###################################
# 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 25964
_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 'Origin nmrStar file /ebi/msd/pdb_root/Processing/prepare/5fsf/ebi/bmrb_iapp_hi18_151217_1_2.str.csh'
_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-15N HSQC' 1 $sample_1 solution 25964 1
2 HNCA 1 $sample_1 solution 25964 1
3 HNHA 1 $sample_1 solution 25964 1
4 HNCACB 1 $sample_1 solution 25964 1
5 '1H-15N NOESY' 1 $sample_1 solution 25964 1
6 HNCO 1 $sample_1 solution 25964 1
7 'HCCH COSY' 1 $sample_1 solution 25964 1
8 '1H-13C NOESY' 1 $sample_1 solution 25964 1
9 '1H-15N HSQC' 1 $sample_2 solution 25964 1
10 HNCA 1 $sample_2 solution 25964 1
11 HNHA 1 $sample_2 solution 25964 1
12 HNCACB 1 $sample_2 solution 25964 1
13 '1H-15N NOESY' 1 $sample_2 solution 25964 1
14 'HCCH COSY' 1 $sample_2 solution 25964 1
15 '1H-13C NOESY' 1 $sample_2 solution 25964 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 $CcpNmr_Analysis . . 25964 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 CYS HA H 1 4.709 0.002 . 1 . . . . 2 CYS HA . 25964 1
2 . 1 1 2 2 CYS HB2 H 1 3.170 0.05 . 2 . . . . 2 CYS HB2 . 25964 1
3 . 1 1 2 2 CYS HB3 H 1 3.227 0.05 . 2 . . . . 2 CYS HB3 . 25964 1
4 . 1 1 2 2 CYS C C 13 174.129 0.05 . 1 . . . . 2 CYS C . 25964 1
5 . 1 1 2 2 CYS CA C 13 55.969 0.039 . 1 . . . . 2 CYS CA . 25964 1
6 . 1 1 2 2 CYS CB C 13 41.520 0.002 . 1 . . . . 2 CYS CB . 25964 1
7 . 1 1 3 3 ASN H H 1 8.880 0.002 . 1 . . . . 3 ASN H . 25964 1
8 . 1 1 3 3 ASN HA H 1 4.934 0.003 . 1 . . . . 3 ASN HA . 25964 1
9 . 1 1 3 3 ASN HB2 H 1 2.865 0.05 . 1 . . . . 3 ASN HB2 . 25964 1
10 . 1 1 3 3 ASN C C 13 174.942 0.05 . 1 . . . . 3 ASN C . 25964 1
11 . 1 1 3 3 ASN CA C 13 53.115 0.066 . 1 . . . . 3 ASN CA . 25964 1
12 . 1 1 3 3 ASN CB C 13 39.537 0.05 . 1 . . . . 3 ASN CB . 25964 1
13 . 1 1 3 3 ASN N N 15 123.794 0.02 . 1 . . . . 3 ASN N . 25964 1
14 . 1 1 4 4 THR H H 1 7.639 0.006 . 1 . . . . 4 THR H . 25964 1
15 . 1 1 4 4 THR HA H 1 4.516 0.004 . 1 . . . . 4 THR HA . 25964 1
16 . 1 1 4 4 THR HB H 1 4.492 0.001 . 1 . . . . 4 THR HB . 25964 1
17 . 1 1 4 4 THR HG21 H 1 1.242 0.002 . 1 . . . . 4 THR HG21 . 25964 1
18 . 1 1 4 4 THR HG22 H 1 1.242 0.002 . 1 . . . . 4 THR HG22 . 25964 1
19 . 1 1 4 4 THR HG23 H 1 1.242 0.002 . 1 . . . . 4 THR HG23 . 25964 1
20 . 1 1 4 4 THR C C 13 174.640 0.05 . 1 . . . . 4 THR C . 25964 1
21 . 1 1 4 4 THR CA C 13 61.022 0.008 . 1 . . . . 4 THR CA . 25964 1
22 . 1 1 4 4 THR CB C 13 70.811 0.002 . 1 . . . . 4 THR CB . 25964 1
23 . 1 1 4 4 THR N N 15 110.990 0.056 . 1 . . . . 4 THR N . 25964 1
24 . 1 1 5 5 ALA H H 1 8.569 0.004 . 1 . . . . 5 ALA H . 25964 1
25 . 1 1 5 5 ALA HA H 1 4.170 0.006 . 1 . . . . 5 ALA HA . 25964 1
26 . 1 1 5 5 ALA HB1 H 1 1.462 0.005 . 1 . . . . 5 ALA HB1 . 25964 1
27 . 1 1 5 5 ALA HB2 H 1 1.462 0.005 . 1 . . . . 5 ALA HB2 . 25964 1
28 . 1 1 5 5 ALA HB3 H 1 1.462 0.005 . 1 . . . . 5 ALA HB3 . 25964 1
29 . 1 1 5 5 ALA C C 13 179.253 0.05 . 1 . . . . 5 ALA C . 25964 1
30 . 1 1 5 5 ALA CA C 13 54.665 0.077 . 1 . . . . 5 ALA CA . 25964 1
31 . 1 1 5 5 ALA CB C 13 18.760 0.05 . 1 . . . . 5 ALA CB . 25964 1
32 . 1 1 5 5 ALA N N 15 122.436 0.023 . 1 . . . . 5 ALA N . 25964 1
33 . 1 1 6 6 THR H H 1 7.835 0.003 . 1 . . . . 6 THR H . 25964 1
34 . 1 1 6 6 THR HA H 1 4.315 0.004 . 1 . . . . 6 THR HA . 25964 1
35 . 1 1 6 6 THR HB H 1 4.227 0.001 . 1 . . . . 6 THR HB . 25964 1
36 . 1 1 6 6 THR HG21 H 1 1.179 0.004 . 1 . . . . 6 THR HG21 . 25964 1
37 . 1 1 6 6 THR HG22 H 1 1.179 0.004 . 1 . . . . 6 THR HG22 . 25964 1
38 . 1 1 6 6 THR HG23 H 1 1.179 0.004 . 1 . . . . 6 THR HG23 . 25964 1
39 . 1 1 6 6 THR C C 13 174.926 0.05 . 1 . . . . 6 THR C . 25964 1
40 . 1 1 6 6 THR CA C 13 62.135 0.019 . 1 . . . . 6 THR CA . 25964 1
41 . 1 1 6 6 THR CB C 13 69.462 0.002 . 1 . . . . 6 THR CB . 25964 1
42 . 1 1 6 6 THR N N 15 108.349 0.054 . 1 . . . . 6 THR N . 25964 1
43 . 1 1 7 7 CYS H H 1 8.081 0.003 . 1 . . . . 7 CYS H . 25964 1
44 . 1 1 7 7 CYS HA H 1 4.628 0.009 . 1 . . . . 7 CYS HA . 25964 1
45 . 1 1 7 7 CYS HB2 H 1 3.235 0.004 . 2 . . . . 7 CYS HB2 . 25964 1
46 . 1 1 7 7 CYS HB3 H 1 3.109 0.002 . 2 . . . . 7 CYS HB3 . 25964 1
47 . 1 1 7 7 CYS C C 13 174.476 0.05 . 1 . . . . 7 CYS C . 25964 1
48 . 1 1 7 7 CYS CA C 13 55.928 0.016 . 1 . . . . 7 CYS CA . 25964 1
49 . 1 1 7 7 CYS CB C 13 41.479 0.002 . 1 . . . . 7 CYS CB . 25964 1
50 . 1 1 7 7 CYS N N 15 120.255 0.039 . 1 . . . . 7 CYS N . 25964 1
51 . 1 1 8 8 ALA H H 1 8.146 0.003 . 1 . . . . 8 ALA H . 25964 1
52 . 1 1 8 8 ALA HA H 1 4.345 0.006 . 1 . . . . 8 ALA HA . 25964 1
53 . 1 1 8 8 ALA HB1 H 1 1.410 0.002 . 1 . . . . 8 ALA HB1 . 25964 1
54 . 1 1 8 8 ALA HB2 H 1 1.410 0.002 . 1 . . . . 8 ALA HB2 . 25964 1
55 . 1 1 8 8 ALA HB3 H 1 1.410 0.002 . 1 . . . . 8 ALA HB3 . 25964 1
56 . 1 1 8 8 ALA C C 13 177.769 0.05 . 1 . . . . 8 ALA C . 25964 1
57 . 1 1 8 8 ALA CA C 13 52.986 0.026 . 1 . . . . 8 ALA CA . 25964 1
58 . 1 1 8 8 ALA CB C 13 19.209 0.05 . 1 . . . . 8 ALA CB . 25964 1
59 . 1 1 8 8 ALA N N 15 124.453 0.054 . 1 . . . . 8 ALA N . 25964 1
60 . 1 1 9 9 THR H H 1 8.023 0.002 . 1 . . . . 9 THR H . 25964 1
61 . 1 1 9 9 THR HA H 1 4.347 0.016 . 1 . . . . 9 THR HA . 25964 1
62 . 1 1 9 9 THR HB H 1 4.215 0.009 . 1 . . . . 9 THR HB . 25964 1
63 . 1 1 9 9 THR HG21 H 1 1.182 0.001 . 1 . . . . 9 THR HG21 . 25964 1
64 . 1 1 9 9 THR HG22 H 1 1.182 0.001 . 1 . . . . 9 THR HG22 . 25964 1
65 . 1 1 9 9 THR HG23 H 1 1.182 0.001 . 1 . . . . 9 THR HG23 . 25964 1
66 . 1 1 9 9 THR C C 13 174.368 0.05 . 1 . . . . 9 THR C . 25964 1
67 . 1 1 9 9 THR CA C 13 61.814 0.034 . 1 . . . . 9 THR CA . 25964 1
68 . 1 1 9 9 THR CB C 13 69.691 0.002 . 1 . . . . 9 THR CB . 25964 1
69 . 1 1 9 9 THR N N 15 112.557 0.062 . 1 . . . . 9 THR N . 25964 1
70 . 1 1 10 10 GLN H H 1 8.227 0.004 . 1 . . . . 10 GLN H . 25964 1
71 . 1 1 10 10 GLN HA H 1 4.395 0.017 . 1 . . . . 10 GLN HA . 25964 1
72 . 1 1 10 10 GLN HB2 H 1 2.055 0.001 . 2 . . . . 10 GLN HB2 . 25964 1
73 . 1 1 10 10 GLN HB3 H 1 1.972 0.02 . 2 . . . . 10 GLN HB3 . 25964 1
74 . 1 1 10 10 GLN HG2 H 1 2.318 0.002 . 1 . . . . 10 GLN HG2 . 25964 1
75 . 1 1 10 10 GLN C C 13 175.216 0.05 . 1 . . . . 10 GLN C . 25964 1
76 . 1 1 10 10 GLN CA C 13 55.636 0.039 . 1 . . . . 10 GLN CA . 25964 1
77 . 1 1 10 10 GLN CB C 13 29.981 0.001 . 1 . . . . 10 GLN CB . 25964 1
78 . 1 1 10 10 GLN N N 15 122.711 0.029 . 1 . . . . 10 GLN N . 25964 1
79 . 1 1 11 11 ARG H H 1 8.319 0.004 . 1 . . . . 11 ARG H . 25964 1
80 . 1 1 11 11 ARG HA H 1 4.518 0.001 . 1 . . . . 11 ARG HA . 25964 1
81 . 1 1 11 11 ARG HB2 H 1 1.689 0.006 . 1 . . . . 11 ARG HB2 . 25964 1
82 . 1 1 11 11 ARG HG2 H 1 1.518 0.001 . 2 . . . . 11 ARG HG2 . 25964 1
83 . 1 1 11 11 ARG HG3 H 1 1.637 0.001 . 2 . . . . 11 ARG HG3 . 25964 1
84 . 1 1 11 11 ARG C C 13 174.945 0.05 . 1 . . . . 11 ARG C . 25964 1
85 . 1 1 11 11 ARG CA C 13 55.512 0.039 . 1 . . . . 11 ARG CA . 25964 1
86 . 1 1 11 11 ARG CB C 13 31.790 0.001 . 1 . . . . 11 ARG CB . 25964 1
87 . 1 1 11 11 ARG N N 15 121.930 0.046 . 1 . . . . 11 ARG N . 25964 1
88 . 1 1 12 12 LEU H H 1 8.382 0.005 . 1 . . . . 12 LEU H . 25964 1
89 . 1 1 12 12 LEU HA H 1 4.533 0.006 . 1 . . . . 12 LEU HA . 25964 1
90 . 1 1 12 12 LEU CA C 13 54.228 0.092 . 1 . . . . 12 LEU CA . 25964 1
91 . 1 1 12 12 LEU CB C 13 44.054 0.05 . 1 . . . . 12 LEU CB . 25964 1
92 . 1 1 12 12 LEU N N 15 123.187 0.061 . 1 . . . . 12 LEU N . 25964 1
93 . 1 1 13 13 ALA H H 1 8.053 0.002 . 1 . . . . 13 ALA H . 25964 1
94 . 1 1 13 13 ALA HA H 1 4.896 0.008 . 1 . . . . 13 ALA HA . 25964 1
95 . 1 1 13 13 ALA HB1 H 1 1.046 0.004 . 1 . . . . 13 ALA HB1 . 25964 1
96 . 1 1 13 13 ALA HB2 H 1 1.046 0.004 . 1 . . . . 13 ALA HB2 . 25964 1
97 . 1 1 13 13 ALA HB3 H 1 1.046 0.004 . 1 . . . . 13 ALA HB3 . 25964 1
98 . 1 1 13 13 ALA CA C 13 50.977 0.029 . 1 . . . . 13 ALA CA . 25964 1
99 . 1 1 13 13 ALA CB C 13 20.005 0.046 . 1 . . . . 13 ALA CB . 25964 1
100 . 1 1 14 14 ASN H H 1 8.472 0.01 . 1 . . . . 14 ASN H . 25964 1
101 . 1 1 14 14 ASN HA H 1 4.813 0.001 . 1 . . . . 14 ASN HA . 25964 1
102 . 1 1 14 14 ASN HB2 H 1 2.589 0.007 . 1 . . . . 14 ASN HB2 . 25964 1
103 . 1 1 14 14 ASN C C 13 173.534 0.05 . 1 . . . . 14 ASN C . 25964 1
104 . 1 1 14 14 ASN CA C 13 51.951 0.066 . 1 . . . . 14 ASN CA . 25964 1
105 . 1 1 14 14 ASN CB C 13 41.338 0.05 . 1 . . . . 14 ASN CB . 25964 1
106 . 1 1 14 14 ASN N N 15 118.928 0.021 . 1 . . . . 14 ASN N . 25964 1
107 . 1 1 15 15 PHE H H 1 8.843 0.006 . 1 . . . . 15 PHE H . 25964 1
108 . 1 1 15 15 PHE HA H 1 5.090 0.007 . 1 . . . . 15 PHE HA . 25964 1
109 . 1 1 15 15 PHE C C 13 173.825 0.05 . 1 . . . . 15 PHE C . 25964 1
110 . 1 1 15 15 PHE CA C 13 57.900 0.022 . 1 . . . . 15 PHE CA . 25964 1
111 . 1 1 15 15 PHE CB C 13 41.556 0.05 . 1 . . . . 15 PHE CB . 25964 1
112 . 1 1 15 15 PHE N N 15 121.077 0.047 . 1 . . . . 15 PHE N . 25964 1
113 . 1 1 16 16 LEU H H 1 8.343 0.005 . 1 . . . . 16 LEU H . 25964 1
114 . 1 1 16 16 LEU HA H 1 5.168 0.05 . 1 . . . . 16 LEU HA . 25964 1
115 . 1 1 16 16 LEU HB2 H 1 0.970 0.008 . 2 . . . . 16 LEU HB2 . 25964 1
116 . 1 1 16 16 LEU HB3 H 1 1.398 0.007 . 2 . . . . 16 LEU HB3 . 25964 1
117 . 1 1 16 16 LEU HG H 1 1.203 0.004 . 1 . . . . 16 LEU HG . 25964 1
118 . 1 1 16 16 LEU HD11 H 1 0.504 0.004 . 2 . . . . 16 LEU HD11 . 25964 1
119 . 1 1 16 16 LEU HD12 H 1 0.504 0.004 . 2 . . . . 16 LEU HD12 . 25964 1
120 . 1 1 16 16 LEU HD13 H 1 0.504 0.004 . 2 . . . . 16 LEU HD13 . 25964 1
121 . 1 1 16 16 LEU HD21 H 1 0.492 0.014 . 2 . . . . 16 LEU HD21 . 25964 1
122 . 1 1 16 16 LEU HD22 H 1 0.492 0.014 . 2 . . . . 16 LEU HD22 . 25964 1
123 . 1 1 16 16 LEU HD23 H 1 0.492 0.014 . 2 . . . . 16 LEU HD23 . 25964 1
124 . 1 1 16 16 LEU C C 13 173.404 0.05 . 1 . . . . 16 LEU C . 25964 1
125 . 1 1 16 16 LEU CA C 13 53.488 0.03 . 1 . . . . 16 LEU CA . 25964 1
126 . 1 1 16 16 LEU CB C 13 44.557 0.066 . 1 . . . . 16 LEU CB . 25964 1
127 . 1 1 16 16 LEU CG C 13 25.369 0.042 . 1 . . . . 16 LEU CG . 25964 1
128 . 1 1 16 16 LEU CD1 C 13 27.759 0.03 . 2 . . . . 16 LEU CD1 . 25964 1
129 . 1 1 16 16 LEU CD2 C 13 24.309 0.045 . 2 . . . . 16 LEU CD2 . 25964 1
130 . 1 1 16 16 LEU N N 15 119.612 0.044 . 1 . . . . 16 LEU N . 25964 1
131 . 1 1 17 17 VAL H H 1 8.581 0.005 . 1 . . . . 17 VAL H . 25964 1
132 . 1 1 17 17 VAL HA H 1 4.585 0.018 . 1 . . . . 17 VAL HA . 25964 1
133 . 1 1 17 17 VAL HB H 1 1.783 0.007 . 1 . . . . 17 VAL HB . 25964 1
134 . 1 1 17 17 VAL HG11 H 1 0.781 0.007 . 2 . . . . 17 VAL HG11 . 25964 1
135 . 1 1 17 17 VAL HG12 H 1 0.781 0.007 . 2 . . . . 17 VAL HG12 . 25964 1
136 . 1 1 17 17 VAL HG13 H 1 0.781 0.007 . 2 . . . . 17 VAL HG13 . 25964 1
137 . 1 1 17 17 VAL HG21 H 1 0.859 0.01 . 2 . . . . 17 VAL HG21 . 25964 1
138 . 1 1 17 17 VAL HG22 H 1 0.859 0.01 . 2 . . . . 17 VAL HG22 . 25964 1
139 . 1 1 17 17 VAL HG23 H 1 0.859 0.01 . 2 . . . . 17 VAL HG23 . 25964 1
140 . 1 1 17 17 VAL C C 13 173.816 0.05 . 1 . . . . 17 VAL C . 25964 1
141 . 1 1 17 17 VAL CA C 13 60.234 0.054 . 1 . . . . 17 VAL CA . 25964 1
142 . 1 1 17 17 VAL CB C 13 35.181 0.072 . 1 . . . . 17 VAL CB . 25964 1
143 . 1 1 17 17 VAL CG1 C 13 21.476 0.013 . 2 . . . . 17 VAL CG1 . 25964 1
144 . 1 1 17 17 VAL CG2 C 13 21.191 0.01 . 2 . . . . 17 VAL CG2 . 25964 1
145 . 1 1 17 17 VAL N N 15 116.731 0.074 . 1 . . . . 17 VAL N . 25964 1
146 . 1 1 18 18 HIS H H 1 8.920 0.005 . 1 . . . . 18 HIS H . 25964 1
147 . 1 1 18 18 HIS HA H 1 5.192 0.007 . 1 . . . . 18 HIS HA . 25964 1
148 . 1 1 18 18 HIS HD2 H 1 6.878 0.05 . 1 . . . . 18 HIS HD2 . 25964 1
149 . 1 1 18 18 HIS C C 13 176.232 0.05 . 1 . . . . 18 HIS C . 25964 1
150 . 1 1 18 18 HIS CA C 13 55.050 0.013 . 1 . . . . 18 HIS CA . 25964 1
151 . 1 1 18 18 HIS CB C 13 29.626 0.05 . 1 . . . . 18 HIS CB . 25964 1
152 . 1 1 18 18 HIS N N 15 128.309 0.066 . 1 . . . . 18 HIS N . 25964 1
153 . 1 1 19 19 SER H H 1 8.361 0.006 . 1 . . . . 19 SER H . 25964 1
154 . 1 1 19 19 SER CA C 13 60.284 0.075 . 1 . . . . 19 SER CA . 25964 1
155 . 1 1 19 19 SER N N 15 122.007 0.021 . 1 . . . . 19 SER N . 25964 1
156 . 1 1 20 20 SER C C 13 174.715 0.05 . 1 . . . . 20 SER C . 25964 1
157 . 1 1 21 21 ASN H H 1 8.254 0.01 . 1 . . . . 21 ASN H . 25964 1
158 . 1 1 21 21 ASN C C 13 173.629 0.05 . 1 . . . . 21 ASN C . 25964 1
159 . 1 1 21 21 ASN CA C 13 53.115 0.005 . 1 . . . . 21 ASN CA . 25964 1
160 . 1 1 21 21 ASN CB C 13 38.633 0.05 . 1 . . . . 21 ASN CB . 25964 1
161 . 1 1 21 21 ASN N N 15 118.657 0.066 . 1 . . . . 21 ASN N . 25964 1
162 . 1 1 22 22 ASN H H 1 7.650 0.003 . 1 . . . . 22 ASN H . 25964 1
163 . 1 1 22 22 ASN C C 13 173.705 0.05 . 1 . . . . 22 ASN C . 25964 1
164 . 1 1 22 22 ASN CA C 13 53.065 0.071 . 1 . . . . 22 ASN CA . 25964 1
165 . 1 1 22 22 ASN CB C 13 39.489 0.05 . 1 . . . . 22 ASN CB . 25964 1
166 . 1 1 22 22 ASN N N 15 116.776 0.046 . 1 . . . . 22 ASN N . 25964 1
167 . 1 1 23 23 PHE H H 1 8.805 0.006 . 1 . . . . 23 PHE H . 25964 1
168 . 1 1 23 23 PHE HA H 1 5.102 0.004 . 1 . . . . 23 PHE HA . 25964 1
169 . 1 1 23 23 PHE HB2 H 1 3.091 0.006 . 1 . . . . 23 PHE HB2 . 25964 1
170 . 1 1 23 23 PHE C C 13 175.312 0.05 . 1 . . . . 23 PHE C . 25964 1
171 . 1 1 23 23 PHE CA C 13 58.038 0.04 . 1 . . . . 23 PHE CA . 25964 1
172 . 1 1 23 23 PHE N N 15 123.741 0.106 . 1 . . . . 23 PHE N . 25964 1
173 . 1 1 24 24 GLY H H 1 8.430 0.005 . 1 . . . . 24 GLY H . 25964 1
174 . 1 1 24 24 GLY HA2 H 1 4.466 0.012 . 2 . . . . 24 GLY HA2 . 25964 1
175 . 1 1 24 24 GLY HA3 H 1 3.453 0.006 . 2 . . . . 24 GLY HA3 . 25964 1
176 . 1 1 24 24 GLY C C 13 169.704 0.05 . 1 . . . . 24 GLY C . 25964 1
177 . 1 1 24 24 GLY CA C 13 45.561 0.036 . 1 . . . . 24 GLY CA . 25964 1
178 . 1 1 24 24 GLY N N 15 111.100 0.065 . 1 . . . . 24 GLY N . 25964 1
179 . 1 1 25 25 ALA H H 1 8.492 0.006 . 1 . . . . 25 ALA H . 25964 1
180 . 1 1 25 25 ALA HA H 1 5.179 0.009 . 1 . . . . 25 ALA HA . 25964 1
181 . 1 1 25 25 ALA HB1 H 1 1.124 0.007 . 1 . . . . 25 ALA HB1 . 25964 1
182 . 1 1 25 25 ALA HB2 H 1 1.124 0.007 . 1 . . . . 25 ALA HB2 . 25964 1
183 . 1 1 25 25 ALA HB3 H 1 1.124 0.007 . 1 . . . . 25 ALA HB3 . 25964 1
184 . 1 1 25 25 ALA C C 13 174.375 0.05 . 1 . . . . 25 ALA C . 25964 1
185 . 1 1 25 25 ALA CA C 13 50.060 0.031 . 1 . . . . 25 ALA CA . 25964 1
186 . 1 1 25 25 ALA CB C 13 23.248 0.067 . 1 . . . . 25 ALA CB . 25964 1
187 . 1 1 25 25 ALA N N 15 119.110 0.061 . 1 . . . . 25 ALA N . 25964 1
188 . 1 1 26 26 ILE H H 1 8.487 0.005 . 1 . . . . 26 ILE H . 25964 1
189 . 1 1 26 26 ILE HA H 1 4.710 0.003 . 1 . . . . 26 ILE HA . 25964 1
190 . 1 1 26 26 ILE HB H 1 1.452 0.006 . 1 . . . . 26 ILE HB . 25964 1
191 . 1 1 26 26 ILE HG12 H 1 1.286 0.004 . 2 . . . . 26 ILE HG12 . 25964 1
192 . 1 1 26 26 ILE HG13 H 1 0.827 0.004 . 2 . . . . 26 ILE HG13 . 25964 1
193 . 1 1 26 26 ILE HG21 H 1 0.831 0.004 . 1 . . . . 26 ILE HG21 . 25964 1
194 . 1 1 26 26 ILE HG22 H 1 0.831 0.004 . 1 . . . . 26 ILE HG22 . 25964 1
195 . 1 1 26 26 ILE HG23 H 1 0.831 0.004 . 1 . . . . 26 ILE HG23 . 25964 1
196 . 1 1 26 26 ILE HD11 H 1 0.690 0.003 . 1 . . . . 26 ILE HD11 . 25964 1
197 . 1 1 26 26 ILE HD12 H 1 0.690 0.003 . 1 . . . . 26 ILE HD12 . 25964 1
198 . 1 1 26 26 ILE HD13 H 1 0.690 0.003 . 1 . . . . 26 ILE HD13 . 25964 1
199 . 1 1 26 26 ILE C C 13 174.300 0.05 . 1 . . . . 26 ILE C . 25964 1
200 . 1 1 26 26 ILE CA C 13 58.741 0.047 . 1 . . . . 26 ILE CA . 25964 1
201 . 1 1 26 26 ILE CB C 13 41.822 0.055 . 1 . . . . 26 ILE CB . 25964 1
202 . 1 1 26 26 ILE CG1 C 13 28.328 0.036 . 1 . . . . 26 ILE CG1 . 25964 1
203 . 1 1 26 26 ILE CG2 C 13 16.270 0.024 . 1 . . . . 26 ILE CG2 . 25964 1
204 . 1 1 26 26 ILE CD1 C 13 14.305 0.036 . 1 . . . . 26 ILE CD1 . 25964 1
205 . 1 1 26 26 ILE N N 15 117.222 0.05 . 1 . . . . 26 ILE N . 25964 1
206 . 1 1 27 27 LEU H H 1 8.723 0.006 . 1 . . . . 27 LEU H . 25964 1
207 . 1 1 27 27 LEU HA H 1 4.905 0.006 . 1 . . . . 27 LEU HA . 25964 1
208 . 1 1 27 27 LEU HB2 H 1 1.541 0.007 . 2 . . . . 27 LEU HB2 . 25964 1
209 . 1 1 27 27 LEU HB3 H 1 1.423 0.01 . 2 . . . . 27 LEU HB3 . 25964 1
210 . 1 1 27 27 LEU HG H 1 1.505 0.007 . 1 . . . . 27 LEU HG . 25964 1
211 . 1 1 27 27 LEU HD11 H 1 0.794 0.007 . 2 . . . . 27 LEU HD11 . 25964 1
212 . 1 1 27 27 LEU HD12 H 1 0.794 0.007 . 2 . . . . 27 LEU HD12 . 25964 1
213 . 1 1 27 27 LEU HD13 H 1 0.794 0.007 . 2 . . . . 27 LEU HD13 . 25964 1
214 . 1 1 27 27 LEU HD21 H 1 0.678 0.004 . 2 . . . . 27 LEU HD21 . 25964 1
215 . 1 1 27 27 LEU HD22 H 1 0.678 0.004 . 2 . . . . 27 LEU HD22 . 25964 1
216 . 1 1 27 27 LEU HD23 H 1 0.678 0.004 . 2 . . . . 27 LEU HD23 . 25964 1
217 . 1 1 27 27 LEU C C 13 176.596 0.05 . 1 . . . . 27 LEU C . 25964 1
218 . 1 1 27 27 LEU CA C 13 53.453 0.074 . 1 . . . . 27 LEU CA . 25964 1
219 . 1 1 27 27 LEU CB C 13 42.607 0.02 . 1 . . . . 27 LEU CB . 25964 1
220 . 1 1 27 27 LEU CG C 13 26.758 0.049 . 1 . . . . 27 LEU CG . 25964 1
221 . 1 1 27 27 LEU CD1 C 13 24.994 0.015 . 2 . . . . 27 LEU CD1 . 25964 1
222 . 1 1 27 27 LEU CD2 C 13 24.004 0.045 . 2 . . . . 27 LEU CD2 . 25964 1
223 . 1 1 27 27 LEU N N 15 128.200 0.064 . 1 . . . . 27 LEU N . 25964 1
224 . 1 1 28 28 SER H H 1 8.798 0.007 . 1 . . . . 28 SER H . 25964 1
225 . 1 1 28 28 SER HA H 1 4.582 0.007 . 1 . . . . 28 SER HA . 25964 1
226 . 1 1 28 28 SER HB2 H 1 3.833 0.05 . 2 . . . . 28 SER HB2 . 25964 1
227 . 1 1 28 28 SER HB3 H 1 3.775 0.05 . 2 . . . . 28 SER HB3 . 25964 1
228 . 1 1 28 28 SER C C 13 173.941 0.05 . 1 . . . . 28 SER C . 25964 1
229 . 1 1 28 28 SER CA C 13 57.796 0.073 . 1 . . . . 28 SER CA . 25964 1
230 . 1 1 28 28 SER CB C 13 64.727 0.05 . 1 . . . . 28 SER CB . 25964 1
231 . 1 1 28 28 SER N N 15 119.325 0.047 . 1 . . . . 28 SER N . 25964 1
232 . 1 1 29 29 SER H H 1 8.611 0.004 . 1 . . . . 29 SER H . 25964 1
233 . 1 1 29 29 SER HA H 1 4.711 0.01 . 1 . . . . 29 SER HA . 25964 1
234 . 1 1 29 29 SER HB2 H 1 3.869 0.003 . 2 . . . . 29 SER HB2 . 25964 1
235 . 1 1 29 29 SER HB3 H 1 3.806 0.001 . 2 . . . . 29 SER HB3 . 25964 1
236 . 1 1 29 29 SER C C 13 174.618 0.05 . 1 . . . . 29 SER C . 25964 1
237 . 1 1 29 29 SER CA C 13 58.078 0.005 . 1 . . . . 29 SER CA . 25964 1
238 . 1 1 29 29 SER CB C 13 64.109 0.05 . 1 . . . . 29 SER CB . 25964 1
239 . 1 1 29 29 SER N N 15 117.790 0.066 . 1 . . . . 29 SER N . 25964 1
240 . 1 1 30 30 THR H H 1 8.294 0.003 . 1 . . . . 30 THR H . 25964 1
241 . 1 1 30 30 THR HA H 1 4.362 0.005 . 1 . . . . 30 THR HA . 25964 1
242 . 1 1 30 30 THR HB H 1 4.178 0.003 . 1 . . . . 30 THR HB . 25964 1
243 . 1 1 30 30 THR HG21 H 1 1.131 0.001 . 1 . . . . 30 THR HG21 . 25964 1
244 . 1 1 30 30 THR HG22 H 1 1.131 0.001 . 1 . . . . 30 THR HG22 . 25964 1
245 . 1 1 30 30 THR HG23 H 1 1.131 0.001 . 1 . . . . 30 THR HG23 . 25964 1
246 . 1 1 30 30 THR C C 13 173.983 0.05 . 1 . . . . 30 THR C . 25964 1
247 . 1 1 30 30 THR CA C 13 61.617 0.019 . 1 . . . . 30 THR CA . 25964 1
248 . 1 1 30 30 THR CB C 13 69.751 0.011 . 1 . . . . 30 THR CB . 25964 1
249 . 1 1 30 30 THR N N 15 115.709 0.054 . 1 . . . . 30 THR N . 25964 1
250 . 1 1 31 31 ASN H H 1 8.484 0.003 . 1 . . . . 31 ASN H . 25964 1
251 . 1 1 31 31 ASN HA H 1 4.763 0.011 . 1 . . . . 31 ASN HA . 25964 1
252 . 1 1 31 31 ASN HB2 H 1 2.795 0.002 . 2 . . . . 31 ASN HB2 . 25964 1
253 . 1 1 31 31 ASN HB3 H 1 2.697 0.002 . 2 . . . . 31 ASN HB3 . 25964 1
254 . 1 1 31 31 ASN C C 13 175.148 0.05 . 1 . . . . 31 ASN C . 25964 1
255 . 1 1 31 31 ASN CA C 13 53.140 0.025 . 1 . . . . 31 ASN CA . 25964 1
256 . 1 1 31 31 ASN CB C 13 38.815 0.05 . 1 . . . . 31 ASN CB . 25964 1
257 . 1 1 31 31 ASN N N 15 121.204 0.034 . 1 . . . . 31 ASN N . 25964 1
258 . 1 1 32 32 VAL H H 1 8.112 0.003 . 1 . . . . 32 VAL H . 25964 1
259 . 1 1 32 32 VAL HA H 1 4.091 0.006 . 1 . . . . 32 VAL HA . 25964 1
260 . 1 1 32 32 VAL HB H 1 2.057 0.001 . 1 . . . . 32 VAL HB . 25964 1
261 . 1 1 32 32 VAL HG11 H 1 0.869 0.001 . 1 . . . . 32 VAL HG11 . 25964 1
262 . 1 1 32 32 VAL HG12 H 1 0.869 0.001 . 1 . . . . 32 VAL HG12 . 25964 1
263 . 1 1 32 32 VAL HG13 H 1 0.869 0.001 . 1 . . . . 32 VAL HG13 . 25964 1
264 . 1 1 32 32 VAL C C 13 176.537 0.05 . 1 . . . . 32 VAL C . 25964 1
265 . 1 1 32 32 VAL CA C 13 62.460 0.02 . 1 . . . . 32 VAL CA . 25964 1
266 . 1 1 32 32 VAL CB C 13 32.530 0.05 . 1 . . . . 32 VAL CB . 25964 1
267 . 1 1 32 32 VAL N N 15 120.215 0.063 . 1 . . . . 32 VAL N . 25964 1
268 . 1 1 33 33 GLY H H 1 8.434 0.004 . 1 . . . . 33 GLY H . 25964 1
269 . 1 1 33 33 GLY HA2 H 1 3.946 0.002 . 1 . . . . 33 GLY HA2 . 25964 1
270 . 1 1 33 33 GLY C C 13 174.092 0.05 . 1 . . . . 33 GLY C . 25964 1
271 . 1 1 33 33 GLY CA C 13 45.173 0.039 . 1 . . . . 33 GLY CA . 25964 1
272 . 1 1 33 33 GLY N N 15 112.079 0.055 . 1 . . . . 33 GLY N . 25964 1
273 . 1 1 34 34 SER H H 1 8.149 0.003 . 1 . . . . 34 SER H . 25964 1
274 . 1 1 34 34 SER HA H 1 4.432 0.007 . 1 . . . . 34 SER HA . 25964 1
275 . 1 1 34 34 SER HB2 H 1 3.833 0.005 . 1 . . . . 34 SER HB2 . 25964 1
276 . 1 1 34 34 SER C C 13 174.285 0.05 . 1 . . . . 34 SER C . 25964 1
277 . 1 1 34 34 SER CA C 13 58.176 0.016 . 1 . . . . 34 SER CA . 25964 1
278 . 1 1 34 34 SER CB C 13 63.869 0.001 . 1 . . . . 34 SER CB . 25964 1
279 . 1 1 34 34 SER N N 15 115.316 0.025 . 1 . . . . 34 SER N . 25964 1
280 . 1 1 35 35 ASN H H 1 8.483 0.003 . 1 . . . . 35 ASN H . 25964 1
281 . 1 1 35 35 ASN HA H 1 4.753 0.013 . 1 . . . . 35 ASN HA . 25964 1
282 . 1 1 35 35 ASN HB2 H 1 2.719 0.001 . 1 . . . . 35 ASN HB2 . 25964 1
283 . 1 1 35 35 ASN C C 13 174.989 0.05 . 1 . . . . 35 ASN C . 25964 1
284 . 1 1 35 35 ASN CA C 13 53.230 0.018 . 1 . . . . 35 ASN CA . 25964 1
285 . 1 1 35 35 ASN CB C 13 38.857 0.05 . 1 . . . . 35 ASN CB . 25964 1
286 . 1 1 35 35 ASN N N 15 120.581 0.056 . 1 . . . . 35 ASN N . 25964 1
287 . 1 1 36 36 THR H H 1 7.988 0.002 . 1 . . . . 36 THR H . 25964 1
288 . 1 1 36 36 THR HA H 1 4.264 0.002 . 1 . . . . 36 THR HA . 25964 1
289 . 1 1 36 36 THR HB H 1 4.142 0.002 . 1 . . . . 36 THR HB . 25964 1
290 . 1 1 36 36 THR HG21 H 1 1.081 0.006 . 1 . . . . 36 THR HG21 . 25964 1
291 . 1 1 36 36 THR HG22 H 1 1.081 0.006 . 1 . . . . 36 THR HG22 . 25964 1
292 . 1 1 36 36 THR HG23 H 1 1.081 0.006 . 1 . . . . 36 THR HG23 . 25964 1
293 . 1 1 36 36 THR C C 13 173.184 0.05 . 1 . . . . 36 THR C . 25964 1
294 . 1 1 36 36 THR CA C 13 61.615 0.018 . 1 . . . . 36 THR CA . 25964 1
295 . 1 1 36 36 THR CB C 13 69.790 0.05 . 1 . . . . 36 THR CB . 25964 1
296 . 1 1 36 36 THR N N 15 113.794 0.059 . 1 . . . . 36 THR N . 25964 1
297 . 1 1 37 37 TYR H H 1 7.718 0.003 . 1 . . . . 37 TYR H . 25964 1
298 . 1 1 37 37 TYR HA H 1 4.374 0.003 . 1 . . . . 37 TYR HA . 25964 1
299 . 1 1 37 37 TYR HB2 H 1 3.044 0.008 . 2 . . . . 37 TYR HB2 . 25964 1
300 . 1 1 37 37 TYR HB3 H 1 2.855 0.006 . 2 . . . . 37 TYR HB3 . 25964 1
301 . 1 1 37 37 TYR CA C 13 59.107 0.011 . 1 . . . . 37 TYR CA . 25964 1
302 . 1 1 37 37 TYR CB C 13 39.319 0.05 . 1 . . . . 37 TYR CB . 25964 1
303 . 1 1 37 37 TYR N N 15 126.893 0.04 . 1 . . . . 37 TYR N . 25964 1
304 . 2 2 11 11 SER H H 1 8.250 0.004 . 1 . . . . 11 SER H . 25964 1
305 . 2 2 11 11 SER HA H 1 4.431 0.01 . 1 . . . . 11 SER HA . 25964 1
306 . 2 2 11 11 SER HB2 H 1 3.864 0.05 . 2 . . . . 11 SER HB2 . 25964 1
307 . 2 2 11 11 SER HB3 H 1 3.805 0.05 . 2 . . . . 11 SER HB3 . 25964 1
308 . 2 2 11 11 SER CA C 13 58.465 0.013 . 1 . . . . 11 SER CA . 25964 1
309 . 2 2 11 11 SER CB C 13 63.708 0.05 . 1 . . . . 11 SER CB . 25964 1
310 . 2 2 11 11 SER N N 15 116.117 0.04 . 1 . . . . 11 SER N . 25964 1
311 . 2 2 12 12 ALA H H 1 8.270 0.003 . 1 . . . . 12 ALA H . 25964 1
312 . 2 2 12 12 ALA HA H 1 4.335 0.005 . 1 . . . . 12 ALA HA . 25964 1
313 . 2 2 12 12 ALA HB1 H 1 1.383 0.05 . 1 . . . . 12 ALA HB1 . 25964 1
314 . 2 2 12 12 ALA HB2 H 1 1.383 0.05 . 1 . . . . 12 ALA HB2 . 25964 1
315 . 2 2 12 12 ALA HB3 H 1 1.383 0.05 . 1 . . . . 12 ALA HB3 . 25964 1
316 . 2 2 12 12 ALA CA C 13 52.800 0.002 . 1 . . . . 12 ALA CA . 25964 1
317 . 2 2 12 12 ALA CB C 13 19.159 0.05 . 1 . . . . 12 ALA CB . 25964 1
318 . 2 2 12 12 ALA N N 15 125.846 0.015 . 1 . . . . 12 ALA N . 25964 1
319 . 2 2 13 13 GLY H H 1 8.337 0.003 . 1 . . . . 13 GLY H . 25964 1
320 . 2 2 13 13 GLY HA2 H 1 3.964 0.002 . 2 . . . . 13 GLY HA2 . 25964 1
321 . 2 2 13 13 GLY HA3 H 1 3.965 0.05 . 2 . . . . 13 GLY HA3 . 25964 1
322 . 2 2 13 13 GLY CA C 13 45.402 0.004 . 1 . . . . 13 GLY CA . 25964 1
323 . 2 2 13 13 GLY N N 15 107.851 0.005 . 1 . . . . 13 GLY N . 25964 1
324 . 2 2 14 14 GLY H H 1 8.104 0.003 . 1 . . . . 14 GLY H . 25964 1
325 . 2 2 14 14 GLY HA2 H 1 3.966 0.003 . 2 . . . . 14 GLY HA2 . 25964 1
326 . 2 2 14 14 GLY HA3 H 1 3.971 0.05 . 2 . . . . 14 GLY HA3 . 25964 1
327 . 2 2 14 14 GLY CA C 13 45.051 0.07 . 1 . . . . 14 GLY CA . 25964 1
328 . 2 2 14 14 GLY N N 15 108.396 0.051 . 1 . . . . 14 GLY N . 25964 1
329 . 2 2 15 15 GLU H H 1 8.209 0.007 . 1 . . . . 15 GLU H . 25964 1
330 . 2 2 15 15 GLU HA H 1 4.332 0.007 . 1 . . . . 15 GLU HA . 25964 1
331 . 2 2 15 15 GLU HB2 H 1 1.867 0.003 . 2 . . . . 15 GLU HB2 . 25964 1
332 . 2 2 15 15 GLU HB3 H 1 1.791 0.003 . 2 . . . . 15 GLU HB3 . 25964 1
333 . 2 2 15 15 GLU HG2 H 1 2.155 0.005 . 2 . . . . 15 GLU HG2 . 25964 1
334 . 2 2 15 15 GLU HG3 H 1 2.085 0.005 . 2 . . . . 15 GLU HG3 . 25964 1
335 . 2 2 15 15 GLU CA C 13 56.014 0.025 . 1 . . . . 15 GLU CA . 25964 1
336 . 2 2 15 15 GLU CB C 13 31.460 0.001 . 1 . . . . 15 GLU CB . 25964 1
337 . 2 2 15 15 GLU CG C 13 36.080 0.05 . 1 . . . . 15 GLU CG . 25964 1
338 . 2 2 15 15 GLU N N 15 119.608 0.027 . 1 . . . . 15 GLU N . 25964 1
339 . 2 2 16 16 ILE H H 1 8.099 0.006 . 1 . . . . 16 ILE H . 25964 1
340 . 2 2 16 16 ILE HA H 1 4.357 0.008 . 1 . . . . 16 ILE HA . 25964 1
341 . 2 2 16 16 ILE HB H 1 1.482 0.018 . 1 . . . . 16 ILE HB . 25964 1
342 . 2 2 16 16 ILE HG12 H 1 0.825 0.006 . 1 . . . . 16 ILE HG12 . 25964 1
343 . 2 2 16 16 ILE HG21 H 1 0.283 0.004 . 1 . . . . 16 ILE HG21 . 25964 1
344 . 2 2 16 16 ILE HG22 H 1 0.283 0.004 . 1 . . . . 16 ILE HG22 . 25964 1
345 . 2 2 16 16 ILE HG23 H 1 0.283 0.004 . 1 . . . . 16 ILE HG23 . 25964 1
346 . 2 2 16 16 ILE HD11 H 1 0.812 0.004 . 1 . . . . 16 ILE HD11 . 25964 1
347 . 2 2 16 16 ILE HD12 H 1 0.812 0.004 . 1 . . . . 16 ILE HD12 . 25964 1
348 . 2 2 16 16 ILE HD13 H 1 0.812 0.004 . 1 . . . . 16 ILE HD13 . 25964 1
349 . 2 2 16 16 ILE CA C 13 60.953 0.09 . 1 . . . . 16 ILE CA . 25964 1
350 . 2 2 16 16 ILE CB C 13 40.249 0.027 . 1 . . . . 16 ILE CB . 25964 1
351 . 2 2 16 16 ILE CG1 C 13 28.627 0.05 . 1 . . . . 16 ILE CG1 . 25964 1
352 . 2 2 16 16 ILE CG2 C 13 18.823 0.014 . 1 . . . . 16 ILE CG2 . 25964 1
353 . 2 2 16 16 ILE CD1 C 13 13.711 0.023 . 1 . . . . 16 ILE CD1 . 25964 1
354 . 2 2 16 16 ILE N N 15 121.428 0.044 . 1 . . . . 16 ILE N . 25964 1
355 . 2 2 17 17 VAL H H 1 8.675 0.006 . 1 . . . . 17 VAL H . 25964 1
356 . 2 2 17 17 VAL HA H 1 4.205 0.01 . 1 . . . . 17 VAL HA . 25964 1
357 . 2 2 17 17 VAL HB H 1 1.919 0.005 . 1 . . . . 17 VAL HB . 25964 1
358 . 2 2 17 17 VAL HG11 H 1 0.844 0.004 . 2 . . . . 17 VAL HG11 . 25964 1
359 . 2 2 17 17 VAL HG12 H 1 0.844 0.004 . 2 . . . . 17 VAL HG12 . 25964 1
360 . 2 2 17 17 VAL HG13 H 1 0.844 0.004 . 2 . . . . 17 VAL HG13 . 25964 1
361 . 2 2 17 17 VAL HG21 H 1 0.750 0.006 . 2 . . . . 17 VAL HG21 . 25964 1
362 . 2 2 17 17 VAL HG22 H 1 0.750 0.006 . 2 . . . . 17 VAL HG22 . 25964 1
363 . 2 2 17 17 VAL HG23 H 1 0.750 0.006 . 2 . . . . 17 VAL HG23 . 25964 1
364 . 2 2 17 17 VAL CA C 13 61.340 0.031 . 1 . . . . 17 VAL CA . 25964 1
365 . 2 2 17 17 VAL CB C 13 33.521 0.047 . 1 . . . . 17 VAL CB . 25964 1
366 . 2 2 17 17 VAL CG1 C 13 21.472 0.026 . 2 . . . . 17 VAL CG1 . 25964 1
367 . 2 2 17 17 VAL CG2 C 13 21.045 0.047 . 2 . . . . 17 VAL CG2 . 25964 1
368 . 2 2 17 17 VAL N N 15 128.312 0.12 . 1 . . . . 17 VAL N . 25964 1
369 . 2 2 18 18 TYR H H 1 8.477 0.007 . 1 . . . . 18 TYR H . 25964 1
370 . 2 2 18 18 TYR HB2 H 1 2.781 0.003 . 2 . . . . 18 TYR HB2 . 25964 1
371 . 2 2 18 18 TYR HB3 H 1 3.030 0.003 . 2 . . . . 18 TYR HB3 . 25964 1
372 . 2 2 18 18 TYR HD1 H 1 7.031 0.008 . 1 . . . . 18 TYR HD1 . 25964 1
373 . 2 2 18 18 TYR HD2 H 1 7.031 0.008 . 1 . . . . 18 TYR HD2 . 25964 1
374 . 2 2 18 18 TYR HE1 H 1 6.581 0.001 . 1 . . . . 18 TYR HE1 . 25964 1
375 . 2 2 18 18 TYR HE2 H 1 6.581 0.001 . 1 . . . . 18 TYR HE2 . 25964 1
376 . 2 2 18 18 TYR CA C 13 58.015 0.001 . 1 . . . . 18 TYR CA . 25964 1
377 . 2 2 18 18 TYR CB C 13 39.520 0.048 . 1 . . . . 18 TYR CB . 25964 1
378 . 2 2 18 18 TYR N N 15 127.035 0.129 . 1 . . . . 18 TYR N . 25964 1
379 . 2 2 19 19 LEU H H 1 8.130 0.011 . 1 . . . . 19 LEU H . 25964 1
380 . 2 2 19 19 LEU HA H 1 4.821 0.002 . 1 . . . . 19 LEU HA . 25964 1
381 . 2 2 19 19 LEU HB2 H 1 1.441 0.001 . 2 . . . . 19 LEU HB2 . 25964 1
382 . 2 2 19 19 LEU HB3 H 1 1.474 0.013 . 2 . . . . 19 LEU HB3 . 25964 1
383 . 2 2 19 19 LEU HG H 1 1.368 0.028 . 1 . . . . 19 LEU HG . 25964 1
384 . 2 2 19 19 LEU HD11 H 1 0.523 0.003 . 2 . . . . 19 LEU HD11 . 25964 1
385 . 2 2 19 19 LEU HD12 H 1 0.523 0.003 . 2 . . . . 19 LEU HD12 . 25964 1
386 . 2 2 19 19 LEU HD13 H 1 0.523 0.003 . 2 . . . . 19 LEU HD13 . 25964 1
387 . 2 2 19 19 LEU HD21 H 1 0.527 0.001 . 2 . . . . 19 LEU HD21 . 25964 1
388 . 2 2 19 19 LEU HD22 H 1 0.527 0.001 . 2 . . . . 19 LEU HD22 . 25964 1
389 . 2 2 19 19 LEU HD23 H 1 0.527 0.001 . 2 . . . . 19 LEU HD23 . 25964 1
390 . 2 2 19 19 LEU CA C 13 52.085 0.02 . 1 . . . . 19 LEU CA . 25964 1
391 . 2 2 19 19 LEU CB C 13 42.931 0.051 . 1 . . . . 19 LEU CB . 25964 1
392 . 2 2 19 19 LEU CG C 13 25.700 0.063 . 1 . . . . 19 LEU CG . 25964 1
393 . 2 2 19 19 LEU CD1 C 13 23.060 0.037 . 2 . . . . 19 LEU CD1 . 25964 1
394 . 2 2 19 19 LEU CD2 C 13 25.885 0.05 . 2 . . . . 19 LEU CD2 . 25964 1
395 . 2 2 19 19 LEU N N 15 120.796 0.055 . 1 . . . . 19 LEU N . 25964 1
396 . 2 2 20 20 PRO CA C 13 64.517 0.05 . 1 . . . . 20 PRO CA . 25964 1
397 . 2 2 21 21 ASN H H 1 8.773 0.004 . 1 . . . . 21 ASN H . 25964 1
398 . 2 2 21 21 ASN CA C 13 52.667 0.027 . 1 . . . . 21 ASN CA . 25964 1
399 . 2 2 21 21 ASN CB C 13 38.811 0.005 . 1 . . . . 21 ASN CB . 25964 1
400 . 2 2 21 21 ASN N N 15 113.308 0.053 . 1 . . . . 21 ASN N . 25964 1
401 . 2 2 22 22 LEU H H 1 6.923 0.007 . 1 . . . . 22 LEU H . 25964 1
402 . 2 2 22 22 LEU HA H 1 4.366 0.01 . 1 . . . . 22 LEU HA . 25964 1
403 . 2 2 22 22 LEU HB2 H 1 1.593 0.012 . 2 . . . . 22 LEU HB2 . 25964 1
404 . 2 2 22 22 LEU HB3 H 1 1.581 0.05 . 2 . . . . 22 LEU HB3 . 25964 1
405 . 2 2 22 22 LEU HG H 1 1.655 0.015 . 1 . . . . 22 LEU HG . 25964 1
406 . 2 2 22 22 LEU HD11 H 1 0.785 0.006 . 2 . . . . 22 LEU HD11 . 25964 1
407 . 2 2 22 22 LEU HD12 H 1 0.785 0.006 . 2 . . . . 22 LEU HD12 . 25964 1
408 . 2 2 22 22 LEU HD13 H 1 0.785 0.006 . 2 . . . . 22 LEU HD13 . 25964 1
409 . 2 2 22 22 LEU HD21 H 1 0.678 0.003 . 2 . . . . 22 LEU HD21 . 25964 1
410 . 2 2 22 22 LEU HD22 H 1 0.678 0.003 . 2 . . . . 22 LEU HD22 . 25964 1
411 . 2 2 22 22 LEU HD23 H 1 0.678 0.003 . 2 . . . . 22 LEU HD23 . 25964 1
412 . 2 2 22 22 LEU CA C 13 54.668 0.048 . 1 . . . . 22 LEU CA . 25964 1
413 . 2 2 22 22 LEU CB C 13 42.334 0.027 . 1 . . . . 22 LEU CB . 25964 1
414 . 2 2 22 22 LEU CG C 13 28.134 0.07 . 1 . . . . 22 LEU CG . 25964 1
415 . 2 2 22 22 LEU CD1 C 13 25.534 0.05 . 2 . . . . 22 LEU CD1 . 25964 1
416 . 2 2 22 22 LEU CD2 C 13 22.882 0.019 . 2 . . . . 22 LEU CD2 . 25964 1
417 . 2 2 22 22 LEU N N 15 120.348 0.025 . 1 . . . . 22 LEU N . 25964 1
418 . 2 2 23 23 ASN H H 1 8.853 0.005 . 1 . . . . 23 ASN H . 25964 1
419 . 2 2 23 23 ASN CA C 13 51.356 0.002 . 1 . . . . 23 ASN CA . 25964 1
420 . 2 2 23 23 ASN CB C 13 36.870 0.05 . 1 . . . . 23 ASN CB . 25964 1
421 . 2 2 23 23 ASN N N 15 121.815 0.079 . 1 . . . . 23 ASN N . 25964 1
422 . 2 2 24 24 PRO HA H 1 3.693 0.007 . 1 . . . . 24 PRO HA . 25964 1
423 . 2 2 24 24 PRO HB2 H 1 1.111 0.019 . 2 . . . . 24 PRO HB2 . 25964 1
424 . 2 2 24 24 PRO HB3 H 1 1.125 0.005 . 2 . . . . 24 PRO HB3 . 25964 1
425 . 2 2 24 24 PRO HG2 H 1 1.281 0.002 . 2 . . . . 24 PRO HG2 . 25964 1
426 . 2 2 24 24 PRO HG3 H 1 1.535 0.007 . 2 . . . . 24 PRO HG3 . 25964 1
427 . 2 2 24 24 PRO HD2 H 1 3.482 0.05 . 2 . . . . 24 PRO HD2 . 25964 1
428 . 2 2 24 24 PRO HD3 H 1 3.268 0.014 . 2 . . . . 24 PRO HD3 . 25964 1
429 . 2 2 24 24 PRO CA C 13 66.145 0.071 . 1 . . . . 24 PRO CA . 25964 1
430 . 2 2 24 24 PRO CB C 13 31.550 0.035 . 1 . . . . 24 PRO CB . 25964 1
431 . 2 2 24 24 PRO CG C 13 27.760 0.005 . 1 . . . . 24 PRO CG . 25964 1
432 . 2 2 24 24 PRO CD C 13 49.512 0.023 . 1 . . . . 24 PRO CD . 25964 1
433 . 2 2 25 25 ASP H H 1 7.869 0.006 . 1 . . . . 25 ASP H . 25964 1
434 . 2 2 25 25 ASP CA C 13 57.582 0.05 . 1 . . . . 25 ASP CA . 25964 1
435 . 2 2 25 25 ASP CB C 13 39.975 0.05 . 1 . . . . 25 ASP CB . 25964 1
436 . 2 2 25 25 ASP N N 15 116.580 0.048 . 1 . . . . 25 ASP N . 25964 1
437 . 2 2 27 27 LEU H H 1 8.582 0.005 . 1 . . . . 27 LEU H . 25964 1
438 . 2 2 27 27 LEU HA H 1 4.030 0.05 . 1 . . . . 27 LEU HA . 25964 1
439 . 2 2 27 27 LEU HB2 H 1 1.665 0.007 . 2 . . . . 27 LEU HB2 . 25964 1
440 . 2 2 27 27 LEU HB3 H 1 1.192 0.011 . 2 . . . . 27 LEU HB3 . 25964 1
441 . 2 2 27 27 LEU HG H 1 1.525 0.007 . 1 . . . . 27 LEU HG . 25964 1
442 . 2 2 27 27 LEU HD11 H 1 0.803 0.011 . 2 . . . . 27 LEU HD11 . 25964 1
443 . 2 2 27 27 LEU HD12 H 1 0.803 0.011 . 2 . . . . 27 LEU HD12 . 25964 1
444 . 2 2 27 27 LEU HD13 H 1 0.803 0.011 . 2 . . . . 27 LEU HD13 . 25964 1
445 . 2 2 27 27 LEU HD21 H 1 0.847 0.007 . 2 . . . . 27 LEU HD21 . 25964 1
446 . 2 2 27 27 LEU HD22 H 1 0.847 0.007 . 2 . . . . 27 LEU HD22 . 25964 1
447 . 2 2 27 27 LEU HD23 H 1 0.847 0.007 . 2 . . . . 27 LEU HD23 . 25964 1
448 . 2 2 27 27 LEU CA C 13 58.182 0.05 . 1 . . . . 27 LEU CA . 25964 1
449 . 2 2 27 27 LEU CB C 13 42.271 0.031 . 1 . . . . 27 LEU CB . 25964 1
450 . 2 2 27 27 LEU CG C 13 27.139 0.033 . 1 . . . . 27 LEU CG . 25964 1
451 . 2 2 27 27 LEU CD1 C 13 25.464 0.037 . 2 . . . . 27 LEU CD1 . 25964 1
452 . 2 2 27 27 LEU CD2 C 13 25.056 0.013 . 2 . . . . 27 LEU CD2 . 25964 1
453 . 2 2 27 27 LEU N N 15 121.185 0.047 . 1 . . . . 27 LEU N . 25964 1
454 . 2 2 29 29 ALA H H 1 8.037 0.004 . 1 . . . . 29 ALA H . 25964 1
455 . 2 2 29 29 ALA HA H 1 4.224 0.003 . 1 . . . . 29 ALA HA . 25964 1
456 . 2 2 29 29 ALA HB1 H 1 1.476 0.001 . 1 . . . . 29 ALA HB1 . 25964 1
457 . 2 2 29 29 ALA HB2 H 1 1.476 0.001 . 1 . . . . 29 ALA HB2 . 25964 1
458 . 2 2 29 29 ALA HB3 H 1 1.476 0.001 . 1 . . . . 29 ALA HB3 . 25964 1
459 . 2 2 29 29 ALA CA C 13 55.516 0.005 . 1 . . . . 29 ALA CA . 25964 1
460 . 2 2 29 29 ALA CB C 13 17.714 0.003 . 1 . . . . 29 ALA CB . 25964 1
461 . 2 2 29 29 ALA N N 15 122.259 0.045 . 1 . . . . 29 ALA N . 25964 1
462 . 2 2 30 30 PHE H H 1 7.786 0.006 . 1 . . . . 30 PHE H . 25964 1
463 . 2 2 30 30 PHE HA H 1 4.482 0.002 . 1 . . . . 30 PHE HA . 25964 1
464 . 2 2 30 30 PHE HB2 H 1 3.218 0.005 . 1 . . . . 30 PHE HB2 . 25964 1
465 . 2 2 30 30 PHE HB3 H 1 3.218 0.005 . 1 . . . . 30 PHE HB3 . 25964 1
466 . 2 2 30 30 PHE HD1 H 1 7.157 0.005 . 1 . . . . 30 PHE HD1 . 25964 1
467 . 2 2 30 30 PHE HD2 H 1 7.157 0.005 . 1 . . . . 30 PHE HD2 . 25964 1
468 . 2 2 30 30 PHE CA C 13 61.082 0.045 . 1 . . . . 30 PHE CA . 25964 1
469 . 2 2 30 30 PHE CB C 13 38.591 0.004 . 1 . . . . 30 PHE CB . 25964 1
470 . 2 2 30 30 PHE N N 15 120.027 0.05 . 1 . . . . 30 PHE N . 25964 1
471 . 2 2 31 31 ILE H H 1 8.295 0.01 . 1 . . . . 31 ILE H . 25964 1
472 . 2 2 31 31 ILE HA H 1 3.307 0.012 . 1 . . . . 31 ILE HA . 25964 1
473 . 2 2 31 31 ILE HB H 1 1.754 0.008 . 1 . . . . 31 ILE HB . 25964 1
474 . 2 2 31 31 ILE HG12 H 1 1.304 0.004 . 2 . . . . 31 ILE HG12 . 25964 1
475 . 2 2 31 31 ILE HG13 H 1 0.460 0.004 . 2 . . . . 31 ILE HG13 . 25964 1
476 . 2 2 31 31 ILE HG21 H 1 0.529 0.005 . 1 . . . . 31 ILE HG21 . 25964 1
477 . 2 2 31 31 ILE HG22 H 1 0.529 0.005 . 1 . . . . 31 ILE HG22 . 25964 1
478 . 2 2 31 31 ILE HG23 H 1 0.529 0.005 . 1 . . . . 31 ILE HG23 . 25964 1
479 . 2 2 31 31 ILE HD11 H 1 0.259 0.005 . 1 . . . . 31 ILE HD11 . 25964 1
480 . 2 2 31 31 ILE HD12 H 1 0.259 0.005 . 1 . . . . 31 ILE HD12 . 25964 1
481 . 2 2 31 31 ILE HD13 H 1 0.259 0.005 . 1 . . . . 31 ILE HD13 . 25964 1
482 . 2 2 31 31 ILE CA C 13 64.473 0.042 . 1 . . . . 31 ILE CA . 25964 1
483 . 2 2 31 31 ILE CB C 13 37.873 0.149 . 1 . . . . 31 ILE CB . 25964 1
484 . 2 2 31 31 ILE CG1 C 13 28.644 0.055 . 1 . . . . 31 ILE CG1 . 25964 1
485 . 2 2 31 31 ILE CG2 C 13 17.921 0.038 . 1 . . . . 31 ILE CG2 . 25964 1
486 . 2 2 31 31 ILE CD1 C 13 14.042 0.112 . 1 . . . . 31 ILE CD1 . 25964 1
487 . 2 2 31 31 ILE N N 15 119.674 0.035 . 1 . . . . 31 ILE N . 25964 1
488 . 2 2 32 32 HIS H H 1 8.197 0.005 . 1 . . . . 32 HIS H . 25964 1
489 . 2 2 32 32 HIS CA C 13 60.818 0.022 . 1 . . . . 32 HIS CA . 25964 1
490 . 2 2 32 32 HIS CB C 13 28.653 0.05 . 1 . . . . 32 HIS CB . 25964 1
491 . 2 2 32 32 HIS N N 15 117.162 0.033 . 1 . . . . 32 HIS N . 25964 1
492 . 2 2 33 33 SER H H 1 8.473 0.003 . 1 . . . . 33 SER H . 25964 1
493 . 2 2 33 33 SER CA C 13 62.975 0.071 . 1 . . . . 33 SER CA . 25964 1
494 . 2 2 33 33 SER N N 15 116.852 0.039 . 1 . . . . 33 SER N . 25964 1
495 . 2 2 34 34 ILE H H 1 8.029 0.008 . 1 . . . . 34 ILE H . 25964 1
496 . 2 2 34 34 ILE HA H 1 3.639 0.009 . 1 . . . . 34 ILE HA . 25964 1
497 . 2 2 34 34 ILE HB H 1 1.725 0.004 . 1 . . . . 34 ILE HB . 25964 1
498 . 2 2 34 34 ILE HG12 H 1 1.000 0.004 . 2 . . . . 34 ILE HG12 . 25964 1
499 . 2 2 34 34 ILE HG13 H 1 1.201 0.008 . 2 . . . . 34 ILE HG13 . 25964 1
500 . 2 2 34 34 ILE HG21 H 1 0.723 0.004 . 1 . . . . 34 ILE HG21 . 25964 1
501 . 2 2 34 34 ILE HG22 H 1 0.723 0.004 . 1 . . . . 34 ILE HG22 . 25964 1
502 . 2 2 34 34 ILE HG23 H 1 0.723 0.004 . 1 . . . . 34 ILE HG23 . 25964 1
503 . 2 2 34 34 ILE HD11 H 1 0.667 0.007 . 1 . . . . 34 ILE HD11 . 25964 1
504 . 2 2 34 34 ILE HD12 H 1 0.667 0.007 . 1 . . . . 34 ILE HD12 . 25964 1
505 . 2 2 34 34 ILE HD13 H 1 0.667 0.007 . 1 . . . . 34 ILE HD13 . 25964 1
506 . 2 2 34 34 ILE CA C 13 63.720 0.034 . 1 . . . . 34 ILE CA . 25964 1
507 . 2 2 34 34 ILE CB C 13 37.346 0.067 . 1 . . . . 34 ILE CB . 25964 1
508 . 2 2 34 34 ILE CG1 C 13 28.156 0.024 . 1 . . . . 34 ILE CG1 . 25964 1
509 . 2 2 34 34 ILE CG2 C 13 17.798 0.035 . 1 . . . . 34 ILE CG2 . 25964 1
510 . 2 2 34 34 ILE CD1 C 13 13.029 0.036 . 1 . . . . 34 ILE CD1 . 25964 1
511 . 2 2 34 34 ILE N N 15 119.889 0.049 . 1 . . . . 34 ILE N . 25964 1
512 . 2 2 35 35 HIS H H 1 7.362 0.009 . 1 . . . . 35 HIS H . 25964 1
513 . 2 2 35 35 HIS HA H 1 4.187 0.009 . 1 . . . . 35 HIS HA . 25964 1
514 . 2 2 35 35 HIS HB2 H 1 3.336 0.005 . 2 . . . . 35 HIS HB2 . 25964 1
515 . 2 2 35 35 HIS HB3 H 1 3.272 0.012 . 2 . . . . 35 HIS HB3 . 25964 1
516 . 2 2 35 35 HIS CA C 13 59.218 0.051 . 1 . . . . 35 HIS CA . 25964 1
517 . 2 2 35 35 HIS CB C 13 29.088 0.05 . 1 . . . . 35 HIS CB . 25964 1
518 . 2 2 35 35 HIS N N 15 118.041 0.056 . 1 . . . . 35 HIS N . 25964 1
519 . 2 2 36 36 ASP H H 1 8.411 0.007 . 1 . . . . 36 ASP H . 25964 1
520 . 2 2 36 36 ASP CA C 13 56.410 0.009 . 1 . . . . 36 ASP CA . 25964 1
521 . 2 2 36 36 ASP CB C 13 40.637 0.05 . 1 . . . . 36 ASP CB . 25964 1
522 . 2 2 36 36 ASP N N 15 118.363 0.048 . 1 . . . . 36 ASP N . 25964 1
523 . 2 2 37 37 ASP H H 1 7.519 0.002 . 1 . . . . 37 ASP H . 25964 1
524 . 2 2 37 37 ASP CA C 13 51.562 0.019 . 1 . . . . 37 ASP CA . 25964 1
525 . 2 2 37 37 ASP CB C 13 40.440 0.05 . 1 . . . . 37 ASP CB . 25964 1
526 . 2 2 37 37 ASP N N 15 115.326 0.036 . 1 . . . . 37 ASP N . 25964 1
527 . 2 2 38 38 PRO CA C 13 64.549 0.05 . 1 . . . . 38 PRO CA . 25964 1
528 . 2 2 38 38 PRO CB C 13 31.718 0.05 . 1 . . . . 38 PRO CB . 25964 1
529 . 2 2 39 39 SER H H 1 8.412 0.004 . 1 . . . . 39 SER H . 25964 1
530 . 2 2 39 39 SER CA C 13 61.343 0.007 . 1 . . . . 39 SER CA . 25964 1
531 . 2 2 39 39 SER CB C 13 62.578 0.05 . 1 . . . . 39 SER CB . 25964 1
532 . 2 2 39 39 SER N N 15 115.318 0.026 . 1 . . . . 39 SER N . 25964 1
533 . 2 2 40 40 GLN H H 1 7.785 0.003 . 1 . . . . 40 GLN H . 25964 1
534 . 2 2 40 40 GLN CA C 13 54.775 0.013 . 1 . . . . 40 GLN CA . 25964 1
535 . 2 2 40 40 GLN CB C 13 28.572 0.037 . 1 . . . . 40 GLN CB . 25964 1
536 . 2 2 40 40 GLN N N 15 120.187 0.015 . 1 . . . . 40 GLN N . 25964 1
537 . 2 2 41 41 SER H H 1 7.728 0.005 . 1 . . . . 41 SER H . 25964 1
538 . 2 2 41 41 SER CA C 13 63.306 0.009 . 1 . . . . 41 SER CA . 25964 1
539 . 2 2 41 41 SER N N 15 115.618 0.049 . 1 . . . . 41 SER N . 25964 1
540 . 2 2 42 42 ALA H H 1 8.631 0.003 . 1 . . . . 42 ALA H . 25964 1
541 . 2 2 42 42 ALA HA H 1 4.159 0.002 . 1 . . . . 42 ALA HA . 25964 1
542 . 2 2 42 42 ALA HB1 H 1 1.423 0.05 . 1 . . . . 42 ALA HB1 . 25964 1
543 . 2 2 42 42 ALA HB2 H 1 1.423 0.05 . 1 . . . . 42 ALA HB2 . 25964 1
544 . 2 2 42 42 ALA HB3 H 1 1.423 0.05 . 1 . . . . 42 ALA HB3 . 25964 1
545 . 2 2 42 42 ALA CA C 13 55.783 0.023 . 1 . . . . 42 ALA CA . 25964 1
546 . 2 2 42 42 ALA CB C 13 17.754 0.008 . 1 . . . . 42 ALA CB . 25964 1
547 . 2 2 42 42 ALA N N 15 123.021 0.068 . 1 . . . . 42 ALA N . 25964 1
548 . 2 2 43 43 ASN H H 1 7.962 0.003 . 1 . . . . 43 ASN H . 25964 1
549 . 2 2 43 43 ASN CA C 13 55.862 0.015 . 1 . . . . 43 ASN CA . 25964 1
550 . 2 2 43 43 ASN CB C 13 38.151 0.028 . 1 . . . . 43 ASN CB . 25964 1
551 . 2 2 43 43 ASN N N 15 118.556 0.015 . 1 . . . . 43 ASN N . 25964 1
552 . 2 2 44 44 LEU H H 1 8.702 0.007 . 1 . . . . 44 LEU H . 25964 1
553 . 2 2 44 44 LEU HB2 H 1 1.950 0.008 . 2 . . . . 44 LEU HB2 . 25964 1
554 . 2 2 44 44 LEU HB3 H 1 1.427 0.02 . 2 . . . . 44 LEU HB3 . 25964 1
555 . 2 2 44 44 LEU HG H 1 1.861 0.009 . 1 . . . . 44 LEU HG . 25964 1
556 . 2 2 44 44 LEU HD11 H 1 0.995 0.008 . 2 . . . . 44 LEU HD11 . 25964 1
557 . 2 2 44 44 LEU HD12 H 1 0.995 0.008 . 2 . . . . 44 LEU HD12 . 25964 1
558 . 2 2 44 44 LEU HD13 H 1 0.995 0.008 . 2 . . . . 44 LEU HD13 . 25964 1
559 . 2 2 44 44 LEU HD21 H 1 0.708 0.012 . 2 . . . . 44 LEU HD21 . 25964 1
560 . 2 2 44 44 LEU HD22 H 1 0.708 0.012 . 2 . . . . 44 LEU HD22 . 25964 1
561 . 2 2 44 44 LEU HD23 H 1 0.708 0.012 . 2 . . . . 44 LEU HD23 . 25964 1
562 . 2 2 44 44 LEU CA C 13 57.952 0.013 . 1 . . . . 44 LEU CA . 25964 1
563 . 2 2 44 44 LEU CB C 13 42.226 0.063 . 1 . . . . 44 LEU CB . 25964 1
564 . 2 2 44 44 LEU CG C 13 27.278 0.003 . 1 . . . . 44 LEU CG . 25964 1
565 . 2 2 44 44 LEU CD1 C 13 22.825 0.039 . 2 . . . . 44 LEU CD1 . 25964 1
566 . 2 2 44 44 LEU CD2 C 13 26.201 0.054 . 2 . . . . 44 LEU CD2 . 25964 1
567 . 2 2 44 44 LEU N N 15 121.620 0.061 . 1 . . . . 44 LEU N . 25964 1
568 . 2 2 45 45 LEU H H 1 8.940 0.007 . 1 . . . . 45 LEU H . 25964 1
569 . 2 2 45 45 LEU HA H 1 4.120 0.017 . 1 . . . . 45 LEU HA . 25964 1
570 . 2 2 45 45 LEU HB2 H 1 1.836 0.014 . 2 . . . . 45 LEU HB2 . 25964 1
571 . 2 2 45 45 LEU HB3 H 1 1.867 0.002 . 2 . . . . 45 LEU HB3 . 25964 1
572 . 2 2 45 45 LEU HG H 1 1.657 0.003 . 1 . . . . 45 LEU HG . 25964 1
573 . 2 2 45 45 LEU HD11 H 1 0.885 0.005 . 2 . . . . 45 LEU HD11 . 25964 1
574 . 2 2 45 45 LEU HD12 H 1 0.885 0.005 . 2 . . . . 45 LEU HD12 . 25964 1
575 . 2 2 45 45 LEU HD13 H 1 0.885 0.005 . 2 . . . . 45 LEU HD13 . 25964 1
576 . 2 2 45 45 LEU HD21 H 1 0.841 0.001 . 2 . . . . 45 LEU HD21 . 25964 1
577 . 2 2 45 45 LEU HD22 H 1 0.841 0.001 . 2 . . . . 45 LEU HD22 . 25964 1
578 . 2 2 45 45 LEU HD23 H 1 0.841 0.001 . 2 . . . . 45 LEU HD23 . 25964 1
579 . 2 2 45 45 LEU CA C 13 58.080 0.035 . 1 . . . . 45 LEU CA . 25964 1
580 . 2 2 45 45 LEU CB C 13 41.512 0.033 . 1 . . . . 45 LEU CB . 25964 1
581 . 2 2 45 45 LEU CG C 13 27.610 0.038 . 1 . . . . 45 LEU CG . 25964 1
582 . 2 2 45 45 LEU CD1 C 13 25.422 0.01 . 2 . . . . 45 LEU CD1 . 25964 1
583 . 2 2 45 45 LEU CD2 C 13 23.831 0.021 . 2 . . . . 45 LEU CD2 . 25964 1
584 . 2 2 45 45 LEU N N 15 122.129 0.085 . 1 . . . . 45 LEU N . 25964 1
585 . 2 2 46 46 ALA H H 1 7.794 0.003 . 1 . . . . 46 ALA H . 25964 1
586 . 2 2 46 46 ALA CA C 13 55.414 0.003 . 1 . . . . 46 ALA CA . 25964 1
587 . 2 2 46 46 ALA CB C 13 17.722 0.05 . 1 . . . . 46 ALA CB . 25964 1
588 . 2 2 46 46 ALA N N 15 121.456 0.052 . 1 . . . . 46 ALA N . 25964 1
589 . 2 2 47 47 GLU H H 1 8.006 0.004 . 1 . . . . 47 GLU H . 25964 1
590 . 2 2 47 47 GLU CA C 13 58.948 0.035 . 1 . . . . 47 GLU CA . 25964 1
591 . 2 2 47 47 GLU CB C 13 29.379 0.055 . 1 . . . . 47 GLU CB . 25964 1
592 . 2 2 47 47 GLU N N 15 118.379 0.073 . 1 . . . . 47 GLU N . 25964 1
593 . 2 2 48 48 ALA H H 1 8.204 0.004 . 1 . . . . 48 ALA H . 25964 1
594 . 2 2 48 48 ALA HA H 1 4.012 0.009 . 1 . . . . 48 ALA HA . 25964 1
595 . 2 2 48 48 ALA HB1 H 1 0.857 0.005 . 1 . . . . 48 ALA HB1 . 25964 1
596 . 2 2 48 48 ALA HB2 H 1 0.857 0.005 . 1 . . . . 48 ALA HB2 . 25964 1
597 . 2 2 48 48 ALA HB3 H 1 0.857 0.005 . 1 . . . . 48 ALA HB3 . 25964 1
598 . 2 2 48 48 ALA CA C 13 55.096 0.025 . 1 . . . . 48 ALA CA . 25964 1
599 . 2 2 48 48 ALA CB C 13 16.857 0.033 . 1 . . . . 48 ALA CB . 25964 1
600 . 2 2 48 48 ALA N N 15 125.027 0.07 . 1 . . . . 48 ALA N . 25964 1
601 . 2 2 49 49 LYS H H 1 8.468 0.004 . 1 . . . . 49 LYS H . 25964 1
602 . 2 2 49 49 LYS HA H 1 3.674 0.006 . 1 . . . . 49 LYS HA . 25964 1
603 . 2 2 49 49 LYS HB2 H 1 1.967 0.006 . 2 . . . . 49 LYS HB2 . 25964 1
604 . 2 2 49 49 LYS HB3 H 1 1.743 0.005 . 2 . . . . 49 LYS HB3 . 25964 1
605 . 2 2 49 49 LYS HG2 H 1 1.434 0.012 . 2 . . . . 49 LYS HG2 . 25964 1
606 . 2 2 49 49 LYS HG3 H 1 1.483 0.04 . 2 . . . . 49 LYS HG3 . 25964 1
607 . 2 2 49 49 LYS HD2 H 1 1.607 0.005 . 2 . . . . 49 LYS HD2 . 25964 1
608 . 2 2 49 49 LYS HD3 H 1 1.745 0.005 . 2 . . . . 49 LYS HD3 . 25964 1
609 . 2 2 49 49 LYS HE2 H 1 3.045 0.002 . 1 . . . . 49 LYS HE2 . 25964 1
610 . 2 2 49 49 LYS HE3 H 1 3.045 0.002 . 1 . . . . 49 LYS HE3 . 25964 1
611 . 2 2 49 49 LYS CA C 13 59.412 0.038 . 1 . . . . 49 LYS CA . 25964 1
612 . 2 2 49 49 LYS CB C 13 32.487 0.036 . 1 . . . . 49 LYS CB . 25964 1
613 . 2 2 49 49 LYS CG C 13 25.412 0.052 . 1 . . . . 49 LYS CG . 25964 1
614 . 2 2 49 49 LYS CD C 13 29.331 0.109 . 1 . . . . 49 LYS CD . 25964 1
615 . 2 2 49 49 LYS CE C 13 42.183 0.002 . 1 . . . . 49 LYS CE . 25964 1
616 . 2 2 49 49 LYS N N 15 118.700 0.043 . 1 . . . . 49 LYS N . 25964 1
617 . 2 2 50 50 LYS H H 1 7.639 0.006 . 1 . . . . 50 LYS H . 25964 1
618 . 2 2 50 50 LYS CA C 13 59.676 0.015 . 1 . . . . 50 LYS CA . 25964 1
619 . 2 2 50 50 LYS CB C 13 32.477 0.008 . 1 . . . . 50 LYS CB . 25964 1
620 . 2 2 50 50 LYS N N 15 119.811 0.051 . 1 . . . . 50 LYS N . 25964 1
621 . 2 2 51 51 LEU H H 1 7.976 0.006 . 1 . . . . 51 LEU H . 25964 1
622 . 2 2 51 51 LEU HA H 1 4.117 0.05 . 1 . . . . 51 LEU HA . 25964 1
623 . 2 2 51 51 LEU HB2 H 1 1.562 0.01 . 2 . . . . 51 LEU HB2 . 25964 1
624 . 2 2 51 51 LEU HB3 H 1 1.769 0.001 . 2 . . . . 51 LEU HB3 . 25964 1
625 . 2 2 51 51 LEU HG H 1 1.348 0.008 . 1 . . . . 51 LEU HG . 25964 1
626 . 2 2 51 51 LEU HD11 H 1 0.819 0.05 . 2 . . . . 51 LEU HD11 . 25964 1
627 . 2 2 51 51 LEU HD12 H 1 0.819 0.05 . 2 . . . . 51 LEU HD12 . 25964 1
628 . 2 2 51 51 LEU HD13 H 1 0.819 0.05 . 2 . . . . 51 LEU HD13 . 25964 1
629 . 2 2 51 51 LEU HD21 H 1 0.846 0.05 . 2 . . . . 51 LEU HD21 . 25964 1
630 . 2 2 51 51 LEU HD22 H 1 0.846 0.05 . 2 . . . . 51 LEU HD22 . 25964 1
631 . 2 2 51 51 LEU HD23 H 1 0.846 0.05 . 2 . . . . 51 LEU HD23 . 25964 1
632 . 2 2 51 51 LEU CA C 13 57.561 0.019 . 1 . . . . 51 LEU CA . 25964 1
633 . 2 2 51 51 LEU CB C 13 42.039 0.053 . 1 . . . . 51 LEU CB . 25964 1
634 . 2 2 51 51 LEU CG C 13 26.678 0.026 . 1 . . . . 51 LEU CG . 25964 1
635 . 2 2 51 51 LEU CD1 C 13 24.919 0.05 . 2 . . . . 51 LEU CD1 . 25964 1
636 . 2 2 51 51 LEU CD2 C 13 23.238 0.024 . 2 . . . . 51 LEU CD2 . 25964 1
637 . 2 2 51 51 LEU N N 15 122.806 0.091 . 1 . . . . 51 LEU N . 25964 1
638 . 2 2 52 52 ASN H H 1 8.521 0.006 . 1 . . . . 52 ASN H . 25964 1
639 . 2 2 52 52 ASN CA C 13 58.002 0.012 . 1 . . . . 52 ASN CA . 25964 1
640 . 2 2 52 52 ASN CB C 13 40.931 0.05 . 1 . . . . 52 ASN CB . 25964 1
641 . 2 2 52 52 ASN N N 15 117.228 0.034 . 1 . . . . 52 ASN N . 25964 1
642 . 2 2 53 53 ASP H H 1 8.496 0.002 . 1 . . . . 53 ASP H . 25964 1
643 . 2 2 53 53 ASP CA C 13 56.783 0.023 . 1 . . . . 53 ASP CA . 25964 1
644 . 2 2 53 53 ASP CB C 13 39.454 0.019 . 1 . . . . 53 ASP CB . 25964 1
645 . 2 2 53 53 ASP N N 15 120.126 0.069 . 1 . . . . 53 ASP N . 25964 1
646 . 2 2 54 54 ALA H H 1 8.038 0.002 . 1 . . . . 54 ALA H . 25964 1
647 . 2 2 54 54 ALA CA C 13 54.121 0.013 . 1 . . . . 54 ALA CA . 25964 1
648 . 2 2 54 54 ALA CB C 13 18.371 0.008 . 1 . . . . 54 ALA CB . 25964 1
649 . 2 2 54 54 ALA N N 15 123.628 0.077 . 1 . . . . 54 ALA N . 25964 1
650 . 2 2 55 55 GLN H H 1 7.456 0.002 . 1 . . . . 55 GLN H . 25964 1
651 . 2 2 55 55 GLN HA H 1 4.964 0.05 . 1 . . . . 55 GLN HA . 25964 1
652 . 2 2 55 55 GLN CA C 13 54.983 0.007 . 1 . . . . 55 GLN CA . 25964 1
653 . 2 2 55 55 GLN CB C 13 28.317 0.05 . 1 . . . . 55 GLN CB . 25964 1
654 . 2 2 55 55 GLN N N 15 115.243 0.028 . 1 . . . . 55 GLN N . 25964 1
655 . 2 2 56 56 ALA H H 1 7.129 0.001 . 1 . . . . 56 ALA H . 25964 1
656 . 2 2 56 56 ALA HA H 1 4.317 0.05 . 1 . . . . 56 ALA HA . 25964 1
657 . 2 2 56 56 ALA CA C 13 50.938 0.018 . 1 . . . . 56 ALA CA . 25964 1
658 . 2 2 56 56 ALA CB C 13 17.876 0.05 . 1 . . . . 56 ALA CB . 25964 1
659 . 2 2 56 56 ALA N N 15 124.136 0.024 . 1 . . . . 56 ALA N . 25964 1
660 . 2 2 57 57 PRO CA C 13 62.885 0.008 . 1 . . . . 57 PRO CA . 25964 1
661 . 2 2 57 57 PRO CB C 13 31.899 0.05 . 1 . . . . 57 PRO CB . 25964 1
662 . 2 2 58 58 LYS H H 1 8.190 0.003 . 1 . . . . 58 LYS H . 25964 1
663 . 2 2 58 58 LYS HA H 1 4.250 0.008 . 1 . . . . 58 LYS HA . 25964 1
664 . 2 2 58 58 LYS CA C 13 55.707 0.007 . 1 . . . . 58 LYS CA . 25964 1
665 . 2 2 58 58 LYS CB C 13 33.031 0.003 . 1 . . . . 58 LYS CB . 25964 1
666 . 2 2 58 58 LYS N N 15 122.039 0.047 . 1 . . . . 58 LYS N . 25964 1
667 . 2 2 59 59 TRP H H 1 7.581 0.002 . 1 . . . . 59 TRP H . 25964 1
668 . 2 2 59 59 TRP HA H 1 4.516 0.05 . 1 . . . . 59 TRP HA . 25964 1
669 . 2 2 59 59 TRP HE1 H 1 10.036 0.05 . 1 . . . . 59 TRP HE1 . 25964 1
670 . 2 2 59 59 TRP CA C 13 58.240 0.05 . 1 . . . . 59 TRP CA . 25964 1
671 . 2 2 59 59 TRP CB C 13 30.120 0.05 . 1 . . . . 59 TRP CB . 25964 1
672 . 2 2 59 59 TRP N N 15 126.511 0.011 . 1 . . . . 59 TRP N . 25964 1
673 . 2 2 59 59 TRP NE1 N 15 128.671 0.05 . 1 . . . . 59 TRP NE1 . 25964 1
674 . 3 2 11 11 SER H H 1 8.225 0.002 . 1 . . . . 11 SER H . 25964 1
675 . 3 2 11 11 SER HA H 1 4.405 0.003 . 1 . . . . 11 SER HA . 25964 1
676 . 3 2 11 11 SER HB2 H 1 3.864 0.05 . 2 . . . . 11 SER HB2 . 25964 1
677 . 3 2 11 11 SER HB3 H 1 3.809 0.05 . 2 . . . . 11 SER HB3 . 25964 1
678 . 3 2 11 11 SER CA C 13 58.467 0.014 . 1 . . . . 11 SER CA . 25964 1
679 . 3 2 11 11 SER CB C 13 63.756 0.05 . 1 . . . . 11 SER CB . 25964 1
680 . 3 2 11 11 SER N N 15 115.987 0.02 . 1 . . . . 11 SER N . 25964 1
681 . 3 2 12 12 ALA H H 1 8.230 0.005 . 1 . . . . 12 ALA H . 25964 1
682 . 3 2 12 12 ALA HA H 1 4.330 0.003 . 1 . . . . 12 ALA HA . 25964 1
683 . 3 2 12 12 ALA HB1 H 1 1.382 0.002 . 1 . . . . 12 ALA HB1 . 25964 1
684 . 3 2 12 12 ALA HB2 H 1 1.382 0.002 . 1 . . . . 12 ALA HB2 . 25964 1
685 . 3 2 12 12 ALA HB3 H 1 1.382 0.002 . 1 . . . . 12 ALA HB3 . 25964 1
686 . 3 2 12 12 ALA CA C 13 52.775 0.018 . 1 . . . . 12 ALA CA . 25964 1
687 . 3 2 12 12 ALA CB C 13 19.243 0.05 . 1 . . . . 12 ALA CB . 25964 1
688 . 3 2 12 12 ALA N N 15 125.678 0.022 . 1 . . . . 12 ALA N . 25964 1
689 . 3 2 13 13 GLY H H 1 8.287 0.003 . 1 . . . . 13 GLY H . 25964 1
690 . 3 2 13 13 GLY HA2 H 1 3.943 0.005 . 2 . . . . 13 GLY HA2 . 25964 1
691 . 3 2 13 13 GLY HA3 H 1 3.947 0.05 . 2 . . . . 13 GLY HA3 . 25964 1
692 . 3 2 13 13 GLY CA C 13 45.480 0.188 . 1 . . . . 13 GLY CA . 25964 1
693 . 3 2 13 13 GLY N N 15 107.564 0.058 . 1 . . . . 13 GLY N . 25964 1
694 . 3 2 14 14 GLY H H 1 8.190 0.003 . 1 . . . . 14 GLY H . 25964 1
695 . 3 2 14 14 GLY HA2 H 1 3.879 0.004 . 2 . . . . 14 GLY HA2 . 25964 1
696 . 3 2 14 14 GLY HA3 H 1 3.887 0.05 . 2 . . . . 14 GLY HA3 . 25964 1
697 . 3 2 14 14 GLY CA C 13 45.052 0.05 . 1 . . . . 14 GLY CA . 25964 1
698 . 3 2 14 14 GLY N N 15 108.692 0.037 . 1 . . . . 14 GLY N . 25964 1
699 . 3 2 15 15 GLU H H 1 8.190 0.005 . 1 . . . . 15 GLU H . 25964 1
700 . 3 2 15 15 GLU HA H 1 4.358 0.003 . 1 . . . . 15 GLU HA . 25964 1
701 . 3 2 15 15 GLU HB2 H 1 1.970 0.005 . 2 . . . . 15 GLU HB2 . 25964 1
702 . 3 2 15 15 GLU HB3 H 1 1.860 0.002 . 2 . . . . 15 GLU HB3 . 25964 1
703 . 3 2 15 15 GLU HG2 H 1 2.184 0.003 . 2 . . . . 15 GLU HG2 . 25964 1
704 . 3 2 15 15 GLU HG3 H 1 2.101 0.005 . 2 . . . . 15 GLU HG3 . 25964 1
705 . 3 2 15 15 GLU CA C 13 55.723 0.049 . 1 . . . . 15 GLU CA . 25964 1
706 . 3 2 15 15 GLU CB C 13 31.173 0.012 . 1 . . . . 15 GLU CB . 25964 1
707 . 3 2 15 15 GLU CG C 13 36.080 0.05 . 1 . . . . 15 GLU CG . 25964 1
708 . 3 2 15 15 GLU N N 15 120.217 0.064 . 1 . . . . 15 GLU N . 25964 1
709 . 3 2 16 16 ILE H H 1 8.215 0.006 . 1 . . . . 16 ILE H . 25964 1
710 . 3 2 16 16 ILE HA H 1 3.917 0.012 . 1 . . . . 16 ILE HA . 25964 1
711 . 3 2 16 16 ILE HB H 1 1.300 0.006 . 1 . . . . 16 ILE HB . 25964 1
712 . 3 2 16 16 ILE HG12 H 1 0.545 0.02 . 1 . . . . 16 ILE HG12 . 25964 1
713 . 3 2 16 16 ILE HG21 H 1 -0.082 0.008 . 1 . . . . 16 ILE HG21 . 25964 1
714 . 3 2 16 16 ILE HG22 H 1 -0.082 0.008 . 1 . . . . 16 ILE HG22 . 25964 1
715 . 3 2 16 16 ILE HG23 H 1 -0.082 0.008 . 1 . . . . 16 ILE HG23 . 25964 1
716 . 3 2 16 16 ILE HD11 H 1 0.767 0.004 . 1 . . . . 16 ILE HD11 . 25964 1
717 . 3 2 16 16 ILE HD12 H 1 0.767 0.004 . 1 . . . . 16 ILE HD12 . 25964 1
718 . 3 2 16 16 ILE HD13 H 1 0.767 0.004 . 1 . . . . 16 ILE HD13 . 25964 1
719 . 3 2 16 16 ILE CA C 13 62.048 0.023 . 1 . . . . 16 ILE CA . 25964 1
720 . 3 2 16 16 ILE CB C 13 39.189 0.05 . 1 . . . . 16 ILE CB . 25964 1
721 . 3 2 16 16 ILE CG1 C 13 28.843 0.033 . 1 . . . . 16 ILE CG1 . 25964 1
722 . 3 2 16 16 ILE CG2 C 13 16.731 0.023 . 1 . . . . 16 ILE CG2 . 25964 1
723 . 3 2 16 16 ILE CD1 C 13 13.819 0.029 . 1 . . . . 16 ILE CD1 . 25964 1
724 . 3 2 16 16 ILE N N 15 123.922 0.087 . 1 . . . . 16 ILE N . 25964 1
725 . 3 2 17 17 VAL H H 1 8.805 0.008 . 1 . . . . 17 VAL H . 25964 1
726 . 3 2 17 17 VAL HA H 1 4.073 0.014 . 1 . . . . 17 VAL HA . 25964 1
727 . 3 2 17 17 VAL HB H 1 1.965 0.006 . 1 . . . . 17 VAL HB . 25964 1
728 . 3 2 17 17 VAL HG11 H 1 0.748 0.004 . 2 . . . . 17 VAL HG11 . 25964 1
729 . 3 2 17 17 VAL HG12 H 1 0.748 0.004 . 2 . . . . 17 VAL HG12 . 25964 1
730 . 3 2 17 17 VAL HG13 H 1 0.748 0.004 . 2 . . . . 17 VAL HG13 . 25964 1
731 . 3 2 17 17 VAL HG21 H 1 0.859 0.012 . 2 . . . . 17 VAL HG21 . 25964 1
732 . 3 2 17 17 VAL HG22 H 1 0.859 0.012 . 2 . . . . 17 VAL HG22 . 25964 1
733 . 3 2 17 17 VAL HG23 H 1 0.859 0.012 . 2 . . . . 17 VAL HG23 . 25964 1
734 . 3 2 17 17 VAL CA C 13 61.130 0.015 . 1 . . . . 17 VAL CA . 25964 1
735 . 3 2 17 17 VAL CB C 13 33.048 0.065 . 1 . . . . 17 VAL CB . 25964 1
736 . 3 2 17 17 VAL CG1 C 13 21.004 0.035 . 2 . . . . 17 VAL CG1 . 25964 1
737 . 3 2 17 17 VAL CG2 C 13 20.719 0.15 . 2 . . . . 17 VAL CG2 . 25964 1
738 . 3 2 17 17 VAL N N 15 129.973 0.157 . 1 . . . . 17 VAL N . 25964 1
739 . 3 2 18 18 TYR H H 1 8.372 0.007 . 1 . . . . 18 TYR H . 25964 1
740 . 3 2 18 18 TYR HA H 1 4.830 0.003 . 1 . . . . 18 TYR HA . 25964 1
741 . 3 2 18 18 TYR HB2 H 1 3.001 0.003 . 2 . . . . 18 TYR HB2 . 25964 1
742 . 3 2 18 18 TYR HB3 H 1 2.647 0.002 . 2 . . . . 18 TYR HB3 . 25964 1
743 . 3 2 18 18 TYR HD1 H 1 6.828 0.008 . 1 . . . . 18 TYR HD1 . 25964 1
744 . 3 2 18 18 TYR HD2 H 1 6.828 0.008 . 1 . . . . 18 TYR HD2 . 25964 1
745 . 3 2 18 18 TYR HE1 H 1 6.412 0.006 . 1 . . . . 18 TYR HE1 . 25964 1
746 . 3 2 18 18 TYR HE2 H 1 6.412 0.006 . 1 . . . . 18 TYR HE2 . 25964 1
747 . 3 2 18 18 TYR CA C 13 59.093 0.029 . 1 . . . . 18 TYR CA . 25964 1
748 . 3 2 18 18 TYR CB C 13 39.695 0.046 . 1 . . . . 18 TYR CB . 25964 1
749 . 3 2 18 18 TYR N N 15 125.361 0.099 . 1 . . . . 18 TYR N . 25964 1
750 . 3 2 19 19 LEU H H 1 8.353 0.006 . 1 . . . . 19 LEU H . 25964 1
751 . 3 2 19 19 LEU HA H 1 4.846 0.007 . 1 . . . . 19 LEU HA . 25964 1
752 . 3 2 19 19 LEU HB2 H 1 1.527 0.001 . 1 . . . . 19 LEU HB2 . 25964 1
753 . 3 2 19 19 LEU HB3 H 1 1.527 0.001 . 1 . . . . 19 LEU HB3 . 25964 1
754 . 3 2 19 19 LEU HG H 1 1.384 0.006 . 1 . . . . 19 LEU HG . 25964 1
755 . 3 2 19 19 LEU HD11 H 1 0.525 0.005 . 2 . . . . 19 LEU HD11 . 25964 1
756 . 3 2 19 19 LEU HD12 H 1 0.525 0.005 . 2 . . . . 19 LEU HD12 . 25964 1
757 . 3 2 19 19 LEU HD13 H 1 0.525 0.005 . 2 . . . . 19 LEU HD13 . 25964 1
758 . 3 2 19 19 LEU HD21 H 1 0.538 0.012 . 2 . . . . 19 LEU HD21 . 25964 1
759 . 3 2 19 19 LEU HD22 H 1 0.538 0.012 . 2 . . . . 19 LEU HD22 . 25964 1
760 . 3 2 19 19 LEU HD23 H 1 0.538 0.012 . 2 . . . . 19 LEU HD23 . 25964 1
761 . 3 2 19 19 LEU CA C 13 52.007 0.024 . 1 . . . . 19 LEU CA . 25964 1
762 . 3 2 19 19 LEU CB C 13 42.961 0.018 . 1 . . . . 19 LEU CB . 25964 1
763 . 3 2 19 19 LEU CG C 13 25.656 0.054 . 1 . . . . 19 LEU CG . 25964 1
764 . 3 2 19 19 LEU CD1 C 13 22.998 0.05 . 2 . . . . 19 LEU CD1 . 25964 1
765 . 3 2 19 19 LEU CD2 C 13 25.619 0.001 . 2 . . . . 19 LEU CD2 . 25964 1
766 . 3 2 19 19 LEU N N 15 119.671 0.039 . 1 . . . . 19 LEU N . 25964 1
767 . 3 2 20 20 PRO CA C 13 64.752 0.05 . 1 . . . . 20 PRO CA . 25964 1
768 . 3 2 21 21 ASN H H 1 8.891 0.003 . 1 . . . . 21 ASN H . 25964 1
769 . 3 2 21 21 ASN CA C 13 52.619 0.019 . 1 . . . . 21 ASN CA . 25964 1
770 . 3 2 21 21 ASN CB C 13 38.685 0.081 . 1 . . . . 21 ASN CB . 25964 1
771 . 3 2 21 21 ASN N N 15 113.558 0.051 . 1 . . . . 21 ASN N . 25964 1
772 . 3 2 22 22 LEU H H 1 6.989 0.009 . 1 . . . . 22 LEU H . 25964 1
773 . 3 2 22 22 LEU HA H 1 4.379 0.017 . 1 . . . . 22 LEU HA . 25964 1
774 . 3 2 22 22 LEU HB2 H 1 1.658 0.001 . 2 . . . . 22 LEU HB2 . 25964 1
775 . 3 2 22 22 LEU HB3 H 1 1.658 0.001 . 2 . . . . 22 LEU HB3 . 25964 1
776 . 3 2 22 22 LEU HG H 1 1.667 0.011 . 1 . . . . 22 LEU HG . 25964 1
777 . 3 2 22 22 LEU HD11 H 1 0.789 0.006 . 2 . . . . 22 LEU HD11 . 25964 1
778 . 3 2 22 22 LEU HD12 H 1 0.789 0.006 . 2 . . . . 22 LEU HD12 . 25964 1
779 . 3 2 22 22 LEU HD13 H 1 0.789 0.006 . 2 . . . . 22 LEU HD13 . 25964 1
780 . 3 2 22 22 LEU HD21 H 1 0.677 0.001 . 2 . . . . 22 LEU HD21 . 25964 1
781 . 3 2 22 22 LEU HD22 H 1 0.677 0.001 . 2 . . . . 22 LEU HD22 . 25964 1
782 . 3 2 22 22 LEU HD23 H 1 0.677 0.001 . 2 . . . . 22 LEU HD23 . 25964 1
783 . 3 2 22 22 LEU CA C 13 54.557 0.08 . 1 . . . . 22 LEU CA . 25964 1
784 . 3 2 22 22 LEU CB C 13 42.025 0.021 . 1 . . . . 22 LEU CB . 25964 1
785 . 3 2 22 22 LEU CG C 13 28.139 0.047 . 1 . . . . 22 LEU CG . 25964 1
786 . 3 2 22 22 LEU CD1 C 13 25.410 0.05 . 2 . . . . 22 LEU CD1 . 25964 1
787 . 3 2 22 22 LEU CD2 C 13 22.848 0.028 . 2 . . . . 22 LEU CD2 . 25964 1
788 . 3 2 22 22 LEU N N 15 120.545 0.076 . 1 . . . . 22 LEU N . 25964 1
789 . 3 2 23 23 ASN H H 1 8.826 0.008 . 1 . . . . 23 ASN H . 25964 1
790 . 3 2 23 23 ASN CA C 13 51.382 0.02 . 1 . . . . 23 ASN CA . 25964 1
791 . 3 2 23 23 ASN CB C 13 36.785 0.05 . 1 . . . . 23 ASN CB . 25964 1
792 . 3 2 23 23 ASN N N 15 121.659 0.077 . 1 . . . . 23 ASN N . 25964 1
793 . 3 2 24 24 PRO HA H 1 3.695 0.005 . 1 . . . . 24 PRO HA . 25964 1
794 . 3 2 24 24 PRO HB2 H 1 1.134 0.015 . 2 . . . . 24 PRO HB2 . 25964 1
795 . 3 2 24 24 PRO HB3 H 1 1.107 0.017 . 2 . . . . 24 PRO HB3 . 25964 1
796 . 3 2 24 24 PRO HG2 H 1 1.281 0.002 . 2 . . . . 24 PRO HG2 . 25964 1
797 . 3 2 24 24 PRO HG3 H 1 1.535 0.007 . 2 . . . . 24 PRO HG3 . 25964 1
798 . 3 2 24 24 PRO HD2 H 1 3.482 0.05 . 2 . . . . 24 PRO HD2 . 25964 1
799 . 3 2 24 24 PRO HD3 H 1 3.268 0.014 . 2 . . . . 24 PRO HD3 . 25964 1
800 . 3 2 24 24 PRO CA C 13 66.160 0.027 . 1 . . . . 24 PRO CA . 25964 1
801 . 3 2 24 24 PRO CB C 13 31.512 0.071 . 1 . . . . 24 PRO CB . 25964 1
802 . 3 2 24 24 PRO CG C 13 27.760 0.005 . 1 . . . . 24 PRO CG . 25964 1
803 . 3 2 24 24 PRO CD C 13 49.512 0.023 . 1 . . . . 24 PRO CD . 25964 1
804 . 3 2 25 25 ASP H H 1 7.860 0.003 . 1 . . . . 25 ASP H . 25964 1
805 . 3 2 25 25 ASP N N 15 116.663 0.013 . 1 . . . . 25 ASP N . 25964 1
806 . 3 2 27 27 LEU H H 1 8.501 0.004 . 1 . . . . 27 LEU H . 25964 1
807 . 3 2 27 27 LEU HA H 1 4.029 0.05 . 1 . . . . 27 LEU HA . 25964 1
808 . 3 2 27 27 LEU HB2 H 1 1.662 0.009 . 2 . . . . 27 LEU HB2 . 25964 1
809 . 3 2 27 27 LEU HB3 H 1 1.195 0.011 . 2 . . . . 27 LEU HB3 . 25964 1
810 . 3 2 27 27 LEU HG H 1 1.523 0.005 . 1 . . . . 27 LEU HG . 25964 1
811 . 3 2 27 27 LEU HD11 H 1 0.808 0.005 . 2 . . . . 27 LEU HD11 . 25964 1
812 . 3 2 27 27 LEU HD12 H 1 0.808 0.005 . 2 . . . . 27 LEU HD12 . 25964 1
813 . 3 2 27 27 LEU HD13 H 1 0.808 0.005 . 2 . . . . 27 LEU HD13 . 25964 1
814 . 3 2 27 27 LEU HD21 H 1 0.846 0.007 . 2 . . . . 27 LEU HD21 . 25964 1
815 . 3 2 27 27 LEU HD22 H 1 0.846 0.007 . 2 . . . . 27 LEU HD22 . 25964 1
816 . 3 2 27 27 LEU HD23 H 1 0.846 0.007 . 2 . . . . 27 LEU HD23 . 25964 1
817 . 3 2 27 27 LEU CA C 13 58.206 0.05 . 1 . . . . 27 LEU CA . 25964 1
818 . 3 2 27 27 LEU CB C 13 42.288 0.017 . 1 . . . . 27 LEU CB . 25964 1
819 . 3 2 27 27 LEU CG C 13 27.154 0.034 . 1 . . . . 27 LEU CG . 25964 1
820 . 3 2 27 27 LEU CD1 C 13 25.493 0.039 . 2 . . . . 27 LEU CD1 . 25964 1
821 . 3 2 27 27 LEU CD2 C 13 25.057 0.013 . 2 . . . . 27 LEU CD2 . 25964 1
822 . 3 2 27 27 LEU N N 15 121.194 0.037 . 1 . . . . 27 LEU N . 25964 1
823 . 3 2 29 29 ALA H H 1 8.033 0.005 . 1 . . . . 29 ALA H . 25964 1
824 . 3 2 29 29 ALA HA H 1 4.224 0.003 . 1 . . . . 29 ALA HA . 25964 1
825 . 3 2 29 29 ALA HB1 H 1 1.476 0.001 . 1 . . . . 29 ALA HB1 . 25964 1
826 . 3 2 29 29 ALA HB2 H 1 1.476 0.001 . 1 . . . . 29 ALA HB2 . 25964 1
827 . 3 2 29 29 ALA HB3 H 1 1.476 0.001 . 1 . . . . 29 ALA HB3 . 25964 1
828 . 3 2 29 29 ALA CA C 13 55.500 0.017 . 1 . . . . 29 ALA CA . 25964 1
829 . 3 2 29 29 ALA CB C 13 17.764 0.071 . 1 . . . . 29 ALA CB . 25964 1
830 . 3 2 29 29 ALA N N 15 122.061 0.033 . 1 . . . . 29 ALA N . 25964 1
831 . 3 2 30 30 PHE H H 1 7.816 0.006 . 1 . . . . 30 PHE H . 25964 1
832 . 3 2 30 30 PHE HA H 1 4.524 0.002 . 1 . . . . 30 PHE HA . 25964 1
833 . 3 2 30 30 PHE HB2 H 1 3.222 0.001 . 1 . . . . 30 PHE HB2 . 25964 1
834 . 3 2 30 30 PHE HB3 H 1 3.222 0.001 . 1 . . . . 30 PHE HB3 . 25964 1
835 . 3 2 30 30 PHE HD1 H 1 7.194 0.05 . 1 . . . . 30 PHE HD1 . 25964 1
836 . 3 2 30 30 PHE HD2 H 1 7.194 0.05 . 1 . . . . 30 PHE HD2 . 25964 1
837 . 3 2 30 30 PHE CA C 13 60.936 0.033 . 1 . . . . 30 PHE CA . 25964 1
838 . 3 2 30 30 PHE CB C 13 38.532 0.039 . 1 . . . . 30 PHE CB . 25964 1
839 . 3 2 30 30 PHE N N 15 120.013 0.075 . 1 . . . . 30 PHE N . 25964 1
840 . 3 2 31 31 ILE H H 1 8.369 0.004 . 1 . . . . 31 ILE H . 25964 1
841 . 3 2 31 31 ILE HA H 1 3.245 0.006 . 1 . . . . 31 ILE HA . 25964 1
842 . 3 2 31 31 ILE HB H 1 1.747 0.008 . 1 . . . . 31 ILE HB . 25964 1
843 . 3 2 31 31 ILE HG12 H 1 1.364 0.01 . 2 . . . . 31 ILE HG12 . 25964 1
844 . 3 2 31 31 ILE HG13 H 1 0.255 0.022 . 2 . . . . 31 ILE HG13 . 25964 1
845 . 3 2 31 31 ILE HG21 H 1 0.533 0.006 . 1 . . . . 31 ILE HG21 . 25964 1
846 . 3 2 31 31 ILE HG22 H 1 0.533 0.006 . 1 . . . . 31 ILE HG22 . 25964 1
847 . 3 2 31 31 ILE HG23 H 1 0.533 0.006 . 1 . . . . 31 ILE HG23 . 25964 1
848 . 3 2 31 31 ILE HD11 H 1 0.262 0.006 . 1 . . . . 31 ILE HD11 . 25964 1
849 . 3 2 31 31 ILE HD12 H 1 0.262 0.006 . 1 . . . . 31 ILE HD12 . 25964 1
850 . 3 2 31 31 ILE HD13 H 1 0.262 0.006 . 1 . . . . 31 ILE HD13 . 25964 1
851 . 3 2 31 31 ILE CA C 13 65.109 0.054 . 1 . . . . 31 ILE CA . 25964 1
852 . 3 2 31 31 ILE CB C 13 38.004 0.098 . 1 . . . . 31 ILE CB . 25964 1
853 . 3 2 31 31 ILE CG1 C 13 28.968 0.06 . 1 . . . . 31 ILE CG1 . 25964 1
854 . 3 2 31 31 ILE CG2 C 13 17.909 0.023 . 1 . . . . 31 ILE CG2 . 25964 1
855 . 3 2 31 31 ILE CD1 C 13 14.320 0.12 . 1 . . . . 31 ILE CD1 . 25964 1
856 . 3 2 31 31 ILE N N 15 120.226 0.06 . 1 . . . . 31 ILE N . 25964 1
857 . 3 2 32 32 HIS H H 1 8.277 0.006 . 1 . . . . 32 HIS H . 25964 1
858 . 3 2 32 32 HIS CA C 13 60.926 0.018 . 1 . . . . 32 HIS CA . 25964 1
859 . 3 2 32 32 HIS CB C 13 28.791 0.082 . 1 . . . . 32 HIS CB . 25964 1
860 . 3 2 32 32 HIS N N 15 117.219 0.041 . 1 . . . . 32 HIS N . 25964 1
861 . 3 2 33 33 SER H H 1 8.502 0.004 . 1 . . . . 33 SER H . 25964 1
862 . 3 2 33 33 SER CA C 13 62.823 0.027 . 1 . . . . 33 SER CA . 25964 1
863 . 3 2 33 33 SER N N 15 116.942 0.06 . 1 . . . . 33 SER N . 25964 1
864 . 3 2 34 34 ILE H H 1 7.996 0.007 . 1 . . . . 34 ILE H . 25964 1
865 . 3 2 34 34 ILE HA H 1 3.632 0.008 . 1 . . . . 34 ILE HA . 25964 1
866 . 3 2 34 34 ILE HB H 1 1.859 0.008 . 1 . . . . 34 ILE HB . 25964 1
867 . 3 2 34 34 ILE HG12 H 1 1.055 0.008 . 2 . . . . 34 ILE HG12 . 25964 1
868 . 3 2 34 34 ILE HG13 H 1 1.286 0.007 . 2 . . . . 34 ILE HG13 . 25964 1
869 . 3 2 34 34 ILE HG21 H 1 0.784 0.004 . 1 . . . . 34 ILE HG21 . 25964 1
870 . 3 2 34 34 ILE HG22 H 1 0.784 0.004 . 1 . . . . 34 ILE HG22 . 25964 1
871 . 3 2 34 34 ILE HG23 H 1 0.784 0.004 . 1 . . . . 34 ILE HG23 . 25964 1
872 . 3 2 34 34 ILE HD11 H 1 0.656 0.005 . 1 . . . . 34 ILE HD11 . 25964 1
873 . 3 2 34 34 ILE HD12 H 1 0.656 0.005 . 1 . . . . 34 ILE HD12 . 25964 1
874 . 3 2 34 34 ILE HD13 H 1 0.656 0.005 . 1 . . . . 34 ILE HD13 . 25964 1
875 . 3 2 34 34 ILE CA C 13 63.578 0.063 . 1 . . . . 34 ILE CA . 25964 1
876 . 3 2 34 34 ILE CB C 13 37.218 0.096 . 1 . . . . 34 ILE CB . 25964 1
877 . 3 2 34 34 ILE CG1 C 13 28.625 0.028 . 1 . . . . 34 ILE CG1 . 25964 1
878 . 3 2 34 34 ILE CG2 C 13 17.697 0.021 . 1 . . . . 34 ILE CG2 . 25964 1
879 . 3 2 34 34 ILE CD1 C 13 12.966 0.034 . 1 . . . . 34 ILE CD1 . 25964 1
880 . 3 2 34 34 ILE N N 15 120.745 0.073 . 1 . . . . 34 ILE N . 25964 1
881 . 3 2 35 35 HIS H H 1 7.454 0.007 . 1 . . . . 35 HIS H . 25964 1
882 . 3 2 35 35 HIS HA H 1 4.170 0.004 . 1 . . . . 35 HIS HA . 25964 1
883 . 3 2 35 35 HIS HB2 H 1 3.250 0.009 . 2 . . . . 35 HIS HB2 . 25964 1
884 . 3 2 35 35 HIS HB3 H 1 3.338 0.006 . 2 . . . . 35 HIS HB3 . 25964 1
885 . 3 2 35 35 HIS CA C 13 59.550 0.035 . 1 . . . . 35 HIS CA . 25964 1
886 . 3 2 35 35 HIS CB C 13 29.325 0.014 . 1 . . . . 35 HIS CB . 25964 1
887 . 3 2 35 35 HIS N N 15 117.919 0.055 . 1 . . . . 35 HIS N . 25964 1
888 . 3 2 36 36 ASP H H 1 8.376 0.005 . 1 . . . . 36 ASP H . 25964 1
889 . 3 2 36 36 ASP CA C 13 56.414 0.012 . 1 . . . . 36 ASP CA . 25964 1
890 . 3 2 36 36 ASP CB C 13 40.729 0.05 . 1 . . . . 36 ASP CB . 25964 1
891 . 3 2 36 36 ASP N N 15 117.968 0.053 . 1 . . . . 36 ASP N . 25964 1
892 . 3 2 37 37 ASP H H 1 7.458 0.004 . 1 . . . . 37 ASP H . 25964 1
893 . 3 2 37 37 ASP CA C 13 51.598 0.013 . 1 . . . . 37 ASP CA . 25964 1
894 . 3 2 37 37 ASP CB C 13 40.401 0.05 . 1 . . . . 37 ASP CB . 25964 1
895 . 3 2 37 37 ASP N N 15 115.399 0.034 . 1 . . . . 37 ASP N . 25964 1
896 . 3 2 38 38 PRO CA C 13 64.522 0.05 . 1 . . . . 38 PRO CA . 25964 1
897 . 3 2 39 39 SER H H 1 8.534 0.003 . 1 . . . . 39 SER H . 25964 1
898 . 3 2 39 39 SER CA C 13 61.602 0.064 . 1 . . . . 39 SER CA . 25964 1
899 . 3 2 39 39 SER CB C 13 62.460 0.048 . 1 . . . . 39 SER CB . 25964 1
900 . 3 2 39 39 SER N N 15 115.483 0.031 . 1 . . . . 39 SER N . 25964 1
901 . 3 2 40 40 GLN H H 1 7.854 0.003 . 1 . . . . 40 GLN H . 25964 1
902 . 3 2 40 40 GLN CA C 13 54.806 0.021 . 1 . . . . 40 GLN CA . 25964 1
903 . 3 2 40 40 GLN CB C 13 28.309 0.009 . 1 . . . . 40 GLN CB . 25964 1
904 . 3 2 40 40 GLN N N 15 120.498 0.065 . 1 . . . . 40 GLN N . 25964 1
905 . 3 2 41 41 SER H H 1 7.835 0.004 . 1 . . . . 41 SER H . 25964 1
906 . 3 2 41 41 SER CA C 13 64.317 0.047 . 1 . . . . 41 SER CA . 25964 1
907 . 3 2 41 41 SER N N 15 115.901 0.056 . 1 . . . . 41 SER N . 25964 1
908 . 3 2 42 42 ALA H H 1 8.819 0.006 . 1 . . . . 42 ALA H . 25964 1
909 . 3 2 42 42 ALA HA H 1 4.030 0.011 . 1 . . . . 42 ALA HA . 25964 1
910 . 3 2 42 42 ALA HB1 H 1 1.394 0.008 . 1 . . . . 42 ALA HB1 . 25964 1
911 . 3 2 42 42 ALA HB2 H 1 1.394 0.008 . 1 . . . . 42 ALA HB2 . 25964 1
912 . 3 2 42 42 ALA HB3 H 1 1.394 0.008 . 1 . . . . 42 ALA HB3 . 25964 1
913 . 3 2 42 42 ALA CA C 13 55.897 0.019 . 1 . . . . 42 ALA CA . 25964 1
914 . 3 2 42 42 ALA CB C 13 17.900 0.035 . 1 . . . . 42 ALA CB . 25964 1
915 . 3 2 42 42 ALA N N 15 122.402 0.083 . 1 . . . . 42 ALA N . 25964 1
916 . 3 2 43 43 ASN H H 1 8.033 0.004 . 1 . . . . 43 ASN H . 25964 1
917 . 3 2 43 43 ASN CA C 13 55.957 0.032 . 1 . . . . 43 ASN CA . 25964 1
918 . 3 2 43 43 ASN CB C 13 38.044 0.057 . 1 . . . . 43 ASN CB . 25964 1
919 . 3 2 43 43 ASN N N 15 118.830 0.04 . 1 . . . . 43 ASN N . 25964 1
920 . 3 2 44 44 LEU H H 1 8.885 0.006 . 1 . . . . 44 LEU H . 25964 1
921 . 3 2 44 44 LEU HB2 H 1 1.420 0.018 . 2 . . . . 44 LEU HB2 . 25964 1
922 . 3 2 44 44 LEU HB3 H 1 1.950 0.008 . 2 . . . . 44 LEU HB3 . 25964 1
923 . 3 2 44 44 LEU HG H 1 1.864 0.007 . 1 . . . . 44 LEU HG . 25964 1
924 . 3 2 44 44 LEU HD11 H 1 1.001 0.008 . 2 . . . . 44 LEU HD11 . 25964 1
925 . 3 2 44 44 LEU HD12 H 1 1.001 0.008 . 2 . . . . 44 LEU HD12 . 25964 1
926 . 3 2 44 44 LEU HD13 H 1 1.001 0.008 . 2 . . . . 44 LEU HD13 . 25964 1
927 . 3 2 44 44 LEU HD21 H 1 0.733 0.008 . 2 . . . . 44 LEU HD21 . 25964 1
928 . 3 2 44 44 LEU HD22 H 1 0.733 0.008 . 2 . . . . 44 LEU HD22 . 25964 1
929 . 3 2 44 44 LEU HD23 H 1 0.733 0.008 . 2 . . . . 44 LEU HD23 . 25964 1
930 . 3 2 44 44 LEU CA C 13 57.937 0.022 . 1 . . . . 44 LEU CA . 25964 1
931 . 3 2 44 44 LEU CB C 13 42.259 0.064 . 1 . . . . 44 LEU CB . 25964 1
932 . 3 2 44 44 LEU CG C 13 27.346 0.05 . 1 . . . . 44 LEU CG . 25964 1
933 . 3 2 44 44 LEU CD1 C 13 22.798 0.039 . 2 . . . . 44 LEU CD1 . 25964 1
934 . 3 2 44 44 LEU CD2 C 13 26.254 0.014 . 2 . . . . 44 LEU CD2 . 25964 1
935 . 3 2 44 44 LEU N N 15 121.174 0.052 . 1 . . . . 44 LEU N . 25964 1
936 . 3 2 45 45 LEU H H 1 8.727 0.005 . 1 . . . . 45 LEU H . 25964 1
937 . 3 2 45 45 LEU HA H 1 4.167 0.006 . 1 . . . . 45 LEU HA . 25964 1
938 . 3 2 45 45 LEU HB2 H 1 1.966 0.007 . 2 . . . . 45 LEU HB2 . 25964 1
939 . 3 2 45 45 LEU HB3 H 1 1.539 0.003 . 2 . . . . 45 LEU HB3 . 25964 1
940 . 3 2 45 45 LEU HG H 1 1.675 0.005 . 1 . . . . 45 LEU HG . 25964 1
941 . 3 2 45 45 LEU HD11 H 1 0.809 0.006 . 2 . . . . 45 LEU HD11 . 25964 1
942 . 3 2 45 45 LEU HD12 H 1 0.809 0.006 . 2 . . . . 45 LEU HD12 . 25964 1
943 . 3 2 45 45 LEU HD13 H 1 0.809 0.006 . 2 . . . . 45 LEU HD13 . 25964 1
944 . 3 2 45 45 LEU HD21 H 1 0.830 0.002 . 2 . . . . 45 LEU HD21 . 25964 1
945 . 3 2 45 45 LEU HD22 H 1 0.830 0.002 . 2 . . . . 45 LEU HD22 . 25964 1
946 . 3 2 45 45 LEU HD23 H 1 0.830 0.002 . 2 . . . . 45 LEU HD23 . 25964 1
947 . 3 2 45 45 LEU CA C 13 57.815 0.049 . 1 . . . . 45 LEU CA . 25964 1
948 . 3 2 45 45 LEU CB C 13 41.852 0.053 . 1 . . . . 45 LEU CB . 25964 1
949 . 3 2 45 45 LEU CG C 13 27.178 0.042 . 1 . . . . 45 LEU CG . 25964 1
950 . 3 2 45 45 LEU CD1 C 13 25.797 0.02 . 2 . . . . 45 LEU CD1 . 25964 1
951 . 3 2 45 45 LEU CD2 C 13 23.870 0.026 . 2 . . . . 45 LEU CD2 . 25964 1
952 . 3 2 45 45 LEU N N 15 121.566 0.083 . 1 . . . . 45 LEU N . 25964 1
953 . 3 2 46 46 ALA H H 1 7.852 0.004 . 1 . . . . 46 ALA H . 25964 1
954 . 3 2 46 46 ALA CA C 13 55.377 0.006 . 1 . . . . 46 ALA CA . 25964 1
955 . 3 2 46 46 ALA CB C 13 17.652 0.05 . 1 . . . . 46 ALA CB . 25964 1
956 . 3 2 46 46 ALA N N 15 121.725 0.08 . 1 . . . . 46 ALA N . 25964 1
957 . 3 2 47 47 GLU H H 1 8.097 0.003 . 1 . . . . 47 GLU H . 25964 1
958 . 3 2 47 47 GLU CA C 13 59.037 0.001 . 1 . . . . 47 GLU CA . 25964 1
959 . 3 2 47 47 GLU CB C 13 29.481 0.007 . 1 . . . . 47 GLU CB . 25964 1
960 . 3 2 47 47 GLU N N 15 118.848 0.043 . 1 . . . . 47 GLU N . 25964 1
961 . 3 2 48 48 ALA H H 1 8.155 0.004 . 1 . . . . 48 ALA H . 25964 1
962 . 3 2 48 48 ALA HA H 1 3.993 0.013 . 1 . . . . 48 ALA HA . 25964 1
963 . 3 2 48 48 ALA HB1 H 1 0.786 0.005 . 1 . . . . 48 ALA HB1 . 25964 1
964 . 3 2 48 48 ALA HB2 H 1 0.786 0.005 . 1 . . . . 48 ALA HB2 . 25964 1
965 . 3 2 48 48 ALA HB3 H 1 0.786 0.005 . 1 . . . . 48 ALA HB3 . 25964 1
966 . 3 2 48 48 ALA CA C 13 54.992 0.025 . 1 . . . . 48 ALA CA . 25964 1
967 . 3 2 48 48 ALA CB C 13 16.801 0.02 . 1 . . . . 48 ALA CB . 25964 1
968 . 3 2 48 48 ALA N N 15 125.024 0.015 . 1 . . . . 48 ALA N . 25964 1
969 . 3 2 49 49 LYS H H 1 8.458 0.006 . 1 . . . . 49 LYS H . 25964 1
970 . 3 2 49 49 LYS HA H 1 3.671 0.005 . 1 . . . . 49 LYS HA . 25964 1
971 . 3 2 49 49 LYS HB2 H 1 2.008 0.007 . 2 . . . . 49 LYS HB2 . 25964 1
972 . 3 2 49 49 LYS HB3 H 1 1.676 0.005 . 2 . . . . 49 LYS HB3 . 25964 1
973 . 3 2 49 49 LYS HG2 H 1 1.455 0.009 . 2 . . . . 49 LYS HG2 . 25964 1
974 . 3 2 49 49 LYS HG3 H 1 1.455 0.009 . 2 . . . . 49 LYS HG3 . 25964 1
975 . 3 2 49 49 LYS HD2 H 1 1.607 0.005 . 2 . . . . 49 LYS HD2 . 25964 1
976 . 3 2 49 49 LYS HD3 H 1 1.742 0.004 . 2 . . . . 49 LYS HD3 . 25964 1
977 . 3 2 49 49 LYS HE2 H 1 3.059 0.022 . 2 . . . . 49 LYS HE2 . 25964 1
978 . 3 2 49 49 LYS HE3 H 1 3.033 0.016 . 2 . . . . 49 LYS HE3 . 25964 1
979 . 3 2 49 49 LYS CA C 13 58.796 0.05 . 1 . . . . 49 LYS CA . 25964 1
980 . 3 2 49 49 LYS CB C 13 32.153 0.034 . 1 . . . . 49 LYS CB . 25964 1
981 . 3 2 49 49 LYS CG C 13 25.093 0.024 . 1 . . . . 49 LYS CG . 25964 1
982 . 3 2 49 49 LYS CD C 13 29.331 0.109 . 1 . . . . 49 LYS CD . 25964 1
983 . 3 2 49 49 LYS CE C 13 42.183 0.002 . 1 . . . . 49 LYS CE . 25964 1
984 . 3 2 49 49 LYS N N 15 119.579 0.055 . 1 . . . . 49 LYS N . 25964 1
985 . 3 2 50 50 LYS H H 1 7.739 0.005 . 1 . . . . 50 LYS H . 25964 1
986 . 3 2 50 50 LYS CA C 13 59.801 0.05 . 1 . . . . 50 LYS CA . 25964 1
987 . 3 2 50 50 LYS CB C 13 32.380 0.022 . 1 . . . . 50 LYS CB . 25964 1
988 . 3 2 50 50 LYS N N 15 120.216 0.064 . 1 . . . . 50 LYS N . 25964 1
989 . 3 2 51 51 LEU H H 1 7.912 0.007 . 1 . . . . 51 LEU H . 25964 1
990 . 3 2 51 51 LEU HA H 1 4.119 0.05 . 1 . . . . 51 LEU HA . 25964 1
991 . 3 2 51 51 LEU HB2 H 1 1.528 0.005 . 2 . . . . 51 LEU HB2 . 25964 1
992 . 3 2 51 51 LEU HB3 H 1 1.867 0.005 . 2 . . . . 51 LEU HB3 . 25964 1
993 . 3 2 51 51 LEU HG H 1 1.327 0.006 . 1 . . . . 51 LEU HG . 25964 1
994 . 3 2 51 51 LEU HD11 H 1 0.846 0.05 . 2 . . . . 51 LEU HD11 . 25964 1
995 . 3 2 51 51 LEU HD12 H 1 0.846 0.05 . 2 . . . . 51 LEU HD12 . 25964 1
996 . 3 2 51 51 LEU HD13 H 1 0.846 0.05 . 2 . . . . 51 LEU HD13 . 25964 1
997 . 3 2 51 51 LEU HD21 H 1 0.861 0.05 . 2 . . . . 51 LEU HD21 . 25964 1
998 . 3 2 51 51 LEU HD22 H 1 0.861 0.05 . 2 . . . . 51 LEU HD22 . 25964 1
999 . 3 2 51 51 LEU HD23 H 1 0.861 0.05 . 2 . . . . 51 LEU HD23 . 25964 1
1000 . 3 2 51 51 LEU CA C 13 57.630 0.023 . 1 . . . . 51 LEU CA . 25964 1
1001 . 3 2 51 51 LEU CB C 13 41.798 0.039 . 1 . . . . 51 LEU CB . 25964 1
1002 . 3 2 51 51 LEU CG C 13 26.722 0.05 . 1 . . . . 51 LEU CG . 25964 1
1003 . 3 2 51 51 LEU CD1 C 13 25.341 0.05 . 2 . . . . 51 LEU CD1 . 25964 1
1004 . 3 2 51 51 LEU CD2 C 13 22.967 0.05 . 2 . . . . 51 LEU CD2 . 25964 1
1005 . 3 2 51 51 LEU N N 15 122.928 0.071 . 1 . . . . 51 LEU N . 25964 1
1006 . 3 2 52 52 ASN H H 1 8.606 0.007 . 1 . . . . 52 ASN H . 25964 1
1007 . 3 2 52 52 ASN CA C 13 58.008 0.031 . 1 . . . . 52 ASN CA . 25964 1
1008 . 3 2 52 52 ASN CB C 13 41.190 0.05 . 1 . . . . 52 ASN CB . 25964 1
1009 . 3 2 52 52 ASN N N 15 117.510 0.064 . 1 . . . . 52 ASN N . 25964 1
1010 . 3 2 53 53 ASP H H 1 8.339 0.005 . 1 . . . . 53 ASP H . 25964 1
1011 . 3 2 53 53 ASP CA C 13 56.834 0.006 . 1 . . . . 53 ASP CA . 25964 1
1012 . 3 2 53 53 ASP CB C 13 39.808 0.05 . 1 . . . . 53 ASP CB . 25964 1
1013 . 3 2 53 53 ASP N N 15 119.628 0.056 . 1 . . . . 53 ASP N . 25964 1
1014 . 3 2 54 54 ALA H H 1 8.067 0.004 . 1 . . . . 54 ALA H . 25964 1
1015 . 3 2 54 54 ALA CA C 13 54.137 0.019 . 1 . . . . 54 ALA CA . 25964 1
1016 . 3 2 54 54 ALA CB C 13 18.418 0.039 . 1 . . . . 54 ALA CB . 25964 1
1017 . 3 2 54 54 ALA N N 15 123.292 0.036 . 1 . . . . 54 ALA N . 25964 1
1018 . 3 2 55 55 GLN H H 1 7.460 0.002 . 1 . . . . 55 GLN H . 25964 1
1019 . 3 2 55 55 GLN HA H 1 4.964 0.05 . 1 . . . . 55 GLN HA . 25964 1
1020 . 3 2 55 55 GLN CA C 13 54.955 0.041 . 1 . . . . 55 GLN CA . 25964 1
1021 . 3 2 55 55 GLN CB C 13 28.371 0.054 . 1 . . . . 55 GLN CB . 25964 1
1022 . 3 2 55 55 GLN N N 15 115.268 0.055 . 1 . . . . 55 GLN N . 25964 1
1023 . 3 2 56 56 ALA H H 1 7.156 0.002 . 1 . . . . 56 ALA H . 25964 1
1024 . 3 2 56 56 ALA CA C 13 50.913 0.05 . 1 . . . . 56 ALA CA . 25964 1
1025 . 3 2 56 56 ALA CB C 13 17.863 0.05 . 1 . . . . 56 ALA CB . 25964 1
1026 . 3 2 56 56 ALA N N 15 124.302 0.048 . 1 . . . . 56 ALA N . 25964 1
1027 . 3 2 57 57 PRO CA C 13 62.885 0.008 . 1 . . . . 57 PRO CA . 25964 1
1028 . 3 2 57 57 PRO CB C 13 31.899 0.05 . 1 . . . . 57 PRO CB . 25964 1
1029 . 3 2 58 58 LYS H H 1 8.191 0.003 . 1 . . . . 58 LYS H . 25964 1
1030 . 3 2 58 58 LYS HA H 1 4.250 0.008 . 1 . . . . 58 LYS HA . 25964 1
1031 . 3 2 58 58 LYS CA C 13 55.707 0.007 . 1 . . . . 58 LYS CA . 25964 1
1032 . 3 2 58 58 LYS CB C 13 33.031 0.003 . 1 . . . . 58 LYS CB . 25964 1
1033 . 3 2 58 58 LYS N N 15 122.070 0.082 . 1 . . . . 58 LYS N . 25964 1
1034 . 3 2 59 59 TRP H H 1 7.583 0.002 . 1 . . . . 59 TRP H . 25964 1
1035 . 3 2 59 59 TRP HA H 1 4.516 0.05 . 1 . . . . 59 TRP HA . 25964 1
1036 . 3 2 59 59 TRP HE1 H 1 10.036 0.05 . 1 . . . . 59 TRP HE1 . 25964 1
1037 . 3 2 59 59 TRP CA C 13 58.242 0.002 . 1 . . . . 59 TRP CA . 25964 1
1038 . 3 2 59 59 TRP CB C 13 30.120 0.05 . 1 . . . . 59 TRP CB . 25964 1
1039 . 3 2 59 59 TRP N N 15 126.633 0.12 . 1 . . . . 59 TRP N . 25964 1
1040 . 3 2 59 59 TRP NE1 N 15 128.671 0.05 . 1 . . . . 59 TRP NE1 . 25964 1
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