Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
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 36075
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 0.03
_Assigned_chem_shift_list.Chem_shift_13C_err 0.1
_Assigned_chem_shift_list.Chem_shift_15N_err 0.2
_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 NOESY' 1 $sample_1 isotropic 36075 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.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 2 2 MET H H 1 7.34 0.03 . 1 . . . . A 2 MET H . 36075 1
2 . 1 1 2 2 MET HA H 1 4.33 0.03 . 1 . . . . A 2 MET HA . 36075 1
3 . 1 1 2 2 MET HB2 H 1 1.54 0.03 . 1 . . . . A 2 MET HB2 . 36075 1
4 . 1 1 2 2 MET HB3 H 1 1.54 0.03 . 1 . . . . A 2 MET HB3 . 36075 1
5 . 1 1 2 2 MET HG2 H 1 2.12 0.03 . 1 . . . . A 2 MET HG2 . 36075 1
6 . 1 1 2 2 MET HG3 H 1 2.12 0.03 . 1 . . . . A 2 MET HG3 . 36075 1
7 . 1 1 2 2 MET HE1 H 1 1.732 0.03 . 1 . . . . A 2 MET HE1 . 36075 1
8 . 1 1 2 2 MET HE2 H 1 1.732 0.03 . 1 . . . . A 2 MET HE2 . 36075 1
9 . 1 1 2 2 MET HE3 H 1 1.732 0.03 . 1 . . . . A 2 MET HE3 . 36075 1
10 . 1 1 2 2 MET C C 13 170.12 0.1 . 1 . . . . A 2 MET C . 36075 1
11 . 1 1 2 2 MET CA C 13 55.33 0.1 . 1 . . . . A 2 MET CA . 36075 1
12 . 1 1 2 2 MET CB C 13 33.52 0.1 . 1 . . . . A 2 MET CB . 36075 1
13 . 1 1 2 2 MET CG C 13 31.02 0.1 . 1 . . . . A 2 MET CG . 36075 1
14 . 1 1 2 2 MET CE C 13 15.41 0.1 . 1 . . . . A 2 MET CE . 36075 1
15 . 1 1 2 2 MET N N 15 119.12 0.2 . 1 . . . . A 2 MET N . 36075 1
16 . 1 1 3 3 CYS H H 1 8.64 0.03 . 1 . . . . A 3 CYS H . 36075 1
17 . 1 1 3 3 CYS HA H 1 3.63 0.03 . 1 . . . . A 3 CYS HA . 36075 1
18 . 1 1 3 3 CYS HB2 H 1 1.80 0.03 . 1 . . . . A 3 CYS HB2 . 36075 1
19 . 1 1 3 3 CYS HB3 H 1 1.80 0.03 . 1 . . . . A 3 CYS HB3 . 36075 1
20 . 1 1 3 3 CYS C C 13 175.21 0.1 . 1 . . . . A 3 CYS C . 36075 1
21 . 1 1 3 3 CYS CA C 13 58.32 0.1 . 1 . . . . A 3 CYS CA . 36075 1
22 . 1 1 3 3 CYS CB C 13 31.12 0.1 . 1 . . . . A 3 CYS CB . 36075 1
23 . 1 1 3 3 CYS N N 15 122.54 0.2 . 1 . . . . A 3 CYS N . 36075 1
24 . 1 1 4 4 ASP H H 1 7.98 0.03 . 1 . . . . A 4 ASP H . 36075 1
25 . 1 1 4 4 ASP HA H 1 4.23 0.03 . 1 . . . . A 4 ASP HA . 36075 1
26 . 1 1 4 4 ASP HB2 H 1 2.45 0.03 . 1 . . . . A 4 ASP HB2 . 36075 1
27 . 1 1 4 4 ASP HB3 H 1 2.45 0.03 . 1 . . . . A 4 ASP HB3 . 36075 1
28 . 1 1 4 4 ASP C C 13 175.53 0.1 . 1 . . . . A 4 ASP C . 36075 1
29 . 1 1 4 4 ASP CA C 13 55.32 0.1 . 1 . . . . A 4 ASP CA . 36075 1
30 . 1 1 4 4 ASP CB C 13 39.45 0.1 . 1 . . . . A 4 ASP CB . 36075 1
31 . 1 1 4 4 ASP N N 15 123.55 0.2 . 1 . . . . A 4 ASP N . 36075 1
32 . 1 1 5 5 VAL H H 1 9.12 0.03 . 1 . . . . A 5 VAL H . 36075 1
33 . 1 1 5 5 VAL HA H 1 4.21 0.03 . 1 . . . . A 5 VAL HA . 36075 1
34 . 1 1 5 5 VAL HB H 1 1.98 0.03 . 1 . . . . A 5 VAL HB . 36075 1
35 . 1 1 5 5 VAL HG11 H 1 1.21 0.03 . 1 . . . . A 5 VAL HG11 . 36075 1
36 . 1 1 5 5 VAL HG12 H 1 1.21 0.03 . 1 . . . . A 5 VAL HG12 . 36075 1
37 . 1 1 5 5 VAL HG13 H 1 1.21 0.03 . 1 . . . . A 5 VAL HG13 . 36075 1
38 . 1 1 5 5 VAL HG21 H 1 1.32 0.03 . 1 . . . . A 5 VAL HG21 . 36075 1
39 . 1 1 5 5 VAL HG22 H 1 1.32 0.03 . 1 . . . . A 5 VAL HG22 . 36075 1
40 . 1 1 5 5 VAL HG23 H 1 1.32 0.03 . 1 . . . . A 5 VAL HG23 . 36075 1
41 . 1 1 5 5 VAL C C 13 180.23 0.1 . 1 . . . . A 5 VAL C . 36075 1
42 . 1 1 5 5 VAL CA C 13 63.12 0.1 . 1 . . . . A 5 VAL CA . 36075 1
43 . 1 1 5 5 VAL CB C 13 30.14 0.1 . 1 . . . . A 5 VAL CB . 36075 1
44 . 1 1 5 5 VAL CG1 C 13 23.12 0.1 . 2 . . . . A 5 VAL CG1 . 36075 1
45 . 1 1 5 5 VAL CG2 C 13 22.19 0.1 . 2 . . . . A 5 VAL CG2 . 36075 1
46 . 1 1 5 5 VAL N N 15 119.01 0.2 . 1 . . . . A 5 VAL N . 36075 1
47 . 1 1 6 6 CYS H H 1 7.71 0.03 . 1 . . . . A 6 CYS H . 36075 1
48 . 1 1 6 6 CYS HA H 1 4.65 0.03 . 1 . . . . A 6 CYS HA . 36075 1
49 . 1 1 6 6 CYS HB2 H 1 2.98 0.03 . 1 . . . . A 6 CYS HB2 . 36075 1
50 . 1 1 6 6 CYS HB3 H 1 2.98 0.03 . 1 . . . . A 6 CYS HB3 . 36075 1
51 . 1 1 6 6 CYS C C 13 170.39 0.1 . 1 . . . . A 6 CYS C . 36075 1
52 . 1 1 6 6 CYS CA C 13 58.11 0.1 . 1 . . . . A 6 CYS CA . 36075 1
53 . 1 1 6 6 CYS CB C 13 30.12 0.1 . 1 . . . . A 6 CYS CB . 36075 1
54 . 1 1 6 6 CYS N N 15 117.1 0.2 . 1 . . . . A 6 CYS N . 36075 1
55 . 1 1 7 7 GLU H H 1 8.45 0.03 . 1 . . . . A 7 GLU H . 36075 1
56 . 1 1 7 7 GLU HA H 1 3.87 0.03 . 1 . . . . A 7 GLU HA . 36075 1
57 . 1 1 7 7 GLU HB2 H 1 2.22 0.03 . 1 . . . . A 7 GLU HB2 . 36075 1
58 . 1 1 7 7 GLU HB3 H 1 2.22 0.03 . 1 . . . . A 7 GLU HB3 . 36075 1
59 . 1 1 7 7 GLU HG2 H 1 1.98 0.03 . 1 . . . . A 7 GLU HG2 . 36075 1
60 . 1 1 7 7 GLU HG3 H 1 1.98 0.03 . 1 . . . . A 7 GLU HG3 . 36075 1
61 . 1 1 7 7 GLU C C 13 172.35 0.1 . 1 . . . . A 7 GLU C . 36075 1
62 . 1 1 7 7 GLU CA C 13 57.64 0.1 . 1 . . . . A 7 GLU CA . 36075 1
63 . 1 1 7 7 GLU CB C 13 30.21 0.1 . 1 . . . . A 7 GLU CB . 36075 1
64 . 1 1 7 7 GLU CG C 13 35.41 0.1 . 1 . . . . A 7 GLU CG . 36075 1
65 . 1 1 7 7 GLU N N 15 120.25 0.2 . 1 . . . . A 7 GLU N . 36075 1
66 . 1 1 8 8 VAL H H 1 8.32 0.03 . 1 . . . . A 8 VAL H . 36075 1
67 . 1 1 8 8 VAL HA H 1 4.66 0.03 . 1 . . . . A 8 VAL HA . 36075 1
68 . 1 1 8 8 VAL HB H 1 2.36 0.03 . 1 . . . . A 8 VAL HB . 36075 1
69 . 1 1 8 8 VAL HG11 H 1 0.525 0.03 . 1 . . . . A 8 VAL HG11 . 36075 1
70 . 1 1 8 8 VAL HG12 H 1 0.525 0.03 . 1 . . . . A 8 VAL HG12 . 36075 1
71 . 1 1 8 8 VAL HG13 H 1 0.525 0.03 . 1 . . . . A 8 VAL HG13 . 36075 1
72 . 1 1 8 8 VAL HG21 H 1 0.323 0.03 . 1 . . . . A 8 VAL HG21 . 36075 1
73 . 1 1 8 8 VAL HG22 H 1 0.323 0.03 . 1 . . . . A 8 VAL HG22 . 36075 1
74 . 1 1 8 8 VAL HG23 H 1 0.323 0.03 . 1 . . . . A 8 VAL HG23 . 36075 1
75 . 1 1 8 8 VAL C C 13 178.23 0.1 . 1 . . . . A 8 VAL C . 36075 1
76 . 1 1 8 8 VAL CA C 13 61.32 0.1 . 1 . . . . A 8 VAL CA . 36075 1
77 . 1 1 8 8 VAL CB C 13 33.24 0.1 . 1 . . . . A 8 VAL CB . 36075 1
78 . 1 1 8 8 VAL CG1 C 13 21.33 0.1 . 2 . . . . A 8 VAL CG1 . 36075 1
79 . 1 1 8 8 VAL CG2 C 13 23.21 0.1 . 2 . . . . A 8 VAL CG2 . 36075 1
80 . 1 1 8 8 VAL N N 15 117.21 0.2 . 1 . . . . A 8 VAL N . 36075 1
81 . 1 1 9 9 TRP H H 1 9.123 0.03 . 1 . . . . A 9 TRP H . 36075 1
82 . 1 1 9 9 TRP HA H 1 4.36 0.03 . 1 . . . . A 9 TRP HA . 36075 1
83 . 1 1 9 9 TRP HB2 H 1 3.52 0.03 . 1 . . . . A 9 TRP HB2 . 36075 1
84 . 1 1 9 9 TRP HB3 H 1 3.52 0.03 . 1 . . . . A 9 TRP HB3 . 36075 1
85 . 1 1 9 9 TRP HD1 H 1 7.524 0.03 . 1 . . . . A 9 TRP HD1 . 36075 1
86 . 1 1 9 9 TRP HE1 H 1 11.3 0.03 . 1 . . . . A 9 TRP HE1 . 36075 1
87 . 1 1 9 9 TRP HE3 H 1 7.41 0.03 . 1 . . . . A 9 TRP HE3 . 36075 1
88 . 1 1 9 9 TRP HZ2 H 1 7.44 0.03 . 1 . . . . A 9 TRP HZ2 . 36075 1
89 . 1 1 9 9 TRP HZ3 H 1 6.98 0.03 . 1 . . . . A 9 TRP HZ3 . 36075 1
90 . 1 1 9 9 TRP HH2 H 1 7.23 0.03 . 1 . . . . A 9 TRP HH2 . 36075 1
91 . 1 1 9 9 TRP C C 13 176.24 0.1 . 1 . . . . A 9 TRP C . 36075 1
92 . 1 1 9 9 TRP CA C 13 58.13 0.1 . 1 . . . . A 9 TRP CA . 36075 1
93 . 1 1 9 9 TRP CB C 13 32.47 0.1 . 1 . . . . A 9 TRP CB . 36075 1
94 . 1 1 9 9 TRP CD1 C 13 125.41 0.1 . 1 . . . . A 9 TRP CD1 . 36075 1
95 . 1 1 9 9 TRP CE3 C 13 123.41 0.1 . 1 . . . . A 9 TRP CE3 . 36075 1
96 . 1 1 9 9 TRP CZ2 C 13 114.33 0.1 . 1 . . . . A 9 TRP CZ2 . 36075 1
97 . 1 1 9 9 TRP CZ3 C 13 122.01 0.1 . 1 . . . . A 9 TRP CZ3 . 36075 1
98 . 1 1 9 9 TRP CH2 C 13 126.7 0.1 . 1 . . . . A 9 TRP CH2 . 36075 1
99 . 1 1 9 9 TRP N N 15 118.45 0.2 . 1 . . . . A 9 TRP N . 36075 1
100 . 1 1 9 9 TRP NE1 N 15 130.98 0.2 . 1 . . . . A 9 TRP NE1 . 36075 1
101 . 1 1 10 10 THR H H 1 7.87 0.03 . 1 . . . . A 10 THR H . 36075 1
102 . 1 1 10 10 THR HA H 1 4.01 0.03 . 1 . . . . A 10 THR HA . 36075 1
103 . 1 1 10 10 THR HB H 1 3.97 0.03 . 1 . . . . A 10 THR HB . 36075 1
104 . 1 1 10 10 THR HG21 H 1 1.21 0.03 . 1 . . . . A 10 THR HG21 . 36075 1
105 . 1 1 10 10 THR HG22 H 1 1.21 0.03 . 1 . . . . A 10 THR HG22 . 36075 1
106 . 1 1 10 10 THR HG23 H 1 1.21 0.03 . 1 . . . . A 10 THR HG23 . 36075 1
107 . 1 1 10 10 THR C C 13 175.47 0.1 . 1 . . . . A 10 THR C . 36075 1
108 . 1 1 10 10 THR CA C 13 60.24 0.1 . 1 . . . . A 10 THR CA . 36075 1
109 . 1 1 10 10 THR CB C 13 70.23 0.1 . 1 . . . . A 10 THR CB . 36075 1
110 . 1 1 10 10 THR CG2 C 13 19.54 0.1 . 1 . . . . A 10 THR CG2 . 36075 1
111 . 1 1 10 10 THR N N 15 115.23 0.2 . 1 . . . . A 10 THR N . 36075 1
112 . 1 1 11 11 ALA H H 1 8.25 0.03 . 1 . . . . A 11 ALA H . 36075 1
113 . 1 1 11 11 ALA HA H 1 3.88 0.03 . 1 . . . . A 11 ALA HA . 36075 1
114 . 1 1 11 11 ALA HB1 H 1 1.67 0.03 . 1 . . . . A 11 ALA HB1 . 36075 1
115 . 1 1 11 11 ALA HB2 H 1 1.67 0.03 . 1 . . . . A 11 ALA HB2 . 36075 1
116 . 1 1 11 11 ALA HB3 H 1 1.67 0.03 . 1 . . . . A 11 ALA HB3 . 36075 1
117 . 1 1 11 11 ALA C C 13 180 0.1 . 1 . . . . A 11 ALA C . 36075 1
118 . 1 1 11 11 ALA CA C 13 53.21 0.1 . 1 . . . . A 11 ALA CA . 36075 1
119 . 1 1 11 11 ALA CB C 13 17.41 0.1 . 1 . . . . A 11 ALA CB . 36075 1
120 . 1 1 11 11 ALA N N 15 121.35 0.2 . 1 . . . . A 11 ALA N . 36075 1
121 . 1 1 12 12 GLU H H 1 7.94 0.03 . 1 . . . . A 12 GLU H . 36075 1
122 . 1 1 12 12 GLU HA H 1 4.21 0.03 . 1 . . . . A 12 GLU HA . 36075 1
123 . 1 1 12 12 GLU HB2 H 1 2.03 0.03 . 1 . . . . A 12 GLU HB2 . 36075 1
124 . 1 1 12 12 GLU HB3 H 1 2.03 0.03 . 1 . . . . A 12 GLU HB3 . 36075 1
125 . 1 1 12 12 GLU HG2 H 1 2.35 0.03 . 1 . . . . A 12 GLU HG2 . 36075 1
126 . 1 1 12 12 GLU HG3 H 1 2.35 0.03 . 1 . . . . A 12 GLU HG3 . 36075 1
127 . 1 1 12 12 GLU C C 13 174.21 0.1 . 1 . . . . A 12 GLU C . 36075 1
128 . 1 1 12 12 GLU CA C 13 57.16 0.1 . 1 . . . . A 12 GLU CA . 36075 1
129 . 1 1 12 12 GLU CB C 13 29.64 0.1 . 1 . . . . A 12 GLU CB . 36075 1
130 . 1 1 12 12 GLU CG C 13 38.54 0.1 . 1 . . . . A 12 GLU CG . 36075 1
131 . 1 1 12 12 GLU N N 15 119.32 0.2 . 1 . . . . A 12 GLU N . 36075 1
132 . 1 1 13 13 SER H H 1 7.45 0.03 . 1 . . . . A 13 SER H . 36075 1
133 . 1 1 13 13 SER HA H 1 4.05 0.03 . 1 . . . . A 13 SER HA . 36075 1
134 . 1 1 13 13 SER HB2 H 1 4.25 0.03 . 1 . . . . A 13 SER HB2 . 36075 1
135 . 1 1 13 13 SER HB3 H 1 4.25 0.03 . 1 . . . . A 13 SER HB3 . 36075 1
136 . 1 1 13 13 SER C C 13 176.6 0.1 . 1 . . . . A 13 SER C . 36075 1
137 . 1 1 13 13 SER CA C 13 58.45 0.1 . 1 . . . . A 13 SER CA . 36075 1
138 . 1 1 13 13 SER CB C 13 59.67 0.1 . 1 . . . . A 13 SER CB . 36075 1
139 . 1 1 13 13 SER N N 15 117.41 0.2 . 1 . . . . A 13 SER N . 36075 1
140 . 1 1 14 14 LEU H H 1 7.34 0.03 . 1 . . . . A 14 LEU H . 36075 1
141 . 1 1 14 14 LEU HA H 1 4.11 0.03 . 1 . . . . A 14 LEU HA . 36075 1
142 . 1 1 14 14 LEU HB2 H 1 0.54 0.03 . 2 . . . . A 14 LEU HB2 . 36075 1
143 . 1 1 14 14 LEU HB3 H 1 1.12 0.03 . 2 . . . . A 14 LEU HB3 . 36075 1
144 . 1 1 14 14 LEU HG H 1 1.78 0.03 . 1 . . . . A 14 LEU HG . 36075 1
145 . 1 1 14 14 LEU HD11 H 1 0.56 0.03 . 1 . . . . A 14 LEU HD11 . 36075 1
146 . 1 1 14 14 LEU HD12 H 1 0.56 0.03 . 1 . . . . A 14 LEU HD12 . 36075 1
147 . 1 1 14 14 LEU HD13 H 1 0.56 0.03 . 1 . . . . A 14 LEU HD13 . 36075 1
148 . 1 1 14 14 LEU HD21 H 1 0.99 0.03 . 1 . . . . A 14 LEU HD21 . 36075 1
149 . 1 1 14 14 LEU HD22 H 1 0.99 0.03 . 1 . . . . A 14 LEU HD22 . 36075 1
150 . 1 1 14 14 LEU HD23 H 1 0.99 0.03 . 1 . . . . A 14 LEU HD23 . 36075 1
151 . 1 1 14 14 LEU C C 13 172.74 0.1 . 1 . . . . A 14 LEU C . 36075 1
152 . 1 1 14 14 LEU CA C 13 54.47 0.1 . 1 . . . . A 14 LEU CA . 36075 1
153 . 1 1 14 14 LEU CB C 13 39.78 0.1 . 1 . . . . A 14 LEU CB . 36075 1
154 . 1 1 14 14 LEU CG C 13 24.1 0.1 . 1 . . . . A 14 LEU CG . 36075 1
155 . 1 1 14 14 LEU CD1 C 13 21.54 0.1 . 2 . . . . A 14 LEU CD1 . 36075 1
156 . 1 1 14 14 LEU CD2 C 13 26.14 0.1 . 2 . . . . A 14 LEU CD2 . 36075 1
157 . 1 1 14 14 LEU N N 15 121.4 0.2 . 1 . . . . A 14 LEU N . 36075 1
158 . 1 1 15 15 PHE H H 1 10.11 0.03 . 1 . . . . A 15 PHE H . 36075 1
159 . 1 1 15 15 PHE HA H 1 4.95 0.03 . 1 . . . . A 15 PHE HA . 36075 1
160 . 1 1 15 15 PHE HB2 H 1 3.54 0.03 . 1 . . . . A 15 PHE HB2 . 36075 1
161 . 1 1 15 15 PHE HB3 H 1 3.54 0.03 . 1 . . . . A 15 PHE HB3 . 36075 1
162 . 1 1 15 15 PHE HD1 H 1 6.87 0.03 . 1 . . . . A 15 PHE HD1 . 36075 1
163 . 1 1 15 15 PHE HD2 H 1 6.87 0.03 . 1 . . . . A 15 PHE HD2 . 36075 1
164 . 1 1 15 15 PHE HE1 H 1 6.54 0.03 . 1 . . . . A 15 PHE HE1 . 36075 1
165 . 1 1 15 15 PHE HE2 H 1 6.54 0.03 . 1 . . . . A 15 PHE HE2 . 36075 1
166 . 1 1 15 15 PHE HZ H 1 6.14 0.03 . 1 . . . . A 15 PHE HZ . 36075 1
167 . 1 1 15 15 PHE C C 13 171.35 0.1 . 1 . . . . A 15 PHE C . 36075 1
168 . 1 1 15 15 PHE CA C 13 57.34 0.1 . 1 . . . . A 15 PHE CA . 36075 1
169 . 1 1 15 15 PHE CB C 13 39.47 0.1 . 1 . . . . A 15 PHE CB . 36075 1
170 . 1 1 15 15 PHE CD1 C 13 129.78 0.1 . 1 . . . . A 15 PHE CD1 . 36075 1
171 . 1 1 15 15 PHE CD2 C 13 129.78 0.1 . 1 . . . . A 15 PHE CD2 . 36075 1
172 . 1 1 15 15 PHE CE1 C 13 131.23 0.1 . 1 . . . . A 15 PHE CE1 . 36075 1
173 . 1 1 15 15 PHE CE2 C 13 131.23 0.1 . 1 . . . . A 15 PHE CE2 . 36075 1
174 . 1 1 15 15 PHE CZ C 13 128.47 0.1 . 1 . . . . A 15 PHE CZ . 36075 1
175 . 1 1 15 15 PHE N N 15 121.47 0.2 . 1 . . . . A 15 PHE N . 36075 1
176 . 1 1 16 16 PRO HA H 1 4.54 0.03 . 1 . . . . A 16 PRO HA . 36075 1
177 . 1 1 16 16 PRO HB2 H 1 2.58 0.03 . 2 . . . . A 16 PRO HB2 . 36075 1
178 . 1 1 16 16 PRO HB3 H 1 2.1 0.03 . 2 . . . . A 16 PRO HB3 . 36075 1
179 . 1 1 16 16 PRO HG2 H 1 1.74 0.03 . 1 . . . . A 16 PRO HG2 . 36075 1
180 . 1 1 16 16 PRO HG3 H 1 1.74 0.03 . 1 . . . . A 16 PRO HG3 . 36075 1
181 . 1 1 16 16 PRO HD2 H 1 3.68 0.03 . 2 . . . . A 16 PRO HD2 . 36075 1
182 . 1 1 16 16 PRO HD3 H 1 3.74 0.03 . 2 . . . . A 16 PRO HD3 . 36075 1
183 . 1 1 16 16 PRO C C 13 172.98 0.1 . 1 . . . . A 16 PRO C . 36075 1
184 . 1 1 16 16 PRO CA C 13 63.41 0.1 . 1 . . . . A 16 PRO CA . 36075 1
185 . 1 1 16 16 PRO CB C 13 34.68 0.1 . 1 . . . . A 16 PRO CB . 36075 1
186 . 1 1 16 16 PRO CG C 13 24.41 0.1 . 1 . . . . A 16 PRO CG . 36075 1
187 . 1 1 16 16 PRO CD C 13 51.98 0.1 . 1 . . . . A 16 PRO CD . 36075 1
188 . 1 1 17 17 CYS H H 1 8.94 0.03 . 1 . . . . A 17 CYS H . 36075 1
189 . 1 1 17 17 CYS HA H 1 4.91 0.03 . 1 . . . . A 17 CYS HA . 36075 1
190 . 1 1 17 17 CYS HB2 H 1 2.54 0.03 . 1 . . . . A 17 CYS HB2 . 36075 1
191 . 1 1 17 17 CYS HB3 H 1 2.54 0.03 . 1 . . . . A 17 CYS HB3 . 36075 1
192 . 1 1 17 17 CYS C C 13 174.95 0.1 . 1 . . . . A 17 CYS C . 36075 1
193 . 1 1 17 17 CYS CA C 13 61.25 0.1 . 1 . . . . A 17 CYS CA . 36075 1
194 . 1 1 17 17 CYS CB C 13 28.65 0.1 . 1 . . . . A 17 CYS CB . 36075 1
195 . 1 1 17 17 CYS N N 15 122.47 0.2 . 1 . . . . A 17 CYS N . 36075 1
196 . 1 1 18 18 ARG H H 1 6.87 0.03 . 1 . . . . A 18 ARG H . 36075 1
197 . 1 1 18 18 ARG HA H 1 4.36 0.03 . 1 . . . . A 18 ARG HA . 36075 1
198 . 1 1 18 18 ARG HB2 H 1 1.66 0.03 . 1 . . . . A 18 ARG HB2 . 36075 1
199 . 1 1 18 18 ARG HB3 H 1 1.66 0.03 . 1 . . . . A 18 ARG HB3 . 36075 1
200 . 1 1 18 18 ARG HG2 H 1 1.65 0.03 . 2 . . . . A 18 ARG HG2 . 36075 1
201 . 1 1 18 18 ARG HG3 H 1 1.61 0.03 . 2 . . . . A 18 ARG HG3 . 36075 1
202 . 1 1 18 18 ARG HD2 H 1 3.21 0.03 . 1 . . . . A 18 ARG HD2 . 36075 1
203 . 1 1 18 18 ARG HD3 H 1 3.21 0.03 . 1 . . . . A 18 ARG HD3 . 36075 1
204 . 1 1 18 18 ARG C C 13 170.14 0.1 . 1 . . . . A 18 ARG C . 36075 1
205 . 1 1 18 18 ARG CA C 13 56.47 0.1 . 1 . . . . A 18 ARG CA . 36075 1
206 . 1 1 18 18 ARG CB C 13 29.65 0.1 . 1 . . . . A 18 ARG CB . 36075 1
207 . 1 1 18 18 ARG CG C 13 28.47 0.1 . 1 . . . . A 18 ARG CG . 36075 1
208 . 1 1 18 18 ARG CD C 13 44.58 0.1 . 1 . . . . A 18 ARG CD . 36075 1
209 . 1 1 19 19 VAL H H 1 8.95 0.03 . 1 . . . . A 19 VAL H . 36075 1
210 . 1 1 19 19 VAL HA H 1 3.85 0.03 . 1 . . . . A 19 VAL HA . 36075 1
211 . 1 1 19 19 VAL HB H 1 2.98 0.03 . 1 . . . . A 19 VAL HB . 36075 1
212 . 1 1 19 19 VAL HG11 H 1 1.12 0.03 . 1 . . . . A 19 VAL HG11 . 36075 1
213 . 1 1 19 19 VAL HG12 H 1 1.12 0.03 . 1 . . . . A 19 VAL HG12 . 36075 1
214 . 1 1 19 19 VAL HG13 H 1 1.12 0.03 . 1 . . . . A 19 VAL HG13 . 36075 1
215 . 1 1 19 19 VAL HG21 H 1 0.54 0.03 . 1 . . . . A 19 VAL HG21 . 36075 1
216 . 1 1 19 19 VAL HG22 H 1 0.54 0.03 . 1 . . . . A 19 VAL HG22 . 36075 1
217 . 1 1 19 19 VAL HG23 H 1 0.54 0.03 . 1 . . . . A 19 VAL HG23 . 36075 1
218 . 1 1 19 19 VAL C C 13 174.69 0.1 . 1 . . . . A 19 VAL C . 36075 1
219 . 1 1 19 19 VAL CA C 13 63.25 0.1 . 1 . . . . A 19 VAL CA . 36075 1
220 . 1 1 19 19 VAL CB C 13 30.41 0.1 . 1 . . . . A 19 VAL CB . 36075 1
221 . 1 1 19 19 VAL CG1 C 13 23.14 0.1 . 2 . . . . A 19 VAL CG1 . 36075 1
222 . 1 1 19 19 VAL CG2 C 13 22.68 0.1 . 2 . . . . A 19 VAL CG2 . 36075 1
223 . 1 1 19 19 VAL N N 15 121.4 0.2 . 1 . . . . A 19 VAL N . 36075 1
224 . 1 1 20 20 CYS H H 1 7.98 0.03 . 1 . . . . A 20 CYS H . 36075 1
225 . 1 1 20 20 CYS HA H 1 4.55 0.03 . 1 . . . . A 20 CYS HA . 36075 1
226 . 1 1 20 20 CYS HB2 H 1 2.89 0.03 . 2 . . . . A 20 CYS HB2 . 36075 1
227 . 1 1 20 20 CYS HB3 H 1 2.14 0.03 . 2 . . . . A 20 CYS HB3 . 36075 1
228 . 1 1 20 20 CYS CB C 13 31.98 0.1 . 1 . . . . A 20 CYS CB . 36075 1
229 . 1 1 21 21 THR H H 1 8.14 0.03 . 1 . . . . A 21 THR H . 36075 1
230 . 1 1 21 21 THR HA H 1 4.26 0.03 . 1 . . . . A 21 THR HA . 36075 1
231 . 1 1 21 21 THR HB H 1 3.97 0.03 . 1 . . . . A 21 THR HB . 36075 1
232 . 1 1 21 21 THR HG21 H 1 1.54 0.03 . 1 . . . . A 21 THR HG21 . 36075 1
233 . 1 1 21 21 THR HG22 H 1 1.54 0.03 . 1 . . . . A 21 THR HG22 . 36075 1
234 . 1 1 21 21 THR HG23 H 1 1.54 0.03 . 1 . . . . A 21 THR HG23 . 36075 1
235 . 1 1 21 21 THR C C 13 179.8 0.1 . 1 . . . . A 21 THR C . 36075 1
236 . 1 1 21 21 THR CA C 13 62.34 0.1 . 1 . . . . A 21 THR CA . 36075 1
237 . 1 1 21 21 THR CB C 13 69.51 0.1 . 1 . . . . A 21 THR CB . 36075 1
238 . 1 1 21 21 THR CG2 C 13 19.87 0.1 . 1 . . . . A 21 THR CG2 . 36075 1
239 . 1 1 22 22 ARG H H 1 9.52 0.03 . 1 . . . . A 22 ARG H . 36075 1
240 . 1 1 22 22 ARG HA H 1 4.13 0.03 . 1 . . . . A 22 ARG HA . 36075 1
241 . 1 1 22 22 ARG HB2 H 1 1.65 0.03 . 2 . . . . A 22 ARG HB2 . 36075 1
242 . 1 1 22 22 ARG HB3 H 1 2.1 0.03 . 2 . . . . A 22 ARG HB3 . 36075 1
243 . 1 1 22 22 ARG HG2 H 1 1.47 0.03 . 1 . . . . A 22 ARG HG2 . 36075 1
244 . 1 1 22 22 ARG HG3 H 1 1.47 0.03 . 1 . . . . A 22 ARG HG3 . 36075 1
245 . 1 1 22 22 ARG HD2 H 1 2.97 0.03 . 1 . . . . A 22 ARG HD2 . 36075 1
246 . 1 1 22 22 ARG HD3 H 1 2.97 0.03 . 1 . . . . A 22 ARG HD3 . 36075 1
247 . 1 1 22 22 ARG C C 13 175.445 0.1 . 1 . . . . A 22 ARG C . 36075 1
248 . 1 1 22 22 ARG CB C 13 29.54 0.1 . 1 . . . . A 22 ARG CB . 36075 1
249 . 1 1 22 22 ARG CG C 13 32.1 0.1 . 1 . . . . A 22 ARG CG . 36075 1
250 . 1 1 22 22 ARG CD C 13 43.98 0.1 . 1 . . . . A 22 ARG CD . 36075 1
251 . 1 1 22 22 ARG N N 15 121.97 0.2 . 1 . . . . A 22 ARG N . 36075 1
252 . 1 1 23 23 VAL H H 1 8.52 0.03 . 1 . . . . A 23 VAL H . 36075 1
253 . 1 1 23 23 VAL HA H 1 4.87 0.03 . 1 . . . . A 23 VAL HA . 36075 1
254 . 1 1 23 23 VAL HB H 1 1.93 0.03 . 1 . . . . A 23 VAL HB . 36075 1
255 . 1 1 23 23 VAL HG11 H 1 0.23 0.03 . 1 . . . . A 23 VAL HG11 . 36075 1
256 . 1 1 23 23 VAL HG12 H 1 0.23 0.03 . 1 . . . . A 23 VAL HG12 . 36075 1
257 . 1 1 23 23 VAL HG13 H 1 0.23 0.03 . 1 . . . . A 23 VAL HG13 . 36075 1
258 . 1 1 23 23 VAL HG21 H 1 0.87 0.03 . 1 . . . . A 23 VAL HG21 . 36075 1
259 . 1 1 23 23 VAL HG22 H 1 0.87 0.03 . 1 . . . . A 23 VAL HG22 . 36075 1
260 . 1 1 23 23 VAL HG23 H 1 0.87 0.03 . 1 . . . . A 23 VAL HG23 . 36075 1
261 . 1 1 23 23 VAL C C 13 170.98 0.1 . 1 . . . . A 23 VAL C . 36075 1
262 . 1 1 23 23 VAL CA C 13 61.14 0.1 . 1 . . . . A 23 VAL CA . 36075 1
263 . 1 1 23 23 VAL CB C 13 33.85 0.1 . 1 . . . . A 23 VAL CB . 36075 1
264 . 1 1 23 23 VAL CG1 C 13 19.78 0.1 . 2 . . . . A 23 VAL CG1 . 36075 1
265 . 1 1 23 23 VAL CG2 C 13 17.54 0.1 . 2 . . . . A 23 VAL CG2 . 36075 1
266 . 1 1 23 23 VAL N N 15 118.4 0.2 . 1 . . . . A 23 VAL N . 36075 1
267 . 1 1 24 24 PHE H H 1 7.21 0.03 . 1 . . . . A 24 PHE H . 36075 1
268 . 1 1 24 24 PHE HA H 1 4.95 0.03 . 1 . . . . A 24 PHE HA . 36075 1
269 . 1 1 24 24 PHE HB2 H 1 2.88 0.03 . 2 . . . . A 24 PHE HB2 . 36075 1
270 . 1 1 24 24 PHE HB3 H 1 3.01 0.03 . 2 . . . . A 24 PHE HB3 . 36075 1
271 . 1 1 24 24 PHE HD1 H 1 6.9 0.03 . 1 . . . . A 24 PHE HD1 . 36075 1
272 . 1 1 24 24 PHE HD2 H 1 6.9 0.03 . 1 . . . . A 24 PHE HD2 . 36075 1
273 . 1 1 24 24 PHE HE1 H 1 7.1 0.03 . 1 . . . . A 24 PHE HE1 . 36075 1
274 . 1 1 24 24 PHE HE2 H 1 7.1 0.03 . 1 . . . . A 24 PHE HE2 . 36075 1
275 . 1 1 24 24 PHE HZ H 1 7.9 0.03 . 1 . . . . A 24 PHE HZ . 36075 1
276 . 1 1 24 24 PHE C C 13 170.97 0.1 . 1 . . . . A 24 PHE C . 36075 1
277 . 1 1 24 24 PHE CA C 13 57.14 0.1 . 1 . . . . A 24 PHE CA . 36075 1
278 . 1 1 24 24 PHE CB C 13 42.74 0.1 . 1 . . . . A 24 PHE CB . 36075 1
279 . 1 1 24 24 PHE CD1 C 13 130.52 0.1 . 1 . . . . A 24 PHE CD1 . 36075 1
280 . 1 1 24 24 PHE CD2 C 13 130.52 0.1 . 1 . . . . A 24 PHE CD2 . 36075 1
281 . 1 1 24 24 PHE CE1 C 13 132.2 0.1 . 1 . . . . A 24 PHE CE1 . 36075 1
282 . 1 1 24 24 PHE CE2 C 13 132.2 0.1 . 1 . . . . A 24 PHE CE2 . 36075 1
283 . 1 1 24 24 PHE CZ C 13 127.5 0.1 . 1 . . . . A 24 PHE CZ . 36075 1
284 . 1 1 24 24 PHE N N 15 119.5 0.2 . 1 . . . . A 24 PHE N . 36075 1
285 . 1 1 25 25 HIS H H 1 10.58 0.03 . 1 . . . . A 25 HIS H . 36075 1
286 . 1 1 25 25 HIS HA H 1 4.78 0.03 . 1 . . . . A 25 HIS HA . 36075 1
287 . 1 1 25 25 HIS HB2 H 1 3.11 0.03 . 2 . . . . A 25 HIS HB2 . 36075 1
288 . 1 1 25 25 HIS HB3 H 1 3.33 0.03 . 2 . . . . A 25 HIS HB3 . 36075 1
289 . 1 1 25 25 HIS HD2 H 1 6.87 0.03 . 1 . . . . A 25 HIS HD2 . 36075 1
290 . 1 1 25 25 HIS HE1 H 1 6.99 0.03 . 1 . . . . A 25 HIS HE1 . 36075 1
291 . 1 1 25 25 HIS C C 13 174.52 0.1 . 1 . . . . A 25 HIS C . 36075 1
292 . 1 1 25 25 HIS CA C 13 56.24 0.1 . 1 . . . . A 25 HIS CA . 36075 1
293 . 1 1 25 25 HIS CB C 13 29.86 0.1 . 1 . . . . A 25 HIS CB . 36075 1
294 . 1 1 25 25 HIS CD2 C 13 118.5 0.1 . 1 . . . . A 25 HIS CD2 . 36075 1
295 . 1 1 25 25 HIS CE1 C 13 137.23 0.1 . 1 . . . . A 25 HIS CE1 . 36075 1
296 . 1 1 25 25 HIS N N 15 120.4 0.2 . 1 . . . . A 25 HIS N . 36075 1
297 . 1 1 26 26 ASP H H 1 8.6 0.03 . 1 . . . . A 26 ASP H . 36075 1
298 . 1 1 26 26 ASP HA H 1 4.06 0.03 . 1 . . . . A 26 ASP HA . 36075 1
299 . 1 1 26 26 ASP HB2 H 1 2.34 0.03 . 2 . . . . A 26 ASP HB2 . 36075 1
300 . 1 1 26 26 ASP HB3 H 1 2.65 0.03 . 2 . . . . A 26 ASP HB3 . 36075 1
301 . 1 1 26 26 ASP C C 13 180.66 0.1 . 1 . . . . A 26 ASP C . 36075 1
302 . 1 1 26 26 ASP CA C 13 55.41 0.1 . 1 . . . . A 26 ASP CA . 36075 1
303 . 1 1 26 26 ASP CB C 13 38.47 0.1 . 1 . . . . A 26 ASP CB . 36075 1
304 . 1 1 26 26 ASP N N 15 121.4 0.2 . 1 . . . . A 26 ASP N . 36075 1
305 . 1 1 27 27 GLY H H 1 7.55 0.03 . 1 . . . . A 27 GLY H . 36075 1
306 . 1 1 27 27 GLY HA2 H 1 3.99 0.03 . 2 . . . . A 27 GLY HA2 . 36075 1
307 . 1 1 27 27 GLY HA3 H 1 4.01 0.03 . 2 . . . . A 27 GLY HA3 . 36075 1
308 . 1 1 27 27 GLY C C 13 179.52 0.1 . 1 . . . . A 27 GLY C . 36075 1
309 . 1 1 27 27 GLY CA C 13 46.24 0.1 . 1 . . . . A 27 GLY CA . 36075 1
310 . 1 1 27 27 GLY N N 15 108.23 0.2 . 1 . . . . A 27 GLY N . 36075 1
311 . 1 1 28 28 CYS H H 1 7.85 0.03 . 1 . . . . A 28 CYS H . 36075 1
312 . 1 1 28 28 CYS HA H 1 3.92 0.03 . 1 . . . . A 28 CYS HA . 36075 1
313 . 1 1 28 28 CYS HB2 H 1 2.87 0.03 . 1 . . . . A 28 CYS HB2 . 36075 1
314 . 1 1 28 28 CYS HB3 H 1 2.87 0.03 . 1 . . . . A 28 CYS HB3 . 36075 1
315 . 1 1 28 28 CYS C C 13 179.52 0.1 . 1 . . . . A 28 CYS C . 36075 1
316 . 1 1 28 28 CYS CA C 13 61.44 0.1 . 1 . . . . A 28 CYS CA . 36075 1
317 . 1 1 28 28 CYS CB C 13 28.44 0.1 . 1 . . . . A 28 CYS CB . 36075 1
318 . 1 1 28 28 CYS N N 15 122.01 0.2 . 1 . . . . A 28 CYS N . 36075 1
319 . 1 1 29 29 LEU H H 1 8.12 0.03 . 1 . . . . A 29 LEU H . 36075 1
320 . 1 1 29 29 LEU HA H 1 4.26 0.03 . 1 . . . . A 29 LEU HA . 36075 1
321 . 1 1 29 29 LEU HB2 H 1 2.12 0.03 . 1 . . . . A 29 LEU HB2 . 36075 1
322 . 1 1 29 29 LEU HB3 H 1 2.12 0.03 . 1 . . . . A 29 LEU HB3 . 36075 1
323 . 1 1 29 29 LEU HG H 1 1.74 0.03 . 1 . . . . A 29 LEU HG . 36075 1
324 . 1 1 29 29 LEU HD11 H 1 0.12 0.03 . 1 . . . . A 29 LEU HD11 . 36075 1
325 . 1 1 29 29 LEU HD12 H 1 0.12 0.03 . 1 . . . . A 29 LEU HD12 . 36075 1
326 . 1 1 29 29 LEU HD13 H 1 0.12 0.03 . 1 . . . . A 29 LEU HD13 . 36075 1
327 . 1 1 29 29 LEU HD21 H 1 0.56 0.03 . 1 . . . . A 29 LEU HD21 . 36075 1
328 . 1 1 29 29 LEU HD22 H 1 0.56 0.03 . 1 . . . . A 29 LEU HD22 . 36075 1
329 . 1 1 29 29 LEU HD23 H 1 0.56 0.03 . 1 . . . . A 29 LEU HD23 . 36075 1
330 . 1 1 29 29 LEU C C 13 180.47 0.1 . 1 . . . . A 29 LEU C . 36075 1
331 . 1 1 29 29 LEU CA C 13 56.24 0.1 . 1 . . . . A 29 LEU CA . 36075 1
332 . 1 1 29 29 LEU CB C 13 39.47 0.1 . 1 . . . . A 29 LEU CB . 36075 1
333 . 1 1 29 29 LEU CG C 13 25.84 0.1 . 1 . . . . A 29 LEU CG . 36075 1
334 . 1 1 29 29 LEU CD1 C 13 24.59 0.1 . 2 . . . . A 29 LEU CD1 . 36075 1
335 . 1 1 29 29 LEU CD2 C 13 22.14 0.1 . 2 . . . . A 29 LEU CD2 . 36075 1
336 . 1 1 29 29 LEU N N 15 120.74 0.2 . 1 . . . . A 29 LEU N . 36075 1
337 . 1 1 30 30 ARG H H 1 8.74 0.03 . 1 . . . . A 30 ARG H . 36075 1
338 . 1 1 30 30 ARG HA H 1 4.19 0.03 . 1 . . . . A 30 ARG HA . 36075 1
339 . 1 1 30 30 ARG HB2 H 1 2.24 0.03 . 1 . . . . A 30 ARG HB2 . 36075 1
340 . 1 1 30 30 ARG HB3 H 1 2.24 0.03 . 1 . . . . A 30 ARG HB3 . 36075 1
341 . 1 1 30 30 ARG HG2 H 1 1.87 0.03 . 2 . . . . A 30 ARG HG2 . 36075 1
342 . 1 1 30 30 ARG HG3 H 1 1.87 0.03 . 2 . . . . A 30 ARG HG3 . 36075 1
343 . 1 1 30 30 ARG HD2 H 1 2.98 0.03 . 1 . . . . A 30 ARG HD2 . 36075 1
344 . 1 1 30 30 ARG HD3 H 1 2.98 0.03 . 1 . . . . A 30 ARG HD3 . 36075 1
345 . 1 1 30 30 ARG C C 13 180.5 0.1 . 1 . . . . A 30 ARG C . 36075 1
346 . 1 1 30 30 ARG CA C 13 55.41 0.1 . 1 . . . . A 30 ARG CA . 36075 1
347 . 1 1 30 30 ARG CB C 13 29.69 0.1 . 1 . . . . A 30 ARG CB . 36075 1
348 . 1 1 30 30 ARG CG C 13 27.54 0.1 . 1 . . . . A 30 ARG CG . 36075 1
349 . 1 1 30 30 ARG CD C 13 44.1 0.1 . 1 . . . . A 30 ARG CD . 36075 1
350 . 1 1 30 30 ARG N N 15 119.4 0.2 . 1 . . . . A 30 ARG N . 36075 1
351 . 1 1 31 31 ARG H H 1 7.41 0.03 . 1 . . . . A 31 ARG H . 36075 1
352 . 1 1 31 31 ARG HA H 1 4 0.03 . 1 . . . . A 31 ARG HA . 36075 1
353 . 1 1 31 31 ARG HB2 H 1 1.58 0.03 . 1 . . . . A 31 ARG HB2 . 36075 1
354 . 1 1 31 31 ARG HB3 H 1 1.58 0.03 . 1 . . . . A 31 ARG HB3 . 36075 1
355 . 1 1 31 31 ARG HG2 H 1 1.77 0.03 . 1 . . . . A 31 ARG HG2 . 36075 1
356 . 1 1 31 31 ARG HG3 H 1 1.77 0.03 . 1 . . . . A 31 ARG HG3 . 36075 1
357 . 1 1 31 31 ARG HD2 H 1 3.32 0.03 . 1 . . . . A 31 ARG HD2 . 36075 1
358 . 1 1 31 31 ARG HD3 H 1 3.32 0.03 . 1 . . . . A 31 ARG HD3 . 36075 1
359 . 1 1 31 31 ARG C C 13 177.21 0.1 . 1 . . . . A 31 ARG C . 36075 1
360 . 1 1 31 31 ARG CA C 13 56.31 0.1 . 1 . . . . A 31 ARG CA . 36075 1
361 . 1 1 31 31 ARG CB C 13 29.54 0.1 . 1 . . . . A 31 ARG CB . 36075 1
362 . 1 1 31 31 ARG CG C 13 25.41 0.1 . 1 . . . . A 31 ARG CG . 36075 1
363 . 1 1 31 31 ARG CD C 13 45.1 0.1 . 1 . . . . A 31 ARG CD . 36075 1
364 . 1 1 31 31 ARG N N 15 118.01 0.2 . 1 . . . . A 31 ARG N . 36075 1
365 . 1 1 32 32 MET H H 1 8.52 0.03 . 1 . . . . A 32 MET H . 36075 1
366 . 1 1 32 32 MET HA H 1 4.52 0.03 . 1 . . . . A 32 MET HA . 36075 1
367 . 1 1 32 32 MET HB2 H 1 1.84 0.03 . 1 . . . . A 32 MET HB2 . 36075 1
368 . 1 1 32 32 MET HB3 H 1 1.84 0.03 . 1 . . . . A 32 MET HB3 . 36075 1
369 . 1 1 32 32 MET HG2 H 1 2.54 0.03 . 1 . . . . A 32 MET HG2 . 36075 1
370 . 1 1 32 32 MET HG3 H 1 2.54 0.03 . 1 . . . . A 32 MET HG3 . 36075 1
371 . 1 1 32 32 MET HE1 H 1 1.78 0.03 . 1 . . . . A 32 MET HE1 . 36075 1
372 . 1 1 32 32 MET HE2 H 1 1.78 0.03 . 1 . . . . A 32 MET HE2 . 36075 1
373 . 1 1 32 32 MET HE3 H 1 1.78 0.03 . 1 . . . . A 32 MET HE3 . 36075 1
374 . 1 1 32 32 MET C C 13 174.21 0.1 . 1 . . . . A 32 MET C . 36075 1
375 . 1 1 32 32 MET CA C 13 55.31 0.1 . 1 . . . . A 32 MET CA . 36075 1
376 . 1 1 32 32 MET CB C 13 33.25 0.1 . 1 . . . . A 32 MET CB . 36075 1
377 . 1 1 32 32 MET CG C 13 34.65 0.1 . 1 . . . . A 32 MET CG . 36075 1
378 . 1 1 32 32 MET CE C 13 18.41 0.1 . 1 . . . . A 32 MET CE . 36075 1
379 . 1 1 32 32 MET N N 15 116.02 0.2 . 1 . . . . A 32 MET N . 36075 1
380 . 1 1 33 33 GLY H H 1 7.88 0.03 . 1 . . . . A 33 GLY H . 36075 1
381 . 1 1 33 33 GLY HA2 H 1 3.9 0.03 . 2 . . . . A 33 GLY HA2 . 36075 1
382 . 1 1 33 33 GLY HA3 H 1 4.01 0.03 . 2 . . . . A 33 GLY HA3 . 36075 1
383 . 1 1 33 33 GLY C C 13 175.41 0.1 . 1 . . . . A 33 GLY C . 36075 1
384 . 1 1 33 33 GLY CA C 13 45.51 0.1 . 1 . . . . A 33 GLY CA . 36075 1
385 . 1 1 33 33 GLY N N 15 108.65 0.2 . 1 . . . . A 33 GLY N . 36075 1
386 . 1 1 34 34 TYR H H 1 8.52 0.03 . 1 . . . . A 34 TYR H . 36075 1
387 . 1 1 34 34 TYR HA H 1 4.33 0.03 . 1 . . . . A 34 TYR HA . 36075 1
388 . 1 1 34 34 TYR HB2 H 1 2.87 0.03 . 2 . . . . A 34 TYR HB2 . 36075 1
389 . 1 1 34 34 TYR HB3 H 1 3.14 0.03 . 2 . . . . A 34 TYR HB3 . 36075 1
390 . 1 1 34 34 TYR HD1 H 1 7.01 0.03 . 1 . . . . A 34 TYR HD1 . 36075 1
391 . 1 1 34 34 TYR HD2 H 1 7.01 0.03 . 1 . . . . A 34 TYR HD2 . 36075 1
392 . 1 1 34 34 TYR HE1 H 1 6.85 0.03 . 1 . . . . A 34 TYR HE1 . 36075 1
393 . 1 1 34 34 TYR HE2 H 1 6.85 0.03 . 1 . . . . A 34 TYR HE2 . 36075 1
394 . 1 1 34 34 TYR C C 13 176.41 0.1 . 1 . . . . A 34 TYR C . 36075 1
395 . 1 1 34 34 TYR CA C 13 58.23 0.1 . 1 . . . . A 34 TYR CA . 36075 1
396 . 1 1 34 34 TYR CB C 13 40.58 0.1 . 1 . . . . A 34 TYR CB . 36075 1
397 . 1 1 34 34 TYR CD1 C 13 131.2 0.1 . 1 . . . . A 34 TYR CD1 . 36075 1
398 . 1 1 34 34 TYR CD2 C 13 131.2 0.1 . 1 . . . . A 34 TYR CD2 . 36075 1
399 . 1 1 34 34 TYR CE1 C 13 115.95 0.1 . 1 . . . . A 34 TYR CE1 . 36075 1
400 . 1 1 34 34 TYR CE2 C 13 115.95 0.1 . 1 . . . . A 34 TYR CE2 . 36075 1
401 . 1 1 34 34 TYR N N 15 118.41 0.2 . 1 . . . . A 34 TYR N . 36075 1
402 . 1 1 35 35 ILE H H 1 8.01 0.03 . 1 . . . . A 35 ILE H . 36075 1
403 . 1 1 35 35 ILE HA H 1 3.08 0.03 . 1 . . . . A 35 ILE HA . 36075 1
404 . 1 1 35 35 ILE HB H 1 1.89 0.03 . 1 . . . . A 35 ILE HB . 36075 1
405 . 1 1 35 35 ILE HG12 H 1 1.23 0.03 . 1 . . . . A 35 ILE HG12 . 36075 1
406 . 1 1 35 35 ILE HG13 H 1 1.23 0.03 . 1 . . . . A 35 ILE HG13 . 36075 1
407 . 1 1 35 35 ILE HG21 H 1 0.52 0.03 . 1 . . . . A 35 ILE HG21 . 36075 1
408 . 1 1 35 35 ILE HG22 H 1 0.52 0.03 . 1 . . . . A 35 ILE HG22 . 36075 1
409 . 1 1 35 35 ILE HG23 H 1 0.52 0.03 . 1 . . . . A 35 ILE HG23 . 36075 1
410 . 1 1 35 35 ILE HD11 H 1 0.39 0.03 . 1 . . . . A 35 ILE HD11 . 36075 1
411 . 1 1 35 35 ILE HD12 H 1 0.39 0.03 . 1 . . . . A 35 ILE HD12 . 36075 1
412 . 1 1 35 35 ILE HD13 H 1 0.39 0.03 . 1 . . . . A 35 ILE HD13 . 36075 1
413 . 1 1 35 35 ILE C C 13 171.41 0.1 . 1 . . . . A 35 ILE C . 36075 1
414 . 1 1 35 35 ILE CA C 13 60.98 0.1 . 1 . . . . A 35 ILE CA . 36075 1
415 . 1 1 35 35 ILE CB C 13 41.52 0.1 . 1 . . . . A 35 ILE CB . 36075 1
416 . 1 1 35 35 ILE CG1 C 13 28.14 0.1 . 1 . . . . A 35 ILE CG1 . 36075 1
417 . 1 1 35 35 ILE CG2 C 13 15.41 0.1 . 1 . . . . A 35 ILE CG2 . 36075 1
418 . 1 1 35 35 ILE CD1 C 13 14.52 0.1 . 1 . . . . A 35 ILE CD1 . 36075 1
419 . 1 1 35 35 ILE N N 15 119.77 0.2 . 1 . . . . A 35 ILE N . 36075 1
420 . 1 1 36 36 GLN H H 1 7.98 0.03 . 1 . . . . A 36 GLN H . 36075 1
421 . 1 1 36 36 GLN HA H 1 4.36 0.03 . 1 . . . . A 36 GLN HA . 36075 1
422 . 1 1 36 36 GLN HB2 H 1 2.55 0.03 . 1 . . . . A 36 GLN HB2 . 36075 1
423 . 1 1 36 36 GLN HB3 H 1 2.55 0.03 . 1 . . . . A 36 GLN HB3 . 36075 1
424 . 1 1 36 36 GLN HG2 H 1 2.14 0.03 . 1 . . . . A 36 GLN HG2 . 36075 1
425 . 1 1 36 36 GLN HG3 H 1 2.14 0.03 . 1 . . . . A 36 GLN HG3 . 36075 1
426 . 1 1 36 36 GLN HE21 H 1 7.4 0.03 . 2 . . . . A 36 GLN HE21 . 36075 1
427 . 1 1 36 36 GLN HE22 H 1 7 0.03 . 2 . . . . A 36 GLN HE22 . 36075 1
428 . 1 1 36 36 GLN C C 13 178.365 0.1 . 1 . . . . A 36 GLN C . 36075 1
429 . 1 1 36 36 GLN CA C 13 56.41 0.1 . 1 . . . . A 36 GLN CA . 36075 1
430 . 1 1 36 36 GLN CB C 13 29.56 0.1 . 1 . . . . A 36 GLN CB . 36075 1
431 . 1 1 36 36 GLN CG C 13 35.14 0.1 . 1 . . . . A 36 GLN CG . 36075 1
432 . 1 1 36 36 GLN N N 15 121.41 0.2 . 1 . . . . A 36 GLN N . 36075 1
433 . 1 1 36 36 GLN NE2 N 15 115.14 0.2 . 1 . . . . A 36 GLN NE2 . 36075 1
434 . 1 1 37 37 GLY H H 1 9.45 0.03 . 1 . . . . A 37 GLY H . 36075 1
435 . 1 1 37 37 GLY HA2 H 1 3.93 0.03 . 1 . . . . A 37 GLY HA2 . 36075 1
436 . 1 1 37 37 GLY HA3 H 1 3.93 0.03 . 1 . . . . A 37 GLY HA3 . 36075 1
437 . 1 1 37 37 GLY C C 13 176.54 0.1 . 1 . . . . A 37 GLY C . 36075 1
438 . 1 1 37 37 GLY CA C 13 45.52 0.1 . 1 . . . . A 37 GLY CA . 36075 1
439 . 1 1 37 37 GLY N N 15 109.14 0.2 . 1 . . . . A 37 GLY N . 36075 1
440 . 1 1 38 38 ASP H H 1 8.91 0.03 . 1 . . . . A 38 ASP H . 36075 1
441 . 1 1 38 38 ASP HA H 1 4.54 0.03 . 1 . . . . A 38 ASP HA . 36075 1
442 . 1 1 38 38 ASP HB2 H 1 2.31 0.03 . 1 . . . . A 38 ASP HB2 . 36075 1
443 . 1 1 38 38 ASP HB3 H 1 2.31 0.03 . 1 . . . . A 38 ASP HB3 . 36075 1
444 . 1 1 38 38 ASP C C 13 178.95 0.1 . 1 . . . . A 38 ASP C . 36075 1
445 . 1 1 38 38 ASP CA C 13 54.74 0.1 . 1 . . . . A 38 ASP CA . 36075 1
446 . 1 1 38 38 ASP CB C 13 38.744 0.1 . 1 . . . . A 38 ASP CB . 36075 1
447 . 1 1 38 38 ASP N N 15 120.99 0.2 . 1 . . . . A 38 ASP N . 36075 1
448 . 1 1 39 39 SER H H 1 8.97 0.03 . 1 . . . . A 39 SER H . 36075 1
449 . 1 1 39 39 SER HA H 1 4.34 0.03 . 1 . . . . A 39 SER HA . 36075 1
450 . 1 1 39 39 SER HB2 H 1 4.35 0.03 . 2 . . . . A 39 SER HB2 . 36075 1
451 . 1 1 39 39 SER HB3 H 1 4.15 0.03 . 2 . . . . A 39 SER HB3 . 36075 1
452 . 1 1 39 39 SER C C 13 178.54 0.1 . 1 . . . . A 39 SER C . 36075 1
453 . 1 1 39 39 SER CA C 13 58.21 0.1 . 1 . . . . A 39 SER CA . 36075 1
454 . 1 1 39 39 SER CB C 13 65.14 0.1 . 1 . . . . A 39 SER CB . 36075 1
455 . 1 1 39 39 SER N N 15 116.7 0.2 . 1 . . . . A 39 SER N . 36075 1
456 . 1 1 40 40 ALA H H 1 7.93 0.03 . 1 . . . . A 40 ALA H . 36075 1
457 . 1 1 40 40 ALA HA H 1 4.2 0.03 . 1 . . . . A 40 ALA HA . 36075 1
458 . 1 1 40 40 ALA HB1 H 1 1.78 0.03 . 1 . . . . A 40 ALA HB1 . 36075 1
459 . 1 1 40 40 ALA HB2 H 1 1.78 0.03 . 1 . . . . A 40 ALA HB2 . 36075 1
460 . 1 1 40 40 ALA HB3 H 1 1.78 0.03 . 1 . . . . A 40 ALA HB3 . 36075 1
461 . 1 1 40 40 ALA C C 13 179.81 0.1 . 1 . . . . A 40 ALA C . 36075 1
462 . 1 1 40 40 ALA CA C 13 53.44 0.1 . 1 . . . . A 40 ALA CA . 36075 1
463 . 1 1 40 40 ALA CB C 13 23.1 0.1 . 1 . . . . A 40 ALA CB . 36075 1
464 . 1 1 40 40 ALA N N 15 123.54 0.2 . 1 . . . . A 40 ALA N . 36075 1
465 . 1 1 41 41 ALA H H 1 7.93 0.03 . 1 . . . . A 41 ALA H . 36075 1
466 . 1 1 41 41 ALA HA H 1 4.1 0.03 . 1 . . . . A 41 ALA HA . 36075 1
467 . 1 1 41 41 ALA HB1 H 1 1.96 0.03 . 1 . . . . A 41 ALA HB1 . 36075 1
468 . 1 1 41 41 ALA HB2 H 1 1.96 0.03 . 1 . . . . A 41 ALA HB2 . 36075 1
469 . 1 1 41 41 ALA HB3 H 1 1.96 0.03 . 1 . . . . A 41 ALA HB3 . 36075 1
470 . 1 1 41 41 ALA C C 13 179.41 0.1 . 1 . . . . A 41 ALA C . 36075 1
471 . 1 1 41 41 ALA CA C 13 52.41 0.1 . 1 . . . . A 41 ALA CA . 36075 1
472 . 1 1 41 41 ALA CB C 13 19.04 0.1 . 1 . . . . A 41 ALA CB . 36075 1
473 . 1 1 41 41 ALA N N 15 122.41 0.2 . 1 . . . . A 41 ALA N . 36075 1
474 . 1 1 42 42 GLU H H 1 7.14 0.03 . 1 . . . . A 42 GLU H . 36075 1
475 . 1 1 42 42 GLU HA H 1 3.98 0.03 . 1 . . . . A 42 GLU HA . 36075 1
476 . 1 1 42 42 GLU HB2 H 1 1.88 0.03 . 2 . . . . A 42 GLU HB2 . 36075 1
477 . 1 1 42 42 GLU HB3 H 1 1.78 0.03 . 2 . . . . A 42 GLU HB3 . 36075 1
478 . 1 1 42 42 GLU HG2 H 1 2.3 0.03 . 1 . . . . A 42 GLU HG2 . 36075 1
479 . 1 1 42 42 GLU HG3 H 1 2.3 0.03 . 1 . . . . A 42 GLU HG3 . 36075 1
480 . 1 1 42 42 GLU C C 13 174.35 0.1 . 1 . . . . A 42 GLU C . 36075 1
481 . 1 1 42 42 GLU CA C 13 57.25 0.1 . 1 . . . . A 42 GLU CA . 36075 1
482 . 1 1 42 42 GLU CB C 13 33.25 0.1 . 1 . . . . A 42 GLU CB . 36075 1
483 . 1 1 42 42 GLU CG C 13 37.41 0.1 . 1 . . . . A 42 GLU CG . 36075 1
484 . 1 1 42 42 GLU N N 15 119.8 0.2 . 1 . . . . A 42 GLU N . 36075 1
485 . 1 1 43 43 VAL H H 1 7.16 0.03 . 1 . . . . A 43 VAL H . 36075 1
486 . 1 1 43 43 VAL HA H 1 3.86 0.03 . 1 . . . . A 43 VAL HA . 36075 1
487 . 1 1 43 43 VAL HB H 1 1.67 0.03 . 1 . . . . A 43 VAL HB . 36075 1
488 . 1 1 43 43 VAL HG11 H 1 0.696 0.03 . 1 . . . . A 43 VAL HG11 . 36075 1
489 . 1 1 43 43 VAL HG12 H 1 0.696 0.03 . 1 . . . . A 43 VAL HG12 . 36075 1
490 . 1 1 43 43 VAL HG13 H 1 0.696 0.03 . 1 . . . . A 43 VAL HG13 . 36075 1
491 . 1 1 43 43 VAL HG21 H 1 0.321 0.03 . 1 . . . . A 43 VAL HG21 . 36075 1
492 . 1 1 43 43 VAL HG22 H 1 0.321 0.03 . 1 . . . . A 43 VAL HG22 . 36075 1
493 . 1 1 43 43 VAL HG23 H 1 0.321 0.03 . 1 . . . . A 43 VAL HG23 . 36075 1
494 . 1 1 43 43 VAL C C 13 179.63 0.1 . 1 . . . . A 43 VAL C . 36075 1
495 . 1 1 43 43 VAL CA C 13 62.52 0.1 . 1 . . . . A 43 VAL CA . 36075 1
496 . 1 1 43 43 VAL CB C 13 35.14 0.1 . 1 . . . . A 43 VAL CB . 36075 1
497 . 1 1 43 43 VAL CG1 C 13 21.36 0.1 . 2 . . . . A 43 VAL CG1 . 36075 1
498 . 1 1 43 43 VAL CG2 C 13 22.25 0.1 . 2 . . . . A 43 VAL CG2 . 36075 1
499 . 1 1 43 43 VAL N N 15 121.14 0.2 . 1 . . . . A 43 VAL N . 36075 1
500 . 1 1 44 44 THR H H 1 8.66 0.03 . 1 . . . . A 44 THR H . 36075 1
501 . 1 1 44 44 THR HA H 1 4.06 0.03 . 1 . . . . A 44 THR HA . 36075 1
502 . 1 1 44 44 THR HB H 1 3.85 0.03 . 1 . . . . A 44 THR HB . 36075 1
503 . 1 1 44 44 THR HG21 H 1 0.94 0.03 . 1 . . . . A 44 THR HG21 . 36075 1
504 . 1 1 44 44 THR HG22 H 1 0.94 0.03 . 1 . . . . A 44 THR HG22 . 36075 1
505 . 1 1 44 44 THR HG23 H 1 0.94 0.03 . 1 . . . . A 44 THR HG23 . 36075 1
506 . 1 1 44 44 THR C C 13 176.52 0.1 . 1 . . . . A 44 THR C . 36075 1
507 . 1 1 44 44 THR CA C 13 62.41 0.1 . 1 . . . . A 44 THR CA . 36075 1
508 . 1 1 44 44 THR CB C 13 70.25 0.1 . 1 . . . . A 44 THR CB . 36075 1
509 . 1 1 44 44 THR CG2 C 13 23.85 0.1 . 1 . . . . A 44 THR CG2 . 36075 1
510 . 1 1 44 44 THR N N 15 115.4 0.2 . 1 . . . . A 44 THR N . 36075 1
511 . 1 1 45 45 GLU H H 1 7.84 0.03 . 1 . . . . A 45 GLU H . 36075 1
512 . 1 1 45 45 GLU HA H 1 4.29 0.03 . 1 . . . . A 45 GLU HA . 36075 1
513 . 1 1 45 45 GLU HB2 H 1 1.99 0.03 . 1 . . . . A 45 GLU HB2 . 36075 1
514 . 1 1 45 45 GLU HB3 H 1 1.99 0.03 . 1 . . . . A 45 GLU HB3 . 36075 1
515 . 1 1 45 45 GLU HG2 H 1 2.3 0.03 . 1 . . . . A 45 GLU HG2 . 36075 1
516 . 1 1 45 45 GLU HG3 H 1 2.3 0.03 . 1 . . . . A 45 GLU HG3 . 36075 1
517 . 1 1 45 45 GLU C C 13 174.25 0.1 . 1 . . . . A 45 GLU C . 36075 1
518 . 1 1 45 45 GLU CA C 13 56.5 0.1 . 1 . . . . A 45 GLU CA . 36075 1
519 . 1 1 45 45 GLU CB C 13 32.54 0.1 . 1 . . . . A 45 GLU CB . 36075 1
520 . 1 1 45 45 GLU CG C 13 38.52 0.1 . 1 . . . . A 45 GLU CG . 36075 1
521 . 1 1 45 45 GLU N N 15 120.58 0.2 . 1 . . . . A 45 GLU N . 36075 1
522 . 1 1 46 46 MET H H 1 7.43 0.03 . 1 . . . . A 46 MET H . 36075 1
523 . 1 1 46 46 MET HA H 1 4.23 0.03 . 1 . . . . A 46 MET HA . 36075 1
524 . 1 1 46 46 MET HB2 H 1 1.85 0.03 . 2 . . . . A 46 MET HB2 . 36075 1
525 . 1 1 46 46 MET HB3 H 1 1.78 0.03 . 2 . . . . A 46 MET HB3 . 36075 1
526 . 1 1 46 46 MET HG2 H 1 2.22 0.03 . 1 . . . . A 46 MET HG2 . 36075 1
527 . 1 1 46 46 MET HG3 H 1 2.22 0.03 . 1 . . . . A 46 MET HG3 . 36075 1
528 . 1 1 46 46 MET HE1 H 1 1.5 0.03 . 1 . . . . A 46 MET HE1 . 36075 1
529 . 1 1 46 46 MET HE2 H 1 1.5 0.03 . 1 . . . . A 46 MET HE2 . 36075 1
530 . 1 1 46 46 MET HE3 H 1 1.5 0.03 . 1 . . . . A 46 MET HE3 . 36075 1
531 . 1 1 46 46 MET C C 13 179.5 0.1 . 1 . . . . A 46 MET C . 36075 1
532 . 1 1 46 46 MET CA C 13 55.47 0.1 . 1 . . . . A 46 MET CA . 36075 1
533 . 1 1 46 46 MET CB C 13 29.52 0.1 . 1 . . . . A 46 MET CB . 36075 1
534 . 1 1 46 46 MET CG C 13 33.14 0.1 . 1 . . . . A 46 MET CG . 36075 1
535 . 1 1 46 46 MET CE C 13 18.41 0.1 . 1 . . . . A 46 MET CE . 36075 1
536 . 1 1 46 46 MET N N 15 120.85 0.2 . 1 . . . . A 46 MET N . 36075 1
537 . 1 1 47 47 ALA H H 1 7.45 0.03 . 1 . . . . A 47 ALA H . 36075 1
538 . 1 1 47 47 ALA HA H 1 4.04 0.03 . 1 . . . . A 47 ALA HA . 36075 1
539 . 1 1 47 47 ALA HB1 H 1 1.83 0.03 . 1 . . . . A 47 ALA HB1 . 36075 1
540 . 1 1 47 47 ALA HB2 H 1 1.83 0.03 . 1 . . . . A 47 ALA HB2 . 36075 1
541 . 1 1 47 47 ALA HB3 H 1 1.83 0.03 . 1 . . . . A 47 ALA HB3 . 36075 1
542 . 1 1 47 47 ALA C C 13 178.3 0.1 . 1 . . . . A 47 ALA C . 36075 1
543 . 1 1 47 47 ALA CA C 13 53.41 0.1 . 1 . . . . A 47 ALA CA . 36075 1
544 . 1 1 47 47 ALA CB C 13 23.21 0.1 . 1 . . . . A 47 ALA CB . 36075 1
545 . 1 1 47 47 ALA N N 15 123.4 0.2 . 1 . . . . A 47 ALA N . 36075 1
546 . 1 1 48 48 HIS H H 1 8.33 0.03 . 1 . . . . A 48 HIS H . 36075 1
547 . 1 1 48 48 HIS HA H 1 4.86 0.03 . 1 . . . . A 48 HIS HA . 36075 1
548 . 1 1 48 48 HIS HB2 H 1 3.25 0.03 . 1 . . . . A 48 HIS HB2 . 36075 1
549 . 1 1 48 48 HIS HB3 H 1 3.25 0.03 . 1 . . . . A 48 HIS HB3 . 36075 1
550 . 1 1 48 48 HIS HD2 H 1 6.53 0.03 . 1 . . . . A 48 HIS HD2 . 36075 1
551 . 1 1 48 48 HIS HE1 H 1 7.14 0.03 . 1 . . . . A 48 HIS HE1 . 36075 1
552 . 1 1 48 48 HIS C C 13 173.2 0.1 . 1 . . . . A 48 HIS C . 36075 1
553 . 1 1 48 48 HIS CA C 13 56.47 0.1 . 1 . . . . A 48 HIS CA . 36075 1
554 . 1 1 48 48 HIS CB C 13 32.59 0.1 . 1 . . . . A 48 HIS CB . 36075 1
555 . 1 1 48 48 HIS CD2 C 13 123.25 0.1 . 1 . . . . A 48 HIS CD2 . 36075 1
556 . 1 1 48 48 HIS CE1 C 13 139.5 0.1 . 1 . . . . A 48 HIS CE1 . 36075 1
557 . 1 1 48 48 HIS N N 15 119.2 0.2 . 1 . . . . A 48 HIS N . 36075 1
558 . 1 1 49 49 THR HA H 1 4.11 0.03 . 1 . . . . A 49 THR HA . 36075 1
559 . 1 1 49 49 THR HB H 1 3.5 0.03 . 1 . . . . A 49 THR HB . 36075 1
560 . 1 1 49 49 THR HG21 H 1 0.97 0.03 . 1 . . . . A 49 THR HG21 . 36075 1
561 . 1 1 49 49 THR HG22 H 1 0.97 0.03 . 1 . . . . A 49 THR HG22 . 36075 1
562 . 1 1 49 49 THR HG23 H 1 0.97 0.03 . 1 . . . . A 49 THR HG23 . 36075 1
563 . 1 1 49 49 THR C C 13 176.52 0.1 . 1 . . . . A 49 THR C . 36075 1
564 . 1 1 49 49 THR CA C 13 61.97 0.1 . 1 . . . . A 49 THR CA . 36075 1
565 . 1 1 49 49 THR CB C 13 71.22 0.1 . 1 . . . . A 49 THR CB . 36075 1
566 . 1 1 49 49 THR CG2 C 13 19.5 0.1 . 1 . . . . A 49 THR CG2 . 36075 1
567 . 1 1 50 50 GLU H H 1 7.88 0.03 . 1 . . . . A 50 GLU H . 36075 1
568 . 1 1 50 50 GLU HA H 1 4.09 0.03 . 1 . . . . A 50 GLU HA . 36075 1
569 . 1 1 50 50 GLU HB2 H 1 1.85 0.03 . 1 . . . . A 50 GLU HB2 . 36075 1
570 . 1 1 50 50 GLU HB3 H 1 1.85 0.03 . 1 . . . . A 50 GLU HB3 . 36075 1
571 . 1 1 50 50 GLU HG2 H 1 2.5 0.03 . 1 . . . . A 50 GLU HG2 . 36075 1
572 . 1 1 50 50 GLU HG3 H 1 2.5 0.03 . 1 . . . . A 50 GLU HG3 . 36075 1
573 . 1 1 50 50 GLU C C 13 179.87 0.1 . 1 . . . . A 50 GLU C . 36075 1
574 . 1 1 50 50 GLU CA C 13 57.41 0.1 . 1 . . . . A 50 GLU CA . 36075 1
575 . 1 1 50 50 GLU CB C 13 29.14 0.1 . 1 . . . . A 50 GLU CB . 36075 1
576 . 1 1 50 50 GLU CG C 13 35.49 0.1 . 1 . . . . A 50 GLU CG . 36075 1
577 . 1 1 50 50 GLU N N 15 120.69 0.2 . 1 . . . . A 50 GLU N . 36075 1
578 . 1 1 51 51 THR H H 1 7.19 0.03 . 1 . . . . A 51 THR H . 36075 1
579 . 1 1 51 51 THR HA H 1 3.81 0.03 . 1 . . . . A 51 THR HA . 36075 1
580 . 1 1 51 51 THR HB H 1 4.51 0.03 . 1 . . . . A 51 THR HB . 36075 1
581 . 1 1 51 51 THR HG21 H 1 1.35 0.03 . 1 . . . . A 51 THR HG21 . 36075 1
582 . 1 1 51 51 THR HG22 H 1 1.35 0.03 . 1 . . . . A 51 THR HG22 . 36075 1
583 . 1 1 51 51 THR HG23 H 1 1.35 0.03 . 1 . . . . A 51 THR HG23 . 36075 1
584 . 1 1 51 51 THR C C 13 176.85 0.1 . 1 . . . . A 51 THR C . 36075 1
585 . 1 1 51 51 THR CA C 13 62.84 0.1 . 1 . . . . A 51 THR CA . 36075 1
586 . 1 1 51 51 THR CB C 13 70.68 0.1 . 1 . . . . A 51 THR CB . 36075 1
587 . 1 1 51 51 THR CG2 C 13 20.1 0.1 . 1 . . . . A 51 THR CG2 . 36075 1
588 . 1 1 51 51 THR N N 15 115.5 0.2 . 1 . . . . A 51 THR N . 36075 1
589 . 1 1 52 52 GLY H H 1 8.52 0.03 . 1 . . . . A 52 GLY H . 36075 1
590 . 1 1 52 52 GLY HA2 H 1 4.68 0.03 . 1 . . . . A 52 GLY HA2 . 36075 1
591 . 1 1 52 52 GLY HA3 H 1 4.68 0.03 . 1 . . . . A 52 GLY HA3 . 36075 1
592 . 1 1 52 52 GLY C C 13 173.5 0.1 . 1 . . . . A 52 GLY C . 36075 1
593 . 1 1 52 52 GLY CA C 13 45.38 0.1 . 1 . . . . A 52 GLY CA . 36075 1
594 . 1 1 52 52 GLY N N 15 109.98 0.2 . 1 . . . . A 52 GLY N . 36075 1
595 . 1 1 53 53 TRP H H 1 8.74 0.03 . 1 . . . . A 53 TRP H . 36075 1
596 . 1 1 53 53 TRP HA H 1 4.78 0.03 . 1 . . . . A 53 TRP HA . 36075 1
597 . 1 1 53 53 TRP HB2 H 1 3.52 0.03 . 1 . . . . A 53 TRP HB2 . 36075 1
598 . 1 1 53 53 TRP HB3 H 1 3.52 0.03 . 1 . . . . A 53 TRP HB3 . 36075 1
599 . 1 1 53 53 TRP HD1 H 1 7.25 0.03 . 1 . . . . A 53 TRP HD1 . 36075 1
600 . 1 1 53 53 TRP HE1 H 1 8.54 0.03 . 1 . . . . A 53 TRP HE1 . 36075 1
601 . 1 1 53 53 TRP HE3 H 1 7.31 0.03 . 1 . . . . A 53 TRP HE3 . 36075 1
602 . 1 1 53 53 TRP HZ2 H 1 6.54 0.03 . 1 . . . . A 53 TRP HZ2 . 36075 1
603 . 1 1 53 53 TRP HZ3 H 1 6.21 0.03 . 1 . . . . A 53 TRP HZ3 . 36075 1
604 . 1 1 53 53 TRP HH2 H 1 6.1 0.03 . 1 . . . . A 53 TRP HH2 . 36075 1
605 . 1 1 53 53 TRP C C 13 171.01 0.1 . 1 . . . . A 53 TRP C . 36075 1
606 . 1 1 53 53 TRP CA C 13 57.41 0.1 . 1 . . . . A 53 TRP CA . 36075 1
607 . 1 1 53 53 TRP CB C 13 29.52 0.1 . 1 . . . . A 53 TRP CB . 36075 1
608 . 1 1 53 53 TRP CD1 C 13 128.54 0.1 . 1 . . . . A 53 TRP CD1 . 36075 1
609 . 1 1 53 53 TRP CE3 C 13 125.14 0.1 . 1 . . . . A 53 TRP CE3 . 36075 1
610 . 1 1 53 53 TRP CZ2 C 13 115.81 0.1 . 1 . . . . A 53 TRP CZ2 . 36075 1
611 . 1 1 53 53 TRP CZ3 C 13 119.54 0.1 . 1 . . . . A 53 TRP CZ3 . 36075 1
612 . 1 1 53 53 TRP CH2 C 13 125.41 0.1 . 1 . . . . A 53 TRP CH2 . 36075 1
613 . 1 1 53 53 TRP N N 15 122.51 0.2 . 1 . . . . A 53 TRP N . 36075 1
614 . 1 1 53 53 TRP NE1 N 15 129.59 0.2 . 1 . . . . A 53 TRP NE1 . 36075 1
615 . 1 1 54 54 SER H H 1 8.03 0.03 . 1 . . . . A 54 SER H . 36075 1
616 . 1 1 54 54 SER HA H 1 3.39 0.03 . 1 . . . . A 54 SER HA . 36075 1
617 . 1 1 54 54 SER HB2 H 1 3.52 0.03 . 1 . . . . A 54 SER HB2 . 36075 1
618 . 1 1 54 54 SER HB3 H 1 3.52 0.03 . 1 . . . . A 54 SER HB3 . 36075 1
619 . 1 1 54 54 SER C C 13 176.5 0.1 . 1 . . . . A 54 SER C . 36075 1
620 . 1 1 54 54 SER CA C 13 58.47 0.1 . 1 . . . . A 54 SER CA . 36075 1
621 . 1 1 54 54 SER CB C 13 68.2 0.1 . 1 . . . . A 54 SER CB . 36075 1
622 . 1 1 54 54 SER N N 15 119.8 0.2 . 1 . . . . A 54 SER N . 36075 1
623 . 1 1 55 55 CYS H H 1 10.25 0.03 . 1 . . . . A 55 CYS H . 36075 1
624 . 1 1 55 55 CYS HA H 1 4.11 0.03 . 1 . . . . A 55 CYS HA . 36075 1
625 . 1 1 55 55 CYS HB2 H 1 2.55 0.03 . 2 . . . . A 55 CYS HB2 . 36075 1
626 . 1 1 55 55 CYS HB3 H 1 2.51 0.03 . 2 . . . . A 55 CYS HB3 . 36075 1
627 . 1 1 55 55 CYS CA C 13 58.32 0.1 . 1 . . . . A 55 CYS CA . 36075 1
628 . 1 1 55 55 CYS CB C 13 28.14 0.1 . 1 . . . . A 55 CYS CB . 36075 1
629 . 1 1 55 55 CYS N N 15 124.14 0.2 . 1 . . . . A 55 CYS N . 36075 1
630 . 1 1 56 56 HIS H H 1 7.69 0.03 . 1 . . . . A 56 HIS H . 36075 1
631 . 1 1 56 56 HIS HA H 1 4.33 0.03 . 1 . . . . A 56 HIS HA . 36075 1
632 . 1 1 56 56 HIS HB2 H 1 2.51 0.03 . 1 . . . . A 56 HIS HB2 . 36075 1
633 . 1 1 56 56 HIS HB3 H 1 2.51 0.03 . 1 . . . . A 56 HIS HB3 . 36075 1
634 . 1 1 56 56 HIS HD2 H 1 6.25 0.03 . 1 . . . . A 56 HIS HD2 . 36075 1
635 . 1 1 56 56 HIS HE1 H 1 6.25 0.03 . 1 . . . . A 56 HIS HE1 . 36075 1
636 . 1 1 56 56 HIS C C 13 178.14 0.1 . 1 . . . . A 56 HIS C . 36075 1
637 . 1 1 56 56 HIS CA C 13 56.78 0.1 . 1 . . . . A 56 HIS CA . 36075 1
638 . 1 1 56 56 HIS CB C 13 29.54 0.1 . 1 . . . . A 56 HIS CB . 36075 1
639 . 1 1 56 56 HIS CD2 C 13 123.25 0.1 . 1 . . . . A 56 HIS CD2 . 36075 1
640 . 1 1 56 56 HIS CE1 C 13 137.709 0.1 . 1 . . . . A 56 HIS CE1 . 36075 1
641 . 1 1 56 56 HIS N N 15 115.41 0.2 . 1 . . . . A 56 HIS N . 36075 1
642 . 1 1 57 57 TYR H H 1 9.41 0.03 . 1 . . . . A 57 TYR H . 36075 1
643 . 1 1 57 57 TYR HA H 1 3.99 0.03 . 1 . . . . A 57 TYR HA . 36075 1
644 . 1 1 57 57 TYR HB2 H 1 3.12 0.03 . 1 . . . . A 57 TYR HB2 . 36075 1
645 . 1 1 57 57 TYR HB3 H 1 3.12 0.03 . 1 . . . . A 57 TYR HB3 . 36075 1
646 . 1 1 57 57 TYR HD1 H 1 7.51 0.03 . 1 . . . . A 57 TYR HD1 . 36075 1
647 . 1 1 57 57 TYR HD2 H 1 7.51 0.03 . 1 . . . . A 57 TYR HD2 . 36075 1
648 . 1 1 57 57 TYR HE1 H 1 6.99 0.03 . 1 . . . . A 57 TYR HE1 . 36075 1
649 . 1 1 57 57 TYR HE2 H 1 6.99 0.03 . 1 . . . . A 57 TYR HE2 . 36075 1
650 . 1 1 57 57 TYR C C 13 179.51 0.1 . 1 . . . . A 57 TYR C . 36075 1
651 . 1 1 57 57 TYR CA C 13 58.12 0.1 . 1 . . . . A 57 TYR CA . 36075 1
652 . 1 1 57 57 TYR CB C 13 35.41 0.1 . 1 . . . . A 57 TYR CB . 36075 1
653 . 1 1 57 57 TYR CD1 C 13 135.41 0.1 . 1 . . . . A 57 TYR CD1 . 36075 1
654 . 1 1 57 57 TYR CD2 C 13 135.41 0.1 . 1 . . . . A 57 TYR CD2 . 36075 1
655 . 1 1 57 57 TYR CE1 C 13 121.1 0.1 . 1 . . . . A 57 TYR CE1 . 36075 1
656 . 1 1 57 57 TYR CE2 C 13 121.1 0.1 . 1 . . . . A 57 TYR CE2 . 36075 1
657 . 1 1 57 57 TYR N N 15 120.85 0.2 . 1 . . . . A 57 TYR N . 36075 1
658 . 1 1 58 58 CYS H H 1 8.65 0.03 . 1 . . . . A 58 CYS H . 36075 1
659 . 1 1 58 58 CYS HA H 1 4.32 0.03 . 1 . . . . A 58 CYS HA . 36075 1
660 . 1 1 58 58 CYS HB2 H 1 2.9 0.03 . 2 . . . . A 58 CYS HB2 . 36075 1
661 . 1 1 58 58 CYS HB3 H 1 2.82 0.03 . 2 . . . . A 58 CYS HB3 . 36075 1
662 . 1 1 58 58 CYS C C 13 179.5 0.1 . 1 . . . . A 58 CYS C . 36075 1
663 . 1 1 58 58 CYS CA C 13 58.21 0.1 . 1 . . . . A 58 CYS CA . 36075 1
664 . 1 1 58 58 CYS CB C 13 29.74 0.1 . 1 . . . . A 58 CYS CB . 36075 1
665 . 1 1 58 58 CYS N N 15 121.7 0.2 . 1 . . . . A 58 CYS N . 36075 1
666 . 1 1 59 59 ASP H H 1 8.57 0.03 . 1 . . . . A 59 ASP H . 36075 1
667 . 1 1 59 59 ASP HA H 1 4.18 0.03 . 1 . . . . A 59 ASP HA . 36075 1
668 . 1 1 59 59 ASP HB2 H 1 2.54 0.03 . 1 . . . . A 59 ASP HB2 . 36075 1
669 . 1 1 59 59 ASP HB3 H 1 2.54 0.03 . 1 . . . . A 59 ASP HB3 . 36075 1
670 . 1 1 59 59 ASP C C 13 174.52 0.1 . 1 . . . . A 59 ASP C . 36075 1
671 . 1 1 59 59 ASP CA C 13 53.65 0.1 . 1 . . . . A 59 ASP CA . 36075 1
672 . 1 1 59 59 ASP CB C 13 39.7 0.1 . 1 . . . . A 59 ASP CB . 36075 1
stop_
save_