Content for NMR-STAR saveframe, "assigned_chemical_shifts_2"
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 50213
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name Tim8_60C
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2
_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
8 '2D 1H-15N BEST-TROSY HSQC' . . . 50213 2
9 '3D BEST-TROSY HNCO' . . . 50213 2
10 '3D BEST-TROSY HNCA' . . . 50213 2
11 '3D BEST-TROSY HN(CO)CA' . . . 50213 2
12 '3D BEST-TROSY HN(COCA)CB' . . . 50213 2
13 '3D BEST-TROSY HN(CA)CO' . . . 50213 2
14 '3D BEST-TROSY HN(CA)CB' . . . 50213 2
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 . . 50213 2
2 $software_2 . . 50213 2
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 8 8 ASP H H 1 8.068 0.000 . 1 . . . . . 808 ASP H . 50213 2
2 . 1 . 1 8 8 ASP C C 13 176.380 0.000 . 1 . . . . . 808 ASP C . 50213 2
3 . 1 . 1 8 8 ASP CA C 13 54.493 0.000 . 1 . . . . . 808 ASP CA . 50213 2
4 . 1 . 1 8 8 ASP CB C 13 40.619 0.000 . 1 . . . . . 808 ASP CB . 50213 2
5 . 1 . 1 8 8 ASP N N 15 122.220 0.000 . 1 . . . . . 808 ASP N . 50213 2
6 . 1 . 1 9 9 LEU H H 1 7.846 0.000 . 1 . . . . . 809 LEU H . 50213 2
7 . 1 . 1 9 9 LEU C C 13 177.306 0.000 . 1 . . . . . 809 LEU C . 50213 2
8 . 1 . 1 9 9 LEU CA C 13 55.384 0.000 . 1 . . . . . 809 LEU CA . 50213 2
9 . 1 . 1 9 9 LEU CB C 13 41.218 0.000 . 1 . . . . . 809 LEU CB . 50213 2
10 . 1 . 1 9 9 LEU N N 15 121.709 0.000 . 1 . . . . . 809 LEU N . 50213 2
11 . 1 . 1 10 10 ALA H H 1 7.896 0.000 . 1 . . . . . 810 ALA H . 50213 2
12 . 1 . 1 10 10 ALA C C 13 177.801 0.000 . 1 . . . . . 810 ALA C . 50213 2
13 . 1 . 1 10 10 ALA CA C 13 52.597 0.000 . 1 . . . . . 810 ALA CA . 50213 2
14 . 1 . 1 10 10 ALA CB C 13 18.330 0.000 . 1 . . . . . 810 ALA CB . 50213 2
15 . 1 . 1 10 10 ALA N N 15 123.019 0.000 . 1 . . . . . 810 ALA N . 50213 2
16 . 1 . 1 11 11 SER H H 1 7.826 0.000 . 1 . . . . . 811 SER H . 50213 2
17 . 1 . 1 11 11 SER CA C 13 57.994 0.000 . 1 . . . . . 811 SER CA . 50213 2
18 . 1 . 1 11 11 SER CB C 13 63.236 0.000 . 1 . . . . . 811 SER CB . 50213 2
19 . 1 . 1 11 11 SER N N 15 113.716 0.000 . 1 . . . . . 811 SER N . 50213 2
20 . 1 . 1 12 12 LEU H H 1 7.823 0.000 . 1 . . . . . 812 LEU H . 50213 2
21 . 1 . 1 12 12 LEU C C 13 176.902 0.000 . 1 . . . . . 812 LEU C . 50213 2
22 . 1 . 1 12 12 LEU CA C 13 55.033 0.000 . 1 . . . . . 812 LEU CA . 50213 2
23 . 1 . 1 12 12 LEU CB C 13 41.560 0.000 . 1 . . . . . 812 LEU CB . 50213 2
24 . 1 . 1 12 12 LEU N N 15 123.408 0.000 . 1 . . . . . 812 LEU N . 50213 2
25 . 1 . 1 13 13 ASP H H 1 7.983 0.000 . 1 . . . . . 813 ASP H . 50213 2
26 . 1 . 1 13 13 ASP C C 13 176.065 0.000 . 1 . . . . . 813 ASP C . 50213 2
27 . 1 . 1 13 13 ASP CA C 13 53.946 0.000 . 1 . . . . . 813 ASP CA . 50213 2
28 . 1 . 1 13 13 ASP CB C 13 40.920 0.000 . 1 . . . . . 813 ASP CB . 50213 2
29 . 1 . 1 13 13 ASP N N 15 120.435 0.000 . 1 . . . . . 813 ASP N . 50213 2
30 . 1 . 1 14 14 ASP H H 1 8.121 0.000 . 1 . . . . . 814 ASP H . 50213 2
31 . 1 . 1 14 14 ASP C C 13 177.366 0.000 . 1 . . . . . 814 ASP C . 50213 2
32 . 1 . 1 14 14 ASP CA C 13 55.000 0.000 . 1 . . . . . 814 ASP CA . 50213 2
33 . 1 . 1 14 14 ASP CB C 13 29.321 0.000 . 1 . . . . . 814 ASP CB . 50213 2
34 . 1 . 1 14 14 ASP N N 15 120.739 0.000 . 1 . . . . . 814 ASP N . 50213 2
35 . 1 . 1 15 15 THR H H 1 8.093 0.000 . 1 . . . . . 815 THR H . 50213 2
36 . 1 . 1 15 15 THR C C 13 175.692 0.000 . 1 . . . . . 815 THR C . 50213 2
37 . 1 . 1 15 15 THR CA C 13 63.440 0.000 . 1 . . . . . 815 THR CA . 50213 2
38 . 1 . 1 15 15 THR CB C 13 68.711 0.000 . 1 . . . . . 815 THR CB . 50213 2
39 . 1 . 1 15 15 THR N N 15 114.664 0.000 . 1 . . . . . 815 THR N . 50213 2
40 . 1 . 1 16 16 SER H H 1 8.164 0.000 . 1 . . . . . 816 SER H . 50213 2
41 . 1 . 1 16 16 SER C C 13 174.998 0.000 . 1 . . . . . 816 SER C . 50213 2
42 . 1 . 1 16 16 SER CA C 13 59.697 0.000 . 1 . . . . . 816 SER CA . 50213 2
43 . 1 . 1 16 16 SER CB C 13 62.944 0.000 . 1 . . . . . 816 SER CB . 50213 2
44 . 1 . 1 16 16 SER N N 15 118.120 0.000 . 1 . . . . . 816 SER N . 50213 2
45 . 1 . 1 17 17 LYS H H 1 7.865 0.000 . 1 . . . . . 817 LYS H . 50213 2
46 . 1 . 1 17 17 LYS N N 15 122.054 0.000 . 1 . . . . . 817 LYS N . 50213 2
47 . 1 . 1 19 19 GLU H H 1 8.085 0.000 . 1 . . . . . 819 GLU H . 50213 2
48 . 1 . 1 19 19 GLU C C 13 177.162 0.000 . 1 . . . . . 819 GLU C . 50213 2
49 . 1 . 1 19 19 GLU CA C 13 56.909 0.000 . 1 . . . . . 819 GLU CA . 50213 2
50 . 1 . 1 19 19 GLU CB C 13 29.237 0.000 . 1 . . . . . 819 GLU CB . 50213 2
51 . 1 . 1 19 19 GLU N N 15 120.919 0.000 . 1 . . . . . 819 GLU N . 50213 2
52 . 1 . 1 20 20 ILE H H 1 7.837 0.000 . 1 . . . . . 820 ILE H . 50213 2
53 . 1 . 1 20 20 ILE C C 13 175.999 0.000 . 1 . . . . . 820 ILE C . 50213 2
54 . 1 . 1 20 20 ILE CA C 13 61.578 0.000 . 1 . . . . . 820 ILE CA . 50213 2
55 . 1 . 1 20 20 ILE CB C 13 37.602 0.000 . 1 . . . . . 820 ILE CB . 50213 2
56 . 1 . 1 20 20 ILE N N 15 120.263 0.000 . 1 . . . . . 820 ILE N . 50213 2
57 . 1 . 1 21 21 ALA H H 1 7.973 0.000 . 1 . . . . . 821 ALA H . 50213 2
58 . 1 . 1 21 21 ALA C C 13 178.147 0.000 . 1 . . . . . 821 ALA C . 50213 2
59 . 1 . 1 21 21 ALA CA C 13 52.664 0.000 . 1 . . . . . 821 ALA CA . 50213 2
60 . 1 . 1 21 21 ALA CB C 13 18.194 0.000 . 1 . . . . . 821 ALA CB . 50213 2
61 . 1 . 1 21 21 ALA N N 15 125.438 0.000 . 1 . . . . . 821 ALA N . 50213 2
62 . 1 . 1 22 22 THR H H 1 7.792 0.000 . 1 . . . . . 822 THR H . 50213 2
63 . 1 . 1 22 22 THR C C 13 174.988 0.000 . 1 . . . . . 822 THR C . 50213 2
64 . 1 . 1 22 22 THR CA C 13 62.745 0.000 . 1 . . . . . 822 THR CA . 50213 2
65 . 1 . 1 22 22 THR CB C 13 69.147 0.000 . 1 . . . . . 822 THR CB . 50213 2
66 . 1 . 1 22 22 THR N N 15 112.462 0.000 . 1 . . . . . 822 THR N . 50213 2
67 . 1 . 1 23 23 PHE H H 1 7.838 0.000 . 1 . . . . . 823 PHE H . 50213 2
68 . 1 . 1 23 23 PHE C C 13 175.808 0.000 . 1 . . . . . 823 PHE C . 50213 2
69 . 1 . 1 23 23 PHE CA C 13 58.295 0.000 . 1 . . . . . 823 PHE CA . 50213 2
70 . 1 . 1 23 23 PHE N N 15 121.442 0.000 . 1 . . . . . 823 PHE N . 50213 2
71 . 1 . 1 24 24 LEU H H 1 7.905 0.000 . 1 . . . . . 824 LEU H . 50213 2
72 . 1 . 1 24 24 LEU CA C 13 55.245 0.000 . 1 . . . . . 824 LEU CA . 50213 2
73 . 1 . 1 24 24 LEU CB C 13 41.397 0.000 . 1 . . . . . 824 LEU CB . 50213 2
74 . 1 . 1 24 24 LEU N N 15 121.111 0.000 . 1 . . . . . 824 LEU N . 50213 2
75 . 1 . 1 25 25 GLU H H 1 7.872 0.000 . 1 . . . . . 825 GLU H . 50213 2
76 . 1 . 1 25 25 GLU C C 13 177.085 0.000 . 1 . . . . . 825 GLU C . 50213 2
77 . 1 . 1 25 25 GLU CA C 13 56.702 0.000 . 1 . . . . . 825 GLU CA . 50213 2
78 . 1 . 1 25 25 GLU CB C 13 29.608 0.000 . 1 . . . . . 825 GLU CB . 50213 2
79 . 1 . 1 25 25 GLU N N 15 120.124 0.000 . 1 . . . . . 825 GLU N . 50213 2
80 . 1 . 1 26 26 GLY H H 1 8.001 0.000 . 1 . . . . . 826 GLY H . 50213 2
81 . 1 . 1 26 26 GLY C C 13 174.580 0.000 . 1 . . . . . 826 GLY C . 50213 2
82 . 1 . 1 26 26 GLY CA C 13 45.212 0.000 . 1 . . . . . 826 GLY CA . 50213 2
83 . 1 . 1 26 26 GLY N N 15 108.826 0.000 . 1 . . . . . 826 GLY N . 50213 2
84 . 1 . 1 27 27 GLU H H 1 8.164 0.000 . 1 . . . . . 827 GLU H . 50213 2
85 . 1 . 1 27 27 GLU C C 13 176.899 0.000 . 1 . . . . . 827 GLU C . 50213 2
86 . 1 . 1 27 27 GLU CA C 13 57.040 0.000 . 1 . . . . . 827 GLU CA . 50213 2
87 . 1 . 1 27 27 GLU CB C 13 29.206 0.000 . 1 . . . . . 827 GLU CB . 50213 2
88 . 1 . 1 27 27 GLU N N 15 121.262 0.000 . 1 . . . . . 827 GLU N . 50213 2
89 . 1 . 1 31 31 GLN H H 1 7.529 0.000 . 1 . . . . . 831 GLN H . 50213 2
90 . 1 . 1 31 31 GLN C C 13 180.869 0.000 . 1 . . . . . 831 GLN C . 50213 2
91 . 1 . 1 31 31 GLN CA C 13 55.054 0.000 . 1 . . . . . 831 GLN CA . 50213 2
92 . 1 . 1 31 31 GLN CB C 13 17.642 0.000 . 1 . . . . . 831 GLN CB . 50213 2
93 . 1 . 1 31 31 GLN N N 15 120.772 0.000 . 1 . . . . . 831 GLN N . 50213 2
94 . 1 . 1 32 32 LYS H H 1 8.794 0.000 . 1 . . . . . 832 LYS H . 50213 2
95 . 1 . 1 32 32 LYS C C 13 180.317 0.000 . 1 . . . . . 832 LYS C . 50213 2
96 . 1 . 1 32 32 LYS CA C 13 60.489 0.000 . 1 . . . . . 832 LYS CA . 50213 2
97 . 1 . 1 32 32 LYS CB C 13 32.609 0.000 . 1 . . . . . 832 LYS CB . 50213 2
98 . 1 . 1 32 32 LYS N N 15 119.516 0.000 . 1 . . . . . 832 LYS N . 50213 2
99 . 1 . 1 33 33 VAL H H 1 9.563 0.000 . 1 . . . . . 833 VAL H . 50213 2
100 . 1 . 1 33 33 VAL C C 13 178.302 0.000 . 1 . . . . . 833 VAL C . 50213 2
101 . 1 . 1 33 33 VAL CA C 13 62.175 0.000 . 1 . . . . . 833 VAL CA . 50213 2
102 . 1 . 1 33 33 VAL CB C 13 37.423 0.000 . 1 . . . . . 833 VAL CB . 50213 2
103 . 1 . 1 33 33 VAL N N 15 126.519 0.000 . 1 . . . . . 833 VAL N . 50213 2
104 . 1 . 1 34 34 GLN H H 1 8.615 0.000 . 1 . . . . . 834 GLN H . 50213 2
105 . 1 . 1 34 34 GLN C C 13 180.084 0.000 . 1 . . . . . 834 GLN C . 50213 2
106 . 1 . 1 34 34 GLN N N 15 118.123 0.000 . 1 . . . . . 834 GLN N . 50213 2
107 . 1 . 1 38 38 HIS H H 1 8.076 0.000 . 1 . . . . . 838 HIS H . 50213 2
108 . 1 . 1 38 38 HIS C C 13 178.269 0.000 . 1 . . . . . 838 HIS C . 50213 2
109 . 1 . 1 38 38 HIS CA C 13 59.450 0.000 . 1 . . . . . 838 HIS CA . 50213 2
110 . 1 . 1 38 38 HIS CB C 13 30.153 0.000 . 1 . . . . . 838 HIS CB . 50213 2
111 . 1 . 1 38 38 HIS N N 15 121.401 0.000 . 1 . . . . . 838 HIS N . 50213 2
112 . 1 . 1 39 39 GLN H H 1 7.648 0.000 . 1 . . . . . 839 GLN H . 50213 2
113 . 1 . 1 39 39 GLN C C 13 178.670 0.000 . 1 . . . . . 839 GLN C . 50213 2
114 . 1 . 1 39 39 GLN CA C 13 58.365 0.000 . 1 . . . . . 839 GLN CA . 50213 2
115 . 1 . 1 39 39 GLN CB C 13 27.034 0.000 . 1 . . . . . 839 GLN CB . 50213 2
116 . 1 . 1 39 39 GLN N N 15 120.510 0.000 . 1 . . . . . 839 GLN N . 50213 2
117 . 1 . 1 40 40 PHE H H 1 8.050 0.000 . 1 . . . . . 840 PHE H . 50213 2
118 . 1 . 1 40 40 PHE C C 13 178.180 0.000 . 1 . . . . . 840 PHE C . 50213 2
119 . 1 . 1 40 40 PHE CB C 13 37.761 0.000 . 1 . . . . . 840 PHE CB . 50213 2
120 . 1 . 1 40 40 PHE N N 15 117.234 0.000 . 1 . . . . . 840 PHE N . 50213 2
121 . 1 . 1 41 41 THR H H 1 8.378 0.000 . 1 . . . . . 841 THR H . 50213 2
122 . 1 . 1 41 41 THR C C 13 175.108 0.000 . 1 . . . . . 841 THR C . 50213 2
123 . 1 . 1 41 41 THR CA C 13 67.491 0.000 . 1 . . . . . 841 THR CA . 50213 2
124 . 1 . 1 41 41 THR CB C 13 66.953 0.000 . 1 . . . . . 841 THR CB . 50213 2
125 . 1 . 1 41 41 THR N N 15 117.225 0.000 . 1 . . . . . 841 THR N . 50213 2
126 . 1 . 1 42 42 ASN H H 1 7.579 0.000 . 1 . . . . . 842 ASN H . 50213 2
127 . 1 . 1 42 42 ASN C C 13 176.753 0.000 . 1 . . . . . 842 ASN C . 50213 2
128 . 1 . 1 42 42 ASN CA C 13 57.055 0.000 . 1 . . . . . 842 ASN CA . 50213 2
129 . 1 . 1 42 42 ASN CB C 13 38.599 0.000 . 1 . . . . . 842 ASN CB . 50213 2
130 . 1 . 1 42 42 ASN N N 15 119.185 0.000 . 1 . . . . . 842 ASN N . 50213 2
131 . 1 . 1 43 43 ILE H H 1 7.455 0.000 . 1 . . . . . 843 ILE H . 50213 2
132 . 1 . 1 43 43 ILE C C 13 178.116 0.000 . 1 . . . . . 843 ILE C . 50213 2
133 . 1 . 1 43 43 ILE CA C 13 64.126 0.000 . 1 . . . . . 843 ILE CA . 50213 2
134 . 1 . 1 43 43 ILE CB C 13 38.074 0.000 . 1 . . . . . 843 ILE CB . 50213 2
135 . 1 . 1 43 43 ILE N N 15 116.474 0.000 . 1 . . . . . 843 ILE N . 50213 2
136 . 1 . 1 44 44 CYS H H 1 8.201 0.000 . 1 . . . . . 844 CYS H . 50213 2
137 . 1 . 1 44 44 CYS C C 13 176.916 0.000 . 1 . . . . . 844 CYS C . 50213 2
138 . 1 . 1 44 44 CYS CA C 13 56.928 0.000 . 1 . . . . . 844 CYS CA . 50213 2
139 . 1 . 1 44 44 CYS CB C 13 40.414 0.000 . 1 . . . . . 844 CYS CB . 50213 2
140 . 1 . 1 44 44 CYS N N 15 116.085 0.000 . 1 . . . . . 844 CYS N . 50213 2
141 . 1 . 1 45 45 PHE H H 1 9.258 0.000 . 1 . . . . . 845 PHE H . 50213 2
142 . 1 . 1 45 45 PHE C C 13 176.760 0.000 . 1 . . . . . 845 PHE C . 50213 2
143 . 1 . 1 45 45 PHE CA C 13 62.540 0.000 . 1 . . . . . 845 PHE CA . 50213 2
144 . 1 . 1 45 45 PHE CB C 13 39.186 0.000 . 1 . . . . . 845 PHE CB . 50213 2
145 . 1 . 1 45 45 PHE N N 15 123.635 0.000 . 1 . . . . . 845 PHE N . 50213 2
146 . 1 . 1 46 46 LYS H H 1 7.400 0.000 . 1 . . . . . 846 LYS H . 50213 2
147 . 1 . 1 46 46 LYS C C 13 178.774 0.000 . 1 . . . . . 846 LYS C . 50213 2
148 . 1 . 1 46 46 LYS CA C 13 59.462 0.000 . 1 . . . . . 846 LYS CA . 50213 2
149 . 1 . 1 46 46 LYS CB C 13 31.789 0.000 . 1 . . . . . 846 LYS CB . 50213 2
150 . 1 . 1 46 46 LYS N N 15 115.416 0.000 . 1 . . . . . 846 LYS N . 50213 2
151 . 1 . 1 47 47 LYS H H 1 7.290 0.000 . 1 . . . . . 847 LYS H . 50213 2
152 . 1 . 1 47 47 LYS C C 13 178.786 0.000 . 1 . . . . . 847 LYS C . 50213 2
153 . 1 . 1 47 47 LYS CA C 13 56.115 0.000 . 1 . . . . . 847 LYS CA . 50213 2
154 . 1 . 1 47 47 LYS CB C 13 32.977 0.000 . 1 . . . . . 847 LYS CB . 50213 2
155 . 1 . 1 47 47 LYS N N 15 113.576 0.000 . 1 . . . . . 847 LYS N . 50213 2
156 . 1 . 1 48 48 CYS H H 1 7.975 0.000 . 1 . . . . . 848 CYS H . 50213 2
157 . 1 . 1 48 48 CYS C C 13 174.348 0.000 . 1 . . . . . 848 CYS C . 50213 2
158 . 1 . 1 48 48 CYS CA C 13 55.113 0.000 . 1 . . . . . 848 CYS CA . 50213 2
159 . 1 . 1 48 48 CYS CB C 13 39.996 0.000 . 1 . . . . . 848 CYS CB . 50213 2
160 . 1 . 1 48 48 CYS N N 15 113.552 0.000 . 1 . . . . . 848 CYS N . 50213 2
161 . 1 . 1 49 49 VAL H H 1 7.676 0.000 . 1 . . . . . 849 VAL H . 50213 2
162 . 1 . 1 49 49 VAL C C 13 174.514 0.000 . 1 . . . . . 849 VAL C . 50213 2
163 . 1 . 1 49 49 VAL CA C 13 61.964 0.000 . 1 . . . . . 849 VAL CA . 50213 2
164 . 1 . 1 49 49 VAL CB C 13 29.374 0.000 . 1 . . . . . 849 VAL CB . 50213 2
165 . 1 . 1 49 49 VAL N N 15 121.361 0.000 . 1 . . . . . 849 VAL N . 50213 2
166 . 1 . 1 50 50 GLU H H 1 8.890 0.000 . 1 . . . . . 850 GLU H . 50213 2
167 . 1 . 1 50 50 GLU C C 13 176.713 0.000 . 1 . . . . . 850 GLU C . 50213 2
168 . 1 . 1 50 50 GLU CA C 13 57.014 0.000 . 1 . . . . . 850 GLU CA . 50213 2
169 . 1 . 1 50 50 GLU CB C 13 30.114 0.000 . 1 . . . . . 850 GLU CB . 50213 2
170 . 1 . 1 50 50 GLU N N 15 127.712 0.000 . 1 . . . . . 850 GLU N . 50213 2
171 . 1 . 1 51 51 SER H H 1 7.724 0.000 . 1 . . . . . 851 SER H . 50213 2
172 . 1 . 1 51 51 SER C C 13 173.564 0.000 . 1 . . . . . 851 SER C . 50213 2
173 . 1 . 1 51 51 SER CA C 13 56.316 0.000 . 1 . . . . . 851 SER CA . 50213 2
174 . 1 . 1 51 51 SER CB C 13 64.475 0.000 . 1 . . . . . 851 SER CB . 50213 2
175 . 1 . 1 51 51 SER N N 15 112.213 0.000 . 1 . . . . . 851 SER N . 50213 2
176 . 1 . 1 52 52 VAL H H 1 8.635 0.000 . 1 . . . . . 852 VAL H . 50213 2
177 . 1 . 1 52 52 VAL C C 13 173.688 0.000 . 1 . . . . . 852 VAL C . 50213 2
178 . 1 . 1 52 52 VAL CA C 13 60.936 0.000 . 1 . . . . . 852 VAL CA . 50213 2
179 . 1 . 1 52 52 VAL CB C 13 30.561 0.000 . 1 . . . . . 852 VAL CB . 50213 2
180 . 1 . 1 52 52 VAL N N 15 120.634 0.000 . 1 . . . . . 852 VAL N . 50213 2
181 . 1 . 1 53 53 ASN H H 1 7.803 0.000 . 1 . . . . . 853 ASN H . 50213 2
182 . 1 . 1 53 53 ASN C C 13 173.507 0.000 . 1 . . . . . 853 ASN C . 50213 2
183 . 1 . 1 53 53 ASN CA C 13 50.872 0.000 . 1 . . . . . 853 ASN CA . 50213 2
184 . 1 . 1 53 53 ASN CB C 13 39.988 0.000 . 1 . . . . . 853 ASN CB . 50213 2
185 . 1 . 1 53 53 ASN N N 15 118.222 0.000 . 1 . . . . . 853 ASN N . 50213 2
186 . 1 . 1 54 54 ASP H H 1 7.668 0.000 . 1 . . . . . 854 ASP H . 50213 2
187 . 1 . 1 54 54 ASP C C 13 174.586 0.000 . 1 . . . . . 854 ASP C . 50213 2
188 . 1 . 1 54 54 ASP CA C 13 52.819 0.000 . 1 . . . . . 854 ASP CA . 50213 2
189 . 1 . 1 54 54 ASP CB C 13 42.178 0.000 . 1 . . . . . 854 ASP CB . 50213 2
190 . 1 . 1 54 54 ASP N N 15 117.607 0.000 . 1 . . . . . 854 ASP N . 50213 2
191 . 1 . 1 55 55 SER H H 1 8.090 0.000 . 1 . . . . . 855 SER H . 50213 2
192 . 1 . 1 55 55 SER C C 13 173.784 0.000 . 1 . . . . . 855 SER C . 50213 2
193 . 1 . 1 55 55 SER CA C 13 58.584 0.000 . 1 . . . . . 855 SER CA . 50213 2
194 . 1 . 1 55 55 SER CB C 13 63.632 0.000 . 1 . . . . . 855 SER CB . 50213 2
195 . 1 . 1 55 55 SER N N 15 113.497 0.000 . 1 . . . . . 855 SER N . 50213 2
196 . 1 . 1 56 56 ASN H H 1 7.844 0.000 . 1 . . . . . 856 ASN H . 50213 2
197 . 1 . 1 56 56 ASN C C 13 175.012 0.000 . 1 . . . . . 856 ASN C . 50213 2
198 . 1 . 1 56 56 ASN CA C 13 52.141 0.000 . 1 . . . . . 856 ASN CA . 50213 2
199 . 1 . 1 56 56 ASN CB C 13 39.790 0.000 . 1 . . . . . 856 ASN CB . 50213 2
200 . 1 . 1 56 56 ASN N N 15 118.544 0.000 . 1 . . . . . 856 ASN N . 50213 2
201 . 1 . 1 57 57 LEU H H 1 8.168 0.000 . 1 . . . . . 857 LEU H . 50213 2
202 . 1 . 1 57 57 LEU C C 13 177.758 0.000 . 1 . . . . . 857 LEU C . 50213 2
203 . 1 . 1 57 57 LEU CA C 13 53.499 0.000 . 1 . . . . . 857 LEU CA . 50213 2
204 . 1 . 1 57 57 LEU CB C 13 42.579 0.000 . 1 . . . . . 857 LEU CB . 50213 2
205 . 1 . 1 57 57 LEU N N 15 120.352 0.000 . 1 . . . . . 857 LEU N . 50213 2
206 . 1 . 1 58 58 SER H H 1 9.606 0.000 . 1 . . . . . 858 SER H . 50213 2
207 . 1 . 1 58 58 SER C C 13 175.522 0.000 . 1 . . . . . 858 SER C . 50213 2
208 . 1 . 1 58 58 SER CA C 13 56.576 0.000 . 1 . . . . . 858 SER CA . 50213 2
209 . 1 . 1 58 58 SER CB C 13 65.095 0.000 . 1 . . . . . 858 SER CB . 50213 2
210 . 1 . 1 58 58 SER N N 15 121.966 0.000 . 1 . . . . . 858 SER N . 50213 2
211 . 1 . 1 60 60 GLN H H 1 8.152 0.000 . 1 . . . . . 860 GLN H . 50213 2
212 . 1 . 1 60 60 GLN C C 13 179.216 0.000 . 1 . . . . . 860 GLN C . 50213 2
213 . 1 . 1 60 60 GLN CA C 13 59.099 0.000 . 1 . . . . . 860 GLN CA . 50213 2
214 . 1 . 1 60 60 GLN CB C 13 27.548 0.000 . 1 . . . . . 860 GLN CB . 50213 2
215 . 1 . 1 60 60 GLN N N 15 120.475 0.000 . 1 . . . . . 860 GLN N . 50213 2
216 . 1 . 1 61 61 GLU H H 1 7.876 0.000 . 1 . . . . . 861 GLU H . 50213 2
217 . 1 . 1 61 61 GLU C C 13 178.805 0.000 . 1 . . . . . 861 GLU C . 50213 2
218 . 1 . 1 61 61 GLU CA C 13 59.516 0.000 . 1 . . . . . 861 GLU CA . 50213 2
219 . 1 . 1 61 61 GLU CB C 13 29.926 0.000 . 1 . . . . . 861 GLU CB . 50213 2
220 . 1 . 1 61 61 GLU N N 15 121.561 0.000 . 1 . . . . . 861 GLU N . 50213 2
221 . 1 . 1 62 62 GLU H H 1 8.496 0.000 . 1 . . . . . 862 GLU H . 50213 2
222 . 1 . 1 62 62 GLU C C 13 178.617 0.000 . 1 . . . . . 862 GLU C . 50213 2
223 . 1 . 1 62 62 GLU CA C 13 60.588 0.000 . 1 . . . . . 862 GLU CA . 50213 2
224 . 1 . 1 62 62 GLU CB C 13 28.988 0.000 . 1 . . . . . 862 GLU CB . 50213 2
225 . 1 . 1 62 62 GLU N N 15 118.722 0.000 . 1 . . . . . 862 GLU N . 50213 2
226 . 1 . 1 63 63 GLN H H 1 8.083 0.000 . 1 . . . . . 863 GLN H . 50213 2
227 . 1 . 1 63 63 GLN C C 13 177.517 0.000 . 1 . . . . . 863 GLN C . 50213 2
228 . 1 . 1 63 63 GLN CA C 13 58.456 0.000 . 1 . . . . . 863 GLN CA . 50213 2
229 . 1 . 1 63 63 GLN CB C 13 28.103 0.000 . 1 . . . . . 863 GLN CB . 50213 2
230 . 1 . 1 63 63 GLN N N 15 118.280 0.000 . 1 . . . . . 863 GLN N . 50213 2
231 . 1 . 1 64 64 CYS H H 1 8.141 0.000 . 1 . . . . . 864 CYS H . 50213 2
232 . 1 . 1 64 64 CYS C C 13 176.436 0.000 . 1 . . . . . 864 CYS C . 50213 2
233 . 1 . 1 64 64 CYS CA C 13 60.081 0.000 . 1 . . . . . 864 CYS CA . 50213 2
234 . 1 . 1 64 64 CYS CB C 13 34.421 0.000 . 1 . . . . . 864 CYS CB . 50213 2
235 . 1 . 1 64 64 CYS N N 15 118.669 0.000 . 1 . . . . . 864 CYS N . 50213 2
236 . 1 . 1 65 65 LEU H H 1 8.541 0.000 . 1 . . . . . 865 LEU H . 50213 2
237 . 1 . 1 65 65 LEU C C 13 178.102 0.000 . 1 . . . . . 865 LEU C . 50213 2
238 . 1 . 1 65 65 LEU CA C 13 58.526 0.000 . 1 . . . . . 865 LEU CA . 50213 2
239 . 1 . 1 65 65 LEU CB C 13 42.109 0.000 . 1 . . . . . 865 LEU CB . 50213 2
240 . 1 . 1 65 65 LEU N N 15 120.885 0.000 . 1 . . . . . 865 LEU N . 50213 2
241 . 1 . 1 66 66 SER H H 1 7.861 0.000 . 1 . . . . . 866 SER H . 50213 2
242 . 1 . 1 66 66 SER C C 13 177.151 0.000 . 1 . . . . . 866 SER C . 50213 2
243 . 1 . 1 66 66 SER CA C 13 61.258 0.000 . 1 . . . . . 866 SER CA . 50213 2
244 . 1 . 1 66 66 SER CB C 13 62.345 0.000 . 1 . . . . . 866 SER CB . 50213 2
245 . 1 . 1 66 66 SER N N 15 112.779 0.000 . 1 . . . . . 866 SER N . 50213 2
246 . 1 . 1 67 67 ASN H H 1 8.631 0.000 . 1 . . . . . 867 ASN H . 50213 2
247 . 1 . 1 67 67 ASN C C 13 176.799 0.000 . 1 . . . . . 867 ASN C . 50213 2
248 . 1 . 1 67 67 ASN CA C 13 55.570 0.000 . 1 . . . . . 867 ASN CA . 50213 2
249 . 1 . 1 67 67 ASN N N 15 121.141 0.000 . 1 . . . . . 867 ASN N . 50213 2
250 . 1 . 1 68 68 CYS H H 1 9.334 0.000 . 1 . . . . . 868 CYS H . 50213 2
251 . 1 . 1 68 68 CYS C C 13 175.257 0.000 . 1 . . . . . 868 CYS C . 50213 2
252 . 1 . 1 68 68 CYS CA C 13 60.588 0.000 . 1 . . . . . 868 CYS CA . 50213 2
253 . 1 . 1 68 68 CYS CB C 13 42.566 0.000 . 1 . . . . . 868 CYS CB . 50213 2
254 . 1 . 1 68 68 CYS N N 15 121.613 0.000 . 1 . . . . . 868 CYS N . 50213 2
255 . 1 . 1 69 69 VAL H H 1 7.772 0.000 . 1 . . . . . 869 VAL H . 50213 2
256 . 1 . 1 69 69 VAL C C 13 176.552 0.000 . 1 . . . . . 869 VAL C . 50213 2
257 . 1 . 1 69 69 VAL CA C 13 65.013 0.000 . 1 . . . . . 869 VAL CA . 50213 2
258 . 1 . 1 69 69 VAL CB C 13 30.222 0.000 . 1 . . . . . 869 VAL CB . 50213 2
259 . 1 . 1 69 69 VAL N N 15 118.390 0.000 . 1 . . . . . 869 VAL N . 50213 2
260 . 1 . 1 70 70 ASN H H 1 7.520 0.000 . 1 . . . . . 870 ASN H . 50213 2
261 . 1 . 1 70 70 ASN C C 13 177.595 0.000 . 1 . . . . . 870 ASN C . 50213 2
262 . 1 . 1 70 70 ASN CA C 13 57.646 0.000 . 1 . . . . . 870 ASN CA . 50213 2
263 . 1 . 1 70 70 ASN CB C 13 38.494 0.000 . 1 . . . . . 870 ASN CB . 50213 2
264 . 1 . 1 70 70 ASN N N 15 119.899 0.000 . 1 . . . . . 870 ASN N . 50213 2
265 . 1 . 1 71 71 ARG H H 1 9.152 0.000 . 1 . . . . . 871 ARG H . 50213 2
266 . 1 . 1 71 71 ARG C C 13 180.289 0.000 . 1 . . . . . 871 ARG C . 50213 2
267 . 1 . 1 71 71 ARG CA C 13 57.575 0.000 . 1 . . . . . 871 ARG CA . 50213 2
268 . 1 . 1 71 71 ARG CB C 13 30.832 0.000 . 1 . . . . . 871 ARG CB . 50213 2
269 . 1 . 1 71 71 ARG N N 15 117.328 0.000 . 1 . . . . . 871 ARG N . 50213 2
270 . 1 . 1 72 72 PHE H H 1 8.944 0.000 . 1 . . . . . 872 PHE H . 50213 2
271 . 1 . 1 72 72 PHE C C 13 178.427 0.000 . 1 . . . . . 872 PHE C . 50213 2
272 . 1 . 1 72 72 PHE CA C 13 62.162 0.000 . 1 . . . . . 872 PHE CA . 50213 2
273 . 1 . 1 72 72 PHE CB C 13 37.417 0.000 . 1 . . . . . 872 PHE CB . 50213 2
274 . 1 . 1 72 72 PHE N N 15 126.643 0.000 . 1 . . . . . 872 PHE N . 50213 2
275 . 1 . 1 73 73 LEU H H 1 8.209 0.000 . 1 . . . . . 873 LEU H . 50213 2
276 . 1 . 1 73 73 LEU C C 13 179.103 0.000 . 1 . . . . . 873 LEU C . 50213 2
277 . 1 . 1 73 73 LEU CA C 13 58.240 0.000 . 1 . . . . . 873 LEU CA . 50213 2
278 . 1 . 1 73 73 LEU CB C 13 40.022 0.000 . 1 . . . . . 873 LEU CB . 50213 2
279 . 1 . 1 73 73 LEU N N 15 121.311 0.000 . 1 . . . . . 873 LEU N . 50213 2
280 . 1 . 1 74 74 ASP H H 1 8.348 0.000 . 1 . . . . . 874 ASP H . 50213 2
281 . 1 . 1 74 74 ASP C C 13 179.247 0.000 . 1 . . . . . 874 ASP C . 50213 2
282 . 1 . 1 74 74 ASP CA C 13 57.398 0.000 . 1 . . . . . 874 ASP CA . 50213 2
283 . 1 . 1 74 74 ASP CB C 13 40.501 0.000 . 1 . . . . . 874 ASP CB . 50213 2
284 . 1 . 1 74 74 ASP N N 15 118.511 0.000 . 1 . . . . . 874 ASP N . 50213 2
285 . 1 . 1 75 75 THR H H 1 7.938 0.000 . 1 . . . . . 875 THR H . 50213 2
286 . 1 . 1 75 75 THR CA C 13 67.657 0.000 . 1 . . . . . 875 THR CA . 50213 2
287 . 1 . 1 75 75 THR N N 15 118.797 0.000 . 1 . . . . . 875 THR N . 50213 2
288 . 1 . 1 76 76 ASN H H 1 8.020 0.000 . 1 . . . . . 876 ASN H . 50213 2
289 . 1 . 1 76 76 ASN C C 13 176.848 0.000 . 1 . . . . . 876 ASN C . 50213 2
290 . 1 . 1 76 76 ASN CA C 13 56.774 0.000 . 1 . . . . . 876 ASN CA . 50213 2
291 . 1 . 1 76 76 ASN CB C 13 39.199 0.000 . 1 . . . . . 876 ASN CB . 50213 2
292 . 1 . 1 76 76 ASN N N 15 120.449 0.000 . 1 . . . . . 876 ASN N . 50213 2
293 . 1 . 1 77 77 ILE H H 1 8.020 0.000 . 1 . . . . . 877 ILE H . 50213 2
294 . 1 . 1 77 77 ILE C C 13 177.698 0.000 . 1 . . . . . 877 ILE C . 50213 2
295 . 1 . 1 77 77 ILE CA C 13 64.598 0.000 . 1 . . . . . 877 ILE CA . 50213 2
296 . 1 . 1 77 77 ILE CB C 13 37.461 0.000 . 1 . . . . . 877 ILE CB . 50213 2
297 . 1 . 1 77 77 ILE N N 15 118.030 0.000 . 1 . . . . . 877 ILE N . 50213 2
298 . 1 . 1 78 78 ARG H H 1 7.587 0.000 . 1 . . . . . 878 ARG H . 50213 2
299 . 1 . 1 78 78 ARG C C 13 179.803 0.000 . 1 . . . . . 878 ARG C . 50213 2
300 . 1 . 1 78 78 ARG CA C 13 58.582 0.000 . 1 . . . . . 878 ARG CA . 50213 2
301 . 1 . 1 78 78 ARG CB C 13 29.250 0.000 . 1 . . . . . 878 ARG CB . 50213 2
302 . 1 . 1 78 78 ARG N N 15 119.768 0.000 . 1 . . . . . 878 ARG N . 50213 2
303 . 1 . 1 79 79 ILE H H 1 8.155 0.000 . 1 . . . . . 879 ILE H . 50213 2
304 . 1 . 1 79 79 ILE C C 13 177.269 0.000 . 1 . . . . . 879 ILE C . 50213 2
305 . 1 . 1 79 79 ILE CA C 13 63.275 0.000 . 1 . . . . . 879 ILE CA . 50213 2
306 . 1 . 1 79 79 ILE CB C 13 35.316 0.000 . 1 . . . . . 879 ILE CB . 50213 2
307 . 1 . 1 79 79 ILE N N 15 120.884 0.000 . 1 . . . . . 879 ILE N . 50213 2
308 . 1 . 1 80 80 VAL H H 1 8.271 0.000 . 1 . . . . . 880 VAL H . 50213 2
309 . 1 . 1 80 80 VAL C C 13 178.661 0.000 . 1 . . . . . 880 VAL C . 50213 2
310 . 1 . 1 80 80 VAL CA C 13 66.917 0.000 . 1 . . . . . 880 VAL CA . 50213 2
311 . 1 . 1 80 80 VAL CB C 13 30.504 0.000 . 1 . . . . . 880 VAL CB . 50213 2
312 . 1 . 1 80 80 VAL N N 15 119.928 0.000 . 1 . . . . . 880 VAL N . 50213 2
313 . 1 . 1 81 81 ASN H H 1 8.009 0.000 . 1 . . . . . 881 ASN H . 50213 2
314 . 1 . 1 81 81 ASN C C 13 177.980 0.000 . 1 . . . . . 881 ASN C . 50213 2
315 . 1 . 1 81 81 ASN CA C 13 55.763 0.000 . 1 . . . . . 881 ASN CA . 50213 2
316 . 1 . 1 81 81 ASN CB C 13 37.941 0.000 . 1 . . . . . 881 ASN CB . 50213 2
317 . 1 . 1 81 81 ASN N N 15 117.039 0.000 . 1 . . . . . 881 ASN N . 50213 2
318 . 1 . 1 82 82 GLY H H 1 8.068 0.000 . 1 . . . . . 882 GLY H . 50213 2
319 . 1 . 1 82 82 GLY C C 13 175.893 0.000 . 1 . . . . . 882 GLY C . 50213 2
320 . 1 . 1 82 82 GLY CA C 13 46.290 0.000 . 1 . . . . . 882 GLY CA . 50213 2
321 . 1 . 1 82 82 GLY N N 15 108.355 0.000 . 1 . . . . . 882 GLY N . 50213 2
322 . 1 . 1 83 83 LEU H H 1 8.009 0.000 . 1 . . . . . 883 LEU H . 50213 2
323 . 1 . 1 83 83 LEU C C 13 178.143 0.000 . 1 . . . . . 883 LEU C . 50213 2
324 . 1 . 1 83 83 LEU CA C 13 56.236 0.000 . 1 . . . . . 883 LEU CA . 50213 2
325 . 1 . 1 83 83 LEU CB C 13 41.615 0.000 . 1 . . . . . 883 LEU CB . 50213 2
326 . 1 . 1 83 83 LEU N N 15 121.568 0.000 . 1 . . . . . 883 LEU N . 50213 2
327 . 1 . 1 84 84 GLN H H 1 7.625 0.000 . 1 . . . . . 884 GLN H . 50213 2
328 . 1 . 1 84 84 GLN C C 13 176.249 0.000 . 1 . . . . . 884 GLN C . 50213 2
329 . 1 . 1 84 84 GLN CA C 13 56.547 0.000 . 1 . . . . . 884 GLN CA . 50213 2
330 . 1 . 1 84 84 GLN CB C 13 28.512 0.000 . 1 . . . . . 884 GLN CB . 50213 2
331 . 1 . 1 84 84 GLN N N 15 116.652 0.000 . 1 . . . . . 884 GLN N . 50213 2
332 . 1 . 1 85 85 ASN H H 1 7.741 0.000 . 1 . . . . . 885 ASN H . 50213 2
333 . 1 . 1 85 85 ASN C C 13 175.075 0.000 . 1 . . . . . 885 ASN C . 50213 2
334 . 1 . 1 85 85 ASN CA C 13 53.186 0.000 . 1 . . . . . 885 ASN CA . 50213 2
335 . 1 . 1 85 85 ASN CB C 13 38.717 0.000 . 1 . . . . . 885 ASN CB . 50213 2
336 . 1 . 1 85 85 ASN N N 15 117.411 0.000 . 1 . . . . . 885 ASN N . 50213 2
337 . 1 . 1 86 86 THR H H 1 7.693 0.000 . 1 . . . . . 886 THR H . 50213 2
338 . 1 . 1 86 86 THR C C 13 173.455 0.000 . 1 . . . . . 886 THR C . 50213 2
339 . 1 . 1 86 86 THR CA C 13 61.921 0.000 . 1 . . . . . 886 THR CA . 50213 2
340 . 1 . 1 86 86 THR CB C 13 69.314 0.000 . 1 . . . . . 886 THR CB . 50213 2
341 . 1 . 1 86 86 THR N N 15 114.470 0.000 . 1 . . . . . 886 THR N . 50213 2
342 . 1 . 1 87 87 ARG H H 1 7.660 0.000 . 1 . . . . . 887 ARG H . 50213 2
343 . 1 . 1 87 87 ARG C C 13 180.598 0.000 . 1 . . . . . 887 ARG C . 50213 2
344 . 1 . 1 87 87 ARG N N 15 128.363 0.000 . 1 . . . . . 887 ARG N . 50213 2
stop_
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