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 34095
_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 '3D HNCACB' . . . 34095 1
2 '3D 1H-15N TOCSY' . . . 34095 1
3 '3D 1H-15N NOESY' . . . 34095 1
4 '2D 1H-1H NOESY' . . . 34095 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 9 9 SER H H 1 8.575 0.020 . 1 . . . . A 9 SER H . 34095 1
2 . 1 . 1 9 9 SER HA H 1 4.420 0.020 . 1 . . . . A 9 SER HA . 34095 1
3 . 1 . 1 9 9 SER HB2 H 1 4.791 0.020 . 2 . . . . A 9 SER HB2 . 34095 1
4 . 1 . 1 9 9 SER HB3 H 1 4.114 0.020 . 2 . . . . A 9 SER HB3 . 34095 1
5 . 1 . 1 9 9 SER CA C 13 58.592 0.400 . 1 . . . . A 9 SER CA . 34095 1
6 . 1 . 1 9 9 SER CB C 13 64.247 0.400 . 1 . . . . A 9 SER CB . 34095 1
7 . 1 . 1 9 9 SER N N 15 119.072 0.400 . 1 . . . . A 9 SER N . 34095 1
8 . 1 . 1 10 10 ILE H H 1 8.124 0.020 . 1 . . . . A 10 ILE H . 34095 1
9 . 1 . 1 10 10 ILE HA H 1 3.386 0.020 . 1 . . . . A 10 ILE HA . 34095 1
10 . 1 . 1 10 10 ILE HB H 1 1.081 0.020 . 1 . . . . A 10 ILE HB . 34095 1
11 . 1 . 1 10 10 ILE HG12 H 1 0.210 0.020 . 2 . . . . A 10 ILE HG12 . 34095 1
12 . 1 . 1 10 10 ILE HG13 H 1 0.210 0.020 . 2 . . . . A 10 ILE HG13 . 34095 1
13 . 1 . 1 10 10 ILE HG21 H 1 -0.170 0.020 . 1 . . . . A 10 ILE HG21 . 34095 1
14 . 1 . 1 10 10 ILE HG22 H 1 -0.170 0.020 . 1 . . . . A 10 ILE HG22 . 34095 1
15 . 1 . 1 10 10 ILE HG23 H 1 -0.170 0.020 . 1 . . . . A 10 ILE HG23 . 34095 1
16 . 1 . 1 10 10 ILE HD11 H 1 0.775 0.020 . 1 . . . . A 10 ILE HD11 . 34095 1
17 . 1 . 1 10 10 ILE HD12 H 1 0.775 0.020 . 1 . . . . A 10 ILE HD12 . 34095 1
18 . 1 . 1 10 10 ILE HD13 H 1 0.775 0.020 . 1 . . . . A 10 ILE HD13 . 34095 1
19 . 1 . 1 10 10 ILE CA C 13 64.927 0.400 . 1 . . . . A 10 ILE CA . 34095 1
20 . 1 . 1 10 10 ILE CB C 13 37.220 0.400 . 1 . . . . A 10 ILE CB . 34095 1
21 . 1 . 1 10 10 ILE N N 15 124.259 0.400 . 1 . . . . A 10 ILE N . 34095 1
22 . 1 . 1 11 11 VAL H H 1 7.934 0.020 . 1 . . . . A 11 VAL H . 34095 1
23 . 1 . 1 11 11 VAL HA H 1 3.600 0.020 . 1 . . . . A 11 VAL HA . 34095 1
24 . 1 . 1 11 11 VAL HB H 1 1.935 0.020 . 1 . . . . A 11 VAL HB . 34095 1
25 . 1 . 1 11 11 VAL HG11 H 1 1.068 0.020 . 2 . . . . A 11 VAL HG11 . 34095 1
26 . 1 . 1 11 11 VAL HG12 H 1 1.068 0.020 . 2 . . . . A 11 VAL HG12 . 34095 1
27 . 1 . 1 11 11 VAL HG13 H 1 1.068 0.020 . 2 . . . . A 11 VAL HG13 . 34095 1
28 . 1 . 1 11 11 VAL HG21 H 1 0.924 0.020 . 2 . . . . A 11 VAL HG21 . 34095 1
29 . 1 . 1 11 11 VAL HG22 H 1 0.924 0.020 . 2 . . . . A 11 VAL HG22 . 34095 1
30 . 1 . 1 11 11 VAL HG23 H 1 0.924 0.020 . 2 . . . . A 11 VAL HG23 . 34095 1
31 . 1 . 1 11 11 VAL CA C 13 66.495 0.400 . 1 . . . . A 11 VAL CA . 34095 1
32 . 1 . 1 11 11 VAL CB C 13 31.862 0.400 . 1 . . . . A 11 VAL CB . 34095 1
33 . 1 . 1 11 11 VAL N N 15 119.861 0.400 . 1 . . . . A 11 VAL N . 34095 1
34 . 1 . 1 12 12 SER H H 1 7.742 0.020 . 1 . . . . A 12 SER H . 34095 1
35 . 1 . 1 12 12 SER HA H 1 4.237 0.020 . 1 . . . . A 12 SER HA . 34095 1
36 . 1 . 1 12 12 SER HB2 H 1 3.848 0.020 . 2 . . . . A 12 SER HB2 . 34095 1
37 . 1 . 1 12 12 SER HB3 H 1 3.848 0.020 . 2 . . . . A 12 SER HB3 . 34095 1
38 . 1 . 1 12 12 SER CA C 13 61.037 0.400 . 1 . . . . A 12 SER CA . 34095 1
39 . 1 . 1 12 12 SER CB C 13 62.313 0.400 . 1 . . . . A 12 SER CB . 34095 1
40 . 1 . 1 12 12 SER N N 15 116.725 0.400 . 1 . . . . A 12 SER N . 34095 1
41 . 1 . 1 13 13 PHE H H 1 7.674 0.020 . 1 . . . . A 13 PHE H . 34095 1
42 . 1 . 1 13 13 PHE HA H 1 4.385 0.020 . 1 . . . . A 13 PHE HA . 34095 1
43 . 1 . 1 13 13 PHE HB2 H 1 3.087 0.020 . 2 . . . . A 13 PHE HB2 . 34095 1
44 . 1 . 1 13 13 PHE HB3 H 1 2.868 0.020 . 2 . . . . A 13 PHE HB3 . 34095 1
45 . 1 . 1 13 13 PHE HD1 H 1 6.927 0.020 . 1 . . . . A 13 PHE HD1 . 34095 1
46 . 1 . 1 13 13 PHE HD2 H 1 6.927 0.020 . 1 . . . . A 13 PHE HD2 . 34095 1
47 . 1 . 1 13 13 PHE HE1 H 1 6.997 0.020 . 1 . . . . A 13 PHE HE1 . 34095 1
48 . 1 . 1 13 13 PHE HE2 H 1 6.997 0.020 . 1 . . . . A 13 PHE HE2 . 34095 1
49 . 1 . 1 13 13 PHE CA C 13 59.420 0.400 . 1 . . . . A 13 PHE CA . 34095 1
50 . 1 . 1 13 13 PHE CB C 13 40.082 0.400 . 1 . . . . A 13 PHE CB . 34095 1
51 . 1 . 1 13 13 PHE N N 15 124.249 0.400 . 1 . . . . A 13 PHE N . 34095 1
52 . 1 . 1 14 14 PHE H H 1 8.920 0.020 . 1 . . . . A 14 PHE H . 34095 1
53 . 1 . 1 14 14 PHE HA H 1 4.077 0.020 . 1 . . . . A 14 PHE HA . 34095 1
54 . 1 . 1 14 14 PHE HB2 H 1 3.135 0.020 . 2 . . . . A 14 PHE HB2 . 34095 1
55 . 1 . 1 14 14 PHE HB3 H 1 2.521 0.020 . 2 . . . . A 14 PHE HB3 . 34095 1
56 . 1 . 1 14 14 PHE HD1 H 1 6.680 0.020 . 1 . . . . A 14 PHE HD1 . 34095 1
57 . 1 . 1 14 14 PHE HD2 H 1 6.680 0.020 . 1 . . . . A 14 PHE HD2 . 34095 1
58 . 1 . 1 14 14 PHE HE1 H 1 6.770 0.020 . 1 . . . . A 14 PHE HE1 . 34095 1
59 . 1 . 1 14 14 PHE HE2 H 1 6.770 0.020 . 1 . . . . A 14 PHE HE2 . 34095 1
60 . 1 . 1 14 14 PHE HZ H 1 5.817 0.020 . 1 . . . . A 14 PHE HZ . 34095 1
61 . 1 . 1 14 14 PHE CA C 13 58.055 0.400 . 1 . . . . A 14 PHE CA . 34095 1
62 . 1 . 1 14 14 PHE CB C 13 35.756 0.400 . 1 . . . . A 14 PHE CB . 34095 1
63 . 1 . 1 14 14 PHE N N 15 116.071 0.400 . 1 . . . . A 14 PHE N . 34095 1
64 . 1 . 1 15 15 ALA H H 1 7.875 0.020 . 1 . . . . A 15 ALA H . 34095 1
65 . 1 . 1 15 15 ALA HA H 1 4.216 0.020 . 1 . . . . A 15 ALA HA . 34095 1
66 . 1 . 1 15 15 ALA HB1 H 1 1.538 0.020 . 1 . . . . A 15 ALA HB1 . 34095 1
67 . 1 . 1 15 15 ALA HB2 H 1 1.538 0.020 . 1 . . . . A 15 ALA HB2 . 34095 1
68 . 1 . 1 15 15 ALA HB3 H 1 1.538 0.020 . 1 . . . . A 15 ALA HB3 . 34095 1
69 . 1 . 1 15 15 ALA CA C 13 55.274 0.400 . 1 . . . . A 15 ALA CA . 34095 1
70 . 1 . 1 15 15 ALA CB C 13 17.613 0.400 . 1 . . . . A 15 ALA CB . 34095 1
71 . 1 . 1 15 15 ALA N N 15 123.039 0.400 . 1 . . . . A 15 ALA N . 34095 1
72 . 1 . 1 16 16 ARG H H 1 7.724 0.020 . 1 . . . . A 16 ARG H . 34095 1
73 . 1 . 1 16 16 ARG HA H 1 4.145 0.020 . 1 . . . . A 16 ARG HA . 34095 1
74 . 1 . 1 16 16 ARG HB2 H 1 2.012 0.020 . 2 . . . . A 16 ARG HB2 . 34095 1
75 . 1 . 1 16 16 ARG HB3 H 1 1.942 0.020 . 2 . . . . A 16 ARG HB3 . 34095 1
76 . 1 . 1 16 16 ARG HG2 H 1 1.785 0.020 . 2 . . . . A 16 ARG HG2 . 34095 1
77 . 1 . 1 16 16 ARG HG3 H 1 1.688 0.020 . 2 . . . . A 16 ARG HG3 . 34095 1
78 . 1 . 1 16 16 ARG HD2 H 1 3.255 0.020 . 2 . . . . A 16 ARG HD2 . 34095 1
79 . 1 . 1 16 16 ARG HD3 H 1 3.255 0.020 . 2 . . . . A 16 ARG HD3 . 34095 1
80 . 1 . 1 16 16 ARG CA C 13 58.988 0.400 . 1 . . . . A 16 ARG CA . 34095 1
81 . 1 . 1 16 16 ARG CB C 13 29.887 0.400 . 1 . . . . A 16 ARG CB . 34095 1
82 . 1 . 1 16 16 ARG N N 15 118.678 0.400 . 1 . . . . A 16 ARG N . 34095 1
83 . 1 . 1 17 17 LEU H H 1 7.423 0.020 . 1 . . . . A 17 LEU H . 34095 1
84 . 1 . 1 17 17 LEU HA H 1 4.175 0.020 . 1 . . . . A 17 LEU HA . 34095 1
85 . 1 . 1 17 17 LEU HB2 H 1 1.512 0.020 . 2 . . . . A 17 LEU HB2 . 34095 1
86 . 1 . 1 17 17 LEU HB3 H 1 1.512 0.020 . 2 . . . . A 17 LEU HB3 . 34095 1
87 . 1 . 1 17 17 LEU HG H 1 1.370 0.020 . 1 . . . . A 17 LEU HG . 34095 1
88 . 1 . 1 17 17 LEU HD11 H 1 0.606 0.020 . 2 . . . . A 17 LEU HD11 . 34095 1
89 . 1 . 1 17 17 LEU HD12 H 1 0.606 0.020 . 2 . . . . A 17 LEU HD12 . 34095 1
90 . 1 . 1 17 17 LEU HD13 H 1 0.606 0.020 . 2 . . . . A 17 LEU HD13 . 34095 1
91 . 1 . 1 17 17 LEU HD21 H 1 0.155 0.020 . 2 . . . . A 17 LEU HD21 . 34095 1
92 . 1 . 1 17 17 LEU HD22 H 1 0.155 0.020 . 2 . . . . A 17 LEU HD22 . 34095 1
93 . 1 . 1 17 17 LEU HD23 H 1 0.155 0.020 . 2 . . . . A 17 LEU HD23 . 34095 1
94 . 1 . 1 17 17 LEU CA C 13 55.003 0.400 . 1 . . . . A 17 LEU CA . 34095 1
95 . 1 . 1 17 17 LEU CB C 13 43.647 0.400 . 1 . . . . A 17 LEU CB . 34095 1
96 . 1 . 1 17 17 LEU N N 15 116.332 0.400 . 1 . . . . A 17 LEU N . 34095 1
97 . 1 . 1 18 18 GLY H H 1 7.723 0.020 . 1 . . . . A 18 GLY H . 34095 1
98 . 1 . 1 18 18 GLY HA2 H 1 4.046 0.020 . 2 . . . . A 18 GLY HA2 . 34095 1
99 . 1 . 1 18 18 GLY HA3 H 1 4.194 0.020 . 2 . . . . A 18 GLY HA3 . 34095 1
100 . 1 . 1 18 18 GLY CA C 13 46.271 0.400 . 1 . . . . A 18 GLY CA . 34095 1
101 . 1 . 1 18 18 GLY N N 15 106.933 0.400 . 1 . . . . A 18 GLY N . 34095 1
102 . 1 . 1 19 19 CYS H H 1 8.244 0.020 . 1 . . . . A 19 CYS H . 34095 1
103 . 1 . 1 19 19 CYS HA H 1 4.639 0.020 . 1 . . . . A 19 CYS HA . 34095 1
104 . 1 . 1 19 19 CYS HB2 H 1 2.171 0.020 . 2 . . . . A 19 CYS HB2 . 34095 1
105 . 1 . 1 19 19 CYS HB3 H 1 2.171 0.020 . 2 . . . . A 19 CYS HB3 . 34095 1
106 . 1 . 1 19 19 CYS CA C 13 56.387 0.400 . 1 . . . . A 19 CYS CA . 34095 1
107 . 1 . 1 19 19 CYS CB C 13 28.399 0.400 . 1 . . . . A 19 CYS CB . 34095 1
108 . 1 . 1 19 19 CYS N N 15 114.893 0.400 . 1 . . . . A 19 CYS N . 34095 1
109 . 1 . 1 21 21 SER H H 1 7.689 0.020 . 1 . . . . A 21 SER H . 34095 1
110 . 1 . 1 21 21 SER CA C 13 60.752 0.400 . 1 . . . . A 21 SER CA . 34095 1
111 . 1 . 1 21 21 SER CB C 13 62.401 0.400 . 1 . . . . A 21 SER CB . 34095 1
112 . 1 . 1 21 21 SER N N 15 115.848 0.400 . 1 . . . . A 21 SER N . 34095 1
113 . 1 . 1 22 22 CYS H H 1 7.860 0.020 . 1 . . . . A 22 CYS H . 34095 1
114 . 1 . 1 22 22 CYS HA H 1 4.813 0.020 . 1 . . . . A 22 CYS HA . 34095 1
115 . 1 . 1 22 22 CYS HB2 H 1 2.913 0.020 . 2 . . . . A 22 CYS HB2 . 34095 1
116 . 1 . 1 22 22 CYS HB3 H 1 2.753 0.020 . 2 . . . . A 22 CYS HB3 . 34095 1
117 . 1 . 1 22 22 CYS CA C 13 59.582 0.400 . 1 . . . . A 22 CYS CA . 34095 1
118 . 1 . 1 22 22 CYS CB C 13 28.376 0.400 . 1 . . . . A 22 CYS CB . 34095 1
119 . 1 . 1 22 22 CYS N N 15 117.271 0.400 . 1 . . . . A 22 CYS N . 34095 1
120 . 1 . 1 23 23 LEU H H 1 7.765 0.020 . 1 . . . . A 23 LEU H . 34095 1
121 . 1 . 1 23 23 LEU HA H 1 4.112 0.020 . 1 . . . . A 23 LEU HA . 34095 1
122 . 1 . 1 23 23 LEU HB2 H 1 1.832 0.020 . 2 . . . . A 23 LEU HB2 . 34095 1
123 . 1 . 1 23 23 LEU HB3 H 1 1.832 0.020 . 2 . . . . A 23 LEU HB3 . 34095 1
124 . 1 . 1 23 23 LEU HG H 1 1.920 0.020 . 1 . . . . A 23 LEU HG . 34095 1
125 . 1 . 1 23 23 LEU HD11 H 1 0.901 0.020 . 2 . . . . A 23 LEU HD11 . 34095 1
126 . 1 . 1 23 23 LEU HD12 H 1 0.901 0.020 . 2 . . . . A 23 LEU HD12 . 34095 1
127 . 1 . 1 23 23 LEU HD13 H 1 0.901 0.020 . 2 . . . . A 23 LEU HD13 . 34095 1
128 . 1 . 1 23 23 LEU HD21 H 1 0.901 0.020 . 2 . . . . A 23 LEU HD21 . 34095 1
129 . 1 . 1 23 23 LEU HD22 H 1 0.901 0.020 . 2 . . . . A 23 LEU HD22 . 34095 1
130 . 1 . 1 23 23 LEU HD23 H 1 0.901 0.020 . 2 . . . . A 23 LEU HD23 . 34095 1
131 . 1 . 1 23 23 LEU CA C 13 59.527 0.400 . 1 . . . . A 23 LEU CA . 34095 1
132 . 1 . 1 23 23 LEU CB C 13 43.102 0.400 . 1 . . . . A 23 LEU CB . 34095 1
133 . 1 . 1 23 23 LEU N N 15 122.223 0.400 . 1 . . . . A 23 LEU N . 34095 1
134 . 1 . 1 24 24 ASP H H 1 8.878 0.020 . 1 . . . . A 24 ASP H . 34095 1
135 . 1 . 1 24 24 ASP HA H 1 4.605 0.020 . 1 . . . . A 24 ASP HA . 34095 1
136 . 1 . 1 24 24 ASP HB2 H 1 2.481 0.020 . 2 . . . . A 24 ASP HB2 . 34095 1
137 . 1 . 1 24 24 ASP HB3 H 1 2.481 0.020 . 2 . . . . A 24 ASP HB3 . 34095 1
138 . 1 . 1 24 24 ASP CA C 13 57.227 0.400 . 1 . . . . A 24 ASP CA . 34095 1
139 . 1 . 1 24 24 ASP CB C 13 39.963 0.400 . 1 . . . . A 24 ASP CB . 34095 1
140 . 1 . 1 24 24 ASP N N 15 117.190 0.400 . 1 . . . . A 24 ASP N . 34095 1
141 . 1 . 1 25 25 TYR H H 1 7.497 0.020 . 1 . . . . A 25 TYR H . 34095 1
142 . 1 . 1 25 25 TYR HA H 1 4.137 0.020 . 1 . . . . A 25 TYR HA . 34095 1
143 . 1 . 1 25 25 TYR HB2 H 1 2.928 0.020 . 2 . . . . A 25 TYR HB2 . 34095 1
144 . 1 . 1 25 25 TYR HB3 H 1 2.833 0.020 . 2 . . . . A 25 TYR HB3 . 34095 1
145 . 1 . 1 25 25 TYR HD1 H 1 7.300 0.020 . 1 . . . . A 25 TYR HD1 . 34095 1
146 . 1 . 1 25 25 TYR HD2 H 1 7.300 0.020 . 1 . . . . A 25 TYR HD2 . 34095 1
147 . 1 . 1 25 25 TYR HE1 H 1 6.896 0.020 . 1 . . . . A 25 TYR HE1 . 34095 1
148 . 1 . 1 25 25 TYR HE2 H 1 6.896 0.020 . 1 . . . . A 25 TYR HE2 . 34095 1
149 . 1 . 1 25 25 TYR CA C 13 61.020 0.400 . 1 . . . . A 25 TYR CA . 34095 1
150 . 1 . 1 25 25 TYR CB C 13 38.399 0.400 . 1 . . . . A 25 TYR CB . 34095 1
151 . 1 . 1 25 25 TYR N N 15 116.565 0.400 . 1 . . . . A 25 TYR N . 34095 1
152 . 1 . 1 26 26 PHE H H 1 8.034 0.020 . 1 . . . . A 26 PHE H . 34095 1
153 . 1 . 1 26 26 PHE HA H 1 4.332 0.020 . 1 . . . . A 26 PHE HA . 34095 1
154 . 1 . 1 26 26 PHE HB2 H 1 3.236 0.020 . 2 . . . . A 26 PHE HB2 . 34095 1
155 . 1 . 1 26 26 PHE HB3 H 1 3.236 0.020 . 2 . . . . A 26 PHE HB3 . 34095 1
156 . 1 . 1 26 26 PHE HD1 H 1 7.531 0.020 . 1 . . . . A 26 PHE HD1 . 34095 1
157 . 1 . 1 26 26 PHE HD2 H 1 7.531 0.020 . 1 . . . . A 26 PHE HD2 . 34095 1
158 . 1 . 1 26 26 PHE HE1 H 1 7.205 0.020 . 1 . . . . A 26 PHE HE1 . 34095 1
159 . 1 . 1 26 26 PHE HE2 H 1 7.205 0.020 . 1 . . . . A 26 PHE HE2 . 34095 1
160 . 1 . 1 26 26 PHE HZ H 1 7.270 0.020 . 1 . . . . A 26 PHE HZ . 34095 1
161 . 1 . 1 26 26 PHE CA C 13 60.731 0.400 . 1 . . . . A 26 PHE CA . 34095 1
162 . 1 . 1 26 26 PHE CB C 13 38.753 0.400 . 1 . . . . A 26 PHE CB . 34095 1
163 . 1 . 1 26 26 PHE N N 15 114.431 0.400 . 1 . . . . A 26 PHE N . 34095 1
164 . 1 . 1 27 27 THR H H 1 8.813 0.020 . 1 . . . . A 27 THR H . 34095 1
165 . 1 . 1 27 27 THR HA H 1 3.940 0.020 . 1 . . . . A 27 THR HA . 34095 1
166 . 1 . 1 27 27 THR HB H 1 4.270 0.020 . 1 . . . . A 27 THR HB . 34095 1
167 . 1 . 1 27 27 THR HG21 H 1 1.276 0.020 . 1 . . . . A 27 THR HG21 . 34095 1
168 . 1 . 1 27 27 THR HG22 H 1 1.276 0.020 . 1 . . . . A 27 THR HG22 . 34095 1
169 . 1 . 1 27 27 THR HG23 H 1 1.276 0.020 . 1 . . . . A 27 THR HG23 . 34095 1
170 . 1 . 1 27 27 THR CA C 13 66.239 0.400 . 1 . . . . A 27 THR CA . 34095 1
171 . 1 . 1 27 27 THR CB C 13 68.019 0.400 . 1 . . . . A 27 THR CB . 34095 1
172 . 1 . 1 27 27 THR N N 15 115.258 0.400 . 1 . . . . A 27 THR N . 34095 1
173 . 1 . 1 28 28 THR H H 1 8.087 0.020 . 1 . . . . A 28 THR H . 34095 1
174 . 1 . 1 28 28 THR HA H 1 4.153 0.020 . 1 . . . . A 28 THR HA . 34095 1
175 . 1 . 1 28 28 THR HB H 1 4.267 0.020 . 1 . . . . A 28 THR HB . 34095 1
176 . 1 . 1 28 28 THR HG21 H 1 1.324 0.020 . 1 . . . . A 28 THR HG21 . 34095 1
177 . 1 . 1 28 28 THR HG22 H 1 1.324 0.020 . 1 . . . . A 28 THR HG22 . 34095 1
178 . 1 . 1 28 28 THR HG23 H 1 1.324 0.020 . 1 . . . . A 28 THR HG23 . 34095 1
179 . 1 . 1 28 28 THR CA C 13 65.068 0.400 . 1 . . . . A 28 THR CA . 34095 1
180 . 1 . 1 28 28 THR CB C 13 69.253 0.400 . 1 . . . . A 28 THR CB . 34095 1
181 . 1 . 1 28 28 THR N N 15 115.127 0.400 . 1 . . . . A 28 THR N . 34095 1
182 . 1 . 1 29 29 GLN H H 1 7.158 0.020 . 1 . . . . A 29 GLN H . 34095 1
183 . 1 . 1 29 29 GLN HA H 1 4.535 0.020 . 1 . . . . A 29 GLN HA . 34095 1
184 . 1 . 1 29 29 GLN HB2 H 1 2.356 0.020 . 2 . . . . A 29 GLN HB2 . 34095 1
185 . 1 . 1 29 29 GLN HB3 H 1 1.942 0.020 . 2 . . . . A 29 GLN HB3 . 34095 1
186 . 1 . 1 29 29 GLN HG2 H 1 2.490 0.020 . 2 . . . . A 29 GLN HG2 . 34095 1
187 . 1 . 1 29 29 GLN HG3 H 1 2.490 0.020 . 2 . . . . A 29 GLN HG3 . 34095 1
188 . 1 . 1 29 29 GLN CA C 13 54.444 0.400 . 1 . . . . A 29 GLN CA . 34095 1
189 . 1 . 1 29 29 GLN CB C 13 28.827 0.400 . 1 . . . . A 29 GLN CB . 34095 1
190 . 1 . 1 29 29 GLN N N 15 117.582 0.400 . 1 . . . . A 29 GLN N . 34095 1
191 . 1 . 1 30 30 GLY H H 1 7.899 0.020 . 1 . . . . A 30 GLY H . 34095 1
192 . 1 . 1 30 30 GLY HA2 H 1 3.788 0.020 . 2 . . . . A 30 GLY HA2 . 34095 1
193 . 1 . 1 30 30 GLY HA3 H 1 4.146 0.020 . 2 . . . . A 30 GLY HA3 . 34095 1
194 . 1 . 1 30 30 GLY CA C 13 45.831 0.400 . 1 . . . . A 30 GLY CA . 34095 1
195 . 1 . 1 30 30 GLY N N 15 107.106 0.400 . 1 . . . . A 30 GLY N . 34095 1
196 . 1 . 1 31 31 LEU H H 1 7.571 0.020 . 1 . . . . A 31 LEU H . 34095 1
197 . 1 . 1 31 31 LEU HA H 1 4.527 0.020 . 1 . . . . A 31 LEU HA . 34095 1
198 . 1 . 1 31 31 LEU HB2 H 1 2.059 0.020 . 2 . . . . A 31 LEU HB2 . 34095 1
199 . 1 . 1 31 31 LEU HB3 H 1 2.059 0.020 . 2 . . . . A 31 LEU HB3 . 34095 1
200 . 1 . 1 31 31 LEU HG H 1 1.051 0.020 . 1 . . . . A 31 LEU HG . 34095 1
201 . 1 . 1 31 31 LEU HD11 H 1 1.593 0.020 . 2 . . . . A 31 LEU HD11 . 34095 1
202 . 1 . 1 31 31 LEU HD12 H 1 1.593 0.020 . 2 . . . . A 31 LEU HD12 . 34095 1
203 . 1 . 1 31 31 LEU HD13 H 1 1.593 0.020 . 2 . . . . A 31 LEU HD13 . 34095 1
204 . 1 . 1 31 31 LEU HD21 H 1 0.857 0.020 . 2 . . . . A 31 LEU HD21 . 34095 1
205 . 1 . 1 31 31 LEU HD22 H 1 0.857 0.020 . 2 . . . . A 31 LEU HD22 . 34095 1
206 . 1 . 1 31 31 LEU HD23 H 1 0.857 0.020 . 2 . . . . A 31 LEU HD23 . 34095 1
207 . 1 . 1 31 31 LEU CA C 13 53.859 0.400 . 1 . . . . A 31 LEU CA . 34095 1
208 . 1 . 1 31 31 LEU CB C 13 41.661 0.400 . 1 . . . . A 31 LEU CB . 34095 1
209 . 1 . 1 31 31 LEU N N 15 122.128 0.400 . 1 . . . . A 31 LEU N . 34095 1
210 . 1 . 1 32 32 THR H H 1 9.217 0.020 . 1 . . . . A 32 THR H . 34095 1
211 . 1 . 1 32 32 THR HA H 1 4.519 0.020 . 1 . . . . A 32 THR HA . 34095 1
212 . 1 . 1 32 32 THR HB H 1 4.312 0.020 . 1 . . . . A 32 THR HB . 34095 1
213 . 1 . 1 32 32 THR HG21 H 1 1.087 0.020 . 1 . . . . A 32 THR HG21 . 34095 1
214 . 1 . 1 32 32 THR HG22 H 1 1.087 0.020 . 1 . . . . A 32 THR HG22 . 34095 1
215 . 1 . 1 32 32 THR HG23 H 1 1.087 0.020 . 1 . . . . A 32 THR HG23 . 34095 1
216 . 1 . 1 32 32 THR CA C 13 61.754 0.400 . 1 . . . . A 32 THR CA . 34095 1
217 . 1 . 1 32 32 THR CB C 13 71.245 0.400 . 1 . . . . A 32 THR CB . 34095 1
218 . 1 . 1 32 32 THR N N 15 109.962 0.400 . 1 . . . . A 32 THR N . 34095 1
219 . 1 . 1 33 33 THR H H 1 8.410 0.020 . 1 . . . . A 33 THR H . 34095 1
220 . 1 . 1 33 33 THR HA H 1 5.081 0.020 . 1 . . . . A 33 THR HA . 34095 1
221 . 1 . 1 33 33 THR HB H 1 4.244 0.020 . 1 . . . . A 33 THR HB . 34095 1
222 . 1 . 1 33 33 THR HG21 H 1 1.186 0.020 . 1 . . . . A 33 THR HG21 . 34095 1
223 . 1 . 1 33 33 THR HG22 H 1 1.186 0.020 . 1 . . . . A 33 THR HG22 . 34095 1
224 . 1 . 1 33 33 THR HG23 H 1 1.186 0.020 . 1 . . . . A 33 THR HG23 . 34095 1
225 . 1 . 1 33 33 THR CA C 13 59.845 0.400 . 1 . . . . A 33 THR CA . 34095 1
226 . 1 . 1 33 33 THR CB C 13 72.728 0.400 . 1 . . . . A 33 THR CB . 34095 1
227 . 1 . 1 33 33 THR N N 15 116.291 0.400 . 1 . . . . A 33 THR N . 34095 1
228 . 1 . 1 34 34 ILE H H 1 8.380 0.020 . 1 . . . . A 34 ILE H . 34095 1
229 . 1 . 1 34 34 ILE HA H 1 3.182 0.020 . 1 . . . . A 34 ILE HA . 34095 1
230 . 1 . 1 34 34 ILE HB H 1 0.817 0.020 . 1 . . . . A 34 ILE HB . 34095 1
231 . 1 . 1 34 34 ILE HG12 H 1 2.849 0.020 . 2 . . . . A 34 ILE HG12 . 34095 1
232 . 1 . 1 34 34 ILE HG13 H 1 0.492 0.020 . 2 . . . . A 34 ILE HG13 . 34095 1
233 . 1 . 1 34 34 ILE HG21 H 1 -0.115 0.020 . 1 . . . . A 34 ILE HG21 . 34095 1
234 . 1 . 1 34 34 ILE HG22 H 1 -0.115 0.020 . 1 . . . . A 34 ILE HG22 . 34095 1
235 . 1 . 1 34 34 ILE HG23 H 1 -0.115 0.020 . 1 . . . . A 34 ILE HG23 . 34095 1
236 . 1 . 1 34 34 ILE HD11 H 1 -0.260 0.020 . 1 . . . . A 34 ILE HD11 . 34095 1
237 . 1 . 1 34 34 ILE HD12 H 1 -0.260 0.020 . 1 . . . . A 34 ILE HD12 . 34095 1
238 . 1 . 1 34 34 ILE HD13 H 1 -0.260 0.020 . 1 . . . . A 34 ILE HD13 . 34095 1
239 . 1 . 1 34 34 ILE CA C 13 62.860 0.400 . 1 . . . . A 34 ILE CA . 34095 1
240 . 1 . 1 34 34 ILE CB C 13 38.043 0.400 . 1 . . . . A 34 ILE CB . 34095 1
241 . 1 . 1 34 34 ILE N N 15 119.031 0.400 . 1 . . . . A 34 ILE N . 34095 1
242 . 1 . 1 35 35 TYR H H 1 6.999 0.020 . 1 . . . . A 35 TYR H . 34095 1
243 . 1 . 1 35 35 TYR HA H 1 4.224 0.020 . 1 . . . . A 35 TYR HA . 34095 1
244 . 1 . 1 35 35 TYR HB2 H 1 3.161 0.020 . 2 . . . . A 35 TYR HB2 . 34095 1
245 . 1 . 1 35 35 TYR HB3 H 1 2.804 0.020 . 2 . . . . A 35 TYR HB3 . 34095 1
246 . 1 . 1 35 35 TYR HD1 H 1 7.149 0.020 . 1 . . . . A 35 TYR HD1 . 34095 1
247 . 1 . 1 35 35 TYR HD2 H 1 7.149 0.020 . 1 . . . . A 35 TYR HD2 . 34095 1
248 . 1 . 1 35 35 TYR HE1 H 1 6.874 0.020 . 1 . . . . A 35 TYR HE1 . 34095 1
249 . 1 . 1 35 35 TYR HE2 H 1 6.874 0.020 . 1 . . . . A 35 TYR HE2 . 34095 1
250 . 1 . 1 35 35 TYR CA C 13 59.739 0.400 . 1 . . . . A 35 TYR CA . 34095 1
251 . 1 . 1 35 35 TYR CB C 13 37.443 0.400 . 1 . . . . A 35 TYR CB . 34095 1
252 . 1 . 1 35 35 TYR N N 15 117.284 0.400 . 1 . . . . A 35 TYR N . 34095 1
253 . 1 . 1 36 36 GLN H H 1 7.320 0.020 . 1 . . . . A 36 GLN H . 34095 1
254 . 1 . 1 36 36 GLN HA H 1 4.171 0.020 . 1 . . . . A 36 GLN HA . 34095 1
255 . 1 . 1 36 36 GLN HB2 H 1 2.363 0.020 . 2 . . . . A 36 GLN HB2 . 34095 1
256 . 1 . 1 36 36 GLN HB3 H 1 2.363 0.020 . 2 . . . . A 36 GLN HB3 . 34095 1
257 . 1 . 1 36 36 GLN HG2 H 1 2.477 0.020 . 2 . . . . A 36 GLN HG2 . 34095 1
258 . 1 . 1 36 36 GLN HG3 H 1 2.189 0.020 . 2 . . . . A 36 GLN HG3 . 34095 1
259 . 1 . 1 36 36 GLN CA C 13 57.915 0.400 . 1 . . . . A 36 GLN CA . 34095 1
260 . 1 . 1 36 36 GLN CB C 13 31.508 0.400 . 1 . . . . A 36 GLN CB . 34095 1
261 . 1 . 1 36 36 GLN N N 15 114.487 0.400 . 1 . . . . A 36 GLN N . 34095 1
262 . 1 . 1 37 37 ILE H H 1 7.111 0.020 . 1 . . . . A 37 ILE H . 34095 1
263 . 1 . 1 37 37 ILE HA H 1 4.149 0.020 . 1 . . . . A 37 ILE HA . 34095 1
264 . 1 . 1 37 37 ILE HB H 1 1.564 0.020 . 1 . . . . A 37 ILE HB . 34095 1
265 . 1 . 1 37 37 ILE HG12 H 1 0.970 0.020 . 2 . . . . A 37 ILE HG12 . 34095 1
266 . 1 . 1 37 37 ILE HG13 H 1 0.852 0.020 . 2 . . . . A 37 ILE HG13 . 34095 1
267 . 1 . 1 37 37 ILE HG21 H 1 0.545 0.020 . 1 . . . . A 37 ILE HG21 . 34095 1
268 . 1 . 1 37 37 ILE HG22 H 1 0.545 0.020 . 1 . . . . A 37 ILE HG22 . 34095 1
269 . 1 . 1 37 37 ILE HG23 H 1 0.545 0.020 . 1 . . . . A 37 ILE HG23 . 34095 1
270 . 1 . 1 37 37 ILE HD11 H 1 0.421 0.020 . 1 . . . . A 37 ILE HD11 . 34095 1
271 . 1 . 1 37 37 ILE HD12 H 1 0.421 0.020 . 1 . . . . A 37 ILE HD12 . 34095 1
272 . 1 . 1 37 37 ILE HD13 H 1 0.421 0.020 . 1 . . . . A 37 ILE HD13 . 34095 1
273 . 1 . 1 37 37 ILE CA C 13 60.188 0.400 . 1 . . . . A 37 ILE CA . 34095 1
274 . 1 . 1 37 37 ILE CB C 13 39.234 0.400 . 1 . . . . A 37 ILE CB . 34095 1
275 . 1 . 1 37 37 ILE N N 15 107.441 0.400 . 1 . . . . A 37 ILE N . 34095 1
276 . 1 . 1 38 38 GLU H H 1 7.176 0.020 . 1 . . . . A 38 GLU H . 34095 1
277 . 1 . 1 38 38 GLU HA H 1 3.891 0.020 . 1 . . . . A 38 GLU HA . 34095 1
278 . 1 . 1 38 38 GLU HB2 H 1 2.098 0.020 . 2 . . . . A 38 GLU HB2 . 34095 1
279 . 1 . 1 38 38 GLU HB3 H 1 1.919 0.020 . 2 . . . . A 38 GLU HB3 . 34095 1
280 . 1 . 1 38 38 GLU HG2 H 1 2.349 0.020 . 2 . . . . A 38 GLU HG2 . 34095 1
281 . 1 . 1 38 38 GLU HG3 H 1 2.349 0.020 . 2 . . . . A 38 GLU HG3 . 34095 1
282 . 1 . 1 38 38 GLU CA C 13 58.794 0.400 . 1 . . . . A 38 GLU CA . 34095 1
283 . 1 . 1 38 38 GLU CB C 13 29.402 0.400 . 1 . . . . A 38 GLU CB . 34095 1
284 . 1 . 1 38 38 GLU N N 15 120.002 0.400 . 1 . . . . A 38 GLU N . 34095 1
285 . 1 . 1 39 39 HIS H H 1 8.406 0.020 . 1 . . . . A 39 HIS H . 34095 1
286 . 1 . 1 39 39 HIS HA H 1 4.814 0.020 . 1 . . . . A 39 HIS HA . 34095 1
287 . 1 . 1 39 39 HIS HB2 H 1 3.189 0.020 . 2 . . . . A 39 HIS HB2 . 34095 1
288 . 1 . 1 39 39 HIS HB3 H 1 3.189 0.020 . 2 . . . . A 39 HIS HB3 . 34095 1
289 . 1 . 1 39 39 HIS HD2 H 1 7.114 0.020 . 1 . . . . A 39 HIS HD2 . 34095 1
290 . 1 . 1 39 39 HIS HE1 H 1 7.429 0.020 . 1 . . . . A 39 HIS HE1 . 34095 1
291 . 1 . 1 39 39 HIS CA C 13 55.825 0.400 . 1 . . . . A 39 HIS CA . 34095 1
292 . 1 . 1 39 39 HIS CB C 13 30.234 0.400 . 1 . . . . A 39 HIS CB . 34095 1
293 . 1 . 1 39 39 HIS N N 15 115.724 0.400 . 1 . . . . A 39 HIS N . 34095 1
294 . 1 . 1 40 40 TYR H H 1 7.879 0.020 . 1 . . . . A 40 TYR H . 34095 1
295 . 1 . 1 40 40 TYR HA H 1 4.662 0.020 . 1 . . . . A 40 TYR HA . 34095 1
296 . 1 . 1 40 40 TYR HB2 H 1 3.603 0.020 . 2 . . . . A 40 TYR HB2 . 34095 1
297 . 1 . 1 40 40 TYR HB3 H 1 2.999 0.020 . 2 . . . . A 40 TYR HB3 . 34095 1
298 . 1 . 1 40 40 TYR HD1 H 1 6.646 0.020 . 1 . . . . A 40 TYR HD1 . 34095 1
299 . 1 . 1 40 40 TYR HD2 H 1 6.646 0.020 . 1 . . . . A 40 TYR HD2 . 34095 1
300 . 1 . 1 40 40 TYR HE1 H 1 6.787 0.020 . 1 . . . . A 40 TYR HE1 . 34095 1
301 . 1 . 1 40 40 TYR HE2 H 1 6.787 0.020 . 1 . . . . A 40 TYR HE2 . 34095 1
302 . 1 . 1 40 40 TYR CA C 13 57.750 0.400 . 1 . . . . A 40 TYR CA . 34095 1
303 . 1 . 1 40 40 TYR CB C 13 37.860 0.400 . 1 . . . . A 40 TYR CB . 34095 1
304 . 1 . 1 40 40 TYR N N 15 124.363 0.400 . 1 . . . . A 40 TYR N . 34095 1
305 . 1 . 1 41 41 SER H H 1 9.536 0.020 . 1 . . . . A 41 SER H . 34095 1
306 . 1 . 1 41 41 SER HA H 1 4.988 0.020 . 1 . . . . A 41 SER HA . 34095 1
307 . 1 . 1 41 41 SER HB2 H 1 4.328 0.020 . 2 . . . . A 41 SER HB2 . 34095 1
308 . 1 . 1 41 41 SER HB3 H 1 4.064 0.020 . 2 . . . . A 41 SER HB3 . 34095 1
309 . 1 . 1 41 41 SER CA C 13 56.003 0.400 . 1 . . . . A 41 SER CA . 34095 1
310 . 1 . 1 41 41 SER CB C 13 67.100 0.400 . 1 . . . . A 41 SER CB . 34095 1
311 . 1 . 1 41 41 SER N N 15 117.050 0.400 . 1 . . . . A 41 SER N . 34095 1
312 . 1 . 1 42 42 MET H H 1 8.328 0.020 . 1 . . . . A 42 MET H . 34095 1
313 . 1 . 1 42 42 MET HA H 1 3.921 0.020 . 1 . . . . A 42 MET HA . 34095 1
314 . 1 . 1 42 42 MET HB2 H 1 1.404 0.020 . 2 . . . . A 42 MET HB2 . 34095 1
315 . 1 . 1 42 42 MET HB3 H 1 1.404 0.020 . 2 . . . . A 42 MET HB3 . 34095 1
316 . 1 . 1 42 42 MET HG2 H 1 1.678 0.020 . 2 . . . . A 42 MET HG2 . 34095 1
317 . 1 . 1 42 42 MET HG3 H 1 1.678 0.020 . 2 . . . . A 42 MET HG3 . 34095 1
318 . 1 . 1 42 42 MET CA C 13 58.350 0.400 . 1 . . . . A 42 MET CA . 34095 1
319 . 1 . 1 42 42 MET CB C 13 30.910 0.400 . 1 . . . . A 42 MET CB . 34095 1
320 . 1 . 1 42 42 MET N N 15 119.123 0.400 . 1 . . . . A 42 MET N . 34095 1
321 . 1 . 1 43 43 ASP H H 1 7.979 0.020 . 1 . . . . A 43 ASP H . 34095 1
322 . 1 . 1 43 43 ASP HA H 1 4.321 0.020 . 1 . . . . A 43 ASP HA . 34095 1
323 . 1 . 1 43 43 ASP HB2 H 1 2.561 0.020 . 2 . . . . A 43 ASP HB2 . 34095 1
324 . 1 . 1 43 43 ASP HB3 H 1 2.409 0.020 . 2 . . . . A 43 ASP HB3 . 34095 1
325 . 1 . 1 43 43 ASP CA C 13 57.221 0.400 . 1 . . . . A 43 ASP CA . 34095 1
326 . 1 . 1 43 43 ASP CB C 13 40.237 0.400 . 1 . . . . A 43 ASP CB . 34095 1
327 . 1 . 1 43 43 ASP N N 15 119.073 0.400 . 1 . . . . A 43 ASP N . 34095 1
328 . 1 . 1 44 44 ASP H H 1 7.583 0.020 . 1 . . . . A 44 ASP H . 34095 1
329 . 1 . 1 44 44 ASP HA H 1 4.188 0.020 . 1 . . . . A 44 ASP HA . 34095 1
330 . 1 . 1 44 44 ASP HB2 H 1 2.594 0.020 . 2 . . . . A 44 ASP HB2 . 34095 1
331 . 1 . 1 44 44 ASP HB3 H 1 1.701 0.020 . 2 . . . . A 44 ASP HB3 . 34095 1
332 . 1 . 1 44 44 ASP CA C 13 57.489 0.400 . 1 . . . . A 44 ASP CA . 34095 1
333 . 1 . 1 44 44 ASP CB C 13 40.480 0.400 . 1 . . . . A 44 ASP CB . 34095 1
334 . 1 . 1 44 44 ASP N N 15 121.170 0.400 . 1 . . . . A 44 ASP N . 34095 1
335 . 1 . 1 45 45 LEU H H 1 7.638 0.020 . 1 . . . . A 45 LEU H . 34095 1
336 . 1 . 1 45 45 LEU HA H 1 4.071 0.020 . 1 . . . . A 45 LEU HA . 34095 1
337 . 1 . 1 45 45 LEU HB2 H 1 2.192 0.020 . 2 . . . . A 45 LEU HB2 . 34095 1
338 . 1 . 1 45 45 LEU HB3 H 1 2.192 0.020 . 2 . . . . A 45 LEU HB3 . 34095 1
339 . 1 . 1 45 45 LEU HD11 H 1 1.237 0.020 . 2 . . . . A 45 LEU HD11 . 34095 1
340 . 1 . 1 45 45 LEU HD12 H 1 1.237 0.020 . 2 . . . . A 45 LEU HD12 . 34095 1
341 . 1 . 1 45 45 LEU HD13 H 1 1.237 0.020 . 2 . . . . A 45 LEU HD13 . 34095 1
342 . 1 . 1 45 45 LEU HD21 H 1 1.237 0.020 . 2 . . . . A 45 LEU HD21 . 34095 1
343 . 1 . 1 45 45 LEU HD22 H 1 1.237 0.020 . 2 . . . . A 45 LEU HD22 . 34095 1
344 . 1 . 1 45 45 LEU HD23 H 1 1.237 0.020 . 2 . . . . A 45 LEU HD23 . 34095 1
345 . 1 . 1 45 45 LEU CA C 13 57.564 0.400 . 1 . . . . A 45 LEU CA . 34095 1
346 . 1 . 1 45 45 LEU CB C 13 41.270 0.400 . 1 . . . . A 45 LEU CB . 34095 1
347 . 1 . 1 45 45 LEU N N 15 118.318 0.400 . 1 . . . . A 45 LEU N . 34095 1
348 . 1 . 1 46 46 ALA H H 1 8.123 0.020 . 1 . . . . A 46 ALA H . 34095 1
349 . 1 . 1 46 46 ALA HA H 1 3.941 0.020 . 1 . . . . A 46 ALA HA . 34095 1
350 . 1 . 1 46 46 ALA HB1 H 1 1.480 0.020 . 1 . . . . A 46 ALA HB1 . 34095 1
351 . 1 . 1 46 46 ALA HB2 H 1 1.480 0.020 . 1 . . . . A 46 ALA HB2 . 34095 1
352 . 1 . 1 46 46 ALA HB3 H 1 1.480 0.020 . 1 . . . . A 46 ALA HB3 . 34095 1
353 . 1 . 1 46 46 ALA CA C 13 55.403 0.400 . 1 . . . . A 46 ALA CA . 34095 1
354 . 1 . 1 46 46 ALA CB C 13 17.831 0.400 . 1 . . . . A 46 ALA CB . 34095 1
355 . 1 . 1 46 46 ALA N N 15 121.611 0.400 . 1 . . . . A 46 ALA N . 34095 1
356 . 1 . 1 47 47 SER H H 1 8.084 0.020 . 1 . . . . A 47 SER H . 34095 1
357 . 1 . 1 47 47 SER HA H 1 4.216 0.020 . 1 . . . . A 47 SER HA . 34095 1
358 . 1 . 1 47 47 SER HB2 H 1 3.974 0.020 . 2 . . . . A 47 SER HB2 . 34095 1
359 . 1 . 1 47 47 SER HB3 H 1 3.974 0.020 . 2 . . . . A 47 SER HB3 . 34095 1
360 . 1 . 1 47 47 SER CA C 13 61.325 0.400 . 1 . . . . A 47 SER CA . 34095 1
361 . 1 . 1 47 47 SER CB C 13 62.814 0.400 . 1 . . . . A 47 SER CB . 34095 1
362 . 1 . 1 47 47 SER N N 15 116.468 0.400 . 1 . . . . A 47 SER N . 34095 1
363 . 1 . 1 48 48 LEU H H 1 7.120 0.020 . 1 . . . . A 48 LEU H . 34095 1
364 . 1 . 1 48 48 LEU HA H 1 4.225 0.020 . 1 . . . . A 48 LEU HA . 34095 1
365 . 1 . 1 48 48 LEU HB2 H 1 1.720 0.020 . 2 . . . . A 48 LEU HB2 . 34095 1
366 . 1 . 1 48 48 LEU HB3 H 1 1.720 0.020 . 2 . . . . A 48 LEU HB3 . 34095 1
367 . 1 . 1 48 48 LEU HG H 1 1.383 0.020 . 1 . . . . A 48 LEU HG . 34095 1
368 . 1 . 1 48 48 LEU HD11 H 1 0.672 0.020 . 2 . . . . A 48 LEU HD11 . 34095 1
369 . 1 . 1 48 48 LEU HD12 H 1 0.672 0.020 . 2 . . . . A 48 LEU HD12 . 34095 1
370 . 1 . 1 48 48 LEU HD13 H 1 0.672 0.020 . 2 . . . . A 48 LEU HD13 . 34095 1
371 . 1 . 1 48 48 LEU HD21 H 1 0.567 0.020 . 2 . . . . A 48 LEU HD21 . 34095 1
372 . 1 . 1 48 48 LEU HD22 H 1 0.567 0.020 . 2 . . . . A 48 LEU HD22 . 34095 1
373 . 1 . 1 48 48 LEU HD23 H 1 0.567 0.020 . 2 . . . . A 48 LEU HD23 . 34095 1
374 . 1 . 1 48 48 LEU CA C 13 54.966 0.400 . 1 . . . . A 48 LEU CA . 34095 1
375 . 1 . 1 48 48 LEU CB C 13 43.119 0.400 . 1 . . . . A 48 LEU CB . 34095 1
376 . 1 . 1 48 48 LEU N N 15 120.360 0.400 . 1 . . . . A 48 LEU N . 34095 1
377 . 1 . 1 49 49 LYS H H 1 7.807 0.020 . 1 . . . . A 49 LYS H . 34095 1
378 . 1 . 1 49 49 LYS HA H 1 3.668 0.020 . 1 . . . . A 49 LYS HA . 34095 1
379 . 1 . 1 49 49 LYS HB2 H 1 2.240 0.020 . 2 . . . . A 49 LYS HB2 . 34095 1
380 . 1 . 1 49 49 LYS HB3 H 1 2.240 0.020 . 2 . . . . A 49 LYS HB3 . 34095 1
381 . 1 . 1 49 49 LYS HG2 H 1 1.317 0.020 . 2 . . . . A 49 LYS HG2 . 34095 1
382 . 1 . 1 49 49 LYS HG3 H 1 1.317 0.020 . 2 . . . . A 49 LYS HG3 . 34095 1
383 . 1 . 1 49 49 LYS HD2 H 1 1.889 0.020 . 2 . . . . A 49 LYS HD2 . 34095 1
384 . 1 . 1 49 49 LYS HD3 H 1 1.889 0.020 . 2 . . . . A 49 LYS HD3 . 34095 1
385 . 1 . 1 49 49 LYS N N 15 111.529 0.400 . 1 . . . . A 49 LYS N . 34095 1
386 . 1 . 1 50 50 ILE H H 1 6.885 0.020 . 1 . . . . A 50 ILE H . 34095 1
387 . 1 . 1 50 50 ILE HA H 1 3.452 0.020 . 1 . . . . A 50 ILE HA . 34095 1
388 . 1 . 1 50 50 ILE HB H 1 1.493 0.020 . 1 . . . . A 50 ILE HB . 34095 1
389 . 1 . 1 50 50 ILE HG12 H 1 1.218 0.020 . 2 . . . . A 50 ILE HG12 . 34095 1
390 . 1 . 1 50 50 ILE HG13 H 1 1.218 0.020 . 2 . . . . A 50 ILE HG13 . 34095 1
391 . 1 . 1 50 50 ILE HG21 H 1 0.957 0.020 . 1 . . . . A 50 ILE HG21 . 34095 1
392 . 1 . 1 50 50 ILE HG22 H 1 0.957 0.020 . 1 . . . . A 50 ILE HG22 . 34095 1
393 . 1 . 1 50 50 ILE HG23 H 1 0.957 0.020 . 1 . . . . A 50 ILE HG23 . 34095 1
394 . 1 . 1 50 50 ILE HD11 H 1 0.732 0.020 . 1 . . . . A 50 ILE HD11 . 34095 1
395 . 1 . 1 50 50 ILE HD12 H 1 0.732 0.020 . 1 . . . . A 50 ILE HD12 . 34095 1
396 . 1 . 1 50 50 ILE HD13 H 1 0.732 0.020 . 1 . . . . A 50 ILE HD13 . 34095 1
397 . 1 . 1 50 50 ILE N N 15 117.300 0.400 . 1 . . . . A 50 ILE N . 34095 1
398 . 1 . 1 51 51 PRO HA H 1 4.777 0.020 . 1 . . . . A 51 PRO HA . 34095 1
399 . 1 . 1 51 51 PRO HD2 H 1 3.561 0.020 . 2 . . . . A 51 PRO HD2 . 34095 1
400 . 1 . 1 51 51 PRO HD3 H 1 3.561 0.020 . 2 . . . . A 51 PRO HD3 . 34095 1
401 . 1 . 1 51 51 PRO CA C 13 63.859 0.400 . 1 . . . . A 51 PRO CA . 34095 1
402 . 1 . 1 51 51 PRO CB C 13 32.689 0.400 . 1 . . . . A 51 PRO CB . 34095 1
403 . 1 . 1 52 52 GLU H H 1 9.051 0.020 . 1 . . . . A 52 GLU H . 34095 1
404 . 1 . 1 52 52 GLU HA H 1 4.336 0.020 . 1 . . . . A 52 GLU HA . 34095 1
405 . 1 . 1 52 52 GLU HB2 H 1 2.020 0.020 . 2 . . . . A 52 GLU HB2 . 34095 1
406 . 1 . 1 52 52 GLU HB3 H 1 2.020 0.020 . 2 . . . . A 52 GLU HB3 . 34095 1
407 . 1 . 1 52 52 GLU HG2 H 1 2.539 0.020 . 2 . . . . A 52 GLU HG2 . 34095 1
408 . 1 . 1 52 52 GLU HG3 H 1 2.265 0.020 . 2 . . . . A 52 GLU HG3 . 34095 1
409 . 1 . 1 52 52 GLU N N 15 124.926 0.400 . 1 . . . . A 52 GLU N . 34095 1
410 . 1 . 1 53 53 GLN H H 1 9.228 0.020 . 1 . . . . A 53 GLN H . 34095 1
411 . 1 . 1 53 53 GLN HA H 1 4.109 0.020 . 1 . . . . A 53 GLN HA . 34095 1
412 . 1 . 1 53 53 GLN HB2 H 1 1.836 0.020 . 2 . . . . A 53 GLN HB2 . 34095 1
413 . 1 . 1 53 53 GLN HB3 H 1 1.621 0.020 . 2 . . . . A 53 GLN HB3 . 34095 1
414 . 1 . 1 53 53 GLN HG2 H 1 1.985 0.020 . 2 . . . . A 53 GLN HG2 . 34095 1
415 . 1 . 1 53 53 GLN HG3 H 1 1.985 0.020 . 2 . . . . A 53 GLN HG3 . 34095 1
416 . 1 . 1 53 53 GLN CA C 13 58.326 0.400 . 1 . . . . A 53 GLN CA . 34095 1
417 . 1 . 1 53 53 GLN CB C 13 27.418 0.400 . 1 . . . . A 53 GLN CB . 34095 1
418 . 1 . 1 53 53 GLN N N 15 116.404 0.400 . 1 . . . . A 53 GLN N . 34095 1
419 . 1 . 1 54 54 PHE H H 1 7.536 0.020 . 1 . . . . A 54 PHE H . 34095 1
420 . 1 . 1 54 54 PHE HA H 1 4.837 0.020 . 1 . . . . A 54 PHE HA . 34095 1
421 . 1 . 1 54 54 PHE HB2 H 1 3.394 0.020 . 2 . . . . A 54 PHE HB2 . 34095 1
422 . 1 . 1 54 54 PHE HB3 H 1 2.542 0.020 . 2 . . . . A 54 PHE HB3 . 34095 1
423 . 1 . 1 54 54 PHE HD1 H 1 7.083 0.020 . 1 . . . . A 54 PHE HD1 . 34095 1
424 . 1 . 1 54 54 PHE HD2 H 1 7.083 0.020 . 1 . . . . A 54 PHE HD2 . 34095 1
425 . 1 . 1 54 54 PHE HE1 H 1 7.370 0.020 . 1 . . . . A 54 PHE HE1 . 34095 1
426 . 1 . 1 54 54 PHE HE2 H 1 7.370 0.020 . 1 . . . . A 54 PHE HE2 . 34095 1
427 . 1 . 1 54 54 PHE HZ H 1 7.304 0.020 . 1 . . . . A 54 PHE HZ . 34095 1
428 . 1 . 1 54 54 PHE CA C 13 58.014 0.400 . 1 . . . . A 54 PHE CA . 34095 1
429 . 1 . 1 54 54 PHE CB C 13 41.301 0.400 . 1 . . . . A 54 PHE CB . 34095 1
430 . 1 . 1 54 54 PHE N N 15 116.653 0.400 . 1 . . . . A 54 PHE N . 34095 1
431 . 1 . 1 55 55 ARG H H 1 7.686 0.020 . 1 . . . . A 55 ARG H . 34095 1
432 . 1 . 1 55 55 ARG HA H 1 3.760 0.020 . 1 . . . . A 55 ARG HA . 34095 1
433 . 1 . 1 55 55 ARG HB2 H 1 1.863 0.020 . 2 . . . . A 55 ARG HB2 . 34095 1
434 . 1 . 1 55 55 ARG HB3 H 1 1.863 0.020 . 2 . . . . A 55 ARG HB3 . 34095 1
435 . 1 . 1 55 55 ARG HG2 H 1 1.316 0.020 . 2 . . . . A 55 ARG HG2 . 34095 1
436 . 1 . 1 55 55 ARG HG3 H 1 1.316 0.020 . 2 . . . . A 55 ARG HG3 . 34095 1
437 . 1 . 1 55 55 ARG HD2 H 1 3.127 0.020 . 2 . . . . A 55 ARG HD2 . 34095 1
438 . 1 . 1 55 55 ARG HD3 H 1 3.127 0.020 . 2 . . . . A 55 ARG HD3 . 34095 1
439 . 1 . 1 55 55 ARG CA C 13 61.667 0.400 . 1 . . . . A 55 ARG CA . 34095 1
440 . 1 . 1 55 55 ARG CB C 13 30.680 0.400 . 1 . . . . A 55 ARG CB . 34095 1
441 . 1 . 1 55 55 ARG N N 15 118.613 0.400 . 1 . . . . A 55 ARG N . 34095 1
442 . 1 . 1 56 56 HIS H H 1 8.492 0.020 . 1 . . . . A 56 HIS H . 34095 1
443 . 1 . 1 56 56 HIS HA H 1 4.415 0.020 . 1 . . . . A 56 HIS HA . 34095 1
444 . 1 . 1 56 56 HIS HB2 H 1 3.149 0.020 . 2 . . . . A 56 HIS HB2 . 34095 1
445 . 1 . 1 56 56 HIS HB3 H 1 3.149 0.020 . 2 . . . . A 56 HIS HB3 . 34095 1
446 . 1 . 1 56 56 HIS HD2 H 1 7.104 0.020 . 1 . . . . A 56 HIS HD2 . 34095 1
447 . 1 . 1 56 56 HIS CA C 13 60.882 0.400 . 1 . . . . A 56 HIS CA . 34095 1
448 . 1 . 1 56 56 HIS CB C 13 30.286 0.400 . 1 . . . . A 56 HIS CB . 34095 1
449 . 1 . 1 56 56 HIS N N 15 116.902 0.400 . 1 . . . . A 56 HIS N . 34095 1
450 . 1 . 1 57 57 ALA H H 1 7.982 0.020 . 1 . . . . A 57 ALA H . 34095 1
451 . 1 . 1 57 57 ALA HA H 1 4.106 0.020 . 1 . . . . A 57 ALA HA . 34095 1
452 . 1 . 1 57 57 ALA HB1 H 1 1.493 0.020 . 1 . . . . A 57 ALA HB1 . 34095 1
453 . 1 . 1 57 57 ALA HB2 H 1 1.493 0.020 . 1 . . . . A 57 ALA HB2 . 34095 1
454 . 1 . 1 57 57 ALA HB3 H 1 1.493 0.020 . 1 . . . . A 57 ALA HB3 . 34095 1
455 . 1 . 1 57 57 ALA CA C 13 55.073 0.400 . 1 . . . . A 57 ALA CA . 34095 1
456 . 1 . 1 57 57 ALA CB C 13 18.228 0.400 . 1 . . . . A 57 ALA CB . 34095 1
457 . 1 . 1 57 57 ALA N N 15 121.204 0.400 . 1 . . . . A 57 ALA N . 34095 1
458 . 1 . 1 58 58 ILE H H 1 7.969 0.020 . 1 . . . . A 58 ILE H . 34095 1
459 . 1 . 1 58 58 ILE HA H 1 3.494 0.020 . 1 . . . . A 58 ILE HA . 34095 1
460 . 1 . 1 58 58 ILE HB H 1 1.834 0.020 . 1 . . . . A 58 ILE HB . 34095 1
461 . 1 . 1 58 58 ILE HG12 H 1 0.720 0.020 . 2 . . . . A 58 ILE HG12 . 34095 1
462 . 1 . 1 58 58 ILE HG13 H 1 0.391 0.020 . 2 . . . . A 58 ILE HG13 . 34095 1
463 . 1 . 1 58 58 ILE HG21 H 1 0.990 0.020 . 1 . . . . A 58 ILE HG21 . 34095 1
464 . 1 . 1 58 58 ILE HG22 H 1 0.990 0.020 . 1 . . . . A 58 ILE HG22 . 34095 1
465 . 1 . 1 58 58 ILE HG23 H 1 0.990 0.020 . 1 . . . . A 58 ILE HG23 . 34095 1
466 . 1 . 1 58 58 ILE HD11 H 1 1.235 0.020 . 1 . . . . A 58 ILE HD11 . 34095 1
467 . 1 . 1 58 58 ILE HD12 H 1 1.235 0.020 . 1 . . . . A 58 ILE HD12 . 34095 1
468 . 1 . 1 58 58 ILE HD13 H 1 1.235 0.020 . 1 . . . . A 58 ILE HD13 . 34095 1
469 . 1 . 1 58 58 ILE CA C 13 65.714 0.400 . 1 . . . . A 58 ILE CA . 34095 1
470 . 1 . 1 58 58 ILE CB C 13 38.659 0.400 . 1 . . . . A 58 ILE CB . 34095 1
471 . 1 . 1 58 58 ILE N N 15 118.169 0.400 . 1 . . . . A 58 ILE N . 34095 1
472 . 1 . 1 59 59 TRP H H 1 8.494 0.020 . 1 . . . . A 59 TRP H . 34095 1
473 . 1 . 1 59 59 TRP HA H 1 4.349 0.020 . 1 . . . . A 59 TRP HA . 34095 1
474 . 1 . 1 59 59 TRP HB2 H 1 3.423 0.020 . 2 . . . . A 59 TRP HB2 . 34095 1
475 . 1 . 1 59 59 TRP HB3 H 1 3.255 0.020 . 2 . . . . A 59 TRP HB3 . 34095 1
476 . 1 . 1 59 59 TRP HD1 H 1 7.154 0.020 . 1 . . . . A 59 TRP HD1 . 34095 1
477 . 1 . 1 59 59 TRP HE1 H 1 10.238 0.020 . 1 . . . . A 59 TRP HE1 . 34095 1
478 . 1 . 1 59 59 TRP HE3 H 1 7.438 0.020 . 1 . . . . A 59 TRP HE3 . 34095 1
479 . 1 . 1 59 59 TRP HZ2 H 1 7.519 0.020 . 1 . . . . A 59 TRP HZ2 . 34095 1
480 . 1 . 1 59 59 TRP HZ3 H 1 7.261 0.020 . 1 . . . . A 59 TRP HZ3 . 34095 1
481 . 1 . 1 59 59 TRP HH2 H 1 7.514 0.020 . 1 . . . . A 59 TRP HH2 . 34095 1
482 . 1 . 1 59 59 TRP CA C 13 61.314 0.400 . 1 . . . . A 59 TRP CA . 34095 1
483 . 1 . 1 59 59 TRP CB C 13 29.720 0.400 . 1 . . . . A 59 TRP CB . 34095 1
484 . 1 . 1 59 59 TRP N N 15 120.818 0.400 . 1 . . . . A 59 TRP N . 34095 1
485 . 1 . 1 59 59 TRP NE1 N 15 129.340 0.400 . 1 . . . . A 59 TRP NE1 . 34095 1
486 . 1 . 1 60 60 LYS H H 1 8.637 0.020 . 1 . . . . A 60 LYS H . 34095 1
487 . 1 . 1 60 60 LYS HA H 1 3.541 0.020 . 1 . . . . A 60 LYS HA . 34095 1
488 . 1 . 1 60 60 LYS HB2 H 1 1.812 0.020 . 2 . . . . A 60 LYS HB2 . 34095 1
489 . 1 . 1 60 60 LYS HB3 H 1 1.728 0.020 . 2 . . . . A 60 LYS HB3 . 34095 1
490 . 1 . 1 60 60 LYS HG2 H 1 1.397 0.020 . 2 . . . . A 60 LYS HG2 . 34095 1
491 . 1 . 1 60 60 LYS HG3 H 1 1.397 0.020 . 2 . . . . A 60 LYS HG3 . 34095 1
492 . 1 . 1 60 60 LYS CA C 13 58.771 0.400 . 1 . . . . A 60 LYS CA . 34095 1
493 . 1 . 1 60 60 LYS CB C 13 31.777 0.400 . 1 . . . . A 60 LYS CB . 34095 1
494 . 1 . 1 60 60 LYS N N 15 117.082 0.400 . 1 . . . . A 60 LYS N . 34095 1
495 . 1 . 1 61 61 GLY H H 1 7.890 0.020 . 1 . . . . A 61 GLY H . 34095 1
496 . 1 . 1 61 61 GLY HA2 H 1 3.733 0.020 . 2 . . . . A 61 GLY HA2 . 34095 1
497 . 1 . 1 61 61 GLY HA3 H 1 4.022 0.020 . 2 . . . . A 61 GLY HA3 . 34095 1
498 . 1 . 1 61 61 GLY CA C 13 47.552 0.400 . 1 . . . . A 61 GLY CA . 34095 1
499 . 1 . 1 61 61 GLY N N 15 106.174 0.400 . 1 . . . . A 61 GLY N . 34095 1
500 . 1 . 1 62 62 ILE H H 1 8.678 0.020 . 1 . . . . A 62 ILE H . 34095 1
501 . 1 . 1 62 62 ILE HA H 1 3.571 0.020 . 1 . . . . A 62 ILE HA . 34095 1
502 . 1 . 1 62 62 ILE HB H 1 2.094 0.020 . 1 . . . . A 62 ILE HB . 34095 1
503 . 1 . 1 62 62 ILE HG12 H 1 0.771 0.020 . 2 . . . . A 62 ILE HG12 . 34095 1
504 . 1 . 1 62 62 ILE HG13 H 1 0.771 0.020 . 2 . . . . A 62 ILE HG13 . 34095 1
505 . 1 . 1 62 62 ILE HG21 H 1 0.987 0.020 . 1 . . . . A 62 ILE HG21 . 34095 1
506 . 1 . 1 62 62 ILE HG22 H 1 0.987 0.020 . 1 . . . . A 62 ILE HG22 . 34095 1
507 . 1 . 1 62 62 ILE HG23 H 1 0.987 0.020 . 1 . . . . A 62 ILE HG23 . 34095 1
508 . 1 . 1 62 62 ILE CA C 13 66.395 0.400 . 1 . . . . A 62 ILE CA . 34095 1
509 . 1 . 1 62 62 ILE CB C 13 37.992 0.400 . 1 . . . . A 62 ILE CB . 34095 1
510 . 1 . 1 62 62 ILE N N 15 125.431 0.400 . 1 . . . . A 62 ILE N . 34095 1
511 . 1 . 1 63 63 LEU H H 1 8.161 0.020 . 1 . . . . A 63 LEU H . 34095 1
512 . 1 . 1 63 63 LEU HA H 1 3.719 0.020 . 1 . . . . A 63 LEU HA . 34095 1
513 . 1 . 1 63 63 LEU HB2 H 1 1.288 0.020 . 2 . . . . A 63 LEU HB2 . 34095 1
514 . 1 . 1 63 63 LEU HB3 H 1 1.288 0.020 . 2 . . . . A 63 LEU HB3 . 34095 1
515 . 1 . 1 63 63 LEU HG H 1 0.998 0.020 . 1 . . . . A 63 LEU HG . 34095 1
516 . 1 . 1 63 63 LEU HD11 H 1 0.522 0.020 . 2 . . . . A 63 LEU HD11 . 34095 1
517 . 1 . 1 63 63 LEU HD12 H 1 0.522 0.020 . 2 . . . . A 63 LEU HD12 . 34095 1
518 . 1 . 1 63 63 LEU HD13 H 1 0.522 0.020 . 2 . . . . A 63 LEU HD13 . 34095 1
519 . 1 . 1 63 63 LEU HD21 H 1 0.302 0.020 . 2 . . . . A 63 LEU HD21 . 34095 1
520 . 1 . 1 63 63 LEU HD22 H 1 0.302 0.020 . 2 . . . . A 63 LEU HD22 . 34095 1
521 . 1 . 1 63 63 LEU HD23 H 1 0.302 0.020 . 2 . . . . A 63 LEU HD23 . 34095 1
522 . 1 . 1 63 63 LEU CA C 13 58.299 0.400 . 1 . . . . A 63 LEU CA . 34095 1
523 . 1 . 1 63 63 LEU CB C 13 41.222 0.400 . 1 . . . . A 63 LEU CB . 34095 1
524 . 1 . 1 63 63 LEU N N 15 121.737 0.400 . 1 . . . . A 63 LEU N . 34095 1
525 . 1 . 1 64 64 ASP H H 1 8.417 0.020 . 1 . . . . A 64 ASP H . 34095 1
526 . 1 . 1 64 64 ASP HA H 1 4.335 0.020 . 1 . . . . A 64 ASP HA . 34095 1
527 . 1 . 1 64 64 ASP HB2 H 1 2.780 0.020 . 2 . . . . A 64 ASP HB2 . 34095 1
528 . 1 . 1 64 64 ASP HB3 H 1 2.630 0.020 . 2 . . . . A 64 ASP HB3 . 34095 1
529 . 1 . 1 64 64 ASP CA C 13 56.910 0.400 . 1 . . . . A 64 ASP CA . 34095 1
530 . 1 . 1 64 64 ASP CB C 13 40.369 0.400 . 1 . . . . A 64 ASP CB . 34095 1
531 . 1 . 1 64 64 ASP N N 15 118.909 0.400 . 1 . . . . A 64 ASP N . 34095 1
532 . 1 . 1 65 65 HIS H H 1 7.899 0.020 . 1 . . . . A 65 HIS H . 34095 1
533 . 1 . 1 65 65 HIS HA H 1 4.250 0.020 . 1 . . . . A 65 HIS HA . 34095 1
534 . 1 . 1 65 65 HIS HB2 H 1 3.310 0.020 . 2 . . . . A 65 HIS HB2 . 34095 1
535 . 1 . 1 65 65 HIS HB3 H 1 3.084 0.020 . 2 . . . . A 65 HIS HB3 . 34095 1
536 . 1 . 1 65 65 HIS HD2 H 1 6.753 0.020 . 1 . . . . A 65 HIS HD2 . 34095 1
537 . 1 . 1 65 65 HIS CA C 13 59.801 0.400 . 1 . . . . A 65 HIS CA . 34095 1
538 . 1 . 1 65 65 HIS CB C 13 30.343 0.400 . 1 . . . . A 65 HIS CB . 34095 1
539 . 1 . 1 65 65 HIS N N 15 120.742 0.400 . 1 . . . . A 65 HIS N . 34095 1
540 . 1 . 1 66 66 ARG H H 1 8.217 0.020 . 1 . . . . A 66 ARG H . 34095 1
541 . 1 . 1 66 66 ARG HA H 1 3.950 0.020 . 1 . . . . A 66 ARG HA . 34095 1
542 . 1 . 1 66 66 ARG HB2 H 1 1.905 0.020 . 2 . . . . A 66 ARG HB2 . 34095 1
543 . 1 . 1 66 66 ARG HB3 H 1 1.905 0.020 . 2 . . . . A 66 ARG HB3 . 34095 1
544 . 1 . 1 66 66 ARG HG2 H 1 1.721 0.020 . 2 . . . . A 66 ARG HG2 . 34095 1
545 . 1 . 1 66 66 ARG HG3 H 1 1.721 0.020 . 2 . . . . A 66 ARG HG3 . 34095 1
546 . 1 . 1 66 66 ARG HD2 H 1 3.184 0.020 . 2 . . . . A 66 ARG HD2 . 34095 1
547 . 1 . 1 66 66 ARG HD3 H 1 3.184 0.020 . 2 . . . . A 66 ARG HD3 . 34095 1
548 . 1 . 1 66 66 ARG CA C 13 58.235 0.400 . 1 . . . . A 66 ARG CA . 34095 1
549 . 1 . 1 66 66 ARG CB C 13 30.628 0.400 . 1 . . . . A 66 ARG CB . 34095 1
550 . 1 . 1 66 66 ARG N N 15 118.211 0.400 . 1 . . . . A 66 ARG N . 34095 1
551 . 1 . 1 67 67 GLN H H 1 7.737 0.020 . 1 . . . . A 67 GLN H . 34095 1
552 . 1 . 1 67 67 GLN HA H 1 4.161 0.020 . 1 . . . . A 67 GLN HA . 34095 1
553 . 1 . 1 67 67 GLN HB2 H 1 2.070 0.020 . 2 . . . . A 67 GLN HB2 . 34095 1
554 . 1 . 1 67 67 GLN HB3 H 1 2.070 0.020 . 2 . . . . A 67 GLN HB3 . 34095 1
555 . 1 . 1 67 67 GLN HG2 H 1 2.426 0.020 . 2 . . . . A 67 GLN HG2 . 34095 1
556 . 1 . 1 67 67 GLN HG3 H 1 2.426 0.020 . 2 . . . . A 67 GLN HG3 . 34095 1
557 . 1 . 1 67 67 GLN CA C 13 56.578 0.400 . 1 . . . . A 67 GLN CA . 34095 1
558 . 1 . 1 67 67 GLN CB C 13 28.876 0.400 . 1 . . . . A 67 GLN CB . 34095 1
559 . 1 . 1 67 67 GLN N N 15 116.742 0.400 . 1 . . . . A 67 GLN N . 34095 1
560 . 1 . 1 68 68 LEU H H 1 7.668 0.020 . 1 . . . . A 68 LEU H . 34095 1
561 . 1 . 1 68 68 LEU HA H 1 4.204 0.020 . 1 . . . . A 68 LEU HA . 34095 1
562 . 1 . 1 68 68 LEU HB2 H 1 1.583 0.020 . 2 . . . . A 68 LEU HB2 . 34095 1
563 . 1 . 1 68 68 LEU HB3 H 1 1.583 0.020 . 2 . . . . A 68 LEU HB3 . 34095 1
564 . 1 . 1 68 68 LEU HG H 1 1.409 0.020 . 1 . . . . A 68 LEU HG . 34095 1
565 . 1 . 1 68 68 LEU HD11 H 1 0.804 0.020 . 2 . . . . A 68 LEU HD11 . 34095 1
566 . 1 . 1 68 68 LEU HD12 H 1 0.804 0.020 . 2 . . . . A 68 LEU HD12 . 34095 1
567 . 1 . 1 68 68 LEU HD13 H 1 0.804 0.020 . 2 . . . . A 68 LEU HD13 . 34095 1
568 . 1 . 1 68 68 LEU HD21 H 1 0.804 0.020 . 2 . . . . A 68 LEU HD21 . 34095 1
569 . 1 . 1 68 68 LEU HD22 H 1 0.804 0.020 . 2 . . . . A 68 LEU HD22 . 34095 1
570 . 1 . 1 68 68 LEU HD23 H 1 0.804 0.020 . 2 . . . . A 68 LEU HD23 . 34095 1
571 . 1 . 1 68 68 LEU CA C 13 55.452 0.400 . 1 . . . . A 68 LEU CA . 34095 1
572 . 1 . 1 68 68 LEU CB C 13 42.201 0.400 . 1 . . . . A 68 LEU CB . 34095 1
573 . 1 . 1 68 68 LEU N N 15 120.378 0.400 . 1 . . . . A 68 LEU N . 34095 1
574 . 1 . 1 69 69 HIS H H 1 7.878 0.020 . 1 . . . . A 69 HIS H . 34095 1
575 . 1 . 1 69 69 HIS HA H 1 4.691 0.020 . 1 . . . . A 69 HIS HA . 34095 1
576 . 1 . 1 69 69 HIS HB2 H 1 3.205 0.020 . 2 . . . . A 69 HIS HB2 . 34095 1
577 . 1 . 1 69 69 HIS HB3 H 1 3.065 0.020 . 2 . . . . A 69 HIS HB3 . 34095 1
578 . 1 . 1 69 69 HIS CA C 13 55.374 0.400 . 1 . . . . A 69 HIS CA . 34095 1
579 . 1 . 1 69 69 HIS CB C 13 30.322 0.400 . 1 . . . . A 69 HIS CB . 34095 1
580 . 1 . 1 69 69 HIS N N 15 118.059 0.400 . 1 . . . . A 69 HIS N . 34095 1
581 . 1 . 1 70 70 ASP H H 1 8.094 0.020 . 1 . . . . A 70 ASP H . 34095 1
582 . 1 . 1 70 70 ASP HA H 1 4.419 0.020 . 1 . . . . A 70 ASP HA . 34095 1
583 . 1 . 1 70 70 ASP HB2 H 1 2.679 0.020 . 2 . . . . A 70 ASP HB2 . 34095 1
584 . 1 . 1 70 70 ASP HB3 H 1 2.587 0.020 . 2 . . . . A 70 ASP HB3 . 34095 1
585 . 1 . 1 70 70 ASP CA C 13 56.008 0.400 . 1 . . . . A 70 ASP CA . 34095 1
586 . 1 . 1 70 70 ASP CB C 13 42.040 0.400 . 1 . . . . A 70 ASP CB . 34095 1
587 . 1 . 1 70 70 ASP N N 15 126.843 0.400 . 1 . . . . A 70 ASP N . 34095 1
stop_
save_