###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 16983
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 16983 1
2 '2D 1H-13C HSQC' . . . 16983 1
3 '3D HNCO' . . . 16983 1
4 '3D HNCACB' . . . 16983 1
5 '3D CBCA(CO)NH' . . . 16983 1
8 '3D HCCH-TOCSY' . . . 16983 1
10 '3D C(CO)NH' . . . 16983 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 2 2 SER HA H 1 4.446 . . 1 . . . . 2 S HA . 16983 1
2 . 1 1 2 2 SER HB2 H 1 3.811 . . 2 . . . . 2 S QB . 16983 1
3 . 1 1 2 2 SER HB3 H 1 3.811 . . 2 . . . . 2 S QB . 16983 1
4 . 1 1 2 2 SER CA C 13 58.188 . . 1 . . . . 2 S CA . 16983 1
5 . 1 1 2 2 SER CB C 13 64.144 . . 1 . . . . 2 S CB . 16983 1
6 . 1 1 3 3 ALA HA H 1 4.004 . . 1 . . . . 3 A HA . 16983 1
7 . 1 1 3 3 ALA HB1 H 1 1.144 . . . . . . . 3 A QB . 16983 1
8 . 1 1 3 3 ALA HB2 H 1 1.144 . . . . . . . 3 A QB . 16983 1
9 . 1 1 3 3 ALA HB3 H 1 1.144 . . . . . . . 3 A QB . 16983 1
10 . 1 1 3 3 ALA C C 13 177.032 . . 1 . . . . 3 A C . 16983 1
11 . 1 1 3 3 ALA CA C 13 52.895 . . 1 . . . . 3 A CA . 16983 1
12 . 1 1 3 3 ALA CB C 13 19.245 . . 1 . . . . 3 A CB . 16983 1
13 . 1 1 4 4 LYS H H 1 8.050 . . 1 . . . . 4 K H . 16983 1
14 . 1 1 4 4 LYS HA H 1 4.137 . . 1 . . . . 4 K HA . 16983 1
15 . 1 1 4 4 LYS HB2 H 1 1.673 . . 2 . . . . 4 K HB2 . 16983 1
16 . 1 1 4 4 LYS HB3 H 1 1.633 . . 2 . . . . 4 K HB3 . 16983 1
17 . 1 1 4 4 LYS HD2 H 1 1.508 . . 2 . . . . 4 K QD . 16983 1
18 . 1 1 4 4 LYS HD3 H 1 1.508 . . 2 . . . . 4 K QD . 16983 1
19 . 1 1 4 4 LYS HE2 H 1 2.810 . . 2 . . . . 4 K QE . 16983 1
20 . 1 1 4 4 LYS HE3 H 1 2.810 . . 2 . . . . 4 K QE . 16983 1
21 . 1 1 4 4 LYS HG2 H 1 1.265 . . 2 . . . . 4 K HG2 . 16983 1
22 . 1 1 4 4 LYS HG3 H 1 1.231 . . 2 . . . . 4 K HG3 . 16983 1
23 . 1 1 4 4 LYS C C 13 176.936 . . 1 . . . . 4 K C . 16983 1
24 . 1 1 4 4 LYS CA C 13 56.717 . . 1 . . . . 4 K CA . 16983 1
25 . 1 1 4 4 LYS CB C 13 33.013 . . 1 . . . . 4 K CB . 16983 1
26 . 1 1 4 4 LYS CD C 13 29.076 . . 1 . . . . 4 K CD . 16983 1
27 . 1 1 4 4 LYS CE C 13 42.189 . . 1 . . . . 4 K CE . 16983 1
28 . 1 1 4 4 LYS CG C 13 24.737 . . 1 . . . . 4 K CG . 16983 1
29 . 1 1 4 4 LYS N N 15 119.644 . . 1 . . . . 4 K N . 16983 1
30 . 1 1 5 5 GLY H H 1 8.255 . . 1 . . . . 5 G H . 16983 1
31 . 1 1 5 5 GLY HA2 H 1 3.880 . . 2 . . . . 5 G HA2 . 16983 1
32 . 1 1 5 5 GLY HA3 H 1 3.781 . . 2 . . . . 5 G HA3 . 16983 1
33 . 1 1 5 5 GLY C C 13 173.536 . . 1 . . . . 5 G C . 16983 1
34 . 1 1 5 5 GLY CA C 13 45.378 . . 1 . . . . 5 G CA . 16983 1
35 . 1 1 5 5 GLY N N 15 109.507 . . 1 . . . . 5 G N . 16983 1
36 . 1 1 6 6 ASN H H 1 8.106 . . 1 . . . . 6 N H . 16983 1
37 . 1 1 6 6 ASN HA H 1 4.726 . . 1 . . . . 6 N HA . 16983 1
38 . 1 1 6 6 ASN HB2 H 1 2.498 . . 2 . . . . 6 N QB . 16983 1
39 . 1 1 6 6 ASN HB3 H 1 2.498 . . 2 . . . . 6 N QB . 16983 1
40 . 1 1 6 6 ASN HD21 H 1 7.121 . . 2 . . . . 6 N HD21 . 16983 1
41 . 1 1 6 6 ASN HD22 H 1 6.732 . . 2 . . . . 6 N HD22 . 16983 1
42 . 1 1 6 6 ASN CA C 13 53.006 . . 1 . . . . 6 N CA . 16983 1
43 . 1 1 6 6 ASN CB C 13 39.202 . . 1 . . . . 6 N CB . 16983 1
44 . 1 1 6 6 ASN N N 15 118.536 . . 1 . . . . 6 N N . 16983 1
45 . 1 1 6 6 ASN ND2 N 15 113.383 . . 1 . . . . 6 N ND2 . 16983 1
46 . 1 1 7 7 PHE H H 1 8.130 . . 1 . . . . 7 F H . 16983 1
47 . 1 1 7 7 PHE HA H 1 4.629 . . 1 . . . . 7 F HA . 16983 1
48 . 1 1 7 7 PHE HB2 H 1 2.733 . . 2 . . . . 7 F QB . 16983 1
49 . 1 1 7 7 PHE HB3 H 1 2.733 . . 2 . . . . 7 F QB . 16983 1
50 . 1 1 7 7 PHE HD1 H 1 7.011 . . 3 . . . . 7 F QD . 16983 1
51 . 1 1 7 7 PHE HD2 H 1 7.011 . . 3 . . . . 7 F QD . 16983 1
52 . 1 1 7 7 PHE HE1 H 1 7.001 . . 3 . . . . 7 F QE . 16983 1
53 . 1 1 7 7 PHE HE2 H 1 7.001 . . 3 . . . . 7 F QE . 16983 1
54 . 1 1 7 7 PHE HZ H 1 6.761 . . 1 . . . . 7 F HZ . 16983 1
55 . 1 1 7 7 PHE C C 13 174.746 . . 1 . . . . 7 F C . 16983 1
56 . 1 1 7 7 PHE CA C 13 56.392 . . 1 . . . . 7 F CA . 16983 1
57 . 1 1 7 7 PHE CB C 13 41.216 . . 1 . . . . 7 F CB . 16983 1
58 . 1 1 7 7 PHE N N 15 119.094 . . 1 . . . . 7 F N . 16983 1
59 . 1 1 8 8 CYS H H 1 8.278 . . 1 . . . . 8 C H . 16983 1
60 . 1 1 8 8 CYS HA H 1 5.140 . . 1 . . . . 8 C HA . 16983 1
61 . 1 1 8 8 CYS HB2 H 1 3.372 . . 2 . . . . 8 C HB2 . 16983 1
62 . 1 1 8 8 CYS HB3 H 1 2.312 . . 2 . . . . 8 C HB3 . 16983 1
63 . 1 1 8 8 CYS CA C 13 55.823 . . 1 . . . . 8 C CA . 16983 1
64 . 1 1 8 8 CYS CB C 13 31.897 . . 1 . . . . 8 C CB . 16983 1
65 . 1 1 8 8 CYS N N 15 127.665 . . 1 . . . . 8 C N . 16983 1
66 . 1 1 9 9 PRO HA H 1 4.617 . . 1 . . . . 9 P HA . 16983 1
67 . 1 1 9 9 PRO HB2 H 1 2.338 . . 2 . . . . 9 P HB2 . 16983 1
68 . 1 1 9 9 PRO HB3 H 1 2.078 . . 2 . . . . 9 P HB3 . 16983 1
69 . 1 1 9 9 PRO HD2 H 1 4.363 . . 2 . . . . 9 P HD2 . 16983 1
70 . 1 1 9 9 PRO HD3 H 1 4.058 . . 2 . . . . 9 P HD3 . 16983 1
71 . 1 1 9 9 PRO HG2 H 1 2.067 . . 2 . . . . 9 P HG2 . 16983 1
72 . 1 1 9 9 PRO HG3 H 1 2.012 . . 2 . . . . 9 P HG3 . 16983 1
73 . 1 1 9 9 PRO C C 13 176.973 . . 1 . . . . 9 P C . 16983 1
74 . 1 1 9 9 PRO CA C 13 63.786 . . 1 . . . . 9 P CA . 16983 1
75 . 1 1 9 9 PRO CB C 13 32.400 . . 1 . . . . 9 P CB . 16983 1
76 . 1 1 9 9 PRO CD C 13 51.520 . . 1 . . . . 9 P CD . 16983 1
77 . 1 1 9 9 PRO CG C 13 27.294 . . 1 . . . . 9 P CG . 16983 1
78 . 1 1 10 10 LEU H H 1 8.867 . . 1 . . . . 10 L H . 16983 1
79 . 1 1 10 10 LEU HA H 1 4.483 . . 1 . . . . 10 L HA . 16983 1
80 . 1 1 10 10 LEU HB2 H 1 1.948 . . 2 . . . . 10 L HB2 . 16983 1
81 . 1 1 10 10 LEU HB3 H 1 1.647 . . 2 . . . . 10 L HB3 . 16983 1
82 . 1 1 10 10 LEU HD11 H 1 0.961 . . . . . . . 10 L QD1 . 16983 1
83 . 1 1 10 10 LEU HD12 H 1 0.961 . . . . . . . 10 L QD1 . 16983 1
84 . 1 1 10 10 LEU HD13 H 1 0.961 . . . . . . . 10 L QD1 . 16983 1
85 . 1 1 10 10 LEU HD21 H 1 0.902 . . . . . . . 10 L QD2 . 16983 1
86 . 1 1 10 10 LEU HD22 H 1 0.902 . . . . . . . 10 L QD2 . 16983 1
87 . 1 1 10 10 LEU HD23 H 1 0.902 . . . . . . . 10 L QD2 . 16983 1
88 . 1 1 10 10 LEU HG H 1 1.700 . . 1 . . . . 10 L HG . 16983 1
89 . 1 1 10 10 LEU C C 13 177.645 . . 1 . . . . 10 L C . 16983 1
90 . 1 1 10 10 LEU CA C 13 56.697 . . 1 . . . . 10 L CA . 16983 1
91 . 1 1 10 10 LEU CB C 13 42.507 . . 1 . . . . 10 L CB . 16983 1
92 . 1 1 10 10 LEU CD1 C 13 26.025 . . 2 . . . . 10 L CD1 . 16983 1
93 . 1 1 10 10 LEU CD2 C 13 23.095 . . 2 . . . . 10 L CD2 . 16983 1
94 . 1 1 10 10 LEU CG C 13 28.022 . . 1 . . . . 10 L CG . 16983 1
95 . 1 1 10 10 LEU N N 15 121.754 . . 1 . . . . 10 L N . 16983 1
96 . 1 1 11 11 CYS H H 1 7.772 . . 1 . . . . 11 C H . 16983 1
97 . 1 1 11 11 CYS HA H 1 4.905 . . 1 . . . . 11 C HA . 16983 1
98 . 1 1 11 11 CYS HB2 H 1 3.161 . . 2 . . . . 11 C HB2 . 16983 1
99 . 1 1 11 11 CYS HB3 H 1 3.071 . . 2 . . . . 11 C HB3 . 16983 1
100 . 1 1 11 11 CYS C C 13 175.287 . . 1 . . . . 11 C C . 16983 1
101 . 1 1 11 11 CYS CA C 13 58.177 . . 1 . . . . 11 C CA . 16983 1
102 . 1 1 11 11 CYS CB C 13 32.075 . . 1 . . . . 11 C CB . 16983 1
103 . 1 1 11 11 CYS N N 15 116.637 . . 1 . . . . 11 C N . 16983 1
104 . 1 1 12 12 ASP H H 1 8.290 . . 1 . . . . 12 D H . 16983 1
105 . 1 1 12 12 ASP HA H 1 4.588 . . 1 . . . . 12 D HA . 16983 1
106 . 1 1 12 12 ASP HB2 H 1 2.939 . . 2 . . . . 12 D HB2 . 16983 1
107 . 1 1 12 12 ASP HB3 H 1 2.652 . . 2 . . . . 12 D HB3 . 16983 1
108 . 1 1 12 12 ASP C C 13 175.008 . . 1 . . . . 12 D C . 16983 1
109 . 1 1 12 12 ASP CA C 13 56.096 . . 1 . . . . 12 D CA . 16983 1
110 . 1 1 12 12 ASP CB C 13 40.512 . . 1 . . . . 12 D CB . 16983 1
111 . 1 1 12 12 ASP N N 15 120.443 . . 1 . . . . 12 D N . 16983 1
112 . 1 1 13 13 LYS H H 1 8.039 . . 1 . . . . 13 K H . 16983 1
113 . 1 1 13 13 LYS HA H 1 4.549 . . 1 . . . . 13 K HA . 16983 1
114 . 1 1 13 13 LYS HB2 H 1 1.976 . . 2 . . . . 13 K HB2 . 16983 1
115 . 1 1 13 13 LYS HB3 H 1 1.713 . . 2 . . . . 13 K HB3 . 16983 1
116 . 1 1 13 13 LYS HD2 H 1 1.613 . . 2 . . . . 13 K QD . 16983 1
117 . 1 1 13 13 LYS HD3 H 1 1.613 . . 2 . . . . 13 K QD . 16983 1
118 . 1 1 13 13 LYS HE2 H 1 2.931 . . 2 . . . . 13 K QE . 16983 1
119 . 1 1 13 13 LYS HE3 H 1 2.931 . . 2 . . . . 13 K QE . 16983 1
120 . 1 1 13 13 LYS HG2 H 1 1.426 . . 2 . . . . 13 K HG2 . 16983 1
121 . 1 1 13 13 LYS HG3 H 1 1.372 . . 2 . . . . 13 K HG3 . 16983 1
122 . 1 1 13 13 LYS C C 13 176.019 . . 1 . . . . 13 K C . 16983 1
123 . 1 1 13 13 LYS CA C 13 55.970 . . 1 . . . . 13 K CA . 16983 1
124 . 1 1 13 13 LYS CB C 13 34.916 . . 1 . . . . 13 K CB . 16983 1
125 . 1 1 13 13 LYS CD C 13 29.181 . . 1 . . . . 13 K CD . 16983 1
126 . 1 1 13 13 LYS CE C 13 42.367 . . 1 . . . . 13 K CE . 16983 1
127 . 1 1 13 13 LYS CG C 13 25.197 . . 1 . . . . 13 K CG . 16983 1
128 . 1 1 13 13 LYS N N 15 118.636 . . 1 . . . . 13 K N . 16983 1
129 . 1 1 14 14 CYS H H 1 8.458 . . 1 . . . . 14 C H . 16983 1
130 . 1 1 14 14 CYS HA H 1 4.370 . . 1 . . . . 14 C HA . 16983 1
131 . 1 1 14 14 CYS HB2 H 1 2.530 . . 2 . . . . 14 C QB . 16983 1
132 . 1 1 14 14 CYS HB3 H 1 2.530 . . 2 . . . . 14 C QB . 16983 1
133 . 1 1 14 14 CYS C C 13 175.116 . . 1 . . . . 14 C C . 16983 1
134 . 1 1 14 14 CYS CA C 13 57.907 . . 1 . . . . 14 C CA . 16983 1
135 . 1 1 14 14 CYS CB C 13 28.248 . . 1 . . . . 14 C CB . 16983 1
136 . 1 1 14 14 CYS N N 15 121.081 . . 1 . . . . 14 C N . 16983 1
137 . 1 1 15 15 TYR H H 1 8.088 . . 1 . . . . 15 Y H . 16983 1
138 . 1 1 15 15 TYR HA H 1 4.508 . . 1 . . . . 15 Y HA . 16983 1
139 . 1 1 15 15 TYR HB2 H 1 2.776 . . 2 . . . . 15 Y QB . 16983 1
140 . 1 1 15 15 TYR HB3 H 1 2.776 . . 2 . . . . 15 Y QB . 16983 1
141 . 1 1 15 15 TYR HD1 H 1 6.774 . . 3 . . . . 15 Y QD . 16983 1
142 . 1 1 15 15 TYR HD2 H 1 6.774 . . 3 . . . . 15 Y QD . 16983 1
143 . 1 1 15 15 TYR HE1 H 1 6.770 . . 3 . . . . 15 Y HE1 . 16983 1
144 . 1 1 15 15 TYR HE2 H 1 6.386 . . 3 . . . . 15 Y HE2 . 16983 1
145 . 1 1 15 15 TYR C C 13 175.457 . . 1 . . . . 15 Y C . 16983 1
146 . 1 1 15 15 TYR CA C 13 58.091 . . 1 . . . . 15 Y CA . 16983 1
147 . 1 1 15 15 TYR CB C 13 39.003 . . 1 . . . . 15 Y CB . 16983 1
148 . 1 1 15 15 TYR CD1 C 13 132.790 . . 3 . . . . 15 Y CD1 . 16983 1
149 . 1 1 15 15 TYR CD2 C 13 132.802 . . 3 . . . . 15 Y CD2 . 16983 1
150 . 1 1 15 15 TYR CE1 C 13 118.413 . . 3 . . . . 15 Y CE1 . 16983 1
151 . 1 1 15 15 TYR CE2 C 13 117.790 . . 3 . . . . 15 Y CE2 . 16983 1
152 . 1 1 15 15 TYR N N 15 124.545 . . 1 . . . . 15 Y N . 16983 1
153 . 1 1 16 16 ASP H H 1 8.304 . . 1 . . . . 16 D H . 16983 1
154 . 1 1 16 16 ASP HA H 1 4.538 . . 1 . . . . 16 D HA . 16983 1
155 . 1 1 16 16 ASP HB2 H 1 2.658 . . 2 . . . . 16 D HB2 . 16983 1
156 . 1 1 16 16 ASP HB3 H 1 2.568 . . 2 . . . . 16 D HB3 . 16983 1
157 . 1 1 16 16 ASP C C 13 176.209 . . 1 . . . . 16 D C . 16983 1
158 . 1 1 16 16 ASP CA C 13 54.331 . . 1 . . . . 16 D CA . 16983 1
159 . 1 1 16 16 ASP CB C 13 41.799 . . 1 . . . . 16 D CB . 16983 1
160 . 1 1 16 16 ASP N N 15 122.076 . . 1 . . . . 16 D N . 16983 1
161 . 1 1 17 17 ASP H H 1 8.035 . . 1 . . . . 17 D H . 16983 1
162 . 1 1 17 17 ASP HA H 1 4.412 . . 1 . . . . 17 D HA . 16983 1
163 . 1 1 17 17 ASP HB2 H 1 2.653 . . 2 . . . . 17 D HB2 . 16983 1
164 . 1 1 17 17 ASP HB3 H 1 2.586 . . 2 . . . . 17 D HB3 . 16983 1
165 . 1 1 17 17 ASP C C 13 176.480 . . 1 . . . . 17 D C . 16983 1
166 . 1 1 17 17 ASP CA C 13 55.338 . . 1 . . . . 17 D CA . 16983 1
167 . 1 1 17 17 ASP CB C 13 41.333 . . 1 . . . . 17 D CB . 16983 1
168 . 1 1 17 17 ASP N N 15 120.034 . . 1 . . . . 17 D N . 16983 1
169 . 1 1 18 18 ASP H H 1 8.177 . . 1 . . . . 18 D H . 16983 1
170 . 1 1 18 18 ASP HA H 1 4.502 . . 1 . . . . 18 D HA . 16983 1
171 . 1 1 18 18 ASP HB2 H 1 2.639 . . 2 . . . . 18 D QB . 16983 1
172 . 1 1 18 18 ASP HB3 H 1 2.639 . . 2 . . . . 18 D QB . 16983 1
173 . 1 1 18 18 ASP C C 13 176.182 . . 1 . . . . 18 D C . 16983 1
174 . 1 1 18 18 ASP CA C 13 54.951 . . 1 . . . . 18 D CA . 16983 1
175 . 1 1 18 18 ASP CB C 13 41.418 . . 1 . . . . 18 D CB . 16983 1
176 . 1 1 18 18 ASP N N 15 119.388 . . 1 . . . . 18 D N . 16983 1
177 . 1 1 19 19 ASP H H 1 8.002 . . 1 . . . . 19 D H . 16983 1
178 . 1 1 19 19 ASP HA H 1 4.522 . . 1 . . . . 19 D HA . 16983 1
179 . 1 1 19 19 ASP HB2 H 1 2.626 . . 2 . . . . 19 D QB . 16983 1
180 . 1 1 19 19 ASP HB3 H 1 2.626 . . 2 . . . . 19 D QB . 16983 1
181 . 1 1 19 19 ASP C C 13 176.687 . . 1 . . . . 19 D C . 16983 1
182 . 1 1 19 19 ASP CA C 13 54.392 . . 1 . . . . 19 D CA . 16983 1
183 . 1 1 19 19 ASP CB C 13 41.253 . . 1 . . . . 19 D CB . 16983 1
184 . 1 1 19 19 ASP N N 15 119.716 . . 1 . . . . 19 D N . 16983 1
185 . 1 1 20 20 TYR H H 1 7.960 . . 1 . . . . 20 Y H . 16983 1
186 . 1 1 20 20 TYR HA H 1 4.271 . . 1 . . . . 20 Y HA . 16983 1
187 . 1 1 20 20 TYR HB2 H 1 2.950 . . 2 . . . . 20 Y QB . 16983 1
188 . 1 1 20 20 TYR HB3 H 1 2.950 . . 2 . . . . 20 Y QB . 16983 1
189 . 1 1 20 20 TYR HD1 H 1 6.962 . . 3 . . . . 20 Y QD . 16983 1
190 . 1 1 20 20 TYR HD2 H 1 6.962 . . 3 . . . . 20 Y QD . 16983 1
191 . 1 1 20 20 TYR HE1 H 1 6.950 . . 3 . . . . 20 Y HE1 . 16983 1
192 . 1 1 20 20 TYR HE2 H 1 6.690 . . 3 . . . . 20 Y HE2 . 16983 1
193 . 1 1 20 20 TYR C C 13 176.480 . . 1 . . . . 20 Y C . 16983 1
194 . 1 1 20 20 TYR CA C 13 59.355 . . 1 . . . . 20 Y CA . 16983 1
195 . 1 1 20 20 TYR CB C 13 38.401 . . 1 . . . . 20 Y CB . 16983 1
196 . 1 1 20 20 TYR CD1 C 13 133.154 . . 3 . . . . 20 Y CD1 . 16983 1
197 . 1 1 20 20 TYR CD2 C 13 133.202 . . 3 . . . . 20 Y CD2 . 16983 1
198 . 1 1 20 20 TYR N N 15 121.100 . . 1 . . . . 20 Y N . 16983 1
199 . 1 1 21 21 GLU H H 1 8.175 . . 1 . . . . 21 E H . 16983 1
200 . 1 1 21 21 GLU HA H 1 4.122 . . 1 . . . . 21 E HA . 16983 1
201 . 1 1 21 21 GLU HB2 H 1 1.978 . . 2 . . . . 21 E HB2 . 16983 1
202 . 1 1 21 21 GLU HB3 H 1 1.907 . . 2 . . . . 21 E HB3 . 16983 1
203 . 1 1 21 21 GLU HG2 H 1 2.112 . . 2 . . . . 21 E QG . 16983 1
204 . 1 1 21 21 GLU HG3 H 1 2.112 . . 2 . . . . 21 E QG . 16983 1
205 . 1 1 21 21 GLU C C 13 176.754 . . 1 . . . . 21 E C . 16983 1
206 . 1 1 21 21 GLU CA C 13 57.316 . . 1 . . . . 21 E CA . 16983 1
207 . 1 1 21 21 GLU CB C 13 30.000 . . 1 . . . . 21 E CB . 16983 1
208 . 1 1 21 21 GLU CG C 13 36.637 . . 1 . . . . 21 E CG . 16983 1
209 . 1 1 21 21 GLU N N 15 119.507 . . 1 . . . . 21 E N . 16983 1
210 . 1 1 22 22 SER H H 1 7.768 . . 1 . . . . 22 S H . 16983 1
211 . 1 1 22 22 SER HA H 1 4.333 . . 1 . . . . 22 S HA . 16983 1
212 . 1 1 22 22 SER HB2 H 1 3.793 . . 2 . . . . 22 S QB . 16983 1
213 . 1 1 22 22 SER HB3 H 1 3.793 . . 2 . . . . 22 S QB . 16983 1
214 . 1 1 22 22 SER C C 13 174.232 . . 1 . . . . 22 S C . 16983 1
215 . 1 1 22 22 SER CA C 13 58.752 . . 1 . . . . 22 S CA . 16983 1
216 . 1 1 22 22 SER CB C 13 64.067 . . 1 . . . . 22 S CB . 16983 1
217 . 1 1 22 22 SER N N 15 115.023 . . 1 . . . . 22 S N . 16983 1
218 . 1 1 23 23 LYS H H 1 7.993 . . 1 . . . . 23 K H . 16983 1
219 . 1 1 23 23 LYS HA H 1 4.233 . . 1 . . . . 23 K HA . 16983 1
220 . 1 1 23 23 LYS HB2 H 1 1.607 . . 2 . . . . 23 K QB . 16983 1
221 . 1 1 23 23 LYS HB3 H 1 1.607 . . 2 . . . . 23 K QB . 16983 1
222 . 1 1 23 23 LYS HD2 H 1 1.367 . . 2 . . . . 23 K QD . 16983 1
223 . 1 1 23 23 LYS HD3 H 1 1.367 . . 2 . . . . 23 K QD . 16983 1
224 . 1 1 23 23 LYS HE2 H 1 2.804 . . 2 . . . . 23 K QE . 16983 1
225 . 1 1 23 23 LYS HE3 H 1 2.804 . . 2 . . . . 23 K QE . 16983 1
226 . 1 1 23 23 LYS HG2 H 1 1.122 . . 2 . . . . 23 K QG . 16983 1
227 . 1 1 23 23 LYS HG3 H 1 1.122 . . 2 . . . . 23 K QG . 16983 1
228 . 1 1 23 23 LYS C C 13 176.234 . . 1 . . . . 23 K C . 16983 1
229 . 1 1 23 23 LYS CA C 13 56.586 . . 1 . . . . 23 K CA . 16983 1
230 . 1 1 23 23 LYS CB C 13 32.545 . . 1 . . . . 23 K CB . 16983 1
231 . 1 1 23 23 LYS CD C 13 29.007 . . 1 . . . . 23 K CD . 16983 1
232 . 1 1 23 23 LYS CE C 13 42.409 . . 1 . . . . 23 K CE . 16983 1
233 . 1 1 23 23 LYS CG C 13 24.847 . . 1 . . . . 23 K CG . 16983 1
234 . 1 1 23 23 LYS N N 15 121.884 . . 1 . . . . 23 K N . 16983 1
235 . 1 1 24 24 MET H H 1 8.350 . . 1 . . . . 24 M H . 16983 1
236 . 1 1 24 24 MET HA H 1 5.263 . . 1 . . . . 24 M HA . 16983 1
237 . 1 1 24 24 MET HB2 H 1 2.070 . . 2 . . . . 24 M HB2 . 16983 1
238 . 1 1 24 24 MET HB3 H 1 1.923 . . 2 . . . . 24 M HB3 . 16983 1
239 . 1 1 24 24 MET HE1 H 1 1.326 . . . . . . . 24 M QE . 16983 1
240 . 1 1 24 24 MET HE2 H 1 1.326 . . . . . . . 24 M QE . 16983 1
241 . 1 1 24 24 MET HE3 H 1 1.326 . . . . . . . 24 M QE . 16983 1
242 . 1 1 24 24 MET HG2 H 1 2.430 . . 2 . . . . 24 M HG2 . 16983 1
243 . 1 1 24 24 MET HG3 H 1 2.154 . . 2 . . . . 24 M HG3 . 16983 1
244 . 1 1 24 24 MET C C 13 175.145 . . 1 . . . . 24 M C . 16983 1
245 . 1 1 24 24 MET CA C 13 55.010 . . 1 . . . . 24 M CA . 16983 1
246 . 1 1 24 24 MET CB C 13 36.926 . . 1 . . . . 24 M CB . 16983 1
247 . 1 1 24 24 MET CE C 13 17.016 . . 1 . . . . 24 M CE . 16983 1
248 . 1 1 24 24 MET CG C 13 32.608 . . 1 . . . . 24 M CG . 16983 1
249 . 1 1 24 24 MET N N 15 121.058 . . 1 . . . . 24 M N . 16983 1
250 . 1 1 25 25 MET H H 1 8.898 . . 1 . . . . 25 M H . 16983 1
251 . 1 1 25 25 MET HA H 1 4.728 . . 1 . . . . 25 M HA . 16983 1
252 . 1 1 25 25 MET HB2 H 1 1.421 . . 2 . . . . 25 M HB2 . 16983 1
253 . 1 1 25 25 MET HB3 H 1 1.381 . . 2 . . . . 25 M HB3 . 16983 1
254 . 1 1 25 25 MET HE1 H 1 1.447 . . . . . . . 25 M QE . 16983 1
255 . 1 1 25 25 MET HE2 H 1 1.447 . . . . . . . 25 M QE . 16983 1
256 . 1 1 25 25 MET HE3 H 1 1.447 . . . . . . . 25 M QE . 16983 1
257 . 1 1 25 25 MET HG2 H 1 2.066 . . 2 . . . . 25 M HG2 . 16983 1
258 . 1 1 25 25 MET HG3 H 1 1.933 . . 2 . . . . 25 M HG3 . 16983 1
259 . 1 1 25 25 MET C C 13 173.278 . . 1 . . . . 25 M C . 16983 1
260 . 1 1 25 25 MET CA C 13 54.041 . . 1 . . . . 25 M CA . 16983 1
261 . 1 1 25 25 MET CB C 13 35.433 . . 1 . . . . 25 M CB . 16983 1
262 . 1 1 25 25 MET CE C 13 16.883 . . 1 . . . . 25 M CE . 16983 1
263 . 1 1 25 25 MET CG C 13 31.577 . . 1 . . . . 25 M CG . 16983 1
264 . 1 1 25 25 MET N N 15 119.990 . . 1 . . . . 25 M N . 16983 1
265 . 1 1 26 26 GLN H H 1 8.223 . . 1 . . . . 26 Q H . 16983 1
266 . 1 1 26 26 GLN HA H 1 4.220 . . 1 . . . . 26 Q HA . 16983 1
267 . 1 1 26 26 GLN HB2 H 1 1.162 . . 2 . . . . 26 Q HB2 . 16983 1
268 . 1 1 26 26 GLN HB3 H 1 -0.560 . . 2 . . . . 26 Q HB3 . 16983 1
269 . 1 1 26 26 GLN HE21 H 1 6.940 . . 2 . . . . 26 Q HE21 . 16983 1
270 . 1 1 26 26 GLN HE22 H 1 6.460 . . 2 . . . . 26 Q HE22 . 16983 1
271 . 1 1 26 26 GLN HG2 H 1 1.377 . . 2 . . . . 26 Q HG2 . 16983 1
272 . 1 1 26 26 GLN HG3 H 1 0.617 . . 2 . . . . 26 Q HG3 . 16983 1
273 . 1 1 26 26 GLN C C 13 175.212 . . 1 . . . . 26 Q C . 16983 1
274 . 1 1 26 26 GLN CA C 13 53.792 . . 1 . . . . 26 Q CA . 16983 1
275 . 1 1 26 26 GLN CB C 13 28.786 . . 1 . . . . 26 Q CB . 16983 1
276 . 1 1 26 26 GLN CG C 13 32.880 . . 1 . . . . 26 Q CG . 16983 1
277 . 1 1 26 26 GLN N N 15 123.224 . . 1 . . . . 26 Q N . 16983 1
278 . 1 1 26 26 GLN NE2 N 15 110.026 . . 1 . . . . 26 Q NE2 . 16983 1
279 . 1 1 27 27 CYS H H 1 8.766 . . 1 . . . . 27 C H . 16983 1
280 . 1 1 27 27 CYS HA H 1 4.296 . . 1 . . . . 27 C HA . 16983 1
281 . 1 1 27 27 CYS HB2 H 1 3.392 . . 2 . . . . 27 C HB2 . 16983 1
282 . 1 1 27 27 CYS HB3 H 1 2.544 . . 2 . . . . 27 C HB3 . 16983 1
283 . 1 1 27 27 CYS C C 13 177.734 . . 1 . . . . 27 C C . 16983 1
284 . 1 1 27 27 CYS CA C 13 59.546 . . 1 . . . . 27 C CA . 16983 1
285 . 1 1 27 27 CYS CB C 13 31.411 . . 1 . . . . 27 C CB . 16983 1
286 . 1 1 27 27 CYS N N 15 128.888 . . 1 . . . . 27 C N . 16983 1
287 . 1 1 28 28 GLY H H 1 9.131 . . 1 . . . . 28 G H . 16983 1
288 . 1 1 28 28 GLY HA2 H 1 4.086 . . 2 . . . . 28 G HA2 . 16983 1
289 . 1 1 28 28 GLY HA3 H 1 3.760 . . 2 . . . . 28 G HA3 . 16983 1
290 . 1 1 28 28 GLY C C 13 173.944 . . 1 . . . . 28 G C . 16983 1
291 . 1 1 28 28 GLY CA C 13 46.660 . . 1 . . . . 28 G CA . 16983 1
292 . 1 1 28 28 GLY N N 15 117.191 . . 1 . . . . 28 G N . 16983 1
293 . 1 1 29 29 LYS H H 1 9.361 . . 1 . . . . 29 K H . 16983 1
294 . 1 1 29 29 LYS HA H 1 4.518 . . 1 . . . . 29 K HA . 16983 1
295 . 1 1 29 29 LYS HB2 H 1 2.035 . . 2 . . . . 29 K HB2 . 16983 1
296 . 1 1 29 29 LYS HB3 H 1 1.990 . . 2 . . . . 29 K HB3 . 16983 1
297 . 1 1 29 29 LYS HD2 H 1 1.603 . . 2 . . . . 29 K QD . 16983 1
298 . 1 1 29 29 LYS HD3 H 1 1.603 . . 2 . . . . 29 K QD . 16983 1
299 . 1 1 29 29 LYS HE2 H 1 2.923 . . 2 . . . . 29 K QE . 16983 1
300 . 1 1 29 29 LYS HE3 H 1 2.923 . . 2 . . . . 29 K QE . 16983 1
301 . 1 1 29 29 LYS HG2 H 1 1.399 . . 2 . . . . 29 K QG . 16983 1
302 . 1 1 29 29 LYS HG3 H 1 1.399 . . 2 . . . . 29 K QG . 16983 1
303 . 1 1 29 29 LYS C C 13 177.178 . . 1 . . . . 29 K C . 16983 1
304 . 1 1 29 29 LYS CA C 13 57.755 . . 1 . . . . 29 K CA . 16983 1
305 . 1 1 29 29 LYS CB C 13 33.972 . . 1 . . . . 29 K CB . 16983 1
306 . 1 1 29 29 LYS CD C 13 28.939 . . 1 . . . . 29 K CD . 16983 1
307 . 1 1 29 29 LYS CE C 13 42.279 . . 1 . . . . 29 K CE . 16983 1
308 . 1 1 29 29 LYS CG C 13 25.474 . . 1 . . . . 29 K CG . 16983 1
309 . 1 1 29 29 LYS N N 15 123.620 . . 1 . . . . 29 K N . 16983 1
310 . 1 1 30 30 CYS H H 1 8.285 . . 1 . . . . 30 C H . 16983 1
311 . 1 1 30 30 CYS HA H 1 4.814 . . 1 . . . . 30 C HA . 16983 1
312 . 1 1 30 30 CYS HB2 H 1 3.147 . . 2 . . . . 30 C HB2 . 16983 1
313 . 1 1 30 30 CYS HB3 H 1 2.580 . . 2 . . . . 30 C HB3 . 16983 1
314 . 1 1 30 30 CYS C C 13 175.853 . . 1 . . . . 30 C C . 16983 1
315 . 1 1 30 30 CYS CA C 13 58.918 . . 1 . . . . 30 C CA . 16983 1
316 . 1 1 30 30 CYS CB C 13 32.080 . . 1 . . . . 30 C CB . 16983 1
317 . 1 1 30 30 CYS N N 15 118.369 . . 1 . . . . 30 C N . 16983 1
318 . 1 1 31 31 ASP H H 1 7.516 . . 1 . . . . 31 D H . 16983 1
319 . 1 1 31 31 ASP HA H 1 4.426 . . 1 . . . . 31 D HA . 16983 1
320 . 1 1 31 31 ASP HB2 H 1 2.907 . . 2 . . . . 31 D HB2 . 16983 1
321 . 1 1 31 31 ASP HB3 H 1 2.810 . . 2 . . . . 31 D HB3 . 16983 1
322 . 1 1 31 31 ASP C C 13 175.523 . . 1 . . . . 31 D C . 16983 1
323 . 1 1 31 31 ASP CA C 13 56.699 . . 1 . . . . 31 D CA . 16983 1
324 . 1 1 31 31 ASP CB C 13 40.366 . . 1 . . . . 31 D CB . 16983 1
325 . 1 1 31 31 ASP N N 15 117.925 . . 1 . . . . 31 D N . 16983 1
326 . 1 1 32 32 ARG H H 1 8.205 . . 1 . . . . 32 R H . 16983 1
327 . 1 1 32 32 ARG HA H 1 4.420 . . 1 . . . . 32 R HA . 16983 1
328 . 1 1 32 32 ARG HB2 H 1 2.056 . . 2 . . . . 32 R HB2 . 16983 1
329 . 1 1 32 32 ARG HB3 H 1 1.760 . . 2 . . . . 32 R HB3 . 16983 1
330 . 1 1 32 32 ARG HD2 H 1 3.277 . . 2 . . . . 32 R QD . 16983 1
331 . 1 1 32 32 ARG HD3 H 1 3.277 . . 2 . . . . 32 R QD . 16983 1
332 . 1 1 32 32 ARG HG2 H 1 1.777 . . 2 . . . . 32 R HG2 . 16983 1
333 . 1 1 32 32 ARG HG3 H 1 1.704 . . 2 . . . . 32 R HG3 . 16983 1
334 . 1 1 32 32 ARG C C 13 175.275 . . 1 . . . . 32 R C . 16983 1
335 . 1 1 32 32 ARG CA C 13 56.708 . . 1 . . . . 32 R CA . 16983 1
336 . 1 1 32 32 ARG CB C 13 31.131 . . 1 . . . . 32 R CB . 16983 1
337 . 1 1 32 32 ARG CD C 13 43.509 . . 1 . . . . 32 R CD . 16983 1
338 . 1 1 32 32 ARG CG C 13 27.844 . . 1 . . . . 32 R CG . 16983 1
339 . 1 1 32 32 ARG N N 15 121.627 . . 1 . . . . 32 R N . 16983 1
340 . 1 1 33 33 TRP H H 1 8.450 . . 1 . . . . 33 W H . 16983 1
341 . 1 1 33 33 TRP HA H 1 4.928 . . 1 . . . . 33 W HA . 16983 1
342 . 1 1 33 33 TRP HB2 H 1 2.823 . . 2 . . . . 33 W HB2 . 16983 1
343 . 1 1 33 33 TRP HB3 H 1 2.741 . . 2 . . . . 33 W HB3 . 16983 1
344 . 1 1 33 33 TRP HD1 H 1 7.208 . . 1 . . . . 33 W HD1 . 16983 1
345 . 1 1 33 33 TRP HE1 H 1 9.937 . . 1 . . . . 33 W HE1 . 16983 1
346 . 1 1 33 33 TRP HE3 H 1 7.079 . . 1 . . . . 33 W HE3 . 16983 1
347 . 1 1 33 33 TRP HH2 H 1 7.357 . . 1 . . . . 33 W HH2 . 16983 1
348 . 1 1 33 33 TRP HZ2 H 1 7.274 . . 1 . . . . 33 W HZ2 . 16983 1
349 . 1 1 33 33 TRP HZ3 H 1 6.883 . . 1 . . . . 33 W HZ3 . 16983 1
350 . 1 1 33 33 TRP C C 13 175.949 . . 1 . . . . 33 W C . 16983 1
351 . 1 1 33 33 TRP CA C 13 56.871 . . 1 . . . . 33 W CA . 16983 1
352 . 1 1 33 33 TRP CB C 13 30.189 . . 1 . . . . 33 W CB . 16983 1
353 . 1 1 33 33 TRP CD1 C 13 127.177 . . 1 . . . . 33 W CD1 . 16983 1
354 . 1 1 33 33 TRP CE3 C 13 124.485 . . 1 . . . . 33 W CE3 . 16983 1
355 . 1 1 33 33 TRP CH2 C 13 127.388 . . 1 . . . . 33 W CH2 . 16983 1
356 . 1 1 33 33 TRP CZ2 C 13 115.061 . . 1 . . . . 33 W CZ2 . 16983 1
357 . 1 1 33 33 TRP CZ3 C 13 121.680 . . 1 . . . . 33 W CZ3 . 16983 1
358 . 1 1 33 33 TRP N N 15 122.116 . . 1 . . . . 33 W N . 16983 1
359 . 1 1 33 33 TRP NE1 N 15 129.607 . . 1 . . . . 33 W NE1 . 16983 1
360 . 1 1 34 34 VAL H H 1 9.087 . . 1 . . . . 34 V H . 16983 1
361 . 1 1 34 34 VAL HA H 1 4.835 . . 1 . . . . 34 V HA . 16983 1
362 . 1 1 34 34 VAL HB H 1 2.079 . . 1 . . . . 34 V HB . 16983 1
363 . 1 1 34 34 VAL HG11 H 1 0.979 . . . . . . . 34 V QG1 . 16983 1
364 . 1 1 34 34 VAL HG12 H 1 0.979 . . . . . . . 34 V QG1 . 16983 1
365 . 1 1 34 34 VAL HG13 H 1 0.979 . . . . . . . 34 V QG1 . 16983 1
366 . 1 1 34 34 VAL HG21 H 1 0.905 . . . . . . . 34 V QG2 . 16983 1
367 . 1 1 34 34 VAL HG22 H 1 0.905 . . . . . . . 34 V QG2 . 16983 1
368 . 1 1 34 34 VAL HG23 H 1 0.905 . . . . . . . 34 V QG2 . 16983 1
369 . 1 1 34 34 VAL C C 13 176.427 . . 1 . . . . 34 V C . 16983 1
370 . 1 1 34 34 VAL CA C 13 59.394 . . 1 . . . . 34 V CA . 16983 1
371 . 1 1 34 34 VAL CB C 13 35.735 . . 1 . . . . 34 V CB . 16983 1
372 . 1 1 34 34 VAL CG1 C 13 21.822 . . 2 . . . . 34 V CG1 . 16983 1
373 . 1 1 34 34 VAL CG2 C 13 20.166 . . 2 . . . . 34 V CG2 . 16983 1
374 . 1 1 34 34 VAL N N 15 117.740 . . 1 . . . . 34 V N . 16983 1
375 . 1 1 35 35 HIS H H 1 8.607 . . 1 . . . . 35 H H . 16983 1
376 . 1 1 35 35 HIS HA H 1 4.919 . . 1 . . . . 35 H HA . 16983 1
377 . 1 1 35 35 HIS HB2 H 1 3.777 . . 2 . . . . 35 H HB2 . 16983 1
378 . 1 1 35 35 HIS HB3 H 1 3.610 . . 2 . . . . 35 H HB3 . 16983 1
379 . 1 1 35 35 HIS HD2 H 1 7.181 . . 1 . . . . 35 H HD2 . 16983 1
380 . 1 1 35 35 HIS HE1 H 1 7.554 . . 1 . . . . 35 H HE1 . 16983 1
381 . 1 1 35 35 HIS C C 13 177.024 . . 1 . . . . 35 H C . 16983 1
382 . 1 1 35 35 HIS CA C 13 57.120 . . 1 . . . . 35 H CA . 16983 1
383 . 1 1 35 35 HIS CB C 13 32.026 . . 1 . . . . 35 H CB . 16983 1
384 . 1 1 35 35 HIS CD2 C 13 118.186 . . 1 . . . . 35 H CD2 . 16983 1
385 . 1 1 35 35 HIS CE1 C 13 138.715 . . 1 . . . . 35 H CE1 . 16983 1
386 . 1 1 35 35 HIS N N 15 123.556 . . 1 . . . . 35 H N . 16983 1
387 . 1 1 36 36 SER H H 1 8.793 . . 1 . . . . 36 S H . 16983 1
388 . 1 1 36 36 SER HA H 1 3.928 . . 1 . . . . 36 S HA . 16983 1
389 . 1 1 36 36 SER HB2 H 1 3.786 . . 2 . . . . 36 S HB2 . 16983 1
390 . 1 1 36 36 SER HB3 H 1 3.674 . . 2 . . . . 36 S HB3 . 16983 1
391 . 1 1 36 36 SER CA C 13 62.241 . . 1 . . . . 36 S CA . 16983 1
392 . 1 1 36 36 SER CB C 13 62.503 . . 1 . . . . 36 S CB . 16983 1
393 . 1 1 36 36 SER N N 15 121.905 . . 1 . . . . 36 S N . 16983 1
394 . 1 1 37 37 LYS HA H 1 4.197 . . 1 . . . . 37 K HA . 16983 1
395 . 1 1 37 37 LYS HB2 H 1 1.714 . . 2 . . . . 37 K QB . 16983 1
396 . 1 1 37 37 LYS HB3 H 1 1.714 . . 2 . . . . 37 K QB . 16983 1
397 . 1 1 37 37 LYS HD2 H 1 1.575 . . 2 . . . . 37 K QD . 16983 1
398 . 1 1 37 37 LYS HD3 H 1 1.575 . . 2 . . . . 37 K QD . 16983 1
399 . 1 1 37 37 LYS HE2 H 1 2.849 . . 2 . . . . 37 K QE . 16983 1
400 . 1 1 37 37 LYS HE3 H 1 2.849 . . 2 . . . . 37 K QE . 16983 1
401 . 1 1 37 37 LYS HG2 H 1 1.429 . . 2 . . . . 37 K HG2 . 16983 1
402 . 1 1 37 37 LYS HG3 H 1 1.341 . . 2 . . . . 37 K HG3 . 16983 1
403 . 1 1 37 37 LYS CA C 13 58.427 . . 1 . . . . 37 K CA . 16983 1
404 . 1 1 37 37 LYS CB C 13 32.428 . . 1 . . . . 37 K CB . 16983 1
405 . 1 1 38 38 CYS H H 1 7.003 . . 1 . . . . 38 C H . 16983 1
406 . 1 1 38 38 CYS HA H 1 4.063 . . 1 . . . . 38 C HA . 16983 1
407 . 1 1 38 38 CYS HB2 H 1 3.092 . . 2 . . . . 38 C HB2 . 16983 1
408 . 1 1 38 38 CYS HB3 H 1 3.022 . . 2 . . . . 38 C HB3 . 16983 1
409 . 1 1 38 38 CYS CA C 13 62.549 . . 1 . . . . 38 C CA . 16983 1
410 . 1 1 38 38 CYS CB C 13 30.012 . . 1 . . . . 38 C CB . 16983 1
411 . 1 1 38 38 CYS N N 15 119.750 . . 1 . . . . 38 C N . 16983 1
412 . 1 1 39 39 GLU H H 1 7.479 . . 1 . . . . 39 E H . 16983 1
413 . 1 1 39 39 GLU HA H 1 4.358 . . 1 . . . . 39 E HA . 16983 1
414 . 1 1 39 39 GLU HB2 H 1 2.226 . . 2 . . . . 39 E HB2 . 16983 1
415 . 1 1 39 39 GLU HB3 H 1 1.852 . . 2 . . . . 39 E HB3 . 16983 1
416 . 1 1 39 39 GLU HG2 H 1 2.241 . . 2 . . . . 39 E HG2 . 16983 1
417 . 1 1 39 39 GLU HG3 H 1 2.158 . . 2 . . . . 39 E HG3 . 16983 1
418 . 1 1 39 39 GLU C C 13 175.319 . . 1 . . . . 39 E C . 16983 1
419 . 1 1 39 39 GLU CA C 13 56.680 . . 1 . . . . 39 E CA . 16983 1
420 . 1 1 39 39 GLU CB C 13 30.611 . . 1 . . . . 39 E CB . 16983 1
421 . 1 1 39 39 GLU CG C 13 36.616 . . 1 . . . . 39 E CG . 16983 1
422 . 1 1 39 39 GLU N N 15 118.959 . . 1 . . . . 39 E N . 16983 1
423 . 1 1 40 40 ASN H H 1 7.957 . . 1 . . . . 40 N H . 16983 1
424 . 1 1 40 40 ASN HA H 1 4.431 . . 1 . . . . 40 N HA . 16983 1
425 . 1 1 40 40 ASN HB2 H 1 3.006 . . 2 . . . . 40 N HB2 . 16983 1
426 . 1 1 40 40 ASN HB3 H 1 2.738 . . 2 . . . . 40 N HB3 . 16983 1
427 . 1 1 40 40 ASN HD21 H 1 7.508 . . 2 . . . . 40 N HD21 . 16983 1
428 . 1 1 40 40 ASN HD22 H 1 6.783 . . 2 . . . . 40 N HD22 . 16983 1
429 . 1 1 40 40 ASN C C 13 174.573 . . 1 . . . . 40 N C . 16983 1
430 . 1 1 40 40 ASN CA C 13 53.991 . . 1 . . . . 40 N CA . 16983 1
431 . 1 1 40 40 ASN CB C 13 37.720 . . 1 . . . . 40 N CB . 16983 1
432 . 1 1 40 40 ASN N N 15 115.330 . . 1 . . . . 40 N N . 16983 1
433 . 1 1 40 40 ASN ND2 N 15 112.619 . . 1 . . . . 40 N ND2 . 16983 1
434 . 1 1 41 41 LEU H H 1 7.746 . . 1 . . . . 41 L H . 16983 1
435 . 1 1 41 41 LEU HA H 1 4.468 . . 1 . . . . 41 L HA . 16983 1
436 . 1 1 41 41 LEU HB2 H 1 1.535 . . 2 . . . . 41 L HB2 . 16983 1
437 . 1 1 41 41 LEU HB3 H 1 1.392 . . 2 . . . . 41 L HB3 . 16983 1
438 . 1 1 41 41 LEU HD11 H 1 0.808 . . . . . . . 41 L QD1 . 16983 1
439 . 1 1 41 41 LEU HD12 H 1 0.808 . . . . . . . 41 L QD1 . 16983 1
440 . 1 1 41 41 LEU HD13 H 1 0.808 . . . . . . . 41 L QD1 . 16983 1
441 . 1 1 41 41 LEU HD21 H 1 0.825 . . . . . . . 41 L QD2 . 16983 1
442 . 1 1 41 41 LEU HD22 H 1 0.825 . . . . . . . 41 L QD2 . 16983 1
443 . 1 1 41 41 LEU HD23 H 1 0.825 . . . . . . . 41 L QD2 . 16983 1
444 . 1 1 41 41 LEU HG H 1 1.616 . . 1 . . . . 41 L HG . 16983 1
445 . 1 1 41 41 LEU C C 13 177.344 . . 1 . . . . 41 L C . 16983 1
446 . 1 1 41 41 LEU CA C 13 54.549 . . 1 . . . . 41 L CA . 16983 1
447 . 1 1 41 41 LEU CB C 13 43.157 . . 1 . . . . 41 L CB . 16983 1
448 . 1 1 41 41 LEU CD1 C 13 25.780 . . 2 . . . . 41 L CD1 . 16983 1
449 . 1 1 41 41 LEU CD2 C 13 23.941 . . 2 . . . . 41 L CD2 . 16983 1
450 . 1 1 41 41 LEU N N 15 119.266 . . 1 . . . . 41 L N . 16983 1
451 . 1 1 42 42 SER H H 1 8.411 . . 1 . . . . 42 S H . 16983 1
452 . 1 1 42 42 SER HA H 1 4.412 . . 1 . . . . 42 S HA . 16983 1
453 . 1 1 42 42 SER HB2 H 1 4.306 . . 2 . . . . 42 S HB2 . 16983 1
454 . 1 1 42 42 SER HB3 H 1 4.023 . . 2 . . . . 42 S HB3 . 16983 1
455 . 1 1 42 42 SER C C 13 174.685 . . 1 . . . . 42 S C . 16983 1
456 . 1 1 42 42 SER CA C 13 57.494 . . 1 . . . . 42 S CA . 16983 1
457 . 1 1 42 42 SER CB C 13 64.787 . . 1 . . . . 42 S CB . 16983 1
458 . 1 1 42 42 SER N N 15 119.613 . . 1 . . . . 42 S N . 16983 1
459 . 1 1 43 43 ASP H H 1 8.830 . . 1 . . . . 43 D H . 16983 1
460 . 1 1 43 43 ASP HA H 1 4.416 . . 1 . . . . 43 D HA . 16983 1
461 . 1 1 43 43 ASP HB2 H 1 2.717 . . 2 . . . . 43 D HB2 . 16983 1
462 . 1 1 43 43 ASP HB3 H 1 2.602 . . 2 . . . . 43 D HB3 . 16983 1
463 . 1 1 43 43 ASP C C 13 178.563 . . 1 . . . . 43 D C . 16983 1
464 . 1 1 43 43 ASP CA C 13 57.507 . . 1 . . . . 43 D CA . 16983 1
465 . 1 1 43 43 ASP CB C 13 40.292 . . 1 . . . . 43 D CB . 16983 1
466 . 1 1 43 43 ASP N N 15 122.384 . . 1 . . . . 43 D N . 16983 1
467 . 1 1 44 44 GLU H H 1 8.709 . . 1 . . . . 44 E H . 16983 1
468 . 1 1 44 44 GLU HA H 1 4.091 . . 1 . . . . 44 E HA . 16983 1
469 . 1 1 44 44 GLU HB2 H 1 2.033 . . 2 . . . . 44 E HB2 . 16983 1
470 . 1 1 44 44 GLU HB3 H 1 1.944 . . 2 . . . . 44 E HB3 . 16983 1
471 . 1 1 44 44 GLU HG2 H 1 2.282 . . 2 . . . . 44 E QG . 16983 1
472 . 1 1 44 44 GLU HG3 H 1 2.282 . . 2 . . . . 44 E QG . 16983 1
473 . 1 1 44 44 GLU C C 13 178.644 . . 1 . . . . 44 E C . 16983 1
474 . 1 1 44 44 GLU CA C 13 59.623 . . 1 . . . . 44 E CA . 16983 1
475 . 1 1 44 44 GLU CB C 13 29.533 . . 1 . . . . 44 E CB . 16983 1
476 . 1 1 44 44 GLU CG C 13 36.689 . . 1 . . . . 44 E CG . 16983 1
477 . 1 1 44 44 GLU N N 15 119.644 . . 1 . . . . 44 E N . 16983 1
478 . 1 1 45 45 MET H H 1 7.888 . . 1 . . . . 45 M H . 16983 1
479 . 1 1 45 45 MET HA H 1 4.374 . . 1 . . . . 45 M HA . 16983 1
480 . 1 1 45 45 MET HB2 H 1 2.138 . . 2 . . . . 45 M HB2 . 16983 1
481 . 1 1 45 45 MET HB3 H 1 2.013 . . 2 . . . . 45 M HB3 . 16983 1
482 . 1 1 45 45 MET HE1 H 1 2.078 . . . . . . . 45 M QE . 16983 1
483 . 1 1 45 45 MET HE2 H 1 2.078 . . . . . . . 45 M QE . 16983 1
484 . 1 1 45 45 MET HE3 H 1 2.078 . . . . . . . 45 M QE . 16983 1
485 . 1 1 45 45 MET HG2 H 1 2.593 . . 2 . . . . 45 M QG . 16983 1
486 . 1 1 45 45 MET HG3 H 1 2.593 . . 2 . . . . 45 M QG . 16983 1
487 . 1 1 45 45 MET C C 13 177.959 . . 1 . . . . 45 M C . 16983 1
488 . 1 1 45 45 MET CA C 13 57.012 . . 1 . . . . 45 M CA . 16983 1
489 . 1 1 45 45 MET CB C 13 32.014 . . 1 . . . . 45 M CB . 16983 1
490 . 1 1 45 45 MET CE C 13 17.018 . . 1 . . . . 45 M CE . 16983 1
491 . 1 1 45 45 MET CG C 13 32.686 . . 1 . . . . 45 M CG . 16983 1
492 . 1 1 45 45 MET N N 15 119.179 . . 1 . . . . 45 M N . 16983 1
493 . 1 1 46 46 TYR H H 1 8.488 . . 1 . . . . 46 Y H . 16983 1
494 . 1 1 46 46 TYR HA H 1 3.989 . . 1 . . . . 46 Y HA . 16983 1
495 . 1 1 46 46 TYR HB2 H 1 3.128 . . 2 . . . . 46 Y HB2 . 16983 1
496 . 1 1 46 46 TYR HB3 H 1 2.977 . . 2 . . . . 46 Y HB3 . 16983 1
497 . 1 1 46 46 TYR HD1 H 1 6.996 . . 3 . . . . 46 Y QD . 16983 1
498 . 1 1 46 46 TYR HD2 H 1 6.996 . . 3 . . . . 46 Y QD . 16983 1
499 . 1 1 46 46 TYR HE1 H 1 6.982 . . 3 . . . . 46 Y HE1 . 16983 1
500 . 1 1 46 46 TYR HE2 H 1 6.706 . . 3 . . . . 46 Y HE2 . 16983 1
501 . 1 1 46 46 TYR C C 13 177.817 . . 1 . . . . 46 Y C . 16983 1
502 . 1 1 46 46 TYR CA C 13 61.941 . . 1 . . . . 46 Y CA . 16983 1
503 . 1 1 46 46 TYR CB C 13 38.192 . . 1 . . . . 46 Y CB . 16983 1
504 . 1 1 46 46 TYR CD1 C 13 132.989 . . 3 . . . . 46 Y CD1 . 16983 1
505 . 1 1 46 46 TYR CD2 C 13 133.051 . . 3 . . . . 46 Y CD2 . 16983 1
506 . 1 1 46 46 TYR N N 15 120.172 . . 1 . . . . 46 Y N . 16983 1
507 . 1 1 47 47 GLU H H 1 8.057 . . 1 . . . . 47 E H . 16983 1
508 . 1 1 47 47 GLU HA H 1 3.857 . . 1 . . . . 47 E HA . 16983 1
509 . 1 1 47 47 GLU HB2 H 1 2.089 . . 2 . . . . 47 E QB . 16983 1
510 . 1 1 47 47 GLU HB3 H 1 2.089 . . 2 . . . . 47 E QB . 16983 1
511 . 1 1 47 47 GLU HG2 H 1 2.299 . . 2 . . . . 47 E QG . 16983 1
512 . 1 1 47 47 GLU HG3 H 1 2.299 . . 2 . . . . 47 E QG . 16983 1
513 . 1 1 47 47 GLU C C 13 178.423 . . 1 . . . . 47 E C . 16983 1
514 . 1 1 47 47 GLU CA C 13 59.230 . . 1 . . . . 47 E CA . 16983 1
515 . 1 1 47 47 GLU CB C 13 29.661 . . 1 . . . . 47 E CB . 16983 1
516 . 1 1 47 47 GLU CG C 13 36.187 . . 1 . . . . 47 E CG . 16983 1
517 . 1 1 47 47 GLU N N 15 120.225 . . 1 . . . . 47 E N . 16983 1
518 . 1 1 48 48 ILE H H 1 7.559 . . 1 . . . . 48 I H . 16983 1
519 . 1 1 48 48 ILE HA H 1 3.800 . . 1 . . . . 48 I HA . 16983 1
520 . 1 1 48 48 ILE HB H 1 1.969 . . 1 . . . . 48 I HB . 16983 1
521 . 1 1 48 48 ILE HD11 H 1 0.851 . . . . . . . 48 I QD1 . 16983 1
522 . 1 1 48 48 ILE HD12 H 1 0.851 . . . . . . . 48 I QD1 . 16983 1
523 . 1 1 48 48 ILE HD13 H 1 0.851 . . . . . . . 48 I QD1 . 16983 1
524 . 1 1 48 48 ILE HG12 H 1 1.696 . . 2 . . . . 48 I HG12 . 16983 1
525 . 1 1 48 48 ILE HG13 H 1 1.155 . . 2 . . . . 48 I HG13 . 16983 1
526 . 1 1 48 48 ILE HG21 H 1 0.871 . . . . . . . 48 I QG2 . 16983 1
527 . 1 1 48 48 ILE HG22 H 1 0.871 . . . . . . . 48 I QG2 . 16983 1
528 . 1 1 48 48 ILE HG23 H 1 0.871 . . . . . . . 48 I QG2 . 16983 1
529 . 1 1 48 48 ILE C C 13 178.561 . . 1 . . . . 48 I C . 16983 1
530 . 1 1 48 48 ILE CA C 13 64.267 . . 1 . . . . 48 I CA . 16983 1
531 . 1 1 48 48 ILE CB C 13 38.393 . . 1 . . . . 48 I CB . 16983 1
532 . 1 1 48 48 ILE CD1 C 13 13.202 . . 1 . . . . 48 I CD1 . 16983 1
533 . 1 1 48 48 ILE CG1 C 13 28.880 . . 1 . . . . 48 I CG1 . 16983 1
534 . 1 1 48 48 ILE CG2 C 13 17.286 . . 1 . . . . 48 I CG2 . 16983 1
535 . 1 1 48 48 ILE N N 15 119.580 . . 1 . . . . 48 I N . 16983 1
536 . 1 1 49 49 LEU H H 1 8.205 . . 1 . . . . 49 L H . 16983 1
537 . 1 1 49 49 LEU HA H 1 3.995 . . 1 . . . . 49 L HA . 16983 1
538 . 1 1 49 49 LEU HB2 H 1 1.662 . . 2 . . . . 49 L HB2 . 16983 1
539 . 1 1 49 49 LEU HB3 H 1 1.409 . . 2 . . . . 49 L HB3 . 16983 1
540 . 1 1 49 49 LEU HD11 H 1 0.817 . . . . . . . 49 L QD1 . 16983 1
541 . 1 1 49 49 LEU HD12 H 1 0.817 . . . . . . . 49 L QD1 . 16983 1
542 . 1 1 49 49 LEU HD13 H 1 0.817 . . . . . . . 49 L QD1 . 16983 1
543 . 1 1 49 49 LEU HD21 H 1 0.831 . . . . . . . 49 L QD2 . 16983 1
544 . 1 1 49 49 LEU HD22 H 1 0.831 . . . . . . . 49 L QD2 . 16983 1
545 . 1 1 49 49 LEU HD23 H 1 0.831 . . . . . . . 49 L QD2 . 16983 1
546 . 1 1 49 49 LEU HG H 1 1.754 . . 1 . . . . 49 L HG . 16983 1
547 . 1 1 49 49 LEU C C 13 178.890 . . 1 . . . . 49 L C . 16983 1
548 . 1 1 49 49 LEU CA C 13 57.228 . . 1 . . . . 49 L CA . 16983 1
549 . 1 1 49 49 LEU CB C 13 41.918 . . 1 . . . . 49 L CB . 16983 1
550 . 1 1 49 49 LEU CD1 C 13 26.065 . . 2 . . . . 49 L CD1 . 16983 1
551 . 1 1 49 49 LEU CD2 C 13 23.378 . . 2 . . . . 49 L CD2 . 16983 1
552 . 1 1 49 49 LEU CG C 13 27.101 . . 1 . . . . 49 L CG . 16983 1
553 . 1 1 49 49 LEU N N 15 119.540 . . 1 . . . . 49 L N . 16983 1
554 . 1 1 50 50 SER H H 1 7.931 . . 1 . . . . 50 S H . 16983 1
555 . 1 1 50 50 SER HA H 1 4.134 . . 1 . . . . 50 S HA . 16983 1
556 . 1 1 50 50 SER HB2 H 1 3.770 . . 2 . . . . 50 S HB2 . 16983 1
557 . 1 1 50 50 SER HB3 H 1 3.530 . . 2 . . . . 50 S HB3 . 16983 1
558 . 1 1 50 50 SER C C 13 174.461 . . 1 . . . . 50 S C . 16983 1
559 . 1 1 50 50 SER CA C 13 60.188 . . 1 . . . . 50 S CA . 16983 1
560 . 1 1 50 50 SER CB C 13 63.386 . . 1 . . . . 50 S CB . 16983 1
561 . 1 1 50 50 SER N N 15 112.904 . . 1 . . . . 50 S N . 16983 1
562 . 1 1 51 51 ASN H H 1 7.496 . . 1 . . . . 51 N H . 16983 1
563 . 1 1 51 51 ASN HA H 1 4.836 . . 1 . . . . 51 N HA . 16983 1
564 . 1 1 51 51 ASN HB2 H 1 2.859 . . 2 . . . . 51 N HB2 . 16983 1
565 . 1 1 51 51 ASN HB3 H 1 2.635 . . 2 . . . . 51 N HB3 . 16983 1
566 . 1 1 51 51 ASN HD21 H 1 7.660 . . 2 . . . . 51 N HD21 . 16983 1
567 . 1 1 51 51 ASN HD22 H 1 6.876 . . 2 . . . . 51 N HD22 . 16983 1
568 . 1 1 51 51 ASN C C 13 174.749 . . 1 . . . . 51 N C . 16983 1
569 . 1 1 51 51 ASN CA C 13 53.383 . . 1 . . . . 51 N CA . 16983 1
570 . 1 1 51 51 ASN CB C 13 40.031 . . 1 . . . . 51 N CB . 16983 1
571 . 1 1 51 51 ASN N N 15 118.795 . . 1 . . . . 51 N N . 16983 1
572 . 1 1 51 51 ASN ND2 N 15 114.478 . . 1 . . . . 51 N ND2 . 16983 1
573 . 1 1 52 52 LEU H H 1 7.586 . . 1 . . . . 52 L H . 16983 1
574 . 1 1 52 52 LEU HA H 1 4.588 . . 1 . . . . 52 L HA . 16983 1
575 . 1 1 52 52 LEU HB2 H 1 1.707 . . 2 . . . . 52 L HB2 . 16983 1
576 . 1 1 52 52 LEU HB3 H 1 1.542 . . 2 . . . . 52 L HB3 . 16983 1
577 . 1 1 52 52 LEU HD11 H 1 0.929 . . . . . . . 52 L QD1 . 16983 1
578 . 1 1 52 52 LEU HD12 H 1 0.929 . . . . . . . 52 L QD1 . 16983 1
579 . 1 1 52 52 LEU HD13 H 1 0.929 . . . . . . . 52 L QD1 . 16983 1
580 . 1 1 52 52 LEU HD21 H 1 0.883 . . . . . . . 52 L QD2 . 16983 1
581 . 1 1 52 52 LEU HD22 H 1 0.883 . . . . . . . 52 L QD2 . 16983 1
582 . 1 1 52 52 LEU HD23 H 1 0.883 . . . . . . . 52 L QD2 . 16983 1
583 . 1 1 52 52 LEU HG H 1 1.842 . . 1 . . . . 52 L HG . 16983 1
584 . 1 1 52 52 LEU CA C 13 53.635 . . 1 . . . . 52 L CA . 16983 1
585 . 1 1 52 52 LEU CB C 13 41.931 . . 1 . . . . 52 L CB . 16983 1
586 . 1 1 52 52 LEU CD1 C 13 26.117 . . 2 . . . . 52 L CD1 . 16983 1
587 . 1 1 52 52 LEU CD2 C 13 23.421 . . 2 . . . . 52 L CD2 . 16983 1
588 . 1 1 52 52 LEU N N 15 122.443 . . 1 . . . . 52 L N . 16983 1
589 . 1 1 53 53 PRO HA H 1 4.449 . . 1 . . . . 53 P HA . 16983 1
590 . 1 1 53 53 PRO HB2 H 1 2.348 . . 2 . . . . 53 P HB2 . 16983 1
591 . 1 1 53 53 PRO HB3 H 1 1.962 . . 2 . . . . 53 P HB3 . 16983 1
592 . 1 1 53 53 PRO HD2 H 1 3.792 . . 2 . . . . 53 P HD2 . 16983 1
593 . 1 1 53 53 PRO HD3 H 1 3.570 . . 2 . . . . 53 P HD3 . 16983 1
594 . 1 1 53 53 PRO HG2 H 1 2.016 . . 2 . . . . 53 P QG . 16983 1
595 . 1 1 53 53 PRO HG3 H 1 2.016 . . 2 . . . . 53 P QG . 16983 1
596 . 1 1 53 53 PRO C C 13 177.263 . . 1 . . . . 53 P C . 16983 1
597 . 1 1 53 53 PRO CA C 13 63.598 . . 1 . . . . 53 P CA . 16983 1
598 . 1 1 53 53 PRO CB C 13 32.115 . . 1 . . . . 53 P CB . 16983 1
599 . 1 1 53 53 PRO CD C 13 50.548 . . 1 . . . . 53 P CD . 16983 1
600 . 1 1 53 53 PRO CG C 13 27.526 . . 1 . . . . 53 P CG . 16983 1
601 . 1 1 54 54 GLU H H 1 8.463 . . 1 . . . . 54 E H . 16983 1
602 . 1 1 54 54 GLU HA H 1 4.179 . . 1 . . . . 54 E HA . 16983 1
603 . 1 1 54 54 GLU HB2 H 1 2.049 . . 2 . . . . 54 E HB2 . 16983 1
604 . 1 1 54 54 GLU HB3 H 1 2.006 . . 2 . . . . 54 E HB3 . 16983 1
605 . 1 1 54 54 GLU HG2 H 1 2.276 . . 2 . . . . 54 E QG . 16983 1
606 . 1 1 54 54 GLU HG3 H 1 2.276 . . 2 . . . . 54 E QG . 16983 1
607 . 1 1 54 54 GLU C C 13 176.666 . . 1 . . . . 54 E C . 16983 1
608 . 1 1 54 54 GLU CA C 13 57.693 . . 1 . . . . 54 E CA . 16983 1
609 . 1 1 54 54 GLU CB C 13 29.882 . . 1 . . . . 54 E CB . 16983 1
610 . 1 1 54 54 GLU CG C 13 36.450 . . 1 . . . . 54 E CG . 16983 1
611 . 1 1 54 54 GLU N N 15 118.363 . . 1 . . . . 54 E N . 16983 1
612 . 1 1 55 55 SER H H 1 7.929 . . 1 . . . . 55 S H . 16983 1
613 . 1 1 55 55 SER HA H 1 4.311 . . 1 . . . . 55 S HA . 16983 1
614 . 1 1 55 55 SER HB2 H 1 3.903 . . 2 . . . . 55 S QB . 16983 1
615 . 1 1 55 55 SER HB3 H 1 3.903 . . 2 . . . . 55 S QB . 16983 1
616 . 1 1 55 55 SER C C 13 174.163 . . 1 . . . . 55 S C . 16983 1
617 . 1 1 55 55 SER CA C 13 59.018 . . 1 . . . . 55 S CA . 16983 1
618 . 1 1 55 55 SER CB C 13 63.698 . . 1 . . . . 55 S CB . 16983 1
619 . 1 1 55 55 SER N N 15 113.500 . . 1 . . . . 55 S N . 16983 1
620 . 1 1 56 56 VAL H H 1 7.730 . . 1 . . . . 56 V H . 16983 1
621 . 1 1 56 56 VAL HA H 1 4.288 . . 1 . . . . 56 V HA . 16983 1
622 . 1 1 56 56 VAL HB H 1 2.041 . . 1 . . . . 56 V HB . 16983 1
623 . 1 1 56 56 VAL HG11 H 1 0.897 . . . . . . . 56 V QG1 . 16983 1
624 . 1 1 56 56 VAL HG12 H 1 0.897 . . . . . . . 56 V QG1 . 16983 1
625 . 1 1 56 56 VAL HG13 H 1 0.897 . . . . . . . 56 V QG1 . 16983 1
626 . 1 1 56 56 VAL HG21 H 1 0.881 . . . . . . . 56 V QG2 . 16983 1
627 . 1 1 56 56 VAL HG22 H 1 0.881 . . . . . . . 56 V QG2 . 16983 1
628 . 1 1 56 56 VAL HG23 H 1 0.881 . . . . . . . 56 V QG2 . 16983 1
629 . 1 1 56 56 VAL C C 13 174.728 . . 1 . . . . 56 V C . 16983 1
630 . 1 1 56 56 VAL CA C 13 61.794 . . 1 . . . . 56 V CA . 16983 1
631 . 1 1 56 56 VAL CB C 13 33.090 . . 1 . . . . 56 V CB . 16983 1
632 . 1 1 56 56 VAL CG1 C 13 21.775 . . 2 . . . . 56 V CG1 . 16983 1
633 . 1 1 56 56 VAL CG2 C 13 20.983 . . 2 . . . . 56 V CG2 . 16983 1
634 . 1 1 56 56 VAL N N 15 120.787 . . 1 . . . . 56 V N . 16983 1
635 . 1 1 57 57 ALA H H 1 8.198 . . 1 . . . . 57 A H . 16983 1
636 . 1 1 57 57 ALA HA H 1 4.423 . . 1 . . . . 57 A HA . 16983 1
637 . 1 1 57 57 ALA HB1 H 1 1.316 . . . . . . . 57 A QB . 16983 1
638 . 1 1 57 57 ALA HB2 H 1 1.316 . . . . . . . 57 A QB . 16983 1
639 . 1 1 57 57 ALA HB3 H 1 1.316 . . . . . . . 57 A QB . 16983 1
640 . 1 1 57 57 ALA C C 13 176.720 . . 1 . . . . 57 A C . 16983 1
641 . 1 1 57 57 ALA CA C 13 51.794 . . 1 . . . . 57 A CA . 16983 1
642 . 1 1 57 57 ALA CB C 13 20.250 . . 1 . . . . 57 A CB . 16983 1
643 . 1 1 57 57 ALA N N 15 126.956 . . 1 . . . . 57 A N . 16983 1
644 . 1 1 58 58 TYR H H 1 8.596 . . 1 . . . . 58 Y H . 16983 1
645 . 1 1 58 58 TYR HA H 1 4.497 . . 1 . . . . 58 Y HA . 16983 1
646 . 1 1 58 58 TYR HB2 H 1 2.936 . . 2 . . . . 58 Y HB2 . 16983 1
647 . 1 1 58 58 TYR HB3 H 1 2.747 . . 2 . . . . 58 Y HB3 . 16983 1
648 . 1 1 58 58 TYR HD1 H 1 6.705 . . 3 . . . . 58 Y QD . 16983 1
649 . 1 1 58 58 TYR HD2 H 1 6.705 . . 3 . . . . 58 Y QD . 16983 1
650 . 1 1 58 58 TYR HE1 H 1 6.692 . . 3 . . . . 58 Y HE1 . 16983 1
651 . 1 1 58 58 TYR HE2 H 1 6.461 . . 3 . . . . 58 Y HE2 . 16983 1
652 . 1 1 58 58 TYR C C 13 174.474 . . 1 . . . . 58 Y C . 16983 1
653 . 1 1 58 58 TYR CA C 13 58.359 . . 1 . . . . 58 Y CA . 16983 1
654 . 1 1 58 58 TYR CB C 13 39.900 . . 1 . . . . 58 Y CB . 16983 1
655 . 1 1 58 58 TYR CD1 C 13 132.711 . . 3 . . . . 58 Y CD1 . 16983 1
656 . 1 1 58 58 TYR CD2 C 13 132.680 . . 3 . . . . 58 Y CD2 . 16983 1
657 . 1 1 58 58 TYR CE1 C 13 118.330 . . 3 . . . . 58 Y CE1 . 16983 1
658 . 1 1 58 58 TYR CE2 C 13 117.984 . . 3 . . . . 58 Y CE2 . 16983 1
659 . 1 1 58 58 TYR N N 15 123.526 . . 1 . . . . 58 Y N . 16983 1
660 . 1 1 59 59 THR H H 1 7.208 . . 1 . . . . 59 T H . 16983 1
661 . 1 1 59 59 THR HA H 1 4.922 . . 1 . . . . 59 T HA . 16983 1
662 . 1 1 59 59 THR HB H 1 3.612 . . 1 . . . . 59 T HB . 16983 1
663 . 1 1 59 59 THR HG21 H 1 1.002 . . . . . . . 59 T QG2 . 16983 1
664 . 1 1 59 59 THR HG22 H 1 1.002 . . . . . . . 59 T QG2 . 16983 1
665 . 1 1 59 59 THR HG23 H 1 1.002 . . . . . . . 59 T QG2 . 16983 1
666 . 1 1 59 59 THR C C 13 172.711 . . 1 . . . . 59 T C . 16983 1
667 . 1 1 59 59 THR CA C 13 60.466 . . 1 . . . . 59 T CA . 16983 1
668 . 1 1 59 59 THR CB C 13 70.590 . . 1 . . . . 59 T CB . 16983 1
669 . 1 1 59 59 THR CG2 C 13 22.676 . . 1 . . . . 59 T CG2 . 16983 1
670 . 1 1 59 59 THR N N 15 123.419 . . 1 . . . . 59 T N . 16983 1
671 . 1 1 60 60 CYS H H 1 9.556 . . 1 . . . . 60 C H . 16983 1
672 . 1 1 60 60 CYS HA H 1 4.518 . . 1 . . . . 60 C HA . 16983 1
673 . 1 1 60 60 CYS HB2 H 1 3.659 . . 2 . . . . 60 C HB2 . 16983 1
674 . 1 1 60 60 CYS HB3 H 1 2.670 . . 2 . . . . 60 C HB3 . 16983 1
675 . 1 1 60 60 CYS C C 13 176.950 . . 1 . . . . 60 C C . 16983 1
676 . 1 1 60 60 CYS CA C 13 58.306 . . 1 . . . . 60 C CA . 16983 1
677 . 1 1 60 60 CYS CB C 13 32.169 . . 1 . . . . 60 C CB . 16983 1
678 . 1 1 60 60 CYS N N 15 128.585 . . 1 . . . . 60 C N . 16983 1
679 . 1 1 61 61 VAL H H 1 9.150 . . 1 . . . . 61 V H . 16983 1
680 . 1 1 61 61 VAL HA H 1 3.746 . . 1 . . . . 61 V HA . 16983 1
681 . 1 1 61 61 VAL HB H 1 2.152 . . 1 . . . . 61 V HB . 16983 1
682 . 1 1 61 61 VAL HG11 H 1 1.021 . . . . . . . 61 V QG1 . 16983 1
683 . 1 1 61 61 VAL HG12 H 1 1.021 . . . . . . . 61 V QG1 . 16983 1
684 . 1 1 61 61 VAL HG13 H 1 1.021 . . . . . . . 61 V QG1 . 16983 1
685 . 1 1 61 61 VAL HG21 H 1 0.949 . . . . . . . 61 V QG2 . 16983 1
686 . 1 1 61 61 VAL HG22 H 1 0.949 . . . . . . . 61 V QG2 . 16983 1
687 . 1 1 61 61 VAL HG23 H 1 0.949 . . . . . . . 61 V QG2 . 16983 1
688 . 1 1 61 61 VAL CA C 13 65.567 . . 1 . . . . 61 V CA . 16983 1
689 . 1 1 61 61 VAL CB C 13 31.946 . . 1 . . . . 61 V CB . 16983 1
690 . 1 1 61 61 VAL CG1 C 13 21.698 . . 2 . . . . 61 V CG1 . 16983 1
691 . 1 1 61 61 VAL CG2 C 13 20.873 . . 2 . . . . 61 V CG2 . 16983 1
692 . 1 1 61 61 VAL N N 15 120.014 . . 1 . . . . 61 V N . 16983 1
693 . 1 1 62 62 ASN H H 1 8.451 . . 1 . . . . 62 N H . 16983 1
694 . 1 1 62 62 ASN HA H 1 4.535 . . 1 . . . . 62 N HA . 16983 1
695 . 1 1 62 62 ASN HB2 H 1 2.874 . . 2 . . . . 62 N HB2 . 16983 1
696 . 1 1 62 62 ASN HB3 H 1 2.843 . . 2 . . . . 62 N HB3 . 16983 1
697 . 1 1 62 62 ASN HD21 H 1 7.827 . . 2 . . . . 62 N HD21 . 16983 1
698 . 1 1 62 62 ASN HD22 H 1 6.921 . . 2 . . . . 62 N HD22 . 16983 1
699 . 1 1 62 62 ASN C C 13 177.256 . . 1 . . . . 62 N C . 16983 1
700 . 1 1 62 62 ASN CA C 13 56.098 . . 1 . . . . 62 N CA . 16983 1
701 . 1 1 62 62 ASN CB C 13 39.300 . . 1 . . . . 62 N CB . 16983 1
702 . 1 1 62 62 ASN N N 15 120.510 . . 1 . . . . 62 N N . 16983 1
703 . 1 1 62 62 ASN ND2 N 15 113.008 . . 1 . . . . 62 N ND2 . 16983 1
704 . 1 1 63 63 CYS H H 1 8.258 . . 1 . . . . 63 C H . 16983 1
705 . 1 1 63 63 CYS HA H 1 4.007 . . 1 . . . . 63 C HA . 16983 1
706 . 1 1 63 63 CYS HB2 H 1 2.765 . . 2 . . . . 63 C QB . 16983 1
707 . 1 1 63 63 CYS HB3 H 1 2.765 . . 2 . . . . 63 C QB . 16983 1
708 . 1 1 63 63 CYS C C 13 176.358 . . 1 . . . . 63 C C . 16983 1
709 . 1 1 63 63 CYS CA C 13 62.925 . . 1 . . . . 63 C CA . 16983 1
710 . 1 1 63 63 CYS CB C 13 30.673 . . 1 . . . . 63 C CB . 16983 1
711 . 1 1 63 63 CYS N N 15 122.008 . . 1 . . . . 63 C N . 16983 1
712 . 1 1 64 64 THR H H 1 7.700 . . 1 . . . . 64 T H . 16983 1
713 . 1 1 64 64 THR HA H 1 3.926 . . 1 . . . . 64 T HA . 16983 1
714 . 1 1 64 64 THR HB H 1 4.082 . . 1 . . . . 64 T HB . 16983 1
715 . 1 1 64 64 THR HG21 H 1 1.110 . . . . . . . 64 T QG2 . 16983 1
716 . 1 1 64 64 THR HG22 H 1 1.110 . . . . . . . 64 T QG2 . 16983 1
717 . 1 1 64 64 THR HG23 H 1 1.110 . . . . . . . 64 T QG2 . 16983 1
718 . 1 1 64 64 THR C C 13 174.396 . . 1 . . . . 64 T C . 16983 1
719 . 1 1 64 64 THR CA C 13 64.116 . . 1 . . . . 64 T CA . 16983 1
720 . 1 1 64 64 THR CB C 13 69.702 . . 1 . . . . 64 T CB . 16983 1
721 . 1 1 64 64 THR CG2 C 13 21.386 . . 1 . . . . 64 T CG2 . 16983 1
722 . 1 1 64 64 THR N N 15 116.018 . . 1 . . . . 64 T N . 16983 1
723 . 1 1 65 65 GLU H H 1 8.154 . . 1 . . . . 65 E H . 16983 1
724 . 1 1 65 65 GLU HA H 1 4.161 . . 1 . . . . 65 E HA . 16983 1
725 . 1 1 65 65 GLU HB2 H 1 1.944 . . 2 . . . . 65 E HB2 . 16983 1
726 . 1 1 65 65 GLU HB3 H 1 1.899 . . 2 . . . . 65 E HB3 . 16983 1
727 . 1 1 65 65 GLU HG2 H 1 2.254 . . 2 . . . . 65 E HG2 . 16983 1
728 . 1 1 65 65 GLU HG3 H 1 2.145 . . 2 . . . . 65 E HG3 . 16983 1
729 . 1 1 65 65 GLU C C 13 176.016 . . 1 . . . . 65 E C . 16983 1
730 . 1 1 65 65 GLU CA C 13 56.834 . . 1 . . . . 65 E CA . 16983 1
731 . 1 1 65 65 GLU CB C 13 30.208 . . 1 . . . . 65 E CB . 16983 1
732 . 1 1 65 65 GLU CG C 13 36.381 . . 1 . . . . 65 E CG . 16983 1
733 . 1 1 65 65 GLU N N 15 123.578 . . 1 . . . . 65 E N . 16983 1
734 . 1 1 66 66 ARG H H 1 8.004 . . 1 . . . . 66 R H . 16983 1
735 . 1 1 66 66 ARG HA H 1 4.260 . . 1 . . . . 66 R HA . 16983 1
736 . 1 1 66 66 ARG HB2 H 1 1.779 . . 2 . . . . 66 R HB2 . 16983 1
737 . 1 1 66 66 ARG HB3 H 1 1.668 . . 2 . . . . 66 R HB3 . 16983 1
738 . 1 1 66 66 ARG HD2 H 1 3.134 . . 2 . . . . 66 R QD . 16983 1
739 . 1 1 66 66 ARG HD3 H 1 3.134 . . 2 . . . . 66 R QD . 16983 1
740 . 1 1 66 66 ARG HG2 H 1 1.567 . . 2 . . . . 66 R QG . 16983 1
741 . 1 1 66 66 ARG HG3 H 1 1.567 . . 2 . . . . 66 R QG . 16983 1
742 . 1 1 66 66 ARG C C 13 175.211 . . 1 . . . . 66 R C . 16983 1
743 . 1 1 66 66 ARG CA C 13 56.082 . . 1 . . . . 66 R CA . 16983 1
744 . 1 1 66 66 ARG CB C 13 30.894 . . 1 . . . . 66 R CB . 16983 1
745 . 1 1 66 66 ARG CD C 13 43.448 . . 1 . . . . 66 R CD . 16983 1
746 . 1 1 66 66 ARG CG C 13 27.163 . . 1 . . . . 66 R CG . 16983 1
747 . 1 1 66 66 ARG N N 15 122.210 . . 1 . . . . 66 R N . 16983 1
748 . 1 1 67 67 HIS H H 1 7.978 . . 1 . . . . 67 H H . 16983 1
749 . 1 1 67 67 HIS HA H 1 4.418 . . 1 . . . . 67 H HA . 16983 1
750 . 1 1 67 67 HIS HB2 H 1 3.184 . . 2 . . . . 67 H HB2 . 16983 1
751 . 1 1 67 67 HIS HB3 H 1 3.005 . . 2 . . . . 67 H HB3 . 16983 1
752 . 1 1 67 67 HIS HD2 H 1 7.076 . . 1 . . . . 67 H HD2 . 16983 1
753 . 1 1 67 67 HIS HE1 H 1 8.245 . . 1 . . . . 67 H HE1 . 16983 1
754 . 1 1 67 67 HIS CA C 13 57.225 . . 1 . . . . 67 H CA . 16983 1
755 . 1 1 67 67 HIS CB C 13 30.731 . . 1 . . . . 67 H CB . 16983 1
756 . 1 1 67 67 HIS CD2 C 13 119.927 . . 1 . . . . 67 H CD2 . 16983 1
757 . 1 1 67 67 HIS CE1 C 13 136.818 . . 1 . . . . 67 H CE1 . 16983 1
758 . 1 1 67 67 HIS N N 15 125.464 . . 1 . . . . 67 H N . 16983 1
stop_
save_