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 17047
_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 '2D 1H-15N HSQC' . . . 17047 1
2 '3D HNCACB' . . . 17047 1
3 '3D CBCA(CO)NH' . . . 17047 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.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 7 7 ALA CA C 13 54.66 0.03 . 1 . . . . 2 Ala CA . 17047 1
2 . 1 1 7 7 ALA CB C 13 19.20 0.08 . 1 . . . . 2 Ala CB . 17047 1
3 . 1 1 8 8 GLN H H 1 8.28 0.01 . 1 . . . . 3 Gln HN . 17047 1
4 . 1 1 8 8 GLN CA C 13 56.57 0.71 . 1 . . . . 3 Gln CA . 17047 1
5 . 1 1 8 8 GLN CB C 13 29.88 0.13 . 1 . . . . 3 Gln CB . 17047 1
6 . 1 1 8 8 GLN N N 15 119.78 0.01 . 1 . . . . 3 Gln N . 17047 1
7 . 1 1 9 9 GLN H H 1 8.45 0.01 . 1 . . . . 4 Gln HN . 17047 1
8 . 1 1 9 9 GLN CA C 13 56.24 0.18 . 1 . . . . 4 Gln CA . 17047 1
9 . 1 1 9 9 GLN CB C 13 29.97 0.20 . 1 . . . . 4 Gln CB . 17047 1
10 . 1 1 9 9 GLN N N 15 121.98 0.01 . 1 . . . . 4 Gln N . 17047 1
11 . 1 1 10 10 SER H H 1 8.36 0.01 . 1 . . . . 5 Ser HN . 17047 1
12 . 1 1 10 10 SER CA C 13 56.14 0.01 . 1 . . . . 5 Ser CA . 17047 1
13 . 1 1 10 10 SER CB C 13 63.76 0.01 . 1 . . . . 5 Ser CB . 17047 1
14 . 1 1 10 10 SER N N 15 118.08 0.01 . 1 . . . . 5 Ser N . 17047 1
15 . 1 1 11 11 PRO CA C 13 63.93 0.19 . 1 . . . . 6 Pro CA . 17047 1
16 . 1 1 11 11 PRO CB C 13 32.10 0.03 . 1 . . . . 6 Pro CB . 17047 1
17 . 1 1 12 12 TYR H H 1 7.93 0.01 . 1 . . . . 7 Tyr HN . 17047 1
18 . 1 1 12 12 TYR CA C 13 58.17 0.15 . 1 . . . . 7 Tyr CA . 17047 1
19 . 1 1 12 12 TYR CB C 13 38.97 0.21 . 1 . . . . 7 Tyr CB . 17047 1
20 . 1 1 12 12 TYR N N 15 118.98 0.01 . 1 . . . . 7 Tyr N . 17047 1
21 . 1 1 13 13 SER H H 1 7.92 0.01 . 1 . . . . 8 Ser HN . 17047 1
22 . 1 1 13 13 SER CA C 13 58.79 0.20 . 1 . . . . 8 Ser CA . 17047 1
23 . 1 1 13 13 SER CB C 13 64.20 0.18 . 1 . . . . 8 Ser CB . 17047 1
24 . 1 1 13 13 SER N N 15 117.18 0.01 . 1 . . . . 8 Ser N . 17047 1
25 . 1 1 14 14 ALA H H 1 8.33 0.01 . 1 . . . . 9 Ala HN . 17047 1
26 . 1 1 14 14 ALA CA C 13 54.18 0.10 . 1 . . . . 9 Ala CA . 17047 1
27 . 1 1 14 14 ALA CB C 13 19.11 0.13 . 1 . . . . 9 Ala CB . 17047 1
28 . 1 1 14 14 ALA N N 15 126.18 0.01 . 1 . . . . 9 Ala N . 17047 1
29 . 1 1 15 15 ALA H H 1 8.09 0.01 . 1 . . . . 10 Ala HN . 17047 1
30 . 1 1 15 15 ALA CA C 13 54.04 0.13 . 1 . . . . 10 Ala CA . 17047 1
31 . 1 1 15 15 ALA CB C 13 18.94 0.05 . 1 . . . . 10 Ala CB . 17047 1
32 . 1 1 15 15 ALA N N 15 121.38 0.01 . 1 . . . . 10 Ala N . 17047 1
33 . 1 1 16 16 MET H H 1 7.99 0.01 . 1 . . . . 11 Met HN . 17047 1
34 . 1 1 16 16 MET CA C 13 56.92 0.17 . 1 . . . . 11 Met CA . 17047 1
35 . 1 1 16 16 MET CB C 13 32.79 0.06 . 1 . . . . 11 Met CB . 17047 1
36 . 1 1 16 16 MET N N 15 118.28 0.01 . 1 . . . . 11 Met N . 17047 1
37 . 1 1 17 17 ALA H H 1 8.11 0.01 . 1 . . . . 12 Ala HN . 17047 1
38 . 1 1 17 17 ALA CA C 13 54.66 0.18 . 1 . . . . 12 Ala CA . 17047 1
39 . 1 1 17 17 ALA CB C 13 18.94 0.01 . 1 . . . . 12 Ala CB . 17047 1
40 . 1 1 17 17 ALA N N 15 122.98 0.01 . 1 . . . . 12 Ala N . 17047 1
41 . 1 1 18 18 GLU H H 1 8.19 0.01 . 1 . . . . 13 Glu HN . 17047 1
42 . 1 1 18 18 GLU CA C 13 52.84 11.50 . 1 . . . . 13 Glu CA . 17047 1
43 . 1 1 18 18 GLU CB C 13 29.66 0.06 . 1 . . . . 13 Glu CB . 17047 1
44 . 1 1 18 18 GLU N N 15 119.18 0.03 . 1 . . . . 13 Glu N . 17047 1
45 . 1 1 19 19 GLN H H 1 8.19 0.01 . 1 . . . . 14 Gln HN . 17047 1
46 . 1 1 19 19 GLN CA C 13 59.06 0.06 . 1 . . . . 14 Gln CA . 17047 1
47 . 1 1 19 19 GLN CB C 13 28.76 0.01 . 1 . . . . 14 Gln CB . 17047 1
48 . 1 1 19 19 GLN N N 15 120.68 0.01 . 1 . . . . 14 Gln N . 17047 1
49 . 1 1 20 20 ARG H H 1 8.37 0.01 . 1 . . . . 15 Arg HN . 17047 1
50 . 1 1 20 20 ARG CA C 13 59.46 0.65 . 1 . . . . 15 Arg CA . 17047 1
51 . 1 1 20 20 ARG CB C 13 31.59 0.94 . 1 . . . . 15 Arg CB . 17047 1
52 . 1 1 20 20 ARG N N 15 117.88 0.01 . 1 . . . . 15 Arg N . 17047 1
53 . 1 1 21 21 HIS H H 1 7.68 0.01 . 1 . . . . 16 His HN . 17047 1
54 . 1 1 21 21 HIS CA C 13 56.17 0.36 . 1 . . . . 16 His CA . 17047 1
55 . 1 1 21 21 HIS CB C 13 32.18 4.66 . 1 . . . . 16 His CB . 17047 1
56 . 1 1 21 21 HIS N N 15 117.28 0.03 . 1 . . . . 16 His N . 17047 1
57 . 1 1 22 22 GLN H H 1 8.37 0.01 . 1 . . . . 17 Gln HN . 17047 1
58 . 1 1 22 22 GLN CA C 13 58.93 0.21 . 1 . . . . 17 Gln CA . 17047 1
59 . 1 1 22 22 GLN CB C 13 29.35 0.65 . 1 . . . . 17 Gln CB . 17047 1
60 . 1 1 22 22 GLN N N 15 118.18 0.01 . 1 . . . . 17 Gln N . 17047 1
61 . 1 1 23 23 GLU H H 1 8.48 0.01 . 1 . . . . 18 Glu HN . 17047 1
62 . 1 1 23 23 GLU CA C 13 59.55 0.31 . 1 . . . . 18 Glu CA . 17047 1
63 . 1 1 23 23 GLU CB C 13 29.42 0.43 . 1 . . . . 18 Glu CB . 17047 1
64 . 1 1 23 23 GLU N N 15 120.18 0.01 . 1 . . . . 18 Glu N . 17047 1
65 . 1 1 24 24 TRP H H 1 8.13 0.01 . 1 . . . . 19 Trp HN . 17047 1
66 . 1 1 24 24 TRP CA C 13 59.51 0.01 . 1 . . . . 19 Trp CA . 17047 1
67 . 1 1 24 24 TRP CB C 13 29.31 0.01 . 1 . . . . 19 Trp CB . 17047 1
68 . 1 1 24 24 TRP N N 15 122.18 0.01 . 1 . . . . 19 Trp N . 17047 1
69 . 1 1 25 25 LEU CA C 13 57.72 0.04 . 1 . . . . 20 Leu CA . 17047 1
70 . 1 1 25 25 LEU CB C 13 40.97 0.01 . 1 . . . . 20 Leu CB . 17047 1
71 . 1 1 26 26 ARG H H 1 7.95 0.01 . 1 . . . . 21 Arg HN . 17047 1
72 . 1 1 26 26 ARG CA C 13 59.95 0.27 . 1 . . . . 21 Arg CA . 17047 1
73 . 1 1 26 26 ARG CB C 13 30.21 0.12 . 1 . . . . 21 Arg CB . 17047 1
74 . 1 1 26 26 ARG N N 15 119.68 0.01 . 1 . . . . 21 Arg N . 17047 1
75 . 1 1 27 27 PHE H H 1 7.81 0.01 . 1 . . . . 22 Phe HN . 17047 1
76 . 1 1 27 27 PHE CA C 13 62.38 0.17 . 1 . . . . 22 Phe CA . 17047 1
77 . 1 1 27 27 PHE CB C 13 37.71 0.16 . 1 . . . . 22 Phe CB . 17047 1
78 . 1 1 27 27 PHE N N 15 120.18 0.01 . 1 . . . . 22 Phe N . 17047 1
79 . 1 1 28 28 VAL H H 1 7.81 0.01 . 1 . . . . 23 Val HN . 17047 1
80 . 1 1 28 28 VAL CA C 13 67.00 0.11 . 1 . . . . 23 Val CA . 17047 1
81 . 1 1 28 28 VAL CB C 13 31.41 0.17 . 1 . . . . 23 Val CB . 17047 1
82 . 1 1 28 28 VAL N N 15 119.28 0.01 . 1 . . . . 23 Val N . 17047 1
83 . 1 1 29 29 ASP H H 1 8.06 0.01 . 1 . . . . 24 Asp HN . 17047 1
84 . 1 1 29 29 ASP CA C 13 57.54 0.18 . 1 . . . . 24 Asp CA . 17047 1
85 . 1 1 29 29 ASP CB C 13 41.87 0.22 . 1 . . . . 24 Asp CB . 17047 1
86 . 1 1 29 29 ASP N N 15 121.28 0.01 . 1 . . . . 24 Asp N . 17047 1
87 . 1 1 30 30 LEU H H 1 8.15 0.01 . 1 . . . . 25 Leu HN . 17047 1
88 . 1 1 30 30 LEU CA C 13 57.99 0.01 . 1 . . . . 25 Leu CA . 17047 1
89 . 1 1 30 30 LEU CB C 13 42.75 0.01 . 1 . . . . 25 Leu CB . 17047 1
90 . 1 1 30 30 LEU N N 15 123.98 0.01 . 1 . . . . 25 Leu N . 17047 1
91 . 1 1 31 31 LEU H H 1 8.22 0.01 . 1 . . . . 26 Leu HN . 17047 1
92 . 1 1 31 31 LEU CA C 13 57.61 0.10 . 1 . . . . 26 Leu CA . 17047 1
93 . 1 1 31 31 LEU CB C 13 40.79 0.09 . 1 . . . . 26 Leu CB . 17047 1
94 . 1 1 31 31 LEU N N 15 119.28 0.01 . 1 . . . . 26 Leu N . 17047 1
95 . 1 1 32 32 LYS H H 1 7.53 0.01 . 1 . . . . 27 Lys HN . 17047 1
96 . 1 1 32 32 LYS CA C 13 60.30 0.29 . 1 . . . . 27 Lys CA . 17047 1
97 . 1 1 32 32 LYS CB C 13 32.63 0.15 . 1 . . . . 27 Lys CB . 17047 1
98 . 1 1 32 32 LYS N N 15 120.68 0.01 . 1 . . . . 27 Lys N . 17047 1
99 . 1 1 33 33 ASN H H 1 7.74 0.01 . 1 . . . . 28 Asn HN . 17047 1
100 . 1 1 33 33 ASN CA C 13 56.09 0.22 . 1 . . . . 28 Asn CA . 17047 1
101 . 1 1 33 33 ASN CB C 13 39.20 0.09 . 1 . . . . 28 Asn CB . 17047 1
102 . 1 1 33 33 ASN N N 15 116.58 0.01 . 1 . . . . 28 Asn N . 17047 1
103 . 1 1 34 34 ALA H H 1 8.94 0.01 . 1 . . . . 29 Ala HN . 17047 1
104 . 1 1 34 34 ALA CA C 13 55.90 0.19 . 1 . . . . 29 Ala CA . 17047 1
105 . 1 1 34 34 ALA CB C 13 18.02 0.13 . 1 . . . . 29 Ala CB . 17047 1
106 . 1 1 34 34 ALA N N 15 126.08 0.01 . 1 . . . . 29 Ala N . 17047 1
107 . 1 1 35 35 TYR H H 1 8.45 0.01 . 1 . . . . 30 Tyr HN . 17047 1
108 . 1 1 35 35 TYR CA C 13 62.01 0.21 . 1 . . . . 30 Tyr CA . 17047 1
109 . 1 1 35 35 TYR CB C 13 38.40 0.19 . 1 . . . . 30 Tyr CB . 17047 1
110 . 1 1 35 35 TYR N N 15 119.18 0.01 . 1 . . . . 30 Tyr N . 17047 1
111 . 1 1 36 36 GLN H H 1 7.43 0.01 . 1 . . . . 31 Gln HN . 17047 1
112 . 1 1 36 36 GLN CA C 13 58.29 0.19 . 1 . . . . 31 Gln CA . 17047 1
113 . 1 1 36 36 GLN CB C 13 28.77 0.14 . 1 . . . . 31 Gln CB . 17047 1
114 . 1 1 36 36 GLN N N 15 116.98 0.01 . 1 . . . . 31 Gln N . 17047 1
115 . 1 1 37 37 ASN H H 1 7.36 0.01 . 1 . . . . 32 Asn HN . 17047 1
116 . 1 1 37 37 ASN CA C 13 53.42 0.17 . 1 . . . . 32 Asn CA . 17047 1
117 . 1 1 37 37 ASN CB C 13 40.67 0.20 . 1 . . . . 32 Asn CB . 17047 1
118 . 1 1 37 37 ASN N N 15 115.48 0.01 . 1 . . . . 32 Asn N . 17047 1
119 . 1 1 38 38 ASP H H 1 7.94 0.01 . 1 . . . . 33 Asp HN . 17047 1
120 . 1 1 38 38 ASP CA C 13 56.43 0.31 . 1 . . . . 33 Asp CA . 17047 1
121 . 1 1 38 38 ASP CB C 13 39.92 0.40 . 1 . . . . 33 Asp CB . 17047 1
122 . 1 1 38 38 ASP N N 15 116.98 0.01 . 1 . . . . 33 Asp N . 17047 1
123 . 1 1 39 39 LEU H H 1 8.43 0.27 . 1 . . . . 34 Leu HN . 17047 1
124 . 1 1 39 39 LEU CA C 13 53.82 0.11 . 1 . . . . 34 Leu CA . 17047 1
125 . 1 1 39 39 LEU CB C 13 40.65 5.94 . 1 . . . . 34 Leu CB . 17047 1
126 . 1 1 39 39 LEU N N 15 118.08 1.13 . 1 . . . . 34 Leu N . 17047 1
127 . 1 1 40 40 HIS H H 1 9.09 0.01 . 1 . . . . 35 His HN . 17047 1
128 . 1 1 40 40 HIS CA C 13 59.85 0.15 . 1 . . . . 35 His CA . 17047 1
129 . 1 1 40 40 HIS CB C 13 39.17 14.64 . 1 . . . . 35 His CB . 17047 1
130 . 1 1 40 40 HIS N N 15 120.88 0.01 . 1 . . . . 35 His N . 17047 1
131 . 1 1 41 41 LEU H H 1 7.47 0.01 . 1 . . . . 36 Leu HN . 17047 1
132 . 1 1 41 41 LEU CA C 13 59.70 0.01 . 1 . . . . 36 Leu CA . 17047 1
133 . 1 1 41 41 LEU CB C 13 37.67 0.01 . 1 . . . . 36 Leu CB . 17047 1
134 . 1 1 41 41 LEU N N 15 119.38 0.01 . 1 . . . . 36 Leu N . 17047 1
135 . 1 1 42 42 PRO CA C 13 65.74 0.15 . 1 . . . . 37 Pro CA . 17047 1
136 . 1 1 42 42 PRO CB C 13 31.36 0.12 . 1 . . . . 37 Pro CB . 17047 1
137 . 1 1 43 43 LEU H H 1 8.03 0.01 . 1 . . . . 38 Leu HN . 17047 1
138 . 1 1 43 43 LEU CA C 13 58.86 0.19 . 1 . . . . 38 Leu CA . 17047 1
139 . 1 1 43 43 LEU CB C 13 41.76 0.21 . 1 . . . . 38 Leu CB . 17047 1
140 . 1 1 43 43 LEU N N 15 119.68 0.01 . 1 . . . . 38 Leu N . 17047 1
141 . 1 1 44 44 LEU H H 1 8.92 0.01 . 1 . . . . 39 Leu HN . 17047 1
142 . 1 1 44 44 LEU CA C 13 58.64 0.21 . 1 . . . . 39 Leu CA . 17047 1
143 . 1 1 44 44 LEU CB C 13 41.95 0.14 . 1 . . . . 39 Leu CB . 17047 1
144 . 1 1 44 44 LEU N N 15 120.78 0.01 . 1 . . . . 39 Leu N . 17047 1
145 . 1 1 45 45 ASN H H 1 8.21 0.01 . 1 . . . . 40 Asn HN . 17047 1
146 . 1 1 45 45 ASN CA C 13 55.26 0.18 . 1 . . . . 40 Asn CA . 17047 1
147 . 1 1 45 45 ASN CB C 13 38.13 0.05 . 1 . . . . 40 Asn CB . 17047 1
148 . 1 1 45 45 ASN N N 15 117.98 0.01 . 1 . . . . 40 Asn N . 17047 1
149 . 1 1 46 46 LEU H H 1 7.77 0.01 . 1 . . . . 41 Leu HN . 17047 1
150 . 1 1 46 46 LEU CA C 13 58.63 0.14 . 1 . . . . 41 Leu CA . 17047 1
151 . 1 1 46 46 LEU CB C 13 39.86 4.37 . 1 . . . . 41 Leu CB . 17047 1
152 . 1 1 46 46 LEU N N 15 118.98 0.01 . 1 . . . . 41 Leu N . 17047 1
153 . 1 1 47 47 MET H H 1 8.70 0.01 . 1 . . . . 42 Met HN . 17047 1
154 . 1 1 47 47 MET CA C 13 56.48 0.20 . 1 . . . . 42 Met CA . 17047 1
155 . 1 1 47 47 MET CB C 13 32.65 0.01 . 1 . . . . 42 Met CB . 17047 1
156 . 1 1 47 47 MET N N 15 114.38 0.01 . 1 . . . . 42 Met N . 17047 1
157 . 1 1 48 48 LEU H H 1 7.64 0.01 . 1 . . . . 43 Leu HN . 17047 1
158 . 1 1 48 48 LEU CA C 13 54.04 0.01 . 1 . . . . 43 Leu CA . 17047 1
159 . 1 1 48 48 LEU CB C 13 44.70 0.01 . 1 . . . . 43 Leu CB . 17047 1
160 . 1 1 48 48 LEU N N 15 115.68 0.01 . 1 . . . . 43 Leu N . 17047 1
161 . 1 1 50 50 PRO CA C 13 65.97 0.35 . 1 . . . . 45 Pro CA . 17047 1
162 . 1 1 50 50 PRO CB C 13 32.04 0.05 . 1 . . . . 45 Pro CB . 17047 1
163 . 1 1 51 51 ASP H H 1 7.99 0.01 . 1 . . . . 46 Asp HN . 17047 1
164 . 1 1 51 51 ASP CA C 13 56.75 0.22 . 1 . . . . 46 Asp CA . 17047 1
165 . 1 1 51 51 ASP CB C 13 40.48 0.16 . 1 . . . . 46 Asp CB . 17047 1
166 . 1 1 51 51 ASP N N 15 114.58 0.01 . 1 . . . . 46 Asp N . 17047 1
167 . 1 1 52 52 GLU H H 1 7.82 0.01 . 1 . . . . 47 Glu HN . 17047 1
168 . 1 1 52 52 GLU CA C 13 59.04 0.12 . 1 . . . . 47 Glu CA . 17047 1
169 . 1 1 52 52 GLU CB C 13 30.01 0.05 . 1 . . . . 47 Glu CB . 17047 1
170 . 1 1 52 52 GLU N N 15 122.68 0.01 . 1 . . . . 47 Glu N . 17047 1
171 . 1 1 53 53 ARG H H 1 7.60 0.01 . 1 . . . . 48 Arg HN . 17047 1
172 . 1 1 53 53 ARG CA C 13 60.80 0.12 . 1 . . . . 48 Arg CA . 17047 1
173 . 1 1 53 53 ARG CB C 13 30.49 0.06 . 1 . . . . 48 Arg CB . 17047 1
174 . 1 1 53 53 ARG N N 15 117.28 0.01 . 1 . . . . 48 Arg N . 17047 1
175 . 1 1 54 54 GLU H H 1 7.72 0.01 . 1 . . . . 49 Glu HN . 17047 1
176 . 1 1 54 54 GLU CA C 13 59.59 0.20 . 1 . . . . 49 Glu CA . 17047 1
177 . 1 1 54 54 GLU CB C 13 26.63 5.28 . 1 . . . . 49 Glu CB . 17047 1
178 . 1 1 54 54 GLU N N 15 117.28 0.01 . 1 . . . . 49 Glu N . 17047 1
179 . 1 1 55 55 ALA H H 1 8.06 0.01 . 1 . . . . 50 Ala HN . 17047 1
180 . 1 1 55 55 ALA CA C 13 55.34 0.04 . 1 . . . . 50 Ala CA . 17047 1
181 . 1 1 55 55 ALA CB C 13 17.81 0.06 . 1 . . . . 50 Ala CB . 17047 1
182 . 1 1 55 55 ALA N N 15 121.98 0.01 . 1 . . . . 50 Ala N . 17047 1
183 . 1 1 56 56 LEU H H 1 8.11 0.01 . 1 . . . . 51 Leu HN . 17047 1
184 . 1 1 56 56 LEU CA C 13 58.80 0.01 . 1 . . . . 51 Leu CA . 17047 1
185 . 1 1 56 56 LEU CB C 13 41.06 0.01 . 1 . . . . 51 Leu CB . 17047 1
186 . 1 1 56 56 LEU N N 15 118.68 0.01 . 1 . . . . 51 Leu N . 17047 1
187 . 1 1 57 57 GLY H H 1 8.04 0.01 . 1 . . . . 52 Gly HN . 17047 1
188 . 1 1 57 57 GLY N N 15 133.98 0.01 . 1 . . . . 52 Gly N . 17047 1
189 . 1 1 59 59 ARG H H 1 8.68 0.01 . 1 . . . . 54 Arg HN . 17047 1
190 . 1 1 59 59 ARG CA C 13 60.94 0.12 . 1 . . . . 54 Arg CA . 17047 1
191 . 1 1 59 59 ARG CB C 13 30.75 0.17 . 1 . . . . 54 Arg CB . 17047 1
192 . 1 1 59 59 ARG N N 15 121.68 0.01 . 1 . . . . 54 Arg N . 17047 1
193 . 1 1 60 60 VAL H H 1 7.80 0.01 . 1 . . . . 55 Val HN . 17047 1
194 . 1 1 60 60 VAL CA C 13 67.50 0.23 . 1 . . . . 55 Val CA . 17047 1
195 . 1 1 60 60 VAL CB C 13 31.86 0.20 . 1 . . . . 55 Val CB . 17047 1
196 . 1 1 60 60 VAL N N 15 117.98 0.03 . 1 . . . . 55 Val N . 17047 1
197 . 1 1 61 61 ARG H H 1 7.17 0.01 . 1 . . . . 56 Arg HN . 17047 1
198 . 1 1 61 61 ARG CA C 13 58.33 0.01 . 1 . . . . 56 Arg CA . 17047 1
199 . 1 1 61 61 ARG CB C 13 28.87 0.01 . 1 . . . . 56 Arg CB . 17047 1
200 . 1 1 61 61 ARG N N 15 118.78 0.01 . 1 . . . . 56 Arg N . 17047 1
201 . 1 1 63 63 VAL H H 1 8.47 0.01 . 1 . . . . 58 Val HN . 17047 1
202 . 1 1 63 63 VAL CA C 13 68.19 0.27 . 1 . . . . 58 Val CA . 17047 1
203 . 1 1 63 63 VAL CB C 13 31.89 0.07 . 1 . . . . 58 Val CB . 17047 1
204 . 1 1 63 63 VAL N N 15 118.58 0.01 . 1 . . . . 58 Val N . 17047 1
205 . 1 1 64 64 GLU H H 1 8.77 0.01 . 1 . . . . 59 Glu HN . 17047 1
206 . 1 1 64 64 GLU CA C 13 60.62 0.19 . 1 . . . . 59 Glu CA . 17047 1
207 . 1 1 64 64 GLU CB C 13 30.24 0.12 . 1 . . . . 59 Glu CB . 17047 1
208 . 1 1 64 64 GLU N N 15 118.88 0.01 . 1 . . . . 59 Glu N . 17047 1
209 . 1 1 65 65 GLU H H 1 8.30 0.01 . 1 . . . . 60 Glu HN . 17047 1
210 . 1 1 65 65 GLU CA C 13 57.83 0.28 . 1 . . . . 60 Glu CA . 17047 1
211 . 1 1 65 65 GLU CB C 13 29.47 0.23 . 1 . . . . 60 Glu CB . 17047 1
212 . 1 1 65 65 GLU N N 15 114.78 0.01 . 1 . . . . 60 Glu N . 17047 1
213 . 1 1 66 66 LEU H H 1 9.07 0.01 . 1 . . . . 61 Leu HN . 17047 1
214 . 1 1 66 66 LEU CA C 13 58.19 0.25 . 1 . . . . 61 Leu CA . 17047 1
215 . 1 1 66 66 LEU CB C 13 42.25 0.62 . 1 . . . . 61 Leu CB . 17047 1
216 . 1 1 66 66 LEU N N 15 124.48 0.01 . 1 . . . . 61 Leu N . 17047 1
217 . 1 1 67 67 LEU H H 1 8.26 0.01 . 1 . . . . 62 Leu HN . 17047 1
218 . 1 1 67 67 LEU CA C 13 53.91 6.47 . 1 . . . . 62 Leu CA . 17047 1
219 . 1 1 67 67 LEU CB C 13 42.55 0.02 . 1 . . . . 62 Leu CB . 17047 1
220 . 1 1 67 67 LEU N N 15 119.18 0.01 . 1 . . . . 62 Leu N . 17047 1
221 . 1 1 68 68 ARG H H 1 8.37 0.01 . 1 . . . . 63 Arg HN . 17047 1
222 . 1 1 68 68 ARG CA C 13 59.48 0.01 . 1 . . . . 63 Arg CA . 17047 1
223 . 1 1 68 68 ARG CB C 13 30.65 0.01 . 1 . . . . 63 Arg CB . 17047 1
224 . 1 1 68 68 ARG N N 15 119.48 0.01 . 1 . . . . 63 Arg N . 17047 1
225 . 1 1 69 69 GLY H H 1 7.64 0.01 . 1 . . . . 64 Gly HN . 17047 1
226 . 1 1 69 69 GLY CA C 13 45.02 0.07 . 1 . . . . 64 Gly CA . 17047 1
227 . 1 1 69 69 GLY N N 15 132.18 0.01 . 1 . . . . 64 Gly N . 17047 1
228 . 1 1 70 70 GLU H H 1 8.61 0.01 . 1 . . . . 65 Glu HN . 17047 1
229 . 1 1 70 70 GLU CA C 13 57.75 0.15 . 1 . . . . 65 Glu CA . 17047 1
230 . 1 1 70 70 GLU CB C 13 31.68 0.13 . 1 . . . . 65 Glu CB . 17047 1
231 . 1 1 70 70 GLU N N 15 120.98 0.01 . 1 . . . . 65 Glu N . 17047 1
232 . 1 1 71 71 MET H H 1 8.67 0.01 . 1 . . . . 66 Met HN . 17047 1
233 . 1 1 71 71 MET CA C 13 56.28 0.22 . 1 . . . . 66 Met CA . 17047 1
234 . 1 1 71 71 MET CB C 13 35.67 0.15 . 1 . . . . 66 Met CB . 17047 1
235 . 1 1 71 71 MET N N 15 118.88 0.01 . 1 . . . . 66 Met N . 17047 1
236 . 1 1 72 72 SER H H 1 8.82 0.01 . 1 . . . . 67 Ser HN . 17047 1
237 . 1 1 72 72 SER CA C 13 57.45 0.06 . 1 . . . . 67 Ser CA . 17047 1
238 . 1 1 72 72 SER CB C 13 65.24 0.18 . 1 . . . . 67 Ser CB . 17047 1
239 . 1 1 72 72 SER N N 15 118.58 0.01 . 1 . . . . 67 Ser N . 17047 1
240 . 1 1 73 73 GLN CA C 13 60.83 0.01 . 1 . . . . 68 Gln CA . 17047 1
241 . 1 1 73 73 GLN CB C 13 28.48 0.01 . 1 . . . . 68 Gln CB . 17047 1
242 . 1 1 73 73 GLN N N 15 120.18 0.01 . 1 . . . . 68 Gln N . 17047 1
243 . 1 1 74 74 ARG CA C 13 59.73 0.12 . 1 . . . . 69 Arg CA . 17047 1
244 . 1 1 74 74 ARG CB C 13 30.54 0.04 . 1 . . . . 69 Arg CB . 17047 1
245 . 1 1 75 75 GLU H H 1 7.62 0.01 . 1 . . . . 70 Glu HN . 17047 1
246 . 1 1 75 75 GLU CA C 13 59.45 0.04 . 1 . . . . 70 Glu CA . 17047 1
247 . 1 1 75 75 GLU CB C 13 30.42 0.13 . 1 . . . . 70 Glu CB . 17047 1
248 . 1 1 75 75 GLU N N 15 119.28 0.01 . 1 . . . . 70 Glu N . 17047 1
249 . 1 1 76 76 LEU H H 1 8.45 0.01 . 1 . . . . 71 Leu HN . 17047 1
250 . 1 1 76 76 LEU CA C 13 58.19 0.01 . 1 . . . . 71 Leu CA . 17047 1
251 . 1 1 76 76 LEU CB C 13 42.65 0.01 . 1 . . . . 71 Leu CB . 17047 1
252 . 1 1 76 76 LEU N N 15 121.28 0.01 . 1 . . . . 71 Leu N . 17047 1
253 . 1 1 78 78 ASN CA C 13 55.78 0.11 . 1 . . . . 73 Asn CA . 17047 1
254 . 1 1 78 78 ASN CB C 13 38.93 0.17 . 1 . . . . 73 Asn CB . 17047 1
255 . 1 1 79 79 GLU H H 1 8.49 0.01 . 1 . . . . 74 Glu HN . 17047 1
256 . 1 1 79 79 GLU CA C 13 58.93 0.16 . 1 . . . . 74 Glu CA . 17047 1
257 . 1 1 79 79 GLU CB C 13 30.16 0.11 . 1 . . . . 74 Glu CB . 17047 1
258 . 1 1 79 79 GLU N N 15 119.78 0.01 . 1 . . . . 74 Glu N . 17047 1
259 . 1 1 80 80 LEU H H 1 8.07 0.01 . 1 . . . . 75 Leu HN . 17047 1
260 . 1 1 80 80 LEU CA C 13 55.12 0.16 . 1 . . . . 75 Leu CA . 17047 1
261 . 1 1 80 80 LEU CB C 13 43.75 0.22 . 1 . . . . 75 Leu CB . 17047 1
262 . 1 1 80 80 LEU N N 15 113.88 0.01 . 1 . . . . 75 Leu N . 17047 1
263 . 1 1 81 81 GLY H H 1 7.94 0.01 . 1 . . . . 76 Gly HN . 17047 1
264 . 1 1 81 81 GLY CA C 13 47.42 0.13 . 1 . . . . 76 Gly CA . 17047 1
265 . 1 1 81 81 GLY N N 15 108.48 0.01 . 1 . . . . 76 Gly N . 17047 1
266 . 1 1 82 82 VAL H H 1 7.08 0.01 . 1 . . . . 77 Val HN . 17047 1
267 . 1 1 82 82 VAL CA C 13 58.60 0.30 . 1 . . . . 77 Val CA . 17047 1
268 . 1 1 82 82 VAL CB C 13 34.92 0.26 . 1 . . . . 77 Val CB . 17047 1
269 . 1 1 82 82 VAL N N 15 109.68 0.01 . 1 . . . . 77 Val N . 17047 1
270 . 1 1 83 83 GLY H H 1 8.28 0.01 . 1 . . . . 78 Gly HN . 17047 1
271 . 1 1 83 83 GLY CA C 13 44.90 0.01 . 1 . . . . 78 Gly CA . 17047 1
272 . 1 1 83 83 GLY N N 15 105.98 0.04 . 1 . . . . 78 Gly N . 17047 1
273 . 1 1 89 89 ARG H H 1 7.81 0.01 . 1 . . . . 84 Arg HN . 17047 1
274 . 1 1 89 89 ARG CA C 13 59.75 0.01 . 1 . . . . 84 Arg CA . 17047 1
275 . 1 1 89 89 ARG CB C 13 29.41 0.01 . 1 . . . . 84 Arg CB . 17047 1
276 . 1 1 89 89 ARG N N 15 121.68 0.01 . 1 . . . . 84 Arg N . 17047 1
277 . 1 1 90 90 GLY H H 1 7.50 0.01 . 1 . . . . 85 Gly HN . 17047 1
278 . 1 1 90 90 GLY CA C 13 47.46 0.17 . 1 . . . . 85 Gly CA . 17047 1
279 . 1 1 90 90 GLY N N 15 109.18 0.01 . 1 . . . . 85 Gly N . 17047 1
280 . 1 1 91 91 SER H H 1 8.32 0.01 . 1 . . . . 86 Ser HN . 17047 1
281 . 1 1 91 91 SER CA C 13 61.66 0.01 . 1 . . . . 86 Ser CA . 17047 1
282 . 1 1 91 91 SER CB C 13 63.03 0.01 . 1 . . . . 86 Ser CB . 17047 1
283 . 1 1 91 91 SER N N 15 116.18 0.01 . 1 . . . . 86 Ser N . 17047 1
284 . 1 1 93 93 SER CB C 13 62.75 0.11 . 1 . . . . 88 Ser CB . 17047 1
285 . 1 1 94 94 LEU H H 1 8.34 0.01 . 1 . . . . 89 Leu HN . 17047 1
286 . 1 1 94 94 LEU CA C 13 58.21 0.12 . 1 . . . . 89 Leu CA . 17047 1
287 . 1 1 94 94 LEU CB C 13 42.62 0.12 . 1 . . . . 89 Leu CB . 17047 1
288 . 1 1 94 94 LEU N N 15 123.78 0.01 . 1 . . . . 89 Leu N . 17047 1
289 . 1 1 95 95 LYS H H 1 7.82 0.01 . 1 . . . . 90 Lys HN . 17047 1
290 . 1 1 95 95 LYS CA C 13 59.41 0.13 . 1 . . . . 90 Lys CA . 17047 1
291 . 1 1 95 95 LYS CB C 13 32.55 0.01 . 1 . . . . 90 Lys CB . 17047 1
292 . 1 1 95 95 LYS N N 15 117.98 0.01 . 1 . . . . 90 Lys N . 17047 1
293 . 1 1 96 96 ALA H H 1 7.12 0.01 . 1 . . . . 91 Ala HN . 17047 1
294 . 1 1 96 96 ALA CA C 13 52.05 0.11 . 1 . . . . 91 Ala CA . 17047 1
295 . 1 1 96 96 ALA CB C 13 19.68 0.20 . 1 . . . . 91 Ala CB . 17047 1
296 . 1 1 96 96 ALA N N 15 118.18 0.01 . 1 . . . . 91 Ala N . 17047 1
297 . 1 1 97 97 ALA H H 1 7.34 0.01 . 1 . . . . 92 Ala HN . 17047 1
298 . 1 1 97 97 ALA CA C 13 50.66 0.01 . 1 . . . . 92 Ala CA . 17047 1
299 . 1 1 97 97 ALA CB C 13 17.78 0.01 . 1 . . . . 92 Ala CB . 17047 1
300 . 1 1 97 97 ALA N N 15 123.08 0.01 . 1 . . . . 92 Ala N . 17047 1
301 . 1 1 98 98 PRO CA C 13 63.03 0.20 . 1 . . . . 93 Pro CA . 17047 1
302 . 1 1 98 98 PRO CB C 13 32.30 0.16 . 1 . . . . 93 Pro CB . 17047 1
303 . 1 1 99 99 VAL H H 1 8.83 0.01 . 1 . . . . 94 Val HN . 17047 1
304 . 1 1 99 99 VAL CA C 13 66.62 0.12 . 1 . . . . 94 Val CA . 17047 1
305 . 1 1 99 99 VAL CB C 13 31.24 1.47 . 1 . . . . 94 Val CB . 17047 1
306 . 1 1 99 99 VAL N N 15 124.98 0.01 . 1 . . . . 94 Val N . 17047 1
307 . 1 1 100 100 GLU H H 1 9.70 0.01 . 1 . . . . 95 Glu HN . 17047 1
308 . 1 1 100 100 GLU CA C 13 60.20 0.16 . 1 . . . . 95 Glu CA . 17047 1
309 . 1 1 100 100 GLU CB C 13 28.86 0.14 . 1 . . . . 95 Glu CB . 17047 1
310 . 1 1 100 100 GLU N N 15 118.88 0.01 . 1 . . . . 95 Glu N . 17047 1
311 . 1 1 101 101 LEU H H 1 7.29 0.01 . 1 . . . . 96 Leu HN . 17047 1
312 . 1 1 101 101 LEU CA C 13 57.50 0.01 . 1 . . . . 96 Leu CA . 17047 1
313 . 1 1 101 101 LEU CB C 13 42.26 0.01 . 1 . . . . 96 Leu CB . 17047 1
314 . 1 1 101 101 LEU N N 15 117.18 0.01 . 1 . . . . 96 Leu N . 17047 1
315 . 1 1 102 102 ARG H H 1 8.00 0.01 . 1 . . . . 97 Arg HN . 17047 1
316 . 1 1 102 102 ARG CA C 13 61.60 0.14 . 1 . . . . 97 Arg CA . 17047 1
317 . 1 1 102 102 ARG CB C 13 30.37 0.13 . 1 . . . . 97 Arg CB . 17047 1
318 . 1 1 102 102 ARG N N 15 119.38 0.01 . 1 . . . . 97 Arg N . 17047 1
319 . 1 1 103 103 GLN H H 1 8.74 0.01 . 1 . . . . 98 Gln HN . 17047 1
320 . 1 1 103 103 GLN CA C 13 59.29 0.08 . 1 . . . . 98 Gln CA . 17047 1
321 . 1 1 103 103 GLN CB C 13 28.85 0.16 . 1 . . . . 98 Gln CB . 17047 1
322 . 1 1 103 103 GLN N N 15 116.08 0.01 . 1 . . . . 98 Gln N . 17047 1
323 . 1 1 104 104 TRP H H 1 7.50 0.01 . 1 . . . . 99 Trp HN . 17047 1
324 . 1 1 104 104 TRP CA C 13 62.08 0.29 . 1 . . . . 99 Trp CA . 17047 1
325 . 1 1 104 104 TRP CB C 13 28.77 0.21 . 1 . . . . 99 Trp CB . 17047 1
326 . 1 1 104 104 TRP N N 15 121.28 0.01 . 1 . . . . 99 Trp N . 17047 1
327 . 1 1 105 105 LEU H H 1 8.88 0.01 . 1 . . . . 100 Leu HN . 17047 1
328 . 1 1 105 105 LEU CA C 13 57.94 0.20 . 1 . . . . 100 Leu CA . 17047 1
329 . 1 1 105 105 LEU CB C 13 42.92 0.13 . 1 . . . . 100 Leu CB . 17047 1
330 . 1 1 105 105 LEU N N 15 117.38 0.01 . 1 . . . . 100 Leu N . 17047 1
331 . 1 1 106 106 GLU H H 1 8.02 0.01 . 1 . . . . 101 Glu HN . 17047 1
332 . 1 1 106 106 GLU CA C 13 60.32 0.20 . 1 . . . . 101 Glu CA . 17047 1
333 . 1 1 106 106 GLU CB C 13 29.83 0.08 . 1 . . . . 101 Glu CB . 17047 1
334 . 1 1 106 106 GLU N N 15 117.18 0.01 . 1 . . . . 101 Glu N . 17047 1
335 . 1 1 107 107 GLU H H 1 7.44 0.01 . 1 . . . . 102 Glu HN . 17047 1
336 . 1 1 107 107 GLU CA C 13 59.32 0.08 . 1 . . . . 102 Glu CA . 17047 1
337 . 1 1 107 107 GLU CB C 13 29.89 0.18 . 1 . . . . 102 Glu CB . 17047 1
338 . 1 1 107 107 GLU N N 15 117.98 0.01 . 1 . . . . 102 Glu N . 17047 1
339 . 1 1 108 108 VAL H H 1 7.97 0.01 . 1 . . . . 103 Val HN . 17047 1
340 . 1 1 108 108 VAL CA C 13 64.58 0.17 . 1 . . . . 103 Val CA . 17047 1
341 . 1 1 108 108 VAL CB C 13 32.34 0.22 . 1 . . . . 103 Val CB . 17047 1
342 . 1 1 108 108 VAL N N 15 113.18 0.01 . 1 . . . . 103 Val N . 17047 1
343 . 1 1 109 109 LEU H H 1 8.40 0.01 . 1 . . . . 104 Leu HN . 17047 1
344 . 1 1 109 109 LEU CA C 13 56.45 0.17 . 1 . . . . 104 Leu CA . 17047 1
345 . 1 1 109 109 LEU CB C 13 42.76 0.19 . 1 . . . . 104 Leu CB . 17047 1
346 . 1 1 109 109 LEU N N 15 117.28 0.01 . 1 . . . . 104 Leu N . 17047 1
347 . 1 1 110 110 LEU H H 1 7.06 0.01 . 1 . . . . 105 Leu HN . 17047 1
348 . 1 1 110 110 LEU CA C 13 55.28 0.14 . 1 . . . . 105 Leu CA . 17047 1
349 . 1 1 110 110 LEU CB C 13 41.34 0.01 . 1 . . . . 105 Leu CB . 17047 1
350 . 1 1 110 110 LEU N N 15 114.98 0.01 . 1 . . . . 105 Leu N . 17047 1
351 . 1 1 111 111 LYS H H 1 7.21 0.01 . 1 . . . . 106 Lys HN . 17047 1
352 . 1 1 111 111 LYS CA C 13 56.67 0.11 . 1 . . . . 106 Lys CA . 17047 1
353 . 1 1 111 111 LYS CB C 13 32.75 0.02 . 1 . . . . 106 Lys CB . 17047 1
354 . 1 1 111 111 LYS N N 15 119.18 0.01 . 1 . . . . 106 Lys N . 17047 1
355 . 1 1 112 112 SER H H 1 8.13 0.01 . 1 . . . . 107 Ser HN . 17047 1
356 . 1 1 112 112 SER CA C 13 58.23 0.17 . 1 . . . . 107 Ser CA . 17047 1
357 . 1 1 112 112 SER CB C 13 64.49 0.10 . 1 . . . . 107 Ser CB . 17047 1
358 . 1 1 112 112 SER N N 15 117.38 0.01 . 1 . . . . 107 Ser N . 17047 1
359 . 1 1 113 113 ASP H H 1 7.95 0.01 . 1 . . . . 108 Asp HN . 17047 1
360 . 1 1 113 113 ASP CA C 13 55.89 0.01 . 1 . . . . 108 Asp CA . 17047 1
361 . 1 1 113 113 ASP CB C 13 42.31 0.01 . 1 . . . . 108 Asp CB . 17047 1
362 . 1 1 113 113 ASP N N 15 127.68 0.01 . 1 . . . . 108 Asp N . 17047 1
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