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 27544
_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' . . . 27544 1
2 '3D HNCACB' . . . 27544 1
3 '3D CBCA(CO)NH' . . . 27544 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 . . 27544 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 2 2 PRO CA C 13 62.9214 0.0234 . 1 . . . . . 2 PRO CA . 27544 1
2 . 1 1 2 2 PRO CB C 13 31.9313 0.0067 . 1 . . . . . 2 PRO CB . 27544 1
3 . 1 1 3 3 ARG H H 1 8.5660 0.0035 . 1 . . . . . 3 ARG H . 27544 1
4 . 1 1 3 3 ARG CA C 13 58.1422 0.0229 . 1 . . . . . 3 ARG CA . 27544 1
5 . 1 1 3 3 ARG CB C 13 30.1914 0.0146 . 1 . . . . . 3 ARG CB . 27544 1
6 . 1 1 3 3 ARG N N 15 123.4924 0.0179 . 1 . . . . . 3 ARG N . 27544 1
7 . 1 1 4 4 GLN H H 1 8.9680 0.0033 . 1 . . . . . 4 GLN H . 27544 1
8 . 1 1 4 4 GLN CA C 13 56.5503 0.0501 . 1 . . . . . 4 GLN CA . 27544 1
9 . 1 1 4 4 GLN CB C 13 27.9085 0.0372 . 1 . . . . . 4 GLN CB . 27544 1
10 . 1 1 4 4 GLN N N 15 117.4123 0.0371 . 1 . . . . . 4 GLN N . 27544 1
11 . 1 1 5 5 PHE H H 1 7.3250 0.0035 . 1 . . . . . 5 PHE H . 27544 1
12 . 1 1 5 5 PHE CA C 13 55.4657 0.0386 . 1 . . . . . 5 PHE CA . 27544 1
13 . 1 1 5 5 PHE CB C 13 42.3272 0.0330 . 1 . . . . . 5 PHE CB . 27544 1
14 . 1 1 5 5 PHE N N 15 119.3454 0.0285 . 1 . . . . . 5 PHE N . 27544 1
15 . 1 1 6 6 THR H H 1 8.8536 0.0044 . 1 . . . . . 6 THR H . 27544 1
16 . 1 1 6 6 THR CA C 13 60.8326 0.0016 . 1 . . . . . 6 THR CA . 27544 1
17 . 1 1 6 6 THR CB C 13 69.2252 0.0648 . 1 . . . . . 6 THR CB . 27544 1
18 . 1 1 6 6 THR N N 15 112.9937 0.0280 . 1 . . . . . 6 THR N . 27544 1
19 . 1 1 7 7 ARG H H 1 8.9711 0.0037 . 1 . . . . . 7 ARG H . 27544 1
20 . 1 1 7 7 ARG CA C 13 61.4276 0.0872 . 1 . . . . . 7 ARG CA . 27544 1
21 . 1 1 7 7 ARG CB C 13 30.7641 0.0190 . 1 . . . . . 7 ARG CB . 27544 1
22 . 1 1 7 7 ARG N N 15 120.6505 0.0265 . 1 . . . . . 7 ARG N . 27544 1
23 . 1 1 8 8 ALA H H 1 10.3619 0.0037 . 1 . . . . . 8 ALA H . 27544 1
24 . 1 1 8 8 ALA CA C 13 55.3040 0.0105 . 1 . . . . . 8 ALA CA . 27544 1
25 . 1 1 8 8 ALA CB C 13 18.9114 0.0905 . 1 . . . . . 8 ALA CB . 27544 1
26 . 1 1 8 8 ALA N N 15 126.0546 0.0367 . 1 . . . . . 8 ALA N . 27544 1
27 . 1 1 9 9 GLN H H 1 8.3630 0.0049 . 1 . . . . . 9 GLN H . 27544 1
28 . 1 1 9 9 GLN CA C 13 58.4665 0.0190 . 1 . . . . . 9 GLN CA . 27544 1
29 . 1 1 9 9 GLN CB C 13 28.5720 0.0319 . 1 . . . . . 9 GLN CB . 27544 1
30 . 1 1 9 9 GLN N N 15 118.7551 0.0301 . 1 . . . . . 9 GLN N . 27544 1
31 . 1 1 10 10 TRP H H 1 8.7685 0.0038 . 1 . . . . . 10 TRP H . 27544 1
32 . 1 1 10 10 TRP HE1 H 1 10.1288 . . 1 . . . . . 10 TRP HE1 . 27544 1
33 . 1 1 10 10 TRP CA C 13 57.8562 0.1177 . 1 . . . . . 10 TRP CA . 27544 1
34 . 1 1 10 10 TRP CB C 13 31.4069 0.0783 . 1 . . . . . 10 TRP CB . 27544 1
35 . 1 1 10 10 TRP N N 15 120.5435 0.0372 . 1 . . . . . 10 TRP N . 27544 1
36 . 1 1 10 10 TRP NE1 N 15 130.1350 . . 1 . . . . . 10 TRP NE1 . 27544 1
37 . 1 1 11 11 PHE H H 1 8.7612 0.0033 . 1 . . . . . 11 PHE H . 27544 1
38 . 1 1 11 11 PHE CA C 13 61.8900 0.0183 . 1 . . . . . 11 PHE CA . 27544 1
39 . 1 1 11 11 PHE CB C 13 38.9047 0.0279 . 1 . . . . . 11 PHE CB . 27544 1
40 . 1 1 11 11 PHE N N 15 121.8096 0.0819 . 1 . . . . . 11 PHE N . 27544 1
41 . 1 1 12 12 ALA H H 1 8.3149 0.0039 . 1 . . . . . 12 ALA H . 27544 1
42 . 1 1 12 12 ALA CA C 13 55.4473 0.0025 . 1 . . . . . 12 ALA CA . 27544 1
43 . 1 1 12 12 ALA CB C 13 17.8188 0.0537 . 1 . . . . . 12 ALA CB . 27544 1
44 . 1 1 12 12 ALA N N 15 122.2731 0.0804 . 1 . . . . . 12 ALA N . 27544 1
45 . 1 1 13 13 ILE H H 1 7.6987 0.0039 . 1 . . . . . 13 ILE H . 27544 1
46 . 1 1 13 13 ILE CA C 13 64.6081 0.0249 . 1 . . . . . 13 ILE CA . 27544 1
47 . 1 1 13 13 ILE CB C 13 38.4768 0.0535 . 1 . . . . . 13 ILE CB . 27544 1
48 . 1 1 13 13 ILE N N 15 117.7284 0.0353 . 1 . . . . . 13 ILE N . 27544 1
49 . 1 1 14 14 GLN H H 1 7.2115 0.0046 . 1 . . . . . 14 GLN H . 27544 1
50 . 1 1 14 14 GLN CA C 13 58.0446 0.0204 . 1 . . . . . 14 GLN CA . 27544 1
51 . 1 1 14 14 GLN CB C 13 30.9454 0.0575 . 1 . . . . . 14 GLN CB . 27544 1
52 . 1 1 14 14 GLN N N 15 112.5633 0.0497 . 1 . . . . . 14 GLN N . 27544 1
53 . 1 1 15 15 HIS H H 1 7.7258 0.0046 . 1 . . . . . 15 HIS H . 27544 1
54 . 1 1 15 15 HIS CA C 13 54.7937 0.0789 . 1 . . . . . 15 HIS CA . 27544 1
55 . 1 1 15 15 HIS CB C 13 30.7452 0.0198 . 1 . . . . . 15 HIS CB . 27544 1
56 . 1 1 15 15 HIS N N 15 105.7482 0.0313 . 1 . . . . . 15 HIS N . 27544 1
57 . 1 1 16 16 VAL H H 1 8.2756 0.0047 . 1 . . . . . 16 VAL H . 27544 1
58 . 1 1 16 16 VAL CA C 13 62.2275 0.1091 . 1 . . . . . 16 VAL CA . 27544 1
59 . 1 1 16 16 VAL CB C 13 32.4969 0.0210 . 1 . . . . . 16 VAL CB . 27544 1
60 . 1 1 16 16 VAL N N 15 121.4905 0.1033 . 1 . . . . . 16 VAL N . 27544 1
61 . 1 1 17 17 SER H H 1 8.0304 0.0062 . 1 . . . . . 17 SER H . 27544 1
62 . 1 1 17 17 SER CA C 13 57.5946 0.0561 . 1 . . . . . 17 SER CA . 27544 1
63 . 1 1 17 17 SER CB C 13 64.2092 0.0559 . 1 . . . . . 17 SER CB . 27544 1
64 . 1 1 17 17 SER N N 15 120.9068 0.0906 . 1 . . . . . 17 SER N . 27544 1
65 . 1 1 18 18 LEU H H 1 8.4517 0.0033 . 1 . . . . . 18 LEU H . 27544 1
66 . 1 1 18 18 LEU CA C 13 58.3781 0.0964 . 1 . . . . . 18 LEU CA . 27544 1
67 . 1 1 18 18 LEU CB C 13 43.1525 0.0188 . 1 . . . . . 18 LEU CB . 27544 1
68 . 1 1 18 18 LEU N N 15 128.2079 0.0229 . 1 . . . . . 18 LEU N . 27544 1
69 . 1 1 19 19 ASN H H 1 8.3503 0.0025 . 1 . . . . . 19 ASN H . 27544 1
70 . 1 1 19 19 ASN CA C 13 51.0028 . . 1 . . . . . 19 ASN CA . 27544 1
71 . 1 1 19 19 ASN CB C 13 39.7482 . . 1 . . . . . 19 ASN CB . 27544 1
72 . 1 1 19 19 ASN N N 15 114.9797 0.0518 . 1 . . . . . 19 ASN N . 27544 1
73 . 1 1 21 21 PRO CA C 13 61.6331 0.0540 . 1 . . . . . 21 PRO CA . 27544 1
74 . 1 1 21 21 PRO CB C 13 31.8980 0.0042 . 1 . . . . . 21 PRO CB . 27544 1
75 . 1 1 22 22 GLN H H 1 7.8025 0.0012 . 1 . . . . . 22 GLN H . 27544 1
76 . 1 1 22 22 GLN CA C 13 56.5011 0.0198 . 1 . . . . . 22 GLN CA . 27544 1
77 . 1 1 22 22 GLN CB C 13 29.0232 0.0360 . 1 . . . . . 22 GLN CB . 27544 1
78 . 1 1 22 22 GLN N N 15 112.6825 0.0624 . 1 . . . . . 22 GLN N . 27544 1
79 . 1 1 23 23 CYS H H 1 10.9125 0.0035 . 1 . . . . . 23 CYS H . 27544 1
80 . 1 1 23 23 CYS CA C 13 62.6209 0.0579 . 1 . . . . . 23 CYS CA . 27544 1
81 . 1 1 23 23 CYS CB C 13 42.0871 0.0700 . 1 . . . . . 23 CYS CB . 27544 1
82 . 1 1 23 23 CYS N N 15 123.8317 0.0264 . 1 . . . . . 23 CYS N . 27544 1
83 . 1 1 24 24 THR H H 1 9.9064 0.0049 . 1 . . . . . 24 THR H . 27544 1
84 . 1 1 24 24 THR CA C 13 68.1082 0.1839 . 1 . . . . . 24 THR CA . 27544 1
85 . 1 1 24 24 THR CB C 13 69.0054 0.0389 . 1 . . . . . 24 THR CB . 27544 1
86 . 1 1 24 24 THR N N 15 117.5447 0.0484 . 1 . . . . . 24 THR N . 27544 1
87 . 1 1 25 25 THR H H 1 7.3174 0.0041 . 1 . . . . . 25 THR H . 27544 1
88 . 1 1 25 25 THR CA C 13 65.8169 0.0507 . 1 . . . . . 25 THR CA . 27544 1
89 . 1 1 25 25 THR CB C 13 68.8928 0.0306 . 1 . . . . . 25 THR CB . 27544 1
90 . 1 1 25 25 THR N N 15 115.9096 0.0374 . 1 . . . . . 25 THR N . 27544 1
91 . 1 1 26 26 ALA H H 1 8.8566 0.0042 . 1 . . . . . 26 ALA H . 27544 1
92 . 1 1 26 26 ALA CA C 13 54.8448 0.0511 . 1 . . . . . 26 ALA CA . 27544 1
93 . 1 1 26 26 ALA CB C 13 18.8958 0.0505 . 1 . . . . . 26 ALA CB . 27544 1
94 . 1 1 26 26 ALA N N 15 125.9238 0.0511 . 1 . . . . . 26 ALA N . 27544 1
95 . 1 1 27 27 MET H H 1 8.3992 0.0034 . 1 . . . . . 27 MET H . 27544 1
96 . 1 1 27 27 MET CA C 13 53.7788 0.0222 . 1 . . . . . 27 MET CA . 27544 1
97 . 1 1 27 27 MET CB C 13 30.0033 0.0891 . 1 . . . . . 27 MET CB . 27544 1
98 . 1 1 27 27 MET N N 15 110.1415 0.0269 . 1 . . . . . 27 MET N . 27544 1
99 . 1 1 28 28 ARG H H 1 7.3095 0.0037 . 1 . . . . . 28 ARG H . 27544 1
100 . 1 1 28 28 ARG CA C 13 59.8569 0.0578 . 1 . . . . . 28 ARG CA . 27544 1
101 . 1 1 28 28 ARG CB C 13 29.7864 0.0262 . 1 . . . . . 28 ARG CB . 27544 1
102 . 1 1 28 28 ARG N N 15 118.9394 0.0309 . 1 . . . . . 28 ARG N . 27544 1
103 . 1 1 29 29 VAL H H 1 7.3804 0.0039 . 1 . . . . . 29 VAL H . 27544 1
104 . 1 1 29 29 VAL CA C 13 65.6224 0.0453 . 1 . . . . . 29 VAL CA . 27544 1
105 . 1 1 29 29 VAL CB C 13 32.0427 0.0534 . 1 . . . . . 29 VAL CB . 27544 1
106 . 1 1 29 29 VAL N N 15 115.8129 0.0275 . 1 . . . . . 29 VAL N . 27544 1
107 . 1 1 30 30 ILE H H 1 6.6952 0.0034 . 1 . . . . . 30 ILE H . 27544 1
108 . 1 1 30 30 ILE CA C 13 65.2366 0.0111 . 1 . . . . . 30 ILE CA . 27544 1
109 . 1 1 30 30 ILE CB C 13 40.1049 0.0118 . 1 . . . . . 30 ILE CB . 27544 1
110 . 1 1 30 30 ILE N N 15 119.1942 0.0339 . 1 . . . . . 30 ILE N . 27544 1
111 . 1 1 31 31 ASN H H 1 8.5206 0.0035 . 1 . . . . . 31 ASN H . 27544 1
112 . 1 1 31 31 ASN CA C 13 54.9006 0.0399 . 1 . . . . . 31 ASN CA . 27544 1
113 . 1 1 31 31 ASN CB C 13 37.8982 0.0070 . 1 . . . . . 31 ASN CB . 27544 1
114 . 1 1 31 31 ASN N N 15 118.5733 0.0399 . 1 . . . . . 31 ASN N . 27544 1
115 . 1 1 32 32 ASN H H 1 8.4266 0.0052 . 1 . . . . . 32 ASN H . 27544 1
116 . 1 1 32 32 ASN CA C 13 55.9016 0.0209 . 1 . . . . . 32 ASN CA . 27544 1
117 . 1 1 32 32 ASN CB C 13 38.3788 0.0173 . 1 . . . . . 32 ASN CB . 27544 1
118 . 1 1 32 32 ASN N N 15 118.2724 0.0322 . 1 . . . . . 32 ASN N . 27544 1
119 . 1 1 33 33 TYR H H 1 7.6998 0.0045 . 1 . . . . . 33 TYR H . 27544 1
120 . 1 1 33 33 TYR CA C 13 60.6534 0.0474 . 1 . . . . . 33 TYR CA . 27544 1
121 . 1 1 33 33 TYR CB C 13 39.1869 0.0587 . 1 . . . . . 33 TYR CB . 27544 1
122 . 1 1 33 33 TYR N N 15 116.9280 0.0477 . 1 . . . . . 33 TYR N . 27544 1
123 . 1 1 34 34 GLN H H 1 8.0534 0.0033 . 1 . . . . . 34 GLN H . 27544 1
124 . 1 1 34 34 GLN CA C 13 55.9001 0.0228 . 1 . . . . . 34 GLN CA . 27544 1
125 . 1 1 34 34 GLN CB C 13 30.1933 0.0066 . 1 . . . . . 34 GLN CB . 27544 1
126 . 1 1 34 34 GLN N N 15 114.5938 0.0306 . 1 . . . . . 34 GLN N . 27544 1
127 . 1 1 35 35 ARG H H 1 8.3291 0.0043 . 1 . . . . . 35 ARG H . 27544 1
128 . 1 1 35 35 ARG CA C 13 57.3032 0.0620 . 1 . . . . . 35 ARG CA . 27544 1
129 . 1 1 35 35 ARG CB C 13 27.4223 0.0326 . 1 . . . . . 35 ARG CB . 27544 1
130 . 1 1 35 35 ARG N N 15 115.9334 0.0395 . 1 . . . . . 35 ARG N . 27544 1
131 . 1 1 36 36 ARG H H 1 7.8343 0.0043 . 1 . . . . . 36 ARG H . 27544 1
132 . 1 1 36 36 ARG CA C 13 55.1409 0.0085 . 1 . . . . . 36 ARG CA . 27544 1
133 . 1 1 36 36 ARG CB C 13 32.6811 0.0647 . 1 . . . . . 36 ARG CB . 27544 1
134 . 1 1 36 36 ARG N N 15 115.7761 0.0498 . 1 . . . . . 36 ARG N . 27544 1
135 . 1 1 37 37 CYS H H 1 9.2025 0.0040 . 1 . . . . . 37 CYS H . 27544 1
136 . 1 1 37 37 CYS CA C 13 54.5344 0.0680 . 1 . . . . . 37 CYS CA . 27544 1
137 . 1 1 37 37 CYS CB C 13 40.7642 0.0660 . 1 . . . . . 37 CYS CB . 27544 1
138 . 1 1 37 37 CYS N N 15 119.7150 0.0315 . 1 . . . . . 37 CYS N . 27544 1
139 . 1 1 38 38 LYS H H 1 8.6778 0.0033 . 1 . . . . . 38 LYS H . 27544 1
140 . 1 1 38 38 LYS CA C 13 57.1631 0.0601 . 1 . . . . . 38 LYS CA . 27544 1
141 . 1 1 38 38 LYS CB C 13 33.1100 0.0565 . 1 . . . . . 38 LYS CB . 27544 1
142 . 1 1 38 38 LYS N N 15 126.0238 0.0379 . 1 . . . . . 38 LYS N . 27544 1
143 . 1 1 39 39 ASP H H 1 9.0959 0.0042 . 1 . . . . . 39 ASP H . 27544 1
144 . 1 1 39 39 ASP CA C 13 57.5846 0.0540 . 1 . . . . . 39 ASP CA . 27544 1
145 . 1 1 39 39 ASP CB C 13 40.6546 0.0183 . 1 . . . . . 39 ASP CB . 27544 1
146 . 1 1 39 39 ASP N N 15 127.4545 0.0467 . 1 . . . . . 39 ASP N . 27544 1
147 . 1 1 40 40 GLN H H 1 7.8852 0.0034 . 1 . . . . . 40 GLN H . 27544 1
148 . 1 1 40 40 GLN CA C 13 54.2895 0.0007 . 1 . . . . . 40 GLN CA . 27544 1
149 . 1 1 40 40 GLN CB C 13 31.9126 0.0235 . 1 . . . . . 40 GLN CB . 27544 1
150 . 1 1 40 40 GLN N N 15 115.6445 0.0245 . 1 . . . . . 40 GLN N . 27544 1
151 . 1 1 41 41 ASN H H 1 8.4937 0.0012 . 1 . . . . . 41 ASN H . 27544 1
152 . 1 1 41 41 ASN CA C 13 54.4196 0.0795 . 1 . . . . . 41 ASN CA . 27544 1
153 . 1 1 41 41 ASN CB C 13 44.5311 0.0638 . 1 . . . . . 41 ASN CB . 27544 1
154 . 1 1 41 41 ASN N N 15 116.6166 0.0203 . 1 . . . . . 41 ASN N . 27544 1
155 . 1 1 42 42 THR H H 1 7.6747 0.0039 . 1 . . . . . 42 THR H . 27544 1
156 . 1 1 42 42 THR CA C 13 62.1861 0.0391 . 1 . . . . . 42 THR CA . 27544 1
157 . 1 1 42 42 THR CB C 13 71.1358 0.0127 . 1 . . . . . 42 THR CB . 27544 1
158 . 1 1 42 42 THR N N 15 121.9925 0.0367 . 1 . . . . . 42 THR N . 27544 1
159 . 1 1 43 43 PHE H H 1 9.7970 0.0035 . 1 . . . . . 43 PHE H . 27544 1
160 . 1 1 43 43 PHE CA C 13 57.2159 0.0464 . 1 . . . . . 43 PHE CA . 27544 1
161 . 1 1 43 43 PHE CB C 13 40.7560 0.0465 . 1 . . . . . 43 PHE CB . 27544 1
162 . 1 1 43 43 PHE N N 15 125.2697 0.0309 . 1 . . . . . 43 PHE N . 27544 1
163 . 1 1 44 44 LEU H H 1 9.3158 0.0048 . 1 . . . . . 44 LEU H . 27544 1
164 . 1 1 44 44 LEU CA C 13 54.1326 0.0157 . 1 . . . . . 44 LEU CA . 27544 1
165 . 1 1 44 44 LEU CB C 13 42.7989 0.0170 . 1 . . . . . 44 LEU CB . 27544 1
166 . 1 1 44 44 LEU N N 15 123.2755 0.0432 . 1 . . . . . 44 LEU N . 27544 1
167 . 1 1 45 45 ARG H H 1 8.4648 0.0038 . 1 . . . . . 45 ARG H . 27544 1
168 . 1 1 45 45 ARG CA C 13 54.3225 0.0552 . 1 . . . . . 45 ARG CA . 27544 1
169 . 1 1 45 45 ARG CB C 13 26.8384 0.0540 . 1 . . . . . 45 ARG CB . 27544 1
170 . 1 1 45 45 ARG N N 15 125.9428 0.0189 . 1 . . . . . 45 ARG N . 27544 1
171 . 1 1 46 46 THR H H 1 7.4995 0.0039 . 1 . . . . . 46 THR H . 27544 1
172 . 1 1 46 46 THR CA C 13 59.0661 0.0124 . 1 . . . . . 46 THR CA . 27544 1
173 . 1 1 46 46 THR CB C 13 68.9565 0.0028 . 1 . . . . . 46 THR CB . 27544 1
174 . 1 1 46 46 THR N N 15 117.8560 0.0344 . 1 . . . . . 46 THR N . 27544 1
175 . 1 1 47 47 THR H H 1 8.0046 0.0038 . 1 . . . . . 47 THR H . 27544 1
176 . 1 1 47 47 THR CA C 13 59.1861 0.0118 . 1 . . . . . 47 THR CA . 27544 1
177 . 1 1 47 47 THR CB C 13 71.2363 0.0365 . 1 . . . . . 47 THR CB . 27544 1
178 . 1 1 47 47 THR N N 15 108.4623 0.0212 . 1 . . . . . 47 THR N . 27544 1
179 . 1 1 48 48 PHE H H 1 9.4663 0.0028 . 1 . . . . . 48 PHE H . 27544 1
180 . 1 1 48 48 PHE CA C 13 62.9297 0.0186 . 1 . . . . . 48 PHE CA . 27544 1
181 . 1 1 48 48 PHE CB C 13 39.1408 0.0260 . 1 . . . . . 48 PHE CB . 27544 1
182 . 1 1 48 48 PHE N N 15 123.8621 0.0376 . 1 . . . . . 48 PHE N . 27544 1
183 . 1 1 49 49 ALA H H 1 8.7242 0.0035 . 1 . . . . . 49 ALA H . 27544 1
184 . 1 1 49 49 ALA CA C 13 55.2466 0.0349 . 1 . . . . . 49 ALA CA . 27544 1
185 . 1 1 49 49 ALA CB C 13 18.3438 0.0749 . 1 . . . . . 49 ALA CB . 27544 1
186 . 1 1 49 49 ALA N N 15 118.6859 0.0426 . 1 . . . . . 49 ALA N . 27544 1
187 . 1 1 50 50 ASN H H 1 7.6305 0.0037 . 1 . . . . . 50 ASN H . 27544 1
188 . 1 1 50 50 ASN CA C 13 56.0647 0.0774 . 1 . . . . . 50 ASN CA . 27544 1
189 . 1 1 50 50 ASN CB C 13 38.2413 0.0325 . 1 . . . . . 50 ASN CB . 27544 1
190 . 1 1 50 50 ASN N N 15 116.6535 0.0442 . 1 . . . . . 50 ASN N . 27544 1
191 . 1 1 51 51 VAL H H 1 7.5836 0.0038 . 1 . . . . . 51 VAL H . 27544 1
192 . 1 1 51 51 VAL CA C 13 65.2209 0.0110 . 1 . . . . . 51 VAL CA . 27544 1
193 . 1 1 51 51 VAL CB C 13 30.9528 0.0518 . 1 . . . . . 51 VAL CB . 27544 1
194 . 1 1 51 51 VAL N N 15 121.5940 0.0242 . 1 . . . . . 51 VAL N . 27544 1
195 . 1 1 52 52 VAL H H 1 7.9820 0.0040 . 1 . . . . . 52 VAL H . 27544 1
196 . 1 1 52 52 VAL CA C 13 67.0526 0.0710 . 1 . . . . . 52 VAL CA . 27544 1
197 . 1 1 52 52 VAL CB C 13 30.6999 0.0692 . 1 . . . . . 52 VAL CB . 27544 1
198 . 1 1 52 52 VAL N N 15 119.1198 0.0445 . 1 . . . . . 52 VAL N . 27544 1
199 . 1 1 53 53 ASN H H 1 7.4341 0.0037 . 1 . . . . . 53 ASN H . 27544 1
200 . 1 1 53 53 ASN CA C 13 56.4091 0.0192 . 1 . . . . . 53 ASN CA . 27544 1
201 . 1 1 53 53 ASN CB C 13 38.0898 0.0480 . 1 . . . . . 53 ASN CB . 27544 1
202 . 1 1 53 53 ASN N N 15 117.4729 0.0286 . 1 . . . . . 53 ASN N . 27544 1
203 . 1 1 54 54 VAL H H 1 7.5838 0.0036 . 1 . . . . . 54 VAL H . 27544 1
204 . 1 1 54 54 VAL CA C 13 65.8466 0.0585 . 1 . . . . . 54 VAL CA . 27544 1
205 . 1 1 54 54 VAL CB C 13 30.3933 0.0502 . 1 . . . . . 54 VAL CB . 27544 1
206 . 1 1 54 54 VAL N N 15 123.3725 0.0304 . 1 . . . . . 54 VAL N . 27544 1
207 . 1 1 55 55 CYS H H 1 7.4511 0.0041 . 1 . . . . . 55 CYS H . 27544 1
208 . 1 1 55 55 CYS CA C 13 55.3956 0.0211 . 1 . . . . . 55 CYS CA . 27544 1
209 . 1 1 55 55 CYS CB C 13 38.4704 0.0220 . 1 . . . . . 55 CYS CB . 27544 1
210 . 1 1 55 55 CYS N N 15 115.8276 0.0806 . 1 . . . . . 55 CYS N . 27544 1
211 . 1 1 56 56 GLY H H 1 7.3839 0.0035 . 1 . . . . . 56 GLY H . 27544 1
212 . 1 1 56 56 GLY CA C 13 44.9233 0.0248 . 1 . . . . . 56 GLY CA . 27544 1
213 . 1 1 56 56 GLY N N 15 104.2882 0.0032 . 1 . . . . . 56 GLY N . 27544 1
214 . 1 1 57 57 ASN H H 1 7.7937 0.0035 . 1 . . . . . 57 ASN H . 27544 1
215 . 1 1 57 57 ASN CA C 13 52.0366 . . 1 . . . . . 57 ASN CA . 27544 1
216 . 1 1 57 57 ASN CB C 13 35.4681 . . 1 . . . . . 57 ASN CB . 27544 1
217 . 1 1 57 57 ASN N N 15 121.9489 0.0536 . 1 . . . . . 57 ASN N . 27544 1
218 . 1 1 58 58 PRO CA C 13 64.7315 0.0177 . 1 . . . . . 58 PRO CA . 27544 1
219 . 1 1 58 58 PRO CB C 13 32.2094 . . 1 . . . . . 58 PRO CB . 27544 1
220 . 1 1 59 59 ASN H H 1 8.4587 0.0031 . 1 . . . . . 59 ASN H . 27544 1
221 . 1 1 59 59 ASN CB C 13 38.5012 0.0106 . 1 . . . . . 59 ASN CB . 27544 1
222 . 1 1 59 59 ASN N N 15 120.8713 0.1310 . 1 . . . . . 59 ASN N . 27544 1
223 . 1 1 60 60 ILE H H 1 8.4539 0.0050 . 1 . . . . . 60 ILE H . 27544 1
224 . 1 1 60 60 ILE CA C 13 59.0003 0.0959 . 1 . . . . . 60 ILE CA . 27544 1
225 . 1 1 60 60 ILE CB C 13 43.2581 0.0240 . 1 . . . . . 60 ILE CB . 27544 1
226 . 1 1 60 60 ILE N N 15 117.1474 0.0992 . 1 . . . . . 60 ILE N . 27544 1
227 . 1 1 61 61 THR H H 1 8.2069 0.0039 . 1 . . . . . 61 THR H . 27544 1
228 . 1 1 61 61 THR CA C 13 63.4483 0.0079 . 1 . . . . . 61 THR CA . 27544 1
229 . 1 1 61 61 THR CB C 13 69.5102 0.0254 . 1 . . . . . 61 THR CB . 27544 1
230 . 1 1 61 61 THR N N 15 117.5033 0.0458 . 1 . . . . . 61 THR N . 27544 1
231 . 1 1 62 62 CYS H H 1 8.3025 0.0044 . 1 . . . . . 62 CYS H . 27544 1
232 . 1 1 62 62 CYS CA C 13 52.6822 . . 1 . . . . . 62 CYS CA . 27544 1
233 . 1 1 62 62 CYS CB C 13 40.7048 . . 1 . . . . . 62 CYS CB . 27544 1
234 . 1 1 62 62 CYS N N 15 128.2249 0.0476 . 1 . . . . . 62 CYS N . 27544 1
235 . 1 1 63 63 PRO CA C 13 65.3105 . . 1 . . . . . 63 PRO CA . 27544 1
236 . 1 1 63 63 PRO CB C 13 32.7892 . . 1 . . . . . 63 PRO CB . 27544 1
237 . 1 1 64 64 ARG H H 1 10.2919 0.0087 . 1 . . . . . 64 ARG H . 27544 1
238 . 1 1 64 64 ARG CA C 13 55.7281 0.0396 . 1 . . . . . 64 ARG CA . 27544 1
239 . 1 1 64 64 ARG CB C 13 29.0045 0.1129 . 1 . . . . . 64 ARG CB . 27544 1
240 . 1 1 64 64 ARG N N 15 115.6648 0.0182 . 1 . . . . . 64 ARG N . 27544 1
241 . 1 1 65 65 ASN H H 1 7.5458 0.0057 . 1 . . . . . 65 ASN H . 27544 1
242 . 1 1 65 65 ASN CA C 13 53.0043 0.0725 . 1 . . . . . 65 ASN CA . 27544 1
243 . 1 1 65 65 ASN CB C 13 38.4043 0.0259 . 1 . . . . . 65 ASN CB . 27544 1
244 . 1 1 65 65 ASN N N 15 118.3417 0.0335 . 1 . . . . . 65 ASN N . 27544 1
245 . 1 1 66 66 ARG H H 1 8.4852 0.0050 . 1 . . . . . 66 ARG H . 27544 1
246 . 1 1 66 66 ARG CA C 13 58.2988 0.1241 . 1 . . . . . 66 ARG CA . 27544 1
247 . 1 1 66 66 ARG CB C 13 29.3578 0.0515 . 1 . . . . . 66 ARG CB . 27544 1
248 . 1 1 66 66 ARG N N 15 120.0191 0.0675 . 1 . . . . . 66 ARG N . 27544 1
249 . 1 1 67 67 THR H H 1 7.6317 0.0039 . 1 . . . . . 67 THR H . 27544 1
250 . 1 1 67 67 THR CA C 13 62.6617 0.0843 . 1 . . . . . 67 THR CA . 27544 1
251 . 1 1 67 67 THR CB C 13 69.0511 0.0331 . 1 . . . . . 67 THR CB . 27544 1
252 . 1 1 67 67 THR N N 15 108.8285 0.0733 . 1 . . . . . 67 THR N . 27544 1
253 . 1 1 68 68 LEU H H 1 8.0657 0.0049 . 1 . . . . . 68 LEU H . 27544 1
254 . 1 1 68 68 LEU CA C 13 53.9392 0.0579 . 1 . . . . . 68 LEU CA . 27544 1
255 . 1 1 68 68 LEU CB C 13 43.8734 0.0862 . 1 . . . . . 68 LEU CB . 27544 1
256 . 1 1 68 68 LEU N N 15 122.8429 0.0310 . 1 . . . . . 68 LEU N . 27544 1
257 . 1 1 69 69 HIS H H 1 8.8475 0.0064 . 1 . . . . . 69 HIS H . 27544 1
258 . 1 1 69 69 HIS CA C 13 54.0925 0.0004 . 1 . . . . . 69 HIS CA . 27544 1
259 . 1 1 69 69 HIS CB C 13 28.7086 0.0828 . 1 . . . . . 69 HIS CB . 27544 1
260 . 1 1 69 69 HIS N N 15 118.9872 0.1016 . 1 . . . . . 69 HIS N . 27544 1
261 . 1 1 70 70 ASN H H 1 8.4135 0.0065 . 1 . . . . . 70 ASN H . 27544 1
262 . 1 1 70 70 ASN CA C 13 51.9416 0.0461 . 1 . . . . . 70 ASN CA . 27544 1
263 . 1 1 70 70 ASN CB C 13 37.0526 0.0026 . 1 . . . . . 70 ASN CB . 27544 1
264 . 1 1 70 70 ASN N N 15 117.9411 0.0857 . 1 . . . . . 70 ASN N . 27544 1
265 . 1 1 71 71 CYS H H 1 7.3169 0.0054 . 1 . . . . . 71 CYS H . 27544 1
266 . 1 1 71 71 CYS CA C 13 60.2944 0.0038 . 1 . . . . . 71 CYS CA . 27544 1
267 . 1 1 71 71 CYS CB C 13 46.9195 0.0348 . 1 . . . . . 71 CYS CB . 27544 1
268 . 1 1 71 71 CYS N N 15 115.0262 0.0437 . 1 . . . . . 71 CYS N . 27544 1
269 . 1 1 72 72 HIS H H 1 8.3990 0.0046 . 1 . . . . . 72 HIS H . 27544 1
270 . 1 1 72 72 HIS CA C 13 54.9251 0.0884 . 1 . . . . . 72 HIS CA . 27544 1
271 . 1 1 72 72 HIS CB C 13 33.5633 0.0223 . 1 . . . . . 72 HIS CB . 27544 1
272 . 1 1 72 72 HIS N N 15 115.5876 0.0197 . 1 . . . . . 72 HIS N . 27544 1
273 . 1 1 73 73 ARG H H 1 9.7853 0.0040 . 1 . . . . . 73 ARG H . 27544 1
274 . 1 1 73 73 ARG CA C 13 53.8433 0.0535 . 1 . . . . . 73 ARG CA . 27544 1
275 . 1 1 73 73 ARG CB C 13 32.7191 0.0575 . 1 . . . . . 73 ARG CB . 27544 1
276 . 1 1 73 73 ARG N N 15 126.6463 0.0248 . 1 . . . . . 73 ARG N . 27544 1
277 . 1 1 74 74 SER H H 1 9.0831 0.0025 . 1 . . . . . 74 SER H . 27544 1
278 . 1 1 74 74 SER CA C 13 59.3161 0.0672 . 1 . . . . . 74 SER CA . 27544 1
279 . 1 1 74 74 SER CB C 13 63.2955 0.0587 . 1 . . . . . 74 SER CB . 27544 1
280 . 1 1 74 74 SER N N 15 125.3120 0.0308 . 1 . . . . . 74 SER N . 27544 1
281 . 1 1 75 75 ARG H H 1 9.0830 0.0038 . 1 . . . . . 75 ARG H . 27544 1
282 . 1 1 75 75 ARG CA C 13 58.0179 0.0357 . 1 . . . . . 75 ARG CA . 27544 1
283 . 1 1 75 75 ARG CB C 13 30.6785 0.0371 . 1 . . . . . 75 ARG CB . 27544 1
284 . 1 1 75 75 ARG N N 15 122.4054 0.0496 . 1 . . . . . 75 ARG N . 27544 1
285 . 1 1 76 76 PHE H H 1 7.7778 0.0043 . 1 . . . . . 76 PHE H . 27544 1
286 . 1 1 76 76 PHE CA C 13 55.2473 0.0261 . 1 . . . . . 76 PHE CA . 27544 1
287 . 1 1 76 76 PHE CB C 13 42.0604 0.0730 . 1 . . . . . 76 PHE CB . 27544 1
288 . 1 1 76 76 PHE N N 15 113.8751 0.0463 . 1 . . . . . 76 PHE N . 27544 1
289 . 1 1 77 77 GLN H H 1 8.7081 0.0037 . 1 . . . . . 77 GLN H . 27544 1
290 . 1 1 77 77 GLN CA C 13 55.2713 0.0239 . 1 . . . . . 77 GLN CA . 27544 1
291 . 1 1 77 77 GLN CB C 13 29.8247 0.0615 . 1 . . . . . 77 GLN CB . 27544 1
292 . 1 1 77 77 GLN N N 15 121.2798 0.0555 . 1 . . . . . 77 GLN N . 27544 1
293 . 1 1 78 78 VAL H H 1 8.5624 0.0034 . 1 . . . . . 78 VAL H . 27544 1
294 . 1 1 78 78 VAL CA C 13 57.6415 . . 1 . . . . . 78 VAL CA . 27544 1
295 . 1 1 78 78 VAL CB C 13 34.0224 . . 1 . . . . . 78 VAL CB . 27544 1
296 . 1 1 78 78 VAL N N 15 117.2321 0.0467 . 1 . . . . . 78 VAL N . 27544 1
297 . 1 1 79 79 PRO CA C 13 62.1113 0.0803 . 1 . . . . . 79 PRO CA . 27544 1
298 . 1 1 79 79 PRO CB C 13 31.4292 0.0507 . 1 . . . . . 79 PRO CB . 27544 1
299 . 1 1 80 80 LEU H H 1 8.9574 0.0055 . 1 . . . . . 80 LEU H . 27544 1
300 . 1 1 80 80 LEU CA C 13 53.3387 0.0481 . 1 . . . . . 80 LEU CA . 27544 1
301 . 1 1 80 80 LEU CB C 13 45.7080 0.0502 . 1 . . . . . 80 LEU CB . 27544 1
302 . 1 1 80 80 LEU N N 15 118.5345 0.0392 . 1 . . . . . 80 LEU N . 27544 1
303 . 1 1 81 81 LEU H H 1 8.8933 0.0040 . 1 . . . . . 81 LEU H . 27544 1
304 . 1 1 81 81 LEU CA C 13 53.8415 0.1191 . 1 . . . . . 81 LEU CA . 27544 1
305 . 1 1 81 81 LEU CB C 13 45.8117 0.0547 . 1 . . . . . 81 LEU CB . 27544 1
306 . 1 1 81 81 LEU N N 15 123.8518 0.0353 . 1 . . . . . 81 LEU N . 27544 1
307 . 1 1 82 82 HIS H H 1 9.7280 0.0042 . 1 . . . . . 82 HIS H . 27544 1
308 . 1 1 82 82 HIS CA C 13 54.7514 0.0282 . 1 . . . . . 82 HIS CA . 27544 1
309 . 1 1 82 82 HIS CB C 13 32.2452 0.0394 . 1 . . . . . 82 HIS CB . 27544 1
310 . 1 1 82 82 HIS N N 15 126.2234 0.0464 . 1 . . . . . 82 HIS N . 27544 1
311 . 1 1 83 83 CYS H H 1 8.8268 0.0038 . 1 . . . . . 83 CYS H . 27544 1
312 . 1 1 83 83 CYS CA C 13 51.5882 0.0075 . 1 . . . . . 83 CYS CA . 27544 1
313 . 1 1 83 83 CYS CB C 13 39.5771 0.0546 . 1 . . . . . 83 CYS CB . 27544 1
314 . 1 1 83 83 CYS N N 15 121.6753 0.0222 . 1 . . . . . 83 CYS N . 27544 1
315 . 1 1 84 84 ASN H H 1 8.7111 0.0042 . 1 . . . . . 84 ASN H . 27544 1
316 . 1 1 84 84 ASN CA C 13 52.9713 0.0472 . 1 . . . . . 84 ASN CA . 27544 1
317 . 1 1 84 84 ASN CB C 13 42.1687 0.0758 . 1 . . . . . 84 ASN CB . 27544 1
318 . 1 1 84 84 ASN N N 15 121.1087 0.0355 . 1 . . . . . 84 ASN N . 27544 1
319 . 1 1 85 85 LEU H H 1 8.8359 0.0041 . 1 . . . . . 85 LEU H . 27544 1
320 . 1 1 85 85 LEU CA C 13 55.6301 0.0339 . 1 . . . . . 85 LEU CA . 27544 1
321 . 1 1 85 85 LEU CB C 13 43.2901 0.0255 . 1 . . . . . 85 LEU CB . 27544 1
322 . 1 1 85 85 LEU N N 15 128.9060 0.0318 . 1 . . . . . 85 LEU N . 27544 1
323 . 1 1 86 86 THR H H 1 9.0430 0.0039 . 1 . . . . . 86 THR H . 27544 1
324 . 1 1 86 86 THR CA C 13 62.5023 0.0203 . 1 . . . . . 86 THR CA . 27544 1
325 . 1 1 86 86 THR CB C 13 69.6150 0.0372 . 1 . . . . . 86 THR CB . 27544 1
326 . 1 1 86 86 THR N N 15 118.6520 0.0518 . 1 . . . . . 86 THR N . 27544 1
327 . 1 1 87 87 ASN H H 1 8.1370 0.0035 . 1 . . . . . 87 ASN H . 27544 1
328 . 1 1 87 87 ASN CA C 13 51.0415 . . 1 . . . . . 87 ASN CA . 27544 1
329 . 1 1 87 87 ASN CB C 13 36.6461 . . 1 . . . . . 87 ASN CB . 27544 1
330 . 1 1 87 87 ASN N N 15 118.8410 0.0461 . 1 . . . . . 87 ASN N . 27544 1
331 . 1 1 88 88 PRO CA C 13 63.9965 0.0578 . 1 . . . . . 88 PRO CA . 27544 1
332 . 1 1 88 88 PRO CB C 13 31.6920 0.0472 . 1 . . . . . 88 PRO CB . 27544 1
333 . 1 1 89 89 GLY H H 1 8.6525 0.0035 . 1 . . . . . 89 GLY H . 27544 1
334 . 1 1 89 89 GLY CA C 13 44.8690 0.0399 . 1 . . . . . 89 GLY CA . 27544 1
335 . 1 1 89 89 GLY N N 15 109.0716 0.0216 . 1 . . . . . 89 GLY N . 27544 1
336 . 1 1 90 90 ALA H H 1 7.7116 0.0033 . 1 . . . . . 90 ALA H . 27544 1
337 . 1 1 90 90 ALA CA C 13 53.1862 0.0027 . 1 . . . . . 90 ALA CA . 27544 1
338 . 1 1 90 90 ALA CB C 13 18.7091 0.0055 . 1 . . . . . 90 ALA CB . 27544 1
339 . 1 1 90 90 ALA N N 15 124.2100 0.0379 . 1 . . . . . 90 ALA N . 27544 1
340 . 1 1 91 91 GLN H H 1 8.6039 0.0027 . 1 . . . . . 91 GLN H . 27544 1
341 . 1 1 91 91 GLN CA C 13 57.0488 0.0263 . 1 . . . . . 91 GLN CA . 27544 1
342 . 1 1 91 91 GLN CB C 13 29.4855 0.0301 . 1 . . . . . 91 GLN CB . 27544 1
343 . 1 1 91 91 GLN N N 15 121.0620 0.0200 . 1 . . . . . 91 GLN N . 27544 1
344 . 1 1 92 92 ASN H H 1 7.7651 0.0037 . 1 . . . . . 92 ASN H . 27544 1
345 . 1 1 92 92 ASN CA C 13 51.8621 0.0269 . 1 . . . . . 92 ASN CA . 27544 1
346 . 1 1 92 92 ASN CB C 13 39.9841 0.0294 . 1 . . . . . 92 ASN CB . 27544 1
347 . 1 1 92 92 ASN N N 15 116.5872 0.0337 . 1 . . . . . 92 ASN N . 27544 1
348 . 1 1 93 93 ILE H H 1 8.6256 0.0035 . 1 . . . . . 93 ILE H . 27544 1
349 . 1 1 93 93 ILE CA C 13 63.9518 0.0808 . 1 . . . . . 93 ILE CA . 27544 1
350 . 1 1 93 93 ILE CB C 13 38.4141 0.0008 . 1 . . . . . 93 ILE CB . 27544 1
351 . 1 1 93 93 ILE N N 15 122.1213 0.0317 . 1 . . . . . 93 ILE N . 27544 1
352 . 1 1 94 94 SER H H 1 8.5367 0.0039 . 1 . . . . . 94 SER H . 27544 1
353 . 1 1 94 94 SER CA C 13 60.4972 0.0936 . 1 . . . . . 94 SER CA . 27544 1
354 . 1 1 94 94 SER CB C 13 62.6785 0.0813 . 1 . . . . . 94 SER CB . 27544 1
355 . 1 1 94 94 SER N N 15 116.4918 0.0221 . 1 . . . . . 94 SER N . 27544 1
356 . 1 1 95 95 ASN H H 1 8.1745 0.0046 . 1 . . . . . 95 ASN H . 27544 1
357 . 1 1 95 95 ASN CA C 13 52.6403 0.0237 . 1 . . . . . 95 ASN CA . 27544 1
358 . 1 1 95 95 ASN CB C 13 39.5728 0.0218 . 1 . . . . . 95 ASN CB . 27544 1
359 . 1 1 95 95 ASN N N 15 117.8831 0.0461 . 1 . . . . . 95 ASN N . 27544 1
360 . 1 1 96 96 CYS H H 1 7.4853 0.0039 . 1 . . . . . 96 CYS H . 27544 1
361 . 1 1 96 96 CYS CA C 13 56.3854 0.0236 . 1 . . . . . 96 CYS CA . 27544 1
362 . 1 1 96 96 CYS CB C 13 42.4034 0.0543 . 1 . . . . . 96 CYS CB . 27544 1
363 . 1 1 96 96 CYS N N 15 120.0812 0.0362 . 1 . . . . . 96 CYS N . 27544 1
364 . 1 1 97 97 LYS H H 1 9.8514 0.0036 . 1 . . . . . 97 LYS H . 27544 1
365 . 1 1 97 97 LYS CA C 13 55.5313 0.0852 . 1 . . . . . 97 LYS CA . 27544 1
366 . 1 1 97 97 LYS CB C 13 35.0545 0.0082 . 1 . . . . . 97 LYS CB . 27544 1
367 . 1 1 97 97 LYS N N 15 129.6260 0.0256 . 1 . . . . . 97 LYS N . 27544 1
368 . 1 1 98 98 TYR H H 1 8.3424 0.0085 . 1 . . . . . 98 TYR H . 27544 1
369 . 1 1 98 98 TYR CA C 13 56.7442 0.0609 . 1 . . . . . 98 TYR CA . 27544 1
370 . 1 1 98 98 TYR CB C 13 44.4247 0.0165 . 1 . . . . . 98 TYR CB . 27544 1
371 . 1 1 98 98 TYR N N 15 119.0113 0.1008 . 1 . . . . . 98 TYR N . 27544 1
372 . 1 1 99 99 ALA H H 1 9.1095 0.0029 . 1 . . . . . 99 ALA H . 27544 1
373 . 1 1 99 99 ALA CA C 13 50.8718 0.0132 . 1 . . . . . 99 ALA CA . 27544 1
374 . 1 1 99 99 ALA CB C 13 20.9339 0.0180 . 1 . . . . . 99 ALA CB . 27544 1
375 . 1 1 99 99 ALA N N 15 125.3892 0.0215 . 1 . . . . . 99 ALA N . 27544 1
376 . 1 1 100 100 ASP H H 1 8.1126 0.0038 . 1 . . . . . 100 ASP H . 27544 1
377 . 1 1 100 100 ASP CA C 13 54.4970 0.0993 . 1 . . . . . 100 ASP CA . 27544 1
378 . 1 1 100 100 ASP CB C 13 43.8231 0.0182 . 1 . . . . . 100 ASP CB . 27544 1
379 . 1 1 100 100 ASP N N 15 119.8963 0.0571 . 1 . . . . . 100 ASP N . 27544 1
380 . 1 1 101 101 ARG H H 1 8.8219 0.0030 . 1 . . . . . 101 ARG H . 27544 1
381 . 1 1 101 101 ARG CA C 13 56.5022 0.0159 . 1 . . . . . 101 ARG CA . 27544 1
382 . 1 1 101 101 ARG CB C 13 34.2793 0.0739 . 1 . . . . . 101 ARG CB . 27544 1
383 . 1 1 101 101 ARG N N 15 121.9990 0.0521 . 1 . . . . . 101 ARG N . 27544 1
384 . 1 1 102 102 THR H H 1 8.8241 0.0032 . 1 . . . . . 102 THR H . 27544 1
385 . 1 1 102 102 THR CA C 13 60.5795 0.0440 . 1 . . . . . 102 THR CA . 27544 1
386 . 1 1 102 102 THR CB C 13 70.6991 0.0419 . 1 . . . . . 102 THR CB . 27544 1
387 . 1 1 102 102 THR N N 15 119.4391 0.0360 . 1 . . . . . 102 THR N . 27544 1
388 . 1 1 103 103 GLU H H 1 8.0066 0.0033 . 1 . . . . . 103 GLU H . 27544 1
389 . 1 1 103 103 GLU CA C 13 54.7078 0.0183 . 1 . . . . . 103 GLU CA . 27544 1
390 . 1 1 103 103 GLU CB C 13 33.8087 0.0326 . 1 . . . . . 103 GLU CB . 27544 1
391 . 1 1 103 103 GLU N N 15 119.7646 0.0161 . 1 . . . . . 103 GLU N . 27544 1
392 . 1 1 104 104 ARG H H 1 8.4778 0.0052 . 1 . . . . . 104 ARG H . 27544 1
393 . 1 1 104 104 ARG CA C 13 55.9141 0.0262 . 1 . . . . . 104 ARG CA . 27544 1
394 . 1 1 104 104 ARG CB C 13 31.8867 0.0201 . 1 . . . . . 104 ARG CB . 27544 1
395 . 1 1 104 104 ARG N N 15 121.4901 0.0399 . 1 . . . . . 104 ARG N . 27544 1
396 . 1 1 105 105 ARG H H 1 8.1393 0.0038 . 1 . . . . . 105 ARG H . 27544 1
397 . 1 1 105 105 ARG CA C 13 54.2460 0.0320 . 1 . . . . . 105 ARG CA . 27544 1
398 . 1 1 105 105 ARG CB C 13 36.7478 0.0257 . 1 . . . . . 105 ARG CB . 27544 1
399 . 1 1 105 105 ARG N N 15 120.3082 0.0212 . 1 . . . . . 105 ARG N . 27544 1
400 . 1 1 106 106 PHE H H 1 8.7575 0.0048 . 1 . . . . . 106 PHE H . 27544 1
401 . 1 1 106 106 PHE CA C 13 58.7773 0.0456 . 1 . . . . . 106 PHE CA . 27544 1
402 . 1 1 106 106 PHE CB C 13 39.6244 0.0753 . 1 . . . . . 106 PHE CB . 27544 1
403 . 1 1 106 106 PHE N N 15 118.3776 0.0365 . 1 . . . . . 106 PHE N . 27544 1
404 . 1 1 107 107 TYR H H 1 8.4048 0.0036 . 1 . . . . . 107 TYR H . 27544 1
405 . 1 1 107 107 TYR CA C 13 55.4161 0.0127 . 1 . . . . . 107 TYR CA . 27544 1
406 . 1 1 107 107 TYR CB C 13 42.2104 0.0144 . 1 . . . . . 107 TYR CB . 27544 1
407 . 1 1 107 107 TYR N N 15 114.5601 0.0501 . 1 . . . . . 107 TYR N . 27544 1
408 . 1 1 108 108 VAL H H 1 8.4189 0.0057 . 1 . . . . . 108 VAL H . 27544 1
409 . 1 1 108 108 VAL CA C 13 60.4030 0.0700 . 1 . . . . . 108 VAL CA . 27544 1
410 . 1 1 108 108 VAL CB C 13 33.9358 0.0256 . 1 . . . . . 108 VAL CB . 27544 1
411 . 1 1 108 108 VAL N N 15 118.8761 0.0308 . 1 . . . . . 108 VAL N . 27544 1
412 . 1 1 109 109 VAL H H 1 8.7456 0.0038 . 1 . . . . . 109 VAL H . 27544 1
413 . 1 1 109 109 VAL CA C 13 57.7629 0.0604 . 1 . . . . . 109 VAL CA . 27544 1
414 . 1 1 109 109 VAL CB C 13 34.8797 0.0145 . 1 . . . . . 109 VAL CB . 27544 1
415 . 1 1 109 109 VAL N N 15 118.4831 0.0754 . 1 . . . . . 109 VAL N . 27544 1
416 . 1 1 110 110 ALA H H 1 8.8682 0.0053 . 1 . . . . . 110 ALA H . 27544 1
417 . 1 1 110 110 ALA CA C 13 50.9799 0.0220 . 1 . . . . . 110 ALA CA . 27544 1
418 . 1 1 110 110 ALA CB C 13 20.4367 0.0176 . 1 . . . . . 110 ALA CB . 27544 1
419 . 1 1 110 110 ALA N N 15 125.0188 0.0397 . 1 . . . . . 110 ALA N . 27544 1
420 . 1 1 111 111 CYS H H 1 8.4537 0.0041 . 1 . . . . . 111 CYS H . 27544 1
421 . 1 1 111 111 CYS CA C 13 54.8666 0.0458 . 1 . . . . . 111 CYS CA . 27544 1
422 . 1 1 111 111 CYS CB C 13 48.4698 0.0505 . 1 . . . . . 111 CYS CB . 27544 1
423 . 1 1 111 111 CYS N N 15 117.5526 0.0377 . 1 . . . . . 111 CYS N . 27544 1
424 . 1 1 112 112 ASP H H 1 9.1631 0.0035 . 1 . . . . . 112 ASP H . 27544 1
425 . 1 1 112 112 ASP CA C 13 52.1473 0.0215 . 1 . . . . . 112 ASP CA . 27544 1
426 . 1 1 112 112 ASP CB C 13 45.6638 0.0540 . 1 . . . . . 112 ASP CB . 27544 1
427 . 1 1 112 112 ASP N N 15 121.5426 0.0306 . 1 . . . . . 112 ASP N . 27544 1
428 . 1 1 113 113 ASN H H 1 8.9952 0.0032 . 1 . . . . . 113 ASN H . 27544 1
429 . 1 1 113 113 ASN CA C 13 54.0742 0.0992 . 1 . . . . . 113 ASN CA . 27544 1
430 . 1 1 113 113 ASN CB C 13 38.8588 0.0620 . 1 . . . . . 113 ASN CB . 27544 1
431 . 1 1 113 113 ASN N N 15 118.8921 0.0155 . 1 . . . . . 113 ASN N . 27544 1
432 . 1 1 114 114 ARG H H 1 8.2335 0.0042 . 1 . . . . . 114 ARG H . 27544 1
433 . 1 1 114 114 ARG CA C 13 56.0058 0.0489 . 1 . . . . . 114 ARG CA . 27544 1
434 . 1 1 114 114 ARG CB C 13 29.2523 0.0622 . 1 . . . . . 114 ARG CB . 27544 1
435 . 1 1 114 114 ARG N N 15 119.1872 0.0634 . 1 . . . . . 114 ARG N . 27544 1
436 . 1 1 115 115 ASP H H 1 9.5433 0.0034 . 1 . . . . . 115 ASP H . 27544 1
437 . 1 1 115 115 ASP CA C 13 52.1667 . . 1 . . . . . 115 ASP CA . 27544 1
438 . 1 1 115 115 ASP CB C 13 43.9229 . . 1 . . . . . 115 ASP CB . 27544 1
439 . 1 1 115 115 ASP N N 15 125.7147 0.0182 . 1 . . . . . 115 ASP N . 27544 1
440 . 1 1 116 116 PRO CA C 13 65.5879 0.0279 . 1 . . . . . 116 PRO CA . 27544 1
441 . 1 1 116 116 PRO CB C 13 32.2068 0.0368 . 1 . . . . . 116 PRO CB . 27544 1
442 . 1 1 117 117 ARG H H 1 9.3976 0.0039 . 1 . . . . . 117 ARG H . 27544 1
443 . 1 1 117 117 ARG CA C 13 56.6284 0.0757 . 1 . . . . . 117 ARG CA . 27544 1
444 . 1 1 117 117 ARG CB C 13 30.4156 0.0553 . 1 . . . . . 117 ARG CB . 27544 1
445 . 1 1 117 117 ARG N N 15 114.1756 0.0276 . 1 . . . . . 117 ARG N . 27544 1
446 . 1 1 118 118 ASP H H 1 8.1968 0.0035 . 1 . . . . . 118 ASP H . 27544 1
447 . 1 1 118 118 ASP CA C 13 55.3967 0.0067 . 1 . . . . . 118 ASP CA . 27544 1
448 . 1 1 118 118 ASP CB C 13 43.0880 0.0617 . 1 . . . . . 118 ASP CB . 27544 1
449 . 1 1 118 118 ASP N N 15 119.7974 0.0404 . 1 . . . . . 118 ASP N . 27544 1
450 . 1 1 119 119 SER H H 1 8.3583 0.0039 . 1 . . . . . 119 SER H . 27544 1
451 . 1 1 119 119 SER CA C 13 56.0420 . . 1 . . . . . 119 SER CA . 27544 1
452 . 1 1 119 119 SER CB C 13 64.0687 . . 1 . . . . . 119 SER CB . 27544 1
453 . 1 1 119 119 SER N N 15 113.8303 0.0264 . 1 . . . . . 119 SER N . 27544 1
454 . 1 1 120 120 PRO CA C 13 63.5400 0.0257 . 1 . . . . . 120 PRO CA . 27544 1
455 . 1 1 120 120 PRO CB C 13 31.8644 0.0011 . 1 . . . . . 120 PRO CB . 27544 1
456 . 1 1 121 121 ARG H H 1 7.6958 0.0016 . 1 . . . . . 121 ARG H . 27544 1
457 . 1 1 121 121 ARG CA C 13 58.2579 0.0650 . 1 . . . . . 121 ARG CA . 27544 1
458 . 1 1 121 121 ARG CB C 13 30.4588 0.0522 . 1 . . . . . 121 ARG CB . 27544 1
459 . 1 1 121 121 ARG N N 15 116.9524 0.0319 . 1 . . . . . 121 ARG N . 27544 1
460 . 1 1 122 122 TYR H H 1 6.6358 0.0031 . 1 . . . . . 122 TYR H . 27544 1
461 . 1 1 122 122 TYR CA C 13 52.1837 . . 1 . . . . . 122 TYR CA . 27544 1
462 . 1 1 122 122 TYR CB C 13 38.9547 . . 1 . . . . . 122 TYR CB . 27544 1
463 . 1 1 122 122 TYR N N 15 113.6407 0.0239 . 1 . . . . . 122 TYR N . 27544 1
464 . 1 1 123 123 PRO CA C 13 64.8930 0.0787 . 1 . . . . . 123 PRO CA . 27544 1
465 . 1 1 123 123 PRO CB C 13 32.5902 0.0805 . 1 . . . . . 123 PRO CB . 27544 1
466 . 1 1 124 124 VAL H H 1 7.8700 0.0025 . 1 . . . . . 124 VAL H . 27544 1
467 . 1 1 124 124 VAL CA C 13 61.4590 0.0469 . 1 . . . . . 124 VAL CA . 27544 1
468 . 1 1 124 124 VAL CB C 13 34.2261 0.0679 . 1 . . . . . 124 VAL CB . 27544 1
469 . 1 1 124 124 VAL N N 15 118.6305 0.0539 . 1 . . . . . 124 VAL N . 27544 1
470 . 1 1 125 125 VAL H H 1 8.8390 0.0038 . 1 . . . . . 125 VAL H . 27544 1
471 . 1 1 125 125 VAL CA C 13 56.5016 . . 1 . . . . . 125 VAL CA . 27544 1
472 . 1 1 125 125 VAL CB C 13 34.5445 . . 1 . . . . . 125 VAL CB . 27544 1
473 . 1 1 125 125 VAL N N 15 114.6479 0.0148 . 1 . . . . . 125 VAL N . 27544 1
474 . 1 1 126 126 PRO CA C 13 61.4322 0.0116 . 1 . . . . . 126 PRO CA . 27544 1
475 . 1 1 126 126 PRO CB C 13 31.2153 0.0182 . 1 . . . . . 126 PRO CB . 27544 1
476 . 1 1 127 127 VAL H H 1 8.3593 0.0043 . 1 . . . . . 127 VAL H . 27544 1
477 . 1 1 127 127 VAL CA C 13 60.2529 0.0242 . 1 . . . . . 127 VAL CA . 27544 1
478 . 1 1 127 127 VAL CB C 13 34.9967 0.0421 . 1 . . . . . 127 VAL CB . 27544 1
479 . 1 1 127 127 VAL N N 15 105.2643 0.0280 . 1 . . . . . 127 VAL N . 27544 1
480 . 1 1 128 128 HIS H H 1 7.3932 0.0053 . 1 . . . . . 128 HIS H . 27544 1
481 . 1 1 128 128 HIS CA C 13 56.4637 0.0123 . 1 . . . . . 128 HIS CA . 27544 1
482 . 1 1 128 128 HIS CB C 13 33.5502 0.0098 . 1 . . . . . 128 HIS CB . 27544 1
483 . 1 1 128 128 HIS N N 15 119.4833 0.0533 . 1 . . . . . 128 HIS N . 27544 1
484 . 1 1 129 129 LEU H H 1 8.8216 0.0038 . 1 . . . . . 129 LEU H . 27544 1
485 . 1 1 129 129 LEU CA C 13 53.7966 0.0307 . 1 . . . . . 129 LEU CA . 27544 1
486 . 1 1 129 129 LEU CB C 13 41.0658 0.0265 . 1 . . . . . 129 LEU CB . 27544 1
487 . 1 1 129 129 LEU N N 15 130.2152 0.0267 . 1 . . . . . 129 LEU N . 27544 1
488 . 1 1 130 130 ASP H H 1 8.7290 0.0055 . 1 . . . . . 130 ASP H . 27544 1
489 . 1 1 130 130 ASP CA C 13 58.0098 0.0829 . 1 . . . . . 130 ASP CA . 27544 1
490 . 1 1 130 130 ASP CB C 13 46.5042 0.0943 . 1 . . . . . 130 ASP CB . 27544 1
491 . 1 1 130 130 ASP N N 15 129.5331 0.0596 . 1 . . . . . 130 ASP N . 27544 1
492 . 1 1 131 131 THR H H 1 7.4483 0.0060 . 1 . . . . . 131 THR H . 27544 1
493 . 1 1 131 131 THR CA C 13 60.5432 0.0986 . 1 . . . . . 131 THR CA . 27544 1
494 . 1 1 131 131 THR CB C 13 68.6965 0.0601 . 1 . . . . . 131 THR CB . 27544 1
495 . 1 1 131 131 THR N N 15 105.4367 0.0473 . 1 . . . . . 131 THR N . 27544 1
496 . 1 1 132 132 THR H H 1 8.0676 0.0043 . 1 . . . . . 132 THR H . 27544 1
497 . 1 1 132 132 THR CA C 13 60.2474 0.0327 . 1 . . . . . 132 THR CA . 27544 1
498 . 1 1 132 132 THR CB C 13 70.9268 0.0757 . 1 . . . . . 132 THR CB . 27544 1
499 . 1 1 132 132 THR N N 15 112.7376 0.0188 . 1 . . . . . 132 THR N . 27544 1
500 . 1 1 133 133 ILE H H 1 8.4522 0.0048 . 1 . . . . . 133 ILE H . 27544 1
501 . 1 1 133 133 ILE CA C 13 63.6979 . . 1 . . . . . 133 ILE CA . 27544 1
502 . 1 1 133 133 ILE CB C 13 42.5264 . . 1 . . . . . 133 ILE CB . 27544 1
503 . 1 1 133 133 ILE N N 15 125.5678 0.0548 . 1 . . . . . 133 ILE N . 27544 1
stop_
save_