Content for NMR-STAR saveframe, "shifts_polymorphC"
save_shifts_polymorphC
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shifts_polymorphC
_Assigned_chem_shift_list.Entry_ID 27602
_Assigned_chem_shift_list.ID 3
_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 .
_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
9 '2D DARR C-C 20 ms' . . . 27602 3
11 '3D NCACB' . . . 27602 3
12 '3D NCACX' . . . 27602 3
13 '3D NCOCX' . . . 27602 3
16 '3D CANCO' . . . 27602 3
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.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 29 29 ILE C C 13 174.134 0.009 . 1 . . . . . 29 ILE C . 27602 3
2 . 1 1 29 29 ILE CA C 13 62.072 0.000 . 1 . . . . . 29 ILE CA . 27602 3
3 . 1 1 30 30 ALA C C 13 174.788 0.011 . 1 . . . . . 30 ALA C . 27602 3
4 . 1 1 30 30 ALA CA C 13 49.890 0.022 . 1 . . . . . 30 ALA CA . 27602 3
5 . 1 1 30 30 ALA CB C 13 21.299 0.011 . 1 . . . . . 30 ALA CB . 27602 3
6 . 1 1 30 30 ALA N N 15 129.173 0.015 . 1 . . . . . 30 ALA N . 27602 3
7 . 1 1 31 31 SER C C 13 173.555 0.028 . 1 . . . . . 31 SER C . 27602 3
8 . 1 1 31 31 SER CA C 13 55.429 0.023 . 1 . . . . . 31 SER CA . 27602 3
9 . 1 1 31 31 SER CB C 13 63.756 0.043 . 1 . . . . . 31 SER CB . 27602 3
10 . 1 1 31 31 SER N N 15 118.733 0.037 . 1 . . . . . 31 SER N . 27602 3
11 . 1 1 32 32 ASN C C 13 169.459 0.048 . 1 . . . . . 32 ASN C . 27602 3
12 . 1 1 32 32 ASN CA C 13 54.740 0.036 . 1 . . . . . 32 ASN CA . 27602 3
13 . 1 1 32 32 ASN CB C 13 36.068 0.072 . 1 . . . . . 32 ASN CB . 27602 3
14 . 1 1 32 32 ASN CG C 13 178.210 0.021 . 1 . . . . . 32 ASN CG . 27602 3
15 . 1 1 32 32 ASN N N 15 122.767 0.019 . 1 . . . . . 32 ASN N . 27602 3
16 . 1 1 33 33 TYR C C 13 172.862 0.088 . 1 . . . . . 33 TYR C . 27602 3
17 . 1 1 33 33 TYR CA C 13 57.002 0.045 . 1 . . . . . 33 TYR CA . 27602 3
18 . 1 1 33 33 TYR CB C 13 43.732 0.054 . 1 . . . . . 33 TYR CB . 27602 3
19 . 1 1 33 33 TYR N N 15 128.996 0.055 . 1 . . . . . 33 TYR N . 27602 3
20 . 1 1 64 64 SER C C 13 171.798 0.000 . 1 . . . . . 64 SER C . 27602 3
21 . 1 1 65 65 GLY C C 13 172.551 0.003 . 1 . . . . . 65 GLY C . 27602 3
22 . 1 1 65 65 GLY CA C 13 44.453 0.003 . 1 . . . . . 65 GLY CA . 27602 3
23 . 1 1 65 65 GLY N N 15 112.568 0.007 . 1 . . . . . 65 GLY N . 27602 3
24 . 1 1 66 66 SER C C 13 172.575 0.017 . 1 . . . . . 66 SER C . 27602 3
25 . 1 1 66 66 SER CA C 13 57.296 0.019 . 1 . . . . . 66 SER CA . 27602 3
26 . 1 1 66 66 SER CB C 13 66.813 0.004 . 1 . . . . . 66 SER CB . 27602 3
27 . 1 1 66 66 SER N N 15 117.568 0.013 . 1 . . . . . 66 SER N . 27602 3
28 . 1 1 67 67 ILE C C 13 175.149 0.024 . 1 . . . . . 67 ILE C . 27602 3
29 . 1 1 67 67 ILE CA C 13 60.557 0.053 . 1 . . . . . 67 ILE CA . 27602 3
30 . 1 1 67 67 ILE CB C 13 39.926 0.027 . 1 . . . . . 67 ILE CB . 27602 3
31 . 1 1 67 67 ILE CG1 C 13 27.724 0.046 . 1 . . . . . 67 ILE CG1 . 27602 3
32 . 1 1 67 67 ILE CG2 C 13 17.322 0.167 . 1 . . . . . 67 ILE CG2 . 27602 3
33 . 1 1 67 67 ILE CD1 C 13 16.450 0.020 . 1 . . . . . 67 ILE CD1 . 27602 3
34 . 1 1 67 67 ILE N N 15 123.106 0.005 . 1 . . . . . 67 ILE N . 27602 3
35 . 1 1 68 68 ASP C C 13 177.365 0.063 . 1 . . . . . 68 ASP C . 27602 3
36 . 1 1 68 68 ASP CA C 13 53.070 0.039 . 1 . . . . . 68 ASP CA . 27602 3
37 . 1 1 68 68 ASP CB C 13 43.408 0.072 . 1 . . . . . 68 ASP CB . 27602 3
38 . 1 1 68 68 ASP CG C 13 179.556 0.021 . 1 . . . . . 68 ASP CG . 27602 3
39 . 1 1 68 68 ASP N N 15 124.852 0.053 . 1 . . . . . 68 ASP N . 27602 3
40 . 1 1 69 69 SER C C 13 176.006 0.022 . 1 . . . . . 69 SER C . 27602 3
41 . 1 1 69 69 SER CA C 13 56.584 0.016 . 1 . . . . . 69 SER CA . 27602 3
42 . 1 1 69 69 SER CB C 13 64.493 0.092 . 1 . . . . . 69 SER CB . 27602 3
43 . 1 1 69 69 SER N N 15 117.935 0.037 . 1 . . . . . 69 SER N . 27602 3
44 . 1 1 70 70 SER C C 13 173.377 0.056 . 1 . . . . . 70 SER C . 27602 3
45 . 1 1 70 70 SER CA C 13 56.216 0.023 . 1 . . . . . 70 SER CA . 27602 3
46 . 1 1 70 70 SER CB C 13 66.717 0.040 . 1 . . . . . 70 SER CB . 27602 3
47 . 1 1 70 70 SER N N 15 122.838 0.038 . 1 . . . . . 70 SER N . 27602 3
48 . 1 1 71 71 SER C C 13 173.781 0.042 . 1 . . . . . 71 SER C . 27602 3
49 . 1 1 71 71 SER CA C 13 58.860 0.042 . 1 . . . . . 71 SER CA . 27602 3
50 . 1 1 71 71 SER CB C 13 61.307 0.056 . 1 . . . . . 71 SER CB . 27602 3
51 . 1 1 71 71 SER N N 15 113.189 0.063 . 1 . . . . . 71 SER N . 27602 3
52 . 1 1 72 72 ASN C C 13 175.514 0.027 . 1 . . . . . 72 ASN C . 27602 3
53 . 1 1 72 72 ASN CA C 13 52.430 0.027 . 1 . . . . . 72 ASN CA . 27602 3
54 . 1 1 72 72 ASN CB C 13 41.219 0.033 . 1 . . . . . 72 ASN CB . 27602 3
55 . 1 1 72 72 ASN N N 15 117.983 0.184 . 1 . . . . . 72 ASN N . 27602 3
56 . 1 1 73 73 SER C C 13 172.791 0.001 . 1 . . . . . 73 SER C . 27602 3
57 . 1 1 73 73 SER CA C 13 56.913 0.016 . 1 . . . . . 73 SER CA . 27602 3
58 . 1 1 73 73 SER CB C 13 66.114 0.000 . 1 . . . . . 73 SER CB . 27602 3
59 . 1 1 73 73 SER N N 15 114.108 0.036 . 1 . . . . . 73 SER N . 27602 3
60 . 1 1 74 74 ALA C C 13 176.530 0.016 . 1 . . . . . 74 ALA C . 27602 3
61 . 1 1 74 74 ALA CA C 13 50.562 0.030 . 1 . . . . . 74 ALA CA . 27602 3
62 . 1 1 74 74 ALA CB C 13 24.120 0.082 . 1 . . . . . 74 ALA CB . 27602 3
63 . 1 1 74 74 ALA N N 15 124.098 0.047 . 1 . . . . . 74 ALA N . 27602 3
64 . 1 1 75 75 SER C C 13 173.480 0.453 . 1 . . . . . 75 SER C . 27602 3
65 . 1 1 75 75 SER CA C 13 56.927 0.041 . 1 . . . . . 75 SER CA . 27602 3
66 . 1 1 75 75 SER CB C 13 64.550 0.040 . 1 . . . . . 75 SER CB . 27602 3
67 . 1 1 75 75 SER N N 15 118.621 0.047 . 1 . . . . . 75 SER N . 27602 3
68 . 1 1 90 90 TYR C C 13 177.195 0.021 . 1 . . . . . 90 TYR C . 27602 3
69 . 1 1 90 90 TYR CA C 13 51.524 0.033 . 1 . . . . . 90 TYR CA . 27602 3
70 . 1 1 90 90 TYR CB C 13 41.089 0.033 . 1 . . . . . 90 TYR CB . 27602 3
71 . 1 1 90 90 TYR N N 15 122.852 0.000 . 1 . . . . . 90 TYR N . 27602 3
72 . 1 1 91 91 CYS C C 13 171.560 0.042 . 1 . . . . . 91 CYS C . 27602 3
73 . 1 1 91 91 CYS CA C 13 56.952 0.020 . 1 . . . . . 91 CYS CA . 27602 3
74 . 1 1 91 91 CYS CB C 13 40.887 0.037 . 1 . . . . . 91 CYS CB . 27602 3
75 . 1 1 91 91 CYS N N 15 123.967 0.021 . 1 . . . . . 91 CYS N . 27602 3
76 . 1 1 92 92 GLN C C 13 173.066 0.031 . 1 . . . . . 92 GLN C . 27602 3
77 . 1 1 92 92 GLN CA C 13 54.157 0.037 . 1 . . . . . 92 GLN CA . 27602 3
78 . 1 1 92 92 GLN CB C 13 32.248 0.057 . 1 . . . . . 92 GLN CB . 27602 3
79 . 1 1 92 92 GLN N N 15 124.122 0.092 . 1 . . . . . 92 GLN N . 27602 3
80 . 1 1 93 93 SER C C 13 171.343 0.016 . 1 . . . . . 93 SER C . 27602 3
81 . 1 1 93 93 SER CA C 13 54.874 0.021 . 1 . . . . . 93 SER CA . 27602 3
82 . 1 1 93 93 SER CB C 13 64.275 0.039 . 1 . . . . . 93 SER CB . 27602 3
83 . 1 1 93 93 SER N N 15 117.252 0.073 . 1 . . . . . 93 SER N . 27602 3
84 . 1 1 94 94 TYR C C 13 175.189 0.011 . 1 . . . . . 94 TYR C . 27602 3
85 . 1 1 94 94 TYR CA C 13 55.773 0.042 . 1 . . . . . 94 TYR CA . 27602 3
86 . 1 1 94 94 TYR CB C 13 39.491 0.053 . 1 . . . . . 94 TYR CB . 27602 3
87 . 1 1 94 94 TYR CD1 C 13 131.982 0.033 . 1 . . . . . 94 TYR CD1 . 27602 3
88 . 1 1 94 94 TYR CD2 C 13 131.982 0.033 . 1 . . . . . 94 TYR CD2 . 27602 3
89 . 1 1 94 94 TYR CE1 C 13 117.601 0.000 . 1 . . . . . 94 TYR CE1 . 27602 3
90 . 1 1 94 94 TYR CE2 C 13 117.601 0.000 . 1 . . . . . 94 TYR CE2 . 27602 3
91 . 1 1 94 94 TYR N N 15 133.144 0.123 . 1 . . . . . 94 TYR N . 27602 3
92 . 1 1 95 95 ASP C C 13 173.895 0.021 . 1 . . . . . 95 ASP C . 27602 3
93 . 1 1 95 95 ASP CA C 13 52.404 0.019 . 1 . . . . . 95 ASP CA . 27602 3
94 . 1 1 95 95 ASP CB C 13 41.811 0.023 . 1 . . . . . 95 ASP CB . 27602 3
95 . 1 1 95 95 ASP CG C 13 180.489 0.016 . 1 . . . . . 95 ASP CG . 27602 3
96 . 1 1 95 95 ASP N N 15 128.283 0.007 . 1 . . . . . 95 ASP N . 27602 3
97 . 1 1 100 100 VAL C C 13 174.249 0.000 . 1 . . . . . 100 VAL C . 27602 3
98 . 1 1 101 101 VAL C C 13 175.371 0.006 . 1 . . . . . 101 VAL C . 27602 3
99 . 1 1 101 101 VAL CA C 13 60.872 0.025 . 1 . . . . . 101 VAL CA . 27602 3
100 . 1 1 101 101 VAL CB C 13 33.538 0.023 . 1 . . . . . 101 VAL CB . 27602 3
101 . 1 1 101 101 VAL CG1 C 13 22.730 0.005 . 1 . . . . . 101 VAL CG1 . 27602 3
102 . 1 1 101 101 VAL N N 15 122.461 0.010 . 1 . . . . . 101 VAL N . 27602 3
103 . 1 1 102 102 PHE C C 13 176.806 0.052 . 1 . . . . . 102 PHE C . 27602 3
104 . 1 1 102 102 PHE CA C 13 55.258 0.034 . 1 . . . . . 102 PHE CA . 27602 3
105 . 1 1 102 102 PHE CB C 13 37.675 0.022 . 1 . . . . . 102 PHE CB . 27602 3
106 . 1 1 102 102 PHE N N 15 130.553 0.172 . 1 . . . . . 102 PHE N . 27602 3
107 . 1 1 103 103 GLY C C 13 172.107 0.075 . 1 . . . . . 103 GLY C . 27602 3
108 . 1 1 103 103 GLY CA C 13 44.728 0.039 . 1 . . . . . 103 GLY CA . 27602 3
109 . 1 1 103 103 GLY N N 15 107.083 0.014 . 1 . . . . . 103 GLY N . 27602 3
110 . 1 1 104 104 GLY C C 13 178.175 0.020 . 1 . . . . . 104 GLY C . 27602 3
111 . 1 1 104 104 GLY CA C 13 44.985 0.017 . 1 . . . . . 104 GLY CA . 27602 3
112 . 1 1 104 104 GLY N N 15 104.287 0.015 . 1 . . . . . 104 GLY N . 27602 3
113 . 1 1 105 105 GLY C C 13 173.939 0.039 . 1 . . . . . 105 GLY C . 27602 3
114 . 1 1 105 105 GLY CA C 13 49.347 0.013 . 1 . . . . . 105 GLY CA . 27602 3
115 . 1 1 105 105 GLY N N 15 116.478 0.031 . 1 . . . . . 105 GLY N . 27602 3
116 . 1 1 106 106 THR C C 13 172.565 0.036 . 1 . . . . . 106 THR C . 27602 3
117 . 1 1 106 106 THR CA C 13 61.781 0.039 . 1 . . . . . 106 THR CA . 27602 3
118 . 1 1 106 106 THR CB C 13 69.088 0.056 . 1 . . . . . 106 THR CB . 27602 3
119 . 1 1 106 106 THR CG2 C 13 23.907 0.037 . 1 . . . . . 106 THR CG2 . 27602 3
120 . 1 1 106 106 THR N N 15 121.495 0.046 . 1 . . . . . 106 THR N . 27602 3
121 . 1 1 108 108 LEU C C 13 175.241 0.015 . 1 . . . . . 108 LEU C . 27602 3
122 . 1 1 108 108 LEU CA C 13 52.822 0.004 . 1 . . . . . 108 LEU CA . 27602 3
123 . 1 1 108 108 LEU CB C 13 39.797 0.049 . 1 . . . . . 108 LEU CB . 27602 3
124 . 1 1 109 109 THR C C 13 172.325 0.044 . 1 . . . . . 109 THR C . 27602 3
125 . 1 1 109 109 THR CA C 13 62.066 0.012 . 1 . . . . . 109 THR CA . 27602 3
126 . 1 1 109 109 THR CB C 13 70.447 0.038 . 1 . . . . . 109 THR CB . 27602 3
127 . 1 1 109 109 THR CG2 C 13 20.601 0.043 . 1 . . . . . 109 THR CG2 . 27602 3
128 . 1 1 109 109 THR N N 15 127.601 0.006 . 1 . . . . . 109 THR N . 27602 3
129 . 1 1 110 110 VAL C C 13 173.687 0.004 . 1 . . . . . 110 VAL C . 27602 3
130 . 1 1 110 110 VAL CA C 13 60.291 0.007 . 1 . . . . . 110 VAL CA . 27602 3
131 . 1 1 110 110 VAL CB C 13 35.303 0.006 . 1 . . . . . 110 VAL CB . 27602 3
132 . 1 1 110 110 VAL CG1 C 13 21.249 0.009 . 1 . . . . . 110 VAL CG1 . 27602 3
133 . 1 1 110 110 VAL N N 15 126.597 0.004 . 1 . . . . . 110 VAL N . 27602 3
stop_
save_