Content for NMR-STAR saveframe, "chem_shift_list_1"
save_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 6863
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing
_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 unknown 1 $NC_labeled_fragment isotropic 6863 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 4 4 MET HA H 1 4.4580 0.02 . . . . . . 1 MET HA . 6863 1
2 . 1 1 4 4 MET HG2 H 1 2.5790 0.02 . . . . . . 1 MET HG . 6863 1
3 . 1 1 4 4 MET HG3 H 1 2.5790 0.02 . . . . . . 1 MET HG . 6863 1
4 . 1 1 4 4 MET C C 13 175.7310 0.1 . . . . . . 1 MET C . 6863 1
5 . 1 1 4 4 MET CA C 13 55.3140 0.1 . . . . . . 1 MET CA . 6863 1
6 . 1 1 4 4 MET CG C 13 31.9630 0.1 . . . . . . 1 MET CG . 6863 1
7 . 1 1 5 5 ALA H H 1 8.3230 0.02 . . . . . . 2 ALA H . 6863 1
8 . 1 1 5 5 ALA HB1 H 1 1.4120 0.02 . . . . . . 2 ALA HB . 6863 1
9 . 1 1 5 5 ALA HB2 H 1 1.4120 0.02 . . . . . . 2 ALA HB . 6863 1
10 . 1 1 5 5 ALA HB3 H 1 1.4120 0.02 . . . . . . 2 ALA HB . 6863 1
11 . 1 1 5 5 ALA C C 13 176.9140 0.1 . . . . . . 2 ALA C . 6863 1
12 . 1 1 5 5 ALA CA C 13 52.7588 0.1 . . . . . . 2 ALA CA . 6863 1
13 . 1 1 5 5 ALA CB C 13 19.4490 0.1 . . . . . . 2 ALA CB . 6863 1
14 . 1 1 5 5 ALA N N 15 126.2109 0.1 . . . . . . 2 ALA N . 6863 1
15 . 1 1 6 6 THR H H 1 7.7622 0.02 . . . . . . 3 THR H . 6863 1
16 . 1 1 6 6 THR CA C 13 63.0996 0.1 . . . . . . 3 THR CA . 6863 1
17 . 1 1 6 6 THR N N 15 118.9108 0.1 . . . . . . 3 THR N . 6863 1
18 . 1 1 7 7 THR HA H 1 4.2430 0.02 . . . . . . 4 THR HA . 6863 1
19 . 1 1 7 7 THR C C 13 174.5390 0.1 . . . . . . 4 THR C . 6863 1
20 . 1 1 7 7 THR CA C 13 62.1991 0.1 . . . . . . 4 THR CA . 6863 1
21 . 1 1 7 7 THR CB C 13 69.8060 0.1 . . . . . . 4 THR CB . 6863 1
22 . 1 1 7 7 THR CG2 C 13 22.0240 0.1 . . . . . . 4 THR CG2 . 6863 1
23 . 1 1 8 8 MET H H 1 8.5587 0.02 . . . . . . 5 MET H . 6863 1
24 . 1 1 8 8 MET HA H 1 4.4410 0.02 . . . . . . 5 MET HA . 6863 1
25 . 1 1 8 8 MET HB2 H 1 2.0380 0.02 . . . . . . 5 MET HB . 6863 1
26 . 1 1 8 8 MET HB3 H 1 2.0380 0.02 . . . . . . 5 MET HB . 6863 1
27 . 1 1 8 8 MET HG2 H 1 2.5310 0.02 . . . . . . 5 MET HG . 6863 1
28 . 1 1 8 8 MET HG3 H 1 2.5310 0.02 . . . . . . 5 MET HG . 6863 1
29 . 1 1 8 8 MET C C 13 176.2010 0.1 . . . . . . 5 MET C . 6863 1
30 . 1 1 8 8 MET CA C 13 56.0939 0.1 . . . . . . 5 MET CA . 6863 1
31 . 1 1 8 8 MET CB C 13 34.0130 0.1 . . . . . . 5 MET CB . 6863 1
32 . 1 1 8 8 MET CG C 13 31.9140 0.1 . . . . . . 5 MET CG . 6863 1
33 . 1 1 8 8 MET N N 15 122.9616 0.1 . . . . . . 5 MET N . 6863 1
34 . 1 1 9 9 GLU H H 1 8.7050 0.02 . . . . . . 6 GLU H . 6863 1
35 . 1 1 9 9 GLU HA H 1 4.2020 0.02 . . . . . . 6 GLU HA . 6863 1
36 . 1 1 9 9 GLU HB2 H 1 1.9260 0.02 . . . . . . 6 GLU HB . 6863 1
37 . 1 1 9 9 GLU HB3 H 1 1.9260 0.02 . . . . . . 6 GLU HB . 6863 1
38 . 1 1 9 9 GLU HG2 H 1 2.2790 0.02 . . . . . . 6 GLU HG . 6863 1
39 . 1 1 9 9 GLU HG3 H 1 2.2790 0.02 . . . . . . 6 GLU HG . 6863 1
40 . 1 1 9 9 GLU C C 13 176.4350 0.1 . . . . . . 6 GLU C . 6863 1
41 . 1 1 9 9 GLU CA C 13 57.5922 0.1 . . . . . . 6 GLU CA . 6863 1
42 . 1 1 9 9 GLU CB C 13 29.5590 0.1 . . . . . . 6 GLU CB . 6863 1
43 . 1 1 9 9 GLU CG C 13 36.4580 0.1 . . . . . . 6 GLU CG . 6863 1
44 . 1 1 9 9 GLU N N 15 121.6054 0.1 . . . . . . 6 GLU N . 6863 1
45 . 1 1 10 10 GLN H H 1 8.2315 0.02 . . . . . . 7 GLN H . 6863 1
46 . 1 1 10 10 GLN HA H 1 4.3820 0.02 . . . . . . 7 GLN HA . 6863 1
47 . 1 1 10 10 GLN HB2 H 1 1.9890 0.02 . . . . . . 7 GLN HB . 6863 1
48 . 1 1 10 10 GLN HB3 H 1 1.9890 0.02 . . . . . . 7 GLN HB . 6863 1
49 . 1 1 10 10 GLN HG2 H 1 2.3590 0.02 . . . . . . 7 GLN HG . 6863 1
50 . 1 1 10 10 GLN HG3 H 1 2.3590 0.02 . . . . . . 7 GLN HG . 6863 1
51 . 1 1 10 10 GLN HE21 H 1 7.6200 0.02 . . . . . . 7 GLN HE21 . 6863 1
52 . 1 1 10 10 GLN HE22 H 1 6.8900 0.02 . . . . . . 7 GLN HE22 . 6863 1
53 . 1 1 10 10 GLN C C 13 175.7120 0.1 . . . . . . 7 GLN C . 6863 1
54 . 1 1 10 10 GLN CA C 13 55.8254 0.1 . . . . . . 7 GLN CA . 6863 1
55 . 1 1 10 10 GLN CB C 13 29.4620 0.1 . . . . . . 7 GLN CB . 6863 1
56 . 1 1 10 10 GLN CG C 13 34.1390 0.1 . . . . . . 7 GLN CG . 6863 1
57 . 1 1 10 10 GLN N N 15 119.1992 0.1 . . . . . . 7 GLN N . 6863 1
58 . 1 1 10 10 GLN NE2 N 15 112.3170 0.1 . . . . . . 7 GLN NE2 . 6863 1
59 . 1 1 11 11 GLU H H 1 8.3746 0.02 . . . . . . 8 GLU H . 6863 1
60 . 1 1 11 11 GLU HA H 1 4.3830 0.02 . . . . . . 8 GLU HA . 6863 1
61 . 1 1 11 11 GLU HB2 H 1 1.9510 0.02 . . . . . . 8 GLU HB . 6863 1
62 . 1 1 11 11 GLU HB3 H 1 1.9510 0.02 . . . . . . 8 GLU HB . 6863 1
63 . 1 1 11 11 GLU HG2 H 1 2.2960 0.02 . . . . . . 8 GLU HG . 6863 1
64 . 1 1 11 11 GLU HG3 H 1 2.2960 0.02 . . . . . . 8 GLU HG . 6863 1
65 . 1 1 11 11 GLU C C 13 175.3900 0.1 . . . . . . 8 GLU C . 6863 1
66 . 1 1 11 11 GLU CA C 13 56.8195 0.1 . . . . . . 8 GLU CA . 6863 1
67 . 1 1 11 11 GLU CB C 13 30.3010 0.1 . . . . . . 8 GLU CB . 6863 1
68 . 1 1 11 11 GLU CG C 13 36.5320 0.1 . . . . . . 8 GLU CG . 6863 1
69 . 1 1 11 11 GLU N N 15 122.1443 0.1 . . . . . . 8 GLU N . 6863 1
70 . 1 1 12 12 ILE H H 1 8.0195 0.02 . . . . . . 9 ILE H . 6863 1
71 . 1 1 12 12 ILE HA H 1 4.6150 0.02 . . . . . . 9 ILE HA . 6863 1
72 . 1 1 12 12 ILE HB H 1 1.7960 0.02 . . . . . . 9 ILE HB . 6863 1
73 . 1 1 12 12 ILE HG12 H 1 1.3260 0.02 . . . . . . 9 ILE HG11 . 6863 1
74 . 1 1 12 12 ILE HG21 H 1 0.8830 0.02 . . . . . . 9 ILE HG2 . 6863 1
75 . 1 1 12 12 ILE HG22 H 1 0.8830 0.02 . . . . . . 9 ILE HG2 . 6863 1
76 . 1 1 12 12 ILE HG23 H 1 0.8830 0.02 . . . . . . 9 ILE HG2 . 6863 1
77 . 1 1 12 12 ILE C C 13 176.1080 0.1 . . . . . . 9 ILE C . 6863 1
78 . 1 1 12 12 ILE CA C 13 58.7019 0.1 . . . . . . 9 ILE CA . 6863 1
79 . 1 1 12 12 ILE CB C 13 38.9240 0.1 . . . . . . 9 ILE CB . 6863 1
80 . 1 1 12 12 ILE CG1 C 13 26.3540 0.1 . . . . . . 9 ILE CG1 . 6863 1
81 . 1 1 12 12 ILE CG2 C 13 17.2800 0.1 . . . . . . 9 ILE CG2 . 6863 1
82 . 1 1 12 12 ILE CD1 C 13 11.5550 0.1 . . . . . . 9 ILE CD1 . 6863 1
83 . 1 1 12 12 ILE N N 15 121.0135 0.1 . . . . . . 9 ILE N . 6863 1
84 . 1 1 13 13 CYS H H 1 9.1246 0.02 . . . . . . 10 CYS H . 6863 1
85 . 1 1 13 13 CYS HA H 1 4.5750 0.02 . . . . . . 10 CYS HA . 6863 1
86 . 1 1 13 13 CYS HB2 H 1 3.5080 0.02 . . . . . . 10 CYS HB1 . 6863 1
87 . 1 1 13 13 CYS HB3 H 1 1.8750 0.02 . . . . . . 10 CYS HB2 . 6863 1
88 . 1 1 13 13 CYS C C 13 177.2190 0.1 . . . . . . 10 CYS C . 6863 1
89 . 1 1 13 13 CYS CA C 13 58.0730 0.1 . . . . . . 10 CYS CA . 6863 1
90 . 1 1 13 13 CYS CB C 13 32.9990 0.1 . . . . . . 10 CYS CB . 6863 1
91 . 1 1 13 13 CYS N N 15 126.6502 0.1 . . . . . . 10 CYS N . 6863 1
92 . 1 1 14 14 ALA H H 1 8.3039 0.02 . . . . . . 11 ALA H . 6863 1
93 . 1 1 14 14 ALA HA H 1 4.0120 0.02 . . . . . . 11 ALA HA . 6863 1
94 . 1 1 14 14 ALA HB1 H 1 0.9890 0.02 . . . . . . 11 ALA HB . 6863 1
95 . 1 1 14 14 ALA HB2 H 1 0.9890 0.02 . . . . . . 11 ALA HB . 6863 1
96 . 1 1 14 14 ALA HB3 H 1 0.9890 0.02 . . . . . . 11 ALA HB . 6863 1
97 . 1 1 14 14 ALA C C 13 177.9280 0.1 . . . . . . 11 ALA C . 6863 1
98 . 1 1 14 14 ALA CA C 13 53.8434 0.1 . . . . . . 11 ALA CA . 6863 1
99 . 1 1 14 14 ALA CB C 13 18.6780 0.1 . . . . . . 11 ALA CB . 6863 1
100 . 1 1 14 14 ALA N N 15 121.8515 0.1 . . . . . . 11 ALA N . 6863 1
101 . 1 1 15 15 HIS H H 1 10.4021 0.02 . . . . . . 12 HIS H . 6863 1
102 . 1 1 15 15 HIS HA H 1 4.6130 0.02 . . . . . . 12 HIS HA . 6863 1
103 . 1 1 15 15 HIS HB2 H 1 3.4990 0.02 . . . . . . 12 HIS HB1 . 6863 1
104 . 1 1 15 15 HIS HB3 H 1 2.8650 0.02 . . . . . . 12 HIS HB2 . 6863 1
105 . 1 1 15 15 HIS C C 13 174.6860 0.1 . . . . . . 12 HIS C . 6863 1
106 . 1 1 15 15 HIS CA C 13 56.5032 0.1 . . . . . . 12 HIS CA . 6863 1
107 . 1 1 15 15 HIS CB C 13 29.6910 0.1 . . . . . . 12 HIS CB . 6863 1
108 . 1 1 15 15 HIS N N 15 122.0227 0.1 . . . . . . 12 HIS N . 6863 1
109 . 1 1 16 16 SER H H 1 8.1952 0.02 . . . . . . 13 SER H . 6863 1
110 . 1 1 16 16 SER HA H 1 4.1430 0.02 . . . . . . 13 SER HA . 6863 1
111 . 1 1 16 16 SER HB2 H 1 3.8130 0.02 . . . . . . 13 SER HB . 6863 1
112 . 1 1 16 16 SER HB3 H 1 3.8130 0.02 . . . . . . 13 SER HB . 6863 1
113 . 1 1 16 16 SER C C 13 173.0810 0.1 . . . . . . 13 SER C . 6863 1
114 . 1 1 16 16 SER CA C 13 59.6133 0.1 . . . . . . 13 SER CA . 6863 1
115 . 1 1 16 16 SER N N 15 112.0382 0.1 . . . . . . 13 SER N . 6863 1
116 . 1 1 17 17 MET H H 1 7.5764 0.02 . . . . . . 14 MET H . 6863 1
117 . 1 1 17 17 MET HA H 1 4.8050 0.02 . . . . . . 14 MET HA . 6863 1
118 . 1 1 17 17 MET HB2 H 1 2.0930 0.02 . . . . . . 14 MET HB2 . 6863 1
119 . 1 1 17 17 MET HG2 H 1 2.4650 0.02 . . . . . . 14 MET HG1 . 6863 1
120 . 1 1 17 17 MET C C 13 174.2290 0.1 . . . . . . 14 MET C . 6863 1
121 . 1 1 17 17 MET CA C 13 53.8394 0.1 . . . . . . 14 MET CA . 6863 1
122 . 1 1 17 17 MET CB C 13 34.5320 0.1 . . . . . . 14 MET CB . 6863 1
123 . 1 1 17 17 MET CG C 13 32.4970 0.1 . . . . . . 14 MET CG . 6863 1
124 . 1 1 17 17 MET N N 15 119.1478 0.1 . . . . . . 14 MET N . 6863 1
125 . 1 1 18 18 THR H H 1 8.4788 0.02 . . . . . . 15 THR H . 6863 1
126 . 1 1 18 18 THR HA H 1 4.7790 0.02 . . . . . . 15 THR HA . 6863 1
127 . 1 1 18 18 THR HB H 1 4.5210 0.02 . . . . . . 15 THR HB . 6863 1
128 . 1 1 18 18 THR HG21 H 1 1.3190 0.02 . . . . . . 15 THR HG2 . 6863 1
129 . 1 1 18 18 THR HG22 H 1 1.3190 0.02 . . . . . . 15 THR HG2 . 6863 1
130 . 1 1 18 18 THR HG23 H 1 1.3190 0.02 . . . . . . 15 THR HG2 . 6863 1
131 . 1 1 18 18 THR C C 13 176.3700 0.1 . . . . . . 15 THR C . 6863 1
132 . 1 1 18 18 THR CA C 13 62.5555 0.1 . . . . . . 15 THR CA . 6863 1
133 . 1 1 18 18 THR CB C 13 69.6490 0.1 . . . . . . 15 THR CB . 6863 1
134 . 1 1 18 18 THR CG2 C 13 22.6920 0.1 . . . . . . 15 THR CG2 . 6863 1
135 . 1 1 18 18 THR N N 15 112.1471 0.1 . . . . . . 15 THR N . 6863 1
136 . 1 1 19 19 PHE H H 1 8.4929 0.02 . . . . . . 16 PHE H . 6863 1
137 . 1 1 19 19 PHE HA H 1 3.8350 0.02 . . . . . . 16 PHE HA . 6863 1
138 . 1 1 19 19 PHE HB2 H 1 2.9970 0.02 . . . . . . 16 PHE HB . 6863 1
139 . 1 1 19 19 PHE HB3 H 1 2.9970 0.02 . . . . . . 16 PHE HB . 6863 1
140 . 1 1 19 19 PHE C C 13 177.3860 0.1 . . . . . . 16 PHE C . 6863 1
141 . 1 1 19 19 PHE CA C 13 63.0474 0.1 . . . . . . 16 PHE CA . 6863 1
142 . 1 1 19 19 PHE CB C 13 39.3080 0.1 . . . . . . 16 PHE CB . 6863 1
143 . 1 1 19 19 PHE N N 15 122.7605 0.1 . . . . . . 16 PHE N . 6863 1
144 . 1 1 20 20 GLU H H 1 8.4305 0.02 . . . . . . 17 GLU H . 6863 1
145 . 1 1 20 20 GLU HA H 1 4.0410 0.02 . . . . . . 17 GLU HA . 6863 1
146 . 1 1 20 20 GLU HB2 H 1 1.9800 0.02 . . . . . . 17 GLU HB . 6863 1
147 . 1 1 20 20 GLU HB3 H 1 1.9800 0.02 . . . . . . 17 GLU HB . 6863 1
148 . 1 1 20 20 GLU HG2 H 1 2.3190 0.02 . . . . . . 17 GLU HG . 6863 1
149 . 1 1 20 20 GLU HG3 H 1 2.3190 0.02 . . . . . . 17 GLU HG . 6863 1
150 . 1 1 20 20 GLU C C 13 177.4210 0.1 . . . . . . 17 GLU C . 6863 1
151 . 1 1 20 20 GLU CA C 13 58.7637 0.1 . . . . . . 17 GLU CA . 6863 1
152 . 1 1 20 20 GLU CB C 13 29.3360 0.1 . . . . . . 17 GLU CB . 6863 1
153 . 1 1 20 20 GLU CG C 13 36.6350 0.1 . . . . . . 17 GLU CG . 6863 1
154 . 1 1 20 20 GLU N N 15 112.9497 0.1 . . . . . . 17 GLU N . 6863 1
155 . 1 1 21 21 GLU H H 1 7.5236 0.02 . . . . . . 18 GLU H . 6863 1
156 . 1 1 21 21 GLU HA H 1 4.2310 0.02 . . . . . . 18 GLU HA . 6863 1
157 . 1 1 21 21 GLU HB2 H 1 1.9070 0.02 . . . . . . 18 GLU HB . 6863 1
158 . 1 1 21 21 GLU HB3 H 1 1.9070 0.02 . . . . . . 18 GLU HB . 6863 1
159 . 1 1 21 21 GLU HG2 H 1 2.2380 0.02 . . . . . . 18 GLU HG . 6863 1
160 . 1 1 21 21 GLU HG3 H 1 2.2380 0.02 . . . . . . 18 GLU HG . 6863 1
161 . 1 1 21 21 GLU C C 13 176.0450 0.1 . . . . . . 18 GLU C . 6863 1
162 . 1 1 21 21 GLU CA C 13 56.2104 0.1 . . . . . . 18 GLU CA . 6863 1
163 . 1 1 21 21 GLU CB C 13 30.8950 0.1 . . . . . . 18 GLU CB . 6863 1
164 . 1 1 21 21 GLU CG C 13 36.8960 0.1 . . . . . . 18 GLU CG . 6863 1
165 . 1 1 21 21 GLU N N 15 116.7564 0.1 . . . . . . 18 GLU N . 6863 1
166 . 1 1 22 22 CYS H H 1 7.7923 0.02 . . . . . . 19 CYS H . 6863 1
167 . 1 1 22 22 CYS CA C 13 57.2819 0.1 . . . . . . 19 CYS CA . 6863 1
168 . 1 1 22 22 CYS N N 15 124.7482 0.1 . . . . . . 19 CYS N . 6863 1
169 . 1 1 23 23 PRO HA H 1 4.3870 0.02 . . . . . . 20 PRO HA . 6863 1
170 . 1 1 23 23 PRO HB2 H 1 1.9600 0.02 . . . . . . 20 PRO HB . 6863 1
171 . 1 1 23 23 PRO HB3 H 1 1.9600 0.02 . . . . . . 20 PRO HB . 6863 1
172 . 1 1 23 23 PRO HG2 H 1 2.3210 0.02 . . . . . . 20 PRO HG . 6863 1
173 . 1 1 23 23 PRO HG3 H 1 2.3210 0.02 . . . . . . 20 PRO HG . 6863 1
174 . 1 1 23 23 PRO HD2 H 1 4.0280 0.02 . . . . . . 20 PRO HD . 6863 1
175 . 1 1 23 23 PRO HD3 H 1 4.0280 0.02 . . . . . . 20 PRO HD . 6863 1
176 . 1 1 23 23 PRO C C 13 177.7330 0.1 . . . . . . 20 PRO C . 6863 1
177 . 1 1 23 23 PRO CA C 13 64.3919 0.1 . . . . . . 20 PRO CA . 6863 1
178 . 1 1 23 23 PRO CB C 13 32.2250 0.1 . . . . . . 20 PRO CB . 6863 1
179 . 1 1 23 23 PRO CG C 13 27.3020 0.1 . . . . . . 20 PRO CG . 6863 1
180 . 1 1 23 23 PRO CD C 13 51.1640 0.1 . . . . . . 20 PRO CD . 6863 1
181 . 1 1 24 24 LYS H H 1 8.4054 0.02 . . . . . . 21 LYS H . 6863 1
182 . 1 1 24 24 LYS HA H 1 4.2620 0.02 . . . . . . 21 LYS HA . 6863 1
183 . 1 1 24 24 LYS HB2 H 1 1.2040 0.02 . . . . . . 21 LYS HB . 6863 1
184 . 1 1 24 24 LYS HB3 H 1 1.2040 0.02 . . . . . . 21 LYS HB . 6863 1
185 . 1 1 24 24 LYS HG2 H 1 1.7090 0.02 . . . . . . 21 LYS HG . 6863 1
186 . 1 1 24 24 LYS HG3 H 1 1.7090 0.02 . . . . . . 21 LYS HG . 6863 1
187 . 1 1 24 24 LYS HD2 H 1 1.3720 0.02 . . . . . . 21 LYS HD . 6863 1
188 . 1 1 24 24 LYS HD3 H 1 1.3720 0.02 . . . . . . 21 LYS HD . 6863 1
189 . 1 1 24 24 LYS HE2 H 1 2.8290 0.02 . . . . . . 21 LYS HE . 6863 1
190 . 1 1 24 24 LYS HE3 H 1 2.8290 0.02 . . . . . . 21 LYS HE . 6863 1
191 . 1 1 24 24 LYS C C 13 178.7070 0.1 . . . . . . 21 LYS C . 6863 1
192 . 1 1 24 24 LYS CA C 13 58.2638 0.1 . . . . . . 21 LYS CA . 6863 1
193 . 1 1 24 24 LYS CB C 13 33.8440 0.1 . . . . . . 21 LYS CB . 6863 1
194 . 1 1 24 24 LYS CG C 13 28.7900 0.1 . . . . . . 21 LYS CG . 6863 1
195 . 1 1 24 24 LYS CD C 13 25.2680 0.1 . . . . . . 21 LYS CD . 6863 1
196 . 1 1 24 24 LYS CE C 13 42.0960 0.1 . . . . . . 21 LYS CE . 6863 1
197 . 1 1 24 24 LYS N N 15 119.8126 0.1 . . . . . . 21 LYS N . 6863 1
198 . 1 1 25 25 CYS H H 1 9.1101 0.02 . . . . . . 22 CYS H . 6863 1
199 . 1 1 25 25 CYS HA H 1 4.2440 0.02 . . . . . . 22 CYS HA . 6863 1
200 . 1 1 25 25 CYS HB2 H 1 3.1010 0.02 . . . . . . 22 CYS HB1 . 6863 1
201 . 1 1 25 25 CYS HB3 H 1 2.5290 0.02 . . . . . . 22 CYS HB2 . 6863 1
202 . 1 1 25 25 CYS C C 13 176.7620 0.1 . . . . . . 22 CYS C . 6863 1
203 . 1 1 25 25 CYS CA C 13 63.1041 0.1 . . . . . . 22 CYS CA . 6863 1
204 . 1 1 25 25 CYS CB C 13 29.4380 0.1 . . . . . . 22 CYS CB . 6863 1
205 . 1 1 25 25 CYS N N 15 122.5700 0.1 . . . . . . 22 CYS N . 6863 1
206 . 1 1 26 26 SER H H 1 8.0107 0.02 . . . . . . 23 SER H . 6863 1
207 . 1 1 26 26 SER HA H 1 4.3390 0.02 . . . . . . 23 SER HA . 6863 1
208 . 1 1 26 26 SER HB2 H 1 3.9370 0.02 . . . . . . 23 SER HB . 6863 1
209 . 1 1 26 26 SER HB3 H 1 3.9370 0.02 . . . . . . 23 SER HB . 6863 1
210 . 1 1 26 26 SER C C 13 174.9140 0.1 . . . . . . 23 SER C . 6863 1
211 . 1 1 26 26 SER CA C 13 59.7750 0.1 . . . . . . 23 SER CA . 6863 1
212 . 1 1 26 26 SER CB C 13 63.7150 0.1 . . . . . . 23 SER CB . 6863 1
213 . 1 1 26 26 SER N N 15 113.7010 0.1 . . . . . . 23 SER N . 6863 1
214 . 1 1 27 27 ALA H H 1 7.4780 0.02 . . . . . . 24 ALA H . 6863 1
215 . 1 1 27 27 ALA HB1 H 1 1.3740 0.02 . . . . . . 24 ALA HB . 6863 1
216 . 1 1 27 27 ALA HB2 H 1 1.3740 0.02 . . . . . . 24 ALA HB . 6863 1
217 . 1 1 27 27 ALA HB3 H 1 1.3740 0.02 . . . . . . 24 ALA HB . 6863 1
218 . 1 1 27 27 ALA C C 13 177.5730 0.1 . . . . . . 24 ALA C . 6863 1
219 . 1 1 27 27 ALA CA C 13 52.6567 0.1 . . . . . . 24 ALA CA . 6863 1
220 . 1 1 27 27 ALA CB C 13 19.1720 0.1 . . . . . . 24 ALA CB . 6863 1
221 . 1 1 27 27 ALA N N 15 123.8456 0.1 . . . . . . 24 ALA N . 6863 1
222 . 1 1 28 28 LEU H H 1 7.7929 0.02 . . . . . . 25 LEU H . 6863 1
223 . 1 1 28 28 LEU HA H 1 4.2490 0.02 . . . . . . 25 LEU HA . 6863 1
224 . 1 1 28 28 LEU HB2 H 1 1.7230 0.02 . . . . . . 25 LEU HB1 . 6863 1
225 . 1 1 28 28 LEU HB3 H 1 1.4710 0.02 . . . . . . 25 LEU HB2 . 6863 1
226 . 1 1 28 28 LEU HD11 H 1 0.9700 0.02 . . . . . . 25 LEU HD1 . 6863 1
227 . 1 1 28 28 LEU HD12 H 1 0.9700 0.02 . . . . . . 25 LEU HD1 . 6863 1
228 . 1 1 28 28 LEU HD13 H 1 0.9700 0.02 . . . . . . 25 LEU HD1 . 6863 1
229 . 1 1 28 28 LEU HD21 H 1 0.8690 0.02 . . . . . . 25 LEU HD2 . 6863 1
230 . 1 1 28 28 LEU HD22 H 1 0.8690 0.02 . . . . . . 25 LEU HD2 . 6863 1
231 . 1 1 28 28 LEU HD23 H 1 0.8690 0.02 . . . . . . 25 LEU HD2 . 6863 1
232 . 1 1 28 28 LEU C C 13 176.9310 0.1 . . . . . . 25 LEU C . 6863 1
233 . 1 1 28 28 LEU CA C 13 55.3152 0.1 . . . . . . 25 LEU CA . 6863 1
234 . 1 1 28 28 LEU CB C 13 42.0820 0.1 . . . . . . 25 LEU CB . 6863 1
235 . 1 1 28 28 LEU CG C 13 26.8720 0.1 . . . . . . 25 LEU CG . 6863 1
236 . 1 1 28 28 LEU CD1 C 13 25.1690 0.1 . . . . . . 25 LEU CD1 . 6863 1
237 . 1 1 28 28 LEU CD2 C 13 23.2240 0.1 . . . . . . 25 LEU CD2 . 6863 1
238 . 1 1 28 28 LEU N N 15 119.9935 0.1 . . . . . . 25 LEU N . 6863 1
239 . 1 1 29 29 GLN H H 1 8.0080 0.02 . . . . . . 26 GLN H . 6863 1
240 . 1 1 29 29 GLN HA H 1 4.2820 0.02 . . . . . . 26 GLN HA . 6863 1
241 . 1 1 29 29 GLN HB2 H 1 1.8830 0.02 . . . . . . 26 GLN HB . 6863 1
242 . 1 1 29 29 GLN HB3 H 1 1.8830 0.02 . . . . . . 26 GLN HB . 6863 1
243 . 1 1 29 29 GLN HG2 H 1 2.2480 0.02 . . . . . . 26 GLN HG . 6863 1
244 . 1 1 29 29 GLN HG3 H 1 2.2480 0.02 . . . . . . 26 GLN HG . 6863 1
245 . 1 1 29 29 GLN HE21 H 1 7.4900 0.02 . . . . . . 26 GLN HE21 . 6863 1
246 . 1 1 29 29 GLN HE22 H 1 6.7900 0.02 . . . . . . 26 GLN HE22 . 6863 1
247 . 1 1 29 29 GLN C C 13 174.5590 0.1 . . . . . . 26 GLN C . 6863 1
248 . 1 1 29 29 GLN CA C 13 55.4965 0.1 . . . . . . 26 GLN CA . 6863 1
249 . 1 1 29 29 GLN CB C 13 29.3900 0.1 . . . . . . 26 GLN CB . 6863 1
250 . 1 1 29 29 GLN CG C 13 33.8130 0.1 . . . . . . 26 GLN CG . 6863 1
251 . 1 1 29 29 GLN N N 15 120.0996 0.1 . . . . . . 26 GLN N . 6863 1
252 . 1 1 29 29 GLN NE2 N 15 112.2700 0.1 . . . . . . 26 GLN NE2 . 6863 1
253 . 1 1 30 30 TYR H H 1 7.6793 0.02 . . . . . . 27 TYR H . 6863 1
254 . 1 1 30 30 TYR N N 15 126.3568 0.1 . . . . . . 27 TYR N . 6863 1
255 . 1 1 32 32 ASN HB2 H 1 2.7560 0.02 . . . . . . 29 ASN HB1 . 6863 1
256 . 1 1 32 32 ASN C C 13 175.4120 0.1 . . . . . . 29 ASN C . 6863 1
257 . 1 1 32 32 ASN CA C 13 53.6287 0.1 . . . . . . 29 ASN CA . 6863 1
258 . 1 1 33 33 GLY H H 1 8.1438 0.02 . . . . . . 30 GLY H . 6863 1
259 . 1 1 33 33 GLY HA2 H 1 3.8350 0.02 . . . . . . 30 GLY HA . 6863 1
260 . 1 1 33 33 GLY HA3 H 1 3.8350 0.02 . . . . . . 30 GLY HA . 6863 1
261 . 1 1 33 33 GLY C C 13 173.5370 0.1 . . . . . . 30 GLY C . 6863 1
262 . 1 1 33 33 GLY CA C 13 45.4198 0.1 . . . . . . 30 GLY CA . 6863 1
263 . 1 1 33 33 GLY N N 15 108.7560 0.1 . . . . . . 30 GLY N . 6863 1
264 . 1 1 34 34 PHE H H 1 7.9605 0.02 . . . . . . 31 PHE H . 6863 1
265 . 1 1 34 34 PHE HA H 1 4.5660 0.02 . . . . . . 31 PHE HA . 6863 1
266 . 1 1 34 34 PHE HB2 H 1 3.0270 0.02 . . . . . . 31 PHE HB . 6863 1
267 . 1 1 34 34 PHE HB3 H 1 3.0270 0.02 . . . . . . 31 PHE HB . 6863 1
268 . 1 1 34 34 PHE C C 13 174.4410 0.1 . . . . . . 31 PHE C . 6863 1
269 . 1 1 34 34 PHE CA C 13 57.8795 0.1 . . . . . . 31 PHE CA . 6863 1
270 . 1 1 34 34 PHE N N 15 119.8992 0.1 . . . . . . 31 PHE N . 6863 1
271 . 1 1 35 35 TYR H H 1 7.6091 0.02 . . . . . . 32 TYR H . 6863 1
272 . 1 1 35 35 TYR CA C 13 59.2278 0.1 . . . . . . 32 TYR CA . 6863 1
273 . 1 1 35 35 TYR N N 15 125.7152 0.1 . . . . . . 32 TYR N . 6863 1
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