###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts
_Assigned_chem_shift_list.Entry_ID 4291
_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_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_one
_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 $sample_one . 4291 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 ALA HA H 1 4.110 0.003 . 1 . . . . . . . . 4291 1
2 . 1 1 1 1 ALA HB1 H 1 1.470 0.003 . 1 . . . . . . . . 4291 1
3 . 1 1 1 1 ALA HB2 H 1 1.470 0.003 . 1 . . . . . . . . 4291 1
4 . 1 1 1 1 ALA HB3 H 1 1.470 0.003 . 1 . . . . . . . . 4291 1
5 . 1 1 2 2 PRO HA H 1 4.642 0.001 . 1 . . . . . . . . 4291 1
6 . 1 1 2 2 PRO HB2 H 1 2.483 0.001 . 1 . . . . . . . . 4291 1
7 . 1 1 2 2 PRO HB3 H 1 2.184 0.004 . 1 . . . . . . . . 4291 1
8 . 1 1 2 2 PRO HG2 H 1 2.174 0.011 . 1 . . . . . . . . 4291 1
9 . 1 1 2 2 PRO HG3 H 1 2.174 0.011 . 1 . . . . . . . . 4291 1
10 . 1 1 2 2 PRO HD2 H 1 3.621 0.003 . 1 . . . . . . . . 4291 1
11 . 1 1 2 2 PRO HD3 H 1 3.805 0.002 . 1 . . . . . . . . 4291 1
12 . 1 1 3 3 LYS HA H 1 4.411 0.001 . 1 . . . . . . . . 4291 1
13 . 1 1 3 3 LYS HB2 H 1 1.706 0.002 . 1 . . . . . . . . 4291 1
14 . 1 1 3 3 LYS HB3 H 1 1.706 0.002 . 1 . . . . . . . . 4291 1
15 . 1 1 3 3 LYS HG2 H 1 1.468 0.000 . 1 . . . . . . . . 4291 1
16 . 1 1 3 3 LYS HG3 H 1 1.468 0.000 . 1 . . . . . . . . 4291 1
17 . 1 1 4 4 ALA H H 1 8.210 0.001 . 1 . . . . . . . . 4291 1
18 . 1 1 4 4 ALA HA H 1 3.478 0.001 . 1 . . . . . . . . 4291 1
19 . 1 1 4 4 ALA HB1 H 1 0.225 0.001 . 1 . . . . . . . . 4291 1
20 . 1 1 4 4 ALA HB2 H 1 0.225 0.001 . 1 . . . . . . . . 4291 1
21 . 1 1 4 4 ALA HB3 H 1 0.225 0.001 . 1 . . . . . . . . 4291 1
22 . 1 1 5 5 PRO HA H 1 3.784 0.002 . 1 . . . . . . . . 4291 1
23 . 1 1 5 5 PRO HB2 H 1 0.582 0.003 . 1 . . . . . . . . 4291 1
24 . 1 1 5 5 PRO HB3 H 1 1.757 0.002 . 1 . . . . . . . . 4291 1
25 . 1 1 5 5 PRO HG2 H 1 -0.392 0.002 . 1 . . . . . . . . 4291 1
26 . 1 1 5 5 PRO HG3 H 1 0.897 0.005 . 1 . . . . . . . . 4291 1
27 . 1 1 5 5 PRO HD2 H 1 -1.900 0.002 . 1 . . . . . . . . 4291 1
28 . 1 1 5 5 PRO HD3 H 1 1.884 0.006 . 1 . . . . . . . . 4291 1
29 . 1 1 6 6 ALA H H 1 7.539 0.002 . 1 . . . . . . . . 4291 1
30 . 1 1 6 6 ALA HA H 1 3.730 0.001 . 1 . . . . . . . . 4291 1
31 . 1 1 6 6 ALA HB1 H 1 1.236 0.001 . 1 . . . . . . . . 4291 1
32 . 1 1 6 6 ALA HB2 H 1 1.236 0.001 . 1 . . . . . . . . 4291 1
33 . 1 1 6 6 ALA HB3 H 1 1.236 0.001 . 1 . . . . . . . . 4291 1
34 . 1 1 7 7 ASP H H 1 8.037 0.004 . 1 . . . . . . . . 4291 1
35 . 1 1 7 7 ASP HA H 1 4.456 0.005 . 1 . . . . . . . . 4291 1
36 . 1 1 7 7 ASP HB2 H 1 2.243 0.003 . 1 . . . . . . . . 4291 1
37 . 1 1 7 7 ASP HB3 H 1 2.572 0.012 . 1 . . . . . . . . 4291 1
38 . 1 1 8 8 GLY H H 1 8.329 0.003 . 1 . . . . . . . . 4291 1
39 . 1 1 8 8 GLY HA2 H 1 3.299 0.004 . 1 . . . . . . . . 4291 1
40 . 1 1 8 8 GLY HA3 H 1 3.883 0.006 . 1 . . . . . . . . 4291 1
41 . 1 1 9 9 LEU H H 1 7.144 0.002 . 1 . . . . . . . . 4291 1
42 . 1 1 9 9 LEU HA H 1 4.226 0.004 . 1 . . . . . . . . 4291 1
43 . 1 1 9 9 LEU HB2 H 1 1.715 0.007 . 1 . . . . . . . . 4291 1
44 . 1 1 9 9 LEU HB3 H 1 2.093 0.003 . 1 . . . . . . . . 4291 1
45 . 1 1 9 9 LEU HG H 1 1.740 0.005 . 1 . . . . . . . . 4291 1
46 . 1 1 9 9 LEU HD11 H 1 0.891 0.003 . 1 . . . . . . . . 4291 1
47 . 1 1 9 9 LEU HD12 H 1 0.891 0.003 . 1 . . . . . . . . 4291 1
48 . 1 1 9 9 LEU HD13 H 1 0.891 0.003 . 1 . . . . . . . . 4291 1
49 . 1 1 9 9 LEU HD21 H 1 1.051 0.003 . 1 . . . . . . . . 4291 1
50 . 1 1 9 9 LEU HD22 H 1 1.051 0.003 . 1 . . . . . . . . 4291 1
51 . 1 1 9 9 LEU HD23 H 1 1.051 0.003 . 1 . . . . . . . . 4291 1
52 . 1 1 10 10 LYS H H 1 8.728 0.002 . 1 . . . . . . . . 4291 1
53 . 1 1 10 10 LYS HA H 1 4.672 0.005 . 1 . . . . . . . . 4291 1
54 . 1 1 10 10 LYS HB2 H 1 1.824 0.004 . 1 . . . . . . . . 4291 1
55 . 1 1 10 10 LYS HB3 H 1 1.824 0.004 . 1 . . . . . . . . 4291 1
56 . 1 1 10 10 LYS HG2 H 1 1.408 0.004 . 1 . . . . . . . . 4291 1
57 . 1 1 10 10 LYS HG3 H 1 1.353 0.006 . 1 . . . . . . . . 4291 1
58 . 1 1 10 10 LYS HD2 H 1 1.717 0.001 . 1 . . . . . . . . 4291 1
59 . 1 1 10 10 LYS HD3 H 1 1.717 0.001 . 1 . . . . . . . . 4291 1
60 . 1 1 10 10 LYS HE2 H 1 2.949 0.008 . 1 . . . . . . . . 4291 1
61 . 1 1 10 10 LYS HE3 H 1 2.988 0.002 . 1 . . . . . . . . 4291 1
62 . 1 1 11 11 MET H H 1 9.808 0.002 . 1 . . . . . . . . 4291 1
63 . 1 1 11 11 MET HA H 1 4.841 0.001 . 1 . . . . . . . . 4291 1
64 . 1 1 11 11 MET HB2 H 1 3.038 0.004 . 1 . . . . . . . . 4291 1
65 . 1 1 11 11 MET HB3 H 1 3.038 0.004 . 1 . . . . . . . . 4291 1
66 . 1 1 11 11 MET HG2 H 1 3.233 0.006 . 1 . . . . . . . . 4291 1
67 . 1 1 11 11 MET HG3 H 1 3.233 0.006 . 1 . . . . . . . . 4291 1
68 . 1 1 11 11 MET HE1 H 1 3.193 0.005 . 1 . . . . . . . . 4291 1
69 . 1 1 11 11 MET HE2 H 1 3.193 0.005 . 1 . . . . . . . . 4291 1
70 . 1 1 11 11 MET HE3 H 1 3.193 0.005 . 1 . . . . . . . . 4291 1
71 . 1 1 12 12 GLU H H 1 8.839 0.004 . 1 . . . . . . . . 4291 1
72 . 1 1 12 12 GLU HA H 1 5.392 0.003 . 1 . . . . . . . . 4291 1
73 . 1 1 12 12 GLU HB2 H 1 1.841 0.005 . 1 . . . . . . . . 4291 1
74 . 1 1 12 12 GLU HB3 H 1 2.297 0.004 . 1 . . . . . . . . 4291 1
75 . 1 1 12 12 GLU HG2 H 1 2.398 0.001 . 1 . . . . . . . . 4291 1
76 . 1 1 12 12 GLU HG3 H 1 2.463 0.001 . 1 . . . . . . . . 4291 1
77 . 1 1 13 13 ALA H H 1 0.945 0.002 . 1 . . . . . . . . 4291 1
78 . 1 1 13 13 ALA HA H 1 4.509 0.002 . 1 . . . . . . . . 4291 1
79 . 1 1 13 13 ALA HB1 H 1 1.440 0.002 . 1 . . . . . . . . 4291 1
80 . 1 1 13 13 ALA HB2 H 1 1.440 0.002 . 1 . . . . . . . . 4291 1
81 . 1 1 13 13 ALA HB3 H 1 1.440 0.002 . 1 . . . . . . . . 4291 1
82 . 1 1 14 14 THR H H 1 10.818 0.004 . 1 . . . . . . . . 4291 1
83 . 1 1 14 14 THR HA H 1 5.183 0.004 . 1 . . . . . . . . 4291 1
84 . 1 1 14 14 THR HB H 1 5.230 0.005 . 1 . . . . . . . . 4291 1
85 . 1 1 14 14 THR HG1 H 1 8.315 0.004 . 1 . . . . . . . . 4291 1
86 . 1 1 14 14 THR HG21 H 1 2.063 0.004 . 1 . . . . . . . . 4291 1
87 . 1 1 14 14 THR HG22 H 1 2.063 0.004 . 1 . . . . . . . . 4291 1
88 . 1 1 14 14 THR HG23 H 1 2.063 0.004 . 1 . . . . . . . . 4291 1
89 . 1 1 15 15 LYS H H 1 8.481 0.004 . 1 . . . . . . . . 4291 1
90 . 1 1 15 15 LYS HA H 1 4.507 0.004 . 1 . . . . . . . . 4291 1
91 . 1 1 15 15 LYS HB2 H 1 2.121 0.002 . 1 . . . . . . . . 4291 1
92 . 1 1 15 15 LYS HB3 H 1 2.221 0.005 . 1 . . . . . . . . 4291 1
93 . 1 1 15 15 LYS HG2 H 1 1.783 0.005 . 1 . . . . . . . . 4291 1
94 . 1 1 15 15 LYS HG3 H 1 1.783 0.005 . 1 . . . . . . . . 4291 1
95 . 1 1 15 15 LYS HD2 H 1 1.886 0.008 . 1 . . . . . . . . 4291 1
96 . 1 1 15 15 LYS HD3 H 1 1.886 0.008 . 1 . . . . . . . . 4291 1
97 . 1 1 15 15 LYS HE2 H 1 3.197 0.008 . 1 . . . . . . . . 4291 1
98 . 1 1 15 15 LYS HE3 H 1 3.197 0.008 . 1 . . . . . . . . 4291 1
99 . 1 1 16 16 GLN H H 1 9.388 0.004 . 1 . . . . . . . . 4291 1
100 . 1 1 16 16 GLN HA H 1 4.500 0.001 . 1 . . . . . . . . 4291 1
101 . 1 1 16 16 GLN HB2 H 1 1.283 0.005 . 1 . . . . . . . . 4291 1
102 . 1 1 16 16 GLN HB3 H 1 0.622 0.005 . 1 . . . . . . . . 4291 1
103 . 1 1 16 16 GLN HG2 H 1 1.677 0.003 . 1 . . . . . . . . 4291 1
104 . 1 1 16 16 GLN HG3 H 1 1.866 0.008 . 1 . . . . . . . . 4291 1
105 . 1 1 16 16 GLN HE21 H 1 2.298 0.003 . 1 . . . . . . . . 4291 1
106 . 1 1 16 16 GLN HE22 H 1 4.939 0.002 . 1 . . . . . . . . 4291 1
107 . 1 1 17 17 PRO HA H 1 5.394 0.004 . 1 . . . . . . . . 4291 1
108 . 1 1 17 17 PRO HB2 H 1 2.402 0.002 . 1 . . . . . . . . 4291 1
109 . 1 1 17 17 PRO HB3 H 1 1.762 0.006 . 1 . . . . . . . . 4291 1
110 . 1 1 17 17 PRO HG2 H 1 1.987 0.004 . 1 . . . . . . . . 4291 1
111 . 1 1 17 17 PRO HG3 H 1 1.987 0.004 . 1 . . . . . . . . 4291 1
112 . 1 1 17 17 PRO HD2 H 1 3.403 0.004 . 1 . . . . . . . . 4291 1
113 . 1 1 17 17 PRO HD3 H 1 3.403 0.004 . 1 . . . . . . . . 4291 1
114 . 1 1 18 18 VAL H H 1 9.120 0.005 . 1 . . . . . . . . 4291 1
115 . 1 1 18 18 VAL HA H 1 4.363 0.002 . 1 . . . . . . . . 4291 1
116 . 1 1 18 18 VAL HB H 1 2.481 0.004 . 1 . . . . . . . . 4291 1
117 . 1 1 18 18 VAL HG11 H 1 1.739 0.003 . 1 . . . . . . . . 4291 1
118 . 1 1 18 18 VAL HG12 H 1 1.739 0.003 . 1 . . . . . . . . 4291 1
119 . 1 1 18 18 VAL HG13 H 1 1.739 0.003 . 1 . . . . . . . . 4291 1
120 . 1 1 18 18 VAL HG21 H 1 0.153 0.001 . 1 . . . . . . . . 4291 1
121 . 1 1 18 18 VAL HG22 H 1 0.153 0.001 . 1 . . . . . . . . 4291 1
122 . 1 1 18 18 VAL HG23 H 1 0.153 0.001 . 1 . . . . . . . . 4291 1
123 . 1 1 19 19 VAL H H 1 8.271 0.004 . 1 . . . . . . . . 4291 1
124 . 1 1 19 19 VAL HA H 1 4.650 0.005 . 1 . . . . . . . . 4291 1
125 . 1 1 19 19 VAL HB H 1 2.054 0.005 . 1 . . . . . . . . 4291 1
126 . 1 1 19 19 VAL HG11 H 1 0.740 0.003 . 1 . . . . . . . . 4291 1
127 . 1 1 19 19 VAL HG12 H 1 0.740 0.003 . 1 . . . . . . . . 4291 1
128 . 1 1 19 19 VAL HG13 H 1 0.740 0.003 . 1 . . . . . . . . 4291 1
129 . 1 1 19 19 VAL HG21 H 1 0.954 0.003 . 1 . . . . . . . . 4291 1
130 . 1 1 19 19 VAL HG22 H 1 0.954 0.003 . 1 . . . . . . . . 4291 1
131 . 1 1 19 19 VAL HG23 H 1 0.954 0.003 . 1 . . . . . . . . 4291 1
132 . 1 1 20 20 PHE H H 1 9.509 0.002 . 1 . . . . . . . . 4291 1
133 . 1 1 20 20 PHE HA H 1 4.669 0.004 . 1 . . . . . . . . 4291 1
134 . 1 1 20 20 PHE HB2 H 1 3.328 0.000 . 1 . . . . . . . . 4291 1
135 . 1 1 20 20 PHE HB3 H 1 2.734 0.001 . 1 . . . . . . . . 4291 1
136 . 1 1 20 20 PHE HD1 H 1 4.886 0.003 . 1 . . . . . . . . 4291 1
137 . 1 1 20 20 PHE HD2 H 1 7.066 0.007 . 1 . . . . . . . . 4291 1
138 . 1 1 20 20 PHE HE1 H 1 0.735 0.006 . 1 . . . . . . . . 4291 1
139 . 1 1 20 20 PHE HE2 H 1 3.697 0.002 . 1 . . . . . . . . 4291 1
140 . 1 1 20 20 PHE HZ H 1 4.543 0.005 . 1 . . . . . . . . 4291 1
141 . 1 1 21 21 ASN H H 1 7.885 0.004 . 1 . . . . . . . . 4291 1
142 . 1 1 21 21 ASN HA H 1 4.140 0.006 . 1 . . . . . . . . 4291 1
143 . 1 1 21 21 ASN HB2 H 1 1.652 0.011 . 1 . . . . . . . . 4291 1
144 . 1 1 21 21 ASN HB3 H 1 2.045 0.008 . 1 . . . . . . . . 4291 1
145 . 1 1 21 21 ASN HD21 H 1 8.594 0.003 . 1 . . . . . . . . 4291 1
146 . 1 1 21 21 ASN HD22 H 1 6.482 0.003 . 1 . . . . . . . . 4291 1
147 . 1 1 22 22 HIS H H 1 7.597 0.005 . 1 . . . . . . . . 4291 1
148 . 1 1 22 22 HIS HA H 1 1.490 0.003 . 1 . . . . . . . . 4291 1
149 . 1 1 22 22 HIS HB2 H 1 1.050 0.006 . 1 . . . . . . . . 4291 1
150 . 1 1 22 22 HIS HB3 H 1 1.285 0.005 . 1 . . . . . . . . 4291 1
151 . 1 1 22 22 HIS HD1 H 1 9.294 0.002 . 1 . . . . . . . . 4291 1
152 . 1 1 22 22 HIS HD2 H 1 0.725 0.004 . 1 . . . . . . . . 4291 1
153 . 1 1 22 22 HIS HE1 H 1 1.523 0.002 . 1 . . . . . . . . 4291 1
154 . 1 1 23 23 SER H H 1 9.038 0.007 . 1 . . . . . . . . 4291 1
155 . 1 1 23 23 SER HA H 1 3.455 0.002 . 1 . . . . . . . . 4291 1
156 . 1 1 23 23 SER HB2 H 1 3.307 0.001 . 1 . . . . . . . . 4291 1
157 . 1 1 23 23 SER HB3 H 1 3.457 0.000 . 1 . . . . . . . . 4291 1
158 . 1 1 24 24 THR H H 1 5.763 0.002 . 1 . . . . . . . . 4291 1
159 . 1 1 24 24 THR HA H 1 3.304 0.002 . 1 . . . . . . . . 4291 1
160 . 1 1 24 24 THR HB H 1 2.616 0.003 . 1 . . . . . . . . 4291 1
161 . 1 1 24 24 THR HG21 H 1 -0.134 0.004 . 1 . . . . . . . . 4291 1
162 . 1 1 24 24 THR HG22 H 1 -0.134 0.004 . 1 . . . . . . . . 4291 1
163 . 1 1 24 24 THR HG23 H 1 -0.134 0.004 . 1 . . . . . . . . 4291 1
164 . 1 1 25 25 HIS H H 1 5.896 0.002 . 1 . . . . . . . . 4291 1
165 . 1 1 25 25 HIS HA H 1 3.042 0.004 . 1 . . . . . . . . 4291 1
166 . 1 1 25 25 HIS HB2 H 1 0.794 0.005 . 1 . . . . . . . . 4291 1
167 . 1 1 25 25 HIS HB3 H 1 2.332 0.004 . 1 . . . . . . . . 4291 1
168 . 1 1 25 25 HIS HD1 H 1 6.758 0.003 . 1 . . . . . . . . 4291 1
169 . 1 1 25 25 HIS HD2 H 1 1.004 0.003 . 1 . . . . . . . . 4291 1
170 . 1 1 25 25 HIS HE1 H 1 1.627 0.008 . 1 . . . . . . . . 4291 1
171 . 1 1 26 26 LYS H H 1 6.442 0.002 . 1 . . . . . . . . 4291 1
172 . 1 1 26 26 LYS HA H 1 4.177 0.003 . 1 . . . . . . . . 4291 1
173 . 1 1 26 26 LYS HB2 H 1 1.801 0.007 . 1 . . . . . . . . 4291 1
174 . 1 1 26 26 LYS HB3 H 1 1.697 0.004 . 1 . . . . . . . . 4291 1
175 . 1 1 26 26 LYS HG2 H 1 1.300 0.004 . 1 . . . . . . . . 4291 1
176 . 1 1 26 26 LYS HG3 H 1 1.365 0.004 . 1 . . . . . . . . 4291 1
177 . 1 1 26 26 LYS HD2 H 1 1.699 0.001 . 1 . . . . . . . . 4291 1
178 . 1 1 26 26 LYS HD3 H 1 1.583 0.008 . 1 . . . . . . . . 4291 1
179 . 1 1 26 26 LYS HE2 H 1 2.926 0.001 . 1 . . . . . . . . 4291 1
180 . 1 1 26 26 LYS HE3 H 1 2.926 0.001 . 1 . . . . . . . . 4291 1
181 . 1 1 27 27 SER HA H 1 4.493 0.000 . 1 . . . . . . . . 4291 1
182 . 1 1 27 27 SER HB2 H 1 4.045 0.001 . 1 . . . . . . . . 4291 1
183 . 1 1 27 27 SER HB3 H 1 4.192 0.003 . 1 . . . . . . . . 4291 1
184 . 1 1 28 28 VAL H H 1 8.062 0.003 . 1 . . . . . . . . 4291 1
185 . 1 1 28 28 VAL HA H 1 4.500 0.003 . 1 . . . . . . . . 4291 1
186 . 1 1 28 28 VAL HB H 1 2.698 0.004 . 1 . . . . . . . . 4291 1
187 . 1 1 28 28 VAL HG11 H 1 1.756 0.003 . 1 . . . . . . . . 4291 1
188 . 1 1 28 28 VAL HG12 H 1 1.756 0.003 . 1 . . . . . . . . 4291 1
189 . 1 1 28 28 VAL HG13 H 1 1.756 0.003 . 1 . . . . . . . . 4291 1
190 . 1 1 28 28 VAL HG21 H 1 1.360 0.001 . 1 . . . . . . . . 4291 1
191 . 1 1 28 28 VAL HG22 H 1 1.360 0.001 . 1 . . . . . . . . 4291 1
192 . 1 1 28 28 VAL HG23 H 1 1.360 0.001 . 1 . . . . . . . . 4291 1
193 . 1 1 29 29 LYS H H 1 8.775 0.002 . 1 . . . . . . . . 4291 1
194 . 1 1 29 29 LYS HA H 1 4.640 0.001 . 1 . . . . . . . . 4291 1
195 . 1 1 29 29 LYS HB2 H 1 1.842 0.006 . 1 . . . . . . . . 4291 1
196 . 1 1 29 29 LYS HB3 H 1 1.920 0.002 . 1 . . . . . . . . 4291 1
197 . 1 1 29 29 LYS HG2 H 1 1.658 0.002 . 1 . . . . . . . . 4291 1
198 . 1 1 29 29 LYS HG3 H 1 1.658 0.002 . 1 . . . . . . . . 4291 1
199 . 1 1 29 29 LYS HD2 H 1 1.777 0.001 . 1 . . . . . . . . 4291 1
200 . 1 1 29 29 LYS HD3 H 1 1.777 0.001 . 1 . . . . . . . . 4291 1
201 . 1 1 29 29 LYS HE2 H 1 3.086 0.000 . 1 . . . . . . . . 4291 1
202 . 1 1 29 29 LYS HE3 H 1 3.086 0.000 . 1 . . . . . . . . 4291 1
203 . 1 1 30 30 CYS H H 1 8.428 0.002 . 1 . . . . . . . . 4291 1
204 . 1 1 30 30 CYS HA H 1 5.176 0.002 . 1 . . . . . . . . 4291 1
205 . 1 1 30 30 CYS HB2 H 1 2.512 0.003 . 1 . . . . . . . . 4291 1
206 . 1 1 30 30 CYS HB3 H 1 2.512 0.003 . 1 . . . . . . . . 4291 1
207 . 1 1 31 31 GLY H H 1 8.373 0.002 . 1 . . . . . . . . 4291 1
208 . 1 1 31 31 GLY HA2 H 1 3.253 0.003 . 1 . . . . . . . . 4291 1
209 . 1 1 31 31 GLY HA3 H 1 3.138 0.003 . 1 . . . . . . . . 4291 1
210 . 1 1 32 32 ASP H H 1 7.803 0.004 . 1 . . . . . . . . 4291 1
211 . 1 1 32 32 ASP HA H 1 4.381 0.002 . 1 . . . . . . . . 4291 1
212 . 1 1 32 32 ASP HB2 H 1 2.818 0.003 . 1 . . . . . . . . 4291 1
213 . 1 1 32 32 ASP HB3 H 1 3.181 0.002 . 1 . . . . . . . . 4291 1
214 . 1 1 33 33 CYS H H 1 6.294 0.005 . 1 . . . . . . . . 4291 1
215 . 1 1 33 33 CYS HA H 1 4.570 0.006 . 1 . . . . . . . . 4291 1
216 . 1 1 33 33 CYS HB2 H 1 1.369 0.005 . 1 . . . . . . . . 4291 1
217 . 1 1 33 33 CYS HB3 H 1 2.196 0.005 . 1 . . . . . . . . 4291 1
218 . 1 1 34 34 HIS H H 1 6.381 0.003 . 1 . . . . . . . . 4291 1
219 . 1 1 34 34 HIS HA H 1 2.227 0.006 . 1 . . . . . . . . 4291 1
220 . 1 1 34 34 HIS HB2 H 1 0.707 0.006 . 1 . . . . . . . . 4291 1
221 . 1 1 34 34 HIS HB3 H 1 0.972 0.006 . 1 . . . . . . . . 4291 1
222 . 1 1 34 34 HIS HD1 H 1 9.362 0.002 . 1 . . . . . . . . 4291 1
223 . 1 1 34 34 HIS HD2 H 1 0.573 0.002 . 1 . . . . . . . . 4291 1
224 . 1 1 34 34 HIS HE1 H 1 1.208 0.002 . 1 . . . . . . . . 4291 1
225 . 1 1 35 35 HIS H H 1 4.477 0.002 . 1 . . . . . . . . 4291 1
226 . 1 1 35 35 HIS HA H 1 3.062 0.004 . 1 . . . . . . . . 4291 1
227 . 1 1 35 35 HIS HB2 H 1 -0.049 0.004 . 1 . . . . . . . . 4291 1
228 . 1 1 35 35 HIS HB3 H 1 0.236 0.002 . 1 . . . . . . . . 4291 1
229 . 1 1 35 35 HIS HD1 H 1 7.101 0.002 . 1 . . . . . . . . 4291 1
230 . 1 1 35 35 HIS HD2 H 1 0.778 0.003 . 1 . . . . . . . . 4291 1
231 . 1 1 35 35 HIS HE1 H 1 0.998 0.003 . 1 . . . . . . . . 4291 1
232 . 1 1 36 36 PRO HA H 1 3.567 0.002 . 1 . . . . . . . . 4291 1
233 . 1 1 36 36 PRO HB2 H 1 1.142 0.005 . 1 . . . . . . . . 4291 1
234 . 1 1 36 36 PRO HB3 H 1 1.420 0.002 . 1 . . . . . . . . 4291 1
235 . 1 1 36 36 PRO HG2 H 1 1.463 0.003 . 1 . . . . . . . . 4291 1
236 . 1 1 36 36 PRO HG3 H 1 1.463 0.003 . 1 . . . . . . . . 4291 1
237 . 1 1 36 36 PRO HD2 H 1 2.440 0.004 . 1 . . . . . . . . 4291 1
238 . 1 1 36 36 PRO HD3 H 1 3.006 0.004 . 1 . . . . . . . . 4291 1
239 . 1 1 37 37 VAL H H 1 7.803 0.002 . 1 . . . . . . . . 4291 1
240 . 1 1 37 37 VAL HA H 1 3.597 0.002 . 1 . . . . . . . . 4291 1
241 . 1 1 37 37 VAL HB H 1 1.428 0.001 . 1 . . . . . . . . 4291 1
242 . 1 1 37 37 VAL HG11 H 1 0.869 0.004 . 1 . . . . . . . . 4291 1
243 . 1 1 37 37 VAL HG12 H 1 0.869 0.004 . 1 . . . . . . . . 4291 1
244 . 1 1 37 37 VAL HG13 H 1 0.869 0.004 . 1 . . . . . . . . 4291 1
245 . 1 1 37 37 VAL HG21 H 1 -0.259 0.002 . 1 . . . . . . . . 4291 1
246 . 1 1 37 37 VAL HG22 H 1 -0.259 0.002 . 1 . . . . . . . . 4291 1
247 . 1 1 37 37 VAL HG23 H 1 -0.259 0.002 . 1 . . . . . . . . 4291 1
248 . 1 1 38 38 ASN HA H 1 4.312 0.000 . 1 . . . . . . . . 4291 1
249 . 1 1 38 38 ASN HB2 H 1 2.747 0.000 . 1 . . . . . . . . 4291 1
250 . 1 1 38 38 ASN HB3 H 1 3.019 0.001 . 1 . . . . . . . . 4291 1
251 . 1 1 39 39 GLY HA2 H 1 3.403 0.001 . 1 . . . . . . . . 4291 1
252 . 1 1 39 39 GLY HA3 H 1 3.971 0.001 . 1 . . . . . . . . 4291 1
253 . 1 1 40 40 LYS H H 1 7.423 0.006 . 1 . . . . . . . . 4291 1
254 . 1 1 40 40 LYS HA H 1 4.372 0.001 . 1 . . . . . . . . 4291 1
255 . 1 1 40 40 LYS HB2 H 1 1.559 0.003 . 1 . . . . . . . . 4291 1
256 . 1 1 40 40 LYS HB3 H 1 1.559 0.003 . 1 . . . . . . . . 4291 1
257 . 1 1 40 40 LYS HG2 H 1 1.177 0.001 . 1 . . . . . . . . 4291 1
258 . 1 1 40 40 LYS HG3 H 1 1.177 0.001 . 1 . . . . . . . . 4291 1
259 . 1 1 40 40 LYS HD2 H 1 1.572 0.002 . 1 . . . . . . . . 4291 1
260 . 1 1 40 40 LYS HD3 H 1 1.572 0.002 . 1 . . . . . . . . 4291 1
261 . 1 1 40 40 LYS HE2 H 1 2.911 0.002 . 1 . . . . . . . . 4291 1
262 . 1 1 40 40 LYS HE3 H 1 2.911 0.002 . 1 . . . . . . . . 4291 1
263 . 1 1 41 41 GLU HA H 1 3.654 0.005 . 1 . . . . . . . . 4291 1
264 . 1 1 41 41 GLU HB2 H 1 1.418 0.002 . 1 . . . . . . . . 4291 1
265 . 1 1 41 41 GLU HB3 H 1 1.418 0.002 . 1 . . . . . . . . 4291 1
266 . 1 1 41 41 GLU HG2 H 1 1.653 0.005 . 1 . . . . . . . . 4291 1
267 . 1 1 41 41 GLU HG3 H 1 1.653 0.005 . 1 . . . . . . . . 4291 1
268 . 1 1 42 42 ASP H H 1 7.550 0.007 . 1 . . . . . . . . 4291 1
269 . 1 1 42 42 ASP HA H 1 3.953 0.001 . 1 . . . . . . . . 4291 1
270 . 1 1 42 42 ASP HB2 H 1 1.994 0.002 . 1 . . . . . . . . 4291 1
271 . 1 1 42 42 ASP HB3 H 1 2.079 0.002 . 1 . . . . . . . . 4291 1
272 . 1 1 43 43 TYR H H 1 7.650 0.005 . 1 . . . . . . . . 4291 1
273 . 1 1 43 43 TYR HA H 1 2.550 0.003 . 1 . . . . . . . . 4291 1
274 . 1 1 43 43 TYR HB2 H 1 1.029 0.001 . 1 . . . . . . . . 4291 1
275 . 1 1 43 43 TYR HB3 H 1 1.029 0.001 . 1 . . . . . . . . 4291 1
276 . 1 1 43 43 TYR HD1 H 1 5.533 0.001 . 1 . . . . . . . . 4291 1
277 . 1 1 43 43 TYR HD2 H 1 5.533 0.001 . 1 . . . . . . . . 4291 1
278 . 1 1 43 43 TYR HE1 H 1 6.069 0.001 . 1 . . . . . . . . 4291 1
279 . 1 1 43 43 TYR HE2 H 1 6.069 0.001 . 1 . . . . . . . . 4291 1
280 . 1 1 44 44 ARG H H 1 6.780 0.003 . 1 . . . . . . . . 4291 1
281 . 1 1 44 44 ARG HA H 1 4.845 0.003 . 1 . . . . . . . . 4291 1
282 . 1 1 44 44 ARG HB2 H 1 1.763 0.007 . 1 . . . . . . . . 4291 1
283 . 1 1 44 44 ARG HB3 H 1 2.093 0.005 . 1 . . . . . . . . 4291 1
284 . 1 1 44 44 ARG HG2 H 1 1.517 0.005 . 1 . . . . . . . . 4291 1
285 . 1 1 44 44 ARG HG3 H 1 1.651 0.004 . 1 . . . . . . . . 4291 1
286 . 1 1 44 44 ARG HD2 H 1 3.302 0.005 . 1 . . . . . . . . 4291 1
287 . 1 1 44 44 ARG HD3 H 1 3.302 0.005 . 1 . . . . . . . . 4291 1
288 . 1 1 45 45 LYS H H 1 9.006 0.002 . 1 . . . . . . . . 4291 1
289 . 1 1 45 45 LYS HA H 1 4.951 0.003 . 1 . . . . . . . . 4291 1
290 . 1 1 45 45 LYS HB2 H 1 2.324 0.003 . 1 . . . . . . . . 4291 1
291 . 1 1 45 45 LYS HB3 H 1 2.586 0.005 . 1 . . . . . . . . 4291 1
292 . 1 1 45 45 LYS HG2 H 1 2.454 0.005 . 1 . . . . . . . . 4291 1
293 . 1 1 45 45 LYS HG3 H 1 2.251 0.004 . 1 . . . . . . . . 4291 1
294 . 1 1 45 45 LYS HD2 H 1 2.252 0.004 . 1 . . . . . . . . 4291 1
295 . 1 1 45 45 LYS HD3 H 1 2.252 0.004 . 1 . . . . . . . . 4291 1
296 . 1 1 45 45 LYS HE2 H 1 3.510 0.005 . 1 . . . . . . . . 4291 1
297 . 1 1 45 45 LYS HE3 H 1 3.510 0.005 . 1 . . . . . . . . 4291 1
298 . 1 1 46 46 CYS H H 1 8.983 0.003 . 1 . . . . . . . . 4291 1
299 . 1 1 46 46 CYS HA H 1 4.981 0.006 . 1 . . . . . . . . 4291 1
300 . 1 1 46 46 CYS HB2 H 1 2.464 0.003 . 1 . . . . . . . . 4291 1
301 . 1 1 46 46 CYS HB3 H 1 2.464 0.003 . 1 . . . . . . . . 4291 1
302 . 1 1 47 47 GLY H H 1 8.826 0.002 . 1 . . . . . . . . 4291 1
303 . 1 1 47 47 GLY HA2 H 1 4.159 0.006 . 1 . . . . . . . . 4291 1
304 . 1 1 47 47 GLY HA3 H 1 3.445 0.000 . 1 . . . . . . . . 4291 1
305 . 1 1 48 48 THR H H 1 7.156 0.002 . 1 . . . . . . . . 4291 1
306 . 1 1 48 48 THR HA H 1 3.915 0.002 . 1 . . . . . . . . 4291 1
307 . 1 1 48 48 THR HB H 1 4.158 0.007 . 1 . . . . . . . . 4291 1
308 . 1 1 48 48 THR HG21 H 1 1.509 0.003 . 1 . . . . . . . . 4291 1
309 . 1 1 48 48 THR HG22 H 1 1.509 0.003 . 1 . . . . . . . . 4291 1
310 . 1 1 48 48 THR HG23 H 1 1.509 0.003 . 1 . . . . . . . . 4291 1
311 . 1 1 49 49 ALA H H 1 8.381 0.002 . 1 . . . . . . . . 4291 1
312 . 1 1 49 49 ALA HA H 1 4.188 0.003 . 1 . . . . . . . . 4291 1
313 . 1 1 49 49 ALA HB1 H 1 1.428 0.002 . 1 . . . . . . . . 4291 1
314 . 1 1 49 49 ALA HB2 H 1 1.428 0.002 . 1 . . . . . . . . 4291 1
315 . 1 1 49 49 ALA HB3 H 1 1.428 0.002 . 1 . . . . . . . . 4291 1
316 . 1 1 50 50 GLY H H 1 8.828 0.003 . 1 . . . . . . . . 4291 1
317 . 1 1 50 50 GLY HA2 H 1 3.662 0.002 . 1 . . . . . . . . 4291 1
318 . 1 1 50 50 GLY HA3 H 1 4.425 0.002 . 1 . . . . . . . . 4291 1
319 . 1 1 51 51 CYS H H 1 8.248 0.003 . 1 . . . . . . . . 4291 1
320 . 1 1 51 51 CYS HA H 1 4.101 0.005 . 1 . . . . . . . . 4291 1
321 . 1 1 51 51 CYS HB2 H 1 2.702 0.00 . 1 . . . . . . . . 4291 1
322 . 1 1 51 51 CYS HB3 H 1 1.594 0.005 . 1 . . . . . . . . 4291 1
323 . 1 1 52 52 HIS H H 1 6.328 0.003 . 1 . . . . . . . . 4291 1
324 . 1 1 52 52 HIS HA H 1 3.545 0.002 . 1 . . . . . . . . 4291 1
325 . 1 1 52 52 HIS HB2 H 1 1.566 0.005 . 1 . . . . . . . . 4291 1
326 . 1 1 52 52 HIS HB3 H 1 1.017 0.003 . 1 . . . . . . . . 4291 1
327 . 1 1 52 52 HIS HD1 H 1 7.907 0.002 . 1 . . . . . . . . 4291 1
328 . 1 1 52 52 HIS HD2 H 1 0.854 0.003 . 1 . . . . . . . . 4291 1
329 . 1 1 52 52 HIS HE1 H 1 1.232 0.002 . 1 . . . . . . . . 4291 1
330 . 1 1 53 53 ASP H H 1 7.086 0.004 . 1 . . . . . . . . 4291 1
331 . 1 1 53 53 ASP HA H 1 4.287 0.002 . 1 . . . . . . . . 4291 1
332 . 1 1 53 53 ASP HB2 H 1 2.087 0.003 . 1 . . . . . . . . 4291 1
333 . 1 1 53 53 ASP HB3 H 1 2.877 0.007 . 1 . . . . . . . . 4291 1
334 . 1 1 54 54 SER H H 1 7.861 0.003 . 1 . . . . . . . . 4291 1
335 . 1 1 54 54 SER HA H 1 4.607 0.003 . 1 . . . . . . . . 4291 1
336 . 1 1 54 54 SER HB2 H 1 3.439 0.003 . 1 . . . . . . . . 4291 1
337 . 1 1 54 54 SER HB3 H 1 3.604 0.004 . 1 . . . . . . . . 4291 1
338 . 1 1 55 55 MET HA H 1 4.817 0.002 . 1 . . . . . . . . 4291 1
339 . 1 1 55 55 MET HB2 H 1 1.972 0.005 . 1 . . . . . . . . 4291 1
340 . 1 1 55 55 MET HB3 H 1 2.952 0.001 . 1 . . . . . . . . 4291 1
341 . 1 1 55 55 MET HG2 H 1 2.278 0.003 . 1 . . . . . . . . 4291 1
342 . 1 1 55 55 MET HG3 H 1 2.401 0.004 . 1 . . . . . . . . 4291 1
343 . 1 1 55 55 MET HE1 H 1 1.681 0.002 . 1 . . . . . . . . 4291 1
344 . 1 1 55 55 MET HE2 H 1 1.681 0.002 . 1 . . . . . . . . 4291 1
345 . 1 1 55 55 MET HE3 H 1 1.681 0.002 . 1 . . . . . . . . 4291 1
346 . 1 1 56 56 ASP H H 1 7.003 0.001 . 1 . . . . . . . . 4291 1
347 . 1 1 56 56 ASP HA H 1 4.659 0.001 . 1 . . . . . . . . 4291 1
348 . 1 1 56 56 ASP HB2 H 1 2.628 0.002 . 1 . . . . . . . . 4291 1
349 . 1 1 56 56 ASP HB3 H 1 2.679 0.001 . 1 . . . . . . . . 4291 1
350 . 1 1 57 57 LYS HA H 1 3.906 0.002 . 1 . . . . . . . . 4291 1
351 . 1 1 57 57 LYS HB2 H 1 1.295 0.003 . 1 . . . . . . . . 4291 1
352 . 1 1 57 57 LYS HB3 H 1 1.023 0.001 . 1 . . . . . . . . 4291 1
353 . 1 1 57 57 LYS HG2 H 1 1.427 0.001 . 1 . . . . . . . . 4291 1
354 . 1 1 57 57 LYS HG3 H 1 1.171 0.001 . 1 . . . . . . . . 4291 1
355 . 1 1 58 58 LYS HA H 1 4.033 0.001 . 1 . . . . . . . . 4291 1
356 . 1 1 58 58 LYS HB2 H 1 1.789 0.001 . 1 . . . . . . . . 4291 1
357 . 1 1 58 58 LYS HB3 H 1 1.789 0.001 . 1 . . . . . . . . 4291 1
358 . 1 1 58 58 LYS HG2 H 1 1.311 0.000 . 1 . . . . . . . . 4291 1
359 . 1 1 58 58 LYS HG3 H 1 1.345 0.001 . 1 . . . . . . . . 4291 1
360 . 1 1 59 59 ASP H H 1 7.647 0.002 . 1 . . . . . . . . 4291 1
361 . 1 1 59 59 ASP HA H 1 4.221 0.003 . 1 . . . . . . . . 4291 1
362 . 1 1 59 59 ASP HB2 H 1 2.455 0.003 . 1 . . . . . . . . 4291 1
363 . 1 1 59 59 ASP HB3 H 1 3.012 0.003 . 1 . . . . . . . . 4291 1
364 . 1 1 60 60 LYS HA H 1 3.749 0.005 . 1 . . . . . . . . 4291 1
365 . 1 1 60 60 LYS HB2 H 1 1.398 0.001 . 1 . . . . . . . . 4291 1
366 . 1 1 60 60 LYS HB3 H 1 1.640 0.003 . 1 . . . . . . . . 4291 1
367 . 1 1 60 60 LYS HG2 H 1 1.300 0.001 . 1 . . . . . . . . 4291 1
368 . 1 1 60 60 LYS HG3 H 1 1.300 0.001 . 1 . . . . . . . . 4291 1
369 . 1 1 60 60 LYS HD2 H 1 1.508 0.004 . 1 . . . . . . . . 4291 1
370 . 1 1 60 60 LYS HD3 H 1 1.508 0.004 . 1 . . . . . . . . 4291 1
371 . 1 1 61 61 SER HA H 1 4.313 0.002 . 1 . . . . . . . . 4291 1
372 . 1 1 61 61 SER HB2 H 1 4.100 0.004 . 1 . . . . . . . . 4291 1
373 . 1 1 61 61 SER HB3 H 1 3.880 0.002 . 1 . . . . . . . . 4291 1
374 . 1 1 62 62 ALA H H 1 8.493 0.002 . 1 . . . . . . . . 4291 1
375 . 1 1 62 62 ALA HA H 1 3.747 0.005 . 1 . . . . . . . . 4291 1
376 . 1 1 62 62 ALA HB1 H 1 1.613 0.004 . 1 . . . . . . . . 4291 1
377 . 1 1 62 62 ALA HB2 H 1 1.613 0.004 . 1 . . . . . . . . 4291 1
378 . 1 1 62 62 ALA HB3 H 1 1.613 0.004 . 1 . . . . . . . . 4291 1
379 . 1 1 63 63 LYS H H 1 7.159 0.003 . 1 . . . . . . . . 4291 1
380 . 1 1 63 63 LYS HA H 1 3.269 0.002 . 1 . . . . . . . . 4291 1
381 . 1 1 63 63 LYS HB2 H 1 1.462 0.008 . 1 . . . . . . . . 4291 1
382 . 1 1 63 63 LYS HB3 H 1 1.462 0.008 . 1 . . . . . . . . 4291 1
383 . 1 1 63 63 LYS HG2 H 1 1.231 0.004 . 1 . . . . . . . . 4291 1
384 . 1 1 63 63 LYS HG3 H 1 1.279 0.010 . 1 . . . . . . . . 4291 1
385 . 1 1 64 64 GLY H H 1 7.487 0.004 . 1 . . . . . . . . 4291 1
386 . 1 1 64 64 GLY HA2 H 1 3.618 0.001 . 1 . . . . . . . . 4291 1
387 . 1 1 64 64 GLY HA3 H 1 3.361 0.003 . 1 . . . . . . . . 4291 1
388 . 1 1 65 65 TYR H H 1 7.771 0.003 . 1 . . . . . . . . 4291 1
389 . 1 1 65 65 TYR HA H 1 3.267 0.003 . 1 . . . . . . . . 4291 1
390 . 1 1 65 65 TYR HB2 H 1 2.585 0.002 . 1 . . . . . . . . 4291 1
391 . 1 1 65 65 TYR HB3 H 1 2.670 0.003 . 1 . . . . . . . . 4291 1
392 . 1 1 65 65 TYR HD1 H 1 6.886 0.002 . 1 . . . . . . . . 4291 1
393 . 1 1 65 65 TYR HE1 H 1 7.056 0.000 . 1 . . . . . . . . 4291 1
394 . 1 1 66 66 TYR H H 1 9.042 0.002 . 1 . . . . . . . . 4291 1
395 . 1 1 66 66 TYR HA H 1 2.763 0.001 . 1 . . . . . . . . 4291 1
396 . 1 1 66 66 TYR HB2 H 1 2.703 0.004 . 1 . . . . . . . . 4291 1
397 . 1 1 66 66 TYR HB3 H 1 2.763 0.002 . 1 . . . . . . . . 4291 1
398 . 1 1 66 66 TYR HD1 H 1 6.033 0.002 . 1 . . . . . . . . 4291 1
399 . 1 1 66 66 TYR HE1 H 1 4.827 0.002 . 1 . . . . . . . . 4291 1
400 . 1 1 67 67 HIS H H 1 8.037 0.002 . 1 . . . . . . . . 4291 1
401 . 1 1 67 67 HIS HA H 1 3.744 0.003 . 1 . . . . . . . . 4291 1
402 . 1 1 67 67 HIS HB2 H 1 3.073 0.004 . 1 . . . . . . . . 4291 1
403 . 1 1 67 67 HIS HB3 H 1 3.073 0.004 . 1 . . . . . . . . 4291 1
404 . 1 1 67 67 HIS HD2 H 1 6.630 0.003 . 1 . . . . . . . . 4291 1
405 . 1 1 67 67 HIS HE1 H 1 8.204 0.005 . 1 . . . . . . . . 4291 1
406 . 1 1 68 68 VAL H H 1 6.860 0.002 . 1 . . . . . . . . 4291 1
407 . 1 1 68 68 VAL HA H 1 3.438 0.001 . 1 . . . . . . . . 4291 1
408 . 1 1 68 68 VAL HB H 1 1.929 0.003 . 1 . . . . . . . . 4291 1
409 . 1 1 68 68 VAL HG11 H 1 0.973 0.002 . 1 . . . . . . . . 4291 1
410 . 1 1 68 68 VAL HG12 H 1 0.973 0.002 . 1 . . . . . . . . 4291 1
411 . 1 1 68 68 VAL HG13 H 1 0.973 0.002 . 1 . . . . . . . . 4291 1
412 . 1 1 68 68 VAL HG21 H 1 0.974 0.003 . 1 . . . . . . . . 4291 1
413 . 1 1 68 68 VAL HG22 H 1 0.974 0.003 . 1 . . . . . . . . 4291 1
414 . 1 1 68 68 VAL HG23 H 1 0.974 0.003 . 1 . . . . . . . . 4291 1
415 . 1 1 69 69 MET H H 1 6.033 0.005 . 1 . . . . . . . . 4291 1
416 . 1 1 69 69 MET HA H 1 4.720 0.003 . 1 . . . . . . . . 4291 1
417 . 1 1 69 69 MET HB2 H 1 0.251 0.004 . 1 . . . . . . . . 4291 1
418 . 1 1 69 69 MET HB3 H 1 0.705 0.004 . 1 . . . . . . . . 4291 1
419 . 1 1 69 69 MET HG2 H 1 2.029 0.003 . 1 . . . . . . . . 4291 1
420 . 1 1 69 69 MET HG3 H 1 2.029 0.003 . 1 . . . . . . . . 4291 1
421 . 1 1 69 69 MET HE1 H 1 1.645 0.005 . 1 . . . . . . . . 4291 1
422 . 1 1 69 69 MET HE2 H 1 1.645 0.005 . 1 . . . . . . . . 4291 1
423 . 1 1 69 69 MET HE3 H 1 1.645 0.005 . 1 . . . . . . . . 4291 1
424 . 1 1 70 70 HIS H H 1 5.850 0.002 . 1 . . . . . . . . 4291 1
425 . 1 1 70 70 HIS HA H 1 2.760 0.002 . 1 . . . . . . . . 4291 1
426 . 1 1 70 70 HIS HB2 H 1 0.402 0.004 . 1 . . . . . . . . 4291 1
427 . 1 1 70 70 HIS HB3 H 1 1.109 0.004 . 1 . . . . . . . . 4291 1
428 . 1 1 70 70 HIS HD1 H 1 7.578 0.003 . 1 . . . . . . . . 4291 1
429 . 1 1 70 70 HIS HD2 H 1 0.251 0.001 . 1 . . . . . . . . 4291 1
430 . 1 1 70 70 HIS HE1 H 1 0.745 0.001 . 1 . . . . . . . . 4291 1
431 . 1 1 71 71 ASP H H 1 7.578 0.003 . 1 . . . . . . . . 4291 1
432 . 1 1 71 71 ASP HA H 1 0.251 0.001 . 1 . . . . . . . . 4291 1
433 . 1 1 71 71 ASP HB2 H 1 0.745 0.001 . 1 . . . . . . . . 4291 1
434 . 1 1 71 71 ASP HB3 H 1 0.745 0.001 . 1 . . . . . . . . 4291 1
435 . 1 1 72 72 LYS HA H 1 4.181 0.002 . 1 . . . . . . . . 4291 1
436 . 1 1 72 72 LYS HB2 H 1 1.860 0.001 . 1 . . . . . . . . 4291 1
437 . 1 1 72 72 LYS HB3 H 1 1.860 0.001 . 1 . . . . . . . . 4291 1
438 . 1 1 72 72 LYS HG2 H 1 1.322 0.002 . 1 . . . . . . . . 4291 1
439 . 1 1 72 72 LYS HG3 H 1 1.181 0.002 . 1 . . . . . . . . 4291 1
440 . 1 1 72 72 LYS HD2 H 1 1.606 0.003 . 1 . . . . . . . . 4291 1
441 . 1 1 72 72 LYS HD3 H 1 1.606 0.003 . 1 . . . . . . . . 4291 1
442 . 1 1 72 72 LYS HE2 H 1 2.861 0.002 . 1 . . . . . . . . 4291 1
443 . 1 1 72 72 LYS HE3 H 1 2.861 0.002 . 1 . . . . . . . . 4291 1
444 . 1 1 73 73 ASN HA H 1 4.810 0.001 . 1 . . . . . . . . 4291 1
445 . 1 1 73 73 ASN HB2 H 1 2.970 0.001 . 1 . . . . . . . . 4291 1
446 . 1 1 73 73 ASN HB3 H 1 2.852 0.001 . 1 . . . . . . . . 4291 1
447 . 1 1 74 74 THR H H 1 7.351 0.001 . 1 . . . . . . . . 4291 1
448 . 1 1 74 74 THR HA H 1 4.508 0.001 . 1 . . . . . . . . 4291 1
449 . 1 1 74 74 THR HB H 1 4.923 0.004 . 1 . . . . . . . . 4291 1
450 . 1 1 74 74 THR HG21 H 1 0.901 0.003 . 1 . . . . . . . . 4291 1
451 . 1 1 74 74 THR HG22 H 1 0.901 0.003 . 1 . . . . . . . . 4291 1
452 . 1 1 74 74 THR HG23 H 1 0.901 0.003 . 1 . . . . . . . . 4291 1
453 . 1 1 75 75 LYS H H 1 9.630 0.003 . 1 . . . . . . . . 4291 1
454 . 1 1 75 75 LYS HA H 1 3.961 0.003 . 1 . . . . . . . . 4291 1
455 . 1 1 75 75 LYS HB2 H 1 1.840 0.004 . 1 . . . . . . . . 4291 1
456 . 1 1 75 75 LYS HB3 H 1 1.482 0.004 . 1 . . . . . . . . 4291 1
457 . 1 1 75 75 LYS HG2 H 1 0.603 0.004 . 1 . . . . . . . . 4291 1
458 . 1 1 75 75 LYS HG3 H 1 0.899 0.006 . 1 . . . . . . . . 4291 1
459 . 1 1 75 75 LYS HD2 H 1 1.374 0.003 . 1 . . . . . . . . 4291 1
460 . 1 1 75 75 LYS HD3 H 1 1.374 0.003 . 1 . . . . . . . . 4291 1
461 . 1 1 75 75 LYS HE2 H 1 2.742 0.001 . 1 . . . . . . . . 4291 1
462 . 1 1 75 75 LYS HE3 H 1 2.742 0.001 . 1 . . . . . . . . 4291 1
463 . 1 1 76 76 PHE H H 1 6.626 0.004 . 1 . . . . . . . . 4291 1
464 . 1 1 76 76 PHE HA H 1 4.843 0.002 . 1 . . . . . . . . 4291 1
465 . 1 1 76 76 PHE HB2 H 1 1.760 0.006 . 1 . . . . . . . . 4291 1
466 . 1 1 76 76 PHE HB3 H 1 2.812 0.004 . 1 . . . . . . . . 4291 1
467 . 1 1 76 76 PHE HD1 H 1 5.767 0.002 . 1 . . . . . . . . 4291 1
468 . 1 1 76 76 PHE HD2 H 1 5.767 0.002 . 1 . . . . . . . . 4291 1
469 . 1 1 76 76 PHE HE1 H 1 6.084 0.002 . 1 . . . . . . . . 4291 1
470 . 1 1 76 76 PHE HE2 H 1 6.084 0.002 . 1 . . . . . . . . 4291 1
471 . 1 1 76 76 PHE HZ H 1 6.461 0.004 . 1 . . . . . . . . 4291 1
472 . 1 1 77 77 LYS H H 1 8.645 0.004 . 1 . . . . . . . . 4291 1
473 . 1 1 77 77 LYS HA H 1 4.566 0.007 . 1 . . . . . . . . 4291 1
474 . 1 1 77 77 LYS HB2 H 1 2.546 0.006 . 1 . . . . . . . . 4291 1
475 . 1 1 77 77 LYS HB3 H 1 2.207 0.005 . 1 . . . . . . . . 4291 1
476 . 1 1 77 77 LYS HG2 H 1 1.901 0.007 . 1 . . . . . . . . 4291 1
477 . 1 1 77 77 LYS HG3 H 1 1.901 0.007 . 1 . . . . . . . . 4291 1
478 . 1 1 77 77 LYS HD2 H 1 2.012 0.006 . 1 . . . . . . . . 4291 1
479 . 1 1 77 77 LYS HD3 H 1 2.012 0.006 . 1 . . . . . . . . 4291 1
480 . 1 1 77 77 LYS HE2 H 1 3.222 0.001 . 1 . . . . . . . . 4291 1
481 . 1 1 77 77 LYS HE3 H 1 3.222 0.001 . 1 . . . . . . . . 4291 1
482 . 1 1 78 78 SER H H 1 8.123 0.006 . 1 . . . . . . . . 4291 1
483 . 1 1 78 78 SER HA H 1 5.745 0.004 . 1 . . . . . . . . 4291 1
484 . 1 1 78 78 SER HB2 H 1 3.732 0.002 . 1 . . . . . . . . 4291 1
485 . 1 1 78 78 SER HB3 H 1 3.818 0.001 . 1 . . . . . . . . 4291 1
486 . 1 1 78 78 SER HG H 1 4.787 0.000 . 1 . . . . . . . . 4291 1
487 . 1 1 79 79 CYS H H 1 7.984 0.003 . 1 . . . . . . . . 4291 1
488 . 1 1 79 79 CYS HA H 1 4.622 0.003 . 1 . . . . . . . . 4291 1
489 . 1 1 79 79 CYS HB2 H 1 2.688 0.003 . 1 . . . . . . . . 4291 1
490 . 1 1 79 79 CYS HB3 H 1 2.346 0.003 . 1 . . . . . . . . 4291 1
491 . 1 1 80 80 VAL H H 1 6.628 0.003 . 1 . . . . . . . . 4291 1
492 . 1 1 80 80 VAL HA H 1 2.417 0.008 . 1 . . . . . . . . 4291 1
493 . 1 1 80 80 VAL HB H 1 1.187 0.004 . 1 . . . . . . . . 4291 1
494 . 1 1 80 80 VAL HG11 H 1 0.537 0.002 . 1 . . . . . . . . 4291 1
495 . 1 1 80 80 VAL HG12 H 1 0.537 0.002 . 1 . . . . . . . . 4291 1
496 . 1 1 80 80 VAL HG13 H 1 0.537 0.002 . 1 . . . . . . . . 4291 1
497 . 1 1 80 80 VAL HG21 H 1 0.041 0.002 . 1 . . . . . . . . 4291 1
498 . 1 1 80 80 VAL HG22 H 1 0.041 0.002 . 1 . . . . . . . . 4291 1
499 . 1 1 80 80 VAL HG23 H 1 0.041 0.002 . 1 . . . . . . . . 4291 1
500 . 1 1 81 81 GLY H H 1 7.781 0.000 . 1 . . . . . . . . 4291 1
501 . 1 1 81 81 GLY HA2 H 1 4.047 0.003 . 1 . . . . . . . . 4291 1
502 . 1 1 81 81 GLY HA3 H 1 3.291 0.007 . 1 . . . . . . . . 4291 1
503 . 1 1 82 82 CYS H H 1 8.464 0.003 . 1 . . . . . . . . 4291 1
504 . 1 1 82 82 CYS HA H 1 4.511 0.002 . 1 . . . . . . . . 4291 1
505 . 1 1 82 82 CYS HB2 H 1 3.605 0.003 . 1 . . . . . . . . 4291 1
506 . 1 1 82 82 CYS HB3 H 1 3.001 0.006 . 1 . . . . . . . . 4291 1
507 . 1 1 83 83 HIS H H 1 7.312 0.002 . 1 . . . . . . . . 4291 1
508 . 1 1 83 83 HIS HA H 1 2.818 0.002 . 1 . . . . . . . . 4291 1
509 . 1 1 83 83 HIS HB2 H 1 1.869 0.005 . 1 . . . . . . . . 4291 1
510 . 1 1 83 83 HIS HB3 H 1 1.471 0.007 . 1 . . . . . . . . 4291 1
511 . 1 1 83 83 HIS HD1 H 1 9.650 0.003 . 1 . . . . . . . . 4291 1
512 . 1 1 83 83 HIS HD2 H 1 1.005 0.004 . 1 . . . . . . . . 4291 1
513 . 1 1 83 83 HIS HE1 H 1 1.438 0.003 . 1 . . . . . . . . 4291 1
514 . 1 1 84 84 VAL H H 1 8.329 0.004 . 1 . . . . . . . . 4291 1
515 . 1 1 84 84 VAL HA H 1 3.394 0.002 . 1 . . . . . . . . 4291 1
516 . 1 1 84 84 VAL HB H 1 2.036 0.004 . 1 . . . . . . . . 4291 1
517 . 1 1 84 84 VAL HG11 H 1 0.899 0.004 . 1 . . . . . . . . 4291 1
518 . 1 1 84 84 VAL HG12 H 1 0.899 0.004 . 1 . . . . . . . . 4291 1
519 . 1 1 84 84 VAL HG13 H 1 0.899 0.004 . 1 . . . . . . . . 4291 1
520 . 1 1 84 84 VAL HG21 H 1 0.988 0.003 . 1 . . . . . . . . 4291 1
521 . 1 1 84 84 VAL HG22 H 1 0.988 0.003 . 1 . . . . . . . . 4291 1
522 . 1 1 84 84 VAL HG23 H 1 0.988 0.003 . 1 . . . . . . . . 4291 1
523 . 1 1 85 85 GLU H H 1 7.119 0.004 . 1 . . . . . . . . 4291 1
524 . 1 1 85 85 GLU HA H 1 4.123 0.002 . 1 . . . . . . . . 4291 1
525 . 1 1 85 85 GLU HB2 H 1 2.312 0.006 . 1 . . . . . . . . 4291 1
526 . 1 1 85 85 GLU HB3 H 1 2.393 0.003 . 1 . . . . . . . . 4291 1
527 . 1 1 85 85 GLU HG2 H 1 2.530 0.003 . 1 . . . . . . . . 4291 1
528 . 1 1 85 85 GLU HG3 H 1 2.352 0.000 . 1 . . . . . . . . 4291 1
529 . 1 1 86 86 VAL H H 1 8.135 0.003 . 1 . . . . . . . . 4291 1
530 . 1 1 86 86 VAL HA H 1 3.744 0.002 . 1 . . . . . . . . 4291 1
531 . 1 1 86 86 VAL HB H 1 1.718 0.003 . 1 . . . . . . . . 4291 1
532 . 1 1 86 86 VAL HG11 H 1 1.028 0.002 . 1 . . . . . . . . 4291 1
533 . 1 1 86 86 VAL HG12 H 1 1.028 0.002 . 1 . . . . . . . . 4291 1
534 . 1 1 86 86 VAL HG13 H 1 1.028 0.002 . 1 . . . . . . . . 4291 1
535 . 1 1 86 86 VAL HG21 H 1 1.447 0.002 . 1 . . . . . . . . 4291 1
536 . 1 1 86 86 VAL HG22 H 1 1.447 0.002 . 1 . . . . . . . . 4291 1
537 . 1 1 86 86 VAL HG23 H 1 1.447 0.002 . 1 . . . . . . . . 4291 1
538 . 1 1 87 87 ALA H H 1 8.364 0.000 . 1 . . . . . . . . 4291 1
539 . 1 1 87 87 ALA HA H 1 3.796 0.003 . 1 . . . . . . . . 4291 1
540 . 1 1 87 87 ALA HB1 H 1 1.103 0.003 . 1 . . . . . . . . 4291 1
541 . 1 1 87 87 ALA HB2 H 1 1.103 0.003 . 1 . . . . . . . . 4291 1
542 . 1 1 87 87 ALA HB3 H 1 1.103 0.003 . 1 . . . . . . . . 4291 1
543 . 1 1 88 88 GLY H H 1 7.220 0.004 . 1 . . . . . . . . 4291 1
544 . 1 1 88 88 GLY HA2 H 1 3.824 0.000 . 1 . . . . . . . . 4291 1
545 . 1 1 88 88 GLY HA3 H 1 3.788 0.002 . 1 . . . . . . . . 4291 1
546 . 1 1 89 89 ALA HA H 1 4.461 0.002 . 1 . . . . . . . . 4291 1
547 . 1 1 89 89 ALA HB1 H 1 1.455 0.001 . 1 . . . . . . . . 4291 1
548 . 1 1 89 89 ALA HB2 H 1 1.455 0.001 . 1 . . . . . . . . 4291 1
549 . 1 1 89 89 ALA HB3 H 1 1.455 0.001 . 1 . . . . . . . . 4291 1
550 . 1 1 90 90 ASP H H 1 7.729 0.001 . 1 . . . . . . . . 4291 1
551 . 1 1 90 90 ASP HA H 1 4.596 0.002 . 1 . . . . . . . . 4291 1
552 . 1 1 90 90 ASP HB2 H 1 2.664 0.005 . 1 . . . . . . . . 4291 1
553 . 1 1 90 90 ASP HB3 H 1 3.195 0.002 . 1 . . . . . . . . 4291 1
554 . 1 1 91 91 ALA HA H 1 3.948 0.003 . 1 . . . . . . . . 4291 1
555 . 1 1 91 91 ALA HB1 H 1 1.537 0.002 . 1 . . . . . . . . 4291 1
556 . 1 1 91 91 ALA HB2 H 1 1.537 0.002 . 1 . . . . . . . . 4291 1
557 . 1 1 91 91 ALA HB3 H 1 1.537 0.002 . 1 . . . . . . . . 4291 1
558 . 1 1 92 92 ALA HA H 1 4.197 0.003 . 1 . . . . . . . . 4291 1
559 . 1 1 92 92 ALA HB1 H 1 1.569 0.002 . 1 . . . . . . . . 4291 1
560 . 1 1 92 92 ALA HB2 H 1 1.569 0.002 . 1 . . . . . . . . 4291 1
561 . 1 1 92 92 ALA HB3 H 1 1.569 0.002 . 1 . . . . . . . . 4291 1
562 . 1 1 93 93 LYS H H 1 8.153 0.004 . 1 . . . . . . . . 4291 1
563 . 1 1 93 93 LYS HA H 1 4.133 0.003 . 1 . . . . . . . . 4291 1
564 . 1 1 93 93 LYS HB2 H 1 1.987 0.003 . 1 . . . . . . . . 4291 1
565 . 1 1 93 93 LYS HB3 H 1 1.651 0.002 . 1 . . . . . . . . 4291 1
566 . 1 1 93 93 LYS HG2 H 1 1.499 0.010 . 1 . . . . . . . . 4291 1
567 . 1 1 93 93 LYS HG3 H 1 1.499 0.010 . 1 . . . . . . . . 4291 1
568 . 1 1 93 93 LYS HD2 H 1 1.786 0.001 . 1 . . . . . . . . 4291 1
569 . 1 1 93 93 LYS HD3 H 1 1.786 0.001 . 1 . . . . . . . . 4291 1
570 . 1 1 93 93 LYS HE2 H 1 3.074 0.007 . 1 . . . . . . . . 4291 1
571 . 1 1 93 93 LYS HE3 H 1 3.074 0.007 . 1 . . . . . . . . 4291 1
572 . 1 1 94 94 LYS H H 1 8.737 0.002 . 1 . . . . . . . . 4291 1
573 . 1 1 94 94 LYS HA H 1 3.534 0.002 . 1 . . . . . . . . 4291 1
574 . 1 1 94 94 LYS HB2 H 1 1.785 0.003 . 1 . . . . . . . . 4291 1
575 . 1 1 94 94 LYS HB3 H 1 1.785 0.003 . 1 . . . . . . . . 4291 1
576 . 1 1 94 94 LYS HG2 H 1 1.233 0.002 . 1 . . . . . . . . 4291 1
577 . 1 1 94 94 LYS HG3 H 1 1.233 0.002 . 1 . . . . . . . . 4291 1
578 . 1 1 94 94 LYS HD2 H 1 1.469 0.008 . 1 . . . . . . . . 4291 1
579 . 1 1 94 94 LYS HD3 H 1 1.469 0.008 . 1 . . . . . . . . 4291 1
580 . 1 1 94 94 LYS HE2 H 1 2.922 0.004 . 1 . . . . . . . . 4291 1
581 . 1 1 94 94 LYS HE3 H 1 2.922 0.004 . 1 . . . . . . . . 4291 1
582 . 1 1 95 95 LYS H H 1 7.743 0.009 . 1 . . . . . . . . 4291 1
583 . 1 1 95 95 LYS HA H 1 4.023 0.003 . 1 . . . . . . . . 4291 1
584 . 1 1 95 95 LYS HB2 H 1 1.982 0.005 . 1 . . . . . . . . 4291 1
585 . 1 1 95 95 LYS HB3 H 1 2.054 0.006 . 1 . . . . . . . . 4291 1
586 . 1 1 95 95 LYS HG2 H 1 1.533 0.002 . 1 . . . . . . . . 4291 1
587 . 1 1 95 95 LYS HG3 H 1 1.646 0.008 . 1 . . . . . . . . 4291 1
588 . 1 1 95 95 LYS HD2 H 1 1.784 0.008 . 1 . . . . . . . . 4291 1
589 . 1 1 95 95 LYS HD3 H 1 1.784 0.008 . 1 . . . . . . . . 4291 1
590 . 1 1 95 95 LYS HE2 H 1 3.075 0.003 . 1 . . . . . . . . 4291 1
591 . 1 1 95 95 LYS HE3 H 1 3.075 0.003 . 1 . . . . . . . . 4291 1
592 . 1 1 96 96 ASP H H 1 7.869 0.003 . 1 . . . . . . . . 4291 1
593 . 1 1 96 96 ASP HA H 1 4.509 0.002 . 1 . . . . . . . . 4291 1
594 . 1 1 96 96 ASP HB2 H 1 2.813 0.003 . 1 . . . . . . . . 4291 1
595 . 1 1 96 96 ASP HB3 H 1 2.509 0.002 . 1 . . . . . . . . 4291 1
596 . 1 1 97 97 LEU H H 1 8.377 0.004 . 1 . . . . . . . . 4291 1
597 . 1 1 97 97 LEU HA H 1 4.126 0.004 . 1 . . . . . . . . 4291 1
598 . 1 1 97 97 LEU HB2 H 1 1.170 0.008 . 1 . . . . . . . . 4291 1
599 . 1 1 97 97 LEU HB3 H 1 0.028 0.005 . 1 . . . . . . . . 4291 1
600 . 1 1 97 97 LEU HG H 1 1.373 0.003 . 1 . . . . . . . . 4291 1
601 . 1 1 97 97 LEU HD11 H 1 0.032 0.004 . 1 . . . . . . . . 4291 1
602 . 1 1 97 97 LEU HD12 H 1 0.032 0.004 . 1 . . . . . . . . 4291 1
603 . 1 1 97 97 LEU HD13 H 1 0.032 0.004 . 1 . . . . . . . . 4291 1
604 . 1 1 97 97 LEU HD21 H 1 -0.150 0.003 . 1 . . . . . . . . 4291 1
605 . 1 1 97 97 LEU HD22 H 1 -0.150 0.003 . 1 . . . . . . . . 4291 1
606 . 1 1 97 97 LEU HD23 H 1 -0.150 0.003 . 1 . . . . . . . . 4291 1
607 . 1 1 98 98 THR H H 1 7.768 0.005 . 1 . . . . . . . . 4291 1
608 . 1 1 98 98 THR HA H 1 5.043 0.005 . 1 . . . . . . . . 4291 1
609 . 1 1 98 98 THR HB H 1 4.409 0.002 . 1 . . . . . . . . 4291 1
610 . 1 1 98 98 THR HG21 H 1 0.762 0.003 . 1 . . . . . . . . 4291 1
611 . 1 1 98 98 THR HG22 H 1 0.762 0.003 . 1 . . . . . . . . 4291 1
612 . 1 1 98 98 THR HG23 H 1 0.762 0.003 . 1 . . . . . . . . 4291 1
613 . 1 1 99 99 GLY H H 1 7.451 0.002 . 1 . . . . . . . . 4291 1
614 . 1 1 99 99 GLY HA2 H 1 4.382 0.003 . 1 . . . . . . . . 4291 1
615 . 1 1 99 99 GLY HA3 H 1 4.559 0.003 . 1 . . . . . . . . 4291 1
616 . 1 1 100 100 CYS H H 1 9.004 0.002 . 1 . . . . . . . . 4291 1
617 . 1 1 100 100 CYS HA H 1 4.755 0.001 . 1 . . . . . . . . 4291 1
618 . 1 1 100 100 CYS HB2 H 1 3.613 0.003 . 1 . . . . . . . . 4291 1
619 . 1 1 100 100 CYS HB3 H 1 2.910 0.006 . 1 . . . . . . . . 4291 1
620 . 1 1 101 101 LYS HA H 1 4.017 0.003 . 1 . . . . . . . . 4291 1
621 . 1 1 101 101 LYS HB2 H 1 1.587 0.011 . 1 . . . . . . . . 4291 1
622 . 1 1 101 101 LYS HB3 H 1 1.494 0.006 . 1 . . . . . . . . 4291 1
623 . 1 1 101 101 LYS HG2 H 1 1.263 0.004 . 1 . . . . . . . . 4291 1
624 . 1 1 101 101 LYS HG3 H 1 1.137 0.002 . 1 . . . . . . . . 4291 1
625 . 1 1 101 101 LYS HD2 H 1 1.497 0.005 . 1 . . . . . . . . 4291 1
626 . 1 1 101 101 LYS HD3 H 1 1.497 0.005 . 1 . . . . . . . . 4291 1
627 . 1 1 101 101 LYS HE2 H 1 2.717 0.001 . 1 . . . . . . . . 4291 1
628 . 1 1 101 101 LYS HE3 H 1 2.845 0.005 . 1 . . . . . . . . 4291 1
629 . 1 1 102 102 LYS H H 1 8.514 0.003 . 1 . . . . . . . . 4291 1
630 . 1 1 102 102 LYS HA H 1 3.955 0.002 . 1 . . . . . . . . 4291 1
631 . 1 1 102 102 LYS HB2 H 1 1.925 0.004 . 1 . . . . . . . . 4291 1
632 . 1 1 102 102 LYS HB3 H 1 1.925 0.004 . 1 . . . . . . . . 4291 1
633 . 1 1 102 102 LYS HG2 H 1 1.358 0.001 . 1 . . . . . . . . 4291 1
634 . 1 1 102 102 LYS HG3 H 1 1.358 0.001 . 1 . . . . . . . . 4291 1
635 . 1 1 102 102 LYS HD2 H 1 1.696 0.004 . 1 . . . . . . . . 4291 1
636 . 1 1 102 102 LYS HD3 H 1 1.696 0.004 . 1 . . . . . . . . 4291 1
637 . 1 1 103 103 SER H H 1 8.399 0.004 . 1 . . . . . . . . 4291 1
638 . 1 1 103 103 SER HA H 1 5.090 0.003 . 1 . . . . . . . . 4291 1
639 . 1 1 103 103 SER HB2 H 1 4.352 0.004 . 1 . . . . . . . . 4291 1
640 . 1 1 103 103 SER HB3 H 1 3.573 0.000 . 1 . . . . . . . . 4291 1
641 . 1 1 103 103 SER HG H 1 4.158 0.002 . 1 . . . . . . . . 4291 1
642 . 1 1 104 104 LYS H H 1 9.678 0.003 . 1 . . . . . . . . 4291 1
643 . 1 1 104 104 LYS HA H 1 4.303 0.005 . 1 . . . . . . . . 4291 1
644 . 1 1 104 104 LYS HB2 H 1 2.128 0.003 . 1 . . . . . . . . 4291 1
645 . 1 1 104 104 LYS HB3 H 1 2.594 0.002 . 1 . . . . . . . . 4291 1
646 . 1 1 104 104 LYS HG2 H 1 1.609 0.003 . 1 . . . . . . . . 4291 1
647 . 1 1 104 104 LYS HG3 H 1 1.805 0.004 . 1 . . . . . . . . 4291 1
648 . 1 1 104 104 LYS HD2 H 1 1.916 0.003 . 1 . . . . . . . . 4291 1
649 . 1 1 104 104 LYS HD3 H 1 2.030 0.001 . 1 . . . . . . . . 4291 1
650 . 1 1 104 104 LYS HE2 H 1 3.050 0.000 . 1 . . . . . . . . 4291 1
651 . 1 1 104 104 LYS HE3 H 1 3.145 0.003 . 1 . . . . . . . . 4291 1
652 . 1 1 105 105 CYS H H 1 6.982 0.001 . 1 . . . . . . . . 4291 1
653 . 1 1 105 105 CYS HA H 1 4.583 0.004 . 1 . . . . . . . . 4291 1
654 . 1 1 105 105 CYS HB2 H 1 1.379 0.004 . 1 . . . . . . . . 4291 1
655 . 1 1 105 105 CYS HB3 H 1 1.317 0.002 . 1 . . . . . . . . 4291 1
656 . 1 1 106 106 HIS H H 1 5.975 0.002 . 1 . . . . . . . . 4291 1
657 . 1 1 106 106 HIS HA H 1 3.854 0.001 . 1 . . . . . . . . 4291 1
658 . 1 1 106 106 HIS HB2 H 1 1.287 0.003 . 1 . . . . . . . . 4291 1
659 . 1 1 106 106 HIS HB3 H 1 1.287 0.003 . 1 . . . . . . . . 4291 1
660 . 1 1 106 106 HIS HD1 H 1 9.354 0.004 . 1 . . . . . . . . 4291 1
661 . 1 1 106 106 HIS HD2 H 1 0.847 0.003 . 1 . . . . . . . . 4291 1
662 . 1 1 106 106 HIS HE1 H 1 2.112 0.004 . 1 . . . . . . . . 4291 1
663 . 1 1 107 107 GLU H H 1 7.841 0.003 . 1 . . . . . . . . 4291 1
664 . 1 1 107 107 GLU HA H 1 3.818 0.002 . 1 . . . . . . . . 4291 1
665 . 1 1 107 107 GLU HB2 H 1 1.754 0.000 . 1 . . . . . . . . 4291 1
666 . 1 1 107 107 GLU HB3 H 1 1.754 0.000 . 1 . . . . . . . . 4291 1
667 . 1 1 107 107 GLU HG2 H 1 2.118 0.001 . 1 . . . . . . . . 4291 1
668 . 1 1 107 107 GLU HG3 H 1 2.118 0.001 . 1 . . . . . . . . 4291 1
stop_
save_