###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 50711
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name list1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 50711 1
2 '3D HNCACB' . . . 50711 1
3 '3D HN(CO)CACB' . . . 50711 1
4 '3D HNCO' . . . 50711 1
5 '3D HN(CA)CO' . . . 50711 1
6 '3D HBHA(CO)NH' . . . 50711 1
7 '3D (H)CCH-TOCSY' . . . 50711 1
8 '3D H(C)CH-TOCSY' . . . 50711 1
9 '2D 1H-13C HSQC' . . . 50711 1
10 '2D 1H-13C HSQC aromatic' . . . 50711 1
11 '3D 1H-15N NOESY' . . . 50711 1
12 '3D 1H-13C NOESY aliphatic' . . . 50711 1
13 '3D 1H-13C NOESY aromatic' . . . 50711 1
14 '2D (HB)CB(CGCD)HD' . . . 50711 1
15 '2D (HB)CB(CGCDCE)HE' . . . 50711 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
3 $software_3 . . 50711 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_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 3 3 LYS HA H 1 3.858 0.04 . 1 . . . . . 3 LYS HA . 50711 1
2 . 1 . 1 3 3 LYS HB2 H 1 1.493 0.04 . 2 . . . . . 3 LYS HB2 . 50711 1
3 . 1 . 1 3 3 LYS HB3 H 1 1.887 0.04 . 2 . . . . . 3 LYS HB3 . 50711 1
4 . 1 . 1 3 3 LYS C C 13 178.421 0.4 . 1 . . . . . 3 LYS C . 50711 1
5 . 1 . 1 3 3 LYS CA C 13 59.293 0.4 . 1 . . . . . 3 LYS CA . 50711 1
6 . 1 . 1 3 3 LYS CB C 13 31.626 0.4 . 1 . . . . . 3 LYS CB . 50711 1
7 . 1 . 1 4 4 LYS H H 1 8.653 0.04 . 1 . . . . . 4 LYS H . 50711 1
8 . 1 . 1 4 4 LYS HA H 1 4.020 0.04 . 1 . . . . . 4 LYS HA . 50711 1
9 . 1 . 1 4 4 LYS C C 13 177.533 0.4 . 1 . . . . . 4 LYS C . 50711 1
10 . 1 . 1 4 4 LYS CA C 13 59.960 0.4 . 1 . . . . . 4 LYS CA . 50711 1
11 . 1 . 1 4 4 LYS N N 15 115.110 0.2 . 1 . . . . . 4 LYS N . 50711 1
12 . 1 . 1 5 5 GLU H H 1 7.078 0.04 . 1 . . . . . 5 GLU H . 50711 1
13 . 1 . 1 5 5 GLU HA H 1 4.392 0.04 . 1 . . . . . 5 GLU HA . 50711 1
14 . 1 . 1 5 5 GLU HB2 H 1 2.071 0.04 . 1 . . . . . 5 GLU HB2 . 50711 1
15 . 1 . 1 5 5 GLU HB3 H 1 2.071 0.04 . 1 . . . . . 5 GLU HB3 . 50711 1
16 . 1 . 1 5 5 GLU HG2 H 1 2.315 0.04 . 1 . . . . . 5 GLU HG2 . 50711 1
17 . 1 . 1 5 5 GLU HG3 H 1 2.315 0.04 . 1 . . . . . 5 GLU HG3 . 50711 1
18 . 1 . 1 5 5 GLU C C 13 177.894 0.4 . 1 . . . . . 5 GLU C . 50711 1
19 . 1 . 1 5 5 GLU CA C 13 57.829 0.4 . 1 . . . . . 5 GLU CA . 50711 1
20 . 1 . 1 5 5 GLU CB C 13 29.923 0.4 . 1 . . . . . 5 GLU CB . 50711 1
21 . 1 . 1 5 5 GLU CG C 13 35.675 0.4 . 1 . . . . . 5 GLU CG . 50711 1
22 . 1 . 1 5 5 GLU N N 15 119.937 0.2 . 1 . . . . . 5 GLU N . 50711 1
23 . 1 . 1 6 6 ILE H H 1 7.566 0.04 . 1 . . . . . 6 ILE H . 50711 1
24 . 1 . 1 6 6 ILE HA H 1 3.527 0.04 . 1 . . . . . 6 ILE HA . 50711 1
25 . 1 . 1 6 6 ILE HB H 1 1.750 0.04 . 1 . . . . . 6 ILE HB . 50711 1
26 . 1 . 1 6 6 ILE HG12 H 1 0.978 0.04 . 2 . . . . . 6 ILE HG12 . 50711 1
27 . 1 . 1 6 6 ILE HG13 H 1 1.499 0.04 . 2 . . . . . 6 ILE HG13 . 50711 1
28 . 1 . 1 6 6 ILE HG21 H 1 0.669 0.04 . 1 . . . . . 6 ILE HG2* . 50711 1
29 . 1 . 1 6 6 ILE HG22 H 1 0.669 0.04 . 1 . . . . . 6 ILE HG2* . 50711 1
30 . 1 . 1 6 6 ILE HG23 H 1 0.669 0.04 . 1 . . . . . 6 ILE HG2* . 50711 1
31 . 1 . 1 6 6 ILE HD11 H 1 0.732 0.04 . 1 . . . . . 6 ILE HD1* . 50711 1
32 . 1 . 1 6 6 ILE HD12 H 1 0.732 0.04 . 1 . . . . . 6 ILE HD1* . 50711 1
33 . 1 . 1 6 6 ILE HD13 H 1 0.732 0.04 . 1 . . . . . 6 ILE HD1* . 50711 1
34 . 1 . 1 6 6 ILE C C 13 177.143 0.4 . 1 . . . . . 6 ILE C . 50711 1
35 . 1 . 1 6 6 ILE CA C 13 65.689 0.4 . 1 . . . . . 6 ILE CA . 50711 1
36 . 1 . 1 6 6 ILE CB C 13 38.604 0.4 . 1 . . . . . 6 ILE CB . 50711 1
37 . 1 . 1 6 6 ILE CG1 C 13 29.537 0.4 . 1 . . . . . 6 ILE CG1 . 50711 1
38 . 1 . 1 6 6 ILE CG2 C 13 17.380 0.4 . 1 . . . . . 6 ILE CG2 . 50711 1
39 . 1 . 1 6 6 ILE CD1 C 13 14.099 0.4 . 1 . . . . . 6 ILE CD1 . 50711 1
40 . 1 . 1 6 6 ILE N N 15 121.533 0.2 . 1 . . . . . 6 ILE N . 50711 1
41 . 1 . 1 7 7 ARG H H 1 7.888 0.04 . 1 . . . . . 7 ARG H . 50711 1
42 . 1 . 1 7 7 ARG HA H 1 4.410 0.04 . 1 . . . . . 7 ARG HA . 50711 1
43 . 1 . 1 7 7 ARG HB2 H 1 -0.181 0.04 . 2 . . . . . 7 ARG HB2 . 50711 1
44 . 1 . 1 7 7 ARG HB3 H 1 0.635 0.04 . 2 . . . . . 7 ARG HB3 . 50711 1
45 . 1 . 1 7 7 ARG HG2 H 1 0.937 0.04 . 2 . . . . . 7 ARG HG2 . 50711 1
46 . 1 . 1 7 7 ARG HG3 H 1 1.281 0.04 . 2 . . . . . 7 ARG HG3 . 50711 1
47 . 1 . 1 7 7 ARG HD2 H 1 2.045 0.04 . 2 . . . . . 7 ARG HD2 . 50711 1
48 . 1 . 1 7 7 ARG HD3 H 1 2.460 0.04 . 2 . . . . . 7 ARG HD3 . 50711 1
49 . 1 . 1 7 7 ARG HE H 1 8.466 0.04 . 1 . . . . . 7 ARG HE . 50711 1
50 . 1 . 1 7 7 ARG C C 13 178.327 0.4 . 1 . . . . . 7 ARG C . 50711 1
51 . 1 . 1 7 7 ARG CA C 13 58.414 0.4 . 1 . . . . . 7 ARG CA . 50711 1
52 . 1 . 1 7 7 ARG CB C 13 28.555 0.4 . 1 . . . . . 7 ARG CB . 50711 1
53 . 1 . 1 7 7 ARG CG C 13 27.745 0.4 . 1 . . . . . 7 ARG CG . 50711 1
54 . 1 . 1 7 7 ARG CD C 13 44.868 0.4 . 1 . . . . . 7 ARG CD . 50711 1
55 . 1 . 1 7 7 ARG N N 15 116.884 0.2 . 1 . . . . . 7 ARG N . 50711 1
56 . 1 . 1 7 7 ARG NE N 15 89.113 0.2 . 1 . . . . . 7 ARG NE . 50711 1
57 . 1 . 1 8 8 ARG H H 1 6.990 0.04 . 1 . . . . . 8 ARG H . 50711 1
58 . 1 . 1 8 8 ARG HA H 1 3.919 0.04 . 1 . . . . . 8 ARG HA . 50711 1
59 . 1 . 1 8 8 ARG HB2 H 1 2.063 0.04 . 2 . . . . . 8 ARG HB2 . 50711 1
60 . 1 . 1 8 8 ARG HB3 H 1 2.125 0.04 . 2 . . . . . 8 ARG HB3 . 50711 1
61 . 1 . 1 8 8 ARG HG2 H 1 1.730 0.04 . 2 . . . . . 8 ARG HG2 . 50711 1
62 . 1 . 1 8 8 ARG HG3 H 1 2.141 0.04 . 2 . . . . . 8 ARG HG3 . 50711 1
63 . 1 . 1 8 8 ARG HD2 H 1 3.134 0.04 . 1 . . . . . 8 ARG HD2 . 50711 1
64 . 1 . 1 8 8 ARG HD3 H 1 3.134 0.04 . 1 . . . . . 8 ARG HD3 . 50711 1
65 . 1 . 1 8 8 ARG C C 13 178.135 0.4 . 1 . . . . . 8 ARG C . 50711 1
66 . 1 . 1 8 8 ARG CA C 13 60.802 0.4 . 1 . . . . . 8 ARG CA . 50711 1
67 . 1 . 1 8 8 ARG CB C 13 31.294 0.4 . 1 . . . . . 8 ARG CB . 50711 1
68 . 1 . 1 8 8 ARG CG C 13 27.914 0.4 . 1 . . . . . 8 ARG CG . 50711 1
69 . 1 . 1 8 8 ARG CD C 13 43.718 0.4 . 1 . . . . . 8 ARG CD . 50711 1
70 . 1 . 1 8 8 ARG N N 15 116.981 0.2 . 1 . . . . . 8 ARG N . 50711 1
71 . 1 . 1 9 9 LEU H H 1 7.861 0.04 . 1 . . . . . 9 LEU H . 50711 1
72 . 1 . 1 9 9 LEU HA H 1 4.006 0.04 . 1 . . . . . 9 LEU HA . 50711 1
73 . 1 . 1 9 9 LEU HB2 H 1 1.596 0.04 . 2 . . . . . 9 LEU HB2 . 50711 1
74 . 1 . 1 9 9 LEU HB3 H 1 2.028 0.04 . 2 . . . . . 9 LEU HB3 . 50711 1
75 . 1 . 1 9 9 LEU HG H 1 1.805 0.04 . 1 . . . . . 9 LEU HG . 50711 1
76 . 1 . 1 9 9 LEU HD11 H 1 0.767 0.04 . 2 . . . . . 9 LEU HD1* . 50711 1
77 . 1 . 1 9 9 LEU HD12 H 1 0.767 0.04 . 2 . . . . . 9 LEU HD1* . 50711 1
78 . 1 . 1 9 9 LEU HD13 H 1 0.767 0.04 . 2 . . . . . 9 LEU HD1* . 50711 1
79 . 1 . 1 9 9 LEU HD21 H 1 0.805 0.04 . 2 . . . . . 9 LEU HD2* . 50711 1
80 . 1 . 1 9 9 LEU HD22 H 1 0.805 0.04 . 2 . . . . . 9 LEU HD2* . 50711 1
81 . 1 . 1 9 9 LEU HD23 H 1 0.805 0.04 . 2 . . . . . 9 LEU HD2* . 50711 1
82 . 1 . 1 9 9 LEU C C 13 180.765 0.4 . 1 . . . . . 9 LEU C . 50711 1
83 . 1 . 1 9 9 LEU CA C 13 58.166 0.4 . 1 . . . . . 9 LEU CA . 50711 1
84 . 1 . 1 9 9 LEU CB C 13 42.045 0.4 . 1 . . . . . 9 LEU CB . 50711 1
85 . 1 . 1 9 9 LEU CG C 13 26.841 0.4 . 1 . . . . . 9 LEU CG . 50711 1
86 . 1 . 1 9 9 LEU CD1 C 13 22.958 0.4 . 2 . . . . . 9 LEU CD1 . 50711 1
87 . 1 . 1 9 9 LEU CD2 C 13 25.218 0.4 . 2 . . . . . 9 LEU CD2 . 50711 1
88 . 1 . 1 9 9 LEU N N 15 119.490 0.2 . 1 . . . . . 9 LEU N . 50711 1
89 . 1 . 1 10 10 ARG H H 1 9.142 0.04 . 1 . . . . . 10 ARG H . 50711 1
90 . 1 . 1 10 10 ARG HA H 1 4.112 0.04 . 1 . . . . . 10 ARG HA . 50711 1
91 . 1 . 1 10 10 ARG HB2 H 1 1.403 0.04 . 2 . . . . . 10 ARG HB2 . 50711 1
92 . 1 . 1 10 10 ARG HB3 H 1 2.145 0.04 . 2 . . . . . 10 ARG HB3 . 50711 1
93 . 1 . 1 10 10 ARG C C 13 179.311 0.4 . 1 . . . . . 10 ARG C . 50711 1
94 . 1 . 1 10 10 ARG CA C 13 57.735 0.4 . 1 . . . . . 10 ARG CA . 50711 1
95 . 1 . 1 10 10 ARG CB C 13 31.173 0.4 . 1 . . . . . 10 ARG CB . 50711 1
96 . 1 . 1 10 10 ARG N N 15 120.765 0.2 . 1 . . . . . 10 ARG N . 50711 1
97 . 1 . 1 11 11 LEU H H 1 8.739 0.04 . 1 . . . . . 11 LEU H . 50711 1
98 . 1 . 1 11 11 LEU HA H 1 4.202 0.04 . 1 . . . . . 11 LEU HA . 50711 1
99 . 1 . 1 11 11 LEU HB2 H 1 1.955 0.04 . 2 . . . . . 11 LEU HB2 . 50711 1
100 . 1 . 1 11 11 LEU HB3 H 1 2.281 0.04 . 2 . . . . . 11 LEU HB3 . 50711 1
101 . 1 . 1 11 11 LEU HG H 1 1.893 0.04 . 1 . . . . . 11 LEU HG . 50711 1
102 . 1 . 1 11 11 LEU HD11 H 1 0.972 0.04 . 2 . . . . . 11 LEU HD1* . 50711 1
103 . 1 . 1 11 11 LEU HD12 H 1 0.972 0.04 . 2 . . . . . 11 LEU HD1* . 50711 1
104 . 1 . 1 11 11 LEU HD13 H 1 0.972 0.04 . 2 . . . . . 11 LEU HD1* . 50711 1
105 . 1 . 1 11 11 LEU HD21 H 1 1.217 0.04 . 2 . . . . . 11 LEU HD2* . 50711 1
106 . 1 . 1 11 11 LEU HD22 H 1 1.217 0.04 . 2 . . . . . 11 LEU HD2* . 50711 1
107 . 1 . 1 11 11 LEU HD23 H 1 1.217 0.04 . 2 . . . . . 11 LEU HD2* . 50711 1
108 . 1 . 1 11 11 LEU C C 13 178.251 0.4 . 1 . . . . . 11 LEU C . 50711 1
109 . 1 . 1 11 11 LEU CA C 13 58.574 0.4 . 1 . . . . . 11 LEU CA . 50711 1
110 . 1 . 1 11 11 LEU CB C 13 42.633 0.4 . 1 . . . . . 11 LEU CB . 50711 1
111 . 1 . 1 11 11 LEU CG C 13 27.002 0.4 . 1 . . . . . 11 LEU CG . 50711 1
112 . 1 . 1 11 11 LEU CD1 C 13 28.890 0.4 . 2 . . . . . 11 LEU CD1 . 50711 1
113 . 1 . 1 11 11 LEU CD2 C 13 25.484 0.4 . 2 . . . . . 11 LEU CD2 . 50711 1
114 . 1 . 1 11 11 LEU N N 15 123.291 0.2 . 1 . . . . . 11 LEU N . 50711 1
115 . 1 . 1 12 12 LYS H H 1 7.911 0.04 . 1 . . . . . 12 LYS H . 50711 1
116 . 1 . 1 12 12 LYS HA H 1 4.176 0.04 . 1 . . . . . 12 LYS HA . 50711 1
117 . 1 . 1 12 12 LYS HB2 H 1 1.967 0.04 . 1 . . . . . 12 LYS HB2 . 50711 1
118 . 1 . 1 12 12 LYS HB3 H 1 1.967 0.04 . 1 . . . . . 12 LYS HB3 . 50711 1
119 . 1 . 1 12 12 LYS HG2 H 1 1.487 0.04 . 2 . . . . . 12 LYS HG2 . 50711 1
120 . 1 . 1 12 12 LYS HG3 H 1 1.826 0.04 . 2 . . . . . 12 LYS HG3 . 50711 1
121 . 1 . 1 12 12 LYS HD2 H 1 1.653 0.04 . 2 . . . . . 12 LYS HD2 . 50711 1
122 . 1 . 1 12 12 LYS HD3 H 1 1.802 0.04 . 2 . . . . . 12 LYS HD3 . 50711 1
123 . 1 . 1 12 12 LYS HE2 H 1 2.971 0.04 . 1 . . . . . 12 LYS HE2 . 50711 1
124 . 1 . 1 12 12 LYS HE3 H 1 2.971 0.04 . 1 . . . . . 12 LYS HE3 . 50711 1
125 . 1 . 1 12 12 LYS C C 13 179.581 0.4 . 1 . . . . . 12 LYS C . 50711 1
126 . 1 . 1 12 12 LYS CA C 13 60.031 0.4 . 1 . . . . . 12 LYS CA . 50711 1
127 . 1 . 1 12 12 LYS CB C 13 32.594 0.4 . 1 . . . . . 12 LYS CB . 50711 1
128 . 1 . 1 12 12 LYS CG C 13 25.367 0.4 . 1 . . . . . 12 LYS CG . 50711 1
129 . 1 . 1 12 12 LYS CD C 13 29.654 0.4 . 1 . . . . . 12 LYS CD . 50711 1
130 . 1 . 1 12 12 LYS CE C 13 41.663 0.4 . 1 . . . . . 12 LYS CE . 50711 1
131 . 1 . 1 12 12 LYS N N 15 117.257 0.2 . 1 . . . . . 12 LYS N . 50711 1
132 . 1 . 1 13 13 GLU H H 1 8.203 0.04 . 1 . . . . . 13 GLU H . 50711 1
133 . 1 . 1 13 13 GLU HA H 1 3.996 0.04 . 1 . . . . . 13 GLU HA . 50711 1
134 . 1 . 1 13 13 GLU HB2 H 1 2.279 0.04 . 2 . . . . . 13 GLU HB2 . 50711 1
135 . 1 . 1 13 13 GLU HB3 H 1 2.377 0.04 . 2 . . . . . 13 GLU HB3 . 50711 1
136 . 1 . 1 13 13 GLU HG2 H 1 2.301 0.04 . 2 . . . . . 13 GLU HG2 . 50711 1
137 . 1 . 1 13 13 GLU HG3 H 1 2.403 0.04 . 2 . . . . . 13 GLU HG3 . 50711 1
138 . 1 . 1 13 13 GLU C C 13 179.161 0.4 . 1 . . . . . 13 GLU C . 50711 1
139 . 1 . 1 13 13 GLU CA C 13 59.415 0.4 . 1 . . . . . 13 GLU CA . 50711 1
140 . 1 . 1 13 13 GLU CB C 13 29.984 0.4 . 1 . . . . . 13 GLU CB . 50711 1
141 . 1 . 1 13 13 GLU CG C 13 36.456 0.4 . 1 . . . . . 13 GLU CG . 50711 1
142 . 1 . 1 13 13 GLU N N 15 119.038 0.2 . 1 . . . . . 13 GLU N . 50711 1
143 . 1 . 1 14 14 TRP H H 1 8.543 0.04 . 1 . . . . . 14 TRP H . 50711 1
144 . 1 . 1 14 14 TRP HA H 1 3.926 0.04 . 1 . . . . . 14 TRP HA . 50711 1
145 . 1 . 1 14 14 TRP HB2 H 1 3.025 0.04 . 2 . . . . . 14 TRP HB2 . 50711 1
146 . 1 . 1 14 14 TRP HB3 H 1 3.374 0.04 . 2 . . . . . 14 TRP HB3 . 50711 1
147 . 1 . 1 14 14 TRP HE1 H 1 9.892 0.04 . 1 . . . . . 14 TRP HE1 . 50711 1
148 . 1 . 1 14 14 TRP C C 13 177.499 0.4 . 1 . . . . . 14 TRP C . 50711 1
149 . 1 . 1 14 14 TRP CA C 13 60.776 0.4 . 1 . . . . . 14 TRP CA . 50711 1
150 . 1 . 1 14 14 TRP CB C 13 28.656 0.4 . 1 . . . . . 14 TRP CB . 50711 1
151 . 1 . 1 14 14 TRP N N 15 120.754 0.2 . 1 . . . . . 14 TRP N . 50711 1
152 . 1 . 1 14 14 TRP NE1 N 15 128.563 0.2 . 1 . . . . . 14 TRP NE1 . 50711 1
153 . 1 . 1 15 15 PHE H H 1 7.448 0.04 . 1 . . . . . 15 PHE H . 50711 1
154 . 1 . 1 15 15 PHE HA H 1 4.254 0.04 . 1 . . . . . 15 PHE HA . 50711 1
155 . 1 . 1 15 15 PHE HB2 H 1 2.602 0.04 . 2 . . . . . 15 PHE HB2 . 50711 1
156 . 1 . 1 15 15 PHE HB3 H 1 3.496 0.04 . 2 . . . . . 15 PHE HB3 . 50711 1
157 . 1 . 1 15 15 PHE HD1 H 1 7.253 0.04 . 1 . . . . . 15 PHE HD1 . 50711 1
158 . 1 . 1 15 15 PHE HD2 H 1 7.253 0.04 . 1 . . . . . 15 PHE HD2 . 50711 1
159 . 1 . 1 15 15 PHE HE1 H 1 6.986 0.04 . 1 . . . . . 15 PHE HE1 . 50711 1
160 . 1 . 1 15 15 PHE HE2 H 1 6.986 0.04 . 1 . . . . . 15 PHE HE2 . 50711 1
161 . 1 . 1 15 15 PHE C C 13 175.281 0.4 . 1 . . . . . 15 PHE C . 50711 1
162 . 1 . 1 15 15 PHE CA C 13 60.316 0.4 . 1 . . . . . 15 PHE CA . 50711 1
163 . 1 . 1 15 15 PHE CB C 13 39.018 0.4 . 1 . . . . . 15 PHE CB . 50711 1
164 . 1 . 1 15 15 PHE CD1 C 13 131.977 0.4 . 1 . . . . . 15 PHE CD1 . 50711 1
165 . 1 . 1 15 15 PHE CD2 C 13 131.977 0.4 . 1 . . . . . 15 PHE CD2 . 50711 1
166 . 1 . 1 15 15 PHE CE1 C 13 131.228 0.4 . 1 . . . . . 15 PHE CE1 . 50711 1
167 . 1 . 1 15 15 PHE CE2 C 13 131.228 0.4 . 1 . . . . . 15 PHE CE2 . 50711 1
168 . 1 . 1 15 15 PHE N N 15 110.672 0.2 . 1 . . . . . 15 PHE N . 50711 1
169 . 1 . 1 16 16 LYS H H 1 7.352 0.04 . 1 . . . . . 16 LYS H . 50711 1
170 . 1 . 1 16 16 LYS C C 13 176.744 0.4 . 1 . . . . . 16 LYS C . 50711 1
171 . 1 . 1 16 16 LYS CA C 13 59.469 0.4 . 1 . . . . . 16 LYS CA . 50711 1
172 . 1 . 1 16 16 LYS CB C 13 32.112 0.4 . 1 . . . . . 16 LYS CB . 50711 1
173 . 1 . 1 16 16 LYS N N 15 121.913 0.2 . 1 . . . . . 16 LYS N . 50711 1
174 . 1 . 1 17 17 ASP C C 13 175.118 0.4 . 1 . . . . . 17 ASP C . 50711 1
175 . 1 . 1 18 18 LYS H H 1 7.458 0.04 . 1 . . . . . 18 LYS H . 50711 1
176 . 1 . 1 18 18 LYS HA H 1 4.621 0.04 . 1 . . . . . 18 LYS HA . 50711 1
177 . 1 . 1 18 18 LYS HB2 H 1 1.505 0.04 . 2 . . . . . 18 LYS HB2 . 50711 1
178 . 1 . 1 18 18 LYS HB3 H 1 1.942 0.04 . 2 . . . . . 18 LYS HB3 . 50711 1
179 . 1 . 1 18 18 LYS HG2 H 1 1.108 0.04 . 2 . . . . . 18 LYS HG2 . 50711 1
180 . 1 . 1 18 18 LYS HG3 H 1 1.289 0.04 . 2 . . . . . 18 LYS HG3 . 50711 1
181 . 1 . 1 18 18 LYS HD2 H 1 0.878 0.04 . 2 . . . . . 18 LYS HD2 . 50711 1
182 . 1 . 1 18 18 LYS HD3 H 1 1.452 0.04 . 2 . . . . . 18 LYS HD3 . 50711 1
183 . 1 . 1 18 18 LYS HE2 H 1 2.173 0.04 . 2 . . . . . 18 LYS HE2 . 50711 1
184 . 1 . 1 18 18 LYS HE3 H 1 2.459 0.04 . 2 . . . . . 18 LYS HE3 . 50711 1
185 . 1 . 1 18 18 LYS C C 13 175.579 0.4 . 1 . . . . . 18 LYS C . 50711 1
186 . 1 . 1 18 18 LYS CA C 13 54.970 0.4 . 1 . . . . . 18 LYS CA . 50711 1
187 . 1 . 1 18 18 LYS CB C 13 36.681 0.4 . 1 . . . . . 18 LYS CB . 50711 1
188 . 1 . 1 18 18 LYS CG C 13 24.718 0.4 . 1 . . . . . 18 LYS CG . 50711 1
189 . 1 . 1 18 18 LYS CD C 13 29.004 0.4 . 1 . . . . . 18 LYS CD . 50711 1
190 . 1 . 1 18 18 LYS CE C 13 42.075 0.4 . 1 . . . . . 18 LYS CE . 50711 1
191 . 1 . 1 18 18 LYS N N 15 118.520 0.2 . 1 . . . . . 18 LYS N . 50711 1
192 . 1 . 1 19 19 THR H H 1 8.255 0.04 . 1 . . . . . 19 THR H . 50711 1
193 . 1 . 1 19 19 THR HA H 1 4.217 0.04 . 1 . . . . . 19 THR HA . 50711 1
194 . 1 . 1 19 19 THR HB H 1 3.955 0.04 . 1 . . . . . 19 THR HB . 50711 1
195 . 1 . 1 19 19 THR HG21 H 1 1.152 0.04 . 1 . . . . . 19 THR HG2* . 50711 1
196 . 1 . 1 19 19 THR HG22 H 1 1.152 0.04 . 1 . . . . . 19 THR HG2* . 50711 1
197 . 1 . 1 19 19 THR HG23 H 1 1.152 0.04 . 1 . . . . . 19 THR HG2* . 50711 1
198 . 1 . 1 19 19 THR C C 13 174.279 0.4 . 1 . . . . . 19 THR C . 50711 1
199 . 1 . 1 19 19 THR CA C 13 62.122 0.4 . 1 . . . . . 19 THR CA . 50711 1
200 . 1 . 1 19 19 THR CB C 13 69.824 0.4 . 1 . . . . . 19 THR CB . 50711 1
201 . 1 . 1 19 19 THR CG2 C 13 21.799 0.4 . 1 . . . . . 19 THR CG2 . 50711 1
202 . 1 . 1 19 19 THR N N 15 116.263 0.2 . 1 . . . . . 19 THR N . 50711 1
203 . 1 . 1 20 20 LEU H H 1 8.563 0.04 . 1 . . . . . 20 LEU H . 50711 1
204 . 1 . 1 20 20 LEU HA H 1 4.138 0.04 . 1 . . . . . 20 LEU HA . 50711 1
205 . 1 . 1 20 20 LEU HB2 H 1 0.866 0.04 . 2 . . . . . 20 LEU HB2 . 50711 1
206 . 1 . 1 20 20 LEU HB3 H 1 1.425 0.04 . 2 . . . . . 20 LEU HB3 . 50711 1
207 . 1 . 1 20 20 LEU HG H 1 1.393 0.04 . 1 . . . . . 20 LEU HG . 50711 1
208 . 1 . 1 20 20 LEU HD11 H 1 0.228 0.04 . 2 . . . . . 20 LEU HD1* . 50711 1
209 . 1 . 1 20 20 LEU HD12 H 1 0.228 0.04 . 2 . . . . . 20 LEU HD1* . 50711 1
210 . 1 . 1 20 20 LEU HD13 H 1 0.228 0.04 . 2 . . . . . 20 LEU HD1* . 50711 1
211 . 1 . 1 20 20 LEU HD21 H 1 0.576 0.04 . 2 . . . . . 20 LEU HD2* . 50711 1
212 . 1 . 1 20 20 LEU HD22 H 1 0.576 0.04 . 2 . . . . . 20 LEU HD2* . 50711 1
213 . 1 . 1 20 20 LEU HD23 H 1 0.576 0.04 . 2 . . . . . 20 LEU HD2* . 50711 1
214 . 1 . 1 20 20 LEU C C 13 174.007 0.4 . 1 . . . . . 20 LEU C . 50711 1
215 . 1 . 1 20 20 LEU CA C 13 52.724 0.4 . 1 . . . . . 20 LEU CA . 50711 1
216 . 1 . 1 20 20 LEU CB C 13 41.660 0.4 . 1 . . . . . 20 LEU CB . 50711 1
217 . 1 . 1 20 20 LEU CG C 13 27.116 0.4 . 1 . . . . . 20 LEU CG . 50711 1
218 . 1 . 1 20 20 LEU CD1 C 13 23.987 0.4 . 2 . . . . . 20 LEU CD1 . 50711 1
219 . 1 . 1 20 20 LEU CD2 C 13 25.637 0.4 . 2 . . . . . 20 LEU CD2 . 50711 1
220 . 1 . 1 20 20 LEU N N 15 127.127 0.2 . 1 . . . . . 20 LEU N . 50711 1
221 . 1 . 1 22 22 PRO HA H 1 4.026 0.04 . 1 . . . . . 22 PRO HA . 50711 1
222 . 1 . 1 22 22 PRO HB2 H 1 1.921 0.04 . 2 . . . . . 22 PRO HB2 . 50711 1
223 . 1 . 1 22 22 PRO HB3 H 1 2.315 0.04 . 2 . . . . . 22 PRO HB3 . 50711 1
224 . 1 . 1 22 22 PRO HG2 H 1 2.008 0.04 . 2 . . . . . 22 PRO HG2 . 50711 1
225 . 1 . 1 22 22 PRO HG3 H 1 2.077 0.04 . 2 . . . . . 22 PRO HG3 . 50711 1
226 . 1 . 1 22 22 PRO HD2 H 1 3.810 0.04 . 2 . . . . . 22 PRO HD2 . 50711 1
227 . 1 . 1 22 22 PRO HD3 H 1 3.881 0.04 . 2 . . . . . 22 PRO HD3 . 50711 1
228 . 1 . 1 22 22 PRO C C 13 179.490 0.4 . 1 . . . . . 22 PRO C . 50711 1
229 . 1 . 1 22 22 PRO CA C 13 65.756 0.4 . 1 . . . . . 22 PRO CA . 50711 1
230 . 1 . 1 22 22 PRO CB C 13 32.283 0.4 . 1 . . . . . 22 PRO CB . 50711 1
231 . 1 . 1 22 22 PRO CG C 13 27.523 0.4 . 1 . . . . . 22 PRO CG . 50711 1
232 . 1 . 1 22 22 PRO CD C 13 50.774 0.4 . 1 . . . . . 22 PRO CD . 50711 1
233 . 1 . 1 23 23 LYS H H 1 8.665 0.04 . 1 . . . . . 23 LYS H . 50711 1
234 . 1 . 1 23 23 LYS HA H 1 4.074 0.04 . 1 . . . . . 23 LYS HA . 50711 1
235 . 1 . 1 23 23 LYS HB2 H 1 1.819 0.04 . 2 . . . . . 23 LYS HB2 . 50711 1
236 . 1 . 1 23 23 LYS HB3 H 1 1.873 0.04 . 2 . . . . . 23 LYS HB3 . 50711 1
237 . 1 . 1 23 23 LYS HG2 H 1 1.402 0.04 . 2 . . . . . 23 LYS HG2 . 50711 1
238 . 1 . 1 23 23 LYS HG3 H 1 1.486 0.04 . 2 . . . . . 23 LYS HG3 . 50711 1
239 . 1 . 1 23 23 LYS HD2 H 1 1.655 0.04 . 1 . . . . . 23 LYS HD2 . 50711 1
240 . 1 . 1 23 23 LYS HD3 H 1 1.655 0.04 . 1 . . . . . 23 LYS HD3 . 50711 1
241 . 1 . 1 23 23 LYS HE2 H 1 2.946 0.04 . 1 . . . . . 23 LYS HE2 . 50711 1
242 . 1 . 1 23 23 LYS HE3 H 1 2.946 0.04 . 1 . . . . . 23 LYS HE3 . 50711 1
243 . 1 . 1 23 23 LYS C C 13 177.732 0.4 . 1 . . . . . 23 LYS C . 50711 1
244 . 1 . 1 23 23 LYS CA C 13 59.156 0.4 . 1 . . . . . 23 LYS CA . 50711 1
245 . 1 . 1 23 23 LYS CB C 13 32.345 0.4 . 1 . . . . . 23 LYS CB . 50711 1
246 . 1 . 1 23 23 LYS CG C 13 25.367 0.4 . 1 . . . . . 23 LYS CG . 50711 1
247 . 1 . 1 23 23 LYS CD C 13 29.105 0.4 . 1 . . . . . 23 LYS CD . 50711 1
248 . 1 . 1 23 23 LYS CE C 13 42.062 0.4 . 1 . . . . . 23 LYS CE . 50711 1
249 . 1 . 1 23 23 LYS N N 15 116.064 0.2 . 1 . . . . . 23 LYS N . 50711 1
250 . 1 . 1 24 24 GLU H H 1 7.342 0.04 . 1 . . . . . 24 GLU H . 50711 1
251 . 1 . 1 24 24 GLU HA H 1 4.873 0.04 . 1 . . . . . 24 GLU HA . 50711 1
252 . 1 . 1 24 24 GLU HB2 H 1 1.843 0.04 . 2 . . . . . 24 GLU HB2 . 50711 1
253 . 1 . 1 24 24 GLU HB3 H 1 2.367 0.04 . 2 . . . . . 24 GLU HB3 . 50711 1
254 . 1 . 1 24 24 GLU HG2 H 1 2.205 0.04 . 2 . . . . . 24 GLU HG2 . 50711 1
255 . 1 . 1 24 24 GLU HG3 H 1 2.270 0.04 . 2 . . . . . 24 GLU HG3 . 50711 1
256 . 1 . 1 24 24 GLU C C 13 175.673 0.4 . 1 . . . . . 24 GLU C . 50711 1
257 . 1 . 1 24 24 GLU CA C 13 55.461 0.4 . 1 . . . . . 24 GLU CA . 50711 1
258 . 1 . 1 24 24 GLU CB C 13 30.760 0.4 . 1 . . . . . 24 GLU CB . 50711 1
259 . 1 . 1 24 24 GLU CG C 13 36.830 0.4 . 1 . . . . . 24 GLU CG . 50711 1
260 . 1 . 1 24 24 GLU N N 15 113.960 0.2 . 1 . . . . . 24 GLU N . 50711 1
261 . 1 . 1 25 25 LYS H H 1 7.320 0.04 . 1 . . . . . 25 LYS H . 50711 1
262 . 1 . 1 25 25 LYS HA H 1 3.531 0.04 . 1 . . . . . 25 LYS HA . 50711 1
263 . 1 . 1 25 25 LYS HB2 H 1 1.705 0.04 . 2 . . . . . 25 LYS HB2 . 50711 1
264 . 1 . 1 25 25 LYS HB3 H 1 1.776 0.04 . 2 . . . . . 25 LYS HB3 . 50711 1
265 . 1 . 1 25 25 LYS HG2 H 1 1.209 0.04 . 2 . . . . . 25 LYS HG2 . 50711 1
266 . 1 . 1 25 25 LYS HG3 H 1 1.259 0.04 . 2 . . . . . 25 LYS HG3 . 50711 1
267 . 1 . 1 25 25 LYS HD2 H 1 1.558 0.04 . 1 . . . . . 25 LYS HD2 . 50711 1
268 . 1 . 1 25 25 LYS HD3 H 1 1.558 0.04 . 1 . . . . . 25 LYS HD3 . 50711 1
269 . 1 . 1 25 25 LYS HE2 H 1 2.856 0.04 . 1 . . . . . 25 LYS HE2 . 50711 1
270 . 1 . 1 25 25 LYS HE3 H 1 2.856 0.04 . 1 . . . . . 25 LYS HE3 . 50711 1
271 . 1 . 1 25 25 LYS C C 13 178.129 0.4 . 1 . . . . . 25 LYS C . 50711 1
272 . 1 . 1 25 25 LYS CA C 13 60.751 0.4 . 1 . . . . . 25 LYS CA . 50711 1
273 . 1 . 1 25 25 LYS CB C 13 32.374 0.4 . 1 . . . . . 25 LYS CB . 50711 1
274 . 1 . 1 25 25 LYS CG C 13 24.215 0.4 . 1 . . . . . 25 LYS CG . 50711 1
275 . 1 . 1 25 25 LYS CD C 13 29.645 0.4 . 1 . . . . . 25 LYS CD . 50711 1
276 . 1 . 1 25 25 LYS CE C 13 42.002 0.4 . 1 . . . . . 25 LYS CE . 50711 1
277 . 1 . 1 25 25 LYS N N 15 121.533 0.2 . 1 . . . . . 25 LYS N . 50711 1
278 . 1 . 1 26 26 SER H H 1 8.664 0.04 . 1 . . . . . 26 SER H . 50711 1
279 . 1 . 1 26 26 SER CA C 13 62.069 0.4 . 1 . . . . . 26 SER CA . 50711 1
280 . 1 . 1 26 26 SER N N 15 115.546 0.2 . 1 . . . . . 26 SER N . 50711 1
281 . 1 . 1 27 27 TYR H H 1 7.957 0.04 . 1 . . . . . 27 TYR H . 50711 1
282 . 1 . 1 27 27 TYR HA H 1 4.301 0.04 . 1 . . . . . 27 TYR HA . 50711 1
283 . 1 . 1 27 27 TYR HB2 H 1 2.738 0.04 . 2 . . . . . 27 TYR HB2 . 50711 1
284 . 1 . 1 27 27 TYR HB3 H 1 3.185 0.04 . 2 . . . . . 27 TYR HB3 . 50711 1
285 . 1 . 1 27 27 TYR HD1 H 1 6.975 0.04 . 1 . . . . . 27 TYR HD1 . 50711 1
286 . 1 . 1 27 27 TYR HD2 H 1 6.975 0.04 . 1 . . . . . 27 TYR HD2 . 50711 1
287 . 1 . 1 27 27 TYR HE1 H 1 6.546 0.04 . 1 . . . . . 27 TYR HE1 . 50711 1
288 . 1 . 1 27 27 TYR HE2 H 1 6.546 0.04 . 1 . . . . . 27 TYR HE2 . 50711 1
289 . 1 . 1 27 27 TYR C C 13 177.298 0.4 . 1 . . . . . 27 TYR C . 50711 1
290 . 1 . 1 27 27 TYR CA C 13 60.009 0.4 . 1 . . . . . 27 TYR CA . 50711 1
291 . 1 . 1 27 27 TYR CB C 13 38.604 0.4 . 1 . . . . . 27 TYR CB . 50711 1
292 . 1 . 1 27 27 TYR CD1 C 13 132.893 0.4 . 1 . . . . . 27 TYR CD1 . 50711 1
293 . 1 . 1 27 27 TYR CD2 C 13 132.893 0.4 . 1 . . . . . 27 TYR CD2 . 50711 1
294 . 1 . 1 27 27 TYR CE1 C 13 117.727 0.4 . 1 . . . . . 27 TYR CE1 . 50711 1
295 . 1 . 1 27 27 TYR CE2 C 13 117.727 0.4 . 1 . . . . . 27 TYR CE2 . 50711 1
296 . 1 . 1 27 27 TYR N N 15 123.267 0.2 . 1 . . . . . 27 TYR N . 50711 1
297 . 1 . 1 28 28 LEU H H 1 8.479 0.04 . 1 . . . . . 28 LEU H . 50711 1
298 . 1 . 1 28 28 LEU HA H 1 3.508 0.04 . 1 . . . . . 28 LEU HA . 50711 1
299 . 1 . 1 28 28 LEU HB2 H 1 0.856 0.04 . 2 . . . . . 28 LEU HB2 . 50711 1
300 . 1 . 1 28 28 LEU HB3 H 1 1.555 0.04 . 2 . . . . . 28 LEU HB3 . 50711 1
301 . 1 . 1 28 28 LEU HG H 1 1.829 0.04 . 1 . . . . . 28 LEU HG . 50711 1
302 . 1 . 1 28 28 LEU HD11 H 1 0.343 0.04 . 2 . . . . . 28 LEU HD1* . 50711 1
303 . 1 . 1 28 28 LEU HD12 H 1 0.343 0.04 . 2 . . . . . 28 LEU HD1* . 50711 1
304 . 1 . 1 28 28 LEU HD13 H 1 0.343 0.04 . 2 . . . . . 28 LEU HD1* . 50711 1
305 . 1 . 1 28 28 LEU HD21 H 1 0.677 0.04 . 2 . . . . . 28 LEU HD2* . 50711 1
306 . 1 . 1 28 28 LEU HD22 H 1 0.677 0.04 . 2 . . . . . 28 LEU HD2* . 50711 1
307 . 1 . 1 28 28 LEU HD23 H 1 0.677 0.04 . 2 . . . . . 28 LEU HD2* . 50711 1
308 . 1 . 1 28 28 LEU C C 13 179.506 0.4 . 1 . . . . . 28 LEU C . 50711 1
309 . 1 . 1 28 28 LEU CA C 13 57.780 0.4 . 1 . . . . . 28 LEU CA . 50711 1
310 . 1 . 1 28 28 LEU CB C 13 41.611 0.4 . 1 . . . . . 28 LEU CB . 50711 1
311 . 1 . 1 28 28 LEU CG C 13 26.929 0.4 . 1 . . . . . 28 LEU CG . 50711 1
312 . 1 . 1 28 28 LEU CD1 C 13 26.049 0.4 . 2 . . . . . 28 LEU CD1 . 50711 1
313 . 1 . 1 28 28 LEU CD2 C 13 22.334 0.4 . 2 . . . . . 28 LEU CD2 . 50711 1
314 . 1 . 1 28 28 LEU N N 15 116.535 0.2 . 1 . . . . . 28 LEU N . 50711 1
315 . 1 . 1 29 29 SER H H 1 8.281 0.04 . 1 . . . . . 29 SER H . 50711 1
316 . 1 . 1 29 29 SER C C 13 177.312 0.4 . 1 . . . . . 29 SER C . 50711 1
317 . 1 . 1 29 29 SER CA C 13 62.512 0.4 . 1 . . . . . 29 SER CA . 50711 1
318 . 1 . 1 29 29 SER N N 15 114.096 0.2 . 1 . . . . . 29 SER N . 50711 1
319 . 1 . 1 30 30 GLN H H 1 7.906 0.04 . 1 . . . . . 30 GLN H . 50711 1
320 . 1 . 1 30 30 GLN HA H 1 3.999 0.04 . 1 . . . . . 30 GLN HA . 50711 1
321 . 1 . 1 30 30 GLN HB2 H 1 1.801 0.04 . 2 . . . . . 30 GLN HB2 . 50711 1
322 . 1 . 1 30 30 GLN HB3 H 1 2.167 0.04 . 2 . . . . . 30 GLN HB3 . 50711 1
323 . 1 . 1 30 30 GLN HG2 H 1 2.162 0.04 . 2 . . . . . 30 GLN HG2 . 50711 1
324 . 1 . 1 30 30 GLN HG3 H 1 2.551 0.04 . 2 . . . . . 30 GLN HG3 . 50711 1
325 . 1 . 1 30 30 GLN HE21 H 1 6.709 0.04 . 2 . . . . . 30 GLN HE21 . 50711 1
326 . 1 . 1 30 30 GLN HE22 H 1 7.102 0.04 . 2 . . . . . 30 GLN HE22 . 50711 1
327 . 1 . 1 30 30 GLN C C 13 179.134 0.4 . 1 . . . . . 30 GLN C . 50711 1
328 . 1 . 1 30 30 GLN CA C 13 58.929 0.4 . 1 . . . . . 30 GLN CA . 50711 1
329 . 1 . 1 30 30 GLN CB C 13 28.418 0.4 . 1 . . . . . 30 GLN CB . 50711 1
330 . 1 . 1 30 30 GLN CG C 13 34.230 0.4 . 1 . . . . . 30 GLN CG . 50711 1
331 . 1 . 1 30 30 GLN N N 15 122.992 0.2 . 1 . . . . . 30 GLN N . 50711 1
332 . 1 . 1 30 30 GLN NE2 N 15 110.867 0.2 . 1 . . . . . 30 GLN NE2 . 50711 1
333 . 1 . 1 31 31 LEU H H 1 7.742 0.04 . 1 . . . . . 31 LEU H . 50711 1
334 . 1 . 1 31 31 LEU HA H 1 3.750 0.04 . 1 . . . . . 31 LEU HA . 50711 1
335 . 1 . 1 31 31 LEU HB2 H 1 0.487 0.04 . 2 . . . . . 31 LEU HB2 . 50711 1
336 . 1 . 1 31 31 LEU HB3 H 1 1.395 0.04 . 2 . . . . . 31 LEU HB3 . 50711 1
337 . 1 . 1 31 31 LEU HD11 H 1 -0.190 0.04 . 2 . . . . . 31 LEU HD1* . 50711 1
338 . 1 . 1 31 31 LEU HD12 H 1 -0.190 0.04 . 2 . . . . . 31 LEU HD1* . 50711 1
339 . 1 . 1 31 31 LEU HD13 H 1 -0.190 0.04 . 2 . . . . . 31 LEU HD1* . 50711 1
340 . 1 . 1 31 31 LEU HD21 H 1 -0.375 0.04 . 2 . . . . . 31 LEU HD2* . 50711 1
341 . 1 . 1 31 31 LEU HD22 H 1 -0.375 0.04 . 2 . . . . . 31 LEU HD2* . 50711 1
342 . 1 . 1 31 31 LEU HD23 H 1 -0.375 0.04 . 2 . . . . . 31 LEU HD2* . 50711 1
343 . 1 . 1 31 31 LEU C C 13 181.226 0.4 . 1 . . . . . 31 LEU C . 50711 1
344 . 1 . 1 31 31 LEU CA C 13 57.463 0.4 . 1 . . . . . 31 LEU CA . 50711 1
345 . 1 . 1 31 31 LEU CB C 13 41.363 0.4 . 1 . . . . . 31 LEU CB . 50711 1
346 . 1 . 1 31 31 LEU CD1 C 13 21.560 0.4 . 2 . . . . . 31 LEU CD1 . 50711 1
347 . 1 . 1 31 31 LEU CD2 C 13 25.783 0.4 . 2 . . . . . 31 LEU CD2 . 50711 1
348 . 1 . 1 31 31 LEU N N 15 120.477 0.2 . 1 . . . . . 31 LEU N . 50711 1
349 . 1 . 1 32 32 MET H H 1 8.298 0.04 . 1 . . . . . 32 MET H . 50711 1
350 . 1 . 1 32 32 MET HA H 1 3.912 0.04 . 1 . . . . . 32 MET HA . 50711 1
351 . 1 . 1 32 32 MET HB2 H 1 1.979 0.04 . 2 . . . . . 32 MET HB2 . 50711 1
352 . 1 . 1 32 32 MET HB3 H 1 2.204 0.04 . 2 . . . . . 32 MET HB3 . 50711 1
353 . 1 . 1 32 32 MET HG2 H 1 2.289 0.04 . 2 . . . . . 32 MET HG2 . 50711 1
354 . 1 . 1 32 32 MET HG3 H 1 2.883 0.04 . 2 . . . . . 32 MET HG3 . 50711 1
355 . 1 . 1 32 32 MET C C 13 176.893 0.4 . 1 . . . . . 32 MET C . 50711 1
356 . 1 . 1 32 32 MET CA C 13 60.430 0.4 . 1 . . . . . 32 MET CA . 50711 1
357 . 1 . 1 32 32 MET CB C 13 33.893 0.4 . 1 . . . . . 32 MET CB . 50711 1
358 . 1 . 1 32 32 MET CG C 13 34.261 0.4 . 1 . . . . . 32 MET CG . 50711 1
359 . 1 . 1 32 32 MET N N 15 117.384 0.2 . 1 . . . . . 32 MET N . 50711 1
360 . 1 . 1 33 33 SER H H 1 7.928 0.04 . 1 . . . . . 33 SER H . 50711 1
361 . 1 . 1 33 33 SER HA H 1 4.435 0.04 . 1 . . . . . 33 SER HA . 50711 1
362 . 1 . 1 33 33 SER HB2 H 1 3.908 0.04 . 2 . . . . . 33 SER HB2 . 50711 1
363 . 1 . 1 33 33 SER HB3 H 1 4.008 0.04 . 2 . . . . . 33 SER HB3 . 50711 1
364 . 1 . 1 33 33 SER C C 13 175.647 0.4 . 1 . . . . . 33 SER C . 50711 1
365 . 1 . 1 33 33 SER CA C 13 58.950 0.4 . 1 . . . . . 33 SER CA . 50711 1
366 . 1 . 1 33 33 SER CB C 13 64.301 0.4 . 1 . . . . . 33 SER CB . 50711 1
367 . 1 . 1 33 33 SER N N 15 111.062 0.2 . 1 . . . . . 33 SER N . 50711 1
368 . 1 . 1 34 34 GLY H H 1 7.455 0.04 . 1 . . . . . 34 GLY H . 50711 1
369 . 1 . 1 34 34 GLY HA2 H 1 4.092 0.04 . 2 . . . . . 34 GLY HA2 . 50711 1
370 . 1 . 1 34 34 GLY HA3 H 1 4.205 0.04 . 2 . . . . . 34 GLY HA3 . 50711 1
371 . 1 . 1 34 34 GLY C C 13 174.049 0.4 . 1 . . . . . 34 GLY C . 50711 1
372 . 1 . 1 34 34 GLY CA C 13 45.383 0.4 . 1 . . . . . 34 GLY CA . 50711 1
373 . 1 . 1 34 34 GLY N N 15 109.145 0.2 . 1 . . . . . 34 GLY N . 50711 1
374 . 1 . 1 35 35 ARG H H 1 8.010 0.04 . 1 . . . . . 35 ARG H . 50711 1
375 . 1 . 1 35 35 ARG HA H 1 4.124 0.04 . 1 . . . . . 35 ARG HA . 50711 1
376 . 1 . 1 35 35 ARG HB2 H 1 1.512 0.04 . 2 . . . . . 35 ARG HB2 . 50711 1
377 . 1 . 1 35 35 ARG HB3 H 1 1.839 0.04 . 2 . . . . . 35 ARG HB3 . 50711 1
378 . 1 . 1 35 35 ARG HG2 H 1 1.515 0.04 . 2 . . . . . 35 ARG HG2 . 50711 1
379 . 1 . 1 35 35 ARG HG3 H 1 1.589 0.04 . 2 . . . . . 35 ARG HG3 . 50711 1
380 . 1 . 1 35 35 ARG HD2 H 1 3.109 0.04 . 1 . . . . . 35 ARG HD2 . 50711 1
381 . 1 . 1 35 35 ARG HD3 H 1 3.109 0.04 . 1 . . . . . 35 ARG HD3 . 50711 1
382 . 1 . 1 35 35 ARG C C 13 175.467 0.4 . 1 . . . . . 35 ARG C . 50711 1
383 . 1 . 1 35 35 ARG CA C 13 57.190 0.4 . 1 . . . . . 35 ARG CA . 50711 1
384 . 1 . 1 35 35 ARG CB C 13 30.722 0.4 . 1 . . . . . 35 ARG CB . 50711 1
385 . 1 . 1 35 35 ARG CG C 13 27.597 0.4 . 1 . . . . . 35 ARG CG . 50711 1
386 . 1 . 1 35 35 ARG CD C 13 43.013 0.4 . 1 . . . . . 35 ARG CD . 50711 1
387 . 1 . 1 35 35 ARG N N 15 120.088 0.2 . 1 . . . . . 35 ARG N . 50711 1
388 . 1 . 1 36 36 ALA H H 1 7.047 0.04 . 1 . . . . . 36 ALA H . 50711 1
389 . 1 . 1 36 36 ALA HA H 1 4.520 0.04 . 1 . . . . . 36 ALA HA . 50711 1
390 . 1 . 1 36 36 ALA HB1 H 1 1.074 0.04 . 1 . . . . . 36 ALA HB* . 50711 1
391 . 1 . 1 36 36 ALA HB2 H 1 1.074 0.04 . 1 . . . . . 36 ALA HB* . 50711 1
392 . 1 . 1 36 36 ALA HB3 H 1 1.074 0.04 . 1 . . . . . 36 ALA HB* . 50711 1
393 . 1 . 1 36 36 ALA C C 13 175.984 0.4 . 1 . . . . . 36 ALA C . 50711 1
394 . 1 . 1 36 36 ALA CA C 13 50.145 0.4 . 1 . . . . . 36 ALA CA . 50711 1
395 . 1 . 1 36 36 ALA CB C 13 21.250 0.4 . 1 . . . . . 36 ALA CB . 50711 1
396 . 1 . 1 36 36 ALA N N 15 119.422 0.2 . 1 . . . . . 36 ALA N . 50711 1
397 . 1 . 1 37 37 SER H H 1 8.465 0.04 . 1 . . . . . 37 SER H . 50711 1
398 . 1 . 1 37 37 SER HA H 1 4.187 0.04 . 1 . . . . . 37 SER HA . 50711 1
399 . 1 . 1 37 37 SER HB2 H 1 3.773 0.04 . 1 . . . . . 37 SER HB2 . 50711 1
400 . 1 . 1 37 37 SER HB3 H 1 3.773 0.04 . 1 . . . . . 37 SER HB3 . 50711 1
401 . 1 . 1 37 37 SER C C 13 173.404 0.4 . 1 . . . . . 37 SER C . 50711 1
402 . 1 . 1 37 37 SER CA C 13 58.670 0.4 . 1 . . . . . 37 SER CA . 50711 1
403 . 1 . 1 37 37 SER CB C 13 63.333 0.4 . 1 . . . . . 37 SER CB . 50711 1
404 . 1 . 1 37 37 SER N N 15 116.582 0.2 . 1 . . . . . 37 SER N . 50711 1
405 . 1 . 1 38 38 PHE H H 1 8.648 0.04 . 1 . . . . . 38 PHE H . 50711 1
406 . 1 . 1 38 38 PHE HA H 1 4.783 0.04 . 1 . . . . . 38 PHE HA . 50711 1
407 . 1 . 1 38 38 PHE HB2 H 1 2.887 0.04 . 2 . . . . . 38 PHE HB2 . 50711 1
408 . 1 . 1 38 38 PHE HB3 H 1 3.799 0.04 . 2 . . . . . 38 PHE HB3 . 50711 1
409 . 1 . 1 38 38 PHE HD1 H 1 7.001 0.04 . 1 . . . . . 38 PHE HD1 . 50711 1
410 . 1 . 1 38 38 PHE HD2 H 1 7.001 0.04 . 1 . . . . . 38 PHE HD2 . 50711 1
411 . 1 . 1 38 38 PHE HE1 H 1 6.924 0.04 . 1 . . . . . 38 PHE HE1 . 50711 1
412 . 1 . 1 38 38 PHE HE2 H 1 6.924 0.04 . 1 . . . . . 38 PHE HE2 . 50711 1
413 . 1 . 1 38 38 PHE C C 13 174.864 0.4 . 1 . . . . . 38 PHE C . 50711 1
414 . 1 . 1 38 38 PHE CA C 13 54.361 0.4 . 1 . . . . . 38 PHE CA . 50711 1
415 . 1 . 1 38 38 PHE CB C 13 37.333 0.4 . 1 . . . . . 38 PHE CB . 50711 1
416 . 1 . 1 38 38 PHE CD1 C 13 130.304 0.4 . 1 . . . . . 38 PHE CD1 . 50711 1
417 . 1 . 1 38 38 PHE CD2 C 13 130.304 0.4 . 1 . . . . . 38 PHE CD2 . 50711 1
418 . 1 . 1 38 38 PHE CE1 C 13 130.923 0.4 . 1 . . . . . 38 PHE CE1 . 50711 1
419 . 1 . 1 38 38 PHE CE2 C 13 130.923 0.4 . 1 . . . . . 38 PHE CE2 . 50711 1
420 . 1 . 1 38 38 PHE N N 15 129.132 0.2 . 1 . . . . . 38 PHE N . 50711 1
421 . 1 . 1 39 39 GLY H H 1 8.152 0.04 . 1 . . . . . 39 GLY H . 50711 1
422 . 1 . 1 39 39 GLY C C 13 173.170 0.4 . 1 . . . . . 39 GLY C . 50711 1
423 . 1 . 1 39 39 GLY CA C 13 44.998 0.4 . 1 . . . . . 39 GLY CA . 50711 1
424 . 1 . 1 39 39 GLY N N 15 109.965 0.2 . 1 . . . . . 39 GLY N . 50711 1
425 . 1 . 1 40 40 GLU C C 13 177.669 0.4 . 1 . . . . . 40 GLU C . 50711 1
426 . 1 . 1 40 40 GLU CA C 13 60.376 0.4 . 1 . . . . . 40 GLU CA . 50711 1
427 . 1 . 1 40 40 GLU CB C 13 30.151 0.4 . 1 . . . . . 40 GLU CB . 50711 1
428 . 1 . 1 41 41 LYS H H 1 8.292 0.04 . 1 . . . . . 41 LYS H . 50711 1
429 . 1 . 1 41 41 LYS HA H 1 3.885 0.04 . 1 . . . . . 41 LYS HA . 50711 1
430 . 1 . 1 41 41 LYS HB2 H 1 1.719 0.04 . 2 . . . . . 41 LYS HB2 . 50711 1
431 . 1 . 1 41 41 LYS HB3 H 1 1.817 0.04 . 2 . . . . . 41 LYS HB3 . 50711 1
432 . 1 . 1 41 41 LYS HG2 H 1 1.390 0.04 . 2 . . . . . 41 LYS HG2 . 50711 1
433 . 1 . 1 41 41 LYS HG3 H 1 1.540 0.04 . 2 . . . . . 41 LYS HG3 . 50711 1
434 . 1 . 1 41 41 LYS HD2 H 1 1.634 0.04 . 1 . . . . . 41 LYS HD2 . 50711 1
435 . 1 . 1 41 41 LYS HD3 H 1 1.634 0.04 . 1 . . . . . 41 LYS HD3 . 50711 1
436 . 1 . 1 41 41 LYS HE2 H 1 2.941 0.04 . 1 . . . . . 41 LYS HE2 . 50711 1
437 . 1 . 1 41 41 LYS HE3 H 1 2.941 0.04 . 1 . . . . . 41 LYS HE3 . 50711 1
438 . 1 . 1 41 41 LYS C C 13 180.160 0.4 . 1 . . . . . 41 LYS C . 50711 1
439 . 1 . 1 41 41 LYS CA C 13 59.565 0.4 . 1 . . . . . 41 LYS CA . 50711 1
440 . 1 . 1 41 41 LYS CB C 13 31.528 0.4 . 1 . . . . . 41 LYS CB . 50711 1
441 . 1 . 1 41 41 LYS CG C 13 25.521 0.4 . 1 . . . . . 41 LYS CG . 50711 1
442 . 1 . 1 41 41 LYS CD C 13 29.081 0.4 . 1 . . . . . 41 LYS CD . 50711 1
443 . 1 . 1 41 41 LYS CE C 13 42.098 0.4 . 1 . . . . . 41 LYS CE . 50711 1
444 . 1 . 1 41 41 LYS N N 15 117.401 0.2 . 1 . . . . . 41 LYS N . 50711 1
445 . 1 . 1 42 42 ALA H H 1 7.880 0.04 . 1 . . . . . 42 ALA H . 50711 1
446 . 1 . 1 42 42 ALA HA H 1 4.124 0.04 . 1 . . . . . 42 ALA HA . 50711 1
447 . 1 . 1 42 42 ALA HB1 H 1 1.505 0.04 . 1 . . . . . 42 ALA HB* . 50711 1
448 . 1 . 1 42 42 ALA HB2 H 1 1.505 0.04 . 1 . . . . . 42 ALA HB* . 50711 1
449 . 1 . 1 42 42 ALA HB3 H 1 1.505 0.04 . 1 . . . . . 42 ALA HB* . 50711 1
450 . 1 . 1 42 42 ALA C C 13 179.296 0.4 . 1 . . . . . 42 ALA C . 50711 1
451 . 1 . 1 42 42 ALA CA C 13 54.917 0.4 . 1 . . . . . 42 ALA CA . 50711 1
452 . 1 . 1 42 42 ALA CB C 13 17.736 0.4 . 1 . . . . . 42 ALA CB . 50711 1
453 . 1 . 1 42 42 ALA N N 15 122.270 0.2 . 1 . . . . . 42 ALA N . 50711 1
454 . 1 . 1 43 43 ALA H H 1 8.060 0.04 . 1 . . . . . 43 ALA H . 50711 1
455 . 1 . 1 43 43 ALA HA H 1 4.053 0.04 . 1 . . . . . 43 ALA HA . 50711 1
456 . 1 . 1 43 43 ALA HB1 H 1 1.294 0.04 . 1 . . . . . 43 ALA HB* . 50711 1
457 . 1 . 1 43 43 ALA HB2 H 1 1.294 0.04 . 1 . . . . . 43 ALA HB* . 50711 1
458 . 1 . 1 43 43 ALA HB3 H 1 1.294 0.04 . 1 . . . . . 43 ALA HB* . 50711 1
459 . 1 . 1 43 43 ALA C C 13 178.552 0.4 . 1 . . . . . 43 ALA C . 50711 1
460 . 1 . 1 43 43 ALA CA C 13 55.556 0.4 . 1 . . . . . 43 ALA CA . 50711 1
461 . 1 . 1 43 43 ALA CB C 13 17.319 0.4 . 1 . . . . . 43 ALA CB . 50711 1
462 . 1 . 1 43 43 ALA N N 15 119.138 0.2 . 1 . . . . . 43 ALA N . 50711 1
463 . 1 . 1 44 44 ARG H H 1 8.091 0.04 . 1 . . . . . 44 ARG H . 50711 1
464 . 1 . 1 44 44 ARG HA H 1 4.147 0.04 . 1 . . . . . 44 ARG HA . 50711 1
465 . 1 . 1 44 44 ARG HB2 H 1 1.895 0.04 . 2 . . . . . 44 ARG HB2 . 50711 1
466 . 1 . 1 44 44 ARG HB3 H 1 1.956 0.04 . 2 . . . . . 44 ARG HB3 . 50711 1
467 . 1 . 1 44 44 ARG HG2 H 1 1.602 0.04 . 2 . . . . . 44 ARG HG2 . 50711 1
468 . 1 . 1 44 44 ARG HG3 H 1 2.095 0.04 . 2 . . . . . 44 ARG HG3 . 50711 1
469 . 1 . 1 44 44 ARG HD2 H 1 3.055 0.04 . 2 . . . . . 44 ARG HD2 . 50711 1
470 . 1 . 1 44 44 ARG HD3 H 1 3.420 0.04 . 2 . . . . . 44 ARG HD3 . 50711 1
471 . 1 . 1 44 44 ARG HE H 1 8.575 0.04 . 1 . . . . . 44 ARG HE . 50711 1
472 . 1 . 1 44 44 ARG C C 13 179.757 0.4 . 1 . . . . . 44 ARG C . 50711 1
473 . 1 . 1 44 44 ARG CA C 13 58.273 0.4 . 1 . . . . . 44 ARG CA . 50711 1
474 . 1 . 1 44 44 ARG CB C 13 32.191 0.4 . 1 . . . . . 44 ARG CB . 50711 1
475 . 1 . 1 44 44 ARG CG C 13 25.569 0.4 . 1 . . . . . 44 ARG CG . 50711 1
476 . 1 . 1 44 44 ARG CD C 13 43.544 0.4 . 1 . . . . . 44 ARG CD . 50711 1
477 . 1 . 1 44 44 ARG N N 15 114.518 0.2 . 1 . . . . . 44 ARG N . 50711 1
478 . 1 . 1 44 44 ARG NE N 15 87.836 0.2 . 1 . . . . . 44 ARG NE . 50711 1
479 . 1 . 1 45 45 ARG H H 1 7.821 0.04 . 1 . . . . . 45 ARG H . 50711 1
480 . 1 . 1 45 45 ARG HA H 1 4.046 0.04 . 1 . . . . . 45 ARG HA . 50711 1
481 . 1 . 1 45 45 ARG HB2 H 1 1.886 0.04 . 2 . . . . . 45 ARG HB2 . 50711 1
482 . 1 . 1 45 45 ARG HB3 H 1 2.019 0.04 . 2 . . . . . 45 ARG HB3 . 50711 1
483 . 1 . 1 45 45 ARG HG2 H 1 1.589 0.04 . 2 . . . . . 45 ARG HG2 . 50711 1
484 . 1 . 1 45 45 ARG HG3 H 1 1.686 0.04 . 2 . . . . . 45 ARG HG3 . 50711 1
485 . 1 . 1 45 45 ARG HD2 H 1 3.054 0.04 . 2 . . . . . 45 ARG HD2 . 50711 1
486 . 1 . 1 45 45 ARG HD3 H 1 3.183 0.04 . 2 . . . . . 45 ARG HD3 . 50711 1
487 . 1 . 1 45 45 ARG C C 13 179.937 0.4 . 1 . . . . . 45 ARG C . 50711 1
488 . 1 . 1 45 45 ARG CA C 13 59.480 0.4 . 1 . . . . . 45 ARG CA . 50711 1
489 . 1 . 1 45 45 ARG CB C 13 29.459 0.4 . 1 . . . . . 45 ARG CB . 50711 1
490 . 1 . 1 45 45 ARG CG C 13 27.048 0.4 . 1 . . . . . 45 ARG CG . 50711 1
491 . 1 . 1 45 45 ARG CD C 13 42.786 0.4 . 1 . . . . . 45 ARG CD . 50711 1
492 . 1 . 1 45 45 ARG N N 15 119.373 0.2 . 1 . . . . . 45 ARG N . 50711 1
493 . 1 . 1 46 46 ILE H H 1 8.722 0.04 . 1 . . . . . 46 ILE H . 50711 1
494 . 1 . 1 46 46 ILE HA H 1 3.699 0.04 . 1 . . . . . 46 ILE HA . 50711 1
495 . 1 . 1 46 46 ILE HB H 1 2.047 0.04 . 1 . . . . . 46 ILE HB . 50711 1
496 . 1 . 1 46 46 ILE HG12 H 1 1.204 0.04 . 2 . . . . . 46 ILE HG12 . 50711 1
497 . 1 . 1 46 46 ILE HG13 H 1 1.944 0.04 . 2 . . . . . 46 ILE HG13 . 50711 1
498 . 1 . 1 46 46 ILE HG21 H 1 1.060 0.04 . 1 . . . . . 46 ILE HG2* . 50711 1
499 . 1 . 1 46 46 ILE HG22 H 1 1.060 0.04 . 1 . . . . . 46 ILE HG2* . 50711 1
500 . 1 . 1 46 46 ILE HG23 H 1 1.060 0.04 . 1 . . . . . 46 ILE HG2* . 50711 1
501 . 1 . 1 46 46 ILE HD11 H 1 0.709 0.04 . 1 . . . . . 46 ILE HD1* . 50711 1
502 . 1 . 1 46 46 ILE HD12 H 1 0.709 0.04 . 1 . . . . . 46 ILE HD1* . 50711 1
503 . 1 . 1 46 46 ILE HD13 H 1 0.709 0.04 . 1 . . . . . 46 ILE HD1* . 50711 1
504 . 1 . 1 46 46 ILE C C 13 177.991 0.4 . 1 . . . . . 46 ILE C . 50711 1
505 . 1 . 1 46 46 ILE CA C 13 65.749 0.4 . 1 . . . . . 46 ILE CA . 50711 1
506 . 1 . 1 46 46 ILE CB C 13 38.054 0.4 . 1 . . . . . 46 ILE CB . 50711 1
507 . 1 . 1 46 46 ILE CG1 C 13 30.662 0.4 . 1 . . . . . 46 ILE CG1 . 50711 1
508 . 1 . 1 46 46 ILE CG2 C 13 18.149 0.4 . 1 . . . . . 46 ILE CG2 . 50711 1
509 . 1 . 1 46 46 ILE CD1 C 13 14.378 0.4 . 1 . . . . . 46 ILE CD1 . 50711 1
510 . 1 . 1 46 46 ILE N N 15 123.619 0.2 . 1 . . . . . 46 ILE N . 50711 1
511 . 1 . 1 47 47 GLU H H 1 7.971 0.04 . 1 . . . . . 47 GLU H . 50711 1
512 . 1 . 1 47 47 GLU HA H 1 3.865 0.04 . 1 . . . . . 47 GLU HA . 50711 1
513 . 1 . 1 47 47 GLU HB2 H 1 1.643 0.04 . 2 . . . . . 47 GLU HB2 . 50711 1
514 . 1 . 1 47 47 GLU HB3 H 1 2.369 0.04 . 2 . . . . . 47 GLU HB3 . 50711 1
515 . 1 . 1 47 47 GLU HG2 H 1 2.282 0.04 . 2 . . . . . 47 GLU HG2 . 50711 1
516 . 1 . 1 47 47 GLU HG3 H 1 2.631 0.04 . 2 . . . . . 47 GLU HG3 . 50711 1
517 . 1 . 1 47 47 GLU C C 13 179.177 0.4 . 1 . . . . . 47 GLU C . 50711 1
518 . 1 . 1 47 47 GLU CA C 13 58.978 0.4 . 1 . . . . . 47 GLU CA . 50711 1
519 . 1 . 1 47 47 GLU CB C 13 29.046 0.4 . 1 . . . . . 47 GLU CB . 50711 1
520 . 1 . 1 47 47 GLU CG C 13 36.297 0.4 . 1 . . . . . 47 GLU CG . 50711 1
521 . 1 . 1 47 47 GLU N N 15 118.439 0.2 . 1 . . . . . 47 GLU N . 50711 1
522 . 1 . 1 48 48 GLN H H 1 7.458 0.04 . 1 . . . . . 48 GLN H . 50711 1
523 . 1 . 1 48 48 GLN HA H 1 4.007 0.04 . 1 . . . . . 48 GLN HA . 50711 1
524 . 1 . 1 48 48 GLN HB2 H 1 2.092 0.04 . 2 . . . . . 48 GLN HB2 . 50711 1
525 . 1 . 1 48 48 GLN HB3 H 1 2.178 0.04 . 2 . . . . . 48 GLN HB3 . 50711 1
526 . 1 . 1 48 48 GLN HG2 H 1 2.389 0.04 . 2 . . . . . 48 GLN HG2 . 50711 1
527 . 1 . 1 48 48 GLN HG3 H 1 2.556 0.04 . 2 . . . . . 48 GLN HG3 . 50711 1
528 . 1 . 1 48 48 GLN HE21 H 1 6.716 0.04 . 2 . . . . . 48 GLN HE21 . 50711 1
529 . 1 . 1 48 48 GLN HE22 H 1 7.422 0.04 . 2 . . . . . 48 GLN HE22 . 50711 1
530 . 1 . 1 48 48 GLN C C 13 179.269 0.4 . 1 . . . . . 48 GLN C . 50711 1
531 . 1 . 1 48 48 GLN CA C 13 58.340 0.4 . 1 . . . . . 48 GLN CA . 50711 1
532 . 1 . 1 48 48 GLN CB C 13 28.527 0.4 . 1 . . . . . 48 GLN CB . 50711 1
533 . 1 . 1 48 48 GLN CG C 13 33.910 0.4 . 1 . . . . . 48 GLN CG . 50711 1
534 . 1 . 1 48 48 GLN N N 15 115.364 0.2 . 1 . . . . . 48 GLN N . 50711 1
535 . 1 . 1 48 48 GLN NE2 N 15 111.509 0.2 . 1 . . . . . 48 GLN NE2 . 50711 1
536 . 1 . 1 49 49 THR H H 1 8.428 0.04 . 1 . . . . . 49 THR H . 50711 1
537 . 1 . 1 49 49 THR HA H 1 3.639 0.04 . 1 . . . . . 49 THR HA . 50711 1
538 . 1 . 1 49 49 THR HB H 1 3.693 0.04 . 1 . . . . . 49 THR HB . 50711 1
539 . 1 . 1 49 49 THR HG21 H 1 0.362 0.04 . 1 . . . . . 49 THR HG2* . 50711 1
540 . 1 . 1 49 49 THR HG22 H 1 0.362 0.04 . 1 . . . . . 49 THR HG2* . 50711 1
541 . 1 . 1 49 49 THR HG23 H 1 0.362 0.04 . 1 . . . . . 49 THR HG2* . 50711 1
542 . 1 . 1 49 49 THR C C 13 175.673 0.4 . 1 . . . . . 49 THR C . 50711 1
543 . 1 . 1 49 49 THR CA C 13 66.484 0.4 . 1 . . . . . 49 THR CA . 50711 1
544 . 1 . 1 49 49 THR CB C 13 69.271 0.4 . 1 . . . . . 49 THR CB . 50711 1
545 . 1 . 1 49 49 THR CG2 C 13 20.618 0.4 . 1 . . . . . 49 THR CG2 . 50711 1
546 . 1 . 1 49 49 THR N N 15 116.757 0.2 . 1 . . . . . 49 THR N . 50711 1
547 . 1 . 1 50 50 TYR H H 1 7.567 0.04 . 1 . . . . . 50 TYR H . 50711 1
548 . 1 . 1 50 50 TYR HA H 1 4.611 0.04 . 1 . . . . . 50 TYR HA . 50711 1
549 . 1 . 1 50 50 TYR HB2 H 1 2.255 0.04 . 2 . . . . . 50 TYR HB2 . 50711 1
550 . 1 . 1 50 50 TYR HB3 H 1 3.503 0.04 . 2 . . . . . 50 TYR HB3 . 50711 1
551 . 1 . 1 50 50 TYR HD1 H 1 7.504 0.04 . 1 . . . . . 50 TYR HD1 . 50711 1
552 . 1 . 1 50 50 TYR HD2 H 1 7.504 0.04 . 1 . . . . . 50 TYR HD2 . 50711 1
553 . 1 . 1 50 50 TYR HE1 H 1 6.820 0.04 . 1 . . . . . 50 TYR HE1 . 50711 1
554 . 1 . 1 50 50 TYR HE2 H 1 6.820 0.04 . 1 . . . . . 50 TYR HE2 . 50711 1
555 . 1 . 1 50 50 TYR C C 13 174.807 0.4 . 1 . . . . . 50 TYR C . 50711 1
556 . 1 . 1 50 50 TYR CA C 13 59.233 0.4 . 1 . . . . . 50 TYR CA . 50711 1
557 . 1 . 1 50 50 TYR CB C 13 37.901 0.4 . 1 . . . . . 50 TYR CB . 50711 1
558 . 1 . 1 50 50 TYR CD1 C 13 133.390 0.4 . 1 . . . . . 50 TYR CD1 . 50711 1
559 . 1 . 1 50 50 TYR CD2 C 13 133.390 0.4 . 1 . . . . . 50 TYR CD2 . 50711 1
560 . 1 . 1 50 50 TYR CE1 C 13 117.909 0.4 . 1 . . . . . 50 TYR CE1 . 50711 1
561 . 1 . 1 50 50 TYR CE2 C 13 117.909 0.4 . 1 . . . . . 50 TYR CE2 . 50711 1
562 . 1 . 1 50 50 TYR N N 15 115.275 0.2 . 1 . . . . . 50 TYR N . 50711 1
563 . 1 . 1 51 51 GLY H H 1 7.412 0.04 . 1 . . . . . 51 GLY H . 50711 1
564 . 1 . 1 51 51 GLY HA2 H 1 3.831 0.04 . 2 . . . . . 51 GLY HA2 . 50711 1
565 . 1 . 1 51 51 GLY HA3 H 1 3.922 0.04 . 2 . . . . . 51 GLY HA3 . 50711 1
566 . 1 . 1 51 51 GLY C C 13 175.506 0.4 . 1 . . . . . 51 GLY C . 50711 1
567 . 1 . 1 51 51 GLY CA C 13 46.942 0.4 . 1 . . . . . 51 GLY CA . 50711 1
568 . 1 . 1 51 51 GLY N N 15 108.606 0.2 . 1 . . . . . 51 GLY N . 50711 1
569 . 1 . 1 52 52 MET H H 1 8.334 0.04 . 1 . . . . . 52 MET H . 50711 1
570 . 1 . 1 52 52 MET HA H 1 3.818 0.04 . 1 . . . . . 52 MET HA . 50711 1
571 . 1 . 1 52 52 MET HB2 H 1 1.054 0.04 . 1 . . . . . 52 MET HB2 . 50711 1
572 . 1 . 1 52 52 MET HB3 H 1 1.054 0.04 . 1 . . . . . 52 MET HB3 . 50711 1
573 . 1 . 1 52 52 MET HG2 H 1 -0.528 0.04 . 1 . . . . . 52 MET HG2 . 50711 1
574 . 1 . 1 52 52 MET HG3 H 1 -0.528 0.04 . 1 . . . . . 52 MET HG3 . 50711 1
575 . 1 . 1 52 52 MET C C 13 173.210 0.4 . 1 . . . . . 52 MET C . 50711 1
576 . 1 . 1 52 52 MET CA C 13 53.535 0.4 . 1 . . . . . 52 MET CA . 50711 1
577 . 1 . 1 52 52 MET CB C 13 30.973 0.4 . 1 . . . . . 52 MET CB . 50711 1
578 . 1 . 1 52 52 MET CG C 13 31.061 0.4 . 1 . . . . . 52 MET CG . 50711 1
579 . 1 . 1 52 52 MET N N 15 119.006 0.2 . 1 . . . . . 52 MET N . 50711 1
580 . 1 . 1 53 53 PRO HA H 1 4.186 0.04 . 1 . . . . . 53 PRO HA . 50711 1
581 . 1 . 1 53 53 PRO HB2 H 1 1.711 0.04 . 2 . . . . . 53 PRO HB2 . 50711 1
582 . 1 . 1 53 53 PRO HB3 H 1 2.288 0.04 . 2 . . . . . 53 PRO HB3 . 50711 1
583 . 1 . 1 53 53 PRO HG2 H 1 2.035 0.04 . 2 . . . . . 53 PRO HG2 . 50711 1
584 . 1 . 1 53 53 PRO HG3 H 1 2.157 0.04 . 2 . . . . . 53 PRO HG3 . 50711 1
585 . 1 . 1 53 53 PRO HD2 H 1 2.963 0.04 . 2 . . . . . 53 PRO HD2 . 50711 1
586 . 1 . 1 53 53 PRO HD3 H 1 3.732 0.04 . 2 . . . . . 53 PRO HD3 . 50711 1
587 . 1 . 1 53 53 PRO C C 13 175.941 0.4 . 1 . . . . . 53 PRO C . 50711 1
588 . 1 . 1 53 53 PRO CA C 13 62.573 0.4 . 1 . . . . . 53 PRO CA . 50711 1
589 . 1 . 1 53 53 PRO CB C 13 31.780 0.4 . 1 . . . . . 53 PRO CB . 50711 1
590 . 1 . 1 53 53 PRO CG C 13 27.878 0.4 . 1 . . . . . 53 PRO CG . 50711 1
591 . 1 . 1 53 53 PRO CD C 13 49.901 0.4 . 1 . . . . . 53 PRO CD . 50711 1
592 . 1 . 1 54 54 GLU H H 1 8.381 0.04 . 1 . . . . . 54 GLU H . 50711 1
593 . 1 . 1 54 54 GLU HA H 1 3.867 0.04 . 1 . . . . . 54 GLU HA . 50711 1
594 . 1 . 1 54 54 GLU HB2 H 1 1.814 0.04 . 2 . . . . . 54 GLU HB2 . 50711 1
595 . 1 . 1 54 54 GLU HB3 H 1 1.915 0.04 . 2 . . . . . 54 GLU HB3 . 50711 1
596 . 1 . 1 54 54 GLU HG2 H 1 2.114 0.04 . 2 . . . . . 54 GLU HG2 . 50711 1
597 . 1 . 1 54 54 GLU HG3 H 1 2.245 0.04 . 2 . . . . . 54 GLU HG3 . 50711 1
598 . 1 . 1 54 54 GLU C C 13 178.591 0.4 . 1 . . . . . 54 GLU C . 50711 1
599 . 1 . 1 54 54 GLU CA C 13 58.084 0.4 . 1 . . . . . 54 GLU CA . 50711 1
600 . 1 . 1 54 54 GLU CB C 13 29.138 0.4 . 1 . . . . . 54 GLU CB . 50711 1
601 . 1 . 1 54 54 GLU CG C 13 36.032 0.4 . 1 . . . . . 54 GLU CG . 50711 1
602 . 1 . 1 54 54 GLU N N 15 123.655 0.2 . 1 . . . . . 54 GLU N . 50711 1
603 . 1 . 1 55 55 GLY H H 1 9.138 0.04 . 1 . . . . . 55 GLY H . 50711 1
604 . 1 . 1 55 55 GLY HA2 H 1 3.486 0.04 . 2 . . . . . 55 GLY HA2 . 50711 1
605 . 1 . 1 55 55 GLY HA3 H 1 4.077 0.04 . 2 . . . . . 55 GLY HA3 . 50711 1
606 . 1 . 1 55 55 GLY C C 13 175.369 0.4 . 1 . . . . . 55 GLY C . 50711 1
607 . 1 . 1 55 55 GLY CA C 13 45.798 0.4 . 1 . . . . . 55 GLY CA . 50711 1
608 . 1 . 1 55 55 GLY N N 15 116.616 0.2 . 1 . . . . . 55 GLY N . 50711 1
609 . 1 . 1 56 56 TYR H H 1 8.092 0.04 . 1 . . . . . 56 TYR H . 50711 1
610 . 1 . 1 56 56 TYR HA H 1 3.775 0.04 . 1 . . . . . 56 TYR HA . 50711 1
611 . 1 . 1 56 56 TYR HB2 H 1 2.418 0.04 . 2 . . . . . 56 TYR HB2 . 50711 1
612 . 1 . 1 56 56 TYR HB3 H 1 3.189 0.04 . 2 . . . . . 56 TYR HB3 . 50711 1
613 . 1 . 1 56 56 TYR HD1 H 1 6.923 0.04 . 1 . . . . . 56 TYR HD1 . 50711 1
614 . 1 . 1 56 56 TYR HD2 H 1 6.923 0.04 . 1 . . . . . 56 TYR HD2 . 50711 1
615 . 1 . 1 56 56 TYR C C 13 176.900 0.4 . 1 . . . . . 56 TYR C . 50711 1
616 . 1 . 1 56 56 TYR CA C 13 61.659 0.4 . 1 . . . . . 56 TYR CA . 50711 1
617 . 1 . 1 56 56 TYR CB C 13 41.037 0.4 . 1 . . . . . 56 TYR CB . 50711 1
618 . 1 . 1 56 56 TYR CD1 C 13 133.723 0.4 . 1 . . . . . 56 TYR CD1 . 50711 1
619 . 1 . 1 56 56 TYR CD2 C 13 133.723 0.4 . 1 . . . . . 56 TYR CD2 . 50711 1
620 . 1 . 1 56 56 TYR N N 15 125.245 0.2 . 1 . . . . . 56 TYR N . 50711 1
621 . 1 . 1 57 57 LEU H H 1 9.237 0.04 . 1 . . . . . 57 LEU H . 50711 1
622 . 1 . 1 57 57 LEU HA H 1 3.615 0.04 . 1 . . . . . 57 LEU HA . 50711 1
623 . 1 . 1 57 57 LEU HB2 H 1 1.143 0.04 . 2 . . . . . 57 LEU HB2 . 50711 1
624 . 1 . 1 57 57 LEU HB3 H 1 1.501 0.04 . 2 . . . . . 57 LEU HB3 . 50711 1
625 . 1 . 1 57 57 LEU HD11 H 1 0.949 0.04 . 2 . . . . . 57 LEU HD1* . 50711 1
626 . 1 . 1 57 57 LEU HD12 H 1 0.949 0.04 . 2 . . . . . 57 LEU HD1* . 50711 1
627 . 1 . 1 57 57 LEU HD13 H 1 0.949 0.04 . 2 . . . . . 57 LEU HD1* . 50711 1
628 . 1 . 1 57 57 LEU HD21 H 1 1.134 0.04 . 2 . . . . . 57 LEU HD2* . 50711 1
629 . 1 . 1 57 57 LEU HD22 H 1 1.134 0.04 . 2 . . . . . 57 LEU HD2* . 50711 1
630 . 1 . 1 57 57 LEU HD23 H 1 1.134 0.04 . 2 . . . . . 57 LEU HD2* . 50711 1
631 . 1 . 1 57 57 LEU C C 13 173.439 0.4 . 1 . . . . . 57 LEU C . 50711 1
632 . 1 . 1 57 57 LEU CA C 13 56.085 0.4 . 1 . . . . . 57 LEU CA . 50711 1
633 . 1 . 1 57 57 LEU CB C 13 41.703 0.4 . 1 . . . . . 57 LEU CB . 50711 1
634 . 1 . 1 57 57 LEU CD1 C 13 23.966 0.4 . 2 . . . . . 57 LEU CD1 . 50711 1
635 . 1 . 1 57 57 LEU CD2 C 13 27.721 0.4 . 2 . . . . . 57 LEU CD2 . 50711 1
636 . 1 . 1 57 57 LEU N N 15 113.998 0.2 . 1 . . . . . 57 LEU N . 50711 1
637 . 1 . 1 58 58 ASP H H 1 6.836 0.04 . 1 . . . . . 58 ASP H . 50711 1
638 . 1 . 1 58 58 ASP HA H 1 4.351 0.04 . 1 . . . . . 58 ASP HA . 50711 1
639 . 1 . 1 58 58 ASP HB2 H 1 2.145 0.04 . 2 . . . . . 58 ASP HB2 . 50711 1
640 . 1 . 1 58 58 ASP HB3 H 1 2.631 0.04 . 2 . . . . . 58 ASP HB3 . 50711 1
641 . 1 . 1 58 58 ASP C C 13 175.809 0.4 . 1 . . . . . 58 ASP C . 50711 1
642 . 1 . 1 58 58 ASP CA C 13 52.756 0.4 . 1 . . . . . 58 ASP CA . 50711 1
643 . 1 . 1 58 58 ASP CB C 13 42.054 0.4 . 1 . . . . . 58 ASP CB . 50711 1
644 . 1 . 1 58 58 ASP N N 15 111.783 0.2 . 1 . . . . . 58 ASP N . 50711 1
645 . 1 . 1 59 59 ALA H H 1 6.874 0.04 . 1 . . . . . 59 ALA H . 50711 1
646 . 1 . 1 59 59 ALA HA H 1 3.872 0.04 . 1 . . . . . 59 ALA HA . 50711 1
647 . 1 . 1 59 59 ALA HB1 H 1 1.001 0.04 . 1 . . . . . 59 ALA HB* . 50711 1
648 . 1 . 1 59 59 ALA HB2 H 1 1.001 0.04 . 1 . . . . . 59 ALA HB* . 50711 1
649 . 1 . 1 59 59 ALA HB3 H 1 1.001 0.04 . 1 . . . . . 59 ALA HB* . 50711 1
650 . 1 . 1 59 59 ALA C C 13 176.719 0.4 . 1 . . . . . 59 ALA C . 50711 1
651 . 1 . 1 59 59 ALA CA C 13 52.773 0.4 . 1 . . . . . 59 ALA CA . 50711 1
652 . 1 . 1 59 59 ALA CB C 13 17.987 0.4 . 1 . . . . . 59 ALA CB . 50711 1
653 . 1 . 1 59 59 ALA N N 15 123.753 0.2 . 1 . . . . . 59 ALA N . 50711 1
654 . 1 . 1 60 60 GLU H H 1 8.279 0.04 . 1 . . . . . 60 GLU H . 50711 1
655 . 1 . 1 60 60 GLU HA H 1 3.818 0.04 . 1 . . . . . 60 GLU HA . 50711 1
656 . 1 . 1 60 60 GLU HB2 H 1 1.751 0.04 . 2 . . . . . 60 GLU HB2 . 50711 1
657 . 1 . 1 60 60 GLU HB3 H 1 1.926 0.04 . 2 . . . . . 60 GLU HB3 . 50711 1
658 . 1 . 1 60 60 GLU HG2 H 1 2.122 0.04 . 2 . . . . . 60 GLU HG2 . 50711 1
659 . 1 . 1 60 60 GLU HG3 H 1 2.206 0.04 . 2 . . . . . 60 GLU HG3 . 50711 1
660 . 1 . 1 60 60 GLU C C 13 176.614 0.4 . 1 . . . . . 60 GLU C . 50711 1
661 . 1 . 1 60 60 GLU CA C 13 56.782 0.4 . 1 . . . . . 60 GLU CA . 50711 1
662 . 1 . 1 60 60 GLU CB C 13 30.186 0.4 . 1 . . . . . 60 GLU CB . 50711 1
663 . 1 . 1 60 60 GLU CG C 13 36.280 0.4 . 1 . . . . . 60 GLU CG . 50711 1
664 . 1 . 1 60 60 GLU N N 15 122.811 0.2 . 1 . . . . . 60 GLU N . 50711 1
665 . 1 . 1 61 61 TYR H H 1 8.378 0.04 . 1 . . . . . 61 TYR H . 50711 1
666 . 1 . 1 61 61 TYR HA H 1 4.247 0.04 . 1 . . . . . 61 TYR HA . 50711 1
667 . 1 . 1 61 61 TYR HB2 H 1 2.647 0.04 . 2 . . . . . 61 TYR HB2 . 50711 1
668 . 1 . 1 61 61 TYR HB3 H 1 2.906 0.04 . 2 . . . . . 61 TYR HB3 . 50711 1
669 . 1 . 1 61 61 TYR HD1 H 1 6.985 0.04 . 1 . . . . . 61 TYR HD1 . 50711 1
670 . 1 . 1 61 61 TYR HD2 H 1 6.985 0.04 . 1 . . . . . 61 TYR HD2 . 50711 1
671 . 1 . 1 61 61 TYR HE1 H 1 6.704 0.04 . 1 . . . . . 61 TYR HE1 . 50711 1
672 . 1 . 1 61 61 TYR HE2 H 1 6.704 0.04 . 1 . . . . . 61 TYR HE2 . 50711 1
673 . 1 . 1 61 61 TYR C C 13 175.862 0.4 . 1 . . . . . 61 TYR C . 50711 1
674 . 1 . 1 61 61 TYR CA C 13 58.323 0.4 . 1 . . . . . 61 TYR CA . 50711 1
675 . 1 . 1 61 61 TYR CB C 13 38.944 0.4 . 1 . . . . . 61 TYR CB . 50711 1
676 . 1 . 1 61 61 TYR CD1 C 13 132.889 0.4 . 1 . . . . . 61 TYR CD1 . 50711 1
677 . 1 . 1 61 61 TYR CD2 C 13 132.889 0.4 . 1 . . . . . 61 TYR CD2 . 50711 1
678 . 1 . 1 61 61 TYR CE1 C 13 118.247 0.4 . 1 . . . . . 61 TYR CE1 . 50711 1
679 . 1 . 1 61 61 TYR CE2 C 13 118.247 0.4 . 1 . . . . . 61 TYR CE2 . 50711 1
680 . 1 . 1 61 61 TYR N N 15 120.934 0.2 . 1 . . . . . 61 TYR N . 50711 1
681 . 1 . 1 62 62 ALA H H 1 8.256 0.04 . 1 . . . . . 62 ALA H . 50711 1
682 . 1 . 1 62 62 ALA HA H 1 4.215 0.04 . 1 . . . . . 62 ALA HA . 50711 1
683 . 1 . 1 62 62 ALA HB1 H 1 1.270 0.04 . 1 . . . . . 62 ALA HB* . 50711 1
684 . 1 . 1 62 62 ALA HB2 H 1 1.270 0.04 . 1 . . . . . 62 ALA HB* . 50711 1
685 . 1 . 1 62 62 ALA HB3 H 1 1.270 0.04 . 1 . . . . . 62 ALA HB* . 50711 1
686 . 1 . 1 62 62 ALA C C 13 177.350 0.4 . 1 . . . . . 62 ALA C . 50711 1
687 . 1 . 1 62 62 ALA CA C 13 52.266 0.4 . 1 . . . . . 62 ALA CA . 50711 1
688 . 1 . 1 62 62 ALA CB C 13 19.412 0.4 . 1 . . . . . 62 ALA CB . 50711 1
689 . 1 . 1 62 62 ALA N N 15 125.683 0.2 . 1 . . . . . 62 ALA N . 50711 1
690 . 1 . 1 63 63 GLU H H 1 8.322 0.04 . 1 . . . . . 63 GLU H . 50711 1
691 . 1 . 1 63 63 GLU HA H 1 4.190 0.04 . 1 . . . . . 63 GLU HA . 50711 1
692 . 1 . 1 63 63 GLU HB2 H 1 1.827 0.04 . 2 . . . . . 63 GLU HB2 . 50711 1
693 . 1 . 1 63 63 GLU HB3 H 1 1.921 0.04 . 2 . . . . . 63 GLU HB3 . 50711 1
694 . 1 . 1 63 63 GLU HG2 H 1 2.153 0.04 . 2 . . . . . 63 GLU HG2 . 50711 1
695 . 1 . 1 63 63 GLU HG3 H 1 2.190 0.04 . 2 . . . . . 63 GLU HG3 . 50711 1
696 . 1 . 1 63 63 GLU C C 13 176.165 0.4 . 1 . . . . . 63 GLU C . 50711 1
697 . 1 . 1 63 63 GLU CA C 13 56.144 0.4 . 1 . . . . . 63 GLU CA . 50711 1
698 . 1 . 1 63 63 GLU CB C 13 30.448 0.4 . 1 . . . . . 63 GLU CB . 50711 1
699 . 1 . 1 63 63 GLU CG C 13 36.107 0.4 . 1 . . . . . 63 GLU CG . 50711 1
700 . 1 . 1 63 63 GLU N N 15 120.383 0.2 . 1 . . . . . 63 GLU N . 50711 1
701 . 1 . 1 64 64 GLN H H 1 8.447 0.04 . 1 . . . . . 64 GLN H . 50711 1
702 . 1 . 1 64 64 GLN HA H 1 4.501 0.04 . 1 . . . . . 64 GLN HA . 50711 1
703 . 1 . 1 64 64 GLN HB2 H 1 1.833 0.04 . 2 . . . . . 64 GLN HB2 . 50711 1
704 . 1 . 1 64 64 GLN HB3 H 1 1.999 0.04 . 2 . . . . . 64 GLN HB3 . 50711 1
705 . 1 . 1 64 64 GLN HG2 H 1 2.298 0.04 . 1 . . . . . 64 GLN HG2 . 50711 1
706 . 1 . 1 64 64 GLN HG3 H 1 2.298 0.04 . 1 . . . . . 64 GLN HG3 . 50711 1
707 . 1 . 1 64 64 GLN HE21 H 1 6.779 0.04 . 2 . . . . . 64 GLN HE21 . 50711 1
708 . 1 . 1 64 64 GLN HE22 H 1 7.455 0.04 . 2 . . . . . 64 GLN HE22 . 50711 1
709 . 1 . 1 64 64 GLN C C 13 174.181 0.4 . 1 . . . . . 64 GLN C . 50711 1
710 . 1 . 1 64 64 GLN CA C 13 53.590 0.4 . 1 . . . . . 64 GLN CA . 50711 1
711 . 1 . 1 64 64 GLN CB C 13 28.742 0.4 . 1 . . . . . 64 GLN CB . 50711 1
712 . 1 . 1 64 64 GLN CG C 13 33.373 0.4 . 1 . . . . . 64 GLN CG . 50711 1
713 . 1 . 1 64 64 GLN N N 15 122.726 0.2 . 1 . . . . . 64 GLN N . 50711 1
714 . 1 . 1 64 64 GLN NE2 N 15 112.564 0.2 . 1 . . . . . 64 GLN NE2 . 50711 1
715 . 1 . 1 65 65 PRO HA H 1 4.310 0.04 . 1 . . . . . 65 PRO HA . 50711 1
716 . 1 . 1 65 65 PRO HB2 H 1 1.834 0.04 . 2 . . . . . 65 PRO HB2 . 50711 1
717 . 1 . 1 65 65 PRO HB3 H 1 2.189 0.04 . 2 . . . . . 65 PRO HB3 . 50711 1
718 . 1 . 1 65 65 PRO HG2 H 1 1.875 0.04 . 2 . . . . . 65 PRO HG2 . 50711 1
719 . 1 . 1 65 65 PRO HG3 H 1 1.952 0.04 . 2 . . . . . 65 PRO HG3 . 50711 1
720 . 1 . 1 65 65 PRO HD2 H 1 3.563 0.04 . 2 . . . . . 65 PRO HD2 . 50711 1
721 . 1 . 1 65 65 PRO HD3 H 1 3.692 0.04 . 2 . . . . . 65 PRO HD3 . 50711 1
722 . 1 . 1 65 65 PRO C C 13 177.621 0.4 . 1 . . . . . 65 PRO C . 50711 1
723 . 1 . 1 65 65 PRO CA C 13 63.605 0.4 . 1 . . . . . 65 PRO CA . 50711 1
724 . 1 . 1 65 65 PRO CB C 13 31.921 0.4 . 1 . . . . . 65 PRO CB . 50711 1
725 . 1 . 1 65 65 PRO CG C 13 27.384 0.4 . 1 . . . . . 65 PRO CG . 50711 1
726 . 1 . 1 65 65 PRO CD C 13 50.642 0.4 . 1 . . . . . 65 PRO CD . 50711 1
727 . 1 . 1 66 66 GLY H H 1 8.533 0.04 . 1 . . . . . 66 GLY H . 50711 1
728 . 1 . 1 66 66 GLY HA2 H 1 3.846 0.04 . 2 . . . . . 66 GLY HA2 . 50711 1
729 . 1 . 1 66 66 GLY HA3 H 1 3.940 0.04 . 2 . . . . . 66 GLY HA3 . 50711 1
730 . 1 . 1 66 66 GLY C C 13 174.486 0.4 . 1 . . . . . 66 GLY C . 50711 1
731 . 1 . 1 66 66 GLY CA C 13 45.376 0.4 . 1 . . . . . 66 GLY CA . 50711 1
732 . 1 . 1 66 66 GLY N N 15 109.852 0.2 . 1 . . . . . 66 GLY N . 50711 1
733 . 1 . 1 67 67 SER H H 1 8.033 0.04 . 1 . . . . . 67 SER H . 50711 1
734 . 1 . 1 67 67 SER HA H 1 4.356 0.04 . 1 . . . . . 67 SER HA . 50711 1
735 . 1 . 1 67 67 SER HB2 H 1 3.757 0.04 . 2 . . . . . 67 SER HB2 . 50711 1
736 . 1 . 1 67 67 SER HB3 H 1 3.824 0.04 . 2 . . . . . 67 SER HB3 . 50711 1
737 . 1 . 1 67 67 SER C C 13 174.759 0.4 . 1 . . . . . 67 SER C . 50711 1
738 . 1 . 1 67 67 SER CA C 13 58.440 0.4 . 1 . . . . . 67 SER CA . 50711 1
739 . 1 . 1 67 67 SER CB C 13 63.918 0.4 . 1 . . . . . 67 SER CB . 50711 1
740 . 1 . 1 67 67 SER N N 15 115.254 0.2 . 1 . . . . . 67 SER N . 50711 1
741 . 1 . 1 68 68 SER H H 1 8.290 0.04 . 1 . . . . . 68 SER H . 50711 1
742 . 1 . 1 68 68 SER C C 13 174.354 0.4 . 1 . . . . . 68 SER C . 50711 1
743 . 1 . 1 68 68 SER CB C 13 63.688 0.4 . 1 . . . . . 68 SER CB . 50711 1
744 . 1 . 1 68 68 SER N N 15 117.388 0.2 . 1 . . . . . 68 SER N . 50711 1
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