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 50375
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name barr1_dpc
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
2 '2D 1H-1H COSY' . . . 50375 1
3 '2D 1H-1H TOCSY' . . . 50375 1
4 '2D 1H-1H NOESY' . . . 50375 1
5 '2D 1H-13C HSQC aliphatic' . . . 50375 1
6 '2D 1H-13C HSQC aromatic' . . . 50375 1
8 '2D 1H-1H TOCSY' . . . 50375 1
9 '2D 1H-13C HSQC aliphatic' . . . 50375 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
2 $software_2 . . 50375 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 ACE H1 H 1 1.934 0.001 . 1 . . . . . 0 ACE H1 . 50375 1
2 . 1 . 1 1 1 ACE H2 H 1 1.934 0.001 . 1 . . . . . 0 ACE H2 . 50375 1
3 . 1 . 1 1 1 ACE H3 H 1 1.934 0.001 . 1 . . . . . 0 ACE H3 . 50375 1
4 . 1 . 1 1 1 ACE CH3 C 13 24.720 0.000 . 1 . . . . . 0 ACE CH3 . 50375 1
5 . 1 . 1 2 2 TYR H H 1 8.137 0.003 . 1 . . . . . 1 TYR H . 50375 1
6 . 1 . 1 2 2 TYR HA H 1 4.580 0.008 . 1 . . . . . 1 TYR HA . 50375 1
7 . 1 . 1 2 2 TYR HB2 H 1 2.793 0.005 . 2 . . . . . 1 TYR HB2 . 50375 1
8 . 1 . 1 2 2 TYR HB3 H 1 3.044 0.004 . 2 . . . . . 1 TYR HB3 . 50375 1
9 . 1 . 1 2 2 TYR HD1 H 1 7.094 0.002 . 1 . . . . . 1 TYR HD1 . 50375 1
10 . 1 . 1 2 2 TYR HD2 H 1 7.094 0.002 . 1 . . . . . 1 TYR HD2 . 50375 1
11 . 1 . 1 2 2 TYR HE1 H 1 6.790 0.003 . 1 . . . . . 1 TYR HE1 . 50375 1
12 . 1 . 1 2 2 TYR HE2 H 1 6.790 0.003 . 1 . . . . . 1 TYR HE2 . 50375 1
13 . 1 . 1 2 2 TYR CA C 13 58.441 0.000 . 1 . . . . . 1 TYR CA . 50375 1
14 . 1 . 1 2 2 TYR CB C 13 39.767 0.007 . 1 . . . . . 1 TYR CB . 50375 1
15 . 1 . 1 2 2 TYR CD1 C 13 133.038 0.000 . 1 . . . . . 1 TYR CD1 . 50375 1
16 . 1 . 1 2 2 TYR CD2 C 13 133.038 0.000 . 1 . . . . . 1 TYR CD2 . 50375 1
17 . 1 . 1 2 2 TYR CE1 C 13 118.134 0.000 . 1 . . . . . 1 TYR CE1 . 50375 1
18 . 1 . 1 2 2 TYR CE2 C 13 118.134 0.000 . 1 . . . . . 1 TYR CE2 . 50375 1
19 . 1 . 1 3 3 GLY H H 1 8.809 0.001 . 1 . . . . . 2 GLY H . 50375 1
20 . 1 . 1 3 3 GLY HA2 H 1 3.964 0.003 . 2 . . . . . 2 GLY HA2 . 50375 1
21 . 1 . 1 3 3 GLY HA3 H 1 4.167 0.003 . 2 . . . . . 2 GLY HA3 . 50375 1
22 . 1 . 1 3 3 GLY CA C 13 45.095 0.000 . 1 . . . . . 2 GLY CA . 50375 1
23 . 1 . 1 4 4 ARG H H 1 8.612 0.001 . 1 . . . . . 3 ARG H . 50375 1
24 . 1 . 1 4 4 ARG HA H 1 4.094 0.007 . 1 . . . . . 3 ARG HA . 50375 1
25 . 1 . 1 4 4 ARG HB2 H 1 1.851 0.006 . 2 . . . . . 3 ARG HB2 . 50375 1
26 . 1 . 1 4 4 ARG HB3 H 1 1.909 0.005 . 2 . . . . . 3 ARG HB3 . 50375 1
27 . 1 . 1 4 4 ARG HG2 H 1 1.670 0.005 . 2 . . . . . 3 ARG HG2 . 50375 1
28 . 1 . 1 4 4 ARG HG3 H 1 1.670 0.005 . 2 . . . . . 3 ARG HG3 . 50375 1
29 . 1 . 1 4 4 ARG HD2 H 1 3.179 0.005 . 2 . . . . . 3 ARG HD2 . 50375 1
30 . 1 . 1 4 4 ARG HD3 H 1 3.231 0.008 . 2 . . . . . 3 ARG HD3 . 50375 1
31 . 1 . 1 4 4 ARG HE H 1 7.728 0.001 . 1 . . . . . 3 ARG HE . 50375 1
32 . 1 . 1 4 4 ARG CA C 13 58.082 0.088 . 1 . . . . . 3 ARG CA . 50375 1
33 . 1 . 1 4 4 ARG CB C 13 30.488 0.003 . 1 . . . . . 3 ARG CB . 50375 1
34 . 1 . 1 4 4 ARG CD C 13 43.353 0.001 . 1 . . . . . 3 ARG CD . 50375 1
35 . 1 . 1 5 5 GLU H H 1 9.055 0.001 . 1 . . . . . 4 GLU H . 50375 1
36 . 1 . 1 5 5 GLU HA H 1 4.204 0.014 . 1 . . . . . 4 GLU HA . 50375 1
37 . 1 . 1 5 5 GLU HB2 H 1 1.978 0.004 . 2 . . . . . 4 GLU HB2 . 50375 1
38 . 1 . 1 5 5 GLU HB3 H 1 2.064 0.004 . 2 . . . . . 4 GLU HB3 . 50375 1
39 . 1 . 1 5 5 GLU HG2 H 1 2.310 0.003 . 2 . . . . . 4 GLU HG2 . 50375 1
40 . 1 . 1 5 5 GLU HG3 H 1 2.310 0.003 . 2 . . . . . 4 GLU HG3 . 50375 1
41 . 1 . 1 5 5 GLU CA C 13 58.047 0.221 . 1 . . . . . 4 GLU CA . 50375 1
42 . 1 . 1 5 5 GLU CB C 13 29.239 0.026 . 1 . . . . . 4 GLU CB . 50375 1
43 . 1 . 1 5 5 GLU CG C 13 36.219 0.000 . 1 . . . . . 4 GLU CG . 50375 1
44 . 1 . 1 6 6 ASP H H 1 8.104 0.001 . 1 . . . . . 5 ASP H . 50375 1
45 . 1 . 1 6 6 ASP HA H 1 4.548 0.006 . 1 . . . . . 5 ASP HA . 50375 1
46 . 1 . 1 6 6 ASP HB2 H 1 2.713 0.008 . 2 . . . . . 5 ASP HB2 . 50375 1
47 . 1 . 1 6 6 ASP HB3 H 1 2.781 0.004 . 2 . . . . . 5 ASP HB3 . 50375 1
48 . 1 . 1 6 6 ASP CA C 13 55.628 0.000 . 1 . . . . . 5 ASP CA . 50375 1
49 . 1 . 1 6 6 ASP CB C 13 41.020 0.020 . 1 . . . . . 5 ASP CB . 50375 1
50 . 1 . 1 7 7 LEU H H 1 7.804 0.001 . 1 . . . . . 6 LEU H . 50375 1
51 . 1 . 1 7 7 LEU HA H 1 4.195 0.006 . 1 . . . . . 6 LEU HA . 50375 1
52 . 1 . 1 7 7 LEU HB2 H 1 1.636 0.002 . 2 . . . . . 6 LEU HB2 . 50375 1
53 . 1 . 1 7 7 LEU HB3 H 1 1.771 0.002 . 2 . . . . . 6 LEU HB3 . 50375 1
54 . 1 . 1 7 7 LEU HG H 1 1.720 0.005 . 1 . . . . . 6 LEU HG . 50375 1
55 . 1 . 1 7 7 LEU HD11 H 1 0.836 0.000 . 2 . . . . . 6 LEU QD1 . 50375 1
56 . 1 . 1 7 7 LEU HD12 H 1 0.836 0.000 . 2 . . . . . 6 LEU QD1 . 50375 1
57 . 1 . 1 7 7 LEU HD13 H 1 0.836 0.000 . 2 . . . . . 6 LEU QD1 . 50375 1
58 . 1 . 1 7 7 LEU HD21 H 1 0.920 0.004 . 2 . . . . . 6 LEU QD2 . 50375 1
59 . 1 . 1 7 7 LEU HD22 H 1 0.920 0.004 . 2 . . . . . 6 LEU QD2 . 50375 1
60 . 1 . 1 7 7 LEU HD23 H 1 0.920 0.004 . 2 . . . . . 6 LEU QD2 . 50375 1
61 . 1 . 1 7 7 LEU CA C 13 56.238 0.000 . 1 . . . . . 6 LEU CA . 50375 1
62 . 1 . 1 7 7 LEU CB C 13 42.059 0.006 . 1 . . . . . 6 LEU CB . 50375 1
63 . 1 . 1 7 7 LEU CG C 13 27.132 0.000 . 1 . . . . . 6 LEU CG . 50375 1
64 . 1 . 1 7 7 LEU CD1 C 13 23.841 0.000 . 1 . . . . . 6 LEU CD1 . 50375 1
65 . 1 . 1 7 7 LEU CD2 C 13 25.393 0.000 . 1 . . . . . 6 LEU CD2 . 50375 1
66 . 1 . 1 8 8 ASP H H 1 8.138 0.003 . 1 . . . . . 7 ASP H . 50375 1
67 . 1 . 1 8 8 ASP HA H 1 4.556 0.011 . 1 . . . . . 7 ASP HA . 50375 1
68 . 1 . 1 8 8 ASP HB2 H 1 2.722 0.003 . 2 . . . . . 7 ASP HB2 . 50375 1
69 . 1 . 1 8 8 ASP HB3 H 1 2.722 0.003 . 2 . . . . . 7 ASP HB3 . 50375 1
70 . 1 . 1 8 8 ASP CA C 13 55.180 0.000 . 1 . . . . . 7 ASP CA . 50375 1
71 . 1 . 1 8 8 ASP CB C 13 40.511 0.000 . 1 . . . . . 7 ASP CB . 50375 1
72 . 1 . 1 9 9 VAL H H 1 7.888 0.001 . 1 . . . . . 8 VAL H . 50375 1
73 . 1 . 1 9 9 VAL HA H 1 3.956 0.003 . 1 . . . . . 8 VAL HA . 50375 1
74 . 1 . 1 9 9 VAL HB H 1 2.223 0.003 . 1 . . . . . 8 VAL HB . 50375 1
75 . 1 . 1 9 9 VAL HG11 H 1 0.977 0.002 . 2 . . . . . 8 VAL QG1 . 50375 1
76 . 1 . 1 9 9 VAL HG12 H 1 0.977 0.002 . 2 . . . . . 8 VAL QG1 . 50375 1
77 . 1 . 1 9 9 VAL HG13 H 1 0.977 0.002 . 2 . . . . . 8 VAL QG1 . 50375 1
78 . 1 . 1 9 9 VAL HG21 H 1 1.038 0.005 . 2 . . . . . 8 VAL QG2 . 50375 1
79 . 1 . 1 9 9 VAL HG22 H 1 1.038 0.005 . 2 . . . . . 8 VAL QG2 . 50375 1
80 . 1 . 1 9 9 VAL HG23 H 1 1.038 0.005 . 2 . . . . . 8 VAL QG2 . 50375 1
81 . 1 . 1 9 9 VAL CA C 13 64.237 0.030 . 1 . . . . . 8 VAL CA . 50375 1
82 . 1 . 1 9 9 VAL CB C 13 32.119 0.000 . 1 . . . . . 8 VAL CB . 50375 1
83 . 1 . 1 9 9 VAL CG1 C 13 21.276 0.000 . 1 . . . . . 8 VAL CG1 . 50375 1
84 . 1 . 1 9 9 VAL CG2 C 13 21.362 0.000 . 1 . . . . . 8 VAL CG2 . 50375 1
85 . 1 . 1 10 10 LEU H H 1 7.957 0.001 . 1 . . . . . 9 LEU H . 50375 1
86 . 1 . 1 10 10 LEU HA H 1 4.176 0.004 . 1 . . . . . 9 LEU HA . 50375 1
87 . 1 . 1 10 10 LEU HB2 H 1 1.615 0.004 . 2 . . . . . 9 LEU HB2 . 50375 1
88 . 1 . 1 10 10 LEU HB3 H 1 1.862 0.003 . 2 . . . . . 9 LEU HB3 . 50375 1
89 . 1 . 1 10 10 LEU HG H 1 1.748 0.002 . 1 . . . . . 9 LEU HG . 50375 1
90 . 1 . 1 10 10 LEU HD11 H 1 0.879 0.005 . 2 . . . . . 9 LEU QD1 . 50375 1
91 . 1 . 1 10 10 LEU HD12 H 1 0.879 0.005 . 2 . . . . . 9 LEU QD1 . 50375 1
92 . 1 . 1 10 10 LEU HD13 H 1 0.879 0.005 . 2 . . . . . 9 LEU QD1 . 50375 1
93 . 1 . 1 10 10 LEU HD21 H 1 0.932 0.003 . 2 . . . . . 9 LEU QD2 . 50375 1
94 . 1 . 1 10 10 LEU HD22 H 1 0.932 0.003 . 2 . . . . . 9 LEU QD2 . 50375 1
95 . 1 . 1 10 10 LEU HD23 H 1 0.932 0.003 . 2 . . . . . 9 LEU QD2 . 50375 1
96 . 1 . 1 10 10 LEU CA C 13 56.424 0.087 . 1 . . . . . 9 LEU CA . 50375 1
97 . 1 . 1 10 10 LEU CB C 13 41.905 0.013 . 1 . . . . . 9 LEU CB . 50375 1
98 . 1 . 1 10 10 LEU CG C 13 27.174 0.000 . 1 . . . . . 9 LEU CG . 50375 1
99 . 1 . 1 10 10 LEU CD1 C 13 23.422 0.000 . 1 . . . . . 9 LEU CD1 . 50375 1
100 . 1 . 1 10 10 LEU CD2 C 13 25.587 0.000 . 1 . . . . . 9 LEU CD2 . 50375 1
101 . 1 . 1 11 11 GLY H H 1 8.108 0.001 . 1 . . . . . 10 GLY H . 50375 1
102 . 1 . 1 11 11 GLY HA2 H 1 3.844 0.005 . 2 . . . . . 10 GLY HA2 . 50375 1
103 . 1 . 1 11 11 GLY HA3 H 1 3.948 0.004 . 2 . . . . . 10 GLY HA3 . 50375 1
104 . 1 . 1 11 11 GLY CA C 13 45.100 0.000 . 1 . . . . . 10 GLY CA . 50375 1
105 . 1 . 1 12 12 LEU H H 1 7.926 0.001 . 1 . . . . . 11 LEU H . 50375 1
106 . 1 . 1 12 12 LEU HA H 1 4.256 0.007 . 1 . . . . . 11 LEU HA . 50375 1
107 . 1 . 1 12 12 LEU HB2 H 1 1.502 0.006 . 2 . . . . . 11 LEU HB2 . 50375 1
108 . 1 . 1 12 12 LEU HB3 H 1 1.748 0.003 . 2 . . . . . 11 LEU HB3 . 50375 1
109 . 1 . 1 12 12 LEU HG H 1 1.677 0.006 . 1 . . . . . 11 LEU HG . 50375 1
110 . 1 . 1 12 12 LEU HD11 H 1 0.868 0.004 . 2 . . . . . 11 LEU QD1 . 50375 1
111 . 1 . 1 12 12 LEU HD12 H 1 0.868 0.004 . 2 . . . . . 11 LEU QD1 . 50375 1
112 . 1 . 1 12 12 LEU HD13 H 1 0.868 0.004 . 2 . . . . . 11 LEU QD1 . 50375 1
113 . 1 . 1 12 12 LEU HD21 H 1 0.915 0.003 . 2 . . . . . 11 LEU QD2 . 50375 1
114 . 1 . 1 12 12 LEU HD22 H 1 0.915 0.003 . 2 . . . . . 11 LEU QD2 . 50375 1
115 . 1 . 1 12 12 LEU HD23 H 1 0.915 0.003 . 2 . . . . . 11 LEU QD2 . 50375 1
116 . 1 . 1 12 12 LEU CA C 13 55.846 0.001 . 1 . . . . . 11 LEU CA . 50375 1
117 . 1 . 1 12 12 LEU CB C 13 42.457 0.016 . 1 . . . . . 11 LEU CB . 50375 1
118 . 1 . 1 12 12 LEU CG C 13 27.094 0.000 . 1 . . . . . 11 LEU CG . 50375 1
119 . 1 . 1 12 12 LEU CD1 C 13 23.618 0.000 . 1 . . . . . 11 LEU CD1 . 50375 1
120 . 1 . 1 12 12 LEU CD2 C 13 25.379 0.000 . 1 . . . . . 11 LEU CD2 . 50375 1
121 . 1 . 1 13 13 THR H H 1 7.995 0.002 . 1 . . . . . 12 THR H . 50375 1
122 . 1 . 1 13 13 THR HA H 1 4.216 0.003 . 1 . . . . . 12 THR HA . 50375 1
123 . 1 . 1 13 13 THR HB H 1 4.086 0.004 . 1 . . . . . 12 THR HB . 50375 1
124 . 1 . 1 13 13 THR HG21 H 1 1.057 0.002 . 1 . . . . . 12 THR QG2 . 50375 1
125 . 1 . 1 13 13 THR HG22 H 1 1.057 0.002 . 1 . . . . . 12 THR QG2 . 50375 1
126 . 1 . 1 13 13 THR HG23 H 1 1.057 0.002 . 1 . . . . . 12 THR QG2 . 50375 1
127 . 1 . 1 13 13 THR CA C 13 63.047 0.071 . 1 . . . . . 12 THR CA . 50375 1
128 . 1 . 1 13 13 THR CB C 13 69.782 0.032 . 1 . . . . . 12 THR CB . 50375 1
129 . 1 . 1 13 13 THR CG2 C 13 21.470 0.000 . 1 . . . . . 12 THR CG2 . 50375 1
130 . 1 . 1 14 14 PHE H H 1 8.171 0.004 . 1 . . . . . 13 PHE H . 50375 1
131 . 1 . 1 14 14 PHE HA H 1 4.576 0.009 . 1 . . . . . 13 PHE HA . 50375 1
132 . 1 . 1 14 14 PHE HB2 H 1 3.024 0.003 . 2 . . . . . 13 PHE HB2 . 50375 1
133 . 1 . 1 14 14 PHE HB3 H 1 3.161 0.004 . 2 . . . . . 13 PHE HB3 . 50375 1
134 . 1 . 1 14 14 PHE HD1 H 1 7.265 0.001 . 1 . . . . . 13 PHE HD1 . 50375 1
135 . 1 . 1 14 14 PHE HD2 H 1 7.265 0.001 . 1 . . . . . 13 PHE HD2 . 50375 1
136 . 1 . 1 14 14 PHE HE1 H 1 7.266 0.001 . 1 . . . . . 13 PHE HE1 . 50375 1
137 . 1 . 1 14 14 PHE HE2 H 1 7.266 0.001 . 1 . . . . . 13 PHE HE2 . 50375 1
138 . 1 . 1 14 14 PHE HZ H 1 7.177 0.000 . 1 . . . . . 13 PHE HZ . 50375 1
139 . 1 . 1 14 14 PHE CA C 13 58.189 0.000 . 1 . . . . . 13 PHE CA . 50375 1
140 . 1 . 1 14 14 PHE CB C 13 39.729 0.001 . 1 . . . . . 13 PHE CB . 50375 1
141 . 1 . 1 14 14 PHE CD1 C 13 132.010 0.000 . 1 . . . . . 13 PHE CD1 . 50375 1
142 . 1 . 1 14 14 PHE CD2 C 13 132.010 0.000 . 1 . . . . . 13 PHE CD2 . 50375 1
143 . 1 . 1 14 14 PHE CE1 C 13 131.224 0.000 . 1 . . . . . 13 PHE CE1 . 50375 1
144 . 1 . 1 14 14 PHE CE2 C 13 131.224 0.000 . 1 . . . . . 13 PHE CE2 . 50375 1
145 . 1 . 1 14 14 PHE CZ C 13 129.459 0.000 . 1 . . . . . 13 PHE CZ . 50375 1
146 . 1 . 1 15 15 ARG H H 1 8.134 0.001 . 1 . . . . . 14 ARG H . 50375 1
147 . 1 . 1 15 15 ARG HA H 1 4.226 0.007 . 1 . . . . . 14 ARG HA . 50375 1
148 . 1 . 1 15 15 ARG HB2 H 1 1.741 0.005 . 2 . . . . . 14 ARG HB2 . 50375 1
149 . 1 . 1 15 15 ARG HB3 H 1 1.870 0.004 . 2 . . . . . 14 ARG HB3 . 50375 1
150 . 1 . 1 15 15 ARG HG2 H 1 1.589 0.006 . 2 . . . . . 14 ARG HG2 . 50375 1
151 . 1 . 1 15 15 ARG HG3 H 1 1.635 0.004 . 2 . . . . . 14 ARG HG3 . 50375 1
152 . 1 . 1 15 15 ARG HD2 H 1 3.166 0.009 . 2 . . . . . 14 ARG HD2 . 50375 1
153 . 1 . 1 15 15 ARG HD3 H 1 3.166 0.009 . 2 . . . . . 14 ARG HD3 . 50375 1
154 . 1 . 1 15 15 ARG HE H 1 7.424 0.003 . 1 . . . . . 14 ARG HE . 50375 1
155 . 1 . 1 15 15 ARG CA C 13 56.093 0.010 . 1 . . . . . 14 ARG CA . 50375 1
156 . 1 . 1 15 15 ARG CB C 13 30.968 0.002 . 1 . . . . . 14 ARG CB . 50375 1
157 . 1 . 1 15 15 ARG CG C 13 27.422 0.008 . 1 . . . . . 14 ARG CG . 50375 1
158 . 1 . 1 15 15 ARG CD C 13 43.440 0.000 . 1 . . . . . 14 ARG CD . 50375 1
159 . 1 . 1 16 16 NH2 HN1 H 1 6.900 0.000 . 2 . . . . . 15 NH2 HN1 . 50375 1
160 . 1 . 1 16 16 NH2 HN2 H 1 7.125 0.000 . 2 . . . . . 15 NH2 HN2 . 50375 1
stop_
save_