Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 51820
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name '13C,15N solid-state NMR assignments of H2B globular domain in NCP'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D DARR' . . . 51820 1
2 '2D NCA' . . . 51820 1
3 '2D NCO' . . . 51820 1
4 '3D CANCO' . . . 51820 1
5 '3D NCACX' . . . 51820 1
6 '3D NCOCX' . . . 51820 1
7 '1D 1H-13C CP' . . . 51820 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
1 $software_1 . . 51820 1
2 $software_2 . . 51820 1
3 $software_3 . . 51820 1
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 . 1 . 1 30 30 ARG CA C 13 58.142 0.062 . 1 . . . . . 30 R CA . 51820 1
2 . 1 . 1 30 30 ARG CB C 13 33.154 0.139 . 1 . . . . . 30 R CB . 51820 1
3 . 1 . 1 30 30 ARG CD C 13 42.432 0.000 . 1 . . . . . 30 R CD . 51820 1
4 . 1 . 1 30 30 ARG N N 15 126.481 0.133 . 1 . . . . . 30 R N . 51820 1
5 . 1 . 1 31 31 LYS C C 13 175.500 0.000 . 1 . . . . . 31 K C . 51820 1
6 . 1 . 1 31 31 LYS CA C 13 55.058 0.136 . 1 . . . . . 31 K CA . 51820 1
7 . 1 . 1 31 31 LYS CB C 13 32.511 0.132 . 1 . . . . . 31 K CB . 51820 1
8 . 1 . 1 31 31 LYS CG C 13 24.622 0.000 . 1 . . . . . 31 K CG . 51820 1
9 . 1 . 1 31 31 LYS N N 15 127.759 0.091 . 1 . . . . . 31 K N . 51820 1
10 . 1 . 1 32 32 GLU C C 13 176.883 0.095 . 1 . . . . . 32 E C . 51820 1
11 . 1 . 1 32 32 GLU CA C 13 55.577 0.102 . 1 . . . . . 32 E CA . 51820 1
12 . 1 . 1 32 32 GLU CB C 13 30.913 0.094 . 1 . . . . . 32 E CB . 51820 1
13 . 1 . 1 32 32 GLU CG C 13 36.780 0.000 . 1 . . . . . 32 E CG . 51820 1
14 . 1 . 1 32 32 GLU CD C 13 184.100 0.040 . 1 . . . . . 32 E CD . 51820 1
15 . 1 . 1 32 32 GLU N N 15 123.123 0.179 . 1 . . . . . 32 E N . 51820 1
16 . 1 . 1 33 33 SER C C 13 174.934 0.138 . 1 . . . . . 33 S C . 51820 1
17 . 1 . 1 33 33 SER CA C 13 57.925 0.121 . 1 . . . . . 33 S CA . 51820 1
18 . 1 . 1 33 33 SER CB C 13 65.930 0.079 . 1 . . . . . 33 S CB . 51820 1
19 . 1 . 1 33 33 SER N N 15 116.895 0.141 . 1 . . . . . 33 S N . 51820 1
20 . 1 . 1 34 34 TYR C C 13 175.748 0.041 . 1 . . . . . 34 Y C . 51820 1
21 . 1 . 1 34 34 TYR CA C 13 59.823 0.086 . 1 . . . . . 34 Y CA . 51820 1
22 . 1 . 1 34 34 TYR CB C 13 37.268 0.000 . 1 . . . . . 34 Y CB . 51820 1
23 . 1 . 1 34 34 TYR N N 15 117.268 0.201 . 1 . . . . . 34 Y N . 51820 1
24 . 1 . 1 35 35 ALA C C 13 179.739 0.058 . 1 . . . . . 35 A C . 51820 1
25 . 1 . 1 35 35 ALA CA C 13 57.117 0.071 . 1 . . . . . 35 A CA . 51820 1
26 . 1 . 1 35 35 ALA CB C 13 18.957 0.046 . 1 . . . . . 35 A CB . 51820 1
27 . 1 . 1 35 35 ALA N N 15 125.019 0.166 . 1 . . . . . 35 A N . 51820 1
28 . 1 . 1 36 36 ILE C C 13 177.838 0.022 . 1 . . . . . 36 I C . 51820 1
29 . 1 . 1 36 36 ILE CA C 13 65.106 0.067 . 1 . . . . . 36 I CA . 51820 1
30 . 1 . 1 36 36 ILE CB C 13 36.963 0.000 . 1 . . . . . 36 I CB . 51820 1
31 . 1 . 1 36 36 ILE CD1 C 13 15.594 0.000 . 1 . . . . . 36 I CD1 . 51820 1
32 . 1 . 1 36 36 ILE N N 15 114.145 0.177 . 1 . . . . . 36 I N . 51820 1
33 . 1 . 1 37 37 TYR C C 13 177.977 0.175 . 1 . . . . . 37 Y C . 51820 1
34 . 1 . 1 37 37 TYR CA C 13 59.109 0.072 . 1 . . . . . 37 Y CA . 51820 1
35 . 1 . 1 37 37 TYR CB C 13 37.197 0.134 . 1 . . . . . 37 Y CB . 51820 1
36 . 1 . 1 37 37 TYR N N 15 121.970 0.118 . 1 . . . . . 37 Y N . 51820 1
37 . 1 . 1 38 38 VAL C C 13 177.937 0.063 . 1 . . . . . 38 V C . 51820 1
38 . 1 . 1 38 38 VAL CA C 13 67.134 0.023 . 1 . . . . . 38 V CA . 51820 1
39 . 1 . 1 38 38 VAL CB C 13 31.495 0.000 . 1 . . . . . 38 V CB . 51820 1
40 . 1 . 1 38 38 VAL CG1 C 13 21.922 0.000 . 2 . . . . . 38 V CG1 . 51820 1
41 . 1 . 1 38 38 VAL CG2 C 13 23.910 0.000 . 2 . . . . . 38 V CG2 . 51820 1
42 . 1 . 1 38 38 VAL N N 15 119.477 0.086 . 1 . . . . . 38 V N . 51820 1
43 . 1 . 1 39 39 TYR C C 13 177.733 0.124 . 1 . . . . . 39 Y C . 51820 1
44 . 1 . 1 39 39 TYR CA C 13 62.881 0.124 . 1 . . . . . 39 Y CA . 51820 1
45 . 1 . 1 39 39 TYR CB C 13 38.381 0.000 . 1 . . . . . 39 Y CB . 51820 1
46 . 1 . 1 39 39 TYR N N 15 119.402 0.258 . 1 . . . . . 39 Y N . 51820 1
47 . 1 . 1 40 40 LYS C C 13 180.221 0.062 . 1 . . . . . 40 K C . 51820 1
48 . 1 . 1 40 40 LYS CA C 13 60.369 0.073 . 1 . . . . . 40 K CA . 51820 1
49 . 1 . 1 40 40 LYS CB C 13 32.803 0.116 . 1 . . . . . 40 K CB . 51820 1
50 . 1 . 1 40 40 LYS CG C 13 26.761 0.000 . 1 . . . . . 40 K CG . 51820 1
51 . 1 . 1 40 40 LYS N N 15 117.147 0.203 . 1 . . . . . 40 K N . 51820 1
52 . 1 . 1 41 41 VAL C C 13 178.192 0.106 . 1 . . . . . 41 V C . 51820 1
53 . 1 . 1 41 41 VAL CA C 13 66.455 0.067 . 1 . . . . . 41 V CA . 51820 1
54 . 1 . 1 41 41 VAL CB C 13 31.667 0.032 . 1 . . . . . 41 V CB . 51820 1
55 . 1 . 1 41 41 VAL CG1 C 13 21.960 0.068 . 2 . . . . . 41 V CG1 . 51820 1
56 . 1 . 1 41 41 VAL CG2 C 13 24.000 0.030 . 2 . . . . . 41 V CG2 . 51820 1
57 . 1 . 1 41 41 VAL N N 15 119.725 0.069 . 1 . . . . . 41 V N . 51820 1
58 . 1 . 1 42 42 LEU C C 13 177.203 0.161 . 1 . . . . . 42 L C . 51820 1
59 . 1 . 1 42 42 LEU CA C 13 59.344 0.112 . 1 . . . . . 42 L CA . 51820 1
60 . 1 . 1 42 42 LEU CB C 13 37.049 0.066 . 1 . . . . . 42 L CB . 51820 1
61 . 1 . 1 42 42 LEU N N 15 122.067 0.157 . 1 . . . . . 42 L N . 51820 1
62 . 1 . 1 43 43 LYS C C 13 178.139 0.082 . 1 . . . . . 43 K C . 51820 1
63 . 1 . 1 43 43 LYS CA C 13 56.831 0.115 . 1 . . . . . 43 K CA . 51820 1
64 . 1 . 1 43 43 LYS CB C 13 31.837 0.045 . 1 . . . . . 43 K CB . 51820 1
65 . 1 . 1 43 43 LYS CG C 13 23.574 0.066 . 1 . . . . . 43 K CG . 51820 1
66 . 1 . 1 43 43 LYS CD C 13 26.891 0.000 . 1 . . . . . 43 K CD . 51820 1
67 . 1 . 1 43 43 LYS CE C 13 43.213 0.103 . 1 . . . . . 43 K CE . 51820 1
68 . 1 . 1 43 43 LYS N N 15 113.539 0.071 . 1 . . . . . 43 K N . 51820 1
69 . 1 . 1 44 44 GLN C C 13 178.067 0.103 . 1 . . . . . 44 Q C . 51820 1
70 . 1 . 1 44 44 GLN CA C 13 58.081 0.099 . 1 . . . . . 44 Q CA . 51820 1
71 . 1 . 1 44 44 GLN CB C 13 29.280 0.075 . 1 . . . . . 44 Q CB . 51820 1
72 . 1 . 1 44 44 GLN CG C 13 34.105 0.067 . 1 . . . . . 44 Q CG . 51820 1
73 . 1 . 1 44 44 GLN CD C 13 180.229 0.061 . 1 . . . . . 44 Q CD . 51820 1
74 . 1 . 1 44 44 GLN N N 15 116.332 0.163 . 1 . . . . . 44 Q N . 51820 1
75 . 1 . 1 45 45 VAL C C 13 176.243 0.075 . 1 . . . . . 45 V C . 51820 1
76 . 1 . 1 45 45 VAL CA C 13 63.761 0.078 . 1 . . . . . 45 V CA . 51820 1
77 . 1 . 1 45 45 VAL CB C 13 33.080 0.050 . 1 . . . . . 45 V CB . 51820 1
78 . 1 . 1 45 45 VAL CG1 C 13 20.222 0.052 . 2 . . . . . 45 V CG1 . 51820 1
79 . 1 . 1 45 45 VAL CG2 C 13 21.782 0.056 . 2 . . . . . 45 V CG2 . 51820 1
80 . 1 . 1 45 45 VAL N N 15 114.152 0.133 . 1 . . . . . 45 V N . 51820 1
81 . 1 . 1 46 46 HIS C C 13 172.770 0.070 . 1 . . . . . 46 H C . 51820 1
82 . 1 . 1 46 46 HIS CA C 13 54.297 0.089 . 1 . . . . . 46 H CA . 51820 1
83 . 1 . 1 46 46 HIS CB C 13 32.914 0.096 . 1 . . . . . 46 H CB . 51820 1
84 . 1 . 1 46 46 HIS CE1 C 13 140.259 0.000 . 1 . . . . . 46 H CE1 . 51820 1
85 . 1 . 1 46 46 HIS N N 15 119.984 0.100 . 1 . . . . . 46 H N . 51820 1
86 . 1 . 1 47 47 PRO C C 13 177.812 0.070 . 1 . . . . . 47 P C . 51820 1
87 . 1 . 1 47 47 PRO CA C 13 65.436 0.079 . 1 . . . . . 47 P CA . 51820 1
88 . 1 . 1 47 47 PRO CB C 13 32.607 0.031 . 1 . . . . . 47 P CB . 51820 1
89 . 1 . 1 47 47 PRO CG C 13 27.098 0.043 . 1 . . . . . 47 P CG . 51820 1
90 . 1 . 1 47 47 PRO CD C 13 50.131 0.070 . 1 . . . . . 47 P CD . 51820 1
91 . 1 . 1 47 47 PRO N N 15 134.915 0.021 . 1 . . . . . 47 P N . 51820 1
92 . 1 . 1 48 48 ASP C C 13 176.502 0.085 . 1 . . . . . 48 D C . 51820 1
93 . 1 . 1 48 48 ASP CA C 13 53.816 0.110 . 1 . . . . . 48 D CA . 51820 1
94 . 1 . 1 48 48 ASP CB C 13 41.165 0.055 . 1 . . . . . 48 D CB . 51820 1
95 . 1 . 1 48 48 ASP CG C 13 181.338 0.027 . 1 . . . . . 48 D CG . 51820 1
96 . 1 . 1 48 48 ASP N N 15 117.210 0.000 . 1 . . . . . 48 D N . 51820 1
97 . 1 . 1 49 49 THR C C 13 173.798 0.051 . 1 . . . . . 49 T C . 51820 1
98 . 1 . 1 49 49 THR CA C 13 62.982 0.084 . 1 . . . . . 49 T CA . 51820 1
99 . 1 . 1 49 49 THR CB C 13 70.430 0.067 . 1 . . . . . 49 T CB . 51820 1
100 . 1 . 1 49 49 THR CG2 C 13 21.903 0.054 . 1 . . . . . 49 T CG2 . 51820 1
101 . 1 . 1 49 49 THR N N 15 120.375 0.192 . 1 . . . . . 49 T N . 51820 1
102 . 1 . 1 50 50 GLY C C 13 173.893 0.108 . 1 . . . . . 50 G C . 51820 1
103 . 1 . 1 50 50 GLY CA C 13 43.781 0.045 . 1 . . . . . 50 G CA . 51820 1
104 . 1 . 1 50 50 GLY N N 15 114.270 0.184 . 1 . . . . . 50 G N . 51820 1
105 . 1 . 1 51 51 ILE C C 13 172.900 0.222 . 1 . . . . . 51 I C . 51820 1
106 . 1 . 1 51 51 ILE CA C 13 60.418 0.121 . 1 . . . . . 51 I CA . 51820 1
107 . 1 . 1 51 51 ILE CB C 13 41.366 0.054 . 1 . . . . . 51 I CB . 51820 1
108 . 1 . 1 51 51 ILE CG1 C 13 30.215 0.108 . 1 . . . . . 51 I CG1 . 51820 1
109 . 1 . 1 51 51 ILE CG2 C 13 15.733 0.055 . 1 . . . . . 51 I CG2 . 51820 1
110 . 1 . 1 51 51 ILE CD1 C 13 13.123 0.046 . 1 . . . . . 51 I CD1 . 51820 1
111 . 1 . 1 51 51 ILE N N 15 118.665 0.129 . 1 . . . . . 51 I N . 51820 1
112 . 1 . 1 52 52 SER C C 13 175.197 0.084 . 1 . . . . . 52 S C . 51820 1
113 . 1 . 1 52 52 SER CA C 13 57.478 0.107 . 1 . . . . . 52 S CA . 51820 1
114 . 1 . 1 52 52 SER CB C 13 65.797 0.083 . 1 . . . . . 52 S CB . 51820 1
115 . 1 . 1 52 52 SER N N 15 123.770 0.183 . 1 . . . . . 52 S N . 51820 1
116 . 1 . 1 53 53 SER C C 13 178.768 0.078 . 1 . . . . . 53 S C . 51820 1
117 . 1 . 1 53 53 SER CA C 13 62.324 0.045 . 1 . . . . . 53 S CA . 51820 1
118 . 1 . 1 53 53 SER N N 15 119.039 0.078 . 1 . . . . . 53 S N . 51820 1
119 . 1 . 1 54 54 LYS C C 13 179.603 0.113 . 1 . . . . . 54 K C . 51820 1
120 . 1 . 1 54 54 LYS CA C 13 58.349 0.102 . 1 . . . . . 54 K CA . 51820 1
121 . 1 . 1 54 54 LYS CB C 13 31.780 0.034 . 1 . . . . . 54 K CB . 51820 1
122 . 1 . 1 54 54 LYS CG C 13 26.788 0.036 . 1 . . . . . 54 K CG . 51820 1
123 . 1 . 1 54 54 LYS CD C 13 29.902 0.029 . 1 . . . . . 54 K CD . 51820 1
124 . 1 . 1 54 54 LYS CE C 13 42.375 0.068 . 1 . . . . . 54 K CE . 51820 1
125 . 1 . 1 54 54 LYS N N 15 122.056 0.096 . 1 . . . . . 54 K N . 51820 1
126 . 1 . 1 55 55 ALA C C 13 178.942 0.077 . 1 . . . . . 55 A C . 51820 1
127 . 1 . 1 55 55 ALA CA C 13 55.217 0.092 . 1 . . . . . 55 A CA . 51820 1
128 . 1 . 1 55 55 ALA CB C 13 18.850 0.073 . 1 . . . . . 55 A CB . 51820 1
129 . 1 . 1 55 55 ALA N N 15 120.709 0.162 . 1 . . . . . 55 A N . 51820 1
130 . 1 . 1 56 56 MET C C 13 178.114 0.081 . 1 . . . . . 56 M C . 51820 1
131 . 1 . 1 56 56 MET CA C 13 57.781 0.139 . 1 . . . . . 56 M CA . 51820 1
132 . 1 . 1 56 56 MET CB C 13 31.725 0.088 . 1 . . . . . 56 M CB . 51820 1
133 . 1 . 1 56 56 MET CG C 13 32.877 0.067 . 1 . . . . . 56 M CG . 51820 1
134 . 1 . 1 56 56 MET CE C 13 18.871 0.028 . 1 . . . . . 56 M CE . 51820 1
135 . 1 . 1 56 56 MET N N 15 119.962 0.135 . 1 . . . . . 56 M N . 51820 1
136 . 1 . 1 57 57 SER C C 13 178.613 0.099 . 1 . . . . . 57 S C . 51820 1
137 . 1 . 1 57 57 SER CA C 13 61.283 0.044 . 1 . . . . . 57 S CA . 51820 1
138 . 1 . 1 57 57 SER CB C 13 63.037 0.075 . 1 . . . . . 57 S CB . 51820 1
139 . 1 . 1 57 57 SER N N 15 115.545 0.142 . 1 . . . . . 57 S N . 51820 1
140 . 1 . 1 58 58 ILE C C 13 176.909 0.106 . 1 . . . . . 58 I C . 51820 1
141 . 1 . 1 58 58 ILE CA C 13 65.663 0.065 . 1 . . . . . 58 I CA . 51820 1
142 . 1 . 1 58 58 ILE CB C 13 36.823 0.042 . 1 . . . . . 58 I CB . 51820 1
143 . 1 . 1 58 58 ILE CG1 C 13 29.833 0.027 . 1 . . . . . 58 I CG1 . 51820 1
144 . 1 . 1 58 58 ILE CG2 C 13 18.779 0.055 . 1 . . . . . 58 I CG2 . 51820 1
145 . 1 . 1 58 58 ILE CD1 C 13 14.976 0.039 . 1 . . . . . 58 I CD1 . 51820 1
146 . 1 . 1 58 58 ILE N N 15 121.609 0.167 . 1 . . . . . 58 I N . 51820 1
147 . 1 . 1 59 59 MET C C 13 178.852 0.062 . 1 . . . . . 59 M C . 51820 1
148 . 1 . 1 59 59 MET CA C 13 55.456 0.087 . 1 . . . . . 59 M CA . 51820 1
149 . 1 . 1 59 59 MET CB C 13 28.795 0.103 . 1 . . . . . 59 M CB . 51820 1
150 . 1 . 1 59 59 MET CG C 13 31.096 0.131 . 1 . . . . . 59 M CG . 51820 1
151 . 1 . 1 59 59 MET CE C 13 15.400 0.038 . 1 . . . . . 59 M CE . 51820 1
152 . 1 . 1 59 59 MET N N 15 117.543 0.173 . 1 . . . . . 59 M N . 51820 1
153 . 1 . 1 60 60 ASN C C 13 178.051 0.070 . 1 . . . . . 60 N C . 51820 1
154 . 1 . 1 60 60 ASN CA C 13 58.058 0.056 . 1 . . . . . 60 N CA . 51820 1
155 . 1 . 1 60 60 ASN CB C 13 39.929 0.046 . 1 . . . . . 60 N CB . 51820 1
156 . 1 . 1 60 60 ASN CG C 13 181.341 0.000 . 1 . . . . . 60 N CG . 51820 1
157 . 1 . 1 60 60 ASN N N 15 119.641 0.137 . 1 . . . . . 60 N N . 51820 1
158 . 1 . 1 61 61 SER C C 13 175.885 0.075 . 1 . . . . . 61 S C . 51820 1
159 . 1 . 1 61 61 SER CA C 13 62.935 0.108 . 1 . . . . . 61 S CA . 51820 1
160 . 1 . 1 61 61 SER CB C 13 63.303 0.141 . 1 . . . . . 61 S CB . 51820 1
161 . 1 . 1 61 61 SER N N 15 116.240 0.105 . 1 . . . . . 61 S N . 51820 1
162 . 1 . 1 62 62 PHE C C 13 175.799 0.020 . 1 . . . . . 62 F C . 51820 1
163 . 1 . 1 62 62 PHE CA C 13 60.148 0.062 . 1 . . . . . 62 F CA . 51820 1
164 . 1 . 1 62 62 PHE CB C 13 38.272 0.042 . 1 . . . . . 62 F CB . 51820 1
165 . 1 . 1 62 62 PHE N N 15 124.817 0.092 . 1 . . . . . 62 F N . 51820 1
166 . 1 . 1 63 63 VAL C C 13 177.869 0.056 . 1 . . . . . 63 V C . 51820 1
167 . 1 . 1 63 63 VAL CA C 13 67.190 0.102 . 1 . . . . . 63 V CA . 51820 1
168 . 1 . 1 63 63 VAL CB C 13 31.683 0.045 . 1 . . . . . 63 V CB . 51820 1
169 . 1 . 1 63 63 VAL CG1 C 13 22.550 0.076 . 2 . . . . . 63 V CG1 . 51820 1
170 . 1 . 1 63 63 VAL N N 15 119.351 0.073 . 1 . . . . . 63 V N . 51820 1
171 . 1 . 1 64 64 ASN C C 13 177.023 0.128 . 1 . . . . . 64 N C . 51820 1
172 . 1 . 1 64 64 ASN CA C 13 57.008 0.068 . 1 . . . . . 64 N CA . 51820 1
173 . 1 . 1 64 64 ASN CB C 13 39.729 0.087 . 1 . . . . . 64 N CB . 51820 1
174 . 1 . 1 64 64 ASN N N 15 114.836 0.092 . 1 . . . . . 64 N N . 51820 1
175 . 1 . 1 65 65 ASP C C 13 177.762 0.102 . 1 . . . . . 65 D C . 51820 1
176 . 1 . 1 65 65 ASP CA C 13 56.819 0.096 . 1 . . . . . 65 D CA . 51820 1
177 . 1 . 1 65 65 ASP CB C 13 40.962 0.058 . 1 . . . . . 65 D CB . 51820 1
178 . 1 . 1 65 65 ASP CG C 13 180.240 0.045 . 1 . . . . . 65 D CG . 51820 1
179 . 1 . 1 65 65 ASP N N 15 119.401 0.118 . 1 . . . . . 65 D N . 51820 1
180 . 1 . 1 66 66 VAL C C 13 177.773 0.057 . 1 . . . . . 66 V C . 51820 1
181 . 1 . 1 66 66 VAL CA C 13 67.770 0.091 . 1 . . . . . 66 V CA . 51820 1
182 . 1 . 1 66 66 VAL CB C 13 30.808 0.057 . 1 . . . . . 66 V CB . 51820 1
183 . 1 . 1 66 66 VAL CG1 C 13 22.527 0.033 . 2 . . . . . 66 V CG1 . 51820 1
184 . 1 . 1 66 66 VAL CG2 C 13 23.346 0.057 . 2 . . . . . 66 V CG2 . 51820 1
185 . 1 . 1 66 66 VAL N N 15 116.780 0.112 . 1 . . . . . 66 V N . 51820 1
186 . 1 . 1 67 67 PHE C C 13 176.082 0.111 . 1 . . . . . 67 F C . 51820 1
187 . 1 . 1 67 67 PHE CA C 13 62.634 0.100 . 1 . . . . . 67 F CA . 51820 1
188 . 1 . 1 67 67 PHE CB C 13 39.033 0.086 . 1 . . . . . 67 F CB . 51820 1
189 . 1 . 1 67 67 PHE CD1 C 13 131.990 0.123 . 3 . . . . . 67 F CD# . 51820 1
190 . 1 . 1 67 67 PHE CD2 C 13 131.990 0.123 . 3 . . . . . 67 F CD# . 51820 1
191 . 1 . 1 67 67 PHE CE1 C 13 131.990 0.123 . 3 . . . . . 67 F CE# . 51820 1
192 . 1 . 1 67 67 PHE CE2 C 13 131.990 0.123 . 3 . . . . . 67 F CE# . 51820 1
193 . 1 . 1 67 67 PHE N N 15 120.467 0.159 . 1 . . . . . 67 F N . 51820 1
194 . 1 . 1 68 68 GLU C C 13 181.236 0.089 . 1 . . . . . 68 E C . 51820 1
195 . 1 . 1 68 68 GLU CA C 13 59.784 0.103 . 1 . . . . . 68 E CA . 51820 1
196 . 1 . 1 68 68 GLU CB C 13 29.878 0.055 . 1 . . . . . 68 E CB . 51820 1
197 . 1 . 1 68 68 GLU CG C 13 35.908 0.113 . 1 . . . . . 68 E CG . 51820 1
198 . 1 . 1 68 68 GLU CD C 13 184.191 0.205 . 1 . . . . . 68 E CD . 51820 1
199 . 1 . 1 68 68 GLU N N 15 119.233 0.205 . 1 . . . . . 68 E N . 51820 1
200 . 1 . 1 69 69 ARG C C 13 179.897 0.083 . 1 . . . . . 69 R C . 51820 1
201 . 1 . 1 69 69 ARG CA C 13 59.832 0.069 . 1 . . . . . 69 R CA . 51820 1
202 . 1 . 1 69 69 ARG CB C 13 31.847 0.144 . 1 . . . . . 69 R CB . 51820 1
203 . 1 . 1 69 69 ARG CG C 13 26.528 0.056 . 1 . . . . . 69 R CG . 51820 1
204 . 1 . 1 69 69 ARG CD C 13 45.245 0.082 . 1 . . . . . 69 R CD . 51820 1
205 . 1 . 1 69 69 ARG CZ C 13 159.965 0.000 . 1 . . . . . 69 R CZ . 51820 1
206 . 1 . 1 69 69 ARG N N 15 119.994 0.073 . 1 . . . . . 69 R N . 51820 1
207 . 1 . 1 70 70 ILE C C 13 177.123 0.119 . 1 . . . . . 70 I C . 51820 1
208 . 1 . 1 70 70 ILE CA C 13 65.245 0.113 . 1 . . . . . 70 I CA . 51820 1
209 . 1 . 1 70 70 ILE CB C 13 37.819 0.032 . 1 . . . . . 70 I CB . 51820 1
210 . 1 . 1 70 70 ILE CG1 C 13 29.687 0.061 . 1 . . . . . 70 I CG1 . 51820 1
211 . 1 . 1 70 70 ILE CG2 C 13 18.581 0.059 . 1 . . . . . 70 I CG2 . 51820 1
212 . 1 . 1 70 70 ILE CD1 C 13 14.304 0.035 . 1 . . . . . 70 I CD1 . 51820 1
213 . 1 . 1 70 70 ILE N N 15 118.852 0.167 . 1 . . . . . 70 I N . 51820 1
214 . 1 . 1 71 71 ALA C C 13 179.265 0.089 . 1 . . . . . 71 A C . 51820 1
215 . 1 . 1 71 71 ALA CA C 13 55.792 0.062 . 1 . . . . . 71 A CA . 51820 1
216 . 1 . 1 71 71 ALA CB C 13 16.388 0.049 . 1 . . . . . 71 A CB . 51820 1
217 . 1 . 1 71 71 ALA N N 15 122.354 0.097 . 1 . . . . . 71 A N . 51820 1
218 . 1 . 1 72 72 GLY C C 13 176.675 0.092 . 1 . . . . . 72 G C . 51820 1
219 . 1 . 1 72 72 GLY CA C 13 47.071 0.084 . 1 . . . . . 72 G CA . 51820 1
220 . 1 . 1 72 72 GLY N N 15 103.748 0.114 . 1 . . . . . 72 G N . 51820 1
221 . 1 . 1 73 73 GLU C C 13 178.612 0.163 . 1 . . . . . 73 E C . 51820 1
222 . 1 . 1 73 73 GLU CA C 13 58.587 0.093 . 1 . . . . . 73 E CA . 51820 1
223 . 1 . 1 73 73 GLU CB C 13 29.909 0.091 . 1 . . . . . 73 E CB . 51820 1
224 . 1 . 1 73 73 GLU CG C 13 36.702 0.020 . 1 . . . . . 73 E CG . 51820 1
225 . 1 . 1 73 73 GLU CD C 13 184.385 0.013 . 1 . . . . . 73 E CD . 51820 1
226 . 1 . 1 73 73 GLU N N 15 122.772 0.074 . 1 . . . . . 73 E N . 51820 1
227 . 1 . 1 74 74 ALA C C 13 178.509 0.117 . 1 . . . . . 74 A C . 51820 1
228 . 1 . 1 74 74 ALA CA C 13 55.269 0.058 . 1 . . . . . 74 A CA . 51820 1
229 . 1 . 1 74 74 ALA CB C 13 18.043 0.048 . 1 . . . . . 74 A CB . 51820 1
230 . 1 . 1 74 74 ALA N N 15 122.162 0.126 . 1 . . . . . 74 A N . 51820 1
231 . 1 . 1 75 75 SER C C 13 178.553 0.063 . 1 . . . . . 75 S C . 51820 1
232 . 1 . 1 75 75 SER CA C 13 60.807 0.070 . 1 . . . . . 75 S CA . 51820 1
233 . 1 . 1 75 75 SER CB C 13 63.631 0.054 . 1 . . . . . 75 S CB . 51820 1
234 . 1 . 1 75 75 SER N N 15 111.047 0.074 . 1 . . . . . 75 S N . 51820 1
235 . 1 . 1 76 76 ARG C C 13 177.694 0.129 . 1 . . . . . 76 R C . 51820 1
236 . 1 . 1 76 76 ARG CA C 13 59.854 0.107 . 1 . . . . . 76 R CA . 51820 1
237 . 1 . 1 76 76 ARG CB C 13 30.204 0.032 . 1 . . . . . 76 R CB . 51820 1
238 . 1 . 1 76 76 ARG CG C 13 28.635 0.121 . 1 . . . . . 76 R CG . 51820 1
239 . 1 . 1 76 76 ARG CD C 13 43.202 0.129 . 1 . . . . . 76 R CD . 51820 1
240 . 1 . 1 76 76 ARG CZ C 13 159.121 0.000 . 1 . . . . . 76 R CZ . 51820 1
241 . 1 . 1 76 76 ARG N N 15 121.838 0.132 . 1 . . . . . 76 R N . 51820 1
242 . 1 . 1 77 77 LEU C C 13 179.716 0.134 . 1 . . . . . 77 L C . 51820 1
243 . 1 . 1 77 77 LEU CA C 13 58.627 0.079 . 1 . . . . . 77 L CA . 51820 1
244 . 1 . 1 77 77 LEU CB C 13 43.274 0.118 . 1 . . . . . 77 L CB . 51820 1
245 . 1 . 1 77 77 LEU CG C 13 27.160 0.000 . 1 . . . . . 77 L CG . 51820 1
246 . 1 . 1 77 77 LEU CD2 C 13 25.010 0.000 . 2 . . . . . 77 L CD2 . 51820 1
247 . 1 . 1 77 77 LEU N N 15 119.025 0.215 . 1 . . . . . 77 L N . 51820 1
248 . 1 . 1 78 78 ALA C C 13 179.405 0.048 . 1 . . . . . 78 A C . 51820 1
249 . 1 . 1 78 78 ALA CA C 13 55.813 0.041 . 1 . . . . . 78 A CA . 51820 1
250 . 1 . 1 78 78 ALA CB C 13 16.961 0.042 . 1 . . . . . 78 A CB . 51820 1
251 . 1 . 1 78 78 ALA N N 15 121.520 0.196 . 1 . . . . . 78 A N . 51820 1
252 . 1 . 1 79 79 HIS C C 13 180.878 0.180 . 1 . . . . . 79 H C . 51820 1
253 . 1 . 1 79 79 HIS CA C 13 60.167 0.051 . 1 . . . . . 79 H CA . 51820 1
254 . 1 . 1 79 79 HIS CB C 13 33.837 0.015 . 1 . . . . . 79 H CB . 51820 1
255 . 1 . 1 79 79 HIS CG C 13 132.562 0.000 . 1 . . . . . 79 H CG . 51820 1
256 . 1 . 1 79 79 HIS N N 15 117.797 0.092 . 1 . . . . . 79 H N . 51820 1
257 . 1 . 1 80 80 TYR C C 13 177.460 0.043 . 1 . . . . . 80 Y C . 51820 1
258 . 1 . 1 80 80 TYR CA C 13 57.689 0.176 . 1 . . . . . 80 Y CA . 51820 1
259 . 1 . 1 80 80 TYR CB C 13 43.182 0.088 . 1 . . . . . 80 Y CB . 51820 1
260 . 1 . 1 80 80 TYR N N 15 121.942 0.179 . 1 . . . . . 80 Y N . 51820 1
261 . 1 . 1 81 81 ASN C C 13 172.617 0.068 . 1 . . . . . 81 N C . 51820 1
262 . 1 . 1 81 81 ASN CA C 13 54.145 0.082 . 1 . . . . . 81 N CA . 51820 1
263 . 1 . 1 81 81 ASN CB C 13 40.407 0.091 . 1 . . . . . 81 N CB . 51820 1
264 . 1 . 1 81 81 ASN CG C 13 179.480 0.061 . 1 . . . . . 81 N CG . 51820 1
265 . 1 . 1 81 81 ASN N N 15 114.317 0.100 . 1 . . . . . 81 N N . 51820 1
266 . 1 . 1 82 82 LYS C C 13 175.811 0.119 . 1 . . . . . 82 K C . 51820 1
267 . 1 . 1 82 82 LYS CA C 13 57.368 0.100 . 1 . . . . . 82 K CA . 51820 1
268 . 1 . 1 82 82 LYS CB C 13 29.184 0.104 . 1 . . . . . 82 K CB . 51820 1
269 . 1 . 1 82 82 LYS CG C 13 25.274 0.036 . 1 . . . . . 82 K CG . 51820 1
270 . 1 . 1 82 82 LYS CD C 13 28.252 0.000 . 1 . . . . . 82 K CD . 51820 1
271 . 1 . 1 82 82 LYS CE C 13 42.198 0.059 . 1 . . . . . 82 K CE . 51820 1
272 . 1 . 1 82 82 LYS N N 15 116.274 0.117 . 1 . . . . . 82 K N . 51820 1
273 . 1 . 1 83 83 ARG C C 13 177.435 0.090 . 1 . . . . . 83 R C . 51820 1
274 . 1 . 1 83 83 ARG CA C 13 53.524 0.074 . 1 . . . . . 83 R CA . 51820 1
275 . 1 . 1 83 83 ARG CB C 13 33.090 0.092 . 1 . . . . . 83 R CB . 51820 1
276 . 1 . 1 83 83 ARG CG C 13 27.194 0.097 . 1 . . . . . 83 R CG . 51820 1
277 . 1 . 1 83 83 ARG CD C 13 43.594 0.080 . 1 . . . . . 83 R CD . 51820 1
278 . 1 . 1 83 83 ARG N N 15 117.142 0.120 . 1 . . . . . 83 R N . 51820 1
279 . 1 . 1 84 84 SER C C 13 172.574 0.080 . 1 . . . . . 84 S C . 51820 1
280 . 1 . 1 84 84 SER CA C 13 59.686 0.085 . 1 . . . . . 84 S CA . 51820 1
281 . 1 . 1 84 84 SER CB C 13 64.469 0.071 . 1 . . . . . 84 S CB . 51820 1
282 . 1 . 1 84 84 SER N N 15 117.857 0.154 . 1 . . . . . 84 S N . 51820 1
283 . 1 . 1 85 85 THR C C 13 174.887 0.058 . 1 . . . . . 85 T C . 51820 1
284 . 1 . 1 85 85 THR CA C 13 60.882 0.061 . 1 . . . . . 85 T CA . 51820 1
285 . 1 . 1 85 85 THR CB C 13 69.562 0.078 . 1 . . . . . 85 T CB . 51820 1
286 . 1 . 1 85 85 THR CG2 C 13 21.365 0.082 . 1 . . . . . 85 T CG2 . 51820 1
287 . 1 . 1 85 85 THR N N 15 116.024 0.132 . 1 . . . . . 85 T N . 51820 1
288 . 1 . 1 86 86 ILE C C 13 173.888 0.100 . 1 . . . . . 86 I C . 51820 1
289 . 1 . 1 86 86 ILE CA C 13 62.670 0.068 . 1 . . . . . 86 I CA . 51820 1
290 . 1 . 1 86 86 ILE CB C 13 39.448 0.727 . 1 . . . . . 86 I CB . 51820 1
291 . 1 . 1 86 86 ILE CG1 C 13 28.986 0.069 . 1 . . . . . 86 I CG1 . 51820 1
292 . 1 . 1 86 86 ILE CG2 C 13 17.639 0.035 . 1 . . . . . 86 I CG2 . 51820 1
293 . 1 . 1 86 86 ILE CD1 C 13 13.757 0.046 . 1 . . . . . 86 I CD1 . 51820 1
294 . 1 . 1 86 86 ILE N N 15 123.484 0.133 . 1 . . . . . 86 I N . 51820 1
295 . 1 . 1 87 87 THR C C 13 176.828 0.120 . 1 . . . . . 87 T C . 51820 1
296 . 1 . 1 87 87 THR CA C 13 60.253 0.068 . 1 . . . . . 87 T CA . 51820 1
297 . 1 . 1 87 87 THR CB C 13 73.673 0.054 . 1 . . . . . 87 T CB . 51820 1
298 . 1 . 1 87 87 THR CG2 C 13 21.927 0.056 . 1 . . . . . 87 T CG2 . 51820 1
299 . 1 . 1 87 87 THR N N 15 121.717 0.094 . 1 . . . . . 87 T N . 51820 1
300 . 1 . 1 88 88 SER C C 13 174.515 0.064 . 1 . . . . . 88 S C . 51820 1
301 . 1 . 1 88 88 SER CA C 13 62.334 0.138 . 1 . . . . . 88 S CA . 51820 1
302 . 1 . 1 88 88 SER N N 15 116.973 0.123 . 1 . . . . . 88 S N . 51820 1
303 . 1 . 1 89 89 ARG C C 13 178.934 0.140 . 1 . . . . . 89 R C . 51820 1
304 . 1 . 1 89 89 ARG CA C 13 59.918 0.080 . 1 . . . . . 89 R CA . 51820 1
305 . 1 . 1 89 89 ARG CB C 13 30.277 0.024 . 1 . . . . . 89 R CB . 51820 1
306 . 1 . 1 89 89 ARG CG C 13 26.700 0.000 . 1 . . . . . 89 R CG . 51820 1
307 . 1 . 1 89 89 ARG CD C 13 43.298 0.054 . 1 . . . . . 89 R CD . 51820 1
308 . 1 . 1 89 89 ARG N N 15 122.108 0.160 . 1 . . . . . 89 R N . 51820 1
309 . 1 . 1 90 90 GLU C C 13 177.916 0.066 . 1 . . . . . 90 E C . 51820 1
310 . 1 . 1 90 90 GLU CA C 13 61.910 0.110 . 1 . . . . . 90 E CA . 51820 1
311 . 1 . 1 90 90 GLU CB C 13 30.101 0.037 . 1 . . . . . 90 E CB . 51820 1
312 . 1 . 1 90 90 GLU CG C 13 36.997 0.005 . 1 . . . . . 90 E CG . 51820 1
313 . 1 . 1 90 90 GLU CD C 13 181.368 0.072 . 1 . . . . . 90 E CD . 51820 1
314 . 1 . 1 90 90 GLU N N 15 117.946 0.190 . 1 . . . . . 90 E N . 51820 1
315 . 1 . 1 91 91 ILE C C 13 176.233 0.105 . 1 . . . . . 91 I C . 51820 1
316 . 1 . 1 91 91 ILE CA C 13 62.085 0.087 . 1 . . . . . 91 I CA . 51820 1
317 . 1 . 1 91 91 ILE CB C 13 33.869 0.081 . 1 . . . . . 91 I CB . 51820 1
318 . 1 . 1 91 91 ILE CG1 C 13 25.620 0.050 . 1 . . . . . 91 I CG1 . 51820 1
319 . 1 . 1 91 91 ILE CG2 C 13 18.680 0.034 . 1 . . . . . 91 I CG2 . 51820 1
320 . 1 . 1 91 91 ILE CD1 C 13 7.381 0.039 . 1 . . . . . 91 I CD1 . 51820 1
321 . 1 . 1 91 91 ILE N N 15 116.085 0.190 . 1 . . . . . 91 I N . 51820 1
322 . 1 . 1 92 92 GLN C C 13 177.472 0.123 . 1 . . . . . 92 Q C . 51820 1
323 . 1 . 1 92 92 GLN CA C 13 60.109 0.062 . 1 . . . . . 92 Q CA . 51820 1
324 . 1 . 1 92 92 GLN CB C 13 29.663 0.058 . 1 . . . . . 92 Q CB . 51820 1
325 . 1 . 1 92 92 GLN CG C 13 34.002 0.043 . 1 . . . . . 92 Q CG . 51820 1
326 . 1 . 1 92 92 GLN CD C 13 181.415 0.138 . 1 . . . . . 92 Q CD . 51820 1
327 . 1 . 1 92 92 GLN N N 15 119.111 0.161 . 1 . . . . . 92 Q N . 51820 1
328 . 1 . 1 92 92 GLN NE2 N 15 113.486 0.040 . 1 . . . . . 92 Q NE2 . 51820 1
329 . 1 . 1 93 93 THR C C 13 175.338 0.044 . 1 . . . . . 93 T C . 51820 1
330 . 1 . 1 93 93 THR CA C 13 66.500 0.122 . 1 . . . . . 93 T CA . 51820 1
331 . 1 . 1 93 93 THR CB C 13 67.061 0.087 . 1 . . . . . 93 T CB . 51820 1
332 . 1 . 1 93 93 THR CG2 C 13 24.666 0.069 . 1 . . . . . 93 T CG2 . 51820 1
333 . 1 . 1 93 93 THR N N 15 115.766 0.106 . 1 . . . . . 93 T N . 51820 1
334 . 1 . 1 94 94 ALA C C 13 179.234 0.057 . 1 . . . . . 94 A C . 51820 1
335 . 1 . 1 94 94 ALA CA C 13 55.958 0.106 . 1 . . . . . 94 A CA . 51820 1
336 . 1 . 1 94 94 ALA CB C 13 19.736 0.040 . 1 . . . . . 94 A CB . 51820 1
337 . 1 . 1 94 94 ALA N N 15 122.767 0.151 . 1 . . . . . 94 A N . 51820 1
338 . 1 . 1 95 95 VAL C C 13 176.933 0.031 . 1 . . . . . 95 V C . 51820 1
339 . 1 . 1 95 95 VAL CA C 13 67.542 0.055 . 1 . . . . . 95 V CA . 51820 1
340 . 1 . 1 95 95 VAL CB C 13 31.627 0.000 . 1 . . . . . 95 V CB . 51820 1
341 . 1 . 1 95 95 VAL CG1 C 13 25.370 0.000 . 2 . . . . . 95 V CG1 . 51820 1
342 . 1 . 1 95 95 VAL N N 15 117.494 0.105 . 1 . . . . . 95 V N . 51820 1
343 . 1 . 1 96 96 ARG C C 13 179.007 0.036 . 1 . . . . . 96 R C . 51820 1
344 . 1 . 1 96 96 ARG CA C 13 59.521 0.024 . 1 . . . . . 96 R CA . 51820 1
345 . 1 . 1 96 96 ARG CB C 13 30.143 0.107 . 1 . . . . . 96 R CB . 51820 1
346 . 1 . 1 96 96 ARG CG C 13 28.366 0.058 . 1 . . . . . 96 R CG . 51820 1
347 . 1 . 1 96 96 ARG CD C 13 43.998 0.064 . 1 . . . . . 96 R CD . 51820 1
348 . 1 . 1 96 96 ARG CZ C 13 159.866 0.000 . 1 . . . . . 96 R CZ . 51820 1
349 . 1 . 1 96 96 ARG N N 15 118.069 0.083 . 1 . . . . . 96 R N . 51820 1
350 . 1 . 1 97 97 LEU C C 13 178.594 0.115 . 1 . . . . . 97 L C . 51820 1
351 . 1 . 1 97 97 LEU CA C 13 57.063 0.048 . 1 . . . . . 97 L CA . 51820 1
352 . 1 . 1 97 97 LEU CB C 13 43.241 0.061 . 1 . . . . . 97 L CB . 51820 1
353 . 1 . 1 97 97 LEU CD1 C 13 26.654 0.062 . 2 . . . . . 97 L CD1 . 51820 1
354 . 1 . 1 97 97 LEU CD2 C 13 22.691 0.028 . 2 . . . . . 97 L CD2 . 51820 1
355 . 1 . 1 97 97 LEU N N 15 118.035 0.056 . 1 . . . . . 97 L N . 51820 1
356 . 1 . 1 98 98 LEU C C 13 177.831 0.129 . 1 . . . . . 98 L C . 51820 1
357 . 1 . 1 98 98 LEU CA C 13 56.567 0.095 . 1 . . . . . 98 L CA . 51820 1
358 . 1 . 1 98 98 LEU CB C 13 44.971 0.040 . 1 . . . . . 98 L CB . 51820 1
359 . 1 . 1 98 98 LEU CG C 13 27.721 0.042 . 1 . . . . . 98 L CG . 51820 1
360 . 1 . 1 98 98 LEU CD1 C 13 25.474 0.179 . 2 . . . . . 98 L CD1 . 51820 1
361 . 1 . 1 98 98 LEU CD2 C 13 23.509 0.012 . 2 . . . . . 98 L CD2 . 51820 1
362 . 1 . 1 98 98 LEU N N 15 116.879 0.096 . 1 . . . . . 98 L N . 51820 1
363 . 1 . 1 99 99 LEU C C 13 174.205 0.069 . 1 . . . . . 99 L C . 51820 1
364 . 1 . 1 99 99 LEU CA C 13 52.676 0.075 . 1 . . . . . 99 L CA . 51820 1
365 . 1 . 1 99 99 LEU CB C 13 40.686 0.056 . 1 . . . . . 99 L CB . 51820 1
366 . 1 . 1 99 99 LEU CG C 13 29.015 0.045 . 1 . . . . . 99 L CG . 51820 1
367 . 1 . 1 99 99 LEU CD1 C 13 26.024 0.071 . 2 . . . . . 99 L CD1 . 51820 1
368 . 1 . 1 99 99 LEU CD2 C 13 25.312 0.037 . 2 . . . . . 99 L CD2 . 51820 1
369 . 1 . 1 99 99 LEU N N 15 119.120 0.128 . 1 . . . . . 99 L N . 51820 1
370 . 1 . 1 100 100 PRO C C 13 177.002 0.189 . 1 . . . . . 100 P C . 51820 1
371 . 1 . 1 100 100 PRO CA C 13 62.392 0.053 . 1 . . . . . 100 P CA . 51820 1
372 . 1 . 1 100 100 PRO CB C 13 32.312 0.073 . 1 . . . . . 100 P CB . 51820 1
373 . 1 . 1 100 100 PRO CG C 13 27.505 0.033 . 1 . . . . . 100 P CG . 51820 1
374 . 1 . 1 100 100 PRO CD C 13 50.634 0.065 . 1 . . . . . 100 P CD . 51820 1
375 . 1 . 1 100 100 PRO N N 15 132.972 0.080 . 1 . . . . . 100 P N . 51820 1
376 . 1 . 1 101 101 GLY C C 13 176.202 0.066 . 1 . . . . . 101 G C . 51820 1
377 . 1 . 1 101 101 GLY CA C 13 48.275 0.074 . 1 . . . . . 101 G CA . 51820 1
378 . 1 . 1 101 101 GLY N N 15 105.472 0.149 . 1 . . . . . 101 G N . 51820 1
379 . 1 . 1 102 102 GLU C C 13 178.739 0.080 . 1 . . . . . 102 E C . 51820 1
380 . 1 . 1 102 102 GLU CA C 13 59.096 0.085 . 1 . . . . . 102 E CA . 51820 1
381 . 1 . 1 102 102 GLU CB C 13 29.197 0.080 . 1 . . . . . 102 E CB . 51820 1
382 . 1 . 1 102 102 GLU CG C 13 36.873 0.081 . 1 . . . . . 102 E CG . 51820 1
383 . 1 . 1 102 102 GLU CD C 13 184.023 0.073 . 1 . . . . . 102 E CD . 51820 1
384 . 1 . 1 102 102 GLU N N 15 128.430 0.173 . 1 . . . . . 102 E N . 51820 1
385 . 1 . 1 103 103 LEU C C 13 179.563 0.085 . 1 . . . . . 103 L C . 51820 1
386 . 1 . 1 103 103 LEU CA C 13 58.144 0.166 . 1 . . . . . 103 L CA . 51820 1
387 . 1 . 1 103 103 LEU CB C 13 41.065 0.071 . 1 . . . . . 103 L CB . 51820 1
388 . 1 . 1 103 103 LEU CD1 C 13 26.910 0.055 . 2 . . . . . 103 L CD1 . 51820 1
389 . 1 . 1 103 103 LEU CD2 C 13 23.750 0.048 . 2 . . . . . 103 L CD2 . 51820 1
390 . 1 . 1 103 103 LEU N N 15 122.093 0.230 . 1 . . . . . 103 L N . 51820 1
391 . 1 . 1 104 104 ALA C C 13 179.213 0.148 . 1 . . . . . 104 A C . 51820 1
392 . 1 . 1 104 104 ALA CA C 13 55.477 0.187 . 1 . . . . . 104 A CA . 51820 1
393 . 1 . 1 104 104 ALA CB C 13 18.919 0.043 . 1 . . . . . 104 A CB . 51820 1
394 . 1 . 1 104 104 ALA N N 15 118.440 0.172 . 1 . . . . . 104 A N . 51820 1
395 . 1 . 1 105 105 LYS C C 13 180.313 0.078 . 1 . . . . . 105 K C . 51820 1
396 . 1 . 1 105 105 LYS CA C 13 59.742 0.094 . 1 . . . . . 105 K CA . 51820 1
397 . 1 . 1 105 105 LYS CB C 13 32.457 0.087 . 1 . . . . . 105 K CB . 51820 1
398 . 1 . 1 105 105 LYS CG C 13 24.872 0.073 . 1 . . . . . 105 K CG . 51820 1
399 . 1 . 1 105 105 LYS CD C 13 29.486 0.190 . 1 . . . . . 105 K CD . 51820 1
400 . 1 . 1 105 105 LYS CE C 13 42.058 0.055 . 1 . . . . . 105 K CE . 51820 1
401 . 1 . 1 105 105 LYS N N 15 116.998 0.200 . 1 . . . . . 105 K N . 51820 1
402 . 1 . 1 106 106 HIS C C 13 177.284 0.146 . 1 . . . . . 106 H C . 51820 1
403 . 1 . 1 106 106 HIS CA C 13 58.878 0.106 . 1 . . . . . 106 H CA . 51820 1
404 . 1 . 1 106 106 HIS N N 15 118.814 0.110 . 1 . . . . . 106 H N . 51820 1
405 . 1 . 1 107 107 ALA C C 13 179.326 0.130 . 1 . . . . . 107 A C . 51820 1
406 . 1 . 1 107 107 ALA CA C 13 55.543 0.081 . 1 . . . . . 107 A CA . 51820 1
407 . 1 . 1 107 107 ALA CB C 13 19.668 0.060 . 1 . . . . . 107 A CB . 51820 1
408 . 1 . 1 107 107 ALA N N 15 123.258 0.029 . 1 . . . . . 107 A N . 51820 1
409 . 1 . 1 108 108 VAL C C 13 180.066 0.100 . 1 . . . . . 108 V C . 51820 1
410 . 1 . 1 108 108 VAL CA C 13 64.553 0.108 . 1 . . . . . 108 V CA . 51820 1
411 . 1 . 1 108 108 VAL CB C 13 31.914 0.000 . 1 . . . . . 108 V CB . 51820 1
412 . 1 . 1 108 108 VAL CG1 C 13 22.952 0.114 . 2 . . . . . 108 V CG1 . 51820 1
413 . 1 . 1 108 108 VAL CG2 C 13 20.551 0.029 . 2 . . . . . 108 V CG2 . 51820 1
414 . 1 . 1 108 108 VAL N N 15 117.311 0.112 . 1 . . . . . 108 V N . 51820 1
415 . 1 . 1 109 109 SER C C 13 177.434 0.069 . 1 . . . . . 109 S C . 51820 1
416 . 1 . 1 109 109 SER CA C 13 61.797 0.096 . 1 . . . . . 109 S CA . 51820 1
417 . 1 . 1 109 109 SER CB C 13 62.606 0.037 . 1 . . . . . 109 S CB . 51820 1
418 . 1 . 1 109 109 SER N N 15 117.532 0.125 . 1 . . . . . 109 S N . 51820 1
419 . 1 . 1 110 110 GLU C C 13 180.269 0.120 . 1 . . . . . 110 E C . 51820 1
420 . 1 . 1 110 110 GLU CA C 13 58.875 0.079 . 1 . . . . . 110 E CA . 51820 1
421 . 1 . 1 110 110 GLU CB C 13 28.765 0.071 . 1 . . . . . 110 E CB . 51820 1
422 . 1 . 1 110 110 GLU CG C 13 36.201 0.062 . 1 . . . . . 110 E CG . 51820 1
423 . 1 . 1 110 110 GLU CD C 13 183.447 0.085 . 1 . . . . . 110 E CD . 51820 1
424 . 1 . 1 110 110 GLU N N 15 120.005 0.111 . 1 . . . . . 110 E N . 51820 1
425 . 1 . 1 111 111 GLY C C 13 174.905 0.064 . 1 . . . . . 111 G C . 51820 1
426 . 1 . 1 111 111 GLY CA C 13 46.828 0.091 . 1 . . . . . 111 G CA . 51820 1
427 . 1 . 1 111 111 GLY N N 15 109.563 0.127 . 1 . . . . . 111 G N . 51820 1
428 . 1 . 1 112 112 THR C C 13 177.609 0.114 . 1 . . . . . 112 T C . 51820 1
429 . 1 . 1 112 112 THR CA C 13 66.818 0.090 . 1 . . . . . 112 T CA . 51820 1
430 . 1 . 1 112 112 THR CB C 13 69.007 0.091 . 1 . . . . . 112 T CB . 51820 1
431 . 1 . 1 112 112 THR CG2 C 13 21.375 0.033 . 1 . . . . . 112 T CG2 . 51820 1
432 . 1 . 1 112 112 THR N N 15 116.670 0.156 . 1 . . . . . 112 T N . 51820 1
433 . 1 . 1 113 113 LYS C C 13 178.729 0.078 . 1 . . . . . 113 K C . 51820 1
434 . 1 . 1 113 113 LYS CA C 13 59.995 0.061 . 1 . . . . . 113 K CA . 51820 1
435 . 1 . 1 113 113 LYS CB C 13 32.522 0.034 . 1 . . . . . 113 K CB . 51820 1
436 . 1 . 1 113 113 LYS N N 15 123.934 0.110 . 1 . . . . . 113 K N . 51820 1
437 . 1 . 1 114 114 ALA C C 13 179.576 0.090 . 1 . . . . . 114 A C . 51820 1
438 . 1 . 1 114 114 ALA CA C 13 55.227 0.099 . 1 . . . . . 114 A CA . 51820 1
439 . 1 . 1 114 114 ALA CB C 13 19.463 0.053 . 1 . . . . . 114 A CB . 51820 1
440 . 1 . 1 114 114 ALA N N 15 121.880 0.117 . 1 . . . . . 114 A N . 51820 1
441 . 1 . 1 115 115 VAL C C 13 179.370 0.129 . 1 . . . . . 115 V C . 51820 1
442 . 1 . 1 115 115 VAL CA C 13 67.685 0.144 . 1 . . . . . 115 V CA . 51820 1
443 . 1 . 1 115 115 VAL CB C 13 31.718 0.090 . 1 . . . . . 115 V CB . 51820 1
444 . 1 . 1 115 115 VAL CG1 C 13 22.516 0.048 . 2 . . . . . 115 V CG1 . 51820 1
445 . 1 . 1 115 115 VAL CG2 C 13 25.014 0.042 . 2 . . . . . 115 V CG2 . 51820 1
446 . 1 . 1 115 115 VAL N N 15 117.794 0.131 . 1 . . . . . 115 V N . 51820 1
447 . 1 . 1 116 116 THR C C 13 176.847 0.084 . 1 . . . . . 116 T C . 51820 1
448 . 1 . 1 116 116 THR CA C 13 67.291 0.082 . 1 . . . . . 116 T CA . 51820 1
449 . 1 . 1 116 116 THR CB C 13 68.677 0.095 . 1 . . . . . 116 T CB . 51820 1
450 . 1 . 1 116 116 THR CG2 C 13 21.748 0.085 . 1 . . . . . 116 T CG2 . 51820 1
451 . 1 . 1 116 116 THR N N 15 120.226 0.202 . 1 . . . . . 116 T N . 51820 1
452 . 1 . 1 117 117 LYS C C 13 178.895 0.071 . 1 . . . . . 117 K C . 51820 1
453 . 1 . 1 117 117 LYS CA C 13 60.126 0.080 . 1 . . . . . 117 K CA . 51820 1
454 . 1 . 1 117 117 LYS CB C 13 32.577 0.057 . 1 . . . . . 117 K CB . 51820 1
455 . 1 . 1 117 117 LYS CG C 13 24.919 0.031 . 1 . . . . . 117 K CG . 51820 1
456 . 1 . 1 117 117 LYS N N 15 124.002 0.155 . 1 . . . . . 117 K N . 51820 1
457 . 1 . 1 118 118 TYR C C 13 177.577 0.068 . 1 . . . . . 118 Y C . 51820 1
458 . 1 . 1 118 118 TYR CA C 13 61.869 0.113 . 1 . . . . . 118 Y CA . 51820 1
459 . 1 . 1 118 118 TYR CB C 13 39.953 0.005 . 1 . . . . . 118 Y CB . 51820 1
460 . 1 . 1 118 118 TYR N N 15 118.974 0.122 . 1 . . . . . 118 Y N . 51820 1
461 . 1 . 1 119 119 THR C C 13 176.111 0.089 . 1 . . . . . 119 T C . 51820 1
462 . 1 . 1 119 119 THR CA C 13 65.241 0.088 . 1 . . . . . 119 T CA . 51820 1
463 . 1 . 1 119 119 THR CB C 13 69.507 0.065 . 1 . . . . . 119 T CB . 51820 1
464 . 1 . 1 119 119 THR CG2 C 13 21.820 0.058 . 1 . . . . . 119 T CG2 . 51820 1
465 . 1 . 1 119 119 THR N N 15 111.448 0.211 . 1 . . . . . 119 T N . 51820 1
466 . 1 . 1 120 120 SER C C 13 174.139 0.115 . 1 . . . . . 120 S C . 51820 1
467 . 1 . 1 120 120 SER CA C 13 59.773 0.121 . 1 . . . . . 120 S CA . 51820 1
468 . 1 . 1 120 120 SER CB C 13 63.996 0.038 . 1 . . . . . 120 S CB . 51820 1
469 . 1 . 1 120 120 SER N N 15 116.132 0.140 . 1 . . . . . 120 S N . 51820 1
470 . 1 . 1 121 121 ALA C C 13 176.811 0.053 . 1 . . . . . 121 A C . 51820 1
471 . 1 . 1 121 121 ALA CA C 13 52.368 0.091 . 1 . . . . . 121 A CA . 51820 1
472 . 1 . 1 121 121 ALA CB C 13 19.566 0.055 . 1 . . . . . 121 A CB . 51820 1
473 . 1 . 1 121 121 ALA N N 15 125.291 0.174 . 1 . . . . . 121 A N . 51820 1
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