###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 34006
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.03
_Assigned_chem_shift_list.Chem_shift_15N_err 0.03
_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 '1H proton' . . . 34006 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
5 $software_5 . . 34006 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 1 1 MET HA H 1 4.155 0.01 . 1 . 2 . . 1 MET HA . 34006 1
2 . 1 1 1 1 MET HB2 H 1 2.149 0.01 . 1 . 4 . . 1 MET HB2 . 34006 1
3 . 1 1 1 1 MET HB3 H 1 2.149 0.01 . 1 . 401 . . 1 MET HB3 . 34006 1
4 . 1 1 1 1 MET HG2 H 1 2.515 0.01 . 1 . 6 . . 1 MET HG2 . 34006 1
5 . 1 1 1 1 MET HG3 H 1 2.570 0.01 . 1 . 7 . . 1 MET HG3 . 34006 1
6 . 1 1 1 1 MET HE1 H 1 2.121 0.01 . 1 . 8 . . 1 MET HE1 . 34006 1
7 . 1 1 1 1 MET HE2 H 1 2.121 0.01 . 1 . 8 . . 1 MET HE2 . 34006 1
8 . 1 1 1 1 MET HE3 H 1 2.121 0.01 . 1 . 8 . . 1 MET HE3 . 34006 1
9 . 1 1 1 1 MET CA C 13 59.332 0.03 . 1 . 1 . . 1 MET CA . 34006 1
10 . 1 1 1 1 MET CB C 13 32.522 0.03 . 1 . 3 . . 1 MET CB . 34006 1
11 . 1 1 1 1 MET CG C 13 30.741 0.03 . 1 . 5 . . 1 MET CG . 34006 1
12 . 1 1 1 1 MET CE C 13 16.164 0.03 . 1 . 9 . . 1 MET CE . 34006 1
13 . 1 1 2 2 LYS H H 1 8.506 0.01 . 1 . 11 . . 2 LYS H . 34006 1
14 . 1 1 2 2 LYS HA H 1 4.405 0.01 . 1 . 13 . . 2 LYS HA . 34006 1
15 . 1 1 2 2 LYS HB2 H 1 1.721 0.01 . 1 . 15 . . 2 LYS HB2 . 34006 1
16 . 1 1 2 2 LYS HB3 H 1 1.774 0.01 . 1 . 16 . . 2 LYS HB3 . 34006 1
17 . 1 1 2 2 LYS HG2 H 1 1.445 0.01 . 1 . 18 . . 2 LYS HG2 . 34006 1
18 . 1 1 2 2 LYS HG3 H 1 1.385 0.01 . 1 . 19 . . 2 LYS HG3 . 34006 1
19 . 1 1 2 2 LYS HD2 H 1 1.716 0.01 . 1 . 21 . . 2 LYS HD2 . 34006 1
20 . 1 1 2 2 LYS HD3 H 1 1.716 0.01 . 1 . 402 . . 2 LYS HD3 . 34006 1
21 . 1 1 2 2 LYS HE2 H 1 3.014 0.01 . 1 . 23 . . 2 LYS HE2 . 34006 1
22 . 1 1 2 2 LYS HE3 H 1 3.014 0.01 . 1 . 403 . . 2 LYS HE3 . 34006 1
23 . 1 1 2 2 LYS CA C 13 56.248 0.03 . 1 . 12 . . 2 LYS CA . 34006 1
24 . 1 1 2 2 LYS CB C 13 33.334 0.03 . 1 . 14 . . 2 LYS CB . 34006 1
25 . 1 1 2 2 LYS CG C 13 24.424 0.03 . 1 . 17 . . 2 LYS CG . 34006 1
26 . 1 1 2 2 LYS CD C 13 28.761 0.03 . 1 . 20 . . 2 LYS CD . 34006 1
27 . 1 1 2 2 LYS CE C 13 42.039 0.03 . 1 . 22 . . 2 LYS CE . 34006 1
28 . 1 1 2 2 LYS N N 15 123.484 0.03 . 1 . 10 . . 2 LYS N . 34006 1
29 . 1 1 3 3 PHE H H 1 8.051 0.01 . 1 . 25 . . 3 PHE H . 34006 1
30 . 1 1 3 3 PHE HA H 1 4.651 0.01 . 1 . 26 . . 3 PHE HA . 34006 1
31 . 1 1 3 3 PHE HB2 H 1 3.119 0.01 . 1 . 28 . . 3 PHE HB2 . 34006 1
32 . 1 1 3 3 PHE HB3 H 1 2.998 0.01 . 1 . 29 . . 3 PHE HB3 . 34006 1
33 . 1 1 3 3 PHE HD1 H 1 7.254 0.01 . 1 . 30 . . 3 PHE HD1 . 34006 1
34 . 1 1 3 3 PHE HD2 H 1 7.254 0.01 . 1 . 30 . . 3 PHE HD2 . 34006 1
35 . 1 1 3 3 PHE HE1 H 1 7.299 0.01 . 1 . 31 . . 3 PHE HE1 . 34006 1
36 . 1 1 3 3 PHE HE2 H 1 7.299 0.01 . 1 . 31 . . 3 PHE HE2 . 34006 1
37 . 1 1 3 3 PHE CB C 13 39.789 0.03 . 1 . 27 . . 3 PHE CB . 34006 1
38 . 1 1 3 3 PHE CD1 C 13 131.594 0.03 . 1 . 32 . . 3 PHE CD1 . 34006 1
39 . 1 1 3 3 PHE CD2 C 13 131.594 0.03 . 1 . 32 . . 3 PHE CD2 . 34006 1
40 . 1 1 3 3 PHE N N 15 119.628 0.03 . 1 . 24 . . 3 PHE N . 34006 1
41 . 1 1 4 4 LYS H H 1 8.001 0.01 . 1 . 34 . . 4 LYS H . 34006 1
42 . 1 1 4 4 LYS HA H 1 4.338 0.01 . 1 . 36 . . 4 LYS HA . 34006 1
43 . 1 1 4 4 LYS HB2 H 1 1.788 0.01 . 1 . 38 . . 4 LYS HB2 . 34006 1
44 . 1 1 4 4 LYS HB3 H 1 1.708 0.01 . 1 . 39 . . 4 LYS HB3 . 34006 1
45 . 1 1 4 4 LYS HG2 H 1 1.360 0.01 . 1 . 41 . . 4 LYS HG2 . 34006 1
46 . 1 1 4 4 LYS HG3 H 1 1.408 0.01 . 1 . 42 . . 4 LYS HG3 . 34006 1
47 . 1 1 4 4 LYS HD2 H 1 1.708 0.01 . 1 . 44 . . 4 LYS HD2 . 34006 1
48 . 1 1 4 4 LYS HD3 H 1 1.708 0.01 . 1 . 404 . . 4 LYS HD3 . 34006 1
49 . 1 1 4 4 LYS HE2 H 1 3.024 0.01 . 1 . 46 . . 4 LYS HE2 . 34006 1
50 . 1 1 4 4 LYS HE3 H 1 3.024 0.01 . 1 . 405 . . 4 LYS HE3 . 34006 1
51 . 1 1 4 4 LYS CA C 13 55.958 0.03 . 1 . 35 . . 4 LYS CA . 34006 1
52 . 1 1 4 4 LYS CB C 13 33.266 0.03 . 1 . 37 . . 4 LYS CB . 34006 1
53 . 1 1 4 4 LYS CG C 13 24.404 0.03 . 1 . 40 . . 4 LYS CG . 34006 1
54 . 1 1 4 4 LYS CD C 13 28.944 0.03 . 1 . 43 . . 4 LYS CD . 34006 1
55 . 1 1 4 4 LYS CE C 13 41.962 0.03 . 1 . 45 . . 4 LYS CE . 34006 1
56 . 1 1 4 4 LYS N N 15 122.270 0.03 . 1 . 33 . . 4 LYS N . 34006 1
57 . 1 1 5 5 PHE H H 1 7.880 0.01 . 1 . 48 . . 5 PHE H . 34006 1
58 . 1 1 5 5 PHE HA H 1 4.608 0.01 . 1 . 49 . . 5 PHE HA . 34006 1
59 . 1 1 5 5 PHE HB2 H 1 3.062 0.01 . 1 . 51 . . 5 PHE HB2 . 34006 1
60 . 1 1 5 5 PHE HB3 H 1 3.062 0.01 . 1 . 406 . . 5 PHE HB3 . 34006 1
61 . 1 1 5 5 PHE HD1 H 1 7.247 0.01 . 1 . 52 . . 5 PHE HD1 . 34006 1
62 . 1 1 5 5 PHE HD2 H 1 7.247 0.01 . 1 . 52 . . 5 PHE HD2 . 34006 1
63 . 1 1 5 5 PHE HE1 H 1 7.347 0.01 . 1 . 53 . . 5 PHE HE1 . 34006 1
64 . 1 1 5 5 PHE HE2 H 1 7.347 0.01 . 1 . 53 . . 5 PHE HE2 . 34006 1
65 . 1 1 5 5 PHE CB C 13 39.809 0.03 . 1 . 50 . . 5 PHE CB . 34006 1
66 . 1 1 5 5 PHE CD1 C 13 131.594 0.03 . 1 . 54 . . 5 PHE CD1 . 34006 1
67 . 1 1 5 5 PHE CD2 C 13 131.594 0.03 . 1 . 54 . . 5 PHE CD2 . 34006 1
68 . 1 1 5 5 PHE CE1 C 13 129.551 0.03 . 1 . 55 . . 5 PHE CE1 . 34006 1
69 . 1 1 5 5 PHE CE2 C 13 129.551 0.03 . 1 . 55 . . 5 PHE CE2 . 34006 1
70 . 1 1 5 5 PHE N N 15 120.790 0.03 . 1 . 47 . . 5 PHE N . 34006 1
71 . 1 1 6 6 ASN H H 1 8.099 0.01 . 1 . 57 . . 6 ASN H . 34006 1
72 . 1 1 6 6 ASN HA H 1 4.990 0.01 . 1 . 59 . . 6 ASN HA . 34006 1
73 . 1 1 6 6 ASN HB2 H 1 2.710 0.01 . 1 . 61 . . 6 ASN HB2 . 34006 1
74 . 1 1 6 6 ASN HB3 H 1 2.993 0.01 . 1 . 62 . . 6 ASN HB3 . 34006 1
75 . 1 1 6 6 ASN HD21 H 1 7.622 0.01 . 1 . 64 . . 6 ASN HD21 . 34006 1
76 . 1 1 6 6 ASN HD22 H 1 6.826 0.01 . 1 . 65 . . 6 ASN HD22 . 34006 1
77 . 1 1 6 6 ASN CA C 13 50.119 0.03 . 1 . 58 . . 6 ASN CA . 34006 1
78 . 1 1 6 6 ASN CB C 13 38.981 0.03 . 1 . 60 . . 6 ASN CB . 34006 1
79 . 1 1 6 6 ASN N N 15 121.225 0.03 . 1 . 56 . . 6 ASN N . 34006 1
80 . 1 1 6 6 ASN ND2 N 15 110.973 0.03 . 1 . 63 . . 6 ASN ND2 . 34006 1
81 . 1 1 7 7 PRO HA H 1 4.434 0.01 . 1 . 68 . . 7 PRO HA . 34006 1
82 . 1 1 7 7 PRO HB2 H 1 2.254 0.01 . 1 . 70 . . 7 PRO HB2 . 34006 1
83 . 1 1 7 7 PRO HB3 H 1 2.134 0.01 . 1 . 71 . . 7 PRO HB3 . 34006 1
84 . 1 1 7 7 PRO HG2 H 1 1.986 0.01 . 1 . 73 . . 7 PRO HG2 . 34006 1
85 . 1 1 7 7 PRO HG3 H 1 1.986 0.01 . 1 . 407 . . 7 PRO HG3 . 34006 1
86 . 1 1 7 7 PRO HD2 H 1 3.808 0.01 . 1 . 74 . . 7 PRO HD2 . 34006 1
87 . 1 1 7 7 PRO HD3 H 1 3.533 0.01 . 1 . 75 . . 7 PRO HD3 . 34006 1
88 . 1 1 7 7 PRO CA C 13 64.136 0.03 . 1 . 67 . . 7 PRO CA . 34006 1
89 . 1 1 7 7 PRO CB C 13 31.535 0.03 . 1 . 69 . . 7 PRO CB . 34006 1
90 . 1 1 7 7 PRO CG C 13 26.211 0.03 . 1 . 72 . . 7 PRO CG . 34006 1
91 . 1 1 7 7 PRO CD C 13 50.245 0.03 . 1 . 66 . . 7 PRO CD . 34006 1
92 . 1 1 8 8 THR H H 1 8.007 0.01 . 1 . 77 . . 8 THR H . 34006 1
93 . 1 1 8 8 THR HA H 1 3.961 0.01 . 1 . 79 . . 8 THR HA . 34006 1
94 . 1 1 8 8 THR HB H 1 4.151 0.01 . 1 . 81 . . 8 THR HB . 34006 1
95 . 1 1 8 8 THR HG21 H 1 1.259 0.01 . 1 . 82 . . 8 THR HG21 . 34006 1
96 . 1 1 8 8 THR HG22 H 1 1.259 0.01 . 1 . 82 . . 8 THR HG22 . 34006 1
97 . 1 1 8 8 THR HG23 H 1 1.259 0.01 . 1 . 82 . . 8 THR HG23 . 34006 1
98 . 1 1 8 8 THR CA C 13 65.938 0.03 . 1 . 78 . . 8 THR CA . 34006 1
99 . 1 1 8 8 THR CB C 13 68.834 0.03 . 1 . 80 . . 8 THR CB . 34006 1
100 . 1 1 8 8 THR CG2 C 13 20.945 0.03 . 1 . 83 . . 8 THR CG2 . 34006 1
101 . 1 1 8 8 THR N N 15 113.523 0.03 . 1 . 76 . . 8 THR N . 34006 1
102 . 1 1 9 9 GLY H H 1 8.211 0.01 . 1 . 85 . . 9 GLY H . 34006 1
103 . 1 1 9 9 GLY HA2 H 1 3.839 0.01 . 1 . 87 . . 9 GLY HA2 . 34006 1
104 . 1 1 9 9 GLY HA3 H 1 3.892 0.01 . 1 . 88 . . 9 GLY HA3 . 34006 1
105 . 1 1 9 9 GLY CA C 13 46.893 0.03 . 1 . 86 . . 9 GLY CA . 34006 1
106 . 1 1 9 9 GLY N N 15 107.141 0.03 . 1 . 84 . . 9 GLY N . 34006 1
107 . 1 1 10 10 THR H H 1 7.808 0.01 . 1 . 90 . . 10 THR H . 34006 1
108 . 1 1 10 10 THR HA H 1 4.049 0.01 . 1 . 92 . . 10 THR HA . 34006 1
109 . 1 1 10 10 THR HB H 1 4.339 0.01 . 1 . 94 . . 10 THR HB . 34006 1
110 . 1 1 10 10 THR HG21 H 1 1.340 0.01 . 1 . 95 . . 10 THR HG21 . 34006 1
111 . 1 1 10 10 THR HG22 H 1 1.340 0.01 . 1 . 95 . . 10 THR HG22 . 34006 1
112 . 1 1 10 10 THR HG23 H 1 1.340 0.01 . 1 . 95 . . 10 THR HG23 . 34006 1
113 . 1 1 10 10 THR CA C 13 66.134 0.03 . 1 . 91 . . 10 THR CA . 34006 1
114 . 1 1 10 10 THR CB C 13 68.930 0.03 . 1 . 93 . . 10 THR CB . 34006 1
115 . 1 1 10 10 THR CG2 C 13 21.188 0.03 . 1 . 96 . . 10 THR CG2 . 34006 1
116 . 1 1 10 10 THR N N 15 116.285 0.03 . 1 . 89 . . 10 THR N . 34006 1
117 . 1 1 11 11 ILE H H 1 7.844 0.01 . 1 . 98 . . 11 ILE H . 34006 1
118 . 1 1 11 11 ILE HA H 1 3.780 0.01 . 1 . 100 . . 11 ILE HA . 34006 1
119 . 1 1 11 11 ILE HB H 1 2.045 0.01 . 1 . 102 . . 11 ILE HB . 34006 1
120 . 1 1 11 11 ILE HG12 H 1 1.708 0.01 . 1 . 106 . . 11 ILE HG12 . 34006 1
121 . 1 1 11 11 ILE HG13 H 1 1.211 0.01 . 1 . 107 . . 11 ILE HG13 . 34006 1
122 . 1 1 11 11 ILE HG21 H 1 0.983 0.01 . 1 . 103 . . 11 ILE HG21 . 34006 1
123 . 1 1 11 11 ILE HG22 H 1 0.983 0.01 . 1 . 103 . . 11 ILE HG22 . 34006 1
124 . 1 1 11 11 ILE HG23 H 1 0.983 0.01 . 1 . 103 . . 11 ILE HG23 . 34006 1
125 . 1 1 11 11 ILE HD11 H 1 0.900 0.01 . 1 . 108 . . 11 ILE HD11 . 34006 1
126 . 1 1 11 11 ILE HD12 H 1 0.900 0.01 . 1 . 108 . . 11 ILE HD12 . 34006 1
127 . 1 1 11 11 ILE HD13 H 1 0.900 0.01 . 1 . 108 . . 11 ILE HD13 . 34006 1
128 . 1 1 11 11 ILE CA C 13 64.962 0.03 . 1 . 99 . . 11 ILE CA . 34006 1
129 . 1 1 11 11 ILE CB C 13 37.758 0.03 . 1 . 101 . . 11 ILE CB . 34006 1
130 . 1 1 11 11 ILE CG1 C 13 28.517 0.03 . 1 . 105 . . 11 ILE CG1 . 34006 1
131 . 1 1 11 11 ILE CG2 C 13 16.322 0.03 . 1 . 104 . . 11 ILE CG2 . 34006 1
132 . 1 1 11 11 ILE CD1 C 13 12.026 0.03 . 1 . 109 . . 11 ILE CD1 . 34006 1
133 . 1 1 11 11 ILE N N 15 122.329 0.03 . 1 . 97 . . 11 ILE N . 34006 1
134 . 1 1 12 12 VAL H H 1 8.164 0.01 . 1 . 111 . . 12 VAL H . 34006 1
135 . 1 1 12 12 VAL HA H 1 3.699 0.01 . 1 . 113 . . 12 VAL HA . 34006 1
136 . 1 1 12 12 VAL HB H 1 2.165 0.01 . 1 . 115 . . 12 VAL HB . 34006 1
137 . 1 1 12 12 VAL HG11 H 1 0.985 0.01 . 1 . 116 . . 12 VAL HG11 . 34006 1
138 . 1 1 12 12 VAL HG12 H 1 0.985 0.01 . 1 . 116 . . 12 VAL HG12 . 34006 1
139 . 1 1 12 12 VAL HG13 H 1 0.985 0.01 . 1 . 116 . . 12 VAL HG13 . 34006 1
140 . 1 1 12 12 VAL HG21 H 1 1.100 0.01 . 1 . 117 . . 12 VAL HG21 . 34006 1
141 . 1 1 12 12 VAL HG22 H 1 1.100 0.01 . 1 . 117 . . 12 VAL HG22 . 34006 1
142 . 1 1 12 12 VAL HG23 H 1 1.100 0.01 . 1 . 117 . . 12 VAL HG23 . 34006 1
143 . 1 1 12 12 VAL CA C 13 66.785 0.03 . 1 . 112 . . 12 VAL CA . 34006 1
144 . 1 1 12 12 VAL CB C 13 32.507 0.03 . 1 . 114 . . 12 VAL CB . 34006 1
145 . 1 1 12 12 VAL CG1 C 13 20.298 0.03 . 1 . 118 . . 12 VAL CG1 . 34006 1
146 . 1 1 12 12 VAL CG2 C 13 21.961 0.03 . 1 . 119 . . 12 VAL CG2 . 34006 1
147 . 1 1 12 12 VAL N N 15 118.503 0.03 . 1 . 110 . . 12 VAL N . 34006 1
148 . 1 1 13 13 LYS H H 1 8.034 0.01 . 1 . 121 . . 13 LYS H . 34006 1
149 . 1 1 13 13 LYS HA H 1 4.039 0.01 . 1 . 123 . . 13 LYS HA . 34006 1
150 . 1 1 13 13 LYS HB2 H 1 2.013 0.01 . 1 . 125 . . 13 LYS HB2 . 34006 1
151 . 1 1 13 13 LYS HB3 H 1 2.013 0.01 . 1 . 408 . . 13 LYS HB3 . 34006 1
152 . 1 1 13 13 LYS HG2 H 1 1.457 0.01 . 1 . 127 . . 13 LYS HG2 . 34006 1
153 . 1 1 13 13 LYS HG3 H 1 1.655 0.01 . 1 . 128 . . 13 LYS HG3 . 34006 1
154 . 1 1 13 13 LYS HD2 H 1 1.738 0.01 . 1 . 130 . . 13 LYS HD2 . 34006 1
155 . 1 1 13 13 LYS HD3 H 1 1.738 0.01 . 1 . 409 . . 13 LYS HD3 . 34006 1
156 . 1 1 13 13 LYS HE2 H 1 2.986 0.01 . 1 . 132 . . 13 LYS HE2 . 34006 1
157 . 1 1 13 13 LYS HE3 H 1 2.986 0.01 . 1 . 410 . . 13 LYS HE3 . 34006 1
158 . 1 1 13 13 LYS CA C 13 58.497 0.03 . 1 . 122 . . 13 LYS CA . 34006 1
159 . 1 1 13 13 LYS CB C 13 32.143 0.03 . 1 . 124 . . 13 LYS CB . 34006 1
160 . 1 1 13 13 LYS CG C 13 25.132 0.03 . 1 . 126 . . 13 LYS CG . 34006 1
161 . 1 1 13 13 LYS CD C 13 28.780 0.03 . 1 . 129 . . 13 LYS CD . 34006 1
162 . 1 1 13 13 LYS CE C 13 41.979 0.03 . 1 . 131 . . 13 LYS CE . 34006 1
163 . 1 1 13 13 LYS N N 15 121.835 0.03 . 1 . 120 . . 13 LYS N . 34006 1
164 . 1 1 14 14 LYS H H 1 8.049 0.01 . 1 . 134 . . 14 LYS H . 34006 1
165 . 1 1 14 14 LYS HA H 1 4.144 0.01 . 1 . 136 . . 14 LYS HA . 34006 1
166 . 1 1 14 14 LYS HB2 H 1 2.074 0.01 . 1 . 138 . . 14 LYS HB2 . 34006 1
167 . 1 1 14 14 LYS HB3 H 1 1.981 0.01 . 1 . 139 . . 14 LYS HB3 . 34006 1
168 . 1 1 14 14 LYS HG2 H 1 1.560 0.01 . 1 . 141 . . 14 LYS HG2 . 34006 1
169 . 1 1 14 14 LYS HG3 H 1 1.653 0.01 . 1 . 142 . . 14 LYS HG3 . 34006 1
170 . 1 1 14 14 LYS HD2 H 1 1.741 0.01 . 1 . 144 . . 14 LYS HD2 . 34006 1
171 . 1 1 14 14 LYS HD3 H 1 1.741 0.01 . 1 . 411 . . 14 LYS HD3 . 34006 1
172 . 1 1 14 14 LYS HE2 H 1 2.996 0.01 . 1 . 146 . . 14 LYS HE2 . 34006 1
173 . 1 1 14 14 LYS HE3 H 1 2.996 0.01 . 1 . 412 . . 14 LYS HE3 . 34006 1
174 . 1 1 14 14 LYS CA C 13 55.400 0.03 . 1 . 135 . . 14 LYS CA . 34006 1
175 . 1 1 14 14 LYS CB C 13 31.820 0.03 . 1 . 137 . . 14 LYS CB . 34006 1
176 . 1 1 14 14 LYS CG C 13 24.737 0.03 . 1 . 140 . . 14 LYS CG . 34006 1
177 . 1 1 14 14 LYS CD C 13 29.248 0.03 . 1 . 143 . . 14 LYS CD . 34006 1
178 . 1 1 14 14 LYS CE C 13 41.989 0.03 . 1 . 145 . . 14 LYS CE . 34006 1
179 . 1 1 14 14 LYS N N 15 120.586 0.03 . 1 . 133 . . 14 LYS N . 34006 1
180 . 1 1 15 15 LEU H H 1 8.824 0.01 . 1 . 148 . . 15 LEU H . 34006 1
181 . 1 1 15 15 LEU HA H 1 4.265 0.01 . 1 . 150 . . 15 LEU HA . 34006 1
182 . 1 1 15 15 LEU HB2 H 1 1.923 0.01 . 1 . 152 . . 15 LEU HB2 . 34006 1
183 . 1 1 15 15 LEU HB3 H 1 1.691 0.01 . 1 . 153 . . 15 LEU HB3 . 34006 1
184 . 1 1 15 15 LEU HG H 1 1.920 0.01 . 1 . 155 . . 15 LEU HG . 34006 1
185 . 1 1 15 15 LEU HD11 H 1 0.933 0.01 . 1 . 156 . . 15 LEU HD11 . 34006 1
186 . 1 1 15 15 LEU HD12 H 1 0.933 0.01 . 1 . 156 . . 15 LEU HD12 . 34006 1
187 . 1 1 15 15 LEU HD13 H 1 0.933 0.01 . 1 . 156 . . 15 LEU HD13 . 34006 1
188 . 1 1 15 15 LEU HD21 H 1 0.902 0.01 . 1 . 157 . . 15 LEU HD21 . 34006 1
189 . 1 1 15 15 LEU HD22 H 1 0.902 0.01 . 1 . 157 . . 15 LEU HD22 . 34006 1
190 . 1 1 15 15 LEU HD23 H 1 0.902 0.01 . 1 . 157 . . 15 LEU HD23 . 34006 1
191 . 1 1 15 15 LEU CA C 13 58.089 0.03 . 1 . 149 . . 15 LEU CA . 34006 1
192 . 1 1 15 15 LEU CB C 13 41.617 0.03 . 1 . 151 . . 15 LEU CB . 34006 1
193 . 1 1 15 15 LEU CG C 13 26.568 0.03 . 1 . 154 . . 15 LEU CG . 34006 1
194 . 1 1 15 15 LEU CD1 C 13 24.073 0.03 . 1 . 158 . . 15 LEU CD1 . 34006 1
195 . 1 1 15 15 LEU CD2 C 13 22.217 0.03 . 1 . 159 . . 15 LEU CD2 . 34006 1
196 . 1 1 15 15 LEU N N 15 119.632 0.03 . 1 . 147 . . 15 LEU N . 34006 1
197 . 1 1 16 16 THR H H 1 8.340 0.01 . 1 . 161 . . 16 THR H . 34006 1
198 . 1 1 16 16 THR HA H 1 4.060 0.01 . 1 . 163 . . 16 THR HA . 34006 1
199 . 1 1 16 16 THR HB H 1 4.433 0.01 . 1 . 165 . . 16 THR HB . 34006 1
200 . 1 1 16 16 THR HG21 H 1 1.356 0.01 . 1 . 166 . . 16 THR HG21 . 34006 1
201 . 1 1 16 16 THR HG22 H 1 1.356 0.01 . 1 . 166 . . 16 THR HG22 . 34006 1
202 . 1 1 16 16 THR HG23 H 1 1.356 0.01 . 1 . 166 . . 16 THR HG23 . 34006 1
203 . 1 1 16 16 THR CA C 13 67.225 0.03 . 1 . 162 . . 16 THR CA . 34006 1
204 . 1 1 16 16 THR CB C 13 68.738 0.03 . 1 . 164 . . 16 THR CB . 34006 1
205 . 1 1 16 16 THR CG2 C 13 20.303 0.03 . 1 . 167 . . 16 THR CG2 . 34006 1
206 . 1 1 16 16 THR N N 15 114.837 0.03 . 1 . 160 . . 16 THR N . 34006 1
207 . 1 1 17 17 GLN H H 1 8.140 0.01 . 1 . 169 . . 17 GLN H . 34006 1
208 . 1 1 17 17 GLN HA H 1 4.063 0.01 . 1 . 171 . . 17 GLN HA . 34006 1
209 . 1 1 17 17 GLN HB2 H 1 2.229 0.01 . 1 . 173 . . 17 GLN HB2 . 34006 1
210 . 1 1 17 17 GLN HB3 H 1 2.389 0.01 . 1 . 174 . . 17 GLN HB3 . 34006 1
211 . 1 1 17 17 GLN HG2 H 1 2.406 0.01 . 1 . 176 . . 17 GLN HG2 . 34006 1
212 . 1 1 17 17 GLN HG3 H 1 2.714 0.01 . 1 . 177 . . 17 GLN HG3 . 34006 1
213 . 1 1 17 17 GLN HE21 H 1 6.685 0.01 . 1 . 179 . . 17 GLN HE21 . 34006 1
214 . 1 1 17 17 GLN HE22 H 1 7.082 0.01 . 1 . 180 . . 17 GLN HE22 . 34006 1
215 . 1 1 17 17 GLN CA C 13 59.657 0.03 . 1 . 170 . . 17 GLN CA . 34006 1
216 . 1 1 17 17 GLN CB C 13 28.141 0.03 . 1 . 172 . . 17 GLN CB . 34006 1
217 . 1 1 17 17 GLN CG C 13 34.247 0.03 . 1 . 175 . . 17 GLN CG . 34006 1
218 . 1 1 17 17 GLN N N 15 119.628 0.03 . 1 . 168 . . 17 GLN N . 34006 1
219 . 1 1 17 17 GLN NE2 N 15 108.716 0.03 . 1 . 178 . . 17 GLN NE2 . 34006 1
220 . 1 1 18 18 TYR H H 1 8.224 0.01 . 1 . 182 . . 18 TYR H . 34006 1
221 . 1 1 18 18 TYR HA H 1 4.361 0.01 . 1 . 184 . . 18 TYR HA . 34006 1
222 . 1 1 18 18 TYR HB2 H 1 3.269 0.01 . 1 . 186 . . 18 TYR HB2 . 34006 1
223 . 1 1 18 18 TYR HB3 H 1 3.269 0.01 . 1 . 413 . . 18 TYR HB3 . 34006 1
224 . 1 1 18 18 TYR HD1 H 1 7.157 0.01 . 1 . 187 . . 18 TYR HD1 . 34006 1
225 . 1 1 18 18 TYR HD2 H 1 7.157 0.01 . 1 . 187 . . 18 TYR HD2 . 34006 1
226 . 1 1 18 18 TYR HE1 H 1 6.792 0.01 . 1 . 188 . . 18 TYR HE1 . 34006 1
227 . 1 1 18 18 TYR HE2 H 1 6.792 0.01 . 1 . 188 . . 18 TYR HE2 . 34006 1
228 . 1 1 18 18 TYR CA C 13 56.285 0.03 . 1 . 183 . . 18 TYR CA . 34006 1
229 . 1 1 18 18 TYR CB C 13 37.648 0.03 . 1 . 185 . . 18 TYR CB . 34006 1
230 . 1 1 18 18 TYR CD1 C 13 132.614 0.03 . 1 . 189 . . 18 TYR CD1 . 34006 1
231 . 1 1 18 18 TYR CD2 C 13 132.614 0.03 . 1 . 189 . . 18 TYR CD2 . 34006 1
232 . 1 1 18 18 TYR CE1 C 13 117.571 0.03 . 1 . 190 . . 18 TYR CE1 . 34006 1
233 . 1 1 18 18 TYR CE2 C 13 117.571 0.03 . 1 . 190 . . 18 TYR CE2 . 34006 1
234 . 1 1 18 18 TYR N N 15 119.657 0.03 . 1 . 181 . . 18 TYR N . 34006 1
235 . 1 1 19 19 GLU H H 1 8.595 0.01 . 1 . 192 . . 19 GLU H . 34006 1
236 . 1 1 19 19 GLU HA H 1 4.176 0.01 . 1 . 194 . . 19 GLU HA . 34006 1
237 . 1 1 19 19 GLU HB2 H 1 2.338 0.01 . 1 . 196 . . 19 GLU HB2 . 34006 1
238 . 1 1 19 19 GLU HB3 H 1 2.507 0.01 . 1 . 197 . . 19 GLU HB3 . 34006 1
239 . 1 1 19 19 GLU HG2 H 1 2.829 0.01 . 1 . 199 . . 19 GLU HG2 . 34006 1
240 . 1 1 19 19 GLU HG3 H 1 2.621 0.01 . 1 . 200 . . 19 GLU HG3 . 34006 1
241 . 1 1 19 19 GLU CA C 13 59.368 0.03 . 1 . 193 . . 19 GLU CA . 34006 1
242 . 1 1 19 19 GLU CB C 13 27.857 0.03 . 1 . 195 . . 19 GLU CB . 34006 1
243 . 1 1 19 19 GLU CG C 13 32.904 0.03 . 1 . 198 . . 19 GLU CG . 34006 1
244 . 1 1 19 19 GLU N N 15 118.769 0.03 . 1 . 191 . . 19 GLU N . 34006 1
245 . 1 1 20 20 ILE H H 1 8.520 0.01 . 1 . 202 . . 20 ILE H . 34006 1
246 . 1 1 20 20 ILE HA H 1 3.843 0.01 . 1 . 204 . . 20 ILE HA . 34006 1
247 . 1 1 20 20 ILE HB H 1 2.129 0.01 . 1 . 206 . . 20 ILE HB . 34006 1
248 . 1 1 20 20 ILE HG12 H 1 2.082 0.01 . 1 . 210 . . 20 ILE HG12 . 34006 1
249 . 1 1 20 20 ILE HG13 H 1 1.246 0.01 . 1 . 211 . . 20 ILE HG13 . 34006 1
250 . 1 1 20 20 ILE HG21 H 1 1.166 0.01 . 1 . 207 . . 20 ILE HG21 . 34006 1
251 . 1 1 20 20 ILE HG22 H 1 1.166 0.01 . 1 . 207 . . 20 ILE HG22 . 34006 1
252 . 1 1 20 20 ILE HG23 H 1 1.166 0.01 . 1 . 207 . . 20 ILE HG23 . 34006 1
253 . 1 1 20 20 ILE HD11 H 1 1.021 0.01 . 1 . 212 . . 20 ILE HD11 . 34006 1
254 . 1 1 20 20 ILE HD12 H 1 1.021 0.01 . 1 . 212 . . 20 ILE HD12 . 34006 1
255 . 1 1 20 20 ILE HD13 H 1 1.021 0.01 . 1 . 212 . . 20 ILE HD13 . 34006 1
256 . 1 1 20 20 ILE CA C 13 65.645 0.03 . 1 . 203 . . 20 ILE CA . 34006 1
257 . 1 1 20 20 ILE CB C 13 37.978 0.03 . 1 . 205 . . 20 ILE CB . 34006 1
258 . 1 1 20 20 ILE CG1 C 13 29.195 0.03 . 1 . 209 . . 20 ILE CG1 . 34006 1
259 . 1 1 20 20 ILE CG2 C 13 17.693 0.03 . 1 . 208 . . 20 ILE CG2 . 34006 1
260 . 1 1 20 20 ILE CD1 C 13 12.840 0.03 . 1 . 213 . . 20 ILE CD1 . 34006 1
261 . 1 1 20 20 ILE N N 15 119.831 0.03 . 1 . 201 . . 20 ILE N . 34006 1
262 . 1 1 21 21 ALA H H 1 8.232 0.01 . 1 . 215 . . 21 ALA H . 34006 1
263 . 1 1 21 21 ALA HA H 1 4.144 0.01 . 1 . 217 . . 21 ALA HA . 34006 1
264 . 1 1 21 21 ALA HB1 H 1 1.595 0.01 . 1 . 218 . . 21 ALA HB1 . 34006 1
265 . 1 1 21 21 ALA HB2 H 1 1.595 0.01 . 1 . 218 . . 21 ALA HB2 . 34006 1
266 . 1 1 21 21 ALA HB3 H 1 1.595 0.01 . 1 . 218 . . 21 ALA HB3 . 34006 1
267 . 1 1 21 21 ALA CA C 13 55.033 0.03 . 1 . 216 . . 21 ALA CA . 34006 1
268 . 1 1 21 21 ALA CB C 13 17.515 0.03 . 1 . 219 . . 21 ALA CB . 34006 1
269 . 1 1 21 21 ALA N N 15 122.532 0.03 . 1 . 214 . . 21 ALA N . 34006 1
270 . 1 1 22 22 TRP H H 1 8.877 0.01 . 1 . 221 . . 22 TRP H . 34006 1
271 . 1 1 22 22 TRP HA H 1 4.174 0.01 . 1 . 223 . . 22 TRP HA . 34006 1
272 . 1 1 22 22 TRP HB2 H 1 3.142 0.01 . 1 . 225 . . 22 TRP HB2 . 34006 1
273 . 1 1 22 22 TRP HB3 H 1 3.444 0.01 . 1 . 226 . . 22 TRP HB3 . 34006 1
274 . 1 1 22 22 TRP HD1 H 1 7.051 0.01 . 1 . 230 . . 22 TRP HD1 . 34006 1
275 . 1 1 22 22 TRP HE1 H 1 9.726 0.01 . 1 . 234 . . 22 TRP HE1 . 34006 1
276 . 1 1 22 22 TRP HE3 H 1 7.593 0.01 . 1 . 231 . . 22 TRP HE3 . 34006 1
277 . 1 1 22 22 TRP HZ2 H 1 7.445 0.01 . 1 . 237 . . 22 TRP HZ2 . 34006 1
278 . 1 1 22 22 TRP HZ3 H 1 7.147 0.01 . 1 . 235 . . 22 TRP HZ3 . 34006 1
279 . 1 1 22 22 TRP HH2 H 1 7.220 0.01 . 1 . 238 . . 22 TRP HH2 . 34006 1
280 . 1 1 22 22 TRP CA C 13 60.979 0.03 . 1 . 222 . . 22 TRP CA . 34006 1
281 . 1 1 22 22 TRP CB C 13 28.488 0.03 . 1 . 224 . . 22 TRP CB . 34006 1
282 . 1 1 22 22 TRP CD1 C 13 126.599 0.03 . 1 . 227 . . 22 TRP CD1 . 34006 1
283 . 1 1 22 22 TRP CE3 C 13 120.616 0.03 . 1 . 228 . . 22 TRP CE3 . 34006 1
284 . 1 1 22 22 TRP CZ2 C 13 114.096 0.03 . 1 . 233 . . 22 TRP CZ2 . 34006 1
285 . 1 1 22 22 TRP CZ3 C 13 121.315 0.03 . 1 . 232 . . 22 TRP CZ3 . 34006 1
286 . 1 1 22 22 TRP CH2 C 13 123.994 0.03 . 1 . 236 . . 22 TRP CH2 . 34006 1
287 . 1 1 22 22 TRP N N 15 120.488 0.03 . 1 . 220 . . 22 TRP N . 34006 1
288 . 1 1 22 22 TRP NE1 N 15 127.061 0.03 . 1 . 229 . . 22 TRP NE1 . 34006 1
289 . 1 1 23 23 PHE H H 1 8.780 0.01 . 1 . 239 . . 23 PHE H . 34006 1
290 . 1 1 23 23 PHE HA H 1 3.926 0.01 . 1 . 240 . . 23 PHE HA . 34006 1
291 . 1 1 23 23 PHE HB2 H 1 3.459 0.01 . 1 . 242 . . 23 PHE HB2 . 34006 1
292 . 1 1 23 23 PHE HB3 H 1 3.425 0.01 . 1 . 243 . . 23 PHE HB3 . 34006 1
293 . 1 1 23 23 PHE HD1 H 1 7.360 0.01 . 1 . 244 . . 23 PHE HD1 . 34006 1
294 . 1 1 23 23 PHE HD2 H 1 7.360 0.01 . 1 . 244 . . 23 PHE HD2 . 34006 1
295 . 1 1 23 23 PHE HE1 H 1 7.070 0.01 . 1 . 245 . . 23 PHE HE1 . 34006 1
296 . 1 1 23 23 PHE HE2 H 1 7.070 0.01 . 1 . 245 . . 23 PHE HE2 . 34006 1
297 . 1 1 23 23 PHE CB C 13 39.138 0.03 . 1 . 241 . . 23 PHE CB . 34006 1
298 . 1 1 23 23 PHE CD1 C 13 131.023 0.03 . 1 . 246 . . 23 PHE CD1 . 34006 1
299 . 1 1 23 23 PHE CD2 C 13 131.023 0.03 . 1 . 246 . . 23 PHE CD2 . 34006 1
300 . 1 1 23 23 PHE CE1 C 13 131.233 0.03 . 1 . 247 . . 23 PHE CE1 . 34006 1
301 . 1 1 23 23 PHE CE2 C 13 131.233 0.03 . 1 . 247 . . 23 PHE CE2 . 34006 1
302 . 1 1 24 24 LYS H H 1 8.787 0.01 . 1 . 248 . . 24 LYS H . 34006 1
303 . 1 1 24 24 LYS HA H 1 4.036 0.01 . 1 . 250 . . 24 LYS HA . 34006 1
304 . 1 1 24 24 LYS HB2 H 1 1.930 0.01 . 1 . 252 . . 24 LYS HB2 . 34006 1
305 . 1 1 24 24 LYS HB3 H 1 1.930 0.01 . 1 . 414 . . 24 LYS HB3 . 34006 1
306 . 1 1 24 24 LYS HG2 H 1 1.180 0.01 . 1 . 254 . . 24 LYS HG2 . 34006 1
307 . 1 1 24 24 LYS HG3 H 1 1.180 0.01 . 1 . 416 . . 24 LYS HG3 . 34006 1
308 . 1 1 24 24 LYS HD2 H 1 0.925 0.01 . 1 . 256 . . 24 LYS HD2 . 34006 1
309 . 1 1 24 24 LYS HD3 H 1 1.204 0.01 . 1 . 257 . . 24 LYS HD3 . 34006 1
310 . 1 1 24 24 LYS HE2 H 1 2.751 0.01 . 1 . 259 . . 24 LYS HE2 . 34006 1
311 . 1 1 24 24 LYS HE3 H 1 2.751 0.01 . 1 . 415 . . 24 LYS HE3 . 34006 1
312 . 1 1 24 24 LYS CA C 13 60.331 0.03 . 1 . 249 . . 24 LYS CA . 34006 1
313 . 1 1 24 24 LYS CB C 13 31.580 0.03 . 1 . 251 . . 24 LYS CB . 34006 1
314 . 1 1 24 24 LYS CG C 13 24.577 0.03 . 1 . 253 . . 24 LYS CG . 34006 1
315 . 1 1 24 24 LYS CD C 13 28.383 0.03 . 1 . 255 . . 24 LYS CD . 34006 1
316 . 1 1 24 24 LYS CE C 13 42.131 0.03 . 1 . 258 . . 24 LYS CE . 34006 1
317 . 1 1 25 25 ASN H H 1 8.307 0.01 . 1 . 261 . . 25 ASN H . 34006 1
318 . 1 1 25 25 ASN HA H 1 4.390 0.01 . 1 . 263 . . 25 ASN HA . 34006 1
319 . 1 1 25 25 ASN HB2 H 1 2.802 0.01 . 1 . 265 . . 25 ASN HB2 . 34006 1
320 . 1 1 25 25 ASN HB3 H 1 2.661 0.01 . 1 . 266 . . 25 ASN HB3 . 34006 1
321 . 1 1 25 25 ASN HD21 H 1 7.153 0.01 . 1 . 268 . . 25 ASN HD21 . 34006 1
322 . 1 1 25 25 ASN HD22 H 1 6.614 0.01 . 1 . 269 . . 25 ASN HD22 . 34006 1
323 . 1 1 25 25 ASN CA C 13 55.642 0.03 . 1 . 262 . . 25 ASN CA . 34006 1
324 . 1 1 25 25 ASN CB C 13 38.694 0.03 . 1 . 264 . . 25 ASN CB . 34006 1
325 . 1 1 25 25 ASN N N 15 118.351 0.03 . 1 . 260 . . 25 ASN N . 34006 1
326 . 1 1 25 25 ASN ND2 N 15 110.390 0.03 . 1 . 267 . . 25 ASN ND2 . 34006 1
327 . 1 1 26 26 LYS H H 1 7.825 0.01 . 1 . 271 . . 26 LYS H . 34006 1
328 . 1 1 26 26 LYS HA H 1 3.961 0.01 . 1 . 273 . . 26 LYS HA . 34006 1
329 . 1 1 26 26 LYS HB2 H 1 1.222 0.01 . 1 . 275 . . 26 LYS HB2 . 34006 1
330 . 1 1 26 26 LYS HB3 H 1 1.239 0.01 . 1 . 276 . . 26 LYS HB3 . 34006 1
331 . 1 1 26 26 LYS HG2 H 1 0.882 0.01 . 1 . 278 . . 26 LYS HG2 . 34006 1
332 . 1 1 26 26 LYS HG3 H 1 0.750 0.01 . 1 . 279 . . 26 LYS HG3 . 34006 1
333 . 1 1 26 26 LYS HD2 H 1 1.316 0.01 . 1 . 281 . . 26 LYS HD2 . 34006 1
334 . 1 1 26 26 LYS HD3 H 1 1.316 0.01 . 1 . 417 . . 26 LYS HD3 . 34006 1
335 . 1 1 26 26 LYS HE2 H 1 2.644 0.01 . 1 . 283 . . 26 LYS HE2 . 34006 1
336 . 1 1 26 26 LYS HE3 H 1 2.731 0.01 . 1 . 284 . . 26 LYS HE3 . 34006 1
337 . 1 1 26 26 LYS CA C 13 56.275 0.03 . 1 . 272 . . 26 LYS CA . 34006 1
338 . 1 1 26 26 LYS CB C 13 31.875 0.03 . 1 . 274 . . 26 LYS CB . 34006 1
339 . 1 1 26 26 LYS CG C 13 23.431 0.03 . 1 . 277 . . 26 LYS CG . 34006 1
340 . 1 1 26 26 LYS CD C 13 27.745 0.03 . 1 . 280 . . 26 LYS CD . 34006 1
341 . 1 1 26 26 LYS CE C 13 41.890 0.03 . 1 . 282 . . 26 LYS CE . 34006 1
342 . 1 1 26 26 LYS N N 15 116.666 0.03 . 1 . 270 . . 26 LYS N . 34006 1
343 . 1 1 27 27 HIS H H 1 7.972 0.01 . 1 . 286 . . 27 HIS H . 34006 1
344 . 1 1 27 27 HIS HA H 1 4.448 0.01 . 1 . 288 . . 27 HIS HA . 34006 1
345 . 1 1 27 27 HIS HB2 H 1 2.767 0.01 . 1 . 290 . . 27 HIS HB2 . 34006 1
346 . 1 1 27 27 HIS HB3 H 1 2.465 0.01 . 1 . 291 . . 27 HIS HB3 . 34006 1
347 . 1 1 27 27 HIS HD2 H 1 6.482 0.01 . 1 . 294 . . 27 HIS HD2 . 34006 1
348 . 1 1 27 27 HIS HE1 H 1 8.127 0.01 . 1 . 295 . . 27 HIS HE1 . 34006 1
349 . 1 1 27 27 HIS CA C 13 55.538 0.03 . 1 . 287 . . 27 HIS CA . 34006 1
350 . 1 1 27 27 HIS CB C 13 28.592 0.03 . 1 . 289 . . 27 HIS CB . 34006 1
351 . 1 1 27 27 HIS CD2 C 13 119.698 0.03 . 1 . 292 . . 27 HIS CD2 . 34006 1
352 . 1 1 27 27 HIS CE1 C 13 135.109 0.03 . 1 . 293 . . 27 HIS CE1 . 34006 1
353 . 1 1 27 27 HIS N N 15 121.283 0.03 . 1 . 285 . . 27 HIS N . 34006 1
354 . 1 1 28 28 GLY H H 1 8.194 0.01 . 1 . 297 . . 28 GLY H . 34006 1
355 . 1 1 28 28 GLY HA2 H 1 3.712 0.01 . 1 . 299 . . 28 GLY HA2 . 34006 1
356 . 1 1 28 28 GLY HA3 H 1 4.093 0.01 . 1 . 300 . . 28 GLY HA3 . 34006 1
357 . 1 1 28 28 GLY CA C 13 44.810 0.03 . 1 . 298 . . 28 GLY CA . 34006 1
358 . 1 1 28 28 GLY N N 15 107.141 0.03 . 1 . 296 . . 28 GLY N . 34006 1
359 . 1 1 29 29 TYR H H 1 7.136 0.01 . 1 . 301 . . 29 TYR H . 34006 1
360 . 1 1 29 29 TYR HA H 1 4.567 0.01 . 1 . 303 . . 29 TYR HA . 34006 1
361 . 1 1 29 29 TYR HB2 H 1 2.966 0.01 . 1 . 305 . . 29 TYR HB2 . 34006 1
362 . 1 1 29 29 TYR HB3 H 1 2.847 0.01 . 1 . 306 . . 29 TYR HB3 . 34006 1
363 . 1 1 29 29 TYR HD1 H 1 7.010 0.01 . 1 . 307 . . 29 TYR HD1 . 34006 1
364 . 1 1 29 29 TYR HD2 H 1 7.010 0.01 . 1 . 307 . . 29 TYR HD2 . 34006 1
365 . 1 1 29 29 TYR HE1 H 1 6.793 0.01 . 1 . 308 . . 29 TYR HE1 . 34006 1
366 . 1 1 29 29 TYR HE2 H 1 6.793 0.01 . 1 . 308 . . 29 TYR HE2 . 34006 1
367 . 1 1 29 29 TYR CA C 13 55.614 0.03 . 1 . 302 . . 29 TYR CA . 34006 1
368 . 1 1 29 29 TYR CB C 13 39.469 0.03 . 1 . 304 . . 29 TYR CB . 34006 1
369 . 1 1 29 29 TYR CD1 C 13 133.817 0.03 . 1 . 309 . . 29 TYR CD1 . 34006 1
370 . 1 1 29 29 TYR CD2 C 13 133.817 0.03 . 1 . 309 . . 29 TYR CD2 . 34006 1
371 . 1 1 29 29 TYR CE1 C 13 117.535 0.03 . 1 . 310 . . 29 TYR CE1 . 34006 1
372 . 1 1 29 29 TYR CE2 C 13 117.535 0.03 . 1 . 310 . . 29 TYR CE2 . 34006 1
373 . 1 1 30 30 TYR H H 1 8.092 0.01 . 1 . 312 . . 30 TYR H . 34006 1
374 . 1 1 30 30 TYR HA H 1 4.363 0.01 . 1 . 314 . . 30 TYR HA . 34006 1
375 . 1 1 30 30 TYR HB2 H 1 3.429 0.01 . 1 . 316 . . 30 TYR HB2 . 34006 1
376 . 1 1 30 30 TYR HB3 H 1 3.429 0.01 . 1 . 418 . . 30 TYR HB3 . 34006 1
377 . 1 1 30 30 TYR HD1 H 1 6.941 0.01 . 1 . 317 . . 30 TYR HD1 . 34006 1
378 . 1 1 30 30 TYR HD2 H 1 6.941 0.01 . 1 . 317 . . 30 TYR HD2 . 34006 1
379 . 1 1 30 30 TYR HE1 H 1 6.872 0.01 . 1 . 318 . . 30 TYR HE1 . 34006 1
380 . 1 1 30 30 TYR HE2 H 1 6.872 0.01 . 1 . 318 . . 30 TYR HE2 . 34006 1
381 . 1 1 30 30 TYR CA C 13 61.203 0.03 . 1 . 313 . . 30 TYR CA . 34006 1
382 . 1 1 30 30 TYR CB C 13 39.146 0.03 . 1 . 315 . . 30 TYR CB . 34006 1
383 . 1 1 30 30 TYR CD1 C 13 132.825 0.03 . 1 . 319 . . 30 TYR CD1 . 34006 1
384 . 1 1 30 30 TYR CD2 C 13 132.825 0.03 . 1 . 319 . . 30 TYR CD2 . 34006 1
385 . 1 1 30 30 TYR CE1 C 13 117.775 0.03 . 1 . 320 . . 30 TYR CE1 . 34006 1
386 . 1 1 30 30 TYR CE2 C 13 117.775 0.03 . 1 . 320 . . 30 TYR CE2 . 34006 1
387 . 1 1 30 30 TYR N N 15 121.254 0.03 . 1 . 311 . . 30 TYR N . 34006 1
388 . 1 1 31 31 PRO HA H 1 3.909 0.01 . 1 . 323 . . 31 PRO HA . 34006 1
389 . 1 1 31 31 PRO HB2 H 1 1.836 0.01 . 1 . 325 . . 31 PRO HB2 . 34006 1
390 . 1 1 31 31 PRO HB3 H 1 1.749 0.01 . 1 . 326 . . 31 PRO HB3 . 34006 1
391 . 1 1 31 31 PRO HG2 H 1 1.508 0.01 . 1 . 328 . . 31 PRO HG2 . 34006 1
392 . 1 1 31 31 PRO HG3 H 1 1.953 0.01 . 1 . 329 . . 31 PRO HG3 . 34006 1
393 . 1 1 31 31 PRO HD2 H 1 3.241 0.01 . 1 . 330 . . 31 PRO HD2 . 34006 1
394 . 1 1 31 31 PRO HD3 H 1 3.457 0.01 . 1 . 331 . . 31 PRO HD3 . 34006 1
395 . 1 1 31 31 PRO CA C 13 65.148 0.03 . 1 . 322 . . 31 PRO CA . 34006 1
396 . 1 1 31 31 PRO CB C 13 30.883 0.03 . 1 . 324 . . 31 PRO CB . 34006 1
397 . 1 1 31 31 PRO CG C 13 26.675 0.03 . 1 . 327 . . 31 PRO CG . 34006 1
398 . 1 1 31 31 PRO CD C 13 49.628 0.03 . 1 . 321 . . 31 PRO CD . 34006 1
399 . 1 1 32 32 TRP H H 1 6.354 0.01 . 1 . 332 . . 32 TRP H . 34006 1
400 . 1 1 32 32 TRP HA H 1 4.757 0.01 . 1 . 333 . . 32 TRP HA . 34006 1
401 . 1 1 32 32 TRP HB2 H 1 3.222 0.01 . 1 . 335 . . 32 TRP HB2 . 34006 1
402 . 1 1 32 32 TRP HB3 H 1 3.541 0.01 . 1 . 336 . . 32 TRP HB3 . 34006 1
403 . 1 1 32 32 TRP HD1 H 1 7.133 0.01 . 1 . 340 . . 32 TRP HD1 . 34006 1
404 . 1 1 32 32 TRP HE1 H 1 10.022 0.01 . 1 . 344 . . 32 TRP HE1 . 34006 1
405 . 1 1 32 32 TRP HE3 H 1 7.544 0.01 . 1 . 341 . . 32 TRP HE3 . 34006 1
406 . 1 1 32 32 TRP HZ2 H 1 6.903 0.01 . 1 . 347 . . 32 TRP HZ2 . 34006 1
407 . 1 1 32 32 TRP HZ3 H 1 7.143 0.01 . 1 . 345 . . 32 TRP HZ3 . 34006 1
408 . 1 1 32 32 TRP HH2 H 1 6.965 0.01 . 1 . 348 . . 32 TRP HH2 . 34006 1
409 . 1 1 32 32 TRP CB C 13 26.825 0.03 . 1 . 334 . . 32 TRP CB . 34006 1
410 . 1 1 32 32 TRP CD1 C 13 126.806 0.03 . 1 . 337 . . 32 TRP CD1 . 34006 1
411 . 1 1 32 32 TRP CE3 C 13 118.891 0.03 . 1 . 338 . . 32 TRP CE3 . 34006 1
412 . 1 1 32 32 TRP CZ2 C 13 115.169 0.03 . 1 . 343 . . 32 TRP CZ2 . 34006 1
413 . 1 1 32 32 TRP CZ3 C 13 121.970 0.03 . 1 . 342 . . 32 TRP CZ3 . 34006 1
414 . 1 1 32 32 TRP CH2 C 13 124.677 0.03 . 1 . 346 . . 32 TRP CH2 . 34006 1
415 . 1 1 32 32 TRP NE1 N 15 130.226 0.03 . 1 . 339 . . 32 TRP NE1 . 34006 1
416 . 1 1 33 33 GLU H H 1 7.663 0.01 . 1 . 350 . . 33 GLU H . 34006 1
417 . 1 1 33 33 GLU HA H 1 4.447 0.01 . 1 . 352 . . 33 GLU HA . 34006 1
418 . 1 1 33 33 GLU HB2 H 1 2.204 0.01 . 1 . 354 . . 33 GLU HB2 . 34006 1
419 . 1 1 33 33 GLU HB3 H 1 2.187 0.01 . 1 . 355 . . 33 GLU HB3 . 34006 1
420 . 1 1 33 33 GLU HG2 H 1 2.062 0.01 . 1 . 357 . . 33 GLU HG2 . 34006 1
421 . 1 1 33 33 GLU HG3 H 1 2.395 0.01 . 1 . 358 . . 33 GLU HG3 . 34006 1
422 . 1 1 33 33 GLU CA C 13 56.203 0.03 . 1 . 351 . . 33 GLU CA . 34006 1
423 . 1 1 33 33 GLU CB C 13 29.852 0.03 . 1 . 353 . . 33 GLU CB . 34006 1
424 . 1 1 33 33 GLU CG C 13 35.178 0.03 . 1 . 356 . . 33 GLU CG . 34006 1
425 . 1 1 33 33 GLU N N 15 120.682 0.03 . 1 . 349 . . 33 GLU N . 34006 1
426 . 1 1 34 34 ILE H H 1 7.372 0.01 . 1 . 360 . . 34 ILE H . 34006 1
427 . 1 1 34 34 ILE HA H 1 4.284 0.01 . 1 . 362 . . 34 ILE HA . 34006 1
428 . 1 1 34 34 ILE HB H 1 1.867 0.01 . 1 . 364 . . 34 ILE HB . 34006 1
429 . 1 1 34 34 ILE HG12 H 1 1.575 0.01 . 1 . 368 . . 34 ILE HG12 . 34006 1
430 . 1 1 34 34 ILE HG13 H 1 1.189 0.01 . 1 . 369 . . 34 ILE HG13 . 34006 1
431 . 1 1 34 34 ILE HG21 H 1 0.959 0.01 . 1 . 365 . . 34 ILE HG21 . 34006 1
432 . 1 1 34 34 ILE HG22 H 1 0.959 0.01 . 1 . 365 . . 34 ILE HG22 . 34006 1
433 . 1 1 34 34 ILE HG23 H 1 0.959 0.01 . 1 . 365 . . 34 ILE HG23 . 34006 1
434 . 1 1 34 34 ILE HD11 H 1 0.891 0.01 . 1 . 370 . . 34 ILE HD11 . 34006 1
435 . 1 1 34 34 ILE HD12 H 1 0.891 0.01 . 1 . 370 . . 34 ILE HD12 . 34006 1
436 . 1 1 34 34 ILE HD13 H 1 0.891 0.01 . 1 . 370 . . 34 ILE HD13 . 34006 1
437 . 1 1 34 34 ILE CA C 13 58.705 0.03 . 1 . 361 . . 34 ILE CA . 34006 1
438 . 1 1 34 34 ILE CB C 13 38.639 0.03 . 1 . 363 . . 34 ILE CB . 34006 1
439 . 1 1 34 34 ILE CG1 C 13 27.087 0.03 . 1 . 367 . . 34 ILE CG1 . 34006 1
440 . 1 1 34 34 ILE CG2 C 13 16.314 0.03 . 1 . 366 . . 34 ILE CG2 . 34006 1
441 . 1 1 34 34 ILE CD1 C 13 12.077 0.03 . 1 . 371 . . 34 ILE CD1 . 34006 1
442 . 1 1 34 34 ILE N N 15 120.216 0.03 . 1 . 359 . . 34 ILE N . 34006 1
443 . 1 1 35 35 PRO HA H 1 4.257 0.01 . 1 . 374 . . 35 PRO HA . 34006 1
444 . 1 1 35 35 PRO HB2 H 1 1.941 0.01 . 1 . 376 . . 35 PRO HB2 . 34006 1
445 . 1 1 35 35 PRO HB3 H 1 2.170 0.01 . 1 . 377 . . 35 PRO HB3 . 34006 1
446 . 1 1 35 35 PRO HG2 H 1 2.011 0.01 . 1 . 379 . . 35 PRO HG2 . 34006 1
447 . 1 1 35 35 PRO HG3 H 1 1.863 0.01 . 1 . 380 . . 35 PRO HG3 . 34006 1
448 . 1 1 35 35 PRO HD2 H 1 3.718 0.01 . 1 . 381 . . 35 PRO HD2 . 34006 1
449 . 1 1 35 35 PRO HD3 H 1 3.545 0.01 . 1 . 382 . . 35 PRO HD3 . 34006 1
450 . 1 1 35 35 PRO CA C 13 63.107 0.03 . 1 . 373 . . 35 PRO CA . 34006 1
451 . 1 1 35 35 PRO CB C 13 31.547 0.03 . 1 . 375 . . 35 PRO CB . 34006 1
452 . 1 1 35 35 PRO CG C 13 26.958 0.03 . 1 . 378 . . 35 PRO CG . 34006 1
453 . 1 1 35 35 PRO CD C 13 50.437 0.03 . 1 . 372 . . 35 PRO CD . 34006 1
454 . 1 1 36 36 ARG H H 1 7.935 0.01 . 1 . 384 . . 36 ARG H . 34006 1
455 . 1 1 36 36 ARG HA H 1 4.448 0.01 . 1 . 385 . . 36 ARG HA . 34006 1
456 . 1 1 36 36 ARG HB2 H 1 1.939 0.01 . 1 . 387 . . 36 ARG HB2 . 34006 1
457 . 1 1 36 36 ARG HB3 H 1 1.819 0.01 . 1 . 388 . . 36 ARG HB3 . 34006 1
458 . 1 1 36 36 ARG HG2 H 1 1.724 0.01 . 1 . 390 . . 36 ARG HG2 . 34006 1
459 . 1 1 36 36 ARG HG3 H 1 1.724 0.01 . 1 . 420 . . 36 ARG HG3 . 34006 1
460 . 1 1 36 36 ARG HD2 H 1 3.247 0.01 . 1 . 392 . . 36 ARG HD2 . 34006 1
461 . 1 1 36 36 ARG HD3 H 1 3.247 0.01 . 1 . 419 . . 36 ARG HD3 . 34006 1
462 . 1 1 36 36 ARG HE H 1 7.203 0.01 . 1 . 394 . . 36 ARG HE . 34006 1
463 . 1 1 36 36 ARG CB C 13 30.911 0.03 . 1 . 386 . . 36 ARG CB . 34006 1
464 . 1 1 36 36 ARG CG C 13 26.739 0.03 . 1 . 389 . . 36 ARG CG . 34006 1
465 . 1 1 36 36 ARG CD C 13 43.095 0.03 . 1 . 391 . . 36 ARG CD . 34006 1
466 . 1 1 36 36 ARG N N 15 120.035 0.03 . 1 . 383 . . 36 ARG N . 34006 1
467 . 1 1 36 36 ARG NE N 15 120.439 0.03 . 1 . 393 . . 36 ARG NE . 34006 1
468 . 1 1 37 37 CYS H H 1 7.919 0.01 . 1 . 396 . . 37 CYS H . 34006 1
469 . 1 1 37 37 CYS HA H 1 4.530 0.01 . 1 . 398 . . 37 CYS HA . 34006 1
470 . 1 1 37 37 CYS HB2 H 1 2.996 0.01 . 1 . 400 . . 37 CYS HB2 . 34006 1
471 . 1 1 37 37 CYS HB3 H 1 2.996 0.01 . 1 . 421 . . 37 CYS HB3 . 34006 1
472 . 1 1 37 37 CYS CA C 13 58.179 0.03 . 1 . 397 . . 37 CYS CA . 34006 1
473 . 1 1 37 37 CYS CB C 13 28.383 0.03 . 1 . 399 . . 37 CYS CB . 34006 1
474 . 1 1 37 37 CYS N N 15 120.819 0.03 . 1 . 395 . . 37 CYS N . 34006 1
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