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 25924
_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 $cs_ref
_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-15N HSQC' . . . 25924 1
2 '3D HNCO' . . . 25924 1
3 '3D HN(CA)CO' . . . 25924 1
4 '3D CBCA(CO)NH' . . . 25924 1
5 '3D HNCACB' . . . 25924 1
6 '3D H(CCO)NH' . . . 25924 1
7 '3D (H)CCO)NH' . . . 25924 1
8 '2D 1H-1H NOESY' . . . 25924 1
9 '3D HCCH-TOCSY' . . . 25924 1
10 '3D HNHA' . . . 25924 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $SPARKY . . 25924 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 6 6 PRO HA H 1 4.233 0.015 . . . . . . A 6 PRO HA . 25924 1
2 . 1 . 1 6 6 PRO HB2 H 1 2.224 0.001 . . . . . . A 6 PRO HB2 . 25924 1
3 . 1 . 1 6 6 PRO HB3 H 1 2.224 0.001 . . . . . . A 6 PRO HB3 . 25924 1
4 . 1 . 1 6 6 PRO HG2 H 1 2.021 0.018 . . . . . . A 6 PRO HG2 . 25924 1
5 . 1 . 1 6 6 PRO HG3 H 1 1.827 0 . . . . . . A 6 PRO HG3 . 25924 1
6 . 1 . 1 6 6 PRO HD2 H 1 3.89 0 . . . . . . A 6 PRO HD2 . 25924 1
7 . 1 . 1 6 6 PRO HD3 H 1 3.89 0 . . . . . . A 6 PRO HD3 . 25924 1
8 . 1 . 1 6 6 PRO C C 13 174.849 0.001 . . . . . . A 6 PRO C . 25924 1
9 . 1 . 1 6 6 PRO CA C 13 62.494 0.116 . . . . . . A 6 PRO CA . 25924 1
10 . 1 . 1 6 6 PRO CB C 13 30.061 0.177 . . . . . . A 6 PRO CB . 25924 1
11 . 1 . 1 6 6 PRO CG C 13 25.389 0 . . . . . . A 6 PRO CG . 25924 1
12 . 1 . 1 6 6 PRO CD C 13 48.165 0 . . . . . . A 6 PRO CD . 25924 1
13 . 1 . 1 7 7 ILE H H 1 7.42 0.007 . . . . . . A 7 ILE H . 25924 1
14 . 1 . 1 7 7 ILE HA H 1 3.556 0.007 . . . . . . A 7 ILE HA . 25924 1
15 . 1 . 1 7 7 ILE HB H 1 1.959 0.017 . . . . . . A 7 ILE HB . 25924 1
16 . 1 . 1 7 7 ILE HG12 H 1 1.459 0.025 . . . . . . A 7 ILE HG12 . 25924 1
17 . 1 . 1 7 7 ILE HG21 H 1 0.78 0.006 . . . . . . A 7 ILE HG21 . 25924 1
18 . 1 . 1 7 7 ILE HG22 H 1 0.78 0.006 . . . . . . A 7 ILE HG22 . 25924 1
19 . 1 . 1 7 7 ILE HG23 H 1 0.78 0.006 . . . . . . A 7 ILE HG23 . 25924 1
20 . 1 . 1 7 7 ILE HD11 H 1 0.599 0.007 . . . . . . A 7 ILE HD11 . 25924 1
21 . 1 . 1 7 7 ILE HD12 H 1 0.599 0.007 . . . . . . A 7 ILE HD12 . 25924 1
22 . 1 . 1 7 7 ILE HD13 H 1 0.599 0.007 . . . . . . A 7 ILE HD13 . 25924 1
23 . 1 . 1 7 7 ILE C C 13 177.294 0.006 . . . . . . A 7 ILE C . 25924 1
24 . 1 . 1 7 7 ILE CA C 13 62.546 0.118 . . . . . . A 7 ILE CA . 25924 1
25 . 1 . 1 7 7 ILE CB C 13 34.984 0.166 . . . . . . A 7 ILE CB . 25924 1
26 . 1 . 1 7 7 ILE CG1 C 13 26.844 0 . . . . . . A 7 ILE CG1 . 25924 1
27 . 1 . 1 7 7 ILE CG2 C 13 14.195 0 . . . . . . A 7 ILE CG2 . 25924 1
28 . 1 . 1 7 7 ILE CD1 C 13 11.591 0 . . . . . . A 7 ILE CD1 . 25924 1
29 . 1 . 1 7 7 ILE N N 15 118.341 0.04 . . . . . . A 7 ILE N . 25924 1
30 . 1 . 1 8 8 SER H H 1 7.867 0.005 . . . . . . A 8 SER H . 25924 1
31 . 1 . 1 8 8 SER HA H 1 4.14 0.009 . . . . . . A 8 SER HA . 25924 1
32 . 1 . 1 8 8 SER HB2 H 1 3.796 0.022 . . . . . . A 8 SER HB2 . 25924 1
33 . 1 . 1 8 8 SER HB3 H 1 3.796 0.022 . . . . . . A 8 SER HB3 . 25924 1
34 . 1 . 1 8 8 SER C C 13 174.216 0.006 . . . . . . A 8 SER C . 25924 1
35 . 1 . 1 8 8 SER CA C 13 58.686 0.142 . . . . . . A 8 SER CA . 25924 1
36 . 1 . 1 8 8 SER CB C 13 59.913 0.435 . . . . . . A 8 SER CB . 25924 1
37 . 1 . 1 8 8 SER N N 15 118.043 0.043 . . . . . . A 8 SER N . 25924 1
38 . 1 . 1 9 9 GLN H H 1 8.384 0.004 . . . . . . A 9 GLN H . 25924 1
39 . 1 . 1 9 9 GLN HA H 1 3.894 0.001 . . . . . . A 9 GLN HA . 25924 1
40 . 1 . 1 9 9 GLN HB2 H 1 1.934 0.016 . . . . . . A 9 GLN HB2 . 25924 1
41 . 1 . 1 9 9 GLN HB3 H 1 1.934 0.016 . . . . . . A 9 GLN HB3 . 25924 1
42 . 1 . 1 9 9 GLN HG2 H 1 2.25 0.006 . . . . . . A 9 GLN HG2 . 25924 1
43 . 1 . 1 9 9 GLN HG3 H 1 2.25 0.006 . . . . . . A 9 GLN HG3 . 25924 1
44 . 1 . 1 9 9 GLN C C 13 175.75 0.013 . . . . . . A 9 GLN C . 25924 1
45 . 1 . 1 9 9 GLN CA C 13 56.418 0.113 . . . . . . A 9 GLN CA . 25924 1
46 . 1 . 1 9 9 GLN CB C 13 26.763 1.306 . . . . . . A 9 GLN CB . 25924 1
47 . 1 . 1 9 9 GLN CG C 13 31.217 0 . . . . . . A 9 GLN CG . 25924 1
48 . 1 . 1 9 9 GLN N N 15 121.528 0.099 . . . . . . A 9 GLN N . 25924 1
49 . 1 . 1 10 10 LEU H H 1 8.357 0.005 . . . . . . A 10 LEU H . 25924 1
50 . 1 . 1 10 10 LEU HA H 1 3.903 0.012 . . . . . . A 10 LEU HA . 25924 1
51 . 1 . 1 10 10 LEU HB2 H 1 1.53 0 . . . . . . A 10 LEU HB2 . 25924 1
52 . 1 . 1 10 10 LEU HB3 H 1 1.53 0 . . . . . . A 10 LEU HB3 . 25924 1
53 . 1 . 1 10 10 LEU HD11 H 1 0.806 0.01 . . . . . . A 10 LEU HD11 . 25924 1
54 . 1 . 1 10 10 LEU HD12 H 1 0.806 0.01 . . . . . . A 10 LEU HD12 . 25924 1
55 . 1 . 1 10 10 LEU HD13 H 1 0.806 0.01 . . . . . . A 10 LEU HD13 . 25924 1
56 . 1 . 1 10 10 LEU C C 13 174.336 0.006 . . . . . . A 10 LEU C . 25924 1
57 . 1 . 1 10 10 LEU CA C 13 55.816 0.074 . . . . . . A 10 LEU CA . 25924 1
58 . 1 . 1 10 10 LEU CB C 13 38.168 0.068 . . . . . . A 10 LEU CB . 25924 1
59 . 1 . 1 10 10 LEU CG C 13 24.05 0 . . . . . . A 10 LEU CG . 25924 1
60 . 1 . 1 10 10 LEU CD1 C 13 22.236 0 . . . . . . A 10 LEU CD1 . 25924 1
61 . 1 . 1 10 10 LEU CD2 C 13 21.164 0 . . . . . . A 10 LEU CD2 . 25924 1
62 . 1 . 1 10 10 LEU N N 15 120.026 0.039 . . . . . . A 10 LEU N . 25924 1
63 . 1 . 1 11 11 GLN H H 1 7.445 0.004 . . . . . . A 11 GLN H . 25924 1
64 . 1 . 1 11 11 GLN HA H 1 3.591 0.004 . . . . . . A 11 GLN HA . 25924 1
65 . 1 . 1 11 11 GLN C C 13 175.196 0.009 . . . . . . A 11 GLN C . 25924 1
66 . 1 . 1 11 11 GLN CA C 13 57.729 0.169 . . . . . . A 11 GLN CA . 25924 1
67 . 1 . 1 11 11 GLN CB C 13 20.954 9.335 . . . . . . A 11 GLN CB . 25924 1
68 . 1 . 1 11 11 GLN CG C 13 31.594 0 . . . . . . A 11 GLN CG . 25924 1
69 . 1 . 1 11 11 GLN N N 15 116.55 0.053 . . . . . . A 11 GLN N . 25924 1
70 . 1 . 1 12 12 GLN H H 1 8.159 0.005 . . . . . . A 12 GLN H . 25924 1
71 . 1 . 1 12 12 GLN HA H 1 3.94 0 . . . . . . A 12 GLN HA . 25924 1
72 . 1 . 1 12 12 GLN HB2 H 1 2.123 0.057 . . . . . . A 12 GLN HB2 . 25924 1
73 . 1 . 1 12 12 GLN HB3 H 1 2.123 0.057 . . . . . . A 12 GLN HB3 . 25924 1
74 . 1 . 1 12 12 GLN HG2 H 1 2.388 0.049 . . . . . . A 12 GLN HG2 . 25924 1
75 . 1 . 1 12 12 GLN HG3 H 1 2.388 0.049 . . . . . . A 12 GLN HG3 . 25924 1
76 . 1 . 1 12 12 GLN C C 13 176.463 0.002 . . . . . . A 12 GLN C . 25924 1
77 . 1 . 1 12 12 GLN CA C 13 56.111 0.093 . . . . . . A 12 GLN CA . 25924 1
78 . 1 . 1 12 12 GLN CB C 13 25.406 0.057 . . . . . . A 12 GLN CB . 25924 1
79 . 1 . 1 12 12 GLN CG C 13 31.359 0 . . . . . . A 12 GLN CG . 25924 1
80 . 1 . 1 12 12 GLN N N 15 116.948 0.055 . . . . . . A 12 GLN N . 25924 1
81 . 1 . 1 13 13 CYS H H 1 8.255 0.003 . . . . . . A 13 CYS H . 25924 1
82 . 1 . 1 13 13 CYS HA H 1 4.246 0.035 . . . . . . A 13 CYS HA . 25924 1
83 . 1 . 1 13 13 CYS HB2 H 1 2.939 0.011 . . . . . . A 13 CYS HB2 . 25924 1
84 . 1 . 1 13 13 CYS HB3 H 1 2.939 0.011 . . . . . . A 13 CYS HB3 . 25924 1
85 . 1 . 1 13 13 CYS C C 13 174.884 0.004 . . . . . . A 13 CYS C . 25924 1
86 . 1 . 1 13 13 CYS CA C 13 55.688 0.15 . . . . . . A 13 CYS CA . 25924 1
87 . 1 . 1 13 13 CYS CB C 13 36.819 0.061 . . . . . . A 13 CYS CB . 25924 1
88 . 1 . 1 13 13 CYS N N 15 119.104 0.036 . . . . . . A 13 CYS N . 25924 1
89 . 1 . 1 14 14 CYS H H 1 8.472 0.005 . . . . . . A 14 CYS H . 25924 1
90 . 1 . 1 14 14 CYS HA H 1 3.872 0.001 . . . . . . A 14 CYS HA . 25924 1
91 . 1 . 1 14 14 CYS HB2 H 1 2.863 0.003 . . . . . . A 14 CYS HB2 . 25924 1
92 . 1 . 1 14 14 CYS HB3 H 1 2.863 0.003 . . . . . . A 14 CYS HB3 . 25924 1
93 . 1 . 1 14 14 CYS C C 13 174.825 0.126 . . . . . . A 14 CYS C . 25924 1
94 . 1 . 1 14 14 CYS CA C 13 59.649 0.13 . . . . . . A 14 CYS CA . 25924 1
95 . 1 . 1 14 14 CYS CB C 13 30.799 0.143 . . . . . . A 14 CYS CB . 25924 1
96 . 1 . 1 14 14 CYS N N 15 119.738 0.032 . . . . . . A 14 CYS N . 25924 1
97 . 1 . 1 15 15 LEU H H 1 7.875 0 . . . . . . A 15 LEU H . 25924 1
98 . 1 . 1 15 15 LEU HA H 1 4.164 0.019 . . . . . . A 15 LEU HA . 25924 1
99 . 1 . 1 15 15 LEU HB2 H 1 1.814 0.018 . . . . . . A 15 LEU HB2 . 25924 1
100 . 1 . 1 15 15 LEU HB3 H 1 1.814 0.018 . . . . . . A 15 LEU HB3 . 25924 1
101 . 1 . 1 15 15 LEU HG H 1 1.609 0.01 . . . . . . A 15 LEU HG . 25924 1
102 . 1 . 1 15 15 LEU HD11 H 1 0.839 0.028 . . . . . . A 15 LEU HD11 . 25924 1
103 . 1 . 1 15 15 LEU HD12 H 1 0.839 0.028 . . . . . . A 15 LEU HD12 . 25924 1
104 . 1 . 1 15 15 LEU HD13 H 1 0.839 0.028 . . . . . . A 15 LEU HD13 . 25924 1
105 . 1 . 1 15 15 LEU C C 13 176.334 0.003 . . . . . . A 15 LEU C . 25924 1
106 . 1 . 1 15 15 LEU CA C 13 55.008 0.172 . . . . . . A 15 LEU CA . 25924 1
107 . 1 . 1 15 15 LEU CB C 13 39.276 0.206 . . . . . . A 15 LEU CB . 25924 1
108 . 1 . 1 15 15 LEU CG C 13 24.636 0 . . . . . . A 15 LEU CG . 25924 1
109 . 1 . 1 15 15 LEU CD1 C 13 22.508 0.039 . . . . . . A 15 LEU CD1 . 25924 1
110 . 1 . 1 15 15 LEU CD2 C 13 21.074 0 . . . . . . A 15 LEU CD2 . 25924 1
111 . 1 . 1 15 15 LEU N N 15 120.206 0.026 . . . . . . A 15 LEU N . 25924 1
112 . 1 . 1 16 16 THR H H 1 7.636 0.004 . . . . . . A 16 THR H . 25924 1
113 . 1 . 1 16 16 THR HA H 1 4.188 0.012 . . . . . . A 16 THR HA . 25924 1
114 . 1 . 1 16 16 THR HB H 1 3.92 0 . . . . . . A 16 THR HB . 25924 1
115 . 1 . 1 16 16 THR HG21 H 1 1.32 0.006 . . . . . . A 16 THR HG21 . 25924 1
116 . 1 . 1 16 16 THR HG22 H 1 1.32 0.006 . . . . . . A 16 THR HG22 . 25924 1
117 . 1 . 1 16 16 THR HG23 H 1 1.32 0.006 . . . . . . A 16 THR HG23 . 25924 1
118 . 1 . 1 16 16 THR C C 13 172.543 0.003 . . . . . . A 16 THR C . 25924 1
119 . 1 . 1 16 16 THR CA C 13 61.556 0.162 . . . . . . A 16 THR CA . 25924 1
120 . 1 . 1 16 16 THR CB C 13 67.074 0.253 . . . . . . A 16 THR CB . 25924 1
121 . 1 . 1 16 16 THR CG2 C 13 19.069 0 . . . . . . A 16 THR CG2 . 25924 1
122 . 1 . 1 16 16 THR N N 15 111.015 0.032 . . . . . . A 16 THR N . 25924 1
123 . 1 . 1 17 17 LEU H H 1 7.364 0.005 . . . . . . A 17 LEU H . 25924 1
124 . 1 . 1 17 17 LEU HA H 1 4.366 0.008 . . . . . . A 17 LEU HA . 25924 1
125 . 1 . 1 17 17 LEU HB2 H 1 1.744 0.002 . . . . . . A 17 LEU HB2 . 25924 1
126 . 1 . 1 17 17 LEU HG H 1 1.502 0.197 . . . . . . A 17 LEU HG . 25924 1
127 . 1 . 1 17 17 LEU HD11 H 1 0.898 0 . . . . . . A 17 LEU HD11 . 25924 1
128 . 1 . 1 17 17 LEU HD12 H 1 0.898 0 . . . . . . A 17 LEU HD12 . 25924 1
129 . 1 . 1 17 17 LEU HD13 H 1 0.898 0 . . . . . . A 17 LEU HD13 . 25924 1
130 . 1 . 1 17 17 LEU C C 13 174.215 0.003 . . . . . . A 17 LEU C . 25924 1
131 . 1 . 1 17 17 LEU CA C 13 52.269 0.113 . . . . . . A 17 LEU CA . 25924 1
132 . 1 . 1 17 17 LEU CB C 13 39.018 0.141 . . . . . . A 17 LEU CB . 25924 1
133 . 1 . 1 17 17 LEU CG C 13 23.628 0 . . . . . . A 17 LEU CG . 25924 1
134 . 1 . 1 17 17 LEU CD1 C 13 20.678 0 . . . . . . A 17 LEU CD1 . 25924 1
135 . 1 . 1 17 17 LEU CD2 C 13 18.833 0 . . . . . . A 17 LEU CD2 . 25924 1
136 . 1 . 1 17 17 LEU N N 15 121.097 0.026 . . . . . . A 17 LEU N . 25924 1
137 . 1 . 1 18 18 ARG H H 1 7.555 0.016 . . . . . . A 18 ARG H . 25924 1
138 . 1 . 1 18 18 ARG HA H 1 4.371 0.013 . . . . . . A 18 ARG HA . 25924 1
139 . 1 . 1 18 18 ARG HB2 H 1 1.851 0.002 . . . . . . A 18 ARG HB2 . 25924 1
140 . 1 . 1 18 18 ARG HG2 H 1 1.588 0.008 . . . . . . A 18 ARG HG2 . 25924 1
141 . 1 . 1 18 18 ARG HD2 H 1 3.104 0.022 . . . . . . A 18 ARG HD2 . 25924 1
142 . 1 . 1 18 18 ARG C C 13 173.362 0.004 . . . . . . A 18 ARG C . 25924 1
143 . 1 . 1 18 18 ARG CA C 13 53.709 0.069 . . . . . . A 18 ARG CA . 25924 1
144 . 1 . 1 18 18 ARG CB C 13 28.038 0.103 . . . . . . A 18 ARG CB . 25924 1
145 . 1 . 1 18 18 ARG CG C 13 26.052 0 . . . . . . A 18 ARG CG . 25924 1
146 . 1 . 1 18 18 ARG CD C 13 41.199 0 . . . . . . A 18 ARG CD . 25924 1
147 . 1 . 1 18 18 ARG N N 15 120.709 0.03 . . . . . . A 18 ARG N . 25924 1
148 . 1 . 1 19 19 THR H H 1 8.54 0.004 . . . . . . A 19 THR H . 25924 1
149 . 1 . 1 19 19 THR HA H 1 4.387 0.005 . . . . . . A 19 THR HA . 25924 1
150 . 1 . 1 19 19 THR HG21 H 1 1.144 0.023 . . . . . . A 19 THR HG21 . 25924 1
151 . 1 . 1 19 19 THR HG22 H 1 1.144 0.023 . . . . . . A 19 THR HG22 . 25924 1
152 . 1 . 1 19 19 THR HG23 H 1 1.144 0.023 . . . . . . A 19 THR HG23 . 25924 1
153 . 1 . 1 19 19 THR C C 13 171.58 0.005 . . . . . . A 19 THR C . 25924 1
154 . 1 . 1 19 19 THR CA C 13 58.936 0.195 . . . . . . A 19 THR CA . 25924 1
155 . 1 . 1 19 19 THR CB C 13 67.672 0.23 . . . . . . A 19 THR CB . 25924 1
156 . 1 . 1 19 19 THR CG2 C 13 18.956 0 . . . . . . A 19 THR CG2 . 25924 1
157 . 1 . 1 19 19 THR N N 15 118.668 0.03 . . . . . . A 19 THR N . 25924 1
158 . 1 . 1 20 20 GLU H H 1 8.586 0.004 . . . . . . A 20 GLU H . 25924 1
159 . 1 . 1 20 20 GLU HA H 1 4.075 0.012 . . . . . . A 20 GLU HA . 25924 1
160 . 1 . 1 20 20 GLU HG2 H 1 2.196 0 . . . . . . A 20 GLU HG2 . 25924 1
161 . 1 . 1 20 20 GLU HG3 H 1 2.196 0 . . . . . . A 20 GLU HG3 . 25924 1
162 . 1 . 1 20 20 GLU C C 13 174.446 0.011 . . . . . . A 20 GLU C . 25924 1
163 . 1 . 1 20 20 GLU CA C 13 54.949 0.134 . . . . . . A 20 GLU CA . 25924 1
164 . 1 . 1 20 20 GLU CB C 13 26.872 0.03 . . . . . . A 20 GLU CB . 25924 1
165 . 1 . 1 20 20 GLU CG C 13 33.61 0 . . . . . . A 20 GLU CG . 25924 1
166 . 1 . 1 20 20 GLU N N 15 124.039 0.038 . . . . . . A 20 GLU N . 25924 1
167 . 1 . 1 21 21 GLY H H 1 8.552 0.005 . . . . . . A 21 GLY H . 25924 1
168 . 1 . 1 21 21 GLY HA2 H 1 3.733 0 . . . . . . A 21 GLY HA2 . 25924 1
169 . 1 . 1 21 21 GLY HA3 H 1 4.046 0.007 . . . . . . A 21 GLY HA3 . 25924 1
170 . 1 . 1 21 21 GLY C C 13 171.105 0.001 . . . . . . A 21 GLY C . 25924 1
171 . 1 . 1 21 21 GLY CA C 13 42.662 0.129 . . . . . . A 21 GLY CA . 25924 1
172 . 1 . 1 21 21 GLY N N 15 111.169 0.037 . . . . . . A 21 GLY N . 25924 1
173 . 1 . 1 22 22 LYS H H 1 7.798 0.004 . . . . . . A 22 LYS H . 25924 1
174 . 1 . 1 22 22 LYS HA H 1 4.453 0.012 . . . . . . A 22 LYS HA . 25924 1
175 . 1 . 1 22 22 LYS HB2 H 1 1.733 0 . . . . . . A 22 LYS HB2 . 25924 1
176 . 1 . 1 22 22 LYS HB3 H 1 1.733 0 . . . . . . A 22 LYS HB3 . 25924 1
177 . 1 . 1 22 22 LYS HG2 H 1 1.316 0 . . . . . . A 22 LYS HG2 . 25924 1
178 . 1 . 1 22 22 LYS HG3 H 1 1.316 0 . . . . . . A 22 LYS HG3 . 25924 1
179 . 1 . 1 22 22 LYS HD2 H 1 1.599 0 . . . . . . A 22 LYS HD2 . 25924 1
180 . 1 . 1 22 22 LYS HD3 H 1 1.599 0 . . . . . . A 22 LYS HD3 . 25924 1
181 . 1 . 1 22 22 LYS HE2 H 1 2.93 0 . . . . . . A 22 LYS HE2 . 25924 1
182 . 1 . 1 22 22 LYS HE3 H 1 2.93 0 . . . . . . A 22 LYS HE3 . 25924 1
183 . 1 . 1 22 22 LYS C C 13 173.525 0.004 . . . . . . A 22 LYS C . 25924 1
184 . 1 . 1 22 22 LYS CA C 13 52.416 0.109 . . . . . . A 22 LYS CA . 25924 1
185 . 1 . 1 22 22 LYS CB C 13 31.336 0.058 . . . . . . A 22 LYS CB . 25924 1
186 . 1 . 1 22 22 LYS CG C 13 21.849 0 . . . . . . A 22 LYS CG . 25924 1
187 . 1 . 1 22 22 LYS CD C 13 25.839 0 . . . . . . A 22 LYS CD . 25924 1
188 . 1 . 1 22 22 LYS CE C 13 39.669 0 . . . . . . A 22 LYS CE . 25924 1
189 . 1 . 1 22 22 LYS N N 15 119.376 0.048 . . . . . . A 22 LYS N . 25924 1
190 . 1 . 1 23 23 GLU C C 13 172.069 0 . . . . . . A 23 GLU C . 25924 1
191 . 1 . 1 23 23 GLU CA C 13 51.739 0 . . . . . . A 23 GLU CA . 25924 1
192 . 1 . 1 23 23 GLU CB C 13 26.486 0 . . . . . . A 23 GLU CB . 25924 1
193 . 1 . 1 23 23 GLU N N 15 122.631 0.052 . . . . . . A 23 GLU N . 25924 1
194 . 1 . 1 24 24 PRO HA H 1 4.402 0.007 . . . . . . A 24 PRO HA . 25924 1
195 . 1 . 1 24 24 PRO HB2 H 1 1.871 0.01 . . . . . . A 24 PRO HB2 . 25924 1
196 . 1 . 1 24 24 PRO HB3 H 1 2.042 0 . . . . . . A 24 PRO HB3 . 25924 1
197 . 1 . 1 24 24 PRO HD2 H 1 3.688 0 . . . . . . A 24 PRO HD2 . 25924 1
198 . 1 . 1 24 24 PRO HD3 H 1 3.688 0 . . . . . . A 24 PRO HD3 . 25924 1
199 . 1 . 1 24 24 PRO C C 13 173.547 0.003 . . . . . . A 24 PRO C . 25924 1
200 . 1 . 1 24 24 PRO CA C 13 60.521 0.199 . . . . . . A 24 PRO CA . 25924 1
201 . 1 . 1 24 24 PRO CB C 13 29.522 0.172 . . . . . . A 24 PRO CB . 25924 1
202 . 1 . 1 24 24 PRO CG C 13 24.731 0 . . . . . . A 24 PRO CG . 25924 1
203 . 1 . 1 24 24 PRO CD C 13 48.156 0 . . . . . . A 24 PRO CD . 25924 1
204 . 1 . 1 25 25 ASP H H 1 8.232 0.004 . . . . . . A 25 ASP H . 25924 1
205 . 1 . 1 25 25 ASP HA H 1 4.657 0.002 . . . . . . A 25 ASP HA . 25924 1
206 . 1 . 1 25 25 ASP HB2 H 1 2.287 0.01 . . . . . . A 25 ASP HB2 . 25924 1
207 . 1 . 1 25 25 ASP HB3 H 1 2.638 0 . . . . . . A 25 ASP HB3 . 25924 1
208 . 1 . 1 25 25 ASP C C 13 171.891 0.006 . . . . . . A 25 ASP C . 25924 1
209 . 1 . 1 25 25 ASP CA C 13 53.718 3.286 . . . . . . A 25 ASP CA . 25924 1
210 . 1 . 1 25 25 ASP CB C 13 40.677 0.211 . . . . . . A 25 ASP CB . 25924 1
211 . 1 . 1 25 25 ASP N N 15 121.674 0.026 . . . . . . A 25 ASP N . 25924 1
212 . 1 . 1 26 26 ILE H H 1 8.108 0.002 . . . . . . A 26 ILE H . 25924 1
213 . 1 . 1 26 26 ILE C C 13 171.291 0 . . . . . . A 26 ILE C . 25924 1
214 . 1 . 1 26 26 ILE CA C 13 55.315 0 . . . . . . A 26 ILE CA . 25924 1
215 . 1 . 1 26 26 ILE CB C 13 37.365 0 . . . . . . A 26 ILE CB . 25924 1
216 . 1 . 1 26 26 ILE N N 15 116.402 0.032 . . . . . . A 26 ILE N . 25924 1
217 . 1 . 1 27 27 PRO HA H 1 4.723 0.001 . . . . . . A 27 PRO HA . 25924 1
218 . 1 . 1 27 27 PRO HB2 H 1 1.999 0 . . . . . . A 27 PRO HB2 . 25924 1
219 . 1 . 1 27 27 PRO HG2 H 1 1.755 0 . . . . . . A 27 PRO HG2 . 25924 1
220 . 1 . 1 27 27 PRO HD2 H 1 3.688 0 . . . . . . A 27 PRO HD2 . 25924 1
221 . 1 . 1 27 27 PRO C C 13 172.234 0.003 . . . . . . A 27 PRO C . 25924 1
222 . 1 . 1 27 27 PRO CA C 13 60.676 0.194 . . . . . . A 27 PRO CA . 25924 1
223 . 1 . 1 27 27 PRO CB C 13 29.51 0.162 . . . . . . A 27 PRO CB . 25924 1
224 . 1 . 1 27 27 PRO CG C 13 26.057 0 . . . . . . A 27 PRO CG . 25924 1
225 . 1 . 1 27 27 PRO CD C 13 48.353 0 . . . . . . A 27 PRO CD . 25924 1
226 . 1 . 1 28 28 LEU H H 1 8.477 0.006 . . . . . . A 28 LEU H . 25924 1
227 . 1 . 1 28 28 LEU HA H 1 4.712 0.009 . . . . . . A 28 LEU HA . 25924 1
228 . 1 . 1 28 28 LEU HB2 H 1 1.564 0.017 . . . . . . A 28 LEU HB2 . 25924 1
229 . 1 . 1 28 28 LEU HG H 1 1.596 0.008 . . . . . . A 28 LEU HG . 25924 1
230 . 1 . 1 28 28 LEU HD11 H 1 0.818 0.01 . . . . . . A 28 LEU HD11 . 25924 1
231 . 1 . 1 28 28 LEU HD12 H 1 0.818 0.01 . . . . . . A 28 LEU HD12 . 25924 1
232 . 1 . 1 28 28 LEU HD13 H 1 0.818 0.01 . . . . . . A 28 LEU HD13 . 25924 1
233 . 1 . 1 28 28 LEU C C 13 172.463 0.004 . . . . . . A 28 LEU C . 25924 1
234 . 1 . 1 28 28 LEU CA C 13 50.999 0.037 . . . . . . A 28 LEU CA . 25924 1
235 . 1 . 1 28 28 LEU CB C 13 42.433 0.126 . . . . . . A 28 LEU CB . 25924 1
236 . 1 . 1 28 28 LEU CG C 13 24.366 0 . . . . . . A 28 LEU CG . 25924 1
237 . 1 . 1 28 28 LEU CD1 C 13 21.813 0 . . . . . . A 28 LEU CD1 . 25924 1
238 . 1 . 1 28 28 LEU CD2 C 13 21.011 0 . . . . . . A 28 LEU CD2 . 25924 1
239 . 1 . 1 28 28 LEU N N 15 124.504 0.035 . . . . . . A 28 LEU N . 25924 1
240 . 1 . 1 29 29 TYR H H 1 8.907 0.004 . . . . . . A 29 TYR H . 25924 1
241 . 1 . 1 29 29 TYR HA H 1 5.285 0.016 . . . . . . A 29 TYR HA . 25924 1
242 . 1 . 1 29 29 TYR HB2 H 1 2.797 0.008 . . . . . . A 29 TYR HB2 . 25924 1
243 . 1 . 1 29 29 TYR HB3 H 1 3.471 0 . . . . . . A 29 TYR HB3 . 25924 1
244 . 1 . 1 29 29 TYR C C 13 173.614 0.003 . . . . . . A 29 TYR C . 25924 1
245 . 1 . 1 29 29 TYR CA C 13 54.959 0.122 . . . . . . A 29 TYR CA . 25924 1
246 . 1 . 1 29 29 TYR CB C 13 37.328 0.101 . . . . . . A 29 TYR CB . 25924 1
247 . 1 . 1 29 29 TYR N N 15 123.137 0.04 . . . . . . A 29 TYR N . 25924 1
248 . 1 . 1 30 30 LYS H H 1 9.344 0.021 . . . . . . A 30 LYS H . 25924 1
249 . 1 . 1 30 30 LYS C C 13 172.5 0 . . . . . . A 30 LYS C . 25924 1
250 . 1 . 1 30 30 LYS CA C 13 52.399 0 . . . . . . A 30 LYS CA . 25924 1
251 . 1 . 1 30 30 LYS CB C 13 34.086 0 . . . . . . A 30 LYS CB . 25924 1
252 . 1 . 1 30 30 LYS N N 15 122.426 0.037 . . . . . . A 30 LYS N . 25924 1
253 . 1 . 1 31 31 THR HA H 1 4.51 0.006 . . . . . . A 31 THR HA . 25924 1
254 . 1 . 1 31 31 THR HB H 1 3.911 0.013 . . . . . . A 31 THR HB . 25924 1
255 . 1 . 1 31 31 THR HG21 H 1 1.22 0.02 . . . . . . A 31 THR HG1 . 25924 1
256 . 1 . 1 31 31 THR HG22 H 1 1.22 0.02 . . . . . . A 31 THR HG1 . 25924 1
257 . 1 . 1 31 31 THR HG23 H 1 1.22 0.02 . . . . . . A 31 THR HG1 . 25924 1
258 . 1 . 1 31 31 THR CA C 13 60.787 0.01 . . . . . . A 31 THR CA . 25924 1
259 . 1 . 1 31 31 THR CG2 C 13 20.082 0 . . . . . . A 31 THR CG2 . 25924 1
260 . 1 . 1 32 32 LEU H H 1 9.019 0.007 . . . . . . A 32 LEU H . 25924 1
261 . 1 . 1 32 32 LEU HA H 1 4.44 0.016 . . . . . . A 32 LEU HA . 25924 1
262 . 1 . 1 32 32 LEU HB2 H 1 1.637 0.006 . . . . . . A 32 LEU HB2 . 25924 1
263 . 1 . 1 32 32 LEU HG H 1 1.508 0.008 . . . . . . A 32 LEU HG . 25924 1
264 . 1 . 1 32 32 LEU HD11 H 1 0.883 0.021 . . . . . . A 32 LEU HD11 . 25924 1
265 . 1 . 1 32 32 LEU HD12 H 1 0.883 0.021 . . . . . . A 32 LEU HD12 . 25924 1
266 . 1 . 1 32 32 LEU HD13 H 1 0.883 0.021 . . . . . . A 32 LEU HD13 . 25924 1
267 . 1 . 1 32 32 LEU C C 13 174.368 0.005 . . . . . . A 32 LEU C . 25924 1
268 . 1 . 1 32 32 LEU CA C 13 52.683 0.128 . . . . . . A 32 LEU CA . 25924 1
269 . 1 . 1 32 32 LEU CB C 13 40.207 0.063 . . . . . . A 32 LEU CB . 25924 1
270 . 1 . 1 32 32 LEU CG C 13 23.197 0 . . . . . . A 32 LEU CG . 25924 1
271 . 1 . 1 32 32 LEU CD1 C 13 19.864 0 . . . . . . A 32 LEU CD1 . 25924 1
272 . 1 . 1 32 32 LEU CD2 C 13 19.864 0 . . . . . . A 32 LEU CD2 . 25924 1
273 . 1 . 1 32 32 LEU N N 15 129.198 0.049 . . . . . . A 32 LEU N . 25924 1
274 . 1 . 1 33 33 GLN H H 1 7.689 0.01 . . . . . . A 33 GLN H . 25924 1
275 . 1 . 1 33 33 GLN HG2 H 1 2.228 0 . . . . . . A 33 GLN HG2 . 25924 1
276 . 1 . 1 33 33 GLN HG3 H 1 2.228 0 . . . . . . A 33 GLN HG3 . 25924 1
277 . 1 . 1 33 33 GLN C C 13 171.615 0.02 . . . . . . A 33 GLN C . 25924 1
278 . 1 . 1 33 33 GLN CA C 13 53.264 0.158 . . . . . . A 33 GLN CA . 25924 1
279 . 1 . 1 33 33 GLN CB C 13 28.844 0.114 . . . . . . A 33 GLN CB . 25924 1
280 . 1 . 1 33 33 GLN CG C 13 31.205 0 . . . . . . A 33 GLN CG . 25924 1
281 . 1 . 1 33 33 GLN N N 15 115.992 0.039 . . . . . . A 33 GLN N . 25924 1
282 . 1 . 1 34 34 THR H H 1 8.345 0.006 . . . . . . A 34 THR H . 25924 1
283 . 1 . 1 34 34 THR HA H 1 4.489 0.008 . . . . . . A 34 THR HA . 25924 1
284 . 1 . 1 34 34 THR HG21 H 1 0.597 0.002 . . . . . . A 34 THR HG1 . 25924 1
285 . 1 . 1 34 34 THR HG22 H 1 0.597 0.002 . . . . . . A 34 THR HG1 . 25924 1
286 . 1 . 1 34 34 THR HG23 H 1 0.597 0.002 . . . . . . A 34 THR HG1 . 25924 1
287 . 1 . 1 34 34 THR C C 13 170.622 0.013 . . . . . . A 34 THR C . 25924 1
288 . 1 . 1 34 34 THR CA C 13 59.144 0.069 . . . . . . A 34 THR CA . 25924 1
289 . 1 . 1 34 34 THR CB C 13 67.805 0.131 . . . . . . A 34 THR CB . 25924 1
290 . 1 . 1 34 34 THR CG2 C 13 18.915 0 . . . . . . A 34 THR CG2 . 25924 1
291 . 1 . 1 34 34 THR N N 15 119.608 0.027 . . . . . . A 34 THR N . 25924 1
292 . 1 . 1 35 35 VAL H H 1 8.134 0.004 . . . . . . A 35 VAL H . 25924 1
293 . 1 . 1 35 35 VAL HA H 1 4.492 0.003 . . . . . . A 35 VAL HA . 25924 1
294 . 1 . 1 35 35 VAL HB H 1 1.934 0.011 . . . . . . A 35 VAL HB . 25924 1
295 . 1 . 1 35 35 VAL HG11 H 1 0.754 0.006 . . . . . . A 35 VAL HG11 . 25924 1
296 . 1 . 1 35 35 VAL HG12 H 1 0.754 0.006 . . . . . . A 35 VAL HG12 . 25924 1
297 . 1 . 1 35 35 VAL HG13 H 1 0.754 0.006 . . . . . . A 35 VAL HG13 . 25924 1
298 . 1 . 1 35 35 VAL C C 13 172.242 0.007 . . . . . . A 35 VAL C . 25924 1
299 . 1 . 1 35 35 VAL CA C 13 57.697 0.136 . . . . . . A 35 VAL CA . 25924 1
300 . 1 . 1 35 35 VAL CB C 13 32.804 0.125 . . . . . . A 35 VAL CB . 25924 1
301 . 1 . 1 35 35 VAL CG1 C 13 17.159 0 . . . . . . A 35 VAL CG1 . 25924 1
302 . 1 . 1 35 35 VAL CG2 C 13 18.595 0 . . . . . . A 35 VAL CG2 . 25924 1
303 . 1 . 1 35 35 VAL N N 15 120.795 0.022 . . . . . . A 35 VAL N . 25924 1
304 . 1 . 1 36 36 GLY H H 1 8.229 0.005 . . . . . . A 36 GLY H . 25924 1
305 . 1 . 1 36 36 GLY C C 13 169.453 0 . . . . . . A 36 GLY C . 25924 1
306 . 1 . 1 36 36 GLY CA C 13 41.094 0 . . . . . . A 36 GLY CA . 25924 1
307 . 1 . 1 36 36 GLY N N 15 110.608 0.042 . . . . . . A 36 GLY N . 25924 1
308 . 1 . 1 39 39 HIS HA H 1 4.631 0.041 . . . . . . A 39 HIS HA . 25924 1
309 . 1 . 1 39 39 HIS HB2 H 1 3.3 0 . . . . . . A 39 HIS HB2 . 25924 1
310 . 1 . 1 39 39 HIS HB3 H 1 2.885 0 . . . . . . A 39 HIS HB3 . 25924 1
311 . 1 . 1 39 39 HIS C C 13 172.14 0 . . . . . . A 39 HIS C . 25924 1
312 . 1 . 1 39 39 HIS CA C 13 53.584 0.219 . . . . . . A 39 HIS CA . 25924 1
313 . 1 . 1 39 39 HIS CB C 13 27.736 0.061 . . . . . . A 39 HIS CB . 25924 1
314 . 1 . 1 40 40 ALA H H 1 7.582 0.003 . . . . . . A 40 ALA H . 25924 1
315 . 1 . 1 40 40 ALA HA H 1 4.422 0.008 . . . . . . A 40 ALA HA . 25924 1
316 . 1 . 1 40 40 ALA HB1 H 1 0.896 0.007 . . . . . . A 40 ALA HB1 . 25924 1
317 . 1 . 1 40 40 ALA HB2 H 1 0.896 0.007 . . . . . . A 40 ALA HB2 . 25924 1
318 . 1 . 1 40 40 ALA HB3 H 1 0.896 0.007 . . . . . . A 40 ALA HB3 . 25924 1
319 . 1 . 1 40 40 ALA C C 13 171.693 0.001 . . . . . . A 40 ALA C . 25924 1
320 . 1 . 1 40 40 ALA CA C 13 48.979 0.006 . . . . . . A 40 ALA CA . 25924 1
321 . 1 . 1 40 40 ALA CB C 13 15.335 0.075 . . . . . . A 40 ALA CB . 25924 1
322 . 1 . 1 40 40 ALA N N 15 128.155 0.031 . . . . . . A 40 ALA N . 25924 1
323 . 1 . 1 41 41 ARG H H 1 8.09 0.007 . . . . . . A 41 ARG H . 25924 1
324 . 1 . 1 41 41 ARG HA H 1 4.467 0.008 . . . . . . A 41 ARG HA . 25924 1
325 . 1 . 1 41 41 ARG HB2 H 1 1.609 0.01 . . . . . . A 41 ARG HB2 . 25924 1
326 . 1 . 1 41 41 ARG HG2 H 1 1.234 0.007 . . . . . . A 41 ARG HG2 . 25924 1
327 . 1 . 1 41 41 ARG HD2 H 1 2.664 0.007 . . . . . . A 41 ARG HD2 . 25924 1
328 . 1 . 1 41 41 ARG C C 13 174.236 0.007 . . . . . . A 41 ARG C . 25924 1
329 . 1 . 1 41 41 ARG CA C 13 52.715 0.123 . . . . . . A 41 ARG CA . 25924 1
330 . 1 . 1 41 41 ARG CB C 13 29.506 0.168 . . . . . . A 41 ARG CB . 25924 1
331 . 1 . 1 41 41 ARG CG C 13 23.465 0 . . . . . . A 41 ARG CG . 25924 1
332 . 1 . 1 41 41 ARG CD C 13 40.879 0 . . . . . . A 41 ARG CD . 25924 1
333 . 1 . 1 41 41 ARG N N 15 122.997 0.033 . . . . . . A 41 ARG N . 25924 1
334 . 1 . 1 42 42 THR H H 1 8.572 0.008 . . . . . . A 42 THR H . 25924 1
335 . 1 . 1 42 42 THR HA H 1 4.448 0.008 . . . . . . A 42 THR HA . 25924 1
336 . 1 . 1 42 42 THR HB H 1 3.696 0.006 . . . . . . A 42 THR HB . 25924 1
337 . 1 . 1 42 42 THR HG21 H 1 1.02 0.073 . . . . . . A 42 THR HG1 . 25924 1
338 . 1 . 1 42 42 THR HG22 H 1 1.02 0.073 . . . . . . A 42 THR HG1 . 25924 1
339 . 1 . 1 42 42 THR HG23 H 1 1.02 0.073 . . . . . . A 42 THR HG1 . 25924 1
340 . 1 . 1 42 42 THR C C 13 171.192 0.01 . . . . . . A 42 THR C . 25924 1
341 . 1 . 1 42 42 THR CA C 13 59.75 0.231 . . . . . . A 42 THR CA . 25924 1
342 . 1 . 1 42 42 THR CB C 13 67.917 0.118 . . . . . . A 42 THR CB . 25924 1
343 . 1 . 1 42 42 THR CG2 C 13 18.884 0 . . . . . . A 42 THR CG2 . 25924 1
344 . 1 . 1 42 42 THR N N 15 116.202 0.028 . . . . . . A 42 THR N . 25924 1
345 . 1 . 1 43 43 TYR H H 1 9.255 0.006 . . . . . . A 43 TYR H . 25924 1
346 . 1 . 1 43 43 TYR HA H 1 4.719 0.023 . . . . . . A 43 TYR HA . 25924 1
347 . 1 . 1 43 43 TYR HB2 H 1 2.492 0 . . . . . . A 43 TYR HB2 . 25924 1
348 . 1 . 1 43 43 TYR HB3 H 1 2.593 0.021 . . . . . . A 43 TYR HB3 . 25924 1
349 . 1 . 1 43 43 TYR C C 13 172.16 0.014 . . . . . . A 43 TYR C . 25924 1
350 . 1 . 1 43 43 TYR CA C 13 54.921 0.114 . . . . . . A 43 TYR CA . 25924 1
351 . 1 . 1 43 43 TYR CB C 13 38.22 0.07 . . . . . . A 43 TYR CB . 25924 1
352 . 1 . 1 43 43 TYR N N 15 127.687 0.042 . . . . . . A 43 TYR N . 25924 1
353 . 1 . 1 44 44 THR H H 1 8.699 0.012 . . . . . . A 44 THR H . 25924 1
354 . 1 . 1 44 44 THR HA H 1 5.162 0.004 . . . . . . A 44 THR HA . 25924 1
355 . 1 . 1 44 44 THR HG21 H 1 1.187 0.015 . . . . . . A 44 THR HG1 . 25924 1
356 . 1 . 1 44 44 THR HG22 H 1 1.187 0.015 . . . . . . A 44 THR HG1 . 25924 1
357 . 1 . 1 44 44 THR HG23 H 1 1.187 0.015 . . . . . . A 44 THR HG1 . 25924 1
358 . 1 . 1 44 44 THR C C 13 171.33 0.014 . . . . . . A 44 THR C . 25924 1
359 . 1 . 1 44 44 THR CA C 13 59.299 0.082 . . . . . . A 44 THR CA . 25924 1
360 . 1 . 1 44 44 THR CB C 13 67.619 0.138 . . . . . . A 44 THR CB . 25924 1
361 . 1 . 1 44 44 THR N N 15 117.178 0.043 . . . . . . A 44 THR N . 25924 1
362 . 1 . 1 45 45 VAL H H 1 9.331 0.006 . . . . . . A 45 VAL H . 25924 1
363 . 1 . 1 45 45 VAL HA H 1 4.177 0 . . . . . . A 45 VAL HA . 25924 1
364 . 1 . 1 45 45 VAL HB H 1 1.527 0.004 . . . . . . A 45 VAL HB . 25924 1
365 . 1 . 1 45 45 VAL HG11 H 1 0.905 0.013 . . . . . . A 45 VAL HG11 . 25924 1
366 . 1 . 1 45 45 VAL HG12 H 1 0.905 0.013 . . . . . . A 45 VAL HG12 . 25924 1
367 . 1 . 1 45 45 VAL HG13 H 1 0.905 0.013 . . . . . . A 45 VAL HG13 . 25924 1
368 . 1 . 1 45 45 VAL C C 13 169.635 0.005 . . . . . . A 45 VAL C . 25924 1
369 . 1 . 1 45 45 VAL CA C 13 57.558 0.204 . . . . . . A 45 VAL CA . 25924 1
370 . 1 . 1 45 45 VAL CB C 13 32.829 0.095 . . . . . . A 45 VAL CB . 25924 1
371 . 1 . 1 45 45 VAL CG1 C 13 18.666 0 . . . . . . A 45 VAL CG1 . 25924 1
372 . 1 . 1 45 45 VAL CG2 C 13 20.235 0 . . . . . . A 45 VAL CG2 . 25924 1
373 . 1 . 1 45 45 VAL N N 15 128.199 0.038 . . . . . . A 45 VAL N . 25924 1
374 . 1 . 1 46 46 ALA H H 1 8.961 0.005 . . . . . . A 46 ALA H . 25924 1
375 . 1 . 1 46 46 ALA HA H 1 5.26 0.013 . . . . . . A 46 ALA HA . 25924 1
376 . 1 . 1 46 46 ALA HB1 H 1 1.332 0 . . . . . . A 46 ALA HB1 . 25924 1
377 . 1 . 1 46 46 ALA HB2 H 1 1.332 0 . . . . . . A 46 ALA HB2 . 25924 1
378 . 1 . 1 46 46 ALA HB3 H 1 1.332 0 . . . . . . A 46 ALA HB3 . 25924 1
379 . 1 . 1 46 46 ALA C C 13 171.973 0.01 . . . . . . A 46 ALA C . 25924 1
380 . 1 . 1 46 46 ALA CA C 13 46.865 0.014 . . . . . . A 46 ALA CA . 25924 1
381 . 1 . 1 46 46 ALA CB C 13 21.198 0.02 . . . . . . A 46 ALA CB . 25924 1
382 . 1 . 1 46 46 ALA N N 15 126.929 0.057 . . . . . . A 46 ALA N . 25924 1
383 . 1 . 1 47 47 VAL H H 1 8.248 0.006 . . . . . . A 47 VAL H . 25924 1
384 . 1 . 1 47 47 VAL HA H 1 4.961 0.019 . . . . . . A 47 VAL HA . 25924 1
385 . 1 . 1 47 47 VAL HB H 1 1.312 0.009 . . . . . . A 47 VAL HB . 25924 1
386 . 1 . 1 47 47 VAL HG11 H 1 0.062 0.048 . . . . . . A 47 VAL HG11 . 25924 1
387 . 1 . 1 47 47 VAL HG12 H 1 0.062 0.048 . . . . . . A 47 VAL HG12 . 25924 1
388 . 1 . 1 47 47 VAL HG13 H 1 0.062 0.048 . . . . . . A 47 VAL HG13 . 25924 1
389 . 1 . 1 47 47 VAL HG21 H 1 0.408 0.007 . . . . . . A 47 VAL HG21 . 25924 1
390 . 1 . 1 47 47 VAL HG22 H 1 0.408 0.007 . . . . . . A 47 VAL HG22 . 25924 1
391 . 1 . 1 47 47 VAL HG23 H 1 0.408 0.007 . . . . . . A 47 VAL HG23 . 25924 1
392 . 1 . 1 47 47 VAL C C 13 170.285 0.007 . . . . . . A 47 VAL C . 25924 1
393 . 1 . 1 47 47 VAL CA C 13 55.384 0.171 . . . . . . A 47 VAL CA . 25924 1
394 . 1 . 1 47 47 VAL CB C 13 32.098 0.216 . . . . . . A 47 VAL CB . 25924 1
395 . 1 . 1 47 47 VAL CG1 C 13 17.157 0 . . . . . . A 47 VAL CG1 . 25924 1
396 . 1 . 1 47 47 VAL CG2 C 13 20.007 0 . . . . . . A 47 VAL CG2 . 25924 1
397 . 1 . 1 47 47 VAL N N 15 118.914 0.041 . . . . . . A 47 VAL N . 25924 1
398 . 1 . 1 48 48 TYR H H 1 9.274 0.008 . . . . . . A 48 TYR H . 25924 1
399 . 1 . 1 48 48 TYR HA H 1 5.217 0.004 . . . . . . A 48 TYR HA . 25924 1
400 . 1 . 1 48 48 TYR HB2 H 1 2.678 0.005 . . . . . . A 48 TYR HB2 . 25924 1
401 . 1 . 1 48 48 TYR C C 13 172.504 0.004 . . . . . . A 48 TYR C . 25924 1
402 . 1 . 1 48 48 TYR CA C 13 53.61 0.079 . . . . . . A 48 TYR CA . 25924 1
403 . 1 . 1 48 48 TYR CB C 13 40.339 0.203 . . . . . . A 48 TYR CB . 25924 1
404 . 1 . 1 48 48 TYR N N 15 126.815 0.03 . . . . . . A 48 TYR N . 25924 1
405 . 1 . 1 49 49 PHE H H 1 9.024 0.007 . . . . . . A 49 PHE H . 25924 1
406 . 1 . 1 49 49 PHE HA H 1 4.766 0.027 . . . . . . A 49 PHE HA . 25924 1
407 . 1 . 1 49 49 PHE HB2 H 1 2.712 0.006 . . . . . . A 49 PHE HB2 . 25924 1
408 . 1 . 1 49 49 PHE HB3 H 1 2.628 0 . . . . . . A 49 PHE HB3 . 25924 1
409 . 1 . 1 49 49 PHE C C 13 172.39 0.011 . . . . . . A 49 PHE C . 25924 1
410 . 1 . 1 49 49 PHE CA C 13 54.128 0.086 . . . . . . A 49 PHE CA . 25924 1
411 . 1 . 1 49 49 PHE CB C 13 40.24 0.189 . . . . . . A 49 PHE CB . 25924 1
412 . 1 . 1 49 49 PHE N N 15 119.234 0.018 . . . . . . A 49 PHE N . 25924 1
413 . 1 . 1 50 50 LYS H H 1 9.035 0.025 . . . . . . A 50 LYS H . 25924 1
414 . 1 . 1 50 50 LYS HA H 1 3.502 0.015 . . . . . . A 50 LYS HA . 25924 1
415 . 1 . 1 50 50 LYS HB2 H 1 1.336 0.012 . . . . . . A 50 LYS HB2 . 25924 1
416 . 1 . 1 50 50 LYS HE2 H 1 2.759 0.026 . . . . . . A 50 LYS HE2 . 25924 1
417 . 1 . 1 50 50 LYS C C 13 173.659 0.004 . . . . . . A 50 LYS C . 25924 1
418 . 1 . 1 50 50 LYS CA C 13 54.906 0.084 . . . . . . A 50 LYS CA . 25924 1
419 . 1 . 1 50 50 LYS CB C 13 26.726 0.146 . . . . . . A 50 LYS CB . 25924 1
420 . 1 . 1 50 50 LYS CG C 13 18.599 0 . . . . . . A 50 LYS CG . 25924 1
421 . 1 . 1 50 50 LYS CD C 13 19.726 0 . . . . . . A 50 LYS CD . 25924 1
422 . 1 . 1 50 50 LYS CE C 13 39.384 0 . . . . . . A 50 LYS CE . 25924 1
423 . 1 . 1 50 50 LYS N N 15 128.064 0.039 . . . . . . A 50 LYS N . 25924 1
424 . 1 . 1 51 51 GLY H H 1 8.893 0.005 . . . . . . A 51 GLY H . 25924 1
425 . 1 . 1 51 51 GLY HA2 H 1 4.086 0.007 . . . . . . A 51 GLY HA2 . 25924 1
426 . 1 . 1 51 51 GLY HA3 H 1 4.335 0 . . . . . . A 51 GLY HA3 . 25924 1
427 . 1 . 1 51 51 GLY C C 13 170.97 0.004 . . . . . . A 51 GLY C . 25924 1
428 . 1 . 1 51 51 GLY CA C 13 42.553 0.082 . . . . . . A 51 GLY CA . 25924 1
429 . 1 . 1 51 51 GLY N N 15 104.286 0.039 . . . . . . A 51 GLY N . 25924 1
430 . 1 . 1 52 52 GLU H H 1 7.71 0.005 . . . . . . A 52 GLU H . 25924 1
431 . 1 . 1 52 52 GLU HA H 1 4.617 0.055 . . . . . . A 52 GLU HA . 25924 1
432 . 1 . 1 52 52 GLU HB2 H 1 2.04 0.027 . . . . . . A 52 GLU HB2 . 25924 1
433 . 1 . 1 52 52 GLU HG2 H 1 2.221 0 . . . . . . A 52 GLU HG2 . 25924 1
434 . 1 . 1 52 52 GLU C C 13 172.477 0.006 . . . . . . A 52 GLU C . 25924 1
435 . 1 . 1 52 52 GLU CA C 13 51.709 0.204 . . . . . . A 52 GLU CA . 25924 1
436 . 1 . 1 52 52 GLU CB C 13 29.248 0.117 . . . . . . A 52 GLU CB . 25924 1
437 . 1 . 1 52 52 GLU CG C 13 31.954 0 . . . . . . A 52 GLU CG . 25924 1
438 . 1 . 1 52 52 GLU N N 15 121.087 0.041 . . . . . . A 52 GLU N . 25924 1
439 . 1 . 1 53 53 ARG H H 1 8.919 0.011 . . . . . . A 53 ARG H . 25924 1
440 . 1 . 1 53 53 ARG HD2 H 1 2.941 0 . . . . . . A 53 ARG HD2 . 25924 1
441 . 1 . 1 53 53 ARG C C 13 173.977 0.004 . . . . . . A 53 ARG C . 25924 1
442 . 1 . 1 53 53 ARG CA C 13 54.25 0.044 . . . . . . A 53 ARG CA . 25924 1
443 . 1 . 1 53 53 ARG CB C 13 27.373 0.013 . . . . . . A 53 ARG CB . 25924 1
444 . 1 . 1 53 53 ARG CD C 13 41.328 0 . . . . . . A 53 ARG CD . 25924 1
445 . 1 . 1 53 53 ARG N N 15 126.72 0.036 . . . . . . A 53 ARG N . 25924 1
446 . 1 . 1 54 54 ILE H H 1 8.92 0.005 . . . . . . A 54 ILE H . 25924 1
447 . 1 . 1 54 54 ILE HA H 1 4.549 0.018 . . . . . . A 54 ILE HA . 25924 1
448 . 1 . 1 54 54 ILE HB H 1 1.913 0 . . . . . . A 54 ILE HB . 25924 1
449 . 1 . 1 54 54 ILE HG12 H 1 0.865 0.009 . . . . . . A 54 ILE HG12 . 25924 1
450 . 1 . 1 54 54 ILE HG21 H 1 0.662 0.004 . . . . . . A 54 ILE HG21 . 25924 1
451 . 1 . 1 54 54 ILE HG22 H 1 0.662 0.004 . . . . . . A 54 ILE HG22 . 25924 1
452 . 1 . 1 54 54 ILE HG23 H 1 0.662 0.004 . . . . . . A 54 ILE HG23 . 25924 1
453 . 1 . 1 54 54 ILE HD11 H 1 0.443 0.019 . . . . . . A 54 ILE HD11 . 25924 1
454 . 1 . 1 54 54 ILE HD12 H 1 0.443 0.019 . . . . . . A 54 ILE HD12 . 25924 1
455 . 1 . 1 54 54 ILE HD13 H 1 0.443 0.019 . . . . . . A 54 ILE HD13 . 25924 1
456 . 1 . 1 54 54 ILE C C 13 172.161 0.009 . . . . . . A 54 ILE C . 25924 1
457 . 1 . 1 54 54 ILE CA C 13 58.807 0.126 . . . . . . A 54 ILE CA . 25924 1
458 . 1 . 1 54 54 ILE CB C 13 37.207 0.125 . . . . . . A 54 ILE CB . 25924 1
459 . 1 . 1 54 54 ILE CG1 C 13 29.182 0 . . . . . . A 54 ILE CG1 . 25924 1
460 . 1 . 1 54 54 ILE CG2 C 13 15.832 0 . . . . . . A 54 ILE CG2 . 25924 1
461 . 1 . 1 54 54 ILE CD1 C 13 12.548 0 . . . . . . A 54 ILE CD1 . 25924 1
462 . 1 . 1 54 54 ILE N N 15 122.215 0.052 . . . . . . A 54 ILE N . 25924 1
463 . 1 . 1 55 55 GLY H H 1 7.233 0.004 . . . . . . A 55 GLY H . 25924 1
464 . 1 . 1 55 55 GLY HA2 H 1 3.774 0.016 . . . . . . A 55 GLY HA2 . 25924 1
465 . 1 . 1 55 55 GLY C C 13 169.649 0.022 . . . . . . A 55 GLY C . 25924 1
466 . 1 . 1 55 55 GLY CA C 13 42.712 0.25 . . . . . . A 55 GLY CA . 25924 1
467 . 1 . 1 55 55 GLY N N 15 107.034 0.032 . . . . . . A 55 GLY N . 25924 1
468 . 1 . 1 56 56 CYS H H 1 9.739 0.011 . . . . . . A 56 CYS H . 25924 1
469 . 1 . 1 56 56 CYS HA H 1 5.264 0.017 . . . . . . A 56 CYS HA . 25924 1
470 . 1 . 1 56 56 CYS HB2 H 1 3.108 0 . . . . . . A 56 CYS HB2 . 25924 1
471 . 1 . 1 56 56 CYS HB3 H 1 2.897 0.018 . . . . . . A 56 CYS HB3 . 25924 1
472 . 1 . 1 56 56 CYS C C 13 169.55 0.029 . . . . . . A 56 CYS C . 25924 1
473 . 1 . 1 56 56 CYS CA C 13 53.638 0.621 . . . . . . A 56 CYS CA . 25924 1
474 . 1 . 1 56 56 CYS CB C 13 40.291 3.935 . . . . . . A 56 CYS CB . 25924 1
475 . 1 . 1 56 56 CYS N N 15 121.361 0.058 . . . . . . A 56 CYS N . 25924 1
476 . 1 . 1 57 57 GLY H H 1 9.408 0.006 . . . . . . A 57 GLY H . 25924 1
477 . 1 . 1 57 57 GLY HA2 H 1 3.863 0.022 . . . . . . A 57 GLY HA2 . 25924 1
478 . 1 . 1 57 57 GLY HA3 H 1 4.501 0.005 . . . . . . A 57 GLY HA3 . 25924 1
479 . 1 . 1 57 57 GLY C C 13 168.036 0.009 . . . . . . A 57 GLY C . 25924 1
480 . 1 . 1 57 57 GLY CA C 13 41.978 0.032 . . . . . . A 57 GLY CA . 25924 1
481 . 1 . 1 57 57 GLY N N 15 113.662 0.019 . . . . . . A 57 GLY N . 25924 1
482 . 1 . 1 58 58 LYS H H 1 8.427 0.004 . . . . . . A 58 LYS H . 25924 1
483 . 1 . 1 58 58 LYS HA H 1 5.981 0.018 . . . . . . A 58 LYS HA . 25924 1
484 . 1 . 1 58 58 LYS HB2 H 1 1.633 0.018 . . . . . . A 58 LYS HB2 . 25924 1
485 . 1 . 1 58 58 LYS HG2 H 1 1.335 0.012 . . . . . . A 58 LYS HG2 . 25924 1
486 . 1 . 1 58 58 LYS HD2 H 1 1.523 0.007 . . . . . . A 58 LYS HD2 . 25924 1
487 . 1 . 1 58 58 LYS HE2 H 1 2.817 0 . . . . . . A 58 LYS HE2 . 25924 1
488 . 1 . 1 58 58 LYS C C 13 174.185 0.004 . . . . . . A 58 LYS C . 25924 1
489 . 1 . 1 58 58 LYS CA C 13 51.418 0.088 . . . . . . A 58 LYS CA . 25924 1
490 . 1 . 1 58 58 LYS CB C 13 34.533 0.091 . . . . . . A 58 LYS CB . 25924 1
491 . 1 . 1 58 58 LYS CG C 13 21.926 0 . . . . . . A 58 LYS CG . 25924 1
492 . 1 . 1 58 58 LYS CD C 13 26.895 0 . . . . . . A 58 LYS CD . 25924 1
493 . 1 . 1 58 58 LYS CE C 13 39.664 0 . . . . . . A 58 LYS CE . 25924 1
494 . 1 . 1 58 58 LYS N N 15 117.565 0.032 . . . . . . A 58 LYS N . 25924 1
495 . 1 . 1 59 59 GLY H H 1 8.534 0.003 . . . . . . A 59 GLY H . 25924 1
496 . 1 . 1 59 59 GLY C C 13 168.361 0 . . . . . . A 59 GLY C . 25924 1
497 . 1 . 1 59 59 GLY CA C 13 43.281 0 . . . . . . A 59 GLY CA . 25924 1
498 . 1 . 1 59 59 GLY N N 15 106.06 0.025 . . . . . . A 59 GLY N . 25924 1
499 . 1 . 1 60 60 PRO HA H 1 5.242 0.008 . . . . . . A 60 PRO HA . 25924 1
500 . 1 . 1 60 60 PRO HB2 H 1 2.268 0.017 . . . . . . A 60 PRO HB2 . 25924 1
501 . 1 . 1 60 60 PRO HB3 H 1 2.268 0.017 . . . . . . A 60 PRO HB3 . 25924 1
502 . 1 . 1 60 60 PRO HG2 H 1 2.022 0.06 . . . . . . A 60 PRO HG2 . 25924 1
503 . 1 . 1 60 60 PRO HD2 H 1 3.657 0.024 . . . . . . A 60 PRO HD2 . 25924 1
504 . 1 . 1 60 60 PRO HD3 H 1 3.428 0 . . . . . . A 60 PRO HD3 . 25924 1
505 . 1 . 1 60 60 PRO C C 13 172.019 0.012 . . . . . . A 60 PRO C . 25924 1
506 . 1 . 1 60 60 PRO CA C 13 61.161 0.19 . . . . . . A 60 PRO CA . 25924 1
507 . 1 . 1 60 60 PRO CB C 13 29.185 0.049 . . . . . . A 60 PRO CB . 25924 1
508 . 1 . 1 60 60 PRO CG C 13 23.585 0 . . . . . . A 60 PRO CG . 25924 1
509 . 1 . 1 60 60 PRO CD C 13 47.511 0 . . . . . . A 60 PRO CD . 25924 1
510 . 1 . 1 61 61 SER H H 1 7.289 0.006 . . . . . . A 61 SER H . 25924 1
511 . 1 . 1 61 61 SER C C 13 170.857 0 . . . . . . A 61 SER C . 25924 1
512 . 1 . 1 61 61 SER CA C 13 53.387 0 . . . . . . A 61 SER CA . 25924 1
513 . 1 . 1 61 61 SER CB C 13 63.795 0 . . . . . . A 61 SER CB . 25924 1
514 . 1 . 1 61 61 SER N N 15 110.749 0.017 . . . . . . A 61 SER N . 25924 1
515 . 1 . 1 62 62 LYS HA H 1 3.155 0.02 . . . . . . A 62 LYS HA . 25924 1
516 . 1 . 1 62 62 LYS HB2 H 1 1.524 0.034 . . . . . . A 62 LYS HB2 . 25924 1
517 . 1 . 1 62 62 LYS HG2 H 1 0.824 0.009 . . . . . . A 62 LYS HG2 . 25924 1
518 . 1 . 1 62 62 LYS HD2 H 1 1.227 0.036 . . . . . . A 62 LYS HD2 . 25924 1
519 . 1 . 1 62 62 LYS HE2 H 1 2.796 0.016 . . . . . . A 62 LYS HE2 . 25924 1
520 . 1 . 1 62 62 LYS C C 13 175.308 0.001 . . . . . . A 62 LYS C . 25924 1
521 . 1 . 1 62 62 LYS CA C 13 57.915 0.179 . . . . . . A 62 LYS CA . 25924 1
522 . 1 . 1 62 62 LYS CB C 13 28.989 0.312 . . . . . . A 62 LYS CB . 25924 1
523 . 1 . 1 62 62 LYS CG C 13 22.274 0.166 . . . . . . A 62 LYS CG . 25924 1
524 . 1 . 1 62 62 LYS CD C 13 23.303 0.346 . . . . . . A 62 LYS CD . 25924 1
525 . 1 . 1 62 62 LYS CE C 13 39.311 0.055 . . . . . . A 62 LYS CE . 25924 1
526 . 1 . 1 63 63 LYS H H 1 8.246 0.005 . . . . . . A 63 LYS H . 25924 1
527 . 1 . 1 63 63 LYS HA H 1 3.709 0.018 . . . . . . A 63 LYS HA . 25924 1
528 . 1 . 1 63 63 LYS HB2 H 1 1.692 0.045 . . . . . . A 63 LYS HB2 . 25924 1
529 . 1 . 1 63 63 LYS HG2 H 1 1.238 0.034 . . . . . . A 63 LYS HG2 . 25924 1
530 . 1 . 1 63 63 LYS HD2 H 1 1.557 0.006 . . . . . . A 63 LYS HD2 . 25924 1
531 . 1 . 1 63 63 LYS HE2 H 1 2.862 0.032 . . . . . . A 63 LYS HE2 . 25924 1
532 . 1 . 1 63 63 LYS C C 13 175.856 0.003 . . . . . . A 63 LYS C . 25924 1
533 . 1 . 1 63 63 LYS CA C 13 57.097 0.109 . . . . . . A 63 LYS CA . 25924 1
534 . 1 . 1 63 63 LYS CB C 13 29.746 0.294 . . . . . . A 63 LYS CB . 25924 1
535 . 1 . 1 63 63 LYS CG C 13 22.105 0.068 . . . . . . A 63 LYS CG . 25924 1
536 . 1 . 1 63 63 LYS CD C 13 26.211 0.081 . . . . . . A 63 LYS CD . 25924 1
537 . 1 . 1 63 63 LYS CE C 13 39.627 0.002 . . . . . . A 63 LYS CE . 25924 1
538 . 1 . 1 63 63 LYS N N 15 118.188 0.039 . . . . . . A 63 LYS N . 25924 1
539 . 1 . 1 64 64 GLN H H 1 7.701 0.005 . . . . . . A 64 GLN H . 25924 1
540 . 1 . 1 64 64 GLN HA H 1 3.927 0.028 . . . . . . A 64 GLN HA . 25924 1
541 . 1 . 1 64 64 GLN HB2 H 1 2.23 0.024 . . . . . . A 64 GLN HB2 . 25924 1
542 . 1 . 1 64 64 GLN HG2 H 1 2.401 0.019 . . . . . . A 64 GLN HG2 . 25924 1
543 . 1 . 1 64 64 GLN C C 13 176.277 0.009 . . . . . . A 64 GLN C . 25924 1
544 . 1 . 1 64 64 GLN CA C 13 56.24 0.057 . . . . . . A 64 GLN CA . 25924 1
545 . 1 . 1 64 64 GLN CB C 13 26.506 0.171 . . . . . . A 64 GLN CB . 25924 1
546 . 1 . 1 64 64 GLN CG C 13 32.492 0.112 . . . . . . A 64 GLN CG . 25924 1
547 . 1 . 1 64 64 GLN N N 15 116.733 0.031 . . . . . . A 64 GLN N . 25924 1
548 . 1 . 1 65 65 ALA H H 1 7.933 0.007 . . . . . . A 65 ALA H . 25924 1
549 . 1 . 1 65 65 ALA HA H 1 3.726 0.015 . . . . . . A 65 ALA HA . 25924 1
550 . 1 . 1 65 65 ALA HB1 H 1 1.355 0.028 . . . . . . A 65 ALA HB1 . 25924 1
551 . 1 . 1 65 65 ALA HB2 H 1 1.355 0.028 . . . . . . A 65 ALA HB2 . 25924 1
552 . 1 . 1 65 65 ALA HB3 H 1 1.355 0.028 . . . . . . A 65 ALA HB3 . 25924 1
553 . 1 . 1 65 65 ALA C C 13 175.75 0.007 . . . . . . A 65 ALA C . 25924 1
554 . 1 . 1 65 65 ALA CA C 13 53.009 0.019 . . . . . . A 65 ALA CA . 25924 1
555 . 1 . 1 65 65 ALA CB C 13 16.089 0.039 . . . . . . A 65 ALA CB . 25924 1
556 . 1 . 1 65 65 ALA N N 15 123.381 0.042 . . . . . . A 65 ALA N . 25924 1
557 . 1 . 1 66 66 LYS H H 1 8.353 0.006 . . . . . . A 66 LYS H . 25924 1
558 . 1 . 1 66 66 LYS HA H 1 3.626 0.026 . . . . . . A 66 LYS HA . 25924 1
559 . 1 . 1 66 66 LYS HB2 H 1 2.046 0.039 . . . . . . A 66 LYS HB2 . 25924 1
560 . 1 . 1 66 66 LYS HG2 H 1 1.136 0.025 . . . . . . A 66 LYS HG2 . 25924 1
561 . 1 . 1 66 66 LYS HD2 H 1 1.702 0 . . . . . . A 66 LYS HD2 . 25924 1
562 . 1 . 1 66 66 LYS C C 13 175.275 0.005 . . . . . . A 66 LYS C . 25924 1
563 . 1 . 1 66 66 LYS CA C 13 57.658 0.166 . . . . . . A 66 LYS CA . 25924 1
564 . 1 . 1 66 66 LYS CB C 13 30.268 0.232 . . . . . . A 66 LYS CB . 25924 1
565 . 1 . 1 66 66 LYS CG C 13 23.432 0.023 . . . . . . A 66 LYS CG . 25924 1
566 . 1 . 1 66 66 LYS CE C 13 38.504 0 . . . . . . A 66 LYS CE . 25924 1
567 . 1 . 1 66 66 LYS N N 15 118.715 0.025 . . . . . . A 66 LYS N . 25924 1
568 . 1 . 1 67 67 MET H H 1 8.011 0.003 . . . . . . A 67 MET H . 25924 1
569 . 1 . 1 67 67 MET HA H 1 3.821 0.015 . . . . . . A 67 MET HA . 25924 1
570 . 1 . 1 67 67 MET HB2 H 1 1.984 0.006 . . . . . . A 67 MET HB2 . 25924 1
571 . 1 . 1 67 67 MET HB3 H 1 2.512 0 . . . . . . A 67 MET HB3 . 25924 1
572 . 1 . 1 67 67 MET HG2 H 1 2.683 0.007 . . . . . . A 67 MET HG2 . 25924 1
573 . 1 . 1 67 67 MET HG3 H 1 2.456 0 . . . . . . A 67 MET HG3 . 25924 1
574 . 1 . 1 67 67 MET HE1 H 1 1.646 0.006 . . . . . . A 67 MET HE1 . 25924 1
575 . 1 . 1 67 67 MET HE2 H 1 1.646 0.006 . . . . . . A 67 MET HE2 . 25924 1
576 . 1 . 1 67 67 MET HE3 H 1 1.646 0.006 . . . . . . A 67 MET HE3 . 25924 1
577 . 1 . 1 67 67 MET C C 13 175.66 0.004 . . . . . . A 67 MET C . 25924 1
578 . 1 . 1 67 67 MET CA C 13 56.845 0.136 . . . . . . A 67 MET CA . 25924 1
579 . 1 . 1 67 67 MET CB C 13 29.95 0.242 . . . . . . A 67 MET CB . 25924 1
580 . 1 . 1 67 67 MET CG C 13 29.416 0.387 . . . . . . A 67 MET CG . 25924 1
581 . 1 . 1 67 67 MET N N 15 117.211 0.04 . . . . . . A 67 MET N . 25924 1
582 . 1 . 1 68 68 GLY H H 1 8.094 0.011 . . . . . . A 68 GLY H . 25924 1
583 . 1 . 1 68 68 GLY HA2 H 1 3.896 0.005 . . . . . . A 68 GLY HA2 . 25924 1
584 . 1 . 1 68 68 GLY C C 13 173.545 0.007 . . . . . . A 68 GLY C . 25924 1
585 . 1 . 1 68 68 GLY CA C 13 44.643 0.181 . . . . . . A 68 GLY CA . 25924 1
586 . 1 . 1 68 68 GLY N N 15 105.985 0.016 . . . . . . A 68 GLY N . 25924 1
587 . 1 . 1 69 69 ALA H H 1 8.437 0.004 . . . . . . A 69 ALA H . 25924 1
588 . 1 . 1 69 69 ALA HA H 1 3.841 0.021 . . . . . . A 69 ALA HA . 25924 1
589 . 1 . 1 69 69 ALA HB1 H 1 1.436 0.042 . . . . . . A 69 ALA HB1 . 25924 1
590 . 1 . 1 69 69 ALA HB2 H 1 1.436 0.042 . . . . . . A 69 ALA HB2 . 25924 1
591 . 1 . 1 69 69 ALA HB3 H 1 1.436 0.042 . . . . . . A 69 ALA HB3 . 25924 1
592 . 1 . 1 69 69 ALA C C 13 175.84 0.01 . . . . . . A 69 ALA C . 25924 1
593 . 1 . 1 69 69 ALA CA C 13 52.512 0.012 . . . . . . A 69 ALA CA . 25924 1
594 . 1 . 1 69 69 ALA CB C 13 15.069 0.108 . . . . . . A 69 ALA CB . 25924 1
595 . 1 . 1 69 69 ALA N N 15 127.579 0.041 . . . . . . A 69 ALA N . 25924 1
596 . 1 . 1 70 70 ALA H H 1 8.219 0.01 . . . . . . A 70 ALA H . 25924 1
597 . 1 . 1 70 70 ALA HA H 1 4.003 0.003 . . . . . . A 70 ALA HA . 25924 1
598 . 1 . 1 70 70 ALA HB1 H 1 1.531 0.002 . . . . . . A 70 ALA HB1 . 25924 1
599 . 1 . 1 70 70 ALA HB2 H 1 1.531 0.002 . . . . . . A 70 ALA HB2 . 25924 1
600 . 1 . 1 70 70 ALA HB3 H 1 1.531 0.002 . . . . . . A 70 ALA HB3 . 25924 1
601 . 1 . 1 70 70 ALA C C 13 176.847 0.006 . . . . . . A 70 ALA C . 25924 1
602 . 1 . 1 70 70 ALA CA C 13 52.759 0.053 . . . . . . A 70 ALA CA . 25924 1
603 . 1 . 1 70 70 ALA CB C 13 15.297 0.054 . . . . . . A 70 ALA CB . 25924 1
604 . 1 . 1 70 70 ALA N N 15 119.968 0.032 . . . . . . A 70 ALA N . 25924 1
605 . 1 . 1 71 71 MET H H 1 8.294 0.004 . . . . . . A 71 MET H . 25924 1
606 . 1 . 1 71 71 MET HA H 1 4.01 0.011 . . . . . . A 71 MET HA . 25924 1
607 . 1 . 1 71 71 MET HB2 H 1 2.185 0.022 . . . . . . A 71 MET HB2 . 25924 1
608 . 1 . 1 71 71 MET HG2 H 1 2.724 0.006 . . . . . . A 71 MET HG2 . 25924 1
609 . 1 . 1 71 71 MET HG3 H 1 2.556 0.015 . . . . . . A 71 MET HG3 . 25924 1
610 . 1 . 1 71 71 MET HE1 H 1 1.036 0 . . . . . . A 71 MET HE1 . 25924 1
611 . 1 . 1 71 71 MET HE2 H 1 1.036 0 . . . . . . A 71 MET HE2 . 25924 1
612 . 1 . 1 71 71 MET HE3 H 1 1.036 0 . . . . . . A 71 MET HE3 . 25924 1
613 . 1 . 1 71 71 MET C C 13 175.596 0.007 . . . . . . A 71 MET C . 25924 1
614 . 1 . 1 71 71 MET CA C 13 56.613 0.107 . . . . . . A 71 MET CA . 25924 1
615 . 1 . 1 71 71 MET CB C 13 30.407 0.143 . . . . . . A 71 MET CB . 25924 1
616 . 1 . 1 71 71 MET CG C 13 29.618 0 . . . . . . A 71 MET CG . 25924 1
617 . 1 . 1 71 71 MET CE C 13 15.427 0 . . . . . . A 71 MET CE . 25924 1
618 . 1 . 1 71 71 MET N N 15 115.754 0.019 . . . . . . A 71 MET N . 25924 1
619 . 1 . 1 72 72 ASP H H 1 8.045 0.009 . . . . . . A 72 ASP H . 25924 1
620 . 1 . 1 72 72 ASP HA H 1 4.389 0.004 . . . . . . A 72 ASP HA . 25924 1
621 . 1 . 1 72 72 ASP HB2 H 1 2.867 0.004 . . . . . . A 72 ASP HB2 . 25924 1
622 . 1 . 1 72 72 ASP C C 13 175.052 0.005 . . . . . . A 72 ASP C . 25924 1
623 . 1 . 1 72 72 ASP CA C 13 54.995 0.019 . . . . . . A 72 ASP CA . 25924 1
624 . 1 . 1 72 72 ASP CB C 13 40.461 0.06 . . . . . . A 72 ASP CB . 25924 1
625 . 1 . 1 72 72 ASP N N 15 120.287 0.02 . . . . . . A 72 ASP N . 25924 1
626 . 1 . 1 73 73 ALA H H 1 8.028 0.005 . . . . . . A 73 ALA H . 25924 1
627 . 1 . 1 73 73 ALA HA H 1 4.188 0.008 . . . . . . A 73 ALA HA . 25924 1
628 . 1 . 1 73 73 ALA HB1 H 1 1.183 0.004 . . . . . . A 73 ALA HB1 . 25924 1
629 . 1 . 1 73 73 ALA HB2 H 1 1.183 0.004 . . . . . . A 73 ALA HB2 . 25924 1
630 . 1 . 1 73 73 ALA HB3 H 1 1.183 0.004 . . . . . . A 73 ALA HB3 . 25924 1
631 . 1 . 1 73 73 ALA C C 13 177.251 0.004 . . . . . . A 73 ALA C . 25924 1
632 . 1 . 1 73 73 ALA CA C 13 52.041 0.037 . . . . . . A 73 ALA CA . 25924 1
633 . 1 . 1 73 73 ALA CB C 13 16.473 0.042 . . . . . . A 73 ALA CB . 25924 1
634 . 1 . 1 73 73 ALA N N 15 119.64 0.059 . . . . . . A 73 ALA N . 25924 1
635 . 1 . 1 74 74 LEU H H 1 8.397 0.007 . . . . . . A 74 LEU H . 25924 1
636 . 1 . 1 74 74 LEU HA H 1 3.992 0.007 . . . . . . A 74 LEU HA . 25924 1
637 . 1 . 1 74 74 LEU HB2 H 1 1.815 0.009 . . . . . . A 74 LEU HB2 . 25924 1
638 . 1 . 1 74 74 LEU HB3 H 1 1.815 0.009 . . . . . . A 74 LEU HB3 . 25924 1
639 . 1 . 1 74 74 LEU HG H 1 1.464 0.011 . . . . . . A 74 LEU HG . 25924 1
640 . 1 . 1 74 74 LEU HD11 H 1 0.756 0.015 . . . . . . A 74 LEU HD11 . 25924 1
641 . 1 . 1 74 74 LEU HD12 H 1 0.756 0.015 . . . . . . A 74 LEU HD12 . 25924 1
642 . 1 . 1 74 74 LEU HD13 H 1 0.756 0.015 . . . . . . A 74 LEU HD13 . 25924 1
643 . 1 . 1 74 74 LEU HD21 H 1 0.858 0.007 . . . . . . A 74 LEU HD21 . 25924 1
644 . 1 . 1 74 74 LEU HD22 H 1 0.858 0.007 . . . . . . A 74 LEU HD22 . 25924 1
645 . 1 . 1 74 74 LEU HD23 H 1 0.858 0.007 . . . . . . A 74 LEU HD23 . 25924 1
646 . 1 . 1 74 74 LEU C C 13 176.643 0.005 . . . . . . A 74 LEU C . 25924 1
647 . 1 . 1 74 74 LEU CA C 13 55.519 0.155 . . . . . . A 74 LEU CA . 25924 1
648 . 1 . 1 74 74 LEU CB C 13 39.698 0.123 . . . . . . A 74 LEU CB . 25924 1
649 . 1 . 1 74 74 LEU CG C 13 23.106 0 . . . . . . A 74 LEU CG . 25924 1
650 . 1 . 1 74 74 LEU CD1 C 13 21.46 0 . . . . . . A 74 LEU CD1 . 25924 1
651 . 1 . 1 74 74 LEU CD2 C 13 21.46 0 . . . . . . A 74 LEU CD2 . 25924 1
652 . 1 . 1 74 74 LEU N N 15 117.01 0.022 . . . . . . A 74 LEU N . 25924 1
653 . 1 . 1 75 75 GLU H H 1 7.812 0.011 . . . . . . A 75 GLU H . 25924 1
654 . 1 . 1 75 75 GLU HA H 1 4.109 0.016 . . . . . . A 75 GLU HA . 25924 1
655 . 1 . 1 75 75 GLU HB2 H 1 2.222 0 . . . . . . A 75 GLU HB2 . 25924 1
656 . 1 . 1 75 75 GLU HG2 H 1 2.396 0.001 . . . . . . A 75 GLU HG2 . 25924 1
657 . 1 . 1 75 75 GLU C C 13 175.976 0.004 . . . . . . A 75 GLU C . 25924 1
658 . 1 . 1 75 75 GLU CA C 13 55.916 0.071 . . . . . . A 75 GLU CA . 25924 1
659 . 1 . 1 75 75 GLU CB C 13 27.425 0.065 . . . . . . A 75 GLU CB . 25924 1
660 . 1 . 1 75 75 GLU CG C 13 34.215 0 . . . . . . A 75 GLU CG . 25924 1
661 . 1 . 1 75 75 GLU N N 15 117.709 0.027 . . . . . . A 75 GLU N . 25924 1
662 . 1 . 1 76 76 LYS H H 1 7.892 0.004 . . . . . . A 76 LYS H . 25924 1
663 . 1 . 1 76 76 LYS HA H 1 4.14 0 . . . . . . A 76 LYS HA . 25924 1
664 . 1 . 1 76 76 LYS HB2 H 1 1.767 0.01 . . . . . . A 76 LYS HB2 . 25924 1
665 . 1 . 1 76 76 LYS HB3 H 1 1.767 0.01 . . . . . . A 76 LYS HB3 . 25924 1
666 . 1 . 1 76 76 LYS HG2 H 1 1.352 0 . . . . . . A 76 LYS HG2 . 25924 1
667 . 1 . 1 76 76 LYS HD2 H 1 1.524 0.011 . . . . . . A 76 LYS HD2 . 25924 1
668 . 1 . 1 76 76 LYS HE2 H 1 2.896 0 . . . . . . A 76 LYS HE2 . 25924 1
669 . 1 . 1 76 76 LYS C C 13 174.882 0.002 . . . . . . A 76 LYS C . 25924 1
670 . 1 . 1 76 76 LYS CA C 13 55.187 0.132 . . . . . . A 76 LYS CA . 25924 1
671 . 1 . 1 76 76 LYS CB C 13 31.27 0.172 . . . . . . A 76 LYS CB . 25924 1
672 . 1 . 1 76 76 LYS CG C 13 25.982 0 . . . . . . A 76 LYS CG . 25924 1
673 . 1 . 1 76 76 LYS CD C 13 29.325 0 . . . . . . A 76 LYS CD . 25924 1
674 . 1 . 1 76 76 LYS CE C 13 40.074 0 . . . . . . A 76 LYS CE . 25924 1
675 . 1 . 1 76 76 LYS N N 15 117.44 0.039 . . . . . . A 76 LYS N . 25924 1
676 . 1 . 1 77 77 TYR H H 1 8.149 0.008 . . . . . . A 77 TYR H . 25924 1
677 . 1 . 1 77 77 TYR HA H 1 4.044 0.01 . . . . . . A 77 TYR HA . 25924 1
678 . 1 . 1 77 77 TYR HB2 H 1 2.554 0.013 . . . . . . A 77 TYR HB2 . 25924 1
679 . 1 . 1 77 77 TYR C C 13 172.041 0.005 . . . . . . A 77 TYR C . 25924 1
680 . 1 . 1 77 77 TYR CA C 13 56.878 0.111 . . . . . . A 77 TYR CA . 25924 1
681 . 1 . 1 77 77 TYR CB C 13 35.852 0.047 . . . . . . A 77 TYR CB . 25924 1
682 . 1 . 1 77 77 TYR N N 15 120.225 0.021 . . . . . . A 77 TYR N . 25924 1
683 . 1 . 1 78 78 ASN H H 1 7.436 0.009 . . . . . . A 78 ASN H . 25924 1
684 . 1 . 1 78 78 ASN HA H 1 4.537 0.006 . . . . . . A 78 ASN HA . 25924 1
685 . 1 . 1 78 78 ASN HB2 H 1 2.539 0.032 . . . . . . A 78 ASN HB2 . 25924 1
686 . 1 . 1 78 78 ASN C C 13 171.116 0.006 . . . . . . A 78 ASN C . 25924 1
687 . 1 . 1 78 78 ASN CA C 13 49.866 0.16 . . . . . . A 78 ASN CA . 25924 1
688 . 1 . 1 78 78 ASN CB C 13 35.302 0.159 . . . . . . A 78 ASN CB . 25924 1
689 . 1 . 1 78 78 ASN N N 15 121.088 0.052 . . . . . . A 78 ASN N . 25924 1
690 . 1 . 1 79 79 PHE H H 1 7.901 0.003 . . . . . . A 79 PHE H . 25924 1
691 . 1 . 1 79 79 PHE C C 13 171.22 0 . . . . . . A 79 PHE C . 25924 1
692 . 1 . 1 79 79 PHE CA C 13 54.195 0 . . . . . . A 79 PHE CA . 25924 1
693 . 1 . 1 79 79 PHE CB C 13 35.969 0 . . . . . . A 79 PHE CB . 25924 1
694 . 1 . 1 79 79 PHE N N 15 122.211 0.03 . . . . . . A 79 PHE N . 25924 1
695 . 1 . 1 80 80 PRO HA H 1 4.367 0.009 . . . . . . A 80 PRO HA . 25924 1
696 . 1 . 1 80 80 PRO HB2 H 1 2.196 0 . . . . . . A 80 PRO HB2 . 25924 1
697 . 1 . 1 80 80 PRO HB3 H 1 2.196 0 . . . . . . A 80 PRO HB3 . 25924 1
698 . 1 . 1 80 80 PRO HG2 H 1 1.898 0.013 . . . . . . A 80 PRO HG2 . 25924 1
699 . 1 . 1 80 80 PRO HG3 H 1 1.898 0.013 . . . . . . A 80 PRO HG3 . 25924 1
700 . 1 . 1 80 80 PRO HD2 H 1 3.763 0.006 . . . . . . A 80 PRO HD2 . 25924 1
701 . 1 . 1 80 80 PRO HD3 H 1 3.586 0 . . . . . . A 80 PRO HD3 . 25924 1
702 . 1 . 1 80 80 PRO C C 13 173.721 0.004 . . . . . . A 80 PRO C . 25924 1
703 . 1 . 1 80 80 PRO CA C 13 60.634 0.157 . . . . . . A 80 PRO CA . 25924 1
704 . 1 . 1 80 80 PRO CB C 13 29.356 0.111 . . . . . . A 80 PRO CB . 25924 1
705 . 1 . 1 80 80 PRO CG C 13 24.811 0 . . . . . . A 80 PRO CG . 25924 1
706 . 1 . 1 80 80 PRO CD C 13 48.246 0 . . . . . . A 80 PRO CD . 25924 1
707 . 1 . 1 81 81 GLN H H 1 8.347 0.004 . . . . . . A 81 GLN H . 25924 1
708 . 1 . 1 81 81 GLN HA H 1 4.232 0.009 . . . . . . A 81 GLN HA . 25924 1
709 . 1 . 1 81 81 GLN HB2 H 1 2.061 0.004 . . . . . . A 81 GLN HB2 . 25924 1
710 . 1 . 1 81 81 GLN HB3 H 1 1.905 0.003 . . . . . . A 81 GLN HB3 . 25924 1
711 . 1 . 1 81 81 GLN HG2 H 1 2.352 0.044 . . . . . . A 81 GLN HG2 . 25924 1
712 . 1 . 1 81 81 GLN C C 13 172.475 0.006 . . . . . . A 81 GLN C . 25924 1
713 . 1 . 1 81 81 GLN CA C 13 53.216 0.155 . . . . . . A 81 GLN CA . 25924 1
714 . 1 . 1 81 81 GLN CB C 13 26.823 0.184 . . . . . . A 81 GLN CB . 25924 1
715 . 1 . 1 81 81 GLN CG C 13 31.497 0 . . . . . . A 81 GLN CG . 25924 1
716 . 1 . 1 81 81 GLN N N 15 120.432 0.031 . . . . . . A 81 GLN N . 25924 1
717 . 1 . 1 82 82 MET H H 1 7.933 0.003 . . . . . . A 82 MET H . 25924 1
718 . 1 . 1 82 82 MET C C 13 178.029 0 . . . . . . A 82 MET C . 25924 1
719 . 1 . 1 82 82 MET CA C 13 54.275 0 . . . . . . A 82 MET CA . 25924 1
720 . 1 . 1 82 82 MET CB C 13 31.111 0 . . . . . . A 82 MET CB . 25924 1
721 . 1 . 1 82 82 MET N N 15 127.154 0.053 . . . . . . A 82 MET N . 25924 1
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