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 51812
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name shifts_58-144
_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 '3D HNCA' . . . 51812 2
2 '3D HNCACB' . . . 51812 2
3 '3D CBCA(CO)NH' . . . 51812 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
2 $software_2 . . 51812 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 26 26 GLU H H 1 8.226 0.001 . 1 . . . . . 58 GLU H . 51812 2
2 . 1 . 1 26 26 GLU CA C 13 58.443 0.000 . 1 . . . . . 58 GLU CA . 51812 2
3 . 1 . 1 26 26 GLU CB C 13 28.977 0.000 . 1 . . . . . 58 GLU CB . 51812 2
4 . 1 . 1 26 26 GLU N N 15 121.359 0.000 . 1 . . . . . 58 GLU N . 51812 2
5 . 1 . 1 27 27 GLN H H 1 7.711 0.000 . 1 . . . . . 59 GLN H . 51812 2
6 . 1 . 1 27 27 GLN HE21 H 1 7.393 0.000 . 1 . . . . . 59 GLN HE21 . 51812 2
7 . 1 . 1 27 27 GLN HE22 H 1 6.746 0.000 . 1 . . . . . 59 GLN HE22 . 51812 2
8 . 1 . 1 27 27 GLN CA C 13 58.651 0.160 . 1 . . . . . 59 GLN CA . 51812 2
9 . 1 . 1 27 27 GLN CB C 13 28.222 0.066 . 1 . . . . . 59 GLN CB . 51812 2
10 . 1 . 1 27 27 GLN CG C 13 33.871 0.000 . 1 . . . . . 59 GLN CG . 51812 2
11 . 1 . 1 27 27 GLN N N 15 115.78 0.003 . 1 . . . . . 59 GLN N . 51812 2
12 . 1 . 1 27 27 GLN NE2 N 15 111.54 0.009 . 1 . . . . . 59 GLN NE2 . 51812 2
13 . 1 . 1 28 28 ALA H H 1 7.814 0.000 . 1 . . . . . 60 ALA H . 51812 2
14 . 1 . 1 28 28 ALA CA C 13 55.073 0.000 . 1 . . . . . 60 ALA CA . 51812 2
15 . 1 . 1 28 28 ALA CB C 13 18.227 0.000 . 1 . . . . . 60 ALA CB . 51812 2
16 . 1 . 1 28 28 ALA N N 15 120.327 0.014 . 1 . . . . . 60 ALA N . 51812 2
17 . 1 . 1 29 29 PHE H H 1 7.995 0.003 . 1 . . . . . 61 PHE H . 51812 2
18 . 1 . 1 29 29 PHE CA C 13 61.554 0.000 . 1 . . . . . 61 PHE CA . 51812 2
19 . 1 . 1 29 29 PHE CB C 13 40.012 0.000 . 1 . . . . . 61 PHE CB . 51812 2
20 . 1 . 1 29 29 PHE N N 15 120.582 0.000 . 1 . . . . . 61 PHE N . 51812 2
21 . 1 . 1 30 30 LEU H H 1 8.364 0.003 . 1 . . . . . 62 LEU H . 51812 2
22 . 1 . 1 30 30 LEU CA C 13 58.324 0.000 . 1 . . . . . 62 LEU CA . 51812 2
23 . 1 . 1 30 30 LEU CB C 13 41.707 0.000 . 1 . . . . . 62 LEU CB . 51812 2
24 . 1 . 1 30 30 LEU N N 15 118.757 0.017 . 1 . . . . . 62 LEU N . 51812 2
25 . 1 . 1 31 31 VAL H H 1 8.167 0.000 . 1 . . . . . 63 VAL H . 51812 2
26 . 1 . 1 31 31 VAL CA C 13 66.81 0.000 . 1 . . . . . 63 VAL CA . 51812 2
27 . 1 . 1 31 31 VAL CB C 13 31.752 0.000 . 1 . . . . . 63 VAL CB . 51812 2
28 . 1 . 1 31 31 VAL N N 15 118.026 0.005 . 1 . . . . . 63 VAL N . 51812 2
29 . 1 . 1 32 32 SER H H 1 7.642 0.003 . 1 . . . . . 64 SER H . 51812 2
30 . 1 . 1 32 32 SER CA C 13 62.413 0.000 . 1 . . . . . 64 SER CA . 51812 2
31 . 1 . 1 32 32 SER CB C 13 63.235 0.000 . 1 . . . . . 64 SER CB . 51812 2
32 . 1 . 1 32 32 SER N N 15 116.392 0.065 . 1 . . . . . 64 SER N . 51812 2
33 . 1 . 1 33 33 LEU H H 1 8.681 0.000 . 1 . . . . . 65 LEU H . 51812 2
34 . 1 . 1 33 33 LEU CA C 13 58.851 0.000 . 1 . . . . . 65 LEU CA . 51812 2
35 . 1 . 1 33 33 LEU CB C 13 41.522 0.000 . 1 . . . . . 65 LEU CB . 51812 2
36 . 1 . 1 33 33 LEU N N 15 126.204 0.021 . 1 . . . . . 65 LEU N . 51812 2
37 . 1 . 1 34 34 TYR H H 1 8.566 0.001 . 1 . . . . . 66 TYR H . 51812 2
38 . 1 . 1 34 34 TYR CA C 13 62.158 0.000 . 1 . . . . . 66 TYR CA . 51812 2
39 . 1 . 1 34 34 TYR CB C 13 37.151 0.000 . 1 . . . . . 66 TYR CB . 51812 2
40 . 1 . 1 34 34 TYR N N 15 117.818 0.003 . 1 . . . . . 66 TYR N . 51812 2
41 . 1 . 1 35 35 LYS H H 1 7.798 0.000 . 1 . . . . . 67 LYS H . 51812 2
42 . 1 . 1 35 35 LYS CA C 13 60.118 0.000 . 1 . . . . . 67 LYS CA . 51812 2
43 . 1 . 1 35 35 LYS CB C 13 33.05 0.000 . 1 . . . . . 67 LYS CB . 51812 2
44 . 1 . 1 35 35 LYS N N 15 120.726 0.001 . 1 . . . . . 67 LYS N . 51812 2
45 . 1 . 1 36 36 PHE H H 1 8.08 0.000 . 1 . . . . . 68 PHE H . 51812 2
46 . 1 . 1 36 36 PHE CA C 13 61.051 0.000 . 1 . . . . . 68 PHE CA . 51812 2
47 . 1 . 1 36 36 PHE CB C 13 39.642 0.000 . 1 . . . . . 68 PHE CB . 51812 2
48 . 1 . 1 36 36 PHE N N 15 120.295 0.007 . 1 . . . . . 68 PHE N . 51812 2
49 . 1 . 1 37 37 MET H H 1 8.199 0.000 . 1 . . . . . 69 MET H . 51812 2
50 . 1 . 1 37 37 MET CA C 13 57.035 0.000 . 1 . . . . . 69 MET CA . 51812 2
51 . 1 . 1 37 37 MET CB C 13 31.431 0.000 . 1 . . . . . 69 MET CB . 51812 2
52 . 1 . 1 37 37 MET N N 15 116.565 0.018 . 1 . . . . . 69 MET N . 51812 2
53 . 1 . 1 38 38 LYS H H 1 7.97 0.001 . 1 . . . . . 70 LYS H . 51812 2
54 . 1 . 1 38 38 LYS CA C 13 60.277 0.000 . 1 . . . . . 70 LYS CA . 51812 2
55 . 1 . 1 38 38 LYS CB C 13 32.192 0.000 . 1 . . . . . 70 LYS CB . 51812 2
56 . 1 . 1 38 38 LYS N N 15 120.814 0.008 . 1 . . . . . 70 LYS N . 51812 2
57 . 1 . 1 39 39 GLU H H 1 8.224 0.001 . 1 . . . . . 71 GLU H . 51812 2
58 . 1 . 1 39 39 GLU CA C 13 58.92 0.000 . 1 . . . . . 71 GLU CA . 51812 2
59 . 1 . 1 39 39 GLU CB C 13 28.87 0.000 . 1 . . . . . 71 GLU CB . 51812 2
60 . 1 . 1 39 39 GLU N N 15 121.108 0.033 . 1 . . . . . 71 GLU N . 51812 2
61 . 1 . 1 40 40 ARG H H 1 7.102 0.000 . 1 . . . . . 72 ARG H . 51812 2
62 . 1 . 1 40 40 ARG CA C 13 55.179 0.000 . 1 . . . . . 72 ARG CA . 51812 2
63 . 1 . 1 40 40 ARG CB C 13 30.231 0.000 . 1 . . . . . 72 ARG CB . 51812 2
64 . 1 . 1 40 40 ARG N N 15 117.13 0.002 . 1 . . . . . 72 ARG N . 51812 2
65 . 1 . 1 41 41 HIS H H 1 7.618 0.000 . 1 . . . . . 73 HIS H . 51812 2
66 . 1 . 1 41 41 HIS CA C 13 56.511 0.000 . 1 . . . . . 73 HIS CA . 51812 2
67 . 1 . 1 41 41 HIS CB C 13 25.941 0.000 . 1 . . . . . 73 HIS CB . 51812 2
68 . 1 . 1 41 41 HIS N N 15 110.995 0.001 . 1 . . . . . 73 HIS N . 51812 2
69 . 1 . 1 42 42 THR H H 1 8.153 0.000 . 1 . . . . . 74 THR H . 51812 2
70 . 1 . 1 42 42 THR CA C 13 57.505 0.000 . 1 . . . . . 74 THR CA . 51812 2
71 . 1 . 1 42 42 THR CB C 13 70.03 0.000 . 1 . . . . . 74 THR CB . 51812 2
72 . 1 . 1 42 42 THR N N 15 108.782 0.006 . 1 . . . . . 74 THR N . 51812 2
73 . 1 . 1 43 43 PRO CA C 13 62.418 0.000 . 1 . . . . . 75 PRO CA . 51812 2
74 . 1 . 1 43 43 PRO CB C 13 32.49 0.000 . 1 . . . . . 75 PRO CB . 51812 2
75 . 1 . 1 44 44 ILE H H 1 8.39 0.005 . 1 . . . . . 76 ILE H . 51812 2
76 . 1 . 1 44 44 ILE CA C 13 62.107 0.000 . 1 . . . . . 76 ILE CA . 51812 2
77 . 1 . 1 44 44 ILE CB C 13 36.716 0.000 . 1 . . . . . 76 ILE CB . 51812 2
78 . 1 . 1 44 44 ILE N N 15 121.11 0.008 . 1 . . . . . 76 ILE N . 51812 2
79 . 1 . 1 45 45 GLU H H 1 8.445 0.001 . 1 . . . . . 77 GLU H . 51812 2
80 . 1 . 1 45 45 GLU CA C 13 57.019 0.000 . 1 . . . . . 77 GLU CA . 51812 2
81 . 1 . 1 45 45 GLU CB C 13 30.84 0.000 . 1 . . . . . 77 GLU CB . 51812 2
82 . 1 . 1 45 45 GLU N N 15 128.232 0.008 . 1 . . . . . 77 GLU N . 51812 2
83 . 1 . 1 46 46 ARG H H 1 7.759 0.000 . 1 . . . . . 78 ARG H . 51812 2
84 . 1 . 1 46 46 ARG CA C 13 55.333 0.000 . 1 . . . . . 78 ARG CA . 51812 2
85 . 1 . 1 46 46 ARG CB C 13 31.281 0.000 . 1 . . . . . 78 ARG CB . 51812 2
86 . 1 . 1 46 46 ARG N N 15 117.952 0.003 . 1 . . . . . 78 ARG N . 51812 2
87 . 1 . 1 47 47 VAL H H 1 8.607 0.001 . 1 . . . . . 79 VAL H . 51812 2
88 . 1 . 1 47 47 VAL CA C 13 60.438 0.000 . 1 . . . . . 79 VAL CA . 51812 2
89 . 1 . 1 47 47 VAL CB C 13 32.547 0.000 . 1 . . . . . 79 VAL CB . 51812 2
90 . 1 . 1 47 47 VAL N N 15 125.554 0.003 . 1 . . . . . 79 VAL N . 51812 2
91 . 1 . 1 48 48 PRO CA C 13 62.742 0.000 . 1 . . . . . 80 PRO CA . 51812 2
92 . 1 . 1 48 48 PRO CB C 13 32.684 0.000 . 1 . . . . . 80 PRO CB . 51812 2
93 . 1 . 1 49 49 HIS H H 1 8.379 0.004 . 1 . . . . . 81 HIS H . 51812 2
94 . 1 . 1 49 49 HIS CA C 13 55.85 0.000 . 1 . . . . . 81 HIS CA . 51812 2
95 . 1 . 1 49 49 HIS CB C 13 32.316 0.000 . 1 . . . . . 81 HIS CB . 51812 2
96 . 1 . 1 49 49 HIS N N 15 117.415 0.037 . 1 . . . . . 81 HIS N . 51812 2
97 . 1 . 1 50 50 LEU H H 1 8.437 0.000 . 1 . . . . . 82 LEU H . 51812 2
98 . 1 . 1 50 50 LEU CA C 13 54.495 0.000 . 1 . . . . . 82 LEU CA . 51812 2
99 . 1 . 1 50 50 LEU CB C 13 43.523 0.000 . 1 . . . . . 82 LEU CB . 51812 2
100 . 1 . 1 50 50 LEU N N 15 122.881 0.017 . 1 . . . . . 82 LEU N . 51812 2
101 . 1 . 1 51 51 GLY H H 1 9 0.000 . 1 . . . . . 83 GLY H . 51812 2
102 . 1 . 1 51 51 GLY CA C 13 46.951 0.000 . 1 . . . . . 83 GLY CA . 51812 2
103 . 1 . 1 51 51 GLY N N 15 115.45 0.000 . 1 . . . . . 83 GLY N . 51812 2
104 . 1 . 1 52 52 PHE H H 1 8.581 0.000 . 1 . . . . . 84 PHE H . 51812 2
105 . 1 . 1 52 52 PHE CA C 13 58.648 0.000 . 1 . . . . . 84 PHE CA . 51812 2
106 . 1 . 1 52 52 PHE CB C 13 38.267 0.000 . 1 . . . . . 84 PHE CB . 51812 2
107 . 1 . 1 52 52 PHE N N 15 118.824 0.000 . 1 . . . . . 84 PHE N . 51812 2
108 . 1 . 1 53 53 LYS H H 1 7.548 0.007 . 1 . . . . . 85 LYS H . 51812 2
109 . 1 . 1 53 53 LYS CA C 13 54.95 0.000 . 1 . . . . . 85 LYS CA . 51812 2
110 . 1 . 1 53 53 LYS CB C 13 35.092 0.000 . 1 . . . . . 85 LYS CB . 51812 2
111 . 1 . 1 53 53 LYS N N 15 118.711 0.003 . 1 . . . . . 85 LYS N . 51812 2
112 . 1 . 1 54 54 GLN H H 1 8.548 0.000 . 1 . . . . . 86 GLN H . 51812 2
113 . 1 . 1 54 54 GLN HE21 H 1 7.627 0.000 . 1 . . . . . 86 GLN HE21 . 51812 2
114 . 1 . 1 54 54 GLN HE22 H 1 6.906 0.000 . 1 . . . . . 86 GLN HE22 . 51812 2
115 . 1 . 1 54 54 GLN CA C 13 56.966 0.000 . 1 . . . . . 86 GLN CA . 51812 2
116 . 1 . 1 54 54 GLN CB C 13 29.427 0.000 . 1 . . . . . 86 GLN CB . 51812 2
117 . 1 . 1 54 54 GLN CG C 13 34.527 0.000 . 1 . . . . . 86 GLN CG . 51812 2
118 . 1 . 1 54 54 GLN N N 15 123.483 0.002 . 1 . . . . . 86 GLN N . 51812 2
119 . 1 . 1 54 54 GLN NE2 N 15 112.769 0.000 . 1 . . . . . 86 GLN NE2 . 51812 2
120 . 1 . 1 55 55 ILE H H 1 8.218 0.002 . 1 . . . . . 87 ILE H . 51812 2
121 . 1 . 1 55 55 ILE CA C 13 62.721 0.000 . 1 . . . . . 87 ILE CA . 51812 2
122 . 1 . 1 55 55 ILE CB C 13 39.154 0.000 . 1 . . . . . 87 ILE CB . 51812 2
123 . 1 . 1 55 55 ILE N N 15 124.887 0.002 . 1 . . . . . 87 ILE N . 51812 2
124 . 1 . 1 56 56 ASN H H 1 8.086 0.000 . 1 . . . . . 88 ASN H . 51812 2
125 . 1 . 1 56 56 ASN CA C 13 52.263 0.000 . 1 . . . . . 88 ASN CA . 51812 2
126 . 1 . 1 56 56 ASN CB C 13 38.977 0.000 . 1 . . . . . 88 ASN CB . 51812 2
127 . 1 . 1 56 56 ASN N N 15 125.17 0.002 . 1 . . . . . 88 ASN N . 51812 2
128 . 1 . 1 57 57 LEU H H 1 8.982 0.000 . 1 . . . . . 89 LEU H . 51812 2
129 . 1 . 1 57 57 LEU CA C 13 57.951 0.000 . 1 . . . . . 89 LEU CA . 51812 2
130 . 1 . 1 57 57 LEU CB C 13 41.443 0.000 . 1 . . . . . 89 LEU CB . 51812 2
131 . 1 . 1 57 57 LEU N N 15 125.858 0.002 . 1 . . . . . 89 LEU N . 51812 2
132 . 1 . 1 58 58 TRP HE1 H 1 10.364 0.000 . 1 . . . . . 90 TRP HE1 . 51812 2
133 . 1 . 1 58 58 TRP CA C 13 59.291 0.000 . 1 . . . . . 90 TRP CA . 51812 2
134 . 1 . 1 58 58 TRP CB C 13 29.454 0.000 . 1 . . . . . 90 TRP CB . 51812 2
135 . 1 . 1 58 58 TRP NE1 N 15 129.364 0.000 . 1 . . . . . 90 TRP NE1 . 51812 2
136 . 1 . 1 59 59 LYS H H 1 8.056 0.005 . 1 . . . . . 91 LYS H . 51812 2
137 . 1 . 1 59 59 LYS CA C 13 59.104 0.000 . 1 . . . . . 91 LYS CA . 51812 2
138 . 1 . 1 59 59 LYS CB C 13 30.894 0.000 . 1 . . . . . 91 LYS CB . 51812 2
139 . 1 . 1 59 59 LYS N N 15 117.807 0.009 . 1 . . . . . 91 LYS N . 51812 2
140 . 1 . 1 60 60 ILE H H 1 8.435 0.001 . 1 . . . . . 92 ILE H . 51812 2
141 . 1 . 1 60 60 ILE CA C 13 66.121 0.000 . 1 . . . . . 92 ILE CA . 51812 2
142 . 1 . 1 60 60 ILE CB C 13 37.157 0.051 . 1 . . . . . 92 ILE CB . 51812 2
143 . 1 . 1 60 60 ILE N N 15 118.808 0.015 . 1 . . . . . 92 ILE N . 51812 2
144 . 1 . 1 61 61 TYR H H 1 7.618 0.002 . 1 . . . . . 93 TYR H . 51812 2
145 . 1 . 1 61 61 TYR CA C 13 60.814 0.089 . 1 . . . . . 93 TYR CA . 51812 2
146 . 1 . 1 61 61 TYR CB C 13 38.294 0.000 . 1 . . . . . 93 TYR CB . 51812 2
147 . 1 . 1 61 61 TYR N N 15 123.979 0.038 . 1 . . . . . 93 TYR N . 51812 2
148 . 1 . 1 62 62 LYS H H 1 8.044 0.001 . 1 . . . . . 94 LYS H . 51812 2
149 . 1 . 1 62 62 LYS CA C 13 58 0.056 . 1 . . . . . 94 LYS CA . 51812 2
150 . 1 . 1 62 62 LYS CB C 13 30.951 0.136 . 1 . . . . . 94 LYS CB . 51812 2
151 . 1 . 1 62 62 LYS N N 15 118.82 0.023 . 1 . . . . . 94 LYS N . 51812 2
152 . 1 . 1 63 63 ALA H H 1 8.238 0.005 . 1 . . . . . 95 ALA H . 51812 2
153 . 1 . 1 63 63 ALA CA C 13 54.87 0.000 . 1 . . . . . 95 ALA CA . 51812 2
154 . 1 . 1 63 63 ALA CB C 13 18.775 0.000 . 1 . . . . . 95 ALA CB . 51812 2
155 . 1 . 1 63 63 ALA N N 15 121.438 0.030 . 1 . . . . . 95 ALA N . 51812 2
156 . 1 . 1 64 64 VAL H H 1 7.502 0.001 . 1 . . . . . 96 VAL H . 51812 2
157 . 1 . 1 64 64 VAL CA C 13 66.243 0.000 . 1 . . . . . 96 VAL CA . 51812 2
158 . 1 . 1 64 64 VAL CB C 13 30.945 0.000 . 1 . . . . . 96 VAL CB . 51812 2
159 . 1 . 1 64 64 VAL N N 15 115.652 0.009 . 1 . . . . . 96 VAL N . 51812 2
160 . 1 . 1 65 65 GLU H H 1 7.377 0.001 . 1 . . . . . 97 GLU H . 51812 2
161 . 1 . 1 65 65 GLU CA C 13 59.417 0.000 . 1 . . . . . 97 GLU CA . 51812 2
162 . 1 . 1 65 65 GLU CB C 13 28.893 0.000 . 1 . . . . . 97 GLU CB . 51812 2
163 . 1 . 1 65 65 GLU N N 15 117.901 0.011 . 1 . . . . . 97 GLU N . 51812 2
164 . 1 . 1 66 66 LYS H H 1 8.013 0.000 . 1 . . . . . 98 LYS H . 51812 2
165 . 1 . 1 66 66 LYS CA C 13 59.116 0.000 . 1 . . . . . 98 LYS CA . 51812 2
166 . 1 . 1 66 66 LYS CB C 13 32.015 0.000 . 1 . . . . . 98 LYS CB . 51812 2
167 . 1 . 1 66 66 LYS N N 15 120.508 0.006 . 1 . . . . . 98 LYS N . 51812 2
168 . 1 . 1 67 67 LEU H H 1 6.785 0.001 . 1 . . . . . 99 LEU H . 51812 2
169 . 1 . 1 67 67 LEU CA C 13 54.729 0.000 . 1 . . . . . 99 LEU CA . 51812 2
170 . 1 . 1 67 67 LEU CB C 13 42.703 0.000 . 1 . . . . . 99 LEU CB . 51812 2
171 . 1 . 1 67 67 LEU N N 15 117.009 0.008 . 1 . . . . . 99 LEU N . 51812 2
172 . 1 . 1 68 68 GLY H H 1 7.148 0.000 . 1 . . . . . 100 GLY H . 51812 2
173 . 1 . 1 68 68 GLY CA C 13 45.393 0.000 . 1 . . . . . 100 GLY CA . 51812 2
174 . 1 . 1 68 68 GLY N N 15 104.036 0.000 . 1 . . . . . 100 GLY N . 51812 2
175 . 1 . 1 69 69 ALA H H 1 8.191 0.000 . 1 . . . . . 101 ALA H . 51812 2
176 . 1 . 1 69 69 ALA CA C 13 53.931 0.000 . 1 . . . . . 101 ALA CA . 51812 2
177 . 1 . 1 69 69 ALA CB C 13 18.505 0.000 . 1 . . . . . 101 ALA CB . 51812 2
178 . 1 . 1 69 69 ALA N N 15 117.095 0.007 . 1 . . . . . 101 ALA N . 51812 2
179 . 1 . 1 70 70 TYR H H 1 8.352 0.001 . 1 . . . . . 102 TYR H . 51812 2
180 . 1 . 1 70 70 TYR CA C 13 63.314 0.000 . 1 . . . . . 102 TYR CA . 51812 2
181 . 1 . 1 70 70 TYR CB C 13 40.003 0.000 . 1 . . . . . 102 TYR CB . 51812 2
182 . 1 . 1 70 70 TYR N N 15 116.84 0.003 . 1 . . . . . 102 TYR N . 51812 2
183 . 1 . 1 71 71 GLU H H 1 9.176 0.000 . 1 . . . . . 103 GLU H . 51812 2
184 . 1 . 1 71 71 GLU CA C 13 60.944 0.000 . 1 . . . . . 103 GLU CA . 51812 2
185 . 1 . 1 71 71 GLU CB C 13 28.692 0.000 . 1 . . . . . 103 GLU CB . 51812 2
186 . 1 . 1 71 71 GLU N N 15 120.441 0.007 . 1 . . . . . 103 GLU N . 51812 2
187 . 1 . 1 72 72 LEU H H 1 8.056 0.000 . 1 . . . . . 104 LEU H . 51812 2
188 . 1 . 1 72 72 LEU CA C 13 57.954 0.000 . 1 . . . . . 104 LEU CA . 51812 2
189 . 1 . 1 72 72 LEU CB C 13 41.756 0.000 . 1 . . . . . 104 LEU CB . 51812 2
190 . 1 . 1 72 72 LEU N N 15 123.671 0.001 . 1 . . . . . 104 LEU N . 51812 2
191 . 1 . 1 73 73 VAL H H 1 8.066 0.002 . 1 . . . . . 105 VAL H . 51812 2
192 . 1 . 1 73 73 VAL CA C 13 66.501 0.000 . 1 . . . . . 105 VAL CA . 51812 2
193 . 1 . 1 73 73 VAL CB C 13 31.176 0.000 . 1 . . . . . 105 VAL CB . 51812 2
194 . 1 . 1 73 73 VAL N N 15 119.678 0.004 . 1 . . . . . 105 VAL N . 51812 2
195 . 1 . 1 74 74 THR H H 1 7.862 0.000 . 1 . . . . . 106 THR H . 51812 2
196 . 1 . 1 74 74 THR CA C 13 66.52 0.000 . 1 . . . . . 106 THR CA . 51812 2
197 . 1 . 1 74 74 THR CB C 13 68.614 0.000 . 1 . . . . . 106 THR CB . 51812 2
198 . 1 . 1 74 74 THR N N 15 114.464 0.034 . 1 . . . . . 106 THR N . 51812 2
199 . 1 . 1 75 75 GLY H H 1 8.596 0.000 . 1 . . . . . 107 GLY H . 51812 2
200 . 1 . 1 75 75 GLY CA C 13 47.316 0.000 . 1 . . . . . 107 GLY CA . 51812 2
201 . 1 . 1 75 75 GLY N N 15 111.812 0.000 . 1 . . . . . 107 GLY N . 51812 2
202 . 1 . 1 76 76 ARG H H 1 8.401 0.001 . 1 . . . . . 108 ARG H . 51812 2
203 . 1 . 1 76 76 ARG CA C 13 55.942 0.000 . 1 . . . . . 108 ARG CA . 51812 2
204 . 1 . 1 76 76 ARG CB C 13 29.538 0.000 . 1 . . . . . 108 ARG CB . 51812 2
205 . 1 . 1 76 76 ARG N N 15 117.005 0.015 . 1 . . . . . 108 ARG N . 51812 2
206 . 1 . 1 77 77 ARG H H 1 7.454 0.000 . 1 . . . . . 109 ARG H . 51812 2
207 . 1 . 1 77 77 ARG CA C 13 57.455 0.000 . 1 . . . . . 109 ARG CA . 51812 2
208 . 1 . 1 77 77 ARG CB C 13 26.036 0.000 . 1 . . . . . 109 ARG CB . 51812 2
209 . 1 . 1 77 77 ARG N N 15 115.44 0.000 . 1 . . . . . 109 ARG N . 51812 2
210 . 1 . 1 78 78 LEU H H 1 8.718 0.000 . 1 . . . . . 110 LEU H . 51812 2
211 . 1 . 1 78 78 LEU CA C 13 53.638 0.000 . 1 . . . . . 110 LEU CA . 51812 2
212 . 1 . 1 78 78 LEU CB C 13 42.433 0.000 . 1 . . . . . 110 LEU CB . 51812 2
213 . 1 . 1 78 78 LEU N N 15 117.592 0.002 . 1 . . . . . 110 LEU N . 51812 2
214 . 1 . 1 79 79 TRP H H 1 7.709 0.000 . 1 . . . . . 111 TRP H . 51812 2
215 . 1 . 1 79 79 TRP HE1 H 1 9.808 0.000 . 1 . . . . . 111 TRP HE1 . 51812 2
216 . 1 . 1 79 79 TRP CA C 13 61.806 0.000 . 1 . . . . . 111 TRP CA . 51812 2
217 . 1 . 1 79 79 TRP CB C 13 28.565 0.000 . 1 . . . . . 111 TRP CB . 51812 2
218 . 1 . 1 79 79 TRP N N 15 120.486 0.007 . 1 . . . . . 111 TRP N . 51812 2
219 . 1 . 1 79 79 TRP NE1 N 15 128.315 0.000 . 1 . . . . . 111 TRP NE1 . 51812 2
220 . 1 . 1 80 80 LYS H H 1 8.975 0.000 . 1 . . . . . 112 LYS H . 51812 2
221 . 1 . 1 80 80 LYS CA C 13 59.176 0.000 . 1 . . . . . 112 LYS CA . 51812 2
222 . 1 . 1 80 80 LYS CB C 13 31.804 0.000 . 1 . . . . . 112 LYS CB . 51812 2
223 . 1 . 1 80 80 LYS N N 15 120.282 0.005 . 1 . . . . . 112 LYS N . 51812 2
224 . 1 . 1 81 81 ASN H H 1 7.605 0.000 . 1 . . . . . 113 ASN H . 51812 2
225 . 1 . 1 81 81 ASN HD21 H 1 7.541 0.000 . 1 . . . . . 113 ASN HD21 . 51812 2
226 . 1 . 1 81 81 ASN HD22 H 1 6.849 0.000 . 1 . . . . . 113 ASN HD22 . 51812 2
227 . 1 . 1 81 81 ASN CA C 13 56.715 0.000 . 1 . . . . . 113 ASN CA . 51812 2
228 . 1 . 1 81 81 ASN CB C 13 36.84 0.000 . 1 . . . . . 113 ASN CB . 51812 2
229 . 1 . 1 81 81 ASN N N 15 117.268 0.002 . 1 . . . . . 113 ASN N . 51812 2
230 . 1 . 1 81 81 ASN ND2 N 15 111.714 0.000 . 1 . . . . . 113 ASN ND2 . 51812 2
231 . 1 . 1 82 82 VAL H H 1 7.43 0.000 . 1 . . . . . 114 VAL H . 51812 2
232 . 1 . 1 82 82 VAL CA C 13 66.772 0.000 . 1 . . . . . 114 VAL CA . 51812 2
233 . 1 . 1 82 82 VAL CB C 13 31.472 0.000 . 1 . . . . . 114 VAL CB . 51812 2
234 . 1 . 1 82 82 VAL N N 15 119.826 0.006 . 1 . . . . . 114 VAL N . 51812 2
235 . 1 . 1 83 83 TYR H H 1 7.939 0.001 . 1 . . . . . 115 TYR H . 51812 2
236 . 1 . 1 83 83 TYR CA C 13 62.481 0.000 . 1 . . . . . 115 TYR CA . 51812 2
237 . 1 . 1 83 83 TYR CB C 13 37.165 0.000 . 1 . . . . . 115 TYR CB . 51812 2
238 . 1 . 1 83 83 TYR N N 15 119.915 0.003 . 1 . . . . . 115 TYR N . 51812 2
239 . 1 . 1 84 84 ASP H H 1 8.657 0.000 . 1 . . . . . 116 ASP H . 51812 2
240 . 1 . 1 84 84 ASP CA C 13 57.366 0.000 . 1 . . . . . 116 ASP CA . 51812 2
241 . 1 . 1 84 84 ASP CB C 13 39.947 0.000 . 1 . . . . . 116 ASP CB . 51812 2
242 . 1 . 1 84 84 ASP N N 15 119.888 0.004 . 1 . . . . . 116 ASP N . 51812 2
243 . 1 . 1 85 85 GLU H H 1 7.968 0.000 . 1 . . . . . 117 GLU H . 51812 2
244 . 1 . 1 85 85 GLU CA C 13 58.694 0.000 . 1 . . . . . 117 GLU CA . 51812 2
245 . 1 . 1 85 85 GLU CB C 13 29.095 0.000 . 1 . . . . . 117 GLU CB . 51812 2
246 . 1 . 1 85 85 GLU N N 15 122.156 0.008 . 1 . . . . . 117 GLU N . 51812 2
247 . 1 . 1 86 86 LEU H H 1 7.608 0.006 . 1 . . . . . 118 LEU H . 51812 2
248 . 1 . 1 86 86 LEU CA C 13 55.44 0.033 . 1 . . . . . 118 LEU CA . 51812 2
249 . 1 . 1 86 86 LEU CB C 13 41.303 0.003 . 1 . . . . . 118 LEU CB . 51812 2
250 . 1 . 1 86 86 LEU N N 15 117.488 0.240 . 1 . . . . . 118 LEU N . 51812 2
251 . 1 . 1 87 87 GLY H H 1 7.702 0.008 . 1 . . . . . 119 GLY H . 51812 2
252 . 1 . 1 87 87 GLY CA C 13 45.703 0.000 . 1 . . . . . 119 GLY CA . 51812 2
253 . 1 . 1 87 87 GLY N N 15 106.193 0.002 . 1 . . . . . 119 GLY N . 51812 2
254 . 1 . 1 88 88 GLY H H 1 7.748 0.000 . 1 . . . . . 120 GLY H . 51812 2
255 . 1 . 1 88 88 GLY CA C 13 45.021 0.000 . 1 . . . . . 120 GLY CA . 51812 2
256 . 1 . 1 88 88 GLY N N 15 107.245 0.000 . 1 . . . . . 120 GLY N . 51812 2
257 . 1 . 1 89 89 SER H H 1 8.121 0.000 . 1 . . . . . 121 SER H . 51812 2
258 . 1 . 1 89 89 SER CA C 13 57.278 0.000 . 1 . . . . . 121 SER CA . 51812 2
259 . 1 . 1 89 89 SER CB C 13 63.016 0.000 . 1 . . . . . 121 SER CB . 51812 2
260 . 1 . 1 89 89 SER N N 15 118.058 0.005 . 1 . . . . . 121 SER N . 51812 2
261 . 1 . 1 90 90 PRO CA C 13 63.8 0.000 . 1 . . . . . 122 PRO CA . 51812 2
262 . 1 . 1 90 90 PRO CB C 13 32.27 0.000 . 1 . . . . . 122 PRO CB . 51812 2
263 . 1 . 1 91 91 GLY H H 1 8.763 0.002 . 1 . . . . . 123 GLY H . 51812 2
264 . 1 . 1 91 91 GLY CA C 13 45.773 0.000 . 1 . . . . . 123 GLY CA . 51812 2
265 . 1 . 1 91 91 GLY N N 15 109.095 0.015 . 1 . . . . . 123 GLY N . 51812 2
266 . 1 . 1 92 92 SER H H 1 7.793 0.001 . 1 . . . . . 124 SER H . 51812 2
267 . 1 . 1 92 92 SER CA C 13 57.304 0.000 . 1 . . . . . 124 SER CA . 51812 2
268 . 1 . 1 92 92 SER CB C 13 64.035 0.000 . 1 . . . . . 124 SER CB . 51812 2
269 . 1 . 1 92 92 SER N N 15 115.084 0.000 . 1 . . . . . 124 SER N . 51812 2
270 . 1 . 1 93 93 THR H H 1 8.059 0.000 . 1 . . . . . 125 THR H . 51812 2
271 . 1 . 1 93 93 THR CA C 13 57.963 0.000 . 1 . . . . . 125 THR CA . 51812 2
272 . 1 . 1 93 93 THR N N 15 118.924 0.000 . 1 . . . . . 125 THR N . 51812 2
273 . 1 . 1 94 94 SER H H 1 7.57 0.000 . 1 . . . . . 126 SER H . 51812 2
274 . 1 . 1 94 94 SER CA C 13 58.49 0.000 . 1 . . . . . 126 SER CA . 51812 2
275 . 1 . 1 94 94 SER CB C 13 63.203 0.000 . 1 . . . . . 126 SER CB . 51812 2
276 . 1 . 1 94 94 SER N N 15 118.518 0.000 . 1 . . . . . 126 SER N . 51812 2
277 . 1 . 1 95 95 ALA H H 1 7.247 0.007 . 1 . . . . . 127 ALA H . 51812 2
278 . 1 . 1 95 95 ALA CA C 13 55.558 0.000 . 1 . . . . . 127 ALA CA . 51812 2
279 . 1 . 1 95 95 ALA CB C 13 17.34 0.000 . 1 . . . . . 127 ALA CB . 51812 2
280 . 1 . 1 95 95 ALA N N 15 124.649 0.003 . 1 . . . . . 127 ALA N . 51812 2
281 . 1 . 1 96 96 ALA H H 1 8.481 0.001 . 1 . . . . . 128 ALA H . 51812 2
282 . 1 . 1 96 96 ALA CA C 13 55.983 0.000 . 1 . . . . . 128 ALA CA . 51812 2
283 . 1 . 1 96 96 ALA CB C 13 18.766 0.000 . 1 . . . . . 128 ALA CB . 51812 2
284 . 1 . 1 96 96 ALA N N 15 121.76 0.002 . 1 . . . . . 128 ALA N . 51812 2
285 . 1 . 1 97 97 THR H H 1 7.801 0.002 . 1 . . . . . 129 THR H . 51812 2
286 . 1 . 1 97 97 THR CA C 13 66.062 0.000 . 1 . . . . . 129 THR CA . 51812 2
287 . 1 . 1 97 97 THR CB C 13 68.442 0.000 . 1 . . . . . 129 THR CB . 51812 2
288 . 1 . 1 97 97 THR N N 15 114.363 0.024 . 1 . . . . . 129 THR N . 51812 2
289 . 1 . 1 98 98 CYS H H 1 8.218 0.001 . 1 . . . . . 130 CYS H . 51812 2
290 . 1 . 1 98 98 CYS CA C 13 62.911 0.030 . 1 . . . . . 130 CYS CA . 51812 2
291 . 1 . 1 98 98 CYS CB C 13 26.906 0.009 . 1 . . . . . 130 CYS CB . 51812 2
292 . 1 . 1 98 98 CYS N N 15 119.662 0.006 . 1 . . . . . 130 CYS N . 51812 2
293 . 1 . 1 99 99 THR H H 1 7.804 0.002 . 1 . . . . . 131 THR H . 51812 2
294 . 1 . 1 99 99 THR CA C 13 68.172 0.061 . 1 . . . . . 131 THR CA . 51812 2
295 . 1 . 1 99 99 THR N N 15 116.341 0.018 . 1 . . . . . 131 THR N . 51812 2
296 . 1 . 1 100 100 ARG H H 1 7.225 0.004 . 1 . . . . . 132 ARG H . 51812 2
297 . 1 . 1 100 100 ARG CA C 13 58.992 0.000 . 1 . . . . . 132 ARG CA . 51812 2
298 . 1 . 1 100 100 ARG CB C 13 28.99 0.000 . 1 . . . . . 132 ARG CB . 51812 2
299 . 1 . 1 100 100 ARG N N 15 121.022 0.035 . 1 . . . . . 132 ARG N . 51812 2
300 . 1 . 1 101 101 ARG H H 1 7.731 0.000 . 1 . . . . . 133 ARG H . 51812 2
301 . 1 . 1 101 101 ARG CA C 13 59.09 0.000 . 1 . . . . . 133 ARG CA . 51812 2
302 . 1 . 1 101 101 ARG CB C 13 29.363 0.000 . 1 . . . . . 133 ARG CB . 51812 2
303 . 1 . 1 101 101 ARG N N 15 116.956 0.004 . 1 . . . . . 133 ARG N . 51812 2
304 . 1 . 1 102 102 HIS H H 1 8.424 0.000 . 1 . . . . . 134 HIS H . 51812 2
305 . 1 . 1 102 102 HIS CA C 13 59.14 0.104 . 1 . . . . . 134 HIS CA . 51812 2
306 . 1 . 1 102 102 HIS CB C 13 30.775 0.004 . 1 . . . . . 134 HIS CB . 51812 2
307 . 1 . 1 102 102 HIS N N 15 119.992 0.000 . 1 . . . . . 134 HIS N . 51812 2
308 . 1 . 1 103 103 TYR H H 1 8.324 0.004 . 1 . . . . . 135 TYR H . 51812 2
309 . 1 . 1 103 103 TYR CA C 13 63.408 0.010 . 1 . . . . . 135 TYR CA . 51812 2
310 . 1 . 1 103 103 TYR CB C 13 39.605 0.004 . 1 . . . . . 135 TYR CB . 51812 2
311 . 1 . 1 103 103 TYR N N 15 119.542 0.024 . 1 . . . . . 135 TYR N . 51812 2
312 . 1 . 1 104 104 GLU H H 1 9.055 0.003 . 1 . . . . . 136 GLU H . 51812 2
313 . 1 . 1 104 104 GLU CA C 13 59.135 0.002 . 1 . . . . . 136 GLU CA . 51812 2
314 . 1 . 1 104 104 GLU CB C 13 29.683 0.042 . 1 . . . . . 136 GLU CB . 51812 2
315 . 1 . 1 104 104 GLU N N 15 119.957 0.008 . 1 . . . . . 136 GLU N . 51812 2
316 . 1 . 1 105 105 ARG H H 1 7.788 0.000 . 1 . . . . . 137 ARG H . 51812 2
317 . 1 . 1 105 105 ARG CA C 13 58.672 0.040 . 1 . . . . . 137 ARG CA . 51812 2
318 . 1 . 1 105 105 ARG CB C 13 31.806 0.056 . 1 . . . . . 137 ARG CB . 51812 2
319 . 1 . 1 105 105 ARG N N 15 115.125 0.012 . 1 . . . . . 137 ARG N . 51812 2
320 . 1 . 1 106 106 LEU H H 1 8 0.001 . 1 . . . . . 138 LEU H . 51812 2
321 . 1 . 1 106 106 LEU CA C 13 56.576 0.050 . 1 . . . . . 138 LEU CA . 51812 2
322 . 1 . 1 106 106 LEU CB C 13 44.846 0.013 . 1 . . . . . 138 LEU CB . 51812 2
323 . 1 . 1 106 106 LEU N N 15 113.191 0.009 . 1 . . . . . 138 LEU N . 51812 2
324 . 1 . 1 107 107 VAL H H 1 7.705 0.003 . 1 . . . . . 139 VAL H . 51812 2
325 . 1 . 1 107 107 VAL CA C 13 63.666 0.031 . 1 . . . . . 139 VAL CA . 51812 2
326 . 1 . 1 107 107 VAL CB C 13 34.833 0.007 . 1 . . . . . 139 VAL CB . 51812 2
327 . 1 . 1 107 107 VAL N N 15 114.855 0.023 . 1 . . . . . 139 VAL N . 51812 2
328 . 1 . 1 108 108 LEU H H 1 7.642 0.003 . 1 . . . . . 140 LEU H . 51812 2
329 . 1 . 1 108 108 LEU CA C 13 58.874 0.000 . 1 . . . . . 140 LEU CA . 51812 2
330 . 1 . 1 108 108 LEU CB C 13 40.325 0.000 . 1 . . . . . 140 LEU CB . 51812 2
331 . 1 . 1 108 108 LEU N N 15 119.213 0.034 . 1 . . . . . 140 LEU N . 51812 2
332 . 1 . 1 109 109 PRO CA C 13 66.883 0.022 . 1 . . . . . 141 PRO CA . 51812 2
333 . 1 . 1 109 109 PRO CB C 13 30.767 0.038 . 1 . . . . . 141 PRO CB . 51812 2
334 . 1 . 1 110 110 TYR H H 1 7.867 0.004 . 1 . . . . . 142 TYR H . 51812 2
335 . 1 . 1 110 110 TYR CA C 13 60.087 0.001 . 1 . . . . . 142 TYR CA . 51812 2
336 . 1 . 1 110 110 TYR CB C 13 39.248 0.012 . 1 . . . . . 142 TYR CB . 51812 2
337 . 1 . 1 110 110 TYR N N 15 118.236 0.030 . 1 . . . . . 142 TYR N . 51812 2
338 . 1 . 1 111 111 VAL H H 1 7.887 0.001 . 1 . . . . . 143 VAL H . 51812 2
339 . 1 . 1 111 111 VAL CA C 13 67.366 0.014 . 1 . . . . . 143 VAL CA . 51812 2
340 . 1 . 1 111 111 VAL CB C 13 31.684 0.012 . 1 . . . . . 143 VAL CB . 51812 2
341 . 1 . 1 111 111 VAL N N 15 120.569 0.018 . 1 . . . . . 143 VAL N . 51812 2
342 . 1 . 1 112 112 ARG H H 1 8.673 0.001 . 1 . . . . . 144 ARG H . 51812 2
343 . 1 . 1 112 112 ARG CA C 13 59.979 0.000 . 1 . . . . . 144 ARG CA . 51812 2
344 . 1 . 1 112 112 ARG CB C 13 29.897 0.000 . 1 . . . . . 144 ARG CB . 51812 2
345 . 1 . 1 112 112 ARG N N 15 117.862 0.026 . 1 . . . . . 144 ARG N . 51812 2
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