###################################
# 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 18677
_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' . . . 18677 1
2 '2D 1H-13C HSQC' . . . 18677 1
3 '3D CBCA(CO)NH' . . . 18677 1
4 '3D HNCACB' . . . 18677 1
5 '3D C(CO)NH' . . . 18677 1
6 '3D H(CCO)NH' . . . 18677 1
8 '3D 1H-15N TOCSY' . . . 18677 1
9 '3D HNCO' . . . 18677 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 4.256 0.05 . 1 . . . C 327 ALA HA . 18677 1
2 . 1 1 1 1 ALA HB1 H 1 1.430 0.05 . 1 . . . C 327 ALA HB1 . 18677 1
3 . 1 1 1 1 ALA HB2 H 1 1.430 0.05 . 1 . . . C 327 ALA HB2 . 18677 1
4 . 1 1 1 1 ALA HB3 H 1 1.430 0.05 . 1 . . . C 327 ALA HB3 . 18677 1
5 . 1 1 1 1 ALA H H 1 8.373 0.05 . 1 . . . C 327 ALA H1 . 18677 1
6 . 1 1 1 1 ALA C C 13 176.908 0.4 . 1 . . . C 327 ALA C . 18677 1
7 . 1 1 1 1 ALA CA C 13 51.862 0.4 . 1 . . . C 327 ALA CA . 18677 1
8 . 1 1 1 1 ALA CB C 13 19.263 0.4 . 1 . . . C 327 ALA CB . 18677 1
9 . 1 1 1 1 ALA N N 15 125.541 0.2 . 1 . . . C 327 ALA N . 18677 1
10 . 1 1 2 2 VAL H H 1 8.351 0.05 . 1 . . . C 328 VAL H . 18677 1
11 . 1 1 2 2 VAL HA H 1 4.193 0.05 . 1 . . . C 328 VAL HA . 18677 1
12 . 1 1 2 2 VAL HB H 1 2.008 0.05 . 1 . . . C 328 VAL HB . 18677 1
13 . 1 1 2 2 VAL HG11 H 1 1.017 0.05 . . . . . C 328 VAL HG11 . 18677 1
14 . 1 1 2 2 VAL HG12 H 1 1.017 0.05 . . . . . C 328 VAL HG12 . 18677 1
15 . 1 1 2 2 VAL HG13 H 1 1.017 0.05 . . . . . C 328 VAL HG13 . 18677 1
16 . 1 1 2 2 VAL HG21 H 1 1.002 0.05 . . . . . C 328 VAL HG21 . 18677 1
17 . 1 1 2 2 VAL HG22 H 1 1.002 0.05 . . . . . C 328 VAL HG22 . 18677 1
18 . 1 1 2 2 VAL HG23 H 1 1.002 0.05 . . . . . C 328 VAL HG23 . 18677 1
19 . 1 1 2 2 VAL C C 13 177.357 0.4 . 1 . . . C 328 VAL C . 18677 1
20 . 1 1 2 2 VAL CA C 13 62.306 0.4 . 1 . . . C 328 VAL CA . 18677 1
21 . 1 1 2 2 VAL CB C 13 31.970 0.4 . 1 . . . C 328 VAL CB . 18677 1
22 . 1 1 2 2 VAL CG1 C 13 20.760 0.4 . . . . . C 328 VAL CG1 . 18677 1
23 . 1 1 2 2 VAL CG2 C 13 20.760 0.4 . . . . . C 328 VAL CG2 . 18677 1
24 . 1 1 2 2 VAL N N 15 119.732 0.2 . 1 . . . C 328 VAL N . 18677 1
25 . 1 1 3 3 ALA H H 1 8.488 0.05 . 1 . . . C 329 ALA H . 18677 1
26 . 1 1 3 3 ALA HA H 1 4.518 0.05 . 1 . . . C 329 ALA HA . 18677 1
27 . 1 1 3 3 ALA HB1 H 1 1.097 0.05 . 1 . . . C 329 ALA HB1 . 18677 1
28 . 1 1 3 3 ALA HB2 H 1 1.097 0.05 . 1 . . . C 329 ALA HB2 . 18677 1
29 . 1 1 3 3 ALA HB3 H 1 1.097 0.05 . 1 . . . C 329 ALA HB3 . 18677 1
30 . 1 1 3 3 ALA C C 13 177.764 0.4 . 1 . . . C 329 ALA C . 18677 1
31 . 1 1 3 3 ALA CA C 13 51.050 0.4 . 1 . . . C 329 ALA CA . 18677 1
32 . 1 1 3 3 ALA CB C 13 19.519 0.4 . 1 . . . C 329 ALA CB . 18677 1
33 . 1 1 3 3 ALA N N 15 130.173 0.2 . 1 . . . C 329 ALA N . 18677 1
34 . 1 1 4 4 THR H H 1 9.276 0.05 . 1 . . . C 330 THR H . 18677 1
35 . 1 1 4 4 THR HA H 1 4.587 0.05 . 1 . . . C 330 THR HA . 18677 1
36 . 1 1 4 4 THR HB H 1 4.770 0.05 . 1 . . . C 330 THR HB . 18677 1
37 . 1 1 4 4 THR HG21 H 1 1.328 0.05 . 1 . . . C 330 THR HG21 . 18677 1
38 . 1 1 4 4 THR HG22 H 1 1.328 0.05 . 1 . . . C 330 THR HG22 . 18677 1
39 . 1 1 4 4 THR HG23 H 1 1.328 0.05 . 1 . . . C 330 THR HG23 . 18677 1
40 . 1 1 4 4 THR CA C 13 59.610 0.4 . 1 . . . C 330 THR CA . 18677 1
41 . 1 1 4 4 THR CB C 13 67.873 0.4 . 1 . . . C 330 THR CB . 18677 1
42 . 1 1 4 4 THR CG2 C 13 21.58 0.4 . 1 . . . C 330 THR CG2 . 18677 1
43 . 1 1 4 4 THR N N 15 116.112 0.2 . 1 . . . C 330 THR N . 18677 1
44 . 1 1 5 5 PRO HA H 1 4.176 0.05 . 1 . . . C 331 PRO HA . 18677 1
45 . 1 1 5 5 PRO HB2 H 1 1.835 0.05 . . . . . C 331 PRO HB2 . 18677 1
46 . 1 1 5 5 PRO HB3 H 1 2.343 0.05 . . . . . C 331 PRO HB3 . 18677 1
47 . 1 1 5 5 PRO HG2 H 1 2.026 0.05 . . . . . C 331 PRO HG2 . 18677 1
48 . 1 1 5 5 PRO HG3 H 1 2.223 0.05 . . . . . C 331 PRO HG3 . 18677 1
49 . 1 1 5 5 PRO HD2 H 1 3.940 0.05 . . . . . C 331 PRO HD2 . 18677 1
50 . 1 1 5 5 PRO HD3 H 1 3.873 0.05 . . . . . C 331 PRO HD3 . 18677 1
51 . 1 1 5 5 PRO C C 13 179.911 0.4 . 1 . . . C 331 PRO C . 18677 1
52 . 1 1 5 5 PRO CA C 13 65.458 0.4 . 1 . . . C 331 PRO CA . 18677 1
53 . 1 1 5 5 PRO CB C 13 31.360 0.4 . 1 . . . C 331 PRO CB . 18677 1
54 . 1 1 5 5 PRO CG C 13 28.03 0.4 . 1 . . . C 331 PRO CG . 18677 1
55 . 1 1 5 5 PRO CD C 13 49.60 0.4 . 1 . . . C 331 PRO CD . 18677 1
56 . 1 1 6 6 GLU H H 1 8.561 0.05 . 1 . . . C 332 GLU H . 18677 1
57 . 1 1 6 6 GLU HA H 1 3.989 0.05 . 1 . . . C 332 GLU HA . 18677 1
58 . 1 1 6 6 GLU HB2 H 1 2.010 0.05 . . . . . C 332 GLU HB2 . 18677 1
59 . 1 1 6 6 GLU HB3 H 1 1.859 0.05 . . . . . C 332 GLU HB3 . 18677 1
60 . 1 1 6 6 GLU HG2 H 1 2.348 0.05 . . . . . C 332 GLU HG2 . 18677 1
61 . 1 1 6 6 GLU HG3 H 1 2.161 0.05 . . . . . C 332 GLU HG3 . 18677 1
62 . 1 1 6 6 GLU C C 13 178.892 0.4 . 1 . . . C 332 GLU C . 18677 1
63 . 1 1 6 6 GLU CA C 13 59.845 0.4 . 1 . . . C 332 GLU CA . 18677 1
64 . 1 1 6 6 GLU CB C 13 28.425 0.4 . 1 . . . C 332 GLU CB . 18677 1
65 . 1 1 6 6 GLU CG C 13 36.402 0.4 . 1 . . . C 332 GLU CG . 18677 1
66 . 1 1 6 6 GLU N N 15 117.710 0.2 . 1 . . . C 332 GLU N . 18677 1
67 . 1 1 7 7 GLU H H 1 7.785 0.05 . 1 . . . C 333 GLU H . 18677 1
68 . 1 1 7 7 GLU HA H 1 3.825 0.05 . 1 . . . C 333 GLU HA . 18677 1
69 . 1 1 7 7 GLU HB2 H 1 2.380 0.05 . . . . . C 333 GLU HB2 . 18677 1
70 . 1 1 7 7 GLU HB3 H 1 1.663 0.05 . . . . . C 333 GLU HB3 . 18677 1
71 . 1 1 7 7 GLU HG2 H 1 2.235 0.05 . . . . . C 333 GLU HG2 . 18677 1
72 . 1 1 7 7 GLU HG3 H 1 2.190 0.05 . . . . . C 333 GLU HG3 . 18677 1
73 . 1 1 7 7 GLU C C 13 180.410 0.4 . 1 . . . C 333 GLU C . 18677 1
74 . 1 1 7 7 GLU CA C 13 58.441 0.4 . 1 . . . C 333 GLU CA . 18677 1
75 . 1 1 7 7 GLU CB C 13 28.622 0.4 . 1 . . . C 333 GLU CB . 18677 1
76 . 1 1 7 7 GLU CG C 13 36.934 0.4 . 1 . . . C 333 GLU CG . 18677 1
77 . 1 1 7 7 GLU N N 15 120.30 0.2 . 1 . . . C 333 GLU N . 18677 1
78 . 1 1 8 8 LEU H H 1 8.044 0.05 . 1 . . . C 334 LEU H . 18677 1
79 . 1 1 8 8 LEU HA H 1 3.792 0.05 . 1 . . . C 334 LEU HA . 18677 1
80 . 1 1 8 8 LEU HB2 H 1 1.731 0.05 . . . . . C 334 LEU HB2 . 18677 1
81 . 1 1 8 8 LEU HG H 1 1.395 0.05 . 1 . . . C 334 LEU HG . 18677 1
82 . 1 1 8 8 LEU HD11 H 1 0.522 0.05 . . . . . C 334 LEU HD11 . 18677 1
83 . 1 1 8 8 LEU HD12 H 1 0.522 0.05 . . . . . C 334 LEU HD12 . 18677 1
84 . 1 1 8 8 LEU HD13 H 1 0.522 0.05 . . . . . C 334 LEU HD13 . 18677 1
85 . 1 1 8 8 LEU HD21 H 1 0.550 0.05 . . . . . C 334 LEU HD21 . 18677 1
86 . 1 1 8 8 LEU HD22 H 1 0.550 0.05 . . . . . C 334 LEU HD22 . 18677 1
87 . 1 1 8 8 LEU HD23 H 1 0.550 0.05 . . . . . C 334 LEU HD23 . 18677 1
88 . 1 1 8 8 LEU C C 13 179.064 0.4 . 1 . . . C 334 LEU C . 18677 1
89 . 1 1 8 8 LEU CA C 13 57.092 0.4 . 1 . . . C 334 LEU CA . 18677 1
90 . 1 1 8 8 LEU CB C 13 41.261 0.4 . 1 . . . C 334 LEU CB . 18677 1
91 . 1 1 8 8 LEU CG C 13 26.730 0.4 . 1 . . . C 334 LEU CG . 18677 1
92 . 1 1 8 8 LEU CD1 C 13 22.920 0.4 . . . . . C 334 LEU CD1 . 18677 1
93 . 1 1 8 8 LEU CD2 C 13 25.720 0.4 . . . . . C 334 LEU CD2 . 18677 1
94 . 1 1 8 8 LEU N N 15 119.888 0.2 . 1 . . . C 334 LEU N . 18677 1
95 . 1 1 9 9 ALA H H 1 7.931 0.05 . 1 . . . C 335 ALA H . 18677 1
96 . 1 1 9 9 ALA HA H 1 4.095 0.05 . 1 . . . C 335 ALA HA . 18677 1
97 . 1 1 9 9 ALA HB1 H 1 1.435 0.05 . 1 . . . C 335 ALA HB1 . 18677 1
98 . 1 1 9 9 ALA HB2 H 1 1.435 0.05 . 1 . . . C 335 ALA HB2 . 18677 1
99 . 1 1 9 9 ALA HB3 H 1 1.435 0.05 . 1 . . . C 335 ALA HB3 . 18677 1
100 . 1 1 9 9 ALA C C 13 179.696 0.4 . 1 . . . C 335 ALA C . 18677 1
101 . 1 1 9 9 ALA CA C 13 54.096 0.4 . 1 . . . C 335 ALA CA . 18677 1
102 . 1 1 9 9 ALA CB C 13 17.762 0.4 . 1 . . . C 335 ALA CB . 18677 1
103 . 1 1 9 9 ALA N N 15 121.832 0.2 . 1 . . . C 335 ALA N . 18677 1
104 . 1 1 10 10 VAL H H 1 7.504 0.05 . 1 . . . C 336 VAL H . 18677 1
105 . 1 1 10 10 VAL HA H 1 3.925 0.05 . 1 . . . C 336 VAL HA . 18677 1
106 . 1 1 10 10 VAL HB H 1 2.023 0.05 . 1 . . . C 336 VAL HB . 18677 1
107 . 1 1 10 10 VAL HG11 H 1 0.923 0.05 . . . . . C 336 VAL HG11 . 18677 1
108 . 1 1 10 10 VAL HG12 H 1 0.923 0.05 . . . . . C 336 VAL HG12 . 18677 1
109 . 1 1 10 10 VAL HG13 H 1 0.923 0.05 . . . . . C 336 VAL HG13 . 18677 1
110 . 1 1 10 10 VAL HG21 H 1 0.923 0.05 . . . . . C 336 VAL HG21 . 18677 1
111 . 1 1 10 10 VAL HG22 H 1 0.923 0.05 . . . . . C 336 VAL HG22 . 18677 1
112 . 1 1 10 10 VAL HG23 H 1 0.923 0.05 . . . . . C 336 VAL HG23 . 18677 1
113 . 1 1 10 10 VAL C C 13 176.816 0.4 . 1 . . . C 336 VAL C . 18677 1
114 . 1 1 10 10 VAL CA C 13 63.026 0.4 . 1 . . . C 336 VAL CA . 18677 1
115 . 1 1 10 10 VAL CB C 13 31.555 0.4 . 1 . . . C 336 VAL CB . 18677 1
116 . 1 1 10 10 VAL CG1 C 13 20.231 0.4 . . . . . C 336 VAL CG1 . 18677 1
117 . 1 1 10 10 VAL CG2 C 13 20.231 0.4 . . . . . C 336 VAL CG2 . 18677 1
118 . 1 1 10 10 VAL N N 15 114.076 0.2 . 1 . . . C 336 VAL N . 18677 1
119 . 1 1 11 11 ASN H H 1 7.395 0.05 . 1 . . . C 337 ASN H . 18677 1
120 . 1 1 11 11 ASN HA H 1 4.343 0.05 . 1 . . . C 337 ASN HA . 18677 1
121 . 1 1 11 11 ASN HB2 H 1 2.678 0.05 . . . . . C 337 ASN HB2 . 18677 1
122 . 1 1 11 11 ASN HB3 H 1 2.508 0.05 . . . . . C 337 ASN HB3 . 18677 1
123 . 1 1 11 11 ASN HD21 H 1 8.035 0.05 . . . . . C 337 ASN HD21 . 18677 1
124 . 1 1 11 11 ASN HD22 H 1 7.493 0.05 . . . . . C 337 ASN HD22 . 18677 1
125 . 1 1 11 11 ASN C C 13 174.524 0.4 . 1 . . . C 337 ASN C . 18677 1
126 . 1 1 11 11 ASN CA C 13 54.744 0.4 . 1 . . . C 337 ASN CA . 18677 1
127 . 1 1 11 11 ASN CB C 13 39.929 0.4 . 1 . . . C 337 ASN CB . 18677 1
128 . 1 1 11 11 ASN N N 15 118.954 0.2 . 1 . . . C 337 ASN N . 18677 1
129 . 1 1 11 11 ASN ND2 N 15 118.90 0.2 . 1 . . . C 337 ASN ND2 . 18677 1
130 . 1 1 12 12 ASN H H 1 8.108 0.05 . 1 . . . C 338 ASN H . 18677 1
131 . 1 1 12 12 ASN HA H 1 4.555 0.05 . 1 . . . C 338 ASN HA . 18677 1
132 . 1 1 12 12 ASN HB2 H 1 2.841 0.05 . . . . . C 338 ASN HB2 . 18677 1
133 . 1 1 12 12 ASN HB3 H 1 2.542 0.05 . . . . . C 338 ASN HB3 . 18677 1
134 . 1 1 12 12 ASN HD21 H 1 7.515 0.05 . . . . . C 338 ASN HD21 . 18677 1
135 . 1 1 12 12 ASN HD22 H 1 6.732 0.05 . . . . . C 338 ASN HD22 . 18677 1
136 . 1 1 12 12 ASN C C 13 174.051 0.4 . 1 . . . C 338 ASN C . 18677 1
137 . 1 1 12 12 ASN CA C 13 52.870 0.4 . 1 . . . C 338 ASN CA . 18677 1
138 . 1 1 12 12 ASN CB C 13 38.404 0.4 . 1 . . . C 338 ASN CB . 18677 1
139 . 1 1 12 12 ASN N N 15 116.973 0.2 . 1 . . . C 338 ASN N . 18677 1
140 . 1 1 12 12 ASN ND2 N 15 111.95 0.2 . 1 . . . C 338 ASN ND2 . 18677 1
141 . 1 1 13 13 ASP H H 1 7.764 0.05 . 1 . . . C 339 ASP H . 18677 1
142 . 1 1 13 13 ASP HA H 1 4.664 0.05 . 1 . . . C 339 ASP HA . 18677 1
143 . 1 1 13 13 ASP HB2 H 1 2.555 0.05 . . . . . C 339 ASP HB2 . 18677 1
144 . 1 1 13 13 ASP C C 13 176.001 0.4 . 1 . . . C 339 ASP C . 18677 1
145 . 1 1 13 13 ASP CA C 13 53.287 0.4 . 1 . . . C 339 ASP CA . 18677 1
146 . 1 1 13 13 ASP CB C 13 41.814 0.4 . 1 . . . C 339 ASP CB . 18677 1
147 . 1 1 13 13 ASP N N 15 117.408 0.2 . 1 . . . C 339 ASP N . 18677 1
148 . 1 1 14 14 ASP H H 1 8.377 0.05 . 1 . . . C 340 ASP H . 18677 1
149 . 1 1 14 14 ASP HA H 1 4.367 0.05 . 1 . . . C 340 ASP HA . 18677 1
150 . 1 1 14 14 ASP HB2 H 1 2.299 0.05 . . . . . C 340 ASP HB2 . 18677 1
151 . 1 1 14 14 ASP HB3 H 1 2.154 0.05 . . . . . C 340 ASP HB3 . 18677 1
152 . 1 1 14 14 ASP C C 13 176.153 0.4 . 1 . . . C 340 ASP C . 18677 1
153 . 1 1 14 14 ASP CA C 13 53.823 0.4 . 1 . . . C 340 ASP CA . 18677 1
154 . 1 1 14 14 ASP CB C 13 41.349 0.4 . 1 . . . C 340 ASP CB . 18677 1
155 . 1 1 14 14 ASP N N 15 119.861 0.2 . 1 . . . C 340 ASP N . 18677 1
156 . 1 1 15 15 CYS H H 1 8.148 0.05 . 1 . . . C 341 CYS H . 18677 1
157 . 1 1 15 15 CYS HA H 1 3.953 0.05 . 1 . . . C 341 CYS HA . 18677 1
158 . 1 1 15 15 CYS HB2 H 1 3.422 0.05 . . . . . C 341 CYS HB2 . 18677 1
159 . 1 1 15 15 CYS HB3 H 1 2.508 0.05 . . . . . C 341 CYS HB3 . 18677 1
160 . 1 1 15 15 CYS C C 13 177.113 0.4 . 1 . . . C 341 CYS C . 18677 1
161 . 1 1 15 15 CYS CA C 13 59.495 0.4 . 1 . . . C 341 CYS CA . 18677 1
162 . 1 1 15 15 CYS CB C 13 30.993 0.4 . 1 . . . C 341 CYS CB . 18677 1
163 . 1 1 15 15 CYS N N 15 123.739 0.2 . 1 . . . C 341 CYS N . 18677 1
164 . 1 1 16 16 ALA H H 1 8.598 0.05 . 1 . . . C 342 ALA H . 18677 1
165 . 1 1 16 16 ALA HA H 1 2.975 0.05 . 1 . . . C 342 ALA HA . 18677 1
166 . 1 1 16 16 ALA HB1 H 1 1.099 0.05 . 1 . . . C 342 ALA HB1 . 18677 1
167 . 1 1 16 16 ALA HB2 H 1 1.099 0.05 . 1 . . . C 342 ALA HB2 . 18677 1
168 . 1 1 16 16 ALA HB3 H 1 1.099 0.05 . 1 . . . C 342 ALA HB3 . 18677 1
169 . 1 1 16 16 ALA C C 13 176.069 0.4 . 1 . . . C 342 ALA C . 18677 1
170 . 1 1 16 16 ALA CA C 13 52.034 0.4 . 1 . . . C 342 ALA CA . 18677 1
171 . 1 1 16 16 ALA CB C 13 18.092 0.4 . 1 . . . C 342 ALA CB . 18677 1
172 . 1 1 16 16 ALA N N 15 130.969 0.2 . 1 . . . C 342 ALA N . 18677 1
173 . 1 1 17 17 ILE H H 1 8.252 0.05 . 1 . . . C 343 ILE H . 18677 1
174 . 1 1 17 17 ILE HA H 1 3.753 0.05 . 1 . . . C 343 ILE HA . 18677 1
175 . 1 1 17 17 ILE HB H 1 1.710 0.05 . 1 . . . C 343 ILE HB . 18677 1
176 . 1 1 17 17 ILE HG12 H 1 1.100 0.05 . . . . . C 343 ILE HG12 . 18677 1
177 . 1 1 17 17 ILE HG13 H 1 0.278 0.05 . . . . . C 343 ILE HG13 . 18677 1
178 . 1 1 17 17 ILE HG21 H 1 0.964 0.05 . 1 . . . C 343 ILE HG21 . 18677 1
179 . 1 1 17 17 ILE HG22 H 1 0.964 0.05 . 1 . . . C 343 ILE HG22 . 18677 1
180 . 1 1 17 17 ILE HG23 H 1 0.964 0.05 . 1 . . . C 343 ILE HG23 . 18677 1
181 . 1 1 17 17 ILE HD11 H 1 0.298 0.05 . 1 . . . C 343 ILE HD11 . 18677 1
182 . 1 1 17 17 ILE HD12 H 1 0.298 0.05 . 1 . . . C 343 ILE HD12 . 18677 1
183 . 1 1 17 17 ILE HD13 H 1 0.298 0.05 . 1 . . . C 343 ILE HD13 . 18677 1
184 . 1 1 17 17 ILE C C 13 175.902 0.4 . 1 . . . C 343 ILE C . 18677 1
185 . 1 1 17 17 ILE CA C 13 63.538 0.4 . 1 . . . C 343 ILE CA . 18677 1
186 . 1 1 17 17 ILE CB C 13 38.361 0.4 . 1 . . . C 343 ILE CB . 18677 1
187 . 1 1 17 17 ILE CG1 C 13 27.480 0.4 . 1 . . . C 343 ILE CG1 . 18677 1
188 . 1 1 17 17 ILE CG2 C 13 16.665 0.4 . 1 . . . C 343 ILE CG2 . 18677 1
189 . 1 1 17 17 ILE CD1 C 13 12.900 0.4 . 1 . . . C 343 ILE CD1 . 18677 1
190 . 1 1 17 17 ILE N N 15 117.963 0.2 . 1 . . . C 343 ILE N . 18677 1
191 . 1 1 18 18 CYS H H 1 7.359 0.05 . 1 . . . C 344 CYS H . 18677 1
192 . 1 1 18 18 CYS HA H 1 4.720 0.05 . 1 . . . C 344 CYS HA . 18677 1
193 . 1 1 18 18 CYS HB2 H 1 3.194 0.05 . . . . . C 344 CYS HB2 . 18677 1
194 . 1 1 18 18 CYS HB3 H 1 2.991 0.05 . . . . . C 344 CYS HB3 . 18677 1
195 . 1 1 18 18 CYS C C 13 175.507 0.4 . 1 . . . C 344 CYS C . 18677 1
196 . 1 1 18 18 CYS CA C 13 57.709 0.4 . 1 . . . C 344 CYS CA . 18677 1
197 . 1 1 18 18 CYS CB C 13 31.889 0.4 . 1 . . . C 344 CYS CB . 18677 1
198 . 1 1 18 18 CYS N N 15 115.918 0.2 . 1 . . . C 344 CYS N . 18677 1
199 . 1 1 19 19 TRP H H 1 8.325 0.05 . 1 . . . C 345 TRP H . 18677 1
200 . 1 1 19 19 TRP HA H 1 4.416 0.05 . 1 . . . C 345 TRP HA . 18677 1
201 . 1 1 19 19 TRP HB2 H 1 3.463 0.05 . . . . . C 345 TRP HB2 . 18677 1
202 . 1 1 19 19 TRP HD1 H 1 6.975 0.05 . 1 . . . C 345 TRP HD1 . 18677 1
203 . 1 1 19 19 TRP HE1 H 1 9.613 0.05 . 1 . . . C 345 TRP HE1 . 18677 1
204 . 1 1 19 19 TRP HE3 H 1 7.663 0.05 . 1 . . . C 345 TRP HE3 . 18677 1
205 . 1 1 19 19 TRP HZ2 H 1 7.476 0.05 . 1 . . . C 345 TRP HZ2 . 18677 1
206 . 1 1 19 19 TRP HZ3 H 1 6.833 0.05 . 1 . . . C 345 TRP HZ3 . 18677 1
207 . 1 1 19 19 TRP HH2 H 1 7.358 0.05 . 1 . . . C 345 TRP HH2 . 18677 1
208 . 1 1 19 19 TRP C C 13 173.833 0.4 . 1 . . . C 345 TRP C . 18677 1
209 . 1 1 19 19 TRP CA C 13 57.809 0.4 . 1 . . . C 345 TRP CA . 18677 1
210 . 1 1 19 19 TRP CB C 13 25.109 0.4 . 1 . . . C 345 TRP CB . 18677 1
211 . 1 1 19 19 TRP CD1 C 13 125.812 0.4 . 1 . . . C 345 TRP CD1 . 18677 1
212 . 1 1 19 19 TRP CE3 C 13 118.064 0.4 . 1 . . . C 345 TRP CE3 . 18677 1
213 . 1 1 19 19 TRP CZ2 C 13 114.351 0.4 . 1 . . . C 345 TRP CZ2 . 18677 1
214 . 1 1 19 19 TRP CZ3 C 13 117.967 0.4 . 1 . . . C 345 TRP CZ3 . 18677 1
215 . 1 1 19 19 TRP N N 15 120.670 0.2 . 1 . . . C 345 TRP N . 18677 1
216 . 1 1 19 19 TRP NE1 N 15 127.378 0.2 . 1 . . . C 345 TRP NE1 . 18677 1
217 . 1 1 20 20 ASP H H 1 8.623 0.05 . 1 . . . C 346 ASP H . 18677 1
218 . 1 1 20 20 ASP HA H 1 5.281 0.05 . 1 . . . C 346 ASP HA . 18677 1
219 . 1 1 20 20 ASP HB2 H 1 2.937 0.05 . . . . . C 346 ASP HB2 . 18677 1
220 . 1 1 20 20 ASP HB3 H 1 2.893 0.05 . . . . . C 346 ASP HB3 . 18677 1
221 . 1 1 20 20 ASP C C 13 176.422 0.4 . 1 . . . C 346 ASP C . 18677 1
222 . 1 1 20 20 ASP CA C 13 51.934 0.4 . 1 . . . C 346 ASP CA . 18677 1
223 . 1 1 20 20 ASP CB C 13 43.811 0.4 . 1 . . . C 346 ASP CB . 18677 1
224 . 1 1 20 20 ASP N N 15 120.742 0.2 . 1 . . . C 346 ASP N . 18677 1
225 . 1 1 21 21 SER H H 1 8.589 0.05 . 1 . . . C 347 SER H . 18677 1
226 . 1 1 21 21 SER HA H 1 4.376 0.05 . 1 . . . C 347 SER HA . 18677 1
227 . 1 1 21 21 SER HB2 H 1 3.925 0.05 . . . . . C 347 SER HB2 . 18677 1
228 . 1 1 21 21 SER HB3 H 1 3.840 0.05 . . . . . C 347 SER HB3 . 18677 1
229 . 1 1 21 21 SER C C 13 174.621 0.4 . 1 . . . C 347 SER C . 18677 1
230 . 1 1 21 21 SER CA C 13 58.267 0.4 . 1 . . . C 347 SER CA . 18677 1
231 . 1 1 21 21 SER CB C 13 63.339 0.4 . 1 . . . C 347 SER CB . 18677 1
232 . 1 1 21 21 SER N N 15 116.315 0.2 . 1 . . . C 347 SER N . 18677 1
233 . 1 1 22 22 MET H H 1 9.040 0.05 . 1 . . . C 348 MET H . 18677 1
234 . 1 1 22 22 MET HA H 1 4.587 0.05 . 1 . . . C 348 MET HA . 18677 1
235 . 1 1 22 22 MET HB2 H 1 1.704 0.05 . . . . . C 348 MET HB2 . 18677 1
236 . 1 1 22 22 MET HB3 H 1 1.445 0.05 . . . . . C 348 MET HB3 . 18677 1
237 . 1 1 22 22 MET HG2 H 1 0.826 0.05 . . . . . C 348 MET HG2 . 18677 1
238 . 1 1 22 22 MET HE1 H 1 2.052 0.05 . 1 . . . C 348 MET HE1 . 18677 1
239 . 1 1 22 22 MET HE2 H 1 2.052 0.05 . 1 . . . C 348 MET HE2 . 18677 1
240 . 1 1 22 22 MET HE3 H 1 2.052 0.05 . 1 . . . C 348 MET HE3 . 18677 1
241 . 1 1 22 22 MET C C 13 174.817 0.4 . 1 . . . C 348 MET C . 18677 1
242 . 1 1 22 22 MET CA C 13 54.755 0.4 . 1 . . . C 348 MET CA . 18677 1
243 . 1 1 22 22 MET CB C 13 34.15 0.4 . 1 . . . C 348 MET CB . 18677 1
244 . 1 1 22 22 MET CG C 13 30.31 0.4 . 1 . . . C 348 MET CG . 18677 1
245 . 1 1 22 22 MET CE C 13 17.002 0.4 . 1 . . . C 348 MET CE . 18677 1
246 . 1 1 22 22 MET N N 15 120.5 0.2 . 1 . . . C 348 MET N . 18677 1
247 . 1 1 23 23 GLN H H 1 9.442 0.05 . 1 . . . C 349 GLN H . 18677 1
248 . 1 1 23 23 GLN HA H 1 4.316 0.05 . 1 . . . C 349 GLN HA . 18677 1
249 . 1 1 23 23 GLN HB2 H 1 2.313 0.05 . . . . . C 349 GLN HB2 . 18677 1
250 . 1 1 23 23 GLN HB3 H 1 2.377 0.05 . . . . . C 349 GLN HB3 . 18677 1
251 . 1 1 23 23 GLN HG2 H 1 2.185 0.05 . . . . . C 349 GLN HG2 . 18677 1
252 . 1 1 23 23 GLN HG3 H 1 1.981 0.05 . . . . . C 349 GLN HG3 . 18677 1
253 . 1 1 23 23 GLN C C 13 174.715 0.4 . 1 . . . C 349 GLN C . 18677 1
254 . 1 1 23 23 GLN CA C 13 55.716 0.4 . 1 . . . C 349 GLN CA . 18677 1
255 . 1 1 23 23 GLN CB C 13 34.238 0.4 . 1 . . . C 349 GLN CB . 18677 1
256 . 1 1 23 23 GLN CG C 13 28.845 0.4 . 1 . . . C 349 GLN CG . 18677 1
257 . 1 1 23 23 GLN N N 15 123.32 0.2 . 1 . . . C 349 GLN N . 18677 1
258 . 1 1 24 24 ALA H H 1 7.727 0.05 . 1 . . . C 350 ALA H . 18677 1
259 . 1 1 24 24 ALA HA H 1 4.440 0.05 . 1 . . . C 350 ALA HA . 18677 1
260 . 1 1 24 24 ALA HB1 H 1 1.371 0.05 . 1 . . . C 350 ALA HB1 . 18677 1
261 . 1 1 24 24 ALA HB2 H 1 1.371 0.05 . 1 . . . C 350 ALA HB2 . 18677 1
262 . 1 1 24 24 ALA HB3 H 1 1.371 0.05 . 1 . . . C 350 ALA HB3 . 18677 1
263 . 1 1 24 24 ALA C C 13 175.941 0.4 . 1 . . . C 350 ALA C . 18677 1
264 . 1 1 24 24 ALA CA C 13 51.107 0.4 . 1 . . . C 350 ALA CA . 18677 1
265 . 1 1 24 24 ALA CB C 13 21.073 0.4 . 1 . . . C 350 ALA CB . 18677 1
266 . 1 1 24 24 ALA N N 15 121.381 0.2 . 1 . . . C 350 ALA N . 18677 1
267 . 1 1 25 25 ALA H H 1 9.036 0.05 . 1 . . . C 351 ALA H . 18677 1
268 . 1 1 25 25 ALA HA H 1 4.767 0.05 . 1 . . . C 351 ALA HA . 18677 1
269 . 1 1 25 25 ALA HB1 H 1 1.143 0.05 . 1 . . . C 351 ALA HB1 . 18677 1
270 . 1 1 25 25 ALA HB2 H 1 1.143 0.05 . 1 . . . C 351 ALA HB2 . 18677 1
271 . 1 1 25 25 ALA HB3 H 1 1.143 0.05 . 1 . . . C 351 ALA HB3 . 18677 1
272 . 1 1 25 25 ALA C C 13 176.921 0.4 . 1 . . . C 351 ALA C . 18677 1
273 . 1 1 25 25 ALA CA C 13 51.450 0.4 . 1 . . . C 351 ALA CA . 18677 1
274 . 1 1 25 25 ALA CB C 13 24.919 0.4 . 1 . . . C 351 ALA CB . 18677 1
275 . 1 1 25 25 ALA N N 15 121.845 0.2 . 1 . . . C 351 ALA N . 18677 1
276 . 1 1 26 26 ARG H H 1 8.956 0.05 . 1 . . . C 352 ARG H . 18677 1
277 . 1 1 26 26 ARG HA H 1 5.019 0.05 . 1 . . . C 352 ARG HA . 18677 1
278 . 1 1 26 26 ARG HB2 H 1 1.657 0.05 . . . . . C 352 ARG HB2 . 18677 1
279 . 1 1 26 26 ARG HB3 H 1 1.506 0.05 . . . . . C 352 ARG HB3 . 18677 1
280 . 1 1 26 26 ARG HG2 H 1 1.750 0.05 . . . . . C 352 ARG HG2 . 18677 1
281 . 1 1 26 26 ARG HD2 H 1 3.140 0.05 . . . . . C 352 ARG HD2 . 18677 1
282 . 1 1 26 26 ARG C C 13 173.757 0.4 . 1 . . . C 352 ARG C . 18677 1
283 . 1 1 26 26 ARG CA C 13 52.842 0.4 . 1 . . . C 352 ARG CA . 18677 1
284 . 1 1 26 26 ARG CB C 13 32.294 0.4 . 1 . . . C 352 ARG CB . 18677 1
285 . 1 1 26 26 ARG CG C 13 26.116 0.4 . 1 . . . C 352 ARG CG . 18677 1
286 . 1 1 26 26 ARG CD C 13 42.268 0.4 . 1 . . . C 352 ARG CD . 18677 1
287 . 1 1 26 26 ARG N N 15 118.863 0.2 . 1 . . . C 352 ARG N . 18677 1
288 . 1 1 27 27 LYS H H 1 8.811 0.05 . 1 . . . C 353 LYS H . 18677 1
289 . 1 1 27 27 LYS HA H 1 4.739 0.05 . 1 . . . C 353 LYS HA . 18677 1
290 . 1 1 27 27 LYS HB2 H 1 1.608 0.05 . . . . . C 353 LYS HB2 . 18677 1
291 . 1 1 27 27 LYS HB3 H 1 1.031 0.05 . . . . . C 353 LYS HB3 . 18677 1
292 . 1 1 27 27 LYS HG2 H 1 1.330 0.05 . . . . . C 353 LYS HG2 . 18677 1
293 . 1 1 27 27 LYS HG3 H 1 1.068 0.05 . . . . . C 353 LYS HG3 . 18677 1
294 . 1 1 27 27 LYS HD2 H 1 1.555 0.05 . . . . . C 353 LYS HD2 . 18677 1
295 . 1 1 27 27 LYS HD3 H 1 1.444 0.05 . . . . . C 353 LYS HD3 . 18677 1
296 . 1 1 27 27 LYS C C 13 175.871 0.4 . 1 . . . C 353 LYS C . 18677 1
297 . 1 1 27 27 LYS CA C 13 54.051 0.4 . 1 . . . C 353 LYS CA . 18677 1
298 . 1 1 27 27 LYS CB C 13 35.190 0.4 . 1 . . . C 353 LYS CB . 18677 1
299 . 1 1 27 27 LYS CG C 13 23.782 0.4 . 1 . . . C 353 LYS CG . 18677 1
300 . 1 1 27 27 LYS CD C 13 28.847 0.4 . 1 . . . C 353 LYS CD . 18677 1
301 . 1 1 27 27 LYS CE C 13 41.190 0.4 . 1 . . . C 353 LYS CE . 18677 1
302 . 1 1 27 27 LYS N N 15 122.217 0.2 . 1 . . . C 353 LYS N . 18677 1
303 . 1 1 28 28 LEU H H 1 8.601 0.05 . 1 . . . C 354 LEU H . 18677 1
304 . 1 1 28 28 LEU HA H 1 4.440 0.05 . 1 . . . C 354 LEU HA . 18677 1
305 . 1 1 28 28 LEU HB2 H 1 2.377 0.05 . . . . . C 354 LEU HB2 . 18677 1
306 . 1 1 28 28 LEU HB3 H 1 1.557 0.05 . . . . . C 354 LEU HB3 . 18677 1
307 . 1 1 28 28 LEU HG H 1 1.700 0.05 . 1 . . . C 354 LEU HG . 18677 1
308 . 1 1 28 28 LEU HD11 H 1 0.156 0.05 . . . . . C 354 LEU HD11 . 18677 1
309 . 1 1 28 28 LEU HD12 H 1 0.156 0.05 . . . . . C 354 LEU HD12 . 18677 1
310 . 1 1 28 28 LEU HD13 H 1 0.156 0.05 . . . . . C 354 LEU HD13 . 18677 1
311 . 1 1 28 28 LEU CA C 13 53.405 0.4 . 1 . . . C 354 LEU CA . 18677 1
312 . 1 1 28 28 LEU CB C 13 41.461 0.4 . 1 . . . C 354 LEU CB . 18677 1
313 . 1 1 28 28 LEU CG C 13 27.000 0.4 . 1 . . . C 354 LEU CG . 18677 1
314 . 1 1 28 28 LEU CD1 C 13 22.050 0.4 . . . . . C 354 LEU CD1 . 18677 1
315 . 1 1 28 28 LEU N N 15 125.979 0.2 . 1 . . . C 354 LEU N . 18677 1
316 . 1 1 29 29 PRO HA H 1 4.331 0.05 . 1 . . . C 355 PRO HA . 18677 1
317 . 1 1 29 29 PRO HB2 H 1 2.507 0.05 . . . . . C 355 PRO HB2 . 18677 1
318 . 1 1 29 29 PRO HB3 H 1 1.893 0.05 . . . . . C 355 PRO HB3 . 18677 1
319 . 1 1 29 29 PRO HG2 H 1 2.250 0.05 . . . . . C 355 PRO HG2 . 18677 1
320 . 1 1 29 29 PRO HD2 H 1 3.852 0.05 . . . . . C 355 PRO HD2 . 18677 1
321 . 1 1 29 29 PRO HD3 H 1 3.578 0.05 . . . . . C 355 PRO HD3 . 18677 1
322 . 1 1 29 29 PRO C C 13 177.342 0.4 . 1 . . . C 355 PRO C . 18677 1
323 . 1 1 29 29 PRO CA C 13 65.233 0.4 . 1 . . . C 355 PRO CA . 18677 1
324 . 1 1 29 29 PRO CB C 13 30.985 0.4 . 1 . . . C 355 PRO CB . 18677 1
325 . 1 1 29 29 PRO CG C 13 27.800 0.4 . 1 . . . C 355 PRO CG . 18677 1
326 . 1 1 29 29 PRO CD C 13 49.600 0.4 . 1 . . . C 355 PRO CD . 18677 1
327 . 1 1 30 30 CYS H H 1 7.551 0.05 . 1 . . . C 356 CYS H . 18677 1
328 . 1 1 30 30 CYS HA H 1 4.300 0.05 . 1 . . . C 356 CYS HA . 18677 1
329 . 1 1 30 30 CYS HB2 H 1 3.007 0.05 . . . . . C 356 CYS HB2 . 18677 1
330 . 1 1 30 30 CYS HB3 H 1 2.883 0.05 . . . . . C 356 CYS HB3 . 18677 1
331 . 1 1 30 30 CYS C C 13 176.147 0.4 . 1 . . . C 356 CYS C . 18677 1
332 . 1 1 30 30 CYS CA C 13 56.608 0.4 . 1 . . . C 356 CYS CA . 18677 1
333 . 1 1 30 30 CYS CB C 13 31.316 0.4 . 1 . . . C 356 CYS CB . 18677 1
334 . 1 1 30 30 CYS N N 15 113.186 0.2 . 1 . . . C 356 CYS N . 18677 1
335 . 1 1 31 31 GLY H H 1 8.292 0.05 . 1 . . . C 357 GLY H . 18677 1
336 . 1 1 31 31 GLY HA2 H 1 4.088 0.05 . . . . . C 357 GLY HA2 . 18677 1
337 . 1 1 31 31 GLY HA3 H 1 3.210 0.05 . . . . . C 357 GLY HA3 . 18677 1
338 . 1 1 31 31 GLY C C 13 173.545 0.4 . 1 . . . C 357 GLY C . 18677 1
339 . 1 1 31 31 GLY CA C 13 44.284 0.4 . 1 . . . C 357 GLY CA . 18677 1
340 . 1 1 31 31 GLY N N 15 111.358 0.2 . 1 . . . C 357 GLY N . 18677 1
341 . 1 1 32 32 HIS H H 1 7.824 0.05 . 1 . . . C 358 HIS H . 18677 1
342 . 1 1 32 32 HIS HA H 1 4.500 0.05 . 1 . . . C 358 HIS HA . 18677 1
343 . 1 1 32 32 HIS HB2 H 1 3.247 0.05 . . . . . C 358 HIS HB2 . 18677 1
344 . 1 1 32 32 HIS HB3 H 1 2.942 0.05 . . . . . C 358 HIS HB3 . 18677 1
345 . 1 1 32 32 HIS HD2 H 1 6.990 0.05 . 1 . . . C 358 HIS HD2 . 18677 1
346 . 1 1 32 32 HIS HE1 H 1 7.249 0.05 . 1 . . . C 358 HIS HE1 . 18677 1
347 . 1 1 32 32 HIS C C 13 172.823 0.4 . 1 . . . C 358 HIS C . 18677 1
348 . 1 1 32 32 HIS CA C 13 59.904 0.4 . 1 . . . C 358 HIS CA . 18677 1
349 . 1 1 32 32 HIS CB C 13 30.690 0.4 . 1 . . . C 358 HIS CB . 18677 1
350 . 1 1 32 32 HIS CD2 C 13 118.00 0.4 . 1 . . . C 358 HIS CD2 . 18677 1
351 . 1 1 32 32 HIS CE1 C 13 134.05 0.4 . 1 . . . C 358 HIS CE1 . 18677 1
352 . 1 1 32 32 HIS N N 15 122.287 0.2 . 1 . . . C 358 HIS N . 18677 1
353 . 1 1 32 32 HIS ND1 N 15 192.34 0.2 . 1 . . . C 358 HIS ND1 . 18677 1
354 . 1 1 32 32 HIS NE2 N 15 181.78 0.2 . 1 . . . C 358 HIS NE2 . 18677 1
355 . 1 1 33 33 LEU H H 1 8.060 0.05 . 1 . . . C 359 LEU H . 18677 1
356 . 1 1 33 33 LEU HA H 1 5.053 0.05 . 1 . . . C 359 LEU HA . 18677 1
357 . 1 1 33 33 LEU HB2 H 1 1.200 0.05 . . . . . C 359 LEU HB2 . 18677 1
358 . 1 1 33 33 LEU HB3 H 1 0.774 0.05 . . . . . C 359 LEU HB3 . 18677 1
359 . 1 1 33 33 LEU HG H 1 1.478 0.05 . 1 . . . C 359 LEU HG . 18677 1
360 . 1 1 33 33 LEU HD11 H 1 0.826 0.05 . . . . . C 359 LEU HD11 . 18677 1
361 . 1 1 33 33 LEU HD12 H 1 0.826 0.05 . . . . . C 359 LEU HD12 . 18677 1
362 . 1 1 33 33 LEU HD13 H 1 0.826 0.05 . . . . . C 359 LEU HD13 . 18677 1
363 . 1 1 33 33 LEU HD21 H 1 0.493 0.05 . . . . . C 359 LEU HD21 . 18677 1
364 . 1 1 33 33 LEU HD22 H 1 0.493 0.05 . . . . . C 359 LEU HD22 . 18677 1
365 . 1 1 33 33 LEU HD23 H 1 0.493 0.05 . . . . . C 359 LEU HD23 . 18677 1
366 . 1 1 33 33 LEU C C 13 174.149 0.4 . 1 . . . C 359 LEU C . 18677 1
367 . 1 1 33 33 LEU CA C 13 52.859 0.4 . 1 . . . C 359 LEU CA . 18677 1
368 . 1 1 33 33 LEU CB C 13 44.539 0.4 . 1 . . . C 359 LEU CB . 18677 1
369 . 1 1 33 33 LEU CG C 13 26.600 0.4 . 1 . . . C 359 LEU CG . 18677 1
370 . 1 1 33 33 LEU CD1 C 13 24.714 0.4 . . . . . C 359 LEU CD1 . 18677 1
371 . 1 1 33 33 LEU N N 15 121.280 0.2 . 1 . . . C 359 LEU N . 18677 1
372 . 1 1 34 34 PHE H H 1 8.038 0.05 . 1 . . . C 360 PHE H . 18677 1
373 . 1 1 34 34 PHE HA H 1 5.082 0.05 . 1 . . . C 360 PHE HA . 18677 1
374 . 1 1 34 34 PHE HB2 H 1 3.171 0.05 . . . . . C 360 PHE HB2 . 18677 1
375 . 1 1 34 34 PHE HB3 H 1 2.139 0.05 . . . . . C 360 PHE HB3 . 18677 1
376 . 1 1 34 34 PHE HD2 H 1 7.045 0.05 . . . . . C 360 PHE HD2 . 18677 1
377 . 1 1 34 34 PHE HE2 H 1 7.045 0.05 . . . . . C 360 PHE HE2 . 18677 1
378 . 1 1 34 34 PHE C C 13 175.995 0.4 . 1 . . . C 360 PHE C . 18677 1
379 . 1 1 34 34 PHE CA C 13 56.591 0.4 . 1 . . . C 360 PHE CA . 18677 1
380 . 1 1 34 34 PHE CB C 13 45.337 0.4 . 1 . . . C 360 PHE CB . 18677 1
381 . 1 1 34 34 PHE CD2 C 13 130.934 0.4 . . . . . C 360 PHE CD2 . 18677 1
382 . 1 1 34 34 PHE CE2 C 13 132.70 0.4 . . . . . C 360 PHE CE2 . 18677 1
383 . 1 1 34 34 PHE N N 15 113.606 0.2 . 1 . . . C 360 PHE N . 18677 1
384 . 1 1 35 35 HIS H H 1 7.950 0.05 . 1 . . . C 361 HIS H . 18677 1
385 . 1 1 35 35 HIS HA H 1 4.599 0.05 . 1 . . . C 361 HIS HA . 18677 1
386 . 1 1 35 35 HIS HB2 H 1 3.688 0.05 . . . . . C 361 HIS HB2 . 18677 1
387 . 1 1 35 35 HIS HB3 H 1 3.801 0.05 . . . . . C 361 HIS HB3 . 18677 1
388 . 1 1 35 35 HIS HD2 H 1 7.642 0.05 . 1 . . . C 361 HIS HD2 . 18677 1
389 . 1 1 35 35 HIS HE1 H 1 7.041 0.05 . 1 . . . C 361 HIS HE1 . 18677 1
390 . 1 1 35 35 HIS C C 13 176.424 0.4 . 1 . . . C 361 HIS C . 18677 1
391 . 1 1 35 35 HIS CA C 13 59.463 0.4 . 1 . . . C 361 HIS CA . 18677 1
392 . 1 1 35 35 HIS CB C 13 31.693 0.4 . 1 . . . C 361 HIS CB . 18677 1
393 . 1 1 35 35 HIS CD2 C 13 117.655 0.4 . 1 . . . C 361 HIS CD2 . 18677 1
394 . 1 1 35 35 HIS CE1 C 13 132.678 0.4 . 1 . . . C 361 HIS CE1 . 18677 1
395 . 1 1 35 35 HIS N N 15 117.644 0.2 . 1 . . . C 361 HIS N . 18677 1
396 . 1 1 35 35 HIS ND1 N 15 190.265 0.2 . 1 . . . C 361 HIS ND1 . 18677 1
397 . 1 1 35 35 HIS NE2 N 15 184.320 0.2 . 1 . . . C 361 HIS NE2 . 18677 1
398 . 1 1 36 36 ASN H H 1 9.457 0.05 . 1 . . . C 362 ASN H . 18677 1
399 . 1 1 36 36 ASN HA H 1 4.137 0.05 . 1 . . . C 362 ASN HA . 18677 1
400 . 1 1 36 36 ASN HB2 H 1 2.839 0.05 . . . . . C 362 ASN HB2 . 18677 1
401 . 1 1 36 36 ASN HD21 H 1 7.650 0.05 . . . . . C 362 ASN HD21 . 18677 1
402 . 1 1 36 36 ASN HD22 H 1 7.206 0.05 . . . . . C 362 ASN HD22 . 18677 1
403 . 1 1 36 36 ASN C C 13 177.025 0.4 . 1 . . . C 362 ASN C . 18677 1
404 . 1 1 36 36 ASN CA C 13 58.193 0.4 . 1 . . . C 362 ASN CA . 18677 1
405 . 1 1 36 36 ASN CB C 13 39.535 0.4 . 1 . . . C 362 ASN CB . 18677 1
406 . 1 1 36 36 ASN N N 15 120.823 0.2 . 1 . . . C 362 ASN N . 18677 1
407 . 1 1 36 36 ASN ND2 N 15 113.950 0.2 . 1 . . . C 362 ASN ND2 . 18677 1
408 . 1 1 37 37 SER H H 1 9.004 0.05 . 1 . . . C 363 SER H . 18677 1
409 . 1 1 37 37 SER HA H 1 4.743 0.05 . 1 . . . C 363 SER HA . 18677 1
410 . 1 1 37 37 SER HB2 H 1 4.040 0.05 . . . . . C 363 SER HB2 . 18677 1
411 . 1 1 37 37 SER C C 13 177.742 0.4 . 1 . . . C 363 SER C . 18677 1
412 . 1 1 37 37 SER CA C 13 60.941 0.4 . 1 . . . C 363 SER CA . 18677 1
413 . 1 1 37 37 SER CB C 13 61.063 0.4 . 1 . . . C 363 SER CB . 18677 1
414 . 1 1 37 37 SER N N 15 113.173 0.2 . 1 . . . C 363 SER N . 18677 1
415 . 1 1 38 38 CYS H H 1 6.758 0.05 . 1 . . . C 364 CYS H . 18677 1
416 . 1 1 38 38 CYS HA H 1 3.978 0.05 . 1 . . . C 364 CYS HA . 18677 1
417 . 1 1 38 38 CYS HB2 H 1 2.965 0.05 . . . . . C 364 CYS HB2 . 18677 1
418 . 1 1 38 38 CYS HB3 H 1 2.885 0.05 . . . . . C 364 CYS HB3 . 18677 1
419 . 1 1 38 38 CYS C C 13 177.167 0.4 . 1 . . . C 364 CYS C . 18677 1
420 . 1 1 38 38 CYS CA C 13 62.567 0.4 . 1 . . . C 364 CYS CA . 18677 1
421 . 1 1 38 38 CYS CB C 13 28.422 0.4 . 1 . . . C 364 CYS CB . 18677 1
422 . 1 1 38 38 CYS N N 15 122.233 0.2 . 1 . . . C 364 CYS N . 18677 1
423 . 1 1 39 39 LEU H H 1 8.456 0.05 . 1 . . . C 365 LEU H . 18677 1
424 . 1 1 39 39 LEU HA H 1 3.838 0.05 . 1 . . . C 365 LEU HA . 18677 1
425 . 1 1 39 39 LEU HB2 H 1 1.850 0.05 . . . . . C 365 LEU HB2 . 18677 1
426 . 1 1 39 39 LEU HB3 H 1 1.387 0.05 . . . . . C 365 LEU HB3 . 18677 1
427 . 1 1 39 39 LEU HG H 1 0.719 0.05 . 1 . . . C 365 LEU HG . 18677 1
428 . 1 1 39 39 LEU HD11 H 1 0.536 0.05 . . . . . C 365 LEU HD11 . 18677 1
429 . 1 1 39 39 LEU HD12 H 1 0.536 0.05 . . . . . C 365 LEU HD12 . 18677 1
430 . 1 1 39 39 LEU HD13 H 1 0.536 0.05 . . . . . C 365 LEU HD13 . 18677 1
431 . 1 1 39 39 LEU C C 13 177.580 0.4 . 1 . . . C 365 LEU C . 18677 1
432 . 1 1 39 39 LEU CA C 13 56.862 0.4 . 1 . . . C 365 LEU CA . 18677 1
433 . 1 1 39 39 LEU CB C 13 41.553 0.4 . 1 . . . C 365 LEU CB . 18677 1
434 . 1 1 39 39 LEU CG C 13 25.779 0.4 . 1 . . . C 365 LEU CG . 18677 1
435 . 1 1 39 39 LEU CD1 C 13 22.622 0.4 . . . . . C 365 LEU CD1 . 18677 1
436 . 1 1 39 39 LEU N N 15 120.172 0.2 . 1 . . . C 365 LEU N . 18677 1
437 . 1 1 40 40 ARG H H 1 8.245 0.05 . 1 . . . C 366 ARG H . 18677 1
438 . 1 1 40 40 ARG HA H 1 3.852 0.05 . 1 . . . C 366 ARG HA . 18677 1
439 . 1 1 40 40 ARG HB2 H 1 1.907 0.05 . . . . . C 366 ARG HB2 . 18677 1
440 . 1 1 40 40 ARG HG2 H 1 1.757 0.05 . . . . . C 366 ARG HG2 . 18677 1
441 . 1 1 40 40 ARG HG3 H 1 1.592 0.05 . . . . . C 366 ARG HG3 . 18677 1
442 . 1 1 40 40 ARG HD2 H 1 3.181 0.05 . . . . . C 366 ARG HD2 . 18677 1
443 . 1 1 40 40 ARG HH11 H 1 6.910 0.05 . . . . . C 366 ARG HH11 . 18677 1
444 . 1 1 40 40 ARG HH21 H 1 6.990 0.05 . . . . . C 366 ARG HH21 . 18677 1
445 . 1 1 40 40 ARG C C 13 177.539 0.4 . 1 . . . C 366 ARG C . 18677 1
446 . 1 1 40 40 ARG CA C 13 59.987 0.4 . 1 . . . C 366 ARG CA . 18677 1
447 . 1 1 40 40 ARG CB C 13 29.540 0.4 . 1 . . . C 366 ARG CB . 18677 1
448 . 1 1 40 40 ARG CG C 13 26.533 0.4 . 1 . . . C 366 ARG CG . 18677 1
449 . 1 1 40 40 ARG CD C 13 43.425 0.4 . 1 . . . C 366 ARG CD . 18677 1
450 . 1 1 40 40 ARG N N 15 118.554 0.2 . 1 . . . C 366 ARG N . 18677 1
451 . 1 1 40 40 ARG NH1 N 15 72.304 0.2 . . . . . C 366 ARG NH1 . 18677 1
452 . 1 1 40 40 ARG NH2 N 15 72.304 0.2 . . . . . C 366 ARG NH2 . 18677 1
453 . 1 1 41 41 SER H H 1 7.585 0.05 . 1 . . . C 367 SER H . 18677 1
454 . 1 1 41 41 SER HA H 1 4.202 0.05 . 1 . . . C 367 SER HA . 18677 1
455 . 1 1 41 41 SER HB2 H 1 3.974 0.05 . . . . . C 367 SER HB2 . 18677 1
456 . 1 1 41 41 SER C C 13 177.226 0.4 . 1 . . . C 367 SER C . 18677 1
457 . 1 1 41 41 SER CA C 13 60.926 0.4 . 1 . . . C 367 SER CA . 18677 1
458 . 1 1 41 41 SER CB C 13 62.189 0.4 . 1 . . . C 367 SER CB . 18677 1
459 . 1 1 41 41 SER N N 15 111.737 0.2 . 1 . . . C 367 SER N . 18677 1
460 . 1 1 42 42 TRP H H 1 8.496 0.05 . 1 . . . C 368 TRP H . 18677 1
461 . 1 1 42 42 TRP HA H 1 4.122 0.05 . 1 . . . C 368 TRP HA . 18677 1
462 . 1 1 42 42 TRP HB2 H 1 3.267 0.05 . . . . . C 368 TRP HB2 . 18677 1
463 . 1 1 42 42 TRP HD1 H 1 6.706 0.05 . 1 . . . C 368 TRP HD1 . 18677 1
464 . 1 1 42 42 TRP HE1 H 1 10.087 0.05 . 1 . . . C 368 TRP HE1 . 18677 1
465 . 1 1 42 42 TRP HE3 H 1 7.890 0.05 . 1 . . . C 368 TRP HE3 . 18677 1
466 . 1 1 42 42 TRP HZ2 H 1 7.173 0.05 . 1 . . . C 368 TRP HZ2 . 18677 1
467 . 1 1 42 42 TRP C C 13 178.470 0.4 . 1 . . . C 368 TRP C . 18677 1
468 . 1 1 42 42 TRP CA C 13 60.187 0.4 . 1 . . . C 368 TRP CA . 18677 1
469 . 1 1 42 42 TRP CB C 13 29.320 0.4 . 1 . . . C 368 TRP CB . 18677 1
470 . 1 1 42 42 TRP CD1 C 13 125.352 0.4 . 1 . . . C 368 TRP CD1 . 18677 1
471 . 1 1 42 42 TRP CZ2 C 13 113.701 0.4 . 1 . . . C 368 TRP CZ2 . 18677 1
472 . 1 1 42 42 TRP N N 15 124.863 0.2 . 1 . . . C 368 TRP N . 18677 1
473 . 1 1 42 42 TRP NE1 N 15 131.459 0.2 . 1 . . . C 368 TRP NE1 . 18677 1
474 . 1 1 43 43 LEU H H 1 8.429 0.05 . 1 . . . C 369 LEU H . 18677 1
475 . 1 1 43 43 LEU HA H 1 4.716 0.05 . 1 . . . C 369 LEU HA . 18677 1
476 . 1 1 43 43 LEU HB2 H 1 1.900 0.05 . . . . . C 369 LEU HB2 . 18677 1
477 . 1 1 43 43 LEU HB3 H 1 1.536 0.05 . . . . . C 369 LEU HB3 . 18677 1
478 . 1 1 43 43 LEU HG H 1 2.024 0.05 . 1 . . . C 369 LEU HG . 18677 1
479 . 1 1 43 43 LEU HD11 H 1 0.996 0.05 . . . . . C 369 LEU HD11 . 18677 1
480 . 1 1 43 43 LEU HD12 H 1 0.996 0.05 . . . . . C 369 LEU HD12 . 18677 1
481 . 1 1 43 43 LEU HD13 H 1 0.996 0.05 . . . . . C 369 LEU HD13 . 18677 1
482 . 1 1 43 43 LEU C C 13 177.625 0.4 . 1 . . . C 369 LEU C . 18677 1
483 . 1 1 43 43 LEU CA C 13 55.528 0.4 . 1 . . . C 369 LEU CA . 18677 1
484 . 1 1 43 43 LEU CB C 13 41.349 0.4 . 1 . . . C 369 LEU CB . 18677 1
485 . 1 1 43 43 LEU CG C 13 26.524 0.4 . 1 . . . C 369 LEU CG . 18677 1
486 . 1 1 43 43 LEU CD1 C 13 22.110 0.4 . . . . . C 369 LEU CD1 . 18677 1
487 . 1 1 43 43 LEU N N 15 116.399 0.2 . 1 . . . C 369 LEU N . 18677 1
488 . 1 1 44 44 GLU H H 1 7.210 0.05 . 1 . . . C 370 GLU H . 18677 1
489 . 1 1 44 44 GLU HA H 1 4.000 0.05 . 1 . . . C 370 GLU HA . 18677 1
490 . 1 1 44 44 GLU HB2 H 1 2.045 0.05 . . . . . C 370 GLU HB2 . 18677 1
491 . 1 1 44 44 GLU HG2 H 1 2.460 0.05 . . . . . C 370 GLU HG2 . 18677 1
492 . 1 1 44 44 GLU HG3 H 1 2.240 0.05 . . . . . C 370 GLU HG3 . 18677 1
493 . 1 1 44 44 GLU C C 13 176.246 0.4 . 1 . . . C 370 GLU C . 18677 1
494 . 1 1 44 44 GLU CA C 13 57.885 0.4 . 1 . . . C 370 GLU CA . 18677 1
495 . 1 1 44 44 GLU CB C 13 29.538 0.4 . 1 . . . C 370 GLU CB . 18677 1
496 . 1 1 44 44 GLU CG C 13 36.064 0.4 . 1 . . . C 370 GLU CG . 18677 1
497 . 1 1 44 44 GLU N N 15 115.885 0.2 . 1 . . . C 370 GLU N . 18677 1
498 . 1 1 45 45 GLN H H 1 7.561 0.05 . 1 . . . C 371 GLN H . 18677 1
499 . 1 1 45 45 GLN HA H 1 4.419 0.05 . 1 . . . C 371 GLN HA . 18677 1
500 . 1 1 45 45 GLN HB2 H 1 1.815 0.05 . . . . . C 371 GLN HB2 . 18677 1
501 . 1 1 45 45 GLN HB3 H 1 1.741 0.05 . . . . . C 371 GLN HB3 . 18677 1
502 . 1 1 45 45 GLN HG2 H 1 2.059 0.05 . . . . . C 371 GLN HG2 . 18677 1
503 . 1 1 45 45 GLN HE21 H 1 7.196 0.05 . . . . . C 371 GLN HE21 . 18677 1
504 . 1 1 45 45 GLN HE22 H 1 6.256 0.05 . . . . . C 371 GLN HE22 . 18677 1
505 . 1 1 45 45 GLN C C 13 174.459 0.4 . 1 . . . C 371 GLN C . 18677 1
506 . 1 1 45 45 GLN CA C 13 54.79 0.4 . 1 . . . C 371 GLN CA . 18677 1
507 . 1 1 45 45 GLN CB C 13 30.45 0.4 . 1 . . . C 371 GLN CB . 18677 1
508 . 1 1 45 45 GLN CG C 13 32.657 0.4 . 1 . . . C 371 GLN CG . 18677 1
509 . 1 1 45 45 GLN N N 15 113.259 0.2 . 1 . . . C 371 GLN N . 18677 1
510 . 1 1 45 45 GLN NE2 N 15 112.246 0.2 . 1 . . . C 371 GLN NE2 . 18677 1
511 . 1 1 46 46 ASP H H 1 7.890 0.05 . 1 . . . C 372 ASP H . 18677 1
512 . 1 1 46 46 ASP HA H 1 4.548 0.05 . 1 . . . C 372 ASP HA . 18677 1
513 . 1 1 46 46 ASP HB2 H 1 1.750 0.05 . . . . . C 372 ASP HB2 . 18677 1
514 . 1 1 46 46 ASP HB3 H 1 1.581 0.05 . . . . . C 372 ASP HB3 . 18677 1
515 . 1 1 46 46 ASP C C 13 174.003 0.4 . 1 . . . C 372 ASP C . 18677 1
516 . 1 1 46 46 ASP CA C 13 53.607 0.4 . 1 . . . C 372 ASP CA . 18677 1
517 . 1 1 46 46 ASP CB C 13 43.669 0.4 . 1 . . . C 372 ASP CB . 18677 1
518 . 1 1 46 46 ASP N N 15 122.118 0.2 . 1 . . . C 372 ASP N . 18677 1
519 . 1 1 47 47 THR H H 1 7.841 0.05 . 1 . . . C 373 THR H . 18677 1
520 . 1 1 47 47 THR HA H 1 4.505 0.05 . 1 . . . C 373 THR HA . 18677 1
521 . 1 1 47 47 THR HB H 1 4.528 0.05 . 1 . . . C 373 THR HB . 18677 1
522 . 1 1 47 47 THR HG21 H 1 1.116 0.05 . 1 . . . C 373 THR HG21 . 18677 1
523 . 1 1 47 47 THR HG22 H 1 1.116 0.05 . 1 . . . C 373 THR HG22 . 18677 1
524 . 1 1 47 47 THR HG23 H 1 1.116 0.05 . 1 . . . C 373 THR HG23 . 18677 1
525 . 1 1 47 47 THR C C 13 173.484 0.4 . 1 . . . C 373 THR C . 18677 1
526 . 1 1 47 47 THR CA C 13 59.327 0.4 . 1 . . . C 373 THR CA . 18677 1
527 . 1 1 47 47 THR CB C 13 67.599 0.4 . 1 . . . C 373 THR CB . 18677 1
528 . 1 1 47 47 THR CG2 C 13 21.226 0.4 . 1 . . . C 373 THR CG2 . 18677 1
529 . 1 1 47 47 THR N N 15 110.708 0.2 . 1 . . . C 373 THR N . 18677 1
530 . 1 1 48 48 SER H H 1 8.261 0.05 . 1 . . . C 374 SER H . 18677 1
531 . 1 1 48 48 SER HA H 1 5.248 0.05 . 1 . . . C 374 SER HA . 18677 1
532 . 1 1 48 48 SER HB2 H 1 3.441 0.05 . . . . . C 374 SER HB2 . 18677 1
533 . 1 1 48 48 SER HB3 H 1 3.408 0.05 . . . . . C 374 SER HB3 . 18677 1
534 . 1 1 48 48 SER C C 13 172.018 0.4 . 1 . . . C 374 SER C . 18677 1
535 . 1 1 48 48 SER CA C 13 56.145 0.4 . 1 . . . C 374 SER CA . 18677 1
536 . 1 1 48 48 SER CB C 13 65.617 0.4 . 1 . . . C 374 SER CB . 18677 1
537 . 1 1 48 48 SER N N 15 117.048 0.2 . 1 . . . C 374 SER N . 18677 1
538 . 1 1 49 49 CYS H H 1 8.419 0.05 . 1 . . . C 375 CYS H . 18677 1
539 . 1 1 49 49 CYS HA H 1 4.008 0.05 . 1 . . . C 375 CYS HA . 18677 1
540 . 1 1 49 49 CYS HB2 H 1 3.008 0.05 . . . . . C 375 CYS HB2 . 18677 1
541 . 1 1 49 49 CYS HB3 H 1 2.881 0.05 . . . . . C 375 CYS HB3 . 18677 1
542 . 1 1 49 49 CYS CA C 13 56.679 0.4 . 1 . . . C 375 CYS CA . 18677 1
543 . 1 1 49 49 CYS CB C 13 31.228 0.4 . 1 . . . C 375 CYS CB . 18677 1
544 . 1 1 49 49 CYS N N 15 122.523 0.2 . 1 . . . C 375 CYS N . 18677 1
545 . 1 1 50 50 PRO HA H 1 3.638 0.05 . 1 . . . C 376 PRO HA . 18677 1
546 . 1 1 50 50 PRO HB2 H 1 0.978 0.05 . . . . . C 376 PRO HB2 . 18677 1
547 . 1 1 50 50 PRO HB3 H 1 0.569 0.05 . . . . . C 376 PRO HB3 . 18677 1
548 . 1 1 50 50 PRO HG3 H 1 0.922 0.05 . . . . . C 376 PRO HG3 . 18677 1
549 . 1 1 50 50 PRO HD2 H 1 3.027 0.05 . . . . . C 376 PRO HD2 . 18677 1
550 . 1 1 50 50 PRO HD3 H 1 2.870 0.05 . . . . . C 376 PRO HD3 . 18677 1
551 . 1 1 50 50 PRO C C 13 176.495 0.4 . 1 . . . C 376 PRO C . 18677 1
552 . 1 1 50 50 PRO CA C 13 64.442 0.4 . 1 . . . C 376 PRO CA . 18677 1
553 . 1 1 50 50 PRO CB C 13 31.370 0.4 . 1 . . . C 376 PRO CB . 18677 1
554 . 1 1 50 50 PRO CG C 13 24.300 0.4 . 1 . . . C 376 PRO CG . 18677 1
555 . 1 1 50 50 PRO CD C 13 50.205 0.4 . 1 . . . C 376 PRO CD . 18677 1
556 . 1 1 51 51 THR H H 1 9.047 0.05 . 1 . . . C 377 THR H . 18677 1
557 . 1 1 51 51 THR HA H 1 4.053 0.05 . 1 . . . C 377 THR HA . 18677 1
558 . 1 1 51 51 THR HB H 1 3.163 0.05 . 1 . . . C 377 THR HB . 18677 1
559 . 1 1 51 51 THR HG21 H 1 0.550 0.05 . 1 . . . C 377 THR HG21 . 18677 1
560 . 1 1 51 51 THR HG22 H 1 0.550 0.05 . 1 . . . C 377 THR HG22 . 18677 1
561 . 1 1 51 51 THR HG23 H 1 0.550 0.05 . 1 . . . C 377 THR HG23 . 18677 1
562 . 1 1 51 51 THR C C 13 174.857 0.4 . 1 . . . C 377 THR C . 18677 1
563 . 1 1 51 51 THR CA C 13 64.148 0.4 . 1 . . . C 377 THR CA . 18677 1
564 . 1 1 51 51 THR CB C 13 69.237 0.4 . 1 . . . C 377 THR CB . 18677 1
565 . 1 1 51 51 THR CG2 C 13 20.650 0.4 . 1 . . . C 377 THR CG2 . 18677 1
566 . 1 1 51 51 THR N N 15 115.817 0.2 . 1 . . . C 377 THR N . 18677 1
567 . 1 1 52 52 CYS H H 1 8.564 0.05 . 1 . . . C 378 CYS H . 18677 1
568 . 1 1 52 52 CYS HA H 1 4.913 0.05 . 1 . . . C 378 CYS HA . 18677 1
569 . 1 1 52 52 CYS HB2 H 1 3.335 0.05 . . . . . C 378 CYS HB2 . 18677 1
570 . 1 1 52 52 CYS HB3 H 1 2.718 0.05 . . . . . C 378 CYS HB3 . 18677 1
571 . 1 1 52 52 CYS C C 13 176.189 0.4 . 1 . . . C 378 CYS C . 18677 1
572 . 1 1 52 52 CYS CA C 13 57.980 0.4 . 1 . . . C 378 CYS CA . 18677 1
573 . 1 1 52 52 CYS CB C 13 31.411 0.4 . 1 . . . C 378 CYS CB . 18677 1
574 . 1 1 52 52 CYS N N 15 120.781 0.2 . 1 . . . C 378 CYS N . 18677 1
575 . 1 1 53 53 ARG H H 1 7.817 0.05 . 1 . . . C 379 ARG H . 18677 1
576 . 1 1 53 53 ARG HA H 1 4.079 0.05 . 1 . . . C 379 ARG HA . 18677 1
577 . 1 1 53 53 ARG HB2 H 1 2.108 0.05 . . . . . C 379 ARG HB2 . 18677 1
578 . 1 1 53 53 ARG HG2 H 1 1.615 0.05 . . . . . C 379 ARG HG2 . 18677 1
579 . 1 1 53 53 ARG HG3 H 1 1.325 0.05 . . . . . C 379 ARG HG3 . 18677 1
580 . 1 1 53 53 ARG HD2 H 1 3.146 0.05 . . . . . C 379 ARG HD2 . 18677 1
581 . 1 1 53 53 ARG HH11 H 1 7.110 0.05 . . . . . C 379 ARG HH11 . 18677 1
582 . 1 1 53 53 ARG HH21 H 1 7.105 0.05 . . . . . C 379 ARG HH21 . 18677 1
583 . 1 1 53 53 ARG C C 13 175.097 0.4 . 1 . . . C 379 ARG C . 18677 1
584 . 1 1 53 53 ARG CA C 13 55.911 0.4 . 1 . . . C 379 ARG CA . 18677 1
585 . 1 1 53 53 ARG CB C 13 30.358 0.4 . 1 . . . C 379 ARG CB . 18677 1
586 . 1 1 53 53 ARG CG C 13 25.738 0.4 . 1 . . . C 379 ARG CG . 18677 1
587 . 1 1 53 53 ARG CD C 13 40.556 0.4 . 1 . . . C 379 ARG CD . 18677 1
588 . 1 1 53 53 ARG N N 15 115.315 0.2 . 1 . . . C 379 ARG N . 18677 1
589 . 1 1 53 53 ARG NH1 N 15 75.035 0.2 . . . . . C 379 ARG NH1 . 18677 1
590 . 1 1 53 53 ARG NH2 N 15 75.035 0.2 . . . . . C 379 ARG NH2 . 18677 1
591 . 1 1 54 54 MET H H 1 8.040 0.05 . 1 . . . C 380 MET H . 18677 1
592 . 1 1 54 54 MET HA H 1 4.259 0.05 . 1 . . . C 380 MET HA . 18677 1
593 . 1 1 54 54 MET HB2 H 1 2.274 0.05 . . . . . C 380 MET HB2 . 18677 1
594 . 1 1 54 54 MET HB3 H 1 1.847 0.05 . . . . . C 380 MET HB3 . 18677 1
595 . 1 1 54 54 MET HG2 H 1 2.578 0.05 . . . . . C 380 MET HG2 . 18677 1
596 . 1 1 54 54 MET HE1 H 1 2.059 0.05 . 1 . . . C 380 MET HE1 . 18677 1
597 . 1 1 54 54 MET HE2 H 1 2.059 0.05 . 1 . . . C 380 MET HE2 . 18677 1
598 . 1 1 54 54 MET HE3 H 1 2.059 0.05 . 1 . . . C 380 MET HE3 . 18677 1
599 . 1 1 54 54 MET C C 13 176.606 0.4 . 1 . . . C 380 MET C . 18677 1
600 . 1 1 54 54 MET CA C 13 56.789 0.4 . 1 . . . C 380 MET CA . 18677 1
601 . 1 1 54 54 MET CB C 13 32.988 0.4 . 1 . . . C 380 MET CB . 18677 1
602 . 1 1 54 54 MET CG C 13 31.405 0.4 . 1 . . . C 380 MET CG . 18677 1
603 . 1 1 54 54 MET CE C 13 17.000 0.4 . 1 . . . C 380 MET CE . 18677 1
604 . 1 1 54 54 MET N N 15 121.598 0.2 . 1 . . . C 380 MET N . 18677 1
605 . 1 1 55 55 SER H H 1 8.802 0.05 . 1 . . . C 381 SER H . 18677 1
606 . 1 1 55 55 SER HA H 1 4.356 0.05 . 1 . . . C 381 SER HA . 18677 1
607 . 1 1 55 55 SER HB2 H 1 3.970 0.05 . . . . . C 381 SER HB2 . 18677 1
608 . 1 1 55 55 SER HB3 H 1 3.860 0.05 . . . . . C 381 SER HB3 . 18677 1
609 . 1 1 55 55 SER C C 13 175.419 0.4 . 1 . . . C 381 SER C . 18677 1
610 . 1 1 55 55 SER CA C 13 58.989 0.4 . 1 . . . C 381 SER CA . 18677 1
611 . 1 1 55 55 SER CB C 13 62.934 0.4 . 1 . . . C 381 SER CB . 18677 1
612 . 1 1 55 55 SER N N 15 120.943 0.2 . 1 . . . C 381 SER N . 18677 1
613 . 1 1 56 56 LEU H H 1 8.521 0.05 . 1 . . . C 382 LEU H . 18677 1
614 . 1 1 56 56 LEU HA H 1 4.609 0.05 . 1 . . . C 382 LEU HA . 18677 1
615 . 1 1 56 56 LEU HB2 H 1 1.657 0.05 . . . . . C 382 LEU HB2 . 18677 1
616 . 1 1 56 56 LEU HG H 1 1.773 0.05 . 1 . . . C 382 LEU HG . 18677 1
617 . 1 1 56 56 LEU HD11 H 1 0.805 0.05 . . . . . C 382 LEU HD11 . 18677 1
618 . 1 1 56 56 LEU HD12 H 1 0.805 0.05 . . . . . C 382 LEU HD12 . 18677 1
619 . 1 1 56 56 LEU HD13 H 1 0.805 0.05 . . . . . C 382 LEU HD13 . 18677 1
620 . 1 1 56 56 LEU C C 13 176.542 0.4 . 1 . . . C 382 LEU C . 18677 1
621 . 1 1 56 56 LEU CA C 13 53.719 0.4 . 1 . . . C 382 LEU CA . 18677 1
622 . 1 1 56 56 LEU CB C 13 41.475 0.4 . 1 . . . C 382 LEU CB . 18677 1
623 . 1 1 56 56 LEU CG C 13 27.120 0.4 . 1 . . . C 382 LEU CG . 18677 1
624 . 1 1 56 56 LEU CD1 C 13 22.455 0.4 . . . . . C 382 LEU CD1 . 18677 1
625 . 1 1 56 56 LEU N N 15 124.777 0.2 . 1 . . . C 382 LEU N . 18677 1
626 . 1 1 57 57 ASN H H 1 8.432 0.05 . 1 . . . C 383 ASN H . 18677 1
627 . 1 1 57 57 ASN HA H 1 4.619 0.05 . 1 . . . C 383 ASN HA . 18677 1
628 . 1 1 57 57 ASN HB2 H 1 2.839 0.05 . . . . . C 383 ASN HB2 . 18677 1
629 . 1 1 57 57 ASN HB3 H 1 2.696 0.05 . . . . . C 383 ASN HB3 . 18677 1
630 . 1 1 57 57 ASN HD21 H 1 7.595 0.05 . . . . . C 383 ASN HD21 . 18677 1
631 . 1 1 57 57 ASN HD22 H 1 6.872 0.05 . . . . . C 383 ASN HD22 . 18677 1
632 . 1 1 57 57 ASN C C 13 175.013 0.4 . 1 . . . C 383 ASN C . 18677 1
633 . 1 1 57 57 ASN CA C 13 52.835 0.4 . 1 . . . C 383 ASN CA . 18677 1
634 . 1 1 57 57 ASN CB C 13 38.313 0.4 . 1 . . . C 383 ASN CB . 18677 1
635 . 1 1 57 57 ASN N N 15 119.143 0.2 . 1 . . . C 383 ASN N . 18677 1
636 . 1 1 57 57 ASN ND2 N 15 113.06 0.2 . 1 . . . C 383 ASN ND2 . 18677 1
637 . 1 1 58 58 ILE H H 1 8.125 0.05 . 1 . . . C 384 ILE H . 18677 1
638 . 1 1 58 58 ILE HA H 1 4.119 0.05 . 1 . . . C 384 ILE HA . 18677 1
639 . 1 1 58 58 ILE HB H 1 1.851 0.05 . 1 . . . C 384 ILE HB . 18677 1
640 . 1 1 58 58 ILE HG12 H 1 1.530 0.05 . . . . . C 384 ILE HG12 . 18677 1
641 . 1 1 58 58 ILE HG13 H 1 1.125 0.05 . . . . . C 384 ILE HG13 . 18677 1
642 . 1 1 58 58 ILE HG21 H 1 1.521 0.05 . 1 . . . C 384 ILE HG21 . 18677 1
643 . 1 1 58 58 ILE HG22 H 1 1.521 0.05 . 1 . . . C 384 ILE HG22 . 18677 1
644 . 1 1 58 58 ILE HG23 H 1 1.521 0.05 . 1 . . . C 384 ILE HG23 . 18677 1
645 . 1 1 58 58 ILE HD11 H 1 0.852 0.05 . 1 . . . C 384 ILE HD11 . 18677 1
646 . 1 1 58 58 ILE HD12 H 1 0.852 0.05 . 1 . . . C 384 ILE HD12 . 18677 1
647 . 1 1 58 58 ILE HD13 H 1 0.852 0.05 . 1 . . . C 384 ILE HD13 . 18677 1
648 . 1 1 58 58 ILE C C 13 175.75 0.4 . 1 . . . C 384 ILE C . 18677 1
649 . 1 1 58 58 ILE CA C 13 60.729 0.4 . 1 . . . C 384 ILE CA . 18677 1
650 . 1 1 58 58 ILE CB C 13 38.434 0.4 . 1 . . . C 384 ILE CB . 18677 1
651 . 1 1 58 58 ILE CG1 C 13 26.795 0.4 . 1 . . . C 384 ILE CG1 . 18677 1
652 . 1 1 58 58 ILE CG2 C 13 17.13 0.4 . 1 . . . C 384 ILE CG2 . 18677 1
653 . 1 1 58 58 ILE CD1 C 13 13.075 0.4 . 1 . . . C 384 ILE CD1 . 18677 1
654 . 1 1 58 58 ILE N N 15 120.747 0.2 . 1 . . . C 384 ILE N . 18677 1
stop_
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