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 52641
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name CLMB_assigned
_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 0.025
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err 0.05
_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 '0.25 (CB), 0.1 (CA), 0.05 (CO)'
_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 HNCA' . . . 52641 1
2 '3D HNCO' . . . 52641 1
3 '3D HN(CA)CO' . . . 52641 1
4 '3D HN(CO)CA' . . . 52641 1
5 '3D CBCA(CO)NH' . . . 52641 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 $software_1 . . 52641 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 MET H H 1 8.728 0.025 . 1 . . . . . 1 M HN . 52641 1
2 . 1 . 1 1 1 MET C C 13 173.833 0.05 . 1 . . . . . 1 M C . 52641 1
3 . 1 . 1 1 1 MET CA C 13 52.961 0.1 . 1 . . . . . 1 M CA . 52641 1
4 . 1 . 1 1 1 MET CB C 13 30.374 0.25 . 1 . . . . . 1 M CB . 52641 1
5 . 1 . 1 1 1 MET N N 15 119.873 0.05 . 1 . . . . . 1 M N . 52641 1
6 . 1 . 1 2 2 GLY H H 1 8.531 0.025 . 1 . . . . . 2 G HN . 52641 1
7 . 1 . 1 2 2 GLY C C 13 171.113 0.05 . 1 . . . . . 2 G C . 52641 1
8 . 1 . 1 2 2 GLY CA C 13 42.593 0.1 . 1 . . . . . 2 G CA . 52641 1
9 . 1 . 1 2 2 GLY N N 15 110.445 0.05 . 1 . . . . . 2 G N . 52641 1
10 . 1 . 1 3 3 LEU H H 1 8.151 0.025 . 1 . . . . . 3 L HN . 52641 1
11 . 1 . 1 3 3 LEU C C 13 174.654 0.05 . 1 . . . . . 3 L C . 52641 1
12 . 1 . 1 3 3 LEU CA C 13 52.517 0.1 . 1 . . . . . 3 L CA . 52641 1
13 . 1 . 1 3 3 LEU CB C 13 39.922 0.25 . 1 . . . . . 3 L CB . 52641 1
14 . 1 . 1 3 3 LEU N N 15 121.973 0.05 . 1 . . . . . 3 L N . 52641 1
15 . 1 . 1 4 4 LYS H H 1 8.373 0.025 . 1 . . . . . 4 K HN . 52641 1
16 . 1 . 1 4 4 LYS CA C 13 53.642 0.1 . 1 . . . . . 4 K CA . 52641 1
17 . 1 . 1 4 4 LYS CB C 13 30.100 0.25 . 1 . . . . . 4 K CB . 52641 1
18 . 1 . 1 4 4 LYS N N 15 122.399 0.05 . 1 . . . . . 4 K N . 52641 1
19 . 1 . 1 5 5 MET H H 1 8.370 0.025 . 1 . . . . . 5 M HN . 52641 1
20 . 1 . 1 5 5 MET C C 13 173.501 0.05 . 1 . . . . . 5 M C . 52641 1
21 . 1 . 1 5 5 MET CA C 13 52.673 0.1 . 1 . . . . . 5 M CA . 52641 1
22 . 1 . 1 5 5 MET CB C 13 30.229 0.25 . 1 . . . . . 5 M CB . 52641 1
23 . 1 . 1 5 5 MET N N 15 121.436 0.05 . 1 . . . . . 5 M N . 52641 1
24 . 1 . 1 6 6 SER H H 1 8.335 0.025 . 1 . . . . . 6 S HN . 52641 1
25 . 1 . 1 6 6 SER CA C 13 55.817 0.1 . 1 . . . . . 6 S CA . 52641 1
26 . 1 . 1 6 6 SER CB C 13 60.971 0.25 . 1 . . . . . 6 S CB . 52641 1
27 . 1 . 1 6 6 SER N N 15 116.766 0.05 . 1 . . . . . 6 S N . 52641 1
28 . 1 . 1 8 8 LEU H H 1 8.215 0.025 . 1 . . . . . 8 L HN . 52641 1
29 . 1 . 1 8 8 LEU CA C 13 52.699 0.1 . 1 . . . . . 8 L CA . 52641 1
30 . 1 . 1 8 8 LEU CB C 13 39.632 0.25 . 1 . . . . . 8 L CB . 52641 1
31 . 1 . 1 8 8 LEU N N 15 124.224 0.05 . 1 . . . . . 8 L N . 52641 1
32 . 1 . 1 10 10 GLY H H 1 8.320 0.025 . 1 . . . . . 10 G HN . 52641 1
33 . 1 . 1 10 10 GLY CA C 13 42.578 0.1 . 1 . . . . . 10 G CA . 52641 1
34 . 1 . 1 10 10 GLY N N 15 109.756 0.05 . 1 . . . . . 10 G N . 52641 1
35 . 1 . 1 11 11 PHE H H 1 8.058 0.025 . 1 . . . . . 11 F HN . 52641 1
36 . 1 . 1 11 11 PHE CA C 13 55.232 0.1 . 1 . . . . . 11 F CA . 52641 1
37 . 1 . 1 11 11 PHE CB C 13 37.027 0.25 . 1 . . . . . 11 F CB . 52641 1
38 . 1 . 1 11 11 PHE N N 15 120.013 0.05 . 1 . . . . . 11 F N . 52641 1
39 . 1 . 1 12 12 GLN H H 1 8.245 0.025 . 1 . . . . . 12 Q HN . 52641 1
40 . 1 . 1 12 12 GLN CA C 13 52.954 0.1 . 1 . . . . . 12 Q CA . 52641 1
41 . 1 . 1 12 12 GLN CB C 13 27.040 0.25 . 1 . . . . . 12 Q CB . 52641 1
42 . 1 . 1 12 12 GLN N N 15 122.009 0.05 . 1 . . . . . 12 Q N . 52641 1
43 . 1 . 1 14 14 CYS H H 1 8.388 0.025 . 1 . . . . . 14 C HN . 52641 1
44 . 1 . 1 14 14 CYS CA C 13 55.652 0.1 . 1 . . . . . 14 C CA . 52641 1
45 . 1 . 1 14 14 CYS N N 15 120.843 0.05 . 1 . . . . . 14 C N . 52641 1
46 . 1 . 1 15 15 VAL H H 1 8.283 0.025 . 1 . . . . . 15 V HN . 52641 1
47 . 1 . 1 15 15 VAL C C 13 173.409 0.05 . 1 . . . . . 15 V C . 52641 1
48 . 1 . 1 15 15 VAL CA C 13 59.632 0.1 . 1 . . . . . 15 V CA . 52641 1
49 . 1 . 1 15 15 VAL CB C 13 30.041 0.25 . 1 . . . . . 15 V CB . 52641 1
50 . 1 . 1 15 15 VAL N N 15 122.538 0.05 . 1 . . . . . 15 V N . 52641 1
51 . 1 . 1 16 16 SER H H 1 8.408 0.025 . 1 . . . . . 16 S HN . 52641 1
52 . 1 . 1 16 16 SER CA C 13 55.473 0.1 . 1 . . . . . 16 S CA . 52641 1
53 . 1 . 1 16 16 SER N N 15 119.382 0.05 . 1 . . . . . 16 S N . 52641 1
54 . 1 . 1 20 20 SER C C 13 171.785 0.05 . 1 . . . . . 20 S C . 52641 1
55 . 1 . 1 21 21 SER H H 1 8.256 0.025 . 1 . . . . . 21 S HN . 52641 1
56 . 1 . 1 21 21 SER C C 13 171.647 0.05 . 1 . . . . . 21 S C . 52641 1
57 . 1 . 1 21 21 SER CB C 13 61.065 0.25 . 1 . . . . . 21 S CB . 52641 1
58 . 1 . 1 21 21 SER N N 15 117.425 0.05 . 1 . . . . . 21 S N . 52641 1
59 . 1 . 1 22 22 HIS H H 1 8.489 0.025 . 1 . . . . . 22 H HN . 52641 1
60 . 1 . 1 22 22 HIS C C 13 171.268 0.05 . 1 . . . . . 22 H C . 52641 1
61 . 1 . 1 22 22 HIS CA C 13 52.673 0.1 . 1 . . . . . 22 H CA . 52641 1
62 . 1 . 1 22 22 HIS CB C 13 26.213 0.25 . 1 . . . . . 22 H CB . 52641 1
63 . 1 . 1 22 22 HIS N N 15 120.165 0.05 . 1 . . . . . 22 H N . 52641 1
64 . 1 . 1 23 23 ASP H H 1 8.339 0.025 . 1 . . . . . 23 D HN . 52641 1
65 . 1 . 1 23 23 ASP C C 13 173.094 0.05 . 1 . . . . . 23 D C . 52641 1
66 . 1 . 1 23 23 ASP CA C 13 51.753 0.1 . 1 . . . . . 23 D CA . 52641 1
67 . 1 . 1 23 23 ASP CB C 13 38.233 0.25 . 1 . . . . . 23 D CB . 52641 1
68 . 1 . 1 23 23 ASP N N 15 121.280 0.05 . 1 . . . . . 23 D N . 52641 1
69 . 1 . 1 24 24 GLU H H 1 8.371 0.025 . 1 . . . . . 24 E HN . 52641 1
70 . 1 . 1 24 24 GLU C C 13 172.931 0.05 . 1 . . . . . 24 E C . 52641 1
71 . 1 . 1 24 24 GLU CA C 13 53.315 0.1 . 1 . . . . . 24 E CA . 52641 1
72 . 1 . 1 24 24 GLU CB C 13 27.371 0.25 . 1 . . . . . 24 E CB . 52641 1
73 . 1 . 1 24 24 GLU N N 15 121.091 0.05 . 1 . . . . . 24 E N . 52641 1
74 . 1 . 1 25 25 ALA H H 1 8.284 0.025 . 1 . . . . . 25 A HN . 52641 1
75 . 1 . 1 25 25 ALA CA C 13 47.896 0.1 . 1 . . . . . 25 A CA . 52641 1
76 . 1 . 1 25 25 ALA CB C 13 15.439 0.25 . 1 . . . . . 25 A CB . 52641 1
77 . 1 . 1 25 25 ALA N N 15 126.525 0.05 . 1 . . . . . 25 A N . 52641 1
78 . 1 . 1 26 26 PRO C C 13 174.011 0.05 . 1 . . . . . 26 P C . 52641 1
79 . 1 . 1 27 27 VAL H H 1 8.220 0.025 . 1 . . . . . 27 V HN . 52641 1
80 . 1 . 1 27 27 VAL C C 13 173.422 0.05 . 1 . . . . . 27 V C . 52641 1
81 . 1 . 1 27 27 VAL CA C 13 59.554 0.1 . 1 . . . . . 27 V CA . 52641 1
82 . 1 . 1 27 27 VAL CB C 13 30.219 0.25 . 1 . . . . . 27 V CB . 52641 1
83 . 1 . 1 27 27 VAL N N 15 120.809 0.05 . 1 . . . . . 27 V N . 52641 1
84 . 1 . 1 28 28 LEU H H 1 8.345 0.025 . 1 . . . . . 28 L HN . 52641 1
85 . 1 . 1 28 28 LEU C C 13 174.136 0.05 . 1 . . . . . 28 L C . 52641 1
86 . 1 . 1 28 28 LEU CA C 13 52.238 0.1 . 1 . . . . . 28 L CA . 52641 1
87 . 1 . 1 28 28 LEU CB C 13 39.659 0.25 . 1 . . . . . 28 L CB . 52641 1
88 . 1 . 1 28 28 LEU N N 15 126.373 0.05 . 1 . . . . . 28 L N . 52641 1
89 . 1 . 1 29 29 ASN H H 1 8.418 0.025 . 1 . . . . . 29 N HN . 52641 1
90 . 1 . 1 29 29 ASN C C 13 171.985 0.05 . 1 . . . . . 29 N C . 52641 1
91 . 1 . 1 29 29 ASN CA C 13 50.453 0.1 . 1 . . . . . 29 N CA . 52641 1
92 . 1 . 1 29 29 ASN CB C 13 36.241 0.25 . 1 . . . . . 29 N CB . 52641 1
93 . 1 . 1 29 29 ASN N N 15 119.876 0.05 . 1 . . . . . 29 N N . 52641 1
94 . 1 . 1 30 30 ASP H H 1 8.267 0.025 . 1 . . . . . 30 D HN . 52641 1
95 . 1 . 1 30 30 ASP C C 13 173.357 0.05 . 1 . . . . . 30 D C . 52641 1
96 . 1 . 1 30 30 ASP CA C 13 51.430 0.1 . 1 . . . . . 30 D CA . 52641 1
97 . 1 . 1 30 30 ASP CB C 13 37.956 0.25 . 1 . . . . . 30 D CB . 52641 1
98 . 1 . 1 30 30 ASP N N 15 120.651 0.05 . 1 . . . . . 30 D N . 52641 1
99 . 1 . 1 31 31 LYS H H 1 8.184 0.025 . 1 . . . . . 31 K HN . 52641 1
100 . 1 . 1 31 31 LYS C C 13 173.706 0.05 . 1 . . . . . 31 K C . 52641 1
101 . 1 . 1 31 31 LYS CA C 13 53.492 0.1 . 1 . . . . . 31 K CA . 52641 1
102 . 1 . 1 31 31 LYS CB C 13 30.009 0.25 . 1 . . . . . 31 K CB . 52641 1
103 . 1 . 1 31 31 LYS N N 15 121.214 0.05 . 1 . . . . . 31 K N . 52641 1
104 . 1 . 1 32 32 HIS H H 1 8.525 0.025 . 1 . . . . . 32 H HN . 52641 1
105 . 1 . 1 32 32 HIS CA C 13 52.733 0.1 . 1 . . . . . 32 H CA . 52641 1
106 . 1 . 1 32 32 HIS CB C 13 25.809 0.25 . 1 . . . . . 32 H CB . 52641 1
107 . 1 . 1 32 32 HIS N N 15 119.397 0.05 . 1 . . . . . 32 H N . 52641 1
108 . 1 . 1 33 33 LEU H H 1 8.245 0.025 . 1 . . . . . 33 L HN . 52641 1
109 . 1 . 1 33 33 LEU CA C 13 52.225 0.1 . 1 . . . . . 33 L CA . 52641 1
110 . 1 . 1 33 33 LEU CB C 13 39.661 0.25 . 1 . . . . . 33 L CB . 52641 1
111 . 1 . 1 33 33 LEU N N 15 123.190 0.05 . 1 . . . . . 33 L N . 52641 1
112 . 1 . 1 34 34 ASP H H 1 8.421 0.025 . 1 . . . . . 34 D HN . 52641 1
113 . 1 . 1 34 34 ASP C C 13 172.771 0.05 . 1 . . . . . 34 D C . 52641 1
114 . 1 . 1 34 34 ASP CA C 13 51.402 0.1 . 1 . . . . . 34 D CA . 52641 1
115 . 1 . 1 34 34 ASP CB C 13 37.982 0.25 . 1 . . . . . 34 D CB . 52641 1
116 . 1 . 1 34 34 ASP N N 15 121.436 0.05 . 1 . . . . . 34 D N . 52641 1
117 . 1 . 1 35 35 VAL H H 1 7.980 0.025 . 1 . . . . . 35 V HN . 52641 1
118 . 1 . 1 35 35 VAL CA C 13 56.958 0.1 . 1 . . . . . 35 V CA . 52641 1
119 . 1 . 1 35 35 VAL CB C 13 29.973 0.25 . 1 . . . . . 35 V CB . 52641 1
120 . 1 . 1 35 35 VAL N N 15 121.044 0.05 . 1 . . . . . 35 V N . 52641 1
121 . 1 . 1 37 37 ASP H H 1 8.340 0.025 . 1 . . . . . 37 D HN . 52641 1
122 . 1 . 1 37 37 ASP C C 13 173.097 0.05 . 1 . . . . . 37 D C . 52641 1
123 . 1 . 1 37 37 ASP CA C 13 51.474 0.1 . 1 . . . . . 37 D CA . 52641 1
124 . 1 . 1 37 37 ASP CB C 13 37.989 0.25 . 1 . . . . . 37 D CB . 52641 1
125 . 1 . 1 37 37 ASP N N 15 120.147 0.05 . 1 . . . . . 37 D N . 52641 1
126 . 1 . 1 38 38 ILE H H 1 7.966 0.025 . 1 . . . . . 38 I HN . 52641 1
127 . 1 . 1 38 38 ILE C C 13 172.935 0.05 . 1 . . . . . 38 I C . 52641 1
128 . 1 . 1 38 38 ILE CA C 13 58.236 0.1 . 1 . . . . . 38 I CA . 52641 1
129 . 1 . 1 38 38 ILE CB C 13 36.236 0.25 . 1 . . . . . 38 I CB . 52641 1
130 . 1 . 1 38 38 ILE N N 15 120.612 0.05 . 1 . . . . . 38 I N . 52641 1
131 . 1 . 1 39 39 ILE H H 1 8.241 0.025 . 1 . . . . . 39 I HN . 52641 1
132 . 1 . 1 39 39 ILE C C 13 173.243 0.05 . 1 . . . . . 39 I C . 52641 1
133 . 1 . 1 39 39 ILE CA C 13 58.096 0.1 . 1 . . . . . 39 I CA . 52641 1
134 . 1 . 1 39 39 ILE CB C 13 35.591 0.25 . 1 . . . . . 39 I CB . 52641 1
135 . 1 . 1 39 39 ILE N N 15 125.910 0.05 . 1 . . . . . 39 I N . 52641 1
136 . 1 . 1 40 40 ILE H H 1 8.331 0.025 . 1 . . . . . 40 I HN . 52641 1
137 . 1 . 1 40 40 ILE C C 13 173.362 0.05 . 1 . . . . . 40 I C . 52641 1
138 . 1 . 1 40 40 ILE CA C 13 57.845 0.1 . 1 . . . . . 40 I CA . 52641 1
139 . 1 . 1 40 40 ILE CB C 13 35.892 0.25 . 1 . . . . . 40 I CB . 52641 1
140 . 1 . 1 40 40 ILE N N 15 126.629 0.05 . 1 . . . . . 40 I N . 52641 1
141 . 1 . 1 41 41 THR H H 1 8.309 0.025 . 1 . . . . . 41 T HN . 52641 1
142 . 1 . 1 41 41 THR CA C 13 56.941 0.1 . 1 . . . . . 41 T CA . 52641 1
143 . 1 . 1 41 41 THR CB C 13 67.013 0.25 . 1 . . . . . 41 T CB . 52641 1
144 . 1 . 1 41 41 THR N N 15 122.315 0.05 . 1 . . . . . 41 T N . 52641 1
145 . 1 . 1 43 43 PRO C C 13 174.025 0.05 . 1 . . . . . 43 P C . 52641 1
146 . 1 . 1 44 44 THR H H 1 8.226 0.025 . 1 . . . . . 44 T HN . 52641 1
147 . 1 . 1 44 44 THR CA C 13 57.146 0.1 . 1 . . . . . 44 T CA . 52641 1
148 . 1 . 1 44 44 THR CB C 13 67.140 0.25 . 1 . . . . . 44 T CB . 52641 1
149 . 1 . 1 44 44 THR N N 15 116.856 0.05 . 1 . . . . . 44 T N . 52641 1
150 . 1 . 1 45 45 PRO C C 13 174.454 0.05 . 1 . . . . . 45 P C . 52641 1
151 . 1 . 1 46 46 THR H H 1 8.211 0.025 . 1 . . . . . 46 T HN . 52641 1
152 . 1 . 1 46 46 THR C C 13 172.573 0.05 . 1 . . . . . 46 T C . 52641 1
153 . 1 . 1 46 46 THR CA C 13 59.455 0.1 . 1 . . . . . 46 T CA . 52641 1
154 . 1 . 1 46 46 THR CB C 13 67.231 0.25 . 1 . . . . . 46 T CB . 52641 1
155 . 1 . 1 46 46 THR N N 15 114.001 0.05 . 1 . . . . . 46 T N . 52641 1
156 . 1 . 1 47 47 GLY H H 1 8.396 0.025 . 1 . . . . . 47 G HN . 52641 1
157 . 1 . 1 47 47 GLY C C 13 171.294 0.05 . 1 . . . . . 47 G C . 52641 1
158 . 1 . 1 47 47 GLY CA C 13 42.738 0.1 . 1 . . . . . 47 G CA . 52641 1
159 . 1 . 1 47 47 GLY N N 15 110.977 0.05 . 1 . . . . . 47 G N . 52641 1
160 . 1 . 1 48 48 MET H H 1 8.115 0.025 . 1 . . . . . 48 M HN . 52641 1
161 . 1 . 1 48 48 MET C C 13 172.985 0.05 . 1 . . . . . 48 M C . 52641 1
162 . 1 . 1 48 48 MET CA C 13 52.763 0.1 . 1 . . . . . 48 M CA . 52641 1
163 . 1 . 1 48 48 MET CB C 13 30.230 0.25 . 1 . . . . . 48 M CB . 52641 1
164 . 1 . 1 48 48 MET N N 15 119.675 0.05 . 1 . . . . . 48 M N . 52641 1
165 . 1 . 1 49 49 MET H H 1 8.310 0.025 . 1 . . . . . 49 M HN . 52641 1
166 . 1 . 1 49 49 MET C C 13 172.914 0.05 . 1 . . . . . 49 M C . 52641 1
167 . 1 . 1 49 49 MET CA C 13 52.930 0.1 . 1 . . . . . 49 M CA . 52641 1
168 . 1 . 1 49 49 MET CB C 13 30.302 0.25 . 1 . . . . . 49 M CB . 52641 1
169 . 1 . 1 49 49 MET N N 15 121.520 0.05 . 1 . . . . . 49 M N . 52641 1
170 . 1 . 1 50 50 LEU H H 1 8.267 0.025 . 1 . . . . . 50 L HN . 52641 1
171 . 1 . 1 50 50 LEU CA C 13 50.259 0.1 . 1 . . . . . 50 L CA . 52641 1
172 . 1 . 1 50 50 LEU CB C 13 39.012 0.25 . 1 . . . . . 50 L CB . 52641 1
173 . 1 . 1 50 50 LEU N N 15 125.059 0.05 . 1 . . . . . 50 L N . 52641 1
174 . 1 . 1 52 52 ARG H H 1 8.328 0.025 . 1 . . . . . 52 R HN . 52641 1
175 . 1 . 1 52 52 ARG C C 13 173.294 0.05 . 1 . . . . . 52 R C . 52641 1
176 . 1 . 1 52 52 ARG CA C 13 53.566 0.1 . 1 . . . . . 52 R CA . 52641 1
177 . 1 . 1 52 52 ARG CB C 13 29.040 0.25 . 1 . . . . . 52 R CB . 52641 1
178 . 1 . 1 52 52 ARG N N 15 120.565 0.05 . 1 . . . . . 52 R N . 52641 1
179 . 1 . 1 53 53 ASP H H 1 8.322 0.025 . 1 . . . . . 53 D HN . 52641 1
180 . 1 . 1 53 53 ASP CA C 13 51.298 0.1 . 1 . . . . . 53 D CA . 52641 1
181 . 1 . 1 53 53 ASP CB C 13 38.152 0.25 . 1 . . . . . 53 D CB . 52641 1
182 . 1 . 1 53 53 ASP N N 15 120.706 0.05 . 1 . . . . . 53 D N . 52641 1
183 . 1 . 1 54 54 LEU H H 1 8.215 0.025 . 1 . . . . . 54 L HN . 52641 1
184 . 1 . 1 54 54 LEU C C 13 175.370 0.05 . 1 . . . . . 54 L C . 52641 1
185 . 1 . 1 54 54 LEU CA C 13 52.217 0.1 . 1 . . . . . 54 L CA . 52641 1
186 . 1 . 1 54 54 LEU CB C 13 39.676 0.25 . 1 . . . . . 54 L CB . 52641 1
187 . 1 . 1 54 54 LEU N N 15 123.184 0.05 . 1 . . . . . 54 L N . 52641 1
188 . 1 . 1 55 55 GLY H H 1 8.448 0.025 . 1 . . . . . 55 G HN . 52641 1
189 . 1 . 1 55 55 GLY C C 13 171.616 0.05 . 1 . . . . . 55 G C . 52641 1
190 . 1 . 1 55 55 GLY CA C 13 42.815 0.1 . 1 . . . . . 55 G CA . 52641 1
191 . 1 . 1 55 55 GLY N N 15 108.972 0.05 . 1 . . . . . 55 G N . 52641 1
192 . 1 . 1 56 56 SER H H 1 8.082 0.025 . 1 . . . . . 56 S HN . 52641 1
193 . 1 . 1 56 56 SER C C 13 172.129 0.05 . 1 . . . . . 56 S C . 52641 1
194 . 1 . 1 56 56 SER CA C 13 55.620 0.1 . 1 . . . . . 56 S CA . 52641 1
195 . 1 . 1 56 56 SER CB C 13 61.181 0.25 . 1 . . . . . 56 S CB . 52641 1
196 . 1 . 1 56 56 SER N N 15 115.266 0.05 . 1 . . . . . 56 S N . 52641 1
197 . 1 . 1 57 57 THR H H 1 8.183 0.025 . 1 . . . . . 57 T HN . 52641 1
198 . 1 . 1 57 57 THR C C 13 171.638 0.05 . 1 . . . . . 57 T C . 52641 1
199 . 1 . 1 57 57 THR CA C 13 59.473 0.1 . 1 . . . . . 57 T CA . 52641 1
200 . 1 . 1 57 57 THR CB C 13 66.942 0.25 . 1 . . . . . 57 T CB . 52641 1
201 . 1 . 1 57 57 THR N N 15 116.241 0.05 . 1 . . . . . 57 T N . 52641 1
202 . 1 . 1 58 58 VAL H H 1 7.972 0.025 . 1 . . . . . 58 V HN . 52641 1
203 . 1 . 1 58 58 VAL C C 13 172.797 0.05 . 1 . . . . . 58 V C . 52641 1
204 . 1 . 1 58 58 VAL CA C 13 59.715 0.1 . 1 . . . . . 58 V CA . 52641 1
205 . 1 . 1 58 58 VAL CB C 13 30.051 0.25 . 1 . . . . . 58 V CB . 52641 1
206 . 1 . 1 58 58 VAL N N 15 122.106 0.05 . 1 . . . . . 58 V N . 52641 1
207 . 1 . 1 59 59 TRP H H 1 8.166 0.025 . 1 . . . . . 59 W HN . 52641 1
208 . 1 . 1 59 59 TRP C C 13 173.016 0.05 . 1 . . . . . 59 W C . 52641 1
209 . 1 . 1 59 59 TRP CA C 13 54.404 0.1 . 1 . . . . . 59 W CA . 52641 1
210 . 1 . 1 59 59 TRP CB C 13 26.830 0.25 . 1 . . . . . 59 W CB . 52641 1
211 . 1 . 1 59 59 TRP N N 15 124.912 0.05 . 1 . . . . . 59 W N . 52641 1
212 . 1 . 1 60 60 LEU H H 1 7.928 0.025 . 1 . . . . . 60 L HN . 52641 1
213 . 1 . 1 60 60 LEU C C 13 173.699 0.05 . 1 . . . . . 60 L C . 52641 1
214 . 1 . 1 60 60 LEU CA C 13 52.201 0.1 . 1 . . . . . 60 L CA . 52641 1
215 . 1 . 1 60 60 LEU CB C 13 40.108 0.25 . 1 . . . . . 60 L CB . 52641 1
216 . 1 . 1 60 60 LEU N N 15 124.286 0.05 . 1 . . . . . 60 L N . 52641 1
217 . 1 . 1 61 61 ASP H H 1 8.138 0.025 . 1 . . . . . 61 D HN . 52641 1
218 . 1 . 1 61 61 ASP CA C 13 51.261 0.1 . 1 . . . . . 61 D CA . 52641 1
219 . 1 . 1 61 61 ASP CB C 13 37.999 0.25 . 1 . . . . . 61 D CB . 52641 1
220 . 1 . 1 61 61 ASP N N 15 120.745 0.05 . 1 . . . . . 61 D N . 52641 1
221 . 1 . 1 62 62 GLU H H 1 8.423 0.025 . 1 . . . . . 62 E HN . 52641 1
222 . 1 . 1 62 62 GLU C C 13 174.118 0.05 . 1 . . . . . 62 E C . 52641 1
223 . 1 . 1 62 62 GLU CA C 13 53.865 0.1 . 1 . . . . . 62 E CA . 52641 1
224 . 1 . 1 62 62 GLU CB C 13 26.769 0.25 . 1 . . . . . 62 E CB . 52641 1
225 . 1 . 1 62 62 GLU N N 15 121.382 0.05 . 1 . . . . . 62 E N . 52641 1
226 . 1 . 1 63 63 THR H H 1 8.248 0.025 . 1 . . . . . 63 T HN . 52641 1
227 . 1 . 1 63 63 THR C C 13 172.709 0.05 . 1 . . . . . 63 T C . 52641 1
228 . 1 . 1 63 63 THR CA C 13 59.979 0.1 . 1 . . . . . 63 T CA . 52641 1
229 . 1 . 1 63 63 THR CB C 13 67.166 0.25 . 1 . . . . . 63 T CB . 52641 1
230 . 1 . 1 63 63 THR N N 15 113.939 0.05 . 1 . . . . . 63 T N . 52641 1
231 . 1 . 1 64 64 GLY H H 1 8.352 0.025 . 1 . . . . . 64 G HN . 52641 1
232 . 1 . 1 64 64 GLY C C 13 171.340 0.05 . 1 . . . . . 64 G C . 52641 1
233 . 1 . 1 64 64 GLY CA C 13 42.704 0.1 . 1 . . . . . 64 G CA . 52641 1
234 . 1 . 1 64 64 GLY N N 15 111.207 0.05 . 1 . . . . . 64 G N . 52641 1
235 . 1 . 1 65 65 SER H H 1 8.117 0.025 . 1 . . . . . 65 S HN . 52641 1
236 . 1 . 1 65 65 SER CA C 13 55.514 0.1 . 1 . . . . . 65 S CA . 52641 1
237 . 1 . 1 65 65 SER CB C 13 61.243 0.25 . 1 . . . . . 65 S CB . 52641 1
238 . 1 . 1 65 65 SER N N 15 115.391 0.05 . 1 . . . . . 65 S N . 52641 1
239 . 1 . 1 66 66 CYS H H 1 8.342 0.025 . 1 . . . . . 66 C HN . 52641 1
240 . 1 . 1 66 66 CYS CA C 13 53.528 0.1 . 1 . . . . . 66 C CA . 52641 1
241 . 1 . 1 66 66 CYS CB C 13 39.225 0.25 . 1 . . . . . 66 C CB . 52641 1
242 . 1 . 1 66 66 CYS N N 15 120.062 0.05 . 1 . . . . . 66 C N . 52641 1
243 . 1 . 1 68 68 ASP H H 1 8.326 0.025 . 1 . . . . . 68 D HN . 52641 1
244 . 1 . 1 68 68 ASP CA C 13 51.454 0.1 . 1 . . . . . 68 D CA . 52641 1
245 . 1 . 1 68 68 ASP CB C 13 37.984 0.25 . 1 . . . . . 68 D CB . 52641 1
246 . 1 . 1 68 68 ASP N N 15 120.070 0.05 . 1 . . . . . 68 D N . 52641 1
247 . 1 . 1 69 69 ASP H H 1 8.251 0.025 . 1 . . . . . 69 D HN . 52641 1
248 . 1 . 1 69 69 ASP C C 13 173.876 0.05 . 1 . . . . . 69 D C . 52641 1
249 . 1 . 1 69 69 ASP CA C 13 51.466 0.1 . 1 . . . . . 69 D CA . 52641 1
250 . 1 . 1 69 69 ASP CB C 13 37.864 0.25 . 1 . . . . . 69 D CB . 52641 1
251 . 1 . 1 69 69 ASP N N 15 120.553 0.05 . 1 . . . . . 69 D N . 52641 1
252 . 1 . 1 70 70 GLY H H 1 8.353 0.025 . 1 . . . . . 70 G HN . 52641 1
253 . 1 . 1 70 70 GLY C C 13 171.342 0.05 . 1 . . . . . 70 G C . 52641 1
254 . 1 . 1 70 70 GLY CA C 13 42.760 0.1 . 1 . . . . . 70 G CA . 52641 1
255 . 1 . 1 70 70 GLY N N 15 108.891 0.05 . 1 . . . . . 70 G N . 52641 1
256 . 1 . 1 71 71 GLU H H 1 8.102 0.025 . 1 . . . . . 71 E HN . 52641 1
257 . 1 . 1 71 71 GLU CA C 13 53.310 0.1 . 1 . . . . . 71 E CA . 52641 1
258 . 1 . 1 71 71 GLU CB C 13 26.996 0.25 . 1 . . . . . 71 E CB . 52641 1
259 . 1 . 1 71 71 GLU N N 15 120.076 0.05 . 1 . . . . . 71 E N . 52641 1
260 . 1 . 1 72 72 ILE H H 1 8.149 0.025 . 1 . . . . . 72 I HN . 52641 1
261 . 1 . 1 72 72 ILE C C 13 172.878 0.05 . 1 . . . . . 72 I C . 52641 1
262 . 1 . 1 72 72 ILE CA C 13 58.051 0.1 . 1 . . . . . 72 I CA . 52641 1
263 . 1 . 1 72 72 ILE CB C 13 36.299 0.25 . 1 . . . . . 72 I CB . 52641 1
264 . 1 . 1 72 72 ILE N N 15 122.123 0.05 . 1 . . . . . 72 I N . 52641 1
265 . 1 . 1 73 73 ASP H H 1 8.515 0.025 . 1 . . . . . 73 D HN . 52641 1
266 . 1 . 1 73 73 ASP CA C 13 49.022 0.1 . 1 . . . . . 73 D CA . 52641 1
267 . 1 . 1 73 73 ASP CB C 13 37.802 0.25 . 1 . . . . . 73 D CB . 52641 1
268 . 1 . 1 73 73 ASP N N 15 125.791 0.05 . 1 . . . . . 73 D N . 52641 1
269 . 1 . 1 74 74 PRO C C 13 174.271 0.05 . 1 . . . . . 74 P C . 52641 1
270 . 1 . 1 75 75 GLU H H 1 8.365 0.025 . 1 . . . . . 75 E HN . 52641 1
271 . 1 . 1 75 75 GLU C C 13 172.550 0.05 . 1 . . . . . 75 E C . 52641 1
272 . 1 . 1 75 75 GLU CA C 13 53.257 0.1 . 1 . . . . . 75 E CA . 52641 1
273 . 1 . 1 75 75 GLU CB C 13 26.806 0.25 . 1 . . . . . 75 E CB . 52641 1
274 . 1 . 1 75 75 GLU N N 15 119.738 0.05 . 1 . . . . . 75 E N . 52641 1
275 . 1 . 1 76 76 ALA H H 1 7.736 0.025 . 1 . . . . . 76 A HN . 52641 1
276 . 1 . 1 76 76 ALA CA C 13 51.042 0.1 . 1 . . . . . 76 A CA . 52641 1
277 . 1 . 1 76 76 ALA CB C 13 17.292 0.25 . 1 . . . . . 76 A CB . 52641 1
278 . 1 . 1 76 76 ALA N N 15 129.676 0.05 . 1 . . . . . 76 A N . 52641 1
stop_
save_