###################################
# 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_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 19713
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 19713 1
2 '3D HNCO' . . . 19713 1
3 '3D HNCA' . . . 19713 1
4 '3D HNCACB' . . . 19713 1
5 '3D HCCH-TOCSY' . . . 19713 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 MET HB2 H 1 2.291 0.020 . 2 . . . A 1 MET HB2 . 19713 1
2 . 1 1 1 1 MET HG3 H 1 2.615 0.020 . 2 . . . A 1 MET HG3 . 19713 1
3 . 1 1 1 1 MET HE1 H 1 1.807 0.020 . 1 . . . A 1 MET HE1 . 19713 1
4 . 1 1 1 1 MET HE2 H 1 1.807 0.020 . 1 . . . A 1 MET HE2 . 19713 1
5 . 1 1 1 1 MET HE3 H 1 1.807 0.020 . 1 . . . A 1 MET HE3 . 19713 1
6 . 1 1 1 1 MET CB C 13 34.316 0.400 . 1 . . . A 1 MET CB . 19713 1
7 . 1 1 1 1 MET CG C 13 30.877 0.400 . 1 . . . A 1 MET CG . 19713 1
8 . 1 1 1 1 MET CE C 13 16.696 0.400 . 1 . . . A 1 MET CE . 19713 1
9 . 1 1 2 2 LEU H H 1 8.977 0.020 . 1 . . . A 2 LEU H . 19713 1
10 . 1 1 2 2 LEU HA H 1 4.840 0.020 . 1 . . . A 2 LEU HA . 19713 1
11 . 1 1 2 2 LEU HB2 H 1 1.601 0.020 . 2 . . . A 2 LEU HB2 . 19713 1
12 . 1 1 2 2 LEU HB3 H 1 1.555 0.020 . 2 . . . A 2 LEU HB3 . 19713 1
13 . 1 1 2 2 LEU HG H 1 1.465 0.020 . 1 . . . A 2 LEU HG . 19713 1
14 . 1 1 2 2 LEU HD11 H 1 0.885 0.020 . 2 . . . A 2 LEU HD11 . 19713 1
15 . 1 1 2 2 LEU HD12 H 1 0.885 0.020 . 2 . . . A 2 LEU HD12 . 19713 1
16 . 1 1 2 2 LEU HD13 H 1 0.885 0.020 . 2 . . . A 2 LEU HD13 . 19713 1
17 . 1 1 2 2 LEU HD21 H 1 0.894 0.020 . 2 . . . A 2 LEU HD21 . 19713 1
18 . 1 1 2 2 LEU HD22 H 1 0.894 0.020 . 2 . . . A 2 LEU HD22 . 19713 1
19 . 1 1 2 2 LEU HD23 H 1 0.894 0.020 . 2 . . . A 2 LEU HD23 . 19713 1
20 . 1 1 2 2 LEU CA C 13 53.699 0.400 . 1 . . . A 2 LEU CA . 19713 1
21 . 1 1 2 2 LEU CB C 13 46.543 0.400 . 1 . . . A 2 LEU CB . 19713 1
22 . 1 1 2 2 LEU CG C 13 26.801 0.400 . 1 . . . A 2 LEU CG . 19713 1
23 . 1 1 2 2 LEU CD1 C 13 25.010 0.400 . 1 . . . A 2 LEU CD1 . 19713 1
24 . 1 1 2 2 LEU CD2 C 13 25.489 0.400 . 1 . . . A 2 LEU CD2 . 19713 1
25 . 1 1 2 2 LEU N N 15 123.873 0.400 . 1 . . . A 2 LEU N . 19713 1
26 . 1 1 3 3 MET H H 1 8.669 0.020 . 1 . . . A 3 MET H . 19713 1
27 . 1 1 3 3 MET HA H 1 3.402 0.020 . 1 . . . A 3 MET HA . 19713 1
28 . 1 1 3 3 MET HB2 H 1 1.385 0.020 . 2 . . . A 3 MET HB2 . 19713 1
29 . 1 1 3 3 MET HB3 H 1 -0.168 0.020 . 2 . . . A 3 MET HB3 . 19713 1
30 . 1 1 3 3 MET HG2 H 1 1.259 0.020 . 2 . . . A 3 MET HG2 . 19713 1
31 . 1 1 3 3 MET HG3 H 1 1.161 0.020 . 2 . . . A 3 MET HG3 . 19713 1
32 . 1 1 3 3 MET HE1 H 1 1.653 0.020 . 1 . . . A 3 MET HE1 . 19713 1
33 . 1 1 3 3 MET HE2 H 1 1.653 0.020 . 1 . . . A 3 MET HE2 . 19713 1
34 . 1 1 3 3 MET HE3 H 1 1.653 0.020 . 1 . . . A 3 MET HE3 . 19713 1
35 . 1 1 3 3 MET CA C 13 55.648 0.400 . 1 . . . A 3 MET CA . 19713 1
36 . 1 1 3 3 MET CB C 13 31.068 0.400 . 1 . . . A 3 MET CB . 19713 1
37 . 1 1 3 3 MET CG C 13 32.294 0.400 . 1 . . . A 3 MET CG . 19713 1
38 . 1 1 3 3 MET CE C 13 17.109 0.400 . 1 . . . A 3 MET CE . 19713 1
39 . 1 1 3 3 MET N N 15 128.873 0.400 . 1 . . . A 3 MET N . 19713 1
40 . 1 1 4 4 ILE H H 1 8.843 0.020 . 1 . . . A 4 ILE H . 19713 1
41 . 1 1 4 4 ILE HA H 1 3.923 0.020 . 1 . . . A 4 ILE HA . 19713 1
42 . 1 1 4 4 ILE HB H 1 1.749 0.020 . 1 . . . A 4 ILE HB . 19713 1
43 . 1 1 4 4 ILE HG12 H 1 1.569 0.020 . 2 . . . A 4 ILE HG12 . 19713 1
44 . 1 1 4 4 ILE HG13 H 1 1.242 0.020 . 2 . . . A 4 ILE HG13 . 19713 1
45 . 1 1 4 4 ILE HG21 H 1 0.788 0.020 . 1 . . . A 4 ILE HG21 . 19713 1
46 . 1 1 4 4 ILE HG22 H 1 0.788 0.020 . 1 . . . A 4 ILE HG22 . 19713 1
47 . 1 1 4 4 ILE HG23 H 1 0.788 0.020 . 1 . . . A 4 ILE HG23 . 19713 1
48 . 1 1 4 4 ILE HD11 H 1 0.705 0.020 . 1 . . . A 4 ILE HD11 . 19713 1
49 . 1 1 4 4 ILE HD12 H 1 0.705 0.020 . 1 . . . A 4 ILE HD12 . 19713 1
50 . 1 1 4 4 ILE HD13 H 1 0.705 0.020 . 1 . . . A 4 ILE HD13 . 19713 1
51 . 1 1 4 4 ILE CA C 13 59.664 0.400 . 1 . . . A 4 ILE CA . 19713 1
52 . 1 1 4 4 ILE CB C 13 37.874 0.400 . 1 . . . A 4 ILE CB . 19713 1
53 . 1 1 4 4 ILE CG1 C 13 27.041 0.400 . 1 . . . A 4 ILE CG1 . 19713 1
54 . 1 1 4 4 ILE CG2 C 13 16.973 0.400 . 1 . . . A 4 ILE CG2 . 19713 1
55 . 1 1 4 4 ILE CD1 C 13 9.236 0.400 . 1 . . . A 4 ILE CD1 . 19713 1
56 . 1 1 4 4 ILE N N 15 127.600 0.400 . 1 . . . A 4 ILE N . 19713 1
57 . 1 1 5 5 THR H H 1 7.255 0.020 . 1 . . . A 5 THR H . 19713 1
58 . 1 1 5 5 THR HA H 1 4.232 0.020 . 1 . . . A 5 THR HA . 19713 1
59 . 1 1 5 5 THR HB H 1 3.982 0.020 . 1 . . . A 5 THR HB . 19713 1
60 . 1 1 5 5 THR HG21 H 1 0.426 0.020 . 1 . . . A 5 THR HG21 . 19713 1
61 . 1 1 5 5 THR HG22 H 1 0.426 0.020 . 1 . . . A 5 THR HG22 . 19713 1
62 . 1 1 5 5 THR HG23 H 1 0.426 0.020 . 1 . . . A 5 THR HG23 . 19713 1
63 . 1 1 5 5 THR CA C 13 60.044 0.400 . 1 . . . A 5 THR CA . 19713 1
64 . 1 1 5 5 THR CB C 13 66.290 0.400 . 1 . . . A 5 THR CB . 19713 1
65 . 1 1 5 5 THR CG2 C 13 18.514 0.400 . 1 . . . A 5 THR CG2 . 19713 1
66 . 1 1 5 5 THR N N 15 109.859 0.400 . 1 . . . A 5 THR N . 19713 1
67 . 1 1 6 6 SER H H 1 7.717 0.020 . 1 . . . A 6 SER H . 19713 1
68 . 1 1 6 6 SER HA H 1 5.353 0.020 . 1 . . . A 6 SER HA . 19713 1
69 . 1 1 6 6 SER HB2 H 1 3.492 0.020 . 2 . . . A 6 SER HB2 . 19713 1
70 . 1 1 6 6 SER CA C 13 56.774 0.400 . 1 . . . A 6 SER CA . 19713 1
71 . 1 1 6 6 SER CB C 13 64.813 0.400 . 1 . . . A 6 SER CB . 19713 1
72 . 1 1 6 6 SER N N 15 116.037 0.400 . 1 . . . A 6 SER N . 19713 1
73 . 1 1 7 7 PHE H H 1 8.928 0.020 . 1 . . . A 7 PHE H . 19713 1
74 . 1 1 7 7 PHE HA H 1 4.911 0.020 . 1 . . . A 7 PHE HA . 19713 1
75 . 1 1 7 7 PHE HB2 H 1 3.336 0.020 . 2 . . . A 7 PHE HB2 . 19713 1
76 . 1 1 7 7 PHE HB3 H 1 2.679 0.020 . 2 . . . A 7 PHE HB3 . 19713 1
77 . 1 1 7 7 PHE HD1 H 1 7.279 0.020 . 1 . . . A 7 PHE HD1 . 19713 1
78 . 1 1 7 7 PHE HD2 H 1 7.279 0.020 . 1 . . . A 7 PHE HD2 . 19713 1
79 . 1 1 7 7 PHE HE1 H 1 7.309 0.020 . 1 . . . A 7 PHE HE1 . 19713 1
80 . 1 1 7 7 PHE HE2 H 1 7.309 0.020 . 1 . . . A 7 PHE HE2 . 19713 1
81 . 1 1 7 7 PHE HZ H 1 7.044 0.020 . 1 . . . A 7 PHE HZ . 19713 1
82 . 1 1 7 7 PHE CA C 13 56.763 0.400 . 1 . . . A 7 PHE CA . 19713 1
83 . 1 1 7 7 PHE CB C 13 43.423 0.400 . 1 . . . A 7 PHE CB . 19713 1
84 . 1 1 7 7 PHE N N 15 121.810 0.400 . 1 . . . A 7 PHE N . 19713 1
85 . 1 1 8 8 ALA HA H 1 4.595 0.020 . 1 . . . A 8 ALA HA . 19713 1
86 . 1 1 8 8 ALA HB1 H 1 1.526 0.020 . 1 . . . A 8 ALA HB1 . 19713 1
87 . 1 1 8 8 ALA HB2 H 1 1.526 0.020 . 1 . . . A 8 ALA HB2 . 19713 1
88 . 1 1 8 8 ALA HB3 H 1 1.526 0.020 . 1 . . . A 8 ALA HB3 . 19713 1
89 . 1 1 8 8 ALA CA C 13 53.578 0.400 . 1 . . . A 8 ALA CA . 19713 1
90 . 1 1 8 8 ALA CB C 13 19.050 0.400 . 1 . . . A 8 ALA CB . 19713 1
91 . 1 1 9 9 ASN H H 1 8.133 0.020 . 1 . . . A 9 ASN H . 19713 1
92 . 1 1 9 9 ASN HA H 1 5.250 0.020 . 1 . . . A 9 ASN HA . 19713 1
93 . 1 1 9 9 ASN HB2 H 1 3.110 0.020 . 2 . . . A 9 ASN HB2 . 19713 1
94 . 1 1 9 9 ASN HB3 H 1 2.855 0.020 . 2 . . . A 9 ASN HB3 . 19713 1
95 . 1 1 9 9 ASN HD21 H 1 7.960 0.020 . 2 . . . A 9 ASN HD21 . 19713 1
96 . 1 1 9 9 ASN HD22 H 1 7.207 0.020 . 2 . . . A 9 ASN HD22 . 19713 1
97 . 1 1 9 9 ASN CA C 13 49.672 0.400 . 1 . . . A 9 ASN CA . 19713 1
98 . 1 1 9 9 ASN CB C 13 39.758 0.400 . 1 . . . A 9 ASN CB . 19713 1
99 . 1 1 9 9 ASN N N 15 116.543 0.400 . 1 . . . A 9 ASN N . 19713 1
100 . 1 1 9 9 ASN ND2 N 15 114.261 0.400 . 1 . . . A 9 ASN ND2 . 19713 1
101 . 1 1 10 10 PRO HA H 1 4.338 0.020 . 1 . . . A 10 PRO HA . 19713 1
102 . 1 1 10 10 PRO HB2 H 1 2.028 0.020 . 2 . . . A 10 PRO HB2 . 19713 1
103 . 1 1 10 10 PRO HB3 H 1 2.331 0.020 . 2 . . . A 10 PRO HB3 . 19713 1
104 . 1 1 10 10 PRO HG2 H 1 2.115 0.020 . 2 . . . A 10 PRO HG2 . 19713 1
105 . 1 1 10 10 PRO HG3 H 1 2.061 0.020 . 2 . . . A 10 PRO HG3 . 19713 1
106 . 1 1 10 10 PRO HD2 H 1 4.010 0.020 . 2 . . . A 10 PRO HD2 . 19713 1
107 . 1 1 10 10 PRO HD3 H 1 4.126 0.020 . 2 . . . A 10 PRO HD3 . 19713 1
108 . 1 1 10 10 PRO CA C 13 64.578 0.400 . 1 . . . A 10 PRO CA . 19713 1
109 . 1 1 10 10 PRO CB C 13 32.355 0.400 . 1 . . . A 10 PRO CB . 19713 1
110 . 1 1 10 10 PRO CG C 13 26.983 0.400 . 1 . . . A 10 PRO CG . 19713 1
111 . 1 1 10 10 PRO CD C 13 51.363 0.400 . 1 . . . A 10 PRO CD . 19713 1
112 . 1 1 11 11 ARG H H 1 8.091 0.020 . 1 . . . A 11 ARG H . 19713 1
113 . 1 1 11 11 ARG HA H 1 4.154 0.020 . 1 . . . A 11 ARG HA . 19713 1
114 . 1 1 11 11 ARG HB2 H 1 1.952 0.020 . 2 . . . A 11 ARG HB2 . 19713 1
115 . 1 1 11 11 ARG HG2 H 1 1.757 0.020 . 2 . . . A 11 ARG HG2 . 19713 1
116 . 1 1 11 11 ARG HG3 H 1 1.676 0.020 . 2 . . . A 11 ARG HG3 . 19713 1
117 . 1 1 11 11 ARG HD2 H 1 3.244 0.020 . 2 . . . A 11 ARG HD2 . 19713 1
118 . 1 1 11 11 ARG CA C 13 58.851 0.400 . 1 . . . A 11 ARG CA . 19713 1
119 . 1 1 11 11 ARG CB C 13 29.603 0.400 . 1 . . . A 11 ARG CB . 19713 1
120 . 1 1 11 11 ARG CG C 13 27.331 0.400 . 1 . . . A 11 ARG CG . 19713 1
121 . 1 1 11 11 ARG CD C 13 42.864 0.400 . 1 . . . A 11 ARG CD . 19713 1
122 . 1 1 11 11 ARG N N 15 118.730 0.400 . 1 . . . A 11 ARG N . 19713 1
123 . 1 1 12 12 VAL H H 1 7.235 0.020 . 1 . . . A 12 VAL H . 19713 1
124 . 1 1 12 12 VAL HA H 1 3.635 0.020 . 1 . . . A 12 VAL HA . 19713 1
125 . 1 1 12 12 VAL HB H 1 2.025 0.020 . 1 . . . A 12 VAL HB . 19713 1
126 . 1 1 12 12 VAL HG11 H 1 0.793 0.020 . 2 . . . A 12 VAL HG11 . 19713 1
127 . 1 1 12 12 VAL HG12 H 1 0.793 0.020 . 2 . . . A 12 VAL HG12 . 19713 1
128 . 1 1 12 12 VAL HG13 H 1 0.793 0.020 . 2 . . . A 12 VAL HG13 . 19713 1
129 . 1 1 12 12 VAL HG21 H 1 0.966 0.020 . 2 . . . A 12 VAL HG21 . 19713 1
130 . 1 1 12 12 VAL HG22 H 1 0.966 0.020 . 2 . . . A 12 VAL HG22 . 19713 1
131 . 1 1 12 12 VAL HG23 H 1 0.966 0.020 . 2 . . . A 12 VAL HG23 . 19713 1
132 . 1 1 12 12 VAL CA C 13 65.532 0.400 . 1 . . . A 12 VAL CA . 19713 1
133 . 1 1 12 12 VAL CB C 13 31.762 0.400 . 1 . . . A 12 VAL CB . 19713 1
134 . 1 1 12 12 VAL CG1 C 13 21.704 0.400 . 1 . . . A 12 VAL CG1 . 19713 1
135 . 1 1 12 12 VAL CG2 C 13 22.300 0.400 . 1 . . . A 12 VAL CG2 . 19713 1
136 . 1 1 12 12 VAL N N 15 122.396 0.400 . 1 . . . A 12 VAL N . 19713 1
137 . 1 1 13 13 ALA H H 1 6.857 0.020 . 1 . . . A 13 ALA H . 19713 1
138 . 1 1 13 13 ALA HA H 1 3.124 0.020 . 1 . . . A 13 ALA HA . 19713 1
139 . 1 1 13 13 ALA HB1 H 1 1.349 0.020 . 1 . . . A 13 ALA HB1 . 19713 1
140 . 1 1 13 13 ALA HB2 H 1 1.349 0.020 . 1 . . . A 13 ALA HB2 . 19713 1
141 . 1 1 13 13 ALA HB3 H 1 1.349 0.020 . 1 . . . A 13 ALA HB3 . 19713 1
142 . 1 1 13 13 ALA CA C 13 54.715 0.400 . 1 . . . A 13 ALA CA . 19713 1
143 . 1 1 13 13 ALA CB C 13 18.757 0.400 . 1 . . . A 13 ALA CB . 19713 1
144 . 1 1 13 13 ALA N N 15 119.674 0.400 . 1 . . . A 13 ALA N . 19713 1
145 . 1 1 14 14 GLN H H 1 7.800 0.020 . 1 . . . A 14 GLN H . 19713 1
146 . 1 1 14 14 GLN HA H 1 3.683 0.020 . 1 . . . A 14 GLN HA . 19713 1
147 . 1 1 14 14 GLN HB3 H 1 2.142 0.020 . 2 . . . A 14 GLN HB3 . 19713 1
148 . 1 1 14 14 GLN HG2 H 1 2.357 0.020 . 2 . . . A 14 GLN HG2 . 19713 1
149 . 1 1 14 14 GLN HE21 H 1 7.883 0.020 . 2 . . . A 14 GLN HE21 . 19713 1
150 . 1 1 14 14 GLN HE22 H 1 6.850 0.020 . 2 . . . A 14 GLN HE22 . 19713 1
151 . 1 1 14 14 GLN CA C 13 57.788 0.400 . 1 . . . A 14 GLN CA . 19713 1
152 . 1 1 14 14 GLN CB C 13 28.407 0.400 . 1 . . . A 14 GLN CB . 19713 1
153 . 1 1 14 14 GLN CG C 13 33.314 0.400 . 1 . . . A 14 GLN CG . 19713 1
154 . 1 1 14 14 GLN N N 15 115.202 0.400 . 1 . . . A 14 GLN N . 19713 1
155 . 1 1 14 14 GLN NE2 N 15 115.580 0.400 . 1 . . . A 14 GLN NE2 . 19713 1
156 . 1 1 15 15 ALA H H 1 7.882 0.020 . 1 . . . A 15 ALA H . 19713 1
157 . 1 1 15 15 ALA HA H 1 4.297 0.020 . 1 . . . A 15 ALA HA . 19713 1
158 . 1 1 15 15 ALA HB1 H 1 1.718 0.020 . 1 . . . A 15 ALA HB1 . 19713 1
159 . 1 1 15 15 ALA HB2 H 1 1.718 0.020 . 1 . . . A 15 ALA HB2 . 19713 1
160 . 1 1 15 15 ALA HB3 H 1 1.718 0.020 . 1 . . . A 15 ALA HB3 . 19713 1
161 . 1 1 15 15 ALA CA C 13 54.990 0.400 . 1 . . . A 15 ALA CA . 19713 1
162 . 1 1 15 15 ALA CB C 13 17.736 0.400 . 1 . . . A 15 ALA CB . 19713 1
163 . 1 1 15 15 ALA N N 15 121.416 0.400 . 1 . . . A 15 ALA N . 19713 1
164 . 1 1 16 16 PHE H H 1 8.150 0.020 . 1 . . . A 16 PHE H . 19713 1
165 . 1 1 16 16 PHE HA H 1 3.612 0.020 . 1 . . . A 16 PHE HA . 19713 1
166 . 1 1 16 16 PHE HB2 H 1 2.585 0.020 . 2 . . . A 16 PHE HB2 . 19713 1
167 . 1 1 16 16 PHE HB3 H 1 2.338 0.020 . 2 . . . A 16 PHE HB3 . 19713 1
168 . 1 1 16 16 PHE HD1 H 1 6.415 0.020 . 1 . . . A 16 PHE HD1 . 19713 1
169 . 1 1 16 16 PHE HD2 H 1 6.415 0.020 . 1 . . . A 16 PHE HD2 . 19713 1
170 . 1 1 16 16 PHE HE1 H 1 6.520 0.020 . 1 . . . A 16 PHE HE1 . 19713 1
171 . 1 1 16 16 PHE HE2 H 1 6.520 0.020 . 1 . . . A 16 PHE HE2 . 19713 1
172 . 1 1 16 16 PHE HZ H 1 6.958 0.020 . 1 . . . A 16 PHE HZ . 19713 1
173 . 1 1 16 16 PHE CA C 13 61.141 0.400 . 1 . . . A 16 PHE CA . 19713 1
174 . 1 1 16 16 PHE CB C 13 38.658 0.400 . 1 . . . A 16 PHE CB . 19713 1
175 . 1 1 16 16 PHE N N 15 120.765 0.400 . 1 . . . A 16 PHE N . 19713 1
176 . 1 1 17 17 VAL H H 1 8.193 0.020 . 1 . . . A 17 VAL H . 19713 1
177 . 1 1 17 17 VAL HA H 1 3.211 0.020 . 1 . . . A 17 VAL HA . 19713 1
178 . 1 1 17 17 VAL HB H 1 2.224 0.020 . 1 . . . A 17 VAL HB . 19713 1
179 . 1 1 17 17 VAL HG11 H 1 1.017 0.020 . 2 . . . A 17 VAL HG11 . 19713 1
180 . 1 1 17 17 VAL HG12 H 1 1.017 0.020 . 2 . . . A 17 VAL HG12 . 19713 1
181 . 1 1 17 17 VAL HG13 H 1 1.017 0.020 . 2 . . . A 17 VAL HG13 . 19713 1
182 . 1 1 17 17 VAL HG21 H 1 0.980 0.020 . 2 . . . A 17 VAL HG21 . 19713 1
183 . 1 1 17 17 VAL HG22 H 1 0.980 0.020 . 2 . . . A 17 VAL HG22 . 19713 1
184 . 1 1 17 17 VAL HG23 H 1 0.980 0.020 . 2 . . . A 17 VAL HG23 . 19713 1
185 . 1 1 17 17 VAL CA C 13 67.635 0.400 . 1 . . . A 17 VAL CA . 19713 1
186 . 1 1 17 17 VAL CB C 13 31.503 0.400 . 1 . . . A 17 VAL CB . 19713 1
187 . 1 1 17 17 VAL CG1 C 13 23.528 0.400 . 1 . . . A 17 VAL CG1 . 19713 1
188 . 1 1 17 17 VAL CG2 C 13 21.121 0.400 . 1 . . . A 17 VAL CG2 . 19713 1
189 . 1 1 17 17 VAL N N 15 120.622 0.400 . 1 . . . A 17 VAL N . 19713 1
190 . 1 1 18 18 ASP H H 1 9.093 0.020 . 1 . . . A 18 ASP H . 19713 1
191 . 1 1 18 18 ASP HA H 1 4.393 0.020 . 1 . . . A 18 ASP HA . 19713 1
192 . 1 1 18 18 ASP HB2 H 1 2.803 0.020 . 2 . . . A 18 ASP HB2 . 19713 1
193 . 1 1 18 18 ASP HB3 H 1 2.692 0.020 . 2 . . . A 18 ASP HB3 . 19713 1
194 . 1 1 18 18 ASP CA C 13 57.549 0.400 . 1 . . . A 18 ASP CA . 19713 1
195 . 1 1 18 18 ASP CB C 13 39.822 0.400 . 1 . . . A 18 ASP CB . 19713 1
196 . 1 1 18 18 ASP N N 15 123.142 0.400 . 1 . . . A 18 ASP N . 19713 1
197 . 1 1 19 19 TYR H H 1 8.142 0.020 . 1 . . . A 19 TYR H . 19713 1
198 . 1 1 19 19 TYR HA H 1 4.389 0.020 . 1 . . . A 19 TYR HA . 19713 1
199 . 1 1 19 19 TYR HB2 H 1 3.376 0.020 . 2 . . . A 19 TYR HB2 . 19713 1
200 . 1 1 19 19 TYR HB3 H 1 2.933 0.020 . 2 . . . A 19 TYR HB3 . 19713 1
201 . 1 1 19 19 TYR HD1 H 1 6.961 0.020 . 1 . . . A 19 TYR HD1 . 19713 1
202 . 1 1 19 19 TYR HD2 H 1 6.961 0.020 . 1 . . . A 19 TYR HD2 . 19713 1
203 . 1 1 19 19 TYR HE1 H 1 6.937 0.020 . 1 . . . A 19 TYR HE1 . 19713 1
204 . 1 1 19 19 TYR HE2 H 1 6.937 0.020 . 1 . . . A 19 TYR HE2 . 19713 1
205 . 1 1 19 19 TYR CA C 13 60.794 0.400 . 1 . . . A 19 TYR CA . 19713 1
206 . 1 1 19 19 TYR CB C 13 37.987 0.400 . 1 . . . A 19 TYR CB . 19713 1
207 . 1 1 19 19 TYR N N 15 122.100 0.400 . 1 . . . A 19 TYR N . 19713 1
208 . 1 1 20 20 MET H H 1 8.421 0.020 . 1 . . . A 20 MET H . 19713 1
209 . 1 1 20 20 MET HA H 1 3.987 0.020 . 1 . . . A 20 MET HA . 19713 1
210 . 1 1 20 20 MET HB2 H 1 1.681 0.020 . 2 . . . A 20 MET HB2 . 19713 1
211 . 1 1 20 20 MET HG2 H 1 1.828 0.020 . 2 . . . A 20 MET HG2 . 19713 1
212 . 1 1 20 20 MET HG3 H 1 1.538 0.020 . 2 . . . A 20 MET HG3 . 19713 1
213 . 1 1 20 20 MET HE1 H 1 1.765 0.020 . 1 . . . A 20 MET HE1 . 19713 1
214 . 1 1 20 20 MET HE2 H 1 1.765 0.020 . 1 . . . A 20 MET HE2 . 19713 1
215 . 1 1 20 20 MET HE3 H 1 1.765 0.020 . 1 . . . A 20 MET HE3 . 19713 1
216 . 1 1 20 20 MET CA C 13 56.147 0.400 . 1 . . . A 20 MET CA . 19713 1
217 . 1 1 20 20 MET CB C 13 28.818 0.400 . 1 . . . A 20 MET CB . 19713 1
218 . 1 1 20 20 MET CG C 13 31.756 0.400 . 1 . . . A 20 MET CG . 19713 1
219 . 1 1 20 20 MET CE C 13 15.559 0.400 . 1 . . . A 20 MET CE . 19713 1
220 . 1 1 20 20 MET N N 15 119.265 0.400 . 1 . . . A 20 MET N . 19713 1
221 . 1 1 21 21 ALA H H 1 8.107 0.020 . 1 . . . A 21 ALA H . 19713 1
222 . 1 1 21 21 ALA HA H 1 4.095 0.020 . 1 . . . A 21 ALA HA . 19713 1
223 . 1 1 21 21 ALA HB1 H 1 1.589 0.020 . 1 . . . A 21 ALA HB1 . 19713 1
224 . 1 1 21 21 ALA HB2 H 1 1.589 0.020 . 1 . . . A 21 ALA HB2 . 19713 1
225 . 1 1 21 21 ALA HB3 H 1 1.589 0.020 . 1 . . . A 21 ALA HB3 . 19713 1
226 . 1 1 21 21 ALA CA C 13 55.540 0.400 . 1 . . . A 21 ALA CA . 19713 1
227 . 1 1 21 21 ALA CB C 13 17.316 0.400 . 1 . . . A 21 ALA CB . 19713 1
228 . 1 1 21 21 ALA N N 15 124.076 0.400 . 1 . . . A 21 ALA N . 19713 1
229 . 1 1 22 22 THR H H 1 7.590 0.020 . 1 . . . A 22 THR H . 19713 1
230 . 1 1 22 22 THR HA H 1 4.236 0.020 . 1 . . . A 22 THR HA . 19713 1
231 . 1 1 22 22 THR HB H 1 4.317 0.020 . 1 . . . A 22 THR HB . 19713 1
232 . 1 1 22 22 THR HG21 H 1 1.438 0.020 . 1 . . . A 22 THR HG21 . 19713 1
233 . 1 1 22 22 THR HG22 H 1 1.438 0.020 . 1 . . . A 22 THR HG22 . 19713 1
234 . 1 1 22 22 THR HG23 H 1 1.438 0.020 . 1 . . . A 22 THR HG23 . 19713 1
235 . 1 1 22 22 THR CA C 13 64.631 0.400 . 1 . . . A 22 THR CA . 19713 1
236 . 1 1 22 22 THR CB C 13 69.311 0.400 . 1 . . . A 22 THR CB . 19713 1
237 . 1 1 22 22 THR CG2 C 13 21.487 0.400 . 1 . . . A 22 THR CG2 . 19713 1
238 . 1 1 22 22 THR N N 15 111.538 0.400 . 1 . . . A 22 THR N . 19713 1
239 . 1 1 23 23 GLN H H 1 7.219 0.020 . 1 . . . A 23 GLN H . 19713 1
240 . 1 1 23 23 GLN HA H 1 4.361 0.020 . 1 . . . A 23 GLN HA . 19713 1
241 . 1 1 23 23 GLN HB2 H 1 2.306 0.020 . 2 . . . A 23 GLN HB2 . 19713 1
242 . 1 1 23 23 GLN HB3 H 1 1.796 0.020 . 2 . . . A 23 GLN HB3 . 19713 1
243 . 1 1 23 23 GLN HG3 H 1 1.873 0.020 . 2 . . . A 23 GLN HG3 . 19713 1
244 . 1 1 23 23 GLN HE21 H 1 6.482 0.020 . 2 . . . A 23 GLN HE21 . 19713 1
245 . 1 1 23 23 GLN HE22 H 1 6.825 0.020 . 2 . . . A 23 GLN HE22 . 19713 1
246 . 1 1 23 23 GLN CA C 13 53.733 0.400 . 1 . . . A 23 GLN CA . 19713 1
247 . 1 1 23 23 GLN CB C 13 28.847 0.400 . 1 . . . A 23 GLN CB . 19713 1
248 . 1 1 23 23 GLN CG C 13 33.217 0.400 . 1 . . . A 23 GLN CG . 19713 1
249 . 1 1 23 23 GLN N N 15 118.055 0.400 . 1 . . . A 23 GLN N . 19713 1
250 . 1 1 23 23 GLN NE2 N 15 113.013 0.400 . 1 . . . A 23 GLN NE2 . 19713 1
251 . 1 1 24 24 GLY H H 1 7.641 0.020 . 1 . . . A 24 GLY H . 19713 1
252 . 1 1 24 24 GLY HA2 H 1 4.139 0.020 . 2 . . . A 24 GLY HA2 . 19713 1
253 . 1 1 24 24 GLY HA3 H 1 3.693 0.020 . 2 . . . A 24 GLY HA3 . 19713 1
254 . 1 1 24 24 GLY CA C 13 45.484 0.400 . 1 . . . A 24 GLY CA . 19713 1
255 . 1 1 24 24 GLY N N 15 106.367 0.400 . 1 . . . A 24 GLY N . 19713 1
256 . 1 1 25 25 VAL H H 1 7.664 0.020 . 1 . . . A 25 VAL H . 19713 1
257 . 1 1 25 25 VAL HA H 1 4.262 0.020 . 1 . . . A 25 VAL HA . 19713 1
258 . 1 1 25 25 VAL HB H 1 1.561 0.020 . 1 . . . A 25 VAL HB . 19713 1
259 . 1 1 25 25 VAL HG11 H 1 0.654 0.020 . 2 . . . A 25 VAL HG11 . 19713 1
260 . 1 1 25 25 VAL HG12 H 1 0.654 0.020 . 2 . . . A 25 VAL HG12 . 19713 1
261 . 1 1 25 25 VAL HG13 H 1 0.654 0.020 . 2 . . . A 25 VAL HG13 . 19713 1
262 . 1 1 25 25 VAL HG21 H 1 0.673 0.020 . 2 . . . A 25 VAL HG21 . 19713 1
263 . 1 1 25 25 VAL HG22 H 1 0.673 0.020 . 2 . . . A 25 VAL HG22 . 19713 1
264 . 1 1 25 25 VAL HG23 H 1 0.673 0.020 . 2 . . . A 25 VAL HG23 . 19713 1
265 . 1 1 25 25 VAL CA C 13 60.880 0.400 . 1 . . . A 25 VAL CA . 19713 1
266 . 1 1 25 25 VAL CB C 13 33.830 0.400 . 1 . . . A 25 VAL CB . 19713 1
267 . 1 1 25 25 VAL CG1 C 13 20.301 0.400 . 1 . . . A 25 VAL CG1 . 19713 1
268 . 1 1 25 25 VAL CG2 C 13 20.928 0.400 . 1 . . . A 25 VAL CG2 . 19713 1
269 . 1 1 25 25 VAL N N 15 120.869 0.400 . 1 . . . A 25 VAL N . 19713 1
270 . 1 1 26 26 ILE H H 1 9.003 0.020 . 1 . . . A 26 ILE H . 19713 1
271 . 1 1 26 26 ILE HA H 1 3.923 0.020 . 1 . . . A 26 ILE HA . 19713 1
272 . 1 1 26 26 ILE HB H 1 1.932 0.020 . 1 . . . A 26 ILE HB . 19713 1
273 . 1 1 26 26 ILE HG12 H 1 1.458 0.020 . 2 . . . A 26 ILE HG12 . 19713 1
274 . 1 1 26 26 ILE HG13 H 1 1.318 0.020 . 2 . . . A 26 ILE HG13 . 19713 1
275 . 1 1 26 26 ILE HG21 H 1 0.840 0.020 . 1 . . . A 26 ILE HG21 . 19713 1
276 . 1 1 26 26 ILE HG22 H 1 0.840 0.020 . 1 . . . A 26 ILE HG22 . 19713 1
277 . 1 1 26 26 ILE HG23 H 1 0.840 0.020 . 1 . . . A 26 ILE HG23 . 19713 1
278 . 1 1 26 26 ILE HD11 H 1 0.761 0.020 . 1 . . . A 26 ILE HD11 . 19713 1
279 . 1 1 26 26 ILE HD12 H 1 0.761 0.020 . 1 . . . A 26 ILE HD12 . 19713 1
280 . 1 1 26 26 ILE HD13 H 1 0.761 0.020 . 1 . . . A 26 ILE HD13 . 19713 1
281 . 1 1 26 26 ILE CA C 13 59.995 0.400 . 1 . . . A 26 ILE CA . 19713 1
282 . 1 1 26 26 ILE CB C 13 36.936 0.400 . 1 . . . A 26 ILE CB . 19713 1
283 . 1 1 26 26 ILE CG1 C 13 26.859 0.400 . 1 . . . A 26 ILE CG1 . 19713 1
284 . 1 1 26 26 ILE CG2 C 13 17.209 0.400 . 1 . . . A 26 ILE CG2 . 19713 1
285 . 1 1 26 26 ILE CD1 C 13 10.703 0.400 . 1 . . . A 26 ILE CD1 . 19713 1
286 . 1 1 26 26 ILE N N 15 128.372 0.400 . 1 . . . A 26 ILE N . 19713 1
287 . 1 1 27 27 LEU H H 1 8.291 0.020 . 1 . . . A 27 LEU H . 19713 1
288 . 1 1 27 27 LEU HA H 1 5.214 0.020 . 1 . . . A 27 LEU HA . 19713 1
289 . 1 1 27 27 LEU HB2 H 1 1.552 0.020 . 2 . . . A 27 LEU HB2 . 19713 1
290 . 1 1 27 27 LEU HB3 H 1 1.762 0.020 . 2 . . . A 27 LEU HB3 . 19713 1
291 . 1 1 27 27 LEU HG H 1 1.569 0.020 . 1 . . . A 27 LEU HG . 19713 1
292 . 1 1 27 27 LEU HD11 H 1 0.663 0.020 . 2 . . . A 27 LEU HD11 . 19713 1
293 . 1 1 27 27 LEU HD12 H 1 0.663 0.020 . 2 . . . A 27 LEU HD12 . 19713 1
294 . 1 1 27 27 LEU HD13 H 1 0.663 0.020 . 2 . . . A 27 LEU HD13 . 19713 1
295 . 1 1 27 27 LEU HD21 H 1 0.924 0.020 . 2 . . . A 27 LEU HD21 . 19713 1
296 . 1 1 27 27 LEU HD22 H 1 0.924 0.020 . 2 . . . A 27 LEU HD22 . 19713 1
297 . 1 1 27 27 LEU HD23 H 1 0.924 0.020 . 2 . . . A 27 LEU HD23 . 19713 1
298 . 1 1 27 27 LEU CA C 13 53.023 0.400 . 1 . . . A 27 LEU CA . 19713 1
299 . 1 1 27 27 LEU CB C 13 44.804 0.400 . 1 . . . A 27 LEU CB . 19713 1
300 . 1 1 27 27 LEU CG C 13 27.162 0.400 . 1 . . . A 27 LEU CG . 19713 1
301 . 1 1 27 27 LEU CD1 C 13 28.098 0.400 . 1 . . . A 27 LEU CD1 . 19713 1
302 . 1 1 27 27 LEU CD2 C 13 25.980 0.400 . 1 . . . A 27 LEU CD2 . 19713 1
303 . 1 1 27 27 LEU N N 15 130.068 0.400 . 1 . . . A 27 LEU N . 19713 1
304 . 1 1 28 28 THR H H 1 8.948 0.020 . 1 . . . A 28 THR H . 19713 1
305 . 1 1 28 28 THR HA H 1 4.763 0.020 . 1 . . . A 28 THR HA . 19713 1
306 . 1 1 28 28 THR HB H 1 4.138 0.020 . 1 . . . A 28 THR HB . 19713 1
307 . 1 1 28 28 THR HG21 H 1 1.152 0.020 . 1 . . . A 28 THR HG21 . 19713 1
308 . 1 1 28 28 THR HG22 H 1 1.152 0.020 . 1 . . . A 28 THR HG22 . 19713 1
309 . 1 1 28 28 THR HG23 H 1 1.152 0.020 . 1 . . . A 28 THR HG23 . 19713 1
310 . 1 1 28 28 THR CA C 13 60.132 0.400 . 1 . . . A 28 THR CA . 19713 1
311 . 1 1 28 28 THR CB C 13 71.760 0.400 . 1 . . . A 28 THR CB . 19713 1
312 . 1 1 28 28 THR CG2 C 13 21.803 0.400 . 1 . . . A 28 THR CG2 . 19713 1
313 . 1 1 28 28 THR N N 15 111.171 0.400 . 1 . . . A 28 THR N . 19713 1
314 . 1 1 29 29 ILE H H 1 8.713 0.020 . 1 . . . A 29 ILE H . 19713 1
315 . 1 1 29 29 ILE HA H 1 5.310 0.020 . 1 . . . A 29 ILE HA . 19713 1
316 . 1 1 29 29 ILE HB H 1 1.730 0.020 . 1 . . . A 29 ILE HB . 19713 1
317 . 1 1 29 29 ILE HG12 H 1 0.804 0.020 . 2 . . . A 29 ILE HG12 . 19713 1
318 . 1 1 29 29 ILE HG13 H 1 1.675 0.020 . 2 . . . A 29 ILE HG13 . 19713 1
319 . 1 1 29 29 ILE HG21 H 1 0.921 0.020 . 1 . . . A 29 ILE HG21 . 19713 1
320 . 1 1 29 29 ILE HG22 H 1 0.921 0.020 . 1 . . . A 29 ILE HG22 . 19713 1
321 . 1 1 29 29 ILE HG23 H 1 0.921 0.020 . 1 . . . A 29 ILE HG23 . 19713 1
322 . 1 1 29 29 ILE HD11 H 1 0.808 0.020 . 1 . . . A 29 ILE HD11 . 19713 1
323 . 1 1 29 29 ILE HD12 H 1 0.808 0.020 . 1 . . . A 29 ILE HD12 . 19713 1
324 . 1 1 29 29 ILE HD13 H 1 0.808 0.020 . 1 . . . A 29 ILE HD13 . 19713 1
325 . 1 1 29 29 ILE CA C 13 59.908 0.400 . 1 . . . A 29 ILE CA . 19713 1
326 . 1 1 29 29 ILE CB C 13 40.768 0.400 . 1 . . . A 29 ILE CB . 19713 1
327 . 1 1 29 29 ILE CG1 C 13 29.315 0.400 . 1 . . . A 29 ILE CG1 . 19713 1
328 . 1 1 29 29 ILE CG2 C 13 18.199 0.400 . 1 . . . A 29 ILE CG2 . 19713 1
329 . 1 1 29 29 ILE CD1 C 13 13.365 0.400 . 1 . . . A 29 ILE CD1 . 19713 1
330 . 1 1 29 29 ILE N N 15 121.390 0.400 . 1 . . . A 29 ILE N . 19713 1
331 . 1 1 30 30 GLN H H 1 9.518 0.020 . 1 . . . A 30 GLN H . 19713 1
332 . 1 1 30 30 GLN HA H 1 4.772 0.020 . 1 . . . A 30 GLN HA . 19713 1
333 . 1 1 30 30 GLN HB2 H 1 2.325 0.020 . 2 . . . A 30 GLN HB2 . 19713 1
334 . 1 1 30 30 GLN HB3 H 1 2.095 0.020 . 2 . . . A 30 GLN HB3 . 19713 1
335 . 1 1 30 30 GLN HG3 H 1 2.237 0.020 . 2 . . . A 30 GLN HG3 . 19713 1
336 . 1 1 30 30 GLN HE21 H 1 6.966 0.020 . 2 . . . A 30 GLN HE21 . 19713 1
337 . 1 1 30 30 GLN HE22 H 1 6.403 0.020 . 2 . . . A 30 GLN HE22 . 19713 1
338 . 1 1 30 30 GLN CA C 13 54.629 0.400 . 1 . . . A 30 GLN CA . 19713 1
339 . 1 1 30 30 GLN CB C 13 31.309 0.400 . 1 . . . A 30 GLN CB . 19713 1
340 . 1 1 30 30 GLN CG C 13 33.594 0.400 . 1 . . . A 30 GLN CG . 19713 1
341 . 1 1 30 30 GLN N N 15 127.776 0.400 . 1 . . . A 30 GLN N . 19713 1
342 . 1 1 30 30 GLN NE2 N 15 110.440 0.400 . 1 . . . A 30 GLN NE2 . 19713 1
343 . 1 1 31 31 GLN H H 1 9.029 0.020 . 1 . . . A 31 GLN H . 19713 1
344 . 1 1 31 31 GLN HA H 1 5.263 0.020 . 1 . . . A 31 GLN HA . 19713 1
345 . 1 1 31 31 GLN HB2 H 1 1.992 0.020 . 2 . . . A 31 GLN HB2 . 19713 1
346 . 1 1 31 31 GLN HB3 H 1 2.103 0.020 . 2 . . . A 31 GLN HB3 . 19713 1
347 . 1 1 31 31 GLN HG2 H 1 2.422 0.020 . 2 . . . A 31 GLN HG2 . 19713 1
348 . 1 1 31 31 GLN HG3 H 1 2.351 0.020 . 2 . . . A 31 GLN HG3 . 19713 1
349 . 1 1 31 31 GLN HE21 H 1 7.577 0.020 . 2 . . . A 31 GLN HE21 . 19713 1
350 . 1 1 31 31 GLN HE22 H 1 6.918 0.020 . 2 . . . A 31 GLN HE22 . 19713 1
351 . 1 1 31 31 GLN CA C 13 55.010 0.400 . 1 . . . A 31 GLN CA . 19713 1
352 . 1 1 31 31 GLN CB C 13 30.396 0.400 . 1 . . . A 31 GLN CB . 19713 1
353 . 1 1 31 31 GLN CG C 13 34.000 0.400 . 1 . . . A 31 GLN CG . 19713 1
354 . 1 1 31 31 GLN N N 15 125.893 0.400 . 1 . . . A 31 GLN N . 19713 1
355 . 1 1 31 31 GLN NE2 N 15 111.959 0.400 . 1 . . . A 31 GLN NE2 . 19713 1
356 . 1 1 32 32 HIS H H 1 8.912 0.020 . 1 . . . A 32 HIS H . 19713 1
357 . 1 1 32 32 HIS HA H 1 4.966 0.020 . 1 . . . A 32 HIS HA . 19713 1
358 . 1 1 32 32 HIS HB2 H 1 3.260 0.020 . 2 . . . A 32 HIS HB2 . 19713 1
359 . 1 1 32 32 HIS HB3 H 1 3.374 0.020 . 2 . . . A 32 HIS HB3 . 19713 1
360 . 1 1 32 32 HIS HD2 H 1 7.126 0.020 . 1 . . . A 32 HIS HD2 . 19713 1
361 . 1 1 32 32 HIS HE1 H 1 8.681 0.020 . 1 . . . A 32 HIS HE1 . 19713 1
362 . 1 1 32 32 HIS CA C 13 54.514 0.400 . 1 . . . A 32 HIS CA . 19713 1
363 . 1 1 32 32 HIS CB C 13 30.661 0.400 . 1 . . . A 32 HIS CB . 19713 1
364 . 1 1 32 32 HIS N N 15 121.451 0.400 . 1 . . . A 32 HIS N . 19713 1
365 . 1 1 33 33 ASN H H 1 8.940 0.020 . 1 . . . A 33 ASN H . 19713 1
366 . 1 1 33 33 ASN HA H 1 5.200 0.020 . 1 . . . A 33 ASN HA . 19713 1
367 . 1 1 33 33 ASN HB2 H 1 2.748 0.020 . 2 . . . A 33 ASN HB2 . 19713 1
368 . 1 1 33 33 ASN HD21 H 1 7.436 0.020 . 2 . . . A 33 ASN HD21 . 19713 1
369 . 1 1 33 33 ASN HD22 H 1 6.940 0.020 . 2 . . . A 33 ASN HD22 . 19713 1
370 . 1 1 33 33 ASN CA C 13 53.106 0.400 . 1 . . . A 33 ASN CA . 19713 1
371 . 1 1 33 33 ASN CB C 13 40.448 0.400 . 1 . . . A 33 ASN CB . 19713 1
372 . 1 1 33 33 ASN N N 15 121.954 0.400 . 1 . . . A 33 ASN N . 19713 1
373 . 1 1 33 33 ASN ND2 N 15 112.268 0.400 . 1 . . . A 33 ASN ND2 . 19713 1
374 . 1 1 34 34 GLN H H 1 8.648 0.020 . 1 . . . A 34 GLN H . 19713 1
375 . 1 1 34 34 GLN HA H 1 4.619 0.020 . 1 . . . A 34 GLN HA . 19713 1
376 . 1 1 34 34 GLN HB2 H 1 1.687 0.020 . 2 . . . A 34 GLN HB2 . 19713 1
377 . 1 1 34 34 GLN HG2 H 1 2.163 0.020 . 2 . . . A 34 GLN HG2 . 19713 1
378 . 1 1 34 34 GLN HE21 H 1 8.257 0.020 . 2 . . . A 34 GLN HE21 . 19713 1
379 . 1 1 34 34 GLN HE22 H 1 6.621 0.020 . 2 . . . A 34 GLN HE22 . 19713 1
380 . 1 1 34 34 GLN CA C 13 55.582 0.400 . 1 . . . A 34 GLN CA . 19713 1
381 . 1 1 34 34 GLN CB C 13 32.175 0.400 . 1 . . . A 34 GLN CB . 19713 1
382 . 1 1 34 34 GLN CG C 13 33.385 0.400 . 1 . . . A 34 GLN CG . 19713 1
383 . 1 1 34 34 GLN N N 15 123.175 0.400 . 1 . . . A 34 GLN N . 19713 1
384 . 1 1 34 34 GLN NE2 N 15 111.783 0.400 . 1 . . . A 34 GLN NE2 . 19713 1
385 . 1 1 35 35 SER H H 1 8.744 0.020 . 1 . . . A 35 SER H . 19713 1
386 . 1 1 35 35 SER HA H 1 4.784 0.020 . 1 . . . A 35 SER HA . 19713 1
387 . 1 1 35 35 SER HB2 H 1 3.870 0.020 . 2 . . . A 35 SER HB2 . 19713 1
388 . 1 1 35 35 SER HB3 H 1 3.629 0.020 . 2 . . . A 35 SER HB3 . 19713 1
389 . 1 1 35 35 SER CA C 13 57.693 0.400 . 1 . . . A 35 SER CA . 19713 1
390 . 1 1 35 35 SER CB C 13 64.218 0.400 . 1 . . . A 35 SER CB . 19713 1
391 . 1 1 35 35 SER N N 15 118.568 0.400 . 1 . . . A 35 SER N . 19713 1
392 . 1 1 36 36 ASP H H 1 8.909 0.020 . 1 . . . A 36 ASP H . 19713 1
393 . 1 1 36 36 ASP HA H 1 4.987 0.020 . 1 . . . A 36 ASP HA . 19713 1
394 . 1 1 36 36 ASP HB2 H 1 3.250 0.020 . 2 . . . A 36 ASP HB2 . 19713 1
395 . 1 1 36 36 ASP HB3 H 1 2.695 0.020 . 2 . . . A 36 ASP HB3 . 19713 1
396 . 1 1 36 36 ASP CA C 13 54.132 0.400 . 1 . . . A 36 ASP CA . 19713 1
397 . 1 1 36 36 ASP CB C 13 41.904 0.400 . 1 . . . A 36 ASP CB . 19713 1
398 . 1 1 36 36 ASP N N 15 127.988 0.400 . 1 . . . A 36 ASP N . 19713 1
399 . 1 1 37 37 VAL H H 1 8.691 0.020 . 1 . . . A 37 VAL H . 19713 1
400 . 1 1 37 37 VAL HA H 1 4.977 0.020 . 1 . . . A 37 VAL HA . 19713 1
401 . 1 1 37 37 VAL HB H 1 1.950 0.020 . 1 . . . A 37 VAL HB . 19713 1
402 . 1 1 37 37 VAL HG11 H 1 1.128 0.020 . 2 . . . A 37 VAL HG11 . 19713 1
403 . 1 1 37 37 VAL HG12 H 1 1.128 0.020 . 2 . . . A 37 VAL HG12 . 19713 1
404 . 1 1 37 37 VAL HG13 H 1 1.128 0.020 . 2 . . . A 37 VAL HG13 . 19713 1
405 . 1 1 37 37 VAL HG21 H 1 1.044 0.020 . 2 . . . A 37 VAL HG21 . 19713 1
406 . 1 1 37 37 VAL HG22 H 1 1.044 0.020 . 2 . . . A 37 VAL HG22 . 19713 1
407 . 1 1 37 37 VAL HG23 H 1 1.044 0.020 . 2 . . . A 37 VAL HG23 . 19713 1
408 . 1 1 37 37 VAL CA C 13 61.821 0.400 . 1 . . . A 37 VAL CA . 19713 1
409 . 1 1 37 37 VAL CB C 13 33.099 0.400 . 1 . . . A 37 VAL CB . 19713 1
410 . 1 1 37 37 VAL CG1 C 13 21.676 0.400 . 1 . . . A 37 VAL CG1 . 19713 1
411 . 1 1 37 37 VAL CG2 C 13 23.763 0.400 . 1 . . . A 37 VAL CG2 . 19713 1
412 . 1 1 37 37 VAL N N 15 122.751 0.400 . 1 . . . A 37 VAL N . 19713 1
413 . 1 1 38 38 TRP H H 1 9.644 0.020 . 1 . . . A 38 TRP H . 19713 1
414 . 1 1 38 38 TRP HA H 1 5.082 0.020 . 1 . . . A 38 TRP HA . 19713 1
415 . 1 1 38 38 TRP HB3 H 1 3.058 0.020 . 2 . . . A 38 TRP HB3 . 19713 1
416 . 1 1 38 38 TRP HD1 H 1 7.022 0.020 . 1 . . . A 38 TRP HD1 . 19713 1
417 . 1 1 38 38 TRP HE1 H 1 10.480 0.020 . 1 . . . A 38 TRP HE1 . 19713 1
418 . 1 1 38 38 TRP HZ2 H 1 7.512 0.020 . 1 . . . A 38 TRP HZ2 . 19713 1
419 . 1 1 38 38 TRP HZ3 H 1 6.915 0.020 . 1 . . . A 38 TRP HZ3 . 19713 1
420 . 1 1 38 38 TRP HH2 H 1 7.128 0.020 . 1 . . . A 38 TRP HH2 . 19713 1
421 . 1 1 38 38 TRP CA C 13 56.773 0.400 . 1 . . . A 38 TRP CA . 19713 1
422 . 1 1 38 38 TRP CB C 13 32.208 0.400 . 1 . . . A 38 TRP CB . 19713 1
423 . 1 1 38 38 TRP N N 15 128.913 0.400 . 1 . . . A 38 TRP N . 19713 1
424 . 1 1 38 38 TRP NE1 N 15 130.289 0.400 . 1 . . . A 38 TRP NE1 . 19713 1
425 . 1 1 39 39 LEU H H 1 9.378 0.020 . 1 . . . A 39 LEU H . 19713 1
426 . 1 1 39 39 LEU HA H 1 4.851 0.020 . 1 . . . A 39 LEU HA . 19713 1
427 . 1 1 39 39 LEU HB2 H 1 1.188 0.020 . 2 . . . A 39 LEU HB2 . 19713 1
428 . 1 1 39 39 LEU HB3 H 1 1.923 0.020 . 2 . . . A 39 LEU HB3 . 19713 1
429 . 1 1 39 39 LEU HG H 1 1.164 0.020 . 1 . . . A 39 LEU HG . 19713 1
430 . 1 1 39 39 LEU HD11 H 1 0.966 0.020 . 2 . . . A 39 LEU HD11 . 19713 1
431 . 1 1 39 39 LEU HD12 H 1 0.966 0.020 . 2 . . . A 39 LEU HD12 . 19713 1
432 . 1 1 39 39 LEU HD13 H 1 0.966 0.020 . 2 . . . A 39 LEU HD13 . 19713 1
433 . 1 1 39 39 LEU HD21 H 1 0.780 0.020 . 2 . . . A 39 LEU HD21 . 19713 1
434 . 1 1 39 39 LEU HD22 H 1 0.780 0.020 . 2 . . . A 39 LEU HD22 . 19713 1
435 . 1 1 39 39 LEU HD23 H 1 0.780 0.020 . 2 . . . A 39 LEU HD23 . 19713 1
436 . 1 1 39 39 LEU CA C 13 53.407 0.400 . 1 . . . A 39 LEU CA . 19713 1
437 . 1 1 39 39 LEU CB C 13 46.898 0.400 . 1 . . . A 39 LEU CB . 19713 1
438 . 1 1 39 39 LEU CG C 13 27.680 0.400 . 1 . . . A 39 LEU CG . 19713 1
439 . 1 1 39 39 LEU CD1 C 13 23.096 0.400 . 1 . . . A 39 LEU CD1 . 19713 1
440 . 1 1 39 39 LEU CD2 C 13 27.221 0.400 . 1 . . . A 39 LEU CD2 . 19713 1
441 . 1 1 39 39 LEU N N 15 122.523 0.400 . 1 . . . A 39 LEU N . 19713 1
442 . 1 1 40 40 ALA H H 1 8.806 0.020 . 1 . . . A 40 ALA H . 19713 1
443 . 1 1 40 40 ALA HA H 1 4.578 0.020 . 1 . . . A 40 ALA HA . 19713 1
444 . 1 1 40 40 ALA HB1 H 1 1.533 0.020 . 1 . . . A 40 ALA HB1 . 19713 1
445 . 1 1 40 40 ALA HB2 H 1 1.533 0.020 . 1 . . . A 40 ALA HB2 . 19713 1
446 . 1 1 40 40 ALA HB3 H 1 1.533 0.020 . 1 . . . A 40 ALA HB3 . 19713 1
447 . 1 1 40 40 ALA CA C 13 54.291 0.400 . 1 . . . A 40 ALA CA . 19713 1
448 . 1 1 40 40 ALA CB C 13 19.036 0.400 . 1 . . . A 40 ALA CB . 19713 1
449 . 1 1 40 40 ALA N N 15 129.759 0.400 . 1 . . . A 40 ALA N . 19713 1
450 . 1 1 41 41 ASP H H 1 7.774 0.020 . 1 . . . A 41 ASP H . 19713 1
451 . 1 1 41 41 ASP HA H 1 4.825 0.020 . 1 . . . A 41 ASP HA . 19713 1
452 . 1 1 41 41 ASP HB2 H 1 3.029 0.020 . 2 . . . A 41 ASP HB2 . 19713 1
453 . 1 1 41 41 ASP HB3 H 1 2.564 0.020 . 2 . . . A 41 ASP HB3 . 19713 1
454 . 1 1 41 41 ASP CA C 13 52.017 0.400 . 1 . . . A 41 ASP CA . 19713 1
455 . 1 1 41 41 ASP CB C 13 38.617 0.400 . 1 . . . A 41 ASP CB . 19713 1
456 . 1 1 41 41 ASP N N 15 115.611 0.400 . 1 . . . A 41 ASP N . 19713 1
457 . 1 1 42 42 GLU H H 1 8.508 0.020 . 1 . . . A 42 GLU H . 19713 1
458 . 1 1 42 42 GLU HA H 1 3.634 0.020 . 1 . . . A 42 GLU HA . 19713 1
459 . 1 1 42 42 GLU HB2 H 1 2.223 0.020 . 2 . . . A 42 GLU HB2 . 19713 1
460 . 1 1 42 42 GLU HB3 H 1 2.000 0.020 . 2 . . . A 42 GLU HB3 . 19713 1
461 . 1 1 42 42 GLU HG2 H 1 2.559 0.020 . 2 . . . A 42 GLU HG2 . 19713 1
462 . 1 1 42 42 GLU HG3 H 1 2.092 0.020 . 2 . . . A 42 GLU HG3 . 19713 1
463 . 1 1 42 42 GLU CA C 13 59.689 0.400 . 1 . . . A 42 GLU CA . 19713 1
464 . 1 1 42 42 GLU CB C 13 28.633 0.400 . 1 . . . A 42 GLU CB . 19713 1
465 . 1 1 42 42 GLU CG C 13 37.398 0.400 . 1 . . . A 42 GLU CG . 19713 1
466 . 1 1 42 42 GLU N N 15 123.031 0.400 . 1 . . . A 42 GLU N . 19713 1
467 . 1 1 43 43 SER H H 1 8.325 0.020 . 1 . . . A 43 SER H . 19713 1
468 . 1 1 43 43 SER HA H 1 4.373 0.020 . 1 . . . A 43 SER HA . 19713 1
469 . 1 1 43 43 SER HB2 H 1 4.043 0.020 . 2 . . . A 43 SER HB2 . 19713 1
470 . 1 1 43 43 SER CA C 13 61.171 0.400 . 1 . . . A 43 SER CA . 19713 1
471 . 1 1 43 43 SER CB C 13 62.526 0.400 . 1 . . . A 43 SER CB . 19713 1
472 . 1 1 43 43 SER N N 15 116.358 0.400 . 1 . . . A 43 SER N . 19713 1
473 . 1 1 44 44 GLN H H 1 7.741 0.020 . 1 . . . A 44 GLN H . 19713 1
474 . 1 1 44 44 GLN HA H 1 4.662 0.020 . 1 . . . A 44 GLN HA . 19713 1
475 . 1 1 44 44 GLN HB2 H 1 2.443 0.020 . 2 . . . A 44 GLN HB2 . 19713 1
476 . 1 1 44 44 GLN HB3 H 1 1.980 0.020 . 2 . . . A 44 GLN HB3 . 19713 1
477 . 1 1 44 44 GLN HG2 H 1 2.432 0.020 . 2 . . . A 44 GLN HG2 . 19713 1
478 . 1 1 44 44 GLN HG3 H 1 2.268 0.020 . 2 . . . A 44 GLN HG3 . 19713 1
479 . 1 1 44 44 GLN HE21 H 1 7.354 0.020 . 2 . . . A 44 GLN HE21 . 19713 1
480 . 1 1 44 44 GLN HE22 H 1 6.633 0.020 . 2 . . . A 44 GLN HE22 . 19713 1
481 . 1 1 44 44 GLN CA C 13 54.473 0.400 . 1 . . . A 44 GLN CA . 19713 1
482 . 1 1 44 44 GLN CB C 13 28.135 0.400 . 1 . . . A 44 GLN CB . 19713 1
483 . 1 1 44 44 GLN CG C 13 32.883 0.400 . 1 . . . A 44 GLN CG . 19713 1
484 . 1 1 44 44 GLN N N 15 118.846 0.400 . 1 . . . A 44 GLN N . 19713 1
485 . 1 1 44 44 GLN NE2 N 15 111.996 0.400 . 1 . . . A 44 GLN NE2 . 19713 1
486 . 1 1 45 45 ALA H H 1 7.567 0.020 . 1 . . . A 45 ALA H . 19713 1
487 . 1 1 45 45 ALA HA H 1 3.550 0.020 . 1 . . . A 45 ALA HA . 19713 1
488 . 1 1 45 45 ALA HB1 H 1 1.417 0.020 . 1 . . . A 45 ALA HB1 . 19713 1
489 . 1 1 45 45 ALA HB2 H 1 1.417 0.020 . 1 . . . A 45 ALA HB2 . 19713 1
490 . 1 1 45 45 ALA HB3 H 1 1.417 0.020 . 1 . . . A 45 ALA HB3 . 19713 1
491 . 1 1 45 45 ALA CA C 13 56.963 0.400 . 1 . . . A 45 ALA CA . 19713 1
492 . 1 1 45 45 ALA CB C 13 18.797 0.400 . 1 . . . A 45 ALA CB . 19713 1
493 . 1 1 45 45 ALA N N 15 122.785 0.400 . 1 . . . A 45 ALA N . 19713 1
494 . 1 1 46 46 GLU H H 1 8.686 0.020 . 1 . . . A 46 GLU H . 19713 1
495 . 1 1 46 46 GLU HA H 1 4.032 0.020 . 1 . . . A 46 GLU HA . 19713 1
496 . 1 1 46 46 GLU HB3 H 1 2.080 0.020 . 2 . . . A 46 GLU HB3 . 19713 1
497 . 1 1 46 46 GLU HG2 H 1 2.372 0.020 . 2 . . . A 46 GLU HG2 . 19713 1
498 . 1 1 46 46 GLU HG3 H 1 2.299 0.020 . 2 . . . A 46 GLU HG3 . 19713 1
499 . 1 1 46 46 GLU CA C 13 59.820 0.400 . 1 . . . A 46 GLU CA . 19713 1
500 . 1 1 46 46 GLU CB C 13 28.688 0.400 . 1 . . . A 46 GLU CB . 19713 1
501 . 1 1 46 46 GLU CG C 13 36.525 0.400 . 1 . . . A 46 GLU CG . 19713 1
502 . 1 1 46 46 GLU N N 15 116.794 0.400 . 1 . . . A 46 GLU N . 19713 1
503 . 1 1 47 47 ARG H H 1 8.042 0.020 . 1 . . . A 47 ARG H . 19713 1
504 . 1 1 47 47 ARG HA H 1 4.245 0.020 . 1 . . . A 47 ARG HA . 19713 1
505 . 1 1 47 47 ARG HB2 H 1 2.010 0.020 . 2 . . . A 47 ARG HB2 . 19713 1
506 . 1 1 47 47 ARG HG2 H 1 1.831 0.020 . 2 . . . A 47 ARG HG2 . 19713 1
507 . 1 1 47 47 ARG HG3 H 1 1.689 0.020 . 2 . . . A 47 ARG HG3 . 19713 1
508 . 1 1 47 47 ARG HD2 H 1 3.295 0.020 . 2 . . . A 47 ARG HD2 . 19713 1
509 . 1 1 47 47 ARG HD3 H 1 3.208 0.020 . 2 . . . A 47 ARG HD3 . 19713 1
510 . 1 1 47 47 ARG CA C 13 58.813 0.400 . 1 . . . A 47 ARG CA . 19713 1
511 . 1 1 47 47 ARG CB C 13 30.066 0.400 . 1 . . . A 47 ARG CB . 19713 1
512 . 1 1 47 47 ARG CG C 13 27.492 0.400 . 1 . . . A 47 ARG CG . 19713 1
513 . 1 1 47 47 ARG CD C 13 43.709 0.400 . 1 . . . A 47 ARG CD . 19713 1
514 . 1 1 47 47 ARG N N 15 122.101 0.400 . 1 . . . A 47 ARG N . 19713 1
515 . 1 1 48 48 VAL H H 1 8.466 0.020 . 1 . . . A 48 VAL H . 19713 1
516 . 1 1 48 48 VAL HA H 1 3.650 0.020 . 1 . . . A 48 VAL HA . 19713 1
517 . 1 1 48 48 VAL HB H 1 2.235 0.020 . 1 . . . A 48 VAL HB . 19713 1
518 . 1 1 48 48 VAL HG11 H 1 1.173 0.020 . 2 . . . A 48 VAL HG11 . 19713 1
519 . 1 1 48 48 VAL HG12 H 1 1.173 0.020 . 2 . . . A 48 VAL HG12 . 19713 1
520 . 1 1 48 48 VAL HG13 H 1 1.173 0.020 . 2 . . . A 48 VAL HG13 . 19713 1
521 . 1 1 48 48 VAL HG21 H 1 1.168 0.020 . 2 . . . A 48 VAL HG21 . 19713 1
522 . 1 1 48 48 VAL HG22 H 1 1.168 0.020 . 2 . . . A 48 VAL HG22 . 19713 1
523 . 1 1 48 48 VAL HG23 H 1 1.168 0.020 . 2 . . . A 48 VAL HG23 . 19713 1
524 . 1 1 48 48 VAL CA C 13 66.962 0.400 . 1 . . . A 48 VAL CA . 19713 1
525 . 1 1 48 48 VAL CB C 13 31.254 0.400 . 1 . . . A 48 VAL CB . 19713 1
526 . 1 1 48 48 VAL CG1 C 13 23.856 0.400 . 1 . . . A 48 VAL CG1 . 19713 1
527 . 1 1 48 48 VAL CG2 C 13 25.576 0.400 . 1 . . . A 48 VAL CG2 . 19713 1
528 . 1 1 48 48 VAL N N 15 118.395 0.400 . 1 . . . A 48 VAL N . 19713 1
529 . 1 1 49 49 ARG H H 1 8.604 0.020 . 1 . . . A 49 ARG H . 19713 1
530 . 1 1 49 49 ARG HA H 1 3.871 0.020 . 1 . . . A 49 ARG HA . 19713 1
531 . 1 1 49 49 ARG HB3 H 1 1.918 0.020 . 2 . . . A 49 ARG HB3 . 19713 1
532 . 1 1 49 49 ARG HG2 H 1 1.585 0.020 . 2 . . . A 49 ARG HG2 . 19713 1
533 . 1 1 49 49 ARG HD2 H 1 3.119 0.020 . 2 . . . A 49 ARG HD2 . 19713 1
534 . 1 1 49 49 ARG HD3 H 1 3.216 0.020 . 2 . . . A 49 ARG HD3 . 19713 1
535 . 1 1 49 49 ARG CA C 13 60.756 0.400 . 1 . . . A 49 ARG CA . 19713 1
536 . 1 1 49 49 ARG CB C 13 29.559 0.400 . 1 . . . A 49 ARG CB . 19713 1
537 . 1 1 49 49 ARG CG C 13 29.443 0.400 . 1 . . . A 49 ARG CG . 19713 1
538 . 1 1 49 49 ARG CD C 13 43.157 0.400 . 1 . . . A 49 ARG CD . 19713 1
539 . 1 1 49 49 ARG N N 15 119.126 0.400 . 1 . . . A 49 ARG N . 19713 1
540 . 1 1 50 50 ALA H H 1 8.081 0.020 . 1 . . . A 50 ALA H . 19713 1
541 . 1 1 50 50 ALA HA H 1 4.274 0.020 . 1 . . . A 50 ALA HA . 19713 1
542 . 1 1 50 50 ALA HB1 H 1 1.623 0.020 . 1 . . . A 50 ALA HB1 . 19713 1
543 . 1 1 50 50 ALA HB2 H 1 1.623 0.020 . 1 . . . A 50 ALA HB2 . 19713 1
544 . 1 1 50 50 ALA HB3 H 1 1.623 0.020 . 1 . . . A 50 ALA HB3 . 19713 1
545 . 1 1 50 50 ALA CA C 13 55.122 0.400 . 1 . . . A 50 ALA CA . 19713 1
546 . 1 1 50 50 ALA CB C 13 18.008 0.400 . 1 . . . A 50 ALA CB . 19713 1
547 . 1 1 50 50 ALA N N 15 123.287 0.400 . 1 . . . A 50 ALA N . 19713 1
548 . 1 1 51 51 GLU H H 1 8.386 0.020 . 1 . . . A 51 GLU H . 19713 1
549 . 1 1 51 51 GLU HA H 1 4.449 0.020 . 1 . . . A 51 GLU HA . 19713 1
550 . 1 1 51 51 GLU HB2 H 1 2.601 0.020 . 2 . . . A 51 GLU HB2 . 19713 1
551 . 1 1 51 51 GLU HB3 H 1 2.429 0.020 . 2 . . . A 51 GLU HB3 . 19713 1
552 . 1 1 51 51 GLU HG2 H 1 2.374 0.020 . 2 . . . A 51 GLU HG2 . 19713 1
553 . 1 1 51 51 GLU HG3 H 1 2.720 0.020 . 2 . . . A 51 GLU HG3 . 19713 1
554 . 1 1 51 51 GLU CA C 13 58.341 0.400 . 1 . . . A 51 GLU CA . 19713 1
555 . 1 1 51 51 GLU CB C 13 30.118 0.400 . 1 . . . A 51 GLU CB . 19713 1
556 . 1 1 51 51 GLU CG C 13 36.126 0.400 . 1 . . . A 51 GLU CG . 19713 1
557 . 1 1 51 51 GLU N N 15 118.576 0.400 . 1 . . . A 51 GLU N . 19713 1
558 . 1 1 52 52 LEU H H 1 8.976 0.020 . 1 . . . A 52 LEU H . 19713 1
559 . 1 1 52 52 LEU HA H 1 3.938 0.020 . 1 . . . A 52 LEU HA . 19713 1
560 . 1 1 52 52 LEU HB2 H 1 1.995 0.020 . 2 . . . A 52 LEU HB2 . 19713 1
561 . 1 1 52 52 LEU HB3 H 1 1.352 0.020 . 2 . . . A 52 LEU HB3 . 19713 1
562 . 1 1 52 52 LEU HG H 1 1.437 0.020 . 1 . . . A 52 LEU HG . 19713 1
563 . 1 1 52 52 LEU HD11 H 1 0.214 0.020 . 2 . . . A 52 LEU HD11 . 19713 1
564 . 1 1 52 52 LEU HD12 H 1 0.214 0.020 . 2 . . . A 52 LEU HD12 . 19713 1
565 . 1 1 52 52 LEU HD13 H 1 0.214 0.020 . 2 . . . A 52 LEU HD13 . 19713 1
566 . 1 1 52 52 LEU HD21 H 1 0.612 0.020 . 2 . . . A 52 LEU HD21 . 19713 1
567 . 1 1 52 52 LEU HD22 H 1 0.612 0.020 . 2 . . . A 52 LEU HD22 . 19713 1
568 . 1 1 52 52 LEU HD23 H 1 0.612 0.020 . 2 . . . A 52 LEU HD23 . 19713 1
569 . 1 1 52 52 LEU CA C 13 57.745 0.400 . 1 . . . A 52 LEU CA . 19713 1
570 . 1 1 52 52 LEU CB C 13 41.243 0.400 . 1 . . . A 52 LEU CB . 19713 1
571 . 1 1 52 52 LEU CG C 13 26.279 0.400 . 1 . . . A 52 LEU CG . 19713 1
572 . 1 1 52 52 LEU CD1 C 13 21.949 0.400 . 1 . . . A 52 LEU CD1 . 19713 1
573 . 1 1 52 52 LEU CD2 C 13 26.008 0.400 . 1 . . . A 52 LEU CD2 . 19713 1
574 . 1 1 52 52 LEU N N 15 122.397 0.400 . 1 . . . A 52 LEU N . 19713 1
575 . 1 1 53 53 ALA H H 1 7.418 0.020 . 1 . . . A 53 ALA H . 19713 1
576 . 1 1 53 53 ALA HA H 1 4.054 0.020 . 1 . . . A 53 ALA HA . 19713 1
577 . 1 1 53 53 ALA HB1 H 1 1.508 0.020 . 1 . . . A 53 ALA HB1 . 19713 1
578 . 1 1 53 53 ALA HB2 H 1 1.508 0.020 . 1 . . . A 53 ALA HB2 . 19713 1
579 . 1 1 53 53 ALA HB3 H 1 1.508 0.020 . 1 . . . A 53 ALA HB3 . 19713 1
580 . 1 1 53 53 ALA CA C 13 55.094 0.400 . 1 . . . A 53 ALA CA . 19713 1
581 . 1 1 53 53 ALA CB C 13 17.597 0.400 . 1 . . . A 53 ALA CB . 19713 1
582 . 1 1 53 53 ALA N N 15 119.025 0.400 . 1 . . . A 53 ALA N . 19713 1
583 . 1 1 54 54 ARG H H 1 7.316 0.020 . 1 . . . A 54 ARG H . 19713 1
584 . 1 1 54 54 ARG HA H 1 4.136 0.020 . 1 . . . A 54 ARG HA . 19713 1
585 . 1 1 54 54 ARG HB2 H 1 2.012 0.020 . 2 . . . A 54 ARG HB2 . 19713 1
586 . 1 1 54 54 ARG HG2 H 1 1.869 0.020 . 2 . . . A 54 ARG HG2 . 19713 1
587 . 1 1 54 54 ARG HG3 H 1 1.888 0.020 . 2 . . . A 54 ARG HG3 . 19713 1
588 . 1 1 54 54 ARG HD2 H 1 3.276 0.020 . 2 . . . A 54 ARG HD2 . 19713 1
589 . 1 1 54 54 ARG CA C 13 58.686 0.400 . 1 . . . A 54 ARG CA . 19713 1
590 . 1 1 54 54 ARG CB C 13 30.440 0.400 . 1 . . . A 54 ARG CB . 19713 1
591 . 1 1 54 54 ARG CG C 13 26.932 0.400 . 1 . . . A 54 ARG CG . 19713 1
592 . 1 1 54 54 ARG CD C 13 43.249 0.400 . 1 . . . A 54 ARG CD . 19713 1
593 . 1 1 54 54 ARG N N 15 116.311 0.400 . 1 . . . A 54 ARG N . 19713 1
594 . 1 1 55 55 PHE H H 1 8.729 0.020 . 1 . . . A 55 PHE H . 19713 1
595 . 1 1 55 55 PHE HA H 1 4.033 0.020 . 1 . . . A 55 PHE HA . 19713 1
596 . 1 1 55 55 PHE HB2 H 1 3.305 0.020 . 2 . . . A 55 PHE HB2 . 19713 1
597 . 1 1 55 55 PHE HB3 H 1 3.219 0.020 . 2 . . . A 55 PHE HB3 . 19713 1
598 . 1 1 55 55 PHE HD1 H 1 6.938 0.020 . 1 . . . A 55 PHE HD1 . 19713 1
599 . 1 1 55 55 PHE HD2 H 1 6.938 0.020 . 1 . . . A 55 PHE HD2 . 19713 1
600 . 1 1 55 55 PHE HE1 H 1 6.913 0.020 . 1 . . . A 55 PHE HE1 . 19713 1
601 . 1 1 55 55 PHE HE2 H 1 6.913 0.020 . 1 . . . A 55 PHE HE2 . 19713 1
602 . 1 1 55 55 PHE HZ H 1 7.077 0.020 . 1 . . . A 55 PHE HZ . 19713 1
603 . 1 1 55 55 PHE CA C 13 60.786 0.400 . 1 . . . A 55 PHE CA . 19713 1
604 . 1 1 55 55 PHE CB C 13 40.056 0.400 . 1 . . . A 55 PHE CB . 19713 1
605 . 1 1 55 55 PHE N N 15 122.048 0.400 . 1 . . . A 55 PHE N . 19713 1
606 . 1 1 56 56 LEU H H 1 8.133 0.020 . 1 . . . A 56 LEU H . 19713 1
607 . 1 1 56 56 LEU HA H 1 4.043 0.020 . 1 . . . A 56 LEU HA . 19713 1
608 . 1 1 56 56 LEU HB2 H 1 1.808 0.020 . 2 . . . A 56 LEU HB2 . 19713 1
609 . 1 1 56 56 LEU HG H 1 1.956 0.020 . 1 . . . A 56 LEU HG . 19713 1
610 . 1 1 56 56 LEU HD11 H 1 0.964 0.020 . 2 . . . A 56 LEU HD11 . 19713 1
611 . 1 1 56 56 LEU HD12 H 1 0.964 0.020 . 2 . . . A 56 LEU HD12 . 19713 1
612 . 1 1 56 56 LEU HD13 H 1 0.964 0.020 . 2 . . . A 56 LEU HD13 . 19713 1
613 . 1 1 56 56 LEU HD21 H 1 0.839 0.020 . 2 . . . A 56 LEU HD21 . 19713 1
614 . 1 1 56 56 LEU HD22 H 1 0.839 0.020 . 2 . . . A 56 LEU HD22 . 19713 1
615 . 1 1 56 56 LEU HD23 H 1 0.839 0.020 . 2 . . . A 56 LEU HD23 . 19713 1
616 . 1 1 56 56 LEU CA C 13 55.717 0.400 . 1 . . . A 56 LEU CA . 19713 1
617 . 1 1 56 56 LEU CB C 13 42.035 0.400 . 1 . . . A 56 LEU CB . 19713 1
618 . 1 1 56 56 LEU CG C 13 26.578 0.400 . 1 . . . A 56 LEU CG . 19713 1
619 . 1 1 56 56 LEU CD1 C 13 22.170 0.400 . 1 . . . A 56 LEU CD1 . 19713 1
620 . 1 1 56 56 LEU CD2 C 13 25.568 0.400 . 1 . . . A 56 LEU CD2 . 19713 1
621 . 1 1 56 56 LEU N N 15 116.538 0.400 . 1 . . . A 56 LEU N . 19713 1
622 . 1 1 57 57 GLU H H 1 7.479 0.020 . 1 . . . A 57 GLU H . 19713 1
623 . 1 1 57 57 GLU HA H 1 4.104 0.020 . 1 . . . A 57 GLU HA . 19713 1
624 . 1 1 57 57 GLU HB2 H 1 2.070 0.020 . 2 . . . A 57 GLU HB2 . 19713 1
625 . 1 1 57 57 GLU HG2 H 1 2.433 0.020 . 2 . . . A 57 GLU HG2 . 19713 1
626 . 1 1 57 57 GLU HG3 H 1 2.269 0.020 . 2 . . . A 57 GLU HG3 . 19713 1
627 . 1 1 57 57 GLU CA C 13 57.554 0.400 . 1 . . . A 57 GLU CA . 19713 1
628 . 1 1 57 57 GLU CB C 13 30.026 0.400 . 1 . . . A 57 GLU CB . 19713 1
629 . 1 1 57 57 GLU CG C 13 36.274 0.400 . 1 . . . A 57 GLU CG . 19713 1
630 . 1 1 57 57 GLU N N 15 118.454 0.400 . 1 . . . A 57 GLU N . 19713 1
631 . 1 1 58 58 ASN H H 1 7.722 0.020 . 1 . . . A 58 ASN H . 19713 1
632 . 1 1 58 58 ASN HA H 1 4.906 0.020 . 1 . . . A 58 ASN HA . 19713 1
633 . 1 1 58 58 ASN HB2 H 1 2.841 0.020 . 2 . . . A 58 ASN HB2 . 19713 1
634 . 1 1 58 58 ASN HB3 H 1 2.676 0.020 . 2 . . . A 58 ASN HB3 . 19713 1
635 . 1 1 58 58 ASN HD21 H 1 7.548 0.020 . 2 . . . A 58 ASN HD21 . 19713 1
636 . 1 1 58 58 ASN HD22 H 1 6.871 0.020 . 2 . . . A 58 ASN HD22 . 19713 1
637 . 1 1 58 58 ASN CA C 13 51.164 0.400 . 1 . . . A 58 ASN CA . 19713 1
638 . 1 1 58 58 ASN CB C 13 38.811 0.400 . 1 . . . A 58 ASN CB . 19713 1
639 . 1 1 58 58 ASN N N 15 116.134 0.400 . 1 . . . A 58 ASN N . 19713 1
640 . 1 1 58 58 ASN ND2 N 15 113.430 0.400 . 1 . . . A 58 ASN ND2 . 19713 1
641 . 1 1 59 59 PRO HA H 1 4.090 0.020 . 1 . . . A 59 PRO HA . 19713 1
642 . 1 1 59 59 PRO HB2 H 1 2.014 0.020 . 2 . . . A 59 PRO HB2 . 19713 1
643 . 1 1 59 59 PRO HB3 H 1 1.838 0.020 . 2 . . . A 59 PRO HB3 . 19713 1
644 . 1 1 59 59 PRO HG2 H 1 1.895 0.020 . 2 . . . A 59 PRO HG2 . 19713 1
645 . 1 1 59 59 PRO HG3 H 1 1.787 0.020 . 2 . . . A 59 PRO HG3 . 19713 1
646 . 1 1 59 59 PRO HD2 H 1 3.636 0.020 . 2 . . . A 59 PRO HD2 . 19713 1
647 . 1 1 59 59 PRO CA C 13 63.883 0.400 . 1 . . . A 59 PRO CA . 19713 1
648 . 1 1 59 59 PRO CB C 13 31.856 0.400 . 1 . . . A 59 PRO CB . 19713 1
649 . 1 1 59 59 PRO CG C 13 27.149 0.400 . 1 . . . A 59 PRO CG . 19713 1
650 . 1 1 59 59 PRO CD C 13 50.407 0.400 . 1 . . . A 59 PRO CD . 19713 1
651 . 1 1 60 60 ALA H H 1 7.995 0.020 . 1 . . . A 60 ALA H . 19713 1
652 . 1 1 60 60 ALA HA H 1 4.196 0.020 . 1 . . . A 60 ALA HA . 19713 1
653 . 1 1 60 60 ALA HB1 H 1 1.344 0.020 . 1 . . . A 60 ALA HB1 . 19713 1
654 . 1 1 60 60 ALA HB2 H 1 1.344 0.020 . 1 . . . A 60 ALA HB2 . 19713 1
655 . 1 1 60 60 ALA HB3 H 1 1.344 0.020 . 1 . . . A 60 ALA HB3 . 19713 1
656 . 1 1 60 60 ALA CA C 13 52.877 0.400 . 1 . . . A 60 ALA CA . 19713 1
657 . 1 1 60 60 ALA CB C 13 18.898 0.400 . 1 . . . A 60 ALA CB . 19713 1
658 . 1 1 60 60 ALA N N 15 123.290 0.400 . 1 . . . A 60 ALA N . 19713 1
659 . 1 1 61 61 ASP H H 1 7.985 0.020 . 1 . . . A 61 ASP H . 19713 1
660 . 1 1 61 61 ASP HA H 1 4.575 0.020 . 1 . . . A 61 ASP HA . 19713 1
661 . 1 1 61 61 ASP HB2 H 1 2.599 0.020 . 2 . . . A 61 ASP HB2 . 19713 1
662 . 1 1 61 61 ASP HB3 H 1 2.718 0.020 . 2 . . . A 61 ASP HB3 . 19713 1
663 . 1 1 61 61 ASP CA C 13 54.274 0.400 . 1 . . . A 61 ASP CA . 19713 1
664 . 1 1 61 61 ASP CB C 13 40.887 0.400 . 1 . . . A 61 ASP CB . 19713 1
665 . 1 1 61 61 ASP N N 15 118.409 0.400 . 1 . . . A 61 ASP N . 19713 1
666 . 1 1 62 62 LEU H H 1 7.921 0.020 . 1 . . . A 62 LEU H . 19713 1
667 . 1 1 62 62 LEU HA H 1 4.170 0.020 . 1 . . . A 62 LEU HA . 19713 1
668 . 1 1 62 62 LEU HB2 H 1 1.600 0.020 . 2 . . . A 62 LEU HB2 . 19713 1
669 . 1 1 62 62 LEU HB3 H 1 1.520 0.020 . 2 . . . A 62 LEU HB3 . 19713 1
670 . 1 1 62 62 LEU HG H 1 1.554 0.020 . 1 . . . A 62 LEU HG . 19713 1
671 . 1 1 62 62 LEU HD11 H 1 0.749 0.020 . 2 . . . A 62 LEU HD11 . 19713 1
672 . 1 1 62 62 LEU HD12 H 1 0.749 0.020 . 2 . . . A 62 LEU HD12 . 19713 1
673 . 1 1 62 62 LEU HD13 H 1 0.749 0.020 . 2 . . . A 62 LEU HD13 . 19713 1
674 . 1 1 62 62 LEU HD21 H 1 0.810 0.020 . 2 . . . A 62 LEU HD21 . 19713 1
675 . 1 1 62 62 LEU HD22 H 1 0.810 0.020 . 2 . . . A 62 LEU HD22 . 19713 1
676 . 1 1 62 62 LEU HD23 H 1 0.810 0.020 . 2 . . . A 62 LEU HD23 . 19713 1
677 . 1 1 62 62 LEU CA C 13 55.673 0.400 . 1 . . . A 62 LEU CA . 19713 1
678 . 1 1 62 62 LEU CB C 13 41.992 0.400 . 1 . . . A 62 LEU CB . 19713 1
679 . 1 1 62 62 LEU CG C 13 27.162 0.400 . 1 . . . A 62 LEU CG . 19713 1
680 . 1 1 62 62 LEU CD1 C 13 23.373 0.400 . 1 . . . A 62 LEU CD1 . 19713 1
681 . 1 1 62 62 LEU CD2 C 13 25.106 0.400 . 1 . . . A 62 LEU CD2 . 19713 1
682 . 1 1 62 62 LEU N N 15 121.754 0.400 . 1 . . . A 62 LEU N . 19713 1
683 . 1 1 63 63 GLU H H 1 8.071 0.020 . 1 . . . A 63 GLU H . 19713 1
684 . 1 1 63 63 GLU HA H 1 4.132 0.020 . 1 . . . A 63 GLU HA . 19713 1
685 . 1 1 63 63 GLU HB2 H 1 1.884 0.020 . 2 . . . A 63 GLU HB2 . 19713 1
686 . 1 1 63 63 GLU HG2 H 1 2.197 0.020 . 2 . . . A 63 GLU HG2 . 19713 1
687 . 1 1 63 63 GLU HG3 H 1 2.110 0.020 . 2 . . . A 63 GLU HG3 . 19713 1
688 . 1 1 63 63 GLU CA C 13 56.838 0.400 . 1 . . . A 63 GLU CA . 19713 1
689 . 1 1 63 63 GLU CB C 13 29.969 0.400 . 1 . . . A 63 GLU CB . 19713 1
690 . 1 1 63 63 GLU CG C 13 36.188 0.400 . 1 . . . A 63 GLU CG . 19713 1
691 . 1 1 63 63 GLU N N 15 118.919 0.400 . 1 . . . A 63 GLU N . 19713 1
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