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 30718
_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 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.01
_Assigned_chem_shift_list.Chem_shift_15N_err 0.01
_Assigned_chem_shift_list.Chem_shift_31P_err 0
_Assigned_chem_shift_list.Chem_shift_2H_err 0
_Assigned_chem_shift_list.Chem_shift_19F_err 0
_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-1H TOCSY' . . . 30718 1
2 '2D 1H-1H NOESY' . . . 30718 1
3 '2D 1H-1H TOCSY' . . . 30718 1
4 '2D 1H-1H NOESY' . . . 30718 1
5 '2D 1H-13C HSQC' . . . 30718 1
6 '2D 1H-15N HSQC' . . . 30718 1
7 '2D 1H-1H TOCSY' . . . 30718 1
8 '2D 1H-1H NOESY' . . . 30718 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 ALA HA H 1 4.208 0.000 . 1 . . . . A 1 ALA HA . 30718 1
2 . 1 . 1 1 1 ALA HB1 H 1 1.640 0.004 . 1 . . . . A 1 ALA HB1 . 30718 1
3 . 1 . 1 1 1 ALA HB2 H 1 1.640 0.004 . 1 . . . . A 1 ALA HB2 . 30718 1
4 . 1 . 1 1 1 ALA HB3 H 1 1.640 0.004 . 1 . . . . A 1 ALA HB3 . 30718 1
5 . 1 . 1 1 1 ALA CA C 13 51.870 0.000 . 1 . . . . A 1 ALA CA . 30718 1
6 . 1 . 1 1 1 ALA CB C 13 19.570 0.000 . 1 . . . . A 1 ALA CB . 30718 1
7 . 1 . 1 2 2 ALA H H 1 8.687 0.003 . 1 . . . . A 2 ALA H . 30718 1
8 . 1 . 1 2 2 ALA HA H 1 4.423 0.006 . 1 . . . . A 2 ALA HA . 30718 1
9 . 1 . 1 2 2 ALA HB1 H 1 1.426 0.005 . 1 . . . . A 2 ALA HB1 . 30718 1
10 . 1 . 1 2 2 ALA HB2 H 1 1.426 0.005 . 1 . . . . A 2 ALA HB2 . 30718 1
11 . 1 . 1 2 2 ALA HB3 H 1 1.426 0.005 . 1 . . . . A 2 ALA HB3 . 30718 1
12 . 1 . 1 2 2 ALA CA C 13 52.091 0.000 . 1 . . . . A 2 ALA CA . 30718 1
13 . 1 . 1 2 2 ALA CB C 13 19.579 0.000 . 1 . . . . A 2 ALA CB . 30718 1
14 . 1 . 1 2 2 ALA N N 15 123.244 0.000 . 1 . . . . A 2 ALA N . 30718 1
15 . 1 . 1 3 3 CYS H H 1 8.619 0.004 . 1 . . . . A 3 CYS H . 30718 1
16 . 1 . 1 3 3 CYS HA H 1 4.596 0.004 . 1 . . . . A 3 CYS HA . 30718 1
17 . 1 . 1 3 3 CYS HB2 H 1 2.928 0.010 . 2 . . . . A 3 CYS HB2 . 30718 1
18 . 1 . 1 3 3 CYS HB3 H 1 3.179 0.016 . 2 . . . . A 3 CYS HB3 . 30718 1
19 . 1 . 1 3 3 CYS CA C 13 55.799 0.000 . 1 . . . . A 3 CYS CA . 30718 1
20 . 1 . 1 3 3 CYS CB C 13 35.954 0.000 . 1 . . . . A 3 CYS CB . 30718 1
21 . 1 . 1 3 3 CYS N N 15 119.800 0.000 . 1 . . . . A 3 CYS N . 30718 1
22 . 1 . 1 4 4 HIS H H 1 9.234 0.003 . 1 . . . . A 4 HIS H . 30718 1
23 . 1 . 1 4 4 HIS HA H 1 4.805 0.123 . 1 . . . . A 4 HIS HA . 30718 1
24 . 1 . 1 4 4 HIS HB2 H 1 3.202 0.097 . 2 . . . . A 4 HIS HB2 . 30718 1
25 . 1 . 1 4 4 HIS HB3 H 1 3.445 0.084 . 2 . . . . A 4 HIS HB3 . 30718 1
26 . 1 . 1 4 4 HIS HD2 H 1 7.303 0.148 . 4 . . . . A 4 HIS HD2 . 30718 1
27 . 1 . 1 4 4 HIS HE1 H 1 6.873 0.000 . 4 . . . . A 4 HIS HE1 . 30718 1
28 . 1 . 1 4 4 HIS CB C 13 28.919 0.012 . 1 . . . . A 4 HIS CB . 30718 1
29 . 1 . 1 4 4 HIS N N 15 124.067 0.000 . 1 . . . . A 4 HIS N . 30718 1
30 . 1 . 1 5 5 ASN H H 1 8.171 0.002 . 1 . . . . A 5 ASN H . 30718 1
31 . 1 . 1 5 5 ASN HA H 1 4.833 0.003 . 1 . . . . A 5 ASN HA . 30718 1
32 . 1 . 1 5 5 ASN CB C 13 39.305 0.000 . 1 . . . . A 5 ASN CB . 30718 1
33 . 1 . 1 5 5 ASN N N 15 118.452 0.000 . 1 . . . . A 5 ASN N . 30718 1
34 . 1 . 1 6 6 HIS H H 1 8.408 0.003 . 1 . . . . A 6 HIS H . 30718 1
35 . 1 . 1 6 6 HIS HA H 1 4.627 0.002 . 1 . . . . A 6 HIS HA . 30718 1
36 . 1 . 1 6 6 HIS HB2 H 1 3.329 0.004 . 2 . . . . A 6 HIS HB2 . 30718 1
37 . 1 . 1 6 6 HIS HB3 H 1 3.329 0.004 . 2 . . . . A 6 HIS HB3 . 30718 1
38 . 1 . 1 6 6 HIS HD2 H 1 7.434 0.031 . 4 . . . . A 6 HIS HD2 . 30718 1
39 . 1 . 1 6 6 HIS HE1 H 1 7.338 0.000 . 4 . . . . A 6 HIS HE1 . 30718 1
40 . 1 . 1 6 6 HIS N N 15 117.408 0.000 . 1 . . . . A 6 HIS N . 30718 1
41 . 1 . 1 7 7 ALA H H 1 8.656 0.002 . 1 . . . . A 7 ALA H . 30718 1
42 . 1 . 1 7 7 ALA HA H 1 4.438 0.011 . 1 . . . . A 7 ALA HA . 30718 1
43 . 1 . 1 7 7 ALA HB1 H 1 1.444 0.004 . 1 . . . . A 7 ALA HB1 . 30718 1
44 . 1 . 1 7 7 ALA HB2 H 1 1.444 0.004 . 1 . . . . A 7 ALA HB2 . 30718 1
45 . 1 . 1 7 7 ALA HB3 H 1 1.444 0.004 . 1 . . . . A 7 ALA HB3 . 30718 1
46 . 1 . 1 7 7 ALA CA C 13 52.534 0.000 . 1 . . . . A 7 ALA CA . 30718 1
47 . 1 . 1 7 7 ALA CB C 13 17.946 0.000 . 1 . . . . A 7 ALA CB . 30718 1
48 . 1 . 1 7 7 ALA N N 15 126.677 0.000 . 1 . . . . A 7 ALA N . 30718 1
49 . 1 . 1 8 8 PRO HA H 1 4.723 0.001 . 1 . . . . A 8 PRO HA . 30718 1
50 . 1 . 1 8 8 PRO HB3 H 1 2.406 0.000 . 2 . . . . A 8 PRO HB3 . 30718 1
51 . 1 . 1 8 8 PRO HG2 H 1 1.833 0.005 . 2 . . . . A 8 PRO HG2 . 30718 1
52 . 1 . 1 8 8 PRO HG3 H 1 2.066 0.002 . 2 . . . . A 8 PRO HG3 . 30718 1
53 . 1 . 1 8 8 PRO HD2 H 1 3.636 0.002 . 2 . . . . A 8 PRO HD2 . 30718 1
54 . 1 . 1 8 8 PRO HD3 H 1 3.724 0.029 . 2 . . . . A 8 PRO HD3 . 30718 1
55 . 1 . 1 8 8 PRO CA C 13 64.060 0.000 . 1 . . . . A 8 PRO CA . 30718 1
56 . 1 . 1 8 8 PRO CG C 13 24.794 0.001 . 1 . . . . A 8 PRO CG . 30718 1
57 . 1 . 1 8 8 PRO CD C 13 50.544 0.032 . 1 . . . . A 8 PRO CD . 30718 1
58 . 1 . 1 9 9 DAL H H 1 8.377 0.002 . 1 . . . . A 9 DAL H . 30718 1
59 . 1 . 1 9 9 DAL N N 15 122.662 0.000 . 1 . . . . A 9 DAL N . 30718 1
60 . 1 . 1 9 9 DAL HA H 1 4.851 0.002 . 1 . . . . A 9 DAL HA . 30718 1
61 . 1 . 1 9 9 DAL HB1 H 1 3.105 0.062 . 2 . . . . A 9 DAL HB1 . 30718 1
62 . 1 . 1 9 9 DAL HB2 H 1 2.909 0.005 . 2 . . . . A 9 DAL HB2 . 30718 1
63 . 1 . 1 10 10 MET H H 1 8.622 0.003 . 1 . . . . A 10 MET H . 30718 1
64 . 1 . 1 10 10 MET HA H 1 4.853 0.031 . 1 . . . . A 10 MET HA . 30718 1
65 . 1 . 1 10 10 MET HB2 H 1 1.917 0.018 . 2 . . . . A 10 MET HB2 . 30718 1
66 . 1 . 1 10 10 MET HB3 H 1 1.917 0.018 . 2 . . . . A 10 MET HB3 . 30718 1
67 . 1 . 1 10 10 MET HG2 H 1 2.442 0.017 . 2 . . . . A 10 MET HG2 . 30718 1
68 . 1 . 1 10 10 MET HG3 H 1 2.531 0.024 . 2 . . . . A 10 MET HG3 . 30718 1
69 . 1 . 1 10 10 MET CA C 13 55.704 0.000 . 1 . . . . A 10 MET CA . 30718 1
70 . 1 . 1 10 10 MET CB C 13 32.605 0.000 . 1 . . . . A 10 MET CB . 30718 1
71 . 1 . 1 10 10 MET CG C 13 32.541 0.000 . 1 . . . . A 10 MET CG . 30718 1
72 . 1 . 1 10 10 MET N N 15 123.899 0.000 . 1 . . . . A 10 MET N . 30718 1
73 . 1 . 1 11 11 PRO HA H 1 4.778 0.008 . 1 . . . . A 11 PRO HA . 30718 1
74 . 1 . 1 11 11 PRO HB2 H 1 1.988 0.008 . 2 . . . . A 11 PRO HB2 . 30718 1
75 . 1 . 1 11 11 PRO HB3 H 1 2.433 0.004 . 2 . . . . A 11 PRO HB3 . 30718 1
76 . 1 . 1 11 11 PRO HG2 H 1 2.064 0.005 . 2 . . . . A 11 PRO HG2 . 30718 1
77 . 1 . 1 11 11 PRO HG3 H 1 2.064 0.005 . 2 . . . . A 11 PRO HG3 . 30718 1
78 . 1 . 1 11 11 PRO HD2 H 1 3.503 0.005 . 2 . . . . A 11 PRO HD2 . 30718 1
79 . 1 . 1 11 11 PRO HD3 H 1 3.847 0.003 . 2 . . . . A 11 PRO HD3 . 30718 1
80 . 1 . 1 11 11 PRO CA C 13 61.904 0.000 . 1 . . . . A 11 PRO CA . 30718 1
81 . 1 . 1 11 11 PRO CB C 13 31.069 0.001 . 1 . . . . A 11 PRO CB . 30718 1
82 . 1 . 1 11 11 PRO CD C 13 50.826 0.006 . 1 . . . . A 11 PRO CD . 30718 1
83 . 1 . 1 12 12 PRO HA H 1 4.541 0.003 . 1 . . . . A 12 PRO HA . 30718 1
84 . 1 . 1 12 12 PRO HB2 H 1 2.044 0.006 . 2 . . . . A 12 PRO HB2 . 30718 1
85 . 1 . 1 12 12 PRO HB3 H 1 2.434 0.007 . 2 . . . . A 12 PRO HB3 . 30718 1
86 . 1 . 1 12 12 PRO HG2 H 1 2.156 0.005 . 2 . . . . A 12 PRO HG2 . 30718 1
87 . 1 . 1 12 12 PRO HG3 H 1 2.211 0.004 . 2 . . . . A 12 PRO HG3 . 30718 1
88 . 1 . 1 12 12 PRO HD2 H 1 3.744 0.004 . 2 . . . . A 12 PRO HD2 . 30718 1
89 . 1 . 1 12 12 PRO HD3 H 1 3.918 0.003 . 2 . . . . A 12 PRO HD3 . 30718 1
90 . 1 . 1 12 12 PRO CA C 13 63.900 0.000 . 1 . . . . A 12 PRO CA . 30718 1
91 . 1 . 1 12 12 PRO CB C 13 32.244 0.016 . 1 . . . . A 12 PRO CB . 30718 1
92 . 1 . 1 12 12 PRO CG C 13 27.931 0.004 . 1 . . . . A 12 PRO CG . 30718 1
93 . 1 . 1 12 12 PRO CD C 13 50.782 0.017 . 1 . . . . A 12 PRO CD . 30718 1
94 . 1 . 1 13 13 DAL H H 1 8.512 0.003 . 1 . . . . A 13 DAL H . 30718 1
95 . 1 . 1 13 13 DAL N N 15 118.659 0.000 . 1 . . . . A 13 DAL N . 30718 1
96 . 1 . 1 13 13 DAL HA H 1 4.594 0.008 . 1 . . . . A 13 DAL HA . 30718 1
97 . 1 . 1 13 13 DAL HB1 H 1 3.072 0.005 . 2 . . . . A 13 DAL HB1 . 30718 1
98 . 1 . 1 13 13 DAL HB2 H 1 2.989 0.003 . 2 . . . . A 13 DAL HB2 . 30718 1
99 . 1 . 1 14 14 TYR H H 1 8.128 0.004 . 1 . . . . A 14 TYR H . 30718 1
100 . 1 . 1 14 14 TYR HA H 1 4.350 0.011 . 1 . . . . A 14 TYR HA . 30718 1
101 . 1 . 1 14 14 TYR HB2 H 1 2.915 0.012 . 2 . . . . A 14 TYR HB2 . 30718 1
102 . 1 . 1 14 14 TYR HB3 H 1 3.065 0.003 . 2 . . . . A 14 TYR HB3 . 30718 1
103 . 1 . 1 14 14 TYR HD1 H 1 6.803 0.005 . 3 . . . . A 14 TYR HD1 . 30718 1
104 . 1 . 1 14 14 TYR HD2 H 1 6.803 0.005 . 3 . . . . A 14 TYR HD2 . 30718 1
105 . 1 . 1 14 14 TYR HE1 H 1 6.723 0.009 . 3 . . . . A 14 TYR HE1 . 30718 1
106 . 1 . 1 14 14 TYR HE2 H 1 6.723 0.009 . 3 . . . . A 14 TYR HE2 . 30718 1
107 . 1 . 1 14 14 TYR CD1 C 13 133.421 0.000 . 1 . . . . A 14 TYR CD1 . 30718 1
108 . 1 . 1 14 14 TYR CD2 C 13 133.421 0.000 . 1 . . . . A 14 TYR CD2 . 30718 1
109 . 1 . 1 14 14 TYR CE1 C 13 118.405 0.000 . 1 . . . . A 14 TYR CE1 . 30718 1
110 . 1 . 1 14 14 TYR CE2 C 13 118.405 0.000 . 1 . . . . A 14 TYR CE2 . 30718 1
111 . 1 . 1 14 14 TYR N N 15 120.800 0.000 . 1 . . . . A 14 TYR N . 30718 1
112 . 1 . 1 15 15 TRP H H 1 7.938 0.003 . 1 . . . . A 15 TRP H . 30718 1
113 . 1 . 1 15 15 TRP HA H 1 4.717 0.003 . 1 . . . . A 15 TRP HA . 30718 1
114 . 1 . 1 15 15 TRP HB2 H 1 3.329 0.006 . 2 . . . . A 15 TRP HB2 . 30718 1
115 . 1 . 1 15 15 TRP HB3 H 1 3.329 0.006 . 2 . . . . A 15 TRP HB3 . 30718 1
116 . 1 . 1 15 15 TRP HD1 H 1 7.375 0.006 . 1 . . . . A 15 TRP HD1 . 30718 1
117 . 1 . 1 15 15 TRP HE1 H 1 10.265 0.007 . 1 . . . . A 15 TRP HE1 . 30718 1
118 . 1 . 1 15 15 TRP HE3 H 1 7.730 0.006 . 1 . . . . A 15 TRP HE3 . 30718 1
119 . 1 . 1 15 15 TRP HZ2 H 1 7.593 0.005 . 1 . . . . A 15 TRP HZ2 . 30718 1
120 . 1 . 1 15 15 TRP HZ3 H 1 7.267 0.003 . 1 . . . . A 15 TRP HZ3 . 30718 1
121 . 1 . 1 15 15 TRP HH2 H 1 7.366 0.025 . 1 . . . . A 15 TRP HH2 . 30718 1
122 . 1 . 1 15 15 TRP CA C 13 57.430 0.000 . 1 . . . . A 15 TRP CA . 30718 1
123 . 1 . 1 15 15 TRP CB C 13 29.141 0.000 . 1 . . . . A 15 TRP CB . 30718 1
124 . 1 . 1 15 15 TRP CD1 C 13 127.456 0.000 . 1 . . . . A 15 TRP CD1 . 30718 1
125 . 1 . 1 15 15 TRP CE3 C 13 121.417 0.000 . 1 . . . . A 15 TRP CE3 . 30718 1
126 . 1 . 1 15 15 TRP CZ2 C 13 115.030 0.000 . 1 . . . . A 15 TRP CZ2 . 30718 1
127 . 1 . 1 15 15 TRP CZ3 C 13 122.517 0.000 . 1 . . . . A 15 TRP CZ3 . 30718 1
128 . 1 . 1 15 15 TRP CH2 C 13 125.129 0.000 . 1 . . . . A 15 TRP CH2 . 30718 1
129 . 1 . 1 15 15 TRP N N 15 118.945 0.000 . 1 . . . . A 15 TRP N . 30718 1
130 . 1 . 1 15 15 TRP NE1 N 15 129.363 0.000 . 1 . . . . A 15 TRP NE1 . 30718 1
131 . 1 . 1 16 16 GLU H H 1 8.147 0.005 . 1 . . . . A 16 GLU H . 30718 1
132 . 1 . 1 16 16 GLU HA H 1 4.196 0.003 . 1 . . . . A 16 GLU HA . 30718 1
133 . 1 . 1 16 16 GLU HB2 H 1 1.967 0.007 . 2 . . . . A 16 GLU HB2 . 30718 1
134 . 1 . 1 16 16 GLU HB3 H 1 2.067 0.004 . 2 . . . . A 16 GLU HB3 . 30718 1
135 . 1 . 1 16 16 GLU HG2 H 1 2.199 0.014 . 2 . . . . A 16 GLU HG2 . 30718 1
136 . 1 . 1 16 16 GLU HG3 H 1 2.256 0.005 . 2 . . . . A 16 GLU HG3 . 30718 1
137 . 1 . 1 16 16 GLU CA C 13 57.126 0.000 . 1 . . . . A 16 GLU CA . 30718 1
138 . 1 . 1 16 16 GLU CB C 13 32.683 0.000 . 1 . . . . A 16 GLU CB . 30718 1
139 . 1 . 1 16 16 GLU CG C 13 32.689 0.007 . 1 . . . . A 16 GLU CG . 30718 1
140 . 1 . 1 16 16 GLU N N 15 120.687 0.000 . 1 . . . . A 16 GLU N . 30718 1
141 . 1 . 1 17 17 GLY H H 1 8.332 0.005 . 1 . . . . A 17 GLY H . 30718 1
142 . 1 . 1 17 17 GLY HA2 H 1 3.923 0.009 . 2 . . . . A 17 GLY HA2 . 30718 1
143 . 1 . 1 17 17 GLY HA3 H 1 4.134 0.006 . 2 . . . . A 17 GLY HA3 . 30718 1
144 . 1 . 1 17 17 GLY CA C 13 45.710 0.009 . 1 . . . . A 17 GLY CA . 30718 1
145 . 1 . 1 17 17 GLY N N 15 109.565 0.000 . 1 . . . . A 17 GLY N . 30718 1
146 . 1 . 1 18 18 GLU H H 1 8.154 0.003 . 1 . . . . A 18 GLU H . 30718 1
147 . 1 . 1 18 18 GLU HA H 1 4.606 0.007 . 1 . . . . A 18 GLU HA . 30718 1
148 . 1 . 1 18 18 GLU HB2 H 1 2.146 0.005 . 2 . . . . A 18 GLU HB2 . 30718 1
149 . 1 . 1 18 18 GLU HB3 H 1 2.348 0.004 . 2 . . . . A 18 GLU HB3 . 30718 1
150 . 1 . 1 18 18 GLU HG2 H 1 2.590 0.006 . 2 . . . . A 18 GLU HG2 . 30718 1
151 . 1 . 1 18 18 GLU HG3 H 1 2.590 0.006 . 2 . . . . A 18 GLU HG3 . 30718 1
152 . 1 . 1 18 18 GLU CB C 13 29.226 0.006 . 1 . . . . A 18 GLU CB . 30718 1
153 . 1 . 1 18 18 GLU CG C 13 33.087 0.000 . 1 . . . . A 18 GLU CG . 30718 1
154 . 1 . 1 18 18 GLU N N 15 118.855 0.000 . 1 . . . . A 18 GLU N . 30718 1
155 . 1 . 1 19 19 CYS H H 1 8.412 0.002 . 1 . . . . A 19 CYS H . 30718 1
156 . 1 . 1 19 19 CYS HA H 1 4.798 0.002 . 1 . . . . A 19 CYS HA . 30718 1
157 . 1 . 1 19 19 CYS HB2 H 1 3.002 0.013 . 2 . . . . A 19 CYS HB2 . 30718 1
158 . 1 . 1 19 19 CYS HB3 H 1 3.191 0.004 . 2 . . . . A 19 CYS HB3 . 30718 1
159 . 1 . 1 19 19 CYS CB C 13 37.357 0.025 . 1 . . . . A 19 CYS CB . 30718 1
stop_
save_