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 52545
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 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 .
_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 1H-15N HSQC' . . . 52545 1
2 '2D 1H-13C HSQC' . . . 52545 1
3 '3D HNCACB' . . . 52545 1
4 '3D C(CO)NH' . . . 52545 1
7 '3D 1H-13C NOESY aliphatic3' . . . 52545 1
9 '3D HNCO' . . . 52545 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
1 $software_1 . . 52545 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 2 2 PRO HA H 1 4.44 0.02 . 1 . . . . . 2 PRO HA . 52545 1
2 . 1 . 1 2 2 PRO HB2 H 1 2.31 0.02 . 2 . . . . . 2 PRO HB2 . 52545 1
3 . 1 . 1 2 2 PRO HB3 H 1 2.00 0.02 . 2 . . . . . 2 PRO HB3 . 52545 1
4 . 1 . 1 2 2 PRO HD2 H 1 3.65 0.02 . 2 . . . . . 2 PRO HD2 . 52545 1
5 . 1 . 1 2 2 PRO HD3 H 1 3.60 0.02 . 2 . . . . . 2 PRO HD3 . 52545 1
6 . 1 . 1 2 2 PRO C C 13 177.0 0.2 . 1 . . . . . 2 PRO C . 52545 1
7 . 1 . 1 2 2 PRO CA C 13 63.5 0.2 . 1 . . . . . 2 PRO CA . 52545 1
8 . 1 . 1 2 2 PRO CB C 13 32.0 0.2 . 1 . . . . . 2 PRO CB . 52545 1
9 . 1 . 1 2 2 PRO CG C 13 26.9 0.2 . 1 . . . . . 2 PRO CG . 52545 1
10 . 1 . 1 2 2 PRO CD C 13 49.5 0.2 . 1 . . . . . 2 PRO CD . 52545 1
11 . 1 . 1 3 3 GLY H H 1 8.79 0.02 . 1 . . . . . 3 GLY H . 52545 1
12 . 1 . 1 3 3 GLY HA2 H 1 3.99 0.02 . 2 . . . . . 3 GLY HA2 . 52545 1
13 . 1 . 1 3 3 GLY HA3 H 1 3.99 0.02 . 2 . . . . . 3 GLY HA3 . 52545 1
14 . 1 . 1 3 3 GLY C C 13 174.2 0.2 . 1 . . . . . 3 GLY C . 52545 1
15 . 1 . 1 3 3 GLY CA C 13 45.4 0.2 . 1 . . . . . 3 GLY CA . 52545 1
16 . 1 . 1 3 3 GLY N N 15 109.0 0.2 . 1 . . . . . 3 GLY N . 52545 1
17 . 1 . 1 4 4 SER H H 1 8.22 0.02 . 1 . . . . . 4 SER H . 52545 1
18 . 1 . 1 4 4 SER HA H 1 4.39 0.02 . 1 . . . . . 4 SER HA . 52545 1
19 . 1 . 1 4 4 SER HB2 H 1 3.81 0.02 . 2 . . . . . 4 SER HB2 . 52545 1
20 . 1 . 1 4 4 SER HB3 H 1 3.81 0.02 . 2 . . . . . 4 SER HB3 . 52545 1
21 . 1 . 1 4 4 SER C C 13 174.4 0.2 . 1 . . . . . 4 SER C . 52545 1
22 . 1 . 1 4 4 SER CA C 13 59.0 0.2 . 1 . . . . . 4 SER CA . 52545 1
23 . 1 . 1 4 4 SER CB C 13 63.6 0.2 . 1 . . . . . 4 SER CB . 52545 1
24 . 1 . 1 4 4 SER N N 15 115.4 0.2 . 1 . . . . . 4 SER N . 52545 1
25 . 1 . 1 5 5 TYR H H 1 8.41 0.02 . 1 . . . . . 5 TYR H . 52545 1
26 . 1 . 1 5 5 TYR HA H 1 4.54 0.02 . 1 . . . . . 5 TYR HA . 52545 1
27 . 1 . 1 5 5 TYR HB2 H 1 3.08 0.02 . 2 . . . . . 5 TYR HB2 . 52545 1
28 . 1 . 1 5 5 TYR HB3 H 1 2.99 0.02 . 2 . . . . . 5 TYR HB3 . 52545 1
29 . 1 . 1 5 5 TYR HD1 H 1 7.12 0.02 . 3 . . . . . 5 TYR HD1 . 52545 1
30 . 1 . 1 5 5 TYR HD2 H 1 7.12 0.02 . 3 . . . . . 5 TYR HD2 . 52545 1
31 . 1 . 1 5 5 TYR C C 13 175.6 0.2 . 1 . . . . . 5 TYR C . 52545 1
32 . 1 . 1 5 5 TYR CA C 13 58.3 0.2 . 1 . . . . . 5 TYR CA . 52545 1
33 . 1 . 1 5 5 TYR CB C 13 38.3 0.2 . 1 . . . . . 5 TYR CB . 52545 1
34 . 1 . 1 5 5 TYR N N 15 121.0 0.2 . 1 . . . . . 5 TYR N . 52545 1
35 . 1 . 1 6 6 SER H H 1 8.22 0.02 . 1 . . . . . 6 SER H . 52545 1
36 . 1 . 1 6 6 SER HA H 1 4.54 0.02 . 1 . . . . . 6 SER HA . 52545 1
37 . 1 . 1 6 6 SER HB2 H 1 4.04 0.02 . 2 . . . . . 6 SER HB2 . 52545 1
38 . 1 . 1 6 6 SER HB3 H 1 3.89 0.02 . 2 . . . . . 6 SER HB3 . 52545 1
39 . 1 . 1 6 6 SER C C 13 174.8 0.2 . 1 . . . . . 6 SER C . 52545 1
40 . 1 . 1 6 6 SER CA C 13 58.5 0.2 . 1 . . . . . 6 SER CA . 52545 1
41 . 1 . 1 6 6 SER CB C 13 64.5 0.2 . 1 . . . . . 6 SER CB . 52545 1
42 . 1 . 1 6 6 SER N N 15 114.8 0.2 . 1 . . . . . 6 SER N . 52545 1
43 . 1 . 1 7 7 ARG H H 1 8.69 0.02 . 1 . . . . . 7 ARG H . 52545 1
44 . 1 . 1 7 7 ARG HA H 1 4.20 0.02 . 1 . . . . . 7 ARG HA . 52545 1
45 . 1 . 1 7 7 ARG HB2 H 1 1.85 0.02 . 2 . . . . . 7 ARG HB2 . 52545 1
46 . 1 . 1 7 7 ARG HB3 H 1 1.85 0.02 . 2 . . . . . 7 ARG HB3 . 52545 1
47 . 1 . 1 7 7 ARG HG2 H 1 1.70 0.02 . 2 . . . . . 7 ARG HG2 . 52545 1
48 . 1 . 1 7 7 ARG HG3 H 1 1.70 0.02 . 2 . . . . . 7 ARG HG3 . 52545 1
49 . 1 . 1 7 7 ARG HD2 H 1 3.23 0.02 . 2 . . . . . 7 ARG HD2 . 52545 1
50 . 1 . 1 7 7 ARG HD3 H 1 3.23 0.02 . 2 . . . . . 7 ARG HD3 . 52545 1
51 . 1 . 1 7 7 ARG HE H 1 7.61 0.02 . 1 . . . . . 7 ARG HE . 52545 1
52 . 1 . 1 7 7 ARG C C 13 177.2 0.2 . 1 . . . . . 7 ARG C . 52545 1
53 . 1 . 1 7 7 ARG CA C 13 58.1 0.2 . 1 . . . . . 7 ARG CA . 52545 1
54 . 1 . 1 7 7 ARG CB C 13 31.0 0.2 . 1 . . . . . 7 ARG CB . 52545 1
55 . 1 . 1 7 7 ARG CG C 13 27.6 0.2 . 1 . . . . . 7 ARG CG . 52545 1
56 . 1 . 1 7 7 ARG CD C 13 43.4 0.2 . 1 . . . . . 7 ARG CD . 52545 1
57 . 1 . 1 7 7 ARG N N 15 122.0 0.2 . 1 . . . . . 7 ARG N . 52545 1
58 . 1 . 1 7 7 ARG NE N 15 102.1 0.2 . 1 . . . . . 7 ARG NE . 52545 1
59 . 1 . 1 8 8 LEU H H 1 8.16 0.02 . 1 . . . . . 8 LEU H . 52545 1
60 . 1 . 1 8 8 LEU HA H 1 4.22 0.02 . 1 . . . . . 8 LEU HA . 52545 1
61 . 1 . 1 8 8 LEU HB2 H 1 1.71 0.02 . 2 . . . . . 8 LEU HB2 . 52545 1
62 . 1 . 1 8 8 LEU HB3 H 1 1.53 0.02 . 2 . . . . . 8 LEU HB3 . 52545 1
63 . 1 . 1 8 8 LEU HD11 H 1 0.96 0.02 . 2 . . . . . 8 LEU MD1 . 52545 1
64 . 1 . 1 8 8 LEU HD12 H 1 0.96 0.02 . 2 . . . . . 8 LEU MD1 . 52545 1
65 . 1 . 1 8 8 LEU HD13 H 1 0.96 0.02 . 2 . . . . . 8 LEU MD1 . 52545 1
66 . 1 . 1 8 8 LEU HD21 H 1 0.96 0.02 . 2 . . . . . 8 LEU MD2 . 52545 1
67 . 1 . 1 8 8 LEU HD22 H 1 0.96 0.02 . 2 . . . . . 8 LEU MD2 . 52545 1
68 . 1 . 1 8 8 LEU HD23 H 1 0.96 0.02 . 2 . . . . . 8 LEU MD2 . 52545 1
69 . 1 . 1 8 8 LEU C C 13 178.0 0.2 . 1 . . . . . 8 LEU C . 52545 1
70 . 1 . 1 8 8 LEU CA C 13 56.5 0.2 . 1 . . . . . 8 LEU CA . 52545 1
71 . 1 . 1 8 8 LEU CB C 13 41.9 0.2 . 1 . . . . . 8 LEU CB . 52545 1
72 . 1 . 1 8 8 LEU CD1 C 13 25.1 0.2 . 2 . . . . . 8 LEU CD1 . 52545 1
73 . 1 . 1 8 8 LEU CD2 C 13 23.7 0.2 . 2 . . . . . 8 LEU CD2 . 52545 1
74 . 1 . 1 8 8 LEU N N 15 119.5 0.2 . 1 . . . . . 8 LEU N . 52545 1
75 . 1 . 1 9 9 GLY H H 1 8.25 0.02 . 1 . . . . . 9 GLY H . 52545 1
76 . 1 . 1 9 9 GLY HA2 H 1 4.01 0.02 . 2 . . . . . 9 GLY HA2 . 52545 1
77 . 1 . 1 9 9 GLY HA3 H 1 3.92 0.02 . 2 . . . . . 9 GLY HA3 . 52545 1
78 . 1 . 1 9 9 GLY C C 13 175.5 0.2 . 1 . . . . . 9 GLY C . 52545 1
79 . 1 . 1 9 9 GLY CA C 13 46.3 0.2 . 1 . . . . . 9 GLY CA . 52545 1
80 . 1 . 1 9 9 GLY N N 15 107.1 0.2 . 1 . . . . . 9 GLY N . 52545 1
81 . 1 . 1 10 10 PHE H H 1 8.40 0.02 . 1 . . . . . 10 PHE H . 52545 1
82 . 1 . 1 10 10 PHE HB2 H 1 3.18 0.02 . 2 . . . . . 10 PHE HB2 . 52545 1
83 . 1 . 1 10 10 PHE HB3 H 1 3.18 0.02 . 2 . . . . . 10 PHE HB3 . 52545 1
84 . 1 . 1 10 10 PHE HD1 H 1 7.25 0.02 . 3 . . . . . 10 PHE HD1 . 52545 1
85 . 1 . 1 10 10 PHE HD2 H 1 7.25 0.02 . 3 . . . . . 10 PHE HD2 . 52545 1
86 . 1 . 1 10 10 PHE C C 13 176.9 0.2 . 1 . . . . . 10 PHE C . 52545 1
87 . 1 . 1 10 10 PHE CA C 13 60.1 0.2 . 1 . . . . . 10 PHE CA . 52545 1
88 . 1 . 1 10 10 PHE CB C 13 39.2 0.2 . 1 . . . . . 10 PHE CB . 52545 1
89 . 1 . 1 10 10 PHE N N 15 120.7 0.2 . 1 . . . . . 10 PHE N . 52545 1
90 . 1 . 1 11 11 GLY H H 1 8.71 0.02 . 1 . . . . . 11 GLY H . 52545 1
91 . 1 . 1 11 11 GLY HA2 H 1 4.02 0.02 . 2 . . . . . 11 GLY HA2 . 52545 1
92 . 1 . 1 11 11 GLY HA3 H 1 3.72 0.02 . 2 . . . . . 11 GLY HA3 . 52545 1
93 . 1 . 1 11 11 GLY C C 13 175.6 0.2 . 1 . . . . . 11 GLY C . 52545 1
94 . 1 . 1 11 11 GLY CA C 13 47.2 0.02 . 1 . . . . . 11 GLY CA . 52545 1
95 . 1 . 1 11 11 GLY N N 15 106.8 0.2 . 1 . . . . . 11 GLY N . 52545 1
96 . 1 . 1 12 12 LYS H H 1 8.16 0.02 . 1 . . . . . 12 LYS H . 52545 1
97 . 1 . 1 12 12 LYS HA H 1 4.17 0.02 . 1 . . . . . 12 LYS HA . 52545 1
98 . 1 . 1 12 12 LYS C C 13 178.7 0.2 . 1 . . . . . 12 LYS C . 52545 1
99 . 1 . 1 12 12 LYS N N 15 121.0 0.2 . 1 . . . . . 12 LYS N . 52545 1
100 . 1 . 1 13 13 ALA H H 1 8.06 0.02 . 1 . . . . . 13 ALA H . 52545 1
101 . 1 . 1 13 13 ALA HA H 1 4.18 0.02 . 1 . . . . . 13 ALA HA . 52545 1
102 . 1 . 1 13 13 ALA HB1 H 1 1.50 0.02 . 1 . . . . . 13 ALA MB . 52545 1
103 . 1 . 1 13 13 ALA HB2 H 1 1.50 0.02 . 1 . . . . . 13 ALA MB . 52545 1
104 . 1 . 1 13 13 ALA HB3 H 1 1.50 0.02 . 1 . . . . . 13 ALA MB . 52545 1
105 . 1 . 1 13 13 ALA C C 13 179.0 0.2 . 1 . . . . . 13 ALA C . 52545 1
106 . 1 . 1 13 13 ALA CA C 13 54.8 0.2 . 1 . . . . . 13 ALA CA . 52545 1
107 . 1 . 1 13 13 ALA CB C 13 18.4 0.2 . 1 . . . . . 13 ALA CB . 52545 1
108 . 1 . 1 13 13 ALA N N 15 122.1 0.2 . 1 . . . . . 13 ALA N . 52545 1
109 . 1 . 1 14 14 LEU H H 1 8.06 0.02 . 1 . . . . . 14 LEU H . 52545 1
110 . 1 . 1 14 14 LEU HA H 1 4.05 0.02 . 1 . . . . . 14 LEU HA . 52545 1
111 . 1 . 1 14 14 LEU HB2 H 1 1.77 0.02 . 2 . . . . . 14 LEU HB2 . 52545 1
112 . 1 . 1 14 14 LEU HB3 H 1 1.55 0.02 . 2 . . . . . 14 LEU HB3 . 52545 1
113 . 1 . 1 14 14 LEU HD11 H 1 0.86 0.02 . 2 . . . . . 14 LEU MD1 . 52545 1
114 . 1 . 1 14 14 LEU HD12 H 1 0.86 0.02 . 2 . . . . . 14 LEU MD1 . 52545 1
115 . 1 . 1 14 14 LEU HD13 H 1 0.86 0.02 . 2 . . . . . 14 LEU MD1 . 52545 1
116 . 1 . 1 14 14 LEU HD21 H 1 0.86 0.02 . 2 . . . . . 14 LEU MD2 . 52545 1
117 . 1 . 1 14 14 LEU HD22 H 1 0.86 0.02 . 2 . . . . . 14 LEU MD2 . 52545 1
118 . 1 . 1 14 14 LEU HD23 H 1 0.86 0.02 . 2 . . . . . 14 LEU MD2 . 52545 1
119 . 1 . 1 14 14 LEU C C 13 177.7 0.2 . 1 . . . . . 14 LEU C . 52545 1
120 . 1 . 1 14 14 LEU CA C 13 57.4 0.2 . 1 . . . . . 14 LEU CA . 52545 1
121 . 1 . 1 14 14 LEU CB C 13 41.4 0.2 . 1 . . . . . 14 LEU CB . 52545 1
122 . 1 . 1 14 14 LEU N N 15 122.1 0.2 . 1 . . . . . 14 LEU N . 52545 1
123 . 1 . 1 15 15 ASN H H 1 8.08 0.02 . 1 . . . . . 15 ASN H . 52545 1
124 . 1 . 1 15 15 ASN HA H 1 4.58 0.02 . 1 . . . . . 15 ASN HA . 52545 1
125 . 1 . 1 15 15 ASN HB2 H 1 2.88 0.02 . 2 . . . . . 15 ASN HB2 . 52545 1
126 . 1 . 1 15 15 ASN HB3 H 1 2.88 0.02 . 2 . . . . . 15 ASN HB3 . 52545 1
127 . 1 . 1 15 15 ASN HD21 H 1 7.70 0.02 . 2 . . . . . 15 ASN HD21 . 52545 1
128 . 1 . 1 15 15 ASN HD22 H 1 6.89 0.02 . 2 . . . . . 15 ASN HD22 . 52545 1
129 . 1 . 1 15 15 ASN C C 13 176.6 0.2 . 1 . . . . . 15 ASN C . 52545 1
130 . 1 . 1 15 15 ASN CB C 13 39.1 0.2 . 1 . . . . . 15 ASN CB . 52545 1
131 . 1 . 1 15 15 ASN N N 15 116.4 0.2 . 1 . . . . . 15 ASN N . 52545 1
132 . 1 . 1 15 15 ASN ND2 N 15 111.9 0.2 . 1 . . . . . 15 ASN ND2 . 52545 1
133 . 1 . 1 16 16 SER H H 1 8.11 0.02 . 1 . . . . . 16 SER H . 52545 1
134 . 1 . 1 16 16 SER HA H 1 4.34 0.02 . 1 . . . . . 16 SER HA . 52545 1
135 . 1 . 1 16 16 SER HB2 H 1 4.15 0.02 . 2 . . . . . 16 SER HB2 . 52545 1
136 . 1 . 1 16 16 SER HB3 H 1 4.05 0.02 . 2 . . . . . 16 SER HB3 . 52545 1
137 . 1 . 1 16 16 SER C C 13 176.4 0.2 . 1 . . . . . 16 SER C . 52545 1
138 . 1 . 1 16 16 SER CA C 13 61.8 0.2 . 1 . . . . . 16 SER CA . 52545 1
139 . 1 . 1 16 16 SER CB C 13 63.2 0.2 . 1 . . . . . 16 SER CB . 52545 1
140 . 1 . 1 16 16 SER N N 15 114.3 0.2 . 1 . . . . . 16 SER N . 52545 1
141 . 1 . 1 17 17 LEU H H 1 8.26 0.02 . 1 . . . . . 17 LEU H . 52545 1
142 . 1 . 1 17 17 LEU HB2 H 1 1.88 0.02 . 2 . . . . . 17 LEU HB2 . 52545 1
143 . 1 . 1 17 17 LEU HB3 H 1 1.65 0.02 . 2 . . . . . 17 LEU HB3 . 52545 1
144 . 1 . 1 17 17 LEU HD11 H 1 0.92 0.02 . 2 . . . . . 17 LEU MD1 . 52545 1
145 . 1 . 1 17 17 LEU HD12 H 1 0.92 0.02 . 2 . . . . . 17 LEU MD1 . 52545 1
146 . 1 . 1 17 17 LEU HD13 H 1 0.92 0.02 . 2 . . . . . 17 LEU MD1 . 52545 1
147 . 1 . 1 17 17 LEU HD21 H 1 0.92 0.02 . 2 . . . . . 17 LEU MD2 . 52545 1
148 . 1 . 1 17 17 LEU HD22 H 1 0.92 0.02 . 2 . . . . . 17 LEU MD2 . 52545 1
149 . 1 . 1 17 17 LEU HD23 H 1 0.92 0.02 . 2 . . . . . 17 LEU MD2 . 52545 1
150 . 1 . 1 17 17 LEU C C 13 178.3 0.2 . 1 . . . . . 17 LEU C . 52545 1
151 . 1 . 1 17 17 LEU CB C 13 41.8 0.2 . 1 . . . . . 17 LEU CB . 52545 1
152 . 1 . 1 17 17 LEU N N 15 123.1 0.2 . 1 . . . . . 17 LEU N . 52545 1
153 . 1 . 1 18 18 TRP H H 1 8.31 0.02 . 1 . . . . . 18 TRP H . 52545 1
154 . 1 . 1 18 18 TRP HA H 1 4.40 0.02 . 1 . . . . . 18 TRP HA . 52545 1
155 . 1 . 1 18 18 TRP HB2 H 1 3.48 0.02 . 2 . . . . . 18 TRP HB2 . 52545 1
156 . 1 . 1 18 18 TRP HB3 H 1 3.37 0.02 . 2 . . . . . 18 TRP HB3 . 52545 1
157 . 1 . 1 18 18 TRP HD1 H 1 7.25 0.02 . 1 . . . . . 18 TRP HD1 . 52545 1
158 . 1 . 1 18 18 TRP HE1 H 1 10.64 0.02 . 1 . . . . . 18 TRP HE1 . 52545 1
159 . 1 . 1 18 18 TRP HZ2 H 1 7.52 0.02 . 1 . . . . . 18 TRP HZ2 . 52545 1
160 . 1 . 1 18 18 TRP CB C 13 29.1 0.2 . 1 . . . . . 18 TRP CB . 52545 1
161 . 1 . 1 18 18 TRP N N 15 119.2 0.2 . 1 . . . . . 18 TRP N . 52545 1
162 . 1 . 1 18 18 TRP NE1 N 15 130.1 0.2 . 1 . . . . . 18 TRP NE1 . 52545 1
163 . 1 . 1 19 19 LEU H H 1 8.05 0.02 . 1 . . . . . 19 LEU H . 52545 1
164 . 1 . 1 19 19 LEU HA H 1 3.88 0.02 . 1 . . . . . 19 LEU HA . 52545 1
165 . 1 . 1 19 19 LEU C C 13 178.3 0.2 . 1 . . . . . 19 LEU C . 52545 1
166 . 1 . 1 19 19 LEU CA C 13 56.9 0.2 . 1 . . . . . 19 LEU CA . 52545 1
167 . 1 . 1 19 19 LEU CB C 13 42.0 0.2 . 1 . . . . . 19 LEU CB . 52545 1
168 . 1 . 1 19 19 LEU N N 15 119.1 0.2 . 1 . . . . . 19 LEU N . 52545 1
169 . 1 . 1 20 20 HIS H H 1 7.96 0.02 . 1 . . . . . 20 HIS H . 52545 1
170 . 1 . 1 20 20 HIS HA H 1 4.50 0.02 . 1 . . . . . 20 HIS HA . 52545 1
171 . 1 . 1 20 20 HIS HB2 H 1 3.41 0.02 . 2 . . . . . 20 HIS HB2 . 52545 1
172 . 1 . 1 20 20 HIS HB3 H 1 3.26 0.02 . 2 . . . . . 20 HIS HB3 . 52545 1
173 . 1 . 1 20 20 HIS C C 13 175.6 0.2 . 1 . . . . . 20 HIS C . 52545 1
174 . 1 . 1 20 20 HIS CA C 13 57.1 0.2 . 1 . . . . . 20 HIS CA . 52545 1
175 . 1 . 1 20 20 HIS CB C 13 29.3 0.2 . 1 . . . . . 20 HIS CB . 52545 1
176 . 1 . 1 20 20 HIS N N 15 114.3 0.2 . 1 . . . . . 20 HIS N . 52545 1
177 . 1 . 1 21 21 GLY H H 1 8.08 0.02 . 1 . . . . . 21 GLY H . 52545 1
178 . 1 . 1 21 21 GLY HA2 H 1 4.04 0.02 . 2 . . . . . 21 GLY HA2 . 52545 1
179 . 1 . 1 21 21 GLY HA3 H 1 3.83 0.02 . 2 . . . . . 21 GLY HA3 . 52545 1
180 . 1 . 1 21 21 GLY CA C 13 45.5 0.2 . 1 . . . . . 21 GLY CA . 52545 1
181 . 1 . 1 21 21 GLY N N 15 107.5 0.2 . 1 . . . . . 21 GLY N . 52545 1
182 . 1 . 1 22 22 LEU HB2 H 1 1.61 0.02 . 2 . . . . . 22 LEU HB2 . 52545 1
183 . 1 . 1 22 22 LEU HB3 H 1 1.61 0.02 . 2 . . . . . 22 LEU HB3 . 52545 1
184 . 1 . 1 22 22 LEU CB C 13 43.6 0.2 . 1 . . . . . 22 LEU CB . 52545 1
185 . 1 . 1 24 24 PRO C C 13 176.6 0.2 . 1 . . . . . 24 PRO C . 52545 1
186 . 1 . 1 25 25 PRO C C 13 174.2 0.2 . 1 . . . . . 25 PRO C . 52545 1
187 . 1 . 1 25 25 PRO CA C 13 63.0 0.2 . 1 . . . . . 25 PRO CA . 52545 1
188 . 1 . 1 26 26 HIS H H 1 8.51 0.02 . 1 . . . . . 26 HIS H . 52545 1
189 . 1 . 1 26 26 HIS HA H 1 4.56 0.02 . 1 . . . . . 26 HIS HA . 52545 1
190 . 1 . 1 26 26 HIS HB2 H 1 3.19 0.02 . 2 . . . . . 26 HIS HB2 . 52545 1
191 . 1 . 1 26 26 HIS HB3 H 1 3.19 0.02 . 2 . . . . . 26 HIS HB3 . 52545 1
192 . 1 . 1 26 26 HIS CA C 13 56.0 0.2 . 1 . . . . . 26 HIS CA . 52545 1
193 . 1 . 1 26 26 HIS CB C 13 29.1 0.2 . 1 . . . . . 26 HIS CB . 52545 1
194 . 1 . 1 26 26 HIS N N 15 117.4 0.2 . 1 . . . . . 26 HIS N . 52545 1
195 . 1 . 1 27 27 ASN H H 1 8.58 0.02 . 1 . . . . . 27 ASN H . 52545 1
196 . 1 . 1 27 27 ASN HA H 1 4.58 0.02 . 1 . . . . . 27 ASN HA . 52545 1
197 . 1 . 1 27 27 ASN HB2 H 1 2.75 0.02 . 2 . . . . . 27 ASN HB2 . 52545 1
198 . 1 . 1 27 27 ASN HB3 H 1 2.75 0.02 . 2 . . . . . 27 ASN HB3 . 52545 1
199 . 1 . 1 27 27 ASN HD21 H 1 7.66 0.02 . 2 . . . . . 27 ASN HD21 . 52545 1
200 . 1 . 1 27 27 ASN HD22 H 1 6.89 0.02 . 2 . . . . . 27 ASN HD22 . 52545 1
201 . 1 . 1 27 27 ASN C C 13 174.8 0.2 . 1 . . . . . 27 ASN C . 52545 1
202 . 1 . 1 27 27 ASN CA C 13 53.7 0.2 . 1 . . . . . 27 ASN CA . 52545 1
203 . 1 . 1 27 27 ASN CB C 13 38.6 0.2 . 1 . . . . . 27 ASN CB . 52545 1
204 . 1 . 1 27 27 ASN N N 15 117.7 0.2 . 1 . . . . . 27 ASN N . 52545 1
205 . 1 . 1 27 27 ASN ND2 N 15 112.3 0.2 . 1 . . . . . 27 ASN ND2 . 52545 1
206 . 1 . 1 28 28 SER H H 1 8.18 0.02 . 1 . . . . . 28 SER H . 52545 1
207 . 1 . 1 28 28 SER HA H 1 4.39 0.02 . 1 . . . . . 28 SER HA . 52545 1
208 . 1 . 1 28 28 SER HB2 H 1 3.74 0.02 . 2 . . . . . 28 SER HB2 . 52545 1
209 . 1 . 1 28 28 SER HB3 H 1 3.74 0.02 . 2 . . . . . 28 SER HB3 . 52545 1
210 . 1 . 1 28 28 SER C C 13 173.3 0.2 . 1 . . . . . 28 SER C . 52545 1
211 . 1 . 1 28 28 SER CA C 13 58.5 0.2 . 1 . . . . . 28 SER CA . 52545 1
212 . 1 . 1 28 28 SER CB C 13 63.5 0.2 . 1 . . . . . 28 SER CB . 52545 1
213 . 1 . 1 28 28 SER N N 15 114.5 0.2 . 1 . . . . . 28 SER N . 52545 1
214 . 1 . 1 29 29 PHE H H 1 8.28 0.02 . 1 . . . . . 29 PHE H . 52545 1
215 . 1 . 1 29 29 PHE HA H 1 4.67 0.02 . 1 . . . . . 29 PHE HA . 52545 1
216 . 1 . 1 29 29 PHE HB2 H 1 2.77 0.02 . 2 . . . . . 29 PHE HB2 . 52545 1
217 . 1 . 1 29 29 PHE HB3 H 1 2.61 0.02 . 2 . . . . . 29 PHE HB3 . 52545 1
218 . 1 . 1 29 29 PHE HD1 H 1 7.25 0.02 . 3 . . . . . 29 PHE HD1 . 52545 1
219 . 1 . 1 29 29 PHE HD2 H 1 7.25 0.02 . 3 . . . . . 29 PHE HD2 . 52545 1
220 . 1 . 1 29 29 PHE CA C 13 55.6 0.2 . 1 . . . . . 29 PHE CA . 52545 1
221 . 1 . 1 29 29 PHE CB C 13 38.9 0.2 . 1 . . . . . 29 PHE CB . 52545 1
222 . 1 . 1 29 29 PHE N N 15 121.5 0.2 . 1 . . . . . 29 PHE N . 52545 1
223 . 1 . 1 30 30 PRO C C 13 175.5 0.2 . 1 . . . . . 30 PRO C . 52545 1
224 . 1 . 1 31 31 TRP H H 1 7.48 0.02 . 1 . . . . . 31 TRP H . 52545 1
225 . 1 . 1 31 31 TRP HA H 1 4.39 0.02 . 1 . . . . . 31 TRP HA . 52545 1
226 . 1 . 1 31 31 TRP HB2 H 1 3.34 0.02 . 2 . . . . . 31 TRP HB2 . 52545 1
227 . 1 . 1 31 31 TRP HB3 H 1 3.34 0.02 . 2 . . . . . 31 TRP HB3 . 52545 1
228 . 1 . 1 31 31 TRP HD1 H 1 7.32 0.02 . 1 . . . . . 31 TRP HD1 . 52545 1
229 . 1 . 1 31 31 TRP HE1 H 1 10.78 0.02 . 1 . . . . . 31 TRP HE1 . 52545 1
230 . 1 . 1 31 31 TRP C C 13 175.5 0.2 . 1 . . . . . 31 TRP C . 52545 1
231 . 1 . 1 31 31 TRP CA C 13 58.3 0.2 . 1 . . . . . 31 TRP CA . 52545 1
232 . 1 . 1 31 31 TRP CB C 13 28.9 0.2 . 1 . . . . . 31 TRP CB . 52545 1
233 . 1 . 1 31 31 TRP N N 15 115.7 0.2 . 1 . . . . . 31 TRP N . 52545 1
234 . 1 . 1 31 31 TRP NE1 N 15 131.2 0.2 . 1 . . . . . 31 TRP NE1 . 52545 1
235 . 1 . 1 32 32 ILE H H 1 7.63 0.02 . 1 . . . . . 32 ILE H . 52545 1
236 . 1 . 1 32 32 ILE HA H 1 4.25 0.02 . 1 . . . . . 32 ILE HA . 52545 1
237 . 1 . 1 32 32 ILE HB H 1 1.89 0.02 . 1 . . . . . 32 ILE HB . 52545 1
238 . 1 . 1 32 32 ILE HG12 H 1 1.36 0.02 . 2 . . . . . 32 ILE HG12 . 52545 1
239 . 1 . 1 32 32 ILE HG13 H 1 1.07 0.02 . 2 . . . . . 32 ILE HG13 . 52545 1
240 . 1 . 1 32 32 ILE HG21 H 1 0.91 0.02 . 1 . . . . . 32 ILE MG . 52545 1
241 . 1 . 1 32 32 ILE HG22 H 1 0.91 0.02 . 1 . . . . . 32 ILE MG . 52545 1
242 . 1 . 1 32 32 ILE HG23 H 1 0.91 0.02 . 1 . . . . . 32 ILE MG . 52545 1
243 . 1 . 1 32 32 ILE HD11 H 1 0.83 0.02 . 1 . . . . . 32 ILE MD . 52545 1
244 . 1 . 1 32 32 ILE HD12 H 1 0.83 0.02 . 1 . . . . . 32 ILE MD . 52545 1
245 . 1 . 1 32 32 ILE HD13 H 1 0.83 0.02 . 1 . . . . . 32 ILE MD . 52545 1
246 . 1 . 1 32 32 ILE C C 13 175.5 0.2 . 1 . . . . . 32 ILE C . 52545 1
247 . 1 . 1 32 32 ILE CA C 13 60.8 0.2 . 1 . . . . . 32 ILE CA . 52545 1
248 . 1 . 1 32 32 ILE CB C 13 38.7 0.2 . 1 . . . . . 32 ILE CB . 52545 1
249 . 1 . 1 32 32 ILE CG1 C 13 27.1 0.2 . 1 . . . . . 32 ILE CG1 . 52545 1
250 . 1 . 1 32 32 ILE CG2 C 13 17.6 0.2 . 1 . . . . . 32 ILE CG2 . 52545 1
251 . 1 . 1 32 32 ILE CD1 C 13 13.4 0.2 . 1 . . . . . 32 ILE CD1 . 52545 1
252 . 1 . 1 32 32 ILE N N 15 118.5 0.2 . 1 . . . . . 32 ILE N . 52545 1
253 . 1 . 1 33 33 GLY H H 1 8.13 0.02 . 1 . . . . . 33 GLY H . 52545 1
254 . 1 . 1 33 33 GLY HA2 H 1 4.08 0.02 . 2 . . . . . 33 GLY HA2 . 52545 1
255 . 1 . 1 33 33 GLY HA3 H 1 4.08 0.02 . 2 . . . . . 33 GLY HA3 . 52545 1
256 . 1 . 1 33 33 GLY CA C 13 44.5 0.2 . 1 . . . . . 33 GLY CA . 52545 1
257 . 1 . 1 33 33 GLY N N 15 110.9 0.2 . 1 . . . . . 33 GLY N . 52545 1
258 . 1 . 1 34 34 PRO C C 13 176.9 0.2 . 1 . . . . . 34 PRO C . 52545 1
259 . 1 . 1 34 34 PRO CA C 13 62.9 0.2 . 1 . . . . . 34 PRO CA . 52545 1
260 . 1 . 1 34 34 PRO CB C 13 32.0 0.2 . 1 . . . . . 34 PRO CB . 52545 1
261 . 1 . 1 34 34 PRO CG C 13 27.0 0.2 . 1 . . . . . 34 PRO CG . 52545 1
262 . 1 . 1 34 34 PRO CD C 13 49.5 0.2 . 1 . . . . . 34 PRO CD . 52545 1
263 . 1 . 1 35 35 ARG H H 1 8.59 0.02 . 1 . . . . . 35 ARG H . 52545 1
264 . 1 . 1 35 35 ARG HA H 1 4.33 0.02 . 1 . . . . . 35 ARG HA . 52545 1
265 . 1 . 1 35 35 ARG HB2 H 1 1.85 0.02 . 2 . . . . . 35 ARG HB2 . 52545 1
266 . 1 . 1 35 35 ARG HB3 H 1 1.73 0.02 . 2 . . . . . 35 ARG HB3 . 52545 1
267 . 1 . 1 35 35 ARG HG2 H 1 1.66 0.02 . 2 . . . . . 35 ARG HG2 . 52545 1
268 . 1 . 1 35 35 ARG HG3 H 1 1.66 0.02 . 2 . . . . . 35 ARG HG3 . 52545 1
269 . 1 . 1 35 35 ARG HD2 H 1 3.19 0.02 . 2 . . . . . 35 ARG HD2 . 52545 1
270 . 1 . 1 35 35 ARG HD3 H 1 3.19 0.02 . 2 . . . . . 35 ARG HD3 . 52545 1
271 . 1 . 1 35 35 ARG HE H 1 7.33 0.02 . 1 . . . . . 35 ARG HE . 52545 1
272 . 1 . 1 35 35 ARG C C 13 176.2 0.2 . 1 . . . . . 35 ARG C . 52545 1
273 . 1 . 1 35 35 ARG CA C 13 55.8 0.2 . 1 . . . . . 35 ARG CA . 52545 1
274 . 1 . 1 35 35 ARG CB C 13 30.8 0.2 . 1 . . . . . 35 ARG CB . 52545 1
275 . 1 . 1 35 35 ARG CG C 13 27.1 0.2 . 1 . . . . . 35 ARG CG . 52545 1
276 . 1 . 1 35 35 ARG CD C 13 43.2 0.2 . 1 . . . . . 35 ARG CD . 52545 1
277 . 1 . 1 35 35 ARG N N 15 121.1 0.2 . 1 . . . . . 35 ARG N . 52545 1
278 . 1 . 1 35 35 ARG NE N 15 102.5 0.2 . 1 . . . . . 35 ARG NE . 52545 1
279 . 1 . 1 36 36 GLU H H 1 8.51 0.02 . 1 . . . . . 36 GLU H . 52545 1
280 . 1 . 1 36 36 GLU HA H 1 4.22 0.02 . 1 . . . . . 36 GLU HA . 52545 1
281 . 1 . 1 36 36 GLU HB2 H 1 2.23 0.02 . 2 . . . . . 36 GLU HB2 . 52545 1
282 . 1 . 1 36 36 GLU HB3 H 1 2.23 0.02 . 2 . . . . . 36 GLU HB3 . 52545 1
283 . 1 . 1 36 36 GLU HG2 H 1 1.92 0.02 . 2 . . . . . 36 GLU HG2 . 52545 1
284 . 1 . 1 36 36 GLU HG3 H 1 1.92 0.02 . 2 . . . . . 36 GLU HG3 . 52545 1
285 . 1 . 1 36 36 GLU C C 13 176.1 0.2 . 1 . . . . . 36 GLU C . 52545 1
286 . 1 . 1 36 36 GLU CA C 13 56.6 0.2 . 1 . . . . . 36 GLU CA . 52545 1
287 . 1 . 1 36 36 GLU CB C 13 31.0 0.2 . 1 . . . . . 36 GLU CB . 52545 1
288 . 1 . 1 36 36 GLU CG C 13 35.9 0.2 . 1 . . . . . 36 GLU CG . 52545 1
289 . 1 . 1 36 36 GLU N N 15 121.5 0.2 . 1 . . . . . 36 GLU N . 52545 1
290 . 1 . 1 37 37 HIS H H 1 8.58 0.02 . 1 . . . . . 37 HIS H . 52545 1
291 . 1 . 1 37 37 HIS HA H 1 4.69 0.02 . 1 . . . . . 37 HIS HA . 52545 1
292 . 1 . 1 37 37 HIS HB2 H 1 3.27 0.02 . 2 . . . . . 37 HIS HB2 . 52545 1
293 . 1 . 1 37 37 HIS HB3 H 1 3.20 0.02 . 2 . . . . . 37 HIS HB3 . 52545 1
294 . 1 . 1 37 37 HIS C C 13 176.4 0.2 . 1 . . . . . 37 HIS C . 52545 1
295 . 1 . 1 37 37 HIS CA C 13 55.4 0.2 . 1 . . . . . 37 HIS CA . 52545 1
296 . 1 . 1 37 37 HIS CB C 13 29.3 0.2 . 1 . . . . . 37 HIS CB . 52545 1
297 . 1 . 1 37 37 HIS N N 15 118.5 0.2 . 1 . . . . . 37 HIS N . 52545 1
298 . 1 . 1 38 38 GLU H H 1 8.57 0.02 . 1 . . . . . 38 GLU H . 52545 1
299 . 1 . 1 38 38 GLU HA H 1 4.36 0.02 . 1 . . . . . 38 GLU HA . 52545 1
300 . 1 . 1 38 38 GLU C C 13 176.4 0.2 . 1 . . . . . 38 GLU C . 52545 1
301 . 1 . 1 38 38 GLU CA C 13 56.5 0.2 . 1 . . . . . 38 GLU CA . 52545 1
302 . 1 . 1 38 38 GLU CB C 13 30.1 0.2 . 1 . . . . . 38 GLU CB . 52545 1
303 . 1 . 1 38 38 GLU CG C 13 36.0 0.2 . 1 . . . . . 38 GLU CG . 52545 1
304 . 1 . 1 38 38 GLU N N 15 122.2 0.2 . 1 . . . . . 38 GLU N . 52545 1
305 . 1 . 1 39 39 THR H H 1 8.37 0.02 . 1 . . . . . 39 THR H . 52545 1
306 . 1 . 1 39 39 THR HA H 1 4.36 0.02 . 1 . . . . . 39 THR HA . 52545 1
307 . 1 . 1 39 39 THR HB H 1 4.21 0.02 . 1 . . . . . 39 THR HB . 52545 1
308 . 1 . 1 39 39 THR HG21 H 1 1.23 0.02 . 1 . . . . . 39 THR MG . 52545 1
309 . 1 . 1 39 39 THR HG22 H 1 1.23 0.02 . 1 . . . . . 39 THR MG . 52545 1
310 . 1 . 1 39 39 THR HG23 H 1 1.23 0.02 . 1 . . . . . 39 THR MG . 52545 1
311 . 1 . 1 39 39 THR C C 13 174.2 0.2 . 1 . . . . . 39 THR C . 52545 1
312 . 1 . 1 39 39 THR CA C 13 61.9 0.2 . 1 . . . . . 39 THR CA . 52545 1
313 . 1 . 1 39 39 THR CB C 13 69.8 0.2 . 1 . . . . . 39 THR CB . 52545 1
314 . 1 . 1 39 39 THR CG2 C 13 21.5 0.2 . 1 . . . . . 39 THR CG2 . 52545 1
315 . 1 . 1 39 39 THR N N 15 115.7 0.2 . 1 . . . . . 39 THR N . 52545 1
316 . 1 . 1 40 40 GLN H H 1 8.53 0.02 . 1 . . . . . 40 GLN H . 52545 1
317 . 1 . 1 40 40 GLN HA H 1 4.36 0.02 . 1 . . . . . 40 GLN HA . 52545 1
318 . 1 . 1 40 40 GLN C C 13 174.8 0.2 . 1 . . . . . 40 GLN C . 52545 1
319 . 1 . 1 40 40 GLN CA C 13 55.9 0.2 . 1 . . . . . 40 GLN CA . 52545 1
320 . 1 . 1 40 40 GLN CB C 13 29.5 0.2 . 1 . . . . . 40 GLN CB . 52545 1
321 . 1 . 1 40 40 GLN CG C 13 33.6 0.2 . 1 . . . . . 40 GLN CG . 52545 1
322 . 1 . 1 40 40 GLN N N 15 123.4 0.2 . 1 . . . . . 40 GLN N . 52545 1
323 . 1 . 1 41 41 GLN H H 1 8.18 0.02 . 1 . . . . . 41 GLN H . 52545 1
324 . 1 . 1 41 41 GLN HA H 1 4.18 0.02 . 1 . . . . . 41 GLN HA . 52545 1
325 . 1 . 1 41 41 GLN CA C 13 57.3 0.2 . 1 . . . . . 41 GLN CA . 52545 1
326 . 1 . 1 41 41 GLN CB C 13 30.3 0.2 . 1 . . . . . 41 GLN CB . 52545 1
327 . 1 . 1 41 41 GLN N N 15 109.2 0.2 . 1 . . . . . 41 GLN N . 52545 1
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