Content for NMR-STAR saveframe, "chemical_shift_set_1"
save_chemical_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1
_Assigned_chem_shift_list.Entry_ID 6554
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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 '2D TOCSY' 1 $sample_1 . 6554 1
2 '2D NOESY' 1 $sample_1 . 6554 1
3 13C-HSQC 1 $sample_1 . 6554 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 ASP HA H 1 4.620 . . 1 . . . . . 1 ASP HA . 6554 1
2 . 1 . 1 1 1 ASP HB2 H 1 3.410 . . 2 . . . . . 1 ASP HB2 . 6554 1
3 . 1 . 1 2 2 ALA H H 1 9.003 . . 1 . . . . . 2 ALA H . 6554 1
4 . 1 . 1 2 2 ALA HA H 1 4.560 . . 1 . . . . . 2 ALA HA . 6554 1
5 . 1 . 1 2 2 ALA HB1 H 1 1.652 . . 1 . . . . . 2 ALA HB1 . 6554 1
6 . 1 . 1 2 2 ALA HB2 H 1 1.652 . . 1 . . . . . 2 ALA HB2 . 6554 1
7 . 1 . 1 2 2 ALA HB3 H 1 1.652 . . 1 . . . . . 2 ALA HB3 . 6554 1
8 . 1 . 1 3 3 GLU H H 1 8.465 . . 1 . . . . . 3 GLU H . 6554 1
9 . 1 . 1 3 3 GLU HA H 1 4.356 . . 1 . . . . . 3 GLU HA . 6554 1
10 . 1 . 1 3 3 GLU HB2 H 1 2.277 . . 2 . . . . . 3 GLU HB2 . 6554 1
11 . 1 . 1 3 3 GLU HB3 H 1 2.322 . . 2 . . . . . 3 GLU HB3 . 6554 1
12 . 1 . 1 3 3 GLU HG2 H 1 2.688 . . 2 . . . . . 3 GLU HG2 . 6554 1
13 . 1 . 1 3 3 GLU CA C 13 58.381 . . 1 . . . . . 3 GLU CA . 6554 1
14 . 1 . 1 4 4 PHE H H 1 8.163 . . 1 . . . . . 4 PHE H . 6554 1
15 . 1 . 1 4 4 PHE HA H 1 4.759 . . 1 . . . . . 4 PHE HA . 6554 1
16 . 1 . 1 4 4 PHE HB2 H 1 3.390 . . 2 . . . . . 4 PHE HB2 . 6554 1
17 . 1 . 1 4 4 PHE HD1 H 1 7.468 . . 3 . . . . . 4 PHE HD1 . 6554 1
18 . 1 . 1 4 4 PHE HE1 H 1 7.570 . . 3 . . . . . 4 PHE HE1 . 6554 1
19 . 1 . 1 4 4 PHE CA C 13 58.362 . . 1 . . . . . 4 PHE CA . 6554 1
20 . 1 . 1 5 5 ARG H H 1 8.225 . . 1 . . . . . 5 ARG H . 6554 1
21 . 1 . 1 5 5 ARG HA H 1 4.328 . . 1 . . . . . 5 ARG HA . 6554 1
22 . 1 . 1 5 5 ARG HB2 H 1 2.194 . . 2 . . . . . 5 ARG HB2 . 6554 1
23 . 1 . 1 5 5 ARG HB3 H 1 2.152 . . 2 . . . . . 5 ARG HB3 . 6554 1
24 . 1 . 1 5 5 ARG HG2 H 1 1.904 . . 2 . . . . . 5 ARG HG2 . 6554 1
25 . 1 . 1 5 5 ARG HG3 H 1 1.723 . . 2 . . . . . 5 ARG HG3 . 6554 1
26 . 1 . 1 5 5 ARG HD2 H 1 0.000 . . 2 . . . . . 5 ARG HD2 . 6554 1
27 . 1 . 1 5 5 ARG HE H 1 7.430 . . 1 . . . . . 5 ARG HE . 6554 1
28 . 1 . 1 6 6 HIS H H 1 8.601 . . 1 . . . . . 6 HIS H . 6554 1
29 . 1 . 1 6 6 HIS HA H 1 4.822 . . 1 . . . . . 6 HIS HA . 6554 1
30 . 1 . 1 6 6 HIS HB2 H 1 3.573 . . 2 . . . . . 6 HIS HB2 . 6554 1
31 . 1 . 1 6 6 HIS HB3 H 1 3.498 . . 2 . . . . . 6 HIS HB3 . 6554 1
32 . 1 . 1 6 6 HIS HD2 H 1 7.526 . . 1 . . . . . 6 HIS HD2 . 6554 1
33 . 1 . 1 6 6 HIS CA C 13 55.972 . . 1 . . . . . 6 HIS CA . 6554 1
34 . 1 . 1 7 7 ASP H H 1 8.718 . . 1 . . . . . 7 ASP H . 6554 1
35 . 1 . 1 7 7 ASP HA H 1 4.971 . . 1 . . . . . 7 ASP HA . 6554 1
36 . 1 . 1 7 7 ASP HB2 H 1 3.205 . . 2 . . . . . 7 ASP HB2 . 6554 1
37 . 1 . 1 7 7 ASP CA C 13 53.274 . . 1 . . . . . 7 ASP CA . 6554 1
38 . 1 . 1 8 8 SER H H 1 8.554 . . 1 . . . . . 8 SER H . 6554 1
39 . 1 . 1 8 8 SER HA H 1 4.554 . . 1 . . . . . 8 SER HA . 6554 1
40 . 1 . 1 8 8 SER HB2 H 1 4.081 . . 2 . . . . . 8 SER HB2 . 6554 1
41 . 1 . 1 8 8 SER HB3 H 1 4.154 . . 2 . . . . . 8 SER HB3 . 6554 1
42 . 1 . 1 8 8 SER CA C 13 59.764 . . 1 . . . . . 8 SER CA . 6554 1
43 . 1 . 1 10 10 TYR H H 1 8.231 . . 1 . . . . . 10 TYR H . 6554 1
44 . 1 . 1 10 10 TYR HA H 1 4.508 . . 1 . . . . . 10 TYR HA . 6554 1
45 . 1 . 1 10 10 TYR HB2 H 1 3.372 . . 2 . . . . . 10 TYR HB2 . 6554 1
46 . 1 . 1 10 10 TYR HD1 H 1 7.322 . . 3 . . . . . 10 TYR HD1 . 6554 1
47 . 1 . 1 10 10 TYR HE1 H 1 7.000 . . 3 . . . . . 10 TYR HE1 . 6554 1
48 . 1 . 1 10 10 TYR CA C 13 60.441 . . 1 . . . . . 10 TYR CA . 6554 1
49 . 1 . 1 11 11 GLU H H 1 8.599 . . 1 . . . . . 11 GLU H . 6554 1
50 . 1 . 1 11 11 GLU HA H 1 4.352 . . 1 . . . . . 11 GLU HA . 6554 1
51 . 1 . 1 11 11 GLU HB2 H 1 2.065 . . 2 . . . . . 11 GLU HB2 . 6554 1
52 . 1 . 1 11 11 GLU HB3 H 1 2.102 . . 2 . . . . . 11 GLU HB3 . 6554 1
53 . 1 . 1 11 11 GLU HG2 H 1 3.431 . . 2 . . . . . 11 GLU HG2 . 6554 1
54 . 1 . 1 11 11 GLU CA C 13 57.965 . . 1 . . . . . 11 GLU CA . 6554 1
55 . 1 . 1 12 12 VAL H H 1 8.573 . . 1 . . . . . 12 VAL H . 6554 1
56 . 1 . 1 12 12 VAL HA H 1 4.008 . . 1 . . . . . 12 VAL HA . 6554 1
57 . 1 . 1 12 12 VAL HB H 1 2.333 . . 1 . . . . . 12 VAL HB . 6554 1
58 . 1 . 1 12 12 VAL HG11 H 1 1.300 . . 2 . . . . . 12 VAL HG11 . 6554 1
59 . 1 . 1 12 12 VAL HG12 H 1 1.300 . . 2 . . . . . 12 VAL HG12 . 6554 1
60 . 1 . 1 12 12 VAL HG13 H 1 1.300 . . 2 . . . . . 12 VAL HG13 . 6554 1
61 . 1 . 1 12 12 VAL HG21 H 1 1.137 . . 2 . . . . . 12 VAL HG21 . 6554 1
62 . 1 . 1 12 12 VAL HG22 H 1 1.137 . . 2 . . . . . 12 VAL HG22 . 6554 1
63 . 1 . 1 12 12 VAL HG23 H 1 1.137 . . 2 . . . . . 12 VAL HG23 . 6554 1
64 . 1 . 1 12 12 VAL CA C 13 65.387 . . 1 . . . . . 12 VAL CA . 6554 1
65 . 1 . 1 13 13 HIS H H 1 8.204 . . 1 . . . . . 13 HIS H . 6554 1
66 . 1 . 1 13 13 HIS HA H 1 4.530 . . 1 . . . . . 13 HIS HA . 6554 1
67 . 1 . 1 13 13 HIS HB2 H 1 0.000 . . 2 . . . . . 13 HIS HB2 . 6554 1
68 . 1 . 1 13 13 HIS HB3 H 1 3.480 . . 2 . . . . . 13 HIS HB3 . 6554 1
69 . 1 . 1 13 13 HIS HD2 H 1 7.430 . . 1 . . . . . 13 HIS HD2 . 6554 1
70 . 1 . 1 13 13 HIS CA C 13 57.306 . . 1 . . . . . 13 HIS CA . 6554 1
71 . 1 . 1 14 14 HIS H H 1 8.628 . . 1 . . . . . 14 HIS H . 6554 1
72 . 1 . 1 14 14 HIS HA H 1 4.489 . . 1 . . . . . 14 HIS HA . 6554 1
73 . 1 . 1 14 14 HIS HB2 H 1 3.344 . . 2 . . . . . 14 HIS HB2 . 6554 1
74 . 1 . 1 14 14 HIS HB3 H 1 3.533 . . 2 . . . . . 14 HIS HB3 . 6554 1
75 . 1 . 1 14 14 HIS HD2 H 1 7.416 . . 1 . . . . . 14 HIS HD2 . 6554 1
76 . 1 . 1 14 14 HIS CA C 13 56.529 . . 1 . . . . . 14 HIS CA . 6554 1
77 . 1 . 1 15 15 GLN H H 1 8.533 . . 1 . . . . . 15 GLN H . 6554 1
78 . 1 . 1 15 15 GLN HA H 1 4.199 . . 1 . . . . . 15 GLN HA . 6554 1
79 . 1 . 1 15 15 GLN HB2 H 1 2.382 . . 2 . . . . . 15 GLN HB2 . 6554 1
80 . 1 . 1 15 15 GLN HB3 H 1 2.477 . . 2 . . . . . 15 GLN HB3 . 6554 1
81 . 1 . 1 15 15 GLN HG2 H 1 2.580 . . 2 . . . . . 15 GLN HG2 . 6554 1
82 . 1 . 1 15 15 GLN HE21 H 1 6.610 . . 1 . . . . . 15 GLN HE21 . 6554 1
83 . 1 . 1 15 15 GLN HE22 H 1 6.720 . . 1 . . . . . 15 GLN HE22 . 6554 1
84 . 1 . 1 15 15 GLN CA C 13 57.704 . . 1 . . . . . 15 GLN CA . 6554 1
85 . 1 . 1 16 16 LYS H H 1 8.243 . . 1 . . . . . 16 LYS H . 6554 1
86 . 1 . 1 16 16 LYS HA H 1 4.351 . . 1 . . . . . 16 LYS HA . 6554 1
87 . 1 . 1 16 16 LYS HB2 H 1 2.098 . . 2 . . . . . 16 LYS HB2 . 6554 1
88 . 1 . 1 16 16 LYS HB3 H 1 2.050 . . 2 . . . . . 16 LYS HB3 . 6554 1
89 . 1 . 1 16 16 LYS HG2 H 1 1.902 . . 2 . . . . . 16 LYS HG2 . 6554 1
90 . 1 . 1 16 16 LYS HG3 H 1 1.832 . . 2 . . . . . 16 LYS HG3 . 6554 1
91 . 1 . 1 16 16 LYS HE2 H 1 3.428 . . 2 . . . . . 16 LYS HE2 . 6554 1
92 . 1 . 1 16 16 LYS HZ1 H 1 7.414 . . 1 . . . . . 16 LYS HZ1 . 6554 1
93 . 1 . 1 16 16 LYS HZ2 H 1 7.414 . . 1 . . . . . 16 LYS HZ2 . 6554 1
94 . 1 . 1 16 16 LYS HZ3 H 1 7.414 . . 1 . . . . . 16 LYS HZ3 . 6554 1
95 . 1 . 1 17 17 LEU H H 1 7.812 . . 1 . . . . . 17 LEU H . 6554 1
96 . 1 . 1 17 17 LEU HA H 1 4.481 . . 1 . . . . . 17 LEU HA . 6554 1
97 . 1 . 1 17 17 LEU HB2 H 1 1.967 . . 2 . . . . . 17 LEU HB2 . 6554 1
98 . 1 . 1 17 17 LEU HB3 H 1 1.927 . . 2 . . . . . 17 LEU HB3 . 6554 1
99 . 1 . 1 17 17 LEU HG H 1 1.800 . . 1 . . . . . 17 LEU HG . 6554 1
100 . 1 . 1 17 17 LEU HD11 H 1 1.113 . . 1 . . . . . 17 LEU HD11 . 6554 1
101 . 1 . 1 17 17 LEU HD12 H 1 1.113 . . 1 . . . . . 17 LEU HD12 . 6554 1
102 . 1 . 1 17 17 LEU HD13 H 1 1.113 . . 1 . . . . . 17 LEU HD13 . 6554 1
103 . 1 . 1 17 17 LEU HD21 H 1 1.154 . . 1 . . . . . 17 LEU HD21 . 6554 1
104 . 1 . 1 17 17 LEU HD22 H 1 1.154 . . 1 . . . . . 17 LEU HD22 . 6554 1
105 . 1 . 1 17 17 LEU HD23 H 1 1.154 . . 1 . . . . . 17 LEU HD23 . 6554 1
106 . 1 . 1 17 17 LEU CA C 13 58.525 . . 1 . . . . . 17 LEU CA . 6554 1
107 . 1 . 1 18 18 VAL H H 1 7.965 . . 1 . . . . . 18 VAL H . 6554 1
108 . 1 . 1 18 18 VAL HA H 1 3.853 . . 1 . . . . . 18 VAL HA . 6554 1
109 . 1 . 1 18 18 VAL HB H 1 2.278 . . 1 . . . . . 18 VAL HB . 6554 1
110 . 1 . 1 18 18 VAL HG21 H 1 1.103 . . 4 . . . . . 18 VAL HG21 . 6554 1
111 . 1 . 1 18 18 VAL HG22 H 1 1.103 . . 4 . . . . . 18 VAL HG22 . 6554 1
112 . 1 . 1 18 18 VAL HG23 H 1 1.103 . . 4 . . . . . 18 VAL HG23 . 6554 1
113 . 1 . 1 18 18 VAL CA C 13 65.647 . . 1 . . . . . 18 VAL CA . 6554 1
114 . 1 . 1 19 19 PHE H H 1 8.277 . . 1 . . . . . 19 PHE H . 6554 1
115 . 1 . 1 19 19 PHE HA H 1 4.626 . . 1 . . . . . 19 PHE HA . 6554 1
116 . 1 . 1 19 19 PHE HB2 H 1 3.390 . . 2 . . . . . 19 PHE HB2 . 6554 1
117 . 1 . 1 19 19 PHE HB3 H 1 3.423 . . 2 . . . . . 19 PHE HB3 . 6554 1
118 . 1 . 1 19 19 PHE HD1 H 1 7.431 . . 3 . . . . . 19 PHE HD1 . 6554 1
119 . 1 . 1 19 19 PHE HE1 H 1 7.519 . . 3 . . . . . 19 PHE HE1 . 6554 1
120 . 1 . 1 19 19 PHE CA C 13 59.326 . . 1 . . . . . 19 PHE CA . 6554 1
121 . 1 . 1 20 20 PHE H H 1 8.687 . . 1 . . . . . 20 PHE H . 6554 1
122 . 1 . 1 20 20 PHE HA H 1 4.512 . . 1 . . . . . 20 PHE HA . 6554 1
123 . 1 . 1 20 20 PHE HB2 H 1 3.541 . . 2 . . . . . 20 PHE HB2 . 6554 1
124 . 1 . 1 20 20 PHE HB3 H 1 3.483 . . 2 . . . . . 20 PHE HB3 . 6554 1
125 . 1 . 1 20 20 PHE HD1 H 1 7.487 . . 3 . . . . . 20 PHE HD1 . 6554 1
126 . 1 . 1 20 20 PHE CA C 13 57.180 . . 1 . . . . . 20 PHE CA . 6554 1
127 . 1 . 1 21 21 ALA H H 1 9.099 . . 1 . . . . . 21 ALA H . 6554 1
128 . 1 . 1 21 21 ALA HA H 1 4.169 . . 1 . . . . . 21 ALA HA . 6554 1
129 . 1 . 1 21 21 ALA HB1 H 1 1.780 . . 1 . . . . . 21 ALA HB1 . 6554 1
130 . 1 . 1 21 21 ALA HB2 H 1 1.780 . . 1 . . . . . 21 ALA HB2 . 6554 1
131 . 1 . 1 21 21 ALA HB3 H 1 1.780 . . 1 . . . . . 21 ALA HB3 . 6554 1
132 . 1 . 1 21 21 ALA CA C 13 54.412 . . 1 . . . . . 21 ALA CA . 6554 1
133 . 1 . 1 22 22 GLU H H 1 8.702 . . 1 . . . . . 22 GLU H . 6554 1
134 . 1 . 1 22 22 GLU HA H 1 4.365 . . 1 . . . . . 22 GLU HA . 6554 1
135 . 1 . 1 22 22 GLU HB2 H 1 2.448 . . 2 . . . . . 22 GLU HB2 . 6554 1
136 . 1 . 1 22 22 GLU HB3 H 1 2.362 . . 2 . . . . . 22 GLU HB3 . 6554 1
137 . 1 . 1 22 22 GLU HG2 H 1 2.893 . . 2 . . . . . 22 GLU HG2 . 6554 1
138 . 1 . 1 22 22 GLU HG3 H 1 2.737 . . 2 . . . . . 22 GLU HG3 . 6554 1
139 . 1 . 1 23 23 ASP H H 1 8.453 . . 1 . . . . . 23 ASP H . 6554 1
140 . 1 . 1 23 23 ASP HA H 1 4.770 . . 1 . . . . . 23 ASP HA . 6554 1
141 . 1 . 1 23 23 ASP HB2 H 1 3.060 . . 2 . . . . . 23 ASP HB2 . 6554 1
142 . 1 . 1 23 23 ASP CA C 13 54.539 . . 1 . . . . . 23 ASP CA . 6554 1
143 . 1 . 1 24 24 VAL H H 1 8.447 . . 1 . . . . . 24 VAL H . 6554 1
144 . 1 . 1 24 24 VAL HA H 1 3.946 . . 1 . . . . . 24 VAL HA . 6554 1
145 . 1 . 1 24 24 VAL HB H 1 2.105 . . 1 . . . . . 24 VAL HB . 6554 1
146 . 1 . 1 24 24 VAL HG11 H 1 0.916 . . 2 . . . . . 24 VAL HG11 . 6554 1
147 . 1 . 1 24 24 VAL HG12 H 1 0.916 . . 2 . . . . . 24 VAL HG12 . 6554 1
148 . 1 . 1 24 24 VAL HG13 H 1 0.916 . . 2 . . . . . 24 VAL HG13 . 6554 1
149 . 1 . 1 24 24 VAL HG21 H 1 1.037 . . 2 . . . . . 24 VAL HG21 . 6554 1
150 . 1 . 1 24 24 VAL HG22 H 1 1.037 . . 2 . . . . . 24 VAL HG22 . 6554 1
151 . 1 . 1 24 24 VAL HG23 H 1 1.037 . . 2 . . . . . 24 VAL HG23 . 6554 1
152 . 1 . 1 24 24 VAL CA C 13 64.736 . . 1 . . . . . 24 VAL CA . 6554 1
153 . 1 . 1 25 25 GLY H H 1 8.432 . . 1 . . . . . 25 GLY H . 6554 1
154 . 1 . 1 25 25 GLY HA2 H 1 4.083 . . 2 . . . . . 25 GLY HA2 . 6554 1
155 . 1 . 1 25 25 GLY CA C 13 45.368 . . 1 . . . . . 25 GLY CA . 6554 1
156 . 1 . 1 26 26 SER H H 1 8.084 . . 1 . . . . . 26 SER H . 6554 1
157 . 1 . 1 26 26 SER HA H 1 4.655 . . 1 . . . . . 26 SER HA . 6554 1
158 . 1 . 1 26 26 SER HB2 H 1 4.228 . . 2 . . . . . 26 SER HB2 . 6554 1
159 . 1 . 1 26 26 SER HB3 H 1 4.277 . . 2 . . . . . 26 SER HB3 . 6554 1
160 . 1 . 1 26 26 SER CA C 13 58.667 . . 1 . . . . . 26 SER CA . 6554 1
161 . 1 . 1 27 27 ASN H H 1 8.205 . . 1 . . . . . 27 ASN H . 6554 1
162 . 1 . 1 27 27 ASN HA H 1 5.059 . . 1 . . . . . 27 ASN HA . 6554 1
163 . 1 . 1 27 27 ASN HB2 H 1 3.082 . . 2 . . . . . 27 ASN HB2 . 6554 1
164 . 1 . 1 27 27 ASN HB3 H 1 3.178 . . 2 . . . . . 27 ASN HB3 . 6554 1
165 . 1 . 1 27 27 ASN HD21 H 1 7.567 . . 1 . . . . . 27 ASN HD21 . 6554 1
166 . 1 . 1 27 27 ASN HD22 H 1 6.808 . . 1 . . . . . 27 ASN HD22 . 6554 1
167 . 1 . 1 28 28 LYS H H 1 8.381 . . 1 . . . . . 28 LYS H . 6554 1
168 . 1 . 1 28 28 LYS HA H 1 4.372 . . 1 . . . . . 28 LYS HA . 6554 1
169 . 1 . 1 28 28 LYS HB2 H 1 2.135 . . 2 . . . . . 28 LYS HB2 . 6554 1
170 . 1 . 1 28 28 LYS HB3 H 1 2.166 . . 2 . . . . . 28 LYS HB3 . 6554 1
171 . 1 . 1 28 28 LYS HD2 H 1 1.804 . . 2 . . . . . 28 LYS HD2 . 6554 1
172 . 1 . 1 28 28 LYS HE2 H 1 3.178 . . 2 . . . . . 28 LYS HE2 . 6554 1
173 . 1 . 1 28 28 LYS HZ1 H 1 7.490 . . 1 . . . . . 28 LYS HZ1 . 6554 1
174 . 1 . 1 28 28 LYS HZ2 H 1 7.490 . . 1 . . . . . 28 LYS HZ2 . 6554 1
175 . 1 . 1 28 28 LYS HZ3 H 1 7.490 . . 1 . . . . . 28 LYS HZ3 . 6554 1
176 . 1 . 1 29 29 GLY H H 1 8.492 . . 1 . . . . . 29 GLY H . 6554 1
177 . 1 . 1 29 29 GLY HA2 H 1 4.098 . . 2 . . . . . 29 GLY HA2 . 6554 1
178 . 1 . 1 30 30 ALA H H 1 7.910 . . 1 . . . . . 30 ALA H . 6554 1
179 . 1 . 1 30 30 ALA HA H 1 4.487 . . 1 . . . . . 30 ALA HA . 6554 1
180 . 1 . 1 30 30 ALA HB1 H 1 1.737 . . 1 . . . . . 30 ALA HB1 . 6554 1
181 . 1 . 1 30 30 ALA HB2 H 1 1.737 . . 1 . . . . . 30 ALA HB2 . 6554 1
182 . 1 . 1 30 30 ALA HB3 H 1 1.737 . . 1 . . . . . 30 ALA HB3 . 6554 1
183 . 1 . 1 30 30 ALA CA C 13 53.427 . . 1 . . . . . 30 ALA CA . 6554 1
184 . 1 . 1 31 31 ILE H H 1 7.777 . . 1 . . . . . 31 ILE H . 6554 1
185 . 1 . 1 31 31 ILE HA H 1 4.151 . . 1 . . . . . 31 ILE HA . 6554 1
186 . 1 . 1 31 31 ILE HB H 1 2.231 . . 1 . . . . . 31 ILE HB . 6554 1
187 . 1 . 1 31 31 ILE HG12 H 1 1.521 . . 1 . . . . . 31 ILE HG12 . 6554 1
188 . 1 . 1 31 31 ILE HG13 H 1 0.000 . . 1 . . . . . 31 ILE HG13 . 6554 1
189 . 1 . 1 31 31 ILE HG21 H 1 1.221 . . 1 . . . . . 31 ILE HG21 . 6554 1
190 . 1 . 1 31 31 ILE HG22 H 1 1.221 . . 1 . . . . . 31 ILE HG22 . 6554 1
191 . 1 . 1 31 31 ILE HG23 H 1 1.221 . . 1 . . . . . 31 ILE HG23 . 6554 1
192 . 1 . 1 31 31 ILE HD11 H 1 1.130 . . 1 . . . . . 31 ILE HD11 . 6554 1
193 . 1 . 1 31 31 ILE HD12 H 1 1.130 . . 1 . . . . . 31 ILE HD12 . 6554 1
194 . 1 . 1 31 31 ILE HD13 H 1 1.130 . . 1 . . . . . 31 ILE HD13 . 6554 1
195 . 1 . 1 31 31 ILE CA C 13 62.846 . . 1 . . . . . 31 ILE CA . 6554 1
196 . 1 . 1 32 32 ILE H H 1 8.032 . . 1 . . . . . 32 ILE H . 6554 1
197 . 1 . 1 32 32 ILE HA H 1 4.070 . . 1 . . . . . 32 ILE HA . 6554 1
198 . 1 . 1 32 32 ILE HB H 1 2.155 . . 1 . . . . . 32 ILE HB . 6554 1
199 . 1 . 1 32 32 ILE HG12 H 1 1.483 . . 1 . . . . . 32 ILE HG12 . 6554 1
200 . 1 . 1 32 32 ILE HG13 H 1 1.900 . . 1 . . . . . 32 ILE HG13 . 6554 1
201 . 1 . 1 32 32 ILE HG21 H 1 1.176 . . 1 . . . . . 32 ILE HG21 . 6554 1
202 . 1 . 1 32 32 ILE HG22 H 1 1.176 . . 1 . . . . . 32 ILE HG22 . 6554 1
203 . 1 . 1 32 32 ILE HG23 H 1 1.176 . . 1 . . . . . 32 ILE HG23 . 6554 1
204 . 1 . 1 32 32 ILE HD11 H 1 1.110 . . 1 . . . . . 32 ILE HD11 . 6554 1
205 . 1 . 1 32 32 ILE HD12 H 1 1.110 . . 1 . . . . . 32 ILE HD12 . 6554 1
206 . 1 . 1 32 32 ILE HD13 H 1 1.110 . . 1 . . . . . 32 ILE HD13 . 6554 1
207 . 1 . 1 32 32 ILE CA C 13 63.668 . . 1 . . . . . 32 ILE CA . 6554 1
208 . 1 . 1 33 33 GLY H H 1 8.087 . . 1 . . . . . 33 GLY H . 6554 1
209 . 1 . 1 33 33 GLY HA2 H 1 4.065 . . 2 . . . . . 33 GLY HA2 . 6554 1
210 . 1 . 1 34 34 LEU H H 1 8.101 . . 1 . . . . . 34 LEU H . 6554 1
211 . 1 . 1 34 34 LEU HA H 1 4.453 . . 1 . . . . . 34 LEU HA . 6554 1
212 . 1 . 1 34 34 LEU HB2 H 1 1.855 . . 2 . . . . . 34 LEU HB2 . 6554 1
213 . 1 . 1 34 34 LEU HB3 H 1 2.223 . . 2 . . . . . 34 LEU HB3 . 6554 1
214 . 1 . 1 34 34 LEU HG H 1 2.034 . . 1 . . . . . 34 LEU HG . 6554 1
215 . 1 . 1 34 34 LEU HD11 H 1 1.110 . . 2 . . . . . 34 LEU HD11 . 6554 1
216 . 1 . 1 34 34 LEU HD12 H 1 1.110 . . 2 . . . . . 34 LEU HD12 . 6554 1
217 . 1 . 1 34 34 LEU HD13 H 1 1.110 . . 2 . . . . . 34 LEU HD13 . 6554 1
218 . 1 . 1 34 34 LEU HD21 H 1 1.210 . . 2 . . . . . 34 LEU HD21 . 6554 1
219 . 1 . 1 34 34 LEU HD22 H 1 1.210 . . 2 . . . . . 34 LEU HD22 . 6554 1
220 . 1 . 1 34 34 LEU HD23 H 1 1.210 . . 2 . . . . . 34 LEU HD23 . 6554 1
221 . 1 . 1 34 34 LEU CA C 13 59.818 . . 1 . . . . . 34 LEU CA . 6554 1
222 . 1 . 1 35 35 MET H H 1 8.437 . . 1 . . . . . 35 MET H . 6554 1
223 . 1 . 1 35 35 MET HA H 1 4.548 . . 1 . . . . . 35 MET HA . 6554 1
224 . 1 . 1 35 35 MET HB2 H 1 2.580 . . 2 . . . . . 35 MET HB2 . 6554 1
225 . 1 . 1 35 35 MET HB3 H 1 2.380 . . 2 . . . . . 35 MET HB3 . 6554 1
226 . 1 . 1 35 35 MET HG2 H 1 2.980 . . 2 . . . . . 35 MET HG2 . 6554 1
227 . 1 . 1 35 35 MET HG3 H 1 2.812 . . 2 . . . . . 35 MET HG3 . 6554 1
228 . 1 . 1 35 35 MET HE1 H 1 0.000 . . 1 . . . . . 35 MET HE1 . 6554 1
229 . 1 . 1 35 35 MET HE2 H 1 0.000 . . 1 . . . . . 35 MET HE2 . 6554 1
230 . 1 . 1 35 35 MET HE3 H 1 0.000 . . 1 . . . . . 35 MET HE3 . 6554 1
231 . 1 . 1 35 35 MET CA C 13 52.815 . . 1 . . . . . 35 MET CA . 6554 1
232 . 1 . 1 36 36 VAL H H 1 8.801 . . 1 . . . . . 36 VAL H . 6554 1
233 . 1 . 1 36 36 VAL HA H 1 4.184 . . 1 . . . . . 36 VAL HA . 6554 1
234 . 1 . 1 36 36 VAL HB H 1 2.449 . . 1 . . . . . 36 VAL HB . 6554 1
235 . 1 . 1 36 36 VAL HG11 H 1 1.283 . . 2 . . . . . 36 VAL HG11 . 6554 1
236 . 1 . 1 36 36 VAL HG12 H 1 1.283 . . 2 . . . . . 36 VAL HG12 . 6554 1
237 . 1 . 1 36 36 VAL HG13 H 1 1.283 . . 2 . . . . . 36 VAL HG13 . 6554 1
238 . 1 . 1 36 36 VAL HG21 H 1 1.195 . . 2 . . . . . 36 VAL HG21 . 6554 1
239 . 1 . 1 36 36 VAL HG22 H 1 1.195 . . 2 . . . . . 36 VAL HG22 . 6554 1
240 . 1 . 1 36 36 VAL HG23 H 1 1.195 . . 2 . . . . . 36 VAL HG23 . 6554 1
241 . 1 . 1 36 36 VAL CA C 13 64.102 . . 1 . . . . . 36 VAL CA . 6554 1
242 . 1 . 1 37 37 GLY H H 1 8.269 . . 1 . . . . . 37 GLY H . 6554 1
243 . 1 . 1 37 37 GLY HA2 H 1 4.147 . . 2 . . . . . 37 GLY HA2 . 6554 1
244 . 1 . 1 37 37 GLY HA3 H 1 4.206 . . 2 . . . . . 37 GLY HA3 . 6554 1
245 . 1 . 1 38 38 GLY H H 1 8.149 . . 1 . . . . . 38 GLY H . 6554 1
246 . 1 . 1 38 38 GLY HA2 H 1 4.197 . . 2 . . . . . 38 GLY HA2 . 6554 1
247 . 1 . 1 39 39 VAL H H 1 7.965 . . 1 . . . . . 39 VAL H . 6554 1
248 . 1 . 1 39 39 VAL HA H 1 4.283 . . 1 . . . . . 39 VAL HA . 6554 1
249 . 1 . 1 39 39 VAL HB H 1 2.404 . . 1 . . . . . 39 VAL HB . 6554 1
250 . 1 . 1 39 39 VAL HG11 H 1 1.182 . . 2 . . . . . 39 VAL HG11 . 6554 1
251 . 1 . 1 39 39 VAL HG12 H 1 1.182 . . 2 . . . . . 39 VAL HG12 . 6554 1
252 . 1 . 1 39 39 VAL HG13 H 1 1.182 . . 2 . . . . . 39 VAL HG13 . 6554 1
253 . 1 . 1 39 39 VAL HG21 H 1 1.230 . . 2 . . . . . 39 VAL HG21 . 6554 1
254 . 1 . 1 39 39 VAL HG22 H 1 1.230 . . 2 . . . . . 39 VAL HG22 . 6554 1
255 . 1 . 1 39 39 VAL HG23 H 1 1.230 . . 2 . . . . . 39 VAL HG23 . 6554 1
256 . 1 . 1 39 39 VAL CA C 13 62.666 . . 1 . . . . . 39 VAL CA . 6554 1
257 . 1 . 1 40 40 VAL H H 1 7.924 . . 1 . . . . . 40 VAL H . 6554 1
258 . 1 . 1 40 40 VAL HA H 1 4.278 . . 1 . . . . . 40 VAL HA . 6554 1
259 . 1 . 1 40 40 VAL HB H 1 2.345 . . 1 . . . . . 40 VAL HB . 6554 1
260 . 1 . 1 40 40 VAL HG11 H 1 1.178 . . 2 . . . . . 40 VAL HG11 . 6554 1
261 . 1 . 1 40 40 VAL HG12 H 1 1.178 . . 2 . . . . . 40 VAL HG12 . 6554 1
262 . 1 . 1 40 40 VAL HG13 H 1 1.178 . . 2 . . . . . 40 VAL HG13 . 6554 1
263 . 1 . 1 40 40 VAL HG21 H 1 1.219 . . 2 . . . . . 40 VAL HG21 . 6554 1
264 . 1 . 1 40 40 VAL HG22 H 1 1.219 . . 2 . . . . . 40 VAL HG22 . 6554 1
265 . 1 . 1 40 40 VAL HG23 H 1 1.219 . . 2 . . . . . 40 VAL HG23 . 6554 1
266 . 1 . 1 40 40 VAL CA C 13 62.666 . . 1 . . . . . 40 VAL CA . 6554 1
267 . 1 . 1 41 41 ILE H H 1 7.888 . . 1 . . . . . 41 ILE H . 6554 1
268 . 1 . 1 41 41 ILE HA H 1 4.413 . . 1 . . . . . 41 ILE HA . 6554 1
269 . 1 . 1 41 41 ILE HB H 1 2.182 . . 1 . . . . . 41 ILE HB . 6554 1
270 . 1 . 1 41 41 ILE HG12 H 1 1.435 . . 2 . . . . . 41 ILE HG12 . 6554 1
271 . 1 . 1 41 41 ILE HG13 H 1 1.725 . . 2 . . . . . 41 ILE HG13 . 6554 1
272 . 1 . 1 41 41 ILE HG21 H 1 1.173 . . 1 . . . . . 41 ILE HG21 . 6554 1
273 . 1 . 1 41 41 ILE HG22 H 1 1.173 . . 1 . . . . . 41 ILE HG22 . 6554 1
274 . 1 . 1 41 41 ILE HG23 H 1 1.173 . . 1 . . . . . 41 ILE HG23 . 6554 1
275 . 1 . 1 41 41 ILE HD11 H 1 1.094 . . 1 . . . . . 41 ILE HD11 . 6554 1
276 . 1 . 1 41 41 ILE HD12 H 1 1.094 . . 1 . . . . . 41 ILE HD12 . 6554 1
277 . 1 . 1 41 41 ILE HD13 H 1 1.094 . . 1 . . . . . 41 ILE HD13 . 6554 1
278 . 1 . 1 41 41 ILE CA C 13 61.747 . . 1 . . . . . 41 ILE CA . 6554 1
279 . 1 . 1 42 42 ALA H H 1 7.887 . . 1 . . . . . 42 ALA H . 6554 1
280 . 1 . 1 42 42 ALA HA H 1 4.582 . . 1 . . . . . 42 ALA HA . 6554 1
281 . 1 . 1 42 42 ALA HB1 H 1 1.689 . . 1 . . . . . 42 ALA HB1 . 6554 1
282 . 1 . 1 42 42 ALA HB2 H 1 1.689 . . 1 . . . . . 42 ALA HB2 . 6554 1
283 . 1 . 1 42 42 ALA HB3 H 1 1.689 . . 1 . . . . . 42 ALA HB3 . 6554 1
284 . 1 . 1 42 42 ALA CA C 13 50.537 . . 1 . . . . . 42 ALA CA . 6554 1
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