Content for NMR-STAR saveframe, "assigned_chemical_shifts_3"
save_assigned_chemical_shifts_3
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_3
_Assigned_chem_shift_list.Entry_ID 51942
_Assigned_chem_shift_list.ID 3
_Assigned_chem_shift_list.Name Chemical-shifts_H2O_05C
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2
_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
13 '2D 1H-1H TOCSY' . . . 51942 3
14 '2D 1H-1H NOESY' . . . 51942 3
15 '2D 1H-13C HSQC aliphatic' . . . 51942 3
16 '2D 1H-13C HSQC aromatic' . . . 51942 3
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
2 $software_2 . . 51942 3
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 1 1 SER HA H 1 4.082 0.002 . 1 . . . . . 1 SER HA . 51942 3
2 . 1 . 1 1 1 SER HB2 H 1 3.914 0.001 . 2 . . . . . 1 SER HB2 . 51942 3
3 . 1 . 1 1 1 SER HB3 H 1 3.964 0.005 . 2 . . . . . 1 SER HB3 . 51942 3
4 . 1 . 1 1 1 SER CA C 13 57.222 0.000 . 1 . . . . . 1 SER CA . 51942 3
5 . 1 . 1 1 1 SER CB C 13 63.055 0.002 . 1 . . . . . 1 SER CB . 51942 3
6 . 1 . 1 2 2 TYR H H 1 8.779 0.000 . 1 . . . . . 2 TYR H . 51942 3
7 . 1 . 1 2 2 TYR HA H 1 4.737 0.001 . 1 . . . . . 2 TYR HA . 51942 3
8 . 1 . 1 2 2 TYR HB2 H 1 2.978 0.002 . 2 . . . . . 2 TYR HB2 . 51942 3
9 . 1 . 1 2 2 TYR HB3 H 1 2.978 0.002 . 2 . . . . . 2 TYR HB3 . 51942 3
10 . 1 . 1 2 2 TYR HD1 H 1 7.104 0.003 . 1 . . . . . 2 TYR HD1 . 51942 3
11 . 1 . 1 2 2 TYR HD2 H 1 7.104 0.003 . 1 . . . . . 2 TYR HD2 . 51942 3
12 . 1 . 1 2 2 TYR HE1 H 1 6.784 0.004 . 1 . . . . . 2 TYR HE1 . 51942 3
13 . 1 . 1 2 2 TYR HE2 H 1 6.784 0.004 . 1 . . . . . 2 TYR HE2 . 51942 3
14 . 1 . 1 2 2 TYR CB C 13 38.941 0.000 . 1 . . . . . 2 TYR CB . 51942 3
15 . 1 . 1 2 2 TYR CD1 C 13 133.173 0.000 . 1 . . . . . 2 TYR CD1 . 51942 3
16 . 1 . 1 2 2 TYR CD2 C 13 133.173 0.000 . 1 . . . . . 2 TYR CD2 . 51942 3
17 . 1 . 1 2 2 TYR CE1 C 13 118.205 0.000 . 1 . . . . . 2 TYR CE1 . 51942 3
18 . 1 . 1 2 2 TYR CE2 C 13 118.205 0.000 . 1 . . . . . 2 TYR CE2 . 51942 3
19 . 1 . 1 3 3 VAL H H 1 8.360 0.002 . 1 . . . . . 3 VAL H . 51942 3
20 . 1 . 1 3 3 VAL HA H 1 4.108 0.002 . 1 . . . . . 3 VAL HA . 51942 3
21 . 1 . 1 3 3 VAL HB H 1 2.080 0.002 . 1 . . . . . 3 VAL HB . 51942 3
22 . 1 . 1 3 3 VAL HG11 H 1 0.940 0.004 . 2 . . . . . 3 VAL QG1 . 51942 3
23 . 1 . 1 3 3 VAL HG12 H 1 0.940 0.004 . 2 . . . . . 3 VAL QG1 . 51942 3
24 . 1 . 1 3 3 VAL HG13 H 1 0.940 0.004 . 2 . . . . . 3 VAL QG1 . 51942 3
25 . 1 . 1 3 3 VAL HG21 H 1 0.944 0.002 . 2 . . . . . 3 VAL QG2 . 51942 3
26 . 1 . 1 3 3 VAL HG22 H 1 0.944 0.002 . 2 . . . . . 3 VAL QG2 . 51942 3
27 . 1 . 1 3 3 VAL HG23 H 1 0.944 0.002 . 2 . . . . . 3 VAL QG2 . 51942 3
28 . 1 . 1 3 3 VAL CA C 13 62.642 0.000 . 1 . . . . . 3 VAL CA . 51942 3
29 . 1 . 1 3 3 VAL CB C 13 32.906 0.000 . 1 . . . . . 3 VAL CB . 51942 3
30 . 1 . 1 3 3 VAL CG1 C 13 20.354 0.000 . 1 . . . . . 3 VAL CG1 . 51942 3
31 . 1 . 1 3 3 VAL CG2 C 13 21.106 0.000 . 1 . . . . . 3 VAL CG2 . 51942 3
32 . 1 . 1 4 4 GLY H H 1 7.899 0.001 . 1 . . . . . 4 GLY H . 51942 3
33 . 1 . 1 4 4 GLY HA2 H 1 3.913 0.002 . 2 . . . . . 4 GLY HA2 . 51942 3
34 . 1 . 1 4 4 GLY HA3 H 1 4.051 0.001 . 2 . . . . . 4 GLY HA3 . 51942 3
35 . 1 . 1 4 4 GLY CA C 13 44.665 0.006 . 1 . . . . . 4 GLY CA . 51942 3
36 . 1 . 1 5 5 ASP H H 1 8.352 0.002 . 1 . . . . . 5 ASP H . 51942 3
37 . 1 . 1 5 5 ASP HA H 1 4.656 0.002 . 1 . . . . . 5 ASP HA . 51942 3
38 . 1 . 1 5 5 ASP HB2 H 1 2.682 0.003 . 2 . . . . . 5 ASP HB2 . 51942 3
39 . 1 . 1 5 5 ASP HB3 H 1 2.902 0.002 . 2 . . . . . 5 ASP HB3 . 51942 3
40 . 1 . 1 5 5 ASP CB C 13 41.900 0.018 . 1 . . . . . 5 ASP CB . 51942 3
41 . 1 . 1 6 6 CYS H H 1 8.786 0.001 . 1 . . . . . 6 CYS H . 51942 3
42 . 1 . 1 6 6 CYS HA H 1 3.850 0.003 . 1 . . . . . 6 CYS HA . 51942 3
43 . 1 . 1 6 6 CYS HB2 H 1 2.841 0.002 . 2 . . . . . 6 CYS HB2 . 51942 3
44 . 1 . 1 6 6 CYS HB3 H 1 2.940 0.003 . 2 . . . . . 6 CYS HB3 . 51942 3
45 . 1 . 1 6 6 CYS CA C 13 59.951 0.000 . 1 . . . . . 6 CYS CA . 51942 3
46 . 1 . 1 6 6 CYS CB C 13 39.444 0.008 . 1 . . . . . 6 CYS CB . 51942 3
47 . 1 . 1 7 7 GLY H H 1 8.663 0.002 . 1 . . . . . 7 GLY H . 51942 3
48 . 1 . 1 7 7 GLY HA2 H 1 3.770 0.001 . 2 . . . . . 7 GLY HA2 . 51942 3
49 . 1 . 1 7 7 GLY HA3 H 1 4.348 0.003 . 2 . . . . . 7 GLY HA3 . 51942 3
50 . 1 . 1 7 7 GLY CA C 13 46.372 0.012 . 1 . . . . . 7 GLY CA . 51942 3
51 . 1 . 1 8 8 SER H H 1 8.121 0.001 . 1 . . . . . 8 SER H . 51942 3
52 . 1 . 1 8 8 SER HA H 1 4.442 0.003 . 1 . . . . . 8 SER HA . 51942 3
53 . 1 . 1 8 8 SER HB2 H 1 3.881 0.003 . 2 . . . . . 8 SER HB2 . 51942 3
54 . 1 . 1 8 8 SER HB3 H 1 3.881 0.003 . 2 . . . . . 8 SER HB3 . 51942 3
55 . 1 . 1 8 8 SER CA C 13 60.016 0.000 . 1 . . . . . 8 SER CA . 51942 3
56 . 1 . 1 8 8 SER CB C 13 62.772 0.000 . 1 . . . . . 8 SER CB . 51942 3
57 . 1 . 1 9 9 ASN H H 1 7.297 0.002 . 1 . . . . . 9 ASN H . 51942 3
58 . 1 . 1 9 9 ASN HA H 1 4.736 0.003 . 1 . . . . . 9 ASN HA . 51942 3
59 . 1 . 1 9 9 ASN HB2 H 1 1.551 0.004 . 2 . . . . . 9 ASN HB2 . 51942 3
60 . 1 . 1 9 9 ASN HB3 H 1 2.437 0.003 . 2 . . . . . 9 ASN HB3 . 51942 3
61 . 1 . 1 9 9 ASN HD21 H 1 6.940 0.000 . 2 . . . . . 9 ASN HD21 . 51942 3
62 . 1 . 1 9 9 ASN HD22 H 1 7.220 0.000 . 2 . . . . . 9 ASN HD22 . 51942 3
63 . 1 . 1 9 9 ASN CB C 13 40.035 0.011 . 1 . . . . . 9 ASN CB . 51942 3
64 . 1 . 1 10 10 GLY H H 1 7.838 0.001 . 1 . . . . . 10 GLY H . 51942 3
65 . 1 . 1 10 10 GLY HA2 H 1 3.732 0.004 . 2 . . . . . 10 GLY HA2 . 51942 3
66 . 1 . 1 10 10 GLY HA3 H 1 4.149 0.003 . 2 . . . . . 10 GLY HA3 . 51942 3
67 . 1 . 1 10 10 GLY CA C 13 46.025 0.019 . 1 . . . . . 10 GLY CA . 51942 3
68 . 1 . 1 11 11 GLY H H 1 7.962 0.001 . 1 . . . . . 11 GLY H . 51942 3
69 . 1 . 1 11 11 GLY HA2 H 1 3.326 0.002 . 2 . . . . . 11 GLY HA2 . 51942 3
70 . 1 . 1 11 11 GLY HA3 H 1 4.899 0.002 . 2 . . . . . 11 GLY HA3 . 51942 3
71 . 1 . 1 11 11 GLY CA C 13 44.146 0.000 . 1 . . . . . 11 GLY CA . 51942 3
72 . 1 . 1 12 12 SER H H 1 8.605 0.001 . 1 . . . . . 12 SER H . 51942 3
73 . 1 . 1 12 12 SER HA H 1 4.525 0.003 . 1 . . . . . 12 SER HA . 51942 3
74 . 1 . 1 12 12 SER HB2 H 1 3.623 0.002 . 2 . . . . . 12 SER HB2 . 51942 3
75 . 1 . 1 12 12 SER HB3 H 1 3.698 0.004 . 2 . . . . . 12 SER HB3 . 51942 3
76 . 1 . 1 12 12 SER CA C 13 57.327 0.000 . 1 . . . . . 12 SER CA . 51942 3
77 . 1 . 1 12 12 SER CB C 13 65.921 0.002 . 1 . . . . . 12 SER CB . 51942 3
78 . 1 . 1 13 13 CYS H H 1 9.075 0.001 . 1 . . . . . 13 CYS H . 51942 3
79 . 1 . 1 13 13 CYS HA H 1 5.241 0.002 . 1 . . . . . 13 CYS HA . 51942 3
80 . 1 . 1 13 13 CYS HB2 H 1 2.601 0.003 . 2 . . . . . 13 CYS HB2 . 51942 3
81 . 1 . 1 13 13 CYS HB3 H 1 3.011 0.003 . 2 . . . . . 13 CYS HB3 . 51942 3
82 . 1 . 1 13 13 CYS CB C 13 38.653 0.027 . 1 . . . . . 13 CYS CB . 51942 3
83 . 1 . 1 14 14 VAL H H 1 9.266 0.003 . 1 . . . . . 14 VAL H . 51942 3
84 . 1 . 1 14 14 VAL HA H 1 4.924 0.001 . 1 . . . . . 14 VAL HA . 51942 3
85 . 1 . 1 14 14 VAL HB H 1 2.382 0.002 . 1 . . . . . 14 VAL HB . 51942 3
86 . 1 . 1 14 14 VAL HG11 H 1 0.914 0.003 . 2 . . . . . 14 VAL QG1 . 51942 3
87 . 1 . 1 14 14 VAL HG12 H 1 0.914 0.003 . 2 . . . . . 14 VAL QG1 . 51942 3
88 . 1 . 1 14 14 VAL HG13 H 1 0.914 0.003 . 2 . . . . . 14 VAL QG1 . 51942 3
89 . 1 . 1 14 14 VAL HG21 H 1 0.977 0.003 . 2 . . . . . 14 VAL QG2 . 51942 3
90 . 1 . 1 14 14 VAL HG22 H 1 0.977 0.003 . 2 . . . . . 14 VAL QG2 . 51942 3
91 . 1 . 1 14 14 VAL HG23 H 1 0.977 0.003 . 2 . . . . . 14 VAL QG2 . 51942 3
92 . 1 . 1 14 14 VAL CB C 13 35.422 0.000 . 1 . . . . . 14 VAL CB . 51942 3
93 . 1 . 1 14 14 VAL CG1 C 13 21.528 0.000 . 1 . . . . . 14 VAL CG1 . 51942 3
94 . 1 . 1 14 14 VAL CG2 C 13 17.889 0.000 . 1 . . . . . 14 VAL CG2 . 51942 3
95 . 1 . 1 15 15 SER H H 1 9.269 0.001 . 1 . . . . . 15 SER H . 51942 3
96 . 1 . 1 15 15 SER HA H 1 4.840 0.001 . 1 . . . . . 15 SER HA . 51942 3
97 . 1 . 1 15 15 SER HB2 H 1 3.756 0.003 . 2 . . . . . 15 SER HB2 . 51942 3
98 . 1 . 1 15 15 SER HB3 H 1 4.032 0.004 . 2 . . . . . 15 SER HB3 . 51942 3
99 . 1 . 1 15 15 SER CB C 13 64.022 0.002 . 1 . . . . . 15 SER CB . 51942 3
100 . 1 . 1 16 16 SER H H 1 7.318 0.001 . 1 . . . . . 16 SER H . 51942 3
101 . 1 . 1 16 16 SER HA H 1 4.492 0.003 . 1 . . . . . 16 SER HA . 51942 3
102 . 1 . 1 16 16 SER HB2 H 1 3.898 0.003 . 2 . . . . . 16 SER HB2 . 51942 3
103 . 1 . 1 16 16 SER HB3 H 1 4.131 0.003 . 2 . . . . . 16 SER HB3 . 51942 3
104 . 1 . 1 16 16 SER CA C 13 56.419 0.000 . 1 . . . . . 16 SER CA . 51942 3
105 . 1 . 1 16 16 SER CB C 13 64.320 0.007 . 1 . . . . . 16 SER CB . 51942 3
106 . 1 . 1 17 17 TYR H H 1 8.613 0.000 . 1 . . . . . 17 TYR H . 51942 3
107 . 1 . 1 17 17 TYR HA H 1 4.200 0.002 . 1 . . . . . 17 TYR HA . 51942 3
108 . 1 . 1 17 17 TYR HB2 H 1 2.729 0.002 . 2 . . . . . 17 TYR HB2 . 51942 3
109 . 1 . 1 17 17 TYR HB3 H 1 3.136 0.002 . 2 . . . . . 17 TYR HB3 . 51942 3
110 . 1 . 1 17 17 TYR HD1 H 1 7.048 0.002 . 1 . . . . . 17 TYR HD1 . 51942 3
111 . 1 . 1 17 17 TYR HD2 H 1 7.048 0.002 . 1 . . . . . 17 TYR HD2 . 51942 3
112 . 1 . 1 17 17 TYR HE1 H 1 6.738 0.003 . 1 . . . . . 17 TYR HE1 . 51942 3
113 . 1 . 1 17 17 TYR HE2 H 1 6.738 0.003 . 1 . . . . . 17 TYR HE2 . 51942 3
114 . 1 . 1 17 17 TYR CA C 13 59.454 0.000 . 1 . . . . . 17 TYR CA . 51942 3
115 . 1 . 1 17 17 TYR CB C 13 38.309 0.005 . 1 . . . . . 17 TYR CB . 51942 3
116 . 1 . 1 17 17 TYR CD1 C 13 133.198 0.000 . 1 . . . . . 17 TYR CD1 . 51942 3
117 . 1 . 1 17 17 TYR CD2 C 13 133.198 0.000 . 1 . . . . . 17 TYR CD2 . 51942 3
118 . 1 . 1 17 17 TYR CE1 C 13 117.837 0.000 . 1 . . . . . 17 TYR CE1 . 51942 3
119 . 1 . 1 17 17 TYR CE2 C 13 117.837 0.000 . 1 . . . . . 17 TYR CE2 . 51942 3
120 . 1 . 1 18 18 CYS H H 1 8.436 0.002 . 1 . . . . . 18 CYS H . 51942 3
121 . 1 . 1 18 18 CYS HA H 1 4.955 0.001 . 1 . . . . . 18 CYS HA . 51942 3
122 . 1 . 1 18 18 CYS HB2 H 1 2.289 0.002 . 2 . . . . . 18 CYS HB2 . 51942 3
123 . 1 . 1 18 18 CYS HB3 H 1 2.895 0.006 . 2 . . . . . 18 CYS HB3 . 51942 3
124 . 1 . 1 18 18 CYS CB C 13 42.193 0.009 . 1 . . . . . 18 CYS CB . 51942 3
125 . 1 . 1 19 19 PRO HA H 1 4.151 0.002 . 1 . . . . . 19 PRO HA . 51942 3
126 . 1 . 1 19 19 PRO HB2 H 1 1.853 0.003 . 2 . . . . . 19 PRO HB2 . 51942 3
127 . 1 . 1 19 19 PRO HB3 H 1 2.458 0.002 . 2 . . . . . 19 PRO HB3 . 51942 3
128 . 1 . 1 19 19 PRO HG2 H 1 1.976 0.002 . 2 . . . . . 19 PRO HG2 . 51942 3
129 . 1 . 1 19 19 PRO HG3 H 1 2.065 0.004 . 2 . . . . . 19 PRO HG3 . 51942 3
130 . 1 . 1 19 19 PRO HD2 H 1 3.425 0.006 . 2 . . . . . 19 PRO HD2 . 51942 3
131 . 1 . 1 19 19 PRO HD3 H 1 3.669 0.005 . 2 . . . . . 19 PRO HD3 . 51942 3
132 . 1 . 1 19 19 PRO CA C 13 62.900 0.000 . 1 . . . . . 19 PRO CA . 51942 3
133 . 1 . 1 19 19 PRO CB C 13 32.285 0.006 . 1 . . . . . 19 PRO CB . 51942 3
134 . 1 . 1 19 19 PRO CG C 13 27.615 0.007 . 1 . . . . . 19 PRO CG . 51942 3
135 . 1 . 1 19 19 PRO CD C 13 51.315 0.001 . 1 . . . . . 19 PRO CD . 51942 3
136 . 1 . 1 20 20 TYR H H 1 8.594 0.002 . 1 . . . . . 20 TYR H . 51942 3
137 . 1 . 1 20 20 TYR HA H 1 3.717 0.003 . 1 . . . . . 20 TYR HA . 51942 3
138 . 1 . 1 20 20 TYR HB2 H 1 2.972 0.002 . 2 . . . . . 20 TYR HB2 . 51942 3
139 . 1 . 1 20 20 TYR HB3 H 1 3.058 0.003 . 2 . . . . . 20 TYR HB3 . 51942 3
140 . 1 . 1 20 20 TYR HD1 H 1 7.127 0.003 . 1 . . . . . 20 TYR HD1 . 51942 3
141 . 1 . 1 20 20 TYR HD2 H 1 7.127 0.003 . 1 . . . . . 20 TYR HD2 . 51942 3
142 . 1 . 1 20 20 TYR HE1 H 1 6.868 0.004 . 1 . . . . . 20 TYR HE1 . 51942 3
143 . 1 . 1 20 20 TYR HE2 H 1 6.868 0.004 . 1 . . . . . 20 TYR HE2 . 51942 3
144 . 1 . 1 20 20 TYR CA C 13 62.682 0.000 . 1 . . . . . 20 TYR CA . 51942 3
145 . 1 . 1 20 20 TYR CB C 13 38.506 0.003 . 1 . . . . . 20 TYR CB . 51942 3
146 . 1 . 1 20 20 TYR CD1 C 13 132.785 0.000 . 1 . . . . . 20 TYR CD1 . 51942 3
147 . 1 . 1 20 20 TYR CD2 C 13 132.785 0.000 . 1 . . . . . 20 TYR CD2 . 51942 3
148 . 1 . 1 20 20 TYR CE1 C 13 118.492 0.000 . 1 . . . . . 20 TYR CE1 . 51942 3
149 . 1 . 1 20 20 TYR CE2 C 13 118.492 0.000 . 1 . . . . . 20 TYR CE2 . 51942 3
150 . 1 . 1 21 21 GLY H H 1 9.071 0.001 . 1 . . . . . 21 GLY H . 51942 3
151 . 1 . 1 21 21 GLY HA2 H 1 3.877 0.004 . 2 . . . . . 21 GLY HA2 . 51942 3
152 . 1 . 1 21 21 GLY HA3 H 1 3.877 0.004 . 2 . . . . . 21 GLY HA3 . 51942 3
153 . 1 . 1 21 21 GLY CA C 13 45.817 0.000 . 1 . . . . . 21 GLY CA . 51942 3
154 . 1 . 1 22 22 ASN H H 1 8.196 0.002 . 1 . . . . . 22 ASN H . 51942 3
155 . 1 . 1 22 22 ASN HA H 1 4.864 0.004 . 1 . . . . . 22 ASN HA . 51942 3
156 . 1 . 1 22 22 ASN HB2 H 1 2.587 0.003 . 2 . . . . . 22 ASN HB2 . 51942 3
157 . 1 . 1 22 22 ASN HB3 H 1 3.133 0.002 . 2 . . . . . 22 ASN HB3 . 51942 3
158 . 1 . 1 22 22 ASN HD21 H 1 6.969 0.001 . 2 . . . . . 22 ASN HD21 . 51942 3
159 . 1 . 1 22 22 ASN HD22 H 1 7.136 0.002 . 2 . . . . . 22 ASN HD22 . 51942 3
160 . 1 . 1 22 22 ASN CB C 13 39.611 0.009 . 1 . . . . . 22 ASN CB . 51942 3
161 . 1 . 1 23 23 ARG H H 1 7.297 0.001 . 1 . . . . . 23 ARG H . 51942 3
162 . 1 . 1 23 23 ARG HA H 1 4.610 0.001 . 1 . . . . . 23 ARG HA . 51942 3
163 . 1 . 1 23 23 ARG HB2 H 1 1.676 0.006 . 2 . . . . . 23 ARG HB2 . 51942 3
164 . 1 . 1 23 23 ARG HB3 H 1 1.821 0.004 . 2 . . . . . 23 ARG HB3 . 51942 3
165 . 1 . 1 23 23 ARG HG2 H 1 1.255 0.005 . 2 . . . . . 23 ARG HG2 . 51942 3
166 . 1 . 1 23 23 ARG HG3 H 1 1.683 0.001 . 2 . . . . . 23 ARG HG3 . 51942 3
167 . 1 . 1 23 23 ARG HD2 H 1 2.907 0.002 . 2 . . . . . 23 ARG HD2 . 51942 3
168 . 1 . 1 23 23 ARG HD3 H 1 3.132 0.002 . 2 . . . . . 23 ARG HD3 . 51942 3
169 . 1 . 1 23 23 ARG HE H 1 6.673 0.001 . 1 . . . . . 23 ARG HE . 51942 3
170 . 1 . 1 23 23 ARG CB C 13 30.462 0.003 . 1 . . . . . 23 ARG CB . 51942 3
171 . 1 . 1 23 23 ARG CG C 13 28.264 0.000 . 1 . . . . . 23 ARG CG . 51942 3
172 . 1 . 1 23 23 ARG CD C 13 43.782 0.005 . 1 . . . . . 23 ARG CD . 51942 3
173 . 1 . 1 24 24 LEU H H 1 8.508 0.002 . 1 . . . . . 24 LEU H . 51942 3
174 . 1 . 1 24 24 LEU HA H 1 4.669 0.003 . 1 . . . . . 24 LEU HA . 51942 3
175 . 1 . 1 24 24 LEU HB2 H 1 1.499 0.004 . 2 . . . . . 24 LEU HB2 . 51942 3
176 . 1 . 1 24 24 LEU HB3 H 1 1.601 0.004 . 2 . . . . . 24 LEU HB3 . 51942 3
177 . 1 . 1 24 24 LEU HG H 1 1.555 0.004 . 1 . . . . . 24 LEU HG . 51942 3
178 . 1 . 1 24 24 LEU HD11 H 1 0.788 0.002 . 2 . . . . . 24 LEU QD1 . 51942 3
179 . 1 . 1 24 24 LEU HD12 H 1 0.788 0.002 . 2 . . . . . 24 LEU QD1 . 51942 3
180 . 1 . 1 24 24 LEU HD13 H 1 0.788 0.002 . 2 . . . . . 24 LEU QD1 . 51942 3
181 . 1 . 1 24 24 LEU HD21 H 1 0.891 0.002 . 2 . . . . . 24 LEU QD2 . 51942 3
182 . 1 . 1 24 24 LEU HD22 H 1 0.891 0.002 . 2 . . . . . 24 LEU QD2 . 51942 3
183 . 1 . 1 24 24 LEU HD23 H 1 0.891 0.002 . 2 . . . . . 24 LEU QD2 . 51942 3
184 . 1 . 1 24 24 LEU CB C 13 45.342 0.009 . 1 . . . . . 24 LEU CB . 51942 3
185 . 1 . 1 24 24 LEU CG C 13 26.926 0.000 . 1 . . . . . 24 LEU CG . 51942 3
186 . 1 . 1 24 24 LEU CD1 C 13 25.487 0.000 . 1 . . . . . 24 LEU CD1 . 51942 3
187 . 1 . 1 24 24 LEU CD2 C 13 22.831 0.000 . 1 . . . . . 24 LEU CD2 . 51942 3
188 . 1 . 1 25 25 ASN H H 1 8.831 0.000 . 1 . . . . . 25 ASN H . 51942 3
189 . 1 . 1 25 25 ASN HA H 1 4.641 0.001 . 1 . . . . . 25 ASN HA . 51942 3
190 . 1 . 1 25 25 ASN HB2 H 1 2.325 0.003 . 2 . . . . . 25 ASN HB2 . 51942 3
191 . 1 . 1 25 25 ASN HB3 H 1 2.494 0.005 . 2 . . . . . 25 ASN HB3 . 51942 3
192 . 1 . 1 25 25 ASN HD21 H 1 6.836 0.001 . 2 . . . . . 25 ASN HD21 . 51942 3
193 . 1 . 1 25 25 ASN HD22 H 1 7.387 0.000 . 2 . . . . . 25 ASN HD22 . 51942 3
194 . 1 . 1 25 25 ASN CB C 13 36.571 0.013 . 1 . . . . . 25 ASN CB . 51942 3
195 . 1 . 1 26 26 TYR H H 1 7.316 0.001 . 1 . . . . . 26 TYR H . 51942 3
196 . 1 . 1 26 26 TYR HA H 1 4.669 0.002 . 1 . . . . . 26 TYR HA . 51942 3
197 . 1 . 1 26 26 TYR HB2 H 1 2.502 0.001 . 2 . . . . . 26 TYR HB2 . 51942 3
198 . 1 . 1 26 26 TYR HB3 H 1 3.084 0.003 . 2 . . . . . 26 TYR HB3 . 51942 3
199 . 1 . 1 26 26 TYR HD1 H 1 6.942 0.004 . 1 . . . . . 26 TYR HD1 . 51942 3
200 . 1 . 1 26 26 TYR HD2 H 1 6.942 0.004 . 1 . . . . . 26 TYR HD2 . 51942 3
201 . 1 . 1 26 26 TYR HE1 H 1 6.675 0.003 . 1 . . . . . 26 TYR HE1 . 51942 3
202 . 1 . 1 26 26 TYR HE2 H 1 6.675 0.003 . 1 . . . . . 26 TYR HE2 . 51942 3
203 . 1 . 1 26 26 TYR CB C 13 42.412 0.021 . 1 . . . . . 26 TYR CB . 51942 3
204 . 1 . 1 26 26 TYR CD1 C 13 133.022 0.000 . 1 . . . . . 26 TYR CD1 . 51942 3
205 . 1 . 1 26 26 TYR CD2 C 13 133.022 0.000 . 1 . . . . . 26 TYR CD2 . 51942 3
206 . 1 . 1 26 26 TYR CE1 C 13 117.960 0.000 . 1 . . . . . 26 TYR CE1 . 51942 3
207 . 1 . 1 26 26 TYR CE2 C 13 117.960 0.000 . 1 . . . . . 26 TYR CE2 . 51942 3
208 . 1 . 1 27 27 PHE H H 1 8.882 0.000 . 1 . . . . . 27 PHE H . 51942 3
209 . 1 . 1 27 27 PHE HA H 1 4.392 0.002 . 1 . . . . . 27 PHE HA . 51942 3
210 . 1 . 1 27 27 PHE HB2 H 1 2.888 0.004 . 2 . . . . . 27 PHE HB2 . 51942 3
211 . 1 . 1 27 27 PHE HB3 H 1 3.251 0.001 . 2 . . . . . 27 PHE HB3 . 51942 3
212 . 1 . 1 27 27 PHE HD1 H 1 7.211 0.002 . 1 . . . . . 27 PHE HD1 . 51942 3
213 . 1 . 1 27 27 PHE HD2 H 1 7.211 0.002 . 1 . . . . . 27 PHE HD2 . 51942 3
214 . 1 . 1 27 27 PHE HE1 H 1 7.321 0.004 . 1 . . . . . 27 PHE HE1 . 51942 3
215 . 1 . 1 27 27 PHE HE2 H 1 7.321 0.004 . 1 . . . . . 27 PHE HE2 . 51942 3
216 . 1 . 1 27 27 PHE HZ H 1 7.289 0.004 . 1 . . . . . 27 PHE HZ . 51942 3
217 . 1 . 1 27 27 PHE CA C 13 60.067 0.000 . 1 . . . . . 27 PHE CA . 51942 3
218 . 1 . 1 27 27 PHE CB C 13 40.157 0.001 . 1 . . . . . 27 PHE CB . 51942 3
219 . 1 . 1 27 27 PHE CD1 C 13 131.776 0.000 . 1 . . . . . 27 PHE CD1 . 51942 3
220 . 1 . 1 27 27 PHE CD2 C 13 131.776 0.000 . 1 . . . . . 27 PHE CD2 . 51942 3
221 . 1 . 1 27 27 PHE CE1 C 13 131.430 0.000 . 1 . . . . . 27 PHE CE1 . 51942 3
222 . 1 . 1 27 27 PHE CE2 C 13 131.430 0.000 . 1 . . . . . 27 PHE CE2 . 51942 3
223 . 1 . 1 27 27 PHE CZ C 13 129.802 0.000 . 1 . . . . . 27 PHE CZ . 51942 3
224 . 1 . 1 28 28 CYS H H 1 7.746 0.002 . 1 . . . . . 28 CYS H . 51942 3
225 . 1 . 1 28 28 CYS HA H 1 4.703 0.003 . 1 . . . . . 28 CYS HA . 51942 3
226 . 1 . 1 28 28 CYS HB2 H 1 2.408 0.002 . 2 . . . . . 28 CYS HB2 . 51942 3
227 . 1 . 1 28 28 CYS HB3 H 1 2.533 0.003 . 2 . . . . . 28 CYS HB3 . 51942 3
228 . 1 . 1 28 28 CYS CB C 13 43.398 0.002 . 1 . . . . . 28 CYS CB . 51942 3
229 . 1 . 1 29 29 PRO HA H 1 4.299 0.001 . 1 . . . . . 29 PRO HA . 51942 3
230 . 1 . 1 29 29 PRO HB2 H 1 1.859 0.004 . 2 . . . . . 29 PRO HB2 . 51942 3
231 . 1 . 1 29 29 PRO HB3 H 1 2.436 0.002 . 2 . . . . . 29 PRO HB3 . 51942 3
232 . 1 . 1 29 29 PRO HG2 H 1 1.928 0.002 . 2 . . . . . 29 PRO HG2 . 51942 3
233 . 1 . 1 29 29 PRO HG3 H 1 2.102 0.004 . 2 . . . . . 29 PRO HG3 . 51942 3
234 . 1 . 1 29 29 PRO HD2 H 1 3.432 0.004 . 2 . . . . . 29 PRO HD2 . 51942 3
235 . 1 . 1 29 29 PRO HD3 H 1 3.722 0.003 . 2 . . . . . 29 PRO HD3 . 51942 3
236 . 1 . 1 29 29 PRO CA C 13 62.255 0.000 . 1 . . . . . 29 PRO CA . 51942 3
237 . 1 . 1 29 29 PRO CB C 13 32.931 0.003 . 1 . . . . . 29 PRO CB . 51942 3
238 . 1 . 1 29 29 PRO CG C 13 27.380 0.001 . 1 . . . . . 29 PRO CG . 51942 3
239 . 1 . 1 29 29 PRO CD C 13 50.613 0.002 . 1 . . . . . 29 PRO CD . 51942 3
240 . 1 . 1 30 30 LEU H H 1 8.520 0.001 . 1 . . . . . 30 LEU H . 51942 3
241 . 1 . 1 30 30 LEU HA H 1 4.039 0.003 . 1 . . . . . 30 LEU HA . 51942 3
242 . 1 . 1 30 30 LEU HB2 H 1 1.610 0.001 . 2 . . . . . 30 LEU HB2 . 51942 3
243 . 1 . 1 30 30 LEU HB3 H 1 1.661 0.003 . 2 . . . . . 30 LEU HB3 . 51942 3
244 . 1 . 1 30 30 LEU HG H 1 1.607 0.008 . 1 . . . . . 30 LEU HG . 51942 3
245 . 1 . 1 30 30 LEU HD11 H 1 0.939 0.006 . 2 . . . . . 30 LEU QD1 . 51942 3
246 . 1 . 1 30 30 LEU HD12 H 1 0.939 0.006 . 2 . . . . . 30 LEU QD1 . 51942 3
247 . 1 . 1 30 30 LEU HD13 H 1 0.939 0.006 . 2 . . . . . 30 LEU QD1 . 51942 3
248 . 1 . 1 30 30 LEU HD21 H 1 0.947 0.000 . 2 . . . . . 30 LEU QD2 . 51942 3
249 . 1 . 1 30 30 LEU HD22 H 1 0.947 0.000 . 2 . . . . . 30 LEU QD2 . 51942 3
250 . 1 . 1 30 30 LEU HD23 H 1 0.947 0.000 . 2 . . . . . 30 LEU QD2 . 51942 3
251 . 1 . 1 30 30 LEU CA C 13 56.257 0.000 . 1 . . . . . 30 LEU CA . 51942 3
252 . 1 . 1 30 30 LEU CB C 13 40.881 0.003 . 1 . . . . . 30 LEU CB . 51942 3
253 . 1 . 1 30 30 LEU CG C 13 26.943 0.000 . 1 . . . . . 30 LEU CG . 51942 3
254 . 1 . 1 30 30 LEU CD1 C 13 23.648 0.000 . 1 . . . . . 30 LEU CD1 . 51942 3
255 . 1 . 1 30 30 LEU CD2 C 13 24.847 0.000 . 1 . . . . . 30 LEU CD2 . 51942 3
256 . 1 . 1 31 31 GLY H H 1 8.963 0.001 . 1 . . . . . 31 GLY H . 51942 3
257 . 1 . 1 31 31 GLY HA2 H 1 3.684 0.005 . 2 . . . . . 31 GLY HA2 . 51942 3
258 . 1 . 1 31 31 GLY HA3 H 1 4.165 0.002 . 2 . . . . . 31 GLY HA3 . 51942 3
259 . 1 . 1 31 31 GLY CA C 13 45.203 0.001 . 1 . . . . . 31 GLY CA . 51942 3
260 . 1 . 1 32 32 ARG H H 1 7.761 0.002 . 1 . . . . . 32 ARG H . 51942 3
261 . 1 . 1 32 32 ARG HA H 1 4.662 0.004 . 1 . . . . . 32 ARG HA . 51942 3
262 . 1 . 1 32 32 ARG HB2 H 1 1.476 0.004 . 2 . . . . . 32 ARG HB2 . 51942 3
263 . 1 . 1 32 32 ARG HB3 H 1 1.606 0.003 . 2 . . . . . 32 ARG HB3 . 51942 3
264 . 1 . 1 32 32 ARG HG2 H 1 1.352 0.004 . 2 . . . . . 32 ARG HG2 . 51942 3
265 . 1 . 1 32 32 ARG HG3 H 1 1.495 0.006 . 2 . . . . . 32 ARG HG3 . 51942 3
266 . 1 . 1 32 32 ARG HD2 H 1 2.860 0.005 . 2 . . . . . 32 ARG HD2 . 51942 3
267 . 1 . 1 32 32 ARG HD3 H 1 2.860 0.005 . 2 . . . . . 32 ARG HD3 . 51942 3
268 . 1 . 1 32 32 ARG HE H 1 7.117 0.001 . 1 . . . . . 32 ARG HE . 51942 3
269 . 1 . 1 32 32 ARG CB C 13 32.895 0.001 . 1 . . . . . 32 ARG CB . 51942 3
270 . 1 . 1 32 32 ARG CG C 13 28.695 0.004 . 1 . . . . . 32 ARG CG . 51942 3
271 . 1 . 1 32 32 ARG CD C 13 43.514 0.000 . 1 . . . . . 32 ARG CD . 51942 3
272 . 1 . 1 33 33 THR H H 1 8.732 0.002 . 1 . . . . . 33 THR H . 51942 3
273 . 1 . 1 33 33 THR HA H 1 4.401 0.002 . 1 . . . . . 33 THR HA . 51942 3
274 . 1 . 1 33 33 THR HB H 1 3.860 0.002 . 1 . . . . . 33 THR HB . 51942 3
275 . 1 . 1 33 33 THR HG21 H 1 1.099 0.002 . 1 . . . . . 33 THR QG2 . 51942 3
276 . 1 . 1 33 33 THR HG22 H 1 1.099 0.002 . 1 . . . . . 33 THR QG2 . 51942 3
277 . 1 . 1 33 33 THR HG23 H 1 1.099 0.002 . 1 . . . . . 33 THR QG2 . 51942 3
278 . 1 . 1 33 33 THR CA C 13 61.493 0.000 . 1 . . . . . 33 THR CA . 51942 3
279 . 1 . 1 33 33 THR CB C 13 71.438 0.000 . 1 . . . . . 33 THR CB . 51942 3
280 . 1 . 1 33 33 THR CG2 C 13 21.050 0.000 . 1 . . . . . 33 THR CG2 . 51942 3
281 . 1 . 1 34 34 CYS H H 1 9.180 0.001 . 1 . . . . . 34 CYS H . 51942 3
282 . 1 . 1 34 34 CYS HA H 1 4.763 0.001 . 1 . . . . . 34 CYS HA . 51942 3
283 . 1 . 1 34 34 CYS HB2 H 1 3.127 0.002 . 2 . . . . . 34 CYS HB2 . 51942 3
284 . 1 . 1 34 34 CYS HB3 H 1 3.687 0.003 . 2 . . . . . 34 CYS HB3 . 51942 3
285 . 1 . 1 34 34 CYS CB C 13 37.105 0.001 . 1 . . . . . 34 CYS CB . 51942 3
286 . 1 . 1 35 35 CYS H H 1 9.444 0.002 . 1 . . . . . 35 CYS H . 51942 3
287 . 1 . 1 35 35 CYS HA H 1 5.326 0.001 . 1 . . . . . 35 CYS HA . 51942 3
288 . 1 . 1 35 35 CYS HB2 H 1 2.561 0.003 . 2 . . . . . 35 CYS HB2 . 51942 3
289 . 1 . 1 35 35 CYS HB3 H 1 3.208 0.003 . 2 . . . . . 35 CYS HB3 . 51942 3
290 . 1 . 1 35 35 CYS CB C 13 45.651 0.005 . 1 . . . . . 35 CYS CB . 51942 3
291 . 1 . 1 36 36 ARG H H 1 9.457 0.002 . 1 . . . . . 36 ARG H . 51942 3
292 . 1 . 1 36 36 ARG HA H 1 4.142 0.002 . 1 . . . . . 36 ARG HA . 51942 3
293 . 1 . 1 36 36 ARG HB2 H 1 1.734 0.002 . 2 . . . . . 36 ARG HB2 . 51942 3
294 . 1 . 1 36 36 ARG HB3 H 1 1.800 0.005 . 2 . . . . . 36 ARG HB3 . 51942 3
295 . 1 . 1 36 36 ARG HG2 H 1 1.734 0.002 . 2 . . . . . 36 ARG HG2 . 51942 3
296 . 1 . 1 36 36 ARG HG3 H 1 1.734 0.002 . 2 . . . . . 36 ARG HG3 . 51942 3
297 . 1 . 1 36 36 ARG HD2 H 1 3.219 0.003 . 2 . . . . . 36 ARG HD2 . 51942 3
298 . 1 . 1 36 36 ARG HD3 H 1 3.297 0.002 . 2 . . . . . 36 ARG HD3 . 51942 3
299 . 1 . 1 36 36 ARG HE H 1 7.260 0.001 . 1 . . . . . 36 ARG HE . 51942 3
300 . 1 . 1 36 36 ARG CA C 13 58.200 0.000 . 1 . . . . . 36 ARG CA . 51942 3
301 . 1 . 1 36 36 ARG CB C 13 30.921 0.001 . 1 . . . . . 36 ARG CB . 51942 3
302 . 1 . 1 36 36 ARG CG C 13 27.664 0.000 . 1 . . . . . 36 ARG CG . 51942 3
303 . 1 . 1 36 36 ARG CD C 13 43.382 0.000 . 1 . . . . . 36 ARG CD . 51942 3
304 . 1 . 1 37 37 ARG H H 1 8.570 0.001 . 1 . . . . . 37 ARG H . 51942 3
305 . 1 . 1 37 37 ARG HA H 1 4.215 0.002 . 1 . . . . . 37 ARG HA . 51942 3
306 . 1 . 1 37 37 ARG HB2 H 1 1.659 0.002 . 2 . . . . . 37 ARG HB2 . 51942 3
307 . 1 . 1 37 37 ARG HB3 H 1 1.659 0.002 . 2 . . . . . 37 ARG HB3 . 51942 3
308 . 1 . 1 37 37 ARG HG2 H 1 1.460 0.003 . 2 . . . . . 37 ARG HG2 . 51942 3
309 . 1 . 1 37 37 ARG HG3 H 1 1.460 0.003 . 2 . . . . . 37 ARG HG3 . 51942 3
310 . 1 . 1 37 37 ARG HD2 H 1 3.087 0.004 . 2 . . . . . 37 ARG HD2 . 51942 3
311 . 1 . 1 37 37 ARG HD3 H 1 3.087 0.004 . 2 . . . . . 37 ARG HD3 . 51942 3
312 . 1 . 1 37 37 ARG HE H 1 7.120 0.000 . 1 . . . . . 37 ARG HE . 51942 3
313 . 1 . 1 37 37 ARG CA C 13 57.267 0.000 . 1 . . . . . 37 ARG CA . 51942 3
314 . 1 . 1 37 37 ARG CB C 13 30.917 0.000 . 1 . . . . . 37 ARG CB . 51942 3
315 . 1 . 1 37 37 ARG CG C 13 27.814 0.000 . 1 . . . . . 37 ARG CG . 51942 3
316 . 1 . 1 37 37 ARG CD C 13 43.483 0.000 . 1 . . . . . 37 ARG CD . 51942 3
317 . 1 . 1 38 38 SER H H 1 8.421 0.002 . 1 . . . . . 38 SER H . 51942 3
318 . 1 . 1 38 38 SER HA H 1 4.376 0.002 . 1 . . . . . 38 SER HA . 51942 3
319 . 1 . 1 38 38 SER HB2 H 1 3.787 0.002 . 2 . . . . . 38 SER HB2 . 51942 3
320 . 1 . 1 38 38 SER HB3 H 1 3.844 0.004 . 2 . . . . . 38 SER HB3 . 51942 3
321 . 1 . 1 38 38 SER CA C 13 58.084 0.000 . 1 . . . . . 38 SER CA . 51942 3
322 . 1 . 1 38 38 SER CB C 13 63.647 0.003 . 1 . . . . . 38 SER CB . 51942 3
323 . 1 . 1 39 39 TYR H H 1 8.294 0.001 . 1 . . . . . 39 TYR H . 51942 3
324 . 1 . 1 39 39 TYR HA H 1 4.509 0.002 . 1 . . . . . 39 TYR HA . 51942 3
325 . 1 . 1 39 39 TYR HB2 H 1 2.922 0.002 . 2 . . . . . 39 TYR HB2 . 51942 3
326 . 1 . 1 39 39 TYR HB3 H 1 3.081 0.004 . 2 . . . . . 39 TYR HB3 . 51942 3
327 . 1 . 1 39 39 TYR HD1 H 1 7.145 0.003 . 1 . . . . . 39 TYR HD1 . 51942 3
328 . 1 . 1 39 39 TYR HD2 H 1 7.145 0.003 . 1 . . . . . 39 TYR HD2 . 51942 3
329 . 1 . 1 39 39 TYR HE1 H 1 6.826 0.003 . 1 . . . . . 39 TYR HE1 . 51942 3
330 . 1 . 1 39 39 TYR HE2 H 1 6.826 0.003 . 1 . . . . . 39 TYR HE2 . 51942 3
331 . 1 . 1 39 39 TYR CA C 13 57.868 0.000 . 1 . . . . . 39 TYR CA . 51942 3
332 . 1 . 1 39 39 TYR CB C 13 38.979 0.001 . 1 . . . . . 39 TYR CB . 51942 3
333 . 1 . 1 39 39 TYR CD1 C 13 133.343 0.000 . 1 . . . . . 39 TYR CD1 . 51942 3
334 . 1 . 1 39 39 TYR CD2 C 13 133.343 0.000 . 1 . . . . . 39 TYR CD2 . 51942 3
335 . 1 . 1 39 39 TYR CE1 C 13 118.074 0.000 . 1 . . . . . 39 TYR CE1 . 51942 3
336 . 1 . 1 39 39 TYR CE2 C 13 118.074 0.000 . 1 . . . . . 39 TYR CE2 . 51942 3
337 . 1 . 1 40 40 NH2 HN1 H 1 7.174 0.000 . 2 . . . . . 40 NH2 HN1 . 51942 3
338 . 1 . 1 40 40 NH2 HN2 H 1 7.582 0.000 . 2 . . . . . 40 NH2 HN2 . 51942 3
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