Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27553
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_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 '3D CBCA(CO)NH' . . . 27553 1
2 '3D HNCO' . . . 27553 1
3 '3D HBHA(CO)NH' . . . 27553 1
5 '3D HNCACB' . . . 27553 1
7 '2D 1H-15N HSQC' . . . 27553 1
9 '3D 1H-15N TOCSY' . . . 27553 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
3 $SPARKY . . 27553 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.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 GLY HA2 H 1 3.88 0.01 . 2 . . . . . 23 GLY HA2 . 27553 1
2 . 1 1 1 1 GLY HA3 H 1 3.88 0.01 . 2 . . . . . 23 GLY HA3 . 27553 1
3 . 1 1 1 1 GLY C C 13 170.0 0.2 . 1 . . . . . 23 GLY C . 27553 1
4 . 1 1 1 1 GLY CA C 13 43.3 0.2 . 1 . . . . . 23 GLY CA . 27553 1
5 . 1 1 2 2 CYS H H 1 8.70 0.01 . 1 . . . . . 24 CYS H . 27553 1
6 . 1 1 2 2 CYS HA H 1 4.58 0.01 . 1 . . . . . 24 CYS HA . 27553 1
7 . 1 1 2 2 CYS HB2 H 1 2.93 0.02 . 2 . . . . . 24 CYS HB2 . 27553 1
8 . 1 1 2 2 CYS HB3 H 1 2.93 0.02 . 2 . . . . . 24 CYS HB3 . 27553 1
9 . 1 1 2 2 CYS C C 13 174.5 0.2 . 1 . . . . . 24 CYS C . 27553 1
10 . 1 1 2 2 CYS CA C 13 58.3 0.2 . 1 . . . . . 24 CYS CA . 27553 1
11 . 1 1 2 2 CYS CB C 13 28.2 0.2 . 1 . . . . . 24 CYS CB . 27553 1
12 . 1 1 2 2 CYS N N 15 118.9 0.1 . 1 . . . . . 24 CYS N . 27553 1
13 . 1 1 3 3 MET H H 1 8.65 0.01 . 1 . . . . . 25 MET H . 27553 1
14 . 1 1 3 3 MET HA H 1 4.49 0.01 . 1 . . . . . 25 MET HA . 27553 1
15 . 1 1 3 3 MET HB2 H 1 2.07 0.01 . 2 . . . . . 25 MET HB2 . 27553 1
16 . 1 1 3 3 MET HB3 H 1 2.02 0.01 . 2 . . . . . 25 MET HB3 . 27553 1
17 . 1 1 3 3 MET C C 13 176.1 0.2 . 1 . . . . . 25 MET C . 27553 1
18 . 1 1 3 3 MET CA C 13 55.6 0.2 . 1 . . . . . 25 MET CA . 27553 1
19 . 1 1 3 3 MET CB C 13 32.6 0.2 . 1 . . . . . 25 MET CB . 27553 1
20 . 1 1 3 3 MET N N 15 123.9 0.1 . 1 . . . . . 25 MET N . 27553 1
21 . 1 1 4 4 LYS H H 1 8.41 0.01 . 1 . . . . . 26 LYS H . 27553 1
22 . 1 1 4 4 LYS HA H 1 4.31 0.01 . 1 . . . . . 26 LYS HA . 27553 1
23 . 1 1 4 4 LYS HB2 H 1 1.82 0.01 . 2 . . . . . 26 LYS HB2 . 27553 1
24 . 1 1 4 4 LYS HB3 H 1 1.74 0.01 . 2 . . . . . 26 LYS HB3 . 27553 1
25 . 1 1 4 4 LYS C C 13 176.5 0.2 . 1 . . . . . 26 LYS C . 27553 1
26 . 1 1 4 4 LYS CA C 13 56.5 0.2 . 1 . . . . . 26 LYS CA . 27553 1
27 . 1 1 4 4 LYS CB C 13 33.0 0.2 . 1 . . . . . 26 LYS CB . 27553 1
28 . 1 1 4 4 LYS N N 15 123.4 0.1 . 1 . . . . . 26 LYS N . 27553 1
29 . 1 1 5 5 SER H H 1 8.28 0.01 . 1 . . . . . 27 SER H . 27553 1
30 . 1 1 5 5 SER HA H 1 4.37 0.01 . 1 . . . . . 27 SER HA . 27553 1
31 . 1 1 5 5 SER HB2 H 1 3.85 0.01 . 2 . . . . . 27 SER HB2 . 27553 1
32 . 1 1 5 5 SER HB3 H 1 3.77 0.01 . 2 . . . . . 27 SER HB3 . 27553 1
33 . 1 1 5 5 SER C C 13 174.6 0.2 . 1 . . . . . 27 SER C . 27553 1
34 . 1 1 5 5 SER CA C 13 58.5 0.2 . 1 . . . . . 27 SER CA . 27553 1
35 . 1 1 5 5 SER CB C 13 63.9 0.2 . 1 . . . . . 27 SER CB . 27553 1
36 . 1 1 5 5 SER N N 15 117.0 0.1 . 1 . . . . . 27 SER N . 27553 1
37 . 1 1 6 6 LYS H H 1 8.33 0.01 . 1 . . . . . 28 LYS H . 27553 1
38 . 1 1 6 6 LYS HA H 1 4.21 0.01 . 1 . . . . . 28 LYS HA . 27553 1
39 . 1 1 6 6 LYS HB2 H 1 1.65 0.01 . 2 . . . . . 28 LYS HB2 . 27553 1
40 . 1 1 6 6 LYS HB3 H 1 1.62 0.01 . 2 . . . . . 28 LYS HB3 . 27553 1
41 . 1 1 6 6 LYS C C 13 176.2 0.3 . 1 . . . . . 28 LYS C . 27553 1
42 . 1 1 6 6 LYS CA C 13 56.7 0.2 . 1 . . . . . 28 LYS CA . 27553 1
43 . 1 1 6 6 LYS CB C 13 32.4 0.3 . 1 . . . . . 28 LYS CB . 27553 1
44 . 1 1 6 6 LYS N N 15 123.3 0.1 . 1 . . . . . 28 LYS N . 27553 1
45 . 1 1 7 7 PHE H H 1 8.10 0.01 . 1 . . . . . 29 PHE H . 27553 1
46 . 1 1 7 7 PHE HA H 1 4.61 0.01 . 1 . . . . . 29 PHE HA . 27553 1
47 . 1 1 7 7 PHE HB2 H 1 3.13 0.01 . 2 . . . . . 29 PHE HB2 . 27553 1
48 . 1 1 7 7 PHE HB3 H 1 2.95 0.01 . 2 . . . . . 29 PHE HB3 . 27553 1
49 . 1 1 7 7 PHE C C 13 175.4 0.2 . 1 . . . . . 29 PHE C . 27553 1
50 . 1 1 7 7 PHE CA C 13 57.5 0.2 . 1 . . . . . 29 PHE CA . 27553 1
51 . 1 1 7 7 PHE CB C 13 39.4 0.2 . 1 . . . . . 29 PHE CB . 27553 1
52 . 1 1 7 7 PHE N N 15 120.3 0.1 . 1 . . . . . 29 PHE N . 27553 1
53 . 1 1 8 8 LEU H H 1 8.04 0.01 . 1 . . . . . 30 LEU H . 27553 1
54 . 1 1 8 8 LEU HA H 1 4.30 0.01 . 1 . . . . . 30 LEU HA . 27553 1
55 . 1 1 8 8 LEU HB2 H 1 1.54 0.02 . 2 . . . . . 30 LEU HB2 . 27553 1
56 . 1 1 8 8 LEU HB3 H 1 1.54 0.02 . 2 . . . . . 30 LEU HB3 . 27553 1
57 . 1 1 8 8 LEU C C 13 176.6 0.2 . 1 . . . . . 30 LEU C . 27553 1
58 . 1 1 8 8 LEU CA C 13 55.0 0.2 . 1 . . . . . 30 LEU CA . 27553 1
59 . 1 1 8 8 LEU CB C 13 42.6 0.2 . 1 . . . . . 30 LEU CB . 27553 1
60 . 1 1 8 8 LEU N N 15 123.8 0.1 . 1 . . . . . 30 LEU N . 27553 1
61 . 1 1 9 9 GLN H H 1 8.28 0.01 . 1 . . . . . 31 GLN H . 27553 1
62 . 1 1 9 9 GLN HA H 1 4.34 0.01 . 1 . . . . . 31 GLN HA . 27553 1
63 . 1 1 9 9 GLN HB2 H 1 2.06 0.01 . 2 . . . . . 31 GLN HB2 . 27553 1
64 . 1 1 9 9 GLN HB3 H 1 1.96 0.01 . 2 . . . . . 31 GLN HB3 . 27553 1
65 . 1 1 9 9 GLN C C 13 175.8 0.2 . 1 . . . . . 31 GLN C . 27553 1
66 . 1 1 9 9 GLN CA C 13 55.6 0.2 . 1 . . . . . 31 GLN CA . 27553 1
67 . 1 1 9 9 GLN CB C 13 29.3 0.2 . 1 . . . . . 31 GLN CB . 27553 1
68 . 1 1 9 9 GLN N N 15 122.0 0.1 . 1 . . . . . 31 GLN N . 27553 1
69 . 1 1 10 10 VAL H H 1 8.22 0.01 . 1 . . . . . 32 VAL H . 27553 1
70 . 1 1 10 10 VAL HA H 1 4.13 0.01 . 1 . . . . . 32 VAL HA . 27553 1
71 . 1 1 10 10 VAL HB H 1 2.07 0.01 . 1 . . . . . 32 VAL HB . 27553 1
72 . 1 1 10 10 VAL C C 13 176.7 0.2 . 1 . . . . . 32 VAL C . 27553 1
73 . 1 1 10 10 VAL CA C 13 62.4 0.2 . 1 . . . . . 32 VAL CA . 27553 1
74 . 1 1 10 10 VAL CB C 13 32.7 0.2 . 1 . . . . . 32 VAL CB . 27553 1
75 . 1 1 10 10 VAL N N 15 122.0 0.1 . 1 . . . . . 32 VAL N . 27553 1
76 . 1 1 11 11 GLY H H 1 8.52 0.01 . 1 . . . . . 33 GLY H . 27553 1
77 . 1 1 11 11 GLY HA2 H 1 4.00 0.01 . 1 . . . . . 33 GLY HA2 . 27553 1
78 . 1 1 11 11 GLY HA3 H 1 3.95 0.01 . 1 . . . . . 33 GLY HA3 . 27553 1
79 . 1 1 11 11 GLY C C 13 174.6 0.2 . 1 . . . . . 33 GLY C . 27553 1
80 . 1 1 11 11 GLY CA C 13 45.2 0.2 . 1 . . . . . 33 GLY CA . 27553 1
81 . 1 1 11 11 GLY N N 15 112.8 0.1 . 1 . . . . . 33 GLY N . 27553 1
82 . 1 1 12 12 GLY H H 1 8.30 0.01 . 1 . . . . . 34 GLY H . 27553 1
83 . 1 1 12 12 GLY HA2 H 1 3.94 0.02 . 2 . . . . . 34 GLY HA2 . 27553 1
84 . 1 1 12 12 GLY HA3 H 1 3.94 0.02 . 2 . . . . . 34 GLY HA3 . 27553 1
85 . 1 1 12 12 GLY C C 13 174.0 0.2 . 1 . . . . . 34 GLY C . 27553 1
86 . 1 1 12 12 GLY CA C 13 45.2 0.2 . 1 . . . . . 34 GLY CA . 27553 1
87 . 1 1 12 12 GLY N N 15 108.6 0.1 . 1 . . . . . 34 GLY N . 27553 1
88 . 1 1 13 13 ASN H H 1 8.38 0.01 . 1 . . . . . 35 ASN H . 27553 1
89 . 1 1 13 13 ASN HA H 1 4.75 0.01 . 1 . . . . . 35 ASN HA . 27553 1
90 . 1 1 13 13 ASN HB2 H 1 2.73 0.02 . 2 . . . . . 35 ASN HB2 . 27553 1
91 . 1 1 13 13 ASN HB3 H 1 2.73 0.02 . 2 . . . . . 35 ASN HB3 . 27553 1
92 . 1 1 13 13 ASN C C 13 175.5 0.2 . 1 . . . . . 35 ASN C . 27553 1
93 . 1 1 13 13 ASN CA C 13 53.1 0.2 . 1 . . . . . 35 ASN CA . 27553 1
94 . 1 1 13 13 ASN CB C 13 38.9 0.2 . 1 . . . . . 35 ASN CB . 27553 1
95 . 1 1 13 13 ASN N N 15 118.6 0.1 . 1 . . . . . 35 ASN N . 27553 1
96 . 1 1 14 14 THR H H 1 8.08 0.01 . 1 . . . . . 36 THR H . 27553 1
97 . 1 1 14 14 THR HA H 1 4.25 0.01 . 1 . . . . . 36 THR HA . 27553 1
98 . 1 1 14 14 THR HB H 1 4.13 0.01 . 1 . . . . . 36 THR HB . 27553 1
99 . 1 1 14 14 THR C C 13 174.3 0.2 . 1 . . . . . 36 THR C . 27553 1
100 . 1 1 14 14 THR CA C 13 62.2 0.2 . 1 . . . . . 36 THR CA . 27553 1
101 . 1 1 14 14 THR CB C 13 69.6 0.2 . 1 . . . . . 36 THR CB . 27553 1
102 . 1 1 14 14 THR N N 15 114.2 0.1 . 1 . . . . . 36 THR N . 27553 1
103 . 1 1 15 15 PHE H H 1 8.22 0.01 . 1 . . . . . 37 PHE H . 27553 1
104 . 1 1 15 15 PHE HA H 1 4.65 0.01 . 1 . . . . . 37 PHE HA . 27553 1
105 . 1 1 15 15 PHE HB2 H 1 3.15 0.01 . 2 . . . . . 37 PHE HB2 . 27553 1
106 . 1 1 15 15 PHE HB3 H 1 3.01 0.01 . 2 . . . . . 37 PHE HB3 . 27553 1
107 . 1 1 15 15 PHE C C 13 175.7 0.2 . 1 . . . . . 37 PHE C . 27553 1
108 . 1 1 15 15 PHE CA C 13 57.8 0.2 . 1 . . . . . 37 PHE CA . 27553 1
109 . 1 1 15 15 PHE CB C 13 39.4 0.2 . 1 . . . . . 37 PHE CB . 27553 1
110 . 1 1 15 15 PHE N N 15 122.0 0.1 . 1 . . . . . 37 PHE N . 27553 1
111 . 1 1 16 16 SER H H 1 8.19 0.01 . 1 . . . . . 38 SER H . 27553 1
112 . 1 1 16 16 SER HA H 1 4.41 0.01 . 1 . . . . . 38 SER HA . 27553 1
113 . 1 1 16 16 SER HB2 H 1 3.80 0.03 . 2 . . . . . 38 SER HB2 . 27553 1
114 . 1 1 16 16 SER HB3 H 1 3.80 0.03 . 2 . . . . . 38 SER HB3 . 27553 1
115 . 1 1 16 16 SER C C 13 174.3 0.2 . 1 . . . . . 38 SER C . 27553 1
116 . 1 1 16 16 SER CA C 13 58.3 0.2 . 1 . . . . . 38 SER CA . 27553 1
117 . 1 1 16 16 SER CB C 13 64.0 0.2 . 1 . . . . . 38 SER CB . 27553 1
118 . 1 1 16 16 SER N N 15 117.3 0.1 . 1 . . . . . 38 SER N . 27553 1
119 . 1 1 17 17 LYS H H 1 8.36 0.01 . 1 . . . . . 39 LYS H . 27553 1
120 . 1 1 17 17 LYS HA H 1 4.36 0.01 . 1 . . . . . 39 LYS HA . 27553 1
121 . 1 1 17 17 LYS HB2 H 1 1.87 0.01 . 2 . . . . . 39 LYS HB2 . 27553 1
122 . 1 1 17 17 LYS HB3 H 1 1.77 0.01 . 2 . . . . . 39 LYS HB3 . 27553 1
123 . 1 1 17 17 LYS C C 13 176.7 0.2 . 1 . . . . . 39 LYS C . 27553 1
124 . 1 1 17 17 LYS CA C 13 56.6 0.2 . 1 . . . . . 39 LYS CA . 27553 1
125 . 1 1 17 17 LYS CB C 13 32.9 0.2 . 1 . . . . . 39 LYS CB . 27553 1
126 . 1 1 17 17 LYS N N 15 123.5 0.1 . 1 . . . . . 39 LYS N . 27553 1
127 . 1 1 18 18 THR H H 1 8.17 0.01 . 1 . . . . . 40 THR H . 27553 1
128 . 1 1 18 18 THR HA H 1 4.32 0.01 . 1 . . . . . 40 THR HA . 27553 1
129 . 1 1 18 18 THR HB H 1 4.19 0.01 . 1 . . . . . 40 THR HB . 27553 1
130 . 1 1 18 18 THR C C 13 174.6 0.2 . 1 . . . . . 40 THR C . 27553 1
131 . 1 1 18 18 THR CA C 13 62.1 0.2 . 1 . . . . . 40 THR CA . 27553 1
132 . 1 1 18 18 THR CB C 13 69.7 0.2 . 1 . . . . . 40 THR CB . 27553 1
133 . 1 1 18 18 THR N N 15 115.2 0.1 . 1 . . . . . 40 THR N . 27553 1
134 . 1 1 19 19 GLU H H 1 8.42 0.01 . 1 . . . . . 41 GLU H . 27553 1
135 . 1 1 19 19 GLU HA H 1 4.41 0.01 . 1 . . . . . 41 GLU HA . 27553 1
136 . 1 1 19 19 GLU HB2 H 1 2.09 0.01 . 2 . . . . . 41 GLU HB2 . 27553 1
137 . 1 1 19 19 GLU HB3 H 1 1.96 0.01 . 2 . . . . . 41 GLU HB3 . 27553 1
138 . 1 1 19 19 GLU C C 13 176.5 0.2 . 1 . . . . . 41 GLU C . 27553 1
139 . 1 1 19 19 GLU CA C 13 56.4 0.2 . 1 . . . . . 41 GLU CA . 27553 1
140 . 1 1 19 19 GLU CB C 13 29.8 0.2 . 1 . . . . . 41 GLU CB . 27553 1
141 . 1 1 19 19 GLU N N 15 123.5 0.1 . 1 . . . . . 41 GLU N . 27553 1
142 . 1 1 20 20 THR H H 1 8.26 0.01 . 1 . . . . . 42 THR H . 27553 1
143 . 1 1 20 20 THR HA H 1 4.37 0.01 . 1 . . . . . 42 THR HA . 27553 1
144 . 1 1 20 20 THR HB H 1 4.24 0.01 . 1 . . . . . 42 THR HB . 27553 1
145 . 1 1 20 20 THR C C 13 174.7 0.2 . 1 . . . . . 42 THR C . 27553 1
146 . 1 1 20 20 THR CA C 13 62.0 0.2 . 1 . . . . . 42 THR CA . 27553 1
147 . 1 1 20 20 THR CB C 13 69.8 0.2 . 1 . . . . . 42 THR CB . 27553 1
148 . 1 1 20 20 THR N N 15 115.4 0.1 . 1 . . . . . 42 THR N . 27553 1
149 . 1 1 21 21 SER H H 1 8.32 0.01 . 1 . . . . . 43 SER H . 27553 1
150 . 1 1 21 21 SER HA H 1 4.44 0.01 . 1 . . . . . 43 SER HA . 27553 1
151 . 1 1 21 21 SER HB2 H 1 3.86 0.02 . 2 . . . . . 43 SER HB2 . 27553 1
152 . 1 1 21 21 SER HB3 H 1 3.86 0.02 . 2 . . . . . 43 SER HB3 . 27553 1
153 . 1 1 21 21 SER C C 13 174.1 0.2 . 1 . . . . . 43 SER C . 27553 1
154 . 1 1 21 21 SER CA C 13 58.6 0.2 . 1 . . . . . 43 SER CA . 27553 1
155 . 1 1 21 21 SER CB C 13 63.9 0.2 . 1 . . . . . 43 SER CB . 27553 1
156 . 1 1 21 21 SER N N 15 118.1 0.1 . 1 . . . . . 43 SER N . 27553 1
157 . 1 1 22 22 ALA H H 1 8.31 0.01 . 1 . . . . . 44 ALA H . 27553 1
158 . 1 1 22 22 ALA HA H 1 4.37 0.01 . 1 . . . . . 44 ALA HA . 27553 1
159 . 1 1 22 22 ALA HB1 H 1 1.37 0.01 . 1 . . . . . 44 ALA MB . 27553 1
160 . 1 1 22 22 ALA HB2 H 1 1.37 0.01 . 1 . . . . . 44 ALA MB . 27553 1
161 . 1 1 22 22 ALA HB3 H 1 1.37 0.01 . 1 . . . . . 44 ALA MB . 27553 1
162 . 1 1 22 22 ALA C C 13 177.5 0.2 . 1 . . . . . 44 ALA C . 27553 1
163 . 1 1 22 22 ALA CA C 13 52.4 0.2 . 1 . . . . . 44 ALA CA . 27553 1
164 . 1 1 22 22 ALA CB C 13 19.3 0.2 . 1 . . . . . 44 ALA CB . 27553 1
165 . 1 1 22 22 ALA N N 15 125.9 0.1 . 1 . . . . . 44 ALA N . 27553 1
166 . 1 1 23 23 SER H H 1 8.22 0.01 . 1 . . . . . 45 SER H . 27553 1
167 . 1 1 23 23 SER HA H 1 4.70 0.02 . 1 . . . . . 45 SER HA . 27553 1
168 . 1 1 23 23 SER HB2 H 1 3.81 0.04 . 2 . . . . . 45 SER HB2 . 27553 1
169 . 1 1 23 23 SER HB3 H 1 3.81 0.04 . 2 . . . . . 45 SER HB3 . 27553 1
170 . 1 1 23 23 SER C C 13 172.7 0.3 . 1 . . . . . 45 SER C . 27553 1
171 . 1 1 23 23 SER CA C 13 56.5 0.3 . 1 . . . . . 45 SER CA . 27553 1
172 . 1 1 23 23 SER CB C 13 63.4 0.3 . 1 . . . . . 45 SER CB . 27553 1
173 . 1 1 23 23 SER N N 15 116.6 0.1 . 1 . . . . . 45 SER N . 27553 1
174 . 1 1 24 24 PRO HA H 1 4.38 0.01 . 1 . . . . . 46 PRO HA . 27553 1
175 . 1 1 24 24 PRO HB2 H 1 2.24 0.01 . 2 . . . . . 46 PRO HB2 . 27553 1
176 . 1 1 24 24 PRO HB3 H 1 1.82 0.01 . 2 . . . . . 46 PRO HB3 . 27553 1
177 . 1 1 24 24 PRO C C 13 176.8 0.2 . 1 . . . . . 46 PRO C . 27553 1
178 . 1 1 24 24 PRO CA C 13 63.3 0.2 . 1 . . . . . 46 PRO CA . 27553 1
179 . 1 1 24 24 PRO CB C 13 32.0 0.2 . 1 . . . . . 46 PRO CB . 27553 1
180 . 1 1 25 25 HIS H H 1 8.57 0.01 . 1 . . . . . 47 HIS H . 27553 1
181 . 1 1 25 25 HIS HA H 1 4.67 0.01 . 1 . . . . . 47 HIS HA . 27553 1
182 . 1 1 25 25 HIS HB2 H 1 3.23 0.01 . 2 . . . . . 47 HIS HB2 . 27553 1
183 . 1 1 25 25 HIS HB3 H 1 3.17 0.01 . 2 . . . . . 47 HIS HB3 . 27553 1
184 . 1 1 25 25 HIS C C 13 174.1 0.2 . 1 . . . . . 47 HIS C . 27553 1
185 . 1 1 25 25 HIS CA C 13 55.1 0.2 . 1 . . . . . 47 HIS CA . 27553 1
186 . 1 1 25 25 HIS CB C 13 28.8 0.2 . 1 . . . . . 47 HIS CB . 27553 1
187 . 1 1 25 25 HIS N N 15 118.5 0.1 . 1 . . . . . 47 HIS N . 27553 1
188 . 1 1 26 26 CYS H H 1 8.36 0.01 . 1 . . . . . 48 CYS H . 27553 1
189 . 1 1 26 26 CYS HA H 1 4.76 0.02 . 1 . . . . . 48 CYS HA . 27553 1
190 . 1 1 26 26 CYS HB2 H 1 2.91 0.02 . 2 . . . . . 48 CYS HB2 . 27553 1
191 . 1 1 26 26 CYS HB3 H 1 2.86 0.02 . 2 . . . . . 48 CYS HB3 . 27553 1
192 . 1 1 26 26 CYS C C 13 172.5 0.3 . 1 . . . . . 48 CYS C . 27553 1
193 . 1 1 26 26 CYS CA C 13 56.6 0.3 . 1 . . . . . 48 CYS CA . 27553 1
194 . 1 1 26 26 CYS CB C 13 27.4 0.3 . 1 . . . . . 48 CYS CB . 27553 1
195 . 1 1 26 26 CYS N N 15 122.4 0.1 . 1 . . . . . 48 CYS N . 27553 1
196 . 1 1 27 27 PRO HA H 1 4.42 0.01 . 1 . . . . . 49 PRO HA . 27553 1
197 . 1 1 27 27 PRO HB2 H 1 2.23 0.01 . 2 . . . . . 49 PRO HB2 . 27553 1
198 . 1 1 27 27 PRO HB3 H 1 1.80 0.01 . 2 . . . . . 49 PRO HB3 . 27553 1
199 . 1 1 27 27 PRO C C 13 176.3 0.3 . 1 . . . . . 49 PRO C . 27553 1
200 . 1 1 27 27 PRO CA C 13 63.3 0.2 . 1 . . . . . 49 PRO CA . 27553 1
201 . 1 1 27 27 PRO CB C 13 32.4 0.4 . 1 . . . . . 49 PRO CB . 27553 1
202 . 1 1 28 28 VAL H H 1 8.10 0.01 . 1 . . . . . 50 VAL H . 27553 1
203 . 1 1 28 28 VAL HA H 1 4.04 0.01 . 1 . . . . . 50 VAL HA . 27553 1
204 . 1 1 28 28 VAL HB H 1 1.98 0.01 . 1 . . . . . 50 VAL HB . 27553 1
205 . 1 1 28 28 VAL C C 13 175.6 0.2 . 1 . . . . . 50 VAL C . 27553 1
206 . 1 1 28 28 VAL CA C 13 62.2 0.2 . 1 . . . . . 50 VAL CA . 27553 1
207 . 1 1 28 28 VAL CB C 13 32.8 0.2 . 1 . . . . . 50 VAL CB . 27553 1
208 . 1 1 28 28 VAL N N 15 120.3 0.1 . 1 . . . . . 50 VAL N . 27553 1
209 . 1 1 29 29 TYR H H 1 8.33 0.01 . 1 . . . . . 51 TYR H . 27553 1
210 . 1 1 29 29 TYR HA H 1 4.59 0.01 . 1 . . . . . 51 TYR HA . 27553 1
211 . 1 1 29 29 TYR HB2 H 1 2.96 0.01 . 2 . . . . . 51 TYR HB2 . 27553 1
212 . 1 1 29 29 TYR HB3 H 1 2.87 0.01 . 2 . . . . . 51 TYR HB3 . 27553 1
213 . 1 1 29 29 TYR C C 13 174.8 0.2 . 1 . . . . . 51 TYR C . 27553 1
214 . 1 1 29 29 TYR CA C 13 57.7 0.2 . 1 . . . . . 51 TYR CA . 27553 1
215 . 1 1 29 29 TYR CB C 13 38.9 0.2 . 1 . . . . . 51 TYR CB . 27553 1
216 . 1 1 29 29 TYR N N 15 125.4 0.1 . 1 . . . . . 51 TYR N . 27553 1
217 . 1 1 30 30 VAL H H 1 8.00 0.01 . 1 . . . . . 52 VAL H . 27553 1
218 . 1 1 30 30 VAL HA H 1 4.27 0.02 . 1 . . . . . 52 VAL HA . 27553 1
219 . 1 1 30 30 VAL HB H 1 1.92 0.02 . 1 . . . . . 52 VAL HB . 27553 1
220 . 1 1 30 30 VAL C C 13 173.5 0.3 . 1 . . . . . 52 VAL C . 27553 1
221 . 1 1 30 30 VAL CA C 13 59.2 0.3 . 1 . . . . . 52 VAL CA . 27553 1
222 . 1 1 30 30 VAL CB C 13 33.2 0.3 . 1 . . . . . 52 VAL CB . 27553 1
223 . 1 1 30 30 VAL N N 15 126.8 0.1 . 1 . . . . . 52 VAL N . 27553 1
224 . 1 1 31 31 PRO HA H 1 4.22 0.01 . 1 . . . . . 53 PRO HA . 27553 1
225 . 1 1 31 31 PRO HB2 H 1 2.26 0.01 . 2 . . . . . 53 PRO HB2 . 27553 1
226 . 1 1 31 31 PRO HB3 H 1 1.84 0.01 . 2 . . . . . 53 PRO HB3 . 27553 1
227 . 1 1 31 31 PRO C C 13 176.2 0.2 . 1 . . . . . 53 PRO C . 27553 1
228 . 1 1 31 31 PRO CA C 13 62.7 0.2 . 1 . . . . . 53 PRO CA . 27553 1
229 . 1 1 31 31 PRO CB C 13 32.0 0.2 . 1 . . . . . 53 PRO CB . 27553 1
230 . 1 1 32 32 ASP H H 1 8.34 0.01 . 1 . . . . . 54 ASP H . 27553 1
231 . 1 1 32 32 ASP HA H 1 4.84 0.02 . 1 . . . . . 54 ASP HA . 27553 1
232 . 1 1 32 32 ASP HB2 H 1 2.78 0.02 . 2 . . . . . 54 ASP HB2 . 27553 1
233 . 1 1 32 32 ASP HB3 H 1 2.59 0.02 . 2 . . . . . 54 ASP HB3 . 27553 1
234 . 1 1 32 32 ASP C C 13 175.2 0.3 . 1 . . . . . 54 ASP C . 27553 1
235 . 1 1 32 32 ASP CA C 13 51.9 0.3 . 1 . . . . . 54 ASP CA . 27553 1
236 . 1 1 32 32 ASP CB C 13 40.8 0.3 . 1 . . . . . 54 ASP CB . 27553 1
237 . 1 1 32 32 ASP N N 15 121.3 0.1 . 1 . . . . . 54 ASP N . 27553 1
238 . 1 1 33 33 PRO HA H 1 4.46 0.01 . 1 . . . . . 55 PRO HA . 27553 1
239 . 1 1 33 33 PRO HB2 H 1 2.30 0.01 . 2 . . . . . 55 PRO HB2 . 27553 1
240 . 1 1 33 33 PRO HB3 H 1 2.00 0.01 . 2 . . . . . 55 PRO HB3 . 27553 1
241 . 1 1 33 33 PRO C C 13 177.6 0.2 . 1 . . . . . 55 PRO C . 27553 1
242 . 1 1 33 33 PRO CA C 13 63.9 0.2 . 1 . . . . . 55 PRO CA . 27553 1
243 . 1 1 33 33 PRO CB C 13 32.0 0.2 . 1 . . . . . 55 PRO CB . 27553 1
244 . 1 1 34 34 THR H H 1 8.32 0.01 . 1 . . . . . 56 THR H . 27553 1
245 . 1 1 34 34 THR HA H 1 4.29 0.02 . 4 . . . . . 56 THR HA . 27553 1
246 . 1 1 34 34 THR HB H 1 4.29 0.02 . 4 . . . . . 56 THR HB . 27553 1
247 . 1 1 34 34 THR C C 13 175.0 0.2 . 1 . . . . . 56 THR C . 27553 1
248 . 1 1 34 34 THR CA C 13 62.5 0.2 . 1 . . . . . 56 THR CA . 27553 1
249 . 1 1 34 34 THR CB C 13 69.6 0.2 . 1 . . . . . 56 THR CB . 27553 1
250 . 1 1 34 34 THR N N 15 112.5 0.1 . 1 . . . . . 56 THR N . 27553 1
251 . 1 1 35 35 SER H H 1 8.05 0.01 . 1 . . . . . 57 SER H . 27553 1
252 . 1 1 35 35 SER HA H 1 4.49 0.01 . 1 . . . . . 57 SER HA . 27553 1
253 . 1 1 35 35 SER HB2 H 1 3.92 0.01 . 2 . . . . . 57 SER HB2 . 27553 1
254 . 1 1 35 35 SER HB3 H 1 3.88 0.01 . 2 . . . . . 57 SER HB3 . 27553 1
255 . 1 1 35 35 SER C C 13 174.8 0.2 . 1 . . . . . 57 SER C . 27553 1
256 . 1 1 35 35 SER CA C 13 58.7 0.2 . 1 . . . . . 57 SER CA . 27553 1
257 . 1 1 35 35 SER CB C 13 63.9 0.2 . 1 . . . . . 57 SER CB . 27553 1
258 . 1 1 35 35 SER N N 15 117.4 0.1 . 1 . . . . . 57 SER N . 27553 1
259 . 1 1 36 36 THR H H 1 8.10 0.01 . 1 . . . . . 58 THR H . 27553 1
260 . 1 1 36 36 THR HA H 1 4.33 0.01 . 1 . . . . . 58 THR HA . 27553 1
261 . 1 1 36 36 THR HB H 1 4.22 0.01 . 1 . . . . . 58 THR HB . 27553 1
262 . 1 1 36 36 THR C C 13 174.4 0.2 . 1 . . . . . 58 THR C . 27553 1
263 . 1 1 36 36 THR CA C 13 62.1 0.2 . 1 . . . . . 58 THR CA . 27553 1
264 . 1 1 36 36 THR CB C 13 69.6 0.2 . 1 . . . . . 58 THR CB . 27553 1
265 . 1 1 36 36 THR N N 15 116.0 0.1 . 1 . . . . . 58 THR N . 27553 1
266 . 1 1 37 37 ILE H H 1 8.06 0.01 . 1 . . . . . 59 ILE H . 27553 1
267 . 1 1 37 37 ILE HA H 1 4.13 0.01 . 1 . . . . . 59 ILE HA . 27553 1
268 . 1 1 37 37 ILE HB H 1 1.81 0.01 . 1 . . . . . 59 ILE HB . 27553 1
269 . 1 1 37 37 ILE C C 13 175.9 0.2 . 1 . . . . . 59 ILE C . 27553 1
270 . 1 1 37 37 ILE CA C 13 61.0 0.2 . 1 . . . . . 59 ILE CA . 27553 1
271 . 1 1 37 37 ILE CB C 13 38.3 0.2 . 1 . . . . . 59 ILE CB . 27553 1
272 . 1 1 37 37 ILE N N 15 123.6 0.1 . 1 . . . . . 59 ILE N . 27553 1
273 . 1 1 38 38 LYS H H 1 8.42 0.01 . 1 . . . . . 60 LYS H . 27553 1
274 . 1 1 38 38 LYS HA H 1 4.62 0.02 . 1 . . . . . 60 LYS HA . 27553 1
275 . 1 1 38 38 LYS C C 13 174.3 0.3 . 1 . . . . . 60 LYS C . 27553 1
276 . 1 1 38 38 LYS CA C 13 54.0 0.3 . 1 . . . . . 60 LYS CA . 27553 1
277 . 1 1 38 38 LYS CB C 13 32.4 0.3 . 1 . . . . . 60 LYS CB . 27553 1
278 . 1 1 38 38 LYS N N 15 127.6 0.1 . 1 . . . . . 60 LYS N . 27553 1
279 . 1 1 39 39 PRO HA H 1 4.43 0.01 . 1 . . . . . 61 PRO HA . 27553 1
280 . 1 1 39 39 PRO HB2 H 1 2.29 0.01 . 2 . . . . . 61 PRO HB2 . 27553 1
281 . 1 1 39 39 PRO HB3 H 1 1.94 0.01 . 2 . . . . . 61 PRO HB3 . 27553 1
282 . 1 1 39 39 PRO C C 13 177.2 0.2 . 1 . . . . . 61 PRO C . 27553 1
283 . 1 1 39 39 PRO CA C 13 63.1 0.2 . 1 . . . . . 61 PRO CA . 27553 1
284 . 1 1 39 39 PRO CB C 13 32.1 0.2 . 1 . . . . . 61 PRO CB . 27553 1
285 . 1 1 40 40 GLY H H 1 8.33 0.01 . 1 . . . . . 62 GLY H . 27553 1
286 . 1 1 40 40 GLY HA2 H 1 4.19 0.02 . 1 . . . . . 62 GLY HA2 . 27553 1
287 . 1 1 40 40 GLY HA3 H 1 4.02 0.02 . 1 . . . . . 62 GLY HA3 . 27553 1
288 . 1 1 40 40 GLY C C 13 172.2 0.3 . 1 . . . . . 62 GLY C . 27553 1
289 . 1 1 40 40 GLY CA C 13 44.6 0.3 . 1 . . . . . 62 GLY CA . 27553 1
290 . 1 1 40 40 GLY N N 15 109.4 0.1 . 1 . . . . . 62 GLY N . 27553 1
291 . 1 1 41 41 PRO HA H 1 4.40 0.01 . 1 . . . . . 63 PRO HA . 27553 1
292 . 1 1 41 41 PRO HB2 H 1 2.27 0.01 . 2 . . . . . 63 PRO HB2 . 27553 1
293 . 1 1 41 41 PRO HB3 H 1 1.92 0.01 . 2 . . . . . 63 PRO HB3 . 27553 1
294 . 1 1 41 41 PRO C C 13 177.1 0.2 . 1 . . . . . 63 PRO C . 27553 1
295 . 1 1 41 41 PRO CA C 13 63.5 0.2 . 1 . . . . . 63 PRO CA . 27553 1
296 . 1 1 41 41 PRO CB C 13 32.0 0.2 . 1 . . . . . 63 PRO CB . 27553 1
297 . 1 1 42 42 ASN H H 1 8.59 0.01 . 1 . . . . . 64 ASN H . 27553 1
298 . 1 1 42 42 ASN HA H 1 4.72 0.01 . 1 . . . . . 64 ASN HA . 27553 1
299 . 1 1 42 42 ASN HB2 H 1 2.87 0.01 . 2 . . . . . 64 ASN HB2 . 27553 1
300 . 1 1 42 42 ASN HB3 H 1 2.75 0.01 . 2 . . . . . 64 ASN HB3 . 27553 1
301 . 1 1 42 42 ASN C C 13 175.4 0.2 . 1 . . . . . 64 ASN C . 27553 1
302 . 1 1 42 42 ASN CA C 13 53.0 0.2 . 1 . . . . . 64 ASN CA . 27553 1
303 . 1 1 42 42 ASN CB C 13 38.7 0.2 . 1 . . . . . 64 ASN CB . 27553 1
304 . 1 1 42 42 ASN N N 15 118.3 0.1 . 1 . . . . . 64 ASN N . 27553 1
305 . 1 1 43 43 SER H H 1 8.13 0.01 . 1 . . . . . 65 SER H . 27553 1
306 . 1 1 43 43 SER HA H 1 4.35 0.01 . 1 . . . . . 65 SER HA . 27553 1
307 . 1 1 43 43 SER HB2 H 1 3.84 0.01 . 2 . . . . . 65 SER HB2 . 27553 1
308 . 1 1 43 43 SER HB3 H 1 3.81 0.01 . 2 . . . . . 65 SER HB3 . 27553 1
309 . 1 1 43 43 SER C C 13 174.5 0.2 . 1 . . . . . 65 SER C . 27553 1
310 . 1 1 43 43 SER CA C 13 58.7 0.2 . 1 . . . . . 65 SER CA . 27553 1
311 . 1 1 43 43 SER CB C 13 63.9 0.2 . 1 . . . . . 65 SER CB . 27553 1
312 . 1 1 43 43 SER N N 15 116.1 0.1 . 1 . . . . . 65 SER N . 27553 1
313 . 1 1 44 44 HIS H H 1 8.55 0.01 . 1 . . . . . 66 HIS H . 27553 1
314 . 1 1 44 44 HIS HA H 1 4.71 0.01 . 1 . . . . . 66 HIS HA . 27553 1
315 . 1 1 44 44 HIS HB2 H 1 3.29 0.01 . 2 . . . . . 66 HIS HB2 . 27553 1
316 . 1 1 44 44 HIS HB3 H 1 3.17 0.01 . 2 . . . . . 66 HIS HB3 . 27553 1
317 . 1 1 44 44 HIS C C 13 174.1 0.2 . 1 . . . . . 66 HIS C . 27553 1
318 . 1 1 44 44 HIS CA C 13 55.4 0.2 . 1 . . . . . 66 HIS CA . 27553 1
319 . 1 1 44 44 HIS CB C 13 28.6 0.2 . 1 . . . . . 66 HIS CB . 27553 1
320 . 1 1 44 44 HIS N N 15 120.0 0.1 . 1 . . . . . 66 HIS N . 27553 1
321 . 1 1 45 45 ASN H H 1 8.42 0.01 . 1 . . . . . 67 ASN H . 27553 1
322 . 1 1 45 45 ASN HA H 1 4.73 0.01 . 1 . . . . . 67 ASN HA . 27553 1
323 . 1 1 45 45 ASN HB2 H 1 2.84 0.01 . 2 . . . . . 67 ASN HB2 . 27553 1
324 . 1 1 45 45 ASN HB3 H 1 2.75 0.01 . 2 . . . . . 67 ASN HB3 . 27553 1
325 . 1 1 45 45 ASN C C 13 175.2 0.2 . 1 . . . . . 67 ASN C . 27553 1
326 . 1 1 45 45 ASN CA C 13 53.2 0.2 . 1 . . . . . 67 ASN CA . 27553 1
327 . 1 1 45 45 ASN CB C 13 38.9 0.2 . 1 . . . . . 67 ASN CB . 27553 1
328 . 1 1 45 45 ASN N N 15 120.0 0.1 . 1 . . . . . 67 ASN N . 27553 1
329 . 1 1 46 46 SER H H 1 8.38 0.01 . 1 . . . . . 68 SER H . 27553 1
330 . 1 1 46 46 SER HA H 1 4.43 0.01 . 1 . . . . . 68 SER HA . 27553 1
331 . 1 1 46 46 SER HB2 H 1 3.89 0.01 . 2 . . . . . 68 SER HB2 . 27553 1
332 . 1 1 46 46 SER HB3 H 1 3.84 0.01 . 2 . . . . . 68 SER HB3 . 27553 1
333 . 1 1 46 46 SER C C 13 174.3 0.2 . 1 . . . . . 68 SER C . 27553 1
334 . 1 1 46 46 SER CA C 13 58.6 0.2 . 1 . . . . . 68 SER CA . 27553 1
335 . 1 1 46 46 SER CB C 13 63.9 0.2 . 1 . . . . . 68 SER CB . 27553 1
336 . 1 1 46 46 SER N N 15 116.4 0.1 . 1 . . . . . 68 SER N . 27553 1
337 . 1 1 47 47 ASN H H 1 8.52 0.01 . 1 . . . . . 69 ASN H . 27553 1
338 . 1 1 47 47 ASN HA H 1 4.76 0.01 . 1 . . . . . 69 ASN HA . 27553 1
339 . 1 1 47 47 ASN HB2 H 1 2.83 0.01 . 2 . . . . . 69 ASN HB2 . 27553 1
340 . 1 1 47 47 ASN HB3 H 1 2.75 0.01 . 2 . . . . . 69 ASN HB3 . 27553 1
341 . 1 1 47 47 ASN C C 13 175.0 0.2 . 1 . . . . . 69 ASN C . 27553 1
342 . 1 1 47 47 ASN CA C 13 53.2 0.2 . 1 . . . . . 69 ASN CA . 27553 1
343 . 1 1 47 47 ASN CB C 13 38.8 0.2 . 1 . . . . . 69 ASN CB . 27553 1
344 . 1 1 47 47 ASN N N 15 120.6 0.1 . 1 . . . . . 69 ASN N . 27553 1
345 . 1 1 48 48 THR H H 1 8.11 0.01 . 1 . . . . . 70 THR H . 27553 1
346 . 1 1 48 48 THR HA H 1 4.57 0.02 . 1 . . . . . 70 THR HA . 27553 1
347 . 1 1 48 48 THR HB H 1 4.11 0.02 . 1 . . . . . 70 THR HB . 27553 1
348 . 1 1 48 48 THR C C 13 172.7 0.3 . 1 . . . . . 70 THR C . 27553 1
349 . 1 1 48 48 THR CA C 13 59.9 0.3 . 1 . . . . . 70 THR CA . 27553 1
350 . 1 1 48 48 THR CB C 13 69.9 0.3 . 1 . . . . . 70 THR CB . 27553 1
351 . 1 1 48 48 THR N N 15 116.8 0.1 . 1 . . . . . 70 THR N . 27553 1
352 . 1 1 49 49 PRO HA H 1 4.40 0.01 . 1 . . . . . 71 PRO HA . 27553 1
353 . 1 1 49 49 PRO HB2 H 1 2.29 0.01 . 2 . . . . . 71 PRO HB2 . 27553 1
354 . 1 1 49 49 PRO HB3 H 1 1.93 0.01 . 2 . . . . . 71 PRO HB3 . 27553 1
355 . 1 1 49 49 PRO C C 13 177.4 0.2 . 1 . . . . . 71 PRO C . 27553 1
356 . 1 1 49 49 PRO CA C 13 63.6 0.2 . 1 . . . . . 71 PRO CA . 27553 1
357 . 1 1 49 49 PRO CB C 13 32.0 0.2 . 1 . . . . . 71 PRO CB . 27553 1
358 . 1 1 50 50 GLY H H 1 8.44 0.01 . 1 . . . . . 72 GLY H . 27553 1
359 . 1 1 50 50 GLY HA2 H 1 3.92 0.02 . 2 . . . . . 72 GLY HA2 . 27553 1
360 . 1 1 50 50 GLY HA3 H 1 3.92 0.02 . 2 . . . . . 72 GLY HA3 . 27553 1
361 . 1 1 50 50 GLY C C 13 174.0 0.2 . 1 . . . . . 72 GLY C . 27553 1
362 . 1 1 50 50 GLY CA C 13 45.2 0.2 . 1 . . . . . 72 GLY CA . 27553 1
363 . 1 1 50 50 GLY N N 15 109.3 0.1 . 1 . . . . . 72 GLY N . 27553 1
364 . 1 1 51 51 ILE H H 1 7.92 0.01 . 1 . . . . . 73 ILE H . 27553 1
365 . 1 1 51 51 ILE HA H 1 4.16 0.01 . 1 . . . . . 73 ILE HA . 27553 1
366 . 1 1 51 51 ILE HB H 1 1.84 0.01 . 1 . . . . . 73 ILE HB . 27553 1
367 . 1 1 51 51 ILE C C 13 176.2 0.2 . 1 . . . . . 73 ILE C . 27553 1
368 . 1 1 51 51 ILE CA C 13 61.0 0.2 . 1 . . . . . 73 ILE CA . 27553 1
369 . 1 1 51 51 ILE CB C 13 38.6 0.2 . 1 . . . . . 73 ILE CB . 27553 1
370 . 1 1 51 51 ILE N N 15 120.2 0.1 . 1 . . . . . 73 ILE N . 27553 1
371 . 1 1 52 52 ARG H H 1 8.43 0.01 . 1 . . . . . 74 ARG H . 27553 1
372 . 1 1 52 52 ARG HA H 1 4.34 0.01 . 1 . . . . . 74 ARG HA . 27553 1
373 . 1 1 52 52 ARG HB2 H 1 1.81 0.01 . 2 . . . . . 74 ARG HB2 . 27553 1
374 . 1 1 52 52 ARG HB3 H 1 1.73 0.01 . 2 . . . . . 74 ARG HB3 . 27553 1
375 . 1 1 52 52 ARG C C 13 176.1 0.2 . 1 . . . . . 74 ARG C . 27553 1
376 . 1 1 52 52 ARG CA C 13 56.0 0.2 . 1 . . . . . 74 ARG CA . 27553 1
377 . 1 1 52 52 ARG CB C 13 30.7 0.2 . 1 . . . . . 74 ARG CB . 27553 1
378 . 1 1 52 52 ARG N N 15 125.4 0.1 . 1 . . . . . 74 ARG N . 27553 1
379 . 1 1 53 53 GLU H H 1 8.48 0.01 . 1 . . . . . 75 GLU H . 27553 1
380 . 1 1 53 53 GLU HA H 1 4.29 0.01 . 1 . . . . . 75 GLU HA . 27553 1
381 . 1 1 53 53 GLU HB2 H 1 2.06 0.01 . 2 . . . . . 75 GLU HB2 . 27553 1
382 . 1 1 53 53 GLU HB3 H 1 1.94 0.01 . 2 . . . . . 75 GLU HB3 . 27553 1
383 . 1 1 53 53 GLU C C 13 176.1 0.2 . 1 . . . . . 75 GLU C . 27553 1
384 . 1 1 53 53 GLU CA C 13 56.2 0.2 . 1 . . . . . 75 GLU CA . 27553 1
385 . 1 1 53 53 GLU CB C 13 29.7 0.2 . 1 . . . . . 75 GLU CB . 27553 1
386 . 1 1 53 53 GLU N N 15 122.8 0.1 . 1 . . . . . 75 GLU N . 27553 1
387 . 1 1 54 54 ALA H H 1 8.46 0.01 . 1 . . . . . 76 ALA H . 27553 1
388 . 1 1 54 54 ALA HA H 1 4.29 0.01 . 1 . . . . . 76 ALA HA . 27553 1
389 . 1 1 54 54 ALA HB1 H 1 1.40 0.01 . 1 . . . . . 76 ALA MB . 27553 1
390 . 1 1 54 54 ALA HB2 H 1 1.40 0.01 . 1 . . . . . 76 ALA MB . 27553 1
391 . 1 1 54 54 ALA HB3 H 1 1.40 0.01 . 1 . . . . . 76 ALA MB . 27553 1
392 . 1 1 54 54 ALA C C 13 178.3 0.2 . 1 . . . . . 76 ALA C . 27553 1
393 . 1 1 54 54 ALA CA C 13 52.9 0.2 . 1 . . . . . 76 ALA CA . 27553 1
394 . 1 1 54 54 ALA CB C 13 19.1 0.2 . 1 . . . . . 76 ALA CB . 27553 1
395 . 1 1 54 54 ALA N N 15 125.7 0.1 . 1 . . . . . 76 ALA N . 27553 1
396 . 1 1 55 55 GLY H H 1 8.46 0.01 . 1 . . . . . 77 GLY H . 27553 1
397 . 1 1 55 55 GLY HA2 H 1 4.02 0.01 . 1 . . . . . 77 GLY HA2 . 27553 1
398 . 1 1 55 55 GLY HA3 H 1 3.98 0.01 . 1 . . . . . 77 GLY HA3 . 27553 1
399 . 1 1 55 55 GLY C C 13 174.2 0.2 . 1 . . . . . 77 GLY C . 27553 1
400 . 1 1 55 55 GLY CA C 13 45.3 0.2 . 1 . . . . . 77 GLY CA . 27553 1
401 . 1 1 55 55 GLY N N 15 108.7 0.1 . 1 . . . . . 77 GLY N . 27553 1
402 . 1 1 56 56 SER H H 1 8.13 0.01 . 1 . . . . . 78 SER H . 27553 1
403 . 1 1 56 56 SER HA H 1 4.49 0.01 . 1 . . . . . 78 SER HA . 27553 1
404 . 1 1 56 56 SER HB2 H 1 3.87 0.02 . 2 . . . . . 78 SER HB2 . 27553 1
405 . 1 1 56 56 SER HB3 H 1 3.87 0.02 . 2 . . . . . 78 SER HB3 . 27553 1
406 . 1 1 56 56 SER C C 13 173.7 0.2 . 1 . . . . . 78 SER C . 27553 1
407 . 1 1 56 56 SER CA C 13 58.4 0.2 . 1 . . . . . 78 SER CA . 27553 1
408 . 1 1 56 56 SER CB C 13 64.2 0.2 . 1 . . . . . 78 SER CB . 27553 1
409 . 1 1 56 56 SER N N 15 115.7 0.1 . 1 . . . . . 78 SER N . 27553 1
410 . 1 1 57 57 GLU H H 1 8.11 0.01 . 1 . . . . . 79 GLU H . 27553 1
411 . 1 1 57 57 GLU HA H 1 4.17 0.02 . 1 . . . . . 79 GLU HA . 27553 1
412 . 1 1 57 57 GLU C C 13 180.6 0.3 . 1 . . . . . 79 GLU C . 27553 1
413 . 1 1 57 57 GLU CA C 13 57.9 0.3 . 1 . . . . . 79 GLU CA . 27553 1
414 . 1 1 57 57 GLU CB C 13 30.2 0.3 . 1 . . . . . 79 GLU CB . 27553 1
415 . 1 1 57 57 GLU N N 15 126.8 0.1 . 1 . . . . . 79 GLU N . 27553 1
stop_
save_