Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 19178
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC/HMQC' 1 $sample_1 isotropic 19178 1
2 '3D HNCACB' 1 $sample_1 isotropic 19178 1
3 'cbcaconh (H[N[co[{CA|ca[C]}]]])' 1 $sample_1 isotropic 19178 1
4 '3D HNCO' 1 $sample_1 isotropic 19178 1
5 'hncaco (H[N[ca[CO]]])' 1 $sample_1 isotropic 19178 1
6 '3D HBHA(CO)NH' . . . 19178 1
7 '2D 1H-13C HSQC aliphatic' . . . 19178 1
8 '2D 1H-13C HSQC aromatic' . . . 19178 1
9 '3D HCCH-TOCSY' . . . 19178 1
10 '3D H(CCO)NH' . . . 19178 1
11 '3D C(CO)NH' . . . 19178 1
14 '2D CBHD' . . . 19178 1
15 '2D CBHE' . . . 19178 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.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 MET HE1 H 1 2.058 0.03 . 1 . . 375 . . 1 MET HE1 . 19178 1
2 . 1 1 1 1 MET HE2 H 1 2.058 0.03 . 1 . . 375 . . 1 MET HE2 . 19178 1
3 . 1 1 1 1 MET HE3 H 1 2.058 0.03 . 1 . . 375 . . 1 MET HE3 . 19178 1
4 . 1 1 1 1 MET CE C 13 16.839 0.20 . 1 . . 374 . . 1 MET CE . 19178 1
5 . 1 1 4 4 GLY H H 1 8.514 0.03 . 1 . . 12 . . 4 GLY H . 19178 1
6 . 1 1 4 4 GLY N N 15 110.601 0.10 . 1 . . 11 . . 4 GLY N . 19178 1
7 . 1 1 5 5 VAL H H 1 8.028 0.03 . 1 . . 98 . . 5 VAL H . 19178 1
8 . 1 1 5 5 VAL HG11 H 1 0.926 0.03 . 2 . . 392 . . 5 VAL HG11 . 19178 1
9 . 1 1 5 5 VAL HG12 H 1 0.926 0.03 . 2 . . 392 . . 5 VAL HG12 . 19178 1
10 . 1 1 5 5 VAL HG13 H 1 0.926 0.03 . 2 . . 392 . . 5 VAL HG13 . 19178 1
11 . 1 1 5 5 VAL HG21 H 1 0.915 0.03 . 2 . . 390 . . 5 VAL HG21 . 19178 1
12 . 1 1 5 5 VAL HG22 H 1 0.915 0.03 . 2 . . 390 . . 5 VAL HG22 . 19178 1
13 . 1 1 5 5 VAL HG23 H 1 0.915 0.03 . 2 . . 390 . . 5 VAL HG23 . 19178 1
14 . 1 1 5 5 VAL CG1 C 13 21.114 0.20 . 2 . . 391 . . 5 VAL CG1 . 19178 1
15 . 1 1 5 5 VAL CG2 C 13 20.331 0.20 . 2 . . 389 . . 5 VAL CG2 . 19178 1
16 . 1 1 5 5 VAL N N 15 119.058 0.10 . 1 . . 97 . . 5 VAL N . 19178 1
17 . 1 1 6 6 GLU H H 1 8.576 0.03 . 1 . . 121 . . 6 GLU H . 19178 1
18 . 1 1 6 6 GLU N N 15 124.028 0.10 . 1 . . 120 . . 6 GLU N . 19178 1
19 . 1 1 7 7 MET H H 1 8.354 0.03 . 1 . . 134 . . 7 MET H . 19178 1
20 . 1 1 7 7 MET N N 15 121.533 0.10 . 1 . . 133 . . 7 MET N . 19178 1
21 . 1 1 8 8 SER H H 1 8.475 0.03 . 1 . . 101 . . 8 SER H . 19178 1
22 . 1 1 8 8 SER N N 15 117.557 0.10 . 1 . . 102 . . 8 SER N . 19178 1
23 . 1 1 9 9 ILE H H 1 8.169 0.03 . 1 . . 128 . . 9 ILE H . 19178 1
24 . 1 1 9 9 ILE HG21 H 1 0.815 0.03 . 1 . . 646 . . 9 ILE HG21 . 19178 1
25 . 1 1 9 9 ILE HG22 H 1 0.815 0.03 . 1 . . 646 . . 9 ILE HG22 . 19178 1
26 . 1 1 9 9 ILE HG23 H 1 0.815 0.03 . 1 . . 646 . . 9 ILE HG23 . 19178 1
27 . 1 1 9 9 ILE HD11 H 1 0.808 0.03 . 1 . . 648 . . 9 ILE HD11 . 19178 1
28 . 1 1 9 9 ILE HD12 H 1 0.808 0.03 . 1 . . 648 . . 9 ILE HD12 . 19178 1
29 . 1 1 9 9 ILE HD13 H 1 0.808 0.03 . 1 . . 648 . . 9 ILE HD13 . 19178 1
30 . 1 1 9 9 ILE CA C 13 61.957 0.20 . 1 . . 640 . . 9 ILE CA . 19178 1
31 . 1 1 9 9 ILE CB C 13 38.522 0.20 . 1 . . 641 . . 9 ILE CB . 19178 1
32 . 1 1 9 9 ILE CG1 C 13 27.221 0.20 . 1 . . 642 . . 9 ILE CG1 . 19178 1
33 . 1 1 9 9 ILE CG2 C 13 17.375 0.20 . 1 . . 645 . . 9 ILE CG2 . 19178 1
34 . 1 1 9 9 ILE CD1 C 13 13.129 0.20 . 1 . . 647 . . 9 ILE CD1 . 19178 1
35 . 1 1 9 9 ILE N N 15 121.943 0.10 . 1 . . 129 . . 9 ILE N . 19178 1
36 . 1 1 10 10 HIS H H 1 8.570 0.03 . 1 . . 124 . . 10 HIS H . 19178 1
37 . 1 1 10 10 HIS HA H 1 3.821 0.03 . 1 . . 541 . . 10 HIS HA . 19178 1
38 . 1 1 10 10 HIS HD2 H 1 6.968 0.03 . 1 . . 588 . . 10 HIS HD2 . 19178 1
39 . 1 1 10 10 HIS HE1 H 1 7.689 0.03 . 1 . . 635 . . 10 HIS HE1 . 19178 1
40 . 1 1 10 10 HIS C C 13 174.068 0.20 . 1 . . 305 . . 10 HIS C . 19178 1
41 . 1 1 10 10 HIS CA C 13 56.332 0.20 . 1 . . 319 . . 10 HIS CA . 19178 1
42 . 1 1 10 10 HIS CB C 13 29.901 0.20 . 1 . . 320 . . 10 HIS CB . 19178 1
43 . 1 1 10 10 HIS CD2 C 13 119.994 0.20 . 1 . . 589 . . 10 HIS CD2 . 19178 1
44 . 1 1 10 10 HIS CE1 C 13 138.311 0.20 . 1 . . 598 . . 10 HIS CE1 . 19178 1
45 . 1 1 10 10 HIS N N 15 125.530 0.10 . 1 . . 125 . . 10 HIS N . 19178 1
46 . 1 1 16 16 GLN HA H 1 4.330 0.03 . 1 . . 566 . A 16 GLN HA . 19178 1
47 . 1 1 17 17 GLU H H 1 8.422 0.03 . 1 . . 142 . A 17 GLU H . 19178 1
48 . 1 1 17 17 GLU HA H 1 4.329 0.03 . 1 . . 567 . A 17 GLU HA . 19178 1
49 . 1 1 17 17 GLU HB2 H 1 2.187 0.03 . 2 . . 568 . A 17 GLU HB2 . 19178 1
50 . 1 1 17 17 GLU HB3 H 1 2.178 0.03 . 2 . . 569 . A 17 GLU HB3 . 19178 1
51 . 1 1 17 17 GLU HG2 H 1 2.322 0.03 . 2 . . 571 . A 17 GLU HG2 . 19178 1
52 . 1 1 17 17 GLU HG3 H 1 2.417 0.03 . 2 . . 570 . A 17 GLU HG3 . 19178 1
53 . 1 1 17 17 GLU N N 15 119.126 0.10 . 1 . . 141 . A 17 GLU N . 19178 1
54 . 1 1 18 18 GLN H H 1 8.729 0.03 . 1 . . 110 . A 18 GLN H . 19178 1
55 . 1 1 18 18 GLN HA H 1 4.081 0.03 . 1 . . 747 . A 18 GLN HA . 19178 1
56 . 1 1 18 18 GLN HB2 H 1 2.247 0.03 . 2 . . 658 . A 18 GLN HB2 . 19178 1
57 . 1 1 18 18 GLN HB3 H 1 2.233 0.03 . 2 . . 656 . A 18 GLN HB3 . 19178 1
58 . 1 1 18 18 GLN HG2 H 1 2.053 0.03 . 1 . . 659 . A 18 GLN HG2 . 19178 1
59 . 1 1 18 18 GLN HG3 H 1 2.053 0.03 . 1 . . 657 . A 18 GLN HG3 . 19178 1
60 . 1 1 18 18 GLN N N 15 120.450 0.10 . 1 . . 109 . A 18 GLN N . 19178 1
61 . 1 1 19 19 TRP H H 1 8.561 0.03 . 1 . . 653 . A 19 TRP H . 19178 1
62 . 1 1 19 19 TRP HA H 1 4.125 0.03 . 1 . . 572 . A 19 TRP HA . 19178 1
63 . 1 1 19 19 TRP HB2 H 1 3.351 0.03 . 2 . . 655 . A 19 TRP HB2 . 19178 1
64 . 1 1 19 19 TRP HB3 H 1 3.622 0.03 . 2 . . 654 . A 19 TRP HB3 . 19178 1
65 . 1 1 19 19 TRP HD1 H 1 7.441 0.03 . 1 . . 585 . A 19 TRP HD1 . 19178 1
66 . 1 1 19 19 TRP HE1 H 1 10.133 0.03 . 1 . . 1 . A 19 TRP HE1 . 19178 1
67 . 1 1 19 19 TRP HE3 H 1 7.541 0.03 . 1 . . 583 . A 19 TRP HE3 . 19178 1
68 . 1 1 19 19 TRP HZ2 H 1 7.589 0.03 . 1 . . 581 . A 19 TRP HZ2 . 19178 1
69 . 1 1 19 19 TRP HZ3 H 1 6.932 0.03 . 1 . . 590 . A 19 TRP HZ3 . 19178 1
70 . 1 1 19 19 TRP HH2 H 1 6.918 0.03 . 1 . . 592 . A 19 TRP HH2 . 19178 1
71 . 1 1 19 19 TRP C C 13 179.400 0.20 . 1 . . 346 . A 19 TRP C . 19178 1
72 . 1 1 19 19 TRP CA C 13 62.361 0.20 . 1 . . 349 . A 19 TRP CA . 19178 1
73 . 1 1 19 19 TRP CB C 13 29.938 0.20 . 1 . . 430 . A 19 TRP CB . 19178 1
74 . 1 1 19 19 TRP CD1 C 13 128.105 0.20 . 1 . . 584 . A 19 TRP CD1 . 19178 1
75 . 1 1 19 19 TRP CE3 C 13 120.124 0.20 . 1 . . 582 . A 19 TRP CE3 . 19178 1
76 . 1 1 19 19 TRP CZ2 C 13 114.082 0.20 . 1 . . 580 . A 19 TRP CZ2 . 19178 1
77 . 1 1 19 19 TRP CZ3 C 13 122.183 0.20 . 1 . . 591 . A 19 TRP CZ3 . 19178 1
78 . 1 1 19 19 TRP CH2 C 13 123.991 0.20 . 1 . . 593 . A 19 TRP CH2 . 19178 1
79 . 1 1 19 19 TRP N N 15 121.902 0.10 . 1 . . 113 . A 19 TRP N . 19178 1
80 . 1 1 19 19 TRP NE1 N 15 128.878 0.10 . 1 . . 2 . A 19 TRP NE1 . 19178 1
81 . 1 1 20 20 ALA H H 1 8.828 0.03 . 1 . . 30 . A 20 ALA H . 19178 1
82 . 1 1 20 20 ALA HA H 1 3.815 0.03 . 1 . . 573 . A 20 ALA HA . 19178 1
83 . 1 1 20 20 ALA HB1 H 1 1.658 0.03 . 1 . . 378 . A 20 ALA HB1 . 19178 1
84 . 1 1 20 20 ALA HB2 H 1 1.658 0.03 . 1 . . 378 . A 20 ALA HB2 . 19178 1
85 . 1 1 20 20 ALA HB3 H 1 1.658 0.03 . 1 . . 378 . A 20 ALA HB3 . 19178 1
86 . 1 1 20 20 ALA C C 13 180.433 0.20 . 1 . . 345 . A 20 ALA C . 19178 1
87 . 1 1 20 20 ALA CA C 13 55.619 0.20 . 1 . . 348 . A 20 ALA CA . 19178 1
88 . 1 1 20 20 ALA CB C 13 18.474 0.20 . 1 . . 347 . A 20 ALA CB . 19178 1
89 . 1 1 20 20 ALA N N 15 122.759 0.10 . 1 . . 29 . A 20 ALA N . 19178 1
90 . 1 1 21 21 MET H H 1 8.702 0.03 . 1 . . 22 . A 21 MET H . 19178 1
91 . 1 1 21 21 MET HA H 1 4.479 0.03 . 1 . . 574 . A 21 MET HA . 19178 1
92 . 1 1 21 21 MET HB2 H 1 2.032 0.03 . 1 . . 665 . A 21 MET HB2 . 19178 1
93 . 1 1 21 21 MET HG3 H 1 2.266 0.03 . 1 . . 671 . A 21 MET HG3 . 19178 1
94 . 1 1 21 21 MET HE1 H 1 1.700 0.03 . 1 . . 394 . A 21 MET HE1 . 19178 1
95 . 1 1 21 21 MET HE2 H 1 1.700 0.03 . 1 . . 394 . A 21 MET HE2 . 19178 1
96 . 1 1 21 21 MET HE3 H 1 1.700 0.03 . 1 . . 394 . A 21 MET HE3 . 19178 1
97 . 1 1 21 21 MET C C 13 178.744 0.20 . 1 . . 344 . A 21 MET C . 19178 1
98 . 1 1 21 21 MET CA C 13 56.778 0.20 . 1 . . 662 . A 21 MET CA . 19178 1
99 . 1 1 21 21 MET CB C 13 29.956 0.20 . 1 . . 350 . A 21 MET CB . 19178 1
100 . 1 1 21 21 MET CE C 13 15.913 0.20 . 1 . . 393 . A 21 MET CE . 19178 1
101 . 1 1 21 21 MET N N 15 117.474 0.10 . 1 . . 21 . A 21 MET N . 19178 1
102 . 1 1 22 22 GLN H H 1 8.531 0.03 . 1 . . 167 . A 22 GLN H . 19178 1
103 . 1 1 22 22 GLN HA H 1 4.025 0.03 . 1 . . 575 . A 22 GLN HA . 19178 1
104 . 1 1 22 22 GLN HB2 H 1 2.033 0.03 . 2 . . 704 . A 22 GLN HB2 . 19178 1
105 . 1 1 22 22 GLN HB3 H 1 2.170 0.03 . 2 . . 703 . A 22 GLN HB3 . 19178 1
106 . 1 1 22 22 GLN HG2 H 1 2.464 0.03 . 2 . . 705 . A 22 GLN HG2 . 19178 1
107 . 1 1 22 22 GLN HG3 H 1 2.396 0.03 . 2 . . 576 . A 22 GLN HG3 . 19178 1
108 . 1 1 22 22 GLN HE21 H 1 7.454 0.03 . 1 . . 157 . A 22 GLN HE21 . 19178 1
109 . 1 1 22 22 GLN HE22 H 1 6.930 0.03 . 1 . . 158 . A 22 GLN HE22 . 19178 1
110 . 1 1 22 22 GLN C C 13 180.104 0.20 . 1 . . 343 . A 22 GLN C . 19178 1
111 . 1 1 22 22 GLN CA C 13 58.872 0.20 . 1 . . 352 . A 22 GLN CA . 19178 1
112 . 1 1 22 22 GLN CB C 13 27.880 0.20 . 1 . . 351 . A 22 GLN CB . 19178 1
113 . 1 1 22 22 GLN CG C 13 34.163 0.20 . 1 . . 429 . A 22 GLN CG . 19178 1
114 . 1 1 22 22 GLN N N 15 119.738 0.10 . 1 . . 166 . A 22 GLN N . 19178 1
115 . 1 1 22 22 GLN NE2 N 15 111.834 0.10 . 1 . . 156 . A 22 GLN NE2 . 19178 1
116 . 1 1 23 23 THR H H 1 7.752 0.03 . 1 . . 71 . A 23 THR H . 19178 1
117 . 1 1 23 23 THR HA H 1 3.715 0.03 . 1 . . 577 . A 23 THR HA . 19178 1
118 . 1 1 23 23 THR HB H 1 3.858 0.03 . 1 . . 752 . A 23 THR HB . 19178 1
119 . 1 1 23 23 THR HG21 H 1 0.636 0.03 . 1 . . 384 . A 23 THR HG21 . 19178 1
120 . 1 1 23 23 THR HG22 H 1 0.636 0.03 . 1 . . 384 . A 23 THR HG22 . 19178 1
121 . 1 1 23 23 THR HG23 H 1 0.636 0.03 . 1 . . 384 . A 23 THR HG23 . 19178 1
122 . 1 1 23 23 THR C C 13 177.477 0.20 . 1 . . 342 . A 23 THR C . 19178 1
123 . 1 1 23 23 THR CA C 13 66.380 0.20 . 1 . . 353 . A 23 THR CA . 19178 1
124 . 1 1 23 23 THR CB C 13 67.579 0.20 . 1 . . 706 . A 23 THR CB . 19178 1
125 . 1 1 23 23 THR CG2 C 13 22.043 0.20 . 1 . . 383 . A 23 THR CG2 . 19178 1
126 . 1 1 23 23 THR N N 15 117.049 0.10 . 1 . . 72 . A 23 THR N . 19178 1
127 . 1 1 24 24 LEU H H 1 7.886 0.03 . 1 . . 47 . A 24 LEU H . 19178 1
128 . 1 1 24 24 LEU HA H 1 3.731 0.03 . 1 . . 578 . A 24 LEU HA . 19178 1
129 . 1 1 24 24 LEU HB3 H 1 1.547 0.03 . 1 . . 710 . A 24 LEU HB3 . 19178 1
130 . 1 1 24 24 LEU HD11 H 1 0.467 0.03 . 2 . . 386 . A 24 LEU HD11 . 19178 1
131 . 1 1 24 24 LEU HD12 H 1 0.467 0.03 . 2 . . 386 . A 24 LEU HD12 . 19178 1
132 . 1 1 24 24 LEU HD13 H 1 0.467 0.03 . 2 . . 386 . A 24 LEU HD13 . 19178 1
133 . 1 1 24 24 LEU HD21 H 1 0.513 0.03 . 2 . . 745 . A 24 LEU HD21 . 19178 1
134 . 1 1 24 24 LEU HD22 H 1 0.513 0.03 . 2 . . 745 . A 24 LEU HD22 . 19178 1
135 . 1 1 24 24 LEU HD23 H 1 0.513 0.03 . 2 . . 745 . A 24 LEU HD23 . 19178 1
136 . 1 1 24 24 LEU C C 13 178.544 0.20 . 1 . . 341 . A 24 LEU C . 19178 1
137 . 1 1 24 24 LEU CA C 13 58.882 0.20 . 1 . . 333 . A 24 LEU CA . 19178 1
138 . 1 1 24 24 LEU CB C 13 41.550 0.20 . 1 . . 428 . A 24 LEU CB . 19178 1
139 . 1 1 24 24 LEU CD1 C 13 25.518 0.20 . 2 . . 385 . A 24 LEU CD1 . 19178 1
140 . 1 1 24 24 LEU CD2 C 13 22.728 0.20 . 2 . . 744 . A 24 LEU CD2 . 19178 1
141 . 1 1 24 24 LEU N N 15 125.735 0.10 . 1 . . 48 . A 24 LEU N . 19178 1
142 . 1 1 25 25 MET H H 1 8.619 0.03 . 1 . . 106 . A 25 MET H . 19178 1
143 . 1 1 25 25 MET HA H 1 4.717 0.03 . 1 . . 579 . A 25 MET HA . 19178 1
144 . 1 1 25 25 MET HB2 H 1 2.522 0.03 . 2 . . 668 . A 25 MET HB2 . 19178 1
145 . 1 1 25 25 MET HB3 H 1 2.621 0.03 . 2 . . 661 . A 25 MET HB3 . 19178 1
146 . 1 1 25 25 MET HG2 H 1 2.078 0.03 . 2 . . 670 . A 25 MET HG2 . 19178 1
147 . 1 1 25 25 MET HG3 H 1 2.012 0.03 . 2 . . 669 . A 25 MET HG3 . 19178 1
148 . 1 1 25 25 MET HE1 H 1 1.832 0.03 . 1 . . 373 . A 25 MET HE1 . 19178 1
149 . 1 1 25 25 MET HE2 H 1 1.832 0.03 . 1 . . 373 . A 25 MET HE2 . 19178 1
150 . 1 1 25 25 MET HE3 H 1 1.832 0.03 . 1 . . 373 . A 25 MET HE3 . 19178 1
151 . 1 1 25 25 MET C C 13 181.465 0.20 . 1 . . 340 . A 25 MET C . 19178 1
152 . 1 1 25 25 MET CA C 13 55.604 0.20 . 1 . . 667 . A 25 MET CA . 19178 1
153 . 1 1 25 25 MET CB C 13 32.071 0.20 . 1 . . 663 . A 25 MET CB . 19178 1
154 . 1 1 25 25 MET CG C 13 33.049 0.20 . 1 . . 664 . A 25 MET CG . 19178 1
155 . 1 1 25 25 MET CE C 13 18.321 0.20 . 1 . . 372 . A 25 MET CE . 19178 1
156 . 1 1 25 25 MET N N 15 118.622 0.10 . 1 . . 105 . A 25 MET N . 19178 1
157 . 1 1 26 26 GLY H H 1 8.953 0.03 . 1 . . 9 . A 26 GLY H . 19178 1
158 . 1 1 26 26 GLY HA2 H 1 3.759 0.03 . 2 . . 565 . A 26 GLY HA2 . 19178 1
159 . 1 1 26 26 GLY HA3 H 1 3.912 0.03 . 2 . . 564 . A 26 GLY HA3 . 19178 1
160 . 1 1 26 26 GLY C C 13 174.662 0.20 . 1 . . 339 . A 26 GLY C . 19178 1
161 . 1 1 26 26 GLY CA C 13 46.788 0.20 . 1 . . 332 . A 26 GLY CA . 19178 1
162 . 1 1 26 26 GLY N N 15 110.755 0.10 . 1 . . 10 . A 26 GLY N . 19178 1
163 . 1 1 27 27 SER H H 1 7.335 0.03 . 1 . . 68 . A 27 SER H . 19178 1
164 . 1 1 27 27 SER HA H 1 4.422 0.03 . 1 . . 561 . A 27 SER HA . 19178 1
165 . 1 1 27 27 SER HB2 H 1 3.795 0.03 . 2 . . 563 . A 27 SER HB2 . 19178 1
166 . 1 1 27 27 SER HB3 H 1 3.779 0.03 . 2 . . 562 . A 27 SER HB3 . 19178 1
167 . 1 1 27 27 SER C C 13 175.612 0.20 . 1 . . 338 . A 27 SER C . 19178 1
168 . 1 1 27 27 SER CA C 13 58.309 0.20 . 1 . . 176 . A 27 SER CA . 19178 1
169 . 1 1 27 27 SER CB C 13 64.423 0.20 . 1 . . 331 . A 27 SER CB . 19178 1
170 . 1 1 27 27 SER N N 15 109.977 0.10 . 1 . . 67 . A 27 SER N . 19178 1
171 . 1 1 28 28 GLY H H 1 7.536 0.03 . 1 . . 65 . A 28 GLY H . 19178 1
172 . 1 1 28 28 GLY HA2 H 1 3.839 0.03 . 2 . . 560 . A 28 GLY HA2 . 19178 1
173 . 1 1 28 28 GLY HA3 H 1 4.114 0.03 . 2 . . 559 . A 28 GLY HA3 . 19178 1
174 . 1 1 28 28 GLY C C 13 174.029 0.20 . 1 . . 337 . A 28 GLY C . 19178 1
175 . 1 1 28 28 GLY CA C 13 45.371 0.20 . 1 . . 328 . A 28 GLY CA . 19178 1
176 . 1 1 28 28 GLY N N 15 110.105 0.10 . 1 . . 66 . A 28 GLY N . 19178 1
177 . 1 1 29 29 VAL H H 1 7.738 0.03 . 1 . . 82 . A 29 VAL H . 19178 1
178 . 1 1 29 29 VAL HA H 1 4.720 0.03 . 1 . . 683 . A 29 VAL HA . 19178 1
179 . 1 1 29 29 VAL HB H 1 1.909 0.03 . 1 . . 684 . A 29 VAL HB . 19178 1
180 . 1 1 29 29 VAL HG11 H 1 0.871 0.03 . 2 . . 723 . A 29 VAL HG11 . 19178 1
181 . 1 1 29 29 VAL HG12 H 1 0.871 0.03 . 2 . . 723 . A 29 VAL HG12 . 19178 1
182 . 1 1 29 29 VAL HG13 H 1 0.871 0.03 . 2 . . 723 . A 29 VAL HG13 . 19178 1
183 . 1 1 29 29 VAL HG21 H 1 0.852 0.03 . 2 . . 722 . A 29 VAL HG21 . 19178 1
184 . 1 1 29 29 VAL HG22 H 1 0.852 0.03 . 2 . . 722 . A 29 VAL HG22 . 19178 1
185 . 1 1 29 29 VAL HG23 H 1 0.852 0.03 . 2 . . 722 . A 29 VAL HG23 . 19178 1
186 . 1 1 29 29 VAL C C 13 177.149 0.20 . 1 . . 336 . A 29 VAL C . 19178 1
187 . 1 1 29 29 VAL CA C 13 66.474 0.20 . 1 . . 329 . A 29 VAL CA . 19178 1
188 . 1 1 29 29 VAL CB C 13 32.694 0.20 . 1 . . 330 . A 29 VAL CB . 19178 1
189 . 1 1 29 29 VAL CG1 C 13 24.841 0.20 . 2 . . 724 . A 29 VAL CG1 . 19178 1
190 . 1 1 29 29 VAL CG2 C 13 21.971 0.20 . 2 . . 721 . A 29 VAL CG2 . 19178 1
191 . 1 1 29 29 VAL N N 15 121.444 0.10 . 1 . . 81 . A 29 VAL N . 19178 1
192 . 1 1 30 30 LEU H H 1 7.090 0.03 . 1 . . 681 . A 30 LEU H . 19178 1
193 . 1 1 30 30 LEU HA H 1 5.349 0.03 . 1 . . 556 . A 30 LEU HA . 19178 1
194 . 1 1 30 30 LEU HB2 H 1 1.270 0.03 . 2 . . 557 . A 30 LEU HB2 . 19178 1
195 . 1 1 30 30 LEU HB3 H 1 1.297 0.03 . 2 . . 558 . A 30 LEU HB3 . 19178 1
196 . 1 1 30 30 LEU HD11 H 1 1.045 0.03 . 2 . . 672 . A 30 LEU HD11 . 19178 1
197 . 1 1 30 30 LEU HD12 H 1 1.045 0.03 . 2 . . 672 . A 30 LEU HD12 . 19178 1
198 . 1 1 30 30 LEU HD13 H 1 1.045 0.03 . 2 . . 672 . A 30 LEU HD13 . 19178 1
199 . 1 1 30 30 LEU HD21 H 1 0.994 0.03 . 2 . . 626 . A 30 LEU HD21 . 19178 1
200 . 1 1 30 30 LEU HD22 H 1 0.994 0.03 . 2 . . 626 . A 30 LEU HD22 . 19178 1
201 . 1 1 30 30 LEU HD23 H 1 0.994 0.03 . 2 . . 626 . A 30 LEU HD23 . 19178 1
202 . 1 1 30 30 LEU C C 13 174.427 0.20 . 1 . . 335 . A 30 LEU C . 19178 1
203 . 1 1 30 30 LEU CA C 13 52.231 0.20 . 1 . . 327 . A 30 LEU CA . 19178 1
204 . 1 1 30 30 LEU CB C 13 43.525 0.20 . 1 . . 427 . A 30 LEU CB . 19178 1
205 . 1 1 30 30 LEU CD1 C 13 22.250 0.20 . 2 . . 718 . A 30 LEU CD1 . 19178 1
206 . 1 1 30 30 LEU CD2 C 13 25.458 0.20 . 2 . . 625 . A 30 LEU CD2 . 19178 1
207 . 1 1 30 30 LEU N N 15 115.594 0.10 . 1 . . 682 . A 30 LEU N . 19178 1
208 . 1 1 31 31 ALA H H 1 8.981 0.03 . 1 . . 26 . A 31 ALA H . 19178 1
209 . 1 1 31 31 ALA HA H 1 4.539 0.03 . 1 . . 554 . A 31 ALA HA . 19178 1
210 . 1 1 31 31 ALA HB1 H 1 1.275 0.03 . 1 . . 555 . A 31 ALA HB1 . 19178 1
211 . 1 1 31 31 ALA HB2 H 1 1.275 0.03 . 1 . . 555 . A 31 ALA HB2 . 19178 1
212 . 1 1 31 31 ALA HB3 H 1 1.275 0.03 . 1 . . 555 . A 31 ALA HB3 . 19178 1
213 . 1 1 31 31 ALA C C 13 175.130 0.20 . 1 . . 334 . A 31 ALA C . 19178 1
214 . 1 1 31 31 ALA CA C 13 50.963 0.20 . 1 . . 312 . A 31 ALA CA . 19178 1
215 . 1 1 31 31 ALA CB C 13 22.314 0.20 . 1 . . 311 . A 31 ALA CB . 19178 1
216 . 1 1 31 31 ALA N N 15 122.020 0.10 . 1 . . 25 . A 31 ALA N . 19178 1
217 . 1 1 32 32 ARG H H 1 8.223 0.03 . 1 . . 96 . A 32 ARG H . 19178 1
218 . 1 1 32 32 ARG HA H 1 5.342 0.03 . 1 . . 553 . A 32 ARG HA . 19178 1
219 . 1 1 32 32 ARG C C 13 178.051 0.20 . 1 . . 309 . A 32 ARG C . 19178 1
220 . 1 1 32 32 ARG CA C 13 54.543 0.20 . 1 . . 310 . A 32 ARG CA . 19178 1
221 . 1 1 32 32 ARG CB C 13 31.485 0.20 . 1 . . 426 . A 32 ARG CB . 19178 1
222 . 1 1 32 32 ARG CG C 13 28.852 0.20 . 1 . . 425 . A 32 ARG CG . 19178 1
223 . 1 1 32 32 ARG CD C 13 42.584 0.20 . 1 . . 424 . A 32 ARG CD . 19178 1
224 . 1 1 32 32 ARG N N 15 118.606 0.10 . 1 . . 95 . A 32 ARG N . 19178 1
225 . 1 1 33 33 CYS H H 1 8.314 0.03 . 1 . . 58 . A 33 CYS H . 19178 1
226 . 1 1 33 33 CYS HA H 1 4.117 0.03 . 1 . . 551 . A 33 CYS HA . 19178 1
227 . 1 1 33 33 CYS HB3 H 1 2.771 0.03 . 1 . . 552 . A 33 CYS HB3 . 19178 1
228 . 1 1 33 33 CYS C C 13 175.978 0.20 . 1 . . 308 . A 33 CYS C . 19178 1
229 . 1 1 33 33 CYS CA C 13 60.620 0.20 . 1 . . 314 . A 33 CYS CA . 19178 1
230 . 1 1 33 33 CYS CB C 13 27.213 0.20 . 1 . . 313 . A 33 CYS CB . 19178 1
231 . 1 1 33 33 CYS N N 15 125.750 0.10 . 1 . . 57 . A 33 CYS N . 19178 1
232 . 1 1 34 34 ARG H H 1 8.578 0.03 . 1 . . 38 . A 34 ARG H . 19178 1
233 . 1 1 34 34 ARG HA H 1 3.926 0.03 . 1 . . 544 . A 34 ARG HA . 19178 1
234 . 1 1 34 34 ARG HB2 H 1 1.820 0.03 . 2 . . 545 . A 34 ARG HB2 . 19178 1
235 . 1 1 34 34 ARG HB3 H 1 1.838 0.03 . 2 . . 546 . A 34 ARG HB3 . 19178 1
236 . 1 1 34 34 ARG HG2 H 1 1.681 0.03 . 2 . . 548 . A 34 ARG HG2 . 19178 1
237 . 1 1 34 34 ARG HG3 H 1 1.669 0.03 . 2 . . 547 . A 34 ARG HG3 . 19178 1
238 . 1 1 34 34 ARG HD2 H 1 3.179 0.03 . 2 . . 549 . A 34 ARG HD2 . 19178 1
239 . 1 1 34 34 ARG HD3 H 1 3.205 0.03 . 2 . . 550 . A 34 ARG HD3 . 19178 1
240 . 1 1 34 34 ARG C C 13 176.565 0.20 . 1 . . 307 . A 34 ARG C . 19178 1
241 . 1 1 34 34 ARG CA C 13 58.719 0.20 . 1 . . 316 . A 34 ARG CA . 19178 1
242 . 1 1 34 34 ARG CB C 13 30.159 0.20 . 1 . . 315 . A 34 ARG CB . 19178 1
243 . 1 1 34 34 ARG CG C 13 27.441 0.20 . 1 . . 422 . A 34 ARG CG . 19178 1
244 . 1 1 34 34 ARG CD C 13 43.243 0.20 . 1 . . 423 . A 34 ARG CD . 19178 1
245 . 1 1 34 34 ARG N N 15 128.053 0.10 . 1 . . 37 . A 34 ARG N . 19178 1
246 . 1 1 35 35 ILE H H 1 8.932 0.03 . 1 . . 28 . A 35 ILE H . 19178 1
247 . 1 1 35 35 ILE HA H 1 3.843 0.03 . 1 . . 542 . A 35 ILE HA . 19178 1
248 . 1 1 35 35 ILE HB H 1 1.229 0.03 . 1 . . 543 . A 35 ILE HB . 19178 1
249 . 1 1 35 35 ILE HG21 H 1 0.175 0.03 . 1 . . 367 . A 35 ILE HG21 . 19178 1
250 . 1 1 35 35 ILE HG22 H 1 0.175 0.03 . 1 . . 367 . A 35 ILE HG22 . 19178 1
251 . 1 1 35 35 ILE HG23 H 1 0.175 0.03 . 1 . . 367 . A 35 ILE HG23 . 19178 1
252 . 1 1 35 35 ILE HD11 H 1 0.721 0.03 . 1 . . 359 . A 35 ILE HD11 . 19178 1
253 . 1 1 35 35 ILE HD12 H 1 0.721 0.03 . 1 . . 359 . A 35 ILE HD12 . 19178 1
254 . 1 1 35 35 ILE HD13 H 1 0.721 0.03 . 1 . . 359 . A 35 ILE HD13 . 19178 1
255 . 1 1 35 35 ILE C C 13 176.028 0.20 . 1 . . 306 . A 35 ILE C . 19178 1
256 . 1 1 35 35 ILE CA C 13 62.035 0.20 . 1 . . 317 . A 35 ILE CA . 19178 1
257 . 1 1 35 35 ILE CB C 13 39.125 0.20 . 1 . . 318 . A 35 ILE CB . 19178 1
258 . 1 1 35 35 ILE CG1 C 13 27.901 0.20 . 1 . . 421 . A 35 ILE CG1 . 19178 1
259 . 1 1 35 35 ILE CG2 C 13 16.424 0.20 . 1 . . 366 . A 35 ILE CG2 . 19178 1
260 . 1 1 35 35 ILE CD1 C 13 11.756 0.20 . 1 . . 358 . A 35 ILE CD1 . 19178 1
261 . 1 1 35 35 ILE N N 15 122.502 0.10 . 1 . . 27 . A 35 ILE N . 19178 1
262 . 1 1 36 36 HIS H H 1 8.078 0.03 . 1 . . 131 . A 36 HIS H . 19178 1
263 . 1 1 36 36 HIS HA H 1 4.569 0.03 . 1 . . 736 . A 36 HIS HA . 19178 1
264 . 1 1 36 36 HIS HB2 H 1 3.127 0.03 . 2 . . 734 . A 36 HIS HB2 . 19178 1
265 . 1 1 36 36 HIS HB3 H 1 2.969 0.03 . 2 . . 735 . A 36 HIS HB3 . 19178 1
266 . 1 1 36 36 HIS HD2 H 1 7.176 0.03 . 1 . . 587 . A 36 HIS HD2 . 19178 1
267 . 1 1 36 36 HIS HE1 H 1 7.689 0.03 . 1 . . 597 . A 36 HIS HE1 . 19178 1
268 . 1 1 36 36 HIS CB C 13 31.187 0.20 . 1 . . 594 . A 36 HIS CB . 19178 1
269 . 1 1 36 36 HIS CD2 C 13 119.096 0.20 . 1 . . 586 . A 36 HIS CD2 . 19178 1
270 . 1 1 36 36 HIS CE1 C 13 138.820 0.20 . 1 . . 600 . A 36 HIS CE1 . 19178 1
271 . 1 1 36 36 HIS N N 15 121.974 0.10 . 1 . . 130 . A 36 HIS N . 19178 1
272 . 1 1 37 37 ASN H H 1 8.386 0.03 . 1 . . 144 . A 37 ASN H . 19178 1
273 . 1 1 37 37 ASN HA H 1 4.399 0.03 . 1 . . 538 . A 37 ASN HA . 19178 1
274 . 1 1 37 37 ASN HB2 H 1 2.681 0.03 . 2 . . 540 . A 37 ASN HB2 . 19178 1
275 . 1 1 37 37 ASN HB3 H 1 2.774 0.03 . 2 . . 539 . A 37 ASN HB3 . 19178 1
276 . 1 1 37 37 ASN HD21 H 1 6.851 0.03 . 1 . . 153 . A 37 ASN HD21 . 19178 1
277 . 1 1 37 37 ASN HD22 H 1 7.802 0.03 . 1 . . 152 . A 37 ASN HD22 . 19178 1
278 . 1 1 37 37 ASN C C 13 173.906 0.20 . 1 . . 304 . A 37 ASN C . 19178 1
279 . 1 1 37 37 ASN CA C 13 56.407 0.20 . 1 . . 322 . A 37 ASN CA . 19178 1
280 . 1 1 37 37 ASN CB C 13 39.331 0.20 . 1 . . 323 . A 37 ASN CB . 19178 1
281 . 1 1 37 37 ASN N N 15 119.433 0.10 . 1 . . 143 . A 37 ASN N . 19178 1
282 . 1 1 37 37 ASN ND2 N 15 113.008 0.10 . 1 . . 154 . A 37 ASN ND2 . 19178 1
283 . 1 1 38 38 ASP H H 1 8.880 0.03 . 1 . . 8 . A 38 ASP H . 19178 1
284 . 1 1 38 38 ASP HA H 1 4.385 0.03 . 1 . . 535 . A 38 ASP HA . 19178 1
285 . 1 1 38 38 ASP HB2 H 1 2.692 0.03 . 2 . . 537 . A 38 ASP HB2 . 19178 1
286 . 1 1 38 38 ASP HB3 H 1 2.705 0.03 . 2 . . 536 . A 38 ASP HB3 . 19178 1
287 . 1 1 38 38 ASP C C 13 175.841 0.20 . 1 . . 303 . A 38 ASP C . 19178 1
288 . 1 1 38 38 ASP CA C 13 53.983 0.20 . 1 . . 324 . A 38 ASP CA . 19178 1
289 . 1 1 38 38 ASP CB C 13 40.263 0.20 . 1 . . 325 . A 38 ASP CB . 19178 1
290 . 1 1 38 38 ASP N N 15 112.673 0.10 . 1 . . 7 . A 38 ASP N . 19178 1
291 . 1 1 39 39 VAL H H 1 8.253 0.03 . 1 . . 54 . A 39 VAL H . 19178 1
292 . 1 1 39 39 VAL HA H 1 3.944 0.03 . 1 . . 534 . A 39 VAL HA . 19178 1
293 . 1 1 39 39 VAL HB H 1 2.471 0.03 . 1 . . 680 . A 39 VAL HB . 19178 1
294 . 1 1 39 39 VAL HG11 H 1 1.023 0.03 . 2 . . 720 . A 39 VAL HG11 . 19178 1
295 . 1 1 39 39 VAL HG12 H 1 1.023 0.03 . 2 . . 720 . A 39 VAL HG12 . 19178 1
296 . 1 1 39 39 VAL HG13 H 1 1.023 0.03 . 2 . . 720 . A 39 VAL HG13 . 19178 1
297 . 1 1 39 39 VAL HG21 H 1 1.207 0.03 . 2 . . 419 . A 39 VAL HG21 . 19178 1
298 . 1 1 39 39 VAL HG22 H 1 1.207 0.03 . 2 . . 419 . A 39 VAL HG22 . 19178 1
299 . 1 1 39 39 VAL HG23 H 1 1.207 0.03 . 2 . . 419 . A 39 VAL HG23 . 19178 1
300 . 1 1 39 39 VAL C C 13 173.731 0.20 . 1 . . 302 . A 39 VAL C . 19178 1
301 . 1 1 39 39 VAL CA C 13 63.514 0.20 . 1 . . 298 . A 39 VAL CA . 19178 1
302 . 1 1 39 39 VAL CB C 13 32.408 0.20 . 1 . . 326 . A 39 VAL CB . 19178 1
303 . 1 1 39 39 VAL CG1 C 13 21.548 0.20 . 2 . . 719 . A 39 VAL CG1 . 19178 1
304 . 1 1 39 39 VAL CG2 C 13 20.854 0.20 . 2 . . 751 . A 39 VAL CG2 . 19178 1
305 . 1 1 39 39 VAL N N 15 124.385 0.10 . 1 . . 53 . A 39 VAL N . 19178 1
306 . 1 1 40 40 ILE H H 1 7.836 0.03 . 1 . . 42 . A 40 ILE H . 19178 1
307 . 1 1 40 40 ILE HA H 1 4.222 0.03 . 1 . . 677 . A 40 ILE HA . 19178 1
308 . 1 1 40 40 ILE HB H 1 1.494 0.03 . 1 . . 675 . A 40 ILE HB . 19178 1
309 . 1 1 40 40 ILE HG12 H 1 0.743 0.03 . 2 . . 673 . A 40 ILE HG12 . 19178 1
310 . 1 1 40 40 ILE HG13 H 1 1.326 0.03 . 2 . . 674 . A 40 ILE HG13 . 19178 1
311 . 1 1 40 40 ILE HG21 H 1 0.301 0.03 . 1 . . 365 . A 40 ILE HG21 . 19178 1
312 . 1 1 40 40 ILE HG22 H 1 0.301 0.03 . 1 . . 365 . A 40 ILE HG22 . 19178 1
313 . 1 1 40 40 ILE HG23 H 1 0.301 0.03 . 1 . . 365 . A 40 ILE HG23 . 19178 1
314 . 1 1 40 40 ILE HD11 H 1 0.553 0.03 . 1 . . 361 . A 40 ILE HD11 . 19178 1
315 . 1 1 40 40 ILE HD12 H 1 0.553 0.03 . 1 . . 361 . A 40 ILE HD12 . 19178 1
316 . 1 1 40 40 ILE HD13 H 1 0.553 0.03 . 1 . . 361 . A 40 ILE HD13 . 19178 1
317 . 1 1 40 40 ILE C C 13 174.090 0.20 . 1 . . 283 . A 40 ILE C . 19178 1
318 . 1 1 40 40 ILE CA C 13 60.635 0.20 . 1 . . 286 . A 40 ILE CA . 19178 1
319 . 1 1 40 40 ILE CB C 13 38.281 0.20 . 1 . . 287 . A 40 ILE CB . 19178 1
320 . 1 1 40 40 ILE CG1 C 13 28.157 0.20 . 1 . . 636 . A 40 ILE CG1 . 19178 1
321 . 1 1 40 40 ILE CG2 C 13 18.765 0.20 . 1 . . 364 . A 40 ILE CG2 . 19178 1
322 . 1 1 40 40 ILE CD1 C 13 12.352 0.20 . 1 . . 360 . A 40 ILE CD1 . 19178 1
323 . 1 1 40 40 ILE N N 15 128.130 0.10 . 1 . . 41 . A 40 ILE N . 19178 1
324 . 1 1 41 41 LEU H H 1 8.836 0.03 . 1 . . 32 . A 41 LEU H . 19178 1
325 . 1 1 41 41 LEU HA H 1 4.884 0.03 . 1 . . 533 . A 41 LEU HA . 19178 1
326 . 1 1 41 41 LEU HB2 H 1 1.060 0.03 . 2 . . 707 . A 41 LEU HB2 . 19178 1
327 . 1 1 41 41 LEU HB3 H 1 1.457 0.03 . 2 . . 676 . A 41 LEU HB3 . 19178 1
328 . 1 1 41 41 LEU HD11 H 1 0.764 0.03 . 2 . . 623 . A 41 LEU HD11 . 19178 1
329 . 1 1 41 41 LEU HD12 H 1 0.764 0.03 . 2 . . 623 . A 41 LEU HD12 . 19178 1
330 . 1 1 41 41 LEU HD13 H 1 0.764 0.03 . 2 . . 623 . A 41 LEU HD13 . 19178 1
331 . 1 1 41 41 LEU HD21 H 1 0.593 0.03 . 2 . . 712 . A 41 LEU HD21 . 19178 1
332 . 1 1 41 41 LEU HD22 H 1 0.593 0.03 . 2 . . 712 . A 41 LEU HD22 . 19178 1
333 . 1 1 41 41 LEU HD23 H 1 0.593 0.03 . 2 . . 712 . A 41 LEU HD23 . 19178 1
334 . 1 1 41 41 LEU C C 13 175.989 0.20 . 1 . . 282 . A 41 LEU C . 19178 1
335 . 1 1 41 41 LEU CA C 13 52.654 0.20 . 1 . . 284 . A 41 LEU CA . 19178 1
336 . 1 1 41 41 LEU CB C 13 45.122 0.20 . 1 . . 285 . A 41 LEU CB . 19178 1
337 . 1 1 41 41 LEU CD1 C 13 25.485 0.20 . 2 . . 624 . A 41 LEU CD1 . 19178 1
338 . 1 1 41 41 LEU CD2 C 13 23.607 0.20 . 2 . . 711 . A 41 LEU CD2 . 19178 1
339 . 1 1 41 41 LEU N N 15 124.924 0.10 . 1 . . 31 . A 41 LEU N . 19178 1
340 . 1 1 42 42 ASP H H 1 8.725 0.03 . 1 . . 104 . A 42 ASP H . 19178 1
341 . 1 1 42 42 ASP HA H 1 4.858 0.03 . 1 . . 746 . A 42 ASP HA . 19178 1
342 . 1 1 42 42 ASP HB2 H 1 2.867 0.03 . 2 . . 714 . A 42 ASP HB2 . 19178 1
343 . 1 1 42 42 ASP HB3 H 1 2.665 0.03 . 2 . . 713 . A 42 ASP HB3 . 19178 1
344 . 1 1 42 42 ASP C C 13 176.128 0.20 . 1 . . 301 . A 42 ASP C . 19178 1
345 . 1 1 42 42 ASP CA C 13 53.328 0.20 . 1 . . 299 . A 42 ASP CA . 19178 1
346 . 1 1 42 42 ASP CB C 13 41.408 0.20 . 1 . . 300 . A 42 ASP CB . 19178 1
347 . 1 1 42 42 ASP N N 15 119.247 0.10 . 1 . . 103 . A 42 ASP N . 19178 1
348 . 1 1 43 43 SER H H 1 8.462 0.03 . 1 . . 119 . A 43 SER H . 19178 1
349 . 1 1 43 43 SER HA H 1 4.178 0.03 . 1 . . 532 . A 43 SER HA . 19178 1
350 . 1 1 43 43 SER HB2 H 1 3.725 0.03 . 2 . . 679 . A 43 SER HB2 . 19178 1
351 . 1 1 43 43 SER HB3 H 1 3.933 0.03 . 2 . . 678 . A 43 SER HB3 . 19178 1
352 . 1 1 43 43 SER C C 13 176.291 0.20 . 1 . . 281 . A 43 SER C . 19178 1
353 . 1 1 43 43 SER CA C 13 60.431 0.20 . 1 . . 296 . A 43 SER CA . 19178 1
354 . 1 1 43 43 SER CB C 13 64.943 0.20 . 1 . . 297 . A 43 SER CB . 19178 1
355 . 1 1 43 43 SER N N 15 123.344 0.10 . 1 . . 118 . A 43 SER N . 19178 1
356 . 1 1 44 44 GLY H H 1 9.230 0.03 . 1 . . 5 . A 44 GLY H . 19178 1
357 . 1 1 44 44 GLY HA2 H 1 3.675 0.03 . 2 . . 531 . A 44 GLY HA2 . 19178 1
358 . 1 1 44 44 GLY HA3 H 1 4.275 0.03 . 2 . . 530 . A 44 GLY HA3 . 19178 1
359 . 1 1 44 44 GLY C C 13 174.525 0.20 . 1 . . 280 . A 44 GLY C . 19178 1
360 . 1 1 44 44 GLY CA C 13 45.368 0.20 . 1 . . 288 . A 44 GLY CA . 19178 1
361 . 1 1 44 44 GLY N N 15 112.184 0.10 . 1 . . 6 . A 44 GLY N . 19178 1
362 . 1 1 45 45 ASN H H 1 8.486 0.03 . 1 . . 138 . A 45 ASN H . 19178 1
363 . 1 1 45 45 ASN HA H 1 4.681 0.03 . 1 . . 528 . A 45 ASN HA . 19178 1
364 . 1 1 45 45 ASN HB2 H 1 2.206 0.03 . 2 . . 701 . A 45 ASN HB2 . 19178 1
365 . 1 1 45 45 ASN HB3 H 1 2.545 0.03 . 2 . . 529 . A 45 ASN HB3 . 19178 1
366 . 1 1 45 45 ASN HD21 H 1 6.816 0.03 . 1 . . 163 . A 45 ASN HD21 . 19178 1
367 . 1 1 45 45 ASN HD22 H 1 7.677 0.03 . 1 . . 155 . A 45 ASN HD22 . 19178 1
368 . 1 1 45 45 ASN C C 13 174.866 0.20 . 1 . . 279 . A 45 ASN C . 19178 1
369 . 1 1 45 45 ASN CA C 13 52.807 0.20 . 1 . . 289 . A 45 ASN CA . 19178 1
370 . 1 1 45 45 ASN CB C 13 39.241 0.20 . 1 . . 290 . A 45 ASN CB . 19178 1
371 . 1 1 45 45 ASN N N 15 119.774 0.10 . 1 . . 137 . A 45 ASN N . 19178 1
372 . 1 1 45 45 ASN ND2 N 15 112.642 0.10 . 1 . . 162 . A 45 ASN ND2 . 19178 1
373 . 1 1 46 46 ASP H H 1 8.387 0.03 . 1 . . 140 . A 46 ASP H . 19178 1
374 . 1 1 46 46 ASP HA H 1 4.367 0.03 . 1 . . 525 . A 46 ASP HA . 19178 1
375 . 1 1 46 46 ASP HB2 H 1 2.705 0.03 . 2 . . 527 . A 46 ASP HB2 . 19178 1
376 . 1 1 46 46 ASP HB3 H 1 2.724 0.03 . 2 . . 526 . A 46 ASP HB3 . 19178 1
377 . 1 1 46 46 ASP C C 13 177.272 0.20 . 1 . . 278 . A 46 ASP C . 19178 1
378 . 1 1 46 46 ASP CA C 13 54.869 0.20 . 1 . . 292 . A 46 ASP CA . 19178 1
379 . 1 1 46 46 ASP CB C 13 42.461 0.20 . 1 . . 291 . A 46 ASP CB . 19178 1
380 . 1 1 46 46 ASP N N 15 120.223 0.10 . 1 . . 139 . A 46 ASP N . 19178 1
381 . 1 1 47 47 ALA H H 1 8.747 0.03 . 1 . . 35 . A 47 ALA H . 19178 1
382 . 1 1 47 47 ALA HA H 1 3.741 0.03 . 1 . . 524 . A 47 ALA HA . 19178 1
383 . 1 1 47 47 ALA HB1 H 1 0.530 0.03 . 1 . . 370 . A 47 ALA HB1 . 19178 1
384 . 1 1 47 47 ALA HB2 H 1 0.530 0.03 . 1 . . 370 . A 47 ALA HB2 . 19178 1
385 . 1 1 47 47 ALA HB3 H 1 0.530 0.03 . 1 . . 370 . A 47 ALA HB3 . 19178 1
386 . 1 1 47 47 ALA C C 13 177.980 0.20 . 1 . . 277 . A 47 ALA C . 19178 1
387 . 1 1 47 47 ALA CA C 13 53.866 0.20 . 1 . . 293 . A 47 ALA CA . 19178 1
388 . 1 1 47 47 ALA CB C 13 16.554 0.20 . 1 . . 294 . A 47 ALA CB . 19178 1
389 . 1 1 47 47 ALA N N 15 126.587 0.10 . 1 . . 36 . A 47 ALA N . 19178 1
390 . 1 1 48 48 SER H H 1 8.973 0.03 . 1 . . 14 . A 48 SER H . 19178 1
391 . 1 1 48 48 SER HA H 1 4.203 0.03 . 1 . . 697 . A 48 SER HA . 19178 1
392 . 1 1 48 48 SER HB3 H 1 3.948 0.03 . 1 . . 698 . A 48 SER HB3 . 19178 1
393 . 1 1 48 48 SER CA C 13 61.994 0.20 . 1 . . 295 . A 48 SER CA . 19178 1
394 . 1 1 48 48 SER N N 15 115.463 0.10 . 1 . . 13 . A 48 SER N . 19178 1
395 . 1 1 49 49 SER C C 13 176.587 0.20 . 1 . . 276 . A 49 SER C . 19178 1
396 . 1 1 49 49 SER CA C 13 62.279 0.20 . 1 . . 418 . A 49 SER CA . 19178 1
397 . 1 1 50 50 ALA H H 1 7.620 0.03 . 1 . . 50 . A 50 ALA H . 19178 1
398 . 1 1 50 50 ALA HA H 1 4.076 0.03 . 1 . . 700 . A 50 ALA HA . 19178 1
399 . 1 1 50 50 ALA HB1 H 1 1.176 0.03 . 1 . . 371 . A 50 ALA HB1 . 19178 1
400 . 1 1 50 50 ALA HB2 H 1 1.176 0.03 . 1 . . 371 . A 50 ALA HB2 . 19178 1
401 . 1 1 50 50 ALA HB3 H 1 1.176 0.03 . 1 . . 371 . A 50 ALA HB3 . 19178 1
402 . 1 1 50 50 ALA C C 13 179.125 0.20 . 1 . . 275 . A 50 ALA C . 19178 1
403 . 1 1 50 50 ALA CA C 13 54.822 0.20 . 1 . . 273 . A 50 ALA CA . 19178 1
404 . 1 1 50 50 ALA CB C 13 18.834 0.20 . 1 . . 274 . A 50 ALA CB . 19178 1
405 . 1 1 50 50 ALA N N 15 125.775 0.10 . 1 . . 49 . A 50 ALA N . 19178 1
406 . 1 1 51 51 TYR H H 1 7.397 0.03 . 1 . . 165 . A 51 TYR H . 19178 1
407 . 1 1 51 51 TYR HA H 1 4.275 0.03 . 1 . . 699 . A 51 TYR HA . 19178 1
408 . 1 1 51 51 TYR HB2 H 1 2.954 0.03 . 2 . . 694 . A 51 TYR HB2 . 19178 1
409 . 1 1 51 51 TYR HB3 H 1 3.099 0.03 . 2 . . 693 . A 51 TYR HB3 . 19178 1
410 . 1 1 51 51 TYR HD1 H 1 6.878 0.03 . 3 . . 604 . A 51 TYR HD1 . 19178 1
411 . 1 1 51 51 TYR HD2 H 1 6.878 0.03 . 3 . . 604 . A 51 TYR HD2 . 19178 1
412 . 1 1 51 51 TYR HE1 H 1 6.717 0.03 . 3 . . 605 . A 51 TYR HE1 . 19178 1
413 . 1 1 51 51 TYR HE2 H 1 6.717 0.03 . 3 . . 605 . A 51 TYR HE2 . 19178 1
414 . 1 1 51 51 TYR C C 13 179.622 0.20 . 1 . . 415 . A 51 TYR C . 19178 1
415 . 1 1 51 51 TYR CA C 13 60.966 0.20 . 1 . . 417 . A 51 TYR CA . 19178 1
416 . 1 1 51 51 TYR CB C 13 36.803 0.20 . 1 . . 416 . A 51 TYR CB . 19178 1
417 . 1 1 51 51 TYR CD1 C 13 131.745 0.20 . 3 . . 603 . A 51 TYR CD1 . 19178 1
418 . 1 1 51 51 TYR CD2 C 13 131.745 0.20 . 3 . . 603 . A 51 TYR CD2 . 19178 1
419 . 1 1 51 51 TYR CE1 C 13 117.835 0.20 . 3 . . 606 . A 51 TYR CE1 . 19178 1
420 . 1 1 51 51 TYR CE2 C 13 117.835 0.20 . 3 . . 606 . A 51 TYR CE2 . 19178 1
421 . 1 1 51 51 TYR N N 15 117.562 0.10 . 1 . . 164 . A 51 TYR N . 19178 1
422 . 1 1 52 52 LYS H H 1 8.332 0.03 . 1 . . 135 . A 52 LYS H . 19178 1
423 . 1 1 52 52 LYS HA H 1 4.103 0.03 . 1 . . 689 . A 52 LYS HA . 19178 1
424 . 1 1 52 52 LYS HB3 H 1 1.898 0.03 . 1 . . 691 . A 52 LYS HB3 . 19178 1
425 . 1 1 52 52 LYS C C 13 179.041 0.20 . 1 . . 414 . A 52 LYS C . 19178 1
426 . 1 1 52 52 LYS CA C 13 59.827 0.20 . 1 . . 321 . A 52 LYS CA . 19178 1
427 . 1 1 52 52 LYS N N 15 121.441 0.10 . 1 . . 136 . A 52 LYS N . 19178 1
428 . 1 1 53 53 LEU H H 1 7.671 0.03 . 1 . . 687 . A 53 LEU H . 19178 1
429 . 1 1 53 53 LEU HA H 1 4.376 0.03 . 1 . . 690 . A 53 LEU HA . 19178 1
430 . 1 1 53 53 LEU HB2 H 1 1.830 0.03 . 2 . . 695 . A 53 LEU HB2 . 19178 1
431 . 1 1 53 53 LEU HB3 H 1 1.619 0.03 . 2 . . 692 . A 53 LEU HB3 . 19178 1
432 . 1 1 53 53 LEU HD11 H 1 0.946 0.03 . 2 . . 627 . A 53 LEU HD11 . 19178 1
433 . 1 1 53 53 LEU HD12 H 1 0.946 0.03 . 2 . . 627 . A 53 LEU HD12 . 19178 1
434 . 1 1 53 53 LEU HD13 H 1 0.946 0.03 . 2 . . 627 . A 53 LEU HD13 . 19178 1
435 . 1 1 53 53 LEU HD21 H 1 0.970 0.03 . 2 . . 388 . A 53 LEU HD21 . 19178 1
436 . 1 1 53 53 LEU HD22 H 1 0.970 0.03 . 2 . . 388 . A 53 LEU HD22 . 19178 1
437 . 1 1 53 53 LEU HD23 H 1 0.970 0.03 . 2 . . 388 . A 53 LEU HD23 . 19178 1
438 . 1 1 53 53 LEU C C 13 178.373 0.20 . 1 . . 413 . A 53 LEU C . 19178 1
439 . 1 1 53 53 LEU CA C 13 57.863 0.20 . 1 . . 411 . A 53 LEU CA . 19178 1
440 . 1 1 53 53 LEU CB C 13 41.288 0.20 . 1 . . 412 . A 53 LEU CB . 19178 1
441 . 1 1 53 53 LEU CD1 C 13 23.568 0.20 . 2 . . 628 . A 53 LEU CD1 . 19178 1
442 . 1 1 53 53 LEU CD2 C 13 25.823 0.20 . 2 . . 387 . A 53 LEU CD2 . 19178 1
443 . 1 1 53 53 LEU N N 15 122.286 0.10 . 1 . . 688 . A 53 LEU N . 19178 1
444 . 1 1 54 54 GLY H H 1 9.020 0.03 . 1 . . 168 . A 54 GLY H . 19178 1
445 . 1 1 54 54 GLY HA2 H 1 3.685 0.03 . 2 . . 523 . A 54 GLY HA2 . 19178 1
446 . 1 1 54 54 GLY HA3 H 1 3.806 0.03 . 2 . . 522 . A 54 GLY HA3 . 19178 1
447 . 1 1 54 54 GLY C C 13 174.865 0.20 . 1 . . 266 . A 54 GLY C . 19178 1
448 . 1 1 54 54 GLY CA C 13 47.971 0.20 . 1 . . 271 . A 54 GLY CA . 19178 1
449 . 1 1 55 55 THR H H 1 8.123 0.03 . 1 . . 94 . A 55 THR H . 19178 1
450 . 1 1 55 55 THR HA H 1 4.445 0.03 . 1 . . 696 . A 55 THR HA . 19178 1
451 . 1 1 55 55 THR HB H 1 4.025 0.03 . 1 . . 649 . A 55 THR HB . 19178 1
452 . 1 1 55 55 THR HG21 H 1 1.335 0.03 . 1 . . 382 . A 55 THR HG21 . 19178 1
453 . 1 1 55 55 THR HG22 H 1 1.335 0.03 . 1 . . 382 . A 55 THR HG22 . 19178 1
454 . 1 1 55 55 THR HG23 H 1 1.335 0.03 . 1 . . 382 . A 55 THR HG23 . 19178 1
455 . 1 1 55 55 THR C C 13 175.188 0.20 . 1 . . 265 . A 55 THR C . 19178 1
456 . 1 1 55 55 THR CA C 13 67.593 0.20 . 1 . . 270 . A 55 THR CA . 19178 1
457 . 1 1 55 55 THR CG2 C 13 20.525 0.20 . 1 . . 381 . A 55 THR CG2 . 19178 1
458 . 1 1 55 55 THR N N 15 117.961 0.10 . 1 . . 93 . A 55 THR N . 19178 1
459 . 1 1 56 56 TYR H H 1 7.697 0.03 . 1 . . 87 . A 56 TYR H . 19178 1
460 . 1 1 56 56 TYR HA H 1 4.346 0.03 . 1 . . 521 . A 56 TYR HA . 19178 1
461 . 1 1 56 56 TYR HB2 H 1 3.230 0.03 . 2 . . 619 . A 56 TYR HB2 . 19178 1
462 . 1 1 56 56 TYR HB3 H 1 3.358 0.03 . 2 . . 618 . A 56 TYR HB3 . 19178 1
463 . 1 1 56 56 TYR HD1 H 1 7.127 0.03 . 3 . . 617 . A 56 TYR HD1 . 19178 1
464 . 1 1 56 56 TYR HD2 H 1 7.127 0.03 . 3 . . 617 . A 56 TYR HD2 . 19178 1
465 . 1 1 56 56 TYR HE1 H 1 6.872 0.03 . 3 . . 815 . A 56 TYR HE1 . 19178 1
466 . 1 1 56 56 TYR HE2 H 1 6.872 0.03 . 3 . . 815 . A 56 TYR HE2 . 19178 1
467 . 1 1 56 56 TYR C C 13 177.909 0.20 . 1 . . 264 . A 56 TYR C . 19178 1
468 . 1 1 56 56 TYR CA C 13 61.147 0.20 . 1 . . 269 . A 56 TYR CA . 19178 1
469 . 1 1 56 56 TYR CB C 13 37.981 0.20 . 1 . . 410 . A 56 TYR CB . 19178 1
470 . 1 1 56 56 TYR CE1 C 13 117.824 0.20 . 3 . . 621 . A 56 TYR CE1 . 19178 1
471 . 1 1 56 56 TYR CE2 C 13 117.824 0.20 . 3 . . 621 . A 56 TYR CE2 . 19178 1
472 . 1 1 56 56 TYR N N 15 122.294 0.10 . 1 . . 88 . A 56 TYR N . 19178 1
473 . 1 1 57 57 LEU H H 1 8.909 0.03 . 1 . . 17 . A 57 LEU H . 19178 1
474 . 1 1 57 57 LEU HA H 1 3.914 0.03 . 1 . . 520 . A 57 LEU HA . 19178 1
475 . 1 1 57 57 LEU HB2 H 1 2.276 0.03 . 2 . . 716 . A 57 LEU HB2 . 19178 1
476 . 1 1 57 57 LEU HB3 H 1 1.923 0.03 . 2 . . 715 . A 57 LEU HB3 . 19178 1
477 . 1 1 57 57 LEU HD11 H 1 0.767 0.03 . 2 . . 686 . A 57 LEU HD11 . 19178 1
478 . 1 1 57 57 LEU HD12 H 1 0.767 0.03 . 2 . . 686 . A 57 LEU HD12 . 19178 1
479 . 1 1 57 57 LEU HD13 H 1 0.767 0.03 . 2 . . 686 . A 57 LEU HD13 . 19178 1
480 . 1 1 57 57 LEU HD21 H 1 1.012 0.03 . 2 . . 717 . A 57 LEU HD21 . 19178 1
481 . 1 1 57 57 LEU HD22 H 1 1.012 0.03 . 2 . . 717 . A 57 LEU HD22 . 19178 1
482 . 1 1 57 57 LEU HD23 H 1 1.012 0.03 . 2 . . 717 . A 57 LEU HD23 . 19178 1
483 . 1 1 57 57 LEU C C 13 180.087 0.20 . 1 . . 262 . A 57 LEU C . 19178 1
484 . 1 1 57 57 LEU CA C 13 57.780 0.20 . 1 . . 268 . A 57 LEU CA . 19178 1
485 . 1 1 57 57 LEU CB C 13 42.026 0.20 . 1 . . 409 . A 57 LEU CB . 19178 1
486 . 1 1 57 57 LEU CD1 C 13 25.974 0.20 . 2 . . 685 . A 57 LEU CD1 . 19178 1
487 . 1 1 57 57 LEU CD2 C 13 22.173 0.20 . 2 . . 652 . A 57 LEU CD2 . 19178 1
488 . 1 1 57 57 LEU N N 15 118.703 0.10 . 1 . . 18 . A 57 LEU N . 19178 1
489 . 1 1 58 58 TYR H H 1 8.971 0.03 . 1 . . 24 . A 58 TYR H . 19178 1
490 . 1 1 58 58 TYR HA H 1 4.209 0.03 . 1 . . 622 . A 58 TYR HA . 19178 1
491 . 1 1 58 58 TYR HB2 H 1 3.132 0.03 . 2 . . 616 . A 58 TYR HB2 . 19178 1
492 . 1 1 58 58 TYR HB3 H 1 3.168 0.03 . 2 . . 615 . A 58 TYR HB3 . 19178 1
493 . 1 1 58 58 TYR HD1 H 1 6.922 0.03 . 3 . . 613 . A 58 TYR HD1 . 19178 1
494 . 1 1 58 58 TYR HD2 H 1 6.922 0.03 . 3 . . 613 . A 58 TYR HD2 . 19178 1
495 . 1 1 58 58 TYR HE1 H 1 6.755 0.03 . 3 . . 816 . A 58 TYR HE1 . 19178 1
496 . 1 1 58 58 TYR HE2 H 1 6.755 0.03 . 3 . . 816 . A 58 TYR HE2 . 19178 1
497 . 1 1 58 58 TYR C C 13 177.511 0.20 . 1 . . 261 . A 58 TYR C . 19178 1
498 . 1 1 58 58 TYR CA C 13 61.641 0.20 . 1 . . 267 . A 58 TYR CA . 19178 1
499 . 1 1 58 58 TYR CD1 C 13 132.313 0.20 . 3 . . 614 . A 58 TYR CD1 . 19178 1
500 . 1 1 58 58 TYR CD2 C 13 132.313 0.20 . 3 . . 614 . A 58 TYR CD2 . 19178 1
501 . 1 1 58 58 TYR CE1 C 13 117.813 0.20 . 3 . . 817 . A 58 TYR CE1 . 19178 1
502 . 1 1 58 58 TYR CE2 C 13 117.813 0.20 . 3 . . 817 . A 58 TYR CE2 . 19178 1
503 . 1 1 58 58 TYR N N 15 120.667 0.10 . 1 . . 23 . A 58 TYR N . 19178 1
504 . 1 1 59 59 GLN H H 1 8.378 0.03 . 1 . . 145 . A 59 GLN H . 19178 1
505 . 1 1 59 59 GLN HA H 1 4.668 0.03 . 1 . . 517 . A 59 GLN HA . 19178 1
506 . 1 1 59 59 GLN HG2 H 1 3.202 0.03 . 1 . . 519 . A 59 GLN HG2 . 19178 1
507 . 1 1 59 59 GLN HG3 H 1 3.202 0.03 . 1 . . 518 . A 59 GLN HG3 . 19178 1
508 . 1 1 59 59 GLN C C 13 179.270 0.20 . 1 . . 263 . A 59 GLN C . 19178 1
509 . 1 1 59 59 GLN N N 15 119.344 0.10 . 1 . . 146 . A 59 GLN N . 19178 1
510 . 1 1 66 66 LEU HD11 H 1 1.125 0.03 . 2 . . 732 . A 66 LEU HD11 . 19178 1
511 . 1 1 66 66 LEU HD12 H 1 1.125 0.03 . 2 . . 732 . A 66 LEU HD12 . 19178 1
512 . 1 1 66 66 LEU HD13 H 1 1.125 0.03 . 2 . . 732 . A 66 LEU HD13 . 19178 1
513 . 1 1 66 66 LEU HD21 H 1 0.712 0.03 . 2 . . 731 . A 66 LEU HD21 . 19178 1
514 . 1 1 66 66 LEU HD22 H 1 0.712 0.03 . 2 . . 731 . A 66 LEU HD22 . 19178 1
515 . 1 1 66 66 LEU HD23 H 1 0.712 0.03 . 2 . . 731 . A 66 LEU HD23 . 19178 1
516 . 1 1 66 66 LEU CD1 C 13 26.477 0.20 . 2 . . 733 . A 66 LEU CD1 . 19178 1
517 . 1 1 66 66 LEU CD2 C 13 24.715 0.20 . 2 . . 730 . A 66 LEU CD2 . 19178 1
518 . 1 1 67 67 PHE HA H 1 4.852 0.03 . 1 . . 516 . A 67 PHE HA . 19178 1
519 . 1 1 67 67 PHE HD1 H 1 7.225 0.03 . 3 . . 607 . A 67 PHE HD1 . 19178 1
520 . 1 1 67 67 PHE HD2 H 1 7.225 0.03 . 3 . . 607 . A 67 PHE HD2 . 19178 1
521 . 1 1 67 67 PHE HE1 H 1 6.821 0.03 . 3 . . 609 . A 67 PHE HE1 . 19178 1
522 . 1 1 67 67 PHE HE2 H 1 6.821 0.03 . 3 . . 609 . A 67 PHE HE2 . 19178 1
523 . 1 1 67 67 PHE C C 13 175.889 0.20 . 1 . . 257 . A 67 PHE C . 19178 1
524 . 1 1 67 67 PHE CA C 13 55.576 0.20 . 1 . . 405 . A 67 PHE CA . 19178 1
525 . 1 1 67 67 PHE CB C 13 42.444 0.20 . 1 . . 406 . A 67 PHE CB . 19178 1
526 . 1 1 67 67 PHE CD1 C 13 133.675 0.20 . 3 . . 608 . A 67 PHE CD1 . 19178 1
527 . 1 1 67 67 PHE CD2 C 13 133.675 0.20 . 3 . . 608 . A 67 PHE CD2 . 19178 1
528 . 1 1 67 67 PHE CE1 C 13 132.007 0.20 . 3 . . 610 . A 67 PHE CE1 . 19178 1
529 . 1 1 67 67 PHE CE2 C 13 132.007 0.20 . 3 . . 610 . A 67 PHE CE2 . 19178 1
530 . 1 1 68 68 ASN H H 1 9.560 0.03 . 1 . . 3 . A 68 ASN H . 19178 1
531 . 1 1 68 68 ASN HB2 H 1 3.208 0.03 . 2 . . 709 . A 68 ASN HB2 . 19178 1
532 . 1 1 68 68 ASN HB3 H 1 2.959 0.03 . 2 . . 708 . A 68 ASN HB3 . 19178 1
533 . 1 1 68 68 ASN HD21 H 1 7.030 0.03 . 1 . . 151 . A 68 ASN HD21 . 19178 1
534 . 1 1 68 68 ASN HD22 H 1 8.220 0.03 . 1 . . 149 . A 68 ASN HD22 . 19178 1
535 . 1 1 68 68 ASN C C 13 175.338 0.20 . 1 . . 258 . A 68 ASN C . 19178 1
536 . 1 1 68 68 ASN CA C 13 55.092 0.20 . 1 . . 254 . A 68 ASN CA . 19178 1
537 . 1 1 68 68 ASN CB C 13 40.006 0.20 . 1 . . 255 . A 68 ASN CB . 19178 1
538 . 1 1 68 68 ASN N N 15 120.775 0.10 . 1 . . 4 . A 68 ASN N . 19178 1
539 . 1 1 68 68 ASN ND2 N 15 116.003 0.10 . 1 . . 150 . A 68 ASN ND2 . 19178 1
540 . 1 1 69 69 THR H H 1 7.237 0.03 . 1 . . 44 . A 69 THR H . 19178 1
541 . 1 1 69 69 THR HA H 1 4.732 0.03 . 1 . . 514 . A 69 THR HA . 19178 1
542 . 1 1 69 69 THR HB H 1 4.522 0.03 . 1 . . 515 . A 69 THR HB . 19178 1
543 . 1 1 69 69 THR HG21 H 1 1.176 0.03 . 1 . . 651 . A 69 THR HG21 . 19178 1
544 . 1 1 69 69 THR HG22 H 1 1.176 0.03 . 1 . . 651 . A 69 THR HG22 . 19178 1
545 . 1 1 69 69 THR HG23 H 1 1.176 0.03 . 1 . . 651 . A 69 THR HG23 . 19178 1
546 . 1 1 69 69 THR C C 13 173.530 0.20 . 1 . . 256 . A 69 THR C . 19178 1
547 . 1 1 69 69 THR CA C 13 58.877 0.20 . 1 . . 260 . A 69 THR CA . 19178 1
548 . 1 1 69 69 THR CB C 13 73.620 0.20 . 1 . . 259 . A 69 THR CB . 19178 1
549 . 1 1 69 69 THR CG2 C 13 21.921 0.20 . 1 . . 650 . A 69 THR CG2 . 19178 1
550 . 1 1 69 69 THR N N 15 127.914 0.10 . 1 . . 43 . A 69 THR N . 19178 1
551 . 1 1 70 70 LEU H H 1 8.614 0.03 . 1 . . 115 . A 70 LEU H . 19178 1
552 . 1 1 70 70 LEU HA H 1 3.005 0.03 . 1 . . 512 . A 70 LEU HA . 19178 1
553 . 1 1 70 70 LEU HB2 H 1 1.620 0.03 . 2 . . 725 . A 70 LEU HB2 . 19178 1
554 . 1 1 70 70 LEU HB3 H 1 1.412 0.03 . 2 . . 513 . A 70 LEU HB3 . 19178 1
555 . 1 1 70 70 LEU HD11 H 1 0.876 0.03 . 2 . . 728 . A 70 LEU HD11 . 19178 1
556 . 1 1 70 70 LEU HD12 H 1 0.876 0.03 . 2 . . 728 . A 70 LEU HD12 . 19178 1
557 . 1 1 70 70 LEU HD13 H 1 0.876 0.03 . 2 . . 728 . A 70 LEU HD13 . 19178 1
558 . 1 1 70 70 LEU HD21 H 1 0.930 0.03 . 2 . . 727 . A 70 LEU HD21 . 19178 1
559 . 1 1 70 70 LEU HD22 H 1 0.930 0.03 . 2 . . 727 . A 70 LEU HD22 . 19178 1
560 . 1 1 70 70 LEU HD23 H 1 0.930 0.03 . 2 . . 727 . A 70 LEU HD23 . 19178 1
561 . 1 1 70 70 LEU C C 13 178.252 0.20 . 1 . . 231 . A 70 LEU C . 19178 1
562 . 1 1 70 70 LEU CA C 13 56.721 0.20 . 1 . . 252 . A 70 LEU CA . 19178 1
563 . 1 1 70 70 LEU CB C 13 41.199 0.20 . 1 . . 253 . A 70 LEU CB . 19178 1
564 . 1 1 70 70 LEU CD1 C 13 23.658 0.20 . 2 . . 729 . A 70 LEU CD1 . 19178 1
565 . 1 1 70 70 LEU CD2 C 13 24.974 0.20 . 2 . . 726 . A 70 LEU CD2 . 19178 1
566 . 1 1 70 70 LEU N N 15 122.013 0.10 . 1 . . 114 . A 70 LEU N . 19178 1
567 . 1 1 71 71 THR H H 1 7.694 0.03 . 1 . . 59 . A 71 THR H . 19178 1
568 . 1 1 71 71 THR HA H 1 3.620 0.03 . 1 . . 510 . A 71 THR HA . 19178 1
569 . 1 1 71 71 THR HB H 1 3.834 0.03 . 1 . . 511 . A 71 THR HB . 19178 1
570 . 1 1 71 71 THR HG21 H 1 1.150 0.03 . 1 . . 408 . A 71 THR HG21 . 19178 1
571 . 1 1 71 71 THR HG22 H 1 1.150 0.03 . 1 . . 408 . A 71 THR HG22 . 19178 1
572 . 1 1 71 71 THR HG23 H 1 1.150 0.03 . 1 . . 408 . A 71 THR HG23 . 19178 1
573 . 1 1 71 71 THR C C 13 175.400 0.20 . 1 . . 230 . A 71 THR C . 19178 1
574 . 1 1 71 71 THR CA C 13 66.405 0.20 . 1 . . 220 . A 71 THR CA . 19178 1
575 . 1 1 71 71 THR CB C 13 68.517 0.20 . 1 . . 221 . A 71 THR CB . 19178 1
576 . 1 1 71 71 THR CG2 C 13 21.714 0.20 . 1 . . 407 . A 71 THR CG2 . 19178 1
577 . 1 1 71 71 THR N N 15 114.041 0.10 . 1 . . 60 . A 71 THR N . 19178 1
578 . 1 1 72 72 GLU H H 1 7.514 0.03 . 1 . . 79 . A 72 GLU H . 19178 1
579 . 1 1 72 72 GLU HA H 1 3.997 0.03 . 1 . . 505 . A 72 GLU HA . 19178 1
580 . 1 1 72 72 GLU HB2 H 1 2.231 0.03 . 2 . . 506 . A 72 GLU HB2 . 19178 1
581 . 1 1 72 72 GLU HB3 H 1 2.204 0.03 . 2 . . 507 . A 72 GLU HB3 . 19178 1
582 . 1 1 72 72 GLU HG2 H 1 2.395 0.03 . 2 . . 509 . A 72 GLU HG2 . 19178 1
583 . 1 1 72 72 GLU HG3 H 1 2.397 0.03 . 2 . . 508 . A 72 GLU HG3 . 19178 1
584 . 1 1 72 72 GLU C C 13 178.982 0.20 . 1 . . 229 . A 72 GLU C . 19178 1
585 . 1 1 72 72 GLU CA C 13 59.250 0.20 . 1 . . 218 . A 72 GLU CA . 19178 1
586 . 1 1 72 72 GLU CB C 13 30.907 0.20 . 1 . . 219 . A 72 GLU CB . 19178 1
587 . 1 1 72 72 GLU CG C 13 37.152 0.20 . 1 . . 404 . A 72 GLU CG . 19178 1
588 . 1 1 72 72 GLU N N 15 120.141 0.10 . 1 . . 80 . A 72 GLU N . 19178 1
589 . 1 1 73 73 ALA H H 1 6.788 0.03 . 1 . . 40 . A 73 ALA H . 19178 1
590 . 1 1 73 73 ALA HA H 1 2.167 0.03 . 1 . . 504 . A 73 ALA HA . 19178 1
591 . 1 1 73 73 ALA HB1 H 1 0.639 0.03 . 1 . . 369 . A 73 ALA HB1 . 19178 1
592 . 1 1 73 73 ALA HB2 H 1 0.639 0.03 . 1 . . 369 . A 73 ALA HB2 . 19178 1
593 . 1 1 73 73 ALA HB3 H 1 0.639 0.03 . 1 . . 369 . A 73 ALA HB3 . 19178 1
594 . 1 1 73 73 ALA C C 13 178.959 0.20 . 1 . . 228 . A 73 ALA C . 19178 1
595 . 1 1 73 73 ALA CA C 13 54.323 0.20 . 1 . . 217 . A 73 ALA CA . 19178 1
596 . 1 1 73 73 ALA CB C 13 17.561 0.20 . 1 . . 368 . A 73 ALA CB . 19178 1
597 . 1 1 73 73 ALA N N 15 123.400 0.10 . 1 . . 39 . A 73 ALA N . 19178 1
598 . 1 1 74 74 ARG H H 1 8.145 0.03 . 1 . . 147 . A 74 ARG H . 19178 1
599 . 1 1 74 74 ARG HA H 1 3.887 0.03 . 1 . . 501 . A 74 ARG HA . 19178 1
600 . 1 1 74 74 ARG HB2 H 1 1.774 0.03 . 2 . . 502 . A 74 ARG HB2 . 19178 1
601 . 1 1 74 74 ARG HB3 H 1 1.746 0.03 . 2 . . 503 . A 74 ARG HB3 . 19178 1
602 . 1 1 74 74 ARG C C 13 179.230 0.20 . 1 . . 226 . A 74 ARG C . 19178 1
603 . 1 1 74 74 ARG CA C 13 60.442 0.20 . 1 . . 215 . A 74 ARG CA . 19178 1
604 . 1 1 74 74 ARG CB C 13 29.878 0.20 . 1 . . 216 . A 74 ARG CB . 19178 1
605 . 1 1 74 74 ARG CG C 13 28.801 0.20 . 1 . . 402 . A 74 ARG CG . 19178 1
606 . 1 1 74 74 ARG CD C 13 43.591 0.20 . 1 . . 403 . A 74 ARG CD . 19178 1
607 . 1 1 74 74 ARG N N 15 116.272 0.10 . 1 . . 148 . A 74 ARG N . 19178 1
608 . 1 1 75 75 ASP H H 1 8.594 0.03 . 1 . . 111 . A 75 ASP H . 19178 1
609 . 1 1 75 75 ASP HA H 1 4.446 0.03 . 1 . . 498 . A 75 ASP HA . 19178 1
610 . 1 1 75 75 ASP HB2 H 1 2.680 0.03 . 2 . . 500 . A 75 ASP HB2 . 19178 1
611 . 1 1 75 75 ASP HB3 H 1 2.748 0.03 . 2 . . 499 . A 75 ASP HB3 . 19178 1
612 . 1 1 75 75 ASP C C 13 178.040 0.20 . 1 . . 227 . A 75 ASP C . 19178 1
613 . 1 1 75 75 ASP CA C 13 57.166 0.20 . 1 . . 213 . A 75 ASP CA . 19178 1
614 . 1 1 75 75 ASP CB C 13 39.687 0.20 . 1 . . 214 . A 75 ASP CB . 19178 1
615 . 1 1 75 75 ASP N N 15 120.487 0.10 . 1 . . 112 . A 75 ASP N . 19178 1
616 . 1 1 76 76 ALA H H 1 7.668 0.03 . 1 . . 90 . A 76 ALA H . 19178 1
617 . 1 1 76 76 ALA HA H 1 4.345 0.03 . 1 . . 497 . A 76 ALA HA . 19178 1
618 . 1 1 76 76 ALA HB1 H 1 1.768 0.03 . 1 . . 377 . A 76 ALA HB1 . 19178 1
619 . 1 1 76 76 ALA HB2 H 1 1.768 0.03 . 1 . . 377 . A 76 ALA HB2 . 19178 1
620 . 1 1 76 76 ALA HB3 H 1 1.768 0.03 . 1 . . 377 . A 76 ALA HB3 . 19178 1
621 . 1 1 76 76 ALA C C 13 181.221 0.20 . 1 . . 225 . A 76 ALA C . 19178 1
622 . 1 1 76 76 ALA CA C 13 55.245 0.20 . 1 . . 212 . A 76 ALA CA . 19178 1
623 . 1 1 76 76 ALA CB C 13 18.316 0.20 . 1 . . 376 . A 76 ALA CB . 19178 1
624 . 1 1 76 76 ALA N N 15 122.773 0.10 . 1 . . 89 . A 76 ALA N . 19178 1
625 . 1 1 77 77 ILE H H 1 7.724 0.03 . 1 . . 78 . A 77 ILE H . 19178 1
626 . 1 1 77 77 ILE HA H 1 3.632 0.03 . 1 . . 496 . A 77 ILE HA . 19178 1
627 . 1 1 77 77 ILE HB H 1 2.216 0.03 . 1 . . 634 . A 77 ILE HB . 19178 1
628 . 1 1 77 77 ILE HG21 H 1 0.511 0.03 . 1 . . 643 . A 77 ILE HG21 . 19178 1
629 . 1 1 77 77 ILE HG22 H 1 0.511 0.03 . 1 . . 643 . A 77 ILE HG22 . 19178 1
630 . 1 1 77 77 ILE HG23 H 1 0.511 0.03 . 1 . . 643 . A 77 ILE HG23 . 19178 1
631 . 1 1 77 77 ILE HD11 H 1 1.016 0.03 . 1 . . 629 . A 77 ILE HD11 . 19178 1
632 . 1 1 77 77 ILE HD12 H 1 1.016 0.03 . 1 . . 629 . A 77 ILE HD12 . 19178 1
633 . 1 1 77 77 ILE HD13 H 1 1.016 0.03 . 1 . . 629 . A 77 ILE HD13 . 19178 1
634 . 1 1 77 77 ILE C C 13 176.567 0.20 . 1 . . 224 . A 77 ILE C . 19178 1
635 . 1 1 77 77 ILE CA C 13 66.365 0.20 . 1 . . 209 . A 77 ILE CA . 19178 1
636 . 1 1 77 77 ILE CB C 13 37.947 0.20 . 1 . . 211 . A 77 ILE CB . 19178 1
637 . 1 1 77 77 ILE CG1 C 13 29.344 0.20 . 1 . . 644 . A 77 ILE CG1 . 19178 1
638 . 1 1 77 77 ILE CG2 C 13 17.533 0.20 . 1 . . 633 . A 77 ILE CG2 . 19178 1
639 . 1 1 77 77 ILE CD1 C 13 15.363 0.20 . 1 . . 630 . A 77 ILE CD1 . 19178 1
640 . 1 1 77 77 ILE N N 15 120.254 0.10 . 1 . . 77 . A 77 ILE N . 19178 1
641 . 1 1 78 78 LYS H H 1 8.465 0.03 . 1 . . 117 . A 78 LYS H . 19178 1
642 . 1 1 78 78 LYS HA H 1 4.265 0.03 . 1 . . 495 . A 78 LYS HA . 19178 1
643 . 1 1 78 78 LYS C C 13 178.382 0.20 . 1 . . 223 . A 78 LYS C . 19178 1
644 . 1 1 78 78 LYS CA C 13 60.442 0.20 . 1 . . 210 . A 78 LYS CA . 19178 1
645 . 1 1 78 78 LYS CB C 13 33.021 0.20 . 1 . . 208 . A 78 LYS CB . 19178 1
646 . 1 1 78 78 LYS N N 15 122.773 0.10 . 1 . . 819 . A 78 LYS N . 19178 1
647 . 1 1 79 79 ASP H H 1 8.541 0.03 . 1 . . 107 . A 79 ASP H . 19178 1
648 . 1 1 79 79 ASP HA H 1 4.353 0.03 . 1 . . 492 . A 79 ASP HA . 19178 1
649 . 1 1 79 79 ASP HB2 H 1 2.679 0.03 . 2 . . 494 . A 79 ASP HB2 . 19178 1
650 . 1 1 79 79 ASP HB3 H 1 2.744 0.03 . 2 . . 493 . A 79 ASP HB3 . 19178 1
651 . 1 1 79 79 ASP C C 13 179.289 0.20 . 1 . . 222 . A 79 ASP C . 19178 1
652 . 1 1 79 79 ASP CA C 13 57.245 0.20 . 1 . . 207 . A 79 ASP CA . 19178 1
653 . 1 1 79 79 ASP N N 15 118.165 0.10 . 1 . . 108 . A 79 ASP N . 19178 1
654 . 1 1 80 80 ALA H H 1 7.727 0.03 . 1 . . 85 . A 80 ALA H . 19178 1
655 . 1 1 80 80 ALA HA H 1 4.340 0.03 . 1 . . 491 . A 80 ALA HA . 19178 1
656 . 1 1 80 80 ALA HB1 H 1 1.564 0.03 . 1 . . 380 . A 80 ALA HB1 . 19178 1
657 . 1 1 80 80 ALA HB2 H 1 1.564 0.03 . 1 . . 380 . A 80 ALA HB2 . 19178 1
658 . 1 1 80 80 ALA HB3 H 1 1.564 0.03 . 1 . . 380 . A 80 ALA HB3 . 19178 1
659 . 1 1 80 80 ALA C C 13 179.265 0.20 . 1 . . 233 . A 80 ALA C . 19178 1
660 . 1 1 80 80 ALA CA C 13 54.979 0.20 . 1 . . 206 . A 80 ALA CA . 19178 1
661 . 1 1 80 80 ALA CB C 13 18.254 0.20 . 1 . . 750 . A 80 ALA CB . 19178 1
662 . 1 1 80 80 ALA N N 15 122.362 0.10 . 1 . . 86 . A 80 ALA N . 19178 1
663 . 1 1 81 81 TYR H H 1 9.037 0.03 . 1 . . 19 . A 81 TYR H . 19178 1
664 . 1 1 81 81 TYR HA H 1 4.115 0.03 . 1 . . 490 . A 81 TYR HA . 19178 1
665 . 1 1 81 81 TYR HB2 H 1 3.193 0.03 . 2 . . 749 . A 81 TYR HB2 . 19178 1
666 . 1 1 81 81 TYR HB3 H 1 3.176 0.03 . 2 . . 748 . A 81 TYR HB3 . 19178 1
667 . 1 1 81 81 TYR HD1 H 1 6.944 0.03 . 3 . . 737 . A 81 TYR HD1 . 19178 1
668 . 1 1 81 81 TYR HD2 H 1 6.944 0.03 . 3 . . 737 . A 81 TYR HD2 . 19178 1
669 . 1 1 81 81 TYR HE1 H 1 6.792 0.03 . 3 . . 818 . A 81 TYR HE1 . 19178 1
670 . 1 1 81 81 TYR HE2 H 1 6.792 0.03 . 3 . . 818 . A 81 TYR HE2 . 19178 1
671 . 1 1 81 81 TYR C C 13 178.146 0.20 . 1 . . 232 . A 81 TYR C . 19178 1
672 . 1 1 81 81 TYR CA C 13 61.635 0.20 . 1 . . 204 . A 81 TYR CA . 19178 1
673 . 1 1 81 81 TYR CB C 13 38.115 0.20 . 1 . . 205 . A 81 TYR CB . 19178 1
674 . 1 1 81 81 TYR N N 15 118.882 0.10 . 1 . . 20 . A 81 TYR N . 19178 1
675 . 1 1 82 82 GLU H H 1 8.854 0.03 . 1 . . 15 . A 82 GLU H . 19178 1
676 . 1 1 82 82 GLU HA H 1 3.816 0.03 . 1 . . 489 . A 82 GLU HA . 19178 1
677 . 1 1 82 82 GLU HB2 H 1 2.020 0.03 . 2 . . 487 . A 82 GLU HB2 . 19178 1
678 . 1 1 82 82 GLU HB3 H 1 2.149 0.03 . 2 . . 488 . A 82 GLU HB3 . 19178 1
679 . 1 1 82 82 GLU HG2 H 1 2.335 0.03 . 2 . . 486 . A 82 GLU HG2 . 19178 1
680 . 1 1 82 82 GLU HG3 H 1 2.327 0.03 . 2 . . 485 . A 82 GLU HG3 . 19178 1
681 . 1 1 82 82 GLU C C 13 178.664 0.20 . 1 . . 234 . A 82 GLU C . 19178 1
682 . 1 1 82 82 GLU CA C 13 59.304 0.20 . 1 . . 202 . A 82 GLU CA . 19178 1
683 . 1 1 82 82 GLU CB C 13 28.848 0.20 . 1 . . 203 . A 82 GLU CB . 19178 1
684 . 1 1 82 82 GLU CG C 13 37.714 0.20 . 1 . . 401 . A 82 GLU CG . 19178 1
685 . 1 1 82 82 GLU N N 15 116.630 0.10 . 1 . . 16 . A 82 GLU N . 19178 1
686 . 1 1 83 83 SER H H 1 7.573 0.03 . 1 . . 62 . A 83 SER H . 19178 1
687 . 1 1 83 83 SER HA H 1 4.164 0.03 . 1 . . 482 . A 83 SER HA . 19178 1
688 . 1 1 83 83 SER HB2 H 1 3.367 0.03 . 2 . . 484 . A 83 SER HB2 . 19178 1
689 . 1 1 83 83 SER HB3 H 1 3.350 0.03 . 2 . . 483 . A 83 SER HB3 . 19178 1
690 . 1 1 83 83 SER C C 13 174.387 0.20 . 1 . . 235 . A 83 SER C . 19178 1
691 . 1 1 83 83 SER CA C 13 61.038 0.20 . 1 . . 200 . A 83 SER CA . 19178 1
692 . 1 1 83 83 SER CB C 13 63.152 0.20 . 1 . . 201 . A 83 SER CB . 19178 1
693 . 1 1 83 83 SER N N 15 114.004 0.10 . 1 . . 61 . A 83 SER N . 19178 1
694 . 1 1 84 84 TYR H H 1 7.319 0.03 . 1 . . 70 . A 84 TYR H . 19178 1
695 . 1 1 84 84 TYR HA H 1 4.595 0.03 . 1 . . 481 . A 84 TYR HA . 19178 1
696 . 1 1 84 84 TYR HB2 H 1 3.138 0.03 . 2 . . 480 . A 84 TYR HB2 . 19178 1
697 . 1 1 84 84 TYR HB3 H 1 3.154 0.03 . 2 . . 479 . A 84 TYR HB3 . 19178 1
698 . 1 1 84 84 TYR HD1 H 1 7.215 0.03 . 3 . . 632 . A 84 TYR HD1 . 19178 1
699 . 1 1 84 84 TYR HD2 H 1 7.215 0.03 . 3 . . 632 . A 84 TYR HD2 . 19178 1
700 . 1 1 84 84 TYR HE1 H 1 6.816 0.03 . 3 . . 611 . A 84 TYR HE1 . 19178 1
701 . 1 1 84 84 TYR HE2 H 1 6.816 0.03 . 3 . . 611 . A 84 TYR HE2 . 19178 1
702 . 1 1 84 84 TYR C C 13 174.434 0.20 . 1 . . 236 . A 84 TYR C . 19178 1
703 . 1 1 84 84 TYR CA C 13 58.871 0.20 . 1 . . 198 . A 84 TYR CA . 19178 1
704 . 1 1 84 84 TYR CB C 13 41.746 0.20 . 1 . . 199 . A 84 TYR CB . 19178 1
705 . 1 1 84 84 TYR CD1 C 13 133.624 0.20 . 3 . . 631 . A 84 TYR CD1 . 19178 1
706 . 1 1 84 84 TYR CD2 C 13 133.624 0.20 . 3 . . 631 . A 84 TYR CD2 . 19178 1
707 . 1 1 84 84 TYR CE1 C 13 117.512 0.20 . 3 . . 612 . A 84 TYR CE1 . 19178 1
708 . 1 1 84 84 TYR CE2 C 13 117.512 0.20 . 3 . . 612 . A 84 TYR CE2 . 19178 1
709 . 1 1 84 84 TYR N N 15 117.323 0.10 . 1 . . 69 . A 84 TYR N . 19178 1
710 . 1 1 85 85 CYS H H 1 7.670 0.03 . 1 . . 76 . A 85 CYS H . 19178 1
711 . 1 1 85 85 CYS HA H 1 3.940 0.03 . 1 . . 478 . A 85 CYS HA . 19178 1
712 . 1 1 85 85 CYS HB2 H 1 2.230 0.03 . 2 . . 742 . A 85 CYS HB2 . 19178 1
713 . 1 1 85 85 CYS HB3 H 1 2.888 0.03 . 2 . . 741 . A 85 CYS HB3 . 19178 1
714 . 1 1 85 85 CYS C C 13 176.178 0.20 . 1 . . 237 . A 85 CYS C . 19178 1
715 . 1 1 85 85 CYS CA C 13 58.817 0.20 . 1 . . 196 . A 85 CYS CA . 19178 1
716 . 1 1 85 85 CYS CB C 13 26.042 0.20 . 1 . . 197 . A 85 CYS CB . 19178 1
717 . 1 1 85 85 CYS N N 15 118.762 0.10 . 1 . . 75 . A 85 CYS N . 19178 1
718 . 1 1 86 86 GLY H H 1 10.799 0.03 . 1 . . 738 . A 86 GLY H . 19178 1
719 . 1 1 86 86 GLY HA2 H 1 4.094 0.03 . 2 . . 740 . A 86 GLY HA2 . 19178 1
720 . 1 1 86 86 GLY HA3 H 1 3.738 0.03 . 2 . . 477 . A 86 GLY HA3 . 19178 1
721 . 1 1 86 86 GLY C C 13 174.587 0.20 . 1 . . 238 . A 86 GLY C . 19178 1
722 . 1 1 86 86 GLY CA C 13 45.214 0.20 . 1 . . 195 . A 86 GLY CA . 19178 1
723 . 1 1 86 86 GLY N N 15 113.730 0.10 . 1 . . 739 . A 86 GLY N . 19178 1
724 . 1 1 87 87 ILE H H 1 8.023 0.03 . 1 . . 743 . A 87 ILE H . 19178 1
725 . 1 1 87 87 ILE HA H 1 4.291 0.03 . 1 . . 473 . A 87 ILE HA . 19178 1
726 . 1 1 87 87 ILE HB H 1 2.393 0.03 . 1 . . 474 . A 87 ILE HB . 19178 1
727 . 1 1 87 87 ILE HG12 H 1 1.028 0.03 . 2 . . 475 . A 87 ILE HG12 . 19178 1
728 . 1 1 87 87 ILE HG13 H 1 1.042 0.03 . 2 . . 476 . A 87 ILE HG13 . 19178 1
729 . 1 1 87 87 ILE HG21 H 1 1.067 0.03 . 1 . . 638 . A 87 ILE HG21 . 19178 1
730 . 1 1 87 87 ILE HG22 H 1 1.067 0.03 . 1 . . 638 . A 87 ILE HG22 . 19178 1
731 . 1 1 87 87 ILE HG23 H 1 1.067 0.03 . 1 . . 638 . A 87 ILE HG23 . 19178 1
732 . 1 1 87 87 ILE HD11 H 1 0.990 0.03 . 1 . . 354 . A 87 ILE HD11 . 19178 1
733 . 1 1 87 87 ILE HD12 H 1 0.990 0.03 . 1 . . 354 . A 87 ILE HD12 . 19178 1
734 . 1 1 87 87 ILE HD13 H 1 0.990 0.03 . 1 . . 354 . A 87 ILE HD13 . 19178 1
735 . 1 1 87 87 ILE C C 13 174.340 0.20 . 1 . . 239 . A 87 ILE C . 19178 1
736 . 1 1 87 87 ILE CA C 13 60.968 0.20 . 1 . . 193 . A 87 ILE CA . 19178 1
737 . 1 1 87 87 ILE CB C 13 35.512 0.20 . 1 . . 194 . A 87 ILE CB . 19178 1
738 . 1 1 87 87 ILE CG1 C 13 26.751 0.20 . 1 . . 637 . A 87 ILE CG1 . 19178 1
739 . 1 1 87 87 ILE CG2 C 13 17.360 0.20 . 1 . . 639 . A 87 ILE CG2 . 19178 1
740 . 1 1 87 87 ILE CD1 C 13 12.846 0.20 . 1 . . 355 . A 87 ILE CD1 . 19178 1
741 . 1 1 87 87 ILE N N 15 122.743 0.10 . 1 . . 132 . A 87 ILE N . 19178 1
742 . 1 1 88 88 ASP H H 1 8.127 0.03 . 1 . . 51 . A 88 ASP H . 19178 1
743 . 1 1 88 88 ASP HA H 1 4.750 0.03 . 1 . . 470 . A 88 ASP HA . 19178 1
744 . 1 1 88 88 ASP HB2 H 1 2.598 0.03 . 2 . . 472 . A 88 ASP HB2 . 19178 1
745 . 1 1 88 88 ASP HB3 H 1 2.694 0.03 . 2 . . 471 . A 88 ASP HB3 . 19178 1
746 . 1 1 88 88 ASP C C 13 175.895 0.20 . 1 . . 240 . A 88 ASP C . 19178 1
747 . 1 1 88 88 ASP CA C 13 54.319 0.20 . 1 . . 191 . A 88 ASP CA . 19178 1
748 . 1 1 88 88 ASP CB C 13 41.692 0.20 . 1 . . 192 . A 88 ASP CB . 19178 1
749 . 1 1 88 88 ASP N N 15 125.059 0.10 . 1 . . 52 . A 88 ASP N . 19178 1
750 . 1 1 89 89 ASP H H 1 7.617 0.03 . 1 . . 74 . A 89 ASP H . 19178 1
751 . 1 1 89 89 ASP HA H 1 4.822 0.03 . 1 . . 467 . A 89 ASP HA . 19178 1
752 . 1 1 89 89 ASP HB2 H 1 2.422 0.03 . 2 . . 469 . A 89 ASP HB2 . 19178 1
753 . 1 1 89 89 ASP HB3 H 1 2.513 0.03 . 2 . . 468 . A 89 ASP HB3 . 19178 1
754 . 1 1 89 89 ASP C C 13 174.069 0.20 . 1 . . 241 . A 89 ASP C . 19178 1
755 . 1 1 89 89 ASP CA C 13 52.369 0.20 . 1 . . 189 . A 89 ASP CA . 19178 1
756 . 1 1 89 89 ASP CB C 13 43.625 0.20 . 1 . . 190 . A 89 ASP CB . 19178 1
757 . 1 1 89 89 ASP N N 15 117.971 0.10 . 1 . . 73 . A 89 ASP N . 19178 1
758 . 1 1 90 90 CYS H H 1 8.936 0.03 . 1 . . 34 . A 90 CYS H . 19178 1
759 . 1 1 90 90 CYS C C 13 175.636 0.20 . 1 . . 242 . A 90 CYS C . 19178 1
760 . 1 1 90 90 CYS CA C 13 56.215 0.20 . 1 . . 188 . A 90 CYS CA . 19178 1
761 . 1 1 90 90 CYS N N 15 126.238 0.10 . 1 . . 33 . A 90 CYS N . 19178 1
762 . 1 1 91 91 PRO HA H 1 4.460 0.03 . 1 . . 460 . A 91 PRO HA . 19178 1
763 . 1 1 91 91 PRO HB2 H 1 1.970 0.03 . 2 . . 462 . A 91 PRO HB2 . 19178 1
764 . 1 1 91 91 PRO HB3 H 1 1.968 0.03 . 2 . . 461 . A 91 PRO HB3 . 19178 1
765 . 1 1 91 91 PRO HG2 H 1 0.897 0.03 . 1 . . 465 . A 91 PRO HG2 . 19178 1
766 . 1 1 91 91 PRO HG3 H 1 0.897 0.03 . 1 . . 466 . A 91 PRO HG3 . 19178 1
767 . 1 1 91 91 PRO HD2 H 1 2.115 0.03 . 2 . . 464 . A 91 PRO HD2 . 19178 1
768 . 1 1 91 91 PRO HD3 H 1 2.106 0.03 . 2 . . 463 . A 91 PRO HD3 . 19178 1
769 . 1 1 91 91 PRO C C 13 178.629 0.20 . 1 . . 243 . A 91 PRO C . 19178 1
770 . 1 1 91 91 PRO CA C 13 64.614 0.20 . 1 . . 186 . A 91 PRO CA . 19178 1
771 . 1 1 91 91 PRO CB C 13 32.208 0.20 . 1 . . 187 . A 91 PRO CB . 19178 1
772 . 1 1 91 91 PRO CG C 13 27.474 0.20 . 1 . . 400 . A 91 PRO CG . 19178 1
773 . 1 1 92 92 GLN H H 1 8.253 0.03 . 1 . . 100 . A 92 GLN H . 19178 1
774 . 1 1 92 92 GLN HA H 1 4.060 0.03 . 1 . . 455 . A 92 GLN HA . 19178 1
775 . 1 1 92 92 GLN HB2 H 1 0.616 0.03 . 2 . . 459 . A 92 GLN HB2 . 19178 1
776 . 1 1 92 92 GLN HB3 H 1 1.015 0.03 . 2 . . 702 . A 92 GLN HB3 . 19178 1
777 . 1 1 92 92 GLN HG2 H 1 2.046 0.03 . 2 . . 457 . A 92 GLN HG2 . 19178 1
778 . 1 1 92 92 GLN HG3 H 1 2.041 0.03 . 2 . . 456 . A 92 GLN HG3 . 19178 1
779 . 1 1 92 92 GLN HE21 H 1 6.976 0.03 . 1 . . 161 . A 92 GLN HE21 . 19178 1
780 . 1 1 92 92 GLN HE22 H 1 7.239 0.03 . 1 . . 159 . A 92 GLN HE22 . 19178 1
781 . 1 1 92 92 GLN C C 13 178.181 0.20 . 1 . . 244 . A 92 GLN C . 19178 1
782 . 1 1 92 92 GLN CA C 13 57.837 0.20 . 1 . . 185 . A 92 GLN CA . 19178 1
783 . 1 1 92 92 GLN CB C 13 28.252 0.20 . 1 . . 184 . A 92 GLN CB . 19178 1
784 . 1 1 92 92 GLN CG C 13 34.786 0.20 . 1 . . 399 . A 92 GLN CG . 19178 1
785 . 1 1 92 92 GLN N N 15 119.363 0.10 . 1 . . 99 . A 92 GLN N . 19178 1
786 . 1 1 92 92 GLN NE2 N 15 112.584 0.10 . 1 . . 160 . A 92 GLN NE2 . 19178 1
787 . 1 1 93 93 CYS H H 1 8.581 0.03 . 1 . . 123 . A 93 CYS H . 19178 1
788 . 1 1 93 93 CYS HA H 1 4.269 0.03 . 1 . . 453 . A 93 CYS HA . 19178 1
789 . 1 1 93 93 CYS HB2 H 1 3.057 0.03 . 2 . . 458 . A 93 CYS HB2 . 19178 1
790 . 1 1 93 93 CYS HB3 H 1 2.902 0.03 . 2 . . 454 . A 93 CYS HB3 . 19178 1
791 . 1 1 93 93 CYS C C 13 177.180 0.20 . 1 . . 245 . A 93 CYS C . 19178 1
792 . 1 1 93 93 CYS CA C 13 64.366 0.20 . 1 . . 183 . A 93 CYS CA . 19178 1
793 . 1 1 93 93 CYS CB C 13 30.379 0.20 . 1 . . 182 . A 93 CYS CB . 19178 1
794 . 1 1 93 93 CYS N N 15 124.725 0.10 . 1 . . 122 . A 93 CYS N . 19178 1
795 . 1 1 94 94 SER H H 1 7.753 0.03 . 1 . . 63 . A 94 SER H . 19178 1
796 . 1 1 94 94 SER HA H 1 4.277 0.03 . 1 . . 452 . A 94 SER HA . 19178 1
797 . 1 1 94 94 SER HB2 H 1 3.835 0.03 . 2 . . 451 . A 94 SER HB2 . 19178 1
798 . 1 1 94 94 SER HB3 H 1 3.838 0.03 . 2 . . 450 . A 94 SER HB3 . 19178 1
799 . 1 1 94 94 SER C C 13 174.481 0.20 . 1 . . 246 . A 94 SER C . 19178 1
800 . 1 1 94 94 SER CA C 13 59.432 0.20 . 1 . . 181 . A 94 SER CA . 19178 1
801 . 1 1 94 94 SER CB C 13 63.217 0.20 . 1 . . 180 . A 94 SER CB . 19178 1
802 . 1 1 94 94 SER N N 15 113.467 0.10 . 1 . . 64 . A 94 SER N . 19178 1
803 . 1 1 95 95 LYS H H 1 7.520 0.03 . 1 . . 83 . A 95 LYS H . 19178 1
804 . 1 1 95 95 LYS HA H 1 4.211 0.03 . 1 . . 443 . A 95 LYS HA . 19178 1
805 . 1 1 95 95 LYS HB2 H 1 1.701 0.03 . 2 . . 445 . A 95 LYS HB2 . 19178 1
806 . 1 1 95 95 LYS HB3 H 1 1.691 0.03 . 2 . . 444 . A 95 LYS HB3 . 19178 1
807 . 1 1 95 95 LYS HG2 H 1 1.580 0.03 . 1 . . 447 . A 95 LYS HG2 . 19178 1
808 . 1 1 95 95 LYS HG3 H 1 1.580 0.03 . 1 . . 446 . A 95 LYS HG3 . 19178 1
809 . 1 1 95 95 LYS HD2 H 1 1.285 0.03 . 2 . . 449 . A 95 LYS HD2 . 19178 1
810 . 1 1 95 95 LYS HD3 H 1 1.296 0.03 . 2 . . 448 . A 95 LYS HD3 . 19178 1
811 . 1 1 95 95 LYS HE2 H 1 2.936 0.03 . 1 . . 442 . A 95 LYS HE2 . 19178 1
812 . 1 1 95 95 LYS HE3 H 1 2.936 0.03 . 1 . . 441 . A 95 LYS HE3 . 19178 1
813 . 1 1 95 95 LYS C C 13 176.237 0.20 . 1 . . 247 . A 95 LYS C . 19178 1
814 . 1 1 95 95 LYS CA C 13 56.622 0.20 . 1 . . 178 . A 95 LYS CA . 19178 1
815 . 1 1 95 95 LYS CB C 13 32.756 0.20 . 1 . . 179 . A 95 LYS CB . 19178 1
816 . 1 1 95 95 LYS CG C 13 24.378 0.20 . 1 . . 398 . A 95 LYS CG . 19178 1
817 . 1 1 95 95 LYS CD C 13 29.128 0.20 . 1 . . 396 . A 95 LYS CD . 19178 1
818 . 1 1 95 95 LYS CE C 13 42.120 0.20 . 1 . . 397 . A 95 LYS CE . 19178 1
819 . 1 1 95 95 LYS N N 15 121.369 0.10 . 1 . . 84 . A 95 LYS N . 19178 1
820 . 1 1 96 96 TYR H H 1 8.005 0.03 . 1 . . 127 . A 96 TYR H . 19178 1
821 . 1 1 96 96 TYR HA H 1 4.559 0.03 . 1 . . 438 . A 96 TYR HA . 19178 1
822 . 1 1 96 96 TYR HB2 H 1 2.959 0.03 . 2 . . 440 . A 96 TYR HB2 . 19178 1
823 . 1 1 96 96 TYR HB3 H 1 3.070 0.03 . 2 . . 439 . A 96 TYR HB3 . 19178 1
824 . 1 1 96 96 TYR HD1 H 1 7.133 0.03 . 3 . . 595 . A 96 TYR HD1 . 19178 1
825 . 1 1 96 96 TYR HD2 H 1 7.133 0.03 . 3 . . 595 . A 96 TYR HD2 . 19178 1
826 . 1 1 96 96 TYR HE1 H 1 6.827 0.03 . 3 . . 596 . A 96 TYR HE1 . 19178 1
827 . 1 1 96 96 TYR HE2 H 1 6.827 0.03 . 3 . . 596 . A 96 TYR HE2 . 19178 1
828 . 1 1 96 96 TYR C C 13 175.577 0.20 . 1 . . 248 . A 96 TYR C . 19178 1
829 . 1 1 96 96 TYR CA C 13 58.039 0.20 . 1 . . 175 . A 96 TYR CA . 19178 1
830 . 1 1 96 96 TYR CB C 13 38.694 0.20 . 1 . . 177 . A 96 TYR CB . 19178 1
831 . 1 1 96 96 TYR CD1 C 13 133.052 0.20 . 3 . . 601 . A 96 TYR CD1 . 19178 1
832 . 1 1 96 96 TYR CD2 C 13 133.052 0.20 . 3 . . 601 . A 96 TYR CD2 . 19178 1
833 . 1 1 96 96 TYR CE1 C 13 118.035 0.20 . 3 . . 602 . A 96 TYR CE1 . 19178 1
834 . 1 1 96 96 TYR CE2 C 13 118.035 0.20 . 3 . . 602 . A 96 TYR CE2 . 19178 1
835 . 1 1 96 96 TYR N N 15 121.000 0.10 . 1 . . 126 . A 96 TYR N . 19178 1
836 . 1 1 97 97 ILE H H 1 7.832 0.03 . 1 . . 92 . A 97 ILE H . 19178 1
837 . 1 1 97 97 ILE HA H 1 4.120 0.03 . 1 . . 434 . A 97 ILE HA . 19178 1
838 . 1 1 97 97 ILE HB H 1 1.802 0.03 . 1 . . 435 . A 97 ILE HB . 19178 1
839 . 1 1 97 97 ILE HG12 H 1 1.414 0.03 . 2 . . 436 . A 97 ILE HG12 . 19178 1
840 . 1 1 97 97 ILE HG13 H 1 1.108 0.03 . 2 . . 437 . A 97 ILE HG13 . 19178 1
841 . 1 1 97 97 ILE HG21 H 1 0.876 0.03 . 1 . . 362 . A 97 ILE HG21 . 19178 1
842 . 1 1 97 97 ILE HG22 H 1 0.876 0.03 . 1 . . 362 . A 97 ILE HG22 . 19178 1
843 . 1 1 97 97 ILE HG23 H 1 0.876 0.03 . 1 . . 362 . A 97 ILE HG23 . 19178 1
844 . 1 1 97 97 ILE HD11 H 1 0.857 0.03 . 1 . . 356 . A 97 ILE HD11 . 19178 1
845 . 1 1 97 97 ILE HD12 H 1 0.857 0.03 . 1 . . 356 . A 97 ILE HD12 . 19178 1
846 . 1 1 97 97 ILE HD13 H 1 0.857 0.03 . 1 . . 356 . A 97 ILE HD13 . 19178 1
847 . 1 1 97 97 ILE C C 13 175.194 0.20 . 1 . . 249 . A 97 ILE C . 19178 1
848 . 1 1 97 97 ILE CA C 13 60.929 0.20 . 1 . . 173 . A 97 ILE CA . 19178 1
849 . 1 1 97 97 ILE CB C 13 39.044 0.20 . 1 . . 174 . A 97 ILE CB . 19178 1
850 . 1 1 97 97 ILE CG1 C 13 27.212 0.20 . 1 . . 395 . A 97 ILE CG1 . 19178 1
851 . 1 1 97 97 ILE CG2 C 13 17.352 0.20 . 1 . . 363 . A 97 ILE CG2 . 19178 1
852 . 1 1 97 97 ILE CD1 C 13 13.004 0.20 . 1 . . 357 . A 97 ILE CD1 . 19178 1
853 . 1 1 97 97 ILE N N 15 123.003 0.10 . 1 . . 91 . A 97 ILE N . 19178 1
854 . 1 1 98 98 ASP H H 1 8.245 0.03 . 1 . . 56 . A 98 ASP H . 19178 1
855 . 1 1 98 98 ASP HA H 1 4.627 0.03 . 1 . . 431 . A 98 ASP HA . 19178 1
856 . 1 1 98 98 ASP HB2 H 1 2.529 0.03 . 2 . . 433 . A 98 ASP HB2 . 19178 1
857 . 1 1 98 98 ASP HB3 H 1 2.748 0.03 . 2 . . 432 . A 98 ASP HB3 . 19178 1
858 . 1 1 98 98 ASP C C 13 174.976 0.20 . 1 . . 250 . A 98 ASP C . 19178 1
859 . 1 1 98 98 ASP CA C 13 54.184 0.20 . 1 . . 171 . A 98 ASP CA . 19178 1
860 . 1 1 98 98 ASP CB C 13 41.502 0.20 . 1 . . 172 . A 98 ASP CB . 19178 1
861 . 1 1 98 98 ASP N N 15 125.070 0.10 . 1 . . 55 . A 98 ASP N . 19178 1
862 . 1 1 99 99 ASP H H 1 7.895 0.03 . 1 . . 45 . A 99 ASP H . 19178 1
863 . 1 1 99 99 ASP CA C 13 56.018 0.20 . 1 . . 169 . A 99 ASP CA . 19178 1
864 . 1 1 99 99 ASP CB C 13 42.513 0.20 . 1 . . 170 . A 99 ASP CB . 19178 1
865 . 1 1 99 99 ASP N N 15 126.602 0.10 . 1 . . 46 . A 99 ASP N . 19178 1
stop_
save_