Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
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 27542
_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' . . . 27542 1
2 '3D HNCACB' . . . 27542 1
3 '3D CBCA(CO)NH' . . . 27542 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 $CcpNmr . . 27542 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 3 3 PRO CA C 13 64.1946 0.0155 . 1 . . . . . 3 PRO CA . 27542 1
2 . 1 1 3 3 PRO CB C 13 31.7905 0.0536 . 1 . . . . . 3 PRO CB . 27542 1
3 . 1 1 4 4 GLN H H 1 9.0432 0.0016 . 1 . . . . . 4 GLN H . 27542 1
4 . 1 1 4 4 GLN HE21 H 1 6.9186 . . 1 . . . . . 4 GLN HE21 . 27542 1
5 . 1 1 4 4 GLN HE22 H 1 7.2071 . . 1 . . . . . 4 GLN HE22 . 27542 1
6 . 1 1 4 4 GLN CA C 13 56.7299 0.0039 . 1 . . . . . 4 GLN CA . 27542 1
7 . 1 1 4 4 GLN CB C 13 27.1121 0.0464 . 1 . . . . . 4 GLN CB . 27542 1
8 . 1 1 4 4 GLN N N 15 117.4643 0.0129 . 1 . . . . . 4 GLN N . 27542 1
9 . 1 1 4 4 GLN NE2 N 15 111.7512 0.0009 . 1 . . . . . 4 GLN NE2 . 27542 1
10 . 1 1 5 5 PHE H H 1 7.6189 0.0026 . 1 . . . . . 5 PHE H . 27542 1
11 . 1 1 5 5 PHE CA C 13 55.4845 0.0091 . 1 . . . . . 5 PHE CA . 27542 1
12 . 1 1 5 5 PHE CB C 13 41.9833 0.0331 . 1 . . . . . 5 PHE CB . 27542 1
13 . 1 1 5 5 PHE N N 15 120.6672 0.0173 . 1 . . . . . 5 PHE N . 27542 1
14 . 1 1 6 6 THR H H 1 8.8277 0.0029 . 1 . . . . . 6 THR H . 27542 1
15 . 1 1 6 6 THR CA C 13 60.8550 0.0390 . 1 . . . . . 6 THR CA . 27542 1
16 . 1 1 6 6 THR CB C 13 69.4594 0.0319 . 1 . . . . . 6 THR CB . 27542 1
17 . 1 1 6 6 THR N N 15 112.9500 0.0147 . 1 . . . . . 6 THR N . 27542 1
18 . 1 1 7 7 LYS H H 1 9.0299 0.0026 . 1 . . . . . 7 LYS H . 27542 1
19 . 1 1 7 7 LYS CA C 13 61.7559 0.0199 . 1 . . . . . 7 LYS CA . 27542 1
20 . 1 1 7 7 LYS CB C 13 33.2844 0.0257 . 1 . . . . . 7 LYS CB . 27542 1
21 . 1 1 7 7 LYS N N 15 121.1331 0.0326 . 1 . . . . . 7 LYS N . 27542 1
22 . 1 1 8 8 ALA H H 1 10.1794 0.0035 . 1 . . . . . 8 ALA H . 27542 1
23 . 1 1 8 8 ALA CA C 13 55.1682 0.0414 . 1 . . . . . 8 ALA CA . 27542 1
24 . 1 1 8 8 ALA CB C 13 18.7537 0.0534 . 1 . . . . . 8 ALA CB . 27542 1
25 . 1 1 8 8 ALA N N 15 125.4543 0.0482 . 1 . . . . . 8 ALA N . 27542 1
26 . 1 1 9 9 GLN H H 1 8.3855 0.0049 . 1 . . . . . 9 GLN H . 27542 1
27 . 1 1 9 9 GLN CA C 13 58.5134 0.0177 . 1 . . . . . 9 GLN CA . 27542 1
28 . 1 1 9 9 GLN CB C 13 28.6187 0.0386 . 1 . . . . . 9 GLN CB . 27542 1
29 . 1 1 9 9 GLN N N 15 118.7497 0.0259 . 1 . . . . . 9 GLN N . 27542 1
30 . 1 1 10 10 TRP H H 1 8.8013 0.0024 . 1 . . . . . 10 TRP H . 27542 1
31 . 1 1 10 10 TRP HE1 H 1 10.1843 . . 1 . . . . . 10 TRP HE1 . 27542 1
32 . 1 1 10 10 TRP CA C 13 57.9165 0.0231 . 1 . . . . . 10 TRP CA . 27542 1
33 . 1 1 10 10 TRP CB C 13 31.5441 0.0222 . 1 . . . . . 10 TRP CB . 27542 1
34 . 1 1 10 10 TRP N N 15 120.7935 0.0185 . 1 . . . . . 10 TRP N . 27542 1
35 . 1 1 10 10 TRP NE1 N 15 130.4223 . . 1 . . . . . 10 TRP NE1 . 27542 1
36 . 1 1 11 11 PHE H H 1 8.6845 0.0041 . 1 . . . . . 11 PHE H . 27542 1
37 . 1 1 11 11 PHE CA C 13 61.8587 0.1038 . 1 . . . . . 11 PHE CA . 27542 1
38 . 1 1 11 11 PHE CB C 13 38.8925 0.0723 . 1 . . . . . 11 PHE CB . 27542 1
39 . 1 1 11 11 PHE N N 15 121.9347 0.0354 . 1 . . . . . 11 PHE N . 27542 1
40 . 1 1 12 12 ALA H H 1 8.2983 0.0045 . 1 . . . . . 12 ALA H . 27542 1
41 . 1 1 12 12 ALA CA C 13 55.2376 0.0044 . 1 . . . . . 12 ALA CA . 27542 1
42 . 1 1 12 12 ALA CB C 13 17.9676 0.0262 . 1 . . . . . 12 ALA CB . 27542 1
43 . 1 1 12 12 ALA N N 15 122.2434 0.1345 . 1 . . . . . 12 ALA N . 27542 1
44 . 1 1 13 13 ILE H H 1 7.7773 0.0019 . 1 . . . . . 13 ILE H . 27542 1
45 . 1 1 13 13 ILE CA C 13 64.6459 0.0360 . 1 . . . . . 13 ILE CA . 27542 1
46 . 1 1 13 13 ILE CB C 13 38.2817 0.0343 . 1 . . . . . 13 ILE CB . 27542 1
47 . 1 1 13 13 ILE N N 15 118.4615 0.0400 . 1 . . . . . 13 ILE N . 27542 1
48 . 1 1 14 14 GLN H H 1 7.2542 0.0021 . 1 . . . . . 14 GLN H . 27542 1
49 . 1 1 14 14 GLN CA C 13 58.2119 0.0092 . 1 . . . . . 14 GLN CA . 27542 1
50 . 1 1 14 14 GLN CB C 13 31.0990 0.0281 . 1 . . . . . 14 GLN CB . 27542 1
51 . 1 1 14 14 GLN N N 15 112.4989 0.0223 . 1 . . . . . 14 GLN N . 27542 1
52 . 1 1 15 15 HIS H H 1 7.7919 0.0028 . 1 . . . . . 15 HIS H . 27542 1
53 . 1 1 15 15 HIS CA C 13 54.8917 0.0170 . 1 . . . . . 15 HIS CA . 27542 1
54 . 1 1 15 15 HIS CB C 13 30.4494 0.0942 . 1 . . . . . 15 HIS CB . 27542 1
55 . 1 1 15 15 HIS N N 15 106.1004 0.0198 . 1 . . . . . 15 HIS N . 27542 1
56 . 1 1 16 16 ILE H H 1 8.3087 0.0016 . 1 . . . . . 16 ILE H . 27542 1
57 . 1 1 16 16 ILE CA C 13 58.8465 0.0216 . 1 . . . . . 16 ILE CA . 27542 1
58 . 1 1 16 16 ILE CB C 13 37.0083 0.0092 . 1 . . . . . 16 ILE CB . 27542 1
59 . 1 1 16 16 ILE N N 15 121.3672 0.0295 . 1 . . . . . 16 ILE N . 27542 1
60 . 1 1 17 17 ASN H H 1 7.9251 0.0040 . 1 . . . . . 17 ASN H . 27542 1
61 . 1 1 17 17 ASN CA C 13 53.7792 0.0725 . 1 . . . . . 17 ASN CA . 27542 1
62 . 1 1 17 17 ASN CB C 13 39.5326 0.0270 . 1 . . . . . 17 ASN CB . 27542 1
63 . 1 1 17 17 ASN N N 15 124.1437 0.0131 . 1 . . . . . 17 ASN N . 27542 1
64 . 1 1 18 18 VAL H H 1 8.5277 0.0010 . 1 . . . . . 18 VAL H . 27542 1
65 . 1 1 18 18 VAL CA C 13 65.4246 0.0155 . 1 . . . . . 18 VAL CA . 27542 1
66 . 1 1 18 18 VAL CB C 13 32.1709 0.0295 . 1 . . . . . 18 VAL CB . 27542 1
67 . 1 1 18 18 VAL N N 15 121.4571 0.0286 . 1 . . . . . 18 VAL N . 27542 1
68 . 1 1 19 19 ASN H H 1 7.9905 0.0033 . 1 . . . . . 19 ASN H . 27542 1
69 . 1 1 19 19 ASN HD21 H 1 6.8059 . . 1 . . . . . 19 ASN HD21 . 27542 1
70 . 1 1 19 19 ASN HD22 H 1 7.5740 . . 1 . . . . . 19 ASN HD22 . 27542 1
71 . 1 1 19 19 ASN CA C 13 51.1871 . . 1 . . . . . 19 ASN CA . 27542 1
72 . 1 1 19 19 ASN CB C 13 39.4085 . . 1 . . . . . 19 ASN CB . 27542 1
73 . 1 1 19 19 ASN N N 15 116.7595 0.0099 . 1 . . . . . 19 ASN N . 27542 1
74 . 1 1 19 19 ASN ND2 N 15 113.2702 0.0029 . 1 . . . . . 19 ASN ND2 . 27542 1
75 . 1 1 21 21 PRO CA C 13 61.7435 0.0149 . 1 . . . . . 21 PRO CA . 27542 1
76 . 1 1 21 21 PRO CB C 13 32.2056 0.0280 . 1 . . . . . 21 PRO CB . 27542 1
77 . 1 1 22 22 ARG H H 1 7.8171 0.0017 . 1 . . . . . 22 ARG H . 27542 1
78 . 1 1 22 22 ARG CA C 13 56.1650 0.0105 . 1 . . . . . 22 ARG CA . 27542 1
79 . 1 1 22 22 ARG CB C 13 30.1609 0.0271 . 1 . . . . . 22 ARG CB . 27542 1
80 . 1 1 22 22 ARG N N 15 112.3117 0.1089 . 1 . . . . . 22 ARG N . 27542 1
81 . 1 1 23 23 CYS H H 1 11.0200 0.0035 . 1 . . . . . 23 CYS H . 27542 1
82 . 1 1 23 23 CYS CA C 13 62.6727 0.0087 . 1 . . . . . 23 CYS CA . 27542 1
83 . 1 1 23 23 CYS CB C 13 42.3259 0.0292 . 1 . . . . . 23 CYS CB . 27542 1
84 . 1 1 23 23 CYS N N 15 123.5604 0.0169 . 1 . . . . . 23 CYS N . 27542 1
85 . 1 1 24 24 THR H H 1 9.9072 0.0035 . 1 . . . . . 24 THR H . 27542 1
86 . 1 1 24 24 THR CA C 13 67.7232 0.0280 . 1 . . . . . 24 THR CA . 27542 1
87 . 1 1 24 24 THR CB C 13 69.8382 0.0785 . 1 . . . . . 24 THR CB . 27542 1
88 . 1 1 24 24 THR N N 15 117.1786 0.0212 . 1 . . . . . 24 THR N . 27542 1
89 . 1 1 25 25 ILE H H 1 7.2473 0.0027 . 1 . . . . . 25 ILE H . 27542 1
90 . 1 1 25 25 ILE CA C 13 63.0839 0.0129 . 1 . . . . . 25 ILE CA . 27542 1
91 . 1 1 25 25 ILE CB C 13 38.0335 0.0346 . 1 . . . . . 25 ILE CB . 27542 1
92 . 1 1 25 25 ILE N N 15 118.3451 0.0532 . 1 . . . . . 25 ILE N . 27542 1
93 . 1 1 26 26 ALA H H 1 8.7834 0.0032 . 1 . . . . . 26 ALA H . 27542 1
94 . 1 1 26 26 ALA CA C 13 54.6893 0.0253 . 1 . . . . . 26 ALA CA . 27542 1
95 . 1 1 26 26 ALA CB C 13 19.0312 0.0523 . 1 . . . . . 26 ALA CB . 27542 1
96 . 1 1 26 26 ALA N N 15 124.0917 0.0118 . 1 . . . . . 26 ALA N . 27542 1
97 . 1 1 27 27 MET H H 1 8.3063 0.0029 . 1 . . . . . 27 MET H . 27542 1
98 . 1 1 27 27 MET CA C 13 53.8558 0.0102 . 1 . . . . . 27 MET CA . 27542 1
99 . 1 1 27 27 MET CB C 13 30.1556 0.0702 . 1 . . . . . 27 MET CB . 27542 1
100 . 1 1 27 27 MET N N 15 109.9185 0.0187 . 1 . . . . . 27 MET N . 27542 1
101 . 1 1 28 28 ARG H H 1 7.4027 0.0025 . 1 . . . . . 28 ARG H . 27542 1
102 . 1 1 28 28 ARG CA C 13 59.8265 0.0130 . 1 . . . . . 28 ARG CA . 27542 1
103 . 1 1 28 28 ARG CB C 13 29.9730 0.0344 . 1 . . . . . 28 ARG CB . 27542 1
104 . 1 1 28 28 ARG N N 15 118.9808 0.0136 . 1 . . . . . 28 ARG N . 27542 1
105 . 1 1 29 29 VAL H H 1 7.3031 0.0029 . 1 . . . . . 29 VAL H . 27542 1
106 . 1 1 29 29 VAL CA C 13 65.6467 0.0012 . 1 . . . . . 29 VAL CA . 27542 1
107 . 1 1 29 29 VAL CB C 13 32.1712 0.0311 . 1 . . . . . 29 VAL CB . 27542 1
108 . 1 1 29 29 VAL N N 15 115.7629 0.0213 . 1 . . . . . 29 VAL N . 27542 1
109 . 1 1 30 30 ILE H H 1 6.8159 0.0027 . 1 . . . . . 30 ILE H . 27542 1
110 . 1 1 30 30 ILE CA C 13 65.2197 0.0484 . 1 . . . . . 30 ILE CA . 27542 1
111 . 1 1 30 30 ILE CB C 13 40.1747 0.0237 . 1 . . . . . 30 ILE CB . 27542 1
112 . 1 1 30 30 ILE N N 15 118.6021 0.0206 . 1 . . . . . 30 ILE N . 27542 1
113 . 1 1 31 31 ASN H H 1 8.4703 0.0025 . 1 . . . . . 31 ASN H . 27542 1
114 . 1 1 31 31 ASN CA C 13 54.9500 0.0049 . 1 . . . . . 31 ASN CA . 27542 1
115 . 1 1 31 31 ASN CB C 13 37.8586 0.0238 . 1 . . . . . 31 ASN CB . 27542 1
116 . 1 1 31 31 ASN N N 15 118.5718 0.0089 . 1 . . . . . 31 ASN N . 27542 1
117 . 1 1 32 32 ASN H H 1 8.4355 0.0038 . 1 . . . . . 32 ASN H . 27542 1
118 . 1 1 32 32 ASN HD21 H 1 6.7471 . . 1 . . . . . 32 ASN HD21 . 27542 1
119 . 1 1 32 32 ASN HD22 H 1 7.3435 . . 1 . . . . . 32 ASN HD22 . 27542 1
120 . 1 1 32 32 ASN CA C 13 55.9784 0.0335 . 1 . . . . . 32 ASN CA . 27542 1
121 . 1 1 32 32 ASN CB C 13 38.3388 0.0507 . 1 . . . . . 32 ASN CB . 27542 1
122 . 1 1 32 32 ASN N N 15 118.2617 0.0299 . 1 . . . . . 32 ASN N . 27542 1
123 . 1 1 32 32 ASN ND2 N 15 111.7402 0.0009 . 1 . . . . . 32 ASN ND2 . 27542 1
124 . 1 1 33 33 TYR H H 1 7.6765 0.0047 . 1 . . . . . 33 TYR H . 27542 1
125 . 1 1 33 33 TYR CA C 13 60.7877 0.0342 . 1 . . . . . 33 TYR CA . 27542 1
126 . 1 1 33 33 TYR CB C 13 39.5315 0.0172 . 1 . . . . . 33 TYR CB . 27542 1
127 . 1 1 33 33 TYR N N 15 116.4732 0.0263 . 1 . . . . . 33 TYR N . 27542 1
128 . 1 1 34 34 GLN H H 1 8.0738 0.0027 . 1 . . . . . 34 GLN H . 27542 1
129 . 1 1 34 34 GLN HE21 H 1 6.9657 . . 1 . . . . . 34 GLN HE21 . 27542 1
130 . 1 1 34 34 GLN HE22 H 1 7.0982 . . 1 . . . . . 34 GLN HE22 . 27542 1
131 . 1 1 34 34 GLN CA C 13 55.9749 0.0445 . 1 . . . . . 34 GLN CA . 27542 1
132 . 1 1 34 34 GLN CB C 13 30.3290 0.0411 . 1 . . . . . 34 GLN CB . 27542 1
133 . 1 1 34 34 GLN N N 15 114.5177 0.0449 . 1 . . . . . 34 GLN N . 27542 1
134 . 1 1 34 34 GLN NE2 N 15 110.7105 0.0094 . 1 . . . . . 34 GLN NE2 . 27542 1
135 . 1 1 35 35 ARG H H 1 8.3600 0.0032 . 1 . . . . . 35 ARG H . 27542 1
136 . 1 1 35 35 ARG CA C 13 57.3465 0.0525 . 1 . . . . . 35 ARG CA . 27542 1
137 . 1 1 35 35 ARG CB C 13 27.5775 0.0729 . 1 . . . . . 35 ARG CB . 27542 1
138 . 1 1 35 35 ARG N N 15 115.6604 0.0176 . 1 . . . . . 35 ARG N . 27542 1
139 . 1 1 36 36 ARG H H 1 7.8205 0.0026 . 1 . . . . . 36 ARG H . 27542 1
140 . 1 1 36 36 ARG CA C 13 54.9533 0.0226 . 1 . . . . . 36 ARG CA . 27542 1
141 . 1 1 36 36 ARG CB C 13 32.7464 0.0175 . 1 . . . . . 36 ARG CB . 27542 1
142 . 1 1 36 36 ARG N N 15 115.4779 0.0303 . 1 . . . . . 36 ARG N . 27542 1
143 . 1 1 37 37 CYS H H 1 9.1317 0.0018 . 1 . . . . . 37 CYS H . 27542 1
144 . 1 1 37 37 CYS CA C 13 54.4115 0.0475 . 1 . . . . . 37 CYS CA . 27542 1
145 . 1 1 37 37 CYS CB C 13 41.1458 0.0245 . 1 . . . . . 37 CYS CB . 27542 1
146 . 1 1 37 37 CYS N N 15 119.0819 0.0169 . 1 . . . . . 37 CYS N . 27542 1
147 . 1 1 38 38 LYS H H 1 8.6502 0.0043 . 1 . . . . . 38 LYS H . 27542 1
148 . 1 1 38 38 LYS CA C 13 57.2796 0.0060 . 1 . . . . . 38 LYS CA . 27542 1
149 . 1 1 38 38 LYS CB C 13 33.2689 0.0133 . 1 . . . . . 38 LYS CB . 27542 1
150 . 1 1 38 38 LYS N N 15 125.8737 0.0165 . 1 . . . . . 38 LYS N . 27542 1
151 . 1 1 39 39 ASN H H 1 9.3475 0.0051 . 1 . . . . . 39 ASN H . 27542 1
152 . 1 1 39 39 ASN HD21 H 1 7.0810 . . 1 . . . . . 39 ASN HD21 . 27542 1
153 . 1 1 39 39 ASN HD22 H 1 7.7916 . . 1 . . . . . 39 ASN HD22 . 27542 1
154 . 1 1 39 39 ASN CA C 13 57.1788 0.0204 . 1 . . . . . 39 ASN CA . 27542 1
155 . 1 1 39 39 ASN CB C 13 38.5217 0.0326 . 1 . . . . . 39 ASN CB . 27542 1
156 . 1 1 39 39 ASN N N 15 126.7170 0.0500 . 1 . . . . . 39 ASN N . 27542 1
157 . 1 1 39 39 ASN ND2 N 15 113.1062 0.0027 . 1 . . . . . 39 ASN ND2 . 27542 1
158 . 1 1 40 40 GLN H H 1 7.8141 0.0028 . 1 . . . . . 40 GLN H . 27542 1
159 . 1 1 40 40 GLN HE21 H 1 6.8957 . . 1 . . . . . 40 GLN HE21 . 27542 1
160 . 1 1 40 40 GLN HE22 H 1 7.5457 . . 1 . . . . . 40 GLN HE22 . 27542 1
161 . 1 1 40 40 GLN CA C 13 54.2402 0.0100 . 1 . . . . . 40 GLN CA . 27542 1
162 . 1 1 40 40 GLN CB C 13 32.4774 0.0485 . 1 . . . . . 40 GLN CB . 27542 1
163 . 1 1 40 40 GLN N N 15 113.6514 0.0636 . 1 . . . . . 40 GLN N . 27542 1
164 . 1 1 40 40 GLN NE2 N 15 112.1225 0.0157 . 1 . . . . . 40 GLN NE2 . 27542 1
165 . 1 1 41 41 ASN H H 1 8.2370 0.0038 . 1 . . . . . 41 ASN H . 27542 1
166 . 1 1 41 41 ASN CA C 13 54.5752 0.0678 . 1 . . . . . 41 ASN CA . 27542 1
167 . 1 1 41 41 ASN CB C 13 44.4486 0.0441 . 1 . . . . . 41 ASN CB . 27542 1
168 . 1 1 41 41 ASN N N 15 114.9694 0.0226 . 1 . . . . . 41 ASN N . 27542 1
169 . 1 1 42 42 THR H H 1 7.9980 0.0053 . 1 . . . . . 42 THR H . 27542 1
170 . 1 1 42 42 THR CA C 13 62.1394 0.0430 . 1 . . . . . 42 THR CA . 27542 1
171 . 1 1 42 42 THR CB C 13 70.3408 0.0529 . 1 . . . . . 42 THR CB . 27542 1
172 . 1 1 42 42 THR N N 15 121.6954 0.0716 . 1 . . . . . 42 THR N . 27542 1
173 . 1 1 43 43 PHE H H 1 9.4759 0.0034 . 1 . . . . . 43 PHE H . 27542 1
174 . 1 1 43 43 PHE CA C 13 57.3793 0.0216 . 1 . . . . . 43 PHE CA . 27542 1
175 . 1 1 43 43 PHE CB C 13 40.5205 0.0295 . 1 . . . . . 43 PHE CB . 27542 1
176 . 1 1 43 43 PHE N N 15 125.4641 0.0256 . 1 . . . . . 43 PHE N . 27542 1
177 . 1 1 44 44 LEU H H 1 9.5399 0.0031 . 1 . . . . . 44 LEU H . 27542 1
178 . 1 1 44 44 LEU CA C 13 54.1679 0.0744 . 1 . . . . . 44 LEU CA . 27542 1
179 . 1 1 44 44 LEU CB C 13 42.6648 0.0282 . 1 . . . . . 44 LEU CB . 27542 1
180 . 1 1 44 44 LEU N N 15 124.2063 0.0181 . 1 . . . . . 44 LEU N . 27542 1
181 . 1 1 45 45 ARG H H 1 8.5518 0.0093 . 1 . . . . . 45 ARG H . 27542 1
182 . 1 1 45 45 ARG CA C 13 54.2259 0.0637 . 1 . . . . . 45 ARG CA . 27542 1
183 . 1 1 45 45 ARG CB C 13 26.9981 0.0519 . 1 . . . . . 45 ARG CB . 27542 1
184 . 1 1 45 45 ARG N N 15 125.7639 0.0268 . 1 . . . . . 45 ARG N . 27542 1
185 . 1 1 46 46 THR H H 1 7.5141 0.0043 . 1 . . . . . 46 THR H . 27542 1
186 . 1 1 46 46 THR CA C 13 58.7880 0.0248 . 1 . . . . . 46 THR CA . 27542 1
187 . 1 1 46 46 THR CB C 13 69.0876 0.0241 . 1 . . . . . 46 THR CB . 27542 1
188 . 1 1 46 46 THR N N 15 116.6041 0.0153 . 1 . . . . . 46 THR N . 27542 1
189 . 1 1 47 47 THR H H 1 7.9697 0.0033 . 1 . . . . . 47 THR H . 27542 1
190 . 1 1 47 47 THR CA C 13 59.3058 0.0212 . 1 . . . . . 47 THR CA . 27542 1
191 . 1 1 47 47 THR CB C 13 71.4489 0.0534 . 1 . . . . . 47 THR CB . 27542 1
192 . 1 1 47 47 THR N N 15 107.4976 0.0223 . 1 . . . . . 47 THR N . 27542 1
193 . 1 1 48 48 PHE H H 1 9.5121 0.0018 . 1 . . . . . 48 PHE H . 27542 1
194 . 1 1 48 48 PHE CA C 13 62.1537 0.0210 . 1 . . . . . 48 PHE CA . 27542 1
195 . 1 1 48 48 PHE CB C 13 39.0604 0.0136 . 1 . . . . . 48 PHE CB . 27542 1
196 . 1 1 48 48 PHE N N 15 123.4109 0.0223 . 1 . . . . . 48 PHE N . 27542 1
197 . 1 1 49 49 ALA H H 1 8.7328 0.0015 . 1 . . . . . 49 ALA H . 27542 1
198 . 1 1 49 49 ALA CA C 13 55.4138 0.0257 . 1 . . . . . 49 ALA CA . 27542 1
199 . 1 1 49 49 ALA CB C 13 18.8469 0.0374 . 1 . . . . . 49 ALA CB . 27542 1
200 . 1 1 49 49 ALA N N 15 120.3420 0.0203 . 1 . . . . . 49 ALA N . 27542 1
201 . 1 1 50 50 TYR H H 1 7.7499 0.0038 . 1 . . . . . 50 TYR H . 27542 1
202 . 1 1 50 50 TYR CA C 13 60.9274 0.0146 . 1 . . . . . 50 TYR CA . 27542 1
203 . 1 1 50 50 TYR CB C 13 37.0486 0.0324 . 1 . . . . . 50 TYR CB . 27542 1
204 . 1 1 50 50 TYR N N 15 117.4855 0.0510 . 1 . . . . . 50 TYR N . 27542 1
205 . 1 1 51 51 THR H H 1 7.8547 0.0025 . 1 . . . . . 51 THR H . 27542 1
206 . 1 1 51 51 THR CA C 13 65.8265 0.0247 . 1 . . . . . 51 THR CA . 27542 1
207 . 1 1 51 51 THR CB C 13 68.4596 0.0563 . 1 . . . . . 51 THR CB . 27542 1
208 . 1 1 51 51 THR N N 15 114.7690 0.0232 . 1 . . . . . 51 THR N . 27542 1
209 . 1 1 52 52 ALA H H 1 8.2791 0.0042 . 1 . . . . . 52 ALA H . 27542 1
210 . 1 1 52 52 ALA CA C 13 55.1210 0.1110 . 1 . . . . . 52 ALA CA . 27542 1
211 . 1 1 52 52 ALA CB C 13 16.7099 0.0580 . 1 . . . . . 52 ALA CB . 27542 1
212 . 1 1 52 52 ALA N N 15 123.0338 0.0401 . 1 . . . . . 52 ALA N . 27542 1
213 . 1 1 53 53 ASN H H 1 7.6338 0.0024 . 1 . . . . . 53 ASN H . 27542 1
214 . 1 1 53 53 ASN HD21 H 1 7.0044 . . 1 . . . . . 53 ASN HD21 . 27542 1
215 . 1 1 53 53 ASN HD22 H 1 7.5617 . . 1 . . . . . 53 ASN HD22 . 27542 1
216 . 1 1 53 53 ASN CA C 13 55.8854 0.0528 . 1 . . . . . 53 ASN CA . 27542 1
217 . 1 1 53 53 ASN CB C 13 38.2340 0.0241 . 1 . . . . . 53 ASN CB . 27542 1
218 . 1 1 53 53 ASN N N 15 116.3816 0.0342 . 1 . . . . . 53 ASN N . 27542 1
219 . 1 1 53 53 ASN ND2 N 15 112.4534 0.0017 . 1 . . . . . 53 ASN ND2 . 27542 1
220 . 1 1 54 54 VAL H H 1 7.6310 0.0026 . 1 . . . . . 54 VAL H . 27542 1
221 . 1 1 54 54 VAL CA C 13 66.1085 0.0149 . 1 . . . . . 54 VAL CA . 27542 1
222 . 1 1 54 54 VAL CB C 13 30.6817 0.0075 . 1 . . . . . 54 VAL CB . 27542 1
223 . 1 1 54 54 VAL N N 15 124.3627 0.0284 . 1 . . . . . 54 VAL N . 27542 1
224 . 1 1 55 55 CYS H H 1 7.0585 0.0068 . 1 . . . . . 55 CYS H . 27542 1
225 . 1 1 55 55 CYS CA C 13 55.1364 0.1083 . 1 . . . . . 55 CYS CA . 27542 1
226 . 1 1 55 55 CYS CB C 13 39.4320 0.0611 . 1 . . . . . 55 CYS CB . 27542 1
227 . 1 1 55 55 CYS N N 15 113.3838 0.0508 . 1 . . . . . 55 CYS N . 27542 1
228 . 1 1 56 56 ARG H H 1 7.2094 0.0043 . 1 . . . . . 56 ARG H . 27542 1
229 . 1 1 56 56 ARG CA C 13 56.0029 0.0273 . 1 . . . . . 56 ARG CA . 27542 1
230 . 1 1 56 56 ARG CB C 13 30.1191 0.0022 . 1 . . . . . 56 ARG CB . 27542 1
231 . 1 1 56 56 ARG N N 15 115.1933 0.0415 . 1 . . . . . 56 ARG N . 27542 1
232 . 1 1 57 57 ASN H H 1 7.6821 0.0038 . 1 . . . . . 57 ASN H . 27542 1
233 . 1 1 57 57 ASN CA C 13 52.2157 0.0210 . 1 . . . . . 57 ASN CA . 27542 1
234 . 1 1 57 57 ASN CB C 13 37.9393 0.0418 . 1 . . . . . 57 ASN CB . 27542 1
235 . 1 1 57 57 ASN N N 15 119.3179 0.0128 . 1 . . . . . 57 ASN N . 27542 1
236 . 1 1 58 58 GLU H H 1 8.8036 0.0045 . 1 . . . . . 58 GLU H . 27542 1
237 . 1 1 58 58 GLU CA C 13 57.9115 0.0364 . 1 . . . . . 58 GLU CA . 27542 1
238 . 1 1 58 58 GLU CB C 13 29.8055 0.1870 . 1 . . . . . 58 GLU CB . 27542 1
239 . 1 1 58 58 GLU N N 15 121.7079 0.0480 . 1 . . . . . 58 GLU N . 27542 1
240 . 1 1 59 59 ARG H H 1 8.3921 0.0097 . 1 . . . . . 59 ARG H . 27542 1
241 . 1 1 59 59 ARG CB C 13 30.8371 0.0570 . 1 . . . . . 59 ARG CB . 27542 1
242 . 1 1 59 59 ARG N N 15 124.3019 0.0345 . 1 . . . . . 59 ARG N . 27542 1
243 . 1 1 60 60 ILE H H 1 8.5422 0.0036 . 1 . . . . . 60 ILE H . 27542 1
244 . 1 1 60 60 ILE CA C 13 58.9822 0.0252 . 1 . . . . . 60 ILE CA . 27542 1
245 . 1 1 60 60 ILE CB C 13 43.1342 0.1309 . 1 . . . . . 60 ILE CB . 27542 1
246 . 1 1 60 60 ILE N N 15 119.5313 0.0952 . 1 . . . . . 60 ILE N . 27542 1
247 . 1 1 61 61 ARG H H 1 8.1483 0.0033 . 1 . . . . . 61 ARG H . 27542 1
248 . 1 1 61 61 ARG CA C 13 56.1881 0.0621 . 1 . . . . . 61 ARG CA . 27542 1
249 . 1 1 61 61 ARG CB C 13 30.3362 0.0771 . 1 . . . . . 61 ARG CB . 27542 1
250 . 1 1 61 61 ARG N N 15 120.3825 0.0538 . 1 . . . . . 61 ARG N . 27542 1
251 . 1 1 62 62 CYS H H 1 8.2556 0.0092 . 1 . . . . . 62 CYS H . 27542 1
252 . 1 1 62 62 CYS CA C 13 52.9052 . . 1 . . . . . 62 CYS CA . 27542 1
253 . 1 1 62 62 CYS CB C 13 40.9021 . . 1 . . . . . 62 CYS CB . 27542 1
254 . 1 1 62 62 CYS N N 15 126.2032 0.1118 . 1 . . . . . 62 CYS N . 27542 1
255 . 1 1 63 63 PRO CA C 13 65.1837 0.0123 . 1 . . . . . 63 PRO CA . 27542 1
256 . 1 1 63 63 PRO CB C 13 32.7297 0.0614 . 1 . . . . . 63 PRO CB . 27542 1
257 . 1 1 64 64 ARG H H 1 10.4790 0.0044 . 1 . . . . . 64 ARG H . 27542 1
258 . 1 1 64 64 ARG CA C 13 56.7731 0.0732 . 1 . . . . . 64 ARG CA . 27542 1
259 . 1 1 64 64 ARG CB C 13 29.3892 0.0064 . 1 . . . . . 64 ARG CB . 27542 1
260 . 1 1 64 64 ARG N N 15 118.4467 0.0588 . 1 . . . . . 64 ARG N . 27542 1
261 . 1 1 65 65 ASN H H 1 8.4420 0.0044 . 1 . . . . . 65 ASN H . 27542 1
262 . 1 1 65 65 ASN CA C 13 52.4959 0.0146 . 1 . . . . . 65 ASN CA . 27542 1
263 . 1 1 65 65 ASN CB C 13 37.4834 0.0446 . 1 . . . . . 65 ASN CB . 27542 1
264 . 1 1 65 65 ASN N N 15 119.2923 0.0598 . 1 . . . . . 65 ASN N . 27542 1
265 . 1 1 66 66 ARG H H 1 8.1096 0.0069 . 1 . . . . . 66 ARG H . 27542 1
266 . 1 1 66 66 ARG CA C 13 58.1169 0.0841 . 1 . . . . . 66 ARG CA . 27542 1
267 . 1 1 66 66 ARG CB C 13 29.8887 0.1115 . 1 . . . . . 66 ARG CB . 27542 1
268 . 1 1 66 66 ARG N N 15 120.0385 0.0740 . 1 . . . . . 66 ARG N . 27542 1
269 . 1 1 67 67 THR H H 1 7.7472 0.0037 . 1 . . . . . 67 THR H . 27542 1
270 . 1 1 67 67 THR CA C 13 62.9019 0.0229 . 1 . . . . . 67 THR CA . 27542 1
271 . 1 1 67 67 THR CB C 13 69.1065 0.0635 . 1 . . . . . 67 THR CB . 27542 1
272 . 1 1 67 67 THR N N 15 109.3185 0.0877 . 1 . . . . . 67 THR N . 27542 1
273 . 1 1 68 68 LEU H H 1 7.9390 0.0037 . 1 . . . . . 68 LEU H . 27542 1
274 . 1 1 68 68 LEU CA C 13 54.3292 0.0075 . 1 . . . . . 68 LEU CA . 27542 1
275 . 1 1 68 68 LEU CB C 13 43.7477 0.0462 . 1 . . . . . 68 LEU CB . 27542 1
276 . 1 1 68 68 LEU N N 15 122.8855 0.0485 . 1 . . . . . 68 LEU N . 27542 1
277 . 1 1 69 69 HIS H H 1 8.9087 0.0041 . 1 . . . . . 69 HIS H . 27542 1
278 . 1 1 69 69 HIS CA C 13 54.3990 0.0249 . 1 . . . . . 69 HIS CA . 27542 1
279 . 1 1 69 69 HIS CB C 13 30.0188 0.0782 . 1 . . . . . 69 HIS CB . 27542 1
280 . 1 1 69 69 HIS N N 15 119.8448 0.0335 . 1 . . . . . 69 HIS N . 27542 1
281 . 1 1 70 70 ASN H H 1 8.5607 0.0108 . 1 . . . . . 70 ASN H . 27542 1
282 . 1 1 70 70 ASN CA C 13 51.9941 0.0574 . 1 . . . . . 70 ASN CA . 27542 1
283 . 1 1 70 70 ASN CB C 13 37.3257 0.0490 . 1 . . . . . 70 ASN CB . 27542 1
284 . 1 1 70 70 ASN N N 15 117.6969 0.0467 . 1 . . . . . 70 ASN N . 27542 1
285 . 1 1 71 71 CYS H H 1 7.5673 0.0071 . 1 . . . . . 71 CYS H . 27542 1
286 . 1 1 71 71 CYS CA C 13 60.5185 0.0035 . 1 . . . . . 71 CYS CA . 27542 1
287 . 1 1 71 71 CYS CB C 13 47.2017 0.0950 . 1 . . . . . 71 CYS CB . 27542 1
288 . 1 1 71 71 CYS N N 15 116.1917 0.0425 . 1 . . . . . 71 CYS N . 27542 1
289 . 1 1 72 72 HIS H H 1 8.5034 0.0084 . 1 . . . . . 72 HIS H . 27542 1
290 . 1 1 72 72 HIS CA C 13 55.3516 0.0357 . 1 . . . . . 72 HIS CA . 27542 1
291 . 1 1 72 72 HIS CB C 13 33.6627 0.0273 . 1 . . . . . 72 HIS CB . 27542 1
292 . 1 1 72 72 HIS N N 15 116.0074 0.0606 . 1 . . . . . 72 HIS N . 27542 1
293 . 1 1 73 73 ARG H H 1 9.7961 0.0042 . 1 . . . . . 73 ARG H . 27542 1
294 . 1 1 73 73 ARG CA C 13 53.7127 0.0619 . 1 . . . . . 73 ARG CA . 27542 1
295 . 1 1 73 73 ARG CB C 13 32.9295 0.1103 . 1 . . . . . 73 ARG CB . 27542 1
296 . 1 1 73 73 ARG N N 15 126.5166 0.0396 . 1 . . . . . 73 ARG N . 27542 1
297 . 1 1 74 74 SER H H 1 9.0789 0.0030 . 1 . . . . . 74 SER H . 27542 1
298 . 1 1 74 74 SER CA C 13 59.2849 0.0066 . 1 . . . . . 74 SER CA . 27542 1
299 . 1 1 74 74 SER CB C 13 63.3767 0.0275 . 1 . . . . . 74 SER CB . 27542 1
300 . 1 1 74 74 SER N N 15 124.7505 0.0260 . 1 . . . . . 74 SER N . 27542 1
301 . 1 1 75 75 ARG H H 1 8.9392 0.0071 . 1 . . . . . 75 ARG H . 27542 1
302 . 1 1 75 75 ARG CA C 13 57.4456 0.0375 . 1 . . . . . 75 ARG CA . 27542 1
303 . 1 1 75 75 ARG CB C 13 30.5097 0.0495 . 1 . . . . . 75 ARG CB . 27542 1
304 . 1 1 75 75 ARG N N 15 121.7338 0.0405 . 1 . . . . . 75 ARG N . 27542 1
305 . 1 1 76 76 TYR H H 1 7.5844 0.0026 . 1 . . . . . 76 TYR H . 27542 1
306 . 1 1 76 76 TYR CA C 13 54.9368 0.0116 . 1 . . . . . 76 TYR CA . 27542 1
307 . 1 1 76 76 TYR CB C 13 41.1580 0.0178 . 1 . . . . . 76 TYR CB . 27542 1
308 . 1 1 76 76 TYR N N 15 113.7964 0.0219 . 1 . . . . . 76 TYR N . 27542 1
309 . 1 1 77 77 ARG H H 1 8.5964 0.0019 . 1 . . . . . 77 ARG H . 27542 1
310 . 1 1 77 77 ARG CA C 13 55.5586 0.0447 . 1 . . . . . 77 ARG CA . 27542 1
311 . 1 1 77 77 ARG CB C 13 31.3702 0.0480 . 1 . . . . . 77 ARG CB . 27542 1
312 . 1 1 77 77 ARG N N 15 121.7193 0.0232 . 1 . . . . . 77 ARG N . 27542 1
313 . 1 1 78 78 VAL H H 1 8.5043 0.0038 . 1 . . . . . 78 VAL H . 27542 1
314 . 1 1 78 78 VAL CA C 13 57.4035 . . 1 . . . . . 78 VAL CA . 27542 1
315 . 1 1 78 78 VAL CB C 13 34.1564 . . 1 . . . . . 78 VAL CB . 27542 1
316 . 1 1 78 78 VAL N N 15 117.7499 0.0221 . 1 . . . . . 78 VAL N . 27542 1
317 . 1 1 79 79 PRO CA C 13 62.0047 0.0142 . 1 . . . . . 79 PRO CA . 27542 1
318 . 1 1 79 79 PRO CB C 13 31.6426 0.0090 . 1 . . . . . 79 PRO CB . 27542 1
319 . 1 1 80 80 LEU H H 1 8.8167 0.0039 . 1 . . . . . 80 LEU H . 27542 1
320 . 1 1 80 80 LEU CA C 13 53.7938 0.0208 . 1 . . . . . 80 LEU CA . 27542 1
321 . 1 1 80 80 LEU CB C 13 45.6069 0.0195 . 1 . . . . . 80 LEU CB . 27542 1
322 . 1 1 80 80 LEU N N 15 116.2443 0.0175 . 1 . . . . . 80 LEU N . 27542 1
323 . 1 1 81 81 LEU H H 1 9.3840 0.0035 . 1 . . . . . 81 LEU H . 27542 1
324 . 1 1 81 81 LEU CA C 13 54.7749 0.0050 . 1 . . . . . 81 LEU CA . 27542 1
325 . 1 1 81 81 LEU CB C 13 46.0518 0.0759 . 1 . . . . . 81 LEU CB . 27542 1
326 . 1 1 81 81 LEU N N 15 124.2934 0.0221 . 1 . . . . . 81 LEU N . 27542 1
327 . 1 1 82 82 HIS H H 1 8.3306 0.0029 . 1 . . . . . 82 HIS H . 27542 1
328 . 1 1 82 82 HIS CA C 13 55.3665 0.1373 . 1 . . . . . 82 HIS CA . 27542 1
329 . 1 1 82 82 HIS CB C 13 30.8722 0.0412 . 1 . . . . . 82 HIS CB . 27542 1
330 . 1 1 82 82 HIS N N 15 127.3827 0.0079 . 1 . . . . . 82 HIS N . 27542 1
331 . 1 1 83 83 CYS H H 1 8.4001 0.0054 . 1 . . . . . 83 CYS H . 27542 1
332 . 1 1 83 83 CYS CA C 13 51.8132 0.0096 . 1 . . . . . 83 CYS CA . 27542 1
333 . 1 1 83 83 CYS CB C 13 39.8378 0.0506 . 1 . . . . . 83 CYS CB . 27542 1
334 . 1 1 83 83 CYS N N 15 123.3785 0.0453 . 1 . . . . . 83 CYS N . 27542 1
335 . 1 1 84 84 ASP H H 1 8.3425 0.0035 . 1 . . . . . 84 ASP H . 27542 1
336 . 1 1 84 84 ASP CA C 13 53.9901 0.0390 . 1 . . . . . 84 ASP CA . 27542 1
337 . 1 1 84 84 ASP CB C 13 45.3205 0.0300 . 1 . . . . . 84 ASP CB . 27542 1
338 . 1 1 84 84 ASP N N 15 121.8248 0.0174 . 1 . . . . . 84 ASP N . 27542 1
339 . 1 1 85 85 LEU H H 1 8.7341 0.0027 . 1 . . . . . 85 LEU H . 27542 1
340 . 1 1 85 85 LEU CA C 13 56.0146 0.0161 . 1 . . . . . 85 LEU CA . 27542 1
341 . 1 1 85 85 LEU CB C 13 42.7972 0.0568 . 1 . . . . . 85 LEU CB . 27542 1
342 . 1 1 85 85 LEU N N 15 127.1673 0.0271 . 1 . . . . . 85 LEU N . 27542 1
343 . 1 1 86 86 ILE H H 1 8.9131 0.0028 . 1 . . . . . 86 ILE H . 27542 1
344 . 1 1 86 86 ILE CA C 13 62.7796 0.0312 . 1 . . . . . 86 ILE CA . 27542 1
345 . 1 1 86 86 ILE CB C 13 39.0110 0.0374 . 1 . . . . . 86 ILE CB . 27542 1
346 . 1 1 86 86 ILE N N 15 126.5941 0.0247 . 1 . . . . . 86 ILE N . 27542 1
347 . 1 1 87 87 ASN H H 1 8.4642 0.0021 . 1 . . . . . 87 ASN H . 27542 1
348 . 1 1 87 87 ASN HD21 H 1 7.0303 . . 1 . . . . . 87 ASN HD21 . 27542 1
349 . 1 1 87 87 ASN HD22 H 1 7.5172 . . 1 . . . . . 87 ASN HD22 . 27542 1
350 . 1 1 87 87 ASN CA C 13 51.2735 . . 1 . . . . . 87 ASN CA . 27542 1
351 . 1 1 87 87 ASN CB C 13 36.7235 . . 1 . . . . . 87 ASN CB . 27542 1
352 . 1 1 87 87 ASN N N 15 115.8642 0.0339 . 1 . . . . . 87 ASN N . 27542 1
353 . 1 1 87 87 ASN ND2 N 15 109.3970 0.0281 . 1 . . . . . 87 ASN ND2 . 27542 1
354 . 1 1 88 88 PRO CA C 13 63.9096 0.0074 . 1 . . . . . 88 PRO CA . 27542 1
355 . 1 1 88 88 PRO CB C 13 31.7813 0.0192 . 1 . . . . . 88 PRO CB . 27542 1
356 . 1 1 89 89 GLY H H 1 8.6419 0.0036 . 1 . . . . . 89 GLY H . 27542 1
357 . 1 1 89 89 GLY CA C 13 44.8980 0.0099 . 1 . . . . . 89 GLY CA . 27542 1
358 . 1 1 89 89 GLY N N 15 109.0107 0.0221 . 1 . . . . . 89 GLY N . 27542 1
359 . 1 1 90 90 ALA H H 1 7.6654 0.0036 . 1 . . . . . 90 ALA H . 27542 1
360 . 1 1 90 90 ALA CA C 13 53.2676 0.0219 . 1 . . . . . 90 ALA CA . 27542 1
361 . 1 1 90 90 ALA CB C 13 19.2335 0.0183 . 1 . . . . . 90 ALA CB . 27542 1
362 . 1 1 90 90 ALA N N 15 124.2531 0.0193 . 1 . . . . . 90 ALA N . 27542 1
363 . 1 1 91 91 GLN H H 1 8.5273 0.0016 . 1 . . . . . 91 GLN H . 27542 1
364 . 1 1 91 91 GLN HE21 H 1 6.8716 . . 1 . . . . . 91 GLN HE21 . 27542 1
365 . 1 1 91 91 GLN HE22 H 1 7.4714 . . 1 . . . . . 91 GLN HE22 . 27542 1
366 . 1 1 91 91 GLN CA C 13 57.0008 0.0285 . 1 . . . . . 91 GLN CA . 27542 1
367 . 1 1 91 91 GLN CB C 13 29.5724 0.0322 . 1 . . . . . 91 GLN CB . 27542 1
368 . 1 1 91 91 GLN N N 15 120.7944 0.0271 . 1 . . . . . 91 GLN N . 27542 1
369 . 1 1 91 91 GLN NE2 N 15 112.6388 0.0011 . 1 . . . . . 91 GLN NE2 . 27542 1
370 . 1 1 92 92 ASN H H 1 7.7494 0.0029 . 1 . . . . . 92 ASN H . 27542 1
371 . 1 1 92 92 ASN HD21 H 1 7.0443 . . 1 . . . . . 92 ASN HD21 . 27542 1
372 . 1 1 92 92 ASN HD22 H 1 7.7447 . . 1 . . . . . 92 ASN HD22 . 27542 1
373 . 1 1 92 92 ASN CA C 13 52.0454 0.0218 . 1 . . . . . 92 ASN CA . 27542 1
374 . 1 1 92 92 ASN CB C 13 39.6907 0.0402 . 1 . . . . . 92 ASN CB . 27542 1
375 . 1 1 92 92 ASN N N 15 115.5346 0.0240 . 1 . . . . . 92 ASN N . 27542 1
376 . 1 1 92 92 ASN ND2 N 15 113.9835 0.0123 . 1 . . . . . 92 ASN ND2 . 27542 1
377 . 1 1 93 93 ILE H H 1 8.7013 0.0020 . 1 . . . . . 93 ILE H . 27542 1
378 . 1 1 93 93 ILE CA C 13 64.0140 0.0644 . 1 . . . . . 93 ILE CA . 27542 1
379 . 1 1 93 93 ILE CB C 13 38.5469 0.0863 . 1 . . . . . 93 ILE CB . 27542 1
380 . 1 1 93 93 ILE N N 15 121.7915 0.0281 . 1 . . . . . 93 ILE N . 27542 1
381 . 1 1 94 94 SER H H 1 8.5042 0.0040 . 1 . . . . . 94 SER H . 27542 1
382 . 1 1 94 94 SER CA C 13 60.8866 0.0506 . 1 . . . . . 94 SER CA . 27542 1
383 . 1 1 94 94 SER CB C 13 62.8510 0.0759 . 1 . . . . . 94 SER CB . 27542 1
384 . 1 1 94 94 SER N N 15 116.4085 0.0570 . 1 . . . . . 94 SER N . 27542 1
385 . 1 1 95 95 THR H H 1 7.9736 0.0022 . 1 . . . . . 95 THR H . 27542 1
386 . 1 1 95 95 THR CA C 13 61.5999 0.0422 . 1 . . . . . 95 THR CA . 27542 1
387 . 1 1 95 95 THR CB C 13 69.5926 0.0347 . 1 . . . . . 95 THR CB . 27542 1
388 . 1 1 95 95 THR N N 15 111.2152 0.0205 . 1 . . . . . 95 THR N . 27542 1
389 . 1 1 96 96 CYS H H 1 7.3889 0.0025 . 1 . . . . . 96 CYS H . 27542 1
390 . 1 1 96 96 CYS CA C 13 56.2081 0.0475 . 1 . . . . . 96 CYS CA . 27542 1
391 . 1 1 96 96 CYS CB C 13 42.5878 0.0242 . 1 . . . . . 96 CYS CB . 27542 1
392 . 1 1 96 96 CYS N N 15 121.7941 0.0232 . 1 . . . . . 96 CYS N . 27542 1
393 . 1 1 97 97 ARG H H 1 9.8750 0.0022 . 1 . . . . . 97 ARG H . 27542 1
394 . 1 1 97 97 ARG CA C 13 55.2667 0.0554 . 1 . . . . . 97 ARG CA . 27542 1
395 . 1 1 97 97 ARG CB C 13 33.4987 0.0265 . 1 . . . . . 97 ARG CB . 27542 1
396 . 1 1 97 97 ARG N N 15 128.4860 0.0242 . 1 . . . . . 97 ARG N . 27542 1
397 . 1 1 98 98 TYR H H 1 8.3806 0.0026 . 1 . . . . . 98 TYR H . 27542 1
398 . 1 1 98 98 TYR CA C 13 56.3893 0.0058 . 1 . . . . . 98 TYR CA . 27542 1
399 . 1 1 98 98 TYR CB C 13 44.5362 0.0211 . 1 . . . . . 98 TYR CB . 27542 1
400 . 1 1 98 98 TYR N N 15 118.2704 0.1225 . 1 . . . . . 98 TYR N . 27542 1
401 . 1 1 99 99 ALA H H 1 9.4774 0.0019 . 1 . . . . . 99 ALA H . 27542 1
402 . 1 1 99 99 ALA CA C 13 51.0396 0.0248 . 1 . . . . . 99 ALA CA . 27542 1
403 . 1 1 99 99 ALA CB C 13 20.4058 0.0222 . 1 . . . . . 99 ALA CB . 27542 1
404 . 1 1 99 99 ALA N N 15 126.1054 0.0316 . 1 . . . . . 99 ALA N . 27542 1
405 . 1 1 100 100 ASP H H 1 8.3224 0.0013 . 1 . . . . . 100 ASP H . 27542 1
406 . 1 1 100 100 ASP CA C 13 54.9203 0.0270 . 1 . . . . . 100 ASP CA . 27542 1
407 . 1 1 100 100 ASP CB C 13 43.7398 0.0182 . 1 . . . . . 100 ASP CB . 27542 1
408 . 1 1 100 100 ASP N N 15 120.9119 0.0326 . 1 . . . . . 100 ASP N . 27542 1
409 . 1 1 101 101 ARG H H 1 9.2314 0.0028 . 1 . . . . . 101 ARG H . 27542 1
410 . 1 1 101 101 ARG CA C 13 53.3951 . . 1 . . . . . 101 ARG CA . 27542 1
411 . 1 1 101 101 ARG CB C 13 31.8670 . . 1 . . . . . 101 ARG CB . 27542 1
412 . 1 1 101 101 ARG N N 15 122.4886 0.0248 . 1 . . . . . 101 ARG N . 27542 1
413 . 1 1 102 102 PRO CA C 13 62.6407 0.0171 . 1 . . . . . 102 PRO CA . 27542 1
414 . 1 1 102 102 PRO CB C 13 33.0033 0.0320 . 1 . . . . . 102 PRO CB . 27542 1
415 . 1 1 103 103 GLY H H 1 8.0676 0.0025 . 1 . . . . . 103 GLY H . 27542 1
416 . 1 1 103 103 GLY CA C 13 45.6759 0.0103 . 1 . . . . . 103 GLY CA . 27542 1
417 . 1 1 103 103 GLY N N 15 105.8361 0.0234 . 1 . . . . . 103 GLY N . 27542 1
418 . 1 1 104 104 ARG H H 1 8.6732 0.0030 . 1 . . . . . 104 ARG H . 27542 1
419 . 1 1 104 104 ARG CA C 13 56.4760 0.0654 . 1 . . . . . 104 ARG CA . 27542 1
420 . 1 1 104 104 ARG CB C 13 31.5723 0.0267 . 1 . . . . . 104 ARG CB . 27542 1
421 . 1 1 104 104 ARG N N 15 123.3551 0.0080 . 1 . . . . . 104 ARG N . 27542 1
422 . 1 1 105 105 ARG H H 1 8.1342 0.0032 . 1 . . . . . 105 ARG H . 27542 1
423 . 1 1 105 105 ARG CA C 13 55.0825 0.0365 . 1 . . . . . 105 ARG CA . 27542 1
424 . 1 1 105 105 ARG CB C 13 37.4362 0.0408 . 1 . . . . . 105 ARG CB . 27542 1
425 . 1 1 105 105 ARG N N 15 122.1648 0.0937 . 1 . . . . . 105 ARG N . 27542 1
426 . 1 1 106 106 PHE H H 1 8.7571 0.0018 . 1 . . . . . 106 PHE H . 27542 1
427 . 1 1 106 106 PHE CA C 13 58.8178 0.0334 . 1 . . . . . 106 PHE CA . 27542 1
428 . 1 1 106 106 PHE CB C 13 39.6463 0.1732 . 1 . . . . . 106 PHE CB . 27542 1
429 . 1 1 106 106 PHE N N 15 119.2209 0.0283 . 1 . . . . . 106 PHE N . 27542 1
430 . 1 1 107 107 TYR H H 1 8.5119 0.0059 . 1 . . . . . 107 TYR H . 27542 1
431 . 1 1 107 107 TYR CA C 13 55.4482 . . 1 . . . . . 107 TYR CA . 27542 1
432 . 1 1 107 107 TYR CB C 13 42.3029 0.0394 . 1 . . . . . 107 TYR CB . 27542 1
433 . 1 1 107 107 TYR N N 15 114.9277 0.1508 . 1 . . . . . 107 TYR N . 27542 1
434 . 1 1 108 108 VAL H H 1 8.3604 0.0065 . 1 . . . . . 108 VAL H . 27542 1
435 . 1 1 108 108 VAL CA C 13 60.5154 0.0308 . 1 . . . . . 108 VAL CA . 27542 1
436 . 1 1 108 108 VAL CB C 13 33.9691 0.0037 . 1 . . . . . 108 VAL CB . 27542 1
437 . 1 1 108 108 VAL N N 15 118.9980 0.0479 . 1 . . . . . 108 VAL N . 27542 1
438 . 1 1 109 109 VAL H H 1 8.7958 0.0036 . 1 . . . . . 109 VAL H . 27542 1
439 . 1 1 109 109 VAL CA C 13 57.6333 0.0197 . 1 . . . . . 109 VAL CA . 27542 1
440 . 1 1 109 109 VAL CB C 13 34.4675 0.0796 . 1 . . . . . 109 VAL CB . 27542 1
441 . 1 1 109 109 VAL N N 15 118.0195 0.0486 . 1 . . . . . 109 VAL N . 27542 1
442 . 1 1 110 110 ALA H H 1 8.7285 0.0082 . 1 . . . . . 110 ALA H . 27542 1
443 . 1 1 110 110 ALA CA C 13 51.0371 0.0159 . 1 . . . . . 110 ALA CA . 27542 1
444 . 1 1 110 110 ALA CB C 13 20.4582 0.0259 . 1 . . . . . 110 ALA CB . 27542 1
445 . 1 1 110 110 ALA N N 15 125.1092 0.0587 . 1 . . . . . 110 ALA N . 27542 1
446 . 1 1 111 111 CYS H H 1 8.3968 0.0041 . 1 . . . . . 111 CYS H . 27542 1
447 . 1 1 111 111 CYS CA C 13 55.2209 0.0185 . 1 . . . . . 111 CYS CA . 27542 1
448 . 1 1 111 111 CYS CB C 13 48.9600 0.0748 . 1 . . . . . 111 CYS CB . 27542 1
449 . 1 1 111 111 CYS N N 15 117.6933 0.0324 . 1 . . . . . 111 CYS N . 27542 1
450 . 1 1 112 112 GLU H H 1 9.0238 0.0017 . 1 . . . . . 112 GLU H . 27542 1
451 . 1 1 112 112 GLU CA C 13 54.6342 0.0126 . 1 . . . . . 112 GLU CA . 27542 1
452 . 1 1 112 112 GLU CB C 13 35.0488 0.0252 . 1 . . . . . 112 GLU CB . 27542 1
453 . 1 1 112 112 GLU N N 15 120.6868 0.0383 . 1 . . . . . 112 GLU N . 27542 1
454 . 1 1 113 113 SER H H 1 8.6799 0.0017 . 1 . . . . . 113 SER H . 27542 1
455 . 1 1 113 113 SER CA C 13 60.1283 0.0452 . 1 . . . . . 113 SER CA . 27542 1
456 . 1 1 113 113 SER CB C 13 63.4817 0.0408 . 1 . . . . . 113 SER CB . 27542 1
457 . 1 1 113 113 SER N N 15 115.7921 0.0167 . 1 . . . . . 113 SER N . 27542 1
458 . 1 1 114 114 ARG H H 1 7.9915 0.0020 . 1 . . . . . 114 ARG H . 27542 1
459 . 1 1 114 114 ARG CA C 13 56.3241 0.0570 . 1 . . . . . 114 ARG CA . 27542 1
460 . 1 1 114 114 ARG CB C 13 29.3724 0.0438 . 1 . . . . . 114 ARG CB . 27542 1
461 . 1 1 114 114 ARG N N 15 120.4918 0.0243 . 1 . . . . . 114 ARG N . 27542 1
462 . 1 1 115 115 ASP H H 1 9.4924 0.0041 . 1 . . . . . 115 ASP H . 27542 1
463 . 1 1 115 115 ASP CA C 13 52.2602 . . 1 . . . . . 115 ASP CA . 27542 1
464 . 1 1 115 115 ASP CB C 13 44.5038 . . 1 . . . . . 115 ASP CB . 27542 1
465 . 1 1 115 115 ASP N N 15 126.0228 0.0295 . 1 . . . . . 115 ASP N . 27542 1
466 . 1 1 116 116 PRO CA C 13 65.5139 0.0062 . 1 . . . . . 116 PRO CA . 27542 1
467 . 1 1 116 116 PRO CB C 13 32.1602 0.0020 . 1 . . . . . 116 PRO CB . 27542 1
468 . 1 1 117 117 ARG H H 1 9.6310 0.0028 . 1 . . . . . 117 ARG H . 27542 1
469 . 1 1 117 117 ARG CA C 13 56.7464 0.1408 . 1 . . . . . 117 ARG CA . 27542 1
470 . 1 1 117 117 ARG CB C 13 30.6659 0.0337 . 1 . . . . . 117 ARG CB . 27542 1
471 . 1 1 117 117 ARG N N 15 114.7886 0.0173 . 1 . . . . . 117 ARG N . 27542 1
472 . 1 1 118 118 ASP H H 1 8.2476 0.0022 . 1 . . . . . 118 ASP H . 27542 1
473 . 1 1 118 118 ASP CA C 13 55.2264 0.0550 . 1 . . . . . 118 ASP CA . 27542 1
474 . 1 1 118 118 ASP CB C 13 43.0004 0.0187 . 1 . . . . . 118 ASP CB . 27542 1
475 . 1 1 118 118 ASP N N 15 119.8235 0.1039 . 1 . . . . . 118 ASP N . 27542 1
476 . 1 1 119 119 SER H H 1 8.3820 0.0023 . 1 . . . . . 119 SER H . 27542 1
477 . 1 1 119 119 SER CA C 13 56.2962 . . 1 . . . . . 119 SER CA . 27542 1
478 . 1 1 119 119 SER CB C 13 64.0200 . . 1 . . . . . 119 SER CB . 27542 1
479 . 1 1 119 119 SER N N 15 114.1225 0.0349 . 1 . . . . . 119 SER N . 27542 1
480 . 1 1 120 120 PRO CA C 13 63.5747 0.0266 . 1 . . . . . 120 PRO CA . 27542 1
481 . 1 1 120 120 PRO CB C 13 31.8987 0.0093 . 1 . . . . . 120 PRO CB . 27542 1
482 . 1 1 121 121 ARG H H 1 7.7440 0.0029 . 1 . . . . . 121 ARG H . 27542 1
483 . 1 1 121 121 ARG CA C 13 58.1444 0.0211 . 1 . . . . . 121 ARG CA . 27542 1
484 . 1 1 121 121 ARG CB C 13 30.3978 0.0347 . 1 . . . . . 121 ARG CB . 27542 1
485 . 1 1 121 121 ARG N N 15 116.6240 0.0112 . 1 . . . . . 121 ARG N . 27542 1
486 . 1 1 122 122 TYR H H 1 6.6858 0.0043 . 1 . . . . . 122 TYR H . 27542 1
487 . 1 1 122 122 TYR CA C 13 53.3023 . . 1 . . . . . 122 TYR CA . 27542 1
488 . 1 1 122 122 TYR CB C 13 38.5429 . . 1 . . . . . 122 TYR CB . 27542 1
489 . 1 1 122 122 TYR N N 15 113.5740 0.0131 . 1 . . . . . 122 TYR N . 27542 1
490 . 1 1 123 123 PRO CA C 13 64.9319 0.0010 . 1 . . . . . 123 PRO CA . 27542 1
491 . 1 1 123 123 PRO CB C 13 32.5819 0.0466 . 1 . . . . . 123 PRO CB . 27542 1
492 . 1 1 124 124 VAL H H 1 7.4045 0.0077 . 1 . . . . . 124 VAL H . 27542 1
493 . 1 1 124 124 VAL CA C 13 60.7614 0.0160 . 1 . . . . . 124 VAL CA . 27542 1
494 . 1 1 124 124 VAL CB C 13 34.3368 0.0155 . 1 . . . . . 124 VAL CB . 27542 1
495 . 1 1 124 124 VAL N N 15 116.0707 0.0531 . 1 . . . . . 124 VAL N . 27542 1
496 . 1 1 125 125 VAL H H 1 9.0831 0.0030 . 1 . . . . . 125 VAL H . 27542 1
497 . 1 1 125 125 VAL CA C 13 56.5541 . . 1 . . . . . 125 VAL CA . 27542 1
498 . 1 1 125 125 VAL CB C 13 34.1954 . . 1 . . . . . 125 VAL CB . 27542 1
499 . 1 1 125 125 VAL N N 15 115.2868 0.0135 . 1 . . . . . 125 VAL N . 27542 1
500 . 1 1 126 126 PRO CA C 13 61.3737 0.0374 . 1 . . . . . 126 PRO CA . 27542 1
501 . 1 1 126 126 PRO CB C 13 30.8945 0.0027 . 1 . . . . . 126 PRO CB . 27542 1
502 . 1 1 127 127 VAL H H 1 8.4145 0.0066 . 1 . . . . . 127 VAL H . 27542 1
503 . 1 1 127 127 VAL CA C 13 60.1684 0.0565 . 1 . . . . . 127 VAL CA . 27542 1
504 . 1 1 127 127 VAL CB C 13 34.6264 0.0842 . 1 . . . . . 127 VAL CB . 27542 1
505 . 1 1 127 127 VAL N N 15 105.3713 0.0249 . 1 . . . . . 127 VAL N . 27542 1
506 . 1 1 128 128 HIS H H 1 7.3989 0.0070 . 1 . . . . . 128 HIS H . 27542 1
507 . 1 1 128 128 HIS CA C 13 55.9485 0.0207 . 1 . . . . . 128 HIS CA . 27542 1
508 . 1 1 128 128 HIS CB C 13 33.7338 0.0250 . 1 . . . . . 128 HIS CB . 27542 1
509 . 1 1 128 128 HIS N N 15 118.6065 0.0948 . 1 . . . . . 128 HIS N . 27542 1
510 . 1 1 129 129 LEU H H 1 8.9639 0.0137 . 1 . . . . . 129 LEU H . 27542 1
511 . 1 1 129 129 LEU CA C 13 53.7291 0.0522 . 1 . . . . . 129 LEU CA . 27542 1
512 . 1 1 129 129 LEU CB C 13 40.6833 0.0724 . 1 . . . . . 129 LEU CB . 27542 1
513 . 1 1 129 129 LEU N N 15 129.5390 0.1057 . 1 . . . . . 129 LEU N . 27542 1
514 . 1 1 130 130 ASP H H 1 8.8009 0.0045 . 1 . . . . . 130 ASP H . 27542 1
515 . 1 1 130 130 ASP CA C 13 58.0165 0.0947 . 1 . . . . . 130 ASP CA . 27542 1
516 . 1 1 130 130 ASP CB C 13 45.9800 0.0723 . 1 . . . . . 130 ASP CB . 27542 1
517 . 1 1 130 130 ASP N N 15 129.4579 0.0309 . 1 . . . . . 130 ASP N . 27542 1
518 . 1 1 131 131 THR H H 1 7.4400 0.0060 . 1 . . . . . 131 THR H . 27542 1
519 . 1 1 131 131 THR CA C 13 60.6345 0.0031 . 1 . . . . . 131 THR CA . 27542 1
520 . 1 1 131 131 THR CB C 13 68.6962 0.0544 . 1 . . . . . 131 THR CB . 27542 1
521 . 1 1 131 131 THR N N 15 105.2137 0.0758 . 1 . . . . . 131 THR N . 27542 1
522 . 1 1 132 132 THR H H 1 8.1045 0.0043 . 1 . . . . . 132 THR H . 27542 1
523 . 1 1 132 132 THR CA C 13 60.1132 0.0531 . 1 . . . . . 132 THR CA . 27542 1
524 . 1 1 132 132 THR CB C 13 71.4347 0.0807 . 1 . . . . . 132 THR CB . 27542 1
525 . 1 1 132 132 THR N N 15 112.2634 0.0497 . 1 . . . . . 132 THR N . 27542 1
526 . 1 1 133 133 ILE H H 1 8.4987 0.0017 . 1 . . . . . 133 ILE H . 27542 1
527 . 1 1 133 133 ILE CA C 13 64.0079 . . 1 . . . . . 133 ILE CA . 27542 1
528 . 1 1 133 133 ILE CB C 13 42.5306 . . 1 . . . . . 133 ILE CB . 27542 1
529 . 1 1 133 133 ILE N N 15 125.6248 0.0263 . 1 . . . . . 133 ILE N . 27542 1
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