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 51531
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name 'assigned chem shift list 2'
_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 0.1
_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
6 '2D 1H-1H COSY' . . . 51531 2
7 '2D 1H-1H TOCSY' . . . 51531 2
8 '2D 1H-1H NOESY' . . . 51531 2
9 '2D 1H-13C HSQC aromatic' . . . 51531 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 . . 51531 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 1 1 ASN HA H 1 3.693 0.002 . 1 . . . . . 1 ASN HA . 51531 2
2 . 1 . 1 1 1 ASN HB2 H 1 2.575 0.004 . 2 . . . . . 1 ASN HB2 . 51531 2
3 . 1 . 1 1 1 ASN HB3 H 1 2.636 0.006 . 2 . . . . . 1 ASN HB3 . 51531 2
4 . 1 . 1 1 1 ASN CA C 13 53.718 0.000 . 1 . . . . . 1 ASN CA . 51531 2
5 . 1 . 1 1 1 ASN CB C 13 41.508 0.013 . 1 . . . . . 1 ASN CB . 51531 2
6 . 1 . 1 2 2 TRP HA H 1 4.450 0.004 . 1 . . . . . 2 TRP HA . 51531 2
7 . 1 . 1 2 2 TRP HB2 H 1 3.190 0.004 . 2 . . . . . 2 TRP HB2 . 51531 2
8 . 1 . 1 2 2 TRP HB3 H 1 3.292 0.005 . 2 . . . . . 2 TRP HB3 . 51531 2
9 . 1 . 1 2 2 TRP HD1 H 1 7.081 0.000 . 1 . . . . . 2 TRP HD1 . 51531 2
10 . 1 . 1 2 2 TRP HE3 H 1 7.446 0.003 . 1 . . . . . 2 TRP HE3 . 51531 2
11 . 1 . 1 2 2 TRP HZ2 H 1 7.443 0.003 . 1 . . . . . 2 TRP HZ2 . 51531 2
12 . 1 . 1 2 2 TRP HZ3 H 1 7.138 0.002 . 1 . . . . . 2 TRP HZ3 . 51531 2
13 . 1 . 1 2 2 TRP HH2 H 1 7.232 0.000 . 1 . . . . . 2 TRP HH2 . 51531 2
14 . 1 . 1 2 2 TRP CA C 13 58.909 0.000 . 1 . . . . . 2 TRP CA . 51531 2
15 . 1 . 1 2 2 TRP CB C 13 29.006 0.005 . 1 . . . . . 2 TRP CB . 51531 2
16 . 1 . 1 3 3 PHE HA H 1 4.245 0.004 . 1 . . . . . 3 PHE HA . 51531 2
17 . 1 . 1 3 3 PHE HB2 H 1 2.826 0.002 . 2 . . . . . 3 PHE HB2 . 51531 2
18 . 1 . 1 3 3 PHE HB3 H 1 2.826 0.002 . 2 . . . . . 3 PHE HB3 . 51531 2
19 . 1 . 1 3 3 PHE HD1 H 1 7.033 0.003 . 1 . . . . . 3 PHE HD1 . 51531 2
20 . 1 . 1 3 3 PHE HD2 H 1 7.033 0.003 . 1 . . . . . 3 PHE HD2 . 51531 2
21 . 1 . 1 3 3 PHE HE1 H 1 7.281 0.001 . 1 . . . . . 3 PHE HE1 . 51531 2
22 . 1 . 1 3 3 PHE HE2 H 1 7.281 0.001 . 1 . . . . . 3 PHE HE2 . 51531 2
23 . 1 . 1 3 3 PHE HZ H 1 7.231 0.002 . 1 . . . . . 3 PHE HZ . 51531 2
24 . 1 . 1 3 3 PHE CA C 13 60.180 0.000 . 1 . . . . . 3 PHE CA . 51531 2
25 . 1 . 1 3 3 PHE CB C 13 38.543 0.000 . 1 . . . . . 3 PHE CB . 51531 2
26 . 1 . 1 4 4 ASP HA H 1 4.589 0.006 . 1 . . . . . 4 ASP HA . 51531 2
27 . 1 . 1 4 4 ASP HB2 H 1 2.695 0.004 . 2 . . . . . 4 ASP HB2 . 51531 2
28 . 1 . 1 4 4 ASP HB3 H 1 2.756 0.003 . 2 . . . . . 4 ASP HB3 . 51531 2
29 . 1 . 1 4 4 ASP CA C 13 55.503 0.000 . 1 . . . . . 4 ASP CA . 51531 2
30 . 1 . 1 4 4 ASP CB C 13 40.821 0.002 . 1 . . . . . 4 ASP CB . 51531 2
31 . 1 . 1 5 5 ILE HA H 1 3.976 0.002 . 1 . . . . . 5 ILE HA . 51531 2
32 . 1 . 1 5 5 ILE HB H 1 1.918 0.004 . 1 . . . . . 5 ILE HB . 51531 2
33 . 1 . 1 5 5 ILE HG12 H 1 1.295 0.002 . 2 . . . . . 5 ILE HG12 . 51531 2
34 . 1 . 1 5 5 ILE HG13 H 1 1.590 0.001 . 2 . . . . . 5 ILE HG13 . 51531 2
35 . 1 . 1 5 5 ILE HG21 H 1 0.997 0.002 . 1 . . . . . 5 ILE QG2 . 51531 2
36 . 1 . 1 5 5 ILE HG22 H 1 0.997 0.002 . 1 . . . . . 5 ILE QG2 . 51531 2
37 . 1 . 1 5 5 ILE HG23 H 1 0.997 0.002 . 1 . . . . . 5 ILE QG2 . 51531 2
38 . 1 . 1 5 5 ILE HD11 H 1 0.904 0.002 . 1 . . . . . 5 ILE QD1 . 51531 2
39 . 1 . 1 5 5 ILE HD12 H 1 0.904 0.002 . 1 . . . . . 5 ILE QD1 . 51531 2
40 . 1 . 1 5 5 ILE HD13 H 1 0.904 0.002 . 1 . . . . . 5 ILE QD1 . 51531 2
41 . 1 . 1 5 5 ILE CA C 13 64.069 0.000 . 1 . . . . . 5 ILE CA . 51531 2
42 . 1 . 1 5 5 ILE CB C 13 38.516 0.000 . 1 . . . . . 5 ILE CB . 51531 2
43 . 1 . 1 5 5 ILE CG1 C 13 28.384 0.007 . 1 . . . . . 5 ILE CG1 . 51531 2
44 . 1 . 1 5 5 ILE CG2 C 13 16.778 0.000 . 1 . . . . . 5 ILE CG2 . 51531 2
45 . 1 . 1 5 5 ILE CD1 C 13 12.403 0.000 . 1 . . . . . 5 ILE CD1 . 51531 2
46 . 1 . 1 6 6 THR HA H 1 4.037 0.001 . 1 . . . . . 6 THR HA . 51531 2
47 . 1 . 1 6 6 THR HB H 1 4.207 0.002 . 1 . . . . . 6 THR HB . 51531 2
48 . 1 . 1 6 6 THR HG21 H 1 1.211 0.002 . 1 . . . . . 6 THR QG2 . 51531 2
49 . 1 . 1 6 6 THR HG22 H 1 1.211 0.002 . 1 . . . . . 6 THR QG2 . 51531 2
50 . 1 . 1 6 6 THR HG23 H 1 1.211 0.002 . 1 . . . . . 6 THR QG2 . 51531 2
51 . 1 . 1 6 6 THR CA C 13 65.259 0.000 . 1 . . . . . 6 THR CA . 51531 2
52 . 1 . 1 6 6 THR CB C 13 69.024 0.000 . 1 . . . . . 6 THR CB . 51531 2
53 . 1 . 1 6 6 THR CG2 C 13 21.062 0.000 . 1 . . . . . 6 THR CG2 . 51531 2
54 . 1 . 1 7 7 ASN HA H 1 4.679 0.001 . 1 . . . . . 7 ASN HA . 51531 2
55 . 1 . 1 7 7 ASN HB2 H 1 2.717 0.008 . 2 . . . . . 7 ASN HB2 . 51531 2
56 . 1 . 1 7 7 ASN HB3 H 1 2.788 0.006 . 2 . . . . . 7 ASN HB3 . 51531 2
57 . 1 . 1 7 7 ASN CA C 13 55.336 0.000 . 1 . . . . . 7 ASN CA . 51531 2
58 . 1 . 1 7 7 ASN CB C 13 38.604 0.008 . 1 . . . . . 7 ASN CB . 51531 2
59 . 1 . 1 8 8 TRP HA H 1 4.713 0.002 . 1 . . . . . 8 TRP HA . 51531 2
60 . 1 . 1 8 8 TRP HB2 H 1 3.367 0.001 . 2 . . . . . 8 TRP HB2 . 51531 2
61 . 1 . 1 8 8 TRP HB3 H 1 3.519 0.004 . 2 . . . . . 8 TRP HB3 . 51531 2
62 . 1 . 1 8 8 TRP HD1 H 1 7.212 0.000 . 1 . . . . . 8 TRP HD1 . 51531 2
63 . 1 . 1 8 8 TRP HE3 H 1 7.566 0.002 . 1 . . . . . 8 TRP HE3 . 51531 2
64 . 1 . 1 8 8 TRP HZ2 H 1 7.376 0.001 . 1 . . . . . 8 TRP HZ2 . 51531 2
65 . 1 . 1 8 8 TRP HZ3 H 1 7.028 0.003 . 1 . . . . . 8 TRP HZ3 . 51531 2
66 . 1 . 1 8 8 TRP HH2 H 1 7.169 0.002 . 1 . . . . . 8 TRP HH2 . 51531 2
67 . 1 . 1 8 8 TRP CA C 13 59.468 0.000 . 1 . . . . . 8 TRP CA . 51531 2
68 . 1 . 1 8 8 TRP CB C 13 29.358 0.024 . 1 . . . . . 8 TRP CB . 51531 2
69 . 1 . 1 9 9 LEU HA H 1 4.038 0.003 . 1 . . . . . 9 LEU HA . 51531 2
70 . 1 . 1 9 9 LEU HB2 H 1 1.484 0.004 . 2 . . . . . 9 LEU HB2 . 51531 2
71 . 1 . 1 9 9 LEU HB3 H 1 1.762 0.006 . 2 . . . . . 9 LEU HB3 . 51531 2
72 . 1 . 1 9 9 LEU HG H 1 1.755 0.005 . 1 . . . . . 9 LEU HG . 51531 2
73 . 1 . 1 9 9 LEU HD11 H 1 0.858 0.004 . 2 . . . . . 9 LEU QD1 . 51531 2
74 . 1 . 1 9 9 LEU HD12 H 1 0.858 0.004 . 2 . . . . . 9 LEU QD1 . 51531 2
75 . 1 . 1 9 9 LEU HD13 H 1 0.858 0.004 . 2 . . . . . 9 LEU QD1 . 51531 2
76 . 1 . 1 9 9 LEU HD21 H 1 0.921 0.004 . 2 . . . . . 9 LEU QD2 . 51531 2
77 . 1 . 1 9 9 LEU HD22 H 1 0.921 0.004 . 2 . . . . . 9 LEU QD2 . 51531 2
78 . 1 . 1 9 9 LEU HD23 H 1 0.921 0.004 . 2 . . . . . 9 LEU QD2 . 51531 2
79 . 1 . 1 9 9 LEU CA C 13 57.653 0.000 . 1 . . . . . 9 LEU CA . 51531 2
80 . 1 . 1 9 9 LEU CB C 13 41.722 0.021 . 1 . . . . . 9 LEU CB . 51531 2
81 . 1 . 1 9 9 LEU CG C 13 26.820 0.000 . 1 . . . . . 9 LEU CG . 51531 2
82 . 1 . 1 9 9 LEU CD1 C 13 22.435 0.000 . 1 . . . . . 9 LEU CD1 . 51531 2
83 . 1 . 1 9 9 LEU CD2 C 13 24.200 0.000 . 1 . . . . . 9 LEU CD2 . 51531 2
84 . 1 . 1 10 10 TRP HA H 1 4.248 0.003 . 1 . . . . . 10 TRP HA . 51531 2
85 . 1 . 1 10 10 TRP HB2 H 1 3.323 0.003 . 2 . . . . . 10 TRP HB2 . 51531 2
86 . 1 . 1 10 10 TRP HB3 H 1 3.378 0.006 . 2 . . . . . 10 TRP HB3 . 51531 2
87 . 1 . 1 10 10 TRP HD1 H 1 7.036 0.008 . 1 . . . . . 10 TRP HD1 . 51531 2
88 . 1 . 1 10 10 TRP HE3 H 1 7.341 0.002 . 1 . . . . . 10 TRP HE3 . 51531 2
89 . 1 . 1 10 10 TRP HZ2 H 1 7.390 0.004 . 1 . . . . . 10 TRP HZ2 . 51531 2
90 . 1 . 1 10 10 TRP HZ3 H 1 7.066 0.004 . 1 . . . . . 10 TRP HZ3 . 51531 2
91 . 1 . 1 10 10 TRP HH2 H 1 7.211 0.003 . 1 . . . . . 10 TRP HH2 . 51531 2
92 . 1 . 1 10 10 TRP CA C 13 58.940 0.000 . 1 . . . . . 10 TRP CA . 51531 2
93 . 1 . 1 10 10 TRP CB C 13 28.681 0.000 . 1 . . . . . 10 TRP CB . 51531 2
94 . 1 . 1 11 11 TYR HA H 1 4.039 0.002 . 1 . . . . . 11 TYR HA . 51531 2
95 . 1 . 1 11 11 TYR HB2 H 1 2.796 0.005 . 2 . . . . . 11 TYR HB2 . 51531 2
96 . 1 . 1 11 11 TYR HB3 H 1 2.943 0.009 . 2 . . . . . 11 TYR HB3 . 51531 2
97 . 1 . 1 11 11 TYR HD1 H 1 7.061 0.003 . 1 . . . . . 11 TYR HD1 . 51531 2
98 . 1 . 1 11 11 TYR HD2 H 1 7.061 0.003 . 1 . . . . . 11 TYR HD2 . 51531 2
99 . 1 . 1 11 11 TYR HE1 H 1 6.812 0.001 . 1 . . . . . 11 TYR HE1 . 51531 2
100 . 1 . 1 11 11 TYR HE2 H 1 6.812 0.001 . 1 . . . . . 11 TYR HE2 . 51531 2
101 . 1 . 1 11 11 TYR CA C 13 61.036 0.000 . 1 . . . . . 11 TYR CA . 51531 2
102 . 1 . 1 11 11 TYR CB C 13 37.875 0.032 . 1 . . . . . 11 TYR CB . 51531 2
103 . 1 . 1 12 12 ILE HA H 1 3.818 0.002 . 1 . . . . . 12 ILE HA . 51531 2
104 . 1 . 1 12 12 ILE HB H 1 1.883 0.005 . 1 . . . . . 12 ILE HB . 51531 2
105 . 1 . 1 12 12 ILE HG12 H 1 1.165 0.002 . 2 . . . . . 12 ILE HG12 . 51531 2
106 . 1 . 1 12 12 ILE HG13 H 1 1.530 0.001 . 2 . . . . . 12 ILE HG13 . 51531 2
107 . 1 . 1 12 12 ILE HG21 H 1 0.925 0.002 . 1 . . . . . 12 ILE QG2 . 51531 2
108 . 1 . 1 12 12 ILE HG22 H 1 0.925 0.002 . 1 . . . . . 12 ILE QG2 . 51531 2
109 . 1 . 1 12 12 ILE HG23 H 1 0.925 0.002 . 1 . . . . . 12 ILE QG2 . 51531 2
110 . 1 . 1 12 12 ILE HD11 H 1 0.810 0.002 . 1 . . . . . 12 ILE QD1 . 51531 2
111 . 1 . 1 12 12 ILE HD12 H 1 0.810 0.002 . 1 . . . . . 12 ILE QD1 . 51531 2
112 . 1 . 1 12 12 ILE HD13 H 1 0.810 0.002 . 1 . . . . . 12 ILE QD1 . 51531 2
113 . 1 . 1 12 12 ILE CA C 13 64.241 0.000 . 1 . . . . . 12 ILE CA . 51531 2
114 . 1 . 1 12 12 ILE CB C 13 37.699 0.000 . 1 . . . . . 12 ILE CB . 51531 2
115 . 1 . 1 12 12 ILE CG1 C 13 28.296 0.014 . 1 . . . . . 12 ILE CG1 . 51531 2
116 . 1 . 1 12 12 ILE CG2 C 13 16.772 0.000 . 1 . . . . . 12 ILE CG2 . 51531 2
117 . 1 . 1 12 12 ILE CD1 C 13 11.643 0.000 . 1 . . . . . 12 ILE CD1 . 51531 2
118 . 1 . 1 13 13 LYS HA H 1 3.913 0.003 . 1 . . . . . 13 LYS HA . 51531 2
119 . 1 . 1 13 13 LYS HB2 H 1 1.837 0.003 . 2 . . . . . 13 LYS HB2 . 51531 2
120 . 1 . 1 13 13 LYS HB3 H 1 1.884 0.004 . 2 . . . . . 13 LYS HB3 . 51531 2
121 . 1 . 1 13 13 LYS HG2 H 1 1.367 0.003 . 2 . . . . . 13 LYS HG2 . 51531 2
122 . 1 . 1 13 13 LYS HG3 H 1 1.566 0.006 . 2 . . . . . 13 LYS HG3 . 51531 2
123 . 1 . 1 13 13 LYS HD2 H 1 1.589 0.004 . 2 . . . . . 13 LYS HD2 . 51531 2
124 . 1 . 1 13 13 LYS HD3 H 1 1.589 0.004 . 2 . . . . . 13 LYS HD3 . 51531 2
125 . 1 . 1 13 13 LYS HE2 H 1 2.840 0.003 . 2 . . . . . 13 LYS HE2 . 51531 2
126 . 1 . 1 13 13 LYS HE3 H 1 2.840 0.003 . 2 . . . . . 13 LYS HE3 . 51531 2
127 . 1 . 1 13 13 LYS CA C 13 60.050 0.000 . 1 . . . . . 13 LYS CA . 51531 2
128 . 1 . 1 13 13 LYS CB C 13 32.045 0.008 . 1 . . . . . 13 LYS CB . 51531 2
129 . 1 . 1 13 13 LYS CG C 13 25.301 0.005 . 1 . . . . . 13 LYS CG . 51531 2
130 . 1 . 1 13 13 LYS CD C 13 29.703 0.000 . 1 . . . . . 13 LYS CD . 51531 2
131 . 1 . 1 13 13 LYS CE C 13 42.046 0.000 . 1 . . . . . 13 LYS CE . 51531 2
132 . 1 . 1 14 14 LEU HA H 1 4.060 0.004 . 1 . . . . . 14 LEU HA . 51531 2
133 . 1 . 1 14 14 LEU HB2 H 1 1.571 0.002 . 2 . . . . . 14 LEU HB2 . 51531 2
134 . 1 . 1 14 14 LEU HB3 H 1 1.736 0.004 . 2 . . . . . 14 LEU HB3 . 51531 2
135 . 1 . 1 14 14 LEU HG H 1 1.626 0.003 . 1 . . . . . 14 LEU HG . 51531 2
136 . 1 . 1 14 14 LEU HD11 H 1 0.893 0.003 . 2 . . . . . 14 LEU QD1 . 51531 2
137 . 1 . 1 14 14 LEU HD12 H 1 0.893 0.003 . 2 . . . . . 14 LEU QD1 . 51531 2
138 . 1 . 1 14 14 LEU HD13 H 1 0.893 0.003 . 2 . . . . . 14 LEU QD1 . 51531 2
139 . 1 . 1 14 14 LEU HD21 H 1 0.893 0.003 . 2 . . . . . 14 LEU QD2 . 51531 2
140 . 1 . 1 14 14 LEU HD22 H 1 0.893 0.003 . 2 . . . . . 14 LEU QD2 . 51531 2
141 . 1 . 1 14 14 LEU HD23 H 1 0.893 0.003 . 2 . . . . . 14 LEU QD2 . 51531 2
142 . 1 . 1 14 14 LEU CA C 13 58.120 0.000 . 1 . . . . . 14 LEU CA . 51531 2
143 . 1 . 1 14 14 LEU CB C 13 41.709 0.010 . 1 . . . . . 14 LEU CB . 51531 2
144 . 1 . 1 14 14 LEU CG C 13 26.928 0.000 . 1 . . . . . 14 LEU CG . 51531 2
145 . 1 . 1 14 14 LEU CD1 C 13 23.139 0.000 . 1 . . . . . 14 LEU CD1 . 51531 2
146 . 1 . 1 14 14 LEU CD2 C 13 23.805 0.000 . 1 . . . . . 14 LEU CD2 . 51531 2
147 . 1 . 1 15 15 PHE HA H 1 4.155 0.002 . 1 . . . . . 15 PHE HA . 51531 2
148 . 1 . 1 15 15 PHE HB2 H 1 3.123 0.004 . 2 . . . . . 15 PHE HB2 . 51531 2
149 . 1 . 1 15 15 PHE HB3 H 1 3.290 0.002 . 2 . . . . . 15 PHE HB3 . 51531 2
150 . 1 . 1 15 15 PHE HD1 H 1 7.146 0.002 . 1 . . . . . 15 PHE HD1 . 51531 2
151 . 1 . 1 15 15 PHE HD2 H 1 7.146 0.002 . 1 . . . . . 15 PHE HD2 . 51531 2
152 . 1 . 1 15 15 PHE HE1 H 1 7.221 0.005 . 1 . . . . . 15 PHE HE1 . 51531 2
153 . 1 . 1 15 15 PHE HE2 H 1 7.221 0.005 . 1 . . . . . 15 PHE HE2 . 51531 2
154 . 1 . 1 15 15 PHE HZ H 1 7.178 0.001 . 1 . . . . . 15 PHE HZ . 51531 2
155 . 1 . 1 15 15 PHE CA C 13 61.626 0.000 . 1 . . . . . 15 PHE CA . 51531 2
156 . 1 . 1 15 15 PHE CB C 13 38.774 0.005 . 1 . . . . . 15 PHE CB . 51531 2
157 . 1 . 1 16 16 ILE HA H 1 3.559 0.003 . 1 . . . . . 16 ILE HA . 51531 2
158 . 1 . 1 16 16 ILE HB H 1 2.009 0.005 . 1 . . . . . 16 ILE HB . 51531 2
159 . 1 . 1 16 16 ILE HG12 H 1 1.297 0.003 . 2 . . . . . 16 ILE HG12 . 51531 2
160 . 1 . 1 16 16 ILE HG13 H 1 1.912 0.003 . 2 . . . . . 16 ILE HG13 . 51531 2
161 . 1 . 1 16 16 ILE HG21 H 1 0.925 0.005 . 1 . . . . . 16 ILE QG2 . 51531 2
162 . 1 . 1 16 16 ILE HG22 H 1 0.925 0.005 . 1 . . . . . 16 ILE QG2 . 51531 2
163 . 1 . 1 16 16 ILE HG23 H 1 0.925 0.005 . 1 . . . . . 16 ILE QG2 . 51531 2
164 . 1 . 1 16 16 ILE HD11 H 1 0.883 0.006 . 1 . . . . . 16 ILE QD1 . 51531 2
165 . 1 . 1 16 16 ILE HD12 H 1 0.883 0.006 . 1 . . . . . 16 ILE QD1 . 51531 2
166 . 1 . 1 16 16 ILE HD13 H 1 0.883 0.006 . 1 . . . . . 16 ILE QD1 . 51531 2
167 . 1 . 1 16 16 ILE CA C 13 65.082 0.000 . 1 . . . . . 16 ILE CA . 51531 2
168 . 1 . 1 16 16 ILE CB C 13 37.779 0.000 . 1 . . . . . 16 ILE CB . 51531 2
169 . 1 . 1 16 16 ILE CG1 C 13 28.794 0.039 . 1 . . . . . 16 ILE CG1 . 51531 2
170 . 1 . 1 16 16 ILE CG2 C 13 16.545 0.000 . 1 . . . . . 16 ILE CG2 . 51531 2
171 . 1 . 1 16 16 ILE CD1 C 13 12.065 0.000 . 1 . . . . . 16 ILE CD1 . 51531 2
172 . 1 . 1 17 17 MET HA H 1 4.142 0.003 . 1 . . . . . 17 MET HA . 51531 2
173 . 1 . 1 17 17 MET HB2 H 1 2.217 0.004 . 2 . . . . . 17 MET HB2 . 51531 2
174 . 1 . 1 17 17 MET HB3 H 1 2.410 0.003 . 2 . . . . . 17 MET HB3 . 51531 2
175 . 1 . 1 17 17 MET HG2 H 1 2.560 0.005 . 2 . . . . . 17 MET HG2 . 51531 2
176 . 1 . 1 17 17 MET HG3 H 1 2.768 0.002 . 2 . . . . . 17 MET HG3 . 51531 2
177 . 1 . 1 17 17 MET HE1 H 1 2.062 0.001 . 1 . . . . . 17 MET HE# . 51531 2
178 . 1 . 1 17 17 MET HE2 H 1 2.062 0.001 . 1 . . . . . 17 MET HE# . 51531 2
179 . 1 . 1 17 17 MET HE3 H 1 2.062 0.001 . 1 . . . . . 17 MET HE# . 51531 2
180 . 1 . 1 17 17 MET CA C 13 58.713 0.000 . 1 . . . . . 17 MET CA . 51531 2
181 . 1 . 1 17 17 MET CB C 13 32.363 0.022 . 1 . . . . . 17 MET CB . 51531 2
182 . 1 . 1 17 17 MET CG C 13 32.106 0.004 . 1 . . . . . 17 MET CG . 51531 2
183 . 1 . 1 17 17 MET CE C 13 15.997 0.000 . 1 . . . . . 17 MET CE . 51531 2
184 . 1 . 1 18 18 ILE HA H 1 3.742 0.002 . 1 . . . . . 18 ILE HA . 51531 2
185 . 1 . 1 18 18 ILE HB H 1 1.995 0.003 . 1 . . . . . 18 ILE HB . 51531 2
186 . 1 . 1 18 18 ILE HG12 H 1 1.133 0.004 . 2 . . . . . 18 ILE HG12 . 51531 2
187 . 1 . 1 18 18 ILE HG13 H 1 1.809 0.005 . 2 . . . . . 18 ILE HG13 . 51531 2
188 . 1 . 1 18 18 ILE HG21 H 1 0.873 0.004 . 1 . . . . . 18 ILE QG2 . 51531 2
189 . 1 . 1 18 18 ILE HG22 H 1 0.873 0.004 . 1 . . . . . 18 ILE QG2 . 51531 2
190 . 1 . 1 18 18 ILE HG23 H 1 0.873 0.004 . 1 . . . . . 18 ILE QG2 . 51531 2
191 . 1 . 1 18 18 ILE HD11 H 1 0.859 0.003 . 1 . . . . . 18 ILE QD1 . 51531 2
192 . 1 . 1 18 18 ILE HD12 H 1 0.859 0.003 . 1 . . . . . 18 ILE QD1 . 51531 2
193 . 1 . 1 18 18 ILE HD13 H 1 0.859 0.003 . 1 . . . . . 18 ILE QD1 . 51531 2
194 . 1 . 1 18 18 ILE CA C 13 65.216 0.000 . 1 . . . . . 18 ILE CA . 51531 2
195 . 1 . 1 18 18 ILE CB C 13 38.012 0.000 . 1 . . . . . 18 ILE CB . 51531 2
196 . 1 . 1 18 18 ILE CG1 C 13 28.705 0.004 . 1 . . . . . 18 ILE CG1 . 51531 2
197 . 1 . 1 18 18 ILE CG2 C 13 16.357 0.000 . 1 . . . . . 18 ILE CG2 . 51531 2
198 . 1 . 1 18 18 ILE CD1 C 13 11.952 0.000 . 1 . . . . . 18 ILE CD1 . 51531 2
199 . 1 . 1 19 19 VAL HA H 1 3.517 0.002 . 1 . . . . . 19 VAL HA . 51531 2
200 . 1 . 1 19 19 VAL HB H 1 1.838 0.002 . 1 . . . . . 19 VAL HB . 51531 2
201 . 1 . 1 19 19 VAL HG11 H 1 0.671 0.002 . 2 . . . . . 19 VAL QG1 . 51531 2
202 . 1 . 1 19 19 VAL HG12 H 1 0.671 0.002 . 2 . . . . . 19 VAL QG1 . 51531 2
203 . 1 . 1 19 19 VAL HG13 H 1 0.671 0.002 . 2 . . . . . 19 VAL QG1 . 51531 2
204 . 1 . 1 19 19 VAL HG21 H 1 0.789 0.003 . 2 . . . . . 19 VAL QG2 . 51531 2
205 . 1 . 1 19 19 VAL HG22 H 1 0.789 0.003 . 2 . . . . . 19 VAL QG2 . 51531 2
206 . 1 . 1 19 19 VAL HG23 H 1 0.789 0.003 . 2 . . . . . 19 VAL QG2 . 51531 2
207 . 1 . 1 19 19 VAL CA C 13 66.794 0.000 . 1 . . . . . 19 VAL CA . 51531 2
208 . 1 . 1 19 19 VAL CB C 13 31.359 0.000 . 1 . . . . . 19 VAL CB . 51531 2
209 . 1 . 1 19 19 VAL CG1 C 13 21.862 0.000 . 1 . . . . . 19 VAL CG1 . 51531 2
210 . 1 . 1 19 19 VAL CG2 C 13 20.637 0.000 . 1 . . . . . 19 VAL CG2 . 51531 2
211 . 1 . 1 20 20 GLY HA2 H 1 3.742 0.006 . 2 . . . . . 20 GLY HA2 . 51531 2
212 . 1 . 1 20 20 GLY HA3 H 1 3.868 0.001 . 2 . . . . . 20 GLY HA3 . 51531 2
213 . 1 . 1 20 20 GLY CA C 13 46.969 0.014 . 1 . . . . . 20 GLY CA . 51531 2
214 . 1 . 1 21 21 LYS HA H 1 4.146 0.003 . 1 . . . . . 21 LYS HA . 51531 2
215 . 1 . 1 21 21 LYS HB2 H 1 1.941 0.004 . 2 . . . . . 21 LYS HB2 . 51531 2
216 . 1 . 1 21 21 LYS HB3 H 1 2.067 0.004 . 2 . . . . . 21 LYS HB3 . 51531 2
217 . 1 . 1 21 21 LYS HG2 H 1 1.508 0.003 . 2 . . . . . 21 LYS HG2 . 51531 2
218 . 1 . 1 21 21 LYS HG3 H 1 1.630 0.004 . 2 . . . . . 21 LYS HG3 . 51531 2
219 . 1 . 1 21 21 LYS HD2 H 1 1.711 0.004 . 2 . . . . . 21 LYS HD2 . 51531 2
220 . 1 . 1 21 21 LYS HD3 H 1 1.711 0.004 . 2 . . . . . 21 LYS HD3 . 51531 2
221 . 1 . 1 21 21 LYS HE2 H 1 2.981 0.006 . 2 . . . . . 21 LYS HE2 . 51531 2
222 . 1 . 1 21 21 LYS HE3 H 1 2.981 0.006 . 2 . . . . . 21 LYS HE3 . 51531 2
223 . 1 . 1 21 21 LYS CA C 13 58.821 0.000 . 1 . . . . . 21 LYS CA . 51531 2
224 . 1 . 1 21 21 LYS CB C 13 32.357 0.010 . 1 . . . . . 21 LYS CB . 51531 2
225 . 1 . 1 21 21 LYS CG C 13 25.110 0.006 . 1 . . . . . 21 LYS CG . 51531 2
226 . 1 . 1 21 21 LYS CD C 13 28.952 0.000 . 1 . . . . . 21 LYS CD . 51531 2
227 . 1 . 1 21 21 LYS CE C 13 42.005 0.000 . 1 . . . . . 21 LYS CE . 51531 2
228 . 1 . 1 22 22 LYS HA H 1 4.126 0.003 . 1 . . . . . 22 LYS HA . 51531 2
229 . 1 . 1 22 22 LYS HB2 H 1 1.945 0.006 . 2 . . . . . 22 LYS HB2 . 51531 2
230 . 1 . 1 22 22 LYS HB3 H 1 2.009 0.006 . 2 . . . . . 22 LYS HB3 . 51531 2
231 . 1 . 1 22 22 LYS HG2 H 1 1.489 0.007 . 2 . . . . . 22 LYS HG2 . 51531 2
232 . 1 . 1 22 22 LYS HG3 H 1 1.602 0.007 . 2 . . . . . 22 LYS HG3 . 51531 2
233 . 1 . 1 22 22 LYS HD2 H 1 1.686 0.004 . 2 . . . . . 22 LYS HD2 . 51531 2
234 . 1 . 1 22 22 LYS HD3 H 1 1.686 0.004 . 2 . . . . . 22 LYS HD3 . 51531 2
235 . 1 . 1 22 22 LYS HE2 H 1 2.959 0.009 . 2 . . . . . 22 LYS HE2 . 51531 2
236 . 1 . 1 22 22 LYS HE3 H 1 2.959 0.009 . 2 . . . . . 22 LYS HE3 . 51531 2
237 . 1 . 1 22 22 LYS CA C 13 58.456 0.000 . 1 . . . . . 22 LYS CA . 51531 2
238 . 1 . 1 22 22 LYS CB C 13 32.366 0.000 . 1 . . . . . 22 LYS CB . 51531 2
239 . 1 . 1 22 22 LYS CG C 13 25.128 0.014 . 1 . . . . . 22 LYS CG . 51531 2
240 . 1 . 1 22 22 LYS CD C 13 29.062 0.000 . 1 . . . . . 22 LYS CD . 51531 2
241 . 1 . 1 22 22 LYS CE C 13 41.939 0.000 . 1 . . . . . 22 LYS CE . 51531 2
242 . 1 . 1 23 23 LYS HA H 1 4.205 0.002 . 1 . . . . . 23 LYS HA . 51531 2
243 . 1 . 1 23 23 LYS HB2 H 1 1.946 0.002 . 2 . . . . . 23 LYS HB2 . 51531 2
244 . 1 . 1 23 23 LYS HB3 H 1 1.946 0.002 . 2 . . . . . 23 LYS HB3 . 51531 2
245 . 1 . 1 23 23 LYS HG2 H 1 1.513 0.007 . 2 . . . . . 23 LYS HG2 . 51531 2
246 . 1 . 1 23 23 LYS HG3 H 1 1.581 0.007 . 2 . . . . . 23 LYS HG3 . 51531 2
247 . 1 . 1 23 23 LYS HD2 H 1 1.703 0.002 . 2 . . . . . 23 LYS HD2 . 51531 2
248 . 1 . 1 23 23 LYS HD3 H 1 1.703 0.002 . 2 . . . . . 23 LYS HD3 . 51531 2
249 . 1 . 1 23 23 LYS HE2 H 1 2.979 0.007 . 2 . . . . . 23 LYS HE2 . 51531 2
250 . 1 . 1 23 23 LYS HE3 H 1 2.979 0.007 . 2 . . . . . 23 LYS HE3 . 51531 2
251 . 1 . 1 23 23 LYS CA C 13 57.592 0.000 . 1 . . . . . 23 LYS CA . 51531 2
252 . 1 . 1 23 23 LYS CB C 13 32.524 0.000 . 1 . . . . . 23 LYS CB . 51531 2
253 . 1 . 1 23 23 LYS CG C 13 24.987 0.027 . 1 . . . . . 23 LYS CG . 51531 2
254 . 1 . 1 23 23 LYS CD C 13 29.205 0.000 . 1 . . . . . 23 LYS CD . 51531 2
255 . 1 . 1 23 23 LYS CE C 13 41.879 0.000 . 1 . . . . . 23 LYS CE . 51531 2
256 . 1 . 1 24 24 LYS HA H 1 4.260 0.005 . 1 . . . . . 24 LYS HA . 51531 2
257 . 1 . 1 24 24 LYS HB2 H 1 1.956 0.003 . 2 . . . . . 24 LYS HB2 . 51531 2
258 . 1 . 1 24 24 LYS HB3 H 1 1.956 0.003 . 2 . . . . . 24 LYS HB3 . 51531 2
259 . 1 . 1 24 24 LYS HG2 H 1 1.527 0.008 . 2 . . . . . 24 LYS HG2 . 51531 2
260 . 1 . 1 24 24 LYS HG3 H 1 1.569 0.011 . 2 . . . . . 24 LYS HG3 . 51531 2
261 . 1 . 1 24 24 LYS HD2 H 1 1.745 0.003 . 2 . . . . . 24 LYS HD2 . 51531 2
262 . 1 . 1 24 24 LYS HD3 H 1 1.745 0.003 . 2 . . . . . 24 LYS HD3 . 51531 2
263 . 1 . 1 24 24 LYS HE2 H 1 3.024 0.006 . 2 . . . . . 24 LYS HE2 . 51531 2
264 . 1 . 1 24 24 LYS HE3 H 1 3.024 0.006 . 2 . . . . . 24 LYS HE3 . 51531 2
265 . 1 . 1 24 24 LYS CA C 13 57.173 0.000 . 1 . . . . . 24 LYS CA . 51531 2
266 . 1 . 1 24 24 LYS CB C 13 32.630 0.000 . 1 . . . . . 24 LYS CB . 51531 2
267 . 1 . 1 24 24 LYS CG C 13 24.741 0.015 . 1 . . . . . 24 LYS CG . 51531 2
268 . 1 . 1 24 24 LYS CD C 13 29.003 0.000 . 1 . . . . . 24 LYS CD . 51531 2
269 . 1 . 1 24 24 LYS CE C 13 41.999 0.000 . 1 . . . . . 24 LYS CE . 51531 2
270 . 1 . 1 25 25 LYS HA H 1 4.286 0.006 . 1 . . . . . 25 LYS HA . 51531 2
271 . 1 . 1 25 25 LYS HB2 H 1 1.900 0.005 . 2 . . . . . 25 LYS HB2 . 51531 2
272 . 1 . 1 25 25 LYS HB3 H 1 1.944 0.005 . 2 . . . . . 25 LYS HB3 . 51531 2
273 . 1 . 1 25 25 LYS HG2 H 1 1.546 0.009 . 2 . . . . . 25 LYS HG2 . 51531 2
274 . 1 . 1 25 25 LYS HG3 H 1 1.546 0.009 . 2 . . . . . 25 LYS HG3 . 51531 2
275 . 1 . 1 25 25 LYS HD2 H 1 1.750 0.005 . 2 . . . . . 25 LYS HD2 . 51531 2
276 . 1 . 1 25 25 LYS HD3 H 1 1.750 0.005 . 2 . . . . . 25 LYS HD3 . 51531 2
277 . 1 . 1 25 25 LYS HE2 H 1 3.038 0.007 . 2 . . . . . 25 LYS HE2 . 51531 2
278 . 1 . 1 25 25 LYS HE3 H 1 3.038 0.007 . 2 . . . . . 25 LYS HE3 . 51531 2
279 . 1 . 1 25 25 LYS CA C 13 56.417 0.000 . 1 . . . . . 25 LYS CA . 51531 2
280 . 1 . 1 25 25 LYS CB C 13 32.832 0.007 . 1 . . . . . 25 LYS CB . 51531 2
281 . 1 . 1 25 25 LYS CG C 13 24.631 0.000 . 1 . . . . . 25 LYS CG . 51531 2
282 . 1 . 1 25 25 LYS CD C 13 28.842 0.000 . 1 . . . . . 25 LYS CD . 51531 2
283 . 1 . 1 25 25 LYS CE C 13 41.894 0.000 . 1 . . . . . 25 LYS CE . 51531 2
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