###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11316
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11316 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11316 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $XWINNMR . . 11316 1
2 $NMRPipe . . 11316 1
3 $NMRView . . 11316 1
4 $Kujira . . 11316 1
5 $CYANA . . 11316 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 8 8 ARG HA H 1 4.379 0.030 . 1 . . . . 8 ARG HA . 11316 1
2 . 1 1 8 8 ARG HB2 H 1 1.718 0.030 . 2 . . . . 8 ARG HB2 . 11316 1
3 . 1 1 8 8 ARG HB3 H 1 1.818 0.030 . 2 . . . . 8 ARG HB3 . 11316 1
4 . 1 1 8 8 ARG HD2 H 1 3.161 0.030 . 1 . . . . 8 ARG HD2 . 11316 1
5 . 1 1 8 8 ARG HD3 H 1 3.161 0.030 . 1 . . . . 8 ARG HD3 . 11316 1
6 . 1 1 8 8 ARG HG2 H 1 1.561 0.030 . 1 . . . . 8 ARG HG2 . 11316 1
7 . 1 1 8 8 ARG HG3 H 1 1.561 0.030 . 1 . . . . 8 ARG HG3 . 11316 1
8 . 1 1 8 8 ARG CA C 13 56.001 0.300 . 1 . . . . 8 ARG CA . 11316 1
9 . 1 1 8 8 ARG CB C 13 30.879 0.300 . 1 . . . . 8 ARG CB . 11316 1
10 . 1 1 8 8 ARG CD C 13 43.326 0.300 . 1 . . . . 8 ARG CD . 11316 1
11 . 1 1 8 8 ARG CG C 13 27.053 0.300 . 1 . . . . 8 ARG CG . 11316 1
12 . 1 1 9 9 THR HA H 1 4.295 0.030 . 1 . . . . 9 THR HA . 11316 1
13 . 1 1 9 9 THR HB H 1 4.143 0.030 . 1 . . . . 9 THR HB . 11316 1
14 . 1 1 9 9 THR HG21 H 1 1.124 0.030 . 1 . . . . 9 THR HG2 . 11316 1
15 . 1 1 9 9 THR HG22 H 1 1.124 0.030 . 1 . . . . 9 THR HG2 . 11316 1
16 . 1 1 9 9 THR HG23 H 1 1.124 0.030 . 1 . . . . 9 THR HG2 . 11316 1
17 . 1 1 9 9 THR CA C 13 61.906 0.300 . 1 . . . . 9 THR CA . 11316 1
18 . 1 1 9 9 THR CB C 13 69.905 0.300 . 1 . . . . 9 THR CB . 11316 1
19 . 1 1 9 9 THR CG2 C 13 21.548 0.300 . 1 . . . . 9 THR CG2 . 11316 1
20 . 1 1 10 10 HIS H H 1 8.179 0.030 . 1 . . . . 10 HIS H . 11316 1
21 . 1 1 10 10 HIS HA H 1 4.648 0.030 . 1 . . . . 10 HIS HA . 11316 1
22 . 1 1 10 10 HIS HB2 H 1 3.113 0.030 . 2 . . . . 10 HIS HB2 . 11316 1
23 . 1 1 10 10 HIS HB3 H 1 3.033 0.030 . 2 . . . . 10 HIS HB3 . 11316 1
24 . 1 1 10 10 HIS HD2 H 1 6.967 0.030 . 1 . . . . 10 HIS HD2 . 11316 1
25 . 1 1 10 10 HIS HE1 H 1 7.758 0.030 . 1 . . . . 10 HIS HE1 . 11316 1
26 . 1 1 10 10 HIS CA C 13 56.400 0.300 . 1 . . . . 10 HIS CA . 11316 1
27 . 1 1 10 10 HIS CB C 13 31.255 0.300 . 1 . . . . 10 HIS CB . 11316 1
28 . 1 1 10 10 HIS CD2 C 13 119.872 0.300 . 1 . . . . 10 HIS CD2 . 11316 1
29 . 1 1 10 10 HIS CE1 C 13 138.491 0.300 . 1 . . . . 10 HIS CE1 . 11316 1
30 . 1 1 10 10 HIS N N 15 122.991 0.300 . 1 . . . . 10 HIS N . 11316 1
31 . 1 1 11 11 SER HA H 1 4.374 0.030 . 1 . . . . 11 SER HA . 11316 1
32 . 1 1 11 11 SER HB2 H 1 3.824 0.030 . 1 . . . . 11 SER HB2 . 11316 1
33 . 1 1 11 11 SER HB3 H 1 3.824 0.030 . 1 . . . . 11 SER HB3 . 11316 1
34 . 1 1 11 11 SER C C 13 174.938 0.300 . 1 . . . . 11 SER C . 11316 1
35 . 1 1 11 11 SER CA C 13 59.017 0.300 . 1 . . . . 11 SER CA . 11316 1
36 . 1 1 11 11 SER CB C 13 63.579 0.300 . 1 . . . . 11 SER CB . 11316 1
37 . 1 1 12 12 GLY H H 1 8.450 0.030 . 1 . . . . 12 GLY H . 11316 1
38 . 1 1 12 12 GLY HA2 H 1 3.910 0.030 . 1 . . . . 12 GLY HA2 . 11316 1
39 . 1 1 12 12 GLY HA3 H 1 3.910 0.030 . 1 . . . . 12 GLY HA3 . 11316 1
40 . 1 1 12 12 GLY C C 13 174.027 0.300 . 1 . . . . 12 GLY C . 11316 1
41 . 1 1 12 12 GLY CA C 13 45.148 0.300 . 1 . . . . 12 GLY CA . 11316 1
42 . 1 1 12 12 GLY N N 15 110.983 0.300 . 1 . . . . 12 GLY N . 11316 1
43 . 1 1 13 13 GLU H H 1 8.201 0.030 . 1 . . . . 13 GLU H . 11316 1
44 . 1 1 13 13 GLU HA H 1 4.175 0.030 . 1 . . . . 13 GLU HA . 11316 1
45 . 1 1 13 13 GLU HB2 H 1 1.959 0.030 . 1 . . . . 13 GLU HB2 . 11316 1
46 . 1 1 13 13 GLU HB3 H 1 1.959 0.030 . 1 . . . . 13 GLU HB3 . 11316 1
47 . 1 1 13 13 GLU HG2 H 1 2.203 0.030 . 1 . . . . 13 GLU HG2 . 11316 1
48 . 1 1 13 13 GLU HG3 H 1 2.203 0.030 . 1 . . . . 13 GLU HG3 . 11316 1
49 . 1 1 13 13 GLU C C 13 176.421 0.300 . 1 . . . . 13 GLU C . 11316 1
50 . 1 1 13 13 GLU CA C 13 56.837 0.300 . 1 . . . . 13 GLU CA . 11316 1
51 . 1 1 13 13 GLU CB C 13 30.349 0.300 . 1 . . . . 13 GLU CB . 11316 1
52 . 1 1 13 13 GLU CG C 13 36.287 0.300 . 1 . . . . 13 GLU CG . 11316 1
53 . 1 1 13 13 GLU N N 15 120.257 0.300 . 1 . . . . 13 GLU N . 11316 1
54 . 1 1 14 14 LYS H H 1 8.409 0.030 . 1 . . . . 14 LYS H . 11316 1
55 . 1 1 14 14 LYS HA H 1 4.518 0.030 . 1 . . . . 14 LYS HA . 11316 1
56 . 1 1 14 14 LYS HB2 H 1 1.617 0.030 . 2 . . . . 14 LYS HB2 . 11316 1
57 . 1 1 14 14 LYS HB3 H 1 1.457 0.030 . 2 . . . . 14 LYS HB3 . 11316 1
58 . 1 1 14 14 LYS HD2 H 1 1.431 0.030 . 1 . . . . 14 LYS HD2 . 11316 1
59 . 1 1 14 14 LYS HD3 H 1 1.431 0.030 . 1 . . . . 14 LYS HD3 . 11316 1
60 . 1 1 14 14 LYS HE2 H 1 2.869 0.030 . 1 . . . . 14 LYS HE2 . 11316 1
61 . 1 1 14 14 LYS HE3 H 1 2.869 0.030 . 1 . . . . 14 LYS HE3 . 11316 1
62 . 1 1 14 14 LYS HG2 H 1 1.308 0.030 . 2 . . . . 14 LYS HG2 . 11316 1
63 . 1 1 14 14 LYS HG3 H 1 1.169 0.030 . 2 . . . . 14 LYS HG3 . 11316 1
64 . 1 1 14 14 LYS C C 13 174.233 0.300 . 1 . . . . 14 LYS C . 11316 1
65 . 1 1 14 14 LYS CA C 13 53.799 0.300 . 1 . . . . 14 LYS CA . 11316 1
66 . 1 1 14 14 LYS CB C 13 33.429 0.300 . 1 . . . . 14 LYS CB . 11316 1
67 . 1 1 14 14 LYS CD C 13 29.811 0.300 . 1 . . . . 14 LYS CD . 11316 1
68 . 1 1 14 14 LYS CE C 13 42.229 0.300 . 1 . . . . 14 LYS CE . 11316 1
69 . 1 1 14 14 LYS CG C 13 25.020 0.300 . 1 . . . . 14 LYS CG . 11316 1
70 . 1 1 14 14 LYS N N 15 121.432 0.300 . 1 . . . . 14 LYS N . 11316 1
71 . 1 1 15 15 PRO HA H 1 4.269 0.030 . 1 . . . . 15 PRO HA . 11316 1
72 . 1 1 15 15 PRO HB2 H 1 2.049 0.030 . 2 . . . . 15 PRO HB2 . 11316 1
73 . 1 1 15 15 PRO HB3 H 1 1.263 0.030 . 2 . . . . 15 PRO HB3 . 11316 1
74 . 1 1 15 15 PRO HD2 H 1 3.706 0.030 . 1 . . . . 15 PRO HD2 . 11316 1
75 . 1 1 15 15 PRO HD3 H 1 3.706 0.030 . 1 . . . . 15 PRO HD3 . 11316 1
76 . 1 1 15 15 PRO HG2 H 1 1.831 0.030 . 2 . . . . 15 PRO HG2 . 11316 1
77 . 1 1 15 15 PRO HG3 H 1 1.712 0.030 . 2 . . . . 15 PRO HG3 . 11316 1
78 . 1 1 15 15 PRO C C 13 176.306 0.300 . 1 . . . . 15 PRO C . 11316 1
79 . 1 1 15 15 PRO CA C 13 63.722 0.300 . 1 . . . . 15 PRO CA . 11316 1
80 . 1 1 15 15 PRO CB C 13 32.341 0.300 . 1 . . . . 15 PRO CB . 11316 1
81 . 1 1 15 15 PRO CD C 13 50.589 0.300 . 1 . . . . 15 PRO CD . 11316 1
82 . 1 1 15 15 PRO CG C 13 26.743 0.300 . 1 . . . . 15 PRO CG . 11316 1
83 . 1 1 16 16 TYR H H 1 7.763 0.030 . 1 . . . . 16 TYR H . 11316 1
84 . 1 1 16 16 TYR HA H 1 4.568 0.030 . 1 . . . . 16 TYR HA . 11316 1
85 . 1 1 16 16 TYR HB2 H 1 3.257 0.030 . 2 . . . . 16 TYR HB2 . 11316 1
86 . 1 1 16 16 TYR HB3 H 1 2.671 0.030 . 2 . . . . 16 TYR HB3 . 11316 1
87 . 1 1 16 16 TYR HD1 H 1 6.950 0.030 . 1 . . . . 16 TYR HD1 . 11316 1
88 . 1 1 16 16 TYR HD2 H 1 6.950 0.030 . 1 . . . . 16 TYR HD2 . 11316 1
89 . 1 1 16 16 TYR HE1 H 1 6.873 0.030 . 1 . . . . 16 TYR HE1 . 11316 1
90 . 1 1 16 16 TYR HE2 H 1 6.873 0.030 . 1 . . . . 16 TYR HE2 . 11316 1
91 . 1 1 16 16 TYR C C 13 174.056 0.300 . 1 . . . . 16 TYR C . 11316 1
92 . 1 1 16 16 TYR CA C 13 58.212 0.300 . 1 . . . . 16 TYR CA . 11316 1
93 . 1 1 16 16 TYR CB C 13 39.054 0.300 . 1 . . . . 16 TYR CB . 11316 1
94 . 1 1 16 16 TYR CD1 C 13 133.050 0.300 . 1 . . . . 16 TYR CD1 . 11316 1
95 . 1 1 16 16 TYR CD2 C 13 133.050 0.300 . 1 . . . . 16 TYR CD2 . 11316 1
96 . 1 1 16 16 TYR CE1 C 13 118.435 0.300 . 1 . . . . 16 TYR CE1 . 11316 1
97 . 1 1 16 16 TYR CE2 C 13 118.435 0.300 . 1 . . . . 16 TYR CE2 . 11316 1
98 . 1 1 16 16 TYR N N 15 117.604 0.300 . 1 . . . . 16 TYR N . 11316 1
99 . 1 1 17 17 GLU H H 1 8.750 0.030 . 1 . . . . 17 GLU H . 11316 1
100 . 1 1 17 17 GLU HA H 1 5.115 0.030 . 1 . . . . 17 GLU HA . 11316 1
101 . 1 1 17 17 GLU HB2 H 1 1.925 0.030 . 2 . . . . 17 GLU HB2 . 11316 1
102 . 1 1 17 17 GLU HB3 H 1 1.726 0.030 . 2 . . . . 17 GLU HB3 . 11316 1
103 . 1 1 17 17 GLU HG2 H 1 2.006 0.030 . 1 . . . . 17 GLU HG2 . 11316 1
104 . 1 1 17 17 GLU HG3 H 1 2.006 0.030 . 1 . . . . 17 GLU HG3 . 11316 1
105 . 1 1 17 17 GLU C C 13 175.314 0.300 . 1 . . . . 17 GLU C . 11316 1
106 . 1 1 17 17 GLU CA C 13 53.953 0.300 . 1 . . . . 17 GLU CA . 11316 1
107 . 1 1 17 17 GLU CB C 13 33.834 0.300 . 1 . . . . 17 GLU CB . 11316 1
108 . 1 1 17 17 GLU CG C 13 36.020 0.300 . 1 . . . . 17 GLU CG . 11316 1
109 . 1 1 17 17 GLU N N 15 124.808 0.300 . 1 . . . . 17 GLU N . 11316 1
110 . 1 1 18 18 CYS H H 1 9.309 0.030 . 1 . . . . 18 CYS H . 11316 1
111 . 1 1 18 18 CYS HA H 1 4.315 0.030 . 1 . . . . 18 CYS HA . 11316 1
112 . 1 1 18 18 CYS HB2 H 1 3.216 0.030 . 2 . . . . 18 CYS HB2 . 11316 1
113 . 1 1 18 18 CYS HB3 H 1 2.830 0.030 . 2 . . . . 18 CYS HB3 . 11316 1
114 . 1 1 18 18 CYS C C 13 177.338 0.300 . 1 . . . . 18 CYS C . 11316 1
115 . 1 1 18 18 CYS CA C 13 60.428 0.300 . 1 . . . . 18 CYS CA . 11316 1
116 . 1 1 18 18 CYS CB C 13 29.795 0.300 . 1 . . . . 18 CYS CB . 11316 1
117 . 1 1 18 18 CYS N N 15 128.339 0.300 . 1 . . . . 18 CYS N . 11316 1
118 . 1 1 19 19 TYR H H 1 8.193 0.030 . 1 . . . . 19 TYR H . 11316 1
119 . 1 1 19 19 TYR HA H 1 4.373 0.030 . 1 . . . . 19 TYR HA . 11316 1
120 . 1 1 19 19 TYR HB2 H 1 3.219 0.030 . 2 . . . . 19 TYR HB2 . 11316 1
121 . 1 1 19 19 TYR HB3 H 1 3.134 0.030 . 2 . . . . 19 TYR HB3 . 11316 1
122 . 1 1 19 19 TYR HD1 H 1 7.190 0.030 . 1 . . . . 19 TYR HD1 . 11316 1
123 . 1 1 19 19 TYR HD2 H 1 7.190 0.030 . 1 . . . . 19 TYR HD2 . 11316 1
124 . 1 1 19 19 TYR HE1 H 1 6.800 0.030 . 1 . . . . 19 TYR HE1 . 11316 1
125 . 1 1 19 19 TYR HE2 H 1 6.800 0.030 . 1 . . . . 19 TYR HE2 . 11316 1
126 . 1 1 19 19 TYR C C 13 174.066 0.300 . 1 . . . . 19 TYR C . 11316 1
127 . 1 1 19 19 TYR CA C 13 58.996 0.300 . 1 . . . . 19 TYR CA . 11316 1
128 . 1 1 19 19 TYR CB C 13 36.820 0.300 . 1 . . . . 19 TYR CB . 11316 1
129 . 1 1 19 19 TYR CD1 C 13 133.536 0.300 . 1 . . . . 19 TYR CD1 . 11316 1
130 . 1 1 19 19 TYR CD2 C 13 133.536 0.300 . 1 . . . . 19 TYR CD2 . 11316 1
131 . 1 1 19 19 TYR CE1 C 13 118.570 0.300 . 1 . . . . 19 TYR CE1 . 11316 1
132 . 1 1 19 19 TYR CE2 C 13 118.570 0.300 . 1 . . . . 19 TYR CE2 . 11316 1
133 . 1 1 19 19 TYR N N 15 129.433 0.300 . 1 . . . . 19 TYR N . 11316 1
134 . 1 1 20 20 ILE H H 1 8.137 0.030 . 1 . . . . 20 ILE H . 11316 1
135 . 1 1 20 20 ILE HA H 1 3.546 0.030 . 1 . . . . 20 ILE HA . 11316 1
136 . 1 1 20 20 ILE HB H 1 0.499 0.030 . 1 . . . . 20 ILE HB . 11316 1
137 . 1 1 20 20 ILE HD11 H 1 0.350 0.030 . 1 . . . . 20 ILE HD1 . 11316 1
138 . 1 1 20 20 ILE HD12 H 1 0.350 0.030 . 1 . . . . 20 ILE HD1 . 11316 1
139 . 1 1 20 20 ILE HD13 H 1 0.350 0.030 . 1 . . . . 20 ILE HD1 . 11316 1
140 . 1 1 20 20 ILE HG12 H 1 0.201 0.030 . 2 . . . . 20 ILE HG12 . 11316 1
141 . 1 1 20 20 ILE HG13 H 1 0.258 0.030 . 2 . . . . 20 ILE HG13 . 11316 1
142 . 1 1 20 20 ILE HG21 H 1 0.154 0.030 . 1 . . . . 20 ILE HG2 . 11316 1
143 . 1 1 20 20 ILE HG22 H 1 0.154 0.030 . 1 . . . . 20 ILE HG2 . 11316 1
144 . 1 1 20 20 ILE HG23 H 1 0.154 0.030 . 1 . . . . 20 ILE HG2 . 11316 1
145 . 1 1 20 20 ILE C C 13 176.113 0.300 . 1 . . . . 20 ILE C . 11316 1
146 . 1 1 20 20 ILE CA C 13 63.451 0.300 . 1 . . . . 20 ILE CA . 11316 1
147 . 1 1 20 20 ILE CB C 13 38.831 0.300 . 1 . . . . 20 ILE CB . 11316 1
148 . 1 1 20 20 ILE CD1 C 13 13.456 0.300 . 1 . . . . 20 ILE CD1 . 11316 1
149 . 1 1 20 20 ILE CG1 C 13 27.704 0.300 . 1 . . . . 20 ILE CG1 . 11316 1
150 . 1 1 20 20 ILE CG2 C 13 16.454 0.300 . 1 . . . . 20 ILE CG2 . 11316 1
151 . 1 1 20 20 ILE N N 15 123.162 0.300 . 1 . . . . 20 ILE N . 11316 1
152 . 1 1 21 21 CYS H H 1 8.271 0.030 . 1 . . . . 21 CYS H . 11316 1
153 . 1 1 21 21 CYS HA H 1 5.008 0.030 . 1 . . . . 21 CYS HA . 11316 1
154 . 1 1 21 21 CYS HB2 H 1 3.437 0.030 . 2 . . . . 21 CYS HB2 . 11316 1
155 . 1 1 21 21 CYS HB3 H 1 2.748 0.030 . 2 . . . . 21 CYS HB3 . 11316 1
156 . 1 1 21 21 CYS C C 13 176.208 0.300 . 1 . . . . 21 CYS C . 11316 1
157 . 1 1 21 21 CYS CA C 13 58.323 0.300 . 1 . . . . 21 CYS CA . 11316 1
158 . 1 1 21 21 CYS CB C 13 32.256 0.300 . 1 . . . . 21 CYS CB . 11316 1
159 . 1 1 21 21 CYS N N 15 117.178 0.300 . 1 . . . . 21 CYS N . 11316 1
160 . 1 1 22 22 HIS H H 1 7.783 0.030 . 1 . . . . 22 HIS H . 11316 1
161 . 1 1 22 22 HIS HA H 1 4.508 0.030 . 1 . . . . 22 HIS HA . 11316 1
162 . 1 1 22 22 HIS HB2 H 1 3.580 0.030 . 2 . . . . 22 HIS HB2 . 11316 1
163 . 1 1 22 22 HIS HB3 H 1 3.390 0.030 . 2 . . . . 22 HIS HB3 . 11316 1
164 . 1 1 22 22 HIS HD2 H 1 7.023 0.030 . 1 . . . . 22 HIS HD2 . 11316 1
165 . 1 1 22 22 HIS HE1 H 1 8.362 0.030 . 1 . . . . 22 HIS HE1 . 11316 1
166 . 1 1 22 22 HIS C C 13 173.297 0.300 . 1 . . . . 22 HIS C . 11316 1
167 . 1 1 22 22 HIS CA C 13 58.243 0.300 . 1 . . . . 22 HIS CA . 11316 1
168 . 1 1 22 22 HIS CB C 13 25.362 0.300 . 1 . . . . 22 HIS CB . 11316 1
169 . 1 1 22 22 HIS CD2 C 13 120.296 0.300 . 1 . . . . 22 HIS CD2 . 11316 1
170 . 1 1 22 22 HIS CE1 C 13 136.618 0.300 . 1 . . . . 22 HIS CE1 . 11316 1
171 . 1 1 22 22 HIS N N 15 116.064 0.300 . 1 . . . . 22 HIS N . 11316 1
172 . 1 1 23 23 ALA H H 1 8.158 0.030 . 1 . . . . 23 ALA H . 11316 1
173 . 1 1 23 23 ALA HA H 1 4.150 0.030 . 1 . . . . 23 ALA HA . 11316 1
174 . 1 1 23 23 ALA HB1 H 1 1.040 0.030 . 1 . . . . 23 ALA HB . 11316 1
175 . 1 1 23 23 ALA HB2 H 1 1.040 0.030 . 1 . . . . 23 ALA HB . 11316 1
176 . 1 1 23 23 ALA HB3 H 1 1.040 0.030 . 1 . . . . 23 ALA HB . 11316 1
177 . 1 1 23 23 ALA C C 13 175.481 0.300 . 1 . . . . 23 ALA C . 11316 1
178 . 1 1 23 23 ALA CA C 13 53.361 0.300 . 1 . . . . 23 ALA CA . 11316 1
179 . 1 1 23 23 ALA CB C 13 19.714 0.300 . 1 . . . . 23 ALA CB . 11316 1
180 . 1 1 23 23 ALA N N 15 124.506 0.300 . 1 . . . . 23 ALA N . 11316 1
181 . 1 1 24 24 ARG H H 1 7.866 0.030 . 1 . . . . 24 ARG H . 11316 1
182 . 1 1 24 24 ARG HA H 1 5.227 0.030 . 1 . . . . 24 ARG HA . 11316 1
183 . 1 1 24 24 ARG HB2 H 1 1.735 0.030 . 2 . . . . 24 ARG HB2 . 11316 1
184 . 1 1 24 24 ARG HB3 H 1 1.434 0.030 . 2 . . . . 24 ARG HB3 . 11316 1
185 . 1 1 24 24 ARG HD2 H 1 3.195 0.030 . 2 . . . . 24 ARG HD2 . 11316 1
186 . 1 1 24 24 ARG HD3 H 1 3.076 0.030 . 2 . . . . 24 ARG HD3 . 11316 1
187 . 1 1 24 24 ARG HG2 H 1 1.730 0.030 . 2 . . . . 24 ARG HG2 . 11316 1
188 . 1 1 24 24 ARG HG3 H 1 1.315 0.030 . 2 . . . . 24 ARG HG3 . 11316 1
189 . 1 1 24 24 ARG C C 13 175.718 0.300 . 1 . . . . 24 ARG C . 11316 1
190 . 1 1 24 24 ARG CA C 13 54.531 0.300 . 1 . . . . 24 ARG CA . 11316 1
191 . 1 1 24 24 ARG CB C 13 33.430 0.300 . 1 . . . . 24 ARG CB . 11316 1
192 . 1 1 24 24 ARG CD C 13 43.081 0.300 . 1 . . . . 24 ARG CD . 11316 1
193 . 1 1 24 24 ARG CG C 13 28.208 0.300 . 1 . . . . 24 ARG CG . 11316 1
194 . 1 1 24 24 ARG N N 15 117.895 0.300 . 1 . . . . 24 ARG N . 11316 1
195 . 1 1 25 25 PHE H H 1 8.809 0.030 . 1 . . . . 25 PHE H . 11316 1
196 . 1 1 25 25 PHE HA H 1 4.825 0.030 . 1 . . . . 25 PHE HA . 11316 1
197 . 1 1 25 25 PHE HB2 H 1 3.426 0.030 . 2 . . . . 25 PHE HB2 . 11316 1
198 . 1 1 25 25 PHE HB3 H 1 2.559 0.030 . 2 . . . . 25 PHE HB3 . 11316 1
199 . 1 1 25 25 PHE HD1 H 1 7.049 0.030 . 1 . . . . 25 PHE HD1 . 11316 1
200 . 1 1 25 25 PHE HD2 H 1 7.049 0.030 . 1 . . . . 25 PHE HD2 . 11316 1
201 . 1 1 25 25 PHE HE1 H 1 6.791 0.030 . 1 . . . . 25 PHE HE1 . 11316 1
202 . 1 1 25 25 PHE HE2 H 1 6.791 0.030 . 1 . . . . 25 PHE HE2 . 11316 1
203 . 1 1 25 25 PHE HZ H 1 5.847 0.030 . 1 . . . . 25 PHE HZ . 11316 1
204 . 1 1 25 25 PHE C C 13 175.571 0.300 . 1 . . . . 25 PHE C . 11316 1
205 . 1 1 25 25 PHE CA C 13 56.969 0.300 . 1 . . . . 25 PHE CA . 11316 1
206 . 1 1 25 25 PHE CB C 13 44.102 0.300 . 1 . . . . 25 PHE CB . 11316 1
207 . 1 1 25 25 PHE CD1 C 13 132.251 0.300 . 1 . . . . 25 PHE CD1 . 11316 1
208 . 1 1 25 25 PHE CD2 C 13 132.251 0.300 . 1 . . . . 25 PHE CD2 . 11316 1
209 . 1 1 25 25 PHE CE1 C 13 130.623 0.300 . 1 . . . . 25 PHE CE1 . 11316 1
210 . 1 1 25 25 PHE CE2 C 13 130.623 0.300 . 1 . . . . 25 PHE CE2 . 11316 1
211 . 1 1 25 25 PHE CZ C 13 128.842 0.300 . 1 . . . . 25 PHE CZ . 11316 1
212 . 1 1 25 25 PHE N N 15 116.760 0.300 . 1 . . . . 25 PHE N . 11316 1
213 . 1 1 26 26 THR H H 1 9.102 0.030 . 1 . . . . 26 THR H . 11316 1
214 . 1 1 26 26 THR HA H 1 4.507 0.030 . 1 . . . . 26 THR HA . 11316 1
215 . 1 1 26 26 THR HB H 1 4.482 0.030 . 1 . . . . 26 THR HB . 11316 1
216 . 1 1 26 26 THR HG21 H 1 1.410 0.030 . 1 . . . . 26 THR HG2 . 11316 1
217 . 1 1 26 26 THR HG22 H 1 1.410 0.030 . 1 . . . . 26 THR HG2 . 11316 1
218 . 1 1 26 26 THR HG23 H 1 1.410 0.030 . 1 . . . . 26 THR HG2 . 11316 1
219 . 1 1 26 26 THR C C 13 174.501 0.300 . 1 . . . . 26 THR C . 11316 1
220 . 1 1 26 26 THR CA C 13 63.991 0.300 . 1 . . . . 26 THR CA . 11316 1
221 . 1 1 26 26 THR CB C 13 69.667 0.300 . 1 . . . . 26 THR CB . 11316 1
222 . 1 1 26 26 THR CG2 C 13 22.825 0.300 . 1 . . . . 26 THR CG2 . 11316 1
223 . 1 1 26 26 THR N N 15 113.346 0.300 . 1 . . . . 26 THR N . 11316 1
224 . 1 1 27 27 GLN H H 1 7.328 0.030 . 1 . . . . 27 GLN H . 11316 1
225 . 1 1 27 27 GLN HA H 1 4.782 0.030 . 1 . . . . 27 GLN HA . 11316 1
226 . 1 1 27 27 GLN HB2 H 1 2.019 0.030 . 2 . . . . 27 GLN HB2 . 11316 1
227 . 1 1 27 27 GLN HB3 H 1 2.257 0.030 . 2 . . . . 27 GLN HB3 . 11316 1
228 . 1 1 27 27 GLN HE21 H 1 6.922 0.030 . 2 . . . . 27 GLN HE21 . 11316 1
229 . 1 1 27 27 GLN HE22 H 1 7.523 0.030 . 2 . . . . 27 GLN HE22 . 11316 1
230 . 1 1 27 27 GLN HG2 H 1 2.446 0.030 . 1 . . . . 27 GLN HG2 . 11316 1
231 . 1 1 27 27 GLN HG3 H 1 2.446 0.030 . 1 . . . . 27 GLN HG3 . 11316 1
232 . 1 1 27 27 GLN C C 13 175.500 0.300 . 1 . . . . 27 GLN C . 11316 1
233 . 1 1 27 27 GLN CA C 13 54.029 0.300 . 1 . . . . 27 GLN CA . 11316 1
234 . 1 1 27 27 GLN CB C 13 32.176 0.300 . 1 . . . . 27 GLN CB . 11316 1
235 . 1 1 27 27 GLN CG C 13 33.618 0.300 . 1 . . . . 27 GLN CG . 11316 1
236 . 1 1 27 27 GLN N N 15 115.999 0.300 . 1 . . . . 27 GLN N . 11316 1
237 . 1 1 27 27 GLN NE2 N 15 112.146 0.300 . 1 . . . . 27 GLN NE2 . 11316 1
238 . 1 1 28 28 SER H H 1 8.444 0.030 . 1 . . . . 28 SER H . 11316 1
239 . 1 1 28 28 SER HA H 1 3.102 0.030 . 1 . . . . 28 SER HA . 11316 1
240 . 1 1 28 28 SER HB2 H 1 3.253 0.030 . 2 . . . . 28 SER HB2 . 11316 1
241 . 1 1 28 28 SER HB3 H 1 3.425 0.030 . 2 . . . . 28 SER HB3 . 11316 1
242 . 1 1 28 28 SER C C 13 177.548 0.300 . 1 . . . . 28 SER C . 11316 1
243 . 1 1 28 28 SER CA C 13 60.824 0.300 . 1 . . . . 28 SER CA . 11316 1
244 . 1 1 28 28 SER CB C 13 62.114 0.300 . 1 . . . . 28 SER CB . 11316 1
245 . 1 1 28 28 SER N N 15 119.056 0.300 . 1 . . . . 28 SER N . 11316 1
246 . 1 1 29 29 GLY HA2 H 1 3.673 0.030 . 2 . . . . 29 GLY HA2 . 11316 1
247 . 1 1 29 29 GLY HA3 H 1 3.878 0.030 . 2 . . . . 29 GLY HA3 . 11316 1
248 . 1 1 29 29 GLY C C 13 176.602 0.300 . 1 . . . . 29 GLY C . 11316 1
249 . 1 1 29 29 GLY CA C 13 47.251 0.300 . 1 . . . . 29 GLY CA . 11316 1
250 . 1 1 30 30 THR H H 1 6.930 0.030 . 1 . . . . 30 THR H . 11316 1
251 . 1 1 30 30 THR HA H 1 3.874 0.030 . 1 . . . . 30 THR HA . 11316 1
252 . 1 1 30 30 THR HB H 1 4.129 0.030 . 1 . . . . 30 THR HB . 11316 1
253 . 1 1 30 30 THR HG21 H 1 1.357 0.030 . 1 . . . . 30 THR HG2 . 11316 1
254 . 1 1 30 30 THR HG22 H 1 1.357 0.030 . 1 . . . . 30 THR HG2 . 11316 1
255 . 1 1 30 30 THR HG23 H 1 1.357 0.030 . 1 . . . . 30 THR HG2 . 11316 1
256 . 1 1 30 30 THR C C 13 176.685 0.300 . 1 . . . . 30 THR C . 11316 1
257 . 1 1 30 30 THR CA C 13 64.974 0.300 . 1 . . . . 30 THR CA . 11316 1
258 . 1 1 30 30 THR CB C 13 68.078 0.300 . 1 . . . . 30 THR CB . 11316 1
259 . 1 1 30 30 THR CG2 C 13 23.658 0.300 . 1 . . . . 30 THR CG2 . 11316 1
260 . 1 1 30 30 THR N N 15 115.906 0.300 . 1 . . . . 30 THR N . 11316 1
261 . 1 1 31 31 MET H H 1 6.951 0.030 . 1 . . . . 31 MET H . 11316 1
262 . 1 1 31 31 MET HA H 1 2.403 0.030 . 1 . . . . 31 MET HA . 11316 1
263 . 1 1 31 31 MET HB2 H 1 2.259 0.030 . 2 . . . . 31 MET HB2 . 11316 1
264 . 1 1 31 31 MET HB3 H 1 1.468 0.030 . 2 . . . . 31 MET HB3 . 11316 1
265 . 1 1 31 31 MET HE1 H 1 2.157 0.030 . 1 . . . . 31 MET HE . 11316 1
266 . 1 1 31 31 MET HE2 H 1 2.157 0.030 . 1 . . . . 31 MET HE . 11316 1
267 . 1 1 31 31 MET HE3 H 1 2.157 0.030 . 1 . . . . 31 MET HE . 11316 1
268 . 1 1 31 31 MET HG2 H 1 2.101 0.030 . 2 . . . . 31 MET HG2 . 11316 1
269 . 1 1 31 31 MET HG3 H 1 2.213 0.030 . 2 . . . . 31 MET HG3 . 11316 1
270 . 1 1 31 31 MET C C 13 176.993 0.300 . 1 . . . . 31 MET C . 11316 1
271 . 1 1 31 31 MET CA C 13 58.835 0.300 . 1 . . . . 31 MET CA . 11316 1
272 . 1 1 31 31 MET CB C 13 31.815 0.300 . 1 . . . . 31 MET CB . 11316 1
273 . 1 1 31 31 MET CE C 13 17.187 0.300 . 1 . . . . 31 MET CE . 11316 1
274 . 1 1 31 31 MET CG C 13 30.895 0.300 . 1 . . . . 31 MET CG . 11316 1
275 . 1 1 31 31 MET N N 15 123.059 0.300 . 1 . . . . 31 MET N . 11316 1
276 . 1 1 32 32 LYS H H 1 8.288 0.030 . 1 . . . . 32 LYS H . 11316 1
277 . 1 1 32 32 LYS HA H 1 3.841 0.030 . 1 . . . . 32 LYS HA . 11316 1
278 . 1 1 32 32 LYS HB2 H 1 1.826 0.030 . 1 . . . . 32 LYS HB2 . 11316 1
279 . 1 1 32 32 LYS HB3 H 1 1.826 0.030 . 1 . . . . 32 LYS HB3 . 11316 1
280 . 1 1 32 32 LYS HD2 H 1 1.596 0.030 . 1 . . . . 32 LYS HD2 . 11316 1
281 . 1 1 32 32 LYS HD3 H 1 1.596 0.030 . 1 . . . . 32 LYS HD3 . 11316 1
282 . 1 1 32 32 LYS HE2 H 1 2.849 0.030 . 1 . . . . 32 LYS HE2 . 11316 1
283 . 1 1 32 32 LYS HE3 H 1 2.849 0.030 . 1 . . . . 32 LYS HE3 . 11316 1
284 . 1 1 32 32 LYS HG2 H 1 1.352 0.030 . 2 . . . . 32 LYS HG2 . 11316 1
285 . 1 1 32 32 LYS HG3 H 1 1.546 0.030 . 2 . . . . 32 LYS HG3 . 11316 1
286 . 1 1 32 32 LYS C C 13 179.423 0.300 . 1 . . . . 32 LYS C . 11316 1
287 . 1 1 32 32 LYS CA C 13 60.330 0.300 . 1 . . . . 32 LYS CA . 11316 1
288 . 1 1 32 32 LYS CB C 13 32.218 0.300 . 1 . . . . 32 LYS CB . 11316 1
289 . 1 1 32 32 LYS CD C 13 29.339 0.300 . 1 . . . . 32 LYS CD . 11316 1
290 . 1 1 32 32 LYS CE C 13 42.037 0.300 . 1 . . . . 32 LYS CE . 11316 1
291 . 1 1 32 32 LYS CG C 13 25.709 0.300 . 1 . . . . 32 LYS CG . 11316 1
292 . 1 1 32 32 LYS N N 15 119.245 0.300 . 1 . . . . 32 LYS N . 11316 1
293 . 1 1 33 33 MET H H 1 7.829 0.030 . 1 . . . . 33 MET H . 11316 1
294 . 1 1 33 33 MET HA H 1 4.191 0.030 . 1 . . . . 33 MET HA . 11316 1
295 . 1 1 33 33 MET HB2 H 1 2.565 0.030 . 2 . . . . 33 MET HB2 . 11316 1
296 . 1 1 33 33 MET HB3 H 1 2.038 0.030 . 2 . . . . 33 MET HB3 . 11316 1
297 . 1 1 33 33 MET HE1 H 1 2.003 0.030 . 1 . . . . 33 MET HE . 11316 1
298 . 1 1 33 33 MET HE2 H 1 2.003 0.030 . 1 . . . . 33 MET HE . 11316 1
299 . 1 1 33 33 MET HE3 H 1 2.003 0.030 . 1 . . . . 33 MET HE . 11316 1
300 . 1 1 33 33 MET HG2 H 1 2.565 0.030 . 1 . . . . 33 MET HG2 . 11316 1
301 . 1 1 33 33 MET HG3 H 1 2.565 0.030 . 1 . . . . 33 MET HG3 . 11316 1
302 . 1 1 33 33 MET C C 13 177.424 0.300 . 1 . . . . 33 MET C . 11316 1
303 . 1 1 33 33 MET CA C 13 57.779 0.300 . 1 . . . . 33 MET CA . 11316 1
304 . 1 1 33 33 MET CB C 13 31.815 0.300 . 1 . . . . 33 MET CB . 11316 1
305 . 1 1 33 33 MET CE C 13 16.813 0.300 . 1 . . . . 33 MET CE . 11316 1
306 . 1 1 33 33 MET CG C 13 31.848 0.300 . 1 . . . . 33 MET CG . 11316 1
307 . 1 1 33 33 MET N N 15 118.473 0.300 . 1 . . . . 33 MET N . 11316 1
308 . 1 1 34 34 HIS H H 1 7.669 0.030 . 1 . . . . 34 HIS H . 11316 1
309 . 1 1 34 34 HIS HA H 1 4.265 0.030 . 1 . . . . 34 HIS HA . 11316 1
310 . 1 1 34 34 HIS HB2 H 1 3.286 0.030 . 2 . . . . 34 HIS HB2 . 11316 1
311 . 1 1 34 34 HIS HB3 H 1 2.887 0.030 . 2 . . . . 34 HIS HB3 . 11316 1
312 . 1 1 34 34 HIS HD2 H 1 7.033 0.030 . 1 . . . . 34 HIS HD2 . 11316 1
313 . 1 1 34 34 HIS HE1 H 1 7.931 0.030 . 1 . . . . 34 HIS HE1 . 11316 1
314 . 1 1 34 34 HIS C C 13 176.376 0.300 . 1 . . . . 34 HIS C . 11316 1
315 . 1 1 34 34 HIS CA C 13 59.434 0.300 . 1 . . . . 34 HIS CA . 11316 1
316 . 1 1 34 34 HIS CB C 13 27.316 0.300 . 1 . . . . 34 HIS CB . 11316 1
317 . 1 1 34 34 HIS CD2 C 13 127.802 0.300 . 1 . . . . 34 HIS CD2 . 11316 1
318 . 1 1 34 34 HIS CE1 C 13 138.870 0.300 . 1 . . . . 34 HIS CE1 . 11316 1
319 . 1 1 34 34 HIS N N 15 119.785 0.300 . 1 . . . . 34 HIS N . 11316 1
320 . 1 1 35 35 ILE H H 1 8.144 0.030 . 1 . . . . 35 ILE H . 11316 1
321 . 1 1 35 35 ILE HA H 1 3.416 0.030 . 1 . . . . 35 ILE HA . 11316 1
322 . 1 1 35 35 ILE HB H 1 1.938 0.030 . 1 . . . . 35 ILE HB . 11316 1
323 . 1 1 35 35 ILE HD11 H 1 1.152 0.030 . 1 . . . . 35 ILE HD1 . 11316 1
324 . 1 1 35 35 ILE HD12 H 1 1.152 0.030 . 1 . . . . 35 ILE HD1 . 11316 1
325 . 1 1 35 35 ILE HD13 H 1 1.152 0.030 . 1 . . . . 35 ILE HD1 . 11316 1
326 . 1 1 35 35 ILE HG12 H 1 1.571 0.030 . 2 . . . . 35 ILE HG12 . 11316 1
327 . 1 1 35 35 ILE HG13 H 1 2.175 0.030 . 2 . . . . 35 ILE HG13 . 11316 1
328 . 1 1 35 35 ILE HG21 H 1 0.982 0.030 . 1 . . . . 35 ILE HG2 . 11316 1
329 . 1 1 35 35 ILE HG22 H 1 0.982 0.030 . 1 . . . . 35 ILE HG2 . 11316 1
330 . 1 1 35 35 ILE HG23 H 1 0.982 0.030 . 1 . . . . 35 ILE HG2 . 11316 1
331 . 1 1 35 35 ILE C C 13 178.507 0.300 . 1 . . . . 35 ILE C . 11316 1
332 . 1 1 35 35 ILE CA C 13 66.502 0.300 . 1 . . . . 35 ILE CA . 11316 1
333 . 1 1 35 35 ILE CB C 13 38.129 0.300 . 1 . . . . 35 ILE CB . 11316 1
334 . 1 1 35 35 ILE CD1 C 13 14.475 0.300 . 1 . . . . 35 ILE CD1 . 11316 1
335 . 1 1 35 35 ILE CG1 C 13 30.871 0.300 . 1 . . . . 35 ILE CG1 . 11316 1
336 . 1 1 35 35 ILE CG2 C 13 17.429 0.300 . 1 . . . . 35 ILE CG2 . 11316 1
337 . 1 1 35 35 ILE N N 15 120.426 0.300 . 1 . . . . 35 ILE N . 11316 1
338 . 1 1 36 36 LEU H H 1 7.557 0.030 . 1 . . . . 36 LEU H . 11316 1
339 . 1 1 36 36 LEU HA H 1 4.046 0.030 . 1 . . . . 36 LEU HA . 11316 1
340 . 1 1 36 36 LEU HB2 H 1 1.636 0.030 . 2 . . . . 36 LEU HB2 . 11316 1
341 . 1 1 36 36 LEU HB3 H 1 1.759 0.030 . 2 . . . . 36 LEU HB3 . 11316 1
342 . 1 1 36 36 LEU HD11 H 1 0.846 0.030 . 1 . . . . 36 LEU HD1 . 11316 1
343 . 1 1 36 36 LEU HD12 H 1 0.846 0.030 . 1 . . . . 36 LEU HD1 . 11316 1
344 . 1 1 36 36 LEU HD13 H 1 0.846 0.030 . 1 . . . . 36 LEU HD1 . 11316 1
345 . 1 1 36 36 LEU HD21 H 1 0.859 0.030 . 1 . . . . 36 LEU HD2 . 11316 1
346 . 1 1 36 36 LEU HD22 H 1 0.859 0.030 . 1 . . . . 36 LEU HD2 . 11316 1
347 . 1 1 36 36 LEU HD23 H 1 0.859 0.030 . 1 . . . . 36 LEU HD2 . 11316 1
348 . 1 1 36 36 LEU HG H 1 1.646 0.030 . 1 . . . . 36 LEU HG . 11316 1
349 . 1 1 36 36 LEU C C 13 178.699 0.300 . 1 . . . . 36 LEU C . 11316 1
350 . 1 1 36 36 LEU CA C 13 57.530 0.300 . 1 . . . . 36 LEU CA . 11316 1
351 . 1 1 36 36 LEU CB C 13 42.155 0.300 . 1 . . . . 36 LEU CB . 11316 1
352 . 1 1 36 36 LEU CD1 C 13 24.108 0.300 . 2 . . . . 36 LEU CD1 . 11316 1
353 . 1 1 36 36 LEU CD2 C 13 24.698 0.300 . 2 . . . . 36 LEU CD2 . 11316 1
354 . 1 1 36 36 LEU CG C 13 27.038 0.300 . 1 . . . . 36 LEU CG . 11316 1
355 . 1 1 36 36 LEU N N 15 119.046 0.300 . 1 . . . . 36 LEU N . 11316 1
356 . 1 1 37 37 GLN H H 1 8.127 0.030 . 1 . . . . 37 GLN H . 11316 1
357 . 1 1 37 37 GLN HA H 1 4.032 0.030 . 1 . . . . 37 GLN HA . 11316 1
358 . 1 1 37 37 GLN HB2 H 1 1.927 0.030 . 2 . . . . 37 GLN HB2 . 11316 1
359 . 1 1 37 37 GLN HB3 H 1 2.001 0.030 . 2 . . . . 37 GLN HB3 . 11316 1
360 . 1 1 37 37 GLN HE21 H 1 7.353 0.030 . 2 . . . . 37 GLN HE21 . 11316 1
361 . 1 1 37 37 GLN HE22 H 1 6.802 0.030 . 2 . . . . 37 GLN HE22 . 11316 1
362 . 1 1 37 37 GLN HG2 H 1 2.517 0.030 . 2 . . . . 37 GLN HG2 . 11316 1
363 . 1 1 37 37 GLN HG3 H 1 2.265 0.030 . 2 . . . . 37 GLN HG3 . 11316 1
364 . 1 1 37 37 GLN C C 13 178.296 0.300 . 1 . . . . 37 GLN C . 11316 1
365 . 1 1 37 37 GLN CA C 13 58.130 0.300 . 1 . . . . 37 GLN CA . 11316 1
366 . 1 1 37 37 GLN CB C 13 29.577 0.300 . 1 . . . . 37 GLN CB . 11316 1
367 . 1 1 37 37 GLN CG C 13 34.258 0.300 . 1 . . . . 37 GLN CG . 11316 1
368 . 1 1 37 37 GLN N N 15 114.901 0.300 . 1 . . . . 37 GLN N . 11316 1
369 . 1 1 37 37 GLN NE2 N 15 111.334 0.300 . 1 . . . . 37 GLN NE2 . 11316 1
370 . 1 1 38 38 LYS H H 1 8.321 0.030 . 1 . . . . 38 LYS H . 11316 1
371 . 1 1 38 38 LYS HA H 1 4.237 0.030 . 1 . . . . 38 LYS HA . 11316 1
372 . 1 1 38 38 LYS HB2 H 1 0.569 0.030 . 2 . . . . 38 LYS HB2 . 11316 1
373 . 1 1 38 38 LYS HB3 H 1 0.932 0.030 . 2 . . . . 38 LYS HB3 . 11316 1
374 . 1 1 38 38 LYS HD2 H 1 1.456 0.030 . 1 . . . . 38 LYS HD2 . 11316 1
375 . 1 1 38 38 LYS HD3 H 1 1.456 0.030 . 1 . . . . 38 LYS HD3 . 11316 1
376 . 1 1 38 38 LYS HE2 H 1 2.964 0.030 . 2 . . . . 38 LYS HE2 . 11316 1
377 . 1 1 38 38 LYS HE3 H 1 2.906 0.030 . 2 . . . . 38 LYS HE3 . 11316 1
378 . 1 1 38 38 LYS HG2 H 1 1.128 0.030 . 1 . . . . 38 LYS HG2 . 11316 1
379 . 1 1 38 38 LYS HG3 H 1 1.128 0.030 . 1 . . . . 38 LYS HG3 . 11316 1
380 . 1 1 38 38 LYS C C 13 177.381 0.300 . 1 . . . . 38 LYS C . 11316 1
381 . 1 1 38 38 LYS CA C 13 54.897 0.300 . 1 . . . . 38 LYS CA . 11316 1
382 . 1 1 38 38 LYS CB C 13 31.627 0.300 . 1 . . . . 38 LYS CB . 11316 1
383 . 1 1 38 38 LYS CD C 13 27.707 0.300 . 1 . . . . 38 LYS CD . 11316 1
384 . 1 1 38 38 LYS CE C 13 42.125 0.300 . 1 . . . . 38 LYS CE . 11316 1
385 . 1 1 38 38 LYS CG C 13 24.535 0.300 . 1 . . . . 38 LYS CG . 11316 1
386 . 1 1 38 38 LYS N N 15 113.838 0.300 . 1 . . . . 38 LYS N . 11316 1
387 . 1 1 39 39 HIS H H 1 7.603 0.030 . 1 . . . . 39 HIS H . 11316 1
388 . 1 1 39 39 HIS HA H 1 5.316 0.030 . 1 . . . . 39 HIS HA . 11316 1
389 . 1 1 39 39 HIS HB2 H 1 3.152 0.030 . 2 . . . . 39 HIS HB2 . 11316 1
390 . 1 1 39 39 HIS HB3 H 1 3.258 0.030 . 2 . . . . 39 HIS HB3 . 11316 1
391 . 1 1 39 39 HIS HD2 H 1 6.571 0.030 . 1 . . . . 39 HIS HD2 . 11316 1
392 . 1 1 39 39 HIS HE1 H 1 7.960 0.030 . 1 . . . . 39 HIS HE1 . 11316 1
393 . 1 1 39 39 HIS C C 13 174.849 0.300 . 1 . . . . 39 HIS C . 11316 1
394 . 1 1 39 39 HIS CA C 13 53.289 0.300 . 1 . . . . 39 HIS CA . 11316 1
395 . 1 1 39 39 HIS CB C 13 29.534 0.300 . 1 . . . . 39 HIS CB . 11316 1
396 . 1 1 39 39 HIS CD2 C 13 128.150 0.300 . 1 . . . . 39 HIS CD2 . 11316 1
397 . 1 1 39 39 HIS CE1 C 13 139.422 0.300 . 1 . . . . 39 HIS CE1 . 11316 1
398 . 1 1 39 39 HIS N N 15 115.328 0.300 . 1 . . . . 39 HIS N . 11316 1
399 . 1 1 40 40 THR H H 1 7.765 0.030 . 1 . . . . 40 THR H . 11316 1
400 . 1 1 40 40 THR HA H 1 4.308 0.030 . 1 . . . . 40 THR HA . 11316 1
401 . 1 1 40 40 THR HB H 1 4.249 0.030 . 1 . . . . 40 THR HB . 11316 1
402 . 1 1 40 40 THR HG21 H 1 1.204 0.030 . 1 . . . . 40 THR HG2 . 11316 1
403 . 1 1 40 40 THR HG22 H 1 1.204 0.030 . 1 . . . . 40 THR HG2 . 11316 1
404 . 1 1 40 40 THR HG23 H 1 1.204 0.030 . 1 . . . . 40 THR HG2 . 11316 1
405 . 1 1 40 40 THR C C 13 174.677 0.300 . 1 . . . . 40 THR C . 11316 1
406 . 1 1 40 40 THR CA C 13 63.087 0.300 . 1 . . . . 40 THR CA . 11316 1
407 . 1 1 40 40 THR CB C 13 69.709 0.300 . 1 . . . . 40 THR CB . 11316 1
408 . 1 1 40 40 THR CG2 C 13 21.656 0.300 . 1 . . . . 40 THR CG2 . 11316 1
409 . 1 1 40 40 THR N N 15 114.008 0.300 . 1 . . . . 40 THR N . 11316 1
410 . 1 1 41 41 GLU H H 1 8.728 0.030 . 1 . . . . 41 GLU H . 11316 1
411 . 1 1 41 41 GLU HA H 1 4.270 0.030 . 1 . . . . 41 GLU HA . 11316 1
412 . 1 1 41 41 GLU HB2 H 1 1.917 0.030 . 2 . . . . 41 GLU HB2 . 11316 1
413 . 1 1 41 41 GLU HB3 H 1 2.033 0.030 . 2 . . . . 41 GLU HB3 . 11316 1
414 . 1 1 41 41 GLU HG2 H 1 2.256 0.030 . 2 . . . . 41 GLU HG2 . 11316 1
415 . 1 1 41 41 GLU HG3 H 1 2.209 0.030 . 2 . . . . 41 GLU HG3 . 11316 1
416 . 1 1 41 41 GLU C C 13 176.239 0.300 . 1 . . . . 41 GLU C . 11316 1
417 . 1 1 41 41 GLU CA C 13 56.891 0.300 . 1 . . . . 41 GLU CA . 11316 1
418 . 1 1 41 41 GLU CB C 13 30.203 0.300 . 1 . . . . 41 GLU CB . 11316 1
419 . 1 1 41 41 GLU CG C 13 36.289 0.300 . 1 . . . . 41 GLU CG . 11316 1
420 . 1 1 41 41 GLU N N 15 123.078 0.300 . 1 . . . . 41 GLU N . 11316 1
421 . 1 1 42 42 ASN H H 1 8.447 0.030 . 1 . . . . 42 ASN H . 11316 1
422 . 1 1 42 42 ASN HA H 1 4.654 0.030 . 1 . . . . 42 ASN HA . 11316 1
423 . 1 1 42 42 ASN HB2 H 1 2.673 0.030 . 2 . . . . 42 ASN HB2 . 11316 1
424 . 1 1 42 42 ASN HB3 H 1 2.823 0.030 . 2 . . . . 42 ASN HB3 . 11316 1
425 . 1 1 42 42 ASN HD21 H 1 6.912 0.030 . 2 . . . . 42 ASN HD21 . 11316 1
426 . 1 1 42 42 ASN HD22 H 1 7.568 0.030 . 2 . . . . 42 ASN HD22 . 11316 1
427 . 1 1 42 42 ASN C C 13 174.934 0.300 . 1 . . . . 42 ASN C . 11316 1
428 . 1 1 42 42 ASN CA C 13 53.678 0.300 . 1 . . . . 42 ASN CA . 11316 1
429 . 1 1 42 42 ASN CB C 13 38.860 0.300 . 1 . . . . 42 ASN CB . 11316 1
430 . 1 1 42 42 ASN N N 15 119.338 0.300 . 1 . . . . 42 ASN N . 11316 1
431 . 1 1 42 42 ASN ND2 N 15 112.730 0.300 . 1 . . . . 42 ASN ND2 . 11316 1
432 . 1 1 43 43 VAL H H 1 7.855 0.030 . 1 . . . . 43 VAL H . 11316 1
433 . 1 1 43 43 VAL HA H 1 4.115 0.030 . 1 . . . . 43 VAL HA . 11316 1
434 . 1 1 43 43 VAL HB H 1 2.063 0.030 . 1 . . . . 43 VAL HB . 11316 1
435 . 1 1 43 43 VAL HG11 H 1 0.852 0.030 . 1 . . . . 43 VAL HG1 . 11316 1
436 . 1 1 43 43 VAL HG12 H 1 0.852 0.030 . 1 . . . . 43 VAL HG1 . 11316 1
437 . 1 1 43 43 VAL HG13 H 1 0.852 0.030 . 1 . . . . 43 VAL HG1 . 11316 1
438 . 1 1 43 43 VAL HG21 H 1 0.856 0.030 . 1 . . . . 43 VAL HG2 . 11316 1
439 . 1 1 43 43 VAL HG22 H 1 0.856 0.030 . 1 . . . . 43 VAL HG2 . 11316 1
440 . 1 1 43 43 VAL HG23 H 1 0.856 0.030 . 1 . . . . 43 VAL HG2 . 11316 1
441 . 1 1 43 43 VAL C C 13 175.444 0.300 . 1 . . . . 43 VAL C . 11316 1
442 . 1 1 43 43 VAL CA C 13 62.022 0.300 . 1 . . . . 43 VAL CA . 11316 1
443 . 1 1 43 43 VAL CB C 13 33.024 0.300 . 1 . . . . 43 VAL CB . 11316 1
444 . 1 1 43 43 VAL CG1 C 13 20.416 0.300 . 2 . . . . 43 VAL CG1 . 11316 1
445 . 1 1 43 43 VAL CG2 C 13 21.337 0.300 . 2 . . . . 43 VAL CG2 . 11316 1
446 . 1 1 43 43 VAL N N 15 119.170 0.300 . 1 . . . . 43 VAL N . 11316 1
447 . 1 1 44 44 ALA H H 1 8.284 0.030 . 1 . . . . 44 ALA H . 11316 1
448 . 1 1 44 44 ALA HA H 1 4.265 0.030 . 1 . . . . 44 ALA HA . 11316 1
449 . 1 1 44 44 ALA HB1 H 1 1.295 0.030 . 1 . . . . 44 ALA HB . 11316 1
450 . 1 1 44 44 ALA HB2 H 1 1.295 0.030 . 1 . . . . 44 ALA HB . 11316 1
451 . 1 1 44 44 ALA HB3 H 1 1.295 0.030 . 1 . . . . 44 ALA HB . 11316 1
452 . 1 1 44 44 ALA C C 13 176.670 0.300 . 1 . . . . 44 ALA C . 11316 1
453 . 1 1 44 44 ALA CA C 13 52.322 0.300 . 1 . . . . 44 ALA CA . 11316 1
454 . 1 1 44 44 ALA CB C 13 19.445 0.300 . 1 . . . . 44 ALA CB . 11316 1
455 . 1 1 44 44 ALA N N 15 127.392 0.300 . 1 . . . . 44 ALA N . 11316 1
456 . 1 1 45 45 LYS H H 1 7.739 0.030 . 1 . . . . 45 LYS H . 11316 1
457 . 1 1 45 45 LYS HA H 1 4.222 0.030 . 1 . . . . 45 LYS HA . 11316 1
458 . 1 1 45 45 LYS HB2 H 1 1.489 0.030 . 1 . . . . 45 LYS HB2 . 11316 1
459 . 1 1 45 45 LYS HB3 H 1 1.489 0.030 . 1 . . . . 45 LYS HB3 . 11316 1
460 . 1 1 45 45 LYS HD2 H 1 1.511 0.030 . 1 . . . . 45 LYS HD2 . 11316 1
461 . 1 1 45 45 LYS HD3 H 1 1.511 0.030 . 1 . . . . 45 LYS HD3 . 11316 1
462 . 1 1 45 45 LYS HE2 H 1 2.886 0.030 . 1 . . . . 45 LYS HE2 . 11316 1
463 . 1 1 45 45 LYS HE3 H 1 2.886 0.030 . 1 . . . . 45 LYS HE3 . 11316 1
464 . 1 1 45 45 LYS HG2 H 1 1.176 0.030 . 2 . . . . 45 LYS HG2 . 11316 1
465 . 1 1 45 45 LYS HG3 H 1 1.255 0.030 . 2 . . . . 45 LYS HG3 . 11316 1
466 . 1 1 45 45 LYS C C 13 174.998 0.300 . 1 . . . . 45 LYS C . 11316 1
467 . 1 1 45 45 LYS CA C 13 55.593 0.300 . 1 . . . . 45 LYS CA . 11316 1
468 . 1 1 45 45 LYS CB C 13 33.996 0.300 . 1 . . . . 45 LYS CB . 11316 1
469 . 1 1 45 45 LYS CD C 13 29.183 0.300 . 1 . . . . 45 LYS CD . 11316 1
470 . 1 1 45 45 LYS CE C 13 42.144 0.300 . 1 . . . . 45 LYS CE . 11316 1
471 . 1 1 45 45 LYS CG C 13 24.748 0.300 . 1 . . . . 45 LYS CG . 11316 1
472 . 1 1 45 45 LYS N N 15 118.588 0.300 . 1 . . . . 45 LYS N . 11316 1
473 . 1 1 46 46 PHE H H 1 8.367 0.030 . 1 . . . . 46 PHE H . 11316 1
474 . 1 1 46 46 PHE HA H 1 4.642 0.030 . 1 . . . . 46 PHE HA . 11316 1
475 . 1 1 46 46 PHE HB2 H 1 2.828 0.030 . 2 . . . . 46 PHE HB2 . 11316 1
476 . 1 1 46 46 PHE HB3 H 1 2.928 0.030 . 2 . . . . 46 PHE HB3 . 11316 1
477 . 1 1 46 46 PHE HD1 H 1 7.101 0.030 . 1 . . . . 46 PHE HD1 . 11316 1
478 . 1 1 46 46 PHE HD2 H 1 7.101 0.030 . 1 . . . . 46 PHE HD2 . 11316 1
479 . 1 1 46 46 PHE HE1 H 1 7.270 0.030 . 1 . . . . 46 PHE HE1 . 11316 1
480 . 1 1 46 46 PHE HE2 H 1 7.270 0.030 . 1 . . . . 46 PHE HE2 . 11316 1
481 . 1 1 46 46 PHE HZ H 1 7.270 0.030 . 1 . . . . 46 PHE HZ . 11316 1
482 . 1 1 46 46 PHE C C 13 173.990 0.300 . 1 . . . . 46 PHE C . 11316 1
483 . 1 1 46 46 PHE CA C 13 56.978 0.300 . 1 . . . . 46 PHE CA . 11316 1
484 . 1 1 46 46 PHE CB C 13 40.307 0.300 . 1 . . . . 46 PHE CB . 11316 1
485 . 1 1 46 46 PHE CD1 C 13 131.914 0.300 . 1 . . . . 46 PHE CD1 . 11316 1
486 . 1 1 46 46 PHE CD2 C 13 131.914 0.300 . 1 . . . . 46 PHE CD2 . 11316 1
487 . 1 1 46 46 PHE CE1 C 13 131.249 0.300 . 1 . . . . 46 PHE CE1 . 11316 1
488 . 1 1 46 46 PHE CE2 C 13 131.249 0.300 . 1 . . . . 46 PHE CE2 . 11316 1
489 . 1 1 46 46 PHE CZ C 13 129.704 0.300 . 1 . . . . 46 PHE CZ . 11316 1
490 . 1 1 46 46 PHE N N 15 119.982 0.300 . 1 . . . . 46 PHE N . 11316 1
491 . 1 1 47 47 HIS H H 1 8.466 0.030 . 1 . . . . 47 HIS H . 11316 1
492 . 1 1 47 47 HIS HA H 1 4.713 0.030 . 1 . . . . 47 HIS HA . 11316 1
493 . 1 1 47 47 HIS HB2 H 1 2.970 0.030 . 2 . . . . 47 HIS HB2 . 11316 1
494 . 1 1 47 47 HIS HB3 H 1 2.841 0.030 . 2 . . . . 47 HIS HB3 . 11316 1
495 . 1 1 47 47 HIS HD2 H 1 6.893 0.030 . 1 . . . . 47 HIS HD2 . 11316 1
496 . 1 1 47 47 HIS HE1 H 1 7.893 0.030 . 1 . . . . 47 HIS HE1 . 11316 1
497 . 1 1 47 47 HIS C C 13 174.227 0.300 . 1 . . . . 47 HIS C . 11316 1
498 . 1 1 47 47 HIS CA C 13 55.135 0.300 . 1 . . . . 47 HIS CA . 11316 1
499 . 1 1 47 47 HIS CB C 13 30.857 0.300 . 1 . . . . 47 HIS CB . 11316 1
500 . 1 1 47 47 HIS CD2 C 13 121.690 0.300 . 1 . . . . 47 HIS CD2 . 11316 1
501 . 1 1 47 47 HIS CE1 C 13 137.518 0.300 . 1 . . . . 47 HIS CE1 . 11316 1
502 . 1 1 47 47 HIS N N 15 120.819 0.300 . 1 . . . . 47 HIS N . 11316 1
503 . 1 1 48 48 CYS H H 1 8.705 0.030 . 1 . . . . 48 CYS H . 11316 1
504 . 1 1 48 48 CYS HA H 1 4.500 0.030 . 1 . . . . 48 CYS HA . 11316 1
505 . 1 1 48 48 CYS HB2 H 1 2.439 0.030 . 2 . . . . 48 CYS HB2 . 11316 1
506 . 1 1 48 48 CYS HB3 H 1 3.248 0.030 . 2 . . . . 48 CYS HB3 . 11316 1
507 . 1 1 48 48 CYS C C 13 175.325 0.300 . 1 . . . . 48 CYS C . 11316 1
508 . 1 1 48 48 CYS CA C 13 56.978 0.300 . 1 . . . . 48 CYS CA . 11316 1
509 . 1 1 48 48 CYS CB C 13 30.159 0.300 . 1 . . . . 48 CYS CB . 11316 1
510 . 1 1 48 48 CYS N N 15 126.434 0.300 . 1 . . . . 48 CYS N . 11316 1
511 . 1 1 49 49 PRO HA H 1 4.330 0.030 . 1 . . . . 49 PRO HA . 11316 1
512 . 1 1 49 49 PRO HB2 H 1 2.105 0.030 . 2 . . . . 49 PRO HB2 . 11316 1
513 . 1 1 49 49 PRO HB3 H 1 1.214 0.030 . 2 . . . . 49 PRO HB3 . 11316 1
514 . 1 1 49 49 PRO HD2 H 1 3.819 0.030 . 2 . . . . 49 PRO HD2 . 11316 1
515 . 1 1 49 49 PRO HD3 H 1 4.117 0.030 . 2 . . . . 49 PRO HD3 . 11316 1
516 . 1 1 49 49 PRO HG2 H 1 1.337 0.030 . 2 . . . . 49 PRO HG2 . 11316 1
517 . 1 1 49 49 PRO HG3 H 1 1.845 0.030 . 2 . . . . 49 PRO HG3 . 11316 1
518 . 1 1 49 49 PRO C C 13 176.556 0.300 . 1 . . . . 49 PRO C . 11316 1
519 . 1 1 49 49 PRO CA C 13 63.860 0.300 . 1 . . . . 49 PRO CA . 11316 1
520 . 1 1 49 49 PRO CB C 13 32.021 0.300 . 1 . . . . 49 PRO CB . 11316 1
521 . 1 1 49 49 PRO CD C 13 51.164 0.300 . 1 . . . . 49 PRO CD . 11316 1
522 . 1 1 49 49 PRO CG C 13 26.327 0.300 . 1 . . . . 49 PRO CG . 11316 1
523 . 1 1 50 50 HIS H H 1 9.309 0.030 . 1 . . . . 50 HIS H . 11316 1
524 . 1 1 50 50 HIS HA H 1 4.692 0.030 . 1 . . . . 50 HIS HA . 11316 1
525 . 1 1 50 50 HIS HB2 H 1 2.711 0.030 . 2 . . . . 50 HIS HB2 . 11316 1
526 . 1 1 50 50 HIS HB3 H 1 1.554 0.030 . 2 . . . . 50 HIS HB3 . 11316 1
527 . 1 1 50 50 HIS HD2 H 1 6.311 0.030 . 1 . . . . 50 HIS HD2 . 11316 1
528 . 1 1 50 50 HIS HE1 H 1 7.652 0.030 . 1 . . . . 50 HIS HE1 . 11316 1
529 . 1 1 50 50 HIS C C 13 175.155 0.300 . 1 . . . . 50 HIS C . 11316 1
530 . 1 1 50 50 HIS CA C 13 56.017 0.300 . 1 . . . . 50 HIS CA . 11316 1
531 . 1 1 50 50 HIS CB C 13 30.852 0.300 . 1 . . . . 50 HIS CB . 11316 1
532 . 1 1 50 50 HIS CD2 C 13 121.855 0.300 . 1 . . . . 50 HIS CD2 . 11316 1
533 . 1 1 50 50 HIS CE1 C 13 139.439 0.300 . 1 . . . . 50 HIS CE1 . 11316 1
534 . 1 1 50 50 HIS N N 15 119.004 0.300 . 1 . . . . 50 HIS N . 11316 1
535 . 1 1 51 51 CYS H H 1 7.969 0.030 . 1 . . . . 51 CYS H . 11316 1
536 . 1 1 51 51 CYS HA H 1 5.075 0.030 . 1 . . . . 51 CYS HA . 11316 1
537 . 1 1 51 51 CYS HB2 H 1 3.429 0.030 . 2 . . . . 51 CYS HB2 . 11316 1
538 . 1 1 51 51 CYS HB3 H 1 3.213 0.030 . 2 . . . . 51 CYS HB3 . 11316 1
539 . 1 1 51 51 CYS C C 13 173.725 0.300 . 1 . . . . 51 CYS C . 11316 1
540 . 1 1 51 51 CYS CA C 13 58.589 0.300 . 1 . . . . 51 CYS CA . 11316 1
541 . 1 1 51 51 CYS CB C 13 30.951 0.300 . 1 . . . . 51 CYS CB . 11316 1
542 . 1 1 51 51 CYS N N 15 118.194 0.300 . 1 . . . . 51 CYS N . 11316 1
543 . 1 1 52 52 ASP H H 1 8.194 0.030 . 1 . . . . 52 ASP H . 11316 1
544 . 1 1 52 52 ASP HA H 1 4.709 0.030 . 1 . . . . 52 ASP HA . 11316 1
545 . 1 1 52 52 ASP HB2 H 1 2.849 0.030 . 2 . . . . 52 ASP HB2 . 11316 1
546 . 1 1 52 52 ASP HB3 H 1 2.679 0.030 . 2 . . . . 52 ASP HB3 . 11316 1
547 . 1 1 52 52 ASP C C 13 175.963 0.300 . 1 . . . . 52 ASP C . 11316 1
548 . 1 1 52 52 ASP CA C 13 54.909 0.300 . 1 . . . . 52 ASP CA . 11316 1
549 . 1 1 52 52 ASP CB C 13 40.792 0.300 . 1 . . . . 52 ASP CB . 11316 1
550 . 1 1 52 52 ASP N N 15 117.711 0.300 . 1 . . . . 52 ASP N . 11316 1
551 . 1 1 53 53 THR H H 1 8.331 0.030 . 1 . . . . 53 THR H . 11316 1
552 . 1 1 53 53 THR HA H 1 4.077 0.030 . 1 . . . . 53 THR HA . 11316 1
553 . 1 1 53 53 THR HB H 1 3.707 0.030 . 1 . . . . 53 THR HB . 11316 1
554 . 1 1 53 53 THR HG21 H 1 0.768 0.030 . 1 . . . . 53 THR HG2 . 11316 1
555 . 1 1 53 53 THR HG22 H 1 0.768 0.030 . 1 . . . . 53 THR HG2 . 11316 1
556 . 1 1 53 53 THR HG23 H 1 0.768 0.030 . 1 . . . . 53 THR HG2 . 11316 1
557 . 1 1 53 53 THR CA C 13 64.659 0.300 . 1 . . . . 53 THR CA . 11316 1
558 . 1 1 53 53 THR CB C 13 69.418 0.300 . 1 . . . . 53 THR CB . 11316 1
559 . 1 1 53 53 THR CG2 C 13 20.834 0.300 . 1 . . . . 53 THR CG2 . 11316 1
560 . 1 1 53 53 THR N N 15 119.645 0.300 . 1 . . . . 53 THR N . 11316 1
561 . 1 1 54 54 VAL H H 1 8.262 0.030 . 1 . . . . 54 VAL H . 11316 1
562 . 1 1 54 54 VAL HA H 1 4.053 0.030 . 1 . . . . 54 VAL HA . 11316 1
563 . 1 1 54 54 VAL HB H 1 1.758 0.030 . 1 . . . . 54 VAL HB . 11316 1
564 . 1 1 54 54 VAL HG11 H 1 0.608 0.030 . 1 . . . . 54 VAL HG1 . 11316 1
565 . 1 1 54 54 VAL HG12 H 1 0.608 0.030 . 1 . . . . 54 VAL HG1 . 11316 1
566 . 1 1 54 54 VAL HG13 H 1 0.608 0.030 . 1 . . . . 54 VAL HG1 . 11316 1
567 . 1 1 54 54 VAL HG21 H 1 0.678 0.030 . 1 . . . . 54 VAL HG2 . 11316 1
568 . 1 1 54 54 VAL HG22 H 1 0.678 0.030 . 1 . . . . 54 VAL HG2 . 11316 1
569 . 1 1 54 54 VAL HG23 H 1 0.678 0.030 . 1 . . . . 54 VAL HG2 . 11316 1
570 . 1 1 54 54 VAL C C 13 175.136 0.300 . 1 . . . . 54 VAL C . 11316 1
571 . 1 1 54 54 VAL CA C 13 62.457 0.300 . 1 . . . . 54 VAL CA . 11316 1
572 . 1 1 54 54 VAL CB C 13 32.259 0.300 . 1 . . . . 54 VAL CB . 11316 1
573 . 1 1 54 54 VAL CG1 C 13 21.300 0.300 . 2 . . . . 54 VAL CG1 . 11316 1
574 . 1 1 54 54 VAL CG2 C 13 21.364 0.300 . 2 . . . . 54 VAL CG2 . 11316 1
575 . 1 1 54 54 VAL N N 15 126.890 0.300 . 1 . . . . 54 VAL N . 11316 1
576 . 1 1 55 55 ILE H H 1 8.628 0.030 . 1 . . . . 55 ILE H . 11316 1
577 . 1 1 55 55 ILE HA H 1 4.236 0.030 . 1 . . . . 55 ILE HA . 11316 1
578 . 1 1 55 55 ILE HB H 1 1.609 0.030 . 1 . . . . 55 ILE HB . 11316 1
579 . 1 1 55 55 ILE HD11 H 1 0.347 0.030 . 1 . . . . 55 ILE HD1 . 11316 1
580 . 1 1 55 55 ILE HD12 H 1 0.347 0.030 . 1 . . . . 55 ILE HD1 . 11316 1
581 . 1 1 55 55 ILE HD13 H 1 0.347 0.030 . 1 . . . . 55 ILE HD1 . 11316 1
582 . 1 1 55 55 ILE HG12 H 1 1.071 0.030 . 1 . . . . 55 ILE HG12 . 11316 1
583 . 1 1 55 55 ILE HG13 H 1 1.071 0.030 . 1 . . . . 55 ILE HG13 . 11316 1
584 . 1 1 55 55 ILE HG21 H 1 0.818 0.030 . 1 . . . . 55 ILE HG2 . 11316 1
585 . 1 1 55 55 ILE HG22 H 1 0.818 0.030 . 1 . . . . 55 ILE HG2 . 11316 1
586 . 1 1 55 55 ILE HG23 H 1 0.818 0.030 . 1 . . . . 55 ILE HG2 . 11316 1
587 . 1 1 55 55 ILE C C 13 175.224 0.300 . 1 . . . . 55 ILE C . 11316 1
588 . 1 1 55 55 ILE CA C 13 59.018 0.300 . 1 . . . . 55 ILE CA . 11316 1
589 . 1 1 55 55 ILE CB C 13 39.187 0.300 . 1 . . . . 55 ILE CB . 11316 1
590 . 1 1 55 55 ILE CD1 C 13 11.753 0.300 . 1 . . . . 55 ILE CD1 . 11316 1
591 . 1 1 55 55 ILE CG1 C 13 26.964 0.300 . 1 . . . . 55 ILE CG1 . 11316 1
592 . 1 1 55 55 ILE CG2 C 13 18.676 0.300 . 1 . . . . 55 ILE CG2 . 11316 1
593 . 1 1 55 55 ILE N N 15 129.316 0.300 . 1 . . . . 55 ILE N . 11316 1
594 . 1 1 56 56 ALA H H 1 8.684 0.030 . 1 . . . . 56 ALA H . 11316 1
595 . 1 1 56 56 ALA HA H 1 4.277 0.030 . 1 . . . . 56 ALA HA . 11316 1
596 . 1 1 56 56 ALA HB1 H 1 1.457 0.030 . 1 . . . . 56 ALA HB . 11316 1
597 . 1 1 56 56 ALA HB2 H 1 1.457 0.030 . 1 . . . . 56 ALA HB . 11316 1
598 . 1 1 56 56 ALA HB3 H 1 1.457 0.030 . 1 . . . . 56 ALA HB . 11316 1
599 . 1 1 56 56 ALA C C 13 177.336 0.300 . 1 . . . . 56 ALA C . 11316 1
600 . 1 1 56 56 ALA CA C 13 54.584 0.300 . 1 . . . . 56 ALA CA . 11316 1
601 . 1 1 56 56 ALA CB C 13 19.900 0.300 . 1 . . . . 56 ALA CB . 11316 1
602 . 1 1 56 56 ALA N N 15 127.370 0.300 . 1 . . . . 56 ALA N . 11316 1
603 . 1 1 57 57 ARG H H 1 7.453 0.030 . 1 . . . . 57 ARG H . 11316 1
604 . 1 1 57 57 ARG HA H 1 4.713 0.030 . 1 . . . . 57 ARG HA . 11316 1
605 . 1 1 57 57 ARG HB2 H 1 1.716 0.030 . 2 . . . . 57 ARG HB2 . 11316 1
606 . 1 1 57 57 ARG HB3 H 1 1.907 0.030 . 2 . . . . 57 ARG HB3 . 11316 1
607 . 1 1 57 57 ARG HD2 H 1 3.160 0.030 . 1 . . . . 57 ARG HD2 . 11316 1
608 . 1 1 57 57 ARG HD3 H 1 3.160 0.030 . 1 . . . . 57 ARG HD3 . 11316 1
609 . 1 1 57 57 ARG HG2 H 1 1.543 0.030 . 2 . . . . 57 ARG HG2 . 11316 1
610 . 1 1 57 57 ARG HG3 H 1 1.612 0.030 . 2 . . . . 57 ARG HG3 . 11316 1
611 . 1 1 57 57 ARG C C 13 176.304 0.300 . 1 . . . . 57 ARG C . 11316 1
612 . 1 1 57 57 ARG CA C 13 54.354 0.300 . 1 . . . . 57 ARG CA . 11316 1
613 . 1 1 57 57 ARG CB C 13 32.621 0.300 . 1 . . . . 57 ARG CB . 11316 1
614 . 1 1 57 57 ARG CD C 13 43.444 0.300 . 1 . . . . 57 ARG CD . 11316 1
615 . 1 1 57 57 ARG CG C 13 26.576 0.300 . 1 . . . . 57 ARG CG . 11316 1
616 . 1 1 57 57 ARG N N 15 113.317 0.300 . 1 . . . . 57 ARG N . 11316 1
617 . 1 1 58 58 LYS HA H 1 3.157 0.030 . 1 . . . . 58 LYS HA . 11316 1
618 . 1 1 58 58 LYS HB2 H 1 1.588 0.030 . 2 . . . . 58 LYS HB2 . 11316 1
619 . 1 1 58 58 LYS HB3 H 1 1.429 0.030 . 2 . . . . 58 LYS HB3 . 11316 1
620 . 1 1 58 58 LYS HD2 H 1 1.508 0.030 . 1 . . . . 58 LYS HD2 . 11316 1
621 . 1 1 58 58 LYS HD3 H 1 1.508 0.030 . 1 . . . . 58 LYS HD3 . 11316 1
622 . 1 1 58 58 LYS HE2 H 1 2.839 0.030 . 1 . . . . 58 LYS HE2 . 11316 1
623 . 1 1 58 58 LYS HE3 H 1 2.839 0.030 . 1 . . . . 58 LYS HE3 . 11316 1
624 . 1 1 58 58 LYS HG2 H 1 0.988 0.030 . 2 . . . . 58 LYS HG2 . 11316 1
625 . 1 1 58 58 LYS HG3 H 1 1.107 0.030 . 2 . . . . 58 LYS HG3 . 11316 1
626 . 1 1 58 58 LYS CA C 13 60.021 0.300 . 1 . . . . 58 LYS CA . 11316 1
627 . 1 1 58 58 LYS CB C 13 31.827 0.300 . 1 . . . . 58 LYS CB . 11316 1
628 . 1 1 58 58 LYS CD C 13 29.462 0.300 . 1 . . . . 58 LYS CD . 11316 1
629 . 1 1 58 58 LYS CE C 13 42.246 0.300 . 1 . . . . 58 LYS CE . 11316 1
630 . 1 1 58 58 LYS CG C 13 24.913 0.300 . 1 . . . . 58 LYS CG . 11316 1
631 . 1 1 59 59 SER HA H 1 4.133 0.030 . 1 . . . . 59 SER HA . 11316 1
632 . 1 1 59 59 SER HB2 H 1 3.813 0.030 . 2 . . . . 59 SER HB2 . 11316 1
633 . 1 1 59 59 SER HB3 H 1 3.939 0.030 . 2 . . . . 59 SER HB3 . 11316 1
634 . 1 1 59 59 SER C C 13 176.309 0.300 . 1 . . . . 59 SER C . 11316 1
635 . 1 1 59 59 SER CA C 13 60.651 0.300 . 1 . . . . 59 SER CA . 11316 1
636 . 1 1 59 59 SER CB C 13 61.891 0.300 . 1 . . . . 59 SER CB . 11316 1
637 . 1 1 60 60 ASP H H 1 7.284 0.030 . 1 . . . . 60 ASP H . 11316 1
638 . 1 1 60 60 ASP HA H 1 4.674 0.030 . 1 . . . . 60 ASP HA . 11316 1
639 . 1 1 60 60 ASP HB2 H 1 2.812 0.030 . 1 . . . . 60 ASP HB2 . 11316 1
640 . 1 1 60 60 ASP HB3 H 1 2.812 0.030 . 1 . . . . 60 ASP HB3 . 11316 1
641 . 1 1 60 60 ASP C C 13 178.315 0.300 . 1 . . . . 60 ASP C . 11316 1
642 . 1 1 60 60 ASP CA C 13 55.952 0.300 . 1 . . . . 60 ASP CA . 11316 1
643 . 1 1 60 60 ASP CB C 13 41.084 0.300 . 1 . . . . 60 ASP CB . 11316 1
644 . 1 1 60 60 ASP N N 15 121.127 0.300 . 1 . . . . 60 ASP N . 11316 1
645 . 1 1 61 61 LEU H H 1 7.844 0.030 . 1 . . . . 61 LEU H . 11316 1
646 . 1 1 61 61 LEU HA H 1 4.128 0.030 . 1 . . . . 61 LEU HA . 11316 1
647 . 1 1 61 61 LEU HB2 H 1 2.056 0.030 . 2 . . . . 61 LEU HB2 . 11316 1
648 . 1 1 61 61 LEU HB3 H 1 1.363 0.030 . 2 . . . . 61 LEU HB3 . 11316 1
649 . 1 1 61 61 LEU HD11 H 1 1.015 0.030 . 1 . . . . 61 LEU HD1 . 11316 1
650 . 1 1 61 61 LEU HD12 H 1 1.015 0.030 . 1 . . . . 61 LEU HD1 . 11316 1
651 . 1 1 61 61 LEU HD13 H 1 1.015 0.030 . 1 . . . . 61 LEU HD1 . 11316 1
652 . 1 1 61 61 LEU HD21 H 1 0.940 0.030 . 1 . . . . 61 LEU HD2 . 11316 1
653 . 1 1 61 61 LEU HD22 H 1 0.940 0.030 . 1 . . . . 61 LEU HD2 . 11316 1
654 . 1 1 61 61 LEU HD23 H 1 0.940 0.030 . 1 . . . . 61 LEU HD2 . 11316 1
655 . 1 1 61 61 LEU HG H 1 1.665 0.030 . 1 . . . . 61 LEU HG . 11316 1
656 . 1 1 61 61 LEU C C 13 177.849 0.300 . 1 . . . . 61 LEU C . 11316 1
657 . 1 1 61 61 LEU CA C 13 58.644 0.300 . 1 . . . . 61 LEU CA . 11316 1
658 . 1 1 61 61 LEU CB C 13 40.902 0.300 . 1 . . . . 61 LEU CB . 11316 1
659 . 1 1 61 61 LEU CD1 C 13 22.954 0.300 . 2 . . . . 61 LEU CD1 . 11316 1
660 . 1 1 61 61 LEU CD2 C 13 25.955 0.300 . 2 . . . . 61 LEU CD2 . 11316 1
661 . 1 1 61 61 LEU CG C 13 27.074 0.300 . 1 . . . . 61 LEU CG . 11316 1
662 . 1 1 61 61 LEU N N 15 123.935 0.300 . 1 . . . . 61 LEU N . 11316 1
663 . 1 1 62 62 GLY H H 1 8.224 0.030 . 1 . . . . 62 GLY H . 11316 1
664 . 1 1 62 62 GLY HA2 H 1 4.001 0.030 . 2 . . . . 62 GLY HA2 . 11316 1
665 . 1 1 62 62 GLY HA3 H 1 3.747 0.030 . 2 . . . . 62 GLY HA3 . 11316 1
666 . 1 1 62 62 GLY C C 13 176.428 0.300 . 1 . . . . 62 GLY C . 11316 1
667 . 1 1 62 62 GLY CA C 13 47.826 0.300 . 1 . . . . 62 GLY CA . 11316 1
668 . 1 1 62 62 GLY N N 15 106.439 0.300 . 1 . . . . 62 GLY N . 11316 1
669 . 1 1 63 63 VAL H H 1 7.408 0.030 . 1 . . . . 63 VAL H . 11316 1
670 . 1 1 63 63 VAL HA H 1 3.695 0.030 . 1 . . . . 63 VAL HA . 11316 1
671 . 1 1 63 63 VAL HB H 1 2.124 0.030 . 1 . . . . 63 VAL HB . 11316 1
672 . 1 1 63 63 VAL HG11 H 1 1.008 0.030 . 1 . . . . 63 VAL HG1 . 11316 1
673 . 1 1 63 63 VAL HG12 H 1 1.008 0.030 . 1 . . . . 63 VAL HG1 . 11316 1
674 . 1 1 63 63 VAL HG13 H 1 1.008 0.030 . 1 . . . . 63 VAL HG1 . 11316 1
675 . 1 1 63 63 VAL HG21 H 1 1.104 0.030 . 1 . . . . 63 VAL HG2 . 11316 1
676 . 1 1 63 63 VAL HG22 H 1 1.104 0.030 . 1 . . . . 63 VAL HG2 . 11316 1
677 . 1 1 63 63 VAL HG23 H 1 1.104 0.030 . 1 . . . . 63 VAL HG2 . 11316 1
678 . 1 1 63 63 VAL C C 13 177.460 0.300 . 1 . . . . 63 VAL C . 11316 1
679 . 1 1 63 63 VAL CA C 13 66.178 0.300 . 1 . . . . 63 VAL CA . 11316 1
680 . 1 1 63 63 VAL CB C 13 32.054 0.300 . 1 . . . . 63 VAL CB . 11316 1
681 . 1 1 63 63 VAL CG1 C 13 21.089 0.300 . 2 . . . . 63 VAL CG1 . 11316 1
682 . 1 1 63 63 VAL CG2 C 13 22.264 0.300 . 2 . . . . 63 VAL CG2 . 11316 1
683 . 1 1 63 63 VAL N N 15 121.034 0.300 . 1 . . . . 63 VAL N . 11316 1
684 . 1 1 64 64 HIS H H 1 7.832 0.030 . 1 . . . . 64 HIS H . 11316 1
685 . 1 1 64 64 HIS HA H 1 4.336 0.030 . 1 . . . . 64 HIS HA . 11316 1
686 . 1 1 64 64 HIS HB2 H 1 3.551 0.030 . 2 . . . . 64 HIS HB2 . 11316 1
687 . 1 1 64 64 HIS HB3 H 1 3.286 0.030 . 2 . . . . 64 HIS HB3 . 11316 1
688 . 1 1 64 64 HIS HD2 H 1 7.290 0.030 . 1 . . . . 64 HIS HD2 . 11316 1
689 . 1 1 64 64 HIS HE1 H 1 7.844 0.030 . 1 . . . . 64 HIS HE1 . 11316 1
690 . 1 1 64 64 HIS C C 13 177.160 0.300 . 1 . . . . 64 HIS C . 11316 1
691 . 1 1 64 64 HIS CA C 13 60.226 0.300 . 1 . . . . 64 HIS CA . 11316 1
692 . 1 1 64 64 HIS CB C 13 28.166 0.300 . 1 . . . . 64 HIS CB . 11316 1
693 . 1 1 64 64 HIS CD2 C 13 127.149 0.300 . 1 . . . . 64 HIS CD2 . 11316 1
694 . 1 1 64 64 HIS CE1 C 13 139.556 0.300 . 1 . . . . 64 HIS CE1 . 11316 1
695 . 1 1 64 64 HIS N N 15 119.639 0.300 . 1 . . . . 64 HIS N . 11316 1
696 . 1 1 65 65 LEU H H 1 8.906 0.030 . 1 . . . . 65 LEU H . 11316 1
697 . 1 1 65 65 LEU HA H 1 3.853 0.030 . 1 . . . . 65 LEU HA . 11316 1
698 . 1 1 65 65 LEU HB2 H 1 1.963 0.030 . 2 . . . . 65 LEU HB2 . 11316 1
699 . 1 1 65 65 LEU HB3 H 1 1.301 0.030 . 2 . . . . 65 LEU HB3 . 11316 1
700 . 1 1 65 65 LEU HD11 H 1 0.846 0.030 . 1 . . . . 65 LEU HD1 . 11316 1
701 . 1 1 65 65 LEU HD12 H 1 0.846 0.030 . 1 . . . . 65 LEU HD1 . 11316 1
702 . 1 1 65 65 LEU HD13 H 1 0.846 0.030 . 1 . . . . 65 LEU HD1 . 11316 1
703 . 1 1 65 65 LEU HD21 H 1 1.070 0.030 . 1 . . . . 65 LEU HD2 . 11316 1
704 . 1 1 65 65 LEU HD22 H 1 1.070 0.030 . 1 . . . . 65 LEU HD2 . 11316 1
705 . 1 1 65 65 LEU HD23 H 1 1.070 0.030 . 1 . . . . 65 LEU HD2 . 11316 1
706 . 1 1 65 65 LEU HG H 1 2.026 0.030 . 1 . . . . 65 LEU HG . 11316 1
707 . 1 1 65 65 LEU C C 13 179.756 0.300 . 1 . . . . 65 LEU C . 11316 1
708 . 1 1 65 65 LEU CA C 13 58.793 0.300 . 1 . . . . 65 LEU CA . 11316 1
709 . 1 1 65 65 LEU CB C 13 41.415 0.300 . 1 . . . . 65 LEU CB . 11316 1
710 . 1 1 65 65 LEU CD1 C 13 25.852 0.300 . 2 . . . . 65 LEU CD1 . 11316 1
711 . 1 1 65 65 LEU CD2 C 13 24.243 0.300 . 2 . . . . 65 LEU CD2 . 11316 1
712 . 1 1 65 65 LEU CG C 13 26.979 0.300 . 1 . . . . 65 LEU CG . 11316 1
713 . 1 1 65 65 LEU N N 15 118.659 0.300 . 1 . . . . 65 LEU N . 11316 1
714 . 1 1 66 66 ARG H H 1 7.714 0.030 . 1 . . . . 66 ARG H . 11316 1
715 . 1 1 66 66 ARG HA H 1 4.112 0.030 . 1 . . . . 66 ARG HA . 11316 1
716 . 1 1 66 66 ARG HB2 H 1 1.898 0.030 . 1 . . . . 66 ARG HB2 . 11316 1
717 . 1 1 66 66 ARG HB3 H 1 1.898 0.030 . 1 . . . . 66 ARG HB3 . 11316 1
718 . 1 1 66 66 ARG HD2 H 1 3.170 0.030 . 1 . . . . 66 ARG HD2 . 11316 1
719 . 1 1 66 66 ARG HD3 H 1 3.170 0.030 . 1 . . . . 66 ARG HD3 . 11316 1
720 . 1 1 66 66 ARG HG2 H 1 1.574 0.030 . 2 . . . . 66 ARG HG2 . 11316 1
721 . 1 1 66 66 ARG HG3 H 1 1.766 0.030 . 2 . . . . 66 ARG HG3 . 11316 1
722 . 1 1 66 66 ARG C C 13 178.171 0.300 . 1 . . . . 66 ARG C . 11316 1
723 . 1 1 66 66 ARG CA C 13 59.017 0.300 . 1 . . . . 66 ARG CA . 11316 1
724 . 1 1 66 66 ARG CB C 13 30.556 0.300 . 1 . . . . 66 ARG CB . 11316 1
725 . 1 1 66 66 ARG CD C 13 43.444 0.300 . 1 . . . . 66 ARG CD . 11316 1
726 . 1 1 66 66 ARG CG C 13 27.675 0.300 . 1 . . . . 66 ARG CG . 11316 1
727 . 1 1 66 66 ARG N N 15 118.008 0.300 . 1 . . . . 66 ARG N . 11316 1
728 . 1 1 67 67 LYS H H 1 8.376 0.030 . 1 . . . . 67 LYS H . 11316 1
729 . 1 1 67 67 LYS HA H 1 4.082 0.030 . 1 . . . . 67 LYS HA . 11316 1
730 . 1 1 67 67 LYS HB2 H 1 1.758 0.030 . 2 . . . . 67 LYS HB2 . 11316 1
731 . 1 1 67 67 LYS HB3 H 1 1.861 0.030 . 2 . . . . 67 LYS HB3 . 11316 1
732 . 1 1 67 67 LYS HD2 H 1 1.630 0.030 . 1 . . . . 67 LYS HD2 . 11316 1
733 . 1 1 67 67 LYS HD3 H 1 1.630 0.030 . 1 . . . . 67 LYS HD3 . 11316 1
734 . 1 1 67 67 LYS HE2 H 1 2.927 0.030 . 1 . . . . 67 LYS HE2 . 11316 1
735 . 1 1 67 67 LYS HE3 H 1 2.927 0.030 . 1 . . . . 67 LYS HE3 . 11316 1
736 . 1 1 67 67 LYS HG2 H 1 1.386 0.030 . 2 . . . . 67 LYS HG2 . 11316 1
737 . 1 1 67 67 LYS HG3 H 1 1.532 0.030 . 2 . . . . 67 LYS HG3 . 11316 1
738 . 1 1 67 67 LYS C C 13 178.494 0.300 . 1 . . . . 67 LYS C . 11316 1
739 . 1 1 67 67 LYS CA C 13 58.742 0.300 . 1 . . . . 67 LYS CA . 11316 1
740 . 1 1 67 67 LYS CB C 13 33.323 0.300 . 1 . . . . 67 LYS CB . 11316 1
741 . 1 1 67 67 LYS CD C 13 29.094 0.300 . 1 . . . . 67 LYS CD . 11316 1
742 . 1 1 67 67 LYS CE C 13 42.051 0.300 . 1 . . . . 67 LYS CE . 11316 1
743 . 1 1 67 67 LYS CG C 13 25.394 0.300 . 1 . . . . 67 LYS CG . 11316 1
744 . 1 1 67 67 LYS N N 15 117.406 0.300 . 1 . . . . 67 LYS N . 11316 1
745 . 1 1 68 68 GLN H H 1 8.290 0.030 . 1 . . . . 68 GLN H . 11316 1
746 . 1 1 68 68 GLN HA H 1 4.245 0.030 . 1 . . . . 68 GLN HA . 11316 1
747 . 1 1 68 68 GLN HB2 H 1 1.102 0.030 . 2 . . . . 68 GLN HB2 . 11316 1
748 . 1 1 68 68 GLN HB3 H 1 0.902 0.030 . 2 . . . . 68 GLN HB3 . 11316 1
749 . 1 1 68 68 GLN HE21 H 1 6.845 0.030 . 2 . . . . 68 GLN HE21 . 11316 1
750 . 1 1 68 68 GLN HE22 H 1 7.393 0.030 . 2 . . . . 68 GLN HE22 . 11316 1
751 . 1 1 68 68 GLN HG2 H 1 1.975 0.030 . 1 . . . . 68 GLN HG2 . 11316 1
752 . 1 1 68 68 GLN HG3 H 1 1.975 0.030 . 1 . . . . 68 GLN HG3 . 11316 1
753 . 1 1 68 68 GLN C C 13 176.531 0.300 . 1 . . . . 68 GLN C . 11316 1
754 . 1 1 68 68 GLN CA C 13 55.390 0.300 . 1 . . . . 68 GLN CA . 11316 1
755 . 1 1 68 68 GLN CB C 13 29.134 0.300 . 1 . . . . 68 GLN CB . 11316 1
756 . 1 1 68 68 GLN CG C 13 33.928 0.300 . 1 . . . . 68 GLN CG . 11316 1
757 . 1 1 68 68 GLN N N 15 113.574 0.300 . 1 . . . . 68 GLN N . 11316 1
758 . 1 1 68 68 GLN NE2 N 15 111.958 0.300 . 1 . . . . 68 GLN NE2 . 11316 1
759 . 1 1 69 69 HIS H H 1 7.036 0.030 . 1 . . . . 69 HIS H . 11316 1
760 . 1 1 69 69 HIS HA H 1 5.089 0.030 . 1 . . . . 69 HIS HA . 11316 1
761 . 1 1 69 69 HIS HB2 H 1 3.066 0.030 . 2 . . . . 69 HIS HB2 . 11316 1
762 . 1 1 69 69 HIS HB3 H 1 3.151 0.030 . 2 . . . . 69 HIS HB3 . 11316 1
763 . 1 1 69 69 HIS HD2 H 1 6.572 0.030 . 1 . . . . 69 HIS HD2 . 11316 1
764 . 1 1 69 69 HIS HE1 H 1 7.948 0.030 . 1 . . . . 69 HIS HE1 . 11316 1
765 . 1 1 69 69 HIS C C 13 174.370 0.300 . 1 . . . . 69 HIS C . 11316 1
766 . 1 1 69 69 HIS CA C 13 53.407 0.300 . 1 . . . . 69 HIS CA . 11316 1
767 . 1 1 69 69 HIS CB C 13 28.980 0.300 . 1 . . . . 69 HIS CB . 11316 1
768 . 1 1 69 69 HIS CD2 C 13 127.702 0.300 . 1 . . . . 69 HIS CD2 . 11316 1
769 . 1 1 69 69 HIS CE1 C 13 140.022 0.300 . 1 . . . . 69 HIS CE1 . 11316 1
770 . 1 1 69 69 HIS N N 15 113.797 0.300 . 1 . . . . 69 HIS N . 11316 1
771 . 1 1 70 70 SER H H 1 7.812 0.030 . 1 . . . . 70 SER H . 11316 1
772 . 1 1 70 70 SER HA H 1 4.281 0.030 . 1 . . . . 70 SER HA . 11316 1
773 . 1 1 70 70 SER HB2 H 1 3.878 0.030 . 2 . . . . 70 SER HB2 . 11316 1
774 . 1 1 70 70 SER HB3 H 1 3.952 0.030 . 2 . . . . 70 SER HB3 . 11316 1
775 . 1 1 70 70 SER C C 13 174.172 0.300 . 1 . . . . 70 SER C . 11316 1
776 . 1 1 70 70 SER CA C 13 58.897 0.300 . 1 . . . . 70 SER CA . 11316 1
777 . 1 1 70 70 SER CB C 13 62.458 0.300 . 1 . . . . 70 SER CB . 11316 1
778 . 1 1 70 70 SER N N 15 113.291 0.300 . 1 . . . . 70 SER N . 11316 1
779 . 1 1 71 71 TYR H H 1 8.037 0.030 . 1 . . . . 71 TYR H . 11316 1
780 . 1 1 71 71 TYR HA H 1 4.536 0.030 . 1 . . . . 71 TYR HA . 11316 1
781 . 1 1 71 71 TYR HB2 H 1 2.819 0.030 . 1 . . . . 71 TYR HB2 . 11316 1
782 . 1 1 71 71 TYR HB3 H 1 2.819 0.030 . 1 . . . . 71 TYR HB3 . 11316 1
783 . 1 1 71 71 TYR HD1 H 1 7.086 0.030 . 1 . . . . 71 TYR HD1 . 11316 1
784 . 1 1 71 71 TYR HD2 H 1 7.086 0.030 . 1 . . . . 71 TYR HD2 . 11316 1
785 . 1 1 71 71 TYR HE1 H 1 6.755 0.030 . 1 . . . . 71 TYR HE1 . 11316 1
786 . 1 1 71 71 TYR HE2 H 1 6.755 0.030 . 1 . . . . 71 TYR HE2 . 11316 1
787 . 1 1 71 71 TYR C C 13 175.818 0.300 . 1 . . . . 71 TYR C . 11316 1
788 . 1 1 71 71 TYR CA C 13 58.193 0.300 . 1 . . . . 71 TYR CA . 11316 1
789 . 1 1 71 71 TYR CB C 13 38.891 0.300 . 1 . . . . 71 TYR CB . 11316 1
790 . 1 1 71 71 TYR CD1 C 13 133.174 0.300 . 1 . . . . 71 TYR CD1 . 11316 1
791 . 1 1 71 71 TYR CD2 C 13 133.174 0.300 . 1 . . . . 71 TYR CD2 . 11316 1
792 . 1 1 71 71 TYR CE1 C 13 118.300 0.300 . 1 . . . . 71 TYR CE1 . 11316 1
793 . 1 1 71 71 TYR CE2 C 13 118.300 0.300 . 1 . . . . 71 TYR CE2 . 11316 1
794 . 1 1 71 71 TYR N N 15 121.598 0.300 . 1 . . . . 71 TYR N . 11316 1
795 . 1 1 72 72 SER HA H 1 4.427 0.030 . 1 . . . . 72 SER HA . 11316 1
796 . 1 1 72 72 SER HB2 H 1 3.749 0.030 . 1 . . . . 72 SER HB2 . 11316 1
797 . 1 1 72 72 SER HB3 H 1 3.749 0.030 . 1 . . . . 72 SER HB3 . 11316 1
798 . 1 1 72 72 SER CA C 13 58.151 0.300 . 1 . . . . 72 SER CA . 11316 1
799 . 1 1 72 72 SER CB C 13 64.151 0.300 . 1 . . . . 72 SER CB . 11316 1
800 . 1 1 73 73 GLY H H 1 7.413 0.030 . 1 . . . . 73 GLY H . 11316 1
801 . 1 1 73 73 GLY HA2 H 1 3.998 0.030 . 1 . . . . 73 GLY HA2 . 11316 1
802 . 1 1 73 73 GLY HA3 H 1 3.998 0.030 . 1 . . . . 73 GLY HA3 . 11316 1
803 . 1 1 73 73 GLY CA C 13 44.588 0.300 . 1 . . . . 73 GLY CA . 11316 1
804 . 1 1 73 73 GLY N N 15 109.755 0.300 . 1 . . . . 73 GLY N . 11316 1
805 . 1 1 74 74 PRO HA H 1 4.476 0.030 . 1 . . . . 74 PRO HA . 11316 1
806 . 1 1 74 74 PRO HB2 H 1 2.287 0.030 . 2 . . . . 74 PRO HB2 . 11316 1
807 . 1 1 74 74 PRO HB3 H 1 1.972 0.030 . 2 . . . . 74 PRO HB3 . 11316 1
808 . 1 1 74 74 PRO HD2 H 1 3.602 0.030 . 1 . . . . 74 PRO HD2 . 11316 1
809 . 1 1 74 74 PRO HD3 H 1 3.602 0.030 . 1 . . . . 74 PRO HD3 . 11316 1
810 . 1 1 74 74 PRO HG2 H 1 2.002 0.030 . 1 . . . . 74 PRO HG2 . 11316 1
811 . 1 1 74 74 PRO HG3 H 1 2.002 0.030 . 1 . . . . 74 PRO HG3 . 11316 1
812 . 1 1 74 74 PRO CA C 13 63.248 0.300 . 1 . . . . 74 PRO CA . 11316 1
813 . 1 1 74 74 PRO CB C 13 32.294 0.300 . 1 . . . . 74 PRO CB . 11316 1
814 . 1 1 74 74 PRO CD C 13 49.765 0.300 . 1 . . . . 74 PRO CD . 11316 1
815 . 1 1 74 74 PRO CG C 13 27.159 0.300 . 1 . . . . 74 PRO CG . 11316 1
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