###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 51152
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'aSyn Pi55 323K'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_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 HN(CA)CO' . . . 51152 1
2 '3D HNCA' . . . 51152 1
3 '3D HN(CO)CA' . . . 51152 1
4 '3D HNCACB' . . . 51152 1
5 '3D HN(CO)CACB' . . . 51152 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 $software_1 . . 51152 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 2 2 ASP C C 13 173.229 0.000 . 1 . . . . . 2 ASP C . 51152 1
2 . 1 . 1 2 2 ASP CA C 13 51.821 0.015 . 1 . . . . . 2 ASP CA . 51152 1
3 . 1 . 1 2 2 ASP CB C 13 39.226 0.000 . 1 . . . . . 2 ASP CB . 51152 1
4 . 1 . 1 3 3 VAL H H 1 8.219 0.002 . 1 . . . . . 3 VAL H . 51152 1
5 . 1 . 1 3 3 VAL C C 13 173.248 0.001 . 1 . . . . . 3 VAL C . 51152 1
6 . 1 . 1 3 3 VAL CA C 13 60.096 0.012 . 1 . . . . . 3 VAL CA . 51152 1
7 . 1 . 1 3 3 VAL CB C 13 30.249 0.000 . 1 . . . . . 3 VAL CB . 51152 1
8 . 1 . 1 3 3 VAL N N 15 116.676 0.051 . 1 . . . . . 3 VAL N . 51152 1
9 . 1 . 1 4 4 PHE H H 1 8.321 0.002 . 1 . . . . . 4 PHE H . 51152 1
10 . 1 . 1 4 4 PHE C C 13 173.277 0.006 . 1 . . . . . 4 PHE C . 51152 1
11 . 1 . 1 4 4 PHE CA C 13 55.404 0.008 . 1 . . . . . 4 PHE CA . 51152 1
12 . 1 . 1 4 4 PHE CB C 13 36.994 0.000 . 1 . . . . . 4 PHE CB . 51152 1
13 . 1 . 1 4 4 PHE N N 15 119.742 0.036 . 1 . . . . . 4 PHE N . 51152 1
14 . 1 . 1 5 5 MET H H 1 8.233 0.003 . 1 . . . . . 5 MET H . 51152 1
15 . 1 . 1 5 5 MET C C 13 173.370 0.000 . 1 . . . . . 5 MET C . 51152 1
16 . 1 . 1 5 5 MET CA C 13 53.094 0.003 . 1 . . . . . 5 MET CA . 51152 1
17 . 1 . 1 5 5 MET CB C 13 30.615 0.000 . 1 . . . . . 5 MET CB . 51152 1
18 . 1 . 1 5 5 MET N N 15 118.580 0.000 . 1 . . . . . 5 MET N . 51152 1
19 . 1 . 1 6 6 LYS H H 1 8.250 0.002 . 1 . . . . . 6 LYS H . 51152 1
20 . 1 . 1 6 6 LYS C C 13 174.476 0.005 . 1 . . . . . 6 LYS C . 51152 1
21 . 1 . 1 6 6 LYS CA C 13 54.393 0.016 . 1 . . . . . 6 LYS CA . 51152 1
22 . 1 . 1 6 6 LYS CB C 13 30.453 0.000 . 1 . . . . . 6 LYS CB . 51152 1
23 . 1 . 1 6 6 LYS N N 15 118.921 0.035 . 1 . . . . . 6 LYS N . 51152 1
24 . 1 . 1 7 7 GLY H H 1 8.412 0.005 . 1 . . . . . 7 GLY H . 51152 1
25 . 1 . 1 7 7 GLY C C 13 171.590 0.007 . 1 . . . . . 7 GLY C . 51152 1
26 . 1 . 1 7 7 GLY CA C 13 42.970 0.003 . 1 . . . . . 7 GLY CA . 51152 1
27 . 1 . 1 7 7 GLY N N 15 106.406 0.119 . 1 . . . . . 7 GLY N . 51152 1
28 . 1 . 1 8 8 LEU H H 1 8.065 0.002 . 1 . . . . . 8 LEU H . 51152 1
29 . 1 . 1 8 8 LEU C C 13 174.931 0.002 . 1 . . . . . 8 LEU C . 51152 1
30 . 1 . 1 8 8 LEU CA C 13 52.793 0.002 . 1 . . . . . 8 LEU CA . 51152 1
31 . 1 . 1 8 8 LEU CB C 13 40.177 0.005 . 1 . . . . . 8 LEU CB . 51152 1
32 . 1 . 1 8 8 LEU N N 15 118.412 0.017 . 1 . . . . . 8 LEU N . 51152 1
33 . 1 . 1 9 9 SER H H 1 8.313 0.003 . 1 . . . . . 9 SER H . 51152 1
34 . 1 . 1 9 9 SER C C 13 173.264 0.000 . 1 . . . . . 9 SER C . 51152 1
35 . 1 . 1 9 9 SER CA C 13 55.969 0.002 . 1 . . . . . 9 SER CA . 51152 1
36 . 1 . 1 9 9 SER CB C 13 61.515 0.050 . 1 . . . . . 9 SER CB . 51152 1
37 . 1 . 1 9 9 SER N N 15 113.182 0.046 . 1 . . . . . 9 SER N . 51152 1
38 . 1 . 1 10 10 LYS H H 1 8.328 0.004 . 1 . . . . . 10 LYS H . 51152 1
39 . 1 . 1 10 10 LYS C C 13 173.773 0.004 . 1 . . . . . 10 LYS C . 51152 1
40 . 1 . 1 10 10 LYS CA C 13 53.977 0.150 . 1 . . . . . 10 LYS CA . 51152 1
41 . 1 . 1 10 10 LYS CB C 13 30.537 0.000 . 1 . . . . . 10 LYS CB . 51152 1
42 . 1 . 1 10 10 LYS N N 15 120.043 0.063 . 1 . . . . . 10 LYS N . 51152 1
43 . 1 . 1 11 11 ALA H H 1 8.259 0.017 . 1 . . . . . 11 ALA H . 51152 1
44 . 1 . 1 11 11 ALA C C 13 175.213 0.000 . 1 . . . . . 11 ALA C . 51152 1
45 . 1 . 1 11 11 ALA CA C 13 50.175 0.039 . 1 . . . . . 11 ALA CA . 51152 1
46 . 1 . 1 11 11 ALA CB C 13 16.756 0.000 . 1 . . . . . 11 ALA CB . 51152 1
47 . 1 . 1 11 11 ALA N N 15 121.558 0.144 . 1 . . . . . 11 ALA N . 51152 1
48 . 1 . 1 12 12 LYS H H 1 8.281 0.003 . 1 . . . . . 12 LYS H . 51152 1
49 . 1 . 1 12 12 LYS C C 13 173.994 0.004 . 1 . . . . . 12 LYS C . 51152 1
50 . 1 . 1 12 12 LYS CA C 13 53.992 0.015 . 1 . . . . . 12 LYS CA . 51152 1
51 . 1 . 1 12 12 LYS CB C 13 30.506 0.000 . 1 . . . . . 12 LYS CB . 51152 1
52 . 1 . 1 12 12 LYS N N 15 117.211 0.075 . 1 . . . . . 12 LYS N . 51152 1
53 . 1 . 1 13 13 GLU H H 1 8.424 0.001 . 1 . . . . . 13 GLU H . 51152 1
54 . 1 . 1 13 13 GLU C C 13 174.363 0.014 . 1 . . . . . 13 GLU C . 51152 1
55 . 1 . 1 13 13 GLU CA C 13 54.384 0.078 . 1 . . . . . 13 GLU CA . 51152 1
56 . 1 . 1 13 13 GLU CB C 13 27.736 0.000 . 1 . . . . . 13 GLU CB . 51152 1
57 . 1 . 1 13 13 GLU N N 15 118.427 0.005 . 1 . . . . . 13 GLU N . 51152 1
58 . 1 . 1 14 14 GLY H H 1 8.442 0.009 . 1 . . . . . 14 GLY H . 51152 1
59 . 1 . 1 14 14 GLY C C 13 171.531 0.003 . 1 . . . . . 14 GLY C . 51152 1
60 . 1 . 1 14 14 GLY CA C 13 42.953 0.004 . 1 . . . . . 14 GLY CA . 51152 1
61 . 1 . 1 14 14 GLY N N 15 106.562 0.087 . 1 . . . . . 14 GLY N . 51152 1
62 . 1 . 1 15 15 VAL H H 1 7.970 0.003 . 1 . . . . . 15 VAL H . 51152 1
63 . 1 . 1 15 15 VAL C C 13 173.735 0.003 . 1 . . . . . 15 VAL C . 51152 1
64 . 1 . 1 15 15 VAL CA C 13 60.004 0.074 . 1 . . . . . 15 VAL CA . 51152 1
65 . 1 . 1 15 15 VAL CB C 13 30.308 0.000 . 1 . . . . . 15 VAL CB . 51152 1
66 . 1 . 1 15 15 VAL N N 15 116.378 0.029 . 1 . . . . . 15 VAL N . 51152 1
67 . 1 . 1 16 16 VAL H H 1 8.204 0.003 . 1 . . . . . 16 VAL H . 51152 1
68 . 1 . 1 16 16 VAL C C 13 173.321 0.011 . 1 . . . . . 16 VAL C . 51152 1
69 . 1 . 1 16 16 VAL CA C 13 59.915 0.018 . 1 . . . . . 16 VAL CA . 51152 1
70 . 1 . 1 16 16 VAL CB C 13 30.269 0.000 . 1 . . . . . 16 VAL CB . 51152 1
71 . 1 . 1 16 16 VAL N N 15 120.606 0.027 . 1 . . . . . 16 VAL N . 51152 1
72 . 1 . 1 17 17 ALA H H 1 8.370 0.004 . 1 . . . . . 17 ALA H . 51152 1
73 . 1 . 1 17 17 ALA C C 13 174.957 0.011 . 1 . . . . . 17 ALA C . 51152 1
74 . 1 . 1 17 17 ALA CA C 13 50.017 0.004 . 1 . . . . . 17 ALA CA . 51152 1
75 . 1 . 1 17 17 ALA CB C 13 16.780 0.012 . 1 . . . . . 17 ALA CB . 51152 1
76 . 1 . 1 17 17 ALA N N 15 124.593 0.028 . 1 . . . . . 17 ALA N . 51152 1
77 . 1 . 1 18 18 ALA H H 1 8.247 0.002 . 1 . . . . . 18 ALA H . 51152 1
78 . 1 . 1 18 18 ALA C C 13 175.239 0.001 . 1 . . . . . 18 ALA C . 51152 1
79 . 1 . 1 18 18 ALA CA C 13 50.189 0.009 . 1 . . . . . 18 ALA CA . 51152 1
80 . 1 . 1 18 18 ALA CB C 13 16.726 0.017 . 1 . . . . . 18 ALA CB . 51152 1
81 . 1 . 1 18 18 ALA N N 15 120.121 0.024 . 1 . . . . . 18 ALA N . 51152 1
82 . 1 . 1 19 19 ALA H H 1 8.249 0.001 . 1 . . . . . 19 ALA H . 51152 1
83 . 1 . 1 19 19 ALA C C 13 175.492 0.003 . 1 . . . . . 19 ALA C . 51152 1
84 . 1 . 1 19 19 ALA CA C 13 50.305 0.016 . 1 . . . . . 19 ALA CA . 51152 1
85 . 1 . 1 19 19 ALA CB C 13 16.746 0.015 . 1 . . . . . 19 ALA CB . 51152 1
86 . 1 . 1 19 19 ALA N N 15 119.577 0.008 . 1 . . . . . 19 ALA N . 51152 1
87 . 1 . 1 20 20 GLU H H 1 8.338 0.004 . 1 . . . . . 20 GLU H . 51152 1
88 . 1 . 1 20 20 GLU C C 13 174.324 0.001 . 1 . . . . . 20 GLU C . 51152 1
89 . 1 . 1 20 20 GLU CA C 13 54.382 0.015 . 1 . . . . . 20 GLU CA . 51152 1
90 . 1 . 1 20 20 GLU CB C 13 27.637 0.013 . 1 . . . . . 20 GLU CB . 51152 1
91 . 1 . 1 20 20 GLU N N 15 116.412 0.046 . 1 . . . . . 20 GLU N . 51152 1
92 . 1 . 1 21 21 LYS H H 1 8.306 0.002 . 1 . . . . . 21 LYS H . 51152 1
93 . 1 . 1 21 21 LYS C C 13 174.468 0.002 . 1 . . . . . 21 LYS C . 51152 1
94 . 1 . 1 21 21 LYS CA C 13 54.316 0.011 . 1 . . . . . 21 LYS CA . 51152 1
95 . 1 . 1 21 21 LYS CB C 13 30.387 0.010 . 1 . . . . . 21 LYS CB . 51152 1
96 . 1 . 1 21 21 LYS N N 15 118.424 0.021 . 1 . . . . . 21 LYS N . 51152 1
97 . 1 . 1 22 22 THR H H 1 8.089 0.003 . 1 . . . . . 22 THR H . 51152 1
98 . 1 . 1 22 22 THR C C 13 172.142 0.000 . 1 . . . . . 22 THR C . 51152 1
99 . 1 . 1 22 22 THR CA C 13 59.691 0.000 . 1 . . . . . 22 THR CA . 51152 1
100 . 1 . 1 22 22 THR CB C 13 67.291 0.000 . 1 . . . . . 22 THR CB . 51152 1
101 . 1 . 1 22 22 THR N N 15 111.030 0.039 . 1 . . . . . 22 THR N . 51152 1
102 . 1 . 1 23 23 LYS H H 1 8.292 0.000 . 1 . . . . . 23 LYS H . 51152 1
103 . 1 . 1 23 23 LYS C C 13 173.935 0.003 . 1 . . . . . 23 LYS C . 51152 1
104 . 1 . 1 23 23 LYS CA C 13 54.157 0.046 . 1 . . . . . 23 LYS CA . 51152 1
105 . 1 . 1 23 23 LYS CB C 13 30.250 0.000 . 1 . . . . . 23 LYS CB . 51152 1
106 . 1 . 1 23 23 LYS N N 15 120.075 0.021 . 1 . . . . . 23 LYS N . 51152 1
107 . 1 . 1 24 24 GLN H H 1 8.387 0.004 . 1 . . . . . 24 GLN H . 51152 1
108 . 1 . 1 24 24 GLN C C 13 173.926 0.000 . 1 . . . . . 24 GLN C . 51152 1
109 . 1 . 1 24 24 GLN CA C 13 53.634 0.032 . 1 . . . . . 24 GLN CA . 51152 1
110 . 1 . 1 24 24 GLN CB C 13 27.103 0.000 . 1 . . . . . 24 GLN CB . 51152 1
111 . 1 . 1 24 24 GLN N N 15 118.099 0.030 . 1 . . . . . 24 GLN N . 51152 1
112 . 1 . 1 25 25 GLY H H 1 8.490 0.005 . 1 . . . . . 25 GLY H . 51152 1
113 . 1 . 1 25 25 GLY C C 13 171.639 0.003 . 1 . . . . . 25 GLY C . 51152 1
114 . 1 . 1 25 25 GLY CA C 13 42.991 0.006 . 1 . . . . . 25 GLY CA . 51152 1
115 . 1 . 1 25 25 GLY N N 15 107.089 0.018 . 1 . . . . . 25 GLY N . 51152 1
116 . 1 . 1 26 26 VAL H H 1 7.991 0.002 . 1 . . . . . 26 VAL H . 51152 1
117 . 1 . 1 26 26 VAL C C 13 173.576 0.000 . 1 . . . . . 26 VAL C . 51152 1
118 . 1 . 1 26 26 VAL CA C 13 59.935 0.013 . 1 . . . . . 26 VAL CA . 51152 1
119 . 1 . 1 26 26 VAL CB C 13 30.286 0.003 . 1 . . . . . 26 VAL CB . 51152 1
120 . 1 . 1 26 26 VAL N N 15 115.959 0.027 . 1 . . . . . 26 VAL N . 51152 1
121 . 1 . 1 27 27 ALA H H 1 8.413 0.002 . 1 . . . . . 27 ALA H . 51152 1
122 . 1 . 1 27 27 ALA C C 13 175.348 0.004 . 1 . . . . . 27 ALA C . 51152 1
123 . 1 . 1 27 27 ALA CA C 13 50.244 0.005 . 1 . . . . . 27 ALA CA . 51152 1
124 . 1 . 1 27 27 ALA CB C 13 16.723 0.000 . 1 . . . . . 27 ALA CB . 51152 1
125 . 1 . 1 27 27 ALA N N 15 123.935 0.024 . 1 . . . . . 27 ALA N . 51152 1
126 . 1 . 1 28 28 GLU H H 1 8.382 0.004 . 1 . . . . . 28 GLU H . 51152 1
127 . 1 . 1 28 28 GLU C C 13 173.942 0.003 . 1 . . . . . 28 GLU C . 51152 1
128 . 1 . 1 28 28 GLU CA C 13 54.360 0.030 . 1 . . . . . 28 GLU CA . 51152 1
129 . 1 . 1 28 28 GLU CB C 13 27.681 0.011 . 1 . . . . . 28 GLU CB . 51152 1
130 . 1 . 1 28 28 GLU N N 15 117.053 0.026 . 1 . . . . . 28 GLU N . 51152 1
131 . 1 . 1 29 29 ALA H H 1 8.281 0.004 . 1 . . . . . 29 ALA H . 51152 1
132 . 1 . 1 29 29 ALA C C 13 175.032 0.001 . 1 . . . . . 29 ALA C . 51152 1
133 . 1 . 1 29 29 ALA CA C 13 50.148 0.019 . 1 . . . . . 29 ALA CA . 51152 1
134 . 1 . 1 29 29 ALA CB C 13 16.737 0.012 . 1 . . . . . 29 ALA CB . 51152 1
135 . 1 . 1 29 29 ALA N N 15 121.489 0.079 . 1 . . . . . 29 ALA N . 51152 1
136 . 1 . 1 30 30 ALA H H 1 8.229 0.005 . 1 . . . . . 30 ALA H . 51152 1
137 . 1 . 1 30 30 ALA C C 13 175.766 0.006 . 1 . . . . . 30 ALA C . 51152 1
138 . 1 . 1 30 30 ALA CA C 13 50.258 0.025 . 1 . . . . . 30 ALA CA . 51152 1
139 . 1 . 1 30 30 ALA CB C 13 16.709 0.002 . 1 . . . . . 30 ALA CB . 51152 1
140 . 1 . 1 30 30 ALA N N 15 119.657 0.019 . 1 . . . . . 30 ALA N . 51152 1
141 . 1 . 1 31 31 GLY H H 1 8.339 0.004 . 1 . . . . . 31 GLY H . 51152 1
142 . 1 . 1 31 31 GLY C C 13 171.720 0.001 . 1 . . . . . 31 GLY C . 51152 1
143 . 1 . 1 31 31 GLY CA C 13 43.002 0.001 . 1 . . . . . 31 GLY CA . 51152 1
144 . 1 . 1 31 31 GLY N N 15 104.455 0.011 . 1 . . . . . 31 GLY N . 51152 1
145 . 1 . 1 32 32 LYS H H 1 8.143 0.002 . 1 . . . . . 32 LYS H . 51152 1
146 . 1 . 1 32 32 LYS C C 13 174.333 0.013 . 1 . . . . . 32 LYS C . 51152 1
147 . 1 . 1 32 32 LYS CA C 13 53.846 0.015 . 1 . . . . . 32 LYS CA . 51152 1
148 . 1 . 1 32 32 LYS CB C 13 30.669 0.047 . 1 . . . . . 32 LYS CB . 51152 1
149 . 1 . 1 32 32 LYS N N 15 117.420 0.020 . 1 . . . . . 32 LYS N . 51152 1
150 . 1 . 1 33 33 THR H H 1 8.197 0.003 . 1 . . . . . 33 THR H . 51152 1
151 . 1 . 1 33 33 THR C C 13 172.097 0.000 . 1 . . . . . 33 THR C . 51152 1
152 . 1 . 1 33 33 THR CA C 13 59.386 0.012 . 1 . . . . . 33 THR CA . 51152 1
153 . 1 . 1 33 33 THR CB C 13 67.484 0.021 . 1 . . . . . 33 THR CB . 51152 1
154 . 1 . 1 33 33 THR N N 15 111.647 0.058 . 1 . . . . . 33 THR N . 51152 1
155 . 1 . 1 34 34 LYS H H 1 8.422 0.002 . 1 . . . . . 34 LYS H . 51152 1
156 . 1 . 1 34 34 LYS C C 13 173.849 0.009 . 1 . . . . . 34 LYS C . 51152 1
157 . 1 . 1 34 34 LYS CA C 13 54.102 0.001 . 1 . . . . . 34 LYS CA . 51152 1
158 . 1 . 1 34 34 LYS CB C 13 30.516 0.000 . 1 . . . . . 34 LYS CB . 51152 1
159 . 1 . 1 34 34 LYS N N 15 120.184 0.017 . 1 . . . . . 34 LYS N . 51152 1
160 . 1 . 1 35 35 GLU H H 1 8.427 0.012 . 1 . . . . . 35 GLU H . 51152 1
161 . 1 . 1 35 35 GLU C C 13 174.345 0.002 . 1 . . . . . 35 GLU C . 51152 1
162 . 1 . 1 35 35 GLU CA C 13 54.341 0.017 . 1 . . . . . 35 GLU CA . 51152 1
163 . 1 . 1 35 35 GLU CB C 13 27.711 0.000 . 1 . . . . . 35 GLU CB . 51152 1
164 . 1 . 1 35 35 GLU N N 15 118.363 0.031 . 1 . . . . . 35 GLU N . 51152 1
165 . 1 . 1 36 36 GLY H H 1 8.418 0.006 . 1 . . . . . 36 GLY H . 51152 1
166 . 1 . 1 36 36 GLY C C 13 171.496 0.020 . 1 . . . . . 36 GLY C . 51152 1
167 . 1 . 1 36 36 GLY CA C 13 43.002 0.005 . 1 . . . . . 36 GLY CA . 51152 1
168 . 1 . 1 36 36 GLY N N 15 106.497 0.088 . 1 . . . . . 36 GLY N . 51152 1
169 . 1 . 1 37 37 VAL H H 1 7.898 0.006 . 1 . . . . . 37 VAL H . 51152 1
170 . 1 . 1 37 37 VAL C C 13 173.174 0.005 . 1 . . . . . 37 VAL C . 51152 1
171 . 1 . 1 37 37 VAL CA C 13 59.783 0.019 . 1 . . . . . 37 VAL CA . 51152 1
172 . 1 . 1 37 37 VAL CB C 13 30.306 0.004 . 1 . . . . . 37 VAL CB . 51152 1
173 . 1 . 1 37 37 VAL N N 15 115.890 0.063 . 1 . . . . . 37 VAL N . 51152 1
174 . 1 . 1 38 38 LEU H H 1 8.235 0.002 . 1 . . . . . 38 LEU H . 51152 1
175 . 1 . 1 38 38 LEU C C 13 174.013 0.004 . 1 . . . . . 38 LEU C . 51152 1
176 . 1 . 1 38 38 LEU CA C 13 52.591 0.013 . 1 . . . . . 38 LEU CA . 51152 1
177 . 1 . 1 38 38 LEU CB C 13 40.215 0.031 . 1 . . . . . 38 LEU CB . 51152 1
178 . 1 . 1 38 38 LEU N N 15 121.972 0.034 . 1 . . . . . 38 LEU N . 51152 1
179 . 1 . 1 39 39 TYR H H 1 8.212 0.002 . 1 . . . . . 39 TYR H . 51152 1
180 . 1 . 1 39 39 TYR C C 13 173.052 0.007 . 1 . . . . . 39 TYR C . 51152 1
181 . 1 . 1 39 39 TYR CA C 13 55.225 0.005 . 1 . . . . . 39 TYR CA . 51152 1
182 . 1 . 1 39 39 TYR CB C 13 36.385 0.012 . 1 . . . . . 39 TYR CB . 51152 1
183 . 1 . 1 39 39 TYR N N 15 118.497 0.139 . 1 . . . . . 39 TYR N . 51152 1
184 . 1 . 1 40 40 VAL H H 1 8.068 0.011 . 1 . . . . . 40 VAL H . 51152 1
185 . 1 . 1 40 40 VAL C C 13 173.667 0.009 . 1 . . . . . 40 VAL C . 51152 1
186 . 1 . 1 40 40 VAL CA C 13 59.756 0.006 . 1 . . . . . 40 VAL CA . 51152 1
187 . 1 . 1 40 40 VAL CB C 13 30.349 0.010 . 1 . . . . . 40 VAL CB . 51152 1
188 . 1 . 1 40 40 VAL N N 15 118.917 0.154 . 1 . . . . . 40 VAL N . 51152 1
189 . 1 . 1 41 41 GLY H H 1 8.135 0.005 . 1 . . . . . 41 GLY H . 51152 1
190 . 1 . 1 41 41 GLY C C 13 171.481 0.007 . 1 . . . . . 41 GLY C . 51152 1
191 . 1 . 1 41 41 GLY CA C 13 42.878 0.059 . 1 . . . . . 41 GLY CA . 51152 1
192 . 1 . 1 41 41 GLY N N 15 108.522 0.021 . 1 . . . . . 41 GLY N . 51152 1
193 . 1 . 1 42 42 SER H H 1 8.241 0.002 . 1 . . . . . 42 SER H . 51152 1
194 . 1 . 1 42 42 SER C C 13 172.206 0.021 . 1 . . . . . 42 SER C . 51152 1
195 . 1 . 1 42 42 SER CA C 13 55.958 0.012 . 1 . . . . . 42 SER CA . 51152 1
196 . 1 . 1 42 42 SER CB C 13 61.495 0.000 . 1 . . . . . 42 SER CB . 51152 1
197 . 1 . 1 42 42 SER N N 15 112.359 0.031 . 1 . . . . . 42 SER N . 51152 1
198 . 1 . 1 43 43 LYS H H 1 8.467 0.002 . 1 . . . . . 43 LYS H . 51152 1
199 . 1 . 1 43 43 LYS C C 13 174.227 0.009 . 1 . . . . . 43 LYS C . 51152 1
200 . 1 . 1 43 43 LYS CA C 13 54.021 0.015 . 1 . . . . . 43 LYS CA . 51152 1
201 . 1 . 1 43 43 LYS CB C 13 30.560 0.000 . 1 . . . . . 43 LYS CB . 51152 1
202 . 1 . 1 43 43 LYS N N 15 119.950 0.000 . 1 . . . . . 43 LYS N . 51152 1
203 . 1 . 1 44 44 THR H H 1 8.166 0.005 . 1 . . . . . 44 THR H . 51152 1
204 . 1 . 1 44 44 THR C C 13 172.089 0.028 . 1 . . . . . 44 THR C . 51152 1
205 . 1 . 1 44 44 THR CA C 13 59.420 0.004 . 1 . . . . . 44 THR CA . 51152 1
206 . 1 . 1 44 44 THR CB C 13 67.502 0.000 . 1 . . . . . 44 THR CB . 51152 1
207 . 1 . 1 44 44 THR N N 15 111.556 0.040 . 1 . . . . . 44 THR N . 51152 1
208 . 1 . 1 45 45 LYS H H 1 8.379 0.003 . 1 . . . . . 45 LYS H . 51152 1
209 . 1 . 1 45 45 LYS C C 13 173.874 0.010 . 1 . . . . . 45 LYS C . 51152 1
210 . 1 . 1 45 45 LYS CA C 13 54.207 0.088 . 1 . . . . . 45 LYS CA . 51152 1
211 . 1 . 1 45 45 LYS CB C 13 30.504 0.010 . 1 . . . . . 45 LYS CB . 51152 1
212 . 1 . 1 45 45 LYS N N 15 120.038 0.033 . 1 . . . . . 45 LYS N . 51152 1
213 . 1 . 1 46 46 GLU H H 1 8.434 0.035 . 1 . . . . . 46 GLU H . 51152 1
214 . 1 . 1 46 46 GLU C C 13 173.926 0.000 . 1 . . . . . 46 GLU C . 51152 1
215 . 1 . 1 46 46 GLU CA C 13 54.443 0.000 . 1 . . . . . 46 GLU CA . 51152 1
216 . 1 . 1 46 46 GLU CB C 13 27.615 0.042 . 1 . . . . . 46 GLU CB . 51152 1
217 . 1 . 1 46 46 GLU N N 15 118.335 0.166 . 1 . . . . . 46 GLU N . 51152 1
218 . 1 . 1 47 47 GLY H H 1 8.414 0.005 . 1 . . . . . 47 GLY H . 51152 1
219 . 1 . 1 47 47 GLY C C 13 171.386 0.013 . 1 . . . . . 47 GLY C . 51152 1
220 . 1 . 1 47 47 GLY CA C 13 42.911 0.037 . 1 . . . . . 47 GLY CA . 51152 1
221 . 1 . 1 47 47 GLY N N 15 106.568 0.101 . 1 . . . . . 47 GLY N . 51152 1
222 . 1 . 1 48 48 VAL H H 1 7.913 0.005 . 1 . . . . . 48 VAL H . 51152 1
223 . 1 . 1 48 48 VAL C C 13 173.460 0.009 . 1 . . . . . 48 VAL C . 51152 1
224 . 1 . 1 48 48 VAL CA C 13 59.765 0.039 . 1 . . . . . 48 VAL CA . 51152 1
225 . 1 . 1 48 48 VAL CB C 13 30.352 0.000 . 1 . . . . . 48 VAL CB . 51152 1
226 . 1 . 1 48 48 VAL N N 15 116.155 0.045 . 1 . . . . . 48 VAL N . 51152 1
227 . 1 . 1 49 49 VAL H H 1 8.206 0.002 . 1 . . . . . 49 VAL H . 51152 1
228 . 1 . 1 49 49 VAL C C 13 173.287 0.009 . 1 . . . . . 49 VAL C . 51152 1
229 . 1 . 1 49 49 VAL CA C 13 59.766 0.005 . 1 . . . . . 49 VAL CA . 51152 1
230 . 1 . 1 49 49 VAL CB C 13 30.300 0.000 . 1 . . . . . 49 VAL CB . 51152 1
231 . 1 . 1 49 49 VAL N N 15 120.433 0.077 . 1 . . . . . 49 VAL N . 51152 1
232 . 1 . 1 50 50 HIS H H 1 8.585 0.001 . 1 . . . . . 50 HIS H . 51152 1
233 . 1 . 1 50 50 HIS C C 13 173.918 0.000 . 1 . . . . . 50 HIS C . 51152 1
234 . 1 . 1 50 50 HIS CA C 13 53.561 0.679 . 1 . . . . . 50 HIS CA . 51152 1
235 . 1 . 1 50 50 HIS CB C 13 27.364 0.027 . 1 . . . . . 50 HIS CB . 51152 1
236 . 1 . 1 50 50 HIS N N 15 119.593 0.018 . 1 . . . . . 50 HIS N . 51152 1
237 . 1 . 1 51 51 GLY H H 1 8.476 0.005 . 1 . . . . . 51 GLY H . 51152 1
238 . 1 . 1 51 51 GLY C C 13 171.557 0.008 . 1 . . . . . 51 GLY C . 51152 1
239 . 1 . 1 51 51 GLY CA C 13 42.926 0.012 . 1 . . . . . 51 GLY CA . 51152 1
240 . 1 . 1 51 51 GLY N N 15 107.100 0.003 . 1 . . . . . 51 GLY N . 51152 1
241 . 1 . 1 52 52 VAL H H 1 8.064 0.005 . 1 . . . . . 52 VAL H . 51152 1
242 . 1 . 1 52 52 VAL C C 13 173.241 0.006 . 1 . . . . . 52 VAL C . 51152 1
243 . 1 . 1 52 52 VAL CA C 13 59.557 0.010 . 1 . . . . . 52 VAL CA . 51152 1
244 . 1 . 1 52 52 VAL CB C 13 30.431 0.064 . 1 . . . . . 52 VAL CB . 51152 1
245 . 1 . 1 52 52 VAL N N 15 115.941 0.022 . 1 . . . . . 52 VAL N . 51152 1
246 . 1 . 1 53 53 ALA H H 1 8.455 0.002 . 1 . . . . . 53 ALA H . 51152 1
247 . 1 . 1 53 53 ALA C C 13 175.157 0.007 . 1 . . . . . 53 ALA C . 51152 1
248 . 1 . 1 53 53 ALA CA C 13 49.955 0.014 . 1 . . . . . 53 ALA CA . 51152 1
249 . 1 . 1 53 53 ALA CB C 13 16.956 0.001 . 1 . . . . . 53 ALA CB . 51152 1
250 . 1 . 1 53 53 ALA N N 15 124.359 0.036 . 1 . . . . . 53 ALA N . 51152 1
251 . 1 . 1 54 54 THR H H 1 8.164 0.002 . 1 . . . . . 54 THR H . 51152 1
252 . 1 . 1 54 54 THR C C 13 172.043 0.004 . 1 . . . . . 54 THR C . 51152 1
253 . 1 . 1 54 54 THR CA C 13 59.281 0.071 . 1 . . . . . 54 THR CA . 51152 1
254 . 1 . 1 54 54 THR CB C 13 67.441 0.000 . 1 . . . . . 54 THR CB . 51152 1
255 . 1 . 1 54 54 THR N N 15 110.746 0.052 . 1 . . . . . 54 THR N . 51152 1
256 . 1 . 1 55 55 VAL H H 1 8.153 0.003 . 1 . . . . . 55 VAL H . 51152 1
257 . 1 . 1 55 55 VAL C C 13 173.264 0.007 . 1 . . . . . 55 VAL C . 51152 1
258 . 1 . 1 55 55 VAL CA C 13 59.870 0.030 . 1 . . . . . 55 VAL CA . 51152 1
259 . 1 . 1 55 55 VAL CB C 13 30.374 0.000 . 1 . . . . . 55 VAL CB . 51152 1
260 . 1 . 1 55 55 VAL N N 15 118.690 0.073 . 1 . . . . . 55 VAL N . 51152 1
261 . 1 . 1 56 56 ALA H H 1 8.360 0.004 . 1 . . . . . 56 ALA H . 51152 1
262 . 1 . 1 56 56 ALA C C 13 175.136 0.005 . 1 . . . . . 56 ALA C . 51152 1
263 . 1 . 1 56 56 ALA CA C 13 50.153 0.047 . 1 . . . . . 56 ALA CA . 51152 1
264 . 1 . 1 56 56 ALA CB C 13 16.709 0.000 . 1 . . . . . 56 ALA CB . 51152 1
265 . 1 . 1 56 56 ALA N N 15 124.201 0.079 . 1 . . . . . 56 ALA N . 51152 1
266 . 1 . 1 57 57 GLU H H 1 8.353 0.014 . 1 . . . . . 57 GLU H . 51152 1
267 . 1 . 1 57 57 GLU C C 13 174.109 0.005 . 1 . . . . . 57 GLU C . 51152 1
268 . 1 . 1 57 57 GLU CA C 13 54.309 0.010 . 1 . . . . . 57 GLU CA . 51152 1
269 . 1 . 1 57 57 GLU CB C 13 27.853 0.000 . 1 . . . . . 57 GLU CB . 51152 1
270 . 1 . 1 57 57 GLU N N 15 117.142 0.033 . 1 . . . . . 57 GLU N . 51152 1
271 . 1 . 1 58 58 LYS H H 1 8.375 0.002 . 1 . . . . . 58 LYS H . 51152 1
272 . 1 . 1 58 58 LYS C C 13 174.370 0.006 . 1 . . . . . 58 LYS C . 51152 1
273 . 1 . 1 58 58 LYS CA C 13 54.101 0.036 . 1 . . . . . 58 LYS CA . 51152 1
274 . 1 . 1 58 58 LYS CB C 13 30.390 0.000 . 1 . . . . . 58 LYS CB . 51152 1
275 . 1 . 1 58 58 LYS N N 15 118.834 0.031 . 1 . . . . . 58 LYS N . 51152 1
276 . 1 . 1 59 59 THR H H 1 8.150 0.005 . 1 . . . . . 59 THR H . 51152 1
277 . 1 . 1 59 59 THR C C 13 172.136 0.002 . 1 . . . . . 59 THR C . 51152 1
278 . 1 . 1 59 59 THR CA C 13 59.583 0.001 . 1 . . . . . 59 THR CA . 51152 1
279 . 1 . 1 59 59 THR CB C 13 67.352 0.022 . 1 . . . . . 59 THR CB . 51152 1
280 . 1 . 1 59 59 THR N N 15 111.579 0.035 . 1 . . . . . 59 THR N . 51152 1
281 . 1 . 1 60 60 LYS H H 1 8.323 0.006 . 1 . . . . . 60 LYS H . 51152 1
282 . 1 . 1 60 60 LYS C C 13 174.029 0.008 . 1 . . . . . 60 LYS C . 51152 1
283 . 1 . 1 60 60 LYS CA C 13 54.234 0.006 . 1 . . . . . 60 LYS CA . 51152 1
284 . 1 . 1 60 60 LYS CB C 13 30.433 0.109 . 1 . . . . . 60 LYS CB . 51152 1
285 . 1 . 1 60 60 LYS N N 15 119.853 0.056 . 1 . . . . . 60 LYS N . 51152 1
286 . 1 . 1 61 61 GLU H H 1 8.420 0.002 . 1 . . . . . 61 GLU H . 51152 1
287 . 1 . 1 61 61 GLU C C 13 173.821 0.004 . 1 . . . . . 61 GLU C . 51152 1
288 . 1 . 1 61 61 GLU CA C 13 54.359 0.003 . 1 . . . . . 61 GLU CA . 51152 1
289 . 1 . 1 61 61 GLU CB C 13 27.663 0.030 . 1 . . . . . 61 GLU CB . 51152 1
290 . 1 . 1 61 61 GLU N N 15 118.290 0.024 . 1 . . . . . 61 GLU N . 51152 1
291 . 1 . 1 62 62 GLN H H 1 8.379 0.001 . 1 . . . . . 62 GLN H . 51152 1
292 . 1 . 1 62 62 GLN C C 13 173.362 0.001 . 1 . . . . . 62 GLN C . 51152 1
293 . 1 . 1 62 62 GLN CA C 13 53.430 0.027 . 1 . . . . . 62 GLN CA . 51152 1
294 . 1 . 1 62 62 GLN CB C 13 27.092 0.000 . 1 . . . . . 62 GLN CB . 51152 1
295 . 1 . 1 62 62 GLN N N 15 118.028 0.034 . 1 . . . . . 62 GLN N . 51152 1
296 . 1 . 1 63 63 VAL H H 1 8.217 0.002 . 1 . . . . . 63 VAL H . 51152 1
297 . 1 . 1 63 63 VAL C C 13 173.687 0.008 . 1 . . . . . 63 VAL C . 51152 1
298 . 1 . 1 63 63 VAL CA C 13 59.956 0.009 . 1 . . . . . 63 VAL CA . 51152 1
299 . 1 . 1 63 63 VAL CB C 13 30.280 0.000 . 1 . . . . . 63 VAL CB . 51152 1
300 . 1 . 1 63 63 VAL N N 15 117.861 0.055 . 1 . . . . . 63 VAL N . 51152 1
301 . 1 . 1 64 64 THR H H 1 8.251 0.002 . 1 . . . . . 64 THR H . 51152 1
302 . 1 . 1 64 64 THR C C 13 171.568 0.003 . 1 . . . . . 64 THR C . 51152 1
303 . 1 . 1 64 64 THR CA C 13 59.318 0.009 . 1 . . . . . 64 THR CA . 51152 1
304 . 1 . 1 64 64 THR CB C 13 67.421 0.021 . 1 . . . . . 64 THR CB . 51152 1
305 . 1 . 1 64 64 THR N N 15 114.000 0.049 . 1 . . . . . 64 THR N . 51152 1
306 . 1 . 1 65 65 ASN H H 1 8.483 0.003 . 1 . . . . . 65 ASN H . 51152 1
307 . 1 . 1 65 65 ASN C C 13 172.609 0.002 . 1 . . . . . 65 ASN C . 51152 1
308 . 1 . 1 65 65 ASN CA C 13 50.728 0.004 . 1 . . . . . 65 ASN CA . 51152 1
309 . 1 . 1 65 65 ASN CB C 13 36.510 0.008 . 1 . . . . . 65 ASN CB . 51152 1
310 . 1 . 1 65 65 ASN N N 15 118.321 0.013 . 1 . . . . . 65 ASN N . 51152 1
311 . 1 . 1 66 66 VAL H H 1 8.185 0.002 . 1 . . . . . 66 VAL H . 51152 1
312 . 1 . 1 66 66 VAL C C 13 174.116 0.007 . 1 . . . . . 66 VAL C . 51152 1
313 . 1 . 1 66 66 VAL CA C 13 60.077 0.027 . 1 . . . . . 66 VAL CA . 51152 1
314 . 1 . 1 66 66 VAL CB C 13 30.120 0.000 . 1 . . . . . 66 VAL CB . 51152 1
315 . 1 . 1 66 66 VAL N N 15 116.884 0.023 . 1 . . . . . 66 VAL N . 51152 1
316 . 1 . 1 67 67 GLY H H 1 8.515 0.002 . 1 . . . . . 67 GLY H . 51152 1
317 . 1 . 1 67 67 GLY C C 13 172.085 0.001 . 1 . . . . . 67 GLY C . 51152 1
318 . 1 . 1 67 67 GLY CA C 13 42.968 0.009 . 1 . . . . . 67 GLY CA . 51152 1
319 . 1 . 1 67 67 GLY N N 15 108.976 0.027 . 1 . . . . . 67 GLY N . 51152 1
320 . 1 . 1 68 68 GLY H H 1 8.248 0.003 . 1 . . . . . 68 GLY H . 51152 1
321 . 1 . 1 68 68 GLY C C 13 171.214 0.007 . 1 . . . . . 68 GLY C . 51152 1
322 . 1 . 1 68 68 GLY CA C 13 42.743 0.014 . 1 . . . . . 68 GLY CA . 51152 1
323 . 1 . 1 68 68 GLY N N 15 105.573 0.016 . 1 . . . . . 68 GLY N . 51152 1
324 . 1 . 1 69 69 ALA H H 1 8.163 0.003 . 1 . . . . . 69 ALA H . 51152 1
325 . 1 . 1 69 69 ALA C C 13 174.979 0.001 . 1 . . . . . 69 ALA C . 51152 1
326 . 1 . 1 69 69 ALA CA C 13 49.859 0.012 . 1 . . . . . 69 ALA CA . 51152 1
327 . 1 . 1 69 69 ALA CB C 13 16.936 0.000 . 1 . . . . . 69 ALA CB . 51152 1
328 . 1 . 1 69 69 ALA N N 15 120.589 0.014 . 1 . . . . . 69 ALA N . 51152 1
329 . 1 . 1 70 70 VAL H H 1 8.142 0.002 . 1 . . . . . 70 VAL H . 51152 1
330 . 1 . 1 70 70 VAL C C 13 173.661 0.004 . 1 . . . . . 70 VAL C . 51152 1
331 . 1 . 1 70 70 VAL CA C 13 59.908 0.015 . 1 . . . . . 70 VAL CA . 51152 1
332 . 1 . 1 70 70 VAL CB C 13 30.232 0.000 . 1 . . . . . 70 VAL CB . 51152 1
333 . 1 . 1 70 70 VAL N N 15 116.454 0.046 . 1 . . . . . 70 VAL N . 51152 1
334 . 1 . 1 71 71 VAL H H 1 8.287 0.005 . 1 . . . . . 71 VAL H . 51152 1
335 . 1 . 1 71 71 VAL C C 13 173.632 0.002 . 1 . . . . . 71 VAL C . 51152 1
336 . 1 . 1 71 71 VAL CA C 13 59.768 0.012 . 1 . . . . . 71 VAL CA . 51152 1
337 . 1 . 1 71 71 VAL CB C 13 30.194 0.000 . 1 . . . . . 71 VAL CB . 51152 1
338 . 1 . 1 71 71 VAL N N 15 120.896 0.077 . 1 . . . . . 71 VAL N . 51152 1
339 . 1 . 1 72 72 THR H H 1 8.239 0.002 . 1 . . . . . 72 THR H . 51152 1
340 . 1 . 1 72 72 THR C C 13 172.361 0.000 . 1 . . . . . 72 THR C . 51152 1
341 . 1 . 1 72 72 THR CA C 13 59.369 0.018 . 1 . . . . . 72 THR CA . 51152 1
342 . 1 . 1 72 72 THR CB C 13 67.429 0.000 . 1 . . . . . 72 THR CB . 51152 1
343 . 1 . 1 72 72 THR N N 15 114.427 0.054 . 1 . . . . . 72 THR N . 51152 1
344 . 1 . 1 73 73 GLY H H 1 8.415 0.002 . 1 . . . . . 73 GLY H . 51152 1
345 . 1 . 1 73 73 GLY C C 13 171.544 0.006 . 1 . . . . . 73 GLY C . 51152 1
346 . 1 . 1 73 73 GLY CA C 13 42.924 0.014 . 1 . . . . . 73 GLY CA . 51152 1
347 . 1 . 1 73 73 GLY N N 15 107.853 0.015 . 1 . . . . . 73 GLY N . 51152 1
348 . 1 . 1 74 74 VAL H H 1 8.058 0.001 . 1 . . . . . 74 VAL H . 51152 1
349 . 1 . 1 74 74 VAL C C 13 173.875 0.001 . 1 . . . . . 74 VAL C . 51152 1
350 . 1 . 1 74 74 VAL CA C 13 59.857 0.054 . 1 . . . . . 74 VAL CA . 51152 1
351 . 1 . 1 74 74 VAL CB C 13 30.343 0.000 . 1 . . . . . 74 VAL CB . 51152 1
352 . 1 . 1 74 74 VAL N N 15 115.870 0.050 . 1 . . . . . 74 VAL N . 51152 1
353 . 1 . 1 75 75 THR H H 1 8.235 0.002 . 1 . . . . . 75 THR H . 51152 1
354 . 1 . 1 75 75 THR C C 13 171.600 0.002 . 1 . . . . . 75 THR C . 51152 1
355 . 1 . 1 75 75 THR CA C 13 59.359 0.057 . 1 . . . . . 75 THR CA . 51152 1
356 . 1 . 1 75 75 THR CB C 13 67.337 0.000 . 1 . . . . . 75 THR CB . 51152 1
357 . 1 . 1 75 75 THR N N 15 114.418 0.062 . 1 . . . . . 75 THR N . 51152 1
358 . 1 . 1 76 76 ALA H H 1 8.298 0.002 . 1 . . . . . 76 ALA H . 51152 1
359 . 1 . 1 76 76 ALA C C 13 174.938 0.001 . 1 . . . . . 76 ALA C . 51152 1
360 . 1 . 1 76 76 ALA CA C 13 50.037 0.008 . 1 . . . . . 76 ALA CA . 51152 1
361 . 1 . 1 76 76 ALA CB C 13 16.870 0.000 . 1 . . . . . 76 ALA CB . 51152 1
362 . 1 . 1 76 76 ALA N N 15 123.519 0.034 . 1 . . . . . 76 ALA N . 51152 1
363 . 1 . 1 77 77 VAL H H 1 8.049 0.005 . 1 . . . . . 77 VAL H . 51152 1
364 . 1 . 1 77 77 VAL C C 13 173.363 0.007 . 1 . . . . . 77 VAL C . 51152 1
365 . 1 . 1 77 77 VAL CA C 13 59.808 0.032 . 1 . . . . . 77 VAL CA . 51152 1
366 . 1 . 1 77 77 VAL CB C 13 30.324 0.000 . 1 . . . . . 77 VAL CB . 51152 1
367 . 1 . 1 77 77 VAL N N 15 115.775 0.085 . 1 . . . . . 77 VAL N . 51152 1
368 . 1 . 1 78 78 ALA H H 1 8.329 0.007 . 1 . . . . . 78 ALA H . 51152 1
369 . 1 . 1 78 78 ALA C C 13 174.974 0.004 . 1 . . . . . 78 ALA C . 51152 1
370 . 1 . 1 78 78 ALA CA C 13 50.051 0.034 . 1 . . . . . 78 ALA CA . 51152 1
371 . 1 . 1 78 78 ALA CB C 13 16.747 0.000 . 1 . . . . . 78 ALA CB . 51152 1
372 . 1 . 1 78 78 ALA N N 15 124.140 0.098 . 1 . . . . . 78 ALA N . 51152 1
373 . 1 . 1 79 79 GLN H H 1 8.304 0.008 . 1 . . . . . 79 GLN H . 51152 1
374 . 1 . 1 79 79 GLN C C 13 173.310 0.002 . 1 . . . . . 79 GLN C . 51152 1
375 . 1 . 1 79 79 GLN CA C 13 53.402 0.014 . 1 . . . . . 79 GLN CA . 51152 1
376 . 1 . 1 79 79 GLN CB C 13 27.166 0.000 . 1 . . . . . 79 GLN CB . 51152 1
377 . 1 . 1 79 79 GLN N N 15 116.501 0.011 . 1 . . . . . 79 GLN N . 51152 1
378 . 1 . 1 80 80 LYS H H 1 8.379 0.002 . 1 . . . . . 80 LYS H . 51152 1
379 . 1 . 1 80 80 LYS C C 13 174.015 0.006 . 1 . . . . . 80 LYS C . 51152 1
380 . 1 . 1 80 80 LYS CA C 13 53.930 0.022 . 1 . . . . . 80 LYS CA . 51152 1
381 . 1 . 1 80 80 LYS CB C 13 30.680 0.000 . 1 . . . . . 80 LYS CB . 51152 1
382 . 1 . 1 80 80 LYS N N 15 119.339 0.079 . 1 . . . . . 80 LYS N . 51152 1
383 . 1 . 1 81 81 THR H H 1 8.238 0.002 . 1 . . . . . 81 THR H . 51152 1
384 . 1 . 1 81 81 THR C C 13 171.937 0.003 . 1 . . . . . 81 THR C . 51152 1
385 . 1 . 1 81 81 THR CA C 13 59.302 0.006 . 1 . . . . . 81 THR CA . 51152 1
386 . 1 . 1 81 81 THR CB C 13 67.427 0.000 . 1 . . . . . 81 THR CB . 51152 1
387 . 1 . 1 81 81 THR N N 15 112.774 0.049 . 1 . . . . . 81 THR N . 51152 1
388 . 1 . 1 82 82 VAL H H 1 8.218 0.003 . 1 . . . . . 82 VAL H . 51152 1
389 . 1 . 1 82 82 VAL C C 13 173.497 0.001 . 1 . . . . . 82 VAL C . 51152 1
390 . 1 . 1 82 82 VAL CA C 13 59.828 0.009 . 1 . . . . . 82 VAL CA . 51152 1
391 . 1 . 1 82 82 VAL CB C 13 30.353 0.000 . 1 . . . . . 82 VAL CB . 51152 1
392 . 1 . 1 82 82 VAL N N 15 118.768 0.070 . 1 . . . . . 82 VAL N . 51152 1
393 . 1 . 1 83 83 GLU H H 1 8.531 0.001 . 1 . . . . . 83 GLU H . 51152 1
394 . 1 . 1 83 83 GLU C C 13 174.394 0.009 . 1 . . . . . 83 GLU C . 51152 1
395 . 1 . 1 83 83 GLU CA C 13 54.326 0.026 . 1 . . . . . 83 GLU CA . 51152 1
396 . 1 . 1 83 83 GLU CB C 13 27.756 0.000 . 1 . . . . . 83 GLU CB . 51152 1
397 . 1 . 1 83 83 GLU N N 15 121.427 0.032 . 1 . . . . . 83 GLU N . 51152 1
398 . 1 . 1 84 84 GLY H H 1 8.460 0.003 . 1 . . . . . 84 GLY H . 51152 1
399 . 1 . 1 84 84 GLY C C 13 171.562 0.011 . 1 . . . . . 84 GLY C . 51152 1
400 . 1 . 1 84 84 GLY CA C 13 42.940 0.016 . 1 . . . . . 84 GLY CA . 51152 1
401 . 1 . 1 84 84 GLY N N 15 107.101 0.015 . 1 . . . . . 84 GLY N . 51152 1
402 . 1 . 1 85 85 ALA H H 1 8.247 0.002 . 1 . . . . . 85 ALA H . 51152 1
403 . 1 . 1 85 85 ALA C C 13 175.754 0.010 . 1 . . . . . 85 ALA C . 51152 1
404 . 1 . 1 85 85 ALA CA C 13 50.294 0.007 . 1 . . . . . 85 ALA CA . 51152 1
405 . 1 . 1 85 85 ALA CB C 13 16.779 0.000 . 1 . . . . . 85 ALA CB . 51152 1
406 . 1 . 1 85 85 ALA N N 15 120.749 0.026 . 1 . . . . . 85 ALA N . 51152 1
407 . 1 . 1 86 86 GLY H H 1 8.470 0.001 . 1 . . . . . 86 GLY H . 51152 1
408 . 1 . 1 86 86 GLY C C 13 171.796 0.002 . 1 . . . . . 86 GLY C . 51152 1
409 . 1 . 1 86 86 GLY CA C 13 42.958 0.009 . 1 . . . . . 86 GLY CA . 51152 1
410 . 1 . 1 86 86 GLY N N 15 104.730 0.020 . 1 . . . . . 86 GLY N . 51152 1
411 . 1 . 1 87 87 SER H H 1 8.178 0.004 . 1 . . . . . 87 SER H . 51152 1
412 . 1 . 1 87 87 SER C C 13 172.201 0.003 . 1 . . . . . 87 SER C . 51152 1
413 . 1 . 1 87 87 SER CA C 13 55.889 0.004 . 1 . . . . . 87 SER CA . 51152 1
414 . 1 . 1 87 87 SER CB C 13 61.464 0.000 . 1 . . . . . 87 SER CB . 51152 1
415 . 1 . 1 87 87 SER N N 15 112.371 0.019 . 1 . . . . . 87 SER N . 51152 1
416 . 1 . 1 88 88 ILE H H 1 8.162 0.002 . 1 . . . . . 88 ILE H . 51152 1
417 . 1 . 1 88 88 ILE C C 13 173.566 0.002 . 1 . . . . . 88 ILE C . 51152 1
418 . 1 . 1 88 88 ILE CA C 13 58.907 0.028 . 1 . . . . . 88 ILE CA . 51152 1
419 . 1 . 1 88 88 ILE CB C 13 36.293 0.000 . 1 . . . . . 88 ILE CB . 51152 1
420 . 1 . 1 88 88 ILE N N 15 119.020 0.033 . 1 . . . . . 88 ILE N . 51152 1
421 . 1 . 1 89 89 ALA H H 1 8.301 0.002 . 1 . . . . . 89 ALA H . 51152 1
422 . 1 . 1 89 89 ALA C C 13 174.888 0.002 . 1 . . . . . 89 ALA C . 51152 1
423 . 1 . 1 89 89 ALA CA C 13 50.097 0.011 . 1 . . . . . 89 ALA CA . 51152 1
424 . 1 . 1 89 89 ALA CB C 13 16.679 0.000 . 1 . . . . . 89 ALA CB . 51152 1
425 . 1 . 1 89 89 ALA N N 15 124.221 0.039 . 1 . . . . . 89 ALA N . 51152 1
426 . 1 . 1 90 90 ALA H H 1 8.141 0.002 . 1 . . . . . 90 ALA H . 51152 1
427 . 1 . 1 90 90 ALA C C 13 175.001 0.078 . 1 . . . . . 90 ALA C . 51152 1
428 . 1 . 1 90 90 ALA CA C 13 50.040 0.001 . 1 . . . . . 90 ALA CA . 51152 1
429 . 1 . 1 90 90 ALA CB C 13 16.772 0.007 . 1 . . . . . 90 ALA CB . 51152 1
430 . 1 . 1 90 90 ALA N N 15 119.754 0.006 . 1 . . . . . 90 ALA N . 51152 1
431 . 1 . 1 91 91 ALA H H 1 8.244 0.006 . 1 . . . . . 91 ALA H . 51152 1
432 . 1 . 1 91 91 ALA C C 13 175.433 0.005 . 1 . . . . . 91 ALA C . 51152 1
433 . 1 . 1 91 91 ALA CA C 13 50.190 0.020 . 1 . . . . . 91 ALA CA . 51152 1
434 . 1 . 1 91 91 ALA CB C 13 16.733 0.000 . 1 . . . . . 91 ALA CB . 51152 1
435 . 1 . 1 91 91 ALA N N 15 119.799 0.002 . 1 . . . . . 91 ALA N . 51152 1
436 . 1 . 1 92 92 THR H H 1 8.045 0.002 . 1 . . . . . 92 THR H . 51152 1
437 . 1 . 1 92 92 THR C C 13 172.540 0.004 . 1 . . . . . 92 THR C . 51152 1
438 . 1 . 1 92 92 THR CA C 13 59.479 0.046 . 1 . . . . . 92 THR CA . 51152 1
439 . 1 . 1 92 92 THR CB C 13 67.387 0.000 . 1 . . . . . 92 THR CB . 51152 1
440 . 1 . 1 92 92 THR N N 15 108.827 0.020 . 1 . . . . . 92 THR N . 51152 1
441 . 1 . 1 93 93 GLY H H 1 8.302 0.003 . 1 . . . . . 93 GLY H . 51152 1
442 . 1 . 1 93 93 GLY C C 13 171.125 0.003 . 1 . . . . . 93 GLY C . 51152 1
443 . 1 . 1 93 93 GLY CA C 13 42.859 0.007 . 1 . . . . . 93 GLY CA . 51152 1
444 . 1 . 1 93 93 GLY N N 15 107.230 0.029 . 1 . . . . . 93 GLY N . 51152 1
445 . 1 . 1 94 94 PHE H H 1 8.097 0.005 . 1 . . . . . 94 PHE H . 51152 1
446 . 1 . 1 94 94 PHE C C 13 172.893 0.005 . 1 . . . . . 94 PHE C . 51152 1
447 . 1 . 1 94 94 PHE CA C 13 55.207 0.009 . 1 . . . . . 94 PHE CA . 51152 1
448 . 1 . 1 94 94 PHE CB C 13 37.217 0.000 . 1 . . . . . 94 PHE CB . 51152 1
449 . 1 . 1 94 94 PHE N N 15 116.911 0.017 . 1 . . . . . 94 PHE N . 51152 1
450 . 1 . 1 95 95 VAL H H 1 8.047 0.001 . 1 . . . . . 95 VAL H . 51152 1
451 . 1 . 1 95 95 VAL C C 13 172.901 0.006 . 1 . . . . . 95 VAL C . 51152 1
452 . 1 . 1 95 95 VAL CA C 13 59.611 0.031 . 1 . . . . . 95 VAL CA . 51152 1
453 . 1 . 1 95 95 VAL CB C 13 30.560 0.000 . 1 . . . . . 95 VAL CB . 51152 1
454 . 1 . 1 95 95 VAL N N 15 119.074 0.066 . 1 . . . . . 95 VAL N . 51152 1
455 . 1 . 1 96 96 LYS H H 1 8.355 0.003 . 1 . . . . . 96 LYS H . 51152 1
456 . 1 . 1 96 96 LYS C C 13 173.826 0.002 . 1 . . . . . 96 LYS C . 51152 1
457 . 1 . 1 96 96 LYS CA C 13 53.762 0.008 . 1 . . . . . 96 LYS CA . 51152 1
458 . 1 . 1 96 96 LYS CB C 13 30.603 0.000 . 1 . . . . . 96 LYS CB . 51152 1
459 . 1 . 1 96 96 LYS N N 15 122.528 0.042 . 1 . . . . . 96 LYS N . 51152 1
460 . 1 . 1 97 97 LYS H H 1 8.431 0.001 . 1 . . . . . 97 LYS H . 51152 1
461 . 1 . 1 97 97 LYS C C 13 173.734 0.006 . 1 . . . . . 97 LYS C . 51152 1
462 . 1 . 1 97 97 LYS CA C 13 54.125 0.059 . 1 . . . . . 97 LYS CA . 51152 1
463 . 1 . 1 97 97 LYS CB C 13 30.732 0.051 . 1 . . . . . 97 LYS CB . 51152 1
464 . 1 . 1 97 97 LYS N N 15 120.183 0.017 . 1 . . . . . 97 LYS N . 51152 1
465 . 1 . 1 98 98 ASP H H 1 8.421 0.005 . 1 . . . . . 98 ASP H . 51152 1
466 . 1 . 1 98 98 ASP C C 13 173.664 0.018 . 1 . . . . . 98 ASP C . 51152 1
467 . 1 . 1 98 98 ASP CA C 13 52.005 0.011 . 1 . . . . . 98 ASP CA . 51152 1
468 . 1 . 1 98 98 ASP CB C 13 38.660 0.000 . 1 . . . . . 98 ASP CB . 51152 1
469 . 1 . 1 98 98 ASP N N 15 117.681 0.050 . 1 . . . . . 98 ASP N . 51152 1
470 . 1 . 1 99 99 GLN H H 1 8.324 0.006 . 1 . . . . . 99 GLN H . 51152 1
471 . 1 . 1 99 99 GLN C C 13 173.378 0.002 . 1 . . . . . 99 GLN C . 51152 1
472 . 1 . 1 99 99 GLN CA C 13 53.489 0.019 . 1 . . . . . 99 GLN CA . 51152 1
473 . 1 . 1 99 99 GLN CB C 13 27.005 0.000 . 1 . . . . . 99 GLN CB . 51152 1
474 . 1 . 1 99 99 GLN N N 15 116.660 0.089 . 1 . . . . . 99 GLN N . 51152 1
475 . 1 . 1 100 100 LEU H H 1 8.259 0.002 . 1 . . . . . 100 LEU H . 51152 1
476 . 1 . 1 100 100 LEU C C 13 175.306 0.005 . 1 . . . . . 100 LEU C . 51152 1
477 . 1 . 1 100 100 LEU CA C 13 52.959 0.023 . 1 . . . . . 100 LEU CA . 51152 1
478 . 1 . 1 100 100 LEU CB C 13 39.915 0.000 . 1 . . . . . 100 LEU CB . 51152 1
479 . 1 . 1 100 100 LEU N N 15 119.352 0.014 . 1 . . . . . 100 LEU N . 51152 1
480 . 1 . 1 101 101 GLY H H 1 8.451 0.003 . 1 . . . . . 101 GLY H . 51152 1
481 . 1 . 1 101 101 GLY C C 13 171.523 0.003 . 1 . . . . . 101 GLY C . 51152 1
482 . 1 . 1 101 101 GLY CA C 13 42.953 0.020 . 1 . . . . . 101 GLY CA . 51152 1
483 . 1 . 1 101 101 GLY N N 15 106.325 0.018 . 1 . . . . . 101 GLY N . 51152 1
484 . 1 . 1 102 102 LYS H H 1 8.194 0.006 . 1 . . . . . 102 LYS H . 51152 1
485 . 1 . 1 102 102 LYS C C 13 173.782 0.002 . 1 . . . . . 102 LYS C . 51152 1
486 . 1 . 1 102 102 LYS CA C 13 53.736 0.017 . 1 . . . . . 102 LYS CA . 51152 1
487 . 1 . 1 102 102 LYS CB C 13 30.698 0.000 . 1 . . . . . 102 LYS CB . 51152 1
488 . 1 . 1 102 102 LYS N N 15 117.487 0.064 . 1 . . . . . 102 LYS N . 51152 1
489 . 1 . 1 103 103 ASN H H 1 8.596 0.001 . 1 . . . . . 103 ASN H . 51152 1
490 . 1 . 1 103 103 ASN C C 13 172.679 0.001 . 1 . . . . . 103 ASN C . 51152 1
491 . 1 . 1 103 103 ASN CA C 13 50.942 0.015 . 1 . . . . . 103 ASN CA . 51152 1
492 . 1 . 1 103 103 ASN CB C 13 36.428 0.010 . 1 . . . . . 103 ASN CB . 51152 1
493 . 1 . 1 103 103 ASN N N 15 116.772 0.015 . 1 . . . . . 103 ASN N . 51152 1
494 . 1 . 1 104 104 GLU H H 1 8.487 0.003 . 1 . . . . . 104 GLU H . 51152 1
495 . 1 . 1 104 104 GLU C C 13 173.870 0.003 . 1 . . . . . 104 GLU C . 51152 1
496 . 1 . 1 104 104 GLU CA C 13 54.129 0.011 . 1 . . . . . 104 GLU CA . 51152 1
497 . 1 . 1 104 104 GLU CB C 13 27.722 0.020 . 1 . . . . . 104 GLU CB . 51152 1
498 . 1 . 1 104 104 GLU N N 15 118.042 0.018 . 1 . . . . . 104 GLU N . 51152 1
499 . 1 . 1 105 105 GLU H H 1 8.457 0.003 . 1 . . . . . 105 GLU H . 51152 1
500 . 1 . 1 105 105 GLU C C 13 174.338 0.008 . 1 . . . . . 105 GLU C . 51152 1
501 . 1 . 1 105 105 GLU CA C 13 54.354 0.003 . 1 . . . . . 105 GLU CA . 51152 1
502 . 1 . 1 105 105 GLU CB C 13 27.707 0.000 . 1 . . . . . 105 GLU CB . 51152 1
503 . 1 . 1 105 105 GLU N N 15 118.348 0.034 . 1 . . . . . 105 GLU N . 51152 1
504 . 1 . 1 106 106 GLY H H 1 8.409 0.001 . 1 . . . . . 106 GLY H . 51152 1
505 . 1 . 1 106 106 GLY C C 13 170.877 0.003 . 1 . . . . . 106 GLY C . 51152 1
506 . 1 . 1 106 106 GLY CA C 13 42.698 0.012 . 1 . . . . . 106 GLY CA . 51152 1
507 . 1 . 1 106 106 GLY N N 15 106.744 0.117 . 1 . . . . . 106 GLY N . 51152 1
508 . 1 . 1 107 107 ALA H H 1 8.106 0.002 . 1 . . . . . 107 ALA H . 51152 1
509 . 1 . 1 107 107 ALA C C 13 173.012 0.000 . 1 . . . . . 107 ALA C . 51152 1
510 . 1 . 1 107 107 ALA CA C 13 47.943 0.000 . 1 . . . . . 107 ALA CA . 51152 1
511 . 1 . 1 107 107 ALA CB C 13 15.897 0.000 . 1 . . . . . 107 ALA CB . 51152 1
512 . 1 . 1 107 107 ALA N N 15 121.622 0.017 . 1 . . . . . 107 ALA N . 51152 1
513 . 1 . 1 108 108 PRO C C 13 174.498 0.008 . 1 . . . . . 108 PRO C . 51152 1
514 . 1 . 1 108 108 PRO CA C 13 60.724 0.035 . 1 . . . . . 108 PRO CA . 51152 1
515 . 1 . 1 108 108 PRO CB C 13 29.508 0.000 . 1 . . . . . 108 PRO CB . 51152 1
516 . 1 . 1 109 109 GLN H H 1 8.510 0.003 . 1 . . . . . 109 GLN H . 51152 1
517 . 1 . 1 109 109 GLN C C 13 173.382 0.000 . 1 . . . . . 109 GLN C . 51152 1
518 . 1 . 1 109 109 GLN CA C 13 53.389 0.017 . 1 . . . . . 109 GLN CA . 51152 1
519 . 1 . 1 109 109 GLN CB C 13 27.206 0.000 . 1 . . . . . 109 GLN CB . 51152 1
520 . 1 . 1 109 109 GLN N N 15 117.450 0.026 . 1 . . . . . 109 GLN N . 51152 1
521 . 1 . 1 110 110 GLU H H 1 8.470 0.001 . 1 . . . . . 110 GLU H . 51152 1
522 . 1 . 1 110 110 GLU C C 13 174.190 0.001 . 1 . . . . . 110 GLU C . 51152 1
523 . 1 . 1 110 110 GLU CA C 13 54.193 0.049 . 1 . . . . . 110 GLU CA . 51152 1
524 . 1 . 1 110 110 GLU CB C 13 27.832 0.000 . 1 . . . . . 110 GLU CB . 51152 1
525 . 1 . 1 110 110 GLU N N 15 118.618 0.021 . 1 . . . . . 110 GLU N . 51152 1
526 . 1 . 1 111 111 GLY H H 1 8.454 0.007 . 1 . . . . . 111 GLY H . 51152 1
527 . 1 . 1 111 111 GLY C C 13 171.260 0.003 . 1 . . . . . 111 GLY C . 51152 1
528 . 1 . 1 111 111 GLY CA C 13 42.952 0.003 . 1 . . . . . 111 GLY CA . 51152 1
529 . 1 . 1 111 111 GLY N N 15 106.544 0.149 . 1 . . . . . 111 GLY N . 51152 1
530 . 1 . 1 112 112 ILE H H 1 7.955 0.003 . 1 . . . . . 112 ILE H . 51152 1
531 . 1 . 1 112 112 ILE C C 13 173.489 0.004 . 1 . . . . . 112 ILE C . 51152 1
532 . 1 . 1 112 112 ILE CA C 13 58.513 0.005 . 1 . . . . . 112 ILE CA . 51152 1
533 . 1 . 1 112 112 ILE CB C 13 36.320 0.000 . 1 . . . . . 112 ILE CB . 51152 1
534 . 1 . 1 112 112 ILE N N 15 116.517 0.024 . 1 . . . . . 112 ILE N . 51152 1
535 . 1 . 1 113 113 LEU H H 1 8.335 0.006 . 1 . . . . . 113 LEU H . 51152 1
536 . 1 . 1 113 113 LEU C C 13 174.474 0.003 . 1 . . . . . 113 LEU C . 51152 1
537 . 1 . 1 113 113 LEU CA C 13 52.599 0.021 . 1 . . . . . 113 LEU CA . 51152 1
538 . 1 . 1 113 113 LEU CB C 13 40.012 0.000 . 1 . . . . . 113 LEU CB . 51152 1
539 . 1 . 1 113 113 LEU N N 15 122.968 0.114 . 1 . . . . . 113 LEU N . 51152 1
540 . 1 . 1 114 114 GLU H H 1 8.381 0.002 . 1 . . . . . 114 GLU H . 51152 1
541 . 1 . 1 114 114 GLU C C 13 173.187 0.008 . 1 . . . . . 114 GLU C . 51152 1
542 . 1 . 1 114 114 GLU CA C 13 53.972 0.003 . 1 . . . . . 114 GLU CA . 51152 1
543 . 1 . 1 114 114 GLU CB C 13 27.834 0.000 . 1 . . . . . 114 GLU CB . 51152 1
544 . 1 . 1 114 114 GLU N N 15 118.476 0.103 . 1 . . . . . 114 GLU N . 51152 1
545 . 1 . 1 115 115 ASP H H 1 8.345 0.002 . 1 . . . . . 115 ASP H . 51152 1
546 . 1 . 1 115 115 ASP C C 13 172.978 0.007 . 1 . . . . . 115 ASP C . 51152 1
547 . 1 . 1 115 115 ASP CA C 13 51.613 0.027 . 1 . . . . . 115 ASP CA . 51152 1
548 . 1 . 1 115 115 ASP CB C 13 38.499 0.009 . 1 . . . . . 115 ASP CB . 51152 1
549 . 1 . 1 115 115 ASP N N 15 117.734 0.020 . 1 . . . . . 115 ASP N . 51152 1
550 . 1 . 1 116 116 MET H H 1 8.197 0.002 . 1 . . . . . 116 MET H . 51152 1
551 . 1 . 1 116 116 MET C C 13 171.421 0.000 . 1 . . . . . 116 MET C . 51152 1
552 . 1 . 1 116 116 MET CA C 13 50.793 0.000 . 1 . . . . . 116 MET CA . 51152 1
553 . 1 . 1 116 116 MET CB C 13 30.453 0.000 . 1 . . . . . 116 MET CB . 51152 1
554 . 1 . 1 116 116 MET N N 15 118.282 0.050 . 1 . . . . . 116 MET N . 51152 1
555 . 1 . 1 117 117 PRO C C 13 174.066 0.000 . 1 . . . . . 117 PRO C . 51152 1
556 . 1 . 1 117 117 PRO CA C 13 60.496 0.024 . 1 . . . . . 117 PRO CA . 51152 1
557 . 1 . 1 117 117 PRO CB C 13 29.508 0.000 . 1 . . . . . 117 PRO CB . 51152 1
558 . 1 . 1 118 118 VAL H H 1 8.176 0.010 . 1 . . . . . 118 VAL H . 51152 1
559 . 1 . 1 118 118 VAL C C 13 172.998 0.006 . 1 . . . . . 118 VAL C . 51152 1
560 . 1 . 1 118 118 VAL CA C 13 59.388 0.020 . 1 . . . . . 118 VAL CA . 51152 1
561 . 1 . 1 118 118 VAL CB C 13 30.638 0.000 . 1 . . . . . 118 VAL CB . 51152 1
562 . 1 . 1 118 118 VAL N N 15 116.776 0.109 . 1 . . . . . 118 VAL N . 51152 1
563 . 1 . 1 119 119 ASP H H 1 8.416 0.004 . 1 . . . . . 119 ASP H . 51152 1
564 . 1 . 1 119 119 ASP C C 13 172.130 0.000 . 1 . . . . . 119 ASP C . 51152 1
565 . 1 . 1 119 119 ASP CA C 13 49.448 0.000 . 1 . . . . . 119 ASP CA . 51152 1
566 . 1 . 1 119 119 ASP CB C 13 38.611 0.000 . 1 . . . . . 119 ASP CB . 51152 1
567 . 1 . 1 119 119 ASP N N 15 121.746 0.039 . 1 . . . . . 119 ASP N . 51152 1
568 . 1 . 1 120 120 PRO C C 13 174.384 0.007 . 1 . . . . . 120 PRO C . 51152 1
569 . 1 . 1 120 120 PRO CA C 13 61.177 0.014 . 1 . . . . . 120 PRO CA . 51152 1
570 . 1 . 1 120 120 PRO CB C 13 29.662 0.000 . 1 . . . . . 120 PRO CB . 51152 1
571 . 1 . 1 121 121 ASP H H 1 8.404 0.004 . 1 . . . . . 121 ASP H . 51152 1
572 . 1 . 1 121 121 ASP C C 13 173.533 0.005 . 1 . . . . . 121 ASP C . 51152 1
573 . 1 . 1 121 121 ASP CA C 13 51.983 0.036 . 1 . . . . . 121 ASP CA . 51152 1
574 . 1 . 1 121 121 ASP CB C 13 38.241 0.000 . 1 . . . . . 121 ASP CB . 51152 1
575 . 1 . 1 121 121 ASP N N 15 115.834 0.018 . 1 . . . . . 121 ASP N . 51152 1
576 . 1 . 1 122 122 ASN H H 1 8.182 0.006 . 1 . . . . . 122 ASN H . 51152 1
577 . 1 . 1 122 122 ASN C C 13 172.770 0.003 . 1 . . . . . 122 ASN C . 51152 1
578 . 1 . 1 122 122 ASN CA C 13 51.090 0.027 . 1 . . . . . 122 ASN CA . 51152 1
579 . 1 . 1 122 122 ASN CB C 13 36.835 0.000 . 1 . . . . . 122 ASN CB . 51152 1
580 . 1 . 1 122 122 ASN N N 15 115.683 0.023 . 1 . . . . . 122 ASN N . 51152 1
581 . 1 . 1 123 123 GLU H H 1 8.345 0.003 . 1 . . . . . 123 GLU H . 51152 1
582 . 1 . 1 123 123 GLU C C 13 173.386 0.006 . 1 . . . . . 123 GLU C . 51152 1
583 . 1 . 1 123 123 GLU CA C 13 54.238 0.014 . 1 . . . . . 123 GLU CA . 51152 1
584 . 1 . 1 123 123 GLU CB C 13 27.264 0.000 . 1 . . . . . 123 GLU CB . 51152 1
585 . 1 . 1 123 123 GLU N N 15 117.810 0.058 . 1 . . . . . 123 GLU N . 51152 1
586 . 1 . 1 124 124 ALA H H 1 8.192 0.007 . 1 . . . . . 124 ALA H . 51152 1
587 . 1 . 1 124 124 ALA C C 13 174.592 0.005 . 1 . . . . . 124 ALA C . 51152 1
588 . 1 . 1 124 124 ALA CA C 13 49.989 0.014 . 1 . . . . . 124 ALA CA . 51152 1
589 . 1 . 1 124 124 ALA CB C 13 16.738 0.000 . 1 . . . . . 124 ALA CB . 51152 1
590 . 1 . 1 124 124 ALA N N 15 120.786 0.068 . 1 . . . . . 124 ALA N . 51152 1
591 . 1 . 1 125 125 TYR H H 1 7.989 0.002 . 1 . . . . . 125 TYR H . 51152 1
592 . 1 . 1 125 125 TYR C C 13 172.845 0.005 . 1 . . . . . 125 TYR C . 51152 1
593 . 1 . 1 125 125 TYR CA C 13 55.111 0.009 . 1 . . . . . 125 TYR CA . 51152 1
594 . 1 . 1 125 125 TYR CB C 13 36.487 0.007 . 1 . . . . . 125 TYR CB . 51152 1
595 . 1 . 1 125 125 TYR N N 15 115.872 0.048 . 1 . . . . . 125 TYR N . 51152 1
596 . 1 . 1 126 126 GLU H H 1 8.163 0.004 . 1 . . . . . 126 GLU H . 51152 1
597 . 1 . 1 126 126 GLU C C 13 172.968 0.008 . 1 . . . . . 126 GLU C . 51152 1
598 . 1 . 1 126 126 GLU CA C 13 53.354 0.012 . 1 . . . . . 126 GLU CA . 51152 1
599 . 1 . 1 126 126 GLU CB C 13 27.848 0.000 . 1 . . . . . 126 GLU CB . 51152 1
600 . 1 . 1 126 126 GLU N N 15 119.124 0.176 . 1 . . . . . 126 GLU N . 51152 1
601 . 1 . 1 127 127 MET H H 1 8.346 0.008 . 1 . . . . . 127 MET H . 51152 1
602 . 1 . 1 127 127 MET C C 13 171.636 0.000 . 1 . . . . . 127 MET C . 51152 1
603 . 1 . 1 127 127 MET CA C 13 50.832 0.000 . 1 . . . . . 127 MET CA . 51152 1
604 . 1 . 1 127 127 MET CB C 13 30.297 0.000 . 1 . . . . . 127 MET CB . 51152 1
605 . 1 . 1 127 127 MET N N 15 119.797 0.015 . 1 . . . . . 127 MET N . 51152 1
606 . 1 . 1 128 128 PRO C C 13 174.345 0.013 . 1 . . . . . 128 PRO C . 51152 1
607 . 1 . 1 128 128 PRO CA C 13 60.734 0.028 . 1 . . . . . 128 PRO CA . 51152 1
608 . 1 . 1 128 128 PRO CB C 13 29.626 0.000 . 1 . . . . . 128 PRO CB . 51152 1
609 . 1 . 1 129 129 SER H H 1 8.393 0.002 . 1 . . . . . 129 SER H . 51152 1
610 . 1 . 1 129 129 SER C C 13 172.246 0.003 . 1 . . . . . 129 SER C . 51152 1
611 . 1 . 1 129 129 SER CA C 13 55.840 0.002 . 1 . . . . . 129 SER CA . 51152 1
612 . 1 . 1 129 129 SER CB C 13 61.494 0.000 . 1 . . . . . 129 SER CB . 51152 1
613 . 1 . 1 129 129 SER N N 15 112.874 0.026 . 1 . . . . . 129 SER N . 51152 1
614 . 1 . 1 130 130 GLU H H 1 8.519 0.002 . 1 . . . . . 130 GLU H . 51152 1
615 . 1 . 1 130 130 GLU C C 13 173.831 0.003 . 1 . . . . . 130 GLU C . 51152 1
616 . 1 . 1 130 130 GLU CA C 13 54.113 0.015 . 1 . . . . . 130 GLU CA . 51152 1
617 . 1 . 1 130 130 GLU CB C 13 27.549 0.000 . 1 . . . . . 130 GLU CB . 51152 1
618 . 1 . 1 130 130 GLU N N 15 119.500 0.012 . 1 . . . . . 130 GLU N . 51152 1
619 . 1 . 1 131 131 GLU H H 1 8.434 0.006 . 1 . . . . . 131 GLU H . 51152 1
620 . 1 . 1 131 131 GLU C C 13 174.261 0.062 . 1 . . . . . 131 GLU C . 51152 1
621 . 1 . 1 131 131 GLU CA C 13 54.241 0.054 . 1 . . . . . 131 GLU CA . 51152 1
622 . 1 . 1 131 131 GLU CB C 13 27.615 0.000 . 1 . . . . . 131 GLU CB . 51152 1
623 . 1 . 1 131 131 GLU N N 15 118.298 0.108 . 1 . . . . . 131 GLU N . 51152 1
624 . 1 . 1 132 132 GLY H H 1 8.368 0.002 . 1 . . . . . 132 GLY H . 51152 1
625 . 1 . 1 132 132 GLY C C 13 171.270 0.008 . 1 . . . . . 132 GLY C . 51152 1
626 . 1 . 1 132 132 GLY CA C 13 42.835 0.011 . 1 . . . . . 132 GLY CA . 51152 1
627 . 1 . 1 132 132 GLY N N 15 106.323 0.042 . 1 . . . . . 132 GLY N . 51152 1
628 . 1 . 1 133 133 TYR H H 1 8.044 0.003 . 1 . . . . . 133 TYR H . 51152 1
629 . 1 . 1 133 133 TYR C C 13 173.121 0.004 . 1 . . . . . 133 TYR C . 51152 1
630 . 1 . 1 133 133 TYR CA C 13 55.485 0.006 . 1 . . . . . 133 TYR CA . 51152 1
631 . 1 . 1 133 133 TYR CB C 13 36.380 0.000 . 1 . . . . . 133 TYR CB . 51152 1
632 . 1 . 1 133 133 TYR N N 15 116.881 0.021 . 1 . . . . . 133 TYR N . 51152 1
633 . 1 . 1 134 134 GLN H H 1 8.249 0.016 . 1 . . . . . 134 GLN H . 51152 1
634 . 1 . 1 134 134 GLN C C 13 172.435 0.004 . 1 . . . . . 134 GLN C . 51152 1
635 . 1 . 1 134 134 GLN CA C 13 53.178 0.035 . 1 . . . . . 134 GLN CA . 51152 1
636 . 1 . 1 134 134 GLN CB C 13 27.337 0.000 . 1 . . . . . 134 GLN CB . 51152 1
637 . 1 . 1 134 134 GLN N N 15 118.905 0.056 . 1 . . . . . 134 GLN N . 51152 1
638 . 1 . 1 135 135 ASP H H 1 8.267 0.004 . 1 . . . . . 135 ASP H . 51152 1
639 . 1 . 1 135 135 ASP C C 13 172.751 0.006 . 1 . . . . . 135 ASP C . 51152 1
640 . 1 . 1 135 135 ASP CA C 13 51.634 0.032 . 1 . . . . . 135 ASP CA . 51152 1
641 . 1 . 1 135 135 ASP CB C 13 38.406 0.000 . 1 . . . . . 135 ASP CB . 51152 1
642 . 1 . 1 135 135 ASP N N 15 118.145 0.018 . 1 . . . . . 135 ASP N . 51152 1
643 . 1 . 1 136 136 TYR H H 1 8.070 0.002 . 1 . . . . . 136 TYR H . 51152 1
644 . 1 . 1 136 136 TYR C C 13 172.424 0.004 . 1 . . . . . 136 TYR C . 51152 1
645 . 1 . 1 136 136 TYR CA C 13 55.119 0.008 . 1 . . . . . 136 TYR CA . 51152 1
646 . 1 . 1 136 136 TYR CB C 13 36.628 0.014 . 1 . . . . . 136 TYR CB . 51152 1
647 . 1 . 1 136 136 TYR N N 15 117.413 0.023 . 1 . . . . . 136 TYR N . 51152 1
648 . 1 . 1 137 137 GLU H H 1 8.200 0.010 . 1 . . . . . 137 GLU H . 51152 1
649 . 1 . 1 137 137 GLU C C 13 171.146 0.000 . 1 . . . . . 137 GLU C . 51152 1
650 . 1 . 1 137 137 GLU CA C 13 51.010 0.000 . 1 . . . . . 137 GLU CA . 51152 1
651 . 1 . 1 137 137 GLU CB C 13 27.149 0.000 . 1 . . . . . 137 GLU CB . 51152 1
652 . 1 . 1 137 137 GLU N N 15 121.353 0.149 . 1 . . . . . 137 GLU N . 51152 1
653 . 1 . 1 138 138 PRO C C 13 174.260 0.007 . 1 . . . . . 138 PRO C . 51152 1
654 . 1 . 1 138 138 PRO CA C 13 60.573 0.033 . 1 . . . . . 138 PRO CA . 51152 1
655 . 1 . 1 138 138 PRO CB C 13 29.671 0.005 . 1 . . . . . 138 PRO CB . 51152 1
656 . 1 . 1 139 139 GLU H H 1 8.457 0.002 . 1 . . . . . 139 GLU H . 51152 1
657 . 1 . 1 139 139 GLU C C 13 172.632 0.003 . 1 . . . . . 139 GLU C . 51152 1
658 . 1 . 1 139 139 GLU CA C 13 53.965 0.022 . 1 . . . . . 139 GLU CA . 51152 1
659 . 1 . 1 139 139 GLU CB C 13 27.612 0.004 . 1 . . . . . 139 GLU CB . 51152 1
660 . 1 . 1 139 139 GLU N N 15 117.971 0.027 . 1 . . . . . 139 GLU N . 51152 1
661 . 1 . 1 140 140 ALA H H 1 7.954 0.002 . 1 . . . . . 140 ALA H . 51152 1
662 . 1 . 1 140 140 ALA C C 13 179.585 0.000 . 1 . . . . . 140 ALA C . 51152 1
663 . 1 . 1 140 140 ALA CA C 13 51.170 0.000 . 1 . . . . . 140 ALA CA . 51152 1
664 . 1 . 1 140 140 ALA CB C 13 17.905 0.000 . 1 . . . . . 140 ALA CB . 51152 1
665 . 1 . 1 140 140 ALA N N 15 127.272 0.021 . 1 . . . . . 140 ALA N . 51152 1
stop_
save_