Content for NMR-STAR saveframe, "assigned_chem_shift_list_2"
save_assigned_chem_shift_list_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2
_Assigned_chem_shift_list.Entry_ID 27095
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name .
_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 1H-15N HSQC' . . . 27095 2
2 '3D HNCACB' . . . 27095 2
3 '3D CBCA(CO)NH' . . . 27095 2
4 '3D HNCO' . . . 27095 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
3 $Analysis . . 27095 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 . 3 . 2 2 2 PRO C C 13 177.520 0.000 . 1 . . . . . -3 PRO C . 27095 2
2 . 3 . 2 2 2 PRO CA C 13 63.529 0.017 . 1 . . . . . -3 PRO CA . 27095 2
3 . 3 . 2 2 2 PRO CB C 13 32.249 0.038 . 1 . . . . . -3 PRO CB . 27095 2
4 . 3 . 2 2 2 PRO CD C 13 49.660 0.015 . 1 . . . . . -3 PRO CD . 27095 2
5 . 3 . 2 2 2 PRO CG C 13 27.152 0.040 . 1 . . . . . -3 PRO CG . 27095 2
6 . 3 . 2 2 2 PRO HA H 1 4.472 0.002 . 1 . . . . . -3 PRO HA . 27095 2
7 . 3 . 2 2 2 PRO HB2 H 1 1.988 0.002 . 2 . . . . . -3 PRO HB2 . 27095 2
8 . 3 . 2 2 2 PRO HB3 H 1 2.311 0.003 . 2 . . . . . -3 PRO HB3 . 27095 2
9 . 3 . 2 2 2 PRO HD2 H 1 3.568 0.005 . 2 . . . . . -3 PRO HD2 . 27095 2
10 . 3 . 2 2 2 PRO HD3 H 1 3.606 0.004 . 2 . . . . . -3 PRO HD3 . 27095 2
11 . 3 . 2 2 2 PRO HG2 H 1 2.032 0.001 . 1 . . . . . -3 PRO HG2 . 27095 2
12 . 3 . 2 3 3 GLY C C 13 174.479 0.000 . 1 . . . . . -2 GLY C . 27095 2
13 . 3 . 2 3 3 GLY CA C 13 45.360 0.066 . 1 . . . . . -2 GLY CA . 27095 2
14 . 3 . 2 3 3 GLY HA2 H 1 3.986 0.004 . 1 . . . . . -2 GLY HA2 . 27095 2
15 . 3 . 2 4 4 SER C C 13 175.135 0.021 . 1 . . . . . -1 SER C . 27095 2
16 . 3 . 2 4 4 SER CA C 13 58.812 0.081 . 1 . . . . . -1 SER CA . 27095 2
17 . 3 . 2 4 4 SER CB C 13 63.628 0.091 . 1 . . . . . -1 SER CB . 27095 2
18 . 3 . 2 4 4 SER H H 1 8.179 0.003 . 1 . . . . . -1 SER H . 27095 2
19 . 3 . 2 4 4 SER HA H 1 4.387 0.002 . 1 . . . . . -1 SER HA . 27095 2
20 . 3 . 2 4 4 SER HB2 H 1 3.877 0.004 . 2 . . . . . -1 SER HB2 . 27095 2
21 . 3 . 2 4 4 SER HB3 H 1 3.939 0.004 . 2 . . . . . -1 SER HB3 . 27095 2
22 . 3 . 2 4 4 SER N N 15 115.924 0.008 . 1 . . . . . -1 SER N . 27095 2
23 . 3 . 2 5 5 LYS C C 13 177.125 0.011 . 1 . . . . . 1901 LYS C . 27095 2
24 . 3 . 2 5 5 LYS CA C 13 57.287 0.120 . 1 . . . . . 1901 LYS CA . 27095 2
25 . 3 . 2 5 5 LYS CB C 13 32.541 0.045 . 1 . . . . . 1901 LYS CB . 27095 2
26 . 3 . 2 5 5 LYS CD C 13 28.945 0.000 . 1 . . . . . 1901 LYS CD . 27095 2
27 . 3 . 2 5 5 LYS CG C 13 24.696 0.000 . 1 . . . . . 1901 LYS CG . 27095 2
28 . 3 . 2 5 5 LYS H H 1 8.456 0.003 . 1 . . . . . 1901 LYS H . 27095 2
29 . 3 . 2 5 5 LYS HA H 1 4.268 0.001 . 1 . . . . . 1901 LYS HA . 27095 2
30 . 3 . 2 5 5 LYS HB2 H 1 1.835 0.000 . 1 . . . . . 1901 LYS HB2 . 27095 2
31 . 3 . 2 5 5 LYS HD2 H 1 1.668 0.000 . 1 . . . . . 1901 LYS HD2 . 27095 2
32 . 3 . 2 5 5 LYS HE2 H 1 2.978 0.005 . 1 . . . . . 1901 LYS HE2 . 27095 2
33 . 3 . 2 5 5 LYS HG2 H 1 1.423 0.000 . 1 . . . . . 1901 LYS HG2 . 27095 2
34 . 3 . 2 5 5 LYS N N 15 124.096 0.019 . 1 . . . . . 1901 LYS N . 27095 2
35 . 3 . 2 6 6 ARG C C 13 177.560 0.003 . 1 . . . . . 1902 ARG C . 27095 2
36 . 3 . 2 6 6 ARG CA C 13 57.229 0.086 . 1 . . . . . 1902 ARG CA . 27095 2
37 . 3 . 2 6 6 ARG CB C 13 30.401 0.041 . 1 . . . . . 1902 ARG CB . 27095 2
38 . 3 . 2 6 6 ARG CD C 13 43.141 0.056 . 1 . . . . . 1902 ARG CD . 27095 2
39 . 3 . 2 6 6 ARG CG C 13 27.126 0.031 . 1 . . . . . 1902 ARG CG . 27095 2
40 . 3 . 2 6 6 ARG H H 1 8.189 0.002 . 1 . . . . . 1902 ARG H . 27095 2
41 . 3 . 2 6 6 ARG HA H 1 4.279 0.004 . 1 . . . . . 1902 ARG HA . 27095 2
42 . 3 . 2 6 6 ARG HB2 H 1 1.806 0.005 . 1 . . . . . 1902 ARG HB2 . 27095 2
43 . 3 . 2 6 6 ARG HD2 H 1 3.213 0.003 . 1 . . . . . 1902 ARG HD2 . 27095 2
44 . 3 . 2 6 6 ARG HG2 H 1 1.679 0.003 . 1 . . . . . 1902 ARG HG2 . 27095 2
45 . 3 . 2 6 6 ARG N N 15 120.715 0.024 . 1 . . . . . 1902 ARG N . 27095 2
46 . 3 . 2 7 7 LYS C C 13 177.822 0.026 . 1 . . . . . 1903 LYS C . 27095 2
47 . 3 . 2 7 7 LYS CA C 13 57.732 0.065 . 1 . . . . . 1903 LYS CA . 27095 2
48 . 3 . 2 7 7 LYS CB C 13 32.348 0.040 . 1 . . . . . 1903 LYS CB . 27095 2
49 . 3 . 2 7 7 LYS CD C 13 28.900 0.000 . 1 . . . . . 1903 LYS CD . 27095 2
50 . 3 . 2 7 7 LYS CG C 13 24.879 0.000 . 1 . . . . . 1903 LYS CG . 27095 2
51 . 3 . 2 7 7 LYS H H 1 8.292 0.004 . 1 . . . . . 1903 LYS H . 27095 2
52 . 3 . 2 7 7 LYS HA H 1 4.235 0.003 . 1 . . . . . 1903 LYS HA . 27095 2
53 . 3 . 2 7 7 LYS HB2 H 1 1.943 0.003 . 1 . . . . . 1903 LYS HB2 . 27095 2
54 . 3 . 2 7 7 LYS HE2 H 1 2.969 0.001 . 1 . . . . . 1903 LYS HE2 . 27095 2
55 . 3 . 2 7 7 LYS N N 15 121.311 0.030 . 1 . . . . . 1903 LYS N . 27095 2
56 . 3 . 2 8 8 GLN C C 13 178.816 0.011 . 1 . . . . . 1904 GLN C . 27095 2
57 . 3 . 2 8 8 GLN CA C 13 58.255 0.131 . 1 . . . . . 1904 GLN CA . 27095 2
58 . 3 . 2 8 8 GLN CB C 13 28.588 0.072 . 1 . . . . . 1904 GLN CB . 27095 2
59 . 3 . 2 8 8 GLN CG C 13 33.903 0.039 . 1 . . . . . 1904 GLN CG . 27095 2
60 . 3 . 2 8 8 GLN H H 1 8.347 0.006 . 1 . . . . . 1904 GLN H . 27095 2
61 . 3 . 2 8 8 GLN HA H 1 4.041 0.003 . 1 . . . . . 1904 GLN HA . 27095 2
62 . 3 . 2 8 8 GLN HB2 H 1 2.068 0.006 . 1 . . . . . 1904 GLN HB2 . 27095 2
63 . 3 . 2 8 8 GLN HG2 H 1 2.276 0.001 . 1 . . . . . 1904 GLN HG2 . 27095 2
64 . 3 . 2 8 8 GLN N N 15 119.967 0.034 . 1 . . . . . 1904 GLN N . 27095 2
65 . 3 . 2 9 9 GLU C C 13 177.589 0.050 . 1 . . . . . 1905 GLU C . 27095 2
66 . 3 . 2 9 9 GLU CA C 13 60.468 0.071 . 1 . . . . . 1905 GLU CA . 27095 2
67 . 3 . 2 9 9 GLU CB C 13 29.184 0.084 . 1 . . . . . 1905 GLU CB . 27095 2
68 . 3 . 2 9 9 GLU CG C 13 37.277 0.025 . 1 . . . . . 1905 GLU CG . 27095 2
69 . 3 . 2 9 9 GLU H H 1 8.876 0.009 . 1 . . . . . 1905 GLU H . 27095 2
70 . 3 . 2 9 9 GLU HA H 1 3.669 0.005 . 1 . . . . . 1905 GLU HA . 27095 2
71 . 3 . 2 9 9 GLU HB2 H 1 2.040 0.006 . 2 . . . . . 1905 GLU HB2 . 27095 2
72 . 3 . 2 9 9 GLU HB3 H 1 2.216 0.001 . 2 . . . . . 1905 GLU HB3 . 27095 2
73 . 3 . 2 9 9 GLU HG2 H 1 2.045 0.002 . 2 . . . . . 1905 GLU HG2 . 27095 2
74 . 3 . 2 9 9 GLU HG3 H 1 2.245 0.004 . 2 . . . . . 1905 GLU HG3 . 27095 2
75 . 3 . 2 9 9 GLU N N 15 120.732 0.022 . 1 . . . . . 1905 GLU N . 27095 2
76 . 3 . 2 10 10 GLU C C 13 177.444 0.007 . 1 . . . . . 1906 GLU C . 27095 2
77 . 3 . 2 10 10 GLU CA C 13 60.518 0.046 . 1 . . . . . 1906 GLU CA . 27095 2
78 . 3 . 2 10 10 GLU CB C 13 29.824 0.068 . 1 . . . . . 1906 GLU CB . 27095 2
79 . 3 . 2 10 10 GLU CG C 13 36.702 0.000 . 1 . . . . . 1906 GLU CG . 27095 2
80 . 3 . 2 10 10 GLU H H 1 7.934 0.005 . 1 . . . . . 1906 GLU H . 27095 2
81 . 3 . 2 10 10 GLU HA H 1 3.947 0.002 . 1 . . . . . 1906 GLU HA . 27095 2
82 . 3 . 2 10 10 GLU HB2 H 1 2.205 0.000 . 1 . . . . . 1906 GLU HB2 . 27095 2
83 . 3 . 2 10 10 GLU HG2 H 1 2.291 0.000 . 1 . . . . . 1906 GLU HG2 . 27095 2
84 . 3 . 2 10 10 GLU N N 15 119.109 0.051 . 1 . . . . . 1906 GLU N . 27095 2
85 . 3 . 2 11 11 VAL C C 13 178.674 0.015 . 1 . . . . . 1907 VAL C . 27095 2
86 . 3 . 2 11 11 VAL CA C 13 66.214 0.059 . 1 . . . . . 1907 VAL CA . 27095 2
87 . 3 . 2 11 11 VAL CB C 13 31.996 0.088 . 1 . . . . . 1907 VAL CB . 27095 2
88 . 3 . 2 11 11 VAL CG1 C 13 21.167 0.026 . 2 . . . . . 1907 VAL CG1 . 27095 2
89 . 3 . 2 11 11 VAL CG2 C 13 22.464 0.034 . 2 . . . . . 1907 VAL CG2 . 27095 2
90 . 3 . 2 11 11 VAL H H 1 7.814 0.007 . 1 . . . . . 1907 VAL H . 27095 2
91 . 3 . 2 11 11 VAL HA H 1 3.598 0.005 . 1 . . . . . 1907 VAL HA . 27095 2
92 . 3 . 2 11 11 VAL HB H 1 2.109 0.006 . 1 . . . . . 1907 VAL HB . 27095 2
93 . 3 . 2 11 11 VAL HG11 H 1 0.955 0.003 . 2 . . . . . 1907 VAL HG11 . 27095 2
94 . 3 . 2 11 11 VAL HG12 H 1 0.955 0.003 . 2 . . . . . 1907 VAL HG12 . 27095 2
95 . 3 . 2 11 11 VAL HG13 H 1 0.955 0.003 . 2 . . . . . 1907 VAL HG13 . 27095 2
96 . 3 . 2 11 11 VAL HG21 H 1 1.034 0.004 . 2 . . . . . 1907 VAL HG21 . 27095 2
97 . 3 . 2 11 11 VAL HG22 H 1 1.034 0.004 . 2 . . . . . 1907 VAL HG22 . 27095 2
98 . 3 . 2 11 11 VAL HG23 H 1 1.034 0.004 . 2 . . . . . 1907 VAL HG23 . 27095 2
99 . 3 . 2 11 11 VAL N N 15 116.473 0.026 . 1 . . . . . 1907 VAL N . 27095 2
100 . 3 . 2 12 12 SER C C 13 174.794 0.042 . 1 . . . . . 1908 SER C . 27095 2
101 . 3 . 2 12 12 SER CA C 13 63.040 0.102 . 1 . . . . . 1908 SER CA . 27095 2
102 . 3 . 2 12 12 SER H H 1 7.973 0.003 . 1 . . . . . 1908 SER H . 27095 2
103 . 3 . 2 12 12 SER HA H 1 4.091 0.002 . 1 . . . . . 1908 SER HA . 27095 2
104 . 3 . 2 12 12 SER HB2 H 1 3.862 0.005 . 2 . . . . . 1908 SER HB2 . 27095 2
105 . 3 . 2 12 12 SER HB3 H 1 4.015 0.004 . 2 . . . . . 1908 SER HB3 . 27095 2
106 . 3 . 2 12 12 SER N N 15 115.895 0.045 . 1 . . . . . 1908 SER N . 27095 2
107 . 3 . 2 13 13 ALA C C 13 178.016 0.039 . 1 . . . . . 1909 ALA C . 27095 2
108 . 3 . 2 13 13 ALA CA C 13 56.155 0.098 . 1 . . . . . 1909 ALA CA . 27095 2
109 . 3 . 2 13 13 ALA CB C 13 17.715 0.083 . 1 . . . . . 1909 ALA CB . 27095 2
110 . 3 . 2 13 13 ALA H H 1 8.348 0.006 . 1 . . . . . 1909 ALA H . 27095 2
111 . 3 . 2 13 13 ALA HA H 1 3.586 0.005 . 1 . . . . . 1909 ALA HA . 27095 2
112 . 3 . 2 13 13 ALA HB1 H 1 1.278 0.003 . 1 . . . . . 1909 ALA HB1 . 27095 2
113 . 3 . 2 13 13 ALA HB2 H 1 1.278 0.003 . 1 . . . . . 1909 ALA HB2 . 27095 2
114 . 3 . 2 13 13 ALA HB3 H 1 1.278 0.003 . 1 . . . . . 1909 ALA HB3 . 27095 2
115 . 3 . 2 13 13 ALA N N 15 123.361 0.009 . 1 . . . . . 1909 ALA N . 27095 2
116 . 3 . 2 14 14 ILE C C 13 178.151 0.004 . 1 . . . . . 1910 ILE C . 27095 2
117 . 3 . 2 14 14 ILE CA C 13 65.074 0.058 . 1 . . . . . 1910 ILE CA . 27095 2
118 . 3 . 2 14 14 ILE CB C 13 38.163 0.022 . 1 . . . . . 1910 ILE CB . 27095 2
119 . 3 . 2 14 14 ILE CD1 C 13 13.893 0.078 . 1 . . . . . 1910 ILE CD1 . 27095 2
120 . 3 . 2 14 14 ILE CG1 C 13 31.031 0.036 . 1 . . . . . 1910 ILE CG1 . 27095 2
121 . 3 . 2 14 14 ILE CG2 C 13 16.900 0.056 . 1 . . . . . 1910 ILE CG2 . 27095 2
122 . 3 . 2 14 14 ILE H H 1 7.676 0.005 . 1 . . . . . 1910 ILE H . 27095 2
123 . 3 . 2 14 14 ILE HA H 1 4.315 0.004 . 1 . . . . . 1910 ILE HA . 27095 2
124 . 3 . 2 14 14 ILE HB H 1 1.867 0.006 . 1 . . . . . 1910 ILE HB . 27095 2
125 . 3 . 2 14 14 ILE HD11 H 1 0.868 0.007 . 1 . . . . . 1910 ILE HD11 . 27095 2
126 . 3 . 2 14 14 ILE HD12 H 1 0.868 0.007 . 1 . . . . . 1910 ILE HD12 . 27095 2
127 . 3 . 2 14 14 ILE HD13 H 1 0.868 0.007 . 1 . . . . . 1910 ILE HD13 . 27095 2
128 . 3 . 2 14 14 ILE HG12 H 1 0.901 0.004 . 2 . . . . . 1910 ILE HG12 . 27095 2
129 . 3 . 2 14 14 ILE HG13 H 1 2.074 0.008 . 2 . . . . . 1910 ILE HG13 . 27095 2
130 . 3 . 2 14 14 ILE HG21 H 1 0.824 0.004 . 1 . . . . . 1910 ILE HG21 . 27095 2
131 . 3 . 2 14 14 ILE HG22 H 1 0.824 0.004 . 1 . . . . . 1910 ILE HG22 . 27095 2
132 . 3 . 2 14 14 ILE HG23 H 1 0.824 0.004 . 1 . . . . . 1910 ILE HG23 . 27095 2
133 . 3 . 2 14 14 ILE N N 15 117.173 0.017 . 1 . . . . . 1910 ILE N . 27095 2
134 . 3 . 2 15 15 ILE C C 13 179.245 0.022 . 1 . . . . . 1911 ILE C . 27095 2
135 . 3 . 2 15 15 ILE CA C 13 65.554 0.038 . 1 . . . . . 1911 ILE CA . 27095 2
136 . 3 . 2 15 15 ILE CB C 13 38.124 0.042 . 1 . . . . . 1911 ILE CB . 27095 2
137 . 3 . 2 15 15 ILE CD1 C 13 14.034 0.034 . 1 . . . . . 1911 ILE CD1 . 27095 2
138 . 3 . 2 15 15 ILE CG1 C 13 29.431 0.088 . 1 . . . . . 1911 ILE CG1 . 27095 2
139 . 3 . 2 15 15 ILE CG2 C 13 17.660 0.051 . 1 . . . . . 1911 ILE CG2 . 27095 2
140 . 3 . 2 15 15 ILE H H 1 7.671 0.003 . 1 . . . . . 1911 ILE H . 27095 2
141 . 3 . 2 15 15 ILE HA H 1 3.540 0.003 . 1 . . . . . 1911 ILE HA . 27095 2
142 . 3 . 2 15 15 ILE HB H 1 1.938 0.006 . 1 . . . . . 1911 ILE HB . 27095 2
143 . 3 . 2 15 15 ILE HD11 H 1 0.823 0.004 . 1 . . . . . 1911 ILE HD11 . 27095 2
144 . 3 . 2 15 15 ILE HD12 H 1 0.823 0.004 . 1 . . . . . 1911 ILE HD12 . 27095 2
145 . 3 . 2 15 15 ILE HD13 H 1 0.823 0.004 . 1 . . . . . 1911 ILE HD13 . 27095 2
146 . 3 . 2 15 15 ILE HG12 H 1 1.078 0.005 . 2 . . . . . 1911 ILE HG12 . 27095 2
147 . 3 . 2 15 15 ILE HG13 H 1 1.802 0.006 . 2 . . . . . 1911 ILE HG13 . 27095 2
148 . 3 . 2 15 15 ILE HG21 H 1 0.749 0.004 . 1 . . . . . 1911 ILE HG21 . 27095 2
149 . 3 . 2 15 15 ILE HG22 H 1 0.749 0.004 . 1 . . . . . 1911 ILE HG22 . 27095 2
150 . 3 . 2 15 15 ILE HG23 H 1 0.749 0.004 . 1 . . . . . 1911 ILE HG23 . 27095 2
151 . 3 . 2 15 15 ILE N N 15 119.870 0.051 . 1 . . . . . 1911 ILE N . 27095 2
152 . 3 . 2 16 16 ILE C C 13 177.240 0.020 . 1 . . . . . 1912 ILE C . 27095 2
153 . 3 . 2 16 16 ILE CA C 13 66.208 0.043 . 1 . . . . . 1912 ILE CA . 27095 2
154 . 3 . 2 16 16 ILE CB C 13 38.819 0.040 . 1 . . . . . 1912 ILE CB . 27095 2
155 . 3 . 2 16 16 ILE CD1 C 13 12.542 0.040 . 1 . . . . . 1912 ILE CD1 . 27095 2
156 . 3 . 2 16 16 ILE CG1 C 13 29.244 0.055 . 1 . . . . . 1912 ILE CG1 . 27095 2
157 . 3 . 2 16 16 ILE CG2 C 13 18.571 0.073 . 1 . . . . . 1912 ILE CG2 . 27095 2
158 . 3 . 2 16 16 ILE H H 1 7.441 0.005 . 1 . . . . . 1912 ILE H . 27095 2
159 . 3 . 2 16 16 ILE HA H 1 3.285 0.004 . 1 . . . . . 1912 ILE HA . 27095 2
160 . 3 . 2 16 16 ILE HB H 1 1.537 0.006 . 1 . . . . . 1912 ILE HB . 27095 2
161 . 3 . 2 16 16 ILE HD11 H 1 -0.232 0.004 . 1 . . . . . 1912 ILE HD11 . 27095 2
162 . 3 . 2 16 16 ILE HD12 H 1 -0.232 0.004 . 1 . . . . . 1912 ILE HD12 . 27095 2
163 . 3 . 2 16 16 ILE HD13 H 1 -0.232 0.004 . 1 . . . . . 1912 ILE HD13 . 27095 2
164 . 3 . 2 16 16 ILE HG12 H 1 -0.007 0.006 . 2 . . . . . 1912 ILE HG12 . 27095 2
165 . 3 . 2 16 16 ILE HG13 H 1 1.485 0.004 . 2 . . . . . 1912 ILE HG13 . 27095 2
166 . 3 . 2 16 16 ILE HG21 H 1 0.561 0.003 . 1 . . . . . 1912 ILE HG21 . 27095 2
167 . 3 . 2 16 16 ILE HG22 H 1 0.561 0.003 . 1 . . . . . 1912 ILE HG22 . 27095 2
168 . 3 . 2 16 16 ILE HG23 H 1 0.561 0.003 . 1 . . . . . 1912 ILE HG23 . 27095 2
169 . 3 . 2 16 16 ILE N N 15 119.970 0.023 . 1 . . . . . 1912 ILE N . 27095 2
170 . 3 . 2 17 17 GLN C C 13 179.057 0.009 . 1 . . . . . 1913 GLN C . 27095 2
171 . 3 . 2 17 17 GLN CA C 13 60.163 0.094 . 1 . . . . . 1913 GLN CA . 27095 2
172 . 3 . 2 17 17 GLN CB C 13 26.850 0.092 . 1 . . . . . 1913 GLN CB . 27095 2
173 . 3 . 2 17 17 GLN CG C 13 35.149 0.008 . 1 . . . . . 1913 GLN CG . 27095 2
174 . 3 . 2 17 17 GLN H H 1 9.105 0.005 . 1 . . . . . 1913 GLN H . 27095 2
175 . 3 . 2 17 17 GLN HA H 1 3.760 0.005 . 1 . . . . . 1913 GLN HA . 27095 2
176 . 3 . 2 17 17 GLN HB2 H 1 1.895 0.004 . 2 . . . . . 1913 GLN HB2 . 27095 2
177 . 3 . 2 17 17 GLN HB3 H 1 2.642 0.000 . 2 . . . . . 1913 GLN HB3 . 27095 2
178 . 3 . 2 17 17 GLN HG2 H 1 2.464 0.004 . 2 . . . . . 1913 GLN HG2 . 27095 2
179 . 3 . 2 17 17 GLN HG3 H 1 2.289 0.004 . 2 . . . . . 1913 GLN HG3 . 27095 2
180 . 3 . 2 17 17 GLN N N 15 120.401 0.015 . 1 . . . . . 1913 GLN N . 27095 2
181 . 3 . 2 18 18 ARG C C 13 180.100 0.002 . 1 . . . . . 1914 ARG C . 27095 2
182 . 3 . 2 18 18 ARG CA C 13 60.019 0.079 . 1 . . . . . 1914 ARG CA . 27095 2
183 . 3 . 2 18 18 ARG CB C 13 30.243 0.057 . 1 . . . . . 1914 ARG CB . 27095 2
184 . 3 . 2 18 18 ARG CD C 13 44.141 0.017 . 1 . . . . . 1914 ARG CD . 27095 2
185 . 3 . 2 18 18 ARG CG C 13 28.331 0.022 . 1 . . . . . 1914 ARG CG . 27095 2
186 . 3 . 2 18 18 ARG H H 1 9.081 0.003 . 1 . . . . . 1914 ARG H . 27095 2
187 . 3 . 2 18 18 ARG HA H 1 4.050 0.000 . 1 . . . . . 1914 ARG HA . 27095 2
188 . 3 . 2 18 18 ARG HB2 H 1 1.946 0.008 . 1 . . . . . 1914 ARG HB2 . 27095 2
189 . 3 . 2 18 18 ARG HD2 H 1 2.969 0.003 . 2 . . . . . 1914 ARG HD2 . 27095 2
190 . 3 . 2 18 18 ARG HD3 H 1 3.120 0.004 . 2 . . . . . 1914 ARG HD3 . 27095 2
191 . 3 . 2 18 18 ARG HG2 H 1 1.684 0.003 . 2 . . . . . 1914 ARG HG2 . 27095 2
192 . 3 . 2 18 18 ARG HG3 H 1 2.115 0.002 . 2 . . . . . 1914 ARG HG3 . 27095 2
193 . 3 . 2 18 18 ARG N N 15 117.024 0.022 . 1 . . . . . 1914 ARG N . 27095 2
194 . 3 . 2 19 19 ALA C C 13 180.510 0.019 . 1 . . . . . 1915 ALA C . 27095 2
195 . 3 . 2 19 19 ALA CA C 13 55.271 0.067 . 1 . . . . . 1915 ALA CA . 27095 2
196 . 3 . 2 19 19 ALA CB C 13 18.639 0.071 . 1 . . . . . 1915 ALA CB . 27095 2
197 . 3 . 2 19 19 ALA H H 1 7.983 0.002 . 1 . . . . . 1915 ALA H . 27095 2
198 . 3 . 2 19 19 ALA HA H 1 4.154 0.003 . 1 . . . . . 1915 ALA HA . 27095 2
199 . 3 . 2 19 19 ALA HB1 H 1 1.578 0.002 . 1 . . . . . 1915 ALA HB1 . 27095 2
200 . 3 . 2 19 19 ALA HB2 H 1 1.578 0.002 . 1 . . . . . 1915 ALA HB2 . 27095 2
201 . 3 . 2 19 19 ALA HB3 H 1 1.578 0.002 . 1 . . . . . 1915 ALA HB3 . 27095 2
202 . 3 . 2 19 19 ALA N N 15 122.810 0.015 . 1 . . . . . 1915 ALA N . 27095 2
203 . 3 . 2 20 20 TYR C C 13 177.404 0.014 . 1 . . . . . 1916 TYR C . 27095 2
204 . 3 . 2 20 20 TYR CA C 13 62.042 0.063 . 1 . . . . . 1916 TYR CA . 27095 2
205 . 3 . 2 20 20 TYR CB C 13 38.290 0.048 . 1 . . . . . 1916 TYR CB . 27095 2
206 . 3 . 2 20 20 TYR CD1 C 13 132.299 0.029 . 1 . . . . . 1916 TYR CD1 . 27095 2
207 . 3 . 2 20 20 TYR CD2 C 13 132.299 0.029 . 1 . . . . . 1916 TYR CD2 . 27095 2
208 . 3 . 2 20 20 TYR CE1 C 13 118.521 0.011 . 1 . . . . . 1916 TYR CE1 . 27095 2
209 . 3 . 2 20 20 TYR CE2 C 13 118.521 0.011 . 1 . . . . . 1916 TYR CE2 . 27095 2
210 . 3 . 2 20 20 TYR H H 1 9.325 0.002 . 1 . . . . . 1916 TYR H . 27095 2
211 . 3 . 2 20 20 TYR HA H 1 4.520 0.005 . 1 . . . . . 1916 TYR HA . 27095 2
212 . 3 . 2 20 20 TYR HB2 H 1 2.960 0.005 . 2 . . . . . 1916 TYR HB2 . 27095 2
213 . 3 . 2 20 20 TYR HB3 H 1 3.214 0.005 . 2 . . . . . 1916 TYR HB3 . 27095 2
214 . 3 . 2 20 20 TYR HD1 H 1 7.032 0.005 . 1 . . . . . 1916 TYR HD1 . 27095 2
215 . 3 . 2 20 20 TYR HD2 H 1 7.032 0.005 . 1 . . . . . 1916 TYR HD2 . 27095 2
216 . 3 . 2 20 20 TYR HE1 H 1 6.916 0.002 . 1 . . . . . 1916 TYR HE1 . 27095 2
217 . 3 . 2 20 20 TYR HE2 H 1 6.916 0.002 . 1 . . . . . 1916 TYR HE2 . 27095 2
218 . 3 . 2 20 20 TYR N N 15 122.236 0.009 . 1 . . . . . 1916 TYR N . 27095 2
219 . 3 . 2 21 21 ARG C C 13 179.510 0.010 . 1 . . . . . 1917 ARG C . 27095 2
220 . 3 . 2 21 21 ARG CA C 13 61.147 0.038 . 1 . . . . . 1917 ARG CA . 27095 2
221 . 3 . 2 21 21 ARG CB C 13 29.660 0.077 . 1 . . . . . 1917 ARG CB . 27095 2
222 . 3 . 2 21 21 ARG CD C 13 43.108 0.055 . 1 . . . . . 1917 ARG CD . 27095 2
223 . 3 . 2 21 21 ARG CG C 13 30.939 0.010 . 1 . . . . . 1917 ARG CG . 27095 2
224 . 3 . 2 21 21 ARG H H 1 8.652 0.002 . 1 . . . . . 1917 ARG H . 27095 2
225 . 3 . 2 21 21 ARG HA H 1 3.790 0.005 . 1 . . . . . 1917 ARG HA . 27095 2
226 . 3 . 2 21 21 ARG HB2 H 1 1.842 0.001 . 1 . . . . . 1917 ARG HB2 . 27095 2
227 . 3 . 2 21 21 ARG HD2 H 1 3.014 0.002 . 2 . . . . . 1917 ARG HD2 . 27095 2
228 . 3 . 2 21 21 ARG HD3 H 1 3.193 0.003 . 2 . . . . . 1917 ARG HD3 . 27095 2
229 . 3 . 2 21 21 ARG HG2 H 1 1.524 0.002 . 2 . . . . . 1917 ARG HG2 . 27095 2
230 . 3 . 2 21 21 ARG HG3 H 1 1.992 0.003 . 2 . . . . . 1917 ARG HG3 . 27095 2
231 . 3 . 2 21 21 ARG N N 15 118.222 0.027 . 1 . . . . . 1917 ARG N . 27095 2
232 . 3 . 2 22 22 ARG C C 13 178.603 0.012 . 1 . . . . . 1918 ARG C . 27095 2
233 . 3 . 2 22 22 ARG CA C 13 59.977 0.084 . 1 . . . . . 1918 ARG CA . 27095 2
234 . 3 . 2 22 22 ARG CB C 13 30.365 0.035 . 1 . . . . . 1918 ARG CB . 27095 2
235 . 3 . 2 22 22 ARG CD C 13 43.572 0.042 . 1 . . . . . 1918 ARG CD . 27095 2
236 . 3 . 2 22 22 ARG CG C 13 28.170 0.070 . 1 . . . . . 1918 ARG CG . 27095 2
237 . 3 . 2 22 22 ARG H H 1 7.934 0.003 . 1 . . . . . 1918 ARG H . 27095 2
238 . 3 . 2 22 22 ARG HA H 1 4.058 0.006 . 1 . . . . . 1918 ARG HA . 27095 2
239 . 3 . 2 22 22 ARG HB2 H 1 2.036 0.005 . 1 . . . . . 1918 ARG HB2 . 27095 2
240 . 3 . 2 22 22 ARG HD2 H 1 3.330 0.004 . 2 . . . . . 1918 ARG HD2 . 27095 2
241 . 3 . 2 22 22 ARG HD3 H 1 3.237 0.007 . 2 . . . . . 1918 ARG HD3 . 27095 2
242 . 3 . 2 22 22 ARG HG2 H 1 1.575 0.005 . 2 . . . . . 1918 ARG HG2 . 27095 2
243 . 3 . 2 22 22 ARG HG3 H 1 1.890 0.006 . 2 . . . . . 1918 ARG HG3 . 27095 2
244 . 3 . 2 22 22 ARG N N 15 119.497 0.047 . 1 . . . . . 1918 ARG N . 27095 2
245 . 3 . 2 23 23 TYR C C 13 177.422 0.024 . 1 . . . . . 1919 TYR C . 27095 2
246 . 3 . 2 23 23 TYR CA C 13 60.813 0.065 . 1 . . . . . 1919 TYR CA . 27095 2
247 . 3 . 2 23 23 TYR CB C 13 37.784 0.031 . 1 . . . . . 1919 TYR CB . 27095 2
248 . 3 . 2 23 23 TYR CD1 C 13 133.538 0.018 . 1 . . . . . 1919 TYR CD1 . 27095 2
249 . 3 . 2 23 23 TYR CD2 C 13 133.538 0.018 . 1 . . . . . 1919 TYR CD2 . 27095 2
250 . 3 . 2 23 23 TYR CE1 C 13 118.502 0.016 . 1 . . . . . 1919 TYR CE1 . 27095 2
251 . 3 . 2 23 23 TYR CE2 C 13 118.502 0.016 . 1 . . . . . 1919 TYR CE2 . 27095 2
252 . 3 . 2 23 23 TYR H H 1 7.881 0.003 . 1 . . . . . 1919 TYR H . 27095 2
253 . 3 . 2 23 23 TYR HA H 1 4.299 0.005 . 1 . . . . . 1919 TYR HA . 27095 2
254 . 3 . 2 23 23 TYR HB2 H 1 3.247 0.004 . 2 . . . . . 1919 TYR HB2 . 27095 2
255 . 3 . 2 23 23 TYR HB3 H 1 3.389 0.008 . 2 . . . . . 1919 TYR HB3 . 27095 2
256 . 3 . 2 23 23 TYR HD1 H 1 7.040 0.001 . 1 . . . . . 1919 TYR HD1 . 27095 2
257 . 3 . 2 23 23 TYR HD2 H 1 7.040 0.001 . 1 . . . . . 1919 TYR HD2 . 27095 2
258 . 3 . 2 23 23 TYR HE1 H 1 6.984 0.001 . 1 . . . . . 1919 TYR HE1 . 27095 2
259 . 3 . 2 23 23 TYR HE2 H 1 6.984 0.001 . 1 . . . . . 1919 TYR HE2 . 27095 2
260 . 3 . 2 23 23 TYR N N 15 123.132 0.028 . 1 . . . . . 1919 TYR N . 27095 2
261 . 3 . 2 24 24 LEU C C 13 180.033 0.016 . 1 . . . . . 1920 LEU C . 27095 2
262 . 3 . 2 24 24 LEU CA C 13 57.458 0.078 . 1 . . . . . 1920 LEU CA . 27095 2
263 . 3 . 2 24 24 LEU CB C 13 42.144 0.062 . 1 . . . . . 1920 LEU CB . 27095 2
264 . 3 . 2 24 24 LEU CD1 C 13 22.391 0.030 . 2 . . . . . 1920 LEU CD1 . 27095 2
265 . 3 . 2 24 24 LEU CD2 C 13 25.470 0.047 . 2 . . . . . 1920 LEU CD2 . 27095 2
266 . 3 . 2 24 24 LEU CG C 13 26.060 0.025 . 1 . . . . . 1920 LEU CG . 27095 2
267 . 3 . 2 24 24 LEU H H 1 8.441 0.002 . 1 . . . . . 1920 LEU H . 27095 2
268 . 3 . 2 24 24 LEU HA H 1 3.529 0.003 . 1 . . . . . 1920 LEU HA . 27095 2
269 . 3 . 2 24 24 LEU HB2 H 1 1.221 0.006 . 2 . . . . . 1920 LEU HB2 . 27095 2
270 . 3 . 2 24 24 LEU HB3 H 1 1.667 0.004 . 2 . . . . . 1920 LEU HB3 . 27095 2
271 . 3 . 2 24 24 LEU HD11 H 1 0.771 0.006 . 2 . . . . . 1920 LEU HD11 . 27095 2
272 . 3 . 2 24 24 LEU HD12 H 1 0.771 0.006 . 2 . . . . . 1920 LEU HD12 . 27095 2
273 . 3 . 2 24 24 LEU HD13 H 1 0.771 0.006 . 2 . . . . . 1920 LEU HD13 . 27095 2
274 . 3 . 2 24 24 LEU HD21 H 1 0.780 0.003 . 2 . . . . . 1920 LEU HD21 . 27095 2
275 . 3 . 2 24 24 LEU HD22 H 1 0.780 0.003 . 2 . . . . . 1920 LEU HD22 . 27095 2
276 . 3 . 2 24 24 LEU HD23 H 1 0.780 0.003 . 2 . . . . . 1920 LEU HD23 . 27095 2
277 . 3 . 2 24 24 LEU HG H 1 1.210 0.005 . 1 . . . . . 1920 LEU HG . 27095 2
278 . 3 . 2 24 24 LEU N N 15 120.413 0.013 . 1 . . . . . 1920 LEU N . 27095 2
279 . 3 . 2 25 25 LEU C C 13 179.162 0.005 . 1 . . . . . 1921 LEU C . 27095 2
280 . 3 . 2 25 25 LEU CA C 13 57.235 0.089 . 1 . . . . . 1921 LEU CA . 27095 2
281 . 3 . 2 25 25 LEU CB C 13 41.936 0.034 . 1 . . . . . 1921 LEU CB . 27095 2
282 . 3 . 2 25 25 LEU CD1 C 13 23.724 0.020 . 2 . . . . . 1921 LEU CD1 . 27095 2
283 . 3 . 2 25 25 LEU CD2 C 13 24.804 0.021 . 2 . . . . . 1921 LEU CD2 . 27095 2
284 . 3 . 2 25 25 LEU CG C 13 26.966 0.060 . 1 . . . . . 1921 LEU CG . 27095 2
285 . 3 . 2 25 25 LEU H H 1 7.496 0.003 . 1 . . . . . 1921 LEU H . 27095 2
286 . 3 . 2 25 25 LEU HA H 1 4.030 0.003 . 1 . . . . . 1921 LEU HA . 27095 2
287 . 3 . 2 25 25 LEU HB2 H 1 1.633 0.003 . 2 . . . . . 1921 LEU HB2 . 27095 2
288 . 3 . 2 25 25 LEU HB3 H 1 1.775 0.004 . 2 . . . . . 1921 LEU HB3 . 27095 2
289 . 3 . 2 25 25 LEU HD11 H 1 0.853 0.001 . 2 . . . . . 1921 LEU HD11 . 27095 2
290 . 3 . 2 25 25 LEU HD12 H 1 0.853 0.001 . 2 . . . . . 1921 LEU HD12 . 27095 2
291 . 3 . 2 25 25 LEU HD13 H 1 0.853 0.001 . 2 . . . . . 1921 LEU HD13 . 27095 2
292 . 3 . 2 25 25 LEU HD21 H 1 0.894 0.002 . 2 . . . . . 1921 LEU HD21 . 27095 2
293 . 3 . 2 25 25 LEU HD22 H 1 0.894 0.002 . 2 . . . . . 1921 LEU HD22 . 27095 2
294 . 3 . 2 25 25 LEU HD23 H 1 0.894 0.002 . 2 . . . . . 1921 LEU HD23 . 27095 2
295 . 3 . 2 25 25 LEU HG H 1 1.742 0.004 . 1 . . . . . 1921 LEU HG . 27095 2
296 . 3 . 2 25 25 LEU N N 15 118.616 0.028 . 1 . . . . . 1921 LEU N . 27095 2
297 . 3 . 2 26 26 LYS C C 13 178.082 0.000 . 1 . . . . . 1922 LYS C . 27095 2
298 . 3 . 2 26 26 LYS CA C 13 58.163 0.067 . 1 . . . . . 1922 LYS CA . 27095 2
299 . 3 . 2 26 26 LYS CB C 13 32.403 0.040 . 1 . . . . . 1922 LYS CB . 27095 2
300 . 3 . 2 26 26 LYS CD C 13 29.474 0.042 . 1 . . . . . 1922 LYS CD . 27095 2
301 . 3 . 2 26 26 LYS CE C 13 42.174 0.000 . 1 . . . . . 1922 LYS CE . 27095 2
302 . 3 . 2 26 26 LYS CG C 13 24.909 0.121 . 1 . . . . . 1922 LYS CG . 27095 2
303 . 3 . 2 26 26 LYS H H 1 7.616 0.003 . 1 . . . . . 1922 LYS H . 27095 2
304 . 3 . 2 26 26 LYS HA H 1 4.051 0.003 . 1 . . . . . 1922 LYS HA . 27095 2
305 . 3 . 2 26 26 LYS HB2 H 1 1.880 0.003 . 1 . . . . . 1922 LYS HB2 . 27095 2
306 . 3 . 2 26 26 LYS HD2 H 1 1.714 0.002 . 1 . . . . . 1922 LYS HD2 . 27095 2
307 . 3 . 2 26 26 LYS HE2 H 1 3.000 0.001 . 1 . . . . . 1922 LYS HE2 . 27095 2
308 . 3 . 2 26 26 LYS HG2 H 1 1.433 0.002 . 2 . . . . . 1922 LYS HG2 . 27095 2
309 . 3 . 2 26 26 LYS HG3 H 1 1.574 0.007 . 2 . . . . . 1922 LYS HG3 . 27095 2
310 . 3 . 2 26 26 LYS N N 15 118.783 0.032 . 1 . . . . . 1922 LYS N . 27095 2
311 . 3 . 2 27 27 GLN C C 13 177.010 0.014 . 1 . . . . . 1923 GLN C . 27095 2
312 . 3 . 2 27 27 GLN CA C 13 56.439 0.063 . 1 . . . . . 1923 GLN CA . 27095 2
313 . 3 . 2 27 27 GLN CB C 13 29.023 0.087 . 1 . . . . . 1923 GLN CB . 27095 2
314 . 3 . 2 27 27 GLN CG C 13 33.335 0.029 . 1 . . . . . 1923 GLN CG . 27095 2
315 . 3 . 2 27 27 GLN H H 1 7.734 0.002 . 1 . . . . . 1923 GLN H . 27095 2
316 . 3 . 2 27 27 GLN HA H 1 4.051 0.003 . 1 . . . . . 1923 GLN HA . 27095 2
317 . 3 . 2 27 27 GLN HB2 H 1 1.819 0.001 . 1 . . . . . 1923 GLN HB2 . 27095 2
318 . 3 . 2 27 27 GLN HG2 H 1 2.063 0.004 . 1 . . . . . 1923 GLN HG2 . 27095 2
319 . 3 . 2 27 27 GLN N N 15 116.972 0.024 . 1 . . . . . 1923 GLN N . 27095 2
320 . 3 . 2 28 28 LYS C C 13 176.948 0.016 . 1 . . . . . 1924 LYS C . 27095 2
321 . 3 . 2 28 28 LYS CA C 13 56.937 0.087 . 1 . . . . . 1924 LYS CA . 27095 2
322 . 3 . 2 28 28 LYS CB C 13 32.667 0.068 . 1 . . . . . 1924 LYS CB . 27095 2
323 . 3 . 2 28 28 LYS CD C 13 28.978 0.034 . 1 . . . . . 1924 LYS CD . 27095 2
324 . 3 . 2 28 28 LYS CE C 13 41.975 0.096 . 1 . . . . . 1924 LYS CE . 27095 2
325 . 3 . 2 28 28 LYS CG C 13 24.784 0.054 . 1 . . . . . 1924 LYS CG . 27095 2
326 . 3 . 2 28 28 LYS H H 1 7.740 0.003 . 1 . . . . . 1924 LYS H . 27095 2
327 . 3 . 2 28 28 LYS HA H 1 4.175 0.005 . 1 . . . . . 1924 LYS HA . 27095 2
328 . 3 . 2 28 28 LYS HB2 H 1 1.795 0.002 . 2 . . . . . 1924 LYS HB2 . 27095 2
329 . 3 . 2 28 28 LYS HB3 H 1 1.854 0.003 . 2 . . . . . 1924 LYS HB3 . 27095 2
330 . 3 . 2 28 28 LYS HD2 H 1 1.636 0.001 . 1 . . . . . 1924 LYS HD2 . 27095 2
331 . 3 . 2 28 28 LYS HE2 H 1 2.929 0.002 . 1 . . . . . 1924 LYS HE2 . 27095 2
332 . 3 . 2 28 28 LYS HG2 H 1 1.399 0.003 . 2 . . . . . 1924 LYS HG2 . 27095 2
333 . 3 . 2 28 28 LYS HG3 H 1 1.491 0.002 . 2 . . . . . 1924 LYS HG3 . 27095 2
334 . 3 . 2 28 28 LYS N N 15 119.342 0.022 . 1 . . . . . 1924 LYS N . 27095 2
335 . 3 . 2 29 29 VAL C C 13 175.876 0.014 . 1 . . . . . 1925 VAL C . 27095 2
336 . 3 . 2 29 29 VAL CA C 13 62.432 0.079 . 1 . . . . . 1925 VAL CA . 27095 2
337 . 3 . 2 29 29 VAL CB C 13 32.366 0.062 . 1 . . . . . 1925 VAL CB . 27095 2
338 . 3 . 2 29 29 VAL CG1 C 13 21.141 0.027 . 2 . . . . . 1925 VAL CG1 . 27095 2
339 . 3 . 2 29 29 VAL CG2 C 13 20.652 0.039 . 2 . . . . . 1925 VAL CG2 . 27095 2
340 . 3 . 2 29 29 VAL H H 1 7.643 0.002 . 1 . . . . . 1925 VAL H . 27095 2
341 . 3 . 2 29 29 VAL HA H 1 4.056 0.003 . 1 . . . . . 1925 VAL HA . 27095 2
342 . 3 . 2 29 29 VAL HB H 1 2.109 0.002 . 1 . . . . . 1925 VAL HB . 27095 2
343 . 3 . 2 29 29 VAL HG11 H 1 0.914 0.005 . 2 . . . . . 1925 VAL HG11 . 27095 2
344 . 3 . 2 29 29 VAL HG12 H 1 0.914 0.005 . 2 . . . . . 1925 VAL HG12 . 27095 2
345 . 3 . 2 29 29 VAL HG13 H 1 0.914 0.005 . 2 . . . . . 1925 VAL HG13 . 27095 2
346 . 3 . 2 29 29 VAL HG21 H 1 0.942 0.001 . 2 . . . . . 1925 VAL HG21 . 27095 2
347 . 3 . 2 29 29 VAL HG22 H 1 0.942 0.001 . 2 . . . . . 1925 VAL HG22 . 27095 2
348 . 3 . 2 29 29 VAL HG23 H 1 0.942 0.001 . 2 . . . . . 1925 VAL HG23 . 27095 2
349 . 3 . 2 29 29 VAL N N 15 118.304 0.010 . 1 . . . . . 1925 VAL N . 27095 2
350 . 3 . 2 30 30 LYS C C 13 175.436 0.017 . 1 . . . . . 1926 LYS C . 27095 2
351 . 3 . 2 30 30 LYS CA C 13 56.275 0.080 . 1 . . . . . 1926 LYS CA . 27095 2
352 . 3 . 2 30 30 LYS CB C 13 32.969 0.061 . 1 . . . . . 1926 LYS CB . 27095 2
353 . 3 . 2 30 30 LYS CD C 13 29.021 0.029 . 1 . . . . . 1926 LYS CD . 27095 2
354 . 3 . 2 30 30 LYS CE C 13 42.149 0.000 . 1 . . . . . 1926 LYS CE . 27095 2
355 . 3 . 2 30 30 LYS CG C 13 24.545 0.061 . 1 . . . . . 1926 LYS CG . 27095 2
356 . 3 . 2 30 30 LYS H H 1 8.051 0.002 . 1 . . . . . 1926 LYS H . 27095 2
357 . 3 . 2 30 30 LYS HA H 1 4.296 0.003 . 1 . . . . . 1926 LYS HA . 27095 2
358 . 3 . 2 30 30 LYS HB2 H 1 1.750 0.003 . 2 . . . . . 1926 LYS HB2 . 27095 2
359 . 3 . 2 30 30 LYS HB3 H 1 1.842 0.003 . 2 . . . . . 1926 LYS HB3 . 27095 2
360 . 3 . 2 30 30 LYS HD2 H 1 1.667 0.002 . 1 . . . . . 1926 LYS HD2 . 27095 2
361 . 3 . 2 30 30 LYS HE2 H 1 2.978 0.004 . 1 . . . . . 1926 LYS HE2 . 27095 2
362 . 3 . 2 30 30 LYS HG2 H 1 1.422 0.003 . 2 . . . . . 1926 LYS HG2 . 27095 2
363 . 3 . 2 30 30 LYS HG3 H 1 1.445 0.001 . 2 . . . . . 1926 LYS HG3 . 27095 2
364 . 3 . 2 30 30 LYS N N 15 125.120 0.006 . 1 . . . . . 1926 LYS N . 27095 2
365 . 3 . 2 31 31 LYS CA C 13 57.717 0.000 . 1 . . . . . 1927 LYS CA . 27095 2
366 . 3 . 2 31 31 LYS CB C 13 33.804 0.000 . 1 . . . . . 1927 LYS CB . 27095 2
367 . 3 . 2 31 31 LYS H H 1 7.918 0.002 . 1 . . . . . 1927 LYS H . 27095 2
368 . 3 . 2 31 31 LYS N N 15 128.570 0.007 . 1 . . . . . 1927 LYS N . 27095 2
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