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 51406
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'assigned chem shift list'
_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
1 '2D 1H-15N HSQC/HMQC' . . . 51406 1
2 '3D HNCACB' . . . 51406 1
3 '3D HNCA' . . . 51406 1
4 'CC(CO)NH (HNco_C.relayed)' . . . 51406 1
5 '3D HNCO' . . . 51406 1
6 'HN(CA)CO (H[N[ca[CO]]])' . . . 51406 1
7 '3D CBCA(CO)NH' . . . 51406 1
8 '3D 1H-15N TOCSY' . . . 51406 1
9 'HNHA (H{[N]+[HA]})' . . . 51406 1
10 '3D HNHB' . . . 51406 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 . . 51406 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 THR C C 13 173.111 . . 1 . . . . . 5 THR C . 51406 1
2 . 1 . 1 1 1 THR CA C 13 61.413 0.038 . 1 . . . . . 5 THR CA . 51406 1
3 . 1 . 1 1 1 THR CB C 13 69.794 0.138 . 1 . . . . . 5 THR CB . 51406 1
4 . 1 . 1 1 1 THR CG2 C 13 21.164 . . 1 . . . . . 5 THR CG2 . 51406 1
5 . 1 . 1 2 2 TYR H H 1 7.569 0.008 . 1 . . . . . 6 TYR H . 51406 1
6 . 1 . 1 2 2 TYR HA H 1 4.113 . . 1 . . . . . 6 TYR HA . 51406 1
7 . 1 . 1 2 2 TYR HB2 H 1 2.552 . . 2 . . . . . 6 TYR HB2 . 51406 1
8 . 1 . 1 2 2 TYR HB3 H 1 2.791 . . 2 . . . . . 6 TYR HB3 . 51406 1
9 . 1 . 1 2 2 TYR CA C 13 58.909 0.006 . 1 . . . . . 6 TYR CA . 51406 1
10 . 1 . 1 2 2 TYR CB C 13 39.091 . . 1 . . . . . 6 TYR CB . 51406 1
11 . 1 . 1 2 2 TYR N N 15 126.805 0.04 . 1 . . . . . 6 TYR N . 51406 1
12 . 1 . 1 3 3 HIS C C 13 174.892 . . 1 . . . . . 7 HIS C . 51406 1
13 . 1 . 1 3 3 HIS CA C 13 56.315 0.024 . 1 . . . . . 7 HIS CA . 51406 1
14 . 1 . 1 3 3 HIS CB C 13 31.292 0.015 . 1 . . . . . 7 HIS CB . 51406 1
15 . 1 . 1 4 4 VAL H H 1 7.772 0.005 . 1 . . . . . 8 VAL H . 51406 1
16 . 1 . 1 4 4 VAL HA H 1 3.690 0.004 . 1 . . . . . 8 VAL HA . 51406 1
17 . 1 . 1 4 4 VAL HB H 1 1.652 0.007 . 1 . . . . . 8 VAL HB . 51406 1
18 . 1 . 1 4 4 VAL HG11 H 1 0.659 . . 2 . . . . . 8 VAL HG11 . 51406 1
19 . 1 . 1 4 4 VAL HG12 H 1 0.659 . . 2 . . . . . 8 VAL HG12 . 51406 1
20 . 1 . 1 4 4 VAL HG13 H 1 0.659 . . 2 . . . . . 8 VAL HG13 . 51406 1
21 . 1 . 1 4 4 VAL HG21 H 1 0.502 . . 2 . . . . . 8 VAL HG21 . 51406 1
22 . 1 . 1 4 4 VAL HG22 H 1 0.502 . . 2 . . . . . 8 VAL HG22 . 51406 1
23 . 1 . 1 4 4 VAL HG23 H 1 0.502 . . 2 . . . . . 8 VAL HG23 . 51406 1
24 . 1 . 1 4 4 VAL C C 13 175.233 0.008 . 1 . . . . . 8 VAL C . 51406 1
25 . 1 . 1 4 4 VAL CA C 13 61.931 0.062 . 1 . . . . . 8 VAL CA . 51406 1
26 . 1 . 1 4 4 VAL CB C 13 32.641 0.061 . 1 . . . . . 8 VAL CB . 51406 1
27 . 1 . 1 4 4 VAL CG1 C 13 20.440 . . 1 . . . . . 8 VAL CG1 . 51406 1
28 . 1 . 1 4 4 VAL N N 15 123.019 0.05 . 1 . . . . . 8 VAL N . 51406 1
29 . 1 . 1 5 5 ASP H H 1 8.384 0.004 . 1 . . . . . 9 ASP H . 51406 1
30 . 1 . 1 5 5 ASP HA H 1 4.263 0.01 . 1 . . . . . 9 ASP HA . 51406 1
31 . 1 . 1 5 5 ASP HB2 H 1 2.416 0.009 . 2 . . . . . 9 ASP HB2 . 51406 1
32 . 1 . 1 5 5 ASP HB3 H 1 2.561 . . 2 . . . . . 9 ASP HB3 . 51406 1
33 . 1 . 1 5 5 ASP C C 13 175.944 0.003 . 1 . . . . . 9 ASP C . 51406 1
34 . 1 . 1 5 5 ASP CA C 13 53.909 0.061 . 1 . . . . . 9 ASP CA . 51406 1
35 . 1 . 1 5 5 ASP CB C 13 41.040 0.05 . 1 . . . . . 9 ASP CB . 51406 1
36 . 1 . 1 5 5 ASP N N 15 124.502 0.052 . 1 . . . . . 9 ASP N . 51406 1
37 . 1 . 1 6 6 ALA H H 1 8.161 0.005 . 1 . . . . . 10 ALA H . 51406 1
38 . 1 . 1 6 6 ALA C C 13 177.612 0.052 . 1 . . . . . 10 ALA C . 51406 1
39 . 1 . 1 6 6 ALA CA C 13 52.760 0.01 . 1 . . . . . 10 ALA CA . 51406 1
40 . 1 . 1 6 6 ALA CB C 13 18.811 . . 1 . . . . . 10 ALA CB . 51406 1
41 . 1 . 1 6 6 ALA N N 15 125.240 0.039 . 1 . . . . . 10 ALA N . 51406 1
42 . 1 . 1 7 7 ASN H H 1 7.806 0.011 . 1 . . . . . 11 ASN H . 51406 1
43 . 1 . 1 7 7 ASN HA H 1 3.940 . . 1 . . . . . 11 ASN HA . 51406 1
44 . 1 . 1 7 7 ASN CA C 13 55.392 0.008 . 1 . . . . . 11 ASN CA . 51406 1
45 . 1 . 1 7 7 ASN CB C 13 41.775 . . 1 . . . . . 11 ASN CB . 51406 1
46 . 1 . 1 7 7 ASN N N 15 119.862 0.021 . 1 . . . . . 11 ASN N . 51406 1
47 . 1 . 1 8 8 ASP H H 1 8.272 0.004 . 1 . . . . . 12 ASP H . 51406 1
48 . 1 . 1 8 8 ASP HA H 1 4.223 . . 1 . . . . . 12 ASP HA . 51406 1
49 . 1 . 1 8 8 ASP HB2 H 1 2.280 . . 1 . . . . . 12 ASP HB2 . 51406 1
50 . 1 . 1 8 8 ASP C C 13 176.095 . . 1 . . . . . 12 ASP C . 51406 1
51 . 1 . 1 8 8 ASP CA C 13 54.163 0.032 . 1 . . . . . 12 ASP CA . 51406 1
52 . 1 . 1 8 8 ASP CB C 13 40.597 0.111 . 1 . . . . . 12 ASP CB . 51406 1
53 . 1 . 1 8 8 ASP N N 15 126.863 0.096 . 1 . . . . . 12 ASP N . 51406 1
54 . 1 . 1 9 9 HIS H H 1 7.929 0.009 . 1 . . . . . 13 HIS H . 51406 1
55 . 1 . 1 9 9 HIS C C 13 175.683 . . 1 . . . . . 13 HIS C . 51406 1
56 . 1 . 1 9 9 HIS CA C 13 56.787 0.015 . 1 . . . . . 13 HIS CA . 51406 1
57 . 1 . 1 9 9 HIS CB C 13 30.723 0.052 . 1 . . . . . 13 HIS CB . 51406 1
58 . 1 . 1 9 9 HIS N N 15 120.146 0.037 . 1 . . . . . 13 HIS N . 51406 1
59 . 1 . 1 10 10 ASP H H 1 8.024 0.014 . 1 . . . . . 14 ASP H . 51406 1
60 . 1 . 1 10 10 ASP CA C 13 54.399 . . 1 . . . . . 14 ASP CA . 51406 1
61 . 1 . 1 10 10 ASP CB C 13 40.618 . . 1 . . . . . 14 ASP CB . 51406 1
62 . 1 . 1 10 10 ASP N N 15 120.822 0.086 . 1 . . . . . 14 ASP N . 51406 1
63 . 1 . 1 13 13 ARG C C 13 175.174 0.028 . 1 . . . . . 17 ARG C . 51406 1
64 . 1 . 1 13 13 ARG CA C 13 55.732 0.045 . 1 . . . . . 17 ARG CA . 51406 1
65 . 1 . 1 13 13 ARG CB C 13 30.211 0.049 . 1 . . . . . 17 ARG CB . 51406 1
66 . 1 . 1 13 13 ARG CG C 13 26.742 . . 1 . . . . . 17 ARG CG . 51406 1
67 . 1 . 1 13 13 ARG CD C 13 42.974 . . 1 . . . . . 17 ARG CD . 51406 1
68 . 1 . 1 14 14 LYS H H 1 7.737 0.006 . 1 . . . . . 18 LYS H . 51406 1
69 . 1 . 1 14 14 LYS HA H 1 3.842 0.0 . 1 . . . . . 18 LYS HA . 51406 1
70 . 1 . 1 14 14 LYS HB2 H 1 1.484 0.006 . 1 . . . . . 18 LYS HB2 . 51406 1
71 . 1 . 1 14 14 LYS HG2 H 1 1.039 . . 1 . . . . . 18 LYS HG2 . 51406 1
72 . 1 . 1 14 14 LYS HD2 H 1 1.252 . . 1 . . . . . 18 LYS HD2 . 51406 1
73 . 1 . 1 14 14 LYS HE2 H 1 2.787 . . 1 . . . . . 18 LYS HE2 . 51406 1
74 . 1 . 1 14 14 LYS CA C 13 57.432 0.005 . 1 . . . . . 18 LYS CA . 51406 1
75 . 1 . 1 14 14 LYS CB C 13 33.227 . . 1 . . . . . 18 LYS CB . 51406 1
76 . 1 . 1 14 14 LYS N N 15 127.899 0.06 . 1 . . . . . 18 LYS N . 51406 1
77 . 1 . 1 15 15 SER C C 13 173.398 . . 1 . . . . . 19 SER C . 51406 1
78 . 1 . 1 15 15 SER CA C 13 58.247 0.022 . 1 . . . . . 19 SER CA . 51406 1
79 . 1 . 1 15 15 SER CB C 13 63.466 0.085 . 1 . . . . . 19 SER CB . 51406 1
80 . 1 . 1 16 16 GLN H H 1 7.883 0.006 . 1 . . . . . 20 GLN H . 51406 1
81 . 1 . 1 16 16 GLN HA H 1 3.864 . . 1 . . . . . 20 GLN HA . 51406 1
82 . 1 . 1 16 16 GLN HB2 H 1 1.573 0.025 . 2 . . . . . 20 GLN HB2 . 51406 1
83 . 1 . 1 16 16 GLN HB3 H 1 1.768 0.039 . 2 . . . . . 20 GLN HB3 . 51406 1
84 . 1 . 1 16 16 GLN HG2 H 1 1.933 . . 2 . . . . . 20 GLN HG2 . 51406 1
85 . 1 . 1 16 16 GLN HG3 H 1 2.106 . . 2 . . . . . 20 GLN HG3 . 51406 1
86 . 1 . 1 16 16 GLN C C 13 180.396 . . 1 . . . . . 20 GLN C . 51406 1
87 . 1 . 1 16 16 GLN CA C 13 57.154 0.015 . 1 . . . . . 20 GLN CA . 51406 1
88 . 1 . 1 16 16 GLN CB C 13 30.020 . . 1 . . . . . 20 GLN CB . 51406 1
89 . 1 . 1 16 16 GLN N N 15 126.803 0.041 . 1 . . . . . 20 GLN N . 51406 1
90 . 1 . 1 17 17 GLN C C 13 174.370 . . 1 . . . . . 21 GLN C . 51406 1
91 . 1 . 1 17 17 GLN CA C 13 55.369 0.041 . 1 . . . . . 21 GLN CA . 51406 1
92 . 1 . 1 17 17 GLN CB C 13 29.285 0.042 . 1 . . . . . 21 GLN CB . 51406 1
93 . 1 . 1 17 17 GLN CG C 13 33.456 . . 1 . . . . . 21 GLN CG . 51406 1
94 . 1 . 1 18 18 TYR H H 1 7.593 0.004 . 1 . . . . . 22 TYR H . 51406 1
95 . 1 . 1 18 18 TYR HA H 1 4.098 0.0 . 1 . . . . . 22 TYR HA . 51406 1
96 . 1 . 1 18 18 TYR HB2 H 1 2.544 0.018 . 2 . . . . . 22 TYR HB2 . 51406 1
97 . 1 . 1 18 18 TYR HB3 H 1 2.785 0.005 . 2 . . . . . 22 TYR HB3 . 51406 1
98 . 1 . 1 18 18 TYR C C 13 180.294 . . 1 . . . . . 22 TYR C . 51406 1
99 . 1 . 1 18 18 TYR CA C 13 58.902 0.001 . 1 . . . . . 22 TYR CA . 51406 1
100 . 1 . 1 18 18 TYR CB C 13 39.121 . . 1 . . . . . 22 TYR CB . 51406 1
101 . 1 . 1 18 18 TYR N N 15 126.321 0.049 . 1 . . . . . 22 TYR N . 51406 1
102 . 1 . 1 19 19 ASP C C 13 175.618 . . 1 . . . . . 23 ASP C . 51406 1
103 . 1 . 1 19 19 ASP CA C 13 53.946 0.08 . 1 . . . . . 23 ASP CA . 51406 1
104 . 1 . 1 19 19 ASP CB C 13 40.692 0.031 . 1 . . . . . 23 ASP CB . 51406 1
105 . 1 . 1 20 20 LEU H H 1 7.949 0.008 . 1 . . . . . 24 LEU H . 51406 1
106 . 1 . 1 20 20 LEU HA H 1 4.086 . . 1 . . . . . 24 LEU HA . 51406 1
107 . 1 . 1 20 20 LEU HB2 H 1 1.308 . . 1 . . . . . 24 LEU HB2 . 51406 1
108 . 1 . 1 20 20 LEU HG H 1 1.156 . . 1 . . . . . 24 LEU HG . 51406 1
109 . 1 . 1 20 20 LEU HD11 H 1 0.609 . . 2 . . . . . 24 LEU HD11 . 51406 1
110 . 1 . 1 20 20 LEU HD12 H 1 0.609 . . 2 . . . . . 24 LEU HD12 . 51406 1
111 . 1 . 1 20 20 LEU HD13 H 1 0.609 . . 2 . . . . . 24 LEU HD13 . 51406 1
112 . 1 . 1 20 20 LEU HD21 H 1 0.380 . . 2 . . . . . 24 LEU HD21 . 51406 1
113 . 1 . 1 20 20 LEU HD22 H 1 0.380 . . 2 . . . . . 24 LEU HD22 . 51406 1
114 . 1 . 1 20 20 LEU HD23 H 1 0.380 . . 2 . . . . . 24 LEU HD23 . 51406 1
115 . 1 . 1 20 20 LEU C C 13 176.257 . . 1 . . . . . 24 LEU C . 51406 1
116 . 1 . 1 20 20 LEU CA C 13 54.755 0.028 . 1 . . . . . 24 LEU CA . 51406 1
117 . 1 . 1 20 20 LEU CB C 13 41.890 0.066 . 1 . . . . . 24 LEU CB . 51406 1
118 . 1 . 1 20 20 LEU CG C 13 26.454 . . 1 . . . . . 24 LEU CG . 51406 1
119 . 1 . 1 20 20 LEU CD1 C 13 24.785 . . 2 . . . . . 24 LEU CD1 . 51406 1
120 . 1 . 1 20 20 LEU CD2 C 13 22.907 . . 2 . . . . . 24 LEU CD2 . 51406 1
121 . 1 . 1 20 20 LEU N N 15 122.443 0.133 . 1 . . . . . 24 LEU N . 51406 1
122 . 1 . 1 21 21 ASN H H 1 7.812 0.008 . 1 . . . . . 25 ASN H . 51406 1
123 . 1 . 1 21 21 ASN HA H 1 4.152 . . 1 . . . . . 25 ASN HA . 51406 1
124 . 1 . 1 21 21 ASN HB2 H 1 2.417 0.008 . 1 . . . . . 25 ASN HB2 . 51406 1
125 . 1 . 1 21 21 ASN C C 13 173.704 . . 1 . . . . . 25 ASN C . 51406 1
126 . 1 . 1 21 21 ASN CA C 13 54.529 0.028 . 1 . . . . . 25 ASN CA . 51406 1
127 . 1 . 1 21 21 ASN CB C 13 40.067 . . 1 . . . . . 25 ASN CB . 51406 1
128 . 1 . 1 21 21 ASN N N 15 124.290 0.019 . 1 . . . . . 25 ASN N . 51406 1
129 . 1 . 1 22 22 ALA H H 1 7.440 0.007 . 1 . . . . . 26 ALA H . 51406 1
130 . 1 . 1 22 22 ALA HA H 1 3.769 0.002 . 1 . . . . . 26 ALA HA . 51406 1
131 . 1 . 1 22 22 ALA HB1 H 1 1.027 0.014 . 1 . . . . . 26 ALA HB1 . 51406 1
132 . 1 . 1 22 22 ALA HB2 H 1 1.027 0.014 . 1 . . . . . 26 ALA HB2 . 51406 1
133 . 1 . 1 22 22 ALA HB3 H 1 1.027 0.014 . 1 . . . . . 26 ALA HB3 . 51406 1
134 . 1 . 1 22 22 ALA CA C 13 53.793 0.005 . 1 . . . . . 26 ALA CA . 51406 1
135 . 1 . 1 22 22 ALA CB C 13 19.645 . . 1 . . . . . 26 ALA CB . 51406 1
136 . 1 . 1 22 22 ALA N N 15 129.097 0.01 . 1 . . . . . 26 ALA N . 51406 1
137 . 1 . 1 23 23 LEU C C 13 176.113 . . 1 . . . . . 27 LEU C . 51406 1
138 . 1 . 1 23 23 LEU CA C 13 54.849 0.089 . 1 . . . . . 27 LEU CA . 51406 1
139 . 1 . 1 23 23 LEU CB C 13 41.731 0.107 . 1 . . . . . 27 LEU CB . 51406 1
140 . 1 . 1 23 23 LEU CG C 13 26.299 . . 1 . . . . . 27 LEU CG . 51406 1
141 . 1 . 1 23 23 LEU CD1 C 13 24.631 . . 1 . . . . . 27 LEU CD1 . 51406 1
142 . 1 . 1 24 24 HIS H H 1 7.488 0.008 . 1 . . . . . 28 HIS H . 51406 1
143 . 1 . 1 24 24 HIS HA H 1 4.096 . . 1 . . . . . 28 HIS HA . 51406 1
144 . 1 . 1 24 24 HIS HB2 H 1 2.747 0.005 . 1 . . . . . 28 HIS HB2 . 51406 1
145 . 1 . 1 24 24 HIS C C 13 180.091 . . 1 . . . . . 28 HIS C . 51406 1
146 . 1 . 1 24 24 HIS CA C 13 57.417 0.003 . 1 . . . . . 28 HIS CA . 51406 1
147 . 1 . 1 24 24 HIS CB C 13 31.450 . . 1 . . . . . 28 HIS CB . 51406 1
148 . 1 . 1 24 24 HIS N N 15 124.991 0.129 . 1 . . . . . 28 HIS N . 51406 1
149 . 1 . 1 25 25 LYS C C 13 175.586 . . 1 . . . . . 29 LYS C . 51406 1
150 . 1 . 1 25 25 LYS CA C 13 55.934 0.021 . 1 . . . . . 29 LYS CA . 51406 1
151 . 1 . 1 25 25 LYS CB C 13 32.856 0.186 . 1 . . . . . 29 LYS CB . 51406 1
152 . 1 . 1 25 25 LYS CG C 13 24.333 . . 1 . . . . . 29 LYS CG . 51406 1
153 . 1 . 1 25 25 LYS CD C 13 28.744 . . 1 . . . . . 29 LYS CD . 51406 1
154 . 1 . 1 26 26 THR H H 1 7.654 0.006 . 1 . . . . . 30 THR H . 51406 1
155 . 1 . 1 26 26 THR HA H 1 3.827 0.002 . 1 . . . . . 30 THR HA . 51406 1
156 . 1 . 1 26 26 THR HB H 1 3.925 0.005 . 1 . . . . . 30 THR HB . 51406 1
157 . 1 . 1 26 26 THR HG21 H 1 0.875 . . 1 . . . . . 30 THR HG21 . 51406 1
158 . 1 . 1 26 26 THR HG22 H 1 0.875 . . 1 . . . . . 30 THR HG22 . 51406 1
159 . 1 . 1 26 26 THR HG23 H 1 0.875 . . 1 . . . . . 30 THR HG23 . 51406 1
160 . 1 . 1 26 26 THR C C 13 173.898 . . 1 . . . . . 30 THR C . 51406 1
161 . 1 . 1 26 26 THR CA C 13 63.087 0.054 . 1 . . . . . 30 THR CA . 51406 1
162 . 1 . 1 26 26 THR CB C 13 70.425 . . 1 . . . . . 30 THR CB . 51406 1
163 . 1 . 1 26 26 THR CG2 C 13 21.311 . . 1 . . . . . 30 THR CG2 . 51406 1
164 . 1 . 1 26 26 THR N N 15 120.897 0.046 . 1 . . . . . 30 THR N . 51406 1
165 . 1 . 1 27 27 THR H H 1 7.613 0.005 . 1 . . . . . 31 THR H . 51406 1
166 . 1 . 1 27 27 THR HA H 1 3.853 0.009 . 1 . . . . . 31 THR HA . 51406 1
167 . 1 . 1 27 27 THR HB H 1 3.949 0.015 . 1 . . . . . 31 THR HB . 51406 1
168 . 1 . 1 27 27 THR HG21 H 1 0.893 . . 1 . . . . . 31 THR HG21 . 51406 1
169 . 1 . 1 27 27 THR HG22 H 1 0.893 . . 1 . . . . . 31 THR HG22 . 51406 1
170 . 1 . 1 27 27 THR HG23 H 1 0.893 . . 1 . . . . . 31 THR HG23 . 51406 1
171 . 1 . 1 27 27 THR C C 13 173.423 . . 1 . . . . . 31 THR C . 51406 1
172 . 1 . 1 27 27 THR CA C 13 61.519 0.069 . 1 . . . . . 31 THR CA . 51406 1
173 . 1 . 1 27 27 THR CB C 13 69.775 0.056 . 1 . . . . . 31 THR CB . 51406 1
174 . 1 . 1 27 27 THR CG2 C 13 21.282 . . 1 . . . . . 31 THR CG2 . 51406 1
175 . 1 . 1 27 27 THR N N 15 121.181 0.021 . 1 . . . . . 31 THR N . 51406 1
176 . 1 . 1 28 28 LYS H H 1 7.878 0.006 . 1 . . . . . 32 LYS H . 51406 1
177 . 1 . 1 28 28 LYS HA H 1 3.846 0.005 . 1 . . . . . 32 LYS HA . 51406 1
178 . 1 . 1 28 28 LYS HB2 H 1 1.467 0.004 . 1 . . . . . 32 LYS HB2 . 51406 1
179 . 1 . 1 28 28 LYS HG2 H 1 1.013 . . 1 . . . . . 32 LYS HG2 . 51406 1
180 . 1 . 1 28 28 LYS HD2 H 1 1.230 . . 1 . . . . . 32 LYS HD2 . 51406 1
181 . 1 . 1 28 28 LYS CA C 13 57.646 0.01 . 1 . . . . . 32 LYS CA . 51406 1
182 . 1 . 1 28 28 LYS CB C 13 33.204 . . 1 . . . . . 32 LYS CB . 51406 1
183 . 1 . 1 28 28 LYS N N 15 128.805 0.022 . 1 . . . . . 32 LYS N . 51406 1
184 . 1 . 1 30 30 GLN C C 13 174.806 . . 1 . . . . . 34 GLN C . 51406 1
185 . 1 . 1 30 30 GLN CA C 13 55.544 0.046 . 1 . . . . . 34 GLN CA . 51406 1
186 . 1 . 1 30 30 GLN CB C 13 29.235 0.054 . 1 . . . . . 34 GLN CB . 51406 1
187 . 1 . 1 30 30 GLN CG C 13 33.525 . . 1 . . . . . 34 GLN CG . 51406 1
188 . 1 . 1 31 31 ARG H H 1 7.843 0.006 . 1 . . . . . 35 ARG H . 51406 1
189 . 1 . 1 31 31 ARG HA H 1 3.840 . . 1 . . . . . 35 ARG HA . 51406 1
190 . 1 . 1 31 31 ARG HB2 H 1 1.509 0.009 . 2 . . . . . 35 ARG HB2 . 51406 1
191 . 1 . 1 31 31 ARG HB3 H 1 1.381 . . 2 . . . . . 35 ARG HB3 . 51406 1
192 . 1 . 1 31 31 ARG HG2 H 1 1.194 . . 1 . . . . . 35 ARG HG2 . 51406 1
193 . 1 . 1 31 31 ARG HD2 H 1 2.779 . . 1 . . . . . 35 ARG HD2 . 51406 1
194 . 1 . 1 31 31 ARG CA C 13 57.331 0.001 . 1 . . . . . 35 ARG CA . 51406 1
195 . 1 . 1 31 31 ARG CB C 13 30.967 . . 1 . . . . . 35 ARG CB . 51406 1
196 . 1 . 1 31 31 ARG N N 15 127.478 0.032 . 1 . . . . . 35 ARG N . 51406 1
197 . 1 . 1 33 33 LEU C C 13 176.482 . . 1 . . . . . 37 LEU C . 51406 1
198 . 1 . 1 33 33 LEU CA C 13 54.819 0.129 . 1 . . . . . 37 LEU CA . 51406 1
199 . 1 . 1 33 33 LEU CB C 13 41.954 0.238 . 1 . . . . . 37 LEU CB . 51406 1
200 . 1 . 1 34 34 GLY H H 1 7.572 0.009 . 1 . . . . . 38 GLY H . 51406 1
201 . 1 . 1 34 34 GLY HA2 H 1 3.524 . . 2 . . . . . 38 GLY HA2 . 51406 1
202 . 1 . 1 34 34 GLY HA3 H 1 3.350 0.001 . 2 . . . . . 38 GLY HA3 . 51406 1
203 . 1 . 1 34 34 GLY CA C 13 45.757 0.009 . 1 . . . . . 38 GLY CA . 51406 1
204 . 1 . 1 34 34 GLY N N 15 115.090 0.15 . 1 . . . . . 38 GLY N . 51406 1
205 . 1 . 1 38 38 GLN C C 13 175.276 . . 1 . . . . . 42 GLN C . 51406 1
206 . 1 . 1 38 38 GLN CA C 13 55.527 0.049 . 1 . . . . . 42 GLN CA . 51406 1
207 . 1 . 1 38 38 GLN CB C 13 29.131 0.06 . 1 . . . . . 42 GLN CB . 51406 1
208 . 1 . 1 38 38 GLN CG C 13 33.458 . . 1 . . . . . 42 GLN CG . 51406 1
209 . 1 . 1 39 39 LEU H H 1 8.154 0.005 . 1 . . . . . 43 LEU H . 51406 1
210 . 1 . 1 39 39 LEU C C 13 176.043 0.002 . 1 . . . . . 43 LEU C . 51406 1
211 . 1 . 1 39 39 LEU CA C 13 54.860 0.056 . 1 . . . . . 43 LEU CA . 51406 1
212 . 1 . 1 39 39 LEU CB C 13 41.738 0.057 . 1 . . . . . 43 LEU CB . 51406 1
213 . 1 . 1 39 39 LEU CG C 13 26.565 . . 1 . . . . . 43 LEU CG . 51406 1
214 . 1 . 1 39 39 LEU CD1 C 13 24.693 . . 2 . . . . . 43 LEU CD1 . 51406 1
215 . 1 . 1 39 39 LEU CD2 C 13 22.939 . . 2 . . . . . 43 LEU CD2 . 51406 1
216 . 1 . 1 39 39 LEU N N 15 124.474 0.046 . 1 . . . . . 43 LEU N . 51406 1
217 . 1 . 1 40 40 LEU H H 1 7.653 0.004 . 1 . . . . . 44 LEU H . 51406 1
218 . 1 . 1 40 40 LEU HA H 1 3.888 0.01 . 1 . . . . . 44 LEU HA . 51406 1
219 . 1 . 1 40 40 LEU HB2 H 1 1.226 0.012 . 2 . . . . . 44 LEU HB2 . 51406 1
220 . 1 . 1 40 40 LEU HB3 H 1 1.362 . . 2 . . . . . 44 LEU HB3 . 51406 1
221 . 1 . 1 40 40 LEU HD11 H 1 0.636 . . 2 . . . . . 44 LEU HD11 . 51406 1
222 . 1 . 1 40 40 LEU HD12 H 1 0.636 . . 2 . . . . . 44 LEU HD12 . 51406 1
223 . 1 . 1 40 40 LEU HD13 H 1 0.636 . . 2 . . . . . 44 LEU HD13 . 51406 1
224 . 1 . 1 40 40 LEU HD21 H 1 0.515 . . 2 . . . . . 44 LEU HD21 . 51406 1
225 . 1 . 1 40 40 LEU HD22 H 1 0.515 . . 2 . . . . . 44 LEU HD22 . 51406 1
226 . 1 . 1 40 40 LEU HD23 H 1 0.515 . . 2 . . . . . 44 LEU HD23 . 51406 1
227 . 1 . 1 40 40 LEU C C 13 182.276 . . 1 . . . . . 44 LEU C . 51406 1
228 . 1 . 1 40 40 LEU CA C 13 56.338 0.025 . 1 . . . . . 44 LEU CA . 51406 1
229 . 1 . 1 40 40 LEU CB C 13 43.000 . . 1 . . . . . 44 LEU CB . 51406 1
230 . 1 . 1 40 40 LEU N N 15 128.694 0.029 . 1 . . . . . 44 LEU N . 51406 1
stop_
save_