###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
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 30623
_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-15N HSQC' . . . 30623 1
2 '2D 1H-13C HSQC' . . . 30623 1
3 '2D 1H-13C HSQC aromatic' . . . 30623 1
4 '3D HNCO' . . . 30623 1
5 '3D HN(CO)CA' . . . 30623 1
6 '3D HNCA' . . . 30623 1
7 '3D CBCA(CO)NH' . . . 30623 1
8 '3D HNCACB' . . . 30623 1
9 '3D 1H-15N NOESY' . . . 30623 1
10 '3D 1H-13C NOESY aromatic' . . . 30623 1
11 '3D 1H-13C NOESY' . . . 30623 1
12 '3D HCCH-TOCSY' . . . 30623 1
13 '3D HCCH-COSY' . . . 30623 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 3 3 LYS H H 1 8.267 0.00 . . . . . . X 314 LYS H . 30623 1
2 . 1 . 1 3 3 LYS HA H 1 4.159 0.00 . . . . . . X 314 LYS HA . 30623 1
3 . 1 . 1 3 3 LYS HB2 H 1 1.622 0.00 . . . . . . X 314 LYS HB2 . 30623 1
4 . 1 . 1 3 3 LYS HB3 H 1 1.622 0.00 . . . . . . X 314 LYS HB3 . 30623 1
5 . 1 . 1 3 3 LYS HG2 H 1 1.209 0.00 . . . . . . X 314 LYS HG2 . 30623 1
6 . 1 . 1 3 3 LYS HG3 H 1 1.177 0.00 . . . . . . X 314 LYS HG3 . 30623 1
7 . 1 . 1 3 3 LYS HD2 H 1 1.567 0.00 . . . . . . X 314 LYS HD2 . 30623 1
8 . 1 . 1 3 3 LYS HD3 H 1 1.567 0.00 . . . . . . X 314 LYS HD3 . 30623 1
9 . 1 . 1 3 3 LYS HE2 H 1 2.915 0.00 . . . . . . X 314 LYS HE2 . 30623 1
10 . 1 . 1 3 3 LYS HE3 H 1 2.915 0.00 . . . . . . X 314 LYS HE3 . 30623 1
11 . 1 . 1 3 3 LYS CA C 13 56.725 0.00 . . . . . . X 314 LYS CA . 30623 1
12 . 1 . 1 3 3 LYS CB C 13 32.706 0.00 . . . . . . X 314 LYS CB . 30623 1
13 . 1 . 1 3 3 LYS CG C 13 24.665 0.01 . . . . . . X 314 LYS CG . 30623 1
14 . 1 . 1 3 3 LYS CD C 13 29.093 0.00 . . . . . . X 314 LYS CD . 30623 1
15 . 1 . 1 3 3 LYS CE C 13 42.152 0.00 . . . . . . X 314 LYS CE . 30623 1
16 . 1 . 1 3 3 LYS N N 15 121.471 0.00 . . . . . . X 314 LYS N . 30623 1
17 . 1 . 1 4 4 TYR H H 1 8.082 0.00 . . . . . . X 315 TYR H . 30623 1
18 . 1 . 1 4 4 TYR HA H 1 4.514 0.00 . . . . . . X 315 TYR HA . 30623 1
19 . 1 . 1 4 4 TYR HB2 H 1 3.025 0.00 . . . . . . X 315 TYR HB2 . 30623 1
20 . 1 . 1 4 4 TYR HB3 H 1 2.880 0.00 . . . . . . X 315 TYR HB3 . 30623 1
21 . 1 . 1 4 4 TYR HD1 H 1 7.063 0.00 . . . . . . X 315 TYR HD1 . 30623 1
22 . 1 . 1 4 4 TYR HD2 H 1 7.063 0.00 . . . . . . X 315 TYR HD2 . 30623 1
23 . 1 . 1 4 4 TYR HE1 H 1 6.783 0.01 . . . . . . X 315 TYR HE1 . 30623 1
24 . 1 . 1 4 4 TYR HE2 H 1 6.783 0.01 . . . . . . X 315 TYR HE2 . 30623 1
25 . 1 . 1 4 4 TYR CA C 13 57.699 0.00 . . . . . . X 315 TYR CA . 30623 1
26 . 1 . 1 4 4 TYR CB C 13 38.617 0.02 . . . . . . X 315 TYR CB . 30623 1
27 . 1 . 1 4 4 TYR CD1 C 13 133.171 0.00 . . . . . . X 315 TYR CD1 . 30623 1
28 . 1 . 1 4 4 TYR CD2 C 13 133.171 0.00 . . . . . . X 315 TYR CD2 . 30623 1
29 . 1 . 1 4 4 TYR CE1 C 13 118.253 0.00 . . . . . . X 315 TYR CE1 . 30623 1
30 . 1 . 1 4 4 TYR CE2 C 13 118.253 0.00 . . . . . . X 315 TYR CE2 . 30623 1
31 . 1 . 1 4 4 TYR N N 15 120.875 0.00 . . . . . . X 315 TYR N . 30623 1
32 . 1 . 1 5 5 LYS H H 1 8.160 0.00 . . . . . . X 316 LYS H . 30623 1
33 . 1 . 1 5 5 LYS HA H 1 4.102 0.00 . . . . . . X 316 LYS HA . 30623 1
34 . 1 . 1 5 5 LYS HB2 H 1 1.665 0.00 . . . . . . X 316 LYS HB2 . 30623 1
35 . 1 . 1 5 5 LYS HB3 H 1 1.663 0.00 . . . . . . X 316 LYS HB3 . 30623 1
36 . 1 . 1 5 5 LYS HG2 H 1 1.137 0.00 . . . . . . X 316 LYS HG2 . 30623 1
37 . 1 . 1 5 5 LYS HG3 H 1 1.136 0.00 . . . . . . X 316 LYS HG3 . 30623 1
38 . 1 . 1 5 5 LYS HD2 H 1 1.415 0.00 . . . . . . X 316 LYS HD2 . 30623 1
39 . 1 . 1 5 5 LYS HD3 H 1 1.415 0.00 . . . . . . X 316 LYS HD3 . 30623 1
40 . 1 . 1 5 5 LYS HE2 H 1 2.860 0.00 . . . . . . X 316 LYS HE2 . 30623 1
41 . 1 . 1 5 5 LYS HE3 H 1 2.860 0.00 . . . . . . X 316 LYS HE3 . 30623 1
42 . 1 . 1 5 5 LYS CA C 13 56.674 0.00 . . . . . . X 316 LYS CA . 30623 1
43 . 1 . 1 5 5 LYS CB C 13 32.507 0.00 . . . . . . X 316 LYS CB . 30623 1
44 . 1 . 1 5 5 LYS CG C 13 24.746 0.01 . . . . . . X 316 LYS CG . 30623 1
45 . 1 . 1 5 5 LYS CD C 13 29.232 0.00 . . . . . . X 316 LYS CD . 30623 1
46 . 1 . 1 5 5 LYS CE C 13 42.276 0.00 . . . . . . X 316 LYS CE . 30623 1
47 . 1 . 1 5 5 LYS N N 15 122.176 0.00 . . . . . . X 316 LYS N . 30623 1
48 . 1 . 1 6 6 THR H H 1 8.313 0.00 . . . . . . X 317 THR H . 30623 1
49 . 1 . 1 6 6 THR HA H 1 4.386 0.00 . . . . . . X 317 THR HA . 30623 1
50 . 1 . 1 6 6 THR HB H 1 4.231 0.00 . . . . . . X 317 THR HB . 30623 1
51 . 1 . 1 6 6 THR HG21 H 1 1.160 0.00 . . . . . . X 317 THR HG21 . 30623 1
52 . 1 . 1 6 6 THR HG22 H 1 1.160 0.00 . . . . . . X 317 THR HG22 . 30623 1
53 . 1 . 1 6 6 THR HG23 H 1 1.160 0.00 . . . . . . X 317 THR HG23 . 30623 1
54 . 1 . 1 6 6 THR CA C 13 61.888 0.00 . . . . . . X 317 THR CA . 30623 1
55 . 1 . 1 6 6 THR CB C 13 70.397 0.00 . . . . . . X 317 THR CB . 30623 1
56 . 1 . 1 6 6 THR CG2 C 13 21.852 0.00 . . . . . . X 317 THR CG2 . 30623 1
57 . 1 . 1 6 6 THR N N 15 111.565 0.00 . . . . . . X 317 THR N . 30623 1
58 . 1 . 1 7 7 LYS H H 1 8.177 0.00 . . . . . . X 318 LYS H . 30623 1
59 . 1 . 1 7 7 LYS HA H 1 4.543 0.00 . . . . . . X 318 LYS HA . 30623 1
60 . 1 . 1 7 7 LYS HB2 H 1 1.955 0.00 . . . . . . X 318 LYS HB2 . 30623 1
61 . 1 . 1 7 7 LYS HB3 H 1 1.880 0.00 . . . . . . X 318 LYS HB3 . 30623 1
62 . 1 . 1 7 7 LYS HG2 H 1 1.516 0.00 . . . . . . X 318 LYS HG2 . 30623 1
63 . 1 . 1 7 7 LYS HG3 H 1 1.472 0.00 . . . . . . X 318 LYS HG3 . 30623 1
64 . 1 . 1 7 7 LYS HD2 H 1 1.689 0.00 . . . . . . X 318 LYS HD2 . 30623 1
65 . 1 . 1 7 7 LYS HD3 H 1 1.686 0.00 . . . . . . X 318 LYS HD3 . 30623 1
66 . 1 . 1 7 7 LYS HE2 H 1 2.955 0.00 . . . . . . X 318 LYS HE2 . 30623 1
67 . 1 . 1 7 7 LYS HE3 H 1 2.955 0.00 . . . . . . X 318 LYS HE3 . 30623 1
68 . 1 . 1 7 7 LYS CA C 13 55.512 0.00 . . . . . . X 318 LYS CA . 30623 1
69 . 1 . 1 7 7 LYS CB C 13 34.508 0.00 . . . . . . X 318 LYS CB . 30623 1
70 . 1 . 1 7 7 LYS CG C 13 24.869 0.01 . . . . . . X 318 LYS CG . 30623 1
71 . 1 . 1 7 7 LYS CD C 13 29.312 0.01 . . . . . . X 318 LYS CD . 30623 1
72 . 1 . 1 7 7 LYS CE C 13 42.236 0.01 . . . . . . X 318 LYS CE . 30623 1
73 . 1 . 1 7 7 LYS N N 15 123.524 0.00 . . . . . . X 318 LYS N . 30623 1
74 . 1 . 1 8 8 LEU H H 1 8.373 0.00 . . . . . . X 319 LEU H . 30623 1
75 . 1 . 1 8 8 LEU HA H 1 4.204 0.00 . . . . . . X 319 LEU HA . 30623 1
76 . 1 . 1 8 8 LEU HB2 H 1 1.600 0.00 . . . . . . X 319 LEU HB2 . 30623 1
77 . 1 . 1 8 8 LEU HB3 H 1 1.505 0.00 . . . . . . X 319 LEU HB3 . 30623 1
78 . 1 . 1 8 8 LEU HG H 1 1.754 0.00 . . . . . . X 319 LEU HG . 30623 1
79 . 1 . 1 8 8 LEU HD11 H 1 0.806 0.00 . . . . . . X 319 LEU HD11 . 30623 1
80 . 1 . 1 8 8 LEU HD12 H 1 0.806 0.00 . . . . . . X 319 LEU HD12 . 30623 1
81 . 1 . 1 8 8 LEU HD13 H 1 0.806 0.00 . . . . . . X 319 LEU HD13 . 30623 1
82 . 1 . 1 8 8 LEU HD21 H 1 0.867 0.00 . . . . . . X 319 LEU HD21 . 30623 1
83 . 1 . 1 8 8 LEU HD22 H 1 0.867 0.00 . . . . . . X 319 LEU HD22 . 30623 1
84 . 1 . 1 8 8 LEU HD23 H 1 0.867 0.00 . . . . . . X 319 LEU HD23 . 30623 1
85 . 1 . 1 8 8 LEU CA C 13 55.603 0.00 . . . . . . X 319 LEU CA . 30623 1
86 . 1 . 1 8 8 LEU CB C 13 42.790 0.01 . . . . . . X 319 LEU CB . 30623 1
87 . 1 . 1 8 8 LEU CG C 13 26.316 0.00 . . . . . . X 319 LEU CG . 30623 1
88 . 1 . 1 8 8 LEU CD1 C 13 25.115 0.00 . . . . . . X 319 LEU CD1 . 30623 1
89 . 1 . 1 8 8 LEU CD2 C 13 23.517 0.00 . . . . . . X 319 LEU CD2 . 30623 1
90 . 1 . 1 8 8 LEU N N 15 124.784 0.00 . . . . . . X 319 LEU N . 30623 1
91 . 1 . 1 9 9 CYS H H 1 9.014 0.00 . . . . . . X 320 CYS H . 30623 1
92 . 1 . 1 9 9 CYS HA H 1 3.726 0.00 . . . . . . X 320 CYS HA . 30623 1
93 . 1 . 1 9 9 CYS HB2 H 1 3.315 0.00 . . . . . . X 320 CYS HB2 . 30623 1
94 . 1 . 1 9 9 CYS HB3 H 1 3.176 0.00 . . . . . . X 320 CYS HB3 . 30623 1
95 . 1 . 1 9 9 CYS CA C 13 61.427 0.00 . . . . . . X 320 CYS CA . 30623 1
96 . 1 . 1 9 9 CYS CB C 13 31.827 0.00 . . . . . . X 320 CYS CB . 30623 1
97 . 1 . 1 9 9 CYS N N 15 128.412 0.00 . . . . . . X 320 CYS N . 30623 1
98 . 1 . 1 10 10 LYS H H 1 8.560 0.00 . . . . . . X 321 LYS H . 30623 1
99 . 1 . 1 10 10 LYS HA H 1 4.046 0.00 . . . . . . X 321 LYS HA . 30623 1
100 . 1 . 1 10 10 LYS HB2 H 1 1.828 0.00 . . . . . . X 321 LYS HB2 . 30623 1
101 . 1 . 1 10 10 LYS HB3 H 1 1.777 0.00 . . . . . . X 321 LYS HB3 . 30623 1
102 . 1 . 1 10 10 LYS HG2 H 1 1.449 0.00 . . . . . . X 321 LYS HG2 . 30623 1
103 . 1 . 1 10 10 LYS HG3 H 1 1.302 0.00 . . . . . . X 321 LYS HG3 . 30623 1
104 . 1 . 1 10 10 LYS HD2 H 1 1.612 0.00 . . . . . . X 321 LYS HD2 . 30623 1
105 . 1 . 1 10 10 LYS HD3 H 1 1.614 0.00 . . . . . . X 321 LYS HD3 . 30623 1
106 . 1 . 1 10 10 LYS HE2 H 1 2.985 0.00 . . . . . . X 321 LYS HE2 . 30623 1
107 . 1 . 1 10 10 LYS HE3 H 1 2.986 0.00 . . . . . . X 321 LYS HE3 . 30623 1
108 . 1 . 1 10 10 LYS CA C 13 58.960 0.00 . . . . . . X 321 LYS CA . 30623 1
109 . 1 . 1 10 10 LYS CB C 13 31.815 0.00 . . . . . . X 321 LYS CB . 30623 1
110 . 1 . 1 10 10 LYS CG C 13 24.100 0.02 . . . . . . X 321 LYS CG . 30623 1
111 . 1 . 1 10 10 LYS CD C 13 29.200 0.01 . . . . . . X 321 LYS CD . 30623 1
112 . 1 . 1 10 10 LYS CE C 13 42.065 0.00 . . . . . . X 321 LYS CE . 30623 1
113 . 1 . 1 10 10 LYS N N 15 130.418 0.00 . . . . . . X 321 LYS N . 30623 1
114 . 1 . 1 11 11 ASN H H 1 8.361 0.00 . . . . . . X 322 ASN H . 30623 1
115 . 1 . 1 11 11 ASN HA H 1 4.634 0.00 . . . . . . X 322 ASN HA . 30623 1
116 . 1 . 1 11 11 ASN HB2 H 1 2.651 0.00 . . . . . . X 322 ASN HB2 . 30623 1
117 . 1 . 1 11 11 ASN HB3 H 1 2.539 0.00 . . . . . . X 322 ASN HB3 . 30623 1
118 . 1 . 1 11 11 ASN HD21 H 1 7.650 0.00 . . . . . . X 322 ASN HD21 . 30623 1
119 . 1 . 1 11 11 ASN HD22 H 1 7.450 0.00 . . . . . . X 322 ASN HD22 . 30623 1
120 . 1 . 1 11 11 ASN CA C 13 56.076 0.00 . . . . . . X 322 ASN CA . 30623 1
121 . 1 . 1 11 11 ASN CB C 13 38.320 0.02 . . . . . . X 322 ASN CB . 30623 1
122 . 1 . 1 11 11 ASN N N 15 118.326 0.00 . . . . . . X 322 ASN N . 30623 1
123 . 1 . 1 11 11 ASN ND2 N 15 118.656 0.00 . . . . . . X 322 ASN ND2 . 30623 1
124 . 1 . 1 12 12 PHE H H 1 8.073 0.00 . . . . . . X 323 PHE H . 30623 1
125 . 1 . 1 12 12 PHE HA H 1 4.506 0.00 . . . . . . X 323 PHE HA . 30623 1
126 . 1 . 1 12 12 PHE HB2 H 1 3.375 0.00 . . . . . . X 323 PHE HB2 . 30623 1
127 . 1 . 1 12 12 PHE HB3 H 1 2.637 0.00 . . . . . . X 323 PHE HB3 . 30623 1
128 . 1 . 1 12 12 PHE HD1 H 1 7.080 0.01 . . . . . . X 323 PHE HD1 . 30623 1
129 . 1 . 1 12 12 PHE HD2 H 1 7.080 0.01 . . . . . . X 323 PHE HD2 . 30623 1
130 . 1 . 1 12 12 PHE HE1 H 1 6.712 0.01 . . . . . . X 323 PHE HE1 . 30623 1
131 . 1 . 1 12 12 PHE HE2 H 1 6.712 0.01 . . . . . . X 323 PHE HE2 . 30623 1
132 . 1 . 1 12 12 PHE HZ H 1 6.987 0.00 . . . . . . X 323 PHE HZ . 30623 1
133 . 1 . 1 12 12 PHE CA C 13 58.091 0.00 . . . . . . X 323 PHE CA . 30623 1
134 . 1 . 1 12 12 PHE CB C 13 40.141 0.02 . . . . . . X 323 PHE CB . 30623 1
135 . 1 . 1 12 12 PHE CD1 C 13 131.368 0.00 . . . . . . X 323 PHE CD1 . 30623 1
136 . 1 . 1 12 12 PHE CD2 C 13 131.368 0.00 . . . . . . X 323 PHE CD2 . 30623 1
137 . 1 . 1 12 12 PHE CE1 C 13 131.358 0.00 . . . . . . X 323 PHE CE1 . 30623 1
138 . 1 . 1 12 12 PHE CE2 C 13 131.358 0.00 . . . . . . X 323 PHE CE2 . 30623 1
139 . 1 . 1 12 12 PHE CZ C 13 129.457 0.00 . . . . . . X 323 PHE CZ . 30623 1
140 . 1 . 1 12 12 PHE N N 15 117.166 0.00 . . . . . . X 323 PHE N . 30623 1
141 . 1 . 1 13 13 ALA H H 1 7.237 0.00 . . . . . . X 324 ALA H . 30623 1
142 . 1 . 1 13 13 ALA HA H 1 4.377 0.00 . . . . . . X 324 ALA HA . 30623 1
143 . 1 . 1 13 13 ALA HB1 H 1 1.452 0.00 . . . . . . X 324 ALA HB1 . 30623 1
144 . 1 . 1 13 13 ALA HB2 H 1 1.452 0.00 . . . . . . X 324 ALA HB2 . 30623 1
145 . 1 . 1 13 13 ALA HB3 H 1 1.452 0.00 . . . . . . X 324 ALA HB3 . 30623 1
146 . 1 . 1 13 13 ALA CA C 13 51.606 0.00 . . . . . . X 324 ALA CA . 30623 1
147 . 1 . 1 13 13 ALA CB C 13 19.913 0.00 . . . . . . X 324 ALA CB . 30623 1
148 . 1 . 1 13 13 ALA N N 15 123.142 0.00 . . . . . . X 324 ALA N . 30623 1
149 . 1 . 1 14 14 ARG H H 1 8.419 0.00 . . . . . . X 325 ARG H . 30623 1
150 . 1 . 1 14 14 ARG HA H 1 4.102 0.00 . . . . . . X 325 ARG HA . 30623 1
151 . 1 . 1 14 14 ARG HB2 H 1 1.825 0.00 . . . . . . X 325 ARG HB2 . 30623 1
152 . 1 . 1 14 14 ARG HB3 H 1 1.781 0.00 . . . . . . X 325 ARG HB3 . 30623 1
153 . 1 . 1 14 14 ARG HG2 H 1 1.706 0.00 . . . . . . X 325 ARG HG2 . 30623 1
154 . 1 . 1 14 14 ARG HG3 H 1 1.599 0.00 . . . . . . X 325 ARG HG3 . 30623 1
155 . 1 . 1 14 14 ARG HD2 H 1 3.224 0.00 . . . . . . X 325 ARG HD2 . 30623 1
156 . 1 . 1 14 14 ARG HD3 H 1 3.224 0.00 . . . . . . X 325 ARG HD3 . 30623 1
157 . 1 . 1 14 14 ARG CA C 13 58.442 0.00 . . . . . . X 325 ARG CA . 30623 1
158 . 1 . 1 14 14 ARG CB C 13 29.587 0.01 . . . . . . X 325 ARG CB . 30623 1
159 . 1 . 1 14 14 ARG CG C 13 27.085 0.00 . . . . . . X 325 ARG CG . 30623 1
160 . 1 . 1 14 14 ARG CD C 13 43.324 0.00 . . . . . . X 325 ARG CD . 30623 1
161 . 1 . 1 14 14 ARG N N 15 121.289 0.00 . . . . . . X 325 ARG N . 30623 1
162 . 1 . 1 15 15 GLY H H 1 8.850 0.00 . . . . . . X 326 GLY H . 30623 1
163 . 1 . 1 15 15 GLY HA2 H 1 4.091 0.00 . . . . . . X 326 GLY HA2 . 30623 1
164 . 1 . 1 15 15 GLY HA3 H 1 3.775 0.00 . . . . . . X 326 GLY HA3 . 30623 1
165 . 1 . 1 15 15 GLY CA C 13 45.258 0.00 . . . . . . X 326 GLY CA . 30623 1
166 . 1 . 1 15 15 GLY N N 15 113.968 0.00 . . . . . . X 326 GLY N . 30623 1
167 . 1 . 1 16 16 GLY H H 1 8.380 0.00 . . . . . . X 327 GLY H . 30623 1
168 . 1 . 1 16 16 GLY HA2 H 1 4.157 0.00 . . . . . . X 327 GLY HA2 . 30623 1
169 . 1 . 1 16 16 GLY HA3 H 1 3.735 0.00 . . . . . . X 327 GLY HA3 . 30623 1
170 . 1 . 1 16 16 GLY CA C 13 44.504 0.01 . . . . . . X 327 GLY CA . 30623 1
171 . 1 . 1 16 16 GLY N N 15 108.717 0.00 . . . . . . X 327 GLY N . 30623 1
172 . 1 . 1 17 17 THR H H 1 8.462 0.00 . . . . . . X 328 THR H . 30623 1
173 . 1 . 1 17 17 THR HA H 1 4.179 0.00 . . . . . . X 328 THR HA . 30623 1
174 . 1 . 1 17 17 THR HB H 1 4.294 0.00 . . . . . . X 328 THR HB . 30623 1
175 . 1 . 1 17 17 THR HG21 H 1 1.307 0.00 . . . . . . X 328 THR HG21 . 30623 1
176 . 1 . 1 17 17 THR HG22 H 1 1.307 0.00 . . . . . . X 328 THR HG22 . 30623 1
177 . 1 . 1 17 17 THR HG23 H 1 1.307 0.00 . . . . . . X 328 THR HG23 . 30623 1
178 . 1 . 1 17 17 THR CA C 13 62.854 0.00 . . . . . . X 328 THR CA . 30623 1
179 . 1 . 1 17 17 THR CB C 13 70.135 0.00 . . . . . . X 328 THR CB . 30623 1
180 . 1 . 1 17 17 THR CG2 C 13 21.879 0.00 . . . . . . X 328 THR CG2 . 30623 1
181 . 1 . 1 17 17 THR N N 15 110.901 0.00 . . . . . . X 328 THR N . 30623 1
182 . 1 . 1 18 18 GLY H H 1 8.514 0.00 . . . . . . X 329 GLY H . 30623 1
183 . 1 . 1 18 18 GLY HA2 H 1 3.885 0.00 . . . . . . X 329 GLY HA2 . 30623 1
184 . 1 . 1 18 18 GLY HA3 H 1 3.103 0.00 . . . . . . X 329 GLY HA3 . 30623 1
185 . 1 . 1 18 18 GLY CA C 13 45.471 0.01 . . . . . . X 329 GLY CA . 30623 1
186 . 1 . 1 18 18 GLY N N 15 109.549 0.00 . . . . . . X 329 GLY N . 30623 1
187 . 1 . 1 19 19 PHE H H 1 7.326 0.00 . . . . . . X 330 PHE H . 30623 1
188 . 1 . 1 19 19 PHE HA H 1 4.388 0.00 . . . . . . X 330 PHE HA . 30623 1
189 . 1 . 1 19 19 PHE HB2 H 1 2.878 0.00 . . . . . . X 330 PHE HB2 . 30623 1
190 . 1 . 1 19 19 PHE HB3 H 1 2.641 0.00 . . . . . . X 330 PHE HB3 . 30623 1
191 . 1 . 1 19 19 PHE HD1 H 1 7.264 0.00 . . . . . . X 330 PHE HD1 . 30623 1
192 . 1 . 1 19 19 PHE HD2 H 1 7.264 0.00 . . . . . . X 330 PHE HD2 . 30623 1
193 . 1 . 1 19 19 PHE CA C 13 56.788 0.00 . . . . . . X 330 PHE CA . 30623 1
194 . 1 . 1 19 19 PHE CB C 13 41.149 0.01 . . . . . . X 330 PHE CB . 30623 1
195 . 1 . 1 19 19 PHE N N 15 117.872 0.00 . . . . . . X 330 PHE N . 30623 1
196 . 1 . 1 20 20 CYS H H 1 8.226 0.00 . . . . . . X 331 CYS H . 30623 1
197 . 1 . 1 20 20 CYS HB2 H 1 2.860 0.00 . . . . . . X 331 CYS HB2 . 30623 1
198 . 1 . 1 20 20 CYS HB3 H 1 2.459 0.00 . . . . . . X 331 CYS HB3 . 30623 1
199 . 1 . 1 20 20 CYS CB C 13 32.532 0.00 . . . . . . X 331 CYS CB . 30623 1
200 . 1 . 1 20 20 CYS N N 15 127.911 0.00 . . . . . . X 331 CYS N . 30623 1
201 . 1 . 1 21 21 PRO HA H 1 4.201 0.00 . . . . . . X 332 PRO HA . 30623 1
202 . 1 . 1 21 21 PRO HB2 H 1 2.251 0.00 . . . . . . X 332 PRO HB2 . 30623 1
203 . 1 . 1 21 21 PRO HB3 H 1 1.606 0.00 . . . . . . X 332 PRO HB3 . 30623 1
204 . 1 . 1 21 21 PRO HG2 H 1 1.867 0.00 . . . . . . X 332 PRO HG2 . 30623 1
205 . 1 . 1 21 21 PRO HG3 H 1 1.323 0.00 . . . . . . X 332 PRO HG3 . 30623 1
206 . 1 . 1 21 21 PRO HD2 H 1 3.923 0.00 . . . . . . X 332 PRO HD2 . 30623 1
207 . 1 . 1 21 21 PRO HD3 H 1 3.531 0.00 . . . . . . X 332 PRO HD3 . 30623 1
208 . 1 . 1 21 21 PRO CA C 13 63.771 0.00 . . . . . . X 332 PRO CA . 30623 1
209 . 1 . 1 21 21 PRO CB C 13 32.162 0.07 . . . . . . X 332 PRO CB . 30623 1
210 . 1 . 1 21 21 PRO CG C 13 26.287 0.00 . . . . . . X 332 PRO CG . 30623 1
211 . 1 . 1 21 21 PRO CD C 13 51.663 0.00 . . . . . . X 332 PRO CD . 30623 1
212 . 1 . 1 22 22 TYR H H 1 8.161 0.00 . . . . . . X 333 TYR H . 30623 1
213 . 1 . 1 22 22 TYR HA H 1 4.477 0.00 . . . . . . X 333 TYR HA . 30623 1
214 . 1 . 1 22 22 TYR HB2 H 1 2.943 0.00 . . . . . . X 333 TYR HB2 . 30623 1
215 . 1 . 1 22 22 TYR HB3 H 1 2.943 0.00 . . . . . . X 333 TYR HB3 . 30623 1
216 . 1 . 1 22 22 TYR HD1 H 1 7.288 0.00 . . . . . . X 333 TYR HD1 . 30623 1
217 . 1 . 1 22 22 TYR HD2 H 1 7.288 0.00 . . . . . . X 333 TYR HD2 . 30623 1
218 . 1 . 1 22 22 TYR HE1 H 1 6.923 0.00 . . . . . . X 333 TYR HE1 . 30623 1
219 . 1 . 1 22 22 TYR HE2 H 1 6.923 0.00 . . . . . . X 333 TYR HE2 . 30623 1
220 . 1 . 1 22 22 TYR CA C 13 59.010 0.00 . . . . . . X 333 TYR CA . 30623 1
221 . 1 . 1 22 22 TYR CB C 13 38.041 0.01 . . . . . . X 333 TYR CB . 30623 1
222 . 1 . 1 22 22 TYR CD1 C 13 133.216 0.00 . . . . . . X 333 TYR CD1 . 30623 1
223 . 1 . 1 22 22 TYR CD2 C 13 133.216 0.00 . . . . . . X 333 TYR CD2 . 30623 1
224 . 1 . 1 22 22 TYR CE1 C 13 118.480 0.00 . . . . . . X 333 TYR CE1 . 30623 1
225 . 1 . 1 22 22 TYR CE2 C 13 118.480 0.00 . . . . . . X 333 TYR CE2 . 30623 1
226 . 1 . 1 22 22 TYR N N 15 118.671 0.00 . . . . . . X 333 TYR N . 30623 1
227 . 1 . 1 23 23 GLY H H 1 7.652 0.00 . . . . . . X 334 GLY H . 30623 1
228 . 1 . 1 23 23 GLY HA2 H 1 4.017 0.00 . . . . . . X 334 GLY HA2 . 30623 1
229 . 1 . 1 23 23 GLY HA3 H 1 4.019 0.00 . . . . . . X 334 GLY HA3 . 30623 1
230 . 1 . 1 23 23 GLY CA C 13 47.385 0.00 . . . . . . X 334 GLY CA . 30623 1
231 . 1 . 1 23 23 GLY N N 15 108.206 0.00 . . . . . . X 334 GLY N . 30623 1
232 . 1 . 1 24 24 LEU H H 1 8.875 0.00 . . . . . . X 335 LEU H . 30623 1
233 . 1 . 1 24 24 LEU HA H 1 4.230 0.00 . . . . . . X 335 LEU HA . 30623 1
234 . 1 . 1 24 24 LEU HB2 H 1 1.736 0.00 . . . . . . X 335 LEU HB2 . 30623 1
235 . 1 . 1 24 24 LEU HB3 H 1 1.672 0.00 . . . . . . X 335 LEU HB3 . 30623 1
236 . 1 . 1 24 24 LEU HG H 1 1.796 0.00 . . . . . . X 335 LEU HG . 30623 1
237 . 1 . 1 24 24 LEU HD11 H 1 0.964 0.00 . . . . . . X 335 LEU HD11 . 30623 1
238 . 1 . 1 24 24 LEU HD12 H 1 0.964 0.00 . . . . . . X 335 LEU HD12 . 30623 1
239 . 1 . 1 24 24 LEU HD13 H 1 0.964 0.00 . . . . . . X 335 LEU HD13 . 30623 1
240 . 1 . 1 24 24 LEU HD21 H 1 0.931 0.00 . . . . . . X 335 LEU HD21 . 30623 1
241 . 1 . 1 24 24 LEU HD22 H 1 0.931 0.00 . . . . . . X 335 LEU HD22 . 30623 1
242 . 1 . 1 24 24 LEU HD23 H 1 0.931 0.00 . . . . . . X 335 LEU HD23 . 30623 1
243 . 1 . 1 24 24 LEU CA C 13 56.546 0.00 . . . . . . X 335 LEU CA . 30623 1
244 . 1 . 1 24 24 LEU CB C 13 41.912 0.01 . . . . . . X 335 LEU CB . 30623 1
245 . 1 . 1 24 24 LEU CG C 13 27.212 0.00 . . . . . . X 335 LEU CG . 30623 1
246 . 1 . 1 24 24 LEU CD1 C 13 25.221 0.00 . . . . . . X 335 LEU CD1 . 30623 1
247 . 1 . 1 24 24 LEU CD2 C 13 23.091 0.00 . . . . . . X 335 LEU CD2 . 30623 1
248 . 1 . 1 24 24 LEU N N 15 125.522 0.00 . . . . . . X 335 LEU N . 30623 1
249 . 1 . 1 25 25 ARG H H 1 8.041 0.00 . . . . . . X 336 ARG H . 30623 1
250 . 1 . 1 25 25 ARG HA H 1 4.343 0.00 . . . . . . X 336 ARG HA . 30623 1
251 . 1 . 1 25 25 ARG HB2 H 1 2.073 0.00 . . . . . . X 336 ARG HB2 . 30623 1
252 . 1 . 1 25 25 ARG HB3 H 1 1.934 0.00 . . . . . . X 336 ARG HB3 . 30623 1
253 . 1 . 1 25 25 ARG HG2 H 1 1.723 0.00 . . . . . . X 336 ARG HG2 . 30623 1
254 . 1 . 1 25 25 ARG HG3 H 1 1.671 0.00 . . . . . . X 336 ARG HG3 . 30623 1
255 . 1 . 1 25 25 ARG HD2 H 1 3.257 0.00 . . . . . . X 336 ARG HD2 . 30623 1
256 . 1 . 1 25 25 ARG HD3 H 1 3.257 0.00 . . . . . . X 336 ARG HD3 . 30623 1
257 . 1 . 1 25 25 ARG CA C 13 55.389 0.00 . . . . . . X 336 ARG CA . 30623 1
258 . 1 . 1 25 25 ARG CB C 13 29.904 0.00 . . . . . . X 336 ARG CB . 30623 1
259 . 1 . 1 25 25 ARG CG C 13 27.539 0.01 . . . . . . X 336 ARG CG . 30623 1
260 . 1 . 1 25 25 ARG CD C 13 43.225 0.00 . . . . . . X 336 ARG CD . 30623 1
261 . 1 . 1 25 25 ARG N N 15 116.000 0.00 . . . . . . X 336 ARG N . 30623 1
262 . 1 . 1 26 26 CYS H H 1 7.403 0.00 . . . . . . X 337 CYS H . 30623 1
263 . 1 . 1 26 26 CYS HA H 1 3.745 0.00 . . . . . . X 337 CYS HA . 30623 1
264 . 1 . 1 26 26 CYS HB2 H 1 2.980 0.00 . . . . . . X 337 CYS HB2 . 30623 1
265 . 1 . 1 26 26 CYS HB3 H 1 2.572 0.00 . . . . . . X 337 CYS HB3 . 30623 1
266 . 1 . 1 26 26 CYS CA C 13 61.627 0.00 . . . . . . X 337 CYS CA . 30623 1
267 . 1 . 1 26 26 CYS CB C 13 30.786 0.00 . . . . . . X 337 CYS CB . 30623 1
268 . 1 . 1 26 26 CYS N N 15 124.056 0.00 . . . . . . X 337 CYS N . 30623 1
269 . 1 . 1 27 27 GLU H H 1 8.552 0.00 . . . . . . X 338 GLU H . 30623 1
270 . 1 . 1 27 27 GLU HA H 1 4.045 0.00 . . . . . . X 338 GLU HA . 30623 1
271 . 1 . 1 27 27 GLU HB2 H 1 1.623 0.00 . . . . . . X 338 GLU HB2 . 30623 1
272 . 1 . 1 27 27 GLU HB3 H 1 1.566 0.00 . . . . . . X 338 GLU HB3 . 30623 1
273 . 1 . 1 27 27 GLU HG2 H 1 1.740 0.00 . . . . . . X 338 GLU HG2 . 30623 1
274 . 1 . 1 27 27 GLU HG3 H 1 1.705 0.00 . . . . . . X 338 GLU HG3 . 30623 1
275 . 1 . 1 27 27 GLU CA C 13 57.384 0.00 . . . . . . X 338 GLU CA . 30623 1
276 . 1 . 1 27 27 GLU CB C 13 29.721 0.01 . . . . . . X 338 GLU CB . 30623 1
277 . 1 . 1 27 27 GLU CG C 13 35.990 0.00 . . . . . . X 338 GLU CG . 30623 1
278 . 1 . 1 27 27 GLU N N 15 126.340 0.00 . . . . . . X 338 GLU N . 30623 1
279 . 1 . 1 28 28 PHE H H 1 8.975 0.00 . . . . . . X 339 PHE H . 30623 1
280 . 1 . 1 28 28 PHE HB2 H 1 3.387 0.00 . . . . . . X 339 PHE HB2 . 30623 1
281 . 1 . 1 28 28 PHE HB3 H 1 3.140 0.00 . . . . . . X 339 PHE HB3 . 30623 1
282 . 1 . 1 28 28 PHE HD1 H 1 7.450 0.00 . . . . . . X 339 PHE HD1 . 30623 1
283 . 1 . 1 28 28 PHE HD2 H 1 7.450 0.00 . . . . . . X 339 PHE HD2 . 30623 1
284 . 1 . 1 28 28 PHE HE1 H 1 7.345 0.01 . . . . . . X 339 PHE HE1 . 30623 1
285 . 1 . 1 28 28 PHE HE2 H 1 7.345 0.01 . . . . . . X 339 PHE HE2 . 30623 1
286 . 1 . 1 28 28 PHE CB C 13 39.738 0.04 . . . . . . X 339 PHE CB . 30623 1
287 . 1 . 1 28 28 PHE CD1 C 13 132.487 0.00 . . . . . . X 339 PHE CD1 . 30623 1
288 . 1 . 1 28 28 PHE CD2 C 13 132.487 0.00 . . . . . . X 339 PHE CD2 . 30623 1
289 . 1 . 1 28 28 PHE CE1 C 13 131.537 0.00 . . . . . . X 339 PHE CE1 . 30623 1
290 . 1 . 1 28 28 PHE CE2 C 13 131.537 0.00 . . . . . . X 339 PHE CE2 . 30623 1
291 . 1 . 1 28 28 PHE N N 15 122.078 0.00 . . . . . . X 339 PHE N . 30623 1
292 . 1 . 1 29 29 VAL H H 1 8.674 0.00 . . . . . . X 340 VAL H . 30623 1
293 . 1 . 1 29 29 VAL HA H 1 3.644 0.00 . . . . . . X 340 VAL HA . 30623 1
294 . 1 . 1 29 29 VAL HB H 1 1.756 0.00 . . . . . . X 340 VAL HB . 30623 1
295 . 1 . 1 29 29 VAL HG11 H 1 0.799 0.00 . . . . . . X 340 VAL HG11 . 30623 1
296 . 1 . 1 29 29 VAL HG12 H 1 0.799 0.00 . . . . . . X 340 VAL HG12 . 30623 1
297 . 1 . 1 29 29 VAL HG13 H 1 0.799 0.00 . . . . . . X 340 VAL HG13 . 30623 1
298 . 1 . 1 29 29 VAL HG21 H 1 0.761 0.00 . . . . . . X 340 VAL HG21 . 30623 1
299 . 1 . 1 29 29 VAL HG22 H 1 0.761 0.00 . . . . . . X 340 VAL HG22 . 30623 1
300 . 1 . 1 29 29 VAL HG23 H 1 0.761 0.00 . . . . . . X 340 VAL HG23 . 30623 1
301 . 1 . 1 29 29 VAL CA C 13 63.949 0.00 . . . . . . X 340 VAL CA . 30623 1
302 . 1 . 1 29 29 VAL CB C 13 33.073 0.00 . . . . . . X 340 VAL CB . 30623 1
303 . 1 . 1 29 29 VAL CG1 C 13 22.432 0.00 . . . . . . X 340 VAL CG1 . 30623 1
304 . 1 . 1 29 29 VAL CG2 C 13 21.241 0.00 . . . . . . X 340 VAL CG2 . 30623 1
305 . 1 . 1 29 29 VAL N N 15 118.827 0.00 . . . . . . X 340 VAL N . 30623 1
306 . 1 . 1 30 30 HIS H H 1 8.659 0.00 . . . . . . X 341 HIS H . 30623 1
307 . 1 . 1 30 30 HIS HB2 H 1 2.928 0.00 . . . . . . X 341 HIS HB2 . 30623 1
308 . 1 . 1 30 30 HIS HB3 H 1 2.422 0.00 . . . . . . X 341 HIS HB3 . 30623 1
309 . 1 . 1 30 30 HIS HD2 H 1 6.834 0.00 . . . . . . X 341 HIS HD2 . 30623 1
310 . 1 . 1 30 30 HIS HE1 H 1 8.106 0.00 . . . . . . X 341 HIS HE1 . 30623 1
311 . 1 . 1 30 30 HIS CB C 13 29.260 0.03 . . . . . . X 341 HIS CB . 30623 1
312 . 1 . 1 30 30 HIS CD2 C 13 124.600 0.00 . . . . . . X 341 HIS CD2 . 30623 1
313 . 1 . 1 30 30 HIS CE1 C 13 140.290 0.00 . . . . . . X 341 HIS CE1 . 30623 1
314 . 1 . 1 30 30 HIS N N 15 126.053 0.00 . . . . . . X 341 HIS N . 30623 1
315 . 1 . 1 31 31 PRO HA H 1 4.319 0.00 . . . . . . X 342 PRO HA . 30623 1
316 . 1 . 1 31 31 PRO HB2 H 1 2.216 0.00 . . . . . . X 342 PRO HB2 . 30623 1
317 . 1 . 1 31 31 PRO HB3 H 1 1.861 0.00 . . . . . . X 342 PRO HB3 . 30623 1
318 . 1 . 1 31 31 PRO HG2 H 1 1.830 0.00 . . . . . . X 342 PRO HG2 . 30623 1
319 . 1 . 1 31 31 PRO HG3 H 1 1.830 0.00 . . . . . . X 342 PRO HG3 . 30623 1
320 . 1 . 1 31 31 PRO HD2 H 1 3.099 0.00 . . . . . . X 342 PRO HD2 . 30623 1
321 . 1 . 1 31 31 PRO HD3 H 1 2.478 0.00 . . . . . . X 342 PRO HD3 . 30623 1
322 . 1 . 1 31 31 PRO CA C 13 63.593 0.00 . . . . . . X 342 PRO CA . 30623 1
323 . 1 . 1 31 31 PRO CB C 13 32.081 0.05 . . . . . . X 342 PRO CB . 30623 1
324 . 1 . 1 31 31 PRO CG C 13 27.594 0.00 . . . . . . X 342 PRO CG . 30623 1
325 . 1 . 1 31 31 PRO CD C 13 50.166 0.00 . . . . . . X 342 PRO CD . 30623 1
326 . 1 . 1 32 32 THR H H 1 7.799 0.00 . . . . . . X 343 THR H . 30623 1
327 . 1 . 1 32 32 THR HA H 1 4.289 0.00 . . . . . . X 343 THR HA . 30623 1
328 . 1 . 1 32 32 THR HB H 1 4.304 0.00 . . . . . . X 343 THR HB . 30623 1
329 . 1 . 1 32 32 THR HG21 H 1 1.195 0.00 . . . . . . X 343 THR HG21 . 30623 1
330 . 1 . 1 32 32 THR HG22 H 1 1.195 0.00 . . . . . . X 343 THR HG22 . 30623 1
331 . 1 . 1 32 32 THR HG23 H 1 1.195 0.00 . . . . . . X 343 THR HG23 . 30623 1
332 . 1 . 1 32 32 THR CA C 13 61.632 0.00 . . . . . . X 343 THR CA . 30623 1
333 . 1 . 1 32 32 THR CB C 13 69.748 0.00 . . . . . . X 343 THR CB . 30623 1
334 . 1 . 1 32 32 THR CG2 C 13 21.696 0.00 . . . . . . X 343 THR CG2 . 30623 1
335 . 1 . 1 32 32 THR N N 15 110.802 0.00 . . . . . . X 343 THR N . 30623 1
336 . 1 . 1 33 33 ASP H H 1 8.133 0.00 . . . . . . X 344 ASP H . 30623 1
337 . 1 . 1 33 33 ASP HA H 1 4.587 0.00 . . . . . . X 344 ASP HA . 30623 1
338 . 1 . 1 33 33 ASP HB2 H 1 2.702 0.00 . . . . . . X 344 ASP HB2 . 30623 1
339 . 1 . 1 33 33 ASP HB3 H 1 2.702 0.00 . . . . . . X 344 ASP HB3 . 30623 1
340 . 1 . 1 33 33 ASP CA C 13 54.694 0.00 . . . . . . X 344 ASP CA . 30623 1
341 . 1 . 1 33 33 ASP CB C 13 41.032 0.00 . . . . . . X 344 ASP CB . 30623 1
342 . 1 . 1 33 33 ASP N N 15 121.955 0.00 . . . . . . X 344 ASP N . 30623 1
343 . 1 . 1 34 34 LYS H H 1 8.174 0.00 . . . . . . X 345 LYS H . 30623 1
344 . 1 . 1 34 34 LYS HA H 1 4.361 0.00 . . . . . . X 345 LYS HA . 30623 1
345 . 1 . 1 34 34 LYS HB2 H 1 1.862 0.00 . . . . . . X 345 LYS HB2 . 30623 1
346 . 1 . 1 34 34 LYS HB3 H 1 1.731 0.00 . . . . . . X 345 LYS HB3 . 30623 1
347 . 1 . 1 34 34 LYS HG2 H 1 1.419 0.00 . . . . . . X 345 LYS HG2 . 30623 1
348 . 1 . 1 34 34 LYS HG3 H 1 1.419 0.00 . . . . . . X 345 LYS HG3 . 30623 1
349 . 1 . 1 34 34 LYS HD2 H 1 1.669 0.00 . . . . . . X 345 LYS HD2 . 30623 1
350 . 1 . 1 34 34 LYS HD3 H 1 1.669 0.00 . . . . . . X 345 LYS HD3 . 30623 1
351 . 1 . 1 34 34 LYS HE2 H 1 2.998 0.00 . . . . . . X 345 LYS HE2 . 30623 1
352 . 1 . 1 34 34 LYS HE3 H 1 2.997 0.00 . . . . . . X 345 LYS HE3 . 30623 1
353 . 1 . 1 34 34 LYS CA C 13 55.961 0.00 . . . . . . X 345 LYS CA . 30623 1
354 . 1 . 1 34 34 LYS CB C 13 33.253 0.04 . . . . . . X 345 LYS CB . 30623 1
355 . 1 . 1 34 34 LYS CG C 13 24.497 0.00 . . . . . . X 345 LYS CG . 30623 1
356 . 1 . 1 34 34 LYS CD C 13 29.012 0.00 . . . . . . X 345 LYS CD . 30623 1
357 . 1 . 1 34 34 LYS CE C 13 42.160 0.01 . . . . . . X 345 LYS CE . 30623 1
358 . 1 . 1 34 34 LYS N N 15 121.055 0.00 . . . . . . X 345 LYS N . 30623 1
359 . 1 . 1 35 35 GLU H H 1 8.014 0.00 . . . . . . X 346 GLU H . 30623 1
360 . 1 . 1 35 35 GLU HA H 1 4.101 0.00 . . . . . . X 346 GLU HA . 30623 1
361 . 1 . 1 35 35 GLU HB2 H 1 2.033 0.00 . . . . . . X 346 GLU HB2 . 30623 1
362 . 1 . 1 35 35 GLU HB3 H 1 1.894 0.00 . . . . . . X 346 GLU HB3 . 30623 1
363 . 1 . 1 35 35 GLU HG2 H 1 2.211 0.00 . . . . . . X 346 GLU HG2 . 30623 1
364 . 1 . 1 35 35 GLU HG3 H 1 2.211 0.00 . . . . . . X 346 GLU HG3 . 30623 1
365 . 1 . 1 35 35 GLU CA C 13 58.149 0.00 . . . . . . X 346 GLU CA . 30623 1
366 . 1 . 1 35 35 GLU CB C 13 31.024 0.00 . . . . . . X 346 GLU CB . 30623 1
367 . 1 . 1 35 35 GLU CG C 13 36.595 0.00 . . . . . . X 346 GLU CG . 30623 1
368 . 1 . 1 35 35 GLU N N 15 127.210 0.00 . . . . . . X 346 GLU N . 30623 1
stop_
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