Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 51528
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'assigned chem shift list 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 $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
1 '2D 1H-1H COSY' . . . 51528 1
2 '2D 1H-1H TOCSY' . . . 51528 1
3 '2D 1H-1H NOESY' . . . 51528 1
4 '2D 1H-13C HSQC aliphatic' . . . 51528 1
7 '2D 1H-1H TOCSY' . . . 51528 1
8 '2D 1H-1H NOESY' . . . 51528 1
9 '2D 1H-13C HSQC aliphatic' . . . 51528 1
10 '2D 1H-13C HSQC aromatic' . . . 51528 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $software_2 . . 51528 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 ASN HA H 1 3.904 0.004 . 1 . . . . . 1 ASN HA . 51528 1
2 . 1 . 1 1 1 ASN HB2 H 1 2.602 0.003 . 2 . . . . . 1 ASN HB2 . 51528 1
3 . 1 . 1 1 1 ASN HB3 H 1 2.602 0.003 . 2 . . . . . 1 ASN HB3 . 51528 1
4 . 1 . 1 1 1 ASN HD21 H 1 6.631 0.000 . 2 . . . . . 1 ASN HD21 . 51528 1
5 . 1 . 1 1 1 ASN HD22 H 1 7.293 0.000 . 2 . . . . . 1 ASN HD22 . 51528 1
6 . 1 . 1 1 1 ASN CA C 13 53.660 0.000 . 1 . . . . . 1 ASN CA . 51528 1
7 . 1 . 1 1 1 ASN CB C 13 41.129 0.000 . 1 . . . . . 1 ASN CB . 51528 1
8 . 1 . 1 2 2 TRP HA H 1 4.415 0.005 . 1 . . . . . 2 TRP HA . 51528 1
9 . 1 . 1 2 2 TRP HB2 H 1 3.185 0.003 . 2 . . . . . 2 TRP HB2 . 51528 1
10 . 1 . 1 2 2 TRP HB3 H 1 3.185 0.003 . 2 . . . . . 2 TRP HB3 . 51528 1
11 . 1 . 1 2 2 TRP HD1 H 1 7.382 0.002 . 1 . . . . . 2 TRP HD1 . 51528 1
12 . 1 . 1 2 2 TRP HE3 H 1 7.496 0.003 . 1 . . . . . 2 TRP HE3 . 51528 1
13 . 1 . 1 2 2 TRP HZ2 H 1 7.476 0.004 . 1 . . . . . 2 TRP HZ2 . 51528 1
14 . 1 . 1 2 2 TRP HZ3 H 1 6.963 0.002 . 1 . . . . . 2 TRP HZ3 . 51528 1
15 . 1 . 1 2 2 TRP HH2 H 1 7.062 0.004 . 1 . . . . . 2 TRP HH2 . 51528 1
16 . 1 . 1 2 2 TRP CA C 13 58.884 0.000 . 1 . . . . . 2 TRP CA . 51528 1
17 . 1 . 1 2 2 TRP CB C 13 29.484 0.000 . 1 . . . . . 2 TRP CB . 51528 1
18 . 1 . 1 2 2 TRP CD1 C 13 127.360 0.077 . 1 . . . . . 2 TRP CD1 . 51528 1
19 . 1 . 1 2 2 TRP CE3 C 13 120.901 0.006 . 1 . . . . . 2 TRP CE3 . 51528 1
20 . 1 . 1 2 2 TRP CZ2 C 13 114.656 0.038 . 1 . . . . . 2 TRP CZ2 . 51528 1
21 . 1 . 1 2 2 TRP CZ3 C 13 121.411 0.003 . 1 . . . . . 2 TRP CZ3 . 51528 1
22 . 1 . 1 2 2 TRP CH2 C 13 124.001 0.004 . 1 . . . . . 2 TRP CH2 . 51528 1
23 . 1 . 1 3 3 PHE H H 1 7.634 0.002 . 1 . . . . . 3 PHE H . 51528 1
24 . 1 . 1 3 3 PHE HA H 1 4.491 0.005 . 1 . . . . . 3 PHE HA . 51528 1
25 . 1 . 1 3 3 PHE HB2 H 1 2.767 0.005 . 2 . . . . . 3 PHE HB2 . 51528 1
26 . 1 . 1 3 3 PHE HB3 H 1 2.841 0.006 . 2 . . . . . 3 PHE HB3 . 51528 1
27 . 1 . 1 3 3 PHE HD1 H 1 6.977 0.003 . 1 . . . . . 3 PHE HD1 . 51528 1
28 . 1 . 1 3 3 PHE HD2 H 1 6.977 0.003 . 1 . . . . . 3 PHE HD2 . 51528 1
29 . 1 . 1 3 3 PHE HE1 H 1 7.172 0.002 . 1 . . . . . 3 PHE HE1 . 51528 1
30 . 1 . 1 3 3 PHE HE2 H 1 7.172 0.002 . 1 . . . . . 3 PHE HE2 . 51528 1
31 . 1 . 1 3 3 PHE HZ H 1 7.101 0.002 . 1 . . . . . 3 PHE HZ . 51528 1
32 . 1 . 1 3 3 PHE CA C 13 57.090 0.000 . 1 . . . . . 3 PHE CA . 51528 1
33 . 1 . 1 3 3 PHE CB C 13 38.902 0.000 . 1 . . . . . 3 PHE CB . 51528 1
34 . 1 . 1 3 3 PHE CD1 C 13 131.977 0.002 . 1 . . . . . 3 PHE CD1 . 51528 1
35 . 1 . 1 3 3 PHE CE1 C 13 131.127 0.006 . 1 . . . . . 3 PHE CE1 . 51528 1
36 . 1 . 1 3 3 PHE CZ C 13 129.282 0.005 . 1 . . . . . 3 PHE CZ . 51528 1
37 . 1 . 1 5 5 ILE H H 1 8.251 0.002 . 1 . . . . . 5 ILE H . 51528 1
38 . 1 . 1 5 5 ILE HA H 1 3.819 0.005 . 1 . . . . . 5 ILE HA . 51528 1
39 . 1 . 1 5 5 ILE HB H 1 1.903 0.004 . 1 . . . . . 5 ILE HB . 51528 1
40 . 1 . 1 5 5 ILE HG12 H 1 1.237 0.005 . 2 . . . . . 5 ILE HG12 . 51528 1
41 . 1 . 1 5 5 ILE HG13 H 1 1.467 0.004 . 2 . . . . . 5 ILE HG13 . 51528 1
42 . 1 . 1 5 5 ILE HG21 H 1 0.853 0.003 . 1 . . . . . 5 ILE QG2 . 51528 1
43 . 1 . 1 5 5 ILE HG22 H 1 0.853 0.003 . 1 . . . . . 5 ILE QG2 . 51528 1
44 . 1 . 1 5 5 ILE HG23 H 1 0.853 0.003 . 1 . . . . . 5 ILE QG2 . 51528 1
45 . 1 . 1 5 5 ILE HD11 H 1 0.856 0.003 . 1 . . . . . 5 ILE QD1 . 51528 1
46 . 1 . 1 5 5 ILE HD12 H 1 0.856 0.003 . 1 . . . . . 5 ILE QD1 . 51528 1
47 . 1 . 1 5 5 ILE HD13 H 1 0.856 0.003 . 1 . . . . . 5 ILE QD1 . 51528 1
48 . 1 . 1 5 5 ILE CA C 13 63.090 0.000 . 1 . . . . . 5 ILE CA . 51528 1
49 . 1 . 1 5 5 ILE CB C 13 38.343 0.000 . 1 . . . . . 5 ILE CB . 51528 1
50 . 1 . 1 5 5 ILE CG1 C 13 28.318 0.000 . 1 . . . . . 5 ILE CG1 . 51528 1
51 . 1 . 1 5 5 ILE CG2 C 13 17.942 0.000 . 1 . . . . . 5 ILE CG2 . 51528 1
52 . 1 . 1 5 5 ILE CD1 C 13 14.176 0.000 . 1 . . . . . 5 ILE CD1 . 51528 1
53 . 1 . 1 6 6 THR H H 1 8.201 0.001 . 1 . . . . . 6 THR H . 51528 1
54 . 1 . 1 6 6 THR HA H 1 3.934 0.003 . 1 . . . . . 6 THR HA . 51528 1
55 . 1 . 1 6 6 THR HB H 1 4.172 0.002 . 1 . . . . . 6 THR HB . 51528 1
56 . 1 . 1 6 6 THR HG21 H 1 1.228 0.002 . 1 . . . . . 6 THR QG2 . 51528 1
57 . 1 . 1 6 6 THR HG22 H 1 1.228 0.002 . 1 . . . . . 6 THR QG2 . 51528 1
58 . 1 . 1 6 6 THR HG23 H 1 1.228 0.002 . 1 . . . . . 6 THR QG2 . 51528 1
59 . 1 . 1 6 6 THR CA C 13 66.111 0.000 . 1 . . . . . 6 THR CA . 51528 1
60 . 1 . 1 6 6 THR CB C 13 68.477 0.000 . 1 . . . . . 6 THR CB . 51528 1
61 . 1 . 1 6 6 THR CG2 C 13 21.989 0.000 . 1 . . . . . 6 THR CG2 . 51528 1
62 . 1 . 1 7 7 ASN H H 1 8.118 0.000 . 1 . . . . . 7 ASN H . 51528 1
63 . 1 . 1 7 7 ASN HB2 H 1 2.726 0.003 . 2 . . . . . 7 ASN HB2 . 51528 1
64 . 1 . 1 7 7 ASN HB3 H 1 2.838 0.005 . 2 . . . . . 7 ASN HB3 . 51528 1
65 . 1 . 1 7 7 ASN HD21 H 1 6.896 0.000 . 2 . . . . . 7 ASN HD21 . 51528 1
66 . 1 . 1 7 7 ASN HD22 H 1 7.751 0.001 . 2 . . . . . 7 ASN HD22 . 51528 1
67 . 1 . 1 8 8 TRP H H 1 7.999 0.003 . 1 . . . . . 8 TRP H . 51528 1
68 . 1 . 1 8 8 TRP HB2 H 1 3.393 0.003 . 2 . . . . . 8 TRP HB2 . 51528 1
69 . 1 . 1 8 8 TRP HB3 H 1 3.450 0.000 . 2 . . . . . 8 TRP HB3 . 51528 1
70 . 1 . 1 8 8 TRP HD1 H 1 7.329 0.003 . 1 . . . . . 8 TRP HD1 . 51528 1
71 . 1 . 1 8 8 TRP HE3 H 1 7.435 0.004 . 1 . . . . . 8 TRP HE3 . 51528 1
72 . 1 . 1 8 8 TRP HZ2 H 1 7.427 0.003 . 1 . . . . . 8 TRP HZ2 . 51528 1
73 . 1 . 1 8 8 TRP HZ3 H 1 6.870 0.003 . 1 . . . . . 8 TRP HZ3 . 51528 1
74 . 1 . 1 8 8 TRP HH2 H 1 7.024 0.006 . 1 . . . . . 8 TRP HH2 . 51528 1
75 . 1 . 1 8 8 TRP CD1 C 13 126.422 0.091 . 1 . . . . . 8 TRP CD1 . 51528 1
76 . 1 . 1 8 8 TRP CE3 C 13 119.915 0.000 . 1 . . . . . 8 TRP CE3 . 51528 1
77 . 1 . 1 8 8 TRP CZ2 C 13 114.570 0.045 . 1 . . . . . 8 TRP CZ2 . 51528 1
78 . 1 . 1 8 8 TRP CZ3 C 13 121.296 0.013 . 1 . . . . . 8 TRP CZ3 . 51528 1
79 . 1 . 1 8 8 TRP CH2 C 13 123.970 0.016 . 1 . . . . . 8 TRP CH2 . 51528 1
80 . 1 . 1 9 9 LEU H H 1 8.174 0.002 . 1 . . . . . 9 LEU H . 51528 1
81 . 1 . 1 9 9 LEU HA H 1 4.084 0.004 . 1 . . . . . 9 LEU HA . 51528 1
82 . 1 . 1 9 9 LEU HB2 H 1 1.657 0.005 . 2 . . . . . 9 LEU HB2 . 51528 1
83 . 1 . 1 9 9 LEU HB3 H 1 1.841 0.006 . 2 . . . . . 9 LEU HB3 . 51528 1
84 . 1 . 1 9 9 LEU HG H 1 1.845 0.004 . 1 . . . . . 9 LEU HG . 51528 1
85 . 1 . 1 9 9 LEU HD11 H 1 0.931 0.003 . 2 . . . . . 9 LEU QD1 . 51528 1
86 . 1 . 1 9 9 LEU HD12 H 1 0.931 0.003 . 2 . . . . . 9 LEU QD1 . 51528 1
87 . 1 . 1 9 9 LEU HD13 H 1 0.931 0.003 . 2 . . . . . 9 LEU QD1 . 51528 1
88 . 1 . 1 9 9 LEU HD21 H 1 0.985 0.003 . 2 . . . . . 9 LEU QD2 . 51528 1
89 . 1 . 1 9 9 LEU HD22 H 1 0.985 0.003 . 2 . . . . . 9 LEU QD2 . 51528 1
90 . 1 . 1 9 9 LEU HD23 H 1 0.985 0.003 . 2 . . . . . 9 LEU QD2 . 51528 1
91 . 1 . 1 9 9 LEU CA C 13 58.219 0.000 . 1 . . . . . 9 LEU CA . 51528 1
92 . 1 . 1 9 9 LEU CB C 13 41.691 0.000 . 1 . . . . . 9 LEU CB . 51528 1
93 . 1 . 1 9 9 LEU CG C 13 27.070 0.000 . 1 . . . . . 9 LEU CG . 51528 1
94 . 1 . 1 9 9 LEU CD1 C 13 24.052 0.000 . 1 . . . . . 9 LEU CD1 . 51528 1
95 . 1 . 1 9 9 LEU CD2 C 13 25.045 0.000 . 1 . . . . . 9 LEU CD2 . 51528 1
96 . 1 . 1 10 10 TRP H H 1 8.062 0.002 . 1 . . . . . 10 TRP H . 51528 1
97 . 1 . 1 10 10 TRP HA H 1 4.080 0.004 . 1 . . . . . 10 TRP HA . 51528 1
98 . 1 . 1 10 10 TRP HB2 H 1 3.219 0.007 . 2 . . . . . 10 TRP HB2 . 51528 1
99 . 1 . 1 10 10 TRP HB3 H 1 3.326 0.002 . 2 . . . . . 10 TRP HB3 . 51528 1
100 . 1 . 1 10 10 TRP HD1 H 1 7.174 0.003 . 1 . . . . . 10 TRP HD1 . 51528 1
101 . 1 . 1 10 10 TRP HE3 H 1 6.543 0.006 . 1 . . . . . 10 TRP HE3 . 51528 1
102 . 1 . 1 10 10 TRP HZ2 H 1 7.425 0.010 . 1 . . . . . 10 TRP HZ2 . 51528 1
103 . 1 . 1 10 10 TRP HZ3 H 1 6.741 0.006 . 1 . . . . . 10 TRP HZ3 . 51528 1
104 . 1 . 1 10 10 TRP HH2 H 1 7.024 0.008 . 1 . . . . . 10 TRP HH2 . 51528 1
105 . 1 . 1 10 10 TRP CA C 13 58.916 0.000 . 1 . . . . . 10 TRP CA . 51528 1
106 . 1 . 1 10 10 TRP CZ2 C 13 114.627 0.042 . 1 . . . . . 10 TRP CZ2 . 51528 1
107 . 1 . 1 11 11 TYR H H 1 7.657 0.002 . 1 . . . . . 11 TYR H . 51528 1
108 . 1 . 1 11 11 TYR HA H 1 4.015 0.003 . 1 . . . . . 11 TYR HA . 51528 1
109 . 1 . 1 11 11 TYR HB2 H 1 3.016 0.002 . 2 . . . . . 11 TYR HB2 . 51528 1
110 . 1 . 1 11 11 TYR HB3 H 1 3.188 0.007 . 2 . . . . . 11 TYR HB3 . 51528 1
111 . 1 . 1 11 11 TYR HD1 H 1 7.217 0.003 . 1 . . . . . 11 TYR HD1 . 51528 1
112 . 1 . 1 11 11 TYR HD2 H 1 7.217 0.003 . 1 . . . . . 11 TYR HD2 . 51528 1
113 . 1 . 1 11 11 TYR HE1 H 1 6.838 0.003 . 1 . . . . . 11 TYR HE1 . 51528 1
114 . 1 . 1 11 11 TYR HE2 H 1 6.838 0.003 . 1 . . . . . 11 TYR HE2 . 51528 1
115 . 1 . 1 11 11 TYR CD1 C 13 132.865 0.007 . 1 . . . . . 11 TYR CD1 . 51528 1
116 . 1 . 1 11 11 TYR CE1 C 13 118.317 0.041 . 1 . . . . . 11 TYR CE1 . 51528 1
117 . 1 . 1 12 12 ILE H H 1 8.141 0.004 . 1 . . . . . 12 ILE H . 51528 1
118 . 1 . 1 12 12 ILE HA H 1 3.746 0.002 . 1 . . . . . 12 ILE HA . 51528 1
119 . 1 . 1 12 12 ILE HB H 1 2.117 0.003 . 1 . . . . . 12 ILE HB . 51528 1
120 . 1 . 1 12 12 ILE HG12 H 1 1.194 0.005 . 2 . . . . . 12 ILE HG12 . 51528 1
121 . 1 . 1 12 12 ILE HG13 H 1 1.976 0.005 . 2 . . . . . 12 ILE HG13 . 51528 1
122 . 1 . 1 12 12 ILE HG21 H 1 0.990 0.004 . 1 . . . . . 12 ILE QG2 . 51528 1
123 . 1 . 1 12 12 ILE HG22 H 1 0.990 0.004 . 1 . . . . . 12 ILE QG2 . 51528 1
124 . 1 . 1 12 12 ILE HG23 H 1 0.990 0.004 . 1 . . . . . 12 ILE QG2 . 51528 1
125 . 1 . 1 12 12 ILE HD11 H 1 0.963 0.002 . 1 . . . . . 12 ILE QD1 . 51528 1
126 . 1 . 1 12 12 ILE HD12 H 1 0.963 0.002 . 1 . . . . . 12 ILE QD1 . 51528 1
127 . 1 . 1 12 12 ILE HD13 H 1 0.963 0.002 . 1 . . . . . 12 ILE QD1 . 51528 1
128 . 1 . 1 12 12 ILE CA C 13 65.379 0.000 . 1 . . . . . 12 ILE CA . 51528 1
129 . 1 . 1 12 12 ILE CB C 13 37.770 0.000 . 1 . . . . . 12 ILE CB . 51528 1
130 . 1 . 1 12 12 ILE CG1 C 13 29.713 0.000 . 1 . . . . . 12 ILE CG1 . 51528 1
131 . 1 . 1 12 12 ILE CG2 C 13 17.760 0.000 . 1 . . . . . 12 ILE CG2 . 51528 1
132 . 1 . 1 12 12 ILE CD1 C 13 13.249 0.000 . 1 . . . . . 12 ILE CD1 . 51528 1
133 . 1 . 1 13 13 LYS H H 1 8.318 0.003 . 1 . . . . . 13 LYS H . 51528 1
134 . 1 . 1 13 13 LYS HA H 1 3.825 0.003 . 1 . . . . . 13 LYS HA . 51528 1
135 . 1 . 1 13 13 LYS HB2 H 1 1.810 0.004 . 2 . . . . . 13 LYS HB2 . 51528 1
136 . 1 . 1 13 13 LYS HB3 H 1 1.810 0.004 . 2 . . . . . 13 LYS HB3 . 51528 1
137 . 1 . 1 13 13 LYS HG2 H 1 1.329 0.003 . 2 . . . . . 13 LYS HG2 . 51528 1
138 . 1 . 1 13 13 LYS HG3 H 1 1.580 0.003 . 2 . . . . . 13 LYS HG3 . 51528 1
139 . 1 . 1 13 13 LYS HD2 H 1 1.662 0.002 . 2 . . . . . 13 LYS HD2 . 51528 1
140 . 1 . 1 13 13 LYS HD3 H 1 1.662 0.002 . 2 . . . . . 13 LYS HD3 . 51528 1
141 . 1 . 1 13 13 LYS HE2 H 1 2.835 0.002 . 2 . . . . . 13 LYS HE2 . 51528 1
142 . 1 . 1 13 13 LYS HE3 H 1 2.878 0.007 . 2 . . . . . 13 LYS HE3 . 51528 1
143 . 1 . 1 13 13 LYS CA C 13 60.510 0.000 . 1 . . . . . 13 LYS CA . 51528 1
144 . 1 . 1 13 13 LYS CB C 13 31.903 0.000 . 1 . . . . . 13 LYS CB . 51528 1
145 . 1 . 1 13 13 LYS CG C 13 26.098 0.007 . 1 . . . . . 13 LYS CG . 51528 1
146 . 1 . 1 13 13 LYS CE C 13 41.751 0.003 . 1 . . . . . 13 LYS CE . 51528 1
147 . 1 . 1 14 14 LEU H H 1 7.679 0.003 . 1 . . . . . 14 LEU H . 51528 1
148 . 1 . 1 14 14 LEU HA H 1 3.878 0.003 . 1 . . . . . 14 LEU HA . 51528 1
149 . 1 . 1 14 14 LEU HB2 H 1 1.155 0.005 . 2 . . . . . 14 LEU HB2 . 51528 1
150 . 1 . 1 14 14 LEU HB3 H 1 1.587 0.005 . 2 . . . . . 14 LEU HB3 . 51528 1
151 . 1 . 1 14 14 LEU HG H 1 1.367 0.003 . 1 . . . . . 14 LEU HG . 51528 1
152 . 1 . 1 14 14 LEU HD11 H 1 0.591 0.003 . 2 . . . . . 14 LEU QD1 . 51528 1
153 . 1 . 1 14 14 LEU HD12 H 1 0.591 0.003 . 2 . . . . . 14 LEU QD1 . 51528 1
154 . 1 . 1 14 14 LEU HD13 H 1 0.591 0.003 . 2 . . . . . 14 LEU QD1 . 51528 1
155 . 1 . 1 14 14 LEU HD21 H 1 0.725 0.001 . 2 . . . . . 14 LEU QD2 . 51528 1
156 . 1 . 1 14 14 LEU HD22 H 1 0.725 0.001 . 2 . . . . . 14 LEU QD2 . 51528 1
157 . 1 . 1 14 14 LEU HD23 H 1 0.725 0.001 . 2 . . . . . 14 LEU QD2 . 51528 1
158 . 1 . 1 14 14 LEU CA C 13 58.077 0.000 . 1 . . . . . 14 LEU CA . 51528 1
159 . 1 . 1 14 14 LEU CB C 13 41.332 0.027 . 1 . . . . . 14 LEU CB . 51528 1
160 . 1 . 1 14 14 LEU CG C 13 26.910 0.000 . 1 . . . . . 14 LEU CG . 51528 1
161 . 1 . 1 14 14 LEU CD1 C 13 23.996 0.000 . 1 . . . . . 14 LEU CD1 . 51528 1
162 . 1 . 1 14 14 LEU CD2 C 13 25.068 0.000 . 1 . . . . . 14 LEU CD2 . 51528 1
163 . 1 . 1 15 15 PHE H H 1 8.268 0.003 . 1 . . . . . 15 PHE H . 51528 1
164 . 1 . 1 15 15 PHE HA H 1 4.098 0.005 . 1 . . . . . 15 PHE HA . 51528 1
165 . 1 . 1 15 15 PHE HB2 H 1 3.197 0.003 . 2 . . . . . 15 PHE HB2 . 51528 1
166 . 1 . 1 15 15 PHE HB3 H 1 3.344 0.004 . 2 . . . . . 15 PHE HB3 . 51528 1
167 . 1 . 1 15 15 PHE HD1 H 1 7.077 0.003 . 1 . . . . . 15 PHE HD1 . 51528 1
168 . 1 . 1 15 15 PHE HD2 H 1 7.077 0.003 . 1 . . . . . 15 PHE HD2 . 51528 1
169 . 1 . 1 15 15 PHE HE1 H 1 7.087 0.003 . 1 . . . . . 15 PHE HE1 . 51528 1
170 . 1 . 1 15 15 PHE HE2 H 1 7.087 0.003 . 1 . . . . . 15 PHE HE2 . 51528 1
171 . 1 . 1 15 15 PHE HZ H 1 7.042 0.003 . 1 . . . . . 15 PHE HZ . 51528 1
172 . 1 . 1 15 15 PHE CD1 C 13 131.424 0.005 . 1 . . . . . 15 PHE CD1 . 51528 1
173 . 1 . 1 15 15 PHE CE1 C 13 130.600 0.004 . 1 . . . . . 15 PHE CE1 . 51528 1
174 . 1 . 1 15 15 PHE CZ C 13 128.978 0.036 . 1 . . . . . 15 PHE CZ . 51528 1
175 . 1 . 1 16 16 ILE H H 1 8.409 0.002 . 1 . . . . . 16 ILE H . 51528 1
176 . 1 . 1 16 16 ILE HA H 1 3.452 0.002 . 1 . . . . . 16 ILE HA . 51528 1
177 . 1 . 1 16 16 ILE HB H 1 1.995 0.002 . 1 . . . . . 16 ILE HB . 51528 1
178 . 1 . 1 16 16 ILE HG12 H 1 1.154 0.005 . 2 . . . . . 16 ILE HG12 . 51528 1
179 . 1 . 1 16 16 ILE HG13 H 1 1.963 0.003 . 2 . . . . . 16 ILE HG13 . 51528 1
180 . 1 . 1 16 16 ILE HG21 H 1 0.906 0.002 . 1 . . . . . 16 ILE QG2 . 51528 1
181 . 1 . 1 16 16 ILE HG22 H 1 0.906 0.002 . 1 . . . . . 16 ILE QG2 . 51528 1
182 . 1 . 1 16 16 ILE HG23 H 1 0.906 0.002 . 1 . . . . . 16 ILE QG2 . 51528 1
183 . 1 . 1 16 16 ILE HD11 H 1 0.866 0.003 . 1 . . . . . 16 ILE QD1 . 51528 1
184 . 1 . 1 16 16 ILE HD12 H 1 0.866 0.003 . 1 . . . . . 16 ILE QD1 . 51528 1
185 . 1 . 1 16 16 ILE HD13 H 1 0.866 0.003 . 1 . . . . . 16 ILE QD1 . 51528 1
186 . 1 . 1 16 16 ILE CA C 13 65.367 0.000 . 1 . . . . . 16 ILE CA . 51528 1
187 . 1 . 1 16 16 ILE CB C 13 37.861 0.000 . 1 . . . . . 16 ILE CB . 51528 1
188 . 1 . 1 16 16 ILE CG1 C 13 29.584 0.000 . 1 . . . . . 16 ILE CG1 . 51528 1
189 . 1 . 1 16 16 ILE CG2 C 13 17.549 0.000 . 1 . . . . . 16 ILE CG2 . 51528 1
190 . 1 . 1 16 16 ILE CD1 C 13 13.937 0.000 . 1 . . . . . 16 ILE CD1 . 51528 1
191 . 1 . 1 17 17 MET H H 1 8.005 0.004 . 1 . . . . . 17 MET H . 51528 1
192 . 1 . 1 17 17 MET HA H 1 4.071 0.004 . 1 . . . . . 17 MET HA . 51528 1
193 . 1 . 1 17 17 MET HB2 H 1 2.185 0.002 . 2 . . . . . 17 MET HB2 . 51528 1
194 . 1 . 1 17 17 MET HB3 H 1 2.271 0.004 . 2 . . . . . 17 MET HB3 . 51528 1
195 . 1 . 1 17 17 MET HG2 H 1 2.481 0.003 . 2 . . . . . 17 MET HG2 . 51528 1
196 . 1 . 1 17 17 MET HG3 H 1 2.729 0.002 . 2 . . . . . 17 MET HG3 . 51528 1
197 . 1 . 1 17 17 MET HE1 H 1 2.033 0.002 . 1 . . . . . 17 MET HE# . 51528 1
198 . 1 . 1 17 17 MET HE2 H 1 2.033 0.002 . 1 . . . . . 17 MET HE# . 51528 1
199 . 1 . 1 17 17 MET HE3 H 1 2.033 0.002 . 1 . . . . . 17 MET HE# . 51528 1
200 . 1 . 1 17 17 MET CA C 13 58.292 0.000 . 1 . . . . . 17 MET CA . 51528 1
201 . 1 . 1 17 17 MET CB C 13 32.480 0.006 . 1 . . . . . 17 MET CB . 51528 1
202 . 1 . 1 17 17 MET CG C 13 32.113 0.008 . 1 . . . . . 17 MET CG . 51528 1
203 . 1 . 1 17 17 MET CE C 13 17.023 0.000 . 1 . . . . . 17 MET CE . 51528 1
204 . 1 . 1 18 18 ILE H H 1 8.181 0.004 . 1 . . . . . 18 ILE H . 51528 1
205 . 1 . 1 18 18 ILE HA H 1 3.679 0.004 . 1 . . . . . 18 ILE HA . 51528 1
206 . 1 . 1 18 18 ILE HB H 1 1.923 0.004 . 1 . . . . . 18 ILE HB . 51528 1
207 . 1 . 1 18 18 ILE HG12 H 1 1.123 0.005 . 2 . . . . . 18 ILE HG12 . 51528 1
208 . 1 . 1 18 18 ILE HG13 H 1 1.783 0.003 . 2 . . . . . 18 ILE HG13 . 51528 1
209 . 1 . 1 18 18 ILE HG21 H 1 0.852 0.002 . 1 . . . . . 18 ILE QG2 . 51528 1
210 . 1 . 1 18 18 ILE HG22 H 1 0.852 0.002 . 1 . . . . . 18 ILE QG2 . 51528 1
211 . 1 . 1 18 18 ILE HG23 H 1 0.852 0.002 . 1 . . . . . 18 ILE QG2 . 51528 1
212 . 1 . 1 18 18 ILE HD11 H 1 0.819 0.002 . 1 . . . . . 18 ILE QD1 . 51528 1
213 . 1 . 1 18 18 ILE HD12 H 1 0.819 0.002 . 1 . . . . . 18 ILE QD1 . 51528 1
214 . 1 . 1 18 18 ILE HD13 H 1 0.819 0.002 . 1 . . . . . 18 ILE QD1 . 51528 1
215 . 1 . 1 18 18 ILE CA C 13 64.969 0.000 . 1 . . . . . 18 ILE CA . 51528 1
216 . 1 . 1 18 18 ILE CB C 13 37.935 0.000 . 1 . . . . . 18 ILE CB . 51528 1
217 . 1 . 1 18 18 ILE CG2 C 13 17.554 0.000 . 1 . . . . . 18 ILE CG2 . 51528 1
218 . 1 . 1 18 18 ILE CD1 C 13 13.586 0.000 . 1 . . . . . 18 ILE CD1 . 51528 1
219 . 1 . 1 19 19 VAL H H 1 8.173 0.002 . 1 . . . . . 19 VAL H . 51528 1
220 . 1 . 1 19 19 VAL HA H 1 3.539 0.002 . 1 . . . . . 19 VAL HA . 51528 1
221 . 1 . 1 19 19 VAL HB H 1 1.909 0.003 . 1 . . . . . 19 VAL HB . 51528 1
222 . 1 . 1 19 19 VAL HG11 H 1 0.745 0.003 . 2 . . . . . 19 VAL QG1 . 51528 1
223 . 1 . 1 19 19 VAL HG12 H 1 0.745 0.003 . 2 . . . . . 19 VAL QG1 . 51528 1
224 . 1 . 1 19 19 VAL HG13 H 1 0.745 0.003 . 2 . . . . . 19 VAL QG1 . 51528 1
225 . 1 . 1 19 19 VAL HG21 H 1 0.636 0.002 . 2 . . . . . 19 VAL QG2 . 51528 1
226 . 1 . 1 19 19 VAL HG22 H 1 0.636 0.002 . 2 . . . . . 19 VAL QG2 . 51528 1
227 . 1 . 1 19 19 VAL HG23 H 1 0.636 0.002 . 2 . . . . . 19 VAL QG2 . 51528 1
228 . 1 . 1 19 19 VAL CA C 13 66.088 0.000 . 1 . . . . . 19 VAL CA . 51528 1
229 . 1 . 1 19 19 VAL CB C 13 31.419 0.000 . 1 . . . . . 19 VAL CB . 51528 1
230 . 1 . 1 19 19 VAL CG1 C 13 21.929 0.000 . 1 . . . . . 19 VAL CG1 . 51528 1
231 . 1 . 1 19 19 VAL CG2 C 13 22.495 0.000 . 1 . . . . . 19 VAL CG2 . 51528 1
232 . 1 . 1 20 20 GLY H H 1 8.154 0.007 . 1 . . . . . 20 GLY H . 51528 1
233 . 1 . 1 20 20 GLY HA2 H 1 3.691 0.000 . 2 . . . . . 20 GLY HA2 . 51528 1
234 . 1 . 1 20 20 GLY HA3 H 1 3.836 0.001 . 2 . . . . . 20 GLY HA3 . 51528 1
235 . 1 . 1 21 21 LYS H H 1 7.731 0.003 . 1 . . . . . 21 LYS H . 51528 1
236 . 1 . 1 21 21 LYS HA H 1 4.174 0.002 . 1 . . . . . 21 LYS HA . 51528 1
237 . 1 . 1 21 21 LYS HB2 H 1 1.887 0.004 . 2 . . . . . 21 LYS HB2 . 51528 1
238 . 1 . 1 21 21 LYS HB3 H 1 1.946 0.004 . 2 . . . . . 21 LYS HB3 . 51528 1
239 . 1 . 1 21 21 LYS HG2 H 1 1.528 0.004 . 2 . . . . . 21 LYS HG2 . 51528 1
240 . 1 . 1 21 21 LYS HG3 H 1 1.528 0.004 . 2 . . . . . 21 LYS HG3 . 51528 1
241 . 1 . 1 21 21 LYS HD2 H 1 1.679 0.004 . 2 . . . . . 21 LYS HD2 . 51528 1
242 . 1 . 1 21 21 LYS HD3 H 1 1.679 0.004 . 2 . . . . . 21 LYS HD3 . 51528 1
243 . 1 . 1 21 21 LYS HE2 H 1 2.943 0.007 . 2 . . . . . 21 LYS HE2 . 51528 1
244 . 1 . 1 21 21 LYS HE3 H 1 2.943 0.007 . 2 . . . . . 21 LYS HE3 . 51528 1
245 . 1 . 1 21 21 LYS CA C 13 57.549 0.000 . 1 . . . . . 21 LYS CA . 51528 1
246 . 1 . 1 21 21 LYS CB C 13 32.581 0.004 . 1 . . . . . 21 LYS CB . 51528 1
247 . 1 . 1 21 21 LYS CG C 13 25.184 0.000 . 1 . . . . . 21 LYS CG . 51528 1
248 . 1 . 1 21 21 LYS CD C 13 29.550 0.000 . 1 . . . . . 21 LYS CD . 51528 1
249 . 1 . 1 21 21 LYS CE C 13 41.761 0.000 . 1 . . . . . 21 LYS CE . 51528 1
250 . 1 . 1 22 22 LYS H H 1 7.949 0.003 . 1 . . . . . 22 LYS H . 51528 1
251 . 1 . 1 22 22 LYS HA H 1 4.188 0.005 . 1 . . . . . 22 LYS HA . 51528 1
252 . 1 . 1 22 22 LYS HB2 H 1 1.831 0.003 . 2 . . . . . 22 LYS HB2 . 51528 1
253 . 1 . 1 22 22 LYS HB3 H 1 1.918 0.004 . 2 . . . . . 22 LYS HB3 . 51528 1
254 . 1 . 1 22 22 LYS HG2 H 1 1.487 0.005 . 2 . . . . . 22 LYS HG2 . 51528 1
255 . 1 . 1 22 22 LYS HG3 H 1 1.487 0.005 . 2 . . . . . 22 LYS HG3 . 51528 1
256 . 1 . 1 22 22 LYS HD2 H 1 1.671 0.005 . 2 . . . . . 22 LYS HD2 . 51528 1
257 . 1 . 1 22 22 LYS HD3 H 1 1.671 0.005 . 2 . . . . . 22 LYS HD3 . 51528 1
258 . 1 . 1 22 22 LYS HE2 H 1 2.938 0.004 . 2 . . . . . 22 LYS HE2 . 51528 1
259 . 1 . 1 22 22 LYS HE3 H 1 2.938 0.004 . 2 . . . . . 22 LYS HE3 . 51528 1
260 . 1 . 1 22 22 LYS CA C 13 56.964 0.000 . 1 . . . . . 22 LYS CA . 51528 1
261 . 1 . 1 22 22 LYS CB C 13 32.596 0.010 . 1 . . . . . 22 LYS CB . 51528 1
262 . 1 . 1 22 22 LYS CG C 13 24.947 0.000 . 1 . . . . . 22 LYS CG . 51528 1
263 . 1 . 1 22 22 LYS CD C 13 29.566 0.000 . 1 . . . . . 22 LYS CD . 51528 1
264 . 1 . 1 22 22 LYS CE C 13 41.729 0.000 . 1 . . . . . 22 LYS CE . 51528 1
265 . 1 . 1 23 23 LYS H H 1 8.109 0.007 . 1 . . . . . 23 LYS H . 51528 1
266 . 1 . 1 23 23 LYS HA H 1 4.235 0.000 . 1 . . . . . 23 LYS HA . 51528 1
267 . 1 . 1 23 23 LYS HB2 H 1 1.795 0.007 . 2 . . . . . 23 LYS HB2 . 51528 1
268 . 1 . 1 23 23 LYS HB3 H 1 1.867 0.000 . 2 . . . . . 23 LYS HB3 . 51528 1
269 . 1 . 1 23 23 LYS HG2 H 1 1.481 0.000 . 2 . . . . . 23 LYS HG2 . 51528 1
270 . 1 . 1 23 23 LYS HG3 H 1 1.481 0.000 . 2 . . . . . 23 LYS HG3 . 51528 1
271 . 1 . 1 23 23 LYS HE2 H 1 2.934 0.004 . 2 . . . . . 23 LYS HE2 . 51528 1
272 . 1 . 1 23 23 LYS HE3 H 1 2.934 0.004 . 2 . . . . . 23 LYS HE3 . 51528 1
273 . 1 . 1 23 23 LYS CA C 13 56.705 0.000 . 1 . . . . . 23 LYS CA . 51528 1
274 . 1 . 1 25 25 LYS HA H 1 4.232 0.004 . 1 . . . . . 25 LYS HA . 51528 1
275 . 1 . 1 25 25 LYS HB2 H 1 1.799 0.004 . 2 . . . . . 25 LYS HB2 . 51528 1
276 . 1 . 1 25 25 LYS HB3 H 1 1.854 0.001 . 2 . . . . . 25 LYS HB3 . 51528 1
277 . 1 . 1 25 25 LYS HG2 H 1 1.473 0.005 . 2 . . . . . 25 LYS HG2 . 51528 1
278 . 1 . 1 25 25 LYS HG3 H 1 1.473 0.005 . 2 . . . . . 25 LYS HG3 . 51528 1
279 . 1 . 1 25 25 LYS HD2 H 1 1.678 0.002 . 2 . . . . . 25 LYS HD2 . 51528 1
280 . 1 . 1 25 25 LYS HD3 H 1 1.678 0.002 . 2 . . . . . 25 LYS HD3 . 51528 1
281 . 1 . 1 25 25 LYS HE2 H 1 2.979 0.003 . 2 . . . . . 25 LYS HE2 . 51528 1
282 . 1 . 1 25 25 LYS HE3 H 1 2.979 0.003 . 2 . . . . . 25 LYS HE3 . 51528 1
283 . 1 . 1 25 25 LYS CA C 13 56.192 0.000 . 1 . . . . . 25 LYS CA . 51528 1
284 . 1 . 1 25 25 LYS CB C 13 32.987 0.005 . 1 . . . . . 25 LYS CB . 51528 1
285 . 1 . 1 25 25 LYS CG C 13 24.847 0.000 . 1 . . . . . 25 LYS CG . 51528 1
286 . 1 . 1 25 25 LYS CD C 13 28.973 0.000 . 1 . . . . . 25 LYS CD . 51528 1
287 . 1 . 1 25 25 LYS CE C 13 41.881 0.000 . 1 . . . . . 25 LYS CE . 51528 1
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