Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 50803
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Assigned chemical shift list'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 50803 1
2 '3D HNCO' . . . 50803 1
3 '3D HN(CA)CO' . . . 50803 1
4 '3D HNCA' . . . 50803 1
5 '3D HNCACB' . . . 50803 1
6 '3D HN(CO)CACB' . . . 50803 1
7 '3D CBCA(CO)NH' . . . 50803 1
8 '3D HBHANH' . . . 50803 1
9 '3D HBHA(CO)NH' . . . 50803 1
10 '2D 1H-13C HSQC' . . . 50803 1
11 '2D 1H-13C HSQC aromatic' . . . 50803 1
12 '3D (H)CCH-TOCSY' . . . 50803 1
13 '3D HCCH-TOCSY' . . . 50803 1
14 '3D C(CO)NH' . . . 50803 1
15 '2D HBCBCGCDHD' . . . 50803 1
16 '2D HBCBCGCDCEHE' . . . 50803 1
17 '2D 1H-1H TOCSY' . . . 50803 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 50803 1
2 $software_2 . . 50803 1
3 $software_3 . . 50803 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 2 2 HIS HA H 1 4.671 0.00 . . . . . . . 2 HIS HA . 50803 1
2 . 1 . 1 2 2 HIS HB2 H 1 3.128 0.00 . . . . . . . 2 HIS HB2 . 50803 1
3 . 1 . 1 2 2 HIS HB3 H 1 3.094 0.00 . . . . . . . 2 HIS HB3 . 50803 1
4 . 1 . 1 2 2 HIS HD2 H 1 7.086 0.01 . . . . . . . 2 HIS HD2 . 50803 1
5 . 1 . 1 2 2 HIS HE1 H 1 8.076 0.11 . . . . . . . 2 HIS HE1 . 50803 1
6 . 1 . 1 2 2 HIS CA C 13 56.226 0.00 . . . . . . . 2 HIS CA . 50803 1
7 . 1 . 1 2 2 HIS CB C 13 30.621 0.00 . . . . . . . 2 HIS CB . 50803 1
8 . 1 . 1 2 2 HIS CD2 C 13 119.883 0.02 . . . . . . . 2 HIS CD2 . 50803 1
9 . 1 . 1 2 2 HIS CE1 C 13 137.919 0.10 . . . . . . . 2 HIS CE1 . 50803 1
10 . 1 . 1 2 2 HIS NE2 N 15 175.407 0.00 . . . . . . . 2 HIS NE2 . 50803 1
11 . 1 . 1 3 3 MET HA H 1 4.449 0.00 . . . . . . . 3 MET HA . 50803 1
12 . 1 . 1 3 3 MET HB2 H 1 2.040 0.00 . . . . . . . 3 MET HB2 . 50803 1
13 . 1 . 1 3 3 MET HB3 H 1 1.942 0.00 . . . . . . . 3 MET HB3 . 50803 1
14 . 1 . 1 3 3 MET HG2 H 1 2.531 0.00 . . . . . . . 3 MET HG2 . 50803 1
15 . 1 . 1 3 3 MET HG3 H 1 2.457 0.00 . . . . . . . 3 MET HG3 . 50803 1
16 . 1 . 1 3 3 MET C C 13 176.375 0.00 . . . . . . . 3 MET C . 50803 1
17 . 1 . 1 3 3 MET CA C 13 55.561 0.03 . . . . . . . 3 MET CA . 50803 1
18 . 1 . 1 3 3 MET CB C 13 32.693 0.06 . . . . . . . 3 MET CB . 50803 1
19 . 1 . 1 3 3 MET CG C 13 31.904 0.02 . . . . . . . 3 MET CG . 50803 1
20 . 1 . 1 4 4 GLY H H 1 8.399 0.00 . . . . . . . 4 GLY H . 50803 1
21 . 1 . 1 4 4 GLY HA2 H 1 3.899 0.01 . . . . . . . 4 GLY HA2 . 50803 1
22 . 1 . 1 4 4 GLY HA3 H 1 3.895 0.00 . . . . . . . 4 GLY HA3 . 50803 1
23 . 1 . 1 4 4 GLY C C 13 173.398 0.00 . . . . . . . 4 GLY C . 50803 1
24 . 1 . 1 4 4 GLY CA C 13 45.125 0.02 . . . . . . . 4 GLY CA . 50803 1
25 . 1 . 1 4 4 GLY N N 15 110.307 0.02 . . . . . . . 4 GLY N . 50803 1
26 . 1 . 1 5 5 TYR H H 1 8.037 0.00 . . . . . . . 5 TYR H . 50803 1
27 . 1 . 1 5 5 TYR HA H 1 4.529 0.00 . . . . . . . 5 TYR HA . 50803 1
28 . 1 . 1 5 5 TYR HB2 H 1 2.961 0.00 . . . . . . . 5 TYR HB2 . 50803 1
29 . 1 . 1 5 5 TYR HB3 H 1 2.925 0.00 . . . . . . . 5 TYR HB3 . 50803 1
30 . 1 . 1 5 5 TYR HD1 H 1 7.078 0.01 . . . . . . . 5 TYR HD . 50803 1
31 . 1 . 1 5 5 TYR HD2 H 1 7.078 0.01 . . . . . . . 5 TYR HD . 50803 1
32 . 1 . 1 5 5 TYR HE1 H 1 6.847 0.11 . . . . . . . 5 TYR HE . 50803 1
33 . 1 . 1 5 5 TYR HE2 H 1 6.847 0.11 . . . . . . . 5 TYR HE . 50803 1
34 . 1 . 1 5 5 TYR C C 13 175.279 0.01 . . . . . . . 5 TYR C . 50803 1
35 . 1 . 1 5 5 TYR CA C 13 57.865 0.10 . . . . . . . 5 TYR CA . 50803 1
36 . 1 . 1 5 5 TYR CB C 13 38.859 0.03 . . . . . . . 5 TYR CB . 50803 1
37 . 1 . 1 5 5 TYR CD1 C 13 133.194 0.02 . . . . . . . 5 TYR CD . 50803 1
38 . 1 . 1 5 5 TYR CD2 C 13 133.194 0.02 . . . . . . . 5 TYR CD . 50803 1
39 . 1 . 1 5 5 TYR CE1 C 13 118.146 0.02 . . . . . . . 5 TYR CE . 50803 1
40 . 1 . 1 5 5 TYR CE2 C 13 118.146 0.02 . . . . . . . 5 TYR CE . 50803 1
41 . 1 . 1 5 5 TYR N N 15 120.212 0.05 . . . . . . . 5 TYR N . 50803 1
42 . 1 . 1 6 6 MET H H 1 8.156 0.00 . . . . . . . 6 MET H . 50803 1
43 . 1 . 1 6 6 MET HA H 1 4.709 0.00 . . . . . . . 6 MET HA . 50803 1
44 . 1 . 1 6 6 MET HB2 H 1 1.961 0.00 . . . . . . . 6 MET HB2 . 50803 1
45 . 1 . 1 6 6 MET HB3 H 1 1.843 0.00 . . . . . . . 6 MET HB3 . 50803 1
46 . 1 . 1 6 6 MET HG2 H 1 2.494 0.00 . . . . . . . 6 MET HG2 . 50803 1
47 . 1 . 1 6 6 MET HG3 H 1 2.441 0.00 . . . . . . . 6 MET HG3 . 50803 1
48 . 1 . 1 6 6 MET HE1 H 1 2.055 0.00 . . . . . . . 6 MET HE . 50803 1
49 . 1 . 1 6 6 MET HE2 H 1 2.055 0.00 . . . . . . . 6 MET HE . 50803 1
50 . 1 . 1 6 6 MET HE3 H 1 2.055 0.00 . . . . . . . 6 MET HE . 50803 1
51 . 1 . 1 6 6 MET C C 13 173.473 0.00 . . . . . . . 6 MET C . 50803 1
52 . 1 . 1 6 6 MET CA C 13 52.705 0.02 . . . . . . . 6 MET CA . 50803 1
53 . 1 . 1 6 6 MET CB C 13 32.932 0.06 . . . . . . . 6 MET CB . 50803 1
54 . 1 . 1 6 6 MET CG C 13 31.772 0.06 . . . . . . . 6 MET CG . 50803 1
55 . 1 . 1 6 6 MET CE C 13 16.930 0.00 . . . . . . . 6 MET CE . 50803 1
56 . 1 . 1 6 6 MET N N 15 124.814 0.02 . . . . . . . 6 MET N . 50803 1
57 . 1 . 1 7 7 PRO HA H 1 4.356 0.00 . . . . . . . 7 PRO HA . 50803 1
58 . 1 . 1 7 7 PRO HB2 H 1 2.295 0.00 . . . . . . . 7 PRO HB2 . 50803 1
59 . 1 . 1 7 7 PRO HB3 H 1 1.926 0.00 . . . . . . . 7 PRO HB3 . 50803 1
60 . 1 . 1 7 7 PRO HG2 H 1 2.002 0.00 . . . . . . . 7 PRO HG2 . 50803 1
61 . 1 . 1 7 7 PRO HG3 H 1 1.971 0.00 . . . . . . . 7 PRO HG3 . 50803 1
62 . 1 . 1 7 7 PRO HD2 H 1 3.624 0.00 . . . . . . . 7 PRO HD2 . 50803 1
63 . 1 . 1 7 7 PRO HD3 H 1 3.581 0.00 . . . . . . . 7 PRO HD3 . 50803 1
64 . 1 . 1 7 7 PRO C C 13 176.978 0.00 . . . . . . . 7 PRO C . 50803 1
65 . 1 . 1 7 7 PRO CA C 13 63.115 0.02 . . . . . . . 7 PRO CA . 50803 1
66 . 1 . 1 7 7 PRO CB C 13 32.116 0.04 . . . . . . . 7 PRO CB . 50803 1
67 . 1 . 1 7 7 PRO CG C 13 27.232 0.02 . . . . . . . 7 PRO CG . 50803 1
68 . 1 . 1 7 7 PRO CD C 13 50.674 0.08 . . . . . . . 7 PRO CD . 50803 1
69 . 1 . 1 8 8 SER H H 1 8.313 0.01 . . . . . . . 8 SER H . 50803 1
70 . 1 . 1 8 8 SER HA H 1 4.374 0.00 . . . . . . . 8 SER HA . 50803 1
71 . 1 . 1 8 8 SER HB2 H 1 3.952 0.00 . . . . . . . 8 SER HB2 . 50803 1
72 . 1 . 1 8 8 SER HB3 H 1 3.867 0.01 . . . . . . . 8 SER HB3 . 50803 1
73 . 1 . 1 8 8 SER C C 13 174.828 0.05 . . . . . . . 8 SER C . 50803 1
74 . 1 . 1 8 8 SER CA C 13 58.403 0.05 . . . . . . . 8 SER CA . 50803 1
75 . 1 . 1 8 8 SER CB C 13 63.850 0.02 . . . . . . . 8 SER CB . 50803 1
76 . 1 . 1 8 8 SER N N 15 115.950 0.03 . . . . . . . 8 SER N . 50803 1
77 . 1 . 1 9 9 ALA H H 1 8.456 0.00 . . . . . . . 9 ALA H . 50803 1
78 . 1 . 1 9 9 ALA HA H 1 4.311 0.00 . . . . . . . 9 ALA HA . 50803 1
79 . 1 . 1 9 9 ALA HB1 H 1 1.416 0.00 . . . . . . . 9 ALA HB . 50803 1
80 . 1 . 1 9 9 ALA HB2 H 1 1.416 0.00 . . . . . . . 9 ALA HB . 50803 1
81 . 1 . 1 9 9 ALA HB3 H 1 1.416 0.00 . . . . . . . 9 ALA HB . 50803 1
82 . 1 . 1 9 9 ALA C C 13 178.362 0.04 . . . . . . . 9 ALA C . 50803 1
83 . 1 . 1 9 9 ALA CA C 13 53.254 0.02 . . . . . . . 9 ALA CA . 50803 1
84 . 1 . 1 9 9 ALA CB C 13 19.003 0.03 . . . . . . . 9 ALA CB . 50803 1
85 . 1 . 1 9 9 ALA N N 15 125.869 0.05 . . . . . . . 9 ALA N . 50803 1
86 . 1 . 1 10 10 SER H H 1 8.190 0.00 . . . . . . . 10 SER H . 50803 1
87 . 1 . 1 10 10 SER HA H 1 4.363 0.00 . . . . . . . 10 SER HA . 50803 1
88 . 1 . 1 10 10 SER HB2 H 1 3.883 0.00 . . . . . . . 10 SER HB2 . 50803 1
89 . 1 . 1 10 10 SER HB3 H 1 3.858 0.00 . . . . . . . 10 SER HB3 . 50803 1
90 . 1 . 1 10 10 SER C C 13 175.166 0.06 . . . . . . . 10 SER C . 50803 1
91 . 1 . 1 10 10 SER CA C 13 59.018 0.03 . . . . . . . 10 SER CA . 50803 1
92 . 1 . 1 10 10 SER CB C 13 63.456 0.02 . . . . . . . 10 SER CB . 50803 1
93 . 1 . 1 10 10 SER N N 15 113.994 0.04 . . . . . . . 10 SER N . 50803 1
94 . 1 . 1 11 11 MET H H 1 8.203 0.00 . . . . . . . 11 MET H . 50803 1
95 . 1 . 1 11 11 MET HA H 1 4.499 0.00 . . . . . . . 11 MET HA . 50803 1
96 . 1 . 1 11 11 MET HB2 H 1 2.136 0.01 . . . . . . . 11 MET HB2 . 50803 1
97 . 1 . 1 11 11 MET HB3 H 1 2.064 0.00 . . . . . . . 11 MET HB3 . 50803 1
98 . 1 . 1 11 11 MET HG2 H 1 2.624 0.00 . . . . . . . 11 MET HG2 . 50803 1
99 . 1 . 1 11 11 MET HG3 H 1 2.550 0.00 . . . . . . . 11 MET HG3 . 50803 1
100 . 1 . 1 11 11 MET HE1 H 1 2.085 0.00 . . . . . . . 11 MET HE . 50803 1
101 . 1 . 1 11 11 MET HE2 H 1 2.085 0.00 . . . . . . . 11 MET HE . 50803 1
102 . 1 . 1 11 11 MET HE3 H 1 2.085 0.00 . . . . . . . 11 MET HE . 50803 1
103 . 1 . 1 11 11 MET C C 13 176.900 0.00 . . . . . . . 11 MET C . 50803 1
104 . 1 . 1 11 11 MET CA C 13 56.171 0.03 . . . . . . . 11 MET CA . 50803 1
105 . 1 . 1 11 11 MET CB C 13 32.662 0.03 . . . . . . . 11 MET CB . 50803 1
106 . 1 . 1 11 11 MET CG C 13 31.993 0.10 . . . . . . . 11 MET CG . 50803 1
107 . 1 . 1 11 11 MET CE C 13 16.945 0.00 . . . . . . . 11 MET CE . 50803 1
108 . 1 . 1 11 11 MET N N 15 122.115 0.02 . . . . . . . 11 MET N . 50803 1
109 . 1 . 1 12 12 THR H H 1 8.088 0.00 . . . . . . . 12 THR H . 50803 1
110 . 1 . 1 12 12 THR HA H 1 4.226 0.01 . . . . . . . 12 THR HA . 50803 1
111 . 1 . 1 12 12 THR HB H 1 4.235 0.01 . . . . . . . 12 THR HB . 50803 1
112 . 1 . 1 12 12 THR HG21 H 1 1.216 0.00 . . . . . . . 12 THR HG2 . 50803 1
113 . 1 . 1 12 12 THR HG22 H 1 1.216 0.00 . . . . . . . 12 THR HG2 . 50803 1
114 . 1 . 1 12 12 THR HG23 H 1 1.216 0.00 . . . . . . . 12 THR HG2 . 50803 1
115 . 1 . 1 12 12 THR C C 13 174.978 0.00 . . . . . . . 12 THR C . 50803 1
116 . 1 . 1 12 12 THR CA C 13 63.029 0.09 . . . . . . . 12 THR CA . 50803 1
117 . 1 . 1 12 12 THR CB C 13 69.559 0.02 . . . . . . . 12 THR CB . 50803 1
118 . 1 . 1 12 12 THR CG2 C 13 21.762 0.01 . . . . . . . 12 THR CG2 . 50803 1
119 . 1 . 1 12 12 THR N N 15 115.161 0.02 . . . . . . . 12 THR N . 50803 1
120 . 1 . 1 13 13 ARG H H 1 8.192 0.00 . . . . . . . 13 ARG H . 50803 1
121 . 1 . 1 13 13 ARG HA H 1 4.234 0.00 . . . . . . . 13 ARG HA . 50803 1
122 . 1 . 1 13 13 ARG HB2 H 1 1.850 0.00 . . . . . . . 13 ARG HB2 . 50803 1
123 . 1 . 1 13 13 ARG HB3 H 1 1.806 0.00 . . . . . . . 13 ARG HB3 . 50803 1
124 . 1 . 1 13 13 ARG HG2 H 1 1.647 0.00 . . . . . . . 13 ARG HG2 . 50803 1
125 . 1 . 1 13 13 ARG HG3 H 1 1.586 0.00 . . . . . . . 13 ARG HG3 . 50803 1
126 . 1 . 1 13 13 ARG HD2 H 1 3.190 0.00 . . . . . . . 13 ARG HD . 50803 1
127 . 1 . 1 13 13 ARG HD3 H 1 3.190 0.00 . . . . . . . 13 ARG HD . 50803 1
128 . 1 . 1 13 13 ARG C C 13 176.753 0.00 . . . . . . . 13 ARG C . 50803 1
129 . 1 . 1 13 13 ARG CA C 13 57.130 0.02 . . . . . . . 13 ARG CA . 50803 1
130 . 1 . 1 13 13 ARG CB C 13 30.489 0.02 . . . . . . . 13 ARG CB . 50803 1
131 . 1 . 1 13 13 ARG CG C 13 27.164 0.04 . . . . . . . 13 ARG CG . 50803 1
132 . 1 . 1 13 13 ARG CD C 13 43.386 0.04 . . . . . . . 13 ARG CD . 50803 1
133 . 1 . 1 13 13 ARG N N 15 122.655 0.02 . . . . . . . 13 ARG N . 50803 1
134 . 1 . 1 14 14 LEU H H 1 8.099 0.00 . . . . . . . 14 LEU H . 50803 1
135 . 1 . 1 14 14 LEU HA H 1 4.279 0.00 . . . . . . . 14 LEU HA . 50803 1
136 . 1 . 1 14 14 LEU HB2 H 1 1.652 0.01 . . . . . . . 14 LEU HB2 . 50803 1
137 . 1 . 1 14 14 LEU HB3 H 1 1.592 0.00 . . . . . . . 14 LEU HB3 . 50803 1
138 . 1 . 1 14 14 LEU HG H 1 1.663 0.00 . . . . . . . 14 LEU HG . 50803 1
139 . 1 . 1 14 14 LEU HD11 H 1 0.914 0.00 . . . . . . . 14 LEU HD1 . 50803 1
140 . 1 . 1 14 14 LEU HD12 H 1 0.914 0.00 . . . . . . . 14 LEU HD1 . 50803 1
141 . 1 . 1 14 14 LEU HD13 H 1 0.914 0.00 . . . . . . . 14 LEU HD1 . 50803 1
142 . 1 . 1 14 14 LEU HD21 H 1 0.860 0.00 . . . . . . . 14 LEU HD2 . 50803 1
143 . 1 . 1 14 14 LEU HD22 H 1 0.860 0.00 . . . . . . . 14 LEU HD2 . 50803 1
144 . 1 . 1 14 14 LEU HD23 H 1 0.860 0.00 . . . . . . . 14 LEU HD2 . 50803 1
145 . 1 . 1 14 14 LEU C C 13 177.800 0.00 . . . . . . . 14 LEU C . 50803 1
146 . 1 . 1 14 14 LEU CA C 13 55.791 0.07 . . . . . . . 14 LEU CA . 50803 1
147 . 1 . 1 14 14 LEU CB C 13 42.197 0.04 . . . . . . . 14 LEU CB . 50803 1
148 . 1 . 1 14 14 LEU CG C 13 26.978 0.02 . . . . . . . 14 LEU CG . 50803 1
149 . 1 . 1 14 14 LEU CD1 C 13 24.808 0.06 . . . . . . . 14 LEU CD1 . 50803 1
150 . 1 . 1 14 14 LEU CD2 C 13 23.583 0.10 . . . . . . . 14 LEU CD2 . 50803 1
151 . 1 . 1 14 14 LEU N N 15 122.133 0.02 . . . . . . . 14 LEU N . 50803 1
152 . 1 . 1 15 15 MET H H 1 8.217 0.00 . . . . . . . 15 MET H . 50803 1
153 . 1 . 1 15 15 MET HA H 1 4.405 0.00 . . . . . . . 15 MET HA . 50803 1
154 . 1 . 1 15 15 MET HB2 H 1 2.101 0.01 . . . . . . . 15 MET HB2 . 50803 1
155 . 1 . 1 15 15 MET HB3 H 1 2.044 0.00 . . . . . . . 15 MET HB3 . 50803 1
156 . 1 . 1 15 15 MET HG2 H 1 2.626 0.00 . . . . . . . 15 MET HG2 . 50803 1
157 . 1 . 1 15 15 MET HG3 H 1 2.539 0.00 . . . . . . . 15 MET HG3 . 50803 1
158 . 1 . 1 15 15 MET HE1 H 1 2.085 0.00 . . . . . . . 15 MET HE . 50803 1
159 . 1 . 1 15 15 MET HE2 H 1 2.085 0.00 . . . . . . . 15 MET HE . 50803 1
160 . 1 . 1 15 15 MET HE3 H 1 2.085 0.00 . . . . . . . 15 MET HE . 50803 1
161 . 1 . 1 15 15 MET C C 13 176.669 0.05 . . . . . . . 15 MET C . 50803 1
162 . 1 . 1 15 15 MET CA C 13 55.971 0.08 . . . . . . . 15 MET CA . 50803 1
163 . 1 . 1 15 15 MET CB C 13 32.682 0.03 . . . . . . . 15 MET CB . 50803 1
164 . 1 . 1 15 15 MET CG C 13 32.089 0.01 . . . . . . . 15 MET CG . 50803 1
165 . 1 . 1 15 15 MET CE C 13 16.945 0.00 . . . . . . . 15 MET CE . 50803 1
166 . 1 . 1 15 15 MET N N 15 120.621 0.02 . . . . . . . 15 MET N . 50803 1
167 . 1 . 1 16 16 ARG H H 1 8.226 0.00 . . . . . . . 16 ARG H . 50803 1
168 . 1 . 1 16 16 ARG HA H 1 4.308 0.00 . . . . . . . 16 ARG HA . 50803 1
169 . 1 . 1 16 16 ARG HB2 H 1 1.874 0.00 . . . . . . . 16 ARG HB2 . 50803 1
170 . 1 . 1 16 16 ARG HB3 H 1 1.790 0.01 . . . . . . . 16 ARG HB3 . 50803 1
171 . 1 . 1 16 16 ARG HG2 H 1 1.647 0.00 . . . . . . . 16 ARG HG2 . 50803 1
172 . 1 . 1 16 16 ARG HG3 H 1 1.616 0.00 . . . . . . . 16 ARG HG3 . 50803 1
173 . 1 . 1 16 16 ARG HD2 H 1 3.186 0.00 . . . . . . . 16 ARG HD . 50803 1
174 . 1 . 1 16 16 ARG HD3 H 1 3.186 0.00 . . . . . . . 16 ARG HD . 50803 1
175 . 1 . 1 16 16 ARG C C 13 176.634 0.05 . . . . . . . 16 ARG C . 50803 1
176 . 1 . 1 16 16 ARG CA C 13 56.609 0.04 . . . . . . . 16 ARG CA . 50803 1
177 . 1 . 1 16 16 ARG CB C 13 30.711 0.05 . . . . . . . 16 ARG CB . 50803 1
178 . 1 . 1 16 16 ARG CG C 13 27.133 0.04 . . . . . . . 16 ARG CG . 50803 1
179 . 1 . 1 16 16 ARG CD C 13 43.346 0.00 . . . . . . . 16 ARG CD . 50803 1
180 . 1 . 1 16 16 ARG N N 15 121.514 0.02 . . . . . . . 16 ARG N . 50803 1
181 . 1 . 1 17 17 SER H H 1 8.235 0.00 . . . . . . . 17 SER H . 50803 1
182 . 1 . 1 17 17 SER HA H 1 4.428 0.00 . . . . . . . 17 SER HA . 50803 1
183 . 1 . 1 17 17 SER HB2 H 1 3.906 0.01 . . . . . . . 17 SER HB2 . 50803 1
184 . 1 . 1 17 17 SER HB3 H 1 3.873 0.00 . . . . . . . 17 SER HB3 . 50803 1
185 . 1 . 1 17 17 SER C C 13 174.743 0.00 . . . . . . . 17 SER C . 50803 1
186 . 1 . 1 17 17 SER CA C 13 58.593 0.10 . . . . . . . 17 SER CA . 50803 1
187 . 1 . 1 17 17 SER CB C 13 63.791 0.02 . . . . . . . 17 SER CB . 50803 1
188 . 1 . 1 17 17 SER N N 15 116.357 0.02 . . . . . . . 17 SER N . 50803 1
189 . 1 . 1 18 18 ARG H H 1 8.333 0.00 . . . . . . . 18 ARG H . 50803 1
190 . 1 . 1 18 18 ARG HA H 1 4.413 0.00 . . . . . . . 18 ARG HA . 50803 1
191 . 1 . 1 18 18 ARG HB2 H 1 1.912 0.00 . . . . . . . 18 ARG HB2 . 50803 1
192 . 1 . 1 18 18 ARG HB3 H 1 1.807 0.00 . . . . . . . 18 ARG HB3 . 50803 1
193 . 1 . 1 18 18 ARG HG2 H 1 1.688 0.00 . . . . . . . 18 ARG HG2 . 50803 1
194 . 1 . 1 18 18 ARG HG3 H 1 1.636 0.00 . . . . . . . 18 ARG HG3 . 50803 1
195 . 1 . 1 18 18 ARG HD2 H 1 3.191 0.00 . . . . . . . 18 ARG HD . 50803 1
196 . 1 . 1 18 18 ARG HD3 H 1 3.191 0.00 . . . . . . . 18 ARG HD . 50803 1
197 . 1 . 1 18 18 ARG C C 13 176.614 0.08 . . . . . . . 18 ARG C . 50803 1
198 . 1 . 1 18 18 ARG CA C 13 56.481 0.07 . . . . . . . 18 ARG CA . 50803 1
199 . 1 . 1 18 18 ARG CB C 13 30.811 0.03 . . . . . . . 18 ARG CB . 50803 1
200 . 1 . 1 18 18 ARG CG C 13 27.143 0.05 . . . . . . . 18 ARG CG . 50803 1
201 . 1 . 1 18 18 ARG CD C 13 43.374 0.02 . . . . . . . 18 ARG CD . 50803 1
202 . 1 . 1 18 18 ARG N N 15 122.782 0.05 . . . . . . . 18 ARG N . 50803 1
203 . 1 . 1 19 19 THR H H 1 8.112 0.00 . . . . . . . 19 THR H . 50803 1
204 . 1 . 1 19 19 THR HA H 1 4.327 0.00 . . . . . . . 19 THR HA . 50803 1
205 . 1 . 1 19 19 THR HB H 1 4.233 0.00 . . . . . . . 19 THR HB . 50803 1
206 . 1 . 1 19 19 THR HG21 H 1 1.195 0.00 . . . . . . . 19 THR HG2 . 50803 1
207 . 1 . 1 19 19 THR HG22 H 1 1.195 0.00 . . . . . . . 19 THR HG2 . 50803 1
208 . 1 . 1 19 19 THR HG23 H 1 1.195 0.00 . . . . . . . 19 THR HG2 . 50803 1
209 . 1 . 1 19 19 THR C C 13 174.481 0.00 . . . . . . . 19 THR C . 50803 1
210 . 1 . 1 19 19 THR CA C 13 61.831 0.04 . . . . . . . 19 THR CA . 50803 1
211 . 1 . 1 19 19 THR CB C 13 69.862 0.05 . . . . . . . 19 THR CB . 50803 1
212 . 1 . 1 19 19 THR CG2 C 13 21.653 0.03 . . . . . . . 19 THR CG2 . 50803 1
213 . 1 . 1 19 19 THR N N 15 114.483 0.03 . . . . . . . 19 THR N . 50803 1
214 . 1 . 1 20 20 ALA H H 1 8.322 0.00 . . . . . . . 20 ALA H . 50803 1
215 . 1 . 1 20 20 ALA HA H 1 4.357 0.00 . . . . . . . 20 ALA HA . 50803 1
216 . 1 . 1 20 20 ALA HB1 H 1 1.403 0.00 . . . . . . . 20 ALA HB . 50803 1
217 . 1 . 1 20 20 ALA HB2 H 1 1.403 0.00 . . . . . . . 20 ALA HB . 50803 1
218 . 1 . 1 20 20 ALA HB3 H 1 1.403 0.00 . . . . . . . 20 ALA HB . 50803 1
219 . 1 . 1 20 20 ALA C C 13 177.840 0.00 . . . . . . . 20 ALA C . 50803 1
220 . 1 . 1 20 20 ALA CA C 13 52.725 0.06 . . . . . . . 20 ALA CA . 50803 1
221 . 1 . 1 20 20 ALA CB C 13 19.224 0.04 . . . . . . . 20 ALA CB . 50803 1
222 . 1 . 1 20 20 ALA N N 15 126.477 0.03 . . . . . . . 20 ALA N . 50803 1
223 . 1 . 1 21 21 SER H H 1 8.300 0.00 . . . . . . . 21 SER H . 50803 1
224 . 1 . 1 21 21 SER HA H 1 4.431 0.00 . . . . . . . 21 SER HA . 50803 1
225 . 1 . 1 21 21 SER HB2 H 1 3.901 0.00 . . . . . . . 21 SER HB2 . 50803 1
226 . 1 . 1 21 21 SER HB3 H 1 3.866 0.01 . . . . . . . 21 SER HB3 . 50803 1
227 . 1 . 1 21 21 SER C C 13 175.174 0.01 . . . . . . . 21 SER C . 50803 1
228 . 1 . 1 21 21 SER CA C 13 58.545 0.06 . . . . . . . 21 SER CA . 50803 1
229 . 1 . 1 21 21 SER CB C 13 63.840 0.05 . . . . . . . 21 SER CB . 50803 1
230 . 1 . 1 21 21 SER N N 15 115.055 0.02 . . . . . . . 21 SER N . 50803 1
231 . 1 . 1 22 22 GLY H H 1 8.383 0.00 . . . . . . . 22 GLY H . 50803 1
232 . 1 . 1 22 22 GLY HA2 H 1 4.020 0.00 . . . . . . . 22 GLY HA2 . 50803 1
233 . 1 . 1 22 22 GLY HA3 H 1 3.991 0.00 . . . . . . . 22 GLY HA3 . 50803 1
234 . 1 . 1 22 22 GLY C C 13 174.226 0.01 . . . . . . . 22 GLY C . 50803 1
235 . 1 . 1 22 22 GLY CA C 13 45.445 0.02 . . . . . . . 22 GLY CA . 50803 1
236 . 1 . 1 22 22 GLY N N 15 110.908 0.03 . . . . . . . 22 GLY N . 50803 1
237 . 1 . 1 23 23 SER H H 1 8.194 0.00 . . . . . . . 23 SER H . 50803 1
238 . 1 . 1 23 23 SER HA H 1 4.498 0.05 . . . . . . . 23 SER HA . 50803 1
239 . 1 . 1 23 23 SER HB2 H 1 3.883 0.00 . . . . . . . 23 SER HB2 . 50803 1
240 . 1 . 1 23 23 SER HB3 H 1 3.846 0.00 . . . . . . . 23 SER HB3 . 50803 1
241 . 1 . 1 23 23 SER C C 13 174.629 0.00 . . . . . . . 23 SER C . 50803 1
242 . 1 . 1 23 23 SER CA C 13 58.585 0.93 . . . . . . . 23 SER CA . 50803 1
243 . 1 . 1 23 23 SER CB C 13 63.983 0.03 . . . . . . . 23 SER CB . 50803 1
244 . 1 . 1 23 23 SER N N 15 115.485 0.04 . . . . . . . 23 SER N . 50803 1
245 . 1 . 1 24 24 SER H H 1 8.406 0.01 . . . . . . . 24 SER H . 50803 1
246 . 1 . 1 24 24 SER HA H 1 4.519 0.00 . . . . . . . 24 SER HA . 50803 1
247 . 1 . 1 24 24 SER HB2 H 1 3.890 0.00 . . . . . . . 24 SER HB2 . 50803 1
248 . 1 . 1 24 24 SER HB3 H 1 3.859 0.01 . . . . . . . 24 SER HB3 . 50803 1
249 . 1 . 1 24 24 SER C C 13 174.584 0.01 . . . . . . . 24 SER C . 50803 1
250 . 1 . 1 24 24 SER CA C 13 58.478 0.04 . . . . . . . 24 SER CA . 50803 1
251 . 1 . 1 24 24 SER CB C 13 63.869 0.06 . . . . . . . 24 SER CB . 50803 1
252 . 1 . 1 24 24 SER N N 15 117.945 0.03 . . . . . . . 24 SER N . 50803 1
253 . 1 . 1 25 25 VAL H H 1 8.179 0.01 . . . . . . . 25 VAL H . 50803 1
254 . 1 . 1 25 25 VAL HA H 1 4.210 0.00 . . . . . . . 25 VAL HA . 50803 1
255 . 1 . 1 25 25 VAL HB H 1 2.107 0.00 . . . . . . . 25 VAL HB . 50803 1
256 . 1 . 1 25 25 VAL HG11 H 1 0.928 0.00 . . . . . . . 25 VAL HG . 50803 1
257 . 1 . 1 25 25 VAL HG12 H 1 0.928 0.00 . . . . . . . 25 VAL HG . 50803 1
258 . 1 . 1 25 25 VAL HG13 H 1 0.928 0.00 . . . . . . . 25 VAL HG . 50803 1
259 . 1 . 1 25 25 VAL HG21 H 1 0.928 0.00 . . . . . . . 25 VAL HG . 50803 1
260 . 1 . 1 25 25 VAL HG22 H 1 0.928 0.00 . . . . . . . 25 VAL HG . 50803 1
261 . 1 . 1 25 25 VAL HG23 H 1 0.928 0.00 . . . . . . . 25 VAL HG . 50803 1
262 . 1 . 1 25 25 VAL C C 13 176.440 0.00 . . . . . . . 25 VAL C . 50803 1
263 . 1 . 1 25 25 VAL CA C 13 62.496 0.02 . . . . . . . 25 VAL CA . 50803 1
264 . 1 . 1 25 25 VAL CB C 13 32.700 0.04 . . . . . . . 25 VAL CB . 50803 1
265 . 1 . 1 25 25 VAL CG1 C 13 21.178 0.01 . . . . . . . 25 VAL CG1 . 50803 1
266 . 1 . 1 25 25 VAL CG2 C 13 20.386 0.02 . . . . . . . 25 VAL CG2 . 50803 1
267 . 1 . 1 25 25 VAL N N 15 121.498 0.02 . . . . . . . 25 VAL N . 50803 1
268 . 1 . 1 26 26 THR H H 1 8.221 0.00 . . . . . . . 26 THR H . 50803 1
269 . 1 . 1 26 26 THR HA H 1 4.388 0.00 . . . . . . . 26 THR HA . 50803 1
270 . 1 . 1 26 26 THR HB H 1 4.214 0.01 . . . . . . . 26 THR HB . 50803 1
271 . 1 . 1 26 26 THR HG21 H 1 1.195 0.00 . . . . . . . 26 THR HG2 . 50803 1
272 . 1 . 1 26 26 THR HG22 H 1 1.195 0.00 . . . . . . . 26 THR HG2 . 50803 1
273 . 1 . 1 26 26 THR HG23 H 1 1.195 0.00 . . . . . . . 26 THR HG2 . 50803 1
274 . 1 . 1 26 26 THR C C 13 174.576 0.01 . . . . . . . 26 THR C . 50803 1
275 . 1 . 1 26 26 THR CA C 13 61.853 0.03 . . . . . . . 26 THR CA . 50803 1
276 . 1 . 1 26 26 THR CB C 13 69.864 0.01 . . . . . . . 26 THR CB . 50803 1
277 . 1 . 1 26 26 THR CG2 C 13 21.611 0.03 . . . . . . . 26 THR CG2 . 50803 1
278 . 1 . 1 26 26 THR N N 15 117.395 0.03 . . . . . . . 26 THR N . 50803 1
279 . 1 . 1 27 27 SER H H 1 8.282 0.00 . . . . . . . 27 SER H . 50803 1
280 . 1 . 1 27 27 SER HA H 1 4.463 0.00 . . . . . . . 27 SER HA . 50803 1
281 . 1 . 1 27 27 SER HB2 H 1 3.898 0.00 . . . . . . . 27 SER HB2 . 50803 1
282 . 1 . 1 27 27 SER HB3 H 1 3.845 0.00 . . . . . . . 27 SER HB3 . 50803 1
283 . 1 . 1 27 27 SER C C 13 174.715 0.01 . . . . . . . 27 SER C . 50803 1
284 . 1 . 1 27 27 SER CA C 13 58.263 0.04 . . . . . . . 27 SER CA . 50803 1
285 . 1 . 1 27 27 SER CB C 13 63.839 0.06 . . . . . . . 27 SER CB . 50803 1
286 . 1 . 1 27 27 SER N N 15 118.176 0.04 . . . . . . . 27 SER N . 50803 1
287 . 1 . 1 28 28 LEU H H 1 8.369 0.00 . . . . . . . 28 LEU H . 50803 1
288 . 1 . 1 28 28 LEU HA H 1 4.349 0.00 . . . . . . . 28 LEU HA . 50803 1
289 . 1 . 1 28 28 LEU HB2 H 1 1.637 0.00 . . . . . . . 28 LEU HB2 . 50803 1
290 . 1 . 1 28 28 LEU HB3 H 1 1.585 0.00 . . . . . . . 28 LEU HB3 . 50803 1
291 . 1 . 1 28 28 LEU HG H 1 1.641 0.01 . . . . . . . 28 LEU HG . 50803 1
292 . 1 . 1 28 28 LEU HD11 H 1 0.878 0.00 . . . . . . . 28 LEU HD1 . 50803 1
293 . 1 . 1 28 28 LEU HD12 H 1 0.878 0.00 . . . . . . . 28 LEU HD1 . 50803 1
294 . 1 . 1 28 28 LEU HD13 H 1 0.878 0.00 . . . . . . . 28 LEU HD1 . 50803 1
295 . 1 . 1 28 28 LEU HD21 H 1 0.822 0.00 . . . . . . . 28 LEU HD2 . 50803 1
296 . 1 . 1 28 28 LEU HD22 H 1 0.822 0.00 . . . . . . . 28 LEU HD2 . 50803 1
297 . 1 . 1 28 28 LEU HD23 H 1 0.822 0.00 . . . . . . . 28 LEU HD2 . 50803 1
298 . 1 . 1 28 28 LEU C C 13 177.361 0.00 . . . . . . . 28 LEU C . 50803 1
299 . 1 . 1 28 28 LEU CA C 13 55.481 0.02 . . . . . . . 28 LEU CA . 50803 1
300 . 1 . 1 28 28 LEU CB C 13 42.159 0.01 . . . . . . . 28 LEU CB . 50803 1
301 . 1 . 1 28 28 LEU CG C 13 26.989 0.08 . . . . . . . 28 LEU CG . 50803 1
302 . 1 . 1 28 28 LEU CD1 C 13 24.947 0.03 . . . . . . . 28 LEU CD1 . 50803 1
303 . 1 . 1 28 28 LEU CD2 C 13 23.362 0.02 . . . . . . . 28 LEU CD2 . 50803 1
304 . 1 . 1 28 28 LEU N N 15 124.294 0.02 . . . . . . . 28 LEU N . 50803 1
305 . 1 . 1 29 29 ASP H H 1 8.220 0.00 . . . . . . . 29 ASP H . 50803 1
306 . 1 . 1 29 29 ASP HA H 1 4.571 0.00 . . . . . . . 29 ASP HA . 50803 1
307 . 1 . 1 29 29 ASP HB2 H 1 2.684 0.00 . . . . . . . 29 ASP HB . 50803 1
308 . 1 . 1 29 29 ASP HB3 H 1 2.684 0.00 . . . . . . . 29 ASP HB . 50803 1
309 . 1 . 1 29 29 ASP C C 13 177.018 0.00 . . . . . . . 29 ASP C . 50803 1
310 . 1 . 1 29 29 ASP CA C 13 54.516 0.02 . . . . . . . 29 ASP CA . 50803 1
311 . 1 . 1 29 29 ASP CB C 13 41.159 0.02 . . . . . . . 29 ASP CB . 50803 1
312 . 1 . 1 29 29 ASP N N 15 120.360 0.03 . . . . . . . 29 ASP N . 50803 1
313 . 1 . 1 30 30 GLY H H 1 8.354 0.00 . . . . . . . 30 GLY H . 50803 1
314 . 1 . 1 30 30 GLY HA2 H 1 3.982 0.00 . . . . . . . 30 GLY HA2 . 50803 1
315 . 1 . 1 30 30 GLY HA3 H 1 3.980 0.00 . . . . . . . 30 GLY HA3 . 50803 1
316 . 1 . 1 30 30 GLY C C 13 174.938 0.00 . . . . . . . 30 GLY C . 50803 1
317 . 1 . 1 30 30 GLY CA C 13 45.758 0.02 . . . . . . . 30 GLY CA . 50803 1
318 . 1 . 1 30 30 GLY N N 15 109.556 0.02 . . . . . . . 30 GLY N . 50803 1
319 . 1 . 1 31 31 THR H H 1 8.136 0.00 . . . . . . . 31 THR H . 50803 1
320 . 1 . 1 31 31 THR HA H 1 4.278 0.00 . . . . . . . 31 THR HA . 50803 1
321 . 1 . 1 31 31 THR HB H 1 4.235 0.00 . . . . . . . 31 THR HB . 50803 1
322 . 1 . 1 31 31 THR HG21 H 1 1.195 0.00 . . . . . . . 31 THR HG2 . 50803 1
323 . 1 . 1 31 31 THR HG22 H 1 1.195 0.00 . . . . . . . 31 THR HG2 . 50803 1
324 . 1 . 1 31 31 THR HG23 H 1 1.195 0.00 . . . . . . . 31 THR HG2 . 50803 1
325 . 1 . 1 31 31 THR C C 13 175.086 0.00 . . . . . . . 31 THR C . 50803 1
326 . 1 . 1 31 31 THR CA C 13 62.689 0.02 . . . . . . . 31 THR CA . 50803 1
327 . 1 . 1 31 31 THR CB C 13 69.781 0.03 . . . . . . . 31 THR CB . 50803 1
328 . 1 . 1 31 31 THR CG2 C 13 21.648 0.03 . . . . . . . 31 THR CG2 . 50803 1
329 . 1 . 1 31 31 THR N N 15 113.645 0.02 . . . . . . . 31 THR N . 50803 1
330 . 1 . 1 32 32 ARG H H 1 8.252 0.00 . . . . . . . 32 ARG H . 50803 1
331 . 1 . 1 32 32 ARG HA H 1 4.375 0.00 . . . . . . . 32 ARG HA . 50803 1
332 . 1 . 1 32 32 ARG HB2 H 1 1.878 0.01 . . . . . . . 32 ARG HB2 . 50803 1
333 . 1 . 1 32 32 ARG HB3 H 1 1.787 0.00 . . . . . . . 32 ARG HB3 . 50803 1
334 . 1 . 1 32 32 ARG HG2 H 1 1.647 0.00 . . . . . . . 32 ARG HG2 . 50803 1
335 . 1 . 1 32 32 ARG HG3 H 1 1.616 0.00 . . . . . . . 32 ARG HG3 . 50803 1
336 . 1 . 1 32 32 ARG HD2 H 1 3.185 0.00 . . . . . . . 32 ARG HD . 50803 1
337 . 1 . 1 32 32 ARG HD3 H 1 3.185 0.00 . . . . . . . 32 ARG HD . 50803 1
338 . 1 . 1 32 32 ARG C C 13 176.457 0.00 . . . . . . . 32 ARG C . 50803 1
339 . 1 . 1 32 32 ARG CA C 13 56.251 0.05 . . . . . . . 32 ARG CA . 50803 1
340 . 1 . 1 32 32 ARG CB C 13 30.697 0.05 . . . . . . . 32 ARG CB . 50803 1
341 . 1 . 1 32 32 ARG CG C 13 27.086 0.05 . . . . . . . 32 ARG CG . 50803 1
342 . 1 . 1 32 32 ARG CD C 13 43.348 0.00 . . . . . . . 32 ARG CD . 50803 1
343 . 1 . 1 32 32 ARG N N 15 122.676 0.03 . . . . . . . 32 ARG N . 50803 1
344 . 1 . 1 33 33 SER H H 1 8.271 0.01 . . . . . . . 33 SER H . 50803 1
345 . 1 . 1 33 33 SER HA H 1 4.409 0.00 . . . . . . . 33 SER HA . 50803 1
346 . 1 . 1 33 33 SER HB2 H 1 3.874 0.00 . . . . . . . 33 SER HB2 . 50803 1
347 . 1 . 1 33 33 SER HB3 H 1 3.835 0.00 . . . . . . . 33 SER HB3 . 50803 1
348 . 1 . 1 33 33 SER C C 13 174.699 0.00 . . . . . . . 33 SER C . 50803 1
349 . 1 . 1 33 33 SER CA C 13 58.486 0.06 . . . . . . . 33 SER CA . 50803 1
350 . 1 . 1 33 33 SER CB C 13 63.777 0.01 . . . . . . . 33 SER CB . 50803 1
351 . 1 . 1 33 33 SER N N 15 116.546 0.06 . . . . . . . 33 SER N . 50803 1
352 . 1 . 1 34 34 ARG H H 1 8.367 0.00 . . . . . . . 34 ARG H . 50803 1
353 . 1 . 1 34 34 ARG HA H 1 4.376 0.00 . . . . . . . 34 ARG HA . 50803 1
354 . 1 . 1 34 34 ARG HB2 H 1 1.873 0.00 . . . . . . . 34 ARG HB2 . 50803 1
355 . 1 . 1 34 34 ARG HB3 H 1 1.752 0.00 . . . . . . . 34 ARG HB3 . 50803 1
356 . 1 . 1 34 34 ARG HG2 H 1 1.647 0.00 . . . . . . . 34 ARG HG2 . 50803 1
357 . 1 . 1 34 34 ARG HG3 H 1 1.616 0.00 . . . . . . . 34 ARG HG3 . 50803 1
358 . 1 . 1 34 34 ARG HD2 H 1 3.185 0.00 . . . . . . . 34 ARG HD . 50803 1
359 . 1 . 1 34 34 ARG HD3 H 1 3.185 0.00 . . . . . . . 34 ARG HD . 50803 1
360 . 1 . 1 34 34 ARG C C 13 176.325 0.01 . . . . . . . 34 ARG C . 50803 1
361 . 1 . 1 34 34 ARG CA C 13 56.214 0.02 . . . . . . . 34 ARG CA . 50803 1
362 . 1 . 1 34 34 ARG CB C 13 30.751 0.03 . . . . . . . 34 ARG CB . 50803 1
363 . 1 . 1 34 34 ARG CG C 13 27.069 0.05 . . . . . . . 34 ARG CG . 50803 1
364 . 1 . 1 34 34 ARG CD C 13 43.351 0.00 . . . . . . . 34 ARG CD . 50803 1
365 . 1 . 1 34 34 ARG N N 15 122.906 0.05 . . . . . . . 34 ARG N . 50803 1
366 . 1 . 1 35 35 SER H H 1 8.292 0.00 . . . . . . . 35 SER H . 50803 1
367 . 1 . 1 35 35 SER HA H 1 4.468 0.00 . . . . . . . 35 SER HA . 50803 1
368 . 1 . 1 35 35 SER HB2 H 1 3.865 0.04 . . . . . . . 35 SER HB2 . 50803 1
369 . 1 . 1 35 35 SER HB3 H 1 3.870 0.00 . . . . . . . 35 SER HB3 . 50803 1
370 . 1 . 1 35 35 SER C C 13 174.388 0.00 . . . . . . . 35 SER C . 50803 1
371 . 1 . 1 35 35 SER CA C 13 58.474 0.06 . . . . . . . 35 SER CA . 50803 1
372 . 1 . 1 35 35 SER CB C 13 63.795 0.03 . . . . . . . 35 SER CB . 50803 1
373 . 1 . 1 35 35 SER N N 15 116.442 0.03 . . . . . . . 35 SER N . 50803 1
374 . 1 . 1 36 36 HIS HA H 1 4.729 0.00 . . . . . . . 36 HIS HA . 50803 1
375 . 1 . 1 36 36 HIS HB2 H 1 3.213 0.01 . . . . . . . 36 HIS HB2 . 50803 1
376 . 1 . 1 36 36 HIS HB3 H 1 3.126 0.01 . . . . . . . 36 HIS HB3 . 50803 1
377 . 1 . 1 36 36 HIS HD2 H 1 7.144 0.01 . . . . . . . 36 HIS HD2 . 50803 1
378 . 1 . 1 36 36 HIS HE1 H 1 8.196 0.02 . . . . . . . 36 HIS HE1 . 50803 1
379 . 1 . 1 36 36 HIS C C 13 175.269 0.00 . . . . . . . 36 HIS C . 50803 1
380 . 1 . 1 36 36 HIS CA C 13 56.114 0.02 . . . . . . . 36 HIS CA . 50803 1
381 . 1 . 1 36 36 HIS CB C 13 30.052 0.02 . . . . . . . 36 HIS CB . 50803 1
382 . 1 . 1 36 36 HIS CD2 C 13 120.026 0.02 . . . . . . . 36 HIS CD2 . 50803 1
383 . 1 . 1 36 36 HIS CE1 C 13 137.462 0.10 . . . . . . . 36 HIS CE1 . 50803 1
384 . 1 . 1 36 36 HIS NE2 N 15 176.896 0.01 . . . . . . . 36 HIS NE2 . 50803 1
385 . 1 . 1 37 37 THR H H 1 8.118 0.01 . . . . . . . 37 THR H . 50803 1
386 . 1 . 1 37 37 THR HA H 1 4.368 0.00 . . . . . . . 37 THR HA . 50803 1
387 . 1 . 1 37 37 THR HB H 1 4.231 0.00 . . . . . . . 37 THR HB . 50803 1
388 . 1 . 1 37 37 THR HG21 H 1 1.156 0.00 . . . . . . . 37 THR HG2 . 50803 1
389 . 1 . 1 37 37 THR HG22 H 1 1.156 0.00 . . . . . . . 37 THR HG2 . 50803 1
390 . 1 . 1 37 37 THR HG23 H 1 1.156 0.00 . . . . . . . 37 THR HG2 . 50803 1
391 . 1 . 1 37 37 THR C C 13 174.591 0.00 . . . . . . . 37 THR C . 50803 1
392 . 1 . 1 37 37 THR CA C 13 61.834 0.02 . . . . . . . 37 THR CA . 50803 1
393 . 1 . 1 37 37 THR CB C 13 69.857 0.04 . . . . . . . 37 THR CB . 50803 1
394 . 1 . 1 37 37 THR CG2 C 13 21.521 0.03 . . . . . . . 37 THR CG2 . 50803 1
395 . 1 . 1 37 37 THR N N 15 115.045 0.04 . . . . . . . 37 THR N . 50803 1
396 . 1 . 1 38 38 SER H H 1 8.423 0.00 . . . . . . . 38 SER H . 50803 1
397 . 1 . 1 38 38 SER HA H 1 4.467 0.00 . . . . . . . 38 SER HA . 50803 1
398 . 1 . 1 38 38 SER HB2 H 1 3.901 0.00 . . . . . . . 38 SER HB2 . 50803 1
399 . 1 . 1 38 38 SER HB3 H 1 3.868 0.00 . . . . . . . 38 SER HB3 . 50803 1
400 . 1 . 1 38 38 SER C C 13 174.719 0.00 . . . . . . . 38 SER C . 50803 1
401 . 1 . 1 38 38 SER CA C 13 58.515 0.05 . . . . . . . 38 SER CA . 50803 1
402 . 1 . 1 38 38 SER CB C 13 63.784 0.01 . . . . . . . 38 SER CB . 50803 1
403 . 1 . 1 38 38 SER N N 15 118.032 0.03 . . . . . . . 38 SER N . 50803 1
404 . 1 . 1 39 39 GLU H H 1 8.484 0.00 . . . . . . . 39 GLU H . 50803 1
405 . 1 . 1 39 39 GLU HA H 1 4.285 0.00 . . . . . . . 39 GLU HA . 50803 1
406 . 1 . 1 39 39 GLU HB2 H 1 2.071 0.00 . . . . . . . 39 GLU HB2 . 50803 1
407 . 1 . 1 39 39 GLU HB3 H 1 1.955 0.00 . . . . . . . 39 GLU HB3 . 50803 1
408 . 1 . 1 39 39 GLU HG2 H 1 2.277 0.00 . . . . . . . 39 GLU HG . 50803 1
409 . 1 . 1 39 39 GLU HG3 H 1 2.277 0.00 . . . . . . . 39 GLU HG . 50803 1
410 . 1 . 1 39 39 GLU C C 13 177.158 0.00 . . . . . . . 39 GLU C . 50803 1
411 . 1 . 1 39 39 GLU CA C 13 57.007 0.09 . . . . . . . 39 GLU CA . 50803 1
412 . 1 . 1 39 39 GLU CB C 13 30.193 0.02 . . . . . . . 39 GLU CB . 50803 1
413 . 1 . 1 39 39 GLU CG C 13 36.227 0.01 . . . . . . . 39 GLU CG . 50803 1
414 . 1 . 1 39 39 GLU N N 15 122.935 0.03 . . . . . . . 39 GLU N . 50803 1
415 . 1 . 1 40 40 GLY H H 1 8.416 0.00 . . . . . . . 40 GLY H . 50803 1
416 . 1 . 1 40 40 GLY HA2 H 1 3.992 0.00 . . . . . . . 40 GLY HA . 50803 1
417 . 1 . 1 40 40 GLY HA3 H 1 3.992 0.00 . . . . . . . 40 GLY HA . 50803 1
418 . 1 . 1 40 40 GLY C C 13 174.585 0.01 . . . . . . . 40 GLY C . 50803 1
419 . 1 . 1 40 40 GLY CA C 13 45.491 0.02 . . . . . . . 40 GLY CA . 50803 1
420 . 1 . 1 40 40 GLY N N 15 109.476 0.02 . . . . . . . 40 GLY N . 50803 1
421 . 1 . 1 41 41 THR H H 1 8.059 0.00 . . . . . . . 41 THR H . 50803 1
422 . 1 . 1 41 41 THR HA H 1 4.297 0.00 . . . . . . . 41 THR HA . 50803 1
423 . 1 . 1 41 41 THR HB H 1 4.225 0.01 . . . . . . . 41 THR HB . 50803 1
424 . 1 . 1 41 41 THR HG21 H 1 1.194 0.00 . . . . . . . 41 THR HG2 . 50803 1
425 . 1 . 1 41 41 THR HG22 H 1 1.194 0.00 . . . . . . . 41 THR HG2 . 50803 1
426 . 1 . 1 41 41 THR HG23 H 1 1.194 0.00 . . . . . . . 41 THR HG2 . 50803 1
427 . 1 . 1 41 41 THR C C 13 174.905 0.00 . . . . . . . 41 THR C . 50803 1
428 . 1 . 1 41 41 THR CA C 13 62.260 0.02 . . . . . . . 41 THR CA . 50803 1
429 . 1 . 1 41 41 THR CB C 13 69.732 0.04 . . . . . . . 41 THR CB . 50803 1
430 . 1 . 1 41 41 THR CG2 C 13 21.661 0.04 . . . . . . . 41 THR CG2 . 50803 1
431 . 1 . 1 41 41 THR N N 15 113.853 0.02 . . . . . . . 41 THR N . 50803 1
432 . 1 . 1 42 42 ARG H H 1 8.343 0.00 . . . . . . . 42 ARG H . 50803 1
433 . 1 . 1 42 42 ARG HA H 1 4.368 0.01 . . . . . . . 42 ARG HA . 50803 1
434 . 1 . 1 42 42 ARG HB2 H 1 1.875 0.00 . . . . . . . 42 ARG HB2 . 50803 1
435 . 1 . 1 42 42 ARG HB3 H 1 1.783 0.00 . . . . . . . 42 ARG HB3 . 50803 1
436 . 1 . 1 42 42 ARG HG2 H 1 1.647 0.00 . . . . . . . 42 ARG HG2 . 50803 1
437 . 1 . 1 42 42 ARG HG3 H 1 1.611 0.00 . . . . . . . 42 ARG HG3 . 50803 1
438 . 1 . 1 42 42 ARG HD2 H 1 3.185 0.00 . . . . . . . 42 ARG HD . 50803 1
439 . 1 . 1 42 42 ARG HD3 H 1 3.185 0.00 . . . . . . . 42 ARG HD . 50803 1
440 . 1 . 1 42 42 ARG C C 13 176.449 0.01 . . . . . . . 42 ARG C . 50803 1
441 . 1 . 1 42 42 ARG CA C 13 56.294 0.05 . . . . . . . 42 ARG CA . 50803 1
442 . 1 . 1 42 42 ARG CB C 13 30.710 0.04 . . . . . . . 42 ARG CB . 50803 1
443 . 1 . 1 42 42 ARG CG C 13 27.082 0.05 . . . . . . . 42 ARG CG . 50803 1
444 . 1 . 1 42 42 ARG CD C 13 43.349 0.00 . . . . . . . 42 ARG CD . 50803 1
445 . 1 . 1 42 42 ARG N N 15 123.313 0.03 . . . . . . . 42 ARG N . 50803 1
446 . 1 . 1 43 43 SER H H 1 8.315 0.00 . . . . . . . 43 SER H . 50803 1
447 . 1 . 1 43 43 SER HA H 1 4.409 0.00 . . . . . . . 43 SER HA . 50803 1
448 . 1 . 1 43 43 SER HB2 H 1 3.867 0.01 . . . . . . . 43 SER HB2 . 50803 1
449 . 1 . 1 43 43 SER HB3 H 1 3.836 0.00 . . . . . . . 43 SER HB3 . 50803 1
450 . 1 . 1 43 43 SER C C 13 174.671 0.00 . . . . . . . 43 SER C . 50803 1
451 . 1 . 1 43 43 SER CA C 13 58.461 0.04 . . . . . . . 43 SER CA . 50803 1
452 . 1 . 1 43 43 SER CB C 13 63.775 0.01 . . . . . . . 43 SER CB . 50803 1
453 . 1 . 1 43 43 SER N N 15 116.916 0.02 . . . . . . . 43 SER N . 50803 1
454 . 1 . 1 44 44 ARG H H 1 8.389 0.00 . . . . . . . 44 ARG H . 50803 1
455 . 1 . 1 44 44 ARG HA H 1 4.376 0.00 . . . . . . . 44 ARG HA . 50803 1
456 . 1 . 1 44 44 ARG HB2 H 1 1.873 0.00 . . . . . . . 44 ARG HB2 . 50803 1
457 . 1 . 1 44 44 ARG HB3 H 1 1.759 0.02 . . . . . . . 44 ARG HB3 . 50803 1
458 . 1 . 1 44 44 ARG HG2 H 1 1.647 0.00 . . . . . . . 44 ARG HG2 . 50803 1
459 . 1 . 1 44 44 ARG HG3 H 1 1.616 0.00 . . . . . . . 44 ARG HG3 . 50803 1
460 . 1 . 1 44 44 ARG HD2 H 1 3.185 0.00 . . . . . . . 44 ARG HD . 50803 1
461 . 1 . 1 44 44 ARG HD3 H 1 3.185 0.00 . . . . . . . 44 ARG HD . 50803 1
462 . 1 . 1 44 44 ARG C C 13 176.325 0.01 . . . . . . . 44 ARG C . 50803 1
463 . 1 . 1 44 44 ARG CA C 13 56.214 0.02 . . . . . . . 44 ARG CA . 50803 1
464 . 1 . 1 44 44 ARG CB C 13 30.708 0.04 . . . . . . . 44 ARG CB . 50803 1
465 . 1 . 1 44 44 ARG CG C 13 27.063 0.05 . . . . . . . 44 ARG CG . 50803 1
466 . 1 . 1 44 44 ARG CD C 13 43.350 0.00 . . . . . . . 44 ARG CD . 50803 1
467 . 1 . 1 44 44 ARG N N 15 122.939 0.04 . . . . . . . 44 ARG N . 50803 1
468 . 1 . 1 45 45 SER H H 1 8.292 0.00 . . . . . . . 45 SER H . 50803 1
469 . 1 . 1 45 45 SER HA H 1 4.484 0.03 . . . . . . . 45 SER HA . 50803 1
470 . 1 . 1 45 45 SER HB2 H 1 3.857 0.02 . . . . . . . 45 SER HB2 . 50803 1
471 . 1 . 1 45 45 SER HB3 H 1 3.871 0.00 . . . . . . . 45 SER HB3 . 50803 1
472 . 1 . 1 45 45 SER C C 13 174.388 0.00 . . . . . . . 45 SER C . 50803 1
473 . 1 . 1 45 45 SER CA C 13 58.468 0.04 . . . . . . . 45 SER CA . 50803 1
474 . 1 . 1 45 45 SER CB C 13 63.763 0.00 . . . . . . . 45 SER CB . 50803 1
475 . 1 . 1 45 45 SER N N 15 116.449 0.02 . . . . . . . 45 SER N . 50803 1
476 . 1 . 1 46 46 HIS HA H 1 4.729 0.00 . . . . . . . 46 HIS HA . 50803 1
477 . 1 . 1 46 46 HIS HB2 H 1 3.213 0.01 . . . . . . . 46 HIS HB2 . 50803 1
478 . 1 . 1 46 46 HIS HB3 H 1 3.126 0.01 . . . . . . . 46 HIS HB3 . 50803 1
479 . 1 . 1 46 46 HIS HD2 H 1 7.143 0.01 . . . . . . . 46 HIS HD2 . 50803 1
480 . 1 . 1 46 46 HIS HE1 H 1 8.176 0.02 . . . . . . . 46 HIS HE1 . 50803 1
481 . 1 . 1 46 46 HIS C C 13 175.269 0.00 . . . . . . . 46 HIS C . 50803 1
482 . 1 . 1 46 46 HIS CA C 13 56.114 0.02 . . . . . . . 46 HIS CA . 50803 1
483 . 1 . 1 46 46 HIS CB C 13 30.047 0.02 . . . . . . . 46 HIS CB . 50803 1
484 . 1 . 1 46 46 HIS CD2 C 13 120.026 0.02 . . . . . . . 46 HIS CD2 . 50803 1
485 . 1 . 1 46 46 HIS CE1 C 13 137.525 0.10 . . . . . . . 46 HIS CE1 . 50803 1
486 . 1 . 1 46 46 HIS NE2 N 15 176.993 0.01 . . . . . . . 46 HIS NE2 . 50803 1
487 . 1 . 1 47 47 THR H H 1 8.115 0.01 . . . . . . . 47 THR H . 50803 1
488 . 1 . 1 47 47 THR HA H 1 4.367 0.00 . . . . . . . 47 THR HA . 50803 1
489 . 1 . 1 47 47 THR HB H 1 4.230 0.00 . . . . . . . 47 THR HB . 50803 1
490 . 1 . 1 47 47 THR HG21 H 1 1.166 0.02 . . . . . . . 47 THR HG2 . 50803 1
491 . 1 . 1 47 47 THR HG22 H 1 1.166 0.02 . . . . . . . 47 THR HG2 . 50803 1
492 . 1 . 1 47 47 THR HG23 H 1 1.166 0.02 . . . . . . . 47 THR HG2 . 50803 1
493 . 1 . 1 47 47 THR C C 13 174.595 0.00 . . . . . . . 47 THR C . 50803 1
494 . 1 . 1 47 47 THR CA C 13 61.836 0.02 . . . . . . . 47 THR CA . 50803 1
495 . 1 . 1 47 47 THR CB C 13 69.853 0.04 . . . . . . . 47 THR CB . 50803 1
496 . 1 . 1 47 47 THR CG2 C 13 21.536 0.05 . . . . . . . 47 THR CG2 . 50803 1
497 . 1 . 1 47 47 THR N N 15 115.058 0.02 . . . . . . . 47 THR N . 50803 1
498 . 1 . 1 48 48 SER H H 1 8.421 0.01 . . . . . . . 48 SER H . 50803 1
499 . 1 . 1 48 48 SER HA H 1 4.467 0.00 . . . . . . . 48 SER HA . 50803 1
500 . 1 . 1 48 48 SER HB2 H 1 3.901 0.00 . . . . . . . 48 SER HB2 . 50803 1
501 . 1 . 1 48 48 SER HB3 H 1 3.868 0.00 . . . . . . . 48 SER HB3 . 50803 1
502 . 1 . 1 48 48 SER C C 13 174.718 0.00 . . . . . . . 48 SER C . 50803 1
503 . 1 . 1 48 48 SER CA C 13 58.497 0.09 . . . . . . . 48 SER CA . 50803 1
504 . 1 . 1 48 48 SER CB C 13 63.781 0.01 . . . . . . . 48 SER CB . 50803 1
505 . 1 . 1 48 48 SER N N 15 118.040 0.05 . . . . . . . 48 SER N . 50803 1
506 . 1 . 1 49 49 GLU H H 1 8.483 0.00 . . . . . . . 49 GLU H . 50803 1
507 . 1 . 1 49 49 GLU HA H 1 4.285 0.00 . . . . . . . 49 GLU HA . 50803 1
508 . 1 . 1 49 49 GLU HB2 H 1 2.070 0.00 . . . . . . . 49 GLU HB2 . 50803 1
509 . 1 . 1 49 49 GLU HB3 H 1 1.955 0.00 . . . . . . . 49 GLU HB3 . 50803 1
510 . 1 . 1 49 49 GLU HG2 H 1 2.277 0.00 . . . . . . . 49 GLU HG . 50803 1
511 . 1 . 1 49 49 GLU HG3 H 1 2.277 0.00 . . . . . . . 49 GLU HG . 50803 1
512 . 1 . 1 49 49 GLU C C 13 177.158 0.00 . . . . . . . 49 GLU C . 50803 1
513 . 1 . 1 49 49 GLU CA C 13 57.033 0.03 . . . . . . . 49 GLU CA . 50803 1
514 . 1 . 1 49 49 GLU CB C 13 30.194 0.02 . . . . . . . 49 GLU CB . 50803 1
515 . 1 . 1 49 49 GLU CG C 13 36.227 0.01 . . . . . . . 49 GLU CG . 50803 1
516 . 1 . 1 49 49 GLU N N 15 122.928 0.01 . . . . . . . 49 GLU N . 50803 1
517 . 1 . 1 50 50 GLY H H 1 8.416 0.00 . . . . . . . 50 GLY H . 50803 1
518 . 1 . 1 50 50 GLY HA2 H 1 3.992 0.00 . . . . . . . 50 GLY HA . 50803 1
519 . 1 . 1 50 50 GLY HA3 H 1 3.992 0.00 . . . . . . . 50 GLY HA . 50803 1
520 . 1 . 1 50 50 GLY C C 13 174.585 0.01 . . . . . . . 50 GLY C . 50803 1
521 . 1 . 1 50 50 GLY CA C 13 45.492 0.02 . . . . . . . 50 GLY CA . 50803 1
522 . 1 . 1 50 50 GLY N N 15 109.469 0.04 . . . . . . . 50 GLY N . 50803 1
523 . 1 . 1 51 51 THR H H 1 8.059 0.00 . . . . . . . 51 THR H . 50803 1
524 . 1 . 1 51 51 THR HA H 1 4.297 0.00 . . . . . . . 51 THR HA . 50803 1
525 . 1 . 1 51 51 THR HB H 1 4.226 0.01 . . . . . . . 51 THR HB . 50803 1
526 . 1 . 1 51 51 THR HG21 H 1 1.194 0.00 . . . . . . . 51 THR HG2 . 50803 1
527 . 1 . 1 51 51 THR HG22 H 1 1.194 0.00 . . . . . . . 51 THR HG2 . 50803 1
528 . 1 . 1 51 51 THR HG23 H 1 1.194 0.00 . . . . . . . 51 THR HG2 . 50803 1
529 . 1 . 1 51 51 THR C C 13 174.905 0.00 . . . . . . . 51 THR C . 50803 1
530 . 1 . 1 51 51 THR CA C 13 62.260 0.02 . . . . . . . 51 THR CA . 50803 1
531 . 1 . 1 51 51 THR CB C 13 69.745 0.04 . . . . . . . 51 THR CB . 50803 1
532 . 1 . 1 51 51 THR CG2 C 13 21.661 0.04 . . . . . . . 51 THR CG2 . 50803 1
533 . 1 . 1 51 51 THR N N 15 113.868 0.06 . . . . . . . 51 THR N . 50803 1
534 . 1 . 1 52 52 ARG H H 1 8.343 0.00 . . . . . . . 52 ARG H . 50803 1
535 . 1 . 1 52 52 ARG HA H 1 4.371 0.01 . . . . . . . 52 ARG HA . 50803 1
536 . 1 . 1 52 52 ARG HB2 H 1 1.875 0.00 . . . . . . . 52 ARG HB2 . 50803 1
537 . 1 . 1 52 52 ARG HB3 H 1 1.765 0.02 . . . . . . . 52 ARG HB3 . 50803 1
538 . 1 . 1 52 52 ARG HG2 H 1 1.647 0.00 . . . . . . . 52 ARG HG2 . 50803 1
539 . 1 . 1 52 52 ARG HG3 H 1 1.616 0.00 . . . . . . . 52 ARG HG3 . 50803 1
540 . 1 . 1 52 52 ARG HD2 H 1 3.185 0.00 . . . . . . . 52 ARG HD . 50803 1
541 . 1 . 1 52 52 ARG HD3 H 1 3.185 0.00 . . . . . . . 52 ARG HD . 50803 1
542 . 1 . 1 52 52 ARG C C 13 176.360 0.05 . . . . . . . 52 ARG C . 50803 1
543 . 1 . 1 52 52 ARG CA C 13 56.241 0.06 . . . . . . . 52 ARG CA . 50803 1
544 . 1 . 1 52 52 ARG CB C 13 30.700 0.04 . . . . . . . 52 ARG CB . 50803 1
545 . 1 . 1 52 52 ARG CG C 13 27.088 0.02 . . . . . . . 52 ARG CG . 50803 1
546 . 1 . 1 52 52 ARG CD C 13 43.361 0.01 . . . . . . . 52 ARG CD . 50803 1
547 . 1 . 1 52 52 ARG N N 15 123.313 0.03 . . . . . . . 52 ARG N . 50803 1
548 . 1 . 1 53 53 SER H H 1 8.278 0.01 . . . . . . . 53 SER H . 50803 1
549 . 1 . 1 53 53 SER HA H 1 4.409 0.00 . . . . . . . 53 SER HA . 50803 1
550 . 1 . 1 53 53 SER HB2 H 1 3.860 0.02 . . . . . . . 53 SER HB2 . 50803 1
551 . 1 . 1 53 53 SER HB3 H 1 3.830 0.01 . . . . . . . 53 SER HB3 . 50803 1
552 . 1 . 1 53 53 SER C C 13 174.680 0.01 . . . . . . . 53 SER C . 50803 1
553 . 1 . 1 53 53 SER CA C 13 58.450 0.04 . . . . . . . 53 SER CA . 50803 1
554 . 1 . 1 53 53 SER CB C 13 63.780 0.02 . . . . . . . 53 SER CB . 50803 1
555 . 1 . 1 53 53 SER N N 15 116.433 0.05 . . . . . . . 53 SER N . 50803 1
556 . 1 . 1 54 54 ARG H H 1 8.388 0.00 . . . . . . . 54 ARG H . 50803 1
557 . 1 . 1 54 54 ARG HA H 1 4.376 0.00 . . . . . . . 54 ARG HA . 50803 1
558 . 1 . 1 54 54 ARG HB2 H 1 1.874 0.00 . . . . . . . 54 ARG HB2 . 50803 1
559 . 1 . 1 54 54 ARG HB3 H 1 1.749 0.00 . . . . . . . 54 ARG HB3 . 50803 1
560 . 1 . 1 54 54 ARG HG2 H 1 1.645 0.00 . . . . . . . 54 ARG HG2 . 50803 1
561 . 1 . 1 54 54 ARG HG3 H 1 1.614 0.00 . . . . . . . 54 ARG HG3 . 50803 1
562 . 1 . 1 54 54 ARG HD2 H 1 3.185 0.00 . . . . . . . 54 ARG HD . 50803 1
563 . 1 . 1 54 54 ARG HD3 H 1 3.185 0.00 . . . . . . . 54 ARG HD . 50803 1
564 . 1 . 1 54 54 ARG C C 13 176.326 0.01 . . . . . . . 54 ARG C . 50803 1
565 . 1 . 1 54 54 ARG CA C 13 56.211 0.02 . . . . . . . 54 ARG CA . 50803 1
566 . 1 . 1 54 54 ARG CB C 13 30.727 0.02 . . . . . . . 54 ARG CB . 50803 1
567 . 1 . 1 54 54 ARG CG C 13 27.063 0.05 . . . . . . . 54 ARG CG . 50803 1
568 . 1 . 1 54 54 ARG CD C 13 43.350 0.00 . . . . . . . 54 ARG CD . 50803 1
569 . 1 . 1 54 54 ARG N N 15 122.945 0.04 . . . . . . . 54 ARG N . 50803 1
570 . 1 . 1 55 55 SER H H 1 8.292 0.00 . . . . . . . 55 SER H . 50803 1
571 . 1 . 1 55 55 SER HA H 1 4.522 0.00 . . . . . . . 55 SER HA . 50803 1
572 . 1 . 1 55 55 SER HB2 H 1 3.850 0.02 . . . . . . . 55 SER HB2 . 50803 1
573 . 1 . 1 55 55 SER HB3 H 1 3.871 0.00 . . . . . . . 55 SER HB3 . 50803 1
574 . 1 . 1 55 55 SER C C 13 174.388 0.00 . . . . . . . 55 SER C . 50803 1
575 . 1 . 1 55 55 SER CA C 13 58.330 0.05 . . . . . . . 55 SER CA . 50803 1
576 . 1 . 1 55 55 SER CB C 13 63.800 0.05 . . . . . . . 55 SER CB . 50803 1
577 . 1 . 1 55 55 SER N N 15 116.449 0.02 . . . . . . . 55 SER N . 50803 1
578 . 1 . 1 56 56 HIS HA H 1 4.729 0.00 . . . . . . . 56 HIS HA . 50803 1
579 . 1 . 1 56 56 HIS HB2 H 1 3.213 0.01 . . . . . . . 56 HIS HB2 . 50803 1
580 . 1 . 1 56 56 HIS HB3 H 1 3.126 0.01 . . . . . . . 56 HIS HB3 . 50803 1
581 . 1 . 1 56 56 HIS HD2 H 1 7.143 0.01 . . . . . . . 56 HIS HD2 . 50803 1
582 . 1 . 1 56 56 HIS HE1 H 1 8.175 0.02 . . . . . . . 56 HIS HE1 . 50803 1
583 . 1 . 1 56 56 HIS C C 13 175.224 0.02 . . . . . . . 56 HIS C . 50803 1
584 . 1 . 1 56 56 HIS CA C 13 56.114 0.02 . . . . . . . 56 HIS CA . 50803 1
585 . 1 . 1 56 56 HIS CB C 13 30.047 0.02 . . . . . . . 56 HIS CB . 50803 1
586 . 1 . 1 56 56 HIS CD2 C 13 120.025 0.02 . . . . . . . 56 HIS CD2 . 50803 1
587 . 1 . 1 56 56 HIS CE1 C 13 137.525 0.10 . . . . . . . 56 HIS CE1 . 50803 1
588 . 1 . 1 56 56 HIS NE2 N 15 177.151 0.01 . . . . . . . 56 HIS NE2 . 50803 1
589 . 1 . 1 57 57 THR H H 1 8.119 0.01 . . . . . . . 57 THR H . 50803 1
590 . 1 . 1 57 57 THR HA H 1 4.370 0.00 . . . . . . . 57 THR HA . 50803 1
591 . 1 . 1 57 57 THR HB H 1 4.237 0.01 . . . . . . . 57 THR HB . 50803 1
592 . 1 . 1 57 57 THR HG21 H 1 1.156 0.00 . . . . . . . 57 THR HG2 . 50803 1
593 . 1 . 1 57 57 THR HG22 H 1 1.156 0.00 . . . . . . . 57 THR HG2 . 50803 1
594 . 1 . 1 57 57 THR HG23 H 1 1.156 0.00 . . . . . . . 57 THR HG2 . 50803 1
595 . 1 . 1 57 57 THR C C 13 174.602 0.01 . . . . . . . 57 THR C . 50803 1
596 . 1 . 1 57 57 THR CA C 13 61.830 0.02 . . . . . . . 57 THR CA . 50803 1
597 . 1 . 1 57 57 THR CB C 13 69.851 0.03 . . . . . . . 57 THR CB . 50803 1
598 . 1 . 1 57 57 THR CG2 C 13 21.517 0.03 . . . . . . . 57 THR CG2 . 50803 1
599 . 1 . 1 57 57 THR N N 15 115.013 0.06 . . . . . . . 57 THR N . 50803 1
600 . 1 . 1 58 58 SER H H 1 8.416 0.01 . . . . . . . 58 SER H . 50803 1
601 . 1 . 1 58 58 SER HA H 1 4.454 0.02 . . . . . . . 58 SER HA . 50803 1
602 . 1 . 1 58 58 SER HB2 H 1 3.894 0.00 . . . . . . . 58 SER HB2 . 50803 1
603 . 1 . 1 58 58 SER HB3 H 1 3.867 0.00 . . . . . . . 58 SER HB3 . 50803 1
604 . 1 . 1 58 58 SER C C 13 174.637 0.00 . . . . . . . 58 SER C . 50803 1
605 . 1 . 1 58 58 SER CA C 13 58.544 0.08 . . . . . . . 58 SER CA . 50803 1
606 . 1 . 1 58 58 SER CB C 13 63.772 0.01 . . . . . . . 58 SER CB . 50803 1
607 . 1 . 1 58 58 SER N N 15 117.913 0.26 . . . . . . . 58 SER N . 50803 1
608 . 1 . 1 59 59 GLU H H 1 8.450 0.00 . . . . . . . 59 GLU H . 50803 1
609 . 1 . 1 59 59 GLU HA H 1 4.286 0.00 . . . . . . . 59 GLU HA . 50803 1
610 . 1 . 1 59 59 GLU HB2 H 1 2.070 0.00 . . . . . . . 59 GLU HB2 . 50803 1
611 . 1 . 1 59 59 GLU HB3 H 1 1.954 0.00 . . . . . . . 59 GLU HB3 . 50803 1
612 . 1 . 1 59 59 GLU HG2 H 1 2.277 0.00 . . . . . . . 59 GLU HG . 50803 1
613 . 1 . 1 59 59 GLU HG3 H 1 2.277 0.00 . . . . . . . 59 GLU HG . 50803 1
614 . 1 . 1 59 59 GLU C C 13 176.964 0.00 . . . . . . . 59 GLU C . 50803 1
615 . 1 . 1 59 59 GLU CA C 13 56.990 0.03 . . . . . . . 59 GLU CA . 50803 1
616 . 1 . 1 59 59 GLU CB C 13 30.186 0.02 . . . . . . . 59 GLU CB . 50803 1
617 . 1 . 1 59 59 GLU CG C 13 36.223 0.01 . . . . . . . 59 GLU CG . 50803 1
618 . 1 . 1 59 59 GLU N N 15 122.840 0.04 . . . . . . . 59 GLU N . 50803 1
619 . 1 . 1 60 60 GLY H H 1 8.375 0.00 . . . . . . . 60 GLY H . 50803 1
620 . 1 . 1 60 60 GLY HA2 H 1 3.914 0.00 . . . . . . . 60 GLY HA2 . 50803 1
621 . 1 . 1 60 60 GLY HA3 H 1 3.911 0.00 . . . . . . . 60 GLY HA3 . 50803 1
622 . 1 . 1 60 60 GLY C C 13 173.785 0.01 . . . . . . . 60 GLY C . 50803 1
623 . 1 . 1 60 60 GLY CA C 13 45.230 0.02 . . . . . . . 60 GLY CA . 50803 1
624 . 1 . 1 60 60 GLY N N 15 109.788 0.02 . . . . . . . 60 GLY N . 50803 1
625 . 1 . 1 61 61 ALA H H 1 8.054 0.00 . . . . . . . 61 ALA H . 50803 1
626 . 1 . 1 61 61 ALA HA H 1 4.253 0.00 . . . . . . . 61 ALA HA . 50803 1
627 . 1 . 1 61 61 ALA HB1 H 1 1.313 0.00 . . . . . . . 61 ALA HB . 50803 1
628 . 1 . 1 61 61 ALA HB2 H 1 1.313 0.00 . . . . . . . 61 ALA HB . 50803 1
629 . 1 . 1 61 61 ALA HB3 H 1 1.313 0.00 . . . . . . . 61 ALA HB . 50803 1
630 . 1 . 1 61 61 ALA C C 13 177.634 0.09 . . . . . . . 61 ALA C . 50803 1
631 . 1 . 1 61 61 ALA CA C 13 52.503 0.03 . . . . . . . 61 ALA CA . 50803 1
632 . 1 . 1 61 61 ALA CB C 13 19.281 0.07 . . . . . . . 61 ALA CB . 50803 1
633 . 1 . 1 61 61 ALA N N 15 123.308 0.02 . . . . . . . 61 ALA N . 50803 1
634 . 1 . 1 62 62 HIS H H 1 8.069 0.00 . . . . . . . 62 HIS H . 50803 1
635 . 1 . 1 62 62 HIS HA H 1 4.615 0.00 . . . . . . . 62 HIS HA . 50803 1
636 . 1 . 1 62 62 HIS HB2 H 1 3.171 0.00 . . . . . . . 62 HIS HB2 . 50803 1
637 . 1 . 1 62 62 HIS HB3 H 1 3.119 0.00 . . . . . . . 62 HIS HB3 . 50803 1
638 . 1 . 1 62 62 HIS HD2 H 1 7.169 0.01 . . . . . . . 62 HIS HD2 . 50803 1
639 . 1 . 1 62 62 HIS HE1 H 1 8.332 0.01 . . . . . . . 62 HIS HE1 . 50803 1
640 . 1 . 1 62 62 HIS C C 13 174.588 0.00 . . . . . . . 62 HIS C . 50803 1
641 . 1 . 1 62 62 HIS CA C 13 55.605 0.03 . . . . . . . 62 HIS CA . 50803 1
642 . 1 . 1 62 62 HIS CB C 13 29.452 0.08 . . . . . . . 62 HIS CB . 50803 1
643 . 1 . 1 62 62 HIS CD2 C 13 120.028 0.02 . . . . . . . 62 HIS CD2 . 50803 1
644 . 1 . 1 62 62 HIS CE1 C 13 137.102 0.09 . . . . . . . 62 HIS CE1 . 50803 1
645 . 1 . 1 62 62 HIS N N 15 107.731 0.04 . . . . . . . 62 HIS N . 50803 1
646 . 1 . 1 62 62 HIS NE2 N 15 175.406 0.00 . . . . . . . 62 HIS NE2 . 50803 1
647 . 1 . 1 63 63 LEU H H 1 8.163 0.01 . . . . . . . 63 LEU H . 50803 1
648 . 1 . 1 63 63 LEU HA H 1 4.324 0.00 . . . . . . . 63 LEU HA . 50803 1
649 . 1 . 1 63 63 LEU HB2 H 1 1.569 0.00 . . . . . . . 63 LEU HB2 . 50803 1
650 . 1 . 1 63 63 LEU HB3 H 1 1.512 0.00 . . . . . . . 63 LEU HB3 . 50803 1
651 . 1 . 1 63 63 LEU HG H 1 1.471 0.00 . . . . . . . 63 LEU HG . 50803 1
652 . 1 . 1 63 63 LEU HD11 H 1 0.885 0.01 . . . . . . . 63 LEU HD1 . 50803 1
653 . 1 . 1 63 63 LEU HD12 H 1 0.885 0.01 . . . . . . . 63 LEU HD1 . 50803 1
654 . 1 . 1 63 63 LEU HD13 H 1 0.885 0.01 . . . . . . . 63 LEU HD1 . 50803 1
655 . 1 . 1 63 63 LEU HD21 H 1 0.833 0.01 . . . . . . . 63 LEU HD2 . 50803 1
656 . 1 . 1 63 63 LEU HD22 H 1 0.833 0.01 . . . . . . . 63 LEU HD2 . 50803 1
657 . 1 . 1 63 63 LEU HD23 H 1 0.833 0.01 . . . . . . . 63 LEU HD2 . 50803 1
658 . 1 . 1 63 63 LEU C C 13 176.670 0.00 . . . . . . . 63 LEU C . 50803 1
659 . 1 . 1 63 63 LEU CA C 13 54.942 0.04 . . . . . . . 63 LEU CA . 50803 1
660 . 1 . 1 63 63 LEU CB C 13 42.542 0.03 . . . . . . . 63 LEU CB . 50803 1
661 . 1 . 1 63 63 LEU CG C 13 26.858 0.02 . . . . . . . 63 LEU CG . 50803 1
662 . 1 . 1 63 63 LEU CD1 C 13 24.913 0.03 . . . . . . . 63 LEU CD1 . 50803 1
663 . 1 . 1 63 63 LEU CD2 C 13 23.399 0.04 . . . . . . . 63 LEU CD2 . 50803 1
664 . 1 . 1 63 63 LEU N N 15 123.594 0.03 . . . . . . . 63 LEU N . 50803 1
665 . 1 . 1 64 64 ASP H H 1 8.408 0.00 . . . . . . . 64 ASP H . 50803 1
666 . 1 . 1 64 64 ASP HA H 1 4.612 0.00 . . . . . . . 64 ASP HA . 50803 1
667 . 1 . 1 64 64 ASP HB2 H 1 2.695 0.01 . . . . . . . 64 ASP HB2 . 50803 1
668 . 1 . 1 64 64 ASP HB3 H 1 2.549 0.00 . . . . . . . 64 ASP HB3 . 50803 1
669 . 1 . 1 64 64 ASP C C 13 175.883 0.00 . . . . . . . 64 ASP C . 50803 1
670 . 1 . 1 64 64 ASP CA C 13 54.243 0.02 . . . . . . . 64 ASP CA . 50803 1
671 . 1 . 1 64 64 ASP CB C 13 41.028 0.01 . . . . . . . 64 ASP CB . 50803 1
672 . 1 . 1 64 64 ASP N N 15 121.670 0.02 . . . . . . . 64 ASP N . 50803 1
673 . 1 . 1 65 65 ILE H H 1 8.023 0.00 . . . . . . . 65 ILE H . 50803 1
674 . 1 . 1 65 65 ILE HA H 1 4.238 0.00 . . . . . . . 65 ILE HA . 50803 1
675 . 1 . 1 65 65 ILE HB H 1 1.870 0.00 . . . . . . . 65 ILE HB . 50803 1
676 . 1 . 1 65 65 ILE HG12 H 1 1.406 0.00 . . . . . . . 65 ILE HG12 . 50803 1
677 . 1 . 1 65 65 ILE HG13 H 1 1.145 0.00 . . . . . . . 65 ILE HG13 . 50803 1
678 . 1 . 1 65 65 ILE HG21 H 1 0.858 0.00 . . . . . . . 65 ILE HG2 . 50803 1
679 . 1 . 1 65 65 ILE HG22 H 1 0.858 0.00 . . . . . . . 65 ILE HG2 . 50803 1
680 . 1 . 1 65 65 ILE HG23 H 1 0.858 0.00 . . . . . . . 65 ILE HG2 . 50803 1
681 . 1 . 1 65 65 ILE HD11 H 1 0.832 0.00 . . . . . . . 65 ILE HD1 . 50803 1
682 . 1 . 1 65 65 ILE HD12 H 1 0.832 0.00 . . . . . . . 65 ILE HD1 . 50803 1
683 . 1 . 1 65 65 ILE HD13 H 1 0.832 0.00 . . . . . . . 65 ILE HD1 . 50803 1
684 . 1 . 1 65 65 ILE C C 13 176.247 0.00 . . . . . . . 65 ILE C . 50803 1
685 . 1 . 1 65 65 ILE CA C 13 60.824 0.03 . . . . . . . 65 ILE CA . 50803 1
686 . 1 . 1 65 65 ILE CB C 13 38.877 0.03 . . . . . . . 65 ILE CB . 50803 1
687 . 1 . 1 65 65 ILE CG1 C 13 27.030 0.05 . . . . . . . 65 ILE CG1 . 50803 1
688 . 1 . 1 65 65 ILE CG2 C 13 17.616 0.01 . . . . . . . 65 ILE CG2 . 50803 1
689 . 1 . 1 65 65 ILE CD1 C 13 13.052 0.02 . . . . . . . 65 ILE CD1 . 50803 1
690 . 1 . 1 65 65 ILE N N 15 120.422 0.02 . . . . . . . 65 ILE N . 50803 1
691 . 1 . 1 66 66 THR H H 1 8.320 0.00 . . . . . . . 66 THR H . 50803 1
692 . 1 . 1 66 66 THR HA H 1 4.573 0.00 . . . . . . . 66 THR HA . 50803 1
693 . 1 . 1 66 66 THR HB H 1 4.147 0.00 . . . . . . . 66 THR HB . 50803 1
694 . 1 . 1 66 66 THR HG21 H 1 1.236 0.00 . . . . . . . 66 THR HG2 . 50803 1
695 . 1 . 1 66 66 THR HG22 H 1 1.236 0.00 . . . . . . . 66 THR HG2 . 50803 1
696 . 1 . 1 66 66 THR HG23 H 1 1.236 0.00 . . . . . . . 66 THR HG2 . 50803 1
697 . 1 . 1 66 66 THR C C 13 172.961 0.00 . . . . . . . 66 THR C . 50803 1
698 . 1 . 1 66 66 THR CA C 13 59.969 0.04 . . . . . . . 66 THR CA . 50803 1
699 . 1 . 1 66 66 THR CB C 13 69.612 0.02 . . . . . . . 66 THR CB . 50803 1
700 . 1 . 1 66 66 THR CG2 C 13 21.465 0.03 . . . . . . . 66 THR CG2 . 50803 1
701 . 1 . 1 66 66 THR N N 15 121.031 0.02 . . . . . . . 66 THR N . 50803 1
702 . 1 . 1 67 67 PRO HA H 1 4.403 0.00 . . . . . . . 67 PRO HA . 50803 1
703 . 1 . 1 67 67 PRO HB2 H 1 2.290 0.00 . . . . . . . 67 PRO HB2 . 50803 1
704 . 1 . 1 67 67 PRO HB3 H 1 1.909 0.02 . . . . . . . 67 PRO HB3 . 50803 1
705 . 1 . 1 67 67 PRO HG2 H 1 2.026 0.00 . . . . . . . 67 PRO HG2 . 50803 1
706 . 1 . 1 67 67 PRO HG3 H 1 1.972 0.00 . . . . . . . 67 PRO HG3 . 50803 1
707 . 1 . 1 67 67 PRO HD2 H 1 3.860 0.00 . . . . . . . 67 PRO HD2 . 50803 1
708 . 1 . 1 67 67 PRO HD3 H 1 3.705 0.00 . . . . . . . 67 PRO HD3 . 50803 1
709 . 1 . 1 67 67 PRO C C 13 176.743 0.01 . . . . . . . 67 PRO C . 50803 1
710 . 1 . 1 67 67 PRO CA C 13 63.357 0.06 . . . . . . . 67 PRO CA . 50803 1
711 . 1 . 1 67 67 PRO CB C 13 32.125 0.03 . . . . . . . 67 PRO CB . 50803 1
712 . 1 . 1 67 67 PRO CG C 13 27.366 0.03 . . . . . . . 67 PRO CG . 50803 1
713 . 1 . 1 67 67 PRO CD C 13 51.097 0.05 . . . . . . . 67 PRO CD . 50803 1
714 . 1 . 1 68 68 ASN H H 1 8.539 0.00 . . . . . . . 68 ASN H . 50803 1
715 . 1 . 1 68 68 ASN HA H 1 4.682 0.00 . . . . . . . 68 ASN HA . 50803 1
716 . 1 . 1 68 68 ASN HB2 H 1 2.855 0.00 . . . . . . . 68 ASN HB2 . 50803 1
717 . 1 . 1 68 68 ASN HB3 H 1 2.783 0.00 . . . . . . . 68 ASN HB3 . 50803 1
718 . 1 . 1 68 68 ASN C C 13 175.452 0.00 . . . . . . . 68 ASN C . 50803 1
719 . 1 . 1 68 68 ASN CA C 13 53.354 0.02 . . . . . . . 68 ASN CA . 50803 1
720 . 1 . 1 68 68 ASN CB C 13 38.747 0.02 . . . . . . . 68 ASN CB . 50803 1
721 . 1 . 1 68 68 ASN N N 15 118.683 0.02 . . . . . . . 68 ASN N . 50803 1
722 . 1 . 1 69 69 SER H H 1 8.296 0.00 . . . . . . . 69 SER H . 50803 1
723 . 1 . 1 69 69 SER HA H 1 4.402 0.00 . . . . . . . 69 SER HA . 50803 1
724 . 1 . 1 69 69 SER HB2 H 1 3.925 0.00 . . . . . . . 69 SER HB2 . 50803 1
725 . 1 . 1 69 69 SER HB3 H 1 3.859 0.01 . . . . . . . 69 SER HB3 . 50803 1
726 . 1 . 1 69 69 SER C C 13 175.169 0.01 . . . . . . . 69 SER C . 50803 1
727 . 1 . 1 69 69 SER CA C 13 58.823 0.03 . . . . . . . 69 SER CA . 50803 1
728 . 1 . 1 69 69 SER CB C 13 63.792 0.03 . . . . . . . 69 SER CB . 50803 1
729 . 1 . 1 69 69 SER N N 15 116.307 0.05 . . . . . . . 69 SER N . 50803 1
730 . 1 . 1 70 70 GLY H H 1 8.438 0.00 . . . . . . . 70 GLY H . 50803 1
731 . 1 . 1 70 70 GLY HA2 H 1 3.954 0.00 . . . . . . . 70 GLY HA . 50803 1
732 . 1 . 1 70 70 GLY HA3 H 1 3.954 0.00 . . . . . . . 70 GLY HA . 50803 1
733 . 1 . 1 70 70 GLY C C 13 174.042 0.00 . . . . . . . 70 GLY C . 50803 1
734 . 1 . 1 70 70 GLY CA C 13 45.374 0.01 . . . . . . . 70 GLY CA . 50803 1
735 . 1 . 1 70 70 GLY N N 15 110.782 0.02 . . . . . . . 70 GLY N . 50803 1
736 . 1 . 1 71 71 ALA H H 1 8.095 0.00 . . . . . . . 71 ALA H . 50803 1
737 . 1 . 1 71 71 ALA HA H 1 4.300 0.00 . . . . . . . 71 ALA HA . 50803 1
738 . 1 . 1 71 71 ALA HB1 H 1 1.370 0.00 . . . . . . . 71 ALA HB . 50803 1
739 . 1 . 1 71 71 ALA HB2 H 1 1.370 0.00 . . . . . . . 71 ALA HB . 50803 1
740 . 1 . 1 71 71 ALA HB3 H 1 1.370 0.00 . . . . . . . 71 ALA HB . 50803 1
741 . 1 . 1 71 71 ALA C C 13 177.714 0.00 . . . . . . . 71 ALA C . 50803 1
742 . 1 . 1 71 71 ALA CA C 13 52.600 0.07 . . . . . . . 71 ALA CA . 50803 1
743 . 1 . 1 71 71 ALA CB C 13 19.243 0.03 . . . . . . . 71 ALA CB . 50803 1
744 . 1 . 1 71 71 ALA N N 15 123.825 0.06 . . . . . . . 71 ALA N . 50803 1
745 . 1 . 1 72 72 ALA H H 1 8.292 0.00 . . . . . . . 72 ALA H . 50803 1
746 . 1 . 1 72 72 ALA HA H 1 4.300 0.00 . . . . . . . 72 ALA HA . 50803 1
747 . 1 . 1 72 72 ALA HB1 H 1 1.394 0.00 . . . . . . . 72 ALA HB . 50803 1
748 . 1 . 1 72 72 ALA HB2 H 1 1.394 0.00 . . . . . . . 72 ALA HB . 50803 1
749 . 1 . 1 72 72 ALA HB3 H 1 1.394 0.00 . . . . . . . 72 ALA HB . 50803 1
750 . 1 . 1 72 72 ALA C C 13 178.390 0.00 . . . . . . . 72 ALA C . 50803 1
751 . 1 . 1 72 72 ALA CA C 13 52.689 0.04 . . . . . . . 72 ALA CA . 50803 1
752 . 1 . 1 72 72 ALA CB C 13 19.164 0.05 . . . . . . . 72 ALA CB . 50803 1
753 . 1 . 1 72 72 ALA N N 15 123.027 0.03 . . . . . . . 72 ALA N . 50803 1
754 . 1 . 1 73 73 GLY H H 1 8.278 0.00 . . . . . . . 73 GLY H . 50803 1
755 . 1 . 1 73 73 GLY HA2 H 1 3.937 0.00 . . . . . . . 73 GLY HA . 50803 1
756 . 1 . 1 73 73 GLY HA3 H 1 3.937 0.00 . . . . . . . 73 GLY HA . 50803 1
757 . 1 . 1 73 73 GLY C C 13 174.124 0.07 . . . . . . . 73 GLY C . 50803 1
758 . 1 . 1 73 73 GLY CA C 13 45.380 0.01 . . . . . . . 73 GLY CA . 50803 1
759 . 1 . 1 73 73 GLY N N 15 107.726 0.02 . . . . . . . 73 GLY N . 50803 1
760 . 1 . 1 74 74 ASN H H 1 8.276 0.01 . . . . . . . 74 ASN H . 50803 1
761 . 1 . 1 74 74 ASN HA H 1 4.759 0.00 . . . . . . . 74 ASN HA . 50803 1
762 . 1 . 1 74 74 ASN HB2 H 1 2.842 0.00 . . . . . . . 74 ASN HB2 . 50803 1
763 . 1 . 1 74 74 ASN HB3 H 1 2.773 0.00 . . . . . . . 74 ASN HB3 . 50803 1
764 . 1 . 1 74 74 ASN C C 13 175.493 0.05 . . . . . . . 74 ASN C . 50803 1
765 . 1 . 1 74 74 ASN CA C 13 53.208 0.03 . . . . . . . 74 ASN CA . 50803 1
766 . 1 . 1 74 74 ASN CB C 13 39.015 0.05 . . . . . . . 74 ASN CB . 50803 1
767 . 1 . 1 74 74 ASN N N 15 118.697 0.06 . . . . . . . 74 ASN N . 50803 1
768 . 1 . 1 75 75 SER H H 1 8.331 0.00 . . . . . . . 75 SER H . 50803 1
769 . 1 . 1 75 75 SER HA H 1 4.429 0.00 . . . . . . . 75 SER HA . 50803 1
770 . 1 . 1 75 75 SER HB2 H 1 3.883 0.01 . . . . . . . 75 SER HB2 . 50803 1
771 . 1 . 1 75 75 SER HB3 H 1 3.867 0.01 . . . . . . . 75 SER HB3 . 50803 1
772 . 1 . 1 75 75 SER C C 13 174.182 0.00 . . . . . . . 75 SER C . 50803 1
773 . 1 . 1 75 75 SER CA C 13 58.553 0.05 . . . . . . . 75 SER CA . 50803 1
774 . 1 . 1 75 75 SER CB C 13 63.853 0.06 . . . . . . . 75 SER CB . 50803 1
775 . 1 . 1 75 75 SER N N 15 116.484 0.03 . . . . . . . 75 SER N . 50803 1
776 . 1 . 1 76 76 ALA H H 1 8.301 0.00 . . . . . . . 76 ALA H . 50803 1
777 . 1 . 1 76 76 ALA HA H 1 4.393 0.00 . . . . . . . 76 ALA HA . 50803 1
778 . 1 . 1 76 76 ALA HB1 H 1 1.396 0.00 . . . . . . . 76 ALA HB . 50803 1
779 . 1 . 1 76 76 ALA HB2 H 1 1.396 0.00 . . . . . . . 76 ALA HB . 50803 1
780 . 1 . 1 76 76 ALA HB3 H 1 1.396 0.00 . . . . . . . 76 ALA HB . 50803 1
781 . 1 . 1 76 76 ALA C C 13 177.727 0.03 . . . . . . . 76 ALA C . 50803 1
782 . 1 . 1 76 76 ALA CA C 13 52.455 0.03 . . . . . . . 76 ALA CA . 50803 1
783 . 1 . 1 76 76 ALA CB C 13 19.471 0.06 . . . . . . . 76 ALA CB . 50803 1
784 . 1 . 1 76 76 ALA N N 15 125.720 0.04 . . . . . . . 76 ALA N . 50803 1
785 . 1 . 1 77 77 GLY H H 1 8.131 0.00 . . . . . . . 77 GLY H . 50803 1
786 . 1 . 1 77 77 GLY HA2 H 1 4.114 0.00 . . . . . . . 77 GLY HA2 . 50803 1
787 . 1 . 1 77 77 GLY HA3 H 1 4.049 0.00 . . . . . . . 77 GLY HA3 . 50803 1
788 . 1 . 1 77 77 GLY C C 13 171.843 0.00 . . . . . . . 77 GLY C . 50803 1
789 . 1 . 1 77 77 GLY CA C 13 44.555 0.01 . . . . . . . 77 GLY CA . 50803 1
790 . 1 . 1 77 77 GLY N N 15 108.162 0.02 . . . . . . . 77 GLY N . 50803 1
791 . 1 . 1 78 78 PRO HA H 1 4.418 0.00 . . . . . . . 78 PRO HA . 50803 1
792 . 1 . 1 78 78 PRO HB2 H 1 2.279 0.00 . . . . . . . 78 PRO HB2 . 50803 1
793 . 1 . 1 78 78 PRO HB3 H 1 1.918 0.00 . . . . . . . 78 PRO HB3 . 50803 1
794 . 1 . 1 78 78 PRO HG2 H 1 2.003 0.00 . . . . . . . 78 PRO HG . 50803 1
795 . 1 . 1 78 78 PRO HG3 H 1 2.003 0.00 . . . . . . . 78 PRO HG . 50803 1
796 . 1 . 1 78 78 PRO HD2 H 1 3.615 0.00 . . . . . . . 78 PRO HD . 50803 1
797 . 1 . 1 78 78 PRO HD3 H 1 3.615 0.00 . . . . . . . 78 PRO HD . 50803 1
798 . 1 . 1 78 78 PRO C C 13 177.333 0.00 . . . . . . . 78 PRO C . 50803 1
799 . 1 . 1 78 78 PRO CA C 13 63.217 0.02 . . . . . . . 78 PRO CA . 50803 1
800 . 1 . 1 78 78 PRO CB C 13 32.165 0.02 . . . . . . . 78 PRO CB . 50803 1
801 . 1 . 1 78 78 PRO CG C 13 27.234 0.06 . . . . . . . 78 PRO CG . 50803 1
802 . 1 . 1 78 78 PRO CD C 13 49.825 0.02 . . . . . . . 78 PRO CD . 50803 1
803 . 1 . 1 79 79 LYS H H 1 8.457 0.00 . . . . . . . 79 LYS H . 50803 1
804 . 1 . 1 79 79 LYS HA H 1 4.317 0.00 . . . . . . . 79 LYS HA . 50803 1
805 . 1 . 1 79 79 LYS HB2 H 1 1.843 0.00 . . . . . . . 79 LYS HB2 . 50803 1
806 . 1 . 1 79 79 LYS HB3 H 1 1.756 0.00 . . . . . . . 79 LYS HB3 . 50803 1
807 . 1 . 1 79 79 LYS HG2 H 1 1.466 0.00 . . . . . . . 79 LYS HG2 . 50803 1
808 . 1 . 1 79 79 LYS HG3 H 1 1.431 0.00 . . . . . . . 79 LYS HG3 . 50803 1
809 . 1 . 1 79 79 LYS HD2 H 1 1.676 0.00 . . . . . . . 79 LYS HD . 50803 1
810 . 1 . 1 79 79 LYS HD3 H 1 1.676 0.00 . . . . . . . 79 LYS HD . 50803 1
811 . 1 . 1 79 79 LYS HE2 H 1 2.995 0.00 . . . . . . . 79 LYS HE . 50803 1
812 . 1 . 1 79 79 LYS HE3 H 1 2.995 0.00 . . . . . . . 79 LYS HE . 50803 1
813 . 1 . 1 79 79 LYS C C 13 176.813 0.00 . . . . . . . 79 LYS C . 50803 1
814 . 1 . 1 79 79 LYS CA C 13 56.297 0.04 . . . . . . . 79 LYS CA . 50803 1
815 . 1 . 1 79 79 LYS CB C 13 32.949 0.04 . . . . . . . 79 LYS CB . 50803 1
816 . 1 . 1 79 79 LYS CG C 13 24.739 0.01 . . . . . . . 79 LYS CG . 50803 1
817 . 1 . 1 79 79 LYS CD C 13 28.984 0.01 . . . . . . . 79 LYS CD . 50803 1
818 . 1 . 1 79 79 LYS CE C 13 42.174 0.01 . . . . . . . 79 LYS CE . 50803 1
819 . 1 . 1 79 79 LYS N N 15 121.518 0.02 . . . . . . . 79 LYS N . 50803 1
820 . 1 . 1 80 80 SER H H 1 8.283 0.00 . . . . . . . 80 SER H . 50803 1
821 . 1 . 1 80 80 SER HA H 1 4.407 0.01 . . . . . . . 80 SER HA . 50803 1
822 . 1 . 1 80 80 SER HB2 H 1 3.872 0.01 . . . . . . . 80 SER HB2 . 50803 1
823 . 1 . 1 80 80 SER HB3 H 1 3.837 0.00 . . . . . . . 80 SER HB3 . 50803 1
824 . 1 . 1 80 80 SER C C 13 174.588 0.00 . . . . . . . 80 SER C . 50803 1
825 . 1 . 1 80 80 SER CA C 13 58.437 0.03 . . . . . . . 80 SER CA . 50803 1
826 . 1 . 1 80 80 SER CB C 13 63.764 0.01 . . . . . . . 80 SER CB . 50803 1
827 . 1 . 1 80 80 SER N N 15 116.831 0.02 . . . . . . . 80 SER N . 50803 1
828 . 1 . 1 81 81 MET H H 1 8.397 0.00 . . . . . . . 81 MET H . 50803 1
829 . 1 . 1 81 81 MET HA H 1 4.503 0.00 . . . . . . . 81 MET HA . 50803 1
830 . 1 . 1 81 81 MET HB2 H 1 2.114 0.00 . . . . . . . 81 MET HB2 . 50803 1
831 . 1 . 1 81 81 MET HB3 H 1 1.983 0.00 . . . . . . . 81 MET HB3 . 50803 1
832 . 1 . 1 81 81 MET HG2 H 1 2.600 0.00 . . . . . . . 81 MET HG2 . 50803 1
833 . 1 . 1 81 81 MET HG3 H 1 2.520 0.00 . . . . . . . 81 MET HG3 . 50803 1
834 . 1 . 1 81 81 MET HE1 H 1 2.073 0.00 . . . . . . . 81 MET HE . 50803 1
835 . 1 . 1 81 81 MET HE2 H 1 2.073 0.00 . . . . . . . 81 MET HE . 50803 1
836 . 1 . 1 81 81 MET HE3 H 1 2.073 0.00 . . . . . . . 81 MET HE . 50803 1
837 . 1 . 1 81 81 MET C C 13 176.046 0.04 . . . . . . . 81 MET C . 50803 1
838 . 1 . 1 81 81 MET CA C 13 55.410 0.03 . . . . . . . 81 MET CA . 50803 1
839 . 1 . 1 81 81 MET CB C 13 32.835 0.05 . . . . . . . 81 MET CB . 50803 1
840 . 1 . 1 81 81 MET CG C 13 31.965 0.06 . . . . . . . 81 MET CG . 50803 1
841 . 1 . 1 81 81 MET CE C 13 16.834 0.00 . . . . . . . 81 MET CE . 50803 1
842 . 1 . 1 81 81 MET N N 15 122.062 0.05 . . . . . . . 81 MET N . 50803 1
843 . 1 . 1 82 82 GLU H H 1 8.329 0.00 . . . . . . . 82 GLU H . 50803 1
844 . 1 . 1 82 82 GLU HA H 1 4.301 0.01 . . . . . . . 82 GLU HA . 50803 1
845 . 1 . 1 82 82 GLU HB2 H 1 2.023 0.00 . . . . . . . 82 GLU HB2 . 50803 1
846 . 1 . 1 82 82 GLU HB3 H 1 1.912 0.00 . . . . . . . 82 GLU HB3 . 50803 1
847 . 1 . 1 82 82 GLU HG2 H 1 2.261 0.00 . . . . . . . 82 GLU HG2 . 50803 1
848 . 1 . 1 82 82 GLU HG3 H 1 2.214 0.00 . . . . . . . 82 GLU HG3 . 50803 1
849 . 1 . 1 82 82 GLU C C 13 176.280 0.00 . . . . . . . 82 GLU C . 50803 1
850 . 1 . 1 82 82 GLU CA C 13 56.558 0.06 . . . . . . . 82 GLU CA . 50803 1
851 . 1 . 1 82 82 GLU CB C 13 30.317 0.03 . . . . . . . 82 GLU CB . 50803 1
852 . 1 . 1 82 82 GLU CG C 13 36.244 0.03 . . . . . . . 82 GLU CG . 50803 1
853 . 1 . 1 82 82 GLU N N 15 122.070 0.06 . . . . . . . 82 GLU N . 50803 1
854 . 1 . 1 83 83 VAL H H 1 8.176 0.00 . . . . . . . 83 VAL H . 50803 1
855 . 1 . 1 83 83 VAL HA H 1 4.192 0.00 . . . . . . . 83 VAL HA . 50803 1
856 . 1 . 1 83 83 VAL HB H 1 2.096 0.00 . . . . . . . 83 VAL HB . 50803 1
857 . 1 . 1 83 83 VAL HG11 H 1 0.942 0.00 . . . . . . . 83 VAL HG1 . 50803 1
858 . 1 . 1 83 83 VAL HG12 H 1 0.942 0.00 . . . . . . . 83 VAL HG1 . 50803 1
859 . 1 . 1 83 83 VAL HG13 H 1 0.942 0.00 . . . . . . . 83 VAL HG1 . 50803 1
860 . 1 . 1 83 83 VAL HG21 H 1 0.933 0.00 . . . . . . . 83 VAL HG2 . 50803 1
861 . 1 . 1 83 83 VAL HG22 H 1 0.933 0.00 . . . . . . . 83 VAL HG2 . 50803 1
862 . 1 . 1 83 83 VAL HG23 H 1 0.933 0.00 . . . . . . . 83 VAL HG2 . 50803 1
863 . 1 . 1 83 83 VAL C C 13 176.059 0.00 . . . . . . . 83 VAL C . 50803 1
864 . 1 . 1 83 83 VAL CA C 13 62.024 0.03 . . . . . . . 83 VAL CA . 50803 1
865 . 1 . 1 83 83 VAL CB C 13 32.995 0.04 . . . . . . . 83 VAL CB . 50803 1
866 . 1 . 1 83 83 VAL CG1 C 13 21.246 0.03 . . . . . . . 83 VAL CG1 . 50803 1
867 . 1 . 1 83 83 VAL CG2 C 13 20.362 0.02 . . . . . . . 83 VAL CG2 . 50803 1
868 . 1 . 1 83 83 VAL N N 15 120.974 0.02 . . . . . . . 83 VAL N . 50803 1
869 . 1 . 1 84 84 SER H H 1 8.452 0.00 . . . . . . . 84 SER H . 50803 1
870 . 1 . 1 84 84 SER HA H 1 4.521 0.00 . . . . . . . 84 SER HA . 50803 1
871 . 1 . 1 84 84 SER HB2 H 1 3.864 0.00 . . . . . . . 84 SER HB . 50803 1
872 . 1 . 1 84 84 SER HB3 H 1 3.864 0.00 . . . . . . . 84 SER HB . 50803 1
873 . 1 . 1 84 84 SER C C 13 173.571 0.01 . . . . . . . 84 SER C . 50803 1
874 . 1 . 1 84 84 SER CA C 13 58.288 0.02 . . . . . . . 84 SER CA . 50803 1
875 . 1 . 1 84 84 SER CB C 13 63.956 0.04 . . . . . . . 84 SER CB . 50803 1
876 . 1 . 1 84 84 SER N N 15 120.152 0.02 . . . . . . . 84 SER N . 50803 1
877 . 1 . 1 85 85 CYS H H 1 8.057 0.00 . . . . . . . 85 CYS H . 50803 1
878 . 1 . 1 85 85 CYS HA H 1 4.401 0.00 . . . . . . . 85 CYS HA . 50803 1
879 . 1 . 1 85 85 CYS HB2 H 1 2.924 0.00 . . . . . . . 85 CYS HB . 50803 1
880 . 1 . 1 85 85 CYS HB3 H 1 2.924 0.00 . . . . . . . 85 CYS HB . 50803 1
881 . 1 . 1 85 85 CYS C C 13 178.588 0.00 . . . . . . . 85 CYS C . 50803 1
882 . 1 . 1 85 85 CYS CA C 13 59.390 0.03 . . . . . . . 85 CYS CA . 50803 1
883 . 1 . 1 85 85 CYS CB C 13 29.056 0.03 . . . . . . . 85 CYS CB . 50803 1
884 . 1 . 1 85 85 CYS N N 15 125.344 0.02 . . . . . . . 85 CYS N . 50803 1
stop_
save_