Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 25268
_Assigned_chem_shift_list.ID 1
_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 $chemical_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 'Origin nmrView file /home/ccpn/svn_web/ccpnmrweb/webapps/uploads/T9tW8iY9eE9jH4eB7jO2lI4vN5cA8bW3vB3nN1jN7kE2oX6tQ9sP6mQ9qJ4s/ppm.out'
_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' . . . 25268 1
2 '2D 1H-13C HSQC' . . . 25268 1
3 '3D HNCO' . . . 25268 1
6 '3D HCCH-TOCSY' . . . 25268 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 $NMRPipe . . 25268 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_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.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 MET HA H 1 3.925 . . 1 . 2 . A 1 MET HA . 25268 1
2 . 1 1 1 1 MET HB3 H 1 2.024 . . 1 . 4 . A 1 MET HB3 . 25268 1
3 . 1 1 1 1 MET HG3 H 1 2.504 . . 1 . 6 . A 1 MET HG3 . 25268 1
4 . 1 1 1 1 MET HE1 H 1 2.086 . . 1 . 8 . A 1 MET HE1 . 25268 1
5 . 1 1 1 1 MET HE2 H 1 2.086 . . 1 . 8 . A 1 MET HE2 . 25268 1
6 . 1 1 1 1 MET HE3 H 1 2.086 . . 1 . 8 . A 1 MET HE3 . 25268 1
7 . 1 1 1 1 MET CA C 13 55.655 . . 1 . 1 . A 1 MET CA . 25268 1
8 . 1 1 1 1 MET CB C 13 34.800 . . 1 . 3 . A 1 MET CB . 25268 1
9 . 1 1 1 1 MET CG C 13 31.600 . . 1 . 5 . A 1 MET CG . 25268 1
10 . 1 1 1 1 MET CE C 13 17.210 . . 1 . 7 . A 1 MET CE . 25268 1
11 . 1 1 2 2 LYS HA H 1 4.400 . . 1 . 10 . A 2 LYS HA . 25268 1
12 . 1 1 2 2 LYS HB3 H 1 1.900 . . 1 . 12 . A 2 LYS HB3 . 25268 1
13 . 1 1 2 2 LYS HG3 H 1 1.500 . . 1 . 14 . A 2 LYS HG3 . 25268 1
14 . 1 1 2 2 LYS HD3 H 1 1.750 . . 1 . 16 . A 2 LYS HD3 . 25268 1
15 . 1 1 2 2 LYS HE3 H 1 3.000 . . 1 . 18 . A 2 LYS HE3 . 25268 1
16 . 1 1 2 2 LYS CA C 13 56.200 . . 1 . 9 . A 2 LYS CA . 25268 1
17 . 1 1 2 2 LYS CB C 13 33.300 . . 1 . 11 . A 2 LYS CB . 25268 1
18 . 1 1 2 2 LYS CG C 13 24.600 . . 1 . 13 . A 2 LYS CG . 25268 1
19 . 1 1 2 2 LYS CD C 13 28.950 . . 1 . 15 . A 2 LYS CD . 25268 1
20 . 1 1 2 2 LYS CE C 13 42.000 . . 1 . 17 . A 2 LYS CE . 25268 1
21 . 1 1 3 3 PHE H H 1 8.333 . . 1 . 20 . A 3 PHE H . 25268 1
22 . 1 1 3 3 PHE HA H 1 4.554 . . 1 . 22 . A 3 PHE HA . 25268 1
23 . 1 1 3 3 PHE HB2 H 1 3.014 . . 1 . 25 . A 3 PHE HB2 . 25268 1
24 . 1 1 3 3 PHE HB3 H 1 3.068 . . 1 . 24 . A 3 PHE HB3 . 25268 1
25 . 1 1 3 3 PHE HD1 H 1 7.212 . . 1 . 26 . A 3 PHE HD1 . 25268 1
26 . 1 1 3 3 PHE HD2 H 1 7.212 . . 1 . 26 . A 3 PHE HD2 . 25268 1
27 . 1 1 3 3 PHE CA C 13 58.080 . . 1 . 21 . A 3 PHE CA . 25268 1
28 . 1 1 3 3 PHE CB C 13 40.155 . . 1 . 23 . A 3 PHE CB . 25268 1
29 . 1 1 3 3 PHE N N 15 120.647 . . 1 . 19 . A 3 PHE N . 25268 1
30 . 1 1 4 4 TYR H H 1 7.835 . . 1 . 28 . A 4 TYR H . 25268 1
31 . 1 1 4 4 TYR HA H 1 4.484 . . 1 . 30 . A 4 TYR HA . 25268 1
32 . 1 1 4 4 TYR HB2 H 1 2.945 . . 1 . 33 . A 4 TYR HB2 . 25268 1
33 . 1 1 4 4 TYR HB3 H 1 3.047 . . 1 . 32 . A 4 TYR HB3 . 25268 1
34 . 1 1 4 4 TYR HD1 H 1 7.047 . . 1 . 34 . A 4 TYR HD1 . 25268 1
35 . 1 1 4 4 TYR HD2 H 1 7.047 . . 1 . 34 . A 4 TYR HD2 . 25268 1
36 . 1 1 4 4 TYR HE1 H 1 6.845 . . 1 . 35 . A 4 TYR HE1 . 25268 1
37 . 1 1 4 4 TYR HE2 H 1 6.845 . . 1 . 35 . A 4 TYR HE2 . 25268 1
38 . 1 1 4 4 TYR CA C 13 58.100 . . 1 . 29 . A 4 TYR CA . 25268 1
39 . 1 1 4 4 TYR CB C 13 38.700 . . 1 . 31 . A 4 TYR CB . 25268 1
40 . 1 1 4 4 TYR N N 15 119.545 . . 1 . 27 . A 4 TYR N . 25268 1
41 . 1 1 5 5 THR H H 1 7.921 . . 1 . 37 . A 5 THR H . 25268 1
42 . 1 1 5 5 THR HA H 1 4.327 . . 1 . 39 . A 5 THR HA . 25268 1
43 . 1 1 5 5 THR HB H 1 4.248 . . 1 . 41 . A 5 THR HB . 25268 1
44 . 1 1 5 5 THR HG21 H 1 1.175 . . 1 . 43 . A 5 THR HG21 . 25268 1
45 . 1 1 5 5 THR HG22 H 1 1.175 . . 1 . 43 . A 5 THR HG22 . 25268 1
46 . 1 1 5 5 THR HG23 H 1 1.175 . . 1 . 43 . A 5 THR HG23 . 25268 1
47 . 1 1 5 5 THR CA C 13 62.200 . . 1 . 38 . A 5 THR CA . 25268 1
48 . 1 1 5 5 THR CB C 13 69.500 . . 1 . 40 . A 5 THR CB . 25268 1
49 . 1 1 5 5 THR CG2 C 13 21.865 . . 1 . 42 . A 5 THR CG2 . 25268 1
50 . 1 1 5 5 THR N N 15 113.849 . . 1 . 36 . A 5 THR N . 25268 1
51 . 1 1 6 6 ILE H H 1 7.877 . . 1 . 45 . A 6 ILE H . 25268 1
52 . 1 1 6 6 ILE HA H 1 4.242 . . 1 . 47 . A 6 ILE HA . 25268 1
53 . 1 1 6 6 ILE HB H 1 1.951 . . 1 . 49 . A 6 ILE HB . 25268 1
54 . 1 1 6 6 ILE HG12 H 1 1.579 . . 1 . 52 . A 6 ILE HG12 . 25268 1
55 . 1 1 6 6 ILE HG13 H 1 1.235 . . 1 . 51 . A 6 ILE HG13 . 25268 1
56 . 1 1 6 6 ILE HG21 H 1 0.920 . . 1 . 56 . A 6 ILE HG21 . 25268 1
57 . 1 1 6 6 ILE HG22 H 1 0.920 . . 1 . 56 . A 6 ILE HG22 . 25268 1
58 . 1 1 6 6 ILE HG23 H 1 0.920 . . 1 . 56 . A 6 ILE HG23 . 25268 1
59 . 1 1 6 6 ILE HD11 H 1 0.896 . . 1 . 54 . A 6 ILE HD11 . 25268 1
60 . 1 1 6 6 ILE HD12 H 1 0.896 . . 1 . 54 . A 6 ILE HD12 . 25268 1
61 . 1 1 6 6 ILE HD13 H 1 0.896 . . 1 . 54 . A 6 ILE HD13 . 25268 1
62 . 1 1 6 6 ILE CA C 13 60.900 . . 1 . 46 . A 6 ILE CA . 25268 1
63 . 1 1 6 6 ILE CB C 13 39.278 . . 1 . 48 . A 6 ILE CB . 25268 1
64 . 1 1 6 6 ILE CG1 C 13 27.561 . . 1 . 50 . A 6 ILE CG1 . 25268 1
65 . 1 1 6 6 ILE CG2 C 13 17.708 . . 1 . 55 . A 6 ILE CG2 . 25268 1
66 . 1 1 6 6 ILE CD1 C 13 13.588 . . 1 . 53 . A 6 ILE CD1 . 25268 1
67 . 1 1 6 6 ILE N N 15 121.812 . . 1 . 44 . A 6 ILE N . 25268 1
68 . 1 1 7 7 LYS H H 1 8.210 . . 1 . 58 . A 7 LYS H . 25268 1
69 . 1 1 7 7 LYS HA H 1 4.466 . . 1 . 60 . A 7 LYS HA . 25268 1
70 . 1 1 7 7 LYS HB3 H 1 1.900 . . 1 . 62 . A 7 LYS HB3 . 25268 1
71 . 1 1 7 7 LYS HG3 H 1 1.500 . . 1 . 64 . A 7 LYS HG3 . 25268 1
72 . 1 1 7 7 LYS HD3 H 1 1.750 . . 1 . 66 . A 7 LYS HD3 . 25268 1
73 . 1 1 7 7 LYS HE3 H 1 3.000 . . 1 . 68 . A 7 LYS HE3 . 25268 1
74 . 1 1 7 7 LYS CA C 13 56.200 . . 1 . 59 . A 7 LYS CA . 25268 1
75 . 1 1 7 7 LYS CB C 13 33.300 . . 1 . 61 . A 7 LYS CB . 25268 1
76 . 1 1 7 7 LYS CG C 13 24.600 . . 1 . 63 . A 7 LYS CG . 25268 1
77 . 1 1 7 7 LYS CD C 13 28.950 . . 1 . 65 . A 7 LYS CD . 25268 1
78 . 1 1 7 7 LYS CE C 13 42.000 . . 1 . 67 . A 7 LYS CE . 25268 1
79 . 1 1 7 7 LYS N N 15 124.588 . . 1 . 57 . A 7 LYS N . 25268 1
80 . 1 1 8 8 LEU H H 1 8.421 . . 1 . 70 . A 8 LEU H . 25268 1
81 . 1 1 8 8 LEU HA H 1 4.508 . . 1 . 72 . A 8 LEU HA . 25268 1
82 . 1 1 8 8 LEU HB2 H 1 1.543 . . 1 . 75 . A 8 LEU HB2 . 25268 1
83 . 1 1 8 8 LEU HB3 H 1 1.726 . . 1 . 74 . A 8 LEU HB3 . 25268 1
84 . 1 1 8 8 LEU HG H 1 1.759 . . 1 . 77 . A 8 LEU HG . 25268 1
85 . 1 1 8 8 LEU HD11 H 1 0.957 . . 1 . 79 . A 8 LEU HD11 . 25268 1
86 . 1 1 8 8 LEU HD12 H 1 0.957 . . 1 . 79 . A 8 LEU HD12 . 25268 1
87 . 1 1 8 8 LEU HD13 H 1 0.957 . . 1 . 79 . A 8 LEU HD13 . 25268 1
88 . 1 1 8 8 LEU HD21 H 1 0.912 . . 1 . 81 . A 8 LEU HD21 . 25268 1
89 . 1 1 8 8 LEU HD22 H 1 0.912 . . 1 . 81 . A 8 LEU HD22 . 25268 1
90 . 1 1 8 8 LEU HD23 H 1 0.912 . . 1 . 81 . A 8 LEU HD23 . 25268 1
91 . 1 1 8 8 LEU CA C 13 54.900 . . 1 . 71 . A 8 LEU CA . 25268 1
92 . 1 1 8 8 LEU CB C 13 41.800 . . 1 . 73 . A 8 LEU CB . 25268 1
93 . 1 1 8 8 LEU CG C 13 27.122 . . 1 . 76 . A 8 LEU CG . 25268 1
94 . 1 1 8 8 LEU CD1 C 13 25.500 . . 1 . 78 . A 8 LEU CD1 . 25268 1
95 . 1 1 8 8 LEU CD2 C 13 24.323 . . 1 . 80 . A 8 LEU CD2 . 25268 1
96 . 1 1 8 8 LEU N N 15 123.110 . . 1 . 69 . A 8 LEU N . 25268 1
97 . 1 1 9 9 PRO HA H 1 4.451 . . 1 . 83 . A 9 PRO HA . 25268 1
98 . 1 1 9 9 PRO HB2 H 1 1.804 . . 1 . 86 . A 9 PRO HB2 . 25268 1
99 . 1 1 9 9 PRO HB3 H 1 2.453 . . 1 . 85 . A 9 PRO HB3 . 25268 1
100 . 1 1 9 9 PRO HG2 H 1 2.070 . . 1 . 89 . A 9 PRO HG2 . 25268 1
101 . 1 1 9 9 PRO HG3 H 1 2.020 . . 1 . 88 . A 9 PRO HG3 . 25268 1
102 . 1 1 9 9 PRO HD2 H 1 3.526 . . 1 . 92 . A 9 PRO HD2 . 25268 1
103 . 1 1 9 9 PRO HD3 H 1 3.963 . . 1 . 91 . A 9 PRO HD3 . 25268 1
104 . 1 1 9 9 PRO CA C 13 63.800 . . 1 . 82 . A 9 PRO CA . 25268 1
105 . 1 1 9 9 PRO CB C 13 31.900 . . 1 . 84 . A 9 PRO CB . 25268 1
106 . 1 1 9 9 PRO CG C 13 28.184 . . 1 . 87 . A 9 PRO CG . 25268 1
107 . 1 1 9 9 PRO CD C 13 50.300 . . 1 . 90 . A 9 PRO CD . 25268 1
108 . 1 1 10 10 LYS HA H 1 4.099 . . 1 . 94 . A 10 LYS HA . 25268 1
109 . 1 1 10 10 LYS HB3 H 1 1.953 . . 1 . 96 . A 10 LYS HB3 . 25268 1
110 . 1 1 10 10 LYS HG2 H 1 1.489 . . 1 . 99 . A 10 LYS HG2 . 25268 1
111 . 1 1 10 10 LYS HG3 H 1 1.592 . . 1 . 98 . A 10 LYS HG3 . 25268 1
112 . 1 1 10 10 LYS HD3 H 1 1.751 . . 1 . 101 . A 10 LYS HD3 . 25268 1
113 . 1 1 10 10 LYS HE3 H 1 3.056 . . 1 . 103 . A 10 LYS HE3 . 25268 1
114 . 1 1 10 10 LYS CA C 13 59.200 . . 1 . 93 . A 10 LYS CA . 25268 1
115 . 1 1 10 10 LYS CB C 13 32.400 . . 1 . 95 . A 10 LYS CB . 25268 1
116 . 1 1 10 10 LYS CG C 13 25.500 . . 1 . 97 . A 10 LYS CG . 25268 1
117 . 1 1 10 10 LYS CD C 13 29.200 . . 1 . 100 . A 10 LYS CD . 25268 1
118 . 1 1 10 10 LYS CE C 13 41.900 . . 1 . 102 . A 10 LYS CE . 25268 1
119 . 1 1 11 11 PHE H H 1 8.385 . . 1 . 105 . A 11 PHE H . 25268 1
120 . 1 1 11 11 PHE HA H 1 4.573 . . 1 . 107 . A 11 PHE HA . 25268 1
121 . 1 1 11 11 PHE HB2 H 1 3.209 . . 1 . 110 . A 11 PHE HB2 . 25268 1
122 . 1 1 11 11 PHE HB3 H 1 3.366 . . 1 . 109 . A 11 PHE HB3 . 25268 1
123 . 1 1 11 11 PHE HD1 H 1 7.349 . . 1 . 111 . A 11 PHE HD1 . 25268 1
124 . 1 1 11 11 PHE HD2 H 1 7.349 . . 1 . 111 . A 11 PHE HD2 . 25268 1
125 . 1 1 11 11 PHE CA C 13 59.646 . . 1 . 106 . A 11 PHE CA . 25268 1
126 . 1 1 11 11 PHE CB C 13 38.700 . . 1 . 108 . A 11 PHE CB . 25268 1
127 . 1 1 11 11 PHE N N 15 117.741 . . 1 . 104 . A 11 PHE N . 25268 1
128 . 1 1 12 12 LEU H H 1 7.717 . . 1 . 113 . A 12 LEU H . 25268 1
129 . 1 1 12 12 LEU HA H 1 4.045 . . 1 . 115 . A 12 LEU HA . 25268 1
130 . 1 1 12 12 LEU HB2 H 1 1.534 . . 1 . 118 . A 12 LEU HB2 . 25268 1
131 . 1 1 12 12 LEU HB3 H 1 1.637 . . 1 . 117 . A 12 LEU HB3 . 25268 1
132 . 1 1 12 12 LEU HD11 H 1 0.917 . . 1 . 121 . A 12 LEU HD11 . 25268 1
133 . 1 1 12 12 LEU HD12 H 1 0.917 . . 1 . 121 . A 12 LEU HD12 . 25268 1
134 . 1 1 12 12 LEU HD13 H 1 0.917 . . 1 . 121 . A 12 LEU HD13 . 25268 1
135 . 1 1 12 12 LEU HD21 H 1 0.880 . . 1 . 123 . A 12 LEU HD21 . 25268 1
136 . 1 1 12 12 LEU HD22 H 1 0.880 . . 1 . 123 . A 12 LEU HD22 . 25268 1
137 . 1 1 12 12 LEU HD23 H 1 0.880 . . 1 . 123 . A 12 LEU HD23 . 25268 1
138 . 1 1 12 12 LEU CA C 13 56.935 . . 1 . 114 . A 12 LEU CA . 25268 1
139 . 1 1 12 12 LEU CB C 13 42.158 . . 1 . 116 . A 12 LEU CB . 25268 1
140 . 1 1 12 12 LEU CG C 13 26.700 . . 1 . 119 . A 12 LEU CG . 25268 1
141 . 1 1 12 12 LEU CD1 C 13 25.289 . . 1 . 120 . A 12 LEU CD1 . 25268 1
142 . 1 1 12 12 LEU CD2 C 13 24.212 . . 1 . 122 . A 12 LEU CD2 . 25268 1
143 . 1 1 12 12 LEU N N 15 118.903 . . 1 . 112 . A 12 LEU N . 25268 1
144 . 1 1 13 13 GLY H H 1 8.402 . . 1 . 125 . A 13 GLY H . 25268 1
145 . 1 1 13 13 GLY HA2 H 1 4.062 . . 1 . 128 . A 13 GLY HA2 . 25268 1
146 . 1 1 13 13 GLY HA3 H 1 3.690 . . 1 . 127 . A 13 GLY HA3 . 25268 1
147 . 1 1 13 13 GLY CA C 13 47.544 . . 1 . 126 . A 13 GLY CA . 25268 1
148 . 1 1 13 13 GLY N N 15 106.373 . . 1 . 124 . A 13 GLY N . 25268 1
149 . 1 1 14 14 GLY H H 1 8.110 . . 1 . 130 . A 14 GLY H . 25268 1
150 . 1 1 14 14 GLY HA3 H 1 3.965 . . 1 . 132 . A 14 GLY HA3 . 25268 1
151 . 1 1 14 14 GLY CA C 13 47.000 . . 1 . 131 . A 14 GLY CA . 25268 1
152 . 1 1 14 14 GLY N N 15 108.291 . . 1 . 129 . A 14 GLY N . 25268 1
153 . 1 1 15 15 ILE H H 1 7.723 . . 1 . 134 . A 15 ILE H . 25268 1
154 . 1 1 15 15 ILE HA H 1 3.861 . . 1 . 136 . A 15 ILE HA . 25268 1
155 . 1 1 15 15 ILE HB H 1 2.053 . . 1 . 138 . A 15 ILE HB . 25268 1
156 . 1 1 15 15 ILE HG12 H 1 1.731 . . 1 . 141 . A 15 ILE HG12 . 25268 1
157 . 1 1 15 15 ILE HG13 H 1 1.169 . . 1 . 140 . A 15 ILE HG13 . 25268 1
158 . 1 1 15 15 ILE HG21 H 1 0.951 . . 1 . 145 . A 15 ILE HG21 . 25268 1
159 . 1 1 15 15 ILE HG22 H 1 0.951 . . 1 . 145 . A 15 ILE HG22 . 25268 1
160 . 1 1 15 15 ILE HG23 H 1 0.951 . . 1 . 145 . A 15 ILE HG23 . 25268 1
161 . 1 1 15 15 ILE HD11 H 1 0.853 . . 1 . 143 . A 15 ILE HD11 . 25268 1
162 . 1 1 15 15 ILE HD12 H 1 0.853 . . 1 . 143 . A 15 ILE HD12 . 25268 1
163 . 1 1 15 15 ILE HD13 H 1 0.853 . . 1 . 143 . A 15 ILE HD13 . 25268 1
164 . 1 1 15 15 ILE CA C 13 64.570 . . 1 . 135 . A 15 ILE CA . 25268 1
165 . 1 1 15 15 ILE CB C 13 37.851 . . 1 . 137 . A 15 ILE CB . 25268 1
166 . 1 1 15 15 ILE CG1 C 13 28.813 . . 1 . 139 . A 15 ILE CG1 . 25268 1
167 . 1 1 15 15 ILE CG2 C 13 17.568 . . 1 . 144 . A 15 ILE CG2 . 25268 1
168 . 1 1 15 15 ILE CD1 C 13 13.501 . . 1 . 142 . A 15 ILE CD1 . 25268 1
169 . 1 1 15 15 ILE N N 15 121.990 . . 1 . 133 . A 15 ILE N . 25268 1
170 . 1 1 16 16 VAL H H 1 8.049 . . 1 . 147 . A 16 VAL H . 25268 1
171 . 1 1 16 16 VAL HA H 1 3.612 . . 1 . 149 . A 16 VAL HA . 25268 1
172 . 1 1 16 16 VAL HB H 1 2.234 . . 1 . 151 . A 16 VAL HB . 25268 1
173 . 1 1 16 16 VAL HG11 H 1 0.968 . . 1 . 155 . A 16 VAL HG11 . 25268 1
174 . 1 1 16 16 VAL HG12 H 1 0.968 . . 1 . 155 . A 16 VAL HG12 . 25268 1
175 . 1 1 16 16 VAL HG13 H 1 0.968 . . 1 . 155 . A 16 VAL HG13 . 25268 1
176 . 1 1 16 16 VAL HG21 H 1 1.060 . . 1 . 153 . A 16 VAL HG21 . 25268 1
177 . 1 1 16 16 VAL HG22 H 1 1.060 . . 1 . 153 . A 16 VAL HG22 . 25268 1
178 . 1 1 16 16 VAL HG23 H 1 1.060 . . 1 . 153 . A 16 VAL HG23 . 25268 1
179 . 1 1 16 16 VAL CA C 13 67.200 . . 1 . 148 . A 16 VAL CA . 25268 1
180 . 1 1 16 16 VAL CB C 13 31.342 . . 1 . 150 . A 16 VAL CB . 25268 1
181 . 1 1 16 16 VAL CG1 C 13 21.854 . . 1 . 154 . A 16 VAL CG1 . 25268 1
182 . 1 1 16 16 VAL CG2 C 13 23.254 . . 1 . 152 . A 16 VAL CG2 . 25268 1
183 . 1 1 16 16 VAL N N 15 119.530 . . 1 . 146 . A 16 VAL N . 25268 1
184 . 1 1 17 17 ARG H H 1 8.247 . . 1 . 157 . A 17 ARG H . 25268 1
185 . 1 1 17 17 ARG HA H 1 3.962 . . 1 . 159 . A 17 ARG HA . 25268 1
186 . 1 1 17 17 ARG HB3 H 1 1.955 . . 1 . 161 . A 17 ARG HB3 . 25268 1
187 . 1 1 17 17 ARG HG2 H 1 1.866 . . 1 . 164 . A 17 ARG HG2 . 25268 1
188 . 1 1 17 17 ARG HG3 H 1 1.630 . . 1 . 163 . A 17 ARG HG3 . 25268 1
189 . 1 1 17 17 ARG HD3 H 1 3.250 . . 1 . 166 . A 17 ARG HD3 . 25268 1
190 . 1 1 17 17 ARG CA C 13 60.100 . . 1 . 158 . A 17 ARG CA . 25268 1
191 . 1 1 17 17 ARG CB C 13 30.100 . . 1 . 160 . A 17 ARG CB . 25268 1
192 . 1 1 17 17 ARG CG C 13 28.500 . . 1 . 162 . A 17 ARG CG . 25268 1
193 . 1 1 17 17 ARG CD C 13 43.200 . . 1 . 165 . A 17 ARG CD . 25268 1
194 . 1 1 17 17 ARG N N 15 118.293 . . 1 . 156 . A 17 ARG N . 25268 1
195 . 1 1 18 18 ALA H H 1 7.874 . . 1 . 168 . A 18 ALA H . 25268 1
196 . 1 1 18 18 ALA HA H 1 4.226 . . 1 . 170 . A 18 ALA HA . 25268 1
197 . 1 1 18 18 ALA HB1 H 1 1.565 . . 1 . 172 . A 18 ALA HB1 . 25268 1
198 . 1 1 18 18 ALA HB2 H 1 1.565 . . 1 . 172 . A 18 ALA HB2 . 25268 1
199 . 1 1 18 18 ALA HB3 H 1 1.565 . . 1 . 172 . A 18 ALA HB3 . 25268 1
200 . 1 1 18 18 ALA CA C 13 54.700 . . 1 . 169 . A 18 ALA CA . 25268 1
201 . 1 1 18 18 ALA CB C 13 18.306 . . 1 . 171 . A 18 ALA CB . 25268 1
202 . 1 1 18 18 ALA N N 15 121.103 . . 1 . 167 . A 18 ALA N . 25268 1
203 . 1 1 19 19 MET H H 1 8.174 . . 1 . 174 . A 19 MET H . 25268 1
204 . 1 1 19 19 MET HA H 1 4.192 . . 1 . 176 . A 19 MET HA . 25268 1
205 . 1 1 19 19 MET HB2 H 1 2.151 . . 1 . 179 . A 19 MET HB2 . 25268 1
206 . 1 1 19 19 MET HB3 H 1 2.312 . . 1 . 178 . A 19 MET HB3 . 25268 1
207 . 1 1 19 19 MET HG2 H 1 2.539 . . 1 . 182 . A 19 MET HG2 . 25268 1
208 . 1 1 19 19 MET HG3 H 1 2.809 . . 1 . 181 . A 19 MET HG3 . 25268 1
209 . 1 1 19 19 MET HE1 H 1 2.037 . . 1 . 184 . A 19 MET HE1 . 25268 1
210 . 1 1 19 19 MET HE2 H 1 2.037 . . 1 . 184 . A 19 MET HE2 . 25268 1
211 . 1 1 19 19 MET HE3 H 1 2.037 . . 1 . 184 . A 19 MET HE3 . 25268 1
212 . 1 1 19 19 MET CA C 13 58.650 . . 1 . 175 . A 19 MET CA . 25268 1
213 . 1 1 19 19 MET CB C 13 33.413 . . 1 . 177 . A 19 MET CB . 25268 1
214 . 1 1 19 19 MET CG C 13 32.789 . . 1 . 180 . A 19 MET CG . 25268 1
215 . 1 1 19 19 MET CE C 13 17.296 . . 1 . 183 . A 19 MET CE . 25268 1
216 . 1 1 19 19 MET N N 15 116.847 . . 1 . 173 . A 19 MET N . 25268 1
217 . 1 1 20 20 LEU H H 1 8.178 . . 1 . 186 . A 20 LEU H . 25268 1
218 . 1 1 20 20 LEU HA H 1 4.271 . . 1 . 188 . A 20 LEU HA . 25268 1
219 . 1 1 20 20 LEU HB2 H 1 1.676 . . 1 . 191 . A 20 LEU HB2 . 25268 1
220 . 1 1 20 20 LEU HB3 H 1 1.900 . . 1 . 190 . A 20 LEU HB3 . 25268 1
221 . 1 1 20 20 LEU HG H 1 1.929 . . 1 . 193 . A 20 LEU HG . 25268 1
222 . 1 1 20 20 LEU HD11 H 1 0.927 . . 1 . 195 . A 20 LEU HD11 . 25268 1
223 . 1 1 20 20 LEU HD12 H 1 0.927 . . 1 . 195 . A 20 LEU HD12 . 25268 1
224 . 1 1 20 20 LEU HD13 H 1 0.927 . . 1 . 195 . A 20 LEU HD13 . 25268 1
225 . 1 1 20 20 LEU HD21 H 1 0.910 . . 1 . 197 . A 20 LEU HD21 . 25268 1
226 . 1 1 20 20 LEU HD22 H 1 0.910 . . 1 . 197 . A 20 LEU HD22 . 25268 1
227 . 1 1 20 20 LEU HD23 H 1 0.910 . . 1 . 197 . A 20 LEU HD23 . 25268 1
228 . 1 1 20 20 LEU CA C 13 56.878 . . 1 . 187 . A 20 LEU CA . 25268 1
229 . 1 1 20 20 LEU CB C 13 41.900 . . 1 . 189 . A 20 LEU CB . 25268 1
230 . 1 1 20 20 LEU CG C 13 27.115 . . 1 . 192 . A 20 LEU CG . 25268 1
231 . 1 1 20 20 LEU CD1 C 13 25.771 . . 1 . 194 . A 20 LEU CD1 . 25268 1
232 . 1 1 20 20 LEU CD2 C 13 23.385 . . 1 . 196 . A 20 LEU CD2 . 25268 1
233 . 1 1 20 20 LEU N N 15 117.531 . . 1 . 185 . A 20 LEU N . 25268 1
234 . 1 1 21 21 GLY H H 1 8.006 . . 1 . 199 . A 21 GLY H . 25268 1
235 . 1 1 21 21 GLY HA3 H 1 4.009 . . 1 . 201 . A 21 GLY HA3 . 25268 1
236 . 1 1 21 21 GLY CA C 13 46.400 . . 1 . 200 . A 21 GLY CA . 25268 1
237 . 1 1 21 21 GLY N N 15 105.942 . . 1 . 198 . A 21 GLY N . 25268 1
238 . 1 1 22 22 SER H H 1 7.859 . . 1 . 203 . A 22 SER H . 25268 1
239 . 1 1 22 22 SER HA H 1 4.273 . . 1 . 205 . A 22 SER HA . 25268 1
240 . 1 1 22 22 SER HB3 H 1 3.805 . . 1 . 207 . A 22 SER HB3 . 25268 1
241 . 1 1 22 22 SER CA C 13 59.500 . . 1 . 204 . A 22 SER CA . 25268 1
242 . 1 1 22 22 SER CB C 13 63.580 . . 1 . 206 . A 22 SER CB . 25268 1
243 . 1 1 22 22 SER N N 15 115.031 . . 1 . 202 . A 22 SER N . 25268 1
244 . 1 1 23 23 PHE H H 1 7.837 . . 1 . 209 . A 23 PHE H . 25268 1
245 . 1 1 23 23 PHE HA H 1 4.621 . . 1 . 211 . A 23 PHE HA . 25268 1
246 . 1 1 23 23 PHE HB2 H 1 3.295 . . 1 . 214 . A 23 PHE HB2 . 25268 1
247 . 1 1 23 23 PHE HB3 H 1 3.069 . . 1 . 213 . A 23 PHE HB3 . 25268 1
248 . 1 1 23 23 PHE HD1 H 1 7.383 . . 1 . 215 . A 23 PHE HD1 . 25268 1
249 . 1 1 23 23 PHE HD2 H 1 7.383 . . 1 . 215 . A 23 PHE HD2 . 25268 1
250 . 1 1 23 23 PHE CA C 13 58.100 . . 1 . 210 . A 23 PHE CA . 25268 1
251 . 1 1 23 23 PHE CB C 13 39.670 . . 1 . 212 . A 23 PHE CB . 25268 1
252 . 1 1 23 23 PHE N N 15 119.803 . . 1 . 208 . A 23 PHE N . 25268 1
253 . 1 1 24 24 ARG H H 1 7.886 . . 1 . 217 . A 24 ARG H . 25268 1
254 . 1 1 24 24 ARG HA H 1 4.366 . . 1 . 219 . A 24 ARG HA . 25268 1
255 . 1 1 24 24 ARG HB2 H 1 1.820 . . 1 . 222 . A 24 ARG HB2 . 25268 1
256 . 1 1 24 24 ARG HB3 H 1 1.940 . . 1 . 221 . A 24 ARG HB3 . 25268 1
257 . 1 1 24 24 ARG HG2 H 1 1.629 . . 1 . 225 . A 24 ARG HG2 . 25268 1
258 . 1 1 24 24 ARG HG3 H 1 1.676 . . 1 . 224 . A 24 ARG HG3 . 25268 1
259 . 1 1 24 24 ARG HD3 H 1 3.236 . . 1 . 227 . A 24 ARG HD3 . 25268 1
260 . 1 1 24 24 ARG CA C 13 55.980 . . 1 . 218 . A 24 ARG CA . 25268 1
261 . 1 1 24 24 ARG CB C 13 31.152 . . 1 . 220 . A 24 ARG CB . 25268 1
262 . 1 1 24 24 ARG CG C 13 27.140 . . 1 . 223 . A 24 ARG CG . 25268 1
263 . 1 1 24 24 ARG CD C 13 43.550 . . 1 . 226 . A 24 ARG CD . 25268 1
264 . 1 1 24 24 ARG N N 15 120.811 . . 1 . 216 . A 24 ARG N . 25268 1
265 . 1 1 25 25 LYS H H 1 8.359 . . 1 . 229 . A 25 LYS H . 25268 1
266 . 1 1 25 25 LYS HA H 1 4.400 . . 1 . 231 . A 25 LYS HA . 25268 1
267 . 1 1 25 25 LYS HB3 H 1 1.900 . . 1 . 233 . A 25 LYS HB3 . 25268 1
268 . 1 1 25 25 LYS HG3 H 1 1.500 . . 1 . 235 . A 25 LYS HG3 . 25268 1
269 . 1 1 25 25 LYS HD3 H 1 1.750 . . 1 . 237 . A 25 LYS HD3 . 25268 1
270 . 1 1 25 25 LYS HE3 H 1 3.000 . . 1 . 239 . A 25 LYS HE3 . 25268 1
271 . 1 1 25 25 LYS CA C 13 56.200 . . 1 . 230 . A 25 LYS CA . 25268 1
272 . 1 1 25 25 LYS CB C 13 33.300 . . 1 . 232 . A 25 LYS CB . 25268 1
273 . 1 1 25 25 LYS CG C 13 24.600 . . 1 . 234 . A 25 LYS CG . 25268 1
274 . 1 1 25 25 LYS CD C 13 28.950 . . 1 . 236 . A 25 LYS CD . 25268 1
275 . 1 1 25 25 LYS CE C 13 42.000 . . 1 . 238 . A 25 LYS CE . 25268 1
276 . 1 1 25 25 LYS N N 15 123.162 . . 1 . 228 . A 25 LYS N . 25268 1
277 . 1 1 26 26 ASP H H 1 7.970 . . 1 . 241 . A 26 ASP H . 25268 1
278 . 1 1 26 26 ASP HA H 1 4.416 . . 1 . 243 . A 26 ASP HA . 25268 1
279 . 1 1 26 26 ASP HB2 H 1 2.590 . . 1 . 246 . A 26 ASP HB2 . 25268 1
280 . 1 1 26 26 ASP HB3 H 1 2.686 . . 1 . 245 . A 26 ASP HB3 . 25268 1
281 . 1 1 26 26 ASP CA C 13 55.500 . . 1 . 242 . A 26 ASP CA . 25268 1
282 . 1 1 26 26 ASP CB C 13 42.400 . . 1 . 244 . A 26 ASP CB . 25268 1
283 . 1 1 26 26 ASP N N 15 126.983 . . 1 . 240 . A 26 ASP N . 25268 1
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