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 18813
_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 .
_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
2 '3D 1H-13C NOESY aromatic' . . . 18813 1
4 '3D HNCACB' . . . 18813 1
5 '3D HBHA(CO)NH' . . . 18813 1
6 '3D CBCA(CO)NH' . . . 18813 1
7 '3D HCCH-TOCSY' . . . 18813 1
8 '2D 1H-1H NOESY' . . . 18813 1
9 '3D 1H-15N NOESY' . . . 18813 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 6 6 SER HA H 1 4.519 0.05 . 1 . . . . 10 S HA . 18813 1
2 . 1 1 6 6 SER HB2 H 1 3.854 0.05 . 2 . . . . 10 S HB2 . 18813 1
3 . 1 1 7 7 GLY H H 1 8.207 0.05 . 1 . . . . 11 G H . 18813 1
4 . 1 1 7 7 GLY CA C 13 44.545 0.15 . 1 . . . . 11 G CA . 18813 1
5 . 1 1 7 7 GLY N N 15 110.610 0.15 . 1 . . . . 11 G N . 18813 1
6 . 1 1 10 10 SER HA H 1 4.419 0.05 . 1 . . . . 14 S HA . 18813 1
7 . 1 1 10 10 SER HB2 H 1 3.801 0.05 . 2 . . . . 14 S HB2 . 18813 1
8 . 1 1 10 10 SER CA C 13 58.413 0.15 . 1 . . . . 14 S CA . 18813 1
9 . 1 1 10 10 SER CB C 13 63.879 0.15 . 1 . . . . 14 S CB . 18813 1
10 . 1 1 11 11 LEU H H 1 8.084 0.05 . 1 . . . . 15 L H . 18813 1
11 . 1 1 11 11 LEU HA H 1 4.248 0.05 . 1 . . . . 15 L HA . 18813 1
12 . 1 1 11 11 LEU HB2 H 1 1.399 0.05 . 2 . . . . 15 L HB2 . 18813 1
13 . 1 1 11 11 LEU C C 13 176.667 0.15 . 1 . . . . 15 L C . 18813 1
14 . 1 1 11 11 LEU CA C 13 55.550 0.15 . 1 . . . . 15 L CA . 18813 1
15 . 1 1 11 11 LEU CB C 13 42.257 0.15 . 1 . . . . 15 L CB . 18813 1
16 . 1 1 11 11 LEU N N 15 123.421 0.15 . 1 . . . . 15 L N . 18813 1
17 . 1 1 14 14 PRO HA H 1 4.183 0.05 . 1 . . . . 18 P HA . 18813 1
18 . 1 1 14 14 PRO HB2 H 1 1.922 0.05 . 2 . . . . 18 P HB2 . 18813 1
19 . 1 1 14 14 PRO HB3 H 1 2.229 0.05 . 2 . . . . 18 P HB3 . 18813 1
20 . 1 1 14 14 PRO C C 13 176.735 0.15 . 1 . . . . 18 P C . 18813 1
21 . 1 1 14 14 PRO CA C 13 63.490 0.15 . 1 . . . . 18 P CA . 18813 1
22 . 1 1 14 14 PRO CB C 13 31.985 0.15 . 1 . . . . 18 P CB . 18813 1
23 . 1 1 15 15 ALA H H 1 8.242 0.05 . 1 . . . . 19 A H . 18813 1
24 . 1 1 15 15 ALA HA H 1 4.277 0.05 . 1 . . . . 19 A HA . 18813 1
25 . 1 1 15 15 ALA HB1 H 1 1.348 0.05 . 1 . . . . 19 A QB . 18813 1
26 . 1 1 15 15 ALA HB2 H 1 1.348 0.05 . 1 . . . . 19 A QB . 18813 1
27 . 1 1 15 15 ALA HB3 H 1 1.348 0.05 . 1 . . . . 19 A QB . 18813 1
28 . 1 1 15 15 ALA C C 13 177.686 0.15 . 1 . . . . 19 A C . 18813 1
29 . 1 1 15 15 ALA CA C 13 52.438 0.15 . 1 . . . . 19 A CA . 18813 1
30 . 1 1 15 15 ALA CB C 13 19.164 0.15 . 1 . . . . 19 A CB . 18813 1
31 . 1 1 15 15 ALA N N 15 122.156 0.15 . 1 . . . . 19 A N . 18813 1
32 . 1 1 16 16 SER H H 1 7.916 0.05 . 1 . . . . 20 S H . 18813 1
33 . 1 1 16 16 SER HB2 H 1 3.855 0.05 . 2 . . . . 20 S HB2 . 18813 1
34 . 1 1 16 16 SER HB3 H 1 3.784 0.05 . 2 . . . . 20 S HB3 . 18813 1
35 . 1 1 16 16 SER CA C 13 56.508 0.15 . 1 . . . . 20 S CA . 18813 1
36 . 1 1 16 16 SER CB C 13 63.579 0.15 . 1 . . . . 20 S CB . 18813 1
37 . 1 1 16 16 SER N N 15 116.002 0.15 . 1 . . . . 20 S N . 18813 1
38 . 1 1 17 17 PRO HA H 1 4.410 0.05 . 1 . . . . 21 P HA . 18813 1
39 . 1 1 17 17 PRO HB2 H 1 1.884 0.05 . 2 . . . . 21 P HB2 . 18813 1
40 . 1 1 17 17 PRO HB3 H 1 2.242 0.05 . 2 . . . . 21 P HB3 . 18813 1
41 . 1 1 17 17 PRO C C 13 176.324 0.15 . 1 . . . . 21 P C . 18813 1
42 . 1 1 17 17 PRO CA C 13 62.968 0.15 . 1 . . . . 21 P CA . 18813 1
43 . 1 1 17 17 PRO CB C 13 31.971 0.15 . 1 . . . . 21 P CB . 18813 1
44 . 1 1 18 18 ALA H H 1 8.295 0.05 . 1 . . . . 22 A H . 18813 1
45 . 1 1 18 18 ALA CA C 13 50.533 0.15 . 1 . . . . 22 A CA . 18813 1
46 . 1 1 18 18 ALA CB C 13 17.935 0.15 . 1 . . . . 22 A CB . 18813 1
47 . 1 1 18 18 ALA N N 15 125.657 0.15 . 1 . . . . 22 A N . 18813 1
48 . 1 1 19 19 PRO HA H 1 4.473 0.05 . 1 . . . . 23 P HA . 18813 1
49 . 1 1 19 19 PRO HB2 H 1 1.907 0.05 . 2 . . . . 23 P HB2 . 18813 1
50 . 1 1 19 19 PRO HB3 H 1 2.278 0.05 . 2 . . . . 23 P HB3 . 18813 1
51 . 1 1 19 19 PRO C C 13 177.255 0.15 . 1 . . . . 23 P C . 18813 1
52 . 1 1 19 19 PRO CA C 13 63.211 0.15 . 1 . . . . 23 P CA . 18813 1
53 . 1 1 19 19 PRO CB C 13 31.877 0.15 . 1 . . . . 23 P CB . 18813 1
54 . 1 1 20 20 THR H H 1 8.203 0.05 . 1 . . . . 24 T H . 18813 1
55 . 1 1 20 20 THR HA H 1 4.326 0.05 . 1 . . . . 24 T HA . 18813 1
56 . 1 1 20 20 THR CA C 13 61.854 0.15 . 1 . . . . 24 T CA . 18813 1
57 . 1 1 20 20 THR CB C 13 69.860 0.15 . 1 . . . . 24 T CB . 18813 1
58 . 1 1 20 20 THR N N 15 113.523 0.15 . 1 . . . . 24 T N . 18813 1
59 . 1 1 21 21 SER H H 1 8.227 0.05 . 1 . . . . 25 S H . 18813 1
60 . 1 1 21 21 SER N N 15 117.288 0.15 . 1 . . . . 25 S N . 18813 1
61 . 1 1 23 23 PRO CA C 13 63.077 0.15 . 1 . . . . 27 P CA . 18813 1
62 . 1 1 23 23 PRO CB C 13 32.026 0.15 . 1 . . . . 27 P CB . 18813 1
63 . 1 1 24 24 ARG H H 1 8.410 0.05 . 1 . . . . 28 R H . 18813 1
64 . 1 1 24 24 ARG CA C 13 53.977 0.15 . 1 . . . . 28 R CA . 18813 1
65 . 1 1 24 24 ARG CB C 13 30.221 0.15 . 1 . . . . 28 R CB . 18813 1
66 . 1 1 24 24 ARG N N 15 122.692 0.15 . 1 . . . . 28 R N . 18813 1
67 . 1 1 25 25 PRO HA H 1 4.393 0.05 . 1 . . . . 29 P HA . 18813 1
68 . 1 1 25 25 PRO HB2 H 1 2.231 0.05 . 2 . . . . 29 P HB2 . 18813 1
69 . 1 1 25 25 PRO HB3 H 1 1.849 0.05 . 2 . . . . 29 P HB3 . 18813 1
70 . 1 1 25 25 PRO C C 13 175.983 0.15 . 1 . . . . 29 P C . 18813 1
71 . 1 1 26 26 ARG H H 1 8.309 0.05 . 1 . . . . 30 R H . 18813 1
72 . 1 1 26 26 ARG HA H 1 4.119 0.05 . 1 . . . . 30 R HA . 18813 1
73 . 1 1 26 26 ARG HB2 H 1 1.684 0.05 . 2 . . . . 30 R HB2 . 18813 1
74 . 1 1 26 26 ARG C C 13 174.974 0.15 . 1 . . . . 30 R C . 18813 1
75 . 1 1 26 26 ARG CA C 13 57.101 0.15 . 1 . . . . 30 R CA . 18813 1
76 . 1 1 26 26 ARG CB C 13 30.956 0.15 . 1 . . . . 30 R CB . 18813 1
77 . 1 1 26 26 ARG N N 15 121.295 0.15 . 1 . . . . 30 R N . 18813 1
78 . 1 1 27 27 LEU H H 1 7.098 0.05 . 1 . . . . 31 L H . 18813 1
79 . 1 1 27 27 LEU HA H 1 5.248 0.05 . 1 . . . . 31 L HA . 18813 1
80 . 1 1 27 27 LEU HB2 H 1 0.850 0.05 . 2 . . . . 31 L HB2 . 18813 1
81 . 1 1 27 27 LEU HG H 1 0.843 0.05 . 1 . . . . 31 L HG . 18813 1
82 . 1 1 27 27 LEU HD11 H 1 0.376 0.05 . 2 . . . . 31 L QD1 . 18813 1
83 . 1 1 27 27 LEU HD12 H 1 0.376 0.05 . 2 . . . . 31 L QD1 . 18813 1
84 . 1 1 27 27 LEU HD13 H 1 0.376 0.05 . 2 . . . . 31 L QD1 . 18813 1
85 . 1 1 27 27 LEU HD21 H 1 -0.212 0.05 . 2 . . . . 31 L QD2 . 18813 1
86 . 1 1 27 27 LEU HD22 H 1 -0.212 0.05 . 2 . . . . 31 L QD2 . 18813 1
87 . 1 1 27 27 LEU HD23 H 1 -0.212 0.05 . 2 . . . . 31 L QD2 . 18813 1
88 . 1 1 27 27 LEU C C 13 176.663 0.15 . 1 . . . . 31 L C . 18813 1
89 . 1 1 27 27 LEU CA C 13 52.712 0.15 . 1 . . . . 31 L CA . 18813 1
90 . 1 1 27 27 LEU CB C 13 44.300 0.15 . 1 . . . . 31 L CB . 18813 1
91 . 1 1 27 27 LEU CG C 13 26.717 0.15 . 1 . . . . 31 L CG . 18813 1
92 . 1 1 27 27 LEU CD1 C 13 22.661 0.15 . 2 . . . . 31 L CD1 . 18813 1
93 . 1 1 27 27 LEU CD2 C 13 25.083 0.15 . 2 . . . . 31 L CD2 . 18813 1
94 . 1 1 27 27 LEU N N 15 118.922 0.15 . 1 . . . . 31 L N . 18813 1
95 . 1 1 28 28 TRP H H 1 7.526 0.05 . 1 . . . . 32 W H . 18813 1
96 . 1 1 28 28 TRP HA H 1 4.759 0.05 . 1 . . . . 32 W HA . 18813 1
97 . 1 1 28 28 TRP HB2 H 1 3.115 0.05 . 2 . . . . 32 W HB2 . 18813 1
98 . 1 1 28 28 TRP HB3 H 1 3.253 0.05 . 2 . . . . 32 W HB3 . 18813 1
99 . 1 1 28 28 TRP HD1 H 1 7.002 0.05 . 4 . . . . 32 W HD1 . 18813 1
100 . 1 1 28 28 TRP HE1 H 1 10.104 0.05 . 1 . . . . 32 W HE1 . 18813 1
101 . 1 1 28 28 TRP HE3 H 1 7.181 0.05 . 4 . . . . 32 W HE3 . 18813 1
102 . 1 1 28 28 TRP HZ2 H 1 7.184 0.05 . 4 . . . . 32 W HZ2 . 18813 1
103 . 1 1 28 28 TRP C C 13 173.685 0.15 . 1 . . . . 32 W C . 18813 1
104 . 1 1 28 28 TRP CA C 13 55.691 0.15 . 1 . . . . 32 W CA . 18813 1
105 . 1 1 28 28 TRP CB C 13 30.920 0.15 . 1 . . . . 32 W CB . 18813 1
106 . 1 1 28 28 TRP CE3 C 13 121.197 0.15 . 4 . . . . 32 W CE3 . 18813 1
107 . 1 1 28 28 TRP N N 15 116.897 0.15 . 1 . . . . 32 W N . 18813 1
108 . 1 1 29 29 GLU H H 1 8.714 0.05 . 1 . . . . 33 E H . 18813 1
109 . 1 1 29 29 GLU HA H 1 3.562 0.05 . 1 . . . . 33 E HA . 18813 1
110 . 1 1 29 29 GLU HB2 H 1 1.962 0.05 . 2 . . . . 33 E HB2 . 18813 1
111 . 1 1 29 29 GLU HG2 H 1 2.149 0.05 . 2 . . . . 33 E HG2 . 18813 1
112 . 1 1 29 29 GLU HG3 H 1 2.324 0.05 . 2 . . . . 33 E HG3 . 18813 1
113 . 1 1 29 29 GLU C C 13 177.057 0.15 . 1 . . . . 33 E C . 18813 1
114 . 1 1 29 29 GLU CA C 13 58.792 0.15 . 1 . . . . 33 E CA . 18813 1
115 . 1 1 29 29 GLU CB C 13 30.161 0.15 . 1 . . . . 33 E CB . 18813 1
116 . 1 1 29 29 GLU N N 15 118.641 0.15 . 1 . . . . 33 E N . 18813 1
117 . 1 1 30 30 GLY H H 1 9.189 0.05 . 1 . . . . 34 G H . 18813 1
118 . 1 1 30 30 GLY HA2 H 1 4.423 0.05 . 2 . . . . 34 G HA2 . 18813 1
119 . 1 1 30 30 GLY HA3 H 1 3.528 0.05 . 2 . . . . 34 G HA3 . 18813 1
120 . 1 1 30 30 GLY CA C 13 44.612 0.15 . 1 . . . . 34 G CA . 18813 1
121 . 1 1 30 30 GLY N N 15 112.950 0.15 . 1 . . . . 34 G N . 18813 1
122 . 1 1 31 31 GLN H H 1 7.346 0.05 . 1 . . . . 35 Q H . 18813 1
123 . 1 1 31 31 GLN HA H 1 3.726 0.05 . 1 . . . . 35 Q HA . 18813 1
124 . 1 1 31 31 GLN HB2 H 1 1.596 0.05 . 2 . . . . 35 Q HB2 . 18813 1
125 . 1 1 31 31 GLN HB3 H 1 0.242 0.05 . 2 . . . . 35 Q HB3 . 18813 1
126 . 1 1 31 31 GLN HG2 H 1 1.799 0.05 . 2 . . . . 35 Q HG2 . 18813 1
127 . 1 1 31 31 GLN HG3 H 1 1.574 0.05 . 2 . . . . 35 Q HG3 . 18813 1
128 . 1 1 31 31 GLN HE21 H 1 6.184 0.05 . 2 . . . . 35 Q HE21 . 18813 1
129 . 1 1 31 31 GLN HE22 H 1 5.727 0.05 . 2 . . . . 35 Q HE22 . 18813 1
130 . 1 1 31 31 GLN C C 13 175.411 0.15 . 1 . . . . 35 Q C . 18813 1
131 . 1 1 31 31 GLN CA C 13 56.011 0.15 . 1 . . . . 35 Q CA . 18813 1
132 . 1 1 31 31 GLN CB C 13 30.614 0.15 . 1 . . . . 35 Q CB . 18813 1
133 . 1 1 31 31 GLN CG C 13 32.066 0.15 . 1 . . . . 35 Q CG . 18813 1
134 . 1 1 31 31 GLN N N 15 123.766 0.15 . 1 . . . . 35 Q N . 18813 1
135 . 1 1 32 32 ASP H H 1 8.413 0.05 . 1 . . . . 36 D H . 18813 1
136 . 1 1 32 32 ASP HA H 1 5.309 0.05 . 1 . . . . 36 D HA . 18813 1
137 . 1 1 32 32 ASP HB2 H 1 2.444 0.05 . 2 . . . . 36 D HB2 . 18813 1
138 . 1 1 32 32 ASP HB3 H 1 2.531 0.05 . 2 . . . . 36 D HB3 . 18813 1
139 . 1 1 32 32 ASP C C 13 176.142 0.15 . 1 . . . . 36 D C . 18813 1
140 . 1 1 32 32 ASP CA C 13 54.075 0.15 . 1 . . . . 36 D CA . 18813 1
141 . 1 1 32 32 ASP CB C 13 41.012 0.15 . 1 . . . . 36 D CB . 18813 1
142 . 1 1 32 32 ASP N N 15 125.487 0.15 . 1 . . . . 36 D N . 18813 1
143 . 1 1 33 33 VAL H H 1 9.105 0.05 . 1 . . . . 37 V H . 18813 1
144 . 1 1 33 33 VAL HA H 1 4.753 0.05 . 1 . . . . 37 V HA . 18813 1
145 . 1 1 33 33 VAL HB H 1 1.997 0.05 . 1 . . . . 37 V HB . 18813 1
146 . 1 1 33 33 VAL HG11 H 1 0.436 0.05 . 2 . . . . 37 V QG1 . 18813 1
147 . 1 1 33 33 VAL HG12 H 1 0.436 0.05 . 2 . . . . 37 V QG1 . 18813 1
148 . 1 1 33 33 VAL HG13 H 1 0.436 0.05 . 2 . . . . 37 V QG1 . 18813 1
149 . 1 1 33 33 VAL HG21 H 1 0.351 0.05 . 2 . . . . 37 V QG2 . 18813 1
150 . 1 1 33 33 VAL HG22 H 1 0.351 0.05 . 2 . . . . 37 V QG2 . 18813 1
151 . 1 1 33 33 VAL HG23 H 1 0.351 0.05 . 2 . . . . 37 V QG2 . 18813 1
152 . 1 1 33 33 VAL C C 13 173.563 0.15 . 1 . . . . 37 V C . 18813 1
153 . 1 1 33 33 VAL CA C 13 59.163 0.15 . 1 . . . . 37 V CA . 18813 1
154 . 1 1 33 33 VAL CB C 13 36.253 0.15 . 1 . . . . 37 V CB . 18813 1
155 . 1 1 33 33 VAL CG1 C 13 21.984 0.15 . 2 . . . . 37 V CG1 . 18813 1
156 . 1 1 33 33 VAL CG2 C 13 16.492 0.15 . 2 . . . . 37 V CG2 . 18813 1
157 . 1 1 33 33 VAL N N 15 115.943 0.15 . 1 . . . . 37 V N . 18813 1
158 . 1 1 34 34 LEU H H 1 8.719 0.05 . 1 . . . . 38 L H . 18813 1
159 . 1 1 34 34 LEU HA H 1 4.860 0.05 . 1 . . . . 38 L HA . 18813 1
160 . 1 1 34 34 LEU HB2 H 1 1.054 0.05 . 2 . . . . 38 L HB2 . 18813 1
161 . 1 1 34 34 LEU HB3 H 1 1.594 0.05 . 2 . . . . 38 L HB3 . 18813 1
162 . 1 1 34 34 LEU HG H 1 1.298 0.05 . 1 . . . . 38 L HG . 18813 1
163 . 1 1 34 34 LEU HD11 H 1 0.638 0.05 . 2 . . . . 38 L QD1 . 18813 1
164 . 1 1 34 34 LEU HD12 H 1 0.638 0.05 . 2 . . . . 38 L QD1 . 18813 1
165 . 1 1 34 34 LEU HD13 H 1 0.638 0.05 . 2 . . . . 38 L QD1 . 18813 1
166 . 1 1 34 34 LEU HD21 H 1 0.400 0.05 . 2 . . . . 38 L QD2 . 18813 1
167 . 1 1 34 34 LEU HD22 H 1 0.400 0.05 . 2 . . . . 38 L QD2 . 18813 1
168 . 1 1 34 34 LEU HD23 H 1 0.400 0.05 . 2 . . . . 38 L QD2 . 18813 1
169 . 1 1 34 34 LEU C C 13 175.494 0.15 . 1 . . . . 38 L C . 18813 1
170 . 1 1 34 34 LEU CA C 13 53.572 0.15 . 1 . . . . 38 L CA . 18813 1
171 . 1 1 34 34 LEU CB C 13 43.627 0.15 . 1 . . . . 38 L CB . 18813 1
172 . 1 1 34 34 LEU CG C 13 26.970 0.15 . 1 . . . . 38 L CG . 18813 1
173 . 1 1 34 34 LEU CD1 C 13 25.379 0.15 . 2 . . . . 38 L CD1 . 18813 1
174 . 1 1 34 34 LEU CD2 C 13 23.015 0.15 . 2 . . . . 38 L CD2 . 18813 1
175 . 1 1 34 34 LEU N N 15 118.802 0.15 . 1 . . . . 38 L N . 18813 1
176 . 1 1 35 35 ALA H H 1 9.358 0.05 . 1 . . . . 39 A H . 18813 1
177 . 1 1 35 35 ALA HA H 1 5.418 0.05 . 1 . . . . 39 A HA . 18813 1
178 . 1 1 35 35 ALA HB1 H 1 1.469 0.05 . 1 . . . . 39 A QB . 18813 1
179 . 1 1 35 35 ALA HB2 H 1 1.469 0.05 . 1 . . . . 39 A QB . 18813 1
180 . 1 1 35 35 ALA HB3 H 1 1.469 0.05 . 1 . . . . 39 A QB . 18813 1
181 . 1 1 35 35 ALA C C 13 175.921 0.15 . 1 . . . . 39 A C . 18813 1
182 . 1 1 35 35 ALA CA C 13 49.446 0.15 . 1 . . . . 39 A CA . 18813 1
183 . 1 1 35 35 ALA CB C 13 21.877 0.15 . 1 . . . . 39 A CB . 18813 1
184 . 1 1 35 35 ALA N N 15 125.457 0.15 . 1 . . . . 39 A N . 18813 1
185 . 1 1 36 36 ARG H H 1 8.942 0.05 . 1 . . . . 40 R H . 18813 1
186 . 1 1 36 36 ARG HA H 1 4.863 0.05 . 1 . . . . 40 R HA . 18813 1
187 . 1 1 36 36 ARG HB2 H 1 1.668 0.05 . 2 . . . . 40 R HB2 . 18813 1
188 . 1 1 36 36 ARG HB3 H 1 1.905 0.05 . 2 . . . . 40 R HB3 . 18813 1
189 . 1 1 36 36 ARG HG2 H 1 1.451 0.05 . 2 . . . . 40 R HG2 . 18813 1
190 . 1 1 36 36 ARG HG3 H 1 1.794 0.05 . 2 . . . . 40 R HG3 . 18813 1
191 . 1 1 36 36 ARG HD2 H 1 3.177 0.05 . 2 . . . . 40 R HD2 . 18813 1
192 . 1 1 36 36 ARG C C 13 175.333 0.15 . 1 . . . . 40 R C . 18813 1
193 . 1 1 36 36 ARG CA C 13 55.978 0.15 . 1 . . . . 40 R CA . 18813 1
194 . 1 1 36 36 ARG CB C 13 30.418 0.15 . 1 . . . . 40 R CB . 18813 1
195 . 1 1 36 36 ARG CG C 13 27.152 0.15 . 1 . . . . 40 R CG . 18813 1
196 . 1 1 36 36 ARG CD C 13 43.050 0.15 . 1 . . . . 40 R CD . 18813 1
197 . 1 1 36 36 ARG N N 15 125.000 0.15 . 1 . . . . 40 R N . 18813 1
198 . 1 1 37 37 TRP H H 1 9.057 0.05 . 1 . . . . 41 W H . 18813 1
199 . 1 1 37 37 TRP HA H 1 5.161 0.05 . 1 . . . . 41 W HA . 18813 1
200 . 1 1 37 37 TRP HB2 H 1 3.004 0.05 . 2 . . . . 41 W HB2 . 18813 1
201 . 1 1 37 37 TRP HB3 H 1 3.995 0.05 . 2 . . . . 41 W HB3 . 18813 1
202 . 1 1 37 37 TRP HD1 H 1 6.988 0.05 . 4 . . . . 41 W HD1 . 18813 1
203 . 1 1 37 37 TRP HE3 H 1 7.385 0.05 . 4 . . . . 41 W HE3 . 18813 1
204 . 1 1 37 37 TRP CA C 13 54.474 0.15 . 1 . . . . 41 W CA . 18813 1
205 . 1 1 37 37 TRP CB C 13 31.281 0.15 . 1 . . . . 41 W CB . 18813 1
206 . 1 1 37 37 TRP N N 15 128.368 0.15 . 1 . . . . 41 W N . 18813 1
207 . 1 1 38 38 THR H H 1 6.019 0.05 . 1 . . . . 42 T H . 18813 1
208 . 1 1 38 38 THR HA H 1 3.752 0.05 . 1 . . . . 42 T HA . 18813 1
209 . 1 1 38 38 THR HB H 1 3.815 0.05 . 1 . . . . 42 T HB . 18813 1
210 . 1 1 38 38 THR HG21 H 1 0.631 0.05 . 1 . . . . 42 T QG2 . 18813 1
211 . 1 1 38 38 THR HG22 H 1 0.631 0.05 . 1 . . . . 42 T QG2 . 18813 1
212 . 1 1 38 38 THR HG23 H 1 0.631 0.05 . 1 . . . . 42 T QG2 . 18813 1
213 . 1 1 38 38 THR C C 13 174.329 0.15 . 1 . . . . 42 T C . 18813 1
214 . 1 1 38 38 THR CA C 13 63.780 0.15 . 1 . . . . 42 T CA . 18813 1
215 . 1 1 38 38 THR CB C 13 67.625 0.15 . 1 . . . . 42 T CB . 18813 1
216 . 1 1 38 38 THR CG2 C 13 21.673 0.15 . 1 . . . . 42 T CG2 . 18813 1
217 . 1 1 39 39 ASP H H 1 7.548 0.05 . 1 . . . . 43 D H . 18813 1
218 . 1 1 39 39 ASP HA H 1 4.475 0.05 . 1 . . . . 43 D HA . 18813 1
219 . 1 1 39 39 ASP HB2 H 1 2.693 0.05 . 2 . . . . 43 D HB2 . 18813 1
220 . 1 1 39 39 ASP HB3 H 1 3.060 0.05 . 2 . . . . 43 D HB3 . 18813 1
221 . 1 1 39 39 ASP C C 13 176.713 0.15 . 1 . . . . 43 D C . 18813 1
222 . 1 1 39 39 ASP CA C 13 53.198 0.15 . 1 . . . . 43 D CA . 18813 1
223 . 1 1 39 39 ASP CB C 13 40.236 0.15 . 1 . . . . 43 D CB . 18813 1
224 . 1 1 39 39 ASP N N 15 118.841 0.15 . 1 . . . . 43 D N . 18813 1
225 . 1 1 40 40 GLY H H 1 8.246 0.05 . 1 . . . . 44 G H . 18813 1
226 . 1 1 40 40 GLY HA2 H 1 3.637 0.05 . 2 . . . . 44 G HA2 . 18813 1
227 . 1 1 40 40 GLY HA3 H 1 4.228 0.05 . 2 . . . . 44 G HA3 . 18813 1
228 . 1 1 40 40 GLY C C 13 173.657 0.15 . 1 . . . . 44 G C . 18813 1
229 . 1 1 40 40 GLY CA C 13 45.331 0.15 . 1 . . . . 44 G CA . 18813 1
230 . 1 1 40 40 GLY N N 15 107.903 0.15 . 1 . . . . 44 G N . 18813 1
231 . 1 1 41 41 LEU H H 1 8.393 0.05 . 1 . . . . 45 L H . 18813 1
232 . 1 1 41 41 LEU HA H 1 4.600 0.05 . 1 . . . . 45 L HA . 18813 1
233 . 1 1 41 41 LEU HB2 H 1 1.089 0.05 . 2 . . . . 45 L HB2 . 18813 1
234 . 1 1 41 41 LEU HB3 H 1 2.039 0.05 . 2 . . . . 45 L HB3 . 18813 1
235 . 1 1 41 41 LEU HG H 1 1.368 0.05 . 1 . . . . 45 L HG . 18813 1
236 . 1 1 41 41 LEU HD11 H 1 0.822 0.05 . 2 . . . . 45 L QD1 . 18813 1
237 . 1 1 41 41 LEU HD12 H 1 0.822 0.05 . 2 . . . . 45 L QD1 . 18813 1
238 . 1 1 41 41 LEU HD13 H 1 0.822 0.05 . 2 . . . . 45 L QD1 . 18813 1
239 . 1 1 41 41 LEU HD21 H 1 0.770 0.05 . 2 . . . . 45 L QD2 . 18813 1
240 . 1 1 41 41 LEU HD22 H 1 0.770 0.05 . 2 . . . . 45 L QD2 . 18813 1
241 . 1 1 41 41 LEU HD23 H 1 0.770 0.05 . 2 . . . . 45 L QD2 . 18813 1
242 . 1 1 41 41 LEU C C 13 174.774 0.15 . 1 . . . . 45 L C . 18813 1
243 . 1 1 41 41 LEU CA C 13 53.487 0.15 . 1 . . . . 45 L CA . 18813 1
244 . 1 1 41 41 LEU CB C 13 41.730 0.15 . 1 . . . . 45 L CB . 18813 1
245 . 1 1 41 41 LEU CD1 C 13 25.510 0.15 . 2 . . . . 45 L CD1 . 18813 1
246 . 1 1 41 41 LEU CD2 C 13 22.451 0.15 . 2 . . . . 45 L CD2 . 18813 1
247 . 1 1 41 41 LEU N N 15 123.389 0.15 . 1 . . . . 45 L N . 18813 1
248 . 1 1 42 42 LEU H H 1 8.063 0.05 . 1 . . . . 46 L H . 18813 1
249 . 1 1 42 42 LEU HA H 1 5.044 0.05 . 1 . . . . 46 L HA . 18813 1
250 . 1 1 42 42 LEU HB2 H 1 1.112 0.05 . 2 . . . . 46 L HB2 . 18813 1
251 . 1 1 42 42 LEU HB3 H 1 1.817 0.05 . 2 . . . . 46 L HB3 . 18813 1
252 . 1 1 42 42 LEU HG H 1 1.627 0.05 . 1 . . . . 46 L HG . 18813 1
253 . 1 1 42 42 LEU HD11 H 1 0.685 0.05 . 2 . . . . 46 L QD1 . 18813 1
254 . 1 1 42 42 LEU HD12 H 1 0.685 0.05 . 2 . . . . 46 L QD1 . 18813 1
255 . 1 1 42 42 LEU HD13 H 1 0.685 0.05 . 2 . . . . 46 L QD1 . 18813 1
256 . 1 1 42 42 LEU HD21 H 1 0.846 0.05 . 2 . . . . 46 L QD2 . 18813 1
257 . 1 1 42 42 LEU HD22 H 1 0.846 0.05 . 2 . . . . 46 L QD2 . 18813 1
258 . 1 1 42 42 LEU HD23 H 1 0.846 0.05 . 2 . . . . 46 L QD2 . 18813 1
259 . 1 1 42 42 LEU C C 13 176.146 0.15 . 1 . . . . 46 L C . 18813 1
260 . 1 1 42 42 LEU CA C 13 53.555 0.15 . 1 . . . . 46 L CA . 18813 1
261 . 1 1 42 42 LEU CB C 13 44.512 0.15 . 1 . . . . 46 L CB . 18813 1
262 . 1 1 42 42 LEU CD1 C 13 23.483 0.15 . 2 . . . . 46 L CD1 . 18813 1
263 . 1 1 42 42 LEU CD2 C 13 25.602 0.15 . 2 . . . . 46 L CD2 . 18813 1
264 . 1 1 42 42 LEU N N 15 118.025 0.15 . 1 . . . . 46 L N . 18813 1
265 . 1 1 43 43 TYR H H 1 8.839 0.05 . 1 . . . . 47 Y H . 18813 1
266 . 1 1 43 43 TYR HA H 1 4.744 0.05 . 1 . . . . 47 Y HA . 18813 1
267 . 1 1 43 43 TYR HB2 H 1 2.557 0.05 . 2 . . . . 47 Y HB2 . 18813 1
268 . 1 1 43 43 TYR HB3 H 1 3.189 0.05 . 2 . . . . 47 Y HB3 . 18813 1
269 . 1 1 43 43 TYR HD1 H 1 6.903 0.05 . 4 . . . . 47 Y HD1 . 18813 1
270 . 1 1 43 43 TYR C C 13 174.820 0.15 . 1 . . . . 47 Y C . 18813 1
271 . 1 1 43 43 TYR CA C 13 57.106 0.15 . 1 . . . . 47 Y CA . 18813 1
272 . 1 1 43 43 TYR CB C 13 42.610 0.15 . 1 . . . . 47 Y CB . 18813 1
273 . 1 1 43 43 TYR CD1 C 13 133.729 0.15 . 4 . . . . 47 Y CD1 . 18813 1
274 . 1 1 43 43 TYR N N 15 118.063 0.15 . 1 . . . . 47 Y N . 18813 1
275 . 1 1 44 44 LEU H H 1 9.134 0.05 . 1 . . . . 48 L H . 18813 1
276 . 1 1 44 44 LEU HA H 1 4.900 0.05 . 1 . . . . 48 L HA . 18813 1
277 . 1 1 44 44 LEU HB2 H 1 1.383 0.05 . 2 . . . . 48 L HB2 . 18813 1
278 . 1 1 44 44 LEU HB3 H 1 1.753 0.05 . 2 . . . . 48 L HB3 . 18813 1
279 . 1 1 44 44 LEU HG H 1 1.535 0.05 . 1 . . . . 48 L HG . 18813 1
280 . 1 1 44 44 LEU HD11 H 1 0.831 0.05 . 2 . . . . 48 L QD1 . 18813 1
281 . 1 1 44 44 LEU HD12 H 1 0.831 0.05 . 2 . . . . 48 L QD1 . 18813 1
282 . 1 1 44 44 LEU HD13 H 1 0.831 0.05 . 2 . . . . 48 L QD1 . 18813 1
283 . 1 1 44 44 LEU C C 13 176.600 0.15 . 1 . . . . 48 L C . 18813 1
284 . 1 1 44 44 LEU CA C 13 55.248 0.15 . 1 . . . . 48 L CA . 18813 1
285 . 1 1 44 44 LEU CB C 13 43.206 0.15 . 1 . . . . 48 L CB . 18813 1
286 . 1 1 44 44 LEU CD1 C 13 24.175 0.15 . 2 . . . . 48 L CD1 . 18813 1
287 . 1 1 44 44 LEU N N 15 124.866 0.15 . 1 . . . . 48 L N . 18813 1
288 . 1 1 45 45 GLY H H 1 9.185 0.05 . 1 . . . . 49 G H . 18813 1
289 . 1 1 45 45 GLY HA2 H 1 2.989 0.05 . 2 . . . . 49 G HA2 . 18813 1
290 . 1 1 45 45 GLY HA3 H 1 4.638 0.05 . 2 . . . . 49 G HA3 . 18813 1
291 . 1 1 45 45 GLY C C 13 171.682 0.15 . 1 . . . . 49 G C . 18813 1
292 . 1 1 45 45 GLY CA C 13 45.113 0.15 . 1 . . . . 49 G CA . 18813 1
293 . 1 1 45 45 GLY N N 15 112.027 0.15 . 1 . . . . 49 G N . 18813 1
294 . 1 1 46 46 THR H H 1 8.542 0.05 . 1 . . . . 50 T H . 18813 1
295 . 1 1 46 46 THR HA H 1 5.238 0.05 . 1 . . . . 50 T HA . 18813 1
296 . 1 1 46 46 THR HB H 1 3.550 0.05 . 1 . . . . 50 T HB . 18813 1
297 . 1 1 46 46 THR HG21 H 1 1.018 0.05 . 1 . . . . 50 T QG2 . 18813 1
298 . 1 1 46 46 THR HG22 H 1 1.018 0.05 . 1 . . . . 50 T QG2 . 18813 1
299 . 1 1 46 46 THR HG23 H 1 1.018 0.05 . 1 . . . . 50 T QG2 . 18813 1
300 . 1 1 46 46 THR C C 13 174.815 0.15 . 1 . . . . 50 T C . 18813 1
301 . 1 1 46 46 THR CA C 13 60.547 0.15 . 1 . . . . 50 T CA . 18813 1
302 . 1 1 46 46 THR CB C 13 71.981 0.15 . 1 . . . . 50 T CB . 18813 1
303 . 1 1 46 46 THR CG2 C 13 21.363 0.15 . 1 . . . . 50 T CG2 . 18813 1
304 . 1 1 46 46 THR N N 15 115.417 0.15 . 1 . . . . 50 T N . 18813 1
305 . 1 1 47 47 ILE H H 1 8.718 0.05 . 1 . . . . 51 I H . 18813 1
306 . 1 1 47 47 ILE HA H 1 3.809 0.05 . 1 . . . . 51 I HA . 18813 1
307 . 1 1 47 47 ILE HB H 1 2.140 0.05 . 1 . . . . 51 I HB . 18813 1
308 . 1 1 47 47 ILE HG12 H 1 1.625 0.05 . 2 . . . . 51 I HG12 . 18813 1
309 . 1 1 47 47 ILE HG13 H 1 0.781 0.05 . 2 . . . . 51 I HG13 . 18813 1
310 . 1 1 47 47 ILE HG21 H 1 0.630 0.05 . 1 . . . . 51 I QG2 . 18813 1
311 . 1 1 47 47 ILE HG22 H 1 0.630 0.05 . 1 . . . . 51 I QG2 . 18813 1
312 . 1 1 47 47 ILE HG23 H 1 0.630 0.05 . 1 . . . . 51 I QG2 . 18813 1
313 . 1 1 47 47 ILE HD11 H 1 0.773 0.05 . 1 . . . . 51 I QD1 . 18813 1
314 . 1 1 47 47 ILE HD12 H 1 0.773 0.05 . 1 . . . . 51 I QD1 . 18813 1
315 . 1 1 47 47 ILE HD13 H 1 0.773 0.05 . 1 . . . . 51 I QD1 . 18813 1
316 . 1 1 47 47 ILE C C 13 176.312 0.15 . 1 . . . . 51 I C . 18813 1
317 . 1 1 47 47 ILE CA C 13 63.181 0.15 . 1 . . . . 51 I CA . 18813 1
318 . 1 1 47 47 ILE CB C 13 37.011 0.15 . 1 . . . . 51 I CB . 18813 1
319 . 1 1 47 47 ILE CG1 C 13 28.451 0.15 . 1 . . . . 51 I CG1 . 18813 1
320 . 1 1 47 47 ILE CG2 C 13 19.336 0.15 . 1 . . . . 51 I CG2 . 18813 1
321 . 1 1 47 47 ILE CD1 C 13 14.722 0.15 . 1 . . . . 51 I CD1 . 18813 1
322 . 1 1 47 47 ILE N N 15 125.736 0.15 . 1 . . . . 51 I N . 18813 1
323 . 1 1 48 48 LYS H H 1 9.406 0.05 . 1 . . . . 52 K H . 18813 1
324 . 1 1 48 48 LYS HA H 1 4.590 0.05 . 1 . . . . 52 K HA . 18813 1
325 . 1 1 48 48 LYS HB2 H 1 1.440 0.05 . 2 . . . . 52 K HB2 . 18813 1
326 . 1 1 48 48 LYS HB3 H 1 1.724 0.05 . 2 . . . . 52 K HB3 . 18813 1
327 . 1 1 48 48 LYS HG2 H 1 1.411 0.05 . 2 . . . . 52 K HG2 . 18813 1
328 . 1 1 48 48 LYS C C 13 176.199 0.15 . 1 . . . . 52 K C . 18813 1
329 . 1 1 48 48 LYS CA C 13 54.585 0.15 . 1 . . . . 52 K CA . 18813 1
330 . 1 1 48 48 LYS CB C 13 32.357 0.15 . 1 . . . . 52 K CB . 18813 1
331 . 1 1 48 48 LYS CG C 13 23.758 0.15 . 1 . . . . 52 K CG . 18813 1
332 . 1 1 48 48 LYS N N 15 128.114 0.15 . 1 . . . . 52 K N . 18813 1
333 . 1 1 49 49 LYS H H 1 7.380 0.05 . 1 . . . . 53 K H . 18813 1
334 . 1 1 49 49 LYS HA H 1 4.646 0.05 . 1 . . . . 53 K HA . 18813 1
335 . 1 1 49 49 LYS HB2 H 1 1.637 0.05 . 2 . . . . 53 K HB2 . 18813 1
336 . 1 1 49 49 LYS HG2 H 1 1.287 0.05 . 2 . . . . 53 K HG2 . 18813 1
337 . 1 1 49 49 LYS HD2 H 1 1.677 0.05 . 2 . . . . 53 K HD2 . 18813 1
338 . 1 1 49 49 LYS HE2 H 1 2.928 0.05 . 2 . . . . 53 K HE2 . 18813 1
339 . 1 1 49 49 LYS C C 13 174.789 0.15 . 1 . . . . 53 K C . 18813 1
340 . 1 1 49 49 LYS CA C 13 55.587 0.15 . 1 . . . . 53 K CA . 18813 1
341 . 1 1 49 49 LYS CB C 13 37.016 0.15 . 1 . . . . 53 K CB . 18813 1
342 . 1 1 49 49 LYS CG C 13 24.853 0.15 . 1 . . . . 53 K CG . 18813 1
343 . 1 1 49 49 LYS CD C 13 28.772 0.15 . 1 . . . . 53 K CD . 18813 1
344 . 1 1 49 49 LYS CE C 13 42.152 0.15 . 1 . . . . 53 K CE . 18813 1
345 . 1 1 49 49 LYS N N 15 116.526 0.15 . 1 . . . . 53 K N . 18813 1
346 . 1 1 50 50 VAL H H 1 9.547 0.05 . 1 . . . . 54 V H . 18813 1
347 . 1 1 50 50 VAL HA H 1 4.501 0.05 . 1 . . . . 54 V HA . 18813 1
348 . 1 1 50 50 VAL HB H 1 2.227 0.05 . 1 . . . . 54 V HB . 18813 1
349 . 1 1 50 50 VAL HG11 H 1 1.174 0.05 . 2 . . . . 54 V QG1 . 18813 1
350 . 1 1 50 50 VAL HG12 H 1 1.174 0.05 . 2 . . . . 54 V QG1 . 18813 1
351 . 1 1 50 50 VAL HG13 H 1 1.174 0.05 . 2 . . . . 54 V QG1 . 18813 1
352 . 1 1 50 50 VAL HG21 H 1 0.841 0.05 . 2 . . . . 54 V QG2 . 18813 1
353 . 1 1 50 50 VAL HG22 H 1 0.841 0.05 . 2 . . . . 54 V QG2 . 18813 1
354 . 1 1 50 50 VAL HG23 H 1 0.841 0.05 . 2 . . . . 54 V QG2 . 18813 1
355 . 1 1 50 50 VAL C C 13 174.378 0.15 . 1 . . . . 54 V C . 18813 1
356 . 1 1 50 50 VAL CA C 13 62.428 0.15 . 1 . . . . 54 V CA . 18813 1
357 . 1 1 50 50 VAL CB C 13 34.101 0.15 . 1 . . . . 54 V CB . 18813 1
358 . 1 1 50 50 VAL CG1 C 13 22.336 0.15 . 2 . . . . 54 V CG1 . 18813 1
359 . 1 1 50 50 VAL CG2 C 13 21.498 0.15 . 2 . . . . 54 V CG2 . 18813 1
360 . 1 1 50 50 VAL N N 15 126.337 0.15 . 1 . . . . 54 V N . 18813 1
361 . 1 1 51 51 ASP H H 1 8.752 0.05 . 1 . . . . 55 D H . 18813 1
362 . 1 1 51 51 ASP HA H 1 5.133 0.05 . 1 . . . . 55 D HA . 18813 1
363 . 1 1 51 51 ASP HB2 H 1 2.364 0.05 . 2 . . . . 55 D HB2 . 18813 1
364 . 1 1 51 51 ASP HB3 H 1 3.099 0.05 . 2 . . . . 55 D HB3 . 18813 1
365 . 1 1 51 51 ASP C C 13 176.760 0.15 . 1 . . . . 55 D C . 18813 1
366 . 1 1 51 51 ASP CA C 13 52.720 0.15 . 1 . . . . 55 D CA . 18813 1
367 . 1 1 51 51 ASP CB C 13 41.776 0.15 . 1 . . . . 55 D CB . 18813 1
368 . 1 1 51 51 ASP N N 15 127.468 0.15 . 1 . . . . 55 D N . 18813 1
369 . 1 1 52 52 SER H H 1 9.100 0.05 . 1 . . . . 56 S H . 18813 1
370 . 1 1 52 52 SER HA H 1 4.462 0.05 . 1 . . . . 56 S HA . 18813 1
371 . 1 1 52 52 SER HB2 H 1 4.133 0.05 . 2 . . . . 56 S HB2 . 18813 1
372 . 1 1 52 52 SER C C 13 174.823 0.15 . 1 . . . . 56 S C . 18813 1
373 . 1 1 52 52 SER CA C 13 60.561 0.15 . 1 . . . . 56 S CA . 18813 1
374 . 1 1 52 52 SER CB C 13 63.165 0.15 . 1 . . . . 56 S CB . 18813 1
375 . 1 1 52 52 SER N N 15 120.605 0.15 . 1 . . . . 56 S N . 18813 1
376 . 1 1 53 53 ALA H H 1 8.276 0.05 . 1 . . . . 57 A H . 18813 1
377 . 1 1 53 53 ALA HA H 1 4.247 0.05 . 1 . . . . 57 A HA . 18813 1
378 . 1 1 53 53 ALA HB1 H 1 1.476 0.05 . 1 . . . . 57 A QB . 18813 1
379 . 1 1 53 53 ALA HB2 H 1 1.476 0.05 . 1 . . . . 57 A QB . 18813 1
380 . 1 1 53 53 ALA HB3 H 1 1.476 0.05 . 1 . . . . 57 A QB . 18813 1
381 . 1 1 53 53 ALA C C 13 179.458 0.15 . 1 . . . . 57 A C . 18813 1
382 . 1 1 53 53 ALA CA C 13 54.422 0.15 . 1 . . . . 57 A CA . 18813 1
383 . 1 1 53 53 ALA CB C 13 18.483 0.15 . 1 . . . . 57 A CB . 18813 1
384 . 1 1 53 53 ALA N N 15 124.749 0.15 . 1 . . . . 57 A N . 18813 1
385 . 1 1 54 54 ARG H H 1 7.391 0.05 . 1 . . . . 58 R H . 18813 1
386 . 1 1 54 54 ARG HA H 1 4.109 0.05 . 1 . . . . 58 R HA . 18813 1
387 . 1 1 54 54 ARG HB2 H 1 1.296 0.05 . 2 . . . . 58 R HB2 . 18813 1
388 . 1 1 54 54 ARG HB3 H 1 1.756 0.05 . 2 . . . . 58 R HB3 . 18813 1
389 . 1 1 54 54 ARG HD2 H 1 3.069 0.05 . 2 . . . . 58 R HD2 . 18813 1
390 . 1 1 54 54 ARG C C 13 174.663 0.15 . 1 . . . . 58 R C . 18813 1
391 . 1 1 54 54 ARG CA C 13 55.423 0.15 . 1 . . . . 58 R CA . 18813 1
392 . 1 1 54 54 ARG CB C 13 31.840 0.15 . 1 . . . . 58 R CB . 18813 1
393 . 1 1 54 54 ARG CD C 13 43.507 0.15 . 1 . . . . 58 R CD . 18813 1
394 . 1 1 54 54 ARG N N 15 114.760 0.15 . 1 . . . . 58 R N . 18813 1
395 . 1 1 55 55 GLU H H 1 7.189 0.05 . 1 . . . . 59 E H . 18813 1
396 . 1 1 55 55 GLU HA H 1 1.571 0.05 . 1 . . . . 59 E HA . 18813 1
397 . 1 1 55 55 GLU HB2 H 1 1.792 0.05 . 2 . . . . 59 E HB2 . 18813 1
398 . 1 1 55 55 GLU HB3 H 1 1.047 0.05 . 2 . . . . 59 E HB3 . 18813 1
399 . 1 1 55 55 GLU HG2 H 1 1.597 0.05 . 2 . . . . 59 E HG2 . 18813 1
400 . 1 1 55 55 GLU HG3 H 1 0.788 0.05 . 2 . . . . 59 E HG3 . 18813 1
401 . 1 1 55 55 GLU C C 13 175.062 0.15 . 1 . . . . 59 E C . 18813 1
402 . 1 1 55 55 GLU CA C 13 56.705 0.15 . 1 . . . . 59 E CA . 18813 1
403 . 1 1 55 55 GLU CB C 13 25.496 0.15 . 1 . . . . 59 E CB . 18813 1
404 . 1 1 55 55 GLU CG C 13 36.434 0.15 . 1 . . . . 59 E CG . 18813 1
405 . 1 1 55 55 GLU N N 15 115.955 0.15 . 1 . . . . 59 E N . 18813 1
406 . 1 1 56 56 VAL H H 1 7.453 0.05 . 1 . . . . 60 V H . 18813 1
407 . 1 1 56 56 VAL HA H 1 5.117 0.05 . 1 . . . . 60 V HA . 18813 1
408 . 1 1 56 56 VAL HB H 1 1.861 0.05 . 1 . . . . 60 V HB . 18813 1
409 . 1 1 56 56 VAL HG11 H 1 0.817 0.05 . 2 . . . . 60 V QG1 . 18813 1
410 . 1 1 56 56 VAL HG12 H 1 0.817 0.05 . 2 . . . . 60 V QG1 . 18813 1
411 . 1 1 56 56 VAL HG13 H 1 0.817 0.05 . 2 . . . . 60 V QG1 . 18813 1
412 . 1 1 56 56 VAL C C 13 175.746 0.15 . 1 . . . . 60 V C . 18813 1
413 . 1 1 56 56 VAL CA C 13 59.254 0.15 . 1 . . . . 60 V CA . 18813 1
414 . 1 1 56 56 VAL CB C 13 37.042 0.15 . 1 . . . . 60 V CB . 18813 1
415 . 1 1 56 56 VAL CG1 C 13 21.592 0.15 . 2 . . . . 60 V CG1 . 18813 1
416 . 1 1 56 56 VAL N N 15 111.441 0.15 . 1 . . . . 60 V N . 18813 1
417 . 1 1 57 57 CYS H H 1 9.391 0.05 . 1 . . . . 61 C H . 18813 1
418 . 1 1 57 57 CYS HA H 1 5.396 0.05 . 1 . . . . 61 C HA . 18813 1
419 . 1 1 57 57 CYS HB2 H 1 2.507 0.05 . 2 . . . . 61 C HB2 . 18813 1
420 . 1 1 57 57 CYS HB3 H 1 2.962 0.05 . 2 . . . . 61 C HB3 . 18813 1
421 . 1 1 57 57 CYS C C 13 172.997 0.15 . 1 . . . . 61 C C . 18813 1
422 . 1 1 57 57 CYS CA C 13 57.111 0.15 . 1 . . . . 61 C CA . 18813 1
423 . 1 1 57 57 CYS CB C 13 32.631 0.15 . 1 . . . . 61 C CB . 18813 1
424 . 1 1 57 57 CYS N N 15 118.835 0.15 . 1 . . . . 61 C N . 18813 1
425 . 1 1 58 58 LEU H H 1 8.674 0.05 . 1 . . . . 62 L H . 18813 1
426 . 1 1 58 58 LEU HA H 1 4.764 0.05 . 1 . . . . 62 L HA . 18813 1
427 . 1 1 58 58 LEU HB2 H 1 1.275 0.05 . 2 . . . . 62 L HB2 . 18813 1
428 . 1 1 58 58 LEU HB3 H 1 1.745 0.05 . 2 . . . . 62 L HB3 . 18813 1
429 . 1 1 58 58 LEU HD11 H 1 0.742 0.05 . 2 . . . . 62 L QD1 . 18813 1
430 . 1 1 58 58 LEU HD12 H 1 0.742 0.05 . 2 . . . . 62 L QD1 . 18813 1
431 . 1 1 58 58 LEU HD13 H 1 0.742 0.05 . 2 . . . . 62 L QD1 . 18813 1
432 . 1 1 58 58 LEU CA C 13 54.947 0.15 . 1 . . . . 62 L CA . 18813 1
433 . 1 1 58 58 LEU CB C 13 43.781 0.15 . 1 . . . . 62 L CB . 18813 1
434 . 1 1 58 58 LEU CD1 C 13 22.892 0.15 . 2 . . . . 62 L CD1 . 18813 1
435 . 1 1 58 58 LEU N N 15 125.001 0.15 . 1 . . . . 62 L N . 18813 1
436 . 1 1 59 59 VAL H H 1 9.162 0.05 . 1 . . . . 63 V H . 18813 1
437 . 1 1 59 59 VAL HA H 1 4.329 0.05 . 1 . . . . 63 V HA . 18813 1
438 . 1 1 59 59 VAL HB H 1 1.708 0.05 . 1 . . . . 63 V HB . 18813 1
439 . 1 1 59 59 VAL HG11 H 1 0.637 0.05 . 2 . . . . 63 V QG1 . 18813 1
440 . 1 1 59 59 VAL HG12 H 1 0.637 0.05 . 2 . . . . 63 V QG1 . 18813 1
441 . 1 1 59 59 VAL HG13 H 1 0.637 0.05 . 2 . . . . 63 V QG1 . 18813 1
442 . 1 1 59 59 VAL HG21 H 1 -0.178 0.05 . 2 . . . . 63 V QG2 . 18813 1
443 . 1 1 59 59 VAL HG22 H 1 -0.178 0.05 . 2 . . . . 63 V QG2 . 18813 1
444 . 1 1 59 59 VAL HG23 H 1 -0.178 0.05 . 2 . . . . 63 V QG2 . 18813 1
445 . 1 1 59 59 VAL C C 13 172.896 0.15 . 1 . . . . 63 V C . 18813 1
446 . 1 1 59 59 VAL CA C 13 61.228 0.15 . 1 . . . . 63 V CA . 18813 1
447 . 1 1 59 59 VAL CB C 13 34.245 0.15 . 1 . . . . 63 V CB . 18813 1
448 . 1 1 59 59 VAL CG1 C 13 22.624 0.15 . 2 . . . . 63 V CG1 . 18813 1
449 . 1 1 59 59 VAL CG2 C 13 21.143 0.15 . 2 . . . . 63 V CG2 . 18813 1
450 . 1 1 59 59 VAL N N 15 130.948 0.15 . 1 . . . . 63 V N . 18813 1
451 . 1 1 60 60 GLN H H 1 8.713 0.05 . 1 . . . . 64 Q H . 18813 1
452 . 1 1 60 60 GLN HA H 1 5.388 0.05 . 1 . . . . 64 Q HA . 18813 1
453 . 1 1 60 60 GLN HB2 H 1 1.727 0.05 . 2 . . . . 64 Q HB2 . 18813 1
454 . 1 1 60 60 GLN HB3 H 1 1.907 0.05 . 2 . . . . 64 Q HB3 . 18813 1
455 . 1 1 60 60 GLN HG2 H 1 2.102 0.05 . 2 . . . . 64 Q HG2 . 18813 1
456 . 1 1 60 60 GLN HG3 H 1 2.512 0.05 . 2 . . . . 64 Q HG3 . 18813 1
457 . 1 1 60 60 GLN HE21 H 1 7.660 0.05 . 2 . . . . 64 Q HE21 . 18813 1
458 . 1 1 60 60 GLN HE22 H 1 6.798 0.05 . 2 . . . . 64 Q HE22 . 18813 1
459 . 1 1 60 60 GLN C C 13 176.083 0.15 . 1 . . . . 64 Q C . 18813 1
460 . 1 1 60 60 GLN CA C 13 53.442 0.15 . 1 . . . . 64 Q CA . 18813 1
461 . 1 1 60 60 GLN CB C 13 31.788 0.15 . 1 . . . . 64 Q CB . 18813 1
462 . 1 1 60 60 GLN CG C 13 33.868 0.15 . 1 . . . . 64 Q CG . 18813 1
463 . 1 1 60 60 GLN N N 15 125.317 0.15 . 1 . . . . 64 Q N . 18813 1
464 . 1 1 61 61 PHE H H 1 9.101 0.05 . 1 . . . . 65 F H . 18813 1
465 . 1 1 61 61 PHE HA H 1 4.986 0.05 . 1 . . . . 65 F HA . 18813 1
466 . 1 1 61 61 PHE HB2 H 1 2.939 0.05 . 2 . . . . 65 F HB2 . 18813 1
467 . 1 1 61 61 PHE HB3 H 1 3.528 0.05 . 2 . . . . 65 F HB3 . 18813 1
468 . 1 1 61 61 PHE HD1 H 1 7.383 0.05 . 4 . . . . 65 F HD1 . 18813 1
469 . 1 1 61 61 PHE HE1 H 1 7.170 0.05 . 4 . . . . 65 F HE1 . 18813 1
470 . 1 1 61 61 PHE HZ H 1 6.862 0.05 . 4 . . . . 65 F HZ . 18813 1
471 . 1 1 61 61 PHE C C 13 177.435 0.15 . 1 . . . . 65 F C . 18813 1
472 . 1 1 61 61 PHE CA C 13 58.748 0.15 . 1 . . . . 65 F CA . 18813 1
473 . 1 1 61 61 PHE CB C 13 39.745 0.15 . 1 . . . . 65 F CB . 18813 1
474 . 1 1 61 61 PHE CD1 C 13 132.850 0.15 . 4 . . . . 65 F CD1 . 18813 1
475 . 1 1 61 61 PHE CE1 C 13 131.015 0.15 . 4 . . . . 65 F CE1 . 18813 1
476 . 1 1 61 61 PHE CZ C 13 128.198 0.15 . 4 . . . . 65 F CZ . 18813 1
477 . 1 1 61 61 PHE N N 15 126.899 0.15 . 1 . . . . 65 F N . 18813 1
478 . 1 1 62 62 GLU H H 1 9.778 0.05 . 1 . . . . 66 E H . 18813 1
479 . 1 1 62 62 GLU HA H 1 4.145 0.05 . 1 . . . . 66 E HA . 18813 1
480 . 1 1 62 62 GLU HB2 H 1 2.169 0.05 . 2 . . . . 66 E HB2 . 18813 1
481 . 1 1 62 62 GLU HB3 H 1 2.213 0.05 . 2 . . . . 66 E HB3 . 18813 1
482 . 1 1 62 62 GLU HG2 H 1 2.312 0.05 . 2 . . . . 66 E HG2 . 18813 1
483 . 1 1 62 62 GLU HG3 H 1 2.575 0.05 . 2 . . . . 66 E HG3 . 18813 1
484 . 1 1 62 62 GLU C C 13 175.818 0.15 . 1 . . . . 66 E C . 18813 1
485 . 1 1 62 62 GLU CA C 13 59.901 0.15 . 1 . . . . 66 E CA . 18813 1
486 . 1 1 62 62 GLU CB C 13 31.003 0.15 . 1 . . . . 66 E CB . 18813 1
487 . 1 1 62 62 GLU CG C 13 37.954 0.15 . 1 . . . . 66 E CG . 18813 1
488 . 1 1 62 62 GLU N N 15 119.848 0.15 . 1 . . . . 66 E N . 18813 1
489 . 1 1 63 63 ASP H H 1 7.934 0.05 . 1 . . . . 67 D H . 18813 1
490 . 1 1 63 63 ASP HA H 1 4.492 0.05 . 1 . . . . 67 D HA . 18813 1
491 . 1 1 63 63 ASP HB2 H 1 2.302 0.05 . 2 . . . . 67 D HB2 . 18813 1
492 . 1 1 63 63 ASP HB3 H 1 3.076 0.05 . 2 . . . . 67 D HB3 . 18813 1
493 . 1 1 63 63 ASP C C 13 176.079 0.15 . 1 . . . . 67 D C . 18813 1
494 . 1 1 63 63 ASP CA C 13 52.954 0.15 . 1 . . . . 67 D CA . 18813 1
495 . 1 1 63 63 ASP CB C 13 40.342 0.15 . 1 . . . . 67 D CB . 18813 1
496 . 1 1 63 63 ASP N N 15 115.699 0.15 . 1 . . . . 67 D N . 18813 1
497 . 1 1 64 64 ASP H H 1 8.236 0.05 . 1 . . . . 68 D H . 18813 1
498 . 1 1 64 64 ASP HA H 1 4.250 0.05 . 1 . . . . 68 D HA . 18813 1
499 . 1 1 64 64 ASP HB2 H 1 2.866 0.05 . 2 . . . . 68 D HB2 . 18813 1
500 . 1 1 64 64 ASP HB3 H 1 3.144 0.05 . 2 . . . . 68 D HB3 . 18813 1
501 . 1 1 64 64 ASP C C 13 175.086 0.15 . 1 . . . . 68 D C . 18813 1
502 . 1 1 64 64 ASP CA C 13 57.122 0.15 . 1 . . . . 68 D CA . 18813 1
503 . 1 1 64 64 ASP CB C 13 38.728 0.15 . 1 . . . . 68 D CB . 18813 1
504 . 1 1 64 64 ASP N N 15 113.566 0.15 . 1 . . . . 68 D N . 18813 1
505 . 1 1 65 65 SER H H 1 8.067 0.05 . 1 . . . . 69 S H . 18813 1
506 . 1 1 65 65 SER HA H 1 4.142 0.05 . 1 . . . . 69 S HA . 18813 1
507 . 1 1 65 65 SER HB2 H 1 3.846 0.05 . 2 . . . . 69 S HB2 . 18813 1
508 . 1 1 65 65 SER C C 13 173.471 0.15 . 1 . . . . 69 S C . 18813 1
509 . 1 1 65 65 SER CA C 13 59.606 0.15 . 1 . . . . 69 S CA . 18813 1
510 . 1 1 65 65 SER CB C 13 63.982 0.15 . 1 . . . . 69 S CB . 18813 1
511 . 1 1 65 65 SER N N 15 117.657 0.15 . 1 . . . . 69 S N . 18813 1
512 . 1 1 66 66 GLN H H 1 8.014 0.05 . 1 . . . . 70 Q H . 18813 1
513 . 1 1 66 66 GLN HA H 1 5.797 0.05 . 1 . . . . 70 Q HA . 18813 1
514 . 1 1 66 66 GLN HB2 H 1 1.638 0.05 . 2 . . . . 70 Q HB2 . 18813 1
515 . 1 1 66 66 GLN HB3 H 1 1.727 0.05 . 2 . . . . 70 Q HB3 . 18813 1
516 . 1 1 66 66 GLN HG2 H 1 2.363 0.05 . 2 . . . . 70 Q HG2 . 18813 1
517 . 1 1 66 66 GLN HG3 H 1 1.847 0.05 . 2 . . . . 70 Q HG3 . 18813 1
518 . 1 1 66 66 GLN HE21 H 1 6.624 0.05 . 2 . . . . 70 Q HE21 . 18813 1
519 . 1 1 66 66 GLN HE22 H 1 7.509 0.05 . 2 . . . . 70 Q HE22 . 18813 1
520 . 1 1 66 66 GLN C C 13 175.146 0.15 . 1 . . . . 70 Q C . 18813 1
521 . 1 1 66 66 GLN CA C 13 54.174 0.15 . 1 . . . . 70 Q CA . 18813 1
522 . 1 1 66 66 GLN CB C 13 31.854 0.15 . 1 . . . . 70 Q CB . 18813 1
523 . 1 1 66 66 GLN CG C 13 33.830 0.15 . 1 . . . . 70 Q CG . 18813 1
524 . 1 1 66 66 GLN N N 15 117.461 0.15 . 1 . . . . 70 Q N . 18813 1
525 . 1 1 67 67 PHE H H 1 8.734 0.05 . 1 . . . . 71 F H . 18813 1
526 . 1 1 67 67 PHE HA H 1 4.933 0.05 . 1 . . . . 71 F HA . 18813 1
527 . 1 1 67 67 PHE HB2 H 1 2.803 0.05 . 2 . . . . 71 F HB2 . 18813 1
528 . 1 1 67 67 PHE HB3 H 1 3.571 0.05 . 2 . . . . 71 F HB3 . 18813 1
529 . 1 1 67 67 PHE HD1 H 1 7.349 0.05 . 4 . . . . 71 F HD1 . 18813 1
530 . 1 1 67 67 PHE HE1 H 1 7.170 0.05 . 4 . . . . 71 F HE1 . 18813 1
531 . 1 1 67 67 PHE CA C 13 56.906 0.15 . 1 . . . . 71 F CA . 18813 1
532 . 1 1 67 67 PHE CB C 13 45.107 0.15 . 1 . . . . 71 F CB . 18813 1
533 . 1 1 67 67 PHE CD1 C 13 132.259 0.15 . 4 . . . . 71 F CD1 . 18813 1
534 . 1 1 67 67 PHE N N 15 118.756 0.15 . 1 . . . . 71 F N . 18813 1
535 . 1 1 68 68 LEU H H 1 8.917 0.05 . 1 . . . . 72 L H . 18813 1
536 . 1 1 68 68 LEU HA H 1 5.089 0.05 . 1 . . . . 72 L HA . 18813 1
537 . 1 1 68 68 LEU HB2 H 1 1.239 0.05 . 2 . . . . 72 L HB2 . 18813 1
538 . 1 1 68 68 LEU HB3 H 1 1.879 0.05 . 2 . . . . 72 L HB3 . 18813 1
539 . 1 1 68 68 LEU HG H 1 1.705 0.05 . 1 . . . . 72 L HG . 18813 1
540 . 1 1 68 68 LEU HD11 H 1 0.796 0.05 . 2 . . . . 72 L QD1 . 18813 1
541 . 1 1 68 68 LEU HD12 H 1 0.796 0.05 . 2 . . . . 72 L QD1 . 18813 1
542 . 1 1 68 68 LEU HD13 H 1 0.796 0.05 . 2 . . . . 72 L QD1 . 18813 1
543 . 1 1 68 68 LEU HD21 H 1 0.945 0.05 . 2 . . . . 72 L QD2 . 18813 1
544 . 1 1 68 68 LEU HD22 H 1 0.945 0.05 . 2 . . . . 72 L QD2 . 18813 1
545 . 1 1 68 68 LEU HD23 H 1 0.945 0.05 . 2 . . . . 72 L QD2 . 18813 1
546 . 1 1 68 68 LEU C C 13 176.899 0.15 . 1 . . . . 72 L C . 18813 1
547 . 1 1 68 68 LEU CA C 13 54.762 0.15 . 1 . . . . 72 L CA . 18813 1
548 . 1 1 68 68 LEU CB C 13 42.246 0.15 . 1 . . . . 72 L CB . 18813 1
549 . 1 1 68 68 LEU CD2 C 13 23.009 0.15 . 2 . . . . 72 L CD2 . 18813 1
550 . 1 1 68 68 LEU N N 15 123.439 0.15 . 1 . . . . 72 L N . 18813 1
551 . 1 1 69 69 VAL H H 1 9.314 0.05 . 1 . . . . 73 V H . 18813 1
552 . 1 1 69 69 VAL HA H 1 4.437 0.05 . 1 . . . . 73 V HA . 18813 1
553 . 1 1 69 69 VAL HB H 1 1.911 0.05 . 1 . . . . 73 V HB . 18813 1
554 . 1 1 69 69 VAL HG11 H 1 1.343 0.05 . 2 . . . . 73 V QG1 . 18813 1
555 . 1 1 69 69 VAL HG12 H 1 1.343 0.05 . 2 . . . . 73 V QG1 . 18813 1
556 . 1 1 69 69 VAL HG13 H 1 1.343 0.05 . 2 . . . . 73 V QG1 . 18813 1
557 . 1 1 69 69 VAL HG21 H 1 1.156 0.05 . 2 . . . . 73 V QG2 . 18813 1
558 . 1 1 69 69 VAL HG22 H 1 1.156 0.05 . 2 . . . . 73 V QG2 . 18813 1
559 . 1 1 69 69 VAL HG23 H 1 1.156 0.05 . 2 . . . . 73 V QG2 . 18813 1
560 . 1 1 69 69 VAL C C 13 175.342 0.15 . 1 . . . . 73 V C . 18813 1
561 . 1 1 69 69 VAL CA C 13 61.171 0.15 . 1 . . . . 73 V CA . 18813 1
562 . 1 1 69 69 VAL CB C 13 36.232 0.15 . 1 . . . . 73 V CB . 18813 1
563 . 1 1 69 69 VAL CG1 C 13 22.707 0.15 . 2 . . . . 73 V CG1 . 18813 1
564 . 1 1 69 69 VAL CG2 C 13 21.465 0.15 . 2 . . . . 73 V CG2 . 18813 1
565 . 1 1 69 69 VAL N N 15 125.389 0.15 . 1 . . . . 73 V N . 18813 1
566 . 1 1 70 70 LEU H H 1 9.288 0.05 . 1 . . . . 74 L H . 18813 1
567 . 1 1 70 70 LEU HA H 1 4.645 0.05 . 1 . . . . 74 L HA . 18813 1
568 . 1 1 70 70 LEU HB2 H 1 1.900 0.05 . 2 . . . . 74 L HB2 . 18813 1
569 . 1 1 70 70 LEU HG H 1 1.950 0.05 . 1 . . . . 74 L HG . 18813 1
570 . 1 1 70 70 LEU HD11 H 1 0.987 0.05 . 2 . . . . 74 L QD1 . 18813 1
571 . 1 1 70 70 LEU HD12 H 1 0.987 0.05 . 2 . . . . 74 L QD1 . 18813 1
572 . 1 1 70 70 LEU HD13 H 1 0.987 0.05 . 2 . . . . 74 L QD1 . 18813 1
573 . 1 1 70 70 LEU C C 13 179.119 0.15 . 1 . . . . 74 L C . 18813 1
574 . 1 1 70 70 LEU CA C 13 56.138 0.15 . 1 . . . . 74 L CA . 18813 1
575 . 1 1 70 70 LEU CB C 13 42.169 0.15 . 1 . . . . 74 L CB . 18813 1
576 . 1 1 70 70 LEU CG C 13 27.594 0.15 . 1 . . . . 74 L CG . 18813 1
577 . 1 1 70 70 LEU CD1 C 13 25.810 0.15 . 2 . . . . 74 L CD1 . 18813 1
578 . 1 1 70 70 LEU N N 15 127.929 0.15 . 1 . . . . 74 L N . 18813 1
579 . 1 1 71 71 TRP H H 1 8.634 0.05 . 1 . . . . 75 W H . 18813 1
580 . 1 1 71 71 TRP HA H 1 4.291 0.05 . 1 . . . . 75 W HA . 18813 1
581 . 1 1 71 71 TRP HB2 H 1 3.197 0.05 . 2 . . . . 75 W HB2 . 18813 1
582 . 1 1 71 71 TRP HB3 H 1 3.303 0.05 . 2 . . . . 75 W HB3 . 18813 1
583 . 1 1 71 71 TRP HD1 H 1 6.702 0.05 . 4 . . . . 75 W HD1 . 18813 1
584 . 1 1 71 71 TRP HE1 H 1 8.205 0.05 . 1 . . . . 75 W HE1 . 18813 1
585 . 1 1 71 71 TRP HE3 H 1 7.533 0.05 . 4 . . . . 75 W HE3 . 18813 1
586 . 1 1 71 71 TRP HZ2 H 1 7.147 0.05 . 4 . . . . 75 W HH2 . 18813 1
587 . 1 1 71 71 TRP HZ3 H 1 7.221 0.05 . 4 . . . . 75 W HZ3 . 18813 1
588 . 1 1 71 71 TRP HH2 H 1 7.325 0.05 . 4 . . . . 75 W HZ2 . 18813 1
589 . 1 1 71 71 TRP C C 13 179.099 0.15 . 1 . . . . 75 W C . 18813 1
590 . 1 1 71 71 TRP CA C 13 59.411 0.15 . 1 . . . . 75 W CA . 18813 1
591 . 1 1 71 71 TRP CB C 13 28.939 0.15 . 1 . . . . 75 W CB . 18813 1
592 . 1 1 71 71 TRP CD1 C 13 122.541 0.15 . 4 . . . . 75 W CD1 . 18813 1
593 . 1 1 71 71 TRP CE3 C 13 121.368 0.15 . 4 . . . . 75 W CE3 . 18813 1
594 . 1 1 71 71 TRP CZ2 C 13 113.820 0.15 . 4 . . . . 75 W CH2 . 18813 1
595 . 1 1 71 71 TRP CZ3 C 13 123.093 0.15 . 4 . . . . 75 W CZ3 . 18813 1
596 . 1 1 71 71 TRP CH2 C 13 125.568 0.15 . 4 . . . . 75 W CZ2 . 18813 1
597 . 1 1 71 71 TRP N N 15 121.509 0.15 . 1 . . . . 75 W N . 18813 1
598 . 1 1 71 71 TRP NE1 N 15 125.191 0.15 . 1 . . . . 75 W NE1 . 18813 1
599 . 1 1 72 72 LYS H H 1 8.273 0.05 . 1 . . . . 76 K H . 18813 1
600 . 1 1 72 72 LYS HA H 1 4.323 0.05 . 1 . . . . 76 K HA . 18813 1
601 . 1 1 72 72 LYS HB2 H 1 1.914 0.05 . 2 . . . . 76 K HB2 . 18813 1
602 . 1 1 72 72 LYS HG2 H 1 1.336 0.05 . 2 . . . . 76 K HG2 . 18813 1
603 . 1 1 72 72 LYS HG3 H 1 1.452 0.05 . 2 . . . . 76 K HG3 . 18813 1
604 . 1 1 72 72 LYS HE2 H 1 2.979 0.05 . 2 . . . . 76 K HE2 . 18813 1
605 . 1 1 72 72 LYS HE3 H 1 3.023 0.05 . 2 . . . . 76 K HE3 . 18813 1
606 . 1 1 72 72 LYS C C 13 176.087 0.15 . 1 . . . . 76 K C . 18813 1
607 . 1 1 72 72 LYS CA C 13 58.338 0.15 . 1 . . . . 76 K CA . 18813 1
608 . 1 1 72 72 LYS CB C 13 31.440 0.15 . 1 . . . . 76 K CB . 18813 1
609 . 1 1 72 72 LYS CE C 13 42.187 0.15 . 1 . . . . 76 K CE . 18813 1
610 . 1 1 72 72 LYS N N 15 113.979 0.15 . 1 . . . . 76 K N . 18813 1
611 . 1 1 73 73 ASP H H 1 7.954 0.05 . 1 . . . . 77 D H . 18813 1
612 . 1 1 73 73 ASP HA H 1 5.024 0.05 . 1 . . . . 77 D HA . 18813 1
613 . 1 1 73 73 ASP HB2 H 1 2.839 0.05 . 2 . . . . 77 D HB2 . 18813 1
614 . 1 1 73 73 ASP HB3 H 1 3.389 0.05 . 2 . . . . 77 D HB3 . 18813 1
615 . 1 1 73 73 ASP C C 13 174.603 0.15 . 1 . . . . 77 D C . 18813 1
616 . 1 1 73 73 ASP CA C 13 54.805 0.15 . 1 . . . . 77 D CA . 18813 1
617 . 1 1 73 73 ASP CB C 13 42.768 0.15 . 1 . . . . 77 D CB . 18813 1
618 . 1 1 73 73 ASP N N 15 119.992 0.15 . 1 . . . . 77 D N . 18813 1
619 . 1 1 74 74 ILE H H 1 7.716 0.05 . 1 . . . . 78 I H . 18813 1
620 . 1 1 74 74 ILE HA H 1 4.738 0.05 . 1 . . . . 78 I HA . 18813 1
621 . 1 1 74 74 ILE HB H 1 1.775 0.05 . 1 . . . . 78 I HB . 18813 1
622 . 1 1 74 74 ILE HG12 H 1 1.960 0.05 . 2 . . . . 78 I HG12 . 18813 1
623 . 1 1 74 74 ILE HG13 H 1 0.655 0.05 . 2 . . . . 78 I HG13 . 18813 1
624 . 1 1 74 74 ILE HG21 H 1 0.626 0.05 . 1 . . . . 78 I QG2 . 18813 1
625 . 1 1 74 74 ILE HG22 H 1 0.626 0.05 . 1 . . . . 78 I QG2 . 18813 1
626 . 1 1 74 74 ILE HG23 H 1 0.626 0.05 . 1 . . . . 78 I QG2 . 18813 1
627 . 1 1 74 74 ILE HD11 H 1 0.695 0.05 . 1 . . . . 78 I QD1 . 18813 1
628 . 1 1 74 74 ILE HD12 H 1 0.695 0.05 . 1 . . . . 78 I QD1 . 18813 1
629 . 1 1 74 74 ILE HD13 H 1 0.695 0.05 . 1 . . . . 78 I QD1 . 18813 1
630 . 1 1 74 74 ILE C C 13 174.944 0.15 . 1 . . . . 78 I C . 18813 1
631 . 1 1 74 74 ILE CA C 13 61.210 0.15 . 1 . . . . 78 I CA . 18813 1
632 . 1 1 74 74 ILE CB C 13 40.164 0.15 . 1 . . . . 78 I CB . 18813 1
633 . 1 1 74 74 ILE CG1 C 13 28.494 0.15 . 1 . . . . 78 I CG1 . 18813 1
634 . 1 1 74 74 ILE CG2 C 13 18.867 0.15 . 1 . . . . 78 I CG2 . 18813 1
635 . 1 1 74 74 ILE CD1 C 13 14.538 0.15 . 1 . . . . 78 I CD1 . 18813 1
636 . 1 1 74 74 ILE N N 15 121.009 0.15 . 1 . . . . 78 I N . 18813 1
637 . 1 1 75 75 SER H H 1 8.919 0.05 . 1 . . . . 79 S H . 18813 1
638 . 1 1 75 75 SER HA H 1 4.974 0.05 . 1 . . . . 79 S HA . 18813 1
639 . 1 1 75 75 SER HB2 H 1 3.668 0.05 . 2 . . . . 79 S HB2 . 18813 1
640 . 1 1 75 75 SER HB3 H 1 3.827 0.05 . 2 . . . . 79 S HB3 . 18813 1
641 . 1 1 75 75 SER CA C 13 55.362 0.15 . 1 . . . . 79 S CA . 18813 1
642 . 1 1 75 75 SER CB C 13 64.648 0.15 . 1 . . . . 79 S CB . 18813 1
643 . 1 1 75 75 SER N N 15 122.355 0.15 . 1 . . . . 79 S N . 18813 1
644 . 1 1 76 76 PRO HA H 1 4.259 0.05 . 1 . . . . 80 P HA . 18813 1
645 . 1 1 76 76 PRO HB2 H 1 1.835 0.05 . 2 . . . . 80 P HB2 . 18813 1
646 . 1 1 76 76 PRO HB3 H 1 2.247 0.05 . 2 . . . . 80 P HB3 . 18813 1
647 . 1 1 76 76 PRO HG2 H 1 1.777 0.05 . 2 . . . . 80 P HG2 . 18813 1
648 . 1 1 76 76 PRO HG3 H 1 2.068 0.05 . 2 . . . . 80 O HG3 . 18813 1
649 . 1 1 76 76 PRO HD2 H 1 3.649 0.05 . 2 . . . . 80 P HD2 . 18813 1
650 . 1 1 76 76 PRO C C 13 175.768 0.15 . 1 . . . . 80 P C . 18813 1
651 . 1 1 76 76 PRO CA C 13 63.462 0.15 . 1 . . . . 80 P CA . 18813 1
652 . 1 1 76 76 PRO CB C 13 32.152 0.15 . 1 . . . . 80 P CB . 18813 1
653 . 1 1 76 76 PRO CG C 13 27.808 0.15 . 1 . . . . 80 P CG . 18813 1
654 . 1 1 77 77 ALA H H 1 8.050 0.05 . 1 . . . . 81 A H . 18813 1
655 . 1 1 77 77 ALA HA H 1 4.132 0.05 . 1 . . . . 81 A HA . 18813 1
656 . 1 1 77 77 ALA HB1 H 1 1.058 0.05 . 1 . . . . 81 A QB . 18813 1
657 . 1 1 77 77 ALA HB2 H 1 1.058 0.05 . 1 . . . . 81 A QB . 18813 1
658 . 1 1 77 77 ALA HB3 H 1 1.058 0.05 . 1 . . . . 81 A QB . 18813 1
659 . 1 1 77 77 ALA C C 13 176.504 0.15 . 1 . . . . 81 A C . 18813 1
660 . 1 1 77 77 ALA CA C 13 52.474 0.15 . 1 . . . . 81 A CA . 18813 1
661 . 1 1 77 77 ALA CB C 13 18.782 0.15 . 1 . . . . 81 A CB . 18813 1
662 . 1 1 77 77 ALA N N 15 124.762 0.15 . 1 . . . . 81 A N . 18813 1
663 . 1 1 78 78 ALA H H 1 8.033 0.05 . 1 . . . . 82 A H . 18813 1
664 . 1 1 78 78 ALA HA H 1 4.402 0.05 . 1 . . . . 82 A HA . 18813 1
665 . 1 1 78 78 ALA HB1 H 1 1.337 0.05 . 1 . . . . 82 A QB . 18813 1
666 . 1 1 78 78 ALA HB2 H 1 1.337 0.05 . 1 . . . . 82 A QB . 18813 1
667 . 1 1 78 78 ALA HB3 H 1 1.337 0.05 . 1 . . . . 82 A QB . 18813 1
668 . 1 1 78 78 ALA C C 13 175.913 0.15 . 1 . . . . 82 A C . 18813 1
669 . 1 1 78 78 ALA CA C 13 51.960 0.15 . 1 . . . . 82 A CA . 18813 1
670 . 1 1 78 78 ALA CB C 13 19.164 0.15 . 1 . . . . 82 A CB . 18813 1
671 . 1 1 78 78 ALA N N 15 123.447 0.15 . 1 . . . . 82 A N . 18813 1
672 . 1 1 79 79 LEU H H 1 7.843 0.05 . 1 . . . . 83 L H . 18813 1
673 . 1 1 79 79 LEU CA C 13 56.817 0.15 . 1 . . . . 83 L CA . 18813 1
674 . 1 1 79 79 LEU CB C 13 43.310 0.15 . 1 . . . . 83 L CB . 18813 1
675 . 1 1 79 79 LEU N N 15 127.853 0.15 . 1 . . . . 83 L N . 18813 1
676 . 2 2 2 2 THR HA H 1 4.406 0.05 . 1 . . . . 332 V HA . 18813 1
677 . 2 2 3 3 GLY H H 1 8.656 0.05 . 1 . . . . 333 G H . 18813 1
678 . 2 2 3 3 GLY HA2 H 1 3.972 0.05 . 2 . . . . 333 G HA2 . 18813 1
679 . 2 2 3 3 GLY HA3 H 1 4.019 0.05 . 2 . . . . 333 G HA3 . 18813 1
680 . 2 2 4 4 GLY H H 1 8.265 0.05 . 1 . . . . 334 G H . 18813 1
681 . 2 2 4 4 GLY HA2 H 1 3.935 0.05 . 2 . . . . 334 G HA2 . 18813 1
682 . 2 2 4 4 GLY HA3 H 1 4.018 0.05 . 2 . . . . 334 G HA3 . 18813 1
683 . 2 2 5 5 VAL H H 1 7.975 0.05 . 1 . . . . 335 V H . 18813 1
684 . 2 2 5 5 VAL HA H 1 4.189 0.05 . 1 . . . . 335 V HA . 18813 1
685 . 2 2 5 5 VAL HB H 1 1.990 0.05 . 1 . . . . 335 V HB . 18813 1
686 . 2 2 5 5 VAL HG11 H 1 0.911 0.05 . 2 . . . . 335 V QG1 . 18813 1
687 . 2 2 5 5 VAL HG12 H 1 0.911 0.05 . 2 . . . . 335 V QG1 . 18813 1
688 . 2 2 5 5 VAL HG13 H 1 0.911 0.05 . 2 . . . . 335 V QG1 . 18813 1
689 . 2 2 6 6 M3L H H 1 8.548 0.05 . 1 . . . . 336 M3L H . 18813 1
690 . 2 2 6 6 M3L HA H 1 4.433 0.05 . 1 . . . . 336 M3L HA . 18813 1
691 . 2 2 6 6 M3L HB3 H 1 1.706 0.05 . 4 . . . . 336 M3L HB3 . 18813 1
692 . 2 2 6 6 M3L HD2 H 1 1.649 0.05 . 4 . . . . 336 M3L HD2 . 18813 1
693 . 2 2 6 6 M3L HE2 H 1 2.932 0.05 . 4 . . . . 336 M3L HE2 . 18813 1
694 . 2 2 6 6 M3L HG2 H 1 1.295 0.05 . 4 . . . . 336 M3L HG2 . 18813 1
695 . 2 2 6 6 M3L HG3 H 1 1.409 0.05 . 4 . . . . 336 M3L HG3 . 18813 1
696 . 2 2 6 6 M3L HM11 H 1 1.713 0.05 . 4 . . . . 336 M3L QM1 . 18813 1
697 . 2 2 6 6 M3L HM12 H 1 1.713 0.05 . 4 . . . . 336 M3L QM1 . 18813 1
698 . 2 2 6 6 M3L HM13 H 1 1.713 0.05 . 4 . . . . 336 M3L QM1 . 18813 1
699 . 2 2 6 6 M3L HM21 H 1 1.291 0.05 . 4 . . . . 336 M3L QM2 . 18813 1
700 . 2 2 6 6 M3L HM22 H 1 1.291 0.05 . 4 . . . . 336 M3L QM2 . 18813 1
701 . 2 2 6 6 M3L HM23 H 1 1.291 0.05 . 4 . . . . 336 M3L QM2 . 18813 1
702 . 2 2 7 7 LYS H H 1 8.681 0.05 . 1 . . . . 337 K H . 18813 1
703 . 2 2 7 7 LYS HA H 1 4.772 0.05 . 1 . . . . 337 K HA . 18813 1
704 . 2 2 7 7 LYS HB2 H 1 1.961 0.05 . 2 . . . . 337 K HB2 . 18813 1
705 . 2 2 7 7 LYS HD2 H 1 1.748 0.05 . 2 . . . . 337 K HD2 . 18813 1
706 . 2 2 7 7 LYS HE2 H 1 2.993 0.05 . 2 . . . . 337 K HE2 . 18813 1
707 . 2 2 8 8 PRO HA H 1 4.827 0.05 . 1 . . . . 338 P HA . 18813 1
708 . 2 2 8 8 PRO HB2 H 1 1.770 0.05 . 2 . . . . 338 P HB2 . 18813 1
709 . 2 2 8 8 PRO HB3 H 1 1.819 0.05 . 2 . . . . 338 P HB3 . 18813 1
710 . 2 2 8 8 PRO HG2 H 1 1.957 0.05 . 2 . . . . 338 P HG2 . 18813 1
711 . 2 2 8 8 PRO HD2 H 1 3.848 0.05 . 2 . . . . 338 P HD2 . 18813 1
712 . 2 2 8 8 PRO HD3 H 1 3.652 0.05 . 2 . . . . 338 P HD3 . 18813 1
713 . 2 2 9 9 HIS H H 1 8.773 0.05 . 1 . . . . 339 H H . 18813 1
714 . 2 2 9 9 HIS HA H 1 4.760 0.05 . 1 . . . . 339 H HA . 18813 1
715 . 2 2 9 9 HIS HB2 H 1 2.901 0.05 . 2 . . . . 339 H HB2 . 18813 1
716 . 2 2 9 9 HIS HD2 H 1 6.884 0.05 . 4 . . . . 339 H HD2 . 18813 1
717 . 2 2 9 9 HIS HE1 H 1 8.071 0.05 . 4 . . . . 339 H HE1 . 18813 1
718 . 2 2 10 10 ARG H H 1 8.042 0.05 . 1 . . . . 340 R H . 18813 1
719 . 2 2 10 10 ARG HA H 1 4.270 0.05 . 1 . . . . 340 R HA . 18813 1
720 . 2 2 10 10 ARG HB2 H 1 1.594 0.05 . 2 . . . . 340 R HB2 . 18813 1
721 . 2 2 10 10 ARG HB3 H 1 1.731 0.05 . 2 . . . . 340 R HB3 . 18813 1
722 . 2 2 10 10 ARG HG2 H 1 1.482 0.05 . 2 . . . . 340 R HG2 . 18813 1
723 . 2 2 10 10 ARG HD2 H 1 3.110 0.05 . 2 . . . . 340 R HD2 . 18813 1
724 . 2 2 11 11 TYR H H 1 7.717 0.05 . 1 . . . . 341 Y H . 18813 1
725 . 2 2 11 11 TYR HA H 1 4.309 0.05 . 1 . . . . 341 Y HA . 18813 1
726 . 2 2 11 11 TYR HB2 H 1 2.827 0.05 . 2 . . . . 341 Y HB2 . 18813 1
727 . 2 2 11 11 TYR HB3 H 1 3.056 0.05 . 2 . . . . 341 Y HB3 . 18813 1
728 . 2 2 11 11 TYR HD1 H 1 7.113 0.05 . 3 . . . . 341 Y HD1 . 18813 1
stop_
loop_
_Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID
_Ambiguous_atom_chem_shift.Atom_chem_shift_ID
_Ambiguous_atom_chem_shift.Entry_ID
_Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID
1 99 18813 1
1 101 18813 1
1 102 18813 1
2 106 18813 1
3 202 18813 1
3 203 18813 1
4 269 18813 1
5 273 18813 1
6 468 18813 1
6 469 18813 1
6 470 18813 1
7 474 18813 1
7 475 18813 1
7 476 18813 1
8 529 18813 1
8 530 18813 1
9 533 18813 1
10 583 18813 1
10 585 18813 1
10 586 18813 1
10 587 18813 1
10 588 18813 1
11 592 18813 1
11 593 18813 1
11 594 18813 1
11 595 18813 1
11 596 18813 1
12 691 18813 1
12 692 18813 1
12 693 18813 1
12 694 18813 1
12 695 18813 1
12 696 18813 1
12 697 18813 1
12 698 18813 1
12 699 18813 1
12 700 18813 1
12 701 18813 1
13 716 18813 1
13 717 18813 1
stop_
save_