Content for NMR-STAR saveframe, "chem_shift_list_1"
save_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 6993
_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 $conditions_of_TFPP
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $TMS
_Assigned_chem_shift_list.Chem_shift_1H_err 0.02
_Assigned_chem_shift_list.Chem_shift_13C_err 0.1
_Assigned_chem_shift_list.Chem_shift_15N_err 0.1
_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
2 ROESY 1 $sample_1 isotropic 6993 1
3 IP-COSY 1 $sample_1 isotropic 6993 1
4 TOCSY 1 $sample_1 isotropic 6993 1
5 1H15N_HSQC 1 $sample_1 isotropic 6993 1
6 1H13C_HSQC 1 $sample_1 isotropic 6993 1
stop_
loop_
_Systematic_chem_shift_offset.Type
_Systematic_chem_shift_offset.Atom_type
_Systematic_chem_shift_offset.Atom_isotope_number
_Systematic_chem_shift_offset.Val
_Systematic_chem_shift_offset.Val_err
_Systematic_chem_shift_offset.Entry_ID
_Systematic_chem_shift_offset.Assigned_chem_shift_list_ID
Water H . 4.701 0.02 6993 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $NMRView . . 6993 1
2 $nmrpipe . . 6993 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 3 3 LYS H H 1 8.50 0.02 . 1 . . . . . 247 LYS HN . 6993 1
2 . 1 1 3 3 LYS HA H 1 4.14 0.02 . 1 . . . . . 247 LYS HA . 6993 1
3 . 1 1 3 3 LYS HB2 H 1 1.66 0.02 . 2 . . . . . 247 LYS HB2 . 6993 1
4 . 1 1 3 3 LYS HB3 H 1 1.55 0.02 . 2 . . . . . 247 LYS HB3 . 6993 1
5 . 1 1 3 3 LYS HG2 H 1 1.28 0.02 . 1 . . . . . 247 LYS QG . 6993 1
6 . 1 1 3 3 LYS HG3 H 1 1.28 0.02 . 1 . . . . . 247 LYS QG . 6993 1
7 . 1 1 3 3 LYS CA C 13 56.2 0.10 . 1 . . . . . 247 LYS CA . 6993 1
8 . 1 1 3 3 LYS CB C 13 33.3 0.10 . 1 . . . . . 247 LYS CB . 6993 1
9 . 1 1 3 3 LYS CG C 13 24.8 0.10 . 1 . . . . . 247 LYS CG . 6993 1
10 . 1 1 3 3 LYS N N 15 124.2 0.10 . 1 . . . . . 247 LYS N . 6993 1
11 . 1 1 4 4 ALA H H 1 8.39 0.02 . 1 . . . . . 248 ALA HN . 6993 1
12 . 1 1 4 4 ALA HA H 1 4.15 0.02 . 1 . . . . . 248 ALA HA . 6993 1
13 . 1 1 4 4 ALA HB1 H 1 1.24 0.02 . 1 . . . . . 248 ALA HB . 6993 1
14 . 1 1 4 4 ALA HB2 H 1 1.24 0.02 . 1 . . . . . 248 ALA HB . 6993 1
15 . 1 1 4 4 ALA HB3 H 1 1.24 0.02 . 1 . . . . . 248 ALA HB . 6993 1
16 . 1 1 4 4 ALA CA C 13 52.4 0.10 . 1 . . . . . 248 ALA CA . 6993 1
17 . 1 1 4 4 ALA CB C 13 19.5 0.02 . 1 . . . . . 248 ALA CB . 6993 1
18 . 1 1 4 4 ALA N N 15 126.1 0.10 . 1 . . . . . 248 ALA N . 6993 1
19 . 1 1 5 5 GLY H H 1 8.25 0.02 . 1 . . . . . 249 GLY HN . 6993 1
20 . 1 1 5 5 GLY HA2 H 1 3.83 0.02 . 1 . . . . . 249 GLY HA2 . 6993 1
21 . 1 1 5 5 GLY HA3 H 1 3.83 0.02 . 1 . . . . . 249 GLY HA3 . 6993 1
22 . 1 1 5 5 GLY N N 15 108.7 0.02 . 1 . . . . . 249 GLY N . 6993 1
23 . 1 1 6 6 VAL H H 1 8.04 0.02 . 1 . . . . . 250 VAL HN . 6993 1
24 . 1 1 6 6 VAL HA H 1 4.06 0.02 . 1 . . . . . 250 VAL HA . 6993 1
25 . 1 1 6 6 VAL HB H 1 2.00 0.02 . 1 . . . . . 250 VAL HB . 6993 1
26 . 1 1 6 6 VAL HG11 H 1 0.81 0.02 . 2 . . . . . 250 VAL HG1 . 6993 1
27 . 1 1 6 6 VAL HG12 H 1 0.81 0.02 . 2 . . . . . 250 VAL HG1 . 6993 1
28 . 1 1 6 6 VAL HG13 H 1 0.81 0.02 . 2 . . . . . 250 VAL HG1 . 6993 1
29 . 1 1 6 6 VAL HG21 H 1 0.81 0.02 . 2 . . . . . 250 VAL HG2 . 6993 1
30 . 1 1 6 6 VAL HG22 H 1 0.81 0.02 . 2 . . . . . 250 VAL HG2 . 6993 1
31 . 1 1 6 6 VAL HG23 H 1 0.81 0.02 . 2 . . . . . 250 VAL HG2 . 6993 1
32 . 1 1 6 6 VAL CA C 13 62.3 0.10 . 1 . . . . . 250 VAL CA . 6993 1
33 . 1 1 6 6 VAL CB C 13 32.7 0.10 . 1 . . . . . 250 VAL CB . 6993 1
34 . 1 1 6 6 VAL N N 15 125.1 0.10 . 1 . . . . . 250 VAL N . 6993 1
35 . 1 1 7 7 GLY H H 1 8.70 0.02 . 1 . . . . . 251 GLY HN . 6993 1
36 . 1 1 7 7 GLY HA2 H 1 3.86 0.02 . 2 . . . . . 251 GLY HA2 . 6993 1
37 . 1 1 7 7 GLY HA3 H 1 3.93 0.02 . 2 . . . . . 251 GLY HA3 . 6993 1
38 . 1 1 7 7 GLY CA C 13 45.2 0.10 . 1 . . . . . 251 GLY CA . 6993 1
39 . 1 1 7 7 GLY N N 15 113.5 0.10 . 1 . . . . . 251 GLY N . 6993 1
40 . 1 1 8 8 GLN H H 1 8.20 0.02 . 1 . . . . . 252 GLN HN . 6993 1
41 . 1 1 8 8 GLN HA H 1 4.24 0.02 . 1 . . . . . 252 GLN HA . 6993 1
42 . 1 1 8 8 GLN HB2 H 1 1.92 0.02 . 2 . . . . . 252 GLN HB2 . 6993 1
43 . 1 1 8 8 GLN HB3 H 1 1.80 0.02 . 2 . . . . . 252 GLN HB3 . 6993 1
44 . 1 1 8 8 GLN HG2 H 1 2.17 0.02 . 1 . . . . . 252 GLN HG . 6993 1
45 . 1 1 8 8 GLN HG3 H 1 2.17 0.02 . 1 . . . . . 252 GLN HG . 6993 1
46 . 1 1 8 8 GLN HE21 H 1 6.82 0.02 . 2 . . . . . 252 GLN HD21 . 6993 1
47 . 1 1 8 8 GLN HE22 H 1 7.52 0.02 . 2 . . . . . 252 GLN HD22 . 6993 1
48 . 1 1 8 8 GLN CA C 13 55.7 0.10 . 1 . . . . . 252 GLN CA . 6993 1
49 . 1 1 8 8 GLN CG C 13 33.7 0.10 . 1 . . . . . 252 GLN CG . 6993 1
50 . 1 1 8 8 GLN N N 15 119.4 0.10 . 1 . . . . . 252 GLN N . 6993 1
51 . 1 1 8 8 GLN NE2 N 15 112.9 0.10 . 1 . . . . . 252 GLN NE2 . 6993 1
52 . 1 1 9 9 SEP H H 1 8.99 0.02 . 1 . . . . . 253 SEP HN . 6993 1
53 . 1 1 9 9 SEP HA H 1 4.35 0.02 . 1 . . . . . 253 SEP HA . 6993 1
54 . 1 1 9 9 SEP HB2 H 1 3.99 0.02 . 1 . . . . . 253 SEP HB . 6993 1
55 . 1 1 9 9 SEP N N 15 118.0 0.10 . 1 . . . . . 253 SEP N . 6993 1
56 . 1 1 9 9 SEP CA C 13 58.0 0.10 . 1 . . . . . 253 SEP CA . 6993 1
57 . 1 1 9 9 SEP CB C 13 65.6 0.10 . 1 . . . . . 253 SEP CB . 6993 1
58 . 1 1 10 10 TRP H H 1 8.13 0.02 . 1 . . . . . 254 TRP HN . 6993 1
59 . 1 1 10 10 TRP HA H 1 4.50 0.02 . 1 . . . . . 254 TRP HA . 6993 1
60 . 1 1 10 10 TRP HB2 H 1 3.16 0.02 . 1 . . . . . 254 TRP HB2 . 6993 1
61 . 1 1 10 10 TRP HB3 H 1 3.16 0.02 . 1 . . . . . 254 TRP HB3 . 6993 1
62 . 1 1 10 10 TRP HD1 H 1 7.18 0.02 . 1 . . . . . 254 TRP HD1 . 6993 1
63 . 1 1 10 10 TRP HE1 H 1 10.1 0.02 . 1 . . . . . 254 TRP HE1 . 6993 1
64 . 1 1 10 10 TRP HE3 H 1 7.46 0.02 . 1 . . . . . 254 TRP HE3 . 6993 1
65 . 1 1 10 10 TRP HZ2 H 1 7.39 0.02 . 1 . . . . . 254 TRP HZ2 . 6993 1
66 . 1 1 10 10 TRP HZ3 H 1 7.03 0.02 . 1 . . . . . 254 TRP HZ3 . 6993 1
67 . 1 1 10 10 TRP HH2 H 1 7.12 0.02 . 1 . . . . . 254 TRP HH2 . 6993 1
68 . 1 1 10 10 TRP CA C 13 57.5 0.10 . 1 . . . . . 254 TRP CA . 6993 1
69 . 1 1 10 10 TRP CB C 13 29.5 0.10 . 1 . . . . . 254 TRP CB . 6993 1
70 . 1 1 10 10 TRP N N 15 120.6 0.10 . 1 . . . . . 254 TRP N . 6993 1
71 . 1 1 10 10 TRP NE1 N 15 129.8 0.10 . 1 . . . . . 254 TRP NE1 . 6993 1
72 . 1 1 11 11 LYS H H 1 7.79 0.02 . 1 . . . . . 255 LYS HN . 6993 1
73 . 1 1 11 11 LYS HA H 1 4.07 0.02 . 1 . . . . . 255 LYS HA . 6993 1
74 . 1 1 11 11 LYS HB2 H 1 1.55 0.02 . 2 . . . . . 255 LYS HB2 . 6993 1
75 . 1 1 11 11 LYS HB3 H 1 1.46 0.02 . 2 . . . . . 255 LYS HB3 . 6993 1
76 . 1 1 11 11 LYS HG2 H 1 1.08 0.02 . 1 . . . . . 255 LYS QG . 6993 1
77 . 1 1 11 11 LYS HG3 H 1 1.08 0.02 . 1 . . . . . 255 LYS QG . 6993 1
78 . 1 1 11 11 LYS HD2 H 1 1.54 0.02 . 1 . . . . . 255 LYS QD . 6993 1
79 . 1 1 11 11 LYS HD3 H 1 1.54 0.02 . 1 . . . . . 255 LYS QD . 6993 1
80 . 1 1 11 11 LYS HE2 H 1 2.90 0.02 . 1 . . . . . 255 LYS QE . 6993 1
81 . 1 1 11 11 LYS HE3 H 1 2.90 0.02 . 1 . . . . . 255 LYS QE . 6993 1
82 . 1 1 11 11 LYS CA C 13 55.6 0.10 . 1 . . . . . 255 LYS CA . 6993 1
83 . 1 1 11 11 LYS CB C 13 33.6 0.10 . 1 . . . . . 255 LYS CB . 6993 1
84 . 1 1 11 11 LYS CG C 13 24.312 0.10 . 1 . . . . . 255 LYS CG . 6993 1
85 . 1 1 11 11 LYS CE C 13 42.1 0.10 . 1 . . . . . 255 LYS CE . 6993 1
86 . 1 1 11 11 LYS N N 15 123.7 0.10 . 1 . . . . . 255 LYS N . 6993 1
87 . 1 1 12 12 GLU H H 1 8.16 0.02 . 1 . . . . . 256 GLU HN . 6993 1
88 . 1 1 12 12 GLU HA H 1 4.01 0.02 . 1 . . . . . 256 GLU HA . 6993 1
89 . 1 1 12 12 GLU HB2 H 1 1.79 0.02 . 2 . . . . . 256 GLU HB2 . 6993 1
90 . 1 1 12 12 GLU HB3 H 1 1.91 0.02 . 2 . . . . . 256 GLU HB3 . 6993 1
91 . 1 1 12 12 GLU HG2 H 1 2.17 0.02 . 1 . . . . . 256 GLU QG . 6993 1
92 . 1 1 12 12 GLU HG3 H 1 2.17 0.02 . 1 . . . . . 256 GLU QG . 6993 1
93 . 1 1 12 12 GLU CA C 13 56.3 0.10 . 1 . . . . . 256 GLU CA . 6993 1
94 . 1 1 12 12 GLU CG C 13 36.0 0.10 . 1 . . . . . 256 GLU CG . 6993 1
95 . 1 1 13 13 ASN H H 1 8.44 0.02 . 1 . . . . . 257 ASN HN . 6993 1
96 . 1 1 13 13 ASN HA H 1 4.85 0.02 . 1 . . . . . 257 ASN HA . 6993 1
97 . 1 1 13 13 ASN HB2 H 1 2.63 0.02 . 2 . . . . . 257 ASN HB2 . 6993 1
98 . 1 1 13 13 ASN HB3 H 1 2.73 0.02 . 2 . . . . . 257 ASN HB3 . 6993 1
99 . 1 1 13 13 ASN HD21 H 1 7.62 0.02 . 2 . . . . . 257 ASN HD21 . 6993 1
100 . 1 1 13 13 ASN HD22 H 1 6.88 0.02 . 2 . . . . . 257 ASN HD22 . 6993 1
101 . 1 1 13 13 ASN CA C 13 53.3 0.02 . 1 . . . . . 257 ASN CA . 6993 1
102 . 1 1 13 13 ASN N N 15 120.2 0.10 . 1 . . . . . 257 ASN N . 6993 1
103 . 1 1 13 13 ASN ND2 N 15 113.4 0.10 . 1 . . . . . 257 ASN ND2 . 6993 1
104 . 1 1 14 14 SEP H H 1 8.66 0.02 . 1 . . . . . 258 SEP HN . 6993 1
105 . 1 1 14 14 SEP HA H 1 4.69 0.02 . 1 . . . . . 258 SEP HA . 6993 1
106 . 1 1 14 14 SEP HB2 H 1 3.89 0.02 . 2 . . . . . 258 SEP HB2 . 6993 1
107 . 1 1 14 14 SEP HB3 H 1 3.99 0.02 . 2 . . . . . 258 SEP HB3 . 6993 1
108 . 1 1 14 14 SEP N N 15 118.6 0.10 . 1 . . . . . 258 SEP N . 6993 1
109 . 1 1 14 14 SEP CA C 13 55.8 0.10 . 1 . . . . . 258 SEP CA . 6993 1
110 . 1 1 14 14 SEP CB C 13 65.1 0.10 . 1 . . . . . 258 SEP CB . 6993 1
111 . 1 1 15 15 PRO HA H 1 4.28 0.02 . 1 . . . . . 259 PRO HA . 6993 1
112 . 1 1 15 15 PRO HB2 H 1 1.69 0.02 . 2 . . . . . 259 PRO HB2 . 6993 1
113 . 1 1 15 15 PRO HB3 H 1 1.50 0.02 . 2 . . . . . 259 PRO HB3 . 6993 1
114 . 1 1 15 15 PRO HG2 H 1 1.64 0.02 . 1 . . . . . 259 PRO HG . 6993 1
115 . 1 1 15 15 PRO HG3 H 1 1.64 0.02 . 1 . . . . . 259 PRO HG . 6993 1
116 . 1 1 15 15 PRO HD2 H 1 3.69 0.02 . 2 . . . . . 259 PRO HD2 . 6993 1
117 . 1 1 15 15 PRO HD3 H 1 3.63 0.02 . 2 . . . . . 259 PRO HD3 . 6993 1
118 . 1 1 15 15 PRO CB C 13 32.1 0.10 . 1 . . . . . 259 PRO CB . 6993 1
119 . 1 1 15 15 PRO CG C 13 27.4 0.10 . 1 . . . . . 259 PRO CG . 6993 1
120 . 1 1 15 15 PRO CD C 13 50.7 0.10 . 1 . . . . . 259 PRO CD . 6993 1
121 . 1 1 16 16 LEU H H 1 8.35 0.02 . 1 . . . . . 260 LEU HN . 6993 1
122 . 1 1 16 16 LEU HA H 1 4.20 0.02 . 1 . . . . . 260 LEU HA . 6993 1
123 . 1 1 16 16 LEU HB2 H 1 1.54 0.02 . 1 . . . . . 260 LEU HB2 . 6993 1
124 . 1 1 16 16 LEU HB3 H 1 1.54 0.02 . 1 . . . . . 260 LEU HB3 . 6993 1
125 . 1 1 16 16 LEU HG H 1 1.47 0.02 . 1 . . . . . 260 LEU HG . 6993 1
126 . 1 1 16 16 LEU HD11 H 1 0.83 0.02 . 1 . . . . . 260 LEU HD . 6993 1
127 . 1 1 16 16 LEU HD12 H 1 0.83 0.02 . 1 . . . . . 260 LEU HD . 6993 1
128 . 1 1 16 16 LEU HD13 H 1 0.83 0.02 . 1 . . . . . 260 LEU HD . 6993 1
129 . 1 1 16 16 LEU HD21 H 1 0.83 0.02 . 1 . . . . . 260 LEU HD . 6993 1
130 . 1 1 16 16 LEU HD22 H 1 0.83 0.02 . 1 . . . . . 260 LEU HD . 6993 1
131 . 1 1 16 16 LEU HD23 H 1 0.83 0.02 . 1 . . . . . 260 LEU HD . 6993 1
132 . 1 1 16 16 LEU CA C 13 55.16 0.10 . 1 . . . . . 260 LEU CA . 6993 1
133 . 1 1 16 16 LEU CB C 13 42.39 0.10 . 1 . . . . . 260 LEU CB . 6993 1
134 . 1 1 16 16 LEU N N 15 122.1 0.10 . 1 . . . . . 260 LEU N . 6993 1
135 . 1 1 17 17 ASN H H 1 8.43 0.02 . 1 . . . . . 261 ASN HN . 6993 1
136 . 1 1 17 17 ASN HA H 1 4.65 0.02 . 1 . . . . . 261 ASN HA . 6993 1
137 . 1 1 17 17 ASN HB2 H 1 2.63 0.02 . 2 . . . . . 261 ASN HB2 . 6993 1
138 . 1 1 17 17 ASN HB3 H 1 2.73 0.02 . 2 . . . . . 261 ASN HB3 . 6993 1
139 . 1 1 17 17 ASN HD21 H 1 7.62 0.02 . 2 . . . . . 261 ASN HD21 . 6993 1
140 . 1 1 17 17 ASN HD22 H 1 6.88 0.02 . 2 . . . . . 261 ASN HD22 . 6993 1
141 . 1 1 17 17 ASN CA C 13 53.1 0.02 . 1 . . . . . 261 ASN CA . 6993 1
142 . 1 1 17 17 ASN N N 15 120.2 0.10 . 1 . . . . . 261 ASN N . 6993 1
143 . 1 1 17 17 ASN ND2 N 15 113.5 0.10 . 1 . . . . . 261 ASN ND2 . 6993 1
144 . 1 1 18 18 VAL H H 1 8.14 0.02 . 1 . . . . . 262 VAL HN . 6993 1
145 . 1 1 18 18 VAL HA H 1 4.15 0.02 . 1 . . . . . 262 VAL HA . 6993 1
146 . 1 1 18 18 VAL HB H 1 2.06 0.02 . 1 . . . . . 262 VAL HB . 6993 1
147 . 1 1 18 18 VAL HG11 H 1 0.83 0.02 . 2 . . . . . 262 VAL HG1 . 6993 1
148 . 1 1 18 18 VAL HG12 H 1 0.83 0.02 . 2 . . . . . 262 VAL HG1 . 6993 1
149 . 1 1 18 18 VAL HG13 H 1 0.83 0.02 . 2 . . . . . 262 VAL HG1 . 6993 1
150 . 1 1 18 18 VAL HG21 H 1 0.83 0.02 . 2 . . . . . 262 VAL HG2 . 6993 1
151 . 1 1 18 18 VAL HG22 H 1 0.83 0.02 . 2 . . . . . 262 VAL HG2 . 6993 1
152 . 1 1 18 18 VAL HG23 H 1 0.83 0.02 . 2 . . . . . 262 VAL HG2 . 6993 1
153 . 1 1 18 18 VAL CA C 13 62.0 0.10 . 1 . . . . . 262 VAL CA . 6993 1
154 . 1 1 18 18 VAL CB C 13 32.9 0.10 . 1 . . . . . 262 VAL CB . 6993 1
155 . 1 1 18 18 VAL N N 15 119.0 0.10 . 1 . . . . . 262 VAL N . 6993 1
156 . 1 1 19 19 SER H H 1 8.00 0.02 . 1 . . . . . 263 SER HN . 6993 1
157 . 1 1 19 19 SER HA H 1 4.19 0.02 . 1 . . . . . 263 SER HA . 6993 1
158 . 1 1 19 19 SER HB2 H 1 3.76 0.02 . 1 . . . . . 263 SER HB2 . 6993 1
159 . 1 1 19 19 SER HB3 H 1 3.76 0.02 . 1 . . . . . 263 SER HB3 . 6993 1
160 . 1 1 19 19 SER CA C 13 60.0 0.10 . 1 . . . . . 263 SER CA . 6993 1
161 . 1 1 19 19 SER CB C 13 64.7 0.02 . 1 . . . . . 263 SER CB . 6993 1
162 . 2 1 15 15 PRO HA H 1 4.78 0.02 . 1 . . . . . 259 PRO HA . 6993 1
163 . 2 1 15 15 PRO HB2 H 1 3.47 0.02 . 1 . . . . . 259 PRO HB2 . 6993 1
164 . 2 1 15 15 PRO HB3 H 1 2.31 0.02 . 1 . . . . . 259 PRO HB3 . 6993 1
165 . 2 1 15 15 PRO HG2 H 1 2.03 0.02 . 1 . . . . . 259 PRO HG . 6993 1
166 . 2 1 15 15 PRO HG3 H 1 1.87 0.02 . 1 . . . . . 259 PRO HG . 6993 1
167 . 2 1 15 15 PRO HD2 H 1 1.75 0.02 . 1 . . . . . 259 PRO HD2 . 6993 1
168 . 2 1 15 15 PRO HD3 H 1 1.75 0.02 . 1 . . . . . 259 PRO HD3 . 6993 1
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save_