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 31112
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-1H COSY' . . . 31112 1
2 '2D 1H-1H NOESY' . . . 31112 1
3 '2D 1H-1H TOCSY' . . . 31112 1
4 '2D 1H-13C HSQC' . . . 31112 1
5 '2D 1H-15N HSQC' . . . 31112 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 1 1 ASN H H 1 8.348 0.00 . . . . . . A 550 ASN H1 . 31112 1
2 . 1 . 1 1 1 ASN HA H 1 4.659 0.00 . . . . . . A 550 ASN HA . 31112 1
3 . 1 . 1 1 1 ASN HB2 H 1 2.809 0.01 . . . . . . A 550 ASN HB2 . 31112 1
4 . 1 . 1 1 1 ASN HB3 H 1 2.734 0.00 . . . . . . A 550 ASN HB3 . 31112 1
5 . 1 . 1 1 1 ASN HD21 H 1 7.579 0.00 . . . . . . A 550 ASN HD21 . 31112 1
6 . 1 . 1 1 1 ASN HD22 H 1 6.908 0.00 . . . . . . A 550 ASN HD22 . 31112 1
7 . 1 . 1 1 1 ASN CA C 13 53.325 0.00 . . . . . . A 550 ASN CA . 31112 1
8 . 1 . 1 1 1 ASN CB C 13 38.969 0.01 . . . . . . A 550 ASN CB . 31112 1
9 . 1 . 1 1 1 ASN N N 15 124.328 0.00 . . . . . . A 550 ASN N . 31112 1
10 . 1 . 1 1 1 ASN ND2 N 15 112.688 0.00 . . . . . . A 550 ASN ND2 . 31112 1
11 . 1 . 1 2 2 ASP H H 1 8.442 0.00 . . . . . . A 551 ASP H . 31112 1
12 . 1 . 1 2 2 ASP HA H 1 4.668 0.00 . . . . . . A 551 ASP HA . 31112 1
13 . 1 . 1 2 2 ASP HB2 H 1 2.846 0.00 . . . . . . A 551 ASP HB2 . 31112 1
14 . 1 . 1 2 2 ASP HB3 H 1 2.846 0.00 . . . . . . A 551 ASP HB3 . 31112 1
15 . 1 . 1 2 2 ASP CA C 13 53.261 0.00 . . . . . . A 551 ASP CA . 31112 1
16 . 1 . 1 2 2 ASP CB C 13 38.377 0.00 . . . . . . A 551 ASP CB . 31112 1
17 . 1 . 1 2 2 ASP N N 15 118.992 0.00 . . . . . . A 551 ASP N . 31112 1
18 . 1 . 1 3 3 HIS H H 1 8.484 0.00 . . . . . . A 552 HIS H . 31112 1
19 . 1 . 1 3 3 HIS HA H 1 4.659 0.00 . . . . . . A 552 HIS HA . 31112 1
20 . 1 . 1 3 3 HIS HB2 H 1 3.314 0.01 . . . . . . A 552 HIS HB2 . 31112 1
21 . 1 . 1 3 3 HIS HB3 H 1 3.225 0.00 . . . . . . A 552 HIS HB3 . 31112 1
22 . 1 . 1 3 3 HIS HD2 H 1 7.295 0.00 . . . . . . A 552 HIS HD2 . 31112 1
23 . 1 . 1 3 3 HIS HE1 H 1 8.627 0.00 . . . . . . A 552 HIS HE1 . 31112 1
24 . 1 . 1 3 3 HIS CA C 13 55.706 0.00 . . . . . . A 552 HIS CA . 31112 1
25 . 1 . 1 3 3 HIS CB C 13 28.497 0.00 . . . . . . A 552 HIS CB . 31112 1
26 . 1 . 1 3 3 HIS CD2 C 13 120.101 0.00 . . . . . . A 552 HIS CD2 . 31112 1
27 . 1 . 1 3 3 HIS CE1 C 13 136.457 0.00 . . . . . . A 552 HIS CE1 . 31112 1
28 . 1 . 1 3 3 HIS N N 15 118.363 0.00 . . . . . . A 552 HIS N . 31112 1
29 . 1 . 1 4 4 GLN H H 1 8.326 0.00 . . . . . . A 553 GLN H . 31112 1
30 . 1 . 1 4 4 GLN HA H 1 4.299 0.00 . . . . . . A 553 GLN HA . 31112 1
31 . 1 . 1 4 4 GLN HB2 H 1 2.071 0.01 . . . . . . A 553 GLN HB2 . 31112 1
32 . 1 . 1 4 4 GLN HB3 H 1 1.992 0.00 . . . . . . A 553 GLN HB3 . 31112 1
33 . 1 . 1 4 4 GLN HG2 H 1 2.343 0.00 . . . . . . A 553 GLN HG2 . 31112 1
34 . 1 . 1 4 4 GLN HG3 H 1 2.343 0.00 . . . . . . A 553 GLN HG3 . 31112 1
35 . 1 . 1 4 4 GLN HE21 H 1 7.488 0.00 . . . . . . A 553 GLN HE21 . 31112 1
36 . 1 . 1 4 4 GLN HE22 H 1 6.843 0.00 . . . . . . A 553 GLN HE22 . 31112 1
37 . 1 . 1 4 4 GLN CA C 13 56.382 0.00 . . . . . . A 553 GLN CA . 31112 1
38 . 1 . 1 4 4 GLN CB C 13 29.491 0.01 . . . . . . A 553 GLN CB . 31112 1
39 . 1 . 1 4 4 GLN CG C 13 33.918 0.00 . . . . . . A 553 GLN CG . 31112 1
40 . 1 . 1 4 4 GLN N N 15 120.621 0.00 . . . . . . A 553 GLN N . 31112 1
41 . 1 . 1 4 4 GLN NE2 N 15 112.136 0.00 . . . . . . A 553 GLN NE2 . 31112 1
42 . 1 . 1 5 5 ASP H H 1 8.470 0.00 . . . . . . A 554 ASP H . 31112 1
43 . 1 . 1 5 5 ASP HA H 1 4.695 0.00 . . . . . . A 554 ASP HA . 31112 1
44 . 1 . 1 5 5 ASP HB2 H 1 2.948 0.01 . . . . . . A 554 ASP HB2 . 31112 1
45 . 1 . 1 5 5 ASP HB3 H 1 2.825 0.00 . . . . . . A 554 ASP HB3 . 31112 1
46 . 1 . 1 5 5 ASP CA C 13 53.231 0.00 . . . . . . A 554 ASP CA . 31112 1
47 . 1 . 1 5 5 ASP CB C 13 38.670 0.01 . . . . . . A 554 ASP CB . 31112 1
48 . 1 . 1 5 5 ASP N N 15 120.177 0.00 . . . . . . A 554 ASP N . 31112 1
49 . 1 . 1 6 6 LEU H H 1 8.213 0.00 . . . . . . A 555 LEU H . 31112 1
50 . 1 . 1 6 6 LEU HA H 1 4.293 0.00 . . . . . . A 555 LEU HA . 31112 1
51 . 1 . 1 6 6 LEU HB2 H 1 1.678 0.00 . . . . . . A 555 LEU HB2 . 31112 1
52 . 1 . 1 6 6 LEU HB3 H 1 1.619 0.00 . . . . . . A 555 LEU HB3 . 31112 1
53 . 1 . 1 6 6 LEU HG H 1 1.599 0.00 . . . . . . A 555 LEU HG . 31112 1
54 . 1 . 1 6 6 LEU HD11 H 1 0.913 0.00 . . . . . . A 555 LEU HD11 . 31112 1
55 . 1 . 1 6 6 LEU HD12 H 1 0.913 0.00 . . . . . . A 555 LEU HD12 . 31112 1
56 . 1 . 1 6 6 LEU HD13 H 1 0.913 0.00 . . . . . . A 555 LEU HD13 . 31112 1
57 . 1 . 1 6 6 LEU HD21 H 1 0.852 0.01 . . . . . . A 555 LEU HD21 . 31112 1
58 . 1 . 1 6 6 LEU HD22 H 1 0.852 0.01 . . . . . . A 555 LEU HD22 . 31112 1
59 . 1 . 1 6 6 LEU HD23 H 1 0.852 0.01 . . . . . . A 555 LEU HD23 . 31112 1
60 . 1 . 1 6 6 LEU CA C 13 55.911 0.00 . . . . . . A 555 LEU CA . 31112 1
61 . 1 . 1 6 6 LEU CB C 13 42.151 0.00 . . . . . . A 555 LEU CB . 31112 1
62 . 1 . 1 6 6 LEU CG C 13 27.094 0.00 . . . . . . A 555 LEU CG . 31112 1
63 . 1 . 1 6 6 LEU CD1 C 13 24.865 0.00 . . . . . . A 555 LEU CD1 . 31112 1
64 . 1 . 1 6 6 LEU CD2 C 13 23.463 0.00 . . . . . . A 555 LEU CD2 . 31112 1
65 . 1 . 1 6 6 LEU N N 15 122.934 0.00 . . . . . . A 555 LEU N . 31112 1
66 . 1 . 1 7 7 ARG H H 1 8.217 0.00 . . . . . . A 556 ARG H . 31112 1
67 . 1 . 1 7 7 ARG HA H 1 4.267 0.00 . . . . . . A 556 ARG HA . 31112 1
68 . 1 . 1 7 7 ARG HB2 H 1 1.850 0.00 . . . . . . A 556 ARG HB2 . 31112 1
69 . 1 . 1 7 7 ARG HB3 H 1 1.817 0.00 . . . . . . A 556 ARG HB3 . 31112 1
70 . 1 . 1 7 7 ARG HG2 H 1 1.675 0.00 . . . . . . A 556 ARG HG2 . 31112 1
71 . 1 . 1 7 7 ARG HG3 H 1 1.617 0.00 . . . . . . A 556 ARG HG3 . 31112 1
72 . 1 . 1 7 7 ARG HD2 H 1 3.218 0.01 . . . . . . A 556 ARG HD2 . 31112 1
73 . 1 . 1 7 7 ARG HD3 H 1 3.218 0.01 . . . . . . A 556 ARG HD3 . 31112 1
74 . 1 . 1 7 7 ARG HE H 1 7.237 0.00 . . . . . . A 556 ARG HE . 31112 1
75 . 1 . 1 7 7 ARG CA C 13 56.882 0.00 . . . . . . A 556 ARG CA . 31112 1
76 . 1 . 1 7 7 ARG CB C 13 30.511 0.00 . . . . . . A 556 ARG CB . 31112 1
77 . 1 . 1 7 7 ARG CG C 13 27.139 0.00 . . . . . . A 556 ARG CG . 31112 1
78 . 1 . 1 7 7 ARG CD C 13 43.431 0.00 . . . . . . A 556 ARG CD . 31112 1
79 . 1 . 1 7 7 ARG N N 15 120.726 0.00 . . . . . . A 556 ARG N . 31112 1
80 . 1 . 1 8 8 GLU H H 1 8.137 0.00 . . . . . . A 557 GLU H . 31112 1
81 . 1 . 1 8 8 GLU HA H 1 4.357 0.00 . . . . . . A 557 GLU HA . 31112 1
82 . 1 . 1 8 8 GLU HB2 H 1 2.099 0.00 . . . . . . A 557 GLU HB2 . 31112 1
83 . 1 . 1 8 8 GLU HB3 H 1 2.008 0.00 . . . . . . A 557 GLU HB3 . 31112 1
84 . 1 . 1 8 8 GLU HG2 H 1 2.449 0.00 . . . . . . A 557 GLU HG2 . 31112 1
85 . 1 . 1 8 8 GLU HG3 H 1 2.449 0.00 . . . . . . A 557 GLU HG3 . 31112 1
86 . 1 . 1 8 8 GLU CA C 13 56.160 0.00 . . . . . . A 557 GLU CA . 31112 1
87 . 1 . 1 8 8 GLU CB C 13 28.819 0.00 . . . . . . A 557 GLU CB . 31112 1
88 . 1 . 1 8 8 GLU CG C 13 33.342 0.00 . . . . . . A 557 GLU CG . 31112 1
89 . 1 . 1 8 8 GLU N N 15 120.433 0.00 . . . . . . A 557 GLU N . 31112 1
90 . 1 . 1 9 9 ILE H H 1 8.114 0.00 . . . . . . A 558 ILE H . 31112 1
91 . 1 . 1 9 9 ILE HA H 1 4.182 0.00 . . . . . . A 558 ILE HA . 31112 1
92 . 1 . 1 9 9 ILE HB H 1 1.909 0.00 . . . . . . A 558 ILE HB . 31112 1
93 . 1 . 1 9 9 ILE HG12 H 1 1.500 0.00 . . . . . . A 558 ILE HG12 . 31112 1
94 . 1 . 1 9 9 ILE HG13 H 1 1.208 0.00 . . . . . . A 558 ILE HG13 . 31112 1
95 . 1 . 1 9 9 ILE HG21 H 1 0.913 0.00 . . . . . . A 558 ILE HG21 . 31112 1
96 . 1 . 1 9 9 ILE HG22 H 1 0.913 0.00 . . . . . . A 558 ILE HG22 . 31112 1
97 . 1 . 1 9 9 ILE HG23 H 1 0.913 0.00 . . . . . . A 558 ILE HG23 . 31112 1
98 . 1 . 1 9 9 ILE HD11 H 1 0.858 0.01 . . . . . . A 558 ILE HD11 . 31112 1
99 . 1 . 1 9 9 ILE HD12 H 1 0.858 0.01 . . . . . . A 558 ILE HD12 . 31112 1
100 . 1 . 1 9 9 ILE HD13 H 1 0.858 0.01 . . . . . . A 558 ILE HD13 . 31112 1
101 . 1 . 1 9 9 ILE CA C 13 61.798 0.00 . . . . . . A 558 ILE CA . 31112 1
102 . 1 . 1 9 9 ILE CB C 13 38.638 0.00 . . . . . . A 558 ILE CB . 31112 1
103 . 1 . 1 9 9 ILE CG1 C 13 27.562 0.01 . . . . . . A 558 ILE CG1 . 31112 1
104 . 1 . 1 9 9 ILE CG2 C 13 17.618 0.00 . . . . . . A 558 ILE CG2 . 31112 1
105 . 1 . 1 9 9 ILE CD1 C 13 13.021 0.00 . . . . . . A 558 ILE CD1 . 31112 1
106 . 1 . 1 9 9 ILE N N 15 121.616 0.00 . . . . . . A 558 ILE N . 31112 1
107 . 1 . 1 10 10 THR H H 1 8.146 0.00 . . . . . . A 559 THR H . 31112 1
108 . 1 . 1 10 10 THR HA H 1 4.313 0.00 . . . . . . A 559 THR HA . 31112 1
109 . 1 . 1 10 10 THR HB H 1 4.245 0.01 . . . . . . A 559 THR HB . 31112 1
110 . 1 . 1 10 10 THR HG21 H 1 1.218 0.00 . . . . . . A 559 THR HG21 . 31112 1
111 . 1 . 1 10 10 THR HG22 H 1 1.218 0.00 . . . . . . A 559 THR HG22 . 31112 1
112 . 1 . 1 10 10 THR HG23 H 1 1.218 0.00 . . . . . . A 559 THR HG23 . 31112 1
113 . 1 . 1 10 10 THR CA C 13 62.466 0.00 . . . . . . A 559 THR CA . 31112 1
114 . 1 . 1 10 10 THR CB C 13 69.854 0.00 . . . . . . A 559 THR CB . 31112 1
115 . 1 . 1 10 10 THR CG2 C 13 21.732 0.00 . . . . . . A 559 THR CG2 . 31112 1
116 . 1 . 1 10 10 THR N N 15 117.661 0.00 . . . . . . A 559 THR N . 31112 1
117 . 1 . 1 11 11 LYS H H 1 8.244 0.00 . . . . . . A 560 LYS H . 31112 1
118 . 1 . 1 11 11 LYS HA H 1 4.283 0.00 . . . . . . A 560 LYS HA . 31112 1
119 . 1 . 1 11 11 LYS HB2 H 1 1.854 0.00 . . . . . . A 560 LYS HB2 . 31112 1
120 . 1 . 1 11 11 LYS HB3 H 1 1.807 0.00 . . . . . . A 560 LYS HB3 . 31112 1
121 . 1 . 1 11 11 LYS HG2 H 1 1.468 0.00 . . . . . . A 560 LYS HG2 . 31112 1
122 . 1 . 1 11 11 LYS HG3 H 1 1.414 0.00 . . . . . . A 560 LYS HG3 . 31112 1
123 . 1 . 1 11 11 LYS HD2 H 1 1.684 0.01 . . . . . . A 560 LYS HD2 . 31112 1
124 . 1 . 1 11 11 LYS HD3 H 1 1.684 0.01 . . . . . . A 560 LYS HD3 . 31112 1
125 . 1 . 1 11 11 LYS HE2 H 1 2.982 0.00 . . . . . . A 560 LYS HE2 . 31112 1
126 . 1 . 1 11 11 LYS HE3 H 1 2.982 0.00 . . . . . . A 560 LYS HE3 . 31112 1
127 . 1 . 1 11 11 LYS CA C 13 57.076 0.00 . . . . . . A 560 LYS CA . 31112 1
128 . 1 . 1 11 11 LYS CB C 13 32.767 0.00 . . . . . . A 560 LYS CB . 31112 1
129 . 1 . 1 11 11 LYS CG C 13 24.868 0.00 . . . . . . A 560 LYS CG . 31112 1
130 . 1 . 1 11 11 LYS CD C 13 29.226 0.00 . . . . . . A 560 LYS CD . 31112 1
131 . 1 . 1 11 11 LYS CE C 13 42.304 0.00 . . . . . . A 560 LYS CE . 31112 1
132 . 1 . 1 11 11 LYS N N 15 123.352 0.00 . . . . . . A 560 LYS N . 31112 1
133 . 1 . 1 12 12 ASP H H 1 8.368 0.00 . . . . . . A 561 ASP H . 31112 1
134 . 1 . 1 12 12 ASP HA H 1 4.707 0.00 . . . . . . A 561 ASP HA . 31112 1
135 . 1 . 1 12 12 ASP HB2 H 1 2.924 0.01 . . . . . . A 561 ASP HB2 . 31112 1
136 . 1 . 1 12 12 ASP HB3 H 1 2.863 0.00 . . . . . . A 561 ASP HB3 . 31112 1
137 . 1 . 1 12 12 ASP CA C 13 53.360 0.00 . . . . . . A 561 ASP CA . 31112 1
138 . 1 . 1 12 12 ASP CB C 13 38.704 0.00 . . . . . . A 561 ASP CB . 31112 1
139 . 1 . 1 12 12 ASP N N 15 119.670 0.00 . . . . . . A 561 ASP N . 31112 1
140 . 1 . 1 13 13 SER H H 1 8.299 0.00 . . . . . . A 562 SER H . 31112 1
141 . 1 . 1 13 13 SER HA H 1 4.379 0.00 . . . . . . A 562 SER HA . 31112 1
142 . 1 . 1 13 13 SER HB2 H 1 3.998 0.00 . . . . . . A 562 SER HB2 . 31112 1
143 . 1 . 1 13 13 SER HB3 H 1 3.918 0.00 . . . . . . A 562 SER HB3 . 31112 1
144 . 1 . 1 13 13 SER CA C 13 59.426 0.00 . . . . . . A 562 SER CA . 31112 1
145 . 1 . 1 13 13 SER CB C 13 63.748 0.01 . . . . . . A 562 SER CB . 31112 1
146 . 1 . 1 13 13 SER N N 15 117.001 0.00 . . . . . . A 562 SER N . 31112 1
147 . 1 . 1 14 14 LYS H H 1 8.290 0.00 . . . . . . A 563 LYS H . 31112 1
148 . 1 . 1 14 14 LYS HA H 1 4.222 0.00 . . . . . . A 563 LYS HA . 31112 1
149 . 1 . 1 14 14 LYS HB2 H 1 1.874 0.00 . . . . . . A 563 LYS HB2 . 31112 1
150 . 1 . 1 14 14 LYS HB3 H 1 1.874 0.00 . . . . . . A 563 LYS HB3 . 31112 1
151 . 1 . 1 14 14 LYS HG2 H 1 1.428 0.00 . . . . . . A 563 LYS HG2 . 31112 1
152 . 1 . 1 14 14 LYS HG3 H 1 1.428 0.00 . . . . . . A 563 LYS HG3 . 31112 1
153 . 1 . 1 14 14 LYS HD2 H 1 1.704 0.00 . . . . . . A 563 LYS HD2 . 31112 1
154 . 1 . 1 14 14 LYS HD3 H 1 1.511 0.00 . . . . . . A 563 LYS HD3 . 31112 1
155 . 1 . 1 14 14 LYS HE2 H 1 3.003 0.00 . . . . . . A 563 LYS HE2 . 31112 1
156 . 1 . 1 14 14 LYS HE3 H 1 3.003 0.00 . . . . . . A 563 LYS HE3 . 31112 1
157 . 1 . 1 14 14 LYS CA C 13 57.291 0.00 . . . . . . A 563 LYS CA . 31112 1
158 . 1 . 1 14 14 LYS CB C 13 32.640 0.00 . . . . . . A 563 LYS CB . 31112 1
159 . 1 . 1 14 14 LYS CG C 13 24.980 0.00 . . . . . . A 563 LYS CG . 31112 1
160 . 1 . 1 14 14 LYS CD C 13 29.241 0.00 . . . . . . A 563 LYS CD . 31112 1
161 . 1 . 1 14 14 LYS CE C 13 42.242 0.00 . . . . . . A 563 LYS CE . 31112 1
162 . 1 . 1 14 14 LYS N N 15 122.628 0.00 . . . . . . A 563 LYS N . 31112 1
163 . 1 . 1 15 15 MET H H 1 8.137 0.00 . . . . . . A 564 MET H . 31112 1
164 . 1 . 1 15 15 MET HA H 1 4.374 0.00 . . . . . . A 564 MET HA . 31112 1
165 . 1 . 1 15 15 MET HB2 H 1 2.084 0.00 . . . . . . A 564 MET HB2 . 31112 1
166 . 1 . 1 15 15 MET HB3 H 1 2.084 0.00 . . . . . . A 564 MET HB3 . 31112 1
167 . 1 . 1 15 15 MET HG2 H 1 2.657 0.01 . . . . . . A 564 MET HG2 . 31112 1
168 . 1 . 1 15 15 MET HG3 H 1 2.567 0.00 . . . . . . A 564 MET HG3 . 31112 1
169 . 1 . 1 15 15 MET HE1 H 1 2.087 0.00 . . . . . . A 564 MET HE1 . 31112 1
170 . 1 . 1 15 15 MET HE2 H 1 2.087 0.00 . . . . . . A 564 MET HE2 . 31112 1
171 . 1 . 1 15 15 MET HE3 H 1 2.087 0.00 . . . . . . A 564 MET HE3 . 31112 1
172 . 1 . 1 15 15 MET CA C 13 56.665 0.00 . . . . . . A 564 MET CA . 31112 1
173 . 1 . 1 15 15 MET CB C 13 32.565 0.00 . . . . . . A 564 MET CB . 31112 1
174 . 1 . 1 15 15 MET CG C 13 32.234 0.00 . . . . . . A 564 MET CG . 31112 1
175 . 1 . 1 15 15 MET CE C 13 17.127 0.00 . . . . . . A 564 MET CE . 31112 1
176 . 1 . 1 15 15 MET N N 15 119.112 0.00 . . . . . . A 564 MET N . 31112 1
177 . 1 . 1 16 16 GLN H H 1 8.186 0.00 . . . . . . A 565 GLN H . 31112 1
178 . 1 . 1 16 16 GLN HA H 1 4.218 0.00 . . . . . . A 565 GLN HA . 31112 1
179 . 1 . 1 16 16 GLN HB2 H 1 2.094 0.00 . . . . . . A 565 GLN HB2 . 31112 1
180 . 1 . 1 16 16 GLN HB3 H 1 2.094 0.00 . . . . . . A 565 GLN HB3 . 31112 1
181 . 1 . 1 16 16 GLN HG2 H 1 2.416 0.00 . . . . . . A 565 GLN HG2 . 31112 1
182 . 1 . 1 16 16 GLN HG3 H 1 2.367 0.00 . . . . . . A 565 GLN HG3 . 31112 1
183 . 1 . 1 16 16 GLN HE21 H 1 7.453 0.00 . . . . . . A 565 GLN HE21 . 31112 1
184 . 1 . 1 16 16 GLN HE22 H 1 6.831 0.00 . . . . . . A 565 GLN HE22 . 31112 1
185 . 1 . 1 16 16 GLN CA C 13 57.870 0.00 . . . . . . A 565 GLN CA . 31112 1
186 . 1 . 1 16 16 GLN CB C 13 29.150 0.00 . . . . . . A 565 GLN CB . 31112 1
187 . 1 . 1 16 16 GLN CG C 13 34.037 0.00 . . . . . . A 565 GLN CG . 31112 1
188 . 1 . 1 16 16 GLN N N 15 121.073 0.00 . . . . . . A 565 GLN N . 31112 1
189 . 1 . 1 16 16 GLN NE2 N 15 111.868 0.01 . . . . . . A 565 GLN NE2 . 31112 1
190 . 1 . 1 17 17 LYS H H 1 8.196 0.00 . . . . . . A 566 LYS H . 31112 1
191 . 1 . 1 17 17 LYS HA H 1 4.173 0.00 . . . . . . A 566 LYS HA . 31112 1
192 . 1 . 1 17 17 LYS HB2 H 1 1.858 0.00 . . . . . . A 566 LYS HB2 . 31112 1
193 . 1 . 1 17 17 LYS HB3 H 1 1.858 0.00 . . . . . . A 566 LYS HB3 . 31112 1
194 . 1 . 1 17 17 LYS HG2 H 1 1.519 0.00 . . . . . . A 566 LYS HG2 . 31112 1
195 . 1 . 1 17 17 LYS HG3 H 1 1.421 0.00 . . . . . . A 566 LYS HG3 . 31112 1
196 . 1 . 1 17 17 LYS HD2 H 1 1.685 0.00 . . . . . . A 566 LYS HD2 . 31112 1
197 . 1 . 1 17 17 LYS HD3 H 1 1.685 0.00 . . . . . . A 566 LYS HD3 . 31112 1
198 . 1 . 1 17 17 LYS HE2 H 1 3.002 0.01 . . . . . . A 566 LYS HE2 . 31112 1
199 . 1 . 1 17 17 LYS HE3 H 1 3.002 0.01 . . . . . . A 566 LYS HE3 . 31112 1
200 . 1 . 1 17 17 LYS CA C 13 57.741 0.00 . . . . . . A 566 LYS CA . 31112 1
201 . 1 . 1 17 17 LYS CB C 13 32.641 0.00 . . . . . . A 566 LYS CB . 31112 1
202 . 1 . 1 17 17 LYS CG C 13 25.033 0.00 . . . . . . A 566 LYS CG . 31112 1
203 . 1 . 1 17 17 LYS CD C 13 29.202 0.00 . . . . . . A 566 LYS CD . 31112 1
204 . 1 . 1 17 17 LYS CE C 13 42.187 0.00 . . . . . . A 566 LYS CE . 31112 1
205 . 1 . 1 17 17 LYS N N 15 121.197 0.00 . . . . . . A 566 LYS N . 31112 1
206 . 1 . 1 18 18 LEU H H 1 8.071 0.00 . . . . . . A 567 LEU H . 31112 1
207 . 1 . 1 18 18 LEU HA H 1 4.255 0.00 . . . . . . A 567 LEU HA . 31112 1
208 . 1 . 1 18 18 LEU HB2 H 1 1.739 0.00 . . . . . . A 567 LEU HB2 . 31112 1
209 . 1 . 1 18 18 LEU HB3 H 1 1.592 0.00 . . . . . . A 567 LEU HB3 . 31112 1
210 . 1 . 1 18 18 LEU HG H 1 1.698 0.00 . . . . . . A 567 LEU HG . 31112 1
211 . 1 . 1 18 18 LEU HD11 H 1 0.922 0.00 . . . . . . A 567 LEU HD11 . 31112 1
212 . 1 . 1 18 18 LEU HD12 H 1 0.922 0.00 . . . . . . A 567 LEU HD12 . 31112 1
213 . 1 . 1 18 18 LEU HD13 H 1 0.922 0.00 . . . . . . A 567 LEU HD13 . 31112 1
214 . 1 . 1 18 18 LEU HD21 H 1 0.870 0.00 . . . . . . A 567 LEU HD21 . 31112 1
215 . 1 . 1 18 18 LEU HD22 H 1 0.870 0.00 . . . . . . A 567 LEU HD22 . 31112 1
216 . 1 . 1 18 18 LEU HD23 H 1 0.870 0.00 . . . . . . A 567 LEU HD23 . 31112 1
217 . 1 . 1 18 18 LEU CA C 13 56.327 0.00 . . . . . . A 567 LEU CA . 31112 1
218 . 1 . 1 18 18 LEU CB C 13 42.259 0.00 . . . . . . A 567 LEU CB . 31112 1
219 . 1 . 1 18 18 LEU CG C 13 27.040 0.00 . . . . . . A 567 LEU CG . 31112 1
220 . 1 . 1 18 18 LEU CD1 C 13 24.691 0.00 . . . . . . A 567 LEU CD1 . 31112 1
221 . 1 . 1 18 18 LEU CD2 C 13 24.017 0.00 . . . . . . A 567 LEU CD2 . 31112 1
222 . 1 . 1 18 18 LEU N N 15 121.797 0.00 . . . . . . A 567 LEU N . 31112 1
223 . 1 . 1 19 19 ALA H H 1 8.129 0.00 . . . . . . A 568 ALA H . 31112 1
224 . 1 . 1 19 19 ALA HA H 1 4.278 0.00 . . . . . . A 568 ALA HA . 31112 1
225 . 1 . 1 19 19 ALA HB1 H 1 1.455 0.00 . . . . . . A 568 ALA HB1 . 31112 1
226 . 1 . 1 19 19 ALA HB2 H 1 1.455 0.00 . . . . . . A 568 ALA HB2 . 31112 1
227 . 1 . 1 19 19 ALA HB3 H 1 1.455 0.00 . . . . . . A 568 ALA HB3 . 31112 1
228 . 1 . 1 19 19 ALA CA C 13 53.444 0.00 . . . . . . A 568 ALA CA . 31112 1
229 . 1 . 1 19 19 ALA CB C 13 18.771 0.00 . . . . . . A 568 ALA CB . 31112 1
230 . 1 . 1 19 19 ALA N N 15 124.079 0.00 . . . . . . A 568 ALA N . 31112 1
231 . 1 . 1 20 20 LEU H H 1 8.085 0.00 . . . . . . A 569 LEU H . 31112 1
232 . 1 . 1 20 20 LEU HA H 1 4.258 0.00 . . . . . . A 569 LEU HA . 31112 1
233 . 1 . 1 20 20 LEU HB2 H 1 1.695 0.00 . . . . . . A 569 LEU HB2 . 31112 1
234 . 1 . 1 20 20 LEU HB3 H 1 1.695 0.00 . . . . . . A 569 LEU HB3 . 31112 1
235 . 1 . 1 20 20 LEU HG H 1 1.670 0.00 . . . . . . A 569 LEU HG . 31112 1
236 . 1 . 1 20 20 LEU HD11 H 1 0.922 0.00 . . . . . . A 569 LEU HD11 . 31112 1
237 . 1 . 1 20 20 LEU HD12 H 1 0.922 0.00 . . . . . . A 569 LEU HD12 . 31112 1
238 . 1 . 1 20 20 LEU HD13 H 1 0.922 0.00 . . . . . . A 569 LEU HD13 . 31112 1
239 . 1 . 1 20 20 LEU HD21 H 1 0.867 0.00 . . . . . . A 569 LEU HD21 . 31112 1
240 . 1 . 1 20 20 LEU HD22 H 1 0.867 0.00 . . . . . . A 569 LEU HD22 . 31112 1
241 . 1 . 1 20 20 LEU HD23 H 1 0.867 0.00 . . . . . . A 569 LEU HD23 . 31112 1
242 . 1 . 1 20 20 LEU CA C 13 56.443 0.00 . . . . . . A 569 LEU CA . 31112 1
243 . 1 . 1 20 20 LEU CB C 13 42.199 0.00 . . . . . . A 569 LEU CB . 31112 1
244 . 1 . 1 20 20 LEU CG C 13 27.304 0.00 . . . . . . A 569 LEU CG . 31112 1
245 . 1 . 1 20 20 LEU CD1 C 13 25.086 0.00 . . . . . . A 569 LEU CD1 . 31112 1
246 . 1 . 1 20 20 LEU CD2 C 13 24.134 0.00 . . . . . . A 569 LEU CD2 . 31112 1
247 . 1 . 1 20 20 LEU N N 15 120.567 0.00 . . . . . . A 569 LEU N . 31112 1
248 . 1 . 1 21 21 ALA H H 1 8.080 0.00 . . . . . . A 570 ALA H . 31112 1
249 . 1 . 1 21 21 ALA HA H 1 4.191 0.00 . . . . . . A 570 ALA HA . 31112 1
250 . 1 . 1 21 21 ALA HB1 H 1 1.449 0.00 . . . . . . A 570 ALA HB1 . 31112 1
251 . 1 . 1 21 21 ALA HB2 H 1 1.449 0.00 . . . . . . A 570 ALA HB2 . 31112 1
252 . 1 . 1 21 21 ALA HB3 H 1 1.449 0.00 . . . . . . A 570 ALA HB3 . 31112 1
253 . 1 . 1 21 21 ALA CA C 13 54.050 0.00 . . . . . . A 570 ALA CA . 31112 1
254 . 1 . 1 21 21 ALA CB C 13 18.784 0.00 . . . . . . A 570 ALA CB . 31112 1
255 . 1 . 1 21 21 ALA N N 15 122.280 0.00 . . . . . . A 570 ALA N . 31112 1
256 . 1 . 1 22 22 GLY H H 1 8.165 0.00 . . . . . . A 571 GLY H . 31112 1
257 . 1 . 1 22 22 GLY HA2 H 1 3.922 0.00 . . . . . . A 571 GLY HA2 . 31112 1
258 . 1 . 1 22 22 GLY HA3 H 1 3.886 0.00 . . . . . . A 571 GLY HA3 . 31112 1
259 . 1 . 1 22 22 GLY CA C 13 46.229 0.00 . . . . . . A 571 GLY CA . 31112 1
260 . 1 . 1 22 22 GLY N N 15 106.338 0.00 . . . . . . A 571 GLY N . 31112 1
261 . 1 . 1 23 23 PHE H H 1 7.971 0.00 . . . . . . A 572 PHE H . 31112 1
262 . 1 . 1 23 23 PHE HA H 1 4.473 0.00 . . . . . . A 572 PHE HA . 31112 1
263 . 1 . 1 23 23 PHE HB2 H 1 3.157 0.01 . . . . . . A 572 PHE HB2 . 31112 1
264 . 1 . 1 23 23 PHE HB3 H 1 3.133 0.00 . . . . . . A 572 PHE HB3 . 31112 1
265 . 1 . 1 23 23 PHE HD1 H 1 7.203 0.00 . . . . . . A 572 PHE HD1 . 31112 1
266 . 1 . 1 23 23 PHE HD2 H 1 7.203 0.00 . . . . . . A 572 PHE HD2 . 31112 1
267 . 1 . 1 23 23 PHE HE1 H 1 7.278 0.00 . . . . . . A 572 PHE HE1 . 31112 1
268 . 1 . 1 23 23 PHE HE2 H 1 7.278 0.00 . . . . . . A 572 PHE HE2 . 31112 1
269 . 1 . 1 23 23 PHE HZ H 1 7.232 0.00 . . . . . . A 572 PHE HZ . 31112 1
270 . 1 . 1 23 23 PHE CA C 13 59.343 0.00 . . . . . . A 572 PHE CA . 31112 1
271 . 1 . 1 23 23 PHE CB C 13 39.502 0.01 . . . . . . A 572 PHE CB . 31112 1
272 . 1 . 1 23 23 PHE CD2 C 13 131.841 0.00 . . . . . . A 572 PHE CD2 . 31112 1
273 . 1 . 1 23 23 PHE CE1 C 13 131.380 0.00 . . . . . . A 572 PHE CE1 . 31112 1
274 . 1 . 1 23 23 PHE CZ C 13 129.814 0.00 . . . . . . A 572 PHE CZ . 31112 1
275 . 1 . 1 23 23 PHE N N 15 121.288 0.00 . . . . . . A 572 PHE N . 31112 1
276 . 1 . 1 24 24 LEU H H 1 8.138 0.00 . . . . . . A 573 LEU H . 31112 1
277 . 1 . 1 24 24 LEU HA H 1 4.101 0.00 . . . . . . A 573 LEU HA . 31112 1
278 . 1 . 1 24 24 LEU HB2 H 1 1.721 0.00 . . . . . . A 573 LEU HB2 . 31112 1
279 . 1 . 1 24 24 LEU HB3 H 1 1.503 0.01 . . . . . . A 573 LEU HB3 . 31112 1
280 . 1 . 1 24 24 LEU HG H 1 1.682 0.00 . . . . . . A 573 LEU HG . 31112 1
281 . 1 . 1 24 24 LEU HD11 H 1 0.904 0.00 . . . . . . A 573 LEU HD11 . 31112 1
282 . 1 . 1 24 24 LEU HD12 H 1 0.904 0.00 . . . . . . A 573 LEU HD12 . 31112 1
283 . 1 . 1 24 24 LEU HD13 H 1 0.904 0.00 . . . . . . A 573 LEU HD13 . 31112 1
284 . 1 . 1 24 24 LEU HD21 H 1 0.852 0.00 . . . . . . A 573 LEU HD21 . 31112 1
285 . 1 . 1 24 24 LEU HD22 H 1 0.852 0.00 . . . . . . A 573 LEU HD22 . 31112 1
286 . 1 . 1 24 24 LEU HD23 H 1 0.852 0.00 . . . . . . A 573 LEU HD23 . 31112 1
287 . 1 . 1 24 24 LEU CA C 13 56.229 0.00 . . . . . . A 573 LEU CA . 31112 1
288 . 1 . 1 24 24 LEU CB C 13 41.946 0.00 . . . . . . A 573 LEU CB . 31112 1
289 . 1 . 1 24 24 LEU CG C 13 26.988 0.00 . . . . . . A 573 LEU CG . 31112 1
290 . 1 . 1 24 24 LEU CD1 C 13 25.206 0.00 . . . . . . A 573 LEU CD1 . 31112 1
291 . 1 . 1 24 24 LEU CD2 C 13 23.360 0.00 . . . . . . A 573 LEU CD2 . 31112 1
292 . 1 . 1 24 24 LEU N N 15 120.246 0.00 . . . . . . A 573 LEU N . 31112 1
293 . 1 . 1 25 25 LYS H H 1 7.855 0.00 . . . . . . A 574 LYS H . 31112 1
294 . 1 . 1 25 25 LYS HA H 1 4.154 0.00 . . . . . . A 574 LYS HA . 31112 1
295 . 1 . 1 25 25 LYS HB2 H 1 1.841 0.00 . . . . . . A 574 LYS HB2 . 31112 1
296 . 1 . 1 25 25 LYS HB3 H 1 1.841 0.00 . . . . . . A 574 LYS HB3 . 31112 1
297 . 1 . 1 25 25 LYS HG2 H 1 1.495 0.00 . . . . . . A 574 LYS HG2 . 31112 1
298 . 1 . 1 25 25 LYS HG3 H 1 1.421 0.01 . . . . . . A 574 LYS HG3 . 31112 1
299 . 1 . 1 25 25 LYS HD2 H 1 1.687 0.00 . . . . . . A 574 LYS HD2 . 31112 1
300 . 1 . 1 25 25 LYS HD3 H 1 1.687 0.00 . . . . . . A 574 LYS HD3 . 31112 1
301 . 1 . 1 25 25 LYS HE2 H 1 2.986 0.00 . . . . . . A 574 LYS HE2 . 31112 1
302 . 1 . 1 25 25 LYS HE3 H 1 2.986 0.00 . . . . . . A 574 LYS HE3 . 31112 1
303 . 1 . 1 25 25 LYS CA C 13 57.571 0.00 . . . . . . A 574 LYS CA . 31112 1
304 . 1 . 1 25 25 LYS CB C 13 32.935 0.00 . . . . . . A 574 LYS CB . 31112 1
305 . 1 . 1 25 25 LYS CG C 13 24.989 0.01 . . . . . . A 574 LYS CG . 31112 1
306 . 1 . 1 25 25 LYS CD C 13 29.243 0.00 . . . . . . A 574 LYS CD . 31112 1
307 . 1 . 1 25 25 LYS CE C 13 42.227 0.00 . . . . . . A 574 LYS CE . 31112 1
308 . 1 . 1 25 25 LYS N N 15 119.707 0.00 . . . . . . A 574 LYS N . 31112 1
309 . 1 . 1 26 26 LYS H H 1 7.886 0.01 . . . . . . A 575 LYS H . 31112 1
310 . 1 . 1 26 26 LYS HA H 1 4.243 0.00 . . . . . . A 575 LYS HA . 31112 1
311 . 1 . 1 26 26 LYS HB2 H 1 1.812 0.00 . . . . . . A 575 LYS HB2 . 31112 1
312 . 1 . 1 26 26 LYS HB3 H 1 1.812 0.00 . . . . . . A 575 LYS HB3 . 31112 1
313 . 1 . 1 26 26 LYS HG2 H 1 1.452 0.00 . . . . . . A 575 LYS HG2 . 31112 1
314 . 1 . 1 26 26 LYS HG3 H 1 1.370 0.01 . . . . . . A 575 LYS HG3 . 31112 1
315 . 1 . 1 26 26 LYS HD2 H 1 1.665 0.00 . . . . . . A 575 LYS HD2 . 31112 1
316 . 1 . 1 26 26 LYS HD3 H 1 1.665 0.00 . . . . . . A 575 LYS HD3 . 31112 1
317 . 1 . 1 26 26 LYS HE2 H 1 2.971 0.00 . . . . . . A 575 LYS HE2 . 31112 1
318 . 1 . 1 26 26 LYS HE3 H 1 2.971 0.00 . . . . . . A 575 LYS HE3 . 31112 1
319 . 1 . 1 26 26 LYS CA C 13 57.166 0.00 . . . . . . A 575 LYS CA . 31112 1
320 . 1 . 1 26 26 LYS CB C 13 32.923 0.00 . . . . . . A 575 LYS CB . 31112 1
321 . 1 . 1 26 26 LYS CG C 13 25.010 0.00 . . . . . . A 575 LYS CG . 31112 1
322 . 1 . 1 26 26 LYS CD C 13 29.223 0.00 . . . . . . A 575 LYS CD . 31112 1
323 . 1 . 1 26 26 LYS CE C 13 42.235 0.00 . . . . . . A 575 LYS CE . 31112 1
324 . 1 . 1 26 26 LYS N N 15 120.360 0.00 . . . . . . A 575 LYS N . 31112 1
325 . 1 . 1 27 27 ILE H H 1 7.784 0.00 . . . . . . A 576 ILE H . 31112 1
326 . 1 . 1 27 27 ILE HA H 1 4.165 0.00 . . . . . . A 576 ILE HA . 31112 1
327 . 1 . 1 27 27 ILE HB H 1 1.823 0.00 . . . . . . A 576 ILE HB . 31112 1
328 . 1 . 1 27 27 ILE HG12 H 1 1.326 0.00 . . . . . . A 576 ILE HG12 . 31112 1
329 . 1 . 1 27 27 ILE HG13 H 1 1.104 0.00 . . . . . . A 576 ILE HG13 . 31112 1
330 . 1 . 1 27 27 ILE HG21 H 1 0.767 0.00 . . . . . . A 576 ILE HG21 . 31112 1
331 . 1 . 1 27 27 ILE HG22 H 1 0.767 0.00 . . . . . . A 576 ILE HG22 . 31112 1
332 . 1 . 1 27 27 ILE HG23 H 1 0.767 0.00 . . . . . . A 576 ILE HG23 . 31112 1
333 . 1 . 1 27 27 ILE HD11 H 1 0.730 0.00 . . . . . . A 576 ILE HD11 . 31112 1
334 . 1 . 1 27 27 ILE HD12 H 1 0.730 0.00 . . . . . . A 576 ILE HD12 . 31112 1
335 . 1 . 1 27 27 ILE HD13 H 1 0.730 0.00 . . . . . . A 576 ILE HD13 . 31112 1
336 . 1 . 1 27 27 ILE CA C 13 61.218 0.00 . . . . . . A 576 ILE CA . 31112 1
337 . 1 . 1 27 27 ILE CB C 13 38.681 0.00 . . . . . . A 576 ILE CB . 31112 1
338 . 1 . 1 27 27 ILE CG1 C 13 26.974 0.00 . . . . . . A 576 ILE CG1 . 31112 1
339 . 1 . 1 27 27 ILE CG2 C 13 17.717 0.00 . . . . . . A 576 ILE CG2 . 31112 1
340 . 1 . 1 27 27 ILE CD1 C 13 13.430 0.00 . . . . . . A 576 ILE CD1 . 31112 1
341 . 1 . 1 27 27 ILE N N 15 120.442 0.00 . . . . . . A 576 ILE N . 31112 1
342 . 1 . 1 28 28 LYS H H 1 8.078 0.00 . . . . . . A 577 LYS H . 31112 1
343 . 1 . 1 28 28 LYS HA H 1 4.219 0.00 . . . . . . A 577 LYS HA . 31112 1
344 . 1 . 1 28 28 LYS HB2 H 1 1.853 0.00 . . . . . . A 577 LYS HB2 . 31112 1
345 . 1 . 1 28 28 LYS HB3 H 1 1.853 0.00 . . . . . . A 577 LYS HB3 . 31112 1
346 . 1 . 1 28 28 LYS HG2 H 1 1.471 0.00 . . . . . . A 577 LYS HG2 . 31112 1
347 . 1 . 1 28 28 LYS HG3 H 1 1.471 0.00 . . . . . . A 577 LYS HG3 . 31112 1
348 . 1 . 1 28 28 LYS HD2 H 1 1.673 0.00 . . . . . . A 577 LYS HD2 . 31112 1
349 . 1 . 1 28 28 LYS HD3 H 1 1.673 0.00 . . . . . . A 577 LYS HD3 . 31112 1
350 . 1 . 1 28 28 LYS HE2 H 1 2.993 0.00 . . . . . . A 577 LYS HE2 . 31112 1
351 . 1 . 1 28 28 LYS HE3 H 1 2.993 0.00 . . . . . . A 577 LYS HE3 . 31112 1
352 . 1 . 1 28 28 LYS CA C 13 57.227 0.00 . . . . . . A 577 LYS CA . 31112 1
353 . 1 . 1 28 28 LYS CB C 13 32.884 0.00 . . . . . . A 577 LYS CB . 31112 1
354 . 1 . 1 28 28 LYS CG C 13 24.910 0.00 . . . . . . A 577 LYS CG . 31112 1
355 . 1 . 1 28 28 LYS CD C 13 29.295 0.00 . . . . . . A 577 LYS CD . 31112 1
356 . 1 . 1 28 28 LYS CE C 13 42.191 0.00 . . . . . . A 577 LYS CE . 31112 1
357 . 1 . 1 28 28 LYS N N 15 121.841 0.00 . . . . . . A 577 LYS N . 31112 1
358 . 1 . 1 29 29 GLY H H 1 8.453 0.00 . . . . . . A 578 GLY H . 31112 1
359 . 1 . 1 29 29 GLY HA2 H 1 4.021 0.00 . . . . . . A 578 GLY HA2 . 31112 1
360 . 1 . 1 29 29 GLY HA3 H 1 3.976 0.01 . . . . . . A 578 GLY HA3 . 31112 1
361 . 1 . 1 29 29 GLY CA C 13 45.799 0.01 . . . . . . A 578 GLY CA . 31112 1
362 . 1 . 1 29 29 GLY N N 15 110.140 0.00 . . . . . . A 578 GLY N . 31112 1
363 . 1 . 1 30 30 THR H H 1 7.940 0.00 . . . . . . A 579 THR H . 31112 1
364 . 1 . 1 30 30 THR HA H 1 4.380 0.00 . . . . . . A 579 THR HA . 31112 1
365 . 1 . 1 30 30 THR HB H 1 4.255 0.00 . . . . . . A 579 THR HB . 31112 1
366 . 1 . 1 30 30 THR HG21 H 1 1.180 0.00 . . . . . . A 579 THR HG21 . 31112 1
367 . 1 . 1 30 30 THR HG22 H 1 1.180 0.00 . . . . . . A 579 THR HG22 . 31112 1
368 . 1 . 1 30 30 THR HG23 H 1 1.180 0.00 . . . . . . A 579 THR HG23 . 31112 1
369 . 1 . 1 30 30 THR CA C 13 62.454 0.00 . . . . . . A 579 THR CA . 31112 1
370 . 1 . 1 30 30 THR CB C 13 70.455 0.00 . . . . . . A 579 THR CB . 31112 1
371 . 1 . 1 30 30 THR CG2 C 13 21.603 0.00 . . . . . . A 579 THR CG2 . 31112 1
372 . 1 . 1 30 30 THR N N 15 112.868 0.00 . . . . . . A 579 THR N . 31112 1
373 . 1 . 1 31 31 TYR H H 1 8.381 0.00 . . . . . . A 580 TYR H . 31112 1
374 . 1 . 1 31 31 TYR HA H 1 4.528 0.00 . . . . . . A 580 TYR HA . 31112 1
375 . 1 . 1 31 31 TYR HB2 H 1 3.101 0.00 . . . . . . A 580 TYR HB2 . 31112 1
376 . 1 . 1 31 31 TYR HB3 H 1 3.042 0.00 . . . . . . A 580 TYR HB3 . 31112 1
377 . 1 . 1 31 31 TYR HD1 H 1 7.093 0.00 . . . . . . A 580 TYR HD1 . 31112 1
378 . 1 . 1 31 31 TYR HD2 H 1 7.093 0.00 . . . . . . A 580 TYR HD2 . 31112 1
379 . 1 . 1 31 31 TYR HE1 H 1 6.806 0.00 . . . . . . A 580 TYR HE1 . 31112 1
380 . 1 . 1 31 31 TYR HE2 H 1 6.806 0.00 . . . . . . A 580 TYR HE2 . 31112 1
381 . 1 . 1 31 31 TYR CA C 13 59.312 0.00 . . . . . . A 580 TYR CA . 31112 1
382 . 1 . 1 31 31 TYR CB C 13 38.491 0.00 . . . . . . A 580 TYR CB . 31112 1
383 . 1 . 1 31 31 TYR CD1 C 13 133.135 0.00 . . . . . . A 580 TYR CD1 . 31112 1
384 . 1 . 1 31 31 TYR CE1 C 13 118.304 0.00 . . . . . . A 580 TYR CE1 . 31112 1
385 . 1 . 1 31 31 TYR N N 15 122.919 0.00 . . . . . . A 580 TYR N . 31112 1
386 . 1 . 1 32 32 ILE H H 1 7.906 0.01 . . . . . . A 581 ILE H . 31112 1
387 . 1 . 1 32 32 ILE HA H 1 3.797 0.00 . . . . . . A 581 ILE HA . 31112 1
388 . 1 . 1 32 32 ILE HB H 1 1.808 0.00 . . . . . . A 581 ILE HB . 31112 1
389 . 1 . 1 32 32 ILE HG12 H 1 1.409 0.00 . . . . . . A 581 ILE HG12 . 31112 1
390 . 1 . 1 32 32 ILE HG13 H 1 1.142 0.00 . . . . . . A 581 ILE HG13 . 31112 1
391 . 1 . 1 32 32 ILE HG21 H 1 0.830 0.00 . . . . . . A 581 ILE HG21 . 31112 1
392 . 1 . 1 32 32 ILE HG22 H 1 0.830 0.00 . . . . . . A 581 ILE HG22 . 31112 1
393 . 1 . 1 32 32 ILE HG23 H 1 0.830 0.00 . . . . . . A 581 ILE HG23 . 31112 1
394 . 1 . 1 32 32 ILE HD11 H 1 0.809 0.00 . . . . . . A 581 ILE HD11 . 31112 1
395 . 1 . 1 32 32 ILE HD12 H 1 0.809 0.00 . . . . . . A 581 ILE HD12 . 31112 1
396 . 1 . 1 32 32 ILE HD13 H 1 0.809 0.00 . . . . . . A 581 ILE HD13 . 31112 1
397 . 1 . 1 32 32 ILE CA C 13 62.522 0.00 . . . . . . A 581 ILE CA . 31112 1
398 . 1 . 1 32 32 ILE CB C 13 37.994 0.00 . . . . . . A 581 ILE CB . 31112 1
399 . 1 . 1 32 32 ILE CG1 C 13 28.101 0.02 . . . . . . A 581 ILE CG1 . 31112 1
400 . 1 . 1 32 32 ILE CG2 C 13 17.655 0.00 . . . . . . A 581 ILE CG2 . 31112 1
401 . 1 . 1 32 32 ILE CD1 C 13 12.668 0.00 . . . . . . A 581 ILE CD1 . 31112 1
402 . 1 . 1 32 32 ILE N N 15 121.034 0.00 . . . . . . A 581 ILE N . 31112 1
403 . 1 . 1 33 33 GLU H H 1 7.985 0.00 . . . . . . A 582 GLU H . 31112 1
404 . 1 . 1 33 33 GLU HA H 1 4.049 0.00 . . . . . . A 582 GLU HA . 31112 1
405 . 1 . 1 33 33 GLU HB2 H 1 2.119 0.01 . . . . . . A 582 GLU HB2 . 31112 1
406 . 1 . 1 33 33 GLU HB3 H 1 2.081 0.00 . . . . . . A 582 GLU HB3 . 31112 1
407 . 1 . 1 33 33 GLU HG2 H 1 2.456 0.00 . . . . . . A 582 GLU HG2 . 31112 1
408 . 1 . 1 33 33 GLU HG3 H 1 2.456 0.00 . . . . . . A 582 GLU HG3 . 31112 1
409 . 1 . 1 33 33 GLU CA C 13 58.139 0.00 . . . . . . A 582 GLU CA . 31112 1
410 . 1 . 1 33 33 GLU CB C 13 28.258 0.00 . . . . . . A 582 GLU CB . 31112 1
411 . 1 . 1 33 33 GLU CG C 13 33.103 0.00 . . . . . . A 582 GLU CG . 31112 1
412 . 1 . 1 33 33 GLU N N 15 118.689 0.00 . . . . . . A 582 GLU N . 31112 1
413 . 1 . 1 34 34 SER H H 1 7.954 0.00 . . . . . . A 583 SER H . 31112 1
414 . 1 . 1 34 34 SER HA H 1 4.262 0.00 . . . . . . A 583 SER HA . 31112 1
415 . 1 . 1 34 34 SER HB2 H 1 3.936 0.00 . . . . . . A 583 SER HB2 . 31112 1
416 . 1 . 1 34 34 SER HB3 H 1 3.899 0.00 . . . . . . A 583 SER HB3 . 31112 1
417 . 1 . 1 34 34 SER CA C 13 60.384 0.00 . . . . . . A 583 SER CA . 31112 1
418 . 1 . 1 34 34 SER CB C 13 63.141 0.00 . . . . . . A 583 SER CB . 31112 1
419 . 1 . 1 34 34 SER N N 15 115.430 0.00 . . . . . . A 583 SER N . 31112 1
420 . 1 . 1 35 35 LEU H H 1 7.966 0.00 . . . . . . A 584 LEU H . 31112 1
421 . 1 . 1 35 35 LEU HA H 1 4.162 0.01 . . . . . . A 584 LEU HA . 31112 1
422 . 1 . 1 35 35 LEU HB2 H 1 1.766 0.00 . . . . . . A 584 LEU HB2 . 31112 1
423 . 1 . 1 35 35 LEU HB3 H 1 1.533 0.01 . . . . . . A 584 LEU HB3 . 31112 1
424 . 1 . 1 35 35 LEU HG H 1 1.729 0.00 . . . . . . A 584 LEU HG . 31112 1
425 . 1 . 1 35 35 LEU HD11 H 1 0.868 0.00 . . . . . . A 584 LEU HD11 . 31112 1
426 . 1 . 1 35 35 LEU HD12 H 1 0.868 0.00 . . . . . . A 584 LEU HD12 . 31112 1
427 . 1 . 1 35 35 LEU HD13 H 1 0.868 0.00 . . . . . . A 584 LEU HD13 . 31112 1
428 . 1 . 1 35 35 LEU HD21 H 1 0.834 0.00 . . . . . . A 584 LEU HD21 . 31112 1
429 . 1 . 1 35 35 LEU HD22 H 1 0.834 0.00 . . . . . . A 584 LEU HD22 . 31112 1
430 . 1 . 1 35 35 LEU HD23 H 1 0.834 0.00 . . . . . . A 584 LEU HD23 . 31112 1
431 . 1 . 1 35 35 LEU CA C 13 56.829 0.00 . . . . . . A 584 LEU CA . 31112 1
432 . 1 . 1 35 35 LEU CB C 13 41.912 0.00 . . . . . . A 584 LEU CB . 31112 1
433 . 1 . 1 35 35 LEU CG C 13 26.933 0.00 . . . . . . A 584 LEU CG . 31112 1
434 . 1 . 1 35 35 LEU CD1 C 13 25.358 0.00 . . . . . . A 584 LEU CD1 . 31112 1
435 . 1 . 1 35 35 LEU CD2 C 13 23.450 0.00 . . . . . . A 584 LEU CD2 . 31112 1
436 . 1 . 1 35 35 LEU N N 15 119.944 0.00 . . . . . . A 584 LEU N . 31112 1
437 . 1 . 1 36 36 LEU H H 1 7.851 0.02 . . . . . . A 585 LEU H . 31112 1
438 . 1 . 1 36 36 LEU HA H 1 4.165 0.00 . . . . . . A 585 LEU HA . 31112 1
439 . 1 . 1 36 36 LEU HB2 H 1 1.713 0.00 . . . . . . A 585 LEU HB2 . 31112 1
440 . 1 . 1 36 36 LEU HB3 H 1 1.524 0.01 . . . . . . A 585 LEU HB3 . 31112 1
441 . 1 . 1 36 36 LEU HG H 1 1.531 0.00 . . . . . . A 585 LEU HG . 31112 1
442 . 1 . 1 36 36 LEU HD11 H 1 0.838 0.00 . . . . . . A 585 LEU HD11 . 31112 1
443 . 1 . 1 36 36 LEU HD12 H 1 0.838 0.00 . . . . . . A 585 LEU HD12 . 31112 1
444 . 1 . 1 36 36 LEU HD13 H 1 0.838 0.00 . . . . . . A 585 LEU HD13 . 31112 1
445 . 1 . 1 36 36 LEU HD21 H 1 0.795 0.00 . . . . . . A 585 LEU HD21 . 31112 1
446 . 1 . 1 36 36 LEU HD22 H 1 0.795 0.00 . . . . . . A 585 LEU HD22 . 31112 1
447 . 1 . 1 36 36 LEU HD23 H 1 0.795 0.00 . . . . . . A 585 LEU HD23 . 31112 1
448 . 1 . 1 36 36 LEU CA C 13 56.743 0.00 . . . . . . A 585 LEU CA . 31112 1
449 . 1 . 1 36 36 LEU CB C 13 42.088 0.00 . . . . . . A 585 LEU CB . 31112 1
450 . 1 . 1 36 36 LEU CG C 13 26.831 0.00 . . . . . . A 585 LEU CG . 31112 1
451 . 1 . 1 36 36 LEU CD1 C 13 25.201 0.00 . . . . . . A 585 LEU CD1 . 31112 1
452 . 1 . 1 36 36 LEU CD2 C 13 23.400 0.00 . . . . . . A 585 LEU CD2 . 31112 1
453 . 1 . 1 36 36 LEU N N 15 123.082 0.00 . . . . . . A 585 LEU N . 31112 1
454 . 1 . 1 37 37 LYS H H 1 8.049 0.00 . . . . . . A 586 LYS H . 31112 1
455 . 1 . 1 37 37 LYS HA H 1 4.176 0.01 . . . . . . A 586 LYS HA . 31112 1
456 . 1 . 1 37 37 LYS HB2 H 1 1.859 0.00 . . . . . . A 586 LYS HB2 . 31112 1
457 . 1 . 1 37 37 LYS HB3 H 1 1.859 0.00 . . . . . . A 586 LYS HB3 . 31112 1
458 . 1 . 1 37 37 LYS HG2 H 1 1.520 0.00 . . . . . . A 586 LYS HG2 . 31112 1
459 . 1 . 1 37 37 LYS HG3 H 1 1.414 0.01 . . . . . . A 586 LYS HG3 . 31112 1
460 . 1 . 1 37 37 LYS HD2 H 1 1.687 0.00 . . . . . . A 586 LYS HD2 . 31112 1
461 . 1 . 1 37 37 LYS HD3 H 1 1.687 0.00 . . . . . . A 586 LYS HD3 . 31112 1
462 . 1 . 1 37 37 LYS HE2 H 1 3.007 0.01 . . . . . . A 586 LYS HE2 . 31112 1
463 . 1 . 1 37 37 LYS HE3 H 1 3.007 0.01 . . . . . . A 586 LYS HE3 . 31112 1
464 . 1 . 1 37 37 LYS CA C 13 57.967 0.00 . . . . . . A 586 LYS CA . 31112 1
465 . 1 . 1 37 37 LYS CB C 13 32.754 0.00 . . . . . . A 586 LYS CB . 31112 1
466 . 1 . 1 37 37 LYS CG C 13 25.154 0.01 . . . . . . A 586 LYS CG . 31112 1
467 . 1 . 1 37 37 LYS CD C 13 29.215 0.00 . . . . . . A 586 LYS CD . 31112 1
468 . 1 . 1 37 37 LYS CE C 13 42.250 0.00 . . . . . . A 586 LYS CE . 31112 1
469 . 1 . 1 37 37 LYS N N 15 120.066 0.00 . . . . . . A 586 LYS N . 31112 1
470 . 1 . 1 38 38 GLU H H 1 7.981 0.00 . . . . . . A 587 GLU H . 31112 1
471 . 1 . 1 38 38 GLU HA H 1 4.245 0.01 . . . . . . A 587 GLU HA . 31112 1
472 . 1 . 1 38 38 GLU HB2 H 1 2.089 0.00 . . . . . . A 587 GLU HB2 . 31112 1
473 . 1 . 1 38 38 GLU HB3 H 1 2.042 0.00 . . . . . . A 587 GLU HB3 . 31112 1
474 . 1 . 1 38 38 GLU HG2 H 1 2.491 0.00 . . . . . . A 587 GLU HG2 . 31112 1
475 . 1 . 1 38 38 GLU HG3 H 1 2.431 0.01 . . . . . . A 587 GLU HG3 . 31112 1
476 . 1 . 1 38 38 GLU CA C 13 57.230 0.00 . . . . . . A 587 GLU CA . 31112 1
477 . 1 . 1 38 38 GLU CB C 13 28.682 0.00 . . . . . . A 587 GLU CB . 31112 1
478 . 1 . 1 38 38 GLU CG C 13 33.066 0.00 . . . . . . A 587 GLU CG . 31112 1
479 . 1 . 1 38 38 GLU N N 15 118.769 0.00 . . . . . . A 587 GLU N . 31112 1
480 . 1 . 1 39 39 HIS H H 1 8.123 0.00 . . . . . . A 588 HIS H . 31112 1
481 . 1 . 1 39 39 HIS HA H 1 4.634 0.00 . . . . . . A 588 HIS HA . 31112 1
482 . 1 . 1 39 39 HIS HB2 H 1 3.369 0.00 . . . . . . A 588 HIS HB2 . 31112 1
483 . 1 . 1 39 39 HIS HB3 H 1 3.185 0.01 . . . . . . A 588 HIS HB3 . 31112 1
484 . 1 . 1 39 39 HIS HD2 H 1 7.342 0.00 . . . . . . A 588 HIS HD2 . 31112 1
485 . 1 . 1 39 39 HIS HE1 H 1 8.643 0.00 . . . . . . A 588 HIS HE1 . 31112 1
486 . 1 . 1 39 39 HIS CA C 13 55.586 0.00 . . . . . . A 588 HIS CA . 31112 1
487 . 1 . 1 39 39 HIS CB C 13 28.465 0.00 . . . . . . A 588 HIS CB . 31112 1
488 . 1 . 1 39 39 HIS CD2 C 13 120.104 0.00 . . . . . . A 588 HIS CD2 . 31112 1
489 . 1 . 1 39 39 HIS CE1 C 13 136.438 0.00 . . . . . . A 588 HIS CE1 . 31112 1
490 . 1 . 1 39 39 HIS N N 15 117.126 0.00 . . . . . . A 588 HIS N . 31112 1
491 . 1 . 1 40 40 LYS H H 1 8.175 0.00 . . . . . . A 589 LYS H . 31112 1
492 . 1 . 1 40 40 LYS HA H 1 4.297 0.00 . . . . . . A 589 LYS HA . 31112 1
493 . 1 . 1 40 40 LYS HB2 H 1 1.870 0.00 . . . . . . A 589 LYS HB2 . 31112 1
494 . 1 . 1 40 40 LYS HB3 H 1 1.787 0.00 . . . . . . A 589 LYS HB3 . 31112 1
495 . 1 . 1 40 40 LYS HG2 H 1 1.679 0.00 . . . . . . A 589 LYS HG2 . 31112 1
496 . 1 . 1 40 40 LYS HG3 H 1 1.399 0.01 . . . . . . A 589 LYS HG3 . 31112 1
497 . 1 . 1 40 40 LYS HD2 H 1 1.691 0.01 . . . . . . A 589 LYS HD2 . 31112 1
498 . 1 . 1 40 40 LYS HD3 H 1 1.424 0.00 . . . . . . A 589 LYS HD3 . 31112 1
499 . 1 . 1 40 40 LYS HE2 H 1 2.997 0.00 . . . . . . A 589 LYS HE2 . 31112 1
500 . 1 . 1 40 40 LYS HE3 H 1 2.997 0.00 . . . . . . A 589 LYS HE3 . 31112 1
501 . 1 . 1 40 40 LYS HZ1 H 1 7.533 0.00 . . . . . . A 589 LYS HZ1 . 31112 1
502 . 1 . 1 40 40 LYS HZ2 H 1 7.533 0.00 . . . . . . A 589 LYS HZ2 . 31112 1
503 . 1 . 1 40 40 LYS HZ3 H 1 7.533 0.00 . . . . . . A 589 LYS HZ3 . 31112 1
504 . 1 . 1 40 40 LYS CA C 13 56.557 0.00 . . . . . . A 589 LYS CA . 31112 1
505 . 1 . 1 40 40 LYS CB C 13 32.823 0.00 . . . . . . A 589 LYS CB . 31112 1
506 . 1 . 1 40 40 LYS CG C 13 25.027 0.00 . . . . . . A 589 LYS CG . 31112 1
507 . 1 . 1 40 40 LYS CD C 13 29.201 0.00 . . . . . . A 589 LYS CD . 31112 1
508 . 1 . 1 40 40 LYS CE C 13 42.365 0.00 . . . . . . A 589 LYS CE . 31112 1
509 . 1 . 1 40 40 LYS N N 15 120.239 0.00 . . . . . . A 589 LYS N . 31112 1
510 . 1 . 1 41 41 LEU H H 1 8.155 0.00 . . . . . . A 590 LEU H . 31112 1
511 . 1 . 1 41 41 LEU HA H 1 4.388 0.00 . . . . . . A 590 LEU HA . 31112 1
512 . 1 . 1 41 41 LEU HB2 H 1 1.611 0.00 . . . . . . A 590 LEU HB2 . 31112 1
513 . 1 . 1 41 41 LEU HB3 H 1 1.611 0.00 . . . . . . A 590 LEU HB3 . 31112 1
514 . 1 . 1 41 41 LEU HG H 1 1.595 0.00 . . . . . . A 590 LEU HG . 31112 1
515 . 1 . 1 41 41 LEU HD11 H 1 0.912 0.00 . . . . . . A 590 LEU HD11 . 31112 1
516 . 1 . 1 41 41 LEU HD12 H 1 0.912 0.00 . . . . . . A 590 LEU HD12 . 31112 1
517 . 1 . 1 41 41 LEU HD13 H 1 0.912 0.00 . . . . . . A 590 LEU HD13 . 31112 1
518 . 1 . 1 41 41 LEU HD21 H 1 0.866 0.00 . . . . . . A 590 LEU HD21 . 31112 1
519 . 1 . 1 41 41 LEU HD22 H 1 0.866 0.00 . . . . . . A 590 LEU HD22 . 31112 1
520 . 1 . 1 41 41 LEU HD23 H 1 0.866 0.00 . . . . . . A 590 LEU HD23 . 31112 1
521 . 1 . 1 41 41 LEU CA C 13 55.136 0.00 . . . . . . A 590 LEU CA . 31112 1
522 . 1 . 1 41 41 LEU CB C 13 42.737 0.00 . . . . . . A 590 LEU CB . 31112 1
523 . 1 . 1 41 41 LEU CG C 13 27.227 0.00 . . . . . . A 590 LEU CG . 31112 1
524 . 1 . 1 41 41 LEU CD1 C 13 25.051 0.00 . . . . . . A 590 LEU CD1 . 31112 1
525 . 1 . 1 41 41 LEU CD2 C 13 23.782 0.00 . . . . . . A 590 LEU CD2 . 31112 1
526 . 1 . 1 41 41 LEU N N 15 122.149 0.00 . . . . . . A 590 LEU N . 31112 1
527 . 1 . 1 42 42 LEU H H 1 7.995 0.00 . . . . . . A 591 LEU H . 31112 1
528 . 1 . 1 42 42 LEU HA H 1 4.326 0.00 . . . . . . A 591 LEU HA . 31112 1
529 . 1 . 1 42 42 LEU HB2 H 1 1.620 0.01 . . . . . . A 591 LEU HB2 . 31112 1
530 . 1 . 1 42 42 LEU HB3 H 1 1.620 0.01 . . . . . . A 591 LEU HB3 . 31112 1
531 . 1 . 1 42 42 LEU HG H 1 1.639 0.00 . . . . . . A 591 LEU HG . 31112 1
532 . 1 . 1 42 42 LEU HD11 H 1 0.909 0.00 . . . . . . A 591 LEU HD11 . 31112 1
533 . 1 . 1 42 42 LEU HD12 H 1 0.909 0.00 . . . . . . A 591 LEU HD12 . 31112 1
534 . 1 . 1 42 42 LEU HD13 H 1 0.909 0.00 . . . . . . A 591 LEU HD13 . 31112 1
535 . 1 . 1 42 42 LEU HD21 H 1 0.867 0.00 . . . . . . A 591 LEU HD21 . 31112 1
536 . 1 . 1 42 42 LEU HD22 H 1 0.867 0.00 . . . . . . A 591 LEU HD22 . 31112 1
537 . 1 . 1 42 42 LEU HD23 H 1 0.867 0.00 . . . . . . A 591 LEU HD23 . 31112 1
538 . 1 . 1 42 42 LEU CA C 13 54.735 0.00 . . . . . . A 591 LEU CA . 31112 1
539 . 1 . 1 42 42 LEU CB C 13 42.789 0.00 . . . . . . A 591 LEU CB . 31112 1
540 . 1 . 1 42 42 LEU CG C 13 27.120 0.00 . . . . . . A 591 LEU CG . 31112 1
541 . 1 . 1 42 42 LEU CD1 C 13 25.321 0.00 . . . . . . A 591 LEU CD1 . 31112 1
542 . 1 . 1 42 42 LEU CD2 C 13 23.627 0.00 . . . . . . A 591 LEU CD2 . 31112 1
543 . 1 . 1 42 42 LEU N N 15 123.963 0.00 . . . . . . A 591 LEU N . 31112 1
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