################################### # 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 17750 _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 '3D HNCO' . . . 17750 1 2 '3D HNCA' . . . 17750 1 3 '3D CBCA(CO)NH' . . . 17750 1 4 '3D HBHA(CO)NH' . . . 17750 1 5 '3D HCCH-TOCSY' . . . 17750 1 6 '3D (H)CCH-TOCSY' . . . 17750 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 19 19 LEU H H 1 7.881 0.04 . 1 . . . A 43 LEU H . 17750 1 2 . 1 1 19 19 LEU HA H 1 4.206 0.04 . 1 . . . A 43 LEU HA . 17750 1 3 . 1 1 19 19 LEU HB2 H 1 1.527 0.04 . 2 . . . A 43 LEU HB2 . 17750 1 4 . 1 1 19 19 LEU HB3 H 1 1.469 0.04 . 2 . . . A 43 LEU HB3 . 17750 1 5 . 1 1 19 19 LEU HG H 1 1.477 0.04 . 1 . . . A 43 LEU HG . 17750 1 6 . 1 1 19 19 LEU HD11 H 1 0.799 0.04 . 2 . . . A 43 LEU HD1 . 17750 1 7 . 1 1 19 19 LEU HD12 H 1 0.799 0.04 . 2 . . . A 43 LEU HD1 . 17750 1 8 . 1 1 19 19 LEU HD13 H 1 0.799 0.04 . 2 . . . A 43 LEU HD1 . 17750 1 9 . 1 1 19 19 LEU HD21 H 1 0.741 0.04 . 2 . . . A 43 LEU HD2 . 17750 1 10 . 1 1 19 19 LEU HD22 H 1 0.741 0.04 . 2 . . . A 43 LEU HD2 . 17750 1 11 . 1 1 19 19 LEU HD23 H 1 0.741 0.04 . 2 . . . A 43 LEU HD2 . 17750 1 12 . 1 1 19 19 LEU C C 13 177.422 0.40 . 1 . . . A 43 LEU C . 17750 1 13 . 1 1 19 19 LEU CA C 13 55.349 0.40 . 1 . . . A 43 LEU CA . 17750 1 14 . 1 1 19 19 LEU CB C 13 42.350 0.40 . 1 . . . A 43 LEU CB . 17750 1 15 . 1 1 19 19 LEU CG C 13 26.819 0.40 . 1 . . . A 43 LEU CG . 17750 1 16 . 1 1 19 19 LEU CD1 C 13 24.830 0.40 . 2 . . . A 43 LEU CD1 . 17750 1 17 . 1 1 19 19 LEU CD2 C 13 23.468 0.40 . 2 . . . A 43 LEU CD2 . 17750 1 18 . 1 1 19 19 LEU N N 15 121.393 0.40 . 1 . . . A 43 LEU N . 17750 1 19 . 1 1 20 20 GLN H H 1 8.246 0.04 . 1 . . . A 44 GLN H . 17750 1 20 . 1 1 20 20 GLN HA H 1 4.182 0.04 . 1 . . . A 44 GLN HA . 17750 1 21 . 1 1 20 20 GLN HB2 H 1 1.965 0.04 . 2 . . . A 44 GLN HB2 . 17750 1 22 . 1 1 20 20 GLN HB3 H 1 1.860 0.04 . 2 . . . A 44 GLN HB3 . 17750 1 23 . 1 1 20 20 GLN HG2 H 1 2.223 0.04 . 2 . . . A 44 GLN HG2 . 17750 1 24 . 1 1 20 20 GLN HG3 H 1 2.223 0.04 . 2 . . . A 44 GLN HG3 . 17750 1 25 . 1 1 20 20 GLN C C 13 175.921 0.40 . 1 . . . A 44 GLN C . 17750 1 26 . 1 1 20 20 GLN CA C 13 55.977 0.40 . 1 . . . A 44 GLN CA . 17750 1 27 . 1 1 20 20 GLN CB C 13 29.294 0.40 . 1 . . . A 44 GLN CB . 17750 1 28 . 1 1 20 20 GLN CG C 13 33.792 0.40 . 1 . . . A 44 GLN CG . 17750 1 29 . 1 1 20 20 GLN N N 15 120.780 0.40 . 1 . . . A 44 GLN N . 17750 1 30 . 1 1 21 21 ARG H H 1 8.180 0.04 . 1 . . . A 45 ARG H . 17750 1 31 . 1 1 21 21 ARG HA H 1 4.189 0.04 . 1 . . . A 45 ARG HA . 17750 1 32 . 1 1 21 21 ARG HB2 H 1 1.733 0.04 . 2 . . . A 45 ARG HB2 . 17750 1 33 . 1 1 21 21 ARG HB3 H 1 1.630 0.04 . 2 . . . A 45 ARG HB3 . 17750 1 34 . 1 1 21 21 ARG HG2 H 1 1.503 0.04 . 2 . . . A 45 ARG HG2 . 17750 1 35 . 1 1 21 21 ARG HG3 H 1 1.503 0.04 . 2 . . . A 45 ARG HG3 . 17750 1 36 . 1 1 21 21 ARG HD2 H 1 3.063 0.04 . 2 . . . A 45 ARG HD2 . 17750 1 37 . 1 1 21 21 ARG HD3 H 1 3.063 0.04 . 2 . . . A 45 ARG HD3 . 17750 1 38 . 1 1 21 21 ARG C C 13 175.962 0.40 . 1 . . . A 45 ARG C . 17750 1 39 . 1 1 21 21 ARG CA C 13 55.922 0.40 . 1 . . . A 45 ARG CA . 17750 1 40 . 1 1 21 21 ARG CB C 13 31.083 0.40 . 1 . . . A 45 ARG CB . 17750 1 41 . 1 1 21 21 ARG CG C 13 26.982 0.40 . 1 . . . A 45 ARG CG . 17750 1 42 . 1 1 21 21 ARG CD C 13 43.244 0.40 . 1 . . . A 45 ARG CD . 17750 1 43 . 1 1 21 21 ARG N N 15 122.040 0.40 . 1 . . . A 45 ARG N . 17750 1 44 . 1 1 22 22 ALA H H 1 8.288 0.04 . 1 . . . A 46 ALA H . 17750 1 45 . 1 1 22 22 ALA HA H 1 4.190 0.04 . 1 . . . A 46 ALA HA . 17750 1 46 . 1 1 22 22 ALA HB1 H 1 1.282 0.04 . 1 . . . A 46 ALA HB . 17750 1 47 . 1 1 22 22 ALA HB2 H 1 1.282 0.04 . 1 . . . A 46 ALA HB . 17750 1 48 . 1 1 22 22 ALA HB3 H 1 1.282 0.04 . 1 . . . A 46 ALA HB . 17750 1 49 . 1 1 22 22 ALA C C 13 177.490 0.40 . 1 . . . A 46 ALA C . 17750 1 50 . 1 1 22 22 ALA CA C 13 52.592 0.40 . 1 . . . A 46 ALA CA . 17750 1 51 . 1 1 22 22 ALA CB C 13 19.400 0.40 . 1 . . . A 46 ALA CB . 17750 1 52 . 1 1 22 22 ALA N N 15 125.104 0.40 . 1 . . . A 46 ALA N . 17750 1 53 . 1 1 23 23 ASN H H 1 8.354 0.04 . 1 . . . A 47 ASN H . 17750 1 54 . 1 1 23 23 ASN HA H 1 4.593 0.04 . 1 . . . A 47 ASN HA . 17750 1 55 . 1 1 23 23 ASN HB2 H 1 2.748 0.04 . 2 . . . A 47 ASN HB2 . 17750 1 56 . 1 1 23 23 ASN HB3 H 1 2.677 0.04 . 2 . . . A 47 ASN HB3 . 17750 1 57 . 1 1 23 23 ASN HD21 H 1 6.850 0.04 . 2 . . . A 47 ASN HD21 . 17750 1 58 . 1 1 23 23 ASN HD22 H 1 7.538 0.04 . 2 . . . A 47 ASN HD22 . 17750 1 59 . 1 1 23 23 ASN C C 13 175.279 0.40 . 1 . . . A 47 ASN C . 17750 1 60 . 1 1 23 23 ASN CA C 13 53.356 0.40 . 1 . . . A 47 ASN CA . 17750 1 61 . 1 1 23 23 ASN CB C 13 39.012 0.40 . 1 . . . A 47 ASN CB . 17750 1 62 . 1 1 23 23 ASN N N 15 117.971 0.40 . 1 . . . A 47 ASN N . 17750 1 63 . 1 1 23 23 ASN ND2 N 15 113.270 0.40 . 1 . . . A 47 ASN ND2 . 17750 1 64 . 1 1 24 24 SER H H 1 8.200 0.04 . 1 . . . A 48 SER H . 17750 1 65 . 1 1 24 24 SER HA H 1 4.360 0.04 . 1 . . . A 48 SER HA . 17750 1 66 . 1 1 24 24 SER HB2 H 1 3.841 0.04 . 2 . . . A 48 SER HB2 . 17750 1 67 . 1 1 24 24 SER HB3 H 1 3.841 0.04 . 2 . . . A 48 SER HB3 . 17750 1 68 . 1 1 24 24 SER C C 13 174.433 0.40 . 1 . . . A 48 SER C . 17750 1 69 . 1 1 24 24 SER CA C 13 58.488 0.40 . 1 . . . A 48 SER CA . 17750 1 70 . 1 1 24 24 SER CB C 13 63.947 0.40 . 1 . . . A 48 SER CB . 17750 1 71 . 1 1 24 24 SER N N 15 115.740 0.40 . 1 . . . A 48 SER N . 17750 1 72 . 1 1 25 25 ASP H H 1 8.352 0.04 . 1 . . . A 49 ASP H . 17750 1 73 . 1 1 25 25 ASP HA H 1 4.556 0.04 . 1 . . . A 49 ASP HA . 17750 1 74 . 1 1 25 25 ASP HB2 H 1 2.654 0.04 . 2 . . . A 49 ASP HB2 . 17750 1 75 . 1 1 25 25 ASP HB3 H 1 2.571 0.04 . 2 . . . A 49 ASP HB3 . 17750 1 76 . 1 1 25 25 ASP C C 13 176.603 0.40 . 1 . . . A 49 ASP C . 17750 1 77 . 1 1 25 25 ASP CA C 13 54.694 0.40 . 1 . . . A 49 ASP CA . 17750 1 78 . 1 1 25 25 ASP CB C 13 40.950 0.40 . 1 . . . A 49 ASP CB . 17750 1 79 . 1 1 25 25 ASP N N 15 122.414 0.40 . 1 . . . A 49 ASP N . 17750 1 80 . 1 1 26 26 THR H H 1 7.934 0.04 . 1 . . . A 50 THR H . 17750 1 81 . 1 1 26 26 THR HA H 1 4.194 0.04 . 1 . . . A 50 THR HA . 17750 1 82 . 1 1 26 26 THR HB H 1 4.146 0.04 . 1 . . . A 50 THR HB . 17750 1 83 . 1 1 26 26 THR HG21 H 1 1.088 0.04 . 1 . . . A 50 THR HG2 . 17750 1 84 . 1 1 26 26 THR HG22 H 1 1.088 0.04 . 1 . . . A 50 THR HG2 . 17750 1 85 . 1 1 26 26 THR HG23 H 1 1.088 0.04 . 1 . . . A 50 THR HG2 . 17750 1 86 . 1 1 26 26 THR C C 13 174.378 0.40 . 1 . . . A 50 THR C . 17750 1 87 . 1 1 26 26 THR CA C 13 62.064 0.40 . 1 . . . A 50 THR CA . 17750 1 88 . 1 1 26 26 THR CB C 13 69.652 0.40 . 1 . . . A 50 THR CB . 17750 1 89 . 1 1 26 26 THR CG2 C 13 21.466 0.40 . 1 . . . A 50 THR CG2 . 17750 1 90 . 1 1 26 26 THR N N 15 113.340 0.40 . 1 . . . A 50 THR N . 17750 1 91 . 1 1 27 27 ASP H H 1 8.202 0.04 . 1 . . . A 51 ASP H . 17750 1 92 . 1 1 27 27 ASP HA H 1 4.507 0.04 . 1 . . . A 51 ASP HA . 17750 1 93 . 1 1 27 27 ASP HB2 H 1 2.606 0.04 . 2 . . . A 51 ASP HB2 . 17750 1 94 . 1 1 27 27 ASP HB3 H 1 2.517 0.04 . 2 . . . A 51 ASP HB3 . 17750 1 95 . 1 1 27 27 ASP C C 13 176.057 0.40 . 1 . . . A 51 ASP C . 17750 1 96 . 1 1 27 27 ASP CA C 13 54.530 0.40 . 1 . . . A 51 ASP CA . 17750 1 97 . 1 1 27 27 ASP CB C 13 41.019 0.40 . 1 . . . A 51 ASP CB . 17750 1 98 . 1 1 27 27 ASP N N 15 122.584 0.40 . 1 . . . A 51 ASP N . 17750 1 99 . 1 1 28 28 LEU H H 1 7.991 0.04 . 1 . . . A 52 LEU H . 17750 1 100 . 1 1 28 28 LEU HA H 1 4.216 0.04 . 1 . . . A 52 LEU HA . 17750 1 101 . 1 1 28 28 LEU HB2 H 1 1.529 0.04 . 2 . . . A 52 LEU HB2 . 17750 1 102 . 1 1 28 28 LEU HB3 H 1 1.468 0.04 . 2 . . . A 52 LEU HB3 . 17750 1 103 . 1 1 28 28 LEU HG H 1 1.485 0.04 . 1 . . . A 52 LEU HG . 17750 1 104 . 1 1 28 28 LEU HD11 H 1 0.798 0.04 . 2 . . . A 52 LEU HD1 . 17750 1 105 . 1 1 28 28 LEU HD12 H 1 0.798 0.04 . 2 . . . A 52 LEU HD1 . 17750 1 106 . 1 1 28 28 LEU HD13 H 1 0.798 0.04 . 2 . . . A 52 LEU HD1 . 17750 1 107 . 1 1 28 28 LEU HD21 H 1 0.741 0.04 . 2 . . . A 52 LEU HD2 . 17750 1 108 . 1 1 28 28 LEU HD22 H 1 0.741 0.04 . 2 . . . A 52 LEU HD2 . 17750 1 109 . 1 1 28 28 LEU HD23 H 1 0.741 0.04 . 2 . . . A 52 LEU HD2 . 17750 1 110 . 1 1 28 28 LEU C C 13 177.381 0.40 . 1 . . . A 52 LEU C . 17750 1 111 . 1 1 28 28 LEU CA C 13 55.322 0.40 . 1 . . . A 52 LEU CA . 17750 1 112 . 1 1 28 28 LEU CB C 13 42.351 0.40 . 1 . . . A 52 LEU CB . 17750 1 113 . 1 1 28 28 LEU CG C 13 26.873 0.40 . 1 . . . A 52 LEU CG . 17750 1 114 . 1 1 28 28 LEU CD1 C 13 24.912 0.40 . 2 . . . A 52 LEU CD1 . 17750 1 115 . 1 1 28 28 LEU CD2 C 13 23.468 0.40 . 2 . . . A 52 LEU CD2 . 17750 1 116 . 1 1 28 28 LEU N N 15 122.329 0.40 . 1 . . . A 52 LEU N . 17750 1 117 . 1 1 29 29 VAL H H 1 8.065 0.04 . 1 . . . A 53 VAL H . 17750 1 118 . 1 1 29 29 VAL HA H 1 4.039 0.04 . 1 . . . A 53 VAL HA . 17750 1 119 . 1 1 29 29 VAL HB H 1 1.985 0.04 . 1 . . . A 53 VAL HB . 17750 1 120 . 1 1 29 29 VAL HG11 H 1 0.828 0.04 . 2 . . . A 53 VAL HG1 . 17750 1 121 . 1 1 29 29 VAL HG12 H 1 0.828 0.04 . 2 . . . A 53 VAL HG1 . 17750 1 122 . 1 1 29 29 VAL HG13 H 1 0.828 0.04 . 2 . . . A 53 VAL HG1 . 17750 1 123 . 1 1 29 29 VAL HG21 H 1 0.842 0.04 . 2 . . . A 53 VAL HG2 . 17750 1 124 . 1 1 29 29 VAL HG22 H 1 0.842 0.04 . 2 . . . A 53 VAL HG2 . 17750 1 125 . 1 1 29 29 VAL HG23 H 1 0.842 0.04 . 2 . . . A 53 VAL HG2 . 17750 1 126 . 1 1 29 29 VAL C C 13 176.548 0.40 . 1 . . . A 53 VAL C . 17750 1 127 . 1 1 29 29 VAL CA C 13 62.637 0.40 . 1 . . . A 53 VAL CA . 17750 1 128 . 1 1 29 29 VAL CB C 13 32.502 0.40 . 1 . . . A 53 VAL CB . 17750 1 129 . 1 1 29 29 VAL CG1 C 13 21.098 0.40 . 2 . . . A 53 VAL CG1 . 17750 1 130 . 1 1 29 29 VAL CG2 C 13 20.744 0.40 . 2 . . . A 53 VAL CG2 . 17750 1 131 . 1 1 29 29 VAL N N 15 121.478 0.40 . 1 . . . A 53 VAL N . 17750 1 132 . 1 1 30 30 THR H H 1 8.158 0.04 . 1 . . . A 54 THR H . 17750 1 133 . 1 1 30 30 THR HA H 1 4.292 0.04 . 1 . . . A 54 THR HA . 17750 1 134 . 1 1 30 30 THR HB H 1 4.169 0.04 . 1 . . . A 54 THR HB . 17750 1 135 . 1 1 30 30 THR HG21 H 1 1.092 0.04 . 1 . . . A 54 THR HG2 . 17750 1 136 . 1 1 30 30 THR HG22 H 1 1.092 0.04 . 1 . . . A 54 THR HG2 . 17750 1 137 . 1 1 30 30 THR HG23 H 1 1.092 0.04 . 1 . . . A 54 THR HG2 . 17750 1 138 . 1 1 30 30 THR C C 13 174.706 0.40 . 1 . . . A 54 THR C . 17750 1 139 . 1 1 30 30 THR CA C 13 61.681 0.40 . 1 . . . A 54 THR CA . 17750 1 140 . 1 1 30 30 THR CB C 13 69.843 0.40 . 1 . . . A 54 THR CB . 17750 1 141 . 1 1 30 30 THR CG2 C 13 21.466 0.40 . 1 . . . A 54 THR CG2 . 17750 1 142 . 1 1 30 30 THR N N 15 117.715 0.40 . 1 . . . A 54 THR N . 17750 1 143 . 1 1 31 31 SER H H 1 8.244 0.04 . 1 . . . A 55 SER H . 17750 1 144 . 1 1 31 31 SER HA H 1 4.339 0.04 . 1 . . . A 55 SER HA . 17750 1 145 . 1 1 31 31 SER HB2 H 1 3.807 0.04 . 2 . . . A 55 SER HB2 . 17750 1 146 . 1 1 31 31 SER HB3 H 1 3.732 0.04 . 2 . . . A 55 SER HB3 . 17750 1 147 . 1 1 31 31 SER C C 13 174.610 0.40 . 1 . . . A 55 SER C . 17750 1 148 . 1 1 31 31 SER CA C 13 58.652 0.40 . 1 . . . A 55 SER CA . 17750 1 149 . 1 1 31 31 SER CB C 13 63.729 0.40 . 1 . . . A 55 SER CB . 17750 1 150 . 1 1 31 31 SER N N 15 117.920 0.40 . 1 . . . A 55 SER N . 17750 1 151 . 1 1 32 32 GLU H H 1 8.335 0.04 . 1 . . . A 56 GLU H . 17750 1 152 . 1 1 32 32 GLU HA H 1 4.216 0.04 . 1 . . . A 56 GLU HA . 17750 1 153 . 1 1 32 32 GLU HB2 H 1 1.971 0.04 . 2 . . . A 56 GLU HB2 . 17750 1 154 . 1 1 32 32 GLU HB3 H 1 1.828 0.04 . 2 . . . A 56 GLU HB3 . 17750 1 155 . 1 1 32 32 GLU HG2 H 1 2.190 0.04 . 2 . . . A 56 GLU HG2 . 17750 1 156 . 1 1 32 32 GLU HG3 H 1 2.138 0.04 . 2 . . . A 56 GLU HG3 . 17750 1 157 . 1 1 32 32 GLU C C 13 176.303 0.40 . 1 . . . A 56 GLU C . 17750 1 158 . 1 1 32 32 GLU CA C 13 56.605 0.40 . 1 . . . A 56 GLU CA . 17750 1 159 . 1 1 32 32 GLU CB C 13 30.264 0.40 . 1 . . . A 56 GLU CB . 17750 1 160 . 1 1 32 32 GLU CG C 13 36.312 0.40 . 1 . . . A 56 GLU CG . 17750 1 161 . 1 1 32 32 GLU N N 15 122.567 0.40 . 1 . . . A 56 GLU N . 17750 1 162 . 1 1 33 33 SER H H 1 8.189 0.04 . 1 . . . A 57 SER H . 17750 1 163 . 1 1 33 33 SER HA H 1 4.350 0.04 . 1 . . . A 57 SER HA . 17750 1 164 . 1 1 33 33 SER HB2 H 1 3.748 0.04 . 2 . . . A 57 SER HB2 . 17750 1 165 . 1 1 33 33 SER HB3 H 1 3.748 0.04 . 2 . . . A 57 SER HB3 . 17750 1 166 . 1 1 33 33 SER C C 13 174.065 0.40 . 1 . . . A 57 SER C . 17750 1 167 . 1 1 33 33 SER CA C 13 58.090 0.40 . 1 . . . A 57 SER CA . 17750 1 168 . 1 1 33 33 SER CB C 13 63.511 0.40 . 1 . . . A 57 SER CB . 17750 1 169 . 1 1 33 33 SER N N 15 116.404 0.40 . 1 . . . A 57 SER N . 17750 1 170 . 1 1 34 34 ARG H H 1 8.142 0.04 . 1 . . . A 58 ARG H . 17750 1 171 . 1 1 34 34 ARG HA H 1 4.469 0.04 . 1 . . . A 58 ARG HA . 17750 1 172 . 1 1 34 34 ARG HB2 H 1 1.862 0.04 . 2 . . . A 58 ARG HB2 . 17750 1 173 . 1 1 34 34 ARG HB3 H 1 1.636 0.04 . 2 . . . A 58 ARG HB3 . 17750 1 174 . 1 1 34 34 ARG HG2 H 1 1.567 0.04 . 2 . . . A 58 ARG HG2 . 17750 1 175 . 1 1 34 34 ARG HG3 H 1 1.567 0.04 . 2 . . . A 58 ARG HG3 . 17750 1 176 . 1 1 34 34 ARG HD2 H 1 3.111 0.04 . 2 . . . A 58 ARG HD2 . 17750 1 177 . 1 1 34 34 ARG HD3 H 1 3.111 0.04 . 2 . . . A 58 ARG HD3 . 17750 1 178 . 1 1 34 34 ARG C C 13 176.057 0.40 . 1 . . . A 58 ARG C . 17750 1 179 . 1 1 34 34 ARG CA C 13 54.940 0.40 . 1 . . . A 58 ARG CA . 17750 1 180 . 1 1 34 34 ARG CB C 13 32.202 0.40 . 1 . . . A 58 ARG CB . 17750 1 181 . 1 1 34 34 ARG CG C 13 26.900 0.40 . 1 . . . A 58 ARG CG . 17750 1 182 . 1 1 34 34 ARG CD C 13 43.272 0.40 . 1 . . . A 58 ARG CD . 17750 1 183 . 1 1 34 34 ARG N N 15 122.619 0.40 . 1 . . . A 58 ARG N . 17750 1 184 . 1 1 35 35 SER H H 1 9.236 0.04 . 1 . . . A 59 SER H . 17750 1 185 . 1 1 35 35 SER HA H 1 4.749 0.04 . 1 . . . A 59 SER HA . 17750 1 186 . 1 1 35 35 SER HB2 H 1 3.930 0.04 . 2 . . . A 59 SER HB2 . 17750 1 187 . 1 1 35 35 SER HB3 H 1 3.712 0.04 . 2 . . . A 59 SER HB3 . 17750 1 188 . 1 1 35 35 SER C C 13 173.464 0.40 . 1 . . . A 59 SER C . 17750 1 189 . 1 1 35 35 SER CA C 13 59.907 0.40 . 1 . . . A 59 SER CA . 17750 1 190 . 1 1 35 35 SER CB C 13 63.511 0.40 . 1 . . . A 59 SER CB . 17750 1 191 . 1 1 35 35 SER N N 15 121.444 0.40 . 1 . . . A 59 SER N . 17750 1 192 . 1 1 36 36 SER H H 1 9.241 0.04 . 1 . . . A 60 SER H . 17750 1 193 . 1 1 36 36 SER HA H 1 4.647 0.04 . 1 . . . A 60 SER HA . 17750 1 194 . 1 1 36 36 SER HB2 H 1 3.657 0.04 . 2 . . . A 60 SER HB2 . 17750 1 195 . 1 1 36 36 SER HB3 H 1 3.657 0.04 . 2 . . . A 60 SER HB3 . 17750 1 196 . 1 1 36 36 SER C C 13 170.966 0.40 . 1 . . . A 60 SER C . 17750 1 197 . 1 1 36 36 SER CA C 13 56.933 0.40 . 1 . . . A 60 SER CA . 17750 1 198 . 1 1 36 36 SER CB C 13 66.895 0.40 . 1 . . . A 60 SER CB . 17750 1 199 . 1 1 36 36 SER N N 15 117.596 0.40 . 1 . . . A 60 SER N . 17750 1 200 . 1 1 37 37 LEU H H 1 8.537 0.04 . 1 . . . A 61 LEU H . 17750 1 201 . 1 1 37 37 LEU HA H 1 5.279 0.04 . 1 . . . A 61 LEU HA . 17750 1 202 . 1 1 37 37 LEU HB2 H 1 1.596 0.04 . 2 . . . A 61 LEU HB2 . 17750 1 203 . 1 1 37 37 LEU HB3 H 1 0.896 0.04 . 2 . . . A 61 LEU HB3 . 17750 1 204 . 1 1 37 37 LEU HD11 H 1 0.831 0.04 . 2 . . . A 61 LEU HD11 . 17750 1 205 . 1 1 37 37 LEU HD12 H 1 0.831 0.04 . 2 . . . A 61 LEU HD12 . 17750 1 206 . 1 1 37 37 LEU HD13 H 1 0.831 0.04 . 2 . . . A 61 LEU HD13 . 17750 1 207 . 1 1 37 37 LEU HD21 H 1 1.188 0.04 . 2 . . . A 61 LEU HD21 . 17750 1 208 . 1 1 37 37 LEU HD22 H 1 1.188 0.04 . 2 . . . A 61 LEU HD22 . 17750 1 209 . 1 1 37 37 LEU HD23 H 1 1.188 0.04 . 2 . . . A 61 LEU HD23 . 17750 1 210 . 1 1 37 37 LEU C C 13 175.156 0.40 . 1 . . . A 61 LEU C . 17750 1 211 . 1 1 37 37 LEU CA C 13 53.629 0.40 . 1 . . . A 61 LEU CA . 17750 1 212 . 1 1 37 37 LEU CB C 13 46.713 0.40 . 1 . . . A 61 LEU CB . 17750 1 213 . 1 1 37 37 LEU CD1 C 13 26.955 0.40 . 2 . . . A 61 LEU CD1 . 17750 1 214 . 1 1 37 37 LEU CD2 C 13 26.437 0.40 . 2 . . . A 61 LEU CD2 . 17750 1 215 . 1 1 37 37 LEU N N 15 126.483 0.40 . 1 . . . A 61 LEU N . 17750 1 216 . 1 1 38 38 THR H H 1 9.132 0.04 . 1 . . . A 62 THR H . 17750 1 217 . 1 1 38 38 THR HA H 1 4.783 0.04 . 1 . . . A 62 THR HA . 17750 1 218 . 1 1 38 38 THR HB H 1 4.321 0.04 . 1 . . . A 62 THR HB . 17750 1 219 . 1 1 38 38 THR HG21 H 1 1.134 0.04 . 1 . . . A 62 THR HG21 . 17750 1 220 . 1 1 38 38 THR HG22 H 1 1.134 0.04 . 1 . . . A 62 THR HG22 . 17750 1 221 . 1 1 38 38 THR HG23 H 1 1.134 0.04 . 1 . . . A 62 THR HG23 . 17750 1 222 . 1 1 38 38 THR C C 13 172.140 0.40 . 1 . . . A 62 THR C . 17750 1 223 . 1 1 38 38 THR CA C 13 59.744 0.40 . 1 . . . A 62 THR CA . 17750 1 224 . 1 1 38 38 THR CB C 13 73.118 0.40 . 1 . . . A 62 THR CB . 17750 1 225 . 1 1 38 38 THR CG2 C 13 22.828 0.40 . 1 . . . A 62 THR CG2 . 17750 1 226 . 1 1 38 38 THR N N 15 115.570 0.40 . 1 . . . A 62 THR N . 17750 1 227 . 1 1 39 39 ALA H H 1 8.318 0.04 . 1 . . . A 63 ALA H . 17750 1 228 . 1 1 39 39 ALA HA H 1 5.725 0.04 . 1 . . . A 63 ALA HA . 17750 1 229 . 1 1 39 39 ALA HB1 H 1 0.944 0.04 . 1 . . . A 63 ALA HB1 . 17750 1 230 . 1 1 39 39 ALA HB2 H 1 0.944 0.04 . 1 . . . A 63 ALA HB2 . 17750 1 231 . 1 1 39 39 ALA HB3 H 1 0.944 0.04 . 1 . . . A 63 ALA HB3 . 17750 1 232 . 1 1 39 39 ALA C C 13 177.749 0.40 . 1 . . . A 63 ALA C . 17750 1 233 . 1 1 39 39 ALA CA C 13 49.426 0.40 . 1 . . . A 63 ALA CA . 17750 1 234 . 1 1 39 39 ALA CB C 13 24.232 0.40 . 1 . . . A 63 ALA CB . 17750 1 235 . 1 1 39 39 ALA N N 15 120.695 0.40 . 1 . . . A 63 ALA N . 17750 1 236 . 1 1 40 40 SER H H 1 9.041 0.04 . 1 . . . A 64 SER H . 17750 1 237 . 1 1 40 40 SER HA H 1 4.148 0.04 . 1 . . . A 64 SER HA . 17750 1 238 . 1 1 40 40 SER HB2 H 1 4.025 0.04 . 2 . . . A 64 SER HB2 . 17750 1 239 . 1 1 40 40 SER HB3 H 1 4.025 0.04 . 2 . . . A 64 SER HB3 . 17750 1 240 . 1 1 40 40 SER HG H 1 6.265 0.04 . 1 . . . A 64 SER HG . 17750 1 241 . 1 1 40 40 SER C C 13 173.901 0.40 . 1 . . . A 64 SER C . 17750 1 242 . 1 1 40 40 SER CA C 13 59.853 0.40 . 1 . . . A 64 SER CA . 17750 1 243 . 1 1 40 40 SER CB C 13 62.610 0.40 . 1 . . . A 64 SER CB . 17750 1 244 . 1 1 40 40 SER N N 15 112.948 0.40 . 1 . . . A 64 SER N . 17750 1 245 . 1 1 41 41 MET H H 1 6.981 0.04 . 1 . . . A 65 MET H . 17750 1 246 . 1 1 41 41 MET HA H 1 4.449 0.04 . 1 . . . A 65 MET HA . 17750 1 247 . 1 1 41 41 MET HB2 H 1 2.389 0.04 . 2 . . . A 65 MET HB2 . 17750 1 248 . 1 1 41 41 MET HB3 H 1 2.012 0.04 . 2 . . . A 65 MET HB3 . 17750 1 249 . 1 1 41 41 MET HG2 H 1 2.409 0.04 . 2 . . . A 65 MET HG2 . 17750 1 250 . 1 1 41 41 MET HG3 H 1 2.409 0.04 . 2 . . . A 65 MET HG3 . 17750 1 251 . 1 1 41 41 MET HE1 H 1 2.017 0.04 . 1 . . . A 65 MET HE1 . 17750 1 252 . 1 1 41 41 MET HE2 H 1 2.017 0.04 . 1 . . . A 65 MET HE2 . 17750 1 253 . 1 1 41 41 MET HE3 H 1 2.017 0.04 . 1 . . . A 65 MET HE3 . 17750 1 254 . 1 1 41 41 MET C C 13 172.495 0.40 . 1 . . . A 65 MET C . 17750 1 255 . 1 1 41 41 MET CA C 13 54.858 0.40 . 1 . . . A 65 MET CA . 17750 1 256 . 1 1 41 41 MET CB C 13 35.545 0.40 . 1 . . . A 65 MET CB . 17750 1 257 . 1 1 41 41 MET CG C 13 30.850 0.40 . 1 . . . A 65 MET CG . 17750 1 258 . 1 1 41 41 MET CE C 13 16.920 0.40 . 1 . . . A 65 MET CE . 17750 1 259 . 1 1 41 41 MET N N 15 115.774 0.40 . 1 . . . A 65 MET N . 17750 1 260 . 1 1 42 42 TYR H H 1 8.592 0.04 . 1 . . . A 66 TYR H . 17750 1 261 . 1 1 42 42 TYR HA H 1 4.708 0.04 . 1 . . . A 66 TYR HA . 17750 1 262 . 1 1 42 42 TYR HB2 H 1 3.773 0.04 . 2 . . . A 66 TYR HB2 . 17750 1 263 . 1 1 42 42 TYR HB3 H 1 2.531 0.04 . 2 . . . A 66 TYR HB3 . 17750 1 264 . 1 1 42 42 TYR HD1 H 1 7.135 0.04 . 3 . . . A 66 TYR HD1 . 17750 1 265 . 1 1 42 42 TYR HD2 H 1 7.135 0.04 . 3 . . . A 66 TYR HD2 . 17750 1 266 . 1 1 42 42 TYR HE1 H 1 6.675 0.04 . 3 . . . A 66 TYR HE1 . 17750 1 267 . 1 1 42 42 TYR HE2 H 1 6.675 0.04 . 3 . . . A 66 TYR HE2 . 17750 1 268 . 1 1 42 42 TYR C C 13 174.529 0.40 . 1 . . . A 66 TYR C . 17750 1 269 . 1 1 42 42 TYR CA C 13 59.143 0.40 . 1 . . . A 66 TYR CA . 17750 1 270 . 1 1 42 42 TYR CB C 13 38.016 0.40 . 1 . . . A 66 TYR CB . 17750 1 271 . 1 1 42 42 TYR CD1 C 13 133.283 0.40 . 3 . . . A 66 TYR CD1 . 17750 1 272 . 1 1 42 42 TYR CD2 C 13 133.283 0.40 . 3 . . . A 66 TYR CD2 . 17750 1 273 . 1 1 42 42 TYR CE1 C 13 119.182 0.40 . 3 . . . A 66 TYR CE1 . 17750 1 274 . 1 1 42 42 TYR CE2 C 13 119.182 0.40 . 3 . . . A 66 TYR CE2 . 17750 1 275 . 1 1 42 42 TYR N N 15 112.744 0.40 . 1 . . . A 66 TYR N . 17750 1 276 . 1 1 43 43 GLU H H 1 7.366 0.04 . 1 . . . A 67 GLU H . 17750 1 277 . 1 1 43 43 GLU HA H 1 5.179 0.04 . 1 . . . A 67 GLU HA . 17750 1 278 . 1 1 43 43 GLU HB2 H 1 1.922 0.04 . 2 . . . A 67 GLU HB2 . 17750 1 279 . 1 1 43 43 GLU HB3 H 1 1.922 0.04 . 2 . . . A 67 GLU HB3 . 17750 1 280 . 1 1 43 43 GLU HG2 H 1 2.170 0.04 . 2 . . . A 67 GLU HG2 . 17750 1 281 . 1 1 43 43 GLU HG3 H 1 2.108 0.04 . 2 . . . A 67 GLU HG3 . 17750 1 282 . 1 1 43 43 GLU C C 13 174.010 0.40 . 1 . . . A 67 GLU C . 17750 1 283 . 1 1 43 43 GLU CA C 13 55.322 0.40 . 1 . . . A 67 GLU CA . 17750 1 284 . 1 1 43 43 GLU CB C 13 33.103 0.40 . 1 . . . A 67 GLU CB . 17750 1 285 . 1 1 43 43 GLU CG C 13 36.707 0.40 . 1 . . . A 67 GLU CG . 17750 1 286 . 1 1 43 43 GLU N N 15 120.269 0.40 . 1 . . . A 67 GLU N . 17750 1 287 . 1 1 44 44 TYR H H 1 8.775 0.04 . 1 . . . A 68 TYR H . 17750 1 288 . 1 1 44 44 TYR HA H 1 4.502 0.04 . 1 . . . A 68 TYR HA . 17750 1 289 . 1 1 44 44 TYR HB2 H 1 2.596 0.04 . 2 . . . A 68 TYR HB2 . 17750 1 290 . 1 1 44 44 TYR HB3 H 1 2.354 0.04 . 2 . . . A 68 TYR HB3 . 17750 1 291 . 1 1 44 44 TYR HD1 H 1 6.768 0.04 . 3 . . . A 68 TYR HD1 . 17750 1 292 . 1 1 44 44 TYR HD2 H 1 6.768 0.04 . 3 . . . A 68 TYR HD2 . 17750 1 293 . 1 1 44 44 TYR HE1 H 1 6.894 0.04 . 3 . . . A 68 TYR HE1 . 17750 1 294 . 1 1 44 44 TYR HE2 H 1 6.894 0.04 . 3 . . . A 68 TYR HE2 . 17750 1 295 . 1 1 44 44 TYR C C 13 173.478 0.40 . 1 . . . A 68 TYR C . 17750 1 296 . 1 1 44 44 TYR CA C 13 57.205 0.40 . 1 . . . A 68 TYR CA . 17750 1 297 . 1 1 44 44 TYR CB C 13 42.929 0.40 . 1 . . . A 68 TYR CB . 17750 1 298 . 1 1 44 44 TYR CD1 C 13 132.734 0.40 . 3 . . . A 68 TYR CD1 . 17750 1 299 . 1 1 44 44 TYR CD2 C 13 132.734 0.40 . 3 . . . A 68 TYR CD2 . 17750 1 300 . 1 1 44 44 TYR CE1 C 13 119.604 0.40 . 3 . . . A 68 TYR CE1 . 17750 1 301 . 1 1 44 44 TYR CE2 C 13 119.604 0.40 . 3 . . . A 68 TYR CE2 . 17750 1 302 . 1 1 44 44 TYR N N 15 126.313 0.40 . 1 . . . A 68 TYR N . 17750 1 303 . 1 1 45 45 THR H H 1 8.386 0.04 . 1 . . . A 69 THR H . 17750 1 304 . 1 1 45 45 THR HA H 1 4.756 0.04 . 1 . . . A 69 THR HA . 17750 1 305 . 1 1 45 45 THR HB H 1 3.784 0.04 . 1 . . . A 69 THR HB . 17750 1 306 . 1 1 45 45 THR HG21 H 1 1.031 0.04 . 1 . . . A 69 THR HG21 . 17750 1 307 . 1 1 45 45 THR HG22 H 1 1.031 0.04 . 1 . . . A 69 THR HG22 . 17750 1 308 . 1 1 45 45 THR HG23 H 1 1.031 0.04 . 1 . . . A 69 THR HG23 . 17750 1 309 . 1 1 45 45 THR C C 13 173.123 0.40 . 1 . . . A 69 THR C . 17750 1 310 . 1 1 45 45 THR CA C 13 61.436 0.40 . 1 . . . A 69 THR CA . 17750 1 311 . 1 1 45 45 THR CB C 13 69.407 0.40 . 1 . . . A 69 THR CB . 17750 1 312 . 1 1 45 45 THR CG2 C 13 20.976 0.40 . 1 . . . A 69 THR CG2 . 17750 1 313 . 1 1 45 45 THR N N 15 126.909 0.40 . 1 . . . A 69 THR N . 17750 1 314 . 1 1 46 46 LEU H H 1 8.467 0.04 . 1 . . . A 70 LEU H . 17750 1 315 . 1 1 46 46 LEU HA H 1 3.945 0.04 . 1 . . . A 70 LEU HA . 17750 1 316 . 1 1 46 46 LEU HB2 H 1 1.699 0.04 . 2 . . . A 70 LEU HB2 . 17750 1 317 . 1 1 46 46 LEU HB3 H 1 1.270 0.04 . 2 . . . A 70 LEU HB3 . 17750 1 318 . 1 1 46 46 LEU HG H 1 1.500 0.04 . 1 . . . A 70 LEU HG . 17750 1 319 . 1 1 46 46 LEU HD11 H 1 0.748 0.04 . 2 . . . A 70 LEU HD11 . 17750 1 320 . 1 1 46 46 LEU HD12 H 1 0.748 0.04 . 2 . . . A 70 LEU HD12 . 17750 1 321 . 1 1 46 46 LEU HD13 H 1 0.748 0.04 . 2 . . . A 70 LEU HD13 . 17750 1 322 . 1 1 46 46 LEU HD21 H 1 0.497 0.04 . 2 . . . A 70 LEU HD21 . 17750 1 323 . 1 1 46 46 LEU HD22 H 1 0.497 0.04 . 2 . . . A 70 LEU HD22 . 17750 1 324 . 1 1 46 46 LEU HD23 H 1 0.497 0.04 . 2 . . . A 70 LEU HD23 . 17750 1 325 . 1 1 46 46 LEU C C 13 177.695 0.40 . 1 . . . A 70 LEU C . 17750 1 326 . 1 1 46 46 LEU CA C 13 57.041 0.40 . 1 . . . A 70 LEU CA . 17750 1 327 . 1 1 46 46 LEU CB C 13 42.043 0.40 . 1 . . . A 70 LEU CB . 17750 1 328 . 1 1 46 46 LEU CG C 13 26.690 0.40 . 1 . . . A 70 LEU CG . 17750 1 329 . 1 1 46 46 LEU CD1 C 13 26.083 0.40 . 2 . . . A 70 LEU CD1 . 17750 1 330 . 1 1 46 46 LEU CD2 C 13 23.631 0.40 . 2 . . . A 70 LEU CD2 . 17750 1 331 . 1 1 46 46 LEU N N 15 126.109 0.40 . 1 . . . A 70 LEU N . 17750 1 332 . 1 1 47 47 GLY H H 1 8.981 0.04 . 1 . . . A 71 GLY H . 17750 1 333 . 1 1 47 47 GLY HA2 H 1 4.148 0.04 . 2 . . . A 71 GLY HA2 . 17750 1 334 . 1 1 47 47 GLY HA3 H 1 3.568 0.04 . 2 . . . A 71 GLY HA3 . 17750 1 335 . 1 1 47 47 GLY C C 13 174.979 0.40 . 1 . . . A 71 GLY C . 17750 1 336 . 1 1 47 47 GLY CA C 13 45.004 0.40 . 1 . . . A 71 GLY CA . 17750 1 337 . 1 1 47 47 GLY N N 15 111.007 0.40 . 1 . . . A 71 GLY N . 17750 1 338 . 1 1 48 48 GLN H H 1 8.057 0.04 . 1 . . . A 72 GLN H . 17750 1 339 . 1 1 48 48 GLN HA H 1 4.237 0.04 . 1 . . . A 72 GLN HA . 17750 1 340 . 1 1 48 48 GLN HB2 H 1 2.114 0.04 . 2 . . . A 72 GLN HB2 . 17750 1 341 . 1 1 48 48 GLN HB3 H 1 2.114 0.04 . 2 . . . A 72 GLN HB3 . 17750 1 342 . 1 1 48 48 GLN HG2 H 1 1.934 0.04 . 2 . . . A 72 GLN HG2 . 17750 1 343 . 1 1 48 48 GLN HG3 H 1 1.934 0.04 . 2 . . . A 72 GLN HG3 . 17750 1 344 . 1 1 48 48 GLN HE21 H 1 6.426 0.04 . 2 . . . A 72 GLN HE21 . 17750 1 345 . 1 1 48 48 GLN HE22 H 1 8.066 0.04 . 2 . . . A 72 GLN HE22 . 17750 1 346 . 1 1 48 48 GLN C C 13 175.634 0.40 . 1 . . . A 72 GLN C . 17750 1 347 . 1 1 48 48 GLN CA C 13 55.458 0.40 . 1 . . . A 72 GLN CA . 17750 1 348 . 1 1 48 48 GLN CB C 13 29.036 0.40 . 1 . . . A 72 GLN CB . 17750 1 349 . 1 1 48 48 GLN CG C 13 32.185 0.40 . 1 . . . A 72 GLN CG . 17750 1 350 . 1 1 48 48 GLN N N 15 118.873 0.40 . 1 . . . A 72 GLN N . 17750 1 351 . 1 1 48 48 GLN NE2 N 15 115.111 0.40 . 1 . . . A 72 GLN NE2 . 17750 1 352 . 1 1 49 49 ALA H H 1 8.474 0.04 . 1 . . . A 73 ALA H . 17750 1 353 . 1 1 49 49 ALA HA H 1 4.030 0.04 . 1 . . . A 73 ALA HA . 17750 1 354 . 1 1 49 49 ALA HB1 H 1 1.296 0.04 . 1 . . . A 73 ALA HB1 . 17750 1 355 . 1 1 49 49 ALA HB2 H 1 1.296 0.04 . 1 . . . A 73 ALA HB2 . 17750 1 356 . 1 1 49 49 ALA HB3 H 1 1.296 0.04 . 1 . . . A 73 ALA HB3 . 17750 1 357 . 1 1 49 49 ALA C C 13 178.746 0.40 . 1 . . . A 73 ALA C . 17750 1 358 . 1 1 49 49 ALA CA C 13 54.312 0.40 . 1 . . . A 73 ALA CA . 17750 1 359 . 1 1 49 49 ALA CB C 13 18.854 0.40 . 1 . . . A 73 ALA CB . 17750 1 360 . 1 1 49 49 ALA N N 15 124.100 0.40 . 1 . . . A 73 ALA N . 17750 1 361 . 1 1 50 50 GLN H H 1 8.069 0.04 . 1 . . . A 74 GLN H . 17750 1 362 . 1 1 50 50 GLN HA H 1 4.203 0.04 . 1 . . . A 74 GLN HA . 17750 1 363 . 1 1 50 50 GLN HB2 H 1 1.865 0.04 . 2 . . . A 74 GLN HB2 . 17750 1 364 . 1 1 50 50 GLN HB3 H 1 1.865 0.04 . 2 . . . A 74 GLN HB3 . 17750 1 365 . 1 1 50 50 GLN HG2 H 1 2.329 0.04 . 2 . . . A 74 GLN HG2 . 17750 1 366 . 1 1 50 50 GLN HG3 H 1 2.329 0.04 . 2 . . . A 74 GLN HG3 . 17750 1 367 . 1 1 50 50 GLN HE21 H 1 6.840 0.04 . 2 . . . A 74 GLN HE21 . 17750 1 368 . 1 1 50 50 GLN HE22 H 1 7.501 0.04 . 2 . . . A 74 GLN HE22 . 17750 1 369 . 1 1 50 50 GLN C C 13 176.043 0.40 . 1 . . . A 74 GLN C . 17750 1 370 . 1 1 50 50 GLN CA C 13 55.977 0.40 . 1 . . . A 74 GLN CA . 17750 1 371 . 1 1 50 50 GLN CB C 13 29.308 0.40 . 1 . . . A 74 GLN CB . 17750 1 372 . 1 1 50 50 GLN CG C 13 33.833 0.40 . 1 . . . A 74 GLN CG . 17750 1 373 . 1 1 50 50 GLN N N 15 116.558 0.40 . 1 . . . A 74 GLN N . 17750 1 374 . 1 1 50 50 GLN NE2 N 15 112.627 0.40 . 1 . . . A 74 GLN NE2 . 17750 1 375 . 1 1 51 51 ASN H H 1 8.550 0.04 . 1 . . . A 75 ASN H . 17750 1 376 . 1 1 51 51 ASN HA H 1 4.865 0.04 . 1 . . . A 75 ASN HA . 17750 1 377 . 1 1 51 51 ASN HB2 H 1 2.553 0.04 . 2 . . . A 75 ASN HB2 . 17750 1 378 . 1 1 51 51 ASN HB3 H 1 2.553 0.04 . 2 . . . A 75 ASN HB3 . 17750 1 379 . 1 1 51 51 ASN HD21 H 1 7.029 0.04 . 2 . . . A 75 ASN HD21 . 17750 1 380 . 1 1 51 51 ASN HD22 H 1 7.250 0.04 . 2 . . . A 75 ASN HD22 . 17750 1 381 . 1 1 51 51 ASN C C 13 175.020 0.40 . 1 . . . A 75 ASN C . 17750 1 382 . 1 1 51 51 ASN CA C 13 53.166 0.40 . 1 . . . A 75 ASN CA . 17750 1 383 . 1 1 51 51 ASN CB C 13 39.436 0.40 . 1 . . . A 75 ASN CB . 17750 1 384 . 1 1 51 51 ASN N N 15 122.721 0.40 . 1 . . . A 75 ASN N . 17750 1 385 . 1 1 51 51 ASN ND2 N 15 112.883 0.40 . 1 . . . A 75 ASN ND2 . 17750 1 386 . 1 1 52 52 LEU H H 1 8.248 0.04 . 1 . . . A 76 LEU H . 17750 1 387 . 1 1 52 52 LEU HA H 1 4.100 0.04 . 1 . . . A 76 LEU HA . 17750 1 388 . 1 1 52 52 LEU HB2 H 1 1.657 0.04 . 2 . . . A 76 LEU HB2 . 17750 1 389 . 1 1 52 52 LEU HB3 H 1 1.432 0.04 . 2 . . . A 76 LEU HB3 . 17750 1 390 . 1 1 52 52 LEU HG H 1 1.324 0.04 . 1 . . . A 76 LEU HG . 17750 1 391 . 1 1 52 52 LEU HD11 H 1 0.587 0.04 . 2 . . . A 76 LEU HD11 . 17750 1 392 . 1 1 52 52 LEU HD12 H 1 0.587 0.04 . 2 . . . A 76 LEU HD12 . 17750 1 393 . 1 1 52 52 LEU HD13 H 1 0.587 0.04 . 2 . . . A 76 LEU HD13 . 17750 1 394 . 1 1 52 52 LEU HD21 H 1 0.692 0.04 . 2 . . . A 76 LEU HD21 . 17750 1 395 . 1 1 52 52 LEU HD22 H 1 0.692 0.04 . 2 . . . A 76 LEU HD22 . 17750 1 396 . 1 1 52 52 LEU HD23 H 1 0.692 0.04 . 2 . . . A 76 LEU HD23 . 17750 1 397 . 1 1 52 52 LEU C C 13 174.406 0.40 . 1 . . . A 76 LEU C . 17750 1 398 . 1 1 52 52 LEU CA C 13 55.240 0.40 . 1 . . . A 76 LEU CA . 17750 1 399 . 1 1 52 52 LEU CB C 13 44.185 0.40 . 1 . . . A 76 LEU CB . 17750 1 400 . 1 1 52 52 LEU CG C 13 27.118 0.40 . 1 . . . A 76 LEU CG . 17750 1 401 . 1 1 52 52 LEU CD1 C 13 26.001 0.40 . 2 . . . A 76 LEU CD1 . 17750 1 402 . 1 1 52 52 LEU CD2 C 13 25.075 0.40 . 2 . . . A 76 LEU CD2 . 17750 1 403 . 1 1 52 52 LEU N N 15 122.414 0.40 . 1 . . . A 76 LEU N . 17750 1 404 . 1 1 53 53 ILE H H 1 7.915 0.04 . 1 . . . A 77 ILE H . 17750 1 405 . 1 1 53 53 ILE HA H 1 4.374 0.04 . 1 . . . A 77 ILE HA . 17750 1 406 . 1 1 53 53 ILE HB H 1 1.123 0.04 . 1 . . . A 77 ILE HB . 17750 1 407 . 1 1 53 53 ILE HG12 H 1 1.373 0.04 . 2 . . . A 77 ILE HG12 . 17750 1 408 . 1 1 53 53 ILE HG13 H 1 0.716 0.04 . 2 . . . A 77 ILE HG13 . 17750 1 409 . 1 1 53 53 ILE HG21 H 1 -0.185 0.04 . 1 . . . A 77 ILE HG21 . 17750 1 410 . 1 1 53 53 ILE HG22 H 1 -0.185 0.04 . 1 . . . A 77 ILE HG22 . 17750 1 411 . 1 1 53 53 ILE HG23 H 1 -0.185 0.04 . 1 . . . A 77 ILE HG23 . 17750 1 412 . 1 1 53 53 ILE HD11 H 1 0.706 0.04 . 1 . . . A 77 ILE HD11 . 17750 1 413 . 1 1 53 53 ILE HD12 H 1 0.706 0.04 . 1 . . . A 77 ILE HD12 . 17750 1 414 . 1 1 53 53 ILE HD13 H 1 0.706 0.04 . 1 . . . A 77 ILE HD13 . 17750 1 415 . 1 1 53 53 ILE C C 13 174.105 0.40 . 1 . . . A 77 ILE C . 17750 1 416 . 1 1 53 53 ILE CA C 13 60.044 0.40 . 1 . . . A 77 ILE CA . 17750 1 417 . 1 1 53 53 ILE CB C 13 40.057 0.40 . 1 . . . A 77 ILE CB . 17750 1 418 . 1 1 53 53 ILE CG1 C 13 27.514 0.40 . 1 . . . A 77 ILE CG1 . 17750 1 419 . 1 1 53 53 ILE CG2 C 13 18.660 0.40 . 1 . . . A 77 ILE CG2 . 17750 1 420 . 1 1 53 53 ILE CD1 C 13 13.267 0.40 . 1 . . . A 77 ILE CD1 . 17750 1 421 . 1 1 53 53 ILE N N 15 123.538 0.40 . 1 . . . A 77 ILE N . 17750 1 422 . 1 1 54 54 ILE H H 1 8.535 0.04 . 1 . . . A 78 ILE H . 17750 1 423 . 1 1 54 54 ILE HA H 1 4.721 0.04 . 1 . . . A 78 ILE HA . 17750 1 424 . 1 1 54 54 ILE HB H 1 1.869 0.04 . 1 . . . A 78 ILE HB . 17750 1 425 . 1 1 54 54 ILE HG12 H 1 0.820 0.04 . 2 . . . A 78 ILE HG12 . 17750 1 426 . 1 1 54 54 ILE HG13 H 1 0.255 0.04 . 2 . . . A 78 ILE HG13 . 17750 1 427 . 1 1 54 54 ILE HG21 H 1 0.720 0.04 . 1 . . . A 78 ILE HG21 . 17750 1 428 . 1 1 54 54 ILE HG22 H 1 0.720 0.04 . 1 . . . A 78 ILE HG22 . 17750 1 429 . 1 1 54 54 ILE HG23 H 1 0.720 0.04 . 1 . . . A 78 ILE HG23 . 17750 1 430 . 1 1 54 54 ILE HD11 H 1 -0.178 0.04 . 1 . . . A 78 ILE HD11 . 17750 1 431 . 1 1 54 54 ILE HD12 H 1 -0.178 0.04 . 1 . . . A 78 ILE HD12 . 17750 1 432 . 1 1 54 54 ILE HD13 H 1 -0.178 0.04 . 1 . . . A 78 ILE HD13 . 17750 1 433 . 1 1 54 54 ILE C C 13 174.556 0.40 . 1 . . . A 78 ILE C . 17750 1 434 . 1 1 54 54 ILE CA C 13 57.287 0.40 . 1 . . . A 78 ILE CA . 17750 1 435 . 1 1 54 54 ILE CB C 13 37.252 0.40 . 1 . . . A 78 ILE CB . 17750 1 436 . 1 1 54 54 ILE CG1 C 13 27.520 0.40 . 1 . . . A 78 ILE CG1 . 17750 1 437 . 1 1 54 54 ILE CG2 C 13 18.061 0.40 . 1 . . . A 78 ILE CG2 . 17750 1 438 . 1 1 54 54 ILE CD1 C 13 10.488 0.40 . 1 . . . A 78 ILE CD1 . 17750 1 439 . 1 1 54 54 ILE N N 15 126.500 0.40 . 1 . . . A 78 ILE N . 17750 1 440 . 1 1 55 55 PHE H H 1 8.996 0.04 . 1 . . . A 79 PHE H . 17750 1 441 . 1 1 55 55 PHE HA H 1 5.003 0.04 . 1 . . . A 79 PHE HA . 17750 1 442 . 1 1 55 55 PHE HB2 H 1 2.906 0.04 . 2 . . . A 79 PHE HB2 . 17750 1 443 . 1 1 55 55 PHE HB3 H 1 2.811 0.04 . 2 . . . A 79 PHE HB3 . 17750 1 444 . 1 1 55 55 PHE HD1 H 1 6.848 0.04 . 3 . . . A 79 PHE HD1 . 17750 1 445 . 1 1 55 55 PHE HD2 H 1 6.848 0.04 . 3 . . . A 79 PHE HD2 . 17750 1 446 . 1 1 55 55 PHE HE1 H 1 7.013 0.04 . 3 . . . A 79 PHE HE1 . 17750 1 447 . 1 1 55 55 PHE HE2 H 1 7.013 0.04 . 3 . . . A 79 PHE HE2 . 17750 1 448 . 1 1 55 55 PHE C C 13 176.235 0.40 . 1 . . . A 79 PHE C . 17750 1 449 . 1 1 55 55 PHE CA C 13 56.031 0.40 . 1 . . . A 79 PHE CA . 17750 1 450 . 1 1 55 55 PHE CB C 13 40.364 0.40 . 1 . . . A 79 PHE CB . 17750 1 451 . 1 1 55 55 PHE CD1 C 13 130.772 0.40 . 3 . . . A 79 PHE CD1 . 17750 1 452 . 1 1 55 55 PHE CD2 C 13 130.772 0.40 . 3 . . . A 79 PHE CD2 . 17750 1 453 . 1 1 55 55 PHE CE1 C 13 129.275 0.40 . 3 . . . A 79 PHE CE1 . 17750 1 454 . 1 1 55 55 PHE CE2 C 13 129.275 0.40 . 3 . . . A 79 PHE CE2 . 17750 1 455 . 1 1 55 55 PHE N N 15 124.457 0.40 . 1 . . . A 79 PHE N . 17750 1 456 . 1 1 56 56 TRP H H 1 8.747 0.04 . 1 . . . A 80 TRP H . 17750 1 457 . 1 1 56 56 TRP HA H 1 5.607 0.04 . 1 . . . A 80 TRP HA . 17750 1 458 . 1 1 56 56 TRP HB2 H 1 3.032 0.04 . 2 . . . A 80 TRP HB2 . 17750 1 459 . 1 1 56 56 TRP HB3 H 1 2.772 0.04 . 2 . . . A 80 TRP HB3 . 17750 1 460 . 1 1 56 56 TRP HD1 H 1 6.971 0.04 . 1 . . . A 80 TRP HD1 . 17750 1 461 . 1 1 56 56 TRP HE1 H 1 9.457 0.04 . 1 . . . A 80 TRP HE1 . 17750 1 462 . 1 1 56 56 TRP HE3 H 1 7.157 0.04 . 1 . . . A 80 TRP HE3 . 17750 1 463 . 1 1 56 56 TRP HZ2 H 1 7.605 0.04 . 1 . . . A 80 TRP HZ2 . 17750 1 464 . 1 1 56 56 TRP HZ3 H 1 6.665 0.04 . 1 . . . A 80 TRP HZ3 . 17750 1 465 . 1 1 56 56 TRP HH2 H 1 7.383 0.04 . 1 . . . A 80 TRP HH2 . 17750 1 466 . 1 1 56 56 TRP C C 13 174.610 0.40 . 1 . . . A 80 TRP C . 17750 1 467 . 1 1 56 56 TRP CA C 13 55.758 0.40 . 1 . . . A 80 TRP CA . 17750 1 468 . 1 1 56 56 TRP CB C 13 33.321 0.40 . 1 . . . A 80 TRP CB . 17750 1 469 . 1 1 56 56 TRP CD1 C 13 128.593 0.40 . 1 . . . A 80 TRP CD1 . 17750 1 470 . 1 1 56 56 TRP CE3 C 13 120.211 0.40 . 1 . . . A 80 TRP CE3 . 17750 1 471 . 1 1 56 56 TRP CZ2 C 13 114.211 0.40 . 1 . . . A 80 TRP CZ2 . 17750 1 472 . 1 1 56 56 TRP CZ3 C 13 121.711 0.40 . 1 . . . A 80 TRP CZ3 . 17750 1 473 . 1 1 56 56 TRP CH2 C 13 124.862 0.40 . 1 . . . A 80 TRP CH2 . 17750 1 474 . 1 1 56 56 TRP N N 15 120.984 0.40 . 1 . . . A 80 TRP N . 17750 1 475 . 1 1 56 56 TRP NE1 N 15 130.957 0.40 . 1 . . . A 80 TRP NE1 . 17750 1 476 . 1 1 57 57 ASP H H 1 8.163 0.04 . 1 . . . A 81 ASP H . 17750 1 477 . 1 1 57 57 ASP HA H 1 4.863 0.04 . 1 . . . A 81 ASP HA . 17750 1 478 . 1 1 57 57 ASP HB2 H 1 2.864 0.04 . 2 . . . A 81 ASP HB2 . 17750 1 479 . 1 1 57 57 ASP HB3 H 1 2.313 0.04 . 2 . . . A 81 ASP HB3 . 17750 1 480 . 1 1 57 57 ASP C C 13 174.365 0.40 . 1 . . . A 81 ASP C . 17750 1 481 . 1 1 57 57 ASP CA C 13 53.984 0.40 . 1 . . . A 81 ASP CA . 17750 1 482 . 1 1 57 57 ASP CB C 13 40.895 0.40 . 1 . . . A 81 ASP CB . 17750 1 483 . 1 1 57 57 ASP N N 15 121.716 0.40 . 1 . . . A 81 ASP N . 17750 1 484 . 1 1 58 58 ILE H H 1 9.281 0.04 . 1 . . . A 82 ILE H . 17750 1 485 . 1 1 58 58 ILE HA H 1 4.244 0.04 . 1 . . . A 82 ILE HA . 17750 1 486 . 1 1 58 58 ILE HB H 1 1.984 0.04 . 1 . . . A 82 ILE HB . 17750 1 487 . 1 1 58 58 ILE HG12 H 1 0.071 0.04 . 2 . . . A 82 ILE HG12 . 17750 1 488 . 1 1 58 58 ILE HG13 H 1 1.334 0.04 . 2 . . . A 82 ILE HG13 . 17750 1 489 . 1 1 58 58 ILE HG21 H 1 0.635 0.04 . 1 . . . A 82 ILE HG21 . 17750 1 490 . 1 1 58 58 ILE HG22 H 1 0.635 0.04 . 1 . . . A 82 ILE HG22 . 17750 1 491 . 1 1 58 58 ILE HG23 H 1 0.635 0.04 . 1 . . . A 82 ILE HG23 . 17750 1 492 . 1 1 58 58 ILE HD11 H 1 -0.151 0.04 . 1 . . . A 82 ILE HD11 . 17750 1 493 . 1 1 58 58 ILE HD12 H 1 -0.151 0.04 . 1 . . . A 82 ILE HD12 . 17750 1 494 . 1 1 58 58 ILE HD13 H 1 -0.151 0.04 . 1 . . . A 82 ILE HD13 . 17750 1 495 . 1 1 58 58 ILE C C 13 176.958 0.40 . 1 . . . A 82 ILE C . 17750 1 496 . 1 1 58 58 ILE CA C 13 57.287 0.40 . 1 . . . A 82 ILE CA . 17750 1 497 . 1 1 58 58 ILE CB C 13 36.652 0.40 . 1 . . . A 82 ILE CB . 17750 1 498 . 1 1 58 58 ILE CG1 C 13 26.165 0.40 . 1 . . . A 82 ILE CG1 . 17750 1 499 . 1 1 58 58 ILE CG2 C 13 16.971 0.40 . 1 . . . A 82 ILE CG2 . 17750 1 500 . 1 1 58 58 ILE CD1 C 13 8.091 0.40 . 1 . . . A 82 ILE CD1 . 17750 1 501 . 1 1 58 58 ILE N N 15 124.764 0.40 . 1 . . . A 82 ILE N . 17750 1 502 . 1 1 59 59 LYS H H 1 9.283 0.04 . 1 . . . A 83 LYS H . 17750 1 503 . 1 1 59 59 LYS HA H 1 4.136 0.04 . 1 . . . A 83 LYS HA . 17750 1 504 . 1 1 59 59 LYS HB2 H 1 1.760 0.04 . 2 . . . A 83 LYS HB2 . 17750 1 505 . 1 1 59 59 LYS HB3 H 1 1.523 0.04 . 2 . . . A 83 LYS HB3 . 17750 1 506 . 1 1 59 59 LYS HG2 H 1 1.193 0.04 . 2 . . . A 83 LYS HG2 . 17750 1 507 . 1 1 59 59 LYS HG3 H 1 1.053 0.04 . 2 . . . A 83 LYS HG3 . 17750 1 508 . 1 1 59 59 LYS HD2 H 1 1.304 0.04 . 2 . . . A 83 LYS HD2 . 17750 1 509 . 1 1 59 59 LYS HD3 H 1 1.179 0.04 . 2 . . . A 83 LYS HD3 . 17750 1 510 . 1 1 59 59 LYS HE2 H 1 2.634 0.04 . 2 . . . A 83 LYS HE2 . 17750 1 511 . 1 1 59 59 LYS HE3 H 1 2.458 0.04 . 2 . . . A 83 LYS HE3 . 17750 1 512 . 1 1 59 59 LYS C C 13 178.009 0.40 . 1 . . . A 83 LYS C . 17750 1 513 . 1 1 59 59 LYS CA C 13 54.967 0.40 . 1 . . . A 83 LYS CA . 17750 1 514 . 1 1 59 59 LYS CB C 13 31.574 0.40 . 1 . . . A 83 LYS CB . 17750 1 515 . 1 1 59 59 LYS CG C 13 24.646 0.40 . 1 . . . A 83 LYS CG . 17750 1 516 . 1 1 59 59 LYS CD C 13 27.064 0.40 . 1 . . . A 83 LYS CD . 17750 1 517 . 1 1 59 59 LYS CE C 13 42.481 0.40 . 1 . . . A 83 LYS CE . 17750 1 518 . 1 1 59 59 LYS N N 15 126.160 0.40 . 1 . . . A 83 LYS N . 17750 1 519 . 1 1 60 60 GLU H H 1 6.959 0.04 . 1 . . . A 84 GLU H . 17750 1 520 . 1 1 60 60 GLU HA H 1 4.107 0.04 . 1 . . . A 84 GLU HA . 17750 1 521 . 1 1 60 60 GLU HB2 H 1 1.883 0.04 . 2 . . . A 84 GLU HB2 . 17750 1 522 . 1 1 60 60 GLU HB3 H 1 1.488 0.04 . 2 . . . A 84 GLU HB3 . 17750 1 523 . 1 1 60 60 GLU HG2 H 1 2.309 0.04 . 2 . . . A 84 GLU HG2 . 17750 1 524 . 1 1 60 60 GLU HG3 H 1 1.981 0.04 . 2 . . . A 84 GLU HG3 . 17750 1 525 . 1 1 60 60 GLU C C 13 173.164 0.40 . 1 . . . A 84 GLU C . 17750 1 526 . 1 1 60 60 GLU CA C 13 57.069 0.40 . 1 . . . A 84 GLU CA . 17750 1 527 . 1 1 60 60 GLU CB C 13 29.445 0.40 . 1 . . . A 84 GLU CB . 17750 1 528 . 1 1 60 60 GLU CG C 13 37.244 0.40 . 1 . . . A 84 GLU CG . 17750 1 529 . 1 1 60 60 GLU N N 15 118.277 0.40 . 1 . . . A 84 GLU N . 17750 1 530 . 1 1 61 61 GLU H H 1 7.856 0.04 . 1 . . . A 85 GLU H . 17750 1 531 . 1 1 61 61 GLU HA H 1 4.111 0.04 . 1 . . . A 85 GLU HA . 17750 1 532 . 1 1 61 61 GLU HB2 H 1 1.883 0.04 . 2 . . . A 85 GLU HB2 . 17750 1 533 . 1 1 61 61 GLU HB3 H 1 1.698 0.04 . 2 . . . A 85 GLU HB3 . 17750 1 534 . 1 1 61 61 GLU HG2 H 1 2.162 0.04 . 2 . . . A 85 GLU HG2 . 17750 1 535 . 1 1 61 61 GLU HG3 H 1 2.162 0.04 . 2 . . . A 85 GLU HG3 . 17750 1 536 . 1 1 61 61 GLU C C 13 176.753 0.40 . 1 . . . A 85 GLU C . 17750 1 537 . 1 1 61 61 GLU CA C 13 57.533 0.40 . 1 . . . A 85 GLU CA . 17750 1 538 . 1 1 61 61 GLU CB C 13 29.882 0.40 . 1 . . . A 85 GLU CB . 17750 1 539 . 1 1 61 61 GLU CG C 13 36.244 0.40 . 1 . . . A 85 GLU CG . 17750 1 540 . 1 1 61 61 GLU N N 15 116.677 0.40 . 1 . . . A 85 GLU N . 17750 1 541 . 1 1 62 62 VAL H H 1 8.211 0.04 . 1 . . . A 86 VAL H . 17750 1 542 . 1 1 62 62 VAL HA H 1 4.817 0.04 . 1 . . . A 86 VAL HA . 17750 1 543 . 1 1 62 62 VAL HB H 1 1.849 0.04 . 1 . . . A 86 VAL HB . 17750 1 544 . 1 1 62 62 VAL HG11 H 1 0.844 0.04 . 2 . . . A 86 VAL HG11 . 17750 1 545 . 1 1 62 62 VAL HG12 H 1 0.844 0.04 . 2 . . . A 86 VAL HG12 . 17750 1 546 . 1 1 62 62 VAL HG13 H 1 0.844 0.04 . 2 . . . A 86 VAL HG13 . 17750 1 547 . 1 1 62 62 VAL HG21 H 1 0.500 0.04 . 2 . . . A 86 VAL HG21 . 17750 1 548 . 1 1 62 62 VAL HG22 H 1 0.500 0.04 . 2 . . . A 86 VAL HG22 . 17750 1 549 . 1 1 62 62 VAL HG23 H 1 0.500 0.04 . 2 . . . A 86 VAL HG23 . 17750 1 550 . 1 1 62 62 VAL CA C 13 59.507 0.40 . 1 . . . A 86 VAL CA . 17750 1 551 . 1 1 62 62 VAL CB C 13 36.257 0.40 . 1 . . . A 86 VAL CB . 17750 1 552 . 1 1 62 62 VAL CG1 C 13 22.065 0.40 . 2 . . . A 86 VAL CG1 . 17750 1 553 . 1 1 62 62 VAL CG2 C 13 18.796 0.40 . 2 . . . A 86 VAL CG2 . 17750 1 554 . 1 1 62 62 VAL N N 15 114.719 0.40 . 1 . . . A 86 VAL N . 17750 1 555 . 1 1 63 63 ASP HA H 1 5.290 0.04 . 1 . . . A 87 ASP HA . 17750 1 556 . 1 1 63 63 ASP HB2 H 1 2.570 0.04 . 2 . . . A 87 ASP HB2 . 17750 1 557 . 1 1 63 63 ASP HB3 H 1 2.633 0.04 . 2 . . . A 87 ASP HB3 . 17750 1 558 . 1 1 63 63 ASP CA C 13 52.833 0.40 . 1 . . . A 87 ASP CA . 17750 1 559 . 1 1 63 63 ASP CB C 13 47.112 0.40 . 1 . . . A 87 ASP CB . 17750 1 560 . 1 1 64 64 PRO HA H 1 4.022 0.04 . 1 . . . A 88 PRO HA . 17750 1 561 . 1 1 64 64 PRO HB2 H 1 2.317 0.04 . 2 . . . A 88 PRO HB2 . 17750 1 562 . 1 1 64 64 PRO HB3 H 1 1.835 0.04 . 2 . . . A 88 PRO HB3 . 17750 1 563 . 1 1 64 64 PRO HG2 H 1 2.039 0.04 . 2 . . . A 88 PRO HG2 . 17750 1 564 . 1 1 64 64 PRO HG3 H 1 1.997 0.04 . 2 . . . A 88 PRO HG3 . 17750 1 565 . 1 1 64 64 PRO HD2 H 1 3.598 0.04 . 2 . . . A 88 PRO HD2 . 17750 1 566 . 1 1 64 64 PRO HD3 H 1 3.996 0.04 . 2 . . . A 88 PRO HD3 . 17750 1 567 . 1 1 64 64 PRO C C 13 176.890 0.40 . 1 . . . A 88 PRO C . 17750 1 568 . 1 1 64 64 PRO CA C 13 64.739 0.40 . 1 . . . A 88 PRO CA . 17750 1 569 . 1 1 64 64 PRO CB C 13 32.025 0.40 . 1 . . . A 88 PRO CB . 17750 1 570 . 1 1 64 64 PRO CG C 13 27.936 0.40 . 1 . . . A 88 PRO CG . 17750 1 571 . 1 1 64 64 PRO CD C 13 51.532 0.40 . 1 . . . A 88 PRO CD . 17750 1 572 . 1 1 65 65 SER H H 1 9.007 0.04 . 1 . . . A 89 SER H . 17750 1 573 . 1 1 65 65 SER HA H 1 4.403 0.04 . 1 . . . A 89 SER HA . 17750 1 574 . 1 1 65 65 SER HB2 H 1 3.937 0.04 . 2 . . . A 89 SER HB2 . 17750 1 575 . 1 1 65 65 SER HB3 H 1 3.684 0.04 . 2 . . . A 89 SER HB3 . 17750 1 576 . 1 1 65 65 SER C C 13 173.737 0.40 . 1 . . . A 89 SER C . 17750 1 577 . 1 1 65 65 SER CA C 13 59.579 0.40 . 1 . . . A 89 SER CA . 17750 1 578 . 1 1 65 65 SER CB C 13 63.783 0.40 . 1 . . . A 89 SER CB . 17750 1 579 . 1 1 65 65 SER N N 15 113.595 0.40 . 1 . . . A 89 SER N . 17750 1 580 . 1 1 66 66 ASP H H 1 8.068 0.04 . 1 . . . A 90 ASP H . 17750 1 581 . 1 1 66 66 ASP HA H 1 4.489 0.04 . 1 . . . A 90 ASP HA . 17750 1 582 . 1 1 66 66 ASP HB2 H 1 2.587 0.04 . 2 . . . A 90 ASP HB2 . 17750 1 583 . 1 1 66 66 ASP HB3 H 1 2.352 0.04 . 2 . . . A 90 ASP HB3 . 17750 1 584 . 1 1 66 66 ASP C C 13 173.600 0.40 . 1 . . . A 90 ASP C . 17750 1 585 . 1 1 66 66 ASP CA C 13 55.486 0.40 . 1 . . . A 90 ASP CA . 17750 1 586 . 1 1 66 66 ASP CB C 13 40.542 0.40 . 1 . . . A 90 ASP CB . 17750 1 587 . 1 1 66 66 ASP N N 15 125.513 0.40 . 1 . . . A 90 ASP N . 17750 1 588 . 1 1 67 67 TRP H H 1 7.703 0.04 . 1 . . . A 91 TRP H . 17750 1 589 . 1 1 67 67 TRP HA H 1 4.837 0.04 . 1 . . . A 91 TRP HA . 17750 1 590 . 1 1 67 67 TRP HB2 H 1 3.050 0.04 . 2 . . . A 91 TRP HB2 . 17750 1 591 . 1 1 67 67 TRP HB3 H 1 2.899 0.04 . 2 . . . A 91 TRP HB3 . 17750 1 592 . 1 1 67 67 TRP HD1 H 1 6.978 0.04 . 1 . . . A 91 TRP HD1 . 17750 1 593 . 1 1 67 67 TRP HZ2 H 1 6.912 0.04 . 1 . . . A 91 TRP HZ2 . 17750 1 594 . 1 1 67 67 TRP HH2 H 1 7.216 0.04 . 1 . . . A 91 TRP HH2 . 17750 1 595 . 1 1 67 67 TRP C C 13 171.976 0.40 . 1 . . . A 91 TRP C . 17750 1 596 . 1 1 67 67 TRP CA C 13 54.612 0.40 . 1 . . . A 91 TRP CA . 17750 1 597 . 1 1 67 67 TRP CB C 13 30.919 0.40 . 1 . . . A 91 TRP CB . 17750 1 598 . 1 1 67 67 TRP CD1 C 13 128.610 0.40 . 1 . . . A 91 TRP CD1 . 17750 1 599 . 1 1 67 67 TRP CZ2 C 13 113.170 0.40 . 1 . . . A 91 TRP CZ2 . 17750 1 600 . 1 1 67 67 TRP CH2 C 13 124.262 0.40 . 1 . . . A 91 TRP CH2 . 17750 1 601 . 1 1 67 67 TRP N N 15 114.157 0.40 . 1 . . . A 91 TRP N . 17750 1 602 . 1 1 68 68 ILE H H 1 8.384 0.04 . 1 . . . A 92 ILE H . 17750 1 603 . 1 1 68 68 ILE HA H 1 5.327 0.04 . 1 . . . A 92 ILE HA . 17750 1 604 . 1 1 68 68 ILE HB H 1 1.550 0.04 . 1 . . . A 92 ILE HB . 17750 1 605 . 1 1 68 68 ILE HG12 H 1 1.245 0.04 . 2 . . . A 92 ILE HG12 . 17750 1 606 . 1 1 68 68 ILE HG13 H 1 0.627 0.04 . 2 . . . A 92 ILE HG13 . 17750 1 607 . 1 1 68 68 ILE HG21 H 1 1.060 0.04 . 1 . . . A 92 ILE HG21 . 17750 1 608 . 1 1 68 68 ILE HG22 H 1 1.060 0.04 . 1 . . . A 92 ILE HG22 . 17750 1 609 . 1 1 68 68 ILE HG23 H 1 1.060 0.04 . 1 . . . A 92 ILE HG23 . 17750 1 610 . 1 1 68 68 ILE HD11 H 1 0.805 0.04 . 1 . . . A 92 ILE HD11 . 17750 1 611 . 1 1 68 68 ILE HD12 H 1 0.805 0.04 . 1 . . . A 92 ILE HD12 . 17750 1 612 . 1 1 68 68 ILE HD13 H 1 0.805 0.04 . 1 . . . A 92 ILE HD13 . 17750 1 613 . 1 1 68 68 ILE C C 13 175.907 0.40 . 1 . . . A 92 ILE C . 17750 1 614 . 1 1 68 68 ILE CA C 13 58.407 0.40 . 1 . . . A 92 ILE CA . 17750 1 615 . 1 1 68 68 ILE CB C 13 42.890 0.40 . 1 . . . A 92 ILE CB . 17750 1 616 . 1 1 68 68 ILE CG1 C 13 28.943 0.40 . 1 . . . A 92 ILE CG1 . 17750 1 617 . 1 1 68 68 ILE CG2 C 13 20.022 0.40 . 1 . . . A 92 ILE CG2 . 17750 1 618 . 1 1 68 68 ILE CD1 C 13 15.473 0.40 . 1 . . . A 92 ILE CD1 . 17750 1 619 . 1 1 68 68 ILE N N 15 116.166 0.40 . 1 . . . A 92 ILE N . 17750 1 620 . 1 1 69 69 GLY H H 1 9.243 0.04 . 1 . . . A 93 GLY H . 17750 1 621 . 1 1 69 69 GLY HA2 H 1 5.212 0.04 . 2 . . . A 93 GLY HA2 . 17750 1 622 . 1 1 69 69 GLY HA3 H 1 3.746 0.04 . 2 . . . A 93 GLY HA3 . 17750 1 623 . 1 1 69 69 GLY C C 13 169.953 0.40 . 1 . . . A 93 GLY C . 17750 1 624 . 1 1 69 69 GLY CA C 13 43.596 0.40 . 1 . . . A 93 GLY CA . 17750 1 625 . 1 1 69 69 GLY N N 15 112.812 0.40 . 1 . . . A 93 GLY N . 17750 1 626 . 1 1 70 70 LEU H H 1 8.265 0.04 . 1 . . . A 94 LEU H . 17750 1 627 . 1 1 70 70 LEU HA H 1 3.912 0.04 . 1 . . . A 94 LEU HA . 17750 1 628 . 1 1 70 70 LEU HB2 H 1 0.992 0.04 . 2 . . . A 94 LEU HB2 . 17750 1 629 . 1 1 70 70 LEU HB3 H 1 1.478 0.04 . 2 . . . A 94 LEU HB3 . 17750 1 630 . 1 1 70 70 LEU HG H 1 0.398 0.04 . 1 . . . A 94 LEU HG . 17750 1 631 . 1 1 70 70 LEU HD11 H 1 0.568 0.04 . 2 . . . A 94 LEU HD11 . 17750 1 632 . 1 1 70 70 LEU HD12 H 1 0.568 0.04 . 2 . . . A 94 LEU HD12 . 17750 1 633 . 1 1 70 70 LEU HD13 H 1 0.568 0.04 . 2 . . . A 94 LEU HD13 . 17750 1 634 . 1 1 70 70 LEU HD21 H 1 0.778 0.04 . 2 . . . A 94 LEU HD21 . 17750 1 635 . 1 1 70 70 LEU HD22 H 1 0.778 0.04 . 2 . . . A 94 LEU HD22 . 17750 1 636 . 1 1 70 70 LEU HD23 H 1 0.778 0.04 . 2 . . . A 94 LEU HD23 . 17750 1 637 . 1 1 70 70 LEU C C 13 174.801 0.40 . 1 . . . A 94 LEU C . 17750 1 638 . 1 1 70 70 LEU CA C 13 55.076 0.40 . 1 . . . A 94 LEU CA . 17750 1 639 . 1 1 70 70 LEU CB C 13 44.879 0.40 . 1 . . . A 94 LEU CB . 17750 1 640 . 1 1 70 70 LEU CG C 13 27.336 0.40 . 1 . . . A 94 LEU CG . 17750 1 641 . 1 1 70 70 LEU CD1 C 13 27.854 0.40 . 2 . . . A 94 LEU CD1 . 17750 1 642 . 1 1 70 70 LEU CD2 C 13 24.912 0.40 . 2 . . . A 94 LEU CD2 . 17750 1 643 . 1 1 70 70 LEU N N 15 126.058 0.40 . 1 . . . A 94 LEU N . 17750 1 644 . 1 1 71 71 TYR H H 1 8.876 0.04 . 1 . . . A 95 TYR H . 17750 1 645 . 1 1 71 71 TYR HA H 1 4.185 0.04 . 1 . . . A 95 TYR HA . 17750 1 646 . 1 1 71 71 TYR HB2 H 1 2.863 0.04 . 2 . . . A 95 TYR HB2 . 17750 1 647 . 1 1 71 71 TYR HB3 H 1 2.187 0.04 . 2 . . . A 95 TYR HB3 . 17750 1 648 . 1 1 71 71 TYR C C 13 174.692 0.40 . 1 . . . A 95 TYR C . 17750 1 649 . 1 1 71 71 TYR CA C 13 56.194 0.40 . 1 . . . A 95 TYR CA . 17750 1 650 . 1 1 71 71 TYR CB C 13 42.468 0.40 . 1 . . . A 95 TYR CB . 17750 1 651 . 1 1 71 71 TYR N N 15 124.083 0.40 . 1 . . . A 95 TYR N . 17750 1 652 . 1 1 72 72 HIS H H 1 7.508 0.04 . 1 . . . A 96 HIS H . 17750 1 653 . 1 1 72 72 HIS HA H 1 3.801 0.04 . 1 . . . A 96 HIS HA . 17750 1 654 . 1 1 72 72 HIS HD2 H 1 6.498 0.04 . 1 . . . A 96 HIS HD2 . 17750 1 655 . 1 1 72 72 HIS C C 13 178.009 0.40 . 1 . . . A 96 HIS C . 17750 1 656 . 1 1 72 72 HIS CA C 13 58.460 0.40 . 1 . . . A 96 HIS CA . 17750 1 657 . 1 1 72 72 HIS CD2 C 13 121.312 0.40 . 1 . . . A 96 HIS CD2 . 17750 1 658 . 1 1 72 72 HIS N N 15 120.116 0.40 . 1 . . . A 96 HIS N . 17750 1 659 . 1 1 73 73 ILE H H 1 7.171 0.04 . 1 . . . A 97 ILE H . 17750 1 660 . 1 1 73 73 ILE HA H 1 3.770 0.04 . 1 . . . A 97 ILE HA . 17750 1 661 . 1 1 73 73 ILE HB H 1 1.132 0.04 . 1 . . . A 97 ILE HB . 17750 1 662 . 1 1 73 73 ILE HG12 H 1 1.143 0.04 . 2 . . . A 97 ILE HG12 . 17750 1 663 . 1 1 73 73 ILE HG13 H 1 1.032 0.04 . 2 . . . A 97 ILE HG13 . 17750 1 664 . 1 1 73 73 ILE HG21 H 1 0.451 0.04 . 1 . . . A 97 ILE HG21 . 17750 1 665 . 1 1 73 73 ILE HG22 H 1 0.451 0.04 . 1 . . . A 97 ILE HG22 . 17750 1 666 . 1 1 73 73 ILE HG23 H 1 0.451 0.04 . 1 . . . A 97 ILE HG23 . 17750 1 667 . 1 1 73 73 ILE HD11 H 1 0.729 0.04 . 1 . . . A 97 ILE HD11 . 17750 1 668 . 1 1 73 73 ILE HD12 H 1 0.729 0.04 . 1 . . . A 97 ILE HD12 . 17750 1 669 . 1 1 73 73 ILE HD13 H 1 0.729 0.04 . 1 . . . A 97 ILE HD13 . 17750 1 670 . 1 1 73 73 ILE CA C 13 61.781 0.40 . 1 . . . A 97 ILE CA . 17750 1 671 . 1 1 73 73 ILE CB C 13 38.995 0.40 . 1 . . . A 97 ILE CB . 17750 1 672 . 1 1 73 73 ILE CG1 C 13 27.445 0.40 . 1 . . . A 97 ILE CG1 . 17750 1 673 . 1 1 73 73 ILE CG2 C 13 18.796 0.40 . 1 . . . A 97 ILE CG2 . 17750 1 674 . 1 1 73 73 ILE CD1 C 13 14.193 0.40 . 1 . . . A 97 ILE CD1 . 17750 1 675 . 1 1 73 73 ILE N N 15 125.530 0.40 . 1 . . . A 97 ILE N . 17750 1 676 . 1 1 74 74 ASP HA H 1 4.674 0.04 . 1 . . . A 98 ASP HA . 17750 1 677 . 1 1 74 74 ASP HB2 H 1 2.797 0.04 . 2 . . . A 98 ASP HB2 . 17750 1 678 . 1 1 74 74 ASP HB3 H 1 2.586 0.04 . 2 . . . A 98 ASP HB3 . 17750 1 679 . 1 1 74 74 ASP C C 13 175.948 0.40 . 1 . . . A 98 ASP C . 17750 1 680 . 1 1 74 74 ASP CA C 13 54.339 0.40 . 1 . . . A 98 ASP CA . 17750 1 681 . 1 1 74 74 ASP CB C 13 41.401 0.40 . 1 . . . A 98 ASP CB . 17750 1 682 . 1 1 75 75 GLU H H 1 7.625 0.04 . 1 . . . A 99 GLU H . 17750 1 683 . 1 1 75 75 GLU HA H 1 4.053 0.04 . 1 . . . A 99 GLU HA . 17750 1 684 . 1 1 75 75 GLU HB2 H 1 2.149 0.04 . 2 . . . A 99 GLU HB2 . 17750 1 685 . 1 1 75 75 GLU HB3 H 1 1.971 0.04 . 2 . . . A 99 GLU HB3 . 17750 1 686 . 1 1 75 75 GLU C C 13 175.020 0.40 . 1 . . . A 99 GLU C . 17750 1 687 . 1 1 75 75 GLU CA C 13 56.141 0.40 . 1 . . . A 99 GLU CA . 17750 1 688 . 1 1 75 75 GLU CB C 13 31.356 0.40 . 1 . . . A 99 GLU CB . 17750 1 689 . 1 1 75 75 GLU N N 15 121.872 0.40 . 1 . . . A 99 GLU N . 17750 1 690 . 1 1 76 76 ASN H H 1 8.306 0.04 . 1 . . . A 100 ASN H . 17750 1 691 . 1 1 76 76 ASN HA H 1 4.558 0.04 . 1 . . . A 100 ASN HA . 17750 1 692 . 1 1 76 76 ASN HB2 H 1 2.681 0.04 . 2 . . . A 100 ASN HB2 . 17750 1 693 . 1 1 76 76 ASN HB3 H 1 2.572 0.04 . 2 . . . A 100 ASN HB3 . 17750 1 694 . 1 1 76 76 ASN HD21 H 1 6.806 0.04 . 2 . . . A 100 ASN HD21 . 17750 1 695 . 1 1 76 76 ASN HD22 H 1 7.353 0.04 . 2 . . . A 100 ASN HD22 . 17750 1 696 . 1 1 76 76 ASN C C 13 175.975 0.40 . 1 . . . A 100 ASN C . 17750 1 697 . 1 1 76 76 ASN CA C 13 53.138 0.40 . 1 . . . A 100 ASN CA . 17750 1 698 . 1 1 76 76 ASN CB C 13 40.527 0.40 . 1 . . . A 100 ASN CB . 17750 1 699 . 1 1 76 76 ASN N N 15 123.708 0.40 . 1 . . . A 100 ASN N . 17750 1 700 . 1 1 76 76 ASN ND2 N 15 113.770 0.40 . 1 . . . A 100 ASN ND2 . 17750 1 701 . 1 1 77 77 SER H H 1 9.536 0.04 . 1 . . . A 101 SER H . 17750 1 702 . 1 1 77 77 SER HA H 1 4.898 0.04 . 1 . . . A 101 SER HA . 17750 1 703 . 1 1 77 77 SER HB2 H 1 3.864 0.04 . 2 . . . A 101 SER HB2 . 17750 1 704 . 1 1 77 77 SER HB3 H 1 3.864 0.04 . 2 . . . A 101 SER HB3 . 17750 1 705 . 1 1 77 77 SER CA C 13 55.448 0.40 . 1 . . . A 101 SER CA . 17750 1 706 . 1 1 77 77 SER CB C 13 63.538 0.40 . 1 . . . A 101 SER CB . 17750 1 707 . 1 1 77 77 SER N N 15 120.218 0.40 . 1 . . . A 101 SER N . 17750 1 708 . 1 1 78 78 PRO HA H 1 4.142 0.04 . 1 . . . A 102 PRO HA . 17750 1 709 . 1 1 78 78 PRO HB2 H 1 1.814 0.04 . 2 . . . A 102 PRO HB2 . 17750 1 710 . 1 1 78 78 PRO HB3 H 1 1.814 0.04 . 2 . . . A 102 PRO HB3 . 17750 1 711 . 1 1 78 78 PRO HG2 H 1 2.061 0.04 . 2 . . . A 102 PRO HG2 . 17750 1 712 . 1 1 78 78 PRO HG3 H 1 1.994 0.04 . 2 . . . A 102 PRO HG3 . 17750 1 713 . 1 1 78 78 PRO HD2 H 1 3.872 0.04 . 2 . . . A 102 PRO HD2 . 17750 1 714 . 1 1 78 78 PRO HD3 H 1 4.127 0.04 . 2 . . . A 102 PRO HD3 . 17750 1 715 . 1 1 78 78 PRO C C 13 178.664 0.40 . 1 . . . A 102 PRO C . 17750 1 716 . 1 1 78 78 PRO CA C 13 64.793 0.40 . 1 . . . A 102 PRO CA . 17750 1 717 . 1 1 78 78 PRO CB C 13 32.011 0.40 . 1 . . . A 102 PRO CB . 17750 1 718 . 1 1 78 78 PRO CG C 13 27.418 0.40 . 1 . . . A 102 PRO CG . 17750 1 719 . 1 1 78 78 PRO CD C 13 51.287 0.40 . 1 . . . A 102 PRO CD . 17750 1 720 . 1 1 79 79 ALA H H 1 7.738 0.04 . 1 . . . A 103 ALA H . 17750 1 721 . 1 1 79 79 ALA HA H 1 4.263 0.04 . 1 . . . A 103 ALA HA . 17750 1 722 . 1 1 79 79 ALA HB1 H 1 1.242 0.04 . 1 . . . A 103 ALA HB1 . 17750 1 723 . 1 1 79 79 ALA HB2 H 1 1.242 0.04 . 1 . . . A 103 ALA HB2 . 17750 1 724 . 1 1 79 79 ALA HB3 H 1 1.242 0.04 . 1 . . . A 103 ALA HB3 . 17750 1 725 . 1 1 79 79 ALA C C 13 178.159 0.40 . 1 . . . A 103 ALA C . 17750 1 726 . 1 1 79 79 ALA CA C 13 53.384 0.40 . 1 . . . A 103 ALA CA . 17750 1 727 . 1 1 79 79 ALA CB C 13 18.582 0.40 . 1 . . . A 103 ALA CB . 17750 1 728 . 1 1 79 79 ALA N N 15 115.911 0.40 . 1 . . . A 103 ALA N . 17750 1 729 . 1 1 80 80 ASN H H 1 7.430 0.04 . 1 . . . A 104 ASN H . 17750 1 730 . 1 1 80 80 ASN HA H 1 4.783 0.04 . 1 . . . A 104 ASN HA . 17750 1 731 . 1 1 80 80 ASN HB2 H 1 3.114 0.04 . 2 . . . A 104 ASN HB2 . 17750 1 732 . 1 1 80 80 ASN HB3 H 1 2.552 0.04 . 2 . . . A 104 ASN HB3 . 17750 1 733 . 1 1 80 80 ASN HD21 H 1 6.812 0.04 . 2 . . . A 104 ASN HD21 . 17750 1 734 . 1 1 80 80 ASN HD22 H 1 7.400 0.04 . 2 . . . A 104 ASN HD22 . 17750 1 735 . 1 1 80 80 ASN C C 13 173.860 0.40 . 1 . . . A 104 ASN C . 17750 1 736 . 1 1 80 80 ASN CA C 13 51.828 0.40 . 1 . . . A 104 ASN CA . 17750 1 737 . 1 1 80 80 ASN CB C 13 36.515 0.40 . 1 . . . A 104 ASN CB . 17750 1 738 . 1 1 80 80 ASN N N 15 118.345 0.40 . 1 . . . A 104 ASN N . 17750 1 739 . 1 1 80 80 ASN ND2 N 15 110.377 0.40 . 1 . . . A 104 ASN ND2 . 17750 1 740 . 1 1 81 81 PHE H H 1 6.370 0.04 . 1 . . . A 105 PHE H . 17750 1 741 . 1 1 81 81 PHE HA H 1 3.677 0.04 . 1 . . . A 105 PHE HA . 17750 1 742 . 1 1 81 81 PHE HB2 H 1 3.065 0.04 . 2 . . . A 105 PHE HB2 . 17750 1 743 . 1 1 81 81 PHE HB3 H 1 2.544 0.04 . 2 . . . A 105 PHE HB3 . 17750 1 744 . 1 1 81 81 PHE HD1 H 1 7.134 0.04 . 3 . . . A 105 PHE HD1 . 17750 1 745 . 1 1 81 81 PHE HD2 H 1 7.134 0.04 . 3 . . . A 105 PHE HD2 . 17750 1 746 . 1 1 81 81 PHE HE1 H 1 7.245 0.04 . 3 . . . A 105 PHE HE1 . 17750 1 747 . 1 1 81 81 PHE HE2 H 1 7.245 0.04 . 3 . . . A 105 PHE HE2 . 17750 1 748 . 1 1 81 81 PHE C C 13 176.084 0.40 . 1 . . . A 105 PHE C . 17750 1 749 . 1 1 81 81 PHE CA C 13 55.785 0.40 . 1 . . . A 105 PHE CA . 17750 1 750 . 1 1 81 81 PHE CB C 13 37.769 0.40 . 1 . . . A 105 PHE CB . 17750 1 751 . 1 1 81 81 PHE CD1 C 13 131.726 0.40 . 3 . . . A 105 PHE CD1 . 17750 1 752 . 1 1 81 81 PHE CD2 C 13 131.726 0.40 . 3 . . . A 105 PHE CD2 . 17750 1 753 . 1 1 81 81 PHE CE1 C 13 131.580 0.40 . 3 . . . A 105 PHE CE1 . 17750 1 754 . 1 1 81 81 PHE CE2 C 13 131.508 0.40 . 3 . . . A 105 PHE CE2 . 17750 1 755 . 1 1 81 81 PHE N N 15 114.361 0.40 . 1 . . . A 105 PHE N . 17750 1 756 . 1 1 82 82 TRP H H 1 9.017 0.04 . 1 . . . A 106 TRP H . 17750 1 757 . 1 1 82 82 TRP HA H 1 4.708 0.04 . 1 . . . A 106 TRP HA . 17750 1 758 . 1 1 82 82 TRP HB2 H 1 2.712 0.04 . 2 . . . A 106 TRP HB2 . 17750 1 759 . 1 1 82 82 TRP HB3 H 1 2.555 0.04 . 2 . . . A 106 TRP HB3 . 17750 1 760 . 1 1 82 82 TRP HD1 H 1 6.266 0.04 . 1 . . . A 106 TRP HD1 . 17750 1 761 . 1 1 82 82 TRP HE1 H 1 9.517 0.04 . 1 . . . A 106 TRP HE1 . 17750 1 762 . 1 1 82 82 TRP HE3 H 1 7.148 0.04 . 1 . . . A 106 TRP HE3 . 17750 1 763 . 1 1 82 82 TRP HZ2 H 1 7.234 0.04 . 1 . . . A 106 TRP HZ2 . 17750 1 764 . 1 1 82 82 TRP HH2 H 1 7.022 0.04 . 1 . . . A 106 TRP HH2 . 17750 1 765 . 1 1 82 82 TRP C C 13 176.139 0.40 . 1 . . . A 106 TRP C . 17750 1 766 . 1 1 82 82 TRP CA C 13 54.994 0.40 . 1 . . . A 106 TRP CA . 17750 1 767 . 1 1 82 82 TRP CB C 13 30.523 0.40 . 1 . . . A 106 TRP CB . 17750 1 768 . 1 1 82 82 TRP CD1 C 13 122.583 0.40 . 1 . . . A 106 TRP CD1 . 17750 1 769 . 1 1 82 82 TRP CE3 C 13 120.712 0.40 . 1 . . . A 106 TRP CE3 . 17750 1 770 . 1 1 82 82 TRP CZ2 C 13 114.101 0.40 . 1 . . . A 106 TRP CZ2 . 17750 1 771 . 1 1 82 82 TRP CH2 C 13 124.162 0.40 . 1 . . . A 106 TRP CH2 . 17750 1 772 . 1 1 82 82 TRP N N 15 120.831 0.40 . 1 . . . A 106 TRP N . 17750 1 773 . 1 1 82 82 TRP NE1 N 15 128.071 0.40 . 1 . . . A 106 TRP NE1 . 17750 1 774 . 1 1 83 83 ASP H H 1 8.097 0.04 . 1 . . . A 107 ASP H . 17750 1 775 . 1 1 83 83 ASP HA H 1 5.208 0.04 . 1 . . . A 107 ASP HA . 17750 1 776 . 1 1 83 83 ASP HB2 H 1 3.356 0.04 . 2 . . . A 107 ASP HB2 . 17750 1 777 . 1 1 83 83 ASP HB3 H 1 2.854 0.04 . 2 . . . A 107 ASP HB3 . 17750 1 778 . 1 1 83 83 ASP C C 13 174.365 0.40 . 1 . . . A 107 ASP C . 17750 1 779 . 1 1 83 83 ASP CA C 13 53.084 0.40 . 1 . . . A 107 ASP CA . 17750 1 780 . 1 1 83 83 ASP CB C 13 43.912 0.40 . 1 . . . A 107 ASP CB . 17750 1 781 . 1 1 83 83 ASP N N 15 115.757 0.40 . 1 . . . A 107 ASP N . 17750 1 782 . 1 1 84 84 SER H H 1 8.985 0.04 . 1 . . . A 108 SER H . 17750 1 783 . 1 1 84 84 SER HA H 1 5.619 0.04 . 1 . . . A 108 SER HA . 17750 1 784 . 1 1 84 84 SER HB2 H 1 3.429 0.04 . 2 . . . A 108 SER HB2 . 17750 1 785 . 1 1 84 84 SER HB3 H 1 2.894 0.04 . 2 . . . A 108 SER HB3 . 17750 1 786 . 1 1 84 84 SER C C 13 171.922 0.40 . 1 . . . A 108 SER C . 17750 1 787 . 1 1 84 84 SER CA C 13 58.489 0.40 . 1 . . . A 108 SER CA . 17750 1 788 . 1 1 84 84 SER CB C 13 65.366 0.40 . 1 . . . A 108 SER CB . 17750 1 789 . 1 1 84 84 SER N N 15 118.090 0.40 . 1 . . . A 108 SER N . 17750 1 790 . 1 1 85 85 LYS H H 1 9.076 0.04 . 1 . . . A 109 LYS H . 17750 1 791 . 1 1 85 85 LYS HA H 1 4.370 0.04 . 1 . . . A 109 LYS HA . 17750 1 792 . 1 1 85 85 LYS HB2 H 1 1.613 0.04 . 2 . . . A 109 LYS HB2 . 17750 1 793 . 1 1 85 85 LYS HB3 H 1 1.139 0.04 . 2 . . . A 109 LYS HB3 . 17750 1 794 . 1 1 85 85 LYS HG2 H 1 0.136 0.04 . 2 . . . A 109 LYS HG2 . 17750 1 795 . 1 1 85 85 LYS HG3 H 1 0.721 0.04 . 2 . . . A 109 LYS HG3 . 17750 1 796 . 1 1 85 85 LYS HD2 H 1 0.216 0.04 . 2 . . . A 109 LYS HD2 . 17750 1 797 . 1 1 85 85 LYS HD3 H 1 0.216 0.04 . 2 . . . A 109 LYS HD3 . 17750 1 798 . 1 1 85 85 LYS HE2 H 1 2.034 0.04 . 2 . . . A 109 LYS HE2 . 17750 1 799 . 1 1 85 85 LYS HE3 H 1 0.989 0.04 . 2 . . . A 109 LYS HE3 . 17750 1 800 . 1 1 85 85 LYS C C 13 173.500 0.40 . 1 . . . A 109 LYS C . 17750 1 801 . 1 1 85 85 LYS CA C 13 57.105 0.40 . 1 . . . A 109 LYS CA . 17750 1 802 . 1 1 85 85 LYS CB C 13 36.707 0.40 . 1 . . . A 109 LYS CB . 17750 1 803 . 1 1 85 85 LYS CG C 13 26.628 0.40 . 1 . . . A 109 LYS CG . 17750 1 804 . 1 1 85 85 LYS CD C 13 29.025 0.40 . 1 . . . A 109 LYS CD . 17750 1 805 . 1 1 85 85 LYS CE C 13 41.610 0.40 . 1 . . . A 109 LYS CE . 17750 1 806 . 1 1 85 85 LYS N N 15 119.248 0.40 . 1 . . . A 109 LYS N . 17750 1 807 . 1 1 86 86 ASN H H 1 8.346 0.04 . 1 . . . A 110 ASN H . 17750 1 808 . 1 1 86 86 ASN HA H 1 4.849 0.04 . 1 . . . A 110 ASN HA . 17750 1 809 . 1 1 86 86 ASN HB2 H 1 2.816 0.04 . 2 . . . A 110 ASN HB2 . 17750 1 810 . 1 1 86 86 ASN HB3 H 1 2.589 0.04 . 2 . . . A 110 ASN HB3 . 17750 1 811 . 1 1 86 86 ASN HD21 H 1 6.430 0.04 . 2 . . . A 110 ASN HD21 . 17750 1 812 . 1 1 86 86 ASN HD22 H 1 7.305 0.04 . 2 . . . A 110 ASN HD22 . 17750 1 813 . 1 1 86 86 ASN CA C 13 53.612 0.40 . 1 . . . A 110 ASN CA . 17750 1 814 . 1 1 86 86 ASN CB C 13 40.912 0.40 . 1 . . . A 110 ASN CB . 17750 1 815 . 1 1 86 86 ASN N N 15 119.154 0.40 . 1 . . . A 110 ASN N . 17750 1 816 . 1 1 86 86 ASN ND2 N 15 112.807 0.40 . 1 . . . A 110 ASN ND2 . 17750 1 817 . 1 1 87 87 ARG HA H 1 3.928 0.04 . 1 . . . A 111 ARG HA . 17750 1 818 . 1 1 87 87 ARG HB2 H 1 1.840 0.04 . 2 . . . A 111 ARG HB2 . 17750 1 819 . 1 1 87 87 ARG HB3 H 1 1.774 0.04 . 2 . . . A 111 ARG HB3 . 17750 1 820 . 1 1 87 87 ARG HG2 H 1 1.639 0.04 . 2 . . . A 111 ARG HG2 . 17750 1 821 . 1 1 87 87 ARG HG3 H 1 1.552 0.04 . 2 . . . A 111 ARG HG3 . 17750 1 822 . 1 1 87 87 ARG HD2 H 1 3.137 0.04 . 2 . . . A 111 ARG HD2 . 17750 1 823 . 1 1 87 87 ARG HD3 H 1 3.137 0.04 . 2 . . . A 111 ARG HD3 . 17750 1 824 . 1 1 87 87 ARG C C 13 176.139 0.40 . 1 . . . A 111 ARG C . 17750 1 825 . 1 1 87 87 ARG CA C 13 59.498 0.40 . 1 . . . A 111 ARG CA . 17750 1 826 . 1 1 87 87 ARG CB C 13 29.521 0.40 . 1 . . . A 111 ARG CB . 17750 1 827 . 1 1 87 87 ARG CG C 13 27.200 0.40 . 1 . . . A 111 ARG CG . 17750 1 828 . 1 1 87 87 ARG CD C 13 43.026 0.40 . 1 . . . A 111 ARG CD . 17750 1 829 . 1 1 88 88 GLY HA2 H 1 3.941 0.04 . 2 . . . A 112 GLY HA2 . 17750 1 830 . 1 1 88 88 GLY HA3 H 1 3.941 0.04 . 2 . . . A 112 GLY HA3 . 17750 1 831 . 1 1 88 88 GLY C C 13 173.218 0.40 . 1 . . . A 112 GLY C . 17750 1 832 . 1 1 88 88 GLY CA C 13 45.422 0.40 . 1 . . . A 112 GLY CA . 17750 1 833 . 1 1 89 89 VAL H H 1 7.733 0.04 . 1 . . . A 113 VAL H . 17750 1 834 . 1 1 89 89 VAL HA H 1 4.061 0.04 . 1 . . . A 113 VAL HA . 17750 1 835 . 1 1 89 89 VAL HB H 1 1.985 0.04 . 1 . . . A 113 VAL HB . 17750 1 836 . 1 1 89 89 VAL HG11 H 1 0.362 0.04 . 2 . . . A 113 VAL HG11 . 17750 1 837 . 1 1 89 89 VAL HG12 H 1 0.362 0.04 . 2 . . . A 113 VAL HG12 . 17750 1 838 . 1 1 89 89 VAL HG13 H 1 0.362 0.04 . 2 . . . A 113 VAL HG13 . 17750 1 839 . 1 1 89 89 VAL HG21 H 1 -0.164 0.04 . 2 . . . A 113 VAL HG21 . 17750 1 840 . 1 1 89 89 VAL HG22 H 1 -0.164 0.04 . 2 . . . A 113 VAL HG22 . 17750 1 841 . 1 1 89 89 VAL HG23 H 1 -0.164 0.04 . 2 . . . A 113 VAL HG23 . 17750 1 842 . 1 1 89 89 VAL C C 13 177.340 0.40 . 1 . . . A 113 VAL C . 17750 1 843 . 1 1 89 89 VAL CA C 13 62.555 0.40 . 1 . . . A 113 VAL CA . 17750 1 844 . 1 1 89 89 VAL CB C 13 29.570 0.40 . 1 . . . A 113 VAL CB . 17750 1 845 . 1 1 89 89 VAL CG1 C 13 19.900 0.40 . 2 . . . A 113 VAL CG1 . 17750 1 846 . 1 1 89 89 VAL CG2 C 13 21.616 0.40 . 2 . . . A 113 VAL CG2 . 17750 1 847 . 1 1 89 89 VAL N N 15 124.236 0.40 . 1 . . . A 113 VAL N . 17750 1 848 . 1 1 90 90 THR H H 1 6.899 0.04 . 1 . . . A 114 THR H . 17750 1 849 . 1 1 90 90 THR HA H 1 4.178 0.04 . 1 . . . A 114 THR HA . 17750 1 850 . 1 1 90 90 THR HB H 1 4.539 0.04 . 1 . . . A 114 THR HB . 17750 1 851 . 1 1 90 90 THR HG21 H 1 1.358 0.04 . 1 . . . A 114 THR HG21 . 17750 1 852 . 1 1 90 90 THR HG22 H 1 1.358 0.04 . 1 . . . A 114 THR HG22 . 17750 1 853 . 1 1 90 90 THR HG23 H 1 1.358 0.04 . 1 . . . A 114 THR HG23 . 17750 1 854 . 1 1 90 90 THR C C 13 175.893 0.40 . 1 . . . A 114 THR C . 17750 1 855 . 1 1 90 90 THR CA C 13 63.920 0.40 . 1 . . . A 114 THR CA . 17750 1 856 . 1 1 90 90 THR CB C 13 69.897 0.40 . 1 . . . A 114 THR CB . 17750 1 857 . 1 1 90 90 THR CG2 C 13 22.065 0.40 . 1 . . . A 114 THR CG2 . 17750 1 858 . 1 1 90 90 THR N N 15 109.416 0.40 . 1 . . . A 114 THR N . 17750 1 859 . 1 1 91 91 GLY H H 1 8.736 0.04 . 1 . . . A 115 GLY H . 17750 1 860 . 1 1 91 91 GLY HA2 H 1 3.896 0.04 . 2 . . . A 115 GLY HA2 . 17750 1 861 . 1 1 91 91 GLY HA3 H 1 3.288 0.04 . 2 . . . A 115 GLY HA3 . 17750 1 862 . 1 1 91 91 GLY C C 13 173.969 0.40 . 1 . . . A 115 GLY C . 17750 1 863 . 1 1 91 91 GLY CA C 13 45.727 0.40 . 1 . . . A 115 GLY CA . 17750 1 864 . 1 1 91 91 GLY N N 15 110.778 0.40 . 1 . . . A 115 GLY N . 17750 1 865 . 1 1 92 92 THR H H 1 7.472 0.04 . 1 . . . A 116 THR H . 17750 1 866 . 1 1 92 92 THR HA H 1 4.569 0.04 . 1 . . . A 116 THR HA . 17750 1 867 . 1 1 92 92 THR HB H 1 4.575 0.04 . 1 . . . A 116 THR HB . 17750 1 868 . 1 1 92 92 THR HG21 H 1 1.234 0.04 . 1 . . . A 116 THR HG21 . 17750 1 869 . 1 1 92 92 THR HG22 H 1 1.234 0.04 . 1 . . . A 116 THR HG22 . 17750 1 870 . 1 1 92 92 THR HG23 H 1 1.234 0.04 . 1 . . . A 116 THR HG23 . 17750 1 871 . 1 1 92 92 THR C C 13 176.071 0.40 . 1 . . . A 116 THR C . 17750 1 872 . 1 1 92 92 THR CA C 13 59.907 0.40 . 1 . . . A 116 THR CA . 17750 1 873 . 1 1 92 92 THR CB C 13 70.171 0.40 . 1 . . . A 116 THR CB . 17750 1 874 . 1 1 92 92 THR CG2 C 13 22.092 0.40 . 1 . . . A 116 THR CG2 . 17750 1 875 . 1 1 92 92 THR N N 15 109.424 0.40 . 1 . . . A 116 THR N . 17750 1 876 . 1 1 93 93 GLN H H 1 9.022 0.04 . 1 . . . A 117 GLN H . 17750 1 877 . 1 1 93 93 GLN HA H 1 4.071 0.04 . 1 . . . A 117 GLN HA . 17750 1 878 . 1 1 93 93 GLN HB2 H 1 2.073 0.04 . 2 . . . A 117 GLN HB2 . 17750 1 879 . 1 1 93 93 GLN HB3 H 1 2.335 0.04 . 2 . . . A 117 GLN HB3 . 17750 1 880 . 1 1 93 93 GLN HG2 H 1 2.549 0.04 . 2 . . . A 117 GLN HG2 . 17750 1 881 . 1 1 93 93 GLN HG3 H 1 2.439 0.04 . 2 . . . A 117 GLN HG3 . 17750 1 882 . 1 1 93 93 GLN HE21 H 1 6.890 0.04 . 2 . . . A 117 GLN HE21 . 17750 1 883 . 1 1 93 93 GLN HE22 H 1 7.500 0.04 . 2 . . . A 117 GLN HE22 . 17750 1 884 . 1 1 93 93 GLN C C 13 174.488 0.40 . 1 . . . A 117 GLN C . 17750 1 885 . 1 1 93 93 GLN CA C 13 59.607 0.40 . 1 . . . A 117 GLN CA . 17750 1 886 . 1 1 93 93 GLN CB C 13 28.517 0.40 . 1 . . . A 117 GLN CB . 17750 1 887 . 1 1 93 93 GLN CG C 13 35.045 0.40 . 1 . . . A 117 GLN CG . 17750 1 888 . 1 1 93 93 GLN N N 15 123.283 0.40 . 1 . . . A 117 GLN N . 17750 1 889 . 1 1 93 93 GLN NE2 N 15 113.077 0.40 . 1 . . . A 117 GLN NE2 . 17750 1 890 . 1 1 94 94 LYS H H 1 7.656 0.04 . 1 . . . A 118 LYS H . 17750 1 891 . 1 1 94 94 LYS HA H 1 5.026 0.04 . 1 . . . A 118 LYS HA . 17750 1 892 . 1 1 94 94 LYS HB2 H 1 1.580 0.04 . 2 . . . A 118 LYS HB2 . 17750 1 893 . 1 1 94 94 LYS HB3 H 1 1.465 0.04 . 2 . . . A 118 LYS HB3 . 17750 1 894 . 1 1 94 94 LYS HG2 H 1 1.329 0.04 . 2 . . . A 118 LYS HG2 . 17750 1 895 . 1 1 94 94 LYS HG3 H 1 1.233 0.04 . 2 . . . A 118 LYS HG3 . 17750 1 896 . 1 1 94 94 LYS HD2 H 1 1.466 0.04 . 2 . . . A 118 LYS HD2 . 17750 1 897 . 1 1 94 94 LYS HD3 H 1 1.466 0.04 . 2 . . . A 118 LYS HD3 . 17750 1 898 . 1 1 94 94 LYS HE2 H 1 2.767 0.04 . 2 . . . A 118 LYS HE2 . 17750 1 899 . 1 1 94 94 LYS HE3 H 1 2.767 0.04 . 2 . . . A 118 LYS HE3 . 17750 1 900 . 1 1 94 94 LYS C C 13 176.576 0.40 . 1 . . . A 118 LYS C . 17750 1 901 . 1 1 94 94 LYS CA C 13 53.575 0.40 . 1 . . . A 118 LYS CA . 17750 1 902 . 1 1 94 94 LYS CB C 13 35.942 0.40 . 1 . . . A 118 LYS CB . 17750 1 903 . 1 1 94 94 LYS CG C 13 25.171 0.40 . 1 . . . A 118 LYS CG . 17750 1 904 . 1 1 94 94 LYS CD C 13 29.597 0.40 . 1 . . . A 118 LYS CD . 17750 1 905 . 1 1 94 94 LYS CE C 13 41.964 0.40 . 1 . . . A 118 LYS CE . 17750 1 906 . 1 1 94 94 LYS N N 15 114.021 0.40 . 1 . . . A 118 LYS N . 17750 1 907 . 1 1 95 95 GLY H H 1 7.027 0.04 . 1 . . . A 119 GLY H . 17750 1 908 . 1 1 95 95 GLY HA2 H 1 3.418 0.04 . 2 . . . A 119 GLY HA2 . 17750 1 909 . 1 1 95 95 GLY HA3 H 1 2.818 0.04 . 2 . . . A 119 GLY HA3 . 17750 1 910 . 1 1 95 95 GLY C C 13 169.530 0.40 . 1 . . . A 119 GLY C . 17750 1 911 . 1 1 95 95 GLY CA C 13 44.840 0.40 . 1 . . . A 119 GLY CA . 17750 1 912 . 1 1 95 95 GLY N N 15 110.497 0.40 . 1 . . . A 119 GLY N . 17750 1 913 . 1 1 96 96 GLN H H 1 7.466 0.04 . 1 . . . A 120 GLN H . 17750 1 914 . 1 1 96 96 GLN HA H 1 5.259 0.04 . 1 . . . A 120 GLN HA . 17750 1 915 . 1 1 96 96 GLN HB2 H 1 1.887 0.04 . 2 . . . A 120 GLN HB2 . 17750 1 916 . 1 1 96 96 GLN HB3 H 1 1.672 0.04 . 2 . . . A 120 GLN HB3 . 17750 1 917 . 1 1 96 96 GLN HE21 H 1 6.708 0.04 . 2 . . . A 120 GLN HE21 . 17750 1 918 . 1 1 96 96 GLN HE22 H 1 7.302 0.04 . 2 . . . A 120 GLN HE22 . 17750 1 919 . 1 1 96 96 GLN C C 13 173.628 0.40 . 1 . . . A 120 GLN C . 17750 1 920 . 1 1 96 96 GLN CA C 13 53.384 0.40 . 1 . . . A 120 GLN CA . 17750 1 921 . 1 1 96 96 GLN CB C 13 32.358 0.40 . 1 . . . A 120 GLN CB . 17750 1 922 . 1 1 96 96 GLN N N 15 114.957 0.40 . 1 . . . A 120 GLN N . 17750 1 923 . 1 1 96 96 GLN NE2 N 15 111.677 0.40 . 1 . . . A 120 GLN NE2 . 17750 1 924 . 1 1 97 97 ILE H H 1 8.939 0.04 . 1 . . . A 121 ILE H . 17750 1 925 . 1 1 97 97 ILE HA H 1 4.591 0.04 . 1 . . . A 121 ILE HA . 17750 1 926 . 1 1 97 97 ILE HB H 1 1.855 0.04 . 1 . . . A 121 ILE HB . 17750 1 927 . 1 1 97 97 ILE HG12 H 1 1.637 0.04 . 2 . . . A 121 ILE HG12 . 17750 1 928 . 1 1 97 97 ILE HG13 H 1 1.100 0.04 . 2 . . . A 121 ILE HG13 . 17750 1 929 . 1 1 97 97 ILE HG21 H 1 1.033 0.04 . 1 . . . A 121 ILE HG21 . 17750 1 930 . 1 1 97 97 ILE HG22 H 1 1.033 0.04 . 1 . . . A 121 ILE HG22 . 17750 1 931 . 1 1 97 97 ILE HG23 H 1 1.033 0.04 . 1 . . . A 121 ILE HG23 . 17750 1 932 . 1 1 97 97 ILE HD11 H 1 0.728 0.04 . 1 . . . A 121 ILE HD11 . 17750 1 933 . 1 1 97 97 ILE HD12 H 1 0.728 0.04 . 1 . . . A 121 ILE HD12 . 17750 1 934 . 1 1 97 97 ILE HD13 H 1 0.728 0.04 . 1 . . . A 121 ILE HD13 . 17750 1 935 . 1 1 97 97 ILE C C 13 171.935 0.40 . 1 . . . A 121 ILE C . 17750 1 936 . 1 1 97 97 ILE CA C 13 59.661 0.40 . 1 . . . A 121 ILE CA . 17750 1 937 . 1 1 97 97 ILE CB C 13 42.983 0.40 . 1 . . . A 121 ILE CB . 17750 1 938 . 1 1 97 97 ILE CG1 C 13 28.425 0.40 . 1 . . . A 121 ILE CG1 . 17750 1 939 . 1 1 97 97 ILE CG2 C 13 15.991 0.40 . 1 . . . A 121 ILE CG2 . 17750 1 940 . 1 1 97 97 ILE CD1 C 13 15.909 0.40 . 1 . . . A 121 ILE CD1 . 17750 1 941 . 1 1 97 97 ILE N N 15 119.248 0.40 . 1 . . . A 121 ILE N . 17750 1 942 . 1 1 98 98 VAL H H 1 7.937 0.04 . 1 . . . A 122 VAL H . 17750 1 943 . 1 1 98 98 VAL HA H 1 4.373 0.04 . 1 . . . A 122 VAL HA . 17750 1 944 . 1 1 98 98 VAL HB H 1 1.794 0.04 . 1 . . . A 122 VAL HB . 17750 1 945 . 1 1 98 98 VAL HG11 H 1 0.829 0.04 . 2 . . . A 122 VAL HG11 . 17750 1 946 . 1 1 98 98 VAL HG12 H 1 0.829 0.04 . 2 . . . A 122 VAL HG12 . 17750 1 947 . 1 1 98 98 VAL HG13 H 1 0.829 0.04 . 2 . . . A 122 VAL HG13 . 17750 1 948 . 1 1 98 98 VAL HG21 H 1 0.773 0.04 . 2 . . . A 122 VAL HG21 . 17750 1 949 . 1 1 98 98 VAL HG22 H 1 0.773 0.04 . 2 . . . A 122 VAL HG22 . 17750 1 950 . 1 1 98 98 VAL HG23 H 1 0.773 0.04 . 2 . . . A 122 VAL HG23 . 17750 1 951 . 1 1 98 98 VAL C C 13 175.047 0.40 . 1 . . . A 122 VAL C . 17750 1 952 . 1 1 98 98 VAL CA C 13 62.010 0.40 . 1 . . . A 122 VAL CA . 17750 1 953 . 1 1 98 98 VAL CB C 13 32.339 0.40 . 1 . . . A 122 VAL CB . 17750 1 954 . 1 1 98 98 VAL CG1 C 13 21.561 0.40 . 2 . . . A 122 VAL CG1 . 17750 1 955 . 1 1 98 98 VAL CG2 C 13 21.452 0.40 . 2 . . . A 122 VAL CG2 . 17750 1 956 . 1 1 98 98 VAL N N 15 126.177 0.40 . 1 . . . A 122 VAL N . 17750 1 957 . 1 1 99 99 TRP H H 1 9.295 0.04 . 1 . . . A 123 TRP H . 17750 1 958 . 1 1 99 99 TRP HA H 1 4.326 0.04 . 1 . . . A 123 TRP HA . 17750 1 959 . 1 1 99 99 TRP HB2 H 1 2.920 0.04 . 2 . . . A 123 TRP HB2 . 17750 1 960 . 1 1 99 99 TRP HB3 H 1 2.367 0.04 . 2 . . . A 123 TRP HB3 . 17750 1 961 . 1 1 99 99 TRP HD1 H 1 7.165 0.04 . 1 . . . A 123 TRP HD1 . 17750 1 962 . 1 1 99 99 TRP HE1 H 1 10.224 0.04 . 1 . . . A 123 TRP HE1 . 17750 1 963 . 1 1 99 99 TRP HZ2 H 1 6.723 0.04 . 1 . . . A 123 TRP HZ2 . 17750 1 964 . 1 1 99 99 TRP HZ3 H 1 5.840 0.04 . 1 . . . A 123 TRP HZ3 . 17750 1 965 . 1 1 99 99 TRP HH2 H 1 6.780 0.04 . 1 . . . A 123 TRP HH2 . 17750 1 966 . 1 1 99 99 TRP C C 13 174.324 0.40 . 1 . . . A 123 TRP C . 17750 1 967 . 1 1 99 99 TRP CA C 13 57.287 0.40 . 1 . . . A 123 TRP CA . 17750 1 968 . 1 1 99 99 TRP CB C 13 32.557 0.40 . 1 . . . A 123 TRP CB . 17750 1 969 . 1 1 99 99 TRP CD1 C 13 127.153 0.40 . 1 . . . A 123 TRP CD1 . 17750 1 970 . 1 1 99 99 TRP CZ2 C 13 114.311 0.40 . 1 . . . A 123 TRP CZ2 . 17750 1 971 . 1 1 99 99 TRP CH2 C 13 125.000 0.40 . 1 . . . A 123 TRP CH2 . 17750 1 972 . 1 1 99 99 TRP N N 15 131.421 0.40 . 1 . . . A 123 TRP N . 17750 1 973 . 1 1 99 99 TRP NE1 N 15 130.216 0.40 . 1 . . . A 123 TRP NE1 . 17750 1 974 . 1 1 100 100 ARG H H 1 8.520 0.04 . 1 . . . A 124 ARG H . 17750 1 975 . 1 1 100 100 ARG HA H 1 4.530 0.04 . 1 . . . A 124 ARG HA . 17750 1 976 . 1 1 100 100 ARG HB2 H 1 1.746 0.04 . 2 . . . A 124 ARG HB2 . 17750 1 977 . 1 1 100 100 ARG HB3 H 1 1.625 0.04 . 2 . . . A 124 ARG HB3 . 17750 1 978 . 1 1 100 100 ARG HG2 H 1 1.617 0.04 . 2 . . . A 124 ARG HG2 . 17750 1 979 . 1 1 100 100 ARG HG3 H 1 1.357 0.04 . 2 . . . A 124 ARG HG3 . 17750 1 980 . 1 1 100 100 ARG HD2 H 1 3.220 0.04 . 2 . . . A 124 ARG HD2 . 17750 1 981 . 1 1 100 100 ARG HD3 H 1 3.150 0.04 . 2 . . . A 124 ARG HD3 . 17750 1 982 . 1 1 100 100 ARG C C 13 175.061 0.40 . 1 . . . A 124 ARG C . 17750 1 983 . 1 1 100 100 ARG CA C 13 55.868 0.40 . 1 . . . A 124 ARG CA . 17750 1 984 . 1 1 100 100 ARG CB C 13 31.110 0.40 . 1 . . . A 124 ARG CB . 17750 1 985 . 1 1 100 100 ARG CG C 13 27.663 0.40 . 1 . . . A 124 ARG CG . 17750 1 986 . 1 1 100 100 ARG CD C 13 43.176 0.40 . 1 . . . A 124 ARG CD . 17750 1 987 . 1 1 100 100 ARG N N 15 126.858 0.40 . 1 . . . A 124 ARG N . 17750 1 988 . 1 1 101 101 ILE H H 1 7.371 0.04 . 1 . . . A 125 ILE H . 17750 1 989 . 1 1 101 101 ILE HA H 1 4.152 0.04 . 1 . . . A 125 ILE HA . 17750 1 990 . 1 1 101 101 ILE HB H 1 1.281 0.04 . 1 . . . A 125 ILE HB . 17750 1 991 . 1 1 101 101 ILE HG12 H 1 0.532 0.04 . 2 . . . A 125 ILE HG12 . 17750 1 992 . 1 1 101 101 ILE HG13 H 1 1.020 0.04 . 2 . . . A 125 ILE HG13 . 17750 1 993 . 1 1 101 101 ILE HG21 H 1 0.274 0.04 . 1 . . . A 125 ILE HG21 . 17750 1 994 . 1 1 101 101 ILE HG22 H 1 0.274 0.04 . 1 . . . A 125 ILE HG22 . 17750 1 995 . 1 1 101 101 ILE HG23 H 1 0.274 0.04 . 1 . . . A 125 ILE HG23 . 17750 1 996 . 1 1 101 101 ILE HD11 H 1 0.101 0.04 . 1 . . . A 125 ILE HD11 . 17750 1 997 . 1 1 101 101 ILE HD12 H 1 0.101 0.04 . 1 . . . A 125 ILE HD12 . 17750 1 998 . 1 1 101 101 ILE HD13 H 1 0.101 0.04 . 1 . . . A 125 ILE HD13 . 17750 1 999 . 1 1 101 101 ILE C C 13 174.651 0.40 . 1 . . . A 125 ILE C . 17750 1 1000 . 1 1 101 101 ILE CA C 13 61.163 0.40 . 1 . . . A 125 ILE CA . 17750 1 1001 . 1 1 101 101 ILE CB C 13 37.716 0.40 . 1 . . . A 125 ILE CB . 17750 1 1002 . 1 1 101 101 ILE CG1 C 13 27.009 0.40 . 1 . . . A 125 ILE CG1 . 17750 1 1003 . 1 1 101 101 ILE CG2 C 13 17.625 0.40 . 1 . . . A 125 ILE CG2 . 17750 1 1004 . 1 1 101 101 ILE CD1 C 13 13.103 0.40 . 1 . . . A 125 ILE CD1 . 17750 1 1005 . 1 1 101 101 ILE N N 15 127.113 0.40 . 1 . . . A 125 ILE N . 17750 1 1006 . 1 1 102 102 GLU H H 1 8.597 0.04 . 1 . . . A 126 GLU H . 17750 1 1007 . 1 1 102 102 GLU HA H 1 4.713 0.04 . 1 . . . A 126 GLU HA . 17750 1 1008 . 1 1 102 102 GLU HB2 H 1 1.770 0.04 . 2 . . . A 126 GLU HB2 . 17750 1 1009 . 1 1 102 102 GLU HB3 H 1 2.101 0.04 . 2 . . . A 126 GLU HB3 . 17750 1 1010 . 1 1 102 102 GLU HG2 H 1 2.340 0.04 . 2 . . . A 126 GLU HG2 . 17750 1 1011 . 1 1 102 102 GLU HG3 H 1 2.206 0.04 . 2 . . . A 126 GLU HG3 . 17750 1 1012 . 1 1 102 102 GLU CA C 13 53.732 0.40 . 1 . . . A 126 GLU CA . 17750 1 1013 . 1 1 102 102 GLU CB C 13 30.006 0.40 . 1 . . . A 126 GLU CB . 17750 1 1014 . 1 1 102 102 GLU CG C 13 35.453 0.40 . 1 . . . A 126 GLU CG . 17750 1 1015 . 1 1 102 102 GLU N N 15 128.271 0.40 . 1 . . . A 126 GLU N . 17750 1 1016 . 1 1 103 103 PRO HA H 1 4.346 0.04 . 1 . . . A 127 PRO HA . 17750 1 1017 . 1 1 103 103 PRO HB2 H 1 2.274 0.04 . 2 . . . A 127 PRO HB2 . 17750 1 1018 . 1 1 103 103 PRO HB3 H 1 1.835 0.04 . 2 . . . A 127 PRO HB3 . 17750 1 1019 . 1 1 103 103 PRO HG2 H 1 2.075 0.04 . 2 . . . A 127 PRO HG2 . 17750 1 1020 . 1 1 103 103 PRO HG3 H 1 1.863 0.04 . 2 . . . A 127 PRO HG3 . 17750 1 1021 . 1 1 103 103 PRO HD2 H 1 3.803 0.04 . 2 . . . A 127 PRO HD2 . 17750 1 1022 . 1 1 103 103 PRO HD3 H 1 3.733 0.04 . 2 . . . A 127 PRO HD3 . 17750 1 1023 . 1 1 103 103 PRO C C 13 175.989 0.40 . 1 . . . A 127 PRO C . 17750 1 1024 . 1 1 103 103 PRO CA C 13 63.456 0.40 . 1 . . . A 127 PRO CA . 17750 1 1025 . 1 1 103 103 PRO CB C 13 32.022 0.40 . 1 . . . A 127 PRO CB . 17750 1 1026 . 1 1 103 103 PRO CG C 13 27.895 0.40 . 1 . . . A 127 PRO CG . 17750 1 1027 . 1 1 103 103 PRO CD C 13 50.463 0.40 . 1 . . . A 127 PRO CD . 17750 1 1028 . 1 1 104 104 GLY H H 1 7.767 0.04 . 1 . . . A 128 GLY H . 17750 1 1029 . 1 1 104 104 GLY HA2 H 1 4.018 0.04 . 2 . . . A 128 GLY HA2 . 17750 1 1030 . 1 1 104 104 GLY HA3 H 1 3.900 0.04 . 2 . . . A 128 GLY HA3 . 17750 1 1031 . 1 1 104 104 GLY CA C 13 45.614 0.40 . 1 . . . A 128 GLY CA . 17750 1 1032 . 1 1 104 104 GLY N N 15 108.845 0.40 . 1 . . . A 128 GLY N . 17750 1 1033 . 1 1 105 105 PRO HA H 1 3.986 0.04 . 1 . . . A 129 PRO HA . 17750 1 1034 . 1 1 105 105 PRO HB2 H 1 1.978 0.04 . 2 . . . A 129 PRO HB2 . 17750 1 1035 . 1 1 105 105 PRO HB3 H 1 1.316 0.04 . 2 . . . A 129 PRO HB3 . 17750 1 1036 . 1 1 105 105 PRO HG2 H 1 1.700 0.04 . 2 . . . A 129 PRO HG2 . 17750 1 1037 . 1 1 105 105 PRO HG3 H 1 1.404 0.04 . 2 . . . A 129 PRO HG3 . 17750 1 1038 . 1 1 105 105 PRO HD2 H 1 3.296 0.04 . 2 . . . A 129 PRO HD2 . 17750 1 1039 . 1 1 105 105 PRO HD3 H 1 3.296 0.04 . 2 . . . A 129 PRO HD3 . 17750 1 1040 . 1 1 105 105 PRO C C 13 177.012 0.40 . 1 . . . A 129 PRO C . 17750 1 1041 . 1 1 105 105 PRO CA C 13 64.385 0.40 . 1 . . . A 129 PRO CA . 17750 1 1042 . 1 1 105 105 PRO CB C 13 31.956 0.40 . 1 . . . A 129 PRO CB . 17750 1 1043 . 1 1 105 105 PRO CG C 13 26.587 0.40 . 1 . . . A 129 PRO CG . 17750 1 1044 . 1 1 105 105 PRO CD C 13 49.455 0.40 . 1 . . . A 129 PRO CD . 17750 1 1045 . 1 1 106 106 TYR H H 1 7.289 0.04 . 1 . . . A 130 TYR H . 17750 1 1046 . 1 1 106 106 TYR HA H 1 3.774 0.04 . 1 . . . A 130 TYR HA . 17750 1 1047 . 1 1 106 106 TYR HB2 H 1 1.066 0.04 . 2 . . . A 130 TYR HB2 . 17750 1 1048 . 1 1 106 106 TYR HB3 H 1 0.901 0.04 . 2 . . . A 130 TYR HB3 . 17750 1 1049 . 1 1 106 106 TYR HD1 H 1 6.093 0.04 . 3 . . . A 130 TYR HD1 . 17750 1 1050 . 1 1 106 106 TYR HD2 H 1 6.093 0.04 . 3 . . . A 130 TYR HD2 . 17750 1 1051 . 1 1 106 106 TYR HE1 H 1 6.457 0.04 . 3 . . . A 130 TYR HE1 . 17750 1 1052 . 1 1 106 106 TYR HE2 H 1 6.457 0.04 . 3 . . . A 130 TYR HE2 . 17750 1 1053 . 1 1 106 106 TYR C C 13 175.300 0.40 . 1 . . . A 130 TYR C . 17750 1 1054 . 1 1 106 106 TYR CA C 13 57.151 0.40 . 1 . . . A 130 TYR CA . 17750 1 1055 . 1 1 106 106 TYR CB C 13 35.572 0.40 . 1 . . . A 130 TYR CB . 17750 1 1056 . 1 1 106 106 TYR CD1 C 13 131.672 0.40 . 3 . . . A 130 TYR CD1 . 17750 1 1057 . 1 1 106 106 TYR CD2 C 13 131.672 0.40 . 3 . . . A 130 TYR CD2 . 17750 1 1058 . 1 1 106 106 TYR CE1 C 13 117.425 0.40 . 3 . . . A 130 TYR CE1 . 17750 1 1059 . 1 1 106 106 TYR CE2 C 13 117.425 0.40 . 3 . . . A 130 TYR CE2 . 17750 1 1060 . 1 1 106 106 TYR N N 15 115.315 0.40 . 1 . . . A 130 TYR N . 17750 1 1061 . 1 1 107 107 PHE H H 1 7.491 0.04 . 1 . . . A 131 PHE H . 17750 1 1062 . 1 1 107 107 PHE HA H 1 4.858 0.04 . 1 . . . A 131 PHE HA . 17750 1 1063 . 1 1 107 107 PHE HB2 H 1 3.269 0.04 . 2 . . . A 131 PHE HB2 . 17750 1 1064 . 1 1 107 107 PHE HB3 H 1 2.675 0.04 . 2 . . . A 131 PHE HB3 . 17750 1 1065 . 1 1 107 107 PHE HD1 H 1 7.099 0.04 . 3 . . . A 131 PHE HD1 . 17750 1 1066 . 1 1 107 107 PHE HD2 H 1 7.099 0.04 . 3 . . . A 131 PHE HD2 . 17750 1 1067 . 1 1 107 107 PHE HE1 H 1 7.303 0.04 . 3 . . . A 131 PHE HE1 . 17750 1 1068 . 1 1 107 107 PHE HE2 H 1 7.303 0.04 . 3 . . . A 131 PHE HE2 . 17750 1 1069 . 1 1 107 107 PHE C C 13 175.238 0.40 . 1 . . . A 131 PHE C . 17750 1 1070 . 1 1 107 107 PHE CA C 13 55.076 0.40 . 1 . . . A 131 PHE CA . 17750 1 1071 . 1 1 107 107 PHE CB C 13 39.599 0.40 . 1 . . . A 131 PHE CB . 17750 1 1072 . 1 1 107 107 PHE CD1 C 13 131.917 0.40 . 3 . . . A 131 PHE CD1 . 17750 1 1073 . 1 1 107 107 PHE CD2 C 13 131.917 0.40 . 3 . . . A 131 PHE CD2 . 17750 1 1074 . 1 1 107 107 PHE CE1 C 13 131.073 0.40 . 3 . . . A 131 PHE CE1 . 17750 1 1075 . 1 1 107 107 PHE CE2 C 13 131.073 0.40 . 3 . . . A 131 PHE CE2 . 17750 1 1076 . 1 1 107 107 PHE N N 15 117.443 0.40 . 1 . . . A 131 PHE N . 17750 1 1077 . 1 1 108 108 MET H H 1 7.905 0.04 . 1 . . . A 132 MET H . 17750 1 1078 . 1 1 108 108 MET HA H 1 4.544 0.04 . 1 . . . A 132 MET HA . 17750 1 1079 . 1 1 108 108 MET HB2 H 1 2.060 0.04 . 2 . . . A 132 MET HB2 . 17750 1 1080 . 1 1 108 108 MET HB3 H 1 1.862 0.04 . 2 . . . A 132 MET HB3 . 17750 1 1081 . 1 1 108 108 MET HG2 H 1 2.502 0.04 . 2 . . . A 132 MET HG2 . 17750 1 1082 . 1 1 108 108 MET HG3 H 1 2.333 0.04 . 2 . . . A 132 MET HG3 . 17750 1 1083 . 1 1 108 108 MET HE1 H 1 1.941 0.04 . 1 . . . A 132 MET HE1 . 17750 1 1084 . 1 1 108 108 MET HE2 H 1 1.941 0.04 . 1 . . . A 132 MET HE2 . 17750 1 1085 . 1 1 108 108 MET HE3 H 1 1.941 0.04 . 1 . . . A 132 MET HE3 . 17750 1 1086 . 1 1 108 108 MET C C 13 177.053 0.40 . 1 . . . A 132 MET C . 17750 1 1087 . 1 1 108 108 MET CA C 13 55.431 0.40 . 1 . . . A 132 MET CA . 17750 1 1088 . 1 1 108 108 MET CB C 13 33.048 0.40 . 1 . . . A 132 MET CB . 17750 1 1089 . 1 1 108 108 MET CG C 13 32.090 0.40 . 1 . . . A 132 MET CG . 17750 1 1090 . 1 1 108 108 MET CE C 13 16.450 0.40 . 1 . . . A 132 MET CE . 17750 1 1091 . 1 1 108 108 MET N N 15 118.430 0.40 . 1 . . . A 132 MET N . 17750 1 1092 . 1 1 109 109 GLU H H 1 7.462 0.04 . 1 . . . A 133 GLU H . 17750 1 1093 . 1 1 109 109 GLU HA H 1 4.545 0.04 . 1 . . . A 133 GLU HA . 17750 1 1094 . 1 1 109 109 GLU HB2 H 1 2.330 0.04 . 2 . . . A 133 GLU HB2 . 17750 1 1095 . 1 1 109 109 GLU HB3 H 1 1.744 0.04 . 2 . . . A 133 GLU HB3 . 17750 1 1096 . 1 1 109 109 GLU HG2 H 1 2.368 0.04 . 2 . . . A 133 GLU HG2 . 17750 1 1097 . 1 1 109 109 GLU HG3 H 1 2.281 0.04 . 2 . . . A 133 GLU HG3 . 17750 1 1098 . 1 1 109 109 GLU CA C 13 55.080 0.40 . 1 . . . A 133 GLU CA . 17750 1 1099 . 1 1 109 109 GLU CB C 13 29.938 0.40 . 1 . . . A 133 GLU CB . 17750 1 1100 . 1 1 109 109 GLU CG C 13 36.584 0.40 . 1 . . . A 133 GLU CG . 17750 1 1101 . 1 1 109 109 GLU N N 15 119.418 0.40 . 1 . . . A 133 GLU N . 17750 1 1102 . 1 1 110 110 PRO HA H 1 4.359 0.04 . 1 . . . A 134 PRO HA . 17750 1 1103 . 1 1 110 110 PRO HB2 H 1 2.399 0.04 . 2 . . . A 134 PRO HB2 . 17750 1 1104 . 1 1 110 110 PRO HB3 H 1 1.896 0.04 . 2 . . . A 134 PRO HB3 . 17750 1 1105 . 1 1 110 110 PRO HG2 H 1 2.121 0.04 . 2 . . . A 134 PRO HG2 . 17750 1 1106 . 1 1 110 110 PRO HG3 H 1 2.012 0.04 . 2 . . . A 134 PRO HG3 . 17750 1 1107 . 1 1 110 110 PRO HD2 H 1 3.809 0.04 . 2 . . . A 134 PRO HD2 . 17750 1 1108 . 1 1 110 110 PRO HD3 H 1 3.809 0.04 . 2 . . . A 134 PRO HD3 . 17750 1 1109 . 1 1 110 110 PRO C C 13 177.709 0.40 . 1 . . . A 134 PRO C . 17750 1 1110 . 1 1 110 110 PRO CA C 13 65.749 0.40 . 1 . . . A 134 PRO CA . 17750 1 1111 . 1 1 110 110 PRO CB C 13 32.352 0.40 . 1 . . . A 134 PRO CB . 17750 1 1112 . 1 1 110 110 PRO CG C 13 27.963 0.40 . 1 . . . A 134 PRO CG . 17750 1 1113 . 1 1 110 110 PRO CD C 13 50.409 0.40 . 1 . . . A 134 PRO CD . 17750 1 1114 . 1 1 111 111 GLU H H 1 7.297 0.04 . 1 . . . A 135 GLU H . 17750 1 1115 . 1 1 111 111 GLU HA H 1 5.281 0.04 . 1 . . . A 135 GLU HA . 17750 1 1116 . 1 1 111 111 GLU HB2 H 1 1.814 0.04 . 2 . . . A 135 GLU HB2 . 17750 1 1117 . 1 1 111 111 GLU HB3 H 1 1.814 0.04 . 2 . . . A 135 GLU HB3 . 17750 1 1118 . 1 1 111 111 GLU HG2 H 1 2.075 0.04 . 2 . . . A 135 GLU HG2 . 17750 1 1119 . 1 1 111 111 GLU HG3 H 1 2.004 0.04 . 2 . . . A 135 GLU HG3 . 17750 1 1120 . 1 1 111 111 GLU C C 13 174.897 0.40 . 1 . . . A 135 GLU C . 17750 1 1121 . 1 1 111 111 GLU CA C 13 55.159 0.40 . 1 . . . A 135 GLU CA . 17750 1 1122 . 1 1 111 111 GLU CB C 13 33.540 0.40 . 1 . . . A 135 GLU CB . 17750 1 1123 . 1 1 111 111 GLU CG C 13 37.129 0.40 . 1 . . . A 135 GLU CG . 17750 1 1124 . 1 1 111 111 GLU N N 15 113.357 0.40 . 1 . . . A 135 GLU N . 17750 1 1125 . 1 1 112 112 ILE H H 1 9.382 0.04 . 1 . . . A 136 ILE H . 17750 1 1126 . 1 1 112 112 ILE HA H 1 4.553 0.04 . 1 . . . A 136 ILE HA . 17750 1 1127 . 1 1 112 112 ILE HB H 1 1.924 0.04 . 1 . . . A 136 ILE HB . 17750 1 1128 . 1 1 112 112 ILE HG12 H 1 1.632 0.04 . 2 . . . A 136 ILE HG12 . 17750 1 1129 . 1 1 112 112 ILE HG13 H 1 1.632 0.04 . 2 . . . A 136 ILE HG13 . 17750 1 1130 . 1 1 112 112 ILE HG21 H 1 1.323 0.04 . 1 . . . A 136 ILE HG21 . 17750 1 1131 . 1 1 112 112 ILE HG22 H 1 1.323 0.04 . 1 . . . A 136 ILE HG22 . 17750 1 1132 . 1 1 112 112 ILE HG23 H 1 1.323 0.04 . 1 . . . A 136 ILE HG23 . 17750 1 1133 . 1 1 112 112 ILE HD11 H 1 1.016 0.04 . 1 . . . A 136 ILE HD11 . 17750 1 1134 . 1 1 112 112 ILE HD12 H 1 1.016 0.04 . 1 . . . A 136 ILE HD12 . 17750 1 1135 . 1 1 112 112 ILE HD13 H 1 1.016 0.04 . 1 . . . A 136 ILE HD13 . 17750 1 1136 . 1 1 112 112 ILE C C 13 173.819 0.40 . 1 . . . A 136 ILE C . 17750 1 1137 . 1 1 112 112 ILE CA C 13 61.054 0.40 . 1 . . . A 136 ILE CA . 17750 1 1138 . 1 1 112 112 ILE CB C 13 42.602 0.40 . 1 . . . A 136 ILE CB . 17750 1 1139 . 1 1 112 112 ILE CG1 C 13 29.488 0.40 . 1 . . . A 136 ILE CG1 . 17750 1 1140 . 1 1 112 112 ILE CG2 C 13 20.621 0.40 . 1 . . . A 136 ILE CG2 . 17750 1 1141 . 1 1 112 112 ILE CD1 C 13 16.290 0.40 . 1 . . . A 136 ILE CD1 . 17750 1 1142 . 1 1 112 112 ILE N N 15 125.377 0.40 . 1 . . . A 136 ILE N . 17750 1 1143 . 1 1 113 113 LYS H H 1 8.452 0.04 . 1 . . . A 137 LYS H . 17750 1 1144 . 1 1 113 113 LYS HA H 1 4.926 0.04 . 1 . . . A 137 LYS HA . 17750 1 1145 . 1 1 113 113 LYS HB2 H 1 1.638 0.04 . 2 . . . A 137 LYS HB2 . 17750 1 1146 . 1 1 113 113 LYS HB3 H 1 1.433 0.04 . 2 . . . A 137 LYS HB3 . 17750 1 1147 . 1 1 113 113 LYS HG2 H 1 1.436 0.04 . 2 . . . A 137 LYS HG2 . 17750 1 1148 . 1 1 113 113 LYS HG3 H 1 1.246 0.04 . 2 . . . A 137 LYS HG3 . 17750 1 1149 . 1 1 113 113 LYS HD2 H 1 1.558 0.04 . 2 . . . A 137 LYS HD2 . 17750 1 1150 . 1 1 113 113 LYS HD3 H 1 1.558 0.04 . 2 . . . A 137 LYS HD3 . 17750 1 1151 . 1 1 113 113 LYS HE2 H 1 2.875 0.04 . 2 . . . A 137 LYS HE2 . 17750 1 1152 . 1 1 113 113 LYS HE3 H 1 2.875 0.04 . 2 . . . A 137 LYS HE3 . 17750 1 1153 . 1 1 113 113 LYS C C 13 175.279 0.40 . 1 . . . A 137 LYS C . 17750 1 1154 . 1 1 113 113 LYS CA C 13 55.868 0.40 . 1 . . . A 137 LYS CA . 17750 1 1155 . 1 1 113 113 LYS CB C 13 33.938 0.40 . 1 . . . A 137 LYS CB . 17750 1 1156 . 1 1 113 113 LYS CG C 13 25.702 0.40 . 1 . . . A 137 LYS CG . 17750 1 1157 . 1 1 113 113 LYS CD C 13 29.297 0.40 . 1 . . . A 137 LYS CD . 17750 1 1158 . 1 1 113 113 LYS CE C 13 42.454 0.40 . 1 . . . A 137 LYS CE . 17750 1 1159 . 1 1 113 113 LYS N N 15 127.420 0.40 . 1 . . . A 137 LYS N . 17750 1 1160 . 1 1 114 114 ILE H H 1 8.936 0.04 . 1 . . . A 138 ILE H . 17750 1 1161 . 1 1 114 114 ILE HA H 1 5.057 0.04 . 1 . . . A 138 ILE HA . 17750 1 1162 . 1 1 114 114 ILE HB H 1 1.622 0.04 . 1 . . . A 138 ILE HB . 17750 1 1163 . 1 1 114 114 ILE HG21 H 1 0.850 0.04 . 1 . . . A 138 ILE HG21 . 17750 1 1164 . 1 1 114 114 ILE HG22 H 1 0.850 0.04 . 1 . . . A 138 ILE HG22 . 17750 1 1165 . 1 1 114 114 ILE HG23 H 1 0.850 0.04 . 1 . . . A 138 ILE HG23 . 17750 1 1166 . 1 1 114 114 ILE HD11 H 1 0.282 0.04 . 1 . . . A 138 ILE HD11 . 17750 1 1167 . 1 1 114 114 ILE HD12 H 1 0.282 0.04 . 1 . . . A 138 ILE HD12 . 17750 1 1168 . 1 1 114 114 ILE HD13 H 1 0.282 0.04 . 1 . . . A 138 ILE HD13 . 17750 1 1169 . 1 1 114 114 ILE C C 13 174.392 0.40 . 1 . . . A 138 ILE C . 17750 1 1170 . 1 1 114 114 ILE CA C 13 58.570 0.40 . 1 . . . A 138 ILE CA . 17750 1 1171 . 1 1 114 114 ILE CB C 13 42.848 0.40 . 1 . . . A 138 ILE CB . 17750 1 1172 . 1 1 114 114 ILE CG2 C 13 18.633 0.40 . 1 . . . A 138 ILE CG2 . 17750 1 1173 . 1 1 114 114 ILE CD1 C 13 14.955 0.40 . 1 . . . A 138 ILE CD1 . 17750 1 1174 . 1 1 114 114 ILE N N 15 115.689 0.40 . 1 . . . A 138 ILE N . 17750 1 1175 . 1 1 115 115 CYS H H 1 9.060 0.04 . 1 . . . A 139 CYS H . 17750 1 1176 . 1 1 115 115 CYS HA H 1 4.483 0.04 . 1 . . . A 139 CYS HA . 17750 1 1177 . 1 1 115 115 CYS HB2 H 1 2.806 0.04 . 2 . . . A 139 CYS HB2 . 17750 1 1178 . 1 1 115 115 CYS HB3 H 1 2.806 0.04 . 2 . . . A 139 CYS HB3 . 17750 1 1179 . 1 1 115 115 CYS C C 13 170.540 0.40 . 1 . . . A 139 CYS C . 17750 1 1180 . 1 1 115 115 CYS CA C 13 56.141 0.40 . 1 . . . A 139 CYS CA . 17750 1 1181 . 1 1 115 115 CYS CB C 13 31.383 0.40 . 1 . . . A 139 CYS CB . 17750 1 1182 . 1 1 115 115 CYS N N 15 111.331 0.40 . 1 . . . A 139 CYS N . 17750 1 1183 . 1 1 116 116 PHE H H 1 8.317 0.04 . 1 . . . A 140 PHE H . 17750 1 1184 . 1 1 116 116 PHE HA H 1 5.813 0.04 . 1 . . . A 140 PHE HA . 17750 1 1185 . 1 1 116 116 PHE HB2 H 1 2.574 0.04 . 2 . . . A 140 PHE HB2 . 17750 1 1186 . 1 1 116 116 PHE HB3 H 1 2.509 0.04 . 2 . . . A 140 PHE HB3 . 17750 1 1187 . 1 1 116 116 PHE HD1 H 1 6.361 0.04 . 3 . . . A 140 PHE HD1 . 17750 1 1188 . 1 1 116 116 PHE HD2 H 1 6.361 0.04 . 3 . . . A 140 PHE HD2 . 17750 1 1189 . 1 1 116 116 PHE HE1 H 1 6.904 0.04 . 3 . . . A 140 PHE HE1 . 17750 1 1190 . 1 1 116 116 PHE HE2 H 1 6.904 0.04 . 3 . . . A 140 PHE HE2 . 17750 1 1191 . 1 1 116 116 PHE C C 13 175.102 0.40 . 1 . . . A 140 PHE C . 17750 1 1192 . 1 1 116 116 PHE CA C 13 55.813 0.40 . 1 . . . A 140 PHE CA . 17750 1 1193 . 1 1 116 116 PHE CB C 13 40.855 0.40 . 1 . . . A 140 PHE CB . 17750 1 1194 . 1 1 116 116 PHE CD1 C 13 131.102 0.40 . 3 . . . A 140 PHE CD1 . 17750 1 1195 . 1 1 116 116 PHE CD2 C 13 131.102 0.40 . 3 . . . A 140 PHE CD2 . 17750 1 1196 . 1 1 116 116 PHE CE1 C 13 130.710 0.40 . 3 . . . A 140 PHE CE1 . 17750 1 1197 . 1 1 116 116 PHE CE2 C 13 130.710 0.40 . 3 . . . A 140 PHE CE2 . 17750 1 1198 . 1 1 116 116 PHE N N 15 116.098 0.40 . 1 . . . A 140 PHE N . 17750 1 1199 . 1 1 117 117 LYS H H 1 8.850 0.04 . 1 . . . A 141 LYS H . 17750 1 1200 . 1 1 117 117 LYS HA H 1 4.900 0.04 . 1 . . . A 141 LYS HA . 17750 1 1201 . 1 1 117 117 LYS HD2 H 1 1.053 0.04 . 2 . . . A 141 LYS HD2 . 17750 1 1202 . 1 1 117 117 LYS HD3 H 1 0.632 0.04 . 2 . . . A 141 LYS HD3 . 17750 1 1203 . 1 1 117 117 LYS HE2 H 1 2.488 0.04 . 2 . . . A 141 LYS HE2 . 17750 1 1204 . 1 1 117 117 LYS HE3 H 1 2.234 0.04 . 2 . . . A 141 LYS HE3 . 17750 1 1205 . 1 1 117 117 LYS C C 13 172.768 0.40 . 1 . . . A 141 LYS C . 17750 1 1206 . 1 1 117 117 LYS CA C 13 55.486 0.40 . 1 . . . A 141 LYS CA . 17750 1 1207 . 1 1 117 117 LYS CD C 13 29.004 0.40 . 1 . . . A 141 LYS CD . 17750 1 1208 . 1 1 117 117 LYS CE C 13 43.048 0.40 . 1 . . . A 141 LYS CE . 17750 1 1209 . 1 1 117 117 LYS N N 15 118.890 0.40 . 1 . . . A 141 LYS N . 17750 1 1210 . 1 1 118 118 TYR H H 1 8.048 0.04 . 1 . . . A 142 TYR H . 17750 1 1211 . 1 1 118 118 TYR HA H 1 4.585 0.04 . 1 . . . A 142 TYR HA . 17750 1 1212 . 1 1 118 118 TYR HB2 H 1 2.797 0.04 . 2 . . . A 142 TYR HB2 . 17750 1 1213 . 1 1 118 118 TYR HB3 H 1 2.449 0.04 . 2 . . . A 142 TYR HB3 . 17750 1 1214 . 1 1 118 118 TYR HD1 H 1 6.191 0.04 . 3 . . . A 142 TYR HD1 . 17750 1 1215 . 1 1 118 118 TYR HD2 H 1 6.191 0.04 . 3 . . . A 142 TYR HD2 . 17750 1 1216 . 1 1 118 118 TYR HE1 H 1 6.651 0.04 . 3 . . . A 142 TYR HE1 . 17750 1 1217 . 1 1 118 118 TYR HE2 H 1 6.651 0.04 . 3 . . . A 142 TYR HE2 . 17750 1 1218 . 1 1 118 118 TYR C C 13 173.969 0.40 . 1 . . . A 142 TYR C . 17750 1 1219 . 1 1 118 118 TYR CA C 13 55.704 0.40 . 1 . . . A 142 TYR CA . 17750 1 1220 . 1 1 118 118 TYR CB C 13 40.637 0.40 . 1 . . . A 142 TYR CB . 17750 1 1221 . 1 1 118 118 TYR CD1 C 13 131.402 0.40 . 3 . . . A 142 TYR CD1 . 17750 1 1222 . 1 1 118 118 TYR CD2 C 13 131.402 0.40 . 3 . . . A 142 TYR CD2 . 17750 1 1223 . 1 1 118 118 TYR CE1 C 13 117.702 0.40 . 3 . . . A 142 TYR CE1 . 17750 1 1224 . 1 1 118 118 TYR CE2 C 13 117.702 0.40 . 3 . . . A 142 TYR CE2 . 17750 1 1225 . 1 1 118 118 TYR N N 15 123.283 0.40 . 1 . . . A 142 TYR N . 17750 1 1226 . 1 1 119 119 TYR H H 1 8.525 0.04 . 1 . . . A 143 TYR H . 17750 1 1227 . 1 1 119 119 TYR HA H 1 4.803 0.04 . 1 . . . A 143 TYR HA . 17750 1 1228 . 1 1 119 119 TYR HB2 H 1 1.971 0.04 . 2 . . . A 143 TYR HB2 . 17750 1 1229 . 1 1 119 119 TYR HB3 H 1 0.646 0.04 . 2 . . . A 143 TYR HB3 . 17750 1 1230 . 1 1 119 119 TYR HE1 H 1 6.496 0.04 . 3 . . . A 143 TYR HE1 . 17750 1 1231 . 1 1 119 119 TYR HE2 H 1 6.496 0.04 . 3 . . . A 143 TYR HE2 . 17750 1 1232 . 1 1 119 119 TYR C C 13 173.928 0.40 . 1 . . . A 143 TYR C . 17750 1 1233 . 1 1 119 119 TYR CA C 13 56.959 0.40 . 1 . . . A 143 TYR CA . 17750 1 1234 . 1 1 119 119 TYR CB C 13 41.613 0.40 . 1 . . . A 143 TYR CB . 17750 1 1235 . 1 1 119 119 TYR CE1 C 13 117.712 0.40 . 3 . . . A 143 TYR CE1 . 17750 1 1236 . 1 1 119 119 TYR CE2 C 13 117.712 0.40 . 3 . . . A 143 TYR CE2 . 17750 1 1237 . 1 1 119 119 TYR N N 15 129.088 0.40 . 1 . . . A 143 TYR N . 17750 1 1238 . 1 1 120 120 HIS H H 1 8.638 0.04 . 1 . . . A 144 HIS H . 17750 1 1239 . 1 1 120 120 HIS HB2 H 1 3.137 0.04 . 2 . . . A 144 HIS HB2 . 17750 1 1240 . 1 1 120 120 HIS HB3 H 1 2.940 0.04 . 2 . . . A 144 HIS HB3 . 17750 1 1241 . 1 1 120 120 HIS CB C 13 32.830 0.40 . 1 . . . A 144 HIS CB . 17750 1 1242 . 1 1 120 120 HIS N N 15 119.682 0.40 . 1 . . . A 144 HIS N . 17750 1 1243 . 1 1 122 122 ILE HA H 1 3.749 0.04 . 1 . . . A 146 ILE HA . 17750 1 1244 . 1 1 122 122 ILE HB H 1 0.737 0.04 . 1 . . . A 146 ILE HB . 17750 1 1245 . 1 1 122 122 ILE HG12 H 1 0.731 0.04 . 2 . . . A 146 ILE HG12 . 17750 1 1246 . 1 1 122 122 ILE HG13 H 1 1.110 0.04 . 2 . . . A 146 ILE HG13 . 17750 1 1247 . 1 1 122 122 ILE HG21 H 1 0.720 0.04 . 1 . . . A 146 ILE HG21 . 17750 1 1248 . 1 1 122 122 ILE HG22 H 1 0.720 0.04 . 1 . . . A 146 ILE HG22 . 17750 1 1249 . 1 1 122 122 ILE HG23 H 1 0.720 0.04 . 1 . . . A 146 ILE HG23 . 17750 1 1250 . 1 1 122 122 ILE HD11 H 1 0.589 0.04 . 1 . . . A 146 ILE HD11 . 17750 1 1251 . 1 1 122 122 ILE HD12 H 1 0.589 0.04 . 1 . . . A 146 ILE HD12 . 17750 1 1252 . 1 1 122 122 ILE HD13 H 1 0.589 0.04 . 1 . . . A 146 ILE HD13 . 17750 1 1253 . 1 1 122 122 ILE CA C 13 60.787 0.40 . 1 . . . A 146 ILE CA . 17750 1 1254 . 1 1 122 122 ILE CB C 13 37.170 0.40 . 1 . . . A 146 ILE CB . 17750 1 1255 . 1 1 122 122 ILE CG1 C 13 26.873 0.40 . 1 . . . A 146 ILE CG1 . 17750 1 1256 . 1 1 122 122 ILE CG2 C 13 16.549 0.40 . 1 . . . A 146 ILE CG2 . 17750 1 1257 . 1 1 122 122 ILE CD1 C 13 10.148 0.40 . 1 . . . A 146 ILE CD1 . 17750 1 1258 . 1 1 123 123 SER HA H 1 4.387 0.04 . 1 . . . A 147 SER HA . 17750 1 1259 . 1 1 123 123 SER HB2 H 1 3.827 0.04 . 2 . . . A 147 SER HB2 . 17750 1 1260 . 1 1 123 123 SER HB3 H 1 3.827 0.04 . 2 . . . A 147 SER HB3 . 17750 1 1261 . 1 1 123 123 SER C C 13 175.074 0.40 . 1 . . . A 147 SER C . 17750 1 1262 . 1 1 123 123 SER CA C 13 58.706 0.40 . 1 . . . A 147 SER CA . 17750 1 1263 . 1 1 123 123 SER CB C 13 63.947 0.40 . 1 . . . A 147 SER CB . 17750 1 1264 . 1 1 124 124 GLY H H 1 8.413 0.04 . 1 . . . A 148 GLY H . 17750 1 1265 . 1 1 124 124 GLY HA2 H 1 4.216 0.04 . 2 . . . A 148 GLY HA2 . 17750 1 1266 . 1 1 124 124 GLY HA3 H 1 3.945 0.04 . 2 . . . A 148 GLY HA3 . 17750 1 1267 . 1 1 124 124 GLY C C 13 173.614 0.40 . 1 . . . A 148 GLY C . 17750 1 1268 . 1 1 124 124 GLY CA C 13 45.782 0.40 . 1 . . . A 148 GLY CA . 17750 1 1269 . 1 1 124 124 GLY N N 15 110.973 0.40 . 1 . . . A 148 GLY N . 17750 1 1270 . 1 1 125 125 ALA H H 1 7.809 0.04 . 1 . . . A 149 ALA H . 17750 1 1271 . 1 1 125 125 ALA HA H 1 4.122 0.04 . 1 . . . A 149 ALA HA . 17750 1 1272 . 1 1 125 125 ALA HB1 H 1 1.229 0.04 . 1 . . . A 149 ALA HB1 . 17750 1 1273 . 1 1 125 125 ALA HB2 H 1 1.229 0.04 . 1 . . . A 149 ALA HB2 . 17750 1 1274 . 1 1 125 125 ALA HB3 H 1 1.229 0.04 . 1 . . . A 149 ALA HB3 . 17750 1 1275 . 1 1 125 125 ALA C C 13 177.163 0.40 . 1 . . . A 149 ALA C . 17750 1 1276 . 1 1 125 125 ALA CA C 13 53.002 0.40 . 1 . . . A 149 ALA CA . 17750 1 1277 . 1 1 125 125 ALA CB C 13 19.728 0.40 . 1 . . . A 149 ALA CB . 17750 1 1278 . 1 1 125 125 ALA N N 15 121.989 0.40 . 1 . . . A 149 ALA N . 17750 1 1279 . 1 1 126 126 LEU H H 1 8.417 0.04 . 1 . . . A 150 LEU H . 17750 1 1280 . 1 1 126 126 LEU HA H 1 3.850 0.04 . 1 . . . A 150 LEU HA . 17750 1 1281 . 1 1 126 126 LEU HB2 H 1 1.292 0.04 . 2 . . . A 150 LEU HB2 . 17750 1 1282 . 1 1 126 126 LEU HB3 H 1 1.628 0.04 . 2 . . . A 150 LEU HB3 . 17750 1 1283 . 1 1 126 126 LEU HG H 1 0.878 0.04 . 1 . . . A 150 LEU HG . 17750 1 1284 . 1 1 126 126 LEU HD11 H 1 0.603 0.04 . 2 . . . A 150 LEU HD11 . 17750 1 1285 . 1 1 126 126 LEU HD12 H 1 0.603 0.04 . 2 . . . A 150 LEU HD12 . 17750 1 1286 . 1 1 126 126 LEU HD13 H 1 0.603 0.04 . 2 . . . A 150 LEU HD13 . 17750 1 1287 . 1 1 126 126 LEU HD21 H 1 0.140 0.04 . 2 . . . A 150 LEU HD21 . 17750 1 1288 . 1 1 126 126 LEU HD22 H 1 0.140 0.04 . 2 . . . A 150 LEU HD22 . 17750 1 1289 . 1 1 126 126 LEU HD23 H 1 0.140 0.04 . 2 . . . A 150 LEU HD23 . 17750 1 1290 . 1 1 126 126 LEU C C 13 177.749 0.40 . 1 . . . A 150 LEU C . 17750 1 1291 . 1 1 126 126 LEU CA C 13 54.831 0.40 . 1 . . . A 150 LEU CA . 17750 1 1292 . 1 1 126 126 LEU CB C 13 41.855 0.40 . 1 . . . A 150 LEU CB . 17750 1 1293 . 1 1 126 126 LEU CG C 13 26.982 0.40 . 1 . . . A 150 LEU CG . 17750 1 1294 . 1 1 126 126 LEU CD1 C 13 26.383 0.40 . 2 . . . A 150 LEU CD1 . 17750 1 1295 . 1 1 126 126 LEU CD2 C 13 22.651 0.40 . 2 . . . A 150 LEU CD2 . 17750 1 1296 . 1 1 126 126 LEU N N 15 123.725 0.40 . 1 . . . A 150 LEU N . 17750 1 1297 . 1 1 127 127 ARG H H 1 9.419 0.04 . 1 . . . A 151 ARG H . 17750 1 1298 . 1 1 127 127 ARG HA H 1 4.292 0.04 . 1 . . . A 151 ARG HA . 17750 1 1299 . 1 1 127 127 ARG HB2 H 1 1.637 0.04 . 2 . . . A 151 ARG HB2 . 17750 1 1300 . 1 1 127 127 ARG HB3 H 1 1.507 0.04 . 2 . . . A 151 ARG HB3 . 17750 1 1301 . 1 1 127 127 ARG C C 13 176.671 0.40 . 1 . . . A 151 ARG C . 17750 1 1302 . 1 1 127 127 ARG CA C 13 54.721 0.40 . 1 . . . A 151 ARG CA . 17750 1 1303 . 1 1 127 127 ARG CB C 13 32.830 0.40 . 1 . . . A 151 ARG CB . 17750 1 1304 . 1 1 127 127 ARG N N 15 124.270 0.40 . 1 . . . A 151 ARG N . 17750 1 1305 . 1 1 128 128 ALA H H 1 6.964 0.04 . 1 . . . A 152 ALA H . 17750 1 1306 . 1 1 128 128 ALA HA H 1 4.339 0.04 . 1 . . . A 152 ALA HA . 17750 1 1307 . 1 1 128 128 ALA HB1 H 1 0.967 0.04 . 1 . . . A 152 ALA HB1 . 17750 1 1308 . 1 1 128 128 ALA HB2 H 1 0.967 0.04 . 1 . . . A 152 ALA HB2 . 17750 1 1309 . 1 1 128 128 ALA HB3 H 1 0.967 0.04 . 1 . . . A 152 ALA HB3 . 17750 1 1310 . 1 1 128 128 ALA C C 13 173.778 0.40 . 1 . . . A 152 ALA C . 17750 1 1311 . 1 1 128 128 ALA CA C 13 52.155 0.40 . 1 . . . A 152 ALA CA . 17750 1 1312 . 1 1 128 128 ALA CB C 13 22.212 0.40 . 1 . . . A 152 ALA CB . 17750 1 1313 . 1 1 128 128 ALA N N 15 115.417 0.40 . 1 . . . A 152 ALA N . 17750 1 1314 . 1 1 129 129 THR H H 1 8.097 0.04 . 1 . . . A 153 THR H . 17750 1 1315 . 1 1 129 129 THR HA H 1 5.231 0.04 . 1 . . . A 153 THR HA . 17750 1 1316 . 1 1 129 129 THR HB H 1 3.609 0.04 . 1 . . . A 153 THR HB . 17750 1 1317 . 1 1 129 129 THR HG21 H 1 1.327 0.04 . 1 . . . A 153 THR HG21 . 17750 1 1318 . 1 1 129 129 THR HG22 H 1 1.327 0.04 . 1 . . . A 153 THR HG22 . 17750 1 1319 . 1 1 129 129 THR HG23 H 1 1.327 0.04 . 1 . . . A 153 THR HG23 . 17750 1 1320 . 1 1 129 129 THR C C 13 175.334 0.40 . 1 . . . A 153 THR C . 17750 1 1321 . 1 1 129 129 THR CA C 13 61.271 0.40 . 1 . . . A 153 THR CA . 17750 1 1322 . 1 1 129 129 THR CB C 13 72.245 0.40 . 1 . . . A 153 THR CB . 17750 1 1323 . 1 1 129 129 THR CG2 C 13 21.139 0.40 . 1 . . . A 153 THR CG2 . 17750 1 1324 . 1 1 129 129 THR N N 15 115.928 0.40 . 1 . . . A 153 THR N . 17750 1 1325 . 1 1 130 130 THR H H 1 9.236 0.04 . 1 . . . A 154 THR H . 17750 1 1326 . 1 1 130 130 THR HA H 1 5.314 0.04 . 1 . . . A 154 THR HA . 17750 1 1327 . 1 1 130 130 THR HB H 1 4.675 0.04 . 1 . . . A 154 THR HB . 17750 1 1328 . 1 1 130 130 THR HG21 H 1 1.231 0.04 . 1 . . . A 154 THR HG21 . 17750 1 1329 . 1 1 130 130 THR HG22 H 1 1.231 0.04 . 1 . . . A 154 THR HG22 . 17750 1 1330 . 1 1 130 130 THR HG23 H 1 1.231 0.04 . 1 . . . A 154 THR HG23 . 17750 1 1331 . 1 1 130 130 THR CA C 13 61.019 0.40 . 1 . . . A 154 THR CA . 17750 1 1332 . 1 1 130 130 THR CB C 13 70.280 0.40 . 1 . . . A 154 THR CB . 17750 1 1333 . 1 1 130 130 THR CG2 C 13 21.602 0.40 . 1 . . . A 154 THR CG2 . 17750 1 1334 . 1 1 130 130 THR N N 15 118.992 0.40 . 1 . . . A 154 THR N . 17750 1 1335 . 1 1 131 131 PRO HA H 1 4.449 0.04 . 1 . . . A 155 PRO HA . 17750 1 1336 . 1 1 131 131 PRO HB2 H 1 2.197 0.04 . 2 . . . A 155 PRO HB2 . 17750 1 1337 . 1 1 131 131 PRO HB3 H 1 1.480 0.04 . 2 . . . A 155 PRO HB3 . 17750 1 1338 . 1 1 131 131 PRO HD2 H 1 3.863 0.04 . 2 . . . A 155 PRO HD2 . 17750 1 1339 . 1 1 131 131 PRO HD3 H 1 4.096 0.04 . 2 . . . A 155 PRO HD3 . 17750 1 1340 . 1 1 131 131 PRO C C 13 174.815 0.40 . 1 . . . A 155 PRO C . 17750 1 1341 . 1 1 131 131 PRO CA C 13 62.637 0.40 . 1 . . . A 155 PRO CA . 17750 1 1342 . 1 1 131 131 PRO CB C 13 32.166 0.40 . 1 . . . A 155 PRO CB . 17750 1 1343 . 1 1 131 131 PRO CD C 13 50.763 0.40 . 1 . . . A 155 PRO CD . 17750 1 1344 . 1 1 132 132 CYS H H 1 8.110 0.04 . 1 . . . A 156 CYS H . 17750 1 1345 . 1 1 132 132 CYS HA H 1 4.251 0.04 . 1 . . . A 156 CYS HA . 17750 1 1346 . 1 1 132 132 CYS HB2 H 1 2.797 0.04 . 2 . . . A 156 CYS HB2 . 17750 1 1347 . 1 1 132 132 CYS HB3 H 1 2.731 0.04 . 2 . . . A 156 CYS HB3 . 17750 1 1348 . 1 1 132 132 CYS C C 13 174.774 0.40 . 1 . . . A 156 CYS C . 17750 1 1349 . 1 1 132 132 CYS CA C 13 59.198 0.40 . 1 . . . A 156 CYS CA . 17750 1 1350 . 1 1 132 132 CYS CB C 13 27.762 0.40 . 1 . . . A 156 CYS CB . 17750 1 1351 . 1 1 132 132 CYS N N 15 119.469 0.40 . 1 . . . A 156 CYS N . 17750 1 1352 . 1 1 133 133 ILE H H 1 9.328 0.04 . 1 . . . A 157 ILE H . 17750 1 1353 . 1 1 133 133 ILE HA H 1 4.728 0.04 . 1 . . . A 157 ILE HA . 17750 1 1354 . 1 1 133 133 ILE HB H 1 1.536 0.04 . 1 . . . A 157 ILE HB . 17750 1 1355 . 1 1 133 133 ILE HG12 H 1 2.028 0.04 . 2 . . . A 157 ILE HG12 . 17750 1 1356 . 1 1 133 133 ILE HG13 H 1 1.176 0.04 . 2 . . . A 157 ILE HG13 . 17750 1 1357 . 1 1 133 133 ILE HG21 H 1 0.488 0.04 . 1 . . . A 157 ILE HG21 . 17750 1 1358 . 1 1 133 133 ILE HG22 H 1 0.488 0.04 . 1 . . . A 157 ILE HG22 . 17750 1 1359 . 1 1 133 133 ILE HG23 H 1 0.488 0.04 . 1 . . . A 157 ILE HG23 . 17750 1 1360 . 1 1 133 133 ILE HD11 H 1 1.008 0.04 . 1 . . . A 157 ILE HD11 . 17750 1 1361 . 1 1 133 133 ILE HD12 H 1 1.008 0.04 . 1 . . . A 157 ILE HD12 . 17750 1 1362 . 1 1 133 133 ILE HD13 H 1 1.008 0.04 . 1 . . . A 157 ILE HD13 . 17750 1 1363 . 1 1 133 133 ILE C C 13 175.020 0.40 . 1 . . . A 157 ILE C . 17750 1 1364 . 1 1 133 133 ILE CA C 13 60.290 0.40 . 1 . . . A 157 ILE CA . 17750 1 1365 . 1 1 133 133 ILE CB C 13 41.019 0.40 . 1 . . . A 157 ILE CB . 17750 1 1366 . 1 1 133 133 ILE CG1 C 13 29.978 0.40 . 1 . . . A 157 ILE CG1 . 17750 1 1367 . 1 1 133 133 ILE CG2 C 13 16.998 0.40 . 1 . . . A 157 ILE CG2 . 17750 1 1368 . 1 1 133 133 ILE CD1 C 13 16.481 0.40 . 1 . . . A 157 ILE CD1 . 17750 1 1369 . 1 1 133 133 ILE N N 15 131.216 0.40 . 1 . . . A 157 ILE N . 17750 1 1370 . 1 1 134 134 THR H H 1 8.418 0.04 . 1 . . . A 158 THR H . 17750 1 1371 . 1 1 134 134 THR HA H 1 4.544 0.04 . 1 . . . A 158 THR HA . 17750 1 1372 . 1 1 134 134 THR HB H 1 4.101 0.04 . 1 . . . A 158 THR HB . 17750 1 1373 . 1 1 134 134 THR HG21 H 1 1.024 0.04 . 1 . . . A 158 THR HG21 . 17750 1 1374 . 1 1 134 134 THR HG22 H 1 1.024 0.04 . 1 . . . A 158 THR HG22 . 17750 1 1375 . 1 1 134 134 THR HG23 H 1 1.024 0.04 . 1 . . . A 158 THR HG23 . 17750 1 1376 . 1 1 134 134 THR C C 13 173.191 0.40 . 1 . . . A 158 THR C . 17750 1 1377 . 1 1 134 134 THR CA C 13 63.210 0.40 . 1 . . . A 158 THR CA . 17750 1 1378 . 1 1 134 134 THR CB C 13 69.380 0.40 . 1 . . . A 158 THR CB . 17750 1 1379 . 1 1 134 134 THR CG2 C 13 21.602 0.40 . 1 . . . A 158 THR CG2 . 17750 1 1380 . 1 1 134 134 THR N N 15 123.742 0.40 . 1 . . . A 158 THR N . 17750 1 1381 . 1 1 135 135 VAL H H 1 9.567 0.04 . 1 . . . A 159 VAL H . 17750 1 1382 . 1 1 135 135 VAL HA H 1 5.001 0.04 . 1 . . . A 159 VAL HA . 17750 1 1383 . 1 1 135 135 VAL HB H 1 2.183 0.04 . 1 . . . A 159 VAL HB . 17750 1 1384 . 1 1 135 135 VAL HG11 H 1 0.786 0.04 . 2 . . . A 159 VAL HG11 . 17750 1 1385 . 1 1 135 135 VAL HG12 H 1 0.786 0.04 . 2 . . . A 159 VAL HG12 . 17750 1 1386 . 1 1 135 135 VAL HG13 H 1 0.786 0.04 . 2 . . . A 159 VAL HG13 . 17750 1 1387 . 1 1 135 135 VAL HG21 H 1 0.608 0.04 . 2 . . . A 159 VAL HG21 . 17750 1 1388 . 1 1 135 135 VAL HG22 H 1 0.608 0.04 . 2 . . . A 159 VAL HG22 . 17750 1 1389 . 1 1 135 135 VAL HG23 H 1 0.608 0.04 . 2 . . . A 159 VAL HG23 . 17750 1 1390 . 1 1 135 135 VAL C C 13 175.388 0.40 . 1 . . . A 159 VAL C . 17750 1 1391 . 1 1 135 135 VAL CA C 13 60.999 0.40 . 1 . . . A 159 VAL CA . 17750 1 1392 . 1 1 135 135 VAL CB C 13 32.011 0.40 . 1 . . . A 159 VAL CB . 17750 1 1393 . 1 1 135 135 VAL CG1 C 13 22.406 0.40 . 2 . . . A 159 VAL CG1 . 17750 1 1394 . 1 1 135 135 VAL CG2 C 13 21.561 0.40 . 2 . . . A 159 VAL CG2 . 17750 1 1395 . 1 1 135 135 VAL N N 15 130.195 0.40 . 1 . . . A 159 VAL N . 17750 1 1396 . 1 1 136 136 LYS H H 1 9.312 0.04 . 1 . . . A 160 LYS H . 17750 1 1397 . 1 1 136 136 LYS HA H 1 5.026 0.04 . 1 . . . A 160 LYS HA . 17750 1 1398 . 1 1 136 136 LYS HB2 H 1 1.834 0.04 . 2 . . . A 160 LYS HB2 . 17750 1 1399 . 1 1 136 136 LYS HB3 H 1 1.773 0.04 . 2 . . . A 160 LYS HB3 . 17750 1 1400 . 1 1 136 136 LYS HG2 H 1 1.352 0.04 . 2 . . . A 160 LYS HG2 . 17750 1 1401 . 1 1 136 136 LYS HG3 H 1 1.300 0.04 . 2 . . . A 160 LYS HG3 . 17750 1 1402 . 1 1 136 136 LYS HD2 H 1 1.542 0.04 . 2 . . . A 160 LYS HD2 . 17750 1 1403 . 1 1 136 136 LYS HD3 H 1 1.542 0.04 . 2 . . . A 160 LYS HD3 . 17750 1 1404 . 1 1 136 136 LYS HE2 H 1 2.759 0.04 . 2 . . . A 160 LYS HE2 . 17750 1 1405 . 1 1 136 136 LYS HE3 H 1 2.759 0.04 . 2 . . . A 160 LYS HE3 . 17750 1 1406 . 1 1 136 136 LYS C C 13 175.293 0.40 . 1 . . . A 160 LYS C . 17750 1 1407 . 1 1 136 136 LYS CA C 13 54.803 0.40 . 1 . . . A 160 LYS CA . 17750 1 1408 . 1 1 136 136 LYS CB C 13 34.648 0.40 . 1 . . . A 160 LYS CB . 17750 1 1409 . 1 1 136 136 LYS CG C 13 25.566 0.40 . 1 . . . A 160 LYS CG . 17750 1 1410 . 1 1 136 136 LYS CD C 13 29.202 0.40 . 1 . . . A 160 LYS CD . 17750 1 1411 . 1 1 136 136 LYS CE C 13 41.964 0.40 . 1 . . . A 160 LYS CE . 17750 1 1412 . 1 1 136 136 LYS N N 15 126.313 0.40 . 1 . . . A 160 LYS N . 17750 1 1413 . 1 1 137 137 ASN H H 1 8.235 0.04 . 1 . . . A 161 ASN H . 17750 1 1414 . 1 1 137 137 ASN HA H 1 5.089 0.04 . 1 . . . A 161 ASN HA . 17750 1 1415 . 1 1 137 137 ASN HB2 H 1 3.027 0.04 . 2 . . . A 161 ASN HB2 . 17750 1 1416 . 1 1 137 137 ASN HB3 H 1 2.309 0.04 . 2 . . . A 161 ASN HB3 . 17750 1 1417 . 1 1 137 137 ASN HD21 H 1 6.601 0.04 . 2 . . . A 161 ASN HD21 . 17750 1 1418 . 1 1 137 137 ASN HD22 H 1 7.047 0.04 . 2 . . . A 161 ASN HD22 . 17750 1 1419 . 1 1 137 137 ASN CA C 13 50.368 0.40 . 1 . . . A 161 ASN CA . 17750 1 1420 . 1 1 137 137 ASN CB C 13 39.867 0.40 . 1 . . . A 161 ASN CB . 17750 1 1421 . 1 1 137 137 ASN N N 15 121.529 0.40 . 1 . . . A 161 ASN N . 17750 1 1422 . 1 1 137 137 ASN ND2 N 15 112.000 0.40 . 1 . . . A 161 ASN ND2 . 17750 1 1423 . 1 1 138 138 PRO HA H 1 4.149 0.04 . 1 . . . A 162 PRO HA . 17750 1 1424 . 1 1 138 138 PRO HB2 H 1 2.086 0.04 . 2 . . . A 162 PRO HB2 . 17750 1 1425 . 1 1 138 138 PRO HB3 H 1 1.867 0.04 . 2 . . . A 162 PRO HB3 . 17750 1 1426 . 1 1 138 138 PRO HG2 H 1 1.871 0.04 . 2 . . . A 162 PRO HG2 . 17750 1 1427 . 1 1 138 138 PRO HG3 H 1 1.914 0.04 . 2 . . . A 162 PRO HG3 . 17750 1 1428 . 1 1 138 138 PRO HD2 H 1 3.804 0.04 . 2 . . . A 162 PRO HD2 . 17750 1 1429 . 1 1 138 138 PRO HD3 H 1 3.592 0.04 . 2 . . . A 162 PRO HD3 . 17750 1 1430 . 1 1 138 138 PRO CA C 13 64.914 0.40 . 1 . . . A 162 PRO CA . 17750 1 1431 . 1 1 138 138 PRO CB C 13 32.307 0.40 . 1 . . . A 162 PRO CB . 17750 1 1432 . 1 1 138 138 PRO CG C 13 26.989 0.40 . 1 . . . A 162 PRO CG . 17750 1 1433 . 1 1 138 138 PRO CD C 13 50.409 0.40 . 1 . . . A 162 PRO CD . 17750 1 stop_ save_