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 16482
_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 1H-15N HSQC' . . . 16482 1
2 '2D 1H-13C HSQC' . . . 16482 1
3 '3D CBCA(CO)NH' . . . 16482 1
4 '3D C(CO)NH' . . . 16482 1
5 '3D HNCO' . . . 16482 1
6 '3D HCCH-TOCSY' . . . 16482 1
7 '3D 1H-15N NOESY' . . . 16482 1
8 '3D 1H-13C NOESY' . . . 16482 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 GLY HA2 H 1 3.846 0.003 8 2 . . . . 1 G QA . 16482 1
2 . 1 1 1 1 GLY HA3 H 1 3.846 0.003 8 2 . . . . 1 G QA . 16482 1
3 . 1 1 1 1 GLY CA C 13 44.274 0.019 6 1 . . . . 1 G CA . 16482 1
4 . 1 1 2 2 SER HA H 1 4.515 0.002 6 1 . . . . 2 S HA . 16482 1
5 . 1 1 2 2 SER HB2 H 1 3.913 0.002 4 2 . . . . 2 S QB . 16482 1
6 . 1 1 2 2 SER HB3 H 1 3.913 0.002 4 2 . . . . 2 S QB . 16482 1
7 . 1 1 2 2 SER CA C 13 58.521 0.033 8 1 . . . . 2 S CA . 16482 1
8 . 1 1 2 2 SER CB C 13 63.800 0.075 5 1 . . . . 2 S CB . 16482 1
9 . 1 1 3 3 GLU H H 1 8.743 0.009 3 1 . . . . 3 E H . 16482 1
10 . 1 1 3 3 GLU HA H 1 4.317 0.006 13 1 . . . . 3 E HA . 16482 1
11 . 1 1 3 3 GLU HB2 H 1 2.090 0.007 8 2 . . . . 3 E HB2 . 16482 1
12 . 1 1 3 3 GLU HB3 H 1 1.988 0.006 8 2 . . . . 3 E HB3 . 16482 1
13 . 1 1 3 3 GLU HG2 H 1 2.312 0.005 12 2 . . . . 3 E QG . 16482 1
14 . 1 1 3 3 GLU HG3 H 1 2.312 0.005 12 2 . . . . 3 E QG . 16482 1
15 . 1 1 3 3 GLU C C 13 178.609 0.000 1 1 . . . . 3 E C . 16482 1
16 . 1 1 3 3 GLU CA C 13 57.192 0.067 13 1 . . . . 3 E CA . 16482 1
17 . 1 1 3 3 GLU CB C 13 29.943 0.026 15 1 . . . . 3 E CB . 16482 1
18 . 1 1 3 3 GLU CG C 13 36.289 0.014 9 1 . . . . 3 E CG . 16482 1
19 . 1 1 3 3 GLU N N 15 122.160 0.063 3 1 . . . . 3 E N . 16482 1
20 . 1 1 4 4 GLY H H 1 8.390 0.023 8 1 . . . . 4 G H . 16482 1
21 . 1 1 4 4 GLY HA2 H 1 3.938 0.003 15 2 . . . . 4 G QA . 16482 1
22 . 1 1 4 4 GLY HA3 H 1 3.938 0.003 15 2 . . . . 4 G QA . 16482 1
23 . 1 1 4 4 GLY CA C 13 45.376 0.045 12 1 . . . . 4 G CA . 16482 1
24 . 1 1 4 4 GLY N N 15 109.179 0.032 7 1 . . . . 4 G N . 16482 1
25 . 1 1 5 5 LYS H H 1 8.124 0.007 5 1 . . . . 5 K H . 16482 1
26 . 1 1 5 5 LYS HA H 1 4.406 0.006 20 1 . . . . 5 K HA . 16482 1
27 . 1 1 5 5 LYS HB2 H 1 1.772 0.011 16 2 . . . . 5 K HB2 . 16482 1
28 . 1 1 5 5 LYS HB3 H 1 1.647 0.012 15 2 . . . . 5 K HB3 . 16482 1
29 . 1 1 5 5 LYS HD2 H 1 1.416 0.004 9 2 . . . . 5 K QD . 16482 1
30 . 1 1 5 5 LYS HD3 H 1 1.416 0.004 9 2 . . . . 5 K QD . 16482 1
31 . 1 1 5 5 LYS HE2 H 1 2.991 0.012 3 2 . . . . 5 K QE . 16482 1
32 . 1 1 5 5 LYS HE3 H 1 2.991 0.012 3 2 . . . . 5 K QE . 16482 1
33 . 1 1 5 5 LYS HG2 H 1 1.293 0.011 14 2 . . . . 5 K HG2 . 16482 1
34 . 1 1 5 5 LYS HG3 H 1 1.243 0.009 9 2 . . . . 5 K HG3 . 16482 1
35 . 1 1 5 5 LYS CA C 13 56.418 0.033 15 1 . . . . 5 K CA . 16482 1
36 . 1 1 5 5 LYS CB C 13 33.119 0.044 32 1 . . . . 5 K CB . 16482 1
37 . 1 1 5 5 LYS CD C 13 29.254 0.020 7 1 . . . . 5 K CD . 16482 1
38 . 1 1 5 5 LYS CE C 13 42.333 0.048 2 1 . . . . 5 K CE . 16482 1
39 . 1 1 5 5 LYS CG C 13 25.026 0.047 18 1 . . . . 5 K CG . 16482 1
40 . 1 1 5 5 LYS N N 15 120.708 0.026 5 1 . . . . 5 K N . 16482 1
41 . 1 1 6 6 THR H H 1 7.274 0.003 2 1 . . . . 6 T H . 16482 1
42 . 1 1 6 6 THR HA H 1 4.455 0.007 15 1 . . . . 6 T HA . 16482 1
43 . 1 1 6 6 THR HB H 1 4.299 0.008 15 1 . . . . 6 T HB . 16482 1
44 . 1 1 6 6 THR HG21 H 1 1.260 0.004 15 1 . . . . 6 T MG . 16482 1
45 . 1 1 6 6 THR HG22 H 1 1.260 0.004 15 1 . . . . 6 T MG . 16482 1
46 . 1 1 6 6 THR HG23 H 1 1.260 0.004 15 1 . . . . 6 T MG . 16482 1
47 . 1 1 6 6 THR CA C 13 61.959 0.093 12 1 . . . . 6 T CA . 16482 1
48 . 1 1 6 6 THR CB C 13 70.115 0.049 12 1 . . . . 6 T CB . 16482 1
49 . 1 1 6 6 THR CG2 C 13 21.686 0.043 12 1 . . . . 6 T CG2 . 16482 1
50 . 1 1 7 7 CYS HA H 1 4.687 0.018 8 1 . . . . 7 C HA . 16482 1
51 . 1 1 7 7 CYS HB2 H 1 3.133 0.012 14 2 . . . . 7 C HB2 . 16482 1
52 . 1 1 7 7 CYS HB3 H 1 2.798 0.009 13 2 . . . . 7 C HB3 . 16482 1
53 . 1 1 7 7 CYS CA C 13 55.430 0.232 6 1 . . . . 7 C CA . 16482 1
54 . 1 1 7 7 CYS CB C 13 39.440 0.082 21 1 . . . . 7 C CB . 16482 1
55 . 1 1 8 8 GLY H H 1 8.153 0.013 8 1 . . . . 8 G H . 16482 1
56 . 1 1 8 8 GLY HA2 H 1 4.157 0.006 11 2 . . . . 8 G HA2 . 16482 1
57 . 1 1 8 8 GLY HA3 H 1 4.117 0.006 10 2 . . . . 8 G HA3 . 16482 1
58 . 1 1 8 8 GLY CA C 13 44.759 0.033 17 1 . . . . 8 G CA . 16482 1
59 . 1 1 8 8 GLY N N 15 107.436 0.091 6 1 . . . . 8 G N . 16482 1
60 . 1 1 9 9 PRO HA H 1 4.473 0.006 14 1 . . . . 9 P HA . 16482 1
61 . 1 1 9 9 PRO HB2 H 1 2.376 0.007 15 2 . . . . 9 P HB2 . 16482 1
62 . 1 1 9 9 PRO HB3 H 1 2.034 0.013 7 2 . . . . 9 P HB3 . 16482 1
63 . 1 1 9 9 PRO HD2 H 1 3.679 0.004 17 2 . . . . 9 P QD . 16482 1
64 . 1 1 9 9 PRO HD3 H 1 3.679 0.004 17 2 . . . . 9 P QD . 16482 1
65 . 1 1 9 9 PRO HG2 H 1 2.090 0.005 16 2 . . . . 9 P QG . 16482 1
66 . 1 1 9 9 PRO HG3 H 1 2.090 0.005 16 2 . . . . 9 P QG . 16482 1
67 . 1 1 9 9 PRO C C 13 177.242 0.060 1 1 . . . . 9 P C . 16482 1
68 . 1 1 9 9 PRO CA C 13 64.131 0.024 10 1 . . . . 9 P CA . 16482 1
69 . 1 1 9 9 PRO CB C 13 32.189 0.018 15 1 . . . . 9 P CB . 16482 1
70 . 1 1 9 9 PRO CD C 13 49.777 0.010 11 1 . . . . 9 P CD . 16482 1
71 . 1 1 9 9 PRO CG C 13 27.377 0.033 12 1 . . . . 9 P CG . 16482 1
72 . 1 1 10 10 SER H H 1 8.602 0.012 3 1 . . . . 10 S H . 16482 1
73 . 1 1 10 10 SER HA H 1 4.458 0.008 13 1 . . . . 10 S HA . 16482 1
74 . 1 1 10 10 SER HB2 H 1 4.052 0.005 18 2 . . . . 10 S QB . 16482 1
75 . 1 1 10 10 SER HB3 H 1 4.052 0.005 18 2 . . . . 10 S QB . 16482 1
76 . 1 1 10 10 SER C C 13 173.856 0.060 1 1 . . . . 10 S C . 16482 1
77 . 1 1 10 10 SER CA C 13 58.501 0.039 12 1 . . . . 10 S CA . 16482 1
78 . 1 1 10 10 SER CB C 13 62.707 0.058 19 1 . . . . 10 S CB . 16482 1
79 . 1 1 10 10 SER N N 15 113.260 0.003 2 1 . . . . 10 S N . 16482 1
80 . 1 1 11 11 SER H H 1 7.680 0.006 33 1 . . . . 11 S H . 16482 1
81 . 1 1 11 11 SER HA H 1 4.956 0.010 24 1 . . . . 11 S HA . 16482 1
82 . 1 1 11 11 SER HB2 H 1 3.514 0.018 31 2 . . . . 11 S QB . 16482 1
83 . 1 1 11 11 SER HB3 H 1 3.514 0.018 31 2 . . . . 11 S QB . 16482 1
84 . 1 1 11 11 SER C C 13 171.401 0.060 1 1 . . . . 11 S C . 16482 1
85 . 1 1 11 11 SER CA C 13 57.774 0.045 19 1 . . . . 11 S CA . 16482 1
86 . 1 1 11 11 SER CB C 13 66.184 0.034 26 1 . . . . 11 S CB . 16482 1
87 . 1 1 11 11 SER N N 15 114.780 0.052 26 1 . . . . 11 S N . 16482 1
88 . 1 1 12 12 PHE H H 1 9.421 0.015 29 1 . . . . 12 F H . 16482 1
89 . 1 1 12 12 PHE HA H 1 4.821 0.015 10 1 . . . . 12 F HA . 16482 1
90 . 1 1 12 12 PHE HB2 H 1 3.035 0.006 10 2 . . . . 12 F HB2 . 16482 1
91 . 1 1 12 12 PHE HB3 H 1 2.965 0.011 12 2 . . . . 12 F HB3 . 16482 1
92 . 1 1 12 12 PHE HD1 H 1 7.161 0.013 40 3 . . . . 12 F QD . 16482 1
93 . 1 1 12 12 PHE HD2 H 1 7.161 0.013 40 3 . . . . 12 F QD . 16482 1
94 . 1 1 12 12 PHE HE1 H 1 7.307 0.015 36 3 . . . . 12 F QE . 16482 1
95 . 1 1 12 12 PHE HE2 H 1 7.307 0.015 36 3 . . . . 12 F QE . 16482 1
96 . 1 1 12 12 PHE HZ H 1 7.029 0.010 24 1 . . . . 12 F HZ . 16482 1
97 . 1 1 12 12 PHE C C 13 173.866 0.060 1 1 . . . . 12 F C . 16482 1
98 . 1 1 12 12 PHE CA C 13 56.572 0.045 9 1 . . . . 12 F CA . 16482 1
99 . 1 1 12 12 PHE CB C 13 43.517 0.024 27 1 . . . . 12 F CB . 16482 1
100 . 1 1 12 12 PHE CD1 C 13 132.432 0.045 23 3 . . . . 12 F CD1 . 16482 1
101 . 1 1 12 12 PHE CE1 C 13 130.915 0.045 20 3 . . . . 12 F CE1 . 16482 1
102 . 1 1 12 12 PHE CZ C 13 129.349 0.073 15 1 . . . . 12 F CZ . 16482 1
103 . 1 1 12 12 PHE N N 15 124.916 0.050 19 1 . . . . 12 F N . 16482 1
104 . 1 1 13 13 SER H H 1 7.948 0.021 26 1 . . . . 13 S H . 16482 1
105 . 1 1 13 13 SER HA H 1 4.737 0.004 5 1 . . . . 13 S HA . 16482 1
106 . 1 1 13 13 SER HB2 H 1 3.640 0.003 14 2 . . . . 13 S HB2 . 16482 1
107 . 1 1 13 13 SER HB3 H 1 3.534 0.012 17 2 . . . . 13 S HB3 . 16482 1
108 . 1 1 13 13 SER C C 13 173.910 0.060 1 1 . . . . 13 S C . 16482 1
109 . 1 1 13 13 SER CA C 13 56.613 0.032 9 1 . . . . 13 S CA . 16482 1
110 . 1 1 13 13 SER CB C 13 63.615 0.039 35 1 . . . . 13 S CB . 16482 1
111 . 1 1 13 13 SER N N 15 121.342 0.045 19 1 . . . . 13 S N . 16482 1
112 . 1 1 14 14 CYS H H 1 8.312 0.029 24 1 . . . . 14 C H . 16482 1
113 . 1 1 14 14 CYS HA H 1 4.807 0.013 7 1 . . . . 14 C HA . 16482 1
114 . 1 1 14 14 CYS HB2 H 1 3.692 0.007 27 2 . . . . 14 C HB2 . 16482 1
115 . 1 1 14 14 CYS HB3 H 1 2.980 0.011 27 2 . . . . 14 C HB3 . 16482 1
116 . 1 1 14 14 CYS CA C 13 52.881 0.078 5 1 . . . . 14 C CA . 16482 1
117 . 1 1 14 14 CYS CB C 13 36.099 0.026 36 1 . . . . 14 C CB . 16482 1
118 . 1 1 14 14 CYS N N 15 126.132 0.040 16 1 . . . . 14 C N . 16482 1
119 . 1 1 15 15 PRO HA H 1 4.275 0.004 15 1 . . . . 15 P HA . 16482 1
120 . 1 1 15 15 PRO HB2 H 1 2.326 0.006 13 2 . . . . 15 P HB2 . 16482 1
121 . 1 1 15 15 PRO HB3 H 1 2.020 0.006 8 2 . . . . 15 P HB3 . 16482 1
122 . 1 1 15 15 PRO HD2 H 1 4.276 0.008 26 2 . . . . 15 P HD2 . 16482 1
123 . 1 1 15 15 PRO HD3 H 1 3.927 0.012 30 2 . . . . 15 P HD3 . 16482 1
124 . 1 1 15 15 PRO HG2 H 1 2.252 0.018 30 2 . . . . 15 P HG2 . 16482 1
125 . 1 1 15 15 PRO HG3 H 1 2.000 0.004 15 2 . . . . 15 P HG3 . 16482 1
126 . 1 1 15 15 PRO CA C 13 64.165 0.050 13 1 . . . . 15 P CA . 16482 1
127 . 1 1 15 15 PRO CB C 13 32.177 0.009 15 1 . . . . 15 P CB . 16482 1
128 . 1 1 15 15 PRO CD C 13 51.445 0.037 36 1 . . . . 15 P CD . 16482 1
129 . 1 1 15 15 PRO CG C 13 27.599 0.040 33 1 . . . . 15 P CG . 16482 1
130 . 1 1 16 16 GLY HA2 H 1 4.199 0.005 15 2 . . . . 16 G HA2 . 16482 1
131 . 1 1 16 16 GLY HA3 H 1 3.743 0.002 16 2 . . . . 16 G HA3 . 16482 1
132 . 1 1 16 16 GLY C C 13 174.145 0.060 1 1 . . . . 16 G C . 16482 1
133 . 1 1 16 16 GLY CA C 13 45.802 0.025 25 1 . . . . 16 G CA . 16482 1
134 . 1 1 17 17 THR H H 1 7.735 0.004 23 1 . . . . 17 T H . 16482 1
135 . 1 1 17 17 THR HA H 1 4.791 0.008 7 1 . . . . 17 T HA . 16482 1
136 . 1 1 17 17 THR HB H 1 4.374 0.005 21 1 . . . . 17 T HB . 16482 1
137 . 1 1 17 17 THR HG21 H 1 1.190 0.008 21 1 . . . . 17 T MG . 16482 1
138 . 1 1 17 17 THR HG22 H 1 1.190 0.008 21 1 . . . . 17 T MG . 16482 1
139 . 1 1 17 17 THR HG23 H 1 1.190 0.008 21 1 . . . . 17 T MG . 16482 1
140 . 1 1 17 17 THR CA C 13 60.528 0.011 7 1 . . . . 17 T CA . 16482 1
141 . 1 1 17 17 THR CB C 13 72.519 0.039 17 1 . . . . 17 T CB . 16482 1
142 . 1 1 17 17 THR CG2 C 13 21.218 0.028 16 1 . . . . 17 T CG2 . 16482 1
143 . 1 1 17 17 THR N N 15 108.874 0.047 19 1 . . . . 17 T N . 16482 1
144 . 1 1 18 18 HIS HA H 1 4.538 0.005 3 1 . . . . 18 H HA . 16482 1
145 . 1 1 18 18 HIS HB2 H 1 3.364 0.026 5 2 . . . . 18 H HB2 . 16482 1
146 . 1 1 18 18 HIS HB3 H 1 3.161 0.049 5 2 . . . . 18 H HB3 . 16482 1
147 . 1 1 18 18 HIS HD2 H 1 6.970 0.008 3 1 . . . . 18 H HD2 . 16482 1
148 . 1 1 18 18 HIS HE1 H 1 7.841 0.003 8 1 . . . . 18 H HE1 . 16482 1
149 . 1 1 18 18 HIS C C 13 176.629 0.060 1 1 . . . . 18 H C . 16482 1
150 . 1 1 18 18 HIS CB C 13 29.416 0.219 6 1 . . . . 18 H CB . 16482 1
151 . 1 1 18 18 HIS CD2 C 13 119.864 0.061 3 1 . . . . 18 H CD2 . 16482 1
152 . 1 1 18 18 HIS CE1 C 13 138.086 0.045 7 1 . . . . 18 H CE1 . 16482 1
153 . 1 1 19 19 VAL H H 1 7.914 0.012 18 1 . . . . 19 V H . 16482 1
154 . 1 1 19 19 VAL HA H 1 4.246 0.007 4 1 . . . . 19 V HA . 16482 1
155 . 1 1 19 19 VAL HB H 1 2.042 0.007 21 1 . . . . 19 V HB . 16482 1
156 . 1 1 19 19 VAL HG11 H 1 1.038 0.005 16 2 . . . . 19 V MG1 . 16482 1
157 . 1 1 19 19 VAL HG12 H 1 1.038 0.005 16 2 . . . . 19 V MG1 . 16482 1
158 . 1 1 19 19 VAL HG13 H 1 1.038 0.005 16 2 . . . . 19 V MG1 . 16482 1
159 . 1 1 19 19 VAL HG21 H 1 1.064 0.007 26 2 . . . . 19 V MG2 . 16482 1
160 . 1 1 19 19 VAL HG22 H 1 1.064 0.007 26 2 . . . . 19 V MG2 . 16482 1
161 . 1 1 19 19 VAL HG23 H 1 1.064 0.007 26 2 . . . . 19 V MG2 . 16482 1
162 . 1 1 19 19 VAL CA C 13 63.521 0.060 1 1 . . . . 19 V CA . 16482 1
163 . 1 1 19 19 VAL CB C 13 33.904 0.068 15 1 . . . . 19 V CB . 16482 1
164 . 1 1 19 19 VAL CG1 C 13 21.443 0.044 14 2 . . . . 19 V CG1 . 16482 1
165 . 1 1 19 19 VAL CG2 C 13 21.824 0.041 21 2 . . . . 19 V CG2 . 16482 1
166 . 1 1 19 19 VAL N N 15 119.013 0.117 10 1 . . . . 19 V N . 16482 1
167 . 1 1 20 20 CYS H H 1 8.844 0.029 5 1 . . . . 20 C H . 16482 1
168 . 1 1 20 20 CYS HA H 1 5.520 0.009 26 1 . . . . 20 C HA . 16482 1
169 . 1 1 20 20 CYS HB2 H 1 2.894 0.004 16 2 . . . . 20 C HB2 . 16482 1
170 . 1 1 20 20 CYS HB3 H 1 2.743 0.007 16 2 . . . . 20 C HB3 . 16482 1
171 . 1 1 20 20 CYS CA C 13 53.649 0.045 20 1 . . . . 20 C CA . 16482 1
172 . 1 1 20 20 CYS CB C 13 42.656 0.048 25 1 . . . . 20 C CB . 16482 1
173 . 1 1 21 21 VAL H H 1 9.546 0.029 17 1 . . . . 21 V H . 16482 1
174 . 1 1 21 21 VAL HA H 1 4.787 0.012 3 1 . . . . 21 V HA . 16482 1
175 . 1 1 21 21 VAL HB H 1 2.297 0.011 26 1 . . . . 21 V HB . 16482 1
176 . 1 1 21 21 VAL HG11 H 1 1.149 0.012 35 2 . . . . 21 V MG1 . 16482 1
177 . 1 1 21 21 VAL HG12 H 1 1.149 0.012 35 2 . . . . 21 V MG1 . 16482 1
178 . 1 1 21 21 VAL HG13 H 1 1.149 0.012 35 2 . . . . 21 V MG1 . 16482 1
179 . 1 1 21 21 VAL HG21 H 1 1.213 0.009 29 2 . . . . 21 V MG2 . 16482 1
180 . 1 1 21 21 VAL HG22 H 1 1.213 0.009 29 2 . . . . 21 V MG2 . 16482 1
181 . 1 1 21 21 VAL HG23 H 1 1.213 0.009 29 2 . . . . 21 V MG2 . 16482 1
182 . 1 1 21 21 VAL CA C 13 58.280 0.060 1 1 . . . . 21 V CA . 16482 1
183 . 1 1 21 21 VAL CB C 13 34.202 0.033 15 1 . . . . 21 V CB . 16482 1
184 . 1 1 21 21 VAL CG1 C 13 20.837 0.057 26 2 . . . . 21 V CG1 . 16482 1
185 . 1 1 21 21 VAL CG2 C 13 22.410 0.076 20 2 . . . . 21 V CG2 . 16482 1
186 . 1 1 21 21 VAL N N 15 120.700 0.041 5 1 . . . . 21 V N . 16482 1
187 . 1 1 22 22 PRO HA H 1 4.363 0.008 25 1 . . . . 22 P HA . 16482 1
188 . 1 1 22 22 PRO HB2 H 1 2.146 0.012 22 2 . . . . 22 P HB2 . 16482 1
189 . 1 1 22 22 PRO HB3 H 1 1.289 0.011 17 2 . . . . 22 P HB3 . 16482 1
190 . 1 1 22 22 PRO HD2 H 1 3.039 0.017 5 2 . . . . 22 P HD2 . 16482 1
191 . 1 1 22 22 PRO HD3 H 1 2.536 0.024 5 2 . . . . 22 P HD3 . 16482 1
192 . 1 1 22 22 PRO HG2 H 1 1.889 0.029 3 2 . . . . 22 P HG2 . 16482 1
193 . 1 1 22 22 PRO HG3 H 1 0.748 0.021 2 2 . . . . 22 P HG3 . 16482 1
194 . 1 1 22 22 PRO C C 13 177.177 0.060 1 1 . . . . 22 P C . 16482 1
195 . 1 1 22 22 PRO CA C 13 62.772 0.038 21 1 . . . . 22 P CA . 16482 1
196 . 1 1 22 22 PRO CB C 13 32.521 0.023 29 1 . . . . 22 P CB . 16482 1
197 . 1 1 22 22 PRO CD C 13 48.841 0.015 5 1 . . . . 22 P CD . 16482 1
198 . 1 1 23 23 GLU H H 1 8.140 0.006 36 1 . . . . 23 E H . 16482 1
199 . 1 1 23 23 GLU HA H 1 3.929 0.006 35 1 . . . . 23 E HA . 16482 1
200 . 1 1 23 23 GLU HB2 H 1 2.060 0.005 11 2 . . . . 23 E HB2 . 16482 1
201 . 1 1 23 23 GLU HB3 H 1 1.969 0.006 12 2 . . . . 23 E HB3 . 16482 1
202 . 1 1 23 23 GLU HG2 H 1 2.251 0.022 16 2 . . . . 23 E QG . 16482 1
203 . 1 1 23 23 GLU HG3 H 1 2.251 0.022 16 2 . . . . 23 E QG . 16482 1
204 . 1 1 23 23 GLU C C 13 178.691 0.060 1 1 . . . . 23 E C . 16482 1
205 . 1 1 23 23 GLU CA C 13 59.455 0.025 31 1 . . . . 23 E CA . 16482 1
206 . 1 1 23 23 GLU CB C 13 29.391 0.065 26 1 . . . . 23 E CB . 16482 1
207 . 1 1 23 23 GLU CG C 13 36.363 0.024 13 1 . . . . 23 E CG . 16482 1
208 . 1 1 23 23 GLU N N 15 121.344 0.049 27 1 . . . . 23 E N . 16482 1
209 . 1 1 24 24 ARG H H 1 8.148 0.006 26 1 . . . . 24 R H . 16482 1
210 . 1 1 24 24 ARG HA H 1 4.301 0.013 8 1 . . . . 24 R HA . 16482 1
211 . 1 1 24 24 ARG HB2 H 1 1.907 0.013 4 2 . . . . 24 R QB . 16482 1
212 . 1 1 24 24 ARG HB3 H 1 1.907 0.013 4 2 . . . . 24 R QB . 16482 1
213 . 1 1 24 24 ARG HD2 H 1 3.225 0.014 10 2 . . . . 24 R QD . 16482 1
214 . 1 1 24 24 ARG HD3 H 1 3.225 0.014 10 2 . . . . 24 R QD . 16482 1
215 . 1 1 24 24 ARG HG2 H 1 1.769 0.005 1 2 . . . . 24 R HG2 . 16482 1
216 . 1 1 24 24 ARG HG3 H 1 1.636 0.005 1 2 . . . . 24 R HG3 . 16482 1
217 . 1 1 24 24 ARG C C 13 176.507 0.060 1 1 . . . . 24 R C . 16482 1
218 . 1 1 24 24 ARG CA C 13 57.695 0.032 10 1 . . . . 24 R CA . 16482 1
219 . 1 1 24 24 ARG CB C 13 29.688 0.049 5 1 . . . . 24 R CB . 16482 1
220 . 1 1 24 24 ARG CD C 13 43.334 0.037 11 1 . . . . 24 R CD . 16482 1
221 . 1 1 24 24 ARG CG C 13 27.234 0.209 2 1 . . . . 24 R CG . 16482 1
222 . 1 1 24 24 ARG N N 15 116.183 0.052 24 1 . . . . 24 R N . 16482 1
223 . 1 1 25 25 TRP H H 1 8.092 0.011 27 1 . . . . 25 W H . 16482 1
224 . 1 1 25 25 TRP HA H 1 5.319 0.005 36 1 . . . . 25 W HA . 16482 1
225 . 1 1 25 25 TRP HB2 H 1 3.922 0.008 30 2 . . . . 25 W HB2 . 16482 1
226 . 1 1 25 25 TRP HB3 H 1 3.046 0.012 28 2 . . . . 25 W HB3 . 16482 1
227 . 1 1 25 25 TRP HD1 H 1 6.862 0.015 25 1 . . . . 25 W HD1 . 16482 1
228 . 1 1 25 25 TRP HE1 H 1 9.943 0.010 25 1 . . . . 25 W HE1 . 16482 1
229 . 1 1 25 25 TRP HE3 H 1 7.428 0.052 14 1 . . . . 25 W HE3 . 16482 1
230 . 1 1 25 25 TRP HH2 H 1 7.258 0.003 8 1 . . . . 25 W HH2 . 16482 1
231 . 1 1 25 25 TRP HZ2 H 1 7.364 0.010 14 1 . . . . 25 W HZ2 . 16482 1
232 . 1 1 25 25 TRP HZ3 H 1 7.231 0.009 20 1 . . . . 25 W HZ3 . 16482 1
233 . 1 1 25 25 TRP C C 13 177.347 0.060 1 1 . . . . 25 W C . 16482 1
234 . 1 1 25 25 TRP CA C 13 54.692 0.060 27 1 . . . . 25 W CA . 16482 1
235 . 1 1 25 25 TRP CB C 13 28.137 0.063 45 1 . . . . 25 W CB . 16482 1
236 . 1 1 25 25 TRP CD1 C 13 123.412 0.070 17 1 . . . . 25 W CD1 . 16482 1
237 . 1 1 25 25 TRP CE3 C 13 121.335 0.202 7 1 . . . . 25 W CE3 . 16482 1
238 . 1 1 25 25 TRP CH2 C 13 125.136 0.118 8 1 . . . . 25 W CH2 . 16482 1
239 . 1 1 25 25 TRP CZ2 C 13 114.702 0.049 9 1 . . . . 25 W CZ2 . 16482 1
240 . 1 1 25 25 TRP CZ3 C 13 121.416 0.056 13 1 . . . . 25 W CZ3 . 16482 1
241 . 1 1 25 25 TRP N N 15 117.355 0.048 22 1 . . . . 25 W N . 16482 1
242 . 1 1 25 25 TRP NE1 N 15 125.951 0.062 20 1 . . . . 25 W NE1 . 16482 1
243 . 1 1 26 26 LEU H H 1 7.984 0.007 38 1 . . . . 26 L H . 16482 1
244 . 1 1 26 26 LEU HA H 1 4.584 0.011 24 1 . . . . 26 L HA . 16482 1
245 . 1 1 26 26 LEU HB2 H 1 1.924 0.009 24 2 . . . . 26 L HB2 . 16482 1
246 . 1 1 26 26 LEU HB3 H 1 1.599 0.007 31 2 . . . . 26 L HB3 . 16482 1
247 . 1 1 26 26 LEU HD11 H 1 0.433 0.007 45 2 . . . . 26 L MD1 . 16482 1
248 . 1 1 26 26 LEU HD12 H 1 0.433 0.007 45 2 . . . . 26 L MD1 . 16482 1
249 . 1 1 26 26 LEU HD13 H 1 0.433 0.007 45 2 . . . . 26 L MD1 . 16482 1
250 . 1 1 26 26 LEU HD21 H 1 0.882 0.014 48 2 . . . . 26 L MD2 . 16482 1
251 . 1 1 26 26 LEU HD22 H 1 0.882 0.014 48 2 . . . . 26 L MD2 . 16482 1
252 . 1 1 26 26 LEU HD23 H 1 0.882 0.014 48 2 . . . . 26 L MD2 . 16482 1
253 . 1 1 26 26 LEU HG H 1 1.871 0.012 22 1 . . . . 26 L HG . 16482 1
254 . 1 1 26 26 LEU C C 13 176.280 0.060 1 1 . . . . 26 L C . 16482 1
255 . 1 1 26 26 LEU CA C 13 55.274 0.067 15 1 . . . . 26 L CA . 16482 1
256 . 1 1 26 26 LEU CB C 13 40.394 0.039 40 1 . . . . 26 L CB . 16482 1
257 . 1 1 26 26 LEU CD1 C 13 22.181 0.025 26 2 . . . . 26 L CD1 . 16482 1
258 . 1 1 26 26 LEU CD2 C 13 24.683 0.033 28 2 . . . . 26 L CD2 . 16482 1
259 . 1 1 26 26 LEU CG C 13 26.793 0.054 20 1 . . . . 26 L CG . 16482 1
260 . 1 1 26 26 LEU N N 15 125.873 0.053 28 1 . . . . 26 L N . 16482 1
261 . 1 1 27 27 CYS H H 1 8.811 0.010 57 1 . . . . 27 C H . 16482 1
262 . 1 1 27 27 CYS HA H 1 4.579 0.011 17 1 . . . . 27 C HA . 16482 1
263 . 1 1 27 27 CYS HB2 H 1 3.349 0.012 23 2 . . . . 27 C HB2 . 16482 1
264 . 1 1 27 27 CYS HB3 H 1 3.122 0.008 17 2 . . . . 27 C HB3 . 16482 1
265 . 1 1 27 27 CYS C C 13 175.946 0.000 1 1 . . . . 27 C C . 16482 1
266 . 1 1 27 27 CYS CA C 13 54.731 0.078 14 1 . . . . 27 C CA . 16482 1
267 . 1 1 27 27 CYS CB C 13 34.415 0.024 36 1 . . . . 27 C CB . 16482 1
268 . 1 1 27 27 CYS N N 15 120.227 0.054 38 1 . . . . 27 C N . 16482 1
269 . 1 1 28 28 ASP H H 1 9.697 0.007 39 1 . . . . 28 D H . 16482 1
270 . 1 1 28 28 ASP HA H 1 4.833 0.006 18 1 . . . . 28 D HA . 16482 1
271 . 1 1 28 28 ASP HB2 H 1 3.214 0.015 18 2 . . . . 28 D HB2 . 16482 1
272 . 1 1 28 28 ASP HB3 H 1 2.486 0.007 17 2 . . . . 28 D HB3 . 16482 1
273 . 1 1 28 28 ASP C C 13 177.792 0.060 1 1 . . . . 28 D C . 16482 1
274 . 1 1 28 28 ASP CA C 13 52.778 0.101 13 1 . . . . 28 D CA . 16482 1
275 . 1 1 28 28 ASP CB C 13 41.978 0.069 26 1 . . . . 28 D CB . 16482 1
276 . 1 1 28 28 ASP N N 15 121.331 0.049 27 1 . . . . 28 D N . 16482 1
277 . 1 1 29 29 GLY H H 1 9.677 0.015 27 1 . . . . 29 G H . 16482 1
278 . 1 1 29 29 GLY HA2 H 1 4.319 0.007 16 2 . . . . 29 G HA2 . 16482 1
279 . 1 1 29 29 GLY HA3 H 1 3.498 0.005 18 2 . . . . 29 G HA3 . 16482 1
280 . 1 1 29 29 GLY C C 13 173.393 0.060 1 1 . . . . 29 G C . 16482 1
281 . 1 1 29 29 GLY CA C 13 45.510 0.019 26 1 . . . . 29 G CA . 16482 1
282 . 1 1 29 29 GLY N N 15 111.914 0.040 22 1 . . . . 29 G N . 16482 1
283 . 1 1 30 30 ASP H H 1 7.607 0.008 36 1 . . . . 30 D H . 16482 1
284 . 1 1 30 30 ASP HA H 1 4.953 0.002 13 1 . . . . 30 D HA . 16482 1
285 . 1 1 30 30 ASP HB2 H 1 2.451 0.016 9 2 . . . . 30 D QB . 16482 1
286 . 1 1 30 30 ASP HB3 H 1 2.451 0.016 9 2 . . . . 30 D QB . 16482 1
287 . 1 1 30 30 ASP CA C 13 52.374 0.067 12 1 . . . . 30 D CA . 16482 1
288 . 1 1 30 30 ASP CB C 13 42.462 0.022 9 1 . . . . 30 D CB . 16482 1
289 . 1 1 30 30 ASP N N 15 118.986 0.051 26 1 . . . . 30 D N . 16482 1
290 . 1 1 31 31 LYS HA H 1 4.369 0.011 31 1 . . . . 31 K HA . 16482 1
291 . 1 1 31 31 LYS HB2 H 1 1.943 0.015 19 2 . . . . 31 K HB2 . 16482 1
292 . 1 1 31 31 LYS HB3 H 1 1.825 0.004 14 2 . . . . 31 K HB3 . 16482 1
293 . 1 1 31 31 LYS HD2 H 1 1.705 0.005 24 2 . . . . 31 K QD . 16482 1
294 . 1 1 31 31 LYS HD3 H 1 1.705 0.005 24 2 . . . . 31 K QD . 16482 1
295 . 1 1 31 31 LYS HE2 H 1 3.007 0.003 21 2 . . . . 31 K QE . 16482 1
296 . 1 1 31 31 LYS HE3 H 1 3.007 0.003 21 2 . . . . 31 K QE . 16482 1
297 . 1 1 31 31 LYS HG2 H 1 1.682 0.008 22 2 . . . . 31 K HG2 . 16482 1
298 . 1 1 31 31 LYS HG3 H 1 1.218 0.005 33 2 . . . . 31 K HG3 . 16482 1
299 . 1 1 31 31 LYS C C 13 174.085 0.060 1 1 . . . . 31 K C . 16482 1
300 . 1 1 31 31 LYS CA C 13 57.447 0.042 23 1 . . . . 31 K CA . 16482 1
301 . 1 1 31 31 LYS CB C 13 30.875 0.031 33 1 . . . . 31 K CB . 16482 1
302 . 1 1 31 31 LYS CD C 13 29.663 0.026 22 1 . . . . 31 K CD . 16482 1
303 . 1 1 31 31 LYS CE C 13 42.017 0.027 15 1 . . . . 31 K CE . 16482 1
304 . 1 1 31 31 LYS CG C 13 25.708 0.040 39 1 . . . . 31 K CG . 16482 1
305 . 1 1 32 32 ASP H H 1 10.185 0.008 55 1 . . . . 32 D H . 16482 1
306 . 1 1 32 32 ASP HA H 1 4.669 0.008 7 1 . . . . 32 D HA . 16482 1
307 . 1 1 32 32 ASP HB2 H 1 2.928 0.006 6 2 . . . . 32 D HB2 . 16482 1
308 . 1 1 32 32 ASP HB3 H 1 2.749 0.005 23 2 . . . . 32 D HB3 . 16482 1
309 . 1 1 32 32 ASP C C 13 177.832 0.060 1 1 . . . . 32 D C . 16482 1
310 . 1 1 32 32 ASP CA C 13 57.071 0.029 6 1 . . . . 32 D CA . 16482 1
311 . 1 1 32 32 ASP CB C 13 43.713 0.033 26 1 . . . . 32 D CB . 16482 1
312 . 1 1 32 32 ASP N N 15 129.069 0.062 35 1 . . . . 32 D N . 16482 1
313 . 1 1 33 33 CYS H H 1 8.513 0.006 43 1 . . . . 33 C H . 16482 1
314 . 1 1 33 33 CYS HA H 1 5.064 0.012 29 1 . . . . 33 C HA . 16482 1
315 . 1 1 33 33 CYS HB2 H 1 3.765 0.015 23 2 . . . . 33 C HB2 . 16482 1
316 . 1 1 33 33 CYS HB3 H 1 3.031 0.009 28 2 . . . . 33 C HB3 . 16482 1
317 . 1 1 33 33 CYS CA C 13 52.573 0.059 16 1 . . . . 33 C CA . 16482 1
318 . 1 1 33 33 CYS CB C 13 37.995 0.024 40 1 . . . . 33 C CB . 16482 1
319 . 1 1 33 33 CYS N N 15 117.397 0.046 33 1 . . . . 33 C N . 16482 1
320 . 1 1 34 34 ALA HA H 1 4.177 0.004 20 1 . . . . 34 A HA . 16482 1
321 . 1 1 34 34 ALA HB1 H 1 1.549 0.013 19 1 . . . . 34 A MB . 16482 1
322 . 1 1 34 34 ALA HB2 H 1 1.549 0.013 19 1 . . . . 34 A MB . 16482 1
323 . 1 1 34 34 ALA HB3 H 1 1.549 0.013 19 1 . . . . 34 A MB . 16482 1
324 . 1 1 34 34 ALA C C 13 178.351 0.060 1 1 . . . . 34 A C . 16482 1
325 . 1 1 34 34 ALA CA C 13 55.795 0.046 21 1 . . . . 34 A CA . 16482 1
326 . 1 1 34 34 ALA CB C 13 18.258 0.030 16 1 . . . . 34 A CB . 16482 1
327 . 1 1 35 35 ASP H H 1 8.170 0.013 40 1 . . . . 35 D H . 16482 1
328 . 1 1 35 35 ASP HA H 1 4.664 0.004 5 1 . . . . 35 D HA . 16482 1
329 . 1 1 35 35 ASP HB2 H 1 3.138 0.013 17 2 . . . . 35 D HB2 . 16482 1
330 . 1 1 35 35 ASP HB3 H 1 2.645 0.005 15 2 . . . . 35 D HB3 . 16482 1
331 . 1 1 35 35 ASP C C 13 178.649 0.060 1 1 . . . . 35 D C . 16482 1
332 . 1 1 35 35 ASP CA C 13 52.719 0.030 9 1 . . . . 35 D CA . 16482 1
333 . 1 1 35 35 ASP CB C 13 40.882 0.028 30 1 . . . . 35 D CB . 16482 1
334 . 1 1 35 35 ASP N N 15 113.279 0.058 28 1 . . . . 35 D N . 16482 1
335 . 1 1 36 36 GLY H H 1 8.389 0.011 52 1 . . . . 36 G H . 16482 1
336 . 1 1 36 36 GLY HA2 H 1 4.060 0.012 33 2 . . . . 36 G HA2 . 16482 1
337 . 1 1 36 36 GLY HA3 H 1 3.668 0.008 34 2 . . . . 36 G HA3 . 16482 1
338 . 1 1 36 36 GLY C C 13 177.292 0.060 1 1 . . . . 36 G C . 16482 1
339 . 1 1 36 36 GLY CA C 13 46.310 0.044 49 1 . . . . 36 G CA . 16482 1
340 . 1 1 36 36 GLY N N 15 105.842 0.056 36 1 . . . . 36 G N . 16482 1
341 . 1 1 37 37 ALA H H 1 8.622 0.014 47 1 . . . . 37 A H . 16482 1
342 . 1 1 37 37 ALA HA H 1 4.125 0.005 20 1 . . . . 37 A HA . 16482 1
343 . 1 1 37 37 ALA HB1 H 1 1.900 0.008 44 1 . . . . 37 A MB . 16482 1
344 . 1 1 37 37 ALA HB2 H 1 1.900 0.008 44 1 . . . . 37 A MB . 16482 1
345 . 1 1 37 37 ALA HB3 H 1 1.900 0.008 44 1 . . . . 37 A MB . 16482 1
346 . 1 1 37 37 ALA C C 13 179.201 0.060 1 1 . . . . 37 A C . 16482 1
347 . 1 1 37 37 ALA CA C 13 56.135 0.032 24 1 . . . . 37 A CA . 16482 1
348 . 1 1 37 37 ALA CB C 13 19.977 0.042 38 1 . . . . 37 A CB . 16482 1
349 . 1 1 37 37 ALA N N 15 122.946 0.050 30 1 . . . . 37 A N . 16482 1
350 . 1 1 38 38 ASP H H 1 9.788 0.015 52 1 . . . . 38 D H . 16482 1
351 . 1 1 38 38 ASP HA H 1 3.745 0.014 36 1 . . . . 38 D HA . 16482 1
352 . 1 1 38 38 ASP HB2 H 1 2.830 0.011 21 2 . . . . 38 D HB2 . 16482 1
353 . 1 1 38 38 ASP HB3 H 1 2.716 0.010 23 2 . . . . 38 D HB3 . 16482 1
354 . 1 1 38 38 ASP C C 13 172.543 0.060 1 1 . . . . 38 D C . 16482 1
355 . 1 1 38 38 ASP CA C 13 55.020 0.025 24 1 . . . . 38 D CA . 16482 1
356 . 1 1 38 38 ASP CB C 13 40.792 0.040 43 1 . . . . 38 D CB . 16482 1
357 . 1 1 38 38 ASP N N 15 110.881 0.076 31 1 . . . . 38 D N . 16482 1
358 . 1 1 39 39 GLU H H 1 7.617 0.011 59 1 . . . . 39 E H . 16482 1
359 . 1 1 39 39 GLU HA H 1 4.816 0.011 17 1 . . . . 39 E HA . 16482 1
360 . 1 1 39 39 GLU HB2 H 1 2.558 0.015 39 2 . . . . 39 E HB2 . 16482 1
361 . 1 1 39 39 GLU HB3 H 1 1.670 0.010 29 2 . . . . 39 E HB3 . 16482 1
362 . 1 1 39 39 GLU HG2 H 1 2.183 0.008 28 2 . . . . 39 E HG2 . 16482 1
363 . 1 1 39 39 GLU HG3 H 1 1.958 0.009 27 2 . . . . 39 E HG3 . 16482 1
364 . 1 1 39 39 GLU C C 13 175.649 0.060 1 1 . . . . 39 E C . 16482 1
365 . 1 1 39 39 GLU CA C 13 54.237 0.068 16 1 . . . . 39 E CA . 16482 1
366 . 1 1 39 39 GLU CB C 13 30.641 0.041 51 1 . . . . 39 E CB . 16482 1
367 . 1 1 39 39 GLU CG C 13 36.810 0.046 44 1 . . . . 39 E CG . 16482 1
368 . 1 1 39 39 GLU N N 15 115.720 0.052 37 1 . . . . 39 E N . 16482 1
369 . 1 1 40 40 SER H H 1 7.372 0.006 48 1 . . . . 40 S H . 16482 1
370 . 1 1 40 40 SER HA H 1 4.929 0.013 12 1 . . . . 40 S HA . 16482 1
371 . 1 1 40 40 SER HB2 H 1 4.395 0.011 23 2 . . . . 40 S HB2 . 16482 1
372 . 1 1 40 40 SER HB3 H 1 4.024 0.007 24 2 . . . . 40 S HB3 . 16482 1
373 . 1 1 40 40 SER C C 13 176.001 0.060 1 1 . . . . 40 S C . 16482 1
374 . 1 1 40 40 SER CA C 13 57.592 0.056 15 1 . . . . 40 S CA . 16482 1
375 . 1 1 40 40 SER CB C 13 67.911 0.045 44 1 . . . . 40 S CB . 16482 1
376 . 1 1 40 40 SER N N 15 115.668 0.047 36 1 . . . . 40 S N . 16482 1
377 . 1 1 41 41 ILE H H 1 8.764 0.014 28 1 . . . . 41 I H . 16482 1
378 . 1 1 41 41 ILE HA H 1 4.137 0.007 30 1 . . . . 41 I HA . 16482 1
379 . 1 1 41 41 ILE HB H 1 1.964 0.014 24 1 . . . . 41 I HB . 16482 1
380 . 1 1 41 41 ILE HD11 H 1 0.953 0.010 18 1 . . . . 41 I MD . 16482 1
381 . 1 1 41 41 ILE HD12 H 1 0.953 0.010 18 1 . . . . 41 I MD . 16482 1
382 . 1 1 41 41 ILE HD13 H 1 0.953 0.010 18 1 . . . . 41 I MD . 16482 1
383 . 1 1 41 41 ILE HG12 H 1 1.583 0.005 23 1 . . . . 41 I HG11 . 16482 1
384 . 1 1 41 41 ILE HG13 H 1 1.330 0.007 24 1 . . . . 41 I HG12 . 16482 1
385 . 1 1 41 41 ILE HG21 H 1 1.103 0.013 20 1 . . . . 41 I HG21 . 16482 1
386 . 1 1 41 41 ILE HG22 H 1 1.103 0.013 23 1 . . . . 41 I HG22 . 16482 1
387 . 1 1 41 41 ILE HG23 H 1 1.103 0.013 23 1 . . . . 41 I HG22 . 16482 1
388 . 1 1 41 41 ILE C C 13 179.215 0.060 1 1 . . . . 41 I C . 16482 1
389 . 1 1 41 41 ILE CA C 13 63.997 0.039 27 1 . . . . 41 I CA . 16482 1
390 . 1 1 41 41 ILE CB C 13 38.196 0.032 23 1 . . . . 41 I CB . 16482 1
391 . 1 1 41 41 ILE CD1 C 13 13.664 0.029 16 1 . . . . 41 I CD1 . 16482 1
392 . 1 1 41 41 ILE CG1 C 13 28.509 0.035 31 1 . . . . 41 I CG1 . 16482 1
393 . 1 1 41 41 ILE CG2 C 13 17.472 0.040 18 1 . . . . 41 I CG2 . 16482 1
394 . 1 1 41 41 ILE N N 15 120.825 0.056 22 1 . . . . 41 I N . 16482 1
395 . 1 1 42 42 ALA H H 1 8.210 0.012 30 1 . . . . 42 A H . 16482 1
396 . 1 1 42 42 ALA HA H 1 4.290 0.014 19 1 . . . . 42 A HA . 16482 1
397 . 1 1 42 42 ALA HB1 H 1 1.619 0.010 29 1 . . . . 42 A MB . 16482 1
398 . 1 1 42 42 ALA HB2 H 1 1.619 0.010 29 1 . . . . 42 A MB . 16482 1
399 . 1 1 42 42 ALA HB3 H 1 1.619 0.010 29 1 . . . . 42 A MB . 16482 1
400 . 1 1 42 42 ALA C C 13 178.533 0.000 1 1 . . . . 42 A C . 16482 1
401 . 1 1 42 42 ALA CA C 13 54.778 0.062 21 1 . . . . 42 A CA . 16482 1
402 . 1 1 42 42 ALA CB C 13 18.414 0.035 22 1 . . . . 42 A CB . 16482 1
403 . 1 1 42 42 ALA N N 15 124.652 0.072 22 1 . . . . 42 A N . 16482 1
404 . 1 1 43 43 ALA H H 1 7.428 0.007 37 1 . . . . 43 A H . 16482 1
405 . 1 1 43 43 ALA HA H 1 4.302 0.004 19 1 . . . . 43 A HA . 16482 1
406 . 1 1 43 43 ALA HB1 H 1 1.234 0.012 38 1 . . . . 43 A MB . 16482 1
407 . 1 1 43 43 ALA HB2 H 1 1.234 0.012 38 1 . . . . 43 A MB . 16482 1
408 . 1 1 43 43 ALA HB3 H 1 1.234 0.012 38 1 . . . . 43 A MB . 16482 1
409 . 1 1 43 43 ALA C C 13 176.592 0.060 1 1 . . . . 43 A C . 16482 1
410 . 1 1 43 43 ALA CA C 13 51.772 0.043 20 1 . . . . 43 A CA . 16482 1
411 . 1 1 43 43 ALA CB C 13 20.036 0.030 28 1 . . . . 43 A CB . 16482 1
412 . 1 1 43 43 ALA N N 15 118.776 0.054 30 1 . . . . 43 A N . 16482 1
413 . 1 1 44 44 GLY H H 1 7.948 0.009 41 1 . . . . 44 G H . 16482 1
414 . 1 1 44 44 GLY HA2 H 1 4.239 0.010 19 2 . . . . 44 G HA2 . 16482 1
415 . 1 1 44 44 GLY HA3 H 1 3.729 0.019 19 2 . . . . 44 G HA3 . 16482 1
416 . 1 1 44 44 GLY C C 13 174.505 0.060 1 1 . . . . 44 G C . 16482 1
417 . 1 1 44 44 GLY CA C 13 44.945 0.057 30 1 . . . . 44 G CA . 16482 1
418 . 1 1 44 44 GLY N N 15 104.253 0.056 28 1 . . . . 44 G N . 16482 1
419 . 1 1 45 45 CYS H H 1 7.378 0.010 43 1 . . . . 45 C H . 16482 1
420 . 1 1 45 45 CYS HA H 1 4.681 0.016 7 1 . . . . 45 C HA . 16482 1
421 . 1 1 45 45 CYS HB2 H 1 3.026 0.010 29 2 . . . . 45 C HB2 . 16482 1
422 . 1 1 45 45 CYS HB3 H 1 2.146 0.009 29 2 . . . . 45 C HB3 . 16482 1
423 . 1 1 45 45 CYS C C 13 174.507 0.060 1 1 . . . . 45 C C . 16482 1
424 . 1 1 45 45 CYS CA C 13 52.626 0.025 9 1 . . . . 45 C CA . 16482 1
425 . 1 1 45 45 CYS CB C 13 34.214 0.026 50 1 . . . . 45 C CB . 16482 1
426 . 1 1 45 45 CYS N N 15 117.649 0.063 33 1 . . . . 45 C N . 16482 1
427 . 1 1 46 46 LEU H H 1 8.264 0.007 29 1 . . . . 46 L H . 16482 1
428 . 1 1 46 46 LEU HA H 1 4.316 0.007 17 1 . . . . 46 L HA . 16482 1
429 . 1 1 46 46 LEU HB2 H 1 1.524 0.012 18 2 . . . . 46 L QB . 16482 1
430 . 1 1 46 46 LEU HB3 H 1 1.524 0.012 18 2 . . . . 46 L QB . 16482 1
431 . 1 1 46 46 LEU HD11 H 1 0.867 0.009 11 2 . . . . 46 L MD1 . 16482 1
432 . 1 1 46 46 LEU HD12 H 1 0.867 0.009 11 2 . . . . 46 L MD1 . 16482 1
433 . 1 1 46 46 LEU HD13 H 1 0.867 0.009 11 2 . . . . 46 L MD1 . 16482 1
434 . 1 1 46 46 LEU HD21 H 1 0.932 0.013 15 2 . . . . 46 L MD2 . 16482 1
435 . 1 1 46 46 LEU HD22 H 1 0.932 0.013 15 2 . . . . 46 L MD2 . 16482 1
436 . 1 1 46 46 LEU HD23 H 1 0.932 0.013 15 2 . . . . 46 L MD2 . 16482 1
437 . 1 1 46 46 LEU HG H 1 1.569 0.016 11 1 . . . . 46 L HG . 16482 1
438 . 1 1 46 46 LEU C C 13 176.857 0.060 1 1 . . . . 46 L C . 16482 1
439 . 1 1 46 46 LEU CA C 13 55.308 0.035 16 1 . . . . 46 L CA . 16482 1
440 . 1 1 46 46 LEU CB C 13 42.686 0.028 18 1 . . . . 46 L CB . 16482 1
441 . 1 1 46 46 LEU CD1 C 13 23.576 0.030 11 2 . . . . 46 L CD1 . 16482 1
442 . 1 1 46 46 LEU CD2 C 13 24.995 0.041 10 2 . . . . 46 L CD2 . 16482 1
443 . 1 1 46 46 LEU CG C 13 27.118 0.051 11 1 . . . . 46 L CG . 16482 1
444 . 1 1 46 46 LEU N N 15 122.480 0.057 22 1 . . . . 46 L N . 16482 1
445 . 1 1 47 47 TYR H H 1 7.984 0.010 27 1 . . . . 47 Y H . 16482 1
446 . 1 1 47 47 TYR HA H 1 4.638 0.003 7 1 . . . . 47 Y HA . 16482 1
447 . 1 1 47 47 TYR HB2 H 1 3.114 0.004 15 2 . . . . 47 Y HB2 . 16482 1
448 . 1 1 47 47 TYR HB3 H 1 2.954 0.007 18 2 . . . . 47 Y HB3 . 16482 1
449 . 1 1 47 47 TYR HD1 H 1 7.127 0.008 22 3 . . . . 47 Y QD . 16482 1
450 . 1 1 47 47 TYR HD2 H 1 7.127 0.008 22 3 . . . . 47 Y QD . 16482 1
451 . 1 1 47 47 TYR HE1 H 1 6.851 0.008 22 3 . . . . 47 Y QE . 16482 1
452 . 1 1 47 47 TYR HE2 H 1 6.851 0.008 22 3 . . . . 47 Y QE . 16482 1
453 . 1 1 47 47 TYR CA C 13 57.349 0.033 8 1 . . . . 47 Y CA . 16482 1
454 . 1 1 47 47 TYR CB C 13 38.930 0.029 29 1 . . . . 47 Y CB . 16482 1
455 . 1 1 47 47 TYR CD1 C 13 133.349 0.064 13 3 . . . . 47 Y CD1 . 16482 1
456 . 1 1 47 47 TYR CE1 C 13 118.196 0.033 14 3 . . . . 47 Y CE1 . 16482 1
457 . 1 1 47 47 TYR N N 15 119.022 0.048 23 1 . . . . 47 Y N . 16482 1
458 . 1 1 48 48 ASN H H 1 8.344 0.005 6 1 . . . . 48 N H . 16482 1
459 . 1 1 48 48 ASN HA H 1 4.842 0.006 7 1 . . . . 48 N HA . 16482 1
460 . 1 1 48 48 ASN HB2 H 1 2.859 0.005 7 2 . . . . 48 N HB2 . 16482 1
461 . 1 1 48 48 ASN HB3 H 1 2.737 0.003 7 2 . . . . 48 N HB3 . 16482 1
462 . 1 1 48 48 ASN HD21 H 1 7.599 0.003 9 2 . . . . 48 N HD21 . 16482 1
463 . 1 1 48 48 ASN HD22 H 1 6.893 0.003 9 2 . . . . 48 N HD22 . 16482 1
464 . 1 1 48 48 ASN C C 13 178.355 0.060 1 1 . . . . 48 N C . 16482 1
465 . 1 1 48 48 ASN CA C 13 53.087 0.035 10 1 . . . . 48 N CA . 16482 1
466 . 1 1 48 48 ASN CB C 13 39.291 0.023 21 1 . . . . 48 N CB . 16482 1
467 . 1 1 48 48 ASN N N 15 119.774 0.026 6 1 . . . . 48 N N . 16482 1
468 . 1 1 48 48 ASN ND2 N 15 111.834 0.274 14 1 . . . . 48 N ND2 . 16482 1
469 . 1 1 49 49 SER H H 1 8.200 0.018 8 1 . . . . 49 S H . 16482 1
470 . 1 1 49 49 SER HA H 1 4.553 0.001 6 1 . . . . 49 S HA . 16482 1
471 . 1 1 49 49 SER HB2 H 1 3.950 0.007 4 2 . . . . 49 S QB . 16482 1
472 . 1 1 49 49 SER HB3 H 1 3.950 0.007 4 2 . . . . 49 S QB . 16482 1
473 . 1 1 49 49 SER C C 13 173.999 0.060 1 1 . . . . 49 S C . 16482 1
474 . 1 1 49 49 SER CA C 13 58.526 0.034 11 1 . . . . 49 S CA . 16482 1
475 . 1 1 49 49 SER CB C 13 64.158 0.086 9 1 . . . . 49 S CB . 16482 1
476 . 1 1 49 49 SER N N 15 116.108 0.094 8 1 . . . . 49 S N . 16482 1
477 . 1 1 50 50 THR H H 1 7.844 0.009 17 1 . . . . 50 T H . 16482 1
478 . 1 1 50 50 THR HA H 1 4.223 0.003 9 1 . . . . 50 T HA . 16482 1
479 . 1 1 50 50 THR HB H 1 4.297 0.003 8 1 . . . . 50 T HB . 16482 1
480 . 1 1 50 50 THR HG21 H 1 1.218 0.002 4 1 . . . . 50 T MG . 16482 1
481 . 1 1 50 50 THR HG22 H 1 1.218 0.002 4 1 . . . . 50 T MG . 16482 1
482 . 1 1 50 50 THR HG23 H 1 1.218 0.002 4 1 . . . . 50 T MG . 16482 1
483 . 1 1 50 50 THR CA C 13 63.391 0.045 10 1 . . . . 50 T CA . 16482 1
484 . 1 1 50 50 THR CB C 13 70.831 0.018 8 1 . . . . 50 T CB . 16482 1
485 . 1 1 50 50 THR CG2 C 13 22.135 0.016 3 1 . . . . 50 T CG2 . 16482 1
486 . 1 1 50 50 THR N N 15 120.143 0.054 15 1 . . . . 50 T N . 16482 1
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