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 50026
_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 $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 0.05
_Assigned_chem_shift_list.Chem_shift_13C_err 0.1
_Assigned_chem_shift_list.Chem_shift_15N_err 0.1
_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 'based on linewidths and signal-to-noise ratios in 3D spectra'
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D NCC' . . . 50026 1
2 '3D CANH' . . . 50026 1
3 '3D CONH' . . . 50026 1
4 '3D NHH' . . . 50026 1
5 '3D HN(CO)CX' . . . 50026 1
6 '3D CAN(H)H' . . . 50026 1
7 '3D CON(H)H' . . . 50026 1
8 '3D NHH' . . . 50026 1
9 '3D CANH' . . . 50026 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 51 51 GLY H H 1 8.473 0.05 . . . . . . . 40 G HN . 50026 1
2 . 1 . 1 51 51 GLY C C 13 172.714 0.1 . . . . . . . 40 G CO . 50026 1
3 . 1 . 1 51 51 GLY CA C 13 45.137 0.1 . . . . . . . 40 G CA . 50026 1
4 . 1 . 1 51 51 GLY N N 15 107.143 0.1 . . . . . . . 40 G N . 50026 1
5 . 1 . 1 52 52 TYR H H 1 6.912 0.05 . . . . . . . 41 Y HN . 50026 1
6 . 1 . 1 52 52 TYR C C 13 176.324 0.1 . . . . . . . 41 Y CO . 50026 1
7 . 1 . 1 52 52 TYR CA C 13 57.563 0.1 . . . . . . . 41 Y CA . 50026 1
8 . 1 . 1 52 52 TYR CB C 13 35.583 0.1 . . . . . . . 41 Y CB . 50026 1
9 . 1 . 1 52 52 TYR N N 15 108.868 0.1 . . . . . . . 41 Y N . 50026 1
10 . 1 . 1 53 53 SER H H 1 7.630 0.05 . . . . . . . 42 S HN . 50026 1
11 . 1 . 1 53 53 SER C C 13 172.138 0.1 . . . . . . . 42 S CO . 50026 1
12 . 1 . 1 53 53 SER CA C 13 59.474 0.1 . . . . . . . 42 S CA . 50026 1
13 . 1 . 1 53 53 SER CB C 13 65.014 0.1 . . . . . . . 42 S CB . 50026 1
14 . 1 . 1 53 53 SER N N 15 114.424 0.1 . . . . . . . 42 S N . 50026 1
15 . 1 . 1 54 54 GLN H H 1 9.267 0.05 . . . . . . . 43 Q HN . 50026 1
16 . 1 . 1 54 54 GLN C C 13 176.337 0.1 . . . . . . . 43 Q CO . 50026 1
17 . 1 . 1 54 54 GLN CA C 13 55.069 0.1 . . . . . . . 43 Q CA . 50026 1
18 . 1 . 1 54 54 GLN CB C 13 33.463 0.1 . . . . . . . 43 Q CB . 50026 1
19 . 1 . 1 54 54 GLN N N 15 124.453 0.1 . . . . . . . 43 Q N . 50026 1
20 . 1 . 1 71 71 SER H H 1 8.565 0.05 . . . . . . . 44 S HN . 50026 1
21 . 1 . 1 71 71 SER C C 13 173.782 0.1 . . . . . . . 44 S CO . 50026 1
22 . 1 . 1 71 71 SER CA C 13 56.860 0.1 . . . . . . . 44 S CA . 50026 1
23 . 1 . 1 71 71 SER CB C 13 65.385 0.1 . . . . . . . 44 S CB . 50026 1
24 . 1 . 1 71 71 SER N N 15 121.583 0.1 . . . . . . . 44 S N . 50026 1
25 . 1 . 1 72 72 THR H H 1 9.289 0.05 . . . . . . . 45 T HN . 50026 1
26 . 1 . 1 72 72 THR C C 13 173.610 0.1 . . . . . . . 45 T CO . 50026 1
27 . 1 . 1 72 72 THR CA C 13 63.302 0.1 . . . . . . . 45 T CA . 50026 1
28 . 1 . 1 72 72 THR CB C 13 71.703 0.1 . . . . . . . 45 T CB . 50026 1
29 . 1 . 1 72 72 THR CG2 C 13 21.310 0.1 . . . . . . . 45 T CG . 50026 1
30 . 1 . 1 72 72 THR N N 15 121.773 0.1 . . . . . . . 45 T N . 50026 1
31 . 1 . 1 73 73 ASP H H 1 8.873 0.05 . . . . . . . 46 D HN . 50026 1
32 . 1 . 1 73 73 ASP C C 13 176.717 0.1 . . . . . . . 46 D CO . 50026 1
33 . 1 . 1 73 73 ASP CA C 13 51.123 0.1 . . . . . . . 46 D CA . 50026 1
34 . 1 . 1 73 73 ASP CB C 13 42.929 0.1 . . . . . . . 46 D CB . 50026 1
35 . 1 . 1 73 73 ASP N N 15 127.169 0.1 . . . . . . . 46 D N . 50026 1
36 . 1 . 1 74 74 THR H H 1 10.019 0.05 . . . . . . . 47 T HN . 50026 1
37 . 1 . 1 74 74 THR C C 13 173.863 0.1 . . . . . . . 47 T CO . 50026 1
38 . 1 . 1 74 74 THR CA C 13 63.538 0.1 . . . . . . . 47 T CA . 50026 1
39 . 1 . 1 74 74 THR CB C 13 71.534 0.1 . . . . . . . 47 T CB . 50026 1
40 . 1 . 1 74 74 THR N N 15 121.453 0.1 . . . . . . . 47 T N . 50026 1
41 . 1 . 1 75 75 SER H H 1 9.303 0.05 . . . . . . . 48 S HN . 50026 1
42 . 1 . 1 75 75 SER C C 13 176.776 0.1 . . . . . . . 48 S CO . 50026 1
43 . 1 . 1 75 75 SER CA C 13 59.443 0.1 . . . . . . . 48 S CA . 50026 1
44 . 1 . 1 75 75 SER CB C 13 63.282 0.1 . . . . . . . 48 S CB . 50026 1
45 . 1 . 1 75 75 SER N N 15 121.203 0.1 . . . . . . . 48 S N . 50026 1
46 . 1 . 1 76 76 GLY H H 1 8.288 0.05 . . . . . . . 49 G HN . 50026 1
47 . 1 . 1 76 76 GLY C C 13 174.024 0.1 . . . . . . . 49 G CO . 50026 1
48 . 1 . 1 76 76 GLY CA C 13 44.712 0.1 . . . . . . . 49 G CA . 50026 1
49 . 1 . 1 76 76 GLY N N 15 114.154 0.1 . . . . . . . 49 G N . 50026 1
50 . 1 . 1 77 77 TYR H H 1 7.168 0.05 . . . . . . . 50 Y HN . 50026 1
51 . 1 . 1 77 77 TYR C C 13 173.966 0.1 . . . . . . . 50 Y CO . 50026 1
52 . 1 . 1 77 77 TYR CA C 13 61.652 0.1 . . . . . . . 50 Y CA . 50026 1
53 . 1 . 1 77 77 TYR CB C 13 37.448 0.1 . . . . . . . 50 Y CB . 50026 1
54 . 1 . 1 77 77 TYR N N 15 104.835 0.1 . . . . . . . 50 Y N . 50026 1
55 . 1 . 1 78 78 GLY H H 1 7.748 0.05 . . . . . . . 51 G HN . 50026 1
56 . 1 . 1 78 78 GLY C C 13 172.682 0.1 . . . . . . . 51 G CO . 50026 1
57 . 1 . 1 78 78 GLY CA C 13 43.159 0.1 . . . . . . . 51 G CA . 50026 1
58 . 1 . 1 78 78 GLY N N 15 108.145 0.1 . . . . . . . 51 G N . 50026 1
59 . 1 . 1 79 79 GLN H H 1 7.891 0.05 . . . . . . . 52 Q HN . 50026 1
60 . 1 . 1 79 79 GLN HE21 H 1 6.467 0.05 . . . . . . . 52 Q HE21 . 50026 1
61 . 1 . 1 79 79 GLN HE22 H 1 6.467 0.05 . . . . . . . 52 Q HE22 . 50026 1
62 . 1 . 1 79 79 GLN C C 13 176.684 0.1 . . . . . . . 52 Q CO . 50026 1
63 . 1 . 1 79 79 GLN CA C 13 56.503 0.1 . . . . . . . 52 Q CA . 50026 1
64 . 1 . 1 79 79 GLN CB C 13 26.685 0.1 . . . . . . . 52 Q CB . 50026 1
65 . 1 . 1 79 79 GLN CG C 13 35.005 0.1 . . . . . . . 52 Q CG . 50026 1
66 . 1 . 1 79 79 GLN CD C 13 181.530 0.1 . . . . . . . 52 Q CD . 50026 1
67 . 1 . 1 79 79 GLN N N 15 110.284 0.1 . . . . . . . 52 Q N . 50026 1
68 . 1 . 1 79 79 GLN NE2 N 15 110.837 0.1 . . . . . . . 52 Q NE2 . 50026 1
69 . 1 . 1 80 80 SER H H 1 8.168 0.05 . . . . . . . 53 S HN . 50026 1
70 . 1 . 1 80 80 SER C C 13 173.676 0.1 . . . . . . . 53 S CO . 50026 1
71 . 1 . 1 80 80 SER CA C 13 58.231 0.1 . . . . . . . 53 S CA . 50026 1
72 . 1 . 1 80 80 SER CB C 13 66.094 0.1 . . . . . . . 53 S CB . 50026 1
73 . 1 . 1 80 80 SER N N 15 116.443 0.1 . . . . . . . 53 S N . 50026 1
74 . 1 . 1 81 81 SER H H 1 8.701 0.05 . . . . . . . 54 S HN . 50026 1
75 . 1 . 1 81 81 SER C C 13 175.787 0.1 . . . . . . . 54 S CO . 50026 1
76 . 1 . 1 81 81 SER CA C 13 56.294 0.1 . . . . . . . 54 S CA . 50026 1
77 . 1 . 1 81 81 SER CB C 13 65.735 0.1 . . . . . . . 54 S CB . 50026 1
78 . 1 . 1 81 81 SER N N 15 114.034 0.1 . . . . . . . 54 S N . 50026 1
79 . 1 . 1 82 82 TYR H H 1 7.875 0.05 . . . . . . . 55 Y HN . 50026 1
80 . 1 . 1 82 82 TYR C C 13 173.791 0.1 . . . . . . . 55 Y CO . 50026 1
81 . 1 . 1 82 82 TYR N N 15 123.258 0.1 . . . . . . . 55 Y N . 50026 1
82 . 1 . 1 83 83 SER H H 1 9.159 0.05 . . . . . . . 56 S HN . 50026 1
83 . 1 . 1 83 83 SER CA C 13 52.719 0.1 . . . . . . . 56 S CA . 50026 1
84 . 1 . 1 83 83 SER N N 15 124.634 0.1 . . . . . . . 56 S N . 50026 1
85 . 1 . 1 91 91 GLN C C 13 172.378 0.1 . . . . . . . 62 Q CO . 50026 1
86 . 1 . 1 92 92 ASN H H 1 8.184 0.05 . . . . . . . 63 N HN . 50026 1
87 . 1 . 1 92 92 ASN C C 13 177.523 0.1 . . . . . . . 63 N CO . 50026 1
88 . 1 . 1 92 92 ASN CA C 13 56.354 0.1 . . . . . . . 63 N CA . 50026 1
89 . 1 . 1 92 92 ASN CB C 13 41.030 0.1 . . . . . . . 63 N CB . 50026 1
90 . 1 . 1 92 92 ASN N N 15 120.894 0.1 . . . . . . . 63 N N . 50026 1
91 . 1 . 1 93 93 THR H H 1 9.039 0.05 . . . . . . . 64 T HN . 50026 1
92 . 1 . 1 93 93 THR CA C 13 61.316 0.1 . . . . . . . 64 T CA . 50026 1
93 . 1 . 1 93 93 THR N N 15 114.753 0.1 . . . . . . . 64 T N . 50026 1
94 . 1 . 1 94 94 GLY H H 1 9.100 0.05 . . . . . . . 65 G HN . 50026 1
95 . 1 . 1 94 94 GLY C C 13 171.358 0.1 . . . . . . . 65 G CO . 50026 1
96 . 1 . 1 94 94 GLY CA C 13 45.837 0.1 . . . . . . . 65 G CA . 50026 1
97 . 1 . 1 94 94 GLY N N 15 115.967 0.1 . . . . . . . 65 G N . 50026 1
98 . 1 . 1 95 95 TYR H H 1 8.776 0.05 . . . . . . . 66 Y HN . 50026 1
99 . 1 . 1 95 95 TYR CA C 13 57.961 0.1 . . . . . . . 66 Y CA . 50026 1
100 . 1 . 1 95 95 TYR CB C 13 41.502 0.1 . . . . . . . 66 Y CB . 50026 1
101 . 1 . 1 95 95 TYR N N 15 122.885 0.1 . . . . . . . 66 Y N . 50026 1
102 . 1 . 1 96 96 GLY H H 1 9.116 0.05 . . . . . . . 67 G HN . 50026 1
103 . 1 . 1 96 96 GLY C C 13 174.333 0.1 . . . . . . . 67 G CO . 50026 1
104 . 1 . 1 96 96 GLY CA C 13 47.310 0.1 . . . . . . . 67 G CA . 50026 1
105 . 1 . 1 96 96 GLY N N 15 115.021 0.1 . . . . . . . 67 G N . 50026 1
106 . 1 . 1 97 97 THR H H 1 7.795 0.05 . . . . . . . 68 T HN . 50026 1
107 . 1 . 1 97 97 THR C C 13 172.514 0.1 . . . . . . . 68 T CO . 50026 1
108 . 1 . 1 97 97 THR CA C 13 61.477 0.1 . . . . . . . 68 T CA . 50026 1
109 . 1 . 1 97 97 THR CB C 13 70.163 0.1 . . . . . . . 68 T CB . 50026 1
110 . 1 . 1 97 97 THR N N 15 115.211 0.1 . . . . . . . 68 T N . 50026 1
111 . 1 . 1 98 98 GLN H H 1 8.908 0.05 . . . . . . . 69 Q HN . 50026 1
112 . 1 . 1 98 98 GLN C C 13 174.325 0.1 . . . . . . . 69 Q CO . 50026 1
113 . 1 . 1 98 98 GLN CA C 13 54.087 0.1 . . . . . . . 69 Q CA . 50026 1
114 . 1 . 1 98 98 GLN CB C 13 34.113 0.1 . . . . . . . 69 Q CB . 50026 1
115 . 1 . 1 98 98 GLN N N 15 127.054 0.1 . . . . . . . 69 Q N . 50026 1
116 . 1 . 1 99 99 SER H H 1 8.444 0.05 . . . . . . . 70 S HN . 50026 1
117 . 1 . 1 99 99 SER C C 13 174.309 0.1 . . . . . . . 70 S CO . 50026 1
118 . 1 . 1 99 99 SER CA C 13 54.726 0.1 . . . . . . . 70 S CA . 50026 1
119 . 1 . 1 99 99 SER CB C 13 63.874 0.1 . . . . . . . 70 S CB . 50026 1
120 . 1 . 1 99 99 SER N N 15 120.143 0.1 . . . . . . . 70 S N . 50026 1
121 . 1 . 1 101 101 PRO C C 13 176.843 0.1 . . . . . . . 72 P CO . 50026 1
122 . 1 . 1 101 101 PRO CA C 13 62.460 0.1 . . . . . . . 72 P CA . 50026 1
123 . 1 . 1 101 101 PRO CB C 13 31.873 0.1 . . . . . . . 72 P CB . 50026 1
124 . 1 . 1 102 102 GLN H H 1 9.087 0.05 . . . . . . . 73 Q HN . 50026 1
125 . 1 . 1 102 102 GLN C C 13 175.545 0.1 . . . . . . . 73 Q CO . 50026 1
126 . 1 . 1 102 102 GLN CA C 13 54.525 0.1 . . . . . . . 73 Q CA . 50026 1
127 . 1 . 1 102 102 GLN CB C 13 32.871 0.1 . . . . . . . 73 Q CB . 50026 1
128 . 1 . 1 102 102 GLN CG C 13 34.229 0.1 . . . . . . . 73 Q CG . 50026 1
129 . 1 . 1 102 102 GLN N N 15 121.299 0.1 . . . . . . . 73 Q N . 50026 1
130 . 1 . 1 103 103 GLY H H 1 8.659 0.05 . . . . . . . 74 G HN . 50026 1
131 . 1 . 1 103 103 GLY C C 13 174.407 0.1 . . . . . . . 74 G CO . 50026 1
132 . 1 . 1 103 103 GLY CA C 13 46.256 0.1 . . . . . . . 74 G CA . 50026 1
133 . 1 . 1 103 103 GLY N N 15 110.149 0.1 . . . . . . . 74 G N . 50026 1
134 . 1 . 1 104 104 TYR H H 1 9.184 0.05 . . . . . . . 75 Y HN . 50026 1
135 . 1 . 1 104 104 TYR C C 13 177.985 0.1 . . . . . . . 75 Y CO . 50026 1
136 . 1 . 1 104 104 TYR CA C 13 59.983 0.1 . . . . . . . 75 Y CA . 50026 1
137 . 1 . 1 104 104 TYR CB C 13 39.530 0.1 . . . . . . . 75 Y CB . 50026 1
138 . 1 . 1 104 104 TYR N N 15 126.822 0.1 . . . . . . . 75 Y N . 50026 1
139 . 1 . 1 105 105 GLY H H 1 7.652 0.05 . . . . . . . 76 G HN . 50026 1
140 . 1 . 1 105 105 GLY C C 13 176.078 0.1 . . . . . . . 76 G CO . 50026 1
141 . 1 . 1 105 105 GLY CA C 13 45.774 0.1 . . . . . . . 76 G CA . 50026 1
142 . 1 . 1 105 105 GLY N N 15 103.533 0.1 . . . . . . . 76 G N . 50026 1
143 . 1 . 1 106 106 SER H H 1 9.265 0.05 . . . . . . . 77 S HN . 50026 1
144 . 1 . 1 106 106 SER C C 13 175.095 0.1 . . . . . . . 77 S CO . 50026 1
145 . 1 . 1 106 106 SER CA C 13 58.606 0.1 . . . . . . . 77 S CA . 50026 1
146 . 1 . 1 106 106 SER CB C 13 65.057 0.1 . . . . . . . 77 S CB . 50026 1
147 . 1 . 1 106 106 SER N N 15 118.837 0.1 . . . . . . . 77 S N . 50026 1
148 . 1 . 1 107 107 THR H H 1 8.759 0.05 . . . . . . . 78 T HN . 50026 1
149 . 1 . 1 107 107 THR C C 13 174.013 0.1 . . . . . . . 78 T CO . 50026 1
150 . 1 . 1 107 107 THR CA C 13 62.654 0.1 . . . . . . . 78 T CA . 50026 1
151 . 1 . 1 107 107 THR CB C 13 69.914 0.1 . . . . . . . 78 T CB . 50026 1
152 . 1 . 1 107 107 THR CG2 C 13 19.671 0.1 . . . . . . . 78 T CG . 50026 1
153 . 1 . 1 107 107 THR N N 15 123.364 0.1 . . . . . . . 78 T N . 50026 1
154 . 1 . 1 108 108 GLY H H 1 9.202 0.05 . . . . . . . 79 G HN . 50026 1
155 . 1 . 1 108 108 GLY C C 13 172.636 0.1 . . . . . . . 79 G CO . 50026 1
156 . 1 . 1 108 108 GLY CA C 13 43.884 0.1 . . . . . . . 79 G CA . 50026 1
157 . 1 . 1 108 108 GLY N N 15 115.758 0.1 . . . . . . . 79 G N . 50026 1
158 . 1 . 1 109 109 GLY H H 1 8.047 0.05 . . . . . . . 80 G HN . 50026 1
159 . 1 . 1 109 109 GLY C C 13 172.094 0.1 . . . . . . . 80 G CO . 50026 1
160 . 1 . 1 109 109 GLY CA C 13 43.836 0.1 . . . . . . . 80 G CA . 50026 1
161 . 1 . 1 109 109 GLY N N 15 109.771 0.1 . . . . . . . 80 G N . 50026 1
162 . 1 . 1 110 110 TYR H H 1 7.678 0.05 . . . . . . . 81 Y HN . 50026 1
163 . 1 . 1 110 110 TYR C C 13 177.472 0.1 . . . . . . . 81 Y CO . 50026 1
164 . 1 . 1 110 110 TYR CA C 13 61.585 0.1 . . . . . . . 81 Y CA . 50026 1
165 . 1 . 1 110 110 TYR CB C 13 39.341 0.1 . . . . . . . 81 Y CB . 50026 1
166 . 1 . 1 110 110 TYR N N 15 121.219 0.1 . . . . . . . 81 Y N . 50026 1
167 . 1 . 1 111 111 GLY H H 1 8.508 0.05 . . . . . . . 82 G HN . 50026 1
168 . 1 . 1 111 111 GLY C C 13 175.207 0.1 . . . . . . . 82 G CO . 50026 1
169 . 1 . 1 111 111 GLY CA C 13 48.980 0.1 . . . . . . . 82 G CA . 50026 1
170 . 1 . 1 111 111 GLY N N 15 107.848 0.1 . . . . . . . 82 G N . 50026 1
171 . 1 . 1 112 112 SER H H 1 6.948 0.05 . . . . . . . 83 S HN . 50026 1
172 . 1 . 1 112 112 SER C C 13 173.326 0.1 . . . . . . . 83 S CO . 50026 1
173 . 1 . 1 112 112 SER CA C 13 57.444 0.1 . . . . . . . 83 S CA . 50026 1
174 . 1 . 1 112 112 SER CB C 13 65.723 0.1 . . . . . . . 83 S CB . 50026 1
175 . 1 . 1 112 112 SER N N 15 109.387 0.1 . . . . . . . 83 S N . 50026 1
176 . 1 . 1 113 113 SER H H 1 7.593 0.05 . . . . . . . 84 S HN . 50026 1
177 . 1 . 1 113 113 SER C C 13 175.620 0.1 . . . . . . . 84 S CO . 50026 1
178 . 1 . 1 113 113 SER CA C 13 55.975 0.1 . . . . . . . 84 S CA . 50026 1
179 . 1 . 1 113 113 SER N N 15 116.540 0.1 . . . . . . . 84 S N . 50026 1
180 . 1 . 1 114 114 GLN H H 1 8.140 0.05 . . . . . . . 85 Q HN . 50026 1
181 . 1 . 1 114 114 GLN CA C 13 54.879 0.1 . . . . . . . 85 Q CA . 50026 1
182 . 1 . 1 114 114 GLN N N 15 127.874 0.1 . . . . . . . 85 Q N . 50026 1
183 . 1 . 1 115 115 SER H H 1 8.927 0.05 . . . . . . . 86 S HN . 50026 1
184 . 1 . 1 115 115 SER CA C 13 56.132 0.1 . . . . . . . 86 S CA . 50026 1
185 . 1 . 1 115 115 SER CB C 13 66.674 0.1 . . . . . . . 86 S CB . 50026 1
186 . 1 . 1 115 115 SER N N 15 120.160 0.1 . . . . . . . 86 S N . 50026 1
187 . 1 . 1 116 116 SER C C 13 173.532 0.1 . . . . . . . 87 S CO . 50026 1
188 . 1 . 1 116 116 SER CA C 13 58.708 0.1 . . . . . . . 87 S CA . 50026 1
189 . 1 . 1 116 116 SER CB C 13 65.244 0.1 . . . . . . . 87 S CB . 50026 1
190 . 1 . 1 116 116 SER N N 15 113.418 0.1 . . . . . . . 87 S N . 50026 1
191 . 1 . 1 117 117 GLN H H 1 7.296 0.05 . . . . . . . 88 Q HN . 50026 1
192 . 1 . 1 117 117 GLN C C 13 172.524 0.1 . . . . . . . 88 Q CO . 50026 1
193 . 1 . 1 117 117 GLN CA C 13 57.998 0.1 . . . . . . . 88 Q CA . 50026 1
194 . 1 . 1 117 117 GLN N N 15 107.361 0.1 . . . . . . . 88 Q N . 50026 1
195 . 1 . 1 118 118 SER H H 1 7.897 0.05 . . . . . . . 89 S HN . 50026 1
196 . 1 . 1 118 118 SER C C 13 174.458 0.1 . . . . . . . 89 S CO . 50026 1
197 . 1 . 1 118 118 SER CA C 13 56.329 0.1 . . . . . . . 89 S CA . 50026 1
198 . 1 . 1 118 118 SER CB C 13 65.340 0.1 . . . . . . . 89 S CB . 50026 1
199 . 1 . 1 118 118 SER N N 15 118.425 0.1 . . . . . . . 89 S N . 50026 1
200 . 1 . 1 119 119 SER H H 1 8.593 0.05 . . . . . . . 90 S HN . 50026 1
201 . 1 . 1 119 119 SER N N 15 117.903 0.1 . . . . . . . 90 S N . 50026 1
202 . 1 . 1 120 120 TYR C C 13 176.785 0.1 . . . . . . . 91 Y CO . 50026 1
203 . 1 . 1 120 120 TYR CA C 13 55.334 0.1 . . . . . . . 91 Y CA . 50026 1
204 . 1 . 1 121 121 GLY H H 1 7.592 0.05 . . . . . . . 92 G HN . 50026 1
205 . 1 . 1 121 121 GLY C C 13 174.775 0.1 . . . . . . . 92 G CO . 50026 1
206 . 1 . 1 121 121 GLY CA C 13 46.905 0.1 . . . . . . . 92 G CA . 50026 1
207 . 1 . 1 121 121 GLY N N 15 100.103 0.1 . . . . . . . 92 G N . 50026 1
208 . 1 . 1 122 122 GLN H H 1 7.120 0.05 . . . . . . . 93 Q HN . 50026 1
209 . 1 . 1 122 122 GLN C C 13 176.223 0.1 . . . . . . . 93 Q CO . 50026 1
210 . 1 . 1 122 122 GLN CA C 13 58.481 0.1 . . . . . . . 93 Q CA . 50026 1
211 . 1 . 1 122 122 GLN CB C 13 28.545 0.1 . . . . . . . 93 Q CB . 50026 1
212 . 1 . 1 122 122 GLN N N 15 115.915 0.1 . . . . . . . 93 Q N . 50026 1
213 . 1 . 1 123 123 GLN H H 1 8.589 0.05 . . . . . . . 94 Q HN . 50026 1
214 . 1 . 1 123 123 GLN C C 13 175.616 0.1 . . . . . . . 94 Q CO . 50026 1
215 . 1 . 1 123 123 GLN CA C 13 55.001 0.1 . . . . . . . 94 Q CA . 50026 1
216 . 1 . 1 123 123 GLN CB C 13 33.953 0.1 . . . . . . . 94 Q CB . 50026 1
217 . 1 . 1 123 123 GLN N N 15 117.398 0.1 . . . . . . . 94 Q N . 50026 1
218 . 1 . 1 124 124 SER H H 1 7.815 0.05 . . . . . . . 95 S HN . 50026 1
219 . 1 . 1 124 124 SER C C 13 170.969 0.1 . . . . . . . 95 S CO . 50026 1
220 . 1 . 1 124 124 SER CA C 13 58.683 0.1 . . . . . . . 95 S CA . 50026 1
221 . 1 . 1 124 124 SER N N 15 123.661 0.1 . . . . . . . 95 S N . 50026 1
222 . 1 . 1 135 135 PRO C C 13 171.384 0.1 . . . . . . . 106 P CO . 50026 1
223 . 1 . 1 136 136 SER H H 1 8.080 0.05 . . . . . . . 107 S HN . 50026 1
224 . 1 . 1 136 136 SER C C 13 172.254 0.1 . . . . . . . 107 S CO . 50026 1
225 . 1 . 1 136 136 SER CA C 13 59.080 0.1 . . . . . . . 107 S CA . 50026 1
226 . 1 . 1 136 136 SER CB C 13 68.779 0.1 . . . . . . . 107 S CB . 50026 1
227 . 1 . 1 136 136 SER N N 15 112.143 0.1 . . . . . . . 107 S N . 50026 1
228 . 1 . 1 137 137 SER H H 1 8.352 0.05 . . . . . . . 108 S HN . 50026 1
229 . 1 . 1 137 137 SER C C 13 172.360 0.1 . . . . . . . 108 S CO . 50026 1
230 . 1 . 1 137 137 SER CA C 13 55.415 0.1 . . . . . . . 108 S CA . 50026 1
231 . 1 . 1 137 137 SER CB C 13 62.328 0.1 . . . . . . . 108 S CB . 50026 1
232 . 1 . 1 137 137 SER N N 15 114.214 0.1 . . . . . . . 108 S N . 50026 1
233 . 1 . 1 138 138 THR C C 13 174.260 0.1 . . . . . . . 109 T CO . 50026 1
234 . 1 . 1 138 138 THR CA C 13 61.467 0.1 . . . . . . . 109 T CA . 50026 1
235 . 1 . 1 138 138 THR N N 15 120.950 0.1 . . . . . . . 109 T N . 50026 1
236 . 1 . 1 139 139 SER H H 1 8.807 0.05 . . . . . . . 110 S HN . 50026 1
237 . 1 . 1 139 139 SER C C 13 174.716 0.1 . . . . . . . 110 S CO . 50026 1
238 . 1 . 1 139 139 SER CA C 13 55.920 0.1 . . . . . . . 110 S CA . 50026 1
239 . 1 . 1 139 139 SER N N 15 115.952 0.1 . . . . . . . 110 S N . 50026 1
240 . 1 . 1 140 140 GLY H H 1 7.923 0.05 . . . . . . . 111 G HN . 50026 1
241 . 1 . 1 140 140 GLY N N 15 113.267 0.1 . . . . . . . 111 G N . 50026 1
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