARG CA . 7356 1 217 . 1 1 56 56 ARG CB C 13 30.685 0.400 . 1 . . . . 56 ARG CB . 7356 1 218 . 1 1 56 56 ARG N N 15 112.282 0.400 . 1 . . . . 56 ARG N . 7356 1 219 . 1 1 57 57 ASN H H 1 8.543 0.040 . 1 . . . . 57 ASN H . 7356 1 220 . 1 1 57 57 ASN CA C 13 52.864 0.400 . 1 . . . . 57 ASN CA . 7356 1 221 . 1 1 57 57 ASN CB C 13 40.590 0.400 . 1 . . . . 57 ASN CB . 7356 1 222 . 1 1 57 57 ASN N N 15 119.095 0.400 . 1 . . . . 57 ASN N . 7356 1 223 . 1 1 58 58 ILE H H 1 8.892 0.040 . 1 . . . . 58 ILE H . 7356 1 224 . 1 1 58 58 ILE CA C 13 59.947 0.400 . 1 . . . . 58 ILE CA . 7356 1 225 . 1 1 58 58 ILE CB C 13 43.028 0.400 . 1 . . . . 58 ILE CB . 7356 1 226 . 1 1 58 58 ILE N N 15 117.658 0.400 . 1 . . . . 58 ILE N . 7356 1 227 . 1 1 59 59 ASP H H 1 8.527 0.040 . 1 . . . . 59 ASP H . 7356 1 228 . 1 1 59 59 ASP CA C 13 53.404 0.400 . 1 . . . . 59 ASP CA . 7356 1 229 . 1 1 59 59 ASP CB C 13 33.052 0.400 . 1 . . . . 59 ASP CB . 7356 1 230 . 1 1 59 59 ASP N N 15 123.204 0.400 . 1 . . . . 59 ASP N . 7356 1 231 . 1 1 60 60 VAL H H 1 9.130 0.040 . 1 . . . . 60 VAL H . 7356 1 232 . 1 1 60 60 VAL CA C 13 61.856 0.400 . 1 . . . . 60 VAL CA . 7356 1 233 . 1 1 60 60 VAL CB C 13 34.342 0.400 . 1 . . . . 60 VAL CB . 7356 1 234 . 1 1 60 60 VAL N N 15 123.349 0.400 . 1 . . . . 60 VAL N . 7356 1 235 . 1 1 61 61 VAL H H 1 8.259 0.040 . 1 . . . . 61 VAL H . 7356 1 236 . 1 1 61 61 VAL CA C 13 60.028 0.400 . 1 . . . . 61 VAL CA . 7356 1 237 . 1 1 61 61 VAL CB C 13 34.415 0.400 . 1 . . . . 61 VAL CB . 7356 1 238 . 1 1 61 61 VAL N N 15 125.868 0.400 . 1 . . . . 61 VAL N . 7356 1 239 . 1 1 62 62 PHE H H 1 8.390 0.040 . 1 . . . . 62 PHE H . 7356 1 240 . 1 1 62 62 PHE CA C 13 55.515 0.400 . 1 . . . . 62 PHE CA . 7356 1 241 . 1 1 62 62 PHE CB C 13 40.516 0.400 . 1 . . . . 62 PHE CB . 7356 1 242 . 1 1 62 62 PHE N N 15 121.454 0.400 . 1 . . . . 62 PHE N . 7356 1 243 . 1 1 63 63 GLU H H 1 9.466 0.040 . 1 . . . . 63 GLU H . 7356 1 244 . 1 1 63 63 GLU CA C 13 53.589 0.400 . 1 . . . . 63 GLU CA . 7356 1 245 . 1 1 63 63 GLU CB C 13 32.507 0.400 . 1 . . . . 63 GLU CB . 7356 1 246 . 1 1 63 63 GLU N N 15 120.486 0.400 . 1 . . . . 63 GLU N . 7356 1 247 . 1 1 64 64 LEU H H 1 8.958 0.040 . 1 . . . . 64 LEU H . 7356 1 248 . 1 1 64 64 LEU CA C 13 56.374 0.400 . 1 . . . . 64 LEU CA . 7356 1 249 . 1 1 64 64 LEU CB C 13 41.190 0.400 . 1 . . . . 64 LEU CB . 7356 1 250 . 1 1 64 64 LEU N N 15 125.205 0.400 . 1 . . . . 64 LEU N . 7356 1 251 . 1 1 65 65 GLY H H 1 9.305 0.040 . 1 . . . . 65 GLY H . 7356 1 252 . 1 1 65 65 GLY CA C 13 46.139 0.400 . 1 . . . . 65 GLY CA . 7356 1 253 . 1 1 65 65 GLY N N 15 108.380 0.400 . 1 . . . . 65 GLY N . 7356 1 254 . 1 1 66 66 VAL H H 1 7.952 0.040 . 1 . . . . 66 VAL H . 7356 1 255 . 1 1 66 66 VAL CA C 13 62.476 0.400 . 1 . . . . 66 VAL CA . 7356 1 256 . 1 1 66 66 VAL CB C 13 32.717 0.400 . 1 . . . . 66 VAL CB . 7356 1 257 . 1 1 66 66 VAL N N 15 122.426 0.400 . 1 . . . . 66 VAL N . 7356 1 258 . 1 1 67 67 ASP H H 1 8.792 0.040 . 1 . . . . 67 ASP H . 7356 1 259 . 1 1 67 67 ASP CA C 13 55.420 0.400 . 1 . . . . 67 ASP CA . 7356 1 260 . 1 1 67 67 ASP CB C 13 41.774 0.400 . 1 . . . . 67 ASP CB . 7356 1 261 . 1 1 67 67 ASP N N 15 132.355 0.400 . 1 . . . . 67 ASP N . 7356 1 262 . 1 1 68 68 PHE H H 1 9.272 0.040 . 1 . . . . 68 PHE H . 7356 1 263 . 1 1 68 68 PHE CA C 13 56.066 0.400 . 1 . . . . 68 PHE CA . 7356 1 264 . 1 1 68 68 PHE CB C 13 41.819 0.400 . 1 . . . . 68 PHE CB . 7356 1 265 . 1 1 68 68 PHE N N 15 120.308 0.400 . 1 . . . . 68 PHE N . 7356 1 266 . 1 1 69 69 ALA H H 1 8.401 0.040 . 1 . . . . 69 ALA H . 7356 1 267 . 1 1 69 69 ALA CA C 13 50.853 0.400 . 1 . . . . 69 ALA CA . 7356 1 268 . 1 1 69 69 ALA CB C 13 21.071 0.400 . 1 . . . . 69 ALA CB . 7356 1 269 . 1 1 69 69 ALA N N 15 122.156 0.400 . 1 . . . . 69 ALA N . 7356 1 270 . 1 1 70 70 TYR H H 1 8.465 0.040 . 1 . . . . 70 TYR H . 7356 1 271 . 1 1 70 70 TYR CA C 13 57.824 0.400 . 1 . . . . 70 TYR CA . 7356 1 272 . 1 1 70 70 TYR CB C 13 42.967 0.400 . 1 . . . . 70 TYR CB . 7356 1 273 . 1 1 70 70 TYR N N 15 123.605 0.400 . 1 . . . . 70 TYR N . 7356 1 274 . 1 1 71 71 SER H H 1 7.773 0.040 . 1 . . . . 71 SER H . 7356 1 275 . 1 1 71 71 SER CA C 13 56.090 0.400 . 1 . . . . 71 SER CA . 7356 1 276 . 1 1 71 71 SER CB C 13 64.627 0.400 . 1 . . . . 71 SER CB . 7356 1 277 . 1 1 71 71 SER N N 15 121.114 0.400 . 1 . . . . 71 SER N . 7356 1 278 . 1 1 72 72 LEU H H 1 9.037 0.040 . 1 . . . . 72 LEU H . 7356 1 279 . 1 1 72 72 LEU CA C 13 54.372 0.400 . 1 . . . . 72 LEU CA . 7356 1 280 . 1 1 72 72 LEU N N 15 122.312 0.400 . 1 . . . . 72 LEU N . 7356 1 281 . 1 1 73 73 ALA CA C 13 54.548 0.400 . 1 . . . . 73 ALA CA . 7356 1 282 . 1 1 73 73 ALA CB C 13 17.505 0.400 . 1 . . . . 73 ALA CB . 7356 1 283 . 1 1 74 74 ASP H H 1 7.666 0.040 . 1 . . . . 74 ASP H . 7356 1 284 . 1 1 74 74 ASP CA C 13 53.126 0.400 . 1 . . . . 74 ASP CA . 7356 1 285 . 1 1 74 74 ASP CB C 13 40.155 0.400 . 1 . . . . 74 ASP CB . 7356 1 286 . 1 1 74 74 ASP N N 15 114.729 0.400 . 1 . . . . 74 ASP N . 7356 1 287 . 1 1 75 75 GLY H H 1 7.978 0.040 . 1 . . . . 75 GLY H . 7356 1 288 . 1 1 75 75 GLY CA C 13 44.469 0.400 . 1 . . . . 75 GLY CA . 7356 1 289 . 1 1 75 75 GLY N N 15 108.861 0.400 . 1 . . . . 75 GLY N . 7356 1 290 . 1 1 76 76 THR H H 1 7.786 0.040 . 1 . . . . 76 THR H . 7356 1 291 . 1 1 76 76 THR CA C 13 64.989 0.400 . 1 . . . . 76 THR CA . 7356 1 292 . 1 1 76 76 THR CB C 13 67.908 0.400 . 1 . . . . 76 THR CB . 7356 1 293 . 1 1 76 76 THR N N 15 119.337 0.400 . 1 . . . . 76 THR N . 7356 1 294 . 1 1 77 77 GLU H H 1 8.617 0.040 . 1 . . . . 77 GLU H . 7356 1 295 . 1 1 77 77 GLU CA C 13 57.307 0.400 . 1 . . . . 77 GLU CA . 7356 1 296 . 1 1 77 77 GLU CB C 13 30.857 0.400 . 1 . . . . 77 GLU CB . 7356 1 297 . 1 1 77 77 GLU N N 15 128.947 0.400 . 1 . . . . 77 GLU N . 7356 1 298 . 1 1 78 78 LEU H H 1 8.942 0.040 . 1 . . . . 78 LEU H . 7356 1 299 . 1 1 78 78 LEU CA C 13 53.491 0.400 . 1 . . . . 78 LEU CA . 7356 1 300 . 1 1 78 78 LEU CB C 13 46.440 0.400 . 1 . . . . 78 LEU CB . 7356 1 301 . 1 1 78 78 LEU N N 15 122.241 0.400 . 1 . . . . 78 LEU N . 7356 1 302 . 1 1 79 79 THR H H 1 8.563 0.040 . 1 . . . . 79 THR H . 7356 1 303 . 1 1 79 79 THR CA C 13 60.475 0.400 . 1 . . . . 79 THR CA . 7356 1 304 . 1 1 79 79 THR CB C 13 70.821 0.400 . 1 . . . . 79 THR CB . 7356 1 305 . 1 1 79 79 THR N N 15 112.822 0.400 . 1 . . . . 79 THR N . 7356 1 306 . 1 1 80 80 GLY H H 1 8.518 0.040 . 1 . . . . 80 GLY H . 7356 1 307 . 1 1 80 80 GLY CA C 13 46.572 0.400 . 1 . . . . 80 GLY CA . 7356 1 308 . 1 1 80 80 GLY N N 15 110.773 0.400 . 1 . . . . 80 GLY N . 7356 1 309 . 1 1 81 81 THR H H 1 6.774 0.040 . 1 . . . . 81 THR H . 7356 1 310 . 1 1 81 81 THR CA C 13 60.405 0.400 . 1 . . . . 81 THR CA . 7356 1 311 . 1 1 81 81 THR CB C 13 72.899 0.400 . 1 . . . . 81 THR CB . 7356 1 312 . 1 1 81 81 THR N N 15 107.088 0.400 . 1 . . . . 81 THR N . 7356 1 313 . 1 1 82 82 TRP H H 1 9.348 0.040 . 1 . . . . 82 TRP H . 7356 1 314 . 1 1 82 82 TRP CA C 13 55.866 0.400 . 1 . . . . 82 TRP CA . 7356 1 315 . 1 1 82 82 TRP CB C 13 32.527 0.400 . 1 . . . . 82 TRP CB . 7356 1 316 . 1 1 82 82 TRP N N 15 123.648 0.400 . 1 . . . . 82 TRP N . 7356 1 317 . 1 1 83 83 THR H H 1 9.304 0.040 . 1 . . . . 83 THR H . 7356 1 318 . 1 1 83 83 THR CA C 13 60.440 0.400 . 1 . . . . 83 THR CA . 7356 1 319 . 1 1 83 83 THR CB C 13 72.115 0.400 . 1 . . . . 83 THR CB . 7356 1 320 . 1 1 83 83 THR N N 15 113.672 0.400 . 1 . . . . 83 THR N . 7356 1 321 . 1 1 84 84 MET H H 1 8.928 0.040 . 1 . . . . 84 MET H . 7356 1 322 . 1 1 84 84 MET CA C 13 54.041 0.400 . 1 . . . . 84 MET CA . 7356 1 323 . 1 1 84 84 MET CB C 13 33.045 0.400 . 1 . . . . 84 MET CB . 7356 1 324 . 1 1 84 84 MET N N 15 121.310 0.400 . 1 . . . . 84 MET N . 7356 1 325 . 1 1 85 85 GLU H H 1 9.089 0.040 . 1 . . . . 85 GLU H . 7356 1 326 . 1 1 85 85 GLU CA C 13 54.872 0.400 . 1 . . . . 85 GLU CA . 7356 1 327 . 1 1 85 85 GLU CB C 13 30.615 0.400 . 1 . . . . 85 GLU CB . 7356 1 328 . 1 1 85 85 GLU N N 15 127.774 0.400 . 1 . . . . 85 GLU N . 7356 1 329 . 1 1 86 86 GLY H H 1 9.072 0.040 . 1 . . . . 86 GLY H . 7356 1 330 . 1 1 86 86 GLY CA C 13 47.664 0.400 . 1 . . . . 86 GLY CA . 7356 1 331 . 1 1 86 86 GLY N N 15 117.172 0.400 . 1 . . . . 86 GLY N . 7356 1 332 . 1 1 87 87 ASN H H 1 8.858 0.040 . 1 . . . . 87 ASN H . 7356 1 333 . 1 1 87 87 ASN CA C 13 53.194 0.400 . 1 . . . . 87 ASN CA . 7356 1 334 . 1 1 87 87 ASN CB C 13 38.639 0.400 . 1 . . . . 87 ASN CB . 7356 1 335 . 1 1 87 87 ASN N N 15 123.455 0.400 . 1 . . . . 87 ASN N . 7356 1 336 . 1 1 88 88 LYS H H 1 8.032 0.040 . 1 . . . . 88 LYS H . 7356 1 337 . 1 1 88 88 LYS CA C 13 55.761 0.400 . 1 . . . . 88 LYS CA . 7356 1 338 . 1 1 88 88 LYS CB C 13 34.816 0.400 . 1 . . . . 88 LYS CB . 7356 1 339 . 1 1 88 88 LYS N N 15 119.280 0.400 . 1 . . . . 88 LYS N . 7356 1 340 . 1 1 89 89 LEU H H 1 8.549 0.040 . 1 . . . . 89 LEU H . 7356 1 341 . 1 1 89 89 LEU CA C 13 53.887 0.400 . 1 . . . . 89 LEU CA . 7356 1 342 . 1 1 89 89 LEU CB C 13 44.392 0.400 . 1 . . . . 89 LEU CB . 7356 1 343 . 1 1 89 89 LEU N N 15 124.609 0.400 . 1 . . . . 89 LEU N . 7356 1 344 . 1 1 90 90 VAL H H 1 9.587 0.040 . 1 . . . . 90 VAL H . 7356 1 345 . 1 1 90 90 VAL CA C 13 62.755 0.400 . 1 . . . . 90 VAL CA . 7356 1 346 . 1 1 90 90 VAL CB C 13 33.451 0.400 . 1 . . . . 90 VAL CB . 7356 1 347 . 1 1 90 90 VAL N N 15 126.029 0.400 . 1 . . . . 90 VAL N . 7356 1 348 . 1 1 91 91 GLY H H 1 10.130 0.040 . 1 . . . . 91 GLY H . 7356 1 349 . 1 1 91 91 GLY CA C 13 44.302 0.400 . 1 . . . . 91 GLY CA . 7356 1 350 . 1 1 91 91 GLY N N 15 124.027 0.400 . 1 . . . . 91 GLY N . 7356 1 351 . 1 1 92 92 LYS H H 1 7.633 0.040 . 1 . . . . 92 LYS H . 7356 1 352 . 1 1 92 92 LYS CA C 13 55.146 0.400 . 1 . . . . 92 LYS CA . 7356 1 353 . 1 1 92 92 LYS CB C 13 33.215 0.400 . 1 . . . . 92 LYS CB . 7356 1 354 . 1 1 92 92 LYS N N 15 124.825 0.400 . 1 . . . . 92 LYS N . 7356 1 355 . 1 1 93 93 PHE H H 1 9.030 0.040 . 1 . . . . 93 PHE H . 7356 1 356 . 1 1 93 93 PHE CA C 13 55.611 0.400 . 1 . . . . 93 PHE CA . 7356 1 357 . 1 1 93 93 PHE CB C 13 43.425 0.400 . 1 . . . . 93 PHE CB . 7356 1 358 . 1 1 93 93 PHE N N 15 123.340 0.400 . 1 . . . . 93 PHE N . 7356 1 359 . 1 1 94 94 LYS H H 1 9.351 0.040 . 1 . . . . 94 LYS H . 7356 1 360 . 1 1 94 94 LYS CA C 13 54.744 0.400 . 1 . . . . 94 LYS CA . 7356 1 361 . 1 1 94 94 LYS CB C 13 35.485 0.400 . 1 . . . . 94 LYS CB . 7356 1 362 . 1 1 94 94 LYS N N 15 121.381 0.400 . 1 . . . . 94 LYS N . 7356 1 363 . 1 1 95 95 ARG H H 1 8.741 0.040 . 1 . . . . 95 ARG H . 7356 1 364 . 1 1 95 95 ARG CA C 13 56.725 0.400 . 1 . . . . 95 ARG CA . 7356 1 365 . 1 1 95 95 ARG CB C 13 30.811 0.400 . 1 . . . . 95 ARG CB . 7356 1 366 . 1 1 95 95 ARG N N 15 123.903 0.400 . 1 . . . . 95 ARG N . 7356 1 367 . 1 1 96 96 VAL H H 1 8.409 0.040 . 1 . . . . 96 VAL H . 7356 1 368 . 1 1 96 96 VAL CA C 13 65.397 0.400 . 1 . . . . 96 VAL CA . 7356 1 369 . 1 1 96 96 VAL CB C 13 32.390 0.400 . 1 . . . . 96 VAL CB . 7356 1 370 . 1 1 96 96 VAL N N 15 126.232 0.400 . 1 . . . . 96 VAL N . 7356 1 371 . 1 1 97 97 ASP H H 1 9.155 0.040 . 1 . . . . 97 ASP H . 7356 1 372 . 1 1 97 97 ASP CA C 13 56.509 0.400 . 1 . . . . 97 ASP CA . 7356 1 373 . 1 1 97 97 ASP CB C 13 38.695 0.400 . 1 . . . . 97 ASP CB . 7356 1 374 . 1 1 97 97 ASP N N 15 118.848 0.400 . 1 . . . . 97 ASP N . 7356 1 375 . 1 1 98 98 ASN H H 1 8.648 0.040 . 1 . . . . 98 ASN H . 7356 1 376 . 1 1 98 98 ASN CA C 13 51.497 0.400 . 1 . . . . 98 ASN CA . 7356 1 377 . 1 1 98 98 ASN CB C 13 39.278 0.400 . 1 . . . . 98 ASN CB . 7356 1 378 . 1 1 98 98 ASN N N 15 117.069 0.400 . 1 . . . . 98 ASN N . 7356 1 379 . 1 1 99 99 GLY H H 1 7.966 0.040 . 1 . . . . 99 GLY H . 7356 1 380 . 1 1 99 99 GLY CA C 13 46.507 0.400 . 1 . . . . 99 GLY CA . 7356 1 381 . 1 1 99 99 GLY N N 15 109.365 0.400 . 1 . . . . 99 GLY N . 7356 1 382 . 1 1 100 100 LYS H H 1 8.171 0.040 . 1 . . . . 100 LYS H . 7356 1 383 . 1 1 100 100 LYS CA C 13 56.992 0.400 . 1 . . . . 100 LYS CA . 7356 1 384 . 1 1 100 100 LYS CB C 13 34.094 0.400 . 1 . . . . 100 LYS CB . 7356 1 385 . 1 1 100 100 LYS N N 15 120.234 0.400 . 1 . . . . 100 LYS N . 7356 1 386 . 1 1 101 101 GLU H H 1 8.410 0.040 . 1 . . . . 101 GLU H . 7356 1 387 . 1 1 101 101 GLU CA C 13 56.170 0.400 . 1 . . . . 101 GLU CA . 7356 1 388 . 1 1 101 101 GLU CB C 13 32.736 0.400 . 1 . . . . 101 GLU CB . 7356 1 389 . 1 1 101 101 GLU N N 15 119.682 0.400 . 1 . . . . 101 GLU N . 7356 1 390 . 1 1 102 102 LEU H H 1 9.080 0.040 . 1 . . . . 102 LEU H . 7356 1 391 . 1 1 102 102 LEU CA C 13 54.141 0.400 . 1 . . . . 102 LEU CA . 7356 1 392 . 1 1 102 102 LEU CB C 13 46.429 0.400 . 1 . . . . 102 LEU CB . 7356 1 393 . 1 1 102 102 LEU N N 15 127.643 0.400 . 1 . . . . 102 LEU N . 7356 1 394 . 1 1 103 103 ILE H H 1 8.674 0.040 . 1 . . . . 103 ILE H . 7356 1 395 . 1 1 103 103 ILE CA C 13 59.026 0.400 . 1 . . . . 103 ILE CA . 7356 1 396 . 1 1 103 103 ILE CB C 13 39.489 0.400 . 1 . . . . 103 ILE CB . 7356 1 397 . 1 1 103 103 ILE N N 15 125.961 0.400 . 1 . . . . 103 ILE N . 7356 1 398 . 1 1 104 104 ALA H H 1 9.508 0.040 . 1 . . . . 104 ALA H . 7356 1 399 . 1 1 104 104 ALA CA C 13 49.878 0.400 . 1 . . . . 104 ALA CA . 7356 1 400 . 1 1 104 104 ALA CB C 13 23.807 0.400 . 1 . . . . 104 ALA CB . 7356 1 401 . 1 1 104 104 ALA N N 15 122.453 0.400 . 1 . . . . 104 ALA N . 7356 1 402 . 1 1 105 105 VAL H H 1 9.234 0.040 . 1 . . . . 105 VAL H . 7356 1 403 . 1 1 105 105 VAL CA C 13 61.073 0.400 . 1 . . . . 105 VAL CA . 7356 1 404 . 1 1 105 105 VAL N N 15 122.427 0.400 . 1 . . . . 105 VAL N . 7356 1 405 . 1 1 106 106 ARG H H 1 9.701 0.040 . 1 . . . . 106 ARG H . 7356 1 406 . 1 1 106 106 ARG CA C 13 54.906 0.400 . 1 . . . . 106 ARG CA . 7356 1 407 . 1 1 106 106 ARG CB C 13 33.041 0.400 . 1 . . . . 106 ARG CB . 7356 1 408 . 1 1 106 106 ARG N N 15 125.657 0.400 . 1 . . . . 106 ARG N . 7356 1 409 . 1 1 107 107 GLU H H 1 8.605 0.040 . 1 . . . . 107 GLU H . 7356 1 410 . 1 1 107 107 GLU CA C 13 54.389 0.400 . 1 . . . . 107 GLU CA . 7356 1 411 . 1 1 107 107 GLU CB C 13 34.550 0.400 . 1 . . . . 107 GLU CB . 7356 1 412 . 1 1 107 107 GLU N N 15 121.040 0.400 . 1 . . . . 107 GLU N . 7356 1 413 . 1 1 108 108 ILE H H 1 8.778 0.040 . 1 . . . . 108 ILE H . 7356 1 414 . 1 1 108 108 ILE CA C 13 58.701 0.400 . 1 . . . . 108 ILE CA . 7356 1 415 . 1 1 108 108 ILE CB C 13 37.131 0.400 . 1 . . . . 108 ILE CB . 7356 1 416 . 1 1 108 108 ILE N N 15 124.117 0.400 . 1 . . . . 108 ILE N . 7356 1 417 . 1 1 109 109 SER H H 1 8.982 0.040 . 1 . . . . 109 SER H . 7356 1 418 . 1 1 109 109 SER CA C 13 56.393 0.400 . 1 . . . . 109 SER CA . 7356 1 419 . 1 1 109 109 SER CB C 13 63.663 0.400 . 1 . . . . 109 SER CB . 7356 1 420 . 1 1 109 109 SER N N 15 123.270 0.400 . 1 . . . . 109 SER N . 7356 1 421 . 1 1 110 110 GLY H H 1 9.249 0.040 . 1 . . . . 110 GLY H . 7356 1 422 . 1 1 110 110 GLY CA C 13 47.785 0.400 . 1 . . . . 110 GLY CA . 7356 1 423 . 1 1 110 110 GLY N N 15 119.613 0.400 . 1 . . . . 110 GLY N . 7356 1 424 . 1 1 111 111 ASN H H 1 8.899 0.040 . 1 . . . . 111 ASN H . 7356 1 425 . 1 1 111 111 ASN CA C 13 53.028 0.400 . 1 . . . . 111 ASN CA . 7356 1 426 . 1 1 111 111 ASN CB C 13 38.796 0.400 . 1 . . . . 111 ASN CB . 7356 1 427 . 1 1 111 111 ASN N N 15 123.947 0.400 . 1 . . . . 111 ASN N . 7356 1 428 . 1 1 112 112 GLU H H 1 8.094 0.040 . 1 . . . . 112 GLU H . 7356 1 429 . 1 1 112 112 GLU CA C 13 55.214 0.400 . 1 . . . . 112 GLU CA . 7356 1 430 . 1 1 112 112 GLU CB C 13 33.537 0.400 . 1 . . . . 112 GLU CB . 7356 1 431 . 1 1 112 112 GLU N N 15 118.280 0.400 . 1 . . . . 112 GLU N . 7356 1 432 . 1 1 113 113 LEU H H 1 8.320 0.040 . 1 . . . . 113 LEU H . 7356 1 433 . 1 1 113 113 LEU CA C 13 54.036 0.400 . 1 . . . . 113 LEU CA . 7356 1 434 . 1 1 113 113 LEU CB C 13 43.451 0.400 . 1 . . . . 113 LEU CB . 7356 1 435 . 1 1 113 113 LEU N N 15 123.611 0.400 . 1 . . . . 113 LEU N . 7356 1 436 . 1 1 114 114 ILE H H 1 9.374 0.040 . 1 . . . . 114 ILE H . 7356 1 437 . 1 1 114 114 ILE CA C 13 61.305 0.400 . 1 . . . . 114 ILE CA . 7356 1 438 . 1 1 114 114 ILE CB C 13 38.974 0.400 . 1 . . . . 114 ILE CB . 7356 1 439 . 1 1 114 114 ILE N N 15 127.642 0.400 . 1 . . . . 114 ILE N . 7356 1 440 . 1 1 115 115 GLN H H 1 9.056 0.040 . 1 . . . . 115 GLN H . 7356 1 441 . 1 1 115 115 GLN CA C 13 53.463 0.400 . 1 . . . . 115 GLN CA . 7356 1 442 . 1 1 115 115 GLN CB C 13 42.196 0.400 . 1 . . . . 115 GLN CB . 7356 1 443 . 1 1 115 115 GLN N N 15 131.005 0.400 . 1 . . . . 115 GLN N . 7356 1 444 . 1 1 116 116 THR H H 1 9.297 0.040 . 1 . . . . 116 THR H . 7356 1 445 . 1 1 116 116 THR CA C 13 61.849 0.400 . 1 . . . . 116 THR CA . 7356 1 446 . 1 1 116 116 THR CB C 13 70.053 0.400 . 1 . . . . 116 THR CB . 7356 1 447 . 1 1 116 116 THR N N 15 125.794 0.400 . 1 . . . . 116 THR N . 7356 1 448 . 1 1 117 117 TYR H H 1 9.484 0.040 . 1 . . . . 117 TYR H . 7356 1 449 . 1 1 117 117 TYR CA C 13 53.773 0.400 . 1 . . . . 117 TYR CA . 7356 1 450 . 1 1 117 117 TYR CB C 13 43.877 0.400 . 1 . . . . 117 TYR CB . 7356 1 451 . 1 1 117 117 TYR N N 15 127.920 0.400 . 1 . . . . 117 TYR N . 7356 1 452 . 1 1 118 118 THR H H 1 9.249 0.040 . 1 . . . . 118 THR H . 7356 1 453 . 1 1 118 118 THR CA C 13 62.290 0.400 . 1 . . . . 118 THR CA . 7356 1 454 . 1 1 118 118 THR CB C 13 71.492 0.400 . 1 . . . . 118 THR CB . 7356 1 455 . 1 1 118 118 THR N N 15 113.507 0.400 . 1 . . . . 118 THR N . 7356 1 456 . 1 1 119 119 TYR H H 1 9.094 0.040 . 1 . . . . 119 TYR H . 7356 1 457 . 1 1 119 119 TYR CA C 13 58.645 0.400 . 1 . . . . 119 TYR CA . 7356 1 458 . 1 1 119 119 TYR CB C 13 43.136 0.400 . 1 . . . . 119 TYR CB . 7356 1 459 . 1 1 119 119 TYR N N 15 126.421 0.400 . 1 . . . . 119 TYR N . 7356 1 460 . 1 1 120 120 GLU H H 1 9.597 0.040 . 1 . . . . 120 GLU H . 7356 1 461 . 1 1 120 120 GLU CA C 13 56.369 0.400 . 1 . . . . 120 GLU CA . 7356 1 462 . 1 1 120 120 GLU CB C 13 28.888 0.400 . 1 . . . . 120 GLU CB . 7356 1 463 . 1 1 120 120 GLU N N 15 125.937 0.400 . 1 . . . . 120 GLU N . 7356 1 464 . 1 1 121 121 GLY H H 1 8.627 0.040 . 1 . . . . 121 GLY H . 7356 1 465 . 1 1 121 121 GLY CA C 13 45.386 0.400 . 1 . . . . 121 GLY CA . 7356 1 466 . 1 1 121 121 GLY N N 15 102.742 0.400 . 1 . . . . 121 GLY N . 7356 1 467 . 1 1 122 122 VAL H H 1 8.411 0.040 . 1 . . . . 122 VAL H . 7356 1 468 . 1 1 122 122 VAL CA C 13 62.287 0.400 . 1 . . . . 122 VAL CA . 7356 1 469 . 1 1 122 122 VAL CB C 13 33.044 0.400 . 1 . . . . 122 VAL CB . 7356 1 470 . 1 1 122 122 VAL N N 15 123.750 0.400 . 1 . . . . 122 VAL N . 7356 1 471 . 1 1 123 123 GLU H H 1 8.619 0.040 . 1 . . . . 123 GLU H . 7356 1 472 . 1 1 123 123 GLU CA C 13 53.976 0.400 . 1 . . . . 123 GLU CA . 7356 1 473 . 1 1 123 123 GLU CB C 13 33.970 0.400 . 1 . . . . 123 GLU CB . 7356 1 474 . 1 1 123 123 GLU N N 15 126.728 0.400 . 1 . . . . 123 GLU N . 7356 1 475 . 1 1 124 124 ALA H H 1 8.881 0.040 . 1 . . . . 124 ALA H . 7356 1 476 . 1 1 124 124 ALA CA C 13 51.025 0.400 . 1 . . . . 124 ALA CA . 7356 1 477 . 1 1 124 124 ALA CB C 13 23.982 0.400 . 1 . . . . 124 ALA CB . 7356 1 478 . 1 1 124 124 ALA N N 15 125.410 0.400 . 1 . . . . 124 ALA N . 7356 1 479 . 1 1 125 125 LYS H H 1 8.952 0.040 . 1 . . . . 125 LYS H . 7356 1 480 . 1 1 125 125 LYS CA C 13 54.468 0.400 . 1 . . . . 125 LYS CA . 7356 1 481 . 1 1 125 125 LYS CB C 13 38.223 0.400 . 1 . . . . 125 LYS CB . 7356 1 482 . 1 1 125 125 LYS N N 15 115.495 0.400 . 1 . . . . 125 LYS N . 7356 1 483 . 1 1 126 126 ARG H H 1 9.005 0.040 . 1 . . . . 126 ARG H . 7356 1 484 . 1 1 126 126 ARG CA C 13 56.505 0.400 . 1 . . . . 126 ARG CA . 7356 1 485 . 1 1 126 126 ARG CB C 13 33.275 0.400 . 1 . . . . 126 ARG CB . 7356 1 486 . 1 1 126 126 ARG N N 15 118.591 0.400 . 1 . . . . 126 ARG N . 7356 1 487 . 1 1 127 127 ILE H H 1 8.871 0.040 . 1 . . . . 127 ILE H . 7356 1 488 . 1 1 127 127 ILE CA C 13 61.247 0.400 . 1 . . . . 127 ILE CA . 7356 1 489 . 1 1 127 127 ILE CB C 13 39.914 0.400 . 1 . . . . 127 ILE CB . 7356 1 490 . 1 1 127 127 ILE N N 15 123.772 0.400 . 1 . . . . 127 ILE N . 7356 1 491 . 1 1 128 128 PHE H H 1 9.947 0.040 . 1 . . . . 128 PHE H . 7356 1 492 . 1 1 128 128 PHE CA C 13 55.981 0.400 . 1 . . . . 128 PHE CA . 7356 1 493 . 1 1 128 128 PHE CB C 13 42.842 0.400 . 1 . . . . 128 PHE CB . 7356 1 494 . 1 1 128 128 PHE N N 15 126.932 0.400 . 1 . . . . 128 PHE N . 7356 1 495 . 1 1 129 129 LYS H H 1 8.979 0.040 . 1 . . . . 129 LYS H . 7356 1 496 . 1 1 129 129 LYS CA C 13 54.968 0.400 . 1 . . . . 129 LYS CA . 7356 1 497 . 1 1 129 129 LYS CB C 13 35.991 0.400 . 1 . . . . 129 LYS CB . 7356 1 498 . 1 1 129 129 LYS N N 15 119.490 0.400 . 1 . . . . 129 LYS N . 7356 1 499 . 1 1 130 130 LYS H H 1 8.610 0.040 . 1 . . . . 130 LYS H . 7356 1 500 . 1 1 130 130 LYS CA C 13 56.782 0.400 . 1 . . . . 130 LYS CA . 7356 1 501 . 1 1 130 130 LYS CB C 13 33.280 0.400 . 1 . . . . 130 LYS CB . 7356 1 502 . 1 1 130 130 LYS N N 15 125.840 0.400 . 1 . . . . 130 LYS N . 7356 1 503 . 1 1 131 131 GLU H H 1 8.411 0.040 . 1 . . . . 131 GLU H . 7356 1 504 . 1 1 131 131 GLU CA C 13 58.428 0.400 . 1 . . . . 131 GLU CA . 7356 1 stop_ save_