###################################
# 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 52529
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name K27M
_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
2 '3D HNCACB' . . . 52529 1
3 '3D HNCO' . . . 52529 1
4 '3D 1H-15N TOCSY' . . . 52529 1
5 '3D 1H-15N NOESY' . . . 52529 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 52529 1
2 $software_2 . . 52529 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 1 1 MET H H 1 8.876 0.000 . 1 . . . . . 1 MET H . 52529 1
2 . 1 . 1 1 1 MET C C 13 170.461 0.000 . 1 . . . . . 1 MET C . 52529 1
3 . 1 . 1 1 1 MET CB C 13 33.197 0.000 . 1 . . . . . 1 MET CB . 52529 1
4 . 1 . 1 1 1 MET N N 15 123.436 0.000 . 1 . . . . . 1 MET N . 52529 1
5 . 1 . 1 2 2 GLN H H 1 8.879 0.005 . 1 . . . . . 2 GLN H . 52529 1
6 . 1 . 1 2 2 GLN HA H 1 5.148 0.000 . 1 . . . . . 2 GLN HA . 52529 1
7 . 1 . 1 2 2 GLN HB2 H 1 1.799 0.000 . 2 . . . . . 2 GLN HB2 . 52529 1
8 . 1 . 1 2 2 GLN HB3 H 1 1.799 0.000 . 2 . . . . . 2 GLN HB3 . 52529 1
9 . 1 . 1 2 2 GLN HG2 H 1 2.165 0.000 . 2 . . . . . 2 GLN HG2 . 52529 1
10 . 1 . 1 2 2 GLN HG3 H 1 2.165 0.000 . 2 . . . . . 2 GLN HG3 . 52529 1
11 . 1 . 1 2 2 GLN C C 13 175.747 0.000 . 1 . . . . . 2 GLN C . 52529 1
12 . 1 . 1 2 2 GLN CA C 13 55.006 0.000 . 1 . . . . . 2 GLN CA . 52529 1
13 . 1 . 1 2 2 GLN CB C 13 30.505 0.000 . 1 . . . . . 2 GLN CB . 52529 1
14 . 1 . 1 2 2 GLN N N 15 123.408 0.007 . 1 . . . . . 2 GLN N . 52529 1
15 . 1 . 1 3 3 ILE H H 1 8.338 0.006 . 1 . . . . . 3 ILE H . 52529 1
16 . 1 . 1 3 3 ILE HA H 1 4.120 0.000 . 1 . . . . . 3 ILE HA . 52529 1
17 . 1 . 1 3 3 ILE HB H 1 1.680 0.000 . 1 . . . . . 3 ILE HB . 52529 1
18 . 1 . 1 3 3 ILE HD11 H 1 0.545 0.000 . 1 . . . . . 3 ILE MD . 52529 1
19 . 1 . 1 3 3 ILE HD12 H 1 0.545 0.000 . 1 . . . . . 3 ILE MD . 52529 1
20 . 1 . 1 3 3 ILE HD13 H 1 0.545 0.000 . 1 . . . . . 3 ILE MD . 52529 1
21 . 1 . 1 3 3 ILE C C 13 172.333 0.000 . 1 . . . . . 3 ILE C . 52529 1
22 . 1 . 1 3 3 ILE CA C 13 59.812 0.000 . 1 . . . . . 3 ILE CA . 52529 1
23 . 1 . 1 3 3 ILE CB C 13 42.030 0.000 . 1 . . . . . 3 ILE CB . 52529 1
24 . 1 . 1 3 3 ILE N N 15 115.645 0.014 . 1 . . . . . 3 ILE N . 52529 1
25 . 1 . 1 4 4 PHE H H 1 8.605 0.006 . 1 . . . . . 4 PHE H . 52529 1
26 . 1 . 1 4 4 PHE HA H 1 5.640 0.000 . 1 . . . . . 4 PHE HA . 52529 1
27 . 1 . 1 4 4 PHE HB2 H 1 2.981 0.000 . 2 . . . . . 4 PHE HB2 . 52529 1
28 . 1 . 1 4 4 PHE HB3 H 1 2.829 0.000 . 2 . . . . . 4 PHE HB3 . 52529 1
29 . 1 . 1 4 4 PHE C C 13 175.195 0.000 . 1 . . . . . 4 PHE C . 52529 1
30 . 1 . 1 4 4 PHE CA C 13 55.040 0.000 . 1 . . . . . 4 PHE CA . 52529 1
31 . 1 . 1 4 4 PHE CB C 13 41.250 0.000 . 1 . . . . . 4 PHE CB . 52529 1
32 . 1 . 1 4 4 PHE N N 15 118.780 0.013 . 1 . . . . . 4 PHE N . 52529 1
33 . 1 . 1 5 5 VAL H H 1 9.189 0.005 . 1 . . . . . 5 VAL H . 52529 1
34 . 1 . 1 5 5 VAL HA H 1 4.781 0.000 . 1 . . . . . 5 VAL HA . 52529 1
35 . 1 . 1 5 5 VAL HB H 1 1.738 0.000 . 1 . . . . . 5 VAL HB . 52529 1
36 . 1 . 1 5 5 VAL HG11 H 1 0.623 0.000 . 2 . . . . . 5 VAL MG1 . 52529 1
37 . 1 . 1 5 5 VAL HG12 H 1 0.623 0.000 . 2 . . . . . 5 VAL MG1 . 52529 1
38 . 1 . 1 5 5 VAL HG13 H 1 0.623 0.000 . 2 . . . . . 5 VAL MG1 . 52529 1
39 . 1 . 1 5 5 VAL HG21 H 1 0.623 0.000 . 2 . . . . . 5 VAL MG2 . 52529 1
40 . 1 . 1 5 5 VAL HG22 H 1 0.623 0.000 . 2 . . . . . 5 VAL MG2 . 52529 1
41 . 1 . 1 5 5 VAL HG23 H 1 0.623 0.000 . 2 . . . . . 5 VAL MG2 . 52529 1
42 . 1 . 1 5 5 VAL C C 13 174.711 0.000 . 1 . . . . . 5 VAL C . 52529 1
43 . 1 . 1 5 5 VAL CA C 13 60.335 0.000 . 1 . . . . . 5 VAL CA . 52529 1
44 . 1 . 1 5 5 VAL CB C 13 34.805 0.000 . 1 . . . . . 5 VAL CB . 52529 1
45 . 1 . 1 5 5 VAL N N 15 120.827 0.004 . 1 . . . . . 5 VAL N . 52529 1
46 . 1 . 1 6 6 LYS H H 1 8.808 0.005 . 1 . . . . . 6 LYS H . 52529 1
47 . 1 . 1 6 6 LYS HA H 1 5.144 0.000 . 1 . . . . . 6 LYS HA . 52529 1
48 . 1 . 1 6 6 LYS HE2 H 1 2.819 0.000 . 2 . . . . . 6 LYS HE2 . 52529 1
49 . 1 . 1 6 6 LYS HE3 H 1 2.819 0.000 . 2 . . . . . 6 LYS HE3 . 52529 1
50 . 1 . 1 6 6 LYS C C 13 176.990 0.000 . 1 . . . . . 6 LYS C . 52529 1
51 . 1 . 1 6 6 LYS CA C 13 54.680 0.000 . 1 . . . . . 6 LYS CA . 52529 1
52 . 1 . 1 6 6 LYS CB C 13 33.450 0.000 . 1 . . . . . 6 LYS CB . 52529 1
53 . 1 . 1 6 6 LYS N N 15 127.869 0.003 . 1 . . . . . 6 LYS N . 52529 1
54 . 1 . 1 7 7 THR H H 1 8.895 0.005 . 1 . . . . . 7 THR H . 52529 1
55 . 1 . 1 7 7 THR HA H 1 4.693 0.000 . 1 . . . . . 7 THR HA . 52529 1
56 . 1 . 1 7 7 THR HG21 H 1 1.083 0.000 . 1 . . . . . 7 THR MG . 52529 1
57 . 1 . 1 7 7 THR HG22 H 1 1.083 0.000 . 1 . . . . . 7 THR MG . 52529 1
58 . 1 . 1 7 7 THR HG23 H 1 1.083 0.000 . 1 . . . . . 7 THR MG . 52529 1
59 . 1 . 1 7 7 THR C C 13 176.966 0.000 . 1 . . . . . 7 THR C . 52529 1
60 . 1 . 1 7 7 THR CA C 13 60.574 0.000 . 1 . . . . . 7 THR CA . 52529 1
61 . 1 . 1 7 7 THR CB C 13 70.879 0.000 . 1 . . . . . 7 THR CB . 52529 1
62 . 1 . 1 7 7 THR N N 15 116.042 0.001 . 1 . . . . . 7 THR N . 52529 1
63 . 1 . 1 8 8 LEU H H 1 9.709 0.006 . 1 . . . . . 8 LEU H . 52529 1
64 . 1 . 1 8 8 LEU HA H 1 4.187 0.000 . 1 . . . . . 8 LEU HA . 52529 1
65 . 1 . 1 8 8 LEU HB2 H 1 1.788 0.000 . 2 . . . . . 8 LEU HB2 . 52529 1
66 . 1 . 1 8 8 LEU HB3 H 1 1.788 0.000 . 2 . . . . . 8 LEU HB3 . 52529 1
67 . 1 . 1 8 8 LEU HD11 H 1 0.863 0.000 . 2 . . . . . 8 LEU MD1 . 52529 1
68 . 1 . 1 8 8 LEU HD12 H 1 0.863 0.000 . 2 . . . . . 8 LEU MD1 . 52529 1
69 . 1 . 1 8 8 LEU HD13 H 1 0.863 0.000 . 2 . . . . . 8 LEU MD1 . 52529 1
70 . 1 . 1 8 8 LEU HD21 H 1 0.863 0.000 . 2 . . . . . 8 LEU MD2 . 52529 1
71 . 1 . 1 8 8 LEU HD22 H 1 0.863 0.000 . 2 . . . . . 8 LEU MD2 . 52529 1
72 . 1 . 1 8 8 LEU HD23 H 1 0.863 0.000 . 2 . . . . . 8 LEU MD2 . 52529 1
73 . 1 . 1 8 8 LEU C C 13 179.010 0.000 . 1 . . . . . 8 LEU C . 52529 1
74 . 1 . 1 8 8 LEU CA C 13 57.501 0.000 . 1 . . . . . 8 LEU CA . 52529 1
75 . 1 . 1 8 8 LEU CB C 13 42.076 0.000 . 1 . . . . . 8 LEU CB . 52529 1
76 . 1 . 1 8 8 LEU N N 15 121.651 0.003 . 1 . . . . . 8 LEU N . 52529 1
77 . 1 . 1 9 9 THR H H 1 7.490 0.004 . 1 . . . . . 9 THR H . 52529 1
78 . 1 . 1 9 9 THR HA H 1 4.367 0.000 . 1 . . . . . 9 THR HA . 52529 1
79 . 1 . 1 9 9 THR HG21 H 1 1.165 0.000 . 1 . . . . . 9 THR MG . 52529 1
80 . 1 . 1 9 9 THR HG22 H 1 1.165 0.000 . 1 . . . . . 9 THR MG . 52529 1
81 . 1 . 1 9 9 THR HG23 H 1 1.165 0.000 . 1 . . . . . 9 THR MG . 52529 1
82 . 1 . 1 9 9 THR C C 13 175.337 0.000 . 1 . . . . . 9 THR C . 52529 1
83 . 1 . 1 9 9 THR CA C 13 61.139 0.000 . 1 . . . . . 9 THR CA . 52529 1
84 . 1 . 1 9 9 THR CB C 13 69.104 0.000 . 1 . . . . . 9 THR CB . 52529 1
85 . 1 . 1 9 9 THR N N 15 105.151 0.019 . 1 . . . . . 9 THR N . 52529 1
86 . 1 . 1 10 10 GLY H H 1 7.793 0.005 . 1 . . . . . 10 GLY H . 52529 1
87 . 1 . 1 10 10 GLY HA2 H 1 4.241 0.000 . 2 . . . . . 10 GLY HA2 . 52529 1
88 . 1 . 1 10 10 GLY HA3 H 1 3.548 0.000 . 2 . . . . . 10 GLY HA3 . 52529 1
89 . 1 . 1 10 10 GLY C C 13 173.927 0.000 . 1 . . . . . 10 GLY C . 52529 1
90 . 1 . 1 10 10 GLY CA C 13 45.643 0.000 . 1 . . . . . 10 GLY CA . 52529 1
91 . 1 . 1 10 10 GLY N N 15 109.577 0.006 . 1 . . . . . 10 GLY N . 52529 1
92 . 1 . 1 11 11 LYS H H 1 7.275 0.005 . 1 . . . . . 11 LYS H . 52529 1
93 . 1 . 1 11 11 LYS HA H 1 4.328 0.000 . 1 . . . . . 11 LYS HA . 52529 1
94 . 1 . 1 11 11 LYS HB2 H 1 1.737 0.000 . 2 . . . . . 11 LYS HB2 . 52529 1
95 . 1 . 1 11 11 LYS HB3 H 1 1.737 0.000 . 2 . . . . . 11 LYS HB3 . 52529 1
96 . 1 . 1 11 11 LYS HG2 H 1 1.257 0.000 . 2 . . . . . 11 LYS HG2 . 52529 1
97 . 1 . 1 11 11 LYS HG3 H 1 1.257 0.000 . 2 . . . . . 11 LYS HG3 . 52529 1
98 . 1 . 1 11 11 LYS HD2 H 1 1.637 0.000 . 2 . . . . . 11 LYS HD2 . 52529 1
99 . 1 . 1 11 11 LYS HD3 H 1 1.637 0.000 . 2 . . . . . 11 LYS HD3 . 52529 1
100 . 1 . 1 11 11 LYS HE2 H 1 2.832 0.000 . 2 . . . . . 11 LYS HE2 . 52529 1
101 . 1 . 1 11 11 LYS HE3 H 1 2.832 0.000 . 2 . . . . . 11 LYS HE3 . 52529 1
102 . 1 . 1 11 11 LYS C C 13 175.714 0.000 . 1 . . . . . 11 LYS C . 52529 1
103 . 1 . 1 11 11 LYS CA C 13 56.112 0.000 . 1 . . . . . 11 LYS CA . 52529 1
104 . 1 . 1 11 11 LYS CB C 13 33.729 0.000 . 1 . . . . . 11 LYS CB . 52529 1
105 . 1 . 1 11 11 LYS N N 15 121.508 0.001 . 1 . . . . . 11 LYS N . 52529 1
106 . 1 . 1 12 12 THR H H 1 8.623 0.006 . 1 . . . . . 12 THR H . 52529 1
107 . 1 . 1 12 12 THR HA H 1 4.975 0.000 . 1 . . . . . 12 THR HA . 52529 1
108 . 1 . 1 12 12 THR HG21 H 1 1.048 0.000 . 1 . . . . . 12 THR MG . 52529 1
109 . 1 . 1 12 12 THR HG22 H 1 1.048 0.000 . 1 . . . . . 12 THR MG . 52529 1
110 . 1 . 1 12 12 THR HG23 H 1 1.048 0.000 . 1 . . . . . 12 THR MG . 52529 1
111 . 1 . 1 12 12 THR C C 13 174.505 0.000 . 1 . . . . . 12 THR C . 52529 1
112 . 1 . 1 12 12 THR CA C 13 62.356 0.000 . 1 . . . . . 12 THR CA . 52529 1
113 . 1 . 1 12 12 THR CB C 13 69.512 0.000 . 1 . . . . . 12 THR CB . 52529 1
114 . 1 . 1 12 12 THR N N 15 120.441 0.055 . 1 . . . . . 12 THR N . 52529 1
115 . 1 . 1 13 13 ILE H H 1 9.482 0.006 . 1 . . . . . 13 ILE H . 52529 1
116 . 1 . 1 13 13 ILE HA H 1 4.551 0.000 . 1 . . . . . 13 ILE HA . 52529 1
117 . 1 . 1 13 13 ILE HB H 1 1.840 0.000 . 1 . . . . . 13 ILE HB . 52529 1
118 . 1 . 1 13 13 ILE HG12 H 1 1.330 0.000 . 2 . . . . . 13 ILE HG12 . 52529 1
119 . 1 . 1 13 13 ILE HG13 H 1 1.102 0.000 . 2 . . . . . 13 ILE HG13 . 52529 1
120 . 1 . 1 13 13 ILE HG21 H 1 0.805 0.000 . 1 . . . . . 13 ILE MG . 52529 1
121 . 1 . 1 13 13 ILE HG22 H 1 0.805 0.000 . 1 . . . . . 13 ILE MG . 52529 1
122 . 1 . 1 13 13 ILE HG23 H 1 0.805 0.000 . 1 . . . . . 13 ILE MG . 52529 1
123 . 1 . 1 13 13 ILE HD11 H 1 0.658 0.000 . 1 . . . . . 13 ILE MD . 52529 1
124 . 1 . 1 13 13 ILE HD12 H 1 0.658 0.000 . 1 . . . . . 13 ILE MD . 52529 1
125 . 1 . 1 13 13 ILE HD13 H 1 0.658 0.000 . 1 . . . . . 13 ILE MD . 52529 1
126 . 1 . 1 13 13 ILE C C 13 174.944 0.000 . 1 . . . . . 13 ILE C . 52529 1
127 . 1 . 1 13 13 ILE CA C 13 59.892 0.000 . 1 . . . . . 13 ILE CA . 52529 1
128 . 1 . 1 13 13 ILE CB C 13 40.448 0.000 . 1 . . . . . 13 ILE CB . 52529 1
129 . 1 . 1 13 13 ILE N N 15 126.402 0.004 . 1 . . . . . 13 ILE N . 52529 1
130 . 1 . 1 14 14 THR H H 1 8.607 0.002 . 1 . . . . . 14 THR H . 52529 1
131 . 1 . 1 14 14 THR C C 13 173.578 0.000 . 1 . . . . . 14 THR C . 52529 1
132 . 1 . 1 14 14 THR CA C 13 62.081 0.000 . 1 . . . . . 14 THR CA . 52529 1
133 . 1 . 1 14 14 THR CB C 13 69.586 0.000 . 1 . . . . . 14 THR CB . 52529 1
134 . 1 . 1 14 14 THR N N 15 120.115 0.122 . 1 . . . . . 14 THR N . 52529 1
135 . 1 . 1 15 15 LEU H H 1 8.705 0.006 . 1 . . . . . 15 LEU H . 52529 1
136 . 1 . 1 15 15 LEU HA H 1 4.647 0.000 . 1 . . . . . 15 LEU HA . 52529 1
137 . 1 . 1 15 15 LEU HB2 H 1 1.358 0.000 . 2 . . . . . 15 LEU HB2 . 52529 1
138 . 1 . 1 15 15 LEU HB3 H 1 1.238 0.000 . 2 . . . . . 15 LEU HB3 . 52529 1
139 . 1 . 1 15 15 LEU HD11 H 1 0.676 0.000 . 2 . . . . . 15 LEU MD1 . 52529 1
140 . 1 . 1 15 15 LEU HD12 H 1 0.676 0.000 . 2 . . . . . 15 LEU MD1 . 52529 1
141 . 1 . 1 15 15 LEU HD13 H 1 0.676 0.000 . 2 . . . . . 15 LEU MD1 . 52529 1
142 . 1 . 1 15 15 LEU HD21 H 1 0.676 0.000 . 2 . . . . . 15 LEU MD2 . 52529 1
143 . 1 . 1 15 15 LEU HD22 H 1 0.676 0.000 . 2 . . . . . 15 LEU MD2 . 52529 1
144 . 1 . 1 15 15 LEU HD23 H 1 0.676 0.000 . 2 . . . . . 15 LEU MD2 . 52529 1
145 . 1 . 1 15 15 LEU C C 13 174.270 0.000 . 1 . . . . . 15 LEU C . 52529 1
146 . 1 . 1 15 15 LEU CA C 13 53.048 0.000 . 1 . . . . . 15 LEU CA . 52529 1
147 . 1 . 1 15 15 LEU CB C 13 47.001 0.000 . 1 . . . . . 15 LEU CB . 52529 1
148 . 1 . 1 15 15 LEU N N 15 125.783 0.008 . 1 . . . . . 15 LEU N . 52529 1
149 . 1 . 1 16 16 GLU H H 1 8.122 0.005 . 1 . . . . . 16 GLU H . 52529 1
150 . 1 . 1 16 16 GLU HA H 1 4.823 0.000 . 1 . . . . . 16 GLU HA . 52529 1
151 . 1 . 1 16 16 GLU HB2 H 1 1.768 0.000 . 2 . . . . . 16 GLU HB2 . 52529 1
152 . 1 . 1 16 16 GLU HB3 H 1 1.844 0.000 . 2 . . . . . 16 GLU HB3 . 52529 1
153 . 1 . 1 16 16 GLU HG2 H 1 2.155 0.000 . 2 . . . . . 16 GLU HG2 . 52529 1
154 . 1 . 1 16 16 GLU HG3 H 1 2.011 0.000 . 2 . . . . . 16 GLU HG3 . 52529 1
155 . 1 . 1 16 16 GLU C C 13 175.773 0.000 . 1 . . . . . 16 GLU C . 52529 1
156 . 1 . 1 16 16 GLU CA C 13 54.816 0.000 . 1 . . . . . 16 GLU CA . 52529 1
157 . 1 . 1 16 16 GLU CB C 13 29.672 0.000 . 1 . . . . . 16 GLU CB . 52529 1
158 . 1 . 1 16 16 GLU N N 15 122.993 0.009 . 1 . . . . . 16 GLU N . 52529 1
159 . 1 . 1 17 17 VAL H H 1 8.896 0.004 . 1 . . . . . 17 VAL H . 52529 1
160 . 1 . 1 17 17 VAL HA H 1 4.620 0.000 . 1 . . . . . 17 VAL HA . 52529 1
161 . 1 . 1 17 17 VAL HB H 1 2.295 0.000 . 1 . . . . . 17 VAL HB . 52529 1
162 . 1 . 1 17 17 VAL HG11 H 1 0.665 0.000 . 2 . . . . . 17 VAL MG1 . 52529 1
163 . 1 . 1 17 17 VAL HG12 H 1 0.665 0.000 . 2 . . . . . 17 VAL MG1 . 52529 1
164 . 1 . 1 17 17 VAL HG13 H 1 0.665 0.000 . 2 . . . . . 17 VAL MG1 . 52529 1
165 . 1 . 1 17 17 VAL HG21 H 1 0.339 0.000 . 2 . . . . . 17 VAL MG2 . 52529 1
166 . 1 . 1 17 17 VAL HG22 H 1 0.339 0.000 . 2 . . . . . 17 VAL MG2 . 52529 1
167 . 1 . 1 17 17 VAL HG23 H 1 0.339 0.000 . 2 . . . . . 17 VAL MG2 . 52529 1
168 . 1 . 1 17 17 VAL C C 13 173.951 0.000 . 1 . . . . . 17 VAL C . 52529 1
169 . 1 . 1 17 17 VAL CA C 13 58.547 0.000 . 1 . . . . . 17 VAL CA . 52529 1
170 . 1 . 1 17 17 VAL CB C 13 36.215 0.000 . 1 . . . . . 17 VAL CB . 52529 1
171 . 1 . 1 17 17 VAL N N 15 117.924 0.008 . 1 . . . . . 17 VAL N . 52529 1
172 . 1 . 1 18 18 GLU H H 1 8.565 0.006 . 1 . . . . . 18 GLU H . 52529 1
173 . 1 . 1 18 18 GLU HA H 1 4.975 0.000 . 1 . . . . . 18 GLU HA . 52529 1
174 . 1 . 1 18 18 GLU CA C 13 52.897 0.000 . 1 . . . . . 18 GLU CA . 52529 1
175 . 1 . 1 18 18 GLU CB C 13 30.848 0.000 . 1 . . . . . 18 GLU CB . 52529 1
176 . 1 . 1 18 18 GLU N N 15 119.500 0.012 . 1 . . . . . 18 GLU N . 52529 1
177 . 1 . 1 19 19 PRO C C 13 175.160 0.000 . 1 . . . . . 19 PRO C . 52529 1
178 . 1 . 1 19 19 PRO CA C 13 65.665 0.000 . 1 . . . . . 19 PRO CA . 52529 1
179 . 1 . 1 19 19 PRO CB C 13 31.895 0.000 . 1 . . . . . 19 PRO CB . 52529 1
180 . 1 . 1 20 20 SER H H 1 6.988 0.006 . 1 . . . . . 20 SER H . 52529 1
181 . 1 . 1 20 20 SER HA H 1 4.275 0.000 . 1 . . . . . 20 SER HA . 52529 1
182 . 1 . 1 20 20 SER HB2 H 1 4.112 0.000 . 2 . . . . . 20 SER HB2 . 52529 1
183 . 1 . 1 20 20 SER HB3 H 1 3.715 0.000 . 2 . . . . . 20 SER HB3 . 52529 1
184 . 1 . 1 20 20 SER C C 13 174.275 0.000 . 1 . . . . . 20 SER C . 52529 1
185 . 1 . 1 20 20 SER CA C 13 57.421 0.000 . 1 . . . . . 20 SER CA . 52529 1
186 . 1 . 1 20 20 SER CB C 13 63.441 0.000 . 1 . . . . . 20 SER CB . 52529 1
187 . 1 . 1 20 20 SER N N 15 103.665 0.020 . 1 . . . . . 20 SER N . 52529 1
188 . 1 . 1 21 21 ASP H H 1 7.977 0.006 . 1 . . . . . 21 ASP H . 52529 1
189 . 1 . 1 21 21 ASP HA H 1 4.611 0.000 . 1 . . . . . 21 ASP HA . 52529 1
190 . 1 . 1 21 21 ASP HB2 H 1 2.819 0.000 . 2 . . . . . 21 ASP HB2 . 52529 1
191 . 1 . 1 21 21 ASP HB3 H 1 2.446 0.000 . 2 . . . . . 21 ASP HB3 . 52529 1
192 . 1 . 1 21 21 ASP C C 13 176.222 0.000 . 1 . . . . . 21 ASP C . 52529 1
193 . 1 . 1 21 21 ASP CA C 13 55.789 0.000 . 1 . . . . . 21 ASP CA . 52529 1
194 . 1 . 1 21 21 ASP CB C 13 40.928 0.000 . 1 . . . . . 21 ASP CB . 52529 1
195 . 1 . 1 21 21 ASP N N 15 124.148 0.007 . 1 . . . . . 21 ASP N . 52529 1
196 . 1 . 1 22 22 THR H H 1 7.925 0.005 . 1 . . . . . 22 THR H . 52529 1
197 . 1 . 1 22 22 THR HA H 1 4.845 0.000 . 1 . . . . . 22 THR HA . 52529 1
198 . 1 . 1 22 22 THR C C 13 176.577 0.000 . 1 . . . . . 22 THR C . 52529 1
199 . 1 . 1 22 22 THR CA C 13 59.902 0.000 . 1 . . . . . 22 THR CA . 52529 1
200 . 1 . 1 22 22 THR CB C 13 71.267 0.000 . 1 . . . . . 22 THR CB . 52529 1
201 . 1 . 1 22 22 THR N N 15 109.328 0.018 . 1 . . . . . 22 THR N . 52529 1
202 . 1 . 1 23 23 ILE H H 1 8.482 0.005 . 1 . . . . . 23 ILE H . 52529 1
203 . 1 . 1 23 23 ILE HA H 1 3.482 0.000 . 1 . . . . . 23 ILE HA . 52529 1
204 . 1 . 1 23 23 ILE HG21 H 1 0.751 0.000 . 1 . . . . . 23 ILE MG . 52529 1
205 . 1 . 1 23 23 ILE HG22 H 1 0.751 0.000 . 1 . . . . . 23 ILE MG . 52529 1
206 . 1 . 1 23 23 ILE HG23 H 1 0.751 0.000 . 1 . . . . . 23 ILE MG . 52529 1
207 . 1 . 1 23 23 ILE C C 13 178.625 0.000 . 1 . . . . . 23 ILE C . 52529 1
208 . 1 . 1 23 23 ILE CA C 13 62.567 0.000 . 1 . . . . . 23 ILE CA . 52529 1
209 . 1 . 1 23 23 ILE CB C 13 34.799 0.000 . 1 . . . . . 23 ILE CB . 52529 1
210 . 1 . 1 23 23 ILE N N 15 121.093 0.010 . 1 . . . . . 23 ILE N . 52529 1
211 . 1 . 1 24 24 GLU H H 1 9.909 0.005 . 1 . . . . . 24 GLU H . 52529 1
212 . 1 . 1 24 24 GLU C C 13 179.171 0.000 . 1 . . . . . 24 GLU C . 52529 1
213 . 1 . 1 24 24 GLU CA C 13 60.140 0.000 . 1 . . . . . 24 GLU CA . 52529 1
214 . 1 . 1 24 24 GLU CB C 13 28.642 0.000 . 1 . . . . . 24 GLU CB . 52529 1
215 . 1 . 1 24 24 GLU N N 15 120.064 0.020 . 1 . . . . . 24 GLU N . 52529 1
216 . 1 . 1 25 25 ASN H H 1 7.794 0.004 . 1 . . . . . 25 ASN H . 52529 1
217 . 1 . 1 25 25 ASN HA H 1 4.475 0.000 . 1 . . . . . 25 ASN HA . 52529 1
218 . 1 . 1 25 25 ASN HB2 H 1 3.072 0.000 . 2 . . . . . 25 ASN HB2 . 52529 1
219 . 1 . 1 25 25 ASN HB3 H 1 2.824 0.000 . 2 . . . . . 25 ASN HB3 . 52529 1
220 . 1 . 1 25 25 ASN C C 13 178.156 0.000 . 1 . . . . . 25 ASN C . 52529 1
221 . 1 . 1 25 25 ASN CA C 13 56.336 0.000 . 1 . . . . . 25 ASN CA . 52529 1
222 . 1 . 1 25 25 ASN CB C 13 38.586 0.000 . 1 . . . . . 25 ASN CB . 52529 1
223 . 1 . 1 25 25 ASN N N 15 121.751 0.008 . 1 . . . . . 25 ASN N . 52529 1
224 . 1 . 1 26 26 VAL H H 1 8.164 0.006 . 1 . . . . . 26 VAL H . 52529 1
225 . 1 . 1 26 26 VAL HA H 1 3.373 0.000 . 1 . . . . . 26 VAL HA . 52529 1
226 . 1 . 1 26 26 VAL HB H 1 2.198 0.000 . 1 . . . . . 26 VAL HB . 52529 1
227 . 1 . 1 26 26 VAL HG11 H 1 0.641 0.000 . 2 . . . . . 26 VAL MG1 . 52529 1
228 . 1 . 1 26 26 VAL HG12 H 1 0.641 0.000 . 2 . . . . . 26 VAL MG1 . 52529 1
229 . 1 . 1 26 26 VAL HG13 H 1 0.641 0.000 . 2 . . . . . 26 VAL MG1 . 52529 1
230 . 1 . 1 26 26 VAL HG21 H 1 0.945 0.000 . 2 . . . . . 26 VAL MG2 . 52529 1
231 . 1 . 1 26 26 VAL HG22 H 1 0.945 0.000 . 2 . . . . . 26 VAL MG2 . 52529 1
232 . 1 . 1 26 26 VAL HG23 H 1 0.945 0.000 . 2 . . . . . 26 VAL MG2 . 52529 1
233 . 1 . 1 26 26 VAL C C 13 178.077 0.000 . 1 . . . . . 26 VAL C . 52529 1
234 . 1 . 1 26 26 VAL CA C 13 67.602 0.000 . 1 . . . . . 26 VAL CA . 52529 1
235 . 1 . 1 26 26 VAL CB C 13 30.898 0.000 . 1 . . . . . 26 VAL CB . 52529 1
236 . 1 . 1 26 26 VAL N N 15 122.332 0.014 . 1 . . . . . 26 VAL N . 52529 1
237 . 1 . 1 27 27 MET H H 1 8.746 0.005 . 1 . . . . . 27 MET H . 52529 1
238 . 1 . 1 27 27 MET HA H 1 4.362 0.000 . 1 . . . . . 27 MET HA . 52529 1
239 . 1 . 1 27 27 MET HB2 H 1 2.094 0.000 . 2 . . . . . 27 MET HB2 . 52529 1
240 . 1 . 1 27 27 MET HB3 H 1 2.094 0.000 . 2 . . . . . 27 MET HB3 . 52529 1
241 . 1 . 1 27 27 MET HG2 H 1 2.637 0.000 . 2 . . . . . 27 MET HG2 . 52529 1
242 . 1 . 1 27 27 MET HG3 H 1 2.637 0.000 . 2 . . . . . 27 MET HG3 . 52529 1
243 . 1 . 1 27 27 MET C C 13 179.206 0.000 . 1 . . . . . 27 MET C . 52529 1
244 . 1 . 1 27 27 MET CA C 13 57.277 0.000 . 1 . . . . . 27 MET CA . 52529 1
245 . 1 . 1 27 27 MET CB C 13 30.938 0.000 . 1 . . . . . 27 MET CB . 52529 1
246 . 1 . 1 27 27 MET N N 15 118.237 0.005 . 1 . . . . . 27 MET N . 52529 1
247 . 1 . 1 28 28 ALA H H 1 7.978 0.006 . 1 . . . . . 28 ALA H . 52529 1
248 . 1 . 1 28 28 ALA HA H 1 4.111 0.000 . 1 . . . . . 28 ALA HA . 52529 1
249 . 1 . 1 28 28 ALA HB1 H 1 1.534 0.000 . 1 . . . . . 28 ALA MB . 52529 1
250 . 1 . 1 28 28 ALA HB2 H 1 1.534 0.000 . 1 . . . . . 28 ALA MB . 52529 1
251 . 1 . 1 28 28 ALA HB3 H 1 1.534 0.000 . 1 . . . . . 28 ALA MB . 52529 1
252 . 1 . 1 28 28 ALA C C 13 180.188 0.000 . 1 . . . . . 28 ALA C . 52529 1
253 . 1 . 1 28 28 ALA CA C 13 55.290 0.000 . 1 . . . . . 28 ALA CA . 52529 1
254 . 1 . 1 28 28 ALA CB C 13 17.742 0.000 . 1 . . . . . 28 ALA CB . 52529 1
255 . 1 . 1 28 28 ALA N N 15 123.078 0.005 . 1 . . . . . 28 ALA N . 52529 1
256 . 1 . 1 29 29 LYS H H 1 7.683 0.005 . 1 . . . . . 29 LYS H . 52529 1
257 . 1 . 1 29 29 LYS HA H 1 4.122 0.000 . 1 . . . . . 29 LYS HA . 52529 1
258 . 1 . 1 29 29 LYS HB2 H 1 2.080 0.000 . 2 . . . . . 29 LYS HB2 . 52529 1
259 . 1 . 1 29 29 LYS HB3 H 1 2.080 0.000 . 2 . . . . . 29 LYS HB3 . 52529 1
260 . 1 . 1 29 29 LYS HG2 H 1 1.775 0.000 . 2 . . . . . 29 LYS HG2 . 52529 1
261 . 1 . 1 29 29 LYS HG3 H 1 1.775 0.000 . 2 . . . . . 29 LYS HG3 . 52529 1
262 . 1 . 1 29 29 LYS HD2 H 1 1.473 0.000 . 2 . . . . . 29 LYS HD2 . 52529 1
263 . 1 . 1 29 29 LYS HD3 H 1 1.473 0.000 . 2 . . . . . 29 LYS HD3 . 52529 1
264 . 1 . 1 29 29 LYS HE2 H 1 2.992 0.000 . 2 . . . . . 29 LYS HE2 . 52529 1
265 . 1 . 1 29 29 LYS HE3 H 1 2.992 0.000 . 2 . . . . . 29 LYS HE3 . 52529 1
266 . 1 . 1 29 29 LYS C C 13 179.939 0.000 . 1 . . . . . 29 LYS C . 52529 1
267 . 1 . 1 29 29 LYS CA C 13 59.822 0.000 . 1 . . . . . 29 LYS CA . 52529 1
268 . 1 . 1 29 29 LYS CB C 13 33.070 0.000 . 1 . . . . . 29 LYS CB . 52529 1
269 . 1 . 1 29 29 LYS N N 15 119.270 0.015 . 1 . . . . . 29 LYS N . 52529 1
270 . 1 . 1 30 30 ILE H H 1 8.116 0.005 . 1 . . . . . 30 ILE H . 52529 1
271 . 1 . 1 30 30 ILE HA H 1 3.423 0.000 . 1 . . . . . 30 ILE HA . 52529 1
272 . 1 . 1 30 30 ILE HB H 1 2.114 0.000 . 1 . . . . . 30 ILE HB . 52529 1
273 . 1 . 1 30 30 ILE HG21 H 1 0.744 0.000 . 1 . . . . . 30 ILE MG . 52529 1
274 . 1 . 1 30 30 ILE HG22 H 1 0.744 0.000 . 1 . . . . . 30 ILE MG . 52529 1
275 . 1 . 1 30 30 ILE HG23 H 1 0.744 0.000 . 1 . . . . . 30 ILE MG . 52529 1
276 . 1 . 1 30 30 ILE C C 13 177.773 0.000 . 1 . . . . . 30 ILE C . 52529 1
277 . 1 . 1 30 30 ILE CA C 13 65.813 0.000 . 1 . . . . . 30 ILE CA . 52529 1
278 . 1 . 1 30 30 ILE CB C 13 37.631 0.000 . 1 . . . . . 30 ILE CB . 52529 1
279 . 1 . 1 30 30 ILE N N 15 121.013 0.022 . 1 . . . . . 30 ILE N . 52529 1
280 . 1 . 1 31 31 GLN H H 1 8.620 0.005 . 1 . . . . . 31 GLN H . 52529 1
281 . 1 . 1 31 31 GLN HA H 1 3.821 0.000 . 1 . . . . . 31 GLN HA . 52529 1
282 . 1 . 1 31 31 GLN C C 13 178.745 0.000 . 1 . . . . . 31 GLN C . 52529 1
283 . 1 . 1 31 31 GLN CA C 13 60.107 0.000 . 1 . . . . . 31 GLN CA . 52529 1
284 . 1 . 1 31 31 GLN CB C 13 27.930 0.000 . 1 . . . . . 31 GLN CB . 52529 1
285 . 1 . 1 31 31 GLN N N 15 121.782 0.036 . 1 . . . . . 31 GLN N . 52529 1
286 . 1 . 1 32 32 ASP H H 1 7.947 0.005 . 1 . . . . . 32 ASP H . 52529 1
287 . 1 . 1 32 32 ASP HA H 1 4.325 0.000 . 1 . . . . . 32 ASP HA . 52529 1
288 . 1 . 1 32 32 ASP HB2 H 1 2.718 0.000 . 2 . . . . . 32 ASP HB2 . 52529 1
289 . 1 . 1 32 32 ASP HB3 H 1 2.718 0.000 . 2 . . . . . 32 ASP HB3 . 52529 1
290 . 1 . 1 32 32 ASP C C 13 177.477 0.000 . 1 . . . . . 32 ASP C . 52529 1
291 . 1 . 1 32 32 ASP CA C 13 57.067 0.000 . 1 . . . . . 32 ASP CA . 52529 1
292 . 1 . 1 32 32 ASP CB C 13 41.347 0.000 . 1 . . . . . 32 ASP CB . 52529 1
293 . 1 . 1 32 32 ASP N N 15 118.856 0.004 . 1 . . . . . 32 ASP N . 52529 1
294 . 1 . 1 33 33 LYS H H 1 7.679 0.004 . 1 . . . . . 33 LYS H . 52529 1
295 . 1 . 1 33 33 LYS HA H 1 4.166 0.000 . 1 . . . . . 33 LYS HA . 52529 1
296 . 1 . 1 33 33 LYS HB2 H 1 1.866 0.000 . 2 . . . . . 33 LYS HB2 . 52529 1
297 . 1 . 1 33 33 LYS HB3 H 1 1.866 0.000 . 2 . . . . . 33 LYS HB3 . 52529 1
298 . 1 . 1 33 33 LYS HG2 H 1 1.575 0.000 . 2 . . . . . 33 LYS HG2 . 52529 1
299 . 1 . 1 33 33 LYS HG3 H 1 1.575 0.000 . 2 . . . . . 33 LYS HG3 . 52529 1
300 . 1 . 1 33 33 LYS HE2 H 1 3.063 0.000 . 2 . . . . . 33 LYS HE2 . 52529 1
301 . 1 . 1 33 33 LYS HE3 H 1 3.063 0.000 . 2 . . . . . 33 LYS HE3 . 52529 1
302 . 1 . 1 33 33 LYS C C 13 177.977 0.000 . 1 . . . . . 33 LYS C . 52529 1
303 . 1 . 1 33 33 LYS CA C 13 58.339 0.000 . 1 . . . . . 33 LYS CA . 52529 1
304 . 1 . 1 33 33 LYS CB C 13 33.617 0.000 . 1 . . . . . 33 LYS CB . 52529 1
305 . 1 . 1 33 33 LYS N N 15 116.869 0.008 . 1 . . . . . 33 LYS N . 52529 1
306 . 1 . 1 34 34 GLU H H 1 8.473 0.006 . 1 . . . . . 34 GLU H . 52529 1
307 . 1 . 1 34 34 GLU HA H 1 4.461 0.000 . 1 . . . . . 34 GLU HA . 52529 1
308 . 1 . 1 34 34 GLU HB2 H 1 1.705 0.000 . 2 . . . . . 34 GLU HB2 . 52529 1
309 . 1 . 1 34 34 GLU HB3 H 1 1.705 0.000 . 2 . . . . . 34 GLU HB3 . 52529 1
310 . 1 . 1 34 34 GLU HG2 H 1 2.103 0.000 . 2 . . . . . 34 GLU HG2 . 52529 1
311 . 1 . 1 34 34 GLU HG3 H 1 2.103 0.000 . 2 . . . . . 34 GLU HG3 . 52529 1
312 . 1 . 1 34 34 GLU C C 13 177.241 0.000 . 1 . . . . . 34 GLU C . 52529 1
313 . 1 . 1 34 34 GLU CA C 13 55.092 0.000 . 1 . . . . . 34 GLU CA . 52529 1
314 . 1 . 1 34 34 GLU CB C 13 32.788 0.000 . 1 . . . . . 34 GLU CB . 52529 1
315 . 1 . 1 34 34 GLU N N 15 114.535 0.012 . 1 . . . . . 34 GLU N . 52529 1
316 . 1 . 1 35 35 GLY H H 1 8.124 0.006 . 1 . . . . . 35 GLY H . 52529 1
317 . 1 . 1 35 35 GLY HA2 H 1 3.981 0.000 . 2 . . . . . 35 GLY HA2 . 52529 1
318 . 1 . 1 35 35 GLY HA3 H 1 3.878 0.000 . 2 . . . . . 35 GLY HA3 . 52529 1
319 . 1 . 1 35 35 GLY C C 13 173.241 0.000 . 1 . . . . . 35 GLY C . 52529 1
320 . 1 . 1 35 35 GLY CA C 13 46.228 0.000 . 1 . . . . . 35 GLY CA . 52529 1
321 . 1 . 1 35 35 GLY N N 15 109.789 0.012 . 1 . . . . . 35 GLY N . 52529 1
322 . 1 . 1 36 36 ILE H H 1 6.679 0.006 . 1 . . . . . 36 ILE H . 52529 1
323 . 1 . 1 36 36 ILE HA H 1 4.280 0.000 . 1 . . . . . 36 ILE HA . 52529 1
324 . 1 . 1 36 36 ILE HB H 1 1.425 0.000 . 1 . . . . . 36 ILE HB . 52529 1
325 . 1 . 1 36 36 ILE HG12 H 1 0.972 0.000 . 2 . . . . . 36 ILE HG12 . 52529 1
326 . 1 . 1 36 36 ILE HG13 H 1 0.972 0.000 . 2 . . . . . 36 ILE HG13 . 52529 1
327 . 1 . 1 36 36 ILE HG21 H 1 0.825 0.000 . 1 . . . . . 36 ILE MG . 52529 1
328 . 1 . 1 36 36 ILE HG22 H 1 0.825 0.000 . 1 . . . . . 36 ILE MG . 52529 1
329 . 1 . 1 36 36 ILE HG23 H 1 0.825 0.000 . 1 . . . . . 36 ILE MG . 52529 1
330 . 1 . 1 36 36 ILE HD11 H 1 0.708 0.000 . 1 . . . . . 36 ILE MD . 52529 1
331 . 1 . 1 36 36 ILE HD12 H 1 0.708 0.000 . 1 . . . . . 36 ILE MD . 52529 1
332 . 1 . 1 36 36 ILE HD13 H 1 0.708 0.000 . 1 . . . . . 36 ILE MD . 52529 1
333 . 1 . 1 36 36 ILE CA C 13 58.460 0.000 . 1 . . . . . 36 ILE CA . 52529 1
334 . 1 . 1 36 36 ILE CB C 13 40.397 0.000 . 1 . . . . . 36 ILE CB . 52529 1
335 . 1 . 1 36 36 ILE N N 15 120.588 0.008 . 1 . . . . . 36 ILE N . 52529 1
336 . 1 . 1 38 38 PRO C C 13 176.713 0.000 . 1 . . . . . 38 PRO C . 52529 1
337 . 1 . 1 38 38 PRO CA C 13 64.109 0.000 . 1 . . . . . 38 PRO CA . 52529 1
338 . 1 . 1 38 38 PRO CB C 13 32.246 0.000 . 1 . . . . . 38 PRO CB . 52529 1
339 . 1 . 1 39 39 ASP H H 1 8.372 0.005 . 1 . . . . . 39 ASP H . 52529 1
340 . 1 . 1 39 39 ASP HA H 1 4.349 0.000 . 1 . . . . . 39 ASP HA . 52529 1
341 . 1 . 1 39 39 ASP HB2 H 1 2.684 0.000 . 2 . . . . . 39 ASP HB2 . 52529 1
342 . 1 . 1 39 39 ASP HB3 H 1 2.684 0.000 . 2 . . . . . 39 ASP HB3 . 52529 1
343 . 1 . 1 39 39 ASP C C 13 175.918 0.000 . 1 . . . . . 39 ASP C . 52529 1
344 . 1 . 1 39 39 ASP CA C 13 55.157 0.000 . 1 . . . . . 39 ASP CA . 52529 1
345 . 1 . 1 39 39 ASP CB C 13 40.080 0.000 . 1 . . . . . 39 ASP CB . 52529 1
346 . 1 . 1 39 39 ASP N N 15 113.999 0.015 . 1 . . . . . 39 ASP N . 52529 1
347 . 1 . 1 40 40 GLN H H 1 7.859 0.006 . 1 . . . . . 40 GLN H . 52529 1
348 . 1 . 1 40 40 GLN HA H 1 4.372 0.000 . 1 . . . . . 40 GLN HA . 52529 1
349 . 1 . 1 40 40 GLN HB2 H 1 1.840 0.000 . 2 . . . . . 40 GLN HB2 . 52529 1
350 . 1 . 1 40 40 GLN HB3 H 1 2.411 0.000 . 2 . . . . . 40 GLN HB3 . 52529 1
351 . 1 . 1 40 40 GLN HG2 H 1 2.265 0.000 . 2 . . . . . 40 GLN HG2 . 52529 1
352 . 1 . 1 40 40 GLN HG3 H 1 2.265 0.000 . 2 . . . . . 40 GLN HG3 . 52529 1
353 . 1 . 1 40 40 GLN C C 13 176.388 0.000 . 1 . . . . . 40 GLN C . 52529 1
354 . 1 . 1 40 40 GLN CA C 13 56.634 0.000 . 1 . . . . . 40 GLN CA . 52529 1
355 . 1 . 1 40 40 GLN CB C 13 31.400 0.000 . 1 . . . . . 40 GLN CB . 52529 1
356 . 1 . 1 40 40 GLN N N 15 116.731 0.004 . 1 . . . . . 40 GLN N . 52529 1
357 . 1 . 1 41 41 GLN H H 1 8.097 0.005 . 1 . . . . . 41 GLN H . 52529 1
358 . 1 . 1 41 41 GLN C C 13 173.999 0.000 . 1 . . . . . 41 GLN C . 52529 1
359 . 1 . 1 41 41 GLN CA C 13 55.399 0.000 . 1 . . . . . 41 GLN CA . 52529 1
360 . 1 . 1 41 41 GLN CB C 13 32.584 0.000 . 1 . . . . . 41 GLN CB . 52529 1
361 . 1 . 1 41 41 GLN N N 15 119.172 0.013 . 1 . . . . . 41 GLN N . 52529 1
362 . 1 . 1 42 42 ARG H H 1 8.862 0.006 . 1 . . . . . 42 ARG H . 52529 1
363 . 1 . 1 42 42 ARG HA H 1 4.620 0.000 . 1 . . . . . 42 ARG HA . 52529 1
364 . 1 . 1 42 42 ARG HB2 H 1 1.682 0.000 . 2 . . . . . 42 ARG HB2 . 52529 1
365 . 1 . 1 42 42 ARG HB3 H 1 1.682 0.000 . 2 . . . . . 42 ARG HB3 . 52529 1
366 . 1 . 1 42 42 ARG HG2 H 1 1.384 0.000 . 2 . . . . . 42 ARG HG2 . 52529 1
367 . 1 . 1 42 42 ARG HG3 H 1 1.384 0.000 . 2 . . . . . 42 ARG HG3 . 52529 1
368 . 1 . 1 42 42 ARG HD2 H 1 2.943 0.000 . 2 . . . . . 42 ARG HD2 . 52529 1
369 . 1 . 1 42 42 ARG HD3 H 1 2.943 0.000 . 2 . . . . . 42 ARG HD3 . 52529 1
370 . 1 . 1 42 42 ARG C C 13 173.515 0.000 . 1 . . . . . 42 ARG C . 52529 1
371 . 1 . 1 42 42 ARG CA C 13 54.746 0.000 . 1 . . . . . 42 ARG CA . 52529 1
372 . 1 . 1 42 42 ARG CB C 13 33.099 0.000 . 1 . . . . . 42 ARG CB . 52529 1
373 . 1 . 1 42 42 ARG N N 15 118.415 0.019 . 1 . . . . . 42 ARG N . 52529 1
374 . 1 . 1 43 43 LEU H H 1 8.846 0.005 . 1 . . . . . 43 LEU H . 52529 1
375 . 1 . 1 43 43 LEU HA H 1 5.108 0.000 . 1 . . . . . 43 LEU HA . 52529 1
376 . 1 . 1 43 43 LEU HB2 H 1 1.621 0.000 . 2 . . . . . 43 LEU HB2 . 52529 1
377 . 1 . 1 43 43 LEU HB3 H 1 1.082 0.000 . 2 . . . . . 43 LEU HB3 . 52529 1
378 . 1 . 1 43 43 LEU HD11 H 1 0.653 0.000 . 2 . . . . . 43 LEU MD1 . 52529 1
379 . 1 . 1 43 43 LEU HD12 H 1 0.653 0.000 . 2 . . . . . 43 LEU MD1 . 52529 1
380 . 1 . 1 43 43 LEU HD13 H 1 0.653 0.000 . 2 . . . . . 43 LEU MD1 . 52529 1
381 . 1 . 1 43 43 LEU HD21 H 1 0.653 0.000 . 2 . . . . . 43 LEU MD2 . 52529 1
382 . 1 . 1 43 43 LEU HD22 H 1 0.653 0.000 . 2 . . . . . 43 LEU MD2 . 52529 1
383 . 1 . 1 43 43 LEU HD23 H 1 0.653 0.000 . 2 . . . . . 43 LEU MD2 . 52529 1
384 . 1 . 1 43 43 LEU C C 13 176.149 0.000 . 1 . . . . . 43 LEU C . 52529 1
385 . 1 . 1 43 43 LEU CA C 13 54.497 0.000 . 1 . . . . . 43 LEU CA . 52529 1
386 . 1 . 1 43 43 LEU CB C 13 45.934 0.000 . 1 . . . . . 43 LEU CB . 52529 1
387 . 1 . 1 43 43 LEU N N 15 121.721 0.009 . 1 . . . . . 43 LEU N . 52529 1
388 . 1 . 1 44 44 ILE H H 1 9.066 0.005 . 1 . . . . . 44 ILE H . 52529 1
389 . 1 . 1 44 44 ILE HA H 1 4.887 0.000 . 1 . . . . . 44 ILE HA . 52529 1
390 . 1 . 1 44 44 ILE HB H 1 1.564 0.000 . 1 . . . . . 44 ILE HB . 52529 1
391 . 1 . 1 44 44 ILE HG12 H 1 1.286 0.000 . 2 . . . . . 44 ILE HG12 . 52529 1
392 . 1 . 1 44 44 ILE HG13 H 1 1.105 0.000 . 2 . . . . . 44 ILE HG13 . 52529 1
393 . 1 . 1 44 44 ILE HD11 H 1 0.629 0.000 . 1 . . . . . 44 ILE MD . 52529 1
394 . 1 . 1 44 44 ILE HD12 H 1 0.629 0.000 . 1 . . . . . 44 ILE MD . 52529 1
395 . 1 . 1 44 44 ILE HD13 H 1 0.629 0.000 . 1 . . . . . 44 ILE MD . 52529 1
396 . 1 . 1 44 44 ILE CA C 13 58.635 0.000 . 1 . . . . . 44 ILE CA . 52529 1
397 . 1 . 1 44 44 ILE CB C 13 40.847 0.000 . 1 . . . . . 44 ILE CB . 52529 1
398 . 1 . 1 44 44 ILE N N 15 119.207 0.011 . 1 . . . . . 44 ILE N . 52529 1
399 . 1 . 1 45 45 PHE H H 1 8.567 0.009 . 1 . . . . . 45 PHE H . 52529 1
400 . 1 . 1 45 45 PHE C C 13 174.657 0.000 . 1 . . . . . 45 PHE C . 52529 1
401 . 1 . 1 45 45 PHE CA C 13 56.274 0.000 . 1 . . . . . 45 PHE CA . 52529 1
402 . 1 . 1 45 45 PHE CB C 13 43.455 0.000 . 1 . . . . . 45 PHE CB . 52529 1
403 . 1 . 1 45 45 PHE N N 15 122.734 0.023 . 1 . . . . . 45 PHE N . 52529 1
404 . 1 . 1 46 46 ALA H H 1 9.086 0.005 . 1 . . . . . 46 ALA H . 52529 1
405 . 1 . 1 46 46 ALA HA H 1 3.652 0.000 . 1 . . . . . 46 ALA HA . 52529 1
406 . 1 . 1 46 46 ALA HB1 H 1 0.773 0.000 . 1 . . . . . 46 ALA MB . 52529 1
407 . 1 . 1 46 46 ALA HB2 H 1 0.773 0.000 . 1 . . . . . 46 ALA MB . 52529 1
408 . 1 . 1 46 46 ALA HB3 H 1 0.773 0.000 . 1 . . . . . 46 ALA MB . 52529 1
409 . 1 . 1 46 46 ALA C C 13 177.216 0.000 . 1 . . . . . 46 ALA C . 52529 1
410 . 1 . 1 46 46 ALA CA C 13 52.734 0.000 . 1 . . . . . 46 ALA CA . 52529 1
411 . 1 . 1 46 46 ALA CB C 13 16.300 0.000 . 1 . . . . . 46 ALA CB . 52529 1
412 . 1 . 1 46 46 ALA N N 15 133.186 0.002 . 1 . . . . . 46 ALA N . 52529 1
413 . 1 . 1 47 47 GLY H H 1 7.992 0.006 . 1 . . . . . 47 GLY H . 52529 1
414 . 1 . 1 47 47 GLY HA2 H 1 4.050 0.000 . 2 . . . . . 47 GLY HA2 . 52529 1
415 . 1 . 1 47 47 GLY HA3 H 1 3.392 0.000 . 2 . . . . . 47 GLY HA3 . 52529 1
416 . 1 . 1 47 47 GLY C C 13 173.611 0.000 . 1 . . . . . 47 GLY C . 52529 1
417 . 1 . 1 47 47 GLY CA C 13 45.538 0.000 . 1 . . . . . 47 GLY CA . 52529 1
418 . 1 . 1 47 47 GLY N N 15 102.504 0.033 . 1 . . . . . 47 GLY N . 52529 1
419 . 1 . 1 48 48 LYS H H 1 7.965 0.005 . 1 . . . . . 48 LYS H . 52529 1
420 . 1 . 1 48 48 LYS HA H 1 4.505 0.000 . 1 . . . . . 48 LYS HA . 52529 1
421 . 1 . 1 48 48 LYS HB2 H 1 1.825 0.000 . 2 . . . . . 48 LYS HB2 . 52529 1
422 . 1 . 1 48 48 LYS HB3 H 1 1.825 0.000 . 2 . . . . . 48 LYS HB3 . 52529 1
423 . 1 . 1 48 48 LYS HG2 H 1 1.446 0.000 . 2 . . . . . 48 LYS HG2 . 52529 1
424 . 1 . 1 48 48 LYS HG3 H 1 1.446 0.000 . 2 . . . . . 48 LYS HG3 . 52529 1
425 . 1 . 1 48 48 LYS HE2 H 1 3.103 0.000 . 2 . . . . . 48 LYS HE2 . 52529 1
426 . 1 . 1 48 48 LYS HE3 H 1 3.103 0.000 . 2 . . . . . 48 LYS HE3 . 52529 1
427 . 1 . 1 48 48 LYS CA C 13 54.803 0.000 . 1 . . . . . 48 LYS CA . 52529 1
428 . 1 . 1 48 48 LYS CB C 13 34.196 0.000 . 1 . . . . . 48 LYS CB . 52529 1
429 . 1 . 1 48 48 LYS N N 15 122.106 0.006 . 1 . . . . . 48 LYS N . 52529 1
430 . 1 . 1 49 49 GLN H H 1 8.568 0.001 . 1 . . . . . 49 GLN H . 52529 1
431 . 1 . 1 49 49 GLN C C 13 175.309 0.000 . 1 . . . . . 49 GLN C . 52529 1
432 . 1 . 1 49 49 GLN CA C 13 56.274 0.000 . 1 . . . . . 49 GLN CA . 52529 1
433 . 1 . 1 49 49 GLN CB C 13 28.984 0.000 . 1 . . . . . 49 GLN CB . 52529 1
434 . 1 . 1 49 49 GLN N N 15 122.765 0.008 . 1 . . . . . 49 GLN N . 52529 1
435 . 1 . 1 50 50 LEU H H 1 8.070 0.006 . 1 . . . . . 50 LEU H . 52529 1
436 . 1 . 1 50 50 LEU HA H 1 4.038 0.000 . 1 . . . . . 50 LEU HA . 52529 1
437 . 1 . 1 50 50 LEU HB2 H 1 1.503 0.000 . 2 . . . . . 50 LEU HB2 . 52529 1
438 . 1 . 1 50 50 LEU HB3 H 1 0.941 0.000 . 2 . . . . . 50 LEU HB3 . 52529 1
439 . 1 . 1 50 50 LEU HD11 H 1 0.445 0.000 . 2 . . . . . 50 LEU MD1 . 52529 1
440 . 1 . 1 50 50 LEU HD12 H 1 0.445 0.000 . 2 . . . . . 50 LEU MD1 . 52529 1
441 . 1 . 1 50 50 LEU HD13 H 1 0.445 0.000 . 2 . . . . . 50 LEU MD1 . 52529 1
442 . 1 . 1 50 50 LEU HD21 H 1 -0.225 0.000 . 2 . . . . . 50 LEU MD2 . 52529 1
443 . 1 . 1 50 50 LEU HD22 H 1 -0.225 0.000 . 2 . . . . . 50 LEU MD2 . 52529 1
444 . 1 . 1 50 50 LEU HD23 H 1 -0.225 0.000 . 2 . . . . . 50 LEU MD2 . 52529 1
445 . 1 . 1 50 50 LEU C C 13 176.895 0.000 . 1 . . . . . 50 LEU C . 52529 1
446 . 1 . 1 50 50 LEU CA C 13 55.034 0.000 . 1 . . . . . 50 LEU CA . 52529 1
447 . 1 . 1 50 50 LEU CB C 13 40.796 0.000 . 1 . . . . . 50 LEU CB . 52529 1
448 . 1 . 1 50 50 LEU N N 15 124.782 0.022 . 1 . . . . . 50 LEU N . 52529 1
449 . 1 . 1 51 51 GLU H H 1 8.414 0.006 . 1 . . . . . 51 GLU H . 52529 1
450 . 1 . 1 51 51 GLU HA H 1 4.376 0.000 . 1 . . . . . 51 GLU HA . 52529 1
451 . 1 . 1 51 51 GLU HB2 H 1 1.893 0.000 . 2 . . . . . 51 GLU HB2 . 52529 1
452 . 1 . 1 51 51 GLU HB3 H 1 1.893 0.000 . 2 . . . . . 51 GLU HB3 . 52529 1
453 . 1 . 1 51 51 GLU HG2 H 1 2.296 0.000 . 2 . . . . . 51 GLU HG2 . 52529 1
454 . 1 . 1 51 51 GLU HG3 H 1 2.296 0.000 . 2 . . . . . 51 GLU HG3 . 52529 1
455 . 1 . 1 51 51 GLU C C 13 175.052 0.000 . 1 . . . . . 51 GLU C . 52529 1
456 . 1 . 1 51 51 GLU CA C 13 56.364 0.000 . 1 . . . . . 51 GLU CA . 52529 1
457 . 1 . 1 51 51 GLU CB C 13 31.765 0.000 . 1 . . . . . 51 GLU CB . 52529 1
458 . 1 . 1 51 51 GLU N N 15 124.311 0.010 . 1 . . . . . 51 GLU N . 52529 1
459 . 1 . 1 52 52 ASP H H 1 8.162 0.006 . 1 . . . . . 52 ASP H . 52529 1
460 . 1 . 1 52 52 ASP HA H 1 4.280 0.000 . 1 . . . . . 52 ASP HA . 52529 1
461 . 1 . 1 52 52 ASP HB2 H 1 2.526 0.000 . 2 . . . . . 52 ASP HB2 . 52529 1
462 . 1 . 1 52 52 ASP HB3 H 1 2.526 0.000 . 2 . . . . . 52 ASP HB3 . 52529 1
463 . 1 . 1 52 52 ASP CA C 13 56.506 0.000 . 1 . . . . . 52 ASP CA . 52529 1
464 . 1 . 1 52 52 ASP CB C 13 40.886 0.000 . 1 . . . . . 52 ASP CB . 52529 1
465 . 1 . 1 52 52 ASP N N 15 119.758 0.007 . 1 . . . . . 52 ASP N . 52529 1
466 . 1 . 1 53 53 GLY C C 13 174.806 0.000 . 1 . . . . . 53 GLY C . 52529 1
467 . 1 . 1 53 53 GLY CA C 13 45.442 0.000 . 1 . . . . . 53 GLY CA . 52529 1
468 . 1 . 1 54 54 ARG H H 1 7.389 0.005 . 1 . . . . . 54 ARG H . 52529 1
469 . 1 . 1 54 54 ARG HA H 1 4.640 0.000 . 1 . . . . . 54 ARG HA . 52529 1
470 . 1 . 1 54 54 ARG HB2 H 1 2.196 0.000 . 2 . . . . . 54 ARG HB2 . 52529 1
471 . 1 . 1 54 54 ARG HB3 H 1 2.077 0.000 . 2 . . . . . 54 ARG HB3 . 52529 1
472 . 1 . 1 54 54 ARG HG2 H 1 1.765 0.000 . 2 . . . . . 54 ARG HG2 . 52529 1
473 . 1 . 1 54 54 ARG HG3 H 1 1.566 0.000 . 2 . . . . . 54 ARG HG3 . 52529 1
474 . 1 . 1 54 54 ARG HD2 H 1 3.061 0.000 . 2 . . . . . 54 ARG HD2 . 52529 1
475 . 1 . 1 54 54 ARG HD3 H 1 3.061 0.000 . 2 . . . . . 54 ARG HD3 . 52529 1
476 . 1 . 1 54 54 ARG C C 13 175.105 0.000 . 1 . . . . . 54 ARG C . 52529 1
477 . 1 . 1 54 54 ARG CA C 13 54.615 0.000 . 1 . . . . . 54 ARG CA . 52529 1
478 . 1 . 1 54 54 ARG CB C 13 32.567 0.000 . 1 . . . . . 54 ARG CB . 52529 1
479 . 1 . 1 54 54 ARG N N 15 119.328 0.011 . 1 . . . . . 54 ARG N . 52529 1
480 . 1 . 1 55 55 THR H H 1 8.793 0.006 . 1 . . . . . 55 THR H . 52529 1
481 . 1 . 1 55 55 THR HA H 1 5.182 0.000 . 1 . . . . . 55 THR HA . 52529 1
482 . 1 . 1 55 55 THR HB H 1 4.451 0.000 . 1 . . . . . 55 THR HB . 52529 1
483 . 1 . 1 55 55 THR HG21 H 1 1.044 0.000 . 1 . . . . . 55 THR MG . 52529 1
484 . 1 . 1 55 55 THR HG22 H 1 1.044 0.000 . 1 . . . . . 55 THR MG . 52529 1
485 . 1 . 1 55 55 THR HG23 H 1 1.044 0.000 . 1 . . . . . 55 THR MG . 52529 1
486 . 1 . 1 55 55 THR C C 13 176.462 0.000 . 1 . . . . . 55 THR C . 52529 1
487 . 1 . 1 55 55 THR CA C 13 59.952 0.000 . 1 . . . . . 55 THR CA . 52529 1
488 . 1 . 1 55 55 THR CB C 13 72.308 0.000 . 1 . . . . . 55 THR CB . 52529 1
489 . 1 . 1 55 55 THR N N 15 108.859 0.015 . 1 . . . . . 55 THR N . 52529 1
490 . 1 . 1 56 56 LEU H H 1 8.022 0.005 . 1 . . . . . 56 LEU H . 52529 1
491 . 1 . 1 56 56 LEU HA H 1 4.004 0.000 . 1 . . . . . 56 LEU HA . 52529 1
492 . 1 . 1 56 56 LEU HB2 H 1 2.050 0.000 . 2 . . . . . 56 LEU HB2 . 52529 1
493 . 1 . 1 56 56 LEU HB3 H 1 2.050 0.000 . 2 . . . . . 56 LEU HB3 . 52529 1
494 . 1 . 1 56 56 LEU C C 13 180.727 0.000 . 1 . . . . . 56 LEU C . 52529 1
495 . 1 . 1 56 56 LEU CA C 13 59.108 0.000 . 1 . . . . . 56 LEU CA . 52529 1
496 . 1 . 1 56 56 LEU CB C 13 40.132 0.000 . 1 . . . . . 56 LEU CB . 52529 1
497 . 1 . 1 56 56 LEU N N 15 118.037 0.011 . 1 . . . . . 56 LEU N . 52529 1
498 . 1 . 1 57 57 SER H H 1 8.491 0.005 . 1 . . . . . 57 SER H . 52529 1
499 . 1 . 1 57 57 SER HA H 1 4.180 0.000 . 1 . . . . . 57 SER HA . 52529 1
500 . 1 . 1 57 57 SER HB2 H 1 3.782 0.000 . 2 . . . . . 57 SER HB2 . 52529 1
501 . 1 . 1 57 57 SER HB3 H 1 3.685 0.000 . 2 . . . . . 57 SER HB3 . 52529 1
502 . 1 . 1 57 57 SER C C 13 178.133 0.000 . 1 . . . . . 57 SER C . 52529 1
503 . 1 . 1 57 57 SER CA C 13 60.534 0.000 . 1 . . . . . 57 SER CA . 52529 1
504 . 1 . 1 57 57 SER CB C 13 62.579 0.000 . 1 . . . . . 57 SER CB . 52529 1
505 . 1 . 1 57 57 SER N N 15 113.529 0.008 . 1 . . . . . 57 SER N . 52529 1
506 . 1 . 1 58 58 ASP H H 1 7.888 0.005 . 1 . . . . . 58 ASP H . 52529 1
507 . 1 . 1 58 58 ASP HA H 1 4.220 0.000 . 1 . . . . . 58 ASP HA . 52529 1
508 . 1 . 1 58 58 ASP HB2 H 1 2.931 0.000 . 2 . . . . . 58 ASP HB2 . 52529 1
509 . 1 . 1 58 58 ASP HB3 H 1 2.931 0.000 . 2 . . . . . 58 ASP HB3 . 52529 1
510 . 1 . 1 58 58 ASP C C 13 177.215 0.000 . 1 . . . . . 58 ASP C . 52529 1
511 . 1 . 1 58 58 ASP CA C 13 57.442 0.000 . 1 . . . . . 58 ASP CA . 52529 1
512 . 1 . 1 58 58 ASP CB C 13 40.234 0.000 . 1 . . . . . 58 ASP CB . 52529 1
513 . 1 . 1 58 58 ASP N N 15 124.559 0.005 . 1 . . . . . 58 ASP N . 52529 1
514 . 1 . 1 59 59 TYR H H 1 7.235 0.005 . 1 . . . . . 59 TYR H . 52529 1
515 . 1 . 1 59 59 TYR HA H 1 4.570 0.000 . 1 . . . . . 59 TYR HA . 52529 1
516 . 1 . 1 59 59 TYR HB2 H 1 2.469 0.000 . 2 . . . . . 59 TYR HB2 . 52529 1
517 . 1 . 1 59 59 TYR HB3 H 1 3.408 0.000 . 2 . . . . . 59 TYR HB3 . 52529 1
518 . 1 . 1 59 59 TYR C C 13 174.558 0.000 . 1 . . . . . 59 TYR C . 52529 1
519 . 1 . 1 59 59 TYR CA C 13 58.297 0.000 . 1 . . . . . 59 TYR CA . 52529 1
520 . 1 . 1 59 59 TYR CB C 13 40.016 0.000 . 1 . . . . . 59 TYR CB . 52529 1
521 . 1 . 1 59 59 TYR N N 15 115.851 0.012 . 1 . . . . . 59 TYR N . 52529 1
522 . 1 . 1 60 60 ASN H H 1 8.119 0.005 . 1 . . . . . 60 ASN H . 52529 1
523 . 1 . 1 60 60 ASN HA H 1 4.290 0.000 . 1 . . . . . 60 ASN HA . 52529 1
524 . 1 . 1 60 60 ASN HB2 H 1 3.230 0.000 . 2 . . . . . 60 ASN HB2 . 52529 1
525 . 1 . 1 60 60 ASN HB3 H 1 2.723 0.000 . 2 . . . . . 60 ASN HB3 . 52529 1
526 . 1 . 1 60 60 ASN C C 13 174.172 0.000 . 1 . . . . . 60 ASN C . 52529 1
527 . 1 . 1 60 60 ASN CA C 13 54.442 0.000 . 1 . . . . . 60 ASN CA . 52529 1
528 . 1 . 1 60 60 ASN CB C 13 37.342 0.000 . 1 . . . . . 60 ASN CB . 52529 1
529 . 1 . 1 60 60 ASN N N 15 115.986 0.025 . 1 . . . . . 60 ASN N . 52529 1
530 . 1 . 1 61 61 ILE H H 1 7.117 0.006 . 1 . . . . . 61 ILE H . 52529 1
531 . 1 . 1 61 61 ILE HA H 1 3.301 0.000 . 1 . . . . . 61 ILE HA . 52529 1
532 . 1 . 1 61 61 ILE HB H 1 1.322 0.000 . 1 . . . . . 61 ILE HB . 52529 1
533 . 1 . 1 61 61 ILE C C 13 174.463 0.000 . 1 . . . . . 61 ILE C . 52529 1
534 . 1 . 1 61 61 ILE CA C 13 62.381 0.000 . 1 . . . . . 61 ILE CA . 52529 1
535 . 1 . 1 61 61 ILE CB C 13 36.845 0.000 . 1 . . . . . 61 ILE CB . 52529 1
536 . 1 . 1 61 61 ILE N N 15 118.844 0.001 . 1 . . . . . 61 ILE N . 52529 1
537 . 1 . 1 62 62 GLN H H 1 7.580 0.005 . 1 . . . . . 62 GLN H . 52529 1
538 . 1 . 1 62 62 GLN HA H 1 4.429 0.000 . 1 . . . . . 62 GLN HA . 52529 1
539 . 1 . 1 62 62 GLN HB2 H 1 1.826 0.000 . 2 . . . . . 62 GLN HB2 . 52529 1
540 . 1 . 1 62 62 GLN HB3 H 1 1.826 0.000 . 2 . . . . . 62 GLN HB3 . 52529 1
541 . 1 . 1 62 62 GLN HG2 H 1 2.250 0.000 . 2 . . . . . 62 GLN HG2 . 52529 1
542 . 1 . 1 62 62 GLN HG3 H 1 2.250 0.000 . 2 . . . . . 62 GLN HG3 . 52529 1
543 . 1 . 1 62 62 GLN C C 13 175.742 0.000 . 1 . . . . . 62 GLN C . 52529 1
544 . 1 . 1 62 62 GLN CA C 13 53.637 0.000 . 1 . . . . . 62 GLN CA . 52529 1
545 . 1 . 1 62 62 GLN CB C 13 31.565 0.000 . 1 . . . . . 62 GLN CB . 52529 1
546 . 1 . 1 62 62 GLN N N 15 125.023 0.010 . 1 . . . . . 62 GLN N . 52529 1
547 . 1 . 1 63 63 LYS H H 1 8.455 0.007 . 1 . . . . . 63 LYS H . 52529 1
548 . 1 . 1 63 63 LYS HA H 1 3.482 0.000 . 1 . . . . . 63 LYS HA . 52529 1
549 . 1 . 1 63 63 LYS C C 13 175.607 0.000 . 1 . . . . . 63 LYS C . 52529 1
550 . 1 . 1 63 63 LYS CA C 13 57.975 0.000 . 1 . . . . . 63 LYS CA . 52529 1
551 . 1 . 1 63 63 LYS CB C 13 32.387 0.000 . 1 . . . . . 63 LYS CB . 52529 1
552 . 1 . 1 63 63 LYS N N 15 120.621 0.012 . 1 . . . . . 63 LYS N . 52529 1
553 . 1 . 1 64 64 GLU H H 1 9.309 0.006 . 1 . . . . . 64 GLU H . 52529 1
554 . 1 . 1 64 64 GLU HA H 1 3.251 0.000 . 1 . . . . . 64 GLU HA . 52529 1
555 . 1 . 1 64 64 GLU HB2 H 1 2.410 0.000 . 2 . . . . . 64 GLU HB2 . 52529 1
556 . 1 . 1 64 64 GLU HB3 H 1 2.410 0.000 . 2 . . . . . 64 GLU HB3 . 52529 1
557 . 1 . 1 64 64 GLU HG2 H 1 2.210 0.000 . 2 . . . . . 64 GLU HG2 . 52529 1
558 . 1 . 1 64 64 GLU HG3 H 1 2.210 0.000 . 2 . . . . . 64 GLU HG3 . 52529 1
559 . 1 . 1 64 64 GLU C C 13 175.127 0.000 . 1 . . . . . 64 GLU C . 52529 1
560 . 1 . 1 64 64 GLU CA C 13 58.385 0.000 . 1 . . . . . 64 GLU CA . 52529 1
561 . 1 . 1 64 64 GLU CB C 13 25.883 0.000 . 1 . . . . . 64 GLU CB . 52529 1
562 . 1 . 1 64 64 GLU N N 15 114.527 0.007 . 1 . . . . . 64 GLU N . 52529 1
563 . 1 . 1 65 65 SER H H 1 7.608 0.005 . 1 . . . . . 65 SER H . 52529 1
564 . 1 . 1 65 65 SER HA H 1 4.572 0.000 . 1 . . . . . 65 SER HA . 52529 1
565 . 1 . 1 65 65 SER HB2 H 1 3.841 0.000 . 2 . . . . . 65 SER HB2 . 52529 1
566 . 1 . 1 65 65 SER HB3 H 1 3.560 0.000 . 2 . . . . . 65 SER HB3 . 52529 1
567 . 1 . 1 65 65 SER C C 13 171.916 0.000 . 1 . . . . . 65 SER C . 52529 1
568 . 1 . 1 65 65 SER CA C 13 60.832 0.000 . 1 . . . . . 65 SER CA . 52529 1
569 . 1 . 1 65 65 SER CB C 13 64.939 0.000 . 1 . . . . . 65 SER CB . 52529 1
570 . 1 . 1 65 65 SER N N 15 115.023 0.009 . 1 . . . . . 65 SER N . 52529 1
571 . 1 . 1 66 66 THR H H 1 8.672 0.005 . 1 . . . . . 66 THR H . 52529 1
572 . 1 . 1 66 66 THR HA H 1 5.269 0.000 . 1 . . . . . 66 THR HA . 52529 1
573 . 1 . 1 66 66 THR HB H 1 4.029 0.000 . 1 . . . . . 66 THR HB . 52529 1
574 . 1 . 1 66 66 THR HG21 H 1 0.898 0.000 . 1 . . . . . 66 THR MG . 52529 1
575 . 1 . 1 66 66 THR HG22 H 1 0.898 0.000 . 1 . . . . . 66 THR MG . 52529 1
576 . 1 . 1 66 66 THR HG23 H 1 0.898 0.000 . 1 . . . . . 66 THR MG . 52529 1
577 . 1 . 1 66 66 THR C C 13 173.488 0.000 . 1 . . . . . 66 THR C . 52529 1
578 . 1 . 1 66 66 THR CA C 13 62.126 0.000 . 1 . . . . . 66 THR CA . 52529 1
579 . 1 . 1 66 66 THR CB C 13 70.054 0.000 . 1 . . . . . 66 THR CB . 52529 1
580 . 1 . 1 66 66 THR N N 15 117.454 0.012 . 1 . . . . . 66 THR N . 52529 1
581 . 1 . 1 67 67 LEU H H 1 9.312 0.005 . 1 . . . . . 67 LEU H . 52529 1
582 . 1 . 1 67 67 LEU HA H 1 5.103 0.000 . 1 . . . . . 67 LEU HA . 52529 1
583 . 1 . 1 67 67 LEU HB2 H 1 1.535 0.000 . 2 . . . . . 67 LEU HB2 . 52529 1
584 . 1 . 1 67 67 LEU HB3 H 1 1.535 0.000 . 2 . . . . . 67 LEU HB3 . 52529 1
585 . 1 . 1 67 67 LEU HD11 H 1 0.652 0.000 . 2 . . . . . 67 LEU MD1 . 52529 1
586 . 1 . 1 67 67 LEU HD12 H 1 0.652 0.000 . 2 . . . . . 67 LEU MD1 . 52529 1
587 . 1 . 1 67 67 LEU HD13 H 1 0.652 0.000 . 2 . . . . . 67 LEU MD1 . 52529 1
588 . 1 . 1 67 67 LEU HD21 H 1 0.652 0.000 . 2 . . . . . 67 LEU MD2 . 52529 1
589 . 1 . 1 67 67 LEU HD22 H 1 0.652 0.000 . 2 . . . . . 67 LEU MD2 . 52529 1
590 . 1 . 1 67 67 LEU HD23 H 1 0.652 0.000 . 2 . . . . . 67 LEU MD2 . 52529 1
591 . 1 . 1 67 67 LEU C C 13 174.947 0.000 . 1 . . . . . 67 LEU C . 52529 1
592 . 1 . 1 67 67 LEU CA C 13 54.356 0.000 . 1 . . . . . 67 LEU CA . 52529 1
593 . 1 . 1 67 67 LEU CB C 13 44.711 0.000 . 1 . . . . . 67 LEU CB . 52529 1
594 . 1 . 1 67 67 LEU N N 15 128.412 0.021 . 1 . . . . . 67 LEU N . 52529 1
595 . 1 . 1 68 68 HIS H H 1 8.816 0.006 . 1 . . . . . 68 HIS H . 52529 1
596 . 1 . 1 68 68 HIS HA H 1 5.054 0.000 . 1 . . . . . 68 HIS HA . 52529 1
597 . 1 . 1 68 68 HIS HB2 H 1 2.816 0.000 . 2 . . . . . 68 HIS HB2 . 52529 1
598 . 1 . 1 68 68 HIS HB3 H 1 2.943 0.000 . 2 . . . . . 68 HIS HB3 . 52529 1
599 . 1 . 1 68 68 HIS C C 13 174.361 0.000 . 1 . . . . . 68 HIS C . 52529 1
600 . 1 . 1 68 68 HIS CA C 13 56.441 0.000 . 1 . . . . . 68 HIS CA . 52529 1
601 . 1 . 1 68 68 HIS CB C 13 33.163 0.000 . 1 . . . . . 68 HIS CB . 52529 1
602 . 1 . 1 68 68 HIS N N 15 118.218 0.010 . 1 . . . . . 68 HIS N . 52529 1
603 . 1 . 1 69 69 LEU H H 1 7.884 0.005 . 1 . . . . . 69 LEU H . 52529 1
604 . 1 . 1 69 69 LEU HA H 1 5.102 0.000 . 1 . . . . . 69 LEU HA . 52529 1
605 . 1 . 1 69 69 LEU HB2 H 1 1.457 0.000 . 2 . . . . . 69 LEU HB2 . 52529 1
606 . 1 . 1 69 69 LEU HB3 H 1 1.790 0.000 . 2 . . . . . 69 LEU HB3 . 52529 1
607 . 1 . 1 69 69 LEU HG H 1 1.323 0.000 . 1 . . . . . 69 LEU HG . 52529 1
608 . 1 . 1 69 69 LEU HD11 H 1 0.774 0.000 . 2 . . . . . 69 LEU MD1 . 52529 1
609 . 1 . 1 69 69 LEU HD12 H 1 0.774 0.000 . 2 . . . . . 69 LEU MD1 . 52529 1
610 . 1 . 1 69 69 LEU HD13 H 1 0.774 0.000 . 2 . . . . . 69 LEU MD1 . 52529 1
611 . 1 . 1 69 69 LEU HD21 H 1 0.774 0.000 . 2 . . . . . 69 LEU MD2 . 52529 1
612 . 1 . 1 69 69 LEU HD22 H 1 0.774 0.000 . 2 . . . . . 69 LEU MD2 . 52529 1
613 . 1 . 1 69 69 LEU HD23 H 1 0.774 0.000 . 2 . . . . . 69 LEU MD2 . 52529 1
614 . 1 . 1 69 69 LEU C C 13 176.196 0.000 . 1 . . . . . 69 LEU C . 52529 1
615 . 1 . 1 69 69 LEU CA C 13 55.308 0.000 . 1 . . . . . 69 LEU CA . 52529 1
616 . 1 . 1 69 69 LEU CB C 13 43.471 0.000 . 1 . . . . . 69 LEU CB . 52529 1
617 . 1 . 1 69 69 LEU N N 15 122.610 0.018 . 1 . . . . . 69 LEU N . 52529 1
618 . 1 . 1 70 70 VAL H H 1 8.834 0.006 . 1 . . . . . 70 VAL H . 52529 1
619 . 1 . 1 70 70 VAL HA H 1 4.574 0.000 . 1 . . . . . 70 VAL HA . 52529 1
620 . 1 . 1 70 70 VAL HB H 1 2.117 0.000 . 1 . . . . . 70 VAL HB . 52529 1
621 . 1 . 1 70 70 VAL HG11 H 1 0.805 0.000 . 2 . . . . . 70 VAL MG1 . 52529 1
622 . 1 . 1 70 70 VAL HG12 H 1 0.805 0.000 . 2 . . . . . 70 VAL MG1 . 52529 1
623 . 1 . 1 70 70 VAL HG13 H 1 0.805 0.000 . 2 . . . . . 70 VAL MG1 . 52529 1
624 . 1 . 1 70 70 VAL HG21 H 1 0.663 0.000 . 2 . . . . . 70 VAL MG2 . 52529 1
625 . 1 . 1 70 70 VAL HG22 H 1 0.663 0.000 . 2 . . . . . 70 VAL MG2 . 52529 1
626 . 1 . 1 70 70 VAL HG23 H 1 0.663 0.000 . 2 . . . . . 70 VAL MG2 . 52529 1
627 . 1 . 1 70 70 VAL C C 13 174.986 0.000 . 1 . . . . . 70 VAL C . 52529 1
628 . 1 . 1 70 70 VAL CA C 13 59.185 0.000 . 1 . . . . . 70 VAL CA . 52529 1
629 . 1 . 1 70 70 VAL CB C 13 35.804 0.000 . 1 . . . . . 70 VAL CB . 52529 1
630 . 1 . 1 70 70 VAL N N 15 115.735 0.017 . 1 . . . . . 70 VAL N . 52529 1
631 . 1 . 1 71 71 LEU H H 1 8.285 0.006 . 1 . . . . . 71 LEU H . 52529 1
632 . 1 . 1 71 71 LEU HA H 1 4.436 0.000 . 1 . . . . . 71 LEU HA . 52529 1
633 . 1 . 1 71 71 LEU HB2 H 1 1.561 0.000 . 2 . . . . . 71 LEU HB2 . 52529 1
634 . 1 . 1 71 71 LEU HB3 H 1 1.561 0.000 . 2 . . . . . 71 LEU HB3 . 52529 1
635 . 1 . 1 71 71 LEU HD11 H 1 0.886 0.000 . 2 . . . . . 71 LEU MD1 . 52529 1
636 . 1 . 1 71 71 LEU HD12 H 1 0.886 0.000 . 2 . . . . . 71 LEU MD1 . 52529 1
637 . 1 . 1 71 71 LEU HD13 H 1 0.886 0.000 . 2 . . . . . 71 LEU MD1 . 52529 1
638 . 1 . 1 71 71 LEU HD21 H 1 0.886 0.000 . 2 . . . . . 71 LEU MD2 . 52529 1
639 . 1 . 1 71 71 LEU HD22 H 1 0.886 0.000 . 2 . . . . . 71 LEU MD2 . 52529 1
640 . 1 . 1 71 71 LEU HD23 H 1 0.886 0.000 . 2 . . . . . 71 LEU MD2 . 52529 1
641 . 1 . 1 71 71 LEU C C 13 177.609 0.000 . 1 . . . . . 71 LEU C . 52529 1
642 . 1 . 1 71 71 LEU CA C 13 55.389 0.000 . 1 . . . . . 71 LEU CA . 52529 1
643 . 1 . 1 71 71 LEU CB C 13 42.292 0.000 . 1 . . . . . 71 LEU CB . 52529 1
644 . 1 . 1 71 71 LEU N N 15 120.917 0.011 . 1 . . . . . 71 LEU N . 52529 1
645 . 1 . 1 72 72 ARG H H 1 8.207 0.005 . 1 . . . . . 72 ARG H . 52529 1
646 . 1 . 1 72 72 ARG HA H 1 4.021 0.000 . 1 . . . . . 72 ARG HA . 52529 1
647 . 1 . 1 72 72 ARG HB2 H 1 1.625 0.000 . 2 . . . . . 72 ARG HB2 . 52529 1
648 . 1 . 1 72 72 ARG HB3 H 1 1.625 0.000 . 2 . . . . . 72 ARG HB3 . 52529 1
649 . 1 . 1 72 72 ARG HG2 H 1 1.286 0.000 . 2 . . . . . 72 ARG HG2 . 52529 1
650 . 1 . 1 72 72 ARG HG3 H 1 1.286 0.000 . 2 . . . . . 72 ARG HG3 . 52529 1
651 . 1 . 1 72 72 ARG HD2 H 1 3.006 0.000 . 2 . . . . . 72 ARG HD2 . 52529 1
652 . 1 . 1 72 72 ARG HD3 H 1 3.006 0.000 . 2 . . . . . 72 ARG HD3 . 52529 1
653 . 1 . 1 72 72 ARG C C 13 175.303 0.000 . 1 . . . . . 72 ARG C . 52529 1
654 . 1 . 1 72 72 ARG CA C 13 56.266 0.000 . 1 . . . . . 72 ARG CA . 52529 1
655 . 1 . 1 72 72 ARG CB C 13 30.943 0.000 . 1 . . . . . 72 ARG CB . 52529 1
656 . 1 . 1 72 72 ARG N N 15 123.122 0.004 . 1 . . . . . 72 ARG N . 52529 1
657 . 1 . 1 73 73 LEU H H 1 8.254 0.005 . 1 . . . . . 73 LEU H . 52529 1
658 . 1 . 1 73 73 LEU HA H 1 4.357 0.000 . 1 . . . . . 73 LEU HA . 52529 1
659 . 1 . 1 73 73 LEU HB2 H 1 1.539 0.000 . 2 . . . . . 73 LEU HB2 . 52529 1
660 . 1 . 1 73 73 LEU HB3 H 1 1.539 0.000 . 2 . . . . . 73 LEU HB3 . 52529 1
661 . 1 . 1 73 73 LEU HD11 H 1 0.839 0.000 . 2 . . . . . 73 LEU MD1 . 52529 1
662 . 1 . 1 73 73 LEU HD12 H 1 0.839 0.000 . 2 . . . . . 73 LEU MD1 . 52529 1
663 . 1 . 1 73 73 LEU HD13 H 1 0.839 0.000 . 2 . . . . . 73 LEU MD1 . 52529 1
664 . 1 . 1 73 73 LEU HD21 H 1 0.839 0.000 . 2 . . . . . 73 LEU MD2 . 52529 1
665 . 1 . 1 73 73 LEU HD22 H 1 0.839 0.000 . 2 . . . . . 73 LEU MD2 . 52529 1
666 . 1 . 1 73 73 LEU HD23 H 1 0.839 0.000 . 2 . . . . . 73 LEU MD2 . 52529 1
667 . 1 . 1 73 73 LEU C C 13 176.997 0.000 . 1 . . . . . 73 LEU C . 52529 1
668 . 1 . 1 73 73 LEU CA C 13 54.925 0.000 . 1 . . . . . 73 LEU CA . 52529 1
669 . 1 . 1 73 73 LEU CB C 13 42.272 0.000 . 1 . . . . . 73 LEU CB . 52529 1
670 . 1 . 1 73 73 LEU N N 15 124.898 0.000 . 1 . . . . . 73 LEU N . 52529 1
671 . 1 . 1 74 74 ARG H H 1 8.416 0.005 . 1 . . . . . 74 ARG H . 52529 1
672 . 1 . 1 74 74 ARG HA H 1 4.260 0.000 . 1 . . . . . 74 ARG HA . 52529 1
673 . 1 . 1 74 74 ARG HB2 H 1 1.718 0.000 . 2 . . . . . 74 ARG HB2 . 52529 1
674 . 1 . 1 74 74 ARG HB3 H 1 1.718 0.000 . 2 . . . . . 74 ARG HB3 . 52529 1
675 . 1 . 1 74 74 ARG HD2 H 1 3.155 0.000 . 2 . . . . . 74 ARG HD2 . 52529 1
676 . 1 . 1 74 74 ARG HD3 H 1 3.155 0.000 . 2 . . . . . 74 ARG HD3 . 52529 1
677 . 1 . 1 74 74 ARG C C 13 176.337 0.000 . 1 . . . . . 74 ARG C . 52529 1
678 . 1 . 1 74 74 ARG CA C 13 56.472 0.000 . 1 . . . . . 74 ARG CA . 52529 1
679 . 1 . 1 74 74 ARG CB C 13 30.706 0.000 . 1 . . . . . 74 ARG CB . 52529 1
680 . 1 . 1 74 74 ARG N N 15 122.795 0.008 . 1 . . . . . 74 ARG N . 52529 1
681 . 1 . 1 75 75 GLY H H 1 8.425 0.005 . 1 . . . . . 75 GLY H . 52529 1
682 . 1 . 1 75 75 GLY HA2 H 1 3.903 0.000 . 2 . . . . . 75 GLY HA2 . 52529 1
683 . 1 . 1 75 75 GLY HA3 H 1 3.903 0.000 . 2 . . . . . 75 GLY HA3 . 52529 1
684 . 1 . 1 75 75 GLY C C 13 173.493 0.000 . 1 . . . . . 75 GLY C . 52529 1
685 . 1 . 1 75 75 GLY CA C 13 45.363 0.000 . 1 . . . . . 75 GLY CA . 52529 1
686 . 1 . 1 75 75 GLY N N 15 111.047 0.019 . 1 . . . . . 75 GLY N . 52529 1
687 . 1 . 1 76 76 GLY H H 1 7.885 0.006 . 1 . . . . . 76 GLY H . 52529 1
688 . 1 . 1 76 76 GLY HA2 H 1 3.683 0.000 . 2 . . . . . 76 GLY HA2 . 52529 1
689 . 1 . 1 76 76 GLY HA3 H 1 3.981 0.000 . 2 . . . . . 76 GLY HA3 . 52529 1
690 . 1 . 1 76 76 GLY CA C 13 45.852 0.000 . 1 . . . . . 76 GLY CA . 52529 1
691 . 1 . 1 76 76 GLY N N 15 115.192 0.018 . 1 . . . . . 76 GLY N . 52529 1
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