Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 25270
_Assigned_chem_shift_list.ID 1
_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 $chemical_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 'Origin nmrView file /home/ccpn/svn_web/ccpnmrweb/webapps/uploads/V8hX8bO4pQ9zL4eE5sZ8pX2pA9sT7eL9aH1sZ6cV7gK7tO5zE1rC7aH1rK3g/ppm.out'
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 25270 1
2 '2D 1H-13C HSQC' . . . 25270 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
2 $NMRView . . 25270 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_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.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 MET HA H 1 4.147 . . 1 . 2 . A 1 MET HA . 25270 1
2 . 1 1 1 1 MET HB3 H 1 2.154 . . 1 . 4 . A 1 MET HB3 . 25270 1
3 . 1 1 1 1 MET HG3 H 1 2.594 . . 1 . 6 . A 1 MET HG3 . 25270 1
4 . 1 1 1 1 MET HE1 H 1 2.120 . . 1 . 8 . A 1 MET HE1 . 25270 1
5 . 1 1 1 1 MET HE2 H 1 2.120 . . 1 . 8 . A 1 MET HE2 . 25270 1
6 . 1 1 1 1 MET HE3 H 1 2.120 . . 1 . 8 . A 1 MET HE3 . 25270 1
7 . 1 1 1 1 MET CA C 13 55.200 . . 1 . 1 . A 1 MET CA . 25270 1
8 . 1 1 1 1 MET CB C 13 33.900 . . 1 . 3 . A 1 MET CB . 25270 1
9 . 1 1 1 1 MET CG C 13 31.400 . . 1 . 5 . A 1 MET CG . 25270 1
10 . 1 1 1 1 MET CE C 13 17.200 . . 1 . 7 . A 1 MET CE . 25270 1
11 . 1 1 2 2 LYS HA H 1 4.426 . . 1 . 10 . A 2 LYS HA . 25270 1
12 . 1 1 2 2 LYS HB3 H 1 1.700 . . 1 . 12 . A 2 LYS HB3 . 25270 1
13 . 1 1 2 2 LYS HG2 H 1 1.501 . . 1 . 15 . A 2 LYS HG2 . 25270 1
14 . 1 1 2 2 LYS HG3 H 1 1.427 . . 1 . 14 . A 2 LYS HG3 . 25270 1
15 . 1 1 2 2 LYS HD3 H 1 1.738 . . 1 . 17 . A 2 LYS HD3 . 25270 1
16 . 1 1 2 2 LYS HE3 H 1 3.052 . . 1 . 19 . A 2 LYS HE3 . 25270 1
17 . 1 1 2 2 LYS CA C 13 56.100 . . 1 . 9 . A 2 LYS CA . 25270 1
18 . 1 1 2 2 LYS CB C 13 33.300 . . 1 . 11 . A 2 LYS CB . 25270 1
19 . 1 1 2 2 LYS CG C 13 25.000 . . 1 . 13 . A 2 LYS CG . 25270 1
20 . 1 1 2 2 LYS CD C 13 28.900 . . 1 . 16 . A 2 LYS CD . 25270 1
21 . 1 1 2 2 LYS CE C 13 42.000 . . 1 . 18 . A 2 LYS CE . 25270 1
22 . 1 1 3 3 PHE H H 1 8.514 . . 1 . 21 . A 3 PHE H . 25270 1
23 . 1 1 3 3 PHE HA H 1 4.541 . . 1 . 23 . A 3 PHE HA . 25270 1
24 . 1 1 3 3 PHE HB3 H 1 3.160 . . 1 . 25 . A 3 PHE HB3 . 25270 1
25 . 1 1 3 3 PHE HD1 H 1 7.242 . . 1 . 27 . A 3 PHE HD1 . 25270 1
26 . 1 1 3 3 PHE HD2 H 1 7.242 . . 1 . 27 . A 3 PHE HD2 . 25270 1
27 . 1 1 3 3 PHE CA C 13 59.200 . . 1 . 22 . A 3 PHE CA . 25270 1
28 . 1 1 3 3 PHE CB C 13 39.500 . . 1 . 24 . A 3 PHE CB . 25270 1
29 . 1 1 3 3 PHE CD1 C 13 132.100 . . 1 . 26 . A 3 PHE CD1 . 25270 1
30 . 1 1 3 3 PHE CD2 C 13 132.100 . . 1 . 26 . A 3 PHE CD2 . 25270 1
31 . 1 1 3 3 PHE N N 15 120.310 . . 1 . 20 . A 3 PHE N . 25270 1
32 . 1 1 4 4 TYR H H 1 7.919 . . 1 . 29 . A 4 TYR H . 25270 1
33 . 1 1 4 4 TYR HA H 1 4.463 . . 1 . 31 . A 4 TYR HA . 25270 1
34 . 1 1 4 4 TYR HB3 H 1 3.064 . . 1 . 33 . A 4 TYR HB3 . 25270 1
35 . 1 1 4 4 TYR HD1 H 1 7.103 . . 1 . 35 . A 4 TYR HD1 . 25270 1
36 . 1 1 4 4 TYR HD2 H 1 7.103 . . 1 . 35 . A 4 TYR HD2 . 25270 1
37 . 1 1 4 4 TYR HE1 H 1 6.906 . . 1 . 37 . A 4 TYR HE1 . 25270 1
38 . 1 1 4 4 TYR HE2 H 1 6.906 . . 1 . 37 . A 4 TYR HE2 . 25270 1
39 . 1 1 4 4 TYR CA C 13 59.000 . . 1 . 30 . A 4 TYR CA . 25270 1
40 . 1 1 4 4 TYR CB C 13 38.000 . . 1 . 32 . A 4 TYR CB . 25270 1
41 . 1 1 4 4 TYR CD1 C 13 133.000 . . 1 . 34 . A 4 TYR CD1 . 25270 1
42 . 1 1 4 4 TYR CD2 C 13 133.000 . . 1 . 34 . A 4 TYR CD2 . 25270 1
43 . 1 1 4 4 TYR CE1 C 13 118.400 . . 1 . 36 . A 4 TYR CE1 . 25270 1
44 . 1 1 4 4 TYR CE2 C 13 118.400 . . 1 . 36 . A 4 TYR CE2 . 25270 1
45 . 1 1 4 4 TYR N N 15 118.370 . . 1 . 28 . A 4 TYR N . 25270 1
46 . 1 1 5 5 THR H H 1 7.791 . . 1 . 39 . A 5 THR H . 25270 1
47 . 1 1 5 5 THR HA H 1 4.097 . . 1 . 41 . A 5 THR HA . 25270 1
48 . 1 1 5 5 THR HB H 1 4.326 . . 1 . 43 . A 5 THR HB . 25270 1
49 . 1 1 5 5 THR HG21 H 1 1.284 . . 1 . 45 . A 5 THR HG21 . 25270 1
50 . 1 1 5 5 THR HG22 H 1 1.284 . . 1 . 45 . A 5 THR HG22 . 25270 1
51 . 1 1 5 5 THR HG23 H 1 1.284 . . 1 . 45 . A 5 THR HG23 . 25270 1
52 . 1 1 5 5 THR CA C 13 64.420 . . 1 . 40 . A 5 THR CA . 25270 1
53 . 1 1 5 5 THR CB C 13 69.000 . . 1 . 42 . A 5 THR CB . 25270 1
54 . 1 1 5 5 THR CG2 C 13 22.600 . . 1 . 44 . A 5 THR CG2 . 25270 1
55 . 1 1 5 5 THR N N 15 115.210 . . 1 . 38 . A 5 THR N . 25270 1
56 . 1 1 6 6 ILE H H 1 8.075 . . 1 . 47 . A 6 ILE H . 25270 1
57 . 1 1 6 6 ILE HA H 1 3.941 . . 1 . 49 . A 6 ILE HA . 25270 1
58 . 1 1 6 6 ILE HB H 1 2.044 . . 1 . 51 . A 6 ILE HB . 25270 1
59 . 1 1 6 6 ILE HG12 H 1 1.310 . . 1 . 54 . A 6 ILE HG12 . 25270 1
60 . 1 1 6 6 ILE HG13 H 1 1.688 . . 1 . 53 . A 6 ILE HG13 . 25270 1
61 . 1 1 6 6 ILE HG21 H 1 1.106 . . 1 . 58 . A 6 ILE HG21 . 25270 1
62 . 1 1 6 6 ILE HG22 H 1 1.106 . . 1 . 58 . A 6 ILE HG22 . 25270 1
63 . 1 1 6 6 ILE HG23 H 1 1.106 . . 1 . 58 . A 6 ILE HG23 . 25270 1
64 . 1 1 6 6 ILE HD11 H 1 0.960 . . 1 . 56 . A 6 ILE HD11 . 25270 1
65 . 1 1 6 6 ILE HD12 H 1 0.960 . . 1 . 56 . A 6 ILE HD12 . 25270 1
66 . 1 1 6 6 ILE HD13 H 1 0.960 . . 1 . 56 . A 6 ILE HD13 . 25270 1
67 . 1 1 6 6 ILE CA C 13 63.700 . . 1 . 48 . A 6 ILE CA . 25270 1
68 . 1 1 6 6 ILE CB C 13 37.800 . . 1 . 50 . A 6 ILE CB . 25270 1
69 . 1 1 6 6 ILE CG1 C 13 28.800 . . 1 . 52 . A 6 ILE CG1 . 25270 1
70 . 1 1 6 6 ILE CG2 C 13 17.700 . . 1 . 57 . A 6 ILE CG2 . 25270 1
71 . 1 1 6 6 ILE CD1 C 13 13.100 . . 1 . 55 . A 6 ILE CD1 . 25270 1
72 . 1 1 6 6 ILE N N 15 121.450 . . 1 . 46 . A 6 ILE N . 25270 1
73 . 1 1 7 7 LYS H H 1 7.960 . . 1 . 60 . A 7 LYS H . 25270 1
74 . 1 1 7 7 LYS HA H 1 4.137 . . 1 . 62 . A 7 LYS HA . 25270 1
75 . 1 1 7 7 LYS HB2 H 1 1.895 . . 1 . 65 . A 7 LYS HB2 . 25270 1
76 . 1 1 7 7 LYS HB3 H 1 1.960 . . 1 . 64 . A 7 LYS HB3 . 25270 1
77 . 1 1 7 7 LYS HG2 H 1 1.491 . . 1 . 68 . A 7 LYS HG2 . 25270 1
78 . 1 1 7 7 LYS HG3 H 1 1.597 . . 1 . 67 . A 7 LYS HG3 . 25270 1
79 . 1 1 7 7 LYS HD3 H 1 1.761 . . 1 . 70 . A 7 LYS HD3 . 25270 1
80 . 1 1 7 7 LYS HE3 H 1 3.032 . . 1 . 72 . A 7 LYS HE3 . 25270 1
81 . 1 1 7 7 LYS CA C 13 59.000 . . 1 . 61 . A 7 LYS CA . 25270 1
82 . 1 1 7 7 LYS CB C 13 32.500 . . 1 . 63 . A 7 LYS CB . 25270 1
83 . 1 1 7 7 LYS CG C 13 25.500 . . 1 . 66 . A 7 LYS CG . 25270 1
84 . 1 1 7 7 LYS CD C 13 29.300 . . 1 . 69 . A 7 LYS CD . 25270 1
85 . 1 1 7 7 LYS CE C 13 41.900 . . 1 . 71 . A 7 LYS CE . 25270 1
86 . 1 1 7 7 LYS N N 15 120.790 . . 1 . 59 . A 7 LYS N . 25270 1
87 . 1 1 8 8 LEU H H 1 8.230 . . 1 . 74 . A 8 LEU H . 25270 1
88 . 1 1 8 8 LEU HA H 1 4.260 . . 1 . 76 . A 8 LEU HA . 25270 1
89 . 1 1 8 8 LEU HB2 H 1 1.868 . . 1 . 79 . A 8 LEU HB2 . 25270 1
90 . 1 1 8 8 LEU HB3 H 1 1.930 . . 1 . 78 . A 8 LEU HB3 . 25270 1
91 . 1 1 8 8 LEU HG H 1 1.842 . . 1 . 81 . A 8 LEU HG . 25270 1
92 . 1 1 8 8 LEU HD11 H 1 1.026 . . 1 . 83 . A 8 LEU HD11 . 25270 1
93 . 1 1 8 8 LEU HD12 H 1 1.026 . . 1 . 83 . A 8 LEU HD12 . 25270 1
94 . 1 1 8 8 LEU HD13 H 1 1.026 . . 1 . 83 . A 8 LEU HD13 . 25270 1
95 . 1 1 8 8 LEU HD21 H 1 1.082 . . 1 . 85 . A 8 LEU HD21 . 25270 1
96 . 1 1 8 8 LEU HD22 H 1 1.082 . . 1 . 85 . A 8 LEU HD22 . 25270 1
97 . 1 1 8 8 LEU HD23 H 1 1.082 . . 1 . 85 . A 8 LEU HD23 . 25270 1
98 . 1 1 8 8 LEU CA C 13 58.000 . . 1 . 75 . A 8 LEU CA . 25270 1
99 . 1 1 8 8 LEU CB C 13 41.900 . . 1 . 77 . A 8 LEU CB . 25270 1
100 . 1 1 8 8 LEU CG C 13 27.400 . . 1 . 80 . A 8 LEU CG . 25270 1
101 . 1 1 8 8 LEU CD1 C 13 25.200 . . 1 . 82 . A 8 LEU CD1 . 25270 1
102 . 1 1 8 8 LEU CD2 C 13 24.500 . . 1 . 84 . A 8 LEU CD2 . 25270 1
103 . 1 1 8 8 LEU N N 15 120.300 . . 1 . 73 . A 8 LEU N . 25270 1
104 . 1 1 9 9 ALA H H 1 8.453 . . 1 . 87 . A 9 ALA H . 25270 1
105 . 1 1 9 9 ALA HA H 1 4.055 . . 1 . 89 . A 9 ALA HA . 25270 1
106 . 1 1 9 9 ALA HB1 H 1 1.610 . . 1 . 91 . A 9 ALA HB1 . 25270 1
107 . 1 1 9 9 ALA HB2 H 1 1.610 . . 1 . 91 . A 9 ALA HB2 . 25270 1
108 . 1 1 9 9 ALA HB3 H 1 1.610 . . 1 . 91 . A 9 ALA HB3 . 25270 1
109 . 1 1 9 9 ALA CA C 13 55.900 . . 1 . 88 . A 9 ALA CA . 25270 1
110 . 1 1 9 9 ALA CB C 13 18.200 . . 1 . 90 . A 9 ALA CB . 25270 1
111 . 1 1 9 9 ALA N N 15 121.240 . . 1 . 86 . A 9 ALA N . 25270 1
112 . 1 1 10 10 LYS H H 1 8.250 . . 1 . 93 . A 10 LYS H . 25270 1
113 . 1 1 10 10 LYS HA H 1 4.122 . . 1 . 95 . A 10 LYS HA . 25270 1
114 . 1 1 10 10 LYS HB2 H 1 1.761 . . 1 . 98 . A 10 LYS HB2 . 25270 1
115 . 1 1 10 10 LYS HB3 H 1 2.032 . . 1 . 97 . A 10 LYS HB3 . 25270 1
116 . 1 1 10 10 LYS HG2 H 1 1.730 . . 1 . 101 . A 10 LYS HG2 . 25270 1
117 . 1 1 10 10 LYS HG3 H 1 1.517 . . 1 . 100 . A 10 LYS HG3 . 25270 1
118 . 1 1 10 10 LYS HD3 H 1 1.766 . . 1 . 103 . A 10 LYS HD3 . 25270 1
119 . 1 1 10 10 LYS HE3 H 1 3.029 . . 1 . 105 . A 10 LYS HE3 . 25270 1
120 . 1 1 10 10 LYS CA C 13 59.600 . . 1 . 94 . A 10 LYS CA . 25270 1
121 . 1 1 10 10 LYS CB C 13 32.300 . . 1 . 96 . A 10 LYS CB . 25270 1
122 . 1 1 10 10 LYS CG C 13 25.800 . . 1 . 99 . A 10 LYS CG . 25270 1
123 . 1 1 10 10 LYS CD C 13 29.400 . . 1 . 102 . A 10 LYS CD . 25270 1
124 . 1 1 10 10 LYS CE C 13 41.900 . . 1 . 104 . A 10 LYS CE . 25270 1
125 . 1 1 10 10 LYS N N 15 117.500 . . 1 . 92 . A 10 LYS N . 25270 1
126 . 1 1 11 11 PHE H H 1 8.190 . . 1 . 107 . A 11 PHE H . 25270 1
127 . 1 1 11 11 PHE HA H 1 4.521 . . 1 . 109 . A 11 PHE HA . 25270 1
128 . 1 1 11 11 PHE HB2 H 1 3.358 . . 1 . 112 . A 11 PHE HB2 . 25270 1
129 . 1 1 11 11 PHE HB3 H 1 3.427 . . 1 . 111 . A 11 PHE HB3 . 25270 1
130 . 1 1 11 11 PHE HD1 H 1 7.311 . . 1 . 114 . A 11 PHE HD1 . 25270 1
131 . 1 1 11 11 PHE HD2 H 1 7.311 . . 1 . 114 . A 11 PHE HD2 . 25270 1
132 . 1 1 11 11 PHE CA C 13 60.600 . . 1 . 108 . A 11 PHE CA . 25270 1
133 . 1 1 11 11 PHE CB C 13 39.500 . . 1 . 110 . A 11 PHE CB . 25270 1
134 . 1 1 11 11 PHE CD1 C 13 132.000 . . 1 . 113 . A 11 PHE CD1 . 25270 1
135 . 1 1 11 11 PHE CD2 C 13 132.000 . . 1 . 113 . A 11 PHE CD2 . 25270 1
136 . 1 1 11 11 PHE N N 15 121.010 . . 1 . 106 . A 11 PHE N . 25270 1
137 . 1 1 12 12 LEU H H 1 8.697 . . 1 . 116 . A 12 LEU H . 25270 1
138 . 1 1 12 12 LEU HA H 1 3.994 . . 1 . 118 . A 12 LEU HA . 25270 1
139 . 1 1 12 12 LEU HB2 H 1 1.538 . . 1 . 121 . A 12 LEU HB2 . 25270 1
140 . 1 1 12 12 LEU HB3 H 1 2.011 . . 1 . 120 . A 12 LEU HB3 . 25270 1
141 . 1 1 12 12 LEU HG H 1 2.088 . . 1 . 123 . A 12 LEU HG . 25270 1
142 . 1 1 12 12 LEU HD11 H 1 0.985 . . 1 . 125 . A 12 LEU HD11 . 25270 1
143 . 1 1 12 12 LEU HD12 H 1 0.985 . . 1 . 125 . A 12 LEU HD12 . 25270 1
144 . 1 1 12 12 LEU HD13 H 1 0.985 . . 1 . 125 . A 12 LEU HD13 . 25270 1
145 . 1 1 12 12 LEU HD21 H 1 0.961 . . 1 . 127 . A 12 LEU HD21 . 25270 1
146 . 1 1 12 12 LEU HD22 H 1 0.961 . . 1 . 127 . A 12 LEU HD22 . 25270 1
147 . 1 1 12 12 LEU HD23 H 1 0.961 . . 1 . 127 . A 12 LEU HD23 . 25270 1
148 . 1 1 12 12 LEU CA C 13 57.700 . . 1 . 117 . A 12 LEU CA . 25270 1
149 . 1 1 12 12 LEU CB C 13 41.700 . . 1 . 119 . A 12 LEU CB . 25270 1
150 . 1 1 12 12 LEU CG C 13 27.100 . . 1 . 122 . A 12 LEU CG . 25270 1
151 . 1 1 12 12 LEU CD1 C 13 25.500 . . 1 . 124 . A 12 LEU CD1 . 25270 1
152 . 1 1 12 12 LEU CD2 C 13 23.300 . . 1 . 126 . A 12 LEU CD2 . 25270 1
153 . 1 1 12 12 LEU N N 15 118.470 . . 1 . 115 . A 12 LEU N . 25270 1
154 . 1 1 13 13 GLY H H 1 8.686 . . 1 . 129 . A 13 GLY H . 25270 1
155 . 1 1 13 13 GLY HA2 H 1 3.727 . . 1 . 132 . A 13 GLY HA2 . 25270 1
156 . 1 1 13 13 GLY HA3 H 1 3.988 . . 1 . 131 . A 13 GLY HA3 . 25270 1
157 . 1 1 13 13 GLY CA C 13 47.600 . . 1 . 130 . A 13 GLY CA . 25270 1
158 . 1 1 13 13 GLY N N 15 106.150 . . 1 . 128 . A 13 GLY N . 25270 1
159 . 1 1 14 14 GLY H H 1 8.050 . . 1 . 134 . A 14 GLY H . 25270 1
160 . 1 1 14 14 GLY HA3 H 1 3.991 . . 1 . 136 . A 14 GLY HA3 . 25270 1
161 . 1 1 14 14 GLY CA C 13 47.100 . . 1 . 135 . A 14 GLY CA . 25270 1
162 . 1 1 14 14 GLY N N 15 108.600 . . 1 . 133 . A 14 GLY N . 25270 1
163 . 1 1 15 15 ILE H H 1 7.764 . . 1 . 138 . A 15 ILE H . 25270 1
164 . 1 1 15 15 ILE HA H 1 3.813 . . 1 . 140 . A 15 ILE HA . 25270 1
165 . 1 1 15 15 ILE HB H 1 2.044 . . 1 . 142 . A 15 ILE HB . 25270 1
166 . 1 1 15 15 ILE HG12 H 1 1.029 . . 1 . 145 . A 15 ILE HG12 . 25270 1
167 . 1 1 15 15 ILE HG13 H 1 1.517 . . 1 . 144 . A 15 ILE HG13 . 25270 1
168 . 1 1 15 15 ILE HG21 H 1 0.897 . . 1 . 149 . A 15 ILE HG21 . 25270 1
169 . 1 1 15 15 ILE HG22 H 1 0.897 . . 1 . 149 . A 15 ILE HG22 . 25270 1
170 . 1 1 15 15 ILE HG23 H 1 0.897 . . 1 . 149 . A 15 ILE HG23 . 25270 1
171 . 1 1 15 15 ILE HD11 H 1 0.658 . . 1 . 147 . A 15 ILE HD11 . 25270 1
172 . 1 1 15 15 ILE HD12 H 1 0.658 . . 1 . 147 . A 15 ILE HD12 . 25270 1
173 . 1 1 15 15 ILE HD13 H 1 0.658 . . 1 . 147 . A 15 ILE HD13 . 25270 1
174 . 1 1 15 15 ILE CA C 13 64.500 . . 1 . 139 . A 15 ILE CA . 25270 1
175 . 1 1 15 15 ILE CB C 13 37.400 . . 1 . 141 . A 15 ILE CB . 25270 1
176 . 1 1 15 15 ILE CG1 C 13 28.400 . . 1 . 143 . A 15 ILE CG1 . 25270 1
177 . 1 1 15 15 ILE CG2 C 13 17.500 . . 1 . 148 . A 15 ILE CG2 . 25270 1
178 . 1 1 15 15 ILE CD1 C 13 12.900 . . 1 . 146 . A 15 ILE CD1 . 25270 1
179 . 1 1 15 15 ILE N N 15 122.400 . . 1 . 137 . A 15 ILE N . 25270 1
180 . 1 1 16 16 VAL H H 1 8.133 . . 1 . 151 . A 16 VAL H . 25270 1
181 . 1 1 16 16 VAL HA H 1 3.625 . . 1 . 153 . A 16 VAL HA . 25270 1
182 . 1 1 16 16 VAL HB H 1 2.288 . . 1 . 155 . A 16 VAL HB . 25270 1
183 . 1 1 16 16 VAL HG11 H 1 1.003 . . 1 . 159 . A 16 VAL HG11 . 25270 1
184 . 1 1 16 16 VAL HG12 H 1 1.003 . . 1 . 159 . A 16 VAL HG12 . 25270 1
185 . 1 1 16 16 VAL HG13 H 1 1.003 . . 1 . 159 . A 16 VAL HG13 . 25270 1
186 . 1 1 16 16 VAL HG21 H 1 1.102 . . 1 . 157 . A 16 VAL HG21 . 25270 1
187 . 1 1 16 16 VAL HG22 H 1 1.102 . . 1 . 157 . A 16 VAL HG22 . 25270 1
188 . 1 1 16 16 VAL HG23 H 1 1.102 . . 1 . 157 . A 16 VAL HG23 . 25270 1
189 . 1 1 16 16 VAL CA C 13 67.300 . . 1 . 152 . A 16 VAL CA . 25270 1
190 . 1 1 16 16 VAL CB C 13 31.300 . . 1 . 154 . A 16 VAL CB . 25270 1
191 . 1 1 16 16 VAL CG1 C 13 21.900 . . 1 . 158 . A 16 VAL CG1 . 25270 1
192 . 1 1 16 16 VAL CG2 C 13 23.300 . . 1 . 156 . A 16 VAL CG2 . 25270 1
193 . 1 1 16 16 VAL N N 15 119.610 . . 1 . 150 . A 16 VAL N . 25270 1
194 . 1 1 17 17 ARG H H 1 8.324 . . 1 . 161 . A 17 ARG H . 25270 1
195 . 1 1 17 17 ARG HA H 1 3.982 . . 1 . 163 . A 17 ARG HA . 25270 1
196 . 1 1 17 17 ARG HB2 H 1 1.900 . . 1 . 166 . A 17 ARG HB2 . 25270 1
197 . 1 1 17 17 ARG HB3 H 1 2.009 . . 1 . 165 . A 17 ARG HB3 . 25270 1
198 . 1 1 17 17 ARG HG2 H 1 1.895 . . 1 . 169 . A 17 ARG HG2 . 25270 1
199 . 1 1 17 17 ARG HG3 H 1 1.683 . . 1 . 168 . A 17 ARG HG3 . 25270 1
200 . 1 1 17 17 ARG HD3 H 1 3.288 . . 1 . 171 . A 17 ARG HD3 . 25270 1
201 . 1 1 17 17 ARG CA C 13 60.100 . . 1 . 162 . A 17 ARG CA . 25270 1
202 . 1 1 17 17 ARG CB C 13 30.100 . . 1 . 164 . A 17 ARG CB . 25270 1
203 . 1 1 17 17 ARG CG C 13 28.200 . . 1 . 167 . A 17 ARG CG . 25270 1
204 . 1 1 17 17 ARG CD C 13 43.400 . . 1 . 170 . A 17 ARG CD . 25270 1
205 . 1 1 17 17 ARG N N 15 118.380 . . 1 . 160 . A 17 ARG N . 25270 1
206 . 1 1 18 18 ALA H H 1 7.914 . . 1 . 173 . A 18 ALA H . 25270 1
207 . 1 1 18 18 ALA HA H 1 4.256 . . 1 . 175 . A 18 ALA HA . 25270 1
208 . 1 1 18 18 ALA HB1 H 1 1.577 . . 1 . 177 . A 18 ALA HB1 . 25270 1
209 . 1 1 18 18 ALA HB2 H 1 1.577 . . 1 . 177 . A 18 ALA HB2 . 25270 1
210 . 1 1 18 18 ALA HB3 H 1 1.577 . . 1 . 177 . A 18 ALA HB3 . 25270 1
211 . 1 1 18 18 ALA CA C 13 54.700 . . 1 . 174 . A 18 ALA CA . 25270 1
212 . 1 1 18 18 ALA CB C 13 18.100 . . 1 . 176 . A 18 ALA CB . 25270 1
213 . 1 1 18 18 ALA N N 15 121.190 . . 1 . 172 . A 18 ALA N . 25270 1
214 . 1 1 19 19 MET H H 1 8.239 . . 1 . 179 . A 19 MET H . 25270 1
215 . 1 1 19 19 MET HA H 1 4.221 . . 1 . 181 . A 19 MET HA . 25270 1
216 . 1 1 19 19 MET HB2 H 1 2.186 . . 1 . 184 . A 19 MET HB2 . 25270 1
217 . 1 1 19 19 MET HB3 H 1 2.327 . . 1 . 183 . A 19 MET HB3 . 25270 1
218 . 1 1 19 19 MET HG2 H 1 2.571 . . 1 . 187 . A 19 MET HG2 . 25270 1
219 . 1 1 19 19 MET HG3 H 1 2.848 . . 1 . 186 . A 19 MET HG3 . 25270 1
220 . 1 1 19 19 MET HE1 H 1 2.067 . . 1 . 189 . A 19 MET HE1 . 25270 1
221 . 1 1 19 19 MET HE2 H 1 2.067 . . 1 . 189 . A 19 MET HE2 . 25270 1
222 . 1 1 19 19 MET HE3 H 1 2.067 . . 1 . 189 . A 19 MET HE3 . 25270 1
223 . 1 1 19 19 MET CA C 13 58.700 . . 1 . 180 . A 19 MET CA . 25270 1
224 . 1 1 19 19 MET CB C 13 33.500 . . 1 . 182 . A 19 MET CB . 25270 1
225 . 1 1 19 19 MET CG C 13 32.800 . . 1 . 185 . A 19 MET CG . 25270 1
226 . 1 1 19 19 MET CE C 13 17.300 . . 1 . 188 . A 19 MET CE . 25270 1
227 . 1 1 19 19 MET N N 15 117.090 . . 1 . 178 . A 19 MET N . 25270 1
228 . 1 1 20 20 LEU H H 1 8.238 . . 1 . 191 . A 20 LEU H . 25270 1
229 . 1 1 20 20 LEU HA H 1 4.296 . . 1 . 193 . A 20 LEU HA . 25270 1
230 . 1 1 20 20 LEU HB2 H 1 1.709 . . 1 . 196 . A 20 LEU HB2 . 25270 1
231 . 1 1 20 20 LEU HB3 H 1 1.937 . . 1 . 195 . A 20 LEU HB3 . 25270 1
232 . 1 1 20 20 LEU HG H 1 1.978 . . 1 . 198 . A 20 LEU HG . 25270 1
233 . 1 1 20 20 LEU HD11 H 1 0.958 . . 1 . 200 . A 20 LEU HD11 . 25270 1
234 . 1 1 20 20 LEU HD12 H 1 0.958 . . 1 . 200 . A 20 LEU HD12 . 25270 1
235 . 1 1 20 20 LEU HD13 H 1 0.958 . . 1 . 200 . A 20 LEU HD13 . 25270 1
236 . 1 1 20 20 LEU HD21 H 1 0.944 . . 1 . 202 . A 20 LEU HD21 . 25270 1
237 . 1 1 20 20 LEU HD22 H 1 0.944 . . 1 . 202 . A 20 LEU HD22 . 25270 1
238 . 1 1 20 20 LEU HD23 H 1 0.944 . . 1 . 202 . A 20 LEU HD23 . 25270 1
239 . 1 1 20 20 LEU CA C 13 56.900 . . 1 . 192 . A 20 LEU CA . 25270 1
240 . 1 1 20 20 LEU CB C 13 41.800 . . 1 . 194 . A 20 LEU CB . 25270 1
241 . 1 1 20 20 LEU CG C 13 27.100 . . 1 . 197 . A 20 LEU CG . 25270 1
242 . 1 1 20 20 LEU CD1 C 13 25.800 . . 1 . 199 . A 20 LEU CD1 . 25270 1
243 . 1 1 20 20 LEU CD2 C 13 23.300 . . 1 . 201 . A 20 LEU CD2 . 25270 1
244 . 1 1 20 20 LEU N N 15 117.790 . . 1 . 190 . A 20 LEU N . 25270 1
245 . 1 1 21 21 GLY H H 1 8.036 . . 1 . 204 . A 21 GLY H . 25270 1
246 . 1 1 21 21 GLY HA3 H 1 4.045 . . 1 . 206 . A 21 GLY HA3 . 25270 1
247 . 1 1 21 21 GLY CA C 13 46.300 . . 1 . 205 . A 21 GLY CA . 25270 1
248 . 1 1 21 21 GLY N N 15 105.850 . . 1 . 203 . A 21 GLY N . 25270 1
249 . 1 1 22 22 SER H H 1 7.868 . . 1 . 208 . A 22 SER H . 25270 1
250 . 1 1 22 22 SER HA H 1 4.447 . . 1 . 210 . A 22 SER HA . 25270 1
251 . 1 1 22 22 SER HB3 H 1 3.846 . . 1 . 212 . A 22 SER HB3 . 25270 1
252 . 1 1 22 22 SER CA C 13 59.700 . . 1 . 209 . A 22 SER CA . 25270 1
253 . 1 1 22 22 SER CB C 13 63.700 . . 1 . 211 . A 22 SER CB . 25270 1
254 . 1 1 22 22 SER N N 15 115.100 . . 1 . 207 . A 22 SER N . 25270 1
255 . 1 1 23 23 PHE H H 1 7.855 . . 1 . 214 . A 23 PHE H . 25270 1
256 . 1 1 23 23 PHE HA H 1 4.656 . . 1 . 216 . A 23 PHE HA . 25270 1
257 . 1 1 23 23 PHE HB2 H 1 3.121 . . 1 . 219 . A 23 PHE HB2 . 25270 1
258 . 1 1 23 23 PHE HB3 H 1 3.329 . . 1 . 218 . A 23 PHE HB3 . 25270 1
259 . 1 1 23 23 PHE HD1 H 1 7.414 . . 1 . 221 . A 23 PHE HD1 . 25270 1
260 . 1 1 23 23 PHE HD2 H 1 7.414 . . 1 . 221 . A 23 PHE HD2 . 25270 1
261 . 1 1 23 23 PHE CA C 13 58.100 . . 1 . 215 . A 23 PHE CA . 25270 1
262 . 1 1 23 23 PHE CB C 13 39.500 . . 1 . 217 . A 23 PHE CB . 25270 1
263 . 1 1 23 23 PHE CD1 C 13 132.100 . . 1 . 220 . A 23 PHE CD1 . 25270 1
264 . 1 1 23 23 PHE CD2 C 13 132.100 . . 1 . 220 . A 23 PHE CD2 . 25270 1
265 . 1 1 23 23 PHE N N 15 119.750 . . 1 . 213 . A 23 PHE N . 25270 1
266 . 1 1 24 24 ARG H H 1 7.903 . . 1 . 223 . A 24 ARG H . 25270 1
267 . 1 1 24 24 ARG HA H 1 4.430 . . 1 . 225 . A 24 ARG HA . 25270 1
268 . 1 1 24 24 ARG HB2 H 1 1.859 . . 1 . 228 . A 24 ARG HB2 . 25270 1
269 . 1 1 24 24 ARG HB3 H 1 1.973 . . 1 . 227 . A 24 ARG HB3 . 25270 1
270 . 1 1 24 24 ARG HG2 H 1 1.661 . . 1 . 231 . A 24 ARG HG2 . 25270 1
271 . 1 1 24 24 ARG HG3 H 1 1.713 . . 1 . 230 . A 24 ARG HG3 . 25270 1
272 . 1 1 24 24 ARG HD3 H 1 3.279 . . 1 . 233 . A 24 ARG HD3 . 25270 1
273 . 1 1 24 24 ARG CA C 13 56.100 . . 1 . 224 . A 24 ARG CA . 25270 1
274 . 1 1 24 24 ARG CB C 13 31.200 . . 1 . 226 . A 24 ARG CB . 25270 1
275 . 1 1 24 24 ARG CG C 13 27.200 . . 1 . 229 . A 24 ARG CG . 25270 1
276 . 1 1 24 24 ARG CD C 13 43.500 . . 1 . 232 . A 24 ARG CD . 25270 1
277 . 1 1 24 24 ARG N N 15 120.690 . . 1 . 222 . A 24 ARG N . 25270 1
278 . 1 1 25 25 LYS H H 1 8.368 . . 1 . 235 . A 25 LYS H . 25270 1
279 . 1 1 25 25 LYS HA H 1 4.446 . . 1 . 237 . A 25 LYS HA . 25270 1
280 . 1 1 25 25 LYS HB2 H 1 1.833 . . 1 . 240 . A 25 LYS HB2 . 25270 1
281 . 1 1 25 25 LYS HB3 H 1 1.951 . . 1 . 239 . A 25 LYS HB3 . 25270 1
282 . 1 1 25 25 LYS HG3 H 1 1.535 . . 1 . 242 . A 25 LYS HG3 . 25270 1
283 . 1 1 25 25 LYS HD3 H 1 1.793 . . 1 . 244 . A 25 LYS HD3 . 25270 1
284 . 1 1 25 25 LYS HE3 H 1 3.089 . . 1 . 246 . A 25 LYS HE3 . 25270 1
285 . 1 1 25 25 LYS CA C 13 56.100 . . 1 . 236 . A 25 LYS CA . 25270 1
286 . 1 1 25 25 LYS CB C 13 33.300 . . 1 . 238 . A 25 LYS CB . 25270 1
287 . 1 1 25 25 LYS CG C 13 24.600 . . 1 . 241 . A 25 LYS CG . 25270 1
288 . 1 1 25 25 LYS CD C 13 29.000 . . 1 . 243 . A 25 LYS CD . 25270 1
289 . 1 1 25 25 LYS CE C 13 42.000 . . 1 . 245 . A 25 LYS CE . 25270 1
290 . 1 1 25 25 LYS N N 15 123.030 . . 1 . 234 . A 25 LYS N . 25270 1
291 . 1 1 26 26 ASP H H 1 8.003 . . 1 . 248 . A 26 ASP H . 25270 1
292 . 1 1 26 26 ASP HA H 1 4.453 . . 1 . 250 . A 26 ASP HA . 25270 1
293 . 1 1 26 26 ASP HB2 H 1 2.636 . . 1 . 253 . A 26 ASP HB2 . 25270 1
294 . 1 1 26 26 ASP HB3 H 1 2.731 . . 1 . 252 . A 26 ASP HB3 . 25270 1
295 . 1 1 26 26 ASP CA C 13 55.700 . . 1 . 249 . A 26 ASP CA . 25270 1
296 . 1 1 26 26 ASP CB C 13 42.300 . . 1 . 251 . A 26 ASP CB . 25270 1
297 . 1 1 26 26 ASP N N 15 126.740 . . 1 . 247 . A 26 ASP N . 25270 1
stop_
save_