Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27415
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 27415 1
2 '2D 1H-13C HSQC aliphatic' . . . 27415 1
5 '3D 1H-15N TOCSY' . . . 27415 1
7 '3D C(CO)NH' . . . 27415 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 PRO C C 13 177.2 0.2 . 1 . . . . . 2 PRO C . 27415 1
2 . 1 1 2 2 PRO CA C 13 63.5 0.2 . 1 . . . . . 2 PRO CA . 27415 1
3 . 1 1 2 2 PRO CB C 13 32.2 0.2 . 1 . . . . . 2 PRO CB . 27415 1
4 . 1 1 2 2 PRO CG C 13 27.0 0.2 . 1 . . . . . 2 PRO CG . 27415 1
5 . 1 1 2 2 PRO CD C 13 49.6 0.2 . 1 . . . . . 2 PRO CD . 27415 1
6 . 1 1 3 3 GLY H H 1 8.62 0.02 . 1 . . . . . 3 GLY H . 27415 1
7 . 1 1 3 3 GLY HA2 H 1 4.02 0.02 . 2 . . . . . 3 GLY HA2 . 27415 1
8 . 1 1 3 3 GLY HA3 H 1 4.02 0.02 . 2 . . . . . 3 GLY HA3 . 27415 1
9 . 1 1 3 3 GLY C C 13 174.0 0.2 . 1 . . . . . 3 GLY C . 27415 1
10 . 1 1 3 3 GLY CA C 13 45.2 0.2 . 1 . . . . . 3 GLY CA . 27415 1
11 . 1 1 3 3 GLY N N 15 109.8 0.2 . 1 . . . . . 3 GLY N . 27415 1
12 . 1 1 4 4 SER H H 1 8.16 0.02 . 1 . . . . . 4 SER H . 27415 1
13 . 1 1 4 4 SER CA C 13 58.2 0.2 . 1 . . . . . 4 SER CA . 27415 1
14 . 1 1 4 4 SER CB C 13 64.1 0.2 . 1 . . . . . 4 SER CB . 27415 1
15 . 1 1 4 4 SER N N 15 115.4 0.2 . 1 . . . . . 4 SER N . 27415 1
16 . 1 1 5 5 MET H H 1 8.38 0.02 . 1 . . . . . 5 MET H . 27415 1
17 . 1 1 5 5 MET CA C 13 53.3 0.2 . 1 . . . . . 5 MET CA . 27415 1
18 . 1 1 5 5 MET CB C 13 32.6 0.2 . 1 . . . . . 5 MET CB . 27415 1
19 . 1 1 5 5 MET N N 15 123.3 0.2 . 1 . . . . . 5 MET N . 27415 1
20 . 1 1 6 6 PRO HA H 1 4.41 0.02 . 1 . . . . . 6 PRO HA . 27415 1
21 . 1 1 6 6 PRO HD2 H 1 3.82 0.02 . 2 . . . . . 6 PRO HD2 . 27415 1
22 . 1 1 6 6 PRO HD3 H 1 3.66 0.02 . 2 . . . . . 6 PRO HD3 . 27415 1
23 . 1 1 6 6 PRO C C 13 176.3 0.2 . 1 . . . . . 6 PRO C . 27415 1
24 . 1 1 6 6 PRO CA C 13 63.1 0.2 . 1 . . . . . 6 PRO CA . 27415 1
25 . 1 1 6 6 PRO CB C 13 32.0 0.2 . 1 . . . . . 6 PRO CB . 27415 1
26 . 1 1 6 6 PRO CG C 13 27.3 0.2 . 1 . . . . . 6 PRO CG . 27415 1
27 . 1 1 6 6 PRO CD C 13 50.7 0.2 . 1 . . . . . 6 PRO CD . 27415 1
28 . 1 1 7 7 LEU H H 1 8.32 0.02 . 1 . . . . . 7 LEU H . 27415 1
29 . 1 1 7 7 LEU HA H 1 4.61 0.02 . 1 . . . . . 7 LEU HA . 27415 1
30 . 1 1 7 7 LEU CA C 13 52.9 0.2 . 1 . . . . . 7 LEU CA . 27415 1
31 . 1 1 7 7 LEU CB C 13 41.7 0.2 . 1 . . . . . 7 LEU CB . 27415 1
32 . 1 1 7 7 LEU N N 15 123.7 0.2 . 1 . . . . . 7 LEU N . 27415 1
33 . 1 1 8 8 PRO C C 13 176.1 0.2 . 1 . . . . . 8 PRO C . 27415 1
34 . 1 1 9 9 PRO HA H 1 4.36 0.02 . 1 . . . . . 9 PRO HA . 27415 1
35 . 1 1 9 9 PRO HD2 H 1 3.77 0.02 . 2 . . . . . 9 PRO HD2 . 27415 1
36 . 1 1 9 9 PRO HD3 H 1 3.58 0.02 . 2 . . . . . 9 PRO HD3 . 27415 1
37 . 1 1 9 9 PRO CA C 13 62.9 0.2 . 1 . . . . . 9 PRO CA . 27415 1
38 . 1 1 9 9 PRO CB C 13 32.2 0.2 . 1 . . . . . 9 PRO CB . 27415 1
39 . 1 1 9 9 PRO CG C 13 27.3 0.2 . 1 . . . . . 9 PRO CG . 27415 1
40 . 1 1 9 9 PRO CD C 13 50.4 0.2 . 1 . . . . . 9 PRO CD . 27415 1
41 . 1 1 10 10 HIS H H 1 8.37 0.02 . 1 . . . . . 10 HIS H . 27415 1
42 . 1 1 10 10 HIS HA H 1 4.92 0.02 . 1 . . . . . 10 HIS HA . 27415 1
43 . 1 1 10 10 HIS HB2 H 1 3.39 0.02 . 2 . . . . . 10 HIS HB2 . 27415 1
44 . 1 1 10 10 HIS HB3 H 1 3.35 0.02 . 2 . . . . . 10 HIS HB3 . 27415 1
45 . 1 1 10 10 HIS CA C 13 53.0 0.2 . 1 . . . . . 10 HIS CA . 27415 1
46 . 1 1 10 10 HIS CB C 13 28.5 0.2 . 1 . . . . . 10 HIS CB . 27415 1
47 . 1 1 10 10 HIS N N 15 118.3 0.2 . 1 . . . . . 10 HIS N . 27415 1
48 . 1 1 11 11 PRO HA H 1 3.97 0.02 . 1 . . . . . 11 PRO HA . 27415 1
49 . 1 1 11 11 PRO HD2 H 1 3.66 0.02 . 2 . . . . . 11 PRO HD2 . 27415 1
50 . 1 1 11 11 PRO HD3 H 1 3.46 0.02 . 2 . . . . . 11 PRO HD3 . 27415 1
51 . 1 1 11 11 PRO C C 13 177.2 0.2 . 1 . . . . . 11 PRO C . 27415 1
52 . 1 1 11 11 PRO CA C 13 63.8 0.2 . 1 . . . . . 11 PRO CA . 27415 1
53 . 1 1 11 11 PRO CB C 13 31.8 0.2 . 1 . . . . . 11 PRO CB . 27415 1
54 . 1 1 11 11 PRO CG C 13 27.4 0.2 . 1 . . . . . 11 PRO CG . 27415 1
55 . 1 1 11 11 PRO CD C 13 50.5 0.2 . 1 . . . . . 11 PRO CD . 27415 1
56 . 1 1 12 12 GLY H H 1 8.44 0.02 . 1 . . . . . 12 GLY H . 27415 1
57 . 1 1 12 12 GLY HA2 H 1 4.08 0.02 . 2 . . . . . 12 GLY HA2 . 27415 1
58 . 1 1 12 12 GLY HA3 H 1 3.87 0.02 . 2 . . . . . 12 GLY HA3 . 27415 1
59 . 1 1 12 12 GLY C C 13 174.0 0.2 . 1 . . . . . 12 GLY C . 27415 1
60 . 1 1 12 12 GLY CA C 13 45.2 0.2 . 1 . . . . . 12 GLY CA . 27415 1
61 . 1 1 12 12 GLY N N 15 110.8 0.2 . 1 . . . . . 12 GLY N . 27415 1
62 . 1 1 13 13 SER H H 1 8.12 0.02 . 1 . . . . . 13 SER H . 27415 1
63 . 1 1 13 13 SER CA C 13 56.7 0.2 . 1 . . . . . 13 SER CA . 27415 1
64 . 1 1 13 13 SER CB C 13 63.3 0.2 . 1 . . . . . 13 SER CB . 27415 1
65 . 1 1 13 13 SER N N 15 116.9 0.2 . 1 . . . . . 13 SER N . 27415 1
66 . 1 1 14 14 PRO HA H 1 4.40 0.02 . 1 . . . . . 14 PRO HA . 27415 1
67 . 1 1 14 14 PRO HD2 H 1 3.85 0.02 . 2 . . . . . 14 PRO HD2 . 27415 1
68 . 1 1 14 14 PRO HD3 H 1 3.71 0.02 . 2 . . . . . 14 PRO HD3 . 27415 1
69 . 1 1 14 14 PRO C C 13 177.3 0.2 . 1 . . . . . 14 PRO C . 27415 1
70 . 1 1 14 14 PRO CA C 13 64.0 0.2 . 1 . . . . . 14 PRO CA . 27415 1
71 . 1 1 14 14 PRO CB C 13 31.9 0.2 . 1 . . . . . 14 PRO CB . 27415 1
72 . 1 1 14 14 PRO CG C 13 27.4 0.2 . 1 . . . . . 14 PRO CG . 27415 1
73 . 1 1 14 14 PRO CD C 13 50.7 0.2 . 1 . . . . . 14 PRO CD . 27415 1
74 . 1 1 15 15 GLY H H 1 8.48 0.02 . 1 . . . . . 15 GLY H . 27415 1
75 . 1 1 15 15 GLY HA2 H 1 3.92 0.02 . 2 . . . . . 15 GLY HA2 . 27415 1
76 . 1 1 15 15 GLY HA3 H 1 3.84 0.02 . 2 . . . . . 15 GLY HA3 . 27415 1
77 . 1 1 15 15 GLY C C 13 173.8 0.2 . 1 . . . . . 15 GLY C . 27415 1
78 . 1 1 15 15 GLY CA C 13 45.2 0.2 . 1 . . . . . 15 GLY CA . 27415 1
79 . 1 1 15 15 GLY N N 15 109.1 0.2 . 1 . . . . . 15 GLY N . 27415 1
80 . 1 1 16 16 TYR H H 1 7.85 0.02 . 1 . . . . . 16 TYR H . 27415 1
81 . 1 1 16 16 TYR HA H 1 4.42 0.02 . 1 . . . . . 16 TYR HA . 27415 1
82 . 1 1 16 16 TYR HB2 H 1 2.97 0.02 . 2 . . . . . 16 TYR HB2 . 27415 1
83 . 1 1 16 16 TYR HB3 H 1 2.97 0.02 . 2 . . . . . 16 TYR HB3 . 27415 1
84 . 1 1 16 16 TYR C C 13 175.4 0.2 . 1 . . . . . 16 TYR C . 27415 1
85 . 1 1 16 16 TYR CA C 13 58.4 0.2 . 1 . . . . . 16 TYR CA . 27415 1
86 . 1 1 16 16 TYR CB C 13 38.9 0.2 . 1 . . . . . 16 TYR CB . 27415 1
87 . 1 1 16 16 TYR N N 15 120.1 0.2 . 1 . . . . . 16 TYR N . 27415 1
88 . 1 1 17 17 ILE H H 1 7.84 0.02 . 1 . . . . . 17 ILE H . 27415 1
89 . 1 1 17 17 ILE HA H 1 4.03 0.02 . 1 . . . . . 17 ILE HA . 27415 1
90 . 1 1 17 17 ILE HG21 H 1 1.36 0.02 . 1 . . . . . 17 ILE MG . 27415 1
91 . 1 1 17 17 ILE HG22 H 1 1.36 0.02 . 1 . . . . . 17 ILE MG . 27415 1
92 . 1 1 17 17 ILE HG23 H 1 1.36 0.02 . 1 . . . . . 17 ILE MG . 27415 1
93 . 1 1 17 17 ILE HD11 H 1 1.36 0.02 . 1 . . . . . 17 ILE MD . 27415 1
94 . 1 1 17 17 ILE HD12 H 1 1.36 0.02 . 1 . . . . . 17 ILE MD . 27415 1
95 . 1 1 17 17 ILE HD13 H 1 1.36 0.02 . 1 . . . . . 17 ILE MD . 27415 1
96 . 1 1 17 17 ILE C C 13 174.8 0.2 . 1 . . . . . 17 ILE C . 27415 1
97 . 1 1 17 17 ILE CA C 13 60.8 0.2 . 1 . . . . . 17 ILE CA . 27415 1
98 . 1 1 17 17 ILE CB C 13 39.1 0.2 . 1 . . . . . 17 ILE CB . 27415 1
99 . 1 1 17 17 ILE CG1 C 13 27.1 0.2 . 1 . . . . . 17 ILE CG1 . 27415 1
100 . 1 1 17 17 ILE CG2 C 13 17.3 0.2 . 1 . . . . . 17 ILE CG2 . 27415 1
101 . 1 1 17 17 ILE CD1 C 13 12.8 0.2 . 1 . . . . . 17 ILE CD1 . 27415 1
102 . 1 1 17 17 ILE N N 15 123.8 0.2 . 1 . . . . . 17 ILE N . 27415 1
103 . 1 1 18 18 ASN H H 1 8.31 0.02 . 1 . . . . . 18 ASN H . 27415 1
104 . 1 1 18 18 ASN HA H 1 4.61 0.02 . 1 . . . . . 18 ASN HA . 27415 1
105 . 1 1 18 18 ASN HB2 H 1 2.85 0.02 . 2 . . . . . 18 ASN HB2 . 27415 1
106 . 1 1 18 18 ASN HB3 H 1 2.70 0.02 . 2 . . . . . 18 ASN HB3 . 27415 1
107 . 1 1 18 18 ASN HD21 H 1 7.59 0.02 . 2 . . . . . 18 ASN HD21 . 27415 1
108 . 1 1 18 18 ASN HD22 H 1 6.95 0.02 . 2 . . . . . 18 ASN HD22 . 27415 1
109 . 1 1 18 18 ASN C C 13 175.1 0.2 . 1 . . . . . 18 ASN C . 27415 1
110 . 1 1 18 18 ASN CA C 13 53.1 0.2 . 1 . . . . . 18 ASN CA . 27415 1
111 . 1 1 18 18 ASN CB C 13 38.7 0.2 . 1 . . . . . 18 ASN CB . 27415 1
112 . 1 1 18 18 ASN N N 15 122.5 0.2 . 1 . . . . . 18 ASN N . 27415 1
113 . 1 1 18 18 ASN ND2 N 15 112.4 0.2 . 1 . . . . . 18 ASN ND2 . 27415 1
114 . 1 1 19 19 LEU H H 1 8.24 0.02 . 1 . . . . . 19 LEU H . 27415 1
115 . 1 1 19 19 LEU HA H 1 4.30 0.02 . 1 . . . . . 19 LEU HA . 27415 1
116 . 1 1 19 19 LEU HB2 H 1 2.04 0.02 . 2 . . . . . 19 LEU HB2 . 27415 1
117 . 1 1 19 19 LEU HB3 H 1 1.96 0.02 . 2 . . . . . 19 LEU HB3 . 27415 1
118 . 1 1 19 19 LEU C C 13 177.4 0.2 . 1 . . . . . 19 LEU C . 27415 1
119 . 1 1 19 19 LEU CA C 13 55.4 0.2 . 1 . . . . . 19 LEU CA . 27415 1
120 . 1 1 19 19 LEU CB C 13 42.2 0.2 . 1 . . . . . 19 LEU CB . 27415 1
121 . 1 1 19 19 LEU CG C 13 26.8 0.2 . 1 . . . . . 19 LEU CG . 27415 1
122 . 1 1 19 19 LEU CD1 C 13 25.1 0.2 . 2 . . . . . 19 LEU CD1 . 27415 1
123 . 1 1 19 19 LEU CD2 C 13 23.1 0.2 . 2 . . . . . 19 LEU CD2 . 27415 1
124 . 1 1 19 19 LEU N N 15 123.8 0.2 . 1 . . . . . 19 LEU N . 27415 1
125 . 1 1 20 20 SER H H 1 8.20 0.02 . 1 . . . . . 20 SER H . 27415 1
126 . 1 1 20 20 SER HA H 1 4.34 0.02 . 1 . . . . . 20 SER HA . 27415 1
127 . 1 1 20 20 SER HB2 H 1 3.82 0.02 . 2 . . . . . 20 SER HB2 . 27415 1
128 . 1 1 20 20 SER HB3 H 1 3.82 0.02 . 2 . . . . . 20 SER HB3 . 27415 1
129 . 1 1 20 20 SER CA C 13 63.5 0.2 . 1 . . . . . 20 SER CA . 27415 1
130 . 1 1 20 20 SER CB C 13 59.0 0.2 . 1 . . . . . 20 SER CB . 27415 1
131 . 1 1 20 20 SER N N 15 115.5 0.2 . 1 . . . . . 20 SER N . 27415 1
132 . 1 1 21 21 TYR H H 1 8.86 0.02 . 1 . . . . . 21 TYR H . 27415 1
133 . 1 1 21 21 TYR C C 13 175.5 0.2 . 1 . . . . . 21 TYR C . 27415 1
134 . 1 1 21 21 TYR CA C 13 57.9 0.2 . 1 . . . . . 21 TYR CA . 27415 1
135 . 1 1 21 21 TYR CB C 13 38.6 0.2 . 1 . . . . . 21 TYR CB . 27415 1
136 . 1 1 21 21 TYR N N 15 120.7 0.2 . 1 . . . . . 21 TYR N . 27415 1
137 . 1 1 22 22 GLU H H 1 8.00 0.02 . 1 . . . . . 22 GLU H . 27415 1
138 . 1 1 22 22 GLU HA H 1 4.29 0.02 . 1 . . . . . 22 GLU HA . 27415 1
139 . 1 1 22 22 GLU C C 13 175.3 0.2 . 1 . . . . . 22 GLU C . 27415 1
140 . 1 1 22 22 GLU CA C 13 55.8 0.2 . 1 . . . . . 22 GLU CA . 27415 1
141 . 1 1 22 22 GLU CB C 13 29.1 0.2 . 1 . . . . . 22 GLU CB . 27415 1
142 . 1 1 22 22 GLU CG C 13 32.8 0.2 . 1 . . . . . 22 GLU CG . 27415 1
143 . 1 1 22 22 GLU N N 15 120.9 0.2 . 1 . . . . . 22 GLU N . 27415 1
144 . 1 1 23 23 VAL H H 1 7.98 0.02 . 1 . . . . . 23 VAL H . 27415 1
145 . 1 1 23 23 VAL HA H 1 4.06 0.02 . 1 . . . . . 23 VAL HA . 27415 1
146 . 1 1 23 23 VAL HB H 1 2.05 0.02 . 1 . . . . . 23 VAL HB . 27415 1
147 . 1 1 23 23 VAL HG11 H 1 0.92 0.02 . 2 . . . . . 23 VAL MG1 . 27415 1
148 . 1 1 23 23 VAL HG12 H 1 0.92 0.02 . 2 . . . . . 23 VAL MG1 . 27415 1
149 . 1 1 23 23 VAL HG13 H 1 0.92 0.02 . 2 . . . . . 23 VAL MG1 . 27415 1
150 . 1 1 23 23 VAL HG21 H 1 0.92 0.02 . 2 . . . . . 23 VAL MG2 . 27415 1
151 . 1 1 23 23 VAL HG22 H 1 0.92 0.02 . 2 . . . . . 23 VAL MG2 . 27415 1
152 . 1 1 23 23 VAL HG23 H 1 0.92 0.02 . 2 . . . . . 23 VAL MG2 . 27415 1
153 . 1 1 23 23 VAL C C 13 175.8 0.2 . 1 . . . . . 23 VAL C . 27415 1
154 . 1 1 23 23 VAL CA C 13 62.5 0.2 . 1 . . . . . 23 VAL CA . 27415 1
155 . 1 1 23 23 VAL CB C 13 32.7 0.2 . 1 . . . . . 23 VAL CB . 27415 1
156 . 1 1 23 23 VAL CG1 C 13 20.9 0.2 . 2 . . . . . 23 VAL CG1 . 27415 1
157 . 1 1 23 23 VAL CG2 C 13 20.9 0.2 . 2 . . . . . 23 VAL CG2 . 27415 1
158 . 1 1 23 23 VAL N N 15 120.5 0.2 . 1 . . . . . 23 VAL N . 27415 1
159 . 1 1 24 24 LEU H H 1 8.24 0.02 . 1 . . . . . 24 LEU H . 27415 1
160 . 1 1 24 24 LEU HA H 1 4.42 0.02 . 1 . . . . . 24 LEU HA . 27415 1
161 . 1 1 24 24 LEU HB2 H 1 1.62 0.02 . 2 . . . . . 24 LEU HB2 . 27415 1
162 . 1 1 24 24 LEU HB3 H 1 1.62 0.02 . 2 . . . . . 24 LEU HB3 . 27415 1
163 . 1 1 24 24 LEU C C 13 176.8 0.2 . 1 . . . . . 24 LEU C . 27415 1
164 . 1 1 24 24 LEU CA C 13 55.0 0.2 . 1 . . . . . 24 LEU CA . 27415 1
165 . 1 1 24 24 LEU CB C 13 42.5 0.2 . 1 . . . . . 24 LEU CB . 27415 1
166 . 1 1 24 24 LEU CG C 13 27.0 0.2 . 1 . . . . . 24 LEU CG . 27415 1
167 . 1 1 24 24 LEU CD1 C 13 24.9 0.2 . 2 . . . . . 24 LEU CD1 . 27415 1
168 . 1 1 24 24 LEU CD2 C 13 23.3 0.2 . 2 . . . . . 24 LEU CD2 . 27415 1
169 . 1 1 24 24 LEU N N 15 125.2 0.2 . 1 . . . . . 24 LEU N . 27415 1
170 . 1 1 25 25 THR H H 1 7.98 0.02 . 1 . . . . . 25 THR H . 27415 1
171 . 1 1 25 25 THR HA H 1 4.57 0.02 . 1 . . . . . 25 THR HA . 27415 1
172 . 1 1 25 25 THR HB H 1 4.27 0.02 . 1 . . . . . 25 THR HB . 27415 1
173 . 1 1 25 25 THR HG21 H 1 1.71 0.02 . 1 . . . . . 25 THR MG . 27415 1
174 . 1 1 25 25 THR HG22 H 1 1.71 0.02 . 1 . . . . . 25 THR MG . 27415 1
175 . 1 1 25 25 THR HG23 H 1 1.71 0.02 . 1 . . . . . 25 THR MG . 27415 1
176 . 1 1 25 25 THR CA C 13 59.8 0.2 . 1 . . . . . 25 THR CA . 27415 1
177 . 1 1 25 25 THR CB C 13 69.6 0.2 . 1 . . . . . 25 THR CB . 27415 1
178 . 1 1 25 25 THR CG2 C 13 21.4 0.2 . 1 . . . . . 25 THR CG2 . 27415 1
179 . 1 1 25 25 THR N N 15 116.4 0.2 . 1 . . . . . 25 THR N . 27415 1
180 . 1 1 26 26 PRO HA H 1 4.31 0.02 . 1 . . . . . 26 PRO HA . 27415 1
181 . 1 1 26 26 PRO HD2 H 1 3.74 0.02 . 2 . . . . . 26 PRO HD2 . 27415 1
182 . 1 1 26 26 PRO HD3 H 1 3.62 0.02 . 2 . . . . . 26 PRO HD3 . 27415 1
183 . 1 1 26 26 PRO C C 13 177.0 0.2 . 1 . . . . . 26 PRO C . 27415 1
184 . 1 1 26 26 PRO CA C 13 63.8 0.2 . 1 . . . . . 26 PRO CA . 27415 1
185 . 1 1 26 26 PRO CB C 13 32.0 0.2 . 1 . . . . . 26 PRO CB . 27415 1
186 . 1 1 26 26 PRO CG C 13 27.4 0.2 . 1 . . . . . 26 PRO CG . 27415 1
187 . 1 1 26 26 PRO CD C 13 50.9 0.2 . 1 . . . . . 26 PRO CD . 27415 1
188 . 1 1 27 27 LEU H H 1 8.15 0.02 . 1 . . . . . 27 LEU H . 27415 1
189 . 1 1 27 27 LEU HA H 1 4.25 0.02 . 1 . . . . . 27 LEU HA . 27415 1
190 . 1 1 27 27 LEU HB2 H 1 2.08 0.02 . 2 . . . . . 27 LEU HB2 . 27415 1
191 . 1 1 27 27 LEU HB3 H 1 1.99 0.02 . 2 . . . . . 27 LEU HB3 . 27415 1
192 . 1 1 27 27 LEU HG H 1 1.48 0.02 . 1 . . . . . 27 LEU HG . 27415 1
193 . 1 1 27 27 LEU C C 13 177.7 0.2 . 1 . . . . . 27 LEU C . 27415 1
194 . 1 1 27 27 LEU CA C 13 55.9 0.2 . 1 . . . . . 27 LEU CA . 27415 1
195 . 1 1 27 27 LEU CB C 13 42.2 0.2 . 1 . . . . . 27 LEU CB . 27415 1
196 . 1 1 27 27 LEU CG C 13 27.1 0.2 . 1 . . . . . 27 LEU CG . 27415 1
197 . 1 1 27 27 LEU CD1 C 13 24.7 0.2 . 2 . . . . . 27 LEU CD1 . 27415 1
198 . 1 1 27 27 LEU CD2 C 13 23.6 0.2 . 2 . . . . . 27 LEU CD2 . 27415 1
199 . 1 1 27 27 LEU N N 15 121.1 0.2 . 1 . . . . . 27 LEU N . 27415 1
200 . 1 1 28 28 LYS H H 1 8.09 0.02 . 1 . . . . . 28 LYS H . 27415 1
201 . 1 1 28 28 LYS HA H 1 4.21 0.02 . 1 . . . . . 28 LYS HA . 27415 1
202 . 1 1 28 28 LYS HE2 H 1 3.18 0.02 . 2 . . . . . 28 LYS HE2 . 27415 1
203 . 1 1 28 28 LYS HE3 H 1 3.18 0.02 . 2 . . . . . 28 LYS HE3 . 27415 1
204 . 1 1 28 28 LYS C C 13 176.9 0.2 . 1 . . . . . 28 LYS C . 27415 1
205 . 1 1 28 28 LYS CA C 13 56.8 0.2 . 1 . . . . . 28 LYS CA . 27415 1
206 . 1 1 28 28 LYS CB C 13 32.8 0.2 . 1 . . . . . 28 LYS CB . 27415 1
207 . 1 1 28 28 LYS CG C 13 24.8 0.2 . 1 . . . . . 28 LYS CG . 27415 1
208 . 1 1 28 28 LYS CD C 13 29.0 0.2 . 1 . . . . . 28 LYS CD . 27415 1
209 . 1 1 28 28 LYS CE C 13 42.1 0.2 . 1 . . . . . 28 LYS CE . 27415 1
210 . 1 1 28 28 LYS N N 15 120.3 0.2 . 1 . . . . . 28 LYS N . 27415 1
211 . 1 1 29 29 TRP H H 1 8.08 0.02 . 1 . . . . . 29 TRP H . 27415 1
212 . 1 1 29 29 TRP HD1 H 1 7.13 0.02 . 1 . . . . . 29 TRP HD1 . 27415 1
213 . 1 1 29 29 TRP HE1 H 1 10.1 0.02 . 1 . . . . . 29 TRP HE1 . 27415 1
214 . 1 1 29 29 TRP C C 13 176.2 0.2 . 1 . . . . . 29 TRP C . 27415 1
215 . 1 1 29 29 TRP CA C 13 58.5 0.2 . 1 . . . . . 29 TRP CA . 27415 1
216 . 1 1 29 29 TRP CB C 13 29.5 0.2 . 1 . . . . . 29 TRP CB . 27415 1
217 . 1 1 29 29 TRP N N 15 121.1 0.2 . 1 . . . . . 29 TRP N . 27415 1
218 . 1 1 29 29 TRP NE1 N 15 129.3 0.2 . 1 . . . . . 29 TRP NE1 . 27415 1
219 . 1 1 30 30 TYR H H 1 7.65 0.02 . 1 . . . . . 30 TYR H . 27415 1
220 . 1 1 30 30 TYR HA H 1 4.27 0.02 . 1 . . . . . 30 TYR HA . 27415 1
221 . 1 1 30 30 TYR HB2 H 1 2.82 0.02 . 2 . . . . . 30 TYR HB2 . 27415 1
222 . 1 1 30 30 TYR HB3 H 1 2.82 0.02 . 2 . . . . . 30 TYR HB3 . 27415 1
223 . 1 1 30 30 TYR C C 13 175.8 0.2 . 1 . . . . . 30 TYR C . 27415 1
224 . 1 1 30 30 TYR CA C 13 58.5 0.2 . 1 . . . . . 30 TYR CA . 27415 1
225 . 1 1 30 30 TYR CB C 13 38.5 0.2 . 1 . . . . . 30 TYR CB . 27415 1
226 . 1 1 30 30 TYR N N 15 120.4 0.2 . 1 . . . . . 30 TYR N . 27415 1
227 . 1 1 31 31 GLN H H 1 8.01 0.02 . 1 . . . . . 31 GLN H . 27415 1
228 . 1 1 31 31 GLN HA H 1 4.09 0.02 . 1 . . . . . 31 GLN HA . 27415 1
229 . 1 1 31 31 GLN HE21 H 1 7.47 0.02 . 2 . . . . . 31 GLN HE21 . 27415 1
230 . 1 1 31 31 GLN HE22 H 1 6.85 0.02 . 2 . . . . . 31 GLN HE22 . 27415 1
231 . 1 1 31 31 GLN C C 13 176.0 0.2 . 1 . . . . . 31 GLN C . 27415 1
232 . 1 1 31 31 GLN CA C 13 56.7 0.2 . 1 . . . . . 31 GLN CA . 27415 1
233 . 1 1 31 31 GLN CB C 13 29.3 0.2 . 1 . . . . . 31 GLN CB . 27415 1
234 . 1 1 31 31 GLN CG C 13 34.0 0.2 . 1 . . . . . 31 GLN CG . 27415 1
235 . 1 1 31 31 GLN N N 15 120.1 0.2 . 1 . . . . . 31 GLN N . 27415 1
236 . 1 1 31 31 GLN NE2 N 15 111.7 0.2 . 1 . . . . . 31 GLN NE2 . 27415 1
237 . 1 1 32 32 SER H H 1 8.01 0.02 . 1 . . . . . 32 SER H . 27415 1
238 . 1 1 32 32 SER HA H 1 4.35 0.02 . 1 . . . . . 32 SER HA . 27415 1
239 . 1 1 32 32 SER HB2 H 1 3.87 0.02 . 2 . . . . . 32 SER HB2 . 27415 1
240 . 1 1 32 32 SER HB3 H 1 3.87 0.02 . 2 . . . . . 32 SER HB3 . 27415 1
241 . 1 1 32 32 SER C C 13 174.1 0.2 . 1 . . . . . 32 SER C . 27415 1
242 . 1 1 32 32 SER CA C 13 58.9 0.2 . 1 . . . . . 32 SER CA . 27415 1
243 . 1 1 32 32 SER CB C 13 63.6 0.2 . 1 . . . . . 32 SER CB . 27415 1
244 . 1 1 32 32 SER N N 15 115.1 0.2 . 1 . . . . . 32 SER N . 27415 1
245 . 1 1 33 33 MET H H 1 8.04 0.02 . 1 . . . . . 33 MET H . 27415 1
246 . 1 1 33 33 MET HA H 1 4.54 0.02 . 1 . . . . . 33 MET HA . 27415 1
247 . 1 1 33 33 MET C C 13 176.1 0.2 . 1 . . . . . 33 MET C . 27415 1
248 . 1 1 33 33 MET CA C 13 58.1 0.2 . 1 . . . . . 33 MET CA . 27415 1
249 . 1 1 33 33 MET N N 15 121.1 0.2 . 1 . . . . . 33 MET N . 27415 1
250 . 1 1 34 34 ILE H H 1 7.87 0.02 . 1 . . . . . 34 ILE H . 27415 1
251 . 1 1 34 34 ILE HA H 1 4.10 0.02 . 1 . . . . . 34 ILE HA . 27415 1
252 . 1 1 34 34 ILE HB H 1 2.23 0.02 . 1 . . . . . 34 ILE HB . 27415 1
253 . 1 1 34 34 ILE HG21 H 1 1.39 0.02 . 1 . . . . . 34 ILE MG . 27415 1
254 . 1 1 34 34 ILE HG22 H 1 1.39 0.02 . 1 . . . . . 34 ILE MG . 27415 1
255 . 1 1 34 34 ILE HG23 H 1 1.39 0.02 . 1 . . . . . 34 ILE MG . 27415 1
256 . 1 1 34 34 ILE HD11 H 1 1.36 0.02 . 1 . . . . . 34 ILE MD . 27415 1
257 . 1 1 34 34 ILE HD12 H 1 1.36 0.02 . 1 . . . . . 34 ILE MD . 27415 1
258 . 1 1 34 34 ILE HD13 H 1 1.36 0.02 . 1 . . . . . 34 ILE MD . 27415 1
259 . 1 1 34 34 ILE C C 13 175.9 0.2 . 1 . . . . . 34 ILE C . 27415 1
260 . 1 1 34 34 ILE CA C 13 61.4 0.2 . 1 . . . . . 34 ILE CA . 27415 1
261 . 1 1 34 34 ILE CB C 13 38.3 0.2 . 1 . . . . . 34 ILE CB . 27415 1
262 . 1 1 34 34 ILE CG1 C 13 27.1 0.2 . 1 . . . . . 34 ILE CG1 . 27415 1
263 . 1 1 34 34 ILE CG2 C 13 17.5 0.2 . 1 . . . . . 34 ILE CG2 . 27415 1
264 . 1 1 34 34 ILE CD1 C 13 12.3 0.2 . 1 . . . . . 34 ILE CD1 . 27415 1
265 . 1 1 34 34 ILE N N 15 120.4 0.2 . 1 . . . . . 34 ILE N . 27415 1
266 . 1 1 35 35 ARG HA H 1 4.30 0.02 . 1 . . . . . 35 ARG HA . 27415 1
267 . 1 1 35 35 ARG HD2 H 1 3.35 0.02 . 2 . . . . . 35 ARG HD2 . 27415 1
268 . 1 1 35 35 ARG HD3 H 1 3.35 0.02 . 2 . . . . . 35 ARG HD3 . 27415 1
269 . 1 1 35 35 ARG C C 13 175.5 0.2 . 1 . . . . . 35 ARG C . 27415 1
270 . 1 1 35 35 ARG CA C 13 55.9 0.2 . 1 . . . . . 35 ARG CA . 27415 1
271 . 1 1 35 35 ARG CB C 13 30.6 0.2 . 1 . . . . . 35 ARG CB . 27415 1
272 . 1 1 35 35 ARG CG C 13 27.1 0.2 . 1 . . . . . 35 ARG CG . 27415 1
273 . 1 1 35 35 ARG CD C 13 43.3 0.2 . 1 . . . . . 35 ARG CD . 27415 1
274 . 1 1 36 36 GLN H H 1 8.18 0.02 . 1 . . . . . 36 GLN H . 27415 1
275 . 1 1 36 36 GLN HA H 1 4.56 0.02 . 1 . . . . . 36 GLN HA . 27415 1
276 . 1 1 36 36 GLN HE21 H 1 7.44 0.02 . 2 . . . . . 36 GLN HE21 . 27415 1
277 . 1 1 36 36 GLN HE22 H 1 6.86 0.02 . 2 . . . . . 36 GLN HE22 . 27415 1
278 . 1 1 36 36 GLN N N 15 122.2 0.2 . 1 . . . . . 36 GLN N . 27415 1
279 . 1 1 36 36 GLN NE2 N 15 112.1 0.2 . 1 . . . . . 36 GLN NE2 . 27415 1
280 . 1 1 37 37 PRO HD2 H 1 3.65 0.02 . 2 . . . . . 37 PRO HD2 . 27415 1
281 . 1 1 37 37 PRO HD3 H 1 3.54 0.02 . 2 . . . . . 37 PRO HD3 . 27415 1
282 . 1 1 37 37 PRO C C 13 175.9 0.2 . 1 . . . . . 37 PRO C . 27415 1
283 . 1 1 37 37 PRO CA C 13 63.3 0.2 . 1 . . . . . 37 PRO CA . 27415 1
284 . 1 1 37 37 PRO CB C 13 31.9 0.2 . 1 . . . . . 37 PRO CB . 27415 1
285 . 1 1 37 37 PRO CG C 13 27.2 0.2 . 1 . . . . . 37 PRO CG . 27415 1
286 . 1 1 37 37 PRO CD C 13 50.4 0.2 . 1 . . . . . 37 PRO CD . 27415 1
287 . 1 1 38 38 TYR H H 1 7.89 0.2 . 1 . . . . . 38 TYR H . 27415 1
288 . 1 1 38 38 TYR HB2 H 1 3.01 0.02 . 2 . . . . . 38 TYR HB2 . 27415 1
289 . 1 1 38 38 TYR HB3 H 1 2.81 0.02 . 2 . . . . . 38 TYR HB3 . 27415 1
290 . 1 1 38 38 TYR CA C 13 55.5 0.2 . 1 . . . . . 38 TYR CA . 27415 1
291 . 1 1 38 38 TYR CB C 13 38.2 0.2 . 1 . . . . . 38 TYR CB . 27415 1
292 . 1 1 38 38 TYR N N 15 120.1 0.2 . 1 . . . . . 38 TYR N . 27415 1
293 . 1 1 39 39 PRO CA C 13 63.4 0.2 . 1 . . . . . 39 PRO CA . 27415 1
294 . 1 1 39 39 PRO CB C 13 31.9 0.2 . 1 . . . . . 39 PRO CB . 27415 1
295 . 1 1 39 39 PRO CG C 13 27.3 0.2 . 1 . . . . . 39 PRO CG . 27415 1
296 . 1 1 39 39 PRO CD C 13 50.5 0.2 . 1 . . . . . 39 PRO CD . 27415 1
297 . 1 1 40 40 SER H H 1 8.16 0.2 . 1 . . . . . 40 SER H . 27415 1
298 . 1 1 40 40 SER C C 13 174.4 0.2 . 1 . . . . . 40 SER C . 27415 1
299 . 1 1 40 40 SER CA C 13 59.0 0.2 . 1 . . . . . 40 SER CA . 27415 1
300 . 1 1 40 40 SER CB C 13 63.9 0.2 . 1 . . . . . 40 SER CB . 27415 1
301 . 1 1 40 40 SER N N 15 115.3 0.2 . 1 . . . . . 40 SER N . 27415 1
302 . 1 1 41 41 TYR H H 1 8.08 0.02 . 1 . . . . . 41 TYR H . 27415 1
303 . 1 1 41 41 TYR C C 13 176.0 0.2 . 1 . . . . . 41 TYR C . 27415 1
304 . 1 1 41 41 TYR CA C 13 58.0 0.2 . 1 . . . . . 41 TYR CA . 27415 1
305 . 1 1 41 41 TYR CB C 13 38.8 0.2 . 1 . . . . . 41 TYR CB . 27415 1
306 . 1 1 41 41 TYR N N 15 108.1 0.2 . 1 . . . . . 41 TYR N . 27415 1
307 . 1 1 42 42 GLY H H 1 8.23 0.2 . 1 . . . . . 42 GLY H . 27415 1
308 . 1 1 42 42 GLY HA2 H 1 3.89 0.02 . 2 . . . . . 42 GLY HA2 . 27415 1
309 . 1 1 42 42 GLY HA3 H 1 3.78 0.02 . 2 . . . . . 42 GLY HA3 . 27415 1
310 . 1 1 42 42 GLY C C 13 173.3 0.2 . 1 . . . . . 42 GLY C . 27415 1
311 . 1 1 42 42 GLY CA C 13 45.2 0.2 . 1 . . . . . 42 GLY CA . 27415 1
312 . 1 1 42 42 GLY N N 15 110.2 0.2 . 1 . . . . . 42 GLY N . 27415 1
313 . 1 1 43 43 TYR H H 1 7.92 0.02 . 1 . . . . . 43 TYR H . 27415 1
314 . 1 1 43 43 TYR HA H 1 4.52 0.02 . 1 . . . . . 43 TYR HA . 27415 1
315 . 1 1 43 43 TYR HB2 H 1 2.94 0.02 . 2 . . . . . 43 TYR HB2 . 27415 1
316 . 1 1 43 43 TYR HB3 H 1 2.94 0.02 . 2 . . . . . 43 TYR HB3 . 27415 1
317 . 1 1 43 43 TYR C C 13 175.0 0.2 . 1 . . . . . 43 TYR C . 27415 1
318 . 1 1 43 43 TYR CA C 13 57.8 0.2 . 1 . . . . . 43 TYR CA . 27415 1
319 . 1 1 43 43 TYR CB C 13 39.0 0.2 . 1 . . . . . 43 TYR CB . 27415 1
320 . 1 1 43 43 TYR N N 15 119.8 0.2 . 1 . . . . . 43 TYR N . 27415 1
321 . 1 1 44 44 GLU H H 1 8.00 0.02 . 1 . . . . . 44 GLU H . 27415 1
322 . 1 1 44 44 GLU HA H 1 4.35 0.02 . 1 . . . . . 44 GLU HA . 27415 1
323 . 1 1 44 44 GLU C C 13 176.8 0.2 . 1 . . . . . 44 GLU C . 27415 1
324 . 1 1 44 44 GLU CA C 13 53.0 0.2 . 1 . . . . . 44 GLU CA . 27415 1
325 . 1 1 44 44 GLU CB C 13 28.9 0.2 . 1 . . . . . 44 GLU CB . 27415 1
326 . 1 1 44 44 GLU N N 15 123.8 0.2 . 1 . . . . . 44 GLU N . 27415 1
327 . 1 1 45 45 PRO CA C 13 62.9 0.2 . 1 . . . . . 45 PRO CA . 27415 1
328 . 1 1 45 45 PRO CB C 13 31.9 0.2 . 1 . . . . . 45 PRO CB . 27415 1
329 . 1 1 45 45 PRO CG C 13 27.2 0.2 . 1 . . . . . 45 PRO CG . 27415 1
330 . 1 1 45 45 PRO CD C 13 50.4 0.2 . 1 . . . . . 45 PRO CD . 27415 1
331 . 1 1 46 46 MET H H 1 8.42 0.02 . 1 . . . . . 46 MET H . 27415 1
332 . 1 1 46 46 MET HA H 1 4.32 0.02 . 1 . . . . . 46 MET HA . 27415 1
333 . 1 1 46 46 MET C C 13 176.7 0.2 . 1 . . . . . 46 MET C . 27415 1
334 . 1 1 46 46 MET CA C 13 56.2 0.2 . 1 . . . . . 46 MET CA . 27415 1
335 . 1 1 46 46 MET CB C 13 32.1 0.2 . 1 . . . . . 46 MET CB . 27415 1
336 . 1 1 46 46 MET N N 15 120.6 0.2 . 1 . . . . . 46 MET N . 27415 1
337 . 1 1 47 47 GLY H H 1 8.36 0.02 . 1 . . . . . 47 GLY H . 27415 1
338 . 1 1 47 47 GLY HA2 H 1 3.88 0.02 . 2 . . . . . 47 GLY HA2 . 27415 1
339 . 1 1 47 47 GLY HA3 H 1 3.88 0.02 . 2 . . . . . 47 GLY HA3 . 27415 1
340 . 1 1 47 47 GLY C C 13 174.2 0.2 . 1 . . . . . 47 GLY C . 27415 1
341 . 1 1 47 47 GLY CA C 13 45.2 0.2 . 1 . . . . . 47 GLY CA . 27415 1
342 . 1 1 47 47 GLY N N 15 110.3 0.2 . 1 . . . . . 47 GLY N . 27415 1
343 . 1 1 48 48 GLY H H 1 8.01 0.02 . 1 . . . . . 48 GLY H . 27415 1
344 . 1 1 48 48 GLY HA2 H 1 3.97 0.02 . 2 . . . . . 48 GLY HA2 . 27415 1
345 . 1 1 48 48 GLY HA3 H 1 3.79 0.02 . 2 . . . . . 48 GLY HA3 . 27415 1
346 . 1 1 48 48 GLY CA C 13 45.1 0.2 . 1 . . . . . 48 GLY CA . 27415 1
347 . 1 1 48 48 GLY N N 15 108.1 0.2 . 1 . . . . . 48 GLY N . 27415 1
348 . 1 1 49 49 TRP H H 1 7.86 0.02 . 1 . . . . . 49 TRP H . 27415 1
349 . 1 1 49 49 TRP HD1 H 1 7.22 0.02 . 1 . . . . . 49 TRP HD1 . 27415 1
350 . 1 1 49 49 TRP HE1 H 1 10.05 0.02 . 1 . . . . . 49 TRP HE1 . 27415 1
351 . 1 1 49 49 TRP CA C 13 56.8 0.2 . 1 . . . . . 49 TRP CA . 27415 1
352 . 1 1 49 49 TRP CB C 13 29.5 0.2 . 1 . . . . . 49 TRP CB . 27415 1
353 . 1 1 49 49 TRP N N 15 120.7 0.2 . 1 . . . . . 49 TRP N . 27415 1
354 . 1 1 49 49 TRP NE1 N 15 128.9 0.2 . 1 . . . . . 49 TRP NE1 . 27415 1
stop_
save_