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 17017
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 17017 1
2 '2D 1H-13C HSQC' . . . 17017 1
3 '3D HNCO' . . . 17017 1
5 '3D 1H-13C arom NOESY' . . . 17017 1
6 '3D HBHA(CO)NH' . . . 17017 1
7 '3D HNCA' . . . 17017 1
8 '3D 1H-15N NOESY' . . . 17017 1
9 '3D 1H-13C NOESY' . . . 17017 1
10 '3D H(C)CH-TOCSY' . . . 17017 1
11 '3D (H)CCH-TOCSY' . . . 17017 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 $CNS . . 17017 1
2 $CYANA . . 17017 1
3 $AutoStructure . . 17017 1
4 $NMRPipe . . 17017 1
5 $TOPSPIN . . 17017 1
6 $SPARKY . . 17017 1
7 $TALOS+ . . 17017 1
8 $NMRDraw . . 17017 1
9 $Molmol . . 17017 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 1 1 TRP H H 1 8.920 0.05 . 1 . . . . . 1 TRP H . 17017 1
2 . 1 1 1 1 TRP HA H 1 4.816 0.05 . 1 . . . . . 1 TRP HA . 17017 1
3 . 1 1 1 1 TRP HB2 H 1 2.862 0.05 . 2 . . . . . 1 TRP QB . 17017 1
4 . 1 1 1 1 TRP HB3 H 1 2.862 0.05 . 2 . . . . . 1 TRP QB . 17017 1
5 . 1 1 1 1 TRP HD1 H 1 7.147 0.05 . 1 . . . . . 1 TRP HD1 . 17017 1
6 . 1 1 1 1 TRP HE1 H 1 9.981 0.05 . 1 . . . . . 1 TRP HE1 . 17017 1
7 . 1 1 1 1 TRP HE3 H 1 6.900 0.05 . 1 . . . . . 1 TRP HE3 . 17017 1
8 . 1 1 1 1 TRP HH2 H 1 7.040 0.05 . 1 . . . . . 1 TRP HH2 . 17017 1
9 . 1 1 1 1 TRP HZ2 H 1 7.386 0.05 . 1 . . . . . 1 TRP HZ2 . 17017 1
10 . 1 1 1 1 TRP HZ3 H 1 6.560 0.05 . 1 . . . . . 1 TRP HZ3 . 17017 1
11 . 1 1 1 1 TRP C C 13 177.490 0.4 . 1 . . . . . 1 TRP C . 17017 1
12 . 1 1 1 1 TRP CA C 13 56.082 0.4 . 1 . . . . . 1 TRP CA . 17017 1
13 . 1 1 1 1 TRP CB C 13 31.248 0.4 . 1 . . . . . 1 TRP CB . 17017 1
14 . 1 1 1 1 TRP CD1 C 13 124.378 0.4 . 1 . . . . . 1 TRP CD1 . 17017 1
15 . 1 1 1 1 TRP CE3 C 13 118.803 0.4 . 1 . . . . . 1 TRP CE3 . 17017 1
16 . 1 1 1 1 TRP CH2 C 13 125.048 0.4 . 1 . . . . . 1 TRP CH2 . 17017 1
17 . 1 1 1 1 TRP CZ2 C 13 113.818 0.4 . 1 . . . . . 1 TRP CZ2 . 17017 1
18 . 1 1 1 1 TRP CZ3 C 13 122.101 0.4 . 1 . . . . . 1 TRP CZ3 . 17017 1
19 . 1 1 1 1 TRP N N 15 123.388 0.4 . 1 . . . . . 1 TRP N . 17017 1
20 . 1 1 1 1 TRP NE1 N 15 128.440 0.4 . 1 . . . . . 1 TRP NE1 . 17017 1
21 . 1 1 2 2 ARG H H 1 8.406 0.05 . 1 . . . . . 2 ARG H . 17017 1
22 . 1 1 2 2 ARG HA H 1 4.894 0.05 . 1 . . . . . 2 ARG HA . 17017 1
23 . 1 1 2 2 ARG HB2 H 1 1.736 0.05 . 2 . . . . . 2 ARG HB2 . 17017 1
24 . 1 1 2 2 ARG HB3 H 1 1.644 0.05 . 2 . . . . . 2 ARG HB3 . 17017 1
25 . 1 1 2 2 ARG HD2 H 1 3.134 0.05 . 2 . . . . . 2 ARG QD . 17017 1
26 . 1 1 2 2 ARG HD3 H 1 3.134 0.05 . 2 . . . . . 2 ARG QD . 17017 1
27 . 1 1 2 2 ARG HG2 H 1 1.543 0.05 . 2 . . . . . 2 ARG HG2 . 17017 1
28 . 1 1 2 2 ARG HG3 H 1 1.498 0.05 . 2 . . . . . 2 ARG HG3 . 17017 1
29 . 1 1 2 2 ARG C C 13 177.094 0.4 . 1 . . . . . 2 ARG C . 17017 1
30 . 1 1 2 2 ARG CA C 13 55.179 0.4 . 1 . . . . . 2 ARG CA . 17017 1
31 . 1 1 2 2 ARG CB C 13 31.607 0.4 . 1 . . . . . 2 ARG CB . 17017 1
32 . 1 1 2 2 ARG CD C 13 43.399 0.4 . 1 . . . . . 2 ARG CD . 17017 1
33 . 1 1 2 2 ARG CG C 13 27.194 0.4 . 1 . . . . . 2 ARG CG . 17017 1
34 . 1 1 2 2 ARG N N 15 121.684 0.4 . 1 . . . . . 2 ARG N . 17017 1
35 . 1 1 3 3 VAL H H 1 8.698 0.05 . 1 . . . . . 3 VAL H . 17017 1
36 . 1 1 3 3 VAL HA H 1 4.579 0.05 . 1 . . . . . 3 VAL HA . 17017 1
37 . 1 1 3 3 VAL HB H 1 1.923 0.05 . 1 . . . . . 3 VAL HB . 17017 1
38 . 1 1 3 3 VAL HG11 H 1 0.846 0.05 . . . . . . . 3 VAL QG1 . 17017 1
39 . 1 1 3 3 VAL HG12 H 1 0.846 0.05 . . . . . . . 3 VAL QG1 . 17017 1
40 . 1 1 3 3 VAL HG13 H 1 0.846 0.05 . . . . . . . 3 VAL QG1 . 17017 1
41 . 1 1 3 3 VAL C C 13 179.316 0.4 . 1 . . . . . 3 VAL C . 17017 1
42 . 1 1 3 3 VAL CA C 13 61.063 0.4 . 1 . . . . . 3 VAL CA . 17017 1
43 . 1 1 3 3 VAL CB C 13 35.487 0.4 . 1 . . . . . 3 VAL CB . 17017 1
44 . 1 1 3 3 VAL CG1 C 13 22.050 0.4 . 2 . . . . . 3 VAL CG1 . 17017 1
45 . 1 1 3 3 VAL N N 15 123.428 0.4 . 1 . . . . . 3 VAL N . 17017 1
46 . 1 1 4 4 ARG H H 1 8.234 0.05 . 1 . . . . . 4 ARG H . 17017 1
47 . 1 1 4 4 ARG HA H 1 5.210 0.05 . 1 . . . . . 4 ARG HA . 17017 1
48 . 1 1 4 4 ARG HB2 H 1 1.666 0.05 . 2 . . . . . 4 ARG HB2 . 17017 1
49 . 1 1 4 4 ARG HB3 H 1 1.549 0.05 . 2 . . . . . 4 ARG HB3 . 17017 1
50 . 1 1 4 4 ARG HD2 H 1 3.093 0.05 . 2 . . . . . 4 ARG HD2 . 17017 1
51 . 1 1 4 4 ARG HD3 H 1 3.004 0.05 . 2 . . . . . 4 ARG HD3 . 17017 1
52 . 1 1 4 4 ARG HG2 H 1 1.543 0.05 . 2 . . . . . 4 ARG QG . 17017 1
53 . 1 1 4 4 ARG HG3 H 1 1.543 0.05 . 2 . . . . . 4 ARG QG . 17017 1
54 . 1 1 4 4 ARG C C 13 178.118 0.4 . 1 . . . . . 4 ARG C . 17017 1
55 . 1 1 4 4 ARG CA C 13 54.171 0.4 . 1 . . . . . 4 ARG CA . 17017 1
56 . 1 1 4 4 ARG CB C 13 33.831 0.4 . 1 . . . . . 4 ARG CB . 17017 1
57 . 1 1 4 4 ARG CD C 13 43.653 0.4 . 1 . . . . . 4 ARG CD . 17017 1
58 . 1 1 4 4 ARG CG C 13 28.201 0.4 . 1 . . . . . 4 ARG CG . 17017 1
59 . 1 1 4 4 ARG N N 15 123.910 0.4 . 1 . . . . . 4 ARG N . 17017 1
60 . 1 1 5 5 CYS H H 1 9.284 0.05 . 1 . . . . . 5 CYS H . 17017 1
61 . 1 1 5 5 CYS HA H 1 5.581 0.05 . 1 . . . . . 5 CYS HA . 17017 1
62 . 1 1 5 5 CYS HB2 H 1 2.610 0.05 . 2 . . . . . 5 CYS HB2 . 17017 1
63 . 1 1 5 5 CYS HB3 H 1 2.584 0.05 . 2 . . . . . 5 CYS HB3 . 17017 1
64 . 1 1 5 5 CYS C C 13 181.066 0.4 . 1 . . . . . 5 CYS C . 17017 1
65 . 1 1 5 5 CYS CA C 13 56.103 0.4 . 1 . . . . . 5 CYS CA . 17017 1
66 . 1 1 5 5 CYS CB C 13 30.200 0.4 . 1 . . . . . 5 CYS CB . 17017 1
67 . 1 1 5 5 CYS N N 15 118.682 0.4 . 1 . . . . . 5 CYS N . 17017 1
68 . 1 1 6 6 LYS H H 1 9.193 0.05 . 1 . . . . . 6 LYS H . 17017 1
69 . 1 1 6 6 LYS HA H 1 5.211 0.05 . 1 . . . . . 6 LYS HA . 17017 1
70 . 1 1 6 6 LYS HB2 H 1 1.849 0.05 . 2 . . . . . 6 LYS HB2 . 17017 1
71 . 1 1 6 6 LYS HB3 H 1 1.780 0.05 . 2 . . . . . 6 LYS HB3 . 17017 1
72 . 1 1 6 6 LYS HD2 H 1 1.564 0.05 . 2 . . . . . 6 LYS QD . 17017 1
73 . 1 1 6 6 LYS HD3 H 1 1.564 0.05 . 2 . . . . . 6 LYS QD . 17017 1
74 . 1 1 6 6 LYS HE2 H 1 2.845 0.05 . 2 . . . . . 6 LYS QE . 17017 1
75 . 1 1 6 6 LYS HE3 H 1 2.845 0.05 . 2 . . . . . 6 LYS QE . 17017 1
76 . 1 1 6 6 LYS HG2 H 1 1.357 0.05 . 2 . . . . . 6 LYS QG . 17017 1
77 . 1 1 6 6 LYS HG3 H 1 1.357 0.05 . 2 . . . . . 6 LYS QG . 17017 1
78 . 1 1 6 6 LYS C C 13 178.767 0.4 . 1 . . . . . 6 LYS C . 17017 1
79 . 1 1 6 6 LYS CA C 13 54.703 0.4 . 1 . . . . . 6 LYS CA . 17017 1
80 . 1 1 6 6 LYS CB C 13 34.631 0.4 . 1 . . . . . 6 LYS CB . 17017 1
81 . 1 1 6 6 LYS CD C 13 29.527 0.4 . 1 . . . . . 6 LYS CD . 17017 1
82 . 1 1 6 6 LYS CE C 13 42.142 0.4 . 1 . . . . . 6 LYS CE . 17017 1
83 . 1 1 6 6 LYS CG C 13 24.809 0.4 . 1 . . . . . 6 LYS CG . 17017 1
84 . 1 1 6 6 LYS N N 15 129.124 0.4 . 1 . . . . . 6 LYS N . 17017 1
85 . 1 1 7 7 ALA H H 1 8.713 0.05 . 1 . . . . . 7 ALA H . 17017 1
86 . 1 1 7 7 ALA HA H 1 4.874 0.05 . 1 . . . . . 7 ALA HA . 17017 1
87 . 1 1 7 7 ALA HB1 H 1 1.345 0.05 . . . . . . . 7 ALA QB . 17017 1
88 . 1 1 7 7 ALA HB2 H 1 1.345 0.05 . . . . . . . 7 ALA QB . 17017 1
89 . 1 1 7 7 ALA HB3 H 1 1.345 0.05 . . . . . . . 7 ALA QB . 17017 1
90 . 1 1 7 7 ALA C C 13 176.291 0.4 . 1 . . . . . 7 ALA C . 17017 1
91 . 1 1 7 7 ALA CA C 13 51.519 0.4 . 1 . . . . . 7 ALA CA . 17017 1
92 . 1 1 7 7 ALA CB C 13 23.058 0.4 . 1 . . . . . 7 ALA CB . 17017 1
93 . 1 1 7 7 ALA N N 15 126.435 0.4 . 1 . . . . . 7 ALA N . 17017 1
94 . 1 1 8 8 LYS H H 1 9.585 0.05 . 1 . . . . . 8 LYS H . 17017 1
95 . 1 1 8 8 LYS HA H 1 4.021 0.05 . 1 . . . . . 8 LYS HA . 17017 1
96 . 1 1 8 8 LYS HD2 H 1 1.718 0.05 . 2 . . . . . 8 LYS QD . 17017 1
97 . 1 1 8 8 LYS HD3 H 1 1.718 0.05 . 2 . . . . . 8 LYS QD . 17017 1
98 . 1 1 8 8 LYS HE2 H 1 2.963 0.05 . 2 . . . . . 8 LYS HE2 . 17017 1
99 . 1 1 8 8 LYS HE3 H 1 2.928 0.05 . 2 . . . . . 8 LYS HE3 . 17017 1
100 . 1 1 8 8 LYS HG2 H 1 1.447 0.05 . 2 . . . . . 8 LYS HG2 . 17017 1
101 . 1 1 8 8 LYS HG3 H 1 1.416 0.05 . 2 . . . . . 8 LYS HG3 . 17017 1
102 . 1 1 8 8 LYS C C 13 176.468 0.4 . 1 . . . . . 8 LYS C . 17017 1
103 . 1 1 8 8 LYS CA C 13 57.397 0.4 . 1 . . . . . 8 LYS CA . 17017 1
104 . 1 1 8 8 LYS CD C 13 29.052 0.4 . 1 . . . . . 8 LYS CD . 17017 1
105 . 1 1 8 8 LYS CE C 13 42.188 0.4 . 1 . . . . . 8 LYS CE . 17017 1
106 . 1 1 8 8 LYS CG C 13 25.224 0.4 . 1 . . . . . 8 LYS CG . 17017 1
107 . 1 1 8 8 LYS N N 15 122.280 0.4 . 1 . . . . . 8 LYS N . 17017 1
108 . 1 1 9 9 GLY H H 1 8.776 0.05 . 1 . . . . . 9 GLY H . 17017 1
109 . 1 1 9 9 GLY HA2 H 1 4.099 0.05 . 2 . . . . . 9 GLY HA2 . 17017 1
110 . 1 1 9 9 GLY HA3 H 1 3.752 0.05 . 2 . . . . . 9 GLY HA3 . 17017 1
111 . 1 1 9 9 GLY C C 13 179.062 0.4 . 1 . . . . . 9 GLY C . 17017 1
112 . 1 1 9 9 GLY CA C 13 45.692 0.4 . 1 . . . . . 9 GLY CA . 17017 1
113 . 1 1 9 9 GLY N N 15 106.476 0.4 . 1 . . . . . 9 GLY N . 17017 1
114 . 1 1 10 10 GLY H H 1 8.013 0.05 . 1 . . . . . 10 GLY H . 17017 1
115 . 1 1 10 10 GLY HA2 H 1 4.352 0.05 . 2 . . . . . 10 GLY HA2 . 17017 1
116 . 1 1 10 10 GLY HA3 H 1 3.736 0.05 . 2 . . . . . 10 GLY HA3 . 17017 1
117 . 1 1 10 10 GLY C C 13 176.801 0.4 . 1 . . . . . 10 GLY C . 17017 1
118 . 1 1 10 10 GLY CA C 13 44.198 0.4 . 1 . . . . . 10 GLY CA . 17017 1
119 . 1 1 10 10 GLY N N 15 109.310 0.4 . 1 . . . . . 10 GLY N . 17017 1
120 . 1 1 11 11 THR H H 1 7.987 0.05 . 1 . . . . . 11 THR H . 17017 1
121 . 1 1 11 11 THR HA H 1 5.045 0.05 . 1 . . . . . 11 THR HA . 17017 1
122 . 1 1 11 11 THR HB H 1 3.786 0.05 . 1 . . . . . 11 THR HB . 17017 1
123 . 1 1 11 11 THR HG21 H 1 1.014 0.05 . . . . . . . 11 THR QG2 . 17017 1
124 . 1 1 11 11 THR HG22 H 1 1.014 0.05 . . . . . . . 11 THR QG2 . 17017 1
125 . 1 1 11 11 THR HG23 H 1 1.014 0.05 . . . . . . . 11 THR QG2 . 17017 1
126 . 1 1 11 11 THR C C 13 179.819 0.4 . 1 . . . . . 11 THR C . 17017 1
127 . 1 1 11 11 THR CA C 13 61.521 0.4 . 1 . . . . . 11 THR CA . 17017 1
128 . 1 1 11 11 THR CB C 13 70.033 0.4 . 1 . . . . . 11 THR CB . 17017 1
129 . 1 1 11 11 THR CG2 C 13 22.039 0.4 . 1 . . . . . 11 THR CG2 . 17017 1
130 . 1 1 11 11 THR N N 15 115.113 0.4 . 1 . . . . . 11 THR N . 17017 1
131 . 1 1 12 12 HIS H H 1 9.031 0.05 . 1 . . . . . 12 HIS H . 17017 1
132 . 1 1 12 12 HIS HA H 1 4.749 0.05 . 1 . . . . . 12 HIS HA . 17017 1
133 . 1 1 12 12 HIS HB2 H 1 2.971 0.05 . 2 . . . . . 12 HIS HB2 . 17017 1
134 . 1 1 12 12 HIS HB3 H 1 2.644 0.05 . 2 . . . . . 12 HIS HB3 . 17017 1
135 . 1 1 12 12 HIS C C 13 179.025 0.4 . 1 . . . . . 12 HIS C . 17017 1
136 . 1 1 12 12 HIS CA C 13 54.780 0.4 . 1 . . . . . 12 HIS CA . 17017 1
137 . 1 1 12 12 HIS CB C 13 34.635 0.4 . 1 . . . . . 12 HIS CB . 17017 1
138 . 1 1 12 12 HIS N N 15 124.916 0.4 . 1 . . . . . 12 HIS N . 17017 1
139 . 1 1 13 13 LEU H H 1 8.933 0.05 . 1 . . . . . 13 LEU H . 17017 1
140 . 1 1 13 13 LEU HA H 1 4.626 0.05 . 1 . . . . . 13 LEU HA . 17017 1
141 . 1 1 13 13 LEU HB2 H 1 1.695 0.05 . 2 . . . . . 13 LEU HB2 . 17017 1
142 . 1 1 13 13 LEU HB3 H 1 1.473 0.05 . 2 . . . . . 13 LEU HB3 . 17017 1
143 . 1 1 13 13 LEU HD11 H 1 0.817 0.05 . . . . . . . 13 LEU QD1 . 17017 1
144 . 1 1 13 13 LEU HD12 H 1 0.817 0.05 . . . . . . . 13 LEU QD1 . 17017 1
145 . 1 1 13 13 LEU HD13 H 1 0.817 0.05 . . . . . . . 13 LEU QD1 . 17017 1
146 . 1 1 13 13 LEU HD21 H 1 0.818 0.05 . . . . . . . 13 LEU QD2 . 17017 1
147 . 1 1 13 13 LEU HD22 H 1 0.818 0.05 . . . . . . . 13 LEU QD2 . 17017 1
148 . 1 1 13 13 LEU HD23 H 1 0.818 0.05 . . . . . . . 13 LEU QD2 . 17017 1
149 . 1 1 13 13 LEU HG H 1 1.473 0.05 . 1 . . . . . 13 LEU HG . 17017 1
150 . 1 1 13 13 LEU C C 13 177.411 0.4 . 1 . . . . . 13 LEU C . 17017 1
151 . 1 1 13 13 LEU CA C 13 54.304 0.4 . 1 . . . . . 13 LEU CA . 17017 1
152 . 1 1 13 13 LEU CB C 13 42.787 0.4 . 1 . . . . . 13 LEU CB . 17017 1
153 . 1 1 13 13 LEU CD1 C 13 25.107 0.4 . 2 . . . . . 13 LEU CD1 . 17017 1
154 . 1 1 13 13 LEU CD2 C 13 23.874 0.4 . 2 . . . . . 13 LEU CD2 . 17017 1
155 . 1 1 13 13 LEU CG C 13 27.033 0.4 . 1 . . . . . 13 LEU CG . 17017 1
156 . 1 1 13 13 LEU N N 15 125.059 0.4 . 1 . . . . . 13 LEU N . 17017 1
157 . 1 1 14 14 LEU H H 1 8.596 0.05 . 1 . . . . . 14 LEU H . 17017 1
158 . 1 1 14 14 LEU HA H 1 4.506 0.05 . 1 . . . . . 14 LEU HA . 17017 1
159 . 1 1 14 14 LEU HB2 H 1 1.789 0.05 . 2 . . . . . 14 LEU HB2 . 17017 1
160 . 1 1 14 14 LEU HB3 H 1 1.194 0.05 . 2 . . . . . 14 LEU HB3 . 17017 1
161 . 1 1 14 14 LEU HD11 H 1 0.651 0.05 . . . . . . . 14 LEU QD1 . 17017 1
162 . 1 1 14 14 LEU HD12 H 1 0.651 0.05 . . . . . . . 14 LEU QD1 . 17017 1
163 . 1 1 14 14 LEU HD13 H 1 0.651 0.05 . . . . . . . 14 LEU QD1 . 17017 1
164 . 1 1 14 14 LEU HD21 H 1 0.676 0.05 . . . . . . . 14 LEU QD2 . 17017 1
165 . 1 1 14 14 LEU HD22 H 1 0.676 0.05 . . . . . . . 14 LEU QD2 . 17017 1
166 . 1 1 14 14 LEU HD23 H 1 0.676 0.05 . . . . . . . 14 LEU QD2 . 17017 1
167 . 1 1 14 14 LEU HG H 1 1.529 0.05 . 1 . . . . . 14 LEU HG . 17017 1
168 . 1 1 14 14 LEU C C 13 177.094 0.4 . 1 . . . . . 14 LEU C . 17017 1
169 . 1 1 14 14 LEU CA C 13 54.438 0.4 . 1 . . . . . 14 LEU CA . 17017 1
170 . 1 1 14 14 LEU CB C 13 42.229 0.4 . 1 . . . . . 14 LEU CB . 17017 1
171 . 1 1 14 14 LEU CD1 C 13 26.128 0.4 . 2 . . . . . 14 LEU CD1 . 17017 1
172 . 1 1 14 14 LEU CD2 C 13 23.579 0.4 . 2 . . . . . 14 LEU CD2 . 17017 1
173 . 1 1 14 14 LEU CG C 13 27.552 0.4 . 1 . . . . . 14 LEU CG . 17017 1
174 . 1 1 14 14 LEU N N 15 126.308 0.4 . 1 . . . . . 14 LEU N . 17017 1
175 . 1 1 15 15 GLN H H 1 9.086 0.05 . 1 . . . . . 15 GLN H . 17017 1
176 . 1 1 15 15 GLN HA H 1 4.83 0.05 . 1 . . . . . 15 GLN HA . 17017 1
177 . 1 1 15 15 GLN HB2 H 1 2.097 0.05 . 2 . . . . . 15 GLN HB2 . 17017 1
178 . 1 1 15 15 GLN HB3 H 1 1.893 0.05 . 2 . . . . . 15 GLN HB3 . 17017 1
179 . 1 1 15 15 GLN HE21 H 1 6.792 0.05 . 2 . . . . . 15 GLN HE21 . 17017 1
180 . 1 1 15 15 GLN HE22 H 1 7.480 0.05 . 2 . . . . . 15 GLN HE22 . 17017 1
181 . 1 1 15 15 GLN HG2 H 1 2.301 0.05 . 2 . . . . . 15 GLN HG2 . 17017 1
182 . 1 1 15 15 GLN HG3 H 1 2.203 0.05 . 2 . . . . . 15 GLN HG3 . 17017 1
183 . 1 1 15 15 GLN C C 13 176.527 0.4 . 1 . . . . . 15 GLN C . 17017 1
184 . 1 1 15 15 GLN CA C 13 54.611 0.4 . 1 . . . . . 15 GLN CA . 17017 1
185 . 1 1 15 15 GLN CB C 13 32.290 0.4 . 1 . . . . . 15 GLN CB . 17017 1
186 . 1 1 15 15 GLN CG C 13 34.207 0.4 . 1 . . . . . 15 GLN CG . 17017 1
187 . 1 1 15 15 GLN N N 15 120.746 0.4 . 1 . . . . . 15 GLN N . 17017 1
188 . 1 1 15 15 GLN NE2 N 15 112.345 0.4 . 1 . . . . . 15 GLN NE2 . 17017 1
189 . 1 1 16 16 GLY H H 1 8.788 0.05 . 1 . . . . . 16 GLY H . 17017 1
190 . 1 1 16 16 GLY HA2 H 1 3.844 0.05 . 2 . . . . . 16 GLY QA . 17017 1
191 . 1 1 16 16 GLY HA3 H 1 3.844 0.05 . 2 . . . . . 16 GLY QA . 17017 1
192 . 1 1 16 16 GLY C C 13 178.655 0.4 . 1 . . . . . 16 GLY C . 17017 1
193 . 1 1 16 16 GLY CA C 13 46.735 0.4 . 1 . . . . . 16 GLY CA . 17017 1
194 . 1 1 16 16 GLY N N 15 109.082 0.4 . 1 . . . . . 16 GLY N . 17017 1
195 . 1 1 17 17 LEU H H 1 8.122 0.05 . 1 . . . . . 17 LEU H . 17017 1
196 . 1 1 17 17 LEU HA H 1 4.390 0.05 . 1 . . . . . 17 LEU HA . 17017 1
197 . 1 1 17 17 LEU HB2 H 1 1.648 0.05 . 2 . . . . . 17 LEU HB2 . 17017 1
198 . 1 1 17 17 LEU HB3 H 1 1.029 0.05 . 2 . . . . . 17 LEU HB3 . 17017 1
199 . 1 1 17 17 LEU HD11 H 1 0.696 0.05 . . . . . . . 17 LEU QD1 . 17017 1
200 . 1 1 17 17 LEU HD12 H 1 0.696 0.05 . . . . . . . 17 LEU QD1 . 17017 1
201 . 1 1 17 17 LEU HD13 H 1 0.696 0.05 . . . . . . . 17 LEU QD1 . 17017 1
202 . 1 1 17 17 LEU HD21 H 1 0.731 0.05 . . . . . . . 17 LEU QD2 . 17017 1
203 . 1 1 17 17 LEU HD22 H 1 0.731 0.05 . . . . . . . 17 LEU QD2 . 17017 1
204 . 1 1 17 17 LEU HD23 H 1 0.731 0.05 . . . . . . . 17 LEU QD2 . 17017 1
205 . 1 1 17 17 LEU HG H 1 1.413 0.05 . 1 . . . . . 17 LEU HG . 17017 1
206 . 1 1 17 17 LEU C C 13 178.284 0.4 . 1 . . . . . 17 LEU C . 17017 1
207 . 1 1 17 17 LEU CA C 13 53.638 0.4 . 1 . . . . . 17 LEU CA . 17017 1
208 . 1 1 17 17 LEU CB C 13 43.410 0.4 . 1 . . . . . 17 LEU CB . 17017 1
209 . 1 1 17 17 LEU CD1 C 13 26.278 0.4 . 2 . . . . . 17 LEU CD1 . 17017 1
210 . 1 1 17 17 LEU CD2 C 13 23.382 0.4 . 2 . . . . . 17 LEU CD2 . 17017 1
211 . 1 1 17 17 LEU CG C 13 27.228 0.4 . 1 . . . . . 17 LEU CG . 17017 1
212 . 1 1 17 17 LEU N N 15 119.667 0.4 . 1 . . . . . 17 LEU N . 17017 1
213 . 1 1 18 18 SER H H 1 8.506 0.05 . 1 . . . . . 18 SER H . 17017 1
214 . 1 1 18 18 SER HA H 1 3.663 0.05 . 1 . . . . . 18 SER HA . 17017 1
215 . 1 1 18 18 SER HB2 H 1 3.927 0.05 . 2 . . . . . 18 SER HB2 . 17017 1
216 . 1 1 18 18 SER HB3 H 1 3.661 0.05 . 2 . . . . . 18 SER HB3 . 17017 1
217 . 1 1 18 18 SER C C 13 179.946 0.4 . 1 . . . . . 18 SER C . 17017 1
218 . 1 1 18 18 SER CA C 13 56.790 0.4 . 1 . . . . . 18 SER CA . 17017 1
219 . 1 1 18 18 SER CB C 13 66.676 0.4 . 1 . . . . . 18 SER CB . 17017 1
220 . 1 1 18 18 SER N N 15 115.025 0.4 . 1 . . . . . 18 SER N . 17017 1
221 . 1 1 19 19 SER H H 1 8.105 0.05 . 1 . . . . . 19 SER H . 17017 1
222 . 1 1 19 19 SER HA H 1 3.334 0.05 . 1 . . . . . 19 SER HA . 17017 1
223 . 1 1 19 19 SER HB2 H 1 3.907 0.05 . 2 . . . . . 19 SER HB2 . 17017 1
224 . 1 1 19 19 SER HB3 H 1 3.882 0.05 . 2 . . . . . 19 SER HB3 . 17017 1
225 . 1 1 19 19 SER C C 13 178.734 0.4 . 1 . . . . . 19 SER C . 17017 1
226 . 1 1 19 19 SER CA C 13 60.727 0.4 . 1 . . . . . 19 SER CA . 17017 1
227 . 1 1 19 19 SER CB C 13 62.477 0.4 . 1 . . . . . 19 SER CB . 17017 1
228 . 1 1 19 19 SER N N 15 113.430 0.4 . 1 . . . . . 19 SER N . 17017 1
229 . 1 1 20 20 ARG H H 1 7.438 0.05 . 1 . . . . . 20 ARG H . 17017 1
230 . 1 1 20 20 ARG HA H 1 4.155 0.05 . 1 . . . . . 20 ARG HA . 17017 1
231 . 1 1 20 20 ARG HB2 H 1 1.907 0.05 . 2 . . . . . 20 ARG HB2 . 17017 1
232 . 1 1 20 20 ARG HB3 H 1 1.489 0.05 . 2 . . . . . 20 ARG HB3 . 17017 1
233 . 1 1 20 20 ARG HD2 H 1 3.096 0.05 . 2 . . . . . 20 ARG QD . 17017 1
234 . 1 1 20 20 ARG HD3 H 1 3.096 0.05 . 2 . . . . . 20 ARG QD . 17017 1
235 . 1 1 20 20 ARG HG2 H 1 1.561 0.05 . 2 . . . . . 20 ARG HG2 . 17017 1
236 . 1 1 20 20 ARG HG3 H 1 1.521 0.05 . 2 . . . . . 20 ARG HG3 . 17017 1
237 . 1 1 20 20 ARG C C 13 176.750 0.4 . 1 . . . . . 20 ARG C . 17017 1
238 . 1 1 20 20 ARG CA C 13 55.422 0.4 . 1 . . . . . 20 ARG CA . 17017 1
239 . 1 1 20 20 ARG CB C 13 30.437 0.4 . 1 . . . . . 20 ARG CB . 17017 1
240 . 1 1 20 20 ARG CD C 13 43.167 0.4 . 1 . . . . . 20 ARG CD . 17017 1
241 . 1 1 20 20 ARG CG C 13 27.112 0.4 . 1 . . . . . 20 ARG CG . 17017 1
242 . 1 1 20 20 ARG N N 15 115.986 0.4 . 1 . . . . . 20 ARG N . 17017 1
243 . 1 1 21 21 THR H H 1 7.505 0.05 . 1 . . . . . 21 THR H . 17017 1
244 . 1 1 21 21 THR HA H 1 3.839 0.05 . 1 . . . . . 21 THR HA . 17017 1
245 . 1 1 21 21 THR HB H 1 3.889 0.05 . 1 . . . . . 21 THR HB . 17017 1
246 . 1 1 21 21 THR HG21 H 1 1.302 0.05 . . . . . . . 21 THR QG2 . 17017 1
247 . 1 1 21 21 THR HG22 H 1 1.302 0.05 . . . . . . . 21 THR QG2 . 17017 1
248 . 1 1 21 21 THR HG23 H 1 1.302 0.05 . . . . . . . 21 THR QG2 . 17017 1
249 . 1 1 21 21 THR C C 13 179.592 0.4 . 1 . . . . . 21 THR C . 17017 1
250 . 1 1 21 21 THR CA C 13 64.958 0.4 . 1 . . . . . 21 THR CA . 17017 1
251 . 1 1 21 21 THR CB C 13 69.542 0.4 . 1 . . . . . 21 THR CB . 17017 1
252 . 1 1 21 21 THR CG2 C 13 22.126 0.4 . 1 . . . . . 21 THR CG2 . 17017 1
253 . 1 1 21 21 THR N N 15 120.874 0.4 . 1 . . . . . 21 THR N . 17017 1
254 . 1 1 22 22 ARG H H 1 8.964 0.05 . 1 . . . . . 22 ARG H . 17017 1
255 . 1 1 22 22 ARG HA H 1 4.665 0.05 . 1 . . . . . 22 ARG HA . 17017 1
256 . 1 1 22 22 ARG HB2 H 1 1.938 0.05 . 2 . . . . . 22 ARG HB2 . 17017 1
257 . 1 1 22 22 ARG HB3 H 1 1.730 0.05 . 2 . . . . . 22 ARG HB3 . 17017 1
258 . 1 1 22 22 ARG HD2 H 1 3.235 0.05 . 2 . . . . . 22 ARG HD2 . 17017 1
259 . 1 1 22 22 ARG HD3 H 1 3.153 0.05 . 2 . . . . . 22 ARG HD3 . 17017 1
260 . 1 1 22 22 ARG HG2 H 1 1.794 0.05 . 2 . . . . . 22 ARG HG2 . 17017 1
261 . 1 1 22 22 ARG HG3 H 1 1.655 0.05 . 2 . . . . . 22 ARG HG3 . 17017 1
262 . 1 1 22 22 ARG C C 13 174.502 0.4 . 1 . . . . . 22 ARG C . 17017 1
263 . 1 1 22 22 ARG CA C 13 55.358 0.4 . 1 . . . . . 22 ARG CA . 17017 1
264 . 1 1 22 22 ARG CB C 13 31.862 0.4 . 1 . . . . . 22 ARG CB . 17017 1
265 . 1 1 22 22 ARG CD C 13 43.610 0.4 . 1 . . . . . 22 ARG CD . 17017 1
266 . 1 1 22 22 ARG CG C 13 28.029 0.4 . 1 . . . . . 22 ARG CG . 17017 1
267 . 1 1 22 22 ARG N N 15 125.376 0.4 . 1 . . . . . 22 ARG N . 17017 1
268 . 1 1 23 23 LEU H H 1 9.181 0.05 . 1 . . . . . 23 LEU H . 17017 1
269 . 1 1 23 23 LEU HA H 1 3.862 0.05 . 1 . . . . . 23 LEU HA . 17017 1
270 . 1 1 23 23 LEU HB2 H 1 1.853 0.05 . 2 . . . . . 23 LEU HB2 . 17017 1
271 . 1 1 23 23 LEU HB3 H 1 1.362 0.05 . 2 . . . . . 23 LEU HB3 . 17017 1
272 . 1 1 23 23 LEU HD11 H 1 0.882 0.05 . . . . . . . 23 LEU QD1 . 17017 1
273 . 1 1 23 23 LEU HD12 H 1 0.882 0.05 . . . . . . . 23 LEU QD1 . 17017 1
274 . 1 1 23 23 LEU HD13 H 1 0.882 0.05 . . . . . . . 23 LEU QD1 . 17017 1
275 . 1 1 23 23 LEU HD21 H 1 0.726 0.05 . . . . . . . 23 LEU QD2 . 17017 1
276 . 1 1 23 23 LEU HD22 H 1 0.726 0.05 . . . . . . . 23 LEU QD2 . 17017 1
277 . 1 1 23 23 LEU HD23 H 1 0.726 0.05 . . . . . . . 23 LEU QD2 . 17017 1
278 . 1 1 23 23 LEU HG H 1 1.620 0.05 . 1 . . . . . 23 LEU HG . 17017 1
279 . 1 1 23 23 LEU C C 13 174.542 0.4 . 1 . . . . . 23 LEU C . 17017 1
280 . 1 1 23 23 LEU CA C 13 58.747 0.4 . 1 . . . . . 23 LEU CA . 17017 1
281 . 1 1 23 23 LEU CB C 13 41.302 0.4 . 1 . . . . . 23 LEU CB . 17017 1
282 . 1 1 23 23 LEU CD1 C 13 25.942 0.4 . 2 . . . . . 23 LEU CD1 . 17017 1
283 . 1 1 23 23 LEU CD2 C 13 22.792 0.4 . 2 . . . . . 23 LEU CD2 . 17017 1
284 . 1 1 23 23 LEU CG C 13 26.487 0.4 . 1 . . . . . 23 LEU CG . 17017 1
285 . 1 1 23 23 LEU N N 15 125.925 0.4 . 1 . . . . . 23 LEU N . 17017 1
286 . 1 1 24 24 ARG H H 1 8.874 0.05 . 1 . . . . . 24 ARG H . 17017 1
287 . 1 1 24 24 ARG HA H 1 4.194 0.05 . 1 . . . . . 24 ARG HA . 17017 1
288 . 1 1 24 24 ARG HB2 H 1 1.904 0.05 . 2 . . . . . 24 ARG HB2 . 17017 1
289 . 1 1 24 24 ARG HB3 H 1 1.744 0.05 . 2 . . . . . 24 ARG HB3 . 17017 1
290 . 1 1 24 24 ARG HD2 H 1 3.149 0.05 . 2 . . . . . 24 ARG QD . 17017 1
291 . 1 1 24 24 ARG HD3 H 1 3.149 0.05 . 2 . . . . . 24 ARG QD . 17017 1
292 . 1 1 24 24 ARG HG2 H 1 1.581 0.05 . 2 . . . . . 24 ARG QG . 17017 1
293 . 1 1 24 24 ARG HG3 H 1 1.581 0.05 . 2 . . . . . 24 ARG QG . 17017 1
294 . 1 1 24 24 ARG C C 13 174.580 0.4 . 1 . . . . . 24 ARG C . 17017 1
295 . 1 1 24 24 ARG CA C 13 59.314 0.4 . 1 . . . . . 24 ARG CA . 17017 1
296 . 1 1 24 24 ARG CB C 13 29.498 0.4 . 1 . . . . . 24 ARG CB . 17017 1
297 . 1 1 24 24 ARG CD C 13 43.144 0.4 . 1 . . . . . 24 ARG CD . 17017 1
298 . 1 1 24 24 ARG CG C 13 27.188 0.4 . 1 . . . . . 24 ARG CG . 17017 1
299 . 1 1 24 24 ARG N N 15 114.711 0.4 . 1 . . . . . 24 ARG N . 17017 1
300 . 1 1 25 25 GLU H H 1 7.163 0.05 . 1 . . . . . 25 GLU H . 17017 1
301 . 1 1 25 25 GLU HA H 1 4.201 0.05 . 1 . . . . . 25 GLU HA . 17017 1
302 . 1 1 25 25 GLU HB2 H 1 2.044 0.05 . 2 . . . . . 25 GLU HB2 . 17017 1
303 . 1 1 25 25 GLU HB3 H 1 2.414 0.05 . 2 . . . . . 25 GLU HB3 . 17017 1
304 . 1 1 25 25 GLU HG2 H 1 2.306 0.05 . 2 . . . . . 25 GLU HG2 . 17017 1
305 . 1 1 25 25 GLU HG3 H 1 2.186 0.05 . 2 . . . . . 25 GLU HG3 . 17017 1
306 . 1 1 25 25 GLU C C 13 173.442 0.4 . 1 . . . . . 25 GLU C . 17017 1
307 . 1 1 25 25 GLU CA C 13 58.874 0.4 . 1 . . . . . 25 GLU CA . 17017 1
308 . 1 1 25 25 GLU CB C 13 29.406 0.4 . 1 . . . . . 25 GLU CB . 17017 1
309 . 1 1 25 25 GLU CG C 13 37.364 0.4 . 1 . . . . . 25 GLU CG . 17017 1
310 . 1 1 25 25 GLU N N 15 120.531 0.4 . 1 . . . . . 25 GLU N . 17017 1
311 . 1 1 26 26 LEU H H 1 7.708 0.05 . 1 . . . . . 26 LEU H . 17017 1
312 . 1 1 26 26 LEU HA H 1 4.086 0.05 . 1 . . . . . 26 LEU HA . 17017 1
313 . 1 1 26 26 LEU HB2 H 1 2.203 0.05 . 2 . . . . . 26 LEU HB2 . 17017 1
314 . 1 1 26 26 LEU HB3 H 1 1.296 0.05 . 2 . . . . . 26 LEU HB3 . 17017 1
315 . 1 1 26 26 LEU HD11 H 1 0.659 0.05 . . . . . . . 26 LEU QD1 . 17017 1
316 . 1 1 26 26 LEU HD12 H 1 0.659 0.05 . . . . . . . 26 LEU QD1 . 17017 1
317 . 1 1 26 26 LEU HD13 H 1 0.659 0.05 . . . . . . . 26 LEU QD1 . 17017 1
318 . 1 1 26 26 LEU HD21 H 1 0.815 0.05 . . . . . . . 26 LEU QD2 . 17017 1
319 . 1 1 26 26 LEU HD22 H 1 0.815 0.05 . . . . . . . 26 LEU QD2 . 17017 1
320 . 1 1 26 26 LEU HD23 H 1 0.815 0.05 . . . . . . . 26 LEU QD2 . 17017 1
321 . 1 1 26 26 LEU HG H 1 1.393 0.05 . 1 . . . . . 26 LEU HG . 17017 1
322 . 1 1 26 26 LEU C C 13 174.895 0.4 . 1 . . . . . 26 LEU C . 17017 1
323 . 1 1 26 26 LEU CA C 13 58.492 0.4 . 1 . . . . . 26 LEU CA . 17017 1
324 . 1 1 26 26 LEU CB C 13 41.348 0.4 . 1 . . . . . 26 LEU CB . 17017 1
325 . 1 1 26 26 LEU CD1 C 13 25.178 0.4 . 2 . . . . . 26 LEU CD1 . 17017 1
326 . 1 1 26 26 LEU CD2 C 13 24.575 0.4 . 2 . . . . . 26 LEU CD2 . 17017 1
327 . 1 1 26 26 LEU CG C 13 27.217 0.4 . 1 . . . . . 26 LEU CG . 17017 1
328 . 1 1 26 26 LEU N N 15 123.195 0.4 . 1 . . . . . 26 LEU N . 17017 1
329 . 1 1 27 27 GLN H H 1 8.953 0.05 . 1 . . . . . 27 GLN H . 17017 1
330 . 1 1 27 27 GLN HA H 1 4.089 0.05 . 1 . . . . . 27 GLN HA . 17017 1
331 . 1 1 27 27 GLN HB2 H 1 2.196 0.05 . 2 . . . . . 27 GLN HB2 . 17017 1
332 . 1 1 27 27 GLN HB3 H 1 1.903 0.05 . 2 . . . . . 27 GLN HB3 . 17017 1
333 . 1 1 27 27 GLN HE21 H 1 6.594 0.05 . 2 . . . . . 27 GLN HE21 . 17017 1
334 . 1 1 27 27 GLN HE22 H 1 6.868 0.05 . 2 . . . . . 27 GLN HE22 . 17017 1
335 . 1 1 27 27 GLN HG2 H 1 2.294 0.05 . 2 . . . . . 27 GLN HG2 . 17017 1
336 . 1 1 27 27 GLN HG3 H 1 2.261 0.05 . 2 . . . . . 27 GLN HG3 . 17017 1
337 . 1 1 27 27 GLN C C 13 173.618 0.4 . 1 . . . . . 27 GLN C . 17017 1
338 . 1 1 27 27 GLN CA C 13 60.454 0.4 . 1 . . . . . 27 GLN CA . 17017 1
339 . 1 1 27 27 GLN CB C 13 31.827 0.4 . 1 . . . . . 27 GLN CB . 17017 1
340 . 1 1 27 27 GLN CG C 13 36.245 0.4 . 1 . . . . . 27 GLN CG . 17017 1
341 . 1 1 27 27 GLN N N 15 115.165 0.4 . 1 . . . . . 27 GLN N . 17017 1
342 . 1 1 27 27 GLN NE2 N 15 109.656 0.4 . 1 . . . . . 27 GLN NE2 . 17017 1
343 . 1 1 28 28 GLY H H 1 8.010 0.05 . 1 . . . . . 28 GLY H . 17017 1
344 . 1 1 28 28 GLY HA2 H 1 4.065 0.05 . 2 . . . . . 28 GLY HA2 . 17017 1
345 . 1 1 28 28 GLY HA3 H 1 3.786 0.05 . 2 . . . . . 28 GLY HA3 . 17017 1
346 . 1 1 28 28 GLY C C 13 177.173 0.4 . 1 . . . . . 28 GLY C . 17017 1
347 . 1 1 28 28 GLY CA C 13 47.154 0.4 . 1 . . . . . 28 GLY CA . 17017 1
348 . 1 1 28 28 GLY N N 15 108.737 0.4 . 1 . . . . . 28 GLY N . 17017 1
349 . 1 1 29 29 GLN H H 1 7.805 0.05 . 1 . . . . . 29 GLN H . 17017 1
350 . 1 1 29 29 GLN HA H 1 4.183 0.05 . 1 . . . . . 29 GLN HA . 17017 1
351 . 1 1 29 29 GLN HB2 H 1 2.099 0.05 . 2 . . . . . 29 GLN HB2 . 17017 1
352 . 1 1 29 29 GLN HB3 H 1 2.185 0.05 . 2 . . . . . 29 GLN HB3 . 17017 1
353 . 1 1 29 29 GLN HE21 H 1 7.474 0.05 . 2 . . . . . 29 GLN HE21 . 17017 1
354 . 1 1 29 29 GLN HE22 H 1 7.640 0.05 . 2 . . . . . 29 GLN HE22 . 17017 1
355 . 1 1 29 29 GLN HG2 H 1 2.562 0.05 . 2 . . . . . 29 GLN HG2 . 17017 1
356 . 1 1 29 29 GLN HG3 H 1 2.197 0.05 . 2 . . . . . 29 GLN HG3 . 17017 1
357 . 1 1 29 29 GLN C C 13 174.977 0.4 . 1 . . . . . 29 GLN C . 17017 1
358 . 1 1 29 29 GLN CA C 13 58.851 0.4 . 1 . . . . . 29 GLN CA . 17017 1
359 . 1 1 29 29 GLN CB C 13 27.981 0.4 . 1 . . . . . 29 GLN CB . 17017 1
360 . 1 1 29 29 GLN CG C 13 34.618 0.4 . 1 . . . . . 29 GLN CG . 17017 1
361 . 1 1 29 29 GLN N N 15 124.519 0.4 . 1 . . . . . 29 GLN N . 17017 1
362 . 1 1 29 29 GLN NE2 N 15 110.348 0.4 . 1 . . . . . 29 GLN NE2 . 17017 1
363 . 1 1 30 30 ILE H H 1 8.464 0.05 . 1 . . . . . 30 ILE H . 17017 1
364 . 1 1 30 30 ILE HA H 1 3.391 0.05 . 1 . . . . . 30 ILE HA . 17017 1
365 . 1 1 30 30 ILE HB H 1 1.826 0.05 . 1 . . . . . 30 ILE HB . 17017 1
366 . 1 1 30 30 ILE HD11 H 1 0.603 0.05 . . . . . . . 30 ILE QD1 . 17017 1
367 . 1 1 30 30 ILE HD12 H 1 0.603 0.05 . . . . . . . 30 ILE QD1 . 17017 1
368 . 1 1 30 30 ILE HD13 H 1 0.603 0.05 . . . . . . . 30 ILE QD1 . 17017 1
369 . 1 1 30 30 ILE HG12 H 1 1.795 0.05 . 2 . . . . . 30 ILE HG12 . 17017 1
370 . 1 1 30 30 ILE HG13 H 1 0.906 0.05 . 2 . . . . . 30 ILE HG13 . 17017 1
371 . 1 1 30 30 ILE HG21 H 1 0.723 0.05 . . . . . . . 30 ILE QG2 . 17017 1
372 . 1 1 30 30 ILE HG22 H 1 0.723 0.05 . . . . . . . 30 ILE QG2 . 17017 1
373 . 1 1 30 30 ILE HG23 H 1 0.723 0.05 . . . . . . . 30 ILE QG2 . 17017 1
374 . 1 1 30 30 ILE C C 13 173.442 0.4 . 1 . . . . . 30 ILE C . 17017 1
375 . 1 1 30 30 ILE CA C 13 65.861 0.4 . 1 . . . . . 30 ILE CA . 17017 1
376 . 1 1 30 30 ILE CB C 13 38.386 0.4 . 1 . . . . . 30 ILE CB . 17017 1
377 . 1 1 30 30 ILE CD1 C 13 13.696 0.4 . 1 . . . . . 30 ILE CD1 . 17017 1
378 . 1 1 30 30 ILE CG1 C 13 30.139 0.4 . 1 . . . . . 30 ILE CG1 . 17017 1
379 . 1 1 30 30 ILE CG2 C 13 18.588 0.4 . 1 . . . . . 30 ILE CG2 . 17017 1
380 . 1 1 30 30 ILE N N 15 118.276 0.4 . 1 . . . . . 30 ILE N . 17017 1
381 . 1 1 31 31 ALA H H 1 8.491 0.05 . 1 . . . . . 31 ALA H . 17017 1
382 . 1 1 31 31 ALA HA H 1 4.030 0.05 . 1 . . . . . 31 ALA HA . 17017 1
383 . 1 1 31 31 ALA HB1 H 1 1.370 0.05 . . . . . . . 31 ALA QB . 17017 1
384 . 1 1 31 31 ALA HB2 H 1 1.370 0.05 . . . . . . . 31 ALA QB . 17017 1
385 . 1 1 31 31 ALA HB3 H 1 1.370 0.05 . . . . . . . 31 ALA QB . 17017 1
386 . 1 1 31 31 ALA C C 13 173.442 0.4 . 1 . . . . . 31 ALA C . 17017 1
387 . 1 1 31 31 ALA CA C 13 55.399 0.4 . 1 . . . . . 31 ALA CA . 17017 1
388 . 1 1 31 31 ALA CB C 13 19.178 0.4 . 1 . . . . . 31 ALA CB . 17017 1
389 . 1 1 31 31 ALA N N 15 126.463 0.4 . 1 . . . . . 31 ALA N . 17017 1
390 . 1 1 32 32 ALA H H 1 7.616 0.05 . 1 . . . . . 32 ALA H . 17017 1
391 . 1 1 32 32 ALA HA H 1 3.997 0.05 . 1 . . . . . 32 ALA HA . 17017 1
392 . 1 1 32 32 ALA HB1 H 1 1.489 0.05 . . . . . . . 32 ALA QB . 17017 1
393 . 1 1 32 32 ALA HB2 H 1 1.489 0.05 . . . . . . . 32 ALA QB . 17017 1
394 . 1 1 32 32 ALA HB3 H 1 1.489 0.05 . . . . . . . 32 ALA QB . 17017 1
395 . 1 1 32 32 ALA C C 13 173.733 0.4 . 1 . . . . . 32 ALA C . 17017 1
396 . 1 1 32 32 ALA CA C 13 54.913 0.4 . 1 . . . . . 32 ALA CA . 17017 1
397 . 1 1 32 32 ALA CB C 13 18.147 0.4 . 1 . . . . . 32 ALA CB . 17017 1
398 . 1 1 32 32 ALA N N 15 121.448 0.4 . 1 . . . . . 32 ALA N . 17017 1
399 . 1 1 33 33 ILE H H 1 7.425 0.05 . 1 . . . . . 33 ILE H . 17017 1
400 . 1 1 33 33 ILE HA H 1 3.946 0.05 . 1 . . . . . 33 ILE HA . 17017 1
401 . 1 1 33 33 ILE HB H 1 1.490 0.05 . 1 . . . . . 33 ILE HB . 17017 1
402 . 1 1 33 33 ILE HD11 H 1 0.669 0.05 . . . . . . . 33 ILE QD1 . 17017 1
403 . 1 1 33 33 ILE HD12 H 1 0.669 0.05 . . . . . . . 33 ILE QD1 . 17017 1
404 . 1 1 33 33 ILE HD13 H 1 0.669 0.05 . . . . . . . 33 ILE QD1 . 17017 1
405 . 1 1 33 33 ILE HG12 H 1 1.402 0.05 . 2 . . . . . 33 ILE HG12 . 17017 1
406 . 1 1 33 33 ILE HG13 H 1 1.099 0.05 . 2 . . . . . 33 ILE HG13 . 17017 1
407 . 1 1 33 33 ILE HG21 H 1 0.432 0.05 . . . . . . . 33 ILE QG2 . 17017 1
408 . 1 1 33 33 ILE HG22 H 1 0.432 0.05 . . . . . . . 33 ILE QG2 . 17017 1
409 . 1 1 33 33 ILE HG23 H 1 0.432 0.05 . . . . . . . 33 ILE QG2 . 17017 1
410 . 1 1 33 33 ILE C C 13 176.212 0.4 . 1 . . . . . 33 ILE C . 17017 1
411 . 1 1 33 33 ILE CA C 13 62.907 0.4 . 1 . . . . . 33 ILE CA . 17017 1
412 . 1 1 33 33 ILE CB C 13 39.488 0.4 . 1 . . . . . 33 ILE CB . 17017 1
413 . 1 1 33 33 ILE CD1 C 13 14.143 0.4 . 1 . . . . . 33 ILE CD1 . 17017 1
414 . 1 1 33 33 ILE CG1 C 13 27.663 0.4 . 1 . . . . . 33 ILE CG1 . 17017 1
415 . 1 1 33 33 ILE CG2 C 13 16.840 0.4 . 1 . . . . . 33 ILE CG2 . 17017 1
416 . 1 1 33 33 ILE N N 15 113.340 0.4 . 1 . . . . . 33 ILE N . 17017 1
417 . 1 1 34 34 THR H H 1 7.970 0.05 . 1 . . . . . 34 THR H . 17017 1
418 . 1 1 34 34 THR HA H 1 4.263 0.05 . 1 . . . . . 34 THR HA . 17017 1
419 . 1 1 34 34 THR HB H 1 3.961 0.05 . 1 . . . . . 34 THR HB . 17017 1
420 . 1 1 34 34 THR HG21 H 1 0.950 0.05 . . . . . . . 34 THR QG2 . 17017 1
421 . 1 1 34 34 THR HG22 H 1 0.950 0.05 . . . . . . . 34 THR QG2 . 17017 1
422 . 1 1 34 34 THR HG23 H 1 0.950 0.05 . . . . . . . 34 THR QG2 . 17017 1
423 . 1 1 34 34 THR C C 13 177.450 0.4 . 1 . . . . . 34 THR C . 17017 1
424 . 1 1 34 34 THR CA C 13 62.552 0.4 . 1 . . . . . 34 THR CA . 17017 1
425 . 1 1 34 34 THR CB C 13 72.606 0.4 . 1 . . . . . 34 THR CB . 17017 1
426 . 1 1 34 34 THR CG2 C 13 21.946 0.4 . 1 . . . . . 34 THR CG2 . 17017 1
427 . 1 1 34 34 THR N N 15 106.748 0.4 . 1 . . . . . 34 THR N . 17017 1
428 . 1 1 35 35 GLY H H 1 8.010 0.05 . 1 . . . . . 35 GLY H . 17017 1
429 . 1 1 35 35 GLY HA2 H 1 4.113 0.05 . 2 . . . . . 35 GLY HA2 . 17017 1
430 . 1 1 35 35 GLY HA3 H 1 3.709 0.05 . 2 . . . . . 35 GLY HA3 . 17017 1
431 . 1 1 35 35 GLY C C 13 179.634 0.4 . 1 . . . . . 35 GLY C . 17017 1
432 . 1 1 35 35 GLY CA C 13 45.588 0.4 . 1 . . . . . 35 GLY CA . 17017 1
433 . 1 1 35 35 GLY N N 15 111.409 0.4 . 1 . . . . . 35 GLY N . 17017 1
434 . 1 1 36 36 ILE H H 1 7.704 0.05 . 1 . . . . . 36 ILE H . 17017 1
435 . 1 1 36 36 ILE HA H 1 3.895 0.05 . 1 . . . . . 36 ILE HA . 17017 1
436 . 1 1 36 36 ILE HB H 1 1.422 0.05 . 1 . . . . . 36 ILE HB . 17017 1
437 . 1 1 36 36 ILE HD11 H 1 0.613 0.05 . . . . . . . 36 ILE QD1 . 17017 1
438 . 1 1 36 36 ILE HD12 H 1 0.613 0.05 . . . . . . . 36 ILE QD1 . 17017 1
439 . 1 1 36 36 ILE HD13 H 1 0.613 0.05 . . . . . . . 36 ILE QD1 . 17017 1
440 . 1 1 36 36 ILE HG12 H 1 1.295 0.05 . 2 . . . . . 36 ILE HG12 . 17017 1
441 . 1 1 36 36 ILE HG13 H 1 0.693 0.05 . 2 . . . . . 36 ILE HG13 . 17017 1
442 . 1 1 36 36 ILE HG21 H 1 0.657 0.05 . . . . . . . 36 ILE QG2 . 17017 1
443 . 1 1 36 36 ILE HG22 H 1 0.657 0.05 . . . . . . . 36 ILE QG2 . 17017 1
444 . 1 1 36 36 ILE HG23 H 1 0.657 0.05 . . . . . . . 36 ILE QG2 . 17017 1
445 . 1 1 36 36 ILE C C 13 178.944 0.4 . 1 . . . . . 36 ILE C . 17017 1
446 . 1 1 36 36 ILE CA C 13 61.051 0.4 . 1 . . . . . 36 ILE CA . 17017 1
447 . 1 1 36 36 ILE CB C 13 37.738 0.4 . 1 . . . . . 36 ILE CB . 17017 1
448 . 1 1 36 36 ILE CD1 C 13 13.305 0.4 . 1 . . . . . 36 ILE CD1 . 17017 1
449 . 1 1 36 36 ILE CG1 C 13 26.846 0.4 . 1 . . . . . 36 ILE CG1 . 17017 1
450 . 1 1 36 36 ILE CG2 C 13 17.984 0.4 . 1 . . . . . 36 ILE CG2 . 17017 1
451 . 1 1 36 36 ILE N N 15 122.294 0.4 . 1 . . . . . 36 ILE N . 17017 1
452 . 1 1 37 37 ALA H H 1 8.558 0.05 . 1 . . . . . 37 ALA H . 17017 1
453 . 1 1 37 37 ALA HA H 1 4.281 0.05 . 1 . . . . . 37 ALA HA . 17017 1
454 . 1 1 37 37 ALA HB1 H 1 1.333 0.05 . . . . . . . 37 ALA QB . 17017 1
455 . 1 1 37 37 ALA HB2 H 1 1.333 0.05 . . . . . . . 37 ALA QB . 17017 1
456 . 1 1 37 37 ALA HB3 H 1 1.333 0.05 . . . . . . . 37 ALA QB . 17017 1
457 . 1 1 37 37 ALA CA C 13 51.414 0.4 . 1 . . . . . 37 ALA CA . 17017 1
458 . 1 1 37 37 ALA CB C 13 17.186 0.4 . 1 . . . . . 37 ALA CB . 17017 1
459 . 1 1 37 37 ALA N N 15 131.748 0.4 . 1 . . . . . 37 ALA N . 17017 1
460 . 1 1 38 38 PRO HA H 1 3.842 0.05 . 1 . . . . . 38 PRO HA . 17017 1
461 . 1 1 38 38 PRO HB2 H 1 1.980 0.05 . 2 . . . . . 38 PRO HB2 . 17017 1
462 . 1 1 38 38 PRO HB3 H 1 1.851 0.05 . 2 . . . . . 38 PRO HB3 . 17017 1
463 . 1 1 38 38 PRO HD2 H 1 3.729 0.05 . 2 . . . . . 38 PRO HD2 . 17017 1
464 . 1 1 38 38 PRO HD3 H 1 3.615 0.05 . 2 . . . . . 38 PRO HD3 . 17017 1
465 . 1 1 38 38 PRO HG2 H 1 2.163 0.05 . 2 . . . . . 38 PRO HG2 . 17017 1
466 . 1 1 38 38 PRO HG3 H 1 1.507 0.05 . 2 . . . . . 38 PRO HG3 . 17017 1
467 . 1 1 38 38 PRO CA C 13 66.652 0.4 . 1 . . . . . 38 PRO CA . 17017 1
468 . 1 1 38 38 PRO CB C 13 32.308 0.4 . 1 . . . . . 38 PRO CB . 17017 1
469 . 1 1 38 38 PRO CD C 13 50.093 0.4 . 1 . . . . . 38 PRO CD . 17017 1
470 . 1 1 38 38 PRO CG C 13 28.080 0.4 . 1 . . . . . 38 PRO CG . 17017 1
471 . 1 1 39 39 GLY H H 1 8.636 0.05 . 1 . . . . . 39 GLY H . 17017 1
472 . 1 1 39 39 GLY HA2 H 1 3.917 0.05 . 2 . . . . . 39 GLY HA2 . 17017 1
473 . 1 1 39 39 GLY HA3 H 1 3.726 0.05 . 2 . . . . . 39 GLY HA3 . 17017 1
474 . 1 1 39 39 GLY C C 13 178.840 0.4 . 1 . . . . . 39 GLY C . 17017 1
475 . 1 1 39 39 GLY CA C 13 45.981 0.4 . 1 . . . . . 39 GLY CA . 17017 1
476 . 1 1 39 39 GLY N N 15 134.786 0.4 . 1 . . . . . 39 GLY N . 17017 1
477 . 1 1 40 40 SER H H 1 8.015 0.05 . 1 . . . . . 40 SER H . 17017 1
478 . 1 1 40 40 SER HA H 1 4.720 0.05 . 1 . . . . . 40 SER HA . 17017 1
479 . 1 1 40 40 SER HB2 H 1 4.101 0.05 . 2 . . . . . 40 SER HB2 . 17017 1
480 . 1 1 40 40 SER HB3 H 1 3.726 0.05 . 2 . . . . . 40 SER HB3 . 17017 1
481 . 1 1 40 40 SER C C 13 180.507 0.4 . 1 . . . . . 40 SER C . 17017 1
482 . 1 1 40 40 SER CA C 13 57.533 0.4 . 1 . . . . . 40 SER CA . 17017 1
483 . 1 1 40 40 SER CB C 13 64.701 0.4 . 1 . . . . . 40 SER CB . 17017 1
484 . 1 1 40 40 SER N N 15 114.155 0.4 . 1 . . . . . 40 SER N . 17017 1
485 . 1 1 41 41 GLN H H 1 7.010 0.05 . 1 . . . . . 41 GLN H . 17017 1
486 . 1 1 41 41 GLN HA H 1 4.059 0.05 . 1 . . . . . 41 GLN HA . 17017 1
487 . 1 1 41 41 GLN HB2 H 1 1.888 0.05 . 2 . . . . . 41 GLN HB2 . 17017 1
488 . 1 1 41 41 GLN HB3 H 1 1.586 0.05 . 2 . . . . . 41 GLN HB3 . 17017 1
489 . 1 1 41 41 GLN HE21 H 1 6.603 0.05 . 2 . . . . . 41 GLN HE21 . 17017 1
490 . 1 1 41 41 GLN HE22 H 1 7.104 0.05 . 2 . . . . . 41 GLN HE22 . 17017 1
491 . 1 1 41 41 GLN HG2 H 1 2.740 0.05 . 2 . . . . . 41 GLN HG2 . 17017 1
492 . 1 1 41 41 GLN HG3 H 1 1.624 0.05 . 2 . . . . . 41 GLN HG3 . 17017 1
493 . 1 1 41 41 GLN C C 13 177.570 0.4 . 1 . . . . . 41 GLN C . 17017 1
494 . 1 1 41 41 GLN CA C 13 56.687 0.4 . 1 . . . . . 41 GLN CA . 17017 1
495 . 1 1 41 41 GLN CB C 13 29.417 0.4 . 1 . . . . . 41 GLN CB . 17017 1
496 . 1 1 41 41 GLN CG C 13 33.519 0.4 . 1 . . . . . 41 GLN CG . 17017 1
497 . 1 1 41 41 GLN N N 15 119.549 0.4 . 1 . . . . . 41 GLN N . 17017 1
498 . 1 1 41 41 GLN NE2 N 15 104.100 0.4 . 1 . . . . . 41 GLN NE2 . 17017 1
499 . 1 1 42 42 ARG H H 1 8.605 0.05 . 1 . . . . . 42 ARG H . 17017 1
500 . 1 1 42 42 ARG HA H 1 4.385 0.05 . 1 . . . . . 42 ARG HA . 17017 1
501 . 1 1 42 42 ARG HB2 H 1 1.615 0.05 . 2 . . . . . 42 ARG HB2 . 17017 1
502 . 1 1 42 42 ARG HB3 H 1 1.532 0.05 . 2 . . . . . 42 ARG HB3 . 17017 1
503 . 1 1 42 42 ARG HD2 H 1 3.193 0.05 . 2 . . . . . 42 ARG HD2 . 17017 1
504 . 1 1 42 42 ARG HD3 H 1 3.160 0.05 . 2 . . . . . 42 ARG HD3 . 17017 1
505 . 1 1 42 42 ARG HG2 H 1 1.573 0.05 . 2 . . . . . 42 ARG HG2 . 17017 1
506 . 1 1 42 42 ARG HG3 H 1 1.301 0.05 . 2 . . . . . 42 ARG HG3 . 17017 1
507 . 1 1 42 42 ARG C C 13 179.184 0.4 . 1 . . . . . 42 ARG C . 17017 1
508 . 1 1 42 42 ARG CA C 13 55.935 0.4 . 1 . . . . . 42 ARG CA . 17017 1
509 . 1 1 42 42 ARG CB C 13 31.757 0.4 . 1 . . . . . 42 ARG CB . 17017 1
510 . 1 1 42 42 ARG CD C 13 43.860 0.4 . 1 . . . . . 42 ARG CD . 17017 1
511 . 1 1 42 42 ARG CG C 13 27.413 0.4 . 1 . . . . . 42 ARG CG . 17017 1
512 . 1 1 42 42 ARG N N 15 123.915 0.4 . 1 . . . . . 42 ARG N . 17017 1
513 . 1 1 43 43 ILE H H 1 8.538 0.05 . 1 . . . . . 43 ILE H . 17017 1
514 . 1 1 43 43 ILE HA H 1 5.014 0.05 . 1 . . . . . 43 ILE HA . 17017 1
515 . 1 1 43 43 ILE HB H 1 1.593 0.05 . 1 . . . . . 43 ILE HB . 17017 1
516 . 1 1 43 43 ILE HD11 H 1 0.789 0.05 . . . . . . . 43 ILE QD1 . 17017 1
517 . 1 1 43 43 ILE HD12 H 1 0.789 0.05 . . . . . . . 43 ILE QD1 . 17017 1
518 . 1 1 43 43 ILE HD13 H 1 0.789 0.05 . . . . . . . 43 ILE QD1 . 17017 1
519 . 1 1 43 43 ILE HG12 H 1 1.612 0.05 . 2 . . . . . 43 ILE HG12 . 17017 1
520 . 1 1 43 43 ILE HG13 H 1 0.844 0.05 . 2 . . . . . 43 ILE HG13 . 17017 1
521 . 1 1 43 43 ILE HG21 H 1 0.730 0.05 . . . . . . . 43 ILE QG2 . 17017 1
522 . 1 1 43 43 ILE HG22 H 1 0.730 0.05 . . . . . . . 43 ILE QG2 . 17017 1
523 . 1 1 43 43 ILE HG23 H 1 0.730 0.05 . . . . . . . 43 ILE QG2 . 17017 1
524 . 1 1 43 43 ILE C C 13 179.376 0.4 . 1 . . . . . 43 ILE C . 17017 1
525 . 1 1 43 43 ILE CA C 13 60.461 0.4 . 1 . . . . . 43 ILE CA . 17017 1
526 . 1 1 43 43 ILE CB C 13 39.842 0.4 . 1 . . . . . 43 ILE CB . 17017 1
527 . 1 1 43 43 ILE CD1 C 13 12.343 0.4 . 1 . . . . . 43 ILE CD1 . 17017 1
528 . 1 1 43 43 ILE CG1 C 13 27.315 0.4 . 1 . . . . . 43 ILE CG1 . 17017 1
529 . 1 1 43 43 ILE CG2 C 13 19.062 0.4 . 1 . . . . . 43 ILE CG2 . 17017 1
530 . 1 1 43 43 ILE N N 15 124.801 0.4 . 1 . . . . . 43 ILE N . 17017 1
531 . 1 1 44 44 LEU H H 1 9.697 0.05 . 1 . . . . . 44 LEU H . 17017 1
532 . 1 1 44 44 LEU HA H 1 5.235 0.05 . 1 . . . . . 44 LEU HA . 17017 1
533 . 1 1 44 44 LEU HB2 H 1 1.613 0.05 . 2 . . . . . 44 LEU HB2 . 17017 1
534 . 1 1 44 44 LEU HB3 H 1 1.297 0.05 . 2 . . . . . 44 LEU HB3 . 17017 1
535 . 1 1 44 44 LEU HD11 H 1 0.634 0.05 . . . . . . . 44 LEU QD1 . 17017 1
536 . 1 1 44 44 LEU HD12 H 1 0.634 0.05 . . . . . . . 44 LEU QD1 . 17017 1
537 . 1 1 44 44 LEU HD13 H 1 0.634 0.05 . . . . . . . 44 LEU QD1 . 17017 1
538 . 1 1 44 44 LEU HD21 H 1 0.694 0.05 . . . . . . . 44 LEU QD2 . 17017 1
539 . 1 1 44 44 LEU HD22 H 1 0.694 0.05 . . . . . . . 44 LEU QD2 . 17017 1
540 . 1 1 44 44 LEU HD23 H 1 0.694 0.05 . . . . . . . 44 LEU QD2 . 17017 1
541 . 1 1 44 44 LEU HG H 1 1.458 0.05 . 1 . . . . . 44 LEU HG . 17017 1
542 . 1 1 44 44 LEU C C 13 177.470 0.4 . 1 . . . . . 44 LEU C . 17017 1
543 . 1 1 44 44 LEU CA C 13 54.055 0.4 . 1 . . . . . 44 LEU CA . 17017 1
544 . 1 1 44 44 LEU CB C 13 44.522 0.4 . 1 . . . . . 44 LEU CB . 17017 1
545 . 1 1 44 44 LEU CD1 C 13 25.861 0.4 . 2 . . . . . 44 LEU CD1 . 17017 1
546 . 1 1 44 44 LEU CD2 C 13 25.213 0.4 . 2 . . . . . 44 LEU CD2 . 17017 1
547 . 1 1 44 44 LEU CG C 13 28.178 0.4 . 1 . . . . . 44 LEU CG . 17017 1
548 . 1 1 44 44 LEU N N 15 128.316 0.4 . 1 . . . . . 44 LEU N . 17017 1
549 . 1 1 45 45 VAL H H 1 8.816 0.05 . 1 . . . . . 45 VAL H . 17017 1
550 . 1 1 45 45 VAL HA H 1 4.828 0.05 . 1 . . . . . 45 VAL HA . 17017 1
551 . 1 1 45 45 VAL HB H 1 2.066 0.05 . 1 . . . . . 45 VAL HB . 17017 1
552 . 1 1 45 45 VAL HG11 H 1 0.846 0.05 . . . . . . . 45 VAL QG1 . 17017 1
553 . 1 1 45 45 VAL HG12 H 1 0.846 0.05 . . . . . . . 45 VAL QG1 . 17017 1
554 . 1 1 45 45 VAL HG13 H 1 0.846 0.05 . . . . . . . 45 VAL QG1 . 17017 1
555 . 1 1 45 45 VAL HG21 H 1 0.865 0.05 . . . . . . . 45 VAL QG2 . 17017 1
556 . 1 1 45 45 VAL HG22 H 1 0.865 0.05 . . . . . . . 45 VAL QG2 . 17017 1
557 . 1 1 45 45 VAL HG23 H 1 0.865 0.05 . . . . . . . 45 VAL QG2 . 17017 1
558 . 1 1 45 45 VAL C C 13 177.804 0.4 . 1 . . . . . 45 VAL C . 17017 1
559 . 1 1 45 45 VAL CA C 13 59.778 0.4 . 1 . . . . . 45 VAL CA . 17017 1
560 . 1 1 45 45 VAL CB C 13 35.707 0.4 . 1 . . . . . 45 VAL CB . 17017 1
561 . 1 1 45 45 VAL CG1 C 13 21.639 0.4 . 2 . . . . . 45 VAL CG1 . 17017 1
562 . 1 1 45 45 VAL CG2 C 13 20.585 0.4 . 2 . . . . . 45 VAL CG2 . 17017 1
563 . 1 1 45 45 VAL N N 15 115.810 0.4 . 1 . . . . . 45 VAL N . 17017 1
564 . 1 1 46 46 GLY H H 1 8.553 0.05 . 1 . . . . . 46 GLY H . 17017 1
565 . 1 1 46 46 GLY HA2 H 1 4.219 0.05 . 2 . . . . . 46 GLY HA2 . 17017 1
566 . 1 1 46 46 GLY HA3 H 1 3.723 0.05 . 2 . . . . . 46 GLY HA3 . 17017 1
567 . 1 1 46 46 GLY C C 13 180.983 0.4 . 1 . . . . . 46 GLY C . 17017 1
568 . 1 1 46 46 GLY CA C 13 44.267 0.4 . 1 . . . . . 46 GLY CA . 17017 1
569 . 1 1 46 46 GLY N N 15 111.686 0.4 . 1 . . . . . 46 GLY N . 17017 1
570 . 1 1 47 47 TYR H H 1 7.910 0.05 . 1 . . . . . 47 TYR H . 17017 1
571 . 1 1 47 47 TYR HA H 1 4.308 0.05 . 1 . . . . . 47 TYR HA . 17017 1
572 . 1 1 47 47 TYR HB2 H 1 2.805 0.05 . 2 . . . . . 47 TYR QB . 17017 1
573 . 1 1 47 47 TYR HB3 H 1 2.805 0.05 . 2 . . . . . 47 TYR QB . 17017 1
574 . 1 1 47 47 TYR HD1 H 1 7.091 0.05 . 3 . . . . . 47 TYR QD . 17017 1
575 . 1 1 47 47 TYR HD2 H 1 7.091 0.05 . 3 . . . . . 47 TYR QD . 17017 1
576 . 1 1 47 47 TYR HE1 H 1 6.818 0.05 . 3 . . . . . 47 TYR QE . 17017 1
577 . 1 1 47 47 TYR HE2 H 1 6.818 0.05 . 3 . . . . . 47 TYR QE . 17017 1
578 . 1 1 47 47 TYR CA C 13 56.271 0.4 . 1 . . . . . 47 TYR CA . 17017 1
579 . 1 1 47 47 TYR CB C 13 40.961 0.4 . 1 . . . . . 47 TYR CB . 17017 1
580 . 1 1 47 47 TYR CD1 C 13 133.109 0.4 . 3 . . . . . 47 TYR CD1 . 17017 1
581 . 1 1 47 47 TYR CE1 C 13 118.276 0.4 . 3 . . . . . 47 TYR CE1 . 17017 1
582 . 1 1 47 47 TYR N N 15 116.414 0.4 . 1 . . . . . 47 TYR N . 17017 1
583 . 1 1 48 48 PRO HA H 1 3.956 0.05 . 1 . . . . . 48 PRO HA . 17017 1
584 . 1 1 48 48 PRO HB2 H 1 2.078 0.05 . 2 . . . . . 48 PRO HB2 . 17017 1
585 . 1 1 48 48 PRO HB3 H 1 1.757 0.05 . 2 . . . . . 48 PRO HB3 . 17017 1
586 . 1 1 48 48 PRO HD2 H 1 3.400 0.05 . 2 . . . . . 48 PRO HD2 . 17017 1
587 . 1 1 48 48 PRO HD3 H 1 3.322 0.05 . 2 . . . . . 48 PRO HD3 . 17017 1
588 . 1 1 48 48 PRO HG2 H 1 1.801 0.05 . 2 . . . . . 48 PRO HG2 . 17017 1
589 . 1 1 48 48 PRO HG3 H 1 1.565 0.05 . 2 . . . . . 48 PRO HG3 . 17017 1
590 . 1 1 48 48 PRO CA C 13 61.700 0.4 . 1 . . . . . 48 PRO CA . 17017 1
591 . 1 1 48 48 PRO CB C 13 32.365 0.4 . 1 . . . . . 48 PRO CB . 17017 1
592 . 1 1 48 48 PRO CD C 13 49.874 0.4 . 1 . . . . . 48 PRO CD . 17017 1
593 . 1 1 48 48 PRO CG C 13 25.432 0.4 . 1 . . . . . 48 PRO CG . 17017 1
594 . 1 1 49 49 PRO HA H 1 4.087 0.05 . 1 . . . . . 49 PRO HA . 17017 1
595 . 1 1 49 49 PRO HB2 H 1 1.991 0.05 . 2 . . . . . 49 PRO HB2 . 17017 1
596 . 1 1 49 49 PRO HB3 H 1 1.672 0.05 . 2 . . . . . 49 PRO HB3 . 17017 1
597 . 1 1 49 49 PRO HD2 H 1 3.532 0.05 . 2 . . . . . 49 PRO HD2 . 17017 1
598 . 1 1 49 49 PRO HD3 H 1 3.415 0.05 . 2 . . . . . 49 PRO HD3 . 17017 1
599 . 1 1 49 49 PRO HG2 H 1 1.995 0.05 . 2 . . . . . 49 PRO QG . 17017 1
600 . 1 1 49 49 PRO HG3 H 1 1.995 0.05 . 2 . . . . . 49 PRO QG . 17017 1
601 . 1 1 49 49 PRO C C 13 176.379 0.4 . 1 . . . . . 49 PRO C . 17017 1
602 . 1 1 49 49 PRO CA C 13 63.484 0.4 . 1 . . . . . 49 PRO CA . 17017 1
603 . 1 1 49 49 PRO CB C 13 32.348 0.4 . 1 . . . . . 49 PRO CB . 17017 1
604 . 1 1 49 49 PRO CD C 13 50.163 0.4 . 1 . . . . . 49 PRO CD . 17017 1
605 . 1 1 49 49 PRO CG C 13 27.228 0.4 . 1 . . . . . 49 PRO CG . 17017 1
606 . 1 1 50 50 GLU H H 1 8.670 0.05 . 1 . . . . . 50 GLU H . 17017 1
607 . 1 1 50 50 GLU HA H 1 4.625 0.05 . 1 . . . . . 50 GLU HA . 17017 1
608 . 1 1 50 50 GLU HB2 H 1 1.967 0.05 . 2 . . . . . 50 GLU HB2 . 17017 1
609 . 1 1 50 50 GLU HB3 H 1 1.824 0.05 . 2 . . . . . 50 GLU HB3 . 17017 1
610 . 1 1 50 50 GLU HG2 H 1 2.162 0.05 . 2 . . . . . 50 GLU QG . 17017 1
611 . 1 1 50 50 GLU HG3 H 1 2.162 0.05 . 2 . . . . . 50 GLU QG . 17017 1
612 . 1 1 50 50 GLU C C 13 177.808 0.4 . 1 . . . . . 50 GLU C . 17017 1
613 . 1 1 50 50 GLU CA C 13 54.797 0.4 . 1 . . . . . 50 GLU CA . 17017 1
614 . 1 1 50 50 GLU CB C 13 33.379 0.4 . 1 . . . . . 50 GLU CB . 17017 1
615 . 1 1 50 50 GLU CG C 13 36.124 0.4 . 1 . . . . . 50 GLU CG . 17017 1
616 . 1 1 50 50 GLU N N 15 122.856 0.4 . 1 . . . . . 50 GLU N . 17017 1
617 . 1 1 51 51 CYS H H 1 8.850 0.05 . 1 . . . . . 51 CYS H . 17017 1
618 . 1 1 51 51 CYS HA H 1 4.621 0.05 . 1 . . . . . 51 CYS HA . 17017 1
619 . 1 1 51 51 CYS HB2 H 1 2.856 0.05 . 2 . . . . . 51 CYS HB2 . 17017 1
620 . 1 1 51 51 CYS HB3 H 1 2.743 0.05 . 2 . . . . . 51 CYS HB3 . 17017 1
621 . 1 1 51 51 CYS C C 13 177.450 0.4 . 1 . . . . . 51 CYS C . 17017 1
622 . 1 1 51 51 CYS CA C 13 59.778 0.4 . 1 . . . . . 51 CYS CA . 17017 1
623 . 1 1 51 51 CYS CB C 13 27.182 0.4 . 1 . . . . . 51 CYS CB . 17017 1
624 . 1 1 51 51 CYS N N 15 121.475 0.4 . 1 . . . . . 51 CYS N . 17017 1
625 . 1 1 52 52 LEU H H 1 8.860 0.05 . 1 . . . . . 52 LEU H . 17017 1
626 . 1 1 52 52 LEU HA H 1 4.199 0.05 . 1 . . . . . 52 LEU HA . 17017 1
627 . 1 1 52 52 LEU HB2 H 1 1.395 0.05 . 2 . . . . . 52 LEU HB2 . 17017 1
628 . 1 1 52 52 LEU HB3 H 1 1.377 0.05 . 2 . . . . . 52 LEU HB3 . 17017 1
629 . 1 1 52 52 LEU HD11 H 1 0.798 0.05 . . . . . . . 52 LEU QD1 . 17017 1
630 . 1 1 52 52 LEU HD12 H 1 0.798 0.05 . . . . . . . 52 LEU QD1 . 17017 1
631 . 1 1 52 52 LEU HD13 H 1 0.798 0.05 . . . . . . . 52 LEU QD1 . 17017 1
632 . 1 1 52 52 LEU HD21 H 1 0.741 0.05 . . . . . . . 52 LEU QD2 . 17017 1
633 . 1 1 52 52 LEU HD22 H 1 0.741 0.05 . . . . . . . 52 LEU QD2 . 17017 1
634 . 1 1 52 52 LEU HD23 H 1 0.741 0.05 . . . . . . . 52 LEU QD2 . 17017 1
635 . 1 1 52 52 LEU HG H 1 1.589 0.05 . 1 . . . . . 52 LEU HG . 17017 1
636 . 1 1 52 52 LEU C C 13 177.146 0.4 . 1 . . . . . 52 LEU C . 17017 1
637 . 1 1 52 52 LEU CA C 13 54.279 0.4 . 1 . . . . . 52 LEU CA . 17017 1
638 . 1 1 52 52 LEU CB C 13 43.730 0.4 . 1 . . . . . 52 LEU CB . 17017 1
639 . 1 1 52 52 LEU CD1 C 13 25.102 0.4 . 2 . . . . . 52 LEU CD1 . 17017 1
640 . 1 1 52 52 LEU CD2 C 13 25.063 0.4 . 2 . . . . . 52 LEU CD2 . 17017 1
641 . 1 1 52 52 LEU CG C 13 26.796 0.4 . 1 . . . . . 52 LEU CG . 17017 1
642 . 1 1 52 52 LEU N N 15 127.548 0.4 . 1 . . . . . 52 LEU N . 17017 1
643 . 1 1 53 53 ASP H H 1 8.878 0.05 . 1 . . . . . 53 ASP H . 17017 1
644 . 1 1 53 53 ASP HA H 1 4.391 0.05 . 1 . . . . . 53 ASP HA . 17017 1
645 . 1 1 53 53 ASP HB2 H 1 2.849 0.05 . 2 . . . . . 53 ASP HB2 . 17017 1
646 . 1 1 53 53 ASP HB3 H 1 2.625 0.05 . 2 . . . . . 53 ASP HB3 . 17017 1
647 . 1 1 53 53 ASP C C 13 177.293 0.4 . 1 . . . . . 53 ASP C . 17017 1
648 . 1 1 53 53 ASP CA C 13 54.165 0.4 . 1 . . . . . 53 ASP CA . 17017 1
649 . 1 1 53 53 ASP CB C 13 40.561 0.4 . 1 . . . . . 53 ASP CB . 17017 1
650 . 1 1 53 53 ASP N N 15 124.678 0.4 . 1 . . . . . 53 ASP N . 17017 1
651 . 1 1 54 54 LEU H H 1 8.417 0.05 . 1 . . . . . 54 LEU H . 17017 1
652 . 1 1 54 54 LEU HA H 1 4.354 0.05 . 1 . . . . . 54 LEU HA . 17017 1
653 . 1 1 54 54 LEU HB2 H 1 1.597 0.05 . 2 . . . . . 54 LEU QB . 17017 1
654 . 1 1 54 54 LEU HB3 H 1 1.597 0.05 . 2 . . . . . 54 LEU QB . 17017 1
655 . 1 1 54 54 LEU HD11 H 1 0.919 0.05 . . . . . . . 54 LEU QD1 . 17017 1
656 . 1 1 54 54 LEU HD12 H 1 0.919 0.05 . . . . . . . 54 LEU QD1 . 17017 1
657 . 1 1 54 54 LEU HD13 H 1 0.919 0.05 . . . . . . . 54 LEU QD1 . 17017 1
658 . 1 1 54 54 LEU HD21 H 1 0.619 0.05 . . . . . . . 54 LEU QD2 . 17017 1
659 . 1 1 54 54 LEU HD22 H 1 0.619 0.05 . . . . . . . 54 LEU QD2 . 17017 1
660 . 1 1 54 54 LEU HD23 H 1 0.619 0.05 . . . . . . . 54 LEU QD2 . 17017 1
661 . 1 1 54 54 LEU HG H 1 1.784 0.05 . 1 . . . . . 54 LEU HG . 17017 1
662 . 1 1 54 54 LEU C C 13 175.400 0.4 . 1 . . . . . 54 LEU C . 17017 1
663 . 1 1 54 54 LEU CA C 13 53.268 0.4 . 1 . . . . . 54 LEU CA . 17017 1
664 . 1 1 54 54 LEU CB C 13 40.294 0.4 . 1 . . . . . 54 LEU CB . 17017 1
665 . 1 1 54 54 LEU CD1 C 13 26.209 0.4 . 2 . . . . . 54 LEU CD1 . 17017 1
666 . 1 1 54 54 LEU CD2 C 13 23.545 0.4 . 2 . . . . . 54 LEU CD2 . 17017 1
667 . 1 1 54 54 LEU CG C 13 26.296 0.4 . 1 . . . . . 54 LEU CG . 17017 1
668 . 1 1 54 54 LEU N N 15 126.682 0.4 . 1 . . . . . 54 LEU N . 17017 1
669 . 1 1 55 55 SER H H 1 8.351 0.05 . 1 . . . . . 55 SER H . 17017 1
670 . 1 1 55 55 SER HA H 1 3.939 0.05 . 1 . . . . . 55 SER HA . 17017 1
671 . 1 1 55 55 SER HB2 H 1 3.830 0.05 . 2 . . . . . 55 SER QB . 17017 1
672 . 1 1 55 55 SER HB3 H 1 3.830 0.05 . 2 . . . . . 55 SER QB . 17017 1
673 . 1 1 55 55 SER C C 13 178.919 0.4 . 1 . . . . . 55 SER C . 17017 1
674 . 1 1 55 55 SER CA C 13 61.608 0.4 . 1 . . . . . 55 SER CA . 17017 1
675 . 1 1 55 55 SER CB C 13 63.716 0.4 . 1 . . . . . 55 SER CB . 17017 1
676 . 1 1 55 55 SER N N 15 115.391 0.4 . 1 . . . . . 55 SER N . 17017 1
677 . 1 1 56 56 ASP H H 1 8.122 0.05 . 1 . . . . . 56 ASP H . 17017 1
678 . 1 1 56 56 ASP HA H 1 4.860 0.05 . 1 . . . . . 56 ASP HA . 17017 1
679 . 1 1 56 56 ASP HB2 H 1 2.768 0.05 . 2 . . . . . 56 ASP HB2 . 17017 1
680 . 1 1 56 56 ASP HB3 H 1 2.395 0.05 . 2 . . . . . 56 ASP HB3 . 17017 1
681 . 1 1 56 56 ASP CA C 13 52.272 0.4 . 1 . . . . . 56 ASP CA . 17017 1
682 . 1 1 56 56 ASP CB C 13 41.290 0.4 . 1 . . . . . 56 ASP CB . 17017 1
683 . 1 1 56 56 ASP N N 15 121.542 0.4 . 1 . . . . . 56 ASP N . 17017 1
684 . 1 1 57 57 ARG H H 1 8.657 0.05 . 1 . . . . . 57 ARG H . 17017 1
685 . 1 1 57 57 ARG HA H 1 4.047 0.05 . 1 . . . . . 57 ARG HA . 17017 1
686 . 1 1 57 57 ARG HB2 H 1 1.854 0.05 . 2 . . . . . 57 ARG HB2 . 17017 1
687 . 1 1 57 57 ARG HB3 H 1 1.699 0.05 . 2 . . . . . 57 ARG HB3 . 17017 1
688 . 1 1 57 57 ARG HD2 H 1 3.197 0.05 . 2 . . . . . 57 ARG HD2 . 17017 1
689 . 1 1 57 57 ARG HD3 H 1 3.136 0.05 . 2 . . . . . 57 ARG HD3 . 17017 1
690 . 1 1 57 57 ARG HG2 H 1 1.693 0.05 . 2 . . . . . 57 ARG HG2 . 17017 1
691 . 1 1 57 57 ARG HG3 H 1 1.625 0.05 . 2 . . . . . 57 ARG HG3 . 17017 1
692 . 1 1 57 57 ARG C C 13 177.967 0.4 . 1 . . . . . 57 ARG C . 17017 1
693 . 1 1 57 57 ARG CA C 13 57.994 0.4 . 1 . . . . . 57 ARG CA . 17017 1
694 . 1 1 57 57 ARG CB C 13 30.460 0.4 . 1 . . . . . 57 ARG CB . 17017 1
695 . 1 1 57 57 ARG CD C 13 44.186 0.4 . 1 . . . . . 57 ARG CD . 17017 1
696 . 1 1 57 57 ARG CG C 13 27.657 0.4 . 1 . . . . . 57 ARG CG . 17017 1
697 . 1 1 57 57 ARG N N 15 122.910 0.4 . 1 . . . . . 57 ARG N . 17017 1
698 . 1 1 58 58 ASP H H 1 8.311 0.05 . 1 . . . . . 58 ASP H . 17017 1
699 . 1 1 58 58 ASP HA H 1 4.901 0.05 . 1 . . . . . 58 ASP HA . 17017 1
700 . 1 1 58 58 ASP HB2 H 1 2.806 0.05 . 2 . . . . . 58 ASP HB2 . 17017 1
701 . 1 1 58 58 ASP HB3 H 1 2.562 0.05 . 2 . . . . . 58 ASP HB3 . 17017 1
702 . 1 1 58 58 ASP C C 13 177.745 0.4 . 1 . . . . . 58 ASP C . 17017 1
703 . 1 1 58 58 ASP CA C 13 54.651 0.4 . 1 . . . . . 58 ASP CA . 17017 1
704 . 1 1 58 58 ASP CB C 13 42.029 0.4 . 1 . . . . . 58 ASP CB . 17017 1
705 . 1 1 58 58 ASP N N 15 117.546 0.4 . 1 . . . . . 58 ASP N . 17017 1
706 . 1 1 59 59 ILE H H 1 6.823 0.05 . 1 . . . . . 59 ILE H . 17017 1
707 . 1 1 59 59 ILE HA H 1 4.148 0.05 . 1 . . . . . 59 ILE HA . 17017 1
708 . 1 1 59 59 ILE HB H 1 1.754 0.05 . 1 . . . . . 59 ILE HB . 17017 1
709 . 1 1 59 59 ILE HD11 H 1 0.921 0.05 . . . . . . . 59 ILE QD1 . 17017 1
710 . 1 1 59 59 ILE HD12 H 1 0.921 0.05 . . . . . . . 59 ILE QD1 . 17017 1
711 . 1 1 59 59 ILE HD13 H 1 0.921 0.05 . . . . . . . 59 ILE QD1 . 17017 1
712 . 1 1 59 59 ILE HG12 H 1 1.658 0.05 . 2 . . . . . 59 ILE HG12 . 17017 1
713 . 1 1 59 59 ILE HG13 H 1 1.536 0.05 . 2 . . . . . 59 ILE HG13 . 17017 1
714 . 1 1 59 59 ILE HG21 H 1 0.951 0.05 . . . . . . . 59 ILE QG2 . 17017 1
715 . 1 1 59 59 ILE HG22 H 1 0.951 0.05 . . . . . . . 59 ILE QG2 . 17017 1
716 . 1 1 59 59 ILE HG23 H 1 0.951 0.05 . . . . . . . 59 ILE QG2 . 17017 1
717 . 1 1 59 59 ILE C C 13 179.607 0.4 . 1 . . . . . 59 ILE C . 17017 1
718 . 1 1 59 59 ILE CA C 13 61.492 0.4 . 1 . . . . . 59 ILE CA . 17017 1
719 . 1 1 59 59 ILE CB C 13 39.043 0.4 . 1 . . . . . 59 ILE CB . 17017 1
720 . 1 1 59 59 ILE CD1 C 13 14.162 0.4 . 1 . . . . . 59 ILE CD1 . 17017 1
721 . 1 1 59 59 ILE CG1 C 13 29.174 0.4 . 1 . . . . . 59 ILE CG1 . 17017 1
722 . 1 1 59 59 ILE CG2 C 13 18.170 0.4 . 1 . . . . . 59 ILE CG2 . 17017 1
723 . 1 1 59 59 ILE N N 15 121.385 0.4 . 1 . . . . . 59 ILE N . 17017 1
724 . 1 1 60 60 THR H H 1 8.252 0.05 . 1 . . . . . 60 THR H . 17017 1
725 . 1 1 60 60 THR HA H 1 5.084 0.05 . 1 . . . . . 60 THR HA . 17017 1
726 . 1 1 60 60 THR HB H 1 4.567 0.05 . 1 . . . . . 60 THR HB . 17017 1
727 . 1 1 60 60 THR HG21 H 1 1.090 0.05 . . . . . . . 60 THR QG2 . 17017 1
728 . 1 1 60 60 THR HG22 H 1 1.090 0.05 . . . . . . . 60 THR QG2 . 17017 1
729 . 1 1 60 60 THR HG23 H 1 1.090 0.05 . . . . . . . 60 THR QG2 . 17017 1
730 . 1 1 60 60 THR C C 13 176.511 0.4 . 1 . . . . . 60 THR C . 17017 1
731 . 1 1 60 60 THR CA C 13 60.241 0.4 . 1 . . . . . 60 THR CA . 17017 1
732 . 1 1 60 60 THR CB C 13 71.292 0.4 . 1 . . . . . 60 THR CB . 17017 1
733 . 1 1 60 60 THR CG2 C 13 22.294 0.4 . 1 . . . . . 60 THR CG2 . 17017 1
734 . 1 1 60 60 THR N N 15 114.451 0.4 . 1 . . . . . 60 THR N . 17017 1
735 . 1 1 61 61 LEU H H 1 8.521 0.05 . 1 . . . . . 61 LEU H . 17017 1
736 . 1 1 61 61 LEU HA H 1 3.820 0.05 . 1 . . . . . 61 LEU HA . 17017 1
737 . 1 1 61 61 LEU HB2 H 1 1.560 0.05 . 2 . . . . . 61 LEU HB2 . 17017 1
738 . 1 1 61 61 LEU HB3 H 1 1.355 0.05 . 2 . . . . . 61 LEU HB3 . 17017 1
739 . 1 1 61 61 LEU HD11 H 1 0.717 0.05 . . . . . . . 61 LEU QD1 . 17017 1
740 . 1 1 61 61 LEU HD12 H 1 0.717 0.05 . . . . . . . 61 LEU QD1 . 17017 1
741 . 1 1 61 61 LEU HD13 H 1 0.717 0.05 . . . . . . . 61 LEU QD1 . 17017 1
742 . 1 1 61 61 LEU HD21 H 1 0.591 0.05 . . . . . . . 61 LEU QD2 . 17017 1
743 . 1 1 61 61 LEU HD22 H 1 0.591 0.05 . . . . . . . 61 LEU QD2 . 17017 1
744 . 1 1 61 61 LEU HD23 H 1 0.591 0.05 . . . . . . . 61 LEU QD2 . 17017 1
745 . 1 1 61 61 LEU HG H 1 1.739 0.05 . 1 . . . . . 61 LEU HG . 17017 1
746 . 1 1 61 61 LEU CA C 13 58.017 0.4 . 1 . . . . . 61 LEU CA . 17017 1
747 . 1 1 61 61 LEU CB C 13 39.715 0.4 . 1 . . . . . 61 LEU CB . 17017 1
748 . 1 1 61 61 LEU CD1 C 13 25.195 0.4 . 2 . . . . . 61 LEU CD1 . 17017 1
749 . 1 1 61 61 LEU CD2 C 13 22.983 0.4 . 2 . . . . . 61 LEU CD2 . 17017 1
750 . 1 1 61 61 LEU CG C 13 27.025 0.4 . 1 . . . . . 61 LEU CG . 17017 1
751 . 1 1 61 61 LEU N N 15 118.136 0.4 . 1 . . . . . 61 LEU N . 17017 1
752 . 1 1 62 62 GLY H H 1 8.676 0.05 . 1 . . . . . 62 GLY H . 17017 1
753 . 1 1 62 62 GLY HA2 H 1 4.158 0.05 . 2 . . . . . 62 GLY HA2 . 17017 1
754 . 1 1 62 62 GLY HA3 H 1 3.901 0.05 . 2 . . . . . 62 GLY HA3 . 17017 1
755 . 1 1 62 62 GLY C C 13 178.681 0.4 . 1 . . . . . 62 GLY C . 17017 1
756 . 1 1 62 62 GLY CA C 13 46.341 0.4 . 1 . . . . . 62 GLY CA . 17017 1
757 . 1 1 62 62 GLY N N 15 103.418 0.4 . 1 . . . . . 62 GLY N . 17017 1
758 . 1 1 63 63 ASP H H 1 7.630 0.05 . 1 . . . . . 63 ASP H . 17017 1
759 . 1 1 63 63 ASP HA H 1 4.864 0.05 . 1 . . . . . 63 ASP HA . 17017 1
760 . 1 1 63 63 ASP HB2 H 1 2.942 0.05 . 2 . . . . . 63 ASP HB2 . 17017 1
761 . 1 1 63 63 ASP HB3 H 1 2.718 0.05 . 2 . . . . . 63 ASP HB3 . 17017 1
762 . 1 1 63 63 ASP C C 13 177.781 0.4 . 1 . . . . . 63 ASP C . 17017 1
763 . 1 1 63 63 ASP CA C 13 54.553 0.4 . 1 . . . . . 63 ASP CA . 17017 1
764 . 1 1 63 63 ASP CB C 13 42.113 0.4 . 1 . . . . . 63 ASP CB . 17017 1
765 . 1 1 63 63 ASP N N 15 119.158 0.4 . 1 . . . . . 63 ASP N . 17017 1
766 . 1 1 64 64 LEU H H 1 7.795 0.05 . 1 . . . . . 64 LEU H . 17017 1
767 . 1 1 64 64 LEU HA H 1 4.777 0.05 . 1 . . . . . 64 LEU HA . 17017 1
768 . 1 1 64 64 LEU HB2 H 1 1.984 0.05 . 2 . . . . . 64 LEU HB2 . 17017 1
769 . 1 1 64 64 LEU HB3 H 1 1.240 0.05 . 2 . . . . . 64 LEU HB3 . 17017 1
770 . 1 1 64 64 LEU HD11 H 1 0.763 0.05 . . . . . . . 64 LEU QD1 . 17017 1
771 . 1 1 64 64 LEU HD12 H 1 0.763 0.05 . . . . . . . 64 LEU QD1 . 17017 1
772 . 1 1 64 64 LEU HD13 H 1 0.763 0.05 . . . . . . . 64 LEU QD1 . 17017 1
773 . 1 1 64 64 LEU HD21 H 1 1.042 0.05 . . . . . . . 64 LEU QD2 . 17017 1
774 . 1 1 64 64 LEU HD22 H 1 1.042 0.05 . . . . . . . 64 LEU QD2 . 17017 1
775 . 1 1 64 64 LEU HD23 H 1 1.042 0.05 . . . . . . . 64 LEU QD2 . 17017 1
776 . 1 1 64 64 LEU CA C 13 52.493 0.4 . 1 . . . . . 64 LEU CA . 17017 1
777 . 1 1 64 64 LEU CB C 13 44.267 0.4 . 1 . . . . . 64 LEU CB . 17017 1
778 . 1 1 64 64 LEU CD1 C 13 26.671 0.4 . 2 . . . . . 64 LEU CD1 . 17017 1
779 . 1 1 64 64 LEU CD2 C 13 22.841 0.4 . 2 . . . . . 64 LEU CD2 . 17017 1
780 . 1 1 64 64 LEU N N 15 122.155 0.4 . 1 . . . . . 64 LEU N . 17017 1
781 . 1 1 66 66 ILE H H 1 8.027 0.05 . 1 . . . . . 66 ILE H . 17017 1
782 . 1 1 66 66 ILE HA H 1 4.307 0.05 . 1 . . . . . 66 ILE HA . 17017 1
783 . 1 1 66 66 ILE HB H 1 1.550 0.05 . 1 . . . . . 66 ILE HB . 17017 1
784 . 1 1 66 66 ILE HD11 H 1 0.771 0.05 . . . . . . . 66 ILE QD1 . 17017 1
785 . 1 1 66 66 ILE HD12 H 1 0.771 0.05 . . . . . . . 66 ILE QD1 . 17017 1
786 . 1 1 66 66 ILE HD13 H 1 0.771 0.05 . . . . . . . 66 ILE QD1 . 17017 1
787 . 1 1 66 66 ILE HG12 H 1 0.918 0.05 . . . . . . . 66 ILE QG1 . 17017 1
788 . 1 1 66 66 ILE HG13 H 1 0.918 0.05 . . . . . . . 66 ILE QG1 . 17017 1
789 . 1 1 66 66 ILE HG21 H 1 0.852 0.05 . . . . . . . 66 ILE QG2 . 17017 1
790 . 1 1 66 66 ILE HG22 H 1 0.852 0.05 . . . . . . . 66 ILE QG2 . 17017 1
791 . 1 1 66 66 ILE HG23 H 1 0.852 0.05 . . . . . . . 66 ILE QG2 . 17017 1
792 . 1 1 66 66 ILE C C 13 178.205 0.4 . 1 . . . . . 66 ILE C . 17017 1
793 . 1 1 66 66 ILE CA C 13 60.253 0.4 . 1 . . . . . 66 ILE CA . 17017 1
794 . 1 1 66 66 ILE CB C 13 42.194 0.4 . 1 . . . . . 66 ILE CB . 17017 1
795 . 1 1 66 66 ILE CD1 C 13 14.463 0.4 . 1 . . . . . 66 ILE CD1 . 17017 1
796 . 1 1 66 66 ILE CG1 C 13 26.904 0.4 . 1 . . . . . 66 ILE CG1 . 17017 1
797 . 1 1 66 66 ILE CG2 C 13 17.452 0.4 . 1 . . . . . 66 ILE CG2 . 17017 1
798 . 1 1 66 66 ILE N N 15 120.176 0.4 . 1 . . . . . 66 ILE N . 17017 1
799 . 1 1 67 67 GLN H H 1 8.725 0.05 . 1 . . . . . 67 GLN H . 17017 1
800 . 1 1 67 67 GLN HA H 1 3.856 0.05 . 1 . . . . . 67 GLN HA . 17017 1
801 . 1 1 67 67 GLN HB2 H 1 1.735 0.05 . 2 . . . . . 67 GLN HB2 . 17017 1
802 . 1 1 67 67 GLN HB3 H 1 1.590 0.05 . 2 . . . . . 67 GLN HB3 . 17017 1
803 . 1 1 67 67 GLN HE21 H 1 6.630 0.05 . 2 . . . . . 67 GLN HE21 . 17017 1
804 . 1 1 67 67 GLN HE22 H 1 7.610 0.05 . 2 . . . . . 67 GLN HE22 . 17017 1
805 . 1 1 67 67 GLN HG2 H 1 2.126 0.05 . 2 . . . . . 67 GLN HG2 . 17017 1
806 . 1 1 67 67 GLN HG3 H 1 2.054 0.05 . 2 . . . . . 67 GLN HG3 . 17017 1
807 . 1 1 67 67 GLN C C 13 179.105 0.4 . 1 . . . . . 67 GLN C . 17017 1
808 . 1 1 67 67 GLN CA C 13 53.117 0.4 . 1 . . . . . 67 GLN CA . 17017 1
809 . 1 1 67 67 GLN CB C 13 32.163 0.4 . 1 . . . . . 67 GLN CB . 17017 1
810 . 1 1 67 67 GLN CG C 13 33.240 0.4 . 1 . . . . . 67 GLN CG . 17017 1
811 . 1 1 67 67 GLN N N 15 123.262 0.4 . 1 . . . . . 67 GLN N . 17017 1
812 . 1 1 67 67 GLN NE2 N 15 112.747 0.4 . 1 . . . . . 67 GLN NE2 . 17017 1
813 . 1 1 68 68 SER H H 1 7.198 0.05 . 1 . . . . . 68 SER H . 17017 1
814 . 1 1 68 68 SER HA H 1 3.504 0.05 . 1 . . . . . 68 SER HA . 17017 1
815 . 1 1 68 68 SER HB2 H 1 3.342 0.05 . 2 . . . . . 68 SER HB2 . 17017 1
816 . 1 1 68 68 SER HB3 H 1 2.824 0.05 . 2 . . . . . 68 SER HB3 . 17017 1
817 . 1 1 68 68 SER C C 13 177.234 0.4 . 1 . . . . . 68 SER C . 17017 1
818 . 1 1 68 68 SER CA C 13 60.121 0.4 . 1 . . . . . 68 SER CA . 17017 1
819 . 1 1 68 68 SER CB C 13 62.326 0.4 . 1 . . . . . 68 SER CB . 17017 1
820 . 1 1 68 68 SER N N 15 112.060 0.4 . 1 . . . . . 68 SER N . 17017 1
821 . 1 1 69 69 GLY H H 1 9.109 0.05 . 1 . . . . . 69 GLY H . 17017 1
822 . 1 1 69 69 GLY HA2 H 1 4.287 0.05 . 2 . . . . . 69 GLY HA2 . 17017 1
823 . 1 1 69 69 GLY HA3 H 1 3.610 0.05 . 2 . . . . . 69 GLY HA3 . 17017 1
824 . 1 1 69 69 GLY C C 13 178.655 0.4 . 1 . . . . . 69 GLY C . 17017 1
825 . 1 1 69 69 GLY CA C 13 44.684 0.4 . 1 . . . . . 69 GLY CA . 17017 1
826 . 1 1 69 69 GLY N N 15 115.974 0.4 . 1 . . . . . 69 GLY N . 17017 1
827 . 1 1 70 70 ASP H H 1 7.727 0.05 . 1 . . . . . 70 ASP H . 17017 1
828 . 1 1 70 70 ASP HA H 1 4.600 0.05 . 1 . . . . . 70 ASP HA . 17017 1
829 . 1 1 70 70 ASP HB2 H 1 2.858 0.05 . 2 . . . . . 70 ASP HB2 . 17017 1
830 . 1 1 70 70 ASP HB3 H 1 2.453 0.05 . 2 . . . . . 70 ASP HB3 . 17017 1
831 . 1 1 70 70 ASP C C 13 178.972 0.4 . 1 . . . . . 70 ASP C . 17017 1
832 . 1 1 70 70 ASP CA C 13 54.658 0.4 . 1 . . . . . 70 ASP CA . 17017 1
833 . 1 1 70 70 ASP CB C 13 42.344 0.4 . 1 . . . . . 70 ASP CB . 17017 1
834 . 1 1 70 70 ASP N N 15 121.369 0.4 . 1 . . . . . 70 ASP N . 17017 1
835 . 1 1 71 71 MET H H 1 8.391 0.05 . 1 . . . . . 71 MET H . 17017 1
836 . 1 1 71 71 MET HA H 1 4.937 0.05 . 1 . . . . . 71 MET HA . 17017 1
837 . 1 1 71 71 MET HB2 H 1 2.034 0.05 . 2 . . . . . 71 MET HB2 . 17017 1
838 . 1 1 71 71 MET HB3 H 1 1.804 0.05 . 2 . . . . . 71 MET HB3 . 17017 1
839 . 1 1 71 71 MET HE1 H 1 1.932 0.05 . . . . . . . 71 MET QE . 17017 1
840 . 1 1 71 71 MET HE2 H 1 1.932 0.05 . . . . . . . 71 MET QE . 17017 1
841 . 1 1 71 71 MET HE3 H 1 1.932 0.05 . . . . . . . 71 MET QE . 17017 1
842 . 1 1 71 71 MET HG2 H 1 2.319 0.05 . 2 . . . . . 71 MET HG2 . 17017 1
843 . 1 1 71 71 MET HG3 H 1 2.009 0.05 . 2 . . . . . 71 MET HG3 . 17017 1
844 . 1 1 71 71 MET C C 13 178.413 0.4 . 1 . . . . . 71 MET C . 17017 1
845 . 1 1 71 71 MET CA C 13 53.615 0.4 . 1 . . . . . 71 MET CA . 17017 1
846 . 1 1 71 71 MET CB C 13 34.218 0.4 . 1 . . . . . 71 MET CB . 17017 1
847 . 1 1 71 71 MET CE C 13 16.838 0.4 . 1 . . . . . 71 MET CE . 17017 1
848 . 1 1 71 71 MET CG C 13 32.255 0.4 . 1 . . . . . 71 MET CG . 17017 1
849 . 1 1 71 71 MET N N 15 118.331 0.4 . 1 . . . . . 71 MET N . 17017 1
850 . 1 1 72 72 LEU H H 1 9.019 0.05 . 1 . . . . . 72 LEU H . 17017 1
851 . 1 1 72 72 LEU HA H 1 4.846 0.05 . 1 . . . . . 72 LEU HA . 17017 1
852 . 1 1 72 72 LEU HB2 H 1 1.675 0.05 . 2 . . . . . 72 LEU HB2 . 17017 1
853 . 1 1 72 72 LEU HB3 H 1 1.254 0.05 . 2 . . . . . 72 LEU HB3 . 17017 1
854 . 1 1 72 72 LEU HD11 H 1 0.696 0.05 . . . . . . . 72 LEU QD1 . 17017 1
855 . 1 1 72 72 LEU HD12 H 1 0.696 0.05 . . . . . . . 72 LEU QD1 . 17017 1
856 . 1 1 72 72 LEU HD13 H 1 0.696 0.05 . . . . . . . 72 LEU QD1 . 17017 1
857 . 1 1 72 72 LEU HD21 H 1 0.695 0.05 . . . . . . . 72 LEU QD2 . 17017 1
858 . 1 1 72 72 LEU HD22 H 1 0.695 0.05 . . . . . . . 72 LEU QD2 . 17017 1
859 . 1 1 72 72 LEU HD23 H 1 0.695 0.05 . . . . . . . 72 LEU QD2 . 17017 1
860 . 1 1 72 72 LEU HG H 1 1.683 0.05 . 1 . . . . . 72 LEU HG . 17017 1
861 . 1 1 72 72 LEU C C 13 177.993 0.4 . 1 . . . . . 72 LEU C . 17017 1
862 . 1 1 72 72 LEU CA C 13 53.499 0.4 . 1 . . . . . 72 LEU CA . 17017 1
863 . 1 1 72 72 LEU CB C 13 43.109 0.4 . 1 . . . . . 72 LEU CB . 17017 1
864 . 1 1 72 72 LEU CD1 C 13 25.821 0.4 . 2 . . . . . 72 LEU CD1 . 17017 1
865 . 1 1 72 72 LEU CD2 C 13 23.657 0.4 . 2 . . . . . 72 LEU CD2 . 17017 1
866 . 1 1 72 72 LEU CG C 13 27.278 0.4 . 1 . . . . . 72 LEU CG . 17017 1
867 . 1 1 72 72 LEU N N 15 127.414 0.4 . 1 . . . . . 72 LEU N . 17017 1
868 . 1 1 73 73 ILE H H 1 8.864 0.05 . 1 . . . . . 73 ILE H . 17017 1
869 . 1 1 73 73 ILE HA H 1 4.602 0.05 . 1 . . . . . 73 ILE HA . 17017 1
870 . 1 1 73 73 ILE HB H 1 1.836 0.05 . 1 . . . . . 73 ILE HB . 17017 1
871 . 1 1 73 73 ILE HD11 H 1 0.833 0.05 . . . . . . . 73 ILE QD1 . 17017 1
872 . 1 1 73 73 ILE HD12 H 1 0.833 0.05 . . . . . . . 73 ILE QD1 . 17017 1
873 . 1 1 73 73 ILE HD13 H 1 0.833 0.05 . . . . . . . 73 ILE QD1 . 17017 1
874 . 1 1 73 73 ILE HG12 H 1 1.545 0.05 . 2 . . . . . 73 ILE HG12 . 17017 1
875 . 1 1 73 73 ILE HG13 H 1 1.109 0.05 . 2 . . . . . 73 ILE HG13 . 17017 1
876 . 1 1 73 73 ILE HG21 H 1 0.884 0.05 . . . . . . . 73 ILE QG2 . 17017 1
877 . 1 1 73 73 ILE HG22 H 1 0.884 0.05 . . . . . . . 73 ILE QG2 . 17017 1
878 . 1 1 73 73 ILE HG23 H 1 0.884 0.05 . . . . . . . 73 ILE QG2 . 17017 1
879 . 1 1 73 73 ILE C C 13 178.354 0.4 . 1 . . . . . 73 ILE C . 17017 1
880 . 1 1 73 73 ILE CA C 13 60.650 0.4 . 1 . . . . . 73 ILE CA . 17017 1
881 . 1 1 73 73 ILE CB C 13 39.161 0.4 . 1 . . . . . 73 ILE CB . 17017 1
882 . 1 1 73 73 ILE CD1 C 13 13.228 0.4 . 1 . . . . . 73 ILE CD1 . 17017 1
883 . 1 1 73 73 ILE CG1 C 13 27.855 0.4 . 1 . . . . . 73 ILE CG1 . 17017 1
884 . 1 1 73 73 ILE CG2 C 13 17.966 0.4 . 1 . . . . . 73 ILE CG2 . 17017 1
885 . 1 1 73 73 ILE N N 15 125.035 0.4 . 1 . . . . . 73 ILE N . 17017 1
886 . 1 1 74 74 VAL H H 1 8.753 0.05 . 1 . . . . . 74 VAL H . 17017 1
887 . 1 1 74 74 VAL HA H 1 5.003 0.05 . 1 . . . . . 74 VAL HA . 17017 1
888 . 1 1 74 74 VAL HB H 1 1.870 0.05 . 1 . . . . . 74 VAL HB . 17017 1
889 . 1 1 74 74 VAL HG11 H 1 0.835 0.05 . . . . . . . 74 VAL QG1 . 17017 1
890 . 1 1 74 74 VAL HG12 H 1 0.835 0.05 . . . . . . . 74 VAL QG1 . 17017 1
891 . 1 1 74 74 VAL HG13 H 1 0.835 0.05 . . . . . . . 74 VAL QG1 . 17017 1
892 . 1 1 74 74 VAL HG21 H 1 0.748 0.05 . . . . . . . 74 VAL QG2 . 17017 1
893 . 1 1 74 74 VAL HG22 H 1 0.748 0.05 . . . . . . . 74 VAL QG2 . 17017 1
894 . 1 1 74 74 VAL HG23 H 1 0.748 0.05 . . . . . . . 74 VAL QG2 . 17017 1
895 . 1 1 74 74 VAL C C 13 178.669 0.4 . 1 . . . . . 74 VAL C . 17017 1
896 . 1 1 74 74 VAL CA C 13 60.659 0.4 . 1 . . . . . 74 VAL CA . 17017 1
897 . 1 1 74 74 VAL CB C 13 33.244 0.4 . 1 . . . . . 74 VAL CB . 17017 1
898 . 1 1 74 74 VAL CG1 C 13 21.573 0.4 . 2 . . . . . 74 VAL CG1 . 17017 1
899 . 1 1 74 74 VAL CG2 C 13 20.726 0.4 . 2 . . . . . 74 VAL CG2 . 17017 1
900 . 1 1 74 74 VAL N N 15 126.106 0.4 . 1 . . . . . 74 VAL N . 17017 1
901 . 1 1 75 75 GLU H H 1 9.080 0.05 . 1 . . . . . 75 GLU H . 17017 1
902 . 1 1 75 75 GLU HA H 1 4.543 0.05 . 1 . . . . . 75 GLU HA . 17017 1
903 . 1 1 75 75 GLU HB2 H 1 1.992 0.05 . 2 . . . . . 75 GLU HB2 . 17017 1
904 . 1 1 75 75 GLU HB3 H 1 1.711 0.05 . 2 . . . . . 75 GLU HB3 . 17017 1
905 . 1 1 75 75 GLU HG2 H 1 2.074 0.05 . 2 . . . . . 75 GLU QG . 17017 1
906 . 1 1 75 75 GLU HG3 H 1 2.074 0.05 . 2 . . . . . 75 GLU QG . 17017 1
907 . 1 1 75 75 GLU C C 13 179.184 0.4 . 1 . . . . . 75 GLU C . 17017 1
908 . 1 1 75 75 GLU CA C 13 53.523 0.4 . 1 . . . . . 75 GLU CA . 17017 1
909 . 1 1 75 75 GLU CB C 13 33.309 0.4 . 1 . . . . . 75 GLU CB . 17017 1
910 . 1 1 75 75 GLU CG C 13 36.564 0.4 . 1 . . . . . 75 GLU CG . 17017 1
911 . 1 1 75 75 GLU N N 15 126.142 0.4 . 1 . . . . . 75 GLU N . 17017 1
912 . 1 1 76 76 GLU H H 1 8.500 0.05 . 1 . . . . . 76 GLU H . 17017 1
913 . 1 1 76 76 GLU HA H 1 4.603 0.05 . 1 . . . . . 76 GLU HA . 17017 1
914 . 1 1 76 76 GLU HB2 H 1 1.981 0.05 . 2 . . . . . 76 GLU HB2 . 17017 1
915 . 1 1 76 76 GLU HB3 H 1 1.717 0.05 . 2 . . . . . 76 GLU HB3 . 17017 1
916 . 1 1 76 76 GLU HG2 H 1 2.073 0.05 . 2 . . . . . 76 GLU QG . 17017 1
917 . 1 1 76 76 GLU HG3 H 1 2.073 0.05 . 2 . . . . . 76 GLU QG . 17017 1
918 . 1 1 76 76 GLU C C 13 177.548 0.4 . 1 . . . . . 76 GLU C . 17017 1
919 . 1 1 76 76 GLU CA C 13 55.034 0.4 . 1 . . . . . 76 GLU CA . 17017 1
920 . 1 1 76 76 GLU CB C 13 31.219 0.4 . 1 . . . . . 76 GLU CB . 17017 1
921 . 1 1 76 76 GLU CG C 13 37.196 0.4 . 1 . . . . . 76 GLU CG . 17017 1
922 . 1 1 76 76 GLU N N 15 121.004 0.4 . 1 . . . . . 76 GLU N . 17017 1
923 . 1 1 77 77 ASP H H 1 9.042 0.05 . 1 . . . . . 77 ASP H . 17017 1
924 . 1 1 77 77 ASP HA H 1 4.556 0.05 . 1 . . . . . 77 ASP HA . 17017 1
925 . 1 1 77 77 ASP HB2 H 1 2.623 0.05 . 2 . . . . . 77 ASP HB2 . 17017 1
926 . 1 1 77 77 ASP HB3 H 1 2.260 0.05 . 2 . . . . . 77 ASP HB3 . 17017 1
927 . 1 1 77 77 ASP CA C 13 53.835 0.4 . 1 . . . . . 77 ASP CA . 17017 1
928 . 1 1 77 77 ASP CB C 13 41.511 0.4 . 1 . . . . . 77 ASP CB . 17017 1
929 . 1 1 77 77 ASP N N 15 126.890 0.4 . 1 . . . . . 77 ASP N . 17017 1
930 . 1 1 78 78 GLN H H 1 8.683 0.05 . 1 . . . . . 78 GLN H . 17017 1
931 . 1 1 78 78 GLN HA H 1 4.395 0.05 . 1 . . . . . 78 GLN HA . 17017 1
932 . 1 1 78 78 GLN HB2 H 1 2.197 0.05 . 2 . . . . . 78 GLN HB2 . 17017 1
933 . 1 1 78 78 GLN HB3 H 1 1.883 0.05 . 2 . . . . . 78 GLN HB3 . 17017 1
934 . 1 1 78 78 GLN HE21 H 1 6.830 0.05 . 2 . . . . . 78 GLN HE21 . 17017 1
935 . 1 1 78 78 GLN HE22 H 1 7.476 0.05 . 2 . . . . . 78 GLN HE22 . 17017 1
936 . 1 1 78 78 GLN HG2 H 1 2.330 0.05 . 2 . . . . . 78 GLN QG . 17017 1
937 . 1 1 78 78 GLN HG3 H 1 2.330 0.05 . 2 . . . . . 78 GLN QG . 17017 1
938 . 1 1 78 78 GLN C C 13 176.961 0.4 . 1 . . . . . 78 GLN C . 17017 1
939 . 1 1 78 78 GLN CA C 13 55.561 0.4 . 1 . . . . . 78 GLN CA . 17017 1
940 . 1 1 78 78 GLN CB C 13 29.093 0.4 . 1 . . . . . 78 GLN CB . 17017 1
941 . 1 1 78 78 GLN CG C 13 33.738 0.4 . 1 . . . . . 78 GLN CG . 17017 1
942 . 1 1 78 78 GLN N N 15 123.652 0.4 . 1 . . . . . 78 GLN N . 17017 1
943 . 1 1 78 78 GLN NE2 N 15 112.312 0.4 . 1 . . . . . 78 GLN NE2 . 17017 1
944 . 1 1 79 79 THR H H 1 8.393 0.05 . 1 . . . . . 79 THR H . 17017 1
945 . 1 1 79 79 THR HA H 1 4.193 0.05 . 1 . . . . . 79 THR HA . 17017 1
946 . 1 1 79 79 THR HB H 1 4.154 0.05 . 1 . . . . . 79 THR HB . 17017 1
947 . 1 1 79 79 THR HG21 H 1 1.150 0.05 . . . . . . . 79 THR QG2 . 17017 1
948 . 1 1 79 79 THR HG22 H 1 1.150 0.05 . . . . . . . 79 THR QG2 . 17017 1
949 . 1 1 79 79 THR HG23 H 1 1.150 0.05 . . . . . . . 79 THR QG2 . 17017 1
950 . 1 1 79 79 THR C C 13 178.734 0.4 . 1 . . . . . 79 THR C . 17017 1
951 . 1 1 79 79 THR CA C 13 62.772 0.4 . 1 . . . . . 79 THR CA . 17017 1
952 . 1 1 79 79 THR CB C 13 69.552 0.4 . 1 . . . . . 79 THR CB . 17017 1
953 . 1 1 79 79 THR CG2 C 13 21.712 0.4 . 1 . . . . . 79 THR CG2 . 17017 1
954 . 1 1 79 79 THR N N 15 114.465 0.4 . 1 . . . . . 79 THR N . 17017 1
955 . 1 1 80 80 ARG H H 1 7.892 0.05 . 1 . . . . . 80 ARG H . 17017 1
956 . 1 1 80 80 ARG HA H 1 4.530 0.05 . 1 . . . . . 80 ARG HA . 17017 1
957 . 1 1 80 80 ARG HB2 H 1 1.801 0.05 . 2 . . . . . 80 ARG HB2 . 17017 1
958 . 1 1 80 80 ARG HB3 H 1 1.679 0.05 . 2 . . . . . 80 ARG HB3 . 17017 1
959 . 1 1 80 80 ARG HG2 H 1 1.642 0.05 . 2 . . . . . 80 ARG HG2 . 17017 1
960 . 1 1 80 80 ARG HG3 H 1 1.573 0.05 . 2 . . . . . 80 ARG HG3 . 17017 1
961 . 1 1 80 80 ARG CA C 13 54.171 0.4 . 1 . . . . . 80 ARG CA . 17017 1
962 . 1 1 80 80 ARG CB C 13 29.901 0.4 . 1 . . . . . 80 ARG CB . 17017 1
963 . 1 1 80 80 ARG CG C 13 26.869 0.4 . 1 . . . . . 80 ARG CG . 17017 1
964 . 1 1 80 80 ARG N N 15 124.120 0.4 . 1 . . . . . 80 ARG N . 17017 1
965 . 1 1 81 81 PRO HA H 1 4.343 0.05 . 1 . . . . . 81 PRO HA . 17017 1
966 . 1 1 81 81 PRO HB2 H 1 2.232 0.05 . 2 . . . . . 81 PRO HB2 . 17017 1
967 . 1 1 81 81 PRO HB3 H 1 1.808 0.05 . 2 . . . . . 81 PRO HB3 . 17017 1
968 . 1 1 81 81 PRO HD2 H 1 3.761 0.05 . 2 . . . . . 81 PRO HD2 . 17017 1
969 . 1 1 81 81 PRO HD3 H 1 3.539 0.05 . 2 . . . . . 81 PRO HD3 . 17017 1
970 . 1 1 81 81 PRO HG2 H 1 1.941 0.05 . 2 . . . . . 81 PRO QG . 17017 1
971 . 1 1 81 81 PRO HG3 H 1 1.941 0.05 . 2 . . . . . 81 PRO QG . 17017 1
972 . 1 1 81 81 PRO C C 13 176.538 0.4 . 1 . . . . . 81 PRO C . 17017 1
973 . 1 1 81 81 PRO CA C 13 63.079 0.4 . 1 . . . . . 81 PRO CA . 17017 1
974 . 1 1 81 81 PRO CB C 13 32.012 0.4 . 1 . . . . . 81 PRO CB . 17017 1
975 . 1 1 81 81 PRO CD C 13 50.522 0.4 . 1 . . . . . 81 PRO CD . 17017 1
976 . 1 1 81 81 PRO CG C 13 27.309 0.4 . 1 . . . . . 81 PRO CG . 17017 1
977 . 1 1 82 82 LYS H H 1 8.348 0.05 . 1 . . . . . 82 LYS H . 17017 1
978 . 1 1 82 82 LYS HA H 1 4.193 0.05 . 1 . . . . . 82 LYS HA . 17017 1
979 . 1 1 82 82 LYS HB2 H 1 1.768 0.05 . 2 . . . . . 82 LYS HB2 . 17017 1
980 . 1 1 82 82 LYS HB3 H 1 1.684 0.05 . 2 . . . . . 82 LYS HB3 . 17017 1
981 . 1 1 82 82 LYS HD2 H 1 1.633 0.05 . 2 . . . . . 82 LYS QD . 17017 1
982 . 1 1 82 82 LYS HD3 H 1 1.633 0.05 . 2 . . . . . 82 LYS QD . 17017 1
983 . 1 1 82 82 LYS HE2 H 1 2.957 0.05 . 2 . . . . . 82 LYS QE . 17017 1
984 . 1 1 82 82 LYS HE3 H 1 2.957 0.05 . 2 . . . . . 82 LYS QE . 17017 1
985 . 1 1 82 82 LYS HG2 H 1 1.427 0.05 . 2 . . . . . 82 LYS HG2 . 17017 1
986 . 1 1 82 82 LYS HG3 H 1 1.390 0.05 . 2 . . . . . 82 LYS HG3 . 17017 1
987 . 1 1 82 82 LYS C C 13 177.041 0.4 . 1 . . . . . 82 LYS C . 17017 1
988 . 1 1 82 82 LYS CA C 13 56.311 0.4 . 1 . . . . . 82 LYS CA . 17017 1
989 . 1 1 82 82 LYS CB C 13 33.287 0.4 . 1 . . . . . 82 LYS CB . 17017 1
990 . 1 1 82 82 LYS CD C 13 29.281 0.4 . 1 . . . . . 82 LYS CD . 17017 1
991 . 1 1 82 82 LYS CE C 13 42.146 0.4 . 1 . . . . . 82 LYS CE . 17017 1
992 . 1 1 82 82 LYS CG C 13 24.861 0.4 . 1 . . . . . 82 LYS CG . 17017 1
993 . 1 1 82 82 LYS N N 15 122.032 0.4 . 1 . . . . . 82 LYS N . 17017 1
994 . 1 1 83 83 ALA H H 1 8.253 0.05 . 1 . . . . . 83 ALA H . 17017 1
995 . 1 1 83 83 ALA HA H 1 4.240 0.05 . 1 . . . . . 83 ALA HA . 17017 1
996 . 1 1 83 83 ALA HB1 H 1 1.281 0.05 . . . . . . . 83 ALA QB . 17017 1
997 . 1 1 83 83 ALA HB2 H 1 1.281 0.05 . . . . . . . 83 ALA QB . 17017 1
998 . 1 1 83 83 ALA HB3 H 1 1.281 0.05 . . . . . . . 83 ALA QB . 17017 1
999 . 1 1 83 83 ALA C C 13 181.539 0.4 . 1 . . . . . 83 ALA C . 17017 1
1000 . 1 1 83 83 ALA CA C 13 52.225 0.4 . 1 . . . . . 83 ALA CA . 17017 1
1001 . 1 1 83 83 ALA CB C 13 19.351 0.4 . 1 . . . . . 83 ALA CB . 17017 1
1002 . 1 1 83 83 ALA N N 15 125.427 0.4 . 1 . . . . . 83 ALA N . 17017 1
1003 . 1 1 84 84 SER H H 1 8.009 0.05 . 1 . . . . . 84 SER H . 17017 1
1004 . 1 1 84 84 SER N N 15 115.215 0.4 . 1 . . . . . 84 SER N . 17017 1
1005 . 1 1 85 85 PRO HA H 1 4.419 0.05 . 1 . . . . . 85 PRO HA . 17017 1
1006 . 1 1 85 85 PRO HB2 H 1 2.252 0.05 . 2 . . . . . 85 PRO HB2 . 17017 1
1007 . 1 1 85 85 PRO HB3 H 1 1.952 0.05 . 2 . . . . . 85 PRO HB3 . 17017 1
1008 . 1 1 85 85 PRO HD2 H 1 3.762 0.05 . 2 . . . . . 85 PRO HD2 . 17017 1
1009 . 1 1 85 85 PRO HD3 H 1 3.696 0.05 . 2 . . . . . 85 PRO HD3 . 17017 1
1010 . 1 1 85 85 PRO HG2 H 1 1.990 0.05 . 2 . . . . . 85 PRO HG2 . 17017 1
1011 . 1 1 85 85 PRO HG3 H 1 1.962 0.05 . 2 . . . . . 85 PRO HG3 . 17017 1
1012 . 1 1 85 85 PRO C C 13 177.146 0.4 . 1 . . . . . 85 PRO C . 17017 1
1013 . 1 1 85 85 PRO CA C 13 63.623 0.4 . 1 . . . . . 85 PRO CA . 17017 1
1014 . 1 1 85 85 PRO CB C 13 32.082 0.4 . 1 . . . . . 85 PRO CB . 17017 1
1015 . 1 1 85 85 PRO CD C 13 50.962 0.4 . 1 . . . . . 85 PRO CD . 17017 1
1016 . 1 1 85 85 PRO CG C 13 26.742 0.4 . 1 . . . . . 85 PRO CG . 17017 1
1017 . 1 1 86 86 SER H H 1 7.908 0.05 . 1 . . . . . 86 SER H . 17017 1
1018 . 1 1 86 86 SER N N 15 121.602 0.4 . 1 . . . . . 86 SER N . 17017 1
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