Content for NMR-STAR saveframe, "assigned_chemical_shifts_2"
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 50383
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name CB1_tfe
_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' . . . 50383 2
3 '2D 1H-1H TOCSY' . . . 50383 2
4 '2D 1H-1H NOESY' . . . 50383 2
5 '2D 1H-13C HSQC aliphatic' . . . 50383 2
6 '2D 1H-13C HSQC aromatic' . . . 50383 2
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 . . 50383 2
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 2.103 0.002 . 1 . . . . . 0 ACE H1 . 50383 2
2 . 2 . 2 1 1 ACE H2 H 1 2.103 0.002 . 1 . . . . . 0 ACE H2 . 50383 2
3 . 2 . 2 1 1 ACE H3 H 1 2.103 0.002 . 1 . . . . . 0 ACE H3 . 50383 2
4 . 2 . 2 1 1 ACE CH3 C 13 24.190 0.000 . 1 . . . . . 0 ACE CH3 . 50383 2
5 . 2 . 2 2 2 THR H H 1 7.890 0.003 . 1 . . . . . 1 THR H . 50383 2
6 . 2 . 2 2 2 THR HA H 1 4.377 0.003 . 1 . . . . . 1 THR HA . 50383 2
7 . 2 . 2 2 2 THR HB H 1 4.192 0.008 . 1 . . . . . 1 THR HB . 50383 2
8 . 2 . 2 2 2 THR HG21 H 1 1.228 0.006 . 1 . . . . . 1 THR QG2 . 50383 2
9 . 2 . 2 2 2 THR HG22 H 1 1.228 0.006 . 1 . . . . . 1 THR QG2 . 50383 2
10 . 2 . 2 2 2 THR HG23 H 1 1.228 0.006 . 1 . . . . . 1 THR QG2 . 50383 2
11 . 2 . 2 2 2 THR CA C 13 61.765 0.000 . 1 . . . . . 1 THR CA . 50383 2
12 . 2 . 2 2 2 THR CB C 13 69.941 0.000 . 1 . . . . . 1 THR CB . 50383 2
13 . 2 . 2 2 2 THR CG2 C 13 21.029 0.000 . 1 . . . . . 1 THR CG2 . 50383 2
14 . 2 . 2 3 3 VAL H H 1 7.894 0.008 . 1 . . . . . 2 VAL H . 50383 2
15 . 2 . 2 3 3 VAL HA H 1 4.154 0.003 . 1 . . . . . 2 VAL HA . 50383 2
16 . 2 . 2 3 3 VAL HB H 1 2.057 0.005 . 1 . . . . . 2 VAL HB . 50383 2
17 . 2 . 2 3 3 VAL HG11 H 1 0.939 0.008 . 2 . . . . . 2 VAL QG1 . 50383 2
18 . 2 . 2 3 3 VAL HG12 H 1 0.939 0.008 . 2 . . . . . 2 VAL QG1 . 50383 2
19 . 2 . 2 3 3 VAL HG13 H 1 0.939 0.008 . 2 . . . . . 2 VAL QG1 . 50383 2
20 . 2 . 2 3 3 VAL HG21 H 1 0.888 0.003 . 2 . . . . . 2 VAL QG2 . 50383 2
21 . 2 . 2 3 3 VAL HG22 H 1 0.888 0.003 . 2 . . . . . 2 VAL QG2 . 50383 2
22 . 2 . 2 3 3 VAL HG23 H 1 0.888 0.003 . 2 . . . . . 2 VAL QG2 . 50383 2
23 . 2 . 2 3 3 VAL CA C 13 61.855 0.000 . 1 . . . . . 2 VAL CA . 50383 2
24 . 2 . 2 3 3 VAL CB C 13 33.280 0.000 . 1 . . . . . 2 VAL CB . 50383 2
25 . 2 . 2 3 3 VAL CG1 C 13 20.050 0.000 . 1 . . . . . 2 VAL CG1 . 50383 2
26 . 2 . 2 3 3 VAL CG2 C 13 20.543 0.000 . 1 . . . . . 2 VAL CG2 . 50383 2
27 . 2 . 2 4 4 ASN H H 1 7.853 0.008 . 1 . . . . . 3 ASN H . 50383 2
28 . 2 . 2 4 4 ASN HA H 1 4.926 0.005 . 1 . . . . . 3 ASN HA . 50383 2
29 . 2 . 2 4 4 ASN HB2 H 1 2.890 0.006 . 2 . . . . . 3 ASN HB2 . 50383 2
30 . 2 . 2 4 4 ASN HB3 H 1 2.890 0.006 . 2 . . . . . 3 ASN HB3 . 50383 2
31 . 2 . 2 4 4 ASN HD21 H 1 6.408 0.001 . 2 . . . . . 3 ASN HD21 . 50383 2
32 . 2 . 2 4 4 ASN HD22 H 1 7.644 0.001 . 2 . . . . . 3 ASN HD22 . 50383 2
33 . 2 . 2 4 4 ASN CA C 13 51.595 0.000 . 1 . . . . . 3 ASN CA . 50383 2
34 . 2 . 2 4 4 ASN CB C 13 38.970 0.000 . 1 . . . . . 3 ASN CB . 50383 2
35 . 2 . 2 5 5 PRO HA H 1 4.359 0.009 . 1 . . . . . 4 PRO HA . 50383 2
36 . 2 . 2 5 5 PRO HB2 H 1 2.015 0.006 . 2 . . . . . 4 PRO HB2 . 50383 2
37 . 2 . 2 5 5 PRO HB3 H 1 2.429 0.003 . 2 . . . . . 4 PRO HB3 . 50383 2
38 . 2 . 2 5 5 PRO HG2 H 1 2.083 0.006 . 2 . . . . . 4 PRO HG2 . 50383 2
39 . 2 . 2 5 5 PRO HG3 H 1 2.083 0.006 . 2 . . . . . 4 PRO HG3 . 50383 2
40 . 2 . 2 5 5 PRO HD2 H 1 3.818 0.007 . 2 . . . . . 4 PRO HD2 . 50383 2
41 . 2 . 2 5 5 PRO HD3 H 1 3.971 0.008 . 2 . . . . . 4 PRO HD3 . 50383 2
42 . 2 . 2 5 5 PRO CA C 13 65.252 0.000 . 1 . . . . . 4 PRO CA . 50383 2
43 . 2 . 2 5 5 PRO CB C 13 32.154 0.010 . 1 . . . . . 4 PRO CB . 50383 2
44 . 2 . 2 5 5 PRO CG C 13 27.175 0.000 . 1 . . . . . 4 PRO CG . 50383 2
45 . 2 . 2 5 5 PRO CD C 13 50.912 0.003 . 1 . . . . . 4 PRO CD . 50383 2
46 . 2 . 2 6 6 ILE H H 1 7.907 0.006 . 1 . . . . . 5 ILE H . 50383 2
47 . 2 . 2 6 6 ILE HA H 1 3.911 0.003 . 1 . . . . . 5 ILE HA . 50383 2
48 . 2 . 2 6 6 ILE HB H 1 2.001 0.006 . 1 . . . . . 5 ILE HB . 50383 2
49 . 2 . 2 6 6 ILE HG12 H 1 1.279 0.005 . 2 . . . . . 5 ILE HG12 . 50383 2
50 . 2 . 2 6 6 ILE HG13 H 1 1.601 0.004 . 2 . . . . . 5 ILE HG13 . 50383 2
51 . 2 . 2 6 6 ILE HG21 H 1 0.918 0.004 . 1 . . . . . 5 ILE QG2 . 50383 2
52 . 2 . 2 6 6 ILE HG22 H 1 0.918 0.004 . 1 . . . . . 5 ILE QG2 . 50383 2
53 . 2 . 2 6 6 ILE HG23 H 1 0.918 0.004 . 1 . . . . . 5 ILE QG2 . 50383 2
54 . 2 . 2 6 6 ILE HD11 H 1 0.914 0.001 . 1 . . . . . 5 ILE QD1 . 50383 2
55 . 2 . 2 6 6 ILE HD12 H 1 0.914 0.001 . 1 . . . . . 5 ILE QD1 . 50383 2
56 . 2 . 2 6 6 ILE HD13 H 1 0.914 0.001 . 1 . . . . . 5 ILE QD1 . 50383 2
57 . 2 . 2 6 6 ILE CA C 13 64.080 0.000 . 1 . . . . . 5 ILE CA . 50383 2
58 . 2 . 2 6 6 ILE CB C 13 37.535 0.000 . 1 . . . . . 5 ILE CB . 50383 2
59 . 2 . 2 6 6 ILE CG1 C 13 28.573 0.008 . 1 . . . . . 5 ILE CG1 . 50383 2
60 . 2 . 2 6 6 ILE CG2 C 13 16.786 0.000 . 1 . . . . . 5 ILE CG2 . 50383 2
61 . 2 . 2 6 6 ILE CD1 C 13 11.761 0.000 . 1 . . . . . 5 ILE CD1 . 50383 2
62 . 2 . 2 7 7 ILE H H 1 7.499 0.002 . 1 . . . . . 6 ILE H . 50383 2
63 . 2 . 2 7 7 ILE HA H 1 3.772 0.003 . 1 . . . . . 6 ILE HA . 50383 2
64 . 2 . 2 7 7 ILE HB H 1 1.925 0.005 . 1 . . . . . 6 ILE HB . 50383 2
65 . 2 . 2 7 7 ILE HG12 H 1 1.306 0.004 . 2 . . . . . 6 ILE HG12 . 50383 2
66 . 2 . 2 7 7 ILE HG13 H 1 1.554 0.004 . 2 . . . . . 6 ILE HG13 . 50383 2
67 . 2 . 2 7 7 ILE HG21 H 1 0.910 0.007 . 1 . . . . . 6 ILE QG2 . 50383 2
68 . 2 . 2 7 7 ILE HG22 H 1 0.910 0.007 . 1 . . . . . 6 ILE QG2 . 50383 2
69 . 2 . 2 7 7 ILE HG23 H 1 0.910 0.007 . 1 . . . . . 6 ILE QG2 . 50383 2
70 . 2 . 2 7 7 ILE HD11 H 1 0.881 0.003 . 1 . . . . . 6 ILE QD1 . 50383 2
71 . 2 . 2 7 7 ILE HD12 H 1 0.881 0.003 . 1 . . . . . 6 ILE QD1 . 50383 2
72 . 2 . 2 7 7 ILE HD13 H 1 0.881 0.003 . 1 . . . . . 6 ILE QD1 . 50383 2
73 . 2 . 2 7 7 ILE CA C 13 63.950 0.000 . 1 . . . . . 6 ILE CA . 50383 2
74 . 2 . 2 7 7 ILE CB C 13 37.285 0.000 . 1 . . . . . 6 ILE CB . 50383 2
75 . 2 . 2 7 7 ILE CG1 C 13 28.195 0.011 . 1 . . . . . 6 ILE CG1 . 50383 2
76 . 2 . 2 7 7 ILE CG2 C 13 16.802 0.000 . 1 . . . . . 6 ILE CG2 . 50383 2
77 . 2 . 2 7 7 ILE CD1 C 13 11.119 0.000 . 1 . . . . . 6 ILE CD1 . 50383 2
78 . 2 . 2 8 8 TYR H H 1 7.895 0.005 . 1 . . . . . 7 TYR H . 50383 2
79 . 2 . 2 8 8 TYR HA H 1 4.092 0.003 . 1 . . . . . 7 TYR HA . 50383 2
80 . 2 . 2 8 8 TYR HB2 H 1 3.045 0.007 . 2 . . . . . 7 TYR HB2 . 50383 2
81 . 2 . 2 8 8 TYR HB3 H 1 3.095 0.004 . 2 . . . . . 7 TYR HB3 . 50383 2
82 . 2 . 2 8 8 TYR HD1 H 1 7.075 0.003 . 1 . . . . . 7 TYR HD1 . 50383 2
83 . 2 . 2 8 8 TYR HD2 H 1 7.075 0.003 . 1 . . . . . 7 TYR HD2 . 50383 2
84 . 2 . 2 8 8 TYR HE1 H 1 6.809 0.004 . 1 . . . . . 7 TYR HE1 . 50383 2
85 . 2 . 2 8 8 TYR HE2 H 1 6.809 0.004 . 1 . . . . . 7 TYR HE2 . 50383 2
86 . 2 . 2 8 8 TYR CA C 13 61.579 0.000 . 1 . . . . . 7 TYR CA . 50383 2
87 . 2 . 2 8 8 TYR CB C 13 38.221 0.015 . 1 . . . . . 7 TYR CB . 50383 2
88 . 2 . 2 8 8 TYR CD1 C 13 132.582 0.019 . 1 . . . . . 7 TYR CD1 . 50383 2
89 . 2 . 2 8 8 TYR CD2 C 13 132.582 0.019 . 1 . . . . . 7 TYR CD2 . 50383 2
90 . 2 . 2 8 8 TYR CE1 C 13 118.064 0.000 . 1 . . . . . 7 TYR CE1 . 50383 2
91 . 2 . 2 8 8 TYR CE2 C 13 118.064 0.000 . 1 . . . . . 7 TYR CE2 . 50383 2
92 . 2 . 2 9 9 ALA H H 1 8.099 0.008 . 1 . . . . . 8 ALA H . 50383 2
93 . 2 . 2 9 9 ALA HA H 1 4.042 0.003 . 1 . . . . . 8 ALA HA . 50383 2
94 . 2 . 2 9 9 ALA HB1 H 1 1.617 0.003 . 1 . . . . . 8 ALA HB . 50383 2
95 . 2 . 2 9 9 ALA HB2 H 1 1.617 0.003 . 1 . . . . . 8 ALA HB . 50383 2
96 . 2 . 2 9 9 ALA HB3 H 1 1.617 0.003 . 1 . . . . . 8 ALA HB . 50383 2
97 . 2 . 2 9 9 ALA CA C 13 55.355 0.000 . 1 . . . . . 8 ALA CA . 50383 2
98 . 2 . 2 9 9 ALA CB C 13 17.718 0.000 . 1 . . . . . 8 ALA CB . 50383 2
99 . 2 . 2 10 10 LEU H H 1 8.352 0.003 . 1 . . . . . 9 LEU H . 50383 2
100 . 2 . 2 10 10 LEU HA H 1 4.118 0.003 . 1 . . . . . 9 LEU HA . 50383 2
101 . 2 . 2 10 10 LEU HB2 H 1 1.544 0.004 . 2 . . . . . 9 LEU HB2 . 50383 2
102 . 2 . 2 10 10 LEU HB3 H 1 1.941 0.003 . 2 . . . . . 9 LEU HB3 . 50383 2
103 . 2 . 2 10 10 LEU HG H 1 1.929 0.002 . 1 . . . . . 9 LEU HG . 50383 2
104 . 2 . 2 10 10 LEU HD11 H 1 0.873 0.004 . 2 . . . . . 9 LEU QD1 . 50383 2
105 . 2 . 2 10 10 LEU HD12 H 1 0.873 0.004 . 2 . . . . . 9 LEU QD1 . 50383 2
106 . 2 . 2 10 10 LEU HD13 H 1 0.873 0.004 . 2 . . . . . 9 LEU QD1 . 50383 2
107 . 2 . 2 10 10 LEU HD21 H 1 0.868 0.002 . 2 . . . . . 9 LEU QD2 . 50383 2
108 . 2 . 2 10 10 LEU HD22 H 1 0.868 0.002 . 2 . . . . . 9 LEU QD2 . 50383 2
109 . 2 . 2 10 10 LEU HD23 H 1 0.868 0.002 . 2 . . . . . 9 LEU QD2 . 50383 2
110 . 2 . 2 10 10 LEU CA C 13 57.781 0.000 . 1 . . . . . 9 LEU CA . 50383 2
111 . 2 . 2 10 10 LEU CB C 13 42.077 0.011 . 1 . . . . . 9 LEU CB . 50383 2
112 . 2 . 2 10 10 LEU CG C 13 26.647 0.000 . 1 . . . . . 9 LEU CG . 50383 2
113 . 2 . 2 10 10 LEU CD1 C 13 24.776 0.000 . 1 . . . . . 9 LEU CD1 . 50383 2
114 . 2 . 2 10 10 LEU CD2 C 13 22.173 0.000 . 1 . . . . . 9 LEU CD2 . 50383 2
115 . 2 . 2 11 11 ARG H H 1 8.365 0.003 . 1 . . . . . 10 ARG H . 50383 2
116 . 2 . 2 11 11 ARG HA H 1 4.213 0.002 . 1 . . . . . 10 ARG HA . 50383 2
117 . 2 . 2 11 11 ARG HB2 H 1 1.833 0.004 . 2 . . . . . 10 ARG HB2 . 50383 2
118 . 2 . 2 11 11 ARG HB3 H 1 1.908 0.006 . 2 . . . . . 10 ARG HB3 . 50383 2
119 . 2 . 2 11 11 ARG HG2 H 1 1.704 0.008 . 2 . . . . . 10 ARG HG2 . 50383 2
120 . 2 . 2 11 11 ARG HG3 H 1 1.825 0.000 . 2 . . . . . 10 ARG HG3 . 50383 2
121 . 2 . 2 11 11 ARG HD2 H 1 3.094 0.003 . 2 . . . . . 10 ARG HD2 . 50383 2
122 . 2 . 2 11 11 ARG HD3 H 1 3.153 0.002 . 2 . . . . . 10 ARG HD3 . 50383 2
123 . 2 . 2 11 11 ARG CA C 13 58.012 0.000 . 1 . . . . . 10 ARG CA . 50383 2
124 . 2 . 2 11 11 ARG CB C 13 29.950 0.000 . 1 . . . . . 10 ARG CB . 50383 2
125 . 2 . 2 11 11 ARG CG C 13 27.156 0.013 . 1 . . . . . 10 ARG CG . 50383 2
126 . 2 . 2 11 11 ARG CD C 13 43.141 0.022 . 1 . . . . . 10 ARG CD . 50383 2
127 . 2 . 2 12 12 SER H H 1 7.944 0.002 . 1 . . . . . 11 SER H . 50383 2
128 . 2 . 2 12 12 SER HA H 1 4.221 0.008 . 1 . . . . . 11 SER HA . 50383 2
129 . 2 . 2 12 12 SER HB2 H 1 3.769 0.003 . 2 . . . . . 11 SER HB2 . 50383 2
130 . 2 . 2 12 12 SER HB3 H 1 3.929 0.004 . 2 . . . . . 11 SER HB3 . 50383 2
131 . 2 . 2 12 12 SER CA C 13 60.523 0.000 . 1 . . . . . 11 SER CA . 50383 2
132 . 2 . 2 12 12 SER CB C 13 63.361 0.007 . 1 . . . . . 11 SER CB . 50383 2
133 . 2 . 2 13 13 LYS H H 1 7.740 0.004 . 1 . . . . . 12 LYS H . 50383 2
134 . 2 . 2 13 13 LYS HA H 1 4.210 0.004 . 1 . . . . . 12 LYS HA . 50383 2
135 . 2 . 2 13 13 LYS HB2 H 1 1.959 0.003 . 2 . . . . . 12 LYS HB2 . 50383 2
136 . 2 . 2 13 13 LYS HB3 H 1 1.959 0.003 . 2 . . . . . 12 LYS HB3 . 50383 2
137 . 2 . 2 13 13 LYS HG2 H 1 1.505 0.005 . 2 . . . . . 12 LYS HG2 . 50383 2
138 . 2 . 2 13 13 LYS HG3 H 1 1.542 0.009 . 2 . . . . . 12 LYS HG3 . 50383 2
139 . 2 . 2 13 13 LYS HD2 H 1 1.715 0.004 . 2 . . . . . 12 LYS HD2 . 50383 2
140 . 2 . 2 13 13 LYS HD3 H 1 1.715 0.004 . 2 . . . . . 12 LYS HD3 . 50383 2
141 . 2 . 2 13 13 LYS HE2 H 1 3.015 0.005 . 2 . . . . . 12 LYS HE2 . 50383 2
142 . 2 . 2 13 13 LYS HE3 H 1 3.015 0.005 . 2 . . . . . 12 LYS HE3 . 50383 2
143 . 2 . 2 13 13 LYS CA C 13 57.882 0.000 . 1 . . . . . 12 LYS CA . 50383 2
144 . 2 . 2 13 13 LYS CB C 13 32.227 0.000 . 1 . . . . . 12 LYS CB . 50383 2
145 . 2 . 2 13 13 LYS CG C 13 24.540 0.010 . 1 . . . . . 12 LYS CG . 50383 2
146 . 2 . 2 13 13 LYS CD C 13 29.015 0.000 . 1 . . . . . 12 LYS CD . 50383 2
147 . 2 . 2 13 13 LYS CE C 13 42.106 0.000 . 1 . . . . . 12 LYS CE . 50383 2
148 . 2 . 2 14 14 ASP H H 1 7.992 0.004 . 1 . . . . . 13 ASP H . 50383 2
149 . 2 . 2 14 14 ASP HA H 1 4.667 0.000 . 1 . . . . . 13 ASP HA . 50383 2
150 . 2 . 2 14 14 ASP HB2 H 1 2.716 0.005 . 2 . . . . . 13 ASP HB2 . 50383 2
151 . 2 . 2 14 14 ASP HB3 H 1 2.862 0.004 . 2 . . . . . 13 ASP HB3 . 50383 2
152 . 2 . 2 14 14 ASP CB C 13 41.025 0.021 . 1 . . . . . 13 ASP CB . 50383 2
153 . 2 . 2 15 15 LEU H H 1 8.076 0.004 . 1 . . . . . 14 LEU H . 50383 2
154 . 2 . 2 15 15 LEU HA H 1 4.242 0.004 . 1 . . . . . 14 LEU HA . 50383 2
155 . 2 . 2 15 15 LEU HB2 H 1 1.665 0.003 . 2 . . . . . 14 LEU HB2 . 50383 2
156 . 2 . 2 15 15 LEU HB3 H 1 1.742 0.008 . 2 . . . . . 14 LEU HB3 . 50383 2
157 . 2 . 2 15 15 LEU HG H 1 1.739 0.001 . 1 . . . . . 14 LEU HG . 50383 2
158 . 2 . 2 15 15 LEU HD11 H 1 0.951 0.004 . 2 . . . . . 14 LEU QD1 . 50383 2
159 . 2 . 2 15 15 LEU HD12 H 1 0.951 0.004 . 2 . . . . . 14 LEU QD1 . 50383 2
160 . 2 . 2 15 15 LEU HD13 H 1 0.951 0.004 . 2 . . . . . 14 LEU QD1 . 50383 2
161 . 2 . 2 15 15 LEU HD21 H 1 0.896 0.005 . 2 . . . . . 14 LEU QD2 . 50383 2
162 . 2 . 2 15 15 LEU HD22 H 1 0.896 0.005 . 2 . . . . . 14 LEU QD2 . 50383 2
163 . 2 . 2 15 15 LEU HD23 H 1 0.896 0.005 . 2 . . . . . 14 LEU QD2 . 50383 2
164 . 2 . 2 15 15 LEU CA C 13 56.529 0.000 . 1 . . . . . 14 LEU CA . 50383 2
165 . 2 . 2 15 15 LEU CB C 13 41.939 0.000 . 1 . . . . . 14 LEU CB . 50383 2
166 . 2 . 2 15 15 LEU CG C 13 27.021 0.000 . 1 . . . . . 14 LEU CG . 50383 2
167 . 2 . 2 15 15 LEU CD1 C 13 24.563 0.000 . 1 . . . . . 14 LEU CD1 . 50383 2
168 . 2 . 2 15 15 LEU CD2 C 13 22.907 0.000 . 1 . . . . . 14 LEU CD2 . 50383 2
169 . 2 . 2 16 16 ARG H H 1 8.087 0.001 . 1 . . . . . 15 ARG H . 50383 2
170 . 2 . 2 16 16 ARG HA H 1 4.089 0.006 . 1 . . . . . 15 ARG HA . 50383 2
171 . 2 . 2 16 16 ARG HB2 H 1 1.820 0.005 . 2 . . . . . 15 ARG HB2 . 50383 2
172 . 2 . 2 16 16 ARG HB3 H 1 1.850 0.006 . 2 . . . . . 15 ARG HB3 . 50383 2
173 . 2 . 2 16 16 ARG HG2 H 1 1.638 0.004 . 2 . . . . . 15 ARG HG2 . 50383 2
174 . 2 . 2 16 16 ARG HG3 H 1 1.696 0.010 . 2 . . . . . 15 ARG HG3 . 50383 2
175 . 2 . 2 16 16 ARG HD2 H 1 3.164 0.003 . 2 . . . . . 15 ARG HD2 . 50383 2
176 . 2 . 2 16 16 ARG HD3 H 1 3.230 0.006 . 2 . . . . . 15 ARG HD3 . 50383 2
177 . 2 . 2 16 16 ARG CA C 13 58.309 0.000 . 1 . . . . . 15 ARG CA . 50383 2
178 . 2 . 2 16 16 ARG CB C 13 29.950 0.010 . 1 . . . . . 15 ARG CB . 50383 2
179 . 2 . 2 16 16 ARG CG C 13 27.055 0.000 . 1 . . . . . 15 ARG CG . 50383 2
180 . 2 . 2 16 16 ARG CD C 13 43.339 0.000 . 1 . . . . . 15 ARG CD . 50383 2
181 . 2 . 2 17 17 HIS H H 1 7.906 0.001 . 1 . . . . . 16 HIS H . 50383 2
182 . 2 . 2 17 17 HIS HA H 1 4.541 0.002 . 1 . . . . . 16 HIS HA . 50383 2
183 . 2 . 2 17 17 HIS HB2 H 1 3.254 0.003 . 2 . . . . . 16 HIS HB2 . 50383 2
184 . 2 . 2 17 17 HIS HB3 H 1 3.155 0.003 . 2 . . . . . 16 HIS HB3 . 50383 2
185 . 2 . 2 17 17 HIS HD2 H 1 7.127 0.002 . 1 . . . . . 16 HIS HD2 . 50383 2
186 . 2 . 2 17 17 HIS HE1 H 1 7.956 0.006 . 1 . . . . . 16 HIS HE1 . 50383 2
187 . 2 . 2 17 17 HIS CA C 13 57.262 0.000 . 1 . . . . . 16 HIS CA . 50383 2
188 . 2 . 2 17 17 HIS CB C 13 29.989 0.004 . 1 . . . . . 16 HIS CB . 50383 2
189 . 2 . 2 17 17 HIS CD2 C 13 120.228 0.000 . 1 . . . . . 16 HIS CD2 . 50383 2
190 . 2 . 2 17 17 HIS CE1 C 13 137.668 0.000 . 1 . . . . . 16 HIS CE1 . 50383 2
191 . 2 . 2 18 18 ALA H H 1 7.889 0.003 . 1 . . . . . 17 ALA H . 50383 2
192 . 2 . 2 18 18 ALA HA H 1 4.206 0.003 . 1 . . . . . 17 ALA HA . 50383 2
193 . 2 . 2 18 18 ALA HB1 H 1 1.333 0.002 . 1 . . . . . 17 ALA HB . 50383 2
194 . 2 . 2 18 18 ALA HB2 H 1 1.333 0.002 . 1 . . . . . 17 ALA HB . 50383 2
195 . 2 . 2 18 18 ALA HB3 H 1 1.333 0.002 . 1 . . . . . 17 ALA HB . 50383 2
196 . 2 . 2 18 18 ALA CA C 13 53.447 0.000 . 1 . . . . . 17 ALA CA . 50383 2
197 . 2 . 2 18 18 ALA CB C 13 18.532 0.000 . 1 . . . . . 17 ALA CB . 50383 2
198 . 2 . 2 19 19 PHE H H 1 7.954 0.002 . 1 . . . . . 18 PHE H . 50383 2
199 . 2 . 2 19 19 PHE HA H 1 4.603 0.006 . 1 . . . . . 18 PHE HA . 50383 2
200 . 2 . 2 19 19 PHE HB2 H 1 3.102 0.005 . 2 . . . . . 18 PHE HB2 . 50383 2
201 . 2 . 2 19 19 PHE HB3 H 1 3.241 0.001 . 2 . . . . . 18 PHE HB3 . 50383 2
202 . 2 . 2 19 19 PHE HD1 H 1 7.298 0.001 . 1 . . . . . 18 PHE HD1 . 50383 2
203 . 2 . 2 19 19 PHE HD2 H 1 7.298 0.001 . 1 . . . . . 18 PHE HD2 . 50383 2
204 . 2 . 2 19 19 PHE HE1 H 1 7.337 0.003 . 1 . . . . . 18 PHE HE1 . 50383 2
205 . 2 . 2 19 19 PHE HE2 H 1 7.337 0.003 . 1 . . . . . 18 PHE HE2 . 50383 2
206 . 2 . 2 19 19 PHE HZ H 1 7.275 0.000 . 1 . . . . . 18 PHE HZ . 50383 2
207 . 2 . 2 19 19 PHE CA C 13 58.050 0.000 . 1 . . . . . 18 PHE CA . 50383 2
208 . 2 . 2 19 19 PHE CB C 13 39.076 0.018 . 1 . . . . . 18 PHE CB . 50383 2
209 . 2 . 2 19 19 PHE CD1 C 13 131.661 0.000 . 1 . . . . . 18 PHE CD1 . 50383 2
210 . 2 . 2 19 19 PHE CD2 C 13 131.661 0.000 . 1 . . . . . 18 PHE CD2 . 50383 2
211 . 2 . 2 19 19 PHE CE1 C 13 131.285 0.000 . 1 . . . . . 18 PHE CE1 . 50383 2
212 . 2 . 2 19 19 PHE CE2 C 13 131.285 0.000 . 1 . . . . . 18 PHE CE2 . 50383 2
213 . 2 . 2 19 19 PHE CZ C 13 129.659 0.007 . 1 . . . . . 18 PHE CZ . 50383 2
214 . 2 . 2 20 20 ARG H H 1 7.845 0.007 . 1 . . . . . 19 ARG H . 50383 2
215 . 2 . 2 20 20 ARG HA H 1 4.293 0.003 . 1 . . . . . 19 ARG HA . 50383 2
216 . 2 . 2 20 20 ARG HB2 H 1 1.785 0.004 . 2 . . . . . 19 ARG HB2 . 50383 2
217 . 2 . 2 20 20 ARG HB3 H 1 1.914 0.005 . 2 . . . . . 19 ARG HB3 . 50383 2
218 . 2 . 2 20 20 ARG HG2 H 1 1.663 0.005 . 2 . . . . . 19 ARG HG2 . 50383 2
219 . 2 . 2 20 20 ARG HG3 H 1 1.663 0.005 . 2 . . . . . 19 ARG HG3 . 50383 2
220 . 2 . 2 20 20 ARG HD2 H 1 3.210 0.004 . 2 . . . . . 19 ARG HD2 . 50383 2
221 . 2 . 2 20 20 ARG HD3 H 1 3.210 0.004 . 2 . . . . . 19 ARG HD3 . 50383 2
222 . 2 . 2 20 20 ARG CA C 13 55.985 0.000 . 1 . . . . . 19 ARG CA . 50383 2
223 . 2 . 2 20 20 ARG CB C 13 30.749 0.009 . 1 . . . . . 19 ARG CB . 50383 2
224 . 2 . 2 20 20 ARG CG C 13 27.063 0.000 . 1 . . . . . 19 ARG CG . 50383 2
225 . 2 . 2 20 20 ARG CD C 13 43.291 0.000 . 1 . . . . . 19 ARG CD . 50383 2
226 . 2 . 2 21 21 NH2 HN1 H 1 6.907 0.002 . 2 . . . . . 20 NH2 HN1 . 50383 2
227 . 2 . 2 21 21 NH2 HN2 H 1 7.022 0.000 . 2 . . . . . 20 NH2 HN2 . 50383 2
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