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 16941
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_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' . . . 16941 1
3 '2D 1H-1H NOESY' . . . 16941 1
4 '3D HCCH-TOCSY' . . . 16941 1
5 '3D 1H-13C NOESY' . . . 16941 1
6 '2D 1H-1H NOESY' . . . 16941 1
7 '2D 1H-1H NOESY' . . . 16941 1
8 '2D F1fF2f NOESY' . . . 16941 1
9 '2D F1fF2f NOESY' . . . 16941 1
10 '2D F1fF2f TOCSY' . . . 16941 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 $NMRPipe . . 16941 1
3 $SPARKY . . 16941 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.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 C H1' H 1 5.615 0.011 12 . . . . . 19 C H1' . 16941 1
2 . 1 1 3 3 C H2' H 1 4.680 0.019 9 . . . . . 19 C H2' . 16941 1
3 . 1 1 3 3 C H5 H 1 5.324 0.014 5 1 . . . . 19 C H5 . 16941 1
4 . 1 1 3 3 C H6 H 1 7.700 0.018 7 1 . . . . 19 C H6 . 16941 1
5 . 1 1 4 4 A H61 H 1 7.765 0.012 2 1 . . . . 20 A HN . 16941 1
6 . 1 1 4 4 A H1' H 1 6.062 0.011 19 . . . . . 20 A H1' . 16941 1
7 . 1 1 4 4 A H2 H 1 7.047 0.017 14 1 . . . . 20 A H2 . 16941 1
8 . 1 1 4 4 A H2' H 1 4.807 0.016 11 . . . . . 20 A H2' . 16941 1
9 . 1 1 4 4 A H8 H 1 7.966 0.007 9 1 . . . . 20 A H8 . 16941 1
10 . 1 1 5 5 G H21 H 1 7.304 0.027 2 1 . . . . 21 G HN . 16941 1
11 . 1 1 5 5 G H1 H 1 12.680 0.030 17 1 . . . . 21 G H1 . 16941 1
12 . 1 1 5 5 G H1' H 1 5.571 0.012 17 . . . . . 21 G H1' . 16941 1
13 . 1 1 5 5 G H2' H 1 4.489 0.016 12 . . . . . 21 G H2' . 16941 1
14 . 1 1 5 5 G H8 H 1 6.910 0.003 16 1 . . . . 21 G H8 . 16941 1
15 . 1 1 6 6 A H61 H 1 8.212 0.005 2 1 . . . . 22 A HN . 16941 1
16 . 1 1 6 6 A H1' H 1 6.082 0.016 18 . . . . . 22 A H1' . 16941 1
17 . 1 1 6 6 A H2 H 1 7.058 0.023 11 1 . . . . 22 A H2 . 16941 1
18 . 1 1 6 6 A H2' H 1 4.302 0.008 7 . . . . . 22 A H2' . 16941 1
19 . 1 1 6 6 A H8 H 1 7.798 0.004 13 1 . . . . 22 A H8 . 16941 1
20 . 1 1 7 7 U H1' H 1 5.989 0.003 14 . . . . . 23 U H1' . 16941 1
21 . 1 1 7 7 U H2' H 1 4.852 0.004 9 . . . . . 23 U H2' . 16941 1
22 . 1 1 7 7 U H3 H 1 14.228 0.003 4 1 . . . . 23 U H3 . 16941 1
23 . 1 1 7 7 U H5 H 1 5.152 0.003 8 1 . . . . 23 U H5 . 16941 1
24 . 1 1 7 7 U H6 H 1 7.912 0.004 12 1 . . . . 23 U H6 . 16941 1
25 . 1 1 8 8 C H1' H 1 6.142 0.006 13 . . . . . 24 C H1' . 16941 1
26 . 1 1 8 8 C H2' H 1 4.505 0.006 7 . . . . . 24 C H2' . 16941 1
27 . 1 1 8 8 C H5 H 1 6.174 0.014 4 1 . . . . 24 C H5 . 16941 1
28 . 1 1 8 8 C H6 H 1 7.973 0.003 10 1 . . . . 24 C H6 . 16941 1
29 . 1 1 9 9 U H1' H 1 6.241 0.006 7 . . . . . 25 U H1' . 16941 1
30 . 1 1 9 9 U H2' H 1 4.579 0.006 8 . . . . . 25 U H2' . 16941 1
31 . 1 1 9 9 U H5 H 1 6.030 0.016 2 1 . . . . 25 U H5 . 16941 1
32 . 1 1 9 9 U H6 H 1 8.071 0.004 6 1 . . . . 25 U H6 . 16941 1
33 . 1 1 10 10 G H21 H 1 8.204 0.003 2 1 . . . . 26 G HN . 16941 1
34 . 1 1 10 10 G H1 H 1 12.769 0.018 14 1 . . . . 26 G H1 . 16941 1
35 . 1 1 10 10 G H1' H 1 6.100 0.005 9 . . . . . 26 G H1' . 16941 1
36 . 1 1 10 10 G H2' H 1 5.176 0.007 7 . . . . . 26 G H2' . 16941 1
37 . 1 1 10 10 G H3' H 1 5.168 0.002 3 . . . . . 26 G H3' . 16941 1
38 . 1 1 10 10 G H8 H 1 7.850 0.002 15 1 . . . . 26 G H8 . 16941 1
39 . 1 1 11 11 A H1' H 1 6.111 0.007 8 . . . . . 27 A H1' . 16941 1
40 . 1 1 11 11 A H2 H 1 7.448 0.015 16 1 . . . . 27 A H2 . 16941 1
41 . 1 1 11 11 A H2' H 1 4.802 0.008 7 . . . . . 27 A H2' . 16941 1
42 . 1 1 11 11 A H8 H 1 7.989 0.010 8 1 . . . . 27 A H8 . 16941 1
43 . 1 1 12 12 G H1 H 1 13.831 0.017 15 1 . . . . 28 G H1 . 16941 1
44 . 1 1 12 12 G H1' H 1 6.036 0.006 16 . . . . . 28 G H1' . 16941 1
45 . 1 1 12 12 G H2' H 1 4.700 0.010 7 . . . . . 28 G H2' . 16941 1
46 . 1 1 12 12 G H8 H 1 7.830 0.005 7 1 . . . . 28 G H8 . 16941 1
47 . 1 1 13 13 C H1' H 1 5.612 0.004 8 . . . . . 29 C H1' . 16941 1
48 . 1 1 13 13 C H2' H 1 4.419 0.006 12 . . . . . 29 C H2' . 16941 1
49 . 1 1 13 13 C H5 H 1 5.276 0.013 4 1 . . . . 29 C H5 . 16941 1
50 . 1 1 13 13 C H6 H 1 7.656 0.013 15 1 . . . . 29 C H6 . 16941 1
51 . 1 1 14 14 C H1' H 1 5.798 0.007 16 . . . . . 30 C H1' . 16941 1
52 . 1 1 14 14 C H2' H 1 4.474 0.004 8 . . . . . 30 C H2' . 16941 1
53 . 1 1 14 14 C H5 H 1 5.559 0.003 2 1 . . . . 30 C H5 . 16941 1
54 . 1 1 14 14 C H6 H 1 7.715 0.002 7 1 . . . . 30 C H6 . 16941 1
55 . 1 1 15 15 U H1' H 1 5.646 0.004 8 . . . . . 31 U H1' . 16941 1
56 . 1 1 15 15 U H2' H 1 4.365 0.007 10 . . . . . 31 U H2' . 16941 1
57 . 1 1 15 15 U H6 H 1 7.818 0.004 8 1 . . . . 31 U H6 . 16941 1
58 . 1 1 16 16 G H1' H 1 5.554 0.002 6 . . . . . 32 G H1' . 16941 1
59 . 1 1 16 16 G H2' H 1 4.677 0.000 1 . . . . . 32 G H2' . 16941 1
60 . 1 1 16 16 G H8 H 1 7.839 0.013 5 1 . . . . 32 G H8 . 16941 1
61 . 1 1 17 17 G H1' H 1 5.828 0.009 4 . . . . . 33 G H1' . 16941 1
62 . 1 1 17 17 G H2' H 1 4.869 0.000 1 . . . . . 33 G H2' . 16941 1
63 . 1 1 17 17 G H8 H 1 7.891 0.001 6 1 . . . . 33 G H8 . 16941 1
64 . 1 1 18 18 G H1' H 1 6.033 0.005 15 . . . . . 34 G H1' . 16941 1
65 . 1 1 18 18 G H2' H 1 5.063 0.006 10 . . . . . 34 G H2' . 16941 1
66 . 1 1 18 18 G H8 H 1 8.089 0.005 15 1 . . . . 34 G H8 . 16941 1
67 . 1 1 19 19 A H1' H 1 6.221 0.007 12 . . . . . 35 A H1' . 16941 1
68 . 1 1 19 19 A H2 H 1 8.296 0.002 10 1 . . . . 35 A H2 . 16941 1
69 . 1 1 19 19 A H2' H 1 4.939 0.000 1 . . . . . 35 A H2' . 16941 1
70 . 1 1 19 19 A H4' H 1 4.703 0.000 1 . . . . . 35 A H4' . 16941 1
71 . 1 1 19 19 A H5' H 1 4.445 0.000 1 . . . . . 35 A H5' . 16941 1
72 . 1 1 19 19 A H5'' H 1 4.349 0.000 1 2 . . . . 35 A H5'' . 16941 1
73 . 1 1 19 19 A H8 H 1 8.514 0.006 16 1 . . . . 35 A H8 . 16941 1
74 . 1 1 20 20 G H1 H 1 13.285 0.020 9 1 . . . . 36 G H1 . 16941 1
75 . 1 1 20 20 G H1' H 1 5.819 0.007 9 . . . . . 36 G H1' . 16941 1
76 . 1 1 20 20 G H2' H 1 4.821 0.025 6 . . . . . 36 G H2' . 16941 1
77 . 1 1 20 20 G H8 H 1 7.877 0.007 5 1 . . . . 36 G H8 . 16941 1
78 . 1 1 21 21 C H1' H 1 5.751 0.010 11 . . . . . 37 C H1' . 16941 1
79 . 1 1 21 21 C H2' H 1 4.719 0.008 8 . . . . . 37 C H2' . 16941 1
80 . 1 1 21 21 C H5 H 1 5.320 0.002 4 1 . . . . 37 C H5 . 16941 1
81 . 1 1 21 21 C H6 H 1 7.916 0.002 7 1 . . . . 37 C H6 . 16941 1
82 . 1 1 22 22 U H1' H 1 5.808 0.016 11 . . . . . 38 U H1' . 16941 1
83 . 1 1 22 22 U H2' H 1 4.865 0.004 7 . . . . . 38 U H2' . 16941 1
84 . 1 1 22 22 U H3 H 1 14.477 0.018 14 1 . . . . 38 U H3 . 16941 1
85 . 1 1 22 22 U H5 H 1 5.579 0.014 5 1 . . . . 38 U H5 . 16941 1
86 . 1 1 22 22 U H6 H 1 7.837 0.012 10 1 . . . . 38 U H6 . 16941 1
87 . 1 1 23 23 C H1' H 1 5.264 0.010 15 . . . . . 39 C H1' . 16941 1
88 . 1 1 23 23 C H2' H 1 4.604 0.006 13 . . . . . 39 C H2' . 16941 1
89 . 1 1 23 23 C H3' H 1 4.044 0.014 6 . . . . . 39 C H3' . 16941 1
90 . 1 1 23 23 C H5 H 1 5.691 0.026 8 1 . . . . 39 C H5 . 16941 1
91 . 1 1 23 23 C H6 H 1 7.629 0.021 19 1 . . . . 39 C H6 . 16941 1
92 . 1 1 24 24 U H1' H 1 5.587 0.005 13 . . . . . 40 U H1' . 16941 1
93 . 1 1 24 24 U H2' H 1 4.532 0.014 9 . . . . . 40 U H2' . 16941 1
94 . 1 1 24 24 U H3 H 1 14.257 0.011 16 1 . . . . 40 U H3 . 16941 1
95 . 1 1 24 24 U H5 H 1 5.537 0.004 4 1 . . . . 40 U H5 . 16941 1
96 . 1 1 24 24 U H6 H 1 8.045 0.019 19 1 . . . . 40 U H6 . 16941 1
97 . 1 1 25 25 C H1' H 1 5.573 0.011 14 . . . . . 41 C H1' . 16941 1
98 . 1 1 25 25 C H2' H 1 4.309 0.007 12 . . . . . 41 C H2' . 16941 1
99 . 1 1 25 25 C H5 H 1 5.774 0.010 8 1 . . . . 41 C H5 . 16941 1
100 . 1 1 25 25 C H6 H 1 7.994 0.024 8 1 . . . . 41 C H6 . 16941 1
101 . 1 1 26 26 U H1' H 1 5.547 0.008 13 . . . . . 42 U H1' . 16941 1
102 . 1 1 26 26 U H2' H 1 4.654 0.022 8 . . . . . 42 U H2' . 16941 1
103 . 1 1 26 26 U H3 H 1 13.422 0.016 9 1 . . . . 42 U H3 . 16941 1
104 . 1 1 26 26 U H5 H 1 5.419 0.006 4 1 . . . . 42 U H5 . 16941 1
105 . 1 1 26 26 U H6 H 1 7.948 0.023 9 1 . . . . 42 U H6 . 16941 1
106 . 1 1 27 27 G H1 H 1 12.553 0.020 10 1 . . . . 43 G H1 . 16941 1
107 . 1 1 27 27 G H1' H 1 5.893 0.007 18 . . . . . 43 G H1' . 16941 1
108 . 1 1 27 27 G H2' H 1 4.575 0.014 9 . . . . . 43 G H2' . 16941 1
109 . 1 1 27 27 G H3' H 1 4.696 0.005 2 . . . . . 43 G H3' . 16941 1
110 . 1 1 27 27 G H8 H 1 7.898 0.009 11 1 . . . . 43 G H8 . 16941 1
111 . 1 1 28 28 C H1' H 1 5.578 0.011 14 . . . . . 44 C H1' . 16941 1
112 . 1 1 28 28 C H2' H 1 4.310 0.009 9 . . . . . 44 C H2' . 16941 1
113 . 1 1 28 28 C H5 H 1 5.263 0.009 4 1 . . . . 44 C H5 . 16941 1
114 . 1 1 28 28 C H6 H 1 7.791 0.011 12 1 . . . . 44 C H6 . 16941 1
115 . 1 1 29 29 C H1' H 1 5.828 0.016 10 . . . . . 45 C H1' . 16941 1
116 . 1 1 29 29 C H2' H 1 4.084 0.007 9 . . . . . 45 C H2' . 16941 1
117 . 1 1 29 29 C H4' H 1 4.245 0.001 2 . . . . . 45 C H4' . 16941 1
118 . 1 1 29 29 C H6 H 1 7.753 0.008 10 1 . . . . 45 C H6 . 16941 1
119 . 2 2 1 1 ARG H H 1 8.009 0.003 14 1 . . . . 1 R HN . 16941 1
120 . 2 2 1 1 ARG HA H 1 4.687 0.004 19 1 . . . . 1 R HA . 16941 1
121 . 2 2 1 1 ARG HB2 H 1 1.978 0.004 12 2 . . . . 1 R HB2 . 16941 1
122 . 2 2 1 1 ARG HB3 H 1 1.978 0.004 12 2 . . . . 1 R HB3 . 16941 1
123 . 2 2 1 1 ARG HD2 H 1 3.421 0.005 14 . . . . . 1 R HD1 . 16941 1
124 . 2 2 1 1 ARG HD3 H 1 3.293 0.013 12 2 . . . . 1 R HD2 . 16941 1
125 . 2 2 1 1 ARG HG2 H 1 1.673 0.011 13 2 . . . . 1 R HG . 16941 1
126 . 2 2 1 1 ARG HG3 H 1 1.673 0.011 13 2 . . . . 1 R HG . 16941 1
127 . 2 2 1 1 ARG HH11 H 1 7.449 0.002 6 2 . . . . 1 R HH1* . 16941 1
128 . 2 2 1 1 ARG HH12 H 1 7.449 0.002 6 2 . . . . 1 R HH1* . 16941 1
129 . 2 2 1 1 ARG HH21 H 1 6.974 0.014 2 2 . . . . 1 R HH2* . 16941 1
130 . 2 2 1 1 ARG HH22 H 1 6.974 0.014 2 2 . . . . 1 R HH2* . 16941 1
131 . 2 2 2 2 VAL H H 1 8.705 0.004 11 1 . . . . 2 V HN . 16941 1
132 . 2 2 2 2 VAL HA H 1 4.798 0.003 7 1 . . . . 2 V HA . 16941 1
133 . 2 2 2 2 VAL HB H 1 1.890 0.004 6 1 . . . . 2 V HB . 16941 1
134 . 2 2 2 2 VAL HG11 H 1 0.755 0.020 18 2 . . . . 2 V HG1 . 16941 1
135 . 2 2 2 2 VAL HG12 H 1 0.755 0.020 18 2 . . . . 2 V HG1 . 16941 1
136 . 2 2 2 2 VAL HG13 H 1 0.755 0.020 18 2 . . . . 2 V HG1 . 16941 1
137 . 2 2 2 2 VAL HG21 H 1 0.836 0.003 13 2 . . . . 2 V HG2 . 16941 1
138 . 2 2 2 2 VAL HG22 H 1 0.836 0.003 13 2 . . . . 2 V HG2 . 16941 1
139 . 2 2 2 2 VAL HG23 H 1 0.836 0.003 13 2 . . . . 2 V HG2 . 16941 1
140 . 2 2 3 3 ARG HA H 1 4.775 0.009 11 1 . . . . 3 R HA . 16941 1
141 . 2 2 3 3 ARG HB2 H 1 1.812 0.003 5 2 . . . . 3 R HB2 . 16941 1
142 . 2 2 3 3 ARG HB3 H 1 1.812 0.003 5 2 . . . . 3 R HB3 . 16941 1
143 . 2 2 3 3 ARG HD2 H 1 3.104 0.001 6 . . . . . 3 R HD1 . 16941 1
144 . 2 2 3 3 ARG HD3 H 1 3.327 0.008 9 2 . . . . 3 R HD2 . 16941 1
145 . 2 2 3 3 ARG HG2 H 1 1.648 0.010 8 . . . . . 3 R HG1 . 16941 1
146 . 2 2 3 3 ARG HG3 H 1 1.477 0.007 11 2 . . . . 3 R HG2 . 16941 1
147 . 2 2 3 3 ARG HH11 H 1 7.369 0.000 1 . . . . . 3 R HH1* . 16941 1
148 . 2 2 3 3 ARG HH12 H 1 7.369 0.000 1 . . . . . 3 R HH1* . 16941 1
149 . 2 2 4 4 CYS H H 1 9.311 0.012 6 1 . . . . 4 C HN . 16941 1
150 . 2 2 4 4 CYS HA H 1 5.867 0.004 20 1 . . . . 4 C HA . 16941 1
151 . 2 2 4 4 CYS HB2 H 1 3.103 0.013 8 . . . . . 4 C HB1 . 16941 1
152 . 2 2 4 4 CYS HB3 H 1 2.761 0.008 10 2 . . . . 4 C HB2 . 16941 1
153 . 2 2 5 5 ARG H H 1 9.213 0.002 5 1 . . . . 5 R HN . 16941 1
154 . 2 2 5 5 ARG HA H 1 4.802 0.010 8 1 . . . . 5 R HA . 16941 1
155 . 2 2 5 5 ARG HB2 H 1 2.125 0.005 7 . . . . . 5 R HB1 . 16941 1
156 . 2 2 5 5 ARG HB3 H 1 1.664 0.002 4 2 . . . . 5 R HB2 . 16941 1
157 . 2 2 5 5 ARG HD2 H 1 2.913 0.006 6 . . . . . 5 R HD2 . 16941 1
158 . 2 2 5 5 ARG HD3 H 1 2.902 0.000 1 2 . . . . 5 R HD3 . 16941 1
159 . 2 2 5 5 ARG HG2 H 1 1.514 0.022 3 . . . . . 5 R HG1 . 16941 1
160 . 2 2 5 5 ARG HG3 H 1 1.615 0.005 5 2 . . . . 5 R HG2 . 16941 1
161 . 2 2 6 6 GLN H H 1 8.431 0.007 7 1 . . . . 6 Q HN . 16941 1
162 . 2 2 6 6 GLN HA H 1 4.992 0.005 10 1 . . . . 6 Q HA . 16941 1
163 . 2 2 6 6 GLN HB2 H 1 2.092 0.010 13 2 . . . . 6 Q HB2 . 16941 1
164 . 2 2 6 6 GLN HB3 H 1 2.092 0.010 13 2 . . . . 6 Q HB3 . 16941 1
165 . 2 2 6 6 GLN HG2 H 1 2.422 0.004 9 . . . . . 6 Q HG1 . 16941 1
166 . 2 2 6 6 GLN HG3 H 1 2.301 0.010 9 2 . . . . 6 Q HG2 . 16941 1
167 . 2 2 6 6 GLN HE21 H 1 7.742 0.008 10 . . . . . 6 Q HN1 . 16941 1
168 . 2 2 6 6 GLN HE22 H 1 6.826 0.004 7 . . . . . 6 Q HN2 . 16941 1
169 . 2 2 7 7 ARG H H 1 9.111 0.009 9 1 . . . . 7 R HN . 16941 1
170 . 2 2 7 7 ARG HA H 1 4.342 0.005 15 1 . . . . 7 R HA . 16941 1
171 . 2 2 7 7 ARG HB2 H 1 1.739 0.001 6 . . . . . 7 R HB1 . 16941 1
172 . 2 2 7 7 ARG HB3 H 1 1.746 0.000 2 2 . . . . 7 R HB2 . 16941 1
173 . 2 2 7 7 ARG HD2 H 1 2.955 0.001 3 . . . . . 7 R HD1 . 16941 1
174 . 2 2 7 7 ARG HD3 H 1 2.579 0.010 8 2 . . . . 7 R HD2 . 16941 1
175 . 2 2 7 7 ARG HG2 H 1 1.308 0.011 15 2 . . . . 7 R HG . 16941 1
176 . 2 2 7 7 ARG HG3 H 1 1.308 0.011 15 2 . . . . 7 R HG . 16941 1
177 . 2 2 8 8 LYS H H 1 9.733 0.006 4 1 . . . . 8 K HN . 16941 1
178 . 2 2 8 8 LYS HA H 1 3.779 0.006 10 1 . . . . 8 K HA . 16941 1
179 . 2 2 8 8 LYS HB2 H 1 1.885 0.004 4 2 . . . . 8 K HB2 . 16941 1
180 . 2 2 8 8 LYS HB3 H 1 1.885 0.004 4 2 . . . . 8 K HB3 . 16941 1
181 . 2 2 8 8 LYS HD2 H 1 1.662 0.002 4 . . . . . 8 K HD1 . 16941 1
182 . 2 2 8 8 LYS HD3 H 1 1.717 0.012 5 2 . . . . 8 K HD2 . 16941 1
183 . 2 2 8 8 LYS HE2 H 1 3.071 0.017 5 . . . . . 8 K HE1 . 16941 1
184 . 2 2 8 8 LYS HG2 H 1 1.344 0.011 6 . . . . . 8 K HG1 . 16941 1
185 . 2 2 8 8 LYS HG3 H 1 1.409 0.005 2 2 . . . . 8 K HG2 . 16941 1
186 . 2 2 8 8 LYS HZ1 H 1 7.699 0.001 5 . . . . . 8 K NH3 . 16941 1
187 . 2 2 8 8 LYS HZ2 H 1 7.699 0.001 5 . . . . . 8 K NH3 . 16941 1
188 . 2 2 8 8 LYS HZ3 H 1 7.699 0.001 5 . . . . . 8 K NH3 . 16941 1
189 . 2 2 9 9 GLY H H 1 7.851 0.008 4 1 . . . . 9 G HN . 16941 1
190 . 2 2 9 9 GLY HA2 H 1 4.236 0.011 3 . . . . . 9 G HA1 . 16941 1
191 . 2 2 9 9 GLY HA3 H 1 3.720 0.001 2 2 . . . . 9 G HA2 . 16941 1
192 . 2 2 10 10 ARG H H 1 9.114 0.009 6 1 . . . . 10 R HN . 16941 1
193 . 2 2 10 10 ARG HA H 1 4.734 0.016 11 1 . . . . 10 R HA . 16941 1
194 . 2 2 10 10 ARG HB2 H 1 1.970 0.004 7 . . . . . 10 R HB1 . 16941 1
195 . 2 2 10 10 ARG HB3 H 1 1.858 0.006 7 2 . . . . 10 R HB2 . 16941 1
196 . 2 2 10 10 ARG HD2 H 1 3.093 0.003 7 . . . . . 10 R HD1 . 16941 1
197 . 2 2 10 10 ARG HD3 H 1 2.962 0.005 9 2 . . . . 10 R HD2 . 16941 1
198 . 2 2 10 10 ARG HE H 1 7.743 0.000 1 1 . . . . 10 R HE . 16941 1
199 . 2 2 10 10 ARG HG2 H 1 1.697 0.000 3 . . . . . 10 R HG1 . 16941 1
200 . 2 2 10 10 ARG HG3 H 1 1.473 0.011 2 2 . . . . 10 R HG2 . 16941 1
201 . 2 2 10 10 ARG HH11 H 1 7.373 0.006 2 . . . . . 10 R HH1* . 16941 1
202 . 2 2 10 10 ARG HH12 H 1 7.373 0.006 2 . . . . . 10 R HH1* . 16941 1
203 . 2 2 11 11 ARG H H 1 9.028 0.024 6 1 . . . . 11 R HN . 16941 1
204 . 2 2 11 11 ARG HA H 1 4.789 0.007 6 1 . . . . 11 R HA . 16941 1
205 . 2 2 11 11 ARG HB2 H 1 1.897 0.001 2 . . . . . 11 R HB1 . 16941 1
206 . 2 2 11 11 ARG HB3 H 1 1.804 0.002 2 2 . . . . 11 R HB2 . 16941 1
207 . 2 2 11 11 ARG HD2 H 1 3.240 0.006 15 2 . . . . 11 R HD . 16941 1
208 . 2 2 11 11 ARG HD3 H 1 3.240 0.006 15 2 . . . . 11 R HD . 16941 1
209 . 2 2 11 11 ARG HG2 H 1 1.621 0.005 3 2 . . . . 11 R HG . 16941 1
210 . 2 2 11 11 ARG HG3 H 1 1.621 0.005 3 2 . . . . 11 R HG . 16941 1
211 . 2 2 12 12 ILE H H 1 9.228 0.002 2 1 . . . . 12 I HN . 16941 1
212 . 2 2 12 12 ILE HA H 1 4.684 0.008 5 1 . . . . 12 I HA . 16941 1
213 . 2 2 12 12 ILE HB H 1 1.802 0.010 4 1 . . . . 12 I HB . 16941 1
214 . 2 2 12 12 ILE HD11 H 1 0.834 0.007 7 . . . . . 12 I HD . 16941 1
215 . 2 2 12 12 ILE HD12 H 1 0.834 0.007 7 . . . . . 12 I HD . 16941 1
216 . 2 2 12 12 ILE HD13 H 1 0.834 0.007 7 . . . . . 12 I HD . 16941 1
217 . 2 2 12 12 ILE HG12 H 1 0.991 0.000 1 . . . . . 12 I HG1# . 16941 1
218 . 2 2 12 12 ILE HG13 H 1 0.991 0.000 1 . . . . . 12 I HG1# . 16941 1
219 . 2 2 12 12 ILE HG21 H 1 0.898 0.002 10 . . . . . 12 I HG2# . 16941 1
220 . 2 2 12 12 ILE HG22 H 1 0.898 0.002 10 . . . . . 12 I HG2# . 16941 1
221 . 2 2 12 12 ILE HG23 H 1 0.898 0.002 10 . . . . . 12 I HG2# . 16941 1
222 . 2 2 13 13 CYS H H 1 9.264 0.017 4 1 . . . . 13 C HN . 16941 1
223 . 2 2 13 13 CYS HA H 1 5.591 0.004 20 1 . . . . 13 C HA . 16941 1
224 . 2 2 13 13 CYS HB2 H 1 2.966 0.011 12 . . . . . 13 C HB1 . 16941 1
225 . 2 2 13 13 CYS HB3 H 1 2.563 0.006 12 2 . . . . 13 C HB2 . 16941 1
226 . 2 2 14 14 ILE H H 1 9.091 0.015 11 1 . . . . 14 I HN . 16941 1
227 . 2 2 14 14 ILE HA H 1 4.608 0.008 21 1 . . . . 14 I HA . 16941 1
228 . 2 2 14 14 ILE HB H 1 1.922 0.005 9 1 . . . . 14 I HB . 16941 1
229 . 2 2 14 14 ILE HD11 H 1 0.917 0.003 5 . . . . . 14 I HD . 16941 1
230 . 2 2 14 14 ILE HD12 H 1 0.917 0.003 5 . . . . . 14 I HD . 16941 1
231 . 2 2 14 14 ILE HD13 H 1 0.917 0.003 5 . . . . . 14 I HD . 16941 1
232 . 2 2 14 14 ILE HG12 H 1 1.490 0.003 9 . . . . . 14 I HG11 . 16941 1
233 . 2 2 14 14 ILE HG13 H 1 1.220 0.005 8 2 . . . . 14 I HG12 . 16941 1
234 . 2 2 14 14 ILE HG21 H 1 0.989 0.006 7 1 . . . . 14 I HG2 . 16941 1
235 . 2 2 14 14 ILE HG22 H 1 0.989 0.006 7 1 . . . . 14 I HG2 . 16941 1
236 . 2 2 14 14 ILE HG23 H 1 0.989 0.006 7 1 . . . . 14 I HG2 . 16941 1
237 . 2 2 15 15 ARG H H 1 8.914 0.006 22 1 . . . . 15 R HN . 16941 1
238 . 2 2 15 15 ARG HA H 1 4.958 0.006 11 1 . . . . 15 R HA . 16941 1
239 . 2 2 15 15 ARG HB2 H 1 1.946 0.003 3 . . . . . 15 R HB1 . 16941 1
240 . 2 2 15 15 ARG HB3 H 1 1.839 0.000 1 2 . . . . 15 R HB2 . 16941 1
241 . 2 2 15 15 ARG HD2 H 1 3.283 0.020 7 . . . . . 15 R HD1 . 16941 1
242 . 2 2 15 15 ARG HD3 H 1 3.213 0.019 4 2 . . . . 15 R HD2 . 16941 1
243 . 2 2 15 15 ARG HE H 1 7.450 0.003 10 1 . . . . 15 R HE . 16941 1
244 . 2 2 15 15 ARG HG2 H 1 1.736 0.000 1 . . . . . 15 R HG1 . 16941 1
245 . 2 2 15 15 ARG HG3 H 1 1.611 0.004 2 2 . . . . 15 R HG2 . 16941 1
246 . 2 2 15 15 ARG HH11 H 1 6.994 0.005 5 . . . . . 15 R HH1* . 16941 1
247 . 2 2 15 15 ARG HH12 H 1 6.994 0.005 5 . . . . . 15 R HH1* . 16941 1
248 . 2 2 15 15 ARG HH21 H 1 6.565 0.003 6 . . . . . 15 R HH2* . 16941 1
249 . 2 2 15 15 ARG HH22 H 1 6.565 0.003 6 . . . . . 15 R HH2* . 16941 1
250 . 2 2 16 16 ILE H H 1 9.072 0.003 2 1 . . . . 16 I HN . 16941 1
251 . 2 2 16 16 ILE HA H 1 4.636 0.004 14 1 . . . . 16 I HA . 16941 1
252 . 2 2 16 16 ILE HB H 1 1.850 0.003 12 1 . . . . 16 I HB . 16941 1
253 . 2 2 16 16 ILE HD11 H 1 0.905 0.004 12 . . . . . 16 I HD . 16941 1
254 . 2 2 16 16 ILE HD12 H 1 0.905 0.004 12 . . . . . 16 I HD . 16941 1
255 . 2 2 16 16 ILE HD13 H 1 0.905 0.004 12 . . . . . 16 I HD . 16941 1
256 . 2 2 16 16 ILE HG12 H 1 1.485 0.002 6 . . . . . 16 I HG11 . 16941 1
257 . 2 2 16 16 ILE HG13 H 1 1.152 0.002 4 2 . . . . 16 I HG12 . 16941 1
258 . 2 2 16 16 ILE HG21 H 1 0.998 0.001 6 1 . . . . 16 I HG2 . 16941 1
259 . 2 2 16 16 ILE HG22 H 1 0.998 0.001 6 1 . . . . 16 I HG2 . 16941 1
260 . 2 2 16 16 ILE HG23 H 1 0.998 0.001 6 1 . . . . 16 I HG2 . 16941 1
261 . 2 2 17 17 DPR H H 1 7.194 0.026 2 1 . . . . 17 X HN . 16941 1
262 . 2 2 17 17 DPR HA H 1 4.641 0.003 16 1 . . . . 17 X HA . 16941 1
263 . 2 2 17 17 DPR HB2 H 1 2.341 0.005 9 . . . . . 17 X HB1 . 16941 1
264 . 2 2 17 17 DPR HB3 H 1 2.247 0.004 9 2 . . . . 17 X HB2 . 16941 1
265 . 2 2 17 17 DPR HD2 H 1 4.152 0.003 17 . . . . . 17 X HD1 . 16941 1
266 . 2 2 17 17 DPR HD3 H 1 3.853 0.002 10 2 . . . . 17 X HD2 . 16941 1
267 . 2 2 17 17 DPR HG2 H 1 2.056 0.004 11 . . . . . 17 X HG1 . 16941 1
268 . 2 2 17 17 DPR HG3 H 1 2.197 0.005 9 2 . . . . 17 X HG2 . 16941 1
269 . 2 2 18 18 PRO HA H 1 4.905 0.007 5 1 . . . . 18 P HA . 16941 1
270 . 2 2 18 18 PRO HB2 H 1 2.408 0.003 11 . . . . . 18 P HB1 . 16941 1
271 . 2 2 18 18 PRO HB3 H 1 2.017 0.003 9 2 . . . . 18 P HB2 . 16941 1
272 . 2 2 18 18 PRO HD2 H 1 3.987 0.002 20 . . . . . 18 P HD1 . 16941 1
273 . 2 2 18 18 PRO HD3 H 1 3.592 0.003 22 2 . . . . 18 P HD2 . 16941 1
274 . 2 2 18 18 PRO HG2 H 1 2.247 0.001 10 . . . . . 18 P HG1 . 16941 1
275 . 2 2 18 18 PRO HG3 H 1 2.133 0.001 11 2 . . . . 18 P HG2 . 16941 1
stop_
save_