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 50493
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name OpOrn-hECP30_DPC25HD
_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
2 '2D 1H-1H COSY' . . . 50493 1
3 '2D 1H-1H TOCSY' . . . 50493 1
4 '2D 1H-1H NOESY' . . . 50493 1
5 '2D 1H-13C HSQC aliphatic' . . . 50493 1
6 '2D 1H-13C HSQC aromatic' . . . 50493 1
8 '2D 1H-1H TOCSY' . . . 50493 1
9 '2D 1H-1H NOESY' . . . 50493 1
10 '2D 1H-13C HSQC aliphatic' . . . 50493 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 . . 50493 1
2 $software_2 . . 50493 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 1 1 ORN HA H 1 4.294 0.003 . 1 . . . . . 1 ORN HA . 50493 1
2 . 1 . 1 1 1 ORN HB2 H 1 1.926 0.004 . 2 . . . . . 1 ORN HB2 . 50493 1
3 . 1 . 1 1 1 ORN HB3 H 1 1.926 0.004 . 2 . . . . . 1 ORN HB3 . 50493 1
4 . 1 . 1 1 1 ORN HG2 H 1 1.752 0.003 . 2 . . . . . 1 ORN HG2 . 50493 1
5 . 1 . 1 1 1 ORN HG3 H 1 1.752 0.003 . 2 . . . . . 1 ORN HG3 . 50493 1
6 . 1 . 1 1 1 ORN HD2 H 1 2.997 0.002 . 2 . . . . . 1 ORN HD2 . 50493 1
7 . 1 . 1 1 1 ORN HD3 H 1 2.997 0.002 . 2 . . . . . 1 ORN HD3 . 50493 1
8 . 1 . 1 1 1 ORN CA C 13 54.076 0.000 . 1 . . . . . 1 ORN CA . 50493 1
9 . 1 . 1 1 1 ORN CB C 13 29.679 0.050 . 1 . . . . . 1 ORN CB . 50493 1
10 . 1 . 1 1 1 ORN CG C 13 25.013 0.080 . 1 . . . . . 1 ORN CG . 50493 1
11 . 1 . 1 2 2 DPR HA H 1 4.536 0.004 . 1 . . . . . 2 DPRO HA . 50493 1
12 . 1 . 1 2 2 DPR HB2 H 1 1.100 0.003 . 2 . . . . . 2 DPRO HB2 . 50493 1
13 . 1 . 1 2 2 DPR HB3 H 1 2.023 0.003 . 2 . . . . . 2 DPRO HB3 . 50493 1
14 . 1 . 1 2 2 DPR HG2 H 1 1.523 0.003 . 2 . . . . . 2 DPRO HG2 . 50493 1
15 . 1 . 1 2 2 DPR HG3 H 1 1.745 0.003 . 2 . . . . . 2 DPRO HG3 . 50493 1
16 . 1 . 1 2 2 DPR HD2 H 1 3.518 0.003 . 2 . . . . . 2 DPRO HD2 . 50493 1
17 . 1 . 1 2 2 DPR HD3 H 1 3.607 0.004 . 2 . . . . . 2 DPRO HD3 . 50493 1
18 . 1 . 1 2 2 DPR CA C 13 63.107 0.000 . 1 . . . . . 2 DPRO CA . 50493 1
19 . 1 . 1 2 2 DPR CB C 13 32.640 0.040 . 1 . . . . . 2 DPRO CB . 50493 1
20 . 1 . 1 2 2 DPR CG C 13 26.822 0.008 . 1 . . . . . 2 DPRO CG . 50493 1
21 . 1 . 1 2 2 DPR CD C 13 50.436 0.027 . 1 . . . . . 2 DPRO CD . 50493 1
22 . 1 . 1 3 3 PHE H H 1 8.629 0.002 . 1 . . . . . 3 PHE H . 50493 1
23 . 1 . 1 3 3 PHE HA H 1 5.191 0.004 . 1 . . . . . 3 PHE HA . 50493 1
24 . 1 . 1 3 3 PHE HB2 H 1 2.351 0.003 . 2 . . . . . 3 PHE HB2 . 50493 1
25 . 1 . 1 3 3 PHE HB3 H 1 3.265 0.003 . 2 . . . . . 3 PHE HB3 . 50493 1
26 . 1 . 1 3 3 PHE HD1 H 1 6.991 0.002 . 1 . . . . . 3 PHE HD1 . 50493 1
27 . 1 . 1 3 3 PHE HD2 H 1 6.991 0.002 . 1 . . . . . 3 PHE HD2 . 50493 1
28 . 1 . 1 3 3 PHE HE1 H 1 7.059 0.002 . 1 . . . . . 3 PHE HE1 . 50493 1
29 . 1 . 1 3 3 PHE HE2 H 1 7.059 0.002 . 1 . . . . . 3 PHE HE2 . 50493 1
30 . 1 . 1 3 3 PHE HZ H 1 6.991 0.000 . 1 . . . . . 3 PHE HZ . 50493 1
31 . 1 . 1 3 3 PHE CA C 13 56.172 0.000 . 1 . . . . . 3 PHE CA . 50493 1
32 . 1 . 1 3 3 PHE CB C 13 41.358 0.006 . 1 . . . . . 3 PHE CB . 50493 1
33 . 1 . 1 3 3 PHE CD1 C 13 132.164 0.000 . 1 . . . . . 3 PHE CD1 . 50493 1
34 . 1 . 1 3 3 PHE CD2 C 13 132.164 0.000 . 1 . . . . . 3 PHE CD2 . 50493 1
35 . 1 . 1 3 3 PHE CE1 C 13 130.453 0.000 . 1 . . . . . 3 PHE CE1 . 50493 1
36 . 1 . 1 3 3 PHE CE2 C 13 130.453 0.000 . 1 . . . . . 3 PHE CE2 . 50493 1
37 . 1 . 1 3 3 PHE CZ C 13 128.528 0.000 . 1 . . . . . 3 PHE CZ . 50493 1
38 . 1 . 1 4 4 THR H H 1 8.807 0.001 . 1 . . . . . 4 THR H . 50493 1
39 . 1 . 1 4 4 THR HA H 1 4.554 0.005 . 1 . . . . . 4 THR HA . 50493 1
40 . 1 . 1 4 4 THR HB H 1 4.777 0.003 . 1 . . . . . 4 THR HB . 50493 1
41 . 1 . 1 4 4 THR HG21 H 1 1.339 0.002 . 1 . . . . . 4 THR QG2 . 50493 1
42 . 1 . 1 4 4 THR HG22 H 1 1.339 0.002 . 1 . . . . . 4 THR QG2 . 50493 1
43 . 1 . 1 4 4 THR HG23 H 1 1.339 0.002 . 1 . . . . . 4 THR QG2 . 50493 1
44 . 1 . 1 4 4 THR CA C 13 60.892 0.000 . 1 . . . . . 4 THR CA . 50493 1
45 . 1 . 1 4 4 THR CB C 13 71.123 0.000 . 1 . . . . . 4 THR CB . 50493 1
46 . 1 . 1 4 4 THR CG2 C 13 21.801 0.039 . 1 . . . . . 4 THR CG2 . 50493 1
47 . 1 . 1 5 5 ORN H H 1 9.050 0.001 . 1 . . . . . 5 ORN H . 50493 1
48 . 1 . 1 5 5 ORN HA H 1 4.213 0.003 . 1 . . . . . 5 ORN HA . 50493 1
49 . 1 . 1 5 5 ORN HB2 H 1 1.948 0.002 . 2 . . . . . 5 ORN HB2 . 50493 1
50 . 1 . 1 5 5 ORN HB3 H 1 2.014 0.003 . 2 . . . . . 5 ORN HB3 . 50493 1
51 . 1 . 1 5 5 ORN HG2 H 1 1.804 0.004 . 2 . . . . . 5 ORN HG2 . 50493 1
52 . 1 . 1 5 5 ORN HG3 H 1 1.943 0.000 . 2 . . . . . 5 ORN HG3 . 50493 1
53 . 1 . 1 5 5 ORN HD2 H 1 3.093 0.004 . 2 . . . . . 5 ORN HD2 . 50493 1
54 . 1 . 1 5 5 ORN HD3 H 1 3.093 0.004 . 2 . . . . . 5 ORN HD3 . 50493 1
55 . 1 . 1 5 5 ORN HE1 H 1 7.705 0.000 . 2 . . . . . 5 ORN HE2 . 50493 1
56 . 1 . 1 5 5 ORN HE2 H 1 7.705 0.000 . 2 . . . . . 5 ORN HE3 . 50493 1
57 . 1 . 1 5 5 ORN CA C 13 60.130 0.049 . 1 . . . . . 5 ORN CA . 50493 1
58 . 1 . 1 5 5 ORN CB C 13 29.815 0.000 . 1 . . . . . 5 ORN CB . 50493 1
59 . 1 . 1 5 5 ORN CG C 13 26.543 0.068 . 1 . . . . . 5 ORN CG . 50493 1
60 . 1 . 1 5 5 ORN CD C 13 41.815 0.125 . 1 . . . . . 5 ORN CD . 50493 1
61 . 1 . 1 6 6 ALA H H 1 8.539 0.001 . 1 . . . . . 6 ALA H . 50493 1
62 . 1 . 1 6 6 ALA HA H 1 4.281 0.003 . 1 . . . . . 6 ALA HA . 50493 1
63 . 1 . 1 6 6 ALA HB1 H 1 1.462 0.001 . 1 . . . . . 6 ALA HB# . 50493 1
64 . 1 . 1 6 6 ALA HB2 H 1 1.462 0.001 . 1 . . . . . 6 ALA HB# . 50493 1
65 . 1 . 1 6 6 ALA HB3 H 1 1.462 0.001 . 1 . . . . . 6 ALA HB# . 50493 1
66 . 1 . 1 6 6 ALA CA C 13 55.028 0.000 . 1 . . . . . 6 ALA CA . 50493 1
67 . 1 . 1 6 6 ALA CB C 13 18.590 0.076 . 1 . . . . . 6 ALA CB . 50493 1
68 . 1 . 1 7 7 GLN H H 1 7.923 0.003 . 1 . . . . . 7 GLN H . 50493 1
69 . 1 . 1 7 7 GLN HA H 1 4.039 0.003 . 1 . . . . . 7 GLN HA . 50493 1
70 . 1 . 1 7 7 GLN HB2 H 1 1.735 0.004 . 2 . . . . . 7 GLN HB2 . 50493 1
71 . 1 . 1 7 7 GLN HB3 H 1 1.735 0.004 . 2 . . . . . 7 GLN HB3 . 50493 1
72 . 1 . 1 7 7 GLN HG2 H 1 2.417 0.003 . 2 . . . . . 7 GLN HG2 . 50493 1
73 . 1 . 1 7 7 GLN HG3 H 1 2.585 0.006 . 2 . . . . . 7 GLN HG3 . 50493 1
74 . 1 . 1 7 7 GLN HE21 H 1 6.872 0.000 . 2 . . . . . 7 GLN HE21 . 50493 1
75 . 1 . 1 7 7 GLN HE22 H 1 7.705 0.001 . 2 . . . . . 7 GLN HE22 . 50493 1
76 . 1 . 1 7 7 GLN CA C 13 58.965 0.038 . 1 . . . . . 7 GLN CA . 50493 1
77 . 1 . 1 7 7 GLN CB C 13 28.459 0.000 . 1 . . . . . 7 GLN CB . 50493 1
78 . 1 . 1 7 7 GLN CG C 13 34.761 0.057 . 1 . . . . . 7 GLN CG . 50493 1
79 . 1 . 1 8 8 TRP H H 1 8.693 0.002 . 1 . . . . . 8 TRP H . 50493 1
80 . 1 . 1 8 8 TRP HA H 1 4.432 0.003 . 1 . . . . . 8 TRP HA . 50493 1
81 . 1 . 1 8 8 TRP HB2 H 1 3.280 0.006 . 2 . . . . . 8 TRP HB2 . 50493 1
82 . 1 . 1 8 8 TRP HB3 H 1 3.339 0.004 . 2 . . . . . 8 TRP HB3 . 50493 1
83 . 1 . 1 8 8 TRP HD1 H 1 7.111 0.001 . 1 . . . . . 8 TRP HD1 . 50493 1
84 . 1 . 1 8 8 TRP HE1 H 1 10.682 0.001 . 1 . . . . . 8 TRP HE1 . 50493 1
85 . 1 . 1 8 8 TRP HE3 H 1 7.334 0.004 . 1 . . . . . 8 TRP HE3 . 50493 1
86 . 1 . 1 8 8 TRP HZ2 H 1 7.604 0.003 . 1 . . . . . 8 TRP HZ2 . 50493 1
87 . 1 . 1 8 8 TRP HZ3 H 1 6.887 0.005 . 1 . . . . . 8 TRP HZ3 . 50493 1
88 . 1 . 1 8 8 TRP HH2 H 1 7.096 0.003 . 1 . . . . . 8 TRP HH2 . 50493 1
89 . 1 . 1 8 8 TRP CA C 13 60.053 0.000 . 1 . . . . . 8 TRP CA . 50493 1
90 . 1 . 1 8 8 TRP CB C 13 29.953 0.038 . 1 . . . . . 8 TRP CB . 50493 1
91 . 1 . 1 8 8 TRP CD1 C 13 127.787 0.000 . 1 . . . . . 8 TRP CD1 . 50493 1
92 . 1 . 1 8 8 TRP CE3 C 13 120.962 0.000 . 1 . . . . . 8 TRP CE3 . 50493 1
93 . 1 . 1 8 8 TRP CZ2 C 13 115.151 0.000 . 1 . . . . . 8 TRP CZ2 . 50493 1
94 . 1 . 1 8 8 TRP CZ3 C 13 121.412 0.000 . 1 . . . . . 8 TRP CZ3 . 50493 1
95 . 1 . 1 8 8 TRP CH2 C 13 123.892 0.000 . 1 . . . . . 8 TRP CH2 . 50493 1
96 . 1 . 1 9 9 PHE H H 1 8.353 0.001 . 1 . . . . . 9 PHE H . 50493 1
97 . 1 . 1 9 9 PHE HA H 1 4.302 0.004 . 1 . . . . . 9 PHE HA . 50493 1
98 . 1 . 1 9 9 PHE HB2 H 1 3.254 0.004 . 2 . . . . . 9 PHE HB2 . 50493 1
99 . 1 . 1 9 9 PHE HB3 H 1 3.254 0.004 . 2 . . . . . 9 PHE HB3 . 50493 1
100 . 1 . 1 9 9 PHE HD1 H 1 7.278 0.004 . 1 . . . . . 9 PHE HD1 . 50493 1
101 . 1 . 1 9 9 PHE HD2 H 1 7.278 0.004 . 1 . . . . . 9 PHE HD2 . 50493 1
102 . 1 . 1 9 9 PHE HE1 H 1 7.250 0.003 . 1 . . . . . 9 PHE HE1 . 50493 1
103 . 1 . 1 9 9 PHE HE2 H 1 7.250 0.003 . 1 . . . . . 9 PHE HE2 . 50493 1
104 . 1 . 1 9 9 PHE HZ H 1 7.111 0.002 . 1 . . . . . 9 PHE HZ . 50493 1
105 . 1 . 1 9 9 PHE CA C 13 61.282 0.000 . 1 . . . . . 9 PHE CA . 50493 1
106 . 1 . 1 9 9 PHE CB C 13 38.963 0.028 . 1 . . . . . 9 PHE CB . 50493 1
107 . 1 . 1 9 9 PHE CD1 C 13 132.099 0.000 . 1 . . . . . 9 PHE CD1 . 50493 1
108 . 1 . 1 9 9 PHE CD2 C 13 132.099 0.000 . 1 . . . . . 9 PHE CD2 . 50493 1
109 . 1 . 1 9 9 PHE CE1 C 13 131.519 0.000 . 1 . . . . . 9 PHE CE1 . 50493 1
110 . 1 . 1 9 9 PHE CE2 C 13 131.519 0.000 . 1 . . . . . 9 PHE CE2 . 50493 1
111 . 1 . 1 9 9 PHE CZ C 13 129.909 0.000 . 1 . . . . . 9 PHE CZ . 50493 1
112 . 1 . 1 10 10 ALA H H 1 7.845 0.004 . 1 . . . . . 10 ALA H . 50493 1
113 . 1 . 1 10 10 ALA HA H 1 4.126 0.002 . 1 . . . . . 10 ALA HA . 50493 1
114 . 1 . 1 10 10 ALA HB1 H 1 1.563 0.003 . 1 . . . . . 10 ALA HB# . 50493 1
115 . 1 . 1 10 10 ALA HB2 H 1 1.563 0.003 . 1 . . . . . 10 ALA HB# . 50493 1
116 . 1 . 1 10 10 ALA HB3 H 1 1.563 0.003 . 1 . . . . . 10 ALA HB# . 50493 1
117 . 1 . 1 10 10 ALA CA C 13 55.289 0.044 . 1 . . . . . 10 ALA CA . 50493 1
118 . 1 . 1 10 10 ALA CB C 13 18.388 0.014 . 1 . . . . . 10 ALA CB . 50493 1
119 . 1 . 1 11 11 ILE H H 1 8.044 0.002 . 1 . . . . . 11 ILE H . 50493 1
120 . 1 . 1 11 11 ILE HA H 1 3.559 0.002 . 1 . . . . . 11 ILE HA . 50493 1
121 . 1 . 1 11 11 ILE HB H 1 1.742 0.002 . 1 . . . . . 11 ILE HB . 50493 1
122 . 1 . 1 11 11 ILE HG12 H 1 0.814 0.004 . 2 . . . . . 11 ILE HG12 . 50493 1
123 . 1 . 1 11 11 ILE HG13 H 1 1.519 0.005 . 2 . . . . . 11 ILE HG13 . 50493 1
124 . 1 . 1 11 11 ILE HG21 H 1 0.684 0.001 . 1 . . . . . 11 ILE QG2 . 50493 1
125 . 1 . 1 11 11 ILE HG22 H 1 0.684 0.001 . 1 . . . . . 11 ILE QG2 . 50493 1
126 . 1 . 1 11 11 ILE HG23 H 1 0.684 0.001 . 1 . . . . . 11 ILE QG2 . 50493 1
127 . 1 . 1 11 11 ILE HD11 H 1 0.203 0.002 . 1 . . . . . 11 ILE QD1 . 50493 1
128 . 1 . 1 11 11 ILE HD12 H 1 0.203 0.002 . 1 . . . . . 11 ILE QD1 . 50493 1
129 . 1 . 1 11 11 ILE HD13 H 1 0.203 0.002 . 1 . . . . . 11 ILE QD1 . 50493 1
130 . 1 . 1 11 11 ILE CA C 13 64.693 0.036 . 1 . . . . . 11 ILE CA . 50493 1
131 . 1 . 1 11 11 ILE CB C 13 38.091 0.013 . 1 . . . . . 11 ILE CB . 50493 1
132 . 1 . 1 11 11 ILE CG1 C 13 29.659 0.028 . 1 . . . . . 11 ILE CG1 . 50493 1
133 . 1 . 1 11 11 ILE CG2 C 13 17.622 0.023 . 1 . . . . . 11 ILE CG2 . 50493 1
134 . 1 . 1 11 11 ILE CD1 C 13 13.299 0.019 . 1 . . . . . 11 ILE CD1 . 50493 1
135 . 1 . 1 12 12 GLN H H 1 7.766 0.002 . 1 . . . . . 12 GLN H . 50493 1
136 . 1 . 1 12 12 GLN HA H 1 3.788 0.003 . 1 . . . . . 12 GLN HA . 50493 1
137 . 1 . 1 12 12 GLN HB2 H 1 1.704 0.004 . 2 . . . . . 12 GLN HB2 . 50493 1
138 . 1 . 1 12 12 GLN HB3 H 1 1.824 0.002 . 2 . . . . . 12 GLN HB3 . 50493 1
139 . 1 . 1 12 12 GLN HG2 H 1 1.944 0.003 . 2 . . . . . 12 GLN HG2 . 50493 1
140 . 1 . 1 12 12 GLN HG3 H 1 2.081 0.004 . 2 . . . . . 12 GLN HG3 . 50493 1
141 . 1 . 1 12 12 GLN HE21 H 1 6.668 0.002 . 2 . . . . . 12 GLN HE21 . 50493 1
142 . 1 . 1 12 12 GLN HE22 H 1 6.965 0.004 . 2 . . . . . 12 GLN HE22 . 50493 1
143 . 1 . 1 12 12 GLN CA C 13 57.726 0.000 . 1 . . . . . 12 GLN CA . 50493 1
144 . 1 . 1 12 12 GLN CB C 13 29.288 0.000 . 1 . . . . . 12 GLN CB . 50493 1
145 . 1 . 1 12 12 GLN CG C 13 34.556 0.012 . 1 . . . . . 12 GLN CG . 50493 1
146 . 1 . 1 13 13 HIS H H 1 7.562 0.003 . 1 . . . . . 13 HIS H . 50493 1
147 . 1 . 1 13 13 HIS HA H 1 4.479 0.004 . 1 . . . . . 13 HIS HA . 50493 1
148 . 1 . 1 13 13 HIS HB2 H 1 2.799 0.004 . 2 . . . . . 13 HIS HB2 . 50493 1
149 . 1 . 1 13 13 HIS HB3 H 1 3.427 0.005 . 2 . . . . . 13 HIS HB3 . 50493 1
150 . 1 . 1 13 13 HIS HD2 H 1 7.092 0.001 . 1 . . . . . 13 HIS HD2 . 50493 1
151 . 1 . 1 13 13 HIS HE1 H 1 7.907 0.002 . 1 . . . . . 13 HIS HE1 . 50493 1
152 . 1 . 1 13 13 HIS CA C 13 56.351 0.000 . 1 . . . . . 13 HIS CA . 50493 1
153 . 1 . 1 13 13 HIS CB C 13 28.738 0.076 . 1 . . . . . 13 HIS CB . 50493 1
154 . 1 . 1 13 13 HIS CD2 C 13 119.765 0.000 . 1 . . . . . 13 HIS CD2 . 50493 1
155 . 1 . 1 13 13 HIS CE1 C 13 135.880 0.000 . 1 . . . . . 13 HIS CE1 . 50493 1
156 . 1 . 1 14 14 ILE H H 1 7.436 0.002 . 1 . . . . . 14 ILE H . 50493 1
157 . 1 . 1 14 14 ILE HA H 1 4.116 0.003 . 1 . . . . . 14 ILE HA . 50493 1
158 . 1 . 1 14 14 ILE HB H 1 1.908 0.004 . 1 . . . . . 14 ILE HB . 50493 1
159 . 1 . 1 14 14 ILE HG12 H 1 1.226 0.003 . 2 . . . . . 14 ILE HG12 . 50493 1
160 . 1 . 1 14 14 ILE HG13 H 1 1.634 0.005 . 2 . . . . . 14 ILE HG13 . 50493 1
161 . 1 . 1 14 14 ILE HG21 H 1 0.870 0.002 . 1 . . . . . 14 ILE QG2 . 50493 1
162 . 1 . 1 14 14 ILE HG22 H 1 0.870 0.002 . 1 . . . . . 14 ILE QG2 . 50493 1
163 . 1 . 1 14 14 ILE HG23 H 1 0.870 0.002 . 1 . . . . . 14 ILE QG2 . 50493 1
164 . 1 . 1 14 14 ILE HD11 H 1 0.826 0.004 . 1 . . . . . 14 ILE QD1 . 50493 1
165 . 1 . 1 14 14 ILE HD12 H 1 0.826 0.004 . 1 . . . . . 14 ILE QD1 . 50493 1
166 . 1 . 1 14 14 ILE HD13 H 1 0.826 0.004 . 1 . . . . . 14 ILE QD1 . 50493 1
167 . 1 . 1 14 14 ILE CA C 13 61.676 0.031 . 1 . . . . . 14 ILE CA . 50493 1
168 . 1 . 1 14 14 ILE CB C 13 39.093 0.003 . 1 . . . . . 14 ILE CB . 50493 1
169 . 1 . 1 14 14 ILE CG1 C 13 27.716 0.025 . 1 . . . . . 14 ILE CG1 . 50493 1
170 . 1 . 1 14 14 ILE CG2 C 13 17.778 0.014 . 1 . . . . . 14 ILE CG2 . 50493 1
171 . 1 . 1 14 14 ILE CD1 C 13 14.088 0.001 . 1 . . . . . 14 ILE CD1 . 50493 1
172 . 1 . 1 15 15 SER H H 1 8.373 0.001 . 1 . . . . . 15 SER H . 50493 1
173 . 1 . 1 15 15 SER HA H 1 4.964 0.005 . 1 . . . . . 15 SER HA . 50493 1
174 . 1 . 1 15 15 SER HB2 H 1 3.913 0.006 . 2 . . . . . 15 SER HB2 . 50493 1
175 . 1 . 1 15 15 SER HB3 H 1 3.978 0.006 . 2 . . . . . 15 SER HB3 . 50493 1
176 . 1 . 1 15 15 SER CA C 13 54.570 0.000 . 1 . . . . . 15 SER CA . 50493 1
177 . 1 . 1 15 15 SER CB C 13 63.381 0.003 . 1 . . . . . 15 SER CB . 50493 1
178 . 1 . 1 16 16 PRO HA H 1 4.147 0.006 . 1 . . . . . 16 PRO HA . 50493 1
179 . 1 . 1 16 16 PRO HB2 H 1 2.007 0.005 . 2 . . . . . 16 PRO HB2 . 50493 1
180 . 1 . 1 16 16 PRO HB3 H 1 2.167 0.005 . 2 . . . . . 16 PRO HB3 . 50493 1
181 . 1 . 1 16 16 PRO HG2 H 1 1.825 0.004 . 2 . . . . . 16 PRO HG2 . 50493 1
182 . 1 . 1 16 16 PRO HG3 H 1 2.152 0.002 . 2 . . . . . 16 PRO HG3 . 50493 1
183 . 1 . 1 16 16 PRO HD2 H 1 3.952 0.005 . 2 . . . . . 16 PRO HD2 . 50493 1
184 . 1 . 1 16 16 PRO HD3 H 1 4.121 0.003 . 2 . . . . . 16 PRO HD3 . 50493 1
185 . 1 . 1 16 16 PRO CA C 13 65.315 0.000 . 1 . . . . . 16 PRO CA . 50493 1
186 . 1 . 1 16 16 PRO CB C 13 32.491 0.008 . 1 . . . . . 16 PRO CB . 50493 1
187 . 1 . 1 16 16 PRO CG C 13 27.955 0.027 . 1 . . . . . 16 PRO CG . 50493 1
188 . 1 . 1 16 16 PRO CD C 13 50.836 0.031 . 1 . . . . . 16 PRO CD . 50493 1
189 . 1 . 1 17 17 ORN H H 1 8.700 0.001 . 1 . . . . . 17 ORN H . 50493 1
190 . 1 . 1 17 17 ORN HA H 1 3.952 0.002 . 1 . . . . . 17 ORN HA . 50493 1
191 . 1 . 1 17 17 ORN HB2 H 1 1.912 0.001 . 2 . . . . . 17 ORN HB2 . 50493 1
192 . 1 . 1 17 17 ORN HB3 H 1 1.912 0.001 . 2 . . . . . 17 ORN HB3 . 50493 1
193 . 1 . 1 17 17 ORN HG2 H 1 1.697 0.004 . 2 . . . . . 17 ORN HG2 . 50493 1
194 . 1 . 1 17 17 ORN HG3 H 1 1.774 0.002 . 2 . . . . . 17 ORN HG3 . 50493 1
195 . 1 . 1 17 17 ORN HD2 H 1 3.015 0.003 . 2 . . . . . 17 ORN HD2 . 50493 1
196 . 1 . 1 17 17 ORN HD3 H 1 3.015 0.003 . 2 . . . . . 17 ORN HD3 . 50493 1
197 . 1 . 1 17 17 ORN HE1 H 1 7.888 0.006 . 2 . . . . . 17 ORN HE2 . 50493 1
198 . 1 . 1 17 17 ORN HE2 H 1 7.888 0.006 . 2 . . . . . 17 ORN HE3 . 50493 1
199 . 1 . 1 17 17 ORN CA C 13 59.841 0.075 . 1 . . . . . 17 ORN CA . 50493 1
200 . 1 . 1 17 17 ORN CB C 13 30.108 0.020 . 1 . . . . . 17 ORN CB . 50493 1
201 . 1 . 1 17 17 ORN CG C 13 26.566 0.037 . 1 . . . . . 17 ORN CG . 50493 1
202 . 1 . 1 17 17 ORN CD C 13 41.787 0.057 . 1 . . . . . 17 ORN CD . 50493 1
203 . 1 . 1 18 18 THR H H 1 7.673 0.002 . 1 . . . . . 18 THR H . 50493 1
204 . 1 . 1 18 18 THR HA H 1 4.020 0.005 . 1 . . . . . 18 THR HA . 50493 1
205 . 1 . 1 18 18 THR HB H 1 4.324 0.004 . 1 . . . . . 18 THR HB . 50493 1
206 . 1 . 1 18 18 THR HG21 H 1 1.270 0.002 . 1 . . . . . 18 THR QG2 . 50493 1
207 . 1 . 1 18 18 THR HG22 H 1 1.270 0.002 . 1 . . . . . 18 THR QG2 . 50493 1
208 . 1 . 1 18 18 THR HG23 H 1 1.270 0.002 . 1 . . . . . 18 THR QG2 . 50493 1
209 . 1 . 1 18 18 THR CA C 13 65.640 0.000 . 1 . . . . . 18 THR CA . 50493 1
210 . 1 . 1 18 18 THR CB C 13 68.772 0.000 . 1 . . . . . 18 THR CB . 50493 1
211 . 1 . 1 18 18 THR CG2 C 13 22.145 0.033 . 1 . . . . . 18 THR CG2 . 50493 1
212 . 1 . 1 19 19 ILE H H 1 7.765 0.001 . 1 . . . . . 19 ILE H . 50493 1
213 . 1 . 1 19 19 ILE HA H 1 3.789 0.002 . 1 . . . . . 19 ILE HA . 50493 1
214 . 1 . 1 19 19 ILE HB H 1 1.908 0.003 . 1 . . . . . 19 ILE HB . 50493 1
215 . 1 . 1 19 19 ILE HG12 H 1 1.241 0.006 . 2 . . . . . 19 ILE HG12 . 50493 1
216 . 1 . 1 19 19 ILE HG13 H 1 1.659 0.004 . 2 . . . . . 19 ILE HG13 . 50493 1
217 . 1 . 1 19 19 ILE HG21 H 1 0.920 0.001 . 1 . . . . . 19 ILE QG2 . 50493 1
218 . 1 . 1 19 19 ILE HG22 H 1 0.920 0.001 . 1 . . . . . 19 ILE QG2 . 50493 1
219 . 1 . 1 19 19 ILE HG23 H 1 0.920 0.001 . 1 . . . . . 19 ILE QG2 . 50493 1
220 . 1 . 1 19 19 ILE HD11 H 1 0.843 0.003 . 1 . . . . . 19 ILE QD1 . 50493 1
221 . 1 . 1 19 19 ILE HD12 H 1 0.843 0.003 . 1 . . . . . 19 ILE QD1 . 50493 1
222 . 1 . 1 19 19 ILE HD13 H 1 0.843 0.003 . 1 . . . . . 19 ILE QD1 . 50493 1
223 . 1 . 1 19 19 ILE CA C 13 64.234 0.085 . 1 . . . . . 19 ILE CA . 50493 1
224 . 1 . 1 19 19 ILE CB C 13 37.989 0.017 . 1 . . . . . 19 ILE CB . 50493 1
225 . 1 . 1 19 19 ILE CG1 C 13 28.508 0.010 . 1 . . . . . 19 ILE CG1 . 50493 1
226 . 1 . 1 19 19 ILE CG2 C 13 17.768 0.014 . 1 . . . . . 19 ILE CG2 . 50493 1
227 . 1 . 1 19 19 ILE CD1 C 13 13.422 0.017 . 1 . . . . . 19 ILE CD1 . 50493 1
228 . 1 . 1 20 20 ALA H H 1 8.264 0.002 . 1 . . . . . 20 ALA H . 50493 1
229 . 1 . 1 20 20 ALA HA H 1 4.047 0.004 . 1 . . . . . 20 ALA HA . 50493 1
230 . 1 . 1 20 20 ALA HB1 H 1 1.442 0.001 . 1 . . . . . 20 ALA HB# . 50493 1
231 . 1 . 1 20 20 ALA HB2 H 1 1.442 0.001 . 1 . . . . . 20 ALA HB# . 50493 1
232 . 1 . 1 20 20 ALA HB3 H 1 1.442 0.001 . 1 . . . . . 20 ALA HB# . 50493 1
233 . 1 . 1 20 20 ALA CA C 13 55.079 0.038 . 1 . . . . . 20 ALA CA . 50493 1
234 . 1 . 1 20 20 ALA CB C 13 18.798 0.018 . 1 . . . . . 20 ALA CB . 50493 1
235 . 1 . 1 21 21 MET H H 1 8.142 0.003 . 1 . . . . . 21 MET H . 50493 1
236 . 1 . 1 21 21 MET HA H 1 4.303 0.003 . 1 . . . . . 21 MET HA . 50493 1
237 . 1 . 1 21 21 MET HB2 H 1 2.141 0.003 . 2 . . . . . 21 MET HB2 . 50493 1
238 . 1 . 1 21 21 MET HB3 H 1 2.177 0.004 . 2 . . . . . 21 MET HB3 . 50493 1
239 . 1 . 1 21 21 MET HG2 H 1 2.664 0.004 . 2 . . . . . 21 MET HG2 . 50493 1
240 . 1 . 1 21 21 MET HG3 H 1 2.770 0.003 . 2 . . . . . 21 MET HG3 . 50493 1
241 . 1 . 1 21 21 MET HE1 H 1 2.084 0.001 . 1 . . . . . 21 MET HE# . 50493 1
242 . 1 . 1 21 21 MET HE2 H 1 2.084 0.001 . 1 . . . . . 21 MET HE# . 50493 1
243 . 1 . 1 21 21 MET HE3 H 1 2.084 0.001 . 1 . . . . . 21 MET HE# . 50493 1
244 . 1 . 1 21 21 MET CA C 13 57.571 0.000 . 1 . . . . . 21 MET CA . 50493 1
245 . 1 . 1 21 21 MET CB C 13 31.771 0.013 . 1 . . . . . 21 MET CB . 50493 1
246 . 1 . 1 21 21 MET CG C 13 32.304 0.008 . 1 . . . . . 21 MET CG . 50493 1
247 . 1 . 1 21 21 MET CE C 13 16.813 0.004 . 1 . . . . . 21 MET CE . 50493 1
248 . 1 . 1 22 22 ORN H H 1 7.998 0.004 . 1 . . . . . 22 ORN H . 50493 1
249 . 1 . 1 22 22 ORN HA H 1 4.125 0.003 . 1 . . . . . 22 ORN HA . 50493 1
250 . 1 . 1 22 22 ORN HB2 H 1 1.974 0.005 . 2 . . . . . 22 ORN HB2 . 50493 1
251 . 1 . 1 22 22 ORN HB3 H 1 1.974 0.005 . 2 . . . . . 22 ORN HB3 . 50493 1
252 . 1 . 1 22 22 ORN HG2 H 1 1.783 0.004 . 2 . . . . . 22 ORN HG2 . 50493 1
253 . 1 . 1 22 22 ORN HG3 H 1 1.880 0.005 . 2 . . . . . 22 ORN HG3 . 50493 1
254 . 1 . 1 22 22 ORN HD2 H 1 2.986 0.002 . 2 . . . . . 22 ORN HD2 . 50493 1
255 . 1 . 1 22 22 ORN HD3 H 1 2.986 0.002 . 2 . . . . . 22 ORN HD3 . 50493 1
256 . 1 . 1 22 22 ORN HE1 H 1 7.794 0.001 . 2 . . . . . 22 ORN HE2 . 50493 1
257 . 1 . 1 22 22 ORN HE2 H 1 7.794 0.001 . 2 . . . . . 22 ORN HE3 . 50493 1
258 . 1 . 1 22 22 ORN CA C 13 58.769 0.051 . 1 . . . . . 22 ORN CA . 50493 1
259 . 1 . 1 22 22 ORN CB C 13 29.828 0.000 . 1 . . . . . 22 ORN CB . 50493 1
260 . 1 . 1 22 22 ORN CG C 13 26.575 0.066 . 1 . . . . . 22 ORN CG . 50493 1
261 . 1 . 1 22 22 ORN CD C 13 41.677 0.133 . 1 . . . . . 22 ORN CD . 50493 1
262 . 1 . 1 23 23 ALA H H 1 8.026 0.003 . 1 . . . . . 23 ALA H . 50493 1
263 . 1 . 1 23 23 ALA HA H 1 4.191 0.002 . 1 . . . . . 23 ALA HA . 50493 1
264 . 1 . 1 23 23 ALA HB1 H 1 1.539 0.001 . 1 . . . . . 23 ALA HB# . 50493 1
265 . 1 . 1 23 23 ALA HB2 H 1 1.539 0.001 . 1 . . . . . 23 ALA HB# . 50493 1
266 . 1 . 1 23 23 ALA HB3 H 1 1.539 0.001 . 1 . . . . . 23 ALA HB# . 50493 1
267 . 1 . 1 23 23 ALA CA C 13 55.111 0.051 . 1 . . . . . 23 ALA CA . 50493 1
268 . 1 . 1 23 23 ALA CB C 13 18.700 0.012 . 1 . . . . . 23 ALA CB . 50493 1
269 . 1 . 1 24 24 ILE H H 1 8.149 0.003 . 1 . . . . . 24 ILE H . 50493 1
270 . 1 . 1 24 24 ILE HA H 1 3.888 0.001 . 1 . . . . . 24 ILE HA . 50493 1
271 . 1 . 1 24 24 ILE HB H 1 2.013 0.002 . 1 . . . . . 24 ILE HB . 50493 1
272 . 1 . 1 24 24 ILE HG12 H 1 1.196 0.004 . 2 . . . . . 24 ILE HG12 . 50493 1
273 . 1 . 1 24 24 ILE HG13 H 1 1.789 0.004 . 2 . . . . . 24 ILE HG13 . 50493 1
274 . 1 . 1 24 24 ILE HG21 H 1 0.985 0.001 . 1 . . . . . 24 ILE QG2 . 50493 1
275 . 1 . 1 24 24 ILE HG22 H 1 0.985 0.001 . 1 . . . . . 24 ILE QG2 . 50493 1
276 . 1 . 1 24 24 ILE HG23 H 1 0.985 0.001 . 1 . . . . . 24 ILE QG2 . 50493 1
277 . 1 . 1 24 24 ILE HD11 H 1 0.883 0.004 . 1 . . . . . 24 ILE QD1 . 50493 1
278 . 1 . 1 24 24 ILE HD12 H 1 0.883 0.004 . 1 . . . . . 24 ILE QD1 . 50493 1
279 . 1 . 1 24 24 ILE HD13 H 1 0.883 0.004 . 1 . . . . . 24 ILE QD1 . 50493 1
280 . 1 . 1 24 24 ILE CA C 13 64.461 0.078 . 1 . . . . . 24 ILE CA . 50493 1
281 . 1 . 1 24 24 ILE CB C 13 38.523 0.006 . 1 . . . . . 24 ILE CB . 50493 1
282 . 1 . 1 24 24 ILE CG1 C 13 29.422 0.017 . 1 . . . . . 24 ILE CG1 . 50493 1
283 . 1 . 1 24 24 ILE CG2 C 13 17.736 0.010 . 1 . . . . . 24 ILE CG2 . 50493 1
284 . 1 . 1 24 24 ILE CD1 C 13 13.951 0.005 . 1 . . . . . 24 ILE CD1 . 50493 1
285 . 1 . 1 25 25 ASN H H 1 8.086 0.002 . 1 . . . . . 25 ASN H . 50493 1
286 . 1 . 1 25 25 ASN HA H 1 4.601 0.004 . 1 . . . . . 25 ASN HA . 50493 1
287 . 1 . 1 25 25 ASN HB2 H 1 2.809 0.004 . 2 . . . . . 25 ASN HB2 . 50493 1
288 . 1 . 1 25 25 ASN HB3 H 1 2.859 0.005 . 2 . . . . . 25 ASN HB3 . 50493 1
289 . 1 . 1 25 25 ASN HD21 H 1 6.886 0.002 . 2 . . . . . 25 ASN HD21 . 50493 1
290 . 1 . 1 25 25 ASN HD22 H 1 7.556 0.001 . 2 . . . . . 25 ASN HD22 . 50493 1
291 . 1 . 1 25 25 ASN CA C 13 55.330 0.000 . 1 . . . . . 25 ASN CA . 50493 1
292 . 1 . 1 25 25 ASN CB C 13 38.900 0.007 . 1 . . . . . 25 ASN CB . 50493 1
293 . 1 . 1 26 26 ASN H H 1 7.989 0.002 . 1 . . . . . 26 ASN H . 50493 1
294 . 1 . 1 26 26 ASN HA H 1 4.654 0.007 . 1 . . . . . 26 ASN HA . 50493 1
295 . 1 . 1 26 26 ASN HB2 H 1 2.713 0.004 . 2 . . . . . 26 ASN HB2 . 50493 1
296 . 1 . 1 26 26 ASN HB3 H 1 2.749 0.005 . 2 . . . . . 26 ASN HB3 . 50493 1
297 . 1 . 1 26 26 ASN HD21 H 1 7.024 0.002 . 2 . . . . . 26 ASN HD21 . 50493 1
298 . 1 . 1 26 26 ASN HD22 H 1 7.538 0.002 . 2 . . . . . 26 ASN HD22 . 50493 1
299 . 1 . 1 26 26 ASN CA C 13 54.245 0.000 . 1 . . . . . 26 ASN CA . 50493 1
300 . 1 . 1 26 26 ASN CB C 13 39.609 0.011 . 1 . . . . . 26 ASN CB . 50493 1
301 . 1 . 1 27 27 TYR H H 1 7.812 0.003 . 1 . . . . . 27 TYR H . 50493 1
302 . 1 . 1 27 27 TYR HA H 1 4.353 0.004 . 1 . . . . . 27 TYR HA . 50493 1
303 . 1 . 1 27 27 TYR HB2 H 1 2.864 0.004 . 2 . . . . . 27 TYR HB2 . 50493 1
304 . 1 . 1 27 27 TYR HB3 H 1 2.864 0.004 . 2 . . . . . 27 TYR HB3 . 50493 1
305 . 1 . 1 27 27 TYR HD1 H 1 6.880 0.002 . 1 . . . . . 27 TYR HD1 . 50493 1
306 . 1 . 1 27 27 TYR HD2 H 1 6.880 0.002 . 1 . . . . . 27 TYR HD2 . 50493 1
307 . 1 . 1 27 27 TYR HE1 H 1 6.680 0.002 . 1 . . . . . 27 TYR HE1 . 50493 1
308 . 1 . 1 27 27 TYR HE2 H 1 6.680 0.002 . 1 . . . . . 27 TYR HE2 . 50493 1
309 . 1 . 1 27 27 TYR CA C 13 59.079 0.000 . 1 . . . . . 27 TYR CA . 50493 1
310 . 1 . 1 27 27 TYR CB C 13 38.995 0.042 . 1 . . . . . 27 TYR CB . 50493 1
311 . 1 . 1 27 27 TYR CD1 C 13 133.074 0.000 . 1 . . . . . 27 TYR CD1 . 50493 1
312 . 1 . 1 27 27 TYR CD2 C 13 133.074 0.000 . 1 . . . . . 27 TYR CD2 . 50493 1
313 . 1 . 1 27 27 TYR CE1 C 13 117.968 0.000 . 1 . . . . . 27 TYR CE1 . 50493 1
314 . 1 . 1 27 27 TYR CE2 C 13 117.968 0.000 . 1 . . . . . 27 TYR CE2 . 50493 1
315 . 1 . 1 28 28 ORN H H 1 7.771 0.002 . 1 . . . . . 28 ORN H . 50493 1
316 . 1 . 1 28 28 ORN HA H 1 4.318 0.003 . 1 . . . . . 28 ORN HA . 50493 1
317 . 1 . 1 28 28 ORN HB2 H 1 1.674 0.004 . 2 . . . . . 28 ORN HB2 . 50493 1
318 . 1 . 1 28 28 ORN HB3 H 1 1.756 0.004 . 2 . . . . . 28 ORN HB3 . 50493 1
319 . 1 . 1 28 28 ORN HG2 H 1 1.623 0.004 . 2 . . . . . 28 ORN HG2 . 50493 1
320 . 1 . 1 28 28 ORN HG3 H 1 1.623 0.004 . 2 . . . . . 28 ORN HG3 . 50493 1
321 . 1 . 1 28 28 ORN HD2 H 1 2.965 0.003 . 2 . . . . . 28 ORN HD2 . 50493 1
322 . 1 . 1 28 28 ORN HD3 H 1 2.965 0.003 . 2 . . . . . 28 ORN HD3 . 50493 1
323 . 1 . 1 28 28 ORN HE1 H 1 7.598 0.003 . 2 . . . . . 28 ORN HE2 . 50493 1
324 . 1 . 1 28 28 ORN HE2 H 1 7.598 0.003 . 2 . . . . . 28 ORN HE3 . 50493 1
325 . 1 . 1 28 28 ORN CA C 13 55.164 0.000 . 1 . . . . . 28 ORN CA . 50493 1
326 . 1 . 1 28 28 ORN CB C 13 29.898 0.032 . 1 . . . . . 28 ORN CB . 50493 1
327 . 1 . 1 28 28 ORN CG C 13 26.046 0.082 . 1 . . . . . 28 ORN CG . 50493 1
328 . 1 . 1 29 29 TRP H H 1 8.134 0.005 . 1 . . . . . 29 TRP H . 50493 1
329 . 1 . 1 29 29 TRP HA H 1 4.540 0.003 . 1 . . . . . 29 TRP HA . 50493 1
330 . 1 . 1 29 29 TRP HB2 H 1 3.224 0.004 . 2 . . . . . 29 TRP HB2 . 50493 1
331 . 1 . 1 29 29 TRP HB3 H 1 3.323 0.002 . 2 . . . . . 29 TRP HB3 . 50493 1
332 . 1 . 1 29 29 TRP HD1 H 1 7.328 0.002 . 1 . . . . . 29 TRP HD1 . 50493 1
333 . 1 . 1 29 29 TRP HE1 H 1 10.560 0.001 . 1 . . . . . 29 TRP HE1 . 50493 1
334 . 1 . 1 29 29 TRP HE3 H 1 7.714 0.002 . 1 . . . . . 29 TRP HE3 . 50493 1
335 . 1 . 1 29 29 TRP HZ2 H 1 7.431 0.001 . 1 . . . . . 29 TRP HZ2 . 50493 1
336 . 1 . 1 29 29 TRP HZ3 H 1 7.058 0.002 . 1 . . . . . 29 TRP HZ3 . 50493 1
337 . 1 . 1 29 29 TRP HH2 H 1 7.069 0.004 . 1 . . . . . 29 TRP HH2 . 50493 1
338 . 1 . 1 29 29 TRP CA C 13 57.715 0.000 . 1 . . . . . 29 TRP CA . 50493 1
339 . 1 . 1 29 29 TRP CB C 13 29.986 0.013 . 1 . . . . . 29 TRP CB . 50493 1
340 . 1 . 1 29 29 TRP CD1 C 13 127.660 0.000 . 1 . . . . . 29 TRP CD1 . 50493 1
341 . 1 . 1 29 29 TRP CE3 C 13 121.219 0.000 . 1 . . . . . 29 TRP CE3 . 50493 1
342 . 1 . 1 29 29 TRP CZ2 C 13 114.632 0.000 . 1 . . . . . 29 TRP CZ2 . 50493 1
343 . 1 . 1 29 29 TRP CZ3 C 13 121.767 0.000 . 1 . . . . . 29 TRP CZ3 . 50493 1
344 . 1 . 1 29 29 TRP CH2 C 13 124.168 0.000 . 1 . . . . . 29 TRP CH2 . 50493 1
345 . 1 . 1 30 30 ORN H H 1 8.348 0.001 . 1 . . . . . 30 ORN H . 50493 1
346 . 1 . 1 30 30 ORN HA H 1 4.215 0.003 . 1 . . . . . 30 ORN HA . 50493 1
347 . 1 . 1 30 30 ORN HB2 H 1 1.659 0.005 . 2 . . . . . 30 ORN HB2 . 50493 1
348 . 1 . 1 30 30 ORN HB3 H 1 1.818 0.003 . 2 . . . . . 30 ORN HB3 . 50493 1
349 . 1 . 1 30 30 ORN HG2 H 1 1.604 0.003 . 2 . . . . . 30 ORN HG2 . 50493 1
350 . 1 . 1 30 30 ORN HG3 H 1 1.649 0.001 . 2 . . . . . 30 ORN HG3 . 50493 1
351 . 1 . 1 30 30 ORN HD2 H 1 2.950 0.002 . 2 . . . . . 30 ORN HD2 . 50493 1
352 . 1 . 1 30 30 ORN HD3 H 1 2.950 0.002 . 2 . . . . . 30 ORN HD3 . 50493 1
353 . 1 . 1 30 30 ORN HE1 H 1 7.645 0.006 . 2 . . . . . 30 ORN HE2 . 50493 1
354 . 1 . 1 30 30 ORN HE2 H 1 7.645 0.006 . 2 . . . . . 30 ORN HE3 . 50493 1
355 . 1 . 1 30 30 ORN CA C 13 55.744 0.068 . 1 . . . . . 30 ORN CA . 50493 1
356 . 1 . 1 30 30 ORN CB C 13 30.672 0.028 . 1 . . . . . 30 ORN CB . 50493 1
357 . 1 . 1 30 30 ORN CG C 13 26.059 0.085 . 1 . . . . . 30 ORN CG . 50493 1
358 . 1 . 1 30 30 ORN CD C 13 41.746 0.132 . 1 . . . . . 30 ORN CD . 50493 1
359 . 1 . 1 31 31 NH2 HN1 H 1 7.015 0.000 . 2 . . . . . 31 NH2 HN1 . 50493 1
360 . 1 . 1 31 31 NH2 HN2 H 1 7.090 0.003 . 2 . . . . . 31 NH2 HN2 . 50493 1
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