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 50579
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name WRKY33-C(v352-a422)
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 50579 1
3 '3D CBCA(CO)NH' . . . 50579 1
4 '3D HNCACB' . . . 50579 1
5 '3D HNCA' . . . 50579 1
6 '3D HNCO' . . . 50579 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 . . 50579 1
2 $software_2 . . 50579 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 2 2 VAL HA H 1 4.092 0.02 . 1 . . . . . 2 V HA . 50579 1
2 . 1 . 1 2 2 VAL HB H 1 2.053 0.02 . 1 . . . . . 2 V HB . 50579 1
3 . 1 . 1 2 2 VAL HG21 H 1 0.949 0.02 . 2 . . . . . 2 V HG21 . 50579 1
4 . 1 . 1 2 2 VAL HG22 H 1 0.949 0.02 . 2 . . . . . 2 V HG21 . 50579 1
5 . 1 . 1 2 2 VAL HG23 H 1 0.949 0.02 . 2 . . . . . 2 V HG21 . 50579 1
6 . 1 . 1 2 2 VAL C C 13 176.175 0.3 . 1 . . . . . 2 V C . 50579 1
7 . 1 . 1 2 2 VAL CA C 13 62.382 0.3 . 1 . . . . . 2 V CA . 50579 1
8 . 1 . 1 2 2 VAL CB C 13 32.721 0.3 . 1 . . . . . 2 V CB . 50579 1
9 . 1 . 1 2 2 VAL CG2 C 13 20.899 0.3 . 1 . . . . . 2 V CG2 . 50579 1
10 . 1 . 1 3 3 GLN H H 1 8.559 0.02 . 1 . . . . . 3 Q HN . 50579 1
11 . 1 . 1 3 3 GLN HA H 1 4.558 0.02 . 1 . . . . . 3 Q HA . 50579 1
12 . 1 . 1 3 3 GLN HB2 H 1 2.13 0.02 . 2 . . . . . 3 Q HB1 . 50579 1
13 . 1 . 1 3 3 GLN HB3 H 1 2.01 0.02 . 2 . . . . . 3 Q HB2 . 50579 1
14 . 1 . 1 3 3 GLN HG2 H 1 2.384 0.02 . 2 . . . . . 3 Q HG1 . 50579 1
15 . 1 . 1 3 3 GLN HG3 H 1 2.384 0.02 . 2 . . . . . 3 Q HG2 . 50579 1
16 . 1 . 1 3 3 GLN C C 13 175.691 0.3 . 1 . . . . . 3 Q C . 50579 1
17 . 1 . 1 3 3 GLN CA C 13 55.79 0.3 . 1 . . . . . 3 Q CA . 50579 1
18 . 1 . 1 3 3 GLN CB C 13 29.63 0.3 . 1 . . . . . 3 Q CB . 50579 1
19 . 1 . 1 3 3 GLN CG C 13 33.998 0.3 . 1 . . . . . 3 Q CG . 50579 1
20 . 1 . 1 3 3 GLN N N 15 124.22 0.3 . 1 . . . . . 3 Q N . 50579 1
21 . 1 . 1 4 4 THR H H 1 8.521 0.02 . 1 . . . . . 4 T HN . 50579 1
22 . 1 . 1 4 4 THR HA H 1 4.464 0.02 . 1 . . . . . 4 T HA . 50579 1
23 . 1 . 1 4 4 THR HB H 1 4.281 0.02 . 1 . . . . . 4 T HB . 50579 1
24 . 1 . 1 4 4 THR HG21 H 1 1.219 0.02 . 1 . . . . . 4 T HG21 . 50579 1
25 . 1 . 1 4 4 THR HG22 H 1 1.219 0.02 . 1 . . . . . 4 T HG21 . 50579 1
26 . 1 . 1 4 4 THR HG23 H 1 1.219 0.02 . 1 . . . . . 4 T HG21 . 50579 1
27 . 1 . 1 4 4 THR C C 13 174.578 0.3 . 1 . . . . . 4 T C . 50579 1
28 . 1 . 1 4 4 THR CA C 13 61.8 0.3 . 1 . . . . . 4 T CA . 50579 1
29 . 1 . 1 4 4 THR CB C 13 70.17 0.3 . 1 . . . . . 4 T CB . 50579 1
30 . 1 . 1 4 4 THR CG2 C 13 21.661 0.3 . 1 . . . . . 4 T CG2 . 50579 1
31 . 1 . 1 4 4 THR N N 15 117.18 0.3 . 1 . . . . . 4 T N . 50579 1
32 . 1 . 1 5 5 THR H H 1 8.286 0.02 . 1 . . . . . 5 T HN . 50579 1
33 . 1 . 1 5 5 THR HA H 1 4.483 0.02 . 1 . . . . . 5 T HA . 50579 1
34 . 1 . 1 5 5 THR HB H 1 4.274 0.02 . 1 . . . . . 5 T HB . 50579 1
35 . 1 . 1 5 5 THR HG21 H 1 1.216 0.02 . 1 . . . . . 5 T HG21 . 50579 1
36 . 1 . 1 5 5 THR HG22 H 1 1.216 0.02 . 1 . . . . . 5 T HG21 . 50579 1
37 . 1 . 1 5 5 THR HG23 H 1 1.216 0.02 . 1 . . . . . 5 T HG21 . 50579 1
38 . 1 . 1 5 5 THR C C 13 174.384 0.3 . 1 . . . . . 5 T C . 50579 1
39 . 1 . 1 5 5 THR CA C 13 62.17 0.3 . 1 . . . . . 5 T CA . 50579 1
40 . 1 . 1 5 5 THR CB C 13 69.92 0.3 . 1 . . . . . 5 T CB . 50579 1
41 . 1 . 1 5 5 THR CG2 C 13 21.781 0.3 . 1 . . . . . 5 T CG2 . 50579 1
42 . 1 . 1 5 5 THR N N 15 116.09 0.3 . 1 . . . . . 5 T N . 50579 1
43 . 1 . 1 6 6 SER H H 1 8.425 0.02 . 1 . . . . . 6 S HN . 50579 1
44 . 1 . 1 6 6 SER HA H 1 4.525 0.02 . 1 . . . . . 6 S HA . 50579 1
45 . 1 . 1 6 6 SER HB2 H 1 3.856 0.02 . 2 . . . . . 6 S HB1 . 50579 1
46 . 1 . 1 6 6 SER HB3 H 1 3.891 0.02 . 2 . . . . . 6 S HB2 . 50579 1
47 . 1 . 1 6 6 SER C C 13 176.32 0.3 . 1 . . . . . 6 S C . 50579 1
48 . 1 . 1 6 6 SER CA C 13 58.323 0.3 . 1 . . . . . 6 S CA . 50579 1
49 . 1 . 1 6 6 SER CB C 13 64.14 0.3 . 1 . . . . . 6 S CB . 50579 1
50 . 1 . 1 6 6 SER N N 15 118 0.3 . 1 . . . . . 6 S N . 50579 1
51 . 1 . 1 7 7 ASP H H 1 8.408 0.02 . 1 . . . . . 7 D HN . 50579 1
52 . 1 . 1 7 7 ASP HA H 1 4.607 0.02 . 1 . . . . . 7 D HA . 50579 1
53 . 1 . 1 7 7 ASP HB2 H 1 2.605 0.02 . 2 . . . . . 7 D HB1 . 50579 1
54 . 1 . 1 7 7 ASP HB3 H 1 2.723 0.02 . 2 . . . . . 7 D HB2 . 50579 1
55 . 1 . 1 7 7 ASP C C 13 176.126 0.3 . 1 . . . . . 7 D C . 50579 1
56 . 1 . 1 7 7 ASP CA C 13 54.7 0.3 . 1 . . . . . 7 D CA . 50579 1
57 . 1 . 1 7 7 ASP CB C 13 41.24 0.3 . 1 . . . . . 7 D CB . 50579 1
58 . 1 . 1 7 7 ASP N N 15 122.35 0.3 . 1 . . . . . 7 D N . 50579 1
59 . 1 . 1 8 8 ILE H H 1 7.983 0.02 . 1 . . . . . 8 I HN . 50579 1
60 . 1 . 1 8 8 ILE HA H 1 4.133 0.02 . 1 . . . . . 8 I HA . 50579 1
61 . 1 . 1 8 8 ILE HB H 1 1.806 0.02 . 1 . . . . . 8 I HB . 50579 1
62 . 1 . 1 8 8 ILE HG12 H 1 1.438 0.02 . 1 . . . . . 8 I HG11 . 50579 1
63 . 1 . 1 8 8 ILE HG13 H 1 1.438 0.02 . 1 . . . . . 8 I HG12 . 50579 1
64 . 1 . 1 8 8 ILE HG21 H 1 1.096 0.02 . 1 . . . . . 8 I HG21 . 50579 1
65 . 1 . 1 8 8 ILE HG22 H 1 1.096 0.02 . 1 . . . . . 8 I HG21 . 50579 1
66 . 1 . 1 8 8 ILE HG23 H 1 1.096 0.02 . 1 . . . . . 8 I HG21 . 50579 1
67 . 1 . 1 8 8 ILE HD11 H 1 0.814 0.02 . 1 . . . . . 8 I HD11 . 50579 1
68 . 1 . 1 8 8 ILE HD12 H 1 0.814 0.02 . 1 . . . . . 8 I HD11 . 50579 1
69 . 1 . 1 8 8 ILE HD13 H 1 0.814 0.02 . 1 . . . . . 8 I HD11 . 50579 1
70 . 1 . 1 8 8 ILE C C 13 175.691 0.3 . 1 . . . . . 8 I C . 50579 1
71 . 1 . 1 8 8 ILE CA C 13 61.55 0.3 . 1 . . . . . 8 I CA . 50579 1
72 . 1 . 1 8 8 ILE CB C 13 39.27 0.3 . 1 . . . . . 8 I CB . 50579 1
73 . 1 . 1 8 8 ILE CG1 C 13 27.051 0.3 . 1 . . . . . 8 I CG1 . 50579 1
74 . 1 . 1 8 8 ILE CG2 C 13 17.829 0.3 . 1 . . . . . 8 I CG2 . 50579 1
75 . 1 . 1 8 8 ILE CD1 C 13 13.213 0.3 . 1 . . . . . 8 I CD1 . 50579 1
76 . 1 . 1 8 8 ILE N N 15 119.25 0.3 . 1 . . . . . 8 I N . 50579 1
77 . 1 . 1 9 9 ASP H H 1 8.312 0.02 . 1 . . . . . 9 D HN . 50579 1
78 . 1 . 1 9 9 ASP HA H 1 4.629 0.02 . 1 . . . . . 9 D HA . 50579 1
79 . 1 . 1 9 9 ASP HB2 H 1 2.591 0.02 . 2 . . . . . 9 D HB1 . 50579 1
80 . 1 . 1 9 9 ASP HB3 H 1 2.665 0.02 . 2 . . . . . 9 D HB2 . 50579 1
81 . 1 . 1 9 9 ASP C C 13 175.981 0.3 . 1 . . . . . 9 D C . 50579 1
82 . 1 . 1 9 9 ASP CA C 13 54.65 0.3 . 1 . . . . . 9 D CA . 50579 1
83 . 1 . 1 9 9 ASP CB C 13 41.11 0.3 . 1 . . . . . 9 D CB . 50579 1
84 . 1 . 1 9 9 ASP N N 15 123.73 0.3 . 1 . . . . . 9 D N . 50579 1
85 . 1 . 1 10 10 ILE H H 1 7.888 0.02 . 1 . . . . . 10 I HN . 50579 1
86 . 1 . 1 10 10 ILE HA H 1 4.115 0.02 . 1 . . . . . 10 I HA . 50579 1
87 . 1 . 1 10 10 ILE HB H 1 1.789 0.02 . 1 . . . . . 10 I HB . 50579 1
88 . 1 . 1 10 10 ILE HG12 H 1 1.339 0.02 . 1 . . . . . 10 I HG11 . 50579 1
89 . 1 . 1 10 10 ILE HG13 H 1 1.339 0.02 . 1 . . . . . 10 I HG12 . 50579 1
90 . 1 . 1 10 10 ILE HG21 H 1 1.078 0.02 . 1 . . . . . 10 I HG21 . 50579 1
91 . 1 . 1 10 10 ILE HG22 H 1 1.078 0.02 . 1 . . . . . 10 I HG21 . 50579 1
92 . 1 . 1 10 10 ILE HG23 H 1 1.078 0.02 . 1 . . . . . 10 I HG21 . 50579 1
93 . 1 . 1 10 10 ILE HD11 H 1 0.823 0.02 . 1 . . . . . 10 I HD11 . 50579 1
94 . 1 . 1 10 10 ILE HD12 H 1 0.823 0.02 . 1 . . . . . 10 I HD11 . 50579 1
95 . 1 . 1 10 10 ILE HD13 H 1 0.823 0.02 . 1 . . . . . 10 I HD11 . 50579 1
96 . 1 . 1 10 10 ILE C C 13 175.933 0.3 . 1 . . . . . 10 I C . 50579 1
97 . 1 . 1 10 10 ILE CA C 13 61.31 0.3 . 1 . . . . . 10 I CA . 50579 1
98 . 1 . 1 10 10 ILE CB C 13 38.9 0.3 . 1 . . . . . 10 I CB . 50579 1
99 . 1 . 1 10 10 ILE CG1 C 13 27.051 0.3 . 1 . . . . . 10 I CG1 . 50579 1
100 . 1 . 1 10 10 ILE CG2 C 13 17.72 0.3 . 1 . . . . . 10 I CG2 . 50579 1
101 . 1 . 1 10 10 ILE CD1 C 13 13.298 0.3 . 1 . . . . . 10 I CD1 . 50579 1
102 . 1 . 1 10 10 ILE N N 15 119.62 0.3 . 1 . . . . . 10 I N . 50579 1
103 . 1 . 1 11 11 LEU H H 1 8.12 0.02 . 1 . . . . . 11 L HN . 50579 1
104 . 1 . 1 11 11 LEU HA H 1 4.361 0.02 . 1 . . . . . 11 L HA . 50579 1
105 . 1 . 1 11 11 LEU HB2 H 1 1.513 0.02 . 2 . . . . . 11 L HB1 . 50579 1
106 . 1 . 1 11 11 LEU HB3 H 1 1.618 0.02 . 2 . . . . . 11 L HB2 . 50579 1
107 . 1 . 1 11 11 LEU HG H 1 1.337 0.02 . 1 . . . . . 11 L HG . 50579 1
108 . 1 . 1 11 11 LEU HD11 H 1 0.828 0.02 . 2 . . . . . 11 L HD11 . 50579 1
109 . 1 . 1 11 11 LEU HD12 H 1 0.828 0.02 . 2 . . . . . 11 L HD11 . 50579 1
110 . 1 . 1 11 11 LEU HD13 H 1 0.828 0.02 . 2 . . . . . 11 L HD11 . 50579 1
111 . 1 . 1 11 11 LEU HD21 H 1 0.871 0.02 . 2 . . . . . 11 L HD21 . 50579 1
112 . 1 . 1 11 11 LEU HD22 H 1 0.871 0.02 . 2 . . . . . 11 L HD21 . 50579 1
113 . 1 . 1 11 11 LEU HD23 H 1 0.871 0.02 . 2 . . . . . 11 L HD21 . 50579 1
114 . 1 . 1 11 11 LEU C C 13 174.19 0.3 . 1 . . . . . 11 L C . 50579 1
115 . 1 . 1 11 11 LEU CA C 13 55.03 0.3 . 1 . . . . . 11 L CA . 50579 1
116 . 1 . 1 11 11 LEU CB C 13 42.1 0.3 . 1 . . . . . 11 L CB . 50579 1
117 . 1 . 1 11 11 LEU CG C 13 24.734 0.3 . 1 . . . . . 11 L CG . 50579 1
118 . 1 . 1 11 11 LEU CD1 C 13 23.31 0.3 . 2 . . . . . 11 L CD1 . 50579 1
119 . 1 . 1 11 11 LEU CD2 C 13 24.536 0.3 . 2 . . . . . 11 L CD2 . 50579 1
120 . 1 . 1 11 11 LEU N N 15 124.81 0.3 . 1 . . . . . 11 L N . 50579 1
121 . 1 . 1 12 12 ASP H H 1 8.415 0.02 . 1 . . . . . 12 D HN . 50579 1
122 . 1 . 1 12 12 ASP HA H 1 4.621 0.02 . 1 . . . . . 12 D HA . 50579 1
123 . 1 . 1 12 12 ASP HB2 H 1 2.811 0.02 . 2 . . . . . 12 D HB1 . 50579 1
124 . 1 . 1 12 12 ASP HB3 H 1 2.718 0.02 . 2 . . . . . 12 D HB2 . 50579 1
125 . 1 . 1 12 12 ASP CA C 13 54.592 0.3 . 1 . . . . . 12 D CA . 50579 1
126 . 1 . 1 12 12 ASP CB C 13 41.546 0.3 . 1 . . . . . 12 D CB . 50579 1
127 . 1 . 1 12 12 ASP N N 15 122.75 0.3 . 1 . . . . . 12 D N . 50579 1
128 . 1 . 1 13 13 ASP H H 1 8.563 0.02 . 1 . . . . . 13 D HN . 50579 1
129 . 1 . 1 13 13 ASP HA H 1 4.734 0.02 . 1 . . . . . 13 D HA . 50579 1
130 . 1 . 1 13 13 ASP HB2 H 1 2.606 0.02 . 2 . . . . . 13 D HB1 . 50579 1
131 . 1 . 1 13 13 ASP HB3 H 1 2.692 0.02 . 2 . . . . . 13 D HB2 . 50579 1
132 . 1 . 1 13 13 ASP C C 13 176.175 0.3 . 1 . . . . . 13 D C . 50579 1
133 . 1 . 1 13 13 ASP CA C 13 52.991 0.3 . 1 . . . . . 13 D CA . 50579 1
134 . 1 . 1 13 13 ASP CB C 13 41.298 0.3 . 1 . . . . . 13 D CB . 50579 1
135 . 1 . 1 13 13 ASP N N 15 124.46 0.3 . 1 . . . . . 13 D N . 50579 1
136 . 1 . 1 14 14 GLY H H 1 8.529 0.02 . 1 . . . . . 14 G HN . 50579 1
137 . 1 . 1 14 14 GLY HA2 H 1 3.504 0.02 . 2 . . . . . 14 G HA1 . 50579 1
138 . 1 . 1 14 14 GLY HA3 H 1 4.017 0.02 . 2 . . . . . 14 G HA2 . 50579 1
139 . 1 . 1 14 14 GLY C C 13 173.416 0.3 . 1 . . . . . 14 G C . 50579 1
140 . 1 . 1 14 14 GLY CA C 13 45.3 0.3 . 1 . . . . . 14 G CA . 50579 1
141 . 1 . 1 14 14 GLY N N 15 108.17 0.3 . 1 . . . . . 14 G N . 50579 1
142 . 1 . 1 15 15 TYR H H 1 8.074 0.02 . 1 . . . . . 15 Y HN . 50579 1
143 . 1 . 1 15 15 TYR HA H 1 4.371 0.02 . 1 . . . . . 15 Y HA . 50579 1
144 . 1 . 1 15 15 TYR HB2 H 1 2.847 0.02 . 2 . . . . . 15 Y HB1 . 50579 1
145 . 1 . 1 15 15 TYR HB3 H 1 2.383 0.02 . 2 . . . . . 15 Y HB2 . 50579 1
146 . 1 . 1 15 15 TYR C C 13 173.978 0.3 . 1 . . . . . 15 Y C . 50579 1
147 . 1 . 1 15 15 TYR CA C 13 57.7 0.3 . 1 . . . . . 15 Y CA . 50579 1
148 . 1 . 1 15 15 TYR CB C 13 39.929 0.3 . 1 . . . . . 15 Y CB . 50579 1
149 . 1 . 1 15 15 TYR N N 15 117.96 0.3 . 1 . . . . . 15 Y N . 50579 1
150 . 1 . 1 16 16 ARG H H 1 8.841 0.02 . 1 . . . . . 16 R HN . 50579 1
151 . 1 . 1 16 16 ARG HA H 1 4.757 0.02 . 1 . . . . . 16 R HA . 50579 1
152 . 1 . 1 16 16 ARG HB2 H 1 1.652 0.02 . 2 . . . . . 16 R HB1 . 50579 1
153 . 1 . 1 16 16 ARG HB3 H 1 1.652 0.02 . 2 . . . . . 16 R HB2 . 50579 1
154 . 1 . 1 16 16 ARG HG2 H 1 1.511 0.02 . 2 . . . . . 16 R HG1 . 50579 1
155 . 1 . 1 16 16 ARG HG3 H 1 1.511 0.02 . 2 . . . . . 16 R HG2 . 50579 1
156 . 1 . 1 16 16 ARG HD2 H 1 3.096 0.02 . 2 . . . . . 16 R HD1 . 50579 1
157 . 1 . 1 16 16 ARG HD3 H 1 3.158 0.02 . 2 . . . . . 16 R HD2 . 50579 1
158 . 1 . 1 16 16 ARG C C 13 174.771 0.3 . 1 . . . . . 16 R C . 50579 1
159 . 1 . 1 16 16 ARG CA C 13 54.91 0.3 . 1 . . . . . 16 R CA . 50579 1
160 . 1 . 1 16 16 ARG CB C 13 31.9 0.3 . 1 . . . . . 16 R CB . 50579 1
161 . 1 . 1 16 16 ARG CG C 13 27.768 0.3 . 1 . . . . . 16 R CG . 50579 1
162 . 1 . 1 16 16 ARG CD C 13 43.34 0.3 . 1 . . . . . 16 R CD . 50579 1
163 . 1 . 1 16 16 ARG N N 15 120.92 0.3 . 1 . . . . . 16 R N . 50579 1
164 . 1 . 1 17 17 TRP H H 1 8.27 0.02 . 1 . . . . . 17 W HN . 50579 1
165 . 1 . 1 17 17 TRP HA H 1 5.504 0.02 . 1 . . . . . 17 W HA . 50579 1
166 . 1 . 1 17 17 TRP HB2 H 1 2.883 0.02 . 2 . . . . . 17 W HB1 . 50579 1
167 . 1 . 1 17 17 TRP HB3 H 1 3.299 0.02 . 2 . . . . . 17 W HB2 . 50579 1
168 . 1 . 1 17 17 TRP C C 13 176.32 0.3 . 1 . . . . . 17 W C . 50579 1
169 . 1 . 1 17 17 TRP CA C 13 55.938 0.3 . 1 . . . . . 17 W CA . 50579 1
170 . 1 . 1 17 17 TRP CB C 13 34.59 0.3 . 1 . . . . . 17 W CB . 50579 1
171 . 1 . 1 17 17 TRP N N 15 120.12 0.3 . 1 . . . . . 17 W N . 50579 1
172 . 1 . 1 18 18 ARG H H 1 9.427 0.02 . 1 . . . . . 18 R HN . 50579 1
173 . 1 . 1 18 18 ARG HA H 1 5.045 0.02 . 1 . . . . . 18 R HA . 50579 1
174 . 1 . 1 18 18 ARG HB2 H 1 1.865 0.02 . 2 . . . . . 18 R HB1 . 50579 1
175 . 1 . 1 18 18 ARG HB3 H 1 1.865 0.02 . 2 . . . . . 18 R HB2 . 50579 1
176 . 1 . 1 18 18 ARG HG2 H 1 1.644 0.02 . 2 . . . . . 18 R HG1 . 50579 1
177 . 1 . 1 18 18 ARG HG3 H 1 1.723 0.02 . 2 . . . . . 18 R HG2 . 50579 1
178 . 1 . 1 18 18 ARG HD2 H 1 3.296 0.02 . 2 . . . . . 18 R HD1 . 50579 1
179 . 1 . 1 18 18 ARG HD3 H 1 3.296 0.02 . 2 . . . . . 18 R HD2 . 50579 1
180 . 1 . 1 18 18 ARG C C 13 175.546 0.3 . 1 . . . . . 18 R C . 50579 1
181 . 1 . 1 18 18 ARG CA C 13 54.492 0.3 . 1 . . . . . 18 R CA . 50579 1
182 . 1 . 1 18 18 ARG CB C 13 33.485 0.3 . 1 . . . . . 18 R CB . 50579 1
183 . 1 . 1 18 18 ARG CG C 13 27.313 0.3 . 1 . . . . . 18 R CG . 50579 1
184 . 1 . 1 18 18 ARG CD C 13 43.7 0.3 . 1 . . . . . 18 R CD . 50579 1
185 . 1 . 1 18 18 ARG N N 15 121.56 0.3 . 1 . . . . . 18 R N . 50579 1
186 . 1 . 1 19 19 LYS H H 1 9.32 0.02 . 1 . . . . . 19 K HN . 50579 1
187 . 1 . 1 19 19 LYS HA H 1 4.274 0.02 . 1 . . . . . 19 K HA . 50579 1
188 . 1 . 1 19 19 LYS HB2 H 1 1.624 0.02 . 2 . . . . . 19 K HB1 . 50579 1
189 . 1 . 1 19 19 LYS HB3 H 1 1.786 0.02 . 2 . . . . . 19 K HB2 . 50579 1
190 . 1 . 1 19 19 LYS HG2 H 1 1.131 0.02 . 2 . . . . . 19 K HG1 . 50579 1
191 . 1 . 1 19 19 LYS HG3 H 1 0.895 0.02 . 2 . . . . . 19 K HG2 . 50579 1
192 . 1 . 1 19 19 LYS HD2 H 1 1.512 0.02 . 2 . . . . . 19 K HD1 . 50579 1
193 . 1 . 1 19 19 LYS HD3 H 1 1.593 0.02 . 2 . . . . . 19 K HD2 . 50579 1
194 . 1 . 1 19 19 LYS HE2 H 1 2.845 0.02 . 2 . . . . . 19 K HE1 . 50579 1
195 . 1 . 1 19 19 LYS HE3 H 1 2.845 0.02 . 2 . . . . . 19 K HE2 . 50579 1
196 . 1 . 1 19 19 LYS C C 13 176.512 0.3 . 1 . . . . . 19 K C . 50579 1
197 . 1 . 1 19 19 LYS CA C 13 57.12 0.3 . 1 . . . . . 19 K CA . 50579 1
198 . 1 . 1 19 19 LYS CB C 13 33.23 0.3 . 1 . . . . . 19 K CB . 50579 1
199 . 1 . 1 19 19 LYS CG C 13 24.949 0.3 . 1 . . . . . 19 K CG . 50579 1
200 . 1 . 1 19 19 LYS CD C 13 27.536 0.3 . 1 . . . . . 19 K CD . 50579 1
201 . 1 . 1 19 19 LYS CE C 13 42.125 0.3 . 1 . . . . . 19 K CE . 50579 1
202 . 1 . 1 19 19 LYS N N 15 130.298 0.3 . 1 . . . . . 19 K N . 50579 1
203 . 1 . 1 20 20 TYR H H 1 8.887 0.02 . 1 . . . . . 20 Y HN . 50579 1
204 . 1 . 1 20 20 TYR HA H 1 5.009 0.02 . 1 . . . . . 20 Y HA . 50579 1
205 . 1 . 1 20 20 TYR HB2 H 1 3.119 0.02 . 2 . . . . . 20 Y HB1 . 50579 1
206 . 1 . 1 20 20 TYR HB3 H 1 2.678 0.02 . 2 . . . . . 20 Y HB2 . 50579 1
207 . 1 . 1 20 20 TYR C C 13 174.384 0.3 . 1 . . . . . 20 Y C . 50579 1
208 . 1 . 1 20 20 TYR CA C 13 56.73 0.3 . 1 . . . . . 20 Y CA . 50579 1
209 . 1 . 1 20 20 TYR CB C 13 40.34 0.3 . 1 . . . . . 20 Y CB . 50579 1
210 . 1 . 1 20 20 TYR N N 15 124.1 0.3 . 1 . . . . . 20 Y N . 50579 1
211 . 1 . 1 21 21 GLY H H 1 7.503 0.02 . 1 . . . . . 21 G HN . 50579 1
212 . 1 . 1 21 21 GLY HA2 H 1 3.832 0.02 . 2 . . . . . 21 G HA1 . 50579 1
213 . 1 . 1 21 21 GLY HA3 H 1 4.12 0.02 . 2 . . . . . 21 G HA2 . 50579 1
214 . 1 . 1 21 21 GLY CA C 13 45.3 0.3 . 1 . . . . . 21 G CA . 50579 1
215 . 1 . 1 21 21 GLY N N 15 108.93 0.3 . 1 . . . . . 21 G N . 50579 1
216 . 1 . 1 22 22 GLN H H 1 8.325 0.02 . 1 . . . . . 22 Q HN . 50579 1
217 . 1 . 1 22 22 GLN HA H 1 5.124 0.02 . 1 . . . . . 22 Q HA . 50579 1
218 . 1 . 1 22 22 GLN HB2 H 1 1.978 0.02 . 2 . . . . . 22 Q HB1 . 50579 1
219 . 1 . 1 22 22 GLN HB3 H 1 1.877 0.02 . 2 . . . . . 22 Q HB2 . 50579 1
220 . 1 . 1 22 22 GLN HG2 H 1 2.177 0.02 . 2 . . . . . 22 Q HG1 . 50579 1
221 . 1 . 1 22 22 GLN HG3 H 1 2.177 0.02 . 2 . . . . . 22 Q HG2 . 50579 1
222 . 1 . 1 22 22 GLN C C 13 174.529 0.3 . 1 . . . . . 22 Q C . 50579 1
223 . 1 . 1 22 22 GLN CA C 13 55.27 0.3 . 1 . . . . . 22 Q CA . 50579 1
224 . 1 . 1 22 22 GLN CB C 13 31.88 0.3 . 1 . . . . . 22 Q CB . 50579 1
225 . 1 . 1 22 22 GLN CG C 13 33.655 0.3 . 1 . . . . . 22 Q CG . 50579 1
226 . 1 . 1 22 22 GLN N N 15 118.67 0.3 . 1 . . . . . 22 Q N . 50579 1
227 . 1 . 1 23 23 LYS H H 1 8.855 0.02 . 1 . . . . . 23 K HN . 50579 1
228 . 1 . 1 23 23 LYS HA H 1 4.588 0.02 . 1 . . . . . 23 K HA . 50579 1
229 . 1 . 1 23 23 LYS HB2 H 1 1.722 0.02 . 2 . . . . . 23 K HB1 . 50579 1
230 . 1 . 1 23 23 LYS HB3 H 1 1.82 0.02 . 2 . . . . . 23 K HB2 . 50579 1
231 . 1 . 1 23 23 LYS HG2 H 1 1.339 0.02 . 2 . . . . . 23 K HG1 . 50579 1
232 . 1 . 1 23 23 LYS HG3 H 1 1.339 0.02 . 2 . . . . . 23 K HG2 . 50579 1
233 . 1 . 1 23 23 LYS HD2 H 1 1.616 0.02 . 2 . . . . . 23 K HD1 . 50579 1
234 . 1 . 1 23 23 LYS HD3 H 1 1.616 0.02 . 2 . . . . . 23 K HD2 . 50579 1
235 . 1 . 1 23 23 LYS HE2 H 1 2.871 0.02 . 2 . . . . . 23 K HE1 . 50579 1
236 . 1 . 1 23 23 LYS HE3 H 1 2.871 0.02 . 2 . . . . . 23 K HE2 . 50579 1
237 . 1 . 1 23 23 LYS C C 13 175.013 0.3 . 1 . . . . . 23 K C . 50579 1
238 . 1 . 1 23 23 LYS CA C 13 55.831 0.3 . 1 . . . . . 23 K CA . 50579 1
239 . 1 . 1 23 23 LYS CB C 13 35.788 0.3 . 1 . . . . . 23 K CB . 50579 1
240 . 1 . 1 23 23 LYS CG C 13 24.729 0.3 . 1 . . . . . 23 K CG . 50579 1
241 . 1 . 1 23 23 LYS CD C 13 29.227 0.3 . 1 . . . . . 23 K CD . 50579 1
242 . 1 . 1 23 23 LYS CE C 13 42.134 0.3 . 1 . . . . . 23 K CE . 50579 1
243 . 1 . 1 23 23 LYS N N 15 122.87 0.3 . 1 . . . . . 23 K N . 50579 1
244 . 1 . 1 24 24 VAL H H 1 8.443 0.02 . 1 . . . . . 24 V HN . 50579 1
245 . 1 . 1 24 24 VAL HA H 1 4.201 0.02 . 1 . . . . . 24 V HA . 50579 1
246 . 1 . 1 24 24 VAL HB H 1 1.962 0.02 . 1 . . . . . 24 V HB . 50579 1
247 . 1 . 1 24 24 VAL HG11 H 1 0.893 0.02 . 2 . . . . . 24 V HG11 . 50579 1
248 . 1 . 1 24 24 VAL HG12 H 1 0.893 0.02 . 2 . . . . . 24 V HG11 . 50579 1
249 . 1 . 1 24 24 VAL HG13 H 1 0.893 0.02 . 2 . . . . . 24 V HG11 . 50579 1
250 . 1 . 1 24 24 VAL CA C 13 62.42 0.3 . 1 . . . . . 24 V CA . 50579 1
251 . 1 . 1 24 24 VAL CB C 13 32.62 0.3 . 1 . . . . . 24 V CB . 50579 1
252 . 1 . 1 24 24 VAL CG1 C 13 21.302 0.3 . 1 . . . . . 24 V CG1 . 50579 1
253 . 1 . 1 24 24 VAL N N 15 123.66 0.3 . 1 . . . . . 24 V N . 50579 1
254 . 1 . 1 25 25 VAL H H 1 9.037 0.02 . 1 . . . . . 25 V HN . 50579 1
255 . 1 . 1 25 25 VAL HA H 1 4.212 0.02 . 1 . . . . . 25 V HA . 50579 1
256 . 1 . 1 25 25 VAL HB H 1 2.037 0.02 . 1 . . . . . 25 V HB . 50579 1
257 . 1 . 1 25 25 VAL HG11 H 1 0.896 0.02 . 2 . . . . . 25 V HG11 . 50579 1
258 . 1 . 1 25 25 VAL HG12 H 1 0.896 0.02 . 2 . . . . . 25 V HG11 . 50579 1
259 . 1 . 1 25 25 VAL HG13 H 1 0.896 0.02 . 2 . . . . . 25 V HG11 . 50579 1
260 . 1 . 1 25 25 VAL HG21 H 1 0.896 0.02 . 2 . . . . . 25 V HG21 . 50579 1
261 . 1 . 1 25 25 VAL HG22 H 1 0.896 0.02 . 2 . . . . . 25 V HG21 . 50579 1
262 . 1 . 1 25 25 VAL HG23 H 1 0.896 0.02 . 2 . . . . . 25 V HG21 . 50579 1
263 . 1 . 1 25 25 VAL C C 13 175.594 0.3 . 1 . . . . . 25 V C . 50579 1
264 . 1 . 1 25 25 VAL CA C 13 61.02 0.3 . 1 . . . . . 25 V CA . 50579 1
265 . 1 . 1 25 25 VAL CB C 13 33.5 0.3 . 1 . . . . . 25 V CB . 50579 1
266 . 1 . 1 25 25 VAL CG1 C 13 21.063 0.3 . 1 . . . . . 25 V CG1 . 50579 1
267 . 1 . 1 25 25 VAL CG2 C 13 21.063 0.3 . 1 . . . . . 25 V CG2 . 50579 1
268 . 1 . 1 25 25 VAL N N 15 128.02 0.3 . 1 . . . . . 25 V N . 50579 1
269 . 1 . 1 26 26 LYS H H 1 8.423 0.02 . 1 . . . . . 26 K HN . 50579 1
270 . 1 . 1 26 26 LYS HA H 1 4.002 0.02 . 1 . . . . . 26 K HA . 50579 1
271 . 1 . 1 26 26 LYS HB2 H 1 1.779 0.02 . 2 . . . . . 26 K HB1 . 50579 1
272 . 1 . 1 26 26 LYS HB3 H 1 1.779 0.02 . 2 . . . . . 26 K HB2 . 50579 1
273 . 1 . 1 26 26 LYS HG2 H 1 1.342 0.02 . 2 . . . . . 26 K HG1 . 50579 1
274 . 1 . 1 26 26 LYS HG3 H 1 1.454 0.02 . 2 . . . . . 26 K HG2 . 50579 1
275 . 1 . 1 26 26 LYS HD2 H 1 1.68 0.02 . 2 . . . . . 26 K HD1 . 50579 1
276 . 1 . 1 26 26 LYS HD3 H 1 1.68 0.02 . 2 . . . . . 26 K HD2 . 50579 1
277 . 1 . 1 26 26 LYS HE2 H 1 2.983 0.02 . 2 . . . . . 26 K HE1 . 50579 1
278 . 1 . 1 26 26 LYS HE3 H 1 2.983 0.02 . 2 . . . . . 26 K HE2 . 50579 1
279 . 1 . 1 26 26 LYS C C 13 177.385 0.3 . 1 . . . . . 26 K C . 50579 1
280 . 1 . 1 26 26 LYS CA C 13 58.066 0.3 . 1 . . . . . 26 K CA . 50579 1
281 . 1 . 1 26 26 LYS CB C 13 32.157 0.3 . 1 . . . . . 26 K CB . 50579 1
282 . 1 . 1 26 26 LYS CG C 13 24.813 0.3 . 1 . . . . . 26 K CG . 50579 1
283 . 1 . 1 26 26 LYS CD C 13 29.566 0.3 . 1 . . . . . 26 K CD . 50579 1
284 . 1 . 1 26 26 LYS CE C 13 42.143 0.3 . 1 . . . . . 26 K CE . 50579 1
285 . 1 . 1 26 26 LYS N N 15 125.56 0.3 . 1 . . . . . 26 K N . 50579 1
286 . 1 . 1 27 27 GLY H H 1 8.645 0.02 . 1 . . . . . 27 G HN . 50579 1
287 . 1 . 1 27 27 GLY HA2 H 1 3.67 0.02 . 2 . . . . . 27 G HA1 . 50579 1
288 . 1 . 1 27 27 GLY HA3 H 1 4.226 0.02 . 2 . . . . . 27 G HA2 . 50579 1
289 . 1 . 1 27 27 GLY C C 13 173.513 0.3 . 1 . . . . . 27 G C . 50579 1
290 . 1 . 1 27 27 GLY CA C 13 45.18 0.3 . 1 . . . . . 27 G CA . 50579 1
291 . 1 . 1 27 27 GLY N N 15 112.5 0.3 . 1 . . . . . 27 G N . 50579 1
292 . 1 . 1 28 28 ASN H H 1 7.815 0.02 . 1 . . . . . 28 N HN . 50579 1
293 . 1 . 1 28 28 ASN HA H 1 5.119 0.02 . 1 . . . . . 28 N HA . 50579 1
294 . 1 . 1 28 28 ASN HB2 H 1 2.694 0.02 . 2 . . . . . 28 N HB1 . 50579 1
295 . 1 . 1 28 28 ASN HB3 H 1 3.064 0.02 . 2 . . . . . 28 N HB2 . 50579 1
296 . 1 . 1 28 28 ASN CA C 13 50.1 0.3 . 1 . . . . . 28 N CA . 50579 1
297 . 1 . 1 28 28 ASN CB C 13 40.25 0.3 . 1 . . . . . 28 N CB . 50579 1
298 . 1 . 1 28 28 ASN N N 15 119.34 0.3 . 1 . . . . . 28 N N . 50579 1
299 . 1 . 1 29 29 PRO HA H 1 4.425 0.02 . 1 . . . . . 29 P HA . 50579 1
300 . 1 . 1 29 29 PRO HB2 H 1 2.254 0.02 . 2 . . . . . 29 P HB1 . 50579 1
301 . 1 . 1 29 29 PRO HB3 H 1 1.957 0.02 . 2 . . . . . 29 P HB2 . 50579 1
302 . 1 . 1 29 29 PRO HG2 H 1 1.93 0.02 . 2 . . . . . 29 P HG1 . 50579 1
303 . 1 . 1 29 29 PRO HG3 H 1 2.024 0.02 . 2 . . . . . 29 P HG2 . 50579 1
304 . 1 . 1 29 29 PRO HD2 H 1 3.92 0.02 . 2 . . . . . 29 P HD1 . 50579 1
305 . 1 . 1 29 29 PRO HD3 H 1 3.734 0.02 . 2 . . . . . 29 P HD2 . 50579 1
306 . 1 . 1 29 29 PRO C C 13 176.32 0.3 . 1 . . . . . 29 P C . 50579 1
307 . 1 . 1 29 29 PRO CA C 13 63.65 0.3 . 1 . . . . . 29 P CA . 50579 1
308 . 1 . 1 29 29 PRO CB C 13 32.25 0.3 . 1 . . . . . 29 P CB . 50579 1
309 . 1 . 1 29 29 PRO CG C 13 26.692 0.3 . 1 . . . . . 29 P CG . 50579 1
310 . 1 . 1 29 29 PRO CD C 13 50.651 0.3 . 1 . . . . . 29 P CD . 50579 1
311 . 1 . 1 30 30 ASN H H 1 8.225 0.02 . 1 . . . . . 30 N HN . 50579 1
312 . 1 . 1 30 30 ASN HA H 1 5.004 0.02 . 1 . . . . . 30 N HA . 50579 1
313 . 1 . 1 30 30 ASN HB2 H 1 2.854 0.02 . 2 . . . . . 30 N HB1 . 50579 1
314 . 1 . 1 30 30 ASN HB3 H 1 2.775 0.02 . 2 . . . . . 30 N HB2 . 50579 1
315 . 1 . 1 30 30 ASN CA C 13 50.514 0.3 . 1 . . . . . 30 N CA . 50579 1
316 . 1 . 1 30 30 ASN CB C 13 39.14 0.3 . 1 . . . . . 30 N CB . 50579 1
317 . 1 . 1 30 30 ASN N N 15 119.15 0.3 . 1 . . . . . 30 N N . 50579 1
318 . 1 . 1 31 31 PRO HA H 1 4.403 0.02 . 1 . . . . . 31 P HA . 50579 1
319 . 1 . 1 31 31 PRO HB2 H 1 2.09 0.02 . 2 . . . . . 31 P HB1 . 50579 1
320 . 1 . 1 31 31 PRO HB3 H 1 1.958 0.02 . 2 . . . . . 31 P HB2 . 50579 1
321 . 1 . 1 31 31 PRO HG2 H 1 1.964 0.02 . 2 . . . . . 31 P HG1 . 50579 1
322 . 1 . 1 31 31 PRO HG3 H 1 1.964 0.02 . 2 . . . . . 31 P HG2 . 50579 1
323 . 1 . 1 31 31 PRO HD2 H 1 3.744 0.02 . 2 . . . . . 31 P HD1 . 50579 1
324 . 1 . 1 31 31 PRO HD3 H 1 3.937 0.02 . 2 . . . . . 31 P HD2 . 50579 1
325 . 1 . 1 31 31 PRO C C 13 176.12 0.3 . 1 . . . . . 31 P C . 50579 1
326 . 1 . 1 31 31 PRO CA C 13 63.03 0.3 . 1 . . . . . 31 P CA . 50579 1
327 . 1 . 1 31 31 PRO CB C 13 32.37 0.3 . 1 . . . . . 31 P CB . 50579 1
328 . 1 . 1 31 31 PRO CG C 13 27.411 0.3 . 1 . . . . . 31 P CG . 50579 1
329 . 1 . 1 31 31 PRO CD C 13 50.766 0.3 . 1 . . . . . 31 P CD . 50579 1
330 . 1 . 1 32 32 ARG H H 1 8.696 0.02 . 1 . . . . . 32 R HN . 50579 1
331 . 1 . 1 32 32 ARG HA H 1 4.838 0.02 . 1 . . . . . 32 R HA . 50579 1
332 . 1 . 1 32 32 ARG HB2 H 1 1.62 0.02 . 2 . . . . . 32 R HB1 . 50579 1
333 . 1 . 1 32 32 ARG HB3 H 1 1.764 0.02 . 2 . . . . . 32 R HB2 . 50579 1
334 . 1 . 1 32 32 ARG HG2 H 1 1.379 0.02 . 2 . . . . . 32 R HG1 . 50579 1
335 . 1 . 1 32 32 ARG HG3 H 1 1.379 0.02 . 2 . . . . . 32 R HG2 . 50579 1
336 . 1 . 1 32 32 ARG HD2 H 1 2.838 0.02 . 2 . . . . . 32 R HD1 . 50579 1
337 . 1 . 1 32 32 ARG HD3 H 1 2.838 0.02 . 2 . . . . . 32 R HD2 . 50579 1
338 . 1 . 1 32 32 ARG C C 13 175.836 0.3 . 1 . . . . . 32 R C . 50579 1
339 . 1 . 1 32 32 ARG CA C 13 55.123 0.3 . 1 . . . . . 32 R CA . 50579 1
340 . 1 . 1 32 32 ARG CB C 13 32.76 0.3 . 1 . . . . . 32 R CB . 50579 1
341 . 1 . 1 32 32 ARG CG C 13 27.051 0.3 . 1 . . . . . 32 R CG . 50579 1
342 . 1 . 1 32 32 ARG CD C 13 43.7 0.3 . 1 . . . . . 32 R CD . 50579 1
343 . 1 . 1 32 32 ARG N N 15 123.18 0.3 . 1 . . . . . 32 R N . 50579 1
344 . 1 . 1 33 33 SER H H 1 8.753 0.02 . 1 . . . . . 33 S HN . 50579 1
345 . 1 . 1 33 33 SER HA H 1 4.835 0.02 . 1 . . . . . 33 S HA . 50579 1
346 . 1 . 1 33 33 SER HB2 H 1 3.543 0.02 . 2 . . . . . 33 S HB1 . 50579 1
347 . 1 . 1 33 33 SER HB3 H 1 3.79 0.02 . 2 . . . . . 33 S HB2 . 50579 1
348 . 1 . 1 33 33 SER C C 13 172.4 0.3 . 1 . . . . . 33 S C . 50579 1
349 . 1 . 1 33 33 SER CA C 13 58.46 0.3 . 1 . . . . . 33 S CA . 50579 1
350 . 1 . 1 33 33 SER CB C 13 66 0.3 . 1 . . . . . 33 S CB . 50579 1
351 . 1 . 1 33 33 SER N N 15 120.41 0.3 . 1 . . . . . 33 S N . 50579 1
352 . 1 . 1 34 34 TYR H H 1 8.333 0.02 . 1 . . . . . 34 Y HN . 50579 1
353 . 1 . 1 34 34 TYR HA H 1 4.904 0.02 . 1 . . . . . 34 Y HA . 50579 1
354 . 1 . 1 34 34 TYR HB2 H 1 1.933 0.02 . 2 . . . . . 34 Y HB1 . 50579 1
355 . 1 . 1 34 34 TYR HB3 H 1 2.462 0.02 . 2 . . . . . 34 Y HB2 . 50579 1
356 . 1 . 1 34 34 TYR C C 13 174.045 0.3 . 1 . . . . . 34 Y C . 50579 1
357 . 1 . 1 34 34 TYR CA C 13 57.047 0.3 . 1 . . . . . 34 Y CA . 50579 1
358 . 1 . 1 34 34 TYR CB C 13 39.399 0.3 . 1 . . . . . 34 Y CB . 50579 1
359 . 1 . 1 34 34 TYR N N 15 122.31 0.3 . 1 . . . . . 34 Y N . 50579 1
360 . 1 . 1 35 35 TYR H H 1 9.422 0.02 . 1 . . . . . 35 Y HN . 50579 1
361 . 1 . 1 35 35 TYR HA H 1 5.592 0.02 . 1 . . . . . 35 Y HA . 50579 1
362 . 1 . 1 35 35 TYR HB2 H 1 3.068 0.02 . 2 . . . . . 35 Y HB1 . 50579 1
363 . 1 . 1 35 35 TYR HB3 H 1 2.631 0.02 . 2 . . . . . 35 Y HB2 . 50579 1
364 . 1 . 1 35 35 TYR C C 13 175.4 0.3 . 1 . . . . . 35 Y C . 50579 1
365 . 1 . 1 35 35 TYR CA C 13 56.75 0.3 . 1 . . . . . 35 Y CA . 50579 1
366 . 1 . 1 35 35 TYR CB C 13 43.21 0.3 . 1 . . . . . 35 Y CB . 50579 1
367 . 1 . 1 35 35 TYR N N 15 119.094 0.3 . 1 . . . . . 35 Y N . 50579 1
368 . 1 . 1 36 36 LYS H H 1 9.659 0.02 . 1 . . . . . 36 K HN . 50579 1
369 . 1 . 1 36 36 LYS HA H 1 5.535 0.02 . 1 . . . . . 36 K HA . 50579 1
370 . 1 . 1 36 36 LYS HB2 H 1 1.965 0.02 . 2 . . . . . 36 K HB1 . 50579 1
371 . 1 . 1 36 36 LYS HB3 H 1 1.965 0.02 . 2 . . . . . 36 K HB2 . 50579 1
372 . 1 . 1 36 36 LYS HG2 H 1 1.331 0.02 . 2 . . . . . 36 K HG1 . 50579 1
373 . 1 . 1 36 36 LYS HG3 H 1 1.331 0.02 . 2 . . . . . 36 K HG2 . 50579 1
374 . 1 . 1 36 36 LYS HD2 H 1 1.641 0.02 . 2 . . . . . 36 K HD1 . 50579 1
375 . 1 . 1 36 36 LYS HD3 H 1 1.512 0.02 . 2 . . . . . 36 K HD2 . 50579 1
376 . 1 . 1 36 36 LYS HE2 H 1 2.862 0.02 . 2 . . . . . 36 K HE1 . 50579 1
377 . 1 . 1 36 36 LYS HE3 H 1 2.862 0.02 . 2 . . . . . 36 K HE2 . 50579 1
378 . 1 . 1 36 36 LYS C C 13 175.062 0.3 . 1 . . . . . 36 K C . 50579 1
379 . 1 . 1 36 36 LYS CA C 13 54.09 0.3 . 1 . . . . . 36 K CA . 50579 1
380 . 1 . 1 36 36 LYS CB C 13 35.72 0.3 . 1 . . . . . 36 K CB . 50579 1
381 . 1 . 1 36 36 LYS CG C 13 24.057 0.3 . 1 . . . . . 36 K CG . 50579 1
382 . 1 . 1 36 36 LYS CD C 13 29.087 0.3 . 1 . . . . . 36 K CD . 50579 1
383 . 1 . 1 36 36 LYS CE C 13 42.262 0.3 . 1 . . . . . 36 K CE . 50579 1
384 . 1 . 1 36 36 LYS N N 15 120.9 0.3 . 1 . . . . . 36 K N . 50579 1
385 . 1 . 1 37 37 CYS H H 1 8.029 0.02 . 1 . . . . . 37 C HN . 50579 1
386 . 1 . 1 37 37 CYS HA H 1 4.186 0.02 . 1 . . . . . 37 C HA . 50579 1
387 . 1 . 1 37 37 CYS HB2 H 1 2.531 0.02 . 2 . . . . . 37 C HB1 . 50579 1
388 . 1 . 1 37 37 CYS HB3 H 1 2.797 0.02 . 2 . . . . . 37 C HB2 . 50579 1
389 . 1 . 1 37 37 CYS CA C 13 60.44 0.3 . 1 . . . . . 37 C CA . 50579 1
390 . 1 . 1 37 37 CYS CB C 13 29.79 0.3 . 1 . . . . . 37 C CB . 50579 1
391 . 1 . 1 37 37 CYS N N 15 128.4 0.3 . 1 . . . . . 37 C N . 50579 1
392 . 1 . 1 38 38 THR H H 1 8.092 0.02 . 1 . . . . . 38 T HN . 50579 1
393 . 1 . 1 38 38 THR HA H 1 4.43 0.02 . 1 . . . . . 38 T HA . 50579 1
394 . 1 . 1 38 38 THR HB H 1 4.183 0.02 . 1 . . . . . 38 T HB . 50579 1
395 . 1 . 1 38 38 THR HG21 H 1 1.155 0.02 . 1 . . . . . 38 T HG21 . 50579 1
396 . 1 . 1 38 38 THR HG22 H 1 1.155 0.02 . 1 . . . . . 38 T HG21 . 50579 1
397 . 1 . 1 38 38 THR HG23 H 1 1.155 0.02 . 1 . . . . . 38 T HG21 . 50579 1
398 . 1 . 1 38 38 THR C C 13 176.417 0.3 . 1 . . . . . 38 T C . 50579 1
399 . 1 . 1 38 38 THR CA C 13 63.237 0.3 . 1 . . . . . 38 T CA . 50579 1
400 . 1 . 1 38 38 THR CB C 13 68.898 0.3 . 1 . . . . . 38 T CB . 50579 1
401 . 1 . 1 38 38 THR CG2 C 13 22.979 0.3 . 1 . . . . . 38 T CG2 . 50579 1
402 . 1 . 1 38 38 THR N N 15 117.38 0.3 . 1 . . . . . 38 T N . 50579 1
403 . 1 . 1 39 39 THR H H 1 8.625 0.02 . 1 . . . . . 39 T HN . 50579 1
404 . 1 . 1 39 39 THR HA H 1 3.944 0.02 . 1 . . . . . 39 T HA . 50579 1
405 . 1 . 1 39 39 THR HB H 1 3.549 0.02 . 1 . . . . . 39 T HB . 50579 1
406 . 1 . 1 39 39 THR HG21 H 1 0.748 0.02 . 1 . . . . . 39 T HG21 . 50579 1
407 . 1 . 1 39 39 THR HG22 H 1 0.748 0.02 . 1 . . . . . 39 T HG21 . 50579 1
408 . 1 . 1 39 39 THR HG23 H 1 0.748 0.02 . 1 . . . . . 39 T HG21 . 50579 1
409 . 1 . 1 39 39 THR C C 13 174.432 0.3 . 1 . . . . . 39 T C . 50579 1
410 . 1 . 1 39 39 THR CA C 13 65.37 0.3 . 1 . . . . . 39 T CA . 50579 1
411 . 1 . 1 39 39 THR CB C 13 68.32 0.3 . 1 . . . . . 39 T CB . 50579 1
412 . 1 . 1 39 39 THR CG2 C 13 21.302 0.3 . 1 . . . . . 39 T CG2 . 50579 1
413 . 1 . 1 39 39 THR N N 15 125.26 0.3 . 1 . . . . . 39 T N . 50579 1
414 . 1 . 1 40 40 ILE H H 1 8.521 0.02 . 1 . . . . . 40 I HN . 50579 1
415 . 1 . 1 40 40 ILE HA H 1 3.739 0.02 . 1 . . . . . 40 I HA . 50579 1
416 . 1 . 1 40 40 ILE HB H 1 1.778 0.02 . 1 . . . . . 40 I HB . 50579 1
417 . 1 . 1 40 40 ILE HG12 H 1 1.302 0.02 . 1 . . . . . 40 I HG11 . 50579 1
418 . 1 . 1 40 40 ILE HG13 H 1 1.649 0.02 . 1 . . . . . 40 I HG12 . 50579 1
419 . 1 . 1 40 40 ILE HG21 H 1 0.894 0.02 . 1 . . . . . 40 I HG21 . 50579 1
420 . 1 . 1 40 40 ILE HG22 H 1 0.894 0.02 . 1 . . . . . 40 I HG21 . 50579 1
421 . 1 . 1 40 40 ILE HG23 H 1 0.894 0.02 . 1 . . . . . 40 I HG21 . 50579 1
422 . 1 . 1 40 40 ILE HD11 H 1 0.826 0.02 . 1 . . . . . 40 I HD11 . 50579 1
423 . 1 . 1 40 40 ILE HD12 H 1 0.826 0.02 . 1 . . . . . 40 I HD11 . 50579 1
424 . 1 . 1 40 40 ILE HD13 H 1 0.826 0.02 . 1 . . . . . 40 I HD11 . 50579 1
425 . 1 . 1 40 40 ILE C C 13 177.723 0.3 . 1 . . . . . 40 I C . 50579 1
426 . 1 . 1 40 40 ILE CA C 13 63.03 0.3 . 1 . . . . . 40 I CA . 50579 1
427 . 1 . 1 40 40 ILE CB C 13 37.05 0.3 . 1 . . . . . 40 I CB . 50579 1
428 . 1 . 1 40 40 ILE CG1 C 13 28.246 0.3 . 1 . . . . . 40 I CG1 . 50579 1
429 . 1 . 1 40 40 ILE CG2 C 13 17.23 0.3 . 1 . . . . . 40 I CG2 . 50579 1
430 . 1 . 1 40 40 ILE CD1 C 13 12.84 0.3 . 1 . . . . . 40 I CD1 . 50579 1
431 . 1 . 1 40 40 ILE N N 15 131.07 0.3 . 1 . . . . . 40 I N . 50579 1
432 . 1 . 1 41 41 GLY H H 1 8.931 0.02 . 1 . . . . . 41 G HN . 50579 1
433 . 1 . 1 41 41 GLY HA2 H 1 4.228 0.02 . 2 . . . . . 41 G HA1 . 50579 1
434 . 1 . 1 41 41 GLY HA3 H 1 3.674 0.02 . 2 . . . . . 41 G HA2 . 50579 1
435 . 1 . 1 41 41 GLY CA C 13 44.93 0.3 . 1 . . . . . 41 G CA . 50579 1
436 . 1 . 1 41 41 GLY N N 15 115.84 0.3 . 1 . . . . . 41 G N . 50579 1
437 . 1 . 1 42 42 CYS H H 1 8.04 0.02 . 1 . . . . . 42 C HN . 50579 1
438 . 1 . 1 42 42 CYS HA H 1 5.058 0.02 . 1 . . . . . 42 C HA . 50579 1
439 . 1 . 1 42 42 CYS HB2 H 1 2.769 0.02 . 2 . . . . . 42 C HB1 . 50579 1
440 . 1 . 1 42 42 CYS HB3 H 1 3.128 0.02 . 2 . . . . . 42 C HB2 . 50579 1
441 . 1 . 1 42 42 CYS C C 13 173.852 0.3 . 1 . . . . . 42 C C . 50579 1
442 . 1 . 1 42 42 CYS CA C 13 56.63 0.3 . 1 . . . . . 42 C CA . 50579 1
443 . 1 . 1 42 42 CYS CB C 13 31.321 0.3 . 1 . . . . . 42 C CB . 50579 1
444 . 1 . 1 42 42 CYS N N 15 125.47 0.3 . 1 . . . . . 42 C N . 50579 1
445 . 1 . 1 43 43 PRO HA H 1 4.683 0.02 . 1 . . . . . 43 P HA . 50579 1
446 . 1 . 1 43 43 PRO HB2 H 1 2.249 0.02 . 2 . . . . . 43 P HB1 . 50579 1
447 . 1 . 1 43 43 PRO HB3 H 1 1.835 0.02 . 2 . . . . . 43 P HB2 . 50579 1
448 . 1 . 1 43 43 PRO HG2 H 1 1.879 0.02 . 2 . . . . . 43 P HG1 . 50579 1
449 . 1 . 1 43 43 PRO HG3 H 1 2.19 0.02 . 2 . . . . . 43 P HG2 . 50579 1
450 . 1 . 1 43 43 PRO HD2 H 1 3.731 0.02 . 2 . . . . . 43 P HD1 . 50579 1
451 . 1 . 1 43 43 PRO HD3 H 1 3.921 0.02 . 2 . . . . . 43 P HD2 . 50579 1
452 . 1 . 1 43 43 PRO C C 13 177.481 0.3 . 1 . . . . . 43 P C . 50579 1
453 . 1 . 1 43 43 PRO CA C 13 63.65 0.3 . 1 . . . . . 43 P CA . 50579 1
454 . 1 . 1 43 43 PRO CB C 13 32.32 0.3 . 1 . . . . . 43 P CB . 50579 1
455 . 1 . 1 43 43 PRO CG C 13 27.051 0.3 . 1 . . . . . 43 P CG . 50579 1
456 . 1 . 1 43 43 PRO CD C 13 51.066 0.3 . 1 . . . . . 43 P CD . 50579 1
457 . 1 . 1 44 44 VAL H H 1 8.303 0.02 . 1 . . . . . 44 V HN . 50579 1
458 . 1 . 1 44 44 VAL HA H 1 4.25 0.02 . 1 . . . . . 44 V HA . 50579 1
459 . 1 . 1 44 44 VAL HB H 1 1.471 0.02 . 1 . . . . . 44 V HB . 50579 1
460 . 1 . 1 44 44 VAL HG21 H 1 0.845 0.02 . 2 . . . . . 44 V HG21 . 50579 1
461 . 1 . 1 44 44 VAL HG22 H 1 0.845 0.02 . 2 . . . . . 44 V HG21 . 50579 1
462 . 1 . 1 44 44 VAL HG23 H 1 0.845 0.02 . 2 . . . . . 44 V HG21 . 50579 1
463 . 1 . 1 44 44 VAL C C 13 176.513 0.3 . 1 . . . . . 44 V C . 50579 1
464 . 1 . 1 44 44 VAL CA C 13 65.86 0.3 . 1 . . . . . 44 V CA . 50579 1
465 . 1 . 1 44 44 VAL CB C 13 31.39 0.3 . 1 . . . . . 44 V CB . 50579 1
466 . 1 . 1 44 44 VAL CG2 C 13 22.141 0.3 . 1 . . . . . 44 V CG2 . 50579 1
467 . 1 . 1 44 44 VAL N N 15 123.41 0.3 . 1 . . . . . 44 V N . 50579 1
468 . 1 . 1 45 45 ARG H H 1 8.586 0.02 . 1 . . . . . 45 R HN . 50579 1
469 . 1 . 1 45 45 ARG HA H 1 5.603 0.02 . 1 . . . . . 45 R HA . 50579 1
470 . 1 . 1 45 45 ARG HB2 H 1 2.208 0.02 . 2 . . . . . 45 R HB2 . 50579 1
471 . 1 . 1 45 45 ARG HG2 H 1 1.87 0.02 . 2 . . . . . 45 R HG1 . 50579 1
472 . 1 . 1 45 45 ARG HG3 H 1 1.87 0.02 . 2 . . . . . 45 R HG2 . 50579 1
473 . 1 . 1 45 45 ARG HD2 H 1 3.296 0.02 . 2 . . . . . 45 R HD1 . 50579 1
474 . 1 . 1 45 45 ARG HD3 H 1 3.296 0.02 . 2 . . . . . 45 R HD2 . 50579 1
475 . 1 . 1 45 45 ARG C C 13 173.9 0.3 . 1 . . . . . 45 R C . 50579 1
476 . 1 . 1 45 45 ARG CA C 13 54.103 0.3 . 1 . . . . . 45 R CA . 50579 1
477 . 1 . 1 45 45 ARG CB C 13 34.22 0.3 . 1 . . . . . 45 R CB . 50579 1
478 . 1 . 1 45 45 ARG CG C 13 27.89 0.3 . 1 . . . . . 45 R CG . 50579 1
479 . 1 . 1 45 45 ARG CD C 13 43.714 0.3 . 1 . . . . . 45 R CD . 50579 1
480 . 1 . 1 45 45 ARG N N 15 126.56 0.3 . 1 . . . . . 45 R N . 50579 1
481 . 1 . 1 46 46 LYS H H 1 9.116 0.02 . 1 . . . . . 46 K HN . 50579 1
482 . 1 . 1 46 46 LYS HA H 1 5.16 0.02 . 1 . . . . . 46 K HA . 50579 1
483 . 1 . 1 46 46 LYS HB2 H 1 1.776 0.02 . 2 . . . . . 46 K HB1 . 50579 1
484 . 1 . 1 46 46 LYS HB3 H 1 1.776 0.02 . 2 . . . . . 46 K HB2 . 50579 1
485 . 1 . 1 46 46 LYS HG2 H 1 1.401 0.02 . 2 . . . . . 46 K HG1 . 50579 1
486 . 1 . 1 46 46 LYS HG3 H 1 1.312 0.02 . 2 . . . . . 46 K HG2 . 50579 1
487 . 1 . 1 46 46 LYS HD2 H 1 1.685 0.02 . 2 . . . . . 46 K HD1 . 50579 1
488 . 1 . 1 46 46 LYS HD3 H 1 1.685 0.02 . 2 . . . . . 46 K HD2 . 50579 1
489 . 1 . 1 46 46 LYS HE2 H 1 2.862 0.02 . 2 . . . . . 46 K HE1 . 50579 1
490 . 1 . 1 46 46 LYS HE3 H 1 2.862 0.02 . 2 . . . . . 46 K HE2 . 50579 1
491 . 1 . 1 46 46 LYS C C 13 174.045 0.3 . 1 . . . . . 46 K C . 50579 1
492 . 1 . 1 46 46 LYS CA C 13 54.12 0.3 . 1 . . . . . 46 K CA . 50579 1
493 . 1 . 1 46 46 LYS CB C 13 36.984 0.3 . 1 . . . . . 46 K CB . 50579 1
494 . 1 . 1 46 46 LYS CG C 13 24.656 0.3 . 1 . . . . . 46 K CG . 50579 1
495 . 1 . 1 46 46 LYS CD C 13 32.947 0.3 . 1 . . . . . 46 K CD . 50579 1
496 . 1 . 1 46 46 LYS CE C 13 42.085 0.3 . 1 . . . . . 46 K CE . 50579 1
497 . 1 . 1 46 46 LYS N N 15 119.44 0.3 . 1 . . . . . 46 K N . 50579 1
498 . 1 . 1 47 47 HIS H H 1 8.746 0.02 . 1 . . . . . 47 H HN . 50579 1
499 . 1 . 1 47 47 HIS HA H 1 5.589 0.02 . 1 . . . . . 47 H HA . 50579 1
500 . 1 . 1 47 47 HIS HB2 H 1 2.531 0.02 . 2 . . . . . 47 H HB1 . 50579 1
501 . 1 . 1 47 47 HIS HB3 H 1 2.531 0.02 . 2 . . . . . 47 H HB2 . 50579 1
502 . 1 . 1 47 47 HIS C C 13 173.852 0.3 . 1 . . . . . 47 H C . 50579 1
503 . 1 . 1 47 47 HIS CA C 13 53.4 0.3 . 1 . . . . . 47 H CA . 50579 1
504 . 1 . 1 47 47 HIS CB C 13 32.42 0.3 . 1 . . . . . 47 H CB . 50579 1
505 . 1 . 1 47 47 HIS N N 15 120.64 0.3 . 1 . . . . . 47 H N . 50579 1
506 . 1 . 1 48 48 VAL H H 1 8.671 0.02 . 1 . . . . . 48 V HN . 50579 1
507 . 1 . 1 48 48 VAL HA H 1 4.92 0.02 . 1 . . . . . 48 V HA . 50579 1
508 . 1 . 1 48 48 VAL HB H 1 1.846 0.02 . 1 . . . . . 48 V HB . 50579 1
509 . 1 . 1 48 48 VAL HG11 H 1 0.741 0.02 . 2 . . . . . 48 V HG11 . 50579 1
510 . 1 . 1 48 48 VAL HG12 H 1 0.741 0.02 . 2 . . . . . 48 V HG11 . 50579 1
511 . 1 . 1 48 48 VAL HG13 H 1 0.741 0.02 . 2 . . . . . 48 V HG11 . 50579 1
512 . 1 . 1 48 48 VAL HG21 H 1 0.679 0.02 . 2 . . . . . 48 V HG21 . 50579 1
513 . 1 . 1 48 48 VAL HG22 H 1 0.679 0.02 . 2 . . . . . 48 V HG21 . 50579 1
514 . 1 . 1 48 48 VAL HG23 H 1 0.679 0.02 . 2 . . . . . 48 V HG21 . 50579 1
515 . 1 . 1 48 48 VAL C C 13 174.723 0.3 . 1 . . . . . 48 V C . 50579 1
516 . 1 . 1 48 48 VAL CA C 13 61.06 0.3 . 1 . . . . . 48 V CA . 50579 1
517 . 1 . 1 48 48 VAL CB C 13 35.569 0.3 . 1 . . . . . 48 V CB . 50579 1
518 . 1 . 1 48 48 VAL CG1 C 13 21.542 0.3 . 1 . . . . . 48 V CG1 . 50579 1
519 . 1 . 1 48 48 VAL CG2 C 13 21.542 0.3 . 1 . . . . . 48 V CG2 . 50579 1
520 . 1 . 1 48 48 VAL N N 15 120.56 0.3 . 1 . . . . . 48 V N . 50579 1
521 . 1 . 1 49 49 GLU H H 1 8.674 0.02 . 1 . . . . . 49 E HN . 50579 1
522 . 1 . 1 49 49 GLU HA H 1 4.838 0.02 . 1 . . . . . 49 E HA . 50579 1
523 . 1 . 1 49 49 GLU HB2 H 1 1.859 0.02 . 2 . . . . . 49 E HB1 . 50579 1
524 . 1 . 1 49 49 GLU HB3 H 1 1.996 0.02 . 2 . . . . . 49 E HB2 . 50579 1
525 . 1 . 1 49 49 GLU HG2 H 1 2.123 0.02 . 2 . . . . . 49 E HG1 . 50579 1
526 . 1 . 1 49 49 GLU HG3 H 1 2.123 0.02 . 2 . . . . . 49 E HG2 . 50579 1
527 . 1 . 1 49 49 GLU C C 13 174.432 0.3 . 1 . . . . . 49 E C . 50579 1
528 . 1 . 1 49 49 GLU CA C 13 54.41 0.3 . 1 . . . . . 49 E CA . 50579 1
529 . 1 . 1 49 49 GLU CB C 13 33.73 0.3 . 1 . . . . . 49 E CB . 50579 1
530 . 1 . 1 49 49 GLU CG C 13 35.914 0.3 . 1 . . . . . 49 E CG . 50579 1
531 . 1 . 1 49 49 GLU N N 15 124.95 0.3 . 1 . . . . . 49 E N . 50579 1
532 . 1 . 1 50 50 ARG H H 1 8.83 0.02 . 1 . . . . . 50 R HN . 50579 1
533 . 1 . 1 50 50 ARG HA H 1 4.69 0.02 . 1 . . . . . 50 R HA . 50579 1
534 . 1 . 1 50 50 ARG HB2 H 1 1.616 0.02 . 2 . . . . . 50 R HB1 . 50579 1
535 . 1 . 1 50 50 ARG HB3 H 1 1.813 0.02 . 2 . . . . . 50 R HB2 . 50579 1
536 . 1 . 1 50 50 ARG HG2 H 1 1.451 0.02 . 2 . . . . . 50 R HG1 . 50579 1
537 . 1 . 1 50 50 ARG HG3 H 1 1.451 0.02 . 2 . . . . . 50 R HG2 . 50579 1
538 . 1 . 1 50 50 ARG HD2 H 1 3.151 0.02 . 2 . . . . . 50 R HD1 . 50579 1
539 . 1 . 1 50 50 ARG HD3 H 1 3.151 0.02 . 2 . . . . . 50 R HD2 . 50579 1
540 . 1 . 1 50 50 ARG C C 13 175.787 0.3 . 1 . . . . . 50 R C . 50579 1
541 . 1 . 1 50 50 ARG CA C 13 55.938 0.3 . 1 . . . . . 50 R CA . 50579 1
542 . 1 . 1 50 50 ARG CB C 13 31.084 0.3 . 1 . . . . . 50 R CB . 50579 1
543 . 1 . 1 50 50 ARG CG C 13 27.77 0.3 . 1 . . . . . 50 R CG . 50579 1
544 . 1 . 1 50 50 ARG CD C 13 43.46 0.3 . 1 . . . . . 50 R CD . 50579 1
545 . 1 . 1 50 50 ARG N N 15 123.21 0.3 . 1 . . . . . 50 R N . 50579 1
546 . 1 . 1 51 51 ALA H H 1 8.405 0.02 . 1 . . . . . 51 A HN . 50579 1
547 . 1 . 1 51 51 ALA HA H 1 4.267 0.02 . 1 . . . . . 51 A HA . 50579 1
548 . 1 . 1 51 51 ALA HB1 H 1 1.417 0.02 . 1 . . . . . 51 A HB1 . 50579 1
549 . 1 . 1 51 51 ALA HB2 H 1 1.417 0.02 . 1 . . . . . 51 A HB1 . 50579 1
550 . 1 . 1 51 51 ALA HB3 H 1 1.417 0.02 . 1 . . . . . 51 A HB1 . 50579 1
551 . 1 . 1 51 51 ALA C C 13 178.014 0.3 . 1 . . . . . 51 A C . 50579 1
552 . 1 . 1 51 51 ALA CA C 13 52.32 0.3 . 1 . . . . . 51 A CA . 50579 1
553 . 1 . 1 51 51 ALA CB C 13 19.69 0.3 . 1 . . . . . 51 A CB . 50579 1
554 . 1 . 1 51 51 ALA N N 15 126.79 0.3 . 1 . . . . . 51 A N . 50579 1
555 . 1 . 1 52 52 SER H H 1 8.549 0.02 . 1 . . . . . 52 S HN . 50579 1
556 . 1 . 1 52 52 SER HA H 1 4.182 0.02 . 1 . . . . . 52 S HA . 50579 1
557 . 1 . 1 52 52 SER HB2 H 1 3.92 0.02 . 2 . . . . . 52 S HB1 . 50579 1
558 . 1 . 1 52 52 SER HB3 H 1 3.84 0.02 . 2 . . . . . 52 S HB2 . 50579 1
559 . 1 . 1 52 52 SER CA C 13 60.2 0.3 . 1 . . . . . 52 S CA . 50579 1
560 . 1 . 1 52 52 SER CB C 13 63.65 0.3 . 1 . . . . . 52 S CB . 50579 1
561 . 1 . 1 52 52 SER N N 15 115.23 0.3 . 1 . . . . . 52 S N . 50579 1
562 . 1 . 1 53 53 HIS HA H 1 4.602 0.02 . 1 . . . . . 53 H HA . 50579 1
563 . 1 . 1 53 53 HIS HB2 H 1 3.174 0.02 . 2 . . . . . 53 H HB1 . 50579 1
564 . 1 . 1 53 53 HIS HB3 H 1 3.174 0.02 . 2 . . . . . 53 H HB2 . 50579 1
565 . 1 . 1 53 53 HIS C C 13 174.723 0.3 . 1 . . . . . 53 H C . 50579 1
566 . 1 . 1 53 53 HIS CA C 13 56.47 0.3 . 1 . . . . . 53 H CA . 50579 1
567 . 1 . 1 53 53 HIS CB C 13 29.93 0.3 . 1 . . . . . 53 H CB . 50579 1
568 . 1 . 1 54 54 ASP H H 1 7.156 0.02 . 1 . . . . . 54 D HN . 50579 1
569 . 1 . 1 54 54 ASP HA H 1 4.545 0.02 . 1 . . . . . 54 D HA . 50579 1
570 . 1 . 1 54 54 ASP HB2 H 1 2.56 0.02 . 2 . . . . . 54 D HB1 . 50579 1
571 . 1 . 1 54 54 ASP HB3 H 1 2.56 0.02 . 2 . . . . . 54 D HB2 . 50579 1
572 . 1 . 1 54 54 ASP C C 13 175.642 0.3 . 1 . . . . . 54 D C . 50579 1
573 . 1 . 1 54 54 ASP CA C 13 54.09 0.3 . 1 . . . . . 54 D CA . 50579 1
574 . 1 . 1 54 54 ASP CB C 13 41.764 0.3 . 1 . . . . . 54 D CB . 50579 1
575 . 1 . 1 54 54 ASP N N 15 118.32 0.3 . 1 . . . . . 54 D N . 50579 1
576 . 1 . 1 55 55 MET H H 1 8.44 0.02 . 1 . . . . . 55 M HN . 50579 1
577 . 1 . 1 55 55 MET HA H 1 4.335 0.02 . 1 . . . . . 55 M HA . 50579 1
578 . 1 . 1 55 55 MET HB2 H 1 2.627 0.02 . 2 . . . . . 55 M HB1 . 50579 1
579 . 1 . 1 55 55 MET HB3 H 1 2.585 0.02 . 2 . . . . . 55 M HB2 . 50579 1
580 . 1 . 1 55 55 MET HG2 H 1 2.113 0.02 . 2 . . . . . 55 M HG2 . 50579 1
581 . 1 . 1 55 55 MET C C 13 176.368 0.3 . 1 . . . . . 55 M C . 50579 1
582 . 1 . 1 55 55 MET CA C 13 56.813 0.3 . 1 . . . . . 55 M CA . 50579 1
583 . 1 . 1 55 55 MET CB C 13 32.245 0.3 . 1 . . . . . 55 M CB . 50579 1
584 . 1 . 1 55 55 MET CG C 13 28.325 0.3 . 1 . . . . . 55 M CG . 50579 1
585 . 1 . 1 55 55 MET N N 15 120.95 0.3 . 1 . . . . . 55 M N . 50579 1
586 . 1 . 1 56 56 ARG H H 1 8.25 0.02 . 1 . . . . . 56 R HN . 50579 1
587 . 1 . 1 56 56 ARG HA H 1 4.192 0.02 . 1 . . . . . 56 R HA . 50579 1
588 . 1 . 1 56 56 ARG HB2 H 1 1.9 0.02 . 2 . . . . . 56 R HB1 . 50579 1
589 . 1 . 1 56 56 ARG HB3 H 1 1.81 0.02 . 2 . . . . . 56 R HB2 . 50579 1
590 . 1 . 1 56 56 ARG HG2 H 1 1.622 0.02 . 2 . . . . . 56 R HG1 . 50579 1
591 . 1 . 1 56 56 ARG HG3 H 1 1.622 0.02 . 2 . . . . . 56 R HG2 . 50579 1
592 . 1 . 1 56 56 ARG HD2 H 1 3.2 0.02 . 2 . . . . . 56 R HD1 . 50579 1
593 . 1 . 1 56 56 ARG HD3 H 1 3.2 0.02 . 2 . . . . . 56 R HD2 . 50579 1
594 . 1 . 1 56 56 ARG C C 13 176.126 0.3 . 1 . . . . . 56 R C . 50579 1
595 . 1 . 1 56 56 ARG CA C 13 56.63 0.3 . 1 . . . . . 56 R CA . 50579 1
596 . 1 . 1 56 56 ARG CB C 13 30.28 0.3 . 1 . . . . . 56 R CB . 50579 1
597 . 1 . 1 56 56 ARG CG C 13 27.051 0.3 . 1 . . . . . 56 R CG . 50579 1
598 . 1 . 1 56 56 ARG CD C 13 43.34 0.3 . 1 . . . . . 56 R CD . 50579 1
599 . 1 . 1 56 56 ARG N N 15 117.69 0.3 . 1 . . . . . 56 R N . 50579 1
600 . 1 . 1 57 57 ALA H H 1 7.882 0.02 . 1 . . . . . 57 A HN . 50579 1
601 . 1 . 1 57 57 ALA HA H 1 4.477 0.02 . 1 . . . . . 57 A HA . 50579 1
602 . 1 . 1 57 57 ALA HB1 H 1 1.338 0.02 . 1 . . . . . 57 A HB1 . 50579 1
603 . 1 . 1 57 57 ALA HB2 H 1 1.338 0.02 . 1 . . . . . 57 A HB1 . 50579 1
604 . 1 . 1 57 57 ALA HB3 H 1 1.338 0.02 . 1 . . . . . 57 A HB1 . 50579 1
605 . 1 . 1 57 57 ALA C C 13 176.126 0.3 . 1 . . . . . 57 A C . 50579 1
606 . 1 . 1 57 57 ALA CA C 13 51.95 0.3 . 1 . . . . . 57 A CA . 50579 1
607 . 1 . 1 57 57 ALA CB C 13 19.81 0.3 . 1 . . . . . 57 A CB . 50579 1
608 . 1 . 1 57 57 ALA N N 15 123.49 0.3 . 1 . . . . . 57 A N . 50579 1
609 . 1 . 1 58 58 VAL H H 1 8.224 0.02 . 1 . . . . . 58 V HN . 50579 1
610 . 1 . 1 58 58 VAL HA H 1 4.485 0.02 . 1 . . . . . 58 V HA . 50579 1
611 . 1 . 1 58 58 VAL HB H 1 1.956 0.02 . 1 . . . . . 58 V HB . 50579 1
612 . 1 . 1 58 58 VAL HG11 H 1 0.86 0.02 . 2 . . . . . 58 V HG11 . 50579 1
613 . 1 . 1 58 58 VAL HG12 H 1 0.86 0.02 . 2 . . . . . 58 V HG11 . 50579 1
614 . 1 . 1 58 58 VAL HG13 H 1 0.86 0.02 . 2 . . . . . 58 V HG11 . 50579 1
615 . 1 . 1 58 58 VAL C C 13 175.787 0.3 . 1 . . . . . 58 V C . 50579 1
616 . 1 . 1 58 58 VAL CA C 13 61.18 0.3 . 1 . . . . . 58 V CA . 50579 1
617 . 1 . 1 58 58 VAL CB C 13 33.97 0.3 . 1 . . . . . 58 V CB . 50579 1
618 . 1 . 1 58 58 VAL CG1 C 13 21.302 0.3 . 1 . . . . . 58 V CG1 . 50579 1
619 . 1 . 1 58 58 VAL N N 15 119.39 0.3 . 1 . . . . . 58 V N . 50579 1
620 . 1 . 1 59 59 ILE H H 1 9.034 0.02 . 1 . . . . . 59 I HN . 50579 1
621 . 1 . 1 59 59 ILE HA H 1 4.368 0.02 . 1 . . . . . 59 I HA . 50579 1
622 . 1 . 1 59 59 ILE HB H 1 1.831 0.02 . 1 . . . . . 59 I HB . 50579 1
623 . 1 . 1 59 59 ILE HG12 H 1 1.122 0.02 . 1 . . . . . 59 I HG11 . 50579 1
624 . 1 . 1 59 59 ILE HG13 H 1 1.436 0.02 . 1 . . . . . 59 I HG12 . 50579 1
625 . 1 . 1 59 59 ILE HG21 H 1 0.835 0.02 . 1 . . . . . 59 I HG21 . 50579 1
626 . 1 . 1 59 59 ILE HG22 H 1 0.835 0.02 . 1 . . . . . 59 I HG21 . 50579 1
627 . 1 . 1 59 59 ILE HG23 H 1 0.835 0.02 . 1 . . . . . 59 I HG21 . 50579 1
628 . 1 . 1 59 59 ILE HD11 H 1 0.825 0.02 . 1 . . . . . 59 I HD11 . 50579 1
629 . 1 . 1 59 59 ILE HD12 H 1 0.825 0.02 . 1 . . . . . 59 I HD11 . 50579 1
630 . 1 . 1 59 59 ILE HD13 H 1 0.825 0.02 . 1 . . . . . 59 I HD11 . 50579 1
631 . 1 . 1 59 59 ILE C C 13 175.836 0.3 . 1 . . . . . 59 I C . 50579 1
632 . 1 . 1 59 59 ILE CA C 13 60.46 0.3 . 1 . . . . . 59 I CA . 50579 1
633 . 1 . 1 59 59 ILE CB C 13 39.216 0.3 . 1 . . . . . 59 I CB . 50579 1
634 . 1 . 1 59 59 ILE CG1 C 13 26.931 0.3 . 1 . . . . . 59 I CG1 . 50579 1
635 . 1 . 1 59 59 ILE CG2 C 13 17.688 0.3 . 1 . . . . . 59 I CG2 . 50579 1
636 . 1 . 1 59 59 ILE CD1 C 13 13.082 0.3 . 1 . . . . . 59 I CD1 . 50579 1
637 . 1 . 1 59 59 ILE N N 15 127.71 0.3 . 1 . . . . . 59 I N . 50579 1
638 . 1 . 1 60 60 THR H H 1 8.675 0.02 . 1 . . . . . 60 T HN . 50579 1
639 . 1 . 1 60 60 THR HA H 1 4.469 0.02 . 1 . . . . . 60 T HA . 50579 1
640 . 1 . 1 60 60 THR HB H 1 3.756 0.02 . 1 . . . . . 60 T HB . 50579 1
641 . 1 . 1 60 60 THR HG21 H 1 0.468 0.02 . 1 . . . . . 60 T HG21 . 50579 1
642 . 1 . 1 60 60 THR HG22 H 1 0.468 0.02 . 1 . . . . . 60 T HG21 . 50579 1
643 . 1 . 1 60 60 THR HG23 H 1 0.468 0.02 . 1 . . . . . 60 T HG21 . 50579 1
644 . 1 . 1 60 60 THR C C 13 173.852 0.3 . 1 . . . . . 60 T C . 50579 1
645 . 1 . 1 60 60 THR CA C 13 61.77 0.3 . 1 . . . . . 60 T CA . 50579 1
646 . 1 . 1 60 60 THR CB C 13 69.596 0.3 . 1 . . . . . 60 T CB . 50579 1
647 . 1 . 1 60 60 THR CG2 C 13 22.141 0.3 . 1 . . . . . 60 T CG2 . 50579 1
648 . 1 . 1 60 60 THR N N 15 126.01 0.3 . 1 . . . . . 60 T N . 50579 1
649 . 1 . 1 61 61 THR H H 1 8.655 0.02 . 1 . . . . . 61 T HN . 50579 1
650 . 1 . 1 61 61 THR HA H 1 4.426 0.02 . 1 . . . . . 61 T HA . 50579 1
651 . 1 . 1 61 61 THR HG21 H 1 1.051 0.02 . 1 . . . . . 61 T HG21 . 50579 1
652 . 1 . 1 61 61 THR HG22 H 1 1.051 0.02 . 1 . . . . . 61 T HG21 . 50579 1
653 . 1 . 1 61 61 THR HG23 H 1 1.051 0.02 . 1 . . . . . 61 T HG21 . 50579 1
654 . 1 . 1 61 61 THR C C 13 172.545 0.3 . 1 . . . . . 61 T C . 50579 1
655 . 1 . 1 61 61 THR CA C 13 61.43 0.3 . 1 . . . . . 61 T CA . 50579 1
656 . 1 . 1 61 61 THR CB C 13 70.79 0.3 . 1 . . . . . 61 T CB . 50579 1
657 . 1 . 1 61 61 THR CG2 C 13 21.557 0.3 . 1 . . . . . 61 T CG2 . 50579 1
658 . 1 . 1 61 61 THR N N 15 122.6 0.3 . 1 . . . . . 61 T N . 50579 1
659 . 1 . 1 62 62 TYR H H 1 8.899 0.02 . 1 . . . . . 62 Y HN . 50579 1
660 . 1 . 1 62 62 TYR HA H 1 4.878 0.02 . 1 . . . . . 62 Y HA . 50579 1
661 . 1 . 1 62 62 TYR HB2 H 1 2.862 0.02 . 2 . . . . . 62 Y HB1 . 50579 1
662 . 1 . 1 62 62 TYR HB3 H 1 2.862 0.02 . 2 . . . . . 62 Y HB2 . 50579 1
663 . 1 . 1 62 62 TYR C C 13 175.594 0.3 . 1 . . . . . 62 Y C . 50579 1
664 . 1 . 1 62 62 TYR CA C 13 57.98 0.3 . 1 . . . . . 62 Y CA . 50579 1
665 . 1 . 1 62 62 TYR CB C 13 41.6 0.3 . 1 . . . . . 62 Y CB . 50579 1
666 . 1 . 1 62 62 TYR N N 15 123.52 0.3 . 1 . . . . . 62 Y N . 50579 1
667 . 1 . 1 63 63 GLU H H 1 9.134 0.02 . 1 . . . . . 63 E HN . 50579 1
668 . 1 . 1 63 63 GLU HA H 1 4.582 0.02 . 1 . . . . . 63 E HA . 50579 1
669 . 1 . 1 63 63 GLU HB2 H 1 1.995 0.02 . 2 . . . . . 63 E HB1 . 50579 1
670 . 1 . 1 63 63 GLU HB3 H 1 1.995 0.02 . 2 . . . . . 63 E HB2 . 50579 1
671 . 1 . 1 63 63 GLU HG2 H 1 2.168 0.02 . 2 . . . . . 63 E HG1 . 50579 1
672 . 1 . 1 63 63 GLU HG3 H 1 2.168 0.02 . 2 . . . . . 63 E HG2 . 50579 1
673 . 1 . 1 63 63 GLU C C 13 175.207 0.3 . 1 . . . . . 63 E C . 50579 1
674 . 1 . 1 63 63 GLU CA C 13 55.71 0.3 . 1 . . . . . 63 E CA . 50579 1
675 . 1 . 1 63 63 GLU CB C 13 32.22 0.3 . 1 . . . . . 63 E CB . 50579 1
676 . 1 . 1 63 63 GLU CG C 13 36.393 0.3 . 1 . . . . . 63 E CG . 50579 1
677 . 1 . 1 63 63 GLU N N 15 122.7 0.3 . 1 . . . . . 63 E N . 50579 1
678 . 1 . 1 64 64 GLY H H 1 8.383 0.02 . 1 . . . . . 64 G HN . 50579 1
679 . 1 . 1 64 64 GLY HA2 H 1 3.724 0.02 . 2 . . . . . 64 G HA1 . 50579 1
680 . 1 . 1 64 64 GLY HA3 H 1 4.113 0.02 . 2 . . . . . 64 G HA2 . 50579 1
681 . 1 . 1 64 64 GLY C C 13 171.916 0.3 . 1 . . . . . 64 G C . 50579 1
682 . 1 . 1 64 64 GLY CA C 13 43.72 0.3 . 1 . . . . . 64 G CA . 50579 1
683 . 1 . 1 64 64 GLY N N 15 111.19 0.3 . 1 . . . . . 64 G N . 50579 1
684 . 1 . 1 65 65 LYS H H 1 7.897 0.02 . 1 . . . . . 65 K HN . 50579 1
685 . 1 . 1 65 65 LYS HA H 1 4.467 0.02 . 1 . . . . . 65 K HA . 50579 1
686 . 1 . 1 65 65 LYS HB2 H 1 1.554 0.02 . 2 . . . . . 65 K HB1 . 50579 1
687 . 1 . 1 65 65 LYS HB3 H 1 1.67 0.02 . 2 . . . . . 65 K HB2 . 50579 1
688 . 1 . 1 65 65 LYS HG2 H 1 1.387 0.02 . 2 . . . . . 65 K HG1 . 50579 1
689 . 1 . 1 65 65 LYS HG3 H 1 1.327 0.02 . 2 . . . . . 65 K HG2 . 50579 1
690 . 1 . 1 65 65 LYS HD2 H 1 1.645 0.02 . 2 . . . . . 65 K HD2 . 50579 1
691 . 1 . 1 65 65 LYS HE2 H 1 2.965 0.02 . 2 . . . . . 65 K HE1 . 50579 1
692 . 1 . 1 65 65 LYS HE3 H 1 2.965 0.02 . 2 . . . . . 65 K HE2 . 50579 1
693 . 1 . 1 65 65 LYS C C 13 176.223 0.3 . 1 . . . . . 65 K C . 50579 1
694 . 1 . 1 65 65 LYS CA C 13 53.92 0.3 . 1 . . . . . 65 K CA . 50579 1
695 . 1 . 1 65 65 LYS CB C 13 35.08 0.3 . 1 . . . . . 65 K CB . 50579 1
696 . 1 . 1 65 65 LYS CG C 13 24.541 0.3 . 1 . . . . . 65 K CG . 50579 1
697 . 1 . 1 65 65 LYS CD C 13 29.197 0.3 . 1 . . . . . 65 K CD . 50579 1
698 . 1 . 1 65 65 LYS CE C 13 42.741 0.3 . 1 . . . . . 65 K CE . 50579 1
699 . 1 . 1 65 65 LYS N N 15 118.17 0.3 . 1 . . . . . 65 K N . 50579 1
700 . 1 . 1 66 66 HIS H H 1 8.38 0.02 . 1 . . . . . 66 H HN . 50579 1
701 . 1 . 1 66 66 HIS HA H 1 4.69 0.02 . 1 . . . . . 66 H HA . 50579 1
702 . 1 . 1 66 66 HIS HB2 H 1 2.791 0.02 . 2 . . . . . 66 H HB1 . 50579 1
703 . 1 . 1 66 66 HIS HB3 H 1 2.791 0.02 . 2 . . . . . 66 H HB2 . 50579 1
704 . 1 . 1 66 66 HIS C C 13 176.804 0.3 . 1 . . . . . 66 H C . 50579 1
705 . 1 . 1 66 66 HIS CA C 13 57.18 0.3 . 1 . . . . . 66 H CA . 50579 1
706 . 1 . 1 66 66 HIS CB C 13 29.68 0.3 . 1 . . . . . 66 H CB . 50579 1
707 . 1 . 1 66 66 HIS N N 15 122.74 0.3 . 1 . . . . . 66 H N . 50579 1
708 . 1 . 1 67 67 ASN H H 1 8.338 0.02 . 1 . . . . . 67 N HN . 50579 1
709 . 1 . 1 67 67 ASN HA H 1 4.972 0.02 . 1 . . . . . 67 N HA . 50579 1
710 . 1 . 1 67 67 ASN HB2 H 1 3.37 0.02 . 2 . . . . . 67 N HB1 . 50579 1
711 . 1 . 1 67 67 ASN HB3 H 1 2.866 0.02 . 2 . . . . . 67 N HB2 . 50579 1
712 . 1 . 1 67 67 ASN C C 13 173.271 0.3 . 1 . . . . . 67 N C . 50579 1
713 . 1 . 1 67 67 ASN CA C 13 51.06 0.3 . 1 . . . . . 67 N CA . 50579 1
714 . 1 . 1 67 67 ASN CB C 13 36.8 0.3 . 1 . . . . . 67 N CB . 50579 1
715 . 1 . 1 67 67 ASN N N 15 123.51 0.3 . 1 . . . . . 67 N N . 50579 1
716 . 1 . 1 68 68 HIS H H 1 6.813 0.02 . 1 . . . . . 68 H HN . 50579 1
717 . 1 . 1 68 68 HIS HA H 1 4.838 0.02 . 1 . . . . . 68 H HA . 50579 1
718 . 1 . 1 68 68 HIS HB2 H 1 3.265 0.02 . 2 . . . . . 68 H HB1 . 50579 1
719 . 1 . 1 68 68 HIS HB3 H 1 3.317 0.02 . 2 . . . . . 68 H HB2 . 50579 1
720 . 1 . 1 68 68 HIS C C 13 173.174 0.3 . 1 . . . . . 68 H C . 50579 1
721 . 1 . 1 68 68 HIS CA C 13 53.03 0.3 . 1 . . . . . 68 H CA . 50579 1
722 . 1 . 1 68 68 HIS CB C 13 30.71 0.3 . 1 . . . . . 68 H CB . 50579 1
723 . 1 . 1 68 68 HIS N N 15 111.78 0.3 . 1 . . . . . 68 H N . 50579 1
724 . 1 . 1 69 69 ASP H H 1 8.872 0.02 . 1 . . . . . 69 D HN . 50579 1
725 . 1 . 1 69 69 ASP HA H 1 4.643 0.02 . 1 . . . . . 69 D HA . 50579 1
726 . 1 . 1 69 69 ASP HB2 H 1 2.725 0.02 . 2 . . . . . 69 D HB1 . 50579 1
727 . 1 . 1 69 69 ASP HB3 H 1 2.567 0.02 . 2 . . . . . 69 D HB2 . 50579 1
728 . 1 . 1 69 69 ASP C C 13 176.949 0.3 . 1 . . . . . 69 D C . 50579 1
729 . 1 . 1 69 69 ASP CA C 13 54.04 0.3 . 1 . . . . . 69 D CA . 50579 1
730 . 1 . 1 69 69 ASP CB C 13 41.85 0.3 . 1 . . . . . 69 D CB . 50579 1
731 . 1 . 1 69 69 ASP N N 15 120.25 0.3 . 1 . . . . . 69 D N . 50579 1
732 . 1 . 1 70 70 VAL H H 1 8.589 0.02 . 1 . . . . . 70 V HN . 50579 1
733 . 1 . 1 70 70 VAL HA H 1 3.841 0.02 . 1 . . . . . 70 V HA . 50579 1
734 . 1 . 1 70 70 VAL HB H 1 1.837 0.02 . 1 . . . . . 70 V HB . 50579 1
735 . 1 . 1 70 70 VAL HG11 H 1 0.647 0.02 . 2 . . . . . 70 V HG11 . 50579 1
736 . 1 . 1 70 70 VAL HG12 H 1 0.647 0.02 . 2 . . . . . 70 V HG11 . 50579 1
737 . 1 . 1 70 70 VAL HG13 H 1 0.647 0.02 . 2 . . . . . 70 V HG11 . 50579 1
738 . 1 . 1 70 70 VAL HG21 H 1 0.647 0.02 . 2 . . . . . 70 V HG21 . 50579 1
739 . 1 . 1 70 70 VAL HG22 H 1 0.647 0.02 . 2 . . . . . 70 V HG21 . 50579 1
740 . 1 . 1 70 70 VAL HG23 H 1 0.647 0.02 . 2 . . . . . 70 V HG21 . 50579 1
741 . 1 . 1 70 70 VAL CA C 13 60.81 0.3 . 1 . . . . . 70 V CA . 50579 1
742 . 1 . 1 70 70 VAL CB C 13 32.25 0.3 . 1 . . . . . 70 V CB . 50579 1
743 . 1 . 1 70 70 VAL CG1 C 13 20.539 0.3 . 1 . . . . . 70 V CG1 . 50579 1
744 . 1 . 1 70 70 VAL CG2 C 13 20.539 0.3 . 1 . . . . . 70 V CG2 . 50579 1
745 . 1 . 1 70 70 VAL N N 15 122.94 0.3 . 1 . . . . . 70 V N . 50579 1
746 . 1 . 1 71 71 PRO HA H 1 4.315 0.02 . 1 . . . . . 71 P HA . 50579 1
747 . 1 . 1 71 71 PRO HB2 H 1 1.777 0.02 . 2 . . . . . 71 P HB1 . 50579 1
748 . 1 . 1 71 71 PRO HB3 H 1 2.204 0.02 . 2 . . . . . 71 P HB2 . 50579 1
749 . 1 . 1 71 71 PRO HG2 H 1 1.906 0.02 . 2 . . . . . 71 P HG1 . 50579 1
750 . 1 . 1 71 71 PRO HG3 H 1 1.906 0.02 . 2 . . . . . 71 P HG2 . 50579 1
751 . 1 . 1 71 71 PRO HD2 H 1 3.556 0.02 . 2 . . . . . 71 P HD1 . 50579 1
752 . 1 . 1 71 71 PRO HD3 H 1 3.659 0.02 . 2 . . . . . 71 P HD2 . 50579 1
753 . 1 . 1 71 71 PRO C C 13 176.465 0.3 . 1 . . . . . 71 P C . 50579 1
754 . 1 . 1 71 71 PRO CA C 13 63.77 0.3 . 1 . . . . . 71 P CA . 50579 1
755 . 1 . 1 71 71 PRO CB C 13 31.88 0.3 . 1 . . . . . 71 P CB . 50579 1
756 . 1 . 1 71 71 PRO CG C 13 27.53 0.3 . 1 . . . . . 71 P CG . 50579 1
757 . 1 . 1 71 71 PRO CD C 13 51.245 0.3 . 1 . . . . . 71 P CD . 50579 1
758 . 1 . 1 72 72 ALA H H 1 8.139 0.02 . 1 . . . . . 72 A HN . 50579 1
759 . 1 . 1 72 72 ALA HA H 1 4.221 0.02 . 1 . . . . . 72 A HA . 50579 1
760 . 1 . 1 72 72 ALA HB1 H 1 1.305 0.02 . 1 . . . . . 72 A HB1 . 50579 1
761 . 1 . 1 72 72 ALA HB2 H 1 1.305 0.02 . 1 . . . . . 72 A HB1 . 50579 1
762 . 1 . 1 72 72 ALA HB3 H 1 1.305 0.02 . 1 . . . . . 72 A HB1 . 50579 1
763 . 1 . 1 72 72 ALA C C 13 177.723 0.3 . 1 . . . . . 72 A C . 50579 1
764 . 1 . 1 72 72 ALA CA C 13 52.44 0.3 . 1 . . . . . 72 A CA . 50579 1
765 . 1 . 1 72 72 ALA CB C 13 19.07 0.3 . 1 . . . . . 72 A CB . 50579 1
766 . 1 . 1 72 72 ALA N N 15 123.38 0.3 . 1 . . . . . 72 A N . 50579 1
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