################################### # 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 25287 _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' . . . 25287 1 3 '3D C(CO)NH' . . . 25287 1 4 '3D HNCO' . . . 25287 1 5 '3D HNCA' . . . 25287 1 6 '3D HNCACB' . . . 25287 1 7 '3D 1H-13C NOESY' . . . 25287 1 9 '3D H(CCO)NH' . . . 25287 1 10 '3D HCCH-TOCSY' . . . 25287 1 11 '3D 1H-15N NOESY' . . . 25287 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 ALA HA H 1 4.280 0.000 . 1 . . . A 2 ALA HA . 25287 1 2 . 1 1 2 2 ALA HB1 H 1 1.645 0.000 . 1 . . . A 2 ALA HB1 . 25287 1 3 . 1 1 2 2 ALA HB2 H 1 1.645 0.000 . 1 . . . A 2 ALA HB2 . 25287 1 4 . 1 1 2 2 ALA HB3 H 1 1.645 0.000 . 1 . . . A 2 ALA HB3 . 25287 1 5 . 1 1 2 2 ALA C C 13 173.689 0.000 . 1 . . . A 2 ALA C . 25287 1 6 . 1 1 2 2 ALA CA C 13 52.026 0.000 . 1 . . . A 2 ALA CA . 25287 1 7 . 1 1 2 2 ALA CB C 13 20.087 0.000 . 1 . . . A 2 ALA CB . 25287 1 8 . 1 1 3 3 THR H H 1 8.666 0.000 . 1 . . . A 3 THR H . 25287 1 9 . 1 1 3 3 THR HA H 1 4.386 0.000 . 1 . . . A 3 THR HA . 25287 1 10 . 1 1 3 3 THR HB H 1 4.182 0.000 . 1 . . . A 3 THR HB . 25287 1 11 . 1 1 3 3 THR HG21 H 1 1.374 0.000 . 1 . . . A 3 THR HG21 . 25287 1 12 . 1 1 3 3 THR HG22 H 1 1.374 0.000 . 1 . . . A 3 THR HG22 . 25287 1 13 . 1 1 3 3 THR HG23 H 1 1.374 0.000 . 1 . . . A 3 THR HG23 . 25287 1 14 . 1 1 3 3 THR C C 13 172.917 0.000 . 1 . . . A 3 THR C . 25287 1 15 . 1 1 3 3 THR CA C 13 62.723 0.000 . 1 . . . A 3 THR CA . 25287 1 16 . 1 1 3 3 THR CB C 13 69.857 0.000 . 1 . . . A 3 THR CB . 25287 1 17 . 1 1 3 3 THR CG2 C 13 22.063 0.000 . 1 . . . A 3 THR CG2 . 25287 1 18 . 1 1 3 3 THR N N 15 117.470 0.000 . 1 . . . A 3 THR N . 25287 1 19 . 1 1 4 4 LEU H H 1 8.154 0.000 . 1 . . . A 4 LEU H . 25287 1 20 . 1 1 4 4 LEU HA H 1 4.360 0.000 . 1 . . . A 4 LEU HA . 25287 1 21 . 1 1 4 4 LEU HB2 H 1 1.604 0.000 . 2 . . . A 4 LEU HB2 . 25287 1 22 . 1 1 4 4 LEU HB3 H 1 1.480 0.000 . 2 . . . A 4 LEU HB3 . 25287 1 23 . 1 1 4 4 LEU HG H 1 1.705 0.000 . 1 . . . A 4 LEU HG . 25287 1 24 . 1 1 4 4 LEU HD11 H 1 0.885 0.000 . 2 . . . A 4 LEU HD11 . 25287 1 25 . 1 1 4 4 LEU HD12 H 1 0.885 0.000 . 2 . . . A 4 LEU HD12 . 25287 1 26 . 1 1 4 4 LEU HD13 H 1 0.885 0.000 . 2 . . . A 4 LEU HD13 . 25287 1 27 . 1 1 4 4 LEU HD21 H 1 0.946 0.000 . 2 . . . A 4 LEU HD21 . 25287 1 28 . 1 1 4 4 LEU HD22 H 1 0.946 0.000 . 2 . . . A 4 LEU HD22 . 25287 1 29 . 1 1 4 4 LEU HD23 H 1 0.946 0.000 . 2 . . . A 4 LEU HD23 . 25287 1 30 . 1 1 4 4 LEU C C 13 177.201 0.000 . 1 . . . A 4 LEU C . 25287 1 31 . 1 1 4 4 LEU CA C 13 54.852 0.000 . 1 . . . A 4 LEU CA . 25287 1 32 . 1 1 4 4 LEU CB C 13 42.706 0.000 . 1 . . . A 4 LEU CB . 25287 1 33 . 1 1 4 4 LEU CG C 13 27.286 0.000 . 1 . . . A 4 LEU CG . 25287 1 34 . 1 1 4 4 LEU CD1 C 13 23.680 0.000 . 2 . . . A 4 LEU CD1 . 25287 1 35 . 1 1 4 4 LEU CD2 C 13 25.201 0.000 . 2 . . . A 4 LEU CD2 . 25287 1 36 . 1 1 4 4 LEU N N 15 124.455 0.000 . 1 . . . A 4 LEU N . 25287 1 37 . 1 1 5 5 LEU H H 1 9.421 0.000 . 1 . . . A 5 LEU H . 25287 1 38 . 1 1 5 5 LEU HA H 1 4.544 0.000 . 1 . . . A 5 LEU HA . 25287 1 39 . 1 1 5 5 LEU HB2 H 1 1.584 0.000 . 2 . . . A 5 LEU HB2 . 25287 1 40 . 1 1 5 5 LEU HB3 H 1 1.371 0.000 . 2 . . . A 5 LEU HB3 . 25287 1 41 . 1 1 5 5 LEU HG H 1 1.563 0.000 . 1 . . . A 5 LEU HG . 25287 1 42 . 1 1 5 5 LEU HD11 H 1 0.601 0.000 . 2 . . . A 5 LEU HD11 . 25287 1 43 . 1 1 5 5 LEU HD12 H 1 0.601 0.000 . 2 . . . A 5 LEU HD12 . 25287 1 44 . 1 1 5 5 LEU HD13 H 1 0.601 0.000 . 2 . . . A 5 LEU HD13 . 25287 1 45 . 1 1 5 5 LEU HD21 H 1 0.639 0.000 . 2 . . . A 5 LEU HD21 . 25287 1 46 . 1 1 5 5 LEU HD22 H 1 0.639 0.000 . 2 . . . A 5 LEU HD22 . 25287 1 47 . 1 1 5 5 LEU HD23 H 1 0.639 0.000 . 2 . . . A 5 LEU HD23 . 25287 1 48 . 1 1 5 5 LEU C C 13 177.915 0.000 . 1 . . . A 5 LEU C . 25287 1 49 . 1 1 5 5 LEU CA C 13 55.376 0.000 . 1 . . . A 5 LEU CA . 25287 1 50 . 1 1 5 5 LEU CB C 13 42.862 0.000 . 1 . . . A 5 LEU CB . 25287 1 51 . 1 1 5 5 LEU CG C 13 27.706 0.000 . 1 . . . A 5 LEU CG . 25287 1 52 . 1 1 5 5 LEU CD1 C 13 25.533 0.000 . 2 . . . A 5 LEU CD1 . 25287 1 53 . 1 1 5 5 LEU CD2 C 13 25.357 0.000 . 2 . . . A 5 LEU CD2 . 25287 1 54 . 1 1 5 5 LEU N N 15 124.433 0.000 . 1 . . . A 5 LEU N . 25287 1 55 . 1 1 6 6 THR H H 1 9.044 0.000 . 1 . . . A 6 THR H . 25287 1 56 . 1 1 6 6 THR HA H 1 4.795 0.000 . 1 . . . A 6 THR HA . 25287 1 57 . 1 1 6 6 THR HB H 1 4.847 0.000 . 1 . . . A 6 THR HB . 25287 1 58 . 1 1 6 6 THR HG21 H 1 1.402 0.000 . 1 . . . A 6 THR HG21 . 25287 1 59 . 1 1 6 6 THR HG22 H 1 1.402 0.000 . 1 . . . A 6 THR HG22 . 25287 1 60 . 1 1 6 6 THR HG23 H 1 1.402 0.000 . 1 . . . A 6 THR HG23 . 25287 1 61 . 1 1 6 6 THR C C 13 175.951 0.000 . 1 . . . A 6 THR C . 25287 1 62 . 1 1 6 6 THR CA C 13 60.542 0.000 . 1 . . . A 6 THR CA . 25287 1 63 . 1 1 6 6 THR CB C 13 72.503 0.000 . 1 . . . A 6 THR CB . 25287 1 64 . 1 1 6 6 THR CG2 C 13 21.718 0.000 . 1 . . . A 6 THR CG2 . 25287 1 65 . 1 1 6 6 THR N N 15 114.654 0.000 . 1 . . . A 6 THR N . 25287 1 66 . 1 1 7 7 THR H H 1 8.840 0.000 . 1 . . . A 7 THR H . 25287 1 67 . 1 1 7 7 THR HA H 1 3.865 0.000 . 1 . . . A 7 THR HA . 25287 1 68 . 1 1 7 7 THR HB H 1 4.330 0.000 . 1 . . . A 7 THR HB . 25287 1 69 . 1 1 7 7 THR HG21 H 1 1.383 0.000 . 1 . . . A 7 THR HG21 . 25287 1 70 . 1 1 7 7 THR HG22 H 1 1.383 0.000 . 1 . . . A 7 THR HG22 . 25287 1 71 . 1 1 7 7 THR HG23 H 1 1.383 0.000 . 1 . . . A 7 THR HG23 . 25287 1 72 . 1 1 7 7 THR C C 13 176.562 0.000 . 1 . . . A 7 THR C . 25287 1 73 . 1 1 7 7 THR CA C 13 67.278 0.000 . 1 . . . A 7 THR CA . 25287 1 74 . 1 1 7 7 THR CB C 13 68.436 0.000 . 1 . . . A 7 THR CB . 25287 1 75 . 1 1 7 7 THR CG2 C 13 23.492 0.000 . 1 . . . A 7 THR CG2 . 25287 1 76 . 1 1 7 7 THR N N 15 115.400 0.000 . 1 . . . A 7 THR N . 25287 1 77 . 1 1 8 8 ASP H H 1 8.239 0.000 . 1 . . . A 8 ASP H . 25287 1 78 . 1 1 8 8 ASP HA H 1 4.618 0.000 . 1 . . . A 8 ASP HA . 25287 1 79 . 1 1 8 8 ASP HB2 H 1 2.709 0.000 . 2 . . . A 8 ASP HB2 . 25287 1 80 . 1 1 8 8 ASP HB3 H 1 2.703 0.000 . 2 . . . A 8 ASP HB3 . 25287 1 81 . 1 1 8 8 ASP C C 13 178.508 0.000 . 1 . . . A 8 ASP C . 25287 1 82 . 1 1 8 8 ASP CA C 13 57.797 0.000 . 1 . . . A 8 ASP CA . 25287 1 83 . 1 1 8 8 ASP CB C 13 41.334 0.000 . 1 . . . A 8 ASP CB . 25287 1 84 . 1 1 8 8 ASP N N 15 119.982 0.000 . 1 . . . A 8 ASP N . 25287 1 85 . 1 1 9 9 ASP H H 1 7.891 0.000 . 1 . . . A 9 ASP H . 25287 1 86 . 1 1 9 9 ASP HA H 1 4.543 0.000 . 1 . . . A 9 ASP HA . 25287 1 87 . 1 1 9 9 ASP HB2 H 1 3.026 0.000 . 2 . . . A 9 ASP HB2 . 25287 1 88 . 1 1 9 9 ASP HB3 H 1 2.678 0.000 . 2 . . . A 9 ASP HB3 . 25287 1 89 . 1 1 9 9 ASP C C 13 179.377 0.000 . 1 . . . A 9 ASP C . 25287 1 90 . 1 1 9 9 ASP CA C 13 57.690 0.000 . 1 . . . A 9 ASP CA . 25287 1 91 . 1 1 9 9 ASP CB C 13 41.697 0.000 . 1 . . . A 9 ASP CB . 25287 1 92 . 1 1 9 9 ASP N N 15 120.252 0.000 . 1 . . . A 9 ASP N . 25287 1 93 . 1 1 10 10 LEU H H 1 8.047 0.000 . 1 . . . A 10 LEU H . 25287 1 94 . 1 1 10 10 LEU HA H 1 4.205 0.000 . 1 . . . A 10 LEU HA . 25287 1 95 . 1 1 10 10 LEU HB2 H 1 2.316 0.000 . 2 . . . A 10 LEU HB2 . 25287 1 96 . 1 1 10 10 LEU HB3 H 1 1.576 0.000 . 2 . . . A 10 LEU HB3 . 25287 1 97 . 1 1 10 10 LEU HG H 1 1.890 0.000 . 1 . . . A 10 LEU HG . 25287 1 98 . 1 1 10 10 LEU HD11 H 1 1.035 0.000 . 2 . . . A 10 LEU HD11 . 25287 1 99 . 1 1 10 10 LEU HD12 H 1 1.035 0.000 . 2 . . . A 10 LEU HD12 . 25287 1 100 . 1 1 10 10 LEU HD13 H 1 1.035 0.000 . 2 . . . A 10 LEU HD13 . 25287 1 101 . 1 1 10 10 LEU HD21 H 1 1.118 0.000 . 2 . . . A 10 LEU HD21 . 25287 1 102 . 1 1 10 10 LEU HD22 H 1 1.118 0.000 . 2 . . . A 10 LEU HD22 . 25287 1 103 . 1 1 10 10 LEU HD23 H 1 1.118 0.000 . 2 . . . A 10 LEU HD23 . 25287 1 104 . 1 1 10 10 LEU C C 13 177.462 0.000 . 1 . . . A 10 LEU C . 25287 1 105 . 1 1 10 10 LEU CA C 13 57.960 0.000 . 1 . . . A 10 LEU CA . 25287 1 106 . 1 1 10 10 LEU CB C 13 42.043 0.000 . 1 . . . A 10 LEU CB . 25287 1 107 . 1 1 10 10 LEU CG C 13 27.671 0.000 . 1 . . . A 10 LEU CG . 25287 1 108 . 1 1 10 10 LEU CD1 C 13 23.706 0.000 . 2 . . . A 10 LEU CD1 . 25287 1 109 . 1 1 10 10 LEU CD2 C 13 27.916 0.000 . 2 . . . A 10 LEU CD2 . 25287 1 110 . 1 1 10 10 LEU N N 15 121.161 0.000 . 1 . . . A 10 LEU N . 25287 1 111 . 1 1 11 11 ARG H H 1 8.827 0.000 . 1 . . . A 11 ARG H . 25287 1 112 . 1 1 11 11 ARG HA H 1 3.551 0.000 . 1 . . . A 11 ARG HA . 25287 1 113 . 1 1 11 11 ARG HB2 H 1 2.053 0.000 . 2 . . . A 11 ARG HB2 . 25287 1 114 . 1 1 11 11 ARG HB3 H 1 2.033 0.000 . 2 . . . A 11 ARG HB3 . 25287 1 115 . 1 1 11 11 ARG HG2 H 1 1.408 0.000 . 2 . . . A 11 ARG HG2 . 25287 1 116 . 1 1 11 11 ARG HG3 H 1 1.193 0.000 . 2 . . . A 11 ARG HG3 . 25287 1 117 . 1 1 11 11 ARG HD2 H 1 3.223 0.000 . 2 . . . A 11 ARG HD2 . 25287 1 118 . 1 1 11 11 ARG HD3 H 1 3.189 0.000 . 2 . . . A 11 ARG HD3 . 25287 1 119 . 1 1 11 11 ARG HE H 1 7.321 0.000 . 1 . . . A 11 ARG HE . 25287 1 120 . 1 1 11 11 ARG C C 13 177.728 0.000 . 1 . . . A 11 ARG C . 25287 1 121 . 1 1 11 11 ARG CA C 13 60.583 0.000 . 1 . . . A 11 ARG CA . 25287 1 122 . 1 1 11 11 ARG CB C 13 30.595 0.000 . 1 . . . A 11 ARG CB . 25287 1 123 . 1 1 11 11 ARG CG C 13 27.500 0.000 . 1 . . . A 11 ARG CG . 25287 1 124 . 1 1 11 11 ARG CD C 13 43.536 0.000 . 1 . . . A 11 ARG CD . 25287 1 125 . 1 1 11 11 ARG N N 15 119.706 0.000 . 1 . . . A 11 ARG N . 25287 1 126 . 1 1 11 11 ARG NE N 15 83.606 0.000 . 1 . . . A 11 ARG NE . 25287 1 127 . 1 1 12 12 ARG H H 1 8.017 0.000 . 1 . . . A 12 ARG H . 25287 1 128 . 1 1 12 12 ARG HA H 1 4.028 0.000 . 1 . . . A 12 ARG HA . 25287 1 129 . 1 1 12 12 ARG HB2 H 1 2.010 0.000 . 2 . . . A 12 ARG HB2 . 25287 1 130 . 1 1 12 12 ARG HB3 H 1 1.970 0.000 . 2 . . . A 12 ARG HB3 . 25287 1 131 . 1 1 12 12 ARG HG2 H 1 1.921 0.000 . 2 . . . A 12 ARG HG2 . 25287 1 132 . 1 1 12 12 ARG HG3 H 1 1.686 0.000 . 2 . . . A 12 ARG HG3 . 25287 1 133 . 1 1 12 12 ARG HD2 H 1 3.371 0.000 . 2 . . . A 12 ARG HD2 . 25287 1 134 . 1 1 12 12 ARG HD3 H 1 3.306 0.000 . 2 . . . A 12 ARG HD3 . 25287 1 135 . 1 1 12 12 ARG HE H 1 7.533 0.000 . 1 . . . A 12 ARG HE . 25287 1 136 . 1 1 12 12 ARG C C 13 178.374 0.000 . 1 . . . A 12 ARG C . 25287 1 137 . 1 1 12 12 ARG CA C 13 59.735 0.000 . 1 . . . A 12 ARG CA . 25287 1 138 . 1 1 12 12 ARG CB C 13 30.436 0.000 . 1 . . . A 12 ARG CB . 25287 1 139 . 1 1 12 12 ARG CG C 13 28.259 0.000 . 1 . . . A 12 ARG CG . 25287 1 140 . 1 1 12 12 ARG CD C 13 43.492 0.000 . 1 . . . A 12 ARG CD . 25287 1 141 . 1 1 12 12 ARG N N 15 115.595 0.000 . 1 . . . A 12 ARG N . 25287 1 142 . 1 1 12 12 ARG NE N 15 84.810 0.000 . 1 . . . A 12 ARG NE . 25287 1 143 . 1 1 13 13 ALA H H 1 7.718 0.000 . 1 . . . A 13 ALA H . 25287 1 144 . 1 1 13 13 ALA HA H 1 4.376 0.000 . 1 . . . A 13 ALA HA . 25287 1 145 . 1 1 13 13 ALA HB1 H 1 1.658 0.000 . 1 . . . A 13 ALA HB1 . 25287 1 146 . 1 1 13 13 ALA HB2 H 1 1.658 0.000 . 1 . . . A 13 ALA HB2 . 25287 1 147 . 1 1 13 13 ALA HB3 H 1 1.658 0.000 . 1 . . . A 13 ALA HB3 . 25287 1 148 . 1 1 13 13 ALA C C 13 180.021 0.000 . 1 . . . A 13 ALA C . 25287 1 149 . 1 1 13 13 ALA CA C 13 55.034 0.000 . 1 . . . A 13 ALA CA . 25287 1 150 . 1 1 13 13 ALA CB C 13 18.637 0.000 . 1 . . . A 13 ALA CB . 25287 1 151 . 1 1 13 13 ALA N N 15 119.879 0.000 . 1 . . . A 13 ALA N . 25287 1 152 . 1 1 14 14 LEU H H 1 8.381 0.000 . 1 . . . A 14 LEU H . 25287 1 153 . 1 1 14 14 LEU HA H 1 4.370 0.000 . 1 . . . A 14 LEU HA . 25287 1 154 . 1 1 14 14 LEU HB2 H 1 1.977 0.000 . 2 . . . A 14 LEU HB2 . 25287 1 155 . 1 1 14 14 LEU HB3 H 1 1.434 0.000 . 2 . . . A 14 LEU HB3 . 25287 1 156 . 1 1 14 14 LEU HG H 1 1.845 0.000 . 1 . . . A 14 LEU HG . 25287 1 157 . 1 1 14 14 LEU HD11 H 1 0.731 0.000 . 2 . . . A 14 LEU HD11 . 25287 1 158 . 1 1 14 14 LEU HD12 H 1 0.731 0.000 . 2 . . . A 14 LEU HD12 . 25287 1 159 . 1 1 14 14 LEU HD13 H 1 0.731 0.000 . 2 . . . A 14 LEU HD13 . 25287 1 160 . 1 1 14 14 LEU HD21 H 1 0.884 0.000 . 2 . . . A 14 LEU HD21 . 25287 1 161 . 1 1 14 14 LEU HD22 H 1 0.884 0.000 . 2 . . . A 14 LEU HD22 . 25287 1 162 . 1 1 14 14 LEU HD23 H 1 0.884 0.000 . 2 . . . A 14 LEU HD23 . 25287 1 163 . 1 1 14 14 LEU C C 13 180.305 0.000 . 1 . . . A 14 LEU C . 25287 1 164 . 1 1 14 14 LEU CA C 13 57.631 0.000 . 1 . . . A 14 LEU CA . 25287 1 165 . 1 1 14 14 LEU CB C 13 41.789 0.000 . 1 . . . A 14 LEU CB . 25287 1 166 . 1 1 14 14 LEU CG C 13 27.223 0.000 . 1 . . . A 14 LEU CG . 25287 1 167 . 1 1 14 14 LEU CD1 C 13 23.410 0.000 . 2 . . . A 14 LEU CD1 . 25287 1 168 . 1 1 14 14 LEU CD2 C 13 26.753 0.000 . 2 . . . A 14 LEU CD2 . 25287 1 169 . 1 1 14 14 LEU N N 15 119.118 0.000 . 1 . . . A 14 LEU N . 25287 1 170 . 1 1 15 15 VAL H H 1 8.465 0.000 . 1 . . . A 15 VAL H . 25287 1 171 . 1 1 15 15 VAL HA H 1 3.923 0.000 . 1 . . . A 15 VAL HA . 25287 1 172 . 1 1 15 15 VAL HB H 1 2.265 0.000 . 1 . . . A 15 VAL HB . 25287 1 173 . 1 1 15 15 VAL HG11 H 1 1.031 0.000 . 2 . . . A 15 VAL HG11 . 25287 1 174 . 1 1 15 15 VAL HG12 H 1 1.031 0.000 . 2 . . . A 15 VAL HG12 . 25287 1 175 . 1 1 15 15 VAL HG13 H 1 1.031 0.000 . 2 . . . A 15 VAL HG13 . 25287 1 176 . 1 1 15 15 VAL HG21 H 1 1.116 0.000 . 2 . . . A 15 VAL HG21 . 25287 1 177 . 1 1 15 15 VAL HG22 H 1 1.116 0.000 . 2 . . . A 15 VAL HG22 . 25287 1 178 . 1 1 15 15 VAL HG23 H 1 1.116 0.000 . 2 . . . A 15 VAL HG23 . 25287 1 179 . 1 1 15 15 VAL C C 13 178.980 0.000 . 1 . . . A 15 VAL C . 25287 1 180 . 1 1 15 15 VAL CA C 13 65.976 0.000 . 1 . . . A 15 VAL CA . 25287 1 181 . 1 1 15 15 VAL CB C 13 32.062 0.000 . 1 . . . A 15 VAL CB . 25287 1 182 . 1 1 15 15 VAL CG1 C 13 21.436 0.000 . 2 . . . A 15 VAL CG1 . 25287 1 183 . 1 1 15 15 VAL CG2 C 13 22.787 0.000 . 2 . . . A 15 VAL CG2 . 25287 1 184 . 1 1 15 15 VAL N N 15 120.187 0.000 . 1 . . . A 15 VAL N . 25287 1 185 . 1 1 16 16 GLU H H 1 8.244 0.000 . 1 . . . A 16 GLU H . 25287 1 186 . 1 1 16 16 GLU HA H 1 4.206 0.000 . 1 . . . A 16 GLU HA . 25287 1 187 . 1 1 16 16 GLU HB2 H 1 2.251 0.000 . 2 . . . A 16 GLU HB2 . 25287 1 188 . 1 1 16 16 GLU HB3 H 1 2.134 0.000 . 2 . . . A 16 GLU HB3 . 25287 1 189 . 1 1 16 16 GLU HG2 H 1 2.623 0.000 . 2 . . . A 16 GLU HG2 . 25287 1 190 . 1 1 16 16 GLU HG3 H 1 2.388 0.000 . 2 . . . A 16 GLU HG3 . 25287 1 191 . 1 1 16 16 GLU C C 13 178.468 0.000 . 1 . . . A 16 GLU C . 25287 1 192 . 1 1 16 16 GLU CA C 13 58.858 0.000 . 1 . . . A 16 GLU CA . 25287 1 193 . 1 1 16 16 GLU CB C 13 29.824 0.000 . 1 . . . A 16 GLU CB . 25287 1 194 . 1 1 16 16 GLU CG C 13 36.718 0.000 . 1 . . . A 16 GLU CG . 25287 1 195 . 1 1 16 16 GLU N N 15 119.725 0.000 . 1 . . . A 16 GLU N . 25287 1 196 . 1 1 17 17 SER H H 1 7.801 0.000 . 1 . . . A 17 SER H . 25287 1 197 . 1 1 17 17 SER HA H 1 4.559 0.000 . 1 . . . A 17 SER HA . 25287 1 198 . 1 1 17 17 SER HB2 H 1 4.121 0.000 . 2 . . . A 17 SER HB2 . 25287 1 199 . 1 1 17 17 SER HB3 H 1 4.048 0.000 . 2 . . . A 17 SER HB3 . 25287 1 200 . 1 1 17 17 SER C C 13 174.220 0.000 . 1 . . . A 17 SER C . 25287 1 201 . 1 1 17 17 SER CA C 13 59.836 0.000 . 1 . . . A 17 SER CA . 25287 1 202 . 1 1 17 17 SER CB C 13 64.116 0.000 . 1 . . . A 17 SER CB . 25287 1 203 . 1 1 17 17 SER N N 15 113.737 0.000 . 1 . . . A 17 SER N . 25287 1 204 . 1 1 18 18 ALA H H 1 7.840 0.000 . 1 . . . A 18 ALA H . 25287 1 205 . 1 1 18 18 ALA HA H 1 4.358 0.000 . 1 . . . A 18 ALA HA . 25287 1 206 . 1 1 18 18 ALA HB1 H 1 1.524 0.000 . 1 . . . A 18 ALA HB1 . 25287 1 207 . 1 1 18 18 ALA HB2 H 1 1.524 0.000 . 1 . . . A 18 ALA HB2 . 25287 1 208 . 1 1 18 18 ALA HB3 H 1 1.524 0.000 . 1 . . . A 18 ALA HB3 . 25287 1 209 . 1 1 18 18 ALA C C 13 178.204 0.000 . 1 . . . A 18 ALA C . 25287 1 210 . 1 1 18 18 ALA CA C 13 52.997 0.000 . 1 . . . A 18 ALA CA . 25287 1 211 . 1 1 18 18 ALA CB C 13 19.943 0.000 . 1 . . . A 18 ALA CB . 25287 1 212 . 1 1 18 18 ALA N N 15 123.111 0.000 . 1 . . . A 18 ALA N . 25287 1 213 . 1 1 19 19 GLY H H 1 8.241 0.000 . 1 . . . A 19 GLY H . 25287 1 214 . 1 1 19 19 GLY HA2 H 1 4.056 0.000 . 2 . . . A 19 GLY HA2 . 25287 1 215 . 1 1 19 19 GLY HA3 H 1 4.054 0.000 . 2 . . . A 19 GLY HA3 . 25287 1 216 . 1 1 19 19 GLY C C 13 174.345 0.000 . 1 . . . A 19 GLY C . 25287 1 217 . 1 1 19 19 GLY CA C 13 45.614 0.000 . 1 . . . A 19 GLY CA . 25287 1 218 . 1 1 19 19 GLY N N 15 107.422 0.000 . 1 . . . A 19 GLY N . 25287 1 219 . 1 1 20 20 GLU H H 1 8.465 0.000 . 1 . . . A 20 GLU H . 25287 1 220 . 1 1 20 20 GLU HA H 1 4.476 0.000 . 1 . . . A 20 GLU HA . 25287 1 221 . 1 1 20 20 GLU HB2 H 1 2.236 0.000 . 2 . . . A 20 GLU HB2 . 25287 1 222 . 1 1 20 20 GLU HB3 H 1 2.070 0.000 . 2 . . . A 20 GLU HB3 . 25287 1 223 . 1 1 20 20 GLU HG2 H 1 2.416 0.000 . 2 . . . A 20 GLU HG2 . 25287 1 224 . 1 1 20 20 GLU HG3 H 1 2.414 0.000 . 2 . . . A 20 GLU HG3 . 25287 1 225 . 1 1 20 20 GLU C C 13 176.751 0.000 . 1 . . . A 20 GLU C . 25287 1 226 . 1 1 20 20 GLU CA C 13 56.694 0.000 . 1 . . . A 20 GLU CA . 25287 1 227 . 1 1 20 20 GLU CB C 13 29.981 0.000 . 1 . . . A 20 GLU CB . 25287 1 228 . 1 1 20 20 GLU CG C 13 35.584 0.000 . 1 . . . A 20 GLU CG . 25287 1 229 . 1 1 20 20 GLU N N 15 120.167 0.000 . 1 . . . A 20 GLU N . 25287 1 230 . 1 1 21 21 THR H H 1 8.249 0.000 . 1 . . . A 21 THR H . 25287 1 231 . 1 1 21 21 THR HA H 1 4.506 0.000 . 1 . . . A 21 THR HA . 25287 1 232 . 1 1 21 21 THR HB H 1 4.359 0.000 . 1 . . . A 21 THR HB . 25287 1 233 . 1 1 21 21 THR HG21 H 1 1.231 0.000 . 1 . . . A 21 THR HG21 . 25287 1 234 . 1 1 21 21 THR HG22 H 1 1.231 0.000 . 1 . . . A 21 THR HG22 . 25287 1 235 . 1 1 21 21 THR HG23 H 1 1.231 0.000 . 1 . . . A 21 THR HG23 . 25287 1 236 . 1 1 21 21 THR C C 13 174.502 0.000 . 1 . . . A 21 THR C . 25287 1 237 . 1 1 21 21 THR CA C 13 61.751 0.000 . 1 . . . A 21 THR CA . 25287 1 238 . 1 1 21 21 THR CB C 13 70.068 0.000 . 1 . . . A 21 THR CB . 25287 1 239 . 1 1 21 21 THR CG2 C 13 21.717 0.000 . 1 . . . A 21 THR CG2 . 25287 1 240 . 1 1 21 21 THR N N 15 113.985 0.000 . 1 . . . A 21 THR N . 25287 1 241 . 1 1 22 22 ASP H H 1 8.485 0.000 . 1 . . . A 22 ASP H . 25287 1 242 . 1 1 22 22 ASP HA H 1 4.724 0.000 . 1 . . . A 22 ASP HA . 25287 1 243 . 1 1 22 22 ASP HB2 H 1 2.837 0.000 . 1 . . . A 22 ASP HB2 . 25287 1 244 . 1 1 22 22 ASP HB3 H 1 2.837 0.000 . 1 . . . A 22 ASP HB3 . 25287 1 245 . 1 1 22 22 ASP C C 13 176.791 0.000 . 1 . . . A 22 ASP C . 25287 1 246 . 1 1 22 22 ASP CA C 13 54.670 0.000 . 1 . . . A 22 ASP CA . 25287 1 247 . 1 1 22 22 ASP CB C 13 40.849 0.000 . 1 . . . A 22 ASP CB . 25287 1 248 . 1 1 22 22 ASP N N 15 122.104 0.000 . 1 . . . A 22 ASP N . 25287 1 249 . 1 1 23 23 GLY H H 1 8.489 0.000 . 1 . . . A 23 GLY H . 25287 1 250 . 1 1 23 23 GLY HA2 H 1 4.064 0.000 . 1 . . . A 23 GLY HA2 . 25287 1 251 . 1 1 23 23 GLY HA3 H 1 4.064 0.000 . 1 . . . A 23 GLY HA3 . 25287 1 252 . 1 1 23 23 GLY C C 13 174.744 0.000 . 1 . . . A 23 GLY C . 25287 1 253 . 1 1 23 23 GLY CA C 13 45.807 0.000 . 1 . . . A 23 GLY CA . 25287 1 254 . 1 1 23 23 GLY N N 15 109.344 0.000 . 1 . . . A 23 GLY N . 25287 1 255 . 1 1 24 24 THR H H 1 8.106 0.000 . 1 . . . A 24 THR H . 25287 1 256 . 1 1 24 24 THR HA H 1 4.332 0.000 . 1 . . . A 24 THR HA . 25287 1 257 . 1 1 24 24 THR HB H 1 4.222 0.000 . 1 . . . A 24 THR HB . 25287 1 258 . 1 1 24 24 THR HG21 H 1 1.261 0.000 . 1 . . . A 24 THR HG21 . 25287 1 259 . 1 1 24 24 THR HG22 H 1 1.261 0.000 . 1 . . . A 24 THR HG22 . 25287 1 260 . 1 1 24 24 THR HG23 H 1 1.261 0.000 . 1 . . . A 24 THR HG23 . 25287 1 261 . 1 1 24 24 THR C C 13 174.200 0.000 . 1 . . . A 24 THR C . 25287 1 262 . 1 1 24 24 THR CA C 13 62.961 0.000 . 1 . . . A 24 THR CA . 25287 1 263 . 1 1 24 24 THR CB C 13 69.827 0.000 . 1 . . . A 24 THR CB . 25287 1 264 . 1 1 24 24 THR CG2 C 13 21.756 0.000 . 1 . . . A 24 THR CG2 . 25287 1 265 . 1 1 24 24 THR N N 15 115.594 0.000 . 1 . . . A 24 THR N . 25287 1 266 . 1 1 25 25 ASP H H 1 8.590 0.000 . 1 . . . A 25 ASP H . 25287 1 267 . 1 1 25 25 ASP HA H 1 4.713 0.000 . 1 . . . A 25 ASP HA . 25287 1 268 . 1 1 25 25 ASP HB2 H 1 2.870 0.000 . 2 . . . A 25 ASP HB2 . 25287 1 269 . 1 1 25 25 ASP HB3 H 1 2.798 0.000 . 2 . . . A 25 ASP HB3 . 25287 1 270 . 1 1 25 25 ASP C C 13 176.115 0.000 . 1 . . . A 25 ASP C . 25287 1 271 . 1 1 25 25 ASP CA C 13 54.341 0.000 . 1 . . . A 25 ASP CA . 25287 1 272 . 1 1 25 25 ASP CB C 13 40.939 0.000 . 1 . . . A 25 ASP CB . 25287 1 273 . 1 1 25 25 ASP N N 15 123.567 0.000 . 1 . . . A 25 ASP N . 25287 1 274 . 1 1 26 26 LEU H H 1 8.448 0.000 . 1 . . . A 26 LEU H . 25287 1 275 . 1 1 26 26 LEU HA H 1 4.361 0.000 . 1 . . . A 26 LEU HA . 25287 1 276 . 1 1 26 26 LEU HB2 H 1 1.460 0.000 . 2 . . . A 26 LEU HB2 . 25287 1 277 . 1 1 26 26 LEU HB3 H 1 1.257 0.000 . 2 . . . A 26 LEU HB3 . 25287 1 278 . 1 1 26 26 LEU HG H 1 1.581 0.000 . 1 . . . A 26 LEU HG . 25287 1 279 . 1 1 26 26 LEU HD11 H 1 0.697 0.000 . 2 . . . A 26 LEU HD11 . 25287 1 280 . 1 1 26 26 LEU HD12 H 1 0.697 0.000 . 2 . . . A 26 LEU HD12 . 25287 1 281 . 1 1 26 26 LEU HD13 H 1 0.697 0.000 . 2 . . . A 26 LEU HD13 . 25287 1 282 . 1 1 26 26 LEU HD21 H 1 0.803 0.000 . 2 . . . A 26 LEU HD21 . 25287 1 283 . 1 1 26 26 LEU HD22 H 1 0.803 0.000 . 2 . . . A 26 LEU HD22 . 25287 1 284 . 1 1 26 26 LEU HD23 H 1 0.803 0.000 . 2 . . . A 26 LEU HD23 . 25287 1 285 . 1 1 26 26 LEU C C 13 176.463 0.000 . 1 . . . A 26 LEU C . 25287 1 286 . 1 1 26 26 LEU CA C 13 54.279 0.000 . 1 . . . A 26 LEU CA . 25287 1 287 . 1 1 26 26 LEU CB C 13 41.150 0.000 . 1 . . . A 26 LEU CB . 25287 1 288 . 1 1 26 26 LEU CG C 13 26.886 0.000 . 1 . . . A 26 LEU CG . 25287 1 289 . 1 1 26 26 LEU CD1 C 13 23.450 0.000 . 2 . . . A 26 LEU CD1 . 25287 1 290 . 1 1 26 26 LEU CD2 C 13 26.315 0.000 . 2 . . . A 26 LEU CD2 . 25287 1 291 . 1 1 26 26 LEU N N 15 123.589 0.000 . 1 . . . A 26 LEU N . 25287 1 292 . 1 1 27 27 SER H H 1 8.248 0.000 . 1 . . . A 27 SER H . 25287 1 293 . 1 1 27 27 SER HA H 1 4.320 0.000 . 1 . . . A 27 SER HA . 25287 1 294 . 1 1 27 27 SER HB2 H 1 4.040 0.000 . 2 . . . A 27 SER HB2 . 25287 1 295 . 1 1 27 27 SER HB3 H 1 3.972 0.000 . 2 . . . A 27 SER HB3 . 25287 1 296 . 1 1 27 27 SER C C 13 175.108 0.000 . 1 . . . A 27 SER C . 25287 1 297 . 1 1 27 27 SER CA C 13 59.694 0.000 . 1 . . . A 27 SER CA . 25287 1 298 . 1 1 27 27 SER CB C 13 64.214 0.000 . 1 . . . A 27 SER CB . 25287 1 299 . 1 1 27 27 SER N N 15 115.188 0.000 . 1 . . . A 27 SER N . 25287 1 300 . 1 1 28 28 GLY H H 1 8.568 0.000 . 1 . . . A 28 GLY H . 25287 1 301 . 1 1 28 28 GLY HA2 H 1 4.249 0.000 . 2 . . . A 28 GLY HA2 . 25287 1 302 . 1 1 28 28 GLY HA3 H 1 3.882 0.000 . 2 . . . A 28 GLY HA3 . 25287 1 303 . 1 1 28 28 GLY C C 13 174.255 0.000 . 1 . . . A 28 GLY C . 25287 1 304 . 1 1 28 28 GLY CA C 13 45.416 0.000 . 1 . . . A 28 GLY CA . 25287 1 305 . 1 1 28 28 GLY N N 15 111.343 0.000 . 1 . . . A 28 GLY N . 25287 1 306 . 1 1 29 29 ASP H H 1 8.663 0.000 . 1 . . . A 29 ASP H . 25287 1 307 . 1 1 29 29 ASP HA H 1 4.845 0.000 . 1 . . . A 29 ASP HA . 25287 1 308 . 1 1 29 29 ASP HB2 H 1 2.890 0.000 . 2 . . . A 29 ASP HB2 . 25287 1 309 . 1 1 29 29 ASP HB3 H 1 2.680 0.000 . 2 . . . A 29 ASP HB3 . 25287 1 310 . 1 1 29 29 ASP C C 13 176.437 0.000 . 1 . . . A 29 ASP C . 25287 1 311 . 1 1 29 29 ASP CA C 13 54.266 0.000 . 1 . . . A 29 ASP CA . 25287 1 312 . 1 1 29 29 ASP CB C 13 39.632 0.000 . 1 . . . A 29 ASP CB . 25287 1 313 . 1 1 29 29 ASP N N 15 122.959 0.000 . 1 . . . A 29 ASP N . 25287 1 314 . 1 1 30 30 PHE H H 1 8.048 0.000 . 1 . . . A 30 PHE H . 25287 1 315 . 1 1 30 30 PHE HA H 1 4.723 0.000 . 1 . . . A 30 PHE HA . 25287 1 316 . 1 1 30 30 PHE HB2 H 1 3.304 0.000 . 2 . . . A 30 PHE HB2 . 25287 1 317 . 1 1 30 30 PHE HB3 H 1 3.035 0.000 . 2 . . . A 30 PHE HB3 . 25287 1 318 . 1 1 30 30 PHE HD1 H 1 7.322 0.000 . 3 . . . A 30 PHE HD1 . 25287 1 319 . 1 1 30 30 PHE HD2 H 1 7.322 0.000 . 3 . . . A 30 PHE HD2 . 25287 1 320 . 1 1 30 30 PHE HE1 H 1 7.217 0.000 . 3 . . . A 30 PHE HE1 . 25287 1 321 . 1 1 30 30 PHE HE2 H 1 7.217 0.000 . 3 . . . A 30 PHE HE2 . 25287 1 322 . 1 1 30 30 PHE HZ H 1 7.321 0.000 . 1 . . . A 30 PHE HZ . 25287 1 323 . 1 1 30 30 PHE C C 13 175.418 0.000 . 1 . . . A 30 PHE C . 25287 1 324 . 1 1 30 30 PHE CA C 13 57.743 0.000 . 1 . . . A 30 PHE CA . 25287 1 325 . 1 1 30 30 PHE CB C 13 40.403 0.000 . 1 . . . A 30 PHE CB . 25287 1 326 . 1 1 30 30 PHE CD1 C 13 132.280 0.000 . 3 . . . A 30 PHE CD1 . 25287 1 327 . 1 1 30 30 PHE CD2 C 13 132.280 0.000 . 3 . . . A 30 PHE CD2 . 25287 1 328 . 1 1 30 30 PHE CE1 C 13 130.423 0.000 . 3 . . . A 30 PHE CE1 . 25287 1 329 . 1 1 30 30 PHE CE2 C 13 130.423 0.000 . 3 . . . A 30 PHE CE2 . 25287 1 330 . 1 1 30 30 PHE CZ C 13 128.801 0.000 . 1 . . . A 30 PHE CZ . 25287 1 331 . 1 1 30 30 PHE N N 15 121.956 0.000 . 1 . . . A 30 PHE N . 25287 1 332 . 1 1 31 31 LEU H H 1 7.525 0.000 . 1 . . . A 31 LEU H . 25287 1 333 . 1 1 31 31 LEU HA H 1 3.323 0.000 . 1 . . . A 31 LEU HA . 25287 1 334 . 1 1 31 31 LEU HB2 H 1 1.637 0.000 . 2 . . . A 31 LEU HB2 . 25287 1 335 . 1 1 31 31 LEU HB3 H 1 1.040 0.000 . 2 . . . A 31 LEU HB3 . 25287 1 336 . 1 1 31 31 LEU HG H 1 1.212 0.000 . 1 . . . A 31 LEU HG . 25287 1 337 . 1 1 31 31 LEU HD11 H 1 0.476 0.000 . 2 . . . A 31 LEU HD11 . 25287 1 338 . 1 1 31 31 LEU HD12 H 1 0.476 0.000 . 2 . . . A 31 LEU HD12 . 25287 1 339 . 1 1 31 31 LEU HD13 H 1 0.476 0.000 . 2 . . . A 31 LEU HD13 . 25287 1 340 . 1 1 31 31 LEU HD21 H 1 0.791 0.000 . 2 . . . A 31 LEU HD21 . 25287 1 341 . 1 1 31 31 LEU HD22 H 1 0.791 0.000 . 2 . . . A 31 LEU HD22 . 25287 1 342 . 1 1 31 31 LEU HD23 H 1 0.791 0.000 . 2 . . . A 31 LEU HD23 . 25287 1 343 . 1 1 31 31 LEU C C 13 176.455 0.000 . 1 . . . A 31 LEU C . 25287 1 344 . 1 1 31 31 LEU CA C 13 57.861 0.000 . 1 . . . A 31 LEU CA . 25287 1 345 . 1 1 31 31 LEU CB C 13 42.167 0.000 . 1 . . . A 31 LEU CB . 25287 1 346 . 1 1 31 31 LEU CG C 13 26.992 0.000 . 1 . . . A 31 LEU CG . 25287 1 347 . 1 1 31 31 LEU CD1 C 13 23.890 0.000 . 2 . . . A 31 LEU CD1 . 25287 1 348 . 1 1 31 31 LEU CD2 C 13 25.392 0.000 . 2 . . . A 31 LEU CD2 . 25287 1 349 . 1 1 31 31 LEU N N 15 118.664 0.000 . 1 . . . A 31 LEU N . 25287 1 350 . 1 1 32 32 ASP H H 1 8.025 0.000 . 1 . . . A 32 ASP H . 25287 1 351 . 1 1 32 32 ASP HA H 1 5.049 0.000 . 1 . . . A 32 ASP HA . 25287 1 352 . 1 1 32 32 ASP HB2 H 1 3.038 0.000 . 2 . . . A 32 ASP HB2 . 25287 1 353 . 1 1 32 32 ASP HB3 H 1 2.361 0.000 . 2 . . . A 32 ASP HB3 . 25287 1 354 . 1 1 32 32 ASP C C 13 175.876 0.000 . 1 . . . A 32 ASP C . 25287 1 355 . 1 1 32 32 ASP CA C 13 53.700 0.000 . 1 . . . A 32 ASP CA . 25287 1 356 . 1 1 32 32 ASP CB C 13 41.780 0.000 . 1 . . . A 32 ASP CB . 25287 1 357 . 1 1 32 32 ASP N N 15 111.809 0.000 . 1 . . . A 32 ASP N . 25287 1 358 . 1 1 33 33 LEU H H 1 7.213 0.000 . 1 . . . A 33 LEU H . 25287 1 359 . 1 1 33 33 LEU HA H 1 4.333 0.000 . 1 . . . A 33 LEU HA . 25287 1 360 . 1 1 33 33 LEU HB2 H 1 1.770 0.000 . 2 . . . A 33 LEU HB2 . 25287 1 361 . 1 1 33 33 LEU HB3 H 1 1.416 0.000 . 2 . . . A 33 LEU HB3 . 25287 1 362 . 1 1 33 33 LEU HG H 1 1.778 0.000 . 1 . . . A 33 LEU HG . 25287 1 363 . 1 1 33 33 LEU HD11 H 1 0.951 0.000 . 2 . . . A 33 LEU HD11 . 25287 1 364 . 1 1 33 33 LEU HD12 H 1 0.951 0.000 . 2 . . . A 33 LEU HD12 . 25287 1 365 . 1 1 33 33 LEU HD13 H 1 0.951 0.000 . 2 . . . A 33 LEU HD13 . 25287 1 366 . 1 1 33 33 LEU HD21 H 1 1.054 0.000 . 2 . . . A 33 LEU HD21 . 25287 1 367 . 1 1 33 33 LEU HD22 H 1 1.054 0.000 . 2 . . . A 33 LEU HD22 . 25287 1 368 . 1 1 33 33 LEU HD23 H 1 1.054 0.000 . 2 . . . A 33 LEU HD23 . 25287 1 369 . 1 1 33 33 LEU C C 13 174.910 0.000 . 1 . . . A 33 LEU C . 25287 1 370 . 1 1 33 33 LEU CA C 13 54.333 0.000 . 1 . . . A 33 LEU CA . 25287 1 371 . 1 1 33 33 LEU CB C 13 42.451 0.000 . 1 . . . A 33 LEU CB . 25287 1 372 . 1 1 33 33 LEU CG C 13 26.965 0.000 . 1 . . . A 33 LEU CG . 25287 1 373 . 1 1 33 33 LEU CD1 C 13 22.368 0.000 . 2 . . . A 33 LEU CD1 . 25287 1 374 . 1 1 33 33 LEU CD2 C 13 26.168 0.000 . 2 . . . A 33 LEU CD2 . 25287 1 375 . 1 1 33 33 LEU N N 15 122.121 0.000 . 1 . . . A 33 LEU N . 25287 1 376 . 1 1 34 34 ARG H H 1 8.434 0.000 . 1 . . . A 34 ARG H . 25287 1 377 . 1 1 34 34 ARG HA H 1 4.731 0.000 . 1 . . . A 34 ARG HA . 25287 1 378 . 1 1 34 34 ARG HB2 H 1 2.190 0.000 . 2 . . . A 34 ARG HB2 . 25287 1 379 . 1 1 34 34 ARG HB3 H 1 1.840 0.000 . 2 . . . A 34 ARG HB3 . 25287 1 380 . 1 1 34 34 ARG HG2 H 1 1.930 0.000 . 2 . . . A 34 ARG HG2 . 25287 1 381 . 1 1 34 34 ARG HG3 H 1 1.629 0.000 . 2 . . . A 34 ARG HG3 . 25287 1 382 . 1 1 34 34 ARG HD2 H 1 3.414 0.000 . 2 . . . A 34 ARG HD2 . 25287 1 383 . 1 1 34 34 ARG HD3 H 1 3.350 0.000 . 2 . . . A 34 ARG HD3 . 25287 1 384 . 1 1 34 34 ARG HE H 1 7.872 0.000 . 1 . . . A 34 ARG HE . 25287 1 385 . 1 1 34 34 ARG C C 13 180.010 0.000 . 1 . . . A 34 ARG C . 25287 1 386 . 1 1 34 34 ARG CA C 13 55.394 0.000 . 1 . . . A 34 ARG CA . 25287 1 387 . 1 1 34 34 ARG CB C 13 30.203 0.000 . 1 . . . A 34 ARG CB . 25287 1 388 . 1 1 34 34 ARG CG C 13 28.385 0.000 . 1 . . . A 34 ARG CG . 25287 1 389 . 1 1 34 34 ARG CD C 13 43.581 0.000 . 1 . . . A 34 ARG CD . 25287 1 390 . 1 1 34 34 ARG N N 15 116.262 0.000 . 1 . . . A 34 ARG N . 25287 1 391 . 1 1 34 34 ARG NE N 15 85.010 0.000 . 1 . . . A 34 ARG NE . 25287 1 392 . 1 1 35 35 PHE H H 1 8.372 0.000 . 1 . . . A 35 PHE H . 25287 1 393 . 1 1 35 35 PHE HA H 1 4.368 0.000 . 1 . . . A 35 PHE HA . 25287 1 394 . 1 1 35 35 PHE HB2 H 1 3.540 0.000 . 2 . . . A 35 PHE HB2 . 25287 1 395 . 1 1 35 35 PHE HB3 H 1 3.081 0.000 . 2 . . . A 35 PHE HB3 . 25287 1 396 . 1 1 35 35 PHE HD1 H 1 7.168 0.000 . 3 . . . A 35 PHE HD1 . 25287 1 397 . 1 1 35 35 PHE HD2 H 1 7.168 0.000 . 3 . . . A 35 PHE HD2 . 25287 1 398 . 1 1 35 35 PHE HE1 H 1 6.956 0.000 . 3 . . . A 35 PHE HE1 . 25287 1 399 . 1 1 35 35 PHE HE2 H 1 6.956 0.000 . 3 . . . A 35 PHE HE2 . 25287 1 400 . 1 1 35 35 PHE HZ H 1 6.886 0.000 . 1 . . . A 35 PHE HZ . 25287 1 401 . 1 1 35 35 PHE C C 13 178.684 0.000 . 1 . . . A 35 PHE C . 25287 1 402 . 1 1 35 35 PHE CA C 13 62.854 0.000 . 1 . . . A 35 PHE CA . 25287 1 403 . 1 1 35 35 PHE CB C 13 38.035 0.000 . 1 . . . A 35 PHE CB . 25287 1 404 . 1 1 35 35 PHE CD1 C 13 131.188 0.000 . 3 . . . A 35 PHE CD1 . 25287 1 405 . 1 1 35 35 PHE CD2 C 13 131.188 0.000 . 3 . . . A 35 PHE CD2 . 25287 1 406 . 1 1 35 35 PHE CE1 C 13 130.702 0.000 . 3 . . . A 35 PHE CE1 . 25287 1 407 . 1 1 35 35 PHE CE2 C 13 130.702 0.000 . 3 . . . A 35 PHE CE2 . 25287 1 408 . 1 1 35 35 PHE CZ C 13 127.833 0.000 . 1 . . . A 35 PHE CZ . 25287 1 409 . 1 1 35 35 PHE N N 15 122.494 0.000 . 1 . . . A 35 PHE N . 25287 1 410 . 1 1 36 36 GLU H H 1 9.628 0.000 . 1 . . . A 36 GLU H . 25287 1 411 . 1 1 36 36 GLU HA H 1 4.359 0.000 . 1 . . . A 36 GLU HA . 25287 1 412 . 1 1 36 36 GLU HB2 H 1 2.212 0.000 . 2 . . . A 36 GLU HB2 . 25287 1 413 . 1 1 36 36 GLU HB3 H 1 2.148 0.000 . 2 . . . A 36 GLU HB3 . 25287 1 414 . 1 1 36 36 GLU HG2 H 1 2.510 0.000 . 1 . . . A 36 GLU HG2 . 25287 1 415 . 1 1 36 36 GLU HG3 H 1 2.510 0.000 . 1 . . . A 36 GLU HG3 . 25287 1 416 . 1 1 36 36 GLU C C 13 178.439 0.000 . 1 . . . A 36 GLU C . 25287 1 417 . 1 1 36 36 GLU CA C 13 59.213 0.000 . 1 . . . A 36 GLU CA . 25287 1 418 . 1 1 36 36 GLU CB C 13 29.371 0.000 . 1 . . . A 36 GLU CB . 25287 1 419 . 1 1 36 36 GLU CG C 13 35.552 0.000 . 1 . . . A 36 GLU CG . 25287 1 420 . 1 1 36 36 GLU N N 15 116.928 0.000 . 1 . . . A 36 GLU N . 25287 1 421 . 1 1 37 37 ASP H H 1 7.590 0.000 . 1 . . . A 37 ASP H . 25287 1 422 . 1 1 37 37 ASP HA H 1 4.803 0.000 . 1 . . . A 37 ASP HA . 25287 1 423 . 1 1 37 37 ASP HB2 H 1 3.050 0.000 . 2 . . . A 37 ASP HB2 . 25287 1 424 . 1 1 37 37 ASP HB3 H 1 3.030 0.000 . 2 . . . A 37 ASP HB3 . 25287 1 425 . 1 1 37 37 ASP C C 13 177.830 0.000 . 1 . . . A 37 ASP C . 25287 1 426 . 1 1 37 37 ASP CA C 13 56.451 0.000 . 1 . . . A 37 ASP CA . 25287 1 427 . 1 1 37 37 ASP CB C 13 41.326 0.000 . 1 . . . A 37 ASP CB . 25287 1 428 . 1 1 37 37 ASP N N 15 118.437 0.000 . 1 . . . A 37 ASP N . 25287 1 429 . 1 1 38 38 ILE H H 1 7.705 0.000 . 1 . . . A 38 ILE H . 25287 1 430 . 1 1 38 38 ILE HA H 1 4.576 0.000 . 1 . . . A 38 ILE HA . 25287 1 431 . 1 1 38 38 ILE HB H 1 2.409 0.000 . 1 . . . A 38 ILE HB . 25287 1 432 . 1 1 38 38 ILE HG12 H 1 1.829 0.000 . 2 . . . A 38 ILE HG12 . 25287 1 433 . 1 1 38 38 ILE HG13 H 1 1.503 0.000 . 2 . . . A 38 ILE HG13 . 25287 1 434 . 1 1 38 38 ILE HG21 H 1 1.048 0.000 . 1 . . . A 38 ILE HG21 . 25287 1 435 . 1 1 38 38 ILE HG22 H 1 1.048 0.000 . 1 . . . A 38 ILE HG22 . 25287 1 436 . 1 1 38 38 ILE HG23 H 1 1.048 0.000 . 1 . . . A 38 ILE HG23 . 25287 1 437 . 1 1 38 38 ILE HD11 H 1 0.869 0.000 . 1 . . . A 38 ILE HD11 . 25287 1 438 . 1 1 38 38 ILE HD12 H 1 0.869 0.000 . 1 . . . A 38 ILE HD12 . 25287 1 439 . 1 1 38 38 ILE HD13 H 1 0.869 0.000 . 1 . . . A 38 ILE HD13 . 25287 1 440 . 1 1 38 38 ILE C C 13 176.099 0.000 . 1 . . . A 38 ILE C . 25287 1 441 . 1 1 38 38 ILE CA C 13 62.157 0.000 . 1 . . . A 38 ILE CA . 25287 1 442 . 1 1 38 38 ILE CB C 13 38.774 0.000 . 1 . . . A 38 ILE CB . 25287 1 443 . 1 1 38 38 ILE CG1 C 13 27.576 0.000 . 1 . . . A 38 ILE CG1 . 25287 1 444 . 1 1 38 38 ILE CG2 C 13 18.958 0.000 . 1 . . . A 38 ILE CG2 . 25287 1 445 . 1 1 38 38 ILE CD1 C 13 13.589 0.000 . 1 . . . A 38 ILE CD1 . 25287 1 446 . 1 1 38 38 ILE N N 15 113.604 0.000 . 1 . . . A 38 ILE N . 25287 1 447 . 1 1 39 39 GLY H H 1 7.736 0.000 . 1 . . . A 39 GLY H . 25287 1 448 . 1 1 39 39 GLY HA2 H 1 4.246 0.000 . 2 . . . A 39 GLY HA2 . 25287 1 449 . 1 1 39 39 GLY HA3 H 1 3.858 0.000 . 2 . . . A 39 GLY HA3 . 25287 1 450 . 1 1 39 39 GLY C C 13 176.099 0.000 . 1 . . . A 39 GLY C . 25287 1 451 . 1 1 39 39 GLY CA C 13 46.338 0.000 . 1 . . . A 39 GLY CA . 25287 1 452 . 1 1 39 39 GLY N N 15 106.766 0.000 . 1 . . . A 39 GLY N . 25287 1 453 . 1 1 40 40 TYR H H 1 7.985 0.000 . 1 . . . A 40 TYR H . 25287 1 454 . 1 1 40 40 TYR HA H 1 4.587 0.000 . 1 . . . A 40 TYR HA . 25287 1 455 . 1 1 40 40 TYR HB2 H 1 2.955 0.000 . 2 . . . A 40 TYR HB2 . 25287 1 456 . 1 1 40 40 TYR HB3 H 1 2.831 0.000 . 2 . . . A 40 TYR HB3 . 25287 1 457 . 1 1 40 40 TYR HD1 H 1 6.974 0.000 . 3 . . . A 40 TYR HD1 . 25287 1 458 . 1 1 40 40 TYR HD2 H 1 6.974 0.000 . 3 . . . A 40 TYR HD2 . 25287 1 459 . 1 1 40 40 TYR HE1 H 1 6.743 0.000 . 3 . . . A 40 TYR HE1 . 25287 1 460 . 1 1 40 40 TYR HE2 H 1 6.743 0.000 . 3 . . . A 40 TYR HE2 . 25287 1 461 . 1 1 40 40 TYR C C 13 174.516 0.000 . 1 . . . A 40 TYR C . 25287 1 462 . 1 1 40 40 TYR CA C 13 58.402 0.000 . 1 . . . A 40 TYR CA . 25287 1 463 . 1 1 40 40 TYR CB C 13 40.246 0.000 . 1 . . . A 40 TYR CB . 25287 1 464 . 1 1 40 40 TYR CD1 C 13 131.897 0.000 . 3 . . . A 40 TYR CD1 . 25287 1 465 . 1 1 40 40 TYR CD2 C 13 131.897 0.000 . 3 . . . A 40 TYR CD2 . 25287 1 466 . 1 1 40 40 TYR CE1 C 13 118.102 0.000 . 3 . . . A 40 TYR CE1 . 25287 1 467 . 1 1 40 40 TYR CE2 C 13 118.102 0.000 . 3 . . . A 40 TYR CE2 . 25287 1 468 . 1 1 40 40 TYR N N 15 121.301 0.000 . 1 . . . A 40 TYR N . 25287 1 469 . 1 1 41 41 ASP H H 1 8.032 0.000 . 1 . . . A 41 ASP H . 25287 1 470 . 1 1 41 41 ASP HA H 1 4.748 0.000 . 1 . . . A 41 ASP HA . 25287 1 471 . 1 1 41 41 ASP HB2 H 1 3.281 0.000 . 2 . . . A 41 ASP HB2 . 25287 1 472 . 1 1 41 41 ASP HB3 H 1 2.859 0.000 . 2 . . . A 41 ASP HB3 . 25287 1 473 . 1 1 41 41 ASP C C 13 175.766 0.000 . 1 . . . A 41 ASP C . 25287 1 474 . 1 1 41 41 ASP CA C 13 52.574 0.000 . 1 . . . A 41 ASP CA . 25287 1 475 . 1 1 41 41 ASP CB C 13 41.752 0.000 . 1 . . . A 41 ASP CB . 25287 1 476 . 1 1 41 41 ASP N N 15 123.242 0.000 . 1 . . . A 41 ASP N . 25287 1 477 . 1 1 42 42 SER H H 1 8.929 0.000 . 1 . . . A 42 SER H . 25287 1 478 . 1 1 42 42 SER HA H 1 4.203 0.000 . 1 . . . A 42 SER HA . 25287 1 479 . 1 1 42 42 SER HB2 H 1 4.180 0.000 . 2 . . . A 42 SER HB2 . 25287 1 480 . 1 1 42 42 SER HB3 H 1 4.325 0.000 . 2 . . . A 42 SER HB3 . 25287 1 481 . 1 1 42 42 SER C C 13 175.951 0.000 . 1 . . . A 42 SER C . 25287 1 482 . 1 1 42 42 SER CA C 13 60.495 0.000 . 1 . . . A 42 SER CA . 25287 1 483 . 1 1 42 42 SER CB C 13 65.773 0.000 . 1 . . . A 42 SER CB . 25287 1 484 . 1 1 42 42 SER N N 15 114.147 0.000 . 1 . . . A 42 SER N . 25287 1 485 . 1 1 43 43 LEU H H 1 7.823 0.000 . 1 . . . A 43 LEU H . 25287 1 486 . 1 1 43 43 LEU HA H 1 4.253 0.000 . 1 . . . A 43 LEU HA . 25287 1 487 . 1 1 43 43 LEU HB2 H 1 2.332 0.000 . 2 . . . A 43 LEU HB2 . 25287 1 488 . 1 1 43 43 LEU HB3 H 1 1.849 0.000 . 2 . . . A 43 LEU HB3 . 25287 1 489 . 1 1 43 43 LEU HG H 1 1.725 0.000 . 1 . . . A 43 LEU HG . 25287 1 490 . 1 1 43 43 LEU HD11 H 1 1.013 0.000 . 2 . . . A 43 LEU HD11 . 25287 1 491 . 1 1 43 43 LEU HD12 H 1 1.013 0.000 . 2 . . . A 43 LEU HD12 . 25287 1 492 . 1 1 43 43 LEU HD13 H 1 1.013 0.000 . 2 . . . A 43 LEU HD13 . 25287 1 493 . 1 1 43 43 LEU HD21 H 1 1.061 0.000 . 2 . . . A 43 LEU HD21 . 25287 1 494 . 1 1 43 43 LEU HD22 H 1 1.061 0.000 . 2 . . . A 43 LEU HD22 . 25287 1 495 . 1 1 43 43 LEU HD23 H 1 1.061 0.000 . 2 . . . A 43 LEU HD23 . 25287 1 496 . 1 1 43 43 LEU C C 13 178.993 0.000 . 1 . . . A 43 LEU C . 25287 1 497 . 1 1 43 43 LEU CA C 13 58.450 0.000 . 1 . . . A 43 LEU CA . 25287 1 498 . 1 1 43 43 LEU CB C 13 41.124 0.000 . 1 . . . A 43 LEU CB . 25287 1 499 . 1 1 43 43 LEU CG C 13 27.504 0.000 . 1 . . . A 43 LEU CG . 25287 1 500 . 1 1 43 43 LEU CD1 C 13 24.543 0.000 . 1 . . . A 43 LEU CD1 . 25287 1 501 . 1 1 43 43 LEU CD2 C 13 24.543 0.000 . 1 . . . A 43 LEU CD2 . 25287 1 502 . 1 1 43 43 LEU N N 15 124.030 0.000 . 1 . . . A 43 LEU N . 25287 1 503 . 1 1 44 44 ALA H H 1 8.122 0.000 . 1 . . . A 44 ALA H . 25287 1 504 . 1 1 44 44 ALA HA H 1 4.292 0.000 . 1 . . . A 44 ALA HA . 25287 1 505 . 1 1 44 44 ALA HB1 H 1 1.522 0.000 . 1 . . . A 44 ALA HB1 . 25287 1 506 . 1 1 44 44 ALA HB2 H 1 1.522 0.000 . 1 . . . A 44 ALA HB2 . 25287 1 507 . 1 1 44 44 ALA HB3 H 1 1.522 0.000 . 1 . . . A 44 ALA HB3 . 25287 1 508 . 1 1 44 44 ALA C C 13 181.850 0.000 . 1 . . . A 44 ALA C . 25287 1 509 . 1 1 44 44 ALA CA C 13 55.114 0.000 . 1 . . . A 44 ALA CA . 25287 1 510 . 1 1 44 44 ALA CB C 13 18.739 0.000 . 1 . . . A 44 ALA CB . 25287 1 511 . 1 1 44 44 ALA N N 15 123.003 0.000 . 1 . . . A 44 ALA N . 25287 1 512 . 1 1 45 45 LEU H H 1 8.399 0.000 . 1 . . . A 45 LEU H . 25287 1 513 . 1 1 45 45 LEU HA H 1 3.889 0.000 . 1 . . . A 45 LEU HA . 25287 1 514 . 1 1 45 45 LEU HB2 H 1 1.475 0.000 . 2 . . . A 45 LEU HB2 . 25287 1 515 . 1 1 45 45 LEU HB3 H 1 1.429 0.000 . 2 . . . A 45 LEU HB3 . 25287 1 516 . 1 1 45 45 LEU HG H 1 1.382 0.000 . 1 . . . A 45 LEU HG . 25287 1 517 . 1 1 45 45 LEU HD11 H 1 0.230 0.000 . 2 . . . A 45 LEU HD11 . 25287 1 518 . 1 1 45 45 LEU HD12 H 1 0.230 0.000 . 2 . . . A 45 LEU HD12 . 25287 1 519 . 1 1 45 45 LEU HD13 H 1 0.230 0.000 . 2 . . . A 45 LEU HD13 . 25287 1 520 . 1 1 45 45 LEU HD21 H 1 0.340 0.000 . 2 . . . A 45 LEU HD21 . 25287 1 521 . 1 1 45 45 LEU HD22 H 1 0.340 0.000 . 2 . . . A 45 LEU HD22 . 25287 1 522 . 1 1 45 45 LEU HD23 H 1 0.340 0.000 . 2 . . . A 45 LEU HD23 . 25287 1 523 . 1 1 45 45 LEU C C 13 178.320 0.000 . 1 . . . A 45 LEU C . 25287 1 524 . 1 1 45 45 LEU CA C 13 58.231 0.000 . 1 . . . A 45 LEU CA . 25287 1 525 . 1 1 45 45 LEU CB C 13 41.328 0.000 . 1 . . . A 45 LEU CB . 25287 1 526 . 1 1 45 45 LEU CG C 13 26.880 0.000 . 1 . . . A 45 LEU CG . 25287 1 527 . 1 1 45 45 LEU CD1 C 13 23.833 0.000 . 2 . . . A 45 LEU CD1 . 25287 1 528 . 1 1 45 45 LEU CD2 C 13 24.106 0.000 . 2 . . . A 45 LEU CD2 . 25287 1 529 . 1 1 45 45 LEU N N 15 120.894 0.000 . 1 . . . A 45 LEU N . 25287 1 530 . 1 1 46 46 MET H H 1 8.240 0.000 . 1 . . . A 46 MET H . 25287 1 531 . 1 1 46 46 MET HA H 1 4.195 0.000 . 1 . . . A 46 MET HA . 25287 1 532 . 1 1 46 46 MET HB2 H 1 2.280 0.000 . 2 . . . A 46 MET HB2 . 25287 1 533 . 1 1 46 46 MET HB3 H 1 2.272 0.000 . 2 . . . A 46 MET HB3 . 25287 1 534 . 1 1 46 46 MET HG2 H 1 2.765 0.000 . 2 . . . A 46 MET HG2 . 25287 1 535 . 1 1 46 46 MET HG3 H 1 2.680 0.000 . 2 . . . A 46 MET HG3 . 25287 1 536 . 1 1 46 46 MET C C 13 179.596 0.000 . 1 . . . A 46 MET C . 25287 1 537 . 1 1 46 46 MET CA C 13 58.925 0.000 . 1 . . . A 46 MET CA . 25287 1 538 . 1 1 46 46 MET CB C 13 32.262 0.000 . 1 . . . A 46 MET CB . 25287 1 539 . 1 1 46 46 MET CG C 13 32.262 0.000 . 1 . . . A 46 MET CG . 25287 1 540 . 1 1 46 46 MET N N 15 119.837 0.000 . 1 . . . A 46 MET N . 25287 1 541 . 1 1 47 47 GLU H H 1 8.460 0.000 . 1 . . . A 47 GLU H . 25287 1 542 . 1 1 47 47 GLU HA H 1 4.196 0.000 . 1 . . . A 47 GLU HA . 25287 1 543 . 1 1 47 47 GLU HB2 H 1 2.330 0.000 . 2 . . . A 47 GLU HB2 . 25287 1 544 . 1 1 47 47 GLU HB3 H 1 2.196 0.000 . 2 . . . A 47 GLU HB3 . 25287 1 545 . 1 1 47 47 GLU HG2 H 1 2.599 0.000 . 2 . . . A 47 GLU HG2 . 25287 1 546 . 1 1 47 47 GLU HG3 H 1 2.453 0.000 . 2 . . . A 47 GLU HG3 . 25287 1 547 . 1 1 47 47 GLU C C 13 179.213 0.000 . 1 . . . A 47 GLU C . 25287 1 548 . 1 1 47 47 GLU CA C 13 59.435 0.000 . 1 . . . A 47 GLU CA . 25287 1 549 . 1 1 47 47 GLU CB C 13 29.094 0.000 . 1 . . . A 47 GLU CB . 25287 1 550 . 1 1 47 47 GLU CG C 13 35.290 0.000 . 1 . . . A 47 GLU CG . 25287 1 551 . 1 1 47 47 GLU N N 15 120.516 0.000 . 1 . . . A 47 GLU N . 25287 1 552 . 1 1 48 48 THR H H 1 8.292 0.000 . 1 . . . A 48 THR H . 25287 1 553 . 1 1 48 48 THR HA H 1 3.939 0.000 . 1 . . . A 48 THR HA . 25287 1 554 . 1 1 48 48 THR HB H 1 4.401 0.000 . 1 . . . A 48 THR HB . 25287 1 555 . 1 1 48 48 THR HG21 H 1 1.113 0.000 . 1 . . . A 48 THR HG21 . 25287 1 556 . 1 1 48 48 THR HG22 H 1 1.113 0.000 . 1 . . . A 48 THR HG22 . 25287 1 557 . 1 1 48 48 THR HG23 H 1 1.113 0.000 . 1 . . . A 48 THR HG23 . 25287 1 558 . 1 1 48 48 THR C C 13 176.261 0.000 . 1 . . . A 48 THR C . 25287 1 559 . 1 1 48 48 THR CA C 13 67.890 0.000 . 1 . . . A 48 THR CA . 25287 1 560 . 1 1 48 48 THR CB C 13 68.201 0.000 . 1 . . . A 48 THR CB . 25287 1 561 . 1 1 48 48 THR CG2 C 13 20.776 0.000 . 1 . . . A 48 THR CG2 . 25287 1 562 . 1 1 48 48 THR N N 15 118.558 0.000 . 1 . . . A 48 THR N . 25287 1 563 . 1 1 49 49 ALA H H 1 8.701 0.000 . 1 . . . A 49 ALA H . 25287 1 564 . 1 1 49 49 ALA HA H 1 3.923 0.000 . 1 . . . A 49 ALA HA . 25287 1 565 . 1 1 49 49 ALA HB1 H 1 1.457 0.000 . 1 . . . A 49 ALA HB1 . 25287 1 566 . 1 1 49 49 ALA HB2 H 1 1.457 0.000 . 1 . . . A 49 ALA HB2 . 25287 1 567 . 1 1 49 49 ALA HB3 H 1 1.457 0.000 . 1 . . . A 49 ALA HB3 . 25287 1 568 . 1 1 49 49 ALA C C 13 178.716 0.000 . 1 . . . A 49 ALA C . 25287 1 569 . 1 1 49 49 ALA CA C 13 56.172 0.000 . 1 . . . A 49 ALA CA . 25287 1 570 . 1 1 49 49 ALA CB C 13 17.592 0.000 . 1 . . . A 49 ALA CB . 25287 1 571 . 1 1 49 49 ALA N N 15 123.758 0.000 . 1 . . . A 49 ALA N . 25287 1 572 . 1 1 50 50 ALA H H 1 8.186 0.000 . 1 . . . A 50 ALA H . 25287 1 573 . 1 1 50 50 ALA HA H 1 4.260 0.000 . 1 . . . A 50 ALA HA . 25287 1 574 . 1 1 50 50 ALA HB1 H 1 1.638 0.000 . 1 . . . A 50 ALA HB1 . 25287 1 575 . 1 1 50 50 ALA HB2 H 1 1.638 0.000 . 1 . . . A 50 ALA HB2 . 25287 1 576 . 1 1 50 50 ALA HB3 H 1 1.638 0.000 . 1 . . . A 50 ALA HB3 . 25287 1 577 . 1 1 50 50 ALA C C 13 181.260 0.000 . 1 . . . A 50 ALA C . 25287 1 578 . 1 1 50 50 ALA CA C 13 55.470 0.000 . 1 . . . A 50 ALA CA . 25287 1 579 . 1 1 50 50 ALA CB C 13 18.200 0.000 . 1 . . . A 50 ALA CB . 25287 1 580 . 1 1 50 50 ALA N N 15 119.554 0.000 . 1 . . . A 50 ALA N . 25287 1 581 . 1 1 51 51 ARG H H 1 8.148 0.000 . 1 . . . A 51 ARG H . 25287 1 582 . 1 1 51 51 ARG HA H 1 4.238 0.000 . 1 . . . A 51 ARG HA . 25287 1 583 . 1 1 51 51 ARG HB2 H 1 2.181 0.000 . 2 . . . A 51 ARG HB2 . 25287 1 584 . 1 1 51 51 ARG HB3 H 1 2.036 0.000 . 2 . . . A 51 ARG HB3 . 25287 1 585 . 1 1 51 51 ARG HG2 H 1 1.986 0.000 . 2 . . . A 51 ARG HG2 . 25287 1 586 . 1 1 51 51 ARG HG3 H 1 1.725 0.000 . 2 . . . A 51 ARG HG3 . 25287 1 587 . 1 1 51 51 ARG HD2 H 1 3.413 0.000 . 2 . . . A 51 ARG HD2 . 25287 1 588 . 1 1 51 51 ARG HD3 H 1 3.293 0.000 . 2 . . . A 51 ARG HD3 . 25287 1 589 . 1 1 51 51 ARG HE H 1 7.513 0.000 . 1 . . . A 51 ARG HE . 25287 1 590 . 1 1 51 51 ARG C C 13 179.596 0.000 . 1 . . . A 51 ARG C . 25287 1 591 . 1 1 51 51 ARG CA C 13 59.234 0.000 . 1 . . . A 51 ARG CA . 25287 1 592 . 1 1 51 51 ARG CB C 13 30.561 0.000 . 1 . . . A 51 ARG CB . 25287 1 593 . 1 1 51 51 ARG CG C 13 28.108 0.000 . 1 . . . A 51 ARG CG . 25287 1 594 . 1 1 51 51 ARG CD C 13 43.670 0.000 . 1 . . . A 51 ARG CD . 25287 1 595 . 1 1 51 51 ARG N N 15 119.700 0.000 . 1 . . . A 51 ARG N . 25287 1 596 . 1 1 51 51 ARG NE N 15 85.026 0.000 . 1 . . . A 51 ARG NE . 25287 1 597 . 1 1 52 52 LEU H H 1 8.461 0.000 . 1 . . . A 52 LEU H . 25287 1 598 . 1 1 52 52 LEU HA H 1 4.313 0.000 . 1 . . . A 52 LEU HA . 25287 1 599 . 1 1 52 52 LEU HB2 H 1 2.209 0.000 . 2 . . . A 52 LEU HB2 . 25287 1 600 . 1 1 52 52 LEU HB3 H 1 1.443 0.000 . 2 . . . A 52 LEU HB3 . 25287 1 601 . 1 1 52 52 LEU HG H 1 2.046 0.000 . 1 . . . A 52 LEU HG . 25287 1 602 . 1 1 52 52 LEU HD11 H 1 0.864 0.000 . 2 . . . A 52 LEU HD11 . 25287 1 603 . 1 1 52 52 LEU HD12 H 1 0.864 0.000 . 2 . . . A 52 LEU HD12 . 25287 1 604 . 1 1 52 52 LEU HD13 H 1 0.864 0.000 . 2 . . . A 52 LEU HD13 . 25287 1 605 . 1 1 52 52 LEU HD21 H 1 1.019 0.000 . 2 . . . A 52 LEU HD21 . 25287 1 606 . 1 1 52 52 LEU HD22 H 1 1.019 0.000 . 2 . . . A 52 LEU HD22 . 25287 1 607 . 1 1 52 52 LEU HD23 H 1 1.019 0.000 . 2 . . . A 52 LEU HD23 . 25287 1 608 . 1 1 52 52 LEU C C 13 179.220 0.000 . 1 . . . A 52 LEU C . 25287 1 609 . 1 1 52 52 LEU CA C 13 58.230 0.000 . 1 . . . A 52 LEU CA . 25287 1 610 . 1 1 52 52 LEU CB C 13 42.589 0.000 . 1 . . . A 52 LEU CB . 25287 1 611 . 1 1 52 52 LEU CG C 13 26.523 0.000 . 1 . . . A 52 LEU CG . 25287 1 612 . 1 1 52 52 LEU CD1 C 13 23.651 0.000 . 2 . . . A 52 LEU CD1 . 25287 1 613 . 1 1 52 52 LEU CD2 C 13 26.522 0.000 . 2 . . . A 52 LEU CD2 . 25287 1 614 . 1 1 52 52 LEU N N 15 120.257 0.000 . 1 . . . A 52 LEU N . 25287 1 615 . 1 1 53 53 GLU H H 1 8.879 0.000 . 1 . . . A 53 GLU H . 25287 1 616 . 1 1 53 53 GLU HA H 1 4.114 0.000 . 1 . . . A 53 GLU HA . 25287 1 617 . 1 1 53 53 GLU HB2 H 1 2.472 0.000 . 2 . . . A 53 GLU HB2 . 25287 1 618 . 1 1 53 53 GLU HB3 H 1 2.364 0.000 . 2 . . . A 53 GLU HB3 . 25287 1 619 . 1 1 53 53 GLU HG2 H 1 2.762 0.000 . 2 . . . A 53 GLU HG2 . 25287 1 620 . 1 1 53 53 GLU HG3 H 1 2.356 0.000 . 2 . . . A 53 GLU HG3 . 25287 1 621 . 1 1 53 53 GLU C C 13 179.290 0.000 . 1 . . . A 53 GLU C . 25287 1 622 . 1 1 53 53 GLU CA C 13 60.110 0.000 . 1 . . . A 53 GLU CA . 25287 1 623 . 1 1 53 53 GLU CB C 13 29.130 0.000 . 1 . . . A 53 GLU CB . 25287 1 624 . 1 1 53 53 GLU CG C 13 34.814 0.000 . 1 . . . A 53 GLU CG . 25287 1 625 . 1 1 53 53 GLU N N 15 119.122 0.000 . 1 . . . A 53 GLU N . 25287 1 626 . 1 1 54 54 SER H H 1 8.072 0.000 . 1 . . . A 54 SER H . 25287 1 627 . 1 1 54 54 SER HA H 1 4.382 0.000 . 1 . . . A 54 SER HA . 25287 1 628 . 1 1 54 54 SER HB2 H 1 4.123 0.000 . 2 . . . A 54 SER HB2 . 25287 1 629 . 1 1 54 54 SER HB3 H 1 4.104 0.000 . 2 . . . A 54 SER HB3 . 25287 1 630 . 1 1 54 54 SER C C 13 176.971 0.000 . 1 . . . A 54 SER C . 25287 1 631 . 1 1 54 54 SER CA C 13 61.234 0.000 . 1 . . . A 54 SER CA . 25287 1 632 . 1 1 54 54 SER CB C 13 63.087 0.000 . 1 . . . A 54 SER CB . 25287 1 633 . 1 1 54 54 SER N N 15 112.922 0.000 . 1 . . . A 54 SER N . 25287 1 634 . 1 1 55 55 ARG H H 1 8.170 0.000 . 1 . . . A 55 ARG H . 25287 1 635 . 1 1 55 55 ARG HA H 1 4.093 0.000 . 1 . . . A 55 ARG HA . 25287 1 636 . 1 1 55 55 ARG HB2 H 1 1.880 0.000 . 2 . . . A 55 ARG HB2 . 25287 1 637 . 1 1 55 55 ARG HB3 H 1 1.579 0.000 . 2 . . . A 55 ARG HB3 . 25287 1 638 . 1 1 55 55 ARG HG2 H 1 1.353 0.000 . 2 . . . A 55 ARG HG2 . 25287 1 639 . 1 1 55 55 ARG HG3 H 1 0.982 0.000 . 2 . . . A 55 ARG HG3 . 25287 1 640 . 1 1 55 55 ARG HD2 H 1 3.082 0.000 . 2 . . . A 55 ARG HD2 . 25287 1 641 . 1 1 55 55 ARG HD3 H 1 3.007 0.000 . 2 . . . A 55 ARG HD3 . 25287 1 642 . 1 1 55 55 ARG HE H 1 7.187 0.000 . 1 . . . A 55 ARG HE . 25287 1 643 . 1 1 55 55 ARG C C 13 177.858 0.000 . 1 . . . A 55 ARG C . 25287 1 644 . 1 1 55 55 ARG CA C 13 58.856 0.000 . 1 . . . A 55 ARG CA . 25287 1 645 . 1 1 55 55 ARG CB C 13 30.834 0.000 . 1 . . . A 55 ARG CB . 25287 1 646 . 1 1 55 55 ARG CG C 13 27.020 0.000 . 1 . . . A 55 ARG CG . 25287 1 647 . 1 1 55 55 ARG CD C 13 43.546 0.000 . 1 . . . A 55 ARG CD . 25287 1 648 . 1 1 55 55 ARG N N 15 120.579 0.000 . 1 . . . A 55 ARG N . 25287 1 649 . 1 1 55 55 ARG NE N 15 84.825 0.000 . 1 . . . A 55 ARG NE . 25287 1 650 . 1 1 56 56 TYR H H 1 8.063 0.000 . 1 . . . A 56 TYR H . 25287 1 651 . 1 1 56 56 TYR HA H 1 4.696 0.000 . 1 . . . A 56 TYR HA . 25287 1 652 . 1 1 56 56 TYR HB2 H 1 3.458 0.000 . 2 . . . A 56 TYR HB2 . 25287 1 653 . 1 1 56 56 TYR HB3 H 1 2.802 0.000 . 2 . . . A 56 TYR HB3 . 25287 1 654 . 1 1 56 56 TYR HD1 H 1 7.417 0.000 . 3 . . . A 56 TYR HD1 . 25287 1 655 . 1 1 56 56 TYR HD2 H 1 7.417 0.000 . 3 . . . A 56 TYR HD2 . 25287 1 656 . 1 1 56 56 TYR HE1 H 1 6.811 0.000 . 3 . . . A 56 TYR HE1 . 25287 1 657 . 1 1 56 56 TYR HE2 H 1 6.811 0.000 . 3 . . . A 56 TYR HE2 . 25287 1 658 . 1 1 56 56 TYR C C 13 175.981 0.000 . 1 . . . A 56 TYR C . 25287 1 659 . 1 1 56 56 TYR CA C 13 58.944 0.000 . 1 . . . A 56 TYR CA . 25287 1 660 . 1 1 56 56 TYR CB C 13 39.341 0.000 . 1 . . . A 56 TYR CB . 25287 1 661 . 1 1 56 56 TYR CD1 C 13 132.846 0.000 . 3 . . . A 56 TYR CD1 . 25287 1 662 . 1 1 56 56 TYR CD2 C 13 132.846 0.000 . 3 . . . A 56 TYR CD2 . 25287 1 663 . 1 1 56 56 TYR CE1 C 13 117.934 0.000 . 3 . . . A 56 TYR CE1 . 25287 1 664 . 1 1 56 56 TYR CE2 C 13 117.934 0.000 . 3 . . . A 56 TYR CE2 . 25287 1 665 . 1 1 56 56 TYR N N 15 113.335 0.000 . 1 . . . A 56 TYR N . 25287 1 666 . 1 1 57 57 GLY H H 1 7.946 0.000 . 1 . . . A 57 GLY H . 25287 1 667 . 1 1 57 57 GLY HA2 H 1 4.094 0.000 . 2 . . . A 57 GLY HA2 . 25287 1 668 . 1 1 57 57 GLY HA3 H 1 4.073 0.000 . 2 . . . A 57 GLY HA3 . 25287 1 669 . 1 1 57 57 GLY C C 13 174.616 0.000 . 1 . . . A 57 GLY C . 25287 1 670 . 1 1 57 57 GLY CA C 13 47.315 0.000 . 1 . . . A 57 GLY CA . 25287 1 671 . 1 1 57 57 GLY N N 15 109.507 0.000 . 1 . . . A 57 GLY N . 25287 1 672 . 1 1 58 58 VAL H H 1 7.500 0.000 . 1 . . . A 58 VAL H . 25287 1 673 . 1 1 58 58 VAL HA H 1 4.648 0.000 . 1 . . . A 58 VAL HA . 25287 1 674 . 1 1 58 58 VAL HB H 1 2.120 0.000 . 1 . . . A 58 VAL HB . 25287 1 675 . 1 1 58 58 VAL HG11 H 1 0.942 0.000 . 2 . . . A 58 VAL HG11 . 25287 1 676 . 1 1 58 58 VAL HG12 H 1 0.942 0.000 . 2 . . . A 58 VAL HG12 . 25287 1 677 . 1 1 58 58 VAL HG13 H 1 0.942 0.000 . 2 . . . A 58 VAL HG13 . 25287 1 678 . 1 1 58 58 VAL HG21 H 1 0.961 0.000 . 2 . . . A 58 VAL HG21 . 25287 1 679 . 1 1 58 58 VAL HG22 H 1 0.961 0.000 . 2 . . . A 58 VAL HG22 . 25287 1 680 . 1 1 58 58 VAL HG23 H 1 0.961 0.000 . 2 . . . A 58 VAL HG23 . 25287 1 681 . 1 1 58 58 VAL C C 13 174.098 0.000 . 1 . . . A 58 VAL C . 25287 1 682 . 1 1 58 58 VAL CA C 13 59.427 0.000 . 1 . . . A 58 VAL CA . 25287 1 683 . 1 1 58 58 VAL CB C 13 34.672 0.000 . 1 . . . A 58 VAL CB . 25287 1 684 . 1 1 58 58 VAL CG1 C 13 19.802 0.000 . 2 . . . A 58 VAL CG1 . 25287 1 685 . 1 1 58 58 VAL CG2 C 13 21.777 0.000 . 2 . . . A 58 VAL CG2 . 25287 1 686 . 1 1 58 58 VAL N N 15 112.695 0.000 . 1 . . . A 58 VAL N . 25287 1 687 . 1 1 59 59 SER H H 1 8.480 0.000 . 1 . . . A 59 SER H . 25287 1 688 . 1 1 59 59 SER HA H 1 4.812 0.000 . 1 . . . A 59 SER HA . 25287 1 689 . 1 1 59 59 SER HB2 H 1 3.793 0.000 . 2 . . . A 59 SER HB2 . 25287 1 690 . 1 1 59 59 SER HB3 H 1 3.764 0.000 . 2 . . . A 59 SER HB3 . 25287 1 691 . 1 1 59 59 SER C C 13 173.610 0.000 . 1 . . . A 59 SER C . 25287 1 692 . 1 1 59 59 SER CA C 13 56.928 0.000 . 1 . . . A 59 SER CA . 25287 1 693 . 1 1 59 59 SER CB C 13 64.255 0.000 . 1 . . . A 59 SER CB . 25287 1 694 . 1 1 59 59 SER N N 15 117.143 0.000 . 1 . . . A 59 SER N . 25287 1 695 . 1 1 60 60 ILE H H 1 8.243 0.000 . 1 . . . A 60 ILE H . 25287 1 696 . 1 1 60 60 ILE HA H 1 4.594 0.000 . 1 . . . A 60 ILE HA . 25287 1 697 . 1 1 60 60 ILE HB H 1 1.826 0.000 . 1 . . . A 60 ILE HB . 25287 1 698 . 1 1 60 60 ILE HG12 H 1 1.500 0.000 . 2 . . . A 60 ILE HG12 . 25287 1 699 . 1 1 60 60 ILE HG13 H 1 1.122 0.000 . 2 . . . A 60 ILE HG13 . 25287 1 700 . 1 1 60 60 ILE HG21 H 1 0.989 0.000 . 1 . . . A 60 ILE HG21 . 25287 1 701 . 1 1 60 60 ILE HG22 H 1 0.989 0.000 . 1 . . . A 60 ILE HG22 . 25287 1 702 . 1 1 60 60 ILE HG23 H 1 0.989 0.000 . 1 . . . A 60 ILE HG23 . 25287 1 703 . 1 1 60 60 ILE HD11 H 1 0.861 0.000 . 1 . . . A 60 ILE HD11 . 25287 1 704 . 1 1 60 60 ILE HD12 H 1 0.861 0.000 . 1 . . . A 60 ILE HD12 . 25287 1 705 . 1 1 60 60 ILE HD13 H 1 0.861 0.000 . 1 . . . A 60 ILE HD13 . 25287 1 706 . 1 1 60 60 ILE CA C 13 57.845 0.000 . 1 . . . A 60 ILE CA . 25287 1 707 . 1 1 60 60 ILE CB C 13 39.892 0.000 . 1 . . . A 60 ILE CB . 25287 1 708 . 1 1 60 60 ILE CG1 C 13 27.351 0.000 . 1 . . . A 60 ILE CG1 . 25287 1 709 . 1 1 60 60 ILE CG2 C 13 17.459 0.000 . 1 . . . A 60 ILE CG2 . 25287 1 710 . 1 1 60 60 ILE CD1 C 13 14.040 0.000 . 1 . . . A 60 ILE CD1 . 25287 1 711 . 1 1 60 60 ILE N N 15 125.672 0.000 . 1 . . . A 60 ILE N . 25287 1 712 . 1 1 61 61 PRO HA H 1 4.542 0.000 . 1 . . . A 61 PRO HA . 25287 1 713 . 1 1 61 61 PRO HB2 H 1 2.517 0.000 . 2 . . . A 61 PRO HB2 . 25287 1 714 . 1 1 61 61 PRO HB3 H 1 2.075 0.000 . 2 . . . A 61 PRO HB3 . 25287 1 715 . 1 1 61 61 PRO HG2 H 1 2.116 0.000 . 2 . . . A 61 PRO HG2 . 25287 1 716 . 1 1 61 61 PRO HG3 H 1 2.092 0.000 . 2 . . . A 61 PRO HG3 . 25287 1 717 . 1 1 61 61 PRO HD2 H 1 4.014 0.000 . 2 . . . A 61 PRO HD2 . 25287 1 718 . 1 1 61 61 PRO HD3 H 1 3.565 0.000 . 2 . . . A 61 PRO HD3 . 25287 1 719 . 1 1 61 61 PRO C C 13 177.212 0.000 . 1 . . . A 61 PRO C . 25287 1 720 . 1 1 61 61 PRO CA C 13 63.301 0.000 . 1 . . . A 61 PRO CA . 25287 1 721 . 1 1 61 61 PRO CB C 13 32.700 0.000 . 1 . . . A 61 PRO CB . 25287 1 722 . 1 1 61 61 PRO CG C 13 27.963 0.000 . 1 . . . A 61 PRO CG . 25287 1 723 . 1 1 61 61 PRO CD C 13 51.285 0.000 . 1 . . . A 61 PRO CD . 25287 1 724 . 1 1 62 62 ASP H H 1 8.739 0.000 . 1 . . . A 62 ASP H . 25287 1 725 . 1 1 62 62 ASP HA H 1 4.447 0.000 . 1 . . . A 62 ASP HA . 25287 1 726 . 1 1 62 62 ASP HB2 H 1 2.769 0.000 . 2 . . . A 62 ASP HB2 . 25287 1 727 . 1 1 62 62 ASP HB3 H 1 2.768 0.000 . 2 . . . A 62 ASP HB3 . 25287 1 728 . 1 1 62 62 ASP C C 13 177.266 0.000 . 1 . . . A 62 ASP C . 25287 1 729 . 1 1 62 62 ASP CA C 13 56.794 0.000 . 1 . . . A 62 ASP CA . 25287 1 730 . 1 1 62 62 ASP CB C 13 40.598 0.000 . 1 . . . A 62 ASP CB . 25287 1 731 . 1 1 62 62 ASP N N 15 122.080 0.000 . 1 . . . A 62 ASP N . 25287 1 732 . 1 1 63 63 ASP H H 1 8.542 0.000 . 1 . . . A 63 ASP H . 25287 1 733 . 1 1 63 63 ASP HA H 1 4.536 0.000 . 1 . . . A 63 ASP HA . 25287 1 734 . 1 1 63 63 ASP HB2 H 1 2.829 0.000 . 2 . . . A 63 ASP HB2 . 25287 1 735 . 1 1 63 63 ASP HB3 H 1 2.753 0.000 . 2 . . . A 63 ASP HB3 . 25287 1 736 . 1 1 63 63 ASP C C 13 177.138 0.000 . 1 . . . A 63 ASP C . 25287 1 737 . 1 1 63 63 ASP CA C 13 54.719 0.000 . 1 . . . A 63 ASP CA . 25287 1 738 . 1 1 63 63 ASP CB C 13 39.679 0.000 . 1 . . . A 63 ASP CB . 25287 1 739 . 1 1 63 63 ASP N N 15 116.637 0.000 . 1 . . . A 63 ASP N . 25287 1 740 . 1 1 64 64 VAL H H 1 7.442 0.000 . 1 . . . A 64 VAL H . 25287 1 741 . 1 1 64 64 VAL HA H 1 3.885 0.000 . 1 . . . A 64 VAL HA . 25287 1 742 . 1 1 64 64 VAL HB H 1 2.195 0.000 . 1 . . . A 64 VAL HB . 25287 1 743 . 1 1 64 64 VAL HG11 H 1 0.970 0.000 . 2 . . . A 64 VAL HG11 . 25287 1 744 . 1 1 64 64 VAL HG12 H 1 0.970 0.000 . 2 . . . A 64 VAL HG12 . 25287 1 745 . 1 1 64 64 VAL HG13 H 1 0.970 0.000 . 2 . . . A 64 VAL HG13 . 25287 1 746 . 1 1 64 64 VAL HG21 H 1 1.012 0.000 . 2 . . . A 64 VAL HG21 . 25287 1 747 . 1 1 64 64 VAL HG22 H 1 1.012 0.000 . 2 . . . A 64 VAL HG22 . 25287 1 748 . 1 1 64 64 VAL HG23 H 1 1.012 0.000 . 2 . . . A 64 VAL HG23 . 25287 1 749 . 1 1 64 64 VAL C C 13 177.138 0.000 . 1 . . . A 64 VAL C . 25287 1 750 . 1 1 64 64 VAL CA C 13 64.438 0.000 . 1 . . . A 64 VAL CA . 25287 1 751 . 1 1 64 64 VAL CB C 13 32.334 0.000 . 1 . . . A 64 VAL CB . 25287 1 752 . 1 1 64 64 VAL CG1 C 13 21.150 0.000 . 2 . . . A 64 VAL CG1 . 25287 1 753 . 1 1 64 64 VAL CG2 C 13 21.373 0.000 . 2 . . . A 64 VAL CG2 . 25287 1 754 . 1 1 64 64 VAL N N 15 118.521 0.000 . 1 . . . A 64 VAL N . 25287 1 755 . 1 1 65 65 ALA H H 1 8.178 0.000 . 1 . . . A 65 ALA H . 25287 1 756 . 1 1 65 65 ALA HA H 1 4.019 0.000 . 1 . . . A 65 ALA HA . 25287 1 757 . 1 1 65 65 ALA HB1 H 1 1.337 0.000 . 1 . . . A 65 ALA HB1 . 25287 1 758 . 1 1 65 65 ALA HB2 H 1 1.337 0.000 . 1 . . . A 65 ALA HB2 . 25287 1 759 . 1 1 65 65 ALA HB3 H 1 1.337 0.000 . 1 . . . A 65 ALA HB3 . 25287 1 760 . 1 1 65 65 ALA C C 13 178.120 0.000 . 1 . . . A 65 ALA C . 25287 1 761 . 1 1 65 65 ALA CA C 13 54.601 0.000 . 1 . . . A 65 ALA CA . 25287 1 762 . 1 1 65 65 ALA CB C 13 18.562 0.000 . 1 . . . A 65 ALA CB . 25287 1 763 . 1 1 65 65 ALA N N 15 122.937 0.000 . 1 . . . A 65 ALA N . 25287 1 764 . 1 1 66 66 GLY H H 1 8.044 0.000 . 1 . . . A 66 GLY H . 25287 1 765 . 1 1 66 66 GLY HA2 H 1 4.005 0.000 . 2 . . . A 66 GLY HA2 . 25287 1 766 . 1 1 66 66 GLY HA3 H 1 3.912 0.000 . 2 . . . A 66 GLY HA3 . 25287 1 767 . 1 1 66 66 GLY C C 13 174.236 0.000 . 1 . . . A 66 GLY C . 25287 1 768 . 1 1 66 66 GLY CA C 13 45.774 0.000 . 1 . . . A 66 GLY CA . 25287 1 769 . 1 1 66 66 GLY N N 15 102.206 0.000 . 1 . . . A 66 GLY N . 25287 1 770 . 1 1 67 67 ARG H H 1 7.648 0.000 . 1 . . . A 67 ARG H . 25287 1 771 . 1 1 67 67 ARG HA H 1 4.598 0.000 . 1 . . . A 67 ARG HA . 25287 1 772 . 1 1 67 67 ARG HB2 H 1 2.057 0.000 . 2 . . . A 67 ARG HB2 . 25287 1 773 . 1 1 67 67 ARG HB3 H 1 1.862 0.000 . 2 . . . A 67 ARG HB3 . 25287 1 774 . 1 1 67 67 ARG HG2 H 1 1.732 0.000 . 1 . . . A 67 ARG HG2 . 25287 1 775 . 1 1 67 67 ARG HG3 H 1 1.732 0.000 . 1 . . . A 67 ARG HG3 . 25287 1 776 . 1 1 67 67 ARG HD2 H 1 3.265 0.000 . 2 . . . A 67 ARG HD2 . 25287 1 777 . 1 1 67 67 ARG HD3 H 1 3.263 0.000 . 2 . . . A 67 ARG HD3 . 25287 1 778 . 1 1 67 67 ARG HE H 1 7.395 0.000 . 1 . . . A 67 ARG HE . 25287 1 779 . 1 1 67 67 ARG C C 13 176.280 0.000 . 1 . . . A 67 ARG C . 25287 1 780 . 1 1 67 67 ARG CA C 13 55.833 0.000 . 1 . . . A 67 ARG CA . 25287 1 781 . 1 1 67 67 ARG CB C 13 31.786 0.000 . 1 . . . A 67 ARG CB . 25287 1 782 . 1 1 67 67 ARG CG C 13 27.451 0.000 . 1 . . . A 67 ARG CG . 25287 1 783 . 1 1 67 67 ARG CD C 13 43.767 0.000 . 1 . . . A 67 ARG CD . 25287 1 784 . 1 1 67 67 ARG N N 15 117.369 0.000 . 1 . . . A 67 ARG N . 25287 1 785 . 1 1 67 67 ARG NE N 15 85.045 0.000 . 1 . . . A 67 ARG NE . 25287 1 786 . 1 1 68 68 VAL H H 1 7.545 0.000 . 1 . . . A 68 VAL H . 25287 1 787 . 1 1 68 68 VAL HA H 1 4.430 0.000 . 1 . . . A 68 VAL HA . 25287 1 788 . 1 1 68 68 VAL HB H 1 2.382 0.000 . 1 . . . A 68 VAL HB . 25287 1 789 . 1 1 68 68 VAL HG11 H 1 1.130 0.000 . 2 . . . A 68 VAL HG11 . 25287 1 790 . 1 1 68 68 VAL HG12 H 1 1.130 0.000 . 2 . . . A 68 VAL HG12 . 25287 1 791 . 1 1 68 68 VAL HG13 H 1 1.130 0.000 . 2 . . . A 68 VAL HG13 . 25287 1 792 . 1 1 68 68 VAL HG21 H 1 1.143 0.000 . 2 . . . A 68 VAL HG21 . 25287 1 793 . 1 1 68 68 VAL HG22 H 1 1.143 0.000 . 2 . . . A 68 VAL HG22 . 25287 1 794 . 1 1 68 68 VAL HG23 H 1 1.143 0.000 . 2 . . . A 68 VAL HG23 . 25287 1 795 . 1 1 68 68 VAL C C 13 175.025 0.000 . 1 . . . A 68 VAL C . 25287 1 796 . 1 1 68 68 VAL CA C 13 61.764 0.000 . 1 . . . A 68 VAL CA . 25287 1 797 . 1 1 68 68 VAL CB C 13 33.350 0.000 . 1 . . . A 68 VAL CB . 25287 1 798 . 1 1 68 68 VAL CG1 C 13 23.263 0.000 . 2 . . . A 68 VAL CG1 . 25287 1 799 . 1 1 68 68 VAL CG2 C 13 20.405 0.000 . 2 . . . A 68 VAL CG2 . 25287 1 800 . 1 1 68 68 VAL N N 15 116.597 0.000 . 1 . . . A 68 VAL N . 25287 1 801 . 1 1 69 69 ASP H H 1 9.059 0.000 . 1 . . . A 69 ASP H . 25287 1 802 . 1 1 69 69 ASP HA H 1 5.290 0.000 . 1 . . . A 69 ASP HA . 25287 1 803 . 1 1 69 69 ASP HB2 H 1 2.974 0.000 . 2 . . . A 69 ASP HB2 . 25287 1 804 . 1 1 69 69 ASP HB3 H 1 2.860 0.000 . 2 . . . A 69 ASP HB3 . 25287 1 805 . 1 1 69 69 ASP C C 13 176.162 0.000 . 1 . . . A 69 ASP C . 25287 1 806 . 1 1 69 69 ASP CA C 13 55.378 0.000 . 1 . . . A 69 ASP CA . 25287 1 807 . 1 1 69 69 ASP CB C 13 43.861 0.000 . 1 . . . A 69 ASP CB . 25287 1 808 . 1 1 69 69 ASP N N 15 120.888 0.000 . 1 . . . A 69 ASP N . 25287 1 809 . 1 1 70 70 THR H H 1 7.454 0.000 . 1 . . . A 70 THR H . 25287 1 810 . 1 1 70 70 THR HA H 1 4.946 0.000 . 1 . . . A 70 THR HA . 25287 1 811 . 1 1 70 70 THR HB H 1 4.593 0.000 . 1 . . . A 70 THR HB . 25287 1 812 . 1 1 70 70 THR HG21 H 1 1.037 0.000 . 1 . . . A 70 THR HG21 . 25287 1 813 . 1 1 70 70 THR HG22 H 1 1.037 0.000 . 1 . . . A 70 THR HG22 . 25287 1 814 . 1 1 70 70 THR HG23 H 1 1.037 0.000 . 1 . . . A 70 THR HG23 . 25287 1 815 . 1 1 70 70 THR CA C 13 57.688 0.000 . 1 . . . A 70 THR CA . 25287 1 816 . 1 1 70 70 THR CB C 13 71.200 0.000 . 1 . . . A 70 THR CB . 25287 1 817 . 1 1 70 70 THR CG2 C 13 21.637 0.000 . 1 . . . A 70 THR CG2 . 25287 1 818 . 1 1 70 70 THR N N 15 108.220 0.000 . 1 . . . A 70 THR N . 25287 1 819 . 1 1 71 71 PRO HA H 1 4.223 0.000 . 1 . . . A 71 PRO HA . 25287 1 820 . 1 1 71 71 PRO HB2 H 1 2.238 0.000 . 2 . . . A 71 PRO HB2 . 25287 1 821 . 1 1 71 71 PRO HB3 H 1 2.026 0.000 . 2 . . . A 71 PRO HB3 . 25287 1 822 . 1 1 71 71 PRO HG2 H 1 2.221 0.000 . 2 . . . A 71 PRO HG2 . 25287 1 823 . 1 1 71 71 PRO HG3 H 1 1.387 0.000 . 2 . . . A 71 PRO HG3 . 25287 1 824 . 1 1 71 71 PRO HD2 H 1 4.033 0.000 . 2 . . . A 71 PRO HD2 . 25287 1 825 . 1 1 71 71 PRO HD3 H 1 2.919 0.000 . 2 . . . A 71 PRO HD3 . 25287 1 826 . 1 1 71 71 PRO C C 13 177.322 0.000 . 1 . . . A 71 PRO C . 25287 1 827 . 1 1 71 71 PRO CA C 13 65.754 0.000 . 1 . . . A 71 PRO CA . 25287 1 828 . 1 1 71 71 PRO CB C 13 32.774 0.000 . 1 . . . A 71 PRO CB . 25287 1 829 . 1 1 71 71 PRO CG C 13 27.104 0.000 . 1 . . . A 71 PRO CG . 25287 1 830 . 1 1 71 71 PRO CD C 13 51.944 0.000 . 1 . . . A 71 PRO CD . 25287 1 831 . 1 1 72 72 ARG H H 1 9.024 0.000 . 1 . . . A 72 ARG H . 25287 1 832 . 1 1 72 72 ARG HA H 1 3.609 0.000 . 1 . . . A 72 ARG HA . 25287 1 833 . 1 1 72 72 ARG HB2 H 1 1.870 0.000 . 2 . . . A 72 ARG HB2 . 25287 1 834 . 1 1 72 72 ARG HB3 H 1 1.540 0.000 . 2 . . . A 72 ARG HB3 . 25287 1 835 . 1 1 72 72 ARG HG2 H 1 1.540 0.000 . 2 . . . A 72 ARG HG2 . 25287 1 836 . 1 1 72 72 ARG HG3 H 1 1.663 0.000 . 2 . . . A 72 ARG HG3 . 25287 1 837 . 1 1 72 72 ARG HD2 H 1 3.495 0.000 . 2 . . . A 72 ARG HD2 . 25287 1 838 . 1 1 72 72 ARG HD3 H 1 3.023 0.000 . 2 . . . A 72 ARG HD3 . 25287 1 839 . 1 1 72 72 ARG HE H 1 9.066 0.000 . 1 . . . A 72 ARG HE . 25287 1 840 . 1 1 72 72 ARG C C 13 177.718 0.000 . 1 . . . A 72 ARG C . 25287 1 841 . 1 1 72 72 ARG CA C 13 60.156 0.000 . 1 . . . A 72 ARG CA . 25287 1 842 . 1 1 72 72 ARG CB C 13 30.532 0.000 . 1 . . . A 72 ARG CB . 25287 1 843 . 1 1 72 72 ARG CG C 13 27.553 0.000 . 1 . . . A 72 ARG CG . 25287 1 844 . 1 1 72 72 ARG CD C 13 42.944 0.000 . 1 . . . A 72 ARG CD . 25287 1 845 . 1 1 72 72 ARG N N 15 117.563 0.000 . 1 . . . A 72 ARG N . 25287 1 846 . 1 1 72 72 ARG NE N 15 83.521 0.000 . 1 . . . A 72 ARG NE . 25287 1 847 . 1 1 73 73 GLU H H 1 7.831 0.000 . 1 . . . A 73 GLU H . 25287 1 848 . 1 1 73 73 GLU HA H 1 4.237 0.000 . 1 . . . A 73 GLU HA . 25287 1 849 . 1 1 73 73 GLU HB2 H 1 2.458 0.000 . 2 . . . A 73 GLU HB2 . 25287 1 850 . 1 1 73 73 GLU HB3 H 1 2.278 0.000 . 2 . . . A 73 GLU HB3 . 25287 1 851 . 1 1 73 73 GLU HG2 H 1 2.623 0.000 . 2 . . . A 73 GLU HG2 . 25287 1 852 . 1 1 73 73 GLU HG3 H 1 2.577 0.000 . 2 . . . A 73 GLU HG3 . 25287 1 853 . 1 1 73 73 GLU C C 13 179.996 0.000 . 1 . . . A 73 GLU C . 25287 1 854 . 1 1 73 73 GLU CA C 13 58.893 0.000 . 1 . . . A 73 GLU CA . 25287 1 855 . 1 1 73 73 GLU CB C 13 29.721 0.000 . 1 . . . A 73 GLU CB . 25287 1 856 . 1 1 73 73 GLU CG C 13 36.101 0.000 . 1 . . . A 73 GLU CG . 25287 1 857 . 1 1 73 73 GLU N N 15 116.378 0.000 . 1 . . . A 73 GLU N . 25287 1 858 . 1 1 74 74 LEU H H 1 7.764 0.000 . 1 . . . A 74 LEU H . 25287 1 859 . 1 1 74 74 LEU HA H 1 4.272 0.000 . 1 . . . A 74 LEU HA . 25287 1 860 . 1 1 74 74 LEU HB2 H 1 2.405 0.000 . 2 . . . A 74 LEU HB2 . 25287 1 861 . 1 1 74 74 LEU HB3 H 1 1.658 0.000 . 2 . . . A 74 LEU HB3 . 25287 1 862 . 1 1 74 74 LEU HG H 1 0.940 0.000 . 1 . . . A 74 LEU HG . 25287 1 863 . 1 1 74 74 LEU HD11 H 1 1.012 0.000 . 1 . . . A 74 LEU HD11 . 25287 1 864 . 1 1 74 74 LEU HD12 H 1 1.012 0.000 . 1 . . . A 74 LEU HD12 . 25287 1 865 . 1 1 74 74 LEU HD13 H 1 1.012 0.000 . 1 . . . A 74 LEU HD13 . 25287 1 866 . 1 1 74 74 LEU HD21 H 1 1.012 0.000 . 1 . . . A 74 LEU HD21 . 25287 1 867 . 1 1 74 74 LEU HD22 H 1 1.012 0.000 . 1 . . . A 74 LEU HD22 . 25287 1 868 . 1 1 74 74 LEU HD23 H 1 1.012 0.000 . 1 . . . A 74 LEU HD23 . 25287 1 869 . 1 1 74 74 LEU C C 13 177.033 0.000 . 1 . . . A 74 LEU C . 25287 1 870 . 1 1 74 74 LEU CA C 13 58.208 0.000 . 1 . . . A 74 LEU CA . 25287 1 871 . 1 1 74 74 LEU CB C 13 42.252 0.000 . 1 . . . A 74 LEU CB . 25287 1 872 . 1 1 74 74 LEU CG C 13 26.141 0.000 . 1 . . . A 74 LEU CG . 25287 1 873 . 1 1 74 74 LEU CD1 C 13 22.681 0.000 . 2 . . . A 74 LEU CD1 . 25287 1 874 . 1 1 74 74 LEU CD2 C 13 22.705 0.000 . 2 . . . A 74 LEU CD2 . 25287 1 875 . 1 1 74 74 LEU N N 15 120.607 0.000 . 1 . . . A 74 LEU N . 25287 1 876 . 1 1 75 75 LEU H H 1 8.725 0.000 . 1 . . . A 75 LEU H . 25287 1 877 . 1 1 75 75 LEU HA H 1 3.882 0.000 . 1 . . . A 75 LEU HA . 25287 1 878 . 1 1 75 75 LEU HB2 H 1 2.156 0.000 . 2 . . . A 75 LEU HB2 . 25287 1 879 . 1 1 75 75 LEU HB3 H 1 1.569 0.000 . 2 . . . A 75 LEU HB3 . 25287 1 880 . 1 1 75 75 LEU HG H 1 1.688 0.000 . 1 . . . A 75 LEU HG . 25287 1 881 . 1 1 75 75 LEU HD11 H 1 0.798 0.000 . 2 . . . A 75 LEU HD11 . 25287 1 882 . 1 1 75 75 LEU HD12 H 1 0.798 0.000 . 2 . . . A 75 LEU HD12 . 25287 1 883 . 1 1 75 75 LEU HD13 H 1 0.798 0.000 . 2 . . . A 75 LEU HD13 . 25287 1 884 . 1 1 75 75 LEU HD21 H 1 0.859 0.000 . 2 . . . A 75 LEU HD21 . 25287 1 885 . 1 1 75 75 LEU HD22 H 1 0.859 0.000 . 2 . . . A 75 LEU HD22 . 25287 1 886 . 1 1 75 75 LEU HD23 H 1 0.859 0.000 . 2 . . . A 75 LEU HD23 . 25287 1 887 . 1 1 75 75 LEU C C 13 178.091 0.000 . 1 . . . A 75 LEU C . 25287 1 888 . 1 1 75 75 LEU CA C 13 58.433 0.000 . 1 . . . A 75 LEU CA . 25287 1 889 . 1 1 75 75 LEU CB C 13 42.313 0.000 . 1 . . . A 75 LEU CB . 25287 1 890 . 1 1 75 75 LEU CG C 13 26.511 0.000 . 1 . . . A 75 LEU CG . 25287 1 891 . 1 1 75 75 LEU CD1 C 13 24.981 0.000 . 2 . . . A 75 LEU CD1 . 25287 1 892 . 1 1 75 75 LEU CD2 C 13 26.385 0.000 . 2 . . . A 75 LEU CD2 . 25287 1 893 . 1 1 75 75 LEU N N 15 120.986 0.000 . 1 . . . A 75 LEU N . 25287 1 894 . 1 1 76 76 ASP H H 1 8.664 0.000 . 1 . . . A 76 ASP H . 25287 1 895 . 1 1 76 76 ASP HA H 1 4.473 0.000 . 1 . . . A 76 ASP HA . 25287 1 896 . 1 1 76 76 ASP HB2 H 1 2.790 0.000 . 2 . . . A 76 ASP HB2 . 25287 1 897 . 1 1 76 76 ASP HB3 H 1 2.749 0.000 . 2 . . . A 76 ASP HB3 . 25287 1 898 . 1 1 76 76 ASP C C 13 179.996 0.000 . 1 . . . A 76 ASP C . 25287 1 899 . 1 1 76 76 ASP CA C 13 57.337 0.000 . 1 . . . A 76 ASP CA . 25287 1 900 . 1 1 76 76 ASP CB C 13 39.834 0.000 . 1 . . . A 76 ASP CB . 25287 1 901 . 1 1 76 76 ASP N N 15 117.485 0.000 . 1 . . . A 76 ASP N . 25287 1 902 . 1 1 77 77 LEU H H 1 7.977 0.000 . 1 . . . A 77 LEU H . 25287 1 903 . 1 1 77 77 LEU HA H 1 4.275 0.000 . 1 . . . A 77 LEU HA . 25287 1 904 . 1 1 77 77 LEU HB2 H 1 1.998 0.000 . 2 . . . A 77 LEU HB2 . 25287 1 905 . 1 1 77 77 LEU HB3 H 1 1.918 0.000 . 2 . . . A 77 LEU HB3 . 25287 1 906 . 1 1 77 77 LEU HG H 1 1.823 0.000 . 1 . . . A 77 LEU HG . 25287 1 907 . 1 1 77 77 LEU HD11 H 1 0.966 0.000 . 2 . . . A 77 LEU HD11 . 25287 1 908 . 1 1 77 77 LEU HD12 H 1 0.966 0.000 . 2 . . . A 77 LEU HD12 . 25287 1 909 . 1 1 77 77 LEU HD13 H 1 0.966 0.000 . 2 . . . A 77 LEU HD13 . 25287 1 910 . 1 1 77 77 LEU HD21 H 1 0.967 0.000 . 2 . . . A 77 LEU HD21 . 25287 1 911 . 1 1 77 77 LEU HD22 H 1 0.967 0.000 . 2 . . . A 77 LEU HD22 . 25287 1 912 . 1 1 77 77 LEU HD23 H 1 0.967 0.000 . 2 . . . A 77 LEU HD23 . 25287 1 913 . 1 1 77 77 LEU C C 13 179.837 0.000 . 1 . . . A 77 LEU C . 25287 1 914 . 1 1 77 77 LEU CA C 13 58.235 0.000 . 1 . . . A 77 LEU CA . 25287 1 915 . 1 1 77 77 LEU CB C 13 42.736 0.000 . 1 . . . A 77 LEU CB . 25287 1 916 . 1 1 77 77 LEU CG C 13 27.195 0.000 . 1 . . . A 77 LEU CG . 25287 1 917 . 1 1 77 77 LEU CD1 C 13 25.276 0.000 . 2 . . . A 77 LEU CD1 . 25287 1 918 . 1 1 77 77 LEU CD2 C 13 25.391 0.000 . 2 . . . A 77 LEU CD2 . 25287 1 919 . 1 1 77 77 LEU N N 15 122.846 0.000 . 1 . . . A 77 LEU N . 25287 1 920 . 1 1 78 78 ILE H H 1 8.303 0.000 . 1 . . . A 78 ILE H . 25287 1 921 . 1 1 78 78 ILE HA H 1 3.740 0.000 . 1 . . . A 78 ILE HA . 25287 1 922 . 1 1 78 78 ILE HB H 1 1.930 0.000 . 1 . . . A 78 ILE HB . 25287 1 923 . 1 1 78 78 ILE HG12 H 1 1.726 0.000 . 2 . . . A 78 ILE HG12 . 25287 1 924 . 1 1 78 78 ILE HG13 H 1 1.268 0.000 . 2 . . . A 78 ILE HG13 . 25287 1 925 . 1 1 78 78 ILE HG21 H 1 0.868 0.000 . 1 . . . A 78 ILE HG21 . 25287 1 926 . 1 1 78 78 ILE HG22 H 1 0.868 0.000 . 1 . . . A 78 ILE HG22 . 25287 1 927 . 1 1 78 78 ILE HG23 H 1 0.868 0.000 . 1 . . . A 78 ILE HG23 . 25287 1 928 . 1 1 78 78 ILE HD11 H 1 0.790 0.000 . 1 . . . A 78 ILE HD11 . 25287 1 929 . 1 1 78 78 ILE HD12 H 1 0.790 0.000 . 1 . . . A 78 ILE HD12 . 25287 1 930 . 1 1 78 78 ILE HD13 H 1 0.790 0.000 . 1 . . . A 78 ILE HD13 . 25287 1 931 . 1 1 78 78 ILE C C 13 177.681 0.000 . 1 . . . A 78 ILE C . 25287 1 932 . 1 1 78 78 ILE CA C 13 64.715 0.000 . 1 . . . A 78 ILE CA . 25287 1 933 . 1 1 78 78 ILE CB C 13 37.440 0.000 . 1 . . . A 78 ILE CB . 25287 1 934 . 1 1 78 78 ILE CG1 C 13 29.008 0.000 . 1 . . . A 78 ILE CG1 . 25287 1 935 . 1 1 78 78 ILE CG2 C 13 17.442 0.000 . 1 . . . A 78 ILE CG2 . 25287 1 936 . 1 1 78 78 ILE CD1 C 13 13.114 0.000 . 1 . . . A 78 ILE CD1 . 25287 1 937 . 1 1 78 78 ILE N N 15 119.793 0.000 . 1 . . . A 78 ILE N . 25287 1 938 . 1 1 79 79 ASN H H 1 8.873 0.000 . 1 . . . A 79 ASN H . 25287 1 939 . 1 1 79 79 ASN HA H 1 4.900 0.000 . 1 . . . A 79 ASN HA . 25287 1 940 . 1 1 79 79 ASN HB2 H 1 3.081 0.000 . 2 . . . A 79 ASN HB2 . 25287 1 941 . 1 1 79 79 ASN HB3 H 1 2.767 0.000 . 2 . . . A 79 ASN HB3 . 25287 1 942 . 1 1 79 79 ASN HD21 H 1 7.384 0.000 . 1 . . . A 79 ASN HD21 . 25287 1 943 . 1 1 79 79 ASN HD22 H 1 7.660 0.000 . 1 . . . A 79 ASN HD22 . 25287 1 944 . 1 1 79 79 ASN C C 13 179.380 0.000 . 1 . . . A 79 ASN C . 25287 1 945 . 1 1 79 79 ASN CA C 13 55.417 0.000 . 1 . . . A 79 ASN CA . 25287 1 946 . 1 1 79 79 ASN CB C 13 37.201 0.000 . 1 . . . A 79 ASN CB . 25287 1 947 . 1 1 79 79 ASN N N 15 117.81 0.000 . 1 . . . A 79 ASN N . 25287 1 948 . 1 1 79 79 ASN ND2 N 15 107.820 0.000 . 1 . . . A 79 ASN ND2 . 25287 1 949 . 1 1 80 80 GLY H H 1 8.383 0.000 . 1 . . . A 80 GLY H . 25287 1 950 . 1 1 80 80 GLY HA2 H 1 4.022 0.000 . 1 . . . A 80 GLY HA2 . 25287 1 951 . 1 1 80 80 GLY HA3 H 1 4.022 0.000 . 1 . . . A 80 GLY HA3 . 25287 1 952 . 1 1 80 80 GLY C C 13 175.704 0.000 . 1 . . . A 80 GLY C . 25287 1 953 . 1 1 80 80 GLY CA C 13 47.052 0.000 . 1 . . . A 80 GLY CA . 25287 1 954 . 1 1 80 80 GLY N N 15 109.976 0.000 . 1 . . . A 80 GLY N . 25287 1 955 . 1 1 81 81 ALA H H 1 7.620 0.000 . 1 . . . A 81 ALA H . 25287 1 956 . 1 1 81 81 ALA HA H 1 4.452 0.000 . 1 . . . A 81 ALA HA . 25287 1 957 . 1 1 81 81 ALA HB1 H 1 1.629 0.000 . 1 . . . A 81 ALA HB1 . 25287 1 958 . 1 1 81 81 ALA HB2 H 1 1.629 0.000 . 1 . . . A 81 ALA HB2 . 25287 1 959 . 1 1 81 81 ALA HB3 H 1 1.629 0.000 . 1 . . . A 81 ALA HB3 . 25287 1 960 . 1 1 81 81 ALA C C 13 180.467 0.000 . 1 . . . A 81 ALA C . 25287 1 961 . 1 1 81 81 ALA CA C 13 54.255 0.000 . 1 . . . A 81 ALA CA . 25287 1 962 . 1 1 81 81 ALA CB C 13 18.615 0.000 . 1 . . . A 81 ALA CB . 25287 1 963 . 1 1 81 81 ALA N N 15 124.020 0.000 . 1 . . . A 81 ALA N . 25287 1 964 . 1 1 82 82 LEU H H 1 8.273 0.000 . 1 . . . A 82 LEU H . 25287 1 965 . 1 1 82 82 LEU HA H 1 4.223 0.000 . 1 . . . A 82 LEU HA . 25287 1 966 . 1 1 82 82 LEU HB2 H 1 2.001 0.000 . 2 . . . A 82 LEU HB2 . 25287 1 967 . 1 1 82 82 LEU HB3 H 1 1.559 0.000 . 2 . . . A 82 LEU HB3 . 25287 1 968 . 1 1 82 82 LEU HG H 1 1.852 0.000 . 1 . . . A 82 LEU HG . 25287 1 969 . 1 1 82 82 LEU HD11 H 1 0.971 0.000 . 2 . . . A 82 LEU HD11 . 25287 1 970 . 1 1 82 82 LEU HD12 H 1 0.971 0.000 . 2 . . . A 82 LEU HD12 . 25287 1 971 . 1 1 82 82 LEU HD13 H 1 0.971 0.000 . 2 . . . A 82 LEU HD13 . 25287 1 972 . 1 1 82 82 LEU HD21 H 1 0.983 0.000 . 2 . . . A 82 LEU HD21 . 25287 1 973 . 1 1 82 82 LEU HD22 H 1 0.983 0.000 . 2 . . . A 82 LEU HD22 . 25287 1 974 . 1 1 82 82 LEU HD23 H 1 0.983 0.000 . 2 . . . A 82 LEU HD23 . 25287 1 975 . 1 1 82 82 LEU C C 13 178.768 0.000 . 1 . . . A 82 LEU C . 25287 1 976 . 1 1 82 82 LEU CA C 13 56.948 0.000 . 1 . . . A 82 LEU CA . 25287 1 977 . 1 1 82 82 LEU CB C 13 42.595 0.000 . 1 . . . A 82 LEU CB . 25287 1 978 . 1 1 82 82 LEU CG C 13 27.165 0.000 . 1 . . . A 82 LEU CG . 25287 1 979 . 1 1 82 82 LEU CD1 C 13 23.632 0.000 . 2 . . . A 82 LEU CD1 . 25287 1 980 . 1 1 82 82 LEU CD2 C 13 26.081 0.000 . 2 . . . A 82 LEU CD2 . 25287 1 981 . 1 1 82 82 LEU N N 15 119.821 0.000 . 1 . . . A 82 LEU N . 25287 1 982 . 1 1 83 83 ALA H H 1 7.964 0.000 . 1 . . . A 83 ALA H . 25287 1 983 . 1 1 83 83 ALA HA H 1 4.283 0.000 . 1 . . . A 83 ALA HA . 25287 1 984 . 1 1 83 83 ALA HB1 H 1 1.600 0.000 . 1 . . . A 83 ALA HB1 . 25287 1 985 . 1 1 83 83 ALA HB2 H 1 1.600 0.000 . 1 . . . A 83 ALA HB2 . 25287 1 986 . 1 1 83 83 ALA HB3 H 1 1.600 0.000 . 1 . . . A 83 ALA HB3 . 25287 1 987 . 1 1 83 83 ALA C C 13 178.632 0.000 . 1 . . . A 83 ALA C . 25287 1 988 . 1 1 83 83 ALA CA C 13 53.920 0.000 . 1 . . . A 83 ALA CA . 25287 1 989 . 1 1 83 83 ALA CB C 13 18.994 0.000 . 1 . . . A 83 ALA CB . 25287 1 990 . 1 1 83 83 ALA N N 15 121.346 0.000 . 1 . . . A 83 ALA N . 25287 1 991 . 1 1 84 84 GLU H H 1 7.761 0.000 . 1 . . . A 84 GLU H . 25287 1 992 . 1 1 84 84 GLU HA H 1 4.382 0.000 . 1 . . . A 84 GLU HA . 25287 1 993 . 1 1 84 84 GLU HB2 H 1 2.267 0.000 . 2 . . . A 84 GLU HB2 . 25287 1 994 . 1 1 84 84 GLU HB3 H 1 2.131 0.000 . 2 . . . A 84 GLU HB3 . 25287 1 995 . 1 1 84 84 GLU HG2 H 1 2.470 0.000 . 2 . . . A 84 GLU HG2 . 25287 1 996 . 1 1 84 84 GLU HG3 H 1 2.541 0.000 . 2 . . . A 84 GLU HG3 . 25287 1 997 . 1 1 84 84 GLU C C 13 176.261 0.000 . 1 . . . A 84 GLU C . 25287 1 998 . 1 1 84 84 GLU CA C 13 56.611 0.000 . 1 . . . A 84 GLU CA . 25287 1 999 . 1 1 84 84 GLU CB C 13 29.936 0.000 . 1 . . . A 84 GLU CB . 25287 1 1000 . 1 1 84 84 GLU CG C 13 35.575 0.000 . 1 . . . A 84 GLU CG . 25287 1 1001 . 1 1 84 84 GLU N N 15 117.086 0.000 . 1 . . . A 84 GLU N . 25287 1 1002 . 1 1 85 85 ALA H H 1 7.840 0.000 . 1 . . . A 85 ALA H . 25287 1 1003 . 1 1 85 85 ALA HA H 1 4.489 0.000 . 1 . . . A 85 ALA HA . 25287 1 1004 . 1 1 85 85 ALA HB1 H 1 1.566 0.000 . 1 . . . A 85 ALA HB1 . 25287 1 1005 . 1 1 85 85 ALA HB2 H 1 1.566 0.000 . 1 . . . A 85 ALA HB2 . 25287 1 1006 . 1 1 85 85 ALA HB3 H 1 1.566 0.000 . 1 . . . A 85 ALA HB3 . 25287 1 1007 . 1 1 85 85 ALA C C 13 176.530 0.000 . 1 . . . A 85 ALA C . 25287 1 1008 . 1 1 85 85 ALA CA C 13 52.626 0.000 . 1 . . . A 85 ALA CA . 25287 1 1009 . 1 1 85 85 ALA CB C 13 19.492 0.000 . 1 . . . A 85 ALA CB . 25287 1 1010 . 1 1 85 85 ALA N N 15 124.161 0.000 . 1 . . . A 85 ALA N . 25287 1 1011 . 1 1 86 86 ALA H H 1 7.968 0.000 . 1 . . . A 86 ALA H . 25287 1 1012 . 1 1 86 86 ALA HA H 1 4.224 0.000 . 1 . . . A 86 ALA HA . 25287 1 1013 . 1 1 86 86 ALA CA C 13 54.149 0.000 . 1 . . . A 86 ALA CA . 25287 1 1014 . 1 1 86 86 ALA CB C 13 20.340 0.000 . 1 . . . A 86 ALA CB . 25287 1 1015 . 1 1 86 86 ALA N N 15 129.126 0.000 . 1 . . . A 86 ALA N . 25287 1 1016 . 2 2 1 1 SXR H10 H 1 7.287 0.000 . 2 . . . A 101 SXR H10 . 25287 1 1017 . 2 2 1 1 SXR H11 H 1 7.234 0.000 . 2 . . . A 101 SXR H11 . 25287 1 1018 . 2 2 1 1 SXR H1A H 1 2.816 0.000 . 2 . . . A 101 SXR H1A . 25287 1 1019 . 2 2 1 1 SXR H1B H 1 2.816 0.000 . 2 . . . A 101 SXR H1B . 25287 1 1020 . 2 2 1 1 SXR H28A H 1 3.895 0.000 . 2 . . . A 101 SXR H28A . 25287 1 1021 . 2 2 1 1 SXR H28B H 1 3.906 0.000 . 2 . . . A 101 SXR H28B . 25287 1 1022 . 2 2 1 1 SXR H2A H 1 2.928 0.000 . 2 . . . A 101 SXR H2A . 25287 1 1023 . 2 2 1 1 SXR H2B H 1 2.928 0.000 . 2 . . . A 101 SXR H2B . 25287 1 1024 . 2 2 1 1 SXR H30A H 1 0.951 0.000 . 2 . . . A 101 SXR H30A . 25287 1 1025 . 2 2 1 1 SXR H30B H 1 0.951 0.000 . 2 . . . A 101 SXR H30B . 25287 1 1026 . 2 2 1 1 SXR H30C H 1 0.951 0.000 . 2 . . . A 101 SXR H30C . 25287 1 1027 . 2 2 1 1 SXR H31A H 1 1.062 0.000 . 2 . . . A 101 SXR H31A . 25287 1 1028 . 2 2 1 1 SXR H31B H 1 1.062 0.000 . 2 . . . A 101 SXR H31B . 25287 1 1029 . 2 2 1 1 SXR H31C H 1 1.062 0.000 . 2 . . . A 101 SXR H31C . 25287 1 1030 . 2 2 1 1 SXR H32A H 1 4.128 0.000 . 2 . . . A 101 SXR H32A . 25287 1 1031 . 2 2 1 1 SXR H36 H 1 8.088 0.000 . 1 . . . A 101 SXR H36 . 25287 1 1032 . 2 2 1 1 SXR H37A H 1 3.605 0.000 . 2 . . . A 101 SXR H37A . 25287 1 1033 . 2 2 1 1 SXR H37B H 1 3.605 0.000 . 2 . . . A 101 SXR H37B . 25287 1 1034 . 2 2 1 1 SXR H38A H 1 2.582 0.000 . 2 . . . A 101 SXR H38A . 25287 1 1035 . 2 2 1 1 SXR H38B H 1 2.582 0.000 . 2 . . . A 101 SXR H38B . 25287 1 1036 . 2 2 1 1 SXR H41 H 1 8.221 0.000 . 1 . . . A 101 SXR H41 . 25287 1 1037 . 2 2 1 1 SXR H42A H 1 3.428 0.000 . 2 . . . A 101 SXR H42A . 25287 1 1038 . 2 2 1 1 SXR H42B H 1 3.427 0.000 . 2 . . . A 101 SXR H42B . 25287 1 1039 . 2 2 1 1 SXR H43A H 1 2.689 0.000 . 2 . . . A 101 SXR H43A . 25287 1 1040 . 2 2 1 1 SXR H43B H 1 2.689 0.000 . 2 . . . A 101 SXR H43B . 25287 1 1041 . 2 2 1 1 SXR H4A H 1 2.786 0.000 . 2 . . . A 101 SXR H4A . 25287 1 1042 . 2 2 1 1 SXR H4B H 1 2.786 0.000 . 2 . . . A 101 SXR H4B . 25287 1 1043 . 2 2 1 1 SXR H5A H 1 2.898 0.000 . 2 . . . A 101 SXR H5A . 25287 1 1044 . 2 2 1 1 SXR H5B H 1 2.898 0.000 . 2 . . . A 101 SXR H5B . 25287 1 1045 . 2 2 1 1 SXR H7A H 1 7.235 0.000 . 2 . . . A 101 SXR H7A . 25287 1 1046 . 2 2 1 1 SXR H8A H 1 7.287 0.000 . 2 . . . A 101 SXR H8A . 25287 1 1047 . 2 2 1 1 SXR H9A H 1 7.181 0.000 . 2 . . . A 101 SXR H9A . 25287 1 stop_ save_