################################### # 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_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15277 _Assigned_chem_shift_list.ID 1 _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 $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 '2D 1H-15N HSQC' . . . 15277 1 2 '3D HNCO' . . . 15277 1 3 '3D HNCA' . . . 15277 1 4 '3D HN(CO)CA' . . . 15277 1 5 '3D CBCA(CO)NH' . . . 15277 1 6 '3D HNCACB' . . . 15277 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 2 2 GLU C C 13 174.570 0.100 . 1 . . . . 30 GLU C . 15277 1 2 . 1 1 2 2 GLU CA C 13 55.670 0.100 . 1 . . . . 30 GLU CA . 15277 1 3 . 1 1 3 3 LEU H H 1 8.950 0.030 . 1 . . . . 31 LEU H . 15277 1 4 . 1 1 3 3 LEU CA C 13 53.420 0.100 . 1 . . . . 31 LEU CA . 15277 1 5 . 1 1 3 3 LEU N N 15 126.940 0.050 . 1 . . . . 31 LEU N . 15277 1 6 . 1 1 4 4 THR H H 1 8.620 0.030 . 1 . . . . 32 THR H . 15277 1 7 . 1 1 4 4 THR C C 13 174.370 0.100 . 1 . . . . 32 THR C . 15277 1 8 . 1 1 4 4 THR CA C 13 62.550 0.100 . 1 . . . . 32 THR CA . 15277 1 9 . 1 1 4 4 THR N N 15 118.800 0.050 . 1 . . . . 32 THR N . 15277 1 10 . 1 1 5 5 LEU H H 1 8.980 0.030 . 1 . . . . 33 LEU H . 15277 1 11 . 1 1 5 5 LEU CA C 13 54.600 0.100 . 1 . . . . 33 LEU CA . 15277 1 12 . 1 1 5 5 LEU N N 15 125.260 0.050 . 1 . . . . 33 LEU N . 15277 1 13 . 1 1 6 6 TYR H H 1 9.840 0.030 . 1 . . . . 34 TYR H . 15277 1 14 . 1 1 6 6 TYR C C 13 174.440 0.100 . 1 . . . . 34 TYR C . 15277 1 15 . 1 1 6 6 TYR CA C 13 60.260 0.100 . 1 . . . . 34 TYR CA . 15277 1 16 . 1 1 6 6 TYR N N 15 120.300 0.050 . 1 . . . . 34 TYR N . 15277 1 17 . 1 1 7 7 ASN H H 1 6.580 0.030 . 1 . . . . 35 ASN H . 15277 1 18 . 1 1 7 7 ASN C C 13 176.490 0.100 . 1 . . . . 35 ASN C . 15277 1 19 . 1 1 7 7 ASN CA C 13 50.590 0.100 . 1 . . . . 35 ASN CA . 15277 1 20 . 1 1 7 7 ASN CB C 13 36.940 0.100 . 1 . . . . 35 ASN CB . 15277 1 21 . 1 1 7 7 ASN N N 15 116.930 0.050 . 1 . . . . 35 ASN N . 15277 1 22 . 1 1 8 8 GLY H H 1 7.950 0.030 . 1 . . . . 36 GLY H . 15277 1 23 . 1 1 8 8 GLY C C 13 173.830 0.100 . 1 . . . . 36 GLY C . 15277 1 24 . 1 1 8 8 GLY CA C 13 45.010 0.100 . 1 . . . . 36 GLY CA . 15277 1 25 . 1 1 8 8 GLY N N 15 108.780 0.050 . 1 . . . . 36 GLY N . 15277 1 26 . 1 1 9 9 GLU H H 1 7.120 0.030 . 1 . . . . 37 GLU H . 15277 1 27 . 1 1 9 9 GLU C C 13 174.690 0.100 . 1 . . . . 37 GLU C . 15277 1 28 . 1 1 9 9 GLU CA C 13 56.110 0.100 . 1 . . . . 37 GLU CA . 15277 1 29 . 1 1 9 9 GLU CB C 13 30.550 0.100 . 1 . . . . 37 GLU CB . 15277 1 30 . 1 1 9 9 GLU N N 15 120.240 0.050 . 1 . . . . 37 GLU N . 15277 1 31 . 1 1 10 10 LYS H H 1 8.400 0.030 . 1 . . . . 38 LYS H . 15277 1 32 . 1 1 10 10 LYS C C 13 176.870 0.100 . 1 . . . . 38 LYS C . 15277 1 33 . 1 1 10 10 LYS CA C 13 54.980 0.100 . 1 . . . . 38 LYS CA . 15277 1 34 . 1 1 10 10 LYS CB C 13 34.440 0.100 . 1 . . . . 38 LYS CB . 15277 1 35 . 1 1 10 10 LYS N N 15 121.320 0.050 . 1 . . . . 38 LYS N . 15277 1 36 . 1 1 11 11 LYS H H 1 8.830 0.030 . 1 . . . . 39 LYS H . 15277 1 37 . 1 1 11 11 LYS C C 13 173.900 0.100 . 1 . . . . 39 LYS C . 15277 1 38 . 1 1 11 11 LYS CA C 13 55.710 0.100 . 1 . . . . 39 LYS CA . 15277 1 39 . 1 1 11 11 LYS CB C 13 37.170 0.100 . 1 . . . . 39 LYS CB . 15277 1 40 . 1 1 11 11 LYS N N 15 123.710 0.050 . 1 . . . . 39 LYS N . 15277 1 41 . 1 1 12 12 THR H H 1 8.390 0.030 . 1 . . . . 40 THR H . 15277 1 42 . 1 1 12 12 THR C C 13 172.900 0.100 . 1 . . . . 40 THR C . 15277 1 43 . 1 1 12 12 THR CA C 13 61.890 0.100 . 1 . . . . 40 THR CA . 15277 1 44 . 1 1 12 12 THR CB C 13 69.770 0.100 . 1 . . . . 40 THR CB . 15277 1 45 . 1 1 12 12 THR N N 15 118.830 0.050 . 1 . . . . 40 THR N . 15277 1 46 . 1 1 13 13 PHE H H 1 8.600 0.030 . 1 . . . . 41 PHE H . 15277 1 47 . 1 1 13 13 PHE CA C 13 55.880 0.100 . 1 . . . . 41 PHE CA . 15277 1 48 . 1 1 13 13 PHE CB C 13 42.850 0.100 . 1 . . . . 41 PHE CB . 15277 1 49 . 1 1 13 13 PHE N N 15 124.240 0.050 . 1 . . . . 41 PHE N . 15277 1 50 . 1 1 14 14 TYR H H 1 8.810 0.030 . 1 . . . . 42 TYR H . 15277 1 51 . 1 1 14 14 TYR C C 13 175.420 0.100 . 1 . . . . 42 TYR C . 15277 1 52 . 1 1 14 14 TYR CA C 13 54.400 0.100 . 1 . . . . 42 TYR CA . 15277 1 53 . 1 1 14 14 TYR CB C 13 40.460 0.100 . 1 . . . . 42 TYR CB . 15277 1 54 . 1 1 14 14 TYR N N 15 120.700 0.050 . 1 . . . . 42 TYR N . 15277 1 55 . 1 1 15 15 SER H H 1 8.700 0.030 . 1 . . . . 43 SER H . 15277 1 56 . 1 1 15 15 SER C C 13 172.700 0.100 . 1 . . . . 43 SER C . 15277 1 57 . 1 1 15 15 SER CA C 13 59.990 0.100 . 1 . . . . 43 SER CA . 15277 1 58 . 1 1 15 15 SER CB C 13 64.670 0.100 . 1 . . . . 43 SER CB . 15277 1 59 . 1 1 15 15 SER N N 15 117.210 0.050 . 1 . . . . 43 SER N . 15277 1 60 . 1 1 16 16 ARG H H 1 7.330 0.030 . 1 . . . . 44 ARG H . 15277 1 61 . 1 1 16 16 ARG CA C 13 49.850 0.100 . 1 . . . . 44 ARG CA . 15277 1 62 . 1 1 16 16 ARG N N 15 119.610 0.050 . 1 . . . . 44 ARG N . 15277 1 63 . 1 1 17 17 PRO C C 13 177.800 0.100 . 1 . . . . 45 PRO C . 15277 1 64 . 1 1 17 17 PRO CA C 13 61.340 0.100 . 1 . . . . 45 PRO CA . 15277 1 65 . 1 1 17 17 PRO CB C 13 32.640 0.100 . 1 . . . . 45 PRO CB . 15277 1 66 . 1 1 18 18 ASN H H 1 9.210 0.030 . 1 . . . . 46 ASN H . 15277 1 67 . 1 1 18 18 ASN CA C 13 51.000 0.100 . 1 . . . . 46 ASN CA . 15277 1 68 . 1 1 18 18 ASN N N 15 119.950 0.050 . 1 . . . . 46 ASN N . 15277 1 69 . 1 1 19 19 ASN C C 13 174.980 0.100 . 1 . . . . 47 ASN C . 15277 1 70 . 1 1 19 19 ASN CA C 13 52.280 0.100 . 1 . . . . 47 ASN CA . 15277 1 71 . 1 1 19 19 ASN CB C 13 39.440 0.100 . 1 . . . . 47 ASN CB . 15277 1 72 . 1 1 20 20 HIS H H 1 8.620 0.030 . 1 . . . . 48 HIS H . 15277 1 73 . 1 1 20 20 HIS CA C 13 56.010 0.100 . 1 . . . . 48 HIS CA . 15277 1 74 . 1 1 20 20 HIS N N 15 120.560 0.050 . 1 . . . . 48 HIS N . 15277 1 75 . 1 1 21 21 ASP H H 1 8.840 0.030 . 1 . . . . 49 ASP H . 15277 1 76 . 1 1 21 21 ASP CA C 13 56.040 0.100 . 1 . . . . 49 ASP CA . 15277 1 77 . 1 1 21 21 ASP CB C 13 39.530 0.100 . 1 . . . . 49 ASP CB . 15277 1 78 . 1 1 21 21 ASP N N 15 121.300 0.050 . 1 . . . . 49 ASP N . 15277 1 79 . 1 1 22 22 ASN H H 1 8.250 0.030 . 1 . . . . 50 ASN H . 15277 1 80 . 1 1 22 22 ASN CA C 13 53.670 0.100 . 1 . . . . 50 ASN CA . 15277 1 81 . 1 1 22 22 ASN N N 15 104.900 0.050 . 1 . . . . 50 ASN N . 15277 1 82 . 1 1 23 23 ALA H H 1 8.690 0.030 . 1 . . . . 51 ALA H . 15277 1 83 . 1 1 23 23 ALA CA C 13 55.630 0.100 . 1 . . . . 51 ALA CA . 15277 1 84 . 1 1 23 23 ALA N N 15 127.200 0.050 . 1 . . . . 51 ALA N . 15277 1 85 . 1 1 26 26 ASN C C 13 176.360 0.100 . 1 . . . . 54 ASN C . 15277 1 86 . 1 1 26 26 ASN CA C 13 55.860 0.100 . 1 . . . . 54 ASN CA . 15277 1 87 . 1 1 27 27 ALA H H 1 8.290 0.030 . 1 . . . . 55 ALA H . 15277 1 88 . 1 1 27 27 ALA C C 13 179.310 0.100 . 1 . . . . 55 ALA C . 15277 1 89 . 1 1 27 27 ALA CA C 13 55.440 0.100 . 1 . . . . 55 ALA CA . 15277 1 90 . 1 1 27 27 ALA CB C 13 18.210 0.100 . 1 . . . . 55 ALA CB . 15277 1 91 . 1 1 27 27 ALA N N 15 119.800 0.050 . 1 . . . . 55 ALA N . 15277 1 92 . 1 1 28 28 ILE H H 1 6.950 0.030 . 1 . . . . 56 ILE H . 15277 1 93 . 1 1 28 28 ILE CA C 13 66.090 0.100 . 1 . . . . 56 ILE CA . 15277 1 94 . 1 1 28 28 ILE N N 15 117.520 0.050 . 1 . . . . 56 ILE N . 15277 1 95 . 1 1 29 29 LEU H H 1 8.670 0.030 . 1 . . . . 57 LEU H . 15277 1 96 . 1 1 29 29 LEU C C 13 180.080 0.100 . 1 . . . . 57 LEU C . 15277 1 97 . 1 1 29 29 LEU CA C 13 58.280 0.100 . 1 . . . . 57 LEU CA . 15277 1 98 . 1 1 29 29 LEU N N 15 119.200 0.050 . 1 . . . . 57 LEU N . 15277 1 99 . 1 1 30 30 GLN H H 1 8.100 0.030 . 1 . . . . 58 GLN H . 15277 1 100 . 1 1 30 30 GLN C C 13 177.780 0.100 . 1 . . . . 58 GLN C . 15277 1 101 . 1 1 30 30 GLN CA C 13 56.940 0.100 . 1 . . . . 58 GLN CA . 15277 1 102 . 1 1 30 30 GLN N N 15 116.120 0.050 . 1 . . . . 58 GLN N . 15277 1 103 . 1 1 31 31 LEU H H 1 7.730 0.030 . 1 . . . . 59 LEU H . 15277 1 104 . 1 1 31 31 LEU CA C 13 58.200 0.100 . 1 . . . . 59 LEU CA . 15277 1 105 . 1 1 31 31 LEU N N 15 120.170 0.050 . 1 . . . . 59 LEU N . 15277 1 106 . 1 1 32 32 PHE H H 1 9.100 0.030 . 1 . . . . 60 PHE H . 15277 1 107 . 1 1 32 32 PHE C C 13 178.200 0.100 . 1 . . . . 60 PHE C . 15277 1 108 . 1 1 32 32 PHE CA C 13 56.920 0.100 . 1 . . . . 60 PHE CA . 15277 1 109 . 1 1 32 32 PHE N N 15 117.500 0.050 . 1 . . . . 60 PHE N . 15277 1 110 . 1 1 33 33 ARG H H 1 7.970 0.030 . 1 . . . . 61 ARG H . 15277 1 111 . 1 1 33 33 ARG CA C 13 57.670 0.100 . 1 . . . . 61 ARG CA . 15277 1 112 . 1 1 33 33 ARG N N 15 123.130 0.050 . 1 . . . . 61 ARG N . 15277 1 113 . 1 1 34 34 TYR H H 1 8.600 0.030 . 1 . . . . 62 TYR H . 15277 1 114 . 1 1 34 34 TYR C C 13 177.100 0.100 . 1 . . . . 62 TYR C . 15277 1 115 . 1 1 34 34 TYR CA C 13 63.330 0.100 . 1 . . . . 62 TYR CA . 15277 1 116 . 1 1 34 34 TYR N N 15 121.400 0.050 . 1 . . . . 62 TYR N . 15277 1 117 . 1 1 35 35 VAL H H 1 8.220 0.030 . 1 . . . . 63 VAL H . 15277 1 118 . 1 1 35 35 VAL C C 13 174.920 0.100 . 1 . . . . 63 VAL C . 15277 1 119 . 1 1 35 35 VAL CA C 13 60.780 0.100 . 1 . . . . 63 VAL CA . 15277 1 120 . 1 1 35 35 VAL N N 15 106.830 0.050 . 1 . . . . 63 VAL N . 15277 1 121 . 1 1 36 36 GLU H H 1 7.650 0.030 . 1 . . . . 64 GLU H . 15277 1 122 . 1 1 36 36 GLU C C 13 175.220 0.100 . 1 . . . . 64 GLU C . 15277 1 123 . 1 1 36 36 GLU CA C 13 57.190 0.100 . 1 . . . . 64 GLU CA . 15277 1 124 . 1 1 36 36 GLU CB C 13 25.240 0.100 . 1 . . . . 64 GLU CB . 15277 1 125 . 1 1 36 36 GLU N N 15 118.840 0.050 . 1 . . . . 64 GLU N . 15277 1 126 . 1 1 37 37 GLU H H 1 8.700 0.030 . 1 . . . . 65 GLU H . 15277 1 127 . 1 1 37 37 GLU CA C 13 51.780 0.100 . 1 . . . . 65 GLU CA . 15277 1 128 . 1 1 37 37 GLU N N 15 122.780 0.050 . 1 . . . . 65 GLU N . 15277 1 129 . 1 1 39 39 PHE C C 13 175.450 0.100 . 1 . . . . 67 PHE C . 15277 1 130 . 1 1 39 39 PHE CA C 13 63.380 0.100 . 1 . . . . 67 PHE CA . 15277 1 131 . 1 1 40 40 PHE H H 1 8.740 0.030 . 1 . . . . 68 PHE H . 15277 1 132 . 1 1 40 40 PHE CA C 13 55.250 0.100 . 1 . . . . 68 PHE CA . 15277 1 133 . 1 1 40 40 PHE N N 15 110.820 0.050 . 1 . . . . 68 PHE N . 15277 1 134 . 1 1 41 41 ASP H H 1 8.550 0.030 . 1 . . . . 69 ASP H . 15277 1 135 . 1 1 41 41 ASP C C 13 177.860 0.100 . 1 . . . . 69 ASP C . 15277 1 136 . 1 1 41 41 ASP CA C 13 58.810 0.100 . 1 . . . . 69 ASP CA . 15277 1 137 . 1 1 41 41 ASP N N 15 125.400 0.050 . 1 . . . . 69 ASP N . 15277 1 138 . 1 1 42 42 TRP H H 1 7.960 0.030 . 1 . . . . 70 TRP H . 15277 1 139 . 1 1 42 42 TRP C C 13 176.380 0.100 . 1 . . . . 70 TRP C . 15277 1 140 . 1 1 42 42 TRP CA C 13 57.740 0.100 . 1 . . . . 70 TRP CA . 15277 1 141 . 1 1 42 42 TRP N N 15 116.540 0.050 . 1 . . . . 70 TRP N . 15277 1 142 . 1 1 43 43 VAL H H 1 6.370 0.030 . 1 . . . . 71 VAL H . 15277 1 143 . 1 1 43 43 VAL CA C 13 63.730 0.100 . 1 . . . . 71 VAL CA . 15277 1 144 . 1 1 43 43 VAL N N 15 118.930 0.050 . 1 . . . . 71 VAL N . 15277 1 145 . 1 1 44 44 TYR C C 13 176.750 0.100 . 1 . . . . 72 TYR C . 15277 1 146 . 1 1 44 44 TYR CA C 13 62.280 0.100 . 1 . . . . 72 TYR CA . 15277 1 147 . 1 1 45 45 SER H H 1 8.260 0.030 . 1 . . . . 73 SER H . 15277 1 148 . 1 1 45 45 SER C C 13 174.010 0.100 . 1 . . . . 73 SER C . 15277 1 149 . 1 1 45 45 SER CA C 13 58.430 0.100 . 1 . . . . 73 SER CA . 15277 1 150 . 1 1 45 45 SER CB C 13 63.740 0.100 . 1 . . . . 73 SER CB . 15277 1 151 . 1 1 45 45 SER N N 15 107.720 0.050 . 1 . . . . 73 SER N . 15277 1 152 . 1 1 46 46 SER H H 1 6.660 0.030 . 1 . . . . 74 SER H . 15277 1 153 . 1 1 46 46 SER CA C 13 55.590 0.100 . 1 . . . . 74 SER CA . 15277 1 154 . 1 1 46 46 SER CB C 13 64.180 0.100 . 1 . . . . 74 SER CB . 15277 1 155 . 1 1 46 46 SER N N 15 115.920 0.050 . 1 . . . . 74 SER N . 15277 1 156 . 1 1 49 49 ASN C C 13 176.330 0.100 . 1 . . . . 77 ASN C . 15277 1 157 . 1 1 49 49 ASN CA C 13 52.650 0.100 . 1 . . . . 77 ASN CA . 15277 1 158 . 1 1 50 50 LEU H H 1 8.390 0.030 . 1 . . . . 78 LEU H . 15277 1 159 . 1 1 50 50 LEU C C 13 176.250 0.100 . 1 . . . . 78 LEU C . 15277 1 160 . 1 1 50 50 LEU CA C 13 53.970 0.100 . 1 . . . . 78 LEU CA . 15277 1 161 . 1 1 50 50 LEU N N 15 127.960 0.050 . 1 . . . . 78 LEU N . 15277 1 162 . 1 1 51 51 THR H H 1 7.720 0.030 . 1 . . . . 79 THR H . 15277 1 163 . 1 1 51 51 THR C C 13 175.210 0.100 . 1 . . . . 79 THR C . 15277 1 164 . 1 1 51 51 THR CA C 13 68.450 0.100 . 1 . . . . 79 THR CA . 15277 1 165 . 1 1 51 51 THR N N 15 116.270 0.050 . 1 . . . . 79 THR N . 15277 1 166 . 1 1 52 52 LEU H H 1 8.550 0.030 . 1 . . . . 80 LEU H . 15277 1 167 . 1 1 52 52 LEU C C 13 179.160 0.100 . 1 . . . . 80 LEU C . 15277 1 168 . 1 1 52 52 LEU CA C 13 58.200 0.100 . 1 . . . . 80 LEU CA . 15277 1 169 . 1 1 52 52 LEU N N 15 118.750 0.050 . 1 . . . . 80 LEU N . 15277 1 170 . 1 1 53 53 GLU H H 1 8.190 0.030 . 1 . . . . 81 GLU H . 15277 1 171 . 1 1 53 53 GLU C C 13 179.670 0.100 . 1 . . . . 81 GLU C . 15277 1 172 . 1 1 53 53 GLU CA C 13 59.930 0.100 . 1 . . . . 81 GLU CA . 15277 1 173 . 1 1 53 53 GLU N N 15 120.870 0.050 . 1 . . . . 81 GLU N . 15277 1 174 . 1 1 54 54 ALA H H 1 7.970 0.030 . 1 . . . . 82 ALA H . 15277 1 175 . 1 1 54 54 ALA CA C 13 55.380 0.100 . 1 . . . . 82 ALA CA . 15277 1 176 . 1 1 54 54 ALA CB C 13 18.140 0.100 . 1 . . . . 82 ALA CB . 15277 1 177 . 1 1 54 54 ALA N N 15 123.130 0.050 . 1 . . . . 82 ALA N . 15277 1 178 . 1 1 55 55 ILE H H 1 8.400 0.030 . 1 . . . . 83 ILE H . 15277 1 179 . 1 1 55 55 ILE C C 13 177.390 0.100 . 1 . . . . 83 ILE C . 15277 1 180 . 1 1 55 55 ILE CA C 13 67.620 0.100 . 1 . . . . 83 ILE CA . 15277 1 181 . 1 1 55 55 ILE N N 15 118.400 0.050 . 1 . . . . 83 ILE N . 15277 1 182 . 1 1 56 56 LYS H H 1 8.180 0.030 . 1 . . . . 84 LYS H . 15277 1 183 . 1 1 56 56 LYS C C 13 179.010 0.100 . 1 . . . . 84 LYS C . 15277 1 184 . 1 1 56 56 LYS CA C 13 59.610 0.100 . 1 . . . . 84 LYS CA . 15277 1 185 . 1 1 56 56 LYS N N 15 119.390 0.050 . 1 . . . . 84 LYS N . 15277 1 186 . 1 1 57 57 GLN H H 1 7.970 0.030 . 1 . . . . 85 GLN H . 15277 1 187 . 1 1 57 57 GLN CA C 13 59.480 0.100 . 1 . . . . 85 GLN CA . 15277 1 188 . 1 1 57 57 GLN N N 15 118.320 0.050 . 1 . . . . 85 GLN N . 15277 1 189 . 1 1 58 58 LEU H H 1 8.700 0.030 . 1 . . . . 86 LEU H . 15277 1 190 . 1 1 58 58 LEU C C 13 181.210 0.100 . 1 . . . . 86 LEU C . 15277 1 191 . 1 1 58 58 LEU CA C 13 58.130 0.100 . 1 . . . . 86 LEU CA . 15277 1 192 . 1 1 58 58 LEU N N 15 117.900 0.050 . 1 . . . . 86 LEU N . 15277 1 193 . 1 1 59 59 GLU H H 1 9.270 0.030 . 1 . . . . 87 GLU H . 15277 1 194 . 1 1 59 59 GLU C C 13 179.570 0.100 . 1 . . . . 87 GLU C . 15277 1 195 . 1 1 59 59 GLU CA C 13 60.900 0.100 . 1 . . . . 87 GLU CA . 15277 1 196 . 1 1 59 59 GLU CB C 13 29.730 0.100 . 1 . . . . 87 GLU CB . 15277 1 197 . 1 1 59 59 GLU N N 15 126.240 0.050 . 1 . . . . 87 GLU N . 15277 1 198 . 1 1 60 60 ASP H H 1 8.040 0.030 . 1 . . . . 88 ASP H . 15277 1 199 . 1 1 60 60 ASP C C 13 178.930 0.100 . 1 . . . . 88 ASP C . 15277 1 200 . 1 1 60 60 ASP CA C 13 57.520 0.100 . 1 . . . . 88 ASP CA . 15277 1 201 . 1 1 60 60 ASP CB C 13 40.670 0.100 . 1 . . . . 88 ASP CB . 15277 1 202 . 1 1 60 60 ASP N N 15 121.010 0.050 . 1 . . . . 88 ASP N . 15277 1 203 . 1 1 61 61 LEU H H 1 8.310 0.030 . 1 . . . . 89 LEU H . 15277 1 204 . 1 1 61 61 LEU C C 13 179.200 0.100 . 1 . . . . 89 LEU C . 15277 1 205 . 1 1 61 61 LEU CA C 13 57.230 0.100 . 1 . . . . 89 LEU CA . 15277 1 206 . 1 1 61 61 LEU N N 15 116.330 0.050 . 1 . . . . 89 LEU N . 15277 1 207 . 1 1 62 62 THR H H 1 8.190 0.030 . 1 . . . . 90 THR H . 15277 1 208 . 1 1 62 62 THR C C 13 176.090 0.100 . 1 . . . . 90 THR C . 15277 1 209 . 1 1 62 62 THR CA C 13 62.780 0.100 . 1 . . . . 90 THR CA . 15277 1 210 . 1 1 62 62 THR N N 15 104.600 0.050 . 1 . . . . 90 THR N . 15277 1 211 . 1 1 63 63 GLY H H 1 8.380 0.030 . 1 . . . . 91 GLY H . 15277 1 212 . 1 1 63 63 GLY C C 13 173.760 0.100 . 1 . . . . 91 GLY C . 15277 1 213 . 1 1 63 63 GLY CA C 13 46.020 0.100 . 1 . . . . 91 GLY CA . 15277 1 214 . 1 1 63 63 GLY N N 15 111.930 0.050 . 1 . . . . 91 GLY N . 15277 1 215 . 1 1 64 64 LEU H H 1 7.740 0.030 . 1 . . . . 92 LEU H . 15277 1 216 . 1 1 64 64 LEU C C 13 175.860 0.100 . 1 . . . . 92 LEU C . 15277 1 217 . 1 1 64 64 LEU CA C 13 53.800 0.100 . 1 . . . . 92 LEU CA . 15277 1 218 . 1 1 64 64 LEU N N 15 120.120 0.050 . 1 . . . . 92 LEU N . 15277 1 219 . 1 1 65 65 GLU H H 1 8.070 0.030 . 1 . . . . 93 GLU H . 15277 1 220 . 1 1 65 65 GLU CA C 13 56.220 0.100 . 1 . . . . 93 GLU CA . 15277 1 221 . 1 1 65 65 GLU CB C 13 29.820 0.100 . 1 . . . . 93 GLU CB . 15277 1 222 . 1 1 65 65 GLU N N 15 121.060 0.050 . 1 . . . . 93 GLU N . 15277 1 223 . 1 1 66 66 LEU H H 1 10.310 0.030 . 1 . . . . 94 LEU H . 15277 1 224 . 1 1 66 66 LEU CA C 13 54.310 0.100 . 1 . . . . 94 LEU CA . 15277 1 225 . 1 1 66 66 LEU N N 15 128.200 0.050 . 1 . . . . 94 LEU N . 15277 1 226 . 1 1 67 67 HIS H H 1 8.830 0.030 . 1 . . . . 95 HIS H . 15277 1 227 . 1 1 67 67 HIS CA C 13 59.210 0.100 . 1 . . . . 95 HIS CA . 15277 1 228 . 1 1 67 67 HIS CB C 13 29.490 0.100 . 1 . . . . 95 HIS CB . 15277 1 229 . 1 1 67 67 HIS N N 15 117.300 0.050 . 1 . . . . 95 HIS N . 15277 1 230 . 1 1 68 68 GLU H H 1 8.760 0.030 . 1 . . . . 96 GLU H . 15277 1 231 . 1 1 68 68 GLU CA C 13 54.440 0.100 . 1 . . . . 96 GLU CA . 15277 1 232 . 1 1 68 68 GLU CB C 13 29.870 0.100 . 1 . . . . 96 GLU CB . 15277 1 233 . 1 1 68 68 GLU N N 15 123.800 0.050 . 1 . . . . 96 GLU N . 15277 1 234 . 1 1 69 69 GLY H H 1 8.420 0.030 . 1 . . . . 97 GLY H . 15277 1 235 . 1 1 69 69 GLY CA C 13 44.240 0.100 . 1 . . . . 97 GLY CA . 15277 1 236 . 1 1 69 69 GLY N N 15 110.200 0.050 . 1 . . . . 97 GLY N . 15277 1 237 . 1 1 70 70 GLY H H 1 7.810 0.030 . 1 . . . . 98 GLY H . 15277 1 238 . 1 1 70 70 GLY CA C 13 44.250 0.100 . 1 . . . . 98 GLY CA . 15277 1 239 . 1 1 70 70 GLY N N 15 104.200 0.050 . 1 . . . . 98 GLY N . 15277 1 240 . 1 1 72 72 PRO CA C 13 66.430 0.100 . 1 . . . . 100 PRO CA . 15277 1 241 . 1 1 72 72 PRO CB C 13 31.640 0.100 . 1 . . . . 100 PRO CB . 15277 1 242 . 1 1 73 73 ALA H H 1 9.380 0.030 . 1 . . . . 101 ALA H . 15277 1 243 . 1 1 73 73 ALA CA C 13 55.290 0.100 . 1 . . . . 101 ALA CA . 15277 1 244 . 1 1 73 73 ALA CB C 13 18.960 0.100 . 1 . . . . 101 ALA CB . 15277 1 245 . 1 1 73 73 ALA N N 15 117.800 0.050 . 1 . . . . 101 ALA N . 15277 1 246 . 1 1 74 74 LEU H H 1 6.570 0.030 . 1 . . . . 102 LEU H . 15277 1 247 . 1 1 74 74 LEU CA C 13 56.690 0.100 . 1 . . . . 102 LEU CA . 15277 1 248 . 1 1 74 74 LEU CB C 13 40.900 0.100 . 1 . . . . 102 LEU CB . 15277 1 249 . 1 1 74 74 LEU N N 15 114.400 0.050 . 1 . . . . 102 LEU N . 15277 1 250 . 1 1 75 75 VAL H H 1 7.820 0.030 . 1 . . . . 103 VAL H . 15277 1 251 . 1 1 75 75 VAL CA C 13 67.850 0.100 . 1 . . . . 103 VAL CA . 15277 1 252 . 1 1 75 75 VAL N N 15 119.500 0.050 . 1 . . . . 103 VAL N . 15277 1 253 . 1 1 76 76 ILE H H 1 7.590 0.030 . 1 . . . . 104 ILE H . 15277 1 254 . 1 1 76 76 ILE CA C 13 65.540 0.100 . 1 . . . . 104 ILE CA . 15277 1 255 . 1 1 76 76 ILE N N 15 114.900 0.050 . 1 . . . . 104 ILE N . 15277 1 256 . 1 1 77 77 TRP H H 1 8.170 0.030 . 1 . . . . 105 TRP H . 15277 1 257 . 1 1 77 77 TRP C C 13 178.040 0.100 . 1 . . . . 105 TRP C . 15277 1 258 . 1 1 77 77 TRP CA C 13 60.560 0.100 . 1 . . . . 105 TRP CA . 15277 1 259 . 1 1 77 77 TRP N N 15 117.100 0.050 . 1 . . . . 105 TRP N . 15277 1 260 . 1 1 78 78 ASN H H 1 7.990 0.030 . 1 . . . . 106 ASN H . 15277 1 261 . 1 1 78 78 ASN C C 13 176.140 0.100 . 1 . . . . 106 ASN C . 15277 1 262 . 1 1 78 78 ASN CA C 13 55.350 0.100 . 1 . . . . 106 ASN CA . 15277 1 263 . 1 1 78 78 ASN N N 15 113.280 0.050 . 1 . . . . 106 ASN N . 15277 1 264 . 1 1 79 79 ILE H H 1 7.440 0.030 . 1 . . . . 107 ILE H . 15277 1 265 . 1 1 79 79 ILE C C 13 177.490 0.100 . 1 . . . . 107 ILE C . 15277 1 266 . 1 1 79 79 ILE CA C 13 60.960 0.100 . 1 . . . . 107 ILE CA . 15277 1 267 . 1 1 79 79 ILE CB C 13 38.540 0.100 . 1 . . . . 107 ILE CB . 15277 1 268 . 1 1 79 79 ILE N N 15 109.220 0.050 . 1 . . . . 107 ILE N . 15277 1 269 . 1 1 80 80 LYS H H 1 7.110 0.030 . 1 . . . . 108 LYS H . 15277 1 270 . 1 1 80 80 LYS C C 13 176.340 0.100 . 1 . . . . 108 LYS C . 15277 1 271 . 1 1 80 80 LYS CA C 13 59.640 0.100 . 1 . . . . 108 LYS CA . 15277 1 272 . 1 1 80 80 LYS CB C 13 32.010 0.100 . 1 . . . . 108 LYS CB . 15277 1 273 . 1 1 80 80 LYS N N 15 120.710 0.050 . 1 . . . . 108 LYS N . 15277 1 274 . 1 1 81 81 HIS H H 1 8.760 0.030 . 1 . . . . 109 HIS H . 15277 1 275 . 1 1 81 81 HIS C C 13 176.020 0.100 . 1 . . . . 109 HIS C . 15277 1 276 . 1 1 81 81 HIS CA C 13 57.650 0.100 . 1 . . . . 109 HIS CA . 15277 1 277 . 1 1 81 81 HIS N N 15 118.460 0.050 . 1 . . . . 109 HIS N . 15277 1 278 . 1 1 82 82 LEU H H 1 7.600 0.030 . 1 . . . . 110 LEU H . 15277 1 279 . 1 1 82 82 LEU C C 13 176.610 0.100 . 1 . . . . 110 LEU C . 15277 1 280 . 1 1 82 82 LEU CA C 13 53.850 0.100 . 1 . . . . 110 LEU CA . 15277 1 281 . 1 1 82 82 LEU N N 15 120.570 0.050 . 1 . . . . 110 LEU N . 15277 1 282 . 1 1 83 83 LEU H H 1 6.760 0.030 . 1 . . . . 111 LEU H . 15277 1 283 . 1 1 83 83 LEU CA C 13 53.250 0.100 . 1 . . . . 111 LEU CA . 15277 1 284 . 1 1 83 83 LEU N N 15 116.380 0.050 . 1 . . . . 111 LEU N . 15277 1 285 . 1 1 84 84 HIS H H 1 9.810 0.030 . 1 . . . . 112 HIS H . 15277 1 286 . 1 1 84 84 HIS C C 13 174.800 0.100 . 1 . . . . 112 HIS C . 15277 1 287 . 1 1 84 84 HIS CA C 13 56.560 0.100 . 1 . . . . 112 HIS CA . 15277 1 288 . 1 1 84 84 HIS N N 15 122.200 0.050 . 1 . . . . 112 HIS N . 15277 1 289 . 1 1 85 85 THR H H 1 7.410 0.030 . 1 . . . . 113 THR H . 15277 1 290 . 1 1 85 85 THR C C 13 173.510 0.100 . 1 . . . . 113 THR C . 15277 1 291 . 1 1 85 85 THR CA C 13 62.810 0.100 . 1 . . . . 113 THR CA . 15277 1 292 . 1 1 85 85 THR CB C 13 70.570 0.100 . 1 . . . . 113 THR CB . 15277 1 293 . 1 1 85 85 THR N N 15 118.430 0.050 . 1 . . . . 113 THR N . 15277 1 294 . 1 1 86 86 GLY H H 1 9.320 0.030 . 1 . . . . 114 GLY H . 15277 1 295 . 1 1 86 86 GLY C C 13 171.900 0.100 . 1 . . . . 114 GLY C . 15277 1 296 . 1 1 86 86 GLY CA C 13 46.720 0.100 . 1 . . . . 114 GLY CA . 15277 1 297 . 1 1 86 86 GLY N N 15 116.670 0.050 . 1 . . . . 114 GLY N . 15277 1 298 . 1 1 87 87 ILE H H 1 7.790 0.030 . 1 . . . . 115 ILE H . 15277 1 299 . 1 1 87 87 ILE C C 13 176.380 0.100 . 1 . . . . 115 ILE C . 15277 1 300 . 1 1 87 87 ILE CA C 13 57.050 0.100 . 1 . . . . 115 ILE CA . 15277 1 301 . 1 1 87 87 ILE N N 15 123.860 0.050 . 1 . . . . 115 ILE N . 15277 1 302 . 1 1 88 88 GLY H H 1 9.000 0.030 . 1 . . . . 116 GLY H . 15277 1 303 . 1 1 88 88 GLY C C 13 173.010 0.100 . 1 . . . . 116 GLY C . 15277 1 304 . 1 1 88 88 GLY CA C 13 43.700 0.100 . 1 . . . . 116 GLY CA . 15277 1 305 . 1 1 88 88 GLY N N 15 116.230 0.050 . 1 . . . . 116 GLY N . 15277 1 306 . 1 1 89 89 THR H H 1 8.040 0.030 . 1 . . . . 117 THR H . 15277 1 307 . 1 1 89 89 THR C C 13 175.720 0.100 . 1 . . . . 117 THR C . 15277 1 308 . 1 1 89 89 THR CA C 13 59.130 0.100 . 1 . . . . 117 THR CA . 15277 1 309 . 1 1 89 89 THR N N 15 111.880 0.050 . 1 . . . . 117 THR N . 15277 1 310 . 1 1 90 90 ALA H H 1 7.320 0.030 . 1 . . . . 118 ALA H . 15277 1 311 . 1 1 90 90 ALA C C 13 178.590 0.100 . 1 . . . . 118 ALA C . 15277 1 312 . 1 1 90 90 ALA CA C 13 55.860 0.100 . 1 . . . . 118 ALA CA . 15277 1 313 . 1 1 90 90 ALA CB C 13 18.710 0.100 . 1 . . . . 118 ALA CB . 15277 1 314 . 1 1 90 90 ALA N N 15 119.560 0.050 . 1 . . . . 118 ALA N . 15277 1 315 . 1 1 91 91 SER H H 1 8.230 0.030 . 1 . . . . 119 SER H . 15277 1 316 . 1 1 91 91 SER C C 13 174.310 0.100 . 1 . . . . 119 SER C . 15277 1 317 . 1 1 91 91 SER CA C 13 60.630 0.100 . 1 . . . . 119 SER CA . 15277 1 318 . 1 1 91 91 SER CB C 13 63.090 0.100 . 1 . . . . 119 SER CB . 15277 1 319 . 1 1 91 91 SER N N 15 109.370 0.050 . 1 . . . . 119 SER N . 15277 1 320 . 1 1 92 92 ARG H H 1 7.410 0.030 . 1 . . . . 120 ARG H . 15277 1 321 . 1 1 92 92 ARG CA C 13 53.020 0.100 . 1 . . . . 120 ARG CA . 15277 1 322 . 1 1 92 92 ARG N N 15 123.330 0.050 . 1 . . . . 120 ARG N . 15277 1 323 . 1 1 93 93 PRO C C 13 177.390 0.100 . 1 . . . . 121 PRO C . 15277 1 324 . 1 1 93 93 PRO CA C 13 64.140 0.100 . 1 . . . . 121 PRO CA . 15277 1 325 . 1 1 93 93 PRO CB C 13 34.260 0.100 . 1 . . . . 121 PRO CB . 15277 1 326 . 1 1 94 94 SER H H 1 6.350 0.030 . 1 . . . . 122 SER H . 15277 1 327 . 1 1 94 94 SER CA C 13 55.580 0.100 . 1 . . . . 122 SER CA . 15277 1 328 . 1 1 94 94 SER N N 15 113.250 0.050 . 1 . . . . 122 SER N . 15277 1 329 . 1 1 95 95 GLU H H 1 8.220 0.030 . 1 . . . . 123 GLU H . 15277 1 330 . 1 1 95 95 GLU C C 13 176.150 0.100 . 1 . . . . 123 GLU C . 15277 1 331 . 1 1 95 95 GLU CA C 13 59.880 0.100 . 1 . . . . 123 GLU CA . 15277 1 332 . 1 1 95 95 GLU CB C 13 30.570 0.100 . 1 . . . . 123 GLU CB . 15277 1 333 . 1 1 95 95 GLU N N 15 122.000 0.050 . 1 . . . . 123 GLU N . 15277 1 334 . 1 1 96 96 VAL H H 1 8.030 0.030 . 1 . . . . 124 VAL H . 15277 1 335 . 1 1 96 96 VAL C C 13 174.700 0.100 . 1 . . . . 124 VAL C . 15277 1 336 . 1 1 96 96 VAL CA C 13 60.950 0.100 . 1 . . . . 124 VAL CA . 15277 1 337 . 1 1 96 96 VAL CB C 13 34.730 0.100 . 1 . . . . 124 VAL CB . 15277 1 338 . 1 1 96 96 VAL N N 15 114.620 0.050 . 1 . . . . 124 VAL N . 15277 1 339 . 1 1 97 97 CYS H H 1 8.750 0.030 . 1 . . . . 125 CYS H . 15277 1 340 . 1 1 97 97 CYS CA C 13 55.910 0.100 . 1 . . . . 125 CYS CA . 15277 1 341 . 1 1 97 97 CYS N N 15 120.530 0.050 . 1 . . . . 125 CYS N . 15277 1 342 . 1 1 102 102 THR C C 13 174.050 0.100 . 1 . . . . 130 THR C . 15277 1 343 . 1 1 102 102 THR CA C 13 63.670 0.100 . 1 . . . . 130 THR CA . 15277 1 344 . 1 1 102 102 THR CB C 13 68.950 0.100 . 1 . . . . 130 THR CB . 15277 1 345 . 1 1 103 103 ASP H H 1 8.550 0.030 . 1 . . . . 131 ASP H . 15277 1 346 . 1 1 103 103 ASP C C 13 175.230 0.100 . 1 . . . . 131 ASP C . 15277 1 347 . 1 1 103 103 ASP CA C 13 55.470 0.100 . 1 . . . . 131 ASP CA . 15277 1 348 . 1 1 103 103 ASP CB C 13 41.010 0.100 . 1 . . . . 131 ASP CB . 15277 1 349 . 1 1 103 103 ASP N N 15 126.410 0.050 . 1 . . . . 131 ASP N . 15277 1 350 . 1 1 104 104 MET H H 1 8.190 0.030 . 1 . . . . 132 MET H . 15277 1 351 . 1 1 104 104 MET C C 13 175.610 0.100 . 1 . . . . 132 MET C . 15277 1 352 . 1 1 104 104 MET CA C 13 52.440 0.100 . 1 . . . . 132 MET CA . 15277 1 353 . 1 1 104 104 MET CB C 13 32.720 0.100 . 1 . . . . 132 MET CB . 15277 1 354 . 1 1 104 104 MET N N 15 121.940 0.050 . 1 . . . . 132 MET N . 15277 1 355 . 1 1 105 105 CYS H H 1 8.940 0.030 . 1 . . . . 133 CYS H . 15277 1 356 . 1 1 105 105 CYS C C 13 173.690 0.100 . 1 . . . . 133 CYS C . 15277 1 357 . 1 1 105 105 CYS CA C 13 55.800 0.100 . 1 . . . . 133 CYS CA . 15277 1 358 . 1 1 105 105 CYS CB C 13 30.660 0.100 . 1 . . . . 133 CYS CB . 15277 1 359 . 1 1 105 105 CYS N N 15 118.310 0.050 . 1 . . . . 133 CYS N . 15277 1 360 . 1 1 106 106 LEU H H 1 6.870 0.030 . 1 . . . . 134 LEU H . 15277 1 361 . 1 1 106 106 LEU CA C 13 57.160 0.100 . 1 . . . . 134 LEU CA . 15277 1 362 . 1 1 106 106 LEU CB C 13 41.400 0.100 . 1 . . . . 134 LEU CB . 15277 1 363 . 1 1 106 106 LEU N N 15 120.300 0.050 . 1 . . . . 134 LEU N . 15277 1 364 . 1 1 107 107 ALA H H 1 7.480 0.030 . 1 . . . . 135 ALA H . 15277 1 365 . 1 1 107 107 ALA C C 13 177.620 0.100 . 1 . . . . 135 ALA C . 15277 1 366 . 1 1 107 107 ALA CA C 13 52.880 0.100 . 1 . . . . 135 ALA CA . 15277 1 367 . 1 1 107 107 ALA CB C 13 18.590 0.100 . 1 . . . . 135 ALA CB . 15277 1 368 . 1 1 107 107 ALA N N 15 115.540 0.050 . 1 . . . . 135 ALA N . 15277 1 369 . 1 1 108 108 ASP H H 1 7.520 0.030 . 1 . . . . 136 ASP H . 15277 1 370 . 1 1 108 108 ASP C C 13 176.810 0.100 . 1 . . . . 136 ASP C . 15277 1 371 . 1 1 108 108 ASP CA C 13 56.060 0.100 . 1 . . . . 136 ASP CA . 15277 1 372 . 1 1 108 108 ASP CB C 13 42.790 0.100 . 1 . . . . 136 ASP CB . 15277 1 373 . 1 1 108 108 ASP N N 15 115.310 0.050 . 1 . . . . 136 ASP N . 15277 1 374 . 1 1 109 109 PHE H H 1 7.430 0.030 . 1 . . . . 137 PHE H . 15277 1 375 . 1 1 109 109 PHE C C 13 171.540 0.100 . 1 . . . . 137 PHE C . 15277 1 376 . 1 1 109 109 PHE CA C 13 55.600 0.100 . 1 . . . . 137 PHE CA . 15277 1 377 . 1 1 109 109 PHE CB C 13 41.670 0.100 . 1 . . . . 137 PHE CB . 15277 1 378 . 1 1 109 109 PHE N N 15 115.290 0.050 . 1 . . . . 137 PHE N . 15277 1 379 . 1 1 110 110 HIS H H 1 7.030 0.030 . 1 . . . . 138 HIS H . 15277 1 380 . 1 1 110 110 HIS C C 13 174.350 0.100 . 1 . . . . 138 HIS C . 15277 1 381 . 1 1 110 110 HIS CA C 13 52.400 0.100 . 1 . . . . 138 HIS CA . 15277 1 382 . 1 1 110 110 HIS N N 15 109.610 0.050 . 1 . . . . 138 HIS N . 15277 1 383 . 1 1 111 111 ALA H H 1 7.310 0.030 . 1 . . . . 139 ALA H . 15277 1 384 . 1 1 111 111 ALA C C 13 176.700 0.100 . 1 . . . . 139 ALA C . 15277 1 385 . 1 1 111 111 ALA CA C 13 51.350 0.100 . 1 . . . . 139 ALA CA . 15277 1 386 . 1 1 111 111 ALA N N 15 117.540 0.050 . 1 . . . . 139 ALA N . 15277 1 387 . 1 1 112 112 GLY H H 1 8.790 0.030 . 1 . . . . 140 GLY H . 15277 1 388 . 1 1 112 112 GLY C C 13 170.260 0.100 . 1 . . . . 140 GLY C . 15277 1 389 . 1 1 112 112 GLY CA C 13 47.320 0.100 . 1 . . . . 140 GLY CA . 15277 1 390 . 1 1 112 112 GLY N N 15 104.630 0.050 . 1 . . . . 140 GLY N . 15277 1 391 . 1 1 113 113 ILE H H 1 8.680 0.030 . 1 . . . . 141 ILE H . 15277 1 392 . 1 1 113 113 ILE CA C 13 60.720 0.100 . 1 . . . . 141 ILE CA . 15277 1 393 . 1 1 113 113 ILE N N 15 117.550 0.050 . 1 . . . . 141 ILE N . 15277 1 394 . 1 1 114 114 PHE H H 1 9.060 0.030 . 1 . . . . 142 PHE H . 15277 1 395 . 1 1 114 114 PHE CA C 13 55.990 0.100 . 1 . . . . 142 PHE CA . 15277 1 396 . 1 1 114 114 PHE N N 15 124.900 0.050 . 1 . . . . 142 PHE N . 15277 1 397 . 1 1 115 115 LEU H H 1 8.490 0.030 . 1 . . . . 143 LEU H . 15277 1 398 . 1 1 115 115 LEU CA C 13 56.060 0.100 . 1 . . . . 143 LEU CA . 15277 1 399 . 1 1 115 115 LEU N N 15 122.200 0.050 . 1 . . . . 143 LEU N . 15277 1 400 . 1 1 116 116 LYS H H 1 8.020 0.030 . 1 . . . . 144 LYS H . 15277 1 401 . 1 1 116 116 LYS CA C 13 56.080 0.100 . 1 . . . . 144 LYS CA . 15277 1 402 . 1 1 116 116 LYS N N 15 124.800 0.050 . 1 . . . . 144 LYS N . 15277 1 403 . 1 1 117 117 GLY H H 1 8.680 0.030 . 1 . . . . 145 GLY H . 15277 1 404 . 1 1 117 117 GLY CA C 13 45.090 0.100 . 1 . . . . 145 GLY CA . 15277 1 405 . 1 1 117 117 GLY N N 15 114.900 0.050 . 1 . . . . 145 GLY N . 15277 1 406 . 1 1 118 118 GLN H H 1 8.380 0.030 . 1 . . . . 146 GLN H . 15277 1 407 . 1 1 118 118 GLN CA C 13 58.120 0.100 . 1 . . . . 146 GLN CA . 15277 1 408 . 1 1 118 118 GLN N N 15 118.800 0.050 . 1 . . . . 146 GLN N . 15277 1 409 . 1 1 122 122 VAL C C 13 173.990 0.100 . 1 . . . . 150 VAL C . 15277 1 410 . 1 1 122 122 VAL CA C 13 59.130 0.100 . 1 . . . . 150 VAL CA . 15277 1 411 . 1 1 123 123 PHE H H 1 7.660 0.030 . 1 . . . . 151 PHE H . 15277 1 412 . 1 1 123 123 PHE C C 13 172.740 0.100 . 1 . . . . 151 PHE C . 15277 1 413 . 1 1 123 123 PHE CA C 13 55.690 0.100 . 1 . . . . 151 PHE CA . 15277 1 414 . 1 1 123 123 PHE N N 15 122.150 0.050 . 1 . . . . 151 PHE N . 15277 1 415 . 1 1 124 124 ALA H H 1 8.530 0.030 . 1 . . . . 152 ALA H . 15277 1 416 . 1 1 124 124 ALA C C 13 174.690 0.100 . 1 . . . . 152 ALA C . 15277 1 417 . 1 1 124 124 ALA CA C 13 51.140 0.100 . 1 . . . . 152 ALA CA . 15277 1 418 . 1 1 124 124 ALA CB C 13 22.720 0.100 . 1 . . . . 152 ALA CB . 15277 1 419 . 1 1 124 124 ALA N N 15 127.680 0.050 . 1 . . . . 152 ALA N . 15277 1 420 . 1 1 125 125 CYS H H 1 9.090 0.030 . 1 . . . . 153 CYS H . 15277 1 421 . 1 1 125 125 CYS C C 13 172.200 0.100 . 1 . . . . 153 CYS C . 15277 1 422 . 1 1 125 125 CYS CA C 13 55.760 0.100 . 1 . . . . 153 CYS CA . 15277 1 423 . 1 1 125 125 CYS N N 15 113.120 0.050 . 1 . . . . 153 CYS N . 15277 1 424 . 1 1 126 126 VAL H H 1 7.870 0.030 . 1 . . . . 154 VAL H . 15277 1 425 . 1 1 126 126 VAL C C 13 175.690 0.100 . 1 . . . . 154 VAL C . 15277 1 426 . 1 1 126 126 VAL CA C 13 64.310 0.100 . 1 . . . . 154 VAL CA . 15277 1 427 . 1 1 126 126 VAL N N 15 121.060 0.050 . 1 . . . . 154 VAL N . 15277 1 428 . 1 1 127 127 THR H H 1 6.870 0.030 . 1 . . . . 155 THR H . 15277 1 429 . 1 1 127 127 THR C C 13 177.400 0.100 . 1 . . . . 155 THR C . 15277 1 430 . 1 1 127 127 THR CA C 13 59.410 0.100 . 1 . . . . 155 THR CA . 15277 1 431 . 1 1 127 127 THR N N 15 116.030 0.050 . 1 . . . . 155 THR N . 15277 1 432 . 1 1 128 128 SER H H 1 8.390 0.030 . 1 . . . . 156 SER H . 15277 1 433 . 1 1 128 128 SER C C 13 174.510 0.100 . 1 . . . . 156 SER C . 15277 1 434 . 1 1 128 128 SER CA C 13 60.670 0.100 . 1 . . . . 156 SER CA . 15277 1 435 . 1 1 128 128 SER N N 15 116.530 0.050 . 1 . . . . 156 SER N . 15277 1 436 . 1 1 129 129 ASN H H 1 8.130 0.030 . 1 . . . . 157 ASN H . 15277 1 437 . 1 1 129 129 ASN C C 13 174.240 0.100 . 1 . . . . 157 ASN C . 15277 1 438 . 1 1 129 129 ASN CA C 13 52.530 0.100 . 1 . . . . 157 ASN CA . 15277 1 439 . 1 1 129 129 ASN N N 15 118.890 0.050 . 1 . . . . 157 ASN N . 15277 1 440 . 1 1 130 130 GLY H H 1 7.650 0.030 . 1 . . . . 158 GLY H . 15277 1 441 . 1 1 130 130 GLY C C 13 175.750 0.100 . 1 . . . . 158 GLY C . 15277 1 442 . 1 1 130 130 GLY CA C 13 43.600 0.100 . 1 . . . . 158 GLY CA . 15277 1 443 . 1 1 130 130 GLY N N 15 107.930 0.050 . 1 . . . . 158 GLY N . 15277 1 444 . 1 1 131 131 TRP H H 1 8.940 0.030 . 1 . . . . 159 TRP H . 15277 1 445 . 1 1 131 131 TRP C C 13 177.140 0.100 . 1 . . . . 159 TRP C . 15277 1 446 . 1 1 131 131 TRP CA C 13 60.830 0.100 . 1 . . . . 159 TRP CA . 15277 1 447 . 1 1 131 131 TRP N N 15 123.940 0.050 . 1 . . . . 159 TRP N . 15277 1 448 . 1 1 132 132 TYR H H 1 9.530 0.030 . 1 . . . . 160 TYR H . 15277 1 449 . 1 1 132 132 TYR C C 13 174.000 0.100 . 1 . . . . 160 TYR C . 15277 1 450 . 1 1 132 132 TYR CA C 13 57.470 0.100 . 1 . . . . 160 TYR CA . 15277 1 451 . 1 1 132 132 TYR CB C 13 44.250 0.100 . 1 . . . . 160 TYR CB . 15277 1 452 . 1 1 132 132 TYR N N 15 127.740 0.050 . 1 . . . . 160 TYR N . 15277 1 453 . 1 1 133 133 ALA H H 1 9.040 0.030 . 1 . . . . 161 ALA H . 15277 1 454 . 1 1 133 133 ALA CA C 13 50.220 0.100 . 1 . . . . 161 ALA CA . 15277 1 455 . 1 1 133 133 ALA CB C 13 20.660 0.100 . 1 . . . . 161 ALA CB . 15277 1 456 . 1 1 133 133 ALA N N 15 120.650 0.050 . 1 . . . . 161 ALA N . 15277 1 457 . 1 1 134 134 ILE H H 1 8.920 0.030 . 1 . . . . 162 ILE H . 15277 1 458 . 1 1 134 134 ILE C C 13 175.440 0.100 . 1 . . . . 162 ILE C . 15277 1 459 . 1 1 134 134 ILE CA C 13 62.360 0.100 . 1 . . . . 162 ILE CA . 15277 1 460 . 1 1 134 134 ILE N N 15 117.630 0.050 . 1 . . . . 162 ILE N . 15277 1 461 . 1 1 135 135 ASP H H 1 8.980 0.030 . 1 . . . . 163 ASP H . 15277 1 462 . 1 1 135 135 ASP CA C 13 51.360 0.100 . 1 . . . . 163 ASP CA . 15277 1 463 . 1 1 135 135 ASP N N 15 130.630 0.050 . 1 . . . . 163 ASP N . 15277 1 464 . 1 1 136 136 ASP H H 1 7.790 0.030 . 1 . . . . 164 ASP H . 15277 1 465 . 1 1 136 136 ASP CA C 13 58.780 0.100 . 1 . . . . 164 ASP CA . 15277 1 466 . 1 1 136 136 ASP N N 15 119.400 0.050 . 1 . . . . 164 ASP N . 15277 1 467 . 1 1 137 137 GLU H H 1 8.520 0.030 . 1 . . . . 165 GLU H . 15277 1 468 . 1 1 137 137 GLU CA C 13 57.830 0.100 . 1 . . . . 165 GLU CA . 15277 1 469 . 1 1 137 137 GLU CB C 13 30.580 0.100 . 1 . . . . 165 GLU CB . 15277 1 470 . 1 1 137 137 GLU N N 15 124.060 0.050 . 1 . . . . 165 GLU N . 15277 1 471 . 1 1 138 138 ASP H H 1 8.550 0.030 . 1 . . . . 166 ASP H . 15277 1 472 . 1 1 138 138 ASP C C 13 173.320 0.100 . 1 . . . . 166 ASP C . 15277 1 473 . 1 1 138 138 ASP CA C 13 54.370 0.100 . 1 . . . . 166 ASP CA . 15277 1 474 . 1 1 138 138 ASP CB C 13 44.550 0.100 . 1 . . . . 166 ASP CB . 15277 1 475 . 1 1 138 138 ASP N N 15 121.000 0.050 . 1 . . . . 166 ASP N . 15277 1 476 . 1 1 139 139 PHE H H 1 8.600 0.030 . 1 . . . . 167 PHE H . 15277 1 477 . 1 1 139 139 PHE C C 13 175.910 0.100 . 1 . . . . 167 PHE C . 15277 1 478 . 1 1 139 139 PHE CA C 13 55.690 0.100 . 1 . . . . 167 PHE CA . 15277 1 479 . 1 1 139 139 PHE CB C 13 42.550 0.100 . 1 . . . . 167 PHE CB . 15277 1 480 . 1 1 139 139 PHE N N 15 119.750 0.050 . 1 . . . . 167 PHE N . 15277 1 481 . 1 1 140 140 TYR H H 1 8.130 0.030 . 1 . . . . 168 TYR H . 15277 1 482 . 1 1 140 140 TYR CA C 13 54.700 0.100 . 1 . . . . 168 TYR CA . 15277 1 483 . 1 1 140 140 TYR N N 15 118.850 0.050 . 1 . . . . 168 TYR N . 15277 1 484 . 1 1 141 141 PRO C C 13 177.010 0.100 . 1 . . . . 169 PRO C . 15277 1 485 . 1 1 141 141 PRO CA C 13 62.560 0.100 . 1 . . . . 169 PRO CA . 15277 1 486 . 1 1 142 142 TRP H H 1 8.180 0.030 . 1 . . . . 170 TRP H . 15277 1 487 . 1 1 142 142 TRP C C 13 172.270 0.100 . 1 . . . . 170 TRP C . 15277 1 488 . 1 1 142 142 TRP CA C 13 58.900 0.100 . 1 . . . . 170 TRP CA . 15277 1 489 . 1 1 142 142 TRP N N 15 126.950 0.050 . 1 . . . . 170 TRP N . 15277 1 490 . 1 1 143 143 THR H H 1 7.460 0.030 . 1 . . . . 171 THR H . 15277 1 491 . 1 1 143 143 THR CA C 13 58.870 0.100 . 1 . . . . 171 THR CA . 15277 1 492 . 1 1 143 143 THR CB C 13 69.060 0.100 . 1 . . . . 171 THR CB . 15277 1 493 . 1 1 143 143 THR N N 15 122.710 0.050 . 1 . . . . 171 THR N . 15277 1 494 . 1 1 146 146 PRO C C 13 177.080 0.100 . 1 . . . . 174 PRO C . 15277 1 495 . 1 1 146 146 PRO CA C 13 64.910 0.100 . 1 . . . . 174 PRO CA . 15277 1 496 . 1 1 146 146 PRO CB C 13 31.060 0.100 . 1 . . . . 174 PRO CB . 15277 1 497 . 1 1 147 147 SER H H 1 8.720 0.030 . 1 . . . . 175 SER H . 15277 1 498 . 1 1 147 147 SER CA C 13 60.830 0.100 . 1 . . . . 175 SER CA . 15277 1 499 . 1 1 147 147 SER CB C 13 63.190 0.100 . 1 . . . . 175 SER CB . 15277 1 500 . 1 1 147 147 SER N N 15 115.450 0.050 . 1 . . . . 175 SER N . 15277 1 501 . 1 1 148 148 ASP H H 1 8.180 0.030 . 1 . . . . 176 ASP H . 15277 1 502 . 1 1 148 148 ASP CA C 13 53.880 0.100 . 1 . . . . 176 ASP CA . 15277 1 503 . 1 1 148 148 ASP CB C 13 42.120 0.100 . 1 . . . . 176 ASP CB . 15277 1 504 . 1 1 148 148 ASP N N 15 122.100 0.050 . 1 . . . . 176 ASP N . 15277 1 505 . 1 1 149 149 VAL H H 1 7.230 0.030 . 1 . . . . 177 VAL H . 15277 1 506 . 1 1 149 149 VAL CA C 13 61.940 0.100 . 1 . . . . 177 VAL CA . 15277 1 507 . 1 1 149 149 VAL N N 15 121.100 0.050 . 1 . . . . 177 VAL N . 15277 1 508 . 1 1 150 150 LEU H H 1 8.370 0.030 . 1 . . . . 178 LEU H . 15277 1 509 . 1 1 150 150 LEU CA C 13 55.300 0.100 . 1 . . . . 178 LEU CA . 15277 1 510 . 1 1 150 150 LEU N N 15 122.400 0.050 . 1 . . . . 178 LEU N . 15277 1 511 . 1 1 151 151 VAL H H 1 6.980 0.030 . 1 . . . . 179 VAL H . 15277 1 512 . 1 1 151 151 VAL C C 13 174.260 0.100 . 1 . . . . 179 VAL C . 15277 1 513 . 1 1 151 151 VAL CA C 13 59.130 0.100 . 1 . . . . 179 VAL CA . 15277 1 514 . 1 1 151 151 VAL N N 15 116.000 0.050 . 1 . . . . 179 VAL N . 15277 1 515 . 1 1 152 152 PHE H H 1 9.390 0.030 . 1 . . . . 180 PHE H . 15277 1 516 . 1 1 152 152 PHE C C 13 172.420 0.100 . 1 . . . . 180 PHE C . 15277 1 517 . 1 1 152 152 PHE CA C 13 55.310 0.100 . 1 . . . . 180 PHE CA . 15277 1 518 . 1 1 152 152 PHE N N 15 121.940 0.050 . 1 . . . . 180 PHE N . 15277 1 519 . 1 1 153 153 VAL H H 1 8.260 0.030 . 1 . . . . 181 VAL H . 15277 1 520 . 1 1 153 153 VAL N N 15 121.440 0.050 . 1 . . . . 181 VAL N . 15277 1 521 . 1 1 154 154 PRO CA C 13 62.200 0.100 . 1 . . . . 182 PRO CA . 15277 1 522 . 1 1 154 154 PRO CB C 13 33.790 0.100 . 1 . . . . 182 PRO CB . 15277 1 523 . 1 1 155 155 TYR H H 1 7.520 0.030 . 1 . . . . 183 TYR H . 15277 1 524 . 1 1 155 155 TYR CA C 13 60.540 0.100 . 1 . . . . 183 TYR CA . 15277 1 525 . 1 1 155 155 TYR N N 15 117.300 0.050 . 1 . . . . 183 TYR N . 15277 1 526 . 1 1 156 156 ASP H H 1 8.970 0.030 . 1 . . . . 184 ASP H . 15277 1 527 . 1 1 156 156 ASP CA C 13 54.500 0.100 . 1 . . . . 184 ASP CA . 15277 1 528 . 1 1 156 156 ASP CB C 13 41.370 0.100 . 1 . . . . 184 ASP CB . 15277 1 529 . 1 1 156 156 ASP N N 15 121.500 0.050 . 1 . . . . 184 ASP N . 15277 1 530 . 1 1 157 157 GLN H H 1 8.560 0.030 . 1 . . . . 185 GLN H . 15277 1 531 . 1 1 157 157 GLN CA C 13 55.140 0.100 . 1 . . . . 185 GLN CA . 15277 1 532 . 1 1 157 157 GLN CB C 13 29.780 0.100 . 1 . . . . 185 GLN CB . 15277 1 533 . 1 1 157 157 GLN N N 15 121.300 0.050 . 1 . . . . 185 GLN N . 15277 1 534 . 1 1 158 158 GLU H H 1 8.450 0.030 . 1 . . . . 186 GLU H . 15277 1 535 . 1 1 158 158 GLU CA C 13 54.650 0.100 . 1 . . . . 186 GLU CA . 15277 1 536 . 1 1 158 158 GLU CB C 13 29.760 0.100 . 1 . . . . 186 GLU CB . 15277 1 537 . 1 1 158 158 GLU N N 15 123.600 0.050 . 1 . . . . 186 GLU N . 15277 1 538 . 1 1 159 159 PRO C C 13 177.060 0.100 . 1 . . . . 187 PRO C . 15277 1 539 . 1 1 159 159 PRO CA C 13 62.990 0.100 . 1 . . . . 187 PRO CA . 15277 1 540 . 1 1 160 160 LEU H H 1 8.520 0.030 . 1 . . . . 188 LEU H . 15277 1 541 . 1 1 160 160 LEU CA C 13 55.080 0.100 . 1 . . . . 188 LEU CA . 15277 1 542 . 1 1 160 160 LEU N N 15 123.500 0.050 . 1 . . . . 188 LEU N . 15277 1 543 . 1 1 161 161 ASN H H 1 8.580 0.030 . 1 . . . . 189 ASN H . 15277 1 544 . 1 1 161 161 ASN CA C 13 52.980 0.100 . 1 . . . . 189 ASN CA . 15277 1 545 . 1 1 161 161 ASN N N 15 120.100 0.050 . 1 . . . . 189 ASN N . 15277 1 546 . 1 1 162 162 GLY H H 1 8.100 0.030 . 1 . . . . 190 GLY H . 15277 1 547 . 1 1 162 162 GLY CA C 13 45.220 0.100 . 1 . . . . 190 GLY CA . 15277 1 548 . 1 1 162 162 GLY N N 15 108.000 0.050 . 1 . . . . 190 GLY N . 15277 1 stop_ save_