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 17002
_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 0.02
_Assigned_chem_shift_list.Chem_shift_13C_err 0.13
_Assigned_chem_shift_list.Chem_shift_15N_err 0.12
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 17002 1
2 '4D APSY - HACANH' . . . 17002 1
3 '5D APSY - HACACONH' . . . 17002 1
4 '5D APSY - CBCACONH' . . . 17002 1
5 '15N Resolved [1H,1H]-NOESY' . . . 17002 1
6 '13Cali Resolved [1H,1H]-NOESY' . . . 17002 1
7 '13Caro Resolved [1H,1H]-NOESY' . . . 17002 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $UNIO . . 17002 1
3 $TOPSPIN . . 17002 1
5 $CARA . . 17002 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 2 2 MET HA H 1 4.368 0.02 . 1 . . . . 2 M HA . 17002 1
2 . 1 1 2 2 MET HB2 H 1 1.937 0.02 . 2 . . . . 2 M QB . 17002 1
3 . 1 1 2 2 MET HB3 H 1 1.937 0.02 . 2 . . . . 2 M QB . 17002 1
4 . 1 1 2 2 MET HE1 H 1 2.008 0.02 . 1 . . . . 2 M QE . 17002 1
5 . 1 1 2 2 MET HE2 H 1 2.008 0.02 . 1 . . . . 2 M QE . 17002 1
6 . 1 1 2 2 MET HE3 H 1 2.008 0.02 . 1 . . . . 2 M QE . 17002 1
7 . 1 1 2 2 MET HG2 H 1 2.486 0.02 . 2 . . . . 2 M QG . 17002 1
8 . 1 1 2 2 MET HG3 H 1 2.486 0.02 . 2 . . . . 2 M QG . 17002 1
9 . 1 1 2 2 MET C C 13 176.562 0.13 . 1 . . . . 2 M C . 17002 1
10 . 1 1 2 2 MET CA C 13 56.205 0.13 . 1 . . . . 2 M CA . 17002 1
11 . 1 1 2 2 MET CB C 13 32.733 0.13 . 1 . . . . 2 M CB . 17002 1
12 . 1 1 2 2 MET CE C 13 17.362 0.13 . 1 . . . . 2 M CE . 17002 1
13 . 1 1 2 2 MET CG C 13 32.309 0.13 . 1 . . . . 2 M CG . 17002 1
14 . 1 1 3 3 GLN H H 1 8.637 0.02 . 1 . . . . 3 Q H . 17002 1
15 . 1 1 3 3 GLN HA H 1 4.115 0.02 . 1 . . . . 3 Q HA . 17002 1
16 . 1 1 3 3 GLN HB2 H 1 1.935 0.02 . 2 . . . . 3 Q QB . 17002 1
17 . 1 1 3 3 GLN HB3 H 1 1.935 0.02 . 2 . . . . 3 Q QB . 17002 1
18 . 1 1 3 3 GLN HE21 H 1 6.749 0.02 . 2 . . . . 3 Q HE21 . 17002 1
19 . 1 1 3 3 GLN HE22 H 1 7.594 0.02 . 2 . . . . 3 Q HE22 . 17002 1
20 . 1 1 3 3 GLN HG2 H 1 2.258 0.02 . 2 . . . . 3 Q HG2 . 17002 1
21 . 1 1 3 3 GLN HG3 H 1 2.214 0.02 . 2 . . . . 3 Q HG3 . 17002 1
22 . 1 1 3 3 GLN C C 13 176.589 0.13 . 1 . . . . 3 Q C . 17002 1
23 . 1 1 3 3 GLN CA C 13 57.311 0.13 . 1 . . . . 3 Q CA . 17002 1
24 . 1 1 3 3 GLN CB C 13 28.406 0.13 . 1 . . . . 3 Q CB . 17002 1
25 . 1 1 3 3 GLN CG C 13 33.580 0.13 . 1 . . . . 3 Q CG . 17002 1
26 . 1 1 3 3 GLN N N 15 121.383 0.12 . 1 . . . . 3 Q N . 17002 1
27 . 1 1 3 3 GLN NE2 N 15 112.299 0.12 . 1 . . . . 3 Q NE2 . 17002 1
28 . 1 1 4 4 PHE H H 1 8.118 0.02 . 1 . . . . 4 F H . 17002 1
29 . 1 1 4 4 PHE HA H 1 4.444 0.02 . 1 . . . . 4 F HA . 17002 1
30 . 1 1 4 4 PHE HB2 H 1 3.170 0.02 . 2 . . . . 4 F HB2 . 17002 1
31 . 1 1 4 4 PHE HB3 H 1 3.071 0.02 . 2 . . . . 4 F HB3 . 17002 1
32 . 1 1 4 4 PHE HD1 H 1 7.217 0.02 . 3 . . . . 4 F QD . 17002 1
33 . 1 1 4 4 PHE HD2 H 1 7.217 0.02 . 3 . . . . 4 F QD . 17002 1
34 . 1 1 4 4 PHE HE1 H 1 7.312 0.02 . 3 . . . . 4 F QE . 17002 1
35 . 1 1 4 4 PHE HE2 H 1 7.312 0.02 . 3 . . . . 4 F QE . 17002 1
36 . 1 1 4 4 PHE C C 13 177.581 0.13 . 1 . . . . 4 F C . 17002 1
37 . 1 1 4 4 PHE CA C 13 59.409 0.13 . 1 . . . . 4 F CA . 17002 1
38 . 1 1 4 4 PHE CB C 13 38.853 0.13 . 1 . . . . 4 F CB . 17002 1
39 . 1 1 4 4 PHE CD1 C 13 131.882 0.13 . 3 . . . . 4 F CD1 . 17002 1
40 . 1 1 4 4 PHE CE1 C 13 131.818 0.13 . 3 . . . . 4 F CE1 . 17002 1
41 . 1 1 4 4 PHE N N 15 119.988 0.12 . 1 . . . . 4 F N . 17002 1
42 . 1 1 5 5 LYS H H 1 8.133 0.02 . 1 . . . . 5 K H . 17002 1
43 . 1 1 5 5 LYS HA H 1 4.021 0.02 . 1 . . . . 5 K HA . 17002 1
44 . 1 1 5 5 LYS HB2 H 1 1.759 0.02 . 2 . . . . 5 K QB . 17002 1
45 . 1 1 5 5 LYS HB3 H 1 1.759 0.02 . 2 . . . . 5 K QB . 17002 1
46 . 1 1 5 5 LYS HD2 H 1 1.515 0.02 . 2 . . . . 5 K HD2 . 17002 1
47 . 1 1 5 5 LYS HD3 H 1 1.642 0.02 . 2 . . . . 5 K HD3 . 17002 1
48 . 1 1 5 5 LYS HE2 H 1 2.930 0.02 . 2 . . . . 5 K QE . 17002 1
49 . 1 1 5 5 LYS HE3 H 1 2.930 0.02 . 2 . . . . 5 K QE . 17002 1
50 . 1 1 5 5 LYS HG2 H 1 1.480 0.02 . 2 . . . . 5 K HG2 . 17002 1
51 . 1 1 5 5 LYS HG3 H 1 1.348 0.02 . 2 . . . . 5 K HG3 . 17002 1
52 . 1 1 5 5 LYS C C 13 179.091 0.13 . 1 . . . . 5 K C . 17002 1
53 . 1 1 5 5 LYS CA C 13 59.002 0.13 . 1 . . . . 5 K CA . 17002 1
54 . 1 1 5 5 LYS CB C 13 32.738 0.13 . 1 . . . . 5 K CB . 17002 1
55 . 1 1 5 5 LYS CD C 13 29.692 0.13 . 1 . . . . 5 K CD . 17002 1
56 . 1 1 5 5 LYS CE C 13 42.367 0.13 . 1 . . . . 5 K CE . 17002 1
57 . 1 1 5 5 LYS CG C 13 25.752 0.13 . 1 . . . . 5 K CG . 17002 1
58 . 1 1 5 5 LYS N N 15 120.881 0.12 . 1 . . . . 5 K N . 17002 1
59 . 1 1 6 6 ALA H H 1 8.419 0.02 . 1 . . . . 6 A H . 17002 1
60 . 1 1 6 6 ALA HA H 1 3.812 0.02 . 1 . . . . 6 A HA . 17002 1
61 . 1 1 6 6 ALA HB1 H 1 1.299 0.02 . 1 . . . . 6 A QB . 17002 1
62 . 1 1 6 6 ALA HB2 H 1 1.299 0.02 . 1 . . . . 6 A QB . 17002 1
63 . 1 1 6 6 ALA HB3 H 1 1.299 0.02 . 1 . . . . 6 A QB . 17002 1
64 . 1 1 6 6 ALA C C 13 178.665 0.13 . 1 . . . . 6 A C . 17002 1
65 . 1 1 6 6 ALA CA C 13 55.370 0.13 . 1 . . . . 6 A CA . 17002 1
66 . 1 1 6 6 ALA CB C 13 18.080 0.13 . 1 . . . . 6 A CB . 17002 1
67 . 1 1 6 6 ALA N N 15 123.313 0.12 . 1 . . . . 6 A N . 17002 1
68 . 1 1 7 7 GLU H H 1 8.247 0.02 . 1 . . . . 7 E H . 17002 1
69 . 1 1 7 7 GLU HA H 1 3.753 0.02 . 1 . . . . 7 E HA . 17002 1
70 . 1 1 7 7 GLU HB2 H 1 2.005 0.02 . 2 . . . . 7 E QB . 17002 1
71 . 1 1 7 7 GLU HB3 H 1 2.005 0.02 . 2 . . . . 7 E QB . 17002 1
72 . 1 1 7 7 GLU HG2 H 1 2.320 0.02 . 2 . . . . 7 E QG . 17002 1
73 . 1 1 7 7 GLU HG3 H 1 2.320 0.02 . 2 . . . . 7 E QG . 17002 1
74 . 1 1 7 7 GLU C C 13 178.916 0.13 . 1 . . . . 7 E C . 17002 1
75 . 1 1 7 7 GLU CA C 13 59.749 0.13 . 1 . . . . 7 E CA . 17002 1
76 . 1 1 7 7 GLU CB C 13 29.177 0.13 . 1 . . . . 7 E CB . 17002 1
77 . 1 1 7 7 GLU CG C 13 36.243 0.13 . 1 . . . . 7 E CG . 17002 1
78 . 1 1 7 7 GLU N N 15 117.928 0.12 . 1 . . . . 7 E N . 17002 1
79 . 1 1 8 8 ALA H H 1 7.774 0.02 . 1 . . . . 8 A H . 17002 1
80 . 1 1 8 8 ALA HA H 1 4.289 0.02 . 1 . . . . 8 A HA . 17002 1
81 . 1 1 8 8 ALA HB1 H 1 1.394 0.02 . 1 . . . . 8 A QB . 17002 1
82 . 1 1 8 8 ALA HB2 H 1 1.394 0.02 . 1 . . . . 8 A QB . 17002 1
83 . 1 1 8 8 ALA HB3 H 1 1.394 0.02 . 1 . . . . 8 A QB . 17002 1
84 . 1 1 8 8 ALA C C 13 180.856 0.13 . 1 . . . . 8 A C . 17002 1
85 . 1 1 8 8 ALA CA C 13 55.160 0.13 . 1 . . . . 8 A CA . 17002 1
86 . 1 1 8 8 ALA CB C 13 18.062 0.13 . 1 . . . . 8 A CB . 17002 1
87 . 1 1 8 8 ALA N N 15 121.431 0.12 . 1 . . . . 8 A N . 17002 1
88 . 1 1 9 9 ARG H H 1 7.909 0.02 . 1 . . . . 9 R H . 17002 1
89 . 1 1 9 9 ARG HA H 1 4.197 0.02 . 1 . . . . 9 R HA . 17002 1
90 . 1 1 9 9 ARG HB2 H 1 1.955 0.02 . 2 . . . . 9 R HB2 . 17002 1
91 . 1 1 9 9 ARG HB3 H 1 1.861 0.02 . 2 . . . . 9 R HB3 . 17002 1
92 . 1 1 9 9 ARG HD2 H 1 3.490 0.02 . 2 . . . . 9 R HD2 . 17002 1
93 . 1 1 9 9 ARG HD3 H 1 3.166 0.02 . 2 . . . . 9 R HD3 . 17002 1
94 . 1 1 9 9 ARG HE H 1 7.674 0.02 . 1 . . . . 9 R HE . 17002 1
95 . 1 1 9 9 ARG HG2 H 1 1.252 0.02 . 2 . . . . 9 R QG . 17002 1
96 . 1 1 9 9 ARG HG3 H 1 1.252 0.02 . 2 . . . . 9 R QG . 17002 1
97 . 1 1 9 9 ARG C C 13 177.445 0.13 . 1 . . . . 9 R C . 17002 1
98 . 1 1 9 9 ARG CA C 13 56.831 0.13 . 1 . . . . 9 R CA . 17002 1
99 . 1 1 9 9 ARG CB C 13 27.944 0.13 . 1 . . . . 9 R CB . 17002 1
100 . 1 1 9 9 ARG CD C 13 39.778 0.13 . 1 . . . . 9 R CD . 17002 1
101 . 1 1 9 9 ARG CG C 13 26.770 0.13 . 1 . . . . 9 R CG . 17002 1
102 . 1 1 9 9 ARG N N 15 118.806 0.12 . 1 . . . . 9 R N . 17002 1
103 . 1 1 9 9 ARG NE N 15 79.535 0.12 . 1 . . . . 9 R NE . 17002 1
104 . 1 1 10 10 ARG H H 1 8.702 0.02 . 1 . . . . 10 R H . 17002 1
105 . 1 1 10 10 ARG HA H 1 3.526 0.02 . 1 . . . . 10 R HA . 17002 1
106 . 1 1 10 10 ARG HB2 H 1 1.745 0.02 . 2 . . . . 10 R HB2 . 17002 1
107 . 1 1 10 10 ARG HB3 H 1 1.667 0.02 . 2 . . . . 10 R HB3 . 17002 1
108 . 1 1 10 10 ARG HD2 H 1 2.176 0.02 . 2 . . . . 10 R QD . 17002 1
109 . 1 1 10 10 ARG HD3 H 1 2.176 0.02 . 2 . . . . 10 R QD . 17002 1
110 . 1 1 10 10 ARG HE H 1 6.898 0.02 . 1 . . . . 10 R HE . 17002 1
111 . 1 1 10 10 ARG HG2 H 1 1.173 0.02 . 2 . . . . 10 R HG2 . 17002 1
112 . 1 1 10 10 ARG HG3 H 1 1.084 0.02 . 2 . . . . 10 R HG3 . 17002 1
113 . 1 1 10 10 ARG C C 13 178.034 0.13 . 1 . . . . 10 R C . 17002 1
114 . 1 1 10 10 ARG CA C 13 60.644 0.13 . 1 . . . . 10 R CA . 17002 1
115 . 1 1 10 10 ARG CB C 13 27.846 0.13 . 1 . . . . 10 R CB . 17002 1
116 . 1 1 10 10 ARG CD C 13 42.700 0.13 . 1 . . . . 10 R CD . 17002 1
117 . 1 1 10 10 ARG CG C 13 26.283 0.13 . 1 . . . . 10 R CG . 17002 1
118 . 1 1 10 10 ARG N N 15 121.107 0.12 . 1 . . . . 10 R N . 17002 1
119 . 1 1 10 10 ARG NE N 15 82.262 0.12 . 1 . . . . 10 R NE . 17002 1
120 . 1 1 11 11 ASN H H 1 8.027 0.02 . 1 . . . . 11 N H . 17002 1
121 . 1 1 11 11 ASN HA H 1 4.482 0.02 . 1 . . . . 11 N HA . 17002 1
122 . 1 1 11 11 ASN HB2 H 1 2.957 0.02 . 2 . . . . 11 N HB2 . 17002 1
123 . 1 1 11 11 ASN HB3 H 1 2.330 0.02 . 2 . . . . 11 N HB3 . 17002 1
124 . 1 1 11 11 ASN HD21 H 1 8.160 0.02 . 2 . . . . 11 N HD21 . 17002 1
125 . 1 1 11 11 ASN HD22 H 1 7.617 0.02 . 2 . . . . 11 N HD22 . 17002 1
126 . 1 1 11 11 ASN C C 13 176.748 0.13 . 1 . . . . 11 N C . 17002 1
127 . 1 1 11 11 ASN CA C 13 56.172 0.13 . 1 . . . . 11 N CA . 17002 1
128 . 1 1 11 11 ASN CB C 13 37.792 0.13 . 1 . . . . 11 N CB . 17002 1
129 . 1 1 11 11 ASN N N 15 117.753 0.12 . 1 . . . . 11 N N . 17002 1
130 . 1 1 11 11 ASN ND2 N 15 115.681 0.12 . 1 . . . . 11 N ND2 . 17002 1
131 . 1 1 12 12 LYS H H 1 8.024 0.02 . 1 . . . . 12 K H . 17002 1
132 . 1 1 12 12 LYS HA H 1 3.804 0.02 . 1 . . . . 12 K HA . 17002 1
133 . 1 1 12 12 LYS HB2 H 1 1.990 0.02 . 2 . . . . 12 K HB2 . 17002 1
134 . 1 1 12 12 LYS HB3 H 1 1.852 0.02 . 2 . . . . 12 K HB3 . 17002 1
135 . 1 1 12 12 LYS HD2 H 1 1.565 0.02 . 2 . . . . 12 K QD . 17002 1
136 . 1 1 12 12 LYS HD3 H 1 1.565 0.02 . 2 . . . . 12 K QD . 17002 1
137 . 1 1 12 12 LYS HE2 H 1 2.846 0.02 . 2 . . . . 12 K QE . 17002 1
138 . 1 1 12 12 LYS HE3 H 1 2.846 0.02 . 2 . . . . 12 K QE . 17002 1
139 . 1 1 12 12 LYS HG2 H 1 1.318 0.02 . 2 . . . . 12 K HG2 . 17002 1
140 . 1 1 12 12 LYS HG3 H 1 1.216 0.02 . 2 . . . . 12 K HG3 . 17002 1
141 . 1 1 12 12 LYS C C 13 178.235 0.13 . 1 . . . . 12 K C . 17002 1
142 . 1 1 12 12 LYS CA C 13 60.203 0.13 . 1 . . . . 12 K CA . 17002 1
143 . 1 1 12 12 LYS CB C 13 32.377 0.13 . 1 . . . . 12 K CB . 17002 1
144 . 1 1 12 12 LYS CD C 13 29.540 0.13 . 1 . . . . 12 K CD . 17002 1
145 . 1 1 12 12 LYS CE C 13 42.045 0.13 . 1 . . . . 12 K CE . 17002 1
146 . 1 1 12 12 LYS CG C 13 25.274 0.13 . 1 . . . . 12 K CG . 17002 1
147 . 1 1 12 12 LYS N N 15 123.744 0.12 . 1 . . . . 12 K N . 17002 1
148 . 1 1 13 13 LEU H H 1 8.519 0.02 . 1 . . . . 13 L H . 17002 1
149 . 1 1 13 13 LEU HA H 1 4.003 0.02 . 1 . . . . 13 L HA . 17002 1
150 . 1 1 13 13 LEU HB2 H 1 1.482 0.02 . 2 . . . . 13 L HB2 . 17002 1
151 . 1 1 13 13 LEU HB3 H 1 1.968 0.02 . 2 . . . . 13 L HB3 . 17002 1
152 . 1 1 13 13 LEU HD11 H 1 0.863 0.02 . 2 . . . . 13 L QD1 . 17002 1
153 . 1 1 13 13 LEU HD12 H 1 0.863 0.02 . 2 . . . . 13 L QD1 . 17002 1
154 . 1 1 13 13 LEU HD13 H 1 0.863 0.02 . 2 . . . . 13 L QD1 . 17002 1
155 . 1 1 13 13 LEU HD21 H 1 0.738 0.02 . 2 . . . . 13 L QD2 . 17002 1
156 . 1 1 13 13 LEU HD22 H 1 0.738 0.02 . 2 . . . . 13 L QD2 . 17002 1
157 . 1 1 13 13 LEU HD23 H 1 0.738 0.02 . 2 . . . . 13 L QD2 . 17002 1
158 . 1 1 13 13 LEU HG H 1 1.886 0.02 . 1 . . . . 13 L HG . 17002 1
159 . 1 1 13 13 LEU C C 13 180.656 0.13 . 1 . . . . 13 L C . 17002 1
160 . 1 1 13 13 LEU CA C 13 57.823 0.13 . 1 . . . . 13 L CA . 17002 1
161 . 1 1 13 13 LEU CB C 13 41.763 0.13 . 1 . . . . 13 L CB . 17002 1
162 . 1 1 13 13 LEU CD1 C 13 21.537 0.13 . 2 . . . . 13 L CD1 . 17002 1
163 . 1 1 13 13 LEU CD2 C 13 25.490 0.13 . 2 . . . . 13 L CD2 . 17002 1
164 . 1 1 13 13 LEU CG C 13 26.732 0.13 . 1 . . . . 13 L CG . 17002 1
165 . 1 1 13 13 LEU N N 15 117.266 0.12 . 1 . . . . 13 L N . 17002 1
166 . 1 1 14 14 MET H H 1 8.886 0.02 . 1 . . . . 14 M H . 17002 1
167 . 1 1 14 14 MET HA H 1 4.370 0.02 . 1 . . . . 14 M HA . 17002 1
168 . 1 1 14 14 MET HB2 H 1 2.042 0.02 . 2 . . . . 14 M HB2 . 17002 1
169 . 1 1 14 14 MET HB3 H 1 2.637 0.02 . 2 . . . . 14 M HB3 . 17002 1
170 . 1 1 14 14 MET HE1 H 1 2.176 0.02 . 1 . . . . 14 M QE . 17002 1
171 . 1 1 14 14 MET HE2 H 1 2.176 0.02 . 1 . . . . 14 M QE . 17002 1
172 . 1 1 14 14 MET HE3 H 1 2.176 0.02 . 1 . . . . 14 M QE . 17002 1
173 . 1 1 14 14 MET HG2 H 1 2.644 0.02 . 2 . . . . 14 M HG2 . 17002 1
174 . 1 1 14 14 MET HG3 H 1 2.732 0.02 . 2 . . . . 14 M HG3 . 17002 1
175 . 1 1 14 14 MET C C 13 178.017 0.13 . 1 . . . . 14 M C . 17002 1
176 . 1 1 14 14 MET CA C 13 57.592 0.13 . 1 . . . . 14 M CA . 17002 1
177 . 1 1 14 14 MET CB C 13 31.985 0.13 . 1 . . . . 14 M CB . 17002 1
178 . 1 1 14 14 MET CE C 13 20.800 0.13 . 1 . . . . 14 M CE . 17002 1
179 . 1 1 14 14 MET CG C 13 33.601 0.13 . 1 . . . . 14 M CG . 17002 1
180 . 1 1 14 14 MET N N 15 121.392 0.12 . 1 . . . . 14 M N . 17002 1
181 . 1 1 15 15 GLY H H 1 8.941 0.02 . 1 . . . . 15 G H . 17002 1
182 . 1 1 15 15 GLY HA2 H 1 3.907 0.02 . 2 . . . . 15 G HA2 . 17002 1
183 . 1 1 15 15 GLY HA3 H 1 3.742 0.02 . 2 . . . . 15 G HA3 . 17002 1
184 . 1 1 15 15 GLY C C 13 174.863 0.13 . 1 . . . . 15 G C . 17002 1
185 . 1 1 15 15 GLY CA C 13 48.285 0.13 . 1 . . . . 15 G CA . 17002 1
186 . 1 1 15 15 GLY N N 15 107.398 0.12 . 1 . . . . 15 G N . 17002 1
187 . 1 1 16 16 LEU H H 1 8.573 0.02 . 1 . . . . 16 L H . 17002 1
188 . 1 1 16 16 LEU HA H 1 4.153 0.02 . 1 . . . . 16 L HA . 17002 1
189 . 1 1 16 16 LEU HB2 H 1 1.485 0.02 . 2 . . . . 16 L HB2 . 17002 1
190 . 1 1 16 16 LEU HB3 H 1 1.971 0.02 . 2 . . . . 16 L HB3 . 17002 1
191 . 1 1 16 16 LEU HD11 H 1 0.863 0.02 . 2 . . . . 16 L QD1 . 17002 1
192 . 1 1 16 16 LEU HD12 H 1 0.863 0.02 . 2 . . . . 16 L QD1 . 17002 1
193 . 1 1 16 16 LEU HD13 H 1 0.863 0.02 . 2 . . . . 16 L QD1 . 17002 1
194 . 1 1 16 16 LEU HD21 H 1 0.785 0.02 . 2 . . . . 16 L QD2 . 17002 1
195 . 1 1 16 16 LEU HD22 H 1 0.785 0.02 . 2 . . . . 16 L QD2 . 17002 1
196 . 1 1 16 16 LEU HD23 H 1 0.785 0.02 . 2 . . . . 16 L QD2 . 17002 1
197 . 1 1 16 16 LEU HG H 1 1.785 0.02 . 1 . . . . 16 L HG . 17002 1
198 . 1 1 16 16 LEU C C 13 179.472 0.13 . 1 . . . . 16 L C . 17002 1
199 . 1 1 16 16 LEU CA C 13 58.017 0.13 . 1 . . . . 16 L CA . 17002 1
200 . 1 1 16 16 LEU CB C 13 41.716 0.13 . 1 . . . . 16 L CB . 17002 1
201 . 1 1 16 16 LEU CD1 C 13 26.664 0.13 . 2 . . . . 16 L CD1 . 17002 1
202 . 1 1 16 16 LEU CD2 C 13 22.153 0.13 . 2 . . . . 16 L CD2 . 17002 1
203 . 1 1 16 16 LEU CG C 13 26.753 0.13 . 1 . . . . 16 L CG . 17002 1
204 . 1 1 16 16 LEU N N 15 121.455 0.12 . 1 . . . . 16 L N . 17002 1
205 . 1 1 17 17 TRP H H 1 8.126 0.02 . 1 . . . . 17 W H . 17002 1
206 . 1 1 17 17 TRP HA H 1 4.369 0.02 . 1 . . . . 17 W HA . 17002 1
207 . 1 1 17 17 TRP HB2 H 1 3.682 0.02 . 2 . . . . 17 W HB2 . 17002 1
208 . 1 1 17 17 TRP HB3 H 1 3.302 0.02 . 2 . . . . 17 W HB3 . 17002 1
209 . 1 1 17 17 TRP HD1 H 1 7.370 0.02 . 1 . . . . 17 W HD1 . 17002 1
210 . 1 1 17 17 TRP HE1 H 1 10.150 0.02 . 1 . . . . 17 W HE1 . 17002 1
211 . 1 1 17 17 TRP HE3 H 1 7.727 0.02 . 1 . . . . 17 W HE3 . 17002 1
212 . 1 1 17 17 TRP HH2 H 1 6.647 0.02 . 1 . . . . 17 W HH2 . 17002 1
213 . 1 1 17 17 TRP HZ2 H 1 7.376 0.02 . 1 . . . . 17 W HZ2 . 17002 1
214 . 1 1 17 17 TRP HZ3 H 1 6.703 0.02 . 1 . . . . 17 W HZ3 . 17002 1
215 . 1 1 17 17 TRP C C 13 177.567 0.13 . 1 . . . . 17 W C . 17002 1
216 . 1 1 17 17 TRP CA C 13 62.439 0.13 . 1 . . . . 17 W CA . 17002 1
217 . 1 1 17 17 TRP CB C 13 27.401 0.13 . 1 . . . . 17 W CB . 17002 1
218 . 1 1 17 17 TRP CD1 C 13 127.595 0.13 . 1 . . . . 17 W CD1 . 17002 1
219 . 1 1 17 17 TRP CE3 C 13 121.744 0.13 . 1 . . . . 17 W CE3 . 17002 1
220 . 1 1 17 17 TRP CH2 C 13 122.185 0.13 . 1 . . . . 17 W CH2 . 17002 1
221 . 1 1 17 17 TRP CZ2 C 13 114.634 0.13 . 1 . . . . 17 W CZ2 . 17002 1
222 . 1 1 17 17 TRP CZ3 C 13 119.711 0.13 . 1 . . . . 17 W CZ3 . 17002 1
223 . 1 1 17 17 TRP N N 15 123.634 0.12 . 1 . . . . 17 W N . 17002 1
224 . 1 1 17 17 TRP NE1 N 15 130.361 0.12 . 1 . . . . 17 W NE1 . 17002 1
225 . 1 1 18 18 VAL H H 1 8.952 0.02 . 1 . . . . 18 V H . 17002 1
226 . 1 1 18 18 VAL HA H 1 2.832 0.02 . 1 . . . . 18 V HA . 17002 1
227 . 1 1 18 18 VAL HB H 1 2.346 0.02 . 1 . . . . 18 V HB . 17002 1
228 . 1 1 18 18 VAL HG11 H 1 0.822 0.02 . 2 . . . . 18 V QG1 . 17002 1
229 . 1 1 18 18 VAL HG12 H 1 0.822 0.02 . 2 . . . . 18 V QG1 . 17002 1
230 . 1 1 18 18 VAL HG13 H 1 0.822 0.02 . 2 . . . . 18 V QG1 . 17002 1
231 . 1 1 18 18 VAL HG21 H 1 1.380 0.02 . 2 . . . . 18 V QG2 . 17002 1
232 . 1 1 18 18 VAL HG22 H 1 1.380 0.02 . 2 . . . . 18 V QG2 . 17002 1
233 . 1 1 18 18 VAL HG23 H 1 1.380 0.02 . 2 . . . . 18 V QG2 . 17002 1
234 . 1 1 18 18 VAL C C 13 177.431 0.13 . 1 . . . . 18 V C . 17002 1
235 . 1 1 18 18 VAL CA C 13 66.728 0.13 . 1 . . . . 18 V CA . 17002 1
236 . 1 1 18 18 VAL CB C 13 32.026 0.13 . 1 . . . . 18 V CB . 17002 1
237 . 1 1 18 18 VAL CG1 C 13 21.399 0.13 . 2 . . . . 18 V CG1 . 17002 1
238 . 1 1 18 18 VAL CG2 C 13 24.605 0.13 . 2 . . . . 18 V CG2 . 17002 1
239 . 1 1 18 18 VAL N N 15 118.972 0.12 . 1 . . . . 18 V N . 17002 1
240 . 1 1 19 19 ALA H H 1 8.547 0.02 . 1 . . . . 19 A H . 17002 1
241 . 1 1 19 19 ALA HA H 1 3.268 0.02 . 1 . . . . 19 A HA . 17002 1
242 . 1 1 19 19 ALA HB1 H 1 1.511 0.02 . 1 . . . . 19 A QB . 17002 1
243 . 1 1 19 19 ALA HB2 H 1 1.511 0.02 . 1 . . . . 19 A QB . 17002 1
244 . 1 1 19 19 ALA HB3 H 1 1.511 0.02 . 1 . . . . 19 A QB . 17002 1
245 . 1 1 19 19 ALA C C 13 178.307 0.13 . 1 . . . . 19 A C . 17002 1
246 . 1 1 19 19 ALA CA C 13 55.522 0.13 . 1 . . . . 19 A CA . 17002 1
247 . 1 1 19 19 ALA CB C 13 18.519 0.13 . 1 . . . . 19 A CB . 17002 1
248 . 1 1 19 19 ALA N N 15 118.935 0.12 . 1 . . . . 19 A N . 17002 1
249 . 1 1 20 20 GLU H H 1 7.481 0.02 . 1 . . . . 20 E H . 17002 1
250 . 1 1 20 20 GLU HA H 1 3.968 0.02 . 1 . . . . 20 E HA . 17002 1
251 . 1 1 20 20 GLU HB2 H 1 2.082 0.02 . 2 . . . . 20 E HB2 . 17002 1
252 . 1 1 20 20 GLU HB3 H 1 2.157 0.02 . 2 . . . . 20 E HB3 . 17002 1
253 . 1 1 20 20 GLU HG2 H 1 2.044 0.02 . 2 . . . . 20 E HG2 . 17002 1
254 . 1 1 20 20 GLU HG3 H 1 2.258 0.02 . 2 . . . . 20 E HG3 . 17002 1
255 . 1 1 20 20 GLU C C 13 180.841 0.13 . 1 . . . . 20 E C . 17002 1
256 . 1 1 20 20 GLU CA C 13 59.483 0.13 . 1 . . . . 20 E CA . 17002 1
257 . 1 1 20 20 GLU CB C 13 29.171 0.13 . 1 . . . . 20 E CB . 17002 1
258 . 1 1 20 20 GLU CG C 13 36.243 0.13 . 1 . . . . 20 E CG . 17002 1
259 . 1 1 20 20 GLU N N 15 118.121 0.12 . 1 . . . . 20 E N . 17002 1
260 . 1 1 21 21 VAL H H 1 7.777 0.02 . 1 . . . . 21 V H . 17002 1
261 . 1 1 21 21 VAL HA H 1 3.238 0.02 . 1 . . . . 21 V HA . 17002 1
262 . 1 1 21 21 VAL HB H 1 1.707 0.02 . 1 . . . . 21 V HB . 17002 1
263 . 1 1 21 21 VAL HG11 H 1 -0.099 0.02 . 2 . . . . 21 V QG1 . 17002 1
264 . 1 1 21 21 VAL HG12 H 1 -0.099 0.02 . 2 . . . . 21 V QG1 . 17002 1
265 . 1 1 21 21 VAL HG13 H 1 -0.099 0.02 . 2 . . . . 21 V QG1 . 17002 1
266 . 1 1 21 21 VAL HG21 H 1 0.439 0.02 . 2 . . . . 21 V QG2 . 17002 1
267 . 1 1 21 21 VAL HG22 H 1 0.439 0.02 . 2 . . . . 21 V QG2 . 17002 1
268 . 1 1 21 21 VAL HG23 H 1 0.439 0.02 . 2 . . . . 21 V QG2 . 17002 1
269 . 1 1 21 21 VAL C C 13 178.225 0.13 . 1 . . . . 21 V C . 17002 1
270 . 1 1 21 21 VAL CA C 13 66.207 0.13 . 1 . . . . 21 V CA . 17002 1
271 . 1 1 21 21 VAL CB C 13 30.843 0.13 . 1 . . . . 21 V CB . 17002 1
272 . 1 1 21 21 VAL CG1 C 13 20.993 0.13 . 2 . . . . 21 V CG1 . 17002 1
273 . 1 1 21 21 VAL CG2 C 13 22.306 0.13 . 2 . . . . 21 V CG2 . 17002 1
274 . 1 1 21 21 VAL N N 15 123.559 0.12 . 1 . . . . 21 V N . 17002 1
275 . 1 1 22 22 LEU H H 1 7.856 0.02 . 1 . . . . 22 L H . 17002 1
276 . 1 1 22 22 LEU HA H 1 3.912 0.02 . 1 . . . . 22 L HA . 17002 1
277 . 1 1 22 22 LEU HB2 H 1 1.342 0.02 . 2 . . . . 22 L HB2 . 17002 1
278 . 1 1 22 22 LEU HB3 H 1 1.446 0.02 . 2 . . . . 22 L HB3 . 17002 1
279 . 1 1 22 22 LEU HD11 H 1 0.606 0.02 . 2 . . . . 22 L QD1 . 17002 1
280 . 1 1 22 22 LEU HD12 H 1 0.606 0.02 . 2 . . . . 22 L QD1 . 17002 1
281 . 1 1 22 22 LEU HD13 H 1 0.606 0.02 . 2 . . . . 22 L QD1 . 17002 1
282 . 1 1 22 22 LEU HD21 H 1 0.139 0.02 . 2 . . . . 22 L QD2 . 17002 1
283 . 1 1 22 22 LEU HD22 H 1 0.139 0.02 . 2 . . . . 22 L QD2 . 17002 1
284 . 1 1 22 22 LEU HD23 H 1 0.139 0.02 . 2 . . . . 22 L QD2 . 17002 1
285 . 1 1 22 22 LEU HG H 1 1.477 0.02 . 1 . . . . 22 L HG . 17002 1
286 . 1 1 22 22 LEU C C 13 176.877 0.13 . 1 . . . . 22 L C . 17002 1
287 . 1 1 22 22 LEU CA C 13 54.983 0.13 . 1 . . . . 22 L CA . 17002 1
288 . 1 1 22 22 LEU CB C 13 42.199 0.13 . 1 . . . . 22 L CB . 17002 1
289 . 1 1 22 22 LEU CD1 C 13 22.408 0.13 . 2 . . . . 22 L CD1 . 17002 1
290 . 1 1 22 22 LEU CD2 C 13 25.448 0.13 . 2 . . . . 22 L CD2 . 17002 1
291 . 1 1 22 22 LEU CG C 13 25.681 0.13 . 1 . . . . 22 L CG . 17002 1
292 . 1 1 22 22 LEU N N 15 116.496 0.12 . 1 . . . . 22 L N . 17002 1
293 . 1 1 23 23 GLY H H 1 7.749 0.02 . 1 . . . . 23 G H . 17002 1
294 . 1 1 23 23 GLY HA2 H 1 3.966 0.02 . 2 . . . . 23 G HA2 . 17002 1
295 . 1 1 23 23 GLY HA3 H 1 3.679 0.02 . 2 . . . . 23 G HA3 . 17002 1
296 . 1 1 23 23 GLY C C 13 174.900 0.13 . 1 . . . . 23 G C . 17002 1
297 . 1 1 23 23 GLY CA C 13 45.923 0.13 . 1 . . . . 23 G CA . 17002 1
298 . 1 1 23 23 GLY N N 15 108.618 0.12 . 1 . . . . 23 G N . 17002 1
299 . 1 1 24 24 LYS H H 1 8.183 0.02 . 1 . . . . 24 K H . 17002 1
300 . 1 1 24 24 LYS HA H 1 4.403 0.02 . 1 . . . . 24 K HA . 17002 1
301 . 1 1 24 24 LYS HB2 H 1 1.396 0.02 . 2 . . . . 24 K HB2 . 17002 1
302 . 1 1 24 24 LYS HB3 H 1 1.250 0.02 . 2 . . . . 24 K HB3 . 17002 1
303 . 1 1 24 24 LYS HD2 H 1 1.025 0.02 . 2 . . . . 24 K HD2 . 17002 1
304 . 1 1 24 24 LYS HD3 H 1 1.368 0.02 . 2 . . . . 24 K HD3 . 17002 1
305 . 1 1 24 24 LYS HE2 H 1 2.700 0.02 . 2 . . . . 24 K QE . 17002 1
306 . 1 1 24 24 LYS HE3 H 1 2.700 0.02 . 2 . . . . 24 K QE . 17002 1
307 . 1 1 24 24 LYS HG2 H 1 1.331 0.02 . 2 . . . . 24 K HG2 . 17002 1
308 . 1 1 24 24 LYS HG3 H 1 1.026 0.02 . 2 . . . . 24 K HG3 . 17002 1
309 . 1 1 24 24 LYS C C 13 175.468 0.13 . 1 . . . . 24 K C . 17002 1
310 . 1 1 24 24 LYS CA C 13 55.282 0.13 . 1 . . . . 24 K CA . 17002 1
311 . 1 1 24 24 LYS CB C 13 34.724 0.13 . 1 . . . . 24 K CB . 17002 1
312 . 1 1 24 24 LYS CD C 13 29.725 0.13 . 1 . . . . 24 K CD . 17002 1
313 . 1 1 24 24 LYS CE C 13 42.286 0.13 . 1 . . . . 24 K CE . 17002 1
314 . 1 1 24 24 LYS CG C 13 25.645 0.13 . 1 . . . . 24 K CG . 17002 1
315 . 1 1 24 24 LYS N N 15 119.904 0.12 . 1 . . . . 24 K N . 17002 1
316 . 1 1 25 25 SER H H 1 8.678 0.02 . 1 . . . . 25 S H . 17002 1
317 . 1 1 25 25 SER HA H 1 4.558 0.02 . 1 . . . . 25 S HA . 17002 1
318 . 1 1 25 25 SER HB2 H 1 3.796 0.02 . 2 . . . . 25 S HB2 . 17002 1
319 . 1 1 25 25 SER HB3 H 1 3.727 0.02 . 2 . . . . 25 S HB3 . 17002 1
320 . 1 1 25 25 SER C C 13 174.684 0.13 . 1 . . . . 25 S C . 17002 1
321 . 1 1 25 25 SER CA C 13 57.067 0.13 . 1 . . . . 25 S CA . 17002 1
322 . 1 1 25 25 SER CB C 13 65.800 0.13 . 1 . . . . 25 S CB . 17002 1
323 . 1 1 25 25 SER N N 15 115.768 0.12 . 1 . . . . 25 S N . 17002 1
324 . 1 1 26 26 GLY H H 1 8.760 0.02 . 1 . . . . 26 G H . 17002 1
325 . 1 1 26 26 GLY HA2 H 1 3.915 0.02 . 2 . . . . 26 G HA2 . 17002 1
326 . 1 1 26 26 GLY HA3 H 1 3.752 0.02 . 2 . . . . 26 G HA3 . 17002 1
327 . 1 1 26 26 GLY C C 13 176.120 0.13 . 1 . . . . 26 G C . 17002 1
328 . 1 1 26 26 GLY CA C 13 47.042 0.13 . 1 . . . . 26 G CA . 17002 1
329 . 1 1 26 26 GLY N N 15 109.110 0.12 . 1 . . . . 26 G N . 17002 1
330 . 1 1 27 27 ASP H H 1 9.014 0.02 . 1 . . . . 27 D H . 17002 1
331 . 1 1 27 27 ASP HA H 1 4.385 0.02 . 1 . . . . 27 D HA . 17002 1
332 . 1 1 27 27 ASP HB2 H 1 2.678 0.02 . 2 . . . . 27 D HB2 . 17002 1
333 . 1 1 27 27 ASP HB3 H 1 2.593 0.02 . 2 . . . . 27 D HB3 . 17002 1
334 . 1 1 27 27 ASP C C 13 178.849 0.13 . 1 . . . . 27 D C . 17002 1
335 . 1 1 27 27 ASP CA C 13 57.508 0.13 . 1 . . . . 27 D CA . 17002 1
336 . 1 1 27 27 ASP CB C 13 40.308 0.13 . 1 . . . . 27 D CB . 17002 1
337 . 1 1 27 27 ASP N N 15 126.193 0.12 . 1 . . . . 27 D N . 17002 1
338 . 1 1 28 28 GLU H H 1 8.325 0.02 . 1 . . . . 28 E H . 17002 1
339 . 1 1 28 28 GLU HA H 1 4.092 0.02 . 1 . . . . 28 E HA . 17002 1
340 . 1 1 28 28 GLU HB2 H 1 2.247 0.02 . 2 . . . . 28 E HB2 . 17002 1
341 . 1 1 28 28 GLU HB3 H 1 2.002 0.02 . 2 . . . . 28 E HB3 . 17002 1
342 . 1 1 28 28 GLU HG2 H 1 2.212 0.02 . 2 . . . . 28 E HG2 . 17002 1
343 . 1 1 28 28 GLU HG3 H 1 2.395 0.02 . 2 . . . . 28 E HG3 . 17002 1
344 . 1 1 28 28 GLU C C 13 179.783 0.13 . 1 . . . . 28 E C . 17002 1
345 . 1 1 28 28 GLU CA C 13 59.425 0.13 . 1 . . . . 28 E CA . 17002 1
346 . 1 1 28 28 GLU CB C 13 29.733 0.13 . 1 . . . . 28 E CB . 17002 1
347 . 1 1 28 28 GLU CG C 13 37.017 0.13 . 1 . . . . 28 E CG . 17002 1
348 . 1 1 28 28 GLU N N 15 120.199 0.12 . 1 . . . . 28 E N . 17002 1
349 . 1 1 29 29 ALA H H 1 7.283 0.02 . 1 . . . . 29 A H . 17002 1
350 . 1 1 29 29 ALA HA H 1 3.781 0.02 . 1 . . . . 29 A HA . 17002 1
351 . 1 1 29 29 ALA HB1 H 1 1.187 0.02 . 1 . . . . 29 A QB . 17002 1
352 . 1 1 29 29 ALA HB2 H 1 1.187 0.02 . 1 . . . . 29 A QB . 17002 1
353 . 1 1 29 29 ALA HB3 H 1 1.187 0.02 . 1 . . . . 29 A QB . 17002 1
354 . 1 1 29 29 ALA C C 13 178.316 0.13 . 1 . . . . 29 A C . 17002 1
355 . 1 1 29 29 ALA CA C 13 54.855 0.13 . 1 . . . . 29 A CA . 17002 1
356 . 1 1 29 29 ALA CB C 13 17.619 0.13 . 1 . . . . 29 A CB . 17002 1
357 . 1 1 29 29 ALA N N 15 122.986 0.12 . 1 . . . . 29 A N . 17002 1
358 . 1 1 30 30 ASN H H 1 7.670 0.02 . 1 . . . . 30 N H . 17002 1
359 . 1 1 30 30 ASN HA H 1 4.296 0.02 . 1 . . . . 30 N HA . 17002 1
360 . 1 1 30 30 ASN HB2 H 1 2.758 0.02 . 2 . . . . 30 N QB . 17002 1
361 . 1 1 30 30 ASN HB3 H 1 2.758 0.02 . 2 . . . . 30 N QB . 17002 1
362 . 1 1 30 30 ASN HD21 H 1 7.733 0.02 . 2 . . . . 30 N HD21 . 17002 1
363 . 1 1 30 30 ASN HD22 H 1 6.835 0.02 . 2 . . . . 30 N HD22 . 17002 1
364 . 1 1 30 30 ASN C C 13 178.263 0.13 . 1 . . . . 30 N C . 17002 1
365 . 1 1 30 30 ASN CA C 13 56.263 0.13 . 1 . . . . 30 N CA . 17002 1
366 . 1 1 30 30 ASN CB C 13 38.139 0.13 . 1 . . . . 30 N CB . 17002 1
367 . 1 1 30 30 ASN N N 15 116.456 0.12 . 1 . . . . 30 N N . 17002 1
368 . 1 1 30 30 ASN ND2 N 15 113.182 0.12 . 1 . . . . 30 N ND2 . 17002 1
369 . 1 1 31 31 ALA H H 1 8.238 0.02 . 1 . . . . 31 A H . 17002 1
370 . 1 1 31 31 ALA HA H 1 4.099 0.02 . 1 . . . . 31 A HA . 17002 1
371 . 1 1 31 31 ALA HB1 H 1 1.445 0.02 . 1 . . . . 31 A QB . 17002 1
372 . 1 1 31 31 ALA HB2 H 1 1.445 0.02 . 1 . . . . 31 A QB . 17002 1
373 . 1 1 31 31 ALA HB3 H 1 1.445 0.02 . 1 . . . . 31 A QB . 17002 1
374 . 1 1 31 31 ALA C C 13 180.145 0.13 . 1 . . . . 31 A C . 17002 1
375 . 1 1 31 31 ALA CA C 13 54.918 0.13 . 1 . . . . 31 A CA . 17002 1
376 . 1 1 31 31 ALA CB C 13 17.989 0.13 . 1 . . . . 31 A CB . 17002 1
377 . 1 1 31 31 ALA N N 15 123.423 0.12 . 1 . . . . 31 A N . 17002 1
378 . 1 1 32 32 TYR H H 1 7.828 0.02 . 1 . . . . 32 Y H . 17002 1
379 . 1 1 32 32 TYR HA H 1 3.937 0.02 . 1 . . . . 32 Y HA . 17002 1
380 . 1 1 32 32 TYR HB2 H 1 3.032 0.02 . 2 . . . . 32 Y HB2 . 17002 1
381 . 1 1 32 32 TYR HB3 H 1 2.851 0.02 . 2 . . . . 32 Y HB3 . 17002 1
382 . 1 1 32 32 TYR HD1 H 1 6.952 0.02 . 3 . . . . 32 Y QD . 17002 1
383 . 1 1 32 32 TYR HD2 H 1 6.952 0.02 . 3 . . . . 32 Y QD . 17002 1
384 . 1 1 32 32 TYR HE1 H 1 6.515 0.02 . 3 . . . . 32 Y QE . 17002 1
385 . 1 1 32 32 TYR HE2 H 1 6.515 0.02 . 3 . . . . 32 Y QE . 17002 1
386 . 1 1 32 32 TYR C C 13 177.622 0.13 . 1 . . . . 32 Y C . 17002 1
387 . 1 1 32 32 TYR CA C 13 62.454 0.13 . 1 . . . . 32 Y CA . 17002 1
388 . 1 1 32 32 TYR CB C 13 38.443 0.13 . 1 . . . . 32 Y CB . 17002 1
389 . 1 1 32 32 TYR CD1 C 13 132.373 0.13 . 3 . . . . 32 Y CD1 . 17002 1
390 . 1 1 32 32 TYR CE1 C 13 118.037 0.13 . 3 . . . . 32 Y CE1 . 17002 1
391 . 1 1 32 32 TYR N N 15 120.429 0.12 . 1 . . . . 32 Y N . 17002 1
392 . 1 1 33 33 ALA H H 1 8.398 0.02 . 1 . . . . 33 A H . 17002 1
393 . 1 1 33 33 ALA HA H 1 3.718 0.02 . 1 . . . . 33 A HA . 17002 1
394 . 1 1 33 33 ALA HB1 H 1 1.544 0.02 . 1 . . . . 33 A QB . 17002 1
395 . 1 1 33 33 ALA HB2 H 1 1.544 0.02 . 1 . . . . 33 A QB . 17002 1
396 . 1 1 33 33 ALA HB3 H 1 1.544 0.02 . 1 . . . . 33 A QB . 17002 1
397 . 1 1 33 33 ALA C C 13 179.061 0.13 . 1 . . . . 33 A C . 17002 1
398 . 1 1 33 33 ALA CA C 13 56.056 0.13 . 1 . . . . 33 A CA . 17002 1
399 . 1 1 33 33 ALA CB C 13 18.004 0.13 . 1 . . . . 33 A CB . 17002 1
400 . 1 1 33 33 ALA N N 15 120.573 0.12 . 1 . . . . 33 A N . 17002 1
401 . 1 1 34 34 ALA H H 1 7.611 0.02 . 1 . . . . 34 A H . 17002 1
402 . 1 1 34 34 ALA HA H 1 3.984 0.02 . 1 . . . . 34 A HA . 17002 1
403 . 1 1 34 34 ALA HB1 H 1 1.428 0.02 . 1 . . . . 34 A QB . 17002 1
404 . 1 1 34 34 ALA HB2 H 1 1.428 0.02 . 1 . . . . 34 A QB . 17002 1
405 . 1 1 34 34 ALA HB3 H 1 1.428 0.02 . 1 . . . . 34 A QB . 17002 1
406 . 1 1 34 34 ALA C C 13 180.362 0.13 . 1 . . . . 34 A C . 17002 1
407 . 1 1 34 34 ALA CA C 13 54.860 0.13 . 1 . . . . 34 A CA . 17002 1
408 . 1 1 34 34 ALA CB C 13 17.963 0.13 . 1 . . . . 34 A CB . 17002 1
409 . 1 1 34 34 ALA N N 15 117.895 0.12 . 1 . . . . 34 A N . 17002 1
410 . 1 1 35 35 GLU H H 1 7.508 0.02 . 1 . . . . 35 E H . 17002 1
411 . 1 1 35 35 GLU HA H 1 3.854 0.02 . 1 . . . . 35 E HA . 17002 1
412 . 1 1 35 35 GLU HB2 H 1 1.789 0.02 . 2 . . . . 35 E HB2 . 17002 1
413 . 1 1 35 35 GLU HB3 H 1 2.000 0.02 . 2 . . . . 35 E HB3 . 17002 1
414 . 1 1 35 35 GLU HG2 H 1 2.106 0.02 . 2 . . . . 35 E HG2 . 17002 1
415 . 1 1 35 35 GLU HG3 H 1 2.354 0.02 . 2 . . . . 35 E HG3 . 17002 1
416 . 1 1 35 35 GLU C C 13 179.276 0.13 . 1 . . . . 35 E C . 17002 1
417 . 1 1 35 35 GLU CA C 13 58.738 0.13 . 1 . . . . 35 E CA . 17002 1
418 . 1 1 35 35 GLU CB C 13 29.633 0.13 . 1 . . . . 35 E CB . 17002 1
419 . 1 1 35 35 GLU CG C 13 36.207 0.13 . 1 . . . . 35 E CG . 17002 1
420 . 1 1 35 35 GLU N N 15 118.504 0.12 . 1 . . . . 35 E N . 17002 1
421 . 1 1 36 36 VAL H H 1 7.455 0.02 . 1 . . . . 36 V H . 17002 1
422 . 1 1 36 36 VAL HA H 1 3.170 0.02 . 1 . . . . 36 V HA . 17002 1
423 . 1 1 36 36 VAL HB H 1 2.088 0.02 . 1 . . . . 36 V HB . 17002 1
424 . 1 1 36 36 VAL HG11 H 1 0.728 0.02 . 2 . . . . 36 V QG1 . 17002 1
425 . 1 1 36 36 VAL HG12 H 1 0.728 0.02 . 2 . . . . 36 V QG1 . 17002 1
426 . 1 1 36 36 VAL HG13 H 1 0.728 0.02 . 2 . . . . 36 V QG1 . 17002 1
427 . 1 1 36 36 VAL HG21 H 1 0.570 0.02 . 2 . . . . 36 V QG2 . 17002 1
428 . 1 1 36 36 VAL HG22 H 1 0.570 0.02 . 2 . . . . 36 V QG2 . 17002 1
429 . 1 1 36 36 VAL HG23 H 1 0.570 0.02 . 2 . . . . 36 V QG2 . 17002 1
430 . 1 1 36 36 VAL C C 13 176.792 0.13 . 1 . . . . 36 V C . 17002 1
431 . 1 1 36 36 VAL CA C 13 67.131 0.13 . 1 . . . . 36 V CA . 17002 1
432 . 1 1 36 36 VAL CB C 13 30.830 0.13 . 1 . . . . 36 V CB . 17002 1
433 . 1 1 36 36 VAL CG1 C 13 22.959 0.13 . 2 . . . . 36 V CG1 . 17002 1
434 . 1 1 36 36 VAL CG2 C 13 24.934 0.13 . 2 . . . . 36 V CG2 . 17002 1
435 . 1 1 36 36 VAL N N 15 121.386 0.12 . 1 . . . . 36 V N . 17002 1
436 . 1 1 37 37 VAL H H 1 7.552 0.02 . 1 . . . . 37 V H . 17002 1
437 . 1 1 37 37 VAL HA H 1 3.438 0.02 . 1 . . . . 37 V HA . 17002 1
438 . 1 1 37 37 VAL HB H 1 2.099 0.02 . 1 . . . . 37 V HB . 17002 1
439 . 1 1 37 37 VAL HG11 H 1 0.960 0.02 . 2 . . . . 37 V QG1 . 17002 1
440 . 1 1 37 37 VAL HG12 H 1 0.960 0.02 . 2 . . . . 37 V QG1 . 17002 1
441 . 1 1 37 37 VAL HG13 H 1 0.960 0.02 . 2 . . . . 37 V QG1 . 17002 1
442 . 1 1 37 37 VAL HG21 H 1 1.010 0.02 . 2 . . . . 37 V QG2 . 17002 1
443 . 1 1 37 37 VAL HG22 H 1 1.010 0.02 . 2 . . . . 37 V QG2 . 17002 1
444 . 1 1 37 37 VAL HG23 H 1 1.010 0.02 . 2 . . . . 37 V QG2 . 17002 1
445 . 1 1 37 37 VAL C C 13 178.823 0.13 . 1 . . . . 37 V C . 17002 1
446 . 1 1 37 37 VAL CA C 13 66.279 0.13 . 1 . . . . 37 V CA . 17002 1
447 . 1 1 37 37 VAL CB C 13 32.619 0.13 . 1 . . . . 37 V CB . 17002 1
448 . 1 1 37 37 VAL CG1 C 13 21.180 0.13 . 2 . . . . 37 V CG1 . 17002 1
449 . 1 1 37 37 VAL CG2 C 13 22.549 0.13 . 2 . . . . 37 V CG2 . 17002 1
450 . 1 1 37 37 VAL N N 15 117.390 0.12 . 1 . . . . 37 V N . 17002 1
451 . 1 1 38 38 LYS H H 1 7.381 0.02 . 1 . . . . 38 K H . 17002 1
452 . 1 1 38 38 LYS HA H 1 3.886 0.02 . 1 . . . . 38 K HA . 17002 1
453 . 1 1 38 38 LYS HB2 H 1 1.707 0.02 . 2 . . . . 38 K HB2 . 17002 1
454 . 1 1 38 38 LYS HB3 H 1 1.785 0.02 . 2 . . . . 38 K HB3 . 17002 1
455 . 1 1 38 38 LYS HD2 H 1 1.566 0.02 . 2 . . . . 38 K QD . 17002 1
456 . 1 1 38 38 LYS HD3 H 1 1.566 0.02 . 2 . . . . 38 K QD . 17002 1
457 . 1 1 38 38 LYS HE2 H 1 2.849 0.02 . 2 . . . . 38 K QE . 17002 1
458 . 1 1 38 38 LYS HE3 H 1 2.849 0.02 . 2 . . . . 38 K QE . 17002 1
459 . 1 1 38 38 LYS HG2 H 1 1.405 0.02 . 2 . . . . 38 K HG2 . 17002 1
460 . 1 1 38 38 LYS HG3 H 1 1.481 0.02 . 2 . . . . 38 K HG3 . 17002 1
461 . 1 1 38 38 LYS C C 13 176.868 0.13 . 1 . . . . 38 K C . 17002 1
462 . 1 1 38 38 LYS CA C 13 57.815 0.13 . 1 . . . . 38 K CA . 17002 1
463 . 1 1 38 38 LYS CB C 13 32.830 0.13 . 1 . . . . 38 K CB . 17002 1
464 . 1 1 38 38 LYS CD C 13 29.477 0.13 . 1 . . . . 38 K CD . 17002 1
465 . 1 1 38 38 LYS CE C 13 42.119 0.13 . 1 . . . . 38 K CE . 17002 1
466 . 1 1 38 38 LYS CG C 13 25.487 0.13 . 1 . . . . 38 K CG . 17002 1
467 . 1 1 38 38 LYS N N 15 116.758 0.12 . 1 . . . . 38 K N . 17002 1
468 . 1 1 39 39 ALA H H 1 7.452 0.02 . 1 . . . . 39 A H . 17002 1
469 . 1 1 39 39 ALA HA H 1 4.101 0.02 . 1 . . . . 39 A HA . 17002 1
470 . 1 1 39 39 ALA HB1 H 1 1.340 0.02 . 1 . . . . 39 A QB . 17002 1
471 . 1 1 39 39 ALA HB2 H 1 1.340 0.02 . 1 . . . . 39 A QB . 17002 1
472 . 1 1 39 39 ALA HB3 H 1 1.340 0.02 . 1 . . . . 39 A QB . 17002 1
473 . 1 1 39 39 ALA C C 13 176.489 0.13 . 1 . . . . 39 A C . 17002 1
474 . 1 1 39 39 ALA CA C 13 52.969 0.13 . 1 . . . . 39 A CA . 17002 1
475 . 1 1 39 39 ALA CB C 13 18.260 0.13 . 1 . . . . 39 A CB . 17002 1
476 . 1 1 39 39 ALA N N 15 121.378 0.12 . 1 . . . . 39 A N . 17002 1
477 . 1 1 40 40 ASP H H 1 6.807 0.02 . 1 . . . . 40 D H . 17002 1
478 . 1 1 40 40 ASP HA H 1 4.577 0.02 . 1 . . . . 40 D HA . 17002 1
479 . 1 1 40 40 ASP HB2 H 1 2.645 0.02 . 2 . . . . 40 D HB2 . 17002 1
480 . 1 1 40 40 ASP HB3 H 1 2.292 0.02 . 2 . . . . 40 D HB3 . 17002 1
481 . 1 1 40 40 ASP CA C 13 53.838 0.13 . 1 . . . . 40 D CA . 17002 1
482 . 1 1 40 40 ASP CB C 13 41.956 0.13 . 1 . . . . 40 D CB . 17002 1
483 . 1 1 40 40 ASP N N 15 114.434 0.12 . 1 . . . . 40 D N . 17002 1
484 . 1 1 41 41 PHE HA H 1 4.574 0.02 . 1 . . . . 41 F HA . 17002 1
485 . 1 1 41 41 PHE HB2 H 1 3.292 0.02 . 2 . . . . 41 F HB2 . 17002 1
486 . 1 1 41 41 PHE HB3 H 1 2.967 0.02 . 2 . . . . 41 F HB3 . 17002 1
487 . 1 1 41 41 PHE HD1 H 1 7.223 0.02 . 3 . . . . 41 F QD . 17002 1
488 . 1 1 41 41 PHE HD2 H 1 7.223 0.02 . 3 . . . . 41 F QD . 17002 1
489 . 1 1 41 41 PHE HE1 H 1 7.273 0.02 . 3 . . . . 41 F QE . 17002 1
490 . 1 1 41 41 PHE HE2 H 1 7.273 0.02 . 3 . . . . 41 F QE . 17002 1
491 . 1 1 41 41 PHE HZ H 1 7.189 0.02 . 1 . . . . 41 F HZ . 17002 1
492 . 1 1 41 41 PHE C C 13 176.030 0.13 . 1 . . . . 41 F C . 17002 1
493 . 1 1 41 41 PHE CA C 13 57.440 0.13 . 1 . . . . 41 F CA . 17002 1
494 . 1 1 41 41 PHE CB C 13 38.912 0.13 . 1 . . . . 41 F CB . 17002 1
495 . 1 1 41 41 PHE CD1 C 13 131.806 0.13 . 3 . . . . 41 F CD1 . 17002 1
496 . 1 1 41 41 PHE CE1 C 13 131.667 0.13 . 3 . . . . 41 F CE1 . 17002 1
497 . 1 1 41 41 PHE CZ C 13 129.638 0.13 . 1 . . . . 41 F CZ . 17002 1
498 . 1 1 42 42 GLU H H 1 8.382 0.02 . 1 . . . . 42 E H . 17002 1
499 . 1 1 42 42 GLU HA H 1 3.990 0.02 . 1 . . . . 42 E HA . 17002 1
500 . 1 1 42 42 GLU HB2 H 1 2.116 0.02 . 2 . . . . 42 E HB2 . 17002 1
501 . 1 1 42 42 GLU HB3 H 1 2.042 0.02 . 2 . . . . 42 E HB3 . 17002 1
502 . 1 1 42 42 GLU HG2 H 1 2.129 0.02 . 2 . . . . 42 E QG . 17002 1
503 . 1 1 42 42 GLU HG3 H 1 2.129 0.02 . 2 . . . . 42 E QG . 17002 1
504 . 1 1 42 42 GLU C C 13 176.397 0.13 . 1 . . . . 42 E C . 17002 1
505 . 1 1 42 42 GLU CA C 13 57.782 0.13 . 1 . . . . 42 E CA . 17002 1
506 . 1 1 42 42 GLU CB C 13 29.003 0.13 . 1 . . . . 42 E CB . 17002 1
507 . 1 1 42 42 GLU CG C 13 36.532 0.13 . 1 . . . . 42 E CG . 17002 1
508 . 1 1 42 42 GLU N N 15 119.675 0.12 . 1 . . . . 42 E N . 17002 1
509 . 1 1 43 43 GLU H H 1 8.514 0.02 . 1 . . . . 43 E H . 17002 1
510 . 1 1 43 43 GLU HA H 1 4.196 0.02 . 1 . . . . 43 E HA . 17002 1
511 . 1 1 43 43 GLU HB2 H 1 1.903 0.02 . 2 . . . . 43 E QB . 17002 1
512 . 1 1 43 43 GLU HB3 H 1 1.903 0.02 . 2 . . . . 43 E QB . 17002 1
513 . 1 1 43 43 GLU HG2 H 1 2.199 0.02 . 2 . . . . 43 E QG . 17002 1
514 . 1 1 43 43 GLU HG3 H 1 2.199 0.02 . 2 . . . . 43 E QG . 17002 1
515 . 1 1 43 43 GLU C C 13 176.399 0.13 . 1 . . . . 43 E C . 17002 1
516 . 1 1 43 43 GLU CA C 13 56.471 0.13 . 1 . . . . 43 E CA . 17002 1
517 . 1 1 43 43 GLU CB C 13 30.985 0.13 . 1 . . . . 43 E CB . 17002 1
518 . 1 1 43 43 GLU CG C 13 36.308 0.13 . 1 . . . . 43 E CG . 17002 1
519 . 1 1 43 43 GLU N N 15 119.628 0.12 . 1 . . . . 43 E N . 17002 1
520 . 1 1 44 44 ALA H H 1 8.388 0.02 . 1 . . . . 44 A H . 17002 1
521 . 1 1 44 44 ALA HA H 1 4.153 0.02 . 1 . . . . 44 A HA . 17002 1
522 . 1 1 44 44 ALA HB1 H 1 1.308 0.02 . 1 . . . . 44 A QB . 17002 1
523 . 1 1 44 44 ALA HB2 H 1 1.308 0.02 . 1 . . . . 44 A QB . 17002 1
524 . 1 1 44 44 ALA HB3 H 1 1.308 0.02 . 1 . . . . 44 A QB . 17002 1
525 . 1 1 44 44 ALA C C 13 179.261 0.13 . 1 . . . . 44 A C . 17002 1
526 . 1 1 44 44 ALA CA C 13 53.160 0.13 . 1 . . . . 44 A CA . 17002 1
527 . 1 1 44 44 ALA CB C 13 18.714 0.13 . 1 . . . . 44 A CB . 17002 1
528 . 1 1 44 44 ALA N N 15 124.880 0.12 . 1 . . . . 44 A N . 17002 1
529 . 1 1 45 45 GLY H H 1 8.445 0.02 . 1 . . . . 45 G H . 17002 1
530 . 1 1 45 45 GLY HA2 H 1 3.958 0.02 . 2 . . . . 45 G HA2 . 17002 1
531 . 1 1 45 45 GLY HA3 H 1 3.683 0.02 . 2 . . . . 45 G HA3 . 17002 1
532 . 1 1 45 45 GLY C C 13 174.391 0.13 . 1 . . . . 45 G C . 17002 1
533 . 1 1 45 45 GLY CA C 13 45.749 0.13 . 1 . . . . 45 G CA . 17002 1
534 . 1 1 45 45 GLY N N 15 109.438 0.12 . 1 . . . . 45 G N . 17002 1
535 . 1 1 46 46 HIS H H 1 8.409 0.02 . 1 . . . . 46 H H . 17002 1
536 . 1 1 46 46 HIS HA H 1 4.955 0.02 . 1 . . . . 46 H HA . 17002 1
537 . 1 1 46 46 HIS HB2 H 1 3.447 0.02 . 2 . . . . 46 H HB2 . 17002 1
538 . 1 1 46 46 HIS HB3 H 1 3.312 0.02 . 2 . . . . 46 H HB3 . 17002 1
539 . 1 1 46 46 HIS HD2 H 1 7.296 0.02 . 1 . . . . 46 H HD2 . 17002 1
540 . 1 1 46 46 HIS HE1 H 1 8.447 0.02 . 1 . . . . 46 H HE1 . 17002 1
541 . 1 1 46 46 HIS CA C 13 55.588 0.13 . 1 . . . . 46 H CA . 17002 1
542 . 1 1 46 46 HIS CB C 13 28.375 0.13 . 1 . . . . 46 H CB . 17002 1
543 . 1 1 46 46 HIS CD2 C 13 120.359 0.13 . 1 . . . . 46 H CD2 . 17002 1
544 . 1 1 46 46 HIS CE1 C 13 137.278 0.13 . 1 . . . . 46 H CE1 . 17002 1
545 . 1 1 46 46 HIS N N 15 114.890 0.12 . 1 . . . . 46 H N . 17002 1
546 . 1 1 47 47 GLU H H 1 8.508 0.02 . 1 . . . . 47 E H . 17002 1
547 . 1 1 47 47 GLU HA H 1 4.000 0.02 . 1 . . . . 47 E HA . 17002 1
548 . 1 1 47 47 GLU HB2 H 1 2.105 0.02 . 2 . . . . 47 E HB2 . 17002 1
549 . 1 1 47 47 GLU HB3 H 1 2.055 0.02 . 2 . . . . 47 E HB3 . 17002 1
550 . 1 1 47 47 GLU HG2 H 1 2.207 0.02 . 2 . . . . 47 E QG . 17002 1
551 . 1 1 47 47 GLU HG3 H 1 2.207 0.02 . 2 . . . . 47 E QG . 17002 1
552 . 1 1 47 47 GLU CA C 13 58.000 0.13 . 1 . . . . 47 E CA . 17002 1
553 . 1 1 47 47 GLU CB C 13 29.153 0.13 . 1 . . . . 47 E CB . 17002 1
554 . 1 1 47 47 GLU CG C 13 36.243 0.13 . 1 . . . . 47 E CG . 17002 1
555 . 1 1 47 47 GLU N N 15 119.581 0.12 . 1 . . . . 47 E N . 17002 1
556 . 1 1 48 48 ASP HA H 1 4.193 0.02 . 1 . . . . 48 D HA . 17002 1
557 . 1 1 48 48 ASP HB2 H 1 2.909 0.02 . 2 . . . . 48 D HB2 . 17002 1
558 . 1 1 48 48 ASP HB3 H 1 2.709 0.02 . 2 . . . . 48 D HB3 . 17002 1
559 . 1 1 48 48 ASP C C 13 179.140 0.13 . 1 . . . . 48 D C . 17002 1
560 . 1 1 48 48 ASP CA C 13 56.203 0.13 . 1 . . . . 48 D CA . 17002 1
561 . 1 1 48 48 ASP CB C 13 39.602 0.13 . 1 . . . . 48 D CB . 17002 1
562 . 1 1 49 49 VAL H H 1 8.509 0.02 . 1 . . . . 49 V H . 17002 1
563 . 1 1 49 49 VAL HA H 1 3.311 0.02 . 1 . . . . 49 V HA . 17002 1
564 . 1 1 49 49 VAL HB H 1 1.937 0.02 . 1 . . . . 49 V HB . 17002 1
565 . 1 1 49 49 VAL HG11 H 1 0.661 0.02 . 2 . . . . 49 V QG1 . 17002 1
566 . 1 1 49 49 VAL HG12 H 1 0.661 0.02 . 2 . . . . 49 V QG1 . 17002 1
567 . 1 1 49 49 VAL HG13 H 1 0.661 0.02 . 2 . . . . 49 V QG1 . 17002 1
568 . 1 1 49 49 VAL HG21 H 1 0.927 0.02 . 2 . . . . 49 V QG2 . 17002 1
569 . 1 1 49 49 VAL HG22 H 1 0.927 0.02 . 2 . . . . 49 V QG2 . 17002 1
570 . 1 1 49 49 VAL HG23 H 1 0.927 0.02 . 2 . . . . 49 V QG2 . 17002 1
571 . 1 1 49 49 VAL C C 13 177.814 0.13 . 1 . . . . 49 V C . 17002 1
572 . 1 1 49 49 VAL CA C 13 66.762 0.13 . 1 . . . . 49 V CA . 17002 1
573 . 1 1 49 49 VAL CB C 13 31.781 0.13 . 1 . . . . 49 V CB . 17002 1
574 . 1 1 49 49 VAL CG1 C 13 21.085 0.13 . 2 . . . . 49 V CG1 . 17002 1
575 . 1 1 49 49 VAL CG2 C 13 22.767 0.13 . 2 . . . . 49 V CG2 . 17002 1
576 . 1 1 49 49 VAL N N 15 124.269 0.12 . 1 . . . . 49 V N . 17002 1
577 . 1 1 50 50 MET H H 1 7.723 0.02 . 1 . . . . 50 M H . 17002 1
578 . 1 1 50 50 MET HA H 1 4.124 0.02 . 1 . . . . 50 M HA . 17002 1
579 . 1 1 50 50 MET HB2 H 1 1.963 0.02 . 2 . . . . 50 M HB2 . 17002 1
580 . 1 1 50 50 MET HB3 H 1 1.690 0.02 . 2 . . . . 50 M HB3 . 17002 1
581 . 1 1 50 50 MET HE1 H 1 1.347 0.02 . 1 . . . . 50 M QE . 17002 1
582 . 1 1 50 50 MET HE2 H 1 1.347 0.02 . 1 . . . . 50 M QE . 17002 1
583 . 1 1 50 50 MET HE3 H 1 1.347 0.02 . 1 . . . . 50 M QE . 17002 1
584 . 1 1 50 50 MET HG2 H 1 2.134 0.02 . 2 . . . . 50 M HG2 . 17002 1
585 . 1 1 50 50 MET HG3 H 1 2.410 0.02 . 2 . . . . 50 M HG3 . 17002 1
586 . 1 1 50 50 MET C C 13 177.801 0.13 . 1 . . . . 50 M C . 17002 1
587 . 1 1 50 50 MET CA C 13 56.567 0.13 . 1 . . . . 50 M CA . 17002 1
588 . 1 1 50 50 MET CB C 13 31.464 0.13 . 1 . . . . 50 M CB . 17002 1
589 . 1 1 50 50 MET CE C 13 16.800 0.13 . 1 . . . . 50 M CE . 17002 1
590 . 1 1 50 50 MET CG C 13 32.060 0.13 . 1 . . . . 50 M CG . 17002 1
591 . 1 1 50 50 MET N N 15 117.066 0.12 . 1 . . . . 50 M N . 17002 1
592 . 1 1 51 51 ARG H H 1 8.382 0.02 . 1 . . . . 51 R H . 17002 1
593 . 1 1 51 51 ARG HA H 1 3.866 0.02 . 1 . . . . 51 R HA . 17002 1
594 . 1 1 51 51 ARG HB2 H 1 1.894 0.02 . 2 . . . . 51 R HB2 . 17002 1
595 . 1 1 51 51 ARG HB3 H 1 1.747 0.02 . 2 . . . . 51 R HB3 . 17002 1
596 . 1 1 51 51 ARG HD2 H 1 3.125 0.02 . 2 . . . . 51 R HD2 . 17002 1
597 . 1 1 51 51 ARG HD3 H 1 3.213 0.02 . 2 . . . . 51 R HD3 . 17002 1
598 . 1 1 51 51 ARG HE H 1 7.224 0.02 . 1 . . . . 51 R HE . 17002 1
599 . 1 1 51 51 ARG HG2 H 1 1.798 0.02 . 2 . . . . 51 R HG2 . 17002 1
600 . 1 1 51 51 ARG HG3 H 1 1.504 0.02 . 2 . . . . 51 R HG3 . 17002 1
601 . 1 1 51 51 ARG CA C 13 59.949 0.13 . 1 . . . . 51 R CA . 17002 1
602 . 1 1 51 51 ARG CB C 13 30.421 0.13 . 1 . . . . 51 R CB . 17002 1
603 . 1 1 51 51 ARG CD C 13 43.546 0.13 . 1 . . . . 51 R CD . 17002 1
604 . 1 1 51 51 ARG CG C 13 28.251 0.13 . 1 . . . . 51 R CG . 17002 1
605 . 1 1 51 51 ARG N N 15 118.322 0.12 . 1 . . . . 51 R N . 17002 1
606 . 1 1 51 51 ARG NE N 15 83.307 0.12 . 1 . . . . 51 R NE . 17002 1
607 . 1 1 52 52 LYS H H 1 7.463 0.02 . 1 . . . . 52 K H . 17002 1
608 . 1 1 52 52 LYS HA H 1 4.031 0.02 . 1 . . . . 52 K HA . 17002 1
609 . 1 1 52 52 LYS HB2 H 1 2.009 0.02 . 2 . . . . 52 K HB2 . 17002 1
610 . 1 1 52 52 LYS HB3 H 1 1.967 0.02 . 2 . . . . 52 K HB3 . 17002 1
611 . 1 1 52 52 LYS HD2 H 1 1.504 0.02 . 2 . . . . 52 K QD . 17002 1
612 . 1 1 52 52 LYS HD3 H 1 1.504 0.02 . 2 . . . . 52 K QD . 17002 1
613 . 1 1 52 52 LYS HE2 H 1 2.508 0.02 . 2 . . . . 52 K HE2 . 17002 1
614 . 1 1 52 52 LYS HE3 H 1 2.472 0.02 . 2 . . . . 52 K HE3 . 17002 1
615 . 1 1 52 52 LYS HG2 H 1 1.277 0.02 . 2 . . . . 52 K HG2 . 17002 1
616 . 1 1 52 52 LYS HG3 H 1 1.371 0.02 . 2 . . . . 52 K HG3 . 17002 1
617 . 1 1 52 52 LYS C C 13 178.632 0.13 . 1 . . . . 52 K C . 17002 1
618 . 1 1 52 52 LYS CA C 13 59.442 0.13 . 1 . . . . 52 K CA . 17002 1
619 . 1 1 52 52 LYS CB C 13 32.442 0.13 . 1 . . . . 52 K CB . 17002 1
620 . 1 1 52 52 LYS CD C 13 29.570 0.13 . 1 . . . . 52 K CD . 17002 1
621 . 1 1 52 52 LYS CE C 13 42.400 0.13 . 1 . . . . 52 K CE . 17002 1
622 . 1 1 52 52 LYS CG C 13 25.538 0.13 . 1 . . . . 52 K CG . 17002 1
623 . 1 1 52 52 LYS N N 15 120.594 0.12 . 1 . . . . 52 K N . 17002 1
624 . 1 1 53 53 VAL H H 1 8.430 0.02 . 1 . . . . 53 V H . 17002 1
625 . 1 1 53 53 VAL HA H 1 3.939 0.02 . 1 . . . . 53 V HA . 17002 1
626 . 1 1 53 53 VAL HB H 1 2.231 0.02 . 1 . . . . 53 V HB . 17002 1
627 . 1 1 53 53 VAL HG11 H 1 1.010 0.02 . 2 . . . . 53 V QG1 . 17002 1
628 . 1 1 53 53 VAL HG12 H 1 1.010 0.02 . 2 . . . . 53 V QG1 . 17002 1
629 . 1 1 53 53 VAL HG13 H 1 1.010 0.02 . 2 . . . . 53 V QG1 . 17002 1
630 . 1 1 53 53 VAL HG21 H 1 1.036 0.02 . 2 . . . . 53 V QG2 . 17002 1
631 . 1 1 53 53 VAL HG22 H 1 1.036 0.02 . 2 . . . . 53 V QG2 . 17002 1
632 . 1 1 53 53 VAL HG23 H 1 1.036 0.02 . 2 . . . . 53 V QG2 . 17002 1
633 . 1 1 53 53 VAL C C 13 178.241 0.13 . 1 . . . . 53 V C . 17002 1
634 . 1 1 53 53 VAL CA C 13 65.950 0.13 . 1 . . . . 53 V CA . 17002 1
635 . 1 1 53 53 VAL CB C 13 31.868 0.13 . 1 . . . . 53 V CB . 17002 1
636 . 1 1 53 53 VAL CG1 C 13 20.840 0.13 . 2 . . . . 53 V CG1 . 17002 1
637 . 1 1 53 53 VAL CG2 C 13 23.039 0.13 . 2 . . . . 53 V CG2 . 17002 1
638 . 1 1 53 53 VAL N N 15 114.447 0.12 . 1 . . . . 53 V N . 17002 1
639 . 1 1 54 54 LEU H H 1 8.951 0.02 . 1 . . . . 54 L H . 17002 1
640 . 1 1 54 54 LEU HA H 1 4.092 0.02 . 1 . . . . 54 L HA . 17002 1
641 . 1 1 54 54 LEU HB2 H 1 1.353 0.02 . 2 . . . . 54 L HB2 . 17002 1
642 . 1 1 54 54 LEU HB3 H 1 1.877 0.02 . 2 . . . . 54 L HB3 . 17002 1
643 . 1 1 54 54 LEU HD11 H 1 0.696 0.02 . 2 . . . . 54 L QD1 . 17002 1
644 . 1 1 54 54 LEU HD12 H 1 0.696 0.02 . 2 . . . . 54 L QD1 . 17002 1
645 . 1 1 54 54 LEU HD13 H 1 0.696 0.02 . 2 . . . . 54 L QD1 . 17002 1
646 . 1 1 54 54 LEU HD21 H 1 0.855 0.02 . 2 . . . . 54 L QD2 . 17002 1
647 . 1 1 54 54 LEU HD22 H 1 0.855 0.02 . 2 . . . . 54 L QD2 . 17002 1
648 . 1 1 54 54 LEU HD23 H 1 0.855 0.02 . 2 . . . . 54 L QD2 . 17002 1
649 . 1 1 54 54 LEU HG H 1 1.752 0.02 . 1 . . . . 54 L HG . 17002 1
650 . 1 1 54 54 LEU C C 13 181.448 0.13 . 1 . . . . 54 L C . 17002 1
651 . 1 1 54 54 LEU CA C 13 58.068 0.13 . 1 . . . . 54 L CA . 17002 1
652 . 1 1 54 54 LEU CB C 13 40.628 0.13 . 1 . . . . 54 L CB . 17002 1
653 . 1 1 54 54 LEU CD1 C 13 25.931 0.13 . 2 . . . . 54 L CD1 . 17002 1
654 . 1 1 54 54 LEU CD2 C 13 23.144 0.13 . 2 . . . . 54 L CD2 . 17002 1
655 . 1 1 54 54 LEU CG C 13 27.621 0.13 . 1 . . . . 54 L CG . 17002 1
656 . 1 1 54 54 LEU N N 15 119.753 0.12 . 1 . . . . 54 L N . 17002 1
657 . 1 1 55 55 GLY H H 1 7.838 0.02 . 1 . . . . 55 G H . 17002 1
658 . 1 1 55 55 GLY HA2 H 1 3.845 0.02 . 2 . . . . 55 G HA2 . 17002 1
659 . 1 1 55 55 GLY HA3 H 1 3.918 0.02 . 2 . . . . 55 G HA3 . 17002 1
660 . 1 1 55 55 GLY C C 13 176.182 0.13 . 1 . . . . 55 G C . 17002 1
661 . 1 1 55 55 GLY CA C 13 46.981 0.13 . 1 . . . . 55 G CA . 17002 1
662 . 1 1 55 55 GLY N N 15 108.086 0.12 . 1 . . . . 55 G N . 17002 1
663 . 1 1 56 56 ASP H H 1 7.843 0.02 . 1 . . . . 56 D H . 17002 1
664 . 1 1 56 56 ASP HA H 1 4.442 0.02 . 1 . . . . 56 D HA . 17002 1
665 . 1 1 56 56 ASP HB2 H 1 2.456 0.02 . 2 . . . . 56 D HB2 . 17002 1
666 . 1 1 56 56 ASP HB3 H 1 2.672 0.02 . 2 . . . . 56 D HB3 . 17002 1
667 . 1 1 56 56 ASP C C 13 177.893 0.13 . 1 . . . . 56 D C . 17002 1
668 . 1 1 56 56 ASP CA C 13 56.641 0.13 . 1 . . . . 56 D CA . 17002 1
669 . 1 1 56 56 ASP CB C 13 39.976 0.13 . 1 . . . . 56 D CB . 17002 1
670 . 1 1 56 56 ASP N N 15 121.668 0.12 . 1 . . . . 56 D N . 17002 1
671 . 1 1 57 57 LEU H H 1 8.252 0.02 . 1 . . . . 57 L H . 17002 1
672 . 1 1 57 57 LEU HA H 1 3.881 0.02 . 1 . . . . 57 L HA . 17002 1
673 . 1 1 57 57 LEU HB2 H 1 1.949 0.02 . 2 . . . . 57 L HB2 . 17002 1
674 . 1 1 57 57 LEU HB3 H 1 1.362 0.02 . 2 . . . . 57 L HB3 . 17002 1
675 . 1 1 57 57 LEU HD11 H 1 0.780 0.02 . 2 . . . . 57 L QD1 . 17002 1
676 . 1 1 57 57 LEU HD12 H 1 0.780 0.02 . 2 . . . . 57 L QD1 . 17002 1
677 . 1 1 57 57 LEU HD13 H 1 0.780 0.02 . 2 . . . . 57 L QD1 . 17002 1
678 . 1 1 57 57 LEU HD21 H 1 0.578 0.02 . 2 . . . . 57 L QD2 . 17002 1
679 . 1 1 57 57 LEU HD22 H 1 0.578 0.02 . 2 . . . . 57 L QD2 . 17002 1
680 . 1 1 57 57 LEU HD23 H 1 0.578 0.02 . 2 . . . . 57 L QD2 . 17002 1
681 . 1 1 57 57 LEU HG H 1 1.687 0.02 . 1 . . . . 57 L HG . 17002 1
682 . 1 1 57 57 LEU C C 13 177.936 0.13 . 1 . . . . 57 L C . 17002 1
683 . 1 1 57 57 LEU CA C 13 56.736 0.13 . 1 . . . . 57 L CA . 17002 1
684 . 1 1 57 57 LEU CB C 13 43.571 0.13 . 1 . . . . 57 L CB . 17002 1
685 . 1 1 57 57 LEU CD1 C 13 27.608 0.13 . 2 . . . . 57 L CD1 . 17002 1
686 . 1 1 57 57 LEU CD2 C 13 24.770 0.13 . 2 . . . . 57 L CD2 . 17002 1
687 . 1 1 57 57 LEU CG C 13 27.259 0.13 . 1 . . . . 57 L CG . 17002 1
688 . 1 1 57 57 LEU N N 15 117.897 0.12 . 1 . . . . 57 L N . 17002 1
689 . 1 1 58 58 ASP H H 1 7.566 0.02 . 1 . . . . 58 D H . 17002 1
690 . 1 1 58 58 ASP HA H 1 4.310 0.02 . 1 . . . . 58 D HA . 17002 1
691 . 1 1 58 58 ASP HB2 H 1 2.850 0.02 . 2 . . . . 58 D HB2 . 17002 1
692 . 1 1 58 58 ASP HB3 H 1 2.276 0.02 . 2 . . . . 58 D HB3 . 17002 1
693 . 1 1 58 58 ASP C C 13 176.267 0.13 . 1 . . . . 58 D C . 17002 1
694 . 1 1 58 58 ASP CA C 13 55.056 0.13 . 1 . . . . 58 D CA . 17002 1
695 . 1 1 58 58 ASP CB C 13 40.594 0.13 . 1 . . . . 58 D CB . 17002 1
696 . 1 1 58 58 ASP N N 15 117.474 0.12 . 1 . . . . 58 D N . 17002 1
697 . 1 1 59 59 GLY H H 1 9.218 0.02 . 1 . . . . 59 G H . 17002 1
698 . 1 1 59 59 GLY HA2 H 1 4.050 0.02 . 2 . . . . 59 G HA2 . 17002 1
699 . 1 1 59 59 GLY HA3 H 1 3.659 0.02 . 2 . . . . 59 G HA3 . 17002 1
700 . 1 1 59 59 GLY C C 13 176.397 0.13 . 1 . . . . 59 G C . 17002 1
701 . 1 1 59 59 GLY CA C 13 45.690 0.13 . 1 . . . . 59 G CA . 17002 1
702 . 1 1 59 59 GLY N N 15 105.635 0.12 . 1 . . . . 59 G N . 17002 1
703 . 1 1 60 60 LYS H H 1 7.878 0.02 . 1 . . . . 60 K H . 17002 1
704 . 1 1 60 60 LYS HA H 1 3.938 0.02 . 1 . . . . 60 K HA . 17002 1
705 . 1 1 60 60 LYS HB2 H 1 1.591 0.02 . 2 . . . . 60 K HB2 . 17002 1
706 . 1 1 60 60 LYS HB3 H 1 1.629 0.02 . 2 . . . . 60 K HB3 . 17002 1
707 . 1 1 60 60 LYS HD2 H 1 1.503 0.02 . 2 . . . . 60 K QD . 17002 1
708 . 1 1 60 60 LYS HD3 H 1 1.503 0.02 . 2 . . . . 60 K QD . 17002 1
709 . 1 1 60 60 LYS HE2 H 1 2.931 0.02 . 2 . . . . 60 K QE . 17002 1
710 . 1 1 60 60 LYS HE3 H 1 2.931 0.02 . 2 . . . . 60 K QE . 17002 1
711 . 1 1 60 60 LYS HG2 H 1 1.370 0.02 . 2 . . . . 60 K HG2 . 17002 1
712 . 1 1 60 60 LYS HG3 H 1 1.559 0.02 . 2 . . . . 60 K HG3 . 17002 1
713 . 1 1 60 60 LYS C C 13 177.652 0.13 . 1 . . . . 60 K C . 17002 1
714 . 1 1 60 60 LYS CA C 13 59.106 0.13 . 1 . . . . 60 K CA . 17002 1
715 . 1 1 60 60 LYS CB C 13 33.972 0.13 . 1 . . . . 60 K CB . 17002 1
716 . 1 1 60 60 LYS CD C 13 29.429 0.13 . 1 . . . . 60 K CD . 17002 1
717 . 1 1 60 60 LYS CE C 13 42.366 0.13 . 1 . . . . 60 K CE . 17002 1
718 . 1 1 60 60 LYS CG C 13 26.641 0.13 . 1 . . . . 60 K CG . 17002 1
719 . 1 1 60 60 LYS N N 15 119.374 0.12 . 1 . . . . 60 K N . 17002 1
720 . 1 1 61 61 ARG H H 1 7.450 0.02 . 1 . . . . 61 R H . 17002 1
721 . 1 1 61 61 ARG HA H 1 4.798 0.02 . 1 . . . . 61 R HA . 17002 1
722 . 1 1 61 61 ARG HB2 H 1 1.369 0.02 . 2 . . . . 61 R QB . 17002 1
723 . 1 1 61 61 ARG HB3 H 1 1.369 0.02 . 2 . . . . 61 R QB . 17002 1
724 . 1 1 61 61 ARG HD2 H 1 3.418 0.02 . 2 . . . . 61 R HD2 . 17002 1
725 . 1 1 61 61 ARG HD3 H 1 3.475 0.02 . 2 . . . . 61 R HD3 . 17002 1
726 . 1 1 61 61 ARG HE H 1 7.749 0.02 . 1 . . . . 61 R HE . 17002 1
727 . 1 1 61 61 ARG HG2 H 1 1.496 0.02 . 2 . . . . 61 R HG2 . 17002 1
728 . 1 1 61 61 ARG HG3 H 1 1.292 0.02 . 2 . . . . 61 R HG3 . 17002 1
729 . 1 1 61 61 ARG CA C 13 51.053 0.13 . 1 . . . . 61 R CA . 17002 1
730 . 1 1 61 61 ARG CB C 13 32.657 0.13 . 1 . . . . 61 R CB . 17002 1
731 . 1 1 61 61 ARG CD C 13 41.868 0.13 . 1 . . . . 61 R CD . 17002 1
732 . 1 1 61 61 ARG CG C 13 27.180 0.13 . 1 . . . . 61 R CG . 17002 1
733 . 1 1 61 61 ARG N N 15 113.181 0.12 . 1 . . . . 61 R N . 17002 1
734 . 1 1 61 61 ARG NE N 15 84.222 0.12 . 1 . . . . 61 R NE . 17002 1
735 . 1 1 62 62 PRO HA H 1 4.394 0.02 . 1 . . . . 62 P HA . 17002 1
736 . 1 1 62 62 PRO HB2 H 1 2.448 0.02 . 2 . . . . 62 P HB2 . 17002 1
737 . 1 1 62 62 PRO HB3 H 1 1.911 0.02 . 2 . . . . 62 P HB3 . 17002 1
738 . 1 1 62 62 PRO HD2 H 1 3.800 0.02 . 2 . . . . 62 P HD2 . 17002 1
739 . 1 1 62 62 PRO HD3 H 1 3.756 0.02 . 2 . . . . 62 P HD3 . 17002 1
740 . 1 1 62 62 PRO HG2 H 1 2.147 0.02 . 2 . . . . 62 P HG2 . 17002 1
741 . 1 1 62 62 PRO HG3 H 1 2.018 0.02 . 2 . . . . 62 P HG3 . 17002 1
742 . 1 1 62 62 PRO C C 13 177.652 0.13 . 1 . . . . 62 P C . 17002 1
743 . 1 1 62 62 PRO CA C 13 62.650 0.13 . 1 . . . . 62 P CA . 17002 1
744 . 1 1 62 62 PRO CB C 13 32.499 0.13 . 1 . . . . 62 P CB . 17002 1
745 . 1 1 62 62 PRO CD C 13 50.482 0.13 . 1 . . . . 62 P CD . 17002 1
746 . 1 1 62 62 PRO CG C 13 28.033 0.13 . 1 . . . . 62 P CG . 17002 1
747 . 1 1 63 63 GLU H H 1 8.883 0.02 . 1 . . . . 63 E H . 17002 1
748 . 1 1 63 63 GLU HA H 1 3.649 0.02 . 1 . . . . 63 E HA . 17002 1
749 . 1 1 63 63 GLU HB2 H 1 1.878 0.02 . 2 . . . . 63 E HB2 . 17002 1
750 . 1 1 63 63 GLU HB3 H 1 2.161 0.02 . 2 . . . . 63 E HB3 . 17002 1
751 . 1 1 63 63 GLU HG2 H 1 2.145 0.02 . 2 . . . . 63 E HG2 . 17002 1
752 . 1 1 63 63 GLU HG3 H 1 2.259 0.02 . 2 . . . . 63 E HG3 . 17002 1
753 . 1 1 63 63 GLU C C 13 177.986 0.13 . 1 . . . . 63 E C . 17002 1
754 . 1 1 63 63 GLU CA C 13 60.392 0.13 . 1 . . . . 63 E CA . 17002 1
755 . 1 1 63 63 GLU CB C 13 29.080 0.13 . 1 . . . . 63 E CB . 17002 1
756 . 1 1 63 63 GLU CG C 13 36.228 0.13 . 1 . . . . 63 E CG . 17002 1
757 . 1 1 63 63 GLU N N 15 126.694 0.12 . 1 . . . . 63 E N . 17002 1
758 . 1 1 64 64 ALA H H 1 9.035 0.02 . 1 . . . . 64 A H . 17002 1
759 . 1 1 64 64 ALA HA H 1 3.991 0.02 . 1 . . . . 64 A HA . 17002 1
760 . 1 1 64 64 ALA HB1 H 1 1.358 0.02 . 1 . . . . 64 A QB . 17002 1
761 . 1 1 64 64 ALA HB2 H 1 1.358 0.02 . 1 . . . . 64 A QB . 17002 1
762 . 1 1 64 64 ALA HB3 H 1 1.358 0.02 . 1 . . . . 64 A QB . 17002 1
763 . 1 1 64 64 ALA C C 13 180.970 0.13 . 1 . . . . 64 A C . 17002 1
764 . 1 1 64 64 ALA CA C 13 55.356 0.13 . 1 . . . . 64 A CA . 17002 1
765 . 1 1 64 64 ALA CB C 13 18.281 0.13 . 1 . . . . 64 A CB . 17002 1
766 . 1 1 64 64 ALA N N 15 118.579 0.12 . 1 . . . . 64 A N . 17002 1
767 . 1 1 65 65 GLU H H 1 7.059 0.02 . 1 . . . . 65 E H . 17002 1
768 . 1 1 65 65 GLU HA H 1 4.018 0.02 . 1 . . . . 65 E HA . 17002 1
769 . 1 1 65 65 GLU HB2 H 1 2.212 0.02 . 2 . . . . 65 E HB2 . 17002 1
770 . 1 1 65 65 GLU HB3 H 1 2.101 0.02 . 2 . . . . 65 E HB3 . 17002 1
771 . 1 1 65 65 GLU HG2 H 1 2.102 0.02 . 2 . . . . 65 E HG2 . 17002 1
772 . 1 1 65 65 GLU HG3 H 1 2.327 0.02 . 2 . . . . 65 E HG3 . 17002 1
773 . 1 1 65 65 GLU C C 13 178.767 0.13 . 1 . . . . 65 E C . 17002 1
774 . 1 1 65 65 GLU CA C 13 58.846 0.13 . 1 . . . . 65 E CA . 17002 1
775 . 1 1 65 65 GLU CB C 13 30.046 0.13 . 1 . . . . 65 E CB . 17002 1
776 . 1 1 65 65 GLU CG C 13 36.290 0.13 . 1 . . . . 65 E CG . 17002 1
777 . 1 1 65 65 GLU N N 15 117.897 0.12 . 1 . . . . 65 E N . 17002 1
778 . 1 1 66 66 VAL H H 1 7.651 0.02 . 1 . . . . 66 V H . 17002 1
779 . 1 1 66 66 VAL HA H 1 3.390 0.02 . 1 . . . . 66 V HA . 17002 1
780 . 1 1 66 66 VAL HB H 1 2.202 0.02 . 1 . . . . 66 V HB . 17002 1
781 . 1 1 66 66 VAL HG11 H 1 0.786 0.02 . 2 . . . . 66 V QG1 . 17002 1
782 . 1 1 66 66 VAL HG12 H 1 0.786 0.02 . 2 . . . . 66 V QG1 . 17002 1
783 . 1 1 66 66 VAL HG13 H 1 0.786 0.02 . 2 . . . . 66 V QG1 . 17002 1
784 . 1 1 66 66 VAL HG21 H 1 0.983 0.02 . 2 . . . . 66 V QG2 . 17002 1
785 . 1 1 66 66 VAL HG22 H 1 0.983 0.02 . 2 . . . . 66 V QG2 . 17002 1
786 . 1 1 66 66 VAL HG23 H 1 0.983 0.02 . 2 . . . . 66 V QG2 . 17002 1
787 . 1 1 66 66 VAL C C 13 177.740 0.13 . 1 . . . . 66 V C . 17002 1
788 . 1 1 66 66 VAL CA C 13 66.662 0.13 . 1 . . . . 66 V CA . 17002 1
789 . 1 1 66 66 VAL CB C 13 32.074 0.13 . 1 . . . . 66 V CB . 17002 1
790 . 1 1 66 66 VAL CG1 C 13 22.147 0.13 . 2 . . . . 66 V CG1 . 17002 1
791 . 1 1 66 66 VAL CG2 C 13 23.465 0.13 . 2 . . . . 66 V CG2 . 17002 1
792 . 1 1 66 66 VAL N N 15 121.569 0.12 . 1 . . . . 66 V N . 17002 1
793 . 1 1 67 67 ARG H H 1 8.495 0.02 . 1 . . . . 67 R H . 17002 1
794 . 1 1 67 67 ARG HA H 1 3.916 0.02 . 1 . . . . 67 R HA . 17002 1
795 . 1 1 67 67 ARG HB2 H 1 1.709 0.02 . 2 . . . . 67 R QB . 17002 1
796 . 1 1 67 67 ARG HB3 H 1 1.709 0.02 . 2 . . . . 67 R QB . 17002 1
797 . 1 1 67 67 ARG HD2 H 1 3.034 0.02 . 2 . . . . 67 R HD2 . 17002 1
798 . 1 1 67 67 ARG HD3 H 1 3.173 0.02 . 2 . . . . 67 R HD3 . 17002 1
799 . 1 1 67 67 ARG HE H 1 8.396 0.02 . 1 . . . . 67 R HE . 17002 1
800 . 1 1 67 67 ARG HG2 H 1 1.819 0.02 . 2 . . . . 67 R HG2 . 17002 1
801 . 1 1 67 67 ARG HG3 H 1 1.644 0.02 . 2 . . . . 67 R HG3 . 17002 1
802 . 1 1 67 67 ARG CA C 13 60.390 0.13 . 1 . . . . 67 R CA . 17002 1
803 . 1 1 67 67 ARG CB C 13 30.361 0.13 . 1 . . . . 67 R CB . 17002 1
804 . 1 1 67 67 ARG CD C 13 42.864 0.13 . 1 . . . . 67 R CD . 17002 1
805 . 1 1 67 67 ARG CG C 13 29.880 0.13 . 1 . . . . 67 R CG . 17002 1
806 . 1 1 67 67 ARG N N 15 117.834 0.12 . 1 . . . . 67 R N . 17002 1
807 . 1 1 67 67 ARG NE N 15 85.021 0.12 . 1 . . . . 67 R NE . 17002 1
808 . 1 1 68 68 ALA H H 1 7.760 0.02 . 1 . . . . 68 A H . 17002 1
809 . 1 1 68 68 ALA HA H 1 4.141 0.02 . 1 . . . . 68 A HA . 17002 1
810 . 1 1 68 68 ALA HB1 H 1 1.381 0.02 . 1 . . . . 68 A QB . 17002 1
811 . 1 1 68 68 ALA HB2 H 1 1.381 0.02 . 1 . . . . 68 A QB . 17002 1
812 . 1 1 68 68 ALA HB3 H 1 1.381 0.02 . 1 . . . . 68 A QB . 17002 1
813 . 1 1 68 68 ALA C C 13 181.026 0.13 . 1 . . . . 68 A C . 17002 1
814 . 1 1 68 68 ALA CA C 13 54.939 0.13 . 1 . . . . 68 A CA . 17002 1
815 . 1 1 68 68 ALA CB C 13 18.019 0.13 . 1 . . . . 68 A CB . 17002 1
816 . 1 1 68 68 ALA N N 15 121.407 0.12 . 1 . . . . 68 A N . 17002 1
817 . 1 1 69 69 LYS H H 1 8.056 0.02 . 1 . . . . 69 K H . 17002 1
818 . 1 1 69 69 LYS HA H 1 3.734 0.02 . 1 . . . . 69 K HA . 17002 1
819 . 1 1 69 69 LYS HB2 H 1 1.365 0.02 . 2 . . . . 69 K HB2 . 17002 1
820 . 1 1 69 69 LYS HB3 H 1 1.141 0.02 . 2 . . . . 69 K HB3 . 17002 1
821 . 1 1 69 69 LYS HD2 H 1 0.738 0.02 . 2 . . . . 69 K HD2 . 17002 1
822 . 1 1 69 69 LYS HD3 H 1 1.022 0.02 . 2 . . . . 69 K HD3 . 17002 1
823 . 1 1 69 69 LYS HE2 H 1 1.671 0.02 . 2 . . . . 69 K HE2 . 17002 1
824 . 1 1 69 69 LYS HE3 H 1 1.821 0.02 . 2 . . . . 69 K HE3 . 17002 1
825 . 1 1 69 69 LYS HG2 H 1 -0.476 0.02 . 2 . . . . 69 K HG2 . 17002 1
826 . 1 1 69 69 LYS HG3 H 1 0.383 0.02 . 2 . . . . 69 K HG3 . 17002 1
827 . 1 1 69 69 LYS C C 13 177.766 0.13 . 1 . . . . 69 K C . 17002 1
828 . 1 1 69 69 LYS CA C 13 57.219 0.13 . 1 . . . . 69 K CA . 17002 1
829 . 1 1 69 69 LYS CB C 13 30.703 0.13 . 1 . . . . 69 K CB . 17002 1
830 . 1 1 69 69 LYS CD C 13 27.575 0.13 . 1 . . . . 69 K CD . 17002 1
831 . 1 1 69 69 LYS CE C 13 41.108 0.13 . 1 . . . . 69 K CE . 17002 1
832 . 1 1 69 69 LYS CG C 13 22.433 0.13 . 1 . . . . 69 K CG . 17002 1
833 . 1 1 69 69 LYS N N 15 121.991 0.12 . 1 . . . . 69 K N . 17002 1
834 . 1 1 70 70 TYR H H 1 7.847 0.02 . 1 . . . . 70 Y H . 17002 1
835 . 1 1 70 70 TYR HA H 1 4.091 0.02 . 1 . . . . 70 Y HA . 17002 1
836 . 1 1 70 70 TYR HB2 H 1 2.948 0.02 . 2 . . . . 70 Y HB2 . 17002 1
837 . 1 1 70 70 TYR HB3 H 1 3.011 0.02 . 2 . . . . 70 Y HB3 . 17002 1
838 . 1 1 70 70 TYR HD1 H 1 6.972 0.02 . 3 . . . . 70 Y QD . 17002 1
839 . 1 1 70 70 TYR HD2 H 1 6.972 0.02 . 3 . . . . 70 Y QD . 17002 1
840 . 1 1 70 70 TYR HE1 H 1 6.592 0.02 . 3 . . . . 70 Y QE . 17002 1
841 . 1 1 70 70 TYR HE2 H 1 6.592 0.02 . 3 . . . . 70 Y QE . 17002 1
842 . 1 1 70 70 TYR C C 13 178.846 0.13 . 1 . . . . 70 Y C . 17002 1
843 . 1 1 70 70 TYR CA C 13 62.479 0.13 . 1 . . . . 70 Y CA . 17002 1
844 . 1 1 70 70 TYR CB C 13 39.225 0.13 . 1 . . . . 70 Y CB . 17002 1
845 . 1 1 70 70 TYR CD1 C 13 132.269 0.13 . 3 . . . . 70 Y CD1 . 17002 1
846 . 1 1 70 70 TYR CE1 C 13 118.054 0.13 . 3 . . . . 70 Y CE1 . 17002 1
847 . 1 1 70 70 TYR N N 15 118.649 0.12 . 1 . . . . 70 Y N . 17002 1
848 . 1 1 71 71 GLU H H 1 7.733 0.02 . 1 . . . . 71 E H . 17002 1
849 . 1 1 71 71 GLU HA H 1 3.831 0.02 . 1 . . . . 71 E HA . 17002 1
850 . 1 1 71 71 GLU HB2 H 1 2.009 0.02 . 2 . . . . 71 E QB . 17002 1
851 . 1 1 71 71 GLU HB3 H 1 2.009 0.02 . 2 . . . . 71 E QB . 17002 1
852 . 1 1 71 71 GLU HG2 H 1 2.321 0.02 . 2 . . . . 71 E QG . 17002 1
853 . 1 1 71 71 GLU HG3 H 1 2.321 0.02 . 2 . . . . 71 E QG . 17002 1
854 . 1 1 71 71 GLU C C 13 180.540 0.13 . 1 . . . . 71 E C . 17002 1
855 . 1 1 71 71 GLU CA C 13 58.760 0.13 . 1 . . . . 71 E CA . 17002 1
856 . 1 1 71 71 GLU CB C 13 29.671 0.13 . 1 . . . . 71 E CB . 17002 1
857 . 1 1 71 71 GLU CG C 13 35.794 0.13 . 1 . . . . 71 E CG . 17002 1
858 . 1 1 71 71 GLU N N 15 116.859 0.12 . 1 . . . . 71 E N . 17002 1
859 . 1 1 72 72 GLY H H 1 8.283 0.02 . 1 . . . . 72 G H . 17002 1
860 . 1 1 72 72 GLY HA2 H 1 3.905 0.02 . 2 . . . . 72 G HA2 . 17002 1
861 . 1 1 72 72 GLY HA3 H 1 3.842 0.02 . 2 . . . . 72 G HA3 . 17002 1
862 . 1 1 72 72 GLY C C 13 176.371 0.13 . 1 . . . . 72 G C . 17002 1
863 . 1 1 72 72 GLY CA C 13 46.882 0.13 . 1 . . . . 72 G CA . 17002 1
864 . 1 1 72 72 GLY N N 15 108.600 0.12 . 1 . . . . 72 G N . 17002 1
865 . 1 1 73 73 LEU H H 1 7.846 0.02 . 1 . . . . 73 L H . 17002 1
866 . 1 1 73 73 LEU HA H 1 4.059 0.02 . 1 . . . . 73 L HA . 17002 1
867 . 1 1 73 73 LEU HB2 H 1 1.711 0.02 . 2 . . . . 73 L HB2 . 17002 1
868 . 1 1 73 73 LEU HB3 H 1 1.254 0.02 . 2 . . . . 73 L HB3 . 17002 1
869 . 1 1 73 73 LEU HD11 H 1 0.679 0.02 . 2 . . . . 73 L QD1 . 17002 1
870 . 1 1 73 73 LEU HD12 H 1 0.679 0.02 . 2 . . . . 73 L QD1 . 17002 1
871 . 1 1 73 73 LEU HD13 H 1 0.679 0.02 . 2 . . . . 73 L QD1 . 17002 1
872 . 1 1 73 73 LEU HD21 H 1 0.739 0.02 . 2 . . . . 73 L QD2 . 17002 1
873 . 1 1 73 73 LEU HD22 H 1 0.739 0.02 . 2 . . . . 73 L QD2 . 17002 1
874 . 1 1 73 73 LEU HD23 H 1 0.739 0.02 . 2 . . . . 73 L QD2 . 17002 1
875 . 1 1 73 73 LEU HG H 1 1.679 0.02 . 1 . . . . 73 L HG . 17002 1
876 . 1 1 73 73 LEU C C 13 178.401 0.13 . 1 . . . . 73 L C . 17002 1
877 . 1 1 73 73 LEU CA C 13 56.038 0.13 . 1 . . . . 73 L CA . 17002 1
878 . 1 1 73 73 LEU CB C 13 43.491 0.13 . 1 . . . . 73 L CB . 17002 1
879 . 1 1 73 73 LEU CD1 C 13 25.835 0.13 . 2 . . . . 73 L CD1 . 17002 1
880 . 1 1 73 73 LEU CD2 C 13 22.694 0.13 . 2 . . . . 73 L CD2 . 17002 1
881 . 1 1 73 73 LEU CG C 13 27.011 0.13 . 1 . . . . 73 L CG . 17002 1
882 . 1 1 73 73 LEU N N 15 118.847 0.12 . 1 . . . . 73 L N . 17002 1
883 . 1 1 74 74 MET H H 1 7.342 0.02 . 1 . . . . 74 M H . 17002 1
884 . 1 1 74 74 MET HA H 1 4.217 0.02 . 1 . . . . 74 M HA . 17002 1
885 . 1 1 74 74 MET HB2 H 1 1.833 0.02 . 2 . . . . 74 M HB2 . 17002 1
886 . 1 1 74 74 MET HB3 H 1 2.135 0.02 . 2 . . . . 74 M HB3 . 17002 1
887 . 1 1 74 74 MET HE1 H 1 1.760 0.02 . 1 . . . . 74 M QE . 17002 1
888 . 1 1 74 74 MET HE2 H 1 1.760 0.02 . 1 . . . . 74 M QE . 17002 1
889 . 1 1 74 74 MET HE3 H 1 1.760 0.02 . 1 . . . . 74 M QE . 17002 1
890 . 1 1 74 74 MET HG2 H 1 2.633 0.02 . 2 . . . . 74 M HG2 . 17002 1
891 . 1 1 74 74 MET HG3 H 1 2.317 0.02 . 2 . . . . 74 M HG3 . 17002 1
892 . 1 1 74 74 MET C C 13 177.113 0.13 . 1 . . . . 74 M C . 17002 1
893 . 1 1 74 74 MET CA C 13 57.636 0.13 . 1 . . . . 74 M CA . 17002 1
894 . 1 1 74 74 MET CB C 13 30.740 0.13 . 1 . . . . 74 M CB . 17002 1
895 . 1 1 74 74 MET CE C 13 17.500 0.13 . 1 . . . . 74 M CE . 17002 1
896 . 1 1 74 74 MET CG C 13 32.519 0.13 . 1 . . . . 74 M CG . 17002 1
897 . 1 1 74 74 MET N N 15 120.561 0.12 . 1 . . . . 74 M N . 17002 1
898 . 1 1 75 75 ALA H H 1 7.670 0.02 . 1 . . . . 75 A H . 17002 1
899 . 1 1 75 75 ALA HA H 1 3.951 0.02 . 1 . . . . 75 A HA . 17002 1
900 . 1 1 75 75 ALA HB1 H 1 1.380 0.02 . 1 . . . . 75 A QB . 17002 1
901 . 1 1 75 75 ALA HB2 H 1 1.380 0.02 . 1 . . . . 75 A QB . 17002 1
902 . 1 1 75 75 ALA HB3 H 1 1.380 0.02 . 1 . . . . 75 A QB . 17002 1
903 . 1 1 75 75 ALA C C 13 180.790 0.13 . 1 . . . . 75 A C . 17002 1
904 . 1 1 75 75 ALA CA C 13 55.041 0.13 . 1 . . . . 75 A CA . 17002 1
905 . 1 1 75 75 ALA CB C 13 18.140 0.13 . 1 . . . . 75 A CB . 17002 1
906 . 1 1 75 75 ALA N N 15 120.816 0.12 . 1 . . . . 75 A N . 17002 1
907 . 1 1 76 76 VAL H H 1 6.610 0.02 . 1 . . . . 76 V H . 17002 1
908 . 1 1 76 76 VAL HA H 1 3.563 0.02 . 1 . . . . 76 V HA . 17002 1
909 . 1 1 76 76 VAL HB H 1 1.939 0.02 . 1 . . . . 76 V HB . 17002 1
910 . 1 1 76 76 VAL HG11 H 1 0.942 0.02 . 2 . . . . 76 V QG1 . 17002 1
911 . 1 1 76 76 VAL HG12 H 1 0.942 0.02 . 2 . . . . 76 V QG1 . 17002 1
912 . 1 1 76 76 VAL HG13 H 1 0.942 0.02 . 2 . . . . 76 V QG1 . 17002 1
913 . 1 1 76 76 VAL HG21 H 1 0.830 0.02 . 2 . . . . 76 V QG2 . 17002 1
914 . 1 1 76 76 VAL HG22 H 1 0.830 0.02 . 2 . . . . 76 V QG2 . 17002 1
915 . 1 1 76 76 VAL HG23 H 1 0.830 0.02 . 2 . . . . 76 V QG2 . 17002 1
916 . 1 1 76 76 VAL C C 13 177.669 0.13 . 1 . . . . 76 V C . 17002 1
917 . 1 1 76 76 VAL CA C 13 65.550 0.13 . 1 . . . . 76 V CA . 17002 1
918 . 1 1 76 76 VAL CB C 13 32.060 0.13 . 1 . . . . 76 V CB . 17002 1
919 . 1 1 76 76 VAL CG1 C 13 21.656 0.13 . 2 . . . . 76 V CG1 . 17002 1
920 . 1 1 76 76 VAL CG2 C 13 21.403 0.13 . 2 . . . . 76 V CG2 . 17002 1
921 . 1 1 76 76 VAL N N 15 118.109 0.12 . 1 . . . . 76 V N . 17002 1
922 . 1 1 77 77 ALA H H 1 8.236 0.02 . 1 . . . . 77 A H . 17002 1
923 . 1 1 77 77 ALA HA H 1 3.636 0.02 . 1 . . . . 77 A HA . 17002 1
924 . 1 1 77 77 ALA HB1 H 1 1.334 0.02 . 1 . . . . 77 A QB . 17002 1
925 . 1 1 77 77 ALA HB2 H 1 1.334 0.02 . 1 . . . . 77 A QB . 17002 1
926 . 1 1 77 77 ALA HB3 H 1 1.334 0.02 . 1 . . . . 77 A QB . 17002 1
927 . 1 1 77 77 ALA C C 13 179.074 0.13 . 1 . . . . 77 A C . 17002 1
928 . 1 1 77 77 ALA CA C 13 55.537 0.13 . 1 . . . . 77 A CA . 17002 1
929 . 1 1 77 77 ALA CB C 13 18.914 0.13 . 1 . . . . 77 A CB . 17002 1
930 . 1 1 77 77 ALA N N 15 122.177 0.12 . 1 . . . . 77 A N . 17002 1
931 . 1 1 78 78 LYS H H 1 8.160 0.02 . 1 . . . . 78 K H . 17002 1
932 . 1 1 78 78 LYS HA H 1 3.689 0.02 . 1 . . . . 78 K HA . 17002 1
933 . 1 1 78 78 LYS HB2 H 1 1.663 0.02 . 2 . . . . 78 K HB2 . 17002 1
934 . 1 1 78 78 LYS HB3 H 1 1.730 0.02 . 2 . . . . 78 K HB3 . 17002 1
935 . 1 1 78 78 LYS HD2 H 1 1.540 0.02 . 2 . . . . 78 K QD . 17002 1
936 . 1 1 78 78 LYS HD3 H 1 1.540 0.02 . 2 . . . . 78 K QD . 17002 1
937 . 1 1 78 78 LYS HE2 H 1 2.797 0.02 . 2 . . . . 78 K QE . 17002 1
938 . 1 1 78 78 LYS HE3 H 1 2.797 0.02 . 2 . . . . 78 K QE . 17002 1
939 . 1 1 78 78 LYS HG2 H 1 1.593 0.02 . 2 . . . . 78 K HG2 . 17002 1
940 . 1 1 78 78 LYS HG3 H 1 1.191 0.02 . 2 . . . . 78 K HG3 . 17002 1
941 . 1 1 78 78 LYS C C 13 178.589 0.13 . 1 . . . . 78 K C . 17002 1
942 . 1 1 78 78 LYS CA C 13 60.306 0.13 . 1 . . . . 78 K CA . 17002 1
943 . 1 1 78 78 LYS CB C 13 32.697 0.13 . 1 . . . . 78 K CB . 17002 1
944 . 1 1 78 78 LYS CD C 13 29.763 0.13 . 1 . . . . 78 K CD . 17002 1
945 . 1 1 78 78 LYS CE C 13 42.168 0.13 . 1 . . . . 78 K CE . 17002 1
946 . 1 1 78 78 LYS CG C 13 26.745 0.13 . 1 . . . . 78 K CG . 17002 1
947 . 1 1 78 78 LYS N N 15 114.689 0.12 . 1 . . . . 78 K N . 17002 1
948 . 1 1 79 79 ALA H H 1 7.492 0.02 . 1 . . . . 79 A H . 17002 1
949 . 1 1 79 79 ALA HA H 1 4.040 0.02 . 1 . . . . 79 A HA . 17002 1
950 . 1 1 79 79 ALA HB1 H 1 1.426 0.02 . 1 . . . . 79 A QB . 17002 1
951 . 1 1 79 79 ALA HB2 H 1 1.426 0.02 . 1 . . . . 79 A QB . 17002 1
952 . 1 1 79 79 ALA HB3 H 1 1.426 0.02 . 1 . . . . 79 A QB . 17002 1
953 . 1 1 79 79 ALA C C 13 180.378 0.13 . 1 . . . . 79 A C . 17002 1
954 . 1 1 79 79 ALA CA C 13 54.901 0.13 . 1 . . . . 79 A CA . 17002 1
955 . 1 1 79 79 ALA CB C 13 17.992 0.13 . 1 . . . . 79 A CB . 17002 1
956 . 1 1 79 79 ALA N N 15 120.705 0.12 . 1 . . . . 79 A N . 17002 1
957 . 1 1 80 80 GLN H H 1 8.045 0.02 . 1 . . . . 80 Q H . 17002 1
958 . 1 1 80 80 GLN HA H 1 4.022 0.02 . 1 . . . . 80 Q HA . 17002 1
959 . 1 1 80 80 GLN HB2 H 1 1.848 0.02 . 2 . . . . 80 Q HB2 . 17002 1
960 . 1 1 80 80 GLN HB3 H 1 2.070 0.02 . 2 . . . . 80 Q HB3 . 17002 1
961 . 1 1 80 80 GLN HE21 H 1 7.399 0.02 . 2 . . . . 80 Q HE21 . 17002 1
962 . 1 1 80 80 GLN HE22 H 1 6.162 0.02 . 2 . . . . 80 Q HE22 . 17002 1
963 . 1 1 80 80 GLN HG2 H 1 2.315 0.02 . 2 . . . . 80 Q HG2 . 17002 1
964 . 1 1 80 80 GLN HG3 H 1 2.733 0.02 . 2 . . . . 80 Q HG3 . 17002 1
965 . 1 1 80 80 GLN C C 13 178.813 0.13 . 1 . . . . 80 Q C . 17002 1
966 . 1 1 80 80 GLN CA C 13 58.733 0.13 . 1 . . . . 80 Q CA . 17002 1
967 . 1 1 80 80 GLN CB C 13 28.361 0.13 . 1 . . . . 80 Q CB . 17002 1
968 . 1 1 80 80 GLN CG C 13 33.944 0.13 . 1 . . . . 80 Q CG . 17002 1
969 . 1 1 80 80 GLN N N 15 117.293 0.12 . 1 . . . . 80 Q N . 17002 1
970 . 1 1 80 80 GLN NE2 N 15 108.568 0.12 . 1 . . . . 80 Q NE2 . 17002 1
971 . 1 1 81 81 LEU H H 1 7.749 0.02 . 1 . . . . 81 L H . 17002 1
972 . 1 1 81 81 LEU HA H 1 3.939 0.02 . 1 . . . . 81 L HA . 17002 1
973 . 1 1 81 81 LEU HB2 H 1 1.696 0.02 . 2 . . . . 81 L HB2 . 17002 1
974 . 1 1 81 81 LEU HB3 H 1 1.414 0.02 . 2 . . . . 81 L HB3 . 17002 1
975 . 1 1 81 81 LEU HD11 H 1 0.676 0.02 . 2 . . . . 81 L QD1 . 17002 1
976 . 1 1 81 81 LEU HD12 H 1 0.676 0.02 . 2 . . . . 81 L QD1 . 17002 1
977 . 1 1 81 81 LEU HD13 H 1 0.676 0.02 . 2 . . . . 81 L QD1 . 17002 1
978 . 1 1 81 81 LEU HD21 H 1 0.727 0.02 . 2 . . . . 81 L QD2 . 17002 1
979 . 1 1 81 81 LEU HD22 H 1 0.727 0.02 . 2 . . . . 81 L QD2 . 17002 1
980 . 1 1 81 81 LEU HD23 H 1 0.727 0.02 . 2 . . . . 81 L QD2 . 17002 1
981 . 1 1 81 81 LEU HG H 1 1.702 0.02 . 1 . . . . 81 L HG . 17002 1
982 . 1 1 81 81 LEU CA C 13 57.015 0.13 . 1 . . . . 81 L CA . 17002 1
983 . 1 1 81 81 LEU CB C 13 41.611 0.13 . 1 . . . . 81 L CB . 17002 1
984 . 1 1 81 81 LEU CD1 C 13 25.750 0.13 . 2 . . . . 81 L CD1 . 17002 1
985 . 1 1 81 81 LEU CD2 C 13 23.251 0.13 . 2 . . . . 81 L CD2 . 17002 1
986 . 1 1 81 81 LEU CG C 13 27.557 0.13 . 1 . . . . 81 L CG . 17002 1
987 . 1 1 81 81 LEU N N 15 117.661 0.12 . 1 . . . . 81 L N . 17002 1
988 . 1 1 82 82 MET H H 1 7.635 0.02 . 1 . . . . 82 M H . 17002 1
989 . 1 1 82 82 MET HA H 1 4.034 0.02 . 1 . . . . 82 M HA . 17002 1
990 . 1 1 82 82 MET HB2 H 1 2.085 0.02 . 2 . . . . 82 M QB . 17002 1
991 . 1 1 82 82 MET HB3 H 1 2.085 0.02 . 2 . . . . 82 M QB . 17002 1
992 . 1 1 82 82 MET HE1 H 1 2.001 0.02 . 1 . . . . 82 M QE . 17002 1
993 . 1 1 82 82 MET HE2 H 1 2.001 0.02 . 1 . . . . 82 M QE . 17002 1
994 . 1 1 82 82 MET HE3 H 1 2.001 0.02 . 1 . . . . 82 M QE . 17002 1
995 . 1 1 82 82 MET HG2 H 1 2.626 0.02 . 2 . . . . 82 M HG2 . 17002 1
996 . 1 1 82 82 MET HG3 H 1 2.579 0.02 . 2 . . . . 82 M HG3 . 17002 1
997 . 1 1 82 82 MET C C 13 177.323 0.13 . 1 . . . . 82 M C . 17002 1
998 . 1 1 82 82 MET CA C 13 54.850 0.13 . 1 . . . . 82 M CA . 17002 1
999 . 1 1 82 82 MET CB C 13 32.225 0.13 . 1 . . . . 82 M CB . 17002 1
1000 . 1 1 82 82 MET CE C 13 16.910 0.13 . 1 . . . . 82 M CE . 17002 1
1001 . 1 1 82 82 MET CG C 13 32.209 0.13 . 1 . . . . 82 M CG . 17002 1
1002 . 1 1 82 82 MET N N 15 117.653 0.12 . 1 . . . . 82 M N . 17002 1
1003 . 1 1 83 83 ASP H H 1 7.632 0.02 . 1 . . . . 83 D H . 17002 1
1004 . 1 1 83 83 ASP HA H 1 4.597 0.02 . 1 . . . . 83 D HA . 17002 1
1005 . 1 1 83 83 ASP HB2 H 1 2.650 0.02 . 2 . . . . 83 D HB2 . 17002 1
1006 . 1 1 83 83 ASP HB3 H 1 2.730 0.02 . 2 . . . . 83 D HB3 . 17002 1
1007 . 1 1 83 83 ASP C C 13 176.491 0.13 . 1 . . . . 83 D C . 17002 1
1008 . 1 1 83 83 ASP CA C 13 55.154 0.13 . 1 . . . . 83 D CA . 17002 1
1009 . 1 1 83 83 ASP CB C 13 41.420 0.13 . 1 . . . . 83 D CB . 17002 1
1010 . 1 1 83 83 ASP N N 15 118.431 0.12 . 1 . . . . 83 D N . 17002 1
1011 . 1 1 84 84 GLU H H 1 7.537 0.02 . 1 . . . . 84 E H . 17002 1
1012 . 1 1 84 84 GLU HA H 1 4.229 0.02 . 1 . . . . 84 E HA . 17002 1
1013 . 1 1 84 84 GLU HB2 H 1 2.082 0.02 . 2 . . . . 84 E HB2 . 17002 1
1014 . 1 1 84 84 GLU HB3 H 1 1.852 0.02 . 2 . . . . 84 E HB3 . 17002 1
1015 . 1 1 84 84 GLU HG2 H 1 2.384 0.02 . 2 . . . . 84 E HG2 . 17002 1
1016 . 1 1 84 84 GLU HG3 H 1 2.178 0.02 . 2 . . . . 84 E HG3 . 17002 1
1017 . 1 1 84 84 GLU C C 13 175.600 0.13 . 1 . . . . 84 E C . 17002 1
1018 . 1 1 84 84 GLU CA C 13 56.304 0.13 . 1 . . . . 84 E CA . 17002 1
1019 . 1 1 84 84 GLU CB C 13 30.658 0.13 . 1 . . . . 84 E CB . 17002 1
1020 . 1 1 84 84 GLU CG C 13 36.221 0.13 . 1 . . . . 84 E CG . 17002 1
1021 . 1 1 84 84 GLU N N 15 119.300 0.12 . 1 . . . . 84 E N . 17002 1
1022 . 1 1 85 85 LEU H H 1 7.455 0.02 . 1 . . . . 85 L H . 17002 1
1023 . 1 1 85 85 LEU HA H 1 4.051 0.02 . 1 . . . . 85 L HA . 17002 1
1024 . 1 1 85 85 LEU HB2 H 1 1.595 0.02 . 2 . . . . 85 L HB2 . 17002 1
1025 . 1 1 85 85 LEU HB3 H 1 1.490 0.02 . 2 . . . . 85 L HB3 . 17002 1
1026 . 1 1 85 85 LEU HD11 H 1 0.863 0.02 . 2 . . . . 85 L QD1 . 17002 1
1027 . 1 1 85 85 LEU HD12 H 1 0.863 0.02 . 2 . . . . 85 L QD1 . 17002 1
1028 . 1 1 85 85 LEU HD13 H 1 0.863 0.02 . 2 . . . . 85 L QD1 . 17002 1
1029 . 1 1 85 85 LEU HD21 H 1 0.803 0.02 . 2 . . . . 85 L QD2 . 17002 1
1030 . 1 1 85 85 LEU HD22 H 1 0.803 0.02 . 2 . . . . 85 L QD2 . 17002 1
1031 . 1 1 85 85 LEU HD23 H 1 0.803 0.02 . 2 . . . . 85 L QD2 . 17002 1
1032 . 1 1 85 85 LEU CA C 13 57.076 0.13 . 1 . . . . 85 L CA . 17002 1
1033 . 1 1 85 85 LEU CB C 13 43.361 0.13 . 1 . . . . 85 L CB . 17002 1
1034 . 1 1 85 85 LEU CD1 C 13 25.700 0.13 . 2 . . . . 85 L CD1 . 17002 1
1035 . 1 1 85 85 LEU CD2 C 13 23.720 0.13 . 2 . . . . 85 L CD2 . 17002 1
1036 . 1 1 85 85 LEU CG C 13 27.204 0.13 . 1 . . . . 85 L CG . 17002 1
1037 . 1 1 85 85 LEU N N 15 127.385 0.12 . 1 . . . . 85 L N . 17002 1
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