Content for NMR-STAR saveframe, "shift_set_1"
save_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shift_set_1
_Assigned_chem_shift_list.Entry_ID 5403
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 TROSY 1 $sample_1 . 5403 1
2 TROSY-HNCA 1 $sample_1 . 5403 1
3 TROSY-HN(CO)CA 1 $sample_1 . 5403 1
4 TROSY-HNCACB 1 $sample_1 . 5403 1
5 TROSY-HNCO 1 $sample_1 . 5403 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 8 8 VAL H H 1 7.8960 0.0153 . 1 . . . . . 8 VAL H . 5403 1
2 . 1 . 1 8 8 VAL C C 13 179.1400 0.0000 . 1 . . . . . 8 VAL C . 5403 1
3 . 1 . 1 8 8 VAL CA C 13 58.6250 0.3660 . 1 . . . . . 8 VAL CA . 5403 1
4 . 1 . 1 8 8 VAL N N 15 115.3860 0.0578 . 1 . . . . . 8 VAL N . 5403 1
5 . 1 . 1 9 9 VAL H H 1 8.5410 0.0153 . 1 . . . . . 9 VAL H . 5403 1
6 . 1 . 1 9 9 VAL C C 13 177.9188 0.0000 . 1 . . . . . 9 VAL C . 5403 1
7 . 1 . 1 9 9 VAL CA C 13 61.4830 0.3660 . 1 . . . . . 9 VAL CA . 5403 1
8 . 1 . 1 9 9 VAL CB C 13 33.9580 2.1390 . 1 . . . . . 9 VAL CB . 5403 1
9 . 1 . 1 9 9 VAL N N 15 124.9350 0.0578 . 1 . . . . . 9 VAL N . 5403 1
10 . 1 . 1 10 10 ILE H H 1 9.2200 0.0153 . 1 . . . . . 10 ILE H . 5403 1
11 . 1 . 1 10 10 ILE CA C 13 60.2440 0.3660 . 1 . . . . . 10 ILE CA . 5403 1
12 . 1 . 1 10 10 ILE CB C 13 40.8660 2.1390 . 1 . . . . . 10 ILE CB . 5403 1
13 . 1 . 1 10 10 ILE N N 15 126.9940 0.0578 . 1 . . . . . 10 ILE N . 5403 1
14 . 1 . 1 11 11 LYS H H 1 9.3550 0.0153 . 1 . . . . . 11 LYS H . 5403 1
15 . 1 . 1 11 11 LYS C C 13 176.2136 0.0000 . 1 . . . . . 11 LYS C . 5403 1
16 . 1 . 1 11 11 LYS CA C 13 53.1010 0.3660 . 1 . . . . . 11 LYS CA . 5403 1
17 . 1 . 1 11 11 LYS CB C 13 35.8780 2.1390 . 1 . . . . . 11 LYS CB . 5403 1
18 . 1 . 1 11 11 LYS N N 15 128.1160 0.0578 . 1 . . . . . 11 LYS N . 5403 1
19 . 1 . 1 12 12 ALA H H 1 8.3090 0.0153 . 1 . . . . . 12 ALA H . 5403 1
20 . 1 . 1 12 12 ALA C C 13 174.2298 0.0000 . 1 . . . . . 12 ALA C . 5403 1
21 . 1 . 1 12 12 ALA CA C 13 53.0670 0.3660 . 1 . . . . . 12 ALA CA . 5403 1
22 . 1 . 1 12 12 ALA CB C 13 19.9210 2.1390 . 1 . . . . . 12 ALA CB . 5403 1
23 . 1 . 1 12 12 ALA N N 15 130.4230 0.0578 . 1 . . . . . 12 ALA N . 5403 1
24 . 1 . 1 13 13 LEU H H 1 8.9810 0.0153 . 1 . . . . . 13 LEU H . 5403 1
25 . 1 . 1 13 13 LEU C C 13 177.1714 0.0000 . 1 . . . . . 13 LEU C . 5403 1
26 . 1 . 1 13 13 LEU CA C 13 53.6260 0.3660 . 1 . . . . . 13 LEU CA . 5403 1
27 . 1 . 1 13 13 LEU CB C 13 41.1800 2.1390 . 1 . . . . . 13 LEU CB . 5403 1
28 . 1 . 1 13 13 LEU N N 15 124.4500 0.0578 . 1 . . . . . 13 LEU N . 5403 1
29 . 1 . 1 14 14 GLU H H 1 7.6930 0.0153 . 1 . . . . . 14 GLU H . 5403 1
30 . 1 . 1 14 14 GLU C C 13 179.6025 0.0000 . 1 . . . . . 14 GLU C . 5403 1
31 . 1 . 1 14 14 GLU CA C 13 53.3300 0.3660 . 1 . . . . . 14 GLU CA . 5403 1
32 . 1 . 1 14 14 GLU CB C 13 31.7490 2.1390 . 1 . . . . . 14 GLU CB . 5403 1
33 . 1 . 1 14 14 GLU N N 15 117.1640 0.0578 . 1 . . . . . 14 GLU N . 5403 1
34 . 1 . 1 15 15 ASP H H 1 8.2880 0.0153 . 1 . . . . . 15 ASP H . 5403 1
35 . 1 . 1 15 15 ASP CA C 13 54.9860 0.3660 . 1 . . . . . 15 ASP CA . 5403 1
36 . 1 . 1 15 15 ASP CB C 13 40.5970 2.1390 . 1 . . . . . 15 ASP CB . 5403 1
37 . 1 . 1 15 15 ASP N N 15 118.3370 0.0578 . 1 . . . . . 15 ASP N . 5403 1
38 . 1 . 1 16 16 GLY C C 13 177.2614 0.0000 . 1 . . . . . 16 GLY C . 5403 1
39 . 1 . 1 16 16 GLY CA C 13 46.1480 0.3660 . 1 . . . . . 16 GLY CA . 5403 1
40 . 1 . 1 17 17 VAL H H 1 7.6550 0.0153 . 1 . . . . . 17 VAL H . 5403 1
41 . 1 . 1 17 17 VAL C C 13 176.8610 0.0000 . 1 . . . . . 17 VAL C . 5403 1
42 . 1 . 1 17 17 VAL CA C 13 63.3660 0.3660 . 1 . . . . . 17 VAL CA . 5403 1
43 . 1 . 1 17 17 VAL CB C 13 32.1030 2.1390 . 1 . . . . . 17 VAL CB . 5403 1
44 . 1 . 1 17 17 VAL N N 15 124.0820 0.0578 . 1 . . . . . 17 VAL N . 5403 1
45 . 1 . 1 18 18 ASN H H 1 8.6590 0.0153 . 1 . . . . . 18 ASN H . 5403 1
46 . 1 . 1 18 18 ASN C C 13 179.3636 0.0000 . 1 . . . . . 18 ASN C . 5403 1
47 . 1 . 1 18 18 ASN CA C 13 51.7920 0.3660 . 1 . . . . . 18 ASN CA . 5403 1
48 . 1 . 1 18 18 ASN CB C 13 41.8560 2.1390 . 1 . . . . . 18 ASN CB . 5403 1
49 . 1 . 1 18 18 ASN N N 15 125.2680 0.0578 . 1 . . . . . 18 ASN N . 5403 1
50 . 1 . 1 19 19 VAL H H 1 8.4800 0.0153 . 1 . . . . . 19 VAL H . 5403 1
51 . 1 . 1 19 19 VAL C C 13 178.3280 0.0000 . 1 . . . . . 19 VAL C . 5403 1
52 . 1 . 1 19 19 VAL CA C 13 61.7620 0.3660 . 1 . . . . . 19 VAL CA . 5403 1
53 . 1 . 1 19 19 VAL CB C 13 31.6880 2.1390 . 1 . . . . . 19 VAL CB . 5403 1
54 . 1 . 1 19 19 VAL N N 15 124.6440 0.0578 . 1 . . . . . 19 VAL N . 5403 1
55 . 1 . 1 20 20 ILE H H 1 9.3260 0.0153 . 1 . . . . . 20 ILE H . 5403 1
56 . 1 . 1 20 20 ILE CA C 13 59.9260 0.3660 . 1 . . . . . 20 ILE CA . 5403 1
57 . 1 . 1 20 20 ILE CB C 13 40.0430 2.1390 . 1 . . . . . 20 ILE CB . 5403 1
58 . 1 . 1 20 20 ILE N N 15 129.2550 0.0578 . 1 . . . . . 20 ILE N . 5403 1
59 . 1 . 1 21 21 GLY H H 1 8.7900 0.0153 . 1 . . . . . 21 GLY H . 5403 1
60 . 1 . 1 21 21 GLY CA C 13 45.3640 0.3660 . 1 . . . . . 21 GLY CA . 5403 1
61 . 1 . 1 21 21 GLY N N 15 114.2960 0.0578 . 1 . . . . . 21 GLY N . 5403 1
62 . 1 . 1 22 22 LEU H H 1 8.5150 0.0153 . 1 . . . . . 22 LEU H . 5403 1
63 . 1 . 1 22 22 LEU CA C 13 54.2210 0.3660 . 1 . . . . . 22 LEU CA . 5403 1
64 . 1 . 1 22 22 LEU CB C 13 41.4570 2.1390 . 1 . . . . . 22 LEU CB . 5403 1
65 . 1 . 1 22 22 LEU N N 15 127.5260 0.0578 . 1 . . . . . 22 LEU N . 5403 1
66 . 1 . 1 23 23 THR H H 1 8.5820 0.0153 . 1 . . . . . 23 THR H . 5403 1
67 . 1 . 1 23 23 THR CA C 13 60.4440 0.3660 . 1 . . . . . 23 THR CA . 5403 1
68 . 1 . 1 23 23 THR CB C 13 69.6270 2.1390 . 1 . . . . . 23 THR CB . 5403 1
69 . 1 . 1 23 23 THR N N 15 110.6970 0.0578 . 1 . . . . . 23 THR N . 5403 1
70 . 1 . 1 24 24 ARG H H 1 7.3360 0.0153 . 1 . . . . . 24 ARG H . 5403 1
71 . 1 . 1 24 24 ARG CA C 13 55.8410 0.3660 . 1 . . . . . 24 ARG CA . 5403 1
72 . 1 . 1 24 24 ARG CB C 13 30.3970 2.1390 . 1 . . . . . 24 ARG CB . 5403 1
73 . 1 . 1 24 24 ARG N N 15 124.6140 0.0578 . 1 . . . . . 24 ARG N . 5403 1
74 . 1 . 1 25 25 GLY H H 1 7.9690 0.0153 . 1 . . . . . 25 GLY H . 5403 1
75 . 1 . 1 25 25 GLY CA C 13 43.3750 0.3660 . 1 . . . . . 25 GLY CA . 5403 1
76 . 1 . 1 25 25 GLY N N 15 115.4110 0.0578 . 1 . . . . . 25 GLY N . 5403 1
77 . 1 . 1 30 30 PHE C C 13 175.1916 0.0000 . 1 . . . . . 30 PHE C . 5403 1
78 . 1 . 1 30 30 PHE CA C 13 54.7750 0.3660 . 1 . . . . . 30 PHE CA . 5403 1
79 . 1 . 1 30 30 PHE CB C 13 37.3400 2.1390 . 1 . . . . . 30 PHE CB . 5403 1
80 . 1 . 1 31 31 HIS H H 1 8.4290 0.0153 . 1 . . . . . 31 HIS H . 5403 1
81 . 1 . 1 31 31 HIS CA C 13 55.8460 0.3660 . 1 . . . . . 31 HIS CA . 5403 1
82 . 1 . 1 31 31 HIS CB C 13 32.3020 2.1390 . 1 . . . . . 31 HIS CB . 5403 1
83 . 1 . 1 31 31 HIS N N 15 122.5620 0.0578 . 1 . . . . . 31 HIS N . 5403 1
84 . 1 . 1 32 32 HIS H H 1 9.6870 0.0153 . 1 . . . . . 32 HIS H . 5403 1
85 . 1 . 1 32 32 HIS CA C 13 57.4380 0.3660 . 1 . . . . . 32 HIS CA . 5403 1
86 . 1 . 1 32 32 HIS CB C 13 33.7150 2.1390 . 1 . . . . . 32 HIS CB . 5403 1
87 . 1 . 1 32 32 HIS N N 15 119.4710 0.0578 . 1 . . . . . 32 HIS N . 5403 1
88 . 1 . 1 33 33 SER H H 1 6.9490 0.0153 . 1 . . . . . 33 SER H . 5403 1
89 . 1 . 1 33 33 SER C C 13 179.7877 0.0000 . 1 . . . . . 33 SER C . 5403 1
90 . 1 . 1 33 33 SER CA C 13 55.4420 0.3660 . 1 . . . . . 33 SER CA . 5403 1
91 . 1 . 1 33 33 SER CB C 13 63.6370 2.1390 . 1 . . . . . 33 SER CB . 5403 1
92 . 1 . 1 33 33 SER N N 15 121.2170 0.0578 . 1 . . . . . 33 SER N . 5403 1
93 . 1 . 1 34 34 GLU H H 1 9.2040 0.0153 . 1 . . . . . 34 GLU H . 5403 1
94 . 1 . 1 34 34 GLU C C 13 177.8255 0.0000 . 1 . . . . . 34 GLU C . 5403 1
95 . 1 . 1 34 34 GLU CA C 13 53.8340 0.3660 . 1 . . . . . 34 GLU CA . 5403 1
96 . 1 . 1 34 34 GLU CB C 13 30.7050 2.1390 . 1 . . . . . 34 GLU CB . 5403 1
97 . 1 . 1 34 34 GLU N N 15 129.8480 0.0578 . 1 . . . . . 34 GLU N . 5403 1
98 . 1 . 1 35 35 LYS H H 1 8.0380 0.0153 . 1 . . . . . 35 LYS H . 5403 1
99 . 1 . 1 35 35 LYS C C 13 176.4405 0.0000 . 1 . . . . . 35 LYS C . 5403 1
100 . 1 . 1 35 35 LYS CA C 13 54.9550 0.3660 . 1 . . . . . 35 LYS CA . 5403 1
101 . 1 . 1 35 35 LYS CB C 13 31.8720 2.1390 . 1 . . . . . 35 LYS CB . 5403 1
102 . 1 . 1 35 35 LYS N N 15 129.2580 0.0578 . 1 . . . . . 35 LYS N . 5403 1
103 . 1 . 1 36 36 LEU H H 1 9.0440 0.0153 . 1 . . . . . 36 LEU H . 5403 1
104 . 1 . 1 36 36 LEU C C 13 177.1515 0.0000 . 1 . . . . . 36 LEU C . 5403 1
105 . 1 . 1 36 36 LEU CA C 13 53.1260 0.3660 . 1 . . . . . 36 LEU CA . 5403 1
106 . 1 . 1 36 36 LEU CB C 13 45.3180 2.1390 . 1 . . . . . 36 LEU CB . 5403 1
107 . 1 . 1 36 36 LEU N N 15 128.7120 0.0578 . 1 . . . . . 36 LEU N . 5403 1
108 . 1 . 1 37 37 ASP H H 1 8.4720 0.0153 . 1 . . . . . 37 ASP H . 5403 1
109 . 1 . 1 37 37 ASP C C 13 176.7482 0.0000 . 1 . . . . . 37 ASP C . 5403 1
110 . 1 . 1 37 37 ASP CA C 13 52.4330 0.3660 . 1 . . . . . 37 ASP CA . 5403 1
111 . 1 . 1 37 37 ASP CB C 13 41.8260 2.1390 . 1 . . . . . 37 ASP CB . 5403 1
112 . 1 . 1 37 37 ASP N N 15 123.4800 0.0578 . 1 . . . . . 37 ASP N . 5403 1
113 . 1 . 1 38 38 LYS H H 1 8.7100 0.0153 . 1 . . . . . 38 LYS H . 5403 1
114 . 1 . 1 38 38 LYS C C 13 175.0256 0.0000 . 1 . . . . . 38 LYS C . 5403 1
115 . 1 . 1 38 38 LYS CA C 13 59.3760 0.3660 . 1 . . . . . 38 LYS CA . 5403 1
116 . 1 . 1 38 38 LYS CB C 13 31.8100 2.1390 . 1 . . . . . 38 LYS CB . 5403 1
117 . 1 . 1 38 38 LYS N N 15 119.4840 0.0578 . 1 . . . . . 38 LYS N . 5403 1
118 . 1 . 1 39 39 GLY H H 1 8.5570 0.0153 . 1 . . . . . 39 GLY H . 5403 1
119 . 1 . 1 39 39 GLY C C 13 178.2853 0.0000 . 1 . . . . . 39 GLY C . 5403 1
120 . 1 . 1 39 39 GLY CA C 13 45.1750 0.3660 . 1 . . . . . 39 GLY CA . 5403 1
121 . 1 . 1 39 39 GLY N N 15 115.5460 0.0578 . 1 . . . . . 39 GLY N . 5403 1
122 . 1 . 1 40 40 GLU H H 1 8.1230 0.0153 . 1 . . . . . 40 GLU H . 5403 1
123 . 1 . 1 40 40 GLU C C 13 176.8562 0.0000 . 1 . . . . . 40 GLU C . 5403 1
124 . 1 . 1 40 40 GLU CA C 13 56.7890 0.3660 . 1 . . . . . 40 GLU CA . 5403 1
125 . 1 . 1 40 40 GLU CB C 13 31.8100 2.1390 . 1 . . . . . 40 GLU CB . 5403 1
126 . 1 . 1 40 40 GLU N N 15 120.7060 0.0578 . 1 . . . . . 40 GLU N . 5403 1
127 . 1 . 1 41 41 VAL H H 1 7.4540 0.0153 . 1 . . . . . 41 VAL H . 5403 1
128 . 1 . 1 41 41 VAL C C 13 178.7112 0.0000 . 1 . . . . . 41 VAL C . 5403 1
129 . 1 . 1 41 41 VAL CA C 13 59.6140 0.3660 . 1 . . . . . 41 VAL CA . 5403 1
130 . 1 . 1 41 41 VAL CB C 13 35.6190 2.1390 . 1 . . . . . 41 VAL CB . 5403 1
131 . 1 . 1 41 41 VAL N N 15 118.9090 0.0578 . 1 . . . . . 41 VAL N . 5403 1
132 . 1 . 1 42 42 LEU H H 1 9.2580 0.0153 . 1 . . . . . 42 LEU H . 5403 1
133 . 1 . 1 42 42 LEU C C 13 178.5874 0.0000 . 1 . . . . . 42 LEU C . 5403 1
134 . 1 . 1 42 42 LEU CA C 13 52.3890 0.3660 . 1 . . . . . 42 LEU CA . 5403 1
135 . 1 . 1 42 42 LEU CB C 13 46.6180 2.1390 . 1 . . . . . 42 LEU CB . 5403 1
136 . 1 . 1 42 42 LEU N N 15 128.7260 0.0578 . 1 . . . . . 42 LEU N . 5403 1
137 . 1 . 1 43 43 ILE H H 1 9.3880 0.0153 . 1 . . . . . 43 ILE H . 5403 1
138 . 1 . 1 43 43 ILE C C 13 177.0136 0.0000 . 1 . . . . . 43 ILE C . 5403 1
139 . 1 . 1 43 43 ILE CA C 13 60.2960 0.3660 . 1 . . . . . 43 ILE CA . 5403 1
140 . 1 . 1 43 43 ILE CB C 13 38.2620 2.1390 . 1 . . . . . 43 ILE CB . 5403 1
141 . 1 . 1 43 43 ILE N N 15 128.6980 0.0578 . 1 . . . . . 43 ILE N . 5403 1
142 . 1 . 1 44 44 ALA H H 1 8.7840 0.0153 . 1 . . . . . 44 ALA H . 5403 1
143 . 1 . 1 44 44 ALA C C 13 182.0850 0.0000 . 1 . . . . . 44 ALA C . 5403 1
144 . 1 . 1 44 44 ALA CA C 13 50.6710 0.3660 . 1 . . . . . 44 ALA CA . 5403 1
145 . 1 . 1 44 44 ALA CB C 13 21.5200 2.1390 . 1 . . . . . 44 ALA CB . 5403 1
146 . 1 . 1 44 44 ALA N N 15 128.7040 0.0578 . 1 . . . . . 44 ALA N . 5403 1
147 . 1 . 1 45 45 GLN H H 1 7.6970 0.0153 . 1 . . . . . 45 GLN H . 5403 1
148 . 1 . 1 45 45 GLN C C 13 176.9307 0.0000 . 1 . . . . . 45 GLN C . 5403 1
149 . 1 . 1 45 45 GLN CA C 13 55.4030 0.3660 . 1 . . . . . 45 GLN CA . 5403 1
150 . 1 . 1 45 45 GLN CB C 13 31.1350 2.1390 . 1 . . . . . 45 GLN CB . 5403 1
151 . 1 . 1 45 45 GLN N N 15 120.6360 0.0578 . 1 . . . . . 45 GLN N . 5403 1
152 . 1 . 1 46 46 PHE H H 1 7.1240 0.0153 . 1 . . . . . 46 PHE H . 5403 1
153 . 1 . 1 46 46 PHE CA C 13 59.4950 0.3660 . 1 . . . . . 46 PHE CA . 5403 1
154 . 1 . 1 46 46 PHE CB C 13 39.5390 2.1390 . 1 . . . . . 46 PHE CB . 5403 1
155 . 1 . 1 46 46 PHE N N 15 117.2200 0.0578 . 1 . . . . . 46 PHE N . 5403 1
156 . 1 . 1 47 47 THR CA C 13 59.4350 0.3660 . 1 . . . . . 47 THR CA . 5403 1
157 . 1 . 1 48 48 GLU H H 1 8.0990 0.0153 . 1 . . . . . 48 GLU H . 5403 1
158 . 1 . 1 48 48 GLU CA C 13 54.2930 0.3660 . 1 . . . . . 48 GLU CA . 5403 1
159 . 1 . 1 48 48 GLU N N 15 113.0970 0.0578 . 1 . . . . . 48 GLU N . 5403 1
160 . 1 . 1 49 49 HIS H H 1 8.6780 0.0153 . 1 . . . . . 49 HIS H . 5403 1
161 . 1 . 1 49 49 HIS C C 13 176.4905 0.0000 . 1 . . . . . 49 HIS C . 5403 1
162 . 1 . 1 49 49 HIS CA C 13 58.5530 0.3660 . 1 . . . . . 49 HIS CA . 5403 1
163 . 1 . 1 49 49 HIS N N 15 117.1130 0.0578 . 1 . . . . . 49 HIS N . 5403 1
164 . 1 . 1 50 50 THR H H 1 7.7820 0.0153 . 1 . . . . . 50 THR H . 5403 1
165 . 1 . 1 50 50 THR CA C 13 60.2170 0.3660 . 1 . . . . . 50 THR CA . 5403 1
166 . 1 . 1 50 50 THR CB C 13 69.1440 2.1390 . 1 . . . . . 50 THR CB . 5403 1
167 . 1 . 1 50 50 THR N N 15 120.7180 0.0578 . 1 . . . . . 50 THR N . 5403 1
168 . 1 . 1 51 51 SER H H 1 7.5880 0.0153 . 1 . . . . . 51 SER H . 5403 1
169 . 1 . 1 51 51 SER C C 13 180.6995 0.0000 . 1 . . . . . 51 SER C . 5403 1
170 . 1 . 1 51 51 SER CA C 13 56.3740 0.3660 . 1 . . . . . 51 SER CA . 5403 1
171 . 1 . 1 51 51 SER CB C 13 64.9580 2.1390 . 1 . . . . . 51 SER CB . 5403 1
172 . 1 . 1 51 51 SER N N 15 118.2790 0.0578 . 1 . . . . . 51 SER N . 5403 1
173 . 1 . 1 52 52 ALA H H 1 7.5750 0.0153 . 1 . . . . . 52 ALA H . 5403 1
174 . 1 . 1 52 52 ALA C C 13 178.2423 0.0000 . 1 . . . . . 52 ALA C . 5403 1
175 . 1 . 1 52 52 ALA CA C 13 51.5650 0.3660 . 1 . . . . . 52 ALA CA . 5403 1
176 . 1 . 1 52 52 ALA CB C 13 20.6590 2.1390 . 1 . . . . . 52 ALA CB . 5403 1
177 . 1 . 1 52 52 ALA N N 15 121.1340 0.0578 . 1 . . . . . 52 ALA N . 5403 1
178 . 1 . 1 53 53 ILE H H 1 9.1740 0.0153 . 1 . . . . . 53 ILE H . 5403 1
179 . 1 . 1 53 53 ILE C C 13 178.7465 0.0000 . 1 . . . . . 53 ILE C . 5403 1
180 . 1 . 1 53 53 ILE CA C 13 59.5710 0.3660 . 1 . . . . . 53 ILE CA . 5403 1
181 . 1 . 1 53 53 ILE CB C 13 42.8080 2.1390 . 1 . . . . . 53 ILE CB . 5403 1
182 . 1 . 1 53 53 ILE N N 15 122.3160 0.0578 . 1 . . . . . 53 ILE N . 5403 1
183 . 1 . 1 54 54 LYS H H 1 9.3580 0.0153 . 1 . . . . . 54 LYS H . 5403 1
184 . 1 . 1 54 54 LYS C C 13 178.2740 0.0000 . 1 . . . . . 54 LYS C . 5403 1
185 . 1 . 1 54 54 LYS CA C 13 53.6020 0.3660 . 1 . . . . . 54 LYS CA . 5403 1
186 . 1 . 1 54 54 LYS CB C 13 35.8170 2.1390 . 1 . . . . . 54 LYS CB . 5403 1
187 . 1 . 1 54 54 LYS N N 15 130.3890 0.0578 . 1 . . . . . 54 LYS N . 5403 1
188 . 1 . 1 55 55 VAL H H 1 9.0600 0.0153 . 1 . . . . . 55 VAL H . 5403 1
189 . 1 . 1 55 55 VAL C C 13 178.1228 0.0000 . 1 . . . . . 55 VAL C . 5403 1
190 . 1 . 1 55 55 VAL CA C 13 61.4920 0.3660 . 1 . . . . . 55 VAL CA . 5403 1
191 . 1 . 1 55 55 VAL CB C 13 33.6540 2.1390 . 1 . . . . . 55 VAL CB . 5403 1
192 . 1 . 1 55 55 VAL N N 15 126.4260 0.0578 . 1 . . . . . 55 VAL N . 5403 1
193 . 1 . 1 56 56 ARG H H 1 8.3860 0.0153 . 1 . . . . . 56 ARG H . 5403 1
194 . 1 . 1 56 56 ARG C C 13 177.1318 0.0000 . 1 . . . . . 56 ARG C . 5403 1
195 . 1 . 1 56 56 ARG CA C 13 54.4960 0.3660 . 1 . . . . . 56 ARG CA . 5403 1
196 . 1 . 1 56 56 ARG CB C 13 33.1010 2.1390 . 1 . . . . . 56 ARG CB . 5403 1
197 . 1 . 1 56 56 ARG N N 15 125.8360 0.0578 . 1 . . . . . 56 ARG N . 5403 1
198 . 1 . 1 57 57 GLY H H 1 8.2050 0.0153 . 1 . . . . . 57 GLY H . 5403 1
199 . 1 . 1 57 57 GLY C C 13 180.1373 0.0000 . 1 . . . . . 57 GLY C . 5403 1
200 . 1 . 1 57 57 GLY CA C 13 42.9230 0.3660 . 1 . . . . . 57 GLY CA . 5403 1
201 . 1 . 1 57 57 GLY N N 15 114.2470 0.0578 . 1 . . . . . 57 GLY N . 5403 1
202 . 1 . 1 58 58 LYS H H 1 8.8540 0.0153 . 1 . . . . . 58 LYS H . 5403 1
203 . 1 . 1 58 58 LYS C C 13 178.2263 0.0000 . 1 . . . . . 58 LYS C . 5403 1
204 . 1 . 1 58 58 LYS CA C 13 56.6460 0.3660 . 1 . . . . . 58 LYS CA . 5403 1
205 . 1 . 1 58 58 LYS CB C 13 32.7320 2.1390 . 1 . . . . . 58 LYS CB . 5403 1
206 . 1 . 1 58 58 LYS N N 15 123.4940 0.0578 . 1 . . . . . 58 LYS N . 5403 1
207 . 1 . 1 59 59 ALA H H 1 7.9890 0.0153 . 1 . . . . . 59 ALA H . 5403 1
208 . 1 . 1 59 59 ALA C C 13 176.6476 0.0000 . 1 . . . . . 59 ALA C . 5403 1
209 . 1 . 1 59 59 ALA CA C 13 50.8820 0.3660 . 1 . . . . . 59 ALA CA . 5403 1
210 . 1 . 1 59 59 ALA CB C 13 22.7180 2.1390 . 1 . . . . . 59 ALA CB . 5403 1
211 . 1 . 1 59 59 ALA N N 15 129.8820 0.0578 . 1 . . . . . 59 ALA N . 5403 1
212 . 1 . 1 60 60 TYR H H 1 8.9600 0.0153 . 1 . . . . . 60 TYR H . 5403 1
213 . 1 . 1 60 60 TYR C C 13 178.5729 0.0000 . 1 . . . . . 60 TYR C . 5403 1
214 . 1 . 1 60 60 TYR CA C 13 57.1900 0.3660 . 1 . . . . . 60 TYR CA . 5403 1
215 . 1 . 1 60 60 TYR CB C 13 40.7810 2.1390 . 1 . . . . . 60 TYR CB . 5403 1
216 . 1 . 1 60 60 TYR N N 15 124.2830 0.0578 . 1 . . . . . 60 TYR N . 5403 1
217 . 1 . 1 61 61 ILE H H 1 8.4640 0.0153 . 1 . . . . . 61 ILE H . 5403 1
218 . 1 . 1 61 61 ILE C C 13 177.8985 0.0000 . 1 . . . . . 61 ILE C . 5403 1
219 . 1 . 1 61 61 ILE CA C 13 59.5900 0.3660 . 1 . . . . . 61 ILE CA . 5403 1
220 . 1 . 1 61 61 ILE CB C 13 39.4680 2.1390 . 1 . . . . . 61 ILE CB . 5403 1
221 . 1 . 1 61 61 ILE N N 15 129.3000 0.0578 . 1 . . . . . 61 ILE N . 5403 1
222 . 1 . 1 62 62 GLN H H 1 9.0760 0.0153 . 1 . . . . . 62 GLN H . 5403 1
223 . 1 . 1 62 62 GLN C C 13 177.0763 0.0000 . 1 . . . . . 62 GLN C . 5403 1
224 . 1 . 1 62 62 GLN CA C 13 53.7280 0.3660 . 1 . . . . . 62 GLN CA . 5403 1
225 . 1 . 1 62 62 GLN CB C 13 31.6880 2.1390 . 1 . . . . . 62 GLN CB . 5403 1
226 . 1 . 1 62 62 GLN N N 15 124.0200 0.0578 . 1 . . . . . 62 GLN N . 5403 1
227 . 1 . 1 63 63 THR H H 1 8.1780 0.0153 . 1 . . . . . 63 THR H . 5403 1
228 . 1 . 1 63 63 THR CA C 13 59.4730 0.3660 . 1 . . . . . 63 THR CA . 5403 1
229 . 1 . 1 63 63 THR CB C 13 72.0540 2.1390 . 1 . . . . . 63 THR CB . 5403 1
230 . 1 . 1 63 63 THR N N 15 113.0830 0.0578 . 1 . . . . . 63 THR N . 5403 1
231 . 1 . 1 64 64 ARG H H 1 8.5650 0.0153 . 1 . . . . . 64 ARG H . 5403 1
232 . 1 . 1 64 64 ARG CA C 13 57.6180 0.3660 . 1 . . . . . 64 ARG CA . 5403 1
233 . 1 . 1 64 64 ARG N N 15 120.0550 0.0578 . 1 . . . . . 64 ARG N . 5403 1
234 . 1 . 1 65 65 HIS H H 1 7.5180 0.0153 . 1 . . . . . 65 HIS H . 5403 1
235 . 1 . 1 65 65 HIS C C 13 177.0004 0.0000 . 1 . . . . . 65 HIS C . 5403 1
236 . 1 . 1 65 65 HIS CA C 13 54.0290 0.3660 . 1 . . . . . 65 HIS CA . 5403 1
237 . 1 . 1 65 65 HIS CB C 13 30.7050 2.1390 . 1 . . . . . 65 HIS CB . 5403 1
238 . 1 . 1 65 65 HIS N N 15 115.4660 0.0578 . 1 . . . . . 65 HIS N . 5403 1
239 . 1 . 1 66 66 GLY H H 1 7.3100 0.0153 . 1 . . . . . 66 GLY H . 5403 1
240 . 1 . 1 66 66 GLY C C 13 179.5191 0.0000 . 1 . . . . . 66 GLY C . 5403 1
241 . 1 . 1 66 66 GLY CA C 13 43.7450 0.3660 . 1 . . . . . 66 GLY CA . 5403 1
242 . 1 . 1 66 66 GLY N N 15 107.3250 0.0578 . 1 . . . . . 66 GLY N . 5403 1
243 . 1 . 1 67 67 VAL H H 1 8.2200 0.0153 . 1 . . . . . 67 VAL H . 5403 1
244 . 1 . 1 67 67 VAL C C 13 176.8178 0.0000 . 1 . . . . . 67 VAL C . 5403 1
245 . 1 . 1 67 67 VAL CA C 13 59.7510 0.3660 . 1 . . . . . 67 VAL CA . 5403 1
246 . 1 . 1 67 67 VAL CB C 13 33.8680 2.1390 . 1 . . . . . 67 VAL CB . 5403 1
247 . 1 . 1 67 67 VAL N N 15 121.7460 0.0578 . 1 . . . . . 67 VAL N . 5403 1
248 . 1 . 1 68 68 ILE H H 1 8.9680 0.0153 . 1 . . . . . 68 ILE H . 5403 1
249 . 1 . 1 68 68 ILE C C 13 181.0301 0.0000 . 1 . . . . . 68 ILE C . 5403 1
250 . 1 . 1 68 68 ILE CA C 13 59.0220 0.3660 . 1 . . . . . 68 ILE CA . 5403 1
251 . 1 . 1 68 68 ILE CB C 13 41.7330 2.1390 . 1 . . . . . 68 ILE CB . 5403 1
252 . 1 . 1 68 68 ILE N N 15 126.9810 0.0578 . 1 . . . . . 68 ILE N . 5403 1
253 . 1 . 1 69 69 GLU H H 1 7.7110 0.0153 . 1 . . . . . 69 GLU H . 5403 1
254 . 1 . 1 69 69 GLU CA C 13 53.9410 0.3660 . 1 . . . . . 69 GLU CA . 5403 1
255 . 1 . 1 69 69 GLU CB C 13 31.9340 2.1390 . 1 . . . . . 69 GLU CB . 5403 1
256 . 1 . 1 69 69 GLU N N 15 123.4810 0.0578 . 1 . . . . . 69 GLU N . 5403 1
257 . 1 . 1 70 70 SER H H 1 8.8030 0.0153 . 1 . . . . . 70 SER H . 5403 1
258 . 1 . 1 70 70 SER CA C 13 57.1000 0.3660 . 1 . . . . . 70 SER CA . 5403 1
259 . 1 . 1 70 70 SER CB C 13 64.6200 2.1390 . 1 . . . . . 70 SER CB . 5403 1
260 . 1 . 1 70 70 SER N N 15 119.5860 0.0578 . 1 . . . . . 70 SER N . 5403 1
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