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 30658
_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 '3D HNCO' . . . 30658 1
2 '3D HNCACB' . . . 30658 1
3 '3D CBCA(CO)NH' . . . 30658 1
4 '3D CCCONH' . . . 30658 1
5 '3D HCCH-TOCSY' . . . 30658 1
6 '3D 15N/13C-edited NOESY' . . . 30658 1
7 '3D HCCCONH' . . . 30658 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 ALA HA H 1 4.112 0.03 . 1 . . . . A 535 ALA HA . 30658 1
2 . 1 . 1 2 2 ALA HB1 H 1 1.265 0.03 . 1 . . . . A 535 ALA HB1 . 30658 1
3 . 1 . 1 2 2 ALA HB2 H 1 1.265 0.03 . 1 . . . . A 535 ALA HB2 . 30658 1
4 . 1 . 1 2 2 ALA HB3 H 1 1.265 0.03 . 1 . . . . A 535 ALA HB3 . 30658 1
5 . 1 . 1 2 2 ALA C C 13 177.592 0.50 . 1 . . . . A 535 ALA C . 30658 1
6 . 1 . 1 2 2 ALA CA C 13 52.788 0.50 . 1 . . . . A 535 ALA CA . 30658 1
7 . 1 . 1 2 2 ALA CB C 13 18.966 0.50 . 1 . . . . A 535 ALA CB . 30658 1
8 . 1 . 1 3 3 MET H H 1 8.349 0.03 . 1 . . . . A 536 MET H . 30658 1
9 . 1 . 1 3 3 MET HA H 1 4.370 0.03 . 1 . . . . A 536 MET HA . 30658 1
10 . 1 . 1 3 3 MET HB2 H 1 1.950 0.03 . 2 . . . . A 536 MET HB2 . 30658 1
11 . 1 . 1 3 3 MET HB3 H 1 1.845 0.03 . 2 . . . . A 536 MET HB3 . 30658 1
12 . 1 . 1 3 3 MET HG2 H 1 2.427 0.03 . 2 . . . . A 536 MET HG2 . 30658 1
13 . 1 . 1 3 3 MET HG3 H 1 2.355 0.03 . 2 . . . . A 536 MET HG3 . 30658 1
14 . 1 . 1 3 3 MET C C 13 175.441 0.50 . 1 . . . . A 536 MET C . 30658 1
15 . 1 . 1 3 3 MET CA C 13 54.718 0.50 . 1 . . . . A 536 MET CA . 30658 1
16 . 1 . 1 3 3 MET CB C 13 32.150 0.50 . 1 . . . . A 536 MET CB . 30658 1
17 . 1 . 1 3 3 MET CG C 13 32.270 0.50 . 1 . . . . A 536 MET CG . 30658 1
18 . 1 . 1 3 3 MET N N 15 118.129 0.25 . 1 . . . . A 536 MET N . 30658 1
19 . 1 . 1 4 4 ASP H H 1 8.056 0.03 . 1 . . . . A 537 ASP H . 30658 1
20 . 1 . 1 4 4 ASP HA H 1 4.718 0.03 . 1 . . . . A 537 ASP HA . 30658 1
21 . 1 . 1 4 4 ASP HB2 H 1 2.634 0.03 . 2 . . . . A 537 ASP HB2 . 30658 1
22 . 1 . 1 4 4 ASP HB3 H 1 2.461 0.03 . 2 . . . . A 537 ASP HB3 . 30658 1
23 . 1 . 1 4 4 ASP CA C 13 52.519 0.50 . 1 . . . . A 537 ASP CA . 30658 1
24 . 1 . 1 4 4 ASP CB C 13 40.591 0.50 . 1 . . . . A 537 ASP CB . 30658 1
25 . 1 . 1 4 4 ASP N N 15 123.081 0.25 . 1 . . . . A 537 ASP N . 30658 1
26 . 1 . 1 5 5 PRO HA H 1 4.227 0.03 . 1 . . . . A 538 PRO HA . 30658 1
27 . 1 . 1 5 5 PRO HB2 H 1 2.142 0.03 . 2 . . . . A 538 PRO HB2 . 30658 1
28 . 1 . 1 5 5 PRO HG2 H 1 1.898 0.03 . 2 . . . . A 538 PRO HG2 . 30658 1
29 . 1 . 1 5 5 PRO HG3 H 1 1.755 0.03 . 2 . . . . A 538 PRO HG3 . 30658 1
30 . 1 . 1 5 5 PRO HD2 H 1 3.755 0.03 . 2 . . . . A 538 PRO HD2 . 30658 1
31 . 1 . 1 5 5 PRO HD3 H 1 3.624 0.03 . 2 . . . . A 538 PRO HD3 . 30658 1
32 . 1 . 1 5 5 PRO C C 13 176.991 0.50 . 1 . . . . A 538 PRO C . 30658 1
33 . 1 . 1 5 5 PRO CA C 13 63.553 0.50 . 1 . . . . A 538 PRO CA . 30658 1
34 . 1 . 1 5 5 PRO CB C 13 31.831 0.50 . 1 . . . . A 538 PRO CB . 30658 1
35 . 1 . 1 5 5 PRO CG C 13 27.156 0.50 . 1 . . . . A 538 PRO CG . 30658 1
36 . 1 . 1 5 5 PRO CD C 13 50.515 0.50 . 1 . . . . A 538 PRO CD . 30658 1
37 . 1 . 1 6 6 GLU H H 1 8.415 0.03 . 1 . . . . A 539 GLU H . 30658 1
38 . 1 . 1 6 6 GLU HA H 1 3.991 0.03 . 1 . . . . A 539 GLU HA . 30658 1
39 . 1 . 1 6 6 GLU HB2 H 1 1.932 0.03 . 2 . . . . A 539 GLU HB2 . 30658 1
40 . 1 . 1 6 6 GLU HB3 H 1 1.746 0.03 . 2 . . . . A 539 GLU HB3 . 30658 1
41 . 1 . 1 6 6 GLU HG2 H 1 2.048 0.03 . 2 . . . . A 539 GLU HG2 . 30658 1
42 . 1 . 1 6 6 GLU HG3 H 1 1.943 0.03 . 2 . . . . A 539 GLU HG3 . 30658 1
43 . 1 . 1 6 6 GLU C C 13 176.251 0.50 . 1 . . . . A 539 GLU C . 30658 1
44 . 1 . 1 6 6 GLU CA C 13 56.892 0.50 . 1 . . . . A 539 GLU CA . 30658 1
45 . 1 . 1 6 6 GLU CB C 13 29.582 0.50 . 1 . . . . A 539 GLU CB . 30658 1
46 . 1 . 1 6 6 GLU CG C 13 36.090 0.50 . 1 . . . . A 539 GLU CG . 30658 1
47 . 1 . 1 6 6 GLU N N 15 119.470 0.25 . 1 . . . . A 539 GLU N . 30658 1
48 . 1 . 1 7 7 PHE H H 1 7.893 0.03 . 1 . . . . A 540 PHE H . 30658 1
49 . 1 . 1 7 7 PHE HA H 1 4.443 0.03 . 1 . . . . A 540 PHE HA . 30658 1
50 . 1 . 1 7 7 PHE HB2 H 1 2.898 0.03 . 2 . . . . A 540 PHE HB2 . 30658 1
51 . 1 . 1 7 7 PHE HB3 H 1 2.848 0.03 . 2 . . . . A 540 PHE HB3 . 30658 1
52 . 1 . 1 7 7 PHE C C 13 175.303 0.50 . 1 . . . . A 540 PHE C . 30658 1
53 . 1 . 1 7 7 PHE CA C 13 57.948 0.50 . 1 . . . . A 540 PHE CA . 30658 1
54 . 1 . 1 7 7 PHE CB C 13 39.638 0.50 . 1 . . . . A 540 PHE CB . 30658 1
55 . 1 . 1 7 7 PHE N N 15 119.350 0.25 . 1 . . . . A 540 PHE N . 30658 1
56 . 1 . 1 8 8 TYR H H 1 7.948 0.03 . 1 . . . . A 541 TYR H . 30658 1
57 . 1 . 1 8 8 TYR HA H 1 4.325 0.03 . 1 . . . . A 541 TYR HA . 30658 1
58 . 1 . 1 8 8 TYR HB2 H 1 2.836 0.03 . 2 . . . . A 541 TYR HB2 . 30658 1
59 . 1 . 1 8 8 TYR HB3 H 1 2.801 0.03 . 2 . . . . A 541 TYR HB3 . 30658 1
60 . 1 . 1 8 8 TYR C C 13 175.058 0.50 . 1 . . . . A 541 TYR C . 30658 1
61 . 1 . 1 8 8 TYR CA C 13 57.948 0.50 . 1 . . . . A 541 TYR CA . 30658 1
62 . 1 . 1 8 8 TYR CB C 13 38.689 0.50 . 1 . . . . A 541 TYR CB . 30658 1
63 . 1 . 1 8 8 TYR N N 15 120.621 0.25 . 1 . . . . A 541 TYR N . 30658 1
64 . 1 . 1 9 9 HIS H H 1 7.913 0.03 . 1 . . . . A 542 HIS H . 30658 1
65 . 1 . 1 9 9 HIS HA H 1 4.352 0.03 . 1 . . . . A 542 HIS HA . 30658 1
66 . 1 . 1 9 9 HIS HB2 H 1 2.951 0.03 . 2 . . . . A 542 HIS HB2 . 30658 1
67 . 1 . 1 9 9 HIS HB3 H 1 2.881 0.03 . 2 . . . . A 542 HIS HB3 . 30658 1
68 . 1 . 1 9 9 HIS C C 13 174.642 0.50 . 1 . . . . A 542 HIS C . 30658 1
69 . 1 . 1 9 9 HIS CA C 13 55.943 0.50 . 1 . . . . A 542 HIS CA . 30658 1
70 . 1 . 1 9 9 HIS CB C 13 30.321 0.50 . 1 . . . . A 542 HIS CB . 30658 1
71 . 1 . 1 9 9 HIS N N 15 121.178 0.25 . 1 . . . . A 542 HIS N . 30658 1
72 . 1 . 1 10 10 GLU H H 1 8.194 0.03 . 1 . . . . A 543 GLU H . 30658 1
73 . 1 . 1 10 10 GLU HA H 1 4.069 0.03 . 1 . . . . A 543 GLU HA . 30658 1
74 . 1 . 1 10 10 GLU HB2 H 1 1.830 0.03 . 2 . . . . A 543 GLU HB2 . 30658 1
75 . 1 . 1 10 10 GLU HG2 H 1 2.084 0.03 . 2 . . . . A 543 GLU HG2 . 30658 1
76 . 1 . 1 10 10 GLU C C 13 176.320 0.50 . 1 . . . . A 543 GLU C . 30658 1
77 . 1 . 1 10 10 GLU CA C 13 56.491 0.50 . 1 . . . . A 543 GLU CA . 30658 1
78 . 1 . 1 10 10 GLU CB C 13 29.976 0.50 . 1 . . . . A 543 GLU CB . 30658 1
79 . 1 . 1 10 10 GLU CG C 13 36.080 0.50 . 1 . . . . A 543 GLU CG . 30658 1
80 . 1 . 1 10 10 GLU N N 15 122.371 0.25 . 1 . . . . A 543 GLU N . 30658 1
81 . 1 . 1 11 11 ARG H H 1 8.353 0.03 . 1 . . . . A 544 ARG H . 30658 1
82 . 1 . 1 11 11 ARG HA H 1 4.226 0.03 . 1 . . . . A 544 ARG HA . 30658 1
83 . 1 . 1 11 11 ARG HB2 H 1 1.751 0.03 . 2 . . . . A 544 ARG HB2 . 30658 1
84 . 1 . 1 11 11 ARG HB3 H 1 1.627 0.03 . 2 . . . . A 544 ARG HB3 . 30658 1
85 . 1 . 1 11 11 ARG HG2 H 1 1.473 0.03 . 2 . . . . A 544 ARG HG2 . 30658 1
86 . 1 . 1 11 11 ARG HD2 H 1 3.013 0.03 . 2 . . . . A 544 ARG HD2 . 30658 1
87 . 1 . 1 11 11 ARG C C 13 176.336 0.50 . 1 . . . . A 544 ARG C . 30658 1
88 . 1 . 1 11 11 ARG CA C 13 56.029 0.50 . 1 . . . . A 544 ARG CA . 30658 1
89 . 1 . 1 11 11 ARG CB C 13 30.359 0.50 . 1 . . . . A 544 ARG CB . 30658 1
90 . 1 . 1 11 11 ARG CG C 13 26.913 0.50 . 1 . . . . A 544 ARG CG . 30658 1
91 . 1 . 1 11 11 ARG CD C 13 43.140 0.50 . 1 . . . . A 544 ARG CD . 30658 1
92 . 1 . 1 11 11 ARG N N 15 122.148 0.25 . 1 . . . . A 544 ARG N . 30658 1
93 . 1 . 1 12 12 ARG H H 1 8.188 0.03 . 1 . . . . A 545 ARG H . 30658 1
94 . 1 . 1 12 12 ARG HA H 1 4.226 0.03 . 1 . . . . A 545 ARG HA . 30658 1
95 . 1 . 1 12 12 ARG HB2 H 1 1.751 0.03 . 2 . . . . A 545 ARG HB2 . 30658 1
96 . 1 . 1 12 12 ARG HB3 H 1 1.627 0.03 . 2 . . . . A 545 ARG HB3 . 30658 1
97 . 1 . 1 12 12 ARG HG2 H 1 1.473 0.03 . 2 . . . . A 545 ARG HG2 . 30658 1
98 . 1 . 1 12 12 ARG HD2 H 1 3.013 0.03 . 2 . . . . A 545 ARG HD2 . 30658 1
99 . 1 . 1 12 12 ARG C C 13 176.556 0.50 . 1 . . . . A 545 ARG C . 30658 1
100 . 1 . 1 12 12 ARG CA C 13 56.201 0.50 . 1 . . . . A 545 ARG CA . 30658 1
101 . 1 . 1 12 12 ARG CB C 13 30.352 0.50 . 1 . . . . A 545 ARG CB . 30658 1
102 . 1 . 1 12 12 ARG CG C 13 26.898 0.50 . 1 . . . . A 545 ARG CG . 30658 1
103 . 1 . 1 12 12 ARG CD C 13 43.134 0.50 . 1 . . . . A 545 ARG CD . 30658 1
104 . 1 . 1 12 12 ARG N N 15 121.422 0.25 . 1 . . . . A 545 ARG N . 30658 1
105 . 1 . 1 13 13 GLY H H 1 8.299 0.03 . 1 . . . . A 546 GLY H . 30658 1
106 . 1 . 1 13 13 GLY HA2 H 1 3.803 0.03 . 2 . . . . A 546 GLY HA2 . 30658 1
107 . 1 . 1 13 13 GLY C C 13 173.811 0.50 . 1 . . . . A 546 GLY C . 30658 1
108 . 1 . 1 13 13 GLY CA C 13 45.092 0.50 . 1 . . . . A 546 GLY CA . 30658 1
109 . 1 . 1 13 13 GLY N N 15 109.499 0.25 . 1 . . . . A 546 GLY N . 30658 1
110 . 1 . 1 14 14 SER H H 1 8.183 0.03 . 1 . . . . A 547 SER H . 30658 1
111 . 1 . 1 14 14 SER HA H 1 4.257 0.03 . 1 . . . . A 547 SER HA . 30658 1
112 . 1 . 1 14 14 SER HB2 H 1 3.555 0.03 . 2 . . . . A 547 SER HB2 . 30658 1
113 . 1 . 1 14 14 SER HB3 H 1 3.465 0.03 . 2 . . . . A 547 SER HB3 . 30658 1
114 . 1 . 1 14 14 SER C C 13 172.583 0.50 . 1 . . . . A 547 SER C . 30658 1
115 . 1 . 1 14 14 SER CA C 13 58.384 0.50 . 1 . . . . A 547 SER CA . 30658 1
116 . 1 . 1 14 14 SER CB C 13 64.034 0.50 . 1 . . . . A 547 SER CB . 30658 1
117 . 1 . 1 14 14 SER N N 15 115.871 0.25 . 1 . . . . A 547 SER N . 30658 1
118 . 1 . 1 15 15 LEU H H 1 8.194 0.03 . 1 . . . . A 548 LEU H . 30658 1
119 . 1 . 1 15 15 LEU HA H 1 4.084 0.03 . 1 . . . . A 548 LEU HA . 30658 1
120 . 1 . 1 15 15 LEU HB2 H 1 1.385 0.03 . 2 . . . . A 548 LEU HB2 . 30658 1
121 . 1 . 1 15 15 LEU HB3 H 1 0.780 0.03 . 2 . . . . A 548 LEU HB3 . 30658 1
122 . 1 . 1 15 15 LEU HG H 1 1.370 0.03 . 1 . . . . A 548 LEU HG . 30658 1
123 . 1 . 1 15 15 LEU HD11 H 1 0.447 0.03 . 2 . . . . A 548 LEU HD11 . 30658 1
124 . 1 . 1 15 15 LEU HD12 H 1 0.447 0.03 . 2 . . . . A 548 LEU HD12 . 30658 1
125 . 1 . 1 15 15 LEU HD13 H 1 0.447 0.03 . 2 . . . . A 548 LEU HD13 . 30658 1
126 . 1 . 1 15 15 LEU HD21 H 1 0.632 0.03 . 2 . . . . A 548 LEU HD21 . 30658 1
127 . 1 . 1 15 15 LEU HD22 H 1 0.632 0.03 . 2 . . . . A 548 LEU HD22 . 30658 1
128 . 1 . 1 15 15 LEU HD23 H 1 0.632 0.03 . 2 . . . . A 548 LEU HD23 . 30658 1
129 . 1 . 1 15 15 LEU C C 13 175.445 0.50 . 1 . . . . A 548 LEU C . 30658 1
130 . 1 . 1 15 15 LEU CA C 13 53.538 0.50 . 1 . . . . A 548 LEU CA . 30658 1
131 . 1 . 1 15 15 LEU CB C 13 43.122 0.50 . 1 . . . . A 548 LEU CB . 30658 1
132 . 1 . 1 15 15 LEU CG C 13 26.260 0.50 . 1 . . . . A 548 LEU CG . 30658 1
133 . 1 . 1 15 15 LEU CD1 C 13 22.427 0.50 . 2 . . . . A 548 LEU CD1 . 30658 1
134 . 1 . 1 15 15 LEU CD2 C 13 24.528 0.50 . 2 . . . . A 548 LEU CD2 . 30658 1
135 . 1 . 1 15 15 LEU N N 15 122.821 0.25 . 1 . . . . A 548 LEU N . 30658 1
136 . 1 . 1 16 16 CYS H H 1 8.009 0.03 . 1 . . . . A 549 CYS H . 30658 1
137 . 1 . 1 16 16 CYS HA H 1 4.278 0.03 . 1 . . . . A 549 CYS HA . 30658 1
138 . 1 . 1 16 16 CYS HB2 H 1 3.511 0.03 . 2 . . . . A 549 CYS HB2 . 30658 1
139 . 1 . 1 16 16 CYS HB3 H 1 2.195 0.03 . 2 . . . . A 549 CYS HB3 . 30658 1
140 . 1 . 1 16 16 CYS C C 13 177.587 0.50 . 1 . . . . A 549 CYS C . 30658 1
141 . 1 . 1 16 16 CYS CA C 13 57.282 0.50 . 1 . . . . A 549 CYS CA . 30658 1
142 . 1 . 1 16 16 CYS CB C 13 31.458 0.50 . 1 . . . . A 549 CYS CB . 30658 1
143 . 1 . 1 16 16 CYS N N 15 122.780 0.25 . 1 . . . . A 549 CYS N . 30658 1
144 . 1 . 1 17 17 SER H H 1 8.777 0.03 . 1 . . . . A 550 SER H . 30658 1
145 . 1 . 1 17 17 SER HA H 1 4.083 0.03 . 1 . . . . A 550 SER HA . 30658 1
146 . 1 . 1 17 17 SER HB2 H 1 3.461 0.03 . 2 . . . . A 550 SER HB2 . 30658 1
147 . 1 . 1 17 17 SER HB3 H 1 2.987 0.03 . 2 . . . . A 550 SER HB3 . 30658 1
148 . 1 . 1 17 17 SER C C 13 173.977 0.50 . 1 . . . . A 550 SER C . 30658 1
149 . 1 . 1 17 17 SER CA C 13 61.666 0.50 . 1 . . . . A 550 SER CA . 30658 1
150 . 1 . 1 17 17 SER CB C 13 63.207 0.50 . 1 . . . . A 550 SER CB . 30658 1
151 . 1 . 1 17 17 SER N N 15 125.520 0.25 . 1 . . . . A 550 SER N . 30658 1
152 . 1 . 1 18 18 GLY H H 1 9.061 0.03 . 1 . . . . A 551 GLY H . 30658 1
153 . 1 . 1 18 18 GLY HA2 H 1 4.345 0.03 . 2 . . . . A 551 GLY HA2 . 30658 1
154 . 1 . 1 18 18 GLY HA3 H 1 3.844 0.03 . 2 . . . . A 551 GLY HA3 . 30658 1
155 . 1 . 1 18 18 GLY C C 13 173.616 0.50 . 1 . . . . A 551 GLY C . 30658 1
156 . 1 . 1 18 18 GLY CA C 13 46.108 0.50 . 1 . . . . A 551 GLY CA . 30658 1
157 . 1 . 1 18 18 GLY N N 15 110.671 0.25 . 1 . . . . A 551 GLY N . 30658 1
158 . 1 . 1 19 19 CYS H H 1 7.780 0.03 . 1 . . . . A 552 CYS H . 30658 1
159 . 1 . 1 19 19 CYS HA H 1 4.753 0.03 . 1 . . . . A 552 CYS HA . 30658 1
160 . 1 . 1 19 19 CYS HB2 H 1 3.102 0.03 . 2 . . . . A 552 CYS HB2 . 30658 1
161 . 1 . 1 19 19 CYS HB3 H 1 2.198 0.03 . 2 . . . . A 552 CYS HB3 . 30658 1
162 . 1 . 1 19 19 CYS C C 13 174.873 0.50 . 1 . . . . A 552 CYS C . 30658 1
163 . 1 . 1 19 19 CYS CA C 13 58.186 0.50 . 1 . . . . A 552 CYS CA . 30658 1
164 . 1 . 1 19 19 CYS CB C 13 31.506 0.50 . 1 . . . . A 552 CYS CB . 30658 1
165 . 1 . 1 19 19 CYS N N 15 118.909 0.25 . 1 . . . . A 552 CYS N . 30658 1
166 . 1 . 1 20 20 GLN H H 1 8.264 0.03 . 1 . . . . A 553 GLN H . 30658 1
167 . 1 . 1 20 20 GLN HA H 1 3.871 0.03 . 1 . . . . A 553 GLN HA . 30658 1
168 . 1 . 1 20 20 GLN HB2 H 1 2.255 0.03 . 2 . . . . A 553 GLN HB2 . 30658 1
169 . 1 . 1 20 20 GLN HG2 H 1 2.183 0.03 . 2 . . . . A 553 GLN HG2 . 30658 1
170 . 1 . 1 20 20 GLN HG3 H 1 2.103 0.03 . 2 . . . . A 553 GLN HG3 . 30658 1
171 . 1 . 1 20 20 GLN HE21 H 1 7.140 0.03 . 2 . . . . A 553 GLN HE21 . 30658 1
172 . 1 . 1 20 20 GLN HE22 H 1 6.520 0.03 . 2 . . . . A 553 GLN HE22 . 30658 1
173 . 1 . 1 20 20 GLN C C 13 173.703 0.50 . 1 . . . . A 553 GLN C . 30658 1
174 . 1 . 1 20 20 GLN CA C 13 57.357 0.50 . 1 . . . . A 553 GLN CA . 30658 1
175 . 1 . 1 20 20 GLN CB C 13 25.073 0.50 . 1 . . . . A 553 GLN CB . 30658 1
176 . 1 . 1 20 20 GLN CG C 13 33.723 0.50 . 1 . . . . A 553 GLN CG . 30658 1
177 . 1 . 1 20 20 GLN N N 15 116.391 0.25 . 1 . . . . A 553 GLN N . 30658 1
178 . 1 . 1 20 20 GLN NE2 N 15 112.111 0.25 . 1 . . . . A 553 GLN NE2 . 30658 1
179 . 1 . 1 21 21 LYS H H 1 8.099 0.03 . 1 . . . . A 554 LYS H . 30658 1
180 . 1 . 1 21 21 LYS HA H 1 4.890 0.03 . 1 . . . . A 554 LYS HA . 30658 1
181 . 1 . 1 21 21 LYS HB2 H 1 2.130 0.03 . 2 . . . . A 554 LYS HB2 . 30658 1
182 . 1 . 1 21 21 LYS HB3 H 1 1.915 0.03 . 2 . . . . A 554 LYS HB3 . 30658 1
183 . 1 . 1 21 21 LYS HG2 H 1 1.530 0.03 . 2 . . . . A 554 LYS HG2 . 30658 1
184 . 1 . 1 21 21 LYS HG3 H 1 1.425 0.03 . 2 . . . . A 554 LYS HG3 . 30658 1
185 . 1 . 1 21 21 LYS HD2 H 1 1.691 0.03 . 2 . . . . A 554 LYS HD2 . 30658 1
186 . 1 . 1 21 21 LYS HD3 H 1 1.641 0.03 . 2 . . . . A 554 LYS HD3 . 30658 1
187 . 1 . 1 21 21 LYS CA C 13 53.475 0.50 . 1 . . . . A 554 LYS CA . 30658 1
188 . 1 . 1 21 21 LYS CB C 13 32.410 0.50 . 1 . . . . A 554 LYS CB . 30658 1
189 . 1 . 1 21 21 LYS CG C 13 24.490 0.50 . 1 . . . . A 554 LYS CG . 30658 1
190 . 1 . 1 21 21 LYS CD C 13 28.030 0.50 . 1 . . . . A 554 LYS CD . 30658 1
191 . 1 . 1 21 21 LYS N N 15 118.030 0.25 . 1 . . . . A 554 LYS N . 30658 1
192 . 1 . 1 22 22 PRO HA H 1 4.310 0.03 . 1 . . . . A 555 PRO HA . 30658 1
193 . 1 . 1 22 22 PRO HB2 H 1 2.145 0.03 . 2 . . . . A 555 PRO HB2 . 30658 1
194 . 1 . 1 22 22 PRO HB3 H 1 1.629 0.03 . 2 . . . . A 555 PRO HB3 . 30658 1
195 . 1 . 1 22 22 PRO HG2 H 1 1.735 0.03 . 2 . . . . A 555 PRO HG2 . 30658 1
196 . 1 . 1 22 22 PRO HG3 H 1 1.960 0.03 . 2 . . . . A 555 PRO HG3 . 30658 1
197 . 1 . 1 22 22 PRO HD2 H 1 3.550 0.03 . 2 . . . . A 555 PRO HD2 . 30658 1
198 . 1 . 1 22 22 PRO HD3 H 1 3.700 0.03 . 2 . . . . A 555 PRO HD3 . 30658 1
199 . 1 . 1 22 22 PRO C C 13 176.312 0.50 . 1 . . . . A 555 PRO C . 30658 1
200 . 1 . 1 22 22 PRO CA C 13 63.020 0.50 . 1 . . . . A 555 PRO CA . 30658 1
201 . 1 . 1 22 22 PRO CB C 13 32.370 0.50 . 1 . . . . A 555 PRO CB . 30658 1
202 . 1 . 1 22 22 PRO CG C 13 27.613 0.50 . 1 . . . . A 555 PRO CG . 30658 1
203 . 1 . 1 22 22 PRO CD C 13 50.500 0.50 . 1 . . . . A 555 PRO CD . 30658 1
204 . 1 . 1 23 23 ILE H H 1 8.209 0.03 . 1 . . . . A 556 ILE H . 30658 1
205 . 1 . 1 23 23 ILE HA H 1 3.961 0.03 . 1 . . . . A 556 ILE HA . 30658 1
206 . 1 . 1 23 23 ILE HB H 1 1.290 0.03 . 1 . . . . A 556 ILE HB . 30658 1
207 . 1 . 1 23 23 ILE HG12 H 1 1.107 0.03 . 2 . . . . A 556 ILE HG12 . 30658 1
208 . 1 . 1 23 23 ILE HG13 H 1 -0.460 0.03 . 2 . . . . A 556 ILE HG13 . 30658 1
209 . 1 . 1 23 23 ILE HG21 H 1 0.505 0.03 . 1 . . . . A 556 ILE HG21 . 30658 1
210 . 1 . 1 23 23 ILE HG22 H 1 0.505 0.03 . 1 . . . . A 556 ILE HG22 . 30658 1
211 . 1 . 1 23 23 ILE HG23 H 1 0.505 0.03 . 1 . . . . A 556 ILE HG23 . 30658 1
212 . 1 . 1 23 23 ILE HD11 H 1 0.175 0.03 . 1 . . . . A 556 ILE HD11 . 30658 1
213 . 1 . 1 23 23 ILE HD12 H 1 0.175 0.03 . 1 . . . . A 556 ILE HD12 . 30658 1
214 . 1 . 1 23 23 ILE HD13 H 1 0.175 0.03 . 1 . . . . A 556 ILE HD13 . 30658 1
215 . 1 . 1 23 23 ILE CA C 13 60.540 0.50 . 1 . . . . A 556 ILE CA . 30658 1
216 . 1 . 1 23 23 ILE CB C 13 38.790 0.50 . 1 . . . . A 556 ILE CB . 30658 1
217 . 1 . 1 23 23 ILE CG1 C 13 26.510 0.50 . 1 . . . . A 556 ILE CG1 . 30658 1
218 . 1 . 1 23 23 ILE CG2 C 13 17.870 0.50 . 1 . . . . A 556 ILE CG2 . 30658 1
219 . 1 . 1 23 23 ILE CD1 C 13 14.560 0.50 . 1 . . . . A 556 ILE CD1 . 30658 1
220 . 1 . 1 23 23 ILE N N 15 123.081 0.25 . 1 . . . . A 556 ILE N . 30658 1
221 . 1 . 1 24 24 THR HA H 1 4.389 0.03 . 1 . . . . A 557 THR HA . 30658 1
222 . 1 . 1 24 24 THR HB H 1 4.192 0.03 . 1 . . . . A 557 THR HB . 30658 1
223 . 1 . 1 24 24 THR HG21 H 1 1.033 0.03 . 1 . . . . A 557 THR HG21 . 30658 1
224 . 1 . 1 24 24 THR HG22 H 1 1.033 0.03 . 1 . . . . A 557 THR HG22 . 30658 1
225 . 1 . 1 24 24 THR HG23 H 1 1.033 0.03 . 1 . . . . A 557 THR HG23 . 30658 1
226 . 1 . 1 24 24 THR C C 13 174.380 0.50 . 1 . . . . A 557 THR C . 30658 1
227 . 1 . 1 24 24 THR CA C 13 61.214 0.50 . 1 . . . . A 557 THR CA . 30658 1
228 . 1 . 1 24 24 THR CB C 13 69.372 0.50 . 1 . . . . A 557 THR CB . 30658 1
229 . 1 . 1 24 24 THR CG2 C 13 21.157 0.50 . 1 . . . . A 557 THR CG2 . 30658 1
230 . 1 . 1 25 25 GLY H H 1 8.037 0.03 . 1 . . . . A 558 GLY H . 30658 1
231 . 1 . 1 25 25 GLY HA2 H 1 3.917 0.03 . 2 . . . . A 558 GLY HA2 . 30658 1
232 . 1 . 1 25 25 GLY HA3 H 1 3.803 0.03 . 2 . . . . A 558 GLY HA3 . 30658 1
233 . 1 . 1 25 25 GLY C C 13 172.946 0.50 . 1 . . . . A 558 GLY C . 30658 1
234 . 1 . 1 25 25 GLY CA C 13 44.514 0.50 . 1 . . . . A 558 GLY CA . 30658 1
235 . 1 . 1 25 25 GLY N N 15 113.552 0.25 . 1 . . . . A 558 GLY N . 30658 1
236 . 1 . 1 26 26 ARG H H 1 8.382 0.03 . 1 . . . . A 559 ARG H . 30658 1
237 . 1 . 1 26 26 ARG HA H 1 4.031 0.03 . 1 . . . . A 559 ARG HA . 30658 1
238 . 1 . 1 26 26 ARG HB2 H 1 1.628 0.03 . 2 . . . . A 559 ARG HB2 . 30658 1
239 . 1 . 1 26 26 ARG HG2 H 1 1.575 0.03 . 2 . . . . A 559 ARG HG2 . 30658 1
240 . 1 . 1 26 26 ARG HG3 H 1 1.450 0.03 . 2 . . . . A 559 ARG HG3 . 30658 1
241 . 1 . 1 26 26 ARG HD2 H 1 3.077 0.03 . 2 . . . . A 559 ARG HD2 . 30658 1
242 . 1 . 1 26 26 ARG C C 13 175.004 0.50 . 1 . . . . A 559 ARG C . 30658 1
243 . 1 . 1 26 26 ARG CA C 13 57.178 0.50 . 1 . . . . A 559 ARG CA . 30658 1
244 . 1 . 1 26 26 ARG CB C 13 30.683 0.50 . 1 . . . . A 559 ARG CB . 30658 1
245 . 1 . 1 26 26 ARG CG C 13 27.405 0.50 . 1 . . . . A 559 ARG CG . 30658 1
246 . 1 . 1 26 26 ARG CD C 13 43.245 0.50 . 1 . . . . A 559 ARG CD . 30658 1
247 . 1 . 1 26 26 ARG N N 15 124.909 0.25 . 1 . . . . A 559 ARG N . 30658 1
248 . 1 . 1 27 27 CYS H H 1 8.374 0.03 . 1 . . . . A 560 CYS H . 30658 1
249 . 1 . 1 27 27 CYS HA H 1 4.883 0.03 . 1 . . . . A 560 CYS HA . 30658 1
250 . 1 . 1 27 27 CYS HB2 H 1 2.672 0.03 . 2 . . . . A 560 CYS HB2 . 30658 1
251 . 1 . 1 27 27 CYS HB3 H 1 2.589 0.03 . 2 . . . . A 560 CYS HB3 . 30658 1
252 . 1 . 1 27 27 CYS C C 13 173.463 0.50 . 1 . . . . A 560 CYS C . 30658 1
253 . 1 . 1 27 27 CYS CA C 13 55.859 0.50 . 1 . . . . A 560 CYS CA . 30658 1
254 . 1 . 1 27 27 CYS CB C 13 30.724 0.50 . 1 . . . . A 560 CYS CB . 30658 1
255 . 1 . 1 27 27 CYS N N 15 118.331 0.25 . 1 . . . . A 560 CYS N . 30658 1
256 . 1 . 1 28 28 ILE H H 1 8.734 0.03 . 1 . . . . A 561 ILE H . 30658 1
257 . 1 . 1 28 28 ILE HA H 1 4.367 0.03 . 1 . . . . A 561 ILE HA . 30658 1
258 . 1 . 1 28 28 ILE HB H 1 1.417 0.03 . 1 . . . . A 561 ILE HB . 30658 1
259 . 1 . 1 28 28 ILE HG12 H 1 1.307 0.03 . 2 . . . . A 561 ILE HG12 . 30658 1
260 . 1 . 1 28 28 ILE HG13 H 1 0.986 0.03 . 2 . . . . A 561 ILE HG13 . 30658 1
261 . 1 . 1 28 28 ILE HG21 H 1 0.166 0.03 . 1 . . . . A 561 ILE HG21 . 30658 1
262 . 1 . 1 28 28 ILE HG22 H 1 0.166 0.03 . 1 . . . . A 561 ILE HG22 . 30658 1
263 . 1 . 1 28 28 ILE HG23 H 1 0.166 0.03 . 1 . . . . A 561 ILE HG23 . 30658 1
264 . 1 . 1 28 28 ILE HD11 H 1 0.700 0.03 . 1 . . . . A 561 ILE HD11 . 30658 1
265 . 1 . 1 28 28 ILE HD12 H 1 0.700 0.03 . 1 . . . . A 561 ILE HD12 . 30658 1
266 . 1 . 1 28 28 ILE HD13 H 1 0.700 0.03 . 1 . . . . A 561 ILE HD13 . 30658 1
267 . 1 . 1 28 28 ILE C C 13 174.727 0.50 . 1 . . . . A 561 ILE C . 30658 1
268 . 1 . 1 28 28 ILE CA C 13 59.221 0.50 . 1 . . . . A 561 ILE CA . 30658 1
269 . 1 . 1 28 28 ILE CB C 13 39.812 0.50 . 1 . . . . A 561 ILE CB . 30658 1
270 . 1 . 1 28 28 ILE CG1 C 13 27.455 0.50 . 1 . . . . A 561 ILE CG1 . 30658 1
271 . 1 . 1 28 28 ILE CG2 C 13 16.305 0.50 . 1 . . . . A 561 ILE CG2 . 30658 1
272 . 1 . 1 28 28 ILE CD1 C 13 12.359 0.50 . 1 . . . . A 561 ILE CD1 . 30658 1
273 . 1 . 1 28 28 ILE N N 15 123.939 0.25 . 1 . . . . A 561 ILE N . 30658 1
274 . 1 . 1 29 29 THR H H 1 8.338 0.03 . 1 . . . . A 562 THR H . 30658 1
275 . 1 . 1 29 29 THR HA H 1 5.015 0.03 . 1 . . . . A 562 THR HA . 30658 1
276 . 1 . 1 29 29 THR HB H 1 3.869 0.03 . 1 . . . . A 562 THR HB . 30658 1
277 . 1 . 1 29 29 THR HG21 H 1 0.922 0.03 . 1 . . . . A 562 THR HG21 . 30658 1
278 . 1 . 1 29 29 THR HG22 H 1 0.922 0.03 . 1 . . . . A 562 THR HG22 . 30658 1
279 . 1 . 1 29 29 THR HG23 H 1 0.922 0.03 . 1 . . . . A 562 THR HG23 . 30658 1
280 . 1 . 1 29 29 THR C C 13 173.214 0.50 . 1 . . . . A 562 THR C . 30658 1
281 . 1 . 1 29 29 THR CA C 13 60.119 0.50 . 1 . . . . A 562 THR CA . 30658 1
282 . 1 . 1 29 29 THR CB C 13 69.223 0.50 . 1 . . . . A 562 THR CB . 30658 1
283 . 1 . 1 29 29 THR CG2 C 13 20.718 0.50 . 1 . . . . A 562 THR CG2 . 30658 1
284 . 1 . 1 29 29 THR N N 15 122.148 0.25 . 1 . . . . A 562 THR N . 30658 1
285 . 1 . 1 30 30 ALA H H 1 8.475 0.03 . 1 . . . . A 563 ALA H . 30658 1
286 . 1 . 1 30 30 ALA HA H 1 4.333 0.03 . 1 . . . . A 563 ALA HA . 30658 1
287 . 1 . 1 30 30 ALA HB1 H 1 0.537 0.03 . 1 . . . . A 563 ALA HB1 . 30658 1
288 . 1 . 1 30 30 ALA HB2 H 1 0.537 0.03 . 1 . . . . A 563 ALA HB2 . 30658 1
289 . 1 . 1 30 30 ALA HB3 H 1 0.537 0.03 . 1 . . . . A 563 ALA HB3 . 30658 1
290 . 1 . 1 30 30 ALA C C 13 175.983 0.50 . 1 . . . . A 563 ALA C . 30658 1
291 . 1 . 1 30 30 ALA CA C 13 51.623 0.50 . 1 . . . . A 563 ALA CA . 30658 1
292 . 1 . 1 30 30 ALA CB C 13 21.881 0.50 . 1 . . . . A 563 ALA CB . 30658 1
293 . 1 . 1 30 30 ALA N N 15 127.629 0.25 . 1 . . . . A 563 ALA N . 30658 1
294 . 1 . 1 31 31 MET H H 1 9.215 0.03 . 1 . . . . A 564 MET H . 30658 1
295 . 1 . 1 31 31 MET HA H 1 3.926 0.03 . 1 . . . . A 564 MET HA . 30658 1
296 . 1 . 1 31 31 MET HB2 H 1 2.247 0.03 . 2 . . . . A 564 MET HB2 . 30658 1
297 . 1 . 1 31 31 MET HB3 H 1 2.167 0.03 . 2 . . . . A 564 MET HB3 . 30658 1
298 . 1 . 1 31 31 MET HG2 H 1 2.497 0.03 . 2 . . . . A 564 MET HG2 . 30658 1
299 . 1 . 1 31 31 MET HG3 H 1 2.240 0.03 . 2 . . . . A 564 MET HG3 . 30658 1
300 . 1 . 1 31 31 MET C C 13 174.798 0.50 . 1 . . . . A 564 MET C . 30658 1
301 . 1 . 1 31 31 MET CA C 13 56.593 0.50 . 1 . . . . A 564 MET CA . 30658 1
302 . 1 . 1 31 31 MET CB C 13 30.445 0.50 . 1 . . . . A 564 MET CB . 30658 1
303 . 1 . 1 31 31 MET CG C 13 32.047 0.50 . 1 . . . . A 564 MET CG . 30658 1
304 . 1 . 1 31 31 MET N N 15 117.522 0.25 . 1 . . . . A 564 MET N . 30658 1
305 . 1 . 1 32 32 ALA H H 1 8.513 0.03 . 1 . . . . A 565 ALA H . 30658 1
306 . 1 . 1 32 32 ALA HA H 1 3.723 0.03 . 1 . . . . A 565 ALA HA . 30658 1
307 . 1 . 1 32 32 ALA HB1 H 1 1.392 0.03 . 1 . . . . A 565 ALA HB1 . 30658 1
308 . 1 . 1 32 32 ALA HB2 H 1 1.392 0.03 . 1 . . . . A 565 ALA HB2 . 30658 1
309 . 1 . 1 32 32 ALA HB3 H 1 1.392 0.03 . 1 . . . . A 565 ALA HB3 . 30658 1
310 . 1 . 1 32 32 ALA C C 13 175.984 0.50 . 1 . . . . A 565 ALA C . 30658 1
311 . 1 . 1 32 32 ALA CA C 13 53.182 0.50 . 1 . . . . A 565 ALA CA . 30658 1
312 . 1 . 1 32 32 ALA CB C 13 16.991 0.50 . 1 . . . . A 565 ALA CB . 30658 1
313 . 1 . 1 32 32 ALA N N 15 114.332 0.25 . 1 . . . . A 565 ALA N . 30658 1
314 . 1 . 1 33 33 LYS H H 1 7.989 0.03 . 1 . . . . A 566 LYS H . 30658 1
315 . 1 . 1 33 33 LYS HA H 1 4.309 0.03 . 1 . . . . A 566 LYS HA . 30658 1
316 . 1 . 1 33 33 LYS HB2 H 1 1.689 0.03 . 2 . . . . A 566 LYS HB2 . 30658 1
317 . 1 . 1 33 33 LYS HB3 H 1 1.414 0.03 . 2 . . . . A 566 LYS HB3 . 30658 1
318 . 1 . 1 33 33 LYS HG2 H 1 1.245 0.03 . 2 . . . . A 566 LYS HG2 . 30658 1
319 . 1 . 1 33 33 LYS HG3 H 1 1.405 0.03 . 2 . . . . A 566 LYS HG3 . 30658 1
320 . 1 . 1 33 33 LYS HD2 H 1 1.518 0.03 . 2 . . . . A 566 LYS HD2 . 30658 1
321 . 1 . 1 33 33 LYS HD3 H 1 1.388 0.03 . 2 . . . . A 566 LYS HD3 . 30658 1
322 . 1 . 1 33 33 LYS HE2 H 1 3.008 0.03 . 2 . . . . A 566 LYS HE2 . 30658 1
323 . 1 . 1 33 33 LYS C C 13 173.745 0.50 . 1 . . . . A 566 LYS C . 30658 1
324 . 1 . 1 33 33 LYS CA C 13 54.994 0.50 . 1 . . . . A 566 LYS CA . 30658 1
325 . 1 . 1 33 33 LYS CB C 13 36.791 0.50 . 1 . . . . A 566 LYS CB . 30658 1
326 . 1 . 1 33 33 LYS CG C 13 25.002 0.50 . 1 . . . . A 566 LYS CG . 30658 1
327 . 1 . 1 33 33 LYS CD C 13 29.306 0.50 . 1 . . . . A 566 LYS CD . 30658 1
328 . 1 . 1 33 33 LYS CE C 13 42.800 0.50 . 1 . . . . A 566 LYS CE . 30658 1
329 . 1 . 1 33 33 LYS N N 15 121.368 0.25 . 1 . . . . A 566 LYS N . 30658 1
330 . 1 . 1 34 34 LYS H H 1 7.908 0.03 . 1 . . . . A 567 LYS H . 30658 1
331 . 1 . 1 34 34 LYS HA H 1 5.040 0.03 . 1 . . . . A 567 LYS HA . 30658 1
332 . 1 . 1 34 34 LYS HB2 H 1 1.287 0.03 . 2 . . . . A 567 LYS HB2 . 30658 1
333 . 1 . 1 34 34 LYS HB3 H 1 1.207 0.03 . 2 . . . . A 567 LYS HB3 . 30658 1
334 . 1 . 1 34 34 LYS HG2 H 1 1.150 0.03 . 2 . . . . A 567 LYS HG2 . 30658 1
335 . 1 . 1 34 34 LYS HD2 H 1 1.276 0.03 . 2 . . . . A 567 LYS HD2 . 30658 1
336 . 1 . 1 34 34 LYS HD3 H 1 1.401 0.03 . 2 . . . . A 567 LYS HD3 . 30658 1
337 . 1 . 1 34 34 LYS HE2 H 1 2.674 0.03 . 2 . . . . A 567 LYS HE2 . 30658 1
338 . 1 . 1 34 34 LYS C C 13 175.067 0.50 . 1 . . . . A 567 LYS C . 30658 1
339 . 1 . 1 34 34 LYS CA C 13 54.391 0.50 . 1 . . . . A 567 LYS CA . 30658 1
340 . 1 . 1 34 34 LYS CB C 13 35.781 0.50 . 1 . . . . A 567 LYS CB . 30658 1
341 . 1 . 1 34 34 LYS CG C 13 25.298 0.50 . 1 . . . . A 567 LYS CG . 30658 1
342 . 1 . 1 34 34 LYS CD C 13 29.402 0.50 . 1 . . . . A 567 LYS CD . 30658 1
343 . 1 . 1 34 34 LYS CE C 13 42.173 0.50 . 1 . . . . A 567 LYS CE . 30658 1
344 . 1 . 1 34 34 LYS N N 15 117.782 0.25 . 1 . . . . A 567 LYS N . 30658 1
345 . 1 . 1 35 35 PHE H H 1 8.696 0.03 . 1 . . . . A 568 PHE H . 30658 1
346 . 1 . 1 35 35 PHE HA H 1 5.573 0.03 . 1 . . . . A 568 PHE HA . 30658 1
347 . 1 . 1 35 35 PHE HB2 H 1 3.146 0.03 . 2 . . . . A 568 PHE HB2 . 30658 1
348 . 1 . 1 35 35 PHE HB3 H 1 2.203 0.03 . 2 . . . . A 568 PHE HB3 . 30658 1
349 . 1 . 1 35 35 PHE C C 13 178.375 0.50 . 1 . . . . A 568 PHE C . 30658 1
350 . 1 . 1 35 35 PHE CA C 13 56.245 0.50 . 1 . . . . A 568 PHE CA . 30658 1
351 . 1 . 1 35 35 PHE CB C 13 43.380 0.50 . 1 . . . . A 568 PHE CB . 30658 1
352 . 1 . 1 35 35 PHE N N 15 115.442 0.25 . 1 . . . . A 568 PHE N . 30658 1
353 . 1 . 1 36 36 HIS H H 1 9.274 0.03 . 1 . . . . A 569 HIS H . 30658 1
354 . 1 . 1 36 36 HIS HA H 1 4.598 0.03 . 1 . . . . A 569 HIS HA . 30658 1
355 . 1 . 1 36 36 HIS HB2 H 1 2.397 0.03 . 2 . . . . A 569 HIS HB2 . 30658 1
356 . 1 . 1 36 36 HIS HB3 H 1 3.205 0.03 . 2 . . . . A 569 HIS HB3 . 30658 1
357 . 1 . 1 36 36 HIS CA C 13 58.212 0.50 . 1 . . . . A 569 HIS CA . 30658 1
358 . 1 . 1 36 36 HIS CB C 13 29.093 0.50 . 1 . . . . A 569 HIS CB . 30658 1
359 . 1 . 1 36 36 HIS N N 15 123.180 0.25 . 1 . . . . A 569 HIS N . 30658 1
360 . 1 . 1 37 37 PRO HA H 1 3.966 0.03 . 1 . . . . A 570 PRO HA . 30658 1
361 . 1 . 1 37 37 PRO HB2 H 1 2.298 0.03 . 2 . . . . A 570 PRO HB2 . 30658 1
362 . 1 . 1 37 37 PRO HB3 H 1 1.875 0.03 . 2 . . . . A 570 PRO HB3 . 30658 1
363 . 1 . 1 37 37 PRO HG2 H 1 2.080 0.03 . 2 . . . . A 570 PRO HG2 . 30658 1
364 . 1 . 1 37 37 PRO HG3 H 1 1.600 0.03 . 2 . . . . A 570 PRO HG3 . 30658 1
365 . 1 . 1 37 37 PRO HD2 H 1 4.030 0.03 . 2 . . . . A 570 PRO HD2 . 30658 1
366 . 1 . 1 37 37 PRO HD3 H 1 3.785 0.03 . 2 . . . . A 570 PRO HD3 . 30658 1
367 . 1 . 1 37 37 PRO C C 13 178.191 0.50 . 1 . . . . A 570 PRO C . 30658 1
368 . 1 . 1 37 37 PRO CA C 13 66.475 0.50 . 1 . . . . A 570 PRO CA . 30658 1
369 . 1 . 1 37 37 PRO CB C 13 31.499 0.50 . 1 . . . . A 570 PRO CB . 30658 1
370 . 1 . 1 37 37 PRO CG C 13 28.186 0.50 . 1 . . . . A 570 PRO CG . 30658 1
371 . 1 . 1 37 37 PRO CD C 13 49.707 0.50 . 1 . . . . A 570 PRO CD . 30658 1
372 . 1 . 1 38 38 GLU H H 1 9.939 0.03 . 1 . . . . A 571 GLU H . 30658 1
373 . 1 . 1 38 38 GLU HA H 1 4.024 0.03 . 1 . . . . A 571 GLU HA . 30658 1
374 . 1 . 1 38 38 GLU HB2 H 1 1.800 0.03 . 2 . . . . A 571 GLU HB2 . 30658 1
375 . 1 . 1 38 38 GLU HB3 H 1 1.687 0.03 . 2 . . . . A 571 GLU HB3 . 30658 1
376 . 1 . 1 38 38 GLU HG2 H 1 1.953 0.03 . 2 . . . . A 571 GLU HG2 . 30658 1
377 . 1 . 1 38 38 GLU HG3 H 1 1.465 0.03 . 2 . . . . A 571 GLU HG3 . 30658 1
378 . 1 . 1 38 38 GLU C C 13 175.842 0.50 . 1 . . . . A 571 GLU C . 30658 1
379 . 1 . 1 38 38 GLU CA C 13 57.579 0.50 . 1 . . . . A 571 GLU CA . 30658 1
380 . 1 . 1 38 38 GLU CB C 13 27.565 0.50 . 1 . . . . A 571 GLU CB . 30658 1
381 . 1 . 1 38 38 GLU CG C 13 35.277 0.50 . 1 . . . . A 571 GLU CG . 30658 1
382 . 1 . 1 38 38 GLU N N 15 114.010 0.25 . 1 . . . . A 571 GLU N . 30658 1
383 . 1 . 1 39 39 HIS H H 1 8.111 0.03 . 1 . . . . A 572 HIS H . 30658 1
384 . 1 . 1 39 39 HIS HA H 1 4.973 0.03 . 1 . . . . A 572 HIS HA . 30658 1
385 . 1 . 1 39 39 HIS HB2 H 1 3.603 0.03 . 2 . . . . A 572 HIS HB2 . 30658 1
386 . 1 . 1 39 39 HIS HB3 H 1 3.203 0.03 . 2 . . . . A 572 HIS HB3 . 30658 1
387 . 1 . 1 39 39 HIS C C 13 173.098 0.50 . 1 . . . . A 572 HIS C . 30658 1
388 . 1 . 1 39 39 HIS CA C 13 52.847 0.50 . 1 . . . . A 572 HIS CA . 30658 1
389 . 1 . 1 39 39 HIS CB C 13 32.386 0.50 . 1 . . . . A 572 HIS CB . 30658 1
390 . 1 . 1 39 39 HIS N N 15 116.321 0.25 . 1 . . . . A 572 HIS N . 30658 1
391 . 1 . 1 40 40 PHE H H 1 7.413 0.03 . 1 . . . . A 573 PHE H . 30658 1
392 . 1 . 1 40 40 PHE HA H 1 4.215 0.03 . 1 . . . . A 573 PHE HA . 30658 1
393 . 1 . 1 40 40 PHE HB2 H 1 2.947 0.03 . 2 . . . . A 573 PHE HB2 . 30658 1
394 . 1 . 1 40 40 PHE HB3 H 1 1.957 0.03 . 2 . . . . A 573 PHE HB3 . 30658 1
395 . 1 . 1 40 40 PHE C C 13 171.974 0.50 . 1 . . . . A 573 PHE C . 30658 1
396 . 1 . 1 40 40 PHE CA C 13 55.684 0.50 . 1 . . . . A 573 PHE CA . 30658 1
397 . 1 . 1 40 40 PHE CB C 13 36.875 0.50 . 1 . . . . A 573 PHE CB . 30658 1
398 . 1 . 1 40 40 PHE N N 15 125.830 0.25 . 1 . . . . A 573 PHE N . 30658 1
399 . 1 . 1 41 41 VAL H H 1 6.628 0.03 . 1 . . . . A 574 VAL H . 30658 1
400 . 1 . 1 41 41 VAL HA H 1 4.623 0.03 . 1 . . . . A 574 VAL HA . 30658 1
401 . 1 . 1 41 41 VAL HB H 1 1.363 0.03 . 1 . . . . A 574 VAL HB . 30658 1
402 . 1 . 1 41 41 VAL HG11 H 1 0.411 0.03 . 2 . . . . A 574 VAL HG11 . 30658 1
403 . 1 . 1 41 41 VAL HG12 H 1 0.411 0.03 . 2 . . . . A 574 VAL HG12 . 30658 1
404 . 1 . 1 41 41 VAL HG13 H 1 0.411 0.03 . 2 . . . . A 574 VAL HG13 . 30658 1
405 . 1 . 1 41 41 VAL HG21 H 1 0.390 0.03 . 2 . . . . A 574 VAL HG21 . 30658 1
406 . 1 . 1 41 41 VAL HG22 H 1 0.390 0.03 . 2 . . . . A 574 VAL HG22 . 30658 1
407 . 1 . 1 41 41 VAL HG23 H 1 0.390 0.03 . 2 . . . . A 574 VAL HG23 . 30658 1
408 . 1 . 1 41 41 VAL C C 13 173.398 0.50 . 1 . . . . A 574 VAL C . 30658 1
409 . 1 . 1 41 41 VAL CA C 13 56.501 0.50 . 1 . . . . A 574 VAL CA . 30658 1
410 . 1 . 1 41 41 VAL CB C 13 35.217 0.50 . 1 . . . . A 574 VAL CB . 30658 1
411 . 1 . 1 41 41 VAL CG1 C 13 21.149 0.50 . 2 . . . . A 574 VAL CG1 . 30658 1
412 . 1 . 1 41 41 VAL CG2 C 13 17.495 0.50 . 2 . . . . A 574 VAL CG2 . 30658 1
413 . 1 . 1 41 41 VAL N N 15 113.940 0.25 . 1 . . . . A 574 VAL N . 30658 1
414 . 1 . 1 42 42 CYS H H 1 8.277 0.03 . 1 . . . . A 575 CYS H . 30658 1
415 . 1 . 1 42 42 CYS HA H 1 3.732 0.03 . 1 . . . . A 575 CYS HA . 30658 1
416 . 1 . 1 42 42 CYS HB2 H 1 3.251 0.03 . 2 . . . . A 575 CYS HB2 . 30658 1
417 . 1 . 1 42 42 CYS HB3 H 1 2.648 0.03 . 2 . . . . A 575 CYS HB3 . 30658 1
418 . 1 . 1 42 42 CYS C C 13 176.643 0.50 . 1 . . . . A 575 CYS C . 30658 1
419 . 1 . 1 42 42 CYS CA C 13 59.236 0.50 . 1 . . . . A 575 CYS CA . 30658 1
420 . 1 . 1 42 42 CYS CB C 13 30.925 0.50 . 1 . . . . A 575 CYS CB . 30658 1
421 . 1 . 1 42 42 CYS N N 15 122.511 0.25 . 1 . . . . A 575 CYS N . 30658 1
422 . 1 . 1 43 43 ALA H H 1 8.811 0.03 . 1 . . . . A 576 ALA H . 30658 1
423 . 1 . 1 43 43 ALA HA H 1 3.898 0.03 . 1 . . . . A 576 ALA HA . 30658 1
424 . 1 . 1 43 43 ALA HB1 H 1 1.028 0.03 . 1 . . . . A 576 ALA HB1 . 30658 1
425 . 1 . 1 43 43 ALA HB2 H 1 1.028 0.03 . 1 . . . . A 576 ALA HB2 . 30658 1
426 . 1 . 1 43 43 ALA HB3 H 1 1.028 0.03 . 1 . . . . A 576 ALA HB3 . 30658 1
427 . 1 . 1 43 43 ALA C C 13 177.452 0.50 . 1 . . . . A 576 ALA C . 30658 1
428 . 1 . 1 43 43 ALA CA C 13 53.990 0.50 . 1 . . . . A 576 ALA CA . 30658 1
429 . 1 . 1 43 43 ALA CB C 13 18.225 0.50 . 1 . . . . A 576 ALA CB . 30658 1
430 . 1 . 1 43 43 ALA N N 15 130.720 0.25 . 1 . . . . A 576 ALA N . 30658 1
431 . 1 . 1 44 44 PHE H H 1 9.131 0.03 . 1 . . . . A 577 PHE H . 30658 1
432 . 1 . 1 44 44 PHE HA H 1 4.805 0.03 . 1 . . . . A 577 PHE HA . 30658 1
433 . 1 . 1 44 44 PHE HB2 H 1 4.050 0.03 . 2 . . . . A 577 PHE HB2 . 30658 1
434 . 1 . 1 44 44 PHE HB3 H 1 3.004 0.03 . 2 . . . . A 577 PHE HB3 . 30658 1
435 . 1 . 1 44 44 PHE C C 13 175.751 0.50 . 1 . . . . A 577 PHE C . 30658 1
436 . 1 . 1 44 44 PHE CA C 13 60.428 0.50 . 1 . . . . A 577 PHE CA . 30658 1
437 . 1 . 1 44 44 PHE CB C 13 39.638 0.50 . 1 . . . . A 577 PHE CB . 30658 1
438 . 1 . 1 44 44 PHE N N 15 120.502 0.25 . 1 . . . . A 577 PHE N . 30658 1
439 . 1 . 1 45 45 CYS H H 1 8.668 0.03 . 1 . . . . A 578 CYS H . 30658 1
440 . 1 . 1 45 45 CYS HA H 1 4.588 0.03 . 1 . . . . A 578 CYS HA . 30658 1
441 . 1 . 1 45 45 CYS HB2 H 1 3.205 0.03 . 2 . . . . A 578 CYS HB2 . 30658 1
442 . 1 . 1 45 45 CYS HB3 H 1 2.725 0.03 . 2 . . . . A 578 CYS HB3 . 30658 1
443 . 1 . 1 45 45 CYS C C 13 176.172 0.50 . 1 . . . . A 578 CYS C . 30658 1
444 . 1 . 1 45 45 CYS CA C 13 59.552 0.50 . 1 . . . . A 578 CYS CA . 30658 1
445 . 1 . 1 45 45 CYS CB C 13 32.145 0.50 . 1 . . . . A 578 CYS CB . 30658 1
446 . 1 . 1 45 45 CYS N N 15 119.061 0.25 . 1 . . . . A 578 CYS N . 30658 1
447 . 1 . 1 46 46 LEU H H 1 7.873 0.03 . 1 . . . . A 579 LEU H . 30658 1
448 . 1 . 1 46 46 LEU HA H 1 4.049 0.03 . 1 . . . . A 579 LEU HA . 30658 1
449 . 1 . 1 46 46 LEU HB2 H 1 1.981 0.03 . 2 . . . . A 579 LEU HB2 . 30658 1
450 . 1 . 1 46 46 LEU HB3 H 1 1.510 0.03 . 2 . . . . A 579 LEU HB3 . 30658 1
451 . 1 . 1 46 46 LEU HG H 1 1.176 0.03 . 1 . . . . A 579 LEU HG . 30658 1
452 . 1 . 1 46 46 LEU HD11 H 1 0.664 0.03 . 2 . . . . A 579 LEU HD11 . 30658 1
453 . 1 . 1 46 46 LEU HD12 H 1 0.664 0.03 . 2 . . . . A 579 LEU HD12 . 30658 1
454 . 1 . 1 46 46 LEU HD13 H 1 0.664 0.03 . 2 . . . . A 579 LEU HD13 . 30658 1
455 . 1 . 1 46 46 LEU HD21 H 1 0.699 0.03 . 2 . . . . A 579 LEU HD21 . 30658 1
456 . 1 . 1 46 46 LEU HD22 H 1 0.699 0.03 . 2 . . . . A 579 LEU HD22 . 30658 1
457 . 1 . 1 46 46 LEU HD23 H 1 0.699 0.03 . 2 . . . . A 579 LEU HD23 . 30658 1
458 . 1 . 1 46 46 LEU C C 13 175.482 0.50 . 1 . . . . A 579 LEU C . 30658 1
459 . 1 . 1 46 46 LEU CA C 13 56.721 0.50 . 1 . . . . A 579 LEU CA . 30658 1
460 . 1 . 1 46 46 LEU CB C 13 38.143 0.50 . 1 . . . . A 579 LEU CB . 30658 1
461 . 1 . 1 46 46 LEU CG C 13 27.199 0.50 . 1 . . . . A 579 LEU CG . 30658 1
462 . 1 . 1 46 46 LEU CD1 C 13 22.351 0.50 . 2 . . . . A 579 LEU CD1 . 30658 1
463 . 1 . 1 46 46 LEU CD2 C 13 24.918 0.50 . 2 . . . . A 579 LEU CD2 . 30658 1
464 . 1 . 1 46 46 LEU N N 15 118.050 0.25 . 1 . . . . A 579 LEU N . 30658 1
465 . 1 . 1 47 47 LYS H H 1 8.162 0.03 . 1 . . . . A 580 LYS H . 30658 1
466 . 1 . 1 47 47 LYS HA H 1 4.171 0.03 . 1 . . . . A 580 LYS HA . 30658 1
467 . 1 . 1 47 47 LYS HB2 H 1 1.919 0.03 . 2 . . . . A 580 LYS HB2 . 30658 1
468 . 1 . 1 47 47 LYS HB3 H 1 1.599 0.03 . 2 . . . . A 580 LYS HB3 . 30658 1
469 . 1 . 1 47 47 LYS HG2 H 1 1.425 0.03 . 2 . . . . A 580 LYS HG2 . 30658 1
470 . 1 . 1 47 47 LYS HG3 H 1 1.395 0.03 . 2 . . . . A 580 LYS HG3 . 30658 1
471 . 1 . 1 47 47 LYS HD2 H 1 1.655 0.03 . 2 . . . . A 580 LYS HD2 . 30658 1
472 . 1 . 1 47 47 LYS HE2 H 1 2.987 0.03 . 2 . . . . A 580 LYS HE2 . 30658 1
473 . 1 . 1 47 47 LYS C C 13 176.205 0.50 . 1 . . . . A 580 LYS C . 30658 1
474 . 1 . 1 47 47 LYS CA C 13 56.633 0.50 . 1 . . . . A 580 LYS CA . 30658 1
475 . 1 . 1 47 47 LYS CB C 13 33.279 0.50 . 1 . . . . A 580 LYS CB . 30658 1
476 . 1 . 1 47 47 LYS CG C 13 24.971 0.50 . 1 . . . . A 580 LYS CG . 30658 1
477 . 1 . 1 47 47 LYS CD C 13 29.271 0.50 . 1 . . . . A 580 LYS CD . 30658 1
478 . 1 . 1 47 47 LYS CE C 13 41.904 0.50 . 1 . . . . A 580 LYS CE . 30658 1
479 . 1 . 1 47 47 LYS N N 15 121.220 0.25 . 1 . . . . A 580 LYS N . 30658 1
480 . 1 . 1 48 48 GLN H H 1 8.411 0.03 . 1 . . . . A 581 GLN H . 30658 1
481 . 1 . 1 48 48 GLN HA H 1 3.917 0.03 . 1 . . . . A 581 GLN HA . 30658 1
482 . 1 . 1 48 48 GLN HB2 H 1 1.923 0.03 . 2 . . . . A 581 GLN HB2 . 30658 1
483 . 1 . 1 48 48 GLN HB3 H 1 1.878 0.03 . 2 . . . . A 581 GLN HB3 . 30658 1
484 . 1 . 1 48 48 GLN HG2 H 1 2.323 0.03 . 2 . . . . A 581 GLN HG2 . 30658 1
485 . 1 . 1 48 48 GLN HG3 H 1 2.293 0.03 . 2 . . . . A 581 GLN HG3 . 30658 1
486 . 1 . 1 48 48 GLN HE21 H 1 7.400 0.03 . 2 . . . . A 581 GLN HE21 . 30658 1
487 . 1 . 1 48 48 GLN HE22 H 1 6.985 0.03 . 2 . . . . A 581 GLN HE22 . 30658 1
488 . 1 . 1 48 48 GLN C C 13 175.898 0.50 . 1 . . . . A 581 GLN C . 30658 1
489 . 1 . 1 48 48 GLN CA C 13 57.437 0.50 . 1 . . . . A 581 GLN CA . 30658 1
490 . 1 . 1 48 48 GLN CB C 13 28.558 0.50 . 1 . . . . A 581 GLN CB . 30658 1
491 . 1 . 1 48 48 GLN CG C 13 34.085 0.50 . 1 . . . . A 581 GLN CG . 30658 1
492 . 1 . 1 48 48 GLN N N 15 121.740 0.25 . 1 . . . . A 581 GLN N . 30658 1
493 . 1 . 1 48 48 GLN NE2 N 15 112.198 0.25 . 1 . . . . A 581 GLN NE2 . 30658 1
494 . 1 . 1 49 49 LEU H H 1 8.098 0.03 . 1 . . . . A 582 LEU H . 30658 1
495 . 1 . 1 49 49 LEU HA H 1 4.292 0.03 . 1 . . . . A 582 LEU HA . 30658 1
496 . 1 . 1 49 49 LEU HB2 H 1 0.665 0.03 . 2 . . . . A 582 LEU HB2 . 30658 1
497 . 1 . 1 49 49 LEU HB3 H 1 0.605 0.03 . 2 . . . . A 582 LEU HB3 . 30658 1
498 . 1 . 1 49 49 LEU HG H 1 1.106 0.03 . 1 . . . . A 582 LEU HG . 30658 1
499 . 1 . 1 49 49 LEU HD11 H 1 0.510 0.03 . 2 . . . . A 582 LEU HD11 . 30658 1
500 . 1 . 1 49 49 LEU HD12 H 1 0.510 0.03 . 2 . . . . A 582 LEU HD12 . 30658 1
501 . 1 . 1 49 49 LEU HD13 H 1 0.510 0.03 . 2 . . . . A 582 LEU HD13 . 30658 1
502 . 1 . 1 49 49 LEU HD21 H 1 -0.470 0.03 . 2 . . . . A 582 LEU HD21 . 30658 1
503 . 1 . 1 49 49 LEU HD22 H 1 -0.470 0.03 . 2 . . . . A 582 LEU HD22 . 30658 1
504 . 1 . 1 49 49 LEU HD23 H 1 -0.470 0.03 . 2 . . . . A 582 LEU HD23 . 30658 1
505 . 1 . 1 49 49 LEU C C 13 175.340 0.50 . 1 . . . . A 582 LEU C . 30658 1
506 . 1 . 1 49 49 LEU CA C 13 53.096 0.50 . 1 . . . . A 582 LEU CA . 30658 1
507 . 1 . 1 49 49 LEU CB C 13 43.606 0.50 . 1 . . . . A 582 LEU CB . 30658 1
508 . 1 . 1 49 49 LEU CG C 13 25.621 0.50 . 1 . . . . A 582 LEU CG . 30658 1
509 . 1 . 1 49 49 LEU CD1 C 13 22.186 0.50 . 2 . . . . A 582 LEU CD1 . 30658 1
510 . 1 . 1 49 49 LEU CD2 C 13 25.940 0.50 . 2 . . . . A 582 LEU CD2 . 30658 1
511 . 1 . 1 49 49 LEU N N 15 125.879 0.25 . 1 . . . . A 582 LEU N . 30658 1
512 . 1 . 1 50 50 ASN H H 1 8.159 0.03 . 1 . . . . A 583 ASN H . 30658 1
513 . 1 . 1 50 50 ASN HA H 1 4.838 0.03 . 1 . . . . A 583 ASN HA . 30658 1
514 . 1 . 1 50 50 ASN HB2 H 1 2.901 0.03 . 2 . . . . A 583 ASN HB2 . 30658 1
515 . 1 . 1 50 50 ASN HB3 H 1 2.783 0.03 . 2 . . . . A 583 ASN HB3 . 30658 1
516 . 1 . 1 50 50 ASN HD21 H 1 7.665 0.03 . 2 . . . . A 583 ASN HD21 . 30658 1
517 . 1 . 1 50 50 ASN HD22 H 1 6.950 0.03 . 2 . . . . A 583 ASN HD22 . 30658 1
518 . 1 . 1 50 50 ASN C C 13 175.552 0.50 . 1 . . . . A 583 ASN C . 30658 1
519 . 1 . 1 50 50 ASN CA C 13 51.974 0.50 . 1 . . . . A 583 ASN CA . 30658 1
520 . 1 . 1 50 50 ASN CB C 13 40.846 0.50 . 1 . . . . A 583 ASN CB . 30658 1
521 . 1 . 1 50 50 ASN N N 15 116.981 0.25 . 1 . . . . A 583 ASN N . 30658 1
522 . 1 . 1 50 50 ASN ND2 N 15 114.769 0.25 . 1 . . . . A 583 ASN ND2 . 30658 1
523 . 1 . 1 51 51 LYS H H 1 9.085 0.03 . 1 . . . . A 584 LYS H . 30658 1
524 . 1 . 1 51 51 LYS HA H 1 4.155 0.03 . 1 . . . . A 584 LYS HA . 30658 1
525 . 1 . 1 51 51 LYS HB2 H 1 1.819 0.03 . 2 . . . . A 584 LYS HB2 . 30658 1
526 . 1 . 1 51 51 LYS HG2 H 1 1.434 0.03 . 2 . . . . A 584 LYS HG2 . 30658 1
527 . 1 . 1 51 51 LYS HD2 H 1 1.663 0.03 . 2 . . . . A 584 LYS HD2 . 30658 1
528 . 1 . 1 51 51 LYS HE2 H 1 3.000 0.03 . 2 . . . . A 584 LYS HE2 . 30658 1
529 . 1 . 1 51 51 LYS C C 13 176.633 0.50 . 1 . . . . A 584 LYS C . 30658 1
530 . 1 . 1 51 51 LYS CA C 13 59.010 0.50 . 1 . . . . A 584 LYS CA . 30658 1
531 . 1 . 1 51 51 LYS CB C 13 31.941 0.50 . 1 . . . . A 584 LYS CB . 30658 1
532 . 1 . 1 51 51 LYS CG C 13 24.742 0.50 . 1 . . . . A 584 LYS CG . 30658 1
533 . 1 . 1 51 51 LYS CD C 13 29.183 0.50 . 1 . . . . A 584 LYS CD . 30658 1
534 . 1 . 1 51 51 LYS CE C 13 41.986 0.50 . 1 . . . . A 584 LYS CE . 30658 1
535 . 1 . 1 51 51 LYS N N 15 122.478 0.25 . 1 . . . . A 584 LYS N . 30658 1
536 . 1 . 1 52 52 GLY H H 1 8.681 0.03 . 1 . . . . A 585 GLY H . 30658 1
537 . 1 . 1 52 52 GLY HA2 H 1 4.123 0.03 . 2 . . . . A 585 GLY HA2 . 30658 1
538 . 1 . 1 52 52 GLY HA3 H 1 3.912 0.03 . 2 . . . . A 585 GLY HA3 . 30658 1
539 . 1 . 1 52 52 GLY C C 13 175.385 0.50 . 1 . . . . A 585 GLY C . 30658 1
540 . 1 . 1 52 52 GLY CA C 13 45.325 0.50 . 1 . . . . A 585 GLY CA . 30658 1
541 . 1 . 1 52 52 GLY N N 15 106.330 0.25 . 1 . . . . A 585 GLY N . 30658 1
542 . 1 . 1 53 53 THR H H 1 7.593 0.03 . 1 . . . . A 586 THR H . 30658 1
543 . 1 . 1 53 53 THR HA H 1 4.596 0.03 . 1 . . . . A 586 THR HA . 30658 1
544 . 1 . 1 53 53 THR HB H 1 4.415 0.03 . 1 . . . . A 586 THR HB . 30658 1
545 . 1 . 1 53 53 THR HG21 H 1 1.054 0.03 . 1 . . . . A 586 THR HG21 . 30658 1
546 . 1 . 1 53 53 THR HG22 H 1 1.054 0.03 . 1 . . . . A 586 THR HG22 . 30658 1
547 . 1 . 1 53 53 THR HG23 H 1 1.054 0.03 . 1 . . . . A 586 THR HG23 . 30658 1
548 . 1 . 1 53 53 THR C C 13 173.964 0.50 . 1 . . . . A 586 THR C . 30658 1
549 . 1 . 1 53 53 THR CA C 13 60.678 0.50 . 1 . . . . A 586 THR CA . 30658 1
550 . 1 . 1 53 53 THR CB C 13 70.103 0.50 . 1 . . . . A 586 THR CB . 30658 1
551 . 1 . 1 53 53 THR CG2 C 13 21.651 0.50 . 1 . . . . A 586 THR CG2 . 30658 1
552 . 1 . 1 53 53 THR N N 15 107.968 0.25 . 1 . . . . A 586 THR N . 30658 1
553 . 1 . 1 54 54 PHE H H 1 7.421 0.03 . 1 . . . . A 587 PHE H . 30658 1
554 . 1 . 1 54 54 PHE HA H 1 4.999 0.03 . 1 . . . . A 587 PHE HA . 30658 1
555 . 1 . 1 54 54 PHE HB2 H 1 2.932 0.03 . 2 . . . . A 587 PHE HB2 . 30658 1
556 . 1 . 1 54 54 PHE HB3 H 1 2.861 0.03 . 2 . . . . A 587 PHE HB3 . 30658 1
557 . 1 . 1 54 54 PHE C C 13 172.945 0.50 . 1 . . . . A 587 PHE C . 30658 1
558 . 1 . 1 54 54 PHE CA C 13 56.023 0.50 . 1 . . . . A 587 PHE CA . 30658 1
559 . 1 . 1 54 54 PHE CB C 13 41.609 0.50 . 1 . . . . A 587 PHE CB . 30658 1
560 . 1 . 1 54 54 PHE N N 15 120.159 0.25 . 1 . . . . A 587 PHE N . 30658 1
561 . 1 . 1 55 55 LYS H H 1 9.203 0.03 . 1 . . . . A 588 LYS H . 30658 1
562 . 1 . 1 55 55 LYS HA H 1 4.112 0.03 . 1 . . . . A 588 LYS HA . 30658 1
563 . 1 . 1 55 55 LYS HB2 H 1 1.036 0.03 . 2 . . . . A 588 LYS HB2 . 30658 1
564 . 1 . 1 55 55 LYS HB3 H 1 0.758 0.03 . 2 . . . . A 588 LYS HB3 . 30658 1
565 . 1 . 1 55 55 LYS HG2 H 1 0.678 0.03 . 2 . . . . A 588 LYS HG2 . 30658 1
566 . 1 . 1 55 55 LYS HG3 H 1 0.828 0.03 . 2 . . . . A 588 LYS HG3 . 30658 1
567 . 1 . 1 55 55 LYS HD2 H 1 1.025 0.03 . 2 . . . . A 588 LYS HD2 . 30658 1
568 . 1 . 1 55 55 LYS HD3 H 1 0.910 0.03 . 2 . . . . A 588 LYS HD3 . 30658 1
569 . 1 . 1 55 55 LYS HE2 H 1 2.335 0.03 . 2 . . . . A 588 LYS HE2 . 30658 1
570 . 1 . 1 55 55 LYS HE3 H 1 2.230 0.03 . 2 . . . . A 588 LYS HE3 . 30658 1
571 . 1 . 1 55 55 LYS C C 13 174.406 0.50 . 1 . . . . A 588 LYS C . 30658 1
572 . 1 . 1 55 55 LYS CA C 13 52.812 0.50 . 1 . . . . A 588 LYS CA . 30658 1
573 . 1 . 1 55 55 LYS CB C 13 34.908 0.50 . 1 . . . . A 588 LYS CB . 30658 1
574 . 1 . 1 55 55 LYS CG C 13 23.379 0.50 . 1 . . . . A 588 LYS CG . 30658 1
575 . 1 . 1 55 55 LYS CD C 13 27.100 0.50 . 1 . . . . A 588 LYS CD . 30658 1
576 . 1 . 1 55 55 LYS CE C 13 41.369 0.50 . 1 . . . . A 588 LYS CE . 30658 1
577 . 1 . 1 55 55 LYS N N 15 121.360 0.25 . 1 . . . . A 588 LYS N . 30658 1
578 . 1 . 1 56 56 GLU H H 1 8.233 0.03 . 1 . . . . A 589 GLU H . 30658 1
579 . 1 . 1 56 56 GLU HA H 1 5.297 0.03 . 1 . . . . A 589 GLU HA . 30658 1
580 . 1 . 1 56 56 GLU HB2 H 1 1.944 0.03 . 2 . . . . A 589 GLU HB2 . 30658 1
581 . 1 . 1 56 56 GLU HB3 H 1 1.874 0.03 . 2 . . . . A 589 GLU HB3 . 30658 1
582 . 1 . 1 56 56 GLU HG2 H 1 2.134 0.03 . 2 . . . . A 589 GLU HG2 . 30658 1
583 . 1 . 1 56 56 GLU HG3 H 1 2.089 0.03 . 2 . . . . A 589 GLU HG3 . 30658 1
584 . 1 . 1 56 56 GLU C C 13 175.847 0.50 . 1 . . . . A 589 GLU C . 30658 1
585 . 1 . 1 56 56 GLU CA C 13 54.654 0.50 . 1 . . . . A 589 GLU CA . 30658 1
586 . 1 . 1 56 56 GLU CB C 13 32.097 0.50 . 1 . . . . A 589 GLU CB . 30658 1
587 . 1 . 1 56 56 GLU CG C 13 36.184 0.50 . 1 . . . . A 589 GLU CG . 30658 1
588 . 1 . 1 56 56 GLU N N 15 121.620 0.25 . 1 . . . . A 589 GLU N . 30658 1
589 . 1 . 1 57 57 GLN H H 1 9.090 0.03 . 1 . . . . A 590 GLN H . 30658 1
590 . 1 . 1 57 57 GLN HA H 1 4.253 0.03 . 1 . . . . A 590 GLN HA . 30658 1
591 . 1 . 1 57 57 GLN HB2 H 1 1.222 0.03 . 2 . . . . A 590 GLN HB2 . 30658 1
592 . 1 . 1 57 57 GLN HB3 H 1 0.570 0.03 . 2 . . . . A 590 GLN HB3 . 30658 1
593 . 1 . 1 57 57 GLN HG2 H 1 1.518 0.03 . 2 . . . . A 590 GLN HG2 . 30658 1
594 . 1 . 1 57 57 GLN HG3 H 1 1.468 0.03 . 2 . . . . A 590 GLN HG3 . 30658 1
595 . 1 . 1 57 57 GLN HE21 H 1 6.695 0.03 . 2 . . . . A 590 GLN HE21 . 30658 1
596 . 1 . 1 57 57 GLN HE22 H 1 6.570 0.03 . 2 . . . . A 590 GLN HE22 . 30658 1
597 . 1 . 1 57 57 GLN C C 13 175.374 0.50 . 1 . . . . A 590 GLN C . 30658 1
598 . 1 . 1 57 57 GLN CA C 13 56.352 0.50 . 1 . . . . A 590 GLN CA . 30658 1
599 . 1 . 1 57 57 GLN CB C 13 31.540 0.50 . 1 . . . . A 590 GLN CB . 30658 1
600 . 1 . 1 57 57 GLN CG C 13 31.260 0.50 . 1 . . . . A 590 GLN CG . 30658 1
601 . 1 . 1 57 57 GLN N N 15 123.762 0.25 . 1 . . . . A 590 GLN N . 30658 1
602 . 1 . 1 57 57 GLN NE2 N 15 109.780 0.25 . 1 . . . . A 590 GLN NE2 . 30658 1
603 . 1 . 1 58 58 ASN H H 1 9.403 0.03 . 1 . . . . A 591 ASN H . 30658 1
604 . 1 . 1 58 58 ASN HA H 1 4.225 0.03 . 1 . . . . A 591 ASN HA . 30658 1
605 . 1 . 1 58 58 ASN HB2 H 1 2.957 0.03 . 2 . . . . A 591 ASN HB2 . 30658 1
606 . 1 . 1 58 58 ASN HB3 H 1 2.743 0.03 . 2 . . . . A 591 ASN HB3 . 30658 1
607 . 1 . 1 58 58 ASN HD21 H 1 7.615 0.03 . 2 . . . . A 591 ASN HD21 . 30658 1
608 . 1 . 1 58 58 ASN HD22 H 1 6.905 0.03 . 2 . . . . A 591 ASN HD22 . 30658 1
609 . 1 . 1 58 58 ASN C C 13 173.791 0.50 . 1 . . . . A 591 ASN C . 30658 1
610 . 1 . 1 58 58 ASN CA C 13 54.385 0.50 . 1 . . . . A 591 ASN CA . 30658 1
611 . 1 . 1 58 58 ASN CB C 13 36.934 0.50 . 1 . . . . A 591 ASN CB . 30658 1
612 . 1 . 1 58 58 ASN N N 15 126.688 0.25 . 1 . . . . A 591 ASN N . 30658 1
613 . 1 . 1 58 58 ASN ND2 N 15 112.730 0.25 . 1 . . . . A 591 ASN ND2 . 30658 1
614 . 1 . 1 59 59 ASP H H 1 9.090 0.03 . 1 . . . . A 592 ASP H . 30658 1
615 . 1 . 1 59 59 ASP HA H 1 4.171 0.03 . 1 . . . . A 592 ASP HA . 30658 1
616 . 1 . 1 59 59 ASP HB2 H 1 2.959 0.03 . 2 . . . . A 592 ASP HB2 . 30658 1
617 . 1 . 1 59 59 ASP HB3 H 1 2.673 0.03 . 2 . . . . A 592 ASP HB3 . 30658 1
618 . 1 . 1 59 59 ASP C C 13 174.434 0.50 . 1 . . . . A 592 ASP C . 30658 1
619 . 1 . 1 59 59 ASP CA C 13 55.791 0.50 . 1 . . . . A 592 ASP CA . 30658 1
620 . 1 . 1 59 59 ASP CB C 13 40.202 0.50 . 1 . . . . A 592 ASP CB . 30658 1
621 . 1 . 1 59 59 ASP N N 15 111.360 0.25 . 1 . . . . A 592 ASP N . 30658 1
622 . 1 . 1 60 60 LYS H H 1 7.810 0.03 . 1 . . . . A 593 LYS H . 30658 1
623 . 1 . 1 60 60 LYS HA H 1 4.782 0.03 . 1 . . . . A 593 LYS HA . 30658 1
624 . 1 . 1 60 60 LYS HB2 H 1 1.868 0.03 . 2 . . . . A 593 LYS HB2 . 30658 1
625 . 1 . 1 60 60 LYS HB3 H 1 1.363 0.03 . 2 . . . . A 593 LYS HB3 . 30658 1
626 . 1 . 1 60 60 LYS HG2 H 1 1.665 0.03 . 2 . . . . A 593 LYS HG2 . 30658 1
627 . 1 . 1 60 60 LYS HG3 H 1 1.514 0.03 . 2 . . . . A 593 LYS HG3 . 30658 1
628 . 1 . 1 60 60 LYS HD2 H 1 1.670 0.03 . 2 . . . . A 593 LYS HD2 . 30658 1
629 . 1 . 1 60 60 LYS HE2 H 1 3.022 0.03 . 2 . . . . A 593 LYS HE2 . 30658 1
630 . 1 . 1 60 60 LYS CA C 13 53.047 0.50 . 1 . . . . A 593 LYS CA . 30658 1
631 . 1 . 1 60 60 LYS CB C 13 34.935 0.50 . 1 . . . . A 593 LYS CB . 30658 1
632 . 1 . 1 60 60 LYS CG C 13 24.980 0.50 . 1 . . . . A 593 LYS CG . 30658 1
633 . 1 . 1 60 60 LYS CD C 13 28.980 0.50 . 1 . . . . A 593 LYS CD . 30658 1
634 . 1 . 1 60 60 LYS CE C 13 42.390 0.50 . 1 . . . . A 593 LYS CE . 30658 1
635 . 1 . 1 60 60 LYS N N 15 118.710 0.25 . 1 . . . . A 593 LYS N . 30658 1
636 . 1 . 1 61 61 PRO HA H 1 5.130 0.03 . 1 . . . . A 594 PRO HA . 30658 1
637 . 1 . 1 61 61 PRO HB2 H 1 1.616 0.03 . 2 . . . . A 594 PRO HB2 . 30658 1
638 . 1 . 1 61 61 PRO HB3 H 1 1.064 0.03 . 2 . . . . A 594 PRO HB3 . 30658 1
639 . 1 . 1 61 61 PRO HG2 H 1 2.131 0.03 . 2 . . . . A 594 PRO HG2 . 30658 1
640 . 1 . 1 61 61 PRO HG3 H 1 1.411 0.03 . 2 . . . . A 594 PRO HG3 . 30658 1
641 . 1 . 1 61 61 PRO HD2 H 1 3.611 0.03 . 2 . . . . A 594 PRO HD2 . 30658 1
642 . 1 . 1 61 61 PRO HD3 H 1 3.526 0.03 . 2 . . . . A 594 PRO HD3 . 30658 1
643 . 1 . 1 61 61 PRO C C 13 174.106 0.50 . 1 . . . . A 594 PRO C . 30658 1
644 . 1 . 1 61 61 PRO CA C 13 60.908 0.50 . 1 . . . . A 594 PRO CA . 30658 1
645 . 1 . 1 61 61 PRO CB C 13 31.927 0.50 . 1 . . . . A 594 PRO CB . 30658 1
646 . 1 . 1 61 61 PRO CG C 13 25.151 0.50 . 1 . . . . A 594 PRO CG . 30658 1
647 . 1 . 1 61 61 PRO CD C 13 49.582 0.50 . 1 . . . . A 594 PRO CD . 30658 1
648 . 1 . 1 62 62 TYR H H 1 8.980 0.03 . 1 . . . . A 595 TYR H . 30658 1
649 . 1 . 1 62 62 TYR HA H 1 5.711 0.03 . 1 . . . . A 595 TYR HA . 30658 1
650 . 1 . 1 62 62 TYR HB2 H 1 3.388 0.03 . 2 . . . . A 595 TYR HB2 . 30658 1
651 . 1 . 1 62 62 TYR HB3 H 1 2.671 0.03 . 2 . . . . A 595 TYR HB3 . 30658 1
652 . 1 . 1 62 62 TYR C C 13 175.951 0.50 . 1 . . . . A 595 TYR C . 30658 1
653 . 1 . 1 62 62 TYR CA C 13 56.805 0.50 . 1 . . . . A 595 TYR CA . 30658 1
654 . 1 . 1 62 62 TYR CB C 13 43.914 0.50 . 1 . . . . A 595 TYR CB . 30658 1
655 . 1 . 1 62 62 TYR N N 15 115.838 0.25 . 1 . . . . A 595 TYR N . 30658 1
656 . 1 . 1 63 63 CYS H H 1 9.713 0.03 . 1 . . . . A 596 CYS H . 30658 1
657 . 1 . 1 63 63 CYS HA H 1 4.828 0.03 . 1 . . . . A 596 CYS HA . 30658 1
658 . 1 . 1 63 63 CYS HB2 H 1 3.397 0.03 . 2 . . . . A 596 CYS HB2 . 30658 1
659 . 1 . 1 63 63 CYS HB3 H 1 2.803 0.03 . 2 . . . . A 596 CYS HB3 . 30658 1
660 . 1 . 1 63 63 CYS C C 13 175.444 0.50 . 1 . . . . A 596 CYS C . 30658 1
661 . 1 . 1 63 63 CYS CA C 13 57.383 0.50 . 1 . . . . A 596 CYS CA . 30658 1
662 . 1 . 1 63 63 CYS CB C 13 30.749 0.50 . 1 . . . . A 596 CYS CB . 30658 1
663 . 1 . 1 63 63 CYS N N 15 120.250 0.25 . 1 . . . . A 596 CYS N . 30658 1
664 . 1 . 1 64 64 GLN H H 1 8.747 0.03 . 1 . . . . A 597 GLN H . 30658 1
665 . 1 . 1 64 64 GLN HA H 1 3.839 0.03 . 1 . . . . A 597 GLN HA . 30658 1
666 . 1 . 1 64 64 GLN HB2 H 1 2.022 0.03 . 2 . . . . A 597 GLN HB2 . 30658 1
667 . 1 . 1 64 64 GLN HG2 H 1 2.317 0.03 . 2 . . . . A 597 GLN HG2 . 30658 1
668 . 1 . 1 64 64 GLN HE21 H 1 7.305 0.03 . 2 . . . . A 597 GLN HE21 . 30658 1
669 . 1 . 1 64 64 GLN HE22 H 1 6.805 0.03 . 2 . . . . A 597 GLN HE22 . 30658 1
670 . 1 . 1 64 64 GLN C C 13 177.637 0.50 . 1 . . . . A 597 GLN C . 30658 1
671 . 1 . 1 64 64 GLN CA C 13 59.544 0.50 . 1 . . . . A 597 GLN CA . 30658 1
672 . 1 . 1 64 64 GLN CB C 13 28.152 0.50 . 1 . . . . A 597 GLN CB . 30658 1
673 . 1 . 1 64 64 GLN CG C 13 33.661 0.50 . 1 . . . . A 597 GLN CG . 30658 1
674 . 1 . 1 64 64 GLN N N 15 119.070 0.25 . 1 . . . . A 597 GLN N . 30658 1
675 . 1 . 1 64 64 GLN NE2 N 15 110.981 0.25 . 1 . . . . A 597 GLN NE2 . 30658 1
676 . 1 . 1 65 65 ASN H H 1 8.159 0.03 . 1 . . . . A 598 ASN H . 30658 1
677 . 1 . 1 65 65 ASN HA H 1 4.398 0.03 . 1 . . . . A 598 ASN HA . 30658 1
678 . 1 . 1 65 65 ASN HB2 H 1 2.920 0.03 . 2 . . . . A 598 ASN HB2 . 30658 1
679 . 1 . 1 65 65 ASN HB3 H 1 2.812 0.03 . 2 . . . . A 598 ASN HB3 . 30658 1
680 . 1 . 1 65 65 ASN HD21 H 1 7.770 0.03 . 2 . . . . A 598 ASN HD21 . 30658 1
681 . 1 . 1 65 65 ASN HD22 H 1 6.940 0.03 . 2 . . . . A 598 ASN HD22 . 30658 1
682 . 1 . 1 65 65 ASN C C 13 178.124 0.50 . 1 . . . . A 598 ASN C . 30658 1
683 . 1 . 1 65 65 ASN CA C 13 56.839 0.50 . 1 . . . . A 598 ASN CA . 30658 1
684 . 1 . 1 65 65 ASN CB C 13 38.591 0.50 . 1 . . . . A 598 ASN CB . 30658 1
685 . 1 . 1 65 65 ASN N N 15 116.981 0.25 . 1 . . . . A 598 ASN N . 30658 1
686 . 1 . 1 65 65 ASN ND2 N 15 113.671 0.25 . 1 . . . . A 598 ASN ND2 . 30658 1
687 . 1 . 1 66 66 CYS H H 1 9.191 0.03 . 1 . . . . A 599 CYS H . 30658 1
688 . 1 . 1 66 66 CYS HA H 1 3.772 0.03 . 1 . . . . A 599 CYS HA . 30658 1
689 . 1 . 1 66 66 CYS HB2 H 1 3.198 0.03 . 2 . . . . A 599 CYS HB2 . 30658 1
690 . 1 . 1 66 66 CYS HB3 H 1 2.885 0.03 . 2 . . . . A 599 CYS HB3 . 30658 1
691 . 1 . 1 66 66 CYS C C 13 176.682 0.50 . 1 . . . . A 599 CYS C . 30658 1
692 . 1 . 1 66 66 CYS CA C 13 65.037 0.50 . 1 . . . . A 599 CYS CA . 30658 1
693 . 1 . 1 66 66 CYS CB C 13 29.266 0.50 . 1 . . . . A 599 CYS CB . 30658 1
694 . 1 . 1 66 66 CYS N N 15 124.831 0.25 . 1 . . . . A 599 CYS N . 30658 1
695 . 1 . 1 67 67 PHE H H 1 8.717 0.03 . 1 . . . . A 600 PHE H . 30658 1
696 . 1 . 1 67 67 PHE HA H 1 3.770 0.03 . 1 . . . . A 600 PHE HA . 30658 1
697 . 1 . 1 67 67 PHE HB2 H 1 3.093 0.03 . 2 . . . . A 600 PHE HB2 . 30658 1
698 . 1 . 1 67 67 PHE HB3 H 1 2.950 0.03 . 2 . . . . A 600 PHE HB3 . 30658 1
699 . 1 . 1 67 67 PHE C C 13 177.020 0.50 . 1 . . . . A 600 PHE C . 30658 1
700 . 1 . 1 67 67 PHE CA C 13 61.524 0.50 . 1 . . . . A 600 PHE CA . 30658 1
701 . 1 . 1 67 67 PHE CB C 13 39.655 0.50 . 1 . . . . A 600 PHE CB . 30658 1
702 . 1 . 1 67 67 PHE N N 15 119.391 0.25 . 1 . . . . A 600 PHE N . 30658 1
703 . 1 . 1 68 68 LEU H H 1 7.758 0.03 . 1 . . . . A 601 LEU H . 30658 1
704 . 1 . 1 68 68 LEU HA H 1 3.893 0.03 . 1 . . . . A 601 LEU HA . 30658 1
705 . 1 . 1 68 68 LEU HB2 H 1 1.791 0.03 . 2 . . . . A 601 LEU HB2 . 30658 1
706 . 1 . 1 68 68 LEU HB3 H 1 1.480 0.03 . 2 . . . . A 601 LEU HB3 . 30658 1
707 . 1 . 1 68 68 LEU HG H 1 1.800 0.03 . 1 . . . . A 601 LEU HG . 30658 1
708 . 1 . 1 68 68 LEU HD11 H 1 0.893 0.03 . 2 . . . . A 601 LEU HD11 . 30658 1
709 . 1 . 1 68 68 LEU HD12 H 1 0.893 0.03 . 2 . . . . A 601 LEU HD12 . 30658 1
710 . 1 . 1 68 68 LEU HD13 H 1 0.893 0.03 . 2 . . . . A 601 LEU HD13 . 30658 1
711 . 1 . 1 68 68 LEU HD21 H 1 0.868 0.03 . 2 . . . . A 601 LEU HD21 . 30658 1
712 . 1 . 1 68 68 LEU HD22 H 1 0.868 0.03 . 2 . . . . A 601 LEU HD22 . 30658 1
713 . 1 . 1 68 68 LEU HD23 H 1 0.868 0.03 . 2 . . . . A 601 LEU HD23 . 30658 1
714 . 1 . 1 68 68 LEU C C 13 178.841 0.50 . 1 . . . . A 601 LEU C . 30658 1
715 . 1 . 1 68 68 LEU CA C 13 57.582 0.50 . 1 . . . . A 601 LEU CA . 30658 1
716 . 1 . 1 68 68 LEU CB C 13 42.135 0.50 . 1 . . . . A 601 LEU CB . 30658 1
717 . 1 . 1 68 68 LEU CG C 13 27.086 0.50 . 1 . . . . A 601 LEU CG . 30658 1
718 . 1 . 1 68 68 LEU CD1 C 13 23.475 0.50 . 2 . . . . A 601 LEU CD1 . 30658 1
719 . 1 . 1 68 68 LEU CD2 C 13 24.867 0.50 . 2 . . . . A 601 LEU CD2 . 30658 1
720 . 1 . 1 68 68 LEU N N 15 117.060 0.25 . 1 . . . . A 601 LEU N . 30658 1
721 . 1 . 1 69 69 LYS H H 1 7.237 0.03 . 1 . . . . A 602 LYS H . 30658 1
722 . 1 . 1 69 69 LYS HA H 1 3.762 0.03 . 1 . . . . A 602 LYS HA . 30658 1
723 . 1 . 1 69 69 LYS HB2 H 1 1.643 0.03 . 2 . . . . A 602 LYS HB2 . 30658 1
724 . 1 . 1 69 69 LYS HB3 H 1 1.522 0.03 . 2 . . . . A 602 LYS HB3 . 30658 1
725 . 1 . 1 69 69 LYS HG2 H 1 1.244 0.03 . 2 . . . . A 602 LYS HG2 . 30658 1
726 . 1 . 1 69 69 LYS HG3 H 1 1.150 0.03 . 2 . . . . A 602 LYS HG3 . 30658 1
727 . 1 . 1 69 69 LYS HD2 H 1 1.426 0.03 . 2 . . . . A 602 LYS HD2 . 30658 1
728 . 1 . 1 69 69 LYS HE2 H 1 2.794 0.03 . 2 . . . . A 602 LYS HE2 . 30658 1
729 . 1 . 1 69 69 LYS HE3 H 1 2.724 0.03 . 2 . . . . A 602 LYS HE3 . 30658 1
730 . 1 . 1 69 69 LYS C C 13 178.212 0.50 . 1 . . . . A 602 LYS C . 30658 1
731 . 1 . 1 69 69 LYS CA C 13 58.141 0.50 . 1 . . . . A 602 LYS CA . 30658 1
732 . 1 . 1 69 69 LYS CB C 13 32.603 0.50 . 1 . . . . A 602 LYS CB . 30658 1
733 . 1 . 1 69 69 LYS CG C 13 24.442 0.50 . 1 . . . . A 602 LYS CG . 30658 1
734 . 1 . 1 69 69 LYS CD C 13 28.937 0.50 . 1 . . . . A 602 LYS CD . 30658 1
735 . 1 . 1 69 69 LYS CE C 13 41.827 0.50 . 1 . . . . A 602 LYS CE . 30658 1
736 . 1 . 1 69 69 LYS N N 15 116.870 0.25 . 1 . . . . A 602 LYS N . 30658 1
737 . 1 . 1 70 70 LEU H H 1 7.809 0.03 . 1 . . . . A 603 LEU H . 30658 1
738 . 1 . 1 70 70 LEU HA H 1 3.536 0.03 . 1 . . . . A 603 LEU HA . 30658 1
739 . 1 . 1 70 70 LEU HB2 H 1 0.255 0.03 . 2 . . . . A 603 LEU HB2 . 30658 1
740 . 1 . 1 70 70 LEU HB3 H 1 -0.485 0.03 . 2 . . . . A 603 LEU HB3 . 30658 1
741 . 1 . 1 70 70 LEU HG H 1 0.888 0.03 . 1 . . . . A 603 LEU HG . 30658 1
742 . 1 . 1 70 70 LEU HD11 H 1 -0.045 0.03 . 2 . . . . A 603 LEU HD11 . 30658 1
743 . 1 . 1 70 70 LEU HD12 H 1 -0.045 0.03 . 2 . . . . A 603 LEU HD12 . 30658 1
744 . 1 . 1 70 70 LEU HD13 H 1 -0.045 0.03 . 2 . . . . A 603 LEU HD13 . 30658 1
745 . 1 . 1 70 70 LEU HD21 H 1 -0.049 0.03 . 2 . . . . A 603 LEU HD21 . 30658 1
746 . 1 . 1 70 70 LEU HD22 H 1 -0.049 0.03 . 2 . . . . A 603 LEU HD22 . 30658 1
747 . 1 . 1 70 70 LEU HD23 H 1 -0.049 0.03 . 2 . . . . A 603 LEU HD23 . 30658 1
748 . 1 . 1 70 70 LEU C C 13 178.999 0.50 . 1 . . . . A 603 LEU C . 30658 1
749 . 1 . 1 70 70 LEU CA C 13 56.201 0.50 . 1 . . . . A 603 LEU CA . 30658 1
750 . 1 . 1 70 70 LEU CB C 13 41.470 0.50 . 1 . . . . A 603 LEU CB . 30658 1
751 . 1 . 1 70 70 LEU CG C 13 26.319 0.50 . 1 . . . . A 603 LEU CG . 30658 1
752 . 1 . 1 70 70 LEU CD1 C 13 21.371 0.50 . 2 . . . . A 603 LEU CD1 . 30658 1
753 . 1 . 1 70 70 LEU CD2 C 13 24.933 0.50 . 2 . . . . A 603 LEU CD2 . 30658 1
754 . 1 . 1 70 70 LEU N N 15 116.610 0.25 . 1 . . . . A 603 LEU N . 30658 1
755 . 1 . 1 71 71 PHE H H 1 7.250 0.03 . 1 . . . . A 604 PHE H . 30658 1
756 . 1 . 1 71 71 PHE HA H 1 4.654 0.03 . 1 . . . . A 604 PHE HA . 30658 1
757 . 1 . 1 71 71 PHE HB2 H 1 2.834 0.03 . 2 . . . . A 604 PHE HB2 . 30658 1
758 . 1 . 1 71 71 PHE HB3 H 1 1.596 0.03 . 2 . . . . A 604 PHE HB3 . 30658 1
759 . 1 . 1 71 71 PHE C C 13 175.155 0.50 . 1 . . . . A 604 PHE C . 30658 1
760 . 1 . 1 71 71 PHE CA C 13 56.691 0.50 . 1 . . . . A 604 PHE CA . 30658 1
761 . 1 . 1 71 71 PHE CB C 13 39.397 0.50 . 1 . . . . A 604 PHE CB . 30658 1
762 . 1 . 1 71 71 PHE N N 15 113.960 0.25 . 1 . . . . A 604 PHE N . 30658 1
763 . 1 . 1 72 72 CYS H H 1 6.854 0.03 . 1 . . . . A 605 CYS H . 30658 1
764 . 1 . 1 72 72 CYS HA H 1 4.350 0.03 . 1 . . . . A 605 CYS HA . 30658 1
765 . 1 . 1 72 72 CYS HB2 H 1 3.000 0.03 . 2 . . . . A 605 CYS HB2 . 30658 1
766 . 1 . 1 72 72 CYS HB3 H 1 2.885 0.03 . 2 . . . . A 605 CYS HB3 . 30658 1
767 . 1 . 1 72 72 CYS CA C 13 59.280 0.50 . 1 . . . . A 605 CYS CA . 30658 1
768 . 1 . 1 72 72 CYS CB C 13 29.449 0.50 . 1 . . . . A 605 CYS CB . 30658 1
769 . 1 . 1 72 72 CYS N N 15 122.218 0.25 . 1 . . . . A 605 CYS N . 30658 1
stop_
save_