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 36026
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $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 '4D 13C_15N_edited NOESY' 1 $sample_1 isotropic 36026 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
1 $software_1 . . 36026 1
2 $software_2 . . 36026 1
3 $software_3 . . 36026 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.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 2 2 HIS H H 1 8.320 0.000 . 1 . . . . A 2 HIS H . 36026 1
2 . 1 1 2 2 HIS HD2 H 1 7.058 0.000 . 1 . . . . A 2 HIS HD2 . 36026 1
3 . 1 1 2 2 HIS CD2 C 13 120.449 0.000 . 1 . . . . A 2 HIS CD2 . 36026 1
4 . 1 1 2 2 HIS N N 15 125.466 0.000 . 1 . . . . A 2 HIS N . 36026 1
5 . 1 1 4 4 GLU H H 1 10.198 0.013 . 1 . . . . A 4 GLU H . 36026 1
6 . 1 1 4 4 GLU HA H 1 4.209 0.000 . 1 . . . . A 4 GLU HA . 36026 1
7 . 1 1 4 4 GLU HB3 H 1 1.819 0.000 . 2 . . . . A 4 GLU HB3 . 36026 1
8 . 1 1 4 4 GLU N N 15 120.413 0.011 . 1 . . . . A 4 GLU N . 36026 1
9 . 1 1 5 5 PHE H H 1 7.998 0.002 . 1 . . . . A 5 PHE H . 36026 1
10 . 1 1 5 5 PHE HA H 1 4.094 0.009 . 1 . . . . A 5 PHE HA . 36026 1
11 . 1 1 5 5 PHE HB2 H 1 2.142 0.003 . 2 . . . . A 5 PHE HB2 . 36026 1
12 . 1 1 5 5 PHE HB3 H 1 2.632 0.002 . 2 . . . . A 5 PHE HB3 . 36026 1
13 . 1 1 5 5 PHE HD1 H 1 6.604 0.001 . 3 . . . . A 5 PHE HD1 . 36026 1
14 . 1 1 5 5 PHE HD2 H 1 6.604 0.001 . 3 . . . . A 5 PHE HD2 . 36026 1
15 . 1 1 5 5 PHE HE1 H 1 6.795 0.018 . 3 . . . . A 5 PHE HE1 . 36026 1
16 . 1 1 5 5 PHE HE2 H 1 6.795 0.018 . 3 . . . . A 5 PHE HE2 . 36026 1
17 . 1 1 5 5 PHE CD1 C 13 129.623 0.049 . 3 . . . . A 5 PHE CD1 . 36026 1
18 . 1 1 5 5 PHE CD2 C 13 129.623 0.049 . 3 . . . . A 5 PHE CD2 . 36026 1
19 . 1 1 5 5 PHE CE1 C 13 130.714 0.004 . 3 . . . . A 5 PHE CE1 . 36026 1
20 . 1 1 5 5 PHE CE2 C 13 130.714 0.004 . 3 . . . . A 5 PHE CE2 . 36026 1
21 . 1 1 5 5 PHE N N 15 119.235 0.011 . 1 . . . . A 5 PHE N . 36026 1
22 . 1 1 6 6 LEU H H 1 7.373 0.010 . 1 . . . . A 6 LEU H . 36026 1
23 . 1 1 6 6 LEU HA H 1 4.196 0.017 . 1 . . . . A 6 LEU HA . 36026 1
24 . 1 1 6 6 LEU HB2 H 1 1.748 0.004 . 2 . . . . A 6 LEU HB2 . 36026 1
25 . 1 1 6 6 LEU HB3 H 1 1.587 0.034 . 2 . . . . A 6 LEU HB3 . 36026 1
26 . 1 1 6 6 LEU HD11 H 1 0.925 0.006 . 2 . . . . A 6 LEU HD11 . 36026 1
27 . 1 1 6 6 LEU HD12 H 1 0.925 0.006 . 2 . . . . A 6 LEU HD12 . 36026 1
28 . 1 1 6 6 LEU HD13 H 1 0.925 0.006 . 2 . . . . A 6 LEU HD13 . 36026 1
29 . 1 1 6 6 LEU HD21 H 1 0.919 0.001 . 2 . . . . A 6 LEU HD21 . 36026 1
30 . 1 1 6 6 LEU HD22 H 1 0.919 0.001 . 2 . . . . A 6 LEU HD22 . 36026 1
31 . 1 1 6 6 LEU HD23 H 1 0.919 0.001 . 2 . . . . A 6 LEU HD23 . 36026 1
32 . 1 1 6 6 LEU N N 15 115.938 0.011 . 1 . . . . A 6 LEU N . 36026 1
33 . 1 1 7 7 LYS H H 1 7.282 0.010 . 1 . . . . A 7 LYS H . 36026 1
34 . 1 1 7 7 LYS HA H 1 4.316 0.002 . 1 . . . . A 7 LYS HA . 36026 1
35 . 1 1 7 7 LYS HB2 H 1 2.121 0.003 . 2 . . . . A 7 LYS HB2 . 36026 1
36 . 1 1 7 7 LYS HB3 H 1 1.909 0.003 . 2 . . . . A 7 LYS HB3 . 36026 1
37 . 1 1 7 7 LYS HG2 H 1 1.434 0.000 . 2 . . . . A 7 LYS HG2 . 36026 1
38 . 1 1 7 7 LYS HG3 H 1 1.553 0.000 . 2 . . . . A 7 LYS HG3 . 36026 1
39 . 1 1 7 7 LYS N N 15 114.398 0.008 . 1 . . . . A 7 LYS N . 36026 1
40 . 1 1 8 8 ALA H H 1 8.079 0.011 . 1 . . . . A 8 ALA H . 36026 1
41 . 1 1 8 8 ALA HA H 1 4.569 0.006 . 1 . . . . A 8 ALA HA . 36026 1
42 . 1 1 8 8 ALA HB1 H 1 1.381 0.005 . 1 . . . . A 8 ALA HB1 . 36026 1
43 . 1 1 8 8 ALA HB2 H 1 1.381 0.005 . 1 . . . . A 8 ALA HB2 . 36026 1
44 . 1 1 8 8 ALA HB3 H 1 1.381 0.005 . 1 . . . . A 8 ALA HB3 . 36026 1
45 . 1 1 8 8 ALA CB C 13 20.097 0.019 . 1 . . . . A 8 ALA CB . 36026 1
46 . 1 1 8 8 ALA N N 15 123.742 0.010 . 1 . . . . A 8 ALA N . 36026 1
47 . 1 1 9 9 GLY H H 1 9.476 0.001 . 1 . . . . A 9 GLY H . 36026 1
48 . 1 1 9 9 GLY HA2 H 1 3.724 0.022 . 2 . . . . A 9 GLY HA2 . 36026 1
49 . 1 1 9 9 GLY HA3 H 1 4.240 0.004 . 2 . . . . A 9 GLY HA3 . 36026 1
50 . 1 1 9 9 GLY N N 15 110.163 0.012 . 1 . . . . A 9 GLY N . 36026 1
51 . 1 1 10 10 LYS H H 1 8.212 0.002 . 1 . . . . A 10 LYS H . 36026 1
52 . 1 1 10 10 LYS HA H 1 4.272 0.013 . 1 . . . . A 10 LYS HA . 36026 1
53 . 1 1 10 10 LYS HB2 H 1 1.769 0.003 . 2 . . . . A 10 LYS HB2 . 36026 1
54 . 1 1 10 10 LYS HB3 H 1 1.881 0.012 . 2 . . . . A 10 LYS HB3 . 36026 1
55 . 1 1 10 10 LYS HG2 H 1 1.289 0.000 . 2 . . . . A 10 LYS HG2 . 36026 1
56 . 1 1 10 10 LYS HG3 H 1 1.480 0.000 . 2 . . . . A 10 LYS HG3 . 36026 1
57 . 1 1 10 10 LYS N N 15 118.139 0.010 . 1 . . . . A 10 LYS N . 36026 1
58 . 1 1 11 11 GLU H H 1 8.217 0.001 . 1 . . . . A 11 GLU H . 36026 1
59 . 1 1 11 11 GLU HA H 1 4.800 0.000 . 1 . . . . A 11 GLU HA . 36026 1
60 . 1 1 11 11 GLU HB2 H 1 2.034 0.000 . 2 . . . . A 11 GLU HB2 . 36026 1
61 . 1 1 11 11 GLU HG3 H 1 2.165 0.000 . 2 . . . . A 11 GLU HG3 . 36026 1
62 . 1 1 11 11 GLU N N 15 116.083 0.015 . 1 . . . . A 11 GLU N . 36026 1
63 . 1 1 12 12 PRO HA H 1 3.963 0.007 . 1 . . . . A 12 PRO HA . 36026 1
64 . 1 1 12 12 PRO HB2 H 1 2.157 0.000 . 2 . . . . A 12 PRO HB2 . 36026 1
65 . 1 1 12 12 PRO HB3 H 1 1.911 0.000 . 2 . . . . A 12 PRO HB3 . 36026 1
66 . 1 1 13 13 GLY H H 1 8.739 0.002 . 1 . . . . A 13 GLY H . 36026 1
67 . 1 1 13 13 GLY HA2 H 1 3.732 0.004 . 2 . . . . A 13 GLY HA2 . 36026 1
68 . 1 1 13 13 GLY HA3 H 1 4.474 0.012 . 2 . . . . A 13 GLY HA3 . 36026 1
69 . 1 1 13 13 GLY N N 15 110.874 0.014 . 1 . . . . A 13 GLY N . 36026 1
70 . 1 1 14 14 LEU H H 1 8.316 0.004 . 1 . . . . A 14 LEU H . 36026 1
71 . 1 1 14 14 LEU HA H 1 4.978 0.012 . 1 . . . . A 14 LEU HA . 36026 1
72 . 1 1 14 14 LEU HB2 H 1 1.763 0.011 . 2 . . . . A 14 LEU HB2 . 36026 1
73 . 1 1 14 14 LEU HB3 H 1 1.028 0.006 . 2 . . . . A 14 LEU HB3 . 36026 1
74 . 1 1 14 14 LEU HG H 1 0.881 0.000 . 1 . . . . A 14 LEU HG . 36026 1
75 . 1 1 14 14 LEU HD11 H 1 0.181 0.006 . 2 . . . . A 14 LEU HD11 . 36026 1
76 . 1 1 14 14 LEU HD12 H 1 0.181 0.006 . 2 . . . . A 14 LEU HD12 . 36026 1
77 . 1 1 14 14 LEU HD13 H 1 0.181 0.006 . 2 . . . . A 14 LEU HD13 . 36026 1
78 . 1 1 14 14 LEU HD21 H 1 0.359 0.008 . 2 . . . . A 14 LEU HD21 . 36026 1
79 . 1 1 14 14 LEU HD22 H 1 0.359 0.008 . 2 . . . . A 14 LEU HD22 . 36026 1
80 . 1 1 14 14 LEU HD23 H 1 0.359 0.008 . 2 . . . . A 14 LEU HD23 . 36026 1
81 . 1 1 14 14 LEU N N 15 122.311 0.018 . 1 . . . . A 14 LEU N . 36026 1
82 . 1 1 15 15 GLN H H 1 8.486 0.001 . 1 . . . . A 15 GLN H . 36026 1
83 . 1 1 15 15 GLN HA H 1 4.486 0.006 . 1 . . . . A 15 GLN HA . 36026 1
84 . 1 1 15 15 GLN HB2 H 1 0.899 0.000 . 2 . . . . A 15 GLN HB2 . 36026 1
85 . 1 1 15 15 GLN HB3 H 1 1.654 0.000 . 2 . . . . A 15 GLN HB3 . 36026 1
86 . 1 1 15 15 GLN HG2 H 1 2.215 0.023 . 2 . . . . A 15 GLN HG2 . 36026 1
87 . 1 1 15 15 GLN HG3 H 1 1.997 0.001 . 2 . . . . A 15 GLN HG3 . 36026 1
88 . 1 1 15 15 GLN HE21 H 1 7.529 0.004 . 2 . . . . A 15 GLN HE21 . 36026 1
89 . 1 1 15 15 GLN HE22 H 1 8.041 0.000 . 2 . . . . A 15 GLN HE22 . 36026 1
90 . 1 1 15 15 GLN N N 15 124.568 0.013 . 1 . . . . A 15 GLN N . 36026 1
91 . 1 1 16 16 ILE H H 1 6.901 0.002 . 1 . . . . A 16 ILE H . 36026 1
92 . 1 1 16 16 ILE HA H 1 4.970 0.007 . 1 . . . . A 16 ILE HA . 36026 1
93 . 1 1 16 16 ILE HB H 1 1.135 0.012 . 1 . . . . A 16 ILE HB . 36026 1
94 . 1 1 16 16 ILE HG21 H 1 0.901 0.003 . 1 . . . . A 16 ILE HG21 . 36026 1
95 . 1 1 16 16 ILE HG22 H 1 0.901 0.003 . 1 . . . . A 16 ILE HG22 . 36026 1
96 . 1 1 16 16 ILE HG23 H 1 0.901 0.003 . 1 . . . . A 16 ILE HG23 . 36026 1
97 . 1 1 16 16 ILE HD11 H 1 0.199 0.006 . 1 . . . . A 16 ILE HD11 . 36026 1
98 . 1 1 16 16 ILE HD12 H 1 0.199 0.006 . 1 . . . . A 16 ILE HD12 . 36026 1
99 . 1 1 16 16 ILE HD13 H 1 0.199 0.006 . 1 . . . . A 16 ILE HD13 . 36026 1
100 . 1 1 16 16 ILE CG2 C 13 17.294 0.027 . 1 . . . . A 16 ILE CG2 . 36026 1
101 . 1 1 16 16 ILE CD1 C 13 13.490 0.020 . 1 . . . . A 16 ILE CD1 . 36026 1
102 . 1 1 16 16 ILE N N 15 119.145 0.005 . 1 . . . . A 16 ILE N . 36026 1
103 . 1 1 17 17 TRP H H 1 9.968 0.003 . 1 . . . . A 17 TRP H . 36026 1
104 . 1 1 17 17 TRP HA H 1 5.415 0.009 . 1 . . . . A 17 TRP HA . 36026 1
105 . 1 1 17 17 TRP HB3 H 1 2.928 0.008 . 2 . . . . A 17 TRP HB3 . 36026 1
106 . 1 1 17 17 TRP HD1 H 1 6.436 0.007 . 1 . . . . A 17 TRP HD1 . 36026 1
107 . 1 1 17 17 TRP HE1 H 1 11.087 0.004 . 1 . . . . A 17 TRP HE1 . 36026 1
108 . 1 1 17 17 TRP HE3 H 1 7.615 0.009 . 1 . . . . A 17 TRP HE3 . 36026 1
109 . 1 1 17 17 TRP HZ2 H 1 7.094 0.005 . 1 . . . . A 17 TRP HZ2 . 36026 1
110 . 1 1 17 17 TRP HH2 H 1 6.749 0.018 . 1 . . . . A 17 TRP HH2 . 36026 1
111 . 1 1 17 17 TRP CD1 C 13 124.888 0.000 . 1 . . . . A 17 TRP CD1 . 36026 1
112 . 1 1 17 17 TRP CE3 C 13 123.619 0.000 . 1 . . . . A 17 TRP CE3 . 36026 1
113 . 1 1 17 17 TRP CZ2 C 13 112.841 0.027 . 1 . . . . A 17 TRP CZ2 . 36026 1
114 . 1 1 17 17 TRP CH2 C 13 123.898 0.029 . 1 . . . . A 17 TRP CH2 . 36026 1
115 . 1 1 17 17 TRP N N 15 127.020 0.011 . 1 . . . . A 17 TRP N . 36026 1
116 . 1 1 18 18 ARG H H 1 9.782 0.010 . 1 . . . . A 18 ARG H . 36026 1
117 . 1 1 18 18 ARG HA H 1 4.518 0.010 . 1 . . . . A 18 ARG HA . 36026 1
118 . 1 1 18 18 ARG HB2 H 1 1.482 0.000 . 2 . . . . A 18 ARG HB2 . 36026 1
119 . 1 1 18 18 ARG HB3 H 1 2.021 0.000 . 2 . . . . A 18 ARG HB3 . 36026 1
120 . 1 1 18 18 ARG HG2 H 1 1.526 0.003 . 2 . . . . A 18 ARG HG2 . 36026 1
121 . 1 1 18 18 ARG HG3 H 1 0.947 0.000 . 2 . . . . A 18 ARG HG3 . 36026 1
122 . 1 1 18 18 ARG N N 15 124.561 0.014 . 1 . . . . A 18 ARG N . 36026 1
123 . 1 1 19 19 VAL H H 1 8.344 0.004 . 1 . . . . A 19 VAL H . 36026 1
124 . 1 1 19 19 VAL HA H 1 4.019 0.020 . 1 . . . . A 19 VAL HA . 36026 1
125 . 1 1 19 19 VAL HB H 1 2.067 0.006 . 1 . . . . A 19 VAL HB . 36026 1
126 . 1 1 19 19 VAL HG11 H 1 0.861 0.010 . 2 . . . . A 19 VAL HG11 . 36026 1
127 . 1 1 19 19 VAL HG12 H 1 0.861 0.010 . 2 . . . . A 19 VAL HG12 . 36026 1
128 . 1 1 19 19 VAL HG13 H 1 0.861 0.010 . 2 . . . . A 19 VAL HG13 . 36026 1
129 . 1 1 19 19 VAL HG21 H 1 0.956 0.013 . 2 . . . . A 19 VAL HG21 . 36026 1
130 . 1 1 19 19 VAL HG22 H 1 0.956 0.013 . 2 . . . . A 19 VAL HG22 . 36026 1
131 . 1 1 19 19 VAL HG23 H 1 0.956 0.013 . 2 . . . . A 19 VAL HG23 . 36026 1
132 . 1 1 19 19 VAL N N 15 126.674 0.011 . 1 . . . . A 19 VAL N . 36026 1
133 . 1 1 20 20 GLU H H 1 8.458 0.002 . 1 . . . . A 20 GLU H . 36026 1
134 . 1 1 20 20 GLU HA H 1 4.726 0.008 . 1 . . . . A 20 GLU HA . 36026 1
135 . 1 1 20 20 GLU HB2 H 1 1.971 0.015 . 2 . . . . A 20 GLU HB2 . 36026 1
136 . 1 1 20 20 GLU HB3 H 1 2.086 0.005 . 2 . . . . A 20 GLU HB3 . 36026 1
137 . 1 1 20 20 GLU HG3 H 1 2.262 0.000 . 2 . . . . A 20 GLU HG3 . 36026 1
138 . 1 1 20 20 GLU N N 15 128.615 0.024 . 1 . . . . A 20 GLU N . 36026 1
139 . 1 1 21 21 LYS H H 1 8.800 0.001 . 1 . . . . A 21 LYS H . 36026 1
140 . 1 1 21 21 LYS HB2 H 1 1.723 0.000 . 2 . . . . A 21 LYS HB2 . 36026 1
141 . 1 1 21 21 LYS N N 15 124.028 0.030 . 1 . . . . A 21 LYS N . 36026 1
142 . 1 1 22 22 PHE H H 1 8.094 0.003 . 1 . . . . A 22 PHE H . 36026 1
143 . 1 1 22 22 PHE HB2 H 1 2.888 0.009 . 2 . . . . A 22 PHE HB2 . 36026 1
144 . 1 1 22 22 PHE HB3 H 1 3.447 0.001 . 2 . . . . A 22 PHE HB3 . 36026 1
145 . 1 1 22 22 PHE HD1 H 1 7.238 0.009 . 3 . . . . A 22 PHE HD1 . 36026 1
146 . 1 1 22 22 PHE HD2 H 1 7.238 0.009 . 3 . . . . A 22 PHE HD2 . 36026 1
147 . 1 1 22 22 PHE HE1 H 1 7.058 0.000 . 3 . . . . A 22 PHE HE1 . 36026 1
148 . 1 1 22 22 PHE HE2 H 1 7.058 0.000 . 3 . . . . A 22 PHE HE2 . 36026 1
149 . 1 1 22 22 PHE HZ H 1 6.886 0.000 . 1 . . . . A 22 PHE HZ . 36026 1
150 . 1 1 22 22 PHE CD1 C 13 131.939 0.000 . 3 . . . . A 22 PHE CD1 . 36026 1
151 . 1 1 22 22 PHE CD2 C 13 131.939 0.000 . 3 . . . . A 22 PHE CD2 . 36026 1
152 . 1 1 22 22 PHE CE1 C 13 129.323 0.000 . 3 . . . . A 22 PHE CE1 . 36026 1
153 . 1 1 22 22 PHE CE2 C 13 129.323 0.000 . 3 . . . . A 22 PHE CE2 . 36026 1
154 . 1 1 22 22 PHE CZ C 13 129.627 0.000 . 1 . . . . A 22 PHE CZ . 36026 1
155 . 1 1 22 22 PHE N N 15 112.087 0.031 . 1 . . . . A 22 PHE N . 36026 1
156 . 1 1 23 23 ASP H H 1 7.615 0.006 . 1 . . . . A 23 ASP H . 36026 1
157 . 1 1 23 23 ASP HA H 1 4.703 0.004 . 1 . . . . A 23 ASP HA . 36026 1
158 . 1 1 23 23 ASP HB2 H 1 2.633 0.001 . 2 . . . . A 23 ASP HB2 . 36026 1
159 . 1 1 23 23 ASP N N 15 117.143 0.027 . 1 . . . . A 23 ASP N . 36026 1
160 . 1 1 24 24 LEU H H 1 7.943 0.002 . 1 . . . . A 24 LEU H . 36026 1
161 . 1 1 24 24 LEU HA H 1 4.621 0.006 . 1 . . . . A 24 LEU HA . 36026 1
162 . 1 1 24 24 LEU HB2 H 1 0.603 0.000 . 2 . . . . A 24 LEU HB2 . 36026 1
163 . 1 1 24 24 LEU HD11 H 1 -0.067 0.011 . 2 . . . . A 24 LEU HD11 . 36026 1
164 . 1 1 24 24 LEU HD12 H 1 -0.067 0.011 . 2 . . . . A 24 LEU HD12 . 36026 1
165 . 1 1 24 24 LEU HD13 H 1 -0.067 0.011 . 2 . . . . A 24 LEU HD13 . 36026 1
166 . 1 1 24 24 LEU HD21 H 1 0.222 0.009 . 2 . . . . A 24 LEU HD21 . 36026 1
167 . 1 1 24 24 LEU HD22 H 1 0.222 0.009 . 2 . . . . A 24 LEU HD22 . 36026 1
168 . 1 1 24 24 LEU HD23 H 1 0.222 0.009 . 2 . . . . A 24 LEU HD23 . 36026 1
169 . 1 1 24 24 LEU CD1 C 13 24.747 0.013 . 2 . . . . A 24 LEU CD1 . 36026 1
170 . 1 1 24 24 LEU CD2 C 13 24.205 0.018 . 2 . . . . A 24 LEU CD2 . 36026 1
171 . 1 1 24 24 LEU N N 15 117.970 0.034 . 1 . . . . A 24 LEU N . 36026 1
172 . 1 1 25 25 VAL H H 1 9.029 0.003 . 1 . . . . A 25 VAL H . 36026 1
173 . 1 1 25 25 VAL HA H 1 4.819 0.002 . 1 . . . . A 25 VAL HA . 36026 1
174 . 1 1 25 25 VAL HB H 1 2.029 0.000 . 1 . . . . A 25 VAL HB . 36026 1
175 . 1 1 25 25 VAL HG11 H 1 0.911 0.003 . 2 . . . . A 25 VAL HG11 . 36026 1
176 . 1 1 25 25 VAL HG12 H 1 0.911 0.003 . 2 . . . . A 25 VAL HG12 . 36026 1
177 . 1 1 25 25 VAL HG13 H 1 0.911 0.003 . 2 . . . . A 25 VAL HG13 . 36026 1
178 . 1 1 25 25 VAL HG21 H 1 1.023 0.002 . 2 . . . . A 25 VAL HG21 . 36026 1
179 . 1 1 25 25 VAL HG22 H 1 1.023 0.002 . 2 . . . . A 25 VAL HG22 . 36026 1
180 . 1 1 25 25 VAL HG23 H 1 1.023 0.002 . 2 . . . . A 25 VAL HG23 . 36026 1
181 . 1 1 25 25 VAL CG1 C 13 21.071 0.000 . 2 . . . . A 25 VAL CG1 . 36026 1
182 . 1 1 25 25 VAL CG2 C 13 20.714 0.024 . 2 . . . . A 25 VAL CG2 . 36026 1
183 . 1 1 25 25 VAL N N 15 122.746 0.023 . 1 . . . . A 25 VAL N . 36026 1
184 . 1 1 26 26 PRO HA H 1 4.453 0.014 . 1 . . . . A 26 PRO HA . 36026 1
185 . 1 1 26 26 PRO HB3 H 1 2.247 0.000 . 2 . . . . A 26 PRO HB3 . 36026 1
186 . 1 1 27 27 VAL H H 1 8.259 0.007 . 1 . . . . A 27 VAL H . 36026 1
187 . 1 1 27 27 VAL HA H 1 4.437 0.000 . 1 . . . . A 27 VAL HA . 36026 1
188 . 1 1 27 27 VAL HB H 1 1.871 0.000 . 1 . . . . A 27 VAL HB . 36026 1
189 . 1 1 27 27 VAL HG11 H 1 1.194 0.007 . 2 . . . . A 27 VAL HG11 . 36026 1
190 . 1 1 27 27 VAL HG12 H 1 1.194 0.007 . 2 . . . . A 27 VAL HG12 . 36026 1
191 . 1 1 27 27 VAL HG13 H 1 1.194 0.007 . 2 . . . . A 27 VAL HG13 . 36026 1
192 . 1 1 27 27 VAL HG21 H 1 1.149 0.001 . 2 . . . . A 27 VAL HG21 . 36026 1
193 . 1 1 27 27 VAL HG22 H 1 1.149 0.001 . 2 . . . . A 27 VAL HG22 . 36026 1
194 . 1 1 27 27 VAL HG23 H 1 1.149 0.001 . 2 . . . . A 27 VAL HG23 . 36026 1
195 . 1 1 27 27 VAL CG1 C 13 23.925 0.042 . 2 . . . . A 27 VAL CG1 . 36026 1
196 . 1 1 27 27 VAL CG2 C 13 20.369 0.025 . 2 . . . . A 27 VAL CG2 . 36026 1
197 . 1 1 27 27 VAL N N 15 127.250 0.021 . 1 . . . . A 27 VAL N . 36026 1
198 . 1 1 28 28 PRO HA H 1 4.489 0.000 . 1 . . . . A 28 PRO HA . 36026 1
199 . 1 1 28 28 PRO HB2 H 1 1.907 0.001 . 2 . . . . A 28 PRO HB2 . 36026 1
200 . 1 1 28 28 PRO HB3 H 1 2.338 0.010 . 2 . . . . A 28 PRO HB3 . 36026 1
201 . 1 1 29 29 THR H H 1 8.264 0.000 . 1 . . . . A 29 THR H . 36026 1
202 . 1 1 29 29 THR HA H 1 2.766 0.016 . 1 . . . . A 29 THR HA . 36026 1
203 . 1 1 29 29 THR HB H 1 3.702 0.001 . 1 . . . . A 29 THR HB . 36026 1
204 . 1 1 29 29 THR HG21 H 1 0.978 0.005 . 1 . . . . A 29 THR HG21 . 36026 1
205 . 1 1 29 29 THR HG22 H 1 0.978 0.005 . 1 . . . . A 29 THR HG22 . 36026 1
206 . 1 1 29 29 THR HG23 H 1 0.978 0.005 . 1 . . . . A 29 THR HG23 . 36026 1
207 . 1 1 29 29 THR CG2 C 13 22.048 0.028 . 1 . . . . A 29 THR CG2 . 36026 1
208 . 1 1 29 29 THR N N 15 114.850 0.007 . 1 . . . . A 29 THR N . 36026 1
209 . 1 1 30 30 ASN H H 1 8.315 0.004 . 1 . . . . A 30 ASN H . 36026 1
210 . 1 1 30 30 ASN HA H 1 4.377 0.000 . 1 . . . . A 30 ASN HA . 36026 1
211 . 1 1 30 30 ASN HB2 H 1 2.629 0.004 . 2 . . . . A 30 ASN HB2 . 36026 1
212 . 1 1 30 30 ASN HB3 H 1 2.804 0.000 . 2 . . . . A 30 ASN HB3 . 36026 1
213 . 1 1 30 30 ASN N N 15 116.856 0.012 . 1 . . . . A 30 ASN N . 36026 1
214 . 1 1 31 31 LEU H H 1 7.926 0.005 . 1 . . . . A 31 LEU H . 36026 1
215 . 1 1 31 31 LEU HA H 1 4.406 0.006 . 1 . . . . A 31 LEU HA . 36026 1
216 . 1 1 31 31 LEU HB2 H 1 1.706 0.001 . 2 . . . . A 31 LEU HB2 . 36026 1
217 . 1 1 31 31 LEU HB3 H 1 1.571 0.026 . 2 . . . . A 31 LEU HB3 . 36026 1
218 . 1 1 31 31 LEU HD11 H 1 0.738 0.004 . 2 . . . . A 31 LEU HD11 . 36026 1
219 . 1 1 31 31 LEU HD12 H 1 0.738 0.004 . 2 . . . . A 31 LEU HD12 . 36026 1
220 . 1 1 31 31 LEU HD13 H 1 0.738 0.004 . 2 . . . . A 31 LEU HD13 . 36026 1
221 . 1 1 31 31 LEU HD21 H 1 0.907 0.015 . 2 . . . . A 31 LEU HD21 . 36026 1
222 . 1 1 31 31 LEU HD22 H 1 0.907 0.015 . 2 . . . . A 31 LEU HD22 . 36026 1
223 . 1 1 31 31 LEU HD23 H 1 0.907 0.015 . 2 . . . . A 31 LEU HD23 . 36026 1
224 . 1 1 31 31 LEU CD1 C 13 22.669 0.013 . 2 . . . . A 31 LEU CD1 . 36026 1
225 . 1 1 31 31 LEU CD2 C 13 25.499 0.000 . 2 . . . . A 31 LEU CD2 . 36026 1
226 . 1 1 31 31 LEU N N 15 119.010 0.017 . 1 . . . . A 31 LEU N . 36026 1
227 . 1 1 32 32 TYR H H 1 7.317 0.002 . 1 . . . . A 32 TYR H . 36026 1
228 . 1 1 32 32 TYR HA H 1 4.113 0.006 . 1 . . . . A 32 TYR HA . 36026 1
229 . 1 1 32 32 TYR HB2 H 1 2.765 0.007 . 2 . . . . A 32 TYR HB2 . 36026 1
230 . 1 1 32 32 TYR HB3 H 1 3.254 0.012 . 2 . . . . A 32 TYR HB3 . 36026 1
231 . 1 1 32 32 TYR HD1 H 1 6.889 0.004 . 3 . . . . A 32 TYR HD1 . 36026 1
232 . 1 1 32 32 TYR HD2 H 1 6.889 0.004 . 3 . . . . A 32 TYR HD2 . 36026 1
233 . 1 1 32 32 TYR HE1 H 1 6.869 0.000 . 3 . . . . A 32 TYR HE1 . 36026 1
234 . 1 1 32 32 TYR HE2 H 1 6.869 0.000 . 3 . . . . A 32 TYR HE2 . 36026 1
235 . 1 1 32 32 TYR CD1 C 13 131.455 0.011 . 3 . . . . A 32 TYR CD1 . 36026 1
236 . 1 1 32 32 TYR CD2 C 13 131.455 0.011 . 3 . . . . A 32 TYR CD2 . 36026 1
237 . 1 1 32 32 TYR CE1 C 13 118.760 0.000 . 3 . . . . A 32 TYR CE1 . 36026 1
238 . 1 1 32 32 TYR CE2 C 13 118.760 0.000 . 3 . . . . A 32 TYR CE2 . 36026 1
239 . 1 1 32 32 TYR N N 15 120.953 0.009 . 1 . . . . A 32 TYR N . 36026 1
240 . 1 1 33 33 GLY H H 1 8.028 0.004 . 1 . . . . A 33 GLY H . 36026 1
241 . 1 1 33 33 GLY HA2 H 1 2.381 0.002 . 2 . . . . A 33 GLY HA2 . 36026 1
242 . 1 1 33 33 GLY HA3 H 1 4.115 0.001 . 2 . . . . A 33 GLY HA3 . 36026 1
243 . 1 1 33 33 GLY N N 15 112.972 0.018 . 1 . . . . A 33 GLY N . 36026 1
244 . 1 1 34 34 ASP H H 1 7.337 0.002 . 1 . . . . A 34 ASP H . 36026 1
245 . 1 1 34 34 ASP HA H 1 4.855 0.000 . 1 . . . . A 34 ASP HA . 36026 1
246 . 1 1 34 34 ASP HB2 H 1 1.945 0.000 . 2 . . . . A 34 ASP HB2 . 36026 1
247 . 1 1 34 34 ASP HB3 H 1 2.637 0.000 . 2 . . . . A 34 ASP HB3 . 36026 1
248 . 1 1 34 34 ASP N N 15 120.932 0.016 . 1 . . . . A 34 ASP N . 36026 1
249 . 1 1 35 35 PHE HA H 1 4.053 0.003 . 1 . . . . A 35 PHE HA . 36026 1
250 . 1 1 35 35 PHE HB2 H 1 1.898 0.000 . 2 . . . . A 35 PHE HB2 . 36026 1
251 . 1 1 35 35 PHE HD1 H 1 5.460 0.002 . 3 . . . . A 35 PHE HD1 . 36026 1
252 . 1 1 35 35 PHE HD2 H 1 5.460 0.009 . 3 . . . . A 35 PHE HD2 . 36026 1
253 . 1 1 35 35 PHE HE1 H 1 5.970 0.002 . 3 . . . . A 35 PHE HE1 . 36026 1
254 . 1 1 35 35 PHE HE2 H 1 5.970 0.009 . 3 . . . . A 35 PHE HE2 . 36026 1
255 . 1 1 35 35 PHE HZ H 1 6.411 0.000 . 1 . . . . A 35 PHE HZ . 36026 1
256 . 1 1 35 35 PHE CD1 C 13 131.516 0.022 . 3 . . . . A 35 PHE CD1 . 36026 1
257 . 1 1 35 35 PHE CD2 C 13 131.516 0.022 . 3 . . . . A 35 PHE CD2 . 36026 1
258 . 1 1 35 35 PHE CE1 C 13 128.669 0.000 . 3 . . . . A 35 PHE CE1 . 36026 1
259 . 1 1 35 35 PHE CE2 C 13 128.669 0.000 . 3 . . . . A 35 PHE CE2 . 36026 1
260 . 1 1 35 35 PHE CZ C 13 126.538 0.000 . 1 . . . . A 35 PHE CZ . 36026 1
261 . 1 1 36 36 PHE H H 1 8.759 0.001 . 1 . . . . A 36 PHE H . 36026 1
262 . 1 1 36 36 PHE HA H 1 5.372 0.008 . 1 . . . . A 36 PHE HA . 36026 1
263 . 1 1 36 36 PHE HB2 H 1 3.474 0.000 . 2 . . . . A 36 PHE HB2 . 36026 1
264 . 1 1 36 36 PHE HB3 H 1 3.563 0.017 . 2 . . . . A 36 PHE HB3 . 36026 1
265 . 1 1 36 36 PHE HD1 H 1 7.270 0.003 . 3 . . . . A 36 PHE HD1 . 36026 1
266 . 1 1 36 36 PHE HD2 H 1 7.270 0.003 . 3 . . . . A 36 PHE HD2 . 36026 1
267 . 1 1 36 36 PHE CD1 C 13 132.206 0.000 . 3 . . . . A 36 PHE CD1 . 36026 1
268 . 1 1 36 36 PHE CD2 C 13 132.206 0.000 . 3 . . . . A 36 PHE CD2 . 36026 1
269 . 1 1 36 36 PHE N N 15 123.294 0.012 . 1 . . . . A 36 PHE N . 36026 1
270 . 1 1 37 37 THR H H 1 9.172 0.009 . 1 . . . . A 37 THR H . 36026 1
271 . 1 1 37 37 THR HA H 1 4.452 0.008 . 1 . . . . A 37 THR HA . 36026 1
272 . 1 1 37 37 THR HB H 1 4.635 0.025 . 1 . . . . A 37 THR HB . 36026 1
273 . 1 1 37 37 THR HG21 H 1 1.432 0.004 . 1 . . . . A 37 THR HG21 . 36026 1
274 . 1 1 37 37 THR HG22 H 1 1.432 0.004 . 1 . . . . A 37 THR HG22 . 36026 1
275 . 1 1 37 37 THR HG23 H 1 1.432 0.004 . 1 . . . . A 37 THR HG23 . 36026 1
276 . 1 1 37 37 THR CG2 C 13 22.794 0.020 . 1 . . . . A 37 THR CG2 . 36026 1
277 . 1 1 37 37 THR N N 15 114.165 0.013 . 1 . . . . A 37 THR N . 36026 1
278 . 1 1 38 38 GLY H H 1 8.582 0.003 . 1 . . . . A 38 GLY H . 36026 1
279 . 1 1 38 38 GLY HA2 H 1 4.047 0.012 . 2 . . . . A 38 GLY HA2 . 36026 1
280 . 1 1 38 38 GLY HA3 H 1 3.540 0.003 . 2 . . . . A 38 GLY HA3 . 36026 1
281 . 1 1 38 38 GLY N N 15 108.021 0.021 . 1 . . . . A 38 GLY N . 36026 1
282 . 1 1 39 39 ASP H H 1 7.954 0.001 . 1 . . . . A 39 ASP H . 36026 1
283 . 1 1 39 39 ASP HA H 1 5.414 0.002 . 1 . . . . A 39 ASP HA . 36026 1
284 . 1 1 39 39 ASP HB2 H 1 2.662 0.001 . 2 . . . . A 39 ASP HB2 . 36026 1
285 . 1 1 39 39 ASP HB3 H 1 2.979 0.003 . 2 . . . . A 39 ASP HB3 . 36026 1
286 . 1 1 39 39 ASP N N 15 119.810 0.006 . 1 . . . . A 39 ASP N . 36026 1
287 . 1 1 40 40 ALA H H 1 8.096 0.007 . 1 . . . . A 40 ALA H . 36026 1
288 . 1 1 40 40 ALA HA H 1 5.973 0.005 . 1 . . . . A 40 ALA HA . 36026 1
289 . 1 1 40 40 ALA HB1 H 1 1.501 0.009 . 1 . . . . A 40 ALA HB1 . 36026 1
290 . 1 1 40 40 ALA HB2 H 1 1.501 0.009 . 1 . . . . A 40 ALA HB2 . 36026 1
291 . 1 1 40 40 ALA HB3 H 1 1.501 0.009 . 1 . . . . A 40 ALA HB3 . 36026 1
292 . 1 1 40 40 ALA CB C 13 24.044 0.025 . 1 . . . . A 40 ALA CB . 36026 1
293 . 1 1 40 40 ALA N N 15 117.169 0.007 . 1 . . . . A 40 ALA N . 36026 1
294 . 1 1 41 41 TYR H H 1 9.388 0.005 . 1 . . . . A 41 TYR H . 36026 1
295 . 1 1 41 41 TYR HA H 1 5.732 0.006 . 1 . . . . A 41 TYR HA . 36026 1
296 . 1 1 41 41 TYR HB2 H 1 2.923 0.007 . 2 . . . . A 41 TYR HB2 . 36026 1
297 . 1 1 41 41 TYR HB3 H 1 3.244 0.006 . 2 . . . . A 41 TYR HB3 . 36026 1
298 . 1 1 41 41 TYR HD1 H 1 7.305 0.014 . 3 . . . . A 41 TYR HD1 . 36026 1
299 . 1 1 41 41 TYR HD2 H 1 7.305 0.014 . 3 . . . . A 41 TYR HD2 . 36026 1
300 . 1 1 41 41 TYR HE1 H 1 7.252 0.004 . 3 . . . . A 41 TYR HE1 . 36026 1
301 . 1 1 41 41 TYR HE2 H 1 7.252 0.004 . 3 . . . . A 41 TYR HE2 . 36026 1
302 . 1 1 41 41 TYR CD1 C 13 134.030 0.031 . 3 . . . . A 41 TYR CD1 . 36026 1
303 . 1 1 41 41 TYR CD2 C 13 134.030 0.031 . 3 . . . . A 41 TYR CD2 . 36026 1
304 . 1 1 41 41 TYR CE1 C 13 118.516 0.012 . 3 . . . . A 41 TYR CE1 . 36026 1
305 . 1 1 41 41 TYR CE2 C 13 118.516 0.012 . 3 . . . . A 41 TYR CE2 . 36026 1
306 . 1 1 41 41 TYR N N 15 116.184 0.009 . 1 . . . . A 41 TYR N . 36026 1
307 . 1 1 42 42 VAL H H 1 9.702 0.007 . 1 . . . . A 42 VAL H . 36026 1
308 . 1 1 42 42 VAL HA H 1 4.986 0.006 . 1 . . . . A 42 VAL HA . 36026 1
309 . 1 1 42 42 VAL HB H 1 1.998 0.006 . 1 . . . . A 42 VAL HB . 36026 1
310 . 1 1 42 42 VAL HG11 H 1 0.845 0.001 . 2 . . . . A 42 VAL HG11 . 36026 1
311 . 1 1 42 42 VAL HG12 H 1 0.845 0.001 . 2 . . . . A 42 VAL HG12 . 36026 1
312 . 1 1 42 42 VAL HG13 H 1 0.845 0.001 . 2 . . . . A 42 VAL HG13 . 36026 1
313 . 1 1 42 42 VAL HG21 H 1 0.974 0.010 . 2 . . . . A 42 VAL HG21 . 36026 1
314 . 1 1 42 42 VAL HG22 H 1 0.974 0.010 . 2 . . . . A 42 VAL HG22 . 36026 1
315 . 1 1 42 42 VAL HG23 H 1 0.974 0.010 . 2 . . . . A 42 VAL HG23 . 36026 1
316 . 1 1 42 42 VAL CG2 C 13 21.799 0.038 . 2 . . . . A 42 VAL CG2 . 36026 1
317 . 1 1 42 42 VAL N N 15 120.900 0.011 . 1 . . . . A 42 VAL N . 36026 1
318 . 1 1 43 43 ILE H H 1 10.039 0.003 . 1 . . . . A 43 ILE H . 36026 1
319 . 1 1 43 43 ILE HA H 1 5.451 0.011 . 1 . . . . A 43 ILE HA . 36026 1
320 . 1 1 43 43 ILE HB H 1 2.253 0.020 . 1 . . . . A 43 ILE HB . 36026 1
321 . 1 1 43 43 ILE HG12 H 1 2.075 0.000 . 2 . . . . A 43 ILE HG12 . 36026 1
322 . 1 1 43 43 ILE HG13 H 1 1.671 0.000 . 2 . . . . A 43 ILE HG13 . 36026 1
323 . 1 1 43 43 ILE HG21 H 1 0.972 0.005 . 1 . . . . A 43 ILE HG21 . 36026 1
324 . 1 1 43 43 ILE HG22 H 1 0.972 0.005 . 1 . . . . A 43 ILE HG22 . 36026 1
325 . 1 1 43 43 ILE HG23 H 1 0.972 0.005 . 1 . . . . A 43 ILE HG23 . 36026 1
326 . 1 1 43 43 ILE HD11 H 1 1.325 0.008 . 1 . . . . A 43 ILE HD11 . 36026 1
327 . 1 1 43 43 ILE HD12 H 1 1.325 0.008 . 1 . . . . A 43 ILE HD12 . 36026 1
328 . 1 1 43 43 ILE HD13 H 1 1.325 0.008 . 1 . . . . A 43 ILE HD13 . 36026 1
329 . 1 1 43 43 ILE CG2 C 13 22.750 0.015 . 1 . . . . A 43 ILE CG2 . 36026 1
330 . 1 1 43 43 ILE CD1 C 13 18.897 0.016 . 1 . . . . A 43 ILE CD1 . 36026 1
331 . 1 1 43 43 ILE N N 15 128.220 0.019 . 1 . . . . A 43 ILE N . 36026 1
332 . 1 1 44 44 LEU H H 1 9.641 0.001 . 1 . . . . A 44 LEU H . 36026 1
333 . 1 1 44 44 LEU HA H 1 5.691 0.011 . 1 . . . . A 44 LEU HA . 36026 1
334 . 1 1 44 44 LEU HB2 H 1 1.446 0.012 . 2 . . . . A 44 LEU HB2 . 36026 1
335 . 1 1 44 44 LEU HB3 H 1 2.258 0.001 . 2 . . . . A 44 LEU HB3 . 36026 1
336 . 1 1 44 44 LEU HG H 1 1.723 0.000 . 1 . . . . A 44 LEU HG . 36026 1
337 . 1 1 44 44 LEU HD11 H 1 0.948 0.019 . 2 . . . . A 44 LEU HD11 . 36026 1
338 . 1 1 44 44 LEU HD12 H 1 0.948 0.019 . 2 . . . . A 44 LEU HD12 . 36026 1
339 . 1 1 44 44 LEU HD13 H 1 0.948 0.019 . 2 . . . . A 44 LEU HD13 . 36026 1
340 . 1 1 44 44 LEU HD21 H 1 0.990 0.005 . 2 . . . . A 44 LEU HD21 . 36026 1
341 . 1 1 44 44 LEU HD22 H 1 0.990 0.005 . 2 . . . . A 44 LEU HD22 . 36026 1
342 . 1 1 44 44 LEU HD23 H 1 0.990 0.005 . 2 . . . . A 44 LEU HD23 . 36026 1
343 . 1 1 44 44 LEU CG C 13 27.641 0.000 . 1 . . . . A 44 LEU CG . 36026 1
344 . 1 1 44 44 LEU CD1 C 13 23.236 0.030 . 2 . . . . A 44 LEU CD1 . 36026 1
345 . 1 1 44 44 LEU CD2 C 13 27.384 0.015 . 2 . . . . A 44 LEU CD2 . 36026 1
346 . 1 1 44 44 LEU N N 15 127.572 0.012 . 1 . . . . A 44 LEU N . 36026 1
347 . 1 1 45 45 LYS H H 1 9.767 0.001 . 1 . . . . A 45 LYS H . 36026 1
348 . 1 1 45 45 LYS HA H 1 5.042 0.004 . 1 . . . . A 45 LYS HA . 36026 1
349 . 1 1 45 45 LYS HB2 H 1 2.247 0.000 . 2 . . . . A 45 LYS HB2 . 36026 1
350 . 1 1 45 45 LYS HB3 H 1 0.939 0.008 . 2 . . . . A 45 LYS HB3 . 36026 1
351 . 1 1 45 45 LYS HG2 H 1 1.219 0.000 . 2 . . . . A 45 LYS HG2 . 36026 1
352 . 1 1 45 45 LYS HG3 H 1 1.358 0.482 . 2 . . . . A 45 LYS HG3 . 36026 1
353 . 1 1 45 45 LYS HE2 H 1 2.813 0.000 . 2 . . . . A 45 LYS HE2 . 36026 1
354 . 1 1 45 45 LYS N N 15 134.436 0.016 . 1 . . . . A 45 LYS N . 36026 1
355 . 1 1 46 46 THR H H 1 9.265 0.002 . 1 . . . . A 46 THR H . 36026 1
356 . 1 1 46 46 THR HA H 1 5.161 0.008 . 1 . . . . A 46 THR HA . 36026 1
357 . 1 1 46 46 THR HB H 1 4.146 0.001 . 1 . . . . A 46 THR HB . 36026 1
358 . 1 1 46 46 THR HG21 H 1 0.836 0.007 . 1 . . . . A 46 THR HG21 . 36026 1
359 . 1 1 46 46 THR HG22 H 1 0.836 0.007 . 1 . . . . A 46 THR HG22 . 36026 1
360 . 1 1 46 46 THR HG23 H 1 0.836 0.007 . 1 . . . . A 46 THR HG23 . 36026 1
361 . 1 1 46 46 THR CG2 C 13 23.862 0.081 . 1 . . . . A 46 THR CG2 . 36026 1
362 . 1 1 46 46 THR N N 15 126.696 0.012 . 1 . . . . A 46 THR N . 36026 1
363 . 1 1 47 47 VAL H H 1 9.113 0.003 . 1 . . . . A 47 VAL H . 36026 1
364 . 1 1 47 47 VAL HA H 1 4.319 0.003 . 1 . . . . A 47 VAL HA . 36026 1
365 . 1 1 47 47 VAL HB H 1 1.873 0.002 . 1 . . . . A 47 VAL HB . 36026 1
366 . 1 1 47 47 VAL HG11 H 1 0.844 0.000 . 2 . . . . A 47 VAL HG11 . 36026 1
367 . 1 1 47 47 VAL HG12 H 1 0.844 0.000 . 2 . . . . A 47 VAL HG12 . 36026 1
368 . 1 1 47 47 VAL HG13 H 1 0.844 0.000 . 2 . . . . A 47 VAL HG13 . 36026 1
369 . 1 1 47 47 VAL HG21 H 1 0.826 0.002 . 2 . . . . A 47 VAL HG21 . 36026 1
370 . 1 1 47 47 VAL HG22 H 1 0.826 0.002 . 2 . . . . A 47 VAL HG22 . 36026 1
371 . 1 1 47 47 VAL HG23 H 1 0.826 0.002 . 2 . . . . A 47 VAL HG23 . 36026 1
372 . 1 1 47 47 VAL CG1 C 13 21.517 0.000 . 2 . . . . A 47 VAL CG1 . 36026 1
373 . 1 1 47 47 VAL CG2 C 13 21.056 0.000 . 2 . . . . A 47 VAL CG2 . 36026 1
374 . 1 1 47 47 VAL N N 15 127.223 0.008 . 1 . . . . A 47 VAL N . 36026 1
375 . 1 1 48 48 GLN H H 1 8.822 0.000 . 1 . . . . A 48 GLN H . 36026 1
376 . 1 1 48 48 GLN HA H 1 4.714 0.018 . 1 . . . . A 48 GLN HA . 36026 1
377 . 1 1 48 48 GLN HB2 H 1 1.572 0.003 . 2 . . . . A 48 GLN HB2 . 36026 1
378 . 1 1 48 48 GLN HB3 H 1 2.014 0.000 . 2 . . . . A 48 GLN HB3 . 36026 1
379 . 1 1 48 48 GLN HG2 H 1 1.908 0.000 . 2 . . . . A 48 GLN HG2 . 36026 1
380 . 1 1 48 48 GLN HG3 H 1 2.395 0.005 . 2 . . . . A 48 GLN HG3 . 36026 1
381 . 1 1 48 48 GLN N N 15 125.129 0.010 . 1 . . . . A 48 GLN N . 36026 1
382 . 1 1 49 49 LEU H H 1 8.828 0.001 . 1 . . . . A 49 LEU H . 36026 1
383 . 1 1 49 49 LEU HA H 1 4.466 0.000 . 1 . . . . A 49 LEU HA . 36026 1
384 . 1 1 49 49 LEU HB2 H 1 1.559 0.002 . 2 . . . . A 49 LEU HB2 . 36026 1
385 . 1 1 49 49 LEU HB3 H 1 1.918 0.005 . 2 . . . . A 49 LEU HB3 . 36026 1
386 . 1 1 49 49 LEU HG H 1 1.477 0.019 . 1 . . . . A 49 LEU HG . 36026 1
387 . 1 1 49 49 LEU HD11 H 1 0.803 0.012 . 2 . . . . A 49 LEU HD11 . 36026 1
388 . 1 1 49 49 LEU HD12 H 1 0.803 0.012 . 2 . . . . A 49 LEU HD12 . 36026 1
389 . 1 1 49 49 LEU HD13 H 1 0.803 0.012 . 2 . . . . A 49 LEU HD13 . 36026 1
390 . 1 1 49 49 LEU HD21 H 1 0.765 0.015 . 2 . . . . A 49 LEU HD21 . 36026 1
391 . 1 1 49 49 LEU HD22 H 1 0.765 0.015 . 2 . . . . A 49 LEU HD22 . 36026 1
392 . 1 1 49 49 LEU HD23 H 1 0.765 0.015 . 2 . . . . A 49 LEU HD23 . 36026 1
393 . 1 1 49 49 LEU CG C 13 26.994 0.000 . 1 . . . . A 49 LEU CG . 36026 1
394 . 1 1 49 49 LEU CD1 C 13 25.320 0.000 . 2 . . . . A 49 LEU CD1 . 36026 1
395 . 1 1 49 49 LEU CD2 C 13 21.841 0.000 . 2 . . . . A 49 LEU CD2 . 36026 1
396 . 1 1 49 49 LEU N N 15 128.108 0.019 . 1 . . . . A 49 LEU N . 36026 1
397 . 1 1 50 50 ARG H H 1 8.703 0.001 . 1 . . . . A 50 ARG H . 36026 1
398 . 1 1 50 50 ARG HA H 1 4.030 0.004 . 1 . . . . A 50 ARG HA . 36026 1
399 . 1 1 50 50 ARG HB2 H 1 1.847 0.010 . 2 . . . . A 50 ARG HB2 . 36026 1
400 . 1 1 50 50 ARG HG2 H 1 1.580 0.004 . 2 . . . . A 50 ARG HG2 . 36026 1
401 . 1 1 50 50 ARG N N 15 121.565 0.006 . 1 . . . . A 50 ARG N . 36026 1
402 . 1 1 51 51 ASN H H 1 7.730 0.003 . 1 . . . . A 51 ASN H . 36026 1
403 . 1 1 51 51 ASN HA H 1 4.486 0.004 . 1 . . . . A 51 ASN HA . 36026 1
404 . 1 1 51 51 ASN HB2 H 1 2.780 0.008 . 2 . . . . A 51 ASN HB2 . 36026 1
405 . 1 1 51 51 ASN HB3 H 1 3.178 0.015 . 2 . . . . A 51 ASN HB3 . 36026 1
406 . 1 1 51 51 ASN N N 15 114.063 0.008 . 1 . . . . A 51 ASN N . 36026 1
407 . 1 1 52 52 GLY H H 1 8.047 0.006 . 1 . . . . A 52 GLY H . 36026 1
408 . 1 1 52 52 GLY HA2 H 1 4.340 0.006 . 2 . . . . A 52 GLY HA2 . 36026 1
409 . 1 1 52 52 GLY HA3 H 1 3.516 0.003 . 2 . . . . A 52 GLY HA3 . 36026 1
410 . 1 1 52 52 GLY N N 15 107.733 0.020 . 1 . . . . A 52 GLY N . 36026 1
411 . 1 1 53 53 ASN H H 1 7.991 0.001 . 1 . . . . A 53 ASN H . 36026 1
412 . 1 1 53 53 ASN HA H 1 4.631 0.004 . 1 . . . . A 53 ASN HA . 36026 1
413 . 1 1 53 53 ASN HB2 H 1 2.699 0.001 . 2 . . . . A 53 ASN HB2 . 36026 1
414 . 1 1 53 53 ASN HB3 H 1 2.843 0.003 . 2 . . . . A 53 ASN HB3 . 36026 1
415 . 1 1 53 53 ASN HD21 H 1 6.949 0.000 . 2 . . . . A 53 ASN HD21 . 36026 1
416 . 1 1 53 53 ASN N N 15 119.831 0.006 . 1 . . . . A 53 ASN N . 36026 1
417 . 1 1 54 54 LEU H H 1 8.236 0.004 . 1 . . . . A 54 LEU H . 36026 1
418 . 1 1 54 54 LEU HA H 1 4.967 0.003 . 1 . . . . A 54 LEU HA . 36026 1
419 . 1 1 54 54 LEU HB2 H 1 0.649 0.007 . 2 . . . . A 54 LEU HB2 . 36026 1
420 . 1 1 54 54 LEU HB3 H 1 1.432 0.000 . 2 . . . . A 54 LEU HB3 . 36026 1
421 . 1 1 54 54 LEU HG H 1 1.631 0.004 . 1 . . . . A 54 LEU HG . 36026 1
422 . 1 1 54 54 LEU HD11 H 1 0.786 0.011 . 2 . . . . A 54 LEU HD11 . 36026 1
423 . 1 1 54 54 LEU HD12 H 1 0.786 0.011 . 2 . . . . A 54 LEU HD12 . 36026 1
424 . 1 1 54 54 LEU HD13 H 1 0.786 0.011 . 2 . . . . A 54 LEU HD13 . 36026 1
425 . 1 1 54 54 LEU HD21 H 1 0.537 0.006 . 2 . . . . A 54 LEU HD21 . 36026 1
426 . 1 1 54 54 LEU HD22 H 1 0.537 0.006 . 2 . . . . A 54 LEU HD22 . 36026 1
427 . 1 1 54 54 LEU HD23 H 1 0.537 0.006 . 2 . . . . A 54 LEU HD23 . 36026 1
428 . 1 1 54 54 LEU CD1 C 13 25.357 0.010 . 2 . . . . A 54 LEU CD1 . 36026 1
429 . 1 1 54 54 LEU CD2 C 13 22.479 0.037 . 2 . . . . A 54 LEU CD2 . 36026 1
430 . 1 1 54 54 LEU N N 15 119.179 0.005 . 1 . . . . A 54 LEU N . 36026 1
431 . 1 1 55 55 GLN H H 1 8.868 0.003 . 1 . . . . A 55 GLN H . 36026 1
432 . 1 1 55 55 GLN HA H 1 4.370 0.001 . 1 . . . . A 55 GLN HA . 36026 1
433 . 1 1 55 55 GLN HB2 H 1 1.795 0.005 . 2 . . . . A 55 GLN HB2 . 36026 1
434 . 1 1 55 55 GLN HG2 H 1 2.263 0.003 . 2 . . . . A 55 GLN HG2 . 36026 1
435 . 1 1 55 55 GLN N N 15 122.436 0.008 . 1 . . . . A 55 GLN N . 36026 1
436 . 1 1 56 56 TYR H H 1 8.636 0.001 . 1 . . . . A 56 TYR H . 36026 1
437 . 1 1 56 56 TYR HA H 1 5.714 0.009 . 1 . . . . A 56 TYR HA . 36026 1
438 . 1 1 56 56 TYR HB2 H 1 2.638 0.005 . 2 . . . . A 56 TYR HB2 . 36026 1
439 . 1 1 56 56 TYR HB3 H 1 2.875 0.011 . 2 . . . . A 56 TYR HB3 . 36026 1
440 . 1 1 56 56 TYR HD1 H 1 7.094 0.006 . 3 . . . . A 56 TYR HD1 . 36026 1
441 . 1 1 56 56 TYR HD2 H 1 7.094 0.006 . 3 . . . . A 56 TYR HD2 . 36026 1
442 . 1 1 56 56 TYR HE1 H 1 6.858 0.011 . 3 . . . . A 56 TYR HE1 . 36026 1
443 . 1 1 56 56 TYR HE2 H 1 6.858 0.011 . 3 . . . . A 56 TYR HE2 . 36026 1
444 . 1 1 56 56 TYR CD1 C 13 133.617 0.146 . 3 . . . . A 56 TYR CD1 . 36026 1
445 . 1 1 56 56 TYR CD2 C 13 133.617 0.146 . 3 . . . . A 56 TYR CD2 . 36026 1
446 . 1 1 56 56 TYR CE1 C 13 118.451 0.000 . 3 . . . . A 56 TYR CE1 . 36026 1
447 . 1 1 56 56 TYR CE2 C 13 118.451 0.000 . 3 . . . . A 56 TYR CE2 . 36026 1
448 . 1 1 56 56 TYR N N 15 122.642 0.009 . 1 . . . . A 56 TYR N . 36026 1
449 . 1 1 57 57 ASP H H 1 9.147 0.003 . 1 . . . . A 57 ASP H . 36026 1
450 . 1 1 57 57 ASP HA H 1 5.456 0.004 . 1 . . . . A 57 ASP HA . 36026 1
451 . 1 1 57 57 ASP HB2 H 1 2.808 0.003 . 2 . . . . A 57 ASP HB2 . 36026 1
452 . 1 1 57 57 ASP N N 15 123.157 0.008 . 1 . . . . A 57 ASP N . 36026 1
453 . 1 1 58 58 LEU H H 1 9.333 0.003 . 1 . . . . A 58 LEU H . 36026 1
454 . 1 1 58 58 LEU HA H 1 5.532 0.011 . 1 . . . . A 58 LEU HA . 36026 1
455 . 1 1 58 58 LEU HB2 H 1 1.221 0.020 . 2 . . . . A 58 LEU HB2 . 36026 1
456 . 1 1 58 58 LEU HB3 H 1 1.636 0.007 . 2 . . . . A 58 LEU HB3 . 36026 1
457 . 1 1 58 58 LEU HD11 H 1 0.917 0.004 . 2 . . . . A 58 LEU HD11 . 36026 1
458 . 1 1 58 58 LEU HD12 H 1 0.917 0.004 . 2 . . . . A 58 LEU HD12 . 36026 1
459 . 1 1 58 58 LEU HD13 H 1 0.917 0.004 . 2 . . . . A 58 LEU HD13 . 36026 1
460 . 1 1 58 58 LEU HD21 H 1 0.895 0.002 . 2 . . . . A 58 LEU HD21 . 36026 1
461 . 1 1 58 58 LEU HD22 H 1 0.895 0.002 . 2 . . . . A 58 LEU HD22 . 36026 1
462 . 1 1 58 58 LEU HD23 H 1 0.895 0.002 . 2 . . . . A 58 LEU HD23 . 36026 1
463 . 1 1 58 58 LEU CD1 C 13 25.098 0.020 . 2 . . . . A 58 LEU CD1 . 36026 1
464 . 1 1 58 58 LEU CD2 C 13 27.137 0.037 . 2 . . . . A 58 LEU CD2 . 36026 1
465 . 1 1 58 58 LEU N N 15 127.067 0.019 . 1 . . . . A 58 LEU N . 36026 1
466 . 1 1 59 59 HIS H H 1 10.432 0.003 . 1 . . . . A 59 HIS H . 36026 1
467 . 1 1 59 59 HIS HA H 1 6.118 0.007 . 1 . . . . A 59 HIS HA . 36026 1
468 . 1 1 59 59 HIS HB2 H 1 3.088 0.001 . 2 . . . . A 59 HIS HB2 . 36026 1
469 . 1 1 59 59 HIS HB3 H 1 3.462 0.012 . 2 . . . . A 59 HIS HB3 . 36026 1
470 . 1 1 59 59 HIS HD2 H 1 7.187 0.000 . 1 . . . . A 59 HIS HD2 . 36026 1
471 . 1 1 59 59 HIS N N 15 124.222 0.012 . 1 . . . . A 59 HIS N . 36026 1
472 . 1 1 60 60 TYR H H 1 8.641 0.004 . 1 . . . . A 60 TYR H . 36026 1
473 . 1 1 60 60 TYR HA H 1 6.041 0.011 . 1 . . . . A 60 TYR HA . 36026 1
474 . 1 1 60 60 TYR HB2 H 1 2.923 0.007 . 2 . . . . A 60 TYR HB2 . 36026 1
475 . 1 1 60 60 TYR HB3 H 1 3.443 0.000 . 2 . . . . A 60 TYR HB3 . 36026 1
476 . 1 1 60 60 TYR HD1 H 1 7.009 0.003 . 3 . . . . A 60 TYR HD1 . 36026 1
477 . 1 1 60 60 TYR HE1 H 1 6.749 0.010 . 3 . . . . A 60 TYR HE1 . 36026 1
478 . 1 1 60 60 TYR CD1 C 13 133.961 0.053 . 3 . . . . A 60 TYR CD1 . 36026 1
479 . 1 1 60 60 TYR CE1 C 13 116.844 0.000 . 3 . . . . A 60 TYR CE1 . 36026 1
480 . 1 1 60 60 TYR N N 15 120.062 0.018 . 1 . . . . A 60 TYR N . 36026 1
481 . 1 1 61 61 TRP H H 1 9.411 0.006 . 1 . . . . A 61 TRP H . 36026 1
482 . 1 1 61 61 TRP HA H 1 5.357 0.002 . 1 . . . . A 61 TRP HA . 36026 1
483 . 1 1 61 61 TRP HB2 H 1 3.029 0.009 . 2 . . . . A 61 TRP HB2 . 36026 1
484 . 1 1 61 61 TRP HB3 H 1 2.290 0.014 . 2 . . . . A 61 TRP HB3 . 36026 1
485 . 1 1 61 61 TRP HD1 H 1 6.098 0.006 . 1 . . . . A 61 TRP HD1 . 36026 1
486 . 1 1 61 61 TRP HE1 H 1 11.235 0.002 . 1 . . . . A 61 TRP HE1 . 36026 1
487 . 1 1 61 61 TRP HE3 H 1 7.765 0.000 . 1 . . . . A 61 TRP HE3 . 36026 1
488 . 1 1 61 61 TRP HZ2 H 1 7.058 0.000 . 1 . . . . A 61 TRP HZ2 . 36026 1
489 . 1 1 61 61 TRP CD1 C 13 126.370 0.000 . 1 . . . . A 61 TRP CD1 . 36026 1
490 . 1 1 61 61 TRP CE3 C 13 122.076 0.000 . 1 . . . . A 61 TRP CE3 . 36026 1
491 . 1 1 61 61 TRP CZ2 C 13 112.380 0.000 . 1 . . . . A 61 TRP CZ2 . 36026 1
492 . 1 1 61 61 TRP N N 15 124.645 0.012 . 1 . . . . A 61 TRP N . 36026 1
493 . 1 1 61 61 TRP NE1 N 15 129.133 0.016 . 1 . . . . A 61 TRP NE1 . 36026 1
494 . 1 1 62 62 LEU H H 1 7.739 0.010 . 1 . . . . A 62 LEU H . 36026 1
495 . 1 1 62 62 LEU HA H 1 4.620 0.005 . 1 . . . . A 62 LEU HA . 36026 1
496 . 1 1 62 62 LEU HB2 H 1 1.183 0.003 . 2 . . . . A 62 LEU HB2 . 36026 1
497 . 1 1 62 62 LEU HB3 H 1 1.668 0.011 . 2 . . . . A 62 LEU HB3 . 36026 1
498 . 1 1 62 62 LEU HG H 1 1.697 0.000 . 1 . . . . A 62 LEU HG . 36026 1
499 . 1 1 62 62 LEU HD11 H 1 0.872 0.010 . 2 . . . . A 62 LEU HD11 . 36026 1
500 . 1 1 62 62 LEU HD12 H 1 0.872 0.010 . 2 . . . . A 62 LEU HD12 . 36026 1
501 . 1 1 62 62 LEU HD13 H 1 0.872 0.010 . 2 . . . . A 62 LEU HD13 . 36026 1
502 . 1 1 62 62 LEU HD21 H 1 1.019 0.012 . 2 . . . . A 62 LEU HD21 . 36026 1
503 . 1 1 62 62 LEU HD22 H 1 1.019 0.012 . 2 . . . . A 62 LEU HD22 . 36026 1
504 . 1 1 62 62 LEU HD23 H 1 1.019 0.012 . 2 . . . . A 62 LEU HD23 . 36026 1
505 . 1 1 62 62 LEU CD1 C 13 25.507 0.000 . 2 . . . . A 62 LEU CD1 . 36026 1
506 . 1 1 62 62 LEU CD2 C 13 24.511 0.013 . 2 . . . . A 62 LEU CD2 . 36026 1
507 . 1 1 62 62 LEU N N 15 125.057 0.008 . 1 . . . . A 62 LEU N . 36026 1
508 . 1 1 63 63 GLY H H 1 7.463 0.002 . 1 . . . . A 63 GLY H . 36026 1
509 . 1 1 63 63 GLY HA2 H 1 4.062 0.021 . 2 . . . . A 63 GLY HA2 . 36026 1
510 . 1 1 63 63 GLY HA3 H 1 3.615 0.016 . 2 . . . . A 63 GLY HA3 . 36026 1
511 . 1 1 63 63 GLY N N 15 112.834 0.015 . 1 . . . . A 63 GLY N . 36026 1
512 . 1 1 64 64 ASN H H 1 8.919 0.003 . 1 . . . . A 64 ASN H . 36026 1
513 . 1 1 64 64 ASN HA H 1 4.300 0.024 . 1 . . . . A 64 ASN HA . 36026 1
514 . 1 1 64 64 ASN HB3 H 1 2.652 0.006 . 2 . . . . A 64 ASN HB3 . 36026 1
515 . 1 1 64 64 ASN HD22 H 1 7.450 0.000 . 2 . . . . A 64 ASN HD22 . 36026 1
516 . 1 1 64 64 ASN N N 15 120.454 0.013 . 1 . . . . A 64 ASN N . 36026 1
517 . 1 1 64 64 ASN ND2 N 15 109.860 0.000 . 1 . . . . A 64 ASN ND2 . 36026 1
518 . 1 1 65 65 GLU H H 1 8.122 0.001 . 1 . . . . A 65 GLU H . 36026 1
519 . 1 1 65 65 GLU HA H 1 4.542 0.002 . 1 . . . . A 65 GLU HA . 36026 1
520 . 1 1 65 65 GLU HB2 H 1 1.476 0.003 . 2 . . . . A 65 GLU HB2 . 36026 1
521 . 1 1 65 65 GLU HB3 H 1 2.338 0.002 . 2 . . . . A 65 GLU HB3 . 36026 1
522 . 1 1 65 65 GLU HG3 H 1 2.149 0.002 . 2 . . . . A 65 GLU HG3 . 36026 1
523 . 1 1 65 65 GLU N N 15 115.897 0.006 . 1 . . . . A 65 GLU N . 36026 1
524 . 1 1 66 66 CYS H H 1 7.413 0.007 . 1 . . . . A 66 CYS H . 36026 1
525 . 1 1 66 66 CYS HA H 1 4.471 0.000 . 1 . . . . A 66 CYS HA . 36026 1
526 . 1 1 66 66 CYS HB2 H 1 2.630 0.004 . 2 . . . . A 66 CYS HB2 . 36026 1
527 . 1 1 66 66 CYS HB3 H 1 2.812 0.011 . 2 . . . . A 66 CYS HB3 . 36026 1
528 . 1 1 66 66 CYS N N 15 121.532 0.009 . 1 . . . . A 66 CYS N . 36026 1
529 . 1 1 67 67 SER H H 1 8.981 0.012 . 1 . . . . A 67 SER H . 36026 1
530 . 1 1 67 67 SER HA H 1 4.488 0.000 . 1 . . . . A 67 SER HA . 36026 1
531 . 1 1 67 67 SER HB2 H 1 4.266 0.000 . 2 . . . . A 67 SER HB2 . 36026 1
532 . 1 1 67 67 SER HB3 H 1 4.101 0.010 . 2 . . . . A 67 SER HB3 . 36026 1
533 . 1 1 67 67 SER N N 15 124.031 0.013 . 1 . . . . A 67 SER N . 36026 1
534 . 1 1 68 68 GLN H H 1 9.089 0.001 . 1 . . . . A 68 GLN H . 36026 1
535 . 1 1 68 68 GLN HA H 1 4.376 0.015 . 1 . . . . A 68 GLN HA . 36026 1
536 . 1 1 68 68 GLN HB2 H 1 2.079 0.002 . 2 . . . . A 68 GLN HB2 . 36026 1
537 . 1 1 68 68 GLN HG2 H 1 2.417 0.000 . 2 . . . . A 68 GLN HG2 . 36026 1
538 . 1 1 68 68 GLN N N 15 122.222 0.007 . 1 . . . . A 68 GLN N . 36026 1
539 . 1 1 69 69 ASP H H 1 8.549 0.002 . 1 . . . . A 69 ASP H . 36026 1
540 . 1 1 69 69 ASP HA H 1 4.352 0.002 . 1 . . . . A 69 ASP HA . 36026 1
541 . 1 1 69 69 ASP HB3 H 1 2.590 0.006 . 2 . . . . A 69 ASP HB3 . 36026 1
542 . 1 1 69 69 ASP N N 15 119.152 0.007 . 1 . . . . A 69 ASP N . 36026 1
543 . 1 1 70 70 GLU H H 1 7.623 0.002 . 1 . . . . A 70 GLU H . 36026 1
544 . 1 1 70 70 GLU HA H 1 4.065 0.021 . 1 . . . . A 70 GLU HA . 36026 1
545 . 1 1 70 70 GLU HB2 H 1 1.910 0.006 . 2 . . . . A 70 GLU HB2 . 36026 1
546 . 1 1 70 70 GLU HB3 H 1 1.716 0.005 . 2 . . . . A 70 GLU HB3 . 36026 1
547 . 1 1 70 70 GLU HG2 H 1 2.095 0.002 . 2 . . . . A 70 GLU HG2 . 36026 1
548 . 1 1 70 70 GLU HG3 H 1 2.438 0.172 . 2 . . . . A 70 GLU HG3 . 36026 1
549 . 1 1 70 70 GLU N N 15 121.779 0.012 . 1 . . . . A 70 GLU N . 36026 1
550 . 1 1 71 71 SER H H 1 8.416 0.003 . 1 . . . . A 71 SER H . 36026 1
551 . 1 1 71 71 SER HA H 1 4.029 0.031 . 1 . . . . A 71 SER HA . 36026 1
552 . 1 1 71 71 SER HB2 H 1 3.898 0.010 . 2 . . . . A 71 SER HB2 . 36026 1
553 . 1 1 71 71 SER HB3 H 1 3.689 0.008 . 2 . . . . A 71 SER HB3 . 36026 1
554 . 1 1 71 71 SER N N 15 115.740 0.017 . 1 . . . . A 71 SER N . 36026 1
555 . 1 1 72 72 GLY H H 1 8.335 0.012 . 1 . . . . A 72 GLY H . 36026 1
556 . 1 1 72 72 GLY HA2 H 1 3.736 0.015 . 2 . . . . A 72 GLY HA2 . 36026 1
557 . 1 1 72 72 GLY HA3 H 1 3.853 0.011 . 2 . . . . A 72 GLY HA3 . 36026 1
558 . 1 1 72 72 GLY N N 15 110.730 0.007 . 1 . . . . A 72 GLY N . 36026 1
559 . 1 1 73 73 ALA H H 1 7.662 0.002 . 1 . . . . A 73 ALA H . 36026 1
560 . 1 1 73 73 ALA HA H 1 3.855 0.006 . 1 . . . . A 73 ALA HA . 36026 1
561 . 1 1 73 73 ALA HB1 H 1 1.311 0.009 . 1 . . . . A 73 ALA HB1 . 36026 1
562 . 1 1 73 73 ALA HB2 H 1 1.311 0.009 . 1 . . . . A 73 ALA HB2 . 36026 1
563 . 1 1 73 73 ALA HB3 H 1 1.311 0.009 . 1 . . . . A 73 ALA HB3 . 36026 1
564 . 1 1 73 73 ALA CB C 13 18.075 0.027 . 1 . . . . A 73 ALA CB . 36026 1
565 . 1 1 73 73 ALA N N 15 123.848 0.008 . 1 . . . . A 73 ALA N . 36026 1
566 . 1 1 74 74 ALA H H 1 7.952 0.001 . 1 . . . . A 74 ALA H . 36026 1
567 . 1 1 74 74 ALA HA H 1 3.806 0.011 . 1 . . . . A 74 ALA HA . 36026 1
568 . 1 1 74 74 ALA HB1 H 1 1.456 0.013 . 1 . . . . A 74 ALA HB1 . 36026 1
569 . 1 1 74 74 ALA HB2 H 1 1.456 0.013 . 1 . . . . A 74 ALA HB2 . 36026 1
570 . 1 1 74 74 ALA HB3 H 1 1.456 0.013 . 1 . . . . A 74 ALA HB3 . 36026 1
571 . 1 1 74 74 ALA CB C 13 18.835 0.021 . 1 . . . . A 74 ALA CB . 36026 1
572 . 1 1 74 74 ALA N N 15 119.247 0.011 . 1 . . . . A 74 ALA N . 36026 1
573 . 1 1 75 75 ALA H H 1 7.244 0.002 . 1 . . . . A 75 ALA H . 36026 1
574 . 1 1 75 75 ALA HA H 1 3.077 0.003 . 1 . . . . A 75 ALA HA . 36026 1
575 . 1 1 75 75 ALA HB1 H 1 1.268 0.014 . 1 . . . . A 75 ALA HB1 . 36026 1
576 . 1 1 75 75 ALA HB2 H 1 1.268 0.014 . 1 . . . . A 75 ALA HB2 . 36026 1
577 . 1 1 75 75 ALA HB3 H 1 1.268 0.014 . 1 . . . . A 75 ALA HB3 . 36026 1
578 . 1 1 75 75 ALA CB C 13 17.852 0.023 . 1 . . . . A 75 ALA CB . 36026 1
579 . 1 1 75 75 ALA N N 15 120.617 0.007 . 1 . . . . A 75 ALA N . 36026 1
580 . 1 1 76 76 ILE H H 1 7.579 0.002 . 1 . . . . A 76 ILE H . 36026 1
581 . 1 1 76 76 ILE HA H 1 3.658 0.005 . 1 . . . . A 76 ILE HA . 36026 1
582 . 1 1 76 76 ILE HB H 1 1.661 0.009 . 1 . . . . A 76 ILE HB . 36026 1
583 . 1 1 76 76 ILE HG12 H 1 1.484 0.007 . 2 . . . . A 76 ILE HG12 . 36026 1
584 . 1 1 76 76 ILE HG13 H 1 1.056 0.006 . 2 . . . . A 76 ILE HG13 . 36026 1
585 . 1 1 76 76 ILE HG21 H 1 0.682 0.003 . 1 . . . . A 76 ILE HG21 . 36026 1
586 . 1 1 76 76 ILE HG22 H 1 0.682 0.003 . 1 . . . . A 76 ILE HG22 . 36026 1
587 . 1 1 76 76 ILE HG23 H 1 0.682 0.003 . 1 . . . . A 76 ILE HG23 . 36026 1
588 . 1 1 76 76 ILE HD11 H 1 0.684 0.002 . 1 . . . . A 76 ILE HD11 . 36026 1
589 . 1 1 76 76 ILE HD12 H 1 0.684 0.002 . 1 . . . . A 76 ILE HD12 . 36026 1
590 . 1 1 76 76 ILE HD13 H 1 0.684 0.002 . 1 . . . . A 76 ILE HD13 . 36026 1
591 . 1 1 76 76 ILE CG2 C 13 17.091 0.025 . 1 . . . . A 76 ILE CG2 . 36026 1
592 . 1 1 76 76 ILE CD1 C 13 12.466 0.019 . 1 . . . . A 76 ILE CD1 . 36026 1
593 . 1 1 76 76 ILE N N 15 119.580 0.006 . 1 . . . . A 76 ILE N . 36026 1
594 . 1 1 77 77 PHE H H 1 8.733 0.001 . 1 . . . . A 77 PHE H . 36026 1
595 . 1 1 77 77 PHE HA H 1 4.406 0.005 . 1 . . . . A 77 PHE HA . 36026 1
596 . 1 1 77 77 PHE HB2 H 1 2.908 0.008 . 2 . . . . A 77 PHE HB2 . 36026 1
597 . 1 1 77 77 PHE HD1 H 1 7.016 0.010 . 3 . . . . A 77 PHE HD1 . 36026 1
598 . 1 1 77 77 PHE CD1 C 13 130.701 0.053 . 3 . . . . A 77 PHE CD1 . 36026 1
599 . 1 1 77 77 PHE N N 15 119.027 0.004 . 1 . . . . A 77 PHE N . 36026 1
600 . 1 1 78 78 THR H H 1 7.705 0.001 . 1 . . . . A 78 THR H . 36026 1
601 . 1 1 78 78 THR HA H 1 3.641 0.004 . 1 . . . . A 78 THR HA . 36026 1
602 . 1 1 78 78 THR HB H 1 4.102 0.003 . 1 . . . . A 78 THR HB . 36026 1
603 . 1 1 78 78 THR HG21 H 1 1.188 0.005 . 1 . . . . A 78 THR HG21 . 36026 1
604 . 1 1 78 78 THR HG22 H 1 1.188 0.005 . 1 . . . . A 78 THR HG22 . 36026 1
605 . 1 1 78 78 THR HG23 H 1 1.188 0.005 . 1 . . . . A 78 THR HG23 . 36026 1
606 . 1 1 78 78 THR CG2 C 13 21.581 0.020 . 1 . . . . A 78 THR CG2 . 36026 1
607 . 1 1 78 78 THR N N 15 115.502 0.011 . 1 . . . . A 78 THR N . 36026 1
608 . 1 1 79 79 VAL H H 1 7.373 0.002 . 1 . . . . A 79 VAL H . 36026 1
609 . 1 1 79 79 VAL HA H 1 3.562 0.012 . 1 . . . . A 79 VAL HA . 36026 1
610 . 1 1 79 79 VAL HB H 1 2.181 0.010 . 1 . . . . A 79 VAL HB . 36026 1
611 . 1 1 79 79 VAL HG11 H 1 0.916 0.017 . 2 . . . . A 79 VAL HG11 . 36026 1
612 . 1 1 79 79 VAL HG12 H 1 0.916 0.017 . 2 . . . . A 79 VAL HG12 . 36026 1
613 . 1 1 79 79 VAL HG13 H 1 0.916 0.017 . 2 . . . . A 79 VAL HG13 . 36026 1
614 . 1 1 79 79 VAL HG21 H 1 1.058 0.003 . 2 . . . . A 79 VAL HG21 . 36026 1
615 . 1 1 79 79 VAL HG22 H 1 1.058 0.003 . 2 . . . . A 79 VAL HG22 . 36026 1
616 . 1 1 79 79 VAL HG23 H 1 1.058 0.003 . 2 . . . . A 79 VAL HG23 . 36026 1
617 . 1 1 79 79 VAL CG1 C 13 21.150 0.000 . 2 . . . . A 79 VAL CG1 . 36026 1
618 . 1 1 79 79 VAL CG2 C 13 22.974 0.000 . 2 . . . . A 79 VAL CG2 . 36026 1
619 . 1 1 79 79 VAL N N 15 122.273 0.009 . 1 . . . . A 79 VAL N . 36026 1
620 . 1 1 80 80 GLN H H 1 8.340 0.001 . 1 . . . . A 80 GLN H . 36026 1
621 . 1 1 80 80 GLN HA H 1 4.086 0.005 . 1 . . . . A 80 GLN HA . 36026 1
622 . 1 1 80 80 GLN HB2 H 1 2.343 0.003 . 2 . . . . A 80 GLN HB2 . 36026 1
623 . 1 1 80 80 GLN HB3 H 1 2.428 0.000 . 2 . . . . A 80 GLN HB3 . 36026 1
624 . 1 1 80 80 GLN HG3 H 1 2.652 0.008 . 2 . . . . A 80 GLN HG3 . 36026 1
625 . 1 1 80 80 GLN N N 15 118.655 0.014 . 1 . . . . A 80 GLN N . 36026 1
626 . 1 1 81 81 LEU H H 1 8.669 0.008 . 1 . . . . A 81 LEU H . 36026 1
627 . 1 1 81 81 LEU HA H 1 3.345 0.000 . 1 . . . . A 81 LEU HA . 36026 1
628 . 1 1 81 81 LEU HB2 H 1 1.395 0.008 . 2 . . . . A 81 LEU HB2 . 36026 1
629 . 1 1 81 81 LEU HB3 H 1 0.911 0.049 . 2 . . . . A 81 LEU HB3 . 36026 1
630 . 1 1 81 81 LEU HG H 1 0.927 0.001 . 1 . . . . A 81 LEU HG . 36026 1
631 . 1 1 81 81 LEU HD11 H 1 0.007 0.000 . 2 . . . . A 81 LEU HD11 . 36026 1
632 . 1 1 81 81 LEU HD12 H 1 0.007 0.000 . 2 . . . . A 81 LEU HD12 . 36026 1
633 . 1 1 81 81 LEU HD13 H 1 0.007 0.000 . 2 . . . . A 81 LEU HD13 . 36026 1
634 . 1 1 81 81 LEU HD21 H 1 0.185 0.006 . 2 . . . . A 81 LEU HD21 . 36026 1
635 . 1 1 81 81 LEU HD22 H 1 0.185 0.006 . 2 . . . . A 81 LEU HD22 . 36026 1
636 . 1 1 81 81 LEU HD23 H 1 0.185 0.006 . 2 . . . . A 81 LEU HD23 . 36026 1
637 . 1 1 81 81 LEU CG C 13 26.965 0.011 . 1 . . . . A 81 LEU CG . 36026 1
638 . 1 1 81 81 LEU CD1 C 13 22.573 0.023 . 2 . . . . A 81 LEU CD1 . 36026 1
639 . 1 1 81 81 LEU CD2 C 13 25.361 0.009 . 2 . . . . A 81 LEU CD2 . 36026 1
640 . 1 1 81 81 LEU N N 15 123.628 0.017 . 1 . . . . A 81 LEU N . 36026 1
641 . 1 1 82 82 ASP H H 1 8.076 0.002 . 1 . . . . A 82 ASP H . 36026 1
642 . 1 1 82 82 ASP HA H 1 4.096 0.006 . 1 . . . . A 82 ASP HA . 36026 1
643 . 1 1 82 82 ASP HB2 H 1 3.149 0.002 . 2 . . . . A 82 ASP HB2 . 36026 1
644 . 1 1 82 82 ASP HB3 H 1 2.588 0.015 . 2 . . . . A 82 ASP HB3 . 36026 1
645 . 1 1 82 82 ASP N N 15 118.556 0.014 . 1 . . . . A 82 ASP N . 36026 1
646 . 1 1 83 83 ASP H H 1 8.471 0.004 . 1 . . . . A 83 ASP H . 36026 1
647 . 1 1 83 83 ASP HA H 1 4.250 0.012 . 1 . . . . A 83 ASP HA . 36026 1
648 . 1 1 83 83 ASP HB2 H 1 2.686 0.006 . 2 . . . . A 83 ASP HB2 . 36026 1
649 . 1 1 83 83 ASP HB3 H 1 2.856 0.011 . 2 . . . . A 83 ASP HB3 . 36026 1
650 . 1 1 83 83 ASP N N 15 119.420 0.016 . 1 . . . . A 83 ASP N . 36026 1
651 . 1 1 84 84 TYR H H 1 8.009 0.006 . 1 . . . . A 84 TYR H . 36026 1
652 . 1 1 84 84 TYR HA H 1 4.130 0.018 . 1 . . . . A 84 TYR HA . 36026 1
653 . 1 1 84 84 TYR HB3 H 1 3.127 0.008 . 2 . . . . A 84 TYR HB3 . 36026 1
654 . 1 1 84 84 TYR HD1 H 1 6.967 0.004 . 3 . . . . A 84 TYR HD1 . 36026 1
655 . 1 1 84 84 TYR HD2 H 1 6.967 0.004 . 3 . . . . A 84 TYR HD2 . 36026 1
656 . 1 1 84 84 TYR HE1 H 1 6.810 0.011 . 3 . . . . A 84 TYR HE1 . 36026 1
657 . 1 1 84 84 TYR HE2 H 1 6.810 0.011 . 3 . . . . A 84 TYR HE2 . 36026 1
658 . 1 1 84 84 TYR CD1 C 13 132.649 0.000 . 3 . . . . A 84 TYR CD1 . 36026 1
659 . 1 1 84 84 TYR CD2 C 13 132.649 0.000 . 3 . . . . A 84 TYR CD2 . 36026 1
660 . 1 1 84 84 TYR CE1 C 13 118.750 0.064 . 3 . . . . A 84 TYR CE1 . 36026 1
661 . 1 1 84 84 TYR CE2 C 13 118.750 0.064 . 3 . . . . A 84 TYR CE2 . 36026 1
662 . 1 1 84 84 TYR N N 15 123.524 0.009 . 1 . . . . A 84 TYR N . 36026 1
663 . 1 1 85 85 LEU H H 1 7.655 0.001 . 1 . . . . A 85 LEU H . 36026 1
664 . 1 1 85 85 LEU HA H 1 4.104 0.000 . 1 . . . . A 85 LEU HA . 36026 1
665 . 1 1 85 85 LEU HB2 H 1 1.671 0.007 . 2 . . . . A 85 LEU HB2 . 36026 1
666 . 1 1 85 85 LEU HB3 H 1 1.374 0.009 . 2 . . . . A 85 LEU HB3 . 36026 1
667 . 1 1 85 85 LEU HD11 H 1 0.075 0.021 . 2 . . . . A 85 LEU HD11 . 36026 1
668 . 1 1 85 85 LEU HD12 H 1 0.075 0.021 . 2 . . . . A 85 LEU HD12 . 36026 1
669 . 1 1 85 85 LEU HD13 H 1 0.075 0.021 . 2 . . . . A 85 LEU HD13 . 36026 1
670 . 1 1 85 85 LEU HD21 H 1 0.336 0.008 . 2 . . . . A 85 LEU HD21 . 36026 1
671 . 1 1 85 85 LEU HD22 H 1 0.336 0.008 . 2 . . . . A 85 LEU HD22 . 36026 1
672 . 1 1 85 85 LEU HD23 H 1 0.336 0.008 . 2 . . . . A 85 LEU HD23 . 36026 1
673 . 1 1 85 85 LEU CD1 C 13 25.763 0.020 . 2 . . . . A 85 LEU CD1 . 36026 1
674 . 1 1 85 85 LEU CD2 C 13 21.044 0.024 . 2 . . . . A 85 LEU CD2 . 36026 1
675 . 1 1 85 85 LEU N N 15 119.464 0.007 . 1 . . . . A 85 LEU N . 36026 1
676 . 1 1 86 86 ASN H H 1 7.947 0.004 . 1 . . . . A 86 ASN H . 36026 1
677 . 1 1 86 86 ASN HA H 1 4.410 0.001 . 1 . . . . A 86 ASN HA . 36026 1
678 . 1 1 86 86 ASN HB2 H 1 2.737 0.004 . 2 . . . . A 86 ASN HB2 . 36026 1
679 . 1 1 86 86 ASN HB3 H 1 3.074 0.001 . 2 . . . . A 86 ASN HB3 . 36026 1
680 . 1 1 86 86 ASN N N 15 115.800 0.007 . 1 . . . . A 86 ASN N . 36026 1
681 . 1 1 87 87 GLY H H 1 8.908 0.002 . 1 . . . . A 87 GLY H . 36026 1
682 . 1 1 87 87 GLY HA2 H 1 3.729 0.002 . 2 . . . . A 87 GLY HA2 . 36026 1
683 . 1 1 87 87 GLY HA3 H 1 3.896 0.004 . 2 . . . . A 87 GLY HA3 . 36026 1
684 . 1 1 87 87 GLY N N 15 106.422 0.027 . 1 . . . . A 87 GLY N . 36026 1
685 . 1 1 88 88 ARG H H 1 7.290 0.002 . 1 . . . . A 88 ARG H . 36026 1
686 . 1 1 88 88 ARG HA H 1 4.331 0.003 . 1 . . . . A 88 ARG HA . 36026 1
687 . 1 1 88 88 ARG HB2 H 1 2.337 0.006 . 2 . . . . A 88 ARG HB2 . 36026 1
688 . 1 1 88 88 ARG HB3 H 1 1.860 0.005 . 2 . . . . A 88 ARG HB3 . 36026 1
689 . 1 1 88 88 ARG HG3 H 1 1.698 0.026 . 2 . . . . A 88 ARG HG3 . 36026 1
690 . 1 1 88 88 ARG N N 15 116.031 0.009 . 1 . . . . A 88 ARG N . 36026 1
691 . 1 1 89 89 ALA H H 1 8.183 0.004 . 1 . . . . A 89 ALA H . 36026 1
692 . 1 1 89 89 ALA HA H 1 4.952 0.003 . 1 . . . . A 89 ALA HA . 36026 1
693 . 1 1 89 89 ALA HB1 H 1 1.091 0.006 . 1 . . . . A 89 ALA HB1 . 36026 1
694 . 1 1 89 89 ALA HB2 H 1 1.091 0.006 . 1 . . . . A 89 ALA HB2 . 36026 1
695 . 1 1 89 89 ALA HB3 H 1 1.091 0.006 . 1 . . . . A 89 ALA HB3 . 36026 1
696 . 1 1 89 89 ALA CB C 13 20.846 0.029 . 1 . . . . A 89 ALA CB . 36026 1
697 . 1 1 89 89 ALA N N 15 121.392 0.019 . 1 . . . . A 89 ALA N . 36026 1
698 . 1 1 90 90 VAL H H 1 8.006 0.001 . 1 . . . . A 90 VAL H . 36026 1
699 . 1 1 90 90 VAL HA H 1 3.955 0.005 . 1 . . . . A 90 VAL HA . 36026 1
700 . 1 1 90 90 VAL HB H 1 2.202 0.012 . 1 . . . . A 90 VAL HB . 36026 1
701 . 1 1 90 90 VAL HG11 H 1 0.614 0.002 . 2 . . . . A 90 VAL HG11 . 36026 1
702 . 1 1 90 90 VAL HG12 H 1 0.614 0.002 . 2 . . . . A 90 VAL HG12 . 36026 1
703 . 1 1 90 90 VAL HG13 H 1 0.614 0.002 . 2 . . . . A 90 VAL HG13 . 36026 1
704 . 1 1 90 90 VAL HG21 H 1 1.038 0.007 . 2 . . . . A 90 VAL HG21 . 36026 1
705 . 1 1 90 90 VAL HG22 H 1 1.038 0.007 . 2 . . . . A 90 VAL HG22 . 36026 1
706 . 1 1 90 90 VAL HG23 H 1 1.038 0.007 . 2 . . . . A 90 VAL HG23 . 36026 1
707 . 1 1 90 90 VAL CG1 C 13 21.419 0.000 . 2 . . . . A 90 VAL CG1 . 36026 1
708 . 1 1 90 90 VAL CG2 C 13 21.620 0.000 . 2 . . . . A 90 VAL CG2 . 36026 1
709 . 1 1 90 90 VAL N N 15 124.598 0.015 . 1 . . . . A 90 VAL N . 36026 1
710 . 1 1 91 91 GLN H H 1 8.534 0.011 . 1 . . . . A 91 GLN H . 36026 1
711 . 1 1 91 91 GLN HA H 1 5.043 0.005 . 1 . . . . A 91 GLN HA . 36026 1
712 . 1 1 91 91 GLN HB2 H 1 1.823 0.001 . 2 . . . . A 91 GLN HB2 . 36026 1
713 . 1 1 91 91 GLN HB3 H 1 1.992 0.006 . 2 . . . . A 91 GLN HB3 . 36026 1
714 . 1 1 91 91 GLN HG3 H 1 2.272 0.003 . 2 . . . . A 91 GLN HG3 . 36026 1
715 . 1 1 91 91 GLN N N 15 126.474 0.010 . 1 . . . . A 91 GLN N . 36026 1
716 . 1 1 92 92 HIS H H 1 8.640 0.006 . 1 . . . . A 92 HIS H . 36026 1
717 . 1 1 92 92 HIS HA H 1 4.735 0.000 . 1 . . . . A 92 HIS HA . 36026 1
718 . 1 1 92 92 HIS HB2 H 1 2.621 0.001 . 2 . . . . A 92 HIS HB2 . 36026 1
719 . 1 1 92 92 HIS HB3 H 1 3.145 0.001 . 2 . . . . A 92 HIS HB3 . 36026 1
720 . 1 1 92 92 HIS HD2 H 1 6.299 0.003 . 1 . . . . A 92 HIS HD2 . 36026 1
721 . 1 1 92 92 HIS HE1 H 1 6.867 0.007 . 1 . . . . A 92 HIS HE1 . 36026 1
722 . 1 1 92 92 HIS CD2 C 13 121.204 0.000 . 1 . . . . A 92 HIS CD2 . 36026 1
723 . 1 1 92 92 HIS CE1 C 13 136.590 0.000 . 1 . . . . A 92 HIS CE1 . 36026 1
724 . 1 1 92 92 HIS N N 15 118.054 0.019 . 1 . . . . A 92 HIS N . 36026 1
725 . 1 1 93 93 ARG H H 1 8.736 0.001 . 1 . . . . A 93 ARG H . 36026 1
726 . 1 1 93 93 ARG HA H 1 3.515 0.001 . 1 . . . . A 93 ARG HA . 36026 1
727 . 1 1 93 93 ARG HB2 H 1 1.368 0.007 . 2 . . . . A 93 ARG HB2 . 36026 1
728 . 1 1 93 93 ARG HB3 H 1 1.551 0.002 . 2 . . . . A 93 ARG HB3 . 36026 1
729 . 1 1 93 93 ARG HG2 H 1 0.888 0.000 . 2 . . . . A 93 ARG HG2 . 36026 1
730 . 1 1 93 93 ARG N N 15 127.065 0.014 . 1 . . . . A 93 ARG N . 36026 1
731 . 1 1 94 94 GLU H H 1 8.784 0.005 . 1 . . . . A 94 GLU H . 36026 1
732 . 1 1 94 94 GLU HA H 1 4.963 0.007 . 1 . . . . A 94 GLU HA . 36026 1
733 . 1 1 94 94 GLU HB2 H 1 1.408 0.000 . 2 . . . . A 94 GLU HB2 . 36026 1
734 . 1 1 94 94 GLU HB3 H 1 1.576 0.000 . 2 . . . . A 94 GLU HB3 . 36026 1
735 . 1 1 94 94 GLU HG2 H 1 2.012 0.000 . 2 . . . . A 94 GLU HG2 . 36026 1
736 . 1 1 94 94 GLU HG3 H 1 1.253 0.000 . 2 . . . . A 94 GLU HG3 . 36026 1
737 . 1 1 94 94 GLU N N 15 126.603 0.016 . 1 . . . . A 94 GLU N . 36026 1
738 . 1 1 95 95 VAL H H 1 7.764 0.005 . 1 . . . . A 95 VAL H . 36026 1
739 . 1 1 95 95 VAL HA H 1 3.871 0.003 . 1 . . . . A 95 VAL HA . 36026 1
740 . 1 1 95 95 VAL HB H 1 1.746 0.006 . 1 . . . . A 95 VAL HB . 36026 1
741 . 1 1 95 95 VAL HG11 H 1 0.680 0.009 . 2 . . . . A 95 VAL HG11 . 36026 1
742 . 1 1 95 95 VAL HG12 H 1 0.680 0.009 . 2 . . . . A 95 VAL HG12 . 36026 1
743 . 1 1 95 95 VAL HG13 H 1 0.680 0.009 . 2 . . . . A 95 VAL HG13 . 36026 1
744 . 1 1 95 95 VAL HG21 H 1 0.834 0.010 . 2 . . . . A 95 VAL HG21 . 36026 1
745 . 1 1 95 95 VAL HG22 H 1 0.834 0.010 . 2 . . . . A 95 VAL HG22 . 36026 1
746 . 1 1 95 95 VAL HG23 H 1 0.834 0.010 . 2 . . . . A 95 VAL HG23 . 36026 1
747 . 1 1 95 95 VAL CG1 C 13 21.138 0.000 . 2 . . . . A 95 VAL CG1 . 36026 1
748 . 1 1 95 95 VAL CG2 C 13 21.198 0.000 . 2 . . . . A 95 VAL CG2 . 36026 1
749 . 1 1 95 95 VAL N N 15 120.204 0.011 . 1 . . . . A 95 VAL N . 36026 1
750 . 1 1 96 96 GLN H H 1 6.819 0.009 . 1 . . . . A 96 GLN H . 36026 1
751 . 1 1 96 96 GLN HA H 1 3.793 0.026 . 1 . . . . A 96 GLN HA . 36026 1
752 . 1 1 96 96 GLN HB2 H 1 1.387 0.017 . 2 . . . . A 96 GLN HB2 . 36026 1
753 . 1 1 96 96 GLN HB3 H 1 1.667 0.002 . 2 . . . . A 96 GLN HB3 . 36026 1
754 . 1 1 96 96 GLN HE21 H 1 6.189 0.000 . 2 . . . . A 96 GLN HE21 . 36026 1
755 . 1 1 96 96 GLN HE22 H 1 6.372 0.000 . 2 . . . . A 96 GLN HE22 . 36026 1
756 . 1 1 96 96 GLN N N 15 124.724 0.014 . 1 . . . . A 96 GLN N . 36026 1
757 . 1 1 97 97 GLY H H 1 8.345 0.002 . 1 . . . . A 97 GLY H . 36026 1
758 . 1 1 97 97 GLY HA2 H 1 3.662 0.004 . 2 . . . . A 97 GLY HA2 . 36026 1
759 . 1 1 97 97 GLY HA3 H 1 3.973 0.001 . 2 . . . . A 97 GLY HA3 . 36026 1
760 . 1 1 97 97 GLY N N 15 116.525 0.011 . 1 . . . . A 97 GLY N . 36026 1
761 . 1 1 98 98 PHE H H 1 8.493 0.005 . 1 . . . . A 98 PHE H . 36026 1
762 . 1 1 98 98 PHE HA H 1 4.835 0.001 . 1 . . . . A 98 PHE HA . 36026 1
763 . 1 1 98 98 PHE HB2 H 1 3.465 0.004 . 2 . . . . A 98 PHE HB2 . 36026 1
764 . 1 1 98 98 PHE HB3 H 1 2.372 0.003 . 2 . . . . A 98 PHE HB3 . 36026 1
765 . 1 1 98 98 PHE HD1 H 1 7.152 0.001 . 3 . . . . A 98 PHE HD1 . 36026 1
766 . 1 1 98 98 PHE CD1 C 13 132.431 0.000 . 3 . . . . A 98 PHE CD1 . 36026 1
767 . 1 1 98 98 PHE N N 15 120.233 0.016 . 1 . . . . A 98 PHE N . 36026 1
768 . 1 1 99 99 GLU H H 1 10.238 0.002 . 1 . . . . A 99 GLU H . 36026 1
769 . 1 1 99 99 GLU HA H 1 4.355 0.004 . 1 . . . . A 99 GLU HA . 36026 1
770 . 1 1 99 99 GLU HB2 H 1 1.914 0.001 . 2 . . . . A 99 GLU HB2 . 36026 1
771 . 1 1 99 99 GLU HB3 H 1 2.119 0.005 . 2 . . . . A 99 GLU HB3 . 36026 1
772 . 1 1 99 99 GLU HG2 H 1 2.540 0.004 . 2 . . . . A 99 GLU HG2 . 36026 1
773 . 1 1 99 99 GLU N N 15 125.216 0.012 . 1 . . . . A 99 GLU N . 36026 1
774 . 1 1 100 100 SER H H 1 10.123 0.003 . 1 . . . . A 100 SER H . 36026 1
775 . 1 1 100 100 SER HA H 1 4.226 0.002 . 1 . . . . A 100 SER HA . 36026 1
776 . 1 1 100 100 SER HB3 H 1 4.373 0.024 . 2 . . . . A 100 SER HB3 . 36026 1
777 . 1 1 100 100 SER N N 15 118.443 0.018 . 1 . . . . A 100 SER N . 36026 1
778 . 1 1 101 101 ALA H H 1 8.807 0.001 . 1 . . . . A 101 ALA H . 36026 1
779 . 1 1 101 101 ALA HA H 1 4.002 0.002 . 1 . . . . A 101 ALA HA . 36026 1
780 . 1 1 101 101 ALA HB1 H 1 1.435 0.004 . 1 . . . . A 101 ALA HB1 . 36026 1
781 . 1 1 101 101 ALA HB2 H 1 1.435 0.004 . 1 . . . . A 101 ALA HB2 . 36026 1
782 . 1 1 101 101 ALA HB3 H 1 1.435 0.004 . 1 . . . . A 101 ALA HB3 . 36026 1
783 . 1 1 101 101 ALA CB C 13 17.857 0.000 . 1 . . . . A 101 ALA CB . 36026 1
784 . 1 1 101 101 ALA N N 15 123.837 0.032 . 1 . . . . A 101 ALA N . 36026 1
785 . 1 1 102 102 THR H H 1 7.965 0.012 . 1 . . . . A 102 THR H . 36026 1
786 . 1 1 102 102 THR HA H 1 3.568 0.024 . 1 . . . . A 102 THR HA . 36026 1
787 . 1 1 102 102 THR HB H 1 3.793 0.003 . 1 . . . . A 102 THR HB . 36026 1
788 . 1 1 102 102 THR HG21 H 1 1.090 0.002 . 1 . . . . A 102 THR HG21 . 36026 1
789 . 1 1 102 102 THR HG22 H 1 1.090 0.002 . 1 . . . . A 102 THR HG22 . 36026 1
790 . 1 1 102 102 THR HG23 H 1 1.090 0.002 . 1 . . . . A 102 THR HG23 . 36026 1
791 . 1 1 102 102 THR CG2 C 13 21.776 0.032 . 1 . . . . A 102 THR CG2 . 36026 1
792 . 1 1 102 102 THR N N 15 113.825 0.004 . 1 . . . . A 102 THR N . 36026 1
793 . 1 1 103 103 PHE H H 1 7.344 0.012 . 1 . . . . A 103 PHE H . 36026 1
794 . 1 1 103 103 PHE HA H 1 2.796 0.034 . 1 . . . . A 103 PHE HA . 36026 1
795 . 1 1 103 103 PHE HB2 H 1 2.692 0.002 . 2 . . . . A 103 PHE HB2 . 36026 1
796 . 1 1 103 103 PHE HB3 H 1 2.943 0.007 . 2 . . . . A 103 PHE HB3 . 36026 1
797 . 1 1 103 103 PHE HD1 H 1 6.438 0.006 . 3 . . . . A 103 PHE HD1 . 36026 1
798 . 1 1 103 103 PHE HE1 H 1 6.919 0.000 . 3 . . . . A 103 PHE HE1 . 36026 1
799 . 1 1 103 103 PHE CD1 C 13 131.623 0.000 . 3 . . . . A 103 PHE CD1 . 36026 1
800 . 1 1 103 103 PHE CE1 C 13 130.626 0.003 . 3 . . . . A 103 PHE CE1 . 36026 1
801 . 1 1 103 103 PHE N N 15 120.947 0.027 . 1 . . . . A 103 PHE N . 36026 1
802 . 1 1 104 104 LEU H H 1 8.226 0.001 . 1 . . . . A 104 LEU H . 36026 1
803 . 1 1 104 104 LEU HA H 1 3.811 0.006 . 1 . . . . A 104 LEU HA . 36026 1
804 . 1 1 104 104 LEU HB2 H 1 1.710 0.023 . 2 . . . . A 104 LEU HB2 . 36026 1
805 . 1 1 104 104 LEU HB3 H 1 1.407 0.008 . 2 . . . . A 104 LEU HB3 . 36026 1
806 . 1 1 104 104 LEU HG H 1 1.781 0.000 . 1 . . . . A 104 LEU HG . 36026 1
807 . 1 1 104 104 LEU HD11 H 1 0.865 0.006 . 2 . . . . A 104 LEU HD11 . 36026 1
808 . 1 1 104 104 LEU HD12 H 1 0.865 0.006 . 2 . . . . A 104 LEU HD12 . 36026 1
809 . 1 1 104 104 LEU HD13 H 1 0.865 0.006 . 2 . . . . A 104 LEU HD13 . 36026 1
810 . 1 1 104 104 LEU HD21 H 1 0.847 0.001 . 2 . . . . A 104 LEU HD21 . 36026 1
811 . 1 1 104 104 LEU HD22 H 1 0.847 0.001 . 2 . . . . A 104 LEU HD22 . 36026 1
812 . 1 1 104 104 LEU HD23 H 1 0.847 0.001 . 2 . . . . A 104 LEU HD23 . 36026 1
813 . 1 1 104 104 LEU CD1 C 13 23.014 0.024 . 2 . . . . A 104 LEU CD1 . 36026 1
814 . 1 1 104 104 LEU CD2 C 13 25.409 0.024 . 2 . . . . A 104 LEU CD2 . 36026 1
815 . 1 1 104 104 LEU N N 15 115.759 0.014 . 1 . . . . A 104 LEU N . 36026 1
816 . 1 1 105 105 GLY H H 1 7.529 0.003 . 1 . . . . A 105 GLY H . 36026 1
817 . 1 1 105 105 GLY HA2 H 1 3.646 0.003 . 2 . . . . A 105 GLY HA2 . 36026 1
818 . 1 1 105 105 GLY HA3 H 1 3.827 0.001 . 2 . . . . A 105 GLY HA3 . 36026 1
819 . 1 1 105 105 GLY N N 15 103.854 0.008 . 1 . . . . A 105 GLY N . 36026 1
820 . 1 1 106 106 TYR H H 1 7.078 0.001 . 1 . . . . A 106 TYR H . 36026 1
821 . 1 1 106 106 TYR HA H 1 4.321 0.012 . 1 . . . . A 106 TYR HA . 36026 1
822 . 1 1 106 106 TYR HB2 H 1 1.883 0.007 . 2 . . . . A 106 TYR HB2 . 36026 1
823 . 1 1 106 106 TYR HB3 H 1 2.157 0.005 . 2 . . . . A 106 TYR HB3 . 36026 1
824 . 1 1 106 106 TYR HD1 H 1 6.346 0.010 . 3 . . . . A 106 TYR HD1 . 36026 1
825 . 1 1 106 106 TYR HE1 H 1 6.188 0.017 . 3 . . . . A 106 TYR HE1 . 36026 1
826 . 1 1 106 106 TYR CD1 C 13 130.944 0.000 . 3 . . . . A 106 TYR CD1 . 36026 1
827 . 1 1 106 106 TYR CE1 C 13 117.345 0.000 . 3 . . . . A 106 TYR CE1 . 36026 1
828 . 1 1 106 106 TYR N N 15 118.017 0.012 . 1 . . . . A 106 TYR N . 36026 1
829 . 1 1 107 107 PHE H H 1 7.109 0.002 . 1 . . . . A 107 PHE H . 36026 1
830 . 1 1 107 107 PHE HA H 1 4.452 0.001 . 1 . . . . A 107 PHE HA . 36026 1
831 . 1 1 107 107 PHE HB2 H 1 2.939 0.003 . 2 . . . . A 107 PHE HB2 . 36026 1
832 . 1 1 107 107 PHE HB3 H 1 2.583 0.006 . 2 . . . . A 107 PHE HB3 . 36026 1
833 . 1 1 107 107 PHE HD1 H 1 6.886 0.006 . 3 . . . . A 107 PHE HD1 . 36026 1
834 . 1 1 107 107 PHE HE1 H 1 6.050 0.004 . 3 . . . . A 107 PHE HE1 . 36026 1
835 . 1 1 107 107 PHE HZ H 1 6.502 0.007 . 1 . . . . A 107 PHE HZ . 36026 1
836 . 1 1 107 107 PHE CD1 C 13 132.968 0.029 . 3 . . . . A 107 PHE CD1 . 36026 1
837 . 1 1 107 107 PHE CE1 C 13 130.544 0.018 . 3 . . . . A 107 PHE CE1 . 36026 1
838 . 1 1 107 107 PHE CZ C 13 127.235 0.000 . 1 . . . . A 107 PHE CZ . 36026 1
839 . 1 1 107 107 PHE N N 15 117.049 0.011 . 1 . . . . A 107 PHE N . 36026 1
840 . 1 1 108 108 LYS H H 1 8.590 0.009 . 1 . . . . A 108 LYS H . 36026 1
841 . 1 1 108 108 LYS HA H 1 4.026 0.021 . 1 . . . . A 108 LYS HA . 36026 1
842 . 1 1 108 108 LYS HB2 H 1 1.808 0.001 . 2 . . . . A 108 LYS HB2 . 36026 1
843 . 1 1 108 108 LYS HG2 H 1 1.440 0.005 . 2 . . . . A 108 LYS HG2 . 36026 1
844 . 1 1 108 108 LYS N N 15 124.192 0.014 . 1 . . . . A 108 LYS N . 36026 1
845 . 1 1 109 109 SER H H 1 8.427 0.005 . 1 . . . . A 109 SER H . 36026 1
846 . 1 1 109 109 SER HA H 1 4.560 0.001 . 1 . . . . A 109 SER HA . 36026 1
847 . 1 1 109 109 SER HB2 H 1 3.886 0.003 . 2 . . . . A 109 SER HB2 . 36026 1
848 . 1 1 109 109 SER N N 15 112.982 0.013 . 1 . . . . A 109 SER N . 36026 1
849 . 1 1 110 110 GLY H H 1 7.591 0.002 . 1 . . . . A 110 GLY H . 36026 1
850 . 1 1 110 110 GLY HA2 H 1 3.724 0.001 . 2 . . . . A 110 GLY HA2 . 36026 1
851 . 1 1 110 110 GLY HA3 H 1 4.074 0.005 . 2 . . . . A 110 GLY HA3 . 36026 1
852 . 1 1 110 110 GLY N N 15 108.742 0.020 . 1 . . . . A 110 GLY N . 36026 1
853 . 1 1 111 111 LEU H H 1 8.097 0.005 . 1 . . . . A 111 LEU H . 36026 1
854 . 1 1 111 111 LEU HA H 1 4.283 0.001 . 1 . . . . A 111 LEU HA . 36026 1
855 . 1 1 111 111 LEU HB2 H 1 0.812 0.009 . 2 . . . . A 111 LEU HB2 . 36026 1
856 . 1 1 111 111 LEU HB3 H 1 1.131 0.016 . 2 . . . . A 111 LEU HB3 . 36026 1
857 . 1 1 111 111 LEU HD11 H 1 0.132 0.005 . 2 . . . . A 111 LEU HD11 . 36026 1
858 . 1 1 111 111 LEU HD12 H 1 0.132 0.005 . 2 . . . . A 111 LEU HD12 . 36026 1
859 . 1 1 111 111 LEU HD13 H 1 0.132 0.005 . 2 . . . . A 111 LEU HD13 . 36026 1
860 . 1 1 111 111 LEU HD21 H 1 0.489 0.007 . 2 . . . . A 111 LEU HD21 . 36026 1
861 . 1 1 111 111 LEU HD22 H 1 0.489 0.007 . 2 . . . . A 111 LEU HD22 . 36026 1
862 . 1 1 111 111 LEU HD23 H 1 0.489 0.007 . 2 . . . . A 111 LEU HD23 . 36026 1
863 . 1 1 111 111 LEU CD1 C 13 24.644 0.008 . 2 . . . . A 111 LEU CD1 . 36026 1
864 . 1 1 111 111 LEU CD2 C 13 25.794 0.006 . 2 . . . . A 111 LEU CD2 . 36026 1
865 . 1 1 111 111 LEU N N 15 120.361 0.009 . 1 . . . . A 111 LEU N . 36026 1
866 . 1 1 112 112 LYS H H 1 8.394 0.005 . 1 . . . . A 112 LYS H . 36026 1
867 . 1 1 112 112 LYS HA H 1 4.139 0.005 . 1 . . . . A 112 LYS HA . 36026 1
868 . 1 1 112 112 LYS HB2 H 1 1.610 0.007 . 2 . . . . A 112 LYS HB2 . 36026 1
869 . 1 1 112 112 LYS HB3 H 1 1.421 0.000 . 2 . . . . A 112 LYS HB3 . 36026 1
870 . 1 1 112 112 LYS HG2 H 1 1.104 0.000 . 2 . . . . A 112 LYS HG2 . 36026 1
871 . 1 1 112 112 LYS N N 15 123.407 0.009 . 1 . . . . A 112 LYS N . 36026 1
872 . 1 1 113 113 TYR H H 1 8.132 0.009 . 1 . . . . A 113 TYR H . 36026 1
873 . 1 1 113 113 TYR HA H 1 5.508 0.000 . 1 . . . . A 113 TYR HA . 36026 1
874 . 1 1 113 113 TYR HB2 H 1 2.940 0.006 . 2 . . . . A 113 TYR HB2 . 36026 1
875 . 1 1 113 113 TYR HB3 H 1 2.836 0.005 . 2 . . . . A 113 TYR HB3 . 36026 1
876 . 1 1 113 113 TYR HD1 H 1 7.075 0.008 . 3 . . . . A 113 TYR HD1 . 36026 1
877 . 1 1 113 113 TYR HE1 H 1 6.876 0.000 . 3 . . . . A 113 TYR HE1 . 36026 1
878 . 1 1 113 113 TYR CD1 C 13 132.367 0.000 . 3 . . . . A 113 TYR CD1 . 36026 1
879 . 1 1 113 113 TYR CE1 C 13 119.097 0.001 . 3 . . . . A 113 TYR CE1 . 36026 1
880 . 1 1 113 113 TYR N N 15 122.661 0.015 . 1 . . . . A 113 TYR N . 36026 1
881 . 1 1 114 114 LYS H H 1 8.888 0.011 . 1 . . . . A 114 LYS H . 36026 1
882 . 1 1 114 114 LYS HA H 1 4.549 0.000 . 1 . . . . A 114 LYS HA . 36026 1
883 . 1 1 114 114 LYS HB2 H 1 0.887 0.012 . 2 . . . . A 114 LYS HB2 . 36026 1
884 . 1 1 114 114 LYS HG3 H 1 1.038 0.010 . 2 . . . . A 114 LYS HG3 . 36026 1
885 . 1 1 114 114 LYS N N 15 125.599 0.015 . 1 . . . . A 114 LYS N . 36026 1
886 . 1 1 115 115 LYS H H 1 8.520 0.006 . 1 . . . . A 115 LYS H . 36026 1
887 . 1 1 115 115 LYS HA H 1 4.552 0.000 . 1 . . . . A 115 LYS HA . 36026 1
888 . 1 1 115 115 LYS HB3 H 1 1.814 0.005 . 2 . . . . A 115 LYS HB3 . 36026 1
889 . 1 1 115 115 LYS HG2 H 1 1.468 0.002 . 2 . . . . A 115 LYS HG2 . 36026 1
890 . 1 1 115 115 LYS N N 15 123.732 0.012 . 1 . . . . A 115 LYS N . 36026 1
891 . 1 1 116 116 GLY H H 1 8.415 0.009 . 1 . . . . A 116 GLY H . 36026 1
892 . 1 1 116 116 GLY HA2 H 1 4.253 0.000 . 2 . . . . A 116 GLY HA2 . 36026 1
893 . 1 1 116 116 GLY HA3 H 1 3.771 0.002 . 2 . . . . A 116 GLY HA3 . 36026 1
894 . 1 1 116 116 GLY N N 15 112.354 0.016 . 1 . . . . A 116 GLY N . 36026 1
895 . 1 1 117 117 GLY H H 1 7.809 0.004 . 1 . . . . A 117 GLY H . 36026 1
896 . 1 1 117 117 GLY HA3 H 1 4.245 0.000 . 2 . . . . A 117 GLY HA3 . 36026 1
897 . 1 1 117 117 GLY N N 15 106.656 0.024 . 1 . . . . A 117 GLY N . 36026 1
898 . 1 1 118 118 VAL H H 1 9.348 0.006 . 1 . . . . A 118 VAL H . 36026 1
899 . 1 1 118 118 VAL HA H 1 3.781 0.014 . 1 . . . . A 118 VAL HA . 36026 1
900 . 1 1 118 118 VAL HB H 1 1.925 0.003 . 1 . . . . A 118 VAL HB . 36026 1
901 . 1 1 118 118 VAL HG11 H 1 0.776 0.012 . 2 . . . . A 118 VAL HG11 . 36026 1
902 . 1 1 118 118 VAL HG12 H 1 0.776 0.012 . 2 . . . . A 118 VAL HG12 . 36026 1
903 . 1 1 118 118 VAL HG13 H 1 0.776 0.012 . 2 . . . . A 118 VAL HG13 . 36026 1
904 . 1 1 118 118 VAL CG1 C 13 20.864 0.005 . 2 . . . . A 118 VAL CG1 . 36026 1
905 . 1 1 118 118 VAL N N 15 122.178 0.017 . 1 . . . . A 118 VAL N . 36026 1
906 . 1 1 119 119 ALA H H 1 8.842 0.003 . 1 . . . . A 119 ALA H . 36026 1
907 . 1 1 119 119 ALA HA H 1 4.333 0.001 . 1 . . . . A 119 ALA HA . 36026 1
908 . 1 1 119 119 ALA HB1 H 1 1.424 0.000 . 1 . . . . A 119 ALA HB1 . 36026 1
909 . 1 1 119 119 ALA HB2 H 1 1.424 0.000 . 1 . . . . A 119 ALA HB2 . 36026 1
910 . 1 1 119 119 ALA HB3 H 1 1.424 0.000 . 1 . . . . A 119 ALA HB3 . 36026 1
911 . 1 1 119 119 ALA CB C 13 18.951 0.000 . 1 . . . . A 119 ALA CB . 36026 1
912 . 1 1 119 119 ALA N N 15 126.464 0.013 . 1 . . . . A 119 ALA N . 36026 1
913 . 1 1 120 120 SER H H 1 8.286 0.009 . 1 . . . . A 120 SER H . 36026 1
914 . 1 1 120 120 SER HA H 1 4.332 0.011 . 1 . . . . A 120 SER HA . 36026 1
915 . 1 1 120 120 SER HB3 H 1 3.828 0.011 . 2 . . . . A 120 SER HB3 . 36026 1
916 . 1 1 120 120 SER N N 15 115.084 0.011 . 1 . . . . A 120 SER N . 36026 1
917 . 1 1 121 121 GLY H H 1 8.464 0.005 . 1 . . . . A 121 GLY H . 36026 1
918 . 1 1 121 121 GLY HA2 H 1 3.821 0.000 . 2 . . . . A 121 GLY HA2 . 36026 1
919 . 1 1 121 121 GLY N N 15 111.252 0.023 . 1 . . . . A 121 GLY N . 36026 1
920 . 1 1 122 122 PHE H H 1 7.878 0.003 . 1 . . . . A 122 PHE H . 36026 1
921 . 1 1 122 122 PHE HA H 1 4.587 0.007 . 1 . . . . A 122 PHE HA . 36026 1
922 . 1 1 122 122 PHE HB2 H 1 3.153 0.006 . 2 . . . . A 122 PHE HB2 . 36026 1
923 . 1 1 122 122 PHE HB3 H 1 2.806 0.003 . 2 . . . . A 122 PHE HB3 . 36026 1
924 . 1 1 122 122 PHE HD1 H 1 7.125 0.009 . 3 . . . . A 122 PHE HD1 . 36026 1
925 . 1 1 122 122 PHE CD1 C 13 131.904 0.000 . 3 . . . . A 122 PHE CD1 . 36026 1
926 . 1 1 122 122 PHE N N 15 119.057 0.015 . 1 . . . . A 122 PHE N . 36026 1
927 . 1 1 123 123 LYS H H 1 8.308 0.006 . 1 . . . . A 123 LYS H . 36026 1
928 . 1 1 123 123 LYS HA H 1 4.258 0.000 . 1 . . . . A 123 LYS HA . 36026 1
929 . 1 1 123 123 LYS HB3 H 1 1.730 0.000 . 2 . . . . A 123 LYS HB3 . 36026 1
930 . 1 1 123 123 LYS N N 15 122.296 0.023 . 1 . . . . A 123 LYS N . 36026 1
931 . 1 1 124 124 HIS HA H 1 4.714 0.000 . 1 . . . . A 124 HIS HA . 36026 1
932 . 1 1 124 124 HIS HB2 H 1 3.200 0.000 . 2 . . . . A 124 HIS HB2 . 36026 1
933 . 1 1 125 125 VAL H H 1 8.284 0.002 . 1 . . . . A 125 VAL H . 36026 1
934 . 1 1 125 125 VAL HA H 1 4.095 0.008 . 1 . . . . A 125 VAL HA . 36026 1
935 . 1 1 125 125 VAL HB H 1 1.977 0.000 . 1 . . . . A 125 VAL HB . 36026 1
936 . 1 1 125 125 VAL HG11 H 1 0.877 0.000 . 2 . . . . A 125 VAL HG11 . 36026 1
937 . 1 1 125 125 VAL HG12 H 1 0.877 0.000 . 2 . . . . A 125 VAL HG12 . 36026 1
938 . 1 1 125 125 VAL HG13 H 1 0.877 0.000 . 2 . . . . A 125 VAL HG13 . 36026 1
939 . 1 1 125 125 VAL N N 15 122.973 0.007 . 1 . . . . A 125 VAL N . 36026 1
940 . 1 1 126 126 VAL H H 1 8.311 0.002 . 1 . . . . A 126 VAL H . 36026 1
941 . 1 1 126 126 VAL HA H 1 4.392 0.000 . 1 . . . . A 126 VAL HA . 36026 1
942 . 1 1 126 126 VAL HB H 1 2.033 0.000 . 1 . . . . A 126 VAL HB . 36026 1
943 . 1 1 126 126 VAL HG11 H 1 0.888 0.000 . 2 . . . . A 126 VAL HG11 . 36026 1
944 . 1 1 126 126 VAL HG12 H 1 0.888 0.000 . 2 . . . . A 126 VAL HG12 . 36026 1
945 . 1 1 126 126 VAL HG13 H 1 0.888 0.000 . 2 . . . . A 126 VAL HG13 . 36026 1
946 . 1 1 126 126 VAL N N 15 126.114 0.026 . 1 . . . . A 126 VAL N . 36026 1
947 . 1 1 127 127 PRO HA H 1 4.352 0.000 . 1 . . . . A 127 PRO HA . 36026 1
948 . 1 1 127 127 PRO HB2 H 1 1.895 0.000 . 2 . . . . A 127 PRO HB2 . 36026 1
949 . 1 1 127 127 PRO HB3 H 1 2.263 0.000 . 2 . . . . A 127 PRO HB3 . 36026 1
950 . 1 1 128 128 ASN H H 1 8.461 0.001 . 1 . . . . A 128 ASN H . 36026 1
951 . 1 1 128 128 ASN HA H 1 4.572 0.004 . 1 . . . . A 128 ASN HA . 36026 1
952 . 1 1 128 128 ASN HB2 H 1 2.757 0.004 . 2 . . . . A 128 ASN HB2 . 36026 1
953 . 1 1 128 128 ASN N N 15 118.716 0.011 . 1 . . . . A 128 ASN N . 36026 1
954 . 1 1 129 129 GLU H H 1 8.330 0.001 . 1 . . . . A 129 GLU H . 36026 1
955 . 1 1 129 129 GLU HA H 1 4.239 0.005 . 1 . . . . A 129 GLU HA . 36026 1
956 . 1 1 129 129 GLU HB2 H 1 1.925 0.000 . 2 . . . . A 129 GLU HB2 . 36026 1
957 . 1 1 129 129 GLU HG3 H 1 2.224 0.003 . 2 . . . . A 129 GLU HG3 . 36026 1
958 . 1 1 129 129 GLU N N 15 120.831 0.010 . 1 . . . . A 129 GLU N . 36026 1
959 . 1 1 130 130 VAL H H 1 8.095 0.000 . 1 . . . . A 130 VAL H . 36026 1
960 . 1 1 130 130 VAL HA H 1 4.011 0.000 . 1 . . . . A 130 VAL HA . 36026 1
961 . 1 1 130 130 VAL HB H 1 2.013 0.000 . 1 . . . . A 130 VAL HB . 36026 1
962 . 1 1 130 130 VAL HG11 H 1 0.909 0.000 . 2 . . . . A 130 VAL HG11 . 36026 1
963 . 1 1 130 130 VAL HG12 H 1 0.909 0.000 . 2 . . . . A 130 VAL HG12 . 36026 1
964 . 1 1 130 130 VAL HG13 H 1 0.909 0.000 . 2 . . . . A 130 VAL HG13 . 36026 1
965 . 1 1 130 130 VAL N N 15 121.797 0.013 . 1 . . . . A 130 VAL N . 36026 1
966 . 1 1 131 131 VAL H H 1 8.093 0.001 . 1 . . . . A 131 VAL H . 36026 1
967 . 1 1 131 131 VAL HA H 1 3.987 0.000 . 1 . . . . A 131 VAL HA . 36026 1
968 . 1 1 131 131 VAL HB H 1 2.012 0.000 . 1 . . . . A 131 VAL HB . 36026 1
969 . 1 1 131 131 VAL HG11 H 1 0.889 0.000 . 2 . . . . A 131 VAL HG11 . 36026 1
970 . 1 1 131 131 VAL HG12 H 1 0.889 0.000 . 2 . . . . A 131 VAL HG12 . 36026 1
971 . 1 1 131 131 VAL HG13 H 1 0.889 0.000 . 2 . . . . A 131 VAL HG13 . 36026 1
972 . 1 1 131 131 VAL N N 15 124.617 0.006 . 1 . . . . A 131 VAL N . 36026 1
973 . 1 1 132 132 VAL H H 1 8.168 0.000 . 1 . . . . A 132 VAL H . 36026 1
974 . 1 1 132 132 VAL HA H 1 3.977 0.005 . 1 . . . . A 132 VAL HA . 36026 1
975 . 1 1 132 132 VAL HB H 1 1.989 0.011 . 1 . . . . A 132 VAL HB . 36026 1
976 . 1 1 132 132 VAL HG11 H 1 0.881 0.007 . 2 . . . . A 132 VAL HG11 . 36026 1
977 . 1 1 132 132 VAL HG12 H 1 0.881 0.007 . 2 . . . . A 132 VAL HG12 . 36026 1
978 . 1 1 132 132 VAL HG13 H 1 0.881 0.007 . 2 . . . . A 132 VAL HG13 . 36026 1
979 . 1 1 132 132 VAL N N 15 124.161 0.006 . 1 . . . . A 132 VAL N . 36026 1
980 . 1 1 133 133 GLN H H 1 8.344 0.000 . 1 . . . . A 133 GLN H . 36026 1
981 . 1 1 133 133 GLN HA H 1 4.227 0.000 . 1 . . . . A 133 GLN HA . 36026 1
982 . 1 1 133 133 GLN HG2 H 1 2.329 0.000 . 2 . . . . A 133 GLN HG2 . 36026 1
983 . 1 1 133 133 GLN N N 15 123.772 0.012 . 1 . . . . A 133 GLN N . 36026 1
stop_
save_