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 51780
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name Nanog_aa1-85
_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 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.2
_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 'Spectral resolution'
_Assigned_chem_shift_list.Details '0.05 for CO, 0.2 for CA-CB'
_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-15N HSQC' . . . 51780 1
3 '3D HNCO' . . . 51780 1
5 '3D HNCACB' . . . 51780 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 . . 51780 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 2 2 MET H H 1 8.515538015 0 . 1 . . . . . 2 MET H . 51780 1
2 . 1 . 1 2 2 MET C C 13 176.0753473 0 . 1 . . . . . 2 MET C . 51780 1
3 . 1 . 1 2 2 MET CA C 13 55.32989687 0 . 1 . . . . . 2 MET CA . 51780 1
4 . 1 . 1 2 2 MET CB C 13 32.81935015 0 . 1 . . . . . 2 MET CB . 51780 1
5 . 1 . 1 2 2 MET N N 15 119.7455887 0 . 1 . . . . . 2 MET N . 51780 1
6 . 1 . 1 3 3 SER H H 1 8.356629129 0.001705019843 . 1 . . . . . 3 SER H . 51780 1
7 . 1 . 1 3 3 SER C C 13 174.0304968 0 . 1 . . . . . 3 SER C . 51780 1
8 . 1 . 1 3 3 SER CA C 13 58.14830917 0 . 1 . . . . . 3 SER CA . 51780 1
9 . 1 . 1 3 3 SER CB C 13 63.64059981 0 . 1 . . . . . 3 SER CB . 51780 1
10 . 1 . 1 3 3 SER N N 15 118.0194578 0.0045771225 . 1 . . . . . 3 SER N . 51780 1
11 . 1 . 1 4 4 VAL H H 1 8.099504783 0.0008891091941 . 1 . . . . . 4 VAL H . 51780 1
12 . 1 . 1 4 4 VAL C C 13 175.3890619 0 . 1 . . . . . 4 VAL C . 51780 1
13 . 1 . 1 4 4 VAL CA C 13 61.6471676 0 . 1 . . . . . 4 VAL CA . 51780 1
14 . 1 . 1 4 4 VAL CB C 13 32.54041252 0 . 1 . . . . . 4 VAL CB . 51780 1
15 . 1 . 1 4 4 VAL N N 15 121.669143 0.002379979046 . 1 . . . . . 4 VAL N . 51780 1
16 . 1 . 1 5 5 ASP H H 1 8.318289431 0.001273846522 . 1 . . . . . 5 ASP H . 51780 1
17 . 1 . 1 5 5 ASP CA C 13 51.85221983 0 . 1 . . . . . 5 ASP CA . 51780 1
18 . 1 . 1 5 5 ASP CB C 13 40.83269826 0 . 1 . . . . . 5 ASP CB . 51780 1
19 . 1 . 1 5 5 ASP N N 15 126.3335374 0.001034505001 . 1 . . . . . 5 ASP N . 51780 1
20 . 1 . 1 6 6 PRO C C 13 176.5594365 0 . 1 . . . . . 6 PRO C . 51780 1
21 . 1 . 1 6 6 PRO CA C 13 63.030741 0 . 1 . . . . . 6 PRO CA . 51780 1
22 . 1 . 1 6 6 PRO CB C 13 31.78520429 0 . 1 . . . . . 6 PRO CB . 51780 1
23 . 1 . 1 7 7 ALA H H 1 8.221999172 0.001644007602 . 1 . . . . . 7 ALA H . 51780 1
24 . 1 . 1 7 7 ALA C C 13 177.4254195 0 . 1 . . . . . 7 ALA C . 51780 1
25 . 1 . 1 7 7 ALA CA C 13 52.26866244 0 . 1 . . . . . 7 ALA CA . 51780 1
26 . 1 . 1 7 7 ALA CB C 13 18.8117744 0 . 1 . . . . . 7 ALA CB . 51780 1
27 . 1 . 1 7 7 ALA N N 15 122.289351 0.007483195597 . 1 . . . . . 7 ALA N . 51780 1
28 . 1 . 1 8 8 CYS H H 1 7.916512483 0.001209600795 . 1 . . . . . 8 CYS H . 51780 1
29 . 1 . 1 8 8 CYS C C 13 172.5408762 0 . 1 . . . . . 8 CYS C . 51780 1
30 . 1 . 1 8 8 CYS CA C 13 56.31245059 0 . 1 . . . . . 8 CYS CA . 51780 1
31 . 1 . 1 8 8 CYS CB C 13 27.06684505 0 . 1 . . . . . 8 CYS CB . 51780 1
32 . 1 . 1 8 8 CYS N N 15 119.477424 0.004463071495 . 1 . . . . . 8 CYS N . 51780 1
33 . 1 . 1 9 9 PRO C C 13 176.7332221 0 . 1 . . . . . 9 PRO C . 51780 1
34 . 1 . 1 9 9 PRO CA C 13 63.35019119 0 . 1 . . . . . 9 PRO CA . 51780 1
35 . 1 . 1 9 9 PRO CB C 13 31.94786423 0 . 1 . . . . . 9 PRO CB . 51780 1
36 . 1 . 1 10 10 GLN H H 1 8.332966199 0.001510704969 . 1 . . . . . 10 GLN H . 51780 1
37 . 1 . 1 10 10 GLN C C 13 175.7427468 0 . 1 . . . . . 10 GLN C . 51780 1
38 . 1 . 1 10 10 GLN CA C 13 55.67775342 0 . 1 . . . . . 10 GLN CA . 51780 1
39 . 1 . 1 10 10 GLN CB C 13 29.21046181 0 . 1 . . . . . 10 GLN CB . 51780 1
40 . 1 . 1 10 10 GLN N N 15 120.2256304 0.0007507749193 . 1 . . . . . 10 GLN N . 51780 1
41 . 1 . 1 11 11 SER H H 1 8.167536245 0.0001998804593 . 1 . . . . . 11 SER H . 51780 1
42 . 1 . 1 11 11 SER C C 13 173.7747866 0 . 1 . . . . . 11 SER C . 51780 1
43 . 1 . 1 11 11 SER CA C 13 58.10671613 0 . 1 . . . . . 11 SER CA . 51780 1
44 . 1 . 1 11 11 SER CB C 13 63.54296601 0 . 1 . . . . . 11 SER CB . 51780 1
45 . 1 . 1 11 11 SER N N 15 117.4048799 0.0006539842051 . 1 . . . . . 11 SER N . 51780 1
46 . 1 . 1 12 12 LEU H H 1 8.126143049 0.002998404982 . 1 . . . . . 12 LEU H . 51780 1
47 . 1 . 1 12 12 LEU C C 13 175.0907081 0 . 1 . . . . . 12 LEU C . 51780 1
48 . 1 . 1 12 12 LEU CA C 13 52.77924678 0 . 1 . . . . . 12 LEU CA . 51780 1
49 . 1 . 1 12 12 LEU CB C 13 41.45579214 0 . 1 . . . . . 12 LEU CB . 51780 1
50 . 1 . 1 12 12 LEU N N 15 125.2493034 0.0005008052485 . 1 . . . . . 12 LEU N . 51780 1
51 . 1 . 1 13 13 PRO C C 13 176.299422 0 . 1 . . . . . 13 PRO C . 51780 1
52 . 1 . 1 13 13 PRO CA C 13 62.59804441 0 . 1 . . . . . 13 PRO CA . 51780 1
53 . 1 . 1 13 13 PRO CB C 13 31.71541293 0 . 1 . . . . . 13 PRO CB . 51780 1
54 . 1 . 1 14 14 CYS H H 1 8.190619276 0.003440719638 . 1 . . . . . 14 CYS H . 51780 1
55 . 1 . 1 14 14 CYS C C 13 174.0861534 0 . 1 . . . . . 14 CYS C . 51780 1
56 . 1 . 1 14 14 CYS CA C 13 57.96748397 0 . 1 . . . . . 14 CYS CA . 51780 1
57 . 1 . 1 14 14 CYS CB C 13 27.79645421 0 . 1 . . . . . 14 CYS CB . 51780 1
58 . 1 . 1 14 14 CYS N N 15 119.2127103 0.001225230642 . 1 . . . . . 14 CYS N . 51780 1
59 . 1 . 1 15 15 PHE H H 1 8.192213406 0.0003502880134 . 1 . . . . . 15 PHE H . 51780 1
60 . 1 . 1 15 15 PHE C C 13 175.2544054 0 . 1 . . . . . 15 PHE C . 51780 1
61 . 1 . 1 15 15 PHE CA C 13 57.63425778 0 . 1 . . . . . 15 PHE CA . 51780 1
62 . 1 . 1 15 15 PHE CB C 13 39.36055508 0 . 1 . . . . . 15 PHE CB . 51780 1
63 . 1 . 1 15 15 PHE N N 15 123.1644855 0.008449738395 . 1 . . . . . 15 PHE N . 51780 1
64 . 1 . 1 16 16 GLU H H 1 8.160401943 0.001528445977 . 1 . . . . . 16 GLU H . 51780 1
65 . 1 . 1 16 16 GLU C C 13 175.5758377 0 . 1 . . . . . 16 GLU C . 51780 1
66 . 1 . 1 16 16 GLU CA C 13 55.85967051 0 . 1 . . . . . 16 GLU CA . 51780 1
67 . 1 . 1 16 16 GLU CB C 13 30.28563001 0 . 1 . . . . . 16 GLU CB . 51780 1
68 . 1 . 1 16 16 GLU N N 15 123.0245848 0.00475595039 . 1 . . . . . 16 GLU N . 51780 1
69 . 1 . 1 17 17 ALA H H 1 8.214706368 0.000932452152 . 1 . . . . . 17 ALA H . 51780 1
70 . 1 . 1 17 17 ALA C C 13 177.7342363 0 . 1 . . . . . 17 ALA C . 51780 1
71 . 1 . 1 17 17 ALA CA C 13 52.52538585 0 . 1 . . . . . 17 ALA CA . 51780 1
72 . 1 . 1 17 17 ALA CB C 13 18.97299497 0 . 1 . . . . . 17 ALA CB . 51780 1
73 . 1 . 1 17 17 ALA N N 15 125.8157943 0.003084371758 . 1 . . . . . 17 ALA N . 51780 1
74 . 1 . 1 18 18 SER H H 1 8.191376625 0.0008167507878 . 1 . . . . . 18 SER H . 51780 1
75 . 1 . 1 18 18 SER C C 13 174.2148095 0 . 1 . . . . . 18 SER C . 51780 1
76 . 1 . 1 18 18 SER CA C 13 58.35444901 0 . 1 . . . . . 18 SER CA . 51780 1
77 . 1 . 1 18 18 SER CB C 13 63.55519951 0 . 1 . . . . . 18 SER CB . 51780 1
78 . 1 . 1 18 18 SER N N 15 114.9257714 0.001550919583 . 1 . . . . . 18 SER N . 51780 1
79 . 1 . 1 19 19 ASP H H 1 8.186080691 0.001276848285 . 1 . . . . . 19 ASP H . 51780 1
80 . 1 . 1 19 19 ASP C C 13 175.9063657 0 . 1 . . . . . 19 ASP C . 51780 1
81 . 1 . 1 19 19 ASP CA C 13 54.13662197 0 . 1 . . . . . 19 ASP CA . 51780 1
82 . 1 . 1 19 19 ASP CB C 13 40.75797074 0 . 1 . . . . . 19 ASP CB . 51780 1
83 . 1 . 1 19 19 ASP N N 15 122.0649954 0.0003653033255 . 1 . . . . . 19 ASP N . 51780 1
84 . 1 . 1 20 20 CYS H H 1 8.077657126 0.001175368738 . 1 . . . . . 20 CYS H . 51780 1
85 . 1 . 1 20 20 CYS C C 13 174.5767641 0 . 1 . . . . . 20 CYS C . 51780 1
86 . 1 . 1 20 20 CYS CA C 13 58.51365795 0 . 1 . . . . . 20 CYS CA . 51780 1
87 . 1 . 1 20 20 CYS CB C 13 27.48870762 0 . 1 . . . . . 20 CYS CB . 51780 1
88 . 1 . 1 20 20 CYS N N 15 119.435181 0.01230354762 . 1 . . . . . 20 CYS N . 51780 1
89 . 1 . 1 21 21 LYS H H 1 8.290876688 0.001426439699 . 1 . . . . . 21 LYS H . 51780 1
90 . 1 . 1 21 21 LYS C C 13 176.4919809 0 . 1 . . . . . 21 LYS C . 51780 1
91 . 1 . 1 21 21 LYS CA C 13 56.3453966 0 . 1 . . . . . 21 LYS CA . 51780 1
92 . 1 . 1 21 21 LYS CB C 13 32.59309316 0 . 1 . . . . . 21 LYS CB . 51780 1
93 . 1 . 1 21 21 LYS N N 15 124.0828789 0 . 1 . . . . . 21 LYS N . 51780 1
94 . 1 . 1 22 22 GLU H H 1 8.266967828 0.0007722134312 . 1 . . . . . 22 GLU H . 51780 1
95 . 1 . 1 22 22 GLU C C 13 176.2600103 0 . 1 . . . . . 22 GLU C . 51780 1
96 . 1 . 1 22 22 GLU CA C 13 56.45673519 0 . 1 . . . . . 22 GLU CA . 51780 1
97 . 1 . 1 22 22 GLU CB C 13 29.82987654 0 . 1 . . . . . 22 GLU CB . 51780 1
98 . 1 . 1 22 22 GLU N N 15 121.7085117 0.006378159141 . 1 . . . . . 22 GLU N . 51780 1
99 . 1 . 1 23 23 SER H H 1 8.214122394 0.000484890918 . 1 . . . . . 23 SER H . 51780 1
100 . 1 . 1 23 23 SER C C 13 173.9826523 0 . 1 . . . . . 23 SER C . 51780 1
101 . 1 . 1 23 23 SER N N 15 117.2614847 0.005686041889 . 1 . . . . . 23 SER N . 51780 1
102 . 1 . 1 24 24 SER H H 1 8.207349157 0.002270326395 . 1 . . . . . 24 SER H . 51780 1
103 . 1 . 1 24 24 SER C C 13 172.178858 0 . 1 . . . . . 24 SER C . 51780 1
104 . 1 . 1 24 24 SER N N 15 119.014681 0.005360852137 . 1 . . . . . 24 SER N . 51780 1
105 . 1 . 1 25 25 PRO C C 13 176.5736374 0 . 1 . . . . . 25 PRO C . 51780 1
106 . 1 . 1 25 25 PRO CA C 13 62.7509912 0 . 1 . . . . . 25 PRO CA . 51780 1
107 . 1 . 1 26 26 MET H H 1 8.289205619 0.0007423682296 . 1 . . . . . 26 MET H . 51780 1
108 . 1 . 1 26 26 MET C C 13 174.1278638 0 . 1 . . . . . 26 MET C . 51780 1
109 . 1 . 1 26 26 MET CA C 13 53.11059024 0 . 1 . . . . . 26 MET CA . 51780 1
110 . 1 . 1 26 26 MET CB C 13 31.91841862 0 . 1 . . . . . 26 MET CB . 51780 1
111 . 1 . 1 26 26 MET N N 15 122.2950241 0.004238125229 . 1 . . . . . 26 MET N . 51780 1
112 . 1 . 1 27 27 PRO C C 13 174.7843182 0 . 1 . . . . . 27 PRO C . 51780 1
113 . 1 . 1 27 27 PRO CB C 13 31.85416794 0 . 1 . . . . . 27 PRO CB . 51780 1
114 . 1 . 1 28 28 VAL H H 1 8.149746324 0.001268130756 . 1 . . . . . 28 VAL H . 51780 1
115 . 1 . 1 28 28 VAL C C 13 176.008203 0 . 1 . . . . . 28 VAL C . 51780 1
116 . 1 . 1 28 28 VAL CA C 13 62.08941184 0 . 1 . . . . . 28 VAL CA . 51780 1
117 . 1 . 1 28 28 VAL CB C 13 32.4334884 0 . 1 . . . . . 28 VAL CB . 51780 1
118 . 1 . 1 28 28 VAL N N 15 121.6666267 0.0000013487 . 1 . . . . . 28 VAL N . 51780 1
119 . 1 . 1 29 29 ILE H H 1 8.217541347 0.000464838859 . 1 . . . . . 29 ILE H . 51780 1
120 . 1 . 1 29 29 ILE C C 13 175.8349027 0 . 1 . . . . . 29 ILE C . 51780 1
121 . 1 . 1 29 29 ILE CA C 13 60.57445226 0 . 1 . . . . . 29 ILE CA . 51780 1
122 . 1 . 1 29 29 ILE CB C 13 38.22018218 0 . 1 . . . . . 29 ILE CB . 51780 1
123 . 1 . 1 29 29 ILE N N 15 126.1387879 0.00955382353 . 1 . . . . . 29 ILE N . 51780 1
124 . 1 . 1 30 30 CYS H H 1 8.388358633 0.001395438214 . 1 . . . . . 30 CYS H . 51780 1
125 . 1 . 1 30 30 CYS C C 13 174.3003805 0 . 1 . . . . . 30 CYS C . 51780 1
126 . 1 . 1 30 30 CYS CA C 13 58.33803969 0 . 1 . . . . . 30 CYS CA . 51780 1
127 . 1 . 1 30 30 CYS CB C 13 28.20473509 0 . 1 . . . . . 30 CYS CB . 51780 1
128 . 1 . 1 30 30 CYS N N 15 124.756164 0.008416673305 . 1 . . . . . 30 CYS N . 51780 1
129 . 1 . 1 31 31 GLY H H 1 8.325675634 0.0005179851591 . 1 . . . . . 31 GLY H . 51780 1
130 . 1 . 1 31 31 GLY CA C 13 44.36953017 0 . 1 . . . . . 31 GLY CA . 51780 1
131 . 1 . 1 31 31 GLY N N 15 111.8250757 0.008994069462 . 1 . . . . . 31 GLY N . 51780 1
132 . 1 . 1 32 32 PRO C C 13 177.0883325 0 . 1 . . . . . 32 PRO C . 51780 1
133 . 1 . 1 32 32 PRO CA C 13 63.12964336 0 . 1 . . . . . 32 PRO CA . 51780 1
134 . 1 . 1 32 32 PRO CB C 13 31.78952656 0 . 1 . . . . . 32 PRO CB . 51780 1
135 . 1 . 1 33 33 GLU H H 1 8.485562602 0.0008679066199 . 1 . . . . . 33 GLU H . 51780 1
136 . 1 . 1 33 33 GLU C C 13 176.4201342 0 . 1 . . . . . 33 GLU C . 51780 1
137 . 1 . 1 33 33 GLU CA C 13 56.60705788 0 . 1 . . . . . 33 GLU CA . 51780 1
138 . 1 . 1 33 33 GLU CB C 13 29.48514007 0 . 1 . . . . . 33 GLU CB . 51780 1
139 . 1 . 1 33 33 GLU N N 15 120.5461437 0.00409107897 . 1 . . . . . 33 GLU N . 51780 1
140 . 1 . 1 34 34 GLU H H 1 8.111191709 0.0002846425038 . 1 . . . . . 34 GLU H . 51780 1
141 . 1 . 1 34 34 GLU C C 13 175.5548209 0 . 1 . . . . . 34 GLU C . 51780 1
142 . 1 . 1 34 34 GLU CA C 13 56.34412678 0 . 1 . . . . . 34 GLU CA . 51780 1
143 . 1 . 1 34 34 GLU CB C 13 29.87260816 0 . 1 . . . . . 34 GLU CB . 51780 1
144 . 1 . 1 34 34 GLU N N 15 121.3346953 0.01097751676 . 1 . . . . . 34 GLU N . 51780 1
145 . 1 . 1 35 35 ASN H H 1 8.110511916 0.0008693162752 . 1 . . . . . 35 ASN H . 51780 1
146 . 1 . 1 35 35 ASN C C 13 174.1154187 0 . 1 . . . . . 35 ASN C . 51780 1
147 . 1 . 1 35 35 ASN CA C 13 52.80552652 0 . 1 . . . . . 35 ASN CA . 51780 1
148 . 1 . 1 35 35 ASN CB C 13 38.84799824 0 . 1 . . . . . 35 ASN CB . 51780 1
149 . 1 . 1 35 35 ASN N N 15 119.0952819 0 . 1 . . . . . 35 ASN N . 51780 1
150 . 1 . 1 36 36 TYR H H 1 7.967469472 0.001080051071 . 1 . . . . . 36 TYR H . 51780 1
151 . 1 . 1 36 36 TYR C C 13 173.7811596 0 . 1 . . . . . 36 TYR C . 51780 1
152 . 1 . 1 36 36 TYR CA C 13 55.96221993 0 . 1 . . . . . 36 TYR CA . 51780 1
153 . 1 . 1 36 36 TYR CB C 13 37.58297191 0 . 1 . . . . . 36 TYR CB . 51780 1
154 . 1 . 1 36 36 TYR N N 15 121.5608322 0.008782013287 . 1 . . . . . 36 TYR N . 51780 1
155 . 1 . 1 37 37 PRO C C 13 176.8100761 0 . 1 . . . . . 37 PRO C . 51780 1
156 . 1 . 1 37 37 PRO CB C 13 31.64593428 0 . 1 . . . . . 37 PRO CB . 51780 1
157 . 1 . 1 38 38 SER H H 1 8.194917993 0.002212740493 . 1 . . . . . 38 SER H . 51780 1
158 . 1 . 1 38 38 SER C C 13 174.6765331 0 . 1 . . . . . 38 SER C . 51780 1
159 . 1 . 1 38 38 SER CA C 13 58.22866687 0 . 1 . . . . . 38 SER CA . 51780 1
160 . 1 . 1 38 38 SER CB C 13 63.57875979 0 . 1 . . . . . 38 SER CB . 51780 1
161 . 1 . 1 38 38 SER N N 15 115.8304527 0.002211427005 . 1 . . . . . 38 SER N . 51780 1
162 . 1 . 1 39 39 LEU H H 1 8.144420902 0.0002532164419 . 1 . . . . . 39 LEU H . 51780 1
163 . 1 . 1 39 39 LEU C C 13 177.2094943 0 . 1 . . . . . 39 LEU C . 51780 1
164 . 1 . 1 39 39 LEU CA C 13 55.27491966 0 . 1 . . . . . 39 LEU CA . 51780 1
165 . 1 . 1 39 39 LEU CB C 13 41.88220023 0 . 1 . . . . . 39 LEU CB . 51780 1
166 . 1 . 1 39 39 LEU N N 15 124.065498 0.001287314795 . 1 . . . . . 39 LEU N . 51780 1
167 . 1 . 1 40 40 GLN H H 1 8.157359676 0.001300198163 . 1 . . . . . 40 GLN H . 51780 1
168 . 1 . 1 40 40 GLN C C 13 175.8035817 0 . 1 . . . . . 40 GLN C . 51780 1
169 . 1 . 1 40 40 GLN CA C 13 55.62517434 0 . 1 . . . . . 40 GLN CA . 51780 1
170 . 1 . 1 40 40 GLN CB C 13 28.91833028 0 . 1 . . . . . 40 GLN CB . 51780 1
171 . 1 . 1 40 40 GLN N N 15 120.8813958 0.002268337567 . 1 . . . . . 40 GLN N . 51780 1
172 . 1 . 1 41 41 MET H H 1 8.226920665 0.000238087066 . 1 . . . . . 41 MET H . 51780 1
173 . 1 . 1 41 41 MET C C 13 176.1792553 0 . 1 . . . . . 41 MET C . 51780 1
174 . 1 . 1 41 41 MET CA C 13 55.33296822 0 . 1 . . . . . 41 MET CA . 51780 1
175 . 1 . 1 41 41 MET CB C 13 32.6418925 0 . 1 . . . . . 41 MET CB . 51780 1
176 . 1 . 1 41 41 MET N N 15 121.8578211 0.003136719348 . 1 . . . . . 41 MET N . 51780 1
177 . 1 . 1 42 42 SER H H 1 8.262439848 0.001424190903 . 1 . . . . . 42 SER H . 51780 1
178 . 1 . 1 42 42 SER C C 13 174.5017366 0 . 1 . . . . . 42 SER C . 51780 1
179 . 1 . 1 42 42 SER CA C 13 58.18990295 0 . 1 . . . . . 42 SER CA . 51780 1
180 . 1 . 1 42 42 SER CB C 13 63.6361734 0 . 1 . . . . . 42 SER CB . 51780 1
181 . 1 . 1 42 42 SER N N 15 117.2191102 0.01064637944 . 1 . . . . . 42 SER N . 51780 1
182 . 1 . 1 43 43 SER H H 1 8.256469059 0.0002688470261 . 1 . . . . . 43 SER H . 51780 1
183 . 1 . 1 43 43 SER C C 13 174.2370793 0 . 1 . . . . . 43 SER C . 51780 1
184 . 1 . 1 43 43 SER CA C 13 58.15596275 0 . 1 . . . . . 43 SER CA . 51780 1
185 . 1 . 1 43 43 SER CB C 13 63.48293862 0 . 1 . . . . . 43 SER CB . 51780 1
186 . 1 . 1 43 43 SER N N 15 117.9157801 0.003329530677 . 1 . . . . . 43 SER N . 51780 1
187 . 1 . 1 44 44 ALA H H 1 8.1240257 0.0008900617571 . 1 . . . . . 44 ALA H . 51780 1
188 . 1 . 1 44 44 ALA C C 13 177.4273834 0 . 1 . . . . . 44 ALA C . 51780 1
189 . 1 . 1 44 44 ALA CA C 13 52.46260477 0 . 1 . . . . . 44 ALA CA . 51780 1
190 . 1 . 1 44 44 ALA CB C 13 18.9374874 0 . 1 . . . . . 44 ALA CB . 51780 1
191 . 1 . 1 44 44 ALA N N 15 125.4717354 0.0000013487 . 1 . . . . . 44 ALA N . 51780 1
192 . 1 . 1 45 45 GLU H H 1 8.041733293 0.0001950458885 . 1 . . . . . 45 GLU H . 51780 1
193 . 1 . 1 45 45 GLU C C 13 176.0994808 0 . 1 . . . . . 45 GLU C . 51780 1
194 . 1 . 1 45 45 GLU CA C 13 56.12756309 0 . 1 . . . . . 45 GLU CA . 51780 1
195 . 1 . 1 45 45 GLU CB C 13 30.01827797 0 . 1 . . . . . 45 GLU CB . 51780 1
196 . 1 . 1 45 45 GLU N N 15 119.4517985 0.004676651018 . 1 . . . . . 45 GLU N . 51780 1
197 . 1 . 1 46 46 MET H H 1 8.146155115 0.001355979479 . 1 . . . . . 46 MET H . 51780 1
198 . 1 . 1 46 46 MET C C 13 173.874685 0 . 1 . . . . . 46 MET C . 51780 1
199 . 1 . 1 46 46 MET CA C 13 53.14116596 0 . 1 . . . . . 46 MET CA . 51780 1
200 . 1 . 1 46 46 MET CB C 13 31.86242707 0 . 1 . . . . . 46 MET CB . 51780 1
201 . 1 . 1 46 46 MET N N 15 123.0983861 0.004060898881 . 1 . . . . . 46 MET N . 51780 1
202 . 1 . 1 47 47 PRO C C 13 176.4404287 0 . 1 . . . . . 47 PRO C . 51780 1
203 . 1 . 1 47 47 PRO CA C 13 62.81659537 0 . 1 . . . . . 47 PRO CA . 51780 1
204 . 1 . 1 47 47 PRO CB C 13 31.82875468 0 . 1 . . . . . 47 PRO CB . 51780 1
205 . 1 . 1 48 48 HIS H H 1 8.537372643 0.003159662956 . 1 . . . . . 48 HIS H . 51780 1
206 . 1 . 1 48 48 HIS C C 13 174.5513257 0 . 1 . . . . . 48 HIS C . 51780 1
207 . 1 . 1 48 48 HIS CA C 13 55.24494023 0 . 1 . . . . . 48 HIS CA . 51780 1
208 . 1 . 1 48 48 HIS CB C 13 28.93957048 0 . 1 . . . . . 48 HIS CB . 51780 1
209 . 1 . 1 48 48 HIS N N 15 119.7454468 0.0003173572502 . 1 . . . . . 48 HIS N . 51780 1
210 . 1 . 1 49 49 THR H H 1 8.082497055 0.002046297091 . 1 . . . . . 49 THR H . 51780 1
211 . 1 . 1 49 49 THR C C 13 174.0058255 0 . 1 . . . . . 49 THR C . 51780 1
212 . 1 . 1 49 49 THR CA C 13 61.51123004 0 . 1 . . . . . 49 THR CA . 51780 1
213 . 1 . 1 49 49 THR CB C 13 69.63714645 0 . 1 . . . . . 49 THR CB . 51780 1
214 . 1 . 1 49 49 THR N N 15 116.6409336 0.003264649924 . 1 . . . . . 49 THR N . 51780 1
215 . 1 . 1 50 50 GLU H H 1 8.477289168 0.00084239639 . 1 . . . . . 50 GLU H . 51780 1
216 . 1 . 1 50 50 GLU C C 13 176.2336414 0 . 1 . . . . . 50 GLU C . 51780 1
217 . 1 . 1 50 50 GLU CA C 13 56.20421174 0 . 1 . . . . . 50 GLU CA . 51780 1
218 . 1 . 1 50 50 GLU CB C 13 29.9468262 0 . 1 . . . . . 50 GLU CB . 51780 1
219 . 1 . 1 50 50 GLU N N 15 123.6992972 0 . 1 . . . . . 50 GLU N . 51780 1
220 . 1 . 1 51 51 THR H H 1 8.215117267 0.002341769494 . 1 . . . . . 51 THR H . 51780 1
221 . 1 . 1 51 51 THR C C 13 174.1177819 0 . 1 . . . . . 51 THR C . 51780 1
222 . 1 . 1 51 51 THR CA C 13 61.77556933 0 . 1 . . . . . 51 THR CA . 51780 1
223 . 1 . 1 51 51 THR CB C 13 69.51869633 0 . 1 . . . . . 51 THR CB . 51780 1
224 . 1 . 1 51 51 THR N N 15 117.1669868 0.008625008268 . 1 . . . . . 51 THR N . 51780 1
225 . 1 . 1 52 52 VAL H H 1 8.169027619 0.003530652167 . 1 . . . . . 52 VAL H . 51780 1
226 . 1 . 1 52 52 VAL C C 13 175.7431792 0 . 1 . . . . . 52 VAL C . 51780 1
227 . 1 . 1 52 52 VAL CA C 13 61.81128768 0 . 1 . . . . . 52 VAL CA . 51780 1
228 . 1 . 1 52 52 VAL CB C 13 32.56644455 0 . 1 . . . . . 52 VAL CB . 51780 1
229 . 1 . 1 52 52 VAL N N 15 123.9528132 0.007830556222 . 1 . . . . . 52 VAL N . 51780 1
230 . 1 . 1 53 53 SER H H 1 8.37590315 0.0009601774962 . 1 . . . . . 53 SER H . 51780 1
231 . 1 . 1 53 53 SER C C 13 172.2619611 0 . 1 . . . . . 53 SER C . 51780 1
232 . 1 . 1 53 53 SER CA C 13 56.24600689 0 . 1 . . . . . 53 SER CA . 51780 1
233 . 1 . 1 53 53 SER CB C 13 62.94852172 0 . 1 . . . . . 53 SER CB . 51780 1
234 . 1 . 1 53 53 SER N N 15 122.055866 0.0000013487 . 1 . . . . . 53 SER N . 51780 1
235 . 1 . 1 54 54 PRO C C 13 176.4642037 0 . 1 . . . . . 54 PRO C . 51780 1
236 . 1 . 1 54 54 PRO CA C 13 62.64911407 0 . 1 . . . . . 54 PRO CA . 51780 1
237 . 1 . 1 54 54 PRO CB C 13 31.7345843 0 . 1 . . . . . 54 PRO CB . 51780 1
238 . 1 . 1 55 55 LEU H H 1 8.199328548 0.001854566702 . 1 . . . . . 55 LEU H . 51780 1
239 . 1 . 1 55 55 LEU C C 13 175.3126424 0 . 1 . . . . . 55 LEU C . 51780 1
240 . 1 . 1 55 55 LEU CA C 13 53.03973785 0 . 1 . . . . . 55 LEU CA . 51780 1
241 . 1 . 1 55 55 LEU CB C 13 41.17902207 0 . 1 . . . . . 55 LEU CB . 51780 1
242 . 1 . 1 55 55 LEU N N 15 123.897362 0.06671429881 . 1 . . . . . 55 LEU N . 51780 1
243 . 1 . 1 56 56 PRO C C 13 176.8116075 0 . 1 . . . . . 56 PRO C . 51780 1
244 . 1 . 1 56 56 PRO CA C 13 62.77598811 0 . 1 . . . . . 56 PRO CA . 51780 1
245 . 1 . 1 56 56 PRO CB C 13 31.72940752 0 . 1 . . . . . 56 PRO CB . 51780 1
246 . 1 . 1 57 57 SER H H 1 8.32163924 0.0005121724292 . 1 . . . . . 57 SER H . 51780 1
247 . 1 . 1 57 57 SER CA C 13 58.1262681 0 . 1 . . . . . 57 SER CA . 51780 1
248 . 1 . 1 57 57 SER CB C 13 63.73448303 0 . 1 . . . . . 57 SER CB . 51780 1
249 . 1 . 1 57 57 SER N N 15 116.0191915 0.001638809329 . 1 . . . . . 57 SER N . 51780 1
250 . 1 . 1 58 58 SER H H 1 8.236608565 0 . 1 . . . . . 58 SER H . 51780 1
251 . 1 . 1 58 58 SER C C 13 176.3189567 0 . 1 . . . . . 58 SER C . 51780 1
252 . 1 . 1 58 58 SER N N 15 117.6333809 0 . 1 . . . . . 58 SER N . 51780 1
253 . 1 . 1 59 59 MET H H 1 8.152095306 0.000020654 . 1 . . . . . 59 MET H . 51780 1
254 . 1 . 1 59 59 MET C C 13 175.9649091 0 . 1 . . . . . 59 MET C . 51780 1
255 . 1 . 1 59 59 MET CB C 13 32.30118069 0 . 1 . . . . . 59 MET CB . 51780 1
256 . 1 . 1 59 59 MET N N 15 121.5338335 0.004403119793 . 1 . . . . . 59 MET N . 51780 1
257 . 1 . 1 60 60 ASP H H 1 8.002361746 0.002148561784 . 1 . . . . . 60 ASP H . 51780 1
258 . 1 . 1 60 60 ASP C C 13 176.0692523 0 . 1 . . . . . 60 ASP C . 51780 1
259 . 1 . 1 60 60 ASP CA C 13 54.61249213 0 . 1 . . . . . 60 ASP CA . 51780 1
260 . 1 . 1 60 60 ASP CB C 13 40.60119212 0 . 1 . . . . . 60 ASP CB . 51780 1
261 . 1 . 1 60 60 ASP N N 15 120.8962308 0.001699442815 . 1 . . . . . 60 ASP N . 51780 1
262 . 1 . 1 61 61 LEU H H 1 7.860391844 0.0008375781478 . 1 . . . . . 61 LEU H . 51780 1
263 . 1 . 1 61 61 LEU C C 13 177.0789344 0 . 1 . . . . . 61 LEU C . 51780 1
264 . 1 . 1 61 61 LEU CA C 13 55.19960023 0 . 1 . . . . . 61 LEU CA . 51780 1
265 . 1 . 1 61 61 LEU CB C 13 41.9818999 0 . 1 . . . . . 61 LEU CB . 51780 1
266 . 1 . 1 61 61 LEU N N 15 121.679412 0.004924256861 . 1 . . . . . 61 LEU N . 51780 1
267 . 1 . 1 62 62 LEU H H 1 7.952628338 0.0004210176352 . 1 . . . . . 62 LEU H . 51780 1
268 . 1 . 1 62 62 LEU C C 13 177.0668206 0 . 1 . . . . . 62 LEU C . 51780 1
269 . 1 . 1 62 62 LEU CA C 13 55.15293283 0 . 1 . . . . . 62 LEU CA . 51780 1
270 . 1 . 1 62 62 LEU CB C 13 41.69642958 0 . 1 . . . . . 62 LEU CB . 51780 1
271 . 1 . 1 62 62 LEU N N 15 122.349531 0.002009112724 . 1 . . . . . 62 LEU N . 51780 1
272 . 1 . 1 63 63 ILE H H 1 7.890605331 0.001234623842 . 1 . . . . . 63 ILE H . 51780 1
273 . 1 . 1 63 63 ILE C C 13 176.0400461 0 . 1 . . . . . 63 ILE C . 51780 1
274 . 1 . 1 63 63 ILE CA C 13 60.792179 0 . 1 . . . . . 63 ILE CA . 51780 1
275 . 1 . 1 63 63 ILE CB C 13 37.99262675 0 . 1 . . . . . 63 ILE CB . 51780 1
276 . 1 . 1 63 63 ILE N N 15 122.2763773 0.01221453027 . 1 . . . . . 63 ILE N . 51780 1
277 . 1 . 1 64 64 GLN H H 1 8.275992442 0.001645030685 . 1 . . . . . 64 GLN H . 51780 1
278 . 1 . 1 64 64 GLN C C 13 175.2791231 0 . 1 . . . . . 64 GLN C . 51780 1
279 . 1 . 1 64 64 GLN CA C 13 55.44447431 0 . 1 . . . . . 64 GLN CA . 51780 1
280 . 1 . 1 64 64 GLN CB C 13 29.39101366 0 . 1 . . . . . 64 GLN CB . 51780 1
281 . 1 . 1 64 64 GLN N N 15 124.7543371 0.001567795908 . 1 . . . . . 64 GLN N . 51780 1
282 . 1 . 1 65 65 ASP H H 1 8.242542425 0.001161240954 . 1 . . . . . 65 ASP H . 51780 1
283 . 1 . 1 65 65 ASP C C 13 175.6587293 0 . 1 . . . . . 65 ASP C . 51780 1
284 . 1 . 1 65 65 ASP CA C 13 54.16218163 0 . 1 . . . . . 65 ASP CA . 51780 1
285 . 1 . 1 65 65 ASP CB C 13 40.88585312 0 . 1 . . . . . 65 ASP CB . 51780 1
286 . 1 . 1 65 65 ASP N N 15 122.0289449 0.007317688136 . 1 . . . . . 65 ASP N . 51780 1
287 . 1 . 1 66 66 SER H H 1 8.139354145 0.003054668181 . 1 . . . . . 66 SER H . 51780 1
288 . 1 . 1 66 66 SER C C 13 172.9065846 0 . 1 . . . . . 66 SER C . 51780 1
289 . 1 . 1 66 66 SER CA C 13 56.14065076 0 . 1 . . . . . 66 SER CA . 51780 1
290 . 1 . 1 66 66 SER CB C 13 63.06529272 0 . 1 . . . . . 66 SER CB . 51780 1
291 . 1 . 1 66 66 SER N N 15 116.8545612 0.001607291809 . 1 . . . . . 66 SER N . 51780 1
292 . 1 . 1 67 67 PRO C C 13 176.5964039 0 . 1 . . . . . 67 PRO C . 51780 1
293 . 1 . 1 67 67 PRO CA C 13 63.3495476 0 . 1 . . . . . 67 PRO CA . 51780 1
294 . 1 . 1 67 67 PRO CB C 13 31.85071392 0 . 1 . . . . . 67 PRO CB . 51780 1
295 . 1 . 1 68 68 ASP H H 1 8.194886206 0.002566122268 . 1 . . . . . 68 ASP H . 51780 1
296 . 1 . 1 68 68 ASP C C 13 176.3235114 0 . 1 . . . . . 68 ASP C . 51780 1
297 . 1 . 1 68 68 ASP CA C 13 54.22714853 0 . 1 . . . . . 68 ASP CA . 51780 1
298 . 1 . 1 68 68 ASP CB C 13 40.86614877 0 . 1 . . . . . 68 ASP CB . 51780 1
299 . 1 . 1 68 68 ASP N N 15 119.6503952 0.004574612771 . 1 . . . . . 68 ASP N . 51780 1
300 . 1 . 1 69 69 SER H H 1 8.117973352 0.002209328254 . 1 . . . . . 69 SER H . 51780 1
301 . 1 . 1 69 69 SER C C 13 174.9678803 0 . 1 . . . . . 69 SER C . 51780 1
302 . 1 . 1 69 69 SER CA C 13 58.57281924 0 . 1 . . . . . 69 SER CA . 51780 1
303 . 1 . 1 69 69 SER CB C 13 63.4683704 0 . 1 . . . . . 69 SER CB . 51780 1
304 . 1 . 1 69 69 SER N N 15 116.7934388 0.004612501017 . 1 . . . . . 69 SER N . 51780 1
305 . 1 . 1 70 70 SER H H 1 8.298810771 0.0001079276694 . 1 . . . . . 70 SER H . 51780 1
306 . 1 . 1 70 70 SER C C 13 174.8358957 0 . 1 . . . . . 70 SER C . 51780 1
307 . 1 . 1 70 70 SER CA C 13 58.91512384 0 . 1 . . . . . 70 SER CA . 51780 1
308 . 1 . 1 70 70 SER CB C 13 63.61959808 0 . 1 . . . . . 70 SER CB . 51780 1
309 . 1 . 1 70 70 SER N N 15 117.8856638 0.01287901619 . 1 . . . . . 70 SER N . 51780 1
310 . 1 . 1 71 71 THR H H 1 7.888422281 0.0007525394098 . 1 . . . . . 71 THR H . 51780 1
311 . 1 . 1 71 71 THR C C 13 174.345491 0 . 1 . . . . . 71 THR C . 51780 1
312 . 1 . 1 71 71 THR CA C 13 61.59133955 0 . 1 . . . . . 71 THR CA . 51780 1
313 . 1 . 1 71 71 THR CB C 13 69.3276106 0 . 1 . . . . . 71 THR CB . 51780 1
314 . 1 . 1 71 71 THR N N 15 114.3429649 0.004534259556 . 1 . . . . . 71 THR N . 51780 1
315 . 1 . 1 72 72 SER H H 1 7.96900763 0.00132749637 . 1 . . . . . 72 SER H . 51780 1
316 . 1 . 1 72 72 SER C C 13 172.4952493 0 . 1 . . . . . 72 SER C . 51780 1
317 . 1 . 1 72 72 SER CA C 13 56.41840008 0 . 1 . . . . . 72 SER CA . 51780 1
318 . 1 . 1 72 72 SER CB C 13 62.94584046 0 . 1 . . . . . 72 SER CB . 51780 1
319 . 1 . 1 72 72 SER N N 15 119.2418961 0.001262113647 . 1 . . . . . 72 SER N . 51780 1
320 . 1 . 1 73 73 PRO C C 13 176.9968919 0 . 1 . . . . . 73 PRO C . 51780 1
321 . 1 . 1 73 73 PRO CA C 13 63.15611182 0 . 1 . . . . . 73 PRO CA . 51780 1
322 . 1 . 1 73 73 PRO CB C 13 31.51012429 0 . 1 . . . . . 73 PRO CB . 51780 1
323 . 1 . 1 74 74 LYS H H 1 8.296095861 0.0005689117437 . 1 . . . . . 74 LYS H . 51780 1
324 . 1 . 1 74 74 LYS C C 13 177.1247077 0 . 1 . . . . . 74 LYS C . 51780 1
325 . 1 . 1 74 74 LYS CA C 13 56.3099784 0 . 1 . . . . . 74 LYS CA . 51780 1
326 . 1 . 1 74 74 LYS CB C 13 32.57767285 0 . 1 . . . . . 74 LYS CB . 51780 1
327 . 1 . 1 74 74 LYS N N 15 121.4848966 0.0000834 . 1 . . . . . 74 LYS N . 51780 1
328 . 1 . 1 75 75 GLY H H 1 8.210580302 0.00103034833 . 1 . . . . . 75 GLY H . 51780 1
329 . 1 . 1 75 75 GLY C C 13 173.6493124 0 . 1 . . . . . 75 GLY C . 51780 1
330 . 1 . 1 75 75 GLY CA C 13 44.76528953 0 . 1 . . . . . 75 GLY CA . 51780 1
331 . 1 . 1 75 75 GLY N N 15 109.6208806 0.01758295355 . 1 . . . . . 75 GLY N . 51780 1
332 . 1 . 1 76 76 LYS H H 1 8.032461655 0.002042741644 . 1 . . . . . 76 LYS H . 51780 1
333 . 1 . 1 76 76 LYS C C 13 176.3992425 0 . 1 . . . . . 76 LYS C . 51780 1
334 . 1 . 1 76 76 LYS CA C 13 55.91134987 0 . 1 . . . . . 76 LYS CA . 51780 1
335 . 1 . 1 76 76 LYS CB C 13 32.80557451 0 . 1 . . . . . 76 LYS CB . 51780 1
336 . 1 . 1 76 76 LYS N N 15 120.8140974 0.005487832986 . 1 . . . . . 76 LYS N . 51780 1
337 . 1 . 1 77 77 GLN H H 1 8.379111289 0.0009317168832 . 1 . . . . . 77 GLN H . 51780 1
338 . 1 . 1 77 77 GLN C C 13 173.941113 0 . 1 . . . . . 77 GLN C . 51780 1
339 . 1 . 1 77 77 GLN CA C 13 53.48196732 0 . 1 . . . . . 77 GLN CA . 51780 1
340 . 1 . 1 77 77 GLN CB C 13 28.52013056 0 . 1 . . . . . 77 GLN CB . 51780 1
341 . 1 . 1 77 77 GLN N N 15 123.5132173 0.002313591091 . 1 . . . . . 77 GLN N . 51780 1
342 . 1 . 1 78 78 PRO C C 13 176.9248178 0 . 1 . . . . . 78 PRO C . 51780 1
343 . 1 . 1 78 78 PRO CA C 13 62.90537168 0 . 1 . . . . . 78 PRO CA . 51780 1
344 . 1 . 1 78 78 PRO CB C 13 31.89473107 0 . 1 . . . . . 78 PRO CB . 51780 1
345 . 1 . 1 79 79 THR H H 1 8.223048351 0.001354929791 . 1 . . . . . 79 THR H . 51780 1
346 . 1 . 1 79 79 THR C C 13 174.5475926 0 . 1 . . . . . 79 THR C . 51780 1
347 . 1 . 1 79 79 THR CA C 13 61.56856073 0 . 1 . . . . . 79 THR CA . 51780 1
348 . 1 . 1 79 79 THR CB C 13 69.77509462 0 . 1 . . . . . 79 THR CB . 51780 1
349 . 1 . 1 79 79 THR N N 15 114.7449144 0.005489444964 . 1 . . . . . 79 THR N . 51780 1
350 . 1 . 1 80 80 SER H H 1 8.236263621 0.001051428225 . 1 . . . . . 80 SER H . 51780 1
351 . 1 . 1 80 80 SER C C 13 174.2147927 0 . 1 . . . . . 80 SER C . 51780 1
352 . 1 . 1 80 80 SER CA C 13 58.59945028 0 . 1 . . . . . 80 SER CA . 51780 1
353 . 1 . 1 80 80 SER CB C 13 63.44598206 0 . 1 . . . . . 80 SER CB . 51780 1
354 . 1 . 1 80 80 SER N N 15 117.8306434 0.002844122881 . 1 . . . . . 80 SER N . 51780 1
355 . 1 . 1 81 81 ALA H H 1 8.232485163 0.004083669228 . 1 . . . . . 81 ALA H . 51780 1
356 . 1 . 1 81 81 ALA C C 13 177.6864347 0 . 1 . . . . . 81 ALA C . 51780 1
357 . 1 . 1 81 81 ALA CA C 13 52.52452787 0 . 1 . . . . . 81 ALA CA . 51780 1
358 . 1 . 1 81 81 ALA CB C 13 18.90332202 0 . 1 . . . . . 81 ALA CB . 51780 1
359 . 1 . 1 81 81 ALA N N 15 125.8582044 0 . 1 . . . . . 81 ALA N . 51780 1
360 . 1 . 1 82 82 GLU H H 1 8.120647763 0.001892156492 . 1 . . . . . 82 GLU H . 51780 1
361 . 1 . 1 82 82 GLU C C 13 176.3565929 0 . 1 . . . . . 82 GLU C . 51780 1
362 . 1 . 1 82 82 GLU CA C 13 56.4727427 0 . 1 . . . . . 82 GLU CA . 51780 1
363 . 1 . 1 82 82 GLU CB C 13 29.90964351 0 . 1 . . . . . 82 GLU CB . 51780 1
364 . 1 . 1 82 82 GLU N N 15 120.0280174 0.003761991703 . 1 . . . . . 82 GLU N . 51780 1
365 . 1 . 1 83 83 LYS H H 1 8.153779555 0.0008422108213 . 1 . . . . . 83 LYS H . 51780 1
366 . 1 . 1 83 83 LYS C C 13 176.311598 0 . 1 . . . . . 83 LYS C . 51780 1
367 . 1 . 1 83 83 LYS CA C 13 55.96613333 0 . 1 . . . . . 83 LYS CA . 51780 1
368 . 1 . 1 83 83 LYS CB C 13 32.72775912 0 . 1 . . . . . 83 LYS CB . 51780 1
369 . 1 . 1 83 83 LYS N N 15 122.3556631 0.004095537447 . 1 . . . . . 83 LYS N . 51780 1
370 . 1 . 1 84 84 SER H H 1 8.218985741 0.001347179081 . 1 . . . . . 84 SER H . 51780 1
371 . 1 . 1 84 84 SER C C 13 174.2173351 0 . 1 . . . . . 84 SER C . 51780 1
372 . 1 . 1 84 84 SER CA C 13 58.12092224 0 . 1 . . . . . 84 SER CA . 51780 1
373 . 1 . 1 84 84 SER CB C 13 63.57563282 0 . 1 . . . . . 84 SER CB . 51780 1
374 . 1 . 1 84 84 SER N N 15 117.7521316 0.006285335701 . 1 . . . . . 84 SER N . 51780 1
375 . 1 . 1 85 85 VAL H H 1 8.022262643 0.0009537927435 . 1 . . . . . 85 VAL H . 51780 1
376 . 1 . 1 85 85 VAL C C 13 174.8523799 0 . 1 . . . . . 85 VAL C . 51780 1
377 . 1 . 1 85 85 VAL CA C 13 61.82699354 0 . 1 . . . . . 85 VAL CA . 51780 1
378 . 1 . 1 85 85 VAL CB C 13 32.58900735 0 . 1 . . . . . 85 VAL CB . 51780 1
379 . 1 . 1 85 85 VAL N N 15 121.7082923 0.001246029418 . 1 . . . . . 85 VAL N . 51780 1
380 . 1 . 1 86 86 ALA H H 1 7.824897475 0.0004764120099 . 1 . . . . . 86 ALA H . 51780 1
381 . 1 . 1 86 86 ALA CA C 13 53.76627289 0 . 1 . . . . . 86 ALA CA . 51780 1
382 . 1 . 1 86 86 ALA CB C 13 19.80318386 0 . 1 . . . . . 86 ALA CB . 51780 1
383 . 1 . 1 86 86 ALA N N 15 132.894036 0.002894354887 . 1 . . . . . 86 ALA N . 51780 1
stop_
save_