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 19716
_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 '3D CBCA(CO)NH' . . . 19716 1
2 '3D HCCH-TOCSY' . . . 19716 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 1 1 LYS H H 1 8.4442 0.0000 . 1 . 2642 . A 1 LYS H . 19716 1
2 . 1 1 1 1 LYS HA H 1 4.3287 0.0000 . 1 . . . A 1 LYS HA . 19716 1
3 . 1 1 1 1 LYS HB2 H 1 1.7139 0.0000 . 2 . . . A 1 LYS HB2 . 19716 1
4 . 1 1 1 1 LYS HB3 H 1 1.3657 0.0000 . 2 . . . A 1 LYS HB3 . 19716 1
5 . 1 1 1 1 LYS HG2 H 1 1.4075 0.0000 . 2 . . . A 1 LYS HG2 . 19716 1
6 . 1 1 1 1 LYS HG3 H 1 1.4099 0.0000 . 2 . . . A 1 LYS HG3 . 19716 1
7 . 1 1 1 1 LYS HD2 H 1 1.7170 0.0000 . 2 . . . A 1 LYS HD2 . 19716 1
8 . 1 1 1 1 LYS HE2 H 1 2.9744 0.0000 . 2 . . . A 1 LYS HE2 . 19716 1
9 . 1 1 1 1 LYS CA C 13 28.3826 0.0000 . 1 . 2186 . A 1 LYS CA . 19716 1
10 . 1 1 1 1 LYS CB C 13 33.6298 0.0000 . 1 . 2210 . A 1 LYS CB . 19716 1
11 . 1 1 1 1 LYS CG C 13 24.7879 0.0000 . 1 . . . A 1 LYS CG . 19716 1
12 . 1 1 1 1 LYS N N 15 123.3586 0.0000 . 1 . 2643 . A 1 LYS N . 19716 1
13 . 1 1 2 2 ILE H H 1 8.2268 0.0000 . 1 . 2640 . A 2 ILE H . 19716 1
14 . 1 1 2 2 ILE HA H 1 4.0656 0.0000 . 1 . . . A 2 ILE HA . 19716 1
15 . 1 1 2 2 ILE HB H 1 1.7357 0.0000 . 1 . . . A 2 ILE HB . 19716 1
16 . 1 1 2 2 ILE HG12 H 1 1.4111 0.0000 . 2 . . . A 2 ILE HG12 . 19716 1
17 . 1 1 2 2 ILE HG13 H 1 1.1247 0.0000 . 2 . . . A 2 ILE HG13 . 19716 1
18 . 1 1 2 2 ILE HG21 H 1 0.7862 0.0000 . 1 . . . A 2 ILE HG21 . 19716 1
19 . 1 1 2 2 ILE HG22 H 1 0.7862 0.0000 . 1 . . . A 2 ILE HG22 . 19716 1
20 . 1 1 2 2 ILE HG23 H 1 0.7862 0.0000 . 1 . . . A 2 ILE HG23 . 19716 1
21 . 1 1 2 2 ILE HD11 H 1 0.7895 0.0000 . 1 . . . A 2 ILE HD11 . 19716 1
22 . 1 1 2 2 ILE HD12 H 1 0.7895 0.0000 . 1 . . . A 2 ILE HD12 . 19716 1
23 . 1 1 2 2 ILE HD13 H 1 0.7895 0.0000 . 1 . . . A 2 ILE HD13 . 19716 1
24 . 1 1 2 2 ILE CA C 13 33.2123 0.0000 . 1 . 2183 . A 2 ILE CA . 19716 1
25 . 1 1 2 2 ILE CB C 13 38.8006 0.0000 . 1 . 2195 . A 2 ILE CB . 19716 1
26 . 1 1 2 2 ILE CG1 C 13 27.3936 0.0000 . 1 . . . A 2 ILE CG1 . 19716 1
27 . 1 1 2 2 ILE CG2 C 13 45.2705 0.0000 . 1 . . . A 2 ILE CG2 . 19716 1
28 . 1 1 2 2 ILE CD1 C 13 40.6225 0.0000 . 1 . . . A 2 ILE CD1 . 19716 1
29 . 1 1 2 2 ILE N N 15 123.6061 0.0000 . 1 . 2641 . A 2 ILE N . 19716 1
30 . 1 1 3 3 VAL H H 1 8.0721 0.0000 . 1 . 2648 . A 3 VAL H . 19716 1
31 . 1 1 3 3 VAL HA H 1 3.8382 0.0000 . 1 . . . A 3 VAL HA . 19716 1
32 . 1 1 3 3 VAL HB H 1 1.7207 0.0000 . 1 . . . A 3 VAL HB . 19716 1
33 . 1 1 3 3 VAL HG11 H 1 0.6047 0.0000 . 2 . . . A 3 VAL HG11 . 19716 1
34 . 1 1 3 3 VAL HG12 H 1 0.6047 0.0000 . 2 . . . A 3 VAL HG12 . 19716 1
35 . 1 1 3 3 VAL HG13 H 1 0.6047 0.0000 . 2 . . . A 3 VAL HG13 . 19716 1
36 . 1 1 3 3 VAL HG21 H 1 0.3995 0.0000 . 2 . . . A 3 VAL HG21 . 19716 1
37 . 1 1 3 3 VAL HG22 H 1 0.3995 0.0000 . 2 . . . A 3 VAL HG22 . 19716 1
38 . 1 1 3 3 VAL HG23 H 1 0.3995 0.0000 . 2 . . . A 3 VAL HG23 . 19716 1
39 . 1 1 3 3 VAL CA C 13 33.8377 0.0000 . 1 . 2138 . A 3 VAL CA . 19716 1
40 . 1 1 3 3 VAL CB C 13 32.7389 0.0000 . 1 . 2153 . A 3 VAL CB . 19716 1
41 . 1 1 3 3 VAL CG1 C 13 48.2281 0.0000 . 2 . . . A 3 VAL CG1 . 19716 1
42 . 1 1 3 3 VAL CG2 C 13 48.4400 0.0000 . 2 . . . A 3 VAL CG2 . 19716 1
43 . 1 1 3 3 VAL N N 15 125.8212 0.0000 . 1 . 2649 . A 3 VAL N . 19716 1
44 . 1 1 4 4 SER H H 1 7.8217 0.0000 . 1 . 2668 . A 4 SER H . 19716 1
45 . 1 1 4 4 SER HA H 1 4.5187 0.0000 . 1 . . . A 4 SER HA . 19716 1
46 . 1 1 4 4 SER HB2 H 1 3.4886 0.0000 . 2 . . . A 4 SER HB2 . 19716 1
47 . 1 1 4 4 SER HB3 H 1 3.5311 0.0000 . 2 . . . A 4 SER HB3 . 19716 1
48 . 1 1 4 4 SER CA C 13 29.1086 0.0000 . 1 . 2312 . A 4 SER CA . 19716 1
49 . 1 1 4 4 SER CB C 13 36.5225 0.0000 . 1 . 2291 . A 4 SER CB . 19716 1
50 . 1 1 4 4 SER N N 15 119.0844 0.0000 . 1 . 2669 . A 4 SER N . 19716 1
51 . 1 1 5 5 CYS H H 1 8.5850 0.0000 . 1 . 2460 . A 5 CYS H . 19716 1
52 . 1 1 5 5 CYS HA H 1 4.3146 0.0000 . 1 . . . A 5 CYS HA . 19716 1
53 . 1 1 5 5 CYS HB2 H 1 2.6554 0.0000 . 2 . . . A 5 CYS HB2 . 19716 1
54 . 1 1 5 5 CYS HB3 H 1 2.5078 0.0000 . 2 . . . A 5 CYS HB3 . 19716 1
55 . 1 1 5 5 CYS CA C 13 31.8584 0.0000 . 1 . 2129 . A 5 CYS CA . 19716 1
56 . 1 1 5 5 CYS CB C 13 30.0267 0.0000 . 1 . 2135 . A 5 CYS CB . 19716 1
57 . 1 1 5 5 CYS N N 15 129.0813 0.0000 . 1 . 2461 . A 5 CYS N . 19716 1
58 . 1 1 6 6 ARG H H 1 9.1196 0.0000 . 1 . 2634 . A 6 ARG H . 19716 1
59 . 1 1 6 6 ARG HA H 1 4.1363 0.0000 . 1 . . . A 6 ARG HA . 19716 1
60 . 1 1 6 6 ARG HB2 H 1 1.9838 0.0000 . 2 . . . A 6 ARG HB2 . 19716 1
61 . 1 1 6 6 ARG HB3 H 1 1.8029 0.0000 . 2 . . . A 6 ARG HB3 . 19716 1
62 . 1 1 6 6 ARG HG2 H 1 1.8622 0.0000 . 2 . . . A 6 ARG HG2 . 19716 1
63 . 1 1 6 6 ARG HG3 H 1 1.7915 0.0000 . 2 . . . A 6 ARG HG3 . 19716 1
64 . 1 1 6 6 ARG HD2 H 1 3.3071 0.0000 . 2 . . . A 6 ARG HD2 . 19716 1
65 . 1 1 6 6 ARG CA C 13 30.6710 0.0000 . 1 . 2120 . A 6 ARG CA . 19716 1
66 . 1 1 6 6 ARG CB C 13 30.8072 0.0000 . 1 . 2123 . A 6 ARG CB . 19716 1
67 . 1 1 6 6 ARG CG C 13 27.7988 0.0000 . 1 . . . A 6 ARG CG . 19716 1
68 . 1 1 6 6 ARG CD C 13 43.2067 0.0000 . 1 . . . A 6 ARG CD . 19716 1
69 . 1 1 6 6 ARG N N 15 130.2553 0.0000 . 1 . 2635 . A 6 ARG N . 19716 1
70 . 1 1 7 7 ILE H H 1 9.6730 0.0000 . 1 . 2493 . A 7 ILE H . 19716 1
71 . 1 1 7 7 ILE HA H 1 3.9613 0.0000 . 1 . . . A 7 ILE HA . 19716 1
72 . 1 1 7 7 ILE HB H 1 2.5400 0.0000 . 1 . . . A 7 ILE HB . 19716 1
73 . 1 1 7 7 ILE HG12 H 1 1.6548 0.0000 . 2 . . . A 7 ILE HG12 . 19716 1
74 . 1 1 7 7 ILE HG13 H 1 1.0607 0.0000 . 2 . . . A 7 ILE HG13 . 19716 1
75 . 1 1 7 7 ILE HG21 H 1 0.9509 0.0000 . 1 . . . A 7 ILE HG21 . 19716 1
76 . 1 1 7 7 ILE HG22 H 1 0.9509 0.0000 . 1 . . . A 7 ILE HG22 . 19716 1
77 . 1 1 7 7 ILE HG23 H 1 0.9509 0.0000 . 1 . . . A 7 ILE HG23 . 19716 1
78 . 1 1 7 7 ILE HD11 H 1 0.8283 0.0000 . 1 . . . A 7 ILE HD11 . 19716 1
79 . 1 1 7 7 ILE HD12 H 1 0.8283 0.0000 . 1 . . . A 7 ILE HD12 . 19716 1
80 . 1 1 7 7 ILE HD13 H 1 0.8283 0.0000 . 1 . . . A 7 ILE HD13 . 19716 1
81 . 1 1 7 7 ILE CA C 13 36.4094 0.0000 . 1 . 2168 . A 7 ILE CA . 19716 1
82 . 1 1 7 7 ILE CB C 13 38.2941 0.0000 . 1 . 2201 . A 7 ILE CB . 19716 1
83 . 1 1 7 7 ILE CG1 C 13 28.5500 0.0000 . 1 . . . A 7 ILE CG1 . 19716 1
84 . 1 1 7 7 ILE CG2 C 13 41.5301 0.0000 . 1 . . . A 7 ILE CG2 . 19716 1
85 . 1 1 7 7 ILE CD1 C 13 46.0053 0.0000 . 1 . . . A 7 ILE CD1 . 19716 1
86 . 1 1 7 7 ILE N N 15 123.3842 0.0000 . 1 . 2494 . A 7 ILE N . 19716 1
87 . 1 1 8 8 CYS H H 1 8.7845 0.0000 . 1 . 2553 . A 8 CYS H . 19716 1
88 . 1 1 8 8 CYS HA H 1 4.9843 0.0000 . 1 . . . A 8 CYS HA . 19716 1
89 . 1 1 8 8 CYS HB2 H 1 3.2810 0.0000 . 2 . . . A 8 CYS HB2 . 19716 1
90 . 1 1 8 8 CYS HB3 H 1 2.5335 0.0000 . 2 . . . A 8 CYS HB3 . 19716 1
91 . 1 1 8 8 CYS CA C 13 30.6688 0.0000 . 1 . 2294 . A 8 CYS CA . 19716 1
92 . 1 1 8 8 CYS CB C 13 33.1698 0.0000 . 1 . 2321 . A 8 CYS CB . 19716 1
93 . 1 1 8 8 CYS N N 15 118.6018 0.0000 . 1 . 2554 . A 8 CYS N . 19716 1
94 . 1 1 9 9 LYS H H 1 7.7784 0.0000 . 1 . 2577 . A 9 LYS H . 19716 1
95 . 1 1 9 9 LYS HA H 1 4.3125 0.0000 . 1 . . . A 9 LYS HA . 19716 1
96 . 1 1 9 9 LYS HB2 H 1 2.2010 0.0000 . 2 . . . A 9 LYS HB2 . 19716 1
97 . 1 1 9 9 LYS HB3 H 1 2.0314 0.0000 . 2 . . . A 9 LYS HB3 . 19716 1
98 . 1 1 9 9 LYS HG2 H 1 1.3331 0.0000 . 2 . . . A 9 LYS HG2 . 19716 1
99 . 1 1 9 9 LYS HD2 H 1 1.6564 0.0000 . 2 . . . A 9 LYS HD2 . 19716 1
100 . 1 1 9 9 LYS HE2 H 1 2.9324 0.0000 . 2 . . . A 9 LYS HE2 . 19716 1
101 . 1 1 9 9 LYS CA C 13 30.6809 0.0000 . 1 . 2339 . A 9 LYS CA . 19716 1
102 . 1 1 9 9 LYS CB C 13 29.3794 0.0000 . 1 . 2348 . A 9 LYS CB . 19716 1
103 . 1 1 9 9 LYS CG C 13 25.4130 0.0000 . 1 . . . A 9 LYS CG . 19716 1
104 . 1 1 9 9 LYS CE C 13 42.1216 0.0000 . 1 . . . A 9 LYS CE . 19716 1
105 . 1 1 9 9 LYS N N 15 117.4516 0.0000 . 1 . 2578 . A 9 LYS N . 19716 1
106 . 1 1 10 10 GLY H H 1 9.1402 0.0000 . 1 . 2601 . A 10 GLY H . 19716 1
107 . 1 1 10 10 GLY HA2 H 1 4.1969 0.0000 . 2 . . . A 10 GLY HA2 . 19716 1
108 . 1 1 10 10 GLY HA3 H 1 3.4808 0.0000 . 2 . . . A 10 GLY HA3 . 19716 1
109 . 1 1 10 10 GLY CA C 13 43.3535 0.0000 . 1 . 2366 . A 10 GLY CA . 19716 1
110 . 1 1 10 10 GLY N N 15 112.3053 0.0000 . 1 . 2602 . A 10 GLY N . 19716 1
111 . 1 1 11 11 ASP H H 1 8.3725 0.0000 . 1 . 2662 . A 11 ASP H . 19716 1
112 . 1 1 11 11 ASP HA H 1 4.7223 0.0000 . 1 . . . A 11 ASP HA . 19716 1
113 . 1 1 11 11 ASP HB2 H 1 2.6150 0.0000 . 2 . . . A 11 ASP HB2 . 19716 1
114 . 1 1 11 11 ASP HB3 H 1 2.5392 0.0000 . 2 . . . A 11 ASP HB3 . 19716 1
115 . 1 1 11 11 ASP CA C 13 24.8368 0.0000 . 1 . 2249 . A 11 ASP CA . 19716 1
116 . 1 1 11 11 ASP CB C 13 39.0106 0.0000 . 1 . 2264 . A 11 ASP CB . 19716 1
117 . 1 1 11 11 ASP N N 15 119.7177 0.0000 . 1 . 2663 . A 11 ASP N . 19716 1
118 . 1 1 12 12 HIS H H 1 7.2605 0.0000 . 1 . 2589 . A 12 HIS H . 19716 1
119 . 1 1 12 12 HIS HA H 1 4.5615 0.0000 . 1 . . . A 12 HIS HA . 19716 1
120 . 1 1 12 12 HIS HB2 H 1 3.3357 0.0000 . 2 . . . A 12 HIS HB2 . 19716 1
121 . 1 1 12 12 HIS HB3 H 1 3.0419 0.0000 . 2 . . . A 12 HIS HB3 . 19716 1
122 . 1 1 12 12 HIS HD2 H 1 6.8239 0.0000 . 1 . . . A 12 HIS HD2 . 19716 1
123 . 1 1 12 12 HIS HE1 H 1 7.8345 0.0000 . 1 . . . A 12 HIS HE1 . 19716 1
124 . 1 1 12 12 HIS CA C 13 25.9907 0.0000 . 1 . 2351 . A 12 HIS CA . 19716 1
125 . 1 1 12 12 HIS CB C 13 30.4906 0.0000 . 1 . 2354 . A 12 HIS CB . 19716 1
126 . 1 1 12 12 HIS CD2 C 13 44.3704 0.0000 . 1 . . . A 12 HIS CD2 . 19716 1
127 . 1 1 12 12 HIS CE1 C 13 25.6125 0.0000 . 1 . . . A 12 HIS CE1 . 19716 1
128 . 1 1 12 12 HIS N N 15 115.2904 0.0000 . 1 . 2590 . A 12 HIS N . 19716 1
129 . 1 1 13 13 TRP H H 1 8.3573 0.0000 . 1 . 2672 . A 13 TRP H . 19716 1
130 . 1 1 13 13 TRP HA H 1 4.7520 0.0000 . 1 . . . A 13 TRP HA . 19716 1
131 . 1 1 13 13 TRP HB2 H 1 3.5339 0.0000 . 2 . . . A 13 TRP HB2 . 19716 1
132 . 1 1 13 13 TRP HB3 H 1 2.9385 0.0000 . 2 . . . A 13 TRP HB3 . 19716 1
133 . 1 1 13 13 TRP HD1 H 1 7.3275 0.0000 . 1 . . . A 13 TRP HD1 . 19716 1
134 . 1 1 13 13 TRP HE1 H 1 10.2300 0.0000 . 1 . . . A 13 TRP HE1 . 19716 1
135 . 1 1 13 13 TRP HE3 H 1 7.7223 0.0000 . 1 . . . A 13 TRP HE3 . 19716 1
136 . 1 1 13 13 TRP HZ2 H 1 7.5097 0.0000 . 1 . . . A 13 TRP HZ2 . 19716 1
137 . 1 1 13 13 TRP HZ3 H 1 7.1990 0.0000 . 1 . . . A 13 TRP HZ3 . 19716 1
138 . 1 1 13 13 TRP HH2 H 1 7.2583 0.0000 . 1 . . . A 13 TRP HH2 . 19716 1
139 . 1 1 13 13 TRP CA C 13 28.7436 0.0000 . 1 . 2306 . A 13 TRP CA . 19716 1
140 . 1 1 13 13 TRP CB C 13 30.1384 0.0000 . 1 . 2441 . A 13 TRP CB . 19716 1
141 . 1 1 13 13 TRP CD1 C 13 42.0288 0.0000 . 1 . . . A 13 TRP CD1 . 19716 1
142 . 1 1 13 13 TRP CE3 C 13 36.8314 0.0000 . 1 . . . A 13 TRP CE3 . 19716 1
143 . 1 1 13 13 TRP CZ2 C 13 30.7281 0.0000 . 1 . . . A 13 TRP CZ2 . 19716 1
144 . 1 1 13 13 TRP CZ3 C 13 38.0334 0.0000 . 1 . . . A 13 TRP CZ3 . 19716 1
145 . 1 1 13 13 TRP CH2 C 13 40.9008 0.0000 . 1 . . . A 13 TRP CH2 . 19716 1
146 . 1 1 13 13 TRP N N 15 117.6668 0.0000 . 1 . 2673 . A 13 TRP N . 19716 1
147 . 1 1 13 13 TRP NE1 N 15 128.8700 0.0000 . 1 . . . A 13 TRP NE1 . 19716 1
148 . 1 1 14 14 THR H H 1 8.6933 0.0000 . 1 . . . A 14 THR H . 19716 1
149 . 1 1 14 14 THR HA H 1 5.3294 0.0000 . 1 . . . A 14 THR HA . 19716 1
150 . 1 1 14 14 THR HB H 1 4.3159 0.0000 . 1 . . . A 14 THR HB . 19716 1
151 . 1 1 14 14 THR HG21 H 1 1.4834 0.0000 . 1 . . . A 14 THR HG21 . 19716 1
152 . 1 1 14 14 THR HG22 H 1 1.4834 0.0000 . 1 . . . A 14 THR HG22 . 19716 1
153 . 1 1 14 14 THR HG23 H 1 1.4834 0.0000 . 1 . . . A 14 THR HG23 . 19716 1
154 . 1 1 14 14 THR CA C 13 37.9867 0.0000 . 1 . 2627 . A 14 THR CA . 19716 1
155 . 1 1 14 14 THR CB C 13 42.0043 0.0000 . 1 . 2624 . A 14 THR CB . 19716 1
156 . 1 1 14 14 THR CG2 C 13 50.8598 0.0000 . 1 . . . A 14 THR CG2 . 19716 1
157 . 1 1 14 14 THR N N 15 120.6353 0.0000 . 1 . . . A 14 THR N . 19716 1
158 . 1 1 15 15 THR H H 1 7.7374 0.0000 . 1 . 2688 . A 15 THR H . 19716 1
159 . 1 1 15 15 THR HA H 1 4.0971 0.0000 . 1 . . . A 15 THR HA . 19716 1
160 . 1 1 15 15 THR HB H 1 4.3190 0.0000 . 1 . . . A 15 THR HB . 19716 1
161 . 1 1 15 15 THR HG21 H 1 1.3322 0.0000 . 1 . . . A 15 THR HG21 . 19716 1
162 . 1 1 15 15 THR HG22 H 1 1.3322 0.0000 . 1 . . . A 15 THR HG22 . 19716 1
163 . 1 1 15 15 THR HG23 H 1 1.3322 0.0000 . 1 . . . A 15 THR HG23 . 19716 1
164 . 1 1 15 15 THR CA C 13 35.6174 0.0000 . 1 . 2426 . A 15 THR CA . 19716 1
165 . 1 1 15 15 THR CB C 13 40.8783 0.0000 . 1 . 2402 . A 15 THR CB . 19716 1
166 . 1 1 15 15 THR CG2 C 13 50.7432 0.0000 . 1 . . . A 15 THR CG2 . 19716 1
167 . 1 1 15 15 THR N N 15 108.0645 0.0000 . 1 . 2689 . A 15 THR N . 19716 1
168 . 1 1 16 16 ARG H H 1 7.9764 0.0000 . 1 . 2529 . A 16 ARG H . 19716 1
169 . 1 1 16 16 ARG HA H 1 4.5362 0.0000 . 1 . . . A 16 ARG HA . 19716 1
170 . 1 1 16 16 ARG HB2 H 1 2.1192 0.0000 . 2 . . . A 16 ARG HB2 . 19716 1
171 . 1 1 16 16 ARG HB3 H 1 1.7100 0.0000 . 2 . . . A 16 ARG HB3 . 19716 1
172 . 1 1 16 16 ARG HG2 H 1 1.7287 0.0000 . 2 . . . A 16 ARG HG2 . 19716 1
173 . 1 1 16 16 ARG HG3 H 1 1.6117 0.0000 . 2 . . . A 16 ARG HG3 . 19716 1
174 . 1 1 16 16 ARG HD2 H 1 3.1764 0.0000 . 2 . . . A 16 ARG HD2 . 19716 1
175 . 1 1 16 16 ARG CA C 13 26.0313 0.0000 . 1 . 2255 . A 16 ARG CA . 19716 1
176 . 1 1 16 16 ARG CB C 13 30.3245 0.0000 . 1 . 2282 . A 16 ARG CB . 19716 1
177 . 1 1 16 16 ARG CG C 13 27.0679 0.0000 . 1 . . . A 16 ARG CG . 19716 1
178 . 1 1 16 16 ARG CD C 13 43.0218 0.0000 . 1 . . . A 16 ARG CD . 19716 1
179 . 1 1 16 16 ARG N N 15 119.9565 0.0000 . 1 . 2530 . A 16 ARG N . 19716 1
180 . 1 1 17 17 CYS H H 1 7.5451 0.0000 . 1 . 2472 . A 17 CYS H . 19716 1
181 . 1 1 17 17 CYS HA H 1 4.0156 0.0000 . 1 . . . A 17 CYS HA . 19716 1
182 . 1 1 17 17 CYS HB2 H 1 3.6892 0.0000 . 2 . . . A 17 CYS HB2 . 19716 1
183 . 1 1 17 17 CYS HB3 H 1 2.8408 0.0000 . 2 . . . A 17 CYS HB3 . 19716 1
184 . 1 1 17 17 CYS CA C 13 30.8889 0.0000 . 1 . 2144 . A 17 CYS CA . 19716 1
185 . 1 1 17 17 CYS CB C 13 31.9158 0.0000 . 1 . 2706 . A 17 CYS CB . 19716 1
186 . 1 1 17 17 CYS N N 15 125.7286 0.0000 . 1 . 2473 . A 17 CYS N . 19716 1
187 . 1 1 18 18 PRO HA H 1 4.3165 0.0000 . 1 . . . A 18 PRO HA . 19716 1
188 . 1 1 18 18 PRO HB2 H 1 1.9967 0.0000 . 2 . . . A 18 PRO HB2 . 19716 1
189 . 1 1 18 18 PRO HB3 H 1 1.1741 0.0000 . 2 . . . A 18 PRO HB3 . 19716 1
190 . 1 1 18 18 PRO HG2 H 1 1.6054 0.0000 . 2 . . . A 18 PRO HG2 . 19716 1
191 . 1 1 18 18 PRO HG3 H 1 1.2315 0.0000 . 2 . . . A 18 PRO HG3 . 19716 1
192 . 1 1 18 18 PRO HD2 H 1 3.6570 0.0000 . 2 . . . A 18 PRO HD2 . 19716 1
193 . 1 1 18 18 PRO HD3 H 1 3.0029 0.0000 . 2 . . . A 18 PRO HD3 . 19716 1
194 . 1 1 18 18 PRO CA C 13 35.8773 0.0000 . 1 . 2525 . A 18 PRO CA . 19716 1
195 . 1 1 18 18 PRO CB C 13 31.8078 0.0000 . 1 . 2705 . A 18 PRO CB . 19716 1
196 . 1 1 18 18 PRO CG C 13 26.1890 0.0000 . 1 . . . A 18 PRO CG . 19716 1
197 . 1 1 18 18 PRO CD C 13 50.9125 0.0000 . 1 . . . A 18 PRO CD . 19716 1
198 . 1 1 19 19 TYR H H 1 9.2793 0.0000 . 1 . 2547 . A 19 TYR H . 19716 1
199 . 1 1 19 19 TYR HA H 1 4.7522 0.0000 . 1 . . . A 19 TYR HA . 19716 1
200 . 1 1 19 19 TYR HB2 H 1 3.3328 0.0000 . 2 . . . A 19 TYR HB2 . 19716 1
201 . 1 1 19 19 TYR HB3 H 1 2.9276 0.0000 . 2 . . . A 19 TYR HB3 . 19716 1
202 . 1 1 19 19 TYR HD2 H 1 7.1880 0.0000 . 3 . . . A 19 TYR HD2 . 19716 1
203 . 1 1 19 19 TYR HE2 H 1 6.9019 0.0000 . 3 . . . A 19 TYR HE2 . 19716 1
204 . 1 1 19 19 TYR CA C 13 28.8963 0.0000 . 1 . 2219 . A 19 TYR CA . 19716 1
205 . 1 1 19 19 TYR CB C 13 37.7830 0.0000 . 1 . 2270 . A 19 TYR CB . 19716 1
206 . 1 1 19 19 TYR CD2 C 13 49.2004 0.0000 . 2 . . . A 19 TYR CD2 . 19716 1
207 . 1 1 19 19 TYR CE2 C 13 34.1221 0.0000 . 2 . . . A 19 TYR CE2 . 19716 1
208 . 1 1 19 19 TYR N N 15 120.9965 0.0000 . 1 . 2548 . A 19 TYR N . 19716 1
209 . 1 1 20 20 LYS H H 1 7.4792 0.0000 . 1 . 2544 . A 20 LYS H . 19716 1
210 . 1 1 20 20 LYS HA H 1 4.0972 0.0000 . 1 . . . A 20 LYS HA . 19716 1
211 . 1 1 20 20 LYS HB2 H 1 1.8674 0.0000 . 2 . . . A 20 LYS HB2 . 19716 1
212 . 1 1 20 20 LYS HG2 H 1 1.4384 0.0000 . 2 . . . A 20 LYS HG2 . 19716 1
213 . 1 1 20 20 LYS HD2 H 1 1.6899 0.0000 . 2 . . . A 20 LYS HD2 . 19716 1
214 . 1 1 20 20 LYS HE2 H 1 3.0115 0.0000 . 2 . . . A 20 LYS HE2 . 19716 1
215 . 1 1 20 20 LYS CA C 13 30.6971 0.0000 . 1 . 2240 . A 20 LYS CA . 19716 1
216 . 1 1 20 20 LYS CG C 13 52.0289 0.0000 . 1 . . . A 20 LYS CG . 19716 1
217 . 1 1 20 20 LYS N N 15 120.5321 0.0000 . 1 . 2545 . A 20 LYS N . 19716 1
218 . 1 1 21 21 ASP H H 1 8.5411 0.0000 . 1 . 2664 . A 21 ASP H . 19716 1
219 . 1 1 21 21 ASP HA H 1 4.7042 0.0000 . 1 . . . A 21 ASP HA . 19716 1
220 . 1 1 21 21 ASP HB2 H 1 2.7842 0.0000 . 2 . . . A 21 ASP HB2 . 19716 1
221 . 1 1 21 21 ASP HB3 H 1 2.6347 0.0000 . 2 . . . A 21 ASP HB3 . 19716 1
222 . 1 1 21 21 ASP CA C 13 26.9945 0.0000 . 1 . 2303 . A 21 ASP CA . 19716 1
223 . 1 1 21 21 ASP CB C 13 40.9318 0.0000 . 1 . 2315 . A 21 ASP CB . 19716 1
224 . 1 1 21 21 ASP N N 15 118.9432 0.0000 . 1 . 2665 . A 21 ASP N . 19716 1
225 . 1 1 22 22 THR H H 1 7.8413 0.0000 . 1 . 2595 . A 22 THR H . 19716 1
226 . 1 1 22 22 THR HA H 1 4.3805 0.0000 . 1 . . . A 22 THR HA . 19716 1
227 . 1 1 22 22 THR HB H 1 4.2843 0.0000 . 1 . . . A 22 THR HB . 19716 1
228 . 1 1 22 22 THR HG21 H 1 1.2365 0.0000 . 1 . . . A 22 THR HG21 . 19716 1
229 . 1 1 22 22 THR HG22 H 1 1.2365 0.0000 . 1 . . . A 22 THR HG22 . 19716 1
230 . 1 1 22 22 THR HG23 H 1 1.2365 0.0000 . 1 . . . A 22 THR HG23 . 19716 1
231 . 1 1 22 22 THR CA C 13 34.4430 0.0000 . 1 . 2360 . A 22 THR CA . 19716 1
232 . 1 1 22 22 THR CB C 13 41.9199 0.0000 . 1 . 2357 . A 22 THR CB . 19716 1
233 . 1 1 22 22 THR CG2 C 13 49.7785 0.0000 . 1 . . . A 22 THR CG2 . 19716 1
234 . 1 1 22 22 THR N N 15 112.3965 0.0000 . 1 . 2596 . A 22 THR N . 19716 1
235 . 1 1 23 23 LEU H H 1 8.1699 0.0000 . 1 . 2644 . A 23 LEU H . 19716 1
236 . 1 1 23 23 LEU HA H 1 4.4252 0.0000 . 1 . . . A 23 LEU HA . 19716 1
237 . 1 1 23 23 LEU HB2 H 1 1.6543 0.0000 . 2 . . . A 23 LEU HB2 . 19716 1
238 . 1 1 23 23 LEU HG H 1 1.6551 0.0000 . 1 . . . A 23 LEU HG . 19716 1
239 . 1 1 23 23 LEU HD11 H 1 0.8576 0.0000 . 2 . . . A 23 LEU HD11 . 19716 1
240 . 1 1 23 23 LEU HD12 H 1 0.8576 0.0000 . 2 . . . A 23 LEU HD12 . 19716 1
241 . 1 1 23 23 LEU HD13 H 1 0.8576 0.0000 . 2 . . . A 23 LEU HD13 . 19716 1
242 . 1 1 23 23 LEU HD21 H 1 0.8561 0.0000 . 2 . . . A 23 LEU HD21 . 19716 1
243 . 1 1 23 23 LEU HD22 H 1 0.8561 0.0000 . 2 . . . A 23 LEU HD22 . 19716 1
244 . 1 1 23 23 LEU HD23 H 1 0.8561 0.0000 . 2 . . . A 23 LEU HD23 . 19716 1
245 . 1 1 23 23 LEU CA C 13 27.0941 0.0000 . 1 . 2192 . A 23 LEU CA . 19716 1
246 . 1 1 23 23 LEU CB C 13 42.5382 0.0000 . 1 . 2198 . A 23 LEU CB . 19716 1
247 . 1 1 23 23 LEU CG C 13 27.0551 0.0000 . 1 . . . A 23 LEU CG . 19716 1
248 . 1 1 23 23 LEU CD1 C 13 25.0616 0.0000 . 2 . . . A 23 LEU CD1 . 19716 1
249 . 1 1 23 23 LEU CD2 C 13 51.1998 0.0000 . 2 . . . A 23 LEU CD2 . 19716 1
250 . 1 1 23 23 LEU N N 15 123.0899 0.0000 . 1 . 2645 . A 23 LEU N . 19716 1
251 . 1 1 24 24 GLY H H 1 8.0586 0.0000 . 1 . 2686 . A 24 GLY H . 19716 1
252 . 1 1 24 24 GLY HA2 H 1 4.0522 0.0000 . 2 . . . A 24 GLY HA2 . 19716 1
253 . 1 1 24 24 GLY CA C 13 44.6383 0.0000 . 1 . 2390 . A 24 GLY CA . 19716 1
254 . 1 1 24 24 GLY N N 15 108.9635 0.0000 . 1 . 2687 . A 24 GLY N . 19716 1
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