###################################
# 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_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11404
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $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' 1 $sample_1 isotropic 11404 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11404 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 $XWINNMR . . 11404 1
2 $NMRPipe . . 11404 1
3 $NMRView . . 11404 1
4 $Kujira . . 11404 1
5 $CYANA . . 11404 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 7 7 GLY HA2 H 1 3.960 0.030 . 1 . . . . 7 GLY HA2 . 11404 1
2 . 1 1 7 7 GLY HA3 H 1 3.960 0.030 . 1 . . . . 7 GLY HA3 . 11404 1
3 . 1 1 7 7 GLY C C 13 174.223 0.300 . 1 . . . . 7 GLY C . 11404 1
4 . 1 1 7 7 GLY CA C 13 45.510 0.300 . 1 . . . . 7 GLY CA . 11404 1
5 . 1 1 8 8 GLU H H 1 8.321 0.030 . 1 . . . . 8 GLU H . 11404 1
6 . 1 1 8 8 GLU HA H 1 4.322 0.030 . 1 . . . . 8 GLU HA . 11404 1
7 . 1 1 8 8 GLU HB2 H 1 2.055 0.030 . 2 . . . . 8 GLU HB2 . 11404 1
8 . 1 1 8 8 GLU HB3 H 1 1.978 0.030 . 2 . . . . 8 GLU HB3 . 11404 1
9 . 1 1 8 8 GLU HG2 H 1 2.342 0.030 . 1 . . . . 8 GLU HG2 . 11404 1
10 . 1 1 8 8 GLU HG3 H 1 2.342 0.030 . 1 . . . . 8 GLU HG3 . 11404 1
11 . 1 1 8 8 GLU C C 13 174.279 0.300 . 1 . . . . 8 GLU C . 11404 1
12 . 1 1 8 8 GLU CA C 13 55.843 0.300 . 1 . . . . 8 GLU CA . 11404 1
13 . 1 1 8 8 GLU CB C 13 29.656 0.300 . 1 . . . . 8 GLU CB . 11404 1
14 . 1 1 8 8 GLU CG C 13 33.854 0.300 . 1 . . . . 8 GLU CG . 11404 1
15 . 1 1 8 8 GLU N N 15 120.618 0.300 . 1 . . . . 8 GLU N . 11404 1
16 . 1 1 9 9 GLY H H 1 8.553 0.030 . 1 . . . . 9 GLY H . 11404 1
17 . 1 1 9 9 GLY HA2 H 1 3.964 0.030 . 1 . . . . 9 GLY HA2 . 11404 1
18 . 1 1 9 9 GLY HA3 H 1 3.964 0.030 . 1 . . . . 9 GLY HA3 . 11404 1
19 . 1 1 9 9 GLY C C 13 173.647 0.300 . 1 . . . . 9 GLY C . 11404 1
20 . 1 1 9 9 GLY CA C 13 44.957 0.300 . 1 . . . . 9 GLY CA . 11404 1
21 . 1 1 9 9 GLY N N 15 110.310 0.300 . 1 . . . . 9 GLY N . 11404 1
22 . 1 1 10 10 VAL H H 1 7.819 0.030 . 1 . . . . 10 VAL H . 11404 1
23 . 1 1 10 10 VAL HA H 1 4.332 0.030 . 1 . . . . 10 VAL HA . 11404 1
24 . 1 1 10 10 VAL HB H 1 1.902 0.030 . 1 . . . . 10 VAL HB . 11404 1
25 . 1 1 10 10 VAL HG11 H 1 0.719 0.030 . 1 . . . . 10 VAL HG1 . 11404 1
26 . 1 1 10 10 VAL HG12 H 1 0.719 0.030 . 1 . . . . 10 VAL HG1 . 11404 1
27 . 1 1 10 10 VAL HG13 H 1 0.719 0.030 . 1 . . . . 10 VAL HG1 . 11404 1
28 . 1 1 10 10 VAL HG21 H 1 0.767 0.030 . 1 . . . . 10 VAL HG2 . 11404 1
29 . 1 1 10 10 VAL HG22 H 1 0.767 0.030 . 1 . . . . 10 VAL HG2 . 11404 1
30 . 1 1 10 10 VAL HG23 H 1 0.767 0.030 . 1 . . . . 10 VAL HG2 . 11404 1
31 . 1 1 10 10 VAL C C 13 175.757 0.300 . 1 . . . . 10 VAL C . 11404 1
32 . 1 1 10 10 VAL CA C 13 61.977 0.300 . 1 . . . . 10 VAL CA . 11404 1
33 . 1 1 10 10 VAL CB C 13 33.365 0.300 . 1 . . . . 10 VAL CB . 11404 1
34 . 1 1 10 10 VAL CG1 C 13 21.358 0.300 . 2 . . . . 10 VAL CG1 . 11404 1
35 . 1 1 10 10 VAL CG2 C 13 20.858 0.300 . 2 . . . . 10 VAL CG2 . 11404 1
36 . 1 1 10 10 VAL N N 15 119.807 0.300 . 1 . . . . 10 VAL N . 11404 1
37 . 1 1 11 11 VAL H H 1 8.217 0.030 . 1 . . . . 11 VAL H . 11404 1
38 . 1 1 11 11 VAL HA H 1 4.184 0.030 . 1 . . . . 11 VAL HA . 11404 1
39 . 1 1 11 11 VAL HB H 1 1.852 0.030 . 1 . . . . 11 VAL HB . 11404 1
40 . 1 1 11 11 VAL HG11 H 1 0.905 0.030 . 1 . . . . 11 VAL HG1 . 11404 1
41 . 1 1 11 11 VAL HG12 H 1 0.905 0.030 . 1 . . . . 11 VAL HG1 . 11404 1
42 . 1 1 11 11 VAL HG13 H 1 0.905 0.030 . 1 . . . . 11 VAL HG1 . 11404 1
43 . 1 1 11 11 VAL HG21 H 1 0.731 0.030 . 1 . . . . 11 VAL HG2 . 11404 1
44 . 1 1 11 11 VAL HG22 H 1 0.731 0.030 . 1 . . . . 11 VAL HG2 . 11404 1
45 . 1 1 11 11 VAL HG23 H 1 0.731 0.030 . 1 . . . . 11 VAL HG2 . 11404 1
46 . 1 1 11 11 VAL C C 13 174.536 0.300 . 1 . . . . 11 VAL C . 11404 1
47 . 1 1 11 11 VAL CA C 13 61.442 0.300 . 1 . . . . 11 VAL CA . 11404 1
48 . 1 1 11 11 VAL CB C 13 34.385 0.300 . 1 . . . . 11 VAL CB . 11404 1
49 . 1 1 11 11 VAL CG1 C 13 20.645 0.300 . 2 . . . . 11 VAL CG1 . 11404 1
50 . 1 1 11 11 VAL CG2 C 13 21.560 0.300 . 2 . . . . 11 VAL CG2 . 11404 1
51 . 1 1 11 11 VAL N N 15 126.163 0.300 . 1 . . . . 11 VAL N . 11404 1
52 . 1 1 12 12 GLU H H 1 8.407 0.030 . 1 . . . . 12 GLU H . 11404 1
53 . 1 1 12 12 GLU HA H 1 4.849 0.030 . 1 . . . . 12 GLU HA . 11404 1
54 . 1 1 12 12 GLU HB2 H 1 1.724 0.030 . 2 . . . . 12 GLU HB2 . 11404 1
55 . 1 1 12 12 GLU HB3 H 1 1.816 0.030 . 2 . . . . 12 GLU HB3 . 11404 1
56 . 1 1 12 12 GLU HG2 H 1 2.178 0.030 . 2 . . . . 12 GLU HG2 . 11404 1
57 . 1 1 12 12 GLU HG3 H 1 1.899 0.030 . 2 . . . . 12 GLU HG3 . 11404 1
58 . 1 1 12 12 GLU C C 13 174.671 0.300 . 1 . . . . 12 GLU C . 11404 1
59 . 1 1 12 12 GLU CA C 13 55.399 0.300 . 1 . . . . 12 GLU CA . 11404 1
60 . 1 1 12 12 GLU CB C 13 31.025 0.300 . 1 . . . . 12 GLU CB . 11404 1
61 . 1 1 12 12 GLU CG C 13 37.533 0.300 . 1 . . . . 12 GLU CG . 11404 1
62 . 1 1 12 12 GLU N N 15 125.893 0.300 . 1 . . . . 12 GLU N . 11404 1
63 . 1 1 13 13 ALA H H 1 8.777 0.030 . 1 . . . . 13 ALA H . 11404 1
64 . 1 1 13 13 ALA HA H 1 4.663 0.030 . 1 . . . . 13 ALA HA . 11404 1
65 . 1 1 13 13 ALA HB1 H 1 0.949 0.030 . 1 . . . . 13 ALA HB . 11404 1
66 . 1 1 13 13 ALA HB2 H 1 0.949 0.030 . 1 . . . . 13 ALA HB . 11404 1
67 . 1 1 13 13 ALA HB3 H 1 0.949 0.030 . 1 . . . . 13 ALA HB . 11404 1
68 . 1 1 13 13 ALA C C 13 174.739 0.300 . 1 . . . . 13 ALA C . 11404 1
69 . 1 1 13 13 ALA CA C 13 49.835 0.300 . 1 . . . . 13 ALA CA . 11404 1
70 . 1 1 13 13 ALA CB C 13 23.783 0.300 . 1 . . . . 13 ALA CB . 11404 1
71 . 1 1 13 13 ALA N N 15 125.757 0.300 . 1 . . . . 13 ALA N . 11404 1
72 . 1 1 14 14 VAL H H 1 7.780 0.030 . 1 . . . . 14 VAL H . 11404 1
73 . 1 1 14 14 VAL HA H 1 4.691 0.030 . 1 . . . . 14 VAL HA . 11404 1
74 . 1 1 14 14 VAL HB H 1 1.676 0.030 . 1 . . . . 14 VAL HB . 11404 1
75 . 1 1 14 14 VAL HG11 H 1 0.814 0.030 . 1 . . . . 14 VAL HG1 . 11404 1
76 . 1 1 14 14 VAL HG12 H 1 0.814 0.030 . 1 . . . . 14 VAL HG1 . 11404 1
77 . 1 1 14 14 VAL HG13 H 1 0.814 0.030 . 1 . . . . 14 VAL HG1 . 11404 1
78 . 1 1 14 14 VAL HG21 H 1 0.970 0.030 . 1 . . . . 14 VAL HG2 . 11404 1
79 . 1 1 14 14 VAL HG22 H 1 0.970 0.030 . 1 . . . . 14 VAL HG2 . 11404 1
80 . 1 1 14 14 VAL HG23 H 1 0.970 0.030 . 1 . . . . 14 VAL HG2 . 11404 1
81 . 1 1 14 14 VAL C C 13 176.140 0.300 . 1 . . . . 14 VAL C . 11404 1
82 . 1 1 14 14 VAL CA C 13 60.326 0.300 . 1 . . . . 14 VAL CA . 11404 1
83 . 1 1 14 14 VAL CB C 13 34.496 0.300 . 1 . . . . 14 VAL CB . 11404 1
84 . 1 1 14 14 VAL CG1 C 13 21.927 0.300 . 2 . . . . 14 VAL CG1 . 11404 1
85 . 1 1 14 14 VAL CG2 C 13 21.936 0.300 . 2 . . . . 14 VAL CG2 . 11404 1
86 . 1 1 14 14 VAL N N 15 118.116 0.300 . 1 . . . . 14 VAL N . 11404 1
87 . 1 1 15 15 ALA H H 1 8.853 0.030 . 1 . . . . 15 ALA H . 11404 1
88 . 1 1 15 15 ALA HA H 1 4.599 0.030 . 1 . . . . 15 ALA HA . 11404 1
89 . 1 1 15 15 ALA HB1 H 1 1.575 0.030 . 1 . . . . 15 ALA HB . 11404 1
90 . 1 1 15 15 ALA HB2 H 1 1.575 0.030 . 1 . . . . 15 ALA HB . 11404 1
91 . 1 1 15 15 ALA HB3 H 1 1.575 0.030 . 1 . . . . 15 ALA HB . 11404 1
92 . 1 1 15 15 ALA C C 13 178.797 0.300 . 1 . . . . 15 ALA C . 11404 1
93 . 1 1 15 15 ALA CA C 13 52.485 0.300 . 1 . . . . 15 ALA CA . 11404 1
94 . 1 1 15 15 ALA CB C 13 20.606 0.300 . 1 . . . . 15 ALA CB . 11404 1
95 . 1 1 15 15 ALA N N 15 128.575 0.300 . 1 . . . . 15 ALA N . 11404 1
96 . 1 1 16 16 CYS H H 1 9.214 0.030 . 1 . . . . 16 CYS H . 11404 1
97 . 1 1 16 16 CYS HA H 1 4.433 0.030 . 1 . . . . 16 CYS HA . 11404 1
98 . 1 1 16 16 CYS HB2 H 1 2.689 0.030 . 2 . . . . 16 CYS HB2 . 11404 1
99 . 1 1 16 16 CYS HB3 H 1 2.542 0.030 . 2 . . . . 16 CYS HB3 . 11404 1
100 . 1 1 16 16 CYS C C 13 172.827 0.300 . 1 . . . . 16 CYS C . 11404 1
101 . 1 1 16 16 CYS CA C 13 57.703 0.300 . 1 . . . . 16 CYS CA . 11404 1
102 . 1 1 16 16 CYS CB C 13 27.895 0.300 . 1 . . . . 16 CYS CB . 11404 1
103 . 1 1 16 16 CYS N N 15 124.901 0.300 . 1 . . . . 16 CYS N . 11404 1
104 . 1 1 17 17 PHE H H 1 7.771 0.030 . 1 . . . . 17 PHE H . 11404 1
105 . 1 1 17 17 PHE HA H 1 4.817 0.030 . 1 . . . . 17 PHE HA . 11404 1
106 . 1 1 17 17 PHE HB2 H 1 2.750 0.030 . 2 . . . . 17 PHE HB2 . 11404 1
107 . 1 1 17 17 PHE HB3 H 1 3.278 0.030 . 2 . . . . 17 PHE HB3 . 11404 1
108 . 1 1 17 17 PHE HD1 H 1 7.154 0.030 . 1 . . . . 17 PHE HD1 . 11404 1
109 . 1 1 17 17 PHE HD2 H 1 7.154 0.030 . 1 . . . . 17 PHE HD2 . 11404 1
110 . 1 1 17 17 PHE HE1 H 1 7.276 0.030 . 1 . . . . 17 PHE HE1 . 11404 1
111 . 1 1 17 17 PHE HE2 H 1 7.276 0.030 . 1 . . . . 17 PHE HE2 . 11404 1
112 . 1 1 17 17 PHE HZ H 1 7.250 0.030 . 1 . . . . 17 PHE HZ . 11404 1
113 . 1 1 17 17 PHE C C 13 173.059 0.300 . 1 . . . . 17 PHE C . 11404 1
114 . 1 1 17 17 PHE CA C 13 58.231 0.300 . 1 . . . . 17 PHE CA . 11404 1
115 . 1 1 17 17 PHE CB C 13 44.237 0.300 . 1 . . . . 17 PHE CB . 11404 1
116 . 1 1 17 17 PHE CD1 C 13 132.509 0.300 . 1 . . . . 17 PHE CD1 . 11404 1
117 . 1 1 17 17 PHE CD2 C 13 132.509 0.300 . 1 . . . . 17 PHE CD2 . 11404 1
118 . 1 1 17 17 PHE CE1 C 13 131.377 0.300 . 1 . . . . 17 PHE CE1 . 11404 1
119 . 1 1 17 17 PHE CE2 C 13 131.377 0.300 . 1 . . . . 17 PHE CE2 . 11404 1
120 . 1 1 17 17 PHE CZ C 13 129.989 0.300 . 1 . . . . 17 PHE CZ . 11404 1
121 . 1 1 17 17 PHE N N 15 118.319 0.300 . 1 . . . . 17 PHE N . 11404 1
122 . 1 1 18 18 ALA H H 1 8.215 0.030 . 1 . . . . 18 ALA H . 11404 1
123 . 1 1 18 18 ALA HA H 1 4.277 0.030 . 1 . . . . 18 ALA HA . 11404 1
124 . 1 1 18 18 ALA HB1 H 1 1.481 0.030 . 1 . . . . 18 ALA HB . 11404 1
125 . 1 1 18 18 ALA HB2 H 1 1.481 0.030 . 1 . . . . 18 ALA HB . 11404 1
126 . 1 1 18 18 ALA HB3 H 1 1.481 0.030 . 1 . . . . 18 ALA HB . 11404 1
127 . 1 1 18 18 ALA C C 13 176.339 0.300 . 1 . . . . 18 ALA C . 11404 1
128 . 1 1 18 18 ALA CA C 13 52.032 0.300 . 1 . . . . 18 ALA CA . 11404 1
129 . 1 1 18 18 ALA CB C 13 19.632 0.300 . 1 . . . . 18 ALA CB . 11404 1
130 . 1 1 18 18 ALA N N 15 121.024 0.300 . 1 . . . . 18 ALA N . 11404 1
131 . 1 1 19 19 TYR H H 1 7.899 0.030 . 1 . . . . 19 TYR H . 11404 1
132 . 1 1 19 19 TYR HA H 1 4.312 0.030 . 1 . . . . 19 TYR HA . 11404 1
133 . 1 1 19 19 TYR HB2 H 1 2.051 0.030 . 2 . . . . 19 TYR HB2 . 11404 1
134 . 1 1 19 19 TYR HB3 H 1 1.024 0.030 . 2 . . . . 19 TYR HB3 . 11404 1
135 . 1 1 19 19 TYR HD1 H 1 6.737 0.030 . 1 . . . . 19 TYR HD1 . 11404 1
136 . 1 1 19 19 TYR HD2 H 1 6.737 0.030 . 1 . . . . 19 TYR HD2 . 11404 1
137 . 1 1 19 19 TYR HE1 H 1 6.873 0.030 . 1 . . . . 19 TYR HE1 . 11404 1
138 . 1 1 19 19 TYR HE2 H 1 6.873 0.030 . 1 . . . . 19 TYR HE2 . 11404 1
139 . 1 1 19 19 TYR C C 13 175.082 0.300 . 1 . . . . 19 TYR C . 11404 1
140 . 1 1 19 19 TYR CA C 13 58.171 0.300 . 1 . . . . 19 TYR CA . 11404 1
141 . 1 1 19 19 TYR CB C 13 43.044 0.300 . 1 . . . . 19 TYR CB . 11404 1
142 . 1 1 19 19 TYR CD1 C 13 133.167 0.300 . 1 . . . . 19 TYR CD1 . 11404 1
143 . 1 1 19 19 TYR CD2 C 13 133.167 0.300 . 1 . . . . 19 TYR CD2 . 11404 1
144 . 1 1 19 19 TYR CE1 C 13 117.675 0.300 . 1 . . . . 19 TYR CE1 . 11404 1
145 . 1 1 19 19 TYR CE2 C 13 117.675 0.300 . 1 . . . . 19 TYR CE2 . 11404 1
146 . 1 1 19 19 TYR N N 15 120.205 0.300 . 1 . . . . 19 TYR N . 11404 1
147 . 1 1 20 20 THR H H 1 7.090 0.030 . 1 . . . . 20 THR H . 11404 1
148 . 1 1 20 20 THR HA H 1 4.113 0.030 . 1 . . . . 20 THR HA . 11404 1
149 . 1 1 20 20 THR HB H 1 3.555 0.030 . 1 . . . . 20 THR HB . 11404 1
150 . 1 1 20 20 THR HG21 H 1 1.012 0.030 . 1 . . . . 20 THR HG2 . 11404 1
151 . 1 1 20 20 THR HG22 H 1 1.012 0.030 . 1 . . . . 20 THR HG2 . 11404 1
152 . 1 1 20 20 THR HG23 H 1 1.012 0.030 . 1 . . . . 20 THR HG2 . 11404 1
153 . 1 1 20 20 THR C C 13 172.555 0.300 . 1 . . . . 20 THR C . 11404 1
154 . 1 1 20 20 THR CA C 13 60.457 0.300 . 1 . . . . 20 THR CA . 11404 1
155 . 1 1 20 20 THR CB C 13 69.735 0.300 . 1 . . . . 20 THR CB . 11404 1
156 . 1 1 20 20 THR CG2 C 13 21.193 0.300 . 1 . . . . 20 THR CG2 . 11404 1
157 . 1 1 20 20 THR N N 15 124.135 0.300 . 1 . . . . 20 THR N . 11404 1
158 . 1 1 21 21 GLY H H 1 8.627 0.030 . 1 . . . . 21 GLY H . 11404 1
159 . 1 1 21 21 GLY HA2 H 1 3.395 0.030 . 2 . . . . 21 GLY HA2 . 11404 1
160 . 1 1 21 21 GLY HA3 H 1 3.977 0.030 . 2 . . . . 21 GLY HA3 . 11404 1
161 . 1 1 21 21 GLY C C 13 174.919 0.300 . 1 . . . . 21 GLY C . 11404 1
162 . 1 1 21 21 GLY CA C 13 46.638 0.300 . 1 . . . . 21 GLY CA . 11404 1
163 . 1 1 21 21 GLY N N 15 113.856 0.300 . 1 . . . . 21 GLY N . 11404 1
164 . 1 1 22 22 ARG H H 1 8.921 0.030 . 1 . . . . 22 ARG H . 11404 1
165 . 1 1 22 22 ARG HA H 1 4.132 0.030 . 1 . . . . 22 ARG HA . 11404 1
166 . 1 1 22 22 ARG HB2 H 1 1.989 0.030 . 1 . . . . 22 ARG HB2 . 11404 1
167 . 1 1 22 22 ARG HB3 H 1 1.989 0.030 . 1 . . . . 22 ARG HB3 . 11404 1
168 . 1 1 22 22 ARG HD2 H 1 3.291 0.030 . 2 . . . . 22 ARG HD2 . 11404 1
169 . 1 1 22 22 ARG HD3 H 1 3.357 0.030 . 2 . . . . 22 ARG HD3 . 11404 1
170 . 1 1 22 22 ARG HG2 H 1 1.928 0.030 . 2 . . . . 22 ARG HG2 . 11404 1
171 . 1 1 22 22 ARG HG3 H 1 1.731 0.030 . 2 . . . . 22 ARG HG3 . 11404 1
172 . 1 1 22 22 ARG C C 13 176.882 0.300 . 1 . . . . 22 ARG C . 11404 1
173 . 1 1 22 22 ARG CA C 13 57.246 0.300 . 1 . . . . 22 ARG CA . 11404 1
174 . 1 1 22 22 ARG CB C 13 31.794 0.300 . 1 . . . . 22 ARG CB . 11404 1
175 . 1 1 22 22 ARG CD C 13 43.474 0.300 . 1 . . . . 22 ARG CD . 11404 1
176 . 1 1 22 22 ARG CG C 13 27.362 0.300 . 1 . . . . 22 ARG CG . 11404 1
177 . 1 1 22 22 ARG N N 15 123.999 0.300 . 1 . . . . 22 ARG N . 11404 1
178 . 1 1 23 23 THR H H 1 7.212 0.030 . 1 . . . . 23 THR H . 11404 1
179 . 1 1 23 23 THR HA H 1 4.565 0.030 . 1 . . . . 23 THR HA . 11404 1
180 . 1 1 23 23 THR HB H 1 4.439 0.030 . 1 . . . . 23 THR HB . 11404 1
181 . 1 1 23 23 THR HG21 H 1 1.119 0.030 . 1 . . . . 23 THR HG2 . 11404 1
182 . 1 1 23 23 THR HG22 H 1 1.119 0.030 . 1 . . . . 23 THR HG2 . 11404 1
183 . 1 1 23 23 THR HG23 H 1 1.119 0.030 . 1 . . . . 23 THR HG2 . 11404 1
184 . 1 1 23 23 THR C C 13 175.369 0.300 . 1 . . . . 23 THR C . 11404 1
185 . 1 1 23 23 THR CA C 13 59.305 0.300 . 1 . . . . 23 THR CA . 11404 1
186 . 1 1 23 23 THR CB C 13 72.925 0.300 . 1 . . . . 23 THR CB . 11404 1
187 . 1 1 23 23 THR CG2 C 13 21.201 0.300 . 1 . . . . 23 THR CG2 . 11404 1
188 . 1 1 23 23 THR N N 15 105.886 0.300 . 1 . . . . 23 THR N . 11404 1
189 . 1 1 24 24 ALA HA H 1 4.226 0.030 . 1 . . . . 24 ALA HA . 11404 1
190 . 1 1 24 24 ALA HB1 H 1 1.459 0.030 . 1 . . . . 24 ALA HB . 11404 1
191 . 1 1 24 24 ALA HB2 H 1 1.459 0.030 . 1 . . . . 24 ALA HB . 11404 1
192 . 1 1 24 24 ALA HB3 H 1 1.459 0.030 . 1 . . . . 24 ALA HB . 11404 1
193 . 1 1 24 24 ALA C C 13 177.849 0.300 . 1 . . . . 24 ALA C . 11404 1
194 . 1 1 24 24 ALA CA C 13 54.354 0.300 . 1 . . . . 24 ALA CA . 11404 1
195 . 1 1 24 24 ALA CB C 13 18.428 0.300 . 1 . . . . 24 ALA CB . 11404 1
196 . 1 1 25 25 GLN H H 1 7.776 0.030 . 1 . . . . 25 GLN H . 11404 1
197 . 1 1 25 25 GLN HA H 1 4.364 0.030 . 1 . . . . 25 GLN HA . 11404 1
198 . 1 1 25 25 GLN HB2 H 1 2.153 0.030 . 2 . . . . 25 GLN HB2 . 11404 1
199 . 1 1 25 25 GLN HB3 H 1 1.882 0.030 . 2 . . . . 25 GLN HB3 . 11404 1
200 . 1 1 25 25 GLN HE21 H 1 7.515 0.030 . 2 . . . . 25 GLN HE21 . 11404 1
201 . 1 1 25 25 GLN HE22 H 1 6.822 0.030 . 2 . . . . 25 GLN HE22 . 11404 1
202 . 1 1 25 25 GLN HG2 H 1 2.319 0.030 . 2 . . . . 25 GLN HG2 . 11404 1
203 . 1 1 25 25 GLN HG3 H 1 2.403 0.030 . 2 . . . . 25 GLN HG3 . 11404 1
204 . 1 1 25 25 GLN C C 13 176.075 0.300 . 1 . . . . 25 GLN C . 11404 1
205 . 1 1 25 25 GLN CA C 13 56.750 0.300 . 1 . . . . 25 GLN CA . 11404 1
206 . 1 1 25 25 GLN CB C 13 29.532 0.300 . 1 . . . . 25 GLN CB . 11404 1
207 . 1 1 25 25 GLN CG C 13 34.844 0.300 . 1 . . . . 25 GLN CG . 11404 1
208 . 1 1 25 25 GLN N N 15 113.508 0.300 . 1 . . . . 25 GLN N . 11404 1
209 . 1 1 25 25 GLN NE2 N 15 112.387 0.300 . 1 . . . . 25 GLN NE2 . 11404 1
210 . 1 1 26 26 GLU H H 1 7.559 0.030 . 1 . . . . 26 GLU H . 11404 1
211 . 1 1 26 26 GLU HA H 1 4.728 0.030 . 1 . . . . 26 GLU HA . 11404 1
212 . 1 1 26 26 GLU HB2 H 1 2.036 0.030 . 2 . . . . 26 GLU HB2 . 11404 1
213 . 1 1 26 26 GLU HB3 H 1 2.642 0.030 . 2 . . . . 26 GLU HB3 . 11404 1
214 . 1 1 26 26 GLU HG2 H 1 2.207 0.030 . 2 . . . . 26 GLU HG2 . 11404 1
215 . 1 1 26 26 GLU HG3 H 1 2.056 0.030 . 2 . . . . 26 GLU HG3 . 11404 1
216 . 1 1 26 26 GLU C C 13 175.749 0.300 . 1 . . . . 26 GLU C . 11404 1
217 . 1 1 26 26 GLU CA C 13 56.099 0.300 . 1 . . . . 26 GLU CA . 11404 1
218 . 1 1 26 26 GLU CB C 13 33.162 0.300 . 1 . . . . 26 GLU CB . 11404 1
219 . 1 1 26 26 GLU CG C 13 36.469 0.300 . 1 . . . . 26 GLU CG . 11404 1
220 . 1 1 26 26 GLU N N 15 119.298 0.300 . 1 . . . . 26 GLU N . 11404 1
221 . 1 1 27 27 LEU H H 1 8.680 0.030 . 1 . . . . 27 LEU H . 11404 1
222 . 1 1 27 27 LEU HA H 1 4.550 0.030 . 1 . . . . 27 LEU HA . 11404 1
223 . 1 1 27 27 LEU HB2 H 1 1.800 0.030 . 2 . . . . 27 LEU HB2 . 11404 1
224 . 1 1 27 27 LEU HB3 H 1 1.630 0.030 . 2 . . . . 27 LEU HB3 . 11404 1
225 . 1 1 27 27 LEU HD11 H 1 0.892 0.030 . 1 . . . . 27 LEU HD1 . 11404 1
226 . 1 1 27 27 LEU HD12 H 1 0.892 0.030 . 1 . . . . 27 LEU HD1 . 11404 1
227 . 1 1 27 27 LEU HD13 H 1 0.892 0.030 . 1 . . . . 27 LEU HD1 . 11404 1
228 . 1 1 27 27 LEU HD21 H 1 0.862 0.030 . 1 . . . . 27 LEU HD2 . 11404 1
229 . 1 1 27 27 LEU HD22 H 1 0.862 0.030 . 1 . . . . 27 LEU HD2 . 11404 1
230 . 1 1 27 27 LEU HD23 H 1 0.862 0.030 . 1 . . . . 27 LEU HD2 . 11404 1
231 . 1 1 27 27 LEU HG H 1 1.497 0.030 . 1 . . . . 27 LEU HG . 11404 1
232 . 1 1 27 27 LEU C C 13 175.320 0.300 . 1 . . . . 27 LEU C . 11404 1
233 . 1 1 27 27 LEU CA C 13 54.601 0.300 . 1 . . . . 27 LEU CA . 11404 1
234 . 1 1 27 27 LEU CB C 13 43.337 0.300 . 1 . . . . 27 LEU CB . 11404 1
235 . 1 1 27 27 LEU CD1 C 13 22.776 0.300 . 2 . . . . 27 LEU CD1 . 11404 1
236 . 1 1 27 27 LEU CD2 C 13 25.840 0.300 . 2 . . . . 27 LEU CD2 . 11404 1
237 . 1 1 27 27 LEU CG C 13 27.445 0.300 . 1 . . . . 27 LEU CG . 11404 1
238 . 1 1 27 27 LEU N N 15 122.492 0.300 . 1 . . . . 27 LEU N . 11404 1
239 . 1 1 28 28 SER H H 1 7.839 0.030 . 1 . . . . 28 SER H . 11404 1
240 . 1 1 28 28 SER HA H 1 4.963 0.030 . 1 . . . . 28 SER HA . 11404 1
241 . 1 1 28 28 SER HB2 H 1 3.994 0.030 . 2 . . . . 28 SER HB2 . 11404 1
242 . 1 1 28 28 SER HB3 H 1 3.727 0.030 . 2 . . . . 28 SER HB3 . 11404 1
243 . 1 1 28 28 SER C C 13 173.608 0.300 . 1 . . . . 28 SER C . 11404 1
244 . 1 1 28 28 SER CA C 13 57.308 0.300 . 1 . . . . 28 SER CA . 11404 1
245 . 1 1 28 28 SER CB C 13 65.214 0.300 . 1 . . . . 28 SER CB . 11404 1
246 . 1 1 28 28 SER N N 15 111.422 0.300 . 1 . . . . 28 SER N . 11404 1
247 . 1 1 29 29 PHE H H 1 8.432 0.030 . 1 . . . . 29 PHE H . 11404 1
248 . 1 1 29 29 PHE HA H 1 4.845 0.030 . 1 . . . . 29 PHE HA . 11404 1
249 . 1 1 29 29 PHE HB2 H 1 3.068 0.030 . 2 . . . . 29 PHE HB2 . 11404 1
250 . 1 1 29 29 PHE HB3 H 1 2.771 0.030 . 2 . . . . 29 PHE HB3 . 11404 1
251 . 1 1 29 29 PHE HD1 H 1 6.731 0.030 . 1 . . . . 29 PHE HD1 . 11404 1
252 . 1 1 29 29 PHE HD2 H 1 6.731 0.030 . 1 . . . . 29 PHE HD2 . 11404 1
253 . 1 1 29 29 PHE HE1 H 1 7.455 0.030 . 1 . . . . 29 PHE HE1 . 11404 1
254 . 1 1 29 29 PHE HE2 H 1 7.455 0.030 . 1 . . . . 29 PHE HE2 . 11404 1
255 . 1 1 29 29 PHE HZ H 1 6.764 0.030 . 1 . . . . 29 PHE HZ . 11404 1
256 . 1 1 29 29 PHE C C 13 174.335 0.300 . 1 . . . . 29 PHE C . 11404 1
257 . 1 1 29 29 PHE CA C 13 56.427 0.300 . 1 . . . . 29 PHE CA . 11404 1
258 . 1 1 29 29 PHE CB C 13 39.396 0.300 . 1 . . . . 29 PHE CB . 11404 1
259 . 1 1 29 29 PHE CD1 C 13 133.178 0.300 . 1 . . . . 29 PHE CD1 . 11404 1
260 . 1 1 29 29 PHE CD2 C 13 133.178 0.300 . 1 . . . . 29 PHE CD2 . 11404 1
261 . 1 1 29 29 PHE CE1 C 13 131.501 0.300 . 1 . . . . 29 PHE CE1 . 11404 1
262 . 1 1 29 29 PHE CE2 C 13 131.501 0.300 . 1 . . . . 29 PHE CE2 . 11404 1
263 . 1 1 29 29 PHE CZ C 13 128.843 0.300 . 1 . . . . 29 PHE CZ . 11404 1
264 . 1 1 29 29 PHE N N 15 116.967 0.300 . 1 . . . . 29 PHE N . 11404 1
265 . 1 1 30 30 ARG H H 1 9.271 0.030 . 1 . . . . 30 ARG H . 11404 1
266 . 1 1 30 30 ARG HA H 1 4.509 0.030 . 1 . . . . 30 ARG HA . 11404 1
267 . 1 1 30 30 ARG HB2 H 1 1.798 0.030 . 2 . . . . 30 ARG HB2 . 11404 1
268 . 1 1 30 30 ARG HB3 H 1 1.908 0.030 . 2 . . . . 30 ARG HB3 . 11404 1
269 . 1 1 30 30 ARG HD2 H 1 3.239 0.030 . 1 . . . . 30 ARG HD2 . 11404 1
270 . 1 1 30 30 ARG HD3 H 1 3.239 0.030 . 1 . . . . 30 ARG HD3 . 11404 1
271 . 1 1 30 30 ARG HG2 H 1 1.711 0.030 . 2 . . . . 30 ARG HG2 . 11404 1
272 . 1 1 30 30 ARG HG3 H 1 1.671 0.030 . 2 . . . . 30 ARG HG3 . 11404 1
273 . 1 1 30 30 ARG C C 13 176.070 0.300 . 1 . . . . 30 ARG C . 11404 1
274 . 1 1 30 30 ARG CA C 13 54.342 0.300 . 1 . . . . 30 ARG CA . 11404 1
275 . 1 1 30 30 ARG CB C 13 31.971 0.300 . 1 . . . . 30 ARG CB . 11404 1
276 . 1 1 30 30 ARG CD C 13 43.313 0.300 . 1 . . . . 30 ARG CD . 11404 1
277 . 1 1 30 30 ARG CG C 13 27.691 0.300 . 1 . . . . 30 ARG CG . 11404 1
278 . 1 1 30 30 ARG N N 15 121.295 0.300 . 1 . . . . 30 ARG N . 11404 1
279 . 1 1 31 31 ARG H H 1 8.233 0.030 . 1 . . . . 31 ARG H . 11404 1
280 . 1 1 31 31 ARG HA H 1 3.399 0.030 . 1 . . . . 31 ARG HA . 11404 1
281 . 1 1 31 31 ARG HB2 H 1 1.714 0.030 . 2 . . . . 31 ARG HB2 . 11404 1
282 . 1 1 31 31 ARG HB3 H 1 1.537 0.030 . 2 . . . . 31 ARG HB3 . 11404 1
283 . 1 1 31 31 ARG HD2 H 1 3.186 0.030 . 2 . . . . 31 ARG HD2 . 11404 1
284 . 1 1 31 31 ARG HD3 H 1 3.125 0.030 . 2 . . . . 31 ARG HD3 . 11404 1
285 . 1 1 31 31 ARG HG2 H 1 1.351 0.030 . 1 . . . . 31 ARG HG2 . 11404 1
286 . 1 1 31 31 ARG HG3 H 1 1.351 0.030 . 1 . . . . 31 ARG HG3 . 11404 1
287 . 1 1 31 31 ARG C C 13 177.379 0.300 . 1 . . . . 31 ARG C . 11404 1
288 . 1 1 31 31 ARG CA C 13 58.780 0.300 . 1 . . . . 31 ARG CA . 11404 1
289 . 1 1 31 31 ARG CB C 13 29.891 0.300 . 1 . . . . 31 ARG CB . 11404 1
290 . 1 1 31 31 ARG CD C 13 43.473 0.300 . 1 . . . . 31 ARG CD . 11404 1
291 . 1 1 31 31 ARG CG C 13 27.384 0.300 . 1 . . . . 31 ARG CG . 11404 1
292 . 1 1 31 31 ARG N N 15 120.122 0.300 . 1 . . . . 31 ARG N . 11404 1
293 . 1 1 32 32 GLY H H 1 8.899 0.030 . 1 . . . . 32 GLY H . 11404 1
294 . 1 1 32 32 GLY HA2 H 1 4.382 0.030 . 2 . . . . 32 GLY HA2 . 11404 1
295 . 1 1 32 32 GLY HA3 H 1 3.419 0.030 . 2 . . . . 32 GLY HA3 . 11404 1
296 . 1 1 32 32 GLY C C 13 173.950 0.300 . 1 . . . . 32 GLY C . 11404 1
297 . 1 1 32 32 GLY CA C 13 44.965 0.300 . 1 . . . . 32 GLY CA . 11404 1
298 . 1 1 32 32 GLY N N 15 115.661 0.300 . 1 . . . . 32 GLY N . 11404 1
299 . 1 1 33 33 ASP H H 1 7.830 0.030 . 1 . . . . 33 ASP H . 11404 1
300 . 1 1 33 33 ASP HA H 1 4.604 0.030 . 1 . . . . 33 ASP HA . 11404 1
301 . 1 1 33 33 ASP HB2 H 1 2.817 0.030 . 2 . . . . 33 ASP HB2 . 11404 1
302 . 1 1 33 33 ASP HB3 H 1 2.351 0.030 . 2 . . . . 33 ASP HB3 . 11404 1
303 . 1 1 33 33 ASP C C 13 174.706 0.300 . 1 . . . . 33 ASP C . 11404 1
304 . 1 1 33 33 ASP CA C 13 55.446 0.300 . 1 . . . . 33 ASP CA . 11404 1
305 . 1 1 33 33 ASP CB C 13 41.416 0.300 . 1 . . . . 33 ASP CB . 11404 1
306 . 1 1 33 33 ASP N N 15 121.835 0.300 . 1 . . . . 33 ASP N . 11404 1
307 . 1 1 34 34 VAL H H 1 8.409 0.030 . 1 . . . . 34 VAL H . 11404 1
308 . 1 1 34 34 VAL HA H 1 4.361 0.030 . 1 . . . . 34 VAL HA . 11404 1
309 . 1 1 34 34 VAL HB H 1 1.954 0.030 . 1 . . . . 34 VAL HB . 11404 1
310 . 1 1 34 34 VAL HG11 H 1 0.969 0.030 . 1 . . . . 34 VAL HG1 . 11404 1
311 . 1 1 34 34 VAL HG12 H 1 0.969 0.030 . 1 . . . . 34 VAL HG1 . 11404 1
312 . 1 1 34 34 VAL HG13 H 1 0.969 0.030 . 1 . . . . 34 VAL HG1 . 11404 1
313 . 1 1 34 34 VAL HG21 H 1 0.794 0.030 . 1 . . . . 34 VAL HG2 . 11404 1
314 . 1 1 34 34 VAL HG22 H 1 0.794 0.030 . 1 . . . . 34 VAL HG2 . 11404 1
315 . 1 1 34 34 VAL HG23 H 1 0.794 0.030 . 1 . . . . 34 VAL HG2 . 11404 1
316 . 1 1 34 34 VAL C C 13 175.614 0.300 . 1 . . . . 34 VAL C . 11404 1
317 . 1 1 34 34 VAL CA C 13 62.421 0.300 . 1 . . . . 34 VAL CA . 11404 1
318 . 1 1 34 34 VAL CB C 13 32.082 0.300 . 1 . . . . 34 VAL CB . 11404 1
319 . 1 1 34 34 VAL CG1 C 13 21.525 0.300 . 2 . . . . 34 VAL CG1 . 11404 1
320 . 1 1 34 34 VAL CG2 C 13 21.531 0.300 . 2 . . . . 34 VAL CG2 . 11404 1
321 . 1 1 34 34 VAL N N 15 120.889 0.300 . 1 . . . . 34 VAL N . 11404 1
322 . 1 1 35 35 LEU H H 1 8.759 0.030 . 1 . . . . 35 LEU H . 11404 1
323 . 1 1 35 35 LEU HA H 1 4.645 0.030 . 1 . . . . 35 LEU HA . 11404 1
324 . 1 1 35 35 LEU HB2 H 1 1.040 0.030 . 2 . . . . 35 LEU HB2 . 11404 1
325 . 1 1 35 35 LEU HB3 H 1 1.131 0.030 . 2 . . . . 35 LEU HB3 . 11404 1
326 . 1 1 35 35 LEU HD11 H 1 -0.084 0.030 . 1 . . . . 35 LEU HD1 . 11404 1
327 . 1 1 35 35 LEU HD12 H 1 -0.084 0.030 . 1 . . . . 35 LEU HD1 . 11404 1
328 . 1 1 35 35 LEU HD13 H 1 -0.084 0.030 . 1 . . . . 35 LEU HD1 . 11404 1
329 . 1 1 35 35 LEU HD21 H 1 0.117 0.030 . 1 . . . . 35 LEU HD2 . 11404 1
330 . 1 1 35 35 LEU HD22 H 1 0.117 0.030 . 1 . . . . 35 LEU HD2 . 11404 1
331 . 1 1 35 35 LEU HD23 H 1 0.117 0.030 . 1 . . . . 35 LEU HD2 . 11404 1
332 . 1 1 35 35 LEU HG H 1 1.147 0.030 . 1 . . . . 35 LEU HG . 11404 1
333 . 1 1 35 35 LEU C C 13 175.398 0.300 . 1 . . . . 35 LEU C . 11404 1
334 . 1 1 35 35 LEU CA C 13 53.100 0.300 . 1 . . . . 35 LEU CA . 11404 1
335 . 1 1 35 35 LEU CB C 13 43.973 0.300 . 1 . . . . 35 LEU CB . 11404 1
336 . 1 1 35 35 LEU CD1 C 13 25.143 0.300 . 2 . . . . 35 LEU CD1 . 11404 1
337 . 1 1 35 35 LEU CD2 C 13 23.902 0.300 . 2 . . . . 35 LEU CD2 . 11404 1
338 . 1 1 35 35 LEU CG C 13 26.995 0.300 . 1 . . . . 35 LEU CG . 11404 1
339 . 1 1 35 35 LEU N N 15 128.495 0.300 . 1 . . . . 35 LEU N . 11404 1
340 . 1 1 36 36 ARG H H 1 8.115 0.030 . 1 . . . . 36 ARG H . 11404 1
341 . 1 1 36 36 ARG HA H 1 4.650 0.030 . 1 . . . . 36 ARG HA . 11404 1
342 . 1 1 36 36 ARG HB2 H 1 1.819 0.030 . 2 . . . . 36 ARG HB2 . 11404 1
343 . 1 1 36 36 ARG HB3 H 1 1.555 0.030 . 2 . . . . 36 ARG HB3 . 11404 1
344 . 1 1 36 36 ARG HD2 H 1 3.104 0.030 . 2 . . . . 36 ARG HD2 . 11404 1
345 . 1 1 36 36 ARG HD3 H 1 3.193 0.030 . 2 . . . . 36 ARG HD3 . 11404 1
346 . 1 1 36 36 ARG HG2 H 1 1.449 0.030 . 2 . . . . 36 ARG HG2 . 11404 1
347 . 1 1 36 36 ARG HG3 H 1 1.613 0.030 . 2 . . . . 36 ARG HG3 . 11404 1
348 . 1 1 36 36 ARG C C 13 175.091 0.300 . 1 . . . . 36 ARG C . 11404 1
349 . 1 1 36 36 ARG CA C 13 55.299 0.300 . 1 . . . . 36 ARG CA . 11404 1
350 . 1 1 36 36 ARG CB C 13 31.287 0.300 . 1 . . . . 36 ARG CB . 11404 1
351 . 1 1 36 36 ARG CD C 13 43.395 0.300 . 1 . . . . 36 ARG CD . 11404 1
352 . 1 1 36 36 ARG CG C 13 28.430 0.300 . 1 . . . . 36 ARG CG . 11404 1
353 . 1 1 36 36 ARG N N 15 120.618 0.300 . 1 . . . . 36 ARG N . 11404 1
354 . 1 1 37 37 LEU H H 1 9.036 0.030 . 1 . . . . 37 LEU H . 11404 1
355 . 1 1 37 37 LEU HA H 1 4.353 0.030 . 1 . . . . 37 LEU HA . 11404 1
356 . 1 1 37 37 LEU HB2 H 1 1.475 0.030 . 2 . . . . 37 LEU HB2 . 11404 1
357 . 1 1 37 37 LEU HB3 H 1 1.043 0.030 . 2 . . . . 37 LEU HB3 . 11404 1
358 . 1 1 37 37 LEU HD11 H 1 0.019 0.030 . 1 . . . . 37 LEU HD1 . 11404 1
359 . 1 1 37 37 LEU HD12 H 1 0.019 0.030 . 1 . . . . 37 LEU HD1 . 11404 1
360 . 1 1 37 37 LEU HD13 H 1 0.019 0.030 . 1 . . . . 37 LEU HD1 . 11404 1
361 . 1 1 37 37 LEU HD21 H 1 -0.666 0.030 . 1 . . . . 37 LEU HD2 . 11404 1
362 . 1 1 37 37 LEU HD22 H 1 -0.666 0.030 . 1 . . . . 37 LEU HD2 . 11404 1
363 . 1 1 37 37 LEU HD23 H 1 -0.666 0.030 . 1 . . . . 37 LEU HD2 . 11404 1
364 . 1 1 37 37 LEU HG H 1 1.135 0.030 . 1 . . . . 37 LEU HG . 11404 1
365 . 1 1 37 37 LEU C C 13 175.716 0.300 . 1 . . . . 37 LEU C . 11404 1
366 . 1 1 37 37 LEU CA C 13 54.243 0.300 . 1 . . . . 37 LEU CA . 11404 1
367 . 1 1 37 37 LEU CB C 13 41.436 0.300 . 1 . . . . 37 LEU CB . 11404 1
368 . 1 1 37 37 LEU CD1 C 13 22.192 0.300 . 2 . . . . 37 LEU CD1 . 11404 1
369 . 1 1 37 37 LEU CD2 C 13 23.794 0.300 . 2 . . . . 37 LEU CD2 . 11404 1
370 . 1 1 37 37 LEU CG C 13 25.645 0.300 . 1 . . . . 37 LEU CG . 11404 1
371 . 1 1 37 37 LEU N N 15 122.849 0.300 . 1 . . . . 37 LEU N . 11404 1
372 . 1 1 38 38 HIS H H 1 9.296 0.030 . 1 . . . . 38 HIS H . 11404 1
373 . 1 1 38 38 HIS HA H 1 4.962 0.030 . 1 . . . . 38 HIS HA . 11404 1
374 . 1 1 38 38 HIS HB2 H 1 3.223 0.030 . 2 . . . . 38 HIS HB2 . 11404 1
375 . 1 1 38 38 HIS HB3 H 1 2.993 0.030 . 2 . . . . 38 HIS HB3 . 11404 1
376 . 1 1 38 38 HIS HD2 H 1 6.751 0.030 . 1 . . . . 38 HIS HD2 . 11404 1
377 . 1 1 38 38 HIS HE1 H 1 7.562 0.030 . 1 . . . . 38 HIS HE1 . 11404 1
378 . 1 1 38 38 HIS C C 13 176.242 0.300 . 1 . . . . 38 HIS C . 11404 1
379 . 1 1 38 38 HIS CA C 13 57.331 0.300 . 1 . . . . 38 HIS CA . 11404 1
380 . 1 1 38 38 HIS CB C 13 33.100 0.300 . 1 . . . . 38 HIS CB . 11404 1
381 . 1 1 38 38 HIS CD2 C 13 116.738 0.300 . 1 . . . . 38 HIS CD2 . 11404 1
382 . 1 1 38 38 HIS CE1 C 13 138.391 0.300 . 1 . . . . 38 HIS CE1 . 11404 1
383 . 1 1 38 38 HIS N N 15 121.785 0.300 . 1 . . . . 38 HIS N . 11404 1
384 . 1 1 39 39 GLU H H 1 8.185 0.030 . 1 . . . . 39 GLU H . 11404 1
385 . 1 1 39 39 GLU HA H 1 4.742 0.030 . 1 . . . . 39 GLU HA . 11404 1
386 . 1 1 39 39 GLU HB2 H 1 2.094 0.030 . 1 . . . . 39 GLU HB2 . 11404 1
387 . 1 1 39 39 GLU HB3 H 1 2.094 0.030 . 1 . . . . 39 GLU HB3 . 11404 1
388 . 1 1 39 39 GLU HG2 H 1 2.157 0.030 . 1 . . . . 39 GLU HG2 . 11404 1
389 . 1 1 39 39 GLU HG3 H 1 2.157 0.030 . 1 . . . . 39 GLU HG3 . 11404 1
390 . 1 1 39 39 GLU C C 13 175.757 0.300 . 1 . . . . 39 GLU C . 11404 1
391 . 1 1 39 39 GLU CA C 13 55.728 0.300 . 1 . . . . 39 GLU CA . 11404 1
392 . 1 1 39 39 GLU CB C 13 33.447 0.300 . 1 . . . . 39 GLU CB . 11404 1
393 . 1 1 39 39 GLU CG C 13 35.772 0.300 . 1 . . . . 39 GLU CG . 11404 1
394 . 1 1 39 39 GLU N N 15 114.606 0.300 . 1 . . . . 39 GLU N . 11404 1
395 . 1 1 40 40 ARG H H 1 9.197 0.030 . 1 . . . . 40 ARG H . 11404 1
396 . 1 1 40 40 ARG HA H 1 3.714 0.030 . 1 . . . . 40 ARG HA . 11404 1
397 . 1 1 40 40 ARG HB2 H 1 0.441 0.030 . 2 . . . . 40 ARG HB2 . 11404 1
398 . 1 1 40 40 ARG HB3 H 1 1.559 0.030 . 2 . . . . 40 ARG HB3 . 11404 1
399 . 1 1 40 40 ARG HD2 H 1 1.297 0.030 . 2 . . . . 40 ARG HD2 . 11404 1
400 . 1 1 40 40 ARG HD3 H 1 2.007 0.030 . 2 . . . . 40 ARG HD3 . 11404 1
401 . 1 1 40 40 ARG HG2 H 1 0.887 0.030 . 2 . . . . 40 ARG HG2 . 11404 1
402 . 1 1 40 40 ARG HG3 H 1 0.434 0.030 . 2 . . . . 40 ARG HG3 . 11404 1
403 . 1 1 40 40 ARG C C 13 174.854 0.300 . 1 . . . . 40 ARG C . 11404 1
404 . 1 1 40 40 ARG CA C 13 55.352 0.300 . 1 . . . . 40 ARG CA . 11404 1
405 . 1 1 40 40 ARG CB C 13 29.790 0.300 . 1 . . . . 40 ARG CB . 11404 1
406 . 1 1 40 40 ARG CD C 13 42.196 0.300 . 1 . . . . 40 ARG CD . 11404 1
407 . 1 1 40 40 ARG CG C 13 26.211 0.300 . 1 . . . . 40 ARG CG . 11404 1
408 . 1 1 40 40 ARG N N 15 128.658 0.300 . 1 . . . . 40 ARG N . 11404 1
409 . 1 1 41 41 ALA H H 1 8.429 0.030 . 1 . . . . 41 ALA H . 11404 1
410 . 1 1 41 41 ALA HA H 1 4.274 0.030 . 1 . . . . 41 ALA HA . 11404 1
411 . 1 1 41 41 ALA HB1 H 1 1.302 0.030 . 1 . . . . 41 ALA HB . 11404 1
412 . 1 1 41 41 ALA HB2 H 1 1.302 0.030 . 1 . . . . 41 ALA HB . 11404 1
413 . 1 1 41 41 ALA HB3 H 1 1.302 0.030 . 1 . . . . 41 ALA HB . 11404 1
414 . 1 1 41 41 ALA C C 13 177.248 0.300 . 1 . . . . 41 ALA C . 11404 1
415 . 1 1 41 41 ALA CA C 13 54.247 0.300 . 1 . . . . 41 ALA CA . 11404 1
416 . 1 1 41 41 ALA CB C 13 19.510 0.300 . 1 . . . . 41 ALA CB . 11404 1
417 . 1 1 41 41 ALA N N 15 133.328 0.300 . 1 . . . . 41 ALA N . 11404 1
418 . 1 1 42 42 SER H H 1 8.543 0.030 . 1 . . . . 42 SER H . 11404 1
419 . 1 1 42 42 SER HA H 1 4.527 0.030 . 1 . . . . 42 SER HA . 11404 1
420 . 1 1 42 42 SER HB2 H 1 4.152 0.030 . 2 . . . . 42 SER HB2 . 11404 1
421 . 1 1 42 42 SER HB3 H 1 4.234 0.030 . 2 . . . . 42 SER HB3 . 11404 1
422 . 1 1 42 42 SER C C 13 174.521 0.300 . 1 . . . . 42 SER C . 11404 1
423 . 1 1 42 42 SER CA C 13 57.057 0.300 . 1 . . . . 42 SER CA . 11404 1
424 . 1 1 42 42 SER CB C 13 64.580 0.300 . 1 . . . . 42 SER CB . 11404 1
425 . 1 1 42 42 SER N N 15 110.385 0.300 . 1 . . . . 42 SER N . 11404 1
426 . 1 1 44 44 ASP HA H 1 4.715 0.030 . 1 . . . . 44 ASP HA . 11404 1
427 . 1 1 44 44 ASP HB2 H 1 2.423 0.030 . 2 . . . . 44 ASP HB2 . 11404 1
428 . 1 1 44 44 ASP HB3 H 1 2.345 0.030 . 2 . . . . 44 ASP HB3 . 11404 1
429 . 1 1 44 44 ASP C C 13 176.656 0.300 . 1 . . . . 44 ASP C . 11404 1
430 . 1 1 44 44 ASP CA C 13 54.906 0.300 . 1 . . . . 44 ASP CA . 11404 1
431 . 1 1 44 44 ASP CB C 13 42.902 0.300 . 1 . . . . 44 ASP CB . 11404 1
432 . 1 1 45 45 TRP H H 1 7.350 0.030 . 1 . . . . 45 TRP H . 11404 1
433 . 1 1 45 45 TRP HA H 1 5.494 0.030 . 1 . . . . 45 TRP HA . 11404 1
434 . 1 1 45 45 TRP HB2 H 1 3.170 0.030 . 2 . . . . 45 TRP HB2 . 11404 1
435 . 1 1 45 45 TRP HB3 H 1 2.936 0.030 . 2 . . . . 45 TRP HB3 . 11404 1
436 . 1 1 45 45 TRP HD1 H 1 7.075 0.030 . 1 . . . . 45 TRP HD1 . 11404 1
437 . 1 1 45 45 TRP HE1 H 1 10.167 0.030 . 1 . . . . 45 TRP HE1 . 11404 1
438 . 1 1 45 45 TRP HE3 H 1 7.454 0.030 . 1 . . . . 45 TRP HE3 . 11404 1
439 . 1 1 45 45 TRP HH2 H 1 7.234 0.030 . 1 . . . . 45 TRP HH2 . 11404 1
440 . 1 1 45 45 TRP HZ2 H 1 7.454 0.030 . 1 . . . . 45 TRP HZ2 . 11404 1
441 . 1 1 45 45 TRP HZ3 H 1 6.710 0.030 . 1 . . . . 45 TRP HZ3 . 11404 1
442 . 1 1 45 45 TRP C C 13 174.577 0.300 . 1 . . . . 45 TRP C . 11404 1
443 . 1 1 45 45 TRP CA C 13 57.124 0.300 . 1 . . . . 45 TRP CA . 11404 1
444 . 1 1 45 45 TRP CB C 13 34.263 0.300 . 1 . . . . 45 TRP CB . 11404 1
445 . 1 1 45 45 TRP CD1 C 13 127.707 0.300 . 1 . . . . 45 TRP CD1 . 11404 1
446 . 1 1 45 45 TRP CE3 C 13 120.710 0.300 . 1 . . . . 45 TRP CE3 . 11404 1
447 . 1 1 45 45 TRP CH2 C 13 124.911 0.300 . 1 . . . . 45 TRP CH2 . 11404 1
448 . 1 1 45 45 TRP CZ2 C 13 114.604 0.300 . 1 . . . . 45 TRP CZ2 . 11404 1
449 . 1 1 45 45 TRP CZ3 C 13 120.674 0.300 . 1 . . . . 45 TRP CZ3 . 11404 1
450 . 1 1 45 45 TRP N N 15 119.534 0.300 . 1 . . . . 45 TRP N . 11404 1
451 . 1 1 45 45 TRP NE1 N 15 128.781 0.300 . 1 . . . . 45 TRP NE1 . 11404 1
452 . 1 1 46 46 TRP H H 1 10.000 0.030 . 1 . . . . 46 TRP H . 11404 1
453 . 1 1 46 46 TRP HA H 1 5.086 0.030 . 1 . . . . 46 TRP HA . 11404 1
454 . 1 1 46 46 TRP HB2 H 1 3.295 0.030 . 2 . . . . 46 TRP HB2 . 11404 1
455 . 1 1 46 46 TRP HB3 H 1 2.978 0.030 . 2 . . . . 46 TRP HB3 . 11404 1
456 . 1 1 46 46 TRP HD1 H 1 6.927 0.030 . 1 . . . . 46 TRP HD1 . 11404 1
457 . 1 1 46 46 TRP HE1 H 1 13.444 0.030 . 1 . . . . 46 TRP HE1 . 11404 1
458 . 1 1 46 46 TRP HE3 H 1 7.285 0.030 . 1 . . . . 46 TRP HE3 . 11404 1
459 . 1 1 46 46 TRP HH2 H 1 7.151 0.030 . 1 . . . . 46 TRP HH2 . 11404 1
460 . 1 1 46 46 TRP HZ2 H 1 7.402 0.030 . 1 . . . . 46 TRP HZ2 . 11404 1
461 . 1 1 46 46 TRP HZ3 H 1 6.966 0.030 . 1 . . . . 46 TRP HZ3 . 11404 1
462 . 1 1 46 46 TRP C C 13 176.169 0.300 . 1 . . . . 46 TRP C . 11404 1
463 . 1 1 46 46 TRP CA C 13 56.518 0.300 . 1 . . . . 46 TRP CA . 11404 1
464 . 1 1 46 46 TRP CB C 13 32.355 0.300 . 1 . . . . 46 TRP CB . 11404 1
465 . 1 1 46 46 TRP CD1 C 13 125.705 0.300 . 1 . . . . 46 TRP CD1 . 11404 1
466 . 1 1 46 46 TRP CE3 C 13 120.162 0.300 . 1 . . . . 46 TRP CE3 . 11404 1
467 . 1 1 46 46 TRP CH2 C 13 124.290 0.300 . 1 . . . . 46 TRP CH2 . 11404 1
468 . 1 1 46 46 TRP CZ2 C 13 115.206 0.300 . 1 . . . . 46 TRP CZ2 . 11404 1
469 . 1 1 46 46 TRP CZ3 C 13 121.989 0.300 . 1 . . . . 46 TRP CZ3 . 11404 1
470 . 1 1 46 46 TRP N N 15 122.106 0.300 . 1 . . . . 46 TRP N . 11404 1
471 . 1 1 47 47 ARG H H 1 9.715 0.030 . 1 . . . . 47 ARG H . 11404 1
472 . 1 1 47 47 ARG HA H 1 5.080 0.030 . 1 . . . . 47 ARG HA . 11404 1
473 . 1 1 47 47 ARG HB2 H 1 1.903 0.030 . 2 . . . . 47 ARG HB2 . 11404 1
474 . 1 1 47 47 ARG HB3 H 1 2.121 0.030 . 2 . . . . 47 ARG HB3 . 11404 1
475 . 1 1 47 47 ARG HD2 H 1 3.272 0.030 . 1 . . . . 47 ARG HD2 . 11404 1
476 . 1 1 47 47 ARG HD3 H 1 3.272 0.030 . 1 . . . . 47 ARG HD3 . 11404 1
477 . 1 1 47 47 ARG HG2 H 1 1.659 0.030 . 1 . . . . 47 ARG HG2 . 11404 1
478 . 1 1 47 47 ARG HG3 H 1 1.659 0.030 . 1 . . . . 47 ARG HG3 . 11404 1
479 . 1 1 47 47 ARG C C 13 176.900 0.300 . 1 . . . . 47 ARG C . 11404 1
480 . 1 1 47 47 ARG CA C 13 56.160 0.300 . 1 . . . . 47 ARG CA . 11404 1
481 . 1 1 47 47 ARG CB C 13 31.473 0.300 . 1 . . . . 47 ARG CB . 11404 1
482 . 1 1 47 47 ARG CD C 13 43.231 0.300 . 1 . . . . 47 ARG CD . 11404 1
483 . 1 1 47 47 ARG CG C 13 29.089 0.300 . 1 . . . . 47 ARG CG . 11404 1
484 . 1 1 47 47 ARG N N 15 119.808 0.300 . 1 . . . . 47 ARG N . 11404 1
485 . 1 1 48 48 GLY H H 1 9.108 0.030 . 1 . . . . 48 GLY H . 11404 1
486 . 1 1 48 48 GLY HA2 H 1 4.294 0.030 . 1 . . . . 48 GLY HA2 . 11404 1
487 . 1 1 48 48 GLY HA3 H 1 4.294 0.030 . 1 . . . . 48 GLY HA3 . 11404 1
488 . 1 1 48 48 GLY C C 13 171.166 0.300 . 1 . . . . 48 GLY C . 11404 1
489 . 1 1 48 48 GLY CA C 13 46.908 0.300 . 1 . . . . 48 GLY CA . 11404 1
490 . 1 1 48 48 GLY N N 15 113.012 0.300 . 1 . . . . 48 GLY N . 11404 1
491 . 1 1 49 49 GLU H H 1 9.161 0.030 . 1 . . . . 49 GLU H . 11404 1
492 . 1 1 49 49 GLU HA H 1 5.682 0.030 . 1 . . . . 49 GLU HA . 11404 1
493 . 1 1 49 49 GLU HB2 H 1 1.957 0.030 . 2 . . . . 49 GLU HB2 . 11404 1
494 . 1 1 49 49 GLU HB3 H 1 1.874 0.030 . 2 . . . . 49 GLU HB3 . 11404 1
495 . 1 1 49 49 GLU HG2 H 1 2.056 0.030 . 2 . . . . 49 GLU HG2 . 11404 1
496 . 1 1 49 49 GLU HG3 H 1 2.124 0.030 . 2 . . . . 49 GLU HG3 . 11404 1
497 . 1 1 49 49 GLU C C 13 174.013 0.300 . 1 . . . . 49 GLU C . 11404 1
498 . 1 1 49 49 GLU CA C 13 54.687 0.300 . 1 . . . . 49 GLU CA . 11404 1
499 . 1 1 49 49 GLU CB C 13 34.849 0.300 . 1 . . . . 49 GLU CB . 11404 1
500 . 1 1 49 49 GLU CG C 13 36.070 0.300 . 1 . . . . 49 GLU CG . 11404 1
501 . 1 1 49 49 GLU N N 15 121.971 0.300 . 1 . . . . 49 GLU N . 11404 1
502 . 1 1 50 50 HIS H H 1 8.871 0.030 . 1 . . . . 50 HIS H . 11404 1
503 . 1 1 50 50 HIS HA H 1 4.904 0.030 . 1 . . . . 50 HIS HA . 11404 1
504 . 1 1 50 50 HIS HB2 H 1 3.066 0.030 . 2 . . . . 50 HIS HB2 . 11404 1
505 . 1 1 50 50 HIS HB3 H 1 3.115 0.030 . 2 . . . . 50 HIS HB3 . 11404 1
506 . 1 1 50 50 HIS HD2 H 1 7.334 0.030 . 1 . . . . 50 HIS HD2 . 11404 1
507 . 1 1 50 50 HIS HE1 H 1 7.877 0.030 . 1 . . . . 50 HIS HE1 . 11404 1
508 . 1 1 50 50 HIS C C 13 175.272 0.300 . 1 . . . . 50 HIS C . 11404 1
509 . 1 1 50 50 HIS CA C 13 56.461 0.300 . 1 . . . . 50 HIS CA . 11404 1
510 . 1 1 50 50 HIS CB C 13 34.163 0.300 . 1 . . . . 50 HIS CB . 11404 1
511 . 1 1 50 50 HIS CD2 C 13 119.651 0.300 . 1 . . . . 50 HIS CD2 . 11404 1
512 . 1 1 50 50 HIS CE1 C 13 138.328 0.300 . 1 . . . . 50 HIS CE1 . 11404 1
513 . 1 1 50 50 HIS N N 15 122.512 0.300 . 1 . . . . 50 HIS N . 11404 1
514 . 1 1 51 51 ASN H H 1 9.092 0.030 . 1 . . . . 51 ASN H . 11404 1
515 . 1 1 51 51 ASN HA H 1 4.248 0.030 . 1 . . . . 51 ASN HA . 11404 1
516 . 1 1 51 51 ASN HB2 H 1 3.008 0.030 . 2 . . . . 51 ASN HB2 . 11404 1
517 . 1 1 51 51 ASN HB3 H 1 2.273 0.030 . 2 . . . . 51 ASN HB3 . 11404 1
518 . 1 1 51 51 ASN HD21 H 1 6.744 0.030 . 2 . . . . 51 ASN HD21 . 11404 1
519 . 1 1 51 51 ASN HD22 H 1 7.391 0.030 . 2 . . . . 51 ASN HD22 . 11404 1
520 . 1 1 51 51 ASN C C 13 174.970 0.300 . 1 . . . . 51 ASN C . 11404 1
521 . 1 1 51 51 ASN CA C 13 53.651 0.300 . 1 . . . . 51 ASN CA . 11404 1
522 . 1 1 51 51 ASN CB C 13 37.181 0.300 . 1 . . . . 51 ASN CB . 11404 1
523 . 1 1 51 51 ASN N N 15 127.591 0.300 . 1 . . . . 51 ASN N . 11404 1
524 . 1 1 51 51 ASN ND2 N 15 111.412 0.300 . 1 . . . . 51 ASN ND2 . 11404 1
525 . 1 1 52 52 GLY H H 1 9.046 0.030 . 1 . . . . 52 GLY H . 11404 1
526 . 1 1 52 52 GLY HA2 H 1 3.622 0.030 . 2 . . . . 52 GLY HA2 . 11404 1
527 . 1 1 52 52 GLY HA3 H 1 4.152 0.030 . 2 . . . . 52 GLY HA3 . 11404 1
528 . 1 1 52 52 GLY C C 13 173.844 0.300 . 1 . . . . 52 GLY C . 11404 1
529 . 1 1 52 52 GLY CA C 13 45.522 0.300 . 1 . . . . 52 GLY CA . 11404 1
530 . 1 1 52 52 GLY N N 15 104.251 0.300 . 1 . . . . 52 GLY N . 11404 1
531 . 1 1 53 53 MET H H 1 8.006 0.030 . 1 . . . . 53 MET H . 11404 1
532 . 1 1 53 53 MET HA H 1 4.786 0.030 . 1 . . . . 53 MET HA . 11404 1
533 . 1 1 53 53 MET HB2 H 1 2.207 0.030 . 1 . . . . 53 MET HB2 . 11404 1
534 . 1 1 53 53 MET HB3 H 1 2.207 0.030 . 1 . . . . 53 MET HB3 . 11404 1
535 . 1 1 53 53 MET HE1 H 1 2.219 0.030 . 1 . . . . 53 MET HE . 11404 1
536 . 1 1 53 53 MET HE2 H 1 2.219 0.030 . 1 . . . . 53 MET HE . 11404 1
537 . 1 1 53 53 MET HE3 H 1 2.219 0.030 . 1 . . . . 53 MET HE . 11404 1
538 . 1 1 53 53 MET HG2 H 1 2.596 0.030 . 2 . . . . 53 MET HG2 . 11404 1
539 . 1 1 53 53 MET HG3 H 1 2.660 0.030 . 2 . . . . 53 MET HG3 . 11404 1
540 . 1 1 53 53 MET C C 13 174.620 0.300 . 1 . . . . 53 MET C . 11404 1
541 . 1 1 53 53 MET CA C 13 53.984 0.300 . 1 . . . . 53 MET CA . 11404 1
542 . 1 1 53 53 MET CB C 13 34.302 0.300 . 1 . . . . 53 MET CB . 11404 1
543 . 1 1 53 53 MET CE C 13 17.261 0.300 . 1 . . . . 53 MET CE . 11404 1
544 . 1 1 53 53 MET CG C 13 32.163 0.300 . 1 . . . . 53 MET CG . 11404 1
545 . 1 1 53 53 MET N N 15 121.250 0.300 . 1 . . . . 53 MET N . 11404 1
546 . 1 1 54 54 ARG H H 1 8.629 0.030 . 1 . . . . 54 ARG H . 11404 1
547 . 1 1 54 54 ARG HA H 1 5.405 0.030 . 1 . . . . 54 ARG HA . 11404 1
548 . 1 1 54 54 ARG HB2 H 1 1.798 0.030 . 2 . . . . 54 ARG HB2 . 11404 1
549 . 1 1 54 54 ARG HB3 H 1 1.962 0.030 . 2 . . . . 54 ARG HB3 . 11404 1
550 . 1 1 54 54 ARG HD2 H 1 3.169 0.030 . 1 . . . . 54 ARG HD2 . 11404 1
551 . 1 1 54 54 ARG HD3 H 1 3.169 0.030 . 1 . . . . 54 ARG HD3 . 11404 1
552 . 1 1 54 54 ARG HG2 H 1 1.740 0.030 . 2 . . . . 54 ARG HG2 . 11404 1
553 . 1 1 54 54 ARG HG3 H 1 1.569 0.030 . 2 . . . . 54 ARG HG3 . 11404 1
554 . 1 1 54 54 ARG C C 13 176.920 0.300 . 1 . . . . 54 ARG C . 11404 1
555 . 1 1 54 54 ARG CA C 13 54.659 0.300 . 1 . . . . 54 ARG CA . 11404 1
556 . 1 1 54 54 ARG CB C 13 32.241 0.300 . 1 . . . . 54 ARG CB . 11404 1
557 . 1 1 54 54 ARG CD C 13 43.478 0.300 . 1 . . . . 54 ARG CD . 11404 1
558 . 1 1 54 54 ARG CG C 13 28.349 0.300 . 1 . . . . 54 ARG CG . 11404 1
559 . 1 1 54 54 ARG N N 15 121.835 0.300 . 1 . . . . 54 ARG N . 11404 1
560 . 1 1 55 55 GLY H H 1 8.516 0.030 . 1 . . . . 55 GLY H . 11404 1
561 . 1 1 55 55 GLY HA2 H 1 4.239 0.030 . 2 . . . . 55 GLY HA2 . 11404 1
562 . 1 1 55 55 GLY HA3 H 1 4.051 0.030 . 2 . . . . 55 GLY HA3 . 11404 1
563 . 1 1 55 55 GLY C C 13 171.282 0.300 . 1 . . . . 55 GLY C . 11404 1
564 . 1 1 55 55 GLY CA C 13 45.912 0.300 . 1 . . . . 55 GLY CA . 11404 1
565 . 1 1 55 55 GLY N N 15 109.080 0.300 . 1 . . . . 55 GLY N . 11404 1
566 . 1 1 56 56 LEU H H 1 8.874 0.030 . 1 . . . . 56 LEU H . 11404 1
567 . 1 1 56 56 LEU HA H 1 5.502 0.030 . 1 . . . . 56 LEU HA . 11404 1
568 . 1 1 56 56 LEU HB2 H 1 1.684 0.030 . 2 . . . . 56 LEU HB2 . 11404 1
569 . 1 1 56 56 LEU HB3 H 1 1.523 0.030 . 2 . . . . 56 LEU HB3 . 11404 1
570 . 1 1 56 56 LEU HD11 H 1 0.373 0.030 . 1 . . . . 56 LEU HD1 . 11404 1
571 . 1 1 56 56 LEU HD12 H 1 0.373 0.030 . 1 . . . . 56 LEU HD1 . 11404 1
572 . 1 1 56 56 LEU HD13 H 1 0.373 0.030 . 1 . . . . 56 LEU HD1 . 11404 1
573 . 1 1 56 56 LEU HD21 H 1 0.725 0.030 . 1 . . . . 56 LEU HD2 . 11404 1
574 . 1 1 56 56 LEU HD22 H 1 0.725 0.030 . 1 . . . . 56 LEU HD2 . 11404 1
575 . 1 1 56 56 LEU HD23 H 1 0.725 0.030 . 1 . . . . 56 LEU HD2 . 11404 1
576 . 1 1 56 56 LEU HG H 1 1.617 0.030 . 1 . . . . 56 LEU HG . 11404 1
577 . 1 1 56 56 LEU C C 13 171.201 0.300 . 1 . . . . 56 LEU C . 11404 1
578 . 1 1 56 56 LEU CA C 13 54.763 0.300 . 1 . . . . 56 LEU CA . 11404 1
579 . 1 1 56 56 LEU CB C 13 44.789 0.300 . 1 . . . . 56 LEU CB . 11404 1
580 . 1 1 56 56 LEU CD1 C 13 25.416 0.300 . 2 . . . . 56 LEU CD1 . 11404 1
581 . 1 1 56 56 LEU CD2 C 13 23.169 0.300 . 2 . . . . 56 LEU CD2 . 11404 1
582 . 1 1 56 56 LEU CG C 13 27.207 0.300 . 1 . . . . 56 LEU CG . 11404 1
583 . 1 1 56 56 LEU N N 15 120.343 0.300 . 1 . . . . 56 LEU N . 11404 1
584 . 1 1 57 57 ILE H H 1 9.672 0.030 . 1 . . . . 57 ILE H . 11404 1
585 . 1 1 57 57 ILE HA H 1 4.918 0.030 . 1 . . . . 57 ILE HA . 11404 1
586 . 1 1 57 57 ILE HB H 1 1.595 0.030 . 1 . . . . 57 ILE HB . 11404 1
587 . 1 1 57 57 ILE HD11 H 1 0.600 0.030 . 1 . . . . 57 ILE HD1 . 11404 1
588 . 1 1 57 57 ILE HD12 H 1 0.600 0.030 . 1 . . . . 57 ILE HD1 . 11404 1
589 . 1 1 57 57 ILE HD13 H 1 0.600 0.030 . 1 . . . . 57 ILE HD1 . 11404 1
590 . 1 1 57 57 ILE HG12 H 1 1.707 0.030 . 2 . . . . 57 ILE HG12 . 11404 1
591 . 1 1 57 57 ILE HG13 H 1 0.819 0.030 . 2 . . . . 57 ILE HG13 . 11404 1
592 . 1 1 57 57 ILE HG21 H 1 0.630 0.030 . 1 . . . . 57 ILE HG2 . 11404 1
593 . 1 1 57 57 ILE HG22 H 1 0.630 0.030 . 1 . . . . 57 ILE HG2 . 11404 1
594 . 1 1 57 57 ILE HG23 H 1 0.630 0.030 . 1 . . . . 57 ILE HG2 . 11404 1
595 . 1 1 57 57 ILE CA C 13 58.065 0.300 . 1 . . . . 57 ILE CA . 11404 1
596 . 1 1 57 57 ILE CB C 13 45.013 0.300 . 1 . . . . 57 ILE CB . 11404 1
597 . 1 1 57 57 ILE CD1 C 13 15.913 0.300 . 1 . . . . 57 ILE CD1 . 11404 1
598 . 1 1 57 57 ILE CG1 C 13 28.597 0.300 . 1 . . . . 57 ILE CG1 . 11404 1
599 . 1 1 57 57 ILE CG2 C 13 17.658 0.300 . 1 . . . . 57 ILE CG2 . 11404 1
600 . 1 1 57 57 ILE N N 15 121.042 0.300 . 1 . . . . 57 ILE N . 11404 1
601 . 1 1 58 58 PRO HA H 1 4.051 0.030 . 1 . . . . 58 PRO HA . 11404 1
602 . 1 1 58 58 PRO HB2 H 1 1.397 0.030 . 2 . . . . 58 PRO HB2 . 11404 1
603 . 1 1 58 58 PRO HB3 H 1 0.924 0.030 . 2 . . . . 58 PRO HB3 . 11404 1
604 . 1 1 58 58 PRO HD2 H 1 3.583 0.030 . 2 . . . . 58 PRO HD2 . 11404 1
605 . 1 1 58 58 PRO HD3 H 1 3.879 0.030 . 2 . . . . 58 PRO HD3 . 11404 1
606 . 1 1 58 58 PRO HG2 H 1 0.284 0.030 . 2 . . . . 58 PRO HG2 . 11404 1
607 . 1 1 58 58 PRO HG3 H 1 1.236 0.030 . 2 . . . . 58 PRO HG3 . 11404 1
608 . 1 1 58 58 PRO C C 13 176.908 0.300 . 1 . . . . 58 PRO C . 11404 1
609 . 1 1 58 58 PRO CA C 13 61.905 0.300 . 1 . . . . 58 PRO CA . 11404 1
610 . 1 1 58 58 PRO CB C 13 30.546 0.300 . 1 . . . . 58 PRO CB . 11404 1
611 . 1 1 58 58 PRO CD C 13 51.371 0.300 . 1 . . . . 58 PRO CD . 11404 1
612 . 1 1 58 58 PRO CG C 13 26.129 0.300 . 1 . . . . 58 PRO CG . 11404 1
613 . 1 1 59 59 HIS H H 1 8.096 0.030 . 1 . . . . 59 HIS H . 11404 1
614 . 1 1 59 59 HIS HA H 1 4.246 0.030 . 1 . . . . 59 HIS HA . 11404 1
615 . 1 1 59 59 HIS HB2 H 1 2.833 0.030 . 2 . . . . 59 HIS HB2 . 11404 1
616 . 1 1 59 59 HIS HB3 H 1 2.935 0.030 . 2 . . . . 59 HIS HB3 . 11404 1
617 . 1 1 59 59 HIS HD2 H 1 6.909 0.030 . 1 . . . . 59 HIS HD2 . 11404 1
618 . 1 1 59 59 HIS HE1 H 1 7.785 0.030 . 1 . . . . 59 HIS HE1 . 11404 1
619 . 1 1 59 59 HIS C C 13 176.460 0.300 . 1 . . . . 59 HIS C . 11404 1
620 . 1 1 59 59 HIS CA C 13 60.156 0.300 . 1 . . . . 59 HIS CA . 11404 1
621 . 1 1 59 59 HIS CB C 13 32.706 0.300 . 1 . . . . 59 HIS CB . 11404 1
622 . 1 1 59 59 HIS CD2 C 13 117.508 0.300 . 1 . . . . 59 HIS CD2 . 11404 1
623 . 1 1 59 59 HIS CE1 C 13 138.172 0.300 . 1 . . . . 59 HIS CE1 . 11404 1
624 . 1 1 59 59 HIS N N 15 125.299 0.300 . 1 . . . . 59 HIS N . 11404 1
625 . 1 1 60 60 LYS H H 1 8.449 0.030 . 1 . . . . 60 LYS H . 11404 1
626 . 1 1 60 60 LYS HA H 1 3.982 0.030 . 1 . . . . 60 LYS HA . 11404 1
627 . 1 1 60 60 LYS HB2 H 1 1.612 0.030 . 2 . . . . 60 LYS HB2 . 11404 1
628 . 1 1 60 60 LYS HB3 H 1 1.574 0.030 . 2 . . . . 60 LYS HB3 . 11404 1
629 . 1 1 60 60 LYS HD2 H 1 1.510 0.030 . 1 . . . . 60 LYS HD2 . 11404 1
630 . 1 1 60 60 LYS HD3 H 1 1.510 0.030 . 1 . . . . 60 LYS HD3 . 11404 1
631 . 1 1 60 60 LYS HE2 H 1 2.829 0.030 . 1 . . . . 60 LYS HE2 . 11404 1
632 . 1 1 60 60 LYS HE3 H 1 2.829 0.030 . 1 . . . . 60 LYS HE3 . 11404 1
633 . 1 1 60 60 LYS HG2 H 1 1.161 0.030 . 2 . . . . 60 LYS HG2 . 11404 1
634 . 1 1 60 60 LYS HG3 H 1 1.054 0.030 . 2 . . . . 60 LYS HG3 . 11404 1
635 . 1 1 60 60 LYS C C 13 176.405 0.300 . 1 . . . . 60 LYS C . 11404 1
636 . 1 1 60 60 LYS CA C 13 57.907 0.300 . 1 . . . . 60 LYS CA . 11404 1
637 . 1 1 60 60 LYS CB C 13 32.030 0.300 . 1 . . . . 60 LYS CB . 11404 1
638 . 1 1 60 60 LYS CD C 13 29.171 0.300 . 1 . . . . 60 LYS CD . 11404 1
639 . 1 1 60 60 LYS CE C 13 41.989 0.300 . 1 . . . . 60 LYS CE . 11404 1
640 . 1 1 60 60 LYS CG C 13 24.986 0.300 . 1 . . . . 60 LYS CG . 11404 1
641 . 1 1 60 60 LYS N N 15 112.376 0.300 . 1 . . . . 60 LYS N . 11404 1
642 . 1 1 61 61 TYR H H 1 7.327 0.030 . 1 . . . . 61 TYR H . 11404 1
643 . 1 1 61 61 TYR HA H 1 4.703 0.030 . 1 . . . . 61 TYR HA . 11404 1
644 . 1 1 61 61 TYR HB2 H 1 3.867 0.030 . 2 . . . . 61 TYR HB2 . 11404 1
645 . 1 1 61 61 TYR HB3 H 1 2.815 0.030 . 2 . . . . 61 TYR HB3 . 11404 1
646 . 1 1 61 61 TYR HD1 H 1 6.869 0.030 . 1 . . . . 61 TYR HD1 . 11404 1
647 . 1 1 61 61 TYR HD2 H 1 6.869 0.030 . 1 . . . . 61 TYR HD2 . 11404 1
648 . 1 1 61 61 TYR HE1 H 1 6.797 0.030 . 1 . . . . 61 TYR HE1 . 11404 1
649 . 1 1 61 61 TYR HE2 H 1 6.797 0.030 . 1 . . . . 61 TYR HE2 . 11404 1
650 . 1 1 61 61 TYR C C 13 174.706 0.300 . 1 . . . . 61 TYR C . 11404 1
651 . 1 1 61 61 TYR CA C 13 58.138 0.300 . 1 . . . . 61 TYR CA . 11404 1
652 . 1 1 61 61 TYR CB C 13 38.387 0.300 . 1 . . . . 61 TYR CB . 11404 1
653 . 1 1 61 61 TYR CD1 C 13 133.021 0.300 . 1 . . . . 61 TYR CD1 . 11404 1
654 . 1 1 61 61 TYR CD2 C 13 133.021 0.300 . 1 . . . . 61 TYR CD2 . 11404 1
655 . 1 1 61 61 TYR CE1 C 13 118.153 0.300 . 1 . . . . 61 TYR CE1 . 11404 1
656 . 1 1 61 61 TYR CE2 C 13 118.153 0.300 . 1 . . . . 61 TYR CE2 . 11404 1
657 . 1 1 61 61 TYR N N 15 116.435 0.300 . 1 . . . . 61 TYR N . 11404 1
658 . 1 1 62 62 ILE H H 1 7.172 0.030 . 1 . . . . 62 ILE H . 11404 1
659 . 1 1 62 62 ILE HA H 1 4.981 0.030 . 1 . . . . 62 ILE HA . 11404 1
660 . 1 1 62 62 ILE HB H 1 1.361 0.030 . 1 . . . . 62 ILE HB . 11404 1
661 . 1 1 62 62 ILE HD11 H 1 0.180 0.030 . 1 . . . . 62 ILE HD1 . 11404 1
662 . 1 1 62 62 ILE HD12 H 1 0.180 0.030 . 1 . . . . 62 ILE HD1 . 11404 1
663 . 1 1 62 62 ILE HD13 H 1 0.180 0.030 . 1 . . . . 62 ILE HD1 . 11404 1
664 . 1 1 62 62 ILE HG12 H 1 1.040 0.030 . 2 . . . . 62 ILE HG12 . 11404 1
665 . 1 1 62 62 ILE HG13 H 1 1.003 0.030 . 2 . . . . 62 ILE HG13 . 11404 1
666 . 1 1 62 62 ILE HG21 H 1 0.339 0.030 . 1 . . . . 62 ILE HG2 . 11404 1
667 . 1 1 62 62 ILE HG22 H 1 0.339 0.030 . 1 . . . . 62 ILE HG2 . 11404 1
668 . 1 1 62 62 ILE HG23 H 1 0.339 0.030 . 1 . . . . 62 ILE HG2 . 11404 1
669 . 1 1 62 62 ILE C C 13 174.794 0.300 . 1 . . . . 62 ILE C . 11404 1
670 . 1 1 62 62 ILE CA C 13 59.293 0.300 . 1 . . . . 62 ILE CA . 11404 1
671 . 1 1 62 62 ILE CB C 13 42.100 0.300 . 1 . . . . 62 ILE CB . 11404 1
672 . 1 1 62 62 ILE CD1 C 13 14.740 0.300 . 1 . . . . 62 ILE CD1 . 11404 1
673 . 1 1 62 62 ILE CG1 C 13 24.774 0.300 . 1 . . . . 62 ILE CG1 . 11404 1
674 . 1 1 62 62 ILE CG2 C 13 18.622 0.300 . 1 . . . . 62 ILE CG2 . 11404 1
675 . 1 1 62 62 ILE N N 15 112.098 0.300 . 1 . . . . 62 ILE N . 11404 1
676 . 1 1 63 63 THR H H 1 8.664 0.030 . 1 . . . . 63 THR H . 11404 1
677 . 1 1 63 63 THR HA H 1 4.405 0.030 . 1 . . . . 63 THR HA . 11404 1
678 . 1 1 63 63 THR HB H 1 3.820 0.030 . 1 . . . . 63 THR HB . 11404 1
679 . 1 1 63 63 THR HG21 H 1 1.073 0.030 . 1 . . . . 63 THR HG2 . 11404 1
680 . 1 1 63 63 THR HG22 H 1 1.073 0.030 . 1 . . . . 63 THR HG2 . 11404 1
681 . 1 1 63 63 THR HG23 H 1 1.073 0.030 . 1 . . . . 63 THR HG2 . 11404 1
682 . 1 1 63 63 THR C C 13 173.804 0.300 . 1 . . . . 63 THR C . 11404 1
683 . 1 1 63 63 THR CA C 13 61.195 0.300 . 1 . . . . 63 THR CA . 11404 1
684 . 1 1 63 63 THR CB C 13 70.281 0.300 . 1 . . . . 63 THR CB . 11404 1
685 . 1 1 63 63 THR CG2 C 13 21.866 0.300 . 1 . . . . 63 THR CG2 . 11404 1
686 . 1 1 63 63 THR N N 15 118.274 0.300 . 1 . . . . 63 THR N . 11404 1
687 . 1 1 64 64 LEU H H 1 8.649 0.030 . 1 . . . . 64 LEU H . 11404 1
688 . 1 1 64 64 LEU HA H 1 4.472 0.030 . 1 . . . . 64 LEU HA . 11404 1
689 . 1 1 64 64 LEU HB2 H 1 1.572 0.030 . 2 . . . . 64 LEU HB2 . 11404 1
690 . 1 1 64 64 LEU HB3 H 1 1.530 0.030 . 2 . . . . 64 LEU HB3 . 11404 1
691 . 1 1 64 64 LEU HD11 H 1 0.923 0.030 . 1 . . . . 64 LEU HD1 . 11404 1
692 . 1 1 64 64 LEU HD12 H 1 0.923 0.030 . 1 . . . . 64 LEU HD1 . 11404 1
693 . 1 1 64 64 LEU HD13 H 1 0.923 0.030 . 1 . . . . 64 LEU HD1 . 11404 1
694 . 1 1 64 64 LEU HD21 H 1 0.624 0.030 . 1 . . . . 64 LEU HD2 . 11404 1
695 . 1 1 64 64 LEU HD22 H 1 0.624 0.030 . 1 . . . . 64 LEU HD2 . 11404 1
696 . 1 1 64 64 LEU HD23 H 1 0.624 0.030 . 1 . . . . 64 LEU HD2 . 11404 1
697 . 1 1 64 64 LEU HG H 1 1.497 0.030 . 1 . . . . 64 LEU HG . 11404 1
698 . 1 1 64 64 LEU C C 13 174.812 0.300 . 1 . . . . 64 LEU C . 11404 1
699 . 1 1 64 64 LEU CA C 13 52.875 0.300 . 1 . . . . 64 LEU CA . 11404 1
700 . 1 1 64 64 LEU CB C 13 41.364 0.300 . 1 . . . . 64 LEU CB . 11404 1
701 . 1 1 64 64 LEU CD1 C 13 25.582 0.300 . 2 . . . . 64 LEU CD1 . 11404 1
702 . 1 1 64 64 LEU CD2 C 13 24.390 0.300 . 2 . . . . 64 LEU CD2 . 11404 1
703 . 1 1 64 64 LEU CG C 13 27.980 0.300 . 1 . . . . 64 LEU CG . 11404 1
704 . 1 1 64 64 LEU N N 15 129.374 0.300 . 1 . . . . 64 LEU N . 11404 1
705 . 1 1 65 65 PRO HA H 1 4.391 0.030 . 1 . . . . 65 PRO HA . 11404 1
706 . 1 1 65 65 PRO HB2 H 1 2.303 0.030 . 2 . . . . 65 PRO HB2 . 11404 1
707 . 1 1 65 65 PRO HB3 H 1 1.890 0.030 . 2 . . . . 65 PRO HB3 . 11404 1
708 . 1 1 65 65 PRO HD2 H 1 3.491 0.030 . 2 . . . . 65 PRO HD2 . 11404 1
709 . 1 1 65 65 PRO HD3 H 1 3.742 0.030 . 2 . . . . 65 PRO HD3 . 11404 1
710 . 1 1 65 65 PRO HG2 H 1 2.041 0.030 . 1 . . . . 65 PRO HG2 . 11404 1
711 . 1 1 65 65 PRO HG3 H 1 2.041 0.030 . 1 . . . . 65 PRO HG3 . 11404 1
712 . 1 1 65 65 PRO C C 13 176.856 0.300 . 1 . . . . 65 PRO C . 11404 1
713 . 1 1 65 65 PRO CA C 13 62.842 0.300 . 1 . . . . 65 PRO CA . 11404 1
714 . 1 1 65 65 PRO CB C 13 31.985 0.300 . 1 . . . . 65 PRO CB . 11404 1
715 . 1 1 65 65 PRO CD C 13 50.461 0.300 . 1 . . . . 65 PRO CD . 11404 1
716 . 1 1 65 65 PRO CG C 13 27.606 0.300 . 1 . . . . 65 PRO CG . 11404 1
717 . 1 1 66 66 ALA H H 1 8.546 0.030 . 1 . . . . 66 ALA H . 11404 1
718 . 1 1 66 66 ALA HA H 1 4.282 0.030 . 1 . . . . 66 ALA HA . 11404 1
719 . 1 1 66 66 ALA HB1 H 1 1.403 0.030 . 1 . . . . 66 ALA HB . 11404 1
720 . 1 1 66 66 ALA HB2 H 1 1.403 0.030 . 1 . . . . 66 ALA HB . 11404 1
721 . 1 1 66 66 ALA HB3 H 1 1.403 0.030 . 1 . . . . 66 ALA HB . 11404 1
722 . 1 1 66 66 ALA C C 13 178.568 0.300 . 1 . . . . 66 ALA C . 11404 1
723 . 1 1 66 66 ALA CA C 13 53.007 0.300 . 1 . . . . 66 ALA CA . 11404 1
724 . 1 1 66 66 ALA CB C 13 19.158 0.300 . 1 . . . . 66 ALA CB . 11404 1
725 . 1 1 66 66 ALA N N 15 125.262 0.300 . 1 . . . . 66 ALA N . 11404 1
726 . 1 1 67 67 GLY H H 1 8.592 0.030 . 1 . . . . 67 GLY H . 11404 1
727 . 1 1 67 67 GLY HA2 H 1 3.960 0.030 . 2 . . . . 67 GLY HA2 . 11404 1
728 . 1 1 67 67 GLY HA3 H 1 4.082 0.030 . 2 . . . . 67 GLY HA3 . 11404 1
729 . 1 1 67 67 GLY C C 13 174.861 0.300 . 1 . . . . 67 GLY C . 11404 1
730 . 1 1 67 67 GLY CA C 13 45.450 0.300 . 1 . . . . 67 GLY CA . 11404 1
731 . 1 1 67 67 GLY N N 15 108.942 0.300 . 1 . . . . 67 GLY N . 11404 1
732 . 1 1 68 68 THR H H 1 7.972 0.030 . 1 . . . . 68 THR H . 11404 1
733 . 1 1 68 68 THR HA H 1 4.272 0.030 . 1 . . . . 68 THR HA . 11404 1
734 . 1 1 68 68 THR HB H 1 4.233 0.030 . 1 . . . . 68 THR HB . 11404 1
735 . 1 1 68 68 THR HG21 H 1 1.220 0.030 . 1 . . . . 68 THR HG2 . 11404 1
736 . 1 1 68 68 THR HG22 H 1 1.220 0.030 . 1 . . . . 68 THR HG2 . 11404 1
737 . 1 1 68 68 THR HG23 H 1 1.220 0.030 . 1 . . . . 68 THR HG2 . 11404 1
738 . 1 1 68 68 THR C C 13 174.956 0.300 . 1 . . . . 68 THR C . 11404 1
739 . 1 1 68 68 THR CA C 13 62.924 0.300 . 1 . . . . 68 THR CA . 11404 1
740 . 1 1 68 68 THR CB C 13 69.647 0.300 . 1 . . . . 68 THR CB . 11404 1
741 . 1 1 68 68 THR CG2 C 13 21.901 0.300 . 1 . . . . 68 THR CG2 . 11404 1
742 . 1 1 68 68 THR N N 15 113.562 0.300 . 1 . . . . 68 THR N . 11404 1
743 . 1 1 69 69 GLU H H 1 8.661 0.030 . 1 . . . . 69 GLU H . 11404 1
744 . 1 1 69 69 GLU HA H 1 4.283 0.030 . 1 . . . . 69 GLU HA . 11404 1
745 . 1 1 69 69 GLU HB2 H 1 1.978 0.030 . 2 . . . . 69 GLU HB2 . 11404 1
746 . 1 1 69 69 GLU HB3 H 1 2.066 0.030 . 2 . . . . 69 GLU HB3 . 11404 1
747 . 1 1 69 69 GLU HG2 H 1 2.322 0.030 . 2 . . . . 69 GLU HG2 . 11404 1
748 . 1 1 69 69 GLU HG3 H 1 2.235 0.030 . 2 . . . . 69 GLU HG3 . 11404 1
749 . 1 1 69 69 GLU C C 13 176.453 0.300 . 1 . . . . 69 GLU C . 11404 1
750 . 1 1 69 69 GLU CA C 13 57.202 0.300 . 1 . . . . 69 GLU CA . 11404 1
751 . 1 1 69 69 GLU CB C 13 30.157 0.300 . 1 . . . . 69 GLU CB . 11404 1
752 . 1 1 69 69 GLU CG C 13 36.489 0.300 . 1 . . . . 69 GLU CG . 11404 1
753 . 1 1 69 69 GLU N N 15 123.188 0.300 . 1 . . . . 69 GLU N . 11404 1
754 . 1 1 70 70 LYS H H 1 8.270 0.030 . 1 . . . . 70 LYS H . 11404 1
755 . 1 1 70 70 LYS HA H 1 4.299 0.030 . 1 . . . . 70 LYS HA . 11404 1
756 . 1 1 70 70 LYS HB2 H 1 1.747 0.030 . 2 . . . . 70 LYS HB2 . 11404 1
757 . 1 1 70 70 LYS HB3 H 1 1.833 0.030 . 2 . . . . 70 LYS HB3 . 11404 1
758 . 1 1 70 70 LYS HD2 H 1 1.699 0.030 . 1 . . . . 70 LYS HD2 . 11404 1
759 . 1 1 70 70 LYS HD3 H 1 1.699 0.030 . 1 . . . . 70 LYS HD3 . 11404 1
760 . 1 1 70 70 LYS HE2 H 1 2.994 0.030 . 1 . . . . 70 LYS HE2 . 11404 1
761 . 1 1 70 70 LYS HE3 H 1 2.994 0.030 . 1 . . . . 70 LYS HE3 . 11404 1
762 . 1 1 70 70 LYS HG2 H 1 1.434 0.030 . 1 . . . . 70 LYS HG2 . 11404 1
763 . 1 1 70 70 LYS HG3 H 1 1.434 0.030 . 1 . . . . 70 LYS HG3 . 11404 1
764 . 1 1 70 70 LYS C C 13 176.442 0.300 . 1 . . . . 70 LYS C . 11404 1
765 . 1 1 70 70 LYS CA C 13 56.619 0.300 . 1 . . . . 70 LYS CA . 11404 1
766 . 1 1 70 70 LYS CB C 13 33.028 0.300 . 1 . . . . 70 LYS CB . 11404 1
767 . 1 1 70 70 LYS CD C 13 29.097 0.300 . 1 . . . . 70 LYS CD . 11404 1
768 . 1 1 70 70 LYS CE C 13 42.220 0.300 . 1 . . . . 70 LYS CE . 11404 1
769 . 1 1 70 70 LYS CG C 13 24.848 0.300 . 1 . . . . 70 LYS CG . 11404 1
770 . 1 1 70 70 LYS N N 15 122.071 0.300 . 1 . . . . 70 LYS N . 11404 1
771 . 1 1 71 71 GLN H H 1 8.356 0.030 . 1 . . . . 71 GLN H . 11404 1
772 . 1 1 71 71 GLN HA H 1 4.295 0.030 . 1 . . . . 71 GLN HA . 11404 1
773 . 1 1 71 71 GLN HB2 H 1 2.078 0.030 . 2 . . . . 71 GLN HB2 . 11404 1
774 . 1 1 71 71 GLN HB3 H 1 1.947 0.030 . 2 . . . . 71 GLN HB3 . 11404 1
775 . 1 1 71 71 GLN HG2 H 1 2.267 0.030 . 1 . . . . 71 GLN HG2 . 11404 1
776 . 1 1 71 71 GLN HG3 H 1 2.267 0.030 . 1 . . . . 71 GLN HG3 . 11404 1
777 . 1 1 71 71 GLN C C 13 175.923 0.300 . 1 . . . . 71 GLN C . 11404 1
778 . 1 1 71 71 GLN CA C 13 56.088 0.300 . 1 . . . . 71 GLN CA . 11404 1
779 . 1 1 71 71 GLN CB C 13 30.334 0.300 . 1 . . . . 71 GLN CB . 11404 1
780 . 1 1 71 71 GLN CG C 13 36.413 0.300 . 1 . . . . 71 GLN CG . 11404 1
781 . 1 1 71 71 GLN N N 15 121.698 0.300 . 1 . . . . 71 GLN N . 11404 1
782 . 1 1 72 72 VAL H H 1 8.241 0.030 . 1 . . . . 72 VAL H . 11404 1
783 . 1 1 72 72 VAL HA H 1 4.075 0.030 . 1 . . . . 72 VAL HA . 11404 1
784 . 1 1 72 72 VAL HB H 1 2.031 0.030 . 1 . . . . 72 VAL HB . 11404 1
785 . 1 1 72 72 VAL HG11 H 1 0.901 0.030 . 1 . . . . 72 VAL HG1 . 11404 1
786 . 1 1 72 72 VAL HG12 H 1 0.901 0.030 . 1 . . . . 72 VAL HG1 . 11404 1
787 . 1 1 72 72 VAL HG13 H 1 0.901 0.030 . 1 . . . . 72 VAL HG1 . 11404 1
788 . 1 1 72 72 VAL HG21 H 1 0.902 0.030 . 1 . . . . 72 VAL HG2 . 11404 1
789 . 1 1 72 72 VAL HG22 H 1 0.902 0.030 . 1 . . . . 72 VAL HG2 . 11404 1
790 . 1 1 72 72 VAL HG23 H 1 0.902 0.030 . 1 . . . . 72 VAL HG2 . 11404 1
791 . 1 1 72 72 VAL C C 13 176.167 0.300 . 1 . . . . 72 VAL C . 11404 1
792 . 1 1 72 72 VAL CA C 13 62.388 0.300 . 1 . . . . 72 VAL CA . 11404 1
793 . 1 1 72 72 VAL CB C 13 32.707 0.300 . 1 . . . . 72 VAL CB . 11404 1
794 . 1 1 72 72 VAL CG1 C 13 21.032 0.300 . 1 . . . . 72 VAL CG1 . 11404 1
795 . 1 1 72 72 VAL CG2 C 13 21.032 0.300 . 1 . . . . 72 VAL CG2 . 11404 1
796 . 1 1 72 72 VAL N N 15 122.325 0.300 . 1 . . . . 72 VAL N . 11404 1
797 . 1 1 73 73 VAL H H 1 8.275 0.030 . 1 . . . . 73 VAL H . 11404 1
798 . 1 1 73 73 VAL HA H 1 4.097 0.030 . 1 . . . . 73 VAL HA . 11404 1
799 . 1 1 73 73 VAL HB H 1 2.033 0.030 . 1 . . . . 73 VAL HB . 11404 1
800 . 1 1 73 73 VAL HG11 H 1 0.902 0.030 . 1 . . . . 73 VAL HG1 . 11404 1
801 . 1 1 73 73 VAL HG12 H 1 0.902 0.030 . 1 . . . . 73 VAL HG1 . 11404 1
802 . 1 1 73 73 VAL HG13 H 1 0.902 0.030 . 1 . . . . 73 VAL HG1 . 11404 1
803 . 1 1 73 73 VAL HG21 H 1 0.902 0.030 . 1 . . . . 73 VAL HG2 . 11404 1
804 . 1 1 73 73 VAL HG22 H 1 0.902 0.030 . 1 . . . . 73 VAL HG2 . 11404 1
805 . 1 1 73 73 VAL HG23 H 1 0.902 0.030 . 1 . . . . 73 VAL HG2 . 11404 1
806 . 1 1 73 73 VAL C C 13 176.615 0.300 . 1 . . . . 73 VAL C . 11404 1
807 . 1 1 73 73 VAL CA C 13 62.553 0.300 . 1 . . . . 73 VAL CA . 11404 1
808 . 1 1 73 73 VAL CB C 13 32.756 0.300 . 1 . . . . 73 VAL CB . 11404 1
809 . 1 1 73 73 VAL CG1 C 13 20.949 0.300 . 1 . . . . 73 VAL CG1 . 11404 1
810 . 1 1 73 73 VAL CG2 C 13 20.949 0.300 . 1 . . . . 73 VAL CG2 . 11404 1
811 . 1 1 73 73 VAL N N 15 124.802 0.300 . 1 . . . . 73 VAL N . 11404 1
812 . 1 1 74 74 GLY H H 1 8.477 0.030 . 1 . . . . 74 GLY H . 11404 1
813 . 1 1 74 74 GLY HA2 H 1 4.047 0.030 . 1 . . . . 74 GLY HA2 . 11404 1
814 . 1 1 74 74 GLY HA3 H 1 4.047 0.030 . 1 . . . . 74 GLY HA3 . 11404 1
815 . 1 1 74 74 GLY C C 13 173.653 0.300 . 1 . . . . 74 GLY C . 11404 1
816 . 1 1 74 74 GLY CA C 13 45.269 0.300 . 1 . . . . 74 GLY CA . 11404 1
817 . 1 1 74 74 GLY N N 15 113.230 0.300 . 1 . . . . 74 GLY N . 11404 1
818 . 1 1 75 75 ALA H H 1 8.186 0.030 . 1 . . . . 75 ALA H . 11404 1
819 . 1 1 75 75 ALA HA H 1 4.349 0.030 . 1 . . . . 75 ALA HA . 11404 1
820 . 1 1 75 75 ALA HB1 H 1 1.376 0.030 . 1 . . . . 75 ALA HB . 11404 1
821 . 1 1 75 75 ALA HB2 H 1 1.376 0.030 . 1 . . . . 75 ALA HB . 11404 1
822 . 1 1 75 75 ALA HB3 H 1 1.376 0.030 . 1 . . . . 75 ALA HB . 11404 1
823 . 1 1 75 75 ALA C C 13 175.419 0.300 . 1 . . . . 75 ALA C . 11404 1
824 . 1 1 75 75 ALA CA C 13 52.357 0.300 . 1 . . . . 75 ALA CA . 11404 1
825 . 1 1 75 75 ALA CB C 13 19.663 0.300 . 1 . . . . 75 ALA CB . 11404 1
826 . 1 1 75 75 ALA N N 15 124.270 0.300 . 1 . . . . 75 ALA N . 11404 1
827 . 1 1 76 76 GLY H H 1 8.021 0.030 . 1 . . . . 76 GLY H . 11404 1
828 . 1 1 76 76 GLY HA2 H 1 3.733 0.030 . 1 . . . . 76 GLY HA2 . 11404 1
829 . 1 1 76 76 GLY HA3 H 1 3.733 0.030 . 1 . . . . 76 GLY HA3 . 11404 1
830 . 1 1 76 76 GLY C C 13 179.150 0.300 . 1 . . . . 76 GLY C . 11404 1
831 . 1 1 76 76 GLY CA C 13 46.173 0.300 . 1 . . . . 76 GLY CA . 11404 1
832 . 1 1 76 76 GLY N N 15 114.545 0.300 . 1 . . . . 76 GLY N . 11404 1
stop_
save_