Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 50887
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'GeoHNH chemical shift list'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 50887 1
2 '3D HNCA' . . . 50887 1
3 '3D HN(CO)CA' . . . 50887 1
4 '3D HNCACB' . . . 50887 1
5 '3D HN(CO)CACB' . . . 50887 1
6 '3D HN(CA)CO' . . . 50887 1
7 '3D HNCO' . . . 50887 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 50887 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 6 6 VAL H H 1 7.719 0.020 . 1 . . . . . 6 VAL H . 50887 1
2 . 1 . 1 6 6 VAL CA C 13 66.585 0.3 . 1 . . . . . 6 VAL CA . 50887 1
3 . 1 . 1 6 6 VAL CB C 13 31.205 0.3 . 1 . . . . . 6 VAL CB . 50887 1
4 . 1 . 1 6 6 VAL N N 15 121.108 0.3 . 1 . . . . . 6 VAL N . 50887 1
5 . 1 . 1 7 7 LYS H H 1 8.663 0.020 . 1 . . . . . 7 LYS H . 50887 1
6 . 1 . 1 7 7 LYS C C 13 175.154 0.3 . 1 . . . . . 7 LYS C . 50887 1
7 . 1 . 1 7 7 LYS CA C 13 56.809 0.3 . 1 . . . . . 7 LYS CA . 50887 1
8 . 1 . 1 7 7 LYS CB C 13 35.580 0.3 . 1 . . . . . 7 LYS CB . 50887 1
9 . 1 . 1 7 7 LYS N N 15 117.658 0.3 . 1 . . . . . 7 LYS N . 50887 1
10 . 1 . 1 10 10 LEU H H 1 8.614 0.020 . 1 . . . . . 10 LEU H . 50887 1
11 . 1 . 1 10 10 LEU C C 13 178.203 0.3 . 1 . . . . . 10 LEU C . 50887 1
12 . 1 . 1 10 10 LEU CA C 13 57.819 0.3 . 1 . . . . . 10 LEU CA . 50887 1
13 . 1 . 1 10 10 LEU CB C 13 43.330 0.3 . 1 . . . . . 10 LEU CB . 50887 1
14 . 1 . 1 10 10 LEU N N 15 119.742 0.3 . 1 . . . . . 10 LEU N . 50887 1
15 . 1 . 1 11 11 TRP H H 1 8.447 0.020 . 1 . . . . . 11 TRP H . 50887 1
16 . 1 . 1 11 11 TRP C C 13 178.482 0.3 . 1 . . . . . 11 TRP C . 50887 1
17 . 1 . 1 11 11 TRP CA C 13 63.969 0.3 . 1 . . . . . 11 TRP CA . 50887 1
18 . 1 . 1 11 11 TRP CB C 13 29.094 0.3 . 1 . . . . . 11 TRP CB . 50887 1
19 . 1 . 1 11 11 TRP N N 15 119.484 0.3 . 1 . . . . . 11 TRP N . 50887 1
20 . 1 . 1 12 12 SER H H 1 8.379 0.020 . 1 . . . . . 12 SER H . 50887 1
21 . 1 . 1 12 12 SER C C 13 178.497 0.3 . 1 . . . . . 12 SER C . 50887 1
22 . 1 . 1 12 12 SER CA C 13 61.952 0.3 . 1 . . . . . 12 SER CA . 50887 1
23 . 1 . 1 12 12 SER CB C 13 63.047 0.3 . 1 . . . . . 12 SER CB . 50887 1
24 . 1 . 1 12 12 SER N N 15 112.940 0.3 . 1 . . . . . 12 SER N . 50887 1
25 . 1 . 1 14 14 GLN H H 1 7.463 0.020 . 1 . . . . . 14 GLN H . 50887 1
26 . 1 . 1 14 14 GLN C C 13 174.418 0.3 . 1 . . . . . 14 GLN C . 50887 1
27 . 1 . 1 14 14 GLN CA C 13 55.045 0.3 . 1 . . . . . 14 GLN CA . 50887 1
28 . 1 . 1 14 14 GLN CB C 13 28.256 0.3 . 1 . . . . . 14 GLN CB . 50887 1
29 . 1 . 1 14 14 GLN N N 15 112.352 0.3 . 1 . . . . . 14 GLN N . 50887 1
30 . 1 . 1 15 15 ASN H H 1 7.759 0.020 . 1 . . . . . 15 ASN H . 50887 1
31 . 1 . 1 15 15 ASN C C 13 175.640 0.3 . 1 . . . . . 15 ASN C . 50887 1
32 . 1 . 1 15 15 ASN CA C 13 54.029 0.3 . 1 . . . . . 15 ASN CA . 50887 1
33 . 1 . 1 15 15 ASN CB C 13 37.181 0.3 . 1 . . . . . 15 ASN CB . 50887 1
34 . 1 . 1 15 15 ASN N N 15 114.955 0.3 . 1 . . . . . 15 ASN N . 50887 1
35 . 1 . 1 16 16 GLY H H 1 8.017 0.020 . 1 . . . . . 16 GLY H . 50887 1
36 . 1 . 1 16 16 GLY C C 13 175.625 0.3 . 1 . . . . . 16 GLY C . 50887 1
37 . 1 . 1 16 16 GLY CA C 13 44.262 0.3 . 1 . . . . . 16 GLY CA . 50887 1
38 . 1 . 1 16 16 GLY N N 15 101.724 0.3 . 1 . . . . . 16 GLY N . 50887 1
39 . 1 . 1 17 17 ARG H H 1 6.702 0.020 . 1 . . . . . 17 ARG H . 50887 1
40 . 1 . 1 17 17 ARG C C 13 173.711 0.3 . 1 . . . . . 17 ARG C . 50887 1
41 . 1 . 1 17 17 ARG CA C 13 53.444 0.3 . 1 . . . . . 17 ARG CA . 50887 1
42 . 1 . 1 17 17 ARG CB C 13 32.468 0.3 . 1 . . . . . 17 ARG CB . 50887 1
43 . 1 . 1 17 17 ARG N N 15 116.883 0.3 . 1 . . . . . 17 ARG N . 50887 1
44 . 1 . 1 18 18 CYS H H 1 8.565 0.020 . 1 . . . . . 18 CYS H . 50887 1
45 . 1 . 1 18 18 CYS C C 13 177.363 0.3 . 1 . . . . . 18 CYS C . 50887 1
46 . 1 . 1 18 18 CYS CA C 13 61.189 0.3 . 1 . . . . . 18 CYS CA . 50887 1
47 . 1 . 1 18 18 CYS CB C 13 29.515 0.3 . 1 . . . . . 18 CYS CB . 50887 1
48 . 1 . 1 18 18 CYS N N 15 124.529 0.3 . 1 . . . . . 18 CYS N . 50887 1
49 . 1 . 1 19 19 ALA H H 1 6.907 0.020 . 1 . . . . . 19 ALA H . 50887 1
50 . 1 . 1 19 19 ALA C C 13 174.138 0.3 . 1 . . . . . 19 ALA C . 50887 1
51 . 1 . 1 19 19 ALA CA C 13 54.623 0.3 . 1 . . . . . 19 ALA CA . 50887 1
52 . 1 . 1 19 19 ALA CB C 13 18.142 0.3 . 1 . . . . . 19 ALA CB . 50887 1
53 . 1 . 1 19 19 ALA N N 15 129.007 0.3 . 1 . . . . . 19 ALA N . 50887 1
54 . 1 . 1 20 20 TYR H H 1 7.811 0.020 . 1 . . . . . 20 TYR H . 50887 1
55 . 1 . 1 20 20 TYR C C 13 177.334 0.3 . 1 . . . . . 20 TYR C . 50887 1
56 . 1 . 1 20 20 TYR CA C 13 54.960 0.3 . 1 . . . . . 20 TYR CA . 50887 1
57 . 1 . 1 20 20 TYR CB C 13 40.218 0.3 . 1 . . . . . 20 TYR CB . 50887 1
58 . 1 . 1 20 20 TYR N N 15 107.054 0.3 . 1 . . . . . 20 TYR N . 50887 1
59 . 1 . 1 21 21 SER H H 1 10.281 0.020 . 1 . . . . . 21 SER H . 50887 1
60 . 1 . 1 21 21 SER C C 13 175.507 0.3 . 1 . . . . . 21 SER C . 50887 1
61 . 1 . 1 21 21 SER CA C 13 59.594 0.3 . 1 . . . . . 21 SER CA . 50887 1
62 . 1 . 1 21 21 SER CB C 13 65.575 0.3 . 1 . . . . . 21 SER CB . 50887 1
63 . 1 . 1 21 21 SER N N 15 122.478 0.3 . 1 . . . . . 21 SER N . 50887 1
64 . 1 . 1 22 22 LEU H H 1 7.689 0.020 . 1 . . . . . 22 LEU H . 50887 1
65 . 1 . 1 22 22 LEU C C 13 175.449 0.3 . 1 . . . . . 22 LEU C . 50887 1
66 . 1 . 1 22 22 LEU CA C 13 56.392 0.3 . 1 . . . . . 22 LEU CA . 50887 1
67 . 1 . 1 22 22 LEU CB C 13 37.775 0.3 . 1 . . . . . 22 LEU CB . 50887 1
68 . 1 . 1 22 22 LEU N N 15 118.220 0.3 . 1 . . . . . 22 LEU N . 50887 1
69 . 1 . 1 25 25 ILE H H 1 8.687 0.020 . 1 . . . . . 25 ILE H . 50887 1
70 . 1 . 1 25 25 ILE C C 13 176.951 0.3 . 1 . . . . . 25 ILE C . 50887 1
71 . 1 . 1 25 25 ILE CA C 13 60.262 0.3 . 1 . . . . . 25 ILE CA . 50887 1
72 . 1 . 1 25 25 ILE CB C 13 39.624 0.3 . 1 . . . . . 25 ILE CB . 50887 1
73 . 1 . 1 25 25 ILE N N 15 122.808 0.3 . 1 . . . . . 25 ILE N . 50887 1
74 . 1 . 1 26 26 GLU H H 1 9.052 0.020 . 1 . . . . . 26 GLU H . 50887 1
75 . 1 . 1 26 26 GLU C C 13 177.820 0.3 . 1 . . . . . 26 GLU C . 50887 1
76 . 1 . 1 26 26 GLU CA C 13 56.729 0.3 . 1 . . . . . 26 GLU CA . 50887 1
77 . 1 . 1 26 26 GLU CB C 13 29.520 0.3 . 1 . . . . . 26 GLU CB . 50887 1
78 . 1 . 1 26 26 GLU N N 15 130.876 0.3 . 1 . . . . . 26 GLU N . 50887 1
79 . 1 . 1 27 27 ILE H H 1 8.950 0.020 . 1 . . . . . 27 ILE H . 50887 1
80 . 1 . 1 27 27 ILE C C 13 177.820 0.3 . 1 . . . . . 27 ILE C . 50887 1
81 . 1 . 1 27 27 ILE CA C 13 62.795 0.3 . 1 . . . . . 27 ILE CA . 50887 1
82 . 1 . 1 27 27 ILE CB C 13 36.849 0.3 . 1 . . . . . 27 ILE CB . 50887 1
83 . 1 . 1 27 27 ILE N N 15 129.207 0.3 . 1 . . . . . 27 ILE N . 50887 1
84 . 1 . 1 29 29 ARG H H 1 7.359 0.020 . 1 . . . . . 29 ARG H . 50887 1
85 . 1 . 1 29 29 ARG C C 13 175.964 0.3 . 1 . . . . . 29 ARG C . 50887 1
86 . 1 . 1 29 29 ARG CA C 13 54.960 0.3 . 1 . . . . . 29 ARG CA . 50887 1
87 . 1 . 1 29 29 ARG CB C 13 31.794 0.3 . 1 . . . . . 29 ARG CB . 50887 1
88 . 1 . 1 29 29 ARG N N 15 116.036 0.3 . 1 . . . . . 29 ARG N . 50887 1
89 . 1 . 1 30 30 LEU H H 1 7.204 0.020 . 1 . . . . . 30 LEU H . 50887 1
90 . 1 . 1 30 30 LEU C C 13 176.715 0.3 . 1 . . . . . 30 LEU C . 50887 1
91 . 1 . 1 30 30 LEU CA C 13 58.751 0.3 . 1 . . . . . 30 LEU CA . 50887 1
92 . 1 . 1 30 30 LEU CB C 13 43.082 0.3 . 1 . . . . . 30 LEU CB . 50887 1
93 . 1 . 1 30 30 LEU N N 15 119.118 0.3 . 1 . . . . . 30 LEU N . 50887 1
94 . 1 . 1 31 31 LEU H H 1 8.152 0.020 . 1 . . . . . 31 LEU H . 50887 1
95 . 1 . 1 31 31 LEU C C 13 177.422 0.3 . 1 . . . . . 31 LEU C . 50887 1
96 . 1 . 1 31 31 LEU CA C 13 52.517 0.3 . 1 . . . . . 31 LEU CA . 50887 1
97 . 1 . 1 31 31 LEU CB C 13 39.966 0.3 . 1 . . . . . 31 LEU CB . 50887 1
98 . 1 . 1 31 31 LEU N N 15 111.803 0.3 . 1 . . . . . 31 LEU N . 50887 1
99 . 1 . 1 32 32 GLU H H 1 8.013 0.020 . 1 . . . . . 32 GLU H . 50887 1
100 . 1 . 1 32 32 GLU C C 13 175.110 0.3 . 1 . . . . . 32 GLU C . 50887 1
101 . 1 . 1 32 32 GLU CA C 13 54.539 0.3 . 1 . . . . . 32 GLU CA . 50887 1
102 . 1 . 1 32 32 GLU CB C 13 31.120 0.3 . 1 . . . . . 32 GLU CB . 50887 1
103 . 1 . 1 32 32 GLU N N 15 126.167 0.3 . 1 . . . . . 32 GLU N . 50887 1
104 . 1 . 1 34 34 GLY H H 1 8.976 0.020 . 1 . . . . . 34 GLY H . 50887 1
105 . 1 . 1 34 34 GLY CA C 13 45.857 0.3 . 1 . . . . . 34 GLY CA . 50887 1
106 . 1 . 1 34 34 GLY N N 15 113.447 0.3 . 1 . . . . . 34 GLY N . 50887 1
107 . 1 . 1 35 35 TYR H H 1 7.892 0.020 . 1 . . . . . 35 TYR H . 50887 1
108 . 1 . 1 35 35 TYR C C 13 176.185 0.3 . 1 . . . . . 35 TYR C . 50887 1
109 . 1 . 1 35 35 TYR CA C 13 60.267 0.3 . 1 . . . . . 35 TYR CA . 50887 1
110 . 1 . 1 35 35 TYR CB C 13 39.966 0.3 . 1 . . . . . 35 TYR CB . 50887 1
111 . 1 . 1 35 35 TYR N N 15 123.962 0.3 . 1 . . . . . 35 TYR N . 50887 1
112 . 1 . 1 36 36 VAL H H 1 7.838 0.020 . 1 . . . . . 36 VAL H . 50887 1
113 . 1 . 1 36 36 VAL C C 13 174.800 0.3 . 1 . . . . . 36 VAL C . 50887 1
114 . 1 . 1 36 36 VAL CA C 13 58.414 0.3 . 1 . . . . . 36 VAL CA . 50887 1
115 . 1 . 1 36 36 VAL CB C 13 36.175 0.3 . 1 . . . . . 36 VAL CB . 50887 1
116 . 1 . 1 36 36 VAL N N 15 109.274 0.3 . 1 . . . . . 36 VAL N . 50887 1
117 . 1 . 1 37 37 GLU H H 1 9.125 0.020 . 1 . . . . . 37 GLU H . 50887 1
118 . 1 . 1 37 37 GLU C C 13 174.432 0.3 . 1 . . . . . 37 GLU C . 50887 1
119 . 1 . 1 37 37 GLU CA C 13 53.444 0.3 . 1 . . . . . 37 GLU CA . 50887 1
120 . 1 . 1 37 37 GLU CB C 13 34.911 0.3 . 1 . . . . . 37 GLU CB . 50887 1
121 . 1 . 1 37 37 GLU N N 15 118.479 0.3 . 1 . . . . . 37 GLU N . 50887 1
122 . 1 . 1 38 38 VAL H H 1 8.846 0.020 . 1 . . . . . 38 VAL H . 50887 1
123 . 1 . 1 38 38 VAL C C 13 174.432 0.3 . 1 . . . . . 38 VAL C . 50887 1
124 . 1 . 1 38 38 VAL CA C 13 62.537 0.3 . 1 . . . . . 38 VAL CA . 50887 1
125 . 1 . 1 38 38 VAL CB C 13 30.947 0.3 . 1 . . . . . 38 VAL CB . 50887 1
126 . 1 . 1 38 38 VAL N N 15 123.441 0.3 . 1 . . . . . 38 VAL N . 50887 1
127 . 1 . 1 39 39 ASP H H 1 9.504 0.020 . 1 . . . . . 39 ASP H . 50887 1
128 . 1 . 1 39 39 ASP C C 13 174.418 0.3 . 1 . . . . . 39 ASP C . 50887 1
129 . 1 . 1 39 39 ASP CA C 13 53.444 0.3 . 1 . . . . . 39 ASP CA . 50887 1
130 . 1 . 1 39 39 ASP CB C 13 47.126 0.3 . 1 . . . . . 39 ASP CB . 50887 1
131 . 1 . 1 39 39 ASP N N 15 131.805 0.3 . 1 . . . . . 39 ASP N . 50887 1
132 . 1 . 1 40 40 HIS H H 1 7.864 0.020 . 1 . . . . . 40 HIS H . 50887 1
133 . 1 . 1 40 40 HIS C C 13 174.874 0.3 . 1 . . . . . 40 HIS C . 50887 1
134 . 1 . 1 40 40 HIS CA C 13 56.303 0.3 . 1 . . . . . 40 HIS CA . 50887 1
135 . 1 . 1 40 40 HIS CB C 13 30.189 0.3 . 1 . . . . . 40 HIS CB . 50887 1
136 . 1 . 1 40 40 HIS N N 15 123.556 0.3 . 1 . . . . . 40 HIS N . 50887 1
137 . 1 . 1 44 44 TYR H H 1 9.102 0.020 . 1 . . . . . 44 TYR H . 50887 1
138 . 1 . 1 44 44 TYR C C 13 176.833 0.3 . 1 . . . . . 44 TYR C . 50887 1
139 . 1 . 1 44 44 TYR CA C 13 62.795 0.3 . 1 . . . . . 44 TYR CA . 50887 1
140 . 1 . 1 44 44 TYR CB C 13 37.944 0.3 . 1 . . . . . 44 TYR CB . 50887 1
141 . 1 . 1 44 44 TYR N N 15 128.634 0.3 . 1 . . . . . 44 TYR N . 50887 1
142 . 1 . 1 45 45 SER H H 1 8.993 0.020 . 1 . . . . . 45 SER H . 50887 1
143 . 1 . 1 45 45 SER CA C 13 60.936 0.3 . 1 . . . . . 45 SER CA . 50887 1
144 . 1 . 1 45 45 SER CB C 13 62.200 0.3 . 1 . . . . . 45 SER CB . 50887 1
145 . 1 . 1 45 45 SER N N 15 111.800 0.3 . 1 . . . . . 45 SER N . 50887 1
146 . 1 . 1 46 46 ARG H H 1 7.289 0.020 . 1 . . . . . 46 ARG H . 50887 1
147 . 1 . 1 46 46 ARG C C 13 176.170 0.3 . 1 . . . . . 46 ARG C . 50887 1
148 . 1 . 1 46 46 ARG CA C 13 57.066 0.3 . 1 . . . . . 46 ARG CA . 50887 1
149 . 1 . 1 46 46 ARG CB C 13 32.637 0.3 . 1 . . . . . 46 ARG CB . 50887 1
150 . 1 . 1 46 46 ARG N N 15 117.693 0.3 . 1 . . . . . 46 ARG N . 50887 1
151 . 1 . 1 47 47 SER H H 1 8.185 0.020 . 1 . . . . . 47 SER H . 50887 1
152 . 1 . 1 47 47 SER CA C 13 58.751 0.3 . 1 . . . . . 47 SER CA . 50887 1
153 . 1 . 1 47 47 SER CB C 13 65.575 0.3 . 1 . . . . . 47 SER CB . 50887 1
154 . 1 . 1 47 47 SER N N 15 111.803 0.3 . 1 . . . . . 47 SER N . 50887 1
155 . 1 . 1 48 48 LEU H H 1 9.061 0.020 . 1 . . . . . 48 LEU H . 50887 1
156 . 1 . 1 48 48 LEU C C 13 175.242 0.3 . 1 . . . . . 48 LEU C . 50887 1
157 . 1 . 1 48 48 LEU CA C 13 55.887 0.3 . 1 . . . . . 48 LEU CA . 50887 1
158 . 1 . 1 48 48 LEU CB C 13 38.618 0.3 . 1 . . . . . 48 LEU CB . 50887 1
159 . 1 . 1 48 48 LEU N N 15 122.964 0.3 . 1 . . . . . 48 LEU N . 50887 1
160 . 1 . 1 49 49 ASP H H 1 6.962 0.020 . 1 . . . . . 49 ASP H . 50887 1
161 . 1 . 1 49 49 ASP C C 13 175.183 0.3 . 1 . . . . . 49 ASP C . 50887 1
162 . 1 . 1 49 49 ASP CA C 13 52.854 0.3 . 1 . . . . . 49 ASP CA . 50887 1
163 . 1 . 1 49 49 ASP CB C 13 40.808 0.3 . 1 . . . . . 49 ASP CB . 50887 1
164 . 1 . 1 49 49 ASP N N 15 116.178 0.3 . 1 . . . . . 49 ASP N . 50887 1
165 . 1 . 1 50 50 ASP H H 1 9.124 0.020 . 1 . . . . . 50 ASP H . 50887 1
166 . 1 . 1 50 50 ASP C C 13 176.008 0.3 . 1 . . . . . 50 ASP C . 50887 1
167 . 1 . 1 50 50 ASP CA C 13 52.433 0.3 . 1 . . . . . 50 ASP CA . 50887 1
168 . 1 . 1 50 50 ASP CB C 13 42.156 0.3 . 1 . . . . . 50 ASP CB . 50887 1
169 . 1 . 1 50 50 ASP N N 15 126.833 0.3 . 1 . . . . . 50 ASP N . 50887 1
170 . 1 . 1 51 51 SER H H 1 8.729 0.020 . 1 . . . . . 51 SER H . 50887 1
171 . 1 . 1 51 51 SER C C 13 175.331 0.3 . 1 . . . . . 51 SER C . 50887 1
172 . 1 . 1 51 51 SER CA C 13 58.915 0.3 . 1 . . . . . 51 SER CA . 50887 1
173 . 1 . 1 51 51 SER CB C 13 65.570 0.3 . 1 . . . . . 51 SER CB . 50887 1
174 . 1 . 1 51 51 SER N N 15 116.883 0.3 . 1 . . . . . 51 SER N . 50887 1
175 . 1 . 1 53 53 THR H H 1 7.566 0.020 . 1 . . . . . 53 THR H . 50887 1
176 . 1 . 1 53 53 THR C C 13 171.236 0.3 . 1 . . . . . 53 THR C . 50887 1
177 . 1 . 1 53 53 THR CA C 13 64.311 0.3 . 1 . . . . . 53 THR CA . 50887 1
178 . 1 . 1 53 53 THR CB C 13 69.028 0.3 . 1 . . . . . 53 THR CB . 50887 1
179 . 1 . 1 53 53 THR N N 15 109.364 0.3 . 1 . . . . . 53 THR N . 50887 1
180 . 1 . 1 54 54 ASN H H 1 7.444 0.020 . 1 . . . . . 54 ASN H . 50887 1
181 . 1 . 1 54 54 ASN C C 13 174.580 0.3 . 1 . . . . . 54 ASN C . 50887 1
182 . 1 . 1 54 54 ASN CA C 13 50.917 0.3 . 1 . . . . . 54 ASN CA . 50887 1
183 . 1 . 1 54 54 ASN CB C 13 40.976 0.3 . 1 . . . . . 54 ASN CB . 50887 1
184 . 1 . 1 54 54 ASN N N 15 114.678 0.3 . 1 . . . . . 54 ASN N . 50887 1
185 . 1 . 1 55 55 LYS H H 1 7.035 0.020 . 1 . . . . . 55 LYS H . 50887 1
186 . 1 . 1 55 55 LYS C C 13 174.359 0.3 . 1 . . . . . 55 LYS C . 50887 1
187 . 1 . 1 55 55 LYS CA C 13 54.960 0.3 . 1 . . . . . 55 LYS CA . 50887 1
188 . 1 . 1 55 55 LYS CB C 13 36.764 0.3 . 1 . . . . . 55 LYS CB . 50887 1
189 . 1 . 1 55 55 LYS N N 15 118.654 0.3 . 1 . . . . . 55 LYS N . 50887 1
190 . 1 . 1 56 56 VAL H H 1 8.277 0.020 . 1 . . . . . 56 VAL H . 50887 1
191 . 1 . 1 56 56 VAL C C 13 173.401 0.3 . 1 . . . . . 56 VAL C . 50887 1
192 . 1 . 1 56 56 VAL CA C 13 59.594 0.3 . 1 . . . . . 56 VAL CA . 50887 1
193 . 1 . 1 56 56 VAL CB C 13 36.596 0.3 . 1 . . . . . 56 VAL CB . 50887 1
194 . 1 . 1 56 56 VAL N N 15 109.490 0.3 . 1 . . . . . 56 VAL N . 50887 1
195 . 1 . 1 57 57 LEU H H 1 10.240 0.020 . 1 . . . . . 57 LEU H . 50887 1
196 . 1 . 1 57 57 LEU C C 13 176.509 0.3 . 1 . . . . . 57 LEU C . 50887 1
197 . 1 . 1 57 57 LEU CA C 13 53.697 0.3 . 1 . . . . . 57 LEU CA . 50887 1
198 . 1 . 1 57 57 LEU CB C 13 45.441 0.3 . 1 . . . . . 57 LEU CB . 50887 1
199 . 1 . 1 57 57 LEU N N 15 125.201 0.3 . 1 . . . . . 57 LEU N . 50887 1
200 . 1 . 1 58 58 VAL H H 1 8.765 0.020 . 1 . . . . . 58 VAL H . 50887 1
201 . 1 . 1 58 58 VAL C C 13 175.596 0.3 . 1 . . . . . 58 VAL C . 50887 1
202 . 1 . 1 58 58 VAL CA C 13 57.235 0.3 . 1 . . . . . 58 VAL CA . 50887 1
203 . 1 . 1 58 58 VAL CB C 13 36.175 0.3 . 1 . . . . . 58 VAL CB . 50887 1
204 . 1 . 1 58 58 VAL N N 15 118.497 0.3 . 1 . . . . . 58 VAL N . 50887 1
205 . 1 . 1 59 59 LEU H H 1 9.546 0.020 . 1 . . . . . 59 LEU H . 50887 1
206 . 1 . 1 59 59 LEU C C 13 180.117 0.3 . 1 . . . . . 59 LEU C . 50887 1
207 . 1 . 1 59 59 LEU CA C 13 56.308 0.3 . 1 . . . . . 59 LEU CA . 50887 1
208 . 1 . 1 59 59 LEU CB C 13 41.482 0.3 . 1 . . . . . 59 LEU CB . 50887 1
209 . 1 . 1 59 59 LEU N N 15 124.243 0.3 . 1 . . . . . 59 LEU N . 50887 1
210 . 1 . 1 60 60 THR H H 1 7.823 0.020 . 1 . . . . . 60 THR H . 50887 1
211 . 1 . 1 60 60 THR C C 13 180.147 0.3 . 1 . . . . . 60 THR C . 50887 1
212 . 1 . 1 60 60 THR CA C 13 56.224 0.3 . 1 . . . . . 60 THR CA . 50887 1
213 . 1 . 1 60 60 THR CB C 13 68.776 0.3 . 1 . . . . . 60 THR CB . 50887 1
214 . 1 . 1 60 60 THR N N 15 121.122 0.3 . 1 . . . . . 60 THR N . 50887 1
215 . 1 . 1 61 61 ARG H H 1 9.122 0.020 . 1 . . . . . 61 ARG H . 50887 1
216 . 1 . 1 61 61 ARG C C 13 177.672 0.3 . 1 . . . . . 61 ARG C . 50887 1
217 . 1 . 1 61 61 ARG CA C 13 59.425 0.3 . 1 . . . . . 61 ARG CA . 50887 1
218 . 1 . 1 61 61 ARG CB C 13 29.520 0.3 . 1 . . . . . 61 ARG CB . 50887 1
219 . 1 . 1 61 61 ARG N N 15 118.912 0.3 . 1 . . . . . 61 ARG N . 50887 1
220 . 1 . 1 62 62 GLU H H 1 7.698 0.020 . 1 . . . . . 62 GLU H . 50887 1
221 . 1 . 1 62 62 GLU C C 13 177.893 0.3 . 1 . . . . . 62 GLU C . 50887 1
222 . 1 . 1 62 62 GLU CA C 13 57.819 0.3 . 1 . . . . . 62 GLU CA . 50887 1
223 . 1 . 1 62 62 GLU CB C 13 29.515 0.3 . 1 . . . . . 62 GLU CB . 50887 1
224 . 1 . 1 62 62 GLU N N 15 114.827 0.3 . 1 . . . . . 62 GLU N . 50887 1
225 . 1 . 1 63 63 ASN H H 1 6.888 0.020 . 1 . . . . . 63 ASN H . 50887 1
226 . 1 . 1 63 63 ASN C C 13 176.671 0.3 . 1 . . . . . 63 ASN C . 50887 1
227 . 1 . 1 63 63 ASN CA C 13 56.477 0.3 . 1 . . . . . 63 ASN CA . 50887 1
228 . 1 . 1 63 63 ASN CB C 13 40.892 0.3 . 1 . . . . . 63 ASN CB . 50887 1
229 . 1 . 1 63 63 ASN N N 15 115.787 0.3 . 1 . . . . . 63 ASN N . 50887 1
230 . 1 . 1 64 64 ARG H H 1 7.999 0.020 . 1 . . . . . 64 ARG H . 50887 1
231 . 1 . 1 64 64 ARG C C 13 178.718 0.3 . 1 . . . . . 64 ARG C . 50887 1
232 . 1 . 1 64 64 ARG CA C 13 58.414 0.3 . 1 . . . . . 64 ARG CA . 50887 1
233 . 1 . 1 64 64 ARG CB C 13 29.604 0.3 . 1 . . . . . 64 ARG CB . 50887 1
234 . 1 . 1 64 64 ARG N N 15 118.248 0.3 . 1 . . . . . 64 ARG N . 50887 1
235 . 1 . 1 65 65 GLU H H 1 8.209 0.020 . 1 . . . . . 65 GLU H . 50887 1
236 . 1 . 1 65 65 GLU C C 13 178.114 0.3 . 1 . . . . . 65 GLU C . 50887 1
237 . 1 . 1 65 65 GLU CA C 13 57.909 0.3 . 1 . . . . . 65 GLU CA . 50887 1
238 . 1 . 1 65 65 GLU CB C 13 29.436 0.3 . 1 . . . . . 65 GLU CB . 50887 1
239 . 1 . 1 65 65 GLU N N 15 117.141 0.3 . 1 . . . . . 65 GLU N . 50887 1
240 . 1 . 1 66 66 LYS H H 1 7.563 0.020 . 1 . . . . . 66 LYS H . 50887 1
241 . 1 . 1 66 66 LYS C C 13 178.365 0.3 . 1 . . . . . 66 LYS C . 50887 1
242 . 1 . 1 66 66 LYS CA C 13 60.267 0.3 . 1 . . . . . 66 LYS CA . 50887 1
243 . 1 . 1 66 66 LYS CB C 13 33.648 0.3 . 1 . . . . . 66 LYS CB . 50887 1
244 . 1 . 1 66 66 LYS N N 15 121.541 0.3 . 1 . . . . . 66 LYS N . 50887 1
245 . 1 . 1 67 67 GLY H H 1 7.300 0.020 . 1 . . . . . 67 GLY H . 50887 1
246 . 1 . 1 67 67 GLY C C 13 175.198 0.3 . 1 . . . . . 67 GLY C . 50887 1
247 . 1 . 1 67 67 GLY CA C 13 46.705 0.3 . 1 . . . . . 67 GLY CA . 50887 1
248 . 1 . 1 67 67 GLY N N 15 103.763 0.3 . 1 . . . . . 67 GLY N . 50887 1
249 . 1 . 1 72 72 ALA H H 1 9.599 0.020 . 1 . . . . . 72 ALA H . 50887 1
250 . 1 . 1 72 72 ALA C C 13 180.220 0.3 . 1 . . . . . 72 ALA C . 50887 1
251 . 1 . 1 72 72 ALA CA C 13 56.055 0.3 . 1 . . . . . 72 ALA CA . 50887 1
252 . 1 . 1 72 72 ALA CB C 13 19.242 0.3 . 1 . . . . . 72 ALA CB . 50887 1
253 . 1 . 1 72 72 ALA N N 15 119.056 0.3 . 1 . . . . . 72 ALA N . 50887 1
254 . 1 . 1 73 73 GLU H H 1 6.619 0.020 . 1 . . . . . 73 GLU H . 50887 1
255 . 1 . 1 73 73 GLU C C 13 177.643 0.3 . 1 . . . . . 73 GLU C . 50887 1
256 . 1 . 1 73 73 GLU CA C 13 57.488 0.3 . 1 . . . . . 73 GLU CA . 50887 1
257 . 1 . 1 73 73 GLU CB C 13 31.120 0.3 . 1 . . . . . 73 GLU CB . 50887 1
258 . 1 . 1 73 73 GLU N N 15 113.874 0.3 . 1 . . . . . 73 GLU N . 50887 1
259 . 1 . 1 74 74 TYR H H 1 7.722 0.020 . 1 . . . . . 74 TYR H . 50887 1
260 . 1 . 1 74 74 TYR C C 13 175.404 0.3 . 1 . . . . . 74 TYR C . 50887 1
261 . 1 . 1 74 74 TYR CA C 13 57.572 0.3 . 1 . . . . . 74 TYR CA . 50887 1
262 . 1 . 1 74 74 TYR CB C 13 40.134 0.3 . 1 . . . . . 74 TYR CB . 50887 1
263 . 1 . 1 74 74 TYR N N 15 118.376 0.3 . 1 . . . . . 74 TYR N . 50887 1
264 . 1 . 1 75 75 LEU H H 1 8.923 0.020 . 1 . . . . . 75 LEU H . 50887 1
265 . 1 . 1 75 75 LEU C C 13 177.908 0.3 . 1 . . . . . 75 LEU C . 50887 1
266 . 1 . 1 75 75 LEU CA C 13 56.224 0.3 . 1 . . . . . 75 LEU CA . 50887 1
267 . 1 . 1 75 75 LEU CB C 13 42.830 0.3 . 1 . . . . . 75 LEU CB . 50887 1
268 . 1 . 1 75 75 LEU N N 15 116.731 0.3 . 1 . . . . . 75 LEU N . 50887 1
269 . 1 . 1 76 76 GLY H H 1 6.958 0.020 . 1 . . . . . 76 GLY H . 50887 1
270 . 1 . 1 76 76 GLY C C 13 172.739 0.3 . 1 . . . . . 76 GLY C . 50887 1
271 . 1 . 1 76 76 GLY CA C 13 44.430 0.3 . 1 . . . . . 76 GLY CA . 50887 1
272 . 1 . 1 76 76 GLY N N 15 105.805 0.3 . 1 . . . . . 76 GLY N . 50887 1
273 . 1 . 1 77 77 VAL H H 1 8.097 0.020 . 1 . . . . . 77 VAL H . 50887 1
274 . 1 . 1 77 77 VAL C C 13 177.717 0.3 . 1 . . . . . 77 VAL C . 50887 1
275 . 1 . 1 77 77 VAL CA C 13 64.648 0.3 . 1 . . . . . 77 VAL CA . 50887 1
276 . 1 . 1 77 77 VAL CB C 13 30.531 0.3 . 1 . . . . . 77 VAL CB . 50887 1
277 . 1 . 1 77 77 VAL N N 15 125.906 0.3 . 1 . . . . . 77 VAL N . 50887 1
278 . 1 . 1 78 78 GLY H H 1 7.103 0.020 . 1 . . . . . 78 GLY H . 50887 1
279 . 1 . 1 78 78 GLY C C 13 174.786 0.3 . 1 . . . . . 78 GLY C . 50887 1
280 . 1 . 1 78 78 GLY CA C 13 45.020 0.3 . 1 . . . . . 78 GLY CA . 50887 1
281 . 1 . 1 78 78 GLY N N 15 113.189 0.3 . 1 . . . . . 78 GLY N . 50887 1
282 . 1 . 1 79 79 THR H H 1 7.758 0.020 . 1 . . . . . 79 THR H . 50887 1
283 . 1 . 1 79 79 THR C C 13 175.522 0.3 . 1 . . . . . 79 THR C . 50887 1
284 . 1 . 1 79 79 THR CA C 13 61.526 0.3 . 1 . . . . . 79 THR CA . 50887 1
285 . 1 . 1 79 79 THR CB C 13 72.140 0.3 . 1 . . . . . 79 THR CB . 50887 1
286 . 1 . 1 79 79 THR N N 15 110.777 0.3 . 1 . . . . . 79 THR N . 50887 1
287 . 1 . 1 81 81 ARG H H 1 8.277 0.020 . 1 . . . . . 81 ARG H . 50887 1
288 . 1 . 1 81 81 ARG C C 13 179.764 0.3 . 1 . . . . . 81 ARG C . 50887 1
289 . 1 . 1 81 81 ARG CA C 13 60.099 0.3 . 1 . . . . . 81 ARG CA . 50887 1
290 . 1 . 1 81 81 ARG CB C 13 29.857 0.3 . 1 . . . . . 81 ARG CB . 50887 1
291 . 1 . 1 81 81 ARG N N 15 116.883 0.3 . 1 . . . . . 81 ARG N . 50887 1
292 . 1 . 1 82 82 TRP H H 1 7.895 0.020 . 1 . . . . . 82 TRP H . 50887 1
293 . 1 . 1 82 82 TRP C C 13 176.332 0.3 . 1 . . . . . 82 TRP C . 50887 1
294 . 1 . 1 82 82 TRP CA C 13 60.183 0.3 . 1 . . . . . 82 TRP CA . 50887 1
295 . 1 . 1 82 82 TRP CB C 13 29.604 0.3 . 1 . . . . . 82 TRP CB . 50887 1
296 . 1 . 1 82 82 TRP N N 15 120.140 0.3 . 1 . . . . . 82 TRP N . 50887 1
297 . 1 . 1 83 83 GLN H H 1 8.533 0.020 . 1 . . . . . 83 GLN H . 50887 1
298 . 1 . 1 83 83 GLN C C 13 179.513 0.3 . 1 . . . . . 83 GLN C . 50887 1
299 . 1 . 1 83 83 GLN CA C 13 59.252 0.3 . 1 . . . . . 83 GLN CA . 50887 1
300 . 1 . 1 83 83 GLN CB C 13 28.420 0.3 . 1 . . . . . 83 GLN CB . 50887 1
301 . 1 . 1 83 83 GLN N N 15 117.559 0.3 . 1 . . . . . 83 GLN N . 50887 1
302 . 1 . 1 84 84 GLN H H 1 8.133 0.020 . 1 . . . . . 84 GLN H . 50887 1
303 . 1 . 1 84 84 GLN C C 13 178.585 0.3 . 1 . . . . . 84 GLN C . 50887 1
304 . 1 . 1 84 84 GLN CA C 13 58.920 0.3 . 1 . . . . . 84 GLN CA . 50887 1
305 . 1 . 1 84 84 GLN CB C 13 27.751 0.3 . 1 . . . . . 84 GLN CB . 50887 1
306 . 1 . 1 84 84 GLN N N 15 116.997 0.3 . 1 . . . . . 84 GLN N . 50887 1
307 . 1 . 1 85 85 PHE H H 1 7.807 0.020 . 1 . . . . . 85 PHE H . 50887 1
308 . 1 . 1 85 85 PHE C C 13 175.021 0.3 . 1 . . . . . 85 PHE C . 50887 1
309 . 1 . 1 85 85 PHE CA C 13 60.941 0.3 . 1 . . . . . 85 PHE CA . 50887 1
310 . 1 . 1 85 85 PHE CB C 13 40.050 0.3 . 1 . . . . . 85 PHE CB . 50887 1
311 . 1 . 1 85 85 PHE N N 15 124.009 0.3 . 1 . . . . . 85 PHE N . 50887 1
312 . 1 . 1 86 86 GLU H H 1 9.160 0.020 . 1 . . . . . 86 GLU H . 50887 1
313 . 1 . 1 86 86 GLU C C 13 177.893 0.3 . 1 . . . . . 86 GLU C . 50887 1
314 . 1 . 1 86 86 GLU CA C 13 59.678 0.3 . 1 . . . . . 86 GLU CA . 50887 1
315 . 1 . 1 86 86 GLU CB C 13 29.351 0.3 . 1 . . . . . 86 GLU CB . 50887 1
316 . 1 . 1 86 86 GLU N N 15 121.058 0.3 . 1 . . . . . 86 GLU N . 50887 1
317 . 1 . 1 87 87 THR H H 1 7.834 0.020 . 1 . . . . . 87 THR H . 50887 1
318 . 1 . 1 87 87 THR C C 13 177.893 0.3 . 1 . . . . . 87 THR C . 50887 1
319 . 1 . 1 87 87 THR CA C 13 67.007 0.3 . 1 . . . . . 87 THR CA . 50887 1
320 . 1 . 1 87 87 THR CB C 13 68.776 0.3 . 1 . . . . . 87 THR CB . 50887 1
321 . 1 . 1 87 87 THR N N 15 113.603 0.3 . 1 . . . . . 87 THR N . 50887 1
322 . 1 . 1 88 88 PHE H H 1 7.907 0.020 . 1 . . . . . 88 PHE H . 50887 1
323 . 1 . 1 88 88 PHE C C 13 176.317 0.3 . 1 . . . . . 88 PHE C . 50887 1
324 . 1 . 1 88 88 PHE CA C 13 60.352 0.3 . 1 . . . . . 88 PHE CA . 50887 1
325 . 1 . 1 88 88 PHE CB C 13 39.039 0.3 . 1 . . . . . 88 PHE CB . 50887 1
326 . 1 . 1 88 88 PHE N N 15 125.237 0.3 . 1 . . . . . 88 PHE N . 50887 1
327 . 1 . 1 89 89 VAL H H 1 8.493 0.020 . 1 . . . . . 89 VAL H . 50887 1
328 . 1 . 1 89 89 VAL C C 13 178.291 0.3 . 1 . . . . . 89 VAL C . 50887 1
329 . 1 . 1 89 89 VAL CA C 13 66.665 0.3 . 1 . . . . . 89 VAL CA . 50887 1
330 . 1 . 1 89 89 VAL CB C 13 31.789 0.3 . 1 . . . . . 89 VAL CB . 50887 1
331 . 1 . 1 89 89 VAL N N 15 119.088 0.3 . 1 . . . . . 89 VAL N . 50887 1
332 . 1 . 1 90 90 LEU H H 1 8.516 0.020 . 1 . . . . . 90 LEU H . 50887 1
333 . 1 . 1 90 90 LEU C C 13 179.396 0.3 . 1 . . . . . 90 LEU C . 50887 1
334 . 1 . 1 90 90 LEU CA C 13 57.488 0.3 . 1 . . . . . 90 LEU CA . 50887 1
335 . 1 . 1 90 90 LEU CB C 13 42.156 0.3 . 1 . . . . . 90 LEU CB . 50887 1
336 . 1 . 1 90 90 LEU N N 15 115.515 0.3 . 1 . . . . . 90 LEU N . 50887 1
337 . 1 . 1 91 91 THR H H 1 7.576 0.020 . 1 . . . . . 91 THR H . 50887 1
338 . 1 . 1 91 91 THR C C 13 174.197 0.3 . 1 . . . . . 91 THR C . 50887 1
339 . 1 . 1 91 91 THR CA C 13 62.121 0.3 . 1 . . . . . 91 THR CA . 50887 1
340 . 1 . 1 91 91 THR CB C 13 70.629 0.3 . 1 . . . . . 91 THR CB . 50887 1
341 . 1 . 1 91 91 THR N N 15 106.003 0.3 . 1 . . . . . 91 THR N . 50887 1
342 . 1 . 1 92 92 ASN H H 1 7.240 0.020 . 1 . . . . . 92 ASN H . 50887 1
343 . 1 . 1 92 92 ASN C C 13 176.273 0.3 . 1 . . . . . 92 ASN C . 50887 1
344 . 1 . 1 92 92 ASN CA C 13 53.186 0.3 . 1 . . . . . 92 ASN CA . 50887 1
345 . 1 . 1 92 92 ASN CB C 13 37.433 0.3 . 1 . . . . . 92 ASN CB . 50887 1
346 . 1 . 1 92 92 ASN N N 15 121.385 0.3 . 1 . . . . . 92 ASN N . 50887 1
347 . 1 . 1 93 93 LYS H H 1 8.678 0.020 . 1 . . . . . 93 LYS H . 50887 1
348 . 1 . 1 93 93 LYS C C 13 176.715 0.3 . 1 . . . . . 93 LYS C . 50887 1
349 . 1 . 1 93 93 LYS CA C 13 57.398 0.3 . 1 . . . . . 93 LYS CA . 50887 1
350 . 1 . 1 93 93 LYS N N 15 127.333 0.3 . 1 . . . . . 93 LYS N . 50887 1
351 . 1 . 1 94 94 GLN H H 1 7.937 0.020 . 1 . . . . . 94 GLN H . 50887 1
352 . 1 . 1 94 94 GLN C C 13 177.540 0.3 . 1 . . . . . 94 GLN C . 50887 1
353 . 1 . 1 94 94 GLN CA C 13 57.403 0.3 . 1 . . . . . 94 GLN CA . 50887 1
354 . 1 . 1 94 94 GLN CB C 13 29.604 0.3 . 1 . . . . . 94 GLN CB . 50887 1
355 . 1 . 1 94 94 GLN N N 15 115.234 0.3 . 1 . . . . . 94 GLN N . 50887 1
356 . 1 . 1 95 95 PHE H H 1 7.015 0.020 . 1 . . . . . 95 PHE H . 50887 1
357 . 1 . 1 95 95 PHE C C 13 176.715 0.3 . 1 . . . . . 95 PHE C . 50887 1
358 . 1 . 1 95 95 PHE CA C 13 55.803 0.3 . 1 . . . . . 95 PHE CA . 50887 1
359 . 1 . 1 95 95 PHE CB C 13 39.039 0.3 . 1 . . . . . 95 PHE CB . 50887 1
360 . 1 . 1 95 95 PHE N N 15 116.186 0.3 . 1 . . . . . 95 PHE N . 50887 1
361 . 1 . 1 98 98 LYS H H 1 8.139 0.020 . 1 . . . . . 98 LYS H . 50887 1
362 . 1 . 1 98 98 LYS C C 13 178.821 0.3 . 1 . . . . . 98 LYS C . 50887 1
363 . 1 . 1 98 98 LYS CA C 13 59.509 0.3 . 1 . . . . . 98 LYS CA . 50887 1
364 . 1 . 1 98 98 LYS CB C 13 32.805 0.3 . 1 . . . . . 98 LYS CB . 50887 1
365 . 1 . 1 98 98 LYS N N 15 115.500 0.3 . 1 . . . . . 98 LYS N . 50887 1
366 . 1 . 1 99 99 LYS H H 1 7.856 0.020 . 1 . . . . . 99 LYS H . 50887 1
367 . 1 . 1 99 99 LYS C C 13 177.982 0.3 . 1 . . . . . 99 LYS C . 50887 1
368 . 1 . 1 99 99 LYS CA C 13 60.267 0.3 . 1 . . . . . 99 LYS CA . 50887 1
369 . 1 . 1 99 99 LYS CB C 13 32.300 0.3 . 1 . . . . . 99 LYS CB . 50887 1
370 . 1 . 1 99 99 LYS N N 15 121.278 0.3 . 1 . . . . . 99 LYS N . 50887 1
371 . 1 . 1 100 100 ARG H H 1 8.374 0.020 . 1 . . . . . 100 ARG H . 50887 1
372 . 1 . 1 100 100 ARG C C 13 177.142 0.3 . 1 . . . . . 100 ARG C . 50887 1
373 . 1 . 1 100 100 ARG CA C 13 60.267 0.3 . 1 . . . . . 100 ARG CA . 50887 1
374 . 1 . 1 100 100 ARG CB C 13 29.772 0.3 . 1 . . . . . 100 ARG CB . 50887 1
375 . 1 . 1 100 100 ARG N N 15 118.789 0.3 . 1 . . . . . 100 ARG N . 50887 1
376 . 1 . 1 101 101 ASP H H 1 8.250 0.020 . 1 . . . . . 101 ASP H . 50887 1
377 . 1 . 1 101 101 ASP C C 13 179.013 0.3 . 1 . . . . . 101 ASP C . 50887 1
378 . 1 . 1 101 101 ASP CA C 13 56.561 0.3 . 1 . . . . . 101 ASP CA . 50887 1
379 . 1 . 1 101 101 ASP CB C 13 40.218 0.3 . 1 . . . . . 101 ASP CB . 50887 1
380 . 1 . 1 101 101 ASP N N 15 115.363 0.3 . 1 . . . . . 101 ASP N . 50887 1
381 . 1 . 1 102 102 ARG H H 1 7.413 0.020 . 1 . . . . . 102 ARG H . 50887 1
382 . 1 . 1 102 102 ARG C C 13 176.671 0.3 . 1 . . . . . 102 ARG C . 50887 1
383 . 1 . 1 102 102 ARG CA C 13 59.004 0.3 . 1 . . . . . 102 ARG CA . 50887 1
384 . 1 . 1 102 102 ARG CB C 13 29.941 0.3 . 1 . . . . . 102 ARG CB . 50887 1
385 . 1 . 1 102 102 ARG N N 15 119.059 0.3 . 1 . . . . . 102 ARG N . 50887 1
386 . 1 . 1 103 103 LEU H H 1 8.062 0.020 . 1 . . . . . 103 LEU H . 50887 1
387 . 1 . 1 103 103 LEU C C 13 178.144 0.3 . 1 . . . . . 103 LEU C . 50887 1
388 . 1 . 1 103 103 LEU CA C 13 58.667 0.3 . 1 . . . . . 103 LEU CA . 50887 1
389 . 1 . 1 103 103 LEU CB C 13 42.156 0.3 . 1 . . . . . 103 LEU CB . 50887 1
390 . 1 . 1 103 103 LEU N N 15 116.875 0.3 . 1 . . . . . 103 LEU N . 50887 1
391 . 1 . 1 104 104 LEU H H 1 7.417 0.020 . 1 . . . . . 104 LEU H . 50887 1
392 . 1 . 1 104 104 LEU C C 13 176.303 0.3 . 1 . . . . . 104 LEU C . 50887 1
393 . 1 . 1 104 104 LEU CA C 13 53.781 0.3 . 1 . . . . . 104 LEU CA . 50887 1
394 . 1 . 1 104 104 LEU CB C 13 40.892 0.3 . 1 . . . . . 104 LEU CB . 50887 1
395 . 1 . 1 104 104 LEU N N 15 112.496 0.3 . 1 . . . . . 104 LEU N . 50887 1
396 . 1 . 1 105 105 ARG H H 1 7.127 0.020 . 1 . . . . . 105 ARG H . 50887 1
397 . 1 . 1 105 105 ARG C C 13 176.818 0.3 . 1 . . . . . 105 ARG C . 50887 1
398 . 1 . 1 105 105 ARG CA C 13 56.729 0.3 . 1 . . . . . 105 ARG CA . 50887 1
399 . 1 . 1 105 105 ARG CB C 13 30.194 0.3 . 1 . . . . . 105 ARG CB . 50887 1
400 . 1 . 1 105 105 ARG N N 15 120.162 0.3 . 1 . . . . . 105 ARG N . 50887 1
401 . 1 . 1 106 106 LEU H H 1 8.408 0.020 . 1 . . . . . 106 LEU H . 50887 1
402 . 1 . 1 106 106 LEU C C 13 176.509 0.3 . 1 . . . . . 106 LEU C . 50887 1
403 . 1 . 1 106 106 LEU CA C 13 56.219 0.3 . 1 . . . . . 106 LEU CA . 50887 1
404 . 1 . 1 106 106 LEU CB C 13 42.488 0.3 . 1 . . . . . 106 LEU CB . 50887 1
405 . 1 . 1 106 106 LEU N N 15 121.136 0.3 . 1 . . . . . 106 LEU N . 50887 1
406 . 1 . 1 107 107 HIS H H 1 7.359 0.020 . 1 . . . . . 107 HIS H . 50887 1
407 . 1 . 1 107 107 HIS C C 13 173.372 0.3 . 1 . . . . . 107 HIS C . 50887 1
408 . 1 . 1 107 107 HIS CA C 13 54.618 0.3 . 1 . . . . . 107 HIS CA . 50887 1
409 . 1 . 1 107 107 HIS CB C 13 32.632 0.3 . 1 . . . . . 107 HIS CB . 50887 1
410 . 1 . 1 107 107 HIS N N 15 113.729 0.3 . 1 . . . . . 107 HIS N . 50887 1
411 . 1 . 1 108 108 TYR H H 1 8.379 0.020 . 1 . . . . . 108 TYR H . 50887 1
412 . 1 . 1 108 108 TYR C C 13 173.387 0.3 . 1 . . . . . 108 TYR C . 50887 1
413 . 1 . 1 108 108 TYR CA C 13 62.121 0.3 . 1 . . . . . 108 TYR CA . 50887 1
414 . 1 . 1 108 108 TYR CB C 13 41.482 0.3 . 1 . . . . . 108 TYR CB . 50887 1
415 . 1 . 1 108 108 TYR N N 15 126.869 0.3 . 1 . . . . . 108 TYR N . 50887 1
stop_
save_