################################### # 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11099 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 1H-15N NOESY' 1 $sample_1 isotropic 11099 1 2 '3D 1H-13C NOESY' 1 $sample_1 isotropic 11099 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 11099 1 2 $NMRPipe . . 11099 1 3 $NMNMRView . . 11099 1 4 $Kujira . . 11099 1 5 $CYANA . . 11099 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 8 8 PRO HA H 1 4.420 0.030 . 1 . . . . 8 PRO HA . 11099 1 2 . 1 1 8 8 PRO HB2 H 1 2.272 0.030 . 2 . . . . 8 PRO HB2 . 11099 1 3 . 1 1 8 8 PRO HB3 H 1 1.957 0.030 . 2 . . . . 8 PRO HB3 . 11099 1 4 . 1 1 8 8 PRO HD2 H 1 3.608 0.030 . 2 . . . . 8 PRO HD2 . 11099 1 5 . 1 1 8 8 PRO HG2 H 1 2.004 0.030 . 2 . . . . 8 PRO HG2 . 11099 1 6 . 1 1 8 8 PRO C C 13 177.470 0.300 . 1 . . . . 8 PRO C . 11099 1 7 . 1 1 8 8 PRO CA C 13 63.455 0.300 . 1 . . . . 8 PRO CA . 11099 1 8 . 1 1 8 8 PRO CB C 13 32.165 0.300 . 1 . . . . 8 PRO CB . 11099 1 9 . 1 1 8 8 PRO CD C 13 49.807 0.300 . 1 . . . . 8 PRO CD . 11099 1 10 . 1 1 8 8 PRO CG C 13 27.175 0.300 . 1 . . . . 8 PRO CG . 11099 1 11 . 1 1 9 9 GLU H H 1 8.738 0.030 . 1 . . . . 9 GLU H . 11099 1 12 . 1 1 9 9 GLU HA H 1 4.216 0.030 . 1 . . . . 9 GLU HA . 11099 1 13 . 1 1 9 9 GLU HB2 H 1 2.036 0.030 . 2 . . . . 9 GLU HB2 . 11099 1 14 . 1 1 9 9 GLU HB3 H 1 1.918 0.030 . 2 . . . . 9 GLU HB3 . 11099 1 15 . 1 1 9 9 GLU HG2 H 1 2.281 0.030 . 2 . . . . 9 GLU HG2 . 11099 1 16 . 1 1 9 9 GLU HG3 H 1 2.239 0.030 . 2 . . . . 9 GLU HG3 . 11099 1 17 . 1 1 9 9 GLU C C 13 176.392 0.300 . 1 . . . . 9 GLU C . 11099 1 18 . 1 1 9 9 GLU CA C 13 57.048 0.300 . 1 . . . . 9 GLU CA . 11099 1 19 . 1 1 9 9 GLU CB C 13 29.817 0.300 . 1 . . . . 9 GLU CB . 11099 1 20 . 1 1 9 9 GLU CG C 13 36.283 0.300 . 1 . . . . 9 GLU CG . 11099 1 21 . 1 1 9 9 GLU N N 15 120.714 0.300 . 1 . . . . 9 GLU N . 11099 1 22 . 1 1 10 10 ASN H H 1 8.252 0.030 . 1 . . . . 10 ASN H . 11099 1 23 . 1 1 10 10 ASN HA H 1 4.677 0.030 . 1 . . . . 10 ASN HA . 11099 1 24 . 1 1 10 10 ASN HB2 H 1 2.812 0.030 . 2 . . . . 10 ASN HB2 . 11099 1 25 . 1 1 10 10 ASN HB3 H 1 2.690 0.030 . 2 . . . . 10 ASN HB3 . 11099 1 26 . 1 1 10 10 ASN HD21 H 1 6.871 0.030 . 2 . . . . 10 ASN HD21 . 11099 1 27 . 1 1 10 10 ASN HD22 H 1 7.593 0.030 . 2 . . . . 10 ASN HD22 . 11099 1 28 . 1 1 10 10 ASN C C 13 174.612 0.300 . 1 . . . . 10 ASN C . 11099 1 29 . 1 1 10 10 ASN CA C 13 53.392 0.300 . 1 . . . . 10 ASN CA . 11099 1 30 . 1 1 10 10 ASN CB C 13 39.417 0.300 . 1 . . . . 10 ASN CB . 11099 1 31 . 1 1 10 10 ASN N N 15 118.484 0.300 . 1 . . . . 10 ASN N . 11099 1 32 . 1 1 10 10 ASN ND2 N 15 113.166 0.300 . 1 . . . . 10 ASN ND2 . 11099 1 33 . 1 1 11 11 ASP H H 1 8.249 0.030 . 1 . . . . 11 ASP H . 11099 1 34 . 1 1 11 11 ASP HA H 1 4.601 0.030 . 1 . . . . 11 ASP HA . 11099 1 35 . 1 1 11 11 ASP HB2 H 1 2.698 0.030 . 2 . . . . 11 ASP HB2 . 11099 1 36 . 1 1 11 11 ASP HB3 H 1 2.561 0.030 . 2 . . . . 11 ASP HB3 . 11099 1 37 . 1 1 11 11 ASP C C 13 175.797 0.300 . 1 . . . . 11 ASP C . 11099 1 38 . 1 1 11 11 ASP CA C 13 54.408 0.300 . 1 . . . . 11 ASP CA . 11099 1 39 . 1 1 11 11 ASP CB C 13 41.113 0.300 . 1 . . . . 11 ASP CB . 11099 1 40 . 1 1 11 11 ASP N N 15 120.258 0.300 . 1 . . . . 11 ASP N . 11099 1 41 . 1 1 12 12 LEU H H 1 7.938 0.030 . 1 . . . . 12 LEU H . 11099 1 42 . 1 1 12 12 LEU HA H 1 4.434 0.030 . 1 . . . . 12 LEU HA . 11099 1 43 . 1 1 12 12 LEU HB2 H 1 1.598 0.030 . 2 . . . . 12 LEU HB2 . 11099 1 44 . 1 1 12 12 LEU HB3 H 1 1.308 0.030 . 2 . . . . 12 LEU HB3 . 11099 1 45 . 1 1 12 12 LEU HD11 H 1 0.869 0.030 . 1 . . . . 12 LEU HD1 . 11099 1 46 . 1 1 12 12 LEU HD12 H 1 0.869 0.030 . 1 . . . . 12 LEU HD1 . 11099 1 47 . 1 1 12 12 LEU HD13 H 1 0.869 0.030 . 1 . . . . 12 LEU HD1 . 11099 1 48 . 1 1 12 12 LEU HD21 H 1 0.842 0.030 . 1 . . . . 12 LEU HD2 . 11099 1 49 . 1 1 12 12 LEU HD22 H 1 0.842 0.030 . 1 . . . . 12 LEU HD2 . 11099 1 50 . 1 1 12 12 LEU HD23 H 1 0.842 0.030 . 1 . . . . 12 LEU HD2 . 11099 1 51 . 1 1 12 12 LEU HG H 1 1.604 0.030 . 1 . . . . 12 LEU HG . 11099 1 52 . 1 1 12 12 LEU C C 13 176.330 0.300 . 1 . . . . 12 LEU C . 11099 1 53 . 1 1 12 12 LEU CA C 13 54.843 0.300 . 1 . . . . 12 LEU CA . 11099 1 54 . 1 1 12 12 LEU CB C 13 43.158 0.300 . 1 . . . . 12 LEU CB . 11099 1 55 . 1 1 12 12 LEU CD1 C 13 25.541 0.300 . 2 . . . . 12 LEU CD1 . 11099 1 56 . 1 1 12 12 LEU CD2 C 13 23.279 0.300 . 2 . . . . 12 LEU CD2 . 11099 1 57 . 1 1 12 12 LEU CG C 13 27.191 0.300 . 1 . . . . 12 LEU CG . 11099 1 58 . 1 1 12 12 LEU N N 15 121.272 0.300 . 1 . . . . 12 LEU N . 11099 1 59 . 1 1 13 13 ASP H H 1 8.542 0.030 . 1 . . . . 13 ASP H . 11099 1 60 . 1 1 13 13 ASP HA H 1 4.639 0.030 . 1 . . . . 13 ASP HA . 11099 1 61 . 1 1 13 13 ASP HB2 H 1 2.839 0.030 . 2 . . . . 13 ASP HB2 . 11099 1 62 . 1 1 13 13 ASP HB3 H 1 2.597 0.030 . 2 . . . . 13 ASP HB3 . 11099 1 63 . 1 1 13 13 ASP C C 13 175.050 0.300 . 1 . . . . 13 ASP C . 11099 1 64 . 1 1 13 13 ASP CA C 13 54.201 0.300 . 1 . . . . 13 ASP CA . 11099 1 65 . 1 1 13 13 ASP CB C 13 42.621 0.300 . 1 . . . . 13 ASP CB . 11099 1 66 . 1 1 13 13 ASP N N 15 121.652 0.300 . 1 . . . . 13 ASP N . 11099 1 67 . 1 1 14 14 GLU H H 1 9.001 0.030 . 1 . . . . 14 GLU H . 11099 1 68 . 1 1 14 14 GLU HA H 1 4.547 0.030 . 1 . . . . 14 GLU HA . 11099 1 69 . 1 1 14 14 GLU HB2 H 1 2.112 0.030 . 2 . . . . 14 GLU HB2 . 11099 1 70 . 1 1 14 14 GLU HB3 H 1 1.536 0.030 . 2 . . . . 14 GLU HB3 . 11099 1 71 . 1 1 14 14 GLU HG2 H 1 2.857 0.030 . 2 . . . . 14 GLU HG2 . 11099 1 72 . 1 1 14 14 GLU HG3 H 1 2.187 0.030 . 2 . . . . 14 GLU HG3 . 11099 1 73 . 1 1 14 14 GLU C C 13 175.909 0.300 . 1 . . . . 14 GLU C . 11099 1 74 . 1 1 14 14 GLU CA C 13 54.470 0.300 . 1 . . . . 14 GLU CA . 11099 1 75 . 1 1 14 14 GLU CB C 13 32.306 0.300 . 1 . . . . 14 GLU CB . 11099 1 76 . 1 1 14 14 GLU CG C 13 39.850 0.300 . 1 . . . . 14 GLU CG . 11099 1 77 . 1 1 14 14 GLU N N 15 129.785 0.300 . 1 . . . . 14 GLU N . 11099 1 78 . 1 1 15 15 SER H H 1 8.839 0.030 . 1 . . . . 15 SER H . 11099 1 79 . 1 1 15 15 SER HA H 1 4.348 0.030 . 1 . . . . 15 SER HA . 11099 1 80 . 1 1 15 15 SER HB2 H 1 4.025 0.030 . 2 . . . . 15 SER HB2 . 11099 1 81 . 1 1 15 15 SER HB3 H 1 3.874 0.030 . 2 . . . . 15 SER HB3 . 11099 1 82 . 1 1 15 15 SER C C 13 173.346 0.300 . 1 . . . . 15 SER C . 11099 1 83 . 1 1 15 15 SER CA C 13 59.077 0.300 . 1 . . . . 15 SER CA . 11099 1 84 . 1 1 15 15 SER CB C 13 64.292 0.300 . 1 . . . . 15 SER CB . 11099 1 85 . 1 1 15 15 SER N N 15 115.640 0.300 . 1 . . . . 15 SER N . 11099 1 86 . 1 1 16 16 GLN H H 1 7.133 0.030 . 1 . . . . 16 GLN H . 11099 1 87 . 1 1 16 16 GLN HA H 1 4.642 0.030 . 1 . . . . 16 GLN HA . 11099 1 88 . 1 1 16 16 GLN HB2 H 1 1.951 0.030 . 2 . . . . 16 GLN HB2 . 11099 1 89 . 1 1 16 16 GLN HB3 H 1 1.849 0.030 . 2 . . . . 16 GLN HB3 . 11099 1 90 . 1 1 16 16 GLN HE21 H 1 6.797 0.030 . 2 . . . . 16 GLN HE21 . 11099 1 91 . 1 1 16 16 GLN HE22 H 1 7.744 0.030 . 2 . . . . 16 GLN HE22 . 11099 1 92 . 1 1 16 16 GLN HG2 H 1 2.151 0.030 . 1 . . . . 16 GLN HG2 . 11099 1 93 . 1 1 16 16 GLN HG3 H 1 2.151 0.030 . 1 . . . . 16 GLN HG3 . 11099 1 94 . 1 1 16 16 GLN C C 13 173.596 0.300 . 1 . . . . 16 GLN C . 11099 1 95 . 1 1 16 16 GLN CA C 13 52.631 0.300 . 1 . . . . 16 GLN CA . 11099 1 96 . 1 1 16 16 GLN CB C 13 32.643 0.300 . 1 . . . . 16 GLN CB . 11099 1 97 . 1 1 16 16 GLN CG C 13 32.855 0.300 . 1 . . . . 16 GLN CG . 11099 1 98 . 1 1 16 16 GLN N N 15 118.704 0.300 . 1 . . . . 16 GLN N . 11099 1 99 . 1 1 16 16 GLN NE2 N 15 113.545 0.300 . 1 . . . . 16 GLN NE2 . 11099 1 100 . 1 1 17 17 VAL H H 1 7.979 0.030 . 1 . . . . 17 VAL H . 11099 1 101 . 1 1 17 17 VAL HA H 1 4.318 0.030 . 1 . . . . 17 VAL HA . 11099 1 102 . 1 1 17 17 VAL HB H 1 1.775 0.030 . 1 . . . . 17 VAL HB . 11099 1 103 . 1 1 17 17 VAL HG11 H 1 0.690 0.030 . 1 . . . . 17 VAL HG1 . 11099 1 104 . 1 1 17 17 VAL HG12 H 1 0.690 0.030 . 1 . . . . 17 VAL HG1 . 11099 1 105 . 1 1 17 17 VAL HG13 H 1 0.690 0.030 . 1 . . . . 17 VAL HG1 . 11099 1 106 . 1 1 17 17 VAL HG21 H 1 0.847 0.030 . 1 . . . . 17 VAL HG2 . 11099 1 107 . 1 1 17 17 VAL HG22 H 1 0.847 0.030 . 1 . . . . 17 VAL HG2 . 11099 1 108 . 1 1 17 17 VAL HG23 H 1 0.847 0.030 . 1 . . . . 17 VAL HG2 . 11099 1 109 . 1 1 17 17 VAL C C 13 172.550 0.300 . 1 . . . . 17 VAL C . 11099 1 110 . 1 1 17 17 VAL CA C 13 59.827 0.300 . 1 . . . . 17 VAL CA . 11099 1 111 . 1 1 17 17 VAL CB C 13 29.646 0.300 . 1 . . . . 17 VAL CB . 11099 1 112 . 1 1 17 17 VAL CG1 C 13 21.131 0.300 . 2 . . . . 17 VAL CG1 . 11099 1 113 . 1 1 17 17 VAL CG2 C 13 17.662 0.300 . 2 . . . . 17 VAL CG2 . 11099 1 114 . 1 1 17 17 VAL N N 15 114.303 0.300 . 1 . . . . 17 VAL N . 11099 1 115 . 1 1 18 18 PRO HA H 1 4.395 0.030 . 1 . . . . 18 PRO HA . 11099 1 116 . 1 1 18 18 PRO HB2 H 1 2.075 0.030 . 2 . . . . 18 PRO HB2 . 11099 1 117 . 1 1 18 18 PRO HB3 H 1 1.820 0.030 . 2 . . . . 18 PRO HB3 . 11099 1 118 . 1 1 18 18 PRO HD2 H 1 3.124 0.030 . 2 . . . . 18 PRO HD2 . 11099 1 119 . 1 1 18 18 PRO HD3 H 1 3.702 0.030 . 2 . . . . 18 PRO HD3 . 11099 1 120 . 1 1 18 18 PRO HG2 H 1 1.832 0.030 . 2 . . . . 18 PRO HG2 . 11099 1 121 . 1 1 18 18 PRO HG3 H 1 1.390 0.030 . 2 . . . . 18 PRO HG3 . 11099 1 122 . 1 1 18 18 PRO C C 13 175.594 0.300 . 1 . . . . 18 PRO C . 11099 1 123 . 1 1 18 18 PRO CA C 13 61.826 0.300 . 1 . . . . 18 PRO CA . 11099 1 124 . 1 1 18 18 PRO CB C 13 32.689 0.300 . 1 . . . . 18 PRO CB . 11099 1 125 . 1 1 18 18 PRO CD C 13 49.828 0.300 . 1 . . . . 18 PRO CD . 11099 1 126 . 1 1 18 18 PRO CG C 13 27.699 0.300 . 1 . . . . 18 PRO CG . 11099 1 127 . 1 1 19 19 ASP H H 1 8.312 0.030 . 1 . . . . 19 ASP H . 11099 1 128 . 1 1 19 19 ASP HA H 1 4.686 0.030 . 1 . . . . 19 ASP HA . 11099 1 129 . 1 1 19 19 ASP HB2 H 1 3.037 0.030 . 2 . . . . 19 ASP HB2 . 11099 1 130 . 1 1 19 19 ASP HB3 H 1 2.631 0.030 . 2 . . . . 19 ASP HB3 . 11099 1 131 . 1 1 19 19 ASP C C 13 175.289 0.300 . 1 . . . . 19 ASP C . 11099 1 132 . 1 1 19 19 ASP CA C 13 52.957 0.300 . 1 . . . . 19 ASP CA . 11099 1 133 . 1 1 19 19 ASP CB C 13 42.673 0.300 . 1 . . . . 19 ASP CB . 11099 1 134 . 1 1 19 19 ASP N N 15 117.500 0.300 . 1 . . . . 19 ASP N . 11099 1 135 . 1 1 20 20 GLN H H 1 8.637 0.030 . 1 . . . . 20 GLN H . 11099 1 136 . 1 1 20 20 GLN HA H 1 4.682 0.030 . 1 . . . . 20 GLN HA . 11099 1 137 . 1 1 20 20 GLN HB2 H 1 1.967 0.030 . 2 . . . . 20 GLN HB2 . 11099 1 138 . 1 1 20 20 GLN HB3 H 1 1.813 0.030 . 2 . . . . 20 GLN HB3 . 11099 1 139 . 1 1 20 20 GLN HE21 H 1 7.134 0.030 . 2 . . . . 20 GLN HE21 . 11099 1 140 . 1 1 20 20 GLN HE22 H 1 7.430 0.030 . 2 . . . . 20 GLN HE22 . 11099 1 141 . 1 1 20 20 GLN HG2 H 1 2.377 0.030 . 2 . . . . 20 GLN HG2 . 11099 1 142 . 1 1 20 20 GLN HG3 H 1 2.269 0.030 . 2 . . . . 20 GLN HG3 . 11099 1 143 . 1 1 20 20 GLN C C 13 174.649 0.300 . 1 . . . . 20 GLN C . 11099 1 144 . 1 1 20 20 GLN CA C 13 54.666 0.300 . 1 . . . . 20 GLN CA . 11099 1 145 . 1 1 20 20 GLN CB C 13 29.499 0.300 . 1 . . . . 20 GLN CB . 11099 1 146 . 1 1 20 20 GLN CG C 13 34.203 0.300 . 1 . . . . 20 GLN CG . 11099 1 147 . 1 1 20 20 GLN N N 15 117.116 0.300 . 1 . . . . 20 GLN N . 11099 1 148 . 1 1 20 20 GLN NE2 N 15 114.064 0.300 . 1 . . . . 20 GLN NE2 . 11099 1 149 . 1 1 21 21 PRO HA H 1 4.134 0.030 . 1 . . . . 21 PRO HA . 11099 1 150 . 1 1 21 21 PRO HB2 H 1 2.763 0.030 . 2 . . . . 21 PRO HB2 . 11099 1 151 . 1 1 21 21 PRO HB3 H 1 1.819 0.030 . 2 . . . . 21 PRO HB3 . 11099 1 152 . 1 1 21 21 PRO HD2 H 1 3.403 0.030 . 2 . . . . 21 PRO HD2 . 11099 1 153 . 1 1 21 21 PRO HD3 H 1 4.451 0.030 . 2 . . . . 21 PRO HD3 . 11099 1 154 . 1 1 21 21 PRO HG2 H 1 1.824 0.030 . 2 . . . . 21 PRO HG2 . 11099 1 155 . 1 1 21 21 PRO HG3 H 1 1.681 0.030 . 2 . . . . 21 PRO HG3 . 11099 1 156 . 1 1 21 21 PRO C C 13 174.696 0.300 . 1 . . . . 21 PRO C . 11099 1 157 . 1 1 21 21 PRO CA C 13 63.668 0.300 . 1 . . . . 21 PRO CA . 11099 1 158 . 1 1 21 21 PRO CB C 13 31.224 0.300 . 1 . . . . 21 PRO CB . 11099 1 159 . 1 1 21 21 PRO CD C 13 50.046 0.300 . 1 . . . . 21 PRO CD . 11099 1 160 . 1 1 21 21 PRO CG C 13 28.637 0.300 . 1 . . . . 21 PRO CG . 11099 1 161 . 1 1 22 22 SER H H 1 7.234 0.030 . 1 . . . . 22 SER H . 11099 1 162 . 1 1 22 22 SER HA H 1 4.180 0.030 . 1 . . . . 22 SER HA . 11099 1 163 . 1 1 22 22 SER HB2 H 1 4.119 0.030 . 2 . . . . 22 SER HB2 . 11099 1 164 . 1 1 22 22 SER HB3 H 1 3.902 0.030 . 2 . . . . 22 SER HB3 . 11099 1 165 . 1 1 22 22 SER C C 13 174.128 0.300 . 1 . . . . 22 SER C . 11099 1 166 . 1 1 22 22 SER CA C 13 60.548 0.300 . 1 . . . . 22 SER CA . 11099 1 167 . 1 1 22 22 SER CB C 13 64.289 0.300 . 1 . . . . 22 SER CB . 11099 1 168 . 1 1 22 22 SER N N 15 114.351 0.300 . 1 . . . . 22 SER N . 11099 1 169 . 1 1 23 23 SER H H 1 7.423 0.030 . 1 . . . . 23 SER H . 11099 1 170 . 1 1 23 23 SER HA H 1 4.398 0.030 . 1 . . . . 23 SER HA . 11099 1 171 . 1 1 23 23 SER HB2 H 1 3.659 0.030 . 2 . . . . 23 SER HB2 . 11099 1 172 . 1 1 23 23 SER HB3 H 1 4.017 0.030 . 2 . . . . 23 SER HB3 . 11099 1 173 . 1 1 23 23 SER C C 13 170.844 0.300 . 1 . . . . 23 SER C . 11099 1 174 . 1 1 23 23 SER CA C 13 58.532 0.300 . 1 . . . . 23 SER CA . 11099 1 175 . 1 1 23 23 SER CB C 13 65.653 0.300 . 1 . . . . 23 SER CB . 11099 1 176 . 1 1 23 23 SER N N 15 112.532 0.300 . 1 . . . . 23 SER N . 11099 1 177 . 1 1 24 24 LEU H H 1 8.000 0.030 . 1 . . . . 24 LEU H . 11099 1 178 . 1 1 24 24 LEU HA H 1 5.010 0.030 . 1 . . . . 24 LEU HA . 11099 1 179 . 1 1 24 24 LEU HB2 H 1 1.650 0.030 . 2 . . . . 24 LEU HB2 . 11099 1 180 . 1 1 24 24 LEU HB3 H 1 1.442 0.030 . 2 . . . . 24 LEU HB3 . 11099 1 181 . 1 1 24 24 LEU HD11 H 1 0.954 0.030 . 1 . . . . 24 LEU HD1 . 11099 1 182 . 1 1 24 24 LEU HD12 H 1 0.954 0.030 . 1 . . . . 24 LEU HD1 . 11099 1 183 . 1 1 24 24 LEU HD13 H 1 0.954 0.030 . 1 . . . . 24 LEU HD1 . 11099 1 184 . 1 1 24 24 LEU HD21 H 1 0.585 0.030 . 1 . . . . 24 LEU HD2 . 11099 1 185 . 1 1 24 24 LEU HD22 H 1 0.585 0.030 . 1 . . . . 24 LEU HD2 . 11099 1 186 . 1 1 24 24 LEU HD23 H 1 0.585 0.030 . 1 . . . . 24 LEU HD2 . 11099 1 187 . 1 1 24 24 LEU HG H 1 1.293 0.030 . 1 . . . . 24 LEU HG . 11099 1 188 . 1 1 24 24 LEU C C 13 173.486 0.300 . 1 . . . . 24 LEU C . 11099 1 189 . 1 1 24 24 LEU CA C 13 55.208 0.300 . 1 . . . . 24 LEU CA . 11099 1 190 . 1 1 24 24 LEU CB C 13 44.808 0.300 . 1 . . . . 24 LEU CB . 11099 1 191 . 1 1 24 24 LEU CD1 C 13 23.785 0.300 . 2 . . . . 24 LEU CD1 . 11099 1 192 . 1 1 24 24 LEU CD2 C 13 26.456 0.300 . 2 . . . . 24 LEU CD2 . 11099 1 193 . 1 1 24 24 LEU CG C 13 28.404 0.300 . 1 . . . . 24 LEU CG . 11099 1 194 . 1 1 24 24 LEU N N 15 118.597 0.300 . 1 . . . . 24 LEU N . 11099 1 195 . 1 1 25 25 HIS H H 1 9.486 0.030 . 1 . . . . 25 HIS H . 11099 1 196 . 1 1 25 25 HIS HA H 1 5.042 0.030 . 1 . . . . 25 HIS HA . 11099 1 197 . 1 1 25 25 HIS HB2 H 1 3.067 0.030 . 2 . . . . 25 HIS HB2 . 11099 1 198 . 1 1 25 25 HIS HB3 H 1 2.986 0.030 . 2 . . . . 25 HIS HB3 . 11099 1 199 . 1 1 25 25 HIS HD2 H 1 6.957 0.030 . 1 . . . . 25 HIS HD2 . 11099 1 200 . 1 1 25 25 HIS HE1 H 1 7.789 0.030 . 1 . . . . 25 HIS HE1 . 11099 1 201 . 1 1 25 25 HIS C C 13 174.618 0.300 . 1 . . . . 25 HIS C . 11099 1 202 . 1 1 25 25 HIS CA C 13 54.862 0.300 . 1 . . . . 25 HIS CA . 11099 1 203 . 1 1 25 25 HIS CB C 13 32.888 0.300 . 1 . . . . 25 HIS CB . 11099 1 204 . 1 1 25 25 HIS CD2 C 13 119.951 0.300 . 1 . . . . 25 HIS CD2 . 11099 1 205 . 1 1 25 25 HIS CE1 C 13 138.068 0.300 . 1 . . . . 25 HIS CE1 . 11099 1 206 . 1 1 25 25 HIS N N 15 126.681 0.300 . 1 . . . . 25 HIS N . 11099 1 207 . 1 1 26 26 VAL H H 1 8.726 0.030 . 1 . . . . 26 VAL H . 11099 1 208 . 1 1 26 26 VAL HA H 1 5.181 0.030 . 1 . . . . 26 VAL HA . 11099 1 209 . 1 1 26 26 VAL HB H 1 1.732 0.030 . 1 . . . . 26 VAL HB . 11099 1 210 . 1 1 26 26 VAL HG11 H 1 0.696 0.030 . 1 . . . . 26 VAL HG1 . 11099 1 211 . 1 1 26 26 VAL HG12 H 1 0.696 0.030 . 1 . . . . 26 VAL HG1 . 11099 1 212 . 1 1 26 26 VAL HG13 H 1 0.696 0.030 . 1 . . . . 26 VAL HG1 . 11099 1 213 . 1 1 26 26 VAL HG21 H 1 0.808 0.030 . 1 . . . . 26 VAL HG2 . 11099 1 214 . 1 1 26 26 VAL HG22 H 1 0.808 0.030 . 1 . . . . 26 VAL HG2 . 11099 1 215 . 1 1 26 26 VAL HG23 H 1 0.808 0.030 . 1 . . . . 26 VAL HG2 . 11099 1 216 . 1 1 26 26 VAL C C 13 174.738 0.300 . 1 . . . . 26 VAL C . 11099 1 217 . 1 1 26 26 VAL CA C 13 59.152 0.300 . 1 . . . . 26 VAL CA . 11099 1 218 . 1 1 26 26 VAL CB C 13 34.952 0.300 . 1 . . . . 26 VAL CB . 11099 1 219 . 1 1 26 26 VAL CG1 C 13 22.431 0.300 . 2 . . . . 26 VAL CG1 . 11099 1 220 . 1 1 26 26 VAL CG2 C 13 19.894 0.300 . 2 . . . . 26 VAL CG2 . 11099 1 221 . 1 1 26 26 VAL N N 15 117.433 0.300 . 1 . . . . 26 VAL N . 11099 1 222 . 1 1 27 27 ARG H H 1 8.873 0.030 . 1 . . . . 27 ARG H . 11099 1 223 . 1 1 27 27 ARG HA H 1 4.994 0.030 . 1 . . . . 27 ARG HA . 11099 1 224 . 1 1 27 27 ARG HB2 H 1 1.714 0.030 . 2 . . . . 27 ARG HB2 . 11099 1 225 . 1 1 27 27 ARG HB3 H 1 1.822 0.030 . 2 . . . . 27 ARG HB3 . 11099 1 226 . 1 1 27 27 ARG HD2 H 1 3.174 0.030 . 1 . . . . 27 ARG HD2 . 11099 1 227 . 1 1 27 27 ARG HD3 H 1 3.174 0.030 . 1 . . . . 27 ARG HD3 . 11099 1 228 . 1 1 27 27 ARG HG2 H 1 1.554 0.030 . 2 . . . . 27 ARG HG2 . 11099 1 229 . 1 1 27 27 ARG HG3 H 1 1.488 0.030 . 2 . . . . 27 ARG HG3 . 11099 1 230 . 1 1 27 27 ARG C C 13 174.091 0.300 . 1 . . . . 27 ARG C . 11099 1 231 . 1 1 27 27 ARG CA C 13 52.439 0.300 . 1 . . . . 27 ARG CA . 11099 1 232 . 1 1 27 27 ARG CB C 13 32.576 0.300 . 1 . . . . 27 ARG CB . 11099 1 233 . 1 1 27 27 ARG CD C 13 43.755 0.300 . 1 . . . . 27 ARG CD . 11099 1 234 . 1 1 27 27 ARG CG C 13 26.998 0.300 . 1 . . . . 27 ARG CG . 11099 1 235 . 1 1 27 27 ARG N N 15 123.078 0.300 . 1 . . . . 27 ARG N . 11099 1 236 . 1 1 28 28 PRO HA H 1 4.652 0.030 . 1 . . . . 28 PRO HA . 11099 1 237 . 1 1 28 28 PRO HB2 H 1 2.208 0.030 . 2 . . . . 28 PRO HB2 . 11099 1 238 . 1 1 28 28 PRO HB3 H 1 1.876 0.030 . 2 . . . . 28 PRO HB3 . 11099 1 239 . 1 1 28 28 PRO HD2 H 1 3.564 0.030 . 2 . . . . 28 PRO HD2 . 11099 1 240 . 1 1 28 28 PRO HD3 H 1 4.032 0.030 . 2 . . . . 28 PRO HD3 . 11099 1 241 . 1 1 28 28 PRO HG2 H 1 2.136 0.030 . 2 . . . . 28 PRO HG2 . 11099 1 242 . 1 1 28 28 PRO HG3 H 1 2.336 0.030 . 2 . . . . 28 PRO HG3 . 11099 1 243 . 1 1 28 28 PRO C C 13 176.288 0.300 . 1 . . . . 28 PRO C . 11099 1 244 . 1 1 28 28 PRO CA C 13 62.853 0.300 . 1 . . . . 28 PRO CA . 11099 1 245 . 1 1 28 28 PRO CB C 13 33.682 0.300 . 1 . . . . 28 PRO CB . 11099 1 246 . 1 1 28 28 PRO CD C 13 51.116 0.300 . 1 . . . . 28 PRO CD . 11099 1 247 . 1 1 28 28 PRO CG C 13 27.124 0.300 . 1 . . . . 28 PRO CG . 11099 1 248 . 1 1 29 29 GLN H H 1 8.532 0.030 . 1 . . . . 29 GLN H . 11099 1 249 . 1 1 29 29 GLN HA H 1 4.692 0.030 . 1 . . . . 29 GLN HA . 11099 1 250 . 1 1 29 29 GLN HB2 H 1 2.145 0.030 . 2 . . . . 29 GLN HB2 . 11099 1 251 . 1 1 29 29 GLN HB3 H 1 2.459 0.030 . 2 . . . . 29 GLN HB3 . 11099 1 252 . 1 1 29 29 GLN HE21 H 1 6.945 0.030 . 2 . . . . 29 GLN HE21 . 11099 1 253 . 1 1 29 29 GLN HE22 H 1 6.847 0.030 . 2 . . . . 29 GLN HE22 . 11099 1 254 . 1 1 29 29 GLN HG2 H 1 2.232 0.030 . 1 . . . . 29 GLN HG2 . 11099 1 255 . 1 1 29 29 GLN HG3 H 1 2.232 0.030 . 1 . . . . 29 GLN HG3 . 11099 1 256 . 1 1 29 29 GLN C C 13 175.903 0.300 . 1 . . . . 29 GLN C . 11099 1 257 . 1 1 29 29 GLN CA C 13 54.291 0.300 . 1 . . . . 29 GLN CA . 11099 1 258 . 1 1 29 29 GLN CB C 13 29.384 0.300 . 1 . . . . 29 GLN CB . 11099 1 259 . 1 1 29 29 GLN CG C 13 33.900 0.300 . 1 . . . . 29 GLN CG . 11099 1 260 . 1 1 29 29 GLN N N 15 121.862 0.300 . 1 . . . . 29 GLN N . 11099 1 261 . 1 1 29 29 GLN NE2 N 15 111.072 0.300 . 1 . . . . 29 GLN NE2 . 11099 1 262 . 1 1 30 30 THR H H 1 8.149 0.030 . 1 . . . . 30 THR H . 11099 1 263 . 1 1 30 30 THR HA H 1 4.272 0.030 . 1 . . . . 30 THR HA . 11099 1 264 . 1 1 30 30 THR HB H 1 3.998 0.030 . 1 . . . . 30 THR HB . 11099 1 265 . 1 1 30 30 THR HG21 H 1 1.124 0.030 . 1 . . . . 30 THR HG2 . 11099 1 266 . 1 1 30 30 THR HG22 H 1 1.124 0.030 . 1 . . . . 30 THR HG2 . 11099 1 267 . 1 1 30 30 THR HG23 H 1 1.124 0.030 . 1 . . . . 30 THR HG2 . 11099 1 268 . 1 1 30 30 THR C C 13 173.958 0.300 . 1 . . . . 30 THR C . 11099 1 269 . 1 1 30 30 THR CA C 13 65.754 0.300 . 1 . . . . 30 THR CA . 11099 1 270 . 1 1 30 30 THR CB C 13 68.773 0.300 . 1 . . . . 30 THR CB . 11099 1 271 . 1 1 30 30 THR CG2 C 13 22.352 0.300 . 1 . . . . 30 THR CG2 . 11099 1 272 . 1 1 30 30 THR N N 15 116.503 0.300 . 1 . . . . 30 THR N . 11099 1 273 . 1 1 31 31 ASN H H 1 8.032 0.030 . 1 . . . . 31 ASN H . 11099 1 274 . 1 1 31 31 ASN HA H 1 4.661 0.030 . 1 . . . . 31 ASN HA . 11099 1 275 . 1 1 31 31 ASN HB2 H 1 3.077 0.030 . 2 . . . . 31 ASN HB2 . 11099 1 276 . 1 1 31 31 ASN HB3 H 1 2.544 0.030 . 2 . . . . 31 ASN HB3 . 11099 1 277 . 1 1 31 31 ASN HD21 H 1 7.784 0.030 . 2 . . . . 31 ASN HD21 . 11099 1 278 . 1 1 31 31 ASN HD22 H 1 6.852 0.030 . 2 . . . . 31 ASN HD22 . 11099 1 279 . 1 1 31 31 ASN C C 13 173.841 0.300 . 1 . . . . 31 ASN C . 11099 1 280 . 1 1 31 31 ASN CA C 13 52.341 0.300 . 1 . . . . 31 ASN CA . 11099 1 281 . 1 1 31 31 ASN CB C 13 40.104 0.300 . 1 . . . . 31 ASN CB . 11099 1 282 . 1 1 31 31 ASN N N 15 113.544 0.300 . 1 . . . . 31 ASN N . 11099 1 283 . 1 1 31 31 ASN ND2 N 15 110.953 0.300 . 1 . . . . 31 ASN ND2 . 11099 1 284 . 1 1 32 32 CYS H H 1 7.171 0.030 . 1 . . . . 32 CYS H . 11099 1 285 . 1 1 32 32 CYS HA H 1 5.281 0.030 . 1 . . . . 32 CYS HA . 11099 1 286 . 1 1 32 32 CYS HB2 H 1 2.750 0.030 . 1 . . . . 32 CYS HB2 . 11099 1 287 . 1 1 32 32 CYS HB3 H 1 2.750 0.030 . 1 . . . . 32 CYS HB3 . 11099 1 288 . 1 1 32 32 CYS C C 13 172.465 0.300 . 1 . . . . 32 CYS C . 11099 1 289 . 1 1 32 32 CYS CA C 13 55.242 0.300 . 1 . . . . 32 CYS CA . 11099 1 290 . 1 1 32 32 CYS CB C 13 30.875 0.300 . 1 . . . . 32 CYS CB . 11099 1 291 . 1 1 32 32 CYS N N 15 113.198 0.300 . 1 . . . . 32 CYS N . 11099 1 292 . 1 1 33 33 ILE H H 1 8.356 0.030 . 1 . . . . 33 ILE H . 11099 1 293 . 1 1 33 33 ILE HA H 1 4.126 0.030 . 1 . . . . 33 ILE HA . 11099 1 294 . 1 1 33 33 ILE HB H 1 1.121 0.030 . 1 . . . . 33 ILE HB . 11099 1 295 . 1 1 33 33 ILE HD11 H 1 0.456 0.030 . 1 . . . . 33 ILE HD1 . 11099 1 296 . 1 1 33 33 ILE HD12 H 1 0.456 0.030 . 1 . . . . 33 ILE HD1 . 11099 1 297 . 1 1 33 33 ILE HD13 H 1 0.456 0.030 . 1 . . . . 33 ILE HD1 . 11099 1 298 . 1 1 33 33 ILE HG12 H 1 1.240 0.030 . 2 . . . . 33 ILE HG12 . 11099 1 299 . 1 1 33 33 ILE HG13 H 1 0.411 0.030 . 2 . . . . 33 ILE HG13 . 11099 1 300 . 1 1 33 33 ILE HG21 H 1 0.452 0.030 . 1 . . . . 33 ILE HG2 . 11099 1 301 . 1 1 33 33 ILE HG22 H 1 0.452 0.030 . 1 . . . . 33 ILE HG2 . 11099 1 302 . 1 1 33 33 ILE HG23 H 1 0.452 0.030 . 1 . . . . 33 ILE HG2 . 11099 1 303 . 1 1 33 33 ILE C C 13 173.205 0.300 . 1 . . . . 33 ILE C . 11099 1 304 . 1 1 33 33 ILE CA C 13 61.292 0.300 . 1 . . . . 33 ILE CA . 11099 1 305 . 1 1 33 33 ILE CB C 13 42.765 0.300 . 1 . . . . 33 ILE CB . 11099 1 306 . 1 1 33 33 ILE CD1 C 13 14.983 0.300 . 1 . . . . 33 ILE CD1 . 11099 1 307 . 1 1 33 33 ILE CG1 C 13 28.888 0.300 . 1 . . . . 33 ILE CG1 . 11099 1 308 . 1 1 33 33 ILE CG2 C 13 17.840 0.300 . 1 . . . . 33 ILE CG2 . 11099 1 309 . 1 1 33 33 ILE N N 15 121.293 0.300 . 1 . . . . 33 ILE N . 11099 1 310 . 1 1 34 34 ILE H H 1 8.107 0.030 . 1 . . . . 34 ILE H . 11099 1 311 . 1 1 34 34 ILE HA H 1 4.434 0.030 . 1 . . . . 34 ILE HA . 11099 1 312 . 1 1 34 34 ILE HB H 1 1.815 0.030 . 1 . . . . 34 ILE HB . 11099 1 313 . 1 1 34 34 ILE HD11 H 1 0.757 0.030 . 1 . . . . 34 ILE HD1 . 11099 1 314 . 1 1 34 34 ILE HD12 H 1 0.757 0.030 . 1 . . . . 34 ILE HD1 . 11099 1 315 . 1 1 34 34 ILE HD13 H 1 0.757 0.030 . 1 . . . . 34 ILE HD1 . 11099 1 316 . 1 1 34 34 ILE HG12 H 1 1.454 0.030 . 2 . . . . 34 ILE HG12 . 11099 1 317 . 1 1 34 34 ILE HG13 H 1 1.152 0.030 . 2 . . . . 34 ILE HG13 . 11099 1 318 . 1 1 34 34 ILE HG21 H 1 0.763 0.030 . 1 . . . . 34 ILE HG2 . 11099 1 319 . 1 1 34 34 ILE HG22 H 1 0.763 0.030 . 1 . . . . 34 ILE HG2 . 11099 1 320 . 1 1 34 34 ILE HG23 H 1 0.763 0.030 . 1 . . . . 34 ILE HG2 . 11099 1 321 . 1 1 34 34 ILE C C 13 175.657 0.300 . 1 . . . . 34 ILE C . 11099 1 322 . 1 1 34 34 ILE CA C 13 60.626 0.300 . 1 . . . . 34 ILE CA . 11099 1 323 . 1 1 34 34 ILE CB C 13 38.807 0.300 . 1 . . . . 34 ILE CB . 11099 1 324 . 1 1 34 34 ILE CD1 C 13 12.979 0.300 . 1 . . . . 34 ILE CD1 . 11099 1 325 . 1 1 34 34 ILE CG1 C 13 28.211 0.300 . 1 . . . . 34 ILE CG1 . 11099 1 326 . 1 1 34 34 ILE CG2 C 13 18.331 0.300 . 1 . . . . 34 ILE CG2 . 11099 1 327 . 1 1 34 34 ILE N N 15 127.031 0.300 . 1 . . . . 34 ILE N . 11099 1 328 . 1 1 35 35 MET H H 1 9.272 0.030 . 1 . . . . 35 MET H . 11099 1 329 . 1 1 35 35 MET HA H 1 5.545 0.030 . 1 . . . . 35 MET HA . 11099 1 330 . 1 1 35 35 MET HB2 H 1 2.359 0.030 . 2 . . . . 35 MET HB2 . 11099 1 331 . 1 1 35 35 MET HB3 H 1 2.069 0.030 . 2 . . . . 35 MET HB3 . 11099 1 332 . 1 1 35 35 MET HE1 H 1 1.744 0.030 . 1 . . . . 35 MET HE . 11099 1 333 . 1 1 35 35 MET HE2 H 1 1.744 0.030 . 1 . . . . 35 MET HE . 11099 1 334 . 1 1 35 35 MET HE3 H 1 1.744 0.030 . 1 . . . . 35 MET HE . 11099 1 335 . 1 1 35 35 MET HG2 H 1 2.598 0.030 . 2 . . . . 35 MET HG2 . 11099 1 336 . 1 1 35 35 MET HG3 H 1 2.502 0.030 . 2 . . . . 35 MET HG3 . 11099 1 337 . 1 1 35 35 MET C C 13 174.115 0.300 . 1 . . . . 35 MET C . 11099 1 338 . 1 1 35 35 MET CA C 13 54.166 0.300 . 1 . . . . 35 MET CA . 11099 1 339 . 1 1 35 35 MET CB C 13 38.430 0.300 . 1 . . . . 35 MET CB . 11099 1 340 . 1 1 35 35 MET CE C 13 17.794 0.300 . 1 . . . . 35 MET CE . 11099 1 341 . 1 1 35 35 MET CG C 13 30.819 0.300 . 1 . . . . 35 MET CG . 11099 1 342 . 1 1 35 35 MET N N 15 126.811 0.300 . 1 . . . . 35 MET N . 11099 1 343 . 1 1 36 36 SER H H 1 9.061 0.030 . 1 . . . . 36 SER H . 11099 1 344 . 1 1 36 36 SER HA H 1 5.216 0.030 . 1 . . . . 36 SER HA . 11099 1 345 . 1 1 36 36 SER HB2 H 1 3.790 0.030 . 1 . . . . 36 SER HB2 . 11099 1 346 . 1 1 36 36 SER HB3 H 1 3.790 0.030 . 1 . . . . 36 SER HB3 . 11099 1 347 . 1 1 36 36 SER C C 13 172.998 0.300 . 1 . . . . 36 SER C . 11099 1 348 . 1 1 36 36 SER CA C 13 57.195 0.300 . 1 . . . . 36 SER CA . 11099 1 349 . 1 1 36 36 SER CB C 13 65.999 0.300 . 1 . . . . 36 SER CB . 11099 1 350 . 1 1 36 36 SER N N 15 114.133 0.300 . 1 . . . . 36 SER N . 11099 1 351 . 1 1 37 37 TRP H H 1 8.040 0.030 . 1 . . . . 37 TRP H . 11099 1 352 . 1 1 37 37 TRP HA H 1 5.217 0.030 . 1 . . . . 37 TRP HA . 11099 1 353 . 1 1 37 37 TRP HB2 H 1 3.414 0.030 . 2 . . . . 37 TRP HB2 . 11099 1 354 . 1 1 37 37 TRP HB3 H 1 3.068 0.030 . 2 . . . . 37 TRP HB3 . 11099 1 355 . 1 1 37 37 TRP HD1 H 1 6.103 0.030 . 1 . . . . 37 TRP HD1 . 11099 1 356 . 1 1 37 37 TRP HE1 H 1 6.503 0.030 . 1 . . . . 37 TRP HE1 . 11099 1 357 . 1 1 37 37 TRP HE3 H 1 6.706 0.030 . 1 . . . . 37 TRP HE3 . 11099 1 358 . 1 1 37 37 TRP HH2 H 1 6.560 0.030 . 1 . . . . 37 TRP HH2 . 11099 1 359 . 1 1 37 37 TRP HZ2 H 1 6.495 0.030 . 1 . . . . 37 TRP HZ2 . 11099 1 360 . 1 1 37 37 TRP HZ3 H 1 6.617 0.030 . 1 . . . . 37 TRP HZ3 . 11099 1 361 . 1 1 37 37 TRP C C 13 173.871 0.300 . 1 . . . . 37 TRP C . 11099 1 362 . 1 1 37 37 TRP CA C 13 56.794 0.300 . 1 . . . . 37 TRP CA . 11099 1 363 . 1 1 37 37 TRP CB C 13 32.552 0.300 . 1 . . . . 37 TRP CB . 11099 1 364 . 1 1 37 37 TRP CD1 C 13 124.557 0.300 . 1 . . . . 37 TRP CD1 . 11099 1 365 . 1 1 37 37 TRP CE3 C 13 119.659 0.300 . 1 . . . . 37 TRP CE3 . 11099 1 366 . 1 1 37 37 TRP CH2 C 13 123.427 0.300 . 1 . . . . 37 TRP CH2 . 11099 1 367 . 1 1 37 37 TRP CZ2 C 13 113.629 0.300 . 1 . . . . 37 TRP CZ2 . 11099 1 368 . 1 1 37 37 TRP CZ3 C 13 120.612 0.300 . 1 . . . . 37 TRP CZ3 . 11099 1 369 . 1 1 37 37 TRP N N 15 120.296 0.300 . 1 . . . . 37 TRP N . 11099 1 370 . 1 1 37 37 TRP NE1 N 15 124.584 0.300 . 1 . . . . 37 TRP NE1 . 11099 1 371 . 1 1 38 38 THR H H 1 7.492 0.030 . 1 . . . . 38 THR H . 11099 1 372 . 1 1 38 38 THR HA H 1 4.773 0.030 . 1 . . . . 38 THR HA . 11099 1 373 . 1 1 38 38 THR HB H 1 4.363 0.030 . 1 . . . . 38 THR HB . 11099 1 374 . 1 1 38 38 THR HG21 H 1 1.098 0.030 . 1 . . . . 38 THR HG2 . 11099 1 375 . 1 1 38 38 THR HG22 H 1 1.098 0.030 . 1 . . . . 38 THR HG2 . 11099 1 376 . 1 1 38 38 THR HG23 H 1 1.098 0.030 . 1 . . . . 38 THR HG2 . 11099 1 377 . 1 1 38 38 THR C C 13 172.186 0.300 . 1 . . . . 38 THR C . 11099 1 378 . 1 1 38 38 THR CA C 13 57.783 0.300 . 1 . . . . 38 THR CA . 11099 1 379 . 1 1 38 38 THR CB C 13 69.539 0.300 . 1 . . . . 38 THR CB . 11099 1 380 . 1 1 38 38 THR CG2 C 13 22.350 0.300 . 1 . . . . 38 THR CG2 . 11099 1 381 . 1 1 38 38 THR N N 15 107.336 0.300 . 1 . . . . 38 THR N . 11099 1 382 . 1 1 39 39 PRO HA H 1 5.222 0.030 . 1 . . . . 39 PRO HA . 11099 1 383 . 1 1 39 39 PRO HB2 H 1 2.501 0.030 . 2 . . . . 39 PRO HB2 . 11099 1 384 . 1 1 39 39 PRO HB3 H 1 2.041 0.030 . 2 . . . . 39 PRO HB3 . 11099 1 385 . 1 1 39 39 PRO HD2 H 1 3.691 0.030 . 2 . . . . 39 PRO HD2 . 11099 1 386 . 1 1 39 39 PRO HD3 H 1 3.554 0.030 . 2 . . . . 39 PRO HD3 . 11099 1 387 . 1 1 39 39 PRO HG2 H 1 2.107 0.030 . 2 . . . . 39 PRO HG2 . 11099 1 388 . 1 1 39 39 PRO HG3 H 1 1.983 0.030 . 2 . . . . 39 PRO HG3 . 11099 1 389 . 1 1 39 39 PRO CA C 13 62.285 0.300 . 1 . . . . 39 PRO CA . 11099 1 390 . 1 1 39 39 PRO CB C 13 30.766 0.300 . 1 . . . . 39 PRO CB . 11099 1 391 . 1 1 39 39 PRO CD C 13 51.094 0.300 . 1 . . . . 39 PRO CD . 11099 1 392 . 1 1 39 39 PRO CG C 13 27.529 0.300 . 1 . . . . 39 PRO CG . 11099 1 393 . 1 1 40 40 PRO HA H 1 4.636 0.030 . 1 . . . . 40 PRO HA . 11099 1 394 . 1 1 40 40 PRO HB2 H 1 2.137 0.030 . 2 . . . . 40 PRO HB2 . 11099 1 395 . 1 1 40 40 PRO HD2 H 1 4.022 0.030 . 2 . . . . 40 PRO HD2 . 11099 1 396 . 1 1 40 40 PRO HD3 H 1 3.737 0.030 . 2 . . . . 40 PRO HD3 . 11099 1 397 . 1 1 40 40 PRO HG2 H 1 1.668 0.030 . 2 . . . . 40 PRO HG2 . 11099 1 398 . 1 1 40 40 PRO HG3 H 1 1.834 0.030 . 2 . . . . 40 PRO HG3 . 11099 1 399 . 1 1 40 40 PRO C C 13 176.240 0.300 . 1 . . . . 40 PRO C . 11099 1 400 . 1 1 40 40 PRO CA C 13 62.989 0.300 . 1 . . . . 40 PRO CA . 11099 1 401 . 1 1 40 40 PRO CB C 13 32.581 0.300 . 1 . . . . 40 PRO CB . 11099 1 402 . 1 1 40 40 PRO CD C 13 50.959 0.300 . 1 . . . . 40 PRO CD . 11099 1 403 . 1 1 40 40 PRO CG C 13 27.902 0.300 . 1 . . . . 40 PRO CG . 11099 1 404 . 1 1 41 41 LEU H H 1 8.483 0.030 . 1 . . . . 41 LEU H . 11099 1 405 . 1 1 41 41 LEU HA H 1 4.013 0.030 . 1 . . . . 41 LEU HA . 11099 1 406 . 1 1 41 41 LEU HB2 H 1 1.698 0.030 . 2 . . . . 41 LEU HB2 . 11099 1 407 . 1 1 41 41 LEU HB3 H 1 1.538 0.030 . 2 . . . . 41 LEU HB3 . 11099 1 408 . 1 1 41 41 LEU HD11 H 1 0.971 0.030 . 1 . . . . 41 LEU HD1 . 11099 1 409 . 1 1 41 41 LEU HD12 H 1 0.971 0.030 . 1 . . . . 41 LEU HD1 . 11099 1 410 . 1 1 41 41 LEU HD13 H 1 0.971 0.030 . 1 . . . . 41 LEU HD1 . 11099 1 411 . 1 1 41 41 LEU HD21 H 1 0.932 0.030 . 1 . . . . 41 LEU HD2 . 11099 1 412 . 1 1 41 41 LEU HD22 H 1 0.932 0.030 . 1 . . . . 41 LEU HD2 . 11099 1 413 . 1 1 41 41 LEU HD23 H 1 0.932 0.030 . 1 . . . . 41 LEU HD2 . 11099 1 414 . 1 1 41 41 LEU HG H 1 1.697 0.030 . 1 . . . . 41 LEU HG . 11099 1 415 . 1 1 41 41 LEU C C 13 177.964 0.300 . 1 . . . . 41 LEU C . 11099 1 416 . 1 1 41 41 LEU CA C 13 57.265 0.300 . 1 . . . . 41 LEU CA . 11099 1 417 . 1 1 41 41 LEU CB C 13 42.522 0.300 . 1 . . . . 41 LEU CB . 11099 1 418 . 1 1 41 41 LEU CD1 C 13 25.002 0.300 . 2 . . . . 41 LEU CD1 . 11099 1 419 . 1 1 41 41 LEU CD2 C 13 23.335 0.300 . 2 . . . . 41 LEU CD2 . 11099 1 420 . 1 1 41 41 LEU CG C 13 27.018 0.300 . 1 . . . . 41 LEU CG . 11099 1 421 . 1 1 41 41 LEU N N 15 122.418 0.300 . 1 . . . . 41 LEU N . 11099 1 422 . 1 1 42 42 ASN H H 1 8.395 0.030 . 1 . . . . 42 ASN H . 11099 1 423 . 1 1 42 42 ASN HA H 1 4.803 0.030 . 1 . . . . 42 ASN HA . 11099 1 424 . 1 1 42 42 ASN HB2 H 1 2.975 0.030 . 2 . . . . 42 ASN HB2 . 11099 1 425 . 1 1 42 42 ASN HB3 H 1 2.833 0.030 . 2 . . . . 42 ASN HB3 . 11099 1 426 . 1 1 42 42 ASN HD21 H 1 7.270 0.030 . 2 . . . . 42 ASN HD21 . 11099 1 427 . 1 1 42 42 ASN HD22 H 1 8.038 0.030 . 2 . . . . 42 ASN HD22 . 11099 1 428 . 1 1 42 42 ASN C C 13 174.655 0.300 . 1 . . . . 42 ASN C . 11099 1 429 . 1 1 42 42 ASN CA C 13 50.707 0.300 . 1 . . . . 42 ASN CA . 11099 1 430 . 1 1 42 42 ASN CB C 13 38.283 0.300 . 1 . . . . 42 ASN CB . 11099 1 431 . 1 1 42 42 ASN N N 15 116.796 0.300 . 1 . . . . 42 ASN N . 11099 1 432 . 1 1 42 42 ASN ND2 N 15 112.622 0.300 . 1 . . . . 42 ASN ND2 . 11099 1 433 . 1 1 43 43 PRO HA H 1 4.597 0.030 . 1 . . . . 43 PRO HA . 11099 1 434 . 1 1 43 43 PRO HB2 H 1 2.054 0.030 . 2 . . . . 43 PRO HB2 . 11099 1 435 . 1 1 43 43 PRO HB3 H 1 2.220 0.030 . 2 . . . . 43 PRO HB3 . 11099 1 436 . 1 1 43 43 PRO HD2 H 1 4.271 0.030 . 2 . . . . 43 PRO HD2 . 11099 1 437 . 1 1 43 43 PRO HD3 H 1 3.852 0.030 . 2 . . . . 43 PRO HD3 . 11099 1 438 . 1 1 43 43 PRO HG2 H 1 2.050 0.030 . 2 . . . . 43 PRO HG2 . 11099 1 439 . 1 1 43 43 PRO HG3 H 1 1.845 0.030 . 2 . . . . 43 PRO HG3 . 11099 1 440 . 1 1 43 43 PRO C C 13 177.267 0.300 . 1 . . . . 43 PRO C . 11099 1 441 . 1 1 43 43 PRO CA C 13 63.583 0.300 . 1 . . . . 43 PRO CA . 11099 1 442 . 1 1 43 43 PRO CB C 13 32.244 0.300 . 1 . . . . 43 PRO CB . 11099 1 443 . 1 1 43 43 PRO CD C 13 50.681 0.300 . 1 . . . . 43 PRO CD . 11099 1 444 . 1 1 43 43 PRO CG C 13 26.263 0.300 . 1 . . . . 43 PRO CG . 11099 1 445 . 1 1 44 44 ASN H H 1 8.209 0.030 . 1 . . . . 44 ASN H . 11099 1 446 . 1 1 44 44 ASN HA H 1 4.640 0.030 . 1 . . . . 44 ASN HA . 11099 1 447 . 1 1 44 44 ASN HB2 H 1 2.958 0.030 . 2 . . . . 44 ASN HB2 . 11099 1 448 . 1 1 44 44 ASN HB3 H 1 2.763 0.030 . 2 . . . . 44 ASN HB3 . 11099 1 449 . 1 1 44 44 ASN HD21 H 1 7.605 0.030 . 2 . . . . 44 ASN HD21 . 11099 1 450 . 1 1 44 44 ASN HD22 H 1 6.996 0.030 . 2 . . . . 44 ASN HD22 . 11099 1 451 . 1 1 44 44 ASN C C 13 173.986 0.300 . 1 . . . . 44 ASN C . 11099 1 452 . 1 1 44 44 ASN CA C 13 54.898 0.300 . 1 . . . . 44 ASN CA . 11099 1 453 . 1 1 44 44 ASN CB C 13 39.384 0.300 . 1 . . . . 44 ASN CB . 11099 1 454 . 1 1 44 44 ASN N N 15 116.596 0.300 . 1 . . . . 44 ASN N . 11099 1 455 . 1 1 44 44 ASN ND2 N 15 113.254 0.300 . 1 . . . . 44 ASN ND2 . 11099 1 456 . 1 1 45 45 ILE H H 1 6.497 0.030 . 1 . . . . 45 ILE H . 11099 1 457 . 1 1 45 45 ILE HA H 1 4.829 0.030 . 1 . . . . 45 ILE HA . 11099 1 458 . 1 1 45 45 ILE HB H 1 1.657 0.030 . 1 . . . . 45 ILE HB . 11099 1 459 . 1 1 45 45 ILE HD11 H 1 0.706 0.030 . 1 . . . . 45 ILE HD1 . 11099 1 460 . 1 1 45 45 ILE HD12 H 1 0.706 0.030 . 1 . . . . 45 ILE HD1 . 11099 1 461 . 1 1 45 45 ILE HD13 H 1 0.706 0.030 . 1 . . . . 45 ILE HD1 . 11099 1 462 . 1 1 45 45 ILE HG12 H 1 1.399 0.030 . 2 . . . . 45 ILE HG12 . 11099 1 463 . 1 1 45 45 ILE HG13 H 1 0.916 0.030 . 2 . . . . 45 ILE HG13 . 11099 1 464 . 1 1 45 45 ILE HG21 H 1 0.695 0.030 . 1 . . . . 45 ILE HG2 . 11099 1 465 . 1 1 45 45 ILE HG22 H 1 0.695 0.030 . 1 . . . . 45 ILE HG2 . 11099 1 466 . 1 1 45 45 ILE HG23 H 1 0.695 0.030 . 1 . . . . 45 ILE HG2 . 11099 1 467 . 1 1 45 45 ILE C C 13 176.618 0.300 . 1 . . . . 45 ILE C . 11099 1 468 . 1 1 45 45 ILE CA C 13 59.276 0.300 . 1 . . . . 45 ILE CA . 11099 1 469 . 1 1 45 45 ILE CB C 13 38.652 0.300 . 1 . . . . 45 ILE CB . 11099 1 470 . 1 1 45 45 ILE CD1 C 13 12.704 0.300 . 1 . . . . 45 ILE CD1 . 11099 1 471 . 1 1 45 45 ILE CG1 C 13 27.865 0.300 . 1 . . . . 45 ILE CG1 . 11099 1 472 . 1 1 45 45 ILE CG2 C 13 16.934 0.300 . 1 . . . . 45 ILE CG2 . 11099 1 473 . 1 1 45 45 ILE N N 15 117.769 0.300 . 1 . . . . 45 ILE N . 11099 1 474 . 1 1 46 46 VAL H H 1 8.229 0.030 . 1 . . . . 46 VAL H . 11099 1 475 . 1 1 46 46 VAL HA H 1 3.605 0.030 . 1 . . . . 46 VAL HA . 11099 1 476 . 1 1 46 46 VAL HB H 1 1.670 0.030 . 1 . . . . 46 VAL HB . 11099 1 477 . 1 1 46 46 VAL HG11 H 1 0.776 0.030 . 1 . . . . 46 VAL HG1 . 11099 1 478 . 1 1 46 46 VAL HG12 H 1 0.776 0.030 . 1 . . . . 46 VAL HG1 . 11099 1 479 . 1 1 46 46 VAL HG13 H 1 0.776 0.030 . 1 . . . . 46 VAL HG1 . 11099 1 480 . 1 1 46 46 VAL HG21 H 1 0.908 0.030 . 1 . . . . 46 VAL HG2 . 11099 1 481 . 1 1 46 46 VAL HG22 H 1 0.908 0.030 . 1 . . . . 46 VAL HG2 . 11099 1 482 . 1 1 46 46 VAL HG23 H 1 0.908 0.030 . 1 . . . . 46 VAL HG2 . 11099 1 483 . 1 1 46 46 VAL C C 13 174.062 0.300 . 1 . . . . 46 VAL C . 11099 1 484 . 1 1 46 46 VAL CA C 13 63.762 0.300 . 1 . . . . 46 VAL CA . 11099 1 485 . 1 1 46 46 VAL CB C 13 33.754 0.300 . 1 . . . . 46 VAL CB . 11099 1 486 . 1 1 46 46 VAL CG1 C 13 20.829 0.300 . 2 . . . . 46 VAL CG1 . 11099 1 487 . 1 1 46 46 VAL CG2 C 13 23.674 0.300 . 2 . . . . 46 VAL CG2 . 11099 1 488 . 1 1 46 46 VAL N N 15 129.077 0.300 . 1 . . . . 46 VAL N . 11099 1 489 . 1 1 47 47 VAL H H 1 8.247 0.030 . 1 . . . . 47 VAL H . 11099 1 490 . 1 1 47 47 VAL HA H 1 3.886 0.030 . 1 . . . . 47 VAL HA . 11099 1 491 . 1 1 47 47 VAL HB H 1 1.958 0.030 . 1 . . . . 47 VAL HB . 11099 1 492 . 1 1 47 47 VAL HG11 H 1 0.526 0.030 . 1 . . . . 47 VAL HG1 . 11099 1 493 . 1 1 47 47 VAL HG12 H 1 0.526 0.030 . 1 . . . . 47 VAL HG1 . 11099 1 494 . 1 1 47 47 VAL HG13 H 1 0.526 0.030 . 1 . . . . 47 VAL HG1 . 11099 1 495 . 1 1 47 47 VAL HG21 H 1 0.795 0.030 . 1 . . . . 47 VAL HG2 . 11099 1 496 . 1 1 47 47 VAL HG22 H 1 0.795 0.030 . 1 . . . . 47 VAL HG2 . 11099 1 497 . 1 1 47 47 VAL HG23 H 1 0.795 0.030 . 1 . . . . 47 VAL HG2 . 11099 1 498 . 1 1 47 47 VAL C C 13 176.264 0.300 . 1 . . . . 47 VAL C . 11099 1 499 . 1 1 47 47 VAL CA C 13 62.235 0.300 . 1 . . . . 47 VAL CA . 11099 1 500 . 1 1 47 47 VAL CB C 13 34.465 0.300 . 1 . . . . 47 VAL CB . 11099 1 501 . 1 1 47 47 VAL CG1 C 13 22.307 0.300 . 2 . . . . 47 VAL CG1 . 11099 1 502 . 1 1 47 47 VAL CG2 C 13 21.708 0.300 . 2 . . . . 47 VAL CG2 . 11099 1 503 . 1 1 47 47 VAL N N 15 125.355 0.300 . 1 . . . . 47 VAL N . 11099 1 504 . 1 1 48 48 ARG H H 1 8.903 0.030 . 1 . . . . 48 ARG H . 11099 1 505 . 1 1 48 48 ARG HA H 1 4.360 0.030 . 1 . . . . 48 ARG HA . 11099 1 506 . 1 1 48 48 ARG HB2 H 1 1.758 0.030 . 2 . . . . 48 ARG HB2 . 11099 1 507 . 1 1 48 48 ARG HB3 H 1 1.339 0.030 . 2 . . . . 48 ARG HB3 . 11099 1 508 . 1 1 48 48 ARG HD2 H 1 3.115 0.030 . 2 . . . . 48 ARG HD2 . 11099 1 509 . 1 1 48 48 ARG HD3 H 1 3.022 0.030 . 2 . . . . 48 ARG HD3 . 11099 1 510 . 1 1 48 48 ARG HE H 1 9.433 0.030 . 1 . . . . 48 ARG HE . 11099 1 511 . 1 1 48 48 ARG HG2 H 1 1.408 0.030 . 2 . . . . 48 ARG HG2 . 11099 1 512 . 1 1 48 48 ARG HG3 H 1 1.666 0.030 . 2 . . . . 48 ARG HG3 . 11099 1 513 . 1 1 48 48 ARG C C 13 176.111 0.300 . 1 . . . . 48 ARG C . 11099 1 514 . 1 1 48 48 ARG CA C 13 55.007 0.300 . 1 . . . . 48 ARG CA . 11099 1 515 . 1 1 48 48 ARG CB C 13 30.989 0.300 . 1 . . . . 48 ARG CB . 11099 1 516 . 1 1 48 48 ARG CD C 13 42.768 0.300 . 1 . . . . 48 ARG CD . 11099 1 517 . 1 1 48 48 ARG CG C 13 26.890 0.300 . 1 . . . . 48 ARG CG . 11099 1 518 . 1 1 48 48 ARG N N 15 122.703 0.300 . 1 . . . . 48 ARG N . 11099 1 519 . 1 1 48 48 ARG NE N 15 86.180 0.300 . 1 . . . . 48 ARG NE . 11099 1 520 . 1 1 49 49 GLY H H 1 6.632 0.030 . 1 . . . . 49 GLY H . 11099 1 521 . 1 1 49 49 GLY HA2 H 1 3.992 0.030 . 2 . . . . 49 GLY HA2 . 11099 1 522 . 1 1 49 49 GLY HA3 H 1 3.201 0.030 . 2 . . . . 49 GLY HA3 . 11099 1 523 . 1 1 49 49 GLY C C 13 168.938 0.300 . 1 . . . . 49 GLY C . 11099 1 524 . 1 1 49 49 GLY CA C 13 45.317 0.300 . 1 . . . . 49 GLY CA . 11099 1 525 . 1 1 49 49 GLY N N 15 106.587 0.300 . 1 . . . . 49 GLY N . 11099 1 526 . 1 1 50 50 TYR H H 1 8.480 0.030 . 1 . . . . 50 TYR H . 11099 1 527 . 1 1 50 50 TYR HA H 1 5.337 0.030 . 1 . . . . 50 TYR HA . 11099 1 528 . 1 1 50 50 TYR HB2 H 1 2.392 0.030 . 2 . . . . 50 TYR HB2 . 11099 1 529 . 1 1 50 50 TYR HB3 H 1 2.314 0.030 . 2 . . . . 50 TYR HB3 . 11099 1 530 . 1 1 50 50 TYR HE1 H 1 6.646 0.030 . 1 . . . . 50 TYR HE1 . 11099 1 531 . 1 1 50 50 TYR HE2 H 1 6.646 0.030 . 1 . . . . 50 TYR HE2 . 11099 1 532 . 1 1 50 50 TYR C C 13 174.222 0.300 . 1 . . . . 50 TYR C . 11099 1 533 . 1 1 50 50 TYR CA C 13 56.390 0.300 . 1 . . . . 50 TYR CA . 11099 1 534 . 1 1 50 50 TYR CB C 13 41.736 0.300 . 1 . . . . 50 TYR CB . 11099 1 535 . 1 1 50 50 TYR CE1 C 13 117.919 0.300 . 1 . . . . 50 TYR CE1 . 11099 1 536 . 1 1 50 50 TYR CE2 C 13 117.919 0.300 . 1 . . . . 50 TYR CE2 . 11099 1 537 . 1 1 50 50 TYR N N 15 114.400 0.300 . 1 . . . . 50 TYR N . 11099 1 538 . 1 1 51 51 ILE H H 1 9.402 0.030 . 1 . . . . 51 ILE H . 11099 1 539 . 1 1 51 51 ILE HA H 1 4.749 0.030 . 1 . . . . 51 ILE HA . 11099 1 540 . 1 1 51 51 ILE HB H 1 1.416 0.030 . 1 . . . . 51 ILE HB . 11099 1 541 . 1 1 51 51 ILE HD11 H 1 0.519 0.030 . 1 . . . . 51 ILE HD1 . 11099 1 542 . 1 1 51 51 ILE HD12 H 1 0.519 0.030 . 1 . . . . 51 ILE HD1 . 11099 1 543 . 1 1 51 51 ILE HD13 H 1 0.519 0.030 . 1 . . . . 51 ILE HD1 . 11099 1 544 . 1 1 51 51 ILE HG12 H 1 1.529 0.030 . 2 . . . . 51 ILE HG12 . 11099 1 545 . 1 1 51 51 ILE HG13 H 1 0.673 0.030 . 2 . . . . 51 ILE HG13 . 11099 1 546 . 1 1 51 51 ILE HG21 H 1 0.731 0.030 . 1 . . . . 51 ILE HG2 . 11099 1 547 . 1 1 51 51 ILE HG22 H 1 0.731 0.030 . 1 . . . . 51 ILE HG2 . 11099 1 548 . 1 1 51 51 ILE HG23 H 1 0.731 0.030 . 1 . . . . 51 ILE HG2 . 11099 1 549 . 1 1 51 51 ILE C C 13 175.492 0.300 . 1 . . . . 51 ILE C . 11099 1 550 . 1 1 51 51 ILE CA C 13 60.289 0.300 . 1 . . . . 51 ILE CA . 11099 1 551 . 1 1 51 51 ILE CB C 13 40.790 0.300 . 1 . . . . 51 ILE CB . 11099 1 552 . 1 1 51 51 ILE CD1 C 13 14.629 0.300 . 1 . . . . 51 ILE CD1 . 11099 1 553 . 1 1 51 51 ILE CG1 C 13 28.053 0.300 . 1 . . . . 51 ILE CG1 . 11099 1 554 . 1 1 51 51 ILE CG2 C 13 18.203 0.300 . 1 . . . . 51 ILE CG2 . 11099 1 555 . 1 1 51 51 ILE N N 15 120.460 0.300 . 1 . . . . 51 ILE N . 11099 1 556 . 1 1 52 52 ILE H H 1 9.429 0.030 . 1 . . . . 52 ILE H . 11099 1 557 . 1 1 52 52 ILE HA H 1 4.638 0.030 . 1 . . . . 52 ILE HA . 11099 1 558 . 1 1 52 52 ILE HB H 1 1.437 0.030 . 1 . . . . 52 ILE HB . 11099 1 559 . 1 1 52 52 ILE HD11 H 1 0.229 0.030 . 1 . . . . 52 ILE HD1 . 11099 1 560 . 1 1 52 52 ILE HD12 H 1 0.229 0.030 . 1 . . . . 52 ILE HD1 . 11099 1 561 . 1 1 52 52 ILE HD13 H 1 0.229 0.030 . 1 . . . . 52 ILE HD1 . 11099 1 562 . 1 1 52 52 ILE HG12 H 1 0.993 0.030 . 2 . . . . 52 ILE HG12 . 11099 1 563 . 1 1 52 52 ILE HG13 H 1 0.465 0.030 . 2 . . . . 52 ILE HG13 . 11099 1 564 . 1 1 52 52 ILE HG21 H 1 0.738 0.030 . 1 . . . . 52 ILE HG2 . 11099 1 565 . 1 1 52 52 ILE HG22 H 1 0.738 0.030 . 1 . . . . 52 ILE HG2 . 11099 1 566 . 1 1 52 52 ILE HG23 H 1 0.738 0.030 . 1 . . . . 52 ILE HG2 . 11099 1 567 . 1 1 52 52 ILE C C 13 174.365 0.300 . 1 . . . . 52 ILE C . 11099 1 568 . 1 1 52 52 ILE CA C 13 60.286 0.300 . 1 . . . . 52 ILE CA . 11099 1 569 . 1 1 52 52 ILE CB C 13 40.634 0.300 . 1 . . . . 52 ILE CB . 11099 1 570 . 1 1 52 52 ILE CD1 C 13 14.909 0.300 . 1 . . . . 52 ILE CD1 . 11099 1 571 . 1 1 52 52 ILE CG1 C 13 28.641 0.300 . 1 . . . . 52 ILE CG1 . 11099 1 572 . 1 1 52 52 ILE CG2 C 13 17.743 0.300 . 1 . . . . 52 ILE CG2 . 11099 1 573 . 1 1 52 52 ILE N N 15 133.015 0.300 . 1 . . . . 52 ILE N . 11099 1 574 . 1 1 53 53 GLY H H 1 9.072 0.030 . 1 . . . . 53 GLY H . 11099 1 575 . 1 1 53 53 GLY HA2 H 1 5.537 0.030 . 2 . . . . 53 GLY HA2 . 11099 1 576 . 1 1 53 53 GLY HA3 H 1 3.580 0.030 . 2 . . . . 53 GLY HA3 . 11099 1 577 . 1 1 53 53 GLY C C 13 172.971 0.300 . 1 . . . . 53 GLY C . 11099 1 578 . 1 1 53 53 GLY CA C 13 43.787 0.300 . 1 . . . . 53 GLY CA . 11099 1 579 . 1 1 53 53 GLY N N 15 116.026 0.300 . 1 . . . . 53 GLY N . 11099 1 580 . 1 1 54 54 TYR H H 1 8.045 0.030 . 1 . . . . 54 TYR H . 11099 1 581 . 1 1 54 54 TYR HA H 1 5.977 0.030 . 1 . . . . 54 TYR HA . 11099 1 582 . 1 1 54 54 TYR HB2 H 1 3.244 0.030 . 2 . . . . 54 TYR HB2 . 11099 1 583 . 1 1 54 54 TYR HB3 H 1 2.701 0.030 . 2 . . . . 54 TYR HB3 . 11099 1 584 . 1 1 54 54 TYR HD1 H 1 6.642 0.030 . 1 . . . . 54 TYR HD1 . 11099 1 585 . 1 1 54 54 TYR HD2 H 1 6.642 0.030 . 1 . . . . 54 TYR HD2 . 11099 1 586 . 1 1 54 54 TYR HE1 H 1 6.572 0.030 . 1 . . . . 54 TYR HE1 . 11099 1 587 . 1 1 54 54 TYR HE2 H 1 6.572 0.030 . 1 . . . . 54 TYR HE2 . 11099 1 588 . 1 1 54 54 TYR C C 13 174.647 0.300 . 1 . . . . 54 TYR C . 11099 1 589 . 1 1 54 54 TYR CA C 13 56.340 0.300 . 1 . . . . 54 TYR CA . 11099 1 590 . 1 1 54 54 TYR CB C 13 41.692 0.300 . 1 . . . . 54 TYR CB . 11099 1 591 . 1 1 54 54 TYR CD1 C 13 133.321 0.300 . 1 . . . . 54 TYR CD1 . 11099 1 592 . 1 1 54 54 TYR CD2 C 13 133.321 0.300 . 1 . . . . 54 TYR CD2 . 11099 1 593 . 1 1 54 54 TYR CE1 C 13 118.404 0.300 . 1 . . . . 54 TYR CE1 . 11099 1 594 . 1 1 54 54 TYR CE2 C 13 118.404 0.300 . 1 . . . . 54 TYR CE2 . 11099 1 595 . 1 1 54 54 TYR N N 15 115.063 0.300 . 1 . . . . 54 TYR N . 11099 1 596 . 1 1 55 55 GLY H H 1 8.060 0.030 . 1 . . . . 55 GLY H . 11099 1 597 . 1 1 55 55 GLY HA2 H 1 4.592 0.030 . 2 . . . . 55 GLY HA2 . 11099 1 598 . 1 1 55 55 GLY HA3 H 1 4.225 0.030 . 2 . . . . 55 GLY HA3 . 11099 1 599 . 1 1 55 55 GLY C C 13 172.146 0.300 . 1 . . . . 55 GLY C . 11099 1 600 . 1 1 55 55 GLY CA C 13 46.095 0.300 . 1 . . . . 55 GLY CA . 11099 1 601 . 1 1 55 55 GLY N N 15 104.391 0.300 . 1 . . . . 55 GLY N . 11099 1 602 . 1 1 56 56 VAL H H 1 8.590 0.030 . 1 . . . . 56 VAL H . 11099 1 603 . 1 1 56 56 VAL HA H 1 4.012 0.030 . 1 . . . . 56 VAL HA . 11099 1 604 . 1 1 56 56 VAL HB H 1 1.910 0.030 . 1 . . . . 56 VAL HB . 11099 1 605 . 1 1 56 56 VAL HG11 H 1 0.804 0.030 . 1 . . . . 56 VAL HG1 . 11099 1 606 . 1 1 56 56 VAL HG12 H 1 0.804 0.030 . 1 . . . . 56 VAL HG1 . 11099 1 607 . 1 1 56 56 VAL HG13 H 1 0.804 0.030 . 1 . . . . 56 VAL HG1 . 11099 1 608 . 1 1 56 56 VAL HG21 H 1 0.600 0.030 . 1 . . . . 56 VAL HG2 . 11099 1 609 . 1 1 56 56 VAL HG22 H 1 0.600 0.030 . 1 . . . . 56 VAL HG2 . 11099 1 610 . 1 1 56 56 VAL HG23 H 1 0.600 0.030 . 1 . . . . 56 VAL HG2 . 11099 1 611 . 1 1 56 56 VAL C C 13 178.538 0.300 . 1 . . . . 56 VAL C . 11099 1 612 . 1 1 56 56 VAL CA C 13 63.342 0.300 . 1 . . . . 56 VAL CA . 11099 1 613 . 1 1 56 56 VAL CB C 13 31.227 0.300 . 1 . . . . 56 VAL CB . 11099 1 614 . 1 1 56 56 VAL CG1 C 13 20.891 0.300 . 2 . . . . 56 VAL CG1 . 11099 1 615 . 1 1 56 56 VAL CG2 C 13 21.214 0.300 . 2 . . . . 56 VAL CG2 . 11099 1 616 . 1 1 56 56 VAL N N 15 121.212 0.300 . 1 . . . . 56 VAL N . 11099 1 617 . 1 1 57 57 GLY H H 1 8.744 0.030 . 1 . . . . 57 GLY H . 11099 1 618 . 1 1 57 57 GLY HA2 H 1 4.143 0.030 . 2 . . . . 57 GLY HA2 . 11099 1 619 . 1 1 57 57 GLY HA3 H 1 3.666 0.030 . 2 . . . . 57 GLY HA3 . 11099 1 620 . 1 1 57 57 GLY C C 13 173.118 0.300 . 1 . . . . 57 GLY C . 11099 1 621 . 1 1 57 57 GLY CA C 13 45.963 0.300 . 1 . . . . 57 GLY CA . 11099 1 622 . 1 1 57 57 GLY N N 15 115.971 0.300 . 1 . . . . 57 GLY N . 11099 1 623 . 1 1 58 58 SER H H 1 7.170 0.030 . 1 . . . . 58 SER H . 11099 1 624 . 1 1 58 58 SER HA H 1 4.619 0.030 . 1 . . . . 58 SER HA . 11099 1 625 . 1 1 58 58 SER HB2 H 1 3.719 0.030 . 2 . . . . 58 SER HB2 . 11099 1 626 . 1 1 58 58 SER HB3 H 1 3.853 0.030 . 2 . . . . 58 SER HB3 . 11099 1 627 . 1 1 58 58 SER C C 13 172.151 0.300 . 1 . . . . 58 SER C . 11099 1 628 . 1 1 58 58 SER CA C 13 55.095 0.300 . 1 . . . . 58 SER CA . 11099 1 629 . 1 1 58 58 SER CB C 13 63.900 0.300 . 1 . . . . 58 SER CB . 11099 1 630 . 1 1 58 58 SER N N 15 113.596 0.300 . 1 . . . . 58 SER N . 11099 1 631 . 1 1 59 59 PRO HA H 1 4.494 0.030 . 1 . . . . 59 PRO HA . 11099 1 632 . 1 1 59 59 PRO HB2 H 1 1.878 0.030 . 2 . . . . 59 PRO HB2 . 11099 1 633 . 1 1 59 59 PRO HB3 H 1 1.484 0.030 . 2 . . . . 59 PRO HB3 . 11099 1 634 . 1 1 59 59 PRO HD2 H 1 3.159 0.030 . 2 . . . . 59 PRO HD2 . 11099 1 635 . 1 1 59 59 PRO HD3 H 1 3.260 0.030 . 2 . . . . 59 PRO HD3 . 11099 1 636 . 1 1 59 59 PRO HG2 H 1 1.640 0.030 . 2 . . . . 59 PRO HG2 . 11099 1 637 . 1 1 59 59 PRO HG3 H 1 1.102 0.030 . 2 . . . . 59 PRO HG3 . 11099 1 638 . 1 1 59 59 PRO C C 13 174.562 0.300 . 1 . . . . 59 PRO C . 11099 1 639 . 1 1 59 59 PRO CA C 13 63.015 0.300 . 1 . . . . 59 PRO CA . 11099 1 640 . 1 1 59 59 PRO CB C 13 29.803 0.300 . 1 . . . . 59 PRO CB . 11099 1 641 . 1 1 59 59 PRO CD C 13 49.198 0.300 . 1 . . . . 59 PRO CD . 11099 1 642 . 1 1 59 59 PRO CG C 13 25.911 0.300 . 1 . . . . 59 PRO CG . 11099 1 643 . 1 1 60 60 TYR H H 1 7.059 0.030 . 1 . . . . 60 TYR H . 11099 1 644 . 1 1 60 60 TYR HA H 1 4.566 0.030 . 1 . . . . 60 TYR HA . 11099 1 645 . 1 1 60 60 TYR HB2 H 1 3.264 0.030 . 2 . . . . 60 TYR HB2 . 11099 1 646 . 1 1 60 60 TYR HB3 H 1 2.432 0.030 . 2 . . . . 60 TYR HB3 . 11099 1 647 . 1 1 60 60 TYR HD1 H 1 6.967 0.030 . 1 . . . . 60 TYR HD1 . 11099 1 648 . 1 1 60 60 TYR HD2 H 1 6.967 0.030 . 1 . . . . 60 TYR HD2 . 11099 1 649 . 1 1 60 60 TYR HE1 H 1 6.781 0.030 . 1 . . . . 60 TYR HE1 . 11099 1 650 . 1 1 60 60 TYR HE2 H 1 6.781 0.030 . 1 . . . . 60 TYR HE2 . 11099 1 651 . 1 1 60 60 TYR C C 13 175.792 0.300 . 1 . . . . 60 TYR C . 11099 1 652 . 1 1 60 60 TYR CA C 13 56.747 0.300 . 1 . . . . 60 TYR CA . 11099 1 653 . 1 1 60 60 TYR CB C 13 38.890 0.300 . 1 . . . . 60 TYR CB . 11099 1 654 . 1 1 60 60 TYR CD1 C 13 132.799 0.300 . 1 . . . . 60 TYR CD1 . 11099 1 655 . 1 1 60 60 TYR CD2 C 13 132.799 0.300 . 1 . . . . 60 TYR CD2 . 11099 1 656 . 1 1 60 60 TYR CE1 C 13 118.247 0.300 . 1 . . . . 60 TYR CE1 . 11099 1 657 . 1 1 60 60 TYR CE2 C 13 118.247 0.300 . 1 . . . . 60 TYR CE2 . 11099 1 658 . 1 1 60 60 TYR N N 15 114.853 0.300 . 1 . . . . 60 TYR N . 11099 1 659 . 1 1 61 61 ALA H H 1 7.118 0.030 . 1 . . . . 61 ALA H . 11099 1 660 . 1 1 61 61 ALA HA H 1 4.048 0.030 . 1 . . . . 61 ALA HA . 11099 1 661 . 1 1 61 61 ALA HB1 H 1 1.686 0.030 . 1 . . . . 61 ALA HB . 11099 1 662 . 1 1 61 61 ALA HB2 H 1 1.686 0.030 . 1 . . . . 61 ALA HB . 11099 1 663 . 1 1 61 61 ALA HB3 H 1 1.686 0.030 . 1 . . . . 61 ALA HB . 11099 1 664 . 1 1 61 61 ALA C C 13 177.690 0.300 . 1 . . . . 61 ALA C . 11099 1 665 . 1 1 61 61 ALA CA C 13 55.676 0.300 . 1 . . . . 61 ALA CA . 11099 1 666 . 1 1 61 61 ALA CB C 13 19.263 0.300 . 1 . . . . 61 ALA CB . 11099 1 667 . 1 1 61 61 ALA N N 15 123.945 0.300 . 1 . . . . 61 ALA N . 11099 1 668 . 1 1 62 62 GLU H H 1 7.746 0.030 . 1 . . . . 62 GLU H . 11099 1 669 . 1 1 62 62 GLU HA H 1 4.501 0.030 . 1 . . . . 62 GLU HA . 11099 1 670 . 1 1 62 62 GLU HB2 H 1 1.394 0.030 . 2 . . . . 62 GLU HB2 . 11099 1 671 . 1 1 62 62 GLU HB3 H 1 0.665 0.030 . 2 . . . . 62 GLU HB3 . 11099 1 672 . 1 1 62 62 GLU HG2 H 1 2.016 0.030 . 1 . . . . 62 GLU HG2 . 11099 1 673 . 1 1 62 62 GLU HG3 H 1 2.016 0.030 . 1 . . . . 62 GLU HG3 . 11099 1 674 . 1 1 62 62 GLU C C 13 174.952 0.300 . 1 . . . . 62 GLU C . 11099 1 675 . 1 1 62 62 GLU CA C 13 54.430 0.300 . 1 . . . . 62 GLU CA . 11099 1 676 . 1 1 62 62 GLU CB C 13 32.401 0.300 . 1 . . . . 62 GLU CB . 11099 1 677 . 1 1 62 62 GLU CG C 13 35.530 0.300 . 1 . . . . 62 GLU CG . 11099 1 678 . 1 1 62 62 GLU N N 15 115.709 0.300 . 1 . . . . 62 GLU N . 11099 1 679 . 1 1 63 63 THR H H 1 8.156 0.030 . 1 . . . . 63 THR H . 11099 1 680 . 1 1 63 63 THR HA H 1 5.547 0.030 . 1 . . . . 63 THR HA . 11099 1 681 . 1 1 63 63 THR HB H 1 3.792 0.030 . 1 . . . . 63 THR HB . 11099 1 682 . 1 1 63 63 THR HG21 H 1 1.030 0.030 . 1 . . . . 63 THR HG2 . 11099 1 683 . 1 1 63 63 THR HG22 H 1 1.030 0.030 . 1 . . . . 63 THR HG2 . 11099 1 684 . 1 1 63 63 THR HG23 H 1 1.030 0.030 . 1 . . . . 63 THR HG2 . 11099 1 685 . 1 1 63 63 THR C C 13 174.147 0.300 . 1 . . . . 63 THR C . 11099 1 686 . 1 1 63 63 THR CA C 13 60.305 0.300 . 1 . . . . 63 THR CA . 11099 1 687 . 1 1 63 63 THR CB C 13 72.440 0.300 . 1 . . . . 63 THR CB . 11099 1 688 . 1 1 63 63 THR CG2 C 13 21.552 0.300 . 1 . . . . 63 THR CG2 . 11099 1 689 . 1 1 63 63 THR N N 15 113.052 0.300 . 1 . . . . 63 THR N . 11099 1 690 . 1 1 64 64 VAL H H 1 9.490 0.030 . 1 . . . . 64 VAL H . 11099 1 691 . 1 1 64 64 VAL HA H 1 4.341 0.030 . 1 . . . . 64 VAL HA . 11099 1 692 . 1 1 64 64 VAL HB H 1 1.802 0.030 . 1 . . . . 64 VAL HB . 11099 1 693 . 1 1 64 64 VAL HG11 H 1 0.773 0.030 . 1 . . . . 64 VAL HG1 . 11099 1 694 . 1 1 64 64 VAL HG12 H 1 0.773 0.030 . 1 . . . . 64 VAL HG1 . 11099 1 695 . 1 1 64 64 VAL HG13 H 1 0.773 0.030 . 1 . . . . 64 VAL HG1 . 11099 1 696 . 1 1 64 64 VAL HG21 H 1 0.930 0.030 . 1 . . . . 64 VAL HG2 . 11099 1 697 . 1 1 64 64 VAL HG22 H 1 0.930 0.030 . 1 . . . . 64 VAL HG2 . 11099 1 698 . 1 1 64 64 VAL HG23 H 1 0.930 0.030 . 1 . . . . 64 VAL HG2 . 11099 1 699 . 1 1 64 64 VAL C C 13 173.546 0.300 . 1 . . . . 64 VAL C . 11099 1 700 . 1 1 64 64 VAL CA C 13 61.031 0.300 . 1 . . . . 64 VAL CA . 11099 1 701 . 1 1 64 64 VAL CB C 13 36.120 0.300 . 1 . . . . 64 VAL CB . 11099 1 702 . 1 1 64 64 VAL CG1 C 13 20.612 0.300 . 2 . . . . 64 VAL CG1 . 11099 1 703 . 1 1 64 64 VAL CG2 C 13 20.456 0.300 . 2 . . . . 64 VAL CG2 . 11099 1 704 . 1 1 64 64 VAL N N 15 124.845 0.300 . 1 . . . . 64 VAL N . 11099 1 705 . 1 1 65 65 ARG H H 1 8.472 0.030 . 1 . . . . 65 ARG H . 11099 1 706 . 1 1 65 65 ARG HA H 1 5.396 0.030 . 1 . . . . 65 ARG HA . 11099 1 707 . 1 1 65 65 ARG HB2 H 1 1.773 0.030 . 2 . . . . 65 ARG HB2 . 11099 1 708 . 1 1 65 65 ARG HB3 H 1 1.647 0.030 . 2 . . . . 65 ARG HB3 . 11099 1 709 . 1 1 65 65 ARG HD2 H 1 2.985 0.030 . 2 . . . . 65 ARG HD2 . 11099 1 710 . 1 1 65 65 ARG HD3 H 1 2.847 0.030 . 2 . . . . 65 ARG HD3 . 11099 1 711 . 1 1 65 65 ARG HG2 H 1 1.546 0.030 . 2 . . . . 65 ARG HG2 . 11099 1 712 . 1 1 65 65 ARG HG3 H 1 1.368 0.030 . 2 . . . . 65 ARG HG3 . 11099 1 713 . 1 1 65 65 ARG C C 13 176.204 0.300 . 1 . . . . 65 ARG C . 11099 1 714 . 1 1 65 65 ARG CA C 13 54.931 0.300 . 1 . . . . 65 ARG CA . 11099 1 715 . 1 1 65 65 ARG CB C 13 32.625 0.300 . 1 . . . . 65 ARG CB . 11099 1 716 . 1 1 65 65 ARG CD C 13 43.477 0.300 . 1 . . . . 65 ARG CD . 11099 1 717 . 1 1 65 65 ARG CG C 13 28.420 0.300 . 1 . . . . 65 ARG CG . 11099 1 718 . 1 1 65 65 ARG N N 15 124.786 0.300 . 1 . . . . 65 ARG N . 11099 1 719 . 1 1 66 66 VAL H H 1 9.144 0.030 . 1 . . . . 66 VAL H . 11099 1 720 . 1 1 66 66 VAL HA H 1 4.984 0.030 . 1 . . . . 66 VAL HA . 11099 1 721 . 1 1 66 66 VAL HB H 1 2.464 0.030 . 1 . . . . 66 VAL HB . 11099 1 722 . 1 1 66 66 VAL HG11 H 1 0.854 0.030 . 1 . . . . 66 VAL HG1 . 11099 1 723 . 1 1 66 66 VAL HG12 H 1 0.854 0.030 . 1 . . . . 66 VAL HG1 . 11099 1 724 . 1 1 66 66 VAL HG13 H 1 0.854 0.030 . 1 . . . . 66 VAL HG1 . 11099 1 725 . 1 1 66 66 VAL HG21 H 1 1.075 0.030 . 1 . . . . 66 VAL HG2 . 11099 1 726 . 1 1 66 66 VAL HG22 H 1 1.075 0.030 . 1 . . . . 66 VAL HG2 . 11099 1 727 . 1 1 66 66 VAL HG23 H 1 1.075 0.030 . 1 . . . . 66 VAL HG2 . 11099 1 728 . 1 1 66 66 VAL C C 13 175.914 0.300 . 1 . . . . 66 VAL C . 11099 1 729 . 1 1 66 66 VAL CA C 13 58.899 0.300 . 1 . . . . 66 VAL CA . 11099 1 730 . 1 1 66 66 VAL CB C 13 35.775 0.300 . 1 . . . . 66 VAL CB . 11099 1 731 . 1 1 66 66 VAL CG1 C 13 21.879 0.300 . 2 . . . . 66 VAL CG1 . 11099 1 732 . 1 1 66 66 VAL CG2 C 13 20.107 0.300 . 2 . . . . 66 VAL CG2 . 11099 1 733 . 1 1 66 66 VAL N N 15 115.898 0.300 . 1 . . . . 66 VAL N . 11099 1 734 . 1 1 67 67 ASP H H 1 8.704 0.030 . 1 . . . . 67 ASP H . 11099 1 735 . 1 1 67 67 ASP HA H 1 4.860 0.030 . 1 . . . . 67 ASP HA . 11099 1 736 . 1 1 67 67 ASP HB2 H 1 3.381 0.030 . 2 . . . . 67 ASP HB2 . 11099 1 737 . 1 1 67 67 ASP HB3 H 1 2.824 0.030 . 2 . . . . 67 ASP HB3 . 11099 1 738 . 1 1 67 67 ASP C C 13 176.116 0.300 . 1 . . . . 67 ASP C . 11099 1 739 . 1 1 67 67 ASP CA C 13 54.606 0.300 . 1 . . . . 67 ASP CA . 11099 1 740 . 1 1 67 67 ASP CB C 13 42.140 0.300 . 1 . . . . 67 ASP CB . 11099 1 741 . 1 1 67 67 ASP N N 15 120.879 0.300 . 1 . . . . 67 ASP N . 11099 1 742 . 1 1 68 68 SER H H 1 7.631 0.030 . 1 . . . . 68 SER H . 11099 1 743 . 1 1 68 68 SER HA H 1 3.975 0.030 . 1 . . . . 68 SER HA . 11099 1 744 . 1 1 68 68 SER HB2 H 1 3.444 0.030 . 2 . . . . 68 SER HB2 . 11099 1 745 . 1 1 68 68 SER HB3 H 1 3.904 0.030 . 2 . . . . 68 SER HB3 . 11099 1 746 . 1 1 68 68 SER C C 13 175.991 0.300 . 1 . . . . 68 SER C . 11099 1 747 . 1 1 68 68 SER CA C 13 60.850 0.300 . 1 . . . . 68 SER CA . 11099 1 748 . 1 1 68 68 SER CB C 13 63.700 0.300 . 1 . . . . 68 SER CB . 11099 1 749 . 1 1 68 68 SER N N 15 110.585 0.300 . 1 . . . . 68 SER N . 11099 1 750 . 1 1 69 69 LYS H H 1 8.687 0.030 . 1 . . . . 69 LYS H . 11099 1 751 . 1 1 69 69 LYS HA H 1 4.352 0.030 . 1 . . . . 69 LYS HA . 11099 1 752 . 1 1 69 69 LYS HB2 H 1 1.940 0.030 . 2 . . . . 69 LYS HB2 . 11099 1 753 . 1 1 69 69 LYS HB3 H 1 1.876 0.030 . 2 . . . . 69 LYS HB3 . 11099 1 754 . 1 1 69 69 LYS HD2 H 1 1.695 0.030 . 1 . . . . 69 LYS HD2 . 11099 1 755 . 1 1 69 69 LYS HD3 H 1 1.695 0.030 . 1 . . . . 69 LYS HD3 . 11099 1 756 . 1 1 69 69 LYS HE2 H 1 3.003 0.030 . 1 . . . . 69 LYS HE2 . 11099 1 757 . 1 1 69 69 LYS HE3 H 1 3.003 0.030 . 1 . . . . 69 LYS HE3 . 11099 1 758 . 1 1 69 69 LYS HG2 H 1 1.508 0.030 . 2 . . . . 69 LYS HG2 . 11099 1 759 . 1 1 69 69 LYS HG3 H 1 1.454 0.030 . 2 . . . . 69 LYS HG3 . 11099 1 760 . 1 1 69 69 LYS C C 13 176.700 0.300 . 1 . . . . 69 LYS C . 11099 1 761 . 1 1 69 69 LYS CA C 13 56.713 0.300 . 1 . . . . 69 LYS CA . 11099 1 762 . 1 1 69 69 LYS CB C 13 32.252 0.300 . 1 . . . . 69 LYS CB . 11099 1 763 . 1 1 69 69 LYS CD C 13 28.896 0.300 . 1 . . . . 69 LYS CD . 11099 1 764 . 1 1 69 69 LYS CE C 13 42.054 0.300 . 1 . . . . 69 LYS CE . 11099 1 765 . 1 1 69 69 LYS CG C 13 25.284 0.300 . 1 . . . . 69 LYS CG . 11099 1 766 . 1 1 69 69 LYS N N 15 122.057 0.300 . 1 . . . . 69 LYS N . 11099 1 767 . 1 1 70 70 GLN H H 1 7.590 0.030 . 1 . . . . 70 GLN H . 11099 1 768 . 1 1 70 70 GLN HA H 1 4.060 0.030 . 1 . . . . 70 GLN HA . 11099 1 769 . 1 1 70 70 GLN HB2 H 1 2.347 0.030 . 2 . . . . 70 GLN HB2 . 11099 1 770 . 1 1 70 70 GLN HB3 H 1 2.286 0.030 . 2 . . . . 70 GLN HB3 . 11099 1 771 . 1 1 70 70 GLN HE21 H 1 7.103 0.030 . 2 . . . . 70 GLN HE21 . 11099 1 772 . 1 1 70 70 GLN HE22 H 1 8.487 0.030 . 2 . . . . 70 GLN HE22 . 11099 1 773 . 1 1 70 70 GLN HG2 H 1 2.787 0.030 . 2 . . . . 70 GLN HG2 . 11099 1 774 . 1 1 70 70 GLN HG3 H 1 2.599 0.030 . 2 . . . . 70 GLN HG3 . 11099 1 775 . 1 1 70 70 GLN C C 13 176.078 0.300 . 1 . . . . 70 GLN C . 11099 1 776 . 1 1 70 70 GLN CA C 13 56.167 0.300 . 1 . . . . 70 GLN CA . 11099 1 777 . 1 1 70 70 GLN CB C 13 28.951 0.300 . 1 . . . . 70 GLN CB . 11099 1 778 . 1 1 70 70 GLN CG C 13 33.875 0.300 . 1 . . . . 70 GLN CG . 11099 1 779 . 1 1 70 70 GLN N N 15 120.199 0.300 . 1 . . . . 70 GLN N . 11099 1 780 . 1 1 70 70 GLN NE2 N 15 115.612 0.300 . 1 . . . . 70 GLN NE2 . 11099 1 781 . 1 1 71 71 ARG H H 1 8.140 0.030 . 1 . . . . 71 ARG H . 11099 1 782 . 1 1 71 71 ARG HA H 1 2.598 0.030 . 1 . . . . 71 ARG HA . 11099 1 783 . 1 1 71 71 ARG HB2 H 1 1.760 0.030 . 2 . . . . 71 ARG HB2 . 11099 1 784 . 1 1 71 71 ARG HB3 H 1 1.097 0.030 . 2 . . . . 71 ARG HB3 . 11099 1 785 . 1 1 71 71 ARG HD2 H 1 2.967 0.030 . 2 . . . . 71 ARG HD2 . 11099 1 786 . 1 1 71 71 ARG HG2 H 1 1.430 0.030 . 2 . . . . 71 ARG HG2 . 11099 1 787 . 1 1 71 71 ARG HG3 H 1 1.198 0.030 . 2 . . . . 71 ARG HG3 . 11099 1 788 . 1 1 71 71 ARG C C 13 172.647 0.300 . 1 . . . . 71 ARG C . 11099 1 789 . 1 1 71 71 ARG CA C 13 52.790 0.300 . 1 . . . . 71 ARG CA . 11099 1 790 . 1 1 71 71 ARG CB C 13 31.625 0.300 . 1 . . . . 71 ARG CB . 11099 1 791 . 1 1 71 71 ARG CD C 13 42.129 0.300 . 1 . . . . 71 ARG CD . 11099 1 792 . 1 1 71 71 ARG CG C 13 26.610 0.300 . 1 . . . . 71 ARG CG . 11099 1 793 . 1 1 71 71 ARG N N 15 120.435 0.300 . 1 . . . . 71 ARG N . 11099 1 794 . 1 1 72 72 TYR H H 1 6.624 0.030 . 1 . . . . 72 TYR H . 11099 1 795 . 1 1 72 72 TYR HA H 1 4.976 0.030 . 1 . . . . 72 TYR HA . 11099 1 796 . 1 1 72 72 TYR HB2 H 1 2.724 0.030 . 2 . . . . 72 TYR HB2 . 11099 1 797 . 1 1 72 72 TYR HB3 H 1 2.653 0.030 . 2 . . . . 72 TYR HB3 . 11099 1 798 . 1 1 72 72 TYR HD1 H 1 6.819 0.030 . 1 . . . . 72 TYR HD1 . 11099 1 799 . 1 1 72 72 TYR HD2 H 1 6.819 0.030 . 1 . . . . 72 TYR HD2 . 11099 1 800 . 1 1 72 72 TYR HE1 H 1 6.615 0.030 . 1 . . . . 72 TYR HE1 . 11099 1 801 . 1 1 72 72 TYR HE2 H 1 6.615 0.030 . 1 . . . . 72 TYR HE2 . 11099 1 802 . 1 1 72 72 TYR C C 13 174.128 0.300 . 1 . . . . 72 TYR C . 11099 1 803 . 1 1 72 72 TYR CA C 13 55.671 0.300 . 1 . . . . 72 TYR CA . 11099 1 804 . 1 1 72 72 TYR CB C 13 42.189 0.300 . 1 . . . . 72 TYR CB . 11099 1 805 . 1 1 72 72 TYR CD1 C 13 133.347 0.300 . 1 . . . . 72 TYR CD1 . 11099 1 806 . 1 1 72 72 TYR CD2 C 13 133.347 0.300 . 1 . . . . 72 TYR CD2 . 11099 1 807 . 1 1 72 72 TYR CE1 C 13 117.680 0.300 . 1 . . . . 72 TYR CE1 . 11099 1 808 . 1 1 72 72 TYR CE2 C 13 117.680 0.300 . 1 . . . . 72 TYR CE2 . 11099 1 809 . 1 1 72 72 TYR N N 15 118.111 0.300 . 1 . . . . 72 TYR N . 11099 1 810 . 1 1 73 73 TYR H H 1 8.685 0.030 . 1 . . . . 73 TYR H . 11099 1 811 . 1 1 73 73 TYR HA H 1 4.348 0.030 . 1 . . . . 73 TYR HA . 11099 1 812 . 1 1 73 73 TYR HB2 H 1 3.348 0.030 . 2 . . . . 73 TYR HB2 . 11099 1 813 . 1 1 73 73 TYR HB3 H 1 2.832 0.030 . 2 . . . . 73 TYR HB3 . 11099 1 814 . 1 1 73 73 TYR HD1 H 1 6.980 0.030 . 1 . . . . 73 TYR HD1 . 11099 1 815 . 1 1 73 73 TYR HD2 H 1 6.980 0.030 . 1 . . . . 73 TYR HD2 . 11099 1 816 . 1 1 73 73 TYR HE1 H 1 6.626 0.030 . 1 . . . . 73 TYR HE1 . 11099 1 817 . 1 1 73 73 TYR HE2 H 1 6.626 0.030 . 1 . . . . 73 TYR HE2 . 11099 1 818 . 1 1 73 73 TYR C C 13 172.461 0.300 . 1 . . . . 73 TYR C . 11099 1 819 . 1 1 73 73 TYR CA C 13 59.514 0.300 . 1 . . . . 73 TYR CA . 11099 1 820 . 1 1 73 73 TYR CB C 13 42.581 0.300 . 1 . . . . 73 TYR CB . 11099 1 821 . 1 1 73 73 TYR CD1 C 13 132.754 0.300 . 1 . . . . 73 TYR CD1 . 11099 1 822 . 1 1 73 73 TYR CD2 C 13 132.754 0.300 . 1 . . . . 73 TYR CD2 . 11099 1 823 . 1 1 73 73 TYR CE1 C 13 117.619 0.300 . 1 . . . . 73 TYR CE1 . 11099 1 824 . 1 1 73 73 TYR CE2 C 13 117.619 0.300 . 1 . . . . 73 TYR CE2 . 11099 1 825 . 1 1 73 73 TYR N N 15 123.456 0.300 . 1 . . . . 73 TYR N . 11099 1 826 . 1 1 74 74 SER H H 1 7.289 0.030 . 1 . . . . 74 SER H . 11099 1 827 . 1 1 74 74 SER HA H 1 4.695 0.030 . 1 . . . . 74 SER HA . 11099 1 828 . 1 1 74 74 SER HB2 H 1 3.462 0.030 . 2 . . . . 74 SER HB2 . 11099 1 829 . 1 1 74 74 SER HB3 H 1 3.301 0.030 . 2 . . . . 74 SER HB3 . 11099 1 830 . 1 1 74 74 SER C C 13 172.417 0.300 . 1 . . . . 74 SER C . 11099 1 831 . 1 1 74 74 SER CA C 13 55.948 0.300 . 1 . . . . 74 SER CA . 11099 1 832 . 1 1 74 74 SER CB C 13 63.066 0.300 . 1 . . . . 74 SER CB . 11099 1 833 . 1 1 74 74 SER N N 15 121.709 0.300 . 1 . . . . 74 SER N . 11099 1 834 . 1 1 75 75 ILE H H 1 8.774 0.030 . 1 . . . . 75 ILE H . 11099 1 835 . 1 1 75 75 ILE HA H 1 3.673 0.030 . 1 . . . . 75 ILE HA . 11099 1 836 . 1 1 75 75 ILE HB H 1 1.378 0.030 . 1 . . . . 75 ILE HB . 11099 1 837 . 1 1 75 75 ILE HD11 H 1 0.445 0.030 . 1 . . . . 75 ILE HD1 . 11099 1 838 . 1 1 75 75 ILE HD12 H 1 0.445 0.030 . 1 . . . . 75 ILE HD1 . 11099 1 839 . 1 1 75 75 ILE HD13 H 1 0.445 0.030 . 1 . . . . 75 ILE HD1 . 11099 1 840 . 1 1 75 75 ILE HG12 H 1 1.594 0.030 . 2 . . . . 75 ILE HG12 . 11099 1 841 . 1 1 75 75 ILE HG13 H 1 0.536 0.030 . 2 . . . . 75 ILE HG13 . 11099 1 842 . 1 1 75 75 ILE HG21 H 1 -0.158 0.030 . 1 . . . . 75 ILE HG2 . 11099 1 843 . 1 1 75 75 ILE HG22 H 1 -0.158 0.030 . 1 . . . . 75 ILE HG2 . 11099 1 844 . 1 1 75 75 ILE HG23 H 1 -0.158 0.030 . 1 . . . . 75 ILE HG2 . 11099 1 845 . 1 1 75 75 ILE C C 13 175.212 0.300 . 1 . . . . 75 ILE C . 11099 1 846 . 1 1 75 75 ILE CA C 13 61.528 0.300 . 1 . . . . 75 ILE CA . 11099 1 847 . 1 1 75 75 ILE CB C 13 37.584 0.300 . 1 . . . . 75 ILE CB . 11099 1 848 . 1 1 75 75 ILE CD1 C 13 14.023 0.300 . 1 . . . . 75 ILE CD1 . 11099 1 849 . 1 1 75 75 ILE CG1 C 13 26.937 0.300 . 1 . . . . 75 ILE CG1 . 11099 1 850 . 1 1 75 75 ILE CG2 C 13 18.065 0.300 . 1 . . . . 75 ILE CG2 . 11099 1 851 . 1 1 75 75 ILE N N 15 127.724 0.300 . 1 . . . . 75 ILE N . 11099 1 852 . 1 1 76 76 GLU H H 1 7.929 0.030 . 1 . . . . 76 GLU H . 11099 1 853 . 1 1 76 76 GLU HA H 1 4.482 0.030 . 1 . . . . 76 GLU HA . 11099 1 854 . 1 1 76 76 GLU HB2 H 1 2.084 0.030 . 2 . . . . 76 GLU HB2 . 11099 1 855 . 1 1 76 76 GLU HB3 H 1 1.722 0.030 . 2 . . . . 76 GLU HB3 . 11099 1 856 . 1 1 76 76 GLU HG2 H 1 2.116 0.030 . 2 . . . . 76 GLU HG2 . 11099 1 857 . 1 1 76 76 GLU HG3 H 1 2.003 0.030 . 2 . . . . 76 GLU HG3 . 11099 1 858 . 1 1 76 76 GLU C C 13 174.681 0.300 . 1 . . . . 76 GLU C . 11099 1 859 . 1 1 76 76 GLU CA C 13 55.148 0.300 . 1 . . . . 76 GLU CA . 11099 1 860 . 1 1 76 76 GLU CB C 13 32.697 0.300 . 1 . . . . 76 GLU CB . 11099 1 861 . 1 1 76 76 GLU CG C 13 36.505 0.300 . 1 . . . . 76 GLU CG . 11099 1 862 . 1 1 76 76 GLU N N 15 124.952 0.300 . 1 . . . . 76 GLU N . 11099 1 863 . 1 1 77 77 ARG H H 1 8.797 0.030 . 1 . . . . 77 ARG H . 11099 1 864 . 1 1 77 77 ARG HA H 1 3.826 0.030 . 1 . . . . 77 ARG HA . 11099 1 865 . 1 1 77 77 ARG HB2 H 1 1.971 0.030 . 1 . . . . 77 ARG HB2 . 11099 1 866 . 1 1 77 77 ARG HB3 H 1 1.971 0.030 . 1 . . . . 77 ARG HB3 . 11099 1 867 . 1 1 77 77 ARG HD2 H 1 3.275 0.030 . 2 . . . . 77 ARG HD2 . 11099 1 868 . 1 1 77 77 ARG HD3 H 1 3.184 0.030 . 2 . . . . 77 ARG HD3 . 11099 1 869 . 1 1 77 77 ARG HG2 H 1 1.538 0.030 . 1 . . . . 77 ARG HG2 . 11099 1 870 . 1 1 77 77 ARG HG3 H 1 1.538 0.030 . 1 . . . . 77 ARG HG3 . 11099 1 871 . 1 1 77 77 ARG C C 13 176.044 0.300 . 1 . . . . 77 ARG C . 11099 1 872 . 1 1 77 77 ARG CA C 13 56.823 0.300 . 1 . . . . 77 ARG CA . 11099 1 873 . 1 1 77 77 ARG CB C 13 26.518 0.300 . 1 . . . . 77 ARG CB . 11099 1 874 . 1 1 77 77 ARG CD C 13 43.388 0.300 . 1 . . . . 77 ARG CD . 11099 1 875 . 1 1 77 77 ARG CG C 13 28.019 0.300 . 1 . . . . 77 ARG CG . 11099 1 876 . 1 1 77 77 ARG N N 15 112.931 0.300 . 1 . . . . 77 ARG N . 11099 1 877 . 1 1 78 78 LEU H H 1 7.767 0.030 . 1 . . . . 78 LEU H . 11099 1 878 . 1 1 78 78 LEU HA H 1 4.460 0.030 . 1 . . . . 78 LEU HA . 11099 1 879 . 1 1 78 78 LEU HB2 H 1 0.793 0.030 . 2 . . . . 78 LEU HB2 . 11099 1 880 . 1 1 78 78 LEU HB3 H 1 1.306 0.030 . 2 . . . . 78 LEU HB3 . 11099 1 881 . 1 1 78 78 LEU HD11 H 1 -0.293 0.030 . 1 . . . . 78 LEU HD1 . 11099 1 882 . 1 1 78 78 LEU HD12 H 1 -0.293 0.030 . 1 . . . . 78 LEU HD1 . 11099 1 883 . 1 1 78 78 LEU HD13 H 1 -0.293 0.030 . 1 . . . . 78 LEU HD1 . 11099 1 884 . 1 1 78 78 LEU HD21 H 1 0.275 0.030 . 1 . . . . 78 LEU HD2 . 11099 1 885 . 1 1 78 78 LEU HD22 H 1 0.275 0.030 . 1 . . . . 78 LEU HD2 . 11099 1 886 . 1 1 78 78 LEU HD23 H 1 0.275 0.030 . 1 . . . . 78 LEU HD2 . 11099 1 887 . 1 1 78 78 LEU HG H 1 0.936 0.030 . 1 . . . . 78 LEU HG . 11099 1 888 . 1 1 78 78 LEU C C 13 177.416 0.300 . 1 . . . . 78 LEU C . 11099 1 889 . 1 1 78 78 LEU CA C 13 52.981 0.300 . 1 . . . . 78 LEU CA . 11099 1 890 . 1 1 78 78 LEU CB C 13 41.969 0.300 . 1 . . . . 78 LEU CB . 11099 1 891 . 1 1 78 78 LEU CD1 C 13 25.000 0.300 . 2 . . . . 78 LEU CD1 . 11099 1 892 . 1 1 78 78 LEU CD2 C 13 19.748 0.300 . 2 . . . . 78 LEU CD2 . 11099 1 893 . 1 1 78 78 LEU CG C 13 25.619 0.300 . 1 . . . . 78 LEU CG . 11099 1 894 . 1 1 78 78 LEU N N 15 116.588 0.300 . 1 . . . . 78 LEU N . 11099 1 895 . 1 1 79 79 GLU H H 1 8.251 0.030 . 1 . . . . 79 GLU H . 11099 1 896 . 1 1 79 79 GLU HA H 1 4.452 0.030 . 1 . . . . 79 GLU HA . 11099 1 897 . 1 1 79 79 GLU HB2 H 1 2.141 0.030 . 2 . . . . 79 GLU HB2 . 11099 1 898 . 1 1 79 79 GLU HB3 H 1 1.974 0.030 . 2 . . . . 79 GLU HB3 . 11099 1 899 . 1 1 79 79 GLU HG2 H 1 2.454 0.030 . 2 . . . . 79 GLU HG2 . 11099 1 900 . 1 1 79 79 GLU HG3 H 1 2.333 0.030 . 2 . . . . 79 GLU HG3 . 11099 1 901 . 1 1 79 79 GLU C C 13 177.085 0.300 . 1 . . . . 79 GLU C . 11099 1 902 . 1 1 79 79 GLU CA C 13 55.161 0.300 . 1 . . . . 79 GLU CA . 11099 1 903 . 1 1 79 79 GLU CB C 13 31.112 0.300 . 1 . . . . 79 GLU CB . 11099 1 904 . 1 1 79 79 GLU CG C 13 36.029 0.300 . 1 . . . . 79 GLU CG . 11099 1 905 . 1 1 79 79 GLU N N 15 120.249 0.300 . 1 . . . . 79 GLU N . 11099 1 906 . 1 1 80 80 SER H H 1 8.542 0.030 . 1 . . . . 80 SER H . 11099 1 907 . 1 1 80 80 SER HA H 1 4.937 0.030 . 1 . . . . 80 SER HA . 11099 1 908 . 1 1 80 80 SER HB2 H 1 4.288 0.030 . 2 . . . . 80 SER HB2 . 11099 1 909 . 1 1 80 80 SER HB3 H 1 3.933 0.030 . 2 . . . . 80 SER HB3 . 11099 1 910 . 1 1 80 80 SER C C 13 175.341 0.300 . 1 . . . . 80 SER C . 11099 1 911 . 1 1 80 80 SER CA C 13 58.829 0.300 . 1 . . . . 80 SER CA . 11099 1 912 . 1 1 80 80 SER CB C 13 64.621 0.300 . 1 . . . . 80 SER CB . 11099 1 913 . 1 1 80 80 SER N N 15 118.192 0.300 . 1 . . . . 80 SER N . 11099 1 914 . 1 1 81 81 SER H H 1 7.605 0.030 . 1 . . . . 81 SER H . 11099 1 915 . 1 1 81 81 SER HA H 1 3.951 0.030 . 1 . . . . 81 SER HA . 11099 1 916 . 1 1 81 81 SER HB2 H 1 4.045 0.030 . 2 . . . . 81 SER HB2 . 11099 1 917 . 1 1 81 81 SER HB3 H 1 3.759 0.030 . 2 . . . . 81 SER HB3 . 11099 1 918 . 1 1 81 81 SER C C 13 174.143 0.300 . 1 . . . . 81 SER C . 11099 1 919 . 1 1 81 81 SER CA C 13 58.707 0.300 . 1 . . . . 81 SER CA . 11099 1 920 . 1 1 81 81 SER CB C 13 62.387 0.300 . 1 . . . . 81 SER CB . 11099 1 921 . 1 1 81 81 SER N N 15 117.951 0.300 . 1 . . . . 81 SER N . 11099 1 922 . 1 1 82 82 SER H H 1 8.441 0.030 . 1 . . . . 82 SER H . 11099 1 923 . 1 1 82 82 SER HA H 1 4.843 0.030 . 1 . . . . 82 SER HA . 11099 1 924 . 1 1 82 82 SER HB2 H 1 3.624 0.030 . 2 . . . . 82 SER HB2 . 11099 1 925 . 1 1 82 82 SER HB3 H 1 3.324 0.030 . 2 . . . . 82 SER HB3 . 11099 1 926 . 1 1 82 82 SER C C 13 170.861 0.300 . 1 . . . . 82 SER C . 11099 1 927 . 1 1 82 82 SER CA C 13 58.072 0.300 . 1 . . . . 82 SER CA . 11099 1 928 . 1 1 82 82 SER CB C 13 66.834 0.300 . 1 . . . . 82 SER CB . 11099 1 929 . 1 1 82 82 SER N N 15 114.139 0.300 . 1 . . . . 82 SER N . 11099 1 930 . 1 1 83 83 HIS H H 1 8.616 0.030 . 1 . . . . 83 HIS H . 11099 1 931 . 1 1 83 83 HIS HA H 1 4.994 0.030 . 1 . . . . 83 HIS HA . 11099 1 932 . 1 1 83 83 HIS HB2 H 1 3.107 0.030 . 2 . . . . 83 HIS HB2 . 11099 1 933 . 1 1 83 83 HIS HB3 H 1 2.899 0.030 . 2 . . . . 83 HIS HB3 . 11099 1 934 . 1 1 83 83 HIS HD2 H 1 6.872 0.030 . 1 . . . . 83 HIS HD2 . 11099 1 935 . 1 1 83 83 HIS HE1 H 1 7.737 0.030 . 1 . . . . 83 HIS HE1 . 11099 1 936 . 1 1 83 83 HIS C C 13 173.957 0.300 . 1 . . . . 83 HIS C . 11099 1 937 . 1 1 83 83 HIS CA C 13 55.593 0.300 . 1 . . . . 83 HIS CA . 11099 1 938 . 1 1 83 83 HIS CB C 13 30.421 0.300 . 1 . . . . 83 HIS CB . 11099 1 939 . 1 1 83 83 HIS CD2 C 13 120.662 0.300 . 1 . . . . 83 HIS CD2 . 11099 1 940 . 1 1 83 83 HIS CE1 C 13 137.664 0.300 . 1 . . . . 83 HIS CE1 . 11099 1 941 . 1 1 83 83 HIS N N 15 124.277 0.300 . 1 . . . . 83 HIS N . 11099 1 942 . 1 1 84 84 TYR H H 1 9.007 0.030 . 1 . . . . 84 TYR H . 11099 1 943 . 1 1 84 84 TYR HA H 1 4.839 0.030 . 1 . . . . 84 TYR HA . 11099 1 944 . 1 1 84 84 TYR HB2 H 1 2.708 0.030 . 2 . . . . 84 TYR HB2 . 11099 1 945 . 1 1 84 84 TYR HB3 H 1 2.572 0.030 . 2 . . . . 84 TYR HB3 . 11099 1 946 . 1 1 84 84 TYR HD1 H 1 6.940 0.030 . 1 . . . . 84 TYR HD1 . 11099 1 947 . 1 1 84 84 TYR HD2 H 1 6.940 0.030 . 1 . . . . 84 TYR HD2 . 11099 1 948 . 1 1 84 84 TYR HE1 H 1 6.880 0.030 . 1 . . . . 84 TYR HE1 . 11099 1 949 . 1 1 84 84 TYR HE2 H 1 6.880 0.030 . 1 . . . . 84 TYR HE2 . 11099 1 950 . 1 1 84 84 TYR C C 13 174.925 0.300 . 1 . . . . 84 TYR C . 11099 1 951 . 1 1 84 84 TYR CA C 13 58.276 0.300 . 1 . . . . 84 TYR CA . 11099 1 952 . 1 1 84 84 TYR CB C 13 41.755 0.300 . 1 . . . . 84 TYR CB . 11099 1 953 . 1 1 84 84 TYR CD1 C 13 132.543 0.300 . 1 . . . . 84 TYR CD1 . 11099 1 954 . 1 1 84 84 TYR CD2 C 13 132.543 0.300 . 1 . . . . 84 TYR CD2 . 11099 1 955 . 1 1 84 84 TYR CE1 C 13 119.074 0.300 . 1 . . . . 84 TYR CE1 . 11099 1 956 . 1 1 84 84 TYR CE2 C 13 119.074 0.300 . 1 . . . . 84 TYR CE2 . 11099 1 957 . 1 1 84 84 TYR N N 15 125.760 0.300 . 1 . . . . 84 TYR N . 11099 1 958 . 1 1 85 85 VAL H H 1 8.646 0.030 . 1 . . . . 85 VAL H . 11099 1 959 . 1 1 85 85 VAL HA H 1 4.479 0.030 . 1 . . . . 85 VAL HA . 11099 1 960 . 1 1 85 85 VAL HB H 1 1.410 0.030 . 1 . . . . 85 VAL HB . 11099 1 961 . 1 1 85 85 VAL HG11 H 1 0.844 0.030 . 1 . . . . 85 VAL HG1 . 11099 1 962 . 1 1 85 85 VAL HG12 H 1 0.844 0.030 . 1 . . . . 85 VAL HG1 . 11099 1 963 . 1 1 85 85 VAL HG13 H 1 0.844 0.030 . 1 . . . . 85 VAL HG1 . 11099 1 964 . 1 1 85 85 VAL HG21 H 1 0.648 0.030 . 1 . . . . 85 VAL HG2 . 11099 1 965 . 1 1 85 85 VAL HG22 H 1 0.648 0.030 . 1 . . . . 85 VAL HG2 . 11099 1 966 . 1 1 85 85 VAL HG23 H 1 0.648 0.030 . 1 . . . . 85 VAL HG2 . 11099 1 967 . 1 1 85 85 VAL C C 13 174.177 0.300 . 1 . . . . 85 VAL C . 11099 1 968 . 1 1 85 85 VAL CA C 13 61.370 0.300 . 1 . . . . 85 VAL CA . 11099 1 969 . 1 1 85 85 VAL CB C 13 33.762 0.300 . 1 . . . . 85 VAL CB . 11099 1 970 . 1 1 85 85 VAL CG1 C 13 21.595 0.300 . 2 . . . . 85 VAL CG1 . 11099 1 971 . 1 1 85 85 VAL CG2 C 13 20.521 0.300 . 2 . . . . 85 VAL CG2 . 11099 1 972 . 1 1 85 85 VAL N N 15 119.471 0.300 . 1 . . . . 85 VAL N . 11099 1 973 . 1 1 86 86 ILE H H 1 8.793 0.030 . 1 . . . . 86 ILE H . 11099 1 974 . 1 1 86 86 ILE HA H 1 5.190 0.030 . 1 . . . . 86 ILE HA . 11099 1 975 . 1 1 86 86 ILE HB H 1 1.461 0.030 . 1 . . . . 86 ILE HB . 11099 1 976 . 1 1 86 86 ILE HD11 H 1 0.713 0.030 . 1 . . . . 86 ILE HD1 . 11099 1 977 . 1 1 86 86 ILE HD12 H 1 0.713 0.030 . 1 . . . . 86 ILE HD1 . 11099 1 978 . 1 1 86 86 ILE HD13 H 1 0.713 0.030 . 1 . . . . 86 ILE HD1 . 11099 1 979 . 1 1 86 86 ILE HG12 H 1 1.380 0.030 . 2 . . . . 86 ILE HG12 . 11099 1 980 . 1 1 86 86 ILE HG13 H 1 1.052 0.030 . 2 . . . . 86 ILE HG13 . 11099 1 981 . 1 1 86 86 ILE HG21 H 1 0.882 0.030 . 1 . . . . 86 ILE HG2 . 11099 1 982 . 1 1 86 86 ILE HG22 H 1 0.882 0.030 . 1 . . . . 86 ILE HG2 . 11099 1 983 . 1 1 86 86 ILE HG23 H 1 0.882 0.030 . 1 . . . . 86 ILE HG2 . 11099 1 984 . 1 1 86 86 ILE C C 13 174.413 0.300 . 1 . . . . 86 ILE C . 11099 1 985 . 1 1 86 86 ILE CA C 13 59.297 0.300 . 1 . . . . 86 ILE CA . 11099 1 986 . 1 1 86 86 ILE CB C 13 42.685 0.300 . 1 . . . . 86 ILE CB . 11099 1 987 . 1 1 86 86 ILE CD1 C 13 15.381 0.300 . 1 . . . . 86 ILE CD1 . 11099 1 988 . 1 1 86 86 ILE CG1 C 13 28.740 0.300 . 1 . . . . 86 ILE CG1 . 11099 1 989 . 1 1 86 86 ILE CG2 C 13 18.684 0.300 . 1 . . . . 86 ILE CG2 . 11099 1 990 . 1 1 86 86 ILE N N 15 125.456 0.300 . 1 . . . . 86 ILE N . 11099 1 991 . 1 1 87 87 SER H H 1 9.749 0.030 . 1 . . . . 87 SER H . 11099 1 992 . 1 1 87 87 SER HA H 1 5.278 0.030 . 1 . . . . 87 SER HA . 11099 1 993 . 1 1 87 87 SER HB2 H 1 3.438 0.030 . 2 . . . . 87 SER HB2 . 11099 1 994 . 1 1 87 87 SER HB3 H 1 3.381 0.030 . 2 . . . . 87 SER HB3 . 11099 1 995 . 1 1 87 87 SER C C 13 172.712 0.300 . 1 . . . . 87 SER C . 11099 1 996 . 1 1 87 87 SER CA C 13 55.176 0.300 . 1 . . . . 87 SER CA . 11099 1 997 . 1 1 87 87 SER CB C 13 67.489 0.300 . 1 . . . . 87 SER CB . 11099 1 998 . 1 1 87 87 SER N N 15 119.641 0.300 . 1 . . . . 87 SER N . 11099 1 999 . 1 1 88 88 LEU H H 1 8.416 0.030 . 1 . . . . 88 LEU H . 11099 1 1000 . 1 1 88 88 LEU HA H 1 5.024 0.030 . 1 . . . . 88 LEU HA . 11099 1 1001 . 1 1 88 88 LEU HB2 H 1 1.429 0.030 . 2 . . . . 88 LEU HB2 . 11099 1 1002 . 1 1 88 88 LEU HB3 H 1 0.798 0.030 . 2 . . . . 88 LEU HB3 . 11099 1 1003 . 1 1 88 88 LEU HD11 H 1 -0.293 0.030 . 1 . . . . 88 LEU HD1 . 11099 1 1004 . 1 1 88 88 LEU HD12 H 1 -0.293 0.030 . 1 . . . . 88 LEU HD1 . 11099 1 1005 . 1 1 88 88 LEU HD13 H 1 -0.293 0.030 . 1 . . . . 88 LEU HD1 . 11099 1 1006 . 1 1 88 88 LEU HD21 H 1 0.058 0.030 . 1 . . . . 88 LEU HD2 . 11099 1 1007 . 1 1 88 88 LEU HD22 H 1 0.058 0.030 . 1 . . . . 88 LEU HD2 . 11099 1 1008 . 1 1 88 88 LEU HD23 H 1 0.058 0.030 . 1 . . . . 88 LEU HD2 . 11099 1 1009 . 1 1 88 88 LEU HG H 1 0.786 0.030 . 1 . . . . 88 LEU HG . 11099 1 1010 . 1 1 88 88 LEU C C 13 174.318 0.300 . 1 . . . . 88 LEU C . 11099 1 1011 . 1 1 88 88 LEU CA C 13 53.557 0.300 . 1 . . . . 88 LEU CA . 11099 1 1012 . 1 1 88 88 LEU CB C 13 46.907 0.300 . 1 . . . . 88 LEU CB . 11099 1 1013 . 1 1 88 88 LEU CD1 C 13 22.809 0.300 . 2 . . . . 88 LEU CD1 . 11099 1 1014 . 1 1 88 88 LEU CD2 C 13 27.429 0.300 . 2 . . . . 88 LEU CD2 . 11099 1 1015 . 1 1 88 88 LEU CG C 13 27.566 0.300 . 1 . . . . 88 LEU CG . 11099 1 1016 . 1 1 88 88 LEU N N 15 122.662 0.300 . 1 . . . . 88 LEU N . 11099 1 1017 . 1 1 89 89 LYS H H 1 8.429 0.030 . 1 . . . . 89 LYS H . 11099 1 1018 . 1 1 89 89 LYS HA H 1 4.645 0.030 . 1 . . . . 89 LYS HA . 11099 1 1019 . 1 1 89 89 LYS HB2 H 1 1.527 0.030 . 2 . . . . 89 LYS HB2 . 11099 1 1020 . 1 1 89 89 LYS HB3 H 1 1.459 0.030 . 2 . . . . 89 LYS HB3 . 11099 1 1021 . 1 1 89 89 LYS HD2 H 1 1.640 0.030 . 1 . . . . 89 LYS HD2 . 11099 1 1022 . 1 1 89 89 LYS HD3 H 1 1.640 0.030 . 1 . . . . 89 LYS HD3 . 11099 1 1023 . 1 1 89 89 LYS HE2 H 1 2.792 0.030 . 1 . . . . 89 LYS HE2 . 11099 1 1024 . 1 1 89 89 LYS HE3 H 1 2.792 0.030 . 1 . . . . 89 LYS HE3 . 11099 1 1025 . 1 1 89 89 LYS HG2 H 1 1.178 0.030 . 2 . . . . 89 LYS HG2 . 11099 1 1026 . 1 1 89 89 LYS HG3 H 1 1.285 0.030 . 2 . . . . 89 LYS HG3 . 11099 1 1027 . 1 1 89 89 LYS C C 13 174.419 0.300 . 1 . . . . 89 LYS C . 11099 1 1028 . 1 1 89 89 LYS CA C 13 53.885 0.300 . 1 . . . . 89 LYS CA . 11099 1 1029 . 1 1 89 89 LYS CB C 13 36.564 0.300 . 1 . . . . 89 LYS CB . 11099 1 1030 . 1 1 89 89 LYS CD C 13 30.319 0.300 . 1 . . . . 89 LYS CD . 11099 1 1031 . 1 1 89 89 LYS CE C 13 42.126 0.300 . 1 . . . . 89 LYS CE . 11099 1 1032 . 1 1 89 89 LYS CG C 13 24.149 0.300 . 1 . . . . 89 LYS CG . 11099 1 1033 . 1 1 89 89 LYS N N 15 122.099 0.300 . 1 . . . . 89 LYS N . 11099 1 1034 . 1 1 90 90 ALA H H 1 9.618 0.030 . 1 . . . . 90 ALA H . 11099 1 1035 . 1 1 90 90 ALA HA H 1 4.850 0.030 . 1 . . . . 90 ALA HA . 11099 1 1036 . 1 1 90 90 ALA HB1 H 1 1.199 0.030 . 1 . . . . 90 ALA HB . 11099 1 1037 . 1 1 90 90 ALA HB2 H 1 1.199 0.030 . 1 . . . . 90 ALA HB . 11099 1 1038 . 1 1 90 90 ALA HB3 H 1 1.199 0.030 . 1 . . . . 90 ALA HB . 11099 1 1039 . 1 1 90 90 ALA C C 13 175.916 0.300 . 1 . . . . 90 ALA C . 11099 1 1040 . 1 1 90 90 ALA CA C 13 50.119 0.300 . 1 . . . . 90 ALA CA . 11099 1 1041 . 1 1 90 90 ALA CB C 13 21.400 0.300 . 1 . . . . 90 ALA CB . 11099 1 1042 . 1 1 90 90 ALA N N 15 124.661 0.300 . 1 . . . . 90 ALA N . 11099 1 1043 . 1 1 91 91 PHE H H 1 7.935 0.030 . 1 . . . . 91 PHE H . 11099 1 1044 . 1 1 91 91 PHE HA H 1 5.325 0.030 . 1 . . . . 91 PHE HA . 11099 1 1045 . 1 1 91 91 PHE HB2 H 1 3.172 0.030 . 2 . . . . 91 PHE HB2 . 11099 1 1046 . 1 1 91 91 PHE HB3 H 1 2.601 0.030 . 2 . . . . 91 PHE HB3 . 11099 1 1047 . 1 1 91 91 PHE HD1 H 1 6.706 0.030 . 1 . . . . 91 PHE HD1 . 11099 1 1048 . 1 1 91 91 PHE HD2 H 1 6.706 0.030 . 1 . . . . 91 PHE HD2 . 11099 1 1049 . 1 1 91 91 PHE HE1 H 1 7.111 0.030 . 1 . . . . 91 PHE HE1 . 11099 1 1050 . 1 1 91 91 PHE HE2 H 1 7.111 0.030 . 1 . . . . 91 PHE HE2 . 11099 1 1051 . 1 1 91 91 PHE HZ H 1 7.180 0.030 . 1 . . . . 91 PHE HZ . 11099 1 1052 . 1 1 91 91 PHE C C 13 173.195 0.300 . 1 . . . . 91 PHE C . 11099 1 1053 . 1 1 91 91 PHE CA C 13 55.960 0.300 . 1 . . . . 91 PHE CA . 11099 1 1054 . 1 1 91 91 PHE CB C 13 43.530 0.300 . 1 . . . . 91 PHE CB . 11099 1 1055 . 1 1 91 91 PHE CD1 C 13 132.484 0.300 . 1 . . . . 91 PHE CD1 . 11099 1 1056 . 1 1 91 91 PHE CD2 C 13 132.484 0.300 . 1 . . . . 91 PHE CD2 . 11099 1 1057 . 1 1 91 91 PHE CE1 C 13 130.726 0.300 . 1 . . . . 91 PHE CE1 . 11099 1 1058 . 1 1 91 91 PHE CE2 C 13 130.726 0.300 . 1 . . . . 91 PHE CE2 . 11099 1 1059 . 1 1 91 91 PHE CZ C 13 129.669 0.300 . 1 . . . . 91 PHE CZ . 11099 1 1060 . 1 1 91 91 PHE N N 15 113.753 0.300 . 1 . . . . 91 PHE N . 11099 1 1061 . 1 1 92 92 ASN H H 1 9.193 0.030 . 1 . . . . 92 ASN H . 11099 1 1062 . 1 1 92 92 ASN HA H 1 4.157 0.030 . 1 . . . . 92 ASN HA . 11099 1 1063 . 1 1 92 92 ASN HB2 H 1 3.764 0.030 . 2 . . . . 92 ASN HB2 . 11099 1 1064 . 1 1 92 92 ASN HB3 H 1 3.296 0.030 . 2 . . . . 92 ASN HB3 . 11099 1 1065 . 1 1 92 92 ASN HD21 H 1 8.059 0.030 . 2 . . . . 92 ASN HD21 . 11099 1 1066 . 1 1 92 92 ASN HD22 H 1 8.304 0.030 . 2 . . . . 92 ASN HD22 . 11099 1 1067 . 1 1 92 92 ASN C C 13 175.829 0.300 . 1 . . . . 92 ASN C . 11099 1 1068 . 1 1 92 92 ASN CA C 13 52.512 0.300 . 1 . . . . 92 ASN CA . 11099 1 1069 . 1 1 92 92 ASN CB C 13 38.625 0.300 . 1 . . . . 92 ASN CB . 11099 1 1070 . 1 1 92 92 ASN N N 15 120.779 0.300 . 1 . . . . 92 ASN N . 11099 1 1071 . 1 1 92 92 ASN ND2 N 15 109.998 0.300 . 1 . . . . 92 ASN ND2 . 11099 1 1072 . 1 1 93 93 ASN H H 1 10.318 0.030 . 1 . . . . 93 ASN H . 11099 1 1073 . 1 1 93 93 ASN HA H 1 4.491 0.030 . 1 . . . . 93 ASN HA . 11099 1 1074 . 1 1 93 93 ASN HB2 H 1 2.880 0.030 . 2 . . . . 93 ASN HB2 . 11099 1 1075 . 1 1 93 93 ASN HB3 H 1 2.563 0.030 . 2 . . . . 93 ASN HB3 . 11099 1 1076 . 1 1 93 93 ASN HD21 H 1 6.794 0.030 . 2 . . . . 93 ASN HD21 . 11099 1 1077 . 1 1 93 93 ASN HD22 H 1 7.469 0.030 . 2 . . . . 93 ASN HD22 . 11099 1 1078 . 1 1 93 93 ASN C C 13 176.848 0.300 . 1 . . . . 93 ASN C . 11099 1 1079 . 1 1 93 93 ASN CA C 13 55.518 0.300 . 1 . . . . 93 ASN CA . 11099 1 1080 . 1 1 93 93 ASN CB C 13 37.320 0.300 . 1 . . . . 93 ASN CB . 11099 1 1081 . 1 1 93 93 ASN N N 15 117.566 0.300 . 1 . . . . 93 ASN N . 11099 1 1082 . 1 1 93 93 ASN ND2 N 15 110.275 0.300 . 1 . . . . 93 ASN ND2 . 11099 1 1083 . 1 1 94 94 ALA H H 1 8.351 0.030 . 1 . . . . 94 ALA H . 11099 1 1084 . 1 1 94 94 ALA HA H 1 4.246 0.030 . 1 . . . . 94 ALA HA . 11099 1 1085 . 1 1 94 94 ALA HB1 H 1 1.146 0.030 . 1 . . . . 94 ALA HB . 11099 1 1086 . 1 1 94 94 ALA HB2 H 1 1.146 0.030 . 1 . . . . 94 ALA HB . 11099 1 1087 . 1 1 94 94 ALA HB3 H 1 1.146 0.030 . 1 . . . . 94 ALA HB . 11099 1 1088 . 1 1 94 94 ALA C C 13 177.667 0.300 . 1 . . . . 94 ALA C . 11099 1 1089 . 1 1 94 94 ALA CA C 13 53.327 0.300 . 1 . . . . 94 ALA CA . 11099 1 1090 . 1 1 94 94 ALA CB C 13 17.261 0.300 . 1 . . . . 94 ALA CB . 11099 1 1091 . 1 1 94 94 ALA N N 15 121.438 0.300 . 1 . . . . 94 ALA N . 11099 1 1092 . 1 1 95 95 GLY H H 1 7.744 0.030 . 1 . . . . 95 GLY H . 11099 1 1093 . 1 1 95 95 GLY HA2 H 1 3.817 0.030 . 2 . . . . 95 GLY HA2 . 11099 1 1094 . 1 1 95 95 GLY HA3 H 1 4.467 0.030 . 2 . . . . 95 GLY HA3 . 11099 1 1095 . 1 1 95 95 GLY C C 13 171.718 0.300 . 1 . . . . 95 GLY C . 11099 1 1096 . 1 1 95 95 GLY CA C 13 44.185 0.300 . 1 . . . . 95 GLY CA . 11099 1 1097 . 1 1 95 95 GLY N N 15 105.981 0.300 . 1 . . . . 95 GLY N . 11099 1 1098 . 1 1 96 96 GLU H H 1 8.366 0.030 . 1 . . . . 96 GLU H . 11099 1 1099 . 1 1 96 96 GLU HA H 1 4.488 0.030 . 1 . . . . 96 GLU HA . 11099 1 1100 . 1 1 96 96 GLU HB2 H 1 1.943 0.030 . 2 . . . . 96 GLU HB2 . 11099 1 1101 . 1 1 96 96 GLU HB3 H 1 1.895 0.030 . 2 . . . . 96 GLU HB3 . 11099 1 1102 . 1 1 96 96 GLU HG2 H 1 2.285 0.030 . 2 . . . . 96 GLU HG2 . 11099 1 1103 . 1 1 96 96 GLU HG3 H 1 2.011 0.030 . 2 . . . . 96 GLU HG3 . 11099 1 1104 . 1 1 96 96 GLU C C 13 176.469 0.300 . 1 . . . . 96 GLU C . 11099 1 1105 . 1 1 96 96 GLU CA C 13 55.396 0.300 . 1 . . . . 96 GLU CA . 11099 1 1106 . 1 1 96 96 GLU CB C 13 31.500 0.300 . 1 . . . . 96 GLU CB . 11099 1 1107 . 1 1 96 96 GLU CG C 13 36.076 0.300 . 1 . . . . 96 GLU CG . 11099 1 1108 . 1 1 96 96 GLU N N 15 117.837 0.300 . 1 . . . . 96 GLU N . 11099 1 1109 . 1 1 97 97 GLY H H 1 8.745 0.030 . 1 . . . . 97 GLY H . 11099 1 1110 . 1 1 97 97 GLY HA2 H 1 4.213 0.030 . 2 . . . . 97 GLY HA2 . 11099 1 1111 . 1 1 97 97 GLY HA3 H 1 3.975 0.030 . 2 . . . . 97 GLY HA3 . 11099 1 1112 . 1 1 97 97 GLY C C 13 173.315 0.300 . 1 . . . . 97 GLY C . 11099 1 1113 . 1 1 97 97 GLY CA C 13 44.490 0.300 . 1 . . . . 97 GLY CA . 11099 1 1114 . 1 1 97 97 GLY N N 15 108.910 0.300 . 1 . . . . 97 GLY N . 11099 1 1115 . 1 1 98 98 VAL H H 1 7.945 0.030 . 1 . . . . 98 VAL H . 11099 1 1116 . 1 1 98 98 VAL HA H 1 4.181 0.030 . 1 . . . . 98 VAL HA . 11099 1 1117 . 1 1 98 98 VAL HB H 1 1.942 0.030 . 1 . . . . 98 VAL HB . 11099 1 1118 . 1 1 98 98 VAL HG11 H 1 1.109 0.030 . 1 . . . . 98 VAL HG1 . 11099 1 1119 . 1 1 98 98 VAL HG12 H 1 1.109 0.030 . 1 . . . . 98 VAL HG1 . 11099 1 1120 . 1 1 98 98 VAL HG13 H 1 1.109 0.030 . 1 . . . . 98 VAL HG1 . 11099 1 1121 . 1 1 98 98 VAL HG21 H 1 1.099 0.030 . 1 . . . . 98 VAL HG2 . 11099 1 1122 . 1 1 98 98 VAL HG22 H 1 1.099 0.030 . 1 . . . . 98 VAL HG2 . 11099 1 1123 . 1 1 98 98 VAL HG23 H 1 1.099 0.030 . 1 . . . . 98 VAL HG2 . 11099 1 1124 . 1 1 98 98 VAL C C 13 175.759 0.300 . 1 . . . . 98 VAL C . 11099 1 1125 . 1 1 98 98 VAL CA C 13 60.332 0.300 . 1 . . . . 98 VAL CA . 11099 1 1126 . 1 1 98 98 VAL CB C 13 32.977 0.300 . 1 . . . . 98 VAL CB . 11099 1 1127 . 1 1 98 98 VAL CG1 C 13 21.302 0.300 . 2 . . . . 98 VAL CG1 . 11099 1 1128 . 1 1 98 98 VAL CG2 C 13 21.354 0.300 . 2 . . . . 98 VAL CG2 . 11099 1 1129 . 1 1 98 98 VAL N N 15 118.393 0.300 . 1 . . . . 98 VAL N . 11099 1 1130 . 1 1 99 99 PRO HA H 1 4.984 0.030 . 1 . . . . 99 PRO HA . 11099 1 1131 . 1 1 99 99 PRO HB2 H 1 1.591 0.030 . 2 . . . . 99 PRO HB2 . 11099 1 1132 . 1 1 99 99 PRO HB3 H 1 1.067 0.030 . 2 . . . . 99 PRO HB3 . 11099 1 1133 . 1 1 99 99 PRO HD2 H 1 3.782 0.030 . 1 . . . . 99 PRO HD2 . 11099 1 1134 . 1 1 99 99 PRO HD3 H 1 3.782 0.030 . 1 . . . . 99 PRO HD3 . 11099 1 1135 . 1 1 99 99 PRO HG2 H 1 1.964 0.030 . 2 . . . . 99 PRO HG2 . 11099 1 1136 . 1 1 99 99 PRO HG3 H 1 1.899 0.030 . 2 . . . . 99 PRO HG3 . 11099 1 1137 . 1 1 99 99 PRO C C 13 178.029 0.300 . 1 . . . . 99 PRO C . 11099 1 1138 . 1 1 99 99 PRO CA C 13 62.084 0.300 . 1 . . . . 99 PRO CA . 11099 1 1139 . 1 1 99 99 PRO CB C 13 32.451 0.300 . 1 . . . . 99 PRO CB . 11099 1 1140 . 1 1 99 99 PRO CD C 13 50.795 0.300 . 1 . . . . 99 PRO CD . 11099 1 1141 . 1 1 99 99 PRO CG C 13 26.765 0.300 . 1 . . . . 99 PRO CG . 11099 1 1142 . 1 1 100 100 LEU H H 1 8.405 0.030 . 1 . . . . 100 LEU H . 11099 1 1143 . 1 1 100 100 LEU HA H 1 4.529 0.030 . 1 . . . . 100 LEU HA . 11099 1 1144 . 1 1 100 100 LEU HB2 H 1 1.545 0.030 . 2 . . . . 100 LEU HB2 . 11099 1 1145 . 1 1 100 100 LEU HB3 H 1 1.324 0.030 . 2 . . . . 100 LEU HB3 . 11099 1 1146 . 1 1 100 100 LEU HD11 H 1 0.872 0.030 . 1 . . . . 100 LEU HD1 . 11099 1 1147 . 1 1 100 100 LEU HD12 H 1 0.872 0.030 . 1 . . . . 100 LEU HD1 . 11099 1 1148 . 1 1 100 100 LEU HD13 H 1 0.872 0.030 . 1 . . . . 100 LEU HD1 . 11099 1 1149 . 1 1 100 100 LEU HD21 H 1 0.807 0.030 . 1 . . . . 100 LEU HD2 . 11099 1 1150 . 1 1 100 100 LEU HD22 H 1 0.807 0.030 . 1 . . . . 100 LEU HD2 . 11099 1 1151 . 1 1 100 100 LEU HD23 H 1 0.807 0.030 . 1 . . . . 100 LEU HD2 . 11099 1 1152 . 1 1 100 100 LEU HG H 1 1.506 0.030 . 1 . . . . 100 LEU HG . 11099 1 1153 . 1 1 100 100 LEU C C 13 174.988 0.300 . 1 . . . . 100 LEU C . 11099 1 1154 . 1 1 100 100 LEU CA C 13 54.056 0.300 . 1 . . . . 100 LEU CA . 11099 1 1155 . 1 1 100 100 LEU CB C 13 46.158 0.300 . 1 . . . . 100 LEU CB . 11099 1 1156 . 1 1 100 100 LEU CD1 C 13 23.985 0.300 . 2 . . . . 100 LEU CD1 . 11099 1 1157 . 1 1 100 100 LEU CD2 C 13 25.447 0.300 . 2 . . . . 100 LEU CD2 . 11099 1 1158 . 1 1 100 100 LEU CG C 13 27.329 0.300 . 1 . . . . 100 LEU CG . 11099 1 1159 . 1 1 100 100 LEU N N 15 119.076 0.300 . 1 . . . . 100 LEU N . 11099 1 1160 . 1 1 101 101 TYR H H 1 8.243 0.030 . 1 . . . . 101 TYR H . 11099 1 1161 . 1 1 101 101 TYR HA H 1 5.678 0.030 . 1 . . . . 101 TYR HA . 11099 1 1162 . 1 1 101 101 TYR HB2 H 1 2.911 0.030 . 2 . . . . 101 TYR HB2 . 11099 1 1163 . 1 1 101 101 TYR HB3 H 1 2.635 0.030 . 2 . . . . 101 TYR HB3 . 11099 1 1164 . 1 1 101 101 TYR HD1 H 1 6.982 0.030 . 1 . . . . 101 TYR HD1 . 11099 1 1165 . 1 1 101 101 TYR HD2 H 1 6.982 0.030 . 1 . . . . 101 TYR HD2 . 11099 1 1166 . 1 1 101 101 TYR HE1 H 1 6.620 0.030 . 1 . . . . 101 TYR HE1 . 11099 1 1167 . 1 1 101 101 TYR HE2 H 1 6.620 0.030 . 1 . . . . 101 TYR HE2 . 11099 1 1168 . 1 1 101 101 TYR C C 13 176.256 0.300 . 1 . . . . 101 TYR C . 11099 1 1169 . 1 1 101 101 TYR CA C 13 56.245 0.300 . 1 . . . . 101 TYR CA . 11099 1 1170 . 1 1 101 101 TYR CB C 13 41.780 0.300 . 1 . . . . 101 TYR CB . 11099 1 1171 . 1 1 101 101 TYR CD1 C 13 132.937 0.300 . 1 . . . . 101 TYR CD1 . 11099 1 1172 . 1 1 101 101 TYR CD2 C 13 132.937 0.300 . 1 . . . . 101 TYR CD2 . 11099 1 1173 . 1 1 101 101 TYR CE1 C 13 117.589 0.300 . 1 . . . . 101 TYR CE1 . 11099 1 1174 . 1 1 101 101 TYR CE2 C 13 117.589 0.300 . 1 . . . . 101 TYR CE2 . 11099 1 1175 . 1 1 101 101 TYR N N 15 118.105 0.300 . 1 . . . . 101 TYR N . 11099 1 1176 . 1 1 102 102 GLU H H 1 9.204 0.030 . 1 . . . . 102 GLU H . 11099 1 1177 . 1 1 102 102 GLU HA H 1 4.701 0.030 . 1 . . . . 102 GLU HA . 11099 1 1178 . 1 1 102 102 GLU HB2 H 1 1.877 0.030 . 2 . . . . 102 GLU HB2 . 11099 1 1179 . 1 1 102 102 GLU HB3 H 1 1.575 0.030 . 2 . . . . 102 GLU HB3 . 11099 1 1180 . 1 1 102 102 GLU HG2 H 1 2.500 0.030 . 2 . . . . 102 GLU HG2 . 11099 1 1181 . 1 1 102 102 GLU HG3 H 1 2.299 0.030 . 2 . . . . 102 GLU HG3 . 11099 1 1182 . 1 1 102 102 GLU C C 13 174.868 0.300 . 1 . . . . 102 GLU C . 11099 1 1183 . 1 1 102 102 GLU CA C 13 55.061 0.300 . 1 . . . . 102 GLU CA . 11099 1 1184 . 1 1 102 102 GLU CB C 13 36.340 0.300 . 1 . . . . 102 GLU CB . 11099 1 1185 . 1 1 102 102 GLU CG C 13 37.087 0.300 . 1 . . . . 102 GLU CG . 11099 1 1186 . 1 1 102 102 GLU N N 15 122.397 0.300 . 1 . . . . 102 GLU N . 11099 1 1187 . 1 1 103 103 SER H H 1 9.228 0.030 . 1 . . . . 103 SER H . 11099 1 1188 . 1 1 103 103 SER HA H 1 5.307 0.030 . 1 . . . . 103 SER HA . 11099 1 1189 . 1 1 103 103 SER HB2 H 1 3.876 0.030 . 2 . . . . 103 SER HB2 . 11099 1 1190 . 1 1 103 103 SER HB3 H 1 3.814 0.030 . 2 . . . . 103 SER HB3 . 11099 1 1191 . 1 1 103 103 SER C C 13 172.851 0.300 . 1 . . . . 103 SER C . 11099 1 1192 . 1 1 103 103 SER CA C 13 57.446 0.300 . 1 . . . . 103 SER CA . 11099 1 1193 . 1 1 103 103 SER CB C 13 65.904 0.300 . 1 . . . . 103 SER CB . 11099 1 1194 . 1 1 103 103 SER N N 15 116.397 0.300 . 1 . . . . 103 SER N . 11099 1 1195 . 1 1 104 104 ALA H H 1 8.928 0.030 . 1 . . . . 104 ALA H . 11099 1 1196 . 1 1 104 104 ALA HA H 1 4.654 0.030 . 1 . . . . 104 ALA HA . 11099 1 1197 . 1 1 104 104 ALA HB1 H 1 1.200 0.030 . 1 . . . . 104 ALA HB . 11099 1 1198 . 1 1 104 104 ALA HB2 H 1 1.200 0.030 . 1 . . . . 104 ALA HB . 11099 1 1199 . 1 1 104 104 ALA HB3 H 1 1.200 0.030 . 1 . . . . 104 ALA HB . 11099 1 1200 . 1 1 104 104 ALA C C 13 174.625 0.300 . 1 . . . . 104 ALA C . 11099 1 1201 . 1 1 104 104 ALA CA C 13 51.699 0.300 . 1 . . . . 104 ALA CA . 11099 1 1202 . 1 1 104 104 ALA CB C 13 22.702 0.300 . 1 . . . . 104 ALA CB . 11099 1 1203 . 1 1 104 104 ALA N N 15 122.706 0.300 . 1 . . . . 104 ALA N . 11099 1 1204 . 1 1 105 105 THR H H 1 8.603 0.030 . 1 . . . . 105 THR H . 11099 1 1205 . 1 1 105 105 THR HA H 1 5.588 0.030 . 1 . . . . 105 THR HA . 11099 1 1206 . 1 1 105 105 THR HB H 1 3.865 0.030 . 1 . . . . 105 THR HB . 11099 1 1207 . 1 1 105 105 THR HG21 H 1 1.136 0.030 . 1 . . . . 105 THR HG2 . 11099 1 1208 . 1 1 105 105 THR HG22 H 1 1.136 0.030 . 1 . . . . 105 THR HG2 . 11099 1 1209 . 1 1 105 105 THR HG23 H 1 1.136 0.030 . 1 . . . . 105 THR HG2 . 11099 1 1210 . 1 1 105 105 THR C C 13 175.693 0.300 . 1 . . . . 105 THR C . 11099 1 1211 . 1 1 105 105 THR CA C 13 60.357 0.300 . 1 . . . . 105 THR CA . 11099 1 1212 . 1 1 105 105 THR CB C 13 70.367 0.300 . 1 . . . . 105 THR CB . 11099 1 1213 . 1 1 105 105 THR CG2 C 13 21.051 0.300 . 1 . . . . 105 THR CG2 . 11099 1 1214 . 1 1 105 105 THR N N 15 119.116 0.300 . 1 . . . . 105 THR N . 11099 1 1215 . 1 1 106 106 THR H H 1 9.374 0.030 . 1 . . . . 106 THR H . 11099 1 1216 . 1 1 106 106 THR HA H 1 4.282 0.030 . 1 . . . . 106 THR HA . 11099 1 1217 . 1 1 106 106 THR HB H 1 4.874 0.030 . 1 . . . . 106 THR HB . 11099 1 1218 . 1 1 106 106 THR HG21 H 1 1.066 0.030 . 1 . . . . 106 THR HG2 . 11099 1 1219 . 1 1 106 106 THR HG22 H 1 1.066 0.030 . 1 . . . . 106 THR HG2 . 11099 1 1220 . 1 1 106 106 THR HG23 H 1 1.066 0.030 . 1 . . . . 106 THR HG2 . 11099 1 1221 . 1 1 106 106 THR C C 13 175.839 0.300 . 1 . . . . 106 THR C . 11099 1 1222 . 1 1 106 106 THR CA C 13 61.679 0.300 . 1 . . . . 106 THR CA . 11099 1 1223 . 1 1 106 106 THR CB C 13 69.384 0.300 . 1 . . . . 106 THR CB . 11099 1 1224 . 1 1 106 106 THR CG2 C 13 23.871 0.300 . 1 . . . . 106 THR CG2 . 11099 1 1225 . 1 1 106 106 THR N N 15 117.120 0.300 . 1 . . . . 106 THR N . 11099 1 1226 . 1 1 107 107 ARG H H 1 7.858 0.030 . 1 . . . . 107 ARG H . 11099 1 1227 . 1 1 107 107 ARG HA H 1 4.199 0.030 . 1 . . . . 107 ARG HA . 11099 1 1228 . 1 1 107 107 ARG HB2 H 1 2.056 0.030 . 2 . . . . 107 ARG HB2 . 11099 1 1229 . 1 1 107 107 ARG HB3 H 1 1.436 0.030 . 2 . . . . 107 ARG HB3 . 11099 1 1230 . 1 1 107 107 ARG HD2 H 1 3.207 0.030 . 1 . . . . 107 ARG HD2 . 11099 1 1231 . 1 1 107 107 ARG HD3 H 1 3.207 0.030 . 1 . . . . 107 ARG HD3 . 11099 1 1232 . 1 1 107 107 ARG HG2 H 1 1.605 0.030 . 1 . . . . 107 ARG HG2 . 11099 1 1233 . 1 1 107 107 ARG HG3 H 1 1.605 0.030 . 1 . . . . 107 ARG HG3 . 11099 1 1234 . 1 1 107 107 ARG C C 13 175.623 0.300 . 1 . . . . 107 ARG C . 11099 1 1235 . 1 1 107 107 ARG CA C 13 55.722 0.300 . 1 . . . . 107 ARG CA . 11099 1 1236 . 1 1 107 107 ARG CB C 13 31.378 0.300 . 1 . . . . 107 ARG CB . 11099 1 1237 . 1 1 107 107 ARG CD C 13 43.371 0.300 . 1 . . . . 107 ARG CD . 11099 1 1238 . 1 1 107 107 ARG CG C 13 27.871 0.300 . 1 . . . . 107 ARG CG . 11099 1 1239 . 1 1 107 107 ARG N N 15 119.345 0.300 . 1 . . . . 107 ARG N . 11099 1 1240 . 1 1 108 108 SER H H 1 8.252 0.030 . 1 . . . . 108 SER H . 11099 1 1241 . 1 1 108 108 SER HB2 H 1 3.873 0.030 . 2 . . . . 108 SER HB2 . 11099 1 1242 . 1 1 108 108 SER C C 13 175.363 0.300 . 1 . . . . 108 SER C . 11099 1 1243 . 1 1 108 108 SER CA C 13 56.822 0.300 . 1 . . . . 108 SER CA . 11099 1 1244 . 1 1 108 108 SER CB C 13 64.381 0.300 . 1 . . . . 108 SER CB . 11099 1 1245 . 1 1 108 108 SER N N 15 113.630 0.300 . 1 . . . . 108 SER N . 11099 1 1246 . 1 1 109 109 ILE H H 1 8.490 0.030 . 1 . . . . 109 ILE H . 11099 1 1247 . 1 1 109 109 ILE HA H 1 4.212 0.030 . 1 . . . . 109 ILE HA . 11099 1 1248 . 1 1 109 109 ILE HB H 1 1.888 0.030 . 1 . . . . 109 ILE HB . 11099 1 1249 . 1 1 109 109 ILE HD11 H 1 0.903 0.030 . 1 . . . . 109 ILE HD1 . 11099 1 1250 . 1 1 109 109 ILE HD12 H 1 0.903 0.030 . 1 . . . . 109 ILE HD1 . 11099 1 1251 . 1 1 109 109 ILE HD13 H 1 0.903 0.030 . 1 . . . . 109 ILE HD1 . 11099 1 1252 . 1 1 109 109 ILE HG12 H 1 1.502 0.030 . 2 . . . . 109 ILE HG12 . 11099 1 1253 . 1 1 109 109 ILE HG13 H 1 1.223 0.030 . 2 . . . . 109 ILE HG13 . 11099 1 1254 . 1 1 109 109 ILE HG21 H 1 0.946 0.030 . 1 . . . . 109 ILE HG2 . 11099 1 1255 . 1 1 109 109 ILE HG22 H 1 0.946 0.030 . 1 . . . . 109 ILE HG2 . 11099 1 1256 . 1 1 109 109 ILE HG23 H 1 0.946 0.030 . 1 . . . . 109 ILE HG2 . 11099 1 1257 . 1 1 109 109 ILE C C 13 176.637 0.300 . 1 . . . . 109 ILE C . 11099 1 1258 . 1 1 109 109 ILE CA C 13 61.972 0.300 . 1 . . . . 109 ILE CA . 11099 1 1259 . 1 1 109 109 ILE CB C 13 38.857 0.300 . 1 . . . . 109 ILE CB . 11099 1 1260 . 1 1 109 109 ILE CD1 C 13 13.460 0.300 . 1 . . . . 109 ILE CD1 . 11099 1 1261 . 1 1 109 109 ILE CG1 C 13 27.613 0.300 . 1 . . . . 109 ILE CG1 . 11099 1 1262 . 1 1 109 109 ILE CG2 C 13 17.653 0.300 . 1 . . . . 109 ILE CG2 . 11099 1 1263 . 1 1 109 109 ILE N N 15 122.301 0.300 . 1 . . . . 109 ILE N . 11099 1 1264 . 1 1 110 110 THR H H 1 8.205 0.030 . 1 . . . . 110 THR H . 11099 1 1265 . 1 1 110 110 THR HA H 1 4.412 0.030 . 1 . . . . 110 THR HA . 11099 1 1266 . 1 1 110 110 THR HB H 1 4.258 0.030 . 1 . . . . 110 THR HB . 11099 1 1267 . 1 1 110 110 THR HG21 H 1 1.182 0.030 . 1 . . . . 110 THR HG2 . 11099 1 1268 . 1 1 110 110 THR HG22 H 1 1.182 0.030 . 1 . . . . 110 THR HG2 . 11099 1 1269 . 1 1 110 110 THR HG23 H 1 1.182 0.030 . 1 . . . . 110 THR HG2 . 11099 1 1270 . 1 1 110 110 THR C C 13 174.482 0.300 . 1 . . . . 110 THR C . 11099 1 1271 . 1 1 110 110 THR CA C 13 61.583 0.300 . 1 . . . . 110 THR CA . 11099 1 1272 . 1 1 110 110 THR CB C 13 69.767 0.300 . 1 . . . . 110 THR CB . 11099 1 1273 . 1 1 110 110 THR CG2 C 13 21.633 0.300 . 1 . . . . 110 THR CG2 . 11099 1 1274 . 1 1 110 110 THR N N 15 117.055 0.300 . 1 . . . . 110 THR N . 11099 1 1275 . 1 1 111 111 SER H H 1 8.236 0.030 . 1 . . . . 111 SER H . 11099 1 1276 . 1 1 111 111 SER CA C 13 58.433 0.300 . 1 . . . . 111 SER CA . 11099 1 1277 . 1 1 111 111 SER CB C 13 64.168 0.300 . 1 . . . . 111 SER CB . 11099 1 1278 . 1 1 111 111 SER N N 15 118.354 0.300 . 1 . . . . 111 SER N . 11099 1 1279 . 1 1 113 113 PRO HA H 1 4.467 0.030 . 1 . . . . 113 PRO HA . 11099 1 1280 . 1 1 113 113 PRO HB2 H 1 2.282 0.030 . 2 . . . . 113 PRO HB2 . 11099 1 1281 . 1 1 113 113 PRO HB3 H 1 1.958 0.030 . 2 . . . . 113 PRO HB3 . 11099 1 1282 . 1 1 113 113 PRO C C 13 177.431 0.300 . 1 . . . . 113 PRO C . 11099 1 1283 . 1 1 113 113 PRO CA C 13 63.282 0.300 . 1 . . . . 113 PRO CA . 11099 1 1284 . 1 1 113 113 PRO CB C 13 32.158 0.300 . 1 . . . . 113 PRO CB . 11099 1 1285 . 1 1 113 113 PRO CD C 13 49.825 0.300 . 1 . . . . 113 PRO CD . 11099 1 1286 . 1 1 113 113 PRO CG C 13 27.002 0.300 . 1 . . . . 113 PRO CG . 11099 1 1287 . 1 1 114 114 SER H H 1 8.541 0.030 . 1 . . . . 114 SER H . 11099 1 1288 . 1 1 114 114 SER C C 13 174.687 0.300 . 1 . . . . 114 SER C . 11099 1 1289 . 1 1 114 114 SER CA C 13 58.373 0.300 . 1 . . . . 114 SER CA . 11099 1 1290 . 1 1 114 114 SER CB C 13 63.999 0.300 . 1 . . . . 114 SER CB . 11099 1 1291 . 1 1 114 114 SER N N 15 116.409 0.300 . 1 . . . . 114 SER N . 11099 1 stop_ save_