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 50384
_Assigned_chem_shift_list.ID 3
_Assigned_chem_shift_list.Name CB1_dpc
_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' . . . 50384 3
3 '2D 1H-1H TOCSY' . . . 50384 3
4 '2D 1H-1H NOESY' . . . 50384 3
5 '2D 1H-13C HSQC aliphatic' . . . 50384 3
6 '2D 1H-13C HSQC aromatic' . . . 50384 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 . . 50384 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 . 2 . 2 1 1 ACE H1 H 1 2.077 0.001 . 1 . . . . . 0 ACE H1 . 50384 3
2 . 2 . 2 1 1 ACE H2 H 1 2.077 0.001 . 1 . . . . . 0 ACE H2 . 50384 3
3 . 2 . 2 1 1 ACE H3 H 1 2.077 0.001 . 1 . . . . . 0 ACE H3 . 50384 3
4 . 2 . 2 1 1 ACE CH3 C 13 24.720 0.000 . 1 . . . . . 0 ACE CH3 . 50384 3
5 . 2 . 2 2 2 THR H H 1 8.278 0.001 . 1 . . . . . 1 THR H . 50384 3
6 . 2 . 2 2 2 THR HA H 1 4.263 0.004 . 1 . . . . . 1 THR HA . 50384 3
7 . 2 . 2 2 2 THR HB H 1 4.111 0.004 . 1 . . . . . 1 THR HB . 50384 3
8 . 2 . 2 2 2 THR HG21 H 1 1.190 0.001 . 1 . . . . . 1 THR QG2 . 50384 3
9 . 2 . 2 2 2 THR HG22 H 1 1.190 0.001 . 1 . . . . . 1 THR QG2 . 50384 3
10 . 2 . 2 2 2 THR HG23 H 1 1.190 0.001 . 1 . . . . . 1 THR QG2 . 50384 3
11 . 2 . 2 2 2 THR CA C 13 62.816 0.000 . 1 . . . . . 1 THR CA . 50384 3
12 . 2 . 2 2 2 THR CB C 13 69.926 0.000 . 1 . . . . . 1 THR CB . 50384 3
13 . 2 . 2 2 2 THR CG2 C 13 21.856 0.000 . 1 . . . . . 1 THR CG2 . 50384 3
14 . 2 . 2 3 3 VAL H H 1 8.236 0.002 . 1 . . . . . 2 VAL H . 50384 3
15 . 2 . 2 3 3 VAL HA H 1 4.124 0.006 . 1 . . . . . 2 VAL HA . 50384 3
16 . 2 . 2 3 3 VAL HB H 1 2.084 0.001 . 1 . . . . . 2 VAL HB . 50384 3
17 . 2 . 2 3 3 VAL HG11 H 1 0.910 0.008 . 2 . . . . . 2 VAL QG1 . 50384 3
18 . 2 . 2 3 3 VAL HG12 H 1 0.910 0.008 . 2 . . . . . 2 VAL QG1 . 50384 3
19 . 2 . 2 3 3 VAL HG13 H 1 0.910 0.008 . 2 . . . . . 2 VAL QG1 . 50384 3
20 . 2 . 2 3 3 VAL HG21 H 1 0.942 0.006 . 2 . . . . . 2 VAL QG2 . 50384 3
21 . 2 . 2 3 3 VAL HG22 H 1 0.942 0.006 . 2 . . . . . 2 VAL QG2 . 50384 3
22 . 2 . 2 3 3 VAL HG23 H 1 0.942 0.006 . 2 . . . . . 2 VAL QG2 . 50384 3
23 . 2 . 2 3 3 VAL CA C 13 62.206 0.000 . 1 . . . . . 2 VAL CA . 50384 3
24 . 2 . 2 3 3 VAL CB C 13 33.005 0.000 . 1 . . . . . 2 VAL CB . 50384 3
25 . 2 . 2 3 3 VAL CG1 C 13 21.296 0.000 . 1 . . . . . 2 VAL CG1 . 50384 3
26 . 2 . 2 3 3 VAL CG2 C 13 20.921 0.000 . 1 . . . . . 2 VAL CG2 . 50384 3
27 . 2 . 2 4 4 ASN H H 1 8.655 0.003 . 1 . . . . . 3 ASN H . 50384 3
28 . 2 . 2 4 4 ASN HB2 H 1 2.941 0.001 . 2 . . . . . 3 ASN HB2 . 50384 3
29 . 2 . 2 4 4 ASN HB3 H 1 2.702 0.000 . 2 . . . . . 3 ASN HB3 . 50384 3
30 . 2 . 2 4 4 ASN HD21 H 1 6.732 0.001 . 2 . . . . . 3 ASN HD21 . 50384 3
31 . 2 . 2 4 4 ASN HD22 H 1 8.109 0.003 . 2 . . . . . 3 ASN HD22 . 50384 3
32 . 2 . 2 5 5 PRO HA H 1 4.356 0.004 . 1 . . . . . 4 PRO HA . 50384 3
33 . 2 . 2 5 5 PRO HB2 H 1 1.884 0.000 . 2 . . . . . 4 PRO HB2 . 50384 3
34 . 2 . 2 5 5 PRO HB3 H 1 2.419 0.004 . 2 . . . . . 4 PRO HB3 . 50384 3
35 . 2 . 2 5 5 PRO HG2 H 1 2.064 0.004 . 2 . . . . . 4 PRO HG2 . 50384 3
36 . 2 . 2 5 5 PRO HG3 H 1 2.064 0.004 . 2 . . . . . 4 PRO HG3 . 50384 3
37 . 2 . 2 5 5 PRO HD2 H 1 3.747 0.001 . 2 . . . . . 4 PRO HD2 . 50384 3
38 . 2 . 2 5 5 PRO HD3 H 1 3.862 0.007 . 2 . . . . . 4 PRO HD3 . 50384 3
39 . 2 . 2 5 5 PRO CB C 13 32.344 0.016 . 1 . . . . . 4 PRO CB . 50384 3
40 . 2 . 2 5 5 PRO CG C 13 27.848 0.000 . 1 . . . . . 4 PRO CG . 50384 3
41 . 2 . 2 5 5 PRO CD C 13 50.939 0.005 . 1 . . . . . 4 PRO CD . 50384 3
42 . 2 . 2 6 6 ILE H H 1 8.015 0.003 . 1 . . . . . 5 ILE H . 50384 3
43 . 2 . 2 6 6 ILE HA H 1 3.823 0.004 . 1 . . . . . 5 ILE HA . 50384 3
44 . 2 . 2 6 6 ILE HB H 1 2.020 0.000 . 1 . . . . . 5 ILE HB . 50384 3
45 . 2 . 2 6 6 ILE HG12 H 1 1.189 0.010 . 2 . . . . . 5 ILE HG12 . 50384 3
46 . 2 . 2 6 6 ILE HG13 H 1 1.668 0.000 . 2 . . . . . 5 ILE HG13 . 50384 3
47 . 2 . 2 6 6 ILE HG21 H 1 0.875 0.000 . 1 . . . . . 5 ILE QG2 . 50384 3
48 . 2 . 2 6 6 ILE HG22 H 1 0.875 0.000 . 1 . . . . . 5 ILE QG2 . 50384 3
49 . 2 . 2 6 6 ILE HG23 H 1 0.875 0.000 . 1 . . . . . 5 ILE QG2 . 50384 3
50 . 2 . 2 6 6 ILE HD11 H 1 0.911 0.000 . 1 . . . . . 5 ILE QD1 . 50384 3
51 . 2 . 2 6 6 ILE HD12 H 1 0.911 0.000 . 1 . . . . . 5 ILE QD1 . 50384 3
52 . 2 . 2 6 6 ILE HD13 H 1 0.911 0.000 . 1 . . . . . 5 ILE QD1 . 50384 3
53 . 2 . 2 6 6 ILE CA C 13 64.387 0.000 . 1 . . . . . 5 ILE CA . 50384 3
54 . 2 . 2 6 6 ILE CB C 13 37.614 0.000 . 1 . . . . . 5 ILE CB . 50384 3
55 . 2 . 2 6 6 ILE CG1 C 13 29.136 0.000 . 1 . . . . . 5 ILE CG1 . 50384 3
56 . 2 . 2 6 6 ILE CG2 C 13 17.651 0.000 . 1 . . . . . 5 ILE CG2 . 50384 3
57 . 2 . 2 6 6 ILE CD1 C 13 13.325 0.000 . 1 . . . . . 5 ILE CD1 . 50384 3
58 . 2 . 2 7 7 ILE H H 1 7.601 0.001 . 1 . . . . . 6 ILE H . 50384 3
59 . 2 . 2 7 7 ILE HA H 1 3.671 0.003 . 1 . . . . . 6 ILE HA . 50384 3
60 . 2 . 2 7 7 ILE HB H 1 1.993 0.008 . 1 . . . . . 6 ILE HB . 50384 3
61 . 2 . 2 7 7 ILE HG12 H 1 1.218 0.004 . 2 . . . . . 6 ILE HG12 . 50384 3
62 . 2 . 2 7 7 ILE HG13 H 1 1.555 0.006 . 2 . . . . . 6 ILE HG13 . 50384 3
63 . 2 . 2 7 7 ILE HG21 H 1 0.872 0.004 . 1 . . . . . 6 ILE QG2 . 50384 3
64 . 2 . 2 7 7 ILE HG22 H 1 0.872 0.004 . 1 . . . . . 6 ILE QG2 . 50384 3
65 . 2 . 2 7 7 ILE HG23 H 1 0.872 0.004 . 1 . . . . . 6 ILE QG2 . 50384 3
66 . 2 . 2 7 7 ILE HD11 H 1 0.854 0.000 . 1 . . . . . 6 ILE QD1 . 50384 3
67 . 2 . 2 7 7 ILE HD12 H 1 0.854 0.000 . 1 . . . . . 6 ILE QD1 . 50384 3
68 . 2 . 2 7 7 ILE HD13 H 1 0.854 0.000 . 1 . . . . . 6 ILE QD1 . 50384 3
69 . 2 . 2 7 7 ILE CA C 13 64.098 0.000 . 1 . . . . . 6 ILE CA . 50384 3
70 . 2 . 2 7 7 ILE CB C 13 37.131 0.000 . 1 . . . . . 6 ILE CB . 50384 3
71 . 2 . 2 7 7 ILE CG1 C 13 28.562 0.003 . 1 . . . . . 6 ILE CG1 . 50384 3
72 . 2 . 2 7 7 ILE CG2 C 13 17.651 0.000 . 1 . . . . . 6 ILE CG2 . 50384 3
73 . 2 . 2 7 7 ILE CD1 C 13 12.270 0.000 . 1 . . . . . 6 ILE CD1 . 50384 3
74 . 2 . 2 8 8 TYR H H 1 8.096 0.004 . 1 . . . . . 7 TYR H . 50384 3
75 . 2 . 2 8 8 TYR HA H 1 4.111 0.004 . 1 . . . . . 7 TYR HA . 50384 3
76 . 2 . 2 8 8 TYR HB2 H 1 3.025 0.003 . 2 . . . . . 7 TYR HB2 . 50384 3
77 . 2 . 2 8 8 TYR HB3 H 1 3.066 0.002 . 2 . . . . . 7 TYR HB3 . 50384 3
78 . 2 . 2 8 8 TYR HD1 H 1 7.085 0.004 . 1 . . . . . 7 TYR HD1 . 50384 3
79 . 2 . 2 8 8 TYR HD2 H 1 7.085 0.004 . 1 . . . . . 7 TYR HD2 . 50384 3
80 . 2 . 2 8 8 TYR HE1 H 1 6.808 0.005 . 1 . . . . . 7 TYR HE1 . 50384 3
81 . 2 . 2 8 8 TYR HE2 H 1 6.808 0.005 . 1 . . . . . 7 TYR HE2 . 50384 3
82 . 2 . 2 8 8 TYR CA C 13 61.024 0.000 . 1 . . . . . 7 TYR CA . 50384 3
83 . 2 . 2 8 8 TYR CB C 13 38.125 0.012 . 1 . . . . . 7 TYR CB . 50384 3
84 . 2 . 2 8 8 TYR CD1 C 13 132.929 0.000 . 1 . . . . . 7 TYR CD1 . 50384 3
85 . 2 . 2 8 8 TYR CD2 C 13 132.929 0.000 . 1 . . . . . 7 TYR CD2 . 50384 3
86 . 2 . 2 8 8 TYR CE1 C 13 118.320 0.000 . 1 . . . . . 7 TYR CE1 . 50384 3
87 . 2 . 2 8 8 TYR CE2 C 13 118.320 0.000 . 1 . . . . . 7 TYR CE2 . 50384 3
88 . 2 . 2 9 9 ALA H H 1 7.900 0.002 . 1 . . . . . 8 ALA H . 50384 3
89 . 2 . 2 9 9 ALA HA H 1 4.075 0.004 . 1 . . . . . 8 ALA HA . 50384 3
90 . 2 . 2 9 9 ALA HB1 H 1 1.543 0.003 . 1 . . . . . 8 ALA HB . 50384 3
91 . 2 . 2 9 9 ALA HB2 H 1 1.543 0.003 . 1 . . . . . 8 ALA HB . 50384 3
92 . 2 . 2 9 9 ALA HB3 H 1 1.543 0.003 . 1 . . . . . 8 ALA HB . 50384 3
93 . 2 . 2 9 9 ALA CA C 13 54.783 0.000 . 1 . . . . . 8 ALA CA . 50384 3
94 . 2 . 2 9 9 ALA CB C 13 18.641 0.000 . 1 . . . . . 8 ALA CB . 50384 3
95 . 2 . 2 10 10 LEU H H 1 7.949 0.003 . 1 . . . . . 9 LEU H . 50384 3
96 . 2 . 2 10 10 LEU HA H 1 4.079 0.003 . 1 . . . . . 9 LEU HA . 50384 3
97 . 2 . 2 10 10 LEU HB2 H 1 1.538 0.007 . 2 . . . . . 9 LEU HB2 . 50384 3
98 . 2 . 2 10 10 LEU HB3 H 1 1.906 0.011 . 2 . . . . . 9 LEU HB3 . 50384 3
99 . 2 . 2 10 10 LEU HG H 1 1.921 0.000 . 1 . . . . . 9 LEU HG . 50384 3
100 . 2 . 2 10 10 LEU HD11 H 1 0.851 0.007 . 2 . . . . . 9 LEU QD1 . 50384 3
101 . 2 . 2 10 10 LEU HD12 H 1 0.851 0.007 . 2 . . . . . 9 LEU QD1 . 50384 3
102 . 2 . 2 10 10 LEU HD13 H 1 0.851 0.007 . 2 . . . . . 9 LEU QD1 . 50384 3
103 . 2 . 2 10 10 LEU HD21 H 1 0.874 0.001 . 2 . . . . . 9 LEU QD2 . 50384 3
104 . 2 . 2 10 10 LEU HD22 H 1 0.874 0.001 . 2 . . . . . 9 LEU QD2 . 50384 3
105 . 2 . 2 10 10 LEU HD23 H 1 0.874 0.001 . 2 . . . . . 9 LEU QD2 . 50384 3
106 . 2 . 2 10 10 LEU CA C 13 57.148 0.000 . 1 . . . . . 9 LEU CA . 50384 3
107 . 2 . 2 10 10 LEU CB C 13 42.181 0.006 . 1 . . . . . 9 LEU CB . 50384 3
108 . 2 . 2 10 10 LEU CG C 13 26.948 0.000 . 1 . . . . . 9 LEU CG . 50384 3
109 . 2 . 2 10 10 LEU CD1 C 13 23.530 0.000 . 1 . . . . . 9 LEU CD1 . 50384 3
110 . 2 . 2 10 10 LEU CD2 C 13 25.831 0.000 . 1 . . . . . 9 LEU CD2 . 50384 3
111 . 2 . 2 11 11 ARG H H 1 7.948 0.003 . 1 . . . . . 10 ARG H . 50384 3
112 . 2 . 2 11 11 ARG HA H 1 4.179 0.003 . 1 . . . . . 10 ARG HA . 50384 3
113 . 2 . 2 11 11 ARG HB2 H 1 1.806 0.003 . 2 . . . . . 10 ARG HB2 . 50384 3
114 . 2 . 2 11 11 ARG HB3 H 1 1.905 0.009 . 2 . . . . . 10 ARG HB3 . 50384 3
115 . 2 . 2 11 11 ARG HG2 H 1 1.671 0.003 . 2 . . . . . 10 ARG HG2 . 50384 3
116 . 2 . 2 11 11 ARG HD2 H 1 3.088 0.004 . 2 . . . . . 10 ARG HD2 . 50384 3
117 . 2 . 2 11 11 ARG HD3 H 1 3.088 0.004 . 2 . . . . . 10 ARG HD3 . 50384 3
118 . 2 . 2 11 11 ARG HE H 1 7.460 0.000 . 1 . . . . . 10 ARG HE . 50384 3
119 . 2 . 2 11 11 ARG CD C 13 43.808 0.000 . 1 . . . . . 10 ARG CD . 50384 3
120 . 2 . 2 12 12 SER H H 1 7.763 0.002 . 1 . . . . . 11 SER H . 50384 3
121 . 2 . 2 12 12 SER HA H 1 4.321 0.002 . 1 . . . . . 11 SER HA . 50384 3
122 . 2 . 2 12 12 SER HB2 H 1 3.795 0.001 . 2 . . . . . 11 SER HB2 . 50384 3
123 . 2 . 2 12 12 SER HB3 H 1 3.867 0.005 . 2 . . . . . 11 SER HB3 . 50384 3
124 . 2 . 2 13 13 LYS H H 1 7.981 0.003 . 1 . . . . . 12 LYS H . 50384 3
125 . 2 . 2 13 13 LYS HA H 1 4.245 0.006 . 1 . . . . . 12 LYS HA . 50384 3
126 . 2 . 2 13 13 LYS HB2 H 1 1.784 0.004 . 2 . . . . . 12 LYS HB2 . 50384 3
127 . 2 . 2 13 13 LYS HB3 H 1 1.864 0.005 . 2 . . . . . 12 LYS HB3 . 50384 3
128 . 2 . 2 13 13 LYS HG2 H 1 1.442 0.000 . 2 . . . . . 12 LYS HG2 . 50384 3
129 . 2 . 2 13 13 LYS HG3 H 1 1.471 0.000 . 2 . . . . . 12 LYS HG3 . 50384 3
130 . 2 . 2 13 13 LYS HD2 H 1 1.658 0.000 . 2 . . . . . 12 LYS HD2 . 50384 3
131 . 2 . 2 13 13 LYS HD3 H 1 1.658 0.000 . 2 . . . . . 12 LYS HD3 . 50384 3
132 . 2 . 2 13 13 LYS HE2 H 1 2.922 0.000 . 2 . . . . . 12 LYS HE2 . 50384 3
133 . 2 . 2 13 13 LYS HE3 H 1 2.922 0.000 . 2 . . . . . 12 LYS HE3 . 50384 3
134 . 2 . 2 13 13 LYS CB C 13 32.801 0.009 . 1 . . . . . 12 LYS CB . 50384 3
135 . 2 . 2 13 13 LYS CG C 13 24.852 0.002 . 1 . . . . . 12 LYS CG . 50384 3
136 . 2 . 2 13 13 LYS CD C 13 28.906 0.000 . 1 . . . . . 12 LYS CD . 50384 3
137 . 2 . 2 13 13 LYS CE C 13 42.114 0.000 . 1 . . . . . 12 LYS CE . 50384 3
138 . 2 . 2 14 14 ASP H H 1 8.308 0.002 . 1 . . . . . 13 ASP H . 50384 3
139 . 2 . 2 14 14 ASP HA H 1 4.660 0.000 . 1 . . . . . 13 ASP HA . 50384 3
140 . 2 . 2 14 14 ASP HB2 H 1 2.551 0.007 . 2 . . . . . 13 ASP HB2 . 50384 3
141 . 2 . 2 14 14 ASP HB3 H 1 2.837 0.004 . 2 . . . . . 13 ASP HB3 . 50384 3
142 . 2 . 2 14 14 ASP CB C 13 40.538 0.015 . 1 . . . . . 13 ASP CB . 50384 3
143 . 2 . 2 15 15 LEU H H 1 8.354 0.001 . 1 . . . . . 14 LEU H . 50384 3
144 . 2 . 2 15 15 LEU HA H 1 4.084 0.004 . 1 . . . . . 14 LEU HA . 50384 3
145 . 2 . 2 15 15 LEU HB2 H 1 1.601 0.008 . 2 . . . . . 14 LEU HB2 . 50384 3
146 . 2 . 2 15 15 LEU HB3 H 1 1.767 0.004 . 2 . . . . . 14 LEU HB3 . 50384 3
147 . 2 . 2 15 15 LEU HG H 1 1.762 0.000 . 1 . . . . . 14 LEU HG . 50384 3
148 . 2 . 2 15 15 LEU HD11 H 1 0.869 0.002 . 2 . . . . . 14 LEU QD1 . 50384 3
149 . 2 . 2 15 15 LEU HD12 H 1 0.869 0.002 . 2 . . . . . 14 LEU QD1 . 50384 3
150 . 2 . 2 15 15 LEU HD13 H 1 0.869 0.002 . 2 . . . . . 14 LEU QD1 . 50384 3
151 . 2 . 2 15 15 LEU HD21 H 1 0.962 0.004 . 2 . . . . . 14 LEU QD2 . 50384 3
152 . 2 . 2 15 15 LEU HD22 H 1 0.962 0.004 . 2 . . . . . 14 LEU QD2 . 50384 3
153 . 2 . 2 15 15 LEU HD23 H 1 0.962 0.004 . 2 . . . . . 14 LEU QD2 . 50384 3
154 . 2 . 2 15 15 LEU CA C 13 57.148 0.000 . 1 . . . . . 14 LEU CA . 50384 3
155 . 2 . 2 15 15 LEU CB C 13 42.097 0.013 . 1 . . . . . 14 LEU CB . 50384 3
156 . 2 . 2 15 15 LEU CG C 13 27.240 0.000 . 1 . . . . . 14 LEU CG . 50384 3
157 . 2 . 2 15 15 LEU CD1 C 13 23.937 0.000 . 1 . . . . . 14 LEU CD1 . 50384 3
158 . 2 . 2 15 15 LEU CD2 C 13 25.515 0.000 . 1 . . . . . 14 LEU CD2 . 50384 3
159 . 2 . 2 16 16 ARG H H 1 8.280 0.001 . 1 . . . . . 15 ARG H . 50384 3
160 . 2 . 2 16 16 ARG HA H 1 3.965 0.004 . 1 . . . . . 15 ARG HA . 50384 3
161 . 2 . 2 16 16 ARG HB2 H 1 1.772 0.002 . 2 . . . . . 15 ARG HB2 . 50384 3
162 . 2 . 2 16 16 ARG HB3 H 1 1.804 0.000 . 2 . . . . . 15 ARG HB3 . 50384 3
163 . 2 . 2 16 16 ARG HG2 H 1 1.517 0.007 . 2 . . . . . 15 ARG HG2 . 50384 3
164 . 2 . 2 16 16 ARG HG3 H 1 1.562 0.001 . 2 . . . . . 15 ARG HG3 . 50384 3
165 . 2 . 2 16 16 ARG HD2 H 1 3.182 0.003 . 2 . . . . . 15 ARG HD2 . 50384 3
166 . 2 . 2 16 16 ARG HD3 H 1 3.182 0.003 . 2 . . . . . 15 ARG HD3 . 50384 3
167 . 2 . 2 16 16 ARG HE H 1 7.709 0.002 . 1 . . . . . 15 ARG HE . 50384 3
168 . 2 . 2 16 16 ARG CA C 13 58.929 0.000 . 1 . . . . . 15 ARG CA . 50384 3
169 . 2 . 2 16 16 ARG CB C 13 29.901 0.010 . 1 . . . . . 15 ARG CB . 50384 3
170 . 2 . 2 16 16 ARG CG C 13 27.894 0.006 . 1 . . . . . 15 ARG CG . 50384 3
171 . 2 . 2 16 16 ARG CD C 13 43.432 0.000 . 1 . . . . . 15 ARG CD . 50384 3
172 . 2 . 2 17 17 HIS H H 1 7.875 0.004 . 1 . . . . . 16 HIS H . 50384 3
173 . 2 . 2 17 17 HIS HA H 1 4.541 0.006 . 1 . . . . . 16 HIS HA . 50384 3
174 . 2 . 2 17 17 HIS HB2 H 1 3.107 0.005 . 2 . . . . . 16 HIS HB2 . 50384 3
175 . 2 . 2 17 17 HIS HB3 H 1 3.311 0.003 . 2 . . . . . 16 HIS HB3 . 50384 3
176 . 2 . 2 17 17 HIS HD2 H 1 7.215 0.004 . 1 . . . . . 16 HIS HD2 . 50384 3
177 . 2 . 2 17 17 HIS HE1 H 1 8.325 0.006 . 1 . . . . . 16 HIS HE1 . 50384 3
178 . 2 . 2 17 17 HIS CB C 13 29.182 0.000 . 1 . . . . . 16 HIS CB . 50384 3
179 . 2 . 2 17 17 HIS CD2 C 13 119.793 0.000 . 1 . . . . . 16 HIS CD2 . 50384 3
180 . 2 . 2 17 17 HIS CE1 C 13 136.839 0.000 . 1 . . . . . 16 HIS CE1 . 50384 3
181 . 2 . 2 18 18 ALA H H 1 7.785 0.001 . 1 . . . . . 17 ALA H . 50384 3
182 . 2 . 2 18 18 ALA HA H 1 4.079 0.004 . 1 . . . . . 17 ALA HA . 50384 3
183 . 2 . 2 18 18 ALA HB1 H 1 1.263 0.004 . 1 . . . . . 17 ALA HB . 50384 3
184 . 2 . 2 18 18 ALA HB2 H 1 1.263 0.004 . 1 . . . . . 17 ALA HB . 50384 3
185 . 2 . 2 18 18 ALA HB3 H 1 1.263 0.004 . 1 . . . . . 17 ALA HB . 50384 3
186 . 2 . 2 18 18 ALA CA C 13 54.053 0.000 . 1 . . . . . 17 ALA CA . 50384 3
187 . 2 . 2 18 18 ALA CB C 13 18.883 0.000 . 1 . . . . . 17 ALA CB . 50384 3
188 . 2 . 2 19 19 PHE H H 1 7.881 0.005 . 1 . . . . . 18 PHE H . 50384 3
189 . 2 . 2 19 19 PHE HA H 1 4.510 0.004 . 1 . . . . . 18 PHE HA . 50384 3
190 . 2 . 2 19 19 PHE HB2 H 1 3.017 0.005 . 2 . . . . . 18 PHE HB2 . 50384 3
191 . 2 . 2 19 19 PHE HB3 H 1 3.234 0.004 . 2 . . . . . 18 PHE HB3 . 50384 3
192 . 2 . 2 19 19 PHE HD1 H 1 7.285 0.005 . 1 . . . . . 18 PHE HD1 . 50384 3
193 . 2 . 2 19 19 PHE HD2 H 1 7.285 0.005 . 1 . . . . . 18 PHE HD2 . 50384 3
194 . 2 . 2 19 19 PHE HE1 H 1 7.227 0.000 . 1 . . . . . 18 PHE HE1 . 50384 3
195 . 2 . 2 19 19 PHE HE2 H 1 7.227 0.000 . 1 . . . . . 18 PHE HE2 . 50384 3
196 . 2 . 2 19 19 PHE HZ H 1 7.124 0.000 . 1 . . . . . 18 PHE HZ . 50384 3
197 . 2 . 2 19 19 PHE CB C 13 39.535 0.017 . 1 . . . . . 18 PHE CB . 50384 3
198 . 2 . 2 19 19 PHE CD1 C 13 132.049 0.000 . 1 . . . . . 18 PHE CD1 . 50384 3
199 . 2 . 2 19 19 PHE CD2 C 13 132.049 0.000 . 1 . . . . . 18 PHE CD2 . 50384 3
200 . 2 . 2 19 19 PHE CE1 C 13 130.974 0.000 . 1 . . . . . 18 PHE CE1 . 50384 3
201 . 2 . 2 19 19 PHE CE2 C 13 130.974 0.000 . 1 . . . . . 18 PHE CE2 . 50384 3
202 . 2 . 2 19 19 PHE CZ C 13 129.121 0.000 . 1 . . . . . 18 PHE CZ . 50384 3
203 . 2 . 2 20 20 ARG H H 1 7.872 0.002 . 1 . . . . . 19 ARG H . 50384 3
204 . 2 . 2 20 20 ARG HA H 1 4.231 0.003 . 1 . . . . . 19 ARG HA . 50384 3
205 . 2 . 2 20 20 ARG HB2 H 1 1.785 0.006 . 2 . . . . . 19 ARG HB2 . 50384 3
206 . 2 . 2 20 20 ARG HB3 H 1 1.897 0.005 . 2 . . . . . 19 ARG HB3 . 50384 3
207 . 2 . 2 20 20 ARG HG2 H 1 1.621 0.002 . 2 . . . . . 19 ARG HG2 . 50384 3
208 . 2 . 2 20 20 ARG HG3 H 1 1.656 0.005 . 2 . . . . . 19 ARG HG3 . 50384 3
209 . 2 . 2 20 20 ARG HD2 H 1 3.162 0.005 . 2 . . . . . 19 ARG HD2 . 50384 3
210 . 2 . 2 20 20 ARG HD3 H 1 3.162 0.005 . 2 . . . . . 19 ARG HD3 . 50384 3
211 . 2 . 2 20 20 ARG HE H 1 7.452 0.003 . 1 . . . . . 19 ARG HE . 50384 3
212 . 2 . 2 20 20 ARG CB C 13 30.886 0.020 . 1 . . . . . 19 ARG CB . 50384 3
213 . 2 . 2 20 20 ARG CD C 13 43.511 0.000 . 1 . . . . . 19 ARG CD . 50384 3
214 . 2 . 2 21 21 NH2 HN1 H 1 7.195 0.001 . 2 . . . . . 20 NH2 HN1 . 50384 3
215 . 2 . 2 21 21 NH2 HN2 H 1 7.396 0.001 . 2 . . . . . 20 NH2 HN2 . 50384 3
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