Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 25921
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err 0.4
_Assigned_chem_shift_list.Chem_shift_15N_err 0.25
_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' 1 $sample_1 isotropic 25921 1
2 '3D HNCO' 1 $sample_1 isotropic 25921 1
3 '3D HN(CO)CA' 1 $sample_1 isotropic 25921 1
4 '3D HNCA' 1 $sample_1 isotropic 25921 1
5 '3D HNCA-intra' 1 $sample_1 isotropic 25921 1
6 '3D CBCA(CO)NH' 1 $sample_1 isotropic 25921 1
7 '3D HNCACB-intra' 1 $sample_1 isotropic 25921 1
8 '3D HBHA(CO)NH' 1 $sample_1 isotropic 25921 1
9 '2D 15N-13CO' 1 $sample_1 isotropic 25921 1
10 '3D (H)N(COCA)NCO' 1 $sample_1 isotropic 25921 1
11 '3D (HN)CO(CA)NCO' 1 $sample_1 isotropic 25921 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 3 3 SER HA H 1 4.532 0.3 . 1 . . . . -17 S HA . 25921 1
2 . 1 1 3 3 SER HB2 H 1 3.828 0.3 . 2 . . . . -17 S QB . 25921 1
3 . 1 1 3 3 SER HB3 H 1 3.828 0.3 . 2 . . . . -17 S QB . 25921 1
4 . 1 1 3 3 SER C C 13 174.439 0.4 . 1 . . . . -17 S C . 25921 1
5 . 1 1 3 3 SER CA C 13 58.055 0.4 . 1 . . . . -17 S CA . 25921 1
6 . 1 1 3 3 SER CB C 13 63.914 0.4 . 1 . . . . -17 S CB . 25921 1
7 . 1 1 4 4 SER H H 1 8.460 0.02 . 1 . . . . -16 S HN . 25921 1
8 . 1 1 4 4 SER CA C 13 58.324 0.4 . 1 . . . . -16 S CA . 25921 1
9 . 1 1 4 4 SER CB C 13 63.601 0.4 . 1 . . . . -16 S CB . 25921 1
10 . 1 1 4 4 SER N N 15 117.669 0.25 . 1 . . . . -16 S N . 25921 1
11 . 1 1 10 10 HIS HA H 1 4.673 0.3 . 1 . . . . -10 H HA . 25921 1
12 . 1 1 10 10 HIS HB2 H 1 3.170 0.3 . 2 . . . . -10 H QB . 25921 1
13 . 1 1 10 10 HIS HB3 H 1 3.170 0.3 . 2 . . . . -10 H QB . 25921 1
14 . 1 1 10 10 HIS C C 13 174.328 0.4 . 1 . . . . -10 H C . 25921 1
15 . 1 1 10 10 HIS CA C 13 55.514 0.4 . 1 . . . . -10 H CA . 25921 1
16 . 1 1 10 10 HIS CB C 13 29.431 0.4 . 1 . . . . -10 H CB . 25921 1
17 . 1 1 11 11 SER H H 1 8.498 0.02 . 1 . . . . -9 S HN . 25921 1
18 . 1 1 11 11 SER HA H 1 4.485 0.3 . 1 . . . . -9 S HA . 25921 1
19 . 1 1 11 11 SER HB2 H 1 3.828 0.3 . 2 . . . . -9 S QB . 25921 1
20 . 1 1 11 11 SER HB3 H 1 3.828 0.3 . 2 . . . . -9 S QB . 25921 1
21 . 1 1 11 11 SER C C 13 174.324 0.4 . 1 . . . . -9 S C . 25921 1
22 . 1 1 11 11 SER CA C 13 58.062 0.4 . 1 . . . . -9 S CA . 25921 1
23 . 1 1 11 11 SER CB C 13 63.921 0.4 . 1 . . . . -9 S CB . 25921 1
24 . 1 1 11 11 SER N N 15 118.283 0.25 . 1 . . . . -9 S N . 25921 1
25 . 1 1 12 12 SER H H 1 8.532 0.02 . 1 . . . . -8 S HN . 25921 1
26 . 1 1 12 12 SER HA H 1 4.497 0.3 . 1 . . . . -8 S HA . 25921 1
27 . 1 1 12 12 SER HB2 H 1 3.886 0.3 . 2 . . . . -8 S QB . 25921 1
28 . 1 1 12 12 SER HB3 H 1 3.886 0.3 . 2 . . . . -8 S QB . 25921 1
29 . 1 1 12 12 SER C C 13 174.792 0.4 . 1 . . . . -8 S C . 25921 1
30 . 1 1 12 12 SER CA C 13 58.650 0.4 . 1 . . . . -8 S CA . 25921 1
31 . 1 1 12 12 SER CB C 13 63.908 0.4 . 1 . . . . -8 S CB . 25921 1
32 . 1 1 12 12 SER N N 15 118.132 0.25 . 1 . . . . -8 S N . 25921 1
33 . 1 1 13 13 GLY H H 1 8.399 0.02 . 1 . . . . -7 G HN . 25921 1
34 . 1 1 13 13 GLY HA2 H 1 4.423 0.3 . 2 . . . . -7 G QA . 25921 1
35 . 1 1 13 13 GLY HA3 H 1 4.423 0.3 . 2 . . . . -7 G QA . 25921 1
36 . 1 1 13 13 GLY C C 13 173.798 0.4 . 1 . . . . -7 G C . 25921 1
37 . 1 1 13 13 GLY CA C 13 45.279 0.4 . 1 . . . . -7 G CA . 25921 1
38 . 1 1 13 13 GLY N N 15 110.436 0.25 . 1 . . . . -7 G N . 25921 1
39 . 1 1 14 14 LEU H H 1 8.090 0.02 . 1 . . . . -6 L HN . 25921 1
40 . 1 1 14 14 LEU HA H 1 4.367 0.3 . 1 . . . . -6 L HA . 25921 1
41 . 1 1 14 14 LEU HB2 H 1 1.528 0.3 . 2 . . . . -6 L QB . 25921 1
42 . 1 1 14 14 LEU HB3 H 1 1.528 0.3 . 2 . . . . -6 L QB . 25921 1
43 . 1 1 14 14 LEU C C 13 177.188 0.4 . 1 . . . . -6 L C . 25921 1
44 . 1 1 14 14 LEU CA C 13 55.258 0.4 . 1 . . . . -6 L CA . 25921 1
45 . 1 1 14 14 LEU CB C 13 42.458 0.4 . 1 . . . . -6 L CB . 25921 1
46 . 1 1 14 14 LEU N N 15 121.645 0.25 . 1 . . . . -6 L N . 25921 1
47 . 1 1 15 15 VAL H H 1 8.173 0.02 . 1 . . . . -5 V HN . 25921 1
48 . 1 1 15 15 VAL C C 13 174.472 0.4 . 1 . . . . -5 V C . 25921 1
49 . 1 1 15 15 VAL CA C 13 59.912 0.4 . 1 . . . . -5 V CA . 25921 1
50 . 1 1 15 15 VAL CB C 13 32.671 0.4 . 1 . . . . -5 V CB . 25921 1
51 . 1 1 15 15 VAL N N 15 123.216 0.25 . 1 . . . . -5 V N . 25921 1
52 . 1 1 16 16 PRO HA H 1 4.368 0.3 . 1 . . . . -4 P HA . 25921 1
53 . 1 1 16 16 PRO HB2 H 1 2.262 0.3 . 1 . . . . -4 P HB2 . 25921 1
54 . 1 1 16 16 PRO HB3 H 1 1.844 0.3 . 1 . . . . -4 P HB3 . 25921 1
55 . 1 1 16 16 PRO C C 13 176.858 0.4 . 1 . . . . -4 P C . 25921 1
56 . 1 1 16 16 PRO CA C 13 63.016 0.4 . 1 . . . . -4 P CA . 25921 1
57 . 1 1 16 16 PRO CB C 13 31.691 0.4 . 1 . . . . -4 P CB . 25921 1
58 . 1 1 17 17 ARG H H 1 8.468 0.02 . 1 . . . . -3 R HN . 25921 1
59 . 1 1 17 17 ARG HA H 1 4.279 0.3 . 1 . . . . -3 R HA . 25921 1
60 . 1 1 17 17 ARG HB2 H 1 1.795 0.3 . 2 . . . . -3 R QB . 25921 1
61 . 1 1 17 17 ARG HB3 H 1 1.795 0.3 . 2 . . . . -3 R QB . 25921 1
62 . 1 1 17 17 ARG C C 13 177.031 0.4 . 1 . . . . -3 R C . 25921 1
63 . 1 1 17 17 ARG CA C 13 56.719 0.4 . 1 . . . . -3 R CA . 25921 1
64 . 1 1 17 17 ARG CB C 13 30.938 0.4 . 1 . . . . -3 R CB . 25921 1
65 . 1 1 17 17 ARG N N 15 121.848 0.25 . 1 . . . . -3 R N . 25921 1
66 . 1 1 18 18 GLY H H 1 8.450 0.02 . 1 . . . . -2 G HN . 25921 1
67 . 1 1 18 18 GLY HA2 H 1 3.968 0.3 . 2 . . . . -2 G QA . 25921 1
68 . 1 1 18 18 GLY HA3 H 1 3.968 0.3 . 2 . . . . -2 G QA . 25921 1
69 . 1 1 18 18 GLY C C 13 174.107 0.4 . 1 . . . . -2 G C . 25921 1
70 . 1 1 18 18 GLY CA C 13 45.173 0.4 . 1 . . . . -2 G CA . 25921 1
71 . 1 1 18 18 GLY N N 15 110.082 0.25 . 1 . . . . -2 G N . 25921 1
72 . 1 1 19 19 SER H H 1 8.186 0.02 . 1 . . . . -1 S HN . 25921 1
73 . 1 1 19 19 SER HA H 1 4.453 0.3 . 1 . . . . -1 S HA . 25921 1
74 . 1 1 19 19 SER HB2 H 1 3.790 0.3 . 2 . . . . -1 S QB . 25921 1
75 . 1 1 19 19 SER HB3 H 1 3.790 0.3 . 2 . . . . -1 S QB . 25921 1
76 . 1 1 19 19 SER C C 13 174.515 0.4 . 1 . . . . -1 S C . 25921 1
77 . 1 1 19 19 SER CA C 13 58.356 0.4 . 1 . . . . -1 S CA . 25921 1
78 . 1 1 19 19 SER CB C 13 63.928 0.4 . 1 . . . . -1 S CB . 25921 1
79 . 1 1 19 19 SER N N 15 115.115 0.25 . 1 . . . . -1 S N . 25921 1
80 . 1 1 20 20 HIS H H 1 8.608 0.02 . 1 . . . . 0 H HN . 25921 1
81 . 1 1 20 20 HIS HA H 1 4.659 0.3 . 1 . . . . 0 H HA . 25921 1
82 . 1 1 20 20 HIS HB2 H 1 3.203 0.3 . 2 . . . . 0 H QB . 25921 1
83 . 1 1 20 20 HIS HB3 H 1 3.203 0.3 . 2 . . . . 0 H QB . 25921 1
84 . 1 1 20 20 HIS C C 13 174.511 0.4 . 1 . . . . 0 H C . 25921 1
85 . 1 1 20 20 HIS CA C 13 55.739 0.4 . 1 . . . . 0 H CA . 25921 1
86 . 1 1 20 20 HIS CB C 13 28.778 0.4 . 1 . . . . 0 H CB . 25921 1
87 . 1 1 20 20 HIS N N 15 120.274 0.25 . 1 . . . . 0 H N . 25921 1
88 . 1 1 21 21 MET H H 1 8.381 0.02 . 1 . . . . 1 M HN . 25921 1
89 . 1 1 21 21 MET HA H 1 4.485 0.3 . 1 . . . . 1 M HA . 25921 1
90 . 1 1 21 21 MET HB2 H 1 1.997 0.3 . 2 . . . . 1 M QB . 25921 1
91 . 1 1 21 21 MET HB3 H 1 1.997 0.3 . 2 . . . . 1 M QB . 25921 1
92 . 1 1 21 21 MET C C 13 176.404 0.4 . 1 . . . . 1 M C . 25921 1
93 . 1 1 21 21 MET CA C 13 55.914 0.4 . 1 . . . . 1 M CA . 25921 1
94 . 1 1 21 21 MET CB C 13 33.359 0.4 . 1 . . . . 1 M CB . 25921 1
95 . 1 1 21 21 MET N N 15 121.424 0.25 . 1 . . . . 1 M N . 25921 1
96 . 1 1 22 22 SER H H 1 8.548 0.02 . 1 . . . . 2 S HN . 25921 1
97 . 1 1 22 22 SER HA H 1 3.968 0.3 . 1 . . . . 2 S HA . 25921 1
98 . 1 1 22 22 SER HB2 H 1 4.532 0.3 . 2 . . . . 2 S QB . 25921 1
99 . 1 1 22 22 SER HB3 H 1 4.532 0.3 . 2 . . . . 2 S QB . 25921 1
100 . 1 1 22 22 SER C C 13 175.151 0.4 . 1 . . . . 2 S C . 25921 1
101 . 1 1 22 22 SER CA C 13 58.340 0.4 . 1 . . . . 2 S CA . 25921 1
102 . 1 1 22 22 SER CB C 13 64.175 0.4 . 1 . . . . 2 S CB . 25921 1
103 . 1 1 22 22 SER N N 15 117.908 0.25 . 1 . . . . 2 S N . 25921 1
104 . 1 1 23 23 THR H H 1 8.426 0.02 . 1 . . . . 3 T HN . 25921 1
105 . 1 1 23 23 THR HA H 1 4.230 0.3 . 1 . . . . 3 T HA . 25921 1
106 . 1 1 23 23 THR C C 13 175.661 0.4 . 1 . . . . 3 T C . 25921 1
107 . 1 1 23 23 THR CA C 13 63.637 0.4 . 1 . . . . 3 T CA . 25921 1
108 . 1 1 23 23 THR CB C 13 69.482 0.4 . 1 . . . . 3 T CB . 25921 1
109 . 1 1 23 23 THR N N 15 115.882 0.25 . 1 . . . . 3 T N . 25921 1
110 . 1 1 24 24 GLN H H 1 8.453 0.02 . 1 . . . . 4 Q HN . 25921 1
111 . 1 1 24 24 GLN HA H 1 4.221 0.3 . 1 . . . . 4 Q HA . 25921 1
112 . 1 1 24 24 GLN HB2 H 1 2.062 0.3 . 2 . . . . 4 Q QB . 25921 1
113 . 1 1 24 24 GLN HB3 H 1 2.062 0.3 . 2 . . . . 4 Q QB . 25921 1
114 . 1 1 24 24 GLN C C 13 177.237 0.4 . 1 . . . . 4 Q C . 25921 1
115 . 1 1 24 24 GLN CA C 13 57.798 0.4 . 1 . . . . 4 Q CA . 25921 1
116 . 1 1 24 24 GLN CB C 13 28.502 0.4 . 1 . . . . 4 Q CB . 25921 1
117 . 1 1 24 24 GLN N N 15 121.773 0.25 . 1 . . . . 4 Q N . 25921 1
118 . 1 1 25 25 GLN H H 1 8.275 0.02 . 1 . . . . 5 Q HN . 25921 1
119 . 1 1 25 25 GLN HA H 1 4.212 0.3 . 1 . . . . 5 Q HA . 25921 1
120 . 1 1 25 25 GLN HB2 H 1 2.056 0.3 . 2 . . . . 5 Q QB . 25921 1
121 . 1 1 25 25 GLN HB3 H 1 2.056 0.3 . 2 . . . . 5 Q QB . 25921 1
122 . 1 1 25 25 GLN C C 13 177.348 0.4 . 1 . . . . 5 Q C . 25921 1
123 . 1 1 25 25 GLN CA C 13 57.701 0.4 . 1 . . . . 5 Q CA . 25921 1
124 . 1 1 25 25 GLN CB C 13 28.708 0.4 . 1 . . . . 5 Q CB . 25921 1
125 . 1 1 25 25 GLN N N 15 120.599 0.25 . 1 . . . . 5 Q N . 25921 1
126 . 1 1 26 26 GLN H H 1 8.356 0.02 . 1 . . . . 6 Q HN . 25921 1
127 . 1 1 26 26 GLN HA H 1 4.143 0.3 . 1 . . . . 6 Q HA . 25921 1
128 . 1 1 26 26 GLN HB2 H 1 2.082 0.3 . 2 . . . . 6 Q QB . 25921 1
129 . 1 1 26 26 GLN HB3 H 1 2.082 0.3 . 2 . . . . 6 Q QB . 25921 1
130 . 1 1 26 26 GLN C C 13 176.923 0.4 . 1 . . . . 6 Q C . 25921 1
131 . 1 1 26 26 GLN CA C 13 56.856 0.4 . 1 . . . . 6 Q CA . 25921 1
132 . 1 1 26 26 GLN CB C 13 29.030 0.4 . 1 . . . . 6 Q CB . 25921 1
133 . 1 1 26 26 GLN N N 15 120.750 0.25 . 1 . . . . 6 Q N . 25921 1
134 . 1 1 27 27 ALA H H 1 8.184 0.02 . 1 . . . . 7 A HN . 25921 1
135 . 1 1 27 27 ALA HA H 1 4.203 0.3 . 1 . . . . 7 A HA . 25921 1
136 . 1 1 27 27 ALA HB1 H 1 1.433 0.3 . 1 . . . . 7 A QB . 25921 1
137 . 1 1 27 27 ALA HB2 H 1 1.433 0.3 . 1 . . . . 7 A QB . 25921 1
138 . 1 1 27 27 ALA HB3 H 1 1.433 0.3 . 1 . . . . 7 A QB . 25921 1
139 . 1 1 27 27 ALA C C 13 179.193 0.4 . 1 . . . . 7 A C . 25921 1
140 . 1 1 27 27 ALA CA C 13 54.029 0.4 . 1 . . . . 7 A CA . 25921 1
141 . 1 1 27 27 ALA CB C 13 18.571 0.4 . 1 . . . . 7 A CB . 25921 1
142 . 1 1 27 27 ALA N N 15 123.450 0.25 . 1 . . . . 7 A N . 25921 1
143 . 1 1 28 28 ARG H H 1 8.099 0.02 . 1 . . . . 8 R HN . 25921 1
144 . 1 1 28 28 ARG HA H 1 4.098 0.3 . 1 . . . . 8 R HA . 25921 1
145 . 1 1 28 28 ARG HB2 H 1 1.842 0.3 . 2 . . . . 8 R QB . 25921 1
146 . 1 1 28 28 ARG HB3 H 1 1.842 0.3 . 2 . . . . 8 R QB . 25921 1
147 . 1 1 28 28 ARG C C 13 177.448 0.4 . 1 . . . . 8 R C . 25921 1
148 . 1 1 28 28 ARG CA C 13 58.279 0.4 . 1 . . . . 8 R CA . 25921 1
149 . 1 1 28 28 ARG CB C 13 30.135 0.4 . 1 . . . . 8 R CB . 25921 1
150 . 1 1 28 28 ARG N N 15 119.264 0.25 . 1 . . . . 8 R N . 25921 1
151 . 1 1 29 29 ALA H H 1 8.069 0.02 . 1 . . . . 9 A HN . 25921 1
152 . 1 1 29 29 ALA HA H 1 4.156 0.3 . 1 . . . . 9 A HA . 25921 1
153 . 1 1 29 29 ALA HB1 H 1 1.433 0.3 . 1 . . . . 9 A QB . 25921 1
154 . 1 1 29 29 ALA HB2 H 1 1.433 0.3 . 1 . . . . 9 A QB . 25921 1
155 . 1 1 29 29 ALA HB3 H 1 1.433 0.3 . 1 . . . . 9 A QB . 25921 1
156 . 1 1 29 29 ALA C C 13 179.159 0.4 . 1 . . . . 9 A C . 25921 1
157 . 1 1 29 29 ALA CA C 13 54.111 0.4 . 1 . . . . 9 A CA . 25921 1
158 . 1 1 29 29 ALA CB C 13 18.656 0.4 . 1 . . . . 9 A CB . 25921 1
159 . 1 1 29 29 ALA N N 15 122.707 0.25 . 1 . . . . 9 A N . 25921 1
160 . 1 1 30 30 LEU H H 1 7.938 0.02 . 1 . . . . 10 L HN . 25921 1
161 . 1 1 30 30 LEU HA H 1 4.156 0.3 . 1 . . . . 10 L HA . 25921 1
162 . 1 1 30 30 LEU HB2 H 1 1.668 0.3 . 2 . . . . 10 L QB . 25921 1
163 . 1 1 30 30 LEU HB3 H 1 1.668 0.3 . 2 . . . . 10 L QB . 25921 1
164 . 1 1 30 30 LEU C C 13 178.470 0.4 . 1 . . . . 10 L C . 25921 1
165 . 1 1 30 30 LEU CA C 13 56.829 0.4 . 1 . . . . 10 L CA . 25921 1
166 . 1 1 30 30 LEU CB C 13 41.946 0.4 . 1 . . . . 10 L CB . 25921 1
167 . 1 1 30 30 LEU N N 15 119.345 0.25 . 1 . . . . 10 L N . 25921 1
168 . 1 1 31 31 MET H H 1 7.980 0.02 . 1 . . . . 11 M HN . 25921 1
169 . 1 1 31 31 MET HA H 1 4.250 0.3 . 1 . . . . 11 M HA . 25921 1
170 . 1 1 31 31 MET HB2 H 1 2.091 0.3 . 2 . . . . 11 M QB . 25921 1
171 . 1 1 31 31 MET HB3 H 1 2.091 0.3 . 2 . . . . 11 M QB . 25921 1
172 . 1 1 31 31 MET C C 13 177.174 0.4 . 1 . . . . 11 M C . 25921 1
173 . 1 1 31 31 MET CA C 13 56.874 0.4 . 1 . . . . 11 M CA . 25921 1
174 . 1 1 31 31 MET CB C 13 32.282 0.4 . 1 . . . . 11 M CB . 25921 1
175 . 1 1 31 31 MET N N 15 119.241 0.25 . 1 . . . . 11 M N . 25921 1
176 . 1 1 32 32 MET H H 1 8.091 0.02 . 1 . . . . 12 M HN . 25921 1
177 . 1 1 32 32 MET HA H 1 4.295 0.3 . 1 . . . . 12 M HA . 25921 1
178 . 1 1 32 32 MET HB2 H 1 1.974 0.3 . 2 . . . . 12 M QB . 25921 1
179 . 1 1 32 32 MET HB3 H 1 1.974 0.3 . 2 . . . . 12 M QB . 25921 1
180 . 1 1 32 32 MET C C 13 176.922 0.4 . 1 . . . . 12 M C . 25921 1
181 . 1 1 32 32 MET CA C 13 56.631 0.4 . 1 . . . . 12 M CA . 25921 1
182 . 1 1 32 32 MET CB C 13 32.584 0.4 . 1 . . . . 12 M CB . 25921 1
183 . 1 1 32 32 MET N N 15 119.392 0.25 . 1 . . . . 12 M N . 25921 1
184 . 1 1 33 33 ARG H H 1 8.013 0.02 . 1 . . . . 13 R HN . 25921 1
185 . 1 1 33 33 ARG HA H 1 4.203 0.3 . 1 . . . . 13 R HA . 25921 1
186 . 1 1 33 33 ARG HB2 H 1 1.762 0.3 . 2 . . . . 13 R QB . 25921 1
187 . 1 1 33 33 ARG HB3 H 1 1.762 0.3 . 2 . . . . 13 R QB . 25921 1
188 . 1 1 33 33 ARG C C 13 176.667 0.4 . 1 . . . . 13 R C . 25921 1
189 . 1 1 33 33 ARG CA C 13 56.865 0.4 . 1 . . . . 13 R CA . 25921 1
190 . 1 1 33 33 ARG CB C 13 30.226 0.4 . 1 . . . . 13 R CB . 25921 1
191 . 1 1 33 33 ARG N N 15 120.561 0.25 . 1 . . . . 13 R N . 25921 1
192 . 1 1 34 34 HIS H H 1 8.304 0.02 . 1 . . . . 14 H HN . 25921 1
193 . 1 1 34 34 HIS HA H 1 4.579 0.3 . 1 . . . . 14 H HA . 25921 1
194 . 1 1 34 34 HIS HB2 H 1 3.170 0.3 . 2 . . . . 14 H QB . 25921 1
195 . 1 1 34 34 HIS HB3 H 1 3.170 0.3 . 2 . . . . 14 H QB . 25921 1
196 . 1 1 34 34 HIS C C 13 174.720 0.4 . 1 . . . . 14 H C . 25921 1
197 . 1 1 34 34 HIS CA C 13 55.666 0.4 . 1 . . . . 14 H CA . 25921 1
198 . 1 1 34 34 HIS CB C 13 28.707 0.4 . 1 . . . . 14 H CB . 25921 1
199 . 1 1 34 34 HIS N N 15 118.230 0.25 . 1 . . . . 14 H N . 25921 1
200 . 1 1 35 35 HIS H H 1 8.413 0.02 . 1 . . . . 15 H HN . 25921 1
201 . 1 1 35 35 HIS HA H 1 4.527 0.3 . 1 . . . . 15 H HA . 25921 1
202 . 1 1 35 35 HIS HB2 H 1 3.112 0.3 . 2 . . . . 15 H QB . 25921 1
203 . 1 1 35 35 HIS HB3 H 1 3.112 0.3 . 2 . . . . 15 H QB . 25921 1
204 . 1 1 35 35 HIS C C 13 174.409 0.4 . 1 . . . . 15 H C . 25921 1
205 . 1 1 35 35 HIS CA C 13 56.069 0.4 . 1 . . . . 15 H CA . 25921 1
206 . 1 1 35 35 HIS CB C 13 29.138 0.4 . 1 . . . . 15 H CB . 25921 1
207 . 1 1 35 35 HIS N N 15 119.098 0.25 . 1 . . . . 15 H N . 25921 1
208 . 1 1 36 36 GLN H H 1 8.338 0.02 . 1 . . . . 16 Q HN . 25921 1
209 . 1 1 36 36 GLN HA H 1 4.252 0.3 . 1 . . . . 16 Q HA . 25921 1
210 . 1 1 36 36 GLN HB2 H 1 1.927 0.3 . 2 . . . . 16 Q QB . 25921 1
211 . 1 1 36 36 GLN HB3 H 1 1.927 0.3 . 2 . . . . 16 Q QB . 25921 1
212 . 1 1 36 36 GLN C C 13 175.517 0.4 . 1 . . . . 16 Q C . 25921 1
213 . 1 1 36 36 GLN CA C 13 56.153 0.4 . 1 . . . . 16 Q CA . 25921 1
214 . 1 1 36 36 GLN CB C 13 29.496 0.4 . 1 . . . . 16 Q CB . 25921 1
215 . 1 1 36 36 GLN N N 15 120.973 0.25 . 1 . . . . 16 Q N . 25921 1
216 . 1 1 37 37 PHE H H 1 8.338 0.02 . 1 . . . . 17 F HN . 25921 1
217 . 1 1 37 37 PHE HA H 1 4.601 0.3 . 1 . . . . 17 F HA . 25921 1
218 . 1 1 37 37 PHE HB2 H 1 3.055 0.3 . 2 . . . . 17 F QB . 25921 1
219 . 1 1 37 37 PHE HB3 H 1 3.055 0.3 . 2 . . . . 17 F QB . 25921 1
220 . 1 1 37 37 PHE C C 13 175.567 0.4 . 1 . . . . 17 F C . 25921 1
221 . 1 1 37 37 PHE CA C 13 58.128 0.4 . 1 . . . . 17 F CA . 25921 1
222 . 1 1 37 37 PHE CB C 13 39.385 0.4 . 1 . . . . 17 F CB . 25921 1
223 . 1 1 37 37 PHE N N 15 121.674 0.25 . 1 . . . . 17 F N . 25921 1
224 . 1 1 38 38 ILE H H 1 8.023 0.02 . 1 . . . . 18 I HN . 25921 1
225 . 1 1 38 38 ILE HA H 1 4.004 0.3 . 1 . . . . 18 I HA . 25921 1
226 . 1 1 38 38 ILE HB H 1 1.750 0.3 . 1 . . . . 18 I HB . 25921 1
227 . 1 1 38 38 ILE C C 13 176.078 0.4 . 1 . . . . 18 I C . 25921 1
228 . 1 1 38 38 ILE CA C 13 61.375 0.4 . 1 . . . . 18 I CA . 25921 1
229 . 1 1 38 38 ILE CB C 13 38.531 0.4 . 1 . . . . 18 I CB . 25921 1
230 . 1 1 38 38 ILE N N 15 122.810 0.25 . 1 . . . . 18 I N . 25921 1
231 . 1 1 39 39 LYS H H 1 8.264 0.02 . 1 . . . . 19 K HN . 25921 1
232 . 1 1 39 39 LYS HA H 1 4.156 0.3 . 1 . . . . 19 K HA . 25921 1
233 . 1 1 39 39 LYS HB2 H 1 1.762 0.3 . 2 . . . . 19 K QB . 25921 1
234 . 1 1 39 39 LYS HB3 H 1 1.762 0.3 . 2 . . . . 19 K QB . 25921 1
235 . 1 1 39 39 LYS C C 13 176.391 0.4 . 1 . . . . 19 K C . 25921 1
236 . 1 1 39 39 LYS CA C 13 57.204 0.4 . 1 . . . . 19 K CA . 25921 1
237 . 1 1 39 39 LYS CB C 13 32.890 0.4 . 1 . . . . 19 K CB . 25921 1
238 . 1 1 39 39 LYS N N 15 124.903 0.25 . 1 . . . . 19 K N . 25921 1
239 . 1 1 40 40 ASN H H 1 8.348 0.02 . 1 . . . . 20 N HN . 25921 1
240 . 1 1 40 40 ASN HA H 1 4.611 0.3 . 1 . . . . 20 N HA . 25921 1
241 . 1 1 40 40 ASN HB2 H 1 2.779 0.3 . 2 . . . . 20 N QB . 25921 1
242 . 1 1 40 40 ASN HB3 H 1 2.779 0.3 . 2 . . . . 20 N QB . 25921 1
243 . 1 1 40 40 ASN C C 13 175.399 0.4 . 1 . . . . 20 N C . 25921 1
244 . 1 1 40 40 ASN CA C 13 53.332 0.4 . 1 . . . . 20 N CA . 25921 1
245 . 1 1 40 40 ASN CB C 13 38.394 0.4 . 1 . . . . 20 N CB . 25921 1
246 . 1 1 40 40 ASN N N 15 119.200 0.25 . 1 . . . . 20 N N . 25921 1
247 . 1 1 41 41 ARG H H 1 8.291 0.02 . 1 . . . . 21 R HN . 25921 1
248 . 1 1 41 41 ARG C C 13 176.482 0.4 . 1 . . . . 21 R C . 25921 1
249 . 1 1 41 41 ARG CA C 13 57.099 0.4 . 1 . . . . 21 R CA . 25921 1
250 . 1 1 41 41 ARG CB C 13 30.425 0.4 . 1 . . . . 21 R CB . 25921 1
251 . 1 1 41 41 ARG N N 15 121.221 0.25 . 1 . . . . 21 R N . 25921 1
252 . 1 1 42 42 GLN H H 1 8.363 0.02 . 1 . . . . 22 Q HN . 25921 1
253 . 1 1 42 42 GLN C C 13 176.604 0.4 . 1 . . . . 22 Q C . 25921 1
254 . 1 1 42 42 GLN N N 15 120.533 0.25 . 1 . . . . 22 Q N . 25921 1
255 . 1 1 43 43 GLN H H 1 8.363 0.02 . 1 . . . . 23 Q HN . 25921 1
256 . 1 1 43 43 GLN HA H 1 4.250 0.3 . 1 . . . . 23 Q HA . 25921 1
257 . 1 1 43 43 GLN HB2 H 1 2.044 0.3 . 2 . . . . 23 Q QB . 25921 1
258 . 1 1 43 43 GLN HB3 H 1 2.044 0.3 . 2 . . . . 23 Q QB . 25921 1
259 . 1 1 43 43 GLN C C 13 176.402 0.4 . 1 . . . . 23 Q C . 25921 1
260 . 1 1 43 43 GLN CA C 13 56.588 0.4 . 1 . . . . 23 Q CA . 25921 1
261 . 1 1 43 43 GLN CB C 13 29.051 0.4 . 1 . . . . 23 Q CB . 25921 1
262 . 1 1 43 43 GLN N N 15 120.740 0.25 . 1 . . . . 23 Q N . 25921 1
263 . 1 1 44 44 SER H H 1 8.310 0.02 . 1 . . . . 24 S HN . 25921 1
264 . 1 1 44 44 SER HA H 1 4.394 0.3 . 1 . . . . 24 S HA . 25921 1
265 . 1 1 44 44 SER HB2 H 1 3.866 0.3 . 2 . . . . 24 S QB . 25921 1
266 . 1 1 44 44 SER HB3 H 1 3.866 0.3 . 2 . . . . 24 S QB . 25921 1
267 . 1 1 44 44 SER C C 13 174.845 0.4 . 1 . . . . 24 S C . 25921 1
268 . 1 1 44 44 SER CA C 13 58.937 0.4 . 1 . . . . 24 S CA . 25921 1
269 . 1 1 44 44 SER CB C 13 63.919 0.4 . 1 . . . . 24 S CB . 25921 1
270 . 1 1 44 44 SER N N 15 116.275 0.25 . 1 . . . . 24 S N . 25921 1
271 . 1 1 45 45 MET H H 1 8.322 0.02 . 1 . . . . 25 M HN . 25921 1
272 . 1 1 45 45 MET HB2 H 1 2.053 0.3 . 2 . . . . 25 M QB . 25921 1
273 . 1 1 45 45 MET HB3 H 1 2.053 0.3 . 2 . . . . 25 M QB . 25921 1
274 . 1 1 45 45 MET C C 13 176.589 0.4 . 1 . . . . 25 M C . 25921 1
275 . 1 1 45 45 MET CA C 13 56.172 0.4 . 1 . . . . 25 M CA . 25921 1
276 . 1 1 45 45 MET CB C 13 32.741 0.4 . 1 . . . . 25 M CB . 25921 1
277 . 1 1 45 45 MET N N 15 121.568 0.25 . 1 . . . . 25 M N . 25921 1
278 . 1 1 46 46 LEU H H 1 8.100 0.02 . 1 . . . . 26 L HN . 25921 1
279 . 1 1 46 46 LEU HA H 1 4.297 0.3 . 1 . . . . 26 L HA . 25921 1
280 . 1 1 46 46 LEU HB2 H 1 1.621 0.3 . 2 . . . . 26 L QB . 25921 1
281 . 1 1 46 46 LEU HB3 H 1 1.621 0.3 . 2 . . . . 26 L QB . 25921 1
282 . 1 1 46 46 LEU C C 13 177.674 0.4 . 1 . . . . 26 L C . 25921 1
283 . 1 1 46 46 LEU CA C 13 55.857 0.4 . 1 . . . . 26 L CA . 25921 1
284 . 1 1 46 46 LEU CB C 13 45.323 0.4 . 1 . . . . 26 L CB . 25921 1
285 . 1 1 46 46 LEU N N 15 121.684 0.25 . 1 . . . . 26 L N . 25921 1
286 . 1 1 47 47 SER H H 1 8.151 0.02 . 1 . . . . 27 S HN . 25921 1
287 . 1 1 47 47 SER HA H 1 4.381 0.3 . 1 . . . . 27 S HA . 25921 1
288 . 1 1 47 47 SER HB2 H 1 3.866 0.3 . 2 . . . . 27 S QB . 25921 1
289 . 1 1 47 47 SER HB3 H 1 3.866 0.3 . 2 . . . . 27 S QB . 25921 1
290 . 1 1 47 47 SER C C 13 174.680 0.4 . 1 . . . . 27 S C . 25921 1
291 . 1 1 47 47 SER CA C 13 63.969 0.4 . 1 . . . . 27 S CA . 25921 1
292 . 1 1 47 47 SER CB C 13 58.699 0.4 . 1 . . . . 27 S CB . 25921 1
293 . 1 1 47 47 SER N N 15 115.882 0.25 . 1 . . . . 27 S N . 25921 1
294 . 1 1 48 48 ARG H H 1 8.229 0.02 . 1 . . . . 28 R HN . 25921 1
295 . 1 1 48 48 ARG HA H 1 4.229 0.3 . 1 . . . . 28 R HA . 25921 1
296 . 1 1 48 48 ARG HB2 H 1 1.812 0.3 . 2 . . . . 28 R QB . 25921 1
297 . 1 1 48 48 ARG HB3 H 1 1.812 0.3 . 2 . . . . 28 R QB . 25921 1
298 . 1 1 48 48 ARG C C 13 176.285 0.4 . 1 . . . . 28 R C . 25921 1
299 . 1 1 48 48 ARG CA C 13 57.090 0.4 . 1 . . . . 28 R CA . 25921 1
300 . 1 1 48 48 ARG CB C 13 30.718 0.4 . 1 . . . . 28 R CB . 25921 1
301 . 1 1 48 48 ARG N N 15 122.520 0.25 . 1 . . . . 28 R N . 25921 1
302 . 1 1 49 49 ALA H H 1 8.209 0.02 . 1 . . . . 29 A HN . 25921 1
303 . 1 1 49 49 ALA HA H 1 4.257 0.3 . 1 . . . . 29 A HA . 25921 1
304 . 1 1 49 49 ALA HB1 H 1 1.365 0.3 . 1 . . . . 29 A QB . 25921 1
305 . 1 1 49 49 ALA HB2 H 1 1.365 0.3 . 1 . . . . 29 A QB . 25921 1
306 . 1 1 49 49 ALA HB3 H 1 1.365 0.3 . 1 . . . . 29 A QB . 25921 1
307 . 1 1 49 49 ALA C C 13 177.883 0.4 . 1 . . . . 29 A C . 25921 1
308 . 1 1 49 49 ALA CA C 13 52.784 0.4 . 1 . . . . 29 A CA . 25921 1
309 . 1 1 49 49 ALA CB C 13 18.796 0.4 . 1 . . . . 29 A CB . 25921 1
310 . 1 1 49 49 ALA N N 15 124.054 0.25 . 1 . . . . 29 A N . 25921 1
311 . 1 1 50 50 ALA H H 1 8.134 0.02 . 1 . . . . 30 A HN . 25921 1
312 . 1 1 50 50 ALA HA H 1 4.218 0.3 . 1 . . . . 30 A HA . 25921 1
313 . 1 1 50 50 ALA HB1 H 1 1.369 0.3 . 1 . . . . 30 A QB . 25921 1
314 . 1 1 50 50 ALA HB2 H 1 1.369 0.3 . 1 . . . . 30 A QB . 25921 1
315 . 1 1 50 50 ALA HB3 H 1 1.369 0.3 . 1 . . . . 30 A QB . 25921 1
316 . 1 1 50 50 ALA C C 13 177.786 0.4 . 1 . . . . 30 A C . 25921 1
317 . 1 1 50 50 ALA CA C 13 53.201 0.4 . 1 . . . . 30 A CA . 25921 1
318 . 1 1 50 50 ALA CB C 13 18.922 0.4 . 1 . . . . 30 A CB . 25921 1
319 . 1 1 50 50 ALA N N 15 122.475 0.25 . 1 . . . . 30 A N . 25921 1
320 . 1 1 51 51 ALA H H 1 8.106 0.02 . 1 . . . . 31 A HN . 25921 1
321 . 1 1 51 51 ALA HA H 1 4.250 0.3 . 1 . . . . 31 A HA . 25921 1
322 . 1 1 51 51 ALA HB1 H 1 1.386 0.3 . 1 . . . . 31 A QB . 25921 1
323 . 1 1 51 51 ALA HB2 H 1 1.386 0.3 . 1 . . . . 31 A QB . 25921 1
324 . 1 1 51 51 ALA HB3 H 1 1.386 0.3 . 1 . . . . 31 A QB . 25921 1
325 . 1 1 51 51 ALA C C 13 177.932 0.4 . 1 . . . . 31 A C . 25921 1
326 . 1 1 51 51 ALA CA C 13 52.870 0.4 . 1 . . . . 31 A CA . 25921 1
327 . 1 1 51 51 ALA CB C 13 19.178 0.4 . 1 . . . . 31 A CB . 25921 1
328 . 1 1 51 51 ALA N N 15 121.688 0.25 . 1 . . . . 31 A N . 25921 1
329 . 1 1 52 52 GLU H H 1 8.163 0.02 . 1 . . . . 32 E HN . 25921 1
330 . 1 1 52 52 GLU C C 13 176.515 0.4 . 1 . . . . 32 E C . 25921 1
331 . 1 1 52 52 GLU CA C 13 56.882 0.4 . 1 . . . . 32 E CA . 25921 1
332 . 1 1 52 52 GLU CB C 13 29.929 0.4 . 1 . . . . 32 E CB . 25921 1
333 . 1 1 52 52 GLU N N 15 118.967 0.25 . 1 . . . . 32 E N . 25921 1
334 . 1 1 53 53 ILE H H 1 8.008 0.02 . 1 . . . . 33 I HN . 25921 1
335 . 1 1 53 53 ILE HA H 1 4.115 0.3 . 1 . . . . 33 I HA . 25921 1
336 . 1 1 53 53 ILE HB H 1 1.861 0.3 . 1 . . . . 33 I HB . 25921 1
337 . 1 1 53 53 ILE C C 13 176.711 0.4 . 1 . . . . 33 I C . 25921 1
338 . 1 1 53 53 ILE CA C 13 61.536 0.4 . 1 . . . . 33 I CA . 25921 1
339 . 1 1 53 53 ILE CB C 13 38.409 0.4 . 1 . . . . 33 I CB . 25921 1
340 . 1 1 53 53 ILE N N 15 120.579 0.25 . 1 . . . . 33 I N . 25921 1
341 . 1 1 54 54 GLY H H 1 8.389 0.02 . 1 . . . . 34 G HN . 25921 1
342 . 1 1 54 54 GLY HA2 H 1 3.968 0.3 . 2 . . . . 34 G QA . 25921 1
343 . 1 1 54 54 GLY HA3 H 1 3.968 0.3 . 2 . . . . 34 G QA . 25921 1
344 . 1 1 54 54 GLY C C 13 174.328 0.4 . 1 . . . . 34 G C . 25921 1
345 . 1 1 54 54 GLY CA C 13 45.219 0.4 . 1 . . . . 34 G CA . 25921 1
346 . 1 1 54 54 GLY N N 15 112.097 0.25 . 1 . . . . 34 G N . 25921 1
347 . 1 1 55 55 VAL H H 1 7.925 0.02 . 1 . . . . 35 V HN . 25921 1
348 . 1 1 55 55 VAL HA H 1 4.043 0.3 . 1 . . . . 35 V HA . 25921 1
349 . 1 1 55 55 VAL HB H 1 2.071 0.3 . 1 . . . . 35 V HB . 25921 1
350 . 1 1 55 55 VAL C C 13 176.610 0.4 . 1 . . . . 35 V C . 25921 1
351 . 1 1 55 55 VAL CA C 13 62.885 0.4 . 1 . . . . 35 V CA . 25921 1
352 . 1 1 55 55 VAL CB C 13 32.711 0.4 . 1 . . . . 35 V CB . 25921 1
353 . 1 1 55 55 VAL N N 15 118.820 0.25 . 1 . . . . 35 V N . 25921 1
354 . 1 1 56 56 GLU H H 1 8.496 0.02 . 1 . . . . 36 E HN . 25921 1
355 . 1 1 56 56 GLU HB2 H 1 1.950 0.3 . 2 . . . . 36 E QB . 25921 1
356 . 1 1 56 56 GLU HB3 H 1 1.950 0.3 . 2 . . . . 36 E QB . 25921 1
357 . 1 1 56 56 GLU C C 13 176.408 0.4 . 1 . . . . 36 E C . 25921 1
358 . 1 1 56 56 GLU CA C 13 56.944 0.4 . 1 . . . . 36 E CA . 25921 1
359 . 1 1 56 56 GLU CB C 13 29.698 0.4 . 1 . . . . 36 E CB . 25921 1
360 . 1 1 56 56 GLU N N 15 123.463 0.25 . 1 . . . . 36 E N . 25921 1
361 . 1 1 57 57 ALA H H 1 8.198 0.02 . 1 . . . . 37 A HN . 25921 1
362 . 1 1 57 57 ALA HA H 1 4.250 0.3 . 1 . . . . 37 A HA . 25921 1
363 . 1 1 57 57 ALA HB1 H 1 1.386 0.3 . 1 . . . . 37 A QB . 25921 1
364 . 1 1 57 57 ALA HB2 H 1 1.386 0.3 . 1 . . . . 37 A QB . 25921 1
365 . 1 1 57 57 ALA HB3 H 1 1.386 0.3 . 1 . . . . 37 A QB . 25921 1
366 . 1 1 57 57 ALA C C 13 178.181 0.4 . 1 . . . . 37 A C . 25921 1
367 . 1 1 57 57 ALA CA C 13 53.000 0.4 . 1 . . . . 37 A CA . 25921 1
368 . 1 1 57 57 ALA CB C 13 19.311 0.4 . 1 . . . . 37 A CB . 25921 1
369 . 1 1 57 57 ALA N N 15 124.062 0.25 . 1 . . . . 37 A N . 25921 1
370 . 1 1 58 58 GLU H H 1 8.230 0.02 . 1 . . . . 38 E HN . 25921 1
371 . 1 1 58 58 GLU HA H 1 4.157 0.3 . 1 . . . . 38 E HA . 25921 1
372 . 1 1 58 58 GLU HB2 H 1 2.019 0.3 . 2 . . . . 38 E QB . 25921 1
373 . 1 1 58 58 GLU HB3 H 1 2.019 0.3 . 2 . . . . 38 E QB . 25921 1
374 . 1 1 58 58 GLU C C 13 176.812 0.4 . 1 . . . . 38 E C . 25921 1
375 . 1 1 58 58 GLU CA C 13 57.093 0.4 . 1 . . . . 38 E CA . 25921 1
376 . 1 1 58 58 GLU CB C 13 29.847 0.4 . 1 . . . . 38 E CB . 25921 1
377 . 1 1 58 58 GLU N N 15 119.229 0.25 . 1 . . . . 38 E N . 25921 1
378 . 1 1 59 59 LYS H H 1 8.106 0.02 . 1 . . . . 39 K HN . 25921 1
379 . 1 1 59 59 LYS HA H 1 4.113 0.3 . 1 . . . . 39 K HA . 25921 1
380 . 1 1 59 59 LYS HB2 H 1 1.718 0.3 . 2 . . . . 39 K QB . 25921 1
381 . 1 1 59 59 LYS HB3 H 1 1.718 0.3 . 2 . . . . 39 K QB . 25921 1
382 . 1 1 59 59 LYS C C 13 176.498 0.4 . 1 . . . . 39 K C . 25921 1
383 . 1 1 59 59 LYS CA C 13 56.875 0.4 . 1 . . . . 39 K CA . 25921 1
384 . 1 1 59 59 LYS CB C 13 32.560 0.4 . 1 . . . . 39 K CB . 25921 1
385 . 1 1 59 59 LYS N N 15 120.842 0.25 . 1 . . . . 39 K N . 25921 1
386 . 1 1 60 60 ASP H H 1 8.188 0.02 . 1 . . . . 40 D HN . 25921 1
387 . 1 1 60 60 ASP HA H 1 4.463 0.3 . 1 . . . . 40 D HA . 25921 1
388 . 1 1 60 60 ASP HB2 H 1 2.569 0.3 . 2 . . . . 40 D QB . 25921 1
389 . 1 1 60 60 ASP HB3 H 1 2.569 0.3 . 2 . . . . 40 D QB . 25921 1
390 . 1 1 60 60 ASP C C 13 176.281 0.4 . 1 . . . . 40 D C . 25921 1
391 . 1 1 60 60 ASP CA C 13 54.584 0.4 . 1 . . . . 40 D CA . 25921 1
392 . 1 1 60 60 ASP CB C 13 40.808 0.4 . 1 . . . . 40 D CB . 25921 1
393 . 1 1 60 60 ASP N N 15 119.816 0.25 . 1 . . . . 40 D N . 25921 1
394 . 1 1 61 61 PHE H H 1 7.959 0.02 . 1 . . . . 41 F HN . 25921 1
395 . 1 1 61 61 PHE HB2 H 1 2.896 0.3 . 2 . . . . 41 F QB . 25921 1
396 . 1 1 61 61 PHE HB3 H 1 2.896 0.3 . 2 . . . . 41 F QB . 25921 1
397 . 1 1 61 61 PHE CA C 13 58.382 0.4 . 1 . . . . 41 F CA . 25921 1
398 . 1 1 61 61 PHE CB C 13 39.463 0.4 . 1 . . . . 41 F CB . 25921 1
399 . 1 1 61 61 PHE N N 15 120.278 0.25 . 1 . . . . 41 F N . 25921 1
400 . 1 1 62 62 TRP H H 1 7.952 0.02 . 1 . . . . 42 W HN . 25921 1
401 . 1 1 62 62 TRP HA H 1 4.579 0.3 . 1 . . . . 42 W HA . 25921 1
402 . 1 1 62 62 TRP HB2 H 1 3.217 0.3 . 2 . . . . 42 W QB . 25921 1
403 . 1 1 62 62 TRP HB3 H 1 3.217 0.3 . 2 . . . . 42 W QB . 25921 1
404 . 1 1 62 62 TRP C C 13 176.542 0.4 . 1 . . . . 42 W C . 25921 1
405 . 1 1 62 62 TRP CA C 13 58.021 0.4 . 1 . . . . 42 W CA . 25921 1
406 . 1 1 62 62 TRP CB C 13 29.315 0.4 . 1 . . . . 42 W CB . 25921 1
407 . 1 1 62 62 TRP N N 15 120.213 0.25 . 1 . . . . 42 W N . 25921 1
408 . 1 1 63 63 THR H H 1 7.923 0.02 . 1 . . . . 43 T HN . 25921 1
409 . 1 1 63 63 THR HA H 1 4.203 0.3 . 1 . . . . 43 T HA . 25921 1
410 . 1 1 63 63 THR C C 13 174.774 0.4 . 1 . . . . 43 T C . 25921 1
411 . 1 1 63 63 THR CA C 13 62.733 0.4 . 1 . . . . 43 T CA . 25921 1
412 . 1 1 63 63 THR CB C 13 69.766 0.4 . 1 . . . . 43 T CB . 25921 1
413 . 1 1 63 63 THR N N 15 114.173 0.25 . 1 . . . . 43 T N . 25921 1
414 . 1 1 64 64 THR H H 1 7.996 0.02 . 1 . . . . 44 T HN . 25921 1
415 . 1 1 64 64 THR HA H 1 4.266 0.3 . 1 . . . . 44 T HA . 25921 1
416 . 1 1 64 64 THR C C 13 174.870 0.4 . 1 . . . . 44 T C . 25921 1
417 . 1 1 64 64 THR CA C 13 62.924 0.4 . 1 . . . . 44 T CA . 25921 1
418 . 1 1 64 64 THR CB C 13 70.248 0.4 . 1 . . . . 44 T CB . 25921 1
419 . 1 1 64 64 THR N N 15 115.638 0.25 . 1 . . . . 44 T N . 25921 1
420 . 1 1 65 65 VAL H H 1 8.011 0.02 . 1 . . . . 45 V HN . 25921 1
421 . 1 1 65 65 VAL HA H 1 3.995 0.3 . 1 . . . . 45 V HA . 25921 1
422 . 1 1 65 65 VAL HB H 1 1.978 0.3 . 1 . . . . 45 V HB . 25921 1
423 . 1 1 65 65 VAL C C 13 176.154 0.4 . 1 . . . . 45 V C . 25921 1
424 . 1 1 65 65 VAL CA C 13 62.683 0.4 . 1 . . . . 45 V CA . 25921 1
425 . 1 1 65 65 VAL CB C 13 32.423 0.4 . 1 . . . . 45 V CB . 25921 1
426 . 1 1 65 65 VAL N N 15 121.507 0.25 . 1 . . . . 45 V N . 25921 1
427 . 1 1 66 66 GLN H H 1 8.306 0.02 . 1 . . . . 46 Q HN . 25921 1
428 . 1 1 66 66 GLN HA H 1 4.218 0.3 . 1 . . . . 46 Q HA . 25921 1
429 . 1 1 66 66 GLN HB2 H 1 2.011 0.3 . 2 . . . . 46 Q QB . 25921 1
430 . 1 1 66 66 GLN HB3 H 1 2.011 0.3 . 2 . . . . 46 Q QB . 25921 1
431 . 1 1 66 66 GLN C C 13 176.388 0.4 . 1 . . . . 46 Q C . 25921 1
432 . 1 1 66 66 GLN CA C 13 56.465 0.4 . 1 . . . . 46 Q CA . 25921 1
433 . 1 1 66 66 GLN CB C 13 29.218 0.4 . 1 . . . . 46 Q CB . 25921 1
434 . 1 1 66 66 GLN N N 15 122.900 0.25 . 1 . . . . 46 Q N . 25921 1
435 . 1 1 67 67 GLY H H 1 8.279 0.02 . 1 . . . . 47 G HN . 25921 1
436 . 1 1 67 67 GLY HA2 H 1 3.914 0.3 . 2 . . . . 47 G QA . 25921 1
437 . 1 1 67 67 GLY HA3 H 1 3.914 0.3 . 2 . . . . 47 G QA . 25921 1
438 . 1 1 67 67 GLY C C 13 173.608 0.4 . 1 . . . . 47 G C . 25921 1
439 . 1 1 67 67 GLY CA C 13 45.215 0.4 . 1 . . . . 47 G CA . 25921 1
440 . 1 1 67 67 GLY N N 15 109.321 0.25 . 1 . . . . 47 G N . 25921 1
441 . 1 1 68 68 LYS H H 1 8.020 0.02 . 1 . . . . 48 K HN . 25921 1
442 . 1 1 68 68 LYS C C 13 174.508 0.4 . 1 . . . . 48 K C . 25921 1
443 . 1 1 68 68 LYS CA C 13 54.306 0.4 . 1 . . . . 48 K CA . 25921 1
444 . 1 1 68 68 LYS CB C 13 32.728 0.4 . 1 . . . . 48 K CB . 25921 1
445 . 1 1 68 68 LYS N N 15 121.422 0.25 . 1 . . . . 48 K N . 25921 1
446 . 1 1 69 69 PRO HA H 1 4.445 0.3 . 1 . . . . 49 P HA . 25921 1
447 . 1 1 69 69 PRO HB2 H 1 2.238 0.3 . 1 . . . . 49 P HB2 . 25921 1
448 . 1 1 69 69 PRO HB3 H 1 1.861 0.3 . 1 . . . . 49 P HB3 . 25921 1
449 . 1 1 69 69 PRO C C 13 177.009 0.4 . 1 . . . . 49 P C . 25921 1
450 . 1 1 69 69 PRO CA C 13 62.969 0.4 . 1 . . . . 49 P CA . 25921 1
451 . 1 1 69 69 PRO CB C 13 31.913 0.4 . 1 . . . . 49 P CB . 25921 1
452 . 1 1 70 70 GLN H H 1 8.565 0.02 . 1 . . . . 50 Q HN . 25921 1
453 . 1 1 70 70 GLN HA H 1 4.250 0.3 . 1 . . . . 50 Q HA . 25921 1
454 . 1 1 70 70 GLN HB2 H 1 2.044 0.3 . 2 . . . . 50 Q QB . 25921 1
455 . 1 1 70 70 GLN HB3 H 1 2.044 0.3 . 2 . . . . 50 Q QB . 25921 1
456 . 1 1 70 70 GLN C C 13 176.221 0.4 . 1 . . . . 50 Q C . 25921 1
457 . 1 1 70 70 GLN CA C 13 56.128 0.4 . 1 . . . . 50 Q CA . 25921 1
458 . 1 1 70 70 GLN CB C 13 29.472 0.4 . 1 . . . . 50 Q CB . 25921 1
459 . 1 1 70 70 GLN N N 15 120.741 0.25 . 1 . . . . 50 Q N . 25921 1
460 . 1 1 71 71 SER H H 1 8.331 0.02 . 1 . . . . 51 S HN . 25921 1
461 . 1 1 71 71 SER HA H 1 4.391 0.3 . 1 . . . . 51 S HA . 25921 1
462 . 1 1 71 71 SER HB2 H 1 3.828 0.3 . 2 . . . . 51 S QB . 25921 1
463 . 1 1 71 71 SER HB3 H 1 3.828 0.3 . 2 . . . . 51 S QB . 25921 1
464 . 1 1 71 71 SER C C 13 174.587 0.4 . 1 . . . . 51 S C . 25921 1
465 . 1 1 71 71 SER CA C 13 58.318 0.4 . 1 . . . . 51 S CA . 25921 1
466 . 1 1 71 71 SER CB C 13 63.880 0.4 . 1 . . . . 51 S CB . 25921 1
467 . 1 1 71 71 SER N N 15 116.353 0.25 . 1 . . . . 51 S N . 25921 1
468 . 1 1 72 72 SER H H 1 8.248 0.02 . 1 . . . . 52 S HN . 25921 1
469 . 1 1 72 72 SER HB2 H 1 3.790 0.3 . 2 . . . . 52 S QB . 25921 1
470 . 1 1 72 72 SER HB3 H 1 3.790 0.3 . 2 . . . . 52 S QB . 25921 1
471 . 1 1 72 72 SER C C 13 174.173 0.4 . 1 . . . . 52 S C . 25921 1
472 . 1 1 72 72 SER CA C 13 58.428 0.4 . 1 . . . . 52 S CA . 25921 1
473 . 1 1 72 72 SER CB C 13 63.994 0.4 . 1 . . . . 52 S CB . 25921 1
474 . 1 1 72 72 SER N N 15 117.296 0.25 . 1 . . . . 52 S N . 25921 1
475 . 1 1 73 73 PHE H H 1 8.128 0.02 . 1 . . . . 53 F HN . 25921 1
476 . 1 1 73 73 PHE HA H 1 4.556 0.3 . 1 . . . . 53 F HA . 25921 1
477 . 1 1 73 73 PHE HB2 H 1 3.024 0.3 . 2 . . . . 53 F QB . 25921 1
478 . 1 1 73 73 PHE HB3 H 1 3.024 0.3 . 2 . . . . 53 F QB . 25921 1
479 . 1 1 73 73 PHE C C 13 175.344 0.4 . 1 . . . . 53 F C . 25921 1
480 . 1 1 73 73 PHE CA C 13 58.123 0.4 . 1 . . . . 53 F CA . 25921 1
481 . 1 1 73 73 PHE CB C 13 38.835 0.4 . 1 . . . . 53 F CB . 25921 1
482 . 1 1 73 73 PHE N N 15 121.715 0.25 . 1 . . . . 53 F N . 25921 1
483 . 1 1 74 74 ARG H H 1 8.143 0.02 . 1 . . . . 54 R HN . 25921 1
484 . 1 1 74 74 ARG HA H 1 4.344 0.3 . 1 . . . . 54 R HA . 25921 1
485 . 1 1 74 74 ARG HB2 H 1 1.715 0.3 . 2 . . . . 54 R QB . 25921 1
486 . 1 1 74 74 ARG HB3 H 1 1.715 0.3 . 2 . . . . 54 R QB . 25921 1
487 . 1 1 74 74 ARG C C 13 176.082 0.4 . 1 . . . . 54 R C . 25921 1
488 . 1 1 74 74 ARG CA C 13 56.168 0.4 . 1 . . . . 54 R CA . 25921 1
489 . 1 1 74 74 ARG CB C 13 31.261 0.4 . 1 . . . . 54 R CB . 25921 1
490 . 1 1 74 74 ARG N N 15 122.316 0.25 . 1 . . . . 54 R N . 25921 1
491 . 1 1 75 75 THR H H 1 8.194 0.02 . 1 . . . . 55 T HN . 25921 1
492 . 1 1 75 75 THR HA H 1 4.203 0.3 . 1 . . . . 55 T HA . 25921 1
493 . 1 1 75 75 THR C C 13 174.674 0.4 . 1 . . . . 55 T C . 25921 1
494 . 1 1 75 75 THR CA C 13 62.042 0.4 . 1 . . . . 55 T CA . 25921 1
495 . 1 1 75 75 THR CB C 13 70.235 0.4 . 1 . . . . 55 T CB . 25921 1
496 . 1 1 75 75 THR N N 15 115.082 0.25 . 1 . . . . 55 T N . 25921 1
497 . 1 1 76 76 THR H H 1 8.046 0.02 . 1 . . . . 56 T HN . 25921 1
498 . 1 1 76 76 THR HA H 1 4.188 0.3 . 1 . . . . 56 T HA . 25921 1
499 . 1 1 76 76 THR C C 13 174.136 0.4 . 1 . . . . 56 T C . 25921 1
500 . 1 1 76 76 THR CA C 13 61.993 0.4 . 1 . . . . 56 T CA . 25921 1
501 . 1 1 76 76 THR CB C 13 69.901 0.4 . 1 . . . . 56 T CB . 25921 1
502 . 1 1 76 76 THR N N 15 115.513 0.25 . 1 . . . . 56 T N . 25921 1
503 . 1 1 77 77 TYR H H 1 8.135 0.02 . 1 . . . . 57 Y HN . 25921 1
504 . 1 1 77 77 TYR HA H 1 4.523 0.3 . 1 . . . . 57 Y HA . 25921 1
505 . 1 1 77 77 TYR HB2 H 1 2.936 0.3 . 2 . . . . 57 Y QB . 25921 1
506 . 1 1 77 77 TYR HB3 H 1 2.936 0.3 . 2 . . . . 57 Y QB . 25921 1
507 . 1 1 77 77 TYR C C 13 175.269 0.4 . 1 . . . . 57 Y C . 25921 1
508 . 1 1 77 77 TYR CA C 13 57.712 0.4 . 1 . . . . 57 Y CA . 25921 1
509 . 1 1 77 77 TYR CB C 13 38.673 0.4 . 1 . . . . 57 Y CB . 25921 1
510 . 1 1 77 77 TYR N N 15 121.727 0.25 . 1 . . . . 57 Y N . 25921 1
511 . 1 1 78 78 ASP H H 1 8.211 0.02 . 1 . . . . 58 D HN . 25921 1
512 . 1 1 78 78 ASP HA H 1 4.529 0.3 . 1 . . . . 58 D HA . 25921 1
513 . 1 1 78 78 ASP HB2 H 1 2.642 0.3 . 2 . . . . 58 D QB . 25921 1
514 . 1 1 78 78 ASP HB3 H 1 2.642 0.3 . 2 . . . . 58 D QB . 25921 1
515 . 1 1 78 78 ASP C C 13 176.131 0.4 . 1 . . . . 58 D C . 25921 1
516 . 1 1 78 78 ASP CA C 13 54.207 0.4 . 1 . . . . 58 D CA . 25921 1
517 . 1 1 78 78 ASP CB C 13 41.025 0.4 . 1 . . . . 58 D CB . 25921 1
518 . 1 1 78 78 ASP N N 15 121.938 0.25 . 1 . . . . 58 D N . 25921 1
519 . 1 1 79 79 ARG H H 1 8.241 0.02 . 1 . . . . 59 R HN . 25921 1
520 . 1 1 79 79 ARG HA H 1 4.250 0.3 . 1 . . . . 59 R HA . 25921 1
521 . 1 1 79 79 ARG HB2 H 1 1.809 0.3 . 2 . . . . 59 R QB . 25921 1
522 . 1 1 79 79 ARG HB3 H 1 1.809 0.3 . 2 . . . . 59 R QB . 25921 1
523 . 1 1 79 79 ARG C C 13 176.695 0.4 . 1 . . . . 59 R C . 25921 1
524 . 1 1 79 79 ARG CA C 13 56.769 0.4 . 1 . . . . 59 R CA . 25921 1
525 . 1 1 79 79 ARG CB C 13 30.403 0.4 . 1 . . . . 59 R CB . 25921 1
526 . 1 1 79 79 ARG N N 15 121.622 0.25 . 1 . . . . 59 R N . 25921 1
527 . 1 1 80 80 SER H H 1 8.372 0.02 . 1 . . . . 60 S HN . 25921 1
528 . 1 1 80 80 SER HA H 1 4.335 0.3 . 1 . . . . 60 S HA . 25921 1
529 . 1 1 80 80 SER HB2 H 1 3.863 0.3 . 2 . . . . 60 S QB . 25921 1
530 . 1 1 80 80 SER HB3 H 1 3.863 0.3 . 2 . . . . 60 S QB . 25921 1
531 . 1 1 80 80 SER C C 13 174.537 0.4 . 1 . . . . 60 S C . 25921 1
532 . 1 1 80 80 SER CA C 13 59.398 0.4 . 1 . . . . 60 S CA . 25921 1
533 . 1 1 80 80 SER CB C 13 64.081 0.4 . 1 . . . . 60 S CB . 25921 1
534 . 1 1 80 80 SER N N 15 116.233 0.25 . 1 . . . . 60 S N . 25921 1
535 . 1 1 81 81 ASN H H 1 8.286 0.02 . 1 . . . . 61 N HN . 25921 1
536 . 1 1 81 81 ASN HA H 1 4.671 0.3 . 1 . . . . 61 N HA . 25921 1
537 . 1 1 81 81 ASN HB2 H 1 2.745 0.3 . 2 . . . . 61 N QB . 25921 1
538 . 1 1 81 81 ASN HB3 H 1 2.745 0.3 . 2 . . . . 61 N QB . 25921 1
539 . 1 1 81 81 ASN C C 13 174.976 0.4 . 1 . . . . 61 N C . 25921 1
540 . 1 1 81 81 ASN CA C 13 53.302 0.4 . 1 . . . . 61 N CA . 25921 1
541 . 1 1 81 81 ASN CB C 13 38.944 0.4 . 1 . . . . 61 N CB . 25921 1
542 . 1 1 81 81 ASN N N 15 120.167 0.25 . 1 . . . . 61 N N . 25921 1
543 . 1 1 82 82 ALA H H 1 8.150 0.02 . 1 . . . . 62 A HN . 25921 1
544 . 1 1 82 82 ALA HA H 1 4.297 0.3 . 1 . . . . 62 A HA . 25921 1
545 . 1 1 82 82 ALA HB1 H 1 1.386 0.3 . 1 . . . . 62 A QB . 25921 1
546 . 1 1 82 82 ALA HB2 H 1 1.386 0.3 . 1 . . . . 62 A QB . 25921 1
547 . 1 1 82 82 ALA HB3 H 1 1.386 0.3 . 1 . . . . 62 A QB . 25921 1
548 . 1 1 82 82 ALA C C 13 177.790 0.4 . 1 . . . . 62 A C . 25921 1
549 . 1 1 82 82 ALA CA C 13 52.928 0.4 . 1 . . . . 62 A CA . 25921 1
550 . 1 1 82 82 ALA CB C 13 19.230 0.4 . 1 . . . . 62 A CB . 25921 1
551 . 1 1 82 82 ALA N N 15 123.900 0.25 . 1 . . . . 62 A N . 25921 1
552 . 1 1 83 83 SER H H 1 8.209 0.02 . 1 . . . . 63 S HN . 25921 1
553 . 1 1 83 83 SER HA H 1 4.420 0.3 . 1 . . . . 63 S HA . 25921 1
554 . 1 1 83 83 SER HB2 H 1 3.860 0.3 . 2 . . . . 63 S QB . 25921 1
555 . 1 1 83 83 SER HB3 H 1 3.860 0.3 . 2 . . . . 63 S QB . 25921 1
556 . 1 1 83 83 SER C C 13 174.533 0.4 . 1 . . . . 63 S C . 25921 1
557 . 1 1 83 83 SER CA C 13 58.516 0.4 . 1 . . . . 63 S CA . 25921 1
558 . 1 1 83 83 SER CB C 13 63.795 0.4 . 1 . . . . 63 S CB . 25921 1
559 . 1 1 83 83 SER N N 15 114.442 0.25 . 1 . . . . 63 S N . 25921 1
560 . 1 1 84 84 LEU H H 1 8.189 0.02 . 1 . . . . 64 L HN . 25921 1
561 . 1 1 84 84 LEU HA H 1 4.402 0.3 . 1 . . . . 64 L HA . 25921 1
562 . 1 1 84 84 LEU HB2 H 1 1.632 0.3 . 2 . . . . 64 L QB . 25921 1
563 . 1 1 84 84 LEU HB3 H 1 1.632 0.3 . 2 . . . . 64 L QB . 25921 1
564 . 1 1 84 84 LEU C C 13 176.568 0.4 . 1 . . . . 64 L C . 25921 1
565 . 1 1 84 84 LEU CA C 13 55.579 0.4 . 1 . . . . 64 L CA . 25921 1
566 . 1 1 84 84 LEU CB C 13 42.381 0.4 . 1 . . . . 64 L CB . 25921 1
567 . 1 1 84 84 LEU N N 15 124.059 0.25 . 1 . . . . 64 L N . 25921 1
568 . 1 1 85 85 SER H H 1 7.852 0.02 . 1 . . . . 65 S HN . 25921 1
569 . 1 1 85 85 SER C C 13 178.534 0.4 . 1 . . . . 65 S C . 25921 1
570 . 1 1 85 85 SER CA C 13 65.062 0.4 . 1 . . . . 65 S CA . 25921 1
571 . 1 1 85 85 SER CB C 13 60.080 0.4 . 1 . . . . 65 S CB . 25921 1
572 . 1 1 85 85 SER N N 15 121.223 0.25 . 1 . . . . 65 S N . 25921 1
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