Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 34778
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-1H TOCSY' . . . 34778 1
2 '2D 1H-1H TOCSY' . . . 34778 1
3 '2D 1H-1H NOESY' . . . 34778 1
4 '2D 1H-1H NOESY' . . . 34778 1
5 '2D 1H-1H ROESY' . . . 34778 1
6 '2D 1H-1H ROESY' . . . 34778 1
7 '2D DQF-COSY' . . . 34778 1
8 '2D 1H-13C HSQC aliphatic' . . . 34778 1
9 '2D 1H-15N SOFAST-HMQC' . . . 34778 1
10 '2D 1H-13C HSQC-TOCSY' . . . 34778 1
11 '2D 1H-13C HMBC' . . . 34778 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 HIS HA H 1 4.395 0.002 . 1 . . 107 . A 1 HIS HA . 34778 1
2 . 1 . 1 1 1 HIS HB2 H 1 3.374 0.007 . 2 . . 110 . A 1 HIS HB2 . 34778 1
3 . 1 . 1 1 1 HIS HB3 H 1 3.375 0.006 . 2 . . 111 . A 1 HIS HB3 . 34778 1
4 . 1 . 1 1 1 HIS HD2 H 1 7.269 0.002 . 1 . . 105 . A 1 HIS HD2 . 34778 1
5 . 1 . 1 1 1 HIS HE1 H 1 8.471 0.002 . 1 . . 103 . A 1 HIS HE1 . 34778 1
6 . 1 . 1 1 1 HIS CA C 13 55.813 . . 1 . . 108 . A 1 HIS CA . 34778 1
7 . 1 . 1 1 1 HIS CB C 13 30.691 0.009 . 1 . . 109 . A 1 HIS CB . 34778 1
8 . 1 . 1 1 1 HIS CD2 C 13 120.423 . . 1 . . 106 . A 1 HIS CD2 . 34778 1
9 . 1 . 1 1 1 HIS CE1 C 13 137.532 . . 1 . . 104 . A 1 HIS CE1 . 34778 1
10 . 1 . 1 2 2 VAL H H 1 7.821 0.002 . 1 . . 9 . A 2 VAL H . 34778 1
11 . 1 . 1 2 2 VAL HA H 1 4.330 0.009 . 1 . . 221 . A 2 VAL HA . 34778 1
12 . 1 . 1 2 2 VAL HB H 1 2.244 0.004 . 1 . . 223 . A 2 VAL HB . 34778 1
13 . 1 . 1 2 2 VAL HG11 H 1 1.094 0.005 . 2 . . 226 . A 2 VAL HG11 . 34778 1
14 . 1 . 1 2 2 VAL HG12 H 1 1.094 0.005 . 2 . . 226 . A 2 VAL HG12 . 34778 1
15 . 1 . 1 2 2 VAL HG13 H 1 1.094 0.005 . 2 . . 226 . A 2 VAL HG13 . 34778 1
16 . 1 . 1 2 2 VAL HG21 H 1 1.090 0.006 . 2 . . 227 . A 2 VAL HG21 . 34778 1
17 . 1 . 1 2 2 VAL HG22 H 1 1.090 0.006 . 2 . . 227 . A 2 VAL HG22 . 34778 1
18 . 1 . 1 2 2 VAL HG23 H 1 1.090 0.006 . 2 . . 227 . A 2 VAL HG23 . 34778 1
19 . 1 . 1 2 2 VAL CA C 13 62.947 . . 1 . . 222 . A 2 VAL CA . 34778 1
20 . 1 . 1 2 2 VAL CB C 13 32.998 . . 1 . . 224 . A 2 VAL CB . 34778 1
21 . 1 . 1 2 2 VAL CG1 C 13 20.840 . . 2 . . 225 . A 2 VAL CG1 . 34778 1
22 . 1 . 1 2 2 VAL CG2 C 13 20.860 . . 2 . . 228 . A 2 VAL CG2 . 34778 1
23 . 1 . 1 2 2 VAL N N 15 115.526 . . 1 . . 10 . A 2 VAL N . 34778 1
24 . 1 . 1 3 3 PHE HA H 1 4.435 . . 1 . . 101 . A 3 PHE HA . 34778 1
25 . 1 . 1 3 3 PHE HB2 H 1 3.313 0.007 . 2 . . 98 . A 3 PHE HB2 . 34778 1
26 . 1 . 1 3 3 PHE HB3 H 1 3.483 0.005 . 2 . . 100 . A 3 PHE HB3 . 34778 1
27 . 1 . 1 3 3 PHE HD1 H 1 7.459 0.004 . 1 . . 90 . A 3 PHE HD1 . 34778 1
28 . 1 . 1 3 3 PHE HD2 H 1 7.459 0.004 . 1 . . 90 . A 3 PHE HD2 . 34778 1
29 . 1 . 1 3 3 PHE HE1 H 1 7.591 0.006 . 1 . . 92 . A 3 PHE HE1 . 34778 1
30 . 1 . 1 3 3 PHE HE2 H 1 7.591 0.006 . 1 . . 92 . A 3 PHE HE2 . 34778 1
31 . 1 . 1 3 3 PHE HZ H 1 7.408 0.011 . 1 . . 94 . A 3 PHE HZ . 34778 1
32 . 1 . 1 3 3 PHE CA C 13 56.853 . . 1 . . 102 . A 3 PHE CA . 34778 1
33 . 1 . 1 3 3 PHE CB C 13 39.520 0.04 . 1 . . 99 . A 3 PHE CB . 34778 1
34 . 1 . 1 3 3 PHE CD1 C 13 131.580 . . 1 . . 91 . A 3 PHE CD1 . 34778 1
35 . 1 . 1 3 3 PHE CD2 C 13 131.580 . . 1 . . 91 . A 3 PHE CD2 . 34778 1
36 . 1 . 1 3 3 PHE CE1 C 13 132.062 . . 1 . . 93 . A 3 PHE CE1 . 34778 1
37 . 1 . 1 3 3 PHE CE2 C 13 132.062 . . 1 . . 93 . A 3 PHE CE2 . 34778 1
38 . 1 . 1 3 3 PHE CZ C 13 129.649 . . 1 . . 95 . A 3 PHE CZ . 34778 1
39 . 1 . 1 4 4 ARG H H 1 8.553 0.002 . 1 . . 21 . A 4 ARG H . 34778 1
40 . 1 . 1 4 4 ARG HA H 1 4.804 0.025 . 1 . . 79 . A 4 ARG HA . 34778 1
41 . 1 . 1 4 4 ARG HB2 H 1 1.926 0.005 . 2 . . 84 . A 4 ARG HB2 . 34778 1
42 . 1 . 1 4 4 ARG HB3 H 1 1.926 0.006 . 2 . . 85 . A 4 ARG HB3 . 34778 1
43 . 1 . 1 4 4 ARG HG2 H 1 1.619 0.007 . 1 . . 88 . A 4 ARG HG2 . 34778 1
44 . 1 . 1 4 4 ARG HG3 H 1 1.619 0.007 . 1 . . 89 . A 4 ARG HG3 . 34778 1
45 . 1 . 1 4 4 ARG HD2 H 1 3.310 0.006 . 2 . . 81 . A 4 ARG HD2 . 34778 1
46 . 1 . 1 4 4 ARG HD3 H 1 3.310 0.006 . 2 . . 83 . A 4 ARG HD3 . 34778 1
47 . 1 . 1 4 4 ARG CA C 13 59.386 . . 1 . . 80 . A 4 ARG CA . 34778 1
48 . 1 . 1 4 4 ARG CB C 13 32.755 . . 1 . . 86 . A 4 ARG CB . 34778 1
49 . 1 . 1 4 4 ARG CG C 13 25.527 . . 1 . . 87 . A 4 ARG CG . 34778 1
50 . 1 . 1 4 4 ARG CD C 13 39.480 . . 1 . . 82 . A 4 ARG CD . 34778 1
51 . 1 . 1 4 4 ARG N N 15 123.897 . . 1 . . 22 . A 4 ARG N . 34778 1
52 . 1 . 1 5 5 LEU H H 1 7.808 0.005 . 1 . . 11 . A 5 LEU H . 34778 1
53 . 1 . 1 5 5 LEU HA H 1 4.430 0.005 . 1 . . 68 . A 5 LEU HA . 34778 1
54 . 1 . 1 5 5 LEU HB2 H 1 1.845 0.01 . 2 . . 70 . A 5 LEU HB2 . 34778 1
55 . 1 . 1 5 5 LEU HB3 H 1 1.779 0.008 . 2 . . 72 . A 5 LEU HB3 . 34778 1
56 . 1 . 1 5 5 LEU HG H 1 1.822 0.011 . 1 . . 77 . A 5 LEU HG . 34778 1
57 . 1 . 1 5 5 LEU HD11 H 1 1.144 0.004 . 2 . . 73 . A 5 LEU HD11 . 34778 1
58 . 1 . 1 5 5 LEU HD12 H 1 1.144 0.004 . 2 . . 73 . A 5 LEU HD12 . 34778 1
59 . 1 . 1 5 5 LEU HD13 H 1 1.144 0.004 . 2 . . 73 . A 5 LEU HD13 . 34778 1
60 . 1 . 1 5 5 LEU HD21 H 1 1.077 0.005 . 2 . . 75 . A 5 LEU HD21 . 34778 1
61 . 1 . 1 5 5 LEU HD22 H 1 1.077 0.005 . 2 . . 75 . A 5 LEU HD22 . 34778 1
62 . 1 . 1 5 5 LEU HD23 H 1 1.077 0.005 . 2 . . 75 . A 5 LEU HD23 . 34778 1
63 . 1 . 1 5 5 LEU CA C 13 56.774 . . 1 . . 69 . A 5 LEU CA . 34778 1
64 . 1 . 1 5 5 LEU CB C 13 42.633 0.02 . 1 . . 71 . A 5 LEU CB . 34778 1
65 . 1 . 1 5 5 LEU CG C 13 27.164 . . 1 . . 78 . A 5 LEU CG . 34778 1
66 . 1 . 1 5 5 LEU CD1 C 13 23.917 . . 2 . . 76 . A 5 LEU CD1 . 34778 1
67 . 1 . 1 5 5 LEU CD2 C 13 23.898 . . 2 . . 74 . A 5 LEU CD2 . 34778 1
68 . 1 . 1 5 5 LEU N N 15 121.324 . . 1 . . 12 . A 5 LEU N . 34778 1
69 . 1 . 1 6 6 LYS H H 1 8.242 0.001 . 1 . . 37 . A 6 LYS H . 34778 1
70 . 1 . 1 6 6 LYS HA H 1 4.452 0.005 . 1 . . 54 . A 6 LYS HA . 34778 1
71 . 1 . 1 6 6 LYS HB2 H 1 2.047 0.013 . 2 . . 63 . A 6 LYS HB2 . 34778 1
72 . 1 . 1 6 6 LYS HB3 H 1 1.982 0.004 . 2 . . 67 . A 6 LYS HB3 . 34778 1
73 . 1 . 1 6 6 LYS HG2 H 1 1.795 0.004 . 2 . . 59 . A 6 LYS HG2 . 34778 1
74 . 1 . 1 6 6 LYS HG3 H 1 1.854 0.006 . 2 . . 66 . A 6 LYS HG3 . 34778 1
75 . 1 . 1 6 6 LYS HE2 H 1 3.381 0.004 . 2 . . 56 . A 6 LYS HE2 . 34778 1
76 . 1 . 1 6 6 LYS HE3 H 1 3.381 0.004 . 2 . . 58 . A 6 LYS HE3 . 34778 1
77 . 1 . 1 6 6 LYS CA C 13 56.997 . . 1 . . 55 . A 6 LYS CA . 34778 1
78 . 1 . 1 6 6 LYS CB C 13 30.753 0.001 . 1 . . 64 . A 6 LYS CB . 34778 1
79 . 1 . 1 6 6 LYS CG C 13 27.488 0.004 . 1 . . 60 . A 6 LYS CG . 34778 1
80 . 1 . 1 6 6 LYS CE C 13 43.501 . . 1 . . 57 . A 6 LYS CE . 34778 1
81 . 1 . 1 6 6 LYS N N 15 122.528 . . 1 . . 38 . A 6 LYS N . 34778 1
82 . 1 . 1 7 7 LYS H H 1 8.058 0.003 . 1 . . 25 . A 7 LYS H . 34778 1
83 . 1 . 1 7 7 LYS HA H 1 4.208 0.003 . 1 . . 158 . A 7 LYS HA . 34778 1
84 . 1 . 1 7 7 LYS HB2 H 1 2.032 0.011 . 2 . . 163 . A 7 LYS HB2 . 34778 1
85 . 1 . 1 7 7 LYS HB3 H 1 2.152 0.007 . 2 . . 220 . A 7 LYS HB3 . 34778 1
86 . 1 . 1 7 7 LYS HG2 H 1 1.565 0.004 . 2 . . 166 . A 7 LYS HG2 . 34778 1
87 . 1 . 1 7 7 LYS HG3 H 1 1.626 0.005 . 2 . . 168 . A 7 LYS HG3 . 34778 1
88 . 1 . 1 7 7 LYS HD2 H 1 1.871 0.005 . 2 . . 172 . A 7 LYS HD2 . 34778 1
89 . 1 . 1 7 7 LYS HD3 H 1 1.871 0.005 . 2 . . 174 . A 7 LYS HD3 . 34778 1
90 . 1 . 1 7 7 LYS HE2 H 1 3.117 0.004 . 2 . . 160 . A 7 LYS HE2 . 34778 1
91 . 1 . 1 7 7 LYS HE3 H 1 3.117 0.004 . 2 . . 162 . A 7 LYS HE3 . 34778 1
92 . 1 . 1 7 7 LYS CA C 13 59.089 . . 1 . . 159 . A 7 LYS CA . 34778 1
93 . 1 . 1 7 7 LYS CB C 13 32.669 0.021 . 1 . . 164 . A 7 LYS CB . 34778 1
94 . 1 . 1 7 7 LYS CG C 13 25.348 0.005 . 1 . . 167 . A 7 LYS CG . 34778 1
95 . 1 . 1 7 7 LYS CD C 13 29.573 . . 1 . . 173 . A 7 LYS CD . 34778 1
96 . 1 . 1 7 7 LYS CE C 13 42.181 . . 1 . . 161 . A 7 LYS CE . 34778 1
97 . 1 . 1 7 7 LYS N N 15 118.078 . . 1 . . 26 . A 7 LYS N . 34778 1
98 . 1 . 1 8 8 TRP H H 1 7.849 0.003 . 1 . . 23 . A 8 TRP H . 34778 1
99 . 1 . 1 8 8 TRP HA H 1 4.623 0.007 . 1 . . 131 . A 8 TRP HA . 34778 1
100 . 1 . 1 8 8 TRP HB2 H 1 3.620 0.003 . 2 . . 133 . A 8 TRP HB2 . 34778 1
101 . 1 . 1 8 8 TRP HB3 H 1 3.544 0.004 . 2 . . 135 . A 8 TRP HB3 . 34778 1
102 . 1 . 1 8 8 TRP HD1 H 1 7.398 0.008 . 1 . . 120 . A 8 TRP HD1 . 34778 1
103 . 1 . 1 8 8 TRP HE1 H 1 9.946 0.001 . 1 . . 35 . A 8 TRP HE1 . 34778 1
104 . 1 . 1 8 8 TRP HE3 H 1 7.605 0.006 . 1 . . 130 . A 8 TRP HE3 . 34778 1
105 . 1 . 1 8 8 TRP HZ2 H 1 7.748 0.002 . 1 . . 122 . A 8 TRP HZ2 . 34778 1
106 . 1 . 1 8 8 TRP HZ3 H 1 7.364 0.004 . 1 . . 127 . A 8 TRP HZ3 . 34778 1
107 . 1 . 1 8 8 TRP HH2 H 1 7.264 0.004 . 1 . . 125 . A 8 TRP HH2 . 34778 1
108 . 1 . 1 8 8 TRP CA C 13 59.738 . . 1 . . 132 . A 8 TRP CA . 34778 1
109 . 1 . 1 8 8 TRP CB C 13 29.091 0.025 . 1 . . 134 . A 8 TRP CB . 34778 1
110 . 1 . 1 8 8 TRP CD1 C 13 126.496 . . 1 . . 121 . A 8 TRP CD1 . 34778 1
111 . 1 . 1 8 8 TRP CE3 C 13 120.803 . . 1 . . 129 . A 8 TRP CE3 . 34778 1
112 . 1 . 1 8 8 TRP CZ2 C 13 114.421 . . 1 . . 123 . A 8 TRP CZ2 . 34778 1
113 . 1 . 1 8 8 TRP CZ3 C 13 124.666 . . 1 . . 128 . A 8 TRP CZ3 . 34778 1
114 . 1 . 1 8 8 TRP CH2 C 13 121.976 . . 1 . . 126 . A 8 TRP CH2 . 34778 1
115 . 1 . 1 8 8 TRP N N 15 118.273 . . 1 . . 24 . A 8 TRP N . 34778 1
116 . 1 . 1 8 8 TRP NE1 N 15 127.333 . . 1 . . 36 . A 8 TRP NE1 . 34778 1
117 . 1 . 1 9 9 ILE H H 1 7.916 0.004 . 1 . . 7 . A 9 ILE H . 34778 1
118 . 1 . 1 9 9 ILE HA H 1 3.830 0.003 . 1 . . 145 . A 9 ILE HA . 34778 1
119 . 1 . 1 9 9 ILE HB H 1 1.960 0.007 . 1 . . 143 . A 9 ILE HB . 34778 1
120 . 1 . 1 9 9 ILE HG12 H 1 1.285 0.006 . 2 . . 140 . A 9 ILE HG12 . 34778 1
121 . 1 . 1 9 9 ILE HG13 H 1 1.705 0.005 . 2 . . 142 . A 9 ILE HG13 . 34778 1
122 . 1 . 1 9 9 ILE HG21 H 1 1.060 0.008 . 1 . . 136 . A 9 ILE HG21 . 34778 1
123 . 1 . 1 9 9 ILE HG22 H 1 1.060 0.008 . 1 . . 136 . A 9 ILE HG22 . 34778 1
124 . 1 . 1 9 9 ILE HG23 H 1 1.060 0.008 . 1 . . 136 . A 9 ILE HG23 . 34778 1
125 . 1 . 1 9 9 ILE HD11 H 1 1.023 0.003 . 1 . . 147 . A 9 ILE HD11 . 34778 1
126 . 1 . 1 9 9 ILE HD12 H 1 1.023 0.003 . 1 . . 147 . A 9 ILE HD12 . 34778 1
127 . 1 . 1 9 9 ILE HD13 H 1 1.023 0.003 . 1 . . 147 . A 9 ILE HD13 . 34778 1
128 . 1 . 1 9 9 ILE CA C 13 64.225 . . 1 . . 146 . A 9 ILE CA . 34778 1
129 . 1 . 1 9 9 ILE CB C 13 38.375 . . 1 . . 144 . A 9 ILE CB . 34778 1
130 . 1 . 1 9 9 ILE CG1 C 13 28.597 0.008 . 1 . . 141 . A 9 ILE CG1 . 34778 1
131 . 1 . 1 9 9 ILE CG2 C 13 16.820 . . 1 . . 137 . A 9 ILE CG2 . 34778 1
132 . 1 . 1 9 9 ILE CD1 C 13 12.613 . . 1 . . 148 . A 9 ILE CD1 . 34778 1
133 . 1 . 1 9 9 ILE N N 15 118.760 . . 1 . . 8 . A 9 ILE N . 34778 1
134 . 1 . 1 10 10 MK8 N N 15 127.466 . . 1 . . 16 . A 10 MK8 N . 34778 1
135 . 1 . 1 10 10 MK8 CA C 13 20.846 . . 1 . . 204 . A 10 MK8 CA . 34778 1
136 . 1 . 1 10 10 MK8 CB C 13 40.644 0.02 . 1 . . 230 . A 10 MK8 CB . 34778 1
137 . 1 . 1 10 10 MK8 CD C 13 30.386 0.037 . 1 . . 241 . A 10 MK8 CD . 34778 1
138 . 1 . 1 10 10 MK8 CE C 13 131.157 . . 1 . . 6 . A 10 MK8 CE . 34778 1
139 . 1 . 1 10 10 MK8 CG C 13 26.681 0.008 . 1 . . 239 . A 10 MK8 CG . 34778 1
140 . 1 . 1 10 10 MK8 HB1 H 1 1.611 0.01 . 1 . . 205 . A 10 MK8 HB1 . 34778 1
141 . 1 . 1 10 10 MK8 HB2 H 1 2.189 0.004 . 2 . . 229 . A 10 MK8 HB2 . 34778 1
142 . 1 . 1 10 10 MK8 HB3 H 1 2.120 0.013 . 2 . . 231 . A 10 MK8 HB3 . 34778 1
143 . 1 . 1 10 10 MK8 HD H 1 2.248 0.01 . 2 . . 242 . A 10 MK8 HD . 34778 1
144 . 1 . 1 10 10 MK8 HDA H 1 1.763 0.012 . 2 . . 243 . A 10 MK8 HDA . 34778 1
145 . 1 . 1 10 10 MK8 HE H 1 5.631 0.002 . 1 . . 5 . A 10 MK8 HE . 34778 1
146 . 1 . 1 10 10 MK8 HG H 1 1.630 0.012 . 2 . . 238 . A 10 MK8 HG . 34778 1
147 . 1 . 1 10 10 MK8 HGA H 1 1.585 0.015 . 2 . . 240 . A 10 MK8 HGA . 34778 1
148 . 1 . 1 10 10 MK8 HN H 1 8.701 0.004 . 1 . . 15 . A 10 MK8 HN . 34778 1
149 . 1 . 1 11 11 LYS H H 1 7.990 0.002 . 1 . . 19 . A 11 LYS H . 34778 1
150 . 1 . 1 11 11 LYS HA H 1 4.281 0.001 . 1 . . 206 . A 11 LYS HA . 34778 1
151 . 1 . 1 11 11 LYS HB2 H 1 1.930 0.008 . 2 . . 217 . A 11 LYS HB2 . 34778 1
152 . 1 . 1 11 11 LYS HB3 H 1 1.931 0.01 . 2 . . 219 . A 11 LYS HB3 . 34778 1
153 . 1 . 1 11 11 LYS HG2 H 1 1.624 0.002 . 2 . . 211 . A 11 LYS HG2 . 34778 1
154 . 1 . 1 11 11 LYS HG3 H 1 1.753 0.006 . 2 . . 213 . A 11 LYS HG3 . 34778 1
155 . 1 . 1 11 11 LYS HD2 H 1 1.916 0.002 . 2 . . 214 . A 11 LYS HD2 . 34778 1
156 . 1 . 1 11 11 LYS HD3 H 1 1.624 0.002 . 2 . . 216 . A 11 LYS HD3 . 34778 1
157 . 1 . 1 11 11 LYS HE2 H 1 3.177 0.003 . 2 . . 208 . A 11 LYS HE2 . 34778 1
158 . 1 . 1 11 11 LYS HE3 H 1 3.177 0.003 . 2 . . 210 . A 11 LYS HE3 . 34778 1
159 . 1 . 1 11 11 LYS CA C 13 58.745 . . 1 . . 207 . A 11 LYS CA . 34778 1
160 . 1 . 1 11 11 LYS CB C 13 32.755 . . 1 . . 218 . A 11 LYS CB . 34778 1
161 . 1 . 1 11 11 LYS CG C 13 25.536 0.009 . 1 . . 212 . A 11 LYS CG . 34778 1
162 . 1 . 1 11 11 LYS CD C 13 29.560 0.014 . 1 . . 215 . A 11 LYS CD . 34778 1
163 . 1 . 1 11 11 LYS CE C 13 42.290 . . 1 . . 209 . A 11 LYS CE . 34778 1
164 . 1 . 1 11 11 LYS N N 15 118.556 . . 1 . . 20 . A 11 LYS N . 34778 1
165 . 1 . 1 12 12 VAL H H 1 7.934 0.003 . 1 . . 29 . A 12 VAL H . 34778 1
166 . 1 . 1 12 12 VAL HA H 1 3.774 0.003 . 1 . . 52 . A 12 VAL HA . 34778 1
167 . 1 . 1 12 12 VAL HB H 1 2.462 0.005 . 1 . . 49 . A 12 VAL HB . 34778 1
168 . 1 . 1 12 12 VAL HG11 H 1 1.025 0.005 . 2 . . 45 . A 12 VAL HG11 . 34778 1
169 . 1 . 1 12 12 VAL HG12 H 1 1.025 0.005 . 2 . . 45 . A 12 VAL HG12 . 34778 1
170 . 1 . 1 12 12 VAL HG13 H 1 1.025 0.005 . 2 . . 45 . A 12 VAL HG13 . 34778 1
171 . 1 . 1 12 12 VAL HG21 H 1 1.100 0.006 . 2 . . 47 . A 12 VAL HG21 . 34778 1
172 . 1 . 1 12 12 VAL HG22 H 1 1.100 0.006 . 2 . . 47 . A 12 VAL HG22 . 34778 1
173 . 1 . 1 12 12 VAL HG23 H 1 1.100 0.006 . 2 . . 47 . A 12 VAL HG23 . 34778 1
174 . 1 . 1 12 12 VAL CA C 13 66.692 . . 1 . . 51 . A 12 VAL CA . 34778 1
175 . 1 . 1 12 12 VAL CB C 13 31.801 . . 1 . . 50 . A 12 VAL CB . 34778 1
176 . 1 . 1 12 12 VAL CG1 C 13 21.972 . . 2 . . 46 . A 12 VAL CG1 . 34778 1
177 . 1 . 1 12 12 VAL CG2 C 13 20.367 . . 2 . . 48 . A 12 VAL CG2 . 34778 1
178 . 1 . 1 12 12 VAL N N 15 120.075 . . 1 . . 30 . A 12 VAL N . 34778 1
179 . 1 . 1 13 13 ILE H H 1 7.795 0.005 . 1 . . 17 . A 13 ILE H . 34778 1
180 . 1 . 1 13 13 ILE HA H 1 3.824 0.003 . 1 . . 156 . A 13 ILE HA . 34778 1
181 . 1 . 1 13 13 ILE HB H 1 2.237 0.005 . 1 . . 154 . A 13 ILE HB . 34778 1
182 . 1 . 1 13 13 ILE HG12 H 1 1.410 0.007 . 2 . . 151 . A 13 ILE HG12 . 34778 1
183 . 1 . 1 13 13 ILE HG13 H 1 1.806 0.008 . 2 . . 153 . A 13 ILE HG13 . 34778 1
184 . 1 . 1 13 13 ILE HG21 H 1 1.051 0.003 . 1 . . 149 . A 13 ILE HG21 . 34778 1
185 . 1 . 1 13 13 ILE HG22 H 1 1.051 0.003 . 1 . . 149 . A 13 ILE HG22 . 34778 1
186 . 1 . 1 13 13 ILE HG23 H 1 1.051 0.003 . 1 . . 149 . A 13 ILE HG23 . 34778 1
187 . 1 . 1 13 13 ILE HD11 H 1 0.937 0.003 . 1 . . 138 . A 13 ILE HD11 . 34778 1
188 . 1 . 1 13 13 ILE HD12 H 1 0.937 0.003 . 1 . . 138 . A 13 ILE HD12 . 34778 1
189 . 1 . 1 13 13 ILE HD13 H 1 0.937 0.003 . 1 . . 138 . A 13 ILE HD13 . 34778 1
190 . 1 . 1 13 13 ILE CA C 13 65.418 . . 1 . . 157 . A 13 ILE CA . 34778 1
191 . 1 . 1 13 13 ILE CB C 13 36.723 . . 1 . . 155 . A 13 ILE CB . 34778 1
192 . 1 . 1 13 13 ILE CG1 C 13 28.267 0.012 . 1 . . 152 . A 13 ILE CG1 . 34778 1
193 . 1 . 1 13 13 ILE CG2 C 13 16.594 . . 1 . . 150 . A 13 ILE CG2 . 34778 1
194 . 1 . 1 13 13 ILE CD1 C 13 10.821 . . 1 . . 139 . A 13 ILE CD1 . 34778 1
195 . 1 . 1 13 13 ILE N N 15 119.152 . . 1 . . 18 . A 13 ILE N . 34778 1
196 . 1 . 1 14 14 MK8 N N 15 131.772 . . 1 . . 40 . A 14 MK8 N . 34778 1
197 . 1 . 1 14 14 MK8 CA C 13 22.608 . . 1 . . 203 . A 14 MK8 CA . 34778 1
198 . 1 . 1 14 14 MK8 CB C 13 41.659 0.005 . 1 . . 233 . A 14 MK8 CB . 34778 1
199 . 1 . 1 14 14 MK8 CD C 13 29.648 0.001 . 1 . . 245 . A 14 MK8 CD . 34778 1
200 . 1 . 1 14 14 MK8 CE C 13 132.920 . . 1 . . 2 . A 14 MK8 CE . 34778 1
201 . 1 . 1 14 14 MK8 CG C 13 26.115 0.025 . 1 . . 236 . A 14 MK8 CG . 34778 1
202 . 1 . 1 14 14 MK8 HB1 H 1 1.614 0.002 . 1 . . 202 . A 14 MK8 HB1 . 34778 1
203 . 1 . 1 14 14 MK8 HB2 H 1 2.113 0.009 . 2 . . 232 . A 14 MK8 HB2 . 34778 1
204 . 1 . 1 14 14 MK8 HB3 H 1 1.696 0.007 . 2 . . 234 . A 14 MK8 HB3 . 34778 1
205 . 1 . 1 14 14 MK8 HD H 1 1.800 0.005 . 2 . . 244 . A 14 MK8 HD . 34778 1
206 . 1 . 1 14 14 MK8 HDA H 1 2.233 0.006 . 2 . . 246 . A 14 MK8 HDA . 34778 1
207 . 1 . 1 14 14 MK8 HE H 1 5.504 0.003 . 1 . . 1 . A 14 MK8 HE . 34778 1
208 . 1 . 1 14 14 MK8 HG H 1 1.307 0.006 . 2 . . 235 . A 14 MK8 HG . 34778 1
209 . 1 . 1 14 14 MK8 HGA H 1 1.798 0.006 . 2 . . 237 . A 14 MK8 HGA . 34778 1
210 . 1 . 1 14 14 MK8 HN H 1 7.908 0.006 . 1 . . 39 . A 14 MK8 HN . 34778 1
211 . 1 . 1 15 15 GLN H H 1 7.846 0.004 . 1 . . 43 . A 15 GLN H . 34778 1
212 . 1 . 1 15 15 GLN HA H 1 4.188 0.003 . 1 . . 175 . A 15 GLN HA . 34778 1
213 . 1 . 1 15 15 GLN HB2 H 1 2.343 0.004 . 2 . . 177 . A 15 GLN HB2 . 34778 1
214 . 1 . 1 15 15 GLN HB3 H 1 2.188 0.005 . 2 . . 179 . A 15 GLN HB3 . 34778 1
215 . 1 . 1 15 15 GLN HG2 H 1 2.194 0.007 . 2 . . 181 . A 15 GLN HG2 . 34778 1
216 . 1 . 1 15 15 GLN HG3 H 1 2.019 0.006 . 2 . . 182 . A 15 GLN HG3 . 34778 1
217 . 1 . 1 15 15 GLN HE21 H 1 7.170 0.001 . 1 . . 31 . A 15 GLN HE21 . 34778 1
218 . 1 . 1 15 15 GLN HE22 H 1 6.633 0.002 . 1 . . 41 . A 15 GLN HE22 . 34778 1
219 . 1 . 1 15 15 GLN CA C 13 58.637 . . 1 . . 176 . A 15 GLN CA . 34778 1
220 . 1 . 1 15 15 GLN CB C 13 34.319 0.028 . 1 . . 178 . A 15 GLN CB . 34778 1
221 . 1 . 1 15 15 GLN CG C 13 29.335 0.023 . 1 . . 180 . A 15 GLN CG . 34778 1
222 . 1 . 1 15 15 GLN N N 15 113.918 . . 1 . . 44 . A 15 GLN N . 34778 1
223 . 1 . 1 15 15 GLN NE2 N 15 109.269 0.018 . 1 . . 32 . A 15 GLN NE2 . 34778 1
224 . 1 . 1 16 16 PHE H H 1 8.411 0.002 . 1 . . 33 . A 16 PHE H . 34778 1
225 . 1 . 1 16 16 PHE HA H 1 4.831 0.003 . 1 . . 187 . A 16 PHE HA . 34778 1
226 . 1 . 1 16 16 PHE HB2 H 1 3.490 0.004 . 2 . . 189 . A 16 PHE HB2 . 34778 1
227 . 1 . 1 16 16 PHE HB3 H 1 3.319 0.005 . 2 . . 191 . A 16 PHE HB3 . 34778 1
228 . 1 . 1 16 16 PHE HD1 H 1 7.593 0.002 . 1 . . 114 . A 16 PHE HD1 . 34778 1
229 . 1 . 1 16 16 PHE HD2 H 1 7.593 0.002 . 1 . . 114 . A 16 PHE HD2 . 34778 1
230 . 1 . 1 16 16 PHE HE1 H 1 7.460 0.003 . 1 . . 112 . A 16 PHE HE1 . 34778 1
231 . 1 . 1 16 16 PHE HE2 H 1 7.460 0.003 . 1 . . 112 . A 16 PHE HE2 . 34778 1
232 . 1 . 1 16 16 PHE HZ H 1 7.369 0.002 . 1 . . 118 . A 16 PHE HZ . 34778 1
233 . 1 . 1 16 16 PHE CA C 13 58.523 . . 1 . . 188 . A 16 PHE CA . 34778 1
234 . 1 . 1 16 16 PHE CB C 13 39.528 0.008 . 1 . . 190 . A 16 PHE CB . 34778 1
235 . 1 . 1 16 16 PHE CD1 C 13 131.580 . . 1 . . 113 . A 16 PHE CD1 . 34778 1
236 . 1 . 1 16 16 PHE CD2 C 13 131.580 . . 1 . . 113 . A 16 PHE CD2 . 34778 1
237 . 1 . 1 16 16 PHE CE1 C 13 132.062 . . 1 . . 115 . A 16 PHE CE1 . 34778 1
238 . 1 . 1 16 16 PHE CE2 C 13 132.062 . . 1 . . 115 . A 16 PHE CE2 . 34778 1
239 . 1 . 1 16 16 PHE CZ C 13 129.933 . . 1 . . 117 . A 16 PHE CZ . 34778 1
240 . 1 . 1 16 16 PHE N N 15 117.935 . . 1 . . 34 . A 16 PHE N . 34778 1
241 . 1 . 1 17 17 GLY H H 1 8.719 0.006 . 1 . . 13 . A 17 GLY H . 34778 1
242 . 1 . 1 17 17 GLY HA2 H 1 4.195 0.009 . 2 . . 184 . A 17 GLY HA2 . 34778 1
243 . 1 . 1 17 17 GLY HA3 H 1 4.026 0.005 . 2 . . 186 . A 17 GLY HA3 . 34778 1
244 . 1 . 1 17 17 GLY CA C 13 45.674 0.019 . 1 . . 185 . A 17 GLY CA . 34778 1
245 . 1 . 1 17 17 GLY N N 15 109.405 . . 1 . . 14 . A 17 GLY N . 34778 1
246 . 1 . 1 18 18 GLU H H 1 7.894 0.004 . 1 . . 27 . A 18 GLU H . 34778 1
247 . 1 . 1 18 18 GLU HA H 1 4.468 0.005 . 1 . . 192 . A 18 GLU HA . 34778 1
248 . 1 . 1 18 18 GLU HB2 H 1 2.349 0.008 . 2 . . 197 . A 18 GLU HB2 . 34778 1
249 . 1 . 1 18 18 GLU HB3 H 1 2.185 0.007 . 2 . . 199 . A 18 GLU HB3 . 34778 1
250 . 1 . 1 18 18 GLU HG2 H 1 2.602 0.002 . 2 . . 194 . A 18 GLU HG2 . 34778 1
251 . 1 . 1 18 18 GLU HG3 H 1 2.602 0.002 . 2 . . 196 . A 18 GLU HG3 . 34778 1
252 . 1 . 1 18 18 GLU CA C 13 57.008 . . 1 . . 193 . A 18 GLU CA . 34778 1
253 . 1 . 1 18 18 GLU CB C 13 29.973 0.012 . 1 . . 198 . A 18 GLU CB . 34778 1
254 . 1 . 1 18 18 GLU CG C 13 34.038 . . 1 . . 195 . A 18 GLU CG . 34778 1
255 . 1 . 1 18 18 GLU N N 15 122.986 . . 1 . . 28 . A 18 GLU N . 34778 1
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