Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27457
_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 .
_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 CC DARR with 20 ms mixing time' . . . 27457 1
2 '2D CC DARR with 100 ms mixing time' . . . 27457 1
3 '2D NCA' . . . 27457 1
4 '2D NCO' . . . 27457 1
5 '3D NCACX with 100 ms CC DARR' . . . 27457 1
6 '3D NCOCX with 100 ms CC DARR' . . . 27457 1
7 '3D CANCO' . . . 27457 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.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 25 25 ASN C C 13 179.271 0.000 . 1 . . . . . 25 N C . 27457 1
2 . 1 1 26 26 ILE CA C 13 61.917 0.029 . 1 . . . . . 26 I CA . 27457 1
3 . 1 1 26 26 ILE CB C 13 37.874 0.032 . 1 . . . . . 26 I CB . 27457 1
4 . 1 1 26 26 ILE CG1 C 13 29.873 0.013 . 1 . . . . . 26 I CG1 . 27457 1
5 . 1 1 26 26 ILE CG2 C 13 19.339 0.006 . 1 . . . . . 26 I CG2 . 27457 1
6 . 1 1 26 26 ILE CD1 C 13 14.930 0.005 . 1 . . . . . 26 I CD1 . 27457 1
7 . 1 1 26 26 ILE N N 15 124.573 0.059 . 1 . . . . . 26 I N . 27457 1
8 . 1 1 27 27 GLN C C 13 175.713 0.058 . 1 . . . . . 27 Q C . 27457 1
9 . 1 1 27 27 GLN CA C 13 53.405 0.108 . 1 . . . . . 27 Q CA . 27457 1
10 . 1 1 27 27 GLN CB C 13 28.184 0.006 . 1 . . . . . 27 Q CB . 27457 1
11 . 1 1 27 27 GLN N N 15 127.405 0.073 . 1 . . . . . 27 Q N . 27457 1
12 . 1 1 28 28 GLY C C 13 174.175 0.154 . 1 . . . . . 28 G C . 27457 1
13 . 1 1 28 28 GLY CA C 13 45.593 0.102 . 1 . . . . . 28 G CA . 27457 1
14 . 1 1 28 28 GLY N N 15 105.468 0.138 . 1 . . . . . 28 G N . 27457 1
15 . 1 1 29 29 ILE C C 13 175.021 0.079 . 1 . . . . . 29 I C . 27457 1
16 . 1 1 29 29 ILE CA C 13 58.959 0.100 . 1 . . . . . 29 I CA . 27457 1
17 . 1 1 29 29 ILE CB C 13 32.340 0.057 . 1 . . . . . 29 I CB . 27457 1
18 . 1 1 29 29 ILE CG1 C 13 26.753 0.044 . 1 . . . . . 29 I CG1 . 27457 1
19 . 1 1 29 29 ILE CG2 C 13 16.553 0.027 . 1 . . . . . 29 I CG2 . 27457 1
20 . 1 1 29 29 ILE CD1 C 13 9.722 0.025 . 1 . . . . . 29 I CD1 . 27457 1
21 . 1 1 29 29 ILE N N 15 122.254 0.092 . 1 . . . . . 29 I N . 27457 1
22 . 1 1 30 30 THR C C 13 174.077 0.095 . 1 . . . . . 30 T C . 27457 1
23 . 1 1 30 30 THR CA C 13 62.246 0.050 . 1 . . . . . 30 T CA . 27457 1
24 . 1 1 30 30 THR CB C 13 71.298 0.054 . 1 . . . . . 30 T CB . 27457 1
25 . 1 1 30 30 THR CG2 C 13 22.286 0.016 . 1 . . . . . 30 T CG2 . 27457 1
26 . 1 1 30 30 THR N N 15 114.837 0.082 . 1 . . . . . 30 T N . 27457 1
27 . 1 1 31 31 LYS C C 13 175.285 0.075 . 1 . . . . . 31 K C . 27457 1
28 . 1 1 31 31 LYS CA C 13 61.264 0.104 . 1 . . . . . 31 K CA . 27457 1
29 . 1 1 31 31 LYS CB C 13 32.014 0.014 . 1 . . . . . 31 K CB . 27457 1
30 . 1 1 31 31 LYS CG C 13 25.925 0.000 . 1 . . . . . 31 K CG . 27457 1
31 . 1 1 31 31 LYS CE C 13 44.411 0.060 . 1 . . . . . 31 K CE . 27457 1
32 . 1 1 31 31 LYS N N 15 119.676 0.172 . 1 . . . . . 31 K N . 27457 1
33 . 1 1 32 32 PRO C C 13 178.784 0.123 . 1 . . . . . 32 P C . 27457 1
34 . 1 1 32 32 PRO CA C 13 65.734 0.063 . 1 . . . . . 32 P CA . 27457 1
35 . 1 1 32 32 PRO CB C 13 31.125 0.039 . 1 . . . . . 32 P CB . 27457 1
36 . 1 1 32 32 PRO CG C 13 29.115 0.029 . 1 . . . . . 32 P CG . 27457 1
37 . 1 1 32 32 PRO CD C 13 49.647 0.067 . 1 . . . . . 32 P CD . 27457 1
38 . 1 1 32 32 PRO N N 15 134.142 0.081 . 1 . . . . . 32 P N . 27457 1
39 . 1 1 33 33 ALA C C 13 178.872 0.047 . 1 . . . . . 33 A C . 27457 1
40 . 1 1 33 33 ALA CA C 13 55.660 0.090 . 1 . . . . . 33 A CA . 27457 1
41 . 1 1 33 33 ALA CB C 13 19.380 0.046 . 1 . . . . . 33 A CB . 27457 1
42 . 1 1 33 33 ALA N N 15 120.589 0.209 . 1 . . . . . 33 A N . 27457 1
43 . 1 1 34 34 ILE C C 13 177.724 0.123 . 1 . . . . . 34 I C . 27457 1
44 . 1 1 34 34 ILE CA C 13 65.924 0.082 . 1 . . . . . 34 I CA . 27457 1
45 . 1 1 34 34 ILE CB C 13 37.921 0.017 . 1 . . . . . 34 I CB . 27457 1
46 . 1 1 34 34 ILE CG1 C 13 30.701 0.003 . 1 . . . . . 34 I CG1 . 27457 1
47 . 1 1 34 34 ILE CG2 C 13 18.419 0.034 . 1 . . . . . 34 I CG2 . 27457 1
48 . 1 1 34 34 ILE CD1 C 13 14.560 0.063 . 1 . . . . . 34 I CD1 . 27457 1
49 . 1 1 34 34 ILE N N 15 117.220 0.063 . 1 . . . . . 34 I N . 27457 1
50 . 1 1 35 35 ARG C C 13 177.678 0.147 . 1 . . . . . 35 R C . 27457 1
51 . 1 1 35 35 ARG CA C 13 61.156 0.000 . 1 . . . . . 35 R CA . 27457 1
52 . 1 1 35 35 ARG CB C 13 30.532 0.016 . 1 . . . . . 35 R CB . 27457 1
53 . 1 1 35 35 ARG CG C 13 29.005 0.000 . 1 . . . . . 35 R CG . 27457 1
54 . 1 1 35 35 ARG N N 15 118.487 0.025 . 1 . . . . . 35 R N . 27457 1
55 . 1 1 36 36 ARG C C 13 177.719 0.055 . 1 . . . . . 36 R C . 27457 1
56 . 1 1 36 36 ARG CA C 13 61.129 0.023 . 1 . . . . . 36 R CA . 27457 1
57 . 1 1 36 36 ARG CB C 13 32.014 0.000 . 1 . . . . . 36 R CB . 27457 1
58 . 1 1 36 36 ARG N N 15 117.016 0.217 . 1 . . . . . 36 R N . 27457 1
59 . 1 1 37 37 LEU C C 13 178.323 0.016 . 1 . . . . . 37 L C . 27457 1
60 . 1 1 37 37 LEU CA C 13 60.305 0.103 . 1 . . . . . 37 L CA . 27457 1
61 . 1 1 37 37 LEU CG C 13 30.628 0.000 . 1 . . . . . 37 L CG . 27457 1
62 . 1 1 37 37 LEU CD1 C 13 29.144 0.000 . 2 . . . . . 37 L CD1 . 27457 1
63 . 1 1 37 37 LEU N N 15 118.518 0.165 . 1 . . . . . 37 L N . 27457 1
64 . 1 1 38 38 ALA C C 13 179.927 0.081 . 1 . . . . . 38 A C . 27457 1
65 . 1 1 38 38 ALA CA C 13 55.241 0.072 . 1 . . . . . 38 A CA . 27457 1
66 . 1 1 38 38 ALA CB C 13 14.973 0.030 . 1 . . . . . 38 A CB . 27457 1
67 . 1 1 38 38 ALA N N 15 121.141 0.022 . 1 . . . . . 38 A N . 27457 1
68 . 1 1 39 39 ARG C C 13 180.943 0.091 . 1 . . . . . 39 R C . 27457 1
69 . 1 1 39 39 ARG CA C 13 57.444 0.087 . 1 . . . . . 39 R CA . 27457 1
70 . 1 1 39 39 ARG CB C 13 29.729 0.165 . 1 . . . . . 39 R CB . 27457 1
71 . 1 1 39 39 ARG CG C 13 27.292 0.076 . 1 . . . . . 39 R CG . 27457 1
72 . 1 1 39 39 ARG CD C 13 42.800 0.045 . 1 . . . . . 39 R CD . 27457 1
73 . 1 1 39 39 ARG CZ C 13 159.241 0.012 . 1 . . . . . 39 R CZ . 27457 1
74 . 1 1 39 39 ARG N N 15 118.325 0.190 . 1 . . . . . 39 R N . 27457 1
75 . 1 1 40 40 ARG C C 13 178.119 0.083 . 1 . . . . . 40 R C . 27457 1
76 . 1 1 40 40 ARG CA C 13 60.355 0.097 . 1 . . . . . 40 R CA . 27457 1
77 . 1 1 40 40 ARG CB C 13 29.276 0.064 . 1 . . . . . 40 R CB . 27457 1
78 . 1 1 40 40 ARG CD C 13 43.475 0.083 . 1 . . . . . 40 R CD . 27457 1
79 . 1 1 40 40 ARG CZ C 13 159.939 0.107 . 1 . . . . . 40 R CZ . 27457 1
80 . 1 1 40 40 ARG N N 15 121.238 0.181 . 1 . . . . . 40 R N . 27457 1
81 . 1 1 40 40 ARG NE N 15 75.762 0.011 . 1 . . . . . 40 R NE . 27457 1
82 . 1 1 41 41 GLY C C 13 172.537 0.070 . 1 . . . . . 41 G C . 27457 1
83 . 1 1 41 41 GLY CA C 13 46.107 0.050 . 1 . . . . . 41 G CA . 27457 1
84 . 1 1 41 41 GLY N N 15 107.152 0.146 . 1 . . . . . 41 G N . 27457 1
85 . 1 1 42 42 GLY C C 13 173.388 0.082 . 1 . . . . . 42 G C . 27457 1
86 . 1 1 42 42 GLY CA C 13 45.066 0.056 . 1 . . . . . 42 G CA . 27457 1
87 . 1 1 42 42 GLY N N 15 106.589 0.137 . 1 . . . . . 42 G N . 27457 1
88 . 1 1 43 43 VAL C C 13 175.113 0.095 . 1 . . . . . 43 V C . 27457 1
89 . 1 1 43 43 VAL CA C 13 62.825 0.101 . 1 . . . . . 43 V CA . 27457 1
90 . 1 1 43 43 VAL CB C 13 32.278 0.016 . 1 . . . . . 43 V CB . 27457 1
91 . 1 1 43 43 VAL CG1 C 13 23.317 0.067 . 2 . . . . . 43 V CG1 . 27457 1
92 . 1 1 43 43 VAL CG2 C 13 21.495 0.065 . 2 . . . . . 43 V CG2 . 27457 1
93 . 1 1 43 43 VAL N N 15 119.899 0.144 . 1 . . . . . 43 V N . 27457 1
94 . 1 1 44 44 LYS C C 13 175.015 0.074 . 1 . . . . . 44 K C . 27457 1
95 . 1 1 44 44 LYS CA C 13 57.248 0.084 . 1 . . . . . 44 K CA . 27457 1
96 . 1 1 44 44 LYS CB C 13 28.886 0.039 . 1 . . . . . 44 K CB . 27457 1
97 . 1 1 44 44 LYS N N 15 128.043 0.167 . 1 . . . . . 44 K N . 27457 1
98 . 1 1 45 45 ARG C C 13 173.968 0.081 . 1 . . . . . 45 R C . 27457 1
99 . 1 1 45 45 ARG CA C 13 56.255 0.126 . 1 . . . . . 45 R CA . 27457 1
100 . 1 1 45 45 ARG CB C 13 33.957 0.034 . 1 . . . . . 45 R CB . 27457 1
101 . 1 1 45 45 ARG CG C 13 29.390 0.110 . 1 . . . . . 45 R CG . 27457 1
102 . 1 1 45 45 ARG N N 15 122.497 0.227 . 1 . . . . . 45 R N . 27457 1
103 . 1 1 46 46 ILE C C 13 175.180 0.071 . 1 . . . . . 46 I C . 27457 1
104 . 1 1 46 46 ILE CA C 13 61.622 0.084 . 1 . . . . . 46 I CA . 27457 1
105 . 1 1 46 46 ILE CB C 13 42.246 0.037 . 1 . . . . . 46 I CB . 27457 1
106 . 1 1 46 46 ILE CG1 C 13 28.767 0.013 . 1 . . . . . 46 I CG1 . 27457 1
107 . 1 1 46 46 ILE CG2 C 13 17.767 0.047 . 1 . . . . . 46 I CG2 . 27457 1
108 . 1 1 46 46 ILE CD1 C 13 14.472 0.030 . 1 . . . . . 46 I CD1 . 27457 1
109 . 1 1 46 46 ILE N N 15 127.238 0.092 . 1 . . . . . 46 I N . 27457 1
110 . 1 1 47 47 SER C C 13 176.842 0.094 . 1 . . . . . 47 S C . 27457 1
111 . 1 1 47 47 SER CA C 13 58.594 0.091 . 1 . . . . . 47 S CA . 27457 1
112 . 1 1 47 47 SER CB C 13 64.838 0.072 . 1 . . . . . 47 S CB . 27457 1
113 . 1 1 47 47 SER N N 15 122.396 0.172 . 1 . . . . . 47 S N . 27457 1
114 . 1 1 48 48 GLY C C 13 176.290 0.126 . 1 . . . . . 48 G C . 27457 1
115 . 1 1 48 48 GLY CA C 13 47.522 0.074 . 1 . . . . . 48 G CA . 27457 1
116 . 1 1 48 48 GLY N N 15 114.856 0.108 . 1 . . . . . 48 G N . 27457 1
117 . 1 1 49 49 LEU C C 13 178.989 0.138 . 1 . . . . . 49 L C . 27457 1
118 . 1 1 49 49 LEU CA C 13 55.687 0.122 . 1 . . . . . 49 L CA . 27457 1
119 . 1 1 49 49 LEU CB C 13 42.864 0.061 . 1 . . . . . 49 L CB . 27457 1
120 . 1 1 49 49 LEU CG C 13 27.056 0.027 . 1 . . . . . 49 L CG . 27457 1
121 . 1 1 49 49 LEU CD1 C 13 25.462 0.008 . 2 . . . . . 49 L CD1 . 27457 1
122 . 1 1 49 49 LEU CD2 C 13 22.213 0.065 . 2 . . . . . 49 L CD2 . 27457 1
123 . 1 1 49 49 LEU N N 15 118.572 0.352 . 1 . . . . . 49 L N . 27457 1
124 . 1 1 50 50 ILE C C 13 178.140 0.154 . 1 . . . . . 50 I C . 27457 1
125 . 1 1 50 50 ILE CA C 13 60.391 0.080 . 1 . . . . . 50 I CA . 27457 1
126 . 1 1 50 50 ILE CB C 13 34.796 0.019 . 1 . . . . . 50 I CB . 27457 1
127 . 1 1 50 50 ILE CG1 C 13 29.034 0.016 . 1 . . . . . 50 I CG1 . 27457 1
128 . 1 1 50 50 ILE CG2 C 13 17.410 0.090 . 1 . . . . . 50 I CG2 . 27457 1
129 . 1 1 50 50 ILE CD1 C 13 8.869 0.056 . 1 . . . . . 50 I CD1 . 27457 1
130 . 1 1 50 50 ILE N N 15 117.701 0.045 . 1 . . . . . 50 I N . 27457 1
131 . 1 1 51 51 TYR C C 13 177.175 0.093 . 1 . . . . . 51 Y C . 27457 1
132 . 1 1 51 51 TYR CA C 13 63.090 0.087 . 1 . . . . . 51 Y CA . 27457 1
133 . 1 1 51 51 TYR CB C 13 36.028 0.024 . 1 . . . . . 51 Y CB . 27457 1
134 . 1 1 51 51 TYR N N 15 121.303 0.103 . 1 . . . . . 51 Y N . 27457 1
135 . 1 1 52 52 GLU C C 13 179.579 0.056 . 1 . . . . . 52 E C . 27457 1
136 . 1 1 52 52 GLU CA C 13 59.173 0.053 . 1 . . . . . 52 E CA . 27457 1
137 . 1 1 52 52 GLU CB C 13 29.665 0.093 . 1 . . . . . 52 E CB . 27457 1
138 . 1 1 52 52 GLU CG C 13 36.350 0.097 . 1 . . . . . 52 E CG . 27457 1
139 . 1 1 52 52 GLU CD C 13 183.646 0.035 . 1 . . . . . 52 E CD . 27457 1
140 . 1 1 52 52 GLU N N 15 119.191 0.091 . 1 . . . . . 52 E N . 27457 1
141 . 1 1 53 53 GLU C C 13 179.634 0.112 . 1 . . . . . 53 E C . 27457 1
142 . 1 1 53 53 GLU CA C 13 59.142 0.041 . 1 . . . . . 53 E CA . 27457 1
143 . 1 1 53 53 GLU CB C 13 29.773 0.048 . 1 . . . . . 53 E CB . 27457 1
144 . 1 1 53 53 GLU CG C 13 35.035 0.036 . 1 . . . . . 53 E CG . 27457 1
145 . 1 1 53 53 GLU CD C 13 180.690 0.061 . 1 . . . . . 53 E CD . 27457 1
146 . 1 1 53 53 GLU N N 15 119.911 0.137 . 1 . . . . . 53 E N . 27457 1
147 . 1 1 54 54 THR C C 13 176.413 0.118 . 1 . . . . . 54 T C . 27457 1
148 . 1 1 54 54 THR CA C 13 67.913 0.077 . 1 . . . . . 54 T CA . 27457 1
149 . 1 1 54 54 THR CB C 13 68.019 0.041 . 1 . . . . . 54 T CB . 27457 1
150 . 1 1 54 54 THR CG2 C 13 21.634 0.069 . 1 . . . . . 54 T CG2 . 27457 1
151 . 1 1 54 54 THR N N 15 115.533 0.083 . 1 . . . . . 54 T N . 27457 1
152 . 1 1 55 55 ARG C C 13 177.876 0.072 . 1 . . . . . 55 R C . 27457 1
153 . 1 1 55 55 ARG CA C 13 61.778 0.081 . 1 . . . . . 55 R CA . 27457 1
154 . 1 1 55 55 ARG CB C 13 29.660 0.115 . 1 . . . . . 55 R CB . 27457 1
155 . 1 1 55 55 ARG CG C 13 31.644 0.219 . 1 . . . . . 55 R CG . 27457 1
156 . 1 1 55 55 ARG CD C 13 44.456 0.046 . 1 . . . . . 55 R CD . 27457 1
157 . 1 1 55 55 ARG CZ C 13 160.326 0.067 . 1 . . . . . 55 R CZ . 27457 1
158 . 1 1 55 55 ARG N N 15 121.808 0.145 . 1 . . . . . 55 R N . 27457 1
159 . 1 1 56 56 GLY C C 13 176.769 0.085 . 1 . . . . . 56 G C . 27457 1
160 . 1 1 56 56 GLY CA C 13 47.538 0.052 . 1 . . . . . 56 G CA . 27457 1
161 . 1 1 56 56 GLY N N 15 104.572 0.126 . 1 . . . . . 56 G N . 27457 1
162 . 1 1 57 57 VAL C C 13 178.827 0.107 . 1 . . . . . 57 V C . 27457 1
163 . 1 1 57 57 VAL CA C 13 65.964 0.108 . 1 . . . . . 57 V CA . 27457 1
164 . 1 1 57 57 VAL CB C 13 32.035 0.120 . 1 . . . . . 57 V CB . 27457 1
165 . 1 1 57 57 VAL CG2 C 13 22.748 0.048 . 2 . . . . . 57 V CG2 . 27457 1
166 . 1 1 57 57 VAL N N 15 121.584 0.092 . 1 . . . . . 57 V N . 27457 1
167 . 1 1 58 58 LEU C C 13 177.495 0.069 . 1 . . . . . 58 L C . 27457 1
168 . 1 1 58 58 LEU CA C 13 58.443 0.082 . 1 . . . . . 58 L CA . 27457 1
169 . 1 1 58 58 LEU CB C 13 41.820 0.030 . 1 . . . . . 58 L CB . 27457 1
170 . 1 1 58 58 LEU CG C 13 27.584 0.029 . 1 . . . . . 58 L CG . 27457 1
171 . 1 1 58 58 LEU N N 15 122.238 0.113 . 1 . . . . . 58 L N . 27457 1
172 . 1 1 59 59 LYS C C 13 177.710 0.000 . 1 . . . . . 59 K C . 27457 1
173 . 1 1 59 59 LYS CA C 13 56.573 0.000 . 1 . . . . . 59 K CA . 27457 1
174 . 1 1 59 59 LYS N N 15 118.288 0.000 . 1 . . . . . 59 K N . 27457 1
175 . 1 1 60 60 VAL C C 13 177.621 0.073 . 1 . . . . . 60 V C . 27457 1
176 . 1 1 60 60 VAL CA C 13 66.156 0.088 . 1 . . . . . 60 V CA . 27457 1
177 . 1 1 60 60 VAL CB C 13 32.182 0.040 . 1 . . . . . 60 V CB . 27457 1
178 . 1 1 60 60 VAL CG1 C 13 23.050 0.055 . 2 . . . . . 60 V CG1 . 27457 1
179 . 1 1 60 60 VAL CG2 C 13 21.345 0.059 . 2 . . . . . 60 V CG2 . 27457 1
180 . 1 1 60 60 VAL N N 15 117.366 0.170 . 1 . . . . . 60 V N . 27457 1
181 . 1 1 61 61 PHE CA C 13 61.838 0.145 . 1 . . . . . 61 F CA . 27457 1
182 . 1 1 61 61 PHE CB C 13 39.540 0.000 . 1 . . . . . 61 F CB . 27457 1
183 . 1 1 61 61 PHE N N 15 120.283 0.101 . 1 . . . . . 61 F N . 27457 1
184 . 1 1 62 62 LEU C C 13 179.143 0.086 . 1 . . . . . 62 L C . 27457 1
185 . 1 1 62 62 LEU CA C 13 55.722 0.094 . 1 . . . . . 62 L CA . 27457 1
186 . 1 1 62 62 LEU CB C 13 43.437 0.015 . 1 . . . . . 62 L CB . 27457 1
187 . 1 1 62 62 LEU N N 15 119.238 0.045 . 1 . . . . . 62 L N . 27457 1
188 . 1 1 63 63 GLU C C 13 178.068 0.054 . 1 . . . . . 63 E C . 27457 1
189 . 1 1 63 63 GLU CA C 13 60.422 0.079 . 1 . . . . . 63 E CA . 27457 1
190 . 1 1 63 63 GLU CB C 13 30.081 0.060 . 1 . . . . . 63 E CB . 27457 1
191 . 1 1 63 63 GLU CG C 13 37.182 0.068 . 1 . . . . . 63 E CG . 27457 1
192 . 1 1 63 63 GLU CD C 13 183.202 0.063 . 1 . . . . . 63 E CD . 27457 1
193 . 1 1 63 63 GLU N N 15 119.736 0.098 . 1 . . . . . 63 E N . 27457 1
194 . 1 1 64 64 ASN C C 13 178.261 0.061 . 1 . . . . . 64 N C . 27457 1
195 . 1 1 64 64 ASN CA C 13 55.761 0.058 . 1 . . . . . 64 N CA . 27457 1
196 . 1 1 64 64 ASN CB C 13 37.751 0.037 . 1 . . . . . 64 N CB . 27457 1
197 . 1 1 64 64 ASN CG C 13 176.483 0.057 . 1 . . . . . 64 N CG . 27457 1
198 . 1 1 64 64 ASN N N 15 115.665 0.129 . 1 . . . . . 64 N N . 27457 1
199 . 1 1 64 64 ASN ND2 N 15 113.274 0.016 . 1 . . . . . 64 N ND2 . 27457 1
200 . 1 1 65 65 VAL C C 13 177.690 0.086 . 1 . . . . . 65 V C . 27457 1
201 . 1 1 65 65 VAL CA C 13 66.147 0.060 . 1 . . . . . 65 V CA . 27457 1
202 . 1 1 65 65 VAL CB C 13 32.191 0.044 . 1 . . . . . 65 V CB . 27457 1
203 . 1 1 65 65 VAL CG2 C 13 22.745 0.018 . 2 . . . . . 65 V CG2 . 27457 1
204 . 1 1 65 65 VAL N N 15 119.015 0.089 . 1 . . . . . 65 V N . 27457 1
205 . 1 1 66 66 ILE C C 13 176.592 0.076 . 1 . . . . . 66 I C . 27457 1
206 . 1 1 66 66 ILE CA C 13 66.324 0.081 . 1 . . . . . 66 I CA . 27457 1
207 . 1 1 66 66 ILE CB C 13 37.021 0.029 . 1 . . . . . 66 I CB . 27457 1
208 . 1 1 66 66 ILE CG1 C 13 32.041 0.009 . 1 . . . . . 66 I CG1 . 27457 1
209 . 1 1 66 66 ILE CG2 C 13 18.165 0.051 . 1 . . . . . 66 I CG2 . 27457 1
210 . 1 1 66 66 ILE CD1 C 13 15.904 0.032 . 1 . . . . . 66 I CD1 . 27457 1
211 . 1 1 66 66 ILE N N 15 119.707 0.230 . 1 . . . . . 66 I N . 27457 1
212 . 1 1 67 67 ARG C C 13 179.246 0.089 . 1 . . . . . 67 R C . 27457 1
213 . 1 1 67 67 ARG CA C 13 59.855 0.118 . 1 . . . . . 67 R CA . 27457 1
214 . 1 1 67 67 ARG CB C 13 27.074 0.065 . 1 . . . . . 67 R CB . 27457 1
215 . 1 1 67 67 ARG CD C 13 42.727 0.000 . 1 . . . . . 67 R CD . 27457 1
216 . 1 1 67 67 ARG N N 15 119.807 0.132 . 1 . . . . . 67 R N . 27457 1
217 . 1 1 68 68 ASP C C 13 177.270 0.085 . 1 . . . . . 68 D C . 27457 1
218 . 1 1 68 68 ASP CA C 13 57.181 0.046 . 1 . . . . . 68 D CA . 27457 1
219 . 1 1 68 68 ASP CB C 13 40.258 0.061 . 1 . . . . . 68 D CB . 27457 1
220 . 1 1 68 68 ASP CG C 13 177.896 0.055 . 1 . . . . . 68 D CG . 27457 1
221 . 1 1 68 68 ASP N N 15 118.711 0.180 . 1 . . . . . 68 D N . 27457 1
222 . 1 1 69 69 ALA C C 13 179.074 0.195 . 1 . . . . . 69 A C . 27457 1
223 . 1 1 69 69 ALA CA C 13 56.084 0.128 . 1 . . . . . 69 A CA . 27457 1
224 . 1 1 69 69 ALA CB C 13 17.692 0.053 . 1 . . . . . 69 A CB . 27457 1
225 . 1 1 69 69 ALA N N 15 123.341 0.135 . 1 . . . . . 69 A N . 27457 1
226 . 1 1 70 70 VAL C C 13 178.096 0.079 . 1 . . . . . 70 V C . 27457 1
227 . 1 1 70 70 VAL CA C 13 65.203 0.107 . 1 . . . . . 70 V CA . 27457 1
228 . 1 1 70 70 VAL CB C 13 31.190 0.020 . 1 . . . . . 70 V CB . 27457 1
229 . 1 1 70 70 VAL CG2 C 13 23.637 0.091 . 2 . . . . . 70 V CG2 . 27457 1
230 . 1 1 70 70 VAL N N 15 114.010 0.224 . 1 . . . . . 70 V N . 27457 1
231 . 1 1 71 71 THR C C 13 177.927 0.104 . 1 . . . . . 71 T C . 27457 1
232 . 1 1 71 71 THR CA C 13 67.474 0.055 . 1 . . . . . 71 T CA . 27457 1
233 . 1 1 71 71 THR CB C 13 67.481 0.034 . 1 . . . . . 71 T CB . 27457 1
234 . 1 1 71 71 THR CG2 C 13 23.146 0.057 . 1 . . . . . 71 T CG2 . 27457 1
235 . 1 1 71 71 THR N N 15 120.969 0.160 . 1 . . . . . 71 T N . 27457 1
236 . 1 1 72 72 TYR C C 13 179.725 0.081 . 1 . . . . . 72 Y C . 27457 1
237 . 1 1 72 72 TYR CA C 13 64.567 0.145 . 1 . . . . . 72 Y CA . 27457 1
238 . 1 1 72 72 TYR CB C 13 36.916 0.045 . 1 . . . . . 72 Y CB . 27457 1
239 . 1 1 72 72 TYR N N 15 123.144 0.176 . 1 . . . . . 72 Y N . 27457 1
240 . 1 1 73 73 THR C C 13 176.740 0.101 . 1 . . . . . 73 T C . 27457 1
241 . 1 1 73 73 THR CA C 13 67.834 0.120 . 1 . . . . . 73 T CA . 27457 1
242 . 1 1 73 73 THR CB C 13 68.986 0.050 . 1 . . . . . 73 T CB . 27457 1
243 . 1 1 73 73 THR CG2 C 13 21.798 0.085 . 1 . . . . . 73 T CG2 . 27457 1
244 . 1 1 73 73 THR N N 15 121.215 0.140 . 1 . . . . . 73 T N . 27457 1
245 . 1 1 74 74 GLU C C 13 181.913 0.048 . 1 . . . . . 74 E C . 27457 1
246 . 1 1 74 74 GLU CA C 13 59.168 0.072 . 1 . . . . . 74 E CA . 27457 1
247 . 1 1 74 74 GLU CB C 13 30.153 0.000 . 1 . . . . . 74 E CB . 27457 1
248 . 1 1 74 74 GLU CG C 13 36.989 0.113 . 1 . . . . . 74 E CG . 27457 1
249 . 1 1 74 74 GLU N N 15 118.727 0.071 . 1 . . . . . 74 E N . 27457 1
250 . 1 1 75 75 HIS C C 13 177.896 0.120 . 1 . . . . . 75 H C . 27457 1
251 . 1 1 75 75 HIS CA C 13 60.723 0.065 . 1 . . . . . 75 H CA . 27457 1
252 . 1 1 75 75 HIS N N 15 123.867 0.122 . 1 . . . . . 75 H N . 27457 1
253 . 1 1 76 76 ALA C C 13 175.820 0.078 . 1 . . . . . 76 A C . 27457 1
254 . 1 1 76 76 ALA CA C 13 52.684 0.088 . 1 . . . . . 76 A CA . 27457 1
255 . 1 1 76 76 ALA CB C 13 20.030 0.037 . 1 . . . . . 76 A CB . 27457 1
256 . 1 1 76 76 ALA N N 15 119.631 0.042 . 1 . . . . . 76 A N . 27457 1
257 . 1 1 77 77 LYS C C 13 176.019 0.133 . 1 . . . . . 77 K C . 27457 1
258 . 1 1 77 77 LYS CA C 13 57.181 0.093 . 1 . . . . . 77 K CA . 27457 1
259 . 1 1 77 77 LYS CB C 13 29.854 0.025 . 1 . . . . . 77 K CB . 27457 1
260 . 1 1 77 77 LYS CG C 13 25.500 0.049 . 1 . . . . . 77 K CG . 27457 1
261 . 1 1 77 77 LYS CE C 13 42.187 0.000 . 1 . . . . . 77 K CE . 27457 1
262 . 1 1 77 77 LYS N N 15 113.309 0.126 . 1 . . . . . 77 K N . 27457 1
263 . 1 1 78 78 ARG C C 13 176.094 0.074 . 1 . . . . . 78 R C . 27457 1
264 . 1 1 78 78 ARG CA C 13 55.526 0.091 . 1 . . . . . 78 R CA . 27457 1
265 . 1 1 78 78 ARG CB C 13 32.953 0.025 . 1 . . . . . 78 R CB . 27457 1
266 . 1 1 78 78 ARG CD C 13 43.570 0.057 . 1 . . . . . 78 R CD . 27457 1
267 . 1 1 78 78 ARG CZ C 13 159.755 0.000 . 1 . . . . . 78 R CZ . 27457 1
268 . 1 1 78 78 ARG N N 15 117.418 0.221 . 1 . . . . . 78 R N . 27457 1
269 . 1 1 79 79 LYS C C 13 174.147 0.089 . 1 . . . . . 79 K C . 27457 1
270 . 1 1 79 79 LYS CA C 13 54.778 0.135 . 1 . . . . . 79 K CA . 27457 1
271 . 1 1 79 79 LYS CB C 13 33.699 0.076 . 1 . . . . . 79 K CB . 27457 1
272 . 1 1 79 79 LYS CG C 13 24.448 0.000 . 1 . . . . . 79 K CG . 27457 1
273 . 1 1 79 79 LYS N N 15 117.467 0.159 . 1 . . . . . 79 K N . 27457 1
274 . 1 1 80 80 THR C C 13 172.681 0.071 . 1 . . . . . 80 T C . 27457 1
275 . 1 1 80 80 THR CA C 13 60.590 0.065 . 1 . . . . . 80 T CA . 27457 1
276 . 1 1 80 80 THR CB C 13 70.559 0.076 . 1 . . . . . 80 T CB . 27457 1
277 . 1 1 80 80 THR CG2 C 13 20.285 0.019 . 1 . . . . . 80 T CG2 . 27457 1
278 . 1 1 80 80 THR N N 15 116.444 0.058 . 1 . . . . . 80 T N . 27457 1
279 . 1 1 81 81 VAL C C 13 176.500 0.100 . 1 . . . . . 81 V C . 27457 1
280 . 1 1 81 81 VAL CA C 13 61.679 0.102 . 1 . . . . . 81 V CA . 27457 1
281 . 1 1 81 81 VAL CB C 13 31.991 0.060 . 1 . . . . . 81 V CB . 27457 1
282 . 1 1 81 81 VAL CG1 C 13 20.950 0.043 . 2 . . . . . 81 V CG1 . 27457 1
283 . 1 1 81 81 VAL CG2 C 13 21.509 0.058 . 2 . . . . . 81 V CG2 . 27457 1
284 . 1 1 81 81 VAL N N 15 127.531 0.054 . 1 . . . . . 81 V N . 27457 1
285 . 1 1 82 82 THR C C 13 176.529 0.078 . 1 . . . . . 82 T C . 27457 1
286 . 1 1 82 82 THR CA C 13 59.244 0.121 . 1 . . . . . 82 T CA . 27457 1
287 . 1 1 82 82 THR CB C 13 71.785 0.054 . 1 . . . . . 82 T CB . 27457 1
288 . 1 1 82 82 THR CG2 C 13 21.518 0.022 . 1 . . . . . 82 T CG2 . 27457 1
289 . 1 1 82 82 THR N N 15 118.980 0.131 . 1 . . . . . 82 T N . 27457 1
290 . 1 1 83 83 ALA C C 13 179.438 0.109 . 1 . . . . . 83 A C . 27457 1
291 . 1 1 83 83 ALA CA C 13 56.133 0.075 . 1 . . . . . 83 A CA . 27457 1
292 . 1 1 83 83 ALA CB C 13 17.054 0.037 . 1 . . . . . 83 A CB . 27457 1
293 . 1 1 83 83 ALA N N 15 122.202 0.100 . 1 . . . . . 83 A N . 27457 1
294 . 1 1 84 84 MET C C 13 176.843 0.131 . 1 . . . . . 84 M C . 27457 1
295 . 1 1 84 84 MET CA C 13 56.312 0.092 . 1 . . . . . 84 M CA . 27457 1
296 . 1 1 84 84 MET CB C 13 29.683 0.043 . 1 . . . . . 84 M CB . 27457 1
297 . 1 1 84 84 MET N N 15 113.459 0.171 . 1 . . . . . 84 M N . 27457 1
298 . 1 1 85 85 ASP C C 13 178.443 0.082 . 1 . . . . . 85 D C . 27457 1
299 . 1 1 85 85 ASP CA C 13 58.353 0.087 . 1 . . . . . 85 D CA . 27457 1
300 . 1 1 85 85 ASP CB C 13 40.630 0.045 . 1 . . . . . 85 D CB . 27457 1
301 . 1 1 85 85 ASP CG C 13 180.512 0.026 . 1 . . . . . 85 D CG . 27457 1
302 . 1 1 85 85 ASP N N 15 120.476 0.056 . 1 . . . . . 85 D N . 27457 1
303 . 1 1 86 86 VAL C C 13 177.268 0.126 . 1 . . . . . 86 V C . 27457 1
304 . 1 1 86 86 VAL CA C 13 67.036 0.070 . 1 . . . . . 86 V CA . 27457 1
305 . 1 1 86 86 VAL CB C 13 31.578 0.044 . 1 . . . . . 86 V CB . 27457 1
306 . 1 1 86 86 VAL CG1 C 13 21.325 0.050 . 2 . . . . . 86 V CG1 . 27457 1
307 . 1 1 86 86 VAL CG2 C 13 22.071 0.013 . 2 . . . . . 86 V CG2 . 27457 1
308 . 1 1 86 86 VAL N N 15 117.150 0.186 . 1 . . . . . 86 V N . 27457 1
309 . 1 1 87 87 VAL C C 13 180.445 0.109 . 1 . . . . . 87 V C . 27457 1
310 . 1 1 87 87 VAL CA C 13 67.699 0.110 . 1 . . . . . 87 V CA . 27457 1
311 . 1 1 87 87 VAL CB C 13 32.146 0.063 . 1 . . . . . 87 V CB . 27457 1
312 . 1 1 87 87 VAL CG1 C 13 21.476 0.067 . 2 . . . . . 87 V CG1 . 27457 1
313 . 1 1 87 87 VAL CG2 C 13 23.703 0.076 . 2 . . . . . 87 V CG2 . 27457 1
314 . 1 1 87 87 VAL N N 15 122.098 0.149 . 1 . . . . . 87 V N . 27457 1
315 . 1 1 88 88 TYR C C 13 179.699 0.079 . 1 . . . . . 88 Y C . 27457 1
316 . 1 1 88 88 TYR CA C 13 59.627 0.168 . 1 . . . . . 88 Y CA . 27457 1
317 . 1 1 88 88 TYR N N 15 121.493 0.123 . 1 . . . . . 88 Y N . 27457 1
318 . 1 1 89 89 ALA C C 13 179.767 0.091 . 1 . . . . . 89 A C . 27457 1
319 . 1 1 89 89 ALA CA C 13 55.877 0.096 . 1 . . . . . 89 A CA . 27457 1
320 . 1 1 89 89 ALA CB C 13 20.119 0.031 . 1 . . . . . 89 A CB . 27457 1
321 . 1 1 89 89 ALA N N 15 124.736 0.048 . 1 . . . . . 89 A N . 27457 1
322 . 1 1 90 90 LEU C C 13 178.173 0.074 . 1 . . . . . 90 L C . 27457 1
323 . 1 1 90 90 LEU CA C 13 58.023 0.118 . 1 . . . . . 90 L CA . 27457 1
324 . 1 1 90 90 LEU CB C 13 42.771 0.015 . 1 . . . . . 90 L CB . 27457 1
325 . 1 1 90 90 LEU CG C 13 27.012 0.154 . 1 . . . . . 90 L CG . 27457 1
326 . 1 1 90 90 LEU N N 15 119.204 0.179 . 1 . . . . . 90 L N . 27457 1
327 . 1 1 91 91 LYS C C 13 181.559 0.074 . 1 . . . . . 91 K C . 27457 1
328 . 1 1 91 91 LYS CA C 13 59.815 0.069 . 1 . . . . . 91 K CA . 27457 1
329 . 1 1 91 91 LYS CB C 13 32.521 0.069 . 1 . . . . . 91 K CB . 27457 1
330 . 1 1 91 91 LYS CG C 13 24.855 0.014 . 1 . . . . . 91 K CG . 27457 1
331 . 1 1 91 91 LYS N N 15 120.932 0.252 . 1 . . . . . 91 K N . 27457 1
332 . 1 1 92 92 ARG C C 13 178.013 0.100 . 1 . . . . . 92 R C . 27457 1
333 . 1 1 92 92 ARG CA C 13 58.596 0.017 . 1 . . . . . 92 R CA . 27457 1
334 . 1 1 92 92 ARG CB C 13 26.926 0.000 . 1 . . . . . 92 R CB . 27457 1
335 . 1 1 92 92 ARG N N 15 120.041 0.299 . 1 . . . . . 92 R N . 27457 1
336 . 1 1 93 93 GLN C C 13 175.987 0.090 . 1 . . . . . 93 Q C . 27457 1
337 . 1 1 93 93 GLN CA C 13 55.284 0.094 . 1 . . . . . 93 Q CA . 27457 1
338 . 1 1 93 93 GLN CB C 13 28.503 0.040 . 1 . . . . . 93 Q CB . 27457 1
339 . 1 1 93 93 GLN CG C 13 33.882 0.041 . 1 . . . . . 93 Q CG . 27457 1
340 . 1 1 93 93 GLN N N 15 115.942 0.071 . 1 . . . . . 93 Q N . 27457 1
341 . 1 1 94 94 GLY C C 13 174.910 0.103 . 1 . . . . . 94 G C . 27457 1
342 . 1 1 94 94 GLY CA C 13 46.337 0.077 . 1 . . . . . 94 G CA . 27457 1
343 . 1 1 94 94 GLY N N 15 107.854 0.116 . 1 . . . . . 94 G N . 27457 1
344 . 1 1 95 95 ARG C C 13 174.608 0.115 . 1 . . . . . 95 R C . 27457 1
345 . 1 1 95 95 ARG CA C 13 53.740 0.067 . 1 . . . . . 95 R CA . 27457 1
346 . 1 1 95 95 ARG CB C 13 30.457 0.066 . 1 . . . . . 95 R CB . 27457 1
347 . 1 1 95 95 ARG CG C 13 27.158 0.083 . 1 . . . . . 95 R CG . 27457 1
348 . 1 1 95 95 ARG CD C 13 43.339 0.000 . 1 . . . . . 95 R CD . 27457 1
349 . 1 1 95 95 ARG N N 15 121.779 0.081 . 1 . . . . . 95 R N . 27457 1
350 . 1 1 96 96 THR C C 13 172.543 0.084 . 1 . . . . . 96 T C . 27457 1
351 . 1 1 96 96 THR CA C 13 64.203 0.063 . 1 . . . . . 96 T CA . 27457 1
352 . 1 1 96 96 THR CB C 13 69.780 0.087 . 1 . . . . . 96 T CB . 27457 1
353 . 1 1 96 96 THR CG2 C 13 22.807 0.034 . 1 . . . . . 96 T CG2 . 27457 1
354 . 1 1 96 96 THR N N 15 117.910 0.057 . 1 . . . . . 96 T N . 27457 1
355 . 1 1 97 97 LEU C C 13 176.154 0.114 . 1 . . . . . 97 L C . 27457 1
356 . 1 1 97 97 LEU CA C 13 53.443 0.117 . 1 . . . . . 97 L CA . 27457 1
357 . 1 1 97 97 LEU CB C 13 45.731 0.072 . 1 . . . . . 97 L CB . 27457 1
358 . 1 1 97 97 LEU CG C 13 27.704 0.030 . 1 . . . . . 97 L CG . 27457 1
359 . 1 1 97 97 LEU CD1 C 13 26.880 0.000 . 2 . . . . . 97 L CD1 . 27457 1
360 . 1 1 97 97 LEU CD2 C 13 23.743 0.030 . 2 . . . . . 97 L CD2 . 27457 1
361 . 1 1 97 97 LEU N N 15 130.495 0.340 . 1 . . . . . 97 L N . 27457 1
362 . 1 1 98 98 TYR C C 13 174.427 0.000 . 1 . . . . . 98 Y C . 27457 1
363 . 1 1 98 98 TYR CA C 13 53.261 0.047 . 1 . . . . . 98 Y CA . 27457 1
364 . 1 1 98 98 TYR CB C 13 40.201 0.000 . 1 . . . . . 98 Y CB . 27457 1
365 . 1 1 98 98 TYR N N 15 127.322 0.015 . 1 . . . . . 98 Y N . 27457 1
366 . 1 1 99 99 GLY C C 13 173.897 0.101 . 1 . . . . . 99 G C . 27457 1
367 . 1 1 99 99 GLY CA C 13 44.794 0.084 . 1 . . . . . 99 G CA . 27457 1
368 . 1 1 99 99 GLY N N 15 108.406 0.059 . 1 . . . . . 99 G N . 27457 1
369 . 1 1 100 100 PHE CA C 13 51.865 0.000 . 1 . . . . . 100 F CA . 27457 1
370 . 1 1 100 100 PHE N N 15 114.484 0.106 . 1 . . . . . 100 F N . 27457 1
371 . 1 1 101 101 GLY CA C 13 46.398 0.000 . 1 . . . . . 101 G CA . 27457 1
372 . 1 1 101 101 GLY N N 15 114.350 0.000 . 1 . . . . . 101 G N . 27457 1
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