###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27416
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_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 '2D 1H-15N HSQC' . . . 27416 1
2 '3D HNCACB' . . . 27416 1
3 '3D CBCA(CO)NH' . . . 27416 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.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 SER CA C 13 59.101 0.005 . 1 . . . . . 352 SER CA . 27416 1
2 . 1 1 2 2 SER CB C 13 64.774 0.004 . 1 . . . . . 352 SER CB . 27416 1
3 . 1 1 3 3 ASN H H 1 8.720 0.003 . 1 . . . . . 353 ASN H . 27416 1
4 . 1 1 3 3 ASN CA C 13 54.225 0.026 . 1 . . . . . 353 ASN CA . 27416 1
5 . 1 1 3 3 ASN CB C 13 39.644 0.062 . 1 . . . . . 353 ASN CB . 27416 1
6 . 1 1 3 3 ASN N N 15 121.703 0.010 . 1 . . . . . 353 ASN N . 27416 1
7 . 1 1 4 4 VAL H H 1 8.145 0.000 . 1 . . . . . 354 VAL H . 27416 1
8 . 1 1 4 4 VAL CA C 13 63.551 0.029 . 1 . . . . . 354 VAL CA . 27416 1
9 . 1 1 4 4 VAL CB C 13 33.524 0.017 . 1 . . . . . 354 VAL CB . 27416 1
10 . 1 1 4 4 VAL N N 15 121.105 0.003 . 1 . . . . . 354 VAL N . 27416 1
11 . 1 1 5 5 LYS H H 1 8.448 0.001 . 1 . . . . . 355 LYS H . 27416 1
12 . 1 1 5 5 LYS CA C 13 57.274 0.024 . 1 . . . . . 355 LYS CA . 27416 1
13 . 1 1 5 5 LYS CB C 13 33.720 0.013 . 1 . . . . . 355 LYS CB . 27416 1
14 . 1 1 5 5 LYS N N 15 125.934 0.004 . 1 . . . . . 355 LYS N . 27416 1
15 . 1 1 6 6 ARG H H 1 8.400 0.002 . 1 . . . . . 356 ARG H . 27416 1
16 . 1 1 6 6 ARG CA C 13 57.083 0.061 . 1 . . . . . 356 ARG CA . 27416 1
17 . 1 1 6 6 ARG CB C 13 31.735 0.026 . 1 . . . . . 356 ARG CB . 27416 1
18 . 1 1 6 6 ARG N N 15 123.361 0.004 . 1 . . . . . 356 ARG N . 27416 1
19 . 1 1 7 7 ARG H H 1 8.525 0.001 . 1 . . . . . 357 ARG H . 27416 1
20 . 1 1 7 7 ARG CA C 13 57.141 0.014 . 1 . . . . . 357 ARG CA . 27416 1
21 . 1 1 7 7 ARG CB C 13 31.687 0.028 . 1 . . . . . 357 ARG CB . 27416 1
22 . 1 1 7 7 ARG N N 15 123.335 0.003 . 1 . . . . . 357 ARG N . 27416 1
23 . 1 1 8 8 THR H H 1 8.247 0.002 . 1 . . . . . 358 THR H . 27416 1
24 . 1 1 8 8 THR CA C 13 62.836 0.020 . 1 . . . . . 358 THR CA . 27416 1
25 . 1 1 8 8 THR CB C 13 70.743 0.042 . 1 . . . . . 358 THR CB . 27416 1
26 . 1 1 8 8 THR N N 15 115.513 0.014 . 1 . . . . . 358 THR N . 27416 1
27 . 1 1 9 9 HIS H H 1 8.531 0.002 . 1 . . . . . 359 HIS H . 27416 1
28 . 1 1 9 9 HIS CA C 13 57.015 0.030 . 1 . . . . . 359 HIS CA . 27416 1
29 . 1 1 9 9 HIS CB C 13 30.855 0.012 . 1 . . . . . 359 HIS CB . 27416 1
30 . 1 1 9 9 HIS N N 15 121.259 0.020 . 1 . . . . . 359 HIS N . 27416 1
31 . 1 1 10 10 ASN H H 1 8.580 0.003 . 1 . . . . . 360 ASN H . 27416 1
32 . 1 1 10 10 ASN CA C 13 54.436 0.020 . 1 . . . . . 360 ASN CA . 27416 1
33 . 1 1 10 10 ASN CB C 13 39.641 0.014 . 1 . . . . . 360 ASN CB . 27416 1
34 . 1 1 10 10 ASN N N 15 120.714 0.015 . 1 . . . . . 360 ASN N . 27416 1
35 . 1 1 11 11 VAL H H 1 8.229 0.003 . 1 . . . . . 361 VAL H . 27416 1
36 . 1 1 11 11 VAL CA C 13 64.729 0.033 . 1 . . . . . 361 VAL CA . 27416 1
37 . 1 1 11 11 VAL CB C 13 33.287 0.011 . 1 . . . . . 361 VAL CB . 27416 1
38 . 1 1 11 11 VAL N N 15 121.477 0.030 . 1 . . . . . 361 VAL N . 27416 1
39 . 1 1 12 12 LEU H H 1 8.241 0.003 . 1 . . . . . 362 LEU H . 27416 1
40 . 1 1 12 12 LEU CA C 13 56.959 0.019 . 1 . . . . . 362 LEU CA . 27416 1
41 . 1 1 12 12 LEU CB C 13 42.719 0.048 . 1 . . . . . 362 LEU CB . 27416 1
42 . 1 1 12 12 LEU N N 15 124.106 0.011 . 1 . . . . . 362 LEU N . 27416 1
43 . 1 1 13 13 GLU H H 1 8.279 0.003 . 1 . . . . . 363 GLU H . 27416 1
44 . 1 1 13 13 GLU CA C 13 58.391 0.003 . 1 . . . . . 363 GLU CA . 27416 1
45 . 1 1 13 13 GLU CB C 13 30.770 0.021 . 1 . . . . . 363 GLU CB . 27416 1
46 . 1 1 13 13 GLU N N 15 121.420 0.025 . 1 . . . . . 363 GLU N . 27416 1
47 . 1 1 14 14 ARG H H 1 8.229 0.001 . 1 . . . . . 364 ARG H . 27416 1
48 . 1 1 14 14 ARG CA C 13 58.405 0.010 . 1 . . . . . 364 ARG CA . 27416 1
49 . 1 1 14 14 ARG CB C 13 31.251 0.061 . 1 . . . . . 364 ARG CB . 27416 1
50 . 1 1 14 14 ARG N N 15 121.331 0.040 . 1 . . . . . 364 ARG N . 27416 1
51 . 1 1 15 15 GLN H H 1 8.298 0.003 . 1 . . . . . 365 GLN H . 27416 1
52 . 1 1 15 15 GLN CA C 13 57.966 0.000 . 1 . . . . . 365 GLN CA . 27416 1
53 . 1 1 15 15 GLN CB C 13 29.842 0.012 . 1 . . . . . 365 GLN CB . 27416 1
54 . 1 1 15 15 GLN N N 15 120.569 0.020 . 1 . . . . . 365 GLN N . 27416 1
55 . 1 1 16 16 ARG H H 1 8.301 0.002 . 1 . . . . . 366 ARG H . 27416 1
56 . 1 1 16 16 ARG CA C 13 57.837 0.154 . 1 . . . . . 366 ARG CA . 27416 1
57 . 1 1 16 16 ARG CB C 13 31.369 0.122 . 1 . . . . . 366 ARG CB . 27416 1
58 . 1 1 16 16 ARG N N 15 121.836 0.018 . 1 . . . . . 366 ARG N . 27416 1
59 . 1 1 17 17 ARG H H 1 8.310 0.005 . 1 . . . . . 367 ARG H . 27416 1
60 . 1 1 17 17 ARG CA C 13 58.253 0.040 . 1 . . . . . 367 ARG CA . 27416 1
61 . 1 1 17 17 ARG CB C 13 31.311 0.075 . 1 . . . . . 367 ARG CB . 27416 1
62 . 1 1 17 17 ARG N N 15 121.027 0.050 . 1 . . . . . 367 ARG N . 27416 1
63 . 1 1 18 18 ASN H H 1 8.390 0.003 . 1 . . . . . 368 ASN H . 27416 1
64 . 1 1 18 18 ASN CA C 13 54.957 0.019 . 1 . . . . . 368 ASN CA . 27416 1
65 . 1 1 18 18 ASN CB C 13 39.361 0.021 . 1 . . . . . 368 ASN CB . 27416 1
66 . 1 1 18 18 ASN N N 15 119.221 0.006 . 1 . . . . . 368 ASN N . 27416 1
67 . 1 1 19 19 GLU H H 1 8.304 0.002 . 1 . . . . . 369 GLU H . 27416 1
68 . 1 1 19 19 GLU CA C 13 58.225 0.039 . 1 . . . . . 369 GLU CA . 27416 1
69 . 1 1 19 19 GLU CB C 13 30.916 0.100 . 1 . . . . . 369 GLU CB . 27416 1
70 . 1 1 19 19 GLU N N 15 121.205 0.038 . 1 . . . . . 369 GLU N . 27416 1
71 . 1 1 20 20 LEU H H 1 8.075 0.001 . 1 . . . . . 370 LEU H . 27416 1
72 . 1 1 20 20 LEU CA C 13 56.568 0.000 . 1 . . . . . 370 LEU CA . 27416 1
73 . 1 1 20 20 LEU CB C 13 43.050 0.033 . 1 . . . . . 370 LEU CB . 27416 1
74 . 1 1 20 20 LEU N N 15 121.682 0.012 . 1 . . . . . 370 LEU N . 27416 1
75 . 1 1 21 21 LYS H H 1 8.105 0.001 . 1 . . . . . 371 LYS H . 27416 1
76 . 1 1 21 21 LYS CA C 13 57.678 0.024 . 1 . . . . . 371 LYS CA . 27416 1
77 . 1 1 21 21 LYS CB C 13 33.588 0.031 . 1 . . . . . 371 LYS CB . 27416 1
78 . 1 1 21 21 LYS N N 15 121.528 0.008 . 1 . . . . . 371 LYS N . 27416 1
79 . 1 1 22 22 ARG H H 1 8.212 0.001 . 1 . . . . . 372 ARG H . 27416 1
80 . 1 1 22 22 ARG CA C 13 57.618 0.003 . 1 . . . . . 372 ARG CA . 27416 1
81 . 1 1 22 22 ARG CB C 13 31.645 0.000 . 1 . . . . . 372 ARG CB . 27416 1
82 . 1 1 22 22 ARG N N 15 121.864 0.007 . 1 . . . . . 372 ARG N . 27416 1
83 . 1 1 23 23 ASP H H 1 8.317 0.002 . 1 . . . . . 373 ASP H . 27416 1
84 . 1 1 23 23 ASP CA C 13 55.300 0.055 . 1 . . . . . 373 ASP CA . 27416 1
85 . 1 1 23 23 ASP CB C 13 41.804 0.007 . 1 . . . . . 373 ASP CB . 27416 1
86 . 1 1 23 23 ASP N N 15 120.941 0.024 . 1 . . . . . 373 ASP N . 27416 1
87 . 1 1 24 24 PHE H H 1 8.128 0.003 . 1 . . . . . 374 PHE H . 27416 1
88 . 1 1 24 24 PHE CA C 13 59.910 0.022 . 1 . . . . . 374 PHE CA . 27416 1
89 . 1 1 24 24 PHE CB C 13 40.349 0.019 . 1 . . . . . 374 PHE CB . 27416 1
90 . 1 1 24 24 PHE N N 15 121.048 0.014 . 1 . . . . . 374 PHE N . 27416 1
91 . 1 1 25 25 PHE H H 1 8.141 0.003 . 1 . . . . . 375 PHE H . 27416 1
92 . 1 1 25 25 PHE CA C 13 59.270 0.051 . 1 . . . . . 375 PHE CA . 27416 1
93 . 1 1 25 25 PHE CB C 13 40.160 0.060 . 1 . . . . . 375 PHE CB . 27416 1
94 . 1 1 25 25 PHE N N 15 120.559 0.006 . 1 . . . . . 375 PHE N . 27416 1
95 . 1 1 26 26 ALA H H 1 7.993 0.002 . 1 . . . . . 376 ALA H . 27416 1
96 . 1 1 26 26 ALA CA C 13 53.814 0.031 . 1 . . . . . 376 ALA CA . 27416 1
97 . 1 1 26 26 ALA CB C 13 19.985 0.034 . 1 . . . . . 376 ALA CB . 27416 1
98 . 1 1 26 26 ALA N N 15 124.376 0.008 . 1 . . . . . 376 ALA N . 27416 1
99 . 1 1 27 27 LEU H H 1 8.052 0.002 . 1 . . . . . 377 LEU H . 27416 1
100 . 1 1 27 27 LEU CA C 13 56.423 0.007 . 1 . . . . . 377 LEU CA . 27416 1
101 . 1 1 27 27 LEU CB C 13 42.932 0.023 . 1 . . . . . 377 LEU CB . 27416 1
102 . 1 1 27 27 LEU N N 15 120.432 0.007 . 1 . . . . . 377 LEU N . 27416 1
103 . 1 1 28 28 ARG H H 1 8.111 0.003 . 1 . . . . . 378 ARG H . 27416 1
104 . 1 1 28 28 ARG CA C 13 57.428 0.018 . 1 . . . . . 378 ARG CA . 27416 1
105 . 1 1 28 28 ARG CB C 13 31.600 0.042 . 1 . . . . . 378 ARG CB . 27416 1
106 . 1 1 28 28 ARG N N 15 120.905 0.008 . 1 . . . . . 378 ARG N . 27416 1
107 . 1 1 29 29 ASP H H 1 8.271 0.001 . 1 . . . . . 379 ASP H . 27416 1
108 . 1 1 29 29 ASP CA C 13 55.511 0.017 . 1 . . . . . 379 ASP CA . 27416 1
109 . 1 1 29 29 ASP CB C 13 41.798 0.015 . 1 . . . . . 379 ASP CB . 27416 1
110 . 1 1 29 29 ASP N N 15 120.179 0.006 . 1 . . . . . 379 ASP N . 27416 1
111 . 1 1 30 30 GLN H H 1 8.137 0.002 . 1 . . . . . 380 GLN H . 27416 1
112 . 1 1 30 30 GLN CA C 13 56.427 0.010 . 1 . . . . . 380 GLN CA . 27416 1
113 . 1 1 30 30 GLN CB C 13 30.409 0.034 . 1 . . . . . 380 GLN CB . 27416 1
114 . 1 1 30 30 GLN N N 15 119.820 0.008 . 1 . . . . . 380 GLN N . 27416 1
115 . 1 1 31 31 ILE H H 1 8.305 0.002 . 1 . . . . . 381 ILE H . 27416 1
116 . 1 1 31 31 ILE CA C 13 59.905 0.000 . 1 . . . . . 381 ILE CA . 27416 1
117 . 1 1 31 31 ILE CB C 13 39.173 0.000 . 1 . . . . . 381 ILE CB . 27416 1
118 . 1 1 31 31 ILE N N 15 124.497 0.007 . 1 . . . . . 381 ILE N . 27416 1
119 . 1 1 32 32 PRO CA C 13 64.240 0.031 . 1 . . . . . 382 PRO CA . 27416 1
120 . 1 1 32 32 PRO CB C 13 33.108 0.045 . 1 . . . . . 382 PRO CB . 27416 1
121 . 1 1 33 33 GLU H H 1 8.552 0.002 . 1 . . . . . 383 GLU H . 27416 1
122 . 1 1 33 33 GLU CA C 13 57.447 0.001 . 1 . . . . . 383 GLU CA . 27416 1
123 . 1 1 33 33 GLU CB C 13 31.055 0.015 . 1 . . . . . 383 GLU CB . 27416 1
124 . 1 1 33 33 GLU N N 15 121.451 0.024 . 1 . . . . . 383 GLU N . 27416 1
125 . 1 1 34 34 LEU H H 1 8.328 0.003 . 1 . . . . . 384 LEU H . 27416 1
126 . 1 1 34 34 LEU CA C 13 56.058 0.007 . 1 . . . . . 384 LEU CA . 27416 1
127 . 1 1 34 34 LEU CB C 13 43.264 0.002 . 1 . . . . . 384 LEU CB . 27416 1
128 . 1 1 34 34 LEU N N 15 123.399 0.004 . 1 . . . . . 384 LEU N . 27416 1
129 . 1 1 35 35 GLU H H 1 8.462 0.002 . 1 . . . . . 385 GLU H . 27416 1
130 . 1 1 35 35 GLU CA C 13 57.433 0.021 . 1 . . . . . 385 GLU CA . 27416 1
131 . 1 1 35 35 GLU CB C 13 31.184 0.030 . 1 . . . . . 385 GLU CB . 27416 1
132 . 1 1 35 35 GLU N N 15 121.851 0.004 . 1 . . . . . 385 GLU N . 27416 1
133 . 1 1 36 36 ASN H H 1 8.538 0.002 . 1 . . . . . 386 ASN H . 27416 1
134 . 1 1 36 36 ASN CA C 13 54.199 0.038 . 1 . . . . . 386 ASN CA . 27416 1
135 . 1 1 36 36 ASN CB C 13 39.728 0.050 . 1 . . . . . 386 ASN CB . 27416 1
136 . 1 1 36 36 ASN N N 15 119.902 0.056 . 1 . . . . . 386 ASN N . 27416 1
137 . 1 1 37 37 ASN H H 1 8.537 0.001 . 1 . . . . . 387 ASN H . 27416 1
138 . 1 1 37 37 ASN CA C 13 54.232 0.010 . 1 . . . . . 387 ASN CA . 27416 1
139 . 1 1 37 37 ASN CB C 13 39.778 0.003 . 1 . . . . . 387 ASN CB . 27416 1
140 . 1 1 37 37 ASN N N 15 119.855 0.044 . 1 . . . . . 387 ASN N . 27416 1
141 . 1 1 38 38 GLU H H 1 8.385 0.003 . 1 . . . . . 388 GLU H . 27416 1
142 . 1 1 38 38 GLU CA C 13 57.729 0.012 . 1 . . . . . 388 GLU CA . 27416 1
143 . 1 1 38 38 GLU CB C 13 30.944 0.026 . 1 . . . . . 388 GLU CB . 27416 1
144 . 1 1 38 38 GLU N N 15 121.210 0.007 . 1 . . . . . 388 GLU N . 27416 1
145 . 1 1 39 39 LYS H H 1 8.291 0.001 . 1 . . . . . 389 LYS H . 27416 1
146 . 1 1 39 39 LYS CA C 13 56.820 0.032 . 1 . . . . . 389 LYS CA . 27416 1
147 . 1 1 39 39 LYS CB C 13 33.840 0.004 . 1 . . . . . 389 LYS CB . 27416 1
148 . 1 1 39 39 LYS N N 15 122.007 0.012 . 1 . . . . . 389 LYS N . 27416 1
149 . 1 1 40 40 ALA H H 1 8.270 0.001 . 1 . . . . . 390 ALA H . 27416 1
150 . 1 1 40 40 ALA CA C 13 51.422 0.000 . 1 . . . . . 390 ALA CA . 27416 1
151 . 1 1 40 40 ALA CB C 13 18.927 0.000 . 1 . . . . . 390 ALA CB . 27416 1
152 . 1 1 40 40 ALA N N 15 126.580 0.006 . 1 . . . . . 390 ALA N . 27416 1
153 . 1 1 41 41 PRO CA C 13 63.674 0.000 . 1 . . . . . 391 PRO CA . 27416 1
154 . 1 1 41 41 PRO CB C 13 33.025 0.000 . 1 . . . . . 391 PRO CB . 27416 1
155 . 1 1 42 42 LYS H H 1 8.468 0.002 . 1 . . . . . 392 LYS H . 27416 1
156 . 1 1 42 42 LYS CA C 13 57.242 0.018 . 1 . . . . . 392 LYS CA . 27416 1
157 . 1 1 42 42 LYS CB C 13 33.846 0.010 . 1 . . . . . 392 LYS CB . 27416 1
158 . 1 1 42 42 LYS N N 15 122.428 0.008 . 1 . . . . . 392 LYS N . 27416 1
159 . 1 1 43 43 VAL H H 1 8.285 0.002 . 1 . . . . . 393 VAL H . 27416 1
160 . 1 1 43 43 VAL CA C 13 63.293 0.021 . 1 . . . . . 393 VAL CA . 27416 1
161 . 1 1 43 43 VAL CB C 13 33.759 0.085 . 1 . . . . . 393 VAL CB . 27416 1
162 . 1 1 43 43 VAL N N 15 123.473 0.006 . 1 . . . . . 393 VAL N . 27416 1
163 . 1 1 44 44 VAL H H 1 8.412 0.002 . 1 . . . . . 394 VAL H . 27416 1
164 . 1 1 44 44 VAL CA C 13 63.214 0.044 . 1 . . . . . 394 VAL CA . 27416 1
165 . 1 1 44 44 VAL CB C 13 33.783 0.019 . 1 . . . . . 394 VAL CB . 27416 1
166 . 1 1 44 44 VAL N N 15 126.872 0.007 . 1 . . . . . 394 VAL N . 27416 1
167 . 1 1 45 45 ILE H H 1 8.441 0.002 . 1 . . . . . 395 ILE H . 27416 1
168 . 1 1 45 45 ILE CA C 13 61.486 0.003 . 1 . . . . . 395 ILE CA . 27416 1
169 . 1 1 45 45 ILE CB C 13 39.155 0.056 . 1 . . . . . 395 ILE CB . 27416 1
170 . 1 1 45 45 ILE N N 15 127.507 0.006 . 1 . . . . . 395 ILE N . 27416 1
171 . 1 1 46 46 LEU H H 1 8.465 0.002 . 1 . . . . . 396 LEU H . 27416 1
172 . 1 1 46 46 LEU CA C 13 55.743 0.047 . 1 . . . . . 396 LEU CA . 27416 1
173 . 1 1 46 46 LEU CB C 13 43.285 0.032 . 1 . . . . . 396 LEU CB . 27416 1
174 . 1 1 46 46 LEU N N 15 128.354 0.012 . 1 . . . . . 396 LEU N . 27416 1
175 . 1 1 47 47 LYS H H 1 8.431 0.004 . 1 . . . . . 397 LYS H . 27416 1
176 . 1 1 47 47 LYS CA C 13 57.060 0.039 . 1 . . . . . 397 LYS CA . 27416 1
177 . 1 1 47 47 LYS CB C 13 34.009 0.006 . 1 . . . . . 397 LYS CB . 27416 1
178 . 1 1 47 47 LYS N N 15 123.603 0.020 . 1 . . . . . 397 LYS N . 27416 1
179 . 1 1 48 48 LYS H H 1 8.473 0.003 . 1 . . . . . 398 LYS H . 27416 1
180 . 1 1 48 48 LYS CA C 13 57.490 0.135 . 1 . . . . . 398 LYS CA . 27416 1
181 . 1 1 48 48 LYS CB C 13 33.972 0.000 . 1 . . . . . 398 LYS CB . 27416 1
182 . 1 1 48 48 LYS N N 15 124.154 0.018 . 1 . . . . . 398 LYS N . 27416 1
183 . 1 1 49 49 ALA H H 1 8.497 0.005 . 1 . . . . . 399 ALA H . 27416 1
184 . 1 1 49 49 ALA N N 15 125.293 0.006 . 1 . . . . . 399 ALA N . 27416 1
stop_
save_