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 15446
_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
;
The last column under the field "details" is the number of assigned peaks used to infer a particular reasonance.
The protons in particular are always at least amino acid sidechain specificaly
assigned. The QB, QG, QD, refer ro methyl groups of Alanines, Leicines, Valines,
Isoleucines. So most will be umbiguities type 2 while few type 4 are possible.
;
_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' . . . 15446 1
2 '3D HNCA' . . . 15446 1
3 '3D HNCACB' . . . 15446 1
4 '3D HNCO' . . . 15446 1
5 '3D CBCA(CO)NH' . . . 15446 1
6 '3D HBHA(CO)NH' . . . 15446 1
7 '3D C(CO)NH' . . . 15446 1
8 '3D H(CCO)NH' . . . 15446 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 MET HA H 1 4.060 0.05 . 1 . . . . 1 M HA 2 15446 1
2 . 1 1 1 1 MET HB2 H 1 2.181 0.003 . 2 . . . . 1 M HB2 3 15446 1
3 . 1 1 1 1 MET HB3 H 1 2.008 0.007 . 2 . . . . 1 M HB3 3 15446 1
4 . 1 1 1 1 MET HG2 H 1 2.432 0.007 . 2 . . . . 1 M HG2 5 15446 1
5 . 1 1 1 1 MET HG3 H 1 2.519 0.010 . 2 . . . . 1 M HG3 5 15446 1
6 . 1 1 1 1 MET C C 13 171.694 0.026 . 1 . . . . 1 M C 2 15446 1
7 . 1 1 1 1 MET CA C 13 54.858 0.026 . 1 . . . . 1 M CA 4 15446 1
8 . 1 1 1 1 MET CB C 13 33.710 0.071 . 1 . . . . 1 M CB 4 15446 1
9 . 1 1 1 1 MET CG C 13 30.409 0.049 . 1 . . . . 1 M CG 5 15446 1
10 . 1 1 2 2 LYS H H 1 8.700 0.004 . 1 . . . . 2 K H 20 15446 1
11 . 1 1 2 2 LYS HA H 1 4.472 0.019 . 1 . . . . 2 K HA 6 15446 1
12 . 1 1 2 2 LYS HB2 H 1 1.707 0.05 . 2 . . . . 2 K HB2 2 15446 1
13 . 1 1 2 2 LYS HB3 H 1 1.521 0.003 . 2 . . . . 2 K HB3 4 15446 1
14 . 1 1 2 2 LYS HD3 H 1 1.693 0.05 . 2 . . . . 2 K HD3 2 15446 1
15 . 1 1 2 2 LYS HG3 H 1 1.393 0.05 . 2 . . . . 2 K HG3 2 15446 1
16 . 1 1 2 2 LYS C C 13 175.679 0.4 . 1 . . . . 2 K C 2 15446 1
17 . 1 1 2 2 LYS CA C 13 54.990 0.052 . 1 . . . . 2 K CA 10 15446 1
18 . 1 1 2 2 LYS CB C 13 33.446 0.045 . 1 . . . . 2 K CB 5 15446 1
19 . 1 1 2 2 LYS CD C 13 28.505 0.4 . 1 . . . . 2 K CD 2 15446 1
20 . 1 1 2 2 LYS CG C 13 24.696 0.4 . 1 . . . . 2 K CG 2 15446 1
21 . 1 1 2 2 LYS N N 15 126.260 0.018 . 1 . . . . 2 K N 20 15446 1
22 . 1 1 3 3 CYS H H 1 8.352 0.002 . 1 . . . . 3 C H 22 15446 1
23 . 1 1 3 3 CYS C C 13 176.683 0.4 . 1 . . . . 3 C C 1 15446 1
24 . 1 1 3 3 CYS CA C 13 56.944 0.005 . 1 . . . . 3 C CA 2 15446 1
25 . 1 1 3 3 CYS N N 15 126.147 0.023 . 1 . . . . 3 C N 22 15446 1
26 . 1 1 4 4 PRO HA H 1 4.380 0.005 . 1 . . . . 4 P HA 4 15446 1
27 . 1 1 4 4 PRO HB2 H 1 2.022 0.012 . 2 . . . . 4 P HB2 3 15446 1
28 . 1 1 4 4 PRO HB3 H 1 2.245 0.05 . 2 . . . . 4 P HB3 3 15446 1
29 . 1 1 4 4 PRO HG3 H 1 1.866 0.007 . 2 . . . . 4 P HG3 4 15446 1
30 . 1 1 4 4 PRO C C 13 175.678 0.001 . 1 . . . . 4 P C 2 15446 1
31 . 1 1 4 4 PRO CA C 13 63.509 0.065 . 1 . . . . 4 P CA 6 15446 1
32 . 1 1 4 4 PRO CB C 13 32.252 0.043 . 1 . . . . 4 P CB 5 15446 1
33 . 1 1 4 4 PRO CD C 13 51.580 0.4 . 1 . . . . 4 P CD 1 15446 1
34 . 1 1 4 4 PRO CG C 13 26.739 0.056 . 1 . . . . 4 P CG 3 15446 1
35 . 1 1 5 5 VAL H H 1 9.086 0.005 . 1 . . . . 5 V H 26 15446 1
36 . 1 1 5 5 VAL HA H 1 3.884 0.004 . 1 . . . . 5 V HA 7 15446 1
37 . 1 1 5 5 VAL HB H 1 1.840 0.011 . 1 . . . . 5 V HB 5 15446 1
38 . 1 1 5 5 VAL HG11 H 1 0.854 0.005 . 2 . . . . 5 V QG1 11 15446 1
39 . 1 1 5 5 VAL HG12 H 1 0.854 0.005 . 2 . . . . 5 V QG1 11 15446 1
40 . 1 1 5 5 VAL HG13 H 1 0.854 0.005 . 2 . . . . 5 V QG1 11 15446 1
41 . 1 1 5 5 VAL HG21 H 1 0.782 0.006 . 2 . . . . 5 V QG2 4 15446 1
42 . 1 1 5 5 VAL HG22 H 1 0.782 0.006 . 2 . . . . 5 V QG2 4 15446 1
43 . 1 1 5 5 VAL HG23 H 1 0.782 0.006 . 2 . . . . 5 V QG2 4 15446 1
44 . 1 1 5 5 VAL C C 13 176.336 0.015 . 1 . . . . 5 V C 3 15446 1
45 . 1 1 5 5 VAL CA C 13 64.960 0.075 . 1 . . . . 5 V CA 8 15446 1
46 . 1 1 5 5 VAL CB C 13 32.873 0.018 . 1 . . . . 5 V CB 6 15446 1
47 . 1 1 5 5 VAL CG1 C 13 21.357 0.089 . 2 . . . . 5 V CG1 7 15446 1
48 . 1 1 5 5 VAL CG2 C 13 21.517 0.004 . 2 . . . . 5 V CG2 2 15446 1
49 . 1 1 5 5 VAL N N 15 122.875 0.020 . 1 . . . . 5 V N 26 15446 1
50 . 1 1 6 6 CYS H H 1 9.057 0.007 . 1 . . . . 6 C H 25 15446 1
51 . 1 1 6 6 CYS HA H 1 4.752 0.001 . 1 . . . . 6 C HA 3 15446 1
52 . 1 1 6 6 CYS HB2 H 1 2.925 0.007 . 2 . . . . 6 C HB2 5 15446 1
53 . 1 1 6 6 CYS HB3 H 1 3.240 0.004 . 2 . . . . 6 C HB3 5 15446 1
54 . 1 1 6 6 CYS C C 13 177.205 0.020 . 1 . . . . 6 C C 3 15446 1
55 . 1 1 6 6 CYS CA C 13 59.098 0.055 . 1 . . . . 6 C CA 8 15446 1
56 . 1 1 6 6 CYS CB C 13 31.191 0.026 . 1 . . . . 6 C CB 8 15446 1
57 . 1 1 6 6 CYS N N 15 120.387 0.055 . 1 . . . . 6 C N 24 15446 1
58 . 1 1 7 7 HIS H H 1 7.189 0.008 . 1 . . . . 7 H H 24 15446 1
59 . 1 1 7 7 HIS HA H 1 4.534 0.005 . 1 . . . . 7 H HA 4 15446 1
60 . 1 1 7 7 HIS HB2 H 1 3.370 0.003 . 2 . . . . 7 H HB2 3 15446 1
61 . 1 1 7 7 HIS HB3 H 1 3.574 0.003 . 2 . . . . 7 H HB3 3 15446 1
62 . 1 1 7 7 HIS HD2 H 1 7.108 0.002 . 1 . . . . 7 H HD2 2 15446 1
63 . 1 1 7 7 HIS C C 13 174.626 0.021 . 1 . . . . 7 H C 3 15446 1
64 . 1 1 7 7 HIS CA C 13 57.594 0.010 . 1 . . . . 7 H CA 7 15446 1
65 . 1 1 7 7 HIS CB C 13 26.985 0.045 . 1 . . . . 7 H CB 7 15446 1
66 . 1 1 7 7 HIS CD2 C 13 119.421 0.4 . 1 . . . . 7 H CD2 1 15446 1
67 . 1 1 7 7 HIS N N 15 114.944 0.054 . 1 . . . . 7 H N 22 15446 1
68 . 1 1 8 8 GLN H H 1 9.012 0.004 . 1 . . . . 8 Q H 24 15446 1
69 . 1 1 8 8 GLN HA H 1 4.449 0.05 . 1 . . . . 8 Q HA 2 15446 1
70 . 1 1 8 8 GLN HB3 H 1 1.773 0.006 . 2 . . . . 8 Q HB3 3 15446 1
71 . 1 1 8 8 GLN HE21 H 1 7.264 0.05 . 2 . . . . 8 Q HE21 1 15446 1
72 . 1 1 8 8 GLN HE22 H 1 6.676 0.05 . 2 . . . . 8 Q HE22 1 15446 1
73 . 1 1 8 8 GLN HG3 H 1 2.168 0.05 . 2 . . . . 8 Q HG3 2 15446 1
74 . 1 1 8 8 GLN C C 13 175.566 0.022 . 1 . . . . 8 Q C 3 15446 1
75 . 1 1 8 8 GLN CA C 13 56.489 0.030 . 1 . . . . 8 Q CA 8 15446 1
76 . 1 1 8 8 GLN CB C 13 30.814 0.019 . 1 . . . . 8 Q CB 5 15446 1
77 . 1 1 8 8 GLN CG C 13 33.989 0.4 . 1 . . . . 8 Q CG 2 15446 1
78 . 1 1 8 8 GLN N N 15 119.716 0.036 . 1 . . . . 8 Q N 23 15446 1
79 . 1 1 8 8 GLN NE2 N 15 111.010 0.006 . 1 . . . . 8 Q NE2 2 15446 1
80 . 1 1 9 9 GLY H H 1 7.253 0.003 . 1 . . . . 9 G H 23 15446 1
81 . 1 1 9 9 GLY HA2 H 1 4.216 0.05 . 2 . . . . 9 G HA2 3 15446 1
82 . 1 1 9 9 GLY HA3 H 1 3.979 0.003 . 2 . . . . 9 G HA3 3 15446 1
83 . 1 1 9 9 GLY C C 13 171.753 0.008 . 1 . . . . 9 G C 3 15446 1
84 . 1 1 9 9 GLY CA C 13 45.131 0.069 . 1 . . . . 9 G CA 9 15446 1
85 . 1 1 9 9 GLY N N 15 105.500 0.058 . 1 . . . . 9 G N 21 15446 1
86 . 1 1 10 10 GLU H H 1 7.837 0.003 . 1 . . . . 10 E H 19 15446 1
87 . 1 1 10 10 GLU HA H 1 4.498 0.001 . 1 . . . . 10 E HA 3 15446 1
88 . 1 1 10 10 GLU HB2 H 1 1.820 0.007 . 2 . . . . 10 E HB2 3 15446 1
89 . 1 1 10 10 GLU HB3 H 1 1.936 0.006 . 2 . . . . 10 E HB3 3 15446 1
90 . 1 1 10 10 GLU HG2 H 1 2.201 0.05 . 2 . . . . 10 E HG2 2 15446 1
91 . 1 1 10 10 GLU HG3 H 1 2.254 0.05 . 2 . . . . 10 E HG3 2 15446 1
92 . 1 1 10 10 GLU C C 13 175.841 0.010 . 1 . . . . 10 E C 3 15446 1
93 . 1 1 10 10 GLU CA C 13 55.599 0.031 . 1 . . . . 10 E CA 8 15446 1
94 . 1 1 10 10 GLU CB C 13 31.047 0.008 . 1 . . . . 10 E CB 6 15446 1
95 . 1 1 10 10 GLU CG C 13 35.993 0.4 . 1 . . . . 10 E CG 3 15446 1
96 . 1 1 10 10 GLU N N 15 120.741 0.056 . 1 . . . . 10 E N 17 15446 1
97 . 1 1 11 11 MET H H 1 8.032 0.006 . 1 . . . . 11 M H 28 15446 1
98 . 1 1 11 11 MET HA H 1 4.912 0.001 . 1 . . . . 11 M HA 3 15446 1
99 . 1 1 11 11 MET HB2 H 1 1.637 0.05 . 2 . . . . 11 M HB2 2 15446 1
100 . 1 1 11 11 MET HB3 H 1 1.931 0.05 . 2 . . . . 11 M HB3 2 15446 1
101 . 1 1 11 11 MET HG2 H 1 2.080 0.05 . 2 . . . . 11 M HG2 2 15446 1
102 . 1 1 11 11 MET HG3 H 1 2.447 0.05 . 2 . . . . 11 M HG3 2 15446 1
103 . 1 1 11 11 MET C C 13 176.383 0.011 . 1 . . . . 11 M C 3 15446 1
104 . 1 1 11 11 MET CA C 13 53.925 0.026 . 1 . . . . 11 M CA 8 15446 1
105 . 1 1 11 11 MET CB C 13 32.731 0.027 . 1 . . . . 11 M CB 5 15446 1
106 . 1 1 11 11 MET CG C 13 32.053 0.4 . 1 . . . . 11 M CG 3 15446 1
107 . 1 1 11 11 MET N N 15 118.683 0.051 . 1 . . . . 11 M N 26 15446 1
108 . 1 1 12 12 VAL H H 1 8.867 0.009 . 1 . . . . 12 V H 27 15446 1
109 . 1 1 12 12 VAL HA H 1 4.455 0.001 . 1 . . . . 12 V HA 3 15446 1
110 . 1 1 12 12 VAL HB H 1 2.015 0.005 . 1 . . . . 12 V HB 5 15446 1
111 . 1 1 12 12 VAL HG21 H 1 0.938 0.006 . 2 . . . . 12 V QG2 8 15446 1
112 . 1 1 12 12 VAL HG22 H 1 0.938 0.006 . 2 . . . . 12 V QG2 8 15446 1
113 . 1 1 12 12 VAL HG23 H 1 0.938 0.006 . 2 . . . . 12 V QG2 8 15446 1
114 . 1 1 12 12 VAL C C 13 175.990 0.028 . 1 . . . . 12 V C 3 15446 1
115 . 1 1 12 12 VAL CA C 13 60.543 0.021 . 1 . . . . 12 V CA 8 15446 1
116 . 1 1 12 12 VAL CB C 13 35.214 0.017 . 1 . . . . 12 V CB 6 15446 1
117 . 1 1 12 12 VAL CG2 C 13 20.876 0.046 . 2 . . . . 12 V CG2 5 15446 1
118 . 1 1 12 12 VAL N N 15 122.471 0.051 . 1 . . . . 12 V N 24 15446 1
119 . 1 1 13 13 SER H H 1 8.771 0.007 . 1 . . . . 13 S H 25 15446 1
120 . 1 1 13 13 SER HA H 1 4.933 0.005 . 1 . . . . 13 S HA 4 15446 1
121 . 1 1 13 13 SER HB3 H 1 3.838 0.002 . 2 . . . . 13 S HB3 3 15446 1
122 . 1 1 13 13 SER C C 13 175.177 0.035 . 1 . . . . 13 S C 3 15446 1
123 . 1 1 13 13 SER CA C 13 58.412 0.029 . 1 . . . . 13 S CA 8 15446 1
124 . 1 1 13 13 SER CB C 13 63.267 0.036 . 1 . . . . 13 S CB 5 15446 1
125 . 1 1 13 13 SER N N 15 122.853 0.064 . 1 . . . . 13 S N 23 15446 1
126 . 1 1 14 14 GLY H H 1 8.786 0.005 . 1 . . . . 14 G H 22 15446 1
127 . 1 1 14 14 GLY HA2 H 1 4.313 0.002 . 2 . . . . 14 G HA2 3 15446 1
128 . 1 1 14 14 GLY HA3 H 1 4.072 0.002 . 2 . . . . 14 G HA3 3 15446 1
129 . 1 1 14 14 GLY C C 13 171.047 0.010 . 1 . . . . 14 G C 3 15446 1
130 . 1 1 14 14 GLY CA C 13 45.588 0.073 . 1 . . . . 14 G CA 9 15446 1
131 . 1 1 14 14 GLY N N 15 113.355 0.066 . 1 . . . . 14 G N 20 15446 1
132 . 1 1 15 15 ILE H H 1 8.033 0.007 . 1 . . . . 15 I H 28 15446 1
133 . 1 1 15 15 ILE HA H 1 4.720 0.002 . 1 . . . . 15 I HA 3 15446 1
134 . 1 1 15 15 ILE HB H 1 1.320 0.007 . 1 . . . . 15 I HB 11 15446 1
135 . 1 1 15 15 ILE HD11 H 1 0.685 0.006 . 2 . . . . 15 I QD1 22 15446 1
136 . 1 1 15 15 ILE HD12 H 1 0.685 0.006 . 2 . . . . 15 I QD1 22 15446 1
137 . 1 1 15 15 ILE HD13 H 1 0.685 0.006 . 2 . . . . 15 I QD1 22 15446 1
138 . 1 1 15 15 ILE HG12 H 1 1.225 0.005 . 2 . . . . 15 I HG12 18 15446 1
139 . 1 1 15 15 ILE HG13 H 1 0.418 0.008 . 2 . . . . 15 I HG13 15 15446 1
140 . 1 1 15 15 ILE HG21 H 1 0.513 0.008 . 2 . . . . 15 I QG2 30 15446 1
141 . 1 1 15 15 ILE HG22 H 1 0.513 0.008 . 2 . . . . 15 I QG2 30 15446 1
142 . 1 1 15 15 ILE HG23 H 1 0.513 0.008 . 2 . . . . 15 I QG2 30 15446 1
143 . 1 1 15 15 ILE C C 13 174.986 0.007 . 1 . . . . 15 I C 3 15446 1
144 . 1 1 15 15 ILE CA C 13 59.965 0.032 . 1 . . . . 15 I CA 8 15446 1
145 . 1 1 15 15 ILE CB C 13 41.303 0.043 . 1 . . . . 15 I CB 9 15446 1
146 . 1 1 15 15 ILE CD1 C 13 13.970 0.082 . 1 . . . . 15 I CD1 12 15446 1
147 . 1 1 15 15 ILE CG1 C 13 26.531 0.058 . 1 . . . . 15 I CG1 18 15446 1
148 . 1 1 15 15 ILE CG2 C 13 17.653 0.065 . 1 . . . . 15 I CG2 17 15446 1
149 . 1 1 15 15 ILE N N 15 117.527 0.104 . 1 . . . . 15 I N 22 15446 1
150 . 1 1 16 16 LYS H H 1 8.007 0.003 . 1 . . . . 16 K H 26 15446 1
151 . 1 1 16 16 LYS HA H 1 4.306 0.002 . 1 . . . . 16 K HA 3 15446 1
152 . 1 1 16 16 LYS HB2 H 1 0.967 0.005 . 2 . . . . 16 K HB2 4 15446 1
153 . 1 1 16 16 LYS HB3 H 1 1.289 0.004 . 2 . . . . 16 K HB3 6 15446 1
154 . 1 1 16 16 LYS C C 13 173.783 0.014 . 1 . . . . 16 K C 3 15446 1
155 . 1 1 16 16 LYS CA C 13 55.201 0.045 . 1 . . . . 16 K CA 8 15446 1
156 . 1 1 16 16 LYS CB C 13 37.053 0.025 . 1 . . . . 16 K CB 8 15446 1
157 . 1 1 16 16 LYS CD C 13 29.254 0.4 . 1 . . . . 16 K CD 1 15446 1
158 . 1 1 16 16 LYS CE C 13 41.886 0.4 . 1 . . . . 16 K CE 1 15446 1
159 . 1 1 16 16 LYS CG C 13 25.054 0.4 . 1 . . . . 16 K CG 1 15446 1
160 . 1 1 16 16 LYS N N 15 124.263 0.039 . 1 . . . . 16 K N 26 15446 1
161 . 1 1 17 17 ASP H H 1 8.055 0.006 . 1 . . . . 17 D H 27 15446 1
162 . 1 1 17 17 ASP HA H 1 5.403 0.004 . 1 . . . . 17 D HA 7 15446 1
163 . 1 1 17 17 ASP HB2 H 1 2.267 0.004 . 2 . . . . 17 D HB2 4 15446 1
164 . 1 1 17 17 ASP HB3 H 1 2.465 0.004 . 2 . . . . 17 D HB3 6 15446 1
165 . 1 1 17 17 ASP C C 13 176.142 0.005 . 1 . . . . 17 D C 2 15446 1
166 . 1 1 17 17 ASP CA C 13 52.606 0.067 . 1 . . . . 17 D CA 8 15446 1
167 . 1 1 17 17 ASP CB C 13 40.250 0.027 . 1 . . . . 17 D CB 9 15446 1
168 . 1 1 17 17 ASP N N 15 122.941 0.037 . 1 . . . . 17 D N 25 15446 1
169 . 1 1 18 18 ILE H H 1 8.832 0.004 . 1 . . . . 18 I H 19 15446 1
170 . 1 1 18 18 ILE HA H 1 4.597 0.001 . 1 . . . . 18 I HA 2 15446 1
171 . 1 1 18 18 ILE HB H 1 1.925 0.001 . 1 . . . . 18 I HB 5 15446 1
172 . 1 1 18 18 ILE HD11 H 1 0.811 0.003 . 2 . . . . 18 I QD1 5 15446 1
173 . 1 1 18 18 ILE HD12 H 1 0.811 0.003 . 2 . . . . 18 I QD1 5 15446 1
174 . 1 1 18 18 ILE HD13 H 1 0.811 0.003 . 2 . . . . 18 I QD1 5 15446 1
175 . 1 1 18 18 ILE HG12 H 1 1.440 0.003 . 2 . . . . 18 I HG12 5 15446 1
176 . 1 1 18 18 ILE HG13 H 1 1.123 0.011 . 2 . . . . 18 I HG13 6 15446 1
177 . 1 1 18 18 ILE HG21 H 1 1.062 0.006 . 2 . . . . 18 I QG2 3 15446 1
178 . 1 1 18 18 ILE HG22 H 1 1.062 0.006 . 2 . . . . 18 I QG2 3 15446 1
179 . 1 1 18 18 ILE HG23 H 1 1.062 0.006 . 2 . . . . 18 I QG2 3 15446 1
180 . 1 1 18 18 ILE CA C 13 57.781 0.040 . 1 . . . . 18 I CA 4 15446 1
181 . 1 1 18 18 ILE CB C 13 41.183 0.031 . 1 . . . . 18 I CB 4 15446 1
182 . 1 1 18 18 ILE CD1 C 13 12.012 0.057 . 1 . . . . 18 I CD1 2 15446 1
183 . 1 1 18 18 ILE CG1 C 13 26.995 0.061 . 1 . . . . 18 I CG1 4 15446 1
184 . 1 1 18 18 ILE CG2 C 13 16.224 0.013 . 1 . . . . 18 I CG2 2 15446 1
185 . 1 1 18 18 ILE N N 15 125.798 0.046 . 1 . . . . 18 I N 18 15446 1
186 . 1 1 19 19 PRO HA H 1 4.886 0.005 . 1 . . . . 19 P HA 7 15446 1
187 . 1 1 19 19 PRO HB2 H 1 1.936 0.004 . 2 . . . . 19 P HB2 5 15446 1
188 . 1 1 19 19 PRO HB3 H 1 2.242 0.008 . 2 . . . . 19 P HB3 5 15446 1
189 . 1 1 19 19 PRO HD3 H 1 3.169 0.05 . 2 . . . . 19 P HD3 2 15446 1
190 . 1 1 19 19 PRO HG2 H 1 1.603 0.05 . 2 . . . . 19 P HG2 2 15446 1
191 . 1 1 19 19 PRO HG3 H 1 1.769 0.05 . 2 . . . . 19 P HG3 2 15446 1
192 . 1 1 19 19 PRO CA C 13 62.709 0.042 . 1 . . . . 19 P CA 6 15446 1
193 . 1 1 19 19 PRO CB C 13 32.295 0.067 . 1 . . . . 19 P CB 7 15446 1
194 . 1 1 19 19 PRO CD C 13 51.178 0.4 . 1 . . . . 19 P CD 2 15446 1
195 . 1 1 19 19 PRO CG C 13 27.437 0.4 . 1 . . . . 19 P CG 3 15446 1
196 . 1 1 20 20 TYR H H 1 8.458 0.004 . 1 . . . . 20 Y H 23 15446 1
197 . 1 1 20 20 TYR HA H 1 4.661 0.004 . 1 . . . . 20 Y HA 5 15446 1
198 . 1 1 20 20 TYR HB2 H 1 2.198 0.005 . 2 . . . . 20 Y HB2 5 15446 1
199 . 1 1 20 20 TYR HB3 H 1 2.815 0.004 . 2 . . . . 20 Y HB3 3 15446 1
200 . 1 1 20 20 TYR HD1 H 1 7.051 0.05 . 3 . . . . 20 Y QD 1 15446 1
201 . 1 1 20 20 TYR HD2 H 1 7.051 0.05 . 3 . . . . 20 Y QD 1 15446 1
202 . 1 1 20 20 TYR CA C 13 58.441 0.032 . 1 . . . . 20 Y CA 8 15446 1
203 . 1 1 20 20 TYR CB C 13 42.852 0.028 . 1 . . . . 20 Y CB 7 15446 1
204 . 1 1 20 20 TYR N N 15 123.657 0.098 . 1 . . . . 20 Y N 23 15446 1
205 . 1 1 21 21 THR H H 1 7.216 0.005 . 1 . . . . 21 T H 21 15446 1
206 . 1 1 21 21 THR HA H 1 5.316 0.004 . 1 . . . . 21 T HA 6 15446 1
207 . 1 1 21 21 THR HB H 1 3.763 0.003 . 1 . . . . 21 T HB 4 15446 1
208 . 1 1 21 21 THR C C 13 172.387 0.019 . 1 . . . . 21 T C 2 15446 1
209 . 1 1 21 21 THR CA C 13 59.881 0.106 . 1 . . . . 21 T CA 8 15446 1
210 . 1 1 21 21 THR CB C 13 70.770 0.150 . 1 . . . . 21 T CB 5 15446 1
211 . 1 1 21 21 THR CG2 C 13 20.822 0.4 . 1 . . . . 21 T CG2 1 15446 1
212 . 1 1 21 21 THR N N 15 120.707 0.037 . 1 . . . . 21 T N 19 15446 1
213 . 1 1 22 22 PHE H H 1 8.884 0.008 . 1 . . . . 22 F H 27 15446 1
214 . 1 1 22 22 PHE HA H 1 4.674 0.004 . 1 . . . . 22 F HA 5 15446 1
215 . 1 1 22 22 PHE HB2 H 1 2.741 0.008 . 2 . . . . 22 F HB2 5 15446 1
216 . 1 1 22 22 PHE HB3 H 1 3.309 0.008 . 2 . . . . 22 F HB3 4 15446 1
217 . 1 1 22 22 PHE HD1 H 1 7.046 0.010 . 3 . . . . 22 F QD 2 15446 1
218 . 1 1 22 22 PHE HD2 H 1 7.046 0.010 . 3 . . . . 22 F QD 2 15446 1
219 . 1 1 22 22 PHE C C 13 173.644 0.041 . 1 . . . . 22 F C 2 15446 1
220 . 1 1 22 22 PHE CA C 13 57.436 0.098 . 1 . . . . 22 F CA 7 15446 1
221 . 1 1 22 22 PHE CB C 13 42.845 0.024 . 1 . . . . 22 F CB 8 15446 1
222 . 1 1 22 22 PHE CD1 C 13 131.862 0.4 . 3 . . . . 22 F CD 1 15446 1
223 . 1 1 22 22 PHE CD2 C 13 131.862 0.4 . 3 . . . . 22 F CD 1 15446 1
224 . 1 1 22 22 PHE N N 15 124.522 0.267 . 1 . . . . 22 F N 25 15446 1
225 . 1 1 23 23 ARG H H 1 8.853 0.006 . 1 . . . . 23 R H 20 15446 1
226 . 1 1 23 23 ARG HA H 1 3.455 0.004 . 1 . . . . 23 R HA 3 15446 1
227 . 1 1 23 23 ARG HB2 H 1 1.052 0.05 . 2 . . . . 23 R HB2 2 15446 1
228 . 1 1 23 23 ARG HB3 H 1 1.630 0.05 . 2 . . . . 23 R HB3 2 15446 1
229 . 1 1 23 23 ARG HD3 H 1 2.653 0.008 . 2 . . . . 23 R HD3 3 15446 1
230 . 1 1 23 23 ARG HE H 1 6.889 0.05 . 1 . . . . 23 R HE 1 15446 1
231 . 1 1 23 23 ARG HG2 H 1 0.137 0.003 . 2 . . . . 23 R HG2 3 15446 1
232 . 1 1 23 23 ARG HG3 H 1 0.800 0.05 . 2 . . . . 23 R HG3 2 15446 1
233 . 1 1 23 23 ARG C C 13 175.887 0.016 . 1 . . . . 23 R C 2 15446 1
234 . 1 1 23 23 ARG CA C 13 57.000 0.098 . 1 . . . . 23 R CA 8 15446 1
235 . 1 1 23 23 ARG CB C 13 27.849 0.031 . 1 . . . . 23 R CB 6 15446 1
236 . 1 1 23 23 ARG CD C 13 43.918 0.4 . 1 . . . . 23 R CD 2 15446 1
237 . 1 1 23 23 ARG CG C 13 26.573 0.4 . 1 . . . . 23 R CG 3 15446 1
238 . 1 1 23 23 ARG N N 15 125.815 0.039 . 1 . . . . 23 R N 19 15446 1
239 . 1 1 23 23 ARG NE N 15 85.470 0.4 . 1 . . . . 23 R NE 1 15446 1
240 . 1 1 24 24 GLY H H 1 8.279 0.004 . 1 . . . . 24 G H 29 15446 1
241 . 1 1 24 24 GLY HA2 H 1 4.061 0.003 . 2 . . . . 24 G HA2 5 15446 1
242 . 1 1 24 24 GLY HA3 H 1 3.465 0.004 . 2 . . . . 24 G HA3 5 15446 1
243 . 1 1 24 24 GLY C C 13 173.801 0.002 . 1 . . . . 24 G C 2 15446 1
244 . 1 1 24 24 GLY CA C 13 45.389 0.093 . 1 . . . . 24 G CA 9 15446 1
245 . 1 1 24 24 GLY N N 15 103.302 0.017 . 1 . . . . 24 G N 27 15446 1
246 . 1 1 25 25 ARG H H 1 8.054 0.004 . 1 . . . . 25 R H 27 15446 1
247 . 1 1 25 25 ARG HA H 1 4.629 0.006 . 1 . . . . 25 R HA 5 15446 1
248 . 1 1 25 25 ARG HB2 H 1 2.078 0.001 . 2 . . . . 25 R HB2 3 15446 1
249 . 1 1 25 25 ARG HB3 H 1 2.156 0.014 . 2 . . . . 25 R HB3 3 15446 1
250 . 1 1 25 25 ARG HD3 H 1 3.196 0.05 . 2 . . . . 25 R HD3 2 15446 1
251 . 1 1 25 25 ARG HE H 1 7.471 0.05 . 1 . . . . 25 R HE 1 15446 1
252 . 1 1 25 25 ARG HG3 H 1 1.700 0.05 . 2 . . . . 25 R HG3 2 15446 1
253 . 1 1 25 25 ARG C C 13 174.796 0.009 . 1 . . . . 25 R C 2 15446 1
254 . 1 1 25 25 ARG CA C 13 54.429 0.034 . 1 . . . . 25 R CA 8 15446 1
255 . 1 1 25 25 ARG CB C 13 31.034 0.035 . 1 . . . . 25 R CB 6 15446 1
256 . 1 1 25 25 ARG CD C 13 42.791 0.4 . 1 . . . . 25 R CD 2 15446 1
257 . 1 1 25 25 ARG CG C 13 27.236 0.4 . 1 . . . . 25 R CG 2 15446 1
258 . 1 1 25 25 ARG N N 15 122.278 0.075 . 1 . . . . 25 R N 25 15446 1
259 . 1 1 25 25 ARG NE N 15 84.784 0.4 . 1 . . . . 25 R NE 1 15446 1
260 . 1 1 26 26 LYS H H 1 8.583 0.005 . 1 . . . . 26 K H 32 15446 1
261 . 1 1 26 26 LYS HA H 1 5.156 0.004 . 1 . . . . 26 K HA 7 15446 1
262 . 1 1 26 26 LYS HB2 H 1 1.644 0.011 . 2 . . . . 26 K HB2 3 15446 1
263 . 1 1 26 26 LYS HB3 H 1 1.789 0.004 . 2 . . . . 26 K HB3 3 15446 1
264 . 1 1 26 26 LYS HE3 H 1 2.858 0.006 . 2 . . . . 26 K HE3 4 15446 1
265 . 1 1 26 26 LYS HG2 H 1 1.567 0.05 . 2 . . . . 26 K HG2 2 15446 1
266 . 1 1 26 26 LYS HG3 H 1 1.319 0.05 . 2 . . . . 26 K HG3 2 15446 1
267 . 1 1 26 26 LYS C C 13 175.816 0.015 . 1 . . . . 26 K C 2 15446 1
268 . 1 1 26 26 LYS CA C 13 55.443 0.022 . 1 . . . . 26 K CA 8 15446 1
269 . 1 1 26 26 LYS CB C 13 35.471 0.011 . 1 . . . . 26 K CB 6 15446 1
270 . 1 1 26 26 LYS CD C 13 29.439 0.4 . 1 . . . . 26 K CD 1 15446 1
271 . 1 1 26 26 LYS CE C 13 42.076 0.005 . 1 . . . . 26 K CE 3 15446 1
272 . 1 1 26 26 LYS CG C 13 24.899 0.4 . 1 . . . . 26 K CG 3 15446 1
273 . 1 1 26 26 LYS N N 15 122.863 0.036 . 1 . . . . 26 K N 30 15446 1
274 . 1 1 27 27 THR H H 1 8.704 0.004 . 1 . . . . 27 T H 34 15446 1
275 . 1 1 27 27 THR HA H 1 4.462 0.012 . 1 . . . . 27 T HA 5 15446 1
276 . 1 1 27 27 THR HB H 1 3.205 0.010 . 1 . . . . 27 T HB 6 15446 1
277 . 1 1 27 27 THR HG21 H 1 3.002 0.05 . 2 . . . . 27 T QG2 2 15446 1
278 . 1 1 27 27 THR HG22 H 1 3.002 0.05 . 2 . . . . 27 T QG2 2 15446 1
279 . 1 1 27 27 THR HG23 H 1 3.002 0.05 . 2 . . . . 27 T QG2 2 15446 1
280 . 1 1 27 27 THR C C 13 172.322 0.027 . 1 . . . . 27 T C 2 15446 1
281 . 1 1 27 27 THR CA C 13 59.144 0.051 . 1 . . . . 27 T CA 8 15446 1
282 . 1 1 27 27 THR CB C 13 70.165 0.107 . 1 . . . . 27 T CB 5 15446 1
283 . 1 1 27 27 THR CG2 C 13 17.831 0.4 . 1 . . . . 27 T CG2 2 15446 1
284 . 1 1 27 27 THR N N 15 118.072 0.021 . 1 . . . . 27 T N 33 15446 1
285 . 1 1 28 28 VAL H H 1 7.717 0.007 . 1 . . . . 28 V H 30 15446 1
286 . 1 1 28 28 VAL HA H 1 4.274 0.003 . 1 . . . . 28 V HA 6 15446 1
287 . 1 1 28 28 VAL HB H 1 1.717 0.003 . 1 . . . . 28 V HB 6 15446 1
288 . 1 1 28 28 VAL HG11 H 1 0.754 0.006 . 2 . . . . 28 V QG1 22 15446 1
289 . 1 1 28 28 VAL HG12 H 1 0.754 0.006 . 2 . . . . 28 V QG1 22 15446 1
290 . 1 1 28 28 VAL HG13 H 1 0.754 0.006 . 2 . . . . 28 V QG1 22 15446 1
291 . 1 1 28 28 VAL HG21 H 1 0.580 0.010 . 2 . . . . 28 V QG2 27 15446 1
292 . 1 1 28 28 VAL HG22 H 1 0.580 0.010 . 2 . . . . 28 V QG2 27 15446 1
293 . 1 1 28 28 VAL HG23 H 1 0.580 0.010 . 2 . . . . 28 V QG2 27 15446 1
294 . 1 1 28 28 VAL C C 13 174.668 0.008 . 1 . . . . 28 V C 2 15446 1
295 . 1 1 28 28 VAL CA C 13 61.578 0.037 . 1 . . . . 28 V CA 8 15446 1
296 . 1 1 28 28 VAL CB C 13 34.267 0.026 . 1 . . . . 28 V CB 6 15446 1
297 . 1 1 28 28 VAL CG1 C 13 21.255 0.149 . 2 . . . . 28 V CG1 13 15446 1
298 . 1 1 28 28 VAL CG2 C 13 21.912 0.050 . 2 . . . . 28 V CG2 15 15446 1
299 . 1 1 28 28 VAL N N 15 121.803 0.094 . 1 . . . . 28 V N 28 15446 1
300 . 1 1 29 29 LEU H H 1 9.078 0.005 . 1 . . . . 29 L H 30 15446 1
301 . 1 1 29 29 LEU HA H 1 4.358 0.007 . 1 . . . . 29 L HA 11 15446 1
302 . 1 1 29 29 LEU HB2 H 1 1.076 0.006 . 2 . . . . 29 L HB2 12 15446 1
303 . 1 1 29 29 LEU HB3 H 1 1.995 0.009 . 2 . . . . 29 L HB3 11 15446 1
304 . 1 1 29 29 LEU HD11 H 1 0.342 0.008 . 2 . . . . 29 L QD1 21 15446 1
305 . 1 1 29 29 LEU HD12 H 1 0.342 0.008 . 2 . . . . 29 L QD1 21 15446 1
306 . 1 1 29 29 LEU HD13 H 1 0.342 0.008 . 2 . . . . 29 L QD1 21 15446 1
307 . 1 1 29 29 LEU HD21 H 1 0.402 0.010 . 2 . . . . 29 L QD2 13 15446 1
308 . 1 1 29 29 LEU HD22 H 1 0.402 0.010 . 2 . . . . 29 L QD2 13 15446 1
309 . 1 1 29 29 LEU HD23 H 1 0.402 0.010 . 2 . . . . 29 L QD2 13 15446 1
310 . 1 1 29 29 LEU HG H 1 1.523 0.063 . 1 . . . . 29 L HG 6 15446 1
311 . 1 1 29 29 LEU C C 13 175.587 0.012 . 1 . . . . 29 L C 2 15446 1
312 . 1 1 29 29 LEU CA C 13 53.420 0.058 . 1 . . . . 29 L CA 12 15446 1
313 . 1 1 29 29 LEU CB C 13 39.886 0.043 . 1 . . . . 29 L CB 14 15446 1
314 . 1 1 29 29 LEU CD1 C 13 26.820 0.058 . 2 . . . . 29 L CD1 14 15446 1
315 . 1 1 29 29 LEU CD2 C 13 22.570 0.072 . 2 . . . . 29 L CD2 10 15446 1
316 . 1 1 29 29 LEU CG C 13 26.330 0.4 . 1 . . . . 29 L CG 1 15446 1
317 . 1 1 29 29 LEU N N 15 129.675 0.030 . 1 . . . . 29 L N 27 15446 1
318 . 1 1 30 30 LYS H H 1 8.300 0.005 . 1 . . . . 30 K H 26 15446 1
319 . 1 1 30 30 LYS HA H 1 4.371 0.003 . 1 . . . . 30 K HA 5 15446 1
320 . 1 1 30 30 LYS HB3 H 1 1.630 0.006 . 2 . . . . 30 K HB3 3 15446 1
321 . 1 1 30 30 LYS HE3 H 1 2.898 0.005 . 2 . . . . 30 K HE3 4 15446 1
322 . 1 1 30 30 LYS HG2 H 1 1.182 0.05 . 2 . . . . 30 K HG2 2 15446 1
323 . 1 1 30 30 LYS HG3 H 1 1.418 0.004 . 2 . . . . 30 K HG3 4 15446 1
324 . 1 1 30 30 LYS CA C 13 56.008 0.030 . 1 . . . . 30 K CA 8 15446 1
325 . 1 1 30 30 LYS CB C 13 33.664 0.047 . 1 . . . . 30 K CB 4 15446 1
326 . 1 1 30 30 LYS CD C 13 28.567 0.4 . 1 . . . . 30 K CD 1 15446 1
327 . 1 1 30 30 LYS CE C 13 41.824 0.4 . 1 . . . . 30 K CE 3 15446 1
328 . 1 1 30 30 LYS CG C 13 24.878 0.048 . 1 . . . . 30 K CG 4 15446 1
329 . 1 1 30 30 LYS N N 15 123.729 0.046 . 1 . . . . 30 K N 25 15446 1
330 . 1 1 31 31 GLY H H 1 8.784 0.007 . 1 . . . . 31 G H 29 15446 1
331 . 1 1 31 31 GLY HA2 H 1 3.639 0.006 . 2 . . . . 31 G HA2 11 15446 1
332 . 1 1 31 31 GLY HA3 H 1 3.487 0.005 . 2 . . . . 31 G HA3 11 15446 1
333 . 1 1 31 31 GLY CA C 13 45.247 9.956 . 1 . . . . 31 G CA 15 15446 1
334 . 1 1 31 31 GLY N N 15 110.328 0.076 . 1 . . . . 31 G N 27 15446 1
335 . 1 1 32 32 ILE H H 1 8.628 0.007 . 1 . . . . 32 I H 20 15446 1
336 . 1 1 32 32 ILE HA H 1 4.153 0.007 . 1 . . . . 32 I HA 6 15446 1
337 . 1 1 32 32 ILE HB H 1 2.415 0.009 . 1 . . . . 32 I HB 6 15446 1
338 . 1 1 32 32 ILE HG12 H 1 1.196 0.014 . 2 . . . . 32 I HG12 4 15446 1
339 . 1 1 32 32 ILE HG21 H 1 0.942 0.002 . 2 . . . . 32 I QG2 15 15446 1
340 . 1 1 32 32 ILE HG22 H 1 0.942 0.002 . 2 . . . . 32 I QG2 15 15446 1
341 . 1 1 32 32 ILE HG23 H 1 0.942 0.002 . 2 . . . . 32 I QG2 15 15446 1
342 . 1 1 32 32 ILE C C 13 178.247 0.022 . 1 . . . . 32 I C 2 15446 1
343 . 1 1 32 32 ILE CA C 13 58.791 0.024 . 1 . . . . 32 I CA 8 15446 1
344 . 1 1 32 32 ILE CB C 13 35.015 0.105 . 1 . . . . 32 I CB 6 15446 1
345 . 1 1 32 32 ILE CD1 C 13 9.142 0.4 . 1 . . . . 32 I CD1 1 15446 1
346 . 1 1 32 32 ILE CG1 C 13 26.026 0.052 . 1 . . . . 32 I CG1 3 15446 1
347 . 1 1 32 32 ILE CG2 C 13 18.468 0.055 . 1 . . . . 32 I CG2 10 15446 1
348 . 1 1 32 32 ILE N N 15 120.372 0.026 . 1 . . . . 32 I N 16 15446 1
349 . 1 1 33 33 HIS H H 1 8.985 0.005 . 1 . . . . 33 H H 26 15446 1
350 . 1 1 33 33 HIS HA H 1 5.237 0.007 . 1 . . . . 33 H HA 6 15446 1
351 . 1 1 33 33 HIS HB2 H 1 3.256 0.003 . 2 . . . . 33 H HB2 6 15446 1
352 . 1 1 33 33 HIS HB3 H 1 3.353 0.008 . 2 . . . . 33 H HB3 6 15446 1
353 . 1 1 33 33 HIS HD2 H 1 7.432 0.008 . 1 . . . . 33 H HD2 3 15446 1
354 . 1 1 33 33 HIS C C 13 173.373 0.029 . 1 . . . . 33 H C 2 15446 1
355 . 1 1 33 33 HIS CA C 13 56.413 0.020 . 1 . . . . 33 H CA 8 15446 1
356 . 1 1 33 33 HIS CB C 13 29.693 0.037 . 1 . . . . 33 H CB 9 15446 1
357 . 1 1 33 33 HIS CD2 C 13 120.047 0.4 . 1 . . . . 33 H CD2 1 15446 1
358 . 1 1 33 33 HIS N N 15 132.798 0.037 . 1 . . . . 33 H N 24 15446 1
359 . 1 1 34 34 GLY H H 1 8.011 0.005 . 1 . . . . 34 G H 24 15446 1
360 . 1 1 34 34 GLY HA2 H 1 4.029 0.002 . 2 . . . . 34 G HA2 3 15446 1
361 . 1 1 34 34 GLY HA3 H 1 3.161 0.05 . 2 . . . . 34 G HA3 3 15446 1
362 . 1 1 34 34 GLY C C 13 170.363 0.010 . 1 . . . . 34 G C 2 15446 1
363 . 1 1 34 34 GLY CA C 13 45.303 0.083 . 1 . . . . 34 G CA 9 15446 1
364 . 1 1 34 34 GLY N N 15 107.781 0.034 . 1 . . . . 34 G N 24 15446 1
365 . 1 1 35 35 LEU H H 1 7.677 0.006 . 1 . . . . 35 L H 20 15446 1
366 . 1 1 35 35 LEU HA H 1 4.610 0.002 . 1 . . . . 35 L HA 3 15446 1
367 . 1 1 35 35 LEU HB2 H 1 1.235 0.006 . 2 . . . . 35 L HB2 7 15446 1
368 . 1 1 35 35 LEU HB3 H 1 1.585 0.004 . 2 . . . . 35 L HB3 5 15446 1
369 . 1 1 35 35 LEU HD11 H 1 0.710 0.006 . 2 . . . . 35 L QD1 16 15446 1
370 . 1 1 35 35 LEU HD12 H 1 0.710 0.006 . 2 . . . . 35 L QD1 16 15446 1
371 . 1 1 35 35 LEU HD13 H 1 0.710 0.006 . 2 . . . . 35 L QD1 16 15446 1
372 . 1 1 35 35 LEU HD21 H 1 0.702 0.006 . 2 . . . . 35 L QD2 16 15446 1
373 . 1 1 35 35 LEU HD22 H 1 0.702 0.006 . 2 . . . . 35 L QD2 16 15446 1
374 . 1 1 35 35 LEU HD23 H 1 0.702 0.006 . 2 . . . . 35 L QD2 16 15446 1
375 . 1 1 35 35 LEU HG H 1 1.573 0.002 . 1 . . . . 35 L HG 3 15446 1
376 . 1 1 35 35 LEU C C 13 175.497 0.4 . 1 . . . . 35 L C 2 15446 1
377 . 1 1 35 35 LEU CA C 13 53.580 0.043 . 1 . . . . 35 L CA 8 15446 1
378 . 1 1 35 35 LEU CB C 13 43.936 0.014 . 1 . . . . 35 L CB 8 15446 1
379 . 1 1 35 35 LEU CD1 C 13 24.867 0.022 . 2 . . . . 35 L CD1 8 15446 1
380 . 1 1 35 35 LEU CD2 C 13 24.097 0.031 . 2 . . . . 35 L CD2 12 15446 1
381 . 1 1 35 35 LEU CG C 13 26.735 0.4 . 1 . . . . 35 L CG 2 15446 1
382 . 1 1 35 35 LEU N N 15 119.232 0.050 . 1 . . . . 35 L N 16 15446 1
383 . 1 1 36 36 TYR H H 1 8.631 0.008 . 1 . . . . 36 Y H 29 15446 1
384 . 1 1 36 36 TYR HA H 1 5.005 0.003 . 1 . . . . 36 Y HA 4 15446 1
385 . 1 1 36 36 TYR HB2 H 1 2.514 0.007 . 2 . . . . 36 Y HB2 4 15446 1
386 . 1 1 36 36 TYR HB3 H 1 2.929 0.013 . 2 . . . . 36 Y HB3 4 15446 1
387 . 1 1 36 36 TYR HD1 H 1 6.826 0.002 . 3 . . . . 36 Y QD 3 15446 1
388 . 1 1 36 36 TYR HD2 H 1 6.826 0.002 . 3 . . . . 36 Y QD 3 15446 1
389 . 1 1 36 36 TYR HE1 H 1 6.551 0.002 . 3 . . . . 36 Y QE 7 15446 1
390 . 1 1 36 36 TYR HE2 H 1 6.551 0.002 . 3 . . . . 36 Y QE 7 15446 1
391 . 1 1 36 36 TYR C C 13 175.425 0.029 . 1 . . . . 36 Y C 2 15446 1
392 . 1 1 36 36 TYR CA C 13 57.308 0.046 . 1 . . . . 36 Y CA 7 15446 1
393 . 1 1 36 36 TYR CB C 13 41.572 0.017 . 1 . . . . 36 Y CB 9 15446 1
394 . 1 1 36 36 TYR CD1 C 13 132.894 0.4 . 3 . . . . 36 Y CD 1 15446 1
395 . 1 1 36 36 TYR CD2 C 13 132.894 0.4 . 3 . . . . 36 Y CD 1 15446 1
396 . 1 1 36 36 TYR CE1 C 13 116.738 0.021 . 3 . . . . 36 Y CE 6 15446 1
397 . 1 1 36 36 TYR CE2 C 13 116.738 0.021 . 3 . . . . 36 Y CE 6 15446 1
398 . 1 1 36 36 TYR N N 15 120.403 0.066 . 1 . . . . 36 Y N 27 15446 1
399 . 1 1 37 37 CYS H H 1 8.332 0.013 . 1 . . . . 37 C H 19 15446 1
400 . 1 1 37 37 CYS HA H 1 4.531 0.05 . 1 . . . . 37 C HA 3 15446 1
401 . 1 1 37 37 CYS C C 13 176.671 0.024 . 1 . . . . 37 C C 2 15446 1
402 . 1 1 37 37 CYS CA C 13 59.813 0.001 . 1 . . . . 37 C CA 3 15446 1
403 . 1 1 37 37 CYS N N 15 126.363 0.070 . 1 . . . . 37 C N 18 15446 1
404 . 1 1 38 38 VAL H H 1 8.271 0.019 . 1 . . . . 38 V H 5 15446 1
405 . 1 1 38 38 VAL HA H 1 4.180 0.001 . 1 . . . . 38 V HA 3 15446 1
406 . 1 1 38 38 VAL HB H 1 2.293 0.013 . 1 . . . . 38 V HB 3 15446 1
407 . 1 1 38 38 VAL HG11 H 1 1.033 0.005 . 2 . . . . 38 V QG1 3 15446 1
408 . 1 1 38 38 VAL HG12 H 1 1.033 0.005 . 2 . . . . 38 V QG1 3 15446 1
409 . 1 1 38 38 VAL HG13 H 1 1.033 0.005 . 2 . . . . 38 V QG1 3 15446 1
410 . 1 1 38 38 VAL CA C 13 63.419 0.108 . 1 . . . . 38 V CA 6 15446 1
411 . 1 1 38 38 VAL CB C 13 31.777 0.098 . 1 . . . . 38 V CB 4 15446 1
412 . 1 1 38 38 VAL CG1 C 13 21.534 0.4 . 2 . . . . 38 V CG1 2 15446 1
413 . 1 1 38 38 VAL CG2 C 13 19.781 0.4 . 2 . . . . 38 V CG2 1 15446 1
414 . 1 1 38 38 VAL N N 15 122.512 0.108 . 1 . . . . 38 V N 5 15446 1
415 . 1 1 39 39 HIS H H 1 10.142 0.018 . 1 . . . . 39 H H 22 15446 1
416 . 1 1 39 39 HIS HA H 1 4.750 0.05 . 1 . . . . 39 H HA 2 15446 1
417 . 1 1 39 39 HIS HB2 H 1 3.060 0.004 . 2 . . . . 39 H HB2 3 15446 1
418 . 1 1 39 39 HIS HB3 H 1 3.359 0.006 . 2 . . . . 39 H HB3 3 15446 1
419 . 1 1 39 39 HIS HD2 H 1 7.425 0.004 . 1 . . . . 39 H HD2 2 15446 1
420 . 1 1 39 39 HIS CA C 13 57.575 0.022 . 1 . . . . 39 H CA 7 15446 1
421 . 1 1 39 39 HIS CB C 13 31.258 0.028 . 1 . . . . 39 H CB 7 15446 1
422 . 1 1 39 39 HIS CD2 C 13 120.203 0.4 . 1 . . . . 39 H CD2 1 15446 1
423 . 1 1 39 39 HIS N N 15 124.290 0.052 . 1 . . . . 39 H N 20 15446 1
424 . 1 1 40 40 CYS H H 1 9.680 0.011 . 1 . . . . 40 C H 20 15446 1
425 . 1 1 40 40 CYS HA H 1 4.479 0.05 . 1 . . . . 40 C HA 2 15446 1
426 . 1 1 40 40 CYS HB3 H 1 2.970 0.05 . 2 . . . . 40 C HB3 2 15446 1
427 . 1 1 40 40 CYS CA C 13 58.315 0.030 . 1 . . . . 40 C CA 7 15446 1
428 . 1 1 40 40 CYS CB C 13 32.214 0.045 . 1 . . . . 40 C CB 5 15446 1
429 . 1 1 40 40 CYS N N 15 126.073 0.115 . 1 . . . . 40 C N 18 15446 1
430 . 1 1 41 41 GLU H H 1 7.722 0.010 . 1 . . . . 41 E H 15 15446 1
431 . 1 1 41 41 GLU CA C 13 61.799 0.028 . 1 . . . . 41 E CA 2 15446 1
432 . 1 1 41 41 GLU CB C 13 28.687 0.4 . 1 . . . . 41 E CB 1 15446 1
433 . 1 1 41 41 GLU N N 15 115.339 0.204 . 1 . . . . 41 E N 14 15446 1
434 . 1 1 42 42 GLU HA H 1 4.369 0.001 . 1 . . . . 42 E HA 3 15446 1
435 . 1 1 42 42 GLU HB3 H 1 1.987 0.013 . 2 . . . . 42 E HB3 5 15446 1
436 . 1 1 42 42 GLU HG3 H 1 2.611 0.05 . 2 . . . . 42 E HG3 2 15446 1
437 . 1 1 42 42 GLU CA C 13 58.003 0.012 . 1 . . . . 42 E CA 6 15446 1
438 . 1 1 42 42 GLU CB C 13 29.740 0.038 . 1 . . . . 42 E CB 5 15446 1
439 . 1 1 42 42 GLU CG C 13 34.516 0.4 . 1 . . . . 42 E CG 2 15446 1
440 . 1 1 43 43 SER H H 1 7.829 0.014 . 1 . . . . 43 S H 18 15446 1
441 . 1 1 43 43 SER HA H 1 5.306 0.05 . 1 . . . . 43 S HA 2 15446 1
442 . 1 1 43 43 SER HB2 H 1 3.288 0.002 . 2 . . . . 43 S HB2 3 15446 1
443 . 1 1 43 43 SER HB3 H 1 3.619 0.004 . 2 . . . . 43 S HB3 3 15446 1
444 . 1 1 43 43 SER C C 13 173.594 0.061 . 1 . . . . 43 S C 2 15446 1
445 . 1 1 43 43 SER CA C 13 55.558 0.023 . 1 . . . . 43 S CA 7 15446 1
446 . 1 1 43 43 SER CB C 13 67.442 0.082 . 1 . . . . 43 S CB 6 15446 1
447 . 1 1 43 43 SER N N 15 117.798 0.135 . 1 . . . . 43 S N 18 15446 1
448 . 1 1 44 44 ILE H H 1 8.673 0.005 . 1 . . . . 44 I H 22 15446 1
449 . 1 1 44 44 ILE HA H 1 4.131 0.05 . 1 . . . . 44 I HA 4 15446 1
450 . 1 1 44 44 ILE HB H 1 1.425 0.004 . 1 . . . . 44 I HB 7 15446 1
451 . 1 1 44 44 ILE HD11 H 1 0.755 0.012 . 2 . . . . 44 I QD1 15 15446 1
452 . 1 1 44 44 ILE HD12 H 1 0.755 0.012 . 2 . . . . 44 I QD1 15 15446 1
453 . 1 1 44 44 ILE HD13 H 1 0.755 0.012 . 2 . . . . 44 I QD1 15 15446 1
454 . 1 1 44 44 ILE HG12 H 1 1.331 0.007 . 2 . . . . 44 I HG12 6 15446 1
455 . 1 1 44 44 ILE HG13 H 1 0.968 0.002 . 2 . . . . 44 I HG13 6 15446 1
456 . 1 1 44 44 ILE HG21 H 1 0.721 0.007 . 2 . . . . 44 I QG2 26 15446 1
457 . 1 1 44 44 ILE HG22 H 1 0.721 0.007 . 2 . . . . 44 I QG2 26 15446 1
458 . 1 1 44 44 ILE HG23 H 1 0.721 0.007 . 2 . . . . 44 I QG2 26 15446 1
459 . 1 1 44 44 ILE C C 13 175.036 0.052 . 1 . . . . 44 I C 3 15446 1
460 . 1 1 44 44 ILE CA C 13 61.011 0.016 . 1 . . . . 44 I CA 8 15446 1
461 . 1 1 44 44 ILE CB C 13 41.703 0.018 . 1 . . . . 44 I CB 7 15446 1
462 . 1 1 44 44 ILE CD1 C 13 13.682 0.096 . 1 . . . . 44 I CD1 9 15446 1
463 . 1 1 44 44 ILE CG1 C 13 27.621 0.043 . 1 . . . . 44 I CG1 7 15446 1
464 . 1 1 44 44 ILE CG2 C 13 16.822 0.045 . 1 . . . . 44 I CG2 16 15446 1
465 . 1 1 44 44 ILE N N 15 122.092 0.040 . 1 . . . . 44 I N 20 15446 1
466 . 1 1 45 45 MET H H 1 8.556 0.005 . 1 . . . . 45 M H 28 15446 1
467 . 1 1 45 45 MET HA H 1 4.928 0.004 . 1 . . . . 45 M HA 4 15446 1
468 . 1 1 45 45 MET HB2 H 1 1.772 0.05 . 2 . . . . 45 M HB2 2 15446 1
469 . 1 1 45 45 MET HB3 H 1 2.029 0.05 . 2 . . . . 45 M HB3 2 15446 1
470 . 1 1 45 45 MET HG2 H 1 2.138 0.004 . 2 . . . . 45 M HG2 4 15446 1
471 . 1 1 45 45 MET HG3 H 1 2.507 0.006 . 2 . . . . 45 M HG3 4 15446 1
472 . 1 1 45 45 MET C C 13 175.933 0.004 . 1 . . . . 45 M C 3 15446 1
473 . 1 1 45 45 MET CA C 13 54.342 0.041 . 1 . . . . 45 M CA 8 15446 1
474 . 1 1 45 45 MET CB C 13 36.801 0.051 . 1 . . . . 45 M CB 6 15446 1
475 . 1 1 45 45 MET CG C 13 32.947 0.064 . 1 . . . . 45 M CG 5 15446 1
476 . 1 1 45 45 MET N N 15 127.264 0.042 . 1 . . . . 45 M N 27 15446 1
477 . 1 1 46 46 ASN H H 1 9.227 0.011 . 1 . . . . 46 N H 22 15446 1
478 . 1 1 46 46 ASN HA H 1 4.639 0.009 . 1 . . . . 46 N HA 5 15446 1
479 . 1 1 46 46 ASN HB2 H 1 2.835 0.003 . 2 . . . . 46 N HB2 4 15446 1
480 . 1 1 46 46 ASN HB3 H 1 3.363 0.004 . 2 . . . . 46 N HB3 6 15446 1
481 . 1 1 46 46 ASN C C 13 175.661 0.043 . 1 . . . . 46 N C 3 15446 1
482 . 1 1 46 46 ASN CA C 13 51.299 0.072 . 1 . . . . 46 N CA 8 15446 1
483 . 1 1 46 46 ASN CB C 13 37.671 0.017 . 1 . . . . 46 N CB 6 15446 1
484 . 1 1 46 46 ASN N N 15 122.664 0.029 . 1 . . . . 46 N N 22 15446 1
485 . 1 1 47 47 LYS H H 1 8.281 0.003 . 1 . . . . 47 K H 28 15446 1
486 . 1 1 47 47 LYS HA H 1 3.982 0.010 . 1 . . . . 47 K HA 6 15446 1
487 . 1 1 47 47 LYS HB2 H 1 1.783 0.05 . 2 . . . . 47 K HB2 2 15446 1
488 . 1 1 47 47 LYS HB3 H 1 1.901 0.004 . 2 . . . . 47 K HB3 3 15446 1
489 . 1 1 47 47 LYS HD3 H 1 1.737 0.05 . 2 . . . . 47 K HD3 2 15446 1
490 . 1 1 47 47 LYS HE3 H 1 3.002 0.05 . 2 . . . . 47 K HE3 2 15446 1
491 . 1 1 47 47 LYS HG3 H 1 1.401 0.05 . 2 . . . . 47 K HG3 2 15446 1
492 . 1 1 47 47 LYS C C 13 177.842 0.018 . 1 . . . . 47 K C 3 15446 1
493 . 1 1 47 47 LYS CA C 13 60.556 0.028 . 1 . . . . 47 K CA 7 15446 1
494 . 1 1 47 47 LYS CB C 13 32.396 0.030 . 1 . . . . 47 K CB 6 15446 1
495 . 1 1 47 47 LYS CD C 13 28.706 0.4 . 1 . . . . 47 K CD 2 15446 1
496 . 1 1 47 47 LYS CE C 13 42.474 0.4 . 1 . . . . 47 K CE 2 15446 1
497 . 1 1 47 47 LYS CG C 13 24.737 0.4 . 1 . . . . 47 K CG 2 15446 1
498 . 1 1 47 47 LYS N N 15 119.675 0.039 . 1 . . . . 47 K N 27 15446 1
499 . 1 1 48 48 GLU H H 1 8.148 0.004 . 1 . . . . 48 E H 32 15446 1
500 . 1 1 48 48 GLU HA H 1 4.087 0.004 . 1 . . . . 48 E HA 6 15446 1
501 . 1 1 48 48 GLU HB2 H 1 2.012 0.05 . 2 . . . . 48 E HB2 2 15446 1
502 . 1 1 48 48 GLU HB3 H 1 2.111 0.05 . 2 . . . . 48 E HB3 2 15446 1
503 . 1 1 48 48 GLU HG2 H 1 2.327 0.05 . 2 . . . . 48 E HG2 2 15446 1
504 . 1 1 48 48 GLU HG3 H 1 2.287 0.05 . 2 . . . . 48 E HG3 2 15446 1
505 . 1 1 48 48 GLU C C 13 180.466 0.010 . 1 . . . . 48 E C 2 15446 1
506 . 1 1 48 48 GLU CA C 13 60.186 0.031 . 1 . . . . 48 E CA 8 15446 1
507 . 1 1 48 48 GLU CB C 13 28.947 0.034 . 1 . . . . 48 E CB 6 15446 1
508 . 1 1 48 48 GLU CG C 13 36.846 0.4 . 1 . . . . 48 E CG 3 15446 1
509 . 1 1 48 48 GLU N N 15 119.340 0.063 . 1 . . . . 48 E N 30 15446 1
510 . 1 1 49 49 GLU H H 1 8.746 0.005 . 1 . . . . 49 E H 26 15446 1
511 . 1 1 49 49 GLU HA H 1 4.104 0.008 . 1 . . . . 49 E HA 6 15446 1
512 . 1 1 49 49 GLU HB2 H 1 2.057 0.05 . 2 . . . . 49 E HB2 2 15446 1
513 . 1 1 49 49 GLU HB3 H 1 2.195 0.05 . 2 . . . . 49 E HB3 2 15446 1
514 . 1 1 49 49 GLU HG3 H 1 2.523 0.05 . 2 . . . . 49 E HG3 2 15446 1
515 . 1 1 49 49 GLU C C 13 180.121 0.011 . 1 . . . . 49 E C 3 15446 1
516 . 1 1 49 49 GLU CA C 13 58.489 0.027 . 1 . . . . 49 E CA 8 15446 1
517 . 1 1 49 49 GLU CB C 13 29.751 0.032 . 1 . . . . 49 E CB 5 15446 1
518 . 1 1 49 49 GLU CG C 13 36.981 0.4 . 1 . . . . 49 E CG 2 15446 1
519 . 1 1 49 49 GLU N N 15 121.520 0.060 . 1 . . . . 49 E N 24 15446 1
520 . 1 1 50 50 SER H H 1 9.096 0.005 . 1 . . . . 50 S H 29 15446 1
521 . 1 1 50 50 SER HA H 1 4.325 0.006 . 1 . . . . 50 S HA 7 15446 1
522 . 1 1 50 50 SER HB3 H 1 3.990 0.004 . 2 . . . . 50 S HB3 5 15446 1
523 . 1 1 50 50 SER C C 13 176.924 0.003 . 1 . . . . 50 S C 2 15446 1
524 . 1 1 50 50 SER CA C 13 61.962 0.058 . 1 . . . . 50 S CA 7 15446 1
525 . 1 1 50 50 SER CB C 13 62.532 0.065 . 1 . . . . 50 S CB 3 15446 1
526 . 1 1 50 50 SER N N 15 117.754 0.070 . 1 . . . . 50 S N 27 15446 1
527 . 1 1 51 51 ASP H H 1 8.616 0.006 . 1 . . . . 51 D H 25 15446 1
528 . 1 1 51 51 ASP HA H 1 4.441 0.004 . 1 . . . . 51 D HA 6 15446 1
529 . 1 1 51 51 ASP HB2 H 1 2.637 0.05 . 2 . . . . 51 D HB2 2 15446 1
530 . 1 1 51 51 ASP HB3 H 1 2.872 0.05 . 2 . . . . 51 D HB3 2 15446 1
531 . 1 1 51 51 ASP C C 13 179.174 0.041 . 1 . . . . 51 D C 3 15446 1
532 . 1 1 51 51 ASP CA C 13 57.586 0.016 . 1 . . . . 51 D CA 7 15446 1
533 . 1 1 51 51 ASP CB C 13 39.872 0.026 . 1 . . . . 51 D CB 6 15446 1
534 . 1 1 51 51 ASP N N 15 122.859 0.053 . 1 . . . . 51 D N 22 15446 1
535 . 1 1 52 52 ALA H H 1 7.850 0.007 . 1 . . . . 52 A H 29 15446 1
536 . 1 1 52 52 ALA HA H 1 4.261 0.013 . 1 . . . . 52 A HA 5 15446 1
537 . 1 1 52 52 ALA HB1 H 1 1.616 0.008 . 2 . . . . 52 A QB 11 15446 1
538 . 1 1 52 52 ALA HB2 H 1 1.616 0.008 . 2 . . . . 52 A QB 11 15446 1
539 . 1 1 52 52 ALA HB3 H 1 1.616 0.008 . 2 . . . . 52 A QB 11 15446 1
540 . 1 1 52 52 ALA C C 13 180.558 0.032 . 1 . . . . 52 A C 3 15446 1
541 . 1 1 52 52 ALA CA C 13 55.289 0.076 . 1 . . . . 52 A CA 8 15446 1
542 . 1 1 52 52 ALA CB C 13 18.173 0.056 . 1 . . . . 52 A CB 9 15446 1
543 . 1 1 52 52 ALA N N 15 123.612 0.063 . 1 . . . . 52 A N 25 15446 1
544 . 1 1 53 53 PHE H H 1 8.178 0.004 . 1 . . . . 53 F H 27 15446 1
545 . 1 1 53 53 PHE HA H 1 4.203 0.005 . 1 . . . . 53 F HA 7 15446 1
546 . 1 1 53 53 PHE HB2 H 1 3.307 0.008 . 2 . . . . 53 F HB2 6 15446 1
547 . 1 1 53 53 PHE HB3 H 1 3.371 0.007 . 2 . . . . 53 F HB3 6 15446 1
548 . 1 1 53 53 PHE HD1 H 1 7.119 0.001 . 3 . . . . 53 F QD 3 15446 1
549 . 1 1 53 53 PHE HD2 H 1 7.119 0.001 . 3 . . . . 53 F QD 3 15446 1
550 . 1 1 53 53 PHE HE1 H 1 7.168 0.001 . 3 . . . . 53 F QE 3 15446 1
551 . 1 1 53 53 PHE HE2 H 1 7.168 0.001 . 3 . . . . 53 F QE 3 15446 1
552 . 1 1 53 53 PHE C C 13 177.106 0.007 . 1 . . . . 53 F C 3 15446 1
553 . 1 1 53 53 PHE CA C 13 61.026 0.078 . 1 . . . . 53 F CA 8 15446 1
554 . 1 1 53 53 PHE CB C 13 39.693 0.051 . 1 . . . . 53 F CB 8 15446 1
555 . 1 1 53 53 PHE CD1 C 13 130.893 0.4 . 3 . . . . 53 F CD 1 15446 1
556 . 1 1 53 53 PHE CD2 C 13 130.893 0.4 . 3 . . . . 53 F CD 1 15446 1
557 . 1 1 53 53 PHE CE1 C 13 130.815 0.045 . 3 . . . . 53 F CE 3 15446 1
558 . 1 1 53 53 PHE CE2 C 13 130.815 0.045 . 3 . . . . 53 F CE 3 15446 1
559 . 1 1 53 53 PHE N N 15 120.681 0.053 . 1 . . . . 53 F N 26 15446 1
560 . 1 1 54 54 MET H H 1 8.932 0.005 . 1 . . . . 54 M H 28 15446 1
561 . 1 1 54 54 MET HA H 1 4.107 0.003 . 1 . . . . 54 M HA 8 15446 1
562 . 1 1 54 54 MET HB2 H 1 1.997 0.05 . 2 . . . . 54 M HB2 2 15446 1
563 . 1 1 54 54 MET HB3 H 1 2.317 0.05 . 2 . . . . 54 M HB3 2 15446 1
564 . 1 1 54 54 MET HG3 H 1 2.771 0.003 . 2 . . . . 54 M HG3 5 15446 1
565 . 1 1 54 54 MET C C 13 178.651 0.006 . 1 . . . . 54 M C 3 15446 1
566 . 1 1 54 54 MET CA C 13 56.423 0.037 . 1 . . . . 54 M CA 8 15446 1
567 . 1 1 54 54 MET CB C 13 30.744 0.036 . 1 . . . . 54 M CB 5 15446 1
568 . 1 1 54 54 MET CG C 13 32.508 0.033 . 1 . . . . 54 M CG 4 15446 1
569 . 1 1 54 54 MET N N 15 117.159 0.049 . 1 . . . . 54 M N 27 15446 1
570 . 1 1 55 55 ALA H H 1 8.189 0.005 . 1 . . . . 55 A H 26 15446 1
571 . 1 1 55 55 ALA HA H 1 4.067 0.006 . 1 . . . . 55 A HA 4 15446 1
572 . 1 1 55 55 ALA HB1 H 1 1.514 0.004 . 2 . . . . 55 A QB 5 15446 1
573 . 1 1 55 55 ALA HB2 H 1 1.514 0.004 . 2 . . . . 55 A QB 5 15446 1
574 . 1 1 55 55 ALA HB3 H 1 1.514 0.004 . 2 . . . . 55 A QB 5 15446 1
575 . 1 1 55 55 ALA C C 13 181.266 0.017 . 1 . . . . 55 A C 3 15446 1
576 . 1 1 55 55 ALA CA C 13 55.407 0.062 . 1 . . . . 55 A CA 8 15446 1
577 . 1 1 55 55 ALA CB C 13 17.799 0.051 . 1 . . . . 55 A CB 6 15446 1
578 . 1 1 55 55 ALA N N 15 122.162 0.086 . 1 . . . . 55 A N 24 15446 1
579 . 1 1 56 56 GLN H H 1 7.278 0.004 . 1 . . . . 56 Q H 26 15446 1
580 . 1 1 56 56 GLN HA H 1 4.092 0.001 . 1 . . . . 56 Q HA 4 15446 1
581 . 1 1 56 56 GLN HB2 H 1 2.002 0.05 . 2 . . . . 56 Q HB2 2 15446 1
582 . 1 1 56 56 GLN HB3 H 1 2.183 0.05 . 2 . . . . 56 Q HB3 2 15446 1
583 . 1 1 56 56 GLN HE21 H 1 7.256 0.05 . 2 . . . . 56 Q HE21 1 15446 1
584 . 1 1 56 56 GLN HE22 H 1 7.176 0.05 . 2 . . . . 56 Q HE22 1 15446 1
585 . 1 1 56 56 GLN HG2 H 1 2.293 0.05 . 2 . . . . 56 Q HG2 2 15446 1
586 . 1 1 56 56 GLN HG3 H 1 2.598 0.05 . 2 . . . . 56 Q HG3 3 15446 1
587 . 1 1 56 56 GLN C C 13 179.103 0.008 . 1 . . . . 56 Q C 3 15446 1
588 . 1 1 56 56 GLN CA C 13 59.428 0.014 . 1 . . . . 56 Q CA 8 15446 1
589 . 1 1 56 56 GLN CB C 13 29.383 0.025 . 1 . . . . 56 Q CB 6 15446 1
590 . 1 1 56 56 GLN CG C 13 35.015 0.4 . 1 . . . . 56 Q CG 3 15446 1
591 . 1 1 56 56 GLN N N 15 117.540 0.073 . 1 . . . . 56 Q N 24 15446 1
592 . 1 1 56 56 GLN NE2 N 15 112.254 0.017 . 1 . . . . 56 Q NE2 3 15446 1
593 . 1 1 57 57 VAL H H 1 7.821 0.004 . 1 . . . . 57 V H 30 15446 1
594 . 1 1 57 57 VAL HA H 1 2.952 0.006 . 1 . . . . 57 V HA 11 15446 1
595 . 1 1 57 57 VAL HB H 1 1.766 0.006 . 1 . . . . 57 V HB 5 15446 1
596 . 1 1 57 57 VAL HG11 H 1 0.426 0.004 . 2 . . . . 57 V QG1 9 15446 1
597 . 1 1 57 57 VAL HG12 H 1 0.426 0.004 . 2 . . . . 57 V QG1 9 15446 1
598 . 1 1 57 57 VAL HG13 H 1 0.426 0.004 . 2 . . . . 57 V QG1 9 15446 1
599 . 1 1 57 57 VAL HG21 H 1 -0.172 0.03 . 2 . . . . 57 V QG2 16 15446 1
600 . 1 1 57 57 VAL HG22 H 1 -0.172 0.03 . 2 . . . . 57 V QG2 16 15446 1
601 . 1 1 57 57 VAL HG23 H 1 -0.172 0.03 . 2 . . . . 57 V QG2 16 15446 1
602 . 1 1 57 57 VAL C C 13 177.876 0.028 . 1 . . . . 57 V C 3 15446 1
603 . 1 1 57 57 VAL CA C 13 66.980 0.095 . 1 . . . . 57 V CA 10 15446 1
604 . 1 1 57 57 VAL CB C 13 31.674 0.043 . 1 . . . . 57 V CB 6 15446 1
605 . 1 1 57 57 VAL CG1 C 13 20.892 0.036 . 2 . . . . 57 V CG1 5 15446 1
606 . 1 1 57 57 VAL CG2 C 13 22.529 0.008 . 2 . . . . 57 V CG2 9 15446 1
607 . 1 1 57 57 VAL N N 15 122.665 0.039 . 1 . . . . 57 V N 28 15446 1
608 . 1 1 58 58 LYS H H 1 8.691 0.005 . 1 . . . . 58 K H 30 15446 1
609 . 1 1 58 58 LYS HA H 1 3.613 0.005 . 1 . . . . 58 K HA 9 15446 1
610 . 1 1 58 58 LYS HB3 H 1 1.781 0.009 . 2 . . . . 58 K HB3 4 15446 1
611 . 1 1 58 58 LYS HD3 H 1 1.565 0.05 . 2 . . . . 58 K HD3 2 15446 1
612 . 1 1 58 58 LYS HE3 H 1 2.847 0.05 . 2 . . . . 58 K HE3 2 15446 1
613 . 1 1 58 58 LYS HG3 H 1 1.288 0.05 . 2 . . . . 58 K HG3 2 15446 1
614 . 1 1 58 58 LYS C C 13 179.408 0.005 . 1 . . . . 58 K C 3 15446 1
615 . 1 1 58 58 LYS CA C 13 60.289 0.023 . 1 . . . . 58 K CA 8 15446 1
616 . 1 1 58 58 LYS CB C 13 32.273 0.063 . 1 . . . . 58 K CB 5 15446 1
617 . 1 1 58 58 LYS CD C 13 29.480 0.4 . 1 . . . . 58 K CD 2 15446 1
618 . 1 1 58 58 LYS CE C 13 41.877 0.4 . 1 . . . . 58 K CE 2 15446 1
619 . 1 1 58 58 LYS CG C 13 26.064 0.4 . 1 . . . . 58 K CG 2 15446 1
620 . 1 1 58 58 LYS N N 15 118.796 0.050 . 1 . . . . 58 K N 28 15446 1
621 . 1 1 59 59 ALA H H 1 7.521 0.005 . 1 . . . . 59 A H 32 15446 1
622 . 1 1 59 59 ALA HA H 1 4.147 0.002 . 1 . . . . 59 A HA 6 15446 1
623 . 1 1 59 59 ALA HB1 H 1 1.489 0.005 . . . . . . 59 A QB 6 15446 1
624 . 1 1 59 59 ALA HB2 H 1 1.489 0.005 . . . . . . 59 A QB 6 15446 1
625 . 1 1 59 59 ALA HB3 H 1 1.489 0.005 . . . . . . 59 A QB 6 15446 1
626 . 1 1 59 59 ALA C C 13 180.176 0.010 . 1 . . . . 59 A C 3 15446 1
627 . 1 1 59 59 ALA CA C 13 54.851 0.063 . 1 . . . . 59 A CA 8 15446 1
628 . 1 1 59 59 ALA CB C 13 17.871 0.282 . 1 . . . . 59 A CB 6 15446 1
629 . 1 1 59 59 ALA N N 15 121.313 0.051 . 1 . . . . 59 A N 30 15446 1
630 . 1 1 60 60 PHE H H 1 7.787 0.006 . 1 . . . . 60 F H 29 15446 1
631 . 1 1 60 60 PHE HA H 1 4.526 0.003 . 1 . . . . 60 F HA 5 15446 1
632 . 1 1 60 60 PHE HB2 H 1 2.888 0.001 . 2 . . . . 60 F HB2 5 15446 1
633 . 1 1 60 60 PHE HB3 H 1 3.301 0.006 . 2 . . . . 60 F HB3 4 15446 1
634 . 1 1 60 60 PHE HD1 H 1 7.099 0.005 . 3 . . . . 60 F QD 2 15446 1
635 . 1 1 60 60 PHE HD2 H 1 7.099 0.005 . 3 . . . . 60 F QD 2 15446 1
636 . 1 1 60 60 PHE C C 13 178.090 0.021 . 1 . . . . 60 F C 2 15446 1
637 . 1 1 60 60 PHE CA C 13 60.713 0.084 . 1 . . . . 60 F CA 8 15446 1
638 . 1 1 60 60 PHE CB C 13 38.704 0.081 . 1 . . . . 60 F CB 7 15446 1
639 . 1 1 60 60 PHE CD1 C 13 131.313 0.4 . 3 . . . . 60 F CD 1 15446 1
640 . 1 1 60 60 PHE CD2 C 13 131.313 0.4 . 3 . . . . 60 F CD 1 15446 1
641 . 1 1 60 60 PHE N N 15 120.083 0.047 . 1 . . . . 60 F N 28 15446 1
642 . 1 1 61 61 ARG H H 1 8.577 0.004 . 1 . . . . 61 R H 27 15446 1
643 . 1 1 61 61 ARG HA H 1 3.320 0.002 . 1 . . . . 61 R HA 8 15446 1
644 . 1 1 61 61 ARG HB2 H 1 1.236 0.05 . 2 . . . . 61 R HB2 3 15446 1
645 . 1 1 61 61 ARG HB3 H 1 1.475 0.05 . 2 . . . . 61 R HB3 2 15446 1
646 . 1 1 61 61 ARG HE H 1 6.486 0.05 . 1 . . . . 61 R HE 1 15446 1
647 . 1 1 61 61 ARG C C 13 177.989 0.047 . 1 . . . . 61 R C 3 15446 1
648 . 1 1 61 61 ARG CA C 13 59.756 0.114 . 1 . . . . 61 R CA 8 15446 1
649 . 1 1 61 61 ARG CB C 13 30.527 0.067 . 1 . . . . 61 R CB 6 15446 1
650 . 1 1 61 61 ARG CD C 13 44.077 0.4 . 1 . . . . 61 R CD 1 15446 1
651 . 1 1 61 61 ARG CG C 13 26.861 0.4 . 1 . . . . 61 R CG 1 15446 1
652 . 1 1 61 61 ARG N N 15 118.460 0.045 . 1 . . . . 61 R N 25 15446 1
653 . 1 1 61 61 ARG NE N 15 83.422 0.4 . 1 . . . . 61 R NE 1 15446 1
654 . 1 1 62 62 ALA H H 1 7.808 0.005 . 1 . . . . 62 A H 30 15446 1
655 . 1 1 62 62 ALA HA H 1 4.070 0.007 . 1 . . . . 62 A HA 8 15446 1
656 . 1 1 62 62 ALA HB1 H 1 1.427 0.012 . 2 . . . . 62 A QB 5 15446 1
657 . 1 1 62 62 ALA HB2 H 1 1.427 0.012 . 2 . . . . 62 A QB 5 15446 1
658 . 1 1 62 62 ALA HB3 H 1 1.427 0.012 . 2 . . . . 62 A QB 5 15446 1
659 . 1 1 62 62 ALA C C 13 180.191 0.004 . 1 . . . . 62 A C 2 15446 1
660 . 1 1 62 62 ALA CA C 13 54.796 0.065 . 1 . . . . 62 A CA 8 15446 1
661 . 1 1 62 62 ALA CB C 13 17.870 0.052 . 1 . . . . 62 A CB 5 15446 1
662 . 1 1 62 62 ALA N N 15 118.781 0.062 . 1 . . . . 62 A N 28 15446 1
663 . 1 1 63 63 SER H H 1 7.630 0.007 . 1 . . . . 63 S H 27 15446 1
664 . 1 1 63 63 SER HA H 1 4.212 0.003 . 1 . . . . 63 S HA 6 15446 1
665 . 1 1 63 63 SER HB3 H 1 3.990 0.004 . 2 . . . . 63 S HB3 6 15446 1
666 . 1 1 63 63 SER C C 13 176.302 0.055 . 1 . . . . 63 S C 2 15446 1
667 . 1 1 63 63 SER CA C 13 61.091 0.030 . 1 . . . . 63 S CA 7 15446 1
668 . 1 1 63 63 SER CB C 13 62.954 0.061 . 1 . . . . 63 S CB 4 15446 1
669 . 1 1 63 63 SER N N 15 115.101 0.053 . 1 . . . . 63 S N 26 15446 1
670 . 1 1 64 64 VAL H H 1 7.706 0.004 . 1 . . . . 64 V H 24 15446 1
671 . 1 1 64 64 VAL HA H 1 3.622 0.003 . 1 . . . . 64 V HA 8 15446 1
672 . 1 1 64 64 VAL HB H 1 1.951 0.009 . 1 . . . . 64 V HB 4 15446 1
673 . 1 1 64 64 VAL HG11 H 1 0.425 0.05 . 2 . . . . 64 V QG1 2 15446 1
674 . 1 1 64 64 VAL HG12 H 1 0.425 0.05 . 2 . . . . 64 V QG1 2 15446 1
675 . 1 1 64 64 VAL HG13 H 1 0.425 0.05 . 2 . . . . 64 V QG1 2 15446 1
676 . 1 1 64 64 VAL HG21 H 1 0.748 0.05 . 2 . . . . 64 V QG2 2 15446 1
677 . 1 1 64 64 VAL HG22 H 1 0.748 0.05 . 2 . . . . 64 V QG2 2 15446 1
678 . 1 1 64 64 VAL HG23 H 1 0.748 0.05 . 2 . . . . 64 V QG2 2 15446 1
679 . 1 1 64 64 VAL C C 13 178.423 0.065 . 1 . . . . 64 V C 2 15446 1
680 . 1 1 64 64 VAL CA C 13 65.374 0.080 . 1 . . . . 64 V CA 8 15446 1
681 . 1 1 64 64 VAL CB C 13 31.981 0.134 . 1 . . . . 64 V CB 5 15446 1
682 . 1 1 64 64 VAL CG1 C 13 21.464 0.4 . 2 . . . . 64 V CG1 2 15446 1
683 . 1 1 64 64 VAL CG2 C 13 22.536 0.4 . 2 . . . . 64 V CG2 2 15446 1
684 . 1 1 64 64 VAL N N 15 122.326 0.072 . 1 . . . . 64 V N 23 15446 1
685 . 1 1 65 65 ASN H H 1 8.361 0.009 . 1 . . . . 65 N H 33 15446 1
686 . 1 1 65 65 ASN HA H 1 4.454 0.006 . 1 . . . . 65 N HA 8 15446 1
687 . 1 1 65 65 ASN HB3 H 1 2.788 0.005 . 2 . . . . 65 N HB3 7 15446 1
688 . 1 1 65 65 ASN HD21 H 1 7.379 0.05 . 2 . . . . 65 N HD21 1 15446 1
689 . 1 1 65 65 ASN HD22 H 1 6.658 0.05 . 2 . . . . 65 N HD22 1 15446 1
690 . 1 1 65 65 ASN C C 13 176.101 0.011 . 1 . . . . 65 N C 3 15446 1
691 . 1 1 65 65 ASN CA C 13 54.813 0.129 . 1 . . . . 65 N CA 8 15446 1
692 . 1 1 65 65 ASN CB C 13 38.383 0.021 . 1 . . . . 65 N CB 5 15446 1
693 . 1 1 65 65 ASN N N 15 119.088 0.063 . 1 . . . . 65 N N 31 15446 1
694 . 1 1 65 65 ASN ND2 N 15 110.893 0.001 . 1 . . . . 65 N ND2 2 15446 1
695 . 1 1 66 66 ALA H H 1 7.622 0.004 . 1 . . . . 66 A H 26 15446 1
696 . 1 1 66 66 ALA HA H 1 4.202 0.011 . 1 . . . . 66 A HA 5 15446 1
697 . 1 1 66 66 ALA HB1 H 1 1.409 0.004 . 2 . . . . 66 A QB 3 15446 1
698 . 1 1 66 66 ALA HB2 H 1 1.409 0.004 . 2 . . . . 66 A QB 3 15446 1
699 . 1 1 66 66 ALA HB3 H 1 1.409 0.004 . 2 . . . . 66 A QB 3 15446 1
700 . 1 1 66 66 ALA C C 13 177.779 0.052 . 1 . . . . 66 A C 2 15446 1
701 . 1 1 66 66 ALA CA C 13 53.194 0.057 . 1 . . . . 66 A CA 8 15446 1
702 . 1 1 66 66 ALA CB C 13 18.773 0.026 . 1 . . . . 66 A CB 5 15446 1
703 . 1 1 66 66 ALA N N 15 120.981 0.028 . 1 . . . . 66 A N 25 15446 1
704 . 1 1 67 67 GLU H H 1 7.626 0.005 . 1 . . . . 67 E H 23 15446 1
705 . 1 1 67 67 GLU HA H 1 4.215 0.008 . 1 . . . . 67 E HA 5 15446 1
706 . 1 1 67 67 GLU HB2 H 1 1.977 0.002 . 2 . . . . 67 E HB2 3 15446 1
707 . 1 1 67 67 GLU HB3 H 1 2.059 0.002 . 2 . . . . 67 E HB3 3 15446 1
708 . 1 1 67 67 GLU HG2 H 1 2.365 0.05 . 2 . . . . 67 E HG2 2 15446 1
709 . 1 1 67 67 GLU HG3 H 1 2.205 0.05 . 2 . . . . 67 E HG3 2 15446 1
710 . 1 1 67 67 GLU C C 13 176.320 0.008 . 1 . . . . 67 E C 2 15446 1
711 . 1 1 67 67 GLU CA C 13 56.845 0.019 . 1 . . . . 67 E CA 8 15446 1
712 . 1 1 67 67 GLU CB C 13 30.445 0.005 . 1 . . . . 67 E CB 6 15446 1
713 . 1 1 67 67 GLU CG C 13 36.291 0.4 . 1 . . . . 67 E CG 3 15446 1
714 . 1 1 67 67 GLU N N 15 117.211 0.021 . 1 . . . . 67 E N 23 15446 1
715 . 1 1 68 68 THR H H 1 7.605 0.005 . 1 . . . . 68 T H 30 15446 1
716 . 1 1 68 68 THR HA H 1 4.324 0.007 . 1 . . . . 68 T HA 5 15446 1
717 . 1 1 68 68 THR HB H 1 4.043 0.009 . 1 . . . . 68 T HB 6 15446 1
718 . 1 1 68 68 THR HG21 H 1 1.072 0.009 . 2 . . . . 68 T QG2 4 15446 1
719 . 1 1 68 68 THR HG22 H 1 1.072 0.009 . 2 . . . . 68 T QG2 4 15446 1
720 . 1 1 68 68 THR HG23 H 1 1.072 0.009 . 2 . . . . 68 T QG2 4 15446 1
721 . 1 1 68 68 THR C C 13 173.666 0.006 . 1 . . . . 68 T C 2 15446 1
722 . 1 1 68 68 THR CA C 13 61.262 0.030 . 1 . . . . 68 T CA 7 15446 1
723 . 1 1 68 68 THR CB C 13 70.523 0.132 . 1 . . . . 68 T CB 5 15446 1
724 . 1 1 68 68 THR CG2 C 13 21.433 0.023 . 1 . . . . 68 T CG2 3 15446 1
725 . 1 1 68 68 THR N N 15 113.090 0.027 . 1 . . . . 68 T N 29 15446 1
726 . 1 1 69 69 VAL H H 1 8.221 0.005 . 1 . . . . 69 V H 26 15446 1
727 . 1 1 69 69 VAL HA H 1 4.251 0.009 . 1 . . . . 69 V HA 9 15446 1
728 . 1 1 69 69 VAL HB H 1 1.972 0.009 . 1 . . . . 69 V HB 8 15446 1
729 . 1 1 69 69 VAL HG11 H 1 0.831 0.011 . 2 . . . . 69 V QG1 5 15446 1
730 . 1 1 69 69 VAL HG12 H 1 0.831 0.011 . 2 . . . . 69 V QG1 5 15446 1
731 . 1 1 69 69 VAL HG13 H 1 0.831 0.011 . 2 . . . . 69 V QG1 5 15446 1
732 . 1 1 69 69 VAL HG21 H 1 0.685 0.002 . 2 . . . . 69 V QG2 2 15446 1
733 . 1 1 69 69 VAL HG22 H 1 0.685 0.002 . 2 . . . . 69 V QG2 2 15446 1
734 . 1 1 69 69 VAL HG23 H 1 0.685 0.002 . 2 . . . . 69 V QG2 2 15446 1
735 . 1 1 69 69 VAL C C 13 173.933 0.042 . 1 . . . . 69 V C 2 15446 1
736 . 1 1 69 69 VAL CA C 13 60.053 0.076 . 1 . . . . 69 V CA 12 15446 1
737 . 1 1 69 69 VAL CB C 13 33.716 0.025 . 1 . . . . 69 V CB 6 15446 1
738 . 1 1 69 69 VAL CG1 C 13 21.193 0.055 . 2 . . . . 69 V CG1 3 15446 1
739 . 1 1 69 69 VAL N N 15 119.124 0.052 . 1 . . . . 69 V N 24 15446 1
740 . 1 1 70 70 ALA H H 1 8.338 0.004 . 1 . . . . 70 A H 26 15446 1
741 . 1 1 70 70 ALA HA H 1 4.678 0.05 . 1 . . . . 70 A HA 1 15446 1
742 . 1 1 70 70 ALA HB1 H 1 1.520 0.003 . 2 . . . . 70 A QB 3 15446 1
743 . 1 1 70 70 ALA HB2 H 1 1.520 0.003 . 2 . . . . 70 A QB 3 15446 1
744 . 1 1 70 70 ALA HB3 H 1 1.520 0.003 . 2 . . . . 70 A QB 3 15446 1
745 . 1 1 70 70 ALA C C 13 176.798 0.4 . 1 . . . . 70 A C 1 15446 1
746 . 1 1 70 70 ALA CA C 13 50.466 0.055 . 1 . . . . 70 A CA 3 15446 1
747 . 1 1 70 70 ALA CB C 13 18.060 0.218 . 1 . . . . 70 A CB 2 15446 1
748 . 1 1 70 70 ALA N N 15 128.477 0.043 . 1 . . . . 70 A N 25 15446 1
749 . 1 1 71 71 PRO HA H 1 4.072 0.004 . 1 . . . . 71 P HA 3 15446 1
750 . 1 1 71 71 PRO HB2 H 1 2.509 0.05 . 2 . . . . 71 P HB2 2 15446 1
751 . 1 1 71 71 PRO HB3 H 1 1.940 0.05 . 2 . . . . 71 P HB3 2 15446 1
752 . 1 1 71 71 PRO C C 13 177.928 0.4 . 1 . . . . 71 P C 1 15446 1
753 . 1 1 71 71 PRO CA C 13 66.153 0.102 . 1 . . . . 71 P CA 6 15446 1
754 . 1 1 71 71 PRO CB C 13 31.918 0.074 . 1 . . . . 71 P CB 5 15446 1
755 . 1 1 71 71 PRO CD C 13 50.554 0.4 . 1 . . . . 71 P CD 1 15446 1
756 . 1 1 71 71 PRO CG C 13 28.058 0.4 . 1 . . . . 71 P CG 1 15446 1
757 . 1 1 72 72 GLU H H 1 8.878 0.006 . 1 . . . . 72 E H 22 15446 1
758 . 1 1 72 72 GLU HA H 1 4.014 0.008 . 1 . . . . 72 E HA 5 15446 1
759 . 1 1 72 72 GLU HB3 H 1 2.044 0.05 . 2 . . . . 72 E HB3 2 15446 1
760 . 1 1 72 72 GLU HG3 H 1 2.345 0.05 . 2 . . . . 72 E HG3 2 15446 1
761 . 1 1 72 72 GLU C C 13 178.712 0.008 . 1 . . . . 72 E C 2 15446 1
762 . 1 1 72 72 GLU CA C 13 59.686 0.061 . 1 . . . . 72 E CA 8 15446 1
763 . 1 1 72 72 GLU CB C 13 28.787 0.012 . 1 . . . . 72 E CB 4 15446 1
764 . 1 1 72 72 GLU CG C 13 36.471 0.4 . 1 . . . . 72 E CG 2 15446 1
765 . 1 1 72 72 GLU N N 15 113.601 0.070 . 1 . . . . 72 E N 21 15446 1
766 . 1 1 73 73 PHE H H 1 7.724 0.005 . 1 . . . . 73 F H 22 15446 1
767 . 1 1 73 73 PHE HA H 1 4.270 0.004 . 1 . . . . 73 F HA 5 15446 1
768 . 1 1 73 73 PHE HB3 H 1 3.352 0.010 . 3 . . . . 73 F HB3 4 15446 1
769 . 1 1 73 73 PHE HE1 H 1 7.357 0.002 . 3 . . . . 73 F QE 4 15446 1
770 . 1 1 73 73 PHE HE2 H 1 7.357 0.002 . 3 . . . . 73 F QE 4 15446 1
771 . 1 1 73 73 PHE C C 13 175.658 0.023 . 1 . . . . 73 F C 2 15446 1
772 . 1 1 73 73 PHE CA C 13 60.929 0.042 . 1 . . . . 73 F CA 6 15446 1
773 . 1 1 73 73 PHE CB C 13 39.341 0.066 . 1 . . . . 73 F CB 4 15446 1
774 . 1 1 73 73 PHE CE1 C 13 131.139 0.018 . 3 . . . . 73 F CE 3 15446 1
775 . 1 1 73 73 PHE CE2 C 13 131.139 0.018 . 3 . . . . 73 F CE 3 15446 1
776 . 1 1 73 73 PHE N N 15 120.941 0.091 . 1 . . . . 73 F N 20 15446 1
777 . 1 1 74 74 ILE H H 1 7.201 0.006 . 1 . . . . 74 I H 17 15446 1
778 . 1 1 74 74 ILE HA H 1 3.163 0.005 . 1 . . . . 74 I HA 7 15446 1
779 . 1 1 74 74 ILE HB H 1 2.152 0.007 . 1 . . . . 74 I HB 3 15446 1
780 . 1 1 74 74 ILE HG12 H 1 1.403 0.05 . 2 . . . . 74 I HG12 2 15446 1
781 . 1 1 74 74 ILE HG13 H 1 1.029 0.05 . 2 . . . . 74 I HG13 2 15446 1
782 . 1 1 74 74 ILE C C 13 176.997 0.005 . 1 . . . . 74 I C 2 15446 1
783 . 1 1 74 74 ILE CA C 13 65.461 0.096 . 1 . . . . 74 I CA 8 15446 1
784 . 1 1 74 74 ILE CB C 13 37.543 0.036 . 1 . . . . 74 I CB 3 15446 1
785 . 1 1 74 74 ILE CD1 C 13 13.799 0.4 . 1 . . . . 74 I CD1 1 15446 1
786 . 1 1 74 74 ILE CG1 C 13 28.343 0.4 . 1 . . . . 74 I CG1 3 15446 1
787 . 1 1 74 74 ILE CG2 C 13 17.918 0.4 . 1 . . . . 74 I CG2 1 15446 1
788 . 1 1 74 74 ILE N N 15 118.069 0.073 . 1 . . . . 74 I N 15 15446 1
789 . 1 1 75 75 VAL H H 1 7.632 0.006 . 1 . . . . 75 V H 29 15446 1
790 . 1 1 75 75 VAL HA H 1 3.509 0.011 . 1 . . . . 75 V HA 7 15446 1
791 . 1 1 75 75 VAL HB H 1 1.989 0.003 . 1 . . . . 75 V HB 5 15446 1
792 . 1 1 75 75 VAL HG11 H 1 1.090 0.006 . 2 . . . . 75 V QG1 8 15446 1
793 . 1 1 75 75 VAL HG12 H 1 1.090 0.006 . 2 . . . . 75 V QG1 8 15446 1
794 . 1 1 75 75 VAL HG13 H 1 1.090 0.006 . 2 . . . . 75 V QG1 8 15446 1
795 . 1 1 75 75 VAL HG21 H 1 0.904 0.004 . 2 . . . . 75 V QG2 12 15446 1
796 . 1 1 75 75 VAL HG22 H 1 0.904 0.004 . 2 . . . . 75 V QG2 12 15446 1
797 . 1 1 75 75 VAL HG23 H 1 0.904 0.004 . 2 . . . . 75 V QG2 12 15446 1
798 . 1 1 75 75 VAL C C 13 177.245 0.005 . 1 . . . . 75 V C 3 15446 1
799 . 1 1 75 75 VAL CA C 13 66.248 0.106 . 1 . . . . 75 V CA 8 15446 1
800 . 1 1 75 75 VAL CB C 13 32.130 0.036 . 1 . . . . 75 V CB 4 15446 1
801 . 1 1 75 75 VAL CG1 C 13 22.236 0.060 . 2 . . . . 75 V CG1 6 15446 1
802 . 1 1 75 75 VAL CG2 C 13 21.224 0.020 . 2 . . . . 75 V CG2 10 15446 1
803 . 1 1 75 75 VAL N N 15 116.351 0.052 . 1 . . . . 75 V N 27 15446 1
804 . 1 1 76 76 LYS H H 1 7.507 0.006 . 1 . . . . 76 K H 31 15446 1
805 . 1 1 76 76 LYS HA H 1 3.822 0.006 . 1 . . . . 76 K HA 8 15446 1
806 . 1 1 76 76 LYS HB2 H 1 1.823 0.003 . 2 . . . . 76 K HB2 3 15446 1
807 . 1 1 76 76 LYS HB3 H 1 1.944 0.001 . 2 . . . . 76 K HB3 3 15446 1
808 . 1 1 76 76 LYS HD3 H 1 1.610 0.05 . 2 . . . . 76 K HD3 2 15446 1
809 . 1 1 76 76 LYS HE3 H 1 2.874 0.05 . 2 . . . . 76 K HE3 2 15446 1
810 . 1 1 76 76 LYS HG3 H 1 1.211 0.05 . 2 . . . . 76 K HG3 2 15446 1
811 . 1 1 76 76 LYS C C 13 180.043 0.006 . 1 . . . . 76 K C 3 15446 1
812 . 1 1 76 76 LYS CA C 13 59.841 0.025 . 1 . . . . 76 K CA 8 15446 1
813 . 1 1 76 76 LYS CB C 13 31.979 0.015 . 1 . . . . 76 K CB 6 15446 1
814 . 1 1 76 76 LYS CD C 13 29.568 0.4 . 1 . . . . 76 K CD 2 15446 1
815 . 1 1 76 76 LYS CE C 13 41.992 0.4 . 1 . . . . 76 K CE 2 15446 1
816 . 1 1 76 76 LYS CG C 13 25.100 0.4 . 1 . . . . 76 K CG 2 15446 1
817 . 1 1 76 76 LYS N N 15 118.149 0.054 . 1 . . . . 76 K N 29 15446 1
818 . 1 1 77 77 VAL H H 1 7.928 0.005 . 1 . . . . 77 V H 36 15446 1
819 . 1 1 77 77 VAL HA H 1 3.427 0.009 . 1 . . . . 77 V HA 7 15446 1
820 . 1 1 77 77 VAL HB H 1 1.587 0.014 . 1 . . . . 77 V HB 6 15446 1
821 . 1 1 77 77 VAL HG11 H 1 0.393 0.009 . 2 . . . . 77 V QG1 9 15446 1
822 . 1 1 77 77 VAL HG12 H 1 0.393 0.009 . 2 . . . . 77 V QG1 9 15446 1
823 . 1 1 77 77 VAL HG13 H 1 0.393 0.009 . 2 . . . . 77 V QG1 9 15446 1
824 . 1 1 77 77 VAL HG21 H 1 0.784 0.002 . 2 . . . . 77 V QG2 5 15446 1
825 . 1 1 77 77 VAL HG22 H 1 0.784 0.002 . 2 . . . . 77 V QG2 5 15446 1
826 . 1 1 77 77 VAL HG23 H 1 0.784 0.002 . 2 . . . . 77 V QG2 5 15446 1
827 . 1 1 77 77 VAL C C 13 177.080 0.015 . 1 . . . . 77 V C 2 15446 1
828 . 1 1 77 77 VAL CA C 13 66.776 0.103 . 1 . . . . 77 V CA 8 15446 1
829 . 1 1 77 77 VAL CB C 13 31.496 0.020 . 1 . . . . 77 V CB 4 15446 1
830 . 1 1 77 77 VAL CG1 C 13 22.651 0.086 . 2 . . . . 77 V CG1 7 15446 1
831 . 1 1 77 77 VAL CG2 C 13 22.154 0.002 . 2 . . . . 77 V CG2 2 15446 1
832 . 1 1 77 77 VAL N N 15 119.543 0.052 . 1 . . . . 77 V N 34 15446 1
833 . 1 1 78 78 ARG H H 1 8.417 0.005 . 1 . . . . 78 R H 29 15446 1
834 . 1 1 78 78 ARG HA H 1 3.613 0.008 . 1 . . . . 78 R HA 10 15446 1
835 . 1 1 78 78 ARG HB2 H 1 1.657 0.05 . 2 . . . . 78 R HB2 2 15446 1
836 . 1 1 78 78 ARG HB3 H 1 2.120 0.05 . 2 . . . . 78 R HB3 3 15446 1
837 . 1 1 78 78 ARG C C 13 178.891 0.006 . 1 . . . . 78 R C 2 15446 1
838 . 1 1 78 78 ARG CA C 13 62.114 0.036 . 1 . . . . 78 R CA 8 15446 1
839 . 1 1 78 78 ARG CB C 13 29.301 0.022 . 1 . . . . 78 R CB 6 15446 1
840 . 1 1 78 78 ARG CD C 13 41.788 0.4 . 1 . . . . 78 R CD 1 15446 1
841 . 1 1 78 78 ARG N N 15 119.955 0.082 . 1 . . . . 78 R N 28 15446 1
842 . 1 1 79 79 LYS H H 1 8.426 0.006 . 1 . . . . 79 K H 26 15446 1
843 . 1 1 79 79 LYS HA H 1 4.110 0.006 . 1 . . . . 79 K HA 7 15446 1
844 . 1 1 79 79 LYS HB3 H 1 1.831 0.05 . 2 . . . . 79 K HB3 2 15446 1
845 . 1 1 79 79 LYS HD3 H 1 1.624 0.05 . 2 . . . . 79 K HD3 2 15446 1
846 . 1 1 79 79 LYS C C 13 180.933 0.015 . 1 . . . . 79 K C 2 15446 1
847 . 1 1 79 79 LYS CA C 13 59.713 0.015 . 1 . . . . 79 K CA 6 15446 1
848 . 1 1 79 79 LYS CB C 13 32.107 0.062 . 1 . . . . 79 K CB 5 15446 1
849 . 1 1 79 79 LYS CD C 13 29.436 0.4 . 1 . . . . 79 K CD 2 15446 1
850 . 1 1 79 79 LYS CG C 13 26.008 0.4 . 1 . . . . 79 K CG 1 15446 1
851 . 1 1 79 79 LYS N N 15 115.637 0.040 . 1 . . . . 79 K N 25 15446 1
852 . 1 1 80 80 LYS H H 1 8.019 0.004 . 1 . . . . 80 K H 25 15446 1
853 . 1 1 80 80 LYS HA H 1 4.097 0.004 . 1 . . . . 80 K HA 5 15446 1
854 . 1 1 80 80 LYS HB3 H 1 2.016 0.007 . 2 . . . . 80 K HB3 5 15446 1
855 . 1 1 80 80 LYS HG3 H 1 1.525 0.05 . 2 . . . . 80 K HG3 2 15446 1
856 . 1 1 80 80 LYS C C 13 177.902 0.023 . 1 . . . . 80 K C 2 15446 1
857 . 1 1 80 80 LYS CA C 13 59.334 0.054 . 1 . . . . 80 K CA 8 15446 1
858 . 1 1 80 80 LYS CB C 13 32.052 0.053 . 1 . . . . 80 K CB 5 15446 1
859 . 1 1 80 80 LYS CD C 13 30.195 0.4 . 1 . . . . 80 K CD 1 15446 1
860 . 1 1 80 80 LYS CE C 13 41.956 0.4 . 1 . . . . 80 K CE 1 15446 1
861 . 1 1 80 80 LYS CG C 13 24.883 0.4 . 1 . . . . 80 K CG 2 15446 1
862 . 1 1 80 80 LYS N N 15 123.204 0.028 . 1 . . . . 80 K N 23 15446 1
863 . 1 1 81 81 LEU H H 1 7.611 0.005 . 1 . . . . 81 L H 29 15446 1
864 . 1 1 81 81 LEU HA H 1 4.233 0.007 . 1 . . . . 81 L HA 4 15446 1
865 . 1 1 81 81 LEU HB2 H 1 1.682 0.008 . 2 . . . . 81 L HB2 3 15446 1
866 . 1 1 81 81 LEU HB3 H 1 1.758 0.005 . 2 . . . . 81 L HB3 6 15446 1
867 . 1 1 81 81 LEU HG H 1 0.890 0.004 . 1 . . . . 81 L HG 7 15446 1
868 . 1 1 81 81 LEU C C 13 175.134 0.4 . 1 . . . . 81 L C 1 15446 1
869 . 1 1 81 81 LEU CA C 13 54.377 0.064 . 1 . . . . 81 L CA 8 15446 1
870 . 1 1 81 81 LEU CB C 13 41.838 0.021 . 1 . . . . 81 L CB 8 15446 1
871 . 1 1 81 81 LEU CD1 C 13 21.978 0.4 . 2 . . . . 81 L CD1 2 15446 1
872 . 1 1 81 81 LEU CG C 13 26.998 0.006 . 1 . . . . 81 L CG 4 15446 1
873 . 1 1 81 81 LEU N N 15 117.256 0.069 . 1 . . . . 81 L N 27 15446 1
874 . 1 1 82 82 SER H H 1 7.899 0.004 . 1 . . . . 82 S H 30 15446 1
875 . 1 1 82 82 SER HA H 1 3.920 0.002 . 1 . . . . 82 S HA 4 15446 1
876 . 1 1 82 82 SER HB3 H 1 4.180 0.006 . 2 . . . . 82 S HB3 5 15446 1
877 . 1 1 82 82 SER C C 13 173.583 0.024 . 1 . . . . 82 S C 2 15446 1
878 . 1 1 82 82 SER CA C 13 58.653 0.136 . 1 . . . . 82 S CA 8 15446 1
879 . 1 1 82 82 SER CB C 13 61.554 0.022 . 1 . . . . 82 S CB 5 15446 1
880 . 1 1 82 82 SER N N 15 112.580 0.058 . 1 . . . . 82 S N 28 15446 1
881 . 1 1 83 83 LEU H H 1 7.232 0.005 . 1 . . . . 83 L H 24 15446 1
882 . 1 1 83 83 LEU HA H 1 5.002 0.003 . 1 . . . . 83 L HA 5 15446 1
883 . 1 1 83 83 LEU HB2 H 1 1.380 0.05 . 2 . . . . 83 L HB2 2 15446 1
884 . 1 1 83 83 LEU HB3 H 1 1.526 0.006 . 2 . . . . 83 L HB3 4 15446 1
885 . 1 1 83 83 LEU HD11 H 1 0.693 0.007 . 2 . . . . 83 L QD1 14 15446 1
886 . 1 1 83 83 LEU HD12 H 1 0.693 0.007 . 2 . . . . 83 L QD1 14 15446 1
887 . 1 1 83 83 LEU HD13 H 1 0.693 0.007 . 2 . . . . 83 L QD1 14 15446 1
888 . 1 1 83 83 LEU HG H 1 1.321 0.05 . 1 . . . . 83 L HG 2 15446 1
889 . 1 1 83 83 LEU C C 13 178.564 0.020 . 1 . . . . 83 L C 2 15446 1
890 . 1 1 83 83 LEU CA C 13 52.514 0.067 . 1 . . . . 83 L CA 8 15446 1
891 . 1 1 83 83 LEU CB C 13 45.504 0.111 . 1 . . . . 83 L CB 5 15446 1
892 . 1 1 83 83 LEU CD1 C 13 22.962 0.038 . 2 . . . . 83 L CD1 12 15446 1
893 . 1 1 83 83 LEU CG C 13 26.659 0.4 . 1 . . . . 83 L CG 2 15446 1
894 . 1 1 83 83 LEU N N 15 116.391 0.104 . 1 . . . . 83 L N 23 15446 1
895 . 1 1 84 84 THR H H 1 9.021 0.013 . 1 . . . . 84 T H 26 15446 1
896 . 1 1 84 84 THR HA H 1 4.374 0.004 . 1 . . . . 84 T HA 7 15446 1
897 . 1 1 84 84 THR HB H 1 4.754 0.007 . 1 . . . . 84 T HB 6 15446 1
898 . 1 1 84 84 THR C C 13 176.012 0.022 . 1 . . . . 84 T C 2 15446 1
899 . 1 1 84 84 THR CA C 13 61.026 0.056 . 1 . . . . 84 T CA 5 15446 1
900 . 1 1 84 84 THR CB C 13 70.900 0.172 . 1 . . . . 84 T CB 5 15446 1
901 . 1 1 84 84 THR CG2 C 13 21.852 0.4 . 1 . . . . 84 T CG2 1 15446 1
902 . 1 1 84 84 THR N N 15 114.350 0.068 . 1 . . . . 84 T N 25 15446 1
903 . 1 1 85 85 GLN H H 1 9.225 0.005 . 1 . . . . 85 Q H 20 15446 1
904 . 1 1 85 85 GLN HA H 1 3.724 0.379 . 1 . . . . 85 Q HA 7 15446 1
905 . 1 1 85 85 GLN HB3 H 1 1.984 0.05 . 2 . . . . 85 Q HB3 2 15446 1
906 . 1 1 85 85 GLN C C 13 179.096 0.014 . 1 . . . . 85 Q C 3 15446 1
907 . 1 1 85 85 GLN CA C 13 61.017 0.056 . 1 . . . . 85 Q CA 8 15446 1
908 . 1 1 85 85 GLN CB C 13 27.937 0.062 . 1 . . . . 85 Q CB 5 15446 1
909 . 1 1 85 85 GLN CG C 13 34.425 0.4 . 1 . . . . 85 Q CG 1 15446 1
910 . 1 1 85 85 GLN N N 15 120.527 0.047 . 1 . . . . 85 Q N 20 15446 1
911 . 1 1 86 86 LYS H H 1 8.516 0.006 . 1 . . . . 86 K H 23 15446 1
912 . 1 1 86 86 LYS HA H 1 4.066 0.005 . 1 . . . . 86 K HA 6 15446 1
913 . 1 1 86 86 LYS HB2 H 1 1.704 0.05 . 2 . . . . 86 K HB2 2 15446 1
914 . 1 1 86 86 LYS HB3 H 1 1.913 0.05 . 2 . . . . 86 K HB3 2 15446 1
915 . 1 1 86 86 LYS HG2 H 1 1.483 0.05 . 2 . . . . 86 K HG2 2 15446 1
916 . 1 1 86 86 LYS HG3 H 1 1.651 0.05 . 2 . . . . 86 K HG3 2 15446 1
917 . 1 1 86 86 LYS C C 13 178.663 0.010 . 1 . . . . 86 K C 3 15446 1
918 . 1 1 86 86 LYS CA C 13 60.097 0.057 . 1 . . . . 86 K CA 7 15446 1
919 . 1 1 86 86 LYS CB C 13 32.940 0.009 . 1 . . . . 86 K CB 6 15446 1
920 . 1 1 86 86 LYS CD C 13 29.607 0.4 . 1 . . . . 86 K CD 1 15446 1
921 . 1 1 86 86 LYS CE C 13 42.148 0.4 . 1 . . . . 86 K CE 1 15446 1
922 . 1 1 86 86 LYS CG C 13 25.006 0.4 . 1 . . . . 86 K CG 3 15446 1
923 . 1 1 86 86 LYS N N 15 121.684 0.045 . 1 . . . . 86 K N 23 15446 1
924 . 1 1 87 87 GLU H H 1 7.786 0.005 . 1 . . . . 87 E H 27 15446 1
925 . 1 1 87 87 GLU HA H 1 3.988 0.006 . 1 . . . . 87 E HA 5 15446 1
926 . 1 1 87 87 GLU HB2 H 1 2.133 0.05 . 2 . . . . 87 E HB2 2 15446 1
927 . 1 1 87 87 GLU HB3 H 1 1.807 0.05 . 2 . . . . 87 E HB3 2 15446 1
928 . 1 1 87 87 GLU C C 13 179.280 0.019 . 1 . . . . 87 E C 3 15446 1
929 . 1 1 87 87 GLU CA C 13 58.775 0.037 . 1 . . . . 87 E CA 8 15446 1
930 . 1 1 87 87 GLU CB C 13 32.100 0.4 . 1 . . . . 87 E CB 3 15446 1
931 . 1 1 87 87 GLU CG C 13 37.162 0.4 . 1 . . . . 87 E CG 1 15446 1
932 . 1 1 87 87 GLU N N 15 119.416 0.061 . 1 . . . . 87 E N 26 15446 1
933 . 1 1 88 88 ALA H H 1 8.367 0.005 . 1 . . . . 88 A H 26 15446 1
934 . 1 1 88 88 ALA HA H 1 3.702 0.005 . 1 . . . . 88 A HA 6 15446 1
935 . 1 1 88 88 ALA HB1 H 1 0.339 0.006 . 2 . . . . 88 A QB 9 15446 1
936 . 1 1 88 88 ALA HB2 H 1 0.339 0.006 . 2 . . . . 88 A QB 9 15446 1
937 . 1 1 88 88 ALA HB3 H 1 0.339 0.006 . 2 . . . . 88 A QB 9 15446 1
938 . 1 1 88 88 ALA C C 13 178.364 0.012 . 1 . . . . 88 A C 4 15446 1
939 . 1 1 88 88 ALA CA C 13 55.098 0.032 . 1 . . . . 88 A CA 8 15446 1
940 . 1 1 88 88 ALA CB C 13 15.525 0.107 . 1 . . . . 88 A CB 8 15446 1
941 . 1 1 88 88 ALA N N 15 119.267 0.101 . 1 . . . . 88 A N 24 15446 1
942 . 1 1 89 89 SER H H 1 7.960 0.006 . 1 . . . . 89 S H 24 15446 1
943 . 1 1 89 89 SER HA H 1 4.433 0.05 . 1 . . . . 89 S HA 1 15446 1
944 . 1 1 89 89 SER HB3 H 1 4.437 0.002 . 2 . . . . 89 S HB3 2 15446 1
945 . 1 1 89 89 SER C C 13 176.367 0.4 . 1 . . . . 89 S C 1 15446 1
946 . 1 1 89 89 SER CA C 13 62.602 0.047 . 1 . . . . 89 S CA 3 15446 1
947 . 1 1 89 89 SER N N 15 114.702 0.078 . 1 . . . . 89 S N 23 15446 1
948 . 1 1 90 90 GLU H H 1 7.713 0.003 . 1 . . . . 90 E H 2 15446 1
949 . 1 1 90 90 GLU HA H 1 3.981 0.008 . 1 . . . . 90 E HA 5 15446 1
950 . 1 1 90 90 GLU HB2 H 1 2.001 0.006 . 2 . . . . 90 E HB2 3 15446 1
951 . 1 1 90 90 GLU HB3 H 1 2.188 0.002 . 2 . . . . 90 E HB3 4 15446 1
952 . 1 1 90 90 GLU HG2 H 1 2.224 0.05 . 2 . . . . 90 E HG2 2 15446 1
953 . 1 1 90 90 GLU HG3 H 1 2.404 0.05 . 2 . . . . 90 E HG3 2 15446 1
954 . 1 1 90 90 GLU C C 13 178.323 0.4 . 1 . . . . 90 E C 1 15446 1
955 . 1 1 90 90 GLU CA C 13 59.204 0.016 . 1 . . . . 90 E CA 6 15446 1
956 . 1 1 90 90 GLU CB C 13 29.490 0.028 . 1 . . . . 90 E CB 5 15446 1
957 . 1 1 90 90 GLU CG C 13 36.331 0.4 . 1 . . . . 90 E CG 3 15446 1
958 . 1 1 91 91 ILE H H 1 7.966 0.005 . 1 . . . . 91 I H 30 15446 1
959 . 1 1 91 91 ILE HA H 1 3.582 0.007 . 1 . . . . 91 I HA 10 15446 1
960 . 1 1 91 91 ILE HB H 1 1.168 0.010 . 1 . . . . 91 I HB 14 15446 1
961 . 1 1 91 91 ILE HD11 H 1 0.606 0.05 . 2 . . . . 91 I QD1 4 15446 1
962 . 1 1 91 91 ILE HD12 H 1 0.606 0.05 . 2 . . . . 91 I QD1 4 15446 1
963 . 1 1 91 91 ILE HD13 H 1 0.606 0.05 . 2 . . . . 91 I QD1 4 15446 1
964 . 1 1 91 91 ILE HG12 H 1 1.648 0.005 . 2 . . . . 91 I HG12 6 15446 1
965 . 1 1 91 91 ILE HG13 H 1 0.891 0.003 . 2 . . . . 91 I HG13 4 15446 1
966 . 1 1 91 91 ILE HG21 H 1 0.012 0.008 . 2 . . . . 91 I QG2 10 15446 1
967 . 1 1 91 91 ILE HG22 H 1 0.012 0.008 . 2 . . . . 91 I QG2 10 15446 1
968 . 1 1 91 91 ILE HG23 H 1 0.012 0.008 . 2 . . . . 91 I QG2 10 15446 1
969 . 1 1 91 91 ILE C C 13 177.082 0.017 . 1 . . . . 91 I C 3 15446 1
970 . 1 1 91 91 ILE CA C 13 64.479 0.076 . 1 . . . . 91 I CA 10 15446 1
971 . 1 1 91 91 ILE CB C 13 39.390 0.067 . 1 . . . . 91 I CB 10 15446 1
972 . 1 1 91 91 ILE CD1 C 13 8.637 0.4 . 1 . . . . 91 I CD1 1 15446 1
973 . 1 1 91 91 ILE CG1 C 13 28.836 0.098 . 1 . . . . 91 I CG1 6 15446 1
974 . 1 1 91 91 ILE CG2 C 13 16.050 0.108 . 1 . . . . 91 I CG2 7 15446 1
975 . 1 1 91 91 ILE N N 15 118.598 0.033 . 1 . . . . 91 I N 29 15446 1
976 . 1 1 92 92 PHE H H 1 8.491 0.005 . 1 . . . . 92 F H 32 15446 1
977 . 1 1 92 92 PHE HA H 1 4.418 0.004 . 1 . . . . 92 F HA 5 15446 1
978 . 1 1 92 92 PHE HB2 H 1 3.367 0.003 . 2 . . . . 92 F HB2 5 15446 1
979 . 1 1 92 92 PHE HB3 H 1 3.468 0.014 . 2 . . . . 92 F HB3 5 15446 1
980 . 1 1 92 92 PHE HD1 H 1 7.552 0.003 . 3 . . . . 92 F QD 4 15446 1
981 . 1 1 92 92 PHE HD2 H 1 7.552 0.003 . 3 . . . . 92 F QD 4 15446 1
982 . 1 1 92 92 PHE HE1 H 1 6.885 0.002 . 3 . . . . 92 F HE 2 15446 1
983 . 1 1 92 92 PHE HE2 H 1 6.885 0.002 . 3 . . . . 92 F HE 2 15446 1
984 . 1 1 92 92 PHE C C 13 177.257 0.003 . 1 . . . . 92 F C 2 15446 1
985 . 1 1 92 92 PHE CA C 13 59.498 0.040 . 1 . . . . 92 F CA 8 15446 1
986 . 1 1 92 92 PHE CB C 13 39.330 0.071 . 1 . . . . 92 F CB 9 15446 1
987 . 1 1 92 92 PHE CD1 C 13 131.700 0.013 . 3 . . . . 92 F CD 2 15446 1
988 . 1 1 92 92 PHE CD2 C 13 131.700 0.013 . 3 . . . . 92 F CD 2 15446 1
989 . 1 1 92 92 PHE CE1 C 13 128.901 0.4 . 3 . . . . 92 F CE 1 15446 1
990 . 1 1 92 92 PHE CE2 C 13 128.901 0.4 . 3 . . . . 92 F CE 1 15446 1
991 . 1 1 92 92 PHE N N 15 113.032 0.028 . 1 . . . . 92 F N 30 15446 1
992 . 1 1 93 93 GLY H H 1 7.597 0.005 . 1 . . . . 93 G H 26 15446 1
993 . 1 1 93 93 GLY HA2 H 1 4.174 0.012 . 2 . . . . 93 G HA2 6 15446 1
994 . 1 1 93 93 GLY HA3 H 1 4.006 0.003 . 2 . . . . 93 G HA3 5 15446 1
995 . 1 1 93 93 GLY C C 13 172.165 0.030 . 1 . . . . 93 G C 2 15446 1
996 . 1 1 93 93 GLY CA C 13 44.594 0.044 . 1 . . . . 93 G CA 8 15446 1
997 . 1 1 93 93 GLY N N 15 107.602 0.084 . 1 . . . . 93 G N 24 15446 1
998 . 1 1 94 94 GLY H H 1 8.270 0.004 . 1 . . . . 94 G H 19 15446 1
999 . 1 1 94 94 GLY HA2 H 1 4.696 0.008 . 2 . . . . 94 G HA2 5 15446 1
1000 . 1 1 94 94 GLY HA3 H 1 3.847 0.009 . 2 . . . . 94 G HA3 5 15446 1
1001 . 1 1 94 94 GLY C C 13 175.535 0.001 . 1 . . . . 94 G C 2 15446 1
1002 . 1 1 94 94 GLY CA C 13 44.851 0.144 . 1 . . . . 94 G CA 10 15446 1
1003 . 1 1 94 94 GLY N N 15 102.696 0.092 . 1 . . . . 94 G N 19 15446 1
1004 . 1 1 95 95 GLY H H 1 8.307 0.004 . 1 . . . . 95 G H 17 15446 1
1005 . 1 1 95 95 GLY HA2 H 1 4.454 0.004 . 2 . . . . 95 G HA2 7 15446 1
1006 . 1 1 95 95 GLY HA3 H 1 3.822 0.008 . 2 . . . . 95 G HA3 6 15446 1
1007 . 1 1 95 95 GLY C C 13 174.370 0.021 . 1 . . . . 95 G C 3 15446 1
1008 . 1 1 95 95 GLY CA C 13 43.860 0.016 . 1 . . . . 95 G CA 9 15446 1
1009 . 1 1 95 95 GLY N N 15 111.041 0.079 . 1 . . . . 95 G N 17 15446 1
1010 . 1 1 96 96 VAL H H 1 8.135 0.004 . 1 . . . . 96 V H 18 15446 1
1011 . 1 1 96 96 VAL HA H 1 3.816 0.005 . 1 . . . . 96 V HA 10 15446 1
1012 . 1 1 96 96 VAL HB H 1 2.022 0.018 . 1 . . . . 96 V HB 5 15446 1
1013 . 1 1 96 96 VAL HG11 H 1 0.992 0.002 . 2 . . . . 96 V QG1 5 15446 1
1014 . 1 1 96 96 VAL HG12 H 1 0.992 0.002 . 2 . . . . 96 V QG1 5 15446 1
1015 . 1 1 96 96 VAL HG13 H 1 0.992 0.002 . 2 . . . . 96 V QG1 5 15446 1
1016 . 1 1 96 96 VAL HG21 H 1 0.941 0.006 . 2 . . . . 96 V QG2 6 15446 1
1017 . 1 1 96 96 VAL HG22 H 1 0.941 0.006 . 2 . . . . 96 V QG2 6 15446 1
1018 . 1 1 96 96 VAL HG23 H 1 0.941 0.006 . 2 . . . . 96 V QG2 6 15446 1
1019 . 1 1 96 96 VAL C C 13 176.903 0.4 . 1 . . . . 96 V C 1 15446 1
1020 . 1 1 96 96 VAL CA C 13 64.826 0.103 . 1 . . . . 96 V CA 7 15446 1
1021 . 1 1 96 96 VAL CB C 13 31.662 0.050 . 1 . . . . 96 V CB 3 15446 1
1022 . 1 1 96 96 VAL CG1 C 13 20.791 0.081 . 2 . . . . 96 V CG1 2 15446 1
1023 . 1 1 96 96 VAL CG2 C 13 20.643 0.098 . 2 . . . . 96 V CG2 3 15446 1
1024 . 1 1 96 96 VAL N N 15 117.632 0.023 . 1 . . . . 96 V N 17 15446 1
1025 . 1 1 97 97 ASN HA H 1 4.782 0.004 . 1 . . . . 97 N HA 7 15446 1
1026 . 1 1 97 97 ASN HB2 H 1 2.771 0.006 . 2 . . . . 97 N HB2 5 15446 1
1027 . 1 1 97 97 ASN HB3 H 1 2.896 0.004 . 2 . . . . 97 N HB3 4 15446 1
1028 . 1 1 97 97 ASN C C 13 176.233 0.4 . 1 . . . . 97 N C 1 15446 1
1029 . 1 1 97 97 ASN CA C 13 53.247 0.106 . 1 . . . . 97 N CA 6 15446 1
1030 . 1 1 97 97 ASN CB C 13 38.239 0.022 . 1 . . . . 97 N CB 5 15446 1
1031 . 1 1 98 98 ALA H H 1 7.655 0.006 . 1 . . . . 98 A H 29 15446 1
1032 . 1 1 98 98 ALA HA H 1 3.432 0.011 . 1 . . . . 98 A HA 9 15446 1
1033 . 1 1 98 98 ALA HB1 H 1 1.270 0.005 . 2 . . . . 98 A QB 10 15446 1
1034 . 1 1 98 98 ALA HB2 H 1 1.270 0.005 . 2 . . . . 98 A QB 10 15446 1
1035 . 1 1 98 98 ALA HB3 H 1 1.270 0.005 . 2 . . . . 98 A QB 10 15446 1
1036 . 1 1 98 98 ALA C C 13 178.024 0.011 . 1 . . . . 98 A C 2 15446 1
1037 . 1 1 98 98 ALA CA C 13 56.111 0.101 . 1 . . . . 98 A CA 8 15446 1
1038 . 1 1 98 98 ALA CB C 13 18.569 0.073 . 1 . . . . 98 A CB 10 15446 1
1039 . 1 1 98 98 ALA N N 15 122.200 0.053 . 1 . . . . 98 A N 27 15446 1
1040 . 1 1 99 99 PHE H H 1 8.192 0.005 . 1 . . . . 99 F H 27 15446 1
1041 . 1 1 99 99 PHE HA H 1 3.696 0.006 . 1 . . . . 99 F HA 7 15446 1
1042 . 1 1 99 99 PHE HB2 H 1 3.127 0.014 . 2 . . . . 99 F HB2 5 15446 1
1043 . 1 1 99 99 PHE HB3 H 1 2.876 0.009 . 2 . . . . 99 F HB3 5 15446 1
1044 . 1 1 99 99 PHE C C 13 177.876 0.007 . 1 . . . . 99 F C 2 15446 1
1045 . 1 1 99 99 PHE CA C 13 62.321 0.040 . 1 . . . . 99 F CA 6 15446 1
1046 . 1 1 99 99 PHE CB C 13 37.309 0.076 . 1 . . . . 99 F CB 5 15446 1
1047 . 1 1 99 99 PHE N N 15 113.625 0.094 . 1 . . . . 99 F N 26 15446 1
1048 . 1 1 100 100 SER H H 1 7.684 0.007 . 1 . . . . 100 S H 26 15446 1
1049 . 1 1 100 100 SER HA H 1 4.106 0.008 . 1 . . . . 100 S HA 6 15446 1
1050 . 1 1 100 100 SER HB3 H 1 3.806 0.006 . 2 . . . . 100 S HB3 8 15446 1
1051 . 1 1 100 100 SER C C 13 176.994 0.007 . 1 . . . . 100 S C 2 15446 1
1052 . 1 1 100 100 SER CA C 13 61.208 0.065 . 1 . . . . 100 S CA 8 15446 1
1053 . 1 1 100 100 SER CB C 13 62.438 0.034 . 1 . . . . 100 S CB 4 15446 1
1054 . 1 1 100 100 SER N N 15 113.961 0.069 . 1 . . . . 100 S N 24 15446 1
1055 . 1 1 101 101 ARG H H 1 7.194 0.004 . 1 . . . . 101 R H 28 15446 1
1056 . 1 1 101 101 ARG HA H 1 4.111 0.003 . 1 . . . . 101 R HA 6 15446 1
1057 . 1 1 101 101 ARG HB2 H 1 1.579 0.005 . 2 . . . . 101 R HB2 4 15446 1
1058 . 1 1 101 101 ARG HB3 H 1 1.739 0.008 . 2 . . . . 101 R HB3 5 15446 1
1059 . 1 1 101 101 ARG HE H 1 7.145 0.05 . 1 . . . . 101 R HE 1 15446 1
1060 . 1 1 101 101 ARG C C 13 180.085 0.005 . 1 . . . . 101 R C 3 15446 1
1061 . 1 1 101 101 ARG CA C 13 59.276 0.030 . 1 . . . . 101 R CA 8 15446 1
1062 . 1 1 101 101 ARG CB C 13 30.506 0.077 . 1 . . . . 101 R CB 6 15446 1
1063 . 1 1 101 101 ARG CD C 13 43.542 0.4 . 1 . . . . 101 R CD 1 15446 1
1064 . 1 1 101 101 ARG CG C 13 27.744 0.4 . 1 . . . . 101 R CG 1 15446 1
1065 . 1 1 101 101 ARG N N 15 118.648 0.090 . 1 . . . . 101 R N 26 15446 1
1066 . 1 1 101 101 ARG NE N 15 84.839 0.4 . 1 . . . . 101 R NE 1 15446 1
1067 . 1 1 102 102 TYR H H 1 8.576 0.006 . 1 . . . . 102 Y H 31 15446 1
1068 . 1 1 102 102 TYR HA H 1 4.764 0.004 . 1 . . . . 102 Y HA 4 15446 1
1069 . 1 1 102 102 TYR HB2 H 1 2.682 0.014 . 2 . . . . 102 Y HB2 3 15446 1
1070 . 1 1 102 102 TYR HB3 H 1 3.011 0.023 . 2 . . . . 102 Y HB3 3 15446 1
1071 . 1 1 102 102 TYR C C 13 180.702 0.003 . 1 . . . . 102 Y C 2 15446 1
1072 . 1 1 102 102 TYR CA C 13 57.071 0.062 . 1 . . . . 102 Y CA 8 15446 1
1073 . 1 1 102 102 TYR CB C 13 37.634 0.046 . 1 . . . . 102 Y CB 5 15446 1
1074 . 1 1 102 102 TYR N N 15 119.044 0.088 . 1 . . . . 102 Y N 30 15446 1
1075 . 1 1 103 103 GLU H H 1 8.419 0.005 . 1 . . . . 103 E H 27 15446 1
1076 . 1 1 103 103 GLU HA H 1 3.910 0.005 . 1 . . . . 103 E HA 5 15446 1
1077 . 1 1 103 103 GLU HB2 H 1 1.900 0.05 . 2 . . . . 103 E HB2 2 15446 1
1078 . 1 1 103 103 GLU HB3 H 1 2.015 0.05 . 2 . . . . 103 E HB3 3 15446 1
1079 . 1 1 103 103 GLU HG3 H 1 2.816 0.05 . 2 . . . . 103 E HG3 2 15446 1
1080 . 1 1 103 103 GLU C C 13 176.793 0.015 . 1 . . . . 103 E C 2 15446 1
1081 . 1 1 103 103 GLU CA C 13 59.282 0.075 . 1 . . . . 103 E CA 8 15446 1
1082 . 1 1 103 103 GLU CB C 13 28.854 0.032 . 1 . . . . 103 E CB 6 15446 1
1083 . 1 1 103 103 GLU CG C 13 38.774 0.4 . 1 . . . . 103 E CG 2 15446 1
1084 . 1 1 103 103 GLU N N 15 116.876 0.087 . 1 . . . . 103 E N 24 15446 1
1085 . 1 1 104 104 LYS H H 1 7.233 0.005 . 1 . . . . 104 K H 29 15446 1
1086 . 1 1 104 104 LYS HA H 1 4.453 0.004 . 1 . . . . 104 K HA 5 15446 1
1087 . 1 1 104 104 LYS HB2 H 1 1.807 0.005 . 2 . . . . 104 K HB2 4 15446 1
1088 . 1 1 104 104 LYS HB3 H 1 1.993 0.010 . 2 . . . . 104 K HB3 4 15446 1
1089 . 1 1 104 104 LYS HD3 H 1 1.645 0.05 . 2 . . . . 104 K HD3 2 15446 1
1090 . 1 1 104 104 LYS HE3 H 1 2.970 0.05 . 2 . . . . 104 K HE3 2 15446 1
1091 . 1 1 104 104 LYS HG3 H 1 1.486 0.05 . 2 . . . . 104 K HG3 2 15446 1
1092 . 1 1 104 104 LYS C C 13 177.003 0.008 . 1 . . . . 104 K C 2 15446 1
1093 . 1 1 104 104 LYS CA C 13 56.068 0.034 . 1 . . . . 104 K CA 8 15446 1
1094 . 1 1 104 104 LYS CB C 13 33.686 0.050 . 1 . . . . 104 K CB 6 15446 1
1095 . 1 1 104 104 LYS CD C 13 29.016 0.4 . 1 . . . . 104 K CD 2 15446 1
1096 . 1 1 104 104 LYS CE C 13 42.095 0.4 . 1 . . . . 104 K CE 2 15446 1
1097 . 1 1 104 104 LYS CG C 13 25.439 0.4 . 1 . . . . 104 K CG 2 15446 1
1098 . 1 1 104 104 LYS N N 15 116.584 0.136 . 1 . . . . 104 K N 28 15446 1
1099 . 1 1 105 105 GLY H H 1 7.646 0.005 . 1 . . . . 105 G H 35 15446 1
1100 . 1 1 105 105 GLY HA2 H 1 4.237 0.005 . 2 . . . . 105 G HA2 6 15446 1
1101 . 1 1 105 105 GLY HA3 H 1 3.930 0.014 . 2 . . . . 105 G HA3 6 15446 1
1102 . 1 1 105 105 GLY C C 13 174.277 0.025 . 1 . . . . 105 G C 3 15446 1
1103 . 1 1 105 105 GLY CA C 13 45.596 0.070 . 1 . . . . 105 G CA 9 15446 1
1104 . 1 1 105 105 GLY N N 15 105.368 0.102 . 1 . . . . 105 G N 33 15446 1
1105 . 1 1 106 106 ASN H H 1 8.069 0.004 . 1 . . . . 106 N H 23 15446 1
1106 . 1 1 106 106 ASN HA H 1 4.787 0.003 . 1 . . . . 106 N HA 6 15446 1
1107 . 1 1 106 106 ASN HB2 H 1 2.902 0.005 . 2 . . . . 106 N HB2 4 15446 1
1108 . 1 1 106 106 ASN HB3 H 1 2.587 0.006 . 2 . . . . 106 N HB3 4 15446 1
1109 . 1 1 106 106 ASN HD21 H 1 7.465 0.05 . 2 . . . . 106 N HD21 1 15446 1
1110 . 1 1 106 106 ASN HD22 H 1 6.835 0.05 . 2 . . . . 106 N HD22 1 15446 1
1111 . 1 1 106 106 ASN C C 13 173.833 0.022 . 1 . . . . 106 N C 3 15446 1
1112 . 1 1 106 106 ASN CA C 13 53.764 0.102 . 1 . . . . 106 N CA 8 15446 1
1113 . 1 1 106 106 ASN CB C 13 39.740 0.009 . 1 . . . . 106 N CB 6 15446 1
1114 . 1 1 106 106 ASN N N 15 115.820 0.065 . 1 . . . . 106 N N 21 15446 1
1115 . 1 1 106 106 ASN ND2 N 15 110.174 0.001 . 1 . . . . 106 N ND2 2 15446 1
1116 . 1 1 107 107 ALA H H 1 7.327 0.004 . 1 . . . . 107 A H 30 15446 1
1117 . 1 1 107 107 ALA HA H 1 4.548 0.004 . 1 . . . . 107 A HA 5 15446 1
1118 . 1 1 107 107 ALA HB1 H 1 1.369 0.005 . 2 . . . . 107 A QB 7 15446 1
1119 . 1 1 107 107 ALA HB2 H 1 1.369 0.005 . 2 . . . . 107 A QB 7 15446 1
1120 . 1 1 107 107 ALA HB3 H 1 1.369 0.005 . 2 . . . . 107 A QB 7 15446 1
1121 . 1 1 107 107 ALA C C 13 175.415 0.017 . 1 . . . . 107 A C 3 15446 1
1122 . 1 1 107 107 ALA CA C 13 51.365 0.033 . 1 . . . . 107 A CA 8 15446 1
1123 . 1 1 107 107 ALA CB C 13 22.234 0.036 . 1 . . . . 107 A CB 8 15446 1
1124 . 1 1 107 107 ALA N N 15 118.140 0.048 . 1 . . . . 107 A N 29 15446 1
1125 . 1 1 108 108 GLN H H 1 8.766 0.004 . 1 . . . . 108 Q H 22 15446 1
1126 . 1 1 108 108 GLN HE21 H 1 7.480 0.002 . 2 . . . . 108 Q HE21 6 15446 1
1127 . 1 1 108 108 GLN HE22 H 1 6.945 0.004 . 2 . . . . 108 Q HE22 7 15446 1
1128 . 1 1 108 108 GLN C C 13 173.550 0.4 . 1 . . . . 108 Q C 1 15446 1
1129 . 1 1 108 108 GLN CA C 13 52.310 0.042 . 1 . . . . 108 Q CA 3 15446 1
1130 . 1 1 108 108 GLN CB C 13 30.044 0.103 . 1 . . . . 108 Q CB 6 15446 1
1131 . 1 1 108 108 GLN CG C 13 33.586 0.024 . 1 . . . . 108 Q CG 5 15446 1
1132 . 1 1 108 108 GLN N N 15 120.729 0.029 . 1 . . . . 108 Q N 21 15446 1
1133 . 1 1 108 108 GLN NE2 N 15 112.466 0.164 . 1 . . . . 108 Q NE2 12 15446 1
1134 . 1 1 116 116 LEU HA H 1 4.213 0.012 . 1 . . . . 116 L HA 4 15446 1
1135 . 1 1 116 116 LEU HB2 H 1 2.111 0.011 . 2 . . . . 116 L HB2 6 15446 1
1136 . 1 1 116 116 LEU HB3 H 1 1.935 0.05 . 2 . . . . 116 L HB3 3 15446 1
1137 . 1 1 116 116 LEU HD11 H 1 1.054 0.004 . 2 . . . . 116 L QD1 10 15446 1
1138 . 1 1 116 116 LEU HD12 H 1 1.054 0.004 . 2 . . . . 116 L QD1 10 15446 1
1139 . 1 1 116 116 LEU HD13 H 1 1.054 0.004 . 2 . . . . 116 L QD1 10 15446 1
1140 . 1 1 116 116 LEU HG H 1 1.947 0.05 . 1 . . . . 116 L HG 2 15446 1
1141 . 1 1 116 116 LEU C C 13 178.449 0.4 . 1 . . . . 116 L C 1 15446 1
1142 . 1 1 116 116 LEU CA C 13 57.964 0.038 . 1 . . . . 116 L CA 4 15446 1
1143 . 1 1 116 116 LEU CB C 13 42.398 0.010 . 1 . . . . 116 L CB 4 15446 1
1144 . 1 1 116 116 LEU CD1 C 13 23.337 0.039 . 2 . . . . 116 L CD1 8 15446 1
1145 . 1 1 116 116 LEU CG C 13 26.694 0.4 . 1 . . . . 116 L CG 2 15446 1
1146 . 1 1 117 117 LEU H H 1 8.504 0.005 . 1 . . . . 117 L H 23 15446 1
1147 . 1 1 117 117 LEU HA H 1 3.965 0.014 . 1 . . . . 117 L HA 5 15446 1
1148 . 1 1 117 117 LEU HB2 H 1 1.247 0.014 . 2 . . . . 117 L HB2 3 15446 1
1149 . 1 1 117 117 LEU HB3 H 1 2.222 0.015 . 2 . . . . 117 L HB3 4 15446 1
1150 . 1 1 117 117 LEU HD11 H 1 0.355 0.003 . 2 . . . . 117 L QD1 4 15446 1
1151 . 1 1 117 117 LEU HD12 H 1 0.355 0.003 . 2 . . . . 117 L QD1 4 15446 1
1152 . 1 1 117 117 LEU HD13 H 1 0.355 0.003 . 2 . . . . 117 L QD1 4 15446 1
1153 . 1 1 117 117 LEU HD21 H 1 0.612 0.007 . 2 . . . . 117 L QD2 3 15446 1
1154 . 1 1 117 117 LEU HD22 H 1 0.612 0.007 . 2 . . . . 117 L QD2 3 15446 1
1155 . 1 1 117 117 LEU HD23 H 1 0.612 0.007 . 2 . . . . 117 L QD2 3 15446 1
1156 . 1 1 117 117 LEU C C 13 178.551 0.018 . 1 . . . . 117 L C 2 15446 1
1157 . 1 1 117 117 LEU CA C 13 58.626 0.062 . 1 . . . . 117 L CA 8 15446 1
1158 . 1 1 117 117 LEU CB C 13 41.704 0.050 . 1 . . . . 117 L CB 6 15446 1
1159 . 1 1 117 117 LEU CD1 C 13 22.196 0.022 . 2 . . . . 117 L CD1 3 15446 1
1160 . 1 1 117 117 LEU CD2 C 13 21.775 0.4 . 2 . . . . 117 L CD2 1 15446 1
1161 . 1 1 117 117 LEU CG C 13 26.646 0.4 . 1 . . . . 117 L CG 1 15446 1
1162 . 1 1 117 117 LEU N N 15 118.937 0.078 . 1 . . . . 117 L N 22 15446 1
1163 . 1 1 118 118 ARG H H 1 8.210 0.005 . 1 . . . . 118 R H 33 15446 1
1164 . 1 1 118 118 ARG HA H 1 4.242 0.007 . 1 . . . . 118 R HA 4 15446 1
1165 . 1 1 118 118 ARG HB2 H 1 1.898 0.05 . 2 . . . . 118 R HB2 2 15446 1
1166 . 1 1 118 118 ARG HB3 H 1 2.260 0.05 . 2 . . . . 118 R HB3 2 15446 1
1167 . 1 1 118 118 ARG HE H 1 7.000 0.002 . 1 . . . . 118 R HE 3 15446 1
1168 . 1 1 118 118 ARG C C 13 180.137 0.007 . 1 . . . . 118 R C 2 15446 1
1169 . 1 1 118 118 ARG CA C 13 60.551 0.027 . 1 . . . . 118 R CA 8 15446 1
1170 . 1 1 118 118 ARG CB C 13 31.133 0.684 . 1 . . . . 118 R CB 4 15446 1
1171 . 1 1 118 118 ARG CD C 13 44.010 0.102 . 1 . . . . 118 R CD 2 15446 1
1172 . 1 1 118 118 ARG CG C 13 28.234 0.076 . 1 . . . . 118 R CG 2 15446 1
1173 . 1 1 118 118 ARG N N 15 117.440 0.090 . 1 . . . . 118 R N 30 15446 1
1174 . 1 1 118 118 ARG NE N 15 84.310 0.4 . 1 . . . . 118 R NE 3 15446 1
1175 . 1 1 119 119 VAL H H 1 8.028 0.009 . 1 . . . . 119 V H 23 15446 1
1176 . 1 1 119 119 VAL HA H 1 3.959 0.009 . 1 . . . . 119 V HA 6 15446 1
1177 . 1 1 119 119 VAL HB H 1 2.329 0.005 . 1 . . . . 119 V HB 6 15446 1
1178 . 1 1 119 119 VAL HG11 H 1 1.080 0.002 . 2 . . . . 119 V QG1 9 15446 1
1179 . 1 1 119 119 VAL HG12 H 1 1.080 0.002 . 2 . . . . 119 V QG1 9 15446 1
1180 . 1 1 119 119 VAL HG13 H 1 1.080 0.002 . 2 . . . . 119 V QG1 9 15446 1
1181 . 1 1 119 119 VAL HG21 H 1 0.935 0.006 . 2 . . . . 119 V QG2 11 15446 1
1182 . 1 1 119 119 VAL HG22 H 1 0.935 0.006 . 2 . . . . 119 V QG2 11 15446 1
1183 . 1 1 119 119 VAL HG23 H 1 0.935 0.006 . 2 . . . . 119 V QG2 11 15446 1
1184 . 1 1 119 119 VAL C C 13 177.848 0.040 . 1 . . . . 119 V C 3 15446 1
1185 . 1 1 119 119 VAL CA C 13 66.464 0.099 . 1 . . . . 119 V CA 8 15446 1
1186 . 1 1 119 119 VAL CB C 13 32.127 0.040 . 1 . . . . 119 V CB 4 15446 1
1187 . 1 1 119 119 VAL CG1 C 13 23.237 0.022 . 2 . . . . 119 V CG1 8 15446 1
1188 . 1 1 119 119 VAL CG2 C 13 22.315 0.113 . 2 . . . . 119 V CG2 8 15446 1
1189 . 1 1 119 119 VAL N N 15 119.957 0.102 . 1 . . . . 119 V N 21 15446 1
1190 . 1 1 120 120 LEU H H 1 8.450 0.006 . 1 . . . . 120 L H 28 15446 1
1191 . 1 1 120 120 LEU HA H 1 3.973 0.006 . 1 . . . . 120 L HA 5 15446 1
1192 . 1 1 120 120 LEU HB2 H 1 1.521 0.014 . 2 . . . . 120 L HB2 3 15446 1
1193 . 1 1 120 120 LEU HB3 H 1 1.891 0.012 . 2 . . . . 120 L HB3 4 15446 1
1194 . 1 1 120 120 LEU HD11 H 1 0.819 0.003 . 2 . . . . 120 L QD1 4 15446 1
1195 . 1 1 120 120 LEU HD12 H 1 0.819 0.003 . 2 . . . . 120 L QD1 4 15446 1
1196 . 1 1 120 120 LEU HD13 H 1 0.819 0.003 . 2 . . . . 120 L QD1 4 15446 1
1197 . 1 1 120 120 LEU C C 13 176.665 0.008 . 1 . . . . 120 L C 2 15446 1
1198 . 1 1 120 120 LEU CA C 13 56.699 0.032 . 1 . . . . 120 L CA 8 15446 1
1199 . 1 1 120 120 LEU CB C 13 41.790 0.029 . 1 . . . . 120 L CB 6 15446 1
1200 . 1 1 120 120 LEU CD1 C 13 23.500 0.040 . 2 . . . . 120 L CD1 3 15446 1
1201 . 1 1 120 120 LEU CG C 13 27.367 0.4 . 1 . . . . 120 L CG 1 15446 1
1202 . 1 1 120 120 LEU N N 15 120.613 0.093 . 1 . . . . 120 L N 26 15446 1
1203 . 1 1 121 121 ASP H H 1 7.973 0.005 . 1 . . . . 121 D H 32 15446 1
1204 . 1 1 121 121 ASP HA H 1 4.189 0.015 . 1 . . . . 121 D HA 6 15446 1
1205 . 1 1 121 121 ASP HB2 H 1 2.759 0.014 . 2 . . . . 121 D HB2 5 15446 1
1206 . 1 1 121 121 ASP HB3 H 1 2.942 0.007 . 2 . . . . 121 D HB3 5 15446 1
1207 . 1 1 121 121 ASP C C 13 177.560 0.021 . 1 . . . . 121 D C 2 15446 1
1208 . 1 1 121 121 ASP CA C 13 56.941 0.049 . 1 . . . . 121 D CA 8 15446 1
1209 . 1 1 121 121 ASP CB C 13 42.662 0.008 . 1 . . . . 121 D CB 6 15446 1
1210 . 1 1 121 121 ASP N N 15 114.945 0.053 . 1 . . . . 121 D N 30 15446 1
1211 . 1 1 122 122 LYS H H 1 6.704 0.005 . 1 . . . . 122 K H 30 15446 1
1212 . 1 1 122 122 LYS HA H 1 4.063 0.002 . 1 . . . . 122 K HA 5 15446 1
1213 . 1 1 122 122 LYS HB2 H 1 1.390 0.006 . 2 . . . . 122 K HB2 4 15446 1
1214 . 1 1 122 122 LYS HB3 H 1 1.663 0.004 . 2 . . . . 122 K HB3 3 15446 1
1215 . 1 1 122 122 LYS HD3 H 1 1.615 0.05 . 2 . . . . 122 K HD3 2 15446 1
1216 . 1 1 122 122 LYS HE3 H 1 2.971 0.05 . 2 . . . . 122 K HE3 2 15446 1
1217 . 1 1 122 122 LYS HG3 H 1 1.145 0.05 . 2 . . . . 122 K HG3 2 15446 1
1218 . 1 1 122 122 LYS C C 13 176.570 0.040 . 1 . . . . 122 K C 3 15446 1
1219 . 1 1 122 122 LYS CA C 13 56.662 0.036 . 1 . . . . 122 K CA 8 15446 1
1220 . 1 1 122 122 LYS CB C 13 34.002 0.025 . 1 . . . . 122 K CB 6 15446 1
1221 . 1 1 122 122 LYS CD C 13 28.509 0.4 . 1 . . . . 122 K CD 2 15446 1
1222 . 1 1 122 122 LYS CE C 13 42.161 0.4 . 1 . . . . 122 K CE 2 15446 1
1223 . 1 1 122 122 LYS CG C 13 25.451 0.4 . 1 . . . . 122 K CG 2 15446 1
1224 . 1 1 122 122 LYS N N 15 113.143 0.069 . 1 . . . . 122 K N 28 15446 1
1225 . 1 1 123 123 HIS H H 1 8.150 0.006 . 1 . . . . 123 H H 36 15446 1
1226 . 1 1 123 123 HIS HA H 1 5.142 0.009 . 1 . . . . 123 H HA 6 15446 1
1227 . 1 1 123 123 HIS HD2 H 1 7.399 0.001 . 1 . . . . 123 H HD2 4 15446 1
1228 . 1 1 123 123 HIS C C 13 171.852 0.4 . 1 . . . . 123 H C 1 15446 1
1229 . 1 1 123 123 HIS CA C 13 52.181 0.023 . 1 . . . . 123 H CA 3 15446 1
1230 . 1 1 123 123 HIS CB C 13 28.020 0.003 . 1 . . . . 123 H CB 2 15446 1
1231 . 1 1 123 123 HIS CD2 C 13 121.579 0.028 . 1 . . . . 123 H CD2 3 15446 1
1232 . 1 1 123 123 HIS N N 15 116.229 0.054 . 1 . . . . 123 H N 34 15446 1
1233 . 1 1 124 124 PRO HA H 1 4.475 0.006 . 1 . . . . 124 P HA 7 15446 1
1234 . 1 1 124 124 PRO HB2 H 1 1.963 0.05 . 2 . . . . 124 P HB2 2 15446 1
1235 . 1 1 124 124 PRO HB3 H 1 2.192 0.011 . 2 . . . . 124 P HB3 3 15446 1
1236 . 1 1 124 124 PRO HG3 H 1 1.989 0.05 . 2 . . . . 124 P HG3 2 15446 1
1237 . 1 1 124 124 PRO C C 13 178.941 0.005 . 1 . . . . 124 P C 2 15446 1
1238 . 1 1 124 124 PRO CA C 13 65.649 0.091 . 1 . . . . 124 P CA 6 15446 1
1239 . 1 1 124 124 PRO CB C 13 31.481 0.097 . 1 . . . . 124 P CB 5 15446 1
1240 . 1 1 124 124 PRO CD C 13 49.831 0.4 . 1 . . . . 124 P CD 1 15446 1
1241 . 1 1 124 124 PRO CG C 13 27.456 0.4 . 1 . . . . 124 P CG 2 15446 1
1242 . 1 1 125 125 GLU H H 1 10.115 0.007 . 1 . . . . 125 E H 29 15446 1
1243 . 1 1 125 125 GLU HA H 1 4.241 0.015 . 1 . . . . 125 E HA 5 15446 1
1244 . 1 1 125 125 GLU HB3 H 1 2.163 0.007 . 2 . . . . 125 E HB3 3 15446 1
1245 . 1 1 125 125 GLU C C 13 178.140 0.007 . 1 . . . . 125 E C 2 15446 1
1246 . 1 1 125 125 GLU CA C 13 58.337 0.018 . 1 . . . . 125 E CA 8 15446 1
1247 . 1 1 125 125 GLU CB C 13 27.164 0.044 . 1 . . . . 125 E CB 5 15446 1
1248 . 1 1 125 125 GLU CG C 13 35.155 0.4 . 1 . . . . 125 E CG 1 15446 1
1249 . 1 1 125 125 GLU N N 15 121.240 0.038 . 1 . . . . 125 E N 28 15446 1
1250 . 1 1 126 126 LEU H H 1 7.975 0.007 . 1 . . . . 126 L H 26 15446 1
1251 . 1 1 126 126 LEU HA H 1 4.141 0.004 . 1 . . . . 126 L HA 8 15446 1
1252 . 1 1 126 126 LEU HB2 H 1 1.356 0.004 . 2 . . . . 126 L HB2 5 15446 1
1253 . 1 1 126 126 LEU HB3 H 1 1.826 0.003 . 2 . . . . 126 L HB3 5 15446 1
1254 . 1 1 126 126 LEU HD11 H 1 0.442 0.05 . 2 . . . . 126 L QD1 2 15446 1
1255 . 1 1 126 126 LEU HD12 H 1 0.442 0.05 . 2 . . . . 126 L QD1 2 15446 1
1256 . 1 1 126 126 LEU HD13 H 1 0.442 0.05 . 2 . . . . 126 L QD1 2 15446 1
1257 . 1 1 126 126 LEU C C 13 178.119 0.002 . 1 . . . . 126 L C 2 15446 1
1258 . 1 1 126 126 LEU CA C 13 56.048 0.042 . 1 . . . . 126 L CA 8 15446 1
1259 . 1 1 126 126 LEU CB C 13 41.055 0.021 . 1 . . . . 126 L CB 4 15446 1
1260 . 1 1 126 126 LEU CD1 C 13 22.005 0.4 . 2 . . . . 126 L CD1 2 15446 1
1261 . 1 1 126 126 LEU CG C 13 26.652 0.4 . 1 . . . . 126 L CG 1 15446 1
1262 . 1 1 126 126 LEU N N 15 120.767 0.128 . 1 . . . . 126 L N 24 15446 1
1263 . 1 1 127 127 LEU H H 1 7.697 0.005 . 1 . . . . 127 L H 30 15446 1
1264 . 1 1 127 127 LEU HA H 1 3.868 0.010 . 1 . . . . 127 L HA 7 15446 1
1265 . 1 1 127 127 LEU HB2 H 1 1.618 0.006 . 2 . . . . 127 L HB2 5 15446 1
1266 . 1 1 127 127 LEU HB3 H 1 1.908 0.010 . 2 . . . . 127 L HB3 5 15446 1
1267 . 1 1 127 127 LEU HD11 H 1 1.024 0.05 . 2 . . . . 127 L QD1 2 15446 1
1268 . 1 1 127 127 LEU HD12 H 1 1.024 0.05 . 2 . . . . 127 L QD1 2 15446 1
1269 . 1 1 127 127 LEU HD13 H 1 1.024 0.05 . 2 . . . . 127 L QD1 2 15446 1
1270 . 1 1 127 127 LEU HD21 H 1 0.891 0.005 . 2 . . . . 127 L QD2 3 15446 1
1271 . 1 1 127 127 LEU HD22 H 1 0.891 0.005 . 2 . . . . 127 L QD2 3 15446 1
1272 . 1 1 127 127 LEU HD23 H 1 0.891 0.005 . 2 . . . . 127 L QD2 3 15446 1
1273 . 1 1 127 127 LEU C C 13 177.746 0.054 . 1 . . . . 127 L C 3 15446 1
1274 . 1 1 127 127 LEU CA C 13 57.935 0.021 . 1 . . . . 127 L CA 8 15446 1
1275 . 1 1 127 127 LEU CB C 13 41.711 0.033 . 1 . . . . 127 L CB 6 15446 1
1276 . 1 1 127 127 LEU CD1 C 13 23.215 0.4 . 2 . . . . 127 L CD1 2 15446 1
1277 . 1 1 127 127 LEU CD2 C 13 27.015 0.022 . 2 . . . . 127 L CD2 3 15446 1
1278 . 1 1 127 127 LEU N N 15 120.827 0.071 . 1 . . . . 127 L N 28 15446 1
1279 . 1 1 128 128 ASN H H 1 7.581 0.005 . 1 . . . . 128 N H 35 15446 1
1280 . 1 1 128 128 ASN HA H 1 4.383 0.009 . 1 . . . . 128 N HA 8 15446 1
1281 . 1 1 128 128 ASN HB3 H 1 2.847 0.007 . 2 . . . . 128 N HB3 5 15446 1
1282 . 1 1 128 128 ASN HD21 H 1 7.580 0.05 . 2 . . . . 128 N HD21 1 15446 1
1283 . 1 1 128 128 ASN HD22 H 1 7.019 0.05 . 2 . . . . 128 N HD22 1 15446 1
1284 . 1 1 128 128 ASN C C 13 176.635 0.014 . 1 . . . . 128 N C 2 15446 1
1285 . 1 1 128 128 ASN CA C 13 55.487 0.142 . 1 . . . . 128 N CA 8 15446 1
1286 . 1 1 128 128 ASN CB C 13 38.442 0.094 . 1 . . . . 128 N CB 5 15446 1
1287 . 1 1 128 128 ASN N N 15 112.180 0.057 . 1 . . . . 128 N N 33 15446 1
1288 . 1 1 128 128 ASN ND2 N 15 113.156 0.007 . 1 . . . . 128 N ND2 2 15446 1
1289 . 1 1 129 129 GLU H H 1 7.711 0.006 . 1 . . . . 129 E H 27 15446 1
1290 . 1 1 129 129 GLU HA H 1 4.286 0.008 . 1 . . . . 129 E HA 7 15446 1
1291 . 1 1 129 129 GLU HB3 H 1 2.190 0.004 . 2 . . . . 129 E HB3 3 15446 1
1292 . 1 1 129 129 GLU HG3 H 1 2.321 0.05 . 2 . . . . 129 E HG3 2 15446 1
1293 . 1 1 129 129 GLU C C 13 177.791 0.004 . 1 . . . . 129 E C 2 15446 1
1294 . 1 1 129 129 GLU CA C 13 57.784 0.080 . 1 . . . . 129 E CA 8 15446 1
1295 . 1 1 129 129 GLU CB C 13 30.362 0.036 . 1 . . . . 129 E CB 5 15446 1
1296 . 1 1 129 129 GLU CG C 13 36.628 0.4 . 1 . . . . 129 E CG 2 15446 1
1297 . 1 1 129 129 GLU N N 15 115.847 0.137 . 1 . . . . 129 E N 26 15446 1
1298 . 1 1 130 130 ILE H H 1 7.231 0.004 . 1 . . . . 130 I H 28 15446 1
1299 . 1 1 130 130 ILE HA H 1 4.570 0.004 . 1 . . . . 130 I HA 6 15446 1
1300 . 1 1 130 130 ILE HB H 1 2.048 0.005 . 1 . . . . 130 I HB 4 15446 1
1301 . 1 1 130 130 ILE HD11 H 1 0.662 0.004 . 2 . . . . 130 I QD1 4 15446 1
1302 . 1 1 130 130 ILE HD12 H 1 0.662 0.004 . 2 . . . . 130 I QD1 4 15446 1
1303 . 1 1 130 130 ILE HD13 H 1 0.662 0.004 . 2 . . . . 130 I QD1 4 15446 1
1304 . 1 1 130 130 ILE HG12 H 1 1.295 0.05 . 2 . . . . 130 I HG12 2 15446 1
1305 . 1 1 130 130 ILE HG21 H 1 0.827 0.002 . 2 . . . . 130 I QG2 3 15446 1
1306 . 1 1 130 130 ILE HG22 H 1 0.827 0.002 . 2 . . . . 130 I QG2 3 15446 1
1307 . 1 1 130 130 ILE HG23 H 1 0.827 0.002 . 2 . . . . 130 I QG2 3 15446 1
1308 . 1 1 130 130 ILE C C 13 174.027 0.030 . 1 . . . . 130 I C 3 15446 1
1309 . 1 1 130 130 ILE CA C 13 60.806 0.027 . 1 . . . . 130 I CA 8 15446 1
1310 . 1 1 130 130 ILE CB C 13 39.618 0.049 . 1 . . . . 130 I CB 5 15446 1
1311 . 1 1 130 130 ILE CD1 C 13 15.659 0.4 . 1 . . . . 130 I CD1 2 15446 1
1312 . 1 1 130 130 ILE CG1 C 13 26.290 0.4 . 1 . . . . 130 I CG1 2 15446 1
1313 . 1 1 130 130 ILE CG2 C 13 18.812 0.4 . 1 . . . . 130 I CG2 2 15446 1
1314 . 1 1 130 130 ILE N N 15 109.105 0.105 . 1 . . . . 130 I N 26 15446 1
1315 . 1 1 131 131 ARG H H 1 7.132 0.004 . 1 . . . . 131 R H 32 15446 1
1316 . 1 1 131 131 ARG HA H 1 3.939 0.001 . 1 . . . . 131 R HA 2 15446 1
1317 . 1 1 131 131 ARG HE H 1 7.127 0.05 . 1 . . . . 131 R HE 1 15446 1
1318 . 1 1 131 131 ARG C C 13 180.448 0.4 . 1 . . . . 131 R C 1 15446 1
1319 . 1 1 131 131 ARG CA C 13 58.463 0.017 . 1 . . . . 131 R CA 3 15446 1
1320 . 1 1 131 131 ARG CB C 13 31.255 0.4 . 1 . . . . 131 R CB 1 15446 1
1321 . 1 1 131 131 ARG N N 15 126.254 0.026 . 1 . . . . 131 R N 31 15446 1
1322 . 1 1 131 131 ARG NE N 15 83.937 0.4 . 1 . . . . 131 R NE 1 15446 1
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