###################################
# 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 34868
_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' . . . 34868 1
2 '3D HNCO' . . . 34868 1
3 '3D HNCA' . . . 34868 1
4 '3D CBCA(CO)NH' . . . 34868 1
5 '3D HNCACB' . . . 34868 1
6 '3D H(CCO)NH' . . . 34868 1
7 '3D C(CO)NH' . . . 34868 1
8 '3D HCCH-TOCSY' . . . 34868 1
9 '3D HBHA(CO)NH' . . . 34868 1
10 '3D 1H-15N NOESY' . . . 34868 1
11 '2D 1H-13C HSQC' . . . 34868 1
12 '2D hbcbcgcdhdgp' . . . 34868 1
13 '2D hbcbcgcdcehegp' . . . 34868 1
14 '2D 1H-13C HSQC' . . . 34868 1
15 '3D 1H-13C NOESY' . . . 34868 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 MET HA H 1 4.469 0.002 . 1 . . . . A -1 MET HA . 34868 1
2 . 1 . 1 3 3 MET HB2 H 1 2.073 0.013 . 2 . . . . A -1 MET HB2 . 34868 1
3 . 1 . 1 3 3 MET HB3 H 1 2.053 0.016 . 2 . . . . A -1 MET HB3 . 34868 1
4 . 1 . 1 3 3 MET HG2 H 1 2.609 0.003 . 1 . . . . A -1 MET HG2 . 34868 1
5 . 1 . 1 3 3 MET HG3 H 1 2.609 0.003 . 1 . . . . A -1 MET HG3 . 34868 1
6 . 1 . 1 3 3 MET C C 13 176.008 0.000 . 1 . . . . A -1 MET C . 34868 1
7 . 1 . 1 3 3 MET CA C 13 55.493 0.040 . 1 . . . . A -1 MET CA . 34868 1
8 . 1 . 1 3 3 MET CB C 13 33.054 0.027 . 1 . . . . A -1 MET CB . 34868 1
9 . 1 . 1 3 3 MET CG C 13 32.048 0.050 . 1 . . . . A -1 MET CG . 34868 1
10 . 1 . 1 4 4 ALA H H 1 8.338 0.015 . 1 . . . . A 0 ALA H . 34868 1
11 . 1 . 1 4 4 ALA HA H 1 4.375 0.006 . 1 . . . . A 0 ALA HA . 34868 1
12 . 1 . 1 4 4 ALA HB1 H 1 1.408 0.013 . 1 . . . . A 0 ALA HB1 . 34868 1
13 . 1 . 1 4 4 ALA HB2 H 1 1.408 0.013 . 1 . . . . A 0 ALA HB2 . 34868 1
14 . 1 . 1 4 4 ALA HB3 H 1 1.408 0.013 . 1 . . . . A 0 ALA HB3 . 34868 1
15 . 1 . 1 4 4 ALA C C 13 177.746 0.000 . 1 . . . . A 0 ALA C . 34868 1
16 . 1 . 1 4 4 ALA CA C 13 52.682 0.032 . 1 . . . . A 0 ALA CA . 34868 1
17 . 1 . 1 4 4 ALA CB C 13 19.313 0.059 . 1 . . . . A 0 ALA CB . 34868 1
18 . 1 . 1 4 4 ALA N N 15 125.578 0.022 . 1 . . . . A 0 ALA N . 34868 1
19 . 1 . 1 5 5 THR H H 1 8.017 0.015 . 1 . . . . A 1 THR H . 34868 1
20 . 1 . 1 5 5 THR HA H 1 4.295 0.020 . 1 . . . . A 1 THR HA . 34868 1
21 . 1 . 1 5 5 THR HB H 1 4.214 0.012 . 1 . . . . A 1 THR HB . 34868 1
22 . 1 . 1 5 5 THR HG21 H 1 1.210 0.001 . 1 . . . . A 1 THR HG21 . 34868 1
23 . 1 . 1 5 5 THR HG22 H 1 1.210 0.001 . 1 . . . . A 1 THR HG22 . 34868 1
24 . 1 . 1 5 5 THR HG23 H 1 1.210 0.001 . 1 . . . . A 1 THR HG23 . 34868 1
25 . 1 . 1 5 5 THR C C 13 174.168 0.000 . 1 . . . . A 1 THR C . 34868 1
26 . 1 . 1 5 5 THR CA C 13 61.726 0.038 . 1 . . . . A 1 THR CA . 34868 1
27 . 1 . 1 5 5 THR CB C 13 69.837 0.024 . 1 . . . . A 1 THR CB . 34868 1
28 . 1 . 1 5 5 THR CG2 C 13 21.700 0.025 . 1 . . . . A 1 THR CG2 . 34868 1
29 . 1 . 1 5 5 THR N N 15 113.075 0.031 . 1 . . . . A 1 THR N . 34868 1
30 . 1 . 1 6 6 ALA H H 1 8.203 0.016 . 1 . . . . A 2 ALA H . 34868 1
31 . 1 . 1 6 6 ALA HA H 1 4.377 0.004 . 1 . . . . A 2 ALA HA . 34868 1
32 . 1 . 1 6 6 ALA HB1 H 1 1.389 0.004 . 1 . . . . A 2 ALA HB1 . 34868 1
33 . 1 . 1 6 6 ALA HB2 H 1 1.389 0.004 . 1 . . . . A 2 ALA HB2 . 34868 1
34 . 1 . 1 6 6 ALA HB3 H 1 1.389 0.004 . 1 . . . . A 2 ALA HB3 . 34868 1
35 . 1 . 1 6 6 ALA C C 13 177.422 0.000 . 1 . . . . A 2 ALA C . 34868 1
36 . 1 . 1 6 6 ALA CA C 13 52.483 0.048 . 1 . . . . A 2 ALA CA . 34868 1
37 . 1 . 1 6 6 ALA CB C 13 19.430 0.027 . 1 . . . . A 2 ALA CB . 34868 1
38 . 1 . 1 6 6 ALA N N 15 126.357 0.026 . 1 . . . . A 2 ALA N . 34868 1
39 . 1 . 1 7 7 VAL H H 1 8.024 0.014 . 1 . . . . A 3 VAL H . 34868 1
40 . 1 . 1 7 7 VAL HA H 1 4.106 0.005 . 1 . . . . A 3 VAL HA . 34868 1
41 . 1 . 1 7 7 VAL HB H 1 2.068 0.007 . 1 . . . . A 3 VAL HB . 34868 1
42 . 1 . 1 7 7 VAL HG11 H 1 0.933 0.002 . 2 . . . . A 3 VAL HG11 . 34868 1
43 . 1 . 1 7 7 VAL HG12 H 1 0.933 0.002 . 2 . . . . A 3 VAL HG12 . 34868 1
44 . 1 . 1 7 7 VAL HG13 H 1 0.933 0.002 . 2 . . . . A 3 VAL HG13 . 34868 1
45 . 1 . 1 7 7 VAL HG21 H 1 0.931 0.002 . 2 . . . . A 3 VAL HG21 . 34868 1
46 . 1 . 1 7 7 VAL HG22 H 1 0.931 0.002 . 2 . . . . A 3 VAL HG22 . 34868 1
47 . 1 . 1 7 7 VAL HG23 H 1 0.931 0.002 . 2 . . . . A 3 VAL HG23 . 34868 1
48 . 1 . 1 7 7 VAL C C 13 176.008 0.000 . 1 . . . . A 3 VAL C . 34868 1
49 . 1 . 1 7 7 VAL CA C 13 62.106 0.026 . 1 . . . . A 3 VAL CA . 34868 1
50 . 1 . 1 7 7 VAL CB C 13 32.817 0.053 . 1 . . . . A 3 VAL CB . 34868 1
51 . 1 . 1 7 7 VAL CG1 C 13 20.563 0.016 . 2 . . . . A 3 VAL CG1 . 34868 1
52 . 1 . 1 7 7 VAL CG2 C 13 21.295 0.064 . 2 . . . . A 3 VAL CG2 . 34868 1
53 . 1 . 1 7 7 VAL N N 15 119.251 0.022 . 1 . . . . A 3 VAL N . 34868 1
54 . 1 . 1 8 8 GLN H H 1 8.365 0.013 . 1 . . . . A 4 GLN H . 34868 1
55 . 1 . 1 8 8 GLN HA H 1 4.315 0.005 . 1 . . . . A 4 GLN HA . 34868 1
56 . 1 . 1 8 8 GLN HB2 H 1 1.982 0.015 . 2 . . . . A 4 GLN HB2 . 34868 1
57 . 1 . 1 8 8 GLN HB3 H 1 2.025 0.016 . 2 . . . . A 4 GLN HB3 . 34868 1
58 . 1 . 1 8 8 GLN HG2 H 1 2.332 0.004 . 1 . . . . A 4 GLN HG2 . 34868 1
59 . 1 . 1 8 8 GLN HG3 H 1 2.332 0.004 . 1 . . . . A 4 GLN HG3 . 34868 1
60 . 1 . 1 8 8 GLN HE21 H 1 7.572 0.000 . 1 . . . . A 4 GLN HE21 . 34868 1
61 . 1 . 1 8 8 GLN HE22 H 1 6.800 0.000 . 1 . . . . A 4 GLN HE22 . 34868 1
62 . 1 . 1 8 8 GLN C C 13 175.388 0.000 . 1 . . . . A 4 GLN C . 34868 1
63 . 1 . 1 8 8 GLN CA C 13 55.830 0.019 . 1 . . . . A 4 GLN CA . 34868 1
64 . 1 . 1 8 8 GLN CB C 13 29.900 0.067 . 1 . . . . A 4 GLN CB . 34868 1
65 . 1 . 1 8 8 GLN CG C 13 33.991 0.038 . 1 . . . . A 4 GLN CG . 34868 1
66 . 1 . 1 8 8 GLN N N 15 124.202 0.021 . 1 . . . . A 4 GLN N . 34868 1
67 . 1 . 1 8 8 GLN NE2 N 15 112.051 0.048 . 1 . . . . A 4 GLN NE2 . 34868 1
68 . 1 . 1 9 9 ASN H H 1 8.643 0.015 . 1 . . . . A 5 ASN H . 34868 1
69 . 1 . 1 9 9 ASN HA H 1 4.990 0.005 . 1 . . . . A 5 ASN HA . 34868 1
70 . 1 . 1 9 9 ASN HB2 H 1 2.858 0.006 . 2 . . . . A 5 ASN HB2 . 34868 1
71 . 1 . 1 9 9 ASN HB3 H 1 2.749 0.000 . 2 . . . . A 5 ASN HB3 . 34868 1
72 . 1 . 1 9 9 ASN HD21 H 1 6.981 0.000 . 1 . . . . A 5 ASN HD21 . 34868 1
73 . 1 . 1 9 9 ASN HD22 H 1 7.654 0.000 . 1 . . . . A 5 ASN HD22 . 34868 1
74 . 1 . 1 9 9 ASN CA C 13 51.293 0.047 . 1 . . . . A 5 ASN CA . 34868 1
75 . 1 . 1 9 9 ASN CB C 13 38.965 0.028 . 1 . . . . A 5 ASN CB . 34868 1
76 . 1 . 1 9 9 ASN N N 15 122.340 0.011 . 1 . . . . A 5 ASN N . 34868 1
77 . 1 . 1 9 9 ASN ND2 N 15 112.797 0.002 . 1 . . . . A 5 ASN ND2 . 34868 1
78 . 1 . 1 10 10 PRO HA H 1 4.469 0.019 . 1 . . . . A 6 PRO HA . 34868 1
79 . 1 . 1 10 10 PRO HB2 H 1 1.953 0.007 . 2 . . . . A 6 PRO HB2 . 34868 1
80 . 1 . 1 10 10 PRO HB3 H 1 2.311 0.003 . 2 . . . . A 6 PRO HB3 . 34868 1
81 . 1 . 1 10 10 PRO HG2 H 1 2.019 0.003 . 1 . . . . A 6 PRO HG2 . 34868 1
82 . 1 . 1 10 10 PRO HG3 H 1 2.020 0.003 . 1 . . . . A 6 PRO HG3 . 34868 1
83 . 1 . 1 10 10 PRO HD2 H 1 3.585 0.004 . 2 . . . . A 6 PRO HD2 . 34868 1
84 . 1 . 1 10 10 PRO HD3 H 1 3.581 0.009 . 2 . . . . A 6 PRO HD3 . 34868 1
85 . 1 . 1 10 10 PRO C C 13 176.877 0.000 . 1 . . . . A 6 PRO C . 34868 1
86 . 1 . 1 10 10 PRO CA C 13 63.131 0.028 . 1 . . . . A 6 PRO CA . 34868 1
87 . 1 . 1 10 10 PRO CB C 13 32.267 0.039 . 1 . . . . A 6 PRO CB . 34868 1
88 . 1 . 1 10 10 PRO CG C 13 27.057 0.042 . 1 . . . . A 6 PRO CG . 34868 1
89 . 1 . 1 10 10 PRO CD C 13 49.682 0.016 . 1 . . . . A 6 PRO CD . 34868 1
90 . 1 . 1 11 11 LEU H H 1 8.479 0.013 . 1 . . . . A 7 LEU H . 34868 1
91 . 1 . 1 11 11 LEU HA H 1 4.200 0.005 . 1 . . . . A 7 LEU HA . 34868 1
92 . 1 . 1 11 11 LEU HB2 H 1 1.804 0.004 . 2 . . . . A 7 LEU HB2 . 34868 1
93 . 1 . 1 11 11 LEU HB3 H 1 1.443 0.006 . 2 . . . . A 7 LEU HB3 . 34868 1
94 . 1 . 1 11 11 LEU HG H 1 1.682 0.010 . 1 . . . . A 7 LEU HG . 34868 1
95 . 1 . 1 11 11 LEU HD11 H 1 0.763 0.014 . 2 . . . . A 7 LEU HD11 . 34868 1
96 . 1 . 1 11 11 LEU HD12 H 1 0.763 0.014 . 2 . . . . A 7 LEU HD12 . 34868 1
97 . 1 . 1 11 11 LEU HD13 H 1 0.763 0.014 . 2 . . . . A 7 LEU HD13 . 34868 1
98 . 1 . 1 11 11 LEU HD21 H 1 0.697 0.010 . 2 . . . . A 7 LEU HD21 . 34868 1
99 . 1 . 1 11 11 LEU HD22 H 1 0.697 0.010 . 2 . . . . A 7 LEU HD22 . 34868 1
100 . 1 . 1 11 11 LEU HD23 H 1 0.697 0.010 . 2 . . . . A 7 LEU HD23 . 34868 1
101 . 1 . 1 11 11 LEU CA C 13 58.985 0.039 . 1 . . . . A 7 LEU CA . 34868 1
102 . 1 . 1 11 11 LEU CB C 13 41.648 0.051 . 1 . . . . A 7 LEU CB . 34868 1
103 . 1 . 1 11 11 LEU CG C 13 28.802 0.092 . 1 . . . . A 7 LEU CG . 34868 1
104 . 1 . 1 11 11 LEU CD1 C 13 25.334 0.029 . 2 . . . . A 7 LEU CD1 . 34868 1
105 . 1 . 1 11 11 LEU CD2 C 13 24.736 0.126 . 2 . . . . A 7 LEU CD2 . 34868 1
106 . 1 . 1 11 11 LEU N N 15 120.585 0.021 . 1 . . . . A 7 LEU N . 34868 1
107 . 1 . 1 12 12 GLU H H 1 8.103 0.008 . 1 . . . . A 8 GLU H . 34868 1
108 . 1 . 1 12 12 GLU HA H 1 3.614 0.008 . 1 . . . . A 8 GLU HA . 34868 1
109 . 1 . 1 12 12 GLU HB2 H 1 1.944 0.001 . 2 . . . . A 8 GLU HB2 . 34868 1
110 . 1 . 1 12 12 GLU HB3 H 1 2.244 0.013 . 2 . . . . A 8 GLU HB3 . 34868 1
111 . 1 . 1 12 12 GLU HG2 H 1 2.046 0.018 . 2 . . . . A 8 GLU HG2 . 34868 1
112 . 1 . 1 12 12 GLU HG3 H 1 2.298 0.000 . 2 . . . . A 8 GLU HG3 . 34868 1
113 . 1 . 1 12 12 GLU C C 13 178.390 0.000 . 1 . . . . A 8 GLU C . 34868 1
114 . 1 . 1 12 12 GLU CA C 13 60.151 0.057 . 1 . . . . A 8 GLU CA . 34868 1
115 . 1 . 1 12 12 GLU CB C 13 29.904 0.014 . 1 . . . . A 8 GLU CB . 34868 1
116 . 1 . 1 12 12 GLU CG C 13 37.749 0.027 . 1 . . . . A 8 GLU CG . 34868 1
117 . 1 . 1 12 12 GLU N N 15 118.762 0.049 . 1 . . . . A 8 GLU N . 34868 1
118 . 1 . 1 13 13 THR H H 1 7.835 0.011 . 1 . . . . A 9 THR H . 34868 1
119 . 1 . 1 13 13 THR HA H 1 3.895 0.004 . 1 . . . . A 9 THR HA . 34868 1
120 . 1 . 1 13 13 THR HB H 1 4.280 0.006 . 1 . . . . A 9 THR HB . 34868 1
121 . 1 . 1 13 13 THR HG21 H 1 1.287 0.003 . 1 . . . . A 9 THR HG21 . 34868 1
122 . 1 . 1 13 13 THR HG22 H 1 1.287 0.003 . 1 . . . . A 9 THR HG22 . 34868 1
123 . 1 . 1 13 13 THR HG23 H 1 1.287 0.003 . 1 . . . . A 9 THR HG23 . 34868 1
124 . 1 . 1 13 13 THR C C 13 176.158 0.000 . 1 . . . . A 9 THR C . 34868 1
125 . 1 . 1 13 13 THR CA C 13 66.857 0.060 . 1 . . . . A 9 THR CA . 34868 1
126 . 1 . 1 13 13 THR CB C 13 68.616 0.040 . 1 . . . . A 9 THR CB . 34868 1
127 . 1 . 1 13 13 THR CG2 C 13 22.072 0.036 . 1 . . . . A 9 THR CG2 . 34868 1
128 . 1 . 1 13 13 THR N N 15 113.603 0.033 . 1 . . . . A 9 THR N . 34868 1
129 . 1 . 1 14 14 VAL H H 1 7.446 0.008 . 1 . . . . A 10 VAL H . 34868 1
130 . 1 . 1 14 14 VAL HA H 1 3.804 0.004 . 1 . . . . A 10 VAL HA . 34868 1
131 . 1 . 1 14 14 VAL HB H 1 2.390 0.008 . 1 . . . . A 10 VAL HB . 34868 1
132 . 1 . 1 14 14 VAL HG11 H 1 0.960 0.010 . 2 . . . . A 10 VAL HG11 . 34868 1
133 . 1 . 1 14 14 VAL HG12 H 1 0.960 0.010 . 2 . . . . A 10 VAL HG12 . 34868 1
134 . 1 . 1 14 14 VAL HG13 H 1 0.960 0.010 . 2 . . . . A 10 VAL HG13 . 34868 1
135 . 1 . 1 14 14 VAL HG21 H 1 1.188 0.003 . 2 . . . . A 10 VAL HG21 . 34868 1
136 . 1 . 1 14 14 VAL HG22 H 1 1.188 0.003 . 2 . . . . A 10 VAL HG22 . 34868 1
137 . 1 . 1 14 14 VAL HG23 H 1 1.188 0.003 . 2 . . . . A 10 VAL HG23 . 34868 1
138 . 1 . 1 14 14 VAL C C 13 178.698 0.000 . 1 . . . . A 10 VAL C . 34868 1
139 . 1 . 1 14 14 VAL CA C 13 66.397 0.011 . 1 . . . . A 10 VAL CA . 34868 1
140 . 1 . 1 14 14 VAL CB C 13 32.250 0.035 . 1 . . . . A 10 VAL CB . 34868 1
141 . 1 . 1 14 14 VAL CG1 C 13 22.064 0.017 . 2 . . . . A 10 VAL CG1 . 34868 1
142 . 1 . 1 14 14 VAL CG2 C 13 22.913 0.027 . 2 . . . . A 10 VAL CG2 . 34868 1
143 . 1 . 1 14 14 VAL N N 15 121.094 0.021 . 1 . . . . A 10 VAL N . 34868 1
144 . 1 . 1 15 15 VAL H H 1 8.122 0.011 . 1 . . . . A 11 VAL H . 34868 1
145 . 1 . 1 15 15 VAL HA H 1 3.648 0.007 . 1 . . . . A 11 VAL HA . 34868 1
146 . 1 . 1 15 15 VAL HB H 1 2.364 0.006 . 1 . . . . A 11 VAL HB . 34868 1
147 . 1 . 1 15 15 VAL HG11 H 1 1.267 0.017 . 2 . . . . A 11 VAL HG11 . 34868 1
148 . 1 . 1 15 15 VAL HG12 H 1 1.267 0.017 . 2 . . . . A 11 VAL HG12 . 34868 1
149 . 1 . 1 15 15 VAL HG13 H 1 1.267 0.017 . 2 . . . . A 11 VAL HG13 . 34868 1
150 . 1 . 1 15 15 VAL HG21 H 1 1.237 0.014 . 2 . . . . A 11 VAL HG21 . 34868 1
151 . 1 . 1 15 15 VAL HG22 H 1 1.237 0.014 . 2 . . . . A 11 VAL HG22 . 34868 1
152 . 1 . 1 15 15 VAL HG23 H 1 1.237 0.014 . 2 . . . . A 11 VAL HG23 . 34868 1
153 . 1 . 1 15 15 VAL C C 13 176.776 0.000 . 1 . . . . A 11 VAL C . 34868 1
154 . 1 . 1 15 15 VAL CA C 13 67.336 0.030 . 1 . . . . A 11 VAL CA . 34868 1
155 . 1 . 1 15 15 VAL CB C 13 31.328 0.036 . 1 . . . . A 11 VAL CB . 34868 1
156 . 1 . 1 15 15 VAL CG1 C 13 23.396 0.085 . 2 . . . . A 11 VAL CG1 . 34868 1
157 . 1 . 1 15 15 VAL CG2 C 13 22.676 0.022 . 2 . . . . A 11 VAL CG2 . 34868 1
158 . 1 . 1 15 15 VAL N N 15 120.018 0.044 . 1 . . . . A 11 VAL N . 34868 1
159 . 1 . 1 16 16 LEU H H 1 8.796 0.011 . 1 . . . . A 12 LEU H . 34868 1
160 . 1 . 1 16 16 LEU HA H 1 4.218 0.007 . 1 . . . . A 12 LEU HA . 34868 1
161 . 1 . 1 16 16 LEU HB2 H 1 2.191 0.011 . 2 . . . . A 12 LEU HB2 . 34868 1
162 . 1 . 1 16 16 LEU HB3 H 1 1.692 0.006 . 2 . . . . A 12 LEU HB3 . 34868 1
163 . 1 . 1 16 16 LEU HG H 1 1.691 0.004 . 1 . . . . A 12 LEU HG . 34868 1
164 . 1 . 1 16 16 LEU HD11 H 1 1.096 0.014 . 2 . . . . A 12 LEU HD11 . 34868 1
165 . 1 . 1 16 16 LEU HD12 H 1 1.096 0.014 . 2 . . . . A 12 LEU HD12 . 34868 1
166 . 1 . 1 16 16 LEU HD13 H 1 1.096 0.014 . 2 . . . . A 12 LEU HD13 . 34868 1
167 . 1 . 1 16 16 LEU HD21 H 1 1.126 0.012 . 2 . . . . A 12 LEU HD21 . 34868 1
168 . 1 . 1 16 16 LEU HD22 H 1 1.126 0.012 . 2 . . . . A 12 LEU HD22 . 34868 1
169 . 1 . 1 16 16 LEU HD23 H 1 1.126 0.012 . 2 . . . . A 12 LEU HD23 . 34868 1
170 . 1 . 1 16 16 LEU C C 13 178.233 0.000 . 1 . . . . A 12 LEU C . 34868 1
171 . 1 . 1 16 16 LEU CA C 13 58.747 0.058 . 1 . . . . A 12 LEU CA . 34868 1
172 . 1 . 1 16 16 LEU CB C 13 42.523 0.043 . 1 . . . . A 12 LEU CB . 34868 1
173 . 1 . 1 16 16 LEU CG C 13 27.282 0.055 . 1 . . . . A 12 LEU CG . 34868 1
174 . 1 . 1 16 16 LEU CD1 C 13 25.916 0.039 . 2 . . . . A 12 LEU CD1 . 34868 1
175 . 1 . 1 16 16 LEU CD2 C 13 24.449 0.049 . 2 . . . . A 12 LEU CD2 . 34868 1
176 . 1 . 1 16 16 LEU N N 15 119.617 0.021 . 1 . . . . A 12 LEU N . 34868 1
177 . 1 . 1 17 17 GLN H H 1 8.390 0.012 . 1 . . . . A 13 GLN H . 34868 1
178 . 1 . 1 17 17 GLN HA H 1 3.888 0.007 . 1 . . . . A 13 GLN HA . 34868 1
179 . 1 . 1 17 17 GLN HB2 H 1 2.285 0.009 . 2 . . . . A 13 GLN HB2 . 34868 1
180 . 1 . 1 17 17 GLN HB3 H 1 2.161 0.005 . 2 . . . . A 13 GLN HB3 . 34868 1
181 . 1 . 1 17 17 GLN HG2 H 1 2.464 0.021 . 2 . . . . A 13 GLN HG2 . 34868 1
182 . 1 . 1 17 17 GLN HG3 H 1 2.491 0.018 . 2 . . . . A 13 GLN HG3 . 34868 1
183 . 1 . 1 17 17 GLN HE21 H 1 6.898 0.000 . 1 . . . . A 13 GLN HE21 . 34868 1
184 . 1 . 1 17 17 GLN HE22 H 1 7.666 0.000 . 1 . . . . A 13 GLN HE22 . 34868 1
185 . 1 . 1 17 17 GLN C C 13 178.110 0.000 . 1 . . . . A 13 GLN C . 34868 1
186 . 1 . 1 17 17 GLN CA C 13 58.832 0.042 . 1 . . . . A 13 GLN CA . 34868 1
187 . 1 . 1 17 17 GLN CB C 13 28.142 0.052 . 1 . . . . A 13 GLN CB . 34868 1
188 . 1 . 1 17 17 GLN CG C 13 33.995 0.003 . 1 . . . . A 13 GLN CG . 34868 1
189 . 1 . 1 17 17 GLN N N 15 117.554 0.024 . 1 . . . . A 13 GLN N . 34868 1
190 . 1 . 1 17 17 GLN NE2 N 15 114.108 0.004 . 1 . . . . A 13 GLN NE2 . 34868 1
191 . 1 . 1 18 18 ALA H H 1 8.106 0.010 . 1 . . . . A 14 ALA H . 34868 1
192 . 1 . 1 18 18 ALA HA H 1 4.214 0.004 . 1 . . . . A 14 ALA HA . 34868 1
193 . 1 . 1 18 18 ALA HB1 H 1 1.429 0.002 . 1 . . . . A 14 ALA HB1 . 34868 1
194 . 1 . 1 18 18 ALA HB2 H 1 1.429 0.002 . 1 . . . . A 14 ALA HB2 . 34868 1
195 . 1 . 1 18 18 ALA HB3 H 1 1.429 0.002 . 1 . . . . A 14 ALA HB3 . 34868 1
196 . 1 . 1 18 18 ALA C C 13 179.152 0.000 . 1 . . . . A 14 ALA C . 34868 1
197 . 1 . 1 18 18 ALA CA C 13 55.081 0.030 . 1 . . . . A 14 ALA CA . 34868 1
198 . 1 . 1 18 18 ALA CB C 13 17.362 0.017 . 1 . . . . A 14 ALA CB . 34868 1
199 . 1 . 1 18 18 ALA N N 15 120.854 0.031 . 1 . . . . A 14 ALA N . 34868 1
200 . 1 . 1 19 19 TRP H H 1 8.401 0.011 . 1 . . . . A 15 TRP H . 34868 1
201 . 1 . 1 19 19 TRP HA H 1 4.499 0.007 . 1 . . . . A 15 TRP HA . 34868 1
202 . 1 . 1 19 19 TRP HB2 H 1 3.207 0.020 . 2 . . . . A 15 TRP HB2 . 34868 1
203 . 1 . 1 19 19 TRP HB3 H 1 3.248 0.025 . 2 . . . . A 15 TRP HB3 . 34868 1
204 . 1 . 1 19 19 TRP HD1 H 1 5.753 0.000 . 1 . . . . A 15 TRP HD1 . 34868 1
205 . 1 . 1 19 19 TRP HE3 H 1 7.150 0.000 . 1 . . . . A 15 TRP HE3 . 34868 1
206 . 1 . 1 19 19 TRP HZ2 H 1 7.314 0.000 . 1 . . . . A 15 TRP HZ2 . 34868 1
207 . 1 . 1 19 19 TRP HZ3 H 1 6.505 0.000 . 1 . . . . A 15 TRP HZ3 . 34868 1
208 . 1 . 1 19 19 TRP HH2 H 1 7.007 0.000 . 1 . . . . A 15 TRP HH2 . 34868 1
209 . 1 . 1 19 19 TRP C C 13 179.656 0.000 . 1 . . . . A 15 TRP C . 34868 1
210 . 1 . 1 19 19 TRP CA C 13 59.315 0.037 . 1 . . . . A 15 TRP CA . 34868 1
211 . 1 . 1 19 19 TRP CB C 13 29.618 0.016 . 1 . . . . A 15 TRP CB . 34868 1
212 . 1 . 1 19 19 TRP CD1 C 13 126.149 0.000 . 1 . . . . A 15 TRP CD1 . 34868 1
213 . 1 . 1 19 19 TRP CE3 C 13 121.555 0.000 . 1 . . . . A 15 TRP CE3 . 34868 1
214 . 1 . 1 19 19 TRP CZ2 C 13 114.419 0.000 . 1 . . . . A 15 TRP CZ2 . 34868 1
215 . 1 . 1 19 19 TRP CZ3 C 13 120.336 0.000 . 1 . . . . A 15 TRP CZ3 . 34868 1
216 . 1 . 1 19 19 TRP CH2 C 13 124.807 0.000 . 1 . . . . A 15 TRP CH2 . 34868 1
217 . 1 . 1 19 19 TRP N N 15 116.372 0.026 . 1 . . . . A 15 TRP N . 34868 1
218 . 1 . 1 20 20 LYS H H 1 8.860 0.009 . 1 . . . . A 16 LYS H . 34868 1
219 . 1 . 1 20 20 LYS HA H 1 3.410 0.009 . 1 . . . . A 16 LYS HA . 34868 1
220 . 1 . 1 20 20 LYS HB2 H 1 1.851 0.012 . 2 . . . . A 16 LYS HB2 . 34868 1
221 . 1 . 1 20 20 LYS HB3 H 1 1.840 0.013 . 2 . . . . A 16 LYS HB3 . 34868 1
222 . 1 . 1 20 20 LYS HG2 H 1 1.452 0.005 . 2 . . . . A 16 LYS HG2 . 34868 1
223 . 1 . 1 20 20 LYS HG3 H 1 1.803 0.008 . 2 . . . . A 16 LYS HG3 . 34868 1
224 . 1 . 1 20 20 LYS HD2 H 1 1.754 0.001 . 1 . . . . A 16 LYS HD2 . 34868 1
225 . 1 . 1 20 20 LYS HD3 H 1 1.754 0.001 . 1 . . . . A 16 LYS HD3 . 34868 1
226 . 1 . 1 20 20 LYS HE2 H 1 2.981 0.004 . 2 . . . . A 16 LYS HE2 . 34868 1
227 . 1 . 1 20 20 LYS HE3 H 1 3.109 0.002 . 2 . . . . A 16 LYS HE3 . 34868 1
228 . 1 . 1 20 20 LYS C C 13 178.992 0.000 . 1 . . . . A 16 LYS C . 34868 1
229 . 1 . 1 20 20 LYS CA C 13 61.436 0.043 . 1 . . . . A 16 LYS CA . 34868 1
230 . 1 . 1 20 20 LYS CB C 13 32.356 0.058 . 1 . . . . A 16 LYS CB . 34868 1
231 . 1 . 1 20 20 LYS CG C 13 25.931 0.060 . 1 . . . . A 16 LYS CG . 34868 1
232 . 1 . 1 20 20 LYS CD C 13 30.109 0.058 . 1 . . . . A 16 LYS CD . 34868 1
233 . 1 . 1 20 20 LYS CE C 13 43.172 0.000 . 1 . . . . A 16 LYS CE . 34868 1
234 . 1 . 1 20 20 LYS N N 15 122.454 0.012 . 1 . . . . A 16 LYS N . 34868 1
235 . 1 . 1 21 21 ASP H H 1 8.221 0.012 . 1 . . . . A 17 ASP H . 34868 1
236 . 1 . 1 21 21 ASP HA H 1 4.200 0.009 . 1 . . . . A 17 ASP HA . 34868 1
237 . 1 . 1 21 21 ASP HB2 H 1 2.651 0.003 . 2 . . . . A 17 ASP HB2 . 34868 1
238 . 1 . 1 21 21 ASP HB3 H 1 2.832 0.002 . 2 . . . . A 17 ASP HB3 . 34868 1
239 . 1 . 1 21 21 ASP C C 13 177.932 0.000 . 1 . . . . A 17 ASP C . 34868 1
240 . 1 . 1 21 21 ASP CA C 13 57.201 0.021 . 1 . . . . A 17 ASP CA . 34868 1
241 . 1 . 1 21 21 ASP CB C 13 41.207 0.020 . 1 . . . . A 17 ASP CB . 34868 1
242 . 1 . 1 21 21 ASP N N 15 119.446 0.036 . 1 . . . . A 17 ASP N . 34868 1
243 . 1 . 1 22 22 ILE H H 1 7.625 0.010 . 1 . . . . A 18 ILE H . 34868 1
244 . 1 . 1 22 22 ILE HA H 1 3.466 0.009 . 1 . . . . A 18 ILE HA . 34868 1
245 . 1 . 1 22 22 ILE HB H 1 1.371 0.010 . 1 . . . . A 18 ILE HB . 34868 1
246 . 1 . 1 22 22 ILE HG12 H 1 1.715 0.016 . 2 . . . . A 18 ILE HG12 . 34868 1
247 . 1 . 1 22 22 ILE HG13 H 1 0.942 0.010 . 2 . . . . A 18 ILE HG13 . 34868 1
248 . 1 . 1 22 22 ILE HG21 H 1 0.613 0.003 . 1 . . . . A 18 ILE HG21 . 34868 1
249 . 1 . 1 22 22 ILE HG22 H 1 0.613 0.003 . 1 . . . . A 18 ILE HG22 . 34868 1
250 . 1 . 1 22 22 ILE HG23 H 1 0.613 0.003 . 1 . . . . A 18 ILE HG23 . 34868 1
251 . 1 . 1 22 22 ILE HD11 H 1 0.738 0.003 . 1 . . . . A 18 ILE HD11 . 34868 1
252 . 1 . 1 22 22 ILE HD12 H 1 0.738 0.003 . 1 . . . . A 18 ILE HD12 . 34868 1
253 . 1 . 1 22 22 ILE HD13 H 1 0.738 0.003 . 1 . . . . A 18 ILE HD13 . 34868 1
254 . 1 . 1 22 22 ILE C C 13 176.681 0.000 . 1 . . . . A 18 ILE C . 34868 1
255 . 1 . 1 22 22 ILE CA C 13 63.784 0.019 . 1 . . . . A 18 ILE CA . 34868 1
256 . 1 . 1 22 22 ILE CB C 13 39.741 0.031 . 1 . . . . A 18 ILE CB . 34868 1
257 . 1 . 1 22 22 ILE CG1 C 13 29.425 0.061 . 1 . . . . A 18 ILE CG1 . 34868 1
258 . 1 . 1 22 22 ILE CG2 C 13 17.161 0.028 . 1 . . . . A 18 ILE CG2 . 34868 1
259 . 1 . 1 22 22 ILE CD1 C 13 13.879 0.037 . 1 . . . . A 18 ILE CD1 . 34868 1
260 . 1 . 1 22 22 ILE N N 15 118.187 0.019 . 1 . . . . A 18 ILE N . 34868 1
261 . 1 . 1 23 23 SER H H 1 7.882 0.012 . 1 . . . . A 19 SER H . 34868 1
262 . 1 . 1 23 23 SER HA H 1 3.026 0.008 . 1 . . . . A 19 SER HA . 34868 1
263 . 1 . 1 23 23 SER HB2 H 1 1.443 0.011 . 2 . . . . A 19 SER HB2 . 34868 1
264 . 1 . 1 23 23 SER HB3 H 1 3.028 0.002 . 2 . . . . A 19 SER HB3 . 34868 1
265 . 1 . 1 23 23 SER C C 13 175.934 0.000 . 1 . . . . A 19 SER C . 34868 1
266 . 1 . 1 23 23 SER CA C 13 59.225 0.027 . 1 . . . . A 19 SER CA . 34868 1
267 . 1 . 1 23 23 SER CB C 13 65.189 0.019 . 1 . . . . A 19 SER CB . 34868 1
268 . 1 . 1 23 23 SER N N 15 111.745 0.024 . 1 . . . . A 19 SER N . 34868 1
269 . 1 . 1 24 24 GLY H H 1 7.667 0.012 . 1 . . . . A 20 GLY H . 34868 1
270 . 1 . 1 24 24 GLY HA2 H 1 3.724 0.005 . 2 . . . . A 20 GLY HA2 . 34868 1
271 . 1 . 1 24 24 GLY HA3 H 1 3.999 0.008 . 2 . . . . A 20 GLY HA3 . 34868 1
272 . 1 . 1 24 24 GLY C C 13 173.804 0.000 . 1 . . . . A 20 GLY C . 34868 1
273 . 1 . 1 24 24 GLY CA C 13 45.756 0.030 . 1 . . . . A 20 GLY CA . 34868 1
274 . 1 . 1 24 24 GLY N N 15 112.237 0.038 . 1 . . . . A 20 GLY N . 34868 1
275 . 1 . 1 25 25 ALA H H 1 7.368 0.011 . 1 . . . . A 21 ALA H . 34868 1
276 . 1 . 1 25 25 ALA HA H 1 4.377 0.003 . 1 . . . . A 21 ALA HA . 34868 1
277 . 1 . 1 25 25 ALA HB1 H 1 1.185 0.004 . 1 . . . . A 21 ALA HB1 . 34868 1
278 . 1 . 1 25 25 ALA HB2 H 1 1.185 0.004 . 1 . . . . A 21 ALA HB2 . 34868 1
279 . 1 . 1 25 25 ALA HB3 H 1 1.185 0.004 . 1 . . . . A 21 ALA HB3 . 34868 1
280 . 1 . 1 25 25 ALA C C 13 176.229 0.000 . 1 . . . . A 21 ALA C . 34868 1
281 . 1 . 1 25 25 ALA CA C 13 51.829 0.033 . 1 . . . . A 21 ALA CA . 34868 1
282 . 1 . 1 25 25 ALA CB C 13 18.403 0.040 . 1 . . . . A 21 ALA CB . 34868 1
283 . 1 . 1 25 25 ALA N N 15 123.298 0.027 . 1 . . . . A 21 ALA N . 34868 1
284 . 1 . 1 26 26 ASP H H 1 8.151 0.011 . 1 . . . . A 22 ASP H . 34868 1
285 . 1 . 1 26 26 ASP HA H 1 4.516 0.007 . 1 . . . . A 22 ASP HA . 34868 1
286 . 1 . 1 26 26 ASP HB2 H 1 2.664 0.019 . 2 . . . . A 22 ASP HB2 . 34868 1
287 . 1 . 1 26 26 ASP HB3 H 1 2.659 0.023 . 2 . . . . A 22 ASP HB3 . 34868 1
288 . 1 . 1 26 26 ASP C C 13 176.178 0.000 . 1 . . . . A 22 ASP C . 34868 1
289 . 1 . 1 26 26 ASP CA C 13 55.910 0.055 . 1 . . . . A 22 ASP CA . 34868 1
290 . 1 . 1 26 26 ASP CB C 13 42.053 0.021 . 1 . . . . A 22 ASP CB . 34868 1
291 . 1 . 1 26 26 ASP N N 15 121.503 0.030 . 1 . . . . A 22 ASP N . 34868 1
292 . 1 . 1 27 27 ASP H H 1 8.503 0.015 . 1 . . . . A 23 ASP H . 34868 1
293 . 1 . 1 27 27 ASP HA H 1 4.707 0.015 . 1 . . . . A 23 ASP HA . 34868 1
294 . 1 . 1 27 27 ASP HB2 H 1 2.724 0.010 . 2 . . . . A 23 ASP HB2 . 34868 1
295 . 1 . 1 27 27 ASP HB3 H 1 2.733 0.007 . 2 . . . . A 23 ASP HB3 . 34868 1
296 . 1 . 1 27 27 ASP C C 13 175.042 0.000 . 1 . . . . A 23 ASP C . 34868 1
297 . 1 . 1 27 27 ASP CA C 13 53.319 0.040 . 1 . . . . A 23 ASP CA . 34868 1
298 . 1 . 1 27 27 ASP N N 15 117.550 0.015 . 1 . . . . A 23 ASP N . 34868 1
299 . 1 . 1 28 28 PHE H H 1 7.661 0.011 . 1 . . . . A 24 PHE H . 34868 1
300 . 1 . 1 28 28 PHE HA H 1 4.467 0.005 . 1 . . . . A 24 PHE HA . 34868 1
301 . 1 . 1 28 28 PHE HB2 H 1 3.175 0.004 . 2 . . . . A 24 PHE HB2 . 34868 1
302 . 1 . 1 28 28 PHE HB3 H 1 2.878 0.002 . 2 . . . . A 24 PHE HB3 . 34868 1
303 . 1 . 1 28 28 PHE HD1 H 1 7.217 0.000 . 1 . . . . A 24 PHE HD1 . 34868 1
304 . 1 . 1 28 28 PHE HD2 H 1 7.217 0.000 . 1 . . . . A 24 PHE HD2 . 34868 1
305 . 1 . 1 28 28 PHE HE1 H 1 6.656 0.000 . 1 . . . . A 24 PHE HE1 . 34868 1
306 . 1 . 1 28 28 PHE HE2 H 1 6.656 0.000 . 1 . . . . A 24 PHE HE2 . 34868 1
307 . 1 . 1 28 28 PHE C C 13 174.677 0.000 . 1 . . . . A 24 PHE C . 34868 1
308 . 1 . 1 28 28 PHE CA C 13 59.352 0.064 . 1 . . . . A 24 PHE CA . 34868 1
309 . 1 . 1 28 28 PHE CB C 13 41.861 0.018 . 1 . . . . A 24 PHE CB . 34868 1
310 . 1 . 1 28 28 PHE CD1 C 13 132.272 0.000 . 1 . . . . A 24 PHE CD1 . 34868 1
311 . 1 . 1 28 28 PHE CD2 C 13 132.272 0.000 . 1 . . . . A 24 PHE CD2 . 34868 1
312 . 1 . 1 28 28 PHE CE1 C 13 130.757 0.000 . 1 . . . . A 24 PHE CE1 . 34868 1
313 . 1 . 1 28 28 PHE CE2 C 13 130.757 0.000 . 1 . . . . A 24 PHE CE2 . 34868 1
314 . 1 . 1 28 28 PHE N N 15 124.327 0.015 . 1 . . . . A 24 PHE N . 34868 1
315 . 1 . 1 29 29 THR H H 1 8.543 0.012 . 1 . . . . A 25 THR H . 34868 1
316 . 1 . 1 29 29 THR HA H 1 4.948 0.003 . 1 . . . . A 25 THR HA . 34868 1
317 . 1 . 1 29 29 THR HB H 1 4.538 0.008 . 1 . . . . A 25 THR HB . 34868 1
318 . 1 . 1 29 29 THR HG21 H 1 1.202 0.004 . 1 . . . . A 25 THR HG21 . 34868 1
319 . 1 . 1 29 29 THR HG22 H 1 1.202 0.004 . 1 . . . . A 25 THR HG22 . 34868 1
320 . 1 . 1 29 29 THR HG23 H 1 1.202 0.004 . 1 . . . . A 25 THR HG23 . 34868 1
321 . 1 . 1 29 29 THR C C 13 176.339 0.000 . 1 . . . . A 25 THR C . 34868 1
322 . 1 . 1 29 29 THR CA C 13 60.385 0.055 . 1 . . . . A 25 THR CA . 34868 1
323 . 1 . 1 29 29 THR CB C 13 71.742 0.034 . 1 . . . . A 25 THR CB . 34868 1
324 . 1 . 1 29 29 THR CG2 C 13 21.004 0.018 . 1 . . . . A 25 THR CG2 . 34868 1
325 . 1 . 1 29 29 THR N N 15 117.754 0.019 . 1 . . . . A 25 THR N . 34868 1
326 . 1 . 1 30 30 THR H H 1 8.394 0.011 . 1 . . . . A 26 THR H . 34868 1
327 . 1 . 1 30 30 THR HA H 1 3.939 0.011 . 1 . . . . A 26 THR HA . 34868 1
328 . 1 . 1 30 30 THR HB H 1 4.374 0.008 . 1 . . . . A 26 THR HB . 34868 1
329 . 1 . 1 30 30 THR HG21 H 1 1.376 0.009 . 1 . . . . A 26 THR HG21 . 34868 1
330 . 1 . 1 30 30 THR HG22 H 1 1.376 0.009 . 1 . . . . A 26 THR HG22 . 34868 1
331 . 1 . 1 30 30 THR HG23 H 1 1.376 0.009 . 1 . . . . A 26 THR HG23 . 34868 1
332 . 1 . 1 30 30 THR C C 13 173.572 0.000 . 1 . . . . A 26 THR C . 34868 1
333 . 1 . 1 30 30 THR CA C 13 64.538 0.040 . 1 . . . . A 26 THR CA . 34868 1
334 . 1 . 1 30 30 THR CB C 13 68.500 0.023 . 1 . . . . A 26 THR CB . 34868 1
335 . 1 . 1 30 30 THR CG2 C 13 23.708 0.019 . 1 . . . . A 26 THR CG2 . 34868 1
336 . 1 . 1 30 30 THR N N 15 107.499 0.048 . 1 . . . . A 26 THR N . 34868 1
337 . 1 . 1 31 31 THR H H 1 7.329 0.010 . 1 . . . . A 27 THR H . 34868 1
338 . 1 . 1 31 31 THR HA H 1 4.463 0.002 . 1 . . . . A 27 THR HA . 34868 1
339 . 1 . 1 31 31 THR HB H 1 4.397 0.010 . 1 . . . . A 27 THR HB . 34868 1
340 . 1 . 1 31 31 THR HG21 H 1 1.034 0.005 . 1 . . . . A 27 THR HG21 . 34868 1
341 . 1 . 1 31 31 THR HG22 H 1 1.034 0.005 . 1 . . . . A 27 THR HG22 . 34868 1
342 . 1 . 1 31 31 THR HG23 H 1 1.034 0.005 . 1 . . . . A 27 THR HG23 . 34868 1
343 . 1 . 1 31 31 THR C C 13 174.449 0.000 . 1 . . . . A 27 THR C . 34868 1
344 . 1 . 1 31 31 THR CA C 13 60.532 0.053 . 1 . . . . A 27 THR CA . 34868 1
345 . 1 . 1 31 31 THR CB C 13 69.252 0.053 . 1 . . . . A 27 THR CB . 34868 1
346 . 1 . 1 31 31 THR CG2 C 13 21.369 0.037 . 1 . . . . A 27 THR CG2 . 34868 1
347 . 1 . 1 31 31 THR N N 15 105.280 0.024 . 1 . . . . A 27 THR N . 34868 1
348 . 1 . 1 32 32 ASP H H 1 6.517 0.011 . 1 . . . . A 28 ASP H . 34868 1
349 . 1 . 1 32 32 ASP HA H 1 4.367 0.013 . 1 . . . . A 28 ASP HA . 34868 1
350 . 1 . 1 32 32 ASP HB2 H 1 1.282 0.004 . 2 . . . . A 28 ASP HB2 . 34868 1
351 . 1 . 1 32 32 ASP HB3 H 1 1.795 0.007 . 2 . . . . A 28 ASP HB3 . 34868 1
352 . 1 . 1 32 32 ASP C C 13 175.480 0.000 . 1 . . . . A 28 ASP C . 34868 1
353 . 1 . 1 32 32 ASP CA C 13 54.444 0.012 . 1 . . . . A 28 ASP CA . 34868 1
354 . 1 . 1 32 32 ASP CB C 13 41.941 0.016 . 1 . . . . A 28 ASP CB . 34868 1
355 . 1 . 1 32 32 ASP N N 15 123.110 0.023 . 1 . . . . A 28 ASP N . 34868 1
356 . 1 . 1 33 33 SER H H 1 8.447 0.013 . 1 . . . . A 29 SER H . 34868 1
357 . 1 . 1 33 33 SER HA H 1 4.662 0.007 . 1 . . . . A 29 SER HA . 34868 1
358 . 1 . 1 33 33 SER HB2 H 1 3.846 0.004 . 2 . . . . A 29 SER HB2 . 34868 1
359 . 1 . 1 33 33 SER HB3 H 1 4.003 0.014 . 2 . . . . A 29 SER HB3 . 34868 1
360 . 1 . 1 33 33 SER C C 13 177.519 0.000 . 1 . . . . A 29 SER C . 34868 1
361 . 1 . 1 33 33 SER CA C 13 56.778 0.071 . 1 . . . . A 29 SER CA . 34868 1
362 . 1 . 1 33 33 SER CB C 13 63.974 0.056 . 1 . . . . A 29 SER CB . 34868 1
363 . 1 . 1 33 33 SER N N 15 114.439 0.027 . 1 . . . . A 29 SER N . 34868 1
364 . 1 . 1 34 34 PHE H H 1 8.018 0.011 . 1 . . . . A 30 PHE H . 34868 1
365 . 1 . 1 34 34 PHE HA H 1 4.288 0.003 . 1 . . . . A 30 PHE HA . 34868 1
366 . 1 . 1 34 34 PHE HB2 H 1 2.408 0.010 . 2 . . . . A 30 PHE HB2 . 34868 1
367 . 1 . 1 34 34 PHE HB3 H 1 2.655 0.004 . 2 . . . . A 30 PHE HB3 . 34868 1
368 . 1 . 1 34 34 PHE C C 13 178.513 0.000 . 1 . . . . A 30 PHE C . 34868 1
369 . 1 . 1 34 34 PHE CA C 13 60.253 0.063 . 1 . . . . A 30 PHE CA . 34868 1
370 . 1 . 1 34 34 PHE CB C 13 39.022 0.023 . 1 . . . . A 30 PHE CB . 34868 1
371 . 1 . 1 34 34 PHE N N 15 126.033 0.039 . 1 . . . . A 30 PHE N . 34868 1
372 . 1 . 1 35 35 LEU H H 1 8.530 0.010 . 1 . . . . A 31 LEU H . 34868 1
373 . 1 . 1 35 35 LEU HA H 1 4.356 0.005 . 1 . . . . A 31 LEU HA . 34868 1
374 . 1 . 1 35 35 LEU HB2 H 1 1.701 0.004 . 1 . . . . A 31 LEU HB2 . 34868 1
375 . 1 . 1 35 35 LEU HB3 H 1 1.701 0.004 . 1 . . . . A 31 LEU HB3 . 34868 1
376 . 1 . 1 35 35 LEU HG H 1 1.698 0.005 . 1 . . . . A 31 LEU HG . 34868 1
377 . 1 . 1 35 35 LEU HD11 H 1 0.800 0.015 . 2 . . . . A 31 LEU HD11 . 34868 1
378 . 1 . 1 35 35 LEU HD12 H 1 0.800 0.015 . 2 . . . . A 31 LEU HD12 . 34868 1
379 . 1 . 1 35 35 LEU HD13 H 1 0.800 0.015 . 2 . . . . A 31 LEU HD13 . 34868 1
380 . 1 . 1 35 35 LEU HD21 H 1 0.939 0.006 . 2 . . . . A 31 LEU HD21 . 34868 1
381 . 1 . 1 35 35 LEU HD22 H 1 0.939 0.006 . 2 . . . . A 31 LEU HD22 . 34868 1
382 . 1 . 1 35 35 LEU HD23 H 1 0.939 0.006 . 2 . . . . A 31 LEU HD23 . 34868 1
383 . 1 . 1 35 35 LEU C C 13 178.751 0.000 . 1 . . . . A 31 LEU C . 34868 1
384 . 1 . 1 35 35 LEU CA C 13 56.636 0.048 . 1 . . . . A 31 LEU CA . 34868 1
385 . 1 . 1 35 35 LEU CB C 13 41.915 0.044 . 1 . . . . A 31 LEU CB . 34868 1
386 . 1 . 1 35 35 LEU CG C 13 27.524 0.046 . 1 . . . . A 31 LEU CG . 34868 1
387 . 1 . 1 35 35 LEU CD1 C 13 24.087 0.022 . 2 . . . . A 31 LEU CD1 . 34868 1
388 . 1 . 1 35 35 LEU CD2 C 13 24.948 0.033 . 2 . . . . A 31 LEU CD2 . 34868 1
389 . 1 . 1 35 35 LEU N N 15 116.825 0.025 . 1 . . . . A 31 LEU N . 34868 1
390 . 1 . 1 36 36 GLY H H 1 8.061 0.013 . 1 . . . . A 32 GLY H . 34868 1
391 . 1 . 1 36 36 GLY HA2 H 1 3.987 0.010 . 2 . . . . A 32 GLY HA2 . 34868 1
392 . 1 . 1 36 36 GLY HA3 H 1 4.093 0.011 . 2 . . . . A 32 GLY HA3 . 34868 1
393 . 1 . 1 36 36 GLY CA C 13 45.964 0.077 . 1 . . . . A 32 GLY CA . 34868 1
394 . 1 . 1 36 36 GLY N N 15 106.863 0.036 . 1 . . . . A 32 GLY N . 34868 1
395 . 1 . 1 37 37 HIS HA H 1 4.821 0.012 . 1 . . . . A 33 HIS HA . 34868 1
396 . 1 . 1 37 37 HIS HB2 H 1 3.673 0.005 . 2 . . . . A 33 HIS HB2 . 34868 1
397 . 1 . 1 37 37 HIS HB3 H 1 3.385 0.004 . 2 . . . . A 33 HIS HB3 . 34868 1
398 . 1 . 1 37 37 HIS HD2 H 1 7.337 0.000 . 1 . . . . A 33 HIS HD2 . 34868 1
399 . 1 . 1 37 37 HIS C C 13 175.754 0.000 . 1 . . . . A 33 HIS C . 34868 1
400 . 1 . 1 37 37 HIS CA C 13 56.681 0.076 . 1 . . . . A 33 HIS CA . 34868 1
401 . 1 . 1 37 37 HIS CB C 13 30.580 0.000 . 1 . . . . A 33 HIS CB . 34868 1
402 . 1 . 1 37 37 HIS CD2 C 13 120.390 0.000 . 1 . . . . A 33 HIS CD2 . 34868 1
403 . 1 . 1 38 38 GLY H H 1 8.357 0.017 . 1 . . . . A 34 GLY H . 34868 1
404 . 1 . 1 38 38 GLY HA2 H 1 4.203 0.006 . 2 . . . . A 34 GLY HA2 . 34868 1
405 . 1 . 1 38 38 GLY HA3 H 1 3.967 0.008 . 2 . . . . A 34 GLY HA3 . 34868 1
406 . 1 . 1 38 38 GLY C C 13 174.940 0.000 . 1 . . . . A 34 GLY C . 34868 1
407 . 1 . 1 38 38 GLY CA C 13 45.741 0.038 . 1 . . . . A 34 GLY CA . 34868 1
408 . 1 . 1 38 38 GLY N N 15 108.857 0.030 . 1 . . . . A 34 GLY N . 34868 1
409 . 1 . 1 39 39 GLY H H 1 8.171 0.012 . 1 . . . . A 35 GLY H . 34868 1
410 . 1 . 1 39 39 GLY HA2 H 1 3.943 0.013 . 2 . . . . A 35 GLY HA2 . 34868 1
411 . 1 . 1 39 39 GLY HA3 H 1 4.235 0.013 . 2 . . . . A 35 GLY HA3 . 34868 1
412 . 1 . 1 39 39 GLY C C 13 173.163 0.000 . 1 . . . . A 35 GLY C . 34868 1
413 . 1 . 1 39 39 GLY CA C 13 45.776 0.050 . 1 . . . . A 35 GLY CA . 34868 1
414 . 1 . 1 39 39 GLY N N 15 108.337 0.021 . 1 . . . . A 35 GLY N . 34868 1
415 . 1 . 1 40 40 ASN H H 1 8.398 0.014 . 1 . . . . A 36 ASN H . 34868 1
416 . 1 . 1 40 40 ASN HA H 1 4.657 0.015 . 1 . . . . A 36 ASN HA . 34868 1
417 . 1 . 1 40 40 ASN HB2 H 1 2.747 0.002 . 2 . . . . A 36 ASN HB2 . 34868 1
418 . 1 . 1 40 40 ASN HB3 H 1 2.464 0.005 . 2 . . . . A 36 ASN HB3 . 34868 1
419 . 1 . 1 40 40 ASN HD21 H 1 7.450 0.001 . 1 . . . . A 36 ASN HD21 . 34868 1
420 . 1 . 1 40 40 ASN HD22 H 1 6.618 0.002 . 1 . . . . A 36 ASN HD22 . 34868 1
421 . 1 . 1 40 40 ASN C C 13 175.845 0.000 . 1 . . . . A 36 ASN C . 34868 1
422 . 1 . 1 40 40 ASN CA C 13 52.449 0.035 . 1 . . . . A 36 ASN CA . 34868 1
423 . 1 . 1 40 40 ASN CB C 13 39.265 0.058 . 1 . . . . A 36 ASN CB . 34868 1
424 . 1 . 1 40 40 ASN N N 15 119.857 0.032 . 1 . . . . A 36 ASN N . 34868 1
425 . 1 . 1 40 40 ASN ND2 N 15 111.680 0.031 . 1 . . . . A 36 ASN ND2 . 34868 1
426 . 1 . 1 41 41 4HH H H 1 9.016 0.012 . 1 . . . . A 37 4HH H . 34868 1
427 . 1 . 1 41 41 4HH C C 13 175.646 0.000 . 1 . . . . A 37 4HH C . 34868 1
428 . 1 . 1 41 41 4HH N N 15 117.887 0.043 . 1 . . . . A 37 4HH N . 34868 1
429 . 1 . 1 41 41 4HH CA C 13 60.137 0.066 . 1 . . . . A 37 4HH CA . 34868 1
430 . 1 . 1 41 41 4HH CB C 13 65.829 0.017 . 1 . . . . A 37 4HH CB . 34868 1
431 . 1 . 1 41 41 4HH CJ C 13 74.161 0.022 . 1 . . . . A 37 4HH CJ . 34868 1
432 . 1 . 1 41 41 4HH CL1 C 13 23.929 0.005 . 1 . . . . A 37 4HH CL1 . 34868 1
433 . 1 . 1 41 41 4HH CL2 C 13 21.526 0.018 . 1 . . . . A 37 4HH CL2 . 34868 1
434 . 1 . 1 41 41 4HH CL3 C 13 177.309 0.000 . 1 . . . . A 37 4HH CL3 . 34868 1
435 . 1 . 1 41 41 4HH CM C 13 76.882 0.037 . 1 . . . . A 37 4HH CM . 34868 1
436 . 1 . 1 41 41 4HH CO C 13 38.168 0.035 . 1 . . . . A 37 4HH CO . 34868 1
437 . 1 . 1 41 41 4HH CP C 13 38.032 0.028 . 1 . . . . A 37 4HH CP . 34868 1
438 . 1 . 1 41 41 4HH CQ C 13 176.553 0.000 . 1 . . . . A 37 4HH CQ . 34868 1
439 . 1 . 1 41 41 4HH CS C 13 45.069 0.036 . 1 . . . . A 37 4HH CS . 34868 1
440 . 1 . 1 41 41 4HH CT C 13 26.008 0.017 . 1 . . . . A 37 4HH CT . 34868 1
441 . 1 . 1 41 41 4HH HA H 1 3.866 0.023 . 1 . . . . A 37 4HH HA . 34868 1
442 . 1 . 1 41 41 4HH HB2 H 1 4.186 0.012 . 2 . . . . A 37 4HH HB2 . 34868 1
443 . 1 . 1 41 41 4HH HB3 H 1 4.189 0.012 . 2 . . . . A 37 4HH HB2 . 34868 1
444 . 1 . 1 41 41 4HH HJ2 H 1 3.817 0.003 . 2 . . . . A 37 4HH HJ2 . 34868 1
445 . 1 . 1 41 41 4HH HJ3 H 1 3.398 0.006 . 2 . . . . A 37 4HH HJ3 . 34868 1
446 . 1 . 1 41 41 4HH HL11 H 1 1.008 0.001 . 1 . . . . A 37 4HH HL11 . 34868 1
447 . 1 . 1 41 41 4HH HL12 H 1 1.008 0.001 . 1 . . . . A 37 4HH HL12 . 34868 1
448 . 1 . 1 41 41 4HH HL13 H 1 1.008 0.001 . 1 . . . . A 37 4HH HL13 . 34868 1
449 . 1 . 1 41 41 4HH HL21 H 1 0.860 0.002 . 1 . . . . A 37 4HH HL21 . 34868 1
450 . 1 . 1 41 41 4HH HL22 H 1 0.860 0.002 . 1 . . . . A 37 4HH HL22 . 34868 1
451 . 1 . 1 41 41 4HH HL23 H 1 0.860 0.002 . 1 . . . . A 37 4HH HL23 . 34868 1
452 . 1 . 1 41 41 4HH HL3 H 1 4.034 0.002 . 1 . . . . A 37 4HH HL3 . 34868 1
453 . 1 . 1 41 41 4HH HN H 1 7.917 0.021 . 1 . . . . A 37 4HH HN . 34868 1
454 . 1 . 1 41 41 4HH HO2 H 1 3.424 0.010 . 1 . . . . A 37 4HH HO2 . 34868 1
455 . 1 . 1 41 41 4HH HO3 H 1 3.424 0.010 . 1 . . . . A 37 4HH HO3 . 34868 1
456 . 1 . 1 41 41 4HH HP2 H 1 2.410 0.002 . 1 . . . . A 37 4HH HP2 . 34868 1
457 . 1 . 1 41 41 4HH HP3 H 1 2.410 0.002 . 1 . . . . A 37 4HH HP3 . 34868 1
458 . 1 . 1 41 41 4HH HR H 1 8.081 0.011 . 1 . . . . A 37 4HH HR . 34868 1
459 . 1 . 1 41 41 4HH HS2 H 1 3.293 0.002 . 1 . . . . A 37 4HH HS2 . 34868 1
460 . 1 . 1 41 41 4HH HS3 H 1 3.293 0.002 . 1 . . . . A 37 4HH HS3 . 34868 1
461 . 1 . 1 41 41 4HH HT2 H 1 2.588 0.002 . 1 . . . . A 37 4HH HT2 . 34868 1
462 . 1 . 1 41 41 4HH HT3 H 1 2.588 0.002 . 1 . . . . A 37 4HH HT3 . 34868 1
463 . 1 . 1 41 41 4HH NN N 15 119.915 0.018 . 1 . . . . A 37 4HH NN . 34868 1
464 . 1 . 1 41 41 4HH NR N 15 124.014 0.015 . 1 . . . . A 37 4HH NR . 34868 1
465 . 1 . 1 42 42 LEU H H 1 8.146 0.011 . 1 . . . . A 38 LEU H . 34868 1
466 . 1 . 1 42 42 LEU HA H 1 4.168 0.016 . 1 . . . . A 38 LEU HA . 34868 1
467 . 1 . 1 42 42 LEU HB2 H 1 1.606 0.007 . 2 . . . . A 38 LEU HB2 . 34868 1
468 . 1 . 1 42 42 LEU HB3 H 1 1.487 0.012 . 2 . . . . A 38 LEU HB3 . 34868 1
469 . 1 . 1 42 42 LEU HG H 1 1.610 0.008 . 1 . . . . A 38 LEU HG . 34868 1
470 . 1 . 1 42 42 LEU HD11 H 1 0.873 0.013 . 2 . . . . A 38 LEU HD11 . 34868 1
471 . 1 . 1 42 42 LEU HD12 H 1 0.873 0.013 . 2 . . . . A 38 LEU HD12 . 34868 1
472 . 1 . 1 42 42 LEU HD13 H 1 0.873 0.013 . 2 . . . . A 38 LEU HD13 . 34868 1
473 . 1 . 1 42 42 LEU HD21 H 1 0.900 0.013 . 2 . . . . A 38 LEU HD21 . 34868 1
474 . 1 . 1 42 42 LEU HD22 H 1 0.900 0.013 . 2 . . . . A 38 LEU HD22 . 34868 1
475 . 1 . 1 42 42 LEU HD23 H 1 0.900 0.013 . 2 . . . . A 38 LEU HD23 . 34868 1
476 . 1 . 1 42 42 LEU C C 13 179.525 0.000 . 1 . . . . A 38 LEU C . 34868 1
477 . 1 . 1 42 42 LEU CA C 13 57.758 0.023 . 1 . . . . A 38 LEU CA . 34868 1
478 . 1 . 1 42 42 LEU CB C 13 41.142 0.036 . 1 . . . . A 38 LEU CB . 34868 1
479 . 1 . 1 42 42 LEU CG C 13 27.092 0.053 . 1 . . . . A 38 LEU CG . 34868 1
480 . 1 . 1 42 42 LEU CD1 C 13 24.123 0.024 . 2 . . . . A 38 LEU CD1 . 34868 1
481 . 1 . 1 42 42 LEU CD2 C 13 24.142 0.044 . 2 . . . . A 38 LEU CD2 . 34868 1
482 . 1 . 1 42 42 LEU N N 15 122.822 0.022 . 1 . . . . A 38 LEU N . 34868 1
483 . 1 . 1 43 43 HIS H H 1 7.766 0.008 . 1 . . . . A 39 HIS H . 34868 1
484 . 1 . 1 43 43 HIS HA H 1 4.445 0.013 . 1 . . . . A 39 HIS HA . 34868 1
485 . 1 . 1 43 43 HIS HB2 H 1 3.180 0.002 . 2 . . . . A 39 HIS HB2 . 34868 1
486 . 1 . 1 43 43 HIS HB3 H 1 2.965 0.010 . 2 . . . . A 39 HIS HB3 . 34868 1
487 . 1 . 1 43 43 HIS HD2 H 1 6.722 0.000 . 1 . . . . A 39 HIS HD2 . 34868 1
488 . 1 . 1 43 43 HIS C C 13 178.299 0.000 . 1 . . . . A 39 HIS C . 34868 1
489 . 1 . 1 43 43 HIS CA C 13 57.593 0.057 . 1 . . . . A 39 HIS CA . 34868 1
490 . 1 . 1 43 43 HIS CB C 13 31.303 0.018 . 1 . . . . A 39 HIS CB . 34868 1
491 . 1 . 1 43 43 HIS CD2 C 13 117.258 0.000 . 1 . . . . A 39 HIS CD2 . 34868 1
492 . 1 . 1 43 43 HIS N N 15 117.531 0.038 . 1 . . . . A 39 HIS N . 34868 1
493 . 1 . 1 44 44 PHE H H 1 7.823 0.010 . 1 . . . . A 40 PHE H . 34868 1
494 . 1 . 1 44 44 PHE HA H 1 4.409 0.010 . 1 . . . . A 40 PHE HA . 34868 1
495 . 1 . 1 44 44 PHE HB2 H 1 2.986 0.002 . 2 . . . . A 40 PHE HB2 . 34868 1
496 . 1 . 1 44 44 PHE HB3 H 1 3.361 0.008 . 2 . . . . A 40 PHE HB3 . 34868 1
497 . 1 . 1 44 44 PHE HD1 H 1 6.965 0.016 . 1 . . . . A 40 PHE HD1 . 34868 1
498 . 1 . 1 44 44 PHE HD2 H 1 6.965 0.016 . 1 . . . . A 40 PHE HD2 . 34868 1
499 . 1 . 1 44 44 PHE HE1 H 1 7.092 0.000 . 1 . . . . A 40 PHE HE1 . 34868 1
500 . 1 . 1 44 44 PHE HE2 H 1 7.092 0.000 . 1 . . . . A 40 PHE HE2 . 34868 1
501 . 1 . 1 44 44 PHE C C 13 177.534 0.000 . 1 . . . . A 40 PHE C . 34868 1
502 . 1 . 1 44 44 PHE CA C 13 59.672 0.038 . 1 . . . . A 40 PHE CA . 34868 1
503 . 1 . 1 44 44 PHE CB C 13 37.758 0.025 . 1 . . . . A 40 PHE CB . 34868 1
504 . 1 . 1 44 44 PHE CD1 C 13 130.353 0.000 . 1 . . . . A 40 PHE CD1 . 34868 1
505 . 1 . 1 44 44 PHE CD2 C 13 130.353 0.000 . 1 . . . . A 40 PHE CD2 . 34868 1
506 . 1 . 1 44 44 PHE CE1 C 13 131.416 0.000 . 1 . . . . A 40 PHE CE1 . 34868 1
507 . 1 . 1 44 44 PHE CE2 C 13 131.416 0.000 . 1 . . . . A 40 PHE CE2 . 34868 1
508 . 1 . 1 44 44 PHE N N 15 118.186 0.032 . 1 . . . . A 40 PHE N . 34868 1
509 . 1 . 1 45 45 VAL H H 1 7.670 0.011 . 1 . . . . A 41 VAL H . 34868 1
510 . 1 . 1 45 45 VAL HA H 1 3.855 0.008 . 1 . . . . A 41 VAL HA . 34868 1
511 . 1 . 1 45 45 VAL HB H 1 2.344 0.007 . 1 . . . . A 41 VAL HB . 34868 1
512 . 1 . 1 45 45 VAL HG11 H 1 1.060 0.011 . 2 . . . . A 41 VAL HG11 . 34868 1
513 . 1 . 1 45 45 VAL HG12 H 1 1.060 0.011 . 2 . . . . A 41 VAL HG12 . 34868 1
514 . 1 . 1 45 45 VAL HG13 H 1 1.060 0.011 . 2 . . . . A 41 VAL HG13 . 34868 1
515 . 1 . 1 45 45 VAL HG21 H 1 1.228 0.007 . 2 . . . . A 41 VAL HG21 . 34868 1
516 . 1 . 1 45 45 VAL HG22 H 1 1.228 0.007 . 2 . . . . A 41 VAL HG22 . 34868 1
517 . 1 . 1 45 45 VAL HG23 H 1 1.228 0.007 . 2 . . . . A 41 VAL HG23 . 34868 1
518 . 1 . 1 45 45 VAL C C 13 179.287 0.000 . 1 . . . . A 41 VAL C . 34868 1
519 . 1 . 1 45 45 VAL CA C 13 65.707 0.020 . 1 . . . . A 41 VAL CA . 34868 1
520 . 1 . 1 45 45 VAL CB C 13 32.131 0.038 . 1 . . . . A 41 VAL CB . 34868 1
521 . 1 . 1 45 45 VAL CG1 C 13 20.914 0.040 . 2 . . . . A 41 VAL CG1 . 34868 1
522 . 1 . 1 45 45 VAL CG2 C 13 22.694 0.021 . 2 . . . . A 41 VAL CG2 . 34868 1
523 . 1 . 1 45 45 VAL N N 15 119.594 0.033 . 1 . . . . A 41 VAL N . 34868 1
524 . 1 . 1 46 46 GLN H H 1 7.984 0.007 . 1 . . . . A 42 GLN H . 34868 1
525 . 1 . 1 46 46 GLN HA H 1 4.157 0.007 . 1 . . . . A 42 GLN HA . 34868 1
526 . 1 . 1 46 46 GLN HB2 H 1 2.057 0.016 . 2 . . . . A 42 GLN HB2 . 34868 1
527 . 1 . 1 46 46 GLN HB3 H 1 2.317 0.009 . 2 . . . . A 42 GLN HB3 . 34868 1
528 . 1 . 1 46 46 GLN HG2 H 1 2.449 0.006 . 2 . . . . A 42 GLN HG2 . 34868 1
529 . 1 . 1 46 46 GLN HG3 H 1 2.619 0.004 . 2 . . . . A 42 GLN HG3 . 34868 1
530 . 1 . 1 46 46 GLN HE21 H 1 6.876 0.002 . 1 . . . . A 42 GLN HE21 . 34868 1
531 . 1 . 1 46 46 GLN HE22 H 1 7.300 0.000 . 1 . . . . A 42 GLN HE22 . 34868 1
532 . 1 . 1 46 46 GLN C C 13 178.832 0.000 . 1 . . . . A 42 GLN C . 34868 1
533 . 1 . 1 46 46 GLN CA C 13 58.803 0.040 . 1 . . . . A 42 GLN CA . 34868 1
534 . 1 . 1 46 46 GLN CB C 13 29.015 0.067 . 1 . . . . A 42 GLN CB . 34868 1
535 . 1 . 1 46 46 GLN CG C 13 34.519 0.051 . 1 . . . . A 42 GLN CG . 34868 1
536 . 1 . 1 46 46 GLN N N 15 118.950 0.027 . 1 . . . . A 42 GLN N . 34868 1
537 . 1 . 1 46 46 GLN NE2 N 15 110.229 0.000 . 1 . . . . A 42 GLN NE2 . 34868 1
538 . 1 . 1 47 47 LEU H H 1 8.552 0.009 . 1 . . . . A 43 LEU H . 34868 1
539 . 1 . 1 47 47 LEU HA H 1 3.970 0.009 . 1 . . . . A 43 LEU HA . 34868 1
540 . 1 . 1 47 47 LEU HB2 H 1 2.038 0.008 . 2 . . . . A 43 LEU HB2 . 34868 1
541 . 1 . 1 47 47 LEU HB3 H 1 1.681 0.012 . 2 . . . . A 43 LEU HB3 . 34868 1
542 . 1 . 1 47 47 LEU HG H 1 1.382 0.007 . 1 . . . . A 43 LEU HG . 34868 1
543 . 1 . 1 47 47 LEU HD11 H 1 0.332 0.010 . 2 . . . . A 43 LEU HD11 . 34868 1
544 . 1 . 1 47 47 LEU HD12 H 1 0.332 0.010 . 2 . . . . A 43 LEU HD12 . 34868 1
545 . 1 . 1 47 47 LEU HD13 H 1 0.332 0.010 . 2 . . . . A 43 LEU HD13 . 34868 1
546 . 1 . 1 47 47 LEU HD21 H 1 0.992 0.014 . 2 . . . . A 43 LEU HD21 . 34868 1
547 . 1 . 1 47 47 LEU HD22 H 1 0.992 0.014 . 2 . . . . A 43 LEU HD22 . 34868 1
548 . 1 . 1 47 47 LEU HD23 H 1 0.992 0.014 . 2 . . . . A 43 LEU HD23 . 34868 1
549 . 1 . 1 47 47 LEU C C 13 177.398 0.000 . 1 . . . . A 43 LEU C . 34868 1
550 . 1 . 1 47 47 LEU CA C 13 58.488 0.061 . 1 . . . . A 43 LEU CA . 34868 1
551 . 1 . 1 47 47 LEU CB C 13 41.792 0.044 . 1 . . . . A 43 LEU CB . 34868 1
552 . 1 . 1 47 47 LEU CG C 13 26.908 0.076 . 1 . . . . A 43 LEU CG . 34868 1
553 . 1 . 1 47 47 LEU CD1 C 13 25.734 0.038 . 2 . . . . A 43 LEU CD1 . 34868 1
554 . 1 . 1 47 47 LEU CD2 C 13 23.415 0.033 . 2 . . . . A 43 LEU CD2 . 34868 1
555 . 1 . 1 47 47 LEU N N 15 121.491 0.016 . 1 . . . . A 43 LEU N . 34868 1
556 . 1 . 1 48 48 ALA H H 1 8.138 0.011 . 1 . . . . A 44 ALA H . 34868 1
557 . 1 . 1 48 48 ALA HA H 1 3.695 0.005 . 1 . . . . A 44 ALA HA . 34868 1
558 . 1 . 1 48 48 ALA HB1 H 1 1.374 0.006 . 1 . . . . A 44 ALA HB1 . 34868 1
559 . 1 . 1 48 48 ALA HB2 H 1 1.374 0.006 . 1 . . . . A 44 ALA HB2 . 34868 1
560 . 1 . 1 48 48 ALA HB3 H 1 1.374 0.006 . 1 . . . . A 44 ALA HB3 . 34868 1
561 . 1 . 1 48 48 ALA C C 13 178.515 0.000 . 1 . . . . A 44 ALA C . 34868 1
562 . 1 . 1 48 48 ALA CA C 13 56.204 0.019 . 1 . . . . A 44 ALA CA . 34868 1
563 . 1 . 1 48 48 ALA CB C 13 17.309 0.018 . 1 . . . . A 44 ALA CB . 34868 1
564 . 1 . 1 48 48 ALA N N 15 120.588 0.026 . 1 . . . . A 44 ALA N . 34868 1
565 . 1 . 1 49 49 SER H H 1 7.869 0.012 . 1 . . . . A 45 SER H . 34868 1
566 . 1 . 1 49 49 SER HA H 1 4.286 0.003 . 1 . . . . A 45 SER HA . 34868 1
567 . 1 . 1 49 49 SER HB2 H 1 4.017 0.017 . 2 . . . . A 45 SER HB2 . 34868 1
568 . 1 . 1 49 49 SER HB3 H 1 4.037 0.008 . 2 . . . . A 45 SER HB3 . 34868 1
569 . 1 . 1 49 49 SER C C 13 177.616 0.000 . 1 . . . . A 45 SER C . 34868 1
570 . 1 . 1 49 49 SER CA C 13 61.405 0.036 . 1 . . . . A 45 SER CA . 34868 1
571 . 1 . 1 49 49 SER CB C 13 63.127 0.043 . 1 . . . . A 45 SER CB . 34868 1
572 . 1 . 1 49 49 SER N N 15 110.210 0.020 . 1 . . . . A 45 SER N . 34868 1
573 . 1 . 1 50 50 ARG H H 1 8.353 0.013 . 1 . . . . A 46 ARG H . 34868 1
574 . 1 . 1 50 50 ARG HA H 1 4.145 0.006 . 1 . . . . A 46 ARG HA . 34868 1
575 . 1 . 1 50 50 ARG HB2 H 1 2.123 0.001 . 2 . . . . A 46 ARG HB2 . 34868 1
576 . 1 . 1 50 50 ARG HB3 H 1 1.916 0.000 . 2 . . . . A 46 ARG HB3 . 34868 1
577 . 1 . 1 50 50 ARG HG2 H 1 1.749 0.006 . 1 . . . . A 46 ARG HG2 . 34868 1
578 . 1 . 1 50 50 ARG HG3 H 1 1.749 0.006 . 1 . . . . A 46 ARG HG3 . 34868 1
579 . 1 . 1 50 50 ARG HD2 H 1 3.168 0.000 . 2 . . . . A 46 ARG HD2 . 34868 1
580 . 1 . 1 50 50 ARG HD3 H 1 3.288 0.011 . 2 . . . . A 46 ARG HD3 . 34868 1
581 . 1 . 1 50 50 ARG C C 13 177.874 0.000 . 1 . . . . A 46 ARG C . 34868 1
582 . 1 . 1 50 50 ARG CA C 13 59.090 0.014 . 1 . . . . A 46 ARG CA . 34868 1
583 . 1 . 1 50 50 ARG CB C 13 29.890 0.015 . 1 . . . . A 46 ARG CB . 34868 1
584 . 1 . 1 50 50 ARG CG C 13 26.754 0.013 . 1 . . . . A 46 ARG CG . 34868 1
585 . 1 . 1 50 50 ARG CD C 13 42.845 0.088 . 1 . . . . A 46 ARG CD . 34868 1
586 . 1 . 1 50 50 ARG N N 15 121.635 0.018 . 1 . . . . A 46 ARG N . 34868 1
587 . 1 . 1 51 51 LEU H H 1 8.530 0.013 . 1 . . . . A 47 LEU H . 34868 1
588 . 1 . 1 51 51 LEU HA H 1 4.078 0.008 . 1 . . . . A 47 LEU HA . 34868 1
589 . 1 . 1 51 51 LEU HB2 H 1 1.501 0.006 . 2 . . . . A 47 LEU HB2 . 34868 1
590 . 1 . 1 51 51 LEU HB3 H 1 2.119 0.015 . 2 . . . . A 47 LEU HB3 . 34868 1
591 . 1 . 1 51 51 LEU HG H 1 2.315 0.017 . 1 . . . . A 47 LEU HG . 34868 1
592 . 1 . 1 51 51 LEU HD11 H 1 0.953 0.012 . 2 . . . . A 47 LEU HD11 . 34868 1
593 . 1 . 1 51 51 LEU HD12 H 1 0.953 0.012 . 2 . . . . A 47 LEU HD12 . 34868 1
594 . 1 . 1 51 51 LEU HD13 H 1 0.953 0.012 . 2 . . . . A 47 LEU HD13 . 34868 1
595 . 1 . 1 51 51 LEU HD21 H 1 0.955 0.012 . 2 . . . . A 47 LEU HD21 . 34868 1
596 . 1 . 1 51 51 LEU HD22 H 1 0.955 0.012 . 2 . . . . A 47 LEU HD22 . 34868 1
597 . 1 . 1 51 51 LEU HD23 H 1 0.955 0.012 . 2 . . . . A 47 LEU HD23 . 34868 1
598 . 1 . 1 51 51 LEU C C 13 178.832 0.000 . 1 . . . . A 47 LEU C . 34868 1
599 . 1 . 1 51 51 LEU CA C 13 57.976 0.073 . 1 . . . . A 47 LEU CA . 34868 1
600 . 1 . 1 51 51 LEU CB C 13 41.135 0.017 . 1 . . . . A 47 LEU CB . 34868 1
601 . 1 . 1 51 51 LEU CG C 13 26.567 0.009 . 1 . . . . A 47 LEU CG . 34868 1
602 . 1 . 1 51 51 LEU CD1 C 13 27.036 0.049 . 2 . . . . A 47 LEU CD1 . 34868 1
603 . 1 . 1 51 51 LEU CD2 C 13 27.021 0.040 . 2 . . . . A 47 LEU CD2 . 34868 1
604 . 1 . 1 51 51 LEU N N 15 116.828 0.021 . 1 . . . . A 47 LEU N . 34868 1
605 . 1 . 1 52 52 GLN H H 1 8.428 0.014 . 1 . . . . A 48 GLN H . 34868 1
606 . 1 . 1 52 52 GLN HA H 1 4.666 0.004 . 1 . . . . A 48 GLN HA . 34868 1
607 . 1 . 1 52 52 GLN HB2 H 1 2.284 0.003 . 2 . . . . A 48 GLN HB2 . 34868 1
608 . 1 . 1 52 52 GLN HB3 H 1 2.497 0.006 . 2 . . . . A 48 GLN HB3 . 34868 1
609 . 1 . 1 52 52 GLN HG2 H 1 2.748 0.001 . 2 . . . . A 48 GLN HG2 . 34868 1
610 . 1 . 1 52 52 GLN HG3 H 1 2.414 0.000 . 2 . . . . A 48 GLN HG3 . 34868 1
611 . 1 . 1 52 52 GLN HE21 H 1 6.742 0.002 . 1 . . . . A 48 GLN HE21 . 34868 1
612 . 1 . 1 52 52 GLN HE22 H 1 7.402 0.002 . 1 . . . . A 48 GLN HE22 . 34868 1
613 . 1 . 1 52 52 GLN C C 13 179.828 0.000 . 1 . . . . A 48 GLN C . 34868 1
614 . 1 . 1 52 52 GLN CA C 13 59.418 0.031 . 1 . . . . A 48 GLN CA . 34868 1
615 . 1 . 1 52 52 GLN CB C 13 28.659 0.029 . 1 . . . . A 48 GLN CB . 34868 1
616 . 1 . 1 52 52 GLN CG C 13 33.559 0.042 . 1 . . . . A 48 GLN CG . 34868 1
617 . 1 . 1 52 52 GLN N N 15 120.408 0.025 . 1 . . . . A 48 GLN N . 34868 1
618 . 1 . 1 52 52 GLN NE2 N 15 110.132 0.024 . 1 . . . . A 48 GLN NE2 . 34868 1
619 . 1 . 1 53 53 LYS H H 1 7.684 0.009 . 1 . . . . A 49 LYS H . 34868 1
620 . 1 . 1 53 53 LYS HA H 1 4.105 0.012 . 1 . . . . A 49 LYS HA . 34868 1
621 . 1 . 1 53 53 LYS HB2 H 1 2.016 0.004 . 1 . . . . A 49 LYS HB2 . 34868 1
622 . 1 . 1 53 53 LYS HB3 H 1 2.016 0.004 . 1 . . . . A 49 LYS HB3 . 34868 1
623 . 1 . 1 53 53 LYS HG2 H 1 1.517 0.020 . 2 . . . . A 49 LYS HG2 . 34868 1
624 . 1 . 1 53 53 LYS HG3 H 1 1.536 0.011 . 2 . . . . A 49 LYS HG3 . 34868 1
625 . 1 . 1 53 53 LYS HD2 H 1 1.715 0.004 . 1 . . . . A 49 LYS HD2 . 34868 1
626 . 1 . 1 53 53 LYS HD3 H 1 1.715 0.004 . 1 . . . . A 49 LYS HD3 . 34868 1
627 . 1 . 1 53 53 LYS HE2 H 1 2.985 0.002 . 1 . . . . A 49 LYS HE2 . 34868 1
628 . 1 . 1 53 53 LYS HE3 H 1 2.986 0.001 . 1 . . . . A 49 LYS HE3 . 34868 1
629 . 1 . 1 53 53 LYS C C 13 178.625 0.000 . 1 . . . . A 49 LYS C . 34868 1
630 . 1 . 1 53 53 LYS CA C 13 58.919 0.075 . 1 . . . . A 49 LYS CA . 34868 1
631 . 1 . 1 53 53 LYS CB C 13 32.366 0.065 . 1 . . . . A 49 LYS CB . 34868 1
632 . 1 . 1 53 53 LYS CG C 13 25.042 0.058 . 1 . . . . A 49 LYS CG . 34868 1
633 . 1 . 1 53 53 LYS CD C 13 28.992 0.025 . 1 . . . . A 49 LYS CD . 34868 1
634 . 1 . 1 53 53 LYS CE C 13 42.190 0.073 . 1 . . . . A 49 LYS CE . 34868 1
635 . 1 . 1 53 53 LYS N N 15 119.346 0.020 . 1 . . . . A 49 LYS N . 34868 1
636 . 1 . 1 54 54 ILE H H 1 8.208 0.011 . 1 . . . . A 50 ILE H . 34868 1
637 . 1 . 1 54 54 ILE HA H 1 3.603 0.004 . 1 . . . . A 50 ILE HA . 34868 1
638 . 1 . 1 54 54 ILE HB H 1 1.212 0.004 . 1 . . . . A 50 ILE HB . 34868 1
639 . 1 . 1 54 54 ILE HG12 H 1 1.675 0.004 . 2 . . . . A 50 ILE HG12 . 34868 1
640 . 1 . 1 54 54 ILE HG13 H 1 0.818 0.034 . 2 . . . . A 50 ILE HG13 . 34868 1
641 . 1 . 1 54 54 ILE HG21 H 1 0.046 0.003 . 1 . . . . A 50 ILE HG21 . 34868 1
642 . 1 . 1 54 54 ILE HG22 H 1 0.046 0.003 . 1 . . . . A 50 ILE HG22 . 34868 1
643 . 1 . 1 54 54 ILE HG23 H 1 0.046 0.003 . 1 . . . . A 50 ILE HG23 . 34868 1
644 . 1 . 1 54 54 ILE HD11 H 1 0.609 0.006 . 1 . . . . A 50 ILE HD11 . 34868 1
645 . 1 . 1 54 54 ILE HD12 H 1 0.609 0.006 . 1 . . . . A 50 ILE HD12 . 34868 1
646 . 1 . 1 54 54 ILE HD13 H 1 0.609 0.006 . 1 . . . . A 50 ILE HD13 . 34868 1
647 . 1 . 1 54 54 ILE CA C 13 65.119 0.101 . 1 . . . . A 50 ILE CA . 34868 1
648 . 1 . 1 54 54 ILE CB C 13 39.556 0.042 . 1 . . . . A 50 ILE CB . 34868 1
649 . 1 . 1 54 54 ILE CG1 C 13 28.410 0.059 . 1 . . . . A 50 ILE CG1 . 34868 1
650 . 1 . 1 54 54 ILE CG2 C 13 16.569 0.026 . 1 . . . . A 50 ILE CG2 . 34868 1
651 . 1 . 1 54 54 ILE CD1 C 13 13.939 0.026 . 1 . . . . A 50 ILE CD1 . 34868 1
652 . 1 . 1 54 54 ILE N N 15 117.128 0.028 . 1 . . . . A 50 ILE N . 34868 1
653 . 1 . 1 55 55 PHE HA H 1 4.757 0.011 . 1 . . . . A 51 PHE HA . 34868 1
654 . 1 . 1 55 55 PHE HB2 H 1 2.899 0.003 . 2 . . . . A 51 PHE HB2 . 34868 1
655 . 1 . 1 55 55 PHE HB3 H 1 3.153 0.003 . 2 . . . . A 51 PHE HB3 . 34868 1
656 . 1 . 1 55 55 PHE HD1 H 1 7.450 0.000 . 1 . . . . A 51 PHE HD1 . 34868 1
657 . 1 . 1 55 55 PHE HD2 H 1 7.450 0.000 . 1 . . . . A 51 PHE HD2 . 34868 1
658 . 1 . 1 55 55 PHE HE1 H 1 7.223 0.000 . 1 . . . . A 51 PHE HE1 . 34868 1
659 . 1 . 1 55 55 PHE HE2 H 1 7.223 0.000 . 1 . . . . A 51 PHE HE2 . 34868 1
660 . 1 . 1 55 55 PHE C C 13 177.199 0.000 . 1 . . . . A 51 PHE C . 34868 1
661 . 1 . 1 55 55 PHE CA C 13 58.957 0.044 . 1 . . . . A 51 PHE CA . 34868 1
662 . 1 . 1 55 55 PHE CB C 13 40.599 0.011 . 1 . . . . A 51 PHE CB . 34868 1
663 . 1 . 1 55 55 PHE CD1 C 13 132.181 0.000 . 1 . . . . A 51 PHE CD1 . 34868 1
664 . 1 . 1 55 55 PHE CD2 C 13 132.181 0.000 . 1 . . . . A 51 PHE CD2 . 34868 1
665 . 1 . 1 55 55 PHE CE1 C 13 131.438 0.000 . 1 . . . . A 51 PHE CE1 . 34868 1
666 . 1 . 1 55 55 PHE CE2 C 13 131.438 0.000 . 1 . . . . A 51 PHE CE2 . 34868 1
667 . 1 . 1 56 56 GLY H H 1 8.262 0.011 . 1 . . . . A 52 GLY H . 34868 1
668 . 1 . 1 56 56 GLY HA2 H 1 4.000 0.004 . 1 . . . . A 52 GLY HA2 . 34868 1
669 . 1 . 1 56 56 GLY HA3 H 1 4.000 0.004 . 1 . . . . A 52 GLY HA3 . 34868 1
670 . 1 . 1 56 56 GLY C C 13 173.842 0.000 . 1 . . . . A 52 GLY C . 34868 1
671 . 1 . 1 56 56 GLY CA C 13 47.051 0.037 . 1 . . . . A 52 GLY CA . 34868 1
672 . 1 . 1 56 56 GLY N N 15 109.397 0.031 . 1 . . . . A 52 GLY N . 34868 1
673 . 1 . 1 57 57 VAL H H 1 6.833 0.010 . 1 . . . . A 53 VAL H . 34868 1
674 . 1 . 1 57 57 VAL HA H 1 4.488 0.002 . 1 . . . . A 53 VAL HA . 34868 1
675 . 1 . 1 57 57 VAL HB H 1 1.955 0.002 . 1 . . . . A 53 VAL HB . 34868 1
676 . 1 . 1 57 57 VAL HG11 H 1 0.771 0.010 . 2 . . . . A 53 VAL HG11 . 34868 1
677 . 1 . 1 57 57 VAL HG12 H 1 0.771 0.010 . 2 . . . . A 53 VAL HG12 . 34868 1
678 . 1 . 1 57 57 VAL HG13 H 1 0.771 0.010 . 2 . . . . A 53 VAL HG13 . 34868 1
679 . 1 . 1 57 57 VAL HG21 H 1 0.669 0.010 . 2 . . . . A 53 VAL HG21 . 34868 1
680 . 1 . 1 57 57 VAL HG22 H 1 0.669 0.010 . 2 . . . . A 53 VAL HG22 . 34868 1
681 . 1 . 1 57 57 VAL HG23 H 1 0.669 0.010 . 2 . . . . A 53 VAL HG23 . 34868 1
682 . 1 . 1 57 57 VAL C C 13 173.678 0.000 . 1 . . . . A 53 VAL C . 34868 1
683 . 1 . 1 57 57 VAL CA C 13 58.263 0.052 . 1 . . . . A 53 VAL CA . 34868 1
684 . 1 . 1 57 57 VAL CB C 13 34.672 0.043 . 1 . . . . A 53 VAL CB . 34868 1
685 . 1 . 1 57 57 VAL CG1 C 13 21.465 0.027 . 2 . . . . A 53 VAL CG1 . 34868 1
686 . 1 . 1 57 57 VAL CG2 C 13 19.075 0.067 . 2 . . . . A 53 VAL CG2 . 34868 1
687 . 1 . 1 57 57 VAL N N 15 111.467 0.018 . 1 . . . . A 53 VAL N . 34868 1
688 . 1 . 1 58 58 GLU H H 1 8.269 0.011 . 1 . . . . A 54 GLU H . 34868 1
689 . 1 . 1 58 58 GLU HA H 1 4.113 0.005 . 1 . . . . A 54 GLU HA . 34868 1
690 . 1 . 1 58 58 GLU HB2 H 1 1.960 0.006 . 2 . . . . A 54 GLU HB2 . 34868 1
691 . 1 . 1 58 58 GLU HB3 H 1 1.948 0.012 . 2 . . . . A 54 GLU HB3 . 34868 1
692 . 1 . 1 58 58 GLU HG2 H 1 2.235 0.027 . 2 . . . . A 54 GLU HG2 . 34868 1
693 . 1 . 1 58 58 GLU HG3 H 1 2.261 0.025 . 2 . . . . A 54 GLU HG3 . 34868 1
694 . 1 . 1 58 58 GLU C C 13 176.391 0.000 . 1 . . . . A 54 GLU C . 34868 1
695 . 1 . 1 58 58 GLU CA C 13 57.314 0.036 . 1 . . . . A 54 GLU CA . 34868 1
696 . 1 . 1 58 58 GLU CB C 13 29.474 0.030 . 1 . . . . A 54 GLU CB . 34868 1
697 . 1 . 1 58 58 GLU CG C 13 36.682 0.067 . 1 . . . . A 54 GLU CG . 34868 1
698 . 1 . 1 58 58 GLU N N 15 121.660 0.026 . 1 . . . . A 54 GLU N . 34868 1
699 . 1 . 1 59 59 VAL H H 1 7.997 0.011 . 1 . . . . A 55 VAL H . 34868 1
700 . 1 . 1 59 59 VAL HA H 1 4.560 0.003 . 1 . . . . A 55 VAL HA . 34868 1
701 . 1 . 1 59 59 VAL HB H 1 2.337 0.005 . 1 . . . . A 55 VAL HB . 34868 1
702 . 1 . 1 59 59 VAL HG11 H 1 1.006 0.009 . 2 . . . . A 55 VAL HG11 . 34868 1
703 . 1 . 1 59 59 VAL HG12 H 1 1.006 0.009 . 2 . . . . A 55 VAL HG12 . 34868 1
704 . 1 . 1 59 59 VAL HG13 H 1 1.006 0.009 . 2 . . . . A 55 VAL HG13 . 34868 1
705 . 1 . 1 59 59 VAL HG21 H 1 0.978 0.015 . 2 . . . . A 55 VAL HG21 . 34868 1
706 . 1 . 1 59 59 VAL HG22 H 1 0.978 0.015 . 2 . . . . A 55 VAL HG22 . 34868 1
707 . 1 . 1 59 59 VAL HG23 H 1 0.978 0.015 . 2 . . . . A 55 VAL HG23 . 34868 1
708 . 1 . 1 59 59 VAL C C 13 173.840 0.000 . 1 . . . . A 55 VAL C . 34868 1
709 . 1 . 1 59 59 VAL CA C 13 61.888 0.040 . 1 . . . . A 55 VAL CA . 34868 1
710 . 1 . 1 59 59 VAL CB C 13 34.299 0.025 . 1 . . . . A 55 VAL CB . 34868 1
711 . 1 . 1 59 59 VAL CG1 C 13 21.829 0.067 . 2 . . . . A 55 VAL CG1 . 34868 1
712 . 1 . 1 59 59 VAL CG2 C 13 21.135 0.017 . 2 . . . . A 55 VAL CG2 . 34868 1
713 . 1 . 1 59 59 VAL N N 15 125.279 0.027 . 1 . . . . A 55 VAL N . 34868 1
714 . 1 . 1 60 60 SER H H 1 9.935 0.009 . 1 . . . . A 56 SER H . 34868 1
715 . 1 . 1 60 60 SER HA H 1 5.041 0.004 . 1 . . . . A 56 SER HA . 34868 1
716 . 1 . 1 60 60 SER HB2 H 1 4.338 0.005 . 2 . . . . A 56 SER HB2 . 34868 1
717 . 1 . 1 60 60 SER HB3 H 1 3.981 0.008 . 2 . . . . A 56 SER HB3 . 34868 1
718 . 1 . 1 60 60 SER C C 13 176.398 0.000 . 1 . . . . A 56 SER C . 34868 1
719 . 1 . 1 60 60 SER CA C 13 56.138 0.036 . 1 . . . . A 56 SER CA . 34868 1
720 . 1 . 1 60 60 SER CB C 13 67.239 0.067 . 1 . . . . A 56 SER CB . 34868 1
721 . 1 . 1 60 60 SER N N 15 123.676 0.024 . 1 . . . . A 56 SER N . 34868 1
722 . 1 . 1 61 61 THR H H 1 8.818 0.017 . 1 . . . . A 57 THR H . 34868 1
723 . 1 . 1 61 61 THR HA H 1 3.601 0.005 . 1 . . . . A 57 THR HA . 34868 1
724 . 1 . 1 61 61 THR HB H 1 4.123 0.005 . 1 . . . . A 57 THR HB . 34868 1
725 . 1 . 1 61 61 THR HG21 H 1 1.277 0.006 . 1 . . . . A 57 THR HG21 . 34868 1
726 . 1 . 1 61 61 THR HG22 H 1 1.277 0.006 . 1 . . . . A 57 THR HG22 . 34868 1
727 . 1 . 1 61 61 THR HG23 H 1 1.277 0.006 . 1 . . . . A 57 THR HG23 . 34868 1
728 . 1 . 1 61 61 THR C C 13 176.457 0.000 . 1 . . . . A 57 THR C . 34868 1
729 . 1 . 1 61 61 THR CA C 13 66.915 0.047 . 1 . . . . A 57 THR CA . 34868 1
730 . 1 . 1 61 61 THR CB C 13 67.893 0.079 . 1 . . . . A 57 THR CB . 34868 1
731 . 1 . 1 61 61 THR CG2 C 13 23.499 0.032 . 1 . . . . A 57 THR CG2 . 34868 1
732 . 1 . 1 61 61 THR N N 15 116.140 0.049 . 1 . . . . A 57 THR N . 34868 1
733 . 1 . 1 62 62 GLU H H 1 8.254 0.015 . 1 . . . . A 58 GLU H . 34868 1
734 . 1 . 1 62 62 GLU HA H 1 4.008 0.015 . 1 . . . . A 58 GLU HA . 34868 1
735 . 1 . 1 62 62 GLU HB2 H 1 1.999 0.006 . 2 . . . . A 58 GLU HB2 . 34868 1
736 . 1 . 1 62 62 GLU HB3 H 1 1.913 0.015 . 2 . . . . A 58 GLU HB3 . 34868 1
737 . 1 . 1 62 62 GLU HG2 H 1 2.284 0.006 . 1 . . . . A 58 GLU HG2 . 34868 1
738 . 1 . 1 62 62 GLU C C 13 178.668 0.000 . 1 . . . . A 58 GLU C . 34868 1
739 . 1 . 1 62 62 GLU CA C 13 60.024 0.052 . 1 . . . . A 58 GLU CA . 34868 1
740 . 1 . 1 62 62 GLU CB C 13 29.079 0.049 . 1 . . . . A 58 GLU CB . 34868 1
741 . 1 . 1 62 62 GLU CG C 13 36.877 0.102 . 1 . . . . A 58 GLU CG . 34868 1
742 . 1 . 1 62 62 GLU N N 15 119.653 0.025 . 1 . . . . A 58 GLU N . 34868 1
743 . 1 . 1 63 63 ASP H H 1 7.674 0.012 . 1 . . . . A 59 ASP H . 34868 1
744 . 1 . 1 63 63 ASP HA H 1 4.145 0.010 . 1 . . . . A 59 ASP HA . 34868 1
745 . 1 . 1 63 63 ASP HB2 H 1 2.966 0.006 . 2 . . . . A 59 ASP HB2 . 34868 1
746 . 1 . 1 63 63 ASP HB3 H 1 1.818 0.011 . 2 . . . . A 59 ASP HB3 . 34868 1
747 . 1 . 1 63 63 ASP C C 13 177.984 0.000 . 1 . . . . A 59 ASP C . 34868 1
748 . 1 . 1 63 63 ASP CA C 13 57.735 0.069 . 1 . . . . A 59 ASP CA . 34868 1
749 . 1 . 1 63 63 ASP CB C 13 41.236 0.016 . 1 . . . . A 59 ASP CB . 34868 1
750 . 1 . 1 63 63 ASP N N 15 119.178 0.032 . 1 . . . . A 59 ASP N . 34868 1
751 . 1 . 1 64 64 VAL H H 1 7.295 0.008 . 1 . . . . A 60 VAL H . 34868 1
752 . 1 . 1 64 64 VAL HA H 1 3.333 0.006 . 1 . . . . A 60 VAL HA . 34868 1
753 . 1 . 1 64 64 VAL HB H 1 1.905 0.010 . 1 . . . . A 60 VAL HB . 34868 1
754 . 1 . 1 64 64 VAL HG11 H 1 0.014 0.014 . 2 . . . . A 60 VAL HG11 . 34868 1
755 . 1 . 1 64 64 VAL HG12 H 1 0.014 0.014 . 2 . . . . A 60 VAL HG12 . 34868 1
756 . 1 . 1 64 64 VAL HG13 H 1 0.014 0.014 . 2 . . . . A 60 VAL HG13 . 34868 1
757 . 1 . 1 64 64 VAL HG21 H 1 0.771 0.005 . 2 . . . . A 60 VAL HG21 . 34868 1
758 . 1 . 1 64 64 VAL HG22 H 1 0.771 0.005 . 2 . . . . A 60 VAL HG22 . 34868 1
759 . 1 . 1 64 64 VAL HG23 H 1 0.771 0.005 . 2 . . . . A 60 VAL HG23 . 34868 1
760 . 1 . 1 64 64 VAL C C 13 176.254 0.000 . 1 . . . . A 60 VAL C . 34868 1
761 . 1 . 1 64 64 VAL CA C 13 66.138 0.035 . 1 . . . . A 60 VAL CA . 34868 1
762 . 1 . 1 64 64 VAL CB C 13 30.938 0.025 . 1 . . . . A 60 VAL CB . 34868 1
763 . 1 . 1 64 64 VAL CG1 C 13 21.719 0.030 . 2 . . . . A 60 VAL CG1 . 34868 1
764 . 1 . 1 64 64 VAL CG2 C 13 21.719 0.034 . 2 . . . . A 60 VAL CG2 . 34868 1
765 . 1 . 1 64 64 VAL N N 15 119.430 0.051 . 1 . . . . A 60 VAL N . 34868 1
766 . 1 . 1 65 65 PHE H H 1 7.370 0.008 . 1 . . . . A 61 PHE H . 34868 1
767 . 1 . 1 65 65 PHE HA H 1 4.156 0.004 . 1 . . . . A 61 PHE HA . 34868 1
768 . 1 . 1 65 65 PHE HB2 H 1 3.034 0.020 . 2 . . . . A 61 PHE HB2 . 34868 1
769 . 1 . 1 65 65 PHE HB3 H 1 3.054 0.015 . 2 . . . . A 61 PHE HB3 . 34868 1
770 . 1 . 1 65 65 PHE HD1 H 1 7.114 0.000 . 1 . . . . A 61 PHE HD1 . 34868 1
771 . 1 . 1 65 65 PHE HD2 H 1 7.114 0.000 . 1 . . . . A 61 PHE HD2 . 34868 1
772 . 1 . 1 65 65 PHE HE1 H 1 7.157 0.000 . 1 . . . . A 61 PHE HE1 . 34868 1
773 . 1 . 1 65 65 PHE HE2 H 1 7.157 0.000 . 1 . . . . A 61 PHE HE2 . 34868 1
774 . 1 . 1 65 65 PHE C C 13 178.319 0.010 . 1 . . . . A 61 PHE C . 34868 1
775 . 1 . 1 65 65 PHE CA C 13 60.441 0.064 . 1 . . . . A 61 PHE CA . 34868 1
776 . 1 . 1 65 65 PHE CB C 13 38.987 0.047 . 1 . . . . A 61 PHE CB . 34868 1
777 . 1 . 1 65 65 PHE CD1 C 13 131.584 0.000 . 1 . . . . A 61 PHE CD1 . 34868 1
778 . 1 . 1 65 65 PHE CD2 C 13 131.584 0.000 . 1 . . . . A 61 PHE CD2 . 34868 1
779 . 1 . 1 65 65 PHE CE1 C 13 131.521 0.000 . 1 . . . . A 61 PHE CE1 . 34868 1
780 . 1 . 1 65 65 PHE CE2 C 13 131.521 0.000 . 1 . . . . A 61 PHE CE2 . 34868 1
781 . 1 . 1 65 65 PHE N N 15 114.911 0.027 . 1 . . . . A 61 PHE N . 34868 1
782 . 1 . 1 66 66 ARG H H 1 7.885 0.011 . 1 . . . . A 62 ARG H . 34868 1
783 . 1 . 1 66 66 ARG HA H 1 3.888 0.004 . 1 . . . . A 62 ARG HA . 34868 1
784 . 1 . 1 66 66 ARG HB2 H 1 1.310 0.008 . 2 . . . . A 62 ARG HB2 . 34868 1
785 . 1 . 1 66 66 ARG HB3 H 1 1.602 0.003 . 2 . . . . A 62 ARG HB3 . 34868 1
786 . 1 . 1 66 66 ARG HG2 H 1 1.182 0.013 . 2 . . . . A 62 ARG HG2 . 34868 1
787 . 1 . 1 66 66 ARG HG3 H 1 1.424 0.011 . 2 . . . . A 62 ARG HG3 . 34868 1
788 . 1 . 1 66 66 ARG HD2 H 1 3.054 0.024 . 2 . . . . A 62 ARG HD2 . 34868 1
789 . 1 . 1 66 66 ARG HD3 H 1 3.031 0.017 . 2 . . . . A 62 ARG HD3 . 34868 1
790 . 1 . 1 66 66 ARG C C 13 176.143 0.000 . 1 . . . . A 62 ARG C . 34868 1
791 . 1 . 1 66 66 ARG CA C 13 58.221 0.023 . 1 . . . . A 62 ARG CA . 34868 1
792 . 1 . 1 66 66 ARG CB C 13 30.951 0.053 . 1 . . . . A 62 ARG CB . 34868 1
793 . 1 . 1 66 66 ARG CG C 13 27.869 0.039 . 1 . . . . A 62 ARG CG . 34868 1
794 . 1 . 1 66 66 ARG CD C 13 43.187 0.015 . 1 . . . . A 62 ARG CD . 34868 1
795 . 1 . 1 66 66 ARG N N 15 116.928 0.021 . 1 . . . . A 62 ARG N . 34868 1
796 . 1 . 1 67 67 HIS H H 1 7.587 0.010 . 1 . . . . A 63 HIS H . 34868 1
797 . 1 . 1 67 67 HIS HA H 1 4.689 0.004 . 1 . . . . A 63 HIS HA . 34868 1
798 . 1 . 1 67 67 HIS HB2 H 1 2.566 0.010 . 2 . . . . A 63 HIS HB2 . 34868 1
799 . 1 . 1 67 67 HIS HB3 H 1 3.019 0.007 . 2 . . . . A 63 HIS HB3 . 34868 1
800 . 1 . 1 67 67 HIS HD2 H 1 6.622 0.014 . 1 . . . . A 63 HIS HD2 . 34868 1
801 . 1 . 1 67 67 HIS HE1 H 1 7.765 0.000 . 1 . . . . A 63 HIS HE1 . 34868 1
802 . 1 . 1 67 67 HIS C C 13 175.791 0.000 . 1 . . . . A 63 HIS C . 34868 1
803 . 1 . 1 67 67 HIS CA C 13 55.018 0.038 . 1 . . . . A 63 HIS CA . 34868 1
804 . 1 . 1 67 67 HIS CB C 13 28.294 0.014 . 1 . . . . A 63 HIS CB . 34868 1
805 . 1 . 1 67 67 HIS CD2 C 13 121.728 0.000 . 1 . . . . A 63 HIS CD2 . 34868 1
806 . 1 . 1 67 67 HIS N N 15 120.027 0.027 . 1 . . . . A 63 HIS N . 34868 1
807 . 1 . 1 68 68 GLY H H 1 7.261 0.010 . 1 . . . . A 64 GLY H . 34868 1
808 . 1 . 1 68 68 GLY HA2 H 1 3.733 0.007 . 2 . . . . A 64 GLY HA2 . 34868 1
809 . 1 . 1 68 68 GLY HA3 H 1 4.364 0.006 . 2 . . . . A 64 GLY HA3 . 34868 1
810 . 1 . 1 68 68 GLY C C 13 174.912 0.000 . 1 . . . . A 64 GLY C . 34868 1
811 . 1 . 1 68 68 GLY CA C 13 49.428 0.021 . 1 . . . . A 64 GLY CA . 34868 1
812 . 1 . 1 68 68 GLY N N 15 103.923 0.048 . 1 . . . . A 64 GLY N . 34868 1
813 . 1 . 1 69 69 THR H H 1 7.717 0.008 . 1 . . . . A 65 THR H . 34868 1
814 . 1 . 1 69 69 THR HA H 1 3.833 0.015 . 1 . . . . A 65 THR HA . 34868 1
815 . 1 . 1 69 69 THR HB H 1 4.171 0.009 . 1 . . . . A 65 THR HB . 34868 1
816 . 1 . 1 69 69 THR HG21 H 1 0.837 0.005 . 1 . . . . A 65 THR HG21 . 34868 1
817 . 1 . 1 69 69 THR HG22 H 1 0.837 0.005 . 1 . . . . A 65 THR HG22 . 34868 1
818 . 1 . 1 69 69 THR HG23 H 1 0.837 0.005 . 1 . . . . A 65 THR HG23 . 34868 1
819 . 1 . 1 69 69 THR C C 13 173.958 0.000 . 1 . . . . A 65 THR C . 34868 1
820 . 1 . 1 69 69 THR CA C 13 58.353 0.020 . 1 . . . . A 65 THR CA . 34868 1
821 . 1 . 1 69 69 THR CB C 13 73.332 0.068 . 1 . . . . A 65 THR CB . 34868 1
822 . 1 . 1 69 69 THR CG2 C 13 21.537 0.032 . 1 . . . . A 65 THR CG2 . 34868 1
823 . 1 . 1 69 69 THR N N 15 111.000 0.035 . 1 . . . . A 65 THR N . 34868 1
824 . 1 . 1 70 70 VAL H H 1 9.980 0.010 . 1 . . . . A 66 VAL H . 34868 1
825 . 1 . 1 70 70 VAL HA H 1 3.579 0.004 . 1 . . . . A 66 VAL HA . 34868 1
826 . 1 . 1 70 70 VAL HB H 1 2.278 0.003 . 1 . . . . A 66 VAL HB . 34868 1
827 . 1 . 1 70 70 VAL HG11 H 1 1.315 0.008 . 2 . . . . A 66 VAL HG11 . 34868 1
828 . 1 . 1 70 70 VAL HG12 H 1 1.315 0.008 . 2 . . . . A 66 VAL HG12 . 34868 1
829 . 1 . 1 70 70 VAL HG13 H 1 1.315 0.008 . 2 . . . . A 66 VAL HG13 . 34868 1
830 . 1 . 1 70 70 VAL HG21 H 1 1.108 0.002 . 2 . . . . A 66 VAL HG21 . 34868 1
831 . 1 . 1 70 70 VAL HG22 H 1 1.108 0.002 . 2 . . . . A 66 VAL HG22 . 34868 1
832 . 1 . 1 70 70 VAL HG23 H 1 1.108 0.002 . 2 . . . . A 66 VAL HG23 . 34868 1
833 . 1 . 1 70 70 VAL C C 13 177.348 0.000 . 1 . . . . A 66 VAL C . 34868 1
834 . 1 . 1 70 70 VAL CA C 13 67.566 0.033 . 1 . . . . A 66 VAL CA . 34868 1
835 . 1 . 1 70 70 VAL CB C 13 30.690 0.049 . 1 . . . . A 66 VAL CB . 34868 1
836 . 1 . 1 70 70 VAL CG1 C 13 23.617 0.023 . 2 . . . . A 66 VAL CG1 . 34868 1
837 . 1 . 1 70 70 VAL CG2 C 13 22.749 0.023 . 2 . . . . A 66 VAL CG2 . 34868 1
838 . 1 . 1 70 70 VAL N N 15 123.578 0.024 . 1 . . . . A 66 VAL N . 34868 1
839 . 1 . 1 71 71 GLU H H 1 8.366 0.012 . 1 . . . . A 67 GLU H . 34868 1
840 . 1 . 1 71 71 GLU HA H 1 3.932 0.007 . 1 . . . . A 67 GLU HA . 34868 1
841 . 1 . 1 71 71 GLU HB2 H 1 1.991 0.007 . 2 . . . . A 67 GLU HB2 . 34868 1
842 . 1 . 1 71 71 GLU HB3 H 1 1.933 0.012 . 2 . . . . A 67 GLU HB3 . 34868 1
843 . 1 . 1 71 71 GLU HG2 H 1 2.343 0.005 . 2 . . . . A 67 GLU HG2 . 34868 1
844 . 1 . 1 71 71 GLU HG3 H 1 2.080 0.004 . 2 . . . . A 67 GLU HG3 . 34868 1
845 . 1 . 1 71 71 GLU C C 13 179.443 0.000 . 1 . . . . A 67 GLU C . 34868 1
846 . 1 . 1 71 71 GLU CA C 13 59.958 0.041 . 1 . . . . A 67 GLU CA . 34868 1
847 . 1 . 1 71 71 GLU CB C 13 30.269 0.019 . 1 . . . . A 67 GLU CB . 34868 1
848 . 1 . 1 71 71 GLU CG C 13 36.093 0.006 . 1 . . . . A 67 GLU CG . 34868 1
849 . 1 . 1 71 71 GLU N N 15 117.468 0.029 . 1 . . . . A 67 GLU N . 34868 1
850 . 1 . 1 72 72 GLN H H 1 7.775 0.010 . 1 . . . . A 68 GLN H . 34868 1
851 . 1 . 1 72 72 GLN HA H 1 4.091 0.009 . 1 . . . . A 68 GLN HA . 34868 1
852 . 1 . 1 72 72 GLN HB2 H 1 1.941 0.011 . 2 . . . . A 68 GLN HB2 . 34868 1
853 . 1 . 1 72 72 GLN HB3 H 1 2.338 0.004 . 2 . . . . A 68 GLN HB3 . 34868 1
854 . 1 . 1 72 72 GLN HG2 H 1 2.478 0.005 . 2 . . . . A 68 GLN HG2 . 34868 1
855 . 1 . 1 72 72 GLN HG3 H 1 2.479 0.006 . 2 . . . . A 68 GLN HG3 . 34868 1
856 . 1 . 1 72 72 GLN HE21 H 1 7.528 0.000 . 1 . . . . A 68 GLN HE21 . 34868 1
857 . 1 . 1 72 72 GLN HE22 H 1 6.909 0.002 . 1 . . . . A 68 GLN HE22 . 34868 1
858 . 1 . 1 72 72 GLN C C 13 178.852 0.000 . 1 . . . . A 68 GLN C . 34868 1
859 . 1 . 1 72 72 GLN CA C 13 58.735 0.030 . 1 . . . . A 68 GLN CA . 34868 1
860 . 1 . 1 72 72 GLN CB C 13 29.630 0.045 . 1 . . . . A 68 GLN CB . 34868 1
861 . 1 . 1 72 72 GLN CG C 13 34.864 0.008 . 1 . . . . A 68 GLN CG . 34868 1
862 . 1 . 1 72 72 GLN N N 15 116.351 0.011 . 1 . . . . A 68 GLN N . 34868 1
863 . 1 . 1 72 72 GLN NE2 N 15 112.178 0.000 . 1 . . . . A 68 GLN NE2 . 34868 1
864 . 1 . 1 73 73 LEU H H 1 9.177 0.011 . 1 . . . . A 69 LEU H . 34868 1
865 . 1 . 1 73 73 LEU HA H 1 4.219 0.006 . 1 . . . . A 69 LEU HA . 34868 1
866 . 1 . 1 73 73 LEU HB2 H 1 1.977 0.007 . 2 . . . . A 69 LEU HB2 . 34868 1
867 . 1 . 1 73 73 LEU HB3 H 1 2.344 0.017 . 2 . . . . A 69 LEU HB3 . 34868 1
868 . 1 . 1 73 73 LEU HG H 1 1.686 0.004 . 1 . . . . A 69 LEU HG . 34868 1
869 . 1 . 1 73 73 LEU HD11 H 1 0.875 0.006 . 2 . . . . A 69 LEU HD11 . 34868 1
870 . 1 . 1 73 73 LEU HD12 H 1 0.875 0.006 . 2 . . . . A 69 LEU HD12 . 34868 1
871 . 1 . 1 73 73 LEU HD13 H 1 0.875 0.006 . 2 . . . . A 69 LEU HD13 . 34868 1
872 . 1 . 1 73 73 LEU HD21 H 1 0.960 0.001 . 2 . . . . A 69 LEU HD21 . 34868 1
873 . 1 . 1 73 73 LEU HD22 H 1 0.960 0.001 . 2 . . . . A 69 LEU HD22 . 34868 1
874 . 1 . 1 73 73 LEU HD23 H 1 0.960 0.001 . 2 . . . . A 69 LEU HD23 . 34868 1
875 . 1 . 1 73 73 LEU C C 13 178.499 0.000 . 1 . . . . A 69 LEU C . 34868 1
876 . 1 . 1 73 73 LEU CA C 13 57.757 0.035 . 1 . . . . A 69 LEU CA . 34868 1
877 . 1 . 1 73 73 LEU CB C 13 41.644 0.032 . 1 . . . . A 69 LEU CB . 34868 1
878 . 1 . 1 73 73 LEU CG C 13 27.253 0.020 . 1 . . . . A 69 LEU CG . 34868 1
879 . 1 . 1 73 73 LEU CD1 C 13 28.257 0.032 . 2 . . . . A 69 LEU CD1 . 34868 1
880 . 1 . 1 73 73 LEU CD2 C 13 22.886 0.055 . 2 . . . . A 69 LEU CD2 . 34868 1
881 . 1 . 1 73 73 LEU N N 15 124.616 0.013 . 1 . . . . A 69 LEU N . 34868 1
882 . 1 . 1 74 74 ALA H H 1 9.112 0.015 . 1 . . . . A 70 ALA H . 34868 1
883 . 1 . 1 74 74 ALA HA H 1 3.794 0.003 . 1 . . . . A 70 ALA HA . 34868 1
884 . 1 . 1 74 74 ALA HB1 H 1 1.409 0.002 . 1 . . . . A 70 ALA HB1 . 34868 1
885 . 1 . 1 74 74 ALA HB2 H 1 1.409 0.002 . 1 . . . . A 70 ALA HB2 . 34868 1
886 . 1 . 1 74 74 ALA HB3 H 1 1.409 0.002 . 1 . . . . A 70 ALA HB3 . 34868 1
887 . 1 . 1 74 74 ALA C C 13 178.845 0.000 . 1 . . . . A 70 ALA C . 34868 1
888 . 1 . 1 74 74 ALA CA C 13 55.569 0.016 . 1 . . . . A 70 ALA CA . 34868 1
889 . 1 . 1 74 74 ALA CB C 13 18.526 0.025 . 1 . . . . A 70 ALA CB . 34868 1
890 . 1 . 1 74 74 ALA N N 15 120.308 0.029 . 1 . . . . A 70 ALA N . 34868 1
891 . 1 . 1 75 75 ARG H H 1 7.284 0.010 . 1 . . . . A 71 ARG H . 34868 1
892 . 1 . 1 75 75 ARG HA H 1 4.089 0.019 . 1 . . . . A 71 ARG HA . 34868 1
893 . 1 . 1 75 75 ARG HB2 H 1 1.952 0.001 . 2 . . . . A 71 ARG HB2 . 34868 1
894 . 1 . 1 75 75 ARG HB3 H 1 1.953 0.002 . 2 . . . . A 71 ARG HB3 . 34868 1
895 . 1 . 1 75 75 ARG HG2 H 1 1.757 0.017 . 2 . . . . A 71 ARG HG2 . 34868 1
896 . 1 . 1 75 75 ARG HG3 H 1 1.713 0.021 . 2 . . . . A 71 ARG HG3 . 34868 1
897 . 1 . 1 75 75 ARG HD2 H 1 3.251 0.002 . 2 . . . . A 71 ARG HD2 . 34868 1
898 . 1 . 1 75 75 ARG HD3 H 1 3.250 0.006 . 2 . . . . A 71 ARG HD3 . 34868 1
899 . 1 . 1 75 75 ARG C C 13 177.927 0.000 . 1 . . . . A 71 ARG C . 34868 1
900 . 1 . 1 75 75 ARG CA C 13 59.190 0.020 . 1 . . . . A 71 ARG CA . 34868 1
901 . 1 . 1 75 75 ARG CB C 13 29.830 0.056 . 1 . . . . A 71 ARG CB . 34868 1
902 . 1 . 1 75 75 ARG CG C 13 27.210 0.055 . 1 . . . . A 71 ARG CG . 34868 1
903 . 1 . 1 75 75 ARG CD C 13 43.470 0.024 . 1 . . . . A 71 ARG CD . 34868 1
904 . 1 . 1 75 75 ARG N N 15 117.125 0.019 . 1 . . . . A 71 ARG N . 34868 1
905 . 1 . 1 76 76 PHE H H 1 7.754 0.010 . 1 . . . . A 72 PHE H . 34868 1
906 . 1 . 1 76 76 PHE HA H 1 4.138 0.007 . 1 . . . . A 72 PHE HA . 34868 1
907 . 1 . 1 76 76 PHE HB2 H 1 2.324 0.010 . 2 . . . . A 72 PHE HB2 . 34868 1
908 . 1 . 1 76 76 PHE HB3 H 1 3.047 0.003 . 2 . . . . A 72 PHE HB3 . 34868 1
909 . 1 . 1 76 76 PHE HD1 H 1 6.896 0.000 . 1 . . . . A 72 PHE HD1 . 34868 1
910 . 1 . 1 76 76 PHE HD2 H 1 6.896 0.000 . 1 . . . . A 72 PHE HD2 . 34868 1
911 . 1 . 1 76 76 PHE HE1 H 1 7.307 0.000 . 1 . . . . A 72 PHE HE1 . 34868 1
912 . 1 . 1 76 76 PHE HE2 H 1 7.307 0.000 . 1 . . . . A 72 PHE HE2 . 34868 1
913 . 1 . 1 76 76 PHE HZ H 1 7.364 0.000 . 1 . . . . A 72 PHE HZ . 34868 1
914 . 1 . 1 76 76 PHE C C 13 178.421 0.000 . 1 . . . . A 72 PHE C . 34868 1
915 . 1 . 1 76 76 PHE CA C 13 60.869 0.023 . 1 . . . . A 72 PHE CA . 34868 1
916 . 1 . 1 76 76 PHE CB C 13 37.963 0.063 . 1 . . . . A 72 PHE CB . 34868 1
917 . 1 . 1 76 76 PHE CD1 C 13 131.189 0.000 . 1 . . . . A 72 PHE CD1 . 34868 1
918 . 1 . 1 76 76 PHE CD2 C 13 131.189 0.000 . 1 . . . . A 72 PHE CD2 . 34868 1
919 . 1 . 1 76 76 PHE CE1 C 13 131.280 0.000 . 1 . . . . A 72 PHE CE1 . 34868 1
920 . 1 . 1 76 76 PHE CE2 C 13 131.280 0.000 . 1 . . . . A 72 PHE CE2 . 34868 1
921 . 1 . 1 76 76 PHE CZ C 13 131.534 0.000 . 1 . . . . A 72 PHE CZ . 34868 1
922 . 1 . 1 76 76 PHE N N 15 120.628 0.023 . 1 . . . . A 72 PHE N . 34868 1
923 . 1 . 1 77 77 VAL H H 1 8.183 0.010 . 1 . . . . A 73 VAL H . 34868 1
924 . 1 . 1 77 77 VAL HA H 1 2.912 0.006 . 1 . . . . A 73 VAL HA . 34868 1
925 . 1 . 1 77 77 VAL HB H 1 1.832 0.004 . 1 . . . . A 73 VAL HB . 34868 1
926 . 1 . 1 77 77 VAL HG11 H 1 0.771 0.006 . 2 . . . . A 73 VAL HG11 . 34868 1
927 . 1 . 1 77 77 VAL HG12 H 1 0.771 0.006 . 2 . . . . A 73 VAL HG12 . 34868 1
928 . 1 . 1 77 77 VAL HG13 H 1 0.771 0.006 . 2 . . . . A 73 VAL HG13 . 34868 1
929 . 1 . 1 77 77 VAL HG21 H 1 0.062 0.005 . 2 . . . . A 73 VAL HG21 . 34868 1
930 . 1 . 1 77 77 VAL HG22 H 1 0.062 0.005 . 2 . . . . A 73 VAL HG22 . 34868 1
931 . 1 . 1 77 77 VAL HG23 H 1 0.062 0.005 . 2 . . . . A 73 VAL HG23 . 34868 1
932 . 1 . 1 77 77 VAL CA C 13 67.139 0.019 . 1 . . . . A 73 VAL CA . 34868 1
933 . 1 . 1 77 77 VAL CB C 13 30.863 0.036 . 1 . . . . A 73 VAL CB . 34868 1
934 . 1 . 1 77 77 VAL CG1 C 13 21.972 0.021 . 2 . . . . A 73 VAL CG1 . 34868 1
935 . 1 . 1 77 77 VAL CG2 C 13 20.385 0.023 . 2 . . . . A 73 VAL CG2 . 34868 1
936 . 1 . 1 77 77 VAL N N 15 121.830 0.024 . 1 . . . . A 73 VAL N . 34868 1
937 . 1 . 1 78 78 GLU H H 1 7.956 0.000 . 1 . . . . A 74 GLU H . 34868 1
938 . 1 . 1 78 78 GLU HA H 1 3.639 0.004 . 1 . . . . A 74 GLU HA . 34868 1
939 . 1 . 1 78 78 GLU HB2 H 1 2.073 0.004 . 2 . . . . A 74 GLU HB2 . 34868 1
940 . 1 . 1 78 78 GLU HB3 H 1 2.059 0.018 . 2 . . . . A 74 GLU HB3 . 34868 1
941 . 1 . 1 78 78 GLU HG2 H 1 2.178 0.000 . 1 . . . . A 74 GLU HG2 . 34868 1
942 . 1 . 1 78 78 GLU HG3 H 1 2.178 0.000 . 1 . . . . A 74 GLU HG3 . 34868 1
943 . 1 . 1 78 78 GLU CA C 13 59.833 0.045 . 1 . . . . A 74 GLU CA . 34868 1
944 . 1 . 1 78 78 GLU CB C 13 29.969 0.000 . 1 . . . . A 74 GLU CB . 34868 1
945 . 1 . 1 78 78 GLU CG C 13 36.366 0.000 . 1 . . . . A 74 GLU CG . 34868 1
946 . 1 . 1 79 79 GLN H H 1 8.251 0.016 . 1 . . . . A 75 GLN H . 34868 1
947 . 1 . 1 79 79 GLN HA H 1 4.062 0.004 . 1 . . . . A 75 GLN HA . 34868 1
948 . 1 . 1 79 79 GLN HB2 H 1 2.053 0.003 . 2 . . . . A 75 GLN HB2 . 34868 1
949 . 1 . 1 79 79 GLN HB3 H 1 2.051 0.004 . 2 . . . . A 75 GLN HB3 . 34868 1
950 . 1 . 1 79 79 GLN HG2 H 1 2.498 0.010 . 2 . . . . A 75 GLN HG2 . 34868 1
951 . 1 . 1 79 79 GLN HG3 H 1 2.390 0.003 . 2 . . . . A 75 GLN HG3 . 34868 1
952 . 1 . 1 79 79 GLN HE21 H 1 6.816 0.003 . 1 . . . . A 75 GLN HE21 . 34868 1
953 . 1 . 1 79 79 GLN HE22 H 1 7.427 0.001 . 1 . . . . A 75 GLN HE22 . 34868 1
954 . 1 . 1 79 79 GLN C C 13 178.358 0.000 . 1 . . . . A 75 GLN C . 34868 1
955 . 1 . 1 79 79 GLN CA C 13 58.099 0.063 . 1 . . . . A 75 GLN CA . 34868 1
956 . 1 . 1 79 79 GLN CB C 13 28.410 0.038 . 1 . . . . A 75 GLN CB . 34868 1
957 . 1 . 1 79 79 GLN CG C 13 34.155 0.039 . 1 . . . . A 75 GLN CG . 34868 1
958 . 1 . 1 79 79 GLN N N 15 116.670 0.037 . 1 . . . . A 75 GLN N . 34868 1
959 . 1 . 1 79 79 GLN NE2 N 15 111.206 0.023 . 1 . . . . A 75 GLN NE2 . 34868 1
960 . 1 . 1 80 80 SER H H 1 7.754 0.015 . 1 . . . . A 76 SER H . 34868 1
961 . 1 . 1 80 80 SER HA H 1 4.099 0.006 . 1 . . . . A 76 SER HA . 34868 1
962 . 1 . 1 80 80 SER HB2 H 1 3.568 0.026 . 2 . . . . A 76 SER HB2 . 34868 1
963 . 1 . 1 80 80 SER HB3 H 1 3.604 0.016 . 2 . . . . A 76 SER HB3 . 34868 1
964 . 1 . 1 80 80 SER C C 13 175.123 0.000 . 1 . . . . A 76 SER C . 34868 1
965 . 1 . 1 80 80 SER CA C 13 60.796 0.065 . 1 . . . . A 76 SER CA . 34868 1
966 . 1 . 1 80 80 SER CB C 13 63.089 0.028 . 1 . . . . A 76 SER CB . 34868 1
967 . 1 . 1 80 80 SER N N 15 115.180 0.021 . 1 . . . . A 76 SER N . 34868 1
968 . 1 . 1 81 81 ARG H H 1 7.722 0.012 . 1 . . . . A 77 ARG H . 34868 1
969 . 1 . 1 81 81 ARG HA H 1 4.104 0.019 . 1 . . . . A 77 ARG HA . 34868 1
970 . 1 . 1 81 81 ARG HB2 H 1 1.793 0.027 . 2 . . . . A 77 ARG HB2 . 34868 1
971 . 1 . 1 81 81 ARG HB3 H 1 1.824 0.015 . 2 . . . . A 77 ARG HB3 . 34868 1
972 . 1 . 1 81 81 ARG HG2 H 1 1.757 0.000 . 2 . . . . A 77 ARG HG2 . 34868 1
973 . 1 . 1 81 81 ARG HG3 H 1 1.639 0.013 . 2 . . . . A 77 ARG HG3 . 34868 1
974 . 1 . 1 81 81 ARG HD2 H 1 3.156 0.000 . 2 . . . . A 77 ARG HD2 . 34868 1
975 . 1 . 1 81 81 ARG HD3 H 1 3.076 0.013 . 2 . . . . A 77 ARG HD3 . 34868 1
976 . 1 . 1 81 81 ARG C C 13 176.557 0.000 . 1 . . . . A 77 ARG C . 34868 1
977 . 1 . 1 81 81 ARG CA C 13 57.561 0.061 . 1 . . . . A 77 ARG CA . 34868 1
978 . 1 . 1 81 81 ARG CB C 13 30.804 0.082 . 1 . . . . A 77 ARG CB . 34868 1
979 . 1 . 1 81 81 ARG CG C 13 26.787 0.063 . 1 . . . . A 77 ARG CG . 34868 1
980 . 1 . 1 81 81 ARG CD C 13 44.191 0.021 . 1 . . . . A 77 ARG CD . 34868 1
981 . 1 . 1 81 81 ARG N N 15 120.527 0.034 . 1 . . . . A 77 ARG N . 34868 1
982 . 1 . 1 82 82 ASP H H 1 7.939 0.014 . 1 . . . . A 78 ASP H . 34868 1
983 . 1 . 1 82 82 ASP HA H 1 4.652 0.009 . 1 . . . . A 78 ASP HA . 34868 1
984 . 1 . 1 82 82 ASP HB2 H 1 2.691 0.006 . 2 . . . . A 78 ASP HB2 . 34868 1
985 . 1 . 1 82 82 ASP HB3 H 1 2.791 0.009 . 2 . . . . A 78 ASP HB3 . 34868 1
986 . 1 . 1 82 82 ASP C C 13 177.184 0.000 . 1 . . . . A 78 ASP C . 34868 1
987 . 1 . 1 82 82 ASP CA C 13 55.211 0.039 . 1 . . . . A 78 ASP CA . 34868 1
988 . 1 . 1 82 82 ASP CB C 13 41.104 0.013 . 1 . . . . A 78 ASP CB . 34868 1
989 . 1 . 1 82 82 ASP N N 15 119.932 0.037 . 1 . . . . A 78 ASP N . 34868 1
990 . 1 . 1 83 83 THR H H 1 8.024 0.014 . 1 . . . . A 79 THR H . 34868 1
991 . 1 . 1 83 83 THR HA H 1 4.288 0.016 . 1 . . . . A 79 THR HA . 34868 1
992 . 1 . 1 83 83 THR HB H 1 4.330 0.011 . 1 . . . . A 79 THR HB . 34868 1
993 . 1 . 1 83 83 THR HG21 H 1 1.265 0.004 . 1 . . . . A 79 THR HG21 . 34868 1
994 . 1 . 1 83 83 THR HG22 H 1 1.265 0.004 . 1 . . . . A 79 THR HG22 . 34868 1
995 . 1 . 1 83 83 THR HG23 H 1 1.265 0.004 . 1 . . . . A 79 THR HG23 . 34868 1
996 . 1 . 1 83 83 THR C C 13 175.750 0.000 . 1 . . . . A 79 THR C . 34868 1
997 . 1 . 1 83 83 THR CA C 13 62.968 0.041 . 1 . . . . A 79 THR CA . 34868 1
998 . 1 . 1 83 83 THR CB C 13 69.615 0.018 . 1 . . . . A 79 THR CB . 34868 1
999 . 1 . 1 83 83 THR CG2 C 13 21.669 0.026 . 1 . . . . A 79 THR CG2 . 34868 1
1000 . 1 . 1 83 83 THR N N 15 113.688 0.031 . 1 . . . . A 79 THR N . 34868 1
1001 . 1 . 1 84 84 GLY H H 1 8.308 0.013 . 1 . . . . A 80 GLY H . 34868 1
1002 . 1 . 1 84 84 GLY HA2 H 1 4.005 0.022 . 2 . . . . A 80 GLY HA2 . 34868 1
1003 . 1 . 1 84 84 GLY HA3 H 1 4.001 0.020 . 2 . . . . A 80 GLY HA3 . 34868 1
1004 . 1 . 1 84 84 GLY C C 13 174.207 0.000 . 1 . . . . A 80 GLY C . 34868 1
1005 . 1 . 1 84 84 GLY CA C 13 45.709 0.029 . 1 . . . . A 80 GLY CA . 34868 1
1006 . 1 . 1 84 84 GLY N N 15 110.520 0.021 . 1 . . . . A 80 GLY N . 34868 1
1007 . 1 . 1 85 85 ARG H H 1 7.914 0.015 . 1 . . . . A 81 ARG H . 34868 1
1008 . 1 . 1 85 85 ARG HA H 1 4.343 0.008 . 1 . . . . A 81 ARG HA . 34868 1
1009 . 1 . 1 85 85 ARG HB2 H 1 1.825 0.013 . 2 . . . . A 81 ARG HB2 . 34868 1
1010 . 1 . 1 85 85 ARG HB3 H 1 1.829 0.014 . 2 . . . . A 81 ARG HB3 . 34868 1
1011 . 1 . 1 85 85 ARG HG2 H 1 1.625 0.010 . 1 . . . . A 81 ARG HG2 . 34868 1
1012 . 1 . 1 85 85 ARG HG3 H 1 1.626 0.009 . 1 . . . . A 81 ARG HG3 . 34868 1
1013 . 1 . 1 85 85 ARG HD2 H 1 3.219 0.003 . 1 . . . . A 81 ARG HD2 . 34868 1
1014 . 1 . 1 85 85 ARG HD3 H 1 3.219 0.003 . 1 . . . . A 81 ARG HD3 . 34868 1
1015 . 1 . 1 85 85 ARG C C 13 175.750 0.000 . 1 . . . . A 81 ARG C . 34868 1
1016 . 1 . 1 85 85 ARG CA C 13 56.025 0.019 . 1 . . . . A 81 ARG CA . 34868 1
1017 . 1 . 1 85 85 ARG CB C 13 30.911 0.052 . 1 . . . . A 81 ARG CB . 34868 1
1018 . 1 . 1 85 85 ARG CG C 13 27.124 0.036 . 1 . . . . A 81 ARG CG . 34868 1
1019 . 1 . 1 85 85 ARG CD C 13 43.385 0.046 . 1 . . . . A 81 ARG CD . 34868 1
1020 . 1 . 1 85 85 ARG N N 15 119.759 0.121 . 1 . . . . A 81 ARG N . 34868 1
1021 . 1 . 1 86 86 ASN H H 1 8.392 0.015 . 1 . . . . A 82 ASN H . 34868 1
1022 . 1 . 1 86 86 ASN HA H 1 4.990 0.004 . 1 . . . . A 82 ASN HA . 34868 1
1023 . 1 . 1 86 86 ASN HB2 H 1 2.858 0.006 . 2 . . . . A 82 ASN HB2 . 34868 1
1024 . 1 . 1 86 86 ASN HB3 H 1 2.749 0.000 . 2 . . . . A 82 ASN HB3 . 34868 1
1025 . 1 . 1 86 86 ASN HD21 H 1 7.655 0.000 . 1 . . . . A 82 ASN HD21 . 34868 1
1026 . 1 . 1 86 86 ASN HD22 H 1 6.985 0.000 . 1 . . . . A 82 ASN HD22 . 34868 1
1027 . 1 . 1 86 86 ASN CA C 13 51.263 0.028 . 1 . . . . A 82 ASN CA . 34868 1
1028 . 1 . 1 86 86 ASN CB C 13 38.912 0.051 . 1 . . . . A 82 ASN CB . 34868 1
1029 . 1 . 1 86 86 ASN N N 15 120.466 0.028 . 1 . . . . A 82 ASN N . 34868 1
1030 . 1 . 1 86 86 ASN ND2 N 15 112.255 0.029 . 1 . . . . A 82 ASN ND2 . 34868 1
1031 . 1 . 1 87 87 PRO HA H 1 4.415 0.005 . 1 . . . . A 83 PRO HA . 34868 1
1032 . 1 . 1 87 87 PRO HB2 H 1 1.971 0.006 . 2 . . . . A 83 PRO HB2 . 34868 1
1033 . 1 . 1 87 87 PRO HB3 H 1 2.311 0.006 . 2 . . . . A 83 PRO HB3 . 34868 1
1034 . 1 . 1 87 87 PRO HG2 H 1 2.017 0.006 . 2 . . . . A 83 PRO HG2 . 34868 1
1035 . 1 . 1 87 87 PRO HG3 H 1 2.010 0.015 . 2 . . . . A 83 PRO HG3 . 34868 1
1036 . 1 . 1 87 87 PRO HD2 H 1 3.806 0.014 . 2 . . . . A 83 PRO HD2 . 34868 1
1037 . 1 . 1 87 87 PRO HD3 H 1 3.772 0.016 . 2 . . . . A 83 PRO HD3 . 34868 1
1038 . 1 . 1 87 87 PRO C C 13 176.830 0.000 . 1 . . . . A 83 PRO C . 34868 1
1039 . 1 . 1 87 87 PRO CA C 13 63.660 0.044 . 1 . . . . A 83 PRO CA . 34868 1
1040 . 1 . 1 87 87 PRO CB C 13 32.087 0.029 . 1 . . . . A 83 PRO CB . 34868 1
1041 . 1 . 1 87 87 PRO CG C 13 27.251 0.019 . 1 . . . . A 83 PRO CG . 34868 1
1042 . 1 . 1 87 87 PRO CD C 13 50.778 0.015 . 1 . . . . A 83 PRO CD . 34868 1
1043 . 1 . 1 88 88 ALA H H 1 8.190 0.013 . 1 . . . . A 84 ALA H . 34868 1
1044 . 1 . 1 88 88 ALA HA H 1 4.319 0.013 . 1 . . . . A 84 ALA HA . 34868 1
1045 . 1 . 1 88 88 ALA HB1 H 1 1.402 0.005 . 1 . . . . A 84 ALA HB1 . 34868 1
1046 . 1 . 1 88 88 ALA HB2 H 1 1.402 0.005 . 1 . . . . A 84 ALA HB2 . 34868 1
1047 . 1 . 1 88 88 ALA HB3 H 1 1.402 0.005 . 1 . . . . A 84 ALA HB3 . 34868 1
1048 . 1 . 1 88 88 ALA C C 13 177.588 0.000 . 1 . . . . A 84 ALA C . 34868 1
1049 . 1 . 1 88 88 ALA CA C 13 52.462 0.044 . 1 . . . . A 84 ALA CA . 34868 1
1050 . 1 . 1 88 88 ALA CB C 13 19.008 0.034 . 1 . . . . A 84 ALA CB . 34868 1
1051 . 1 . 1 88 88 ALA N N 15 122.835 0.013 . 1 . . . . A 84 ALA N . 34868 1
1052 . 1 . 1 89 89 ALA H H 1 8.027 0.015 . 1 . . . . A 85 ALA H . 34868 1
1053 . 1 . 1 89 89 ALA HA H 1 4.334 0.021 . 1 . . . . A 85 ALA HA . 34868 1
1054 . 1 . 1 89 89 ALA HB1 H 1 1.418 0.006 . 1 . . . . A 85 ALA HB1 . 34868 1
1055 . 1 . 1 89 89 ALA HB2 H 1 1.418 0.006 . 1 . . . . A 85 ALA HB2 . 34868 1
1056 . 1 . 1 89 89 ALA HB3 H 1 1.418 0.006 . 1 . . . . A 85 ALA HB3 . 34868 1
1057 . 1 . 1 89 89 ALA C C 13 177.626 0.000 . 1 . . . . A 85 ALA C . 34868 1
1058 . 1 . 1 89 89 ALA CA C 13 52.486 0.035 . 1 . . . . A 85 ALA CA . 34868 1
1059 . 1 . 1 89 89 ALA CB C 13 19.252 0.046 . 1 . . . . A 85 ALA CB . 34868 1
1060 . 1 . 1 89 89 ALA N N 15 122.592 0.024 . 1 . . . . A 85 ALA N . 34868 1
1061 . 1 . 1 90 90 GLN H H 1 8.241 0.016 . 1 . . . . A 86 GLN H . 34868 1
1062 . 1 . 1 90 90 GLN HA H 1 4.430 0.007 . 1 . . . . A 86 GLN HA . 34868 1
1063 . 1 . 1 90 90 GLN HB2 H 1 2.024 0.003 . 2 . . . . A 86 GLN HB2 . 34868 1
1064 . 1 . 1 90 90 GLN HB3 H 1 2.166 0.006 . 2 . . . . A 86 GLN HB3 . 34868 1
1065 . 1 . 1 90 90 GLN HG2 H 1 2.400 0.001 . 1 . . . . A 86 GLN HG2 . 34868 1
1066 . 1 . 1 90 90 GLN HG3 H 1 2.400 0.001 . 1 . . . . A 86 GLN HG3 . 34868 1
1067 . 1 . 1 90 90 GLN HE21 H 1 6.850 0.002 . 1 . . . . A 86 GLN HE21 . 34868 1
1068 . 1 . 1 90 90 GLN HE22 H 1 7.538 0.001 . 1 . . . . A 86 GLN HE22 . 34868 1
1069 . 1 . 1 90 90 GLN C C 13 176.123 0.000 . 1 . . . . A 86 GLN C . 34868 1
1070 . 1 . 1 90 90 GLN CA C 13 55.801 0.054 . 1 . . . . A 86 GLN CA . 34868 1
1071 . 1 . 1 90 90 GLN CB C 13 29.578 0.035 . 1 . . . . A 86 GLN CB . 34868 1
1072 . 1 . 1 90 90 GLN CG C 13 33.876 0.050 . 1 . . . . A 86 GLN CG . 34868 1
1073 . 1 . 1 90 90 GLN N N 15 119.340 0.036 . 1 . . . . A 86 GLN N . 34868 1
1074 . 1 . 1 90 90 GLN NE2 N 15 112.254 0.017 . 1 . . . . A 86 GLN NE2 . 34868 1
1075 . 1 . 1 91 91 THR H H 1 8.146 0.014 . 1 . . . . A 87 THR H . 34868 1
1076 . 1 . 1 91 91 THR HA H 1 4.364 0.005 . 1 . . . . A 87 THR HA . 34868 1
1077 . 1 . 1 91 91 THR HB H 1 4.258 0.009 . 1 . . . . A 87 THR HB . 34868 1
1078 . 1 . 1 91 91 THR HG21 H 1 1.213 0.004 . 1 . . . . A 87 THR HG21 . 34868 1
1079 . 1 . 1 91 91 THR HG22 H 1 1.213 0.004 . 1 . . . . A 87 THR HG22 . 34868 1
1080 . 1 . 1 91 91 THR HG23 H 1 1.213 0.004 . 1 . . . . A 87 THR HG23 . 34868 1
1081 . 1 . 1 91 91 THR C C 13 173.692 0.000 . 1 . . . . A 87 THR C . 34868 1
1082 . 1 . 1 91 91 THR CA C 13 61.859 0.018 . 1 . . . . A 87 THR CA . 34868 1
1083 . 1 . 1 91 91 THR CB C 13 69.925 0.015 . 1 . . . . A 87 THR CB . 34868 1
1084 . 1 . 1 91 91 THR CG2 C 13 21.515 0.015 . 1 . . . . A 87 THR CG2 . 34868 1
1085 . 1 . 1 91 91 THR N N 15 115.421 0.014 . 1 . . . . A 87 THR N . 34868 1
1086 . 1 . 1 92 92 GLN H H 1 7.998 0.015 . 1 . . . . A 88 GLN H . 34868 1
1087 . 1 . 1 92 92 GLN HA H 1 4.200 0.005 . 1 . . . . A 88 GLN HA . 34868 1
1088 . 1 . 1 92 92 GLN HB2 H 1 2.130 0.003 . 2 . . . . A 88 GLN HB2 . 34868 1
1089 . 1 . 1 92 92 GLN HB3 H 1 1.949 0.003 . 2 . . . . A 88 GLN HB3 . 34868 1
1090 . 1 . 1 92 92 GLN HG2 H 1 2.314 0.003 . 1 . . . . A 88 GLN HG2 . 34868 1
1091 . 1 . 1 92 92 GLN HG3 H 1 2.314 0.003 . 1 . . . . A 88 GLN HG3 . 34868 1
1092 . 1 . 1 92 92 GLN HE21 H 1 6.797 0.001 . 1 . . . . A 88 GLN HE21 . 34868 1
1093 . 1 . 1 92 92 GLN HE22 H 1 7.498 0.000 . 1 . . . . A 88 GLN HE22 . 34868 1
1094 . 1 . 1 92 92 GLN CA C 13 57.476 0.016 . 1 . . . . A 88 GLN CA . 34868 1
1095 . 1 . 1 92 92 GLN CB C 13 30.384 0.078 . 1 . . . . A 88 GLN CB . 34868 1
1096 . 1 . 1 92 92 GLN CG C 13 34.257 0.068 . 1 . . . . A 88 GLN CG . 34868 1
1097 . 1 . 1 92 92 GLN N N 15 127.314 0.024 . 1 . . . . A 88 GLN N . 34868 1
1098 . 1 . 1 92 92 GLN NE2 N 15 111.967 0.054 . 1 . . . . A 88 GLN NE2 . 34868 1
stop_
save_
###################################
# 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_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 34868
_Assigned_chem_shift_list.ID 2
_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' . . . 34868 2
2 '3D HNCO' . . . 34868 2
3 '3D HNCA' . . . 34868 2
4 '3D CBCA(CO)NH' . . . 34868 2
5 '3D HNCACB' . . . 34868 2
6 '3D H(CCO)NH' . . . 34868 2
7 '3D C(CO)NH' . . . 34868 2
8 '3D HCCH-TOCSY' . . . 34868 2
9 '3D HBHA(CO)NH' . . . 34868 2
10 '3D 1H-15N NOESY' . . . 34868 2
11 '2D 1H-13C HSQC' . . . 34868 2
12 '2D hbcbcgcdhdgp' . . . 34868 2
13 '2D hbcbcgcdcehegp' . . . 34868 2
14 '2D 1H-13C HSQC' . . . 34868 2
15 '3D 1H-13C NOESY' . . . 34868 2
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 MET HA H 1 4.469 0.004 . 1 . . . . A -1 MET HA . 34868 2
2 . 1 . 1 3 3 MET HB2 H 1 2.092 0.023 . 2 . . . . A -1 MET HB2 . 34868 2
3 . 1 . 1 3 3 MET HB3 H 1 2.105 0.006 . 2 . . . . A -1 MET HB3 . 34868 2
4 . 1 . 1 3 3 MET HG2 H 1 2.583 0.012 . 1 . . . . A -1 MET HG2 . 34868 2
5 . 1 . 1 3 3 MET HG3 H 1 2.583 0.012 . 1 . . . . A -1 MET HG3 . 34868 2
6 . 1 . 1 3 3 MET CA C 13 55.457 0.007 . 1 . . . . A -1 MET CA . 34868 2
7 . 1 . 1 3 3 MET CB C 13 32.942 0.000 . 1 . . . . A -1 MET CB . 34868 2
8 . 1 . 1 3 3 MET CG C 13 32.032 0.009 . 1 . . . . A -1 MET CG . 34868 2
9 . 1 . 1 4 4 ALA HA H 1 4.383 0.000 . 1 . . . . A 0 ALA HA . 34868 2
10 . 1 . 1 4 4 ALA HB1 H 1 1.411 0.000 . 1 . . . . A 0 ALA HB1 . 34868 2
11 . 1 . 1 4 4 ALA HB2 H 1 1.411 0.000 . 1 . . . . A 0 ALA HB2 . 34868 2
12 . 1 . 1 4 4 ALA HB3 H 1 1.411 0.000 . 1 . . . . A 0 ALA HB3 . 34868 2
13 . 1 . 1 4 4 ALA CA C 13 52.612 0.000 . 1 . . . . A 0 ALA CA . 34868 2
14 . 1 . 1 4 4 ALA CB C 13 18.987 0.000 . 1 . . . . A 0 ALA CB . 34868 2
15 . 1 . 1 5 5 THR HA H 1 4.305 0.012 . 1 . . . . A 1 THR HA . 34868 2
16 . 1 . 1 5 5 THR HB H 1 4.219 0.007 . 1 . . . . A 1 THR HB . 34868 2
17 . 1 . 1 5 5 THR HG21 H 1 1.221 0.002 . 1 . . . . A 1 THR HG21 . 34868 2
18 . 1 . 1 5 5 THR HG22 H 1 1.221 0.002 . 1 . . . . A 1 THR HG22 . 34868 2
19 . 1 . 1 5 5 THR HG23 H 1 1.221 0.002 . 1 . . . . A 1 THR HG23 . 34868 2
20 . 1 . 1 5 5 THR CA C 13 61.668 0.016 . 1 . . . . A 1 THR CA . 34868 2
21 . 1 . 1 5 5 THR CB C 13 69.794 0.028 . 1 . . . . A 1 THR CB . 34868 2
22 . 1 . 1 5 5 THR CG2 C 13 21.645 0.000 . 1 . . . . A 1 THR CG2 . 34868 2
23 . 1 . 1 6 6 ALA HB1 H 1 1.397 0.001 . 1 . . . . A 2 ALA HB1 . 34868 2
24 . 1 . 1 6 6 ALA HB2 H 1 1.397 0.001 . 1 . . . . A 2 ALA HB2 . 34868 2
25 . 1 . 1 6 6 ALA HB3 H 1 1.397 0.001 . 1 . . . . A 2 ALA HB3 . 34868 2
26 . 1 . 1 6 6 ALA CB C 13 19.309 0.000 . 1 . . . . A 2 ALA CB . 34868 2
27 . 1 . 1 7 7 VAL HA H 1 4.113 0.004 . 1 . . . . A 3 VAL HA . 34868 2
28 . 1 . 1 7 7 VAL HB H 1 2.080 0.006 . 1 . . . . A 3 VAL HB . 34868 2
29 . 1 . 1 7 7 VAL HG11 H 1 0.944 0.003 . 1 . . . . A 3 VAL HG11 . 34868 2
30 . 1 . 1 7 7 VAL HG12 H 1 0.944 0.003 . 1 . . . . A 3 VAL HG12 . 34868 2
31 . 1 . 1 7 7 VAL HG13 H 1 0.944 0.003 . 1 . . . . A 3 VAL HG13 . 34868 2
32 . 1 . 1 7 7 VAL HG21 H 1 0.944 0.002 . 1 . . . . A 3 VAL HG21 . 34868 2
33 . 1 . 1 7 7 VAL HG22 H 1 0.944 0.002 . 1 . . . . A 3 VAL HG22 . 34868 2
34 . 1 . 1 7 7 VAL HG23 H 1 0.944 0.002 . 1 . . . . A 3 VAL HG23 . 34868 2
35 . 1 . 1 7 7 VAL CA C 13 62.035 0.015 . 1 . . . . A 3 VAL CA . 34868 2
36 . 1 . 1 7 7 VAL CB C 13 32.765 0.000 . 1 . . . . A 3 VAL CB . 34868 2
37 . 1 . 1 7 7 VAL CG1 C 13 20.576 0.000 . 2 . . . . A 3 VAL CG1 . 34868 2
38 . 1 . 1 7 7 VAL CG2 C 13 20.677 0.087 . 2 . . . . A 3 VAL CG2 . 34868 2
39 . 1 . 1 8 8 GLN HA H 1 4.315 0.006 . 1 . . . . A 4 GLN HA . 34868 2
40 . 1 . 1 8 8 GLN HB2 H 1 1.978 0.013 . 2 . . . . A 4 GLN HB2 . 34868 2
41 . 1 . 1 8 8 GLN HB3 H 1 2.004 0.022 . 2 . . . . A 4 GLN HB3 . 34868 2
42 . 1 . 1 8 8 GLN HG2 H 1 2.339 0.005 . 2 . . . . A 4 GLN HG2 . 34868 2
43 . 1 . 1 8 8 GLN HG3 H 1 2.339 0.005 . 2 . . . . A 4 GLN HG3 . 34868 2
44 . 1 . 1 8 8 GLN CA C 13 55.788 0.003 . 1 . . . . A 4 GLN CA . 34868 2
45 . 1 . 1 8 8 GLN CB C 13 29.750 0.052 . 1 . . . . A 4 GLN CB . 34868 2
46 . 1 . 1 8 8 GLN CG C 13 33.892 0.000 . 1 . . . . A 4 GLN CG . 34868 2
47 . 1 . 1 9 9 ASN HA H 1 4.993 0.018 . 1 . . . . A 5 ASN HA . 34868 2
48 . 1 . 1 9 9 ASN HB2 H 1 2.873 0.006 . 2 . . . . A 5 ASN HB2 . 34868 2
49 . 1 . 1 9 9 ASN HB3 H 1 2.775 0.000 . 2 . . . . A 5 ASN HB3 . 34868 2
50 . 1 . 1 9 9 ASN CA C 13 50.995 0.011 . 1 . . . . A 5 ASN CA . 34868 2
51 . 1 . 1 9 9 ASN CB C 13 38.861 0.016 . 1 . . . . A 5 ASN CB . 34868 2
52 . 1 . 1 10 10 PRO HA H 1 4.478 0.007 . 1 . . . . A 6 PRO HA . 34868 2
53 . 1 . 1 10 10 PRO HB2 H 1 1.986 0.007 . 2 . . . . A 6 PRO HB2 . 34868 2
54 . 1 . 1 10 10 PRO HB3 H 1 2.325 0.001 . 2 . . . . A 6 PRO HB3 . 34868 2
55 . 1 . 1 10 10 PRO HG2 H 1 2.037 0.003 . 1 . . . . A 6 PRO HG2 . 34868 2
56 . 1 . 1 10 10 PRO HG3 H 1 2.037 0.003 . 1 . . . . A 6 PRO HG3 . 34868 2
57 . 1 . 1 10 10 PRO HD2 H 1 3.587 0.010 . 2 . . . . A 6 PRO HD2 . 34868 2
58 . 1 . 1 10 10 PRO HD3 H 1 3.585 0.007 . 2 . . . . A 6 PRO HD3 . 34868 2
59 . 1 . 1 10 10 PRO CA C 13 63.134 0.000 . 1 . . . . A 6 PRO CA . 34868 2
60 . 1 . 1 10 10 PRO CB C 13 32.227 0.084 . 1 . . . . A 6 PRO CB . 34868 2
61 . 1 . 1 10 10 PRO CG C 13 27.019 0.000 . 1 . . . . A 6 PRO CG . 34868 2
62 . 1 . 1 10 10 PRO CD C 13 49.707 0.015 . 1 . . . . A 6 PRO CD . 34868 2
63 . 1 . 1 11 11 LEU HA H 1 4.234 0.015 . 1 . . . . A 7 LEU HA . 34868 2
64 . 1 . 1 11 11 LEU HB2 H 1 1.829 0.006 . 2 . . . . A 7 LEU HB2 . 34868 2
65 . 1 . 1 11 11 LEU HB3 H 1 1.452 0.010 . 2 . . . . A 7 LEU HB3 . 34868 2
66 . 1 . 1 11 11 LEU HG H 1 1.700 0.008 . 1 . . . . A 7 LEU HG . 34868 2
67 . 1 . 1 11 11 LEU HD11 H 1 0.802 0.012 . 2 . . . . A 7 LEU HD11 . 34868 2
68 . 1 . 1 11 11 LEU HD12 H 1 0.802 0.012 . 2 . . . . A 7 LEU HD12 . 34868 2
69 . 1 . 1 11 11 LEU HD13 H 1 0.802 0.012 . 2 . . . . A 7 LEU HD13 . 34868 2
70 . 1 . 1 11 11 LEU HD21 H 1 0.725 0.010 . 2 . . . . A 7 LEU HD21 . 34868 2
71 . 1 . 1 11 11 LEU HD22 H 1 0.725 0.010 . 2 . . . . A 7 LEU HD22 . 34868 2
72 . 1 . 1 11 11 LEU HD23 H 1 0.725 0.010 . 2 . . . . A 7 LEU HD23 . 34868 2
73 . 1 . 1 11 11 LEU CA C 13 58.941 0.022 . 1 . . . . A 7 LEU CA . 34868 2
74 . 1 . 1 11 11 LEU CB C 13 41.576 0.045 . 1 . . . . A 7 LEU CB . 34868 2
75 . 1 . 1 11 11 LEU CG C 13 28.927 0.093 . 1 . . . . A 7 LEU CG . 34868 2
76 . 1 . 1 11 11 LEU CD1 C 13 25.265 0.075 . 2 . . . . A 7 LEU CD1 . 34868 2
77 . 1 . 1 11 11 LEU CD2 C 13 24.893 0.092 . 2 . . . . A 7 LEU CD2 . 34868 2
78 . 1 . 1 12 12 GLU HA H 1 3.631 0.008 . 1 . . . . A 8 GLU HA . 34868 2
79 . 1 . 1 12 12 GLU HB2 H 1 1.952 0.012 . 2 . . . . A 8 GLU HB2 . 34868 2
80 . 1 . 1 12 12 GLU HB3 H 1 2.261 0.011 . 2 . . . . A 8 GLU HB3 . 34868 2
81 . 1 . 1 12 12 GLU HG2 H 1 2.052 0.009 . 2 . . . . A 8 GLU HG2 . 34868 2
82 . 1 . 1 12 12 GLU HG3 H 1 2.300 0.006 . 2 . . . . A 8 GLU HG3 . 34868 2
83 . 1 . 1 12 12 GLU CA C 13 60.021 0.110 . 1 . . . . A 8 GLU CA . 34868 2
84 . 1 . 1 12 12 GLU CB C 13 29.933 0.049 . 1 . . . . A 8 GLU CB . 34868 2
85 . 1 . 1 12 12 GLU CG C 13 37.719 0.070 . 1 . . . . A 8 GLU CG . 34868 2
86 . 1 . 1 13 13 THR HA H 1 3.891 0.010 . 1 . . . . A 9 THR HA . 34868 2
87 . 1 . 1 13 13 THR HB H 1 4.287 0.012 . 1 . . . . A 9 THR HB . 34868 2
88 . 1 . 1 13 13 THR HG21 H 1 1.283 0.008 . 1 . . . . A 9 THR HG21 . 34868 2
89 . 1 . 1 13 13 THR HG22 H 1 1.283 0.008 . 1 . . . . A 9 THR HG22 . 34868 2
90 . 1 . 1 13 13 THR HG23 H 1 1.283 0.008 . 1 . . . . A 9 THR HG23 . 34868 2
91 . 1 . 1 13 13 THR CA C 13 66.813 0.043 . 1 . . . . A 9 THR CA . 34868 2
92 . 1 . 1 13 13 THR CB C 13 68.556 0.029 . 1 . . . . A 9 THR CB . 34868 2
93 . 1 . 1 14 14 VAL H H 1 7.451 0.000 . 1 . . . . A 10 VAL H . 34868 2
94 . 1 . 1 14 14 VAL HA H 1 3.813 0.005 . 1 . . . . A 10 VAL HA . 34868 2
95 . 1 . 1 14 14 VAL HB H 1 2.400 0.010 . 1 . . . . A 10 VAL HB . 34868 2
96 . 1 . 1 14 14 VAL HG11 H 1 0.961 0.009 . 2 . . . . A 10 VAL HG11 . 34868 2
97 . 1 . 1 14 14 VAL HG12 H 1 0.961 0.009 . 2 . . . . A 10 VAL HG12 . 34868 2
98 . 1 . 1 14 14 VAL HG13 H 1 0.961 0.009 . 2 . . . . A 10 VAL HG13 . 34868 2
99 . 1 . 1 14 14 VAL HG21 H 1 1.206 0.009 . 2 . . . . A 10 VAL HG21 . 34868 2
100 . 1 . 1 14 14 VAL HG22 H 1 1.206 0.009 . 2 . . . . A 10 VAL HG22 . 34868 2
101 . 1 . 1 14 14 VAL HG23 H 1 1.206 0.009 . 2 . . . . A 10 VAL HG23 . 34868 2
102 . 1 . 1 14 14 VAL CA C 13 66.375 0.045 . 1 . . . . A 10 VAL CA . 34868 2
103 . 1 . 1 14 14 VAL CB C 13 32.186 0.031 . 1 . . . . A 10 VAL CB . 34868 2
104 . 1 . 1 14 14 VAL CG1 C 13 22.307 0.166 . 2 . . . . A 10 VAL CG1 . 34868 2
105 . 1 . 1 14 14 VAL CG2 C 13 23.045 0.129 . 2 . . . . A 10 VAL CG2 . 34868 2
106 . 1 . 1 15 15 VAL HA H 1 3.650 0.016 . 1 . . . . A 11 VAL HA . 34868 2
107 . 1 . 1 15 15 VAL HB H 1 2.391 0.007 . 1 . . . . A 11 VAL HB . 34868 2
108 . 1 . 1 15 15 VAL HG11 H 1 1.300 0.014 . 2 . . . . A 11 VAL HG11 . 34868 2
109 . 1 . 1 15 15 VAL HG12 H 1 1.300 0.014 . 2 . . . . A 11 VAL HG12 . 34868 2
110 . 1 . 1 15 15 VAL HG13 H 1 1.300 0.014 . 2 . . . . A 11 VAL HG13 . 34868 2
111 . 1 . 1 15 15 VAL HG21 H 1 1.260 0.013 . 2 . . . . A 11 VAL HG21 . 34868 2
112 . 1 . 1 15 15 VAL HG22 H 1 1.260 0.013 . 2 . . . . A 11 VAL HG22 . 34868 2
113 . 1 . 1 15 15 VAL HG23 H 1 1.260 0.013 . 2 . . . . A 11 VAL HG23 . 34868 2
114 . 1 . 1 15 15 VAL CA C 13 67.378 0.036 . 1 . . . . A 11 VAL CA . 34868 2
115 . 1 . 1 15 15 VAL CB C 13 31.331 0.008 . 1 . . . . A 11 VAL CB . 34868 2
116 . 1 . 1 15 15 VAL CG1 C 13 23.379 0.068 . 2 . . . . A 11 VAL CG1 . 34868 2
117 . 1 . 1 15 15 VAL CG2 C 13 22.705 0.109 . 2 . . . . A 11 VAL CG2 . 34868 2
118 . 1 . 1 16 16 LEU HA H 1 4.226 0.006 . 1 . . . . A 12 LEU HA . 34868 2
119 . 1 . 1 16 16 LEU HB2 H 1 2.209 0.006 . 2 . . . . A 12 LEU HB2 . 34868 2
120 . 1 . 1 16 16 LEU HB3 H 1 1.709 0.002 . 2 . . . . A 12 LEU HB3 . 34868 2
121 . 1 . 1 16 16 LEU HG H 1 1.706 0.006 . 1 . . . . A 12 LEU HG . 34868 2
122 . 1 . 1 16 16 LEU HD11 H 1 1.098 0.007 . 2 . . . . A 12 LEU HD11 . 34868 2
123 . 1 . 1 16 16 LEU HD12 H 1 1.098 0.007 . 2 . . . . A 12 LEU HD12 . 34868 2
124 . 1 . 1 16 16 LEU HD13 H 1 1.098 0.007 . 2 . . . . A 12 LEU HD13 . 34868 2
125 . 1 . 1 16 16 LEU HD21 H 1 1.138 0.007 . 2 . . . . A 12 LEU HD21 . 34868 2
126 . 1 . 1 16 16 LEU HD22 H 1 1.138 0.007 . 2 . . . . A 12 LEU HD22 . 34868 2
127 . 1 . 1 16 16 LEU HD23 H 1 1.138 0.007 . 2 . . . . A 12 LEU HD23 . 34868 2
128 . 1 . 1 16 16 LEU CA C 13 58.766 0.078 . 1 . . . . A 12 LEU CA . 34868 2
129 . 1 . 1 16 16 LEU CB C 13 42.507 0.053 . 1 . . . . A 12 LEU CB . 34868 2
130 . 1 . 1 16 16 LEU CG C 13 27.271 0.026 . 1 . . . . A 12 LEU CG . 34868 2
131 . 1 . 1 16 16 LEU CD1 C 13 25.903 0.032 . 2 . . . . A 12 LEU CD1 . 34868 2
132 . 1 . 1 16 16 LEU CD2 C 13 24.519 0.041 . 2 . . . . A 12 LEU CD2 . 34868 2
133 . 1 . 1 17 17 GLN HA H 1 3.902 0.004 . 1 . . . . A 13 GLN HA . 34868 2
134 . 1 . 1 17 17 GLN HB2 H 1 2.275 0.014 . 2 . . . . A 13 GLN HB2 . 34868 2
135 . 1 . 1 17 17 GLN HB3 H 1 2.163 0.009 . 2 . . . . A 13 GLN HB3 . 34868 2
136 . 1 . 1 17 17 GLN HG2 H 1 2.444 0.003 . 2 . . . . A 13 GLN HG2 . 34868 2
137 . 1 . 1 17 17 GLN HG3 H 1 2.543 0.000 . 2 . . . . A 13 GLN HG3 . 34868 2
138 . 1 . 1 17 17 GLN CA C 13 58.853 0.044 . 1 . . . . A 13 GLN CA . 34868 2
139 . 1 . 1 17 17 GLN CB C 13 27.995 0.104 . 1 . . . . A 13 GLN CB . 34868 2
140 . 1 . 1 17 17 GLN CG C 13 33.863 0.030 . 1 . . . . A 13 GLN CG . 34868 2
141 . 1 . 1 18 18 ALA HA H 1 4.229 0.002 . 1 . . . . A 14 ALA HA . 34868 2
142 . 1 . 1 18 18 ALA HB1 H 1 1.441 0.006 . 1 . . . . A 14 ALA HB1 . 34868 2
143 . 1 . 1 18 18 ALA HB2 H 1 1.441 0.006 . 1 . . . . A 14 ALA HB2 . 34868 2
144 . 1 . 1 18 18 ALA HB3 H 1 1.441 0.006 . 1 . . . . A 14 ALA HB3 . 34868 2
145 . 1 . 1 18 18 ALA CA C 13 55.046 0.015 . 1 . . . . A 14 ALA CA . 34868 2
146 . 1 . 1 18 18 ALA CB C 13 17.300 0.032 . 1 . . . . A 14 ALA CB . 34868 2
147 . 1 . 1 19 19 TRP HA H 1 4.505 0.014 . 1 . . . . A 15 TRP HA . 34868 2
148 . 1 . 1 19 19 TRP HB2 H 1 3.220 0.016 . 2 . . . . A 15 TRP HB2 . 34868 2
149 . 1 . 1 19 19 TRP HB3 H 1 3.232 0.015 . 2 . . . . A 15 TRP HB3 . 34868 2
150 . 1 . 1 19 19 TRP HD1 H 1 5.773 0.006 . 1 . . . . A 15 TRP HD1 . 34868 2
151 . 1 . 1 19 19 TRP HE3 H 1 7.177 0.007 . 1 . . . . A 15 TRP HE3 . 34868 2
152 . 1 . 1 19 19 TRP HZ2 H 1 7.300 0.014 . 1 . . . . A 15 TRP HZ2 . 34868 2
153 . 1 . 1 19 19 TRP HZ3 H 1 6.535 0.006 . 1 . . . . A 15 TRP HZ3 . 34868 2
154 . 1 . 1 19 19 TRP HH2 H 1 6.916 0.007 . 1 . . . . A 15 TRP HH2 . 34868 2
155 . 1 . 1 19 19 TRP CA C 13 59.345 0.120 . 1 . . . . A 15 TRP CA . 34868 2
156 . 1 . 1 19 19 TRP CB C 13 29.534 0.032 . 1 . . . . A 15 TRP CB . 34868 2
157 . 1 . 1 19 19 TRP CD1 C 13 126.153 0.033 . 1 . . . . A 15 TRP CD1 . 34868 2
158 . 1 . 1 19 19 TRP CE3 C 13 121.541 0.068 . 1 . . . . A 15 TRP CE3 . 34868 2
159 . 1 . 1 19 19 TRP CZ2 C 13 114.806 0.068 . 1 . . . . A 15 TRP CZ2 . 34868 2
160 . 1 . 1 19 19 TRP CZ3 C 13 120.392 0.029 . 1 . . . . A 15 TRP CZ3 . 34868 2
161 . 1 . 1 19 19 TRP CH2 C 13 124.809 0.044 . 1 . . . . A 15 TRP CH2 . 34868 2
162 . 1 . 1 20 20 LYS HA H 1 3.427 0.005 . 1 . . . . A 16 LYS HA . 34868 2
163 . 1 . 1 20 20 LYS HB2 H 1 1.860 0.010 . 2 . . . . A 16 LYS HB2 . 34868 2
164 . 1 . 1 20 20 LYS HB3 H 1 1.861 0.009 . 2 . . . . A 16 LYS HB3 . 34868 2
165 . 1 . 1 20 20 LYS HG2 H 1 1.472 0.018 . 2 . . . . A 16 LYS HG2 . 34868 2
166 . 1 . 1 20 20 LYS HG3 H 1 1.832 0.009 . 2 . . . . A 16 LYS HG3 . 34868 2
167 . 1 . 1 20 20 LYS HD2 H 1 1.767 0.006 . 1 . . . . A 16 LYS HD2 . 34868 2
168 . 1 . 1 20 20 LYS HD3 H 1 1.767 0.006 . 1 . . . . A 16 LYS HD3 . 34868 2
169 . 1 . 1 20 20 LYS HE2 H 1 3.009 0.035 . 2 . . . . A 16 LYS HE2 . 34868 2
170 . 1 . 1 20 20 LYS HE3 H 1 3.114 0.022 . 2 . . . . A 16 LYS HE3 . 34868 2
171 . 1 . 1 20 20 LYS CA C 13 61.411 0.016 . 1 . . . . A 16 LYS CA . 34868 2
172 . 1 . 1 20 20 LYS CB C 13 32.267 0.017 . 1 . . . . A 16 LYS CB . 34868 2
173 . 1 . 1 20 20 LYS CG C 13 25.956 0.038 . 1 . . . . A 16 LYS CG . 34868 2
174 . 1 . 1 20 20 LYS CD C 13 29.971 0.025 . 1 . . . . A 16 LYS CD . 34868 2
175 . 1 . 1 20 20 LYS CE C 13 43.227 0.000 . 1 . . . . A 16 LYS CE . 34868 2
176 . 1 . 1 21 21 ASP HA H 1 4.210 0.007 . 1 . . . . A 17 ASP HA . 34868 2
177 . 1 . 1 21 21 ASP HB2 H 1 2.659 0.004 . 2 . . . . A 17 ASP HB2 . 34868 2
178 . 1 . 1 21 21 ASP HB3 H 1 2.840 0.008 . 2 . . . . A 17 ASP HB3 . 34868 2
179 . 1 . 1 21 21 ASP CA C 13 57.136 0.004 . 1 . . . . A 17 ASP CA . 34868 2
180 . 1 . 1 21 21 ASP CB C 13 41.256 0.065 . 1 . . . . A 17 ASP CB . 34868 2
181 . 1 . 1 22 22 ILE HA H 1 3.473 0.005 . 1 . . . . A 18 ILE HA . 34868 2
182 . 1 . 1 22 22 ILE HB H 1 1.380 0.011 . 1 . . . . A 18 ILE HB . 34868 2
183 . 1 . 1 22 22 ILE HG12 H 1 1.732 0.008 . 2 . . . . A 18 ILE HG12 . 34868 2
184 . 1 . 1 22 22 ILE HG13 H 1 0.950 0.007 . 2 . . . . A 18 ILE HG13 . 34868 2
185 . 1 . 1 22 22 ILE HG21 H 1 0.628 0.004 . 1 . . . . A 18 ILE HG21 . 34868 2
186 . 1 . 1 22 22 ILE HG22 H 1 0.628 0.004 . 1 . . . . A 18 ILE HG22 . 34868 2
187 . 1 . 1 22 22 ILE HG23 H 1 0.628 0.004 . 1 . . . . A 18 ILE HG23 . 34868 2
188 . 1 . 1 22 22 ILE HD11 H 1 0.745 0.009 . 1 . . . . A 18 ILE HD11 . 34868 2
189 . 1 . 1 22 22 ILE HD12 H 1 0.745 0.009 . 1 . . . . A 18 ILE HD12 . 34868 2
190 . 1 . 1 22 22 ILE HD13 H 1 0.745 0.009 . 1 . . . . A 18 ILE HD13 . 34868 2
191 . 1 . 1 22 22 ILE CA C 13 63.798 0.010 . 1 . . . . A 18 ILE CA . 34868 2
192 . 1 . 1 22 22 ILE CB C 13 39.680 0.025 . 1 . . . . A 18 ILE CB . 34868 2
193 . 1 . 1 22 22 ILE CG1 C 13 29.354 0.093 . 1 . . . . A 18 ILE CG1 . 34868 2
194 . 1 . 1 22 22 ILE CG2 C 13 17.075 0.030 . 1 . . . . A 18 ILE CG2 . 34868 2
195 . 1 . 1 22 22 ILE CD1 C 13 13.780 0.029 . 1 . . . . A 18 ILE CD1 . 34868 2
196 . 1 . 1 23 23 SER HA H 1 3.036 0.006 . 1 . . . . A 19 SER HA . 34868 2
197 . 1 . 1 23 23 SER HB2 H 1 1.453 0.004 . 2 . . . . A 19 SER HB2 . 34868 2
198 . 1 . 1 23 23 SER HB3 H 1 3.037 0.006 . 2 . . . . A 19 SER HB3 . 34868 2
199 . 1 . 1 23 23 SER CA C 13 59.196 0.031 . 1 . . . . A 19 SER CA . 34868 2
200 . 1 . 1 23 23 SER CB C 13 65.089 0.021 . 1 . . . . A 19 SER CB . 34868 2
201 . 1 . 1 24 24 GLY HA2 H 1 3.742 0.012 . 2 . . . . A 20 GLY HA2 . 34868 2
202 . 1 . 1 24 24 GLY HA3 H 1 4.003 0.001 . 2 . . . . A 20 GLY HA3 . 34868 2
203 . 1 . 1 24 24 GLY CA C 13 45.641 0.016 . 1 . . . . A 20 GLY CA . 34868 2
204 . 1 . 1 25 25 ALA H H 1 7.399 0.000 . 1 . . . . A 21 ALA H . 34868 2
205 . 1 . 1 25 25 ALA HA H 1 4.375 0.005 . 1 . . . . A 21 ALA HA . 34868 2
206 . 1 . 1 25 25 ALA HB1 H 1 1.190 0.006 . 1 . . . . A 21 ALA HB1 . 34868 2
207 . 1 . 1 25 25 ALA HB2 H 1 1.190 0.006 . 1 . . . . A 21 ALA HB2 . 34868 2
208 . 1 . 1 25 25 ALA HB3 H 1 1.190 0.006 . 1 . . . . A 21 ALA HB3 . 34868 2
209 . 1 . 1 25 25 ALA CA C 13 51.798 0.011 . 1 . . . . A 21 ALA CA . 34868 2
210 . 1 . 1 25 25 ALA CB C 13 18.329 0.020 . 1 . . . . A 21 ALA CB . 34868 2
211 . 1 . 1 26 26 ASP HA H 1 4.526 0.010 . 1 . . . . A 22 ASP HA . 34868 2
212 . 1 . 1 26 26 ASP HB2 H 1 2.655 0.002 . 1 . . . . A 22 ASP HB2 . 34868 2
213 . 1 . 1 26 26 ASP HB3 H 1 2.655 0.002 . 1 . . . . A 22 ASP HB3 . 34868 2
214 . 1 . 1 26 26 ASP CA C 13 55.781 0.046 . 1 . . . . A 22 ASP CA . 34868 2
215 . 1 . 1 26 26 ASP CB C 13 42.037 0.024 . 1 . . . . A 22 ASP CB . 34868 2
216 . 1 . 1 27 27 ASP HA H 1 4.717 0.008 . 1 . . . . A 23 ASP HA . 34868 2
217 . 1 . 1 27 27 ASP HB2 H 1 2.719 0.009 . 2 . . . . A 23 ASP HB2 . 34868 2
218 . 1 . 1 27 27 ASP HB3 H 1 2.749 0.020 . 2 . . . . A 23 ASP HB3 . 34868 2
219 . 1 . 1 27 27 ASP CA C 13 53.284 0.033 . 1 . . . . A 23 ASP CA . 34868 2
220 . 1 . 1 27 27 ASP CB C 13 40.150 0.000 . 1 . . . . A 23 ASP CB . 34868 2
221 . 1 . 1 28 28 PHE HA H 1 4.474 0.009 . 1 . . . . A 24 PHE HA . 34868 2
222 . 1 . 1 28 28 PHE HB2 H 1 3.171 0.020 . 2 . . . . A 24 PHE HB2 . 34868 2
223 . 1 . 1 28 28 PHE HB3 H 1 2.907 0.039 . 2 . . . . A 24 PHE HB3 . 34868 2
224 . 1 . 1 28 28 PHE HD1 H 1 7.264 0.009 . 1 . . . . A 24 PHE HD1 . 34868 2
225 . 1 . 1 28 28 PHE HD2 H 1 7.264 0.009 . 1 . . . . A 24 PHE HD2 . 34868 2
226 . 1 . 1 28 28 PHE HE1 H 1 6.692 0.009 . 1 . . . . A 24 PHE HE1 . 34868 2
227 . 1 . 1 28 28 PHE HE2 H 1 6.692 0.009 . 1 . . . . A 24 PHE HE2 . 34868 2
228 . 1 . 1 28 28 PHE CA C 13 59.260 0.064 . 1 . . . . A 24 PHE CA . 34868 2
229 . 1 . 1 28 28 PHE CB C 13 41.944 0.102 . 1 . . . . A 24 PHE CB . 34868 2
230 . 1 . 1 28 28 PHE CD1 C 13 132.605 0.065 . 1 . . . . A 24 PHE CD1 . 34868 2
231 . 1 . 1 28 28 PHE CD2 C 13 132.605 0.065 . 1 . . . . A 24 PHE CD2 . 34868 2
232 . 1 . 1 28 28 PHE CE1 C 13 131.045 0.051 . 1 . . . . A 24 PHE CE1 . 34868 2
233 . 1 . 1 28 28 PHE CE2 C 13 131.045 0.051 . 1 . . . . A 24 PHE CE2 . 34868 2
234 . 1 . 1 29 29 THR HA H 1 4.952 0.007 . 1 . . . . A 25 THR HA . 34868 2
235 . 1 . 1 29 29 THR HB H 1 4.528 0.010 . 1 . . . . A 25 THR HB . 34868 2
236 . 1 . 1 29 29 THR HG21 H 1 1.208 0.005 . 1 . . . . A 25 THR HG21 . 34868 2
237 . 1 . 1 29 29 THR HG22 H 1 1.208 0.005 . 1 . . . . A 25 THR HG22 . 34868 2
238 . 1 . 1 29 29 THR HG23 H 1 1.208 0.005 . 1 . . . . A 25 THR HG23 . 34868 2
239 . 1 . 1 29 29 THR CA C 13 60.296 0.016 . 1 . . . . A 25 THR CA . 34868 2
240 . 1 . 1 29 29 THR CB C 13 71.730 0.041 . 1 . . . . A 25 THR CB . 34868 2
241 . 1 . 1 29 29 THR CG2 C 13 20.843 0.039 . 1 . . . . A 25 THR CG2 . 34868 2
242 . 1 . 1 30 30 THR HA H 1 3.939 0.009 . 1 . . . . A 26 THR HA . 34868 2
243 . 1 . 1 30 30 THR HB H 1 4.372 0.007 . 1 . . . . A 26 THR HB . 34868 2
244 . 1 . 1 30 30 THR HG21 H 1 1.383 0.012 . 1 . . . . A 26 THR HG21 . 34868 2
245 . 1 . 1 30 30 THR HG22 H 1 1.383 0.012 . 1 . . . . A 26 THR HG22 . 34868 2
246 . 1 . 1 30 30 THR HG23 H 1 1.383 0.012 . 1 . . . . A 26 THR HG23 . 34868 2
247 . 1 . 1 30 30 THR CA C 13 64.476 0.043 . 1 . . . . A 26 THR CA . 34868 2
248 . 1 . 1 30 30 THR CB C 13 68.487 0.026 . 1 . . . . A 26 THR CB . 34868 2
249 . 1 . 1 30 30 THR CG2 C 13 23.617 0.030 . 1 . . . . A 26 THR CG2 . 34868 2
250 . 1 . 1 31 31 THR HA H 1 4.466 0.008 . 1 . . . . A 27 THR HA . 34868 2
251 . 1 . 1 31 31 THR HB H 1 4.395 0.006 . 1 . . . . A 27 THR HB . 34868 2
252 . 1 . 1 31 31 THR HG21 H 1 1.046 0.003 . 1 . . . . A 27 THR HG21 . 34868 2
253 . 1 . 1 31 31 THR HG22 H 1 1.046 0.003 . 1 . . . . A 27 THR HG22 . 34868 2
254 . 1 . 1 31 31 THR HG23 H 1 1.046 0.003 . 1 . . . . A 27 THR HG23 . 34868 2
255 . 1 . 1 31 31 THR CA C 13 60.483 0.041 . 1 . . . . A 27 THR CA . 34868 2
256 . 1 . 1 31 31 THR CB C 13 69.244 0.021 . 1 . . . . A 27 THR CB . 34868 2
257 . 1 . 1 31 31 THR CG2 C 13 21.335 0.051 . 1 . . . . A 27 THR CG2 . 34868 2
258 . 1 . 1 32 32 ASP HA H 1 4.383 0.007 . 1 . . . . A 28 ASP HA . 34868 2
259 . 1 . 1 32 32 ASP HB2 H 1 1.306 0.005 . 2 . . . . A 28 ASP HB2 . 34868 2
260 . 1 . 1 32 32 ASP HB3 H 1 1.800 0.007 . 2 . . . . A 28 ASP HB3 . 34868 2
261 . 1 . 1 32 32 ASP CA C 13 54.323 0.041 . 1 . . . . A 28 ASP CA . 34868 2
262 . 1 . 1 32 32 ASP CB C 13 41.919 0.053 . 1 . . . . A 28 ASP CB . 34868 2
263 . 1 . 1 33 33 SER HA H 1 4.681 0.004 . 1 . . . . A 29 SER HA . 34868 2
264 . 1 . 1 33 33 SER HB2 H 1 3.858 0.004 . 2 . . . . A 29 SER HB2 . 34868 2
265 . 1 . 1 33 33 SER HB3 H 1 4.001 0.005 . 2 . . . . A 29 SER HB3 . 34868 2
266 . 1 . 1 33 33 SER CA C 13 56.721 0.043 . 1 . . . . A 29 SER CA . 34868 2
267 . 1 . 1 33 33 SER CB C 13 63.842 0.016 . 1 . . . . A 29 SER CB . 34868 2
268 . 1 . 1 34 34 PHE HA H 1 4.279 0.029 . 1 . . . . A 30 PHE HA . 34868 2
269 . 1 . 1 34 34 PHE HB2 H 1 2.414 0.009 . 2 . . . . A 30 PHE HB2 . 34868 2
270 . 1 . 1 34 34 PHE HB3 H 1 2.673 0.015 . 2 . . . . A 30 PHE HB3 . 34868 2
271 . 1 . 1 34 34 PHE HD1 H 1 5.923 0.007 . 3 . . . . A 30 PHE HD1 . 34868 2
272 . 1 . 1 34 34 PHE HD2 H 1 7.024 0.018 . 3 . . . . A 30 PHE HD2 . 34868 2
273 . 1 . 1 34 34 PHE HE1 H 1 6.538 0.011 . 3 . . . . A 30 PHE HE1 . 34868 2
274 . 1 . 1 34 34 PHE HE2 H 1 6.648 0.016 . 3 . . . . A 30 PHE HE2 . 34868 2
275 . 1 . 1 34 34 PHE HZ H 1 7.202 0.009 . 1 . . . . A 30 PHE HZ . 34868 2
276 . 1 . 1 34 34 PHE CA C 13 60.223 0.024 . 1 . . . . A 30 PHE CA . 34868 2
277 . 1 . 1 34 34 PHE CB C 13 39.082 0.116 . 1 . . . . A 30 PHE CB . 34868 2
278 . 1 . 1 34 34 PHE CD1 C 13 131.234 0.070 . 3 . . . . A 30 PHE CD1 . 34868 2
279 . 1 . 1 34 34 PHE CD2 C 13 131.651 0.078 . 3 . . . . A 30 PHE CD2 . 34868 2
280 . 1 . 1 34 34 PHE CE1 C 13 128.458 0.048 . 3 . . . . A 30 PHE CE1 . 34868 2
281 . 1 . 1 34 34 PHE CE2 C 13 130.237 0.049 . 3 . . . . A 30 PHE CE2 . 34868 2
282 . 1 . 1 34 34 PHE CZ C 13 129.724 0.042 . 1 . . . . A 30 PHE CZ . 34868 2
283 . 1 . 1 35 35 LEU HA H 1 4.348 0.018 . 1 . . . . A 31 LEU HA . 34868 2
284 . 1 . 1 35 35 LEU HB3 H 1 1.720 0.000 . 1 . . . . A 31 LEU HB3 . 34868 2
285 . 1 . 1 35 35 LEU HG H 1 1.695 0.022 . 1 . . . . A 31 LEU HG . 34868 2
286 . 1 . 1 35 35 LEU HD11 H 1 0.792 0.013 . 2 . . . . A 31 LEU HD11 . 34868 2
287 . 1 . 1 35 35 LEU HD12 H 1 0.792 0.013 . 2 . . . . A 31 LEU HD12 . 34868 2
288 . 1 . 1 35 35 LEU HD13 H 1 0.792 0.013 . 2 . . . . A 31 LEU HD13 . 34868 2
289 . 1 . 1 35 35 LEU HD21 H 1 0.917 0.029 . 2 . . . . A 31 LEU HD21 . 34868 2
290 . 1 . 1 35 35 LEU HD22 H 1 0.917 0.029 . 2 . . . . A 31 LEU HD22 . 34868 2
291 . 1 . 1 35 35 LEU HD23 H 1 0.917 0.029 . 2 . . . . A 31 LEU HD23 . 34868 2
292 . 1 . 1 35 35 LEU CA C 13 56.509 0.156 . 1 . . . . A 31 LEU CA . 34868 2
293 . 1 . 1 35 35 LEU CG C 13 27.526 0.041 . 1 . . . . A 31 LEU CG . 34868 2
294 . 1 . 1 35 35 LEU CD1 C 13 24.147 0.102 . 2 . . . . A 31 LEU CD1 . 34868 2
295 . 1 . 1 35 35 LEU CD2 C 13 24.920 0.020 . 2 . . . . A 31 LEU CD2 . 34868 2
296 . 1 . 1 36 36 GLY HA2 H 1 3.967 0.018 . 2 . . . . A 32 GLY HA2 . 34868 2
297 . 1 . 1 36 36 GLY HA3 H 1 4.107 0.000 . 2 . . . . A 32 GLY HA3 . 34868 2
298 . 1 . 1 36 36 GLY CA C 13 45.736 0.085 . 1 . . . . A 32 GLY CA . 34868 2
299 . 1 . 1 37 37 HIS HA H 1 4.848 0.005 . 1 . . . . A 33 HIS HA . 34868 2
300 . 1 . 1 37 37 HIS HB2 H 1 3.681 0.004 . 2 . . . . A 33 HIS HB2 . 34868 2
301 . 1 . 1 37 37 HIS HB3 H 1 3.407 0.009 . 2 . . . . A 33 HIS HB3 . 34868 2
302 . 1 . 1 37 37 HIS HD2 H 1 7.343 0.006 . 1 . . . . A 33 HIS HD2 . 34868 2
303 . 1 . 1 37 37 HIS CA C 13 56.417 0.043 . 1 . . . . A 33 HIS CA . 34868 2
304 . 1 . 1 37 37 HIS CB C 13 30.390 0.051 . 1 . . . . A 33 HIS CB . 34868 2
305 . 1 . 1 37 37 HIS CD2 C 13 120.593 0.056 . 1 . . . . A 33 HIS CD2 . 34868 2
306 . 1 . 1 38 38 GLY HA2 H 1 4.230 0.014 . 2 . . . . A 34 GLY HA2 . 34868 2
307 . 1 . 1 38 38 GLY HA3 H 1 3.967 0.014 . 2 . . . . A 34 GLY HA3 . 34868 2
308 . 1 . 1 38 38 GLY CA C 13 45.704 0.059 . 1 . . . . A 34 GLY CA . 34868 2
309 . 1 . 1 39 39 GLY HA2 H 1 3.966 0.014 . 2 . . . . A 35 GLY HA2 . 34868 2
310 . 1 . 1 39 39 GLY HA3 H 1 4.238 0.016 . 2 . . . . A 35 GLY HA3 . 34868 2
311 . 1 . 1 39 39 GLY CA C 13 45.704 0.059 . 1 . . . . A 35 GLY CA . 34868 2
312 . 1 . 1 40 40 ASN HA H 1 4.657 0.003 . 1 . . . . A 36 ASN HA . 34868 2
313 . 1 . 1 40 40 ASN HB2 H 1 2.728 0.025 . 2 . . . . A 36 ASN HB2 . 34868 2
314 . 1 . 1 40 40 ASN HB3 H 1 2.490 0.003 . 2 . . . . A 36 ASN HB3 . 34868 2
315 . 1 . 1 40 40 ASN CA C 13 52.269 0.131 . 1 . . . . A 36 ASN CA . 34868 2
316 . 1 . 1 40 40 ASN CB C 13 39.367 0.132 . 1 . . . . A 36 ASN CB . 34868 2
317 . 1 . 1 41 41 4HH CA C 13 60.155 0.035 . 1 . . . . A 37 4HH CA . 34868 2
318 . 1 . 1 41 41 4HH CB C 13 65.820 0.045 . 1 . . . . A 37 4HH CB . 34868 2
319 . 1 . 1 41 41 4HH CJ C 13 74.226 0.023 . 1 . . . . A 37 4HH CJ . 34868 2
320 . 1 . 1 41 41 4HH CL1 C 13 23.890 0.034 . 1 . . . . A 37 4HH CL1 . 34868 2
321 . 1 . 1 41 41 4HH CL2 C 13 21.636 0.034 . 1 . . . . A 37 4HH CL2 . 34868 2
322 . 1 . 1 41 41 4HH CM C 13 76.817 0.010 . 1 . . . . A 37 4HH CM . 34868 2
323 . 1 . 1 41 41 4HH CO C 13 38.123 0.024 . 1 . . . . A 37 4HH CO . 34868 2
324 . 1 . 1 41 41 4HH CP C 13 37.959 0.031 . 1 . . . . A 37 4HH CP . 34868 2
325 . 1 . 1 41 41 4HH CS C 13 44.979 0.000 . 1 . . . . A 37 4HH CS . 34868 2
326 . 1 . 1 41 41 4HH CT C 13 25.860 0.035 . 1 . . . . A 37 4HH CT . 34868 2
327 . 1 . 1 41 41 4HH HA H 1 3.875 0.005 . 1 . . . . A 37 4HH HA . 34868 2
328 . 1 . 1 41 41 4HH HB2 H 1 4.204 0.008 . 2 . . . . A 37 4HH HB2 . 34868 2
329 . 1 . 1 41 41 4HH HB2 H 1 4.206 0.007 . 2 . . . . A 37 4HH HB2 . 34868 2
330 . 1 . 1 41 41 4HH HJ2 H 1 3.827 0.014 . 2 . . . . A 37 4HH HJ2 . 34868 2
331 . 1 . 1 41 41 4HH HJ3 H 1 3.418 0.012 . 2 . . . . A 37 4HH HJ3 . 34868 2
332 . 1 . 1 41 41 4HH HL11 H 1 1.011 0.006 . 1 . . . . A 37 4HH HL11 . 34868 2
333 . 1 . 1 41 41 4HH HL12 H 1 1.011 0.006 . 1 . . . . A 37 4HH HL12 . 34868 2
334 . 1 . 1 41 41 4HH HL13 H 1 1.011 0.006 . 1 . . . . A 37 4HH HL13 . 34868 2
335 . 1 . 1 41 41 4HH HL21 H 1 0.867 0.010 . 1 . . . . A 37 4HH HL21 . 34868 2
336 . 1 . 1 41 41 4HH HL22 H 1 0.867 0.010 . 1 . . . . A 37 4HH HL22 . 34868 2
337 . 1 . 1 41 41 4HH HL23 H 1 0.867 0.010 . 1 . . . . A 37 4HH HL23 . 34868 2
338 . 1 . 1 41 41 4HH HL3 H 1 4.045 0.007 . 1 . . . . A 37 4HH HL3 . 34868 2
339 . 1 . 1 41 41 4HH HO2 H 1 3.431 0.013 . 1 . . . . A 37 4HH HO2 . 34868 2
340 . 1 . 1 41 41 4HH HO3 H 1 3.431 0.013 . 1 . . . . A 37 4HH HO3 . 34868 2
341 . 1 . 1 41 41 4HH HP2 H 1 2.425 0.003 . 1 . . . . A 37 4HH HP2 . 34868 2
342 . 1 . 1 41 41 4HH HP3 H 1 2.425 0.003 . 1 . . . . A 37 4HH HP3 . 34868 2
343 . 1 . 1 41 41 4HH HS2 H 1 3.298 0.000 . 1 . . . . A 37 4HH HS2 . 34868 2
344 . 1 . 1 41 41 4HH HS3 H 1 3.298 0.000 . 1 . . . . A 37 4HH HS3 . 34868 2
345 . 1 . 1 41 41 4HH HT2 H 1 2.589 0.004 . 1 . . . . A 37 4HH HT2 . 34868 2
346 . 1 . 1 41 41 4HH HT3 H 1 2.589 0.004 . 1 . . . . A 37 4HH HT3 . 34868 2
347 . 1 . 1 42 42 LEU HA H 1 4.178 0.006 . 1 . . . . A 38 LEU HA . 34868 2
348 . 1 . 1 42 42 LEU HB2 H 1 1.602 0.011 . 2 . . . . A 38 LEU HB2 . 34868 2
349 . 1 . 1 42 42 LEU HB3 H 1 1.503 0.012 . 2 . . . . A 38 LEU HB3 . 34868 2
350 . 1 . 1 42 42 LEU HG H 1 1.618 0.003 . 1 . . . . A 38 LEU HG . 34868 2
351 . 1 . 1 42 42 LEU HD11 H 1 0.889 0.014 . 2 . . . . A 38 LEU HD11 . 34868 2
352 . 1 . 1 42 42 LEU HD12 H 1 0.889 0.014 . 2 . . . . A 38 LEU HD12 . 34868 2
353 . 1 . 1 42 42 LEU HD13 H 1 0.889 0.014 . 2 . . . . A 38 LEU HD13 . 34868 2
354 . 1 . 1 42 42 LEU HD21 H 1 0.911 0.017 . 2 . . . . A 38 LEU HD21 . 34868 2
355 . 1 . 1 42 42 LEU HD22 H 1 0.911 0.017 . 2 . . . . A 38 LEU HD22 . 34868 2
356 . 1 . 1 42 42 LEU HD23 H 1 0.911 0.017 . 2 . . . . A 38 LEU HD23 . 34868 2
357 . 1 . 1 42 42 LEU CA C 13 57.762 0.078 . 1 . . . . A 38 LEU CA . 34868 2
358 . 1 . 1 42 42 LEU CB C 13 41.162 0.030 . 1 . . . . A 38 LEU CB . 34868 2
359 . 1 . 1 42 42 LEU CG C 13 27.106 0.090 . 1 . . . . A 38 LEU CG . 34868 2
360 . 1 . 1 42 42 LEU CD1 C 13 24.143 0.028 . 2 . . . . A 38 LEU CD1 . 34868 2
361 . 1 . 1 42 42 LEU CD2 C 13 24.140 0.030 . 2 . . . . A 38 LEU CD2 . 34868 2
362 . 1 . 1 43 43 HIS H H 1 7.795 0.003 . 1 . . . . A 39 HIS H . 34868 2
363 . 1 . 1 43 43 HIS HA H 1 4.468 0.006 . 1 . . . . A 39 HIS HA . 34868 2
364 . 1 . 1 43 43 HIS HB2 H 1 3.196 0.007 . 2 . . . . A 39 HIS HB2 . 34868 2
365 . 1 . 1 43 43 HIS HB3 H 1 2.976 0.004 . 2 . . . . A 39 HIS HB3 . 34868 2
366 . 1 . 1 43 43 HIS HD2 H 1 6.755 0.005 . 1 . . . . A 39 HIS HD2 . 34868 2
367 . 1 . 1 43 43 HIS CA C 13 57.557 0.047 . 1 . . . . A 39 HIS CA . 34868 2
368 . 1 . 1 43 43 HIS CB C 13 31.251 0.060 . 1 . . . . A 39 HIS CB . 34868 2
369 . 1 . 1 43 43 HIS CD2 C 13 117.398 0.028 . 1 . . . . A 39 HIS CD2 . 34868 2
370 . 1 . 1 44 44 PHE H H 1 7.795 0.003 . 1 . . . . A 40 PHE H . 34868 2
371 . 1 . 1 44 44 PHE HA H 1 4.416 0.014 . 1 . . . . A 40 PHE HA . 34868 2
372 . 1 . 1 44 44 PHE HB2 H 1 3.002 0.008 . 2 . . . . A 40 PHE HB2 . 34868 2
373 . 1 . 1 44 44 PHE HB3 H 1 3.369 0.009 . 2 . . . . A 40 PHE HB3 . 34868 2
374 . 1 . 1 44 44 PHE HD1 H 1 6.978 0.006 . 1 . . . . A 40 PHE HD1 . 34868 2
375 . 1 . 1 44 44 PHE HD2 H 1 6.978 0.006 . 1 . . . . A 40 PHE HD2 . 34868 2
376 . 1 . 1 44 44 PHE HE1 H 1 7.038 0.014 . 1 . . . . A 40 PHE HE1 . 34868 2
377 . 1 . 1 44 44 PHE HE2 H 1 7.038 0.014 . 1 . . . . A 40 PHE HE2 . 34868 2
378 . 1 . 1 44 44 PHE CA C 13 59.738 0.085 . 1 . . . . A 40 PHE CA . 34868 2
379 . 1 . 1 44 44 PHE CB C 13 37.760 0.078 . 1 . . . . A 40 PHE CB . 34868 2
380 . 1 . 1 44 44 PHE CD1 C 13 130.693 0.167 . 1 . . . . A 40 PHE CD1 . 34868 2
381 . 1 . 1 44 44 PHE CD2 C 13 130.693 0.167 . 1 . . . . A 40 PHE CD2 . 34868 2
382 . 1 . 1 44 44 PHE CE1 C 13 131.426 0.089 . 1 . . . . A 40 PHE CE1 . 34868 2
383 . 1 . 1 44 44 PHE CE2 C 13 131.426 0.089 . 1 . . . . A 40 PHE CE2 . 34868 2
384 . 1 . 1 45 45 VAL HA H 1 3.859 0.009 . 1 . . . . A 41 VAL HA . 34868 2
385 . 1 . 1 45 45 VAL HB H 1 2.353 0.014 . 1 . . . . A 41 VAL HB . 34868 2
386 . 1 . 1 45 45 VAL HG11 H 1 1.071 0.009 . 2 . . . . A 41 VAL HG11 . 34868 2
387 . 1 . 1 45 45 VAL HG12 H 1 1.071 0.009 . 2 . . . . A 41 VAL HG12 . 34868 2
388 . 1 . 1 45 45 VAL HG13 H 1 1.071 0.009 . 2 . . . . A 41 VAL HG13 . 34868 2
389 . 1 . 1 45 45 VAL HG21 H 1 1.236 0.003 . 2 . . . . A 41 VAL HG21 . 34868 2
390 . 1 . 1 45 45 VAL HG22 H 1 1.236 0.003 . 2 . . . . A 41 VAL HG22 . 34868 2
391 . 1 . 1 45 45 VAL HG23 H 1 1.236 0.003 . 2 . . . . A 41 VAL HG23 . 34868 2
392 . 1 . 1 45 45 VAL CA C 13 65.754 0.061 . 1 . . . . A 41 VAL CA . 34868 2
393 . 1 . 1 45 45 VAL CB C 13 32.085 0.037 . 1 . . . . A 41 VAL CB . 34868 2
394 . 1 . 1 45 45 VAL CG1 C 13 20.889 0.071 . 2 . . . . A 41 VAL CG1 . 34868 2
395 . 1 . 1 45 45 VAL CG2 C 13 22.707 0.035 . 2 . . . . A 41 VAL CG2 . 34868 2
396 . 1 . 1 46 46 GLN HA H 1 4.163 0.019 . 1 . . . . A 42 GLN HA . 34868 2
397 . 1 . 1 46 46 GLN HB2 H 1 2.057 0.005 . 2 . . . . A 42 GLN HB2 . 34868 2
398 . 1 . 1 46 46 GLN HB3 H 1 2.326 0.008 . 2 . . . . A 42 GLN HB3 . 34868 2
399 . 1 . 1 46 46 GLN HG2 H 1 2.447 0.014 . 2 . . . . A 42 GLN HG2 . 34868 2
400 . 1 . 1 46 46 GLN HG3 H 1 2.620 0.011 . 2 . . . . A 42 GLN HG3 . 34868 2
401 . 1 . 1 46 46 GLN CA C 13 58.757 0.040 . 1 . . . . A 42 GLN CA . 34868 2
402 . 1 . 1 46 46 GLN CB C 13 28.978 0.082 . 1 . . . . A 42 GLN CB . 34868 2
403 . 1 . 1 46 46 GLN CG C 13 34.468 0.078 . 1 . . . . A 42 GLN CG . 34868 2
404 . 1 . 1 47 47 LEU HA H 1 3.978 0.008 . 1 . . . . A 43 LEU HA . 34868 2
405 . 1 . 1 47 47 LEU HB2 H 1 2.051 0.014 . 2 . . . . A 43 LEU HB2 . 34868 2
406 . 1 . 1 47 47 LEU HB3 H 1 1.704 0.010 . 2 . . . . A 43 LEU HB3 . 34868 2
407 . 1 . 1 47 47 LEU HG H 1 1.397 0.006 . 1 . . . . A 43 LEU HG . 34868 2
408 . 1 . 1 47 47 LEU HD11 H 1 0.344 0.006 . 2 . . . . A 43 LEU HD11 . 34868 2
409 . 1 . 1 47 47 LEU HD12 H 1 0.344 0.006 . 2 . . . . A 43 LEU HD12 . 34868 2
410 . 1 . 1 47 47 LEU HD13 H 1 0.344 0.006 . 2 . . . . A 43 LEU HD13 . 34868 2
411 . 1 . 1 47 47 LEU HD21 H 1 1.005 0.008 . 2 . . . . A 43 LEU HD21 . 34868 2
412 . 1 . 1 47 47 LEU HD22 H 1 1.005 0.008 . 2 . . . . A 43 LEU HD22 . 34868 2
413 . 1 . 1 47 47 LEU HD23 H 1 1.005 0.008 . 2 . . . . A 43 LEU HD23 . 34868 2
414 . 1 . 1 47 47 LEU CA C 13 58.434 0.066 . 1 . . . . A 43 LEU CA . 34868 2
415 . 1 . 1 47 47 LEU CB C 13 41.778 0.081 . 1 . . . . A 43 LEU CB . 34868 2
416 . 1 . 1 47 47 LEU CG C 13 26.905 0.057 . 1 . . . . A 43 LEU CG . 34868 2
417 . 1 . 1 47 47 LEU CD1 C 13 25.696 0.028 . 2 . . . . A 43 LEU CD1 . 34868 2
418 . 1 . 1 47 47 LEU CD2 C 13 23.348 0.095 . 2 . . . . A 43 LEU CD2 . 34868 2
419 . 1 . 1 48 48 ALA HA H 1 3.703 0.004 . 1 . . . . A 44 ALA HA . 34868 2
420 . 1 . 1 48 48 ALA HB1 H 1 1.393 0.008 . 1 . . . . A 44 ALA HB1 . 34868 2
421 . 1 . 1 48 48 ALA HB2 H 1 1.393 0.008 . 1 . . . . A 44 ALA HB2 . 34868 2
422 . 1 . 1 48 48 ALA HB3 H 1 1.393 0.008 . 1 . . . . A 44 ALA HB3 . 34868 2
423 . 1 . 1 48 48 ALA CA C 13 56.161 0.011 . 1 . . . . A 44 ALA CA . 34868 2
424 . 1 . 1 48 48 ALA CB C 13 17.230 0.026 . 1 . . . . A 44 ALA CB . 34868 2
425 . 1 . 1 49 49 SER HA H 1 4.295 0.008 . 1 . . . . A 45 SER HA . 34868 2
426 . 1 . 1 49 49 SER HB2 H 1 4.027 0.012 . 2 . . . . A 45 SER HB2 . 34868 2
427 . 1 . 1 49 49 SER HB3 H 1 4.031 0.016 . 2 . . . . A 45 SER HB3 . 34868 2
428 . 1 . 1 49 49 SER CA C 13 61.317 0.096 . 1 . . . . A 45 SER CA . 34868 2
429 . 1 . 1 49 49 SER CB C 13 63.075 0.030 . 1 . . . . A 45 SER CB . 34868 2
430 . 1 . 1 50 50 ARG HA H 1 4.139 0.015 . 1 . . . . A 46 ARG HA . 34868 2
431 . 1 . 1 50 50 ARG HB2 H 1 2.147 0.004 . 2 . . . . A 46 ARG HB2 . 34868 2
432 . 1 . 1 50 50 ARG HB3 H 1 1.921 0.002 . 2 . . . . A 46 ARG HB3 . 34868 2
433 . 1 . 1 50 50 ARG HG2 H 1 1.759 0.005 . 2 . . . . A 46 ARG HG2 . 34868 2
434 . 1 . 1 50 50 ARG HG3 H 1 1.761 0.006 . 2 . . . . A 46 ARG HG3 . 34868 2
435 . 1 . 1 50 50 ARG HD2 H 1 3.162 0.014 . 2 . . . . A 46 ARG HD2 . 34868 2
436 . 1 . 1 50 50 ARG HD3 H 1 3.306 0.003 . 2 . . . . A 46 ARG HD3 . 34868 2
437 . 1 . 1 50 50 ARG CA C 13 58.982 0.090 . 1 . . . . A 46 ARG CA . 34868 2
438 . 1 . 1 50 50 ARG CB C 13 29.910 0.023 . 1 . . . . A 46 ARG CB . 34868 2
439 . 1 . 1 50 50 ARG CG C 13 26.798 0.080 . 1 . . . . A 46 ARG CG . 34868 2
440 . 1 . 1 50 50 ARG CD C 13 42.788 0.037 . 1 . . . . A 46 ARG CD . 34868 2
441 . 1 . 1 51 51 LEU HA H 1 4.068 0.016 . 1 . . . . A 47 LEU HA . 34868 2
442 . 1 . 1 51 51 LEU HB2 H 1 1.514 0.013 . 2 . . . . A 47 LEU HB2 . 34868 2
443 . 1 . 1 51 51 LEU HB3 H 1 2.128 0.017 . 2 . . . . A 47 LEU HB3 . 34868 2
444 . 1 . 1 51 51 LEU HG H 1 2.340 0.010 . 1 . . . . A 47 LEU HG . 34868 2
445 . 1 . 1 51 51 LEU HD11 H 1 0.962 0.013 . 1 . . . . A 47 LEU HD11 . 34868 2
446 . 1 . 1 51 51 LEU HD12 H 1 0.962 0.013 . 1 . . . . A 47 LEU HD12 . 34868 2
447 . 1 . 1 51 51 LEU HD13 H 1 0.962 0.013 . 1 . . . . A 47 LEU HD13 . 34868 2
448 . 1 . 1 51 51 LEU HD21 H 1 0.962 0.013 . 1 . . . . A 47 LEU HD21 . 34868 2
449 . 1 . 1 51 51 LEU HD22 H 1 0.962 0.013 . 1 . . . . A 47 LEU HD22 . 34868 2
450 . 1 . 1 51 51 LEU HD23 H 1 0.962 0.013 . 1 . . . . A 47 LEU HD23 . 34868 2
451 . 1 . 1 51 51 LEU CA C 13 58.286 0.072 . 1 . . . . A 47 LEU CA . 34868 2
452 . 1 . 1 51 51 LEU CB C 13 41.131 0.061 . 1 . . . . A 47 LEU CB . 34868 2
453 . 1 . 1 51 51 LEU CG C 13 26.416 0.027 . 1 . . . . A 47 LEU CG . 34868 2
454 . 1 . 1 51 51 LEU CD1 C 13 27.190 0.037 . 2 . . . . A 47 LEU CD1 . 34868 2
455 . 1 . 1 51 51 LEU CD2 C 13 27.191 0.037 . 2 . . . . A 47 LEU CD2 . 34868 2
456 . 1 . 1 52 52 GLN HA H 1 4.689 0.008 . 1 . . . . A 48 GLN HA . 34868 2
457 . 1 . 1 52 52 GLN HB2 H 1 2.304 0.007 . 2 . . . . A 48 GLN HB2 . 34868 2
458 . 1 . 1 52 52 GLN HB3 H 1 2.526 0.004 . 2 . . . . A 48 GLN HB3 . 34868 2
459 . 1 . 1 52 52 GLN HG2 H 1 2.765 0.004 . 2 . . . . A 48 GLN HG2 . 34868 2
460 . 1 . 1 52 52 GLN HG3 H 1 2.412 0.003 . 2 . . . . A 48 GLN HG3 . 34868 2
461 . 1 . 1 52 52 GLN CA C 13 59.365 0.039 . 1 . . . . A 48 GLN CA . 34868 2
462 . 1 . 1 52 52 GLN CB C 13 28.542 0.008 . 1 . . . . A 48 GLN CB . 34868 2
463 . 1 . 1 52 52 GLN CG C 13 33.536 0.109 . 1 . . . . A 48 GLN CG . 34868 2
464 . 1 . 1 53 53 LYS HA H 1 4.122 0.005 . 1 . . . . A 49 LYS HA . 34868 2
465 . 1 . 1 53 53 LYS HB2 H 1 2.032 0.009 . 2 . . . . A 49 LYS HB2 . 34868 2
466 . 1 . 1 53 53 LYS HB3 H 1 2.034 0.009 . 2 . . . . A 49 LYS HB3 . 34868 2
467 . 1 . 1 53 53 LYS HG2 H 1 1.562 0.001 . 2 . . . . A 49 LYS HG2 . 34868 2
468 . 1 . 1 53 53 LYS HG3 H 1 1.558 0.005 . 2 . . . . A 49 LYS HG3 . 34868 2
469 . 1 . 1 53 53 LYS HD2 H 1 1.731 0.008 . 1 . . . . A 49 LYS HD2 . 34868 2
470 . 1 . 1 53 53 LYS HD3 H 1 1.732 0.008 . 1 . . . . A 49 LYS HD3 . 34868 2
471 . 1 . 1 53 53 LYS HE2 H 1 2.991 0.014 . 2 . . . . A 49 LYS HE2 . 34868 2
472 . 1 . 1 53 53 LYS HE3 H 1 2.990 0.014 . 2 . . . . A 49 LYS HE3 . 34868 2
473 . 1 . 1 53 53 LYS CA C 13 58.835 0.060 . 1 . . . . A 49 LYS CA . 34868 2
474 . 1 . 1 53 53 LYS CB C 13 32.313 0.079 . 1 . . . . A 49 LYS CB . 34868 2
475 . 1 . 1 53 53 LYS CG C 13 25.045 0.031 . 1 . . . . A 49 LYS CG . 34868 2
476 . 1 . 1 53 53 LYS CD C 13 28.784 0.072 . 1 . . . . A 49 LYS CD . 34868 2
477 . 1 . 1 53 53 LYS CE C 13 41.903 0.075 . 1 . . . . A 49 LYS CE . 34868 2
478 . 1 . 1 54 54 ILE HA H 1 3.606 0.007 . 1 . . . . A 50 ILE HA . 34868 2
479 . 1 . 1 54 54 ILE HB H 1 1.226 0.009 . 1 . . . . A 50 ILE HB . 34868 2
480 . 1 . 1 54 54 ILE HG12 H 1 1.704 0.005 . 2 . . . . A 50 ILE HG12 . 34868 2
481 . 1 . 1 54 54 ILE HG13 H 1 0.852 0.045 . 2 . . . . A 50 ILE HG13 . 34868 2
482 . 1 . 1 54 54 ILE HG21 H 1 0.084 0.007 . 1 . . . . A 50 ILE HG21 . 34868 2
483 . 1 . 1 54 54 ILE HG22 H 1 0.084 0.007 . 1 . . . . A 50 ILE HG22 . 34868 2
484 . 1 . 1 54 54 ILE HG23 H 1 0.084 0.007 . 1 . . . . A 50 ILE HG23 . 34868 2
485 . 1 . 1 54 54 ILE HD11 H 1 0.631 0.010 . 1 . . . . A 50 ILE HD11 . 34868 2
486 . 1 . 1 54 54 ILE HD12 H 1 0.631 0.010 . 1 . . . . A 50 ILE HD12 . 34868 2
487 . 1 . 1 54 54 ILE HD13 H 1 0.631 0.010 . 1 . . . . A 50 ILE HD13 . 34868 2
488 . 1 . 1 54 54 ILE CA C 13 65.353 0.082 . 1 . . . . A 50 ILE CA . 34868 2
489 . 1 . 1 54 54 ILE CB C 13 39.526 0.058 . 1 . . . . A 50 ILE CB . 34868 2
490 . 1 . 1 54 54 ILE CG1 C 13 28.247 0.131 . 1 . . . . A 50 ILE CG1 . 34868 2
491 . 1 . 1 54 54 ILE CG2 C 13 16.673 0.107 . 1 . . . . A 50 ILE CG2 . 34868 2
492 . 1 . 1 54 54 ILE CD1 C 13 13.880 0.034 . 1 . . . . A 50 ILE CD1 . 34868 2
493 . 1 . 1 55 55 PHE HA H 1 4.775 0.013 . 1 . . . . A 51 PHE HA . 34868 2
494 . 1 . 1 55 55 PHE HB2 H 1 2.926 0.005 . 2 . . . . A 51 PHE HB2 . 34868 2
495 . 1 . 1 55 55 PHE HB3 H 1 3.167 0.011 . 2 . . . . A 51 PHE HB3 . 34868 2
496 . 1 . 1 55 55 PHE HD1 H 1 7.450 0.009 . 1 . . . . A 51 PHE HD1 . 34868 2
497 . 1 . 1 55 55 PHE HD2 H 1 7.450 0.009 . 1 . . . . A 51 PHE HD2 . 34868 2
498 . 1 . 1 55 55 PHE HE1 H 1 7.233 0.013 . 1 . . . . A 51 PHE HE1 . 34868 2
499 . 1 . 1 55 55 PHE HE2 H 1 7.233 0.013 . 1 . . . . A 51 PHE HE2 . 34868 2
500 . 1 . 1 55 55 PHE CA C 13 58.924 0.049 . 1 . . . . A 51 PHE CA . 34868 2
501 . 1 . 1 55 55 PHE CB C 13 40.536 0.115 . 1 . . . . A 51 PHE CB . 34868 2
502 . 1 . 1 55 55 PHE CD1 C 13 132.176 0.084 . 1 . . . . A 51 PHE CD1 . 34868 2
503 . 1 . 1 55 55 PHE CD2 C 13 132.176 0.084 . 1 . . . . A 51 PHE CD2 . 34868 2
504 . 1 . 1 55 55 PHE CE1 C 13 131.434 0.068 . 1 . . . . A 51 PHE CE1 . 34868 2
505 . 1 . 1 55 55 PHE CE2 C 13 131.434 0.068 . 1 . . . . A 51 PHE CE2 . 34868 2
506 . 1 . 1 56 56 GLY HA2 H 1 3.980 0.000 . 2 . . . . A 52 GLY HA2 . 34868 2
507 . 1 . 1 56 56 GLY HA3 H 1 4.033 0.000 . 2 . . . . A 52 GLY HA3 . 34868 2
508 . 1 . 1 56 56 GLY CA C 13 46.794 0.044 . 1 . . . . A 52 GLY CA . 34868 2
509 . 1 . 1 57 57 VAL HA H 1 4.495 0.005 . 1 . . . . A 53 VAL HA . 34868 2
510 . 1 . 1 57 57 VAL HB H 1 1.974 0.006 . 1 . . . . A 53 VAL HB . 34868 2
511 . 1 . 1 57 57 VAL HG11 H 1 0.791 0.005 . 2 . . . . A 53 VAL HG11 . 34868 2
512 . 1 . 1 57 57 VAL HG12 H 1 0.791 0.005 . 2 . . . . A 53 VAL HG12 . 34868 2
513 . 1 . 1 57 57 VAL HG13 H 1 0.791 0.005 . 2 . . . . A 53 VAL HG13 . 34868 2
514 . 1 . 1 57 57 VAL HG21 H 1 0.692 0.012 . 2 . . . . A 53 VAL HG21 . 34868 2
515 . 1 . 1 57 57 VAL HG22 H 1 0.692 0.012 . 2 . . . . A 53 VAL HG22 . 34868 2
516 . 1 . 1 57 57 VAL HG23 H 1 0.692 0.012 . 2 . . . . A 53 VAL HG23 . 34868 2
517 . 1 . 1 57 57 VAL CA C 13 58.248 0.008 . 1 . . . . A 53 VAL CA . 34868 2
518 . 1 . 1 57 57 VAL CB C 13 34.720 0.023 . 1 . . . . A 53 VAL CB . 34868 2
519 . 1 . 1 57 57 VAL CG1 C 13 21.455 0.058 . 2 . . . . A 53 VAL CG1 . 34868 2
520 . 1 . 1 57 57 VAL CG2 C 13 19.099 0.021 . 2 . . . . A 53 VAL CG2 . 34868 2
521 . 1 . 1 58 58 GLU HA H 1 4.114 0.004 . 1 . . . . A 54 GLU HA . 34868 2
522 . 1 . 1 58 58 GLU HB2 H 1 1.971 0.007 . 2 . . . . A 54 GLU HB2 . 34868 2
523 . 1 . 1 58 58 GLU HB3 H 1 1.961 0.004 . 2 . . . . A 54 GLU HB3 . 34868 2
524 . 1 . 1 58 58 GLU HG2 H 1 2.234 0.010 . 1 . . . . A 54 GLU HG2 . 34868 2
525 . 1 . 1 58 58 GLU HG3 H 1 2.234 0.010 . 1 . . . . A 54 GLU HG3 . 34868 2
526 . 1 . 1 58 58 GLU CA C 13 57.316 0.083 . 1 . . . . A 54 GLU CA . 34868 2
527 . 1 . 1 58 58 GLU CB C 13 29.516 0.087 . 1 . . . . A 54 GLU CB . 34868 2
528 . 1 . 1 58 58 GLU CG C 13 36.627 0.052 . 1 . . . . A 54 GLU CG . 34868 2
529 . 1 . 1 59 59 VAL HA H 1 4.560 0.005 . 1 . . . . A 55 VAL HA . 34868 2
530 . 1 . 1 59 59 VAL HB H 1 2.361 0.013 . 1 . . . . A 55 VAL HB . 34868 2
531 . 1 . 1 59 59 VAL HG11 H 1 1.014 0.014 . 2 . . . . A 55 VAL HG11 . 34868 2
532 . 1 . 1 59 59 VAL HG12 H 1 1.014 0.014 . 2 . . . . A 55 VAL HG12 . 34868 2
533 . 1 . 1 59 59 VAL HG13 H 1 1.014 0.014 . 2 . . . . A 55 VAL HG13 . 34868 2
534 . 1 . 1 59 59 VAL HG21 H 1 0.989 0.006 . 2 . . . . A 55 VAL HG21 . 34868 2
535 . 1 . 1 59 59 VAL HG22 H 1 0.989 0.006 . 2 . . . . A 55 VAL HG22 . 34868 2
536 . 1 . 1 59 59 VAL HG23 H 1 0.989 0.006 . 2 . . . . A 55 VAL HG23 . 34868 2
537 . 1 . 1 59 59 VAL CA C 13 61.868 0.022 . 1 . . . . A 55 VAL CA . 34868 2
538 . 1 . 1 59 59 VAL CB C 13 34.256 0.027 . 1 . . . . A 55 VAL CB . 34868 2
539 . 1 . 1 59 59 VAL CG1 C 13 21.926 0.020 . 2 . . . . A 55 VAL CG1 . 34868 2
540 . 1 . 1 59 59 VAL CG2 C 13 21.210 0.049 . 2 . . . . A 55 VAL CG2 . 34868 2
541 . 1 . 1 60 60 SER HA H 1 5.050 0.005 . 1 . . . . A 56 SER HA . 34868 2
542 . 1 . 1 60 60 SER HB2 H 1 4.329 0.007 . 2 . . . . A 56 SER HB2 . 34868 2
543 . 1 . 1 60 60 SER HB3 H 1 3.982 0.007 . 2 . . . . A 56 SER HB3 . 34868 2
544 . 1 . 1 60 60 SER CA C 13 56.071 0.009 . 1 . . . . A 56 SER CA . 34868 2
545 . 1 . 1 60 60 SER CB C 13 67.090 0.019 . 1 . . . . A 56 SER CB . 34868 2
546 . 1 . 1 61 61 THR HA H 1 3.598 0.011 . 1 . . . . A 57 THR HA . 34868 2
547 . 1 . 1 61 61 THR HB H 1 4.110 0.018 . 1 . . . . A 57 THR HB . 34868 2
548 . 1 . 1 61 61 THR HG21 H 1 1.288 0.014 . 1 . . . . A 57 THR HG21 . 34868 2
549 . 1 . 1 61 61 THR HG22 H 1 1.288 0.014 . 1 . . . . A 57 THR HG22 . 34868 2
550 . 1 . 1 61 61 THR HG23 H 1 1.288 0.014 . 1 . . . . A 57 THR HG23 . 34868 2
551 . 1 . 1 61 61 THR CA C 13 66.852 0.034 . 1 . . . . A 57 THR CA . 34868 2
552 . 1 . 1 61 61 THR CB C 13 67.863 0.074 . 1 . . . . A 57 THR CB . 34868 2
553 . 1 . 1 61 61 THR CG2 C 13 23.378 0.029 . 1 . . . . A 57 THR CG2 . 34868 2
554 . 1 . 1 62 62 GLU HA H 1 4.026 0.006 . 1 . . . . A 58 GLU HA . 34868 2
555 . 1 . 1 62 62 GLU HB2 H 1 2.009 0.000 . 2 . . . . A 58 GLU HB2 . 34868 2
556 . 1 . 1 62 62 GLU HB3 H 1 1.936 0.006 . 2 . . . . A 58 GLU HB3 . 34868 2
557 . 1 . 1 62 62 GLU HG2 H 1 2.293 0.014 . 1 . . . . A 58 GLU HG2 . 34868 2
558 . 1 . 1 62 62 GLU CA C 13 59.991 0.091 . 1 . . . . A 58 GLU CA . 34868 2
559 . 1 . 1 62 62 GLU CG C 13 36.797 0.158 . 1 . . . . A 58 GLU CG . 34868 2
560 . 1 . 1 63 63 ASP HA H 1 4.151 0.009 . 1 . . . . A 59 ASP HA . 34868 2
561 . 1 . 1 63 63 ASP HB2 H 1 2.980 0.016 . 2 . . . . A 59 ASP HB2 . 34868 2
562 . 1 . 1 63 63 ASP HB3 H 1 1.822 0.001 . 2 . . . . A 59 ASP HB3 . 34868 2
563 . 1 . 1 63 63 ASP CA C 13 57.796 0.030 . 1 . . . . A 59 ASP CA . 34868 2
564 . 1 . 1 63 63 ASP CB C 13 41.241 0.055 . 1 . . . . A 59 ASP CB . 34868 2
565 . 1 . 1 64 64 VAL H H 1 7.306 0.001 . 1 . . . . A 60 VAL H . 34868 2
566 . 1 . 1 64 64 VAL HA H 1 3.350 0.006 . 1 . . . . A 60 VAL HA . 34868 2
567 . 1 . 1 64 64 VAL HB H 1 1.920 0.012 . 1 . . . . A 60 VAL HB . 34868 2
568 . 1 . 1 64 64 VAL HG11 H 1 0.044 0.024 . 2 . . . . A 60 VAL HG11 . 34868 2
569 . 1 . 1 64 64 VAL HG12 H 1 0.044 0.024 . 2 . . . . A 60 VAL HG12 . 34868 2
570 . 1 . 1 64 64 VAL HG13 H 1 0.044 0.024 . 2 . . . . A 60 VAL HG13 . 34868 2
571 . 1 . 1 64 64 VAL HG21 H 1 0.785 0.012 . 2 . . . . A 60 VAL HG21 . 34868 2
572 . 1 . 1 64 64 VAL HG22 H 1 0.785 0.012 . 2 . . . . A 60 VAL HG22 . 34868 2
573 . 1 . 1 64 64 VAL HG23 H 1 0.785 0.012 . 2 . . . . A 60 VAL HG23 . 34868 2
574 . 1 . 1 64 64 VAL CA C 13 66.087 0.023 . 1 . . . . A 60 VAL CA . 34868 2
575 . 1 . 1 64 64 VAL CB C 13 30.932 0.067 . 1 . . . . A 60 VAL CB . 34868 2
576 . 1 . 1 64 64 VAL CG1 C 13 21.685 0.061 . 2 . . . . A 60 VAL CG1 . 34868 2
577 . 1 . 1 64 64 VAL CG2 C 13 21.641 0.055 . 2 . . . . A 60 VAL CG2 . 34868 2
578 . 1 . 1 65 65 PHE H H 1 7.377 0.003 . 1 . . . . A 61 PHE H . 34868 2
579 . 1 . 1 65 65 PHE HA H 1 4.166 0.007 . 1 . . . . A 61 PHE HA . 34868 2
580 . 1 . 1 65 65 PHE HB2 H 1 3.034 0.013 . 2 . . . . A 61 PHE HB2 . 34868 2
581 . 1 . 1 65 65 PHE HB3 H 1 3.063 0.024 . 2 . . . . A 61 PHE HB3 . 34868 2
582 . 1 . 1 65 65 PHE HD1 H 1 7.077 0.007 . 1 . . . . A 61 PHE HD1 . 34868 2
583 . 1 . 1 65 65 PHE HD2 H 1 7.077 0.007 . 1 . . . . A 61 PHE HD2 . 34868 2
584 . 1 . 1 65 65 PHE HE1 H 1 7.178 0.012 . 1 . . . . A 61 PHE HE1 . 34868 2
585 . 1 . 1 65 65 PHE HE2 H 1 7.178 0.012 . 1 . . . . A 61 PHE HE2 . 34868 2
586 . 1 . 1 65 65 PHE CA C 13 60.405 0.062 . 1 . . . . A 61 PHE CA . 34868 2
587 . 1 . 1 65 65 PHE CB C 13 38.905 0.050 . 1 . . . . A 61 PHE CB . 34868 2
588 . 1 . 1 65 65 PHE CD1 C 13 131.584 0.047 . 1 . . . . A 61 PHE CD1 . 34868 2
589 . 1 . 1 65 65 PHE CD2 C 13 131.584 0.047 . 1 . . . . A 61 PHE CD2 . 34868 2
590 . 1 . 1 65 65 PHE CE1 C 13 131.531 0.046 . 1 . . . . A 61 PHE CE1 . 34868 2
591 . 1 . 1 65 65 PHE CE2 C 13 131.531 0.046 . 1 . . . . A 61 PHE CE2 . 34868 2
592 . 1 . 1 66 66 ARG HA H 1 3.902 0.007 . 1 . . . . A 62 ARG HA . 34868 2
593 . 1 . 1 66 66 ARG HB2 H 1 1.317 0.009 . 2 . . . . A 62 ARG HB2 . 34868 2
594 . 1 . 1 66 66 ARG HB3 H 1 1.608 0.006 . 2 . . . . A 62 ARG HB3 . 34868 2
595 . 1 . 1 66 66 ARG HG2 H 1 1.198 0.006 . 2 . . . . A 62 ARG HG2 . 34868 2
596 . 1 . 1 66 66 ARG HG3 H 1 1.448 0.004 . 2 . . . . A 62 ARG HG3 . 34868 2
597 . 1 . 1 66 66 ARG HD2 H 1 3.068 0.023 . 2 . . . . A 62 ARG HD2 . 34868 2
598 . 1 . 1 66 66 ARG HD3 H 1 3.042 0.016 . 2 . . . . A 62 ARG HD3 . 34868 2
599 . 1 . 1 66 66 ARG CA C 13 58.126 0.073 . 1 . . . . A 62 ARG CA . 34868 2
600 . 1 . 1 66 66 ARG CB C 13 30.899 0.032 . 1 . . . . A 62 ARG CB . 34868 2
601 . 1 . 1 66 66 ARG CG C 13 27.861 0.018 . 1 . . . . A 62 ARG CG . 34868 2
602 . 1 . 1 66 66 ARG CD C 13 43.083 0.067 . 1 . . . . A 62 ARG CD . 34868 2
603 . 1 . 1 67 67 HIS HA H 1 4.714 0.006 . 1 . . . . A 63 HIS HA . 34868 2
604 . 1 . 1 67 67 HIS HB2 H 1 2.569 0.012 . 2 . . . . A 63 HIS HB2 . 34868 2
605 . 1 . 1 67 67 HIS HB3 H 1 3.042 0.009 . 2 . . . . A 63 HIS HB3 . 34868 2
606 . 1 . 1 67 67 HIS HD2 H 1 6.660 0.007 . 1 . . . . A 63 HIS HD2 . 34868 2
607 . 1 . 1 67 67 HIS HE1 H 1 7.815 0.015 . 1 . . . . A 63 HIS HE1 . 34868 2
608 . 1 . 1 67 67 HIS CA C 13 54.806 0.030 . 1 . . . . A 63 HIS CA . 34868 2
609 . 1 . 1 67 67 HIS CB C 13 28.240 0.054 . 1 . . . . A 63 HIS CB . 34868 2
610 . 1 . 1 67 67 HIS CD2 C 13 122.048 0.025 . 1 . . . . A 63 HIS CD2 . 34868 2
611 . 1 . 1 68 68 GLY HA2 H 1 3.731 0.004 . 2 . . . . A 64 GLY HA2 . 34868 2
612 . 1 . 1 68 68 GLY HA3 H 1 4.386 0.004 . 2 . . . . A 64 GLY HA3 . 34868 2
613 . 1 . 1 68 68 GLY CA C 13 49.334 0.035 . 1 . . . . A 64 GLY CA . 34868 2
614 . 1 . 1 69 69 THR HA H 1 3.851 0.010 . 1 . . . . A 65 THR HA . 34868 2
615 . 1 . 1 69 69 THR HB H 1 4.163 0.016 . 1 . . . . A 65 THR HB . 34868 2
616 . 1 . 1 69 69 THR HG21 H 1 0.847 0.005 . 1 . . . . A 65 THR HG21 . 34868 2
617 . 1 . 1 69 69 THR HG22 H 1 0.847 0.005 . 1 . . . . A 65 THR HG22 . 34868 2
618 . 1 . 1 69 69 THR HG23 H 1 0.847 0.005 . 1 . . . . A 65 THR HG23 . 34868 2
619 . 1 . 1 69 69 THR CA C 13 58.264 0.047 . 1 . . . . A 65 THR CA . 34868 2
620 . 1 . 1 69 69 THR CB C 13 73.257 0.021 . 1 . . . . A 65 THR CB . 34868 2
621 . 1 . 1 69 69 THR CG2 C 13 21.489 0.072 . 1 . . . . A 65 THR CG2 . 34868 2
622 . 1 . 1 70 70 VAL HA H 1 3.605 0.011 . 1 . . . . A 66 VAL HA . 34868 2
623 . 1 . 1 70 70 VAL HB H 1 2.303 0.008 . 1 . . . . A 66 VAL HB . 34868 2
624 . 1 . 1 70 70 VAL HG11 H 1 1.332 0.014 . 2 . . . . A 66 VAL HG11 . 34868 2
625 . 1 . 1 70 70 VAL HG12 H 1 1.332 0.014 . 2 . . . . A 66 VAL HG12 . 34868 2
626 . 1 . 1 70 70 VAL HG13 H 1 1.332 0.014 . 2 . . . . A 66 VAL HG13 . 34868 2
627 . 1 . 1 70 70 VAL HG21 H 1 1.128 0.006 . 2 . . . . A 66 VAL HG21 . 34868 2
628 . 1 . 1 70 70 VAL HG22 H 1 1.128 0.006 . 2 . . . . A 66 VAL HG22 . 34868 2
629 . 1 . 1 70 70 VAL HG23 H 1 1.128 0.006 . 2 . . . . A 66 VAL HG23 . 34868 2
630 . 1 . 1 70 70 VAL CA C 13 67.486 0.068 . 1 . . . . A 66 VAL CA . 34868 2
631 . 1 . 1 70 70 VAL CB C 13 30.655 0.094 . 1 . . . . A 66 VAL CB . 34868 2
632 . 1 . 1 70 70 VAL CG1 C 13 23.576 0.025 . 2 . . . . A 66 VAL CG1 . 34868 2
633 . 1 . 1 70 70 VAL CG2 C 13 22.826 0.049 . 2 . . . . A 66 VAL CG2 . 34868 2
634 . 1 . 1 71 71 GLU HA H 1 3.955 0.015 . 1 . . . . A 67 GLU HA . 34868 2
635 . 1 . 1 71 71 GLU HB2 H 1 2.000 0.017 . 2 . . . . A 67 GLU HB2 . 34868 2
636 . 1 . 1 71 71 GLU HB3 H 1 1.925 0.012 . 2 . . . . A 67 GLU HB3 . 34868 2
637 . 1 . 1 71 71 GLU HG2 H 1 2.355 0.012 . 2 . . . . A 67 GLU HG2 . 34868 2
638 . 1 . 1 71 71 GLU HG3 H 1 2.099 0.011 . 2 . . . . A 67 GLU HG3 . 34868 2
639 . 1 . 1 71 71 GLU CA C 13 59.894 0.061 . 1 . . . . A 67 GLU CA . 34868 2
640 . 1 . 1 71 71 GLU CB C 13 30.179 0.000 . 1 . . . . A 67 GLU CB . 34868 2
641 . 1 . 1 71 71 GLU CG C 13 36.107 0.066 . 1 . . . . A 67 GLU CG . 34868 2
642 . 1 . 1 72 72 GLN HA H 1 4.093 0.003 . 1 . . . . A 68 GLN HA . 34868 2
643 . 1 . 1 72 72 GLN HB2 H 1 1.955 0.012 . 2 . . . . A 68 GLN HB2 . 34868 2
644 . 1 . 1 72 72 GLN HB3 H 1 2.332 0.000 . 2 . . . . A 68 GLN HB3 . 34868 2
645 . 1 . 1 72 72 GLN HG2 H 1 2.482 0.004 . 1 . . . . A 68 GLN HG2 . 34868 2
646 . 1 . 1 72 72 GLN HG3 H 1 2.482 0.004 . 1 . . . . A 68 GLN HG3 . 34868 2
647 . 1 . 1 72 72 GLN CA C 13 58.828 0.132 . 1 . . . . A 68 GLN CA . 34868 2
648 . 1 . 1 72 72 GLN CB C 13 29.530 0.000 . 1 . . . . A 68 GLN CB . 34868 2
649 . 1 . 1 72 72 GLN CG C 13 34.769 0.105 . 1 . . . . A 68 GLN CG . 34868 2
650 . 1 . 1 73 73 LEU HA H 1 4.240 0.009 . 1 . . . . A 69 LEU HA . 34868 2
651 . 1 . 1 73 73 LEU HB2 H 1 1.989 0.014 . 2 . . . . A 69 LEU HB2 . 34868 2
652 . 1 . 1 73 73 LEU HB3 H 1 2.377 0.008 . 2 . . . . A 69 LEU HB3 . 34868 2
653 . 1 . 1 73 73 LEU HG H 1 1.721 0.012 . 1 . . . . A 69 LEU HG . 34868 2
654 . 1 . 1 73 73 LEU HD11 H 1 0.898 0.003 . 2 . . . . A 69 LEU HD11 . 34868 2
655 . 1 . 1 73 73 LEU HD12 H 1 0.898 0.003 . 2 . . . . A 69 LEU HD12 . 34868 2
656 . 1 . 1 73 73 LEU HD13 H 1 0.898 0.003 . 2 . . . . A 69 LEU HD13 . 34868 2
657 . 1 . 1 73 73 LEU HD21 H 1 0.981 0.007 . 2 . . . . A 69 LEU HD21 . 34868 2
658 . 1 . 1 73 73 LEU HD22 H 1 0.981 0.007 . 2 . . . . A 69 LEU HD22 . 34868 2
659 . 1 . 1 73 73 LEU HD23 H 1 0.981 0.007 . 2 . . . . A 69 LEU HD23 . 34868 2
660 . 1 . 1 73 73 LEU CA C 13 57.801 0.037 . 1 . . . . A 69 LEU CA . 34868 2
661 . 1 . 1 73 73 LEU CB C 13 41.576 0.044 . 1 . . . . A 69 LEU CB . 34868 2
662 . 1 . 1 73 73 LEU CG C 13 27.211 0.025 . 1 . . . . A 69 LEU CG . 34868 2
663 . 1 . 1 73 73 LEU CD1 C 13 28.176 0.026 . 2 . . . . A 69 LEU CD1 . 34868 2
664 . 1 . 1 73 73 LEU CD2 C 13 23.025 0.085 . 2 . . . . A 69 LEU CD2 . 34868 2
665 . 1 . 1 74 74 ALA HA H 1 3.799 0.006 . 1 . . . . A 70 ALA HA . 34868 2
666 . 1 . 1 74 74 ALA HB1 H 1 1.419 0.009 . 1 . . . . A 70 ALA HB1 . 34868 2
667 . 1 . 1 74 74 ALA HB2 H 1 1.419 0.009 . 1 . . . . A 70 ALA HB2 . 34868 2
668 . 1 . 1 74 74 ALA HB3 H 1 1.419 0.009 . 1 . . . . A 70 ALA HB3 . 34868 2
669 . 1 . 1 74 74 ALA CA C 13 55.581 0.042 . 1 . . . . A 70 ALA CA . 34868 2
670 . 1 . 1 74 74 ALA CB C 13 18.360 0.077 . 1 . . . . A 70 ALA CB . 34868 2
671 . 1 . 1 75 75 ARG H H 1 7.285 0.031 . 1 . . . . A 71 ARG H . 34868 2
672 . 1 . 1 75 75 ARG HA H 1 4.094 0.006 . 1 . . . . A 71 ARG HA . 34868 2
673 . 1 . 1 75 75 ARG HB2 H 1 1.956 0.010 . 2 . . . . A 71 ARG HB2 . 34868 2
674 . 1 . 1 75 75 ARG HB3 H 1 1.961 0.010 . 2 . . . . A 71 ARG HB3 . 34868 2
675 . 1 . 1 75 75 ARG HG2 H 1 1.765 0.018 . 2 . . . . A 71 ARG HG2 . 34868 2
676 . 1 . 1 75 75 ARG HG3 H 1 1.720 0.022 . 2 . . . . A 71 ARG HG3 . 34868 2
677 . 1 . 1 75 75 ARG HD2 H 1 3.259 0.006 . 1 . . . . A 71 ARG HD2 . 34868 2
678 . 1 . 1 75 75 ARG HD3 H 1 3.259 0.006 . 1 . . . . A 71 ARG HD3 . 34868 2
679 . 1 . 1 75 75 ARG CA C 13 59.082 0.043 . 1 . . . . A 71 ARG CA . 34868 2
680 . 1 . 1 75 75 ARG CB C 13 29.779 0.072 . 1 . . . . A 71 ARG CB . 34868 2
681 . 1 . 1 75 75 ARG CG C 13 27.154 0.042 . 1 . . . . A 71 ARG CG . 34868 2
682 . 1 . 1 75 75 ARG CD C 13 43.360 0.020 . 1 . . . . A 71 ARG CD . 34868 2
683 . 1 . 1 76 76 PHE HA H 1 4.146 0.012 . 1 . . . . A 72 PHE HA . 34868 2
684 . 1 . 1 76 76 PHE HB2 H 1 2.327 0.006 . 2 . . . . A 72 PHE HB2 . 34868 2
685 . 1 . 1 76 76 PHE HB3 H 1 3.070 0.008 . 2 . . . . A 72 PHE HB3 . 34868 2
686 . 1 . 1 76 76 PHE HD1 H 1 6.916 0.008 . 1 . . . . A 72 PHE HD1 . 34868 2
687 . 1 . 1 76 76 PHE HD2 H 1 6.916 0.008 . 1 . . . . A 72 PHE HD2 . 34868 2
688 . 1 . 1 76 76 PHE HE1 H 1 7.307 0.002 . 1 . . . . A 72 PHE HE1 . 34868 2
689 . 1 . 1 76 76 PHE HE2 H 1 7.307 0.002 . 1 . . . . A 72 PHE HE2 . 34868 2
690 . 1 . 1 76 76 PHE HZ H 1 7.366 0.017 . 1 . . . . A 72 PHE HZ . 34868 2
691 . 1 . 1 76 76 PHE CA C 13 60.758 0.031 . 1 . . . . A 72 PHE CA . 34868 2
692 . 1 . 1 76 76 PHE CB C 13 37.935 0.046 . 1 . . . . A 72 PHE CB . 34868 2
693 . 1 . 1 76 76 PHE CD1 C 13 131.471 0.024 . 1 . . . . A 72 PHE CD1 . 34868 2
694 . 1 . 1 76 76 PHE CD2 C 13 131.471 0.024 . 1 . . . . A 72 PHE CD2 . 34868 2
695 . 1 . 1 76 76 PHE CE1 C 13 131.277 0.004 . 1 . . . . A 72 PHE CE1 . 34868 2
696 . 1 . 1 76 76 PHE CE2 C 13 131.277 0.004 . 1 . . . . A 72 PHE CE2 . 34868 2
697 . 1 . 1 76 76 PHE CZ C 13 131.459 0.106 . 1 . . . . A 72 PHE CZ . 34868 2
698 . 1 . 1 77 77 VAL HA H 1 2.923 0.003 . 1 . . . . A 73 VAL HA . 34868 2
699 . 1 . 1 77 77 VAL HB H 1 1.851 0.009 . 1 . . . . A 73 VAL HB . 34868 2
700 . 1 . 1 77 77 VAL HG11 H 1 0.785 0.007 . 2 . . . . A 73 VAL HG11 . 34868 2
701 . 1 . 1 77 77 VAL HG12 H 1 0.785 0.007 . 2 . . . . A 73 VAL HG12 . 34868 2
702 . 1 . 1 77 77 VAL HG13 H 1 0.785 0.007 . 2 . . . . A 73 VAL HG13 . 34868 2
703 . 1 . 1 77 77 VAL HG21 H 1 0.074 0.003 . 2 . . . . A 73 VAL HG21 . 34868 2
704 . 1 . 1 77 77 VAL HG22 H 1 0.074 0.003 . 2 . . . . A 73 VAL HG22 . 34868 2
705 . 1 . 1 77 77 VAL HG23 H 1 0.074 0.003 . 2 . . . . A 73 VAL HG23 . 34868 2
706 . 1 . 1 77 77 VAL CA C 13 67.160 0.011 . 1 . . . . A 73 VAL CA . 34868 2
707 . 1 . 1 77 77 VAL CB C 13 30.788 0.016 . 1 . . . . A 73 VAL CB . 34868 2
708 . 1 . 1 77 77 VAL CG1 C 13 21.760 0.040 . 2 . . . . A 73 VAL CG1 . 34868 2
709 . 1 . 1 77 77 VAL CG2 C 13 20.205 0.018 . 2 . . . . A 73 VAL CG2 . 34868 2
710 . 1 . 1 78 78 GLU HA H 1 3.645 0.007 . 1 . . . . A 74 GLU HA . 34868 2
711 . 1 . 1 78 78 GLU HB2 H 1 2.071 0.009 . 2 . . . . A 74 GLU HB2 . 34868 2
712 . 1 . 1 78 78 GLU HB3 H 1 2.069 0.008 . 2 . . . . A 74 GLU HB3 . 34868 2
713 . 1 . 1 78 78 GLU HG2 H 1 2.214 0.009 . 2 . . . . A 74 GLU HG2 . 34868 2
714 . 1 . 1 78 78 GLU HG3 H 1 2.126 0.009 . 2 . . . . A 74 GLU HG3 . 34868 2
715 . 1 . 1 78 78 GLU CA C 13 59.861 0.072 . 1 . . . . A 74 GLU CA . 34868 2
716 . 1 . 1 78 78 GLU CB C 13 29.902 0.040 . 1 . . . . A 74 GLU CB . 34868 2
717 . 1 . 1 78 78 GLU CG C 13 36.445 0.072 . 1 . . . . A 74 GLU CG . 34868 2
718 . 1 . 1 79 79 GLN HA H 1 4.078 0.006 . 1 . . . . A 75 GLN HA . 34868 2
719 . 1 . 1 79 79 GLN HB2 H 1 2.081 0.023 . 2 . . . . A 75 GLN HB2 . 34868 2
720 . 1 . 1 79 79 GLN HB3 H 1 2.065 0.022 . 2 . . . . A 75 GLN HB3 . 34868 2
721 . 1 . 1 79 79 GLN HG2 H 1 2.521 0.003 . 2 . . . . A 75 GLN HG2 . 34868 2
722 . 1 . 1 79 79 GLN HG3 H 1 2.388 0.006 . 2 . . . . A 75 GLN HG3 . 34868 2
723 . 1 . 1 79 79 GLN CA C 13 58.140 0.068 . 1 . . . . A 75 GLN CA . 34868 2
724 . 1 . 1 79 79 GLN CB C 13 28.324 0.014 . 1 . . . . A 75 GLN CB . 34868 2
725 . 1 . 1 79 79 GLN CG C 13 34.161 0.067 . 1 . . . . A 75 GLN CG . 34868 2
726 . 1 . 1 80 80 SER HA H 1 4.105 0.007 . 1 . . . . A 76 SER HA . 34868 2
727 . 1 . 1 80 80 SER HB2 H 1 3.565 0.018 . 2 . . . . A 76 SER HB2 . 34868 2
728 . 1 . 1 80 80 SER HB3 H 1 3.613 0.030 . 2 . . . . A 76 SER HB3 . 34868 2
729 . 1 . 1 80 80 SER CA C 13 60.816 0.031 . 1 . . . . A 76 SER CA . 34868 2
730 . 1 . 1 80 80 SER CB C 13 62.996 0.018 . 1 . . . . A 76 SER CB . 34868 2
731 . 1 . 1 81 81 ARG HA H 1 4.124 0.019 . 1 . . . . A 77 ARG HA . 34868 2
732 . 1 . 1 81 81 ARG HB2 H 1 1.880 0.002 . 2 . . . . A 77 ARG HB2 . 34868 2
733 . 1 . 1 81 81 ARG HB3 H 1 1.866 0.020 . 2 . . . . A 77 ARG HB3 . 34868 2
734 . 1 . 1 81 81 ARG HG2 H 1 1.757 0.001 . 2 . . . . A 77 ARG HG2 . 34868 2
735 . 1 . 1 81 81 ARG HG3 H 1 1.678 0.003 . 2 . . . . A 77 ARG HG3 . 34868 2
736 . 1 . 1 81 81 ARG HD2 H 1 3.182 0.012 . 2 . . . . A 77 ARG HD2 . 34868 2
737 . 1 . 1 81 81 ARG HD3 H 1 3.080 0.002 . 2 . . . . A 77 ARG HD3 . 34868 2
738 . 1 . 1 81 81 ARG CA C 13 57.551 0.042 . 1 . . . . A 77 ARG CA . 34868 2
739 . 1 . 1 81 81 ARG CB C 13 30.645 0.031 . 1 . . . . A 77 ARG CB . 34868 2
740 . 1 . 1 81 81 ARG CG C 13 26.720 0.041 . 1 . . . . A 77 ARG CG . 34868 2
741 . 1 . 1 81 81 ARG CD C 13 44.141 0.028 . 1 . . . . A 77 ARG CD . 34868 2
742 . 1 . 1 82 82 ASP HA H 1 4.666 0.014 . 1 . . . . A 78 ASP HA . 34868 2
743 . 1 . 1 82 82 ASP HB2 H 1 2.718 0.033 . 2 . . . . A 78 ASP HB2 . 34868 2
744 . 1 . 1 82 82 ASP HB3 H 1 2.814 0.011 . 2 . . . . A 78 ASP HB3 . 34868 2
745 . 1 . 1 82 82 ASP CA C 13 55.140 0.086 . 1 . . . . A 78 ASP CA . 34868 2
746 . 1 . 1 82 82 ASP CB C 13 41.049 0.059 . 1 . . . . A 78 ASP CB . 34868 2
747 . 1 . 1 83 83 THR HA H 1 4.296 0.004 . 1 . . . . A 79 THR HA . 34868 2
748 . 1 . 1 83 83 THR HB H 1 4.350 0.005 . 1 . . . . A 79 THR HB . 34868 2
749 . 1 . 1 83 83 THR HG21 H 1 1.281 0.005 . 1 . . . . A 79 THR HG21 . 34868 2
750 . 1 . 1 83 83 THR HG22 H 1 1.281 0.005 . 1 . . . . A 79 THR HG22 . 34868 2
751 . 1 . 1 83 83 THR HG23 H 1 1.281 0.005 . 1 . . . . A 79 THR HG23 . 34868 2
752 . 1 . 1 83 83 THR CA C 13 62.886 0.020 . 1 . . . . A 79 THR CA . 34868 2
753 . 1 . 1 83 83 THR CB C 13 69.563 0.017 . 1 . . . . A 79 THR CB . 34868 2
754 . 1 . 1 83 83 THR CG2 C 13 21.600 0.079 . 1 . . . . A 79 THR CG2 . 34868 2
755 . 1 . 1 84 84 GLY HA2 H 1 3.991 0.000 . 1 . . . . A 80 GLY HA2 . 34868 2
756 . 1 . 1 84 84 GLY HA3 H 1 3.991 0.000 . 1 . . . . A 80 GLY HA3 . 34868 2
757 . 1 . 1 84 84 GLY CA C 13 45.555 0.004 . 1 . . . . A 80 GLY CA . 34868 2
758 . 1 . 1 85 85 ARG HA H 1 4.352 0.005 . 1 . . . . A 81 ARG HA . 34868 2
759 . 1 . 1 85 85 ARG HB2 H 1 1.825 0.025 . 2 . . . . A 81 ARG HB2 . 34868 2
760 . 1 . 1 85 85 ARG HB3 H 1 1.865 0.017 . 2 . . . . A 81 ARG HB3 . 34868 2
761 . 1 . 1 85 85 ARG HG2 H 1 1.641 0.018 . 1 . . . . A 81 ARG HG2 . 34868 2
762 . 1 . 1 85 85 ARG HG3 H 1 1.641 0.018 . 1 . . . . A 81 ARG HG3 . 34868 2
763 . 1 . 1 85 85 ARG HD2 H 1 3.219 0.013 . 2 . . . . A 81 ARG HD2 . 34868 2
764 . 1 . 1 85 85 ARG HD3 H 1 3.222 0.013 . 2 . . . . A 81 ARG HD3 . 34868 2
765 . 1 . 1 85 85 ARG CA C 13 55.966 0.037 . 1 . . . . A 81 ARG CA . 34868 2
766 . 1 . 1 85 85 ARG CB C 13 30.815 0.023 . 1 . . . . A 81 ARG CB . 34868 2
767 . 1 . 1 85 85 ARG CG C 13 27.173 0.176 . 1 . . . . A 81 ARG CG . 34868 2
768 . 1 . 1 85 85 ARG CD C 13 43.266 0.098 . 1 . . . . A 81 ARG CD . 34868 2
769 . 1 . 1 86 86 ASN HA H 1 5.000 0.009 . 1 . . . . A 82 ASN HA . 34868 2
770 . 1 . 1 86 86 ASN HB2 H 1 2.875 0.006 . 2 . . . . A 82 ASN HB2 . 34868 2
771 . 1 . 1 86 86 ASN HB3 H 1 2.760 0.001 . 2 . . . . A 82 ASN HB3 . 34868 2
772 . 1 . 1 86 86 ASN CA C 13 51.175 0.048 . 1 . . . . A 82 ASN CA . 34868 2
773 . 1 . 1 86 86 ASN CB C 13 38.868 0.030 . 1 . . . . A 82 ASN CB . 34868 2
774 . 1 . 1 87 87 PRO HA H 1 4.432 0.007 . 1 . . . . A 83 PRO HA . 34868 2
775 . 1 . 1 87 87 PRO HB2 H 1 1.996 0.002 . 2 . . . . A 83 PRO HB2 . 34868 2
776 . 1 . 1 87 87 PRO HB3 H 1 2.322 0.014 . 2 . . . . A 83 PRO HB3 . 34868 2
777 . 1 . 1 87 87 PRO HG2 H 1 2.045 0.007 . 2 . . . . A 83 PRO HG2 . 34868 2
778 . 1 . 1 87 87 PRO HG3 H 1 2.039 0.016 . 2 . . . . A 83 PRO HG3 . 34868 2
779 . 1 . 1 87 87 PRO HD2 H 1 3.807 0.024 . 2 . . . . A 83 PRO HD2 . 34868 2
780 . 1 . 1 87 87 PRO HD3 H 1 3.788 0.012 . 2 . . . . A 83 PRO HD3 . 34868 2
781 . 1 . 1 87 87 PRO CA C 13 63.706 0.030 . 1 . . . . A 83 PRO CA . 34868 2
782 . 1 . 1 87 87 PRO CB C 13 32.076 0.054 . 1 . . . . A 83 PRO CB . 34868 2
783 . 1 . 1 87 87 PRO CG C 13 27.258 0.054 . 1 . . . . A 83 PRO CG . 34868 2
784 . 1 . 1 87 87 PRO CD C 13 50.810 0.019 . 1 . . . . A 83 PRO CD . 34868 2
785 . 1 . 1 88 88 ALA HA H 1 4.323 0.000 . 1 . . . . A 84 ALA HA . 34868 2
786 . 1 . 1 88 88 ALA HB1 H 1 1.401 0.000 . 1 . . . . A 84 ALA HB1 . 34868 2
787 . 1 . 1 88 88 ALA HB2 H 1 1.401 0.000 . 1 . . . . A 84 ALA HB2 . 34868 2
788 . 1 . 1 88 88 ALA HB3 H 1 1.401 0.000 . 1 . . . . A 84 ALA HB3 . 34868 2
789 . 1 . 1 88 88 ALA CA C 13 52.377 0.000 . 1 . . . . A 84 ALA CA . 34868 2
790 . 1 . 1 88 88 ALA CB C 13 19.014 0.000 . 1 . . . . A 84 ALA CB . 34868 2
791 . 1 . 1 89 89 ALA HA H 1 4.382 0.000 . 1 . . . . A 85 ALA HA . 34868 2
792 . 1 . 1 89 89 ALA HB1 H 1 1.429 0.004 . 1 . . . . A 85 ALA HB1 . 34868 2
793 . 1 . 1 89 89 ALA HB2 H 1 1.429 0.004 . 1 . . . . A 85 ALA HB2 . 34868 2
794 . 1 . 1 89 89 ALA HB3 H 1 1.429 0.004 . 1 . . . . A 85 ALA HB3 . 34868 2
795 . 1 . 1 89 89 ALA CA C 13 52.349 0.000 . 1 . . . . A 85 ALA CA . 34868 2
796 . 1 . 1 89 89 ALA CB C 13 19.217 0.000 . 1 . . . . A 85 ALA CB . 34868 2
797 . 1 . 1 90 90 GLN HA H 1 4.447 0.010 . 1 . . . . A 86 GLN HA . 34868 2
798 . 1 . 1 90 90 GLN HB3 H 1 2.185 0.010 . 1 . . . . A 86 GLN HB3 . 34868 2
799 . 1 . 1 90 90 GLN HG2 H 1 2.410 0.002 . 2 . . . . A 86 GLN HG2 . 34868 2
800 . 1 . 1 90 90 GLN HG3 H 1 2.409 0.000 . 2 . . . . A 86 GLN HG3 . 34868 2
801 . 1 . 1 90 90 GLN CA C 13 55.690 0.078 . 1 . . . . A 86 GLN CA . 34868 2
802 . 1 . 1 90 90 GLN CB C 13 29.440 0.042 . 1 . . . . A 86 GLN CB . 34868 2
803 . 1 . 1 91 91 THR HA H 1 4.378 0.006 . 1 . . . . A 87 THR HA . 34868 2
804 . 1 . 1 91 91 THR HB H 1 4.272 0.005 . 1 . . . . A 87 THR HB . 34868 2
805 . 1 . 1 91 91 THR HG21 H 1 1.218 0.000 . 1 . . . . A 87 THR HG21 . 34868 2
806 . 1 . 1 91 91 THR HG22 H 1 1.218 0.000 . 1 . . . . A 87 THR HG22 . 34868 2
807 . 1 . 1 91 91 THR HG23 H 1 1.218 0.000 . 1 . . . . A 87 THR HG23 . 34868 2
808 . 1 . 1 91 91 THR CA C 13 61.767 0.015 . 1 . . . . A 87 THR CA . 34868 2
809 . 1 . 1 91 91 THR CB C 13 69.874 0.024 . 1 . . . . A 87 THR CB . 34868 2
810 . 1 . 1 91 91 THR CG2 C 13 21.441 0.000 . 1 . . . . A 87 THR CG2 . 34868 2
811 . 1 . 1 92 92 GLN HA H 1 4.211 0.001 . 1 . . . . A 88 GLN HA . 34868 2
812 . 1 . 1 92 92 GLN HB2 H 1 2.149 0.003 . 2 . . . . A 88 GLN HB2 . 34868 2
813 . 1 . 1 92 92 GLN HB3 H 1 1.949 0.000 . 2 . . . . A 88 GLN HB3 . 34868 2
814 . 1 . 1 92 92 GLN HG2 H 1 2.322 0.001 . 2 . . . . A 88 GLN HG2 . 34868 2
815 . 1 . 1 92 92 GLN HG3 H 1 2.321 0.000 . 2 . . . . A 88 GLN HG3 . 34868 2
816 . 1 . 1 92 92 GLN CA C 13 57.407 0.000 . 1 . . . . A 88 GLN CA . 34868 2
817 . 1 . 1 92 92 GLN CB C 13 30.335 0.085 . 1 . . . . A 88 GLN CB . 34868 2
818 . 1 . 1 92 92 GLN CG C 13 34.201 0.000 . 1 . . . . A 88 GLN CG . 34868 2
stop_
save_