###################################
# 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 30310
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 3D_15N-separated_NOESY . . . 30310 1
2 3D_13C-separated_NOESY . . . 30310 1
3 '3D HNCO' . . . 30310 1
4 '3D HNCACB' . . . 30310 1
5 '3D CBCA(CO)NH' . . . 30310 1
6 '3D HCCH-TOCSY' . . . 30310 1
7 '2D 1H-13C HSQC aliphatic' . . . 30310 1
8 '2D 1H-15N HSQC' . . . 30310 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 MET HA H 1 3.833 0.026 . 1 . . . . A 1 MET HA . 30310 1
2 . 1 1 1 1 MET HB2 H 1 1.738 0.000 . 2 . . . . A 1 MET HB2 . 30310 1
3 . 1 1 1 1 MET HB3 H 1 1.738 0.000 . 2 . . . . A 1 MET HB3 . 30310 1
4 . 1 1 1 1 MET HE1 H 1 1.828 0.004 . 1 . . . . A 1 MET HE1 . 30310 1
5 . 1 1 1 1 MET HE2 H 1 1.828 0.004 . 1 . . . . A 1 MET HE2 . 30310 1
6 . 1 1 1 1 MET HE3 H 1 1.828 0.004 . 1 . . . . A 1 MET HE3 . 30310 1
7 . 1 1 1 1 MET C C 13 173.676 0.000 . 1 . . . . A 1 MET C . 30310 1
8 . 1 1 1 1 MET CA C 13 55.252 0.060 . 1 . . . . A 1 MET CA . 30310 1
9 . 1 1 1 1 MET CB C 13 33.415 0.014 . 1 . . . . A 1 MET CB . 30310 1
10 . 1 1 1 1 MET CE C 13 17.276 0.049 . 1 . . . . A 1 MET CE . 30310 1
11 . 1 1 2 2 LYS H H 1 8.392 0.006 . 1 . . . . A 2 LYS H . 30310 1
12 . 1 1 2 2 LYS HA H 1 4.562 0.010 . 1 . . . . A 2 LYS HA . 30310 1
13 . 1 1 2 2 LYS HB2 H 1 1.730 0.012 . 2 . . . . A 2 LYS HB2 . 30310 1
14 . 1 1 2 2 LYS HB3 H 1 1.643 0.009 . 2 . . . . A 2 LYS HB3 . 30310 1
15 . 1 1 2 2 LYS HG2 H 1 1.367 0.018 . 2 . . . . A 2 LYS HG2 . 30310 1
16 . 1 1 2 2 LYS HG3 H 1 1.367 0.018 . 2 . . . . A 2 LYS HG3 . 30310 1
17 . 1 1 2 2 LYS HD2 H 1 1.655 0.000 . 2 . . . . A 2 LYS HD2 . 30310 1
18 . 1 1 2 2 LYS HD3 H 1 1.655 0.000 . 2 . . . . A 2 LYS HD3 . 30310 1
19 . 1 1 2 2 LYS HE2 H 1 2.930 0.002 . 2 . . . . A 2 LYS HE2 . 30310 1
20 . 1 1 2 2 LYS HE3 H 1 2.930 0.002 . 2 . . . . A 2 LYS HE3 . 30310 1
21 . 1 1 2 2 LYS C C 13 173.779 0.000 . 1 . . . . A 2 LYS C . 30310 1
22 . 1 1 2 2 LYS CA C 13 55.014 0.062 . 1 . . . . A 2 LYS CA . 30310 1
23 . 1 1 2 2 LYS CB C 13 35.701 0.073 . 1 . . . . A 2 LYS CB . 30310 1
24 . 1 1 2 2 LYS CG C 13 24.765 0.048 . 1 . . . . A 2 LYS CG . 30310 1
25 . 1 1 2 2 LYS CE C 13 41.928 0.000 . 1 . . . . A 2 LYS CE . 30310 1
26 . 1 1 2 2 LYS N N 15 125.405 0.030 . 1 . . . . A 2 LYS N . 30310 1
27 . 1 1 3 3 LYS H H 1 8.492 0.003 . 1 . . . . A 3 LYS H . 30310 1
28 . 1 1 3 3 LYS HA H 1 5.120 0.012 . 1 . . . . A 3 LYS HA . 30310 1
29 . 1 1 3 3 LYS HB2 H 1 1.590 0.002 . 2 . . . . A 3 LYS HB2 . 30310 1
30 . 1 1 3 3 LYS HB3 H 1 1.542 0.003 . 2 . . . . A 3 LYS HB3 . 30310 1
31 . 1 1 3 3 LYS HG2 H 1 1.340 0.011 . 2 . . . . A 3 LYS HG2 . 30310 1
32 . 1 1 3 3 LYS HG3 H 1 1.143 0.010 . 2 . . . . A 3 LYS HG3 . 30310 1
33 . 1 1 3 3 LYS HD2 H 1 1.627 0.007 . 2 . . . . A 3 LYS HD2 . 30310 1
34 . 1 1 3 3 LYS HD3 H 1 1.627 0.007 . 2 . . . . A 3 LYS HD3 . 30310 1
35 . 1 1 3 3 LYS HE2 H 1 2.892 0.007 . 2 . . . . A 3 LYS HE2 . 30310 1
36 . 1 1 3 3 LYS HE3 H 1 2.892 0.007 . 2 . . . . A 3 LYS HE3 . 30310 1
37 . 1 1 3 3 LYS C C 13 176.170 0.000 . 1 . . . . A 3 LYS C . 30310 1
38 . 1 1 3 3 LYS CA C 13 55.255 0.054 . 1 . . . . A 3 LYS CA . 30310 1
39 . 1 1 3 3 LYS CB C 13 34.033 0.082 . 1 . . . . A 3 LYS CB . 30310 1
40 . 1 1 3 3 LYS CG C 13 25.965 0.022 . 1 . . . . A 3 LYS CG . 30310 1
41 . 1 1 3 3 LYS CD C 13 29.590 0.018 . 1 . . . . A 3 LYS CD . 30310 1
42 . 1 1 3 3 LYS CE C 13 41.847 0.025 . 1 . . . . A 3 LYS CE . 30310 1
43 . 1 1 3 3 LYS N N 15 124.250 0.024 . 1 . . . . A 3 LYS N . 30310 1
44 . 1 1 4 4 ILE H H 1 9.228 0.004 . 1 . . . . A 4 ILE H . 30310 1
45 . 1 1 4 4 ILE HA H 1 4.863 0.014 . 1 . . . . A 4 ILE HA . 30310 1
46 . 1 1 4 4 ILE HB H 1 1.819 0.006 . 1 . . . . A 4 ILE HB . 30310 1
47 . 1 1 4 4 ILE HG12 H 1 1.424 0.003 . 2 . . . . A 4 ILE HG12 . 30310 1
48 . 1 1 4 4 ILE HG13 H 1 1.070 0.012 . 2 . . . . A 4 ILE HG13 . 30310 1
49 . 1 1 4 4 ILE HG21 H 1 0.967 0.005 . 1 . . . . A 4 ILE HG21 . 30310 1
50 . 1 1 4 4 ILE HG22 H 1 0.967 0.005 . 1 . . . . A 4 ILE HG22 . 30310 1
51 . 1 1 4 4 ILE HG23 H 1 0.967 0.005 . 1 . . . . A 4 ILE HG23 . 30310 1
52 . 1 1 4 4 ILE HD11 H 1 0.650 0.012 . 1 . . . . A 4 ILE HD11 . 30310 1
53 . 1 1 4 4 ILE HD12 H 1 0.650 0.012 . 1 . . . . A 4 ILE HD12 . 30310 1
54 . 1 1 4 4 ILE HD13 H 1 0.650 0.012 . 1 . . . . A 4 ILE HD13 . 30310 1
55 . 1 1 4 4 ILE CA C 13 57.302 0.016 . 1 . . . . A 4 ILE CA . 30310 1
56 . 1 1 4 4 ILE CB C 13 41.442 0.053 . 1 . . . . A 4 ILE CB . 30310 1
57 . 1 1 4 4 ILE CG1 C 13 26.288 0.059 . 1 . . . . A 4 ILE CG1 . 30310 1
58 . 1 1 4 4 ILE CG2 C 13 17.614 0.055 . 1 . . . . A 4 ILE CG2 . 30310 1
59 . 1 1 4 4 ILE CD1 C 13 14.126 0.053 . 1 . . . . A 4 ILE CD1 . 30310 1
60 . 1 1 4 4 ILE N N 15 123.950 0.025 . 1 . . . . A 4 ILE N . 30310 1
61 . 1 1 5 5 PRO HA H 1 5.066 0.006 . 1 . . . . A 5 PRO HA . 30310 1
62 . 1 1 5 5 PRO HB2 H 1 1.922 0.010 . 2 . . . . A 5 PRO HB2 . 30310 1
63 . 1 1 5 5 PRO HB3 H 1 2.583 0.008 . 2 . . . . A 5 PRO HB3 . 30310 1
64 . 1 1 5 5 PRO HG2 H 1 2.129 0.004 . 2 . . . . A 5 PRO HG2 . 30310 1
65 . 1 1 5 5 PRO HG3 H 1 2.129 0.004 . 2 . . . . A 5 PRO HG3 . 30310 1
66 . 1 1 5 5 PRO HD2 H 1 3.624 0.006 . 2 . . . . A 5 PRO HD2 . 30310 1
67 . 1 1 5 5 PRO HD3 H 1 3.967 0.005 . 2 . . . . A 5 PRO HD3 . 30310 1
68 . 1 1 5 5 PRO C C 13 178.050 0.000 . 1 . . . . A 5 PRO C . 30310 1
69 . 1 1 5 5 PRO CA C 13 63.111 0.058 . 1 . . . . A 5 PRO CA . 30310 1
70 . 1 1 5 5 PRO CB C 13 32.874 0.081 . 1 . . . . A 5 PRO CB . 30310 1
71 . 1 1 5 5 PRO CG C 13 28.162 0.000 . 1 . . . . A 5 PRO CG . 30310 1
72 . 1 1 5 5 PRO CD C 13 51.166 0.016 . 1 . . . . A 5 PRO CD . 30310 1
73 . 1 1 6 6 LEU H H 1 8.942 0.005 . 1 . . . . A 6 LEU H . 30310 1
74 . 1 1 6 6 LEU HA H 1 4.009 0.009 . 1 . . . . A 6 LEU HA . 30310 1
75 . 1 1 6 6 LEU HB2 H 1 2.048 0.010 . 2 . . . . A 6 LEU HB2 . 30310 1
76 . 1 1 6 6 LEU HB3 H 1 1.497 0.007 . 2 . . . . A 6 LEU HB3 . 30310 1
77 . 1 1 6 6 LEU HG H 1 1.567 0.000 . 1 . . . . A 6 LEU HG . 30310 1
78 . 1 1 6 6 LEU HD11 H 1 0.804 0.005 . 1 . . . . A 6 LEU HD11 . 30310 1
79 . 1 1 6 6 LEU HD12 H 1 0.804 0.005 . 1 . . . . A 6 LEU HD12 . 30310 1
80 . 1 1 6 6 LEU HD13 H 1 0.804 0.005 . 1 . . . . A 6 LEU HD13 . 30310 1
81 . 1 1 6 6 LEU HD21 H 1 0.854 0.009 . 1 . . . . A 6 LEU HD21 . 30310 1
82 . 1 1 6 6 LEU HD22 H 1 0.854 0.009 . 1 . . . . A 6 LEU HD22 . 30310 1
83 . 1 1 6 6 LEU HD23 H 1 0.854 0.009 . 1 . . . . A 6 LEU HD23 . 30310 1
84 . 1 1 6 6 LEU C C 13 177.589 0.000 . 1 . . . . A 6 LEU C . 30310 1
85 . 1 1 6 6 LEU CA C 13 59.082 0.056 . 1 . . . . A 6 LEU CA . 30310 1
86 . 1 1 6 6 LEU CB C 13 42.165 0.084 . 1 . . . . A 6 LEU CB . 30310 1
87 . 1 1 6 6 LEU CD1 C 13 24.310 0.008 . 1 . . . . A 6 LEU CD1 . 30310 1
88 . 1 1 6 6 LEU CD2 C 13 26.554 0.059 . 1 . . . . A 6 LEU CD2 . 30310 1
89 . 1 1 6 6 LEU N N 15 125.669 0.055 . 1 . . . . A 6 LEU N . 30310 1
90 . 1 1 7 7 SER H H 1 8.884 0.004 . 1 . . . . A 7 SER H . 30310 1
91 . 1 1 7 7 SER HA H 1 4.055 0.006 . 1 . . . . A 7 SER HA . 30310 1
92 . 1 1 7 7 SER HB2 H 1 3.937 0.002 . 2 . . . . A 7 SER HB2 . 30310 1
93 . 1 1 7 7 SER HB3 H 1 3.937 0.002 . 2 . . . . A 7 SER HB3 . 30310 1
94 . 1 1 7 7 SER C C 13 176.665 0.000 . 1 . . . . A 7 SER C . 30310 1
95 . 1 1 7 7 SER CA C 13 61.657 0.092 . 1 . . . . A 7 SER CA . 30310 1
96 . 1 1 7 7 SER CB C 13 61.735 0.000 . 1 . . . . A 7 SER CB . 30310 1
97 . 1 1 7 7 SER N N 15 111.109 0.029 . 1 . . . . A 7 SER N . 30310 1
98 . 1 1 8 8 LYS H H 1 7.050 0.004 . 1 . . . . A 8 LYS H . 30310 1
99 . 1 1 8 8 LYS HA H 1 4.353 0.009 . 1 . . . . A 8 LYS HA . 30310 1
100 . 1 1 8 8 LYS HB2 H 1 2.019 0.015 . 2 . . . . A 8 LYS HB2 . 30310 1
101 . 1 1 8 8 LYS HB3 H 1 2.019 0.015 . 2 . . . . A 8 LYS HB3 . 30310 1
102 . 1 1 8 8 LYS HG2 H 1 1.564 0.010 . 2 . . . . A 8 LYS HG2 . 30310 1
103 . 1 1 8 8 LYS HG3 H 1 1.564 0.010 . 2 . . . . A 8 LYS HG3 . 30310 1
104 . 1 1 8 8 LYS HD2 H 1 1.769 0.002 . 2 . . . . A 8 LYS HD2 . 30310 1
105 . 1 1 8 8 LYS HD3 H 1 1.769 0.002 . 2 . . . . A 8 LYS HD3 . 30310 1
106 . 1 1 8 8 LYS HE2 H 1 3.016 0.004 . 2 . . . . A 8 LYS HE2 . 30310 1
107 . 1 1 8 8 LYS HE3 H 1 3.016 0.004 . 2 . . . . A 8 LYS HE3 . 30310 1
108 . 1 1 8 8 LYS C C 13 178.670 0.000 . 1 . . . . A 8 LYS C . 30310 1
109 . 1 1 8 8 LYS CA C 13 57.589 0.030 . 1 . . . . A 8 LYS CA . 30310 1
110 . 1 1 8 8 LYS CB C 13 32.068 0.082 . 1 . . . . A 8 LYS CB . 30310 1
111 . 1 1 8 8 LYS CE C 13 41.638 0.047 . 1 . . . . A 8 LYS CE . 30310 1
112 . 1 1 8 8 LYS N N 15 122.654 0.040 . 1 . . . . A 8 LYS N . 30310 1
113 . 1 1 9 9 TYR H H 1 8.735 0.004 . 1 . . . . A 9 TYR H . 30310 1
114 . 1 1 9 9 TYR HA H 1 3.963 0.014 . 1 . . . . A 9 TYR HA . 30310 1
115 . 1 1 9 9 TYR HB2 H 1 2.755 0.014 . 2 . . . . A 9 TYR HB2 . 30310 1
116 . 1 1 9 9 TYR HB3 H 1 3.411 0.009 . 2 . . . . A 9 TYR HB3 . 30310 1
117 . 1 1 9 9 TYR HD1 H 1 6.710 0.007 . 3 . . . . A 9 TYR HD1 . 30310 1
118 . 1 1 9 9 TYR HD2 H 1 6.710 0.007 . 3 . . . . A 9 TYR HD2 . 30310 1
119 . 1 1 9 9 TYR HE1 H 1 6.576 0.009 . 3 . . . . A 9 TYR HE1 . 30310 1
120 . 1 1 9 9 TYR HE2 H 1 6.576 0.009 . 3 . . . . A 9 TYR HE2 . 30310 1
121 . 1 1 9 9 TYR C C 13 178.041 0.000 . 1 . . . . A 9 TYR C . 30310 1
122 . 1 1 9 9 TYR CA C 13 62.736 0.052 . 1 . . . . A 9 TYR CA . 30310 1
123 . 1 1 9 9 TYR CB C 13 38.346 0.064 . 1 . . . . A 9 TYR CB . 30310 1
124 . 1 1 9 9 TYR N N 15 122.745 0.036 . 1 . . . . A 9 TYR N . 30310 1
125 . 1 1 10 10 LEU H H 1 8.256 0.004 . 1 . . . . A 10 LEU H . 30310 1
126 . 1 1 10 10 LEU HA H 1 4.791 0.006 . 1 . . . . A 10 LEU HA . 30310 1
127 . 1 1 10 10 LEU HB2 H 1 1.917 0.011 . 2 . . . . A 10 LEU HB2 . 30310 1
128 . 1 1 10 10 LEU HB3 H 1 1.614 0.012 . 2 . . . . A 10 LEU HB3 . 30310 1
129 . 1 1 10 10 LEU HG H 1 2.015 0.011 . 1 . . . . A 10 LEU HG . 30310 1
130 . 1 1 10 10 LEU HD11 H 1 0.922 0.007 . 1 . . . . A 10 LEU HD11 . 30310 1
131 . 1 1 10 10 LEU HD12 H 1 0.922 0.007 . 1 . . . . A 10 LEU HD12 . 30310 1
132 . 1 1 10 10 LEU HD13 H 1 0.922 0.007 . 1 . . . . A 10 LEU HD13 . 30310 1
133 . 1 1 10 10 LEU HD21 H 1 0.949 0.005 . 1 . . . . A 10 LEU HD21 . 30310 1
134 . 1 1 10 10 LEU HD22 H 1 0.949 0.005 . 1 . . . . A 10 LEU HD22 . 30310 1
135 . 1 1 10 10 LEU HD23 H 1 0.949 0.005 . 1 . . . . A 10 LEU HD23 . 30310 1
136 . 1 1 10 10 LEU C C 13 178.109 0.000 . 1 . . . . A 10 LEU C . 30310 1
137 . 1 1 10 10 LEU CA C 13 56.008 0.019 . 1 . . . . A 10 LEU CA . 30310 1
138 . 1 1 10 10 LEU CB C 13 41.442 0.061 . 1 . . . . A 10 LEU CB . 30310 1
139 . 1 1 10 10 LEU CG C 13 27.318 0.000 . 1 . . . . A 10 LEU CG . 30310 1
140 . 1 1 10 10 LEU CD1 C 13 26.667 0.036 . 1 . . . . A 10 LEU CD1 . 30310 1
141 . 1 1 10 10 LEU CD2 C 13 22.765 0.042 . 1 . . . . A 10 LEU CD2 . 30310 1
142 . 1 1 10 10 LEU N N 15 118.029 0.026 . 1 . . . . A 10 LEU N . 30310 1
143 . 1 1 11 11 GLU H H 1 7.532 0.006 . 1 . . . . A 11 GLU H . 30310 1
144 . 1 1 11 11 GLU HA H 1 4.225 0.007 . 1 . . . . A 11 GLU HA . 30310 1
145 . 1 1 11 11 GLU HB2 H 1 2.231 0.015 . 2 . . . . A 11 GLU HB2 . 30310 1
146 . 1 1 11 11 GLU HB3 H 1 2.118 0.013 . 2 . . . . A 11 GLU HB3 . 30310 1
147 . 1 1 11 11 GLU HG2 H 1 2.497 0.011 . 2 . . . . A 11 GLU HG2 . 30310 1
148 . 1 1 11 11 GLU HG3 H 1 2.497 0.011 . 2 . . . . A 11 GLU HG3 . 30310 1
149 . 1 1 11 11 GLU C C 13 178.336 0.000 . 1 . . . . A 11 GLU C . 30310 1
150 . 1 1 11 11 GLU CA C 13 58.429 0.067 . 1 . . . . A 11 GLU CA . 30310 1
151 . 1 1 11 11 GLU CB C 13 31.271 0.070 . 1 . . . . A 11 GLU CB . 30310 1
152 . 1 1 11 11 GLU N N 15 117.173 0.017 . 1 . . . . A 11 GLU N . 30310 1
153 . 1 1 12 12 GLU H H 1 7.809 0.002 . 1 . . . . A 12 GLU H . 30310 1
154 . 1 1 12 12 GLU HA H 1 4.386 0.010 . 1 . . . . A 12 GLU HA . 30310 1
155 . 1 1 12 12 GLU HB2 H 1 1.680 0.009 . 2 . . . . A 12 GLU HB2 . 30310 1
156 . 1 1 12 12 GLU HB3 H 1 1.680 0.009 . 2 . . . . A 12 GLU HB3 . 30310 1
157 . 1 1 12 12 GLU HG2 H 1 2.050 0.000 . 2 . . . . A 12 GLU HG2 . 30310 1
158 . 1 1 12 12 GLU HG3 H 1 2.050 0.000 . 2 . . . . A 12 GLU HG3 . 30310 1
159 . 1 1 12 12 GLU C C 13 176.312 0.000 . 1 . . . . A 12 GLU C . 30310 1
160 . 1 1 12 12 GLU CA C 13 56.963 0.047 . 1 . . . . A 12 GLU CA . 30310 1
161 . 1 1 12 12 GLU CB C 13 32.744 0.088 . 1 . . . . A 12 GLU CB . 30310 1
162 . 1 1 12 12 GLU N N 15 113.644 0.017 . 1 . . . . A 12 GLU N . 30310 1
163 . 1 1 13 13 HIS H H 1 8.402 0.003 . 1 . . . . A 13 HIS H . 30310 1
164 . 1 1 13 13 HIS HA H 1 4.494 0.014 . 1 . . . . A 13 HIS HA . 30310 1
165 . 1 1 13 13 HIS HB2 H 1 2.095 0.010 . 2 . . . . A 13 HIS HB2 . 30310 1
166 . 1 1 13 13 HIS HB3 H 1 2.500 0.018 . 2 . . . . A 13 HIS HB3 . 30310 1
167 . 1 1 13 13 HIS HD2 H 1 6.689 0.009 . 1 . . . . A 13 HIS HD2 . 30310 1
168 . 1 1 13 13 HIS HE1 H 1 7.715 0.003 . 1 . . . . A 13 HIS HE1 . 30310 1
169 . 1 1 13 13 HIS C C 13 175.284 0.000 . 1 . . . . A 13 HIS C . 30310 1
170 . 1 1 13 13 HIS CA C 13 57.503 0.058 . 1 . . . . A 13 HIS CA . 30310 1
171 . 1 1 13 13 HIS CB C 13 32.037 0.022 . 1 . . . . A 13 HIS CB . 30310 1
172 . 1 1 13 13 HIS CD2 C 13 120.704 0.000 . 1 . . . . A 13 HIS CD2 . 30310 1
173 . 1 1 13 13 HIS CE1 C 13 137.999 0.000 . 1 . . . . A 13 HIS CE1 . 30310 1
174 . 1 1 13 13 HIS N N 15 117.223 0.032 . 1 . . . . A 13 HIS N . 30310 1
175 . 1 1 14 14 GLY H H 1 7.666 0.005 . 1 . . . . A 14 GLY H . 30310 1
176 . 1 1 14 14 GLY HA2 H 1 4.242 0.012 . 2 . . . . A 14 GLY HA2 . 30310 1
177 . 1 1 14 14 GLY HA3 H 1 3.846 0.009 . 2 . . . . A 14 GLY HA3 . 30310 1
178 . 1 1 14 14 GLY C C 13 171.152 0.000 . 1 . . . . A 14 GLY C . 30310 1
179 . 1 1 14 14 GLY CA C 13 45.700 0.034 . 1 . . . . A 14 GLY CA . 30310 1
180 . 1 1 14 14 GLY N N 15 108.066 0.020 . 1 . . . . A 14 GLY N . 30310 1
181 . 1 1 15 15 THR H H 1 7.392 0.003 . 1 . . . . A 15 THR H . 30310 1
182 . 1 1 15 15 THR HA H 1 4.762 0.008 . 1 . . . . A 15 THR HA . 30310 1
183 . 1 1 15 15 THR HB H 1 4.746 0.006 . 1 . . . . A 15 THR HB . 30310 1
184 . 1 1 15 15 THR HG21 H 1 1.337 0.009 . 1 . . . . A 15 THR HG21 . 30310 1
185 . 1 1 15 15 THR HG22 H 1 1.337 0.009 . 1 . . . . A 15 THR HG22 . 30310 1
186 . 1 1 15 15 THR HG23 H 1 1.337 0.009 . 1 . . . . A 15 THR HG23 . 30310 1
187 . 1 1 15 15 THR C C 13 175.749 0.000 . 1 . . . . A 15 THR C . 30310 1
188 . 1 1 15 15 THR CA C 13 59.920 0.038 . 1 . . . . A 15 THR CA . 30310 1
189 . 1 1 15 15 THR CB C 13 72.072 0.056 . 1 . . . . A 15 THR CB . 30310 1
190 . 1 1 15 15 THR CG2 C 13 21.945 0.038 . 1 . . . . A 15 THR CG2 . 30310 1
191 . 1 1 15 15 THR N N 15 106.178 0.020 . 1 . . . . A 15 THR N . 30310 1
192 . 1 1 16 16 GLN H H 1 9.185 0.006 . 1 . . . . A 16 GLN H . 30310 1
193 . 1 1 16 16 GLN HA H 1 3.901 0.009 . 1 . . . . A 16 GLN HA . 30310 1
194 . 1 1 16 16 GLN HB2 H 1 2.167 0.014 . 2 . . . . A 16 GLN HB2 . 30310 1
195 . 1 1 16 16 GLN HB3 H 1 2.167 0.014 . 2 . . . . A 16 GLN HB3 . 30310 1
196 . 1 1 16 16 GLN HG2 H 1 2.614 0.005 . 2 . . . . A 16 GLN HG2 . 30310 1
197 . 1 1 16 16 GLN HG3 H 1 2.233 0.006 . 2 . . . . A 16 GLN HG3 . 30310 1
198 . 1 1 16 16 GLN HE21 H 1 7.433 0.001 . 2 . . . . A 16 GLN HE21 . 30310 1
199 . 1 1 16 16 GLN HE22 H 1 6.963 0.002 . 2 . . . . A 16 GLN HE22 . 30310 1
200 . 1 1 16 16 GLN C C 13 178.146 0.000 . 1 . . . . A 16 GLN C . 30310 1
201 . 1 1 16 16 GLN CA C 13 60.562 0.052 . 1 . . . . A 16 GLN CA . 30310 1
202 . 1 1 16 16 GLN CB C 13 28.901 0.103 . 1 . . . . A 16 GLN CB . 30310 1
203 . 1 1 16 16 GLN CG C 13 35.329 0.036 . 1 . . . . A 16 GLN CG . 30310 1
204 . 1 1 16 16 GLN N N 15 120.069 0.022 . 1 . . . . A 16 GLN N . 30310 1
205 . 1 1 16 16 GLN NE2 N 15 109.739 0.028 . 1 . . . . A 16 GLN NE2 . 30310 1
206 . 1 1 17 17 SER H H 1 8.447 0.004 . 1 . . . . A 17 SER H . 30310 1
207 . 1 1 17 17 SER HA H 1 4.071 0.009 . 1 . . . . A 17 SER HA . 30310 1
208 . 1 1 17 17 SER HB2 H 1 3.900 0.006 . 2 . . . . A 17 SER HB2 . 30310 1
209 . 1 1 17 17 SER HB3 H 1 3.900 0.006 . 2 . . . . A 17 SER HB3 . 30310 1
210 . 1 1 17 17 SER C C 13 177.102 0.000 . 1 . . . . A 17 SER C . 30310 1
211 . 1 1 17 17 SER CA C 13 61.376 0.129 . 1 . . . . A 17 SER CA . 30310 1
212 . 1 1 17 17 SER CB C 13 62.364 0.041 . 1 . . . . A 17 SER CB . 30310 1
213 . 1 1 17 17 SER N N 15 113.080 0.039 . 1 . . . . A 17 SER N . 30310 1
214 . 1 1 18 18 ALA H H 1 7.900 0.005 . 1 . . . . A 18 ALA H . 30310 1
215 . 1 1 18 18 ALA HA H 1 4.231 0.007 . 1 . . . . A 18 ALA HA . 30310 1
216 . 1 1 18 18 ALA HB1 H 1 1.604 0.006 . 1 . . . . A 18 ALA HB1 . 30310 1
217 . 1 1 18 18 ALA HB2 H 1 1.604 0.006 . 1 . . . . A 18 ALA HB2 . 30310 1
218 . 1 1 18 18 ALA HB3 H 1 1.604 0.006 . 1 . . . . A 18 ALA HB3 . 30310 1
219 . 1 1 18 18 ALA C C 13 180.840 0.000 . 1 . . . . A 18 ALA C . 30310 1
220 . 1 1 18 18 ALA CA C 13 55.012 0.025 . 1 . . . . A 18 ALA CA . 30310 1
221 . 1 1 18 18 ALA CB C 13 18.577 0.061 . 1 . . . . A 18 ALA CB . 30310 1
222 . 1 1 18 18 ALA N N 15 126.889 0.028 . 1 . . . . A 18 ALA N . 30310 1
223 . 1 1 19 19 LEU H H 1 8.465 0.002 . 1 . . . . A 19 LEU H . 30310 1
224 . 1 1 19 19 LEU HA H 1 4.069 0.010 . 1 . . . . A 19 LEU HA . 30310 1
225 . 1 1 19 19 LEU HB2 H 1 1.782 0.013 . 2 . . . . A 19 LEU HB2 . 30310 1
226 . 1 1 19 19 LEU HB3 H 1 1.643 0.005 . 2 . . . . A 19 LEU HB3 . 30310 1
227 . 1 1 19 19 LEU HG H 1 1.332 0.004 . 1 . . . . A 19 LEU HG . 30310 1
228 . 1 1 19 19 LEU HD11 H 1 0.391 0.006 . 1 . . . . A 19 LEU HD11 . 30310 1
229 . 1 1 19 19 LEU HD12 H 1 0.391 0.006 . 1 . . . . A 19 LEU HD12 . 30310 1
230 . 1 1 19 19 LEU HD13 H 1 0.391 0.006 . 1 . . . . A 19 LEU HD13 . 30310 1
231 . 1 1 19 19 LEU HD21 H 1 0.582 0.003 . 1 . . . . A 19 LEU HD21 . 30310 1
232 . 1 1 19 19 LEU HD22 H 1 0.582 0.003 . 1 . . . . A 19 LEU HD22 . 30310 1
233 . 1 1 19 19 LEU HD23 H 1 0.582 0.003 . 1 . . . . A 19 LEU HD23 . 30310 1
234 . 1 1 19 19 LEU CA C 13 57.469 0.035 . 1 . . . . A 19 LEU CA . 30310 1
235 . 1 1 19 19 LEU CB C 13 41.100 0.039 . 1 . . . . A 19 LEU CB . 30310 1
236 . 1 1 19 19 LEU CD1 C 13 22.155 0.046 . 1 . . . . A 19 LEU CD1 . 30310 1
237 . 1 1 19 19 LEU CD2 C 13 26.251 0.052 . 1 . . . . A 19 LEU CD2 . 30310 1
238 . 1 1 19 19 LEU N N 15 121.519 0.026 . 1 . . . . A 19 LEU N . 30310 1
239 . 1 1 20 20 ALA H H 1 8.259 0.003 . 1 . . . . A 20 ALA H . 30310 1
240 . 1 1 20 20 ALA HA H 1 3.774 0.011 . 1 . . . . A 20 ALA HA . 30310 1
241 . 1 1 20 20 ALA HB1 H 1 1.523 0.006 . 1 . . . . A 20 ALA HB1 . 30310 1
242 . 1 1 20 20 ALA HB2 H 1 1.523 0.006 . 1 . . . . A 20 ALA HB2 . 30310 1
243 . 1 1 20 20 ALA HB3 H 1 1.523 0.006 . 1 . . . . A 20 ALA HB3 . 30310 1
244 . 1 1 20 20 ALA C C 13 179.461 0.000 . 1 . . . . A 20 ALA C . 30310 1
245 . 1 1 20 20 ALA CA C 13 55.554 0.064 . 1 . . . . A 20 ALA CA . 30310 1
246 . 1 1 20 20 ALA CB C 13 17.565 0.076 . 1 . . . . A 20 ALA CB . 30310 1
247 . 1 1 20 20 ALA N N 15 120.533 0.030 . 1 . . . . A 20 ALA N . 30310 1
248 . 1 1 21 21 ALA H H 1 7.664 0.004 . 1 . . . . A 21 ALA H . 30310 1
249 . 1 1 21 21 ALA HA H 1 4.200 0.004 . 1 . . . . A 21 ALA HA . 30310 1
250 . 1 1 21 21 ALA HB1 H 1 1.527 0.001 . 1 . . . . A 21 ALA HB1 . 30310 1
251 . 1 1 21 21 ALA HB2 H 1 1.527 0.001 . 1 . . . . A 21 ALA HB2 . 30310 1
252 . 1 1 21 21 ALA HB3 H 1 1.527 0.001 . 1 . . . . A 21 ALA HB3 . 30310 1
253 . 1 1 21 21 ALA C C 13 180.388 0.000 . 1 . . . . A 21 ALA C . 30310 1
254 . 1 1 21 21 ALA CA C 13 54.626 0.068 . 1 . . . . A 21 ALA CA . 30310 1
255 . 1 1 21 21 ALA CB C 13 18.080 0.065 . 1 . . . . A 21 ALA CB . 30310 1
256 . 1 1 21 21 ALA N N 15 118.290 0.050 . 1 . . . . A 21 ALA N . 30310 1
257 . 1 1 22 22 ALA H H 1 8.014 0.003 . 1 . . . . A 22 ALA H . 30310 1
258 . 1 1 22 22 ALA HA H 1 4.168 0.003 . 1 . . . . A 22 ALA HA . 30310 1
259 . 1 1 22 22 ALA HB1 H 1 1.536 0.007 . 1 . . . . A 22 ALA HB1 . 30310 1
260 . 1 1 22 22 ALA HB2 H 1 1.536 0.007 . 1 . . . . A 22 ALA HB2 . 30310 1
261 . 1 1 22 22 ALA HB3 H 1 1.536 0.007 . 1 . . . . A 22 ALA HB3 . 30310 1
262 . 1 1 22 22 ALA C C 13 179.732 0.000 . 1 . . . . A 22 ALA C . 30310 1
263 . 1 1 22 22 ALA CA C 13 54.744 0.028 . 1 . . . . A 22 ALA CA . 30310 1
264 . 1 1 22 22 ALA CB C 13 18.516 0.048 . 1 . . . . A 22 ALA CB . 30310 1
265 . 1 1 22 22 ALA N N 15 121.067 0.027 . 1 . . . . A 22 ALA N . 30310 1
266 . 1 1 23 23 LEU H H 1 8.094 0.004 . 1 . . . . A 23 LEU H . 30310 1
267 . 1 1 23 23 LEU HA H 1 4.341 0.010 . 1 . . . . A 23 LEU HA . 30310 1
268 . 1 1 23 23 LEU HB2 H 1 1.762 0.011 . 2 . . . . A 23 LEU HB2 . 30310 1
269 . 1 1 23 23 LEU HB3 H 1 1.461 0.016 . 2 . . . . A 23 LEU HB3 . 30310 1
270 . 1 1 23 23 LEU HG H 1 1.333 0.000 . 1 . . . . A 23 LEU HG . 30310 1
271 . 1 1 23 23 LEU HD11 H 1 0.646 0.005 . 1 . . . . A 23 LEU HD11 . 30310 1
272 . 1 1 23 23 LEU HD12 H 1 0.646 0.005 . 1 . . . . A 23 LEU HD12 . 30310 1
273 . 1 1 23 23 LEU HD13 H 1 0.646 0.005 . 1 . . . . A 23 LEU HD13 . 30310 1
274 . 1 1 23 23 LEU HD21 H 1 0.750 0.005 . 1 . . . . A 23 LEU HD21 . 30310 1
275 . 1 1 23 23 LEU HD22 H 1 0.750 0.005 . 1 . . . . A 23 LEU HD22 . 30310 1
276 . 1 1 23 23 LEU HD23 H 1 0.750 0.005 . 1 . . . . A 23 LEU HD23 . 30310 1
277 . 1 1 23 23 LEU C C 13 177.466 0.000 . 1 . . . . A 23 LEU C . 30310 1
278 . 1 1 23 23 LEU CA C 13 54.931 0.062 . 1 . . . . A 23 LEU CA . 30310 1
279 . 1 1 23 23 LEU CB C 13 43.918 0.048 . 1 . . . . A 23 LEU CB . 30310 1
280 . 1 1 23 23 LEU CD1 C 13 26.844 0.043 . 1 . . . . A 23 LEU CD1 . 30310 1
281 . 1 1 23 23 LEU CD2 C 13 23.153 0.037 . 1 . . . . A 23 LEU CD2 . 30310 1
282 . 1 1 23 23 LEU N N 15 114.607 0.021 . 1 . . . . A 23 LEU N . 30310 1
283 . 1 1 24 24 GLY H H 1 8.027 0.003 . 1 . . . . A 24 GLY H . 30310 1
284 . 1 1 24 24 GLY HA2 H 1 4.005 0.005 . 2 . . . . A 24 GLY HA2 . 30310 1
285 . 1 1 24 24 GLY HA3 H 1 3.917 0.002 . 2 . . . . A 24 GLY HA3 . 30310 1
286 . 1 1 24 24 GLY C C 13 174.933 0.000 . 1 . . . . A 24 GLY C . 30310 1
287 . 1 1 24 24 GLY CA C 13 46.599 0.051 . 1 . . . . A 24 GLY CA . 30310 1
288 . 1 1 24 24 GLY N N 15 108.885 0.026 . 1 . . . . A 24 GLY N . 30310 1
289 . 1 1 25 25 VAL H H 1 7.871 0.003 . 1 . . . . A 25 VAL H . 30310 1
290 . 1 1 25 25 VAL HA H 1 4.716 0.007 . 1 . . . . A 25 VAL HA . 30310 1
291 . 1 1 25 25 VAL HB H 1 2.209 0.010 . 1 . . . . A 25 VAL HB . 30310 1
292 . 1 1 25 25 VAL HG11 H 1 0.787 0.006 . 1 . . . . A 25 VAL HG11 . 30310 1
293 . 1 1 25 25 VAL HG12 H 1 0.787 0.006 . 1 . . . . A 25 VAL HG12 . 30310 1
294 . 1 1 25 25 VAL HG13 H 1 0.787 0.006 . 1 . . . . A 25 VAL HG13 . 30310 1
295 . 1 1 25 25 VAL HG21 H 1 0.747 0.006 . 1 . . . . A 25 VAL HG21 . 30310 1
296 . 1 1 25 25 VAL HG22 H 1 0.747 0.006 . 1 . . . . A 25 VAL HG22 . 30310 1
297 . 1 1 25 25 VAL HG23 H 1 0.747 0.006 . 1 . . . . A 25 VAL HG23 . 30310 1
298 . 1 1 25 25 VAL C C 13 174.304 0.000 . 1 . . . . A 25 VAL C . 30310 1
299 . 1 1 25 25 VAL CA C 13 58.365 0.025 . 1 . . . . A 25 VAL CA . 30310 1
300 . 1 1 25 25 VAL CB C 13 35.044 0.085 . 1 . . . . A 25 VAL CB . 30310 1
301 . 1 1 25 25 VAL CG1 C 13 21.718 0.049 . 1 . . . . A 25 VAL CG1 . 30310 1
302 . 1 1 25 25 VAL CG2 C 13 19.238 0.037 . 1 . . . . A 25 VAL CG2 . 30310 1
303 . 1 1 25 25 VAL N N 15 111.397 0.020 . 1 . . . . A 25 VAL N . 30310 1
304 . 1 1 26 26 ASN H H 1 8.518 0.002 . 1 . . . . A 26 ASN H . 30310 1
305 . 1 1 26 26 ASN HA H 1 4.670 0.009 . 1 . . . . A 26 ASN HA . 30310 1
306 . 1 1 26 26 ASN HB2 H 1 2.852 0.009 . 2 . . . . A 26 ASN HB2 . 30310 1
307 . 1 1 26 26 ASN HB3 H 1 2.852 0.009 . 2 . . . . A 26 ASN HB3 . 30310 1
308 . 1 1 26 26 ASN HD21 H 1 7.812 0.002 . 2 . . . . A 26 ASN HD21 . 30310 1
309 . 1 1 26 26 ASN HD22 H 1 7.090 0.002 . 2 . . . . A 26 ASN HD22 . 30310 1
310 . 1 1 26 26 ASN C C 13 176.256 0.000 . 1 . . . . A 26 ASN C . 30310 1
311 . 1 1 26 26 ASN CA C 13 53.236 0.042 . 1 . . . . A 26 ASN CA . 30310 1
312 . 1 1 26 26 ASN CB C 13 39.398 0.044 . 1 . . . . A 26 ASN CB . 30310 1
313 . 1 1 26 26 ASN N N 15 119.061 0.034 . 1 . . . . A 26 ASN N . 30310 1
314 . 1 1 26 26 ASN ND2 N 15 114.140 0.020 . 1 . . . . A 26 ASN ND2 . 30310 1
315 . 1 1 27 27 GLN H H 1 9.252 0.002 . 1 . . . . A 27 GLN H . 30310 1
316 . 1 1 27 27 GLN HA H 1 3.788 0.008 . 1 . . . . A 27 GLN HA . 30310 1
317 . 1 1 27 27 GLN HG2 H 1 2.370 0.006 . 2 . . . . A 27 GLN HG2 . 30310 1
318 . 1 1 27 27 GLN HG3 H 1 2.135 0.009 . 2 . . . . A 27 GLN HG3 . 30310 1
319 . 1 1 27 27 GLN HE21 H 1 7.611 0.002 . 2 . . . . A 27 GLN HE21 . 30310 1
320 . 1 1 27 27 GLN HE22 H 1 6.988 0.003 . 2 . . . . A 27 GLN HE22 . 30310 1
321 . 1 1 27 27 GLN C C 13 177.827 0.000 . 1 . . . . A 27 GLN C . 30310 1
322 . 1 1 27 27 GLN CA C 13 60.266 0.055 . 1 . . . . A 27 GLN CA . 30310 1
323 . 1 1 27 27 GLN CB C 13 28.259 0.040 . 1 . . . . A 27 GLN CB . 30310 1
324 . 1 1 27 27 GLN N N 15 124.036 0.014 . 1 . . . . A 27 GLN N . 30310 1
325 . 1 1 27 27 GLN NE2 N 15 112.140 0.009 . 1 . . . . A 27 GLN NE2 . 30310 1
326 . 1 1 28 28 SER H H 1 8.879 0.002 . 1 . . . . A 28 SER H . 30310 1
327 . 1 1 28 28 SER HA H 1 4.216 0.008 . 1 . . . . A 28 SER HA . 30310 1
328 . 1 1 28 28 SER HB2 H 1 3.933 0.001 . 2 . . . . A 28 SER HB2 . 30310 1
329 . 1 1 28 28 SER HB3 H 1 3.933 0.001 . 2 . . . . A 28 SER HB3 . 30310 1
330 . 1 1 28 28 SER C C 13 176.312 0.000 . 1 . . . . A 28 SER C . 30310 1
331 . 1 1 28 28 SER CA C 13 60.878 0.116 . 1 . . . . A 28 SER CA . 30310 1
332 . 1 1 28 28 SER CB C 13 62.260 0.054 . 1 . . . . A 28 SER CB . 30310 1
333 . 1 1 28 28 SER N N 15 114.960 0.022 . 1 . . . . A 28 SER N . 30310 1
334 . 1 1 29 29 ALA H H 1 7.717 0.004 . 1 . . . . A 29 ALA H . 30310 1
335 . 1 1 29 29 ALA HA H 1 4.177 0.007 . 1 . . . . A 29 ALA HA . 30310 1
336 . 1 1 29 29 ALA HB1 H 1 1.478 0.010 . 1 . . . . A 29 ALA HB1 . 30310 1
337 . 1 1 29 29 ALA HB2 H 1 1.478 0.010 . 1 . . . . A 29 ALA HB2 . 30310 1
338 . 1 1 29 29 ALA HB3 H 1 1.478 0.010 . 1 . . . . A 29 ALA HB3 . 30310 1
339 . 1 1 29 29 ALA C C 13 180.200 0.000 . 1 . . . . A 29 ALA C . 30310 1
340 . 1 1 29 29 ALA CA C 13 54.833 0.036 . 1 . . . . A 29 ALA CA . 30310 1
341 . 1 1 29 29 ALA CB C 13 18.307 0.074 . 1 . . . . A 29 ALA CB . 30310 1
342 . 1 1 29 29 ALA N N 15 124.697 0.019 . 1 . . . . A 29 ALA N . 30310 1
343 . 1 1 30 30 ILE H H 1 7.178 0.005 . 1 . . . . A 30 ILE H . 30310 1
344 . 1 1 30 30 ILE HA H 1 3.696 0.011 . 1 . . . . A 30 ILE HA . 30310 1
345 . 1 1 30 30 ILE HB H 1 2.220 0.006 . 1 . . . . A 30 ILE HB . 30310 1
346 . 1 1 30 30 ILE HG12 H 1 1.527 0.007 . 2 . . . . A 30 ILE HG12 . 30310 1
347 . 1 1 30 30 ILE HG13 H 1 1.256 0.009 . 2 . . . . A 30 ILE HG13 . 30310 1
348 . 1 1 30 30 ILE HG21 H 1 0.939 0.009 . 1 . . . . A 30 ILE HG21 . 30310 1
349 . 1 1 30 30 ILE HG22 H 1 0.939 0.009 . 1 . . . . A 30 ILE HG22 . 30310 1
350 . 1 1 30 30 ILE HG23 H 1 0.939 0.009 . 1 . . . . A 30 ILE HG23 . 30310 1
351 . 1 1 30 30 ILE HD11 H 1 0.704 0.013 . 1 . . . . A 30 ILE HD11 . 30310 1
352 . 1 1 30 30 ILE HD12 H 1 0.704 0.013 . 1 . . . . A 30 ILE HD12 . 30310 1
353 . 1 1 30 30 ILE HD13 H 1 0.704 0.013 . 1 . . . . A 30 ILE HD13 . 30310 1
354 . 1 1 30 30 ILE C C 13 177.682 0.000 . 1 . . . . A 30 ILE C . 30310 1
355 . 1 1 30 30 ILE CA C 13 63.473 0.073 . 1 . . . . A 30 ILE CA . 30310 1
356 . 1 1 30 30 ILE CB C 13 36.818 0.053 . 1 . . . . A 30 ILE CB . 30310 1
357 . 1 1 30 30 ILE CG1 C 13 28.447 0.010 . 1 . . . . A 30 ILE CG1 . 30310 1
358 . 1 1 30 30 ILE CG2 C 13 18.538 0.058 . 1 . . . . A 30 ILE CG2 . 30310 1
359 . 1 1 30 30 ILE CD1 C 13 12.004 0.041 . 1 . . . . A 30 ILE CD1 . 30310 1
360 . 1 1 30 30 ILE N N 15 116.432 0.020 . 1 . . . . A 30 ILE N . 30310 1
361 . 1 1 31 31 SER H H 1 8.215 0.005 . 1 . . . . A 31 SER H . 30310 1
362 . 1 1 31 31 SER HA H 1 4.109 0.016 . 1 . . . . A 31 SER HA . 30310 1
363 . 1 1 31 31 SER HB2 H 1 3.992 0.011 . 2 . . . . A 31 SER HB2 . 30310 1
364 . 1 1 31 31 SER HB3 H 1 3.992 0.011 . 2 . . . . A 31 SER HB3 . 30310 1
365 . 1 1 31 31 SER C C 13 177.281 0.000 . 1 . . . . A 31 SER C . 30310 1
366 . 1 1 31 31 SER CA C 13 61.535 0.098 . 1 . . . . A 31 SER CA . 30310 1
367 . 1 1 31 31 SER CB C 13 62.698 0.076 . 1 . . . . A 31 SER CB . 30310 1
368 . 1 1 31 31 SER N N 15 115.016 0.041 . 1 . . . . A 31 SER N . 30310 1
369 . 1 1 32 32 GLN H H 1 8.039 0.004 . 1 . . . . A 32 GLN H . 30310 1
370 . 1 1 32 32 GLN HA H 1 4.034 0.009 . 1 . . . . A 32 GLN HA . 30310 1
371 . 1 1 32 32 GLN HB2 H 1 2.165 0.005 . 2 . . . . A 32 GLN HB2 . 30310 1
372 . 1 1 32 32 GLN HB3 H 1 2.165 0.005 . 2 . . . . A 32 GLN HB3 . 30310 1
373 . 1 1 32 32 GLN HG2 H 1 2.513 0.000 . 2 . . . . A 32 GLN HG2 . 30310 1
374 . 1 1 32 32 GLN HG3 H 1 2.441 0.000 . 2 . . . . A 32 GLN HG3 . 30310 1
375 . 1 1 32 32 GLN HE21 H 1 7.449 0.000 . 2 . . . . A 32 GLN HE21 . 30310 1
376 . 1 1 32 32 GLN HE22 H 1 6.883 0.000 . 2 . . . . A 32 GLN HE22 . 30310 1
377 . 1 1 32 32 GLN C C 13 178.447 0.000 . 1 . . . . A 32 GLN C . 30310 1
378 . 1 1 32 32 GLN CA C 13 59.069 0.061 . 1 . . . . A 32 GLN CA . 30310 1
379 . 1 1 32 32 GLN CB C 13 28.443 0.054 . 1 . . . . A 32 GLN CB . 30310 1
380 . 1 1 32 32 GLN N N 15 119.150 0.026 . 1 . . . . A 32 GLN N . 30310 1
381 . 1 1 32 32 GLN NE2 N 15 111.704 0.000 . 1 . . . . A 32 GLN NE2 . 30310 1
382 . 1 1 33 33 MET H H 1 7.471 0.005 . 1 . . . . A 33 MET H . 30310 1
383 . 1 1 33 33 MET HA H 1 4.153 0.016 . 1 . . . . A 33 MET HA . 30310 1
384 . 1 1 33 33 MET HB2 H 1 2.346 0.003 . 2 . . . . A 33 MET HB2 . 30310 1
385 . 1 1 33 33 MET HB3 H 1 1.909 0.017 . 2 . . . . A 33 MET HB3 . 30310 1
386 . 1 1 33 33 MET HG2 H 1 2.687 0.012 . 2 . . . . A 33 MET HG2 . 30310 1
387 . 1 1 33 33 MET HG3 H 1 2.624 0.005 . 2 . . . . A 33 MET HG3 . 30310 1
388 . 1 1 33 33 MET HE1 H 1 1.979 0.004 . 1 . . . . A 33 MET HE1 . 30310 1
389 . 1 1 33 33 MET HE2 H 1 1.979 0.004 . 1 . . . . A 33 MET HE2 . 30310 1
390 . 1 1 33 33 MET HE3 H 1 1.979 0.004 . 1 . . . . A 33 MET HE3 . 30310 1
391 . 1 1 33 33 MET C C 13 178.332 0.000 . 1 . . . . A 33 MET C . 30310 1
392 . 1 1 33 33 MET CA C 13 58.681 0.071 . 1 . . . . A 33 MET CA . 30310 1
393 . 1 1 33 33 MET CB C 13 33.063 0.120 . 1 . . . . A 33 MET CB . 30310 1
394 . 1 1 33 33 MET CG C 13 32.916 0.052 . 1 . . . . A 33 MET CG . 30310 1
395 . 1 1 33 33 MET CE C 13 18.019 0.048 . 1 . . . . A 33 MET CE . 30310 1
396 . 1 1 33 33 MET N N 15 118.708 0.021 . 1 . . . . A 33 MET N . 30310 1
397 . 1 1 34 34 VAL H H 1 8.085 0.005 . 1 . . . . A 34 VAL H . 30310 1
398 . 1 1 34 34 VAL HA H 1 3.704 0.006 . 1 . . . . A 34 VAL HA . 30310 1
399 . 1 1 34 34 VAL HB H 1 2.174 0.008 . 1 . . . . A 34 VAL HB . 30310 1
400 . 1 1 34 34 VAL HG11 H 1 0.937 0.005 . 1 . . . . A 34 VAL HG11 . 30310 1
401 . 1 1 34 34 VAL HG12 H 1 0.937 0.005 . 1 . . . . A 34 VAL HG12 . 30310 1
402 . 1 1 34 34 VAL HG13 H 1 0.937 0.005 . 1 . . . . A 34 VAL HG13 . 30310 1
403 . 1 1 34 34 VAL HG21 H 1 0.999 0.005 . 1 . . . . A 34 VAL HG21 . 30310 1
404 . 1 1 34 34 VAL HG22 H 1 0.999 0.005 . 1 . . . . A 34 VAL HG22 . 30310 1
405 . 1 1 34 34 VAL HG23 H 1 0.999 0.005 . 1 . . . . A 34 VAL HG23 . 30310 1
406 . 1 1 34 34 VAL CA C 13 66.082 0.093 . 1 . . . . A 34 VAL CA . 30310 1
407 . 1 1 34 34 VAL CB C 13 32.050 0.101 . 1 . . . . A 34 VAL CB . 30310 1
408 . 1 1 34 34 VAL CG1 C 13 21.162 0.034 . 1 . . . . A 34 VAL CG1 . 30310 1
409 . 1 1 34 34 VAL CG2 C 13 23.052 0.044 . 1 . . . . A 34 VAL CG2 . 30310 1
410 . 1 1 34 34 VAL N N 15 119.694 0.034 . 1 . . . . A 34 VAL N . 30310 1
411 . 1 1 35 35 ARG H H 1 8.257 0.002 . 1 . . . . A 35 ARG H . 30310 1
412 . 1 1 35 35 ARG HA H 1 4.088 0.011 . 1 . . . . A 35 ARG HA . 30310 1
413 . 1 1 35 35 ARG HB2 H 1 1.888 0.000 . 2 . . . . A 35 ARG HB2 . 30310 1
414 . 1 1 35 35 ARG HB3 H 1 1.888 0.000 . 2 . . . . A 35 ARG HB3 . 30310 1
415 . 1 1 35 35 ARG C C 13 177.525 0.000 . 1 . . . . A 35 ARG C . 30310 1
416 . 1 1 35 35 ARG CA C 13 58.650 0.068 . 1 . . . . A 35 ARG CA . 30310 1
417 . 1 1 35 35 ARG CB C 13 30.274 0.115 . 1 . . . . A 35 ARG CB . 30310 1
418 . 1 1 35 35 ARG N N 15 120.522 0.024 . 1 . . . . A 35 ARG N . 30310 1
419 . 1 1 36 36 ALA H H 1 7.671 0.005 . 1 . . . . A 36 ALA H . 30310 1
420 . 1 1 36 36 ALA HA H 1 4.310 0.005 . 1 . . . . A 36 ALA HA . 30310 1
421 . 1 1 36 36 ALA HB1 H 1 1.522 0.002 . 1 . . . . A 36 ALA HB1 . 30310 1
422 . 1 1 36 36 ALA HB2 H 1 1.522 0.002 . 1 . . . . A 36 ALA HB2 . 30310 1
423 . 1 1 36 36 ALA HB3 H 1 1.522 0.002 . 1 . . . . A 36 ALA HB3 . 30310 1
424 . 1 1 36 36 ALA C C 13 178.354 0.000 . 1 . . . . A 36 ALA C . 30310 1
425 . 1 1 36 36 ALA CA C 13 52.809 0.038 . 1 . . . . A 36 ALA CA . 30310 1
426 . 1 1 36 36 ALA CB C 13 19.231 0.063 . 1 . . . . A 36 ALA CB . 30310 1
427 . 1 1 36 36 ALA N N 15 118.932 0.035 . 1 . . . . A 36 ALA N . 30310 1
428 . 1 1 37 37 GLY H H 1 7.877 0.004 . 1 . . . . A 37 GLY H . 30310 1
429 . 1 1 37 37 GLY HA2 H 1 3.960 0.001 . 2 . . . . A 37 GLY HA2 . 30310 1
430 . 1 1 37 37 GLY HA3 H 1 3.885 0.000 . 2 . . . . A 37 GLY HA3 . 30310 1
431 . 1 1 37 37 GLY C C 13 174.710 0.000 . 1 . . . . A 37 GLY C . 30310 1
432 . 1 1 37 37 GLY CA C 13 46.245 0.047 . 1 . . . . A 37 GLY CA . 30310 1
433 . 1 1 37 37 GLY N N 15 106.927 0.032 . 1 . . . . A 37 GLY N . 30310 1
434 . 1 1 38 38 ARG H H 1 7.610 0.004 . 1 . . . . A 38 ARG H . 30310 1
435 . 1 1 38 38 ARG HA H 1 4.253 0.006 . 1 . . . . A 38 ARG HA . 30310 1
436 . 1 1 38 38 ARG HB2 H 1 1.700 0.010 . 2 . . . . A 38 ARG HB2 . 30310 1
437 . 1 1 38 38 ARG HB3 H 1 1.700 0.010 . 2 . . . . A 38 ARG HB3 . 30310 1
438 . 1 1 38 38 ARG HD2 H 1 3.203 0.000 . 2 . . . . A 38 ARG HD2 . 30310 1
439 . 1 1 38 38 ARG HD3 H 1 3.203 0.000 . 2 . . . . A 38 ARG HD3 . 30310 1
440 . 1 1 38 38 ARG C C 13 175.787 0.000 . 1 . . . . A 38 ARG C . 30310 1
441 . 1 1 38 38 ARG CA C 13 55.623 0.033 . 1 . . . . A 38 ARG CA . 30310 1
442 . 1 1 38 38 ARG CB C 13 30.983 0.102 . 1 . . . . A 38 ARG CB . 30310 1
443 . 1 1 38 38 ARG N N 15 118.429 0.039 . 1 . . . . A 38 ARG N . 30310 1
444 . 1 1 39 39 CYS H H 1 8.799 0.002 . 1 . . . . A 39 CYS H . 30310 1
445 . 1 1 39 39 CYS HA H 1 4.553 0.008 . 1 . . . . A 39 CYS HA . 30310 1
446 . 1 1 39 39 CYS HB2 H 1 2.912 0.005 . 2 . . . . A 39 CYS HB2 . 30310 1
447 . 1 1 39 39 CYS HB3 H 1 2.844 0.003 . 2 . . . . A 39 CYS HB3 . 30310 1
448 . 1 1 39 39 CYS C C 13 173.958 0.000 . 1 . . . . A 39 CYS C . 30310 1
449 . 1 1 39 39 CYS CA C 13 59.109 0.004 . 1 . . . . A 39 CYS CA . 30310 1
450 . 1 1 39 39 CYS CB C 13 26.682 0.051 . 1 . . . . A 39 CYS CB . 30310 1
451 . 1 1 39 39 CYS N N 15 124.028 0.035 . 1 . . . . A 39 CYS N . 30310 1
452 . 1 1 40 40 ILE H H 1 7.656 0.005 . 1 . . . . A 40 ILE H . 30310 1
453 . 1 1 40 40 ILE HA H 1 4.380 0.007 . 1 . . . . A 40 ILE HA . 30310 1
454 . 1 1 40 40 ILE HB H 1 1.713 0.010 . 1 . . . . A 40 ILE HB . 30310 1
455 . 1 1 40 40 ILE HG12 H 1 1.340 0.007 . 2 . . . . A 40 ILE HG12 . 30310 1
456 . 1 1 40 40 ILE HG13 H 1 1.023 0.006 . 2 . . . . A 40 ILE HG13 . 30310 1
457 . 1 1 40 40 ILE HG21 H 1 0.756 0.007 . 1 . . . . A 40 ILE HG21 . 30310 1
458 . 1 1 40 40 ILE HG22 H 1 0.756 0.007 . 1 . . . . A 40 ILE HG22 . 30310 1
459 . 1 1 40 40 ILE HG23 H 1 0.756 0.007 . 1 . . . . A 40 ILE HG23 . 30310 1
460 . 1 1 40 40 ILE HD11 H 1 0.750 0.004 . 1 . . . . A 40 ILE HD11 . 30310 1
461 . 1 1 40 40 ILE HD12 H 1 0.750 0.004 . 1 . . . . A 40 ILE HD12 . 30310 1
462 . 1 1 40 40 ILE HD13 H 1 0.750 0.004 . 1 . . . . A 40 ILE HD13 . 30310 1
463 . 1 1 40 40 ILE C C 13 173.718 0.000 . 1 . . . . A 40 ILE C . 30310 1
464 . 1 1 40 40 ILE CA C 13 59.329 0.056 . 1 . . . . A 40 ILE CA . 30310 1
465 . 1 1 40 40 ILE CB C 13 40.801 0.100 . 1 . . . . A 40 ILE CB . 30310 1
466 . 1 1 40 40 ILE CG1 C 13 26.880 0.007 . 1 . . . . A 40 ILE CG1 . 30310 1
467 . 1 1 40 40 ILE CG2 C 13 18.457 0.038 . 1 . . . . A 40 ILE CG2 . 30310 1
468 . 1 1 40 40 ILE CD1 C 13 13.656 0.043 . 1 . . . . A 40 ILE CD1 . 30310 1
469 . 1 1 40 40 ILE N N 15 124.679 0.028 . 1 . . . . A 40 ILE N . 30310 1
470 . 1 1 41 41 ASP H H 1 8.702 0.003 . 1 . . . . A 41 ASP H . 30310 1
471 . 1 1 41 41 ASP HA H 1 5.158 0.011 . 1 . . . . A 41 ASP HA . 30310 1
472 . 1 1 41 41 ASP HB2 H 1 2.444 0.007 . 2 . . . . A 41 ASP HB2 . 30310 1
473 . 1 1 41 41 ASP HB3 H 1 2.131 0.009 . 2 . . . . A 41 ASP HB3 . 30310 1
474 . 1 1 41 41 ASP C C 13 175.166 0.000 . 1 . . . . A 41 ASP C . 30310 1
475 . 1 1 41 41 ASP CA C 13 53.847 0.026 . 1 . . . . A 41 ASP CA . 30310 1
476 . 1 1 41 41 ASP CB C 13 43.468 0.060 . 1 . . . . A 41 ASP CB . 30310 1
477 . 1 1 41 41 ASP N N 15 124.812 0.038 . 1 . . . . A 41 ASP N . 30310 1
478 . 1 1 42 42 ILE H H 1 9.371 0.006 . 1 . . . . A 42 ILE H . 30310 1
479 . 1 1 42 42 ILE HA H 1 4.367 0.010 . 1 . . . . A 42 ILE HA . 30310 1
480 . 1 1 42 42 ILE HB H 1 1.971 0.008 . 1 . . . . A 42 ILE HB . 30310 1
481 . 1 1 42 42 ILE HG12 H 1 1.360 0.004 . 2 . . . . A 42 ILE HG12 . 30310 1
482 . 1 1 42 42 ILE HG13 H 1 0.984 0.004 . 2 . . . . A 42 ILE HG13 . 30310 1
483 . 1 1 42 42 ILE HG21 H 1 0.557 0.004 . 1 . . . . A 42 ILE HG21 . 30310 1
484 . 1 1 42 42 ILE HG22 H 1 0.557 0.004 . 1 . . . . A 42 ILE HG22 . 30310 1
485 . 1 1 42 42 ILE HG23 H 1 0.557 0.004 . 1 . . . . A 42 ILE HG23 . 30310 1
486 . 1 1 42 42 ILE HD11 H 1 0.591 0.008 . 1 . . . . A 42 ILE HD11 . 30310 1
487 . 1 1 42 42 ILE HD12 H 1 0.591 0.008 . 1 . . . . A 42 ILE HD12 . 30310 1
488 . 1 1 42 42 ILE HD13 H 1 0.591 0.008 . 1 . . . . A 42 ILE HD13 . 30310 1
489 . 1 1 42 42 ILE C C 13 174.801 0.000 . 1 . . . . A 42 ILE C . 30310 1
490 . 1 1 42 42 ILE CA C 13 58.243 0.044 . 1 . . . . A 42 ILE CA . 30310 1
491 . 1 1 42 42 ILE CB C 13 37.787 0.044 . 1 . . . . A 42 ILE CB . 30310 1
492 . 1 1 42 42 ILE CG2 C 13 18.490 0.053 . 1 . . . . A 42 ILE CG2 . 30310 1
493 . 1 1 42 42 ILE CD1 C 13 11.381 0.041 . 1 . . . . A 42 ILE CD1 . 30310 1
494 . 1 1 42 42 ILE N N 15 122.624 0.040 . 1 . . . . A 42 ILE N . 30310 1
495 . 1 1 43 43 GLU H H 1 8.851 0.003 . 1 . . . . A 43 GLU H . 30310 1
496 . 1 1 43 43 GLU HA H 1 4.563 0.007 . 1 . . . . A 43 GLU HA . 30310 1
497 . 1 1 43 43 GLU HB2 H 1 2.050 0.000 . 2 . . . . A 43 GLU HB2 . 30310 1
498 . 1 1 43 43 GLU HB3 H 1 1.597 0.010 . 2 . . . . A 43 GLU HB3 . 30310 1
499 . 1 1 43 43 GLU C C 13 174.150 0.000 . 1 . . . . A 43 GLU C . 30310 1
500 . 1 1 43 43 GLU CA C 13 55.402 0.017 . 1 . . . . A 43 GLU CA . 30310 1
501 . 1 1 43 43 GLU CB C 13 31.547 0.045 . 1 . . . . A 43 GLU CB . 30310 1
502 . 1 1 43 43 GLU N N 15 124.667 0.043 . 1 . . . . A 43 GLU N . 30310 1
503 . 1 1 44 44 LEU H H 1 8.763 0.003 . 1 . . . . A 44 LEU H . 30310 1
504 . 1 1 44 44 LEU HA H 1 5.047 0.007 . 1 . . . . A 44 LEU HA . 30310 1
505 . 1 1 44 44 LEU HB2 H 1 1.686 0.014 . 2 . . . . A 44 LEU HB2 . 30310 1
506 . 1 1 44 44 LEU HB3 H 1 1.324 0.010 . 2 . . . . A 44 LEU HB3 . 30310 1
507 . 1 1 44 44 LEU HG H 1 1.498 0.001 . 1 . . . . A 44 LEU HG . 30310 1
508 . 1 1 44 44 LEU HD11 H 1 0.821 0.004 . 1 . . . . A 44 LEU HD11 . 30310 1
509 . 1 1 44 44 LEU HD12 H 1 0.821 0.004 . 1 . . . . A 44 LEU HD12 . 30310 1
510 . 1 1 44 44 LEU HD13 H 1 0.821 0.004 . 1 . . . . A 44 LEU HD13 . 30310 1
511 . 1 1 44 44 LEU HD21 H 1 0.756 0.006 . 1 . . . . A 44 LEU HD21 . 30310 1
512 . 1 1 44 44 LEU HD22 H 1 0.756 0.006 . 1 . . . . A 44 LEU HD22 . 30310 1
513 . 1 1 44 44 LEU HD23 H 1 0.756 0.006 . 1 . . . . A 44 LEU HD23 . 30310 1
514 . 1 1 44 44 LEU C C 13 176.764 0.000 . 1 . . . . A 44 LEU C . 30310 1
515 . 1 1 44 44 LEU CA C 13 53.809 0.031 . 1 . . . . A 44 LEU CA . 30310 1
516 . 1 1 44 44 LEU CB C 13 44.112 0.089 . 1 . . . . A 44 LEU CB . 30310 1
517 . 1 1 44 44 LEU CD1 C 13 25.154 0.045 . 1 . . . . A 44 LEU CD1 . 30310 1
518 . 1 1 44 44 LEU CD2 C 13 25.953 0.076 . 1 . . . . A 44 LEU CD2 . 30310 1
519 . 1 1 44 44 LEU N N 15 123.476 0.039 . 1 . . . . A 44 LEU N . 30310 1
520 . 1 1 45 45 TYR H H 1 8.812 0.004 . 1 . . . . A 45 TYR H . 30310 1
521 . 1 1 45 45 TYR HA H 1 4.577 0.011 . 1 . . . . A 45 TYR HA . 30310 1
522 . 1 1 45 45 TYR HB2 H 1 3.093 0.008 . 2 . . . . A 45 TYR HB2 . 30310 1
523 . 1 1 45 45 TYR HB3 H 1 3.279 0.009 . 2 . . . . A 45 TYR HB3 . 30310 1
524 . 1 1 45 45 TYR HD1 H 1 7.176 0.006 . 3 . . . . A 45 TYR HD1 . 30310 1
525 . 1 1 45 45 TYR HD2 H 1 7.176 0.006 . 3 . . . . A 45 TYR HD2 . 30310 1
526 . 1 1 45 45 TYR HE1 H 1 6.681 0.007 . 3 . . . . A 45 TYR HE1 . 30310 1
527 . 1 1 45 45 TYR HE2 H 1 6.681 0.007 . 3 . . . . A 45 TYR HE2 . 30310 1
528 . 1 1 45 45 TYR CA C 13 58.455 0.004 . 1 . . . . A 45 TYR CA . 30310 1
529 . 1 1 45 45 TYR CB C 13 40.392 0.082 . 1 . . . . A 45 TYR CB . 30310 1
530 . 1 1 45 45 TYR N N 15 126.319 0.009 . 1 . . . . A 45 TYR N . 30310 1
531 . 1 1 46 46 THR HA H 1 4.041 0.006 . 1 . . . . A 46 THR HA . 30310 1
532 . 1 1 46 46 THR HB H 1 4.350 0.006 . 1 . . . . A 46 THR HB . 30310 1
533 . 1 1 46 46 THR HG21 H 1 1.360 0.005 . 1 . . . . A 46 THR HG21 . 30310 1
534 . 1 1 46 46 THR HG22 H 1 1.360 0.005 . 1 . . . . A 46 THR HG22 . 30310 1
535 . 1 1 46 46 THR HG23 H 1 1.360 0.005 . 1 . . . . A 46 THR HG23 . 30310 1
536 . 1 1 46 46 THR C C 13 174.958 0.000 . 1 . . . . A 46 THR C . 30310 1
537 . 1 1 46 46 THR CA C 13 65.516 0.072 . 1 . . . . A 46 THR CA . 30310 1
538 . 1 1 46 46 THR CB C 13 68.912 0.047 . 1 . . . . A 46 THR CB . 30310 1
539 . 1 1 46 46 THR CG2 C 13 22.285 0.000 . 1 . . . . A 46 THR CG2 . 30310 1
540 . 1 1 47 47 ASP H H 1 8.133 0.005 . 1 . . . . A 47 ASP H . 30310 1
541 . 1 1 47 47 ASP HA H 1 4.524 0.006 . 1 . . . . A 47 ASP HA . 30310 1
542 . 1 1 47 47 ASP HB2 H 1 3.056 0.011 . 2 . . . . A 47 ASP HB2 . 30310 1
543 . 1 1 47 47 ASP HB3 H 1 2.637 0.006 . 2 . . . . A 47 ASP HB3 . 30310 1
544 . 1 1 47 47 ASP C C 13 176.905 0.000 . 1 . . . . A 47 ASP C . 30310 1
545 . 1 1 47 47 ASP CA C 13 53.698 0.053 . 1 . . . . A 47 ASP CA . 30310 1
546 . 1 1 47 47 ASP CB C 13 40.029 0.052 . 1 . . . . A 47 ASP CB . 30310 1
547 . 1 1 47 47 ASP N N 15 118.643 0.025 . 1 . . . . A 47 ASP N . 30310 1
548 . 1 1 48 48 GLY H H 1 8.093 0.004 . 1 . . . . A 48 GLY H . 30310 1
549 . 1 1 48 48 GLY HA2 H 1 4.405 0.006 . 2 . . . . A 48 GLY HA2 . 30310 1
550 . 1 1 48 48 GLY HA3 H 1 3.669 0.005 . 2 . . . . A 48 GLY HA3 . 30310 1
551 . 1 1 48 48 GLY C C 13 174.614 0.000 . 1 . . . . A 48 GLY C . 30310 1
552 . 1 1 48 48 GLY CA C 13 44.943 0.043 . 1 . . . . A 48 GLY CA . 30310 1
553 . 1 1 48 48 GLY N N 15 108.033 0.034 . 1 . . . . A 48 GLY N . 30310 1
554 . 1 1 49 49 ARG H H 1 7.867 0.001 . 1 . . . . A 49 ARG H . 30310 1
555 . 1 1 49 49 ARG HA H 1 4.253 0.007 . 1 . . . . A 49 ARG HA . 30310 1
556 . 1 1 49 49 ARG HB2 H 1 1.856 0.003 . 2 . . . . A 49 ARG HB2 . 30310 1
557 . 1 1 49 49 ARG HB3 H 1 1.624 0.012 . 2 . . . . A 49 ARG HB3 . 30310 1
558 . 1 1 49 49 ARG HG2 H 1 1.552 0.000 . 2 . . . . A 49 ARG HG2 . 30310 1
559 . 1 1 49 49 ARG HG3 H 1 1.552 0.000 . 2 . . . . A 49 ARG HG3 . 30310 1
560 . 1 1 49 49 ARG HD2 H 1 3.014 0.017 . 2 . . . . A 49 ARG HD2 . 30310 1
561 . 1 1 49 49 ARG HD3 H 1 3.014 0.017 . 2 . . . . A 49 ARG HD3 . 30310 1
562 . 1 1 49 49 ARG HE H 1 7.947 0.001 . 1 . . . . A 49 ARG HE . 30310 1
563 . 1 1 49 49 ARG C C 13 174.991 0.000 . 1 . . . . A 49 ARG C . 30310 1
564 . 1 1 49 49 ARG CA C 13 57.536 0.036 . 1 . . . . A 49 ARG CA . 30310 1
565 . 1 1 49 49 ARG CB C 13 31.088 0.067 . 1 . . . . A 49 ARG CB . 30310 1
566 . 1 1 49 49 ARG N N 15 121.801 0.034 . 1 . . . . A 49 ARG N . 30310 1
567 . 1 1 49 49 ARG NE N 15 85.37 0.003 . 1 . . . . A 49 ARG NE . 30310 1
568 . 1 1 50 50 VAL H H 1 8.047 0.003 . 1 . . . . A 50 VAL H . 30310 1
569 . 1 1 50 50 VAL HA H 1 5.425 0.011 . 1 . . . . A 50 VAL HA . 30310 1
570 . 1 1 50 50 VAL HB H 1 1.717 0.008 . 1 . . . . A 50 VAL HB . 30310 1
571 . 1 1 50 50 VAL HG11 H 1 0.751 0.005 . 1 . . . . A 50 VAL HG11 . 30310 1
572 . 1 1 50 50 VAL HG12 H 1 0.751 0.005 . 1 . . . . A 50 VAL HG12 . 30310 1
573 . 1 1 50 50 VAL HG13 H 1 0.751 0.005 . 1 . . . . A 50 VAL HG13 . 30310 1
574 . 1 1 50 50 VAL HG21 H 1 0.853 0.005 . 1 . . . . A 50 VAL HG21 . 30310 1
575 . 1 1 50 50 VAL HG22 H 1 0.853 0.005 . 1 . . . . A 50 VAL HG22 . 30310 1
576 . 1 1 50 50 VAL HG23 H 1 0.853 0.005 . 1 . . . . A 50 VAL HG23 . 30310 1
577 . 1 1 50 50 VAL C C 13 175.105 0.000 . 1 . . . . A 50 VAL C . 30310 1
578 . 1 1 50 50 VAL CA C 13 59.901 0.024 . 1 . . . . A 50 VAL CA . 30310 1
579 . 1 1 50 50 VAL CB C 13 35.159 0.087 . 1 . . . . A 50 VAL CB . 30310 1
580 . 1 1 50 50 VAL CG1 C 13 22.347 0.047 . 1 . . . . A 50 VAL CG1 . 30310 1
581 . 1 1 50 50 VAL CG2 C 13 20.618 0.055 . 1 . . . . A 50 VAL CG2 . 30310 1
582 . 1 1 50 50 VAL N N 15 119.779 0.038 . 1 . . . . A 50 VAL N . 30310 1
583 . 1 1 51 51 GLU H H 1 8.980 0.005 . 1 . . . . A 51 GLU H . 30310 1
584 . 1 1 51 51 GLU HA H 1 4.664 0.008 . 1 . . . . A 51 GLU HA . 30310 1
585 . 1 1 51 51 GLU HB2 H 1 2.123 0.008 . 2 . . . . A 51 GLU HB2 . 30310 1
586 . 1 1 51 51 GLU HB3 H 1 2.007 0.006 . 2 . . . . A 51 GLU HB3 . 30310 1
587 . 1 1 51 51 GLU C C 13 174.809 0.000 . 1 . . . . A 51 GLU C . 30310 1
588 . 1 1 51 51 GLU CA C 13 54.490 0.040 . 1 . . . . A 51 GLU CA . 30310 1
589 . 1 1 51 51 GLU CB C 13 34.637 0.086 . 1 . . . . A 51 GLU CB . 30310 1
590 . 1 1 51 51 GLU N N 15 121.104 0.030 . 1 . . . . A 51 GLU N . 30310 1
591 . 1 1 52 52 CYS H H 1 9.097 0.004 . 1 . . . . A 52 CYS H . 30310 1
592 . 1 1 52 52 CYS HA H 1 4.682 0.008 . 1 . . . . A 52 CYS HA . 30310 1
593 . 1 1 52 52 CYS HB2 H 1 2.900 0.010 . 2 . . . . A 52 CYS HB2 . 30310 1
594 . 1 1 52 52 CYS HB3 H 1 2.521 0.009 . 2 . . . . A 52 CYS HB3 . 30310 1
595 . 1 1 52 52 CYS CA C 13 59.054 0.008 . 1 . . . . A 52 CYS CA . 30310 1
596 . 1 1 52 52 CYS CB C 13 28.333 0.054 . 1 . . . . A 52 CYS CB . 30310 1
597 . 1 1 52 52 CYS N N 15 121.640 0.026 . 1 . . . . A 52 CYS N . 30310 1
598 . 1 1 53 53 ARG H H 1 9.581 0.004 . 1 . . . . A 53 ARG H . 30310 1
599 . 1 1 53 53 ARG HA H 1 4.066 0.012 . 1 . . . . A 53 ARG HA . 30310 1
600 . 1 1 53 53 ARG HB2 H 1 1.827 0.000 . 2 . . . . A 53 ARG HB2 . 30310 1
601 . 1 1 53 53 ARG HB3 H 1 1.827 0.000 . 2 . . . . A 53 ARG HB3 . 30310 1
602 . 1 1 53 53 ARG C C 13 177.491 0.000 . 1 . . . . A 53 ARG C . 30310 1
603 . 1 1 53 53 ARG CA C 13 58.963 0.045 . 1 . . . . A 53 ARG CA . 30310 1
604 . 1 1 53 53 ARG CB C 13 29.837 0.052 . 1 . . . . A 53 ARG CB . 30310 1
605 . 1 1 53 53 ARG N N 15 130.399 0.048 . 1 . . . . A 53 ARG N . 30310 1
606 . 1 1 54 54 GLU H H 1 8.511 0.003 . 1 . . . . A 54 GLU H . 30310 1
607 . 1 1 54 54 GLU HA H 1 4.166 0.012 . 1 . . . . A 54 GLU HA . 30310 1
608 . 1 1 54 54 GLU HB2 H 1 2.045 0.007 . 2 . . . . A 54 GLU HB2 . 30310 1
609 . 1 1 54 54 GLU HB3 H 1 1.944 0.002 . 2 . . . . A 54 GLU HB3 . 30310 1
610 . 1 1 54 54 GLU HG2 H 1 2.354 0.007 . 2 . . . . A 54 GLU HG2 . 30310 1
611 . 1 1 54 54 GLU HG3 H 1 2.262 0.004 . 2 . . . . A 54 GLU HG3 . 30310 1
612 . 1 1 54 54 GLU C C 13 176.256 0.000 . 1 . . . . A 54 GLU C . 30310 1
613 . 1 1 54 54 GLU CA C 13 58.463 0.014 . 1 . . . . A 54 GLU CA . 30310 1
614 . 1 1 54 54 GLU CB C 13 30.032 0.123 . 1 . . . . A 54 GLU CB . 30310 1
615 . 1 1 54 54 GLU CG C 13 37.332 0.006 . 1 . . . . A 54 GLU CG . 30310 1
616 . 1 1 54 54 GLU N N 15 117.141 0.022 . 1 . . . . A 54 GLU N . 30310 1
617 . 1 1 55 55 LEU H H 1 7.328 0.007 . 1 . . . . A 55 LEU H . 30310 1
618 . 1 1 55 55 LEU HA H 1 4.438 0.014 . 1 . . . . A 55 LEU HA . 30310 1
619 . 1 1 55 55 LEU HB2 H 1 1.527 0.012 . 2 . . . . A 55 LEU HB2 . 30310 1
620 . 1 1 55 55 LEU HB3 H 1 1.527 0.012 . 2 . . . . A 55 LEU HB3 . 30310 1
621 . 1 1 55 55 LEU HG H 1 1.513 0.000 . 1 . . . . A 55 LEU HG . 30310 1
622 . 1 1 55 55 LEU HD11 H 1 0.777 0.008 . 1 . . . . A 55 LEU HD11 . 30310 1
623 . 1 1 55 55 LEU HD12 H 1 0.777 0.008 . 1 . . . . A 55 LEU HD12 . 30310 1
624 . 1 1 55 55 LEU HD13 H 1 0.777 0.008 . 1 . . . . A 55 LEU HD13 . 30310 1
625 . 1 1 55 55 LEU HD21 H 1 0.785 0.007 . 1 . . . . A 55 LEU HD21 . 30310 1
626 . 1 1 55 55 LEU HD22 H 1 0.785 0.007 . 1 . . . . A 55 LEU HD22 . 30310 1
627 . 1 1 55 55 LEU HD23 H 1 0.785 0.007 . 1 . . . . A 55 LEU HD23 . 30310 1
628 . 1 1 55 55 LEU C C 13 175.388 0.000 . 1 . . . . A 55 LEU C . 30310 1
629 . 1 1 55 55 LEU CA C 13 54.347 0.023 . 1 . . . . A 55 LEU CA . 30310 1
630 . 1 1 55 55 LEU CB C 13 43.562 0.099 . 1 . . . . A 55 LEU CB . 30310 1
631 . 1 1 55 55 LEU CG C 13 27.421 0.000 . 1 . . . . A 55 LEU CG . 30310 1
632 . 1 1 55 55 LEU CD1 C 13 26.119 0.031 . 1 . . . . A 55 LEU CD1 . 30310 1
633 . 1 1 55 55 LEU CD2 C 13 24.307 0.039 . 1 . . . . A 55 LEU CD2 . 30310 1
634 . 1 1 55 55 LEU N N 15 118.521 0.025 . 1 . . . . A 55 LEU N . 30310 1
635 . 1 1 56 56 ARG H H 1 7.825 0.004 . 1 . . . . A 56 ARG H . 30310 1
636 . 1 1 56 56 ARG HA H 1 4.699 0.013 . 1 . . . . A 56 ARG HA . 30310 1
637 . 1 1 56 56 ARG HB2 H 1 1.945 0.005 . 2 . . . . A 56 ARG HB2 . 30310 1
638 . 1 1 56 56 ARG HB3 H 1 1.785 0.003 . 2 . . . . A 56 ARG HB3 . 30310 1
639 . 1 1 56 56 ARG HG2 H 1 1.712 0.000 . 2 . . . . A 56 ARG HG2 . 30310 1
640 . 1 1 56 56 ARG HG3 H 1 1.712 0.000 . 2 . . . . A 56 ARG HG3 . 30310 1
641 . 1 1 56 56 ARG HD2 H 1 3.243 0.008 . 2 . . . . A 56 ARG HD2 . 30310 1
642 . 1 1 56 56 ARG HD3 H 1 3.243 0.008 . 2 . . . . A 56 ARG HD3 . 30310 1
643 . 1 1 56 56 ARG HE H 1 7.740 0.002 . 1 . . . . A 56 ARG HE . 30310 1
644 . 1 1 56 56 ARG CA C 13 53.663 0.067 . 1 . . . . A 56 ARG CA . 30310 1
645 . 1 1 56 56 ARG CB C 13 30.622 0.008 . 1 . . . . A 56 ARG CB . 30310 1
646 . 1 1 56 56 ARG N N 15 120.441 0.027 . 1 . . . . A 56 ARG N . 30310 1
647 . 1 1 56 56 ARG NE N 15 84.85 0.033 . 1 . . . . A 56 ARG NE . 30310 1
648 . 1 1 57 57 PRO HA H 1 4.421 0.006 . 1 . . . . A 57 PRO HA . 30310 1
649 . 1 1 57 57 PRO HB2 H 1 2.335 0.007 . 2 . . . . A 57 PRO HB2 . 30310 1
650 . 1 1 57 57 PRO HB3 H 1 1.952 0.008 . 2 . . . . A 57 PRO HB3 . 30310 1
651 . 1 1 57 57 PRO HG2 H 1 2.057 0.004 . 2 . . . . A 57 PRO HG2 . 30310 1
652 . 1 1 57 57 PRO HG3 H 1 2.057 0.004 . 2 . . . . A 57 PRO HG3 . 30310 1
653 . 1 1 57 57 PRO HD2 H 1 3.726 0.004 . 2 . . . . A 57 PRO HD2 . 30310 1
654 . 1 1 57 57 PRO HD3 H 1 3.726 0.004 . 2 . . . . A 57 PRO HD3 . 30310 1
655 . 1 1 57 57 PRO C C 13 176.984 0.000 . 1 . . . . A 57 PRO C . 30310 1
656 . 1 1 57 57 PRO CA C 13 64.055 0.074 . 1 . . . . A 57 PRO CA . 30310 1
657 . 1 1 57 57 PRO CB C 13 32.157 0.084 . 1 . . . . A 57 PRO CB . 30310 1
658 . 1 1 57 57 PRO CG C 13 27.528 0.048 . 1 . . . . A 57 PRO CG . 30310 1
659 . 1 1 57 57 PRO CD C 13 50.792 0.025 . 1 . . . . A 57 PRO CD . 30310 1
660 . 1 1 58 58 ASP H H 1 8.566 0.006 . 1 . . . . A 58 ASP H . 30310 1
661 . 1 1 58 58 ASP HA H 1 4.507 0.005 . 1 . . . . A 58 ASP HA . 30310 1
662 . 1 1 58 58 ASP HB2 H 1 2.658 0.007 . 2 . . . . A 58 ASP HB2 . 30310 1
663 . 1 1 58 58 ASP HB3 H 1 2.658 0.007 . 2 . . . . A 58 ASP HB3 . 30310 1
664 . 1 1 58 58 ASP C C 13 176.474 0.000 . 1 . . . . A 58 ASP C . 30310 1
665 . 1 1 58 58 ASP CA C 13 54.570 0.044 . 1 . . . . A 58 ASP CA . 30310 1
666 . 1 1 58 58 ASP CB C 13 40.510 0.053 . 1 . . . . A 58 ASP CB . 30310 1
667 . 1 1 58 58 ASP N N 15 118.460 0.019 . 1 . . . . A 58 ASP N . 30310 1
668 . 1 1 59 59 VAL H H 1 7.759 0.006 . 1 . . . . A 59 VAL H . 30310 1
669 . 1 1 59 59 VAL HA H 1 4.005 0.008 . 1 . . . . A 59 VAL HA . 30310 1
670 . 1 1 59 59 VAL HB H 1 1.971 0.007 . 1 . . . . A 59 VAL HB . 30310 1
671 . 1 1 59 59 VAL HG11 H 1 0.697 0.005 . 1 . . . . A 59 VAL HG11 . 30310 1
672 . 1 1 59 59 VAL HG12 H 1 0.697 0.005 . 1 . . . . A 59 VAL HG12 . 30310 1
673 . 1 1 59 59 VAL HG13 H 1 0.697 0.005 . 1 . . . . A 59 VAL HG13 . 30310 1
674 . 1 1 59 59 VAL HG21 H 1 0.784 0.006 . 1 . . . . A 59 VAL HG21 . 30310 1
675 . 1 1 59 59 VAL HG22 H 1 0.784 0.006 . 1 . . . . A 59 VAL HG22 . 30310 1
676 . 1 1 59 59 VAL HG23 H 1 0.784 0.006 . 1 . . . . A 59 VAL HG23 . 30310 1
677 . 1 1 59 59 VAL C C 13 176.167 0.000 . 1 . . . . A 59 VAL C . 30310 1
678 . 1 1 59 59 VAL CA C 13 62.861 0.032 . 1 . . . . A 59 VAL CA . 30310 1
679 . 1 1 59 59 VAL CB C 13 32.806 0.085 . 1 . . . . A 59 VAL CB . 30310 1
680 . 1 1 59 59 VAL CG1 C 13 21.150 0.034 . 1 . . . . A 59 VAL CG1 . 30310 1
681 . 1 1 59 59 VAL CG2 C 13 20.674 0.038 . 1 . . . . A 59 VAL CG2 . 30310 1
682 . 1 1 59 59 VAL N N 15 118.811 0.024 . 1 . . . . A 59 VAL N . 30310 1
683 . 1 1 60 60 PHE H H 1 8.185 0.006 . 1 . . . . A 60 PHE H . 30310 1
684 . 1 1 60 60 PHE HA H 1 4.566 0.011 . 1 . . . . A 60 PHE HA . 30310 1
685 . 1 1 60 60 PHE HB2 H 1 3.177 0.010 . 2 . . . . A 60 PHE HB2 . 30310 1
686 . 1 1 60 60 PHE HB3 H 1 2.987 0.005 . 2 . . . . A 60 PHE HB3 . 30310 1
687 . 1 1 60 60 PHE HD1 H 1 7.272 0.014 . 3 . . . . A 60 PHE HD1 . 30310 1
688 . 1 1 60 60 PHE HD2 H 1 7.272 0.014 . 3 . . . . A 60 PHE HD2 . 30310 1
689 . 1 1 60 60 PHE C C 13 176.441 0.000 . 1 . . . . A 60 PHE C . 30310 1
690 . 1 1 60 60 PHE CA C 13 58.456 0.036 . 1 . . . . A 60 PHE CA . 30310 1
691 . 1 1 60 60 PHE CB C 13 39.602 0.042 . 1 . . . . A 60 PHE CB . 30310 1
692 . 1 1 60 60 PHE N N 15 121.644 0.023 . 1 . . . . A 60 PHE N . 30310 1
693 . 1 1 61 61 GLY H H 1 8.278 0.004 . 1 . . . . A 61 GLY H . 30310 1
694 . 1 1 61 61 GLY HA2 H 1 3.892 0.004 . 2 . . . . A 61 GLY HA2 . 30310 1
695 . 1 1 61 61 GLY HA3 H 1 3.892 0.004 . 2 . . . . A 61 GLY HA3 . 30310 1
696 . 1 1 61 61 GLY C C 13 173.878 0.000 . 1 . . . . A 61 GLY C . 30310 1
697 . 1 1 61 61 GLY CA C 13 45.549 0.040 . 1 . . . . A 61 GLY CA . 30310 1
698 . 1 1 61 61 GLY N N 15 110.241 0.014 . 1 . . . . A 61 GLY N . 30310 1
699 . 1 1 62 62 ALA H H 1 8.106 0.002 . 1 . . . . A 62 ALA H . 30310 1
700 . 1 1 62 62 ALA HA H 1 4.288 0.009 . 1 . . . . A 62 ALA HA . 30310 1
701 . 1 1 62 62 ALA HB1 H 1 1.383 0.008 . 1 . . . . A 62 ALA HB1 . 30310 1
702 . 1 1 62 62 ALA HB2 H 1 1.383 0.008 . 1 . . . . A 62 ALA HB2 . 30310 1
703 . 1 1 62 62 ALA HB3 H 1 1.383 0.008 . 1 . . . . A 62 ALA HB3 . 30310 1
704 . 1 1 62 62 ALA C C 13 177.838 0.000 . 1 . . . . A 62 ALA C . 30310 1
705 . 1 1 62 62 ALA CA C 13 52.693 0.045 . 1 . . . . A 62 ALA CA . 30310 1
706 . 1 1 62 62 ALA CB C 13 19.363 0.057 . 1 . . . . A 62 ALA CB . 30310 1
707 . 1 1 62 62 ALA N N 15 123.447 0.032 . 1 . . . . A 62 ALA N . 30310 1
stop_
save_