################################### # 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 17856 _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' . . . 17856 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 . 2 1 1 1 MET H H 1 8.430 0.01 . 9 . . . B 1 MET H1 . 17856 1 2 . 2 1 1 1 MET C C 13 176.900 0.04 . 9 . . . B 1 MET C . 17856 1 3 . 2 1 1 1 MET CA C 13 55.831 0.04 . 9 . . . B 1 MET CA . 17856 1 4 . 2 1 1 1 MET N N 15 117.625 0.1 . 9 . . . B 1 MET N . 17856 1 5 . 2 1 2 2 SER H H 1 8.003 0.01 . 9 . . . B 2 SER H . 17856 1 6 . 2 1 2 2 SER C C 13 174.710 0.04 . 9 . . . B 2 SER C . 17856 1 7 . 2 1 2 2 SER CA C 13 58.908 0.04 . 9 . . . B 2 SER CA . 17856 1 8 . 2 1 2 2 SER N N 15 116.304 0.1 . 9 . . . B 2 SER N . 17856 1 9 . 2 1 3 3 ILE H H 1 7.957 0.01 . 9 . . . B 3 ILE H . 17856 1 10 . 2 1 3 3 ILE HD11 H 1 0.810 0.01 . 9 . . . B 3 ILE HD11 . 17856 1 11 . 2 1 3 3 ILE HD12 H 1 0.810 0.01 . 9 . . . B 3 ILE HD11 . 17856 1 12 . 2 1 3 3 ILE HD13 H 1 0.810 0.01 . 9 . . . B 3 ILE HD11 . 17856 1 13 . 2 1 3 3 ILE C C 13 176.750 0.04 . 9 . . . B 3 ILE C . 17856 1 14 . 2 1 3 3 ILE CA C 13 61.786 0.04 . 9 . . . B 3 ILE CA . 17856 1 15 . 2 1 3 3 ILE CD1 C 13 12.596 0.04 . 9 . . . B 3 ILE CD1 . 17856 1 16 . 2 1 3 3 ILE N N 15 122.062 0.1 . 9 . . . B 3 ILE N . 17856 1 17 . 2 1 4 4 VAL H H 1 7.970 0.01 . 9 . . . B 4 VAL H . 17856 1 18 . 2 1 4 4 VAL HG11 H 1 0.987 0.01 . 2 . . . B 4 VAL HG11 . 17856 1 19 . 2 1 4 4 VAL HG12 H 1 0.987 0.01 . 2 . . . B 4 VAL HG11 . 17856 1 20 . 2 1 4 4 VAL HG13 H 1 0.987 0.01 . 2 . . . B 4 VAL HG11 . 17856 1 21 . 2 1 4 4 VAL HG21 H 1 0.928 0.01 . 2 . . . B 4 VAL HG21 . 17856 1 22 . 2 1 4 4 VAL HG22 H 1 0.928 0.01 . 2 . . . B 4 VAL HG21 . 17856 1 23 . 2 1 4 4 VAL HG23 H 1 0.928 0.01 . 2 . . . B 4 VAL HG21 . 17856 1 24 . 2 1 4 4 VAL C C 13 176.221 0.04 . 9 . . . B 4 VAL C . 17856 1 25 . 2 1 4 4 VAL CA C 13 62.970 0.04 . 9 . . . B 4 VAL CA . 17856 1 26 . 2 1 4 4 VAL CG1 C 13 21.185 0.04 . 2 . . . B 4 VAL CG1 . 17856 1 27 . 2 1 4 4 VAL CG2 C 13 20.942 0.04 . 2 . . . B 4 VAL CG2 . 17856 1 28 . 2 1 4 4 VAL N N 15 122.674 0.1 . 9 . . . B 4 VAL N . 17856 1 29 . 2 1 5 5 SER H H 1 8.093 0.01 . 9 . . . B 5 SER H . 17856 1 30 . 2 1 5 5 SER C C 13 174.858 0.04 . 9 . . . B 5 SER C . 17856 1 31 . 2 1 5 5 SER CA C 13 58.630 0.04 . 9 . . . B 5 SER CA . 17856 1 32 . 2 1 5 5 SER N N 15 117.750 0.1 . 9 . . . B 5 SER N . 17856 1 33 . 2 1 6 6 GLN H H 1 8.371 0.01 . 9 . . . B 6 GLN H . 17856 1 34 . 2 1 6 6 GLN C C 13 176.467 0.04 . 9 . . . B 6 GLN C . 17856 1 35 . 2 1 6 6 GLN CA C 13 56.226 0.04 . 9 . . . B 6 GLN CA . 17856 1 36 . 2 1 6 6 GLN N N 15 121.961 0.1 . 9 . . . B 6 GLN N . 17856 1 37 . 2 1 7 7 THR H H 1 8.152 0.01 . 9 . . . B 7 THR H . 17856 1 38 . 2 1 7 7 THR C C 13 174.752 0.04 . 9 . . . B 7 THR C . 17856 1 39 . 2 1 7 7 THR N N 15 115.325 0.1 . 9 . . . B 7 THR N . 17856 1 40 . 2 1 8 8 ARG H H 1 8.211 0.01 . 1 . . . B 8 ARG H . 17856 1 41 . 2 1 8 8 ARG C C 13 176.200 0.04 . 9 . . . B 8 ARG C . 17856 1 42 . 2 1 8 8 ARG CA C 13 56.570 0.04 . 9 . . . B 8 ARG CA . 17856 1 43 . 2 1 8 8 ARG N N 15 122.530 0.1 . 1 . . . B 8 ARG N . 17856 1 44 . 2 1 9 9 ASN H H 1 8.398 0.01 . 1 . . . B 9 ASN H . 17856 1 45 . 2 1 9 9 ASN C C 13 177.164 0.04 . 9 . . . B 9 ASN C . 17856 1 46 . 2 1 9 9 ASN N N 15 119.600 0.1 . 1 . . . B 9 ASN N . 17856 1 47 . 2 1 10 10 LYS H H 1 8.190 0.01 . 1 . . . B 10 LYS H . 17856 1 48 . 2 1 10 10 LYS C C 13 176.845 0.04 . 9 . . . B 10 LYS C . 17856 1 49 . 2 1 10 10 LYS CA C 13 57.110 0.04 . 9 . . . B 10 LYS CA . 17856 1 50 . 2 1 10 10 LYS N N 15 121.600 0.1 . 1 . . . B 10 LYS N . 17856 1 51 . 2 1 11 11 GLU H H 1 8.323 0.01 . 1 . . . B 11 GLU H . 17856 1 52 . 2 1 11 11 GLU C C 13 176.825 0.04 . 9 . . . B 11 GLU C . 17856 1 53 . 2 1 11 11 GLU CA C 13 56.690 0.04 . 1 . . . B 11 GLU CA . 17856 1 54 . 2 1 11 11 GLU N N 15 120.700 0.1 . 1 . . . B 11 GLU N . 17856 1 55 . 2 1 12 12 LEU H H 1 8.155 0.01 . 1 . . . B 12 LEU H . 17856 1 56 . 2 1 12 12 LEU HD11 H 1 0.843 0.01 . 2 . . . B 12 LEU HD11 . 17856 1 57 . 2 1 12 12 LEU HD12 H 1 0.843 0.01 . 2 . . . B 12 LEU HD11 . 17856 1 58 . 2 1 12 12 LEU HD13 H 1 0.843 0.01 . 2 . . . B 12 LEU HD11 . 17856 1 59 . 2 1 12 12 LEU C C 13 177.670 0.04 . 9 . . . B 12 LEU C . 17856 1 60 . 2 1 12 12 LEU CA C 13 55.470 0.04 . 1 . . . B 12 LEU CA . 17856 1 61 . 2 1 12 12 LEU CD1 C 13 24.358 0.04 . 2 . . . B 12 LEU CD1 . 17856 1 62 . 2 1 12 12 LEU N N 15 122.390 0.1 . 1 . . . B 12 LEU N . 17856 1 63 . 2 1 13 13 LEU H H 1 8.220 0.01 . 9 . . . B 13 LEU H . 17856 1 64 . 2 1 13 13 LEU HD11 H 1 0.883 0.01 . 2 . . . B 13 LEU HD11 . 17856 1 65 . 2 1 13 13 LEU HD12 H 1 0.883 0.01 . 2 . . . B 13 LEU HD11 . 17856 1 66 . 2 1 13 13 LEU HD13 H 1 0.883 0.01 . 2 . . . B 13 LEU HD11 . 17856 1 67 . 2 1 13 13 LEU C C 13 177.510 0.04 . 9 . . . B 13 LEU C . 17856 1 68 . 2 1 13 13 LEU CA C 13 55.581 0.04 . 9 . . . B 13 LEU CA . 17856 1 69 . 2 1 13 13 LEU CD1 C 13 24.266 0.04 . 2 . . . B 13 LEU CD1 . 17856 1 70 . 2 1 13 13 LEU N N 15 122.570 0.1 . 1 . . . B 13 LEU N . 17856 1 71 . 2 1 14 14 ASP H H 1 8.243 0.01 . 1 . . . B 14 ASP H . 17856 1 72 . 2 1 14 14 ASP C C 13 176.480 0.04 . 9 . . . B 14 ASP C . 17856 1 73 . 2 1 14 14 ASP CA C 13 54.650 0.04 . 1 . . . B 14 ASP CA . 17856 1 74 . 2 1 14 14 ASP N N 15 120.780 0.1 . 1 . . . B 14 ASP N . 17856 1 75 . 2 1 15 15 LYS H H 1 8.052 0.01 . 1 . . . B 15 LYS H . 17856 1 76 . 2 1 15 15 LYS C C 13 175.580 0.04 . 9 . . . B 15 LYS C . 17856 1 77 . 2 1 15 15 LYS N N 15 120.900 0.1 . 1 . . . B 15 LYS N . 17856 1 78 . 2 1 16 16 LYS H H 1 8.243 0.01 . 1 . . . B 16 LYS H . 17856 1 79 . 2 1 16 16 LYS C C 13 176.887 0.04 . 9 . . . B 16 LYS C . 17856 1 80 . 2 1 16 16 LYS CA C 13 56.334 0.04 . 9 . . . B 16 LYS CA . 17856 1 81 . 2 1 16 16 LYS N N 15 121.980 0.1 . 1 . . . B 16 LYS N . 17856 1 82 . 2 1 17 17 ILE H H 1 8.110 0.01 . 1 . . . B 17 ILE H . 17856 1 83 . 2 1 17 17 ILE HD11 H 1 0.824 0.01 . 1 . . . B 17 ILE HD11 . 17856 1 84 . 2 1 17 17 ILE HD12 H 1 0.824 0.01 . 1 . . . B 17 ILE HD11 . 17856 1 85 . 2 1 17 17 ILE HD13 H 1 0.824 0.01 . 1 . . . B 17 ILE HD11 . 17856 1 86 . 2 1 17 17 ILE CD1 C 13 12.334 0.04 . 1 . . . B 17 ILE CD1 . 17856 1 87 . 2 1 17 17 ILE N N 15 121.940 0.1 . 1 . . . B 17 ILE N . 17856 1 88 . 2 1 18 18 ARG C C 13 176.520 0.04 . 1 . . . B 18 ARG C . 17856 1 89 . 2 1 19 19 SER H H 1 8.396 0.01 . 1 . . . B 19 SER H . 17856 1 90 . 2 1 19 19 SER C C 13 175.167 0.04 . 9 . . . B 19 SER C . 17856 1 91 . 2 1 19 19 SER CA C 13 58.840 0.04 . 9 . . . B 19 SER CA . 17856 1 92 . 2 1 19 19 SER N N 15 117.150 0.1 . 1 . . . B 19 SER N . 17856 1 93 . 2 1 20 20 GLU H H 1 8.478 0.01 . 1 . . . B 20 GLU H . 17856 1 94 . 2 1 20 20 GLU C C 13 176.921 0.04 . 9 . . . B 20 GLU C . 17856 1 95 . 2 1 20 20 GLU CA C 13 56.860 0.04 . 1 . . . B 20 GLU CA . 17856 1 96 . 2 1 20 20 GLU N N 15 123.176 0.1 . 1 . . . B 20 GLU N . 17856 1 97 . 2 1 21 21 ILE H H 1 8.080 0.01 . 1 . . . B 21 ILE H . 17856 1 98 . 2 1 21 21 ILE HD11 H 1 0.777 0.01 . 1 . . . B 21 ILE HD11 . 17856 1 99 . 2 1 21 21 ILE HD12 H 1 0.777 0.01 . 1 . . . B 21 ILE HD11 . 17856 1 100 . 2 1 21 21 ILE HD13 H 1 0.777 0.01 . 1 . . . B 21 ILE HD11 . 17856 1 101 . 2 1 21 21 ILE C C 13 176.550 0.04 . 9 . . . B 21 ILE C . 17856 1 102 . 2 1 21 21 ILE CA C 13 61.630 0.04 . 1 . . . B 21 ILE CA . 17856 1 103 . 2 1 21 21 ILE CD1 C 13 13.086 0.04 . 1 . . . B 21 ILE CD1 . 17856 1 104 . 2 1 21 21 ILE N N 15 120.550 0.1 . 1 . . . B 21 ILE N . 17856 1 105 . 2 1 22 22 GLU H H 1 8.309 0.01 . 1 . . . B 22 GLU H . 17856 1 106 . 2 1 22 22 GLU C C 13 176.109 0.04 . 9 . . . B 22 GLU C . 17856 1 107 . 2 1 22 22 GLU N N 15 123.685 0.1 . 1 . . . B 22 GLU N . 17856 1 108 . 2 1 23 23 ALA H H 1 8.088 0.01 . 1 . . . B 23 ALA H . 17856 1 109 . 2 1 23 23 ALA C C 13 178.474 0.04 . 1 . . . B 23 ALA C . 17856 1 110 . 2 1 23 23 ALA CA C 13 53.406 0.04 . 9 . . . B 23 ALA CA . 17856 1 111 . 2 1 23 23 ALA N N 15 124.280 0.1 . 1 . . . B 23 ALA N . 17856 1 112 . 2 1 24 24 ILE H H 1 7.980 0.01 . 1 . . . B 24 ILE H . 17856 1 113 . 2 1 24 24 ILE HD11 H 1 0.772 0.01 . 1 . . . B 24 ILE HD11 . 17856 1 114 . 2 1 24 24 ILE HD12 H 1 0.772 0.01 . 1 . . . B 24 ILE HD11 . 17856 1 115 . 2 1 24 24 ILE HD13 H 1 0.772 0.01 . 1 . . . B 24 ILE HD11 . 17856 1 116 . 2 1 24 24 ILE C C 13 176.309 0.04 . 9 . . . B 24 ILE C . 17856 1 117 . 2 1 24 24 ILE CA C 13 61.540 0.04 . 9 . . . B 24 ILE CA . 17856 1 118 . 2 1 24 24 ILE CD1 C 13 13.412 0.04 . 1 . . . B 24 ILE CD1 . 17856 1 119 . 2 1 24 24 ILE N N 15 120.330 0.1 . 1 . . . B 24 ILE N . 17856 1 120 . 2 1 25 25 LYS H H 1 8.198 0.01 . 1 . . . B 25 LYS H . 17856 1 121 . 2 1 25 25 LYS C C 13 176.365 0.04 . 9 . . . B 25 LYS C . 17856 1 122 . 2 1 25 25 LYS CA C 13 56.334 0.04 . 1 . . . B 25 LYS CA . 17856 1 123 . 2 1 25 25 LYS N N 15 124.310 0.1 . 1 . . . B 25 LYS N . 17856 1 124 . 2 1 26 26 LYS H H 1 8.125 0.01 . 1 . . . B 26 LYS H . 17856 1 125 . 2 1 26 26 LYS C C 13 176.365 0.04 . 9 . . . B 26 LYS C . 17856 1 126 . 2 1 26 26 LYS CA C 13 56.175 0.04 . 9 . . . B 26 LYS CA . 17856 1 127 . 2 1 26 26 LYS N N 15 122.518 0.1 . 1 . . . B 26 LYS N . 17856 1 128 . 2 1 27 27 ILE H H 1 8.114 0.01 . 1 . . . B 27 ILE H . 17856 1 129 . 2 1 27 27 ILE HD11 H 1 0.822 0.01 . 1 . . . B 27 ILE HD11 . 17856 1 130 . 2 1 27 27 ILE HD12 H 1 0.822 0.01 . 1 . . . B 27 ILE HD11 . 17856 1 131 . 2 1 27 27 ILE HD13 H 1 0.822 0.01 . 1 . . . B 27 ILE HD11 . 17856 1 132 . 2 1 27 27 ILE C C 13 176.261 0.04 . 1 . . . B 27 ILE C . 17856 1 133 . 2 1 27 27 ILE CA C 13 61.294 0.04 . 9 . . . B 27 ILE CA . 17856 1 134 . 2 1 27 27 ILE CD1 C 13 13.199 0.04 . 1 . . . B 27 ILE CD1 . 17856 1 135 . 2 1 27 27 ILE N N 15 122.670 0.1 . 1 . . . B 27 ILE N . 17856 1 136 . 2 1 28 28 ILE H H 1 8.220 0.01 . 1 . . . B 28 ILE H . 17856 1 137 . 2 1 28 28 ILE HD11 H 1 0.725 0.01 . 1 . . . B 28 ILE HD11 . 17856 1 138 . 2 1 28 28 ILE HD12 H 1 0.725 0.01 . 1 . . . B 28 ILE HD11 . 17856 1 139 . 2 1 28 28 ILE HD13 H 1 0.725 0.01 . 1 . . . B 28 ILE HD11 . 17856 1 140 . 2 1 28 28 ILE C C 13 175.803 0.04 . 1 . . . B 28 ILE C . 17856 1 141 . 2 1 28 28 ILE CA C 13 61.080 0.04 . 1 . . . B 28 ILE CA . 17856 1 142 . 2 1 28 28 ILE CD1 C 13 12.777 0.04 . 1 . . . B 28 ILE CD1 . 17856 1 143 . 2 1 28 28 ILE N N 15 125.178 0.1 . 1 . . . B 28 ILE N . 17856 1 144 . 2 1 29 29 ALA H H 1 8.300 0.01 . 1 . . . B 29 ALA H . 17856 1 145 . 2 1 29 29 ALA C C 13 177.627 0.04 . 9 . . . B 29 ALA C . 17856 1 146 . 2 1 29 29 ALA CA C 13 53.684 0.04 . 9 . . . B 29 ALA CA . 17856 1 147 . 2 1 29 29 ALA N N 15 127.850 0.1 . 1 . . . B 29 ALA N . 17856 1 148 . 2 1 30 30 GLU H H 1 8.258 0.01 . 1 . . . B 30 GLU H . 17856 1 149 . 2 1 30 30 GLU C C 13 176.321 0.04 . 9 . . . B 30 GLU C . 17856 1 150 . 2 1 30 30 GLU N N 15 120.000 0.1 . 1 . . . B 30 GLU N . 17856 1 151 . 2 1 31 31 PHE H H 1 8.061 0.01 . 9 . . . B 31 PHE H . 17856 1 152 . 2 1 31 31 PHE C C 13 175.180 0.04 . 9 . . . B 31 PHE C . 17856 1 153 . 2 1 31 31 PHE CA C 13 57.540 0.04 . 1 . . . B 31 PHE CA . 17856 1 154 . 2 1 31 31 PHE N N 15 119.128 0.1 . 9 . . . B 31 PHE N . 17856 1 155 . 2 1 32 32 ASP H H 1 8.275 0.01 . 1 . . . B 32 ASP H . 17856 1 156 . 2 1 32 32 ASP C C 13 175.894 0.04 . 9 . . . B 32 ASP C . 17856 1 157 . 2 1 32 32 ASP CA C 13 54.529 0.04 . 9 . . . B 32 ASP CA . 17856 1 158 . 2 1 32 32 ASP N N 15 121.800 0.1 . 1 . . . B 32 ASP N . 17856 1 159 . 2 1 33 33 VAL H H 1 8.059 0.01 . 9 . . . B 33 VAL H . 17856 1 160 . 2 1 33 33 VAL HG11 H 1 1.094 0.01 . 2 . . . B 33 VAL HG11 . 17856 1 161 . 2 1 33 33 VAL HG12 H 1 1.094 0.01 . 2 . . . B 33 VAL HG11 . 17856 1 162 . 2 1 33 33 VAL HG13 H 1 1.094 0.01 . 2 . . . B 33 VAL HG11 . 17856 1 163 . 2 1 33 33 VAL HG21 H 1 0.943 0.01 . 2 . . . B 33 VAL HG21 . 17856 1 164 . 2 1 33 33 VAL HG22 H 1 0.943 0.01 . 2 . . . B 33 VAL HG21 . 17856 1 165 . 2 1 33 33 VAL HG23 H 1 0.943 0.01 . 2 . . . B 33 VAL HG21 . 17856 1 166 . 2 1 33 33 VAL C C 13 176.268 0.04 . 9 . . . B 33 VAL C . 17856 1 167 . 2 1 33 33 VAL CA C 13 62.500 0.04 . 1 . . . B 33 VAL CA . 17856 1 168 . 2 1 33 33 VAL CG1 C 13 22.141 0.04 . 2 . . . B 33 VAL CG1 . 17856 1 169 . 2 1 33 33 VAL CG2 C 13 21.032 0.04 . 2 . . . B 33 VAL CG2 . 17856 1 170 . 2 1 33 33 VAL N N 15 119.648 0.1 . 9 . . . B 33 VAL N . 17856 1 171 . 2 1 34 34 VAL H H 1 7.774 0.01 . 9 . . . B 34 VAL H . 17856 1 172 . 2 1 34 34 VAL HG11 H 1 0.600 0.01 . 2 . . . B 34 VAL HG11 . 17856 1 173 . 2 1 34 34 VAL HG12 H 1 0.600 0.01 . 2 . . . B 34 VAL HG11 . 17856 1 174 . 2 1 34 34 VAL HG13 H 1 0.600 0.01 . 2 . . . B 34 VAL HG11 . 17856 1 175 . 2 1 34 34 VAL HG21 H 1 0.889 0.01 . 2 . . . B 34 VAL HG21 . 17856 1 176 . 2 1 34 34 VAL HG22 H 1 0.889 0.01 . 2 . . . B 34 VAL HG21 . 17856 1 177 . 2 1 34 34 VAL HG23 H 1 0.889 0.01 . 2 . . . B 34 VAL HG21 . 17856 1 178 . 2 1 34 34 VAL CG1 C 13 20.415 0.04 . 2 . . . B 34 VAL CG1 . 17856 1 179 . 2 1 34 34 VAL CG2 C 13 22.143 0.04 . 2 . . . B 34 VAL CG2 . 17856 1 180 . 2 1 34 34 VAL N N 15 123.882 0.1 . 9 . . . B 34 VAL N . 17856 1 181 . 2 1 35 35 LYS H H 1 8.357 0.01 . 1 . . . B 35 LYS H . 17856 1 182 . 2 1 35 35 LYS C C 13 176.719 0.04 . 9 . . . B 35 LYS C . 17856 1 183 . 2 1 35 35 LYS CA C 13 56.502 0.04 . 9 . . . B 35 LYS CA . 17856 1 184 . 2 1 35 35 LYS N N 15 125.250 0.1 . 1 . . . B 35 LYS N . 17856 1 185 . 2 1 36 36 GLU H H 1 8.423 0.01 . 1 . . . B 36 GLU H . 17856 1 186 . 2 1 36 36 GLU C C 13 176.426 0.04 . 1 . . . B 36 GLU C . 17856 1 187 . 2 1 36 36 GLU N N 15 121.850 0.1 . 1 . . . B 36 GLU N . 17856 1 188 . 2 1 37 37 SER H H 1 8.362 0.01 . 1 . . . B 37 SER H . 17856 1 189 . 2 1 37 37 SER C C 13 174.854 0.04 . 1 . . . B 37 SER C . 17856 1 190 . 2 1 37 37 SER CA C 13 58.850 0.04 . 9 . . . B 37 SER CA . 17856 1 191 . 2 1 37 37 SER N N 15 117.100 0.1 . 1 . . . B 37 SER N . 17856 1 192 . 2 1 38 38 VAL H H 1 8.225 0.01 . 1 . . . B 38 VAL H . 17856 1 193 . 2 1 38 38 VAL HG11 H 1 0.892 0.01 . 2 . . . B 38 VAL HG11 . 17856 1 194 . 2 1 38 38 VAL HG12 H 1 0.892 0.01 . 2 . . . B 38 VAL HG11 . 17856 1 195 . 2 1 38 38 VAL HG13 H 1 0.892 0.01 . 2 . . . B 38 VAL HG11 . 17856 1 196 . 2 1 38 38 VAL HG21 H 1 0.831 0.01 . 2 . . . B 38 VAL HG21 . 17856 1 197 . 2 1 38 38 VAL HG22 H 1 0.831 0.01 . 2 . . . B 38 VAL HG21 . 17856 1 198 . 2 1 38 38 VAL HG23 H 1 0.831 0.01 . 2 . . . B 38 VAL HG21 . 17856 1 199 . 2 1 38 38 VAL C C 13 176.246 0.04 . 9 . . . B 38 VAL C . 17856 1 200 . 2 1 38 38 VAL CA C 13 63.043 0.04 . 9 . . . B 38 VAL CA . 17856 1 201 . 2 1 38 38 VAL CG1 C 13 22.607 0.04 . 2 . . . B 38 VAL CG1 . 17856 1 202 . 2 1 38 38 VAL CG2 C 13 20.849 0.04 . 2 . . . B 38 VAL CG2 . 17856 1 203 . 2 1 38 38 VAL N N 15 121.625 0.1 . 1 . . . B 38 VAL N . 17856 1 204 . 2 1 39 39 ASN H H 1 8.366 0.01 . 1 . . . B 39 ASN H . 17856 1 205 . 2 1 39 39 ASN C C 13 175.459 0.04 . 9 . . . B 39 ASN C . 17856 1 206 . 2 1 39 39 ASN CA C 13 53.568 0.04 . 1 . . . B 39 ASN CA . 17856 1 207 . 2 1 39 39 ASN N N 15 121.150 0.1 . 1 . . . B 39 ASN N . 17856 1 208 . 2 1 40 40 GLU H H 1 8.370 0.01 . 1 . . . B 40 GLU H . 17856 1 209 . 2 1 40 40 GLU C C 13 175.459 0.04 . 9 . . . B 40 GLU C . 17856 1 210 . 2 1 40 40 GLU CA C 13 56.860 0.04 . 1 . . . B 40 GLU CA . 17856 1 211 . 2 1 40 40 GLU N N 15 121.500 0.1 . 1 . . . B 40 GLU N . 17856 1 212 . 2 1 41 41 LEU H H 1 8.152 0.01 . 1 . . . B 41 LEU H . 17856 1 213 . 2 1 41 41 LEU HD11 H 1 0.879 0.01 . 2 . . . B 41 LEU HD11 . 17856 1 214 . 2 1 41 41 LEU HD12 H 1 0.879 0.01 . 2 . . . B 41 LEU HD11 . 17856 1 215 . 2 1 41 41 LEU HD13 H 1 0.879 0.01 . 2 . . . B 41 LEU HD11 . 17856 1 216 . 2 1 41 41 LEU C C 13 177.939 0.04 . 1 . . . B 41 LEU C . 17856 1 217 . 2 1 41 41 LEU CA C 13 56.040 0.04 . 1 . . . B 41 LEU CA . 17856 1 218 . 2 1 41 41 LEU CD1 C 13 24.428 0.04 . 2 . . . B 41 LEU CD1 . 17856 1 219 . 2 1 41 41 LEU N N 15 121.950 0.1 . 1 . . . B 41 LEU N . 17856 1 220 . 2 1 42 42 SER H H 1 8.373 0.01 . 9 . . . B 42 SER H . 17856 1 221 . 2 1 42 42 SER C C 13 174.660 0.04 . 9 . . . B 42 SER C . 17856 1 222 . 2 1 42 42 SER CA C 13 58.940 0.04 . 9 . . . B 42 SER CA . 17856 1 223 . 2 1 42 42 SER N N 15 113.326 0.1 . 9 . . . B 42 SER N . 17856 1 224 . 2 1 43 43 GLU H H 1 7.329 0.01 . 9 . . . B 43 GLU H . 17856 1 225 . 2 1 43 43 GLU C C 13 177.349 0.04 . 9 . . . B 43 GLU C . 17856 1 226 . 2 1 43 43 GLU N N 15 121.521 0.1 . 9 . . . B 43 GLU N . 17856 1 227 . 2 1 44 44 LYS H H 1 8.103 0.01 . 1 . . . B 44 LYS H . 17856 1 228 . 2 1 44 44 LYS C C 13 177.246 0.04 . 9 . . . B 44 LYS C . 17856 1 229 . 2 1 44 44 LYS CA C 13 56.397 0.04 . 9 . . . B 44 LYS CA . 17856 1 230 . 2 1 44 44 LYS N N 15 121.240 0.1 . 1 . . . B 44 LYS N . 17856 1 231 . 2 1 45 45 ALA H H 1 8.541 0.01 . 9 . . . B 45 ALA H . 17856 1 232 . 2 1 45 45 ALA C C 13 177.853 0.04 . 9 . . . B 45 ALA C . 17856 1 233 . 2 1 45 45 ALA CA C 13 52.560 0.04 . 1 . . . B 45 ALA CA . 17856 1 234 . 2 1 45 45 ALA N N 15 119.568 0.1 . 9 . . . B 45 ALA N . 17856 1 235 . 2 1 46 46 LYS H H 1 7.257 0.01 . 9 . . . B 46 LYS H . 17856 1 236 . 2 1 46 46 LYS C C 13 177.110 0.04 . 9 . . . B 46 LYS C . 17856 1 237 . 2 1 46 46 LYS CA C 13 56.796 0.04 . 1 . . . B 46 LYS CA . 17856 1 238 . 2 1 46 46 LYS N N 15 115.235 0.1 . 9 . . . B 46 LYS N . 17856 1 239 . 2 1 47 47 THR H H 1 7.381 0.01 . 9 . . . B 47 THR H . 17856 1 240 . 2 1 47 47 THR C C 13 173.973 0.04 . 9 . . . B 47 THR C . 17856 1 241 . 2 1 47 47 THR CA C 13 62.740 0.04 . 1 . . . B 47 THR CA . 17856 1 242 . 2 1 47 47 THR N N 15 103.239 0.1 . 9 . . . B 47 THR N . 17856 1 243 . 2 1 48 48 ASP H H 1 8.031 0.01 . 9 . . . B 48 ASP H . 17856 1 244 . 2 1 48 48 ASP N N 15 122.976 0.1 . 9 . . . B 48 ASP N . 17856 1 245 . 2 1 49 49 PRO C C 13 178.106 0.04 . 1 . . . B 49 PRO C . 17856 1 246 . 2 1 49 49 PRO CA C 13 64.219 0.04 . 9 . . . B 49 PRO CA . 17856 1 247 . 2 1 50 50 GLN H H 1 8.304 0.01 . 9 . . . B 50 GLN H . 17856 1 248 . 2 1 50 50 GLN C C 13 176.944 0.04 . 9 . . . B 50 GLN C . 17856 1 249 . 2 1 50 50 GLN CA C 13 56.800 0.04 . 9 . . . B 50 GLN CA . 17856 1 250 . 2 1 50 50 GLN N N 15 118.351 0.1 . 9 . . . B 50 GLN N . 17856 1 251 . 2 1 51 51 ALA H H 1 7.547 0.01 . 9 . . . B 51 ALA H . 17856 1 252 . 2 1 51 51 ALA C C 13 178.490 0.04 . 9 . . . B 51 ALA C . 17856 1 253 . 2 1 51 51 ALA CA C 13 53.424 0.04 . 9 . . . B 51 ALA CA . 17856 1 254 . 2 1 51 51 ALA N N 15 124.206 0.1 . 9 . . . B 51 ALA N . 17856 1 255 . 2 1 52 52 ALA H H 1 7.931 0.01 . 9 . . . B 52 ALA H . 17856 1 256 . 2 1 52 52 ALA C C 13 177.953 0.04 . 9 . . . B 52 ALA C . 17856 1 257 . 2 1 52 52 ALA N N 15 118.686 0.1 . 9 . . . B 52 ALA N . 17856 1 258 . 2 1 53 53 GLU H H 1 7.729 0.01 . 9 . . . B 53 GLU H . 17856 1 259 . 2 1 53 53 GLU N N 15 120.075 0.1 . 9 . . . B 53 GLU N . 17856 1 260 . 2 1 55 55 LEU H H 1 8.215 0.01 . 9 . . . B 55 LEU H . 17856 1 261 . 2 1 55 55 LEU HD11 H 1 0.889 0.01 . 2 . . . B 55 LEU HD11 . 17856 1 262 . 2 1 55 55 LEU HD12 H 1 0.889 0.01 . 2 . . . B 55 LEU HD11 . 17856 1 263 . 2 1 55 55 LEU HD13 H 1 0.889 0.01 . 2 . . . B 55 LEU HD11 . 17856 1 264 . 2 1 55 55 LEU HD21 H 1 0.814 0.01 . 2 . . . B 55 LEU HD21 . 17856 1 265 . 2 1 55 55 LEU HD22 H 1 0.814 0.01 . 2 . . . B 55 LEU HD21 . 17856 1 266 . 2 1 55 55 LEU HD23 H 1 0.814 0.01 . 2 . . . B 55 LEU HD21 . 17856 1 267 . 2 1 55 55 LEU C C 13 177.587 0.04 . 1 . . . B 55 LEU C . 17856 1 268 . 2 1 55 55 LEU CA C 13 55.787 0.04 . 9 . . . B 55 LEU CA . 17856 1 269 . 2 1 55 55 LEU CD1 C 13 23.505 0.04 . 2 . . . B 55 LEU CD1 . 17856 1 270 . 2 1 55 55 LEU CD2 C 13 25.710 0.04 . 2 . . . B 55 LEU CD2 . 17856 1 271 . 2 1 55 55 LEU N N 15 123.640 0.1 . 9 . . . B 55 LEU N . 17856 1 272 . 2 1 56 56 ASN H H 1 8.250 0.01 . 1 . . . B 56 ASN H . 17856 1 273 . 2 1 56 56 ASN C C 13 175.700 0.04 . 1 . . . B 56 ASN C . 17856 1 274 . 2 1 56 56 ASN CA C 13 54.132 0.04 . 9 . . . B 56 ASN CA . 17856 1 275 . 2 1 56 56 ASN N N 15 118.520 0.1 . 1 . . . B 56 ASN N . 17856 1 276 . 2 1 57 57 LYS H H 1 8.065 0.01 . 1 . . . B 57 LYS H . 17856 1 277 . 2 1 57 57 LYS C C 13 176.637 0.04 . 9 . . . B 57 LYS C . 17856 1 278 . 2 1 57 57 LYS N N 15 120.960 0.1 . 1 . . . B 57 LYS N . 17856 1 279 . 2 1 58 58 LEU H H 1 8.135 0.01 . 1 . . . B 58 LEU H . 17856 1 280 . 2 1 58 58 LEU HD11 H 1 0.841 0.01 . 2 . . . B 58 LEU HD11 . 17856 1 281 . 2 1 58 58 LEU HD12 H 1 0.841 0.01 . 2 . . . B 58 LEU HD11 . 17856 1 282 . 2 1 58 58 LEU HD13 H 1 0.841 0.01 . 2 . . . B 58 LEU HD11 . 17856 1 283 . 2 1 58 58 LEU HD21 H 1 0.807 0.01 . 2 . . . B 58 LEU HD21 . 17856 1 284 . 2 1 58 58 LEU HD22 H 1 0.807 0.01 . 2 . . . B 58 LEU HD21 . 17856 1 285 . 2 1 58 58 LEU HD23 H 1 0.807 0.01 . 2 . . . B 58 LEU HD21 . 17856 1 286 . 2 1 58 58 LEU C C 13 177.433 0.04 . 9 . . . B 58 LEU C . 17856 1 287 . 2 1 58 58 LEU CA C 13 55.120 0.04 . 1 . . . B 58 LEU CA . 17856 1 288 . 2 1 58 58 LEU CD1 C 13 24.846 0.04 . 2 . . . B 58 LEU CD1 . 17856 1 289 . 2 1 58 58 LEU CD2 C 13 24.208 0.04 . 2 . . . B 58 LEU CD2 . 17856 1 290 . 2 1 58 58 LEU N N 15 122.610 0.1 . 1 . . . B 58 LEU N . 17856 1 291 . 2 1 59 59 ILE H H 1 8.220 0.01 . 1 . . . B 59 ILE H . 17856 1 292 . 2 1 59 59 ILE HD11 H 1 0.761 0.01 . 1 . . . B 59 ILE HD11 . 17856 1 293 . 2 1 59 59 ILE HD12 H 1 0.761 0.01 . 1 . . . B 59 ILE HD11 . 17856 1 294 . 2 1 59 59 ILE HD13 H 1 0.761 0.01 . 1 . . . B 59 ILE HD11 . 17856 1 295 . 2 1 59 59 ILE CA C 13 61.535 0.04 . 9 . . . B 59 ILE CA . 17856 1 296 . 2 1 59 59 ILE CD1 C 13 12.328 0.04 . 1 . . . B 59 ILE CD1 . 17856 1 297 . 2 1 59 59 ILE N N 15 122.045 0.1 . 1 . . . B 59 ILE N . 17856 1 298 . 2 1 60 60 GLU H H 1 8.340 0.01 . 1 . . . B 60 GLU H . 17856 1 299 . 2 1 60 60 GLU C C 13 177.007 0.04 . 1 . . . B 60 GLU C . 17856 1 300 . 2 1 60 60 GLU CA C 13 56.722 0.04 . 9 . . . B 60 GLU CA . 17856 1 301 . 2 1 60 60 GLU N N 15 124.000 0.1 . 1 . . . B 60 GLU N . 17856 1 302 . 2 1 61 61 GLY H H 1 8.557 0.01 . 9 . . . B 61 GLY H . 17856 1 303 . 2 1 61 61 GLY C C 13 174.002 0.04 . 9 . . . B 61 GLY C . 17856 1 304 . 2 1 61 61 GLY CA C 13 45.405 0.04 . 1 . . . B 61 GLY CA . 17856 1 305 . 2 1 61 61 GLY N N 15 110.520 0.1 . 9 . . . B 61 GLY N . 17856 1 306 . 2 1 62 62 TYR H H 1 7.980 0.01 . 1 . . . B 62 TYR H . 17856 1 307 . 2 1 62 62 TYR C C 13 175.940 0.04 . 9 . . . B 62 TYR C . 17856 1 308 . 2 1 62 62 TYR CA C 13 58.108 0.04 . 1 . . . B 62 TYR CA . 17856 1 309 . 2 1 62 62 TYR N N 15 119.600 0.1 . 1 . . . B 62 TYR N . 17856 1 310 . 2 1 63 63 THR H H 1 8.049 0.01 . 9 . . . B 63 THR H . 17856 1 311 . 2 1 63 63 THR C C 13 173.796 0.04 . 9 . . . B 63 THR C . 17856 1 312 . 2 1 63 63 THR N N 15 116.304 0.1 . 9 . . . B 63 THR N . 17856 1 313 . 2 1 64 64 TYR H H 1 8.133 0.01 . 1 . . . B 64 TYR H . 17856 1 314 . 2 1 64 64 TYR C C 13 176.290 0.04 . 9 . . . B 64 TYR C . 17856 1 315 . 2 1 64 64 TYR CA C 13 58.533 0.04 . 9 . . . B 64 TYR CA . 17856 1 316 . 2 1 64 64 TYR N N 15 122.050 0.1 . 1 . . . B 64 TYR N . 17856 1 317 . 2 1 65 65 GLY H H 1 7.747 0.01 . 9 . . . B 65 GLY H . 17856 1 318 . 2 1 65 65 GLY C C 13 174.340 0.04 . 9 . . . B 65 GLY C . 17856 1 319 . 2 1 65 65 GLY CA C 13 45.328 0.04 . 9 . . . B 65 GLY CA . 17856 1 320 . 2 1 65 65 GLY N N 15 110.456 0.1 . 9 . . . B 65 GLY N . 17856 1 321 . 2 1 66 66 GLU H H 1 8.243 0.01 . 1 . . . B 66 GLU H . 17856 1 322 . 2 1 66 66 GLU C C 13 176.895 0.04 . 9 . . . B 66 GLU C . 17856 1 323 . 2 1 66 66 GLU CA C 13 56.804 0.04 . 9 . . . B 66 GLU CA . 17856 1 324 . 2 1 66 66 GLU N N 15 120.783 0.1 . 1 . . . B 66 GLU N . 17856 1 325 . 2 1 67 67 GLU H H 1 8.611 0.01 . 1 . . . B 67 GLU H . 17856 1 326 . 2 1 67 67 GLU C C 13 176.340 0.04 . 9 . . . B 67 GLU C . 17856 1 327 . 2 1 67 67 GLU N N 15 121.587 0.1 . 1 . . . B 67 GLU N . 17856 1 328 . 2 1 68 68 ARG H H 1 8.267 0.01 . 1 . . . B 68 ARG H . 17856 1 329 . 2 1 68 68 ARG C C 13 176.350 0.04 . 9 . . . B 68 ARG C . 17856 1 330 . 2 1 68 68 ARG N N 15 121.790 0.1 . 1 . . . B 68 ARG N . 17856 1 331 . 2 1 69 69 LYS H H 1 7.567 0.01 . 9 . . . B 69 LYS H . 17856 1 332 . 2 1 69 69 LYS N N 15 118.431 0.1 . 9 . . . B 69 LYS N . 17856 1 333 . 2 1 70 70 LEU HD11 H 1 0.882 0.01 . 2 . . . B 70 LEU HD11 . 17856 1 334 . 2 1 70 70 LEU HD12 H 1 0.882 0.01 . 2 . . . B 70 LEU HD11 . 17856 1 335 . 2 1 70 70 LEU HD13 H 1 0.882 0.01 . 2 . . . B 70 LEU HD11 . 17856 1 336 . 2 1 70 70 LEU HD21 H 1 0.933 0.01 . 2 . . . B 70 LEU HD21 . 17856 1 337 . 2 1 70 70 LEU HD22 H 1 0.933 0.01 . 2 . . . B 70 LEU HD21 . 17856 1 338 . 2 1 70 70 LEU HD23 H 1 0.933 0.01 . 2 . . . B 70 LEU HD21 . 17856 1 339 . 2 1 70 70 LEU C C 13 177.338 0.04 . 1 . . . B 70 LEU C . 17856 1 340 . 2 1 70 70 LEU CA C 13 55.533 0.04 . 9 . . . B 70 LEU CA . 17856 1 341 . 2 1 70 70 LEU CD1 C 13 23.380 0.04 . 2 . . . B 70 LEU CD1 . 17856 1 342 . 2 1 70 70 LEU CD2 C 13 24.630 0.04 . 2 . . . B 70 LEU CD2 . 17856 1 343 . 2 1 71 71 TYR H H 1 7.997 0.01 . 1 . . . B 71 TYR H . 17856 1 344 . 2 1 71 71 TYR N N 15 119.504 0.1 . 1 . . . B 71 TYR N . 17856 1 345 . 2 1 72 72 ASP C C 13 176.528 0.04 . 1 . . . B 72 ASP C . 17856 1 346 . 2 1 72 72 ASP CA C 13 54.693 0.04 . 9 . . . B 72 ASP CA . 17856 1 347 . 2 1 73 73 SER H H 1 8.282 0.01 . 1 . . . B 73 SER H . 17856 1 348 . 2 1 73 73 SER C C 13 174.950 0.04 . 1 . . . B 73 SER C . 17856 1 349 . 2 1 73 73 SER CA C 13 58.997 0.04 . 1 . . . B 73 SER CA . 17856 1 350 . 2 1 73 73 SER N N 15 117.000 0.1 . 1 . . . B 73 SER N . 17856 1 351 . 2 1 74 74 ALA H H 1 8.339 0.01 . 1 . . . B 74 ALA H . 17856 1 352 . 2 1 74 74 ALA C C 13 178.389 0.04 . 9 . . . B 74 ALA C . 17856 1 353 . 2 1 74 74 ALA CA C 13 53.433 0.04 . 9 . . . B 74 ALA CA . 17856 1 354 . 2 1 74 74 ALA N N 15 125.422 0.1 . 1 . . . B 74 ALA N . 17856 1 355 . 2 1 75 75 LEU H H 1 7.948 0.01 . 1 . . . B 75 LEU H . 17856 1 356 . 2 1 75 75 LEU HD11 H 1 0.724 0.01 . 2 . . . B 75 LEU HD11 . 17856 1 357 . 2 1 75 75 LEU HD12 H 1 0.724 0.01 . 2 . . . B 75 LEU HD11 . 17856 1 358 . 2 1 75 75 LEU HD13 H 1 0.724 0.01 . 2 . . . B 75 LEU HD11 . 17856 1 359 . 2 1 75 75 LEU HD21 H 1 0.718 0.01 . 2 . . . B 75 LEU HD21 . 17856 1 360 . 2 1 75 75 LEU HD22 H 1 0.718 0.01 . 2 . . . B 75 LEU HD21 . 17856 1 361 . 2 1 75 75 LEU HD23 H 1 0.718 0.01 . 2 . . . B 75 LEU HD21 . 17856 1 362 . 2 1 75 75 LEU C C 13 177.954 0.04 . 9 . . . B 75 LEU C . 17856 1 363 . 2 1 75 75 LEU CA C 13 55.780 0.04 . 9 . . . B 75 LEU CA . 17856 1 364 . 2 1 75 75 LEU CD1 C 13 24.316 0.04 . 2 . . . B 75 LEU CD1 . 17856 1 365 . 2 1 75 75 LEU CD2 C 13 23.346 0.04 . 2 . . . B 75 LEU CD2 . 17856 1 366 . 2 1 75 75 LEU N N 15 120.019 0.1 . 1 . . . B 75 LEU N . 17856 1 367 . 2 1 76 76 SER H H 1 7.951 0.01 . 9 . . . B 76 SER H . 17856 1 368 . 2 1 76 76 SER C C 13 174.784 0.04 . 9 . . . B 76 SER C . 17856 1 369 . 2 1 76 76 SER CA C 13 59.173 0.04 . 1 . . . B 76 SER CA . 17856 1 370 . 2 1 76 76 SER N N 15 113.321 0.1 . 9 . . . B 76 SER N . 17856 1 371 . 2 1 77 77 LYS H H 1 8.170 0.01 . 1 . . . B 77 LYS H . 17856 1 372 . 2 1 77 77 LYS C C 13 176.734 0.04 . 9 . . . B 77 LYS C . 17856 1 373 . 2 1 77 77 LYS CA C 13 58.390 0.04 . 1 . . . B 77 LYS CA . 17856 1 374 . 2 1 77 77 LYS N N 15 122.710 0.1 . 1 . . . B 77 LYS N . 17856 1 375 . 2 1 78 78 ILE H H 1 8.160 0.01 . 1 . . . B 78 ILE H . 17856 1 376 . 2 1 78 78 ILE HD11 H 1 0.764 0.01 . 1 . . . B 78 ILE HD11 . 17856 1 377 . 2 1 78 78 ILE HD12 H 1 0.764 0.01 . 1 . . . B 78 ILE HD11 . 17856 1 378 . 2 1 78 78 ILE HD13 H 1 0.764 0.01 . 1 . . . B 78 ILE HD11 . 17856 1 379 . 2 1 78 78 ILE C C 13 176.512 0.04 . 9 . . . B 78 ILE C . 17856 1 380 . 2 1 78 78 ILE CD1 C 13 12.528 0.04 . 1 . . . B 78 ILE CD1 . 17856 1 381 . 2 1 78 78 ILE N N 15 121.521 0.1 . 1 . . . B 78 ILE N . 17856 1 382 . 2 1 79 79 GLU H H 1 8.360 0.01 . 1 . . . B 79 GLU H . 17856 1 383 . 2 1 79 79 GLU CA C 13 55.478 0.04 . 1 . . . B 79 GLU CA . 17856 1 384 . 2 1 79 79 GLU N N 15 123.840 0.1 . 1 . . . B 79 GLU N . 17856 1 385 . 2 1 80 80 LYS H H 1 8.231 0.01 . 1 . . . B 80 LYS H . 17856 1 386 . 2 1 80 80 LYS C C 13 176.937 0.04 . 1 . . . B 80 LYS C . 17856 1 387 . 2 1 80 80 LYS CA C 13 56.500 0.04 . 1 . . . B 80 LYS CA . 17856 1 388 . 2 1 80 80 LYS N N 15 122.143 0.1 . 1 . . . B 80 LYS N . 17856 1 389 . 2 1 81 81 LEU H H 1 8.050 0.01 . 1 . . . B 81 LEU H . 17856 1 390 . 2 1 81 81 LEU HD21 H 1 0.828 0.01 . 2 . . . B 81 LEU HD21 . 17856 1 391 . 2 1 81 81 LEU HD22 H 1 0.828 0.01 . 2 . . . B 81 LEU HD21 . 17856 1 392 . 2 1 81 81 LEU HD23 H 1 0.828 0.01 . 2 . . . B 81 LEU HD21 . 17856 1 393 . 2 1 81 81 LEU C C 13 177.531 0.04 . 9 . . . B 81 LEU C . 17856 1 394 . 2 1 81 81 LEU CD2 C 13 24.118 0.04 . 2 . . . B 81 LEU CD2 . 17856 1 395 . 2 1 81 81 LEU N N 15 122.095 0.1 . 1 . . . B 81 LEU N . 17856 1 396 . 2 1 82 82 ILE H H 1 8.000 0.01 . 1 . . . B 82 ILE H . 17856 1 397 . 2 1 82 82 ILE HD11 H 1 0.771 0.01 . 1 . . . B 82 ILE HD11 . 17856 1 398 . 2 1 82 82 ILE HD12 H 1 0.771 0.01 . 1 . . . B 82 ILE HD11 . 17856 1 399 . 2 1 82 82 ILE HD13 H 1 0.771 0.01 . 1 . . . B 82 ILE HD11 . 17856 1 400 . 2 1 82 82 ILE CA C 13 61.360 0.04 . 1 . . . B 82 ILE CA . 17856 1 401 . 2 1 82 82 ILE CD1 C 13 12.934 0.04 . 1 . . . B 82 ILE CD1 . 17856 1 402 . 2 1 82 82 ILE N N 15 120.609 0.1 . 1 . . . B 82 ILE N . 17856 1 403 . 2 1 83 83 GLU H H 1 8.380 0.01 . 1 . . . B 83 GLU H . 17856 1 404 . 2 1 83 83 GLU C C 13 177.298 0.04 . 1 . . . B 83 GLU C . 17856 1 405 . 2 1 83 83 GLU N N 15 124.611 0.1 . 1 . . . B 83 GLU N . 17856 1 406 . 2 1 84 84 THR H H 1 8.064 0.01 . 9 . . . B 84 THR H . 17856 1 407 . 2 1 84 84 THR C C 13 174.400 0.04 . 9 . . . B 84 THR C . 17856 1 408 . 2 1 84 84 THR CA C 13 62.659 0.04 . 9 . . . B 84 THR CA . 17856 1 409 . 2 1 84 84 THR N N 15 115.107 0.1 . 9 . . . B 84 THR N . 17856 1 410 . 2 1 85 85 LEU H H 1 8.238 0.01 . 1 . . . B 85 LEU H . 17856 1 411 . 2 1 85 85 LEU HD11 H 1 0.779 0.01 . 2 . . . B 85 LEU HD11 . 17856 1 412 . 2 1 85 85 LEU HD12 H 1 0.779 0.01 . 2 . . . B 85 LEU HD11 . 17856 1 413 . 2 1 85 85 LEU HD13 H 1 0.779 0.01 . 2 . . . B 85 LEU HD11 . 17856 1 414 . 2 1 85 85 LEU HD21 H 1 0.801 0.01 . 2 . . . B 85 LEU HD21 . 17856 1 415 . 2 1 85 85 LEU HD22 H 1 0.801 0.01 . 2 . . . B 85 LEU HD21 . 17856 1 416 . 2 1 85 85 LEU HD23 H 1 0.801 0.01 . 2 . . . B 85 LEU HD21 . 17856 1 417 . 2 1 85 85 LEU C C 13 177.120 0.04 . 9 . . . B 85 LEU C . 17856 1 418 . 2 1 85 85 LEU CA C 13 55.020 0.04 . 1 . . . B 85 LEU CA . 17856 1 419 . 2 1 85 85 LEU CD1 C 13 22.360 0.04 . 2 . . . B 85 LEU CD1 . 17856 1 420 . 2 1 85 85 LEU CD2 C 13 25.410 0.04 . 2 . . . B 85 LEU CD2 . 17856 1 421 . 2 1 85 85 LEU N N 15 124.150 0.1 . 1 . . . B 85 LEU N . 17856 1 422 . 2 1 86 86 SER H H 1 7.678 0.01 . 9 . . . B 86 SER H . 17856 1 423 . 2 1 86 86 SER N N 15 114.913 0.1 . 9 . . . B 86 SER N . 17856 1 424 . 2 1 87 87 PRO CA C 13 63.550 0.04 . 9 . . . B 87 PRO CA . 17856 1 425 . 2 1 88 88 ALA H H 1 8.342 0.01 . 1 . . . B 88 ALA H . 17856 1 426 . 2 1 88 88 ALA C C 13 178.131 0.04 . 1 . . . B 88 ALA C . 17856 1 427 . 2 1 88 88 ALA CA C 13 52.878 0.04 . 9 . . . B 88 ALA CA . 17856 1 428 . 2 1 88 88 ALA N N 15 123.767 0.1 . 1 . . . B 88 ALA N . 17856 1 429 . 2 1 89 89 ARG H H 1 8.133 0.01 . 1 . . . B 89 ARG H . 17856 1 430 . 2 1 89 89 ARG C C 13 176.620 0.04 . 9 . . . B 89 ARG C . 17856 1 431 . 2 1 89 89 ARG N N 15 119.159 0.1 . 1 . . . B 89 ARG N . 17856 1 432 . 2 1 90 90 SER H H 1 8.322 0.01 . 1 . . . B 90 SER H . 17856 1 433 . 2 1 90 90 SER C C 13 174.887 0.04 . 9 . . . B 90 SER C . 17856 1 434 . 2 1 90 90 SER N N 15 116.910 0.1 . 1 . . . B 90 SER N . 17856 1 435 . 2 1 91 91 LYS H H 1 8.396 0.01 . 1 . . . B 91 LYS H . 17856 1 436 . 2 1 91 91 LYS C C 13 176.970 0.04 . 9 . . . B 91 LYS C . 17856 1 437 . 2 1 91 91 LYS N N 15 123.457 0.1 . 1 . . . B 91 LYS N . 17856 1 438 . 2 1 92 92 SER H H 1 8.297 0.01 . 9 . . . B 92 SER H . 17856 1 439 . 2 1 92 92 SER C C 13 174.573 0.04 . 9 . . . B 92 SER C . 17856 1 440 . 2 1 92 92 SER CA C 13 58.600 0.04 . 9 . . . B 92 SER CA . 17856 1 441 . 2 1 92 92 SER N N 15 116.692 0.1 . 9 . . . B 92 SER N . 17856 1 442 . 2 1 93 93 GLN H H 1 8.325 0.01 . 9 . . . B 93 GLN H . 17856 1 443 . 2 1 93 93 GLN C C 13 175.971 0.04 . 9 . . . B 93 GLN C . 17856 1 444 . 2 1 93 93 GLN N N 15 121.916 0.1 . 9 . . . B 93 GLN N . 17856 1 445 . 2 1 94 94 SER H H 1 8.352 0.01 . 9 . . . B 94 SER H . 17856 1 446 . 2 1 94 94 SER C C 13 173.940 0.04 . 9 . . . B 94 SER C . 17856 1 447 . 2 1 94 94 SER CA C 13 58.520 0.04 . 9 . . . B 94 SER CA . 17856 1 448 . 2 1 94 94 SER N N 15 117.385 0.1 . 9 . . . B 94 SER N . 17856 1 449 . 2 1 95 95 THR H H 1 7.805 0.01 . 9 . . . B 95 THR H . 17856 1 450 . 2 1 95 95 THR N N 15 120.756 0.1 . 9 . . . B 95 THR N . 17856 1 451 . 2 1 99 99 ARG C C 13 176.250 0.04 . 1 . . . B 99 ARG C . 17856 1 452 . 2 1 99 99 ARG CA C 13 56.157 0.04 . 9 . . . B 99 ARG CA . 17856 1 453 . 2 1 100 100 ASN H H 1 8.272 0.01 . 9 . . . B 100 ASN H . 17856 1 454 . 2 1 100 100 ASN N N 15 118.482 0.1 . 9 . . . B 100 ASN N . 17856 1 455 . 2 1 101 101 ARG C C 13 176.280 0.04 . 1 . . . B 101 ARG C . 17856 1 456 . 2 1 102 102 ASN H H 1 8.424 0.01 . 9 . . . B 102 ASN H . 17856 1 457 . 2 1 102 102 ASN C C 13 174.996 0.04 . 9 . . . B 102 ASN C . 17856 1 458 . 2 1 102 102 ASN CA C 13 53.609 0.04 . 9 . . . B 102 ASN CA . 17856 1 459 . 2 1 102 102 ASN N N 15 118.688 0.1 . 9 . . . B 102 ASN N . 17856 1 460 . 2 1 103 103 ASN H H 1 8.282 0.01 . 9 . . . B 103 ASN H . 17856 1 461 . 2 1 103 103 ASN C C 13 175.040 0.04 . 9 . . . B 103 ASN C . 17856 1 462 . 2 1 103 103 ASN CA C 13 53.812 0.04 . 1 . . . B 103 ASN CA . 17856 1 463 . 2 1 103 103 ASN N N 15 118.865 0.1 . 9 . . . B 103 ASN N . 17856 1 464 . 2 1 104 104 ARG H H 1 8.140 0.01 . 9 . . . B 104 ARG H . 17856 1 465 . 2 1 104 104 ARG N N 15 120.875 0.1 . 9 . . . B 104 ARG N . 17856 1 466 . 2 1 106 106 ILE HD11 H 1 0.821 0.01 . 1 . . . B 106 ILE HD11 . 17856 1 467 . 2 1 106 106 ILE HD12 H 1 0.821 0.01 . 1 . . . B 106 ILE HD11 . 17856 1 468 . 2 1 106 106 ILE HD13 H 1 0.821 0.01 . 1 . . . B 106 ILE HD11 . 17856 1 469 . 2 1 106 106 ILE C C 13 175.408 0.04 . 9 . . . B 106 ILE C . 17856 1 470 . 2 1 106 106 ILE CA C 13 61.395 0.04 . 9 . . . B 106 ILE CA . 17856 1 471 . 2 1 106 106 ILE CD1 C 13 12.441 0.04 . 1 . . . B 106 ILE CD1 . 17856 1 472 . 2 1 107 107 VAL H H 1 7.663 0.01 . 9 . . . B 107 VAL H . 17856 1 473 . 2 1 107 107 VAL HG11 H 1 0.863 0.01 . 2 . . . B 107 VAL HG11 . 17856 1 474 . 2 1 107 107 VAL HG12 H 1 0.863 0.01 . 2 . . . B 107 VAL HG11 . 17856 1 475 . 2 1 107 107 VAL HG13 H 1 0.863 0.01 . 2 . . . B 107 VAL HG11 . 17856 1 476 . 2 1 107 107 VAL HG21 H 1 0.879 0.01 . 2 . . . B 107 VAL HG21 . 17856 1 477 . 2 1 107 107 VAL HG22 H 1 0.879 0.01 . 2 . . . B 107 VAL HG21 . 17856 1 478 . 2 1 107 107 VAL HG23 H 1 0.879 0.01 . 2 . . . B 107 VAL HG21 . 17856 1 479 . 2 1 107 107 VAL CG1 C 13 20.069 0.04 . 2 . . . B 107 VAL CG1 . 17856 1 480 . 2 1 107 107 VAL CG2 C 13 21.440 0.04 . 2 . . . B 107 VAL CG2 . 17856 1 481 . 2 1 107 107 VAL N N 15 128.095 0.1 . 9 . . . B 107 VAL N . 17856 1 stop_ save_