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 19462
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 0.03
_Assigned_chem_shift_list.Chem_shift_13C_err 0.2
_Assigned_chem_shift_list.Chem_shift_15N_err 0.2
_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 'approximate digital resolution of spectra'
_Assigned_chem_shift_list.Details
;
Note that because these are assignments for a minor trans form we only see split
peaks for about 50% of the residues in the sequence. For the remainder the cis
and trans forms are magnetically equivalent so the assignments are the same as
for the corresponding residues in the major cis form (entry 19461). We did not
list the residues here that did not show splitting between the cis and trans forms.
;
_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 '3D HNCACB' . . . 19462 1
2 '3D HN(CO)CA' . . . 19462 1
3 '3D HNCO' . . . 19462 1
4 '3D HN(CA)CO' . . . 19462 1
5 '2D 1H-15N HSQC' . . . 19462 1
6 '2D 1H-13C HSQC' . . . 19462 1
7 '2D 1H-1H TOCSY' . . . 19462 1
8 '3D HCCH-TOCSY' . . . 19462 1
9 '3D CCH-TOCSY' . . . 19462 1
10 '3D HNHA' . . . 19462 1
11 '3D HNHB' . . . 19462 1
12 '3D 1H-15N TOCSY' . . . 19462 1
13 '3D 1H-13C NOESY aliphatic' . . . 19462 1
14 '3D 1H-15N NOESY' . . . 19462 1
15 '2D DQF-COSY' . . . 19462 1
16 '2D 1H-1H NOESY' . . . 19462 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 4 4 LYS H H 1 8.235 0.03 . 1 . . 797 . . 4 LYS H . 19462 1
2 . 1 . 1 4 4 LYS HA H 1 4.100 0.03 . 1 . . 794 . . 4 LYS HA . 19462 1
3 . 1 . 1 4 4 LYS HB3 H 1 2.274 0.03 . 1 . . 795 . . 4 LYS HB3 . 19462 1
4 . 1 . 1 4 4 LYS C C 13 175.850 0.2 . 1 . . 697 . . 4 LYS C . 19462 1
5 . 1 . 1 4 4 LYS CA C 13 55.996 0.2 . 1 . . 695 . . 4 LYS CA . 19462 1
6 . 1 . 1 4 4 LYS CB C 13 33.576 0.2 . 1 . . 693 . . 4 LYS CB . 19462 1
7 . 1 . 1 4 4 LYS N N 15 121.076 0.2 . 1 . . 796 . . 4 LYS N . 19462 1
8 . 1 . 1 5 5 ALA H H 1 8.387 0.03 . 1 . . 691 . . 5 ALA H . 19462 1
9 . 1 . 1 5 5 ALA HA H 1 4.340 0.03 . 1 . . 889 . . 5 ALA HA . 19462 1
10 . 1 . 1 5 5 ALA HB1 H 1 1.449 0.03 . 1 . . 721 . . 5 ALA HB1 . 19462 1
11 . 1 . 1 5 5 ALA HB2 H 1 1.449 0.03 . 1 . . 721 . . 5 ALA HB2 . 19462 1
12 . 1 . 1 5 5 ALA HB3 H 1 1.449 0.03 . 1 . . 721 . . 5 ALA HB3 . 19462 1
13 . 1 . 1 5 5 ALA C C 13 177.883 0.2 . 1 . . 696 . . 5 ALA C . 19462 1
14 . 1 . 1 5 5 ALA CA C 13 53.272 0.2 . 1 . . 694 . . 5 ALA CA . 19462 1
15 . 1 . 1 5 5 ALA CB C 13 19.817 0.2 . 1 . . 692 . . 5 ALA CB . 19462 1
16 . 1 . 1 5 5 ALA N N 15 125.485 0.2 . 1 . . 690 . . 5 ALA N . 19462 1
17 . 1 . 1 9 9 GLN HE21 H 1 7.371 0.03 . 1 . . 964 . . 9 GLN HE21 . 19462 1
18 . 1 . 1 9 9 GLN HE22 H 1 7.006 0.03 . 1 . . 963 . . 9 GLN HE22 . 19462 1
19 . 1 . 1 9 9 GLN NE2 N 15 109.628 0.2 . 1 . . 965 . . 9 GLN NE2 . 19462 1
20 . 1 . 1 12 12 SER H H 1 7.952 0.03 . 1 . . 687 . . 12 SER H . 19462 1
21 . 1 . 1 12 12 SER HA H 1 4.729 0.03 . 1 . . 723 . . 12 SER HA . 19462 1
22 . 1 . 1 12 12 SER HB2 H 1 4.186 0.03 . 2 . . 725 . . 12 SER HB2 . 19462 1
23 . 1 . 1 12 12 SER HB3 H 1 4.458 0.03 . 2 . . 724 . . 12 SER HB3 . 19462 1
24 . 1 . 1 12 12 SER C C 13 177.37 0.2 . 1 . . 684 . . 12 SER C . 19462 1
25 . 1 . 1 12 12 SER N N 15 114.524 0.2 . 1 . . 688 . . 12 SER N . 19462 1
26 . 1 . 1 13 13 ILE H H 1 8.097 0.03 . 1 . . 678 . . 13 ILE H . 19462 1
27 . 1 . 1 13 13 ILE HA H 1 3.776 0.03 . 1 . . 881 . . 13 ILE HA . 19462 1
28 . 1 . 1 13 13 ILE HB H 1 2.087 0.03 . 1 . . 727 . . 13 ILE HB . 19462 1
29 . 1 . 1 13 13 ILE HG12 H 1 1.232 0.03 . 2 . . 885 . . 13 ILE HG12 . 19462 1
30 . 1 . 1 13 13 ILE HG13 H 1 1.543 0.03 . 2 . . 886 . . 13 ILE HG13 . 19462 1
31 . 1 . 1 13 13 ILE HG21 H 1 0.738 0.03 . 1 . . 887 . . 13 ILE HG21 . 19462 1
32 . 1 . 1 13 13 ILE HG22 H 1 0.738 0.03 . 1 . . 887 . . 13 ILE HG22 . 19462 1
33 . 1 . 1 13 13 ILE HG23 H 1 0.738 0.03 . 1 . . 887 . . 13 ILE HG23 . 19462 1
34 . 1 . 1 13 13 ILE HD11 H 1 0.679 0.03 . 1 . . 888 . . 13 ILE HD11 . 19462 1
35 . 1 . 1 13 13 ILE HD12 H 1 0.679 0.03 . 1 . . 888 . . 13 ILE HD12 . 19462 1
36 . 1 . 1 13 13 ILE HD13 H 1 0.679 0.03 . 1 . . 888 . . 13 ILE HD13 . 19462 1
37 . 1 . 1 13 13 ILE C C 13 177.228 0.2 . 1 . . 681 . . 13 ILE C . 19462 1
38 . 1 . 1 13 13 ILE CA C 13 64.297 0.2 . 1 . . 679 . . 13 ILE CA . 19462 1
39 . 1 . 1 13 13 ILE CB C 13 37.608 0.2 . 1 . . 680 . . 13 ILE CB . 19462 1
40 . 1 . 1 13 13 ILE CG1 C 13 29.791 0.2 . 1 . . 882 . . 13 ILE CG1 . 19462 1
41 . 1 . 1 13 13 ILE CG2 C 13 18.841 0.2 . 1 . . 883 . . 13 ILE CG2 . 19462 1
42 . 1 . 1 13 13 ILE CD1 C 13 12.899 0.2 . 1 . . 884 . . 13 ILE CD1 . 19462 1
43 . 1 . 1 13 13 ILE N N 15 122.116 0.2 . 1 . . 677 . . 13 ILE N . 19462 1
44 . 1 . 1 14 14 ASN H H 1 8.458 0.03 . 1 . . 671 . . 14 ASN H . 19462 1
45 . 1 . 1 14 14 ASN HA H 1 4.657 0.03 . 1 . . 728 . . 14 ASN HA . 19462 1
46 . 1 . 1 14 14 ASN HB2 H 1 2.833 0.03 . 2 . . 910 . . 14 ASN HB2 . 19462 1
47 . 1 . 1 14 14 ASN HB3 H 1 2.968 0.03 . 2 . . 911 . . 14 ASN HB3 . 19462 1
48 . 1 . 1 14 14 ASN HD21 H 1 7.964 0.03 . 1 . . 972 . . 14 ASN HD21 . 19462 1
49 . 1 . 1 14 14 ASN HD22 H 1 7.453 0.03 . 1 . . 971 . . 14 ASN HD22 . 19462 1
50 . 1 . 1 14 14 ASN C C 13 178.293 0.2 . 1 . . 673 . . 14 ASN C . 19462 1
51 . 1 . 1 14 14 ASN CA C 13 56.818 0.2 . 1 . . 674 . . 14 ASN CA . 19462 1
52 . 1 . 1 14 14 ASN CB C 13 38.159 0.2 . 1 . . 675 . . 14 ASN CB . 19462 1
53 . 1 . 1 14 14 ASN N N 15 118.513 0.2 . 1 . . 672 . . 14 ASN N . 19462 1
54 . 1 . 1 14 14 ASN ND2 N 15 110.456 0.2 . 1 . . 970 . . 14 ASN ND2 . 19462 1
55 . 1 . 1 15 15 SER H H 1 8.324 0.03 . 1 . . 666 . . 15 SER H . 19462 1
56 . 1 . 1 15 15 SER HA H 1 4.141 0.03 . 1 . . 905 . . 15 SER HA . 19462 1
57 . 1 . 1 15 15 SER HB2 H 1 4.188 0.03 . 2 . . 729 . . 15 SER HB2 . 19462 1
58 . 1 . 1 15 15 SER HB3 H 1 4.144 0.03 . 2 . . 906 . . 15 SER HB3 . 19462 1
59 . 1 . 1 15 15 SER C C 13 177.253 0.2 . 1 . . 668 . . 15 SER C . 19462 1
60 . 1 . 1 15 15 SER CA C 13 61.803 0.2 . 1 . . 669 . . 15 SER CA . 19462 1
61 . 1 . 1 15 15 SER CB C 13 63.622 0.2 . 1 . . 670 . . 15 SER CB . 19462 1
62 . 1 . 1 15 15 SER N N 15 116.588 0.2 . 1 . . 667 . . 15 SER N . 19462 1
63 . 1 . 1 16 16 VAL H H 1 7.897 0.03 . 1 . . 661 . . 16 VAL H . 19462 1
64 . 1 . 1 16 16 VAL HA H 1 3.825 0.03 . 1 . . 743 . . 16 VAL HA . 19462 1
65 . 1 . 1 16 16 VAL HB H 1 2.273 0.03 . 1 . . 742 . . 16 VAL HB . 19462 1
66 . 1 . 1 16 16 VAL HG11 H 1 1.190 0.03 . 2 . . 741 . . 16 VAL HG11 . 19462 1
67 . 1 . 1 16 16 VAL HG12 H 1 1.190 0.03 . 2 . . 741 . . 16 VAL HG12 . 19462 1
68 . 1 . 1 16 16 VAL HG13 H 1 1.190 0.03 . 2 . . 741 . . 16 VAL HG13 . 19462 1
69 . 1 . 1 16 16 VAL HG21 H 1 0.893 0.03 . 2 . . 740 . . 16 VAL HG21 . 19462 1
70 . 1 . 1 16 16 VAL HG22 H 1 0.893 0.03 . 2 . . 740 . . 16 VAL HG22 . 19462 1
71 . 1 . 1 16 16 VAL HG23 H 1 0.893 0.03 . 2 . . 740 . . 16 VAL HG23 . 19462 1
72 . 1 . 1 16 16 VAL C C 13 177.512 0.2 . 1 . . 663 . . 16 VAL C . 19462 1
73 . 1 . 1 16 16 VAL CA C 13 66.669 0.2 . 1 . . 664 . . 16 VAL CA . 19462 1
74 . 1 . 1 16 16 VAL CB C 13 31.774 0.2 . 1 . . 665 . . 16 VAL CB . 19462 1
75 . 1 . 1 16 16 VAL CG1 C 13 21.895 0.2 . 2 . . 892 . . 16 VAL CG1 . 19462 1
76 . 1 . 1 16 16 VAL CG2 C 13 24.158 0.2 . 2 . . 891 . . 16 VAL CG2 . 19462 1
77 . 1 . 1 16 16 VAL N N 15 123.025 0.2 . 1 . . 662 . . 16 VAL N . 19462 1
78 . 1 . 1 17 17 ASN H H 1 8.262 0.03 . 1 . . 656 . . 17 ASN H . 19462 1
79 . 1 . 1 17 17 ASN HA H 1 4.483 0.03 . 1 . . 912 . . 17 ASN HA . 19462 1
80 . 1 . 1 17 17 ASN HB2 H 1 2.784 0.03 . 2 . . 913 . . 17 ASN HB2 . 19462 1
81 . 1 . 1 17 17 ASN HB3 H 1 2.645 0.03 . 2 . . 914 . . 17 ASN HB3 . 19462 1
82 . 1 . 1 17 17 ASN C C 13 179.072 0.2 . 1 . . 658 . . 17 ASN C . 19462 1
83 . 1 . 1 17 17 ASN CA C 13 56.574 0.2 . 1 . . 659 . . 17 ASN CA . 19462 1
84 . 1 . 1 17 17 ASN CB C 13 38.302 0.2 . 1 . . 660 . . 17 ASN CB . 19462 1
85 . 1 . 1 17 17 ASN N N 15 119.432 0.2 . 1 . . 657 . . 17 ASN N . 19462 1
86 . 1 . 1 18 18 ASP H H 1 7.607 0.03 . 1 . . 651 . . 18 ASP H . 19462 1
87 . 1 . 1 18 18 ASP HA H 1 4.642 0.03 . 1 . . 744 . . 18 ASP HA . 19462 1
88 . 1 . 1 18 18 ASP HB2 H 1 2.817 0.03 . 2 . . 921 . . 18 ASP HB2 . 19462 1
89 . 1 . 1 18 18 ASP HB3 H 1 2.881 0.03 . 2 . . 745 . . 18 ASP HB3 . 19462 1
90 . 1 . 1 18 18 ASP C C 13 178.453 0.2 . 1 . . 653 . . 18 ASP C . 19462 1
91 . 1 . 1 18 18 ASP CA C 13 57.707 0.2 . 1 . . 654 . . 18 ASP CA . 19462 1
92 . 1 . 1 18 18 ASP CB C 13 41.560 0.2 . 1 . . 655 . . 18 ASP CB . 19462 1
93 . 1 . 1 18 18 ASP N N 15 118.117 0.2 . 1 . . 652 . . 18 ASP N . 19462 1
94 . 1 . 1 21 21 ASN HD21 H 1 6.878 0.03 . 1 . . 991 . . 21 ASN HD21 . 19462 1
95 . 1 . 1 21 21 ASN HD22 H 1 7.607 0.03 . 1 . . 989 . . 21 ASN HD22 . 19462 1
96 . 1 . 1 21 21 ASN ND2 N 15 110.765 0.2 . 1 . . 990 . . 21 ASN ND2 . 19462 1
97 . 1 . 1 25 25 GLY H H 1 8.440 0.03 . 1 . . 649 . . 25 GLY H . 19462 1
98 . 1 . 1 25 25 GLY HA2 H 1 3.448 0.03 . 2 . . 747 . . 25 GLY HA2 . 19462 1
99 . 1 . 1 25 25 GLY HA3 H 1 4.376 0.03 . 2 . . 746 . . 25 GLY HA3 . 19462 1
100 . 1 . 1 25 25 GLY C C 13 172.897 0.2 . 1 . . 647 . . 25 GLY C . 19462 1
101 . 1 . 1 25 25 GLY CA C 13 46.663 0.2 . 1 . . 648 . . 25 GLY CA . 19462 1
102 . 1 . 1 25 25 GLY N N 15 111.810 0.2 . 1 . . 650 . . 25 GLY N . 19462 1
103 . 1 . 1 27 27 LEU H H 1 8.657 0.03 . 1 . . 998 . . 27 LEU H . 19462 1
104 . 1 . 1 27 27 LEU HA H 1 4.672 0.03 . 1 . . 750 . . 27 LEU HA . 19462 1
105 . 1 . 1 27 27 LEU HB2 H 1 1.723 0.03 . 1 . . 749 . . 27 LEU HB2 . 19462 1
106 . 1 . 1 27 27 LEU HB3 H 1 0.993 0.03 . 1 . . 748 . . 27 LEU HB3 . 19462 1
107 . 1 . 1 27 27 LEU HG H 1 1.136 0.03 . 1 . . 1003 . . 27 LEU HG . 19462 1
108 . 1 . 1 27 27 LEU HD11 H 1 0.343 0.03 . 2 . . 1005 . . 27 LEU HD11 . 19462 1
109 . 1 . 1 27 27 LEU HD12 H 1 0.343 0.03 . 2 . . 1005 . . 27 LEU HD12 . 19462 1
110 . 1 . 1 27 27 LEU HD13 H 1 0.343 0.03 . 2 . . 1005 . . 27 LEU HD13 . 19462 1
111 . 1 . 1 27 27 LEU HD21 H 1 0.601 0.03 . 2 . . 937 . . 27 LEU HD21 . 19462 1
112 . 1 . 1 27 27 LEU HD22 H 1 0.601 0.03 . 2 . . 937 . . 27 LEU HD22 . 19462 1
113 . 1 . 1 27 27 LEU HD23 H 1 0.601 0.03 . 2 . . 937 . . 27 LEU HD23 . 19462 1
114 . 1 . 1 27 27 LEU C C 13 174.122 0.2 . 1 . . 463 . . 27 LEU C . 19462 1
115 . 1 . 1 27 27 LEU CA C 13 53.713 0.2 . 1 . . 464 . . 27 LEU CA . 19462 1
116 . 1 . 1 27 27 LEU CB C 13 45.537 0.2 . 1 . . 465 . . 27 LEU CB . 19462 1
117 . 1 . 1 27 27 LEU CG C 13 27.726 0.2 . 1 . . 1006 . . 27 LEU CG . 19462 1
118 . 1 . 1 27 27 LEU CD1 C 13 27.220 0.2 . 2 . . 1004 . . 27 LEU CD1 . 19462 1
119 . 1 . 1 27 27 LEU CD2 C 13 24.562 0.2 . 2 . . 936 . . 27 LEU CD2 . 19462 1
120 . 1 . 1 27 27 LEU N N 15 129.123 0.2 . 1 . . 999 . . 27 LEU N . 19462 1
121 . 1 . 1 31 31 MET H H 1 8.403 0.03 . 1 . . 642 . . 31 MET H . 19462 1
122 . 1 . 1 31 31 MET HA H 1 5.369 0.03 . 1 . . 730 . . 31 MET HA . 19462 1
123 . 1 . 1 31 31 MET HB2 H 1 1.860 0.03 . 1 . . 731 . . 31 MET HB2 . 19462 1
124 . 1 . 1 31 31 MET HB3 H 1 2.223 0.03 . 1 . . 948 . . 31 MET HB3 . 19462 1
125 . 1 . 1 31 31 MET C C 13 176.328 0.2 . 1 . . 646 . . 31 MET C . 19462 1
126 . 1 . 1 31 31 MET CA C 13 53.307 0.2 . 1 . . 644 . . 31 MET CA . 19462 1
127 . 1 . 1 31 31 MET CB C 13 32.088 0.2 . 1 . . 645 . . 31 MET CB . 19462 1
128 . 1 . 1 31 31 MET N N 15 117.489 0.2 . 1 . . 643 . . 31 MET N . 19462 1
129 . 1 . 1 32 32 ASN H H 1 9.126 0.03 . 1 . . 484 . . 32 ASN H . 19462 1
130 . 1 . 1 32 32 ASN HA H 1 4.923 0.03 . 1 . . 753 . . 32 ASN HA . 19462 1
131 . 1 . 1 32 32 ASN HB2 H 1 2.550 0.03 . 1 . . 751 . . 32 ASN HB2 . 19462 1
132 . 1 . 1 32 32 ASN HB3 H 1 2.826 0.03 . 1 . . 752 . . 32 ASN HB3 . 19462 1
133 . 1 . 1 32 32 ASN C C 13 176.071 0.2 . 1 . . 488 . . 32 ASN C . 19462 1
134 . 1 . 1 32 32 ASN CA C 13 52.529 0.2 . 1 . . 486 . . 32 ASN CA . 19462 1
135 . 1 . 1 32 32 ASN CB C 13 39.756 0.2 . 1 . . 487 . . 32 ASN CB . 19462 1
136 . 1 . 1 32 32 ASN N N 15 123.630 0.2 . 1 . . 485 . . 32 ASN N . 19462 1
137 . 1 . 1 33 33 GLY H H 1 8.718 0.03 . 1 . . 639 . . 33 GLY H . 19462 1
138 . 1 . 1 33 33 GLY HA2 H 1 3.622 0.03 . 2 . . 924 . . 33 GLY HA2 . 19462 1
139 . 1 . 1 33 33 GLY HA3 H 1 3.962 0.03 . 2 . . 923 . . 33 GLY HA3 . 19462 1
140 . 1 . 1 33 33 GLY C C 13 174.267 0.2 . 1 . . 638 . . 33 GLY C . 19462 1
141 . 1 . 1 33 33 GLY CA C 13 47.682 0.2 . 1 . . 641 . . 33 GLY CA . 19462 1
142 . 1 . 1 33 33 GLY N N 15 116.238 0.2 . 1 . . 640 . . 33 GLY N . 19462 1
143 . 1 . 1 34 34 ASN H H 1 8.660 0.03 . 1 . . 633 . . 34 ASN H . 19462 1
144 . 1 . 1 34 34 ASN HA H 1 4.581 0.03 . 1 . . 915 . . 34 ASN HA . 19462 1
145 . 1 . 1 34 34 ASN HB2 H 1 2.796 0.03 . 2 . . 917 . . 34 ASN HB2 . 19462 1
146 . 1 . 1 34 34 ASN HB3 H 1 2.705 0.03 . 2 . . 916 . . 34 ASN HB3 . 19462 1
147 . 1 . 1 34 34 ASN HD21 H 1 6.912 0.03 . 1 . . 985 . . 34 ASN HD21 . 19462 1
148 . 1 . 1 34 34 ASN HD22 H 1 7.678 0.03 . 1 . . 983 . . 34 ASN HD22 . 19462 1
149 . 1 . 1 34 34 ASN C C 13 173.803 0.2 . 1 . . 637 . . 34 ASN C . 19462 1
150 . 1 . 1 34 34 ASN CA C 13 53.308 0.2 . 1 . . 636 . . 34 ASN CA . 19462 1
151 . 1 . 1 34 34 ASN CB C 13 39.246 0.2 . 1 . . 635 . . 34 ASN CB . 19462 1
152 . 1 . 1 34 34 ASN N N 15 121.887 0.2 . 1 . . 634 . . 34 ASN N . 19462 1
153 . 1 . 1 34 34 ASN ND2 N 15 112.840 0.2 . 1 . . 984 . . 34 ASN ND2 . 19462 1
154 . 1 . 1 35 35 GLN H H 1 7.709 0.03 . 1 . . 628 . . 35 GLN H . 19462 1
155 . 1 . 1 35 35 GLN HA H 1 4.691 0.03 . 1 . . 931 . . 35 GLN HA . 19462 1
156 . 1 . 1 35 35 GLN HB2 H 1 2.115 0.03 . 2 . . 933 . . 35 GLN HB2 . 19462 1
157 . 1 . 1 35 35 GLN HB3 H 1 2.012 0.03 . 2 . . 754 . . 35 GLN HB3 . 19462 1
158 . 1 . 1 35 35 GLN HG2 H 1 2.288 0.03 . 2 . . 935 . . 35 GLN HG2 . 19462 1
159 . 1 . 1 35 35 GLN HG3 H 1 2.135 0.03 . 2 . . 934 . . 35 GLN HG3 . 19462 1
160 . 1 . 1 35 35 GLN HE21 H 1 7.591 0.03 . 1 . . 993 . . 35 GLN HE21 . 19462 1
161 . 1 . 1 35 35 GLN HE22 H 1 6.755 0.03 . 1 . . 994 . . 35 GLN HE22 . 19462 1
162 . 1 . 1 35 35 GLN C C 13 174.648 0.2 . 1 . . 630 . . 35 GLN C . 19462 1
163 . 1 . 1 35 35 GLN CA C 13 55.115 0.2 . 1 . . 631 . . 35 GLN CA . 19462 1
164 . 1 . 1 35 35 GLN CB C 13 32.086 0.2 . 1 . . 632 . . 35 GLN CB . 19462 1
165 . 1 . 1 35 35 GLN CG C 13 36.318 0.2 . 1 . . 932 . . 35 GLN CG . 19462 1
166 . 1 . 1 35 35 GLN N N 15 118.748 0.2 . 1 . . 629 . . 35 GLN N . 19462 1
167 . 1 . 1 35 35 GLN NE2 N 15 111.217 0.2 . 1 . . 992 . . 35 GLN NE2 . 19462 1
168 . 1 . 1 36 36 LEU H H 1 8.528 0.03 . 1 . . 623 . . 36 LEU H . 19462 1
169 . 1 . 1 36 36 LEU HA H 1 4.763 0.03 . 1 . . 938 . . 36 LEU HA . 19462 1
170 . 1 . 1 36 36 LEU HB2 H 1 1.093 0.03 . 1 . . 941 . . 36 LEU HB2 . 19462 1
171 . 1 . 1 36 36 LEU HB3 H 1 1.875 0.03 . 1 . . 756 . . 36 LEU HB3 . 19462 1
172 . 1 . 1 36 36 LEU HG H 1 0.813 0.03 . 1 . . 942 . . 36 LEU HG . 19462 1
173 . 1 . 1 36 36 LEU HD11 H 1 0.917 0.03 . 2 . . 943 . . 36 LEU HD11 . 19462 1
174 . 1 . 1 36 36 LEU HD12 H 1 0.917 0.03 . 2 . . 943 . . 36 LEU HD12 . 19462 1
175 . 1 . 1 36 36 LEU HD13 H 1 0.917 0.03 . 2 . . 943 . . 36 LEU HD13 . 19462 1
176 . 1 . 1 36 36 LEU HD21 H 1 1.180 0.03 . 2 . . 755 . . 36 LEU HD21 . 19462 1
177 . 1 . 1 36 36 LEU HD22 H 1 1.180 0.03 . 2 . . 755 . . 36 LEU HD22 . 19462 1
178 . 1 . 1 36 36 LEU HD23 H 1 1.180 0.03 . 2 . . 755 . . 36 LEU HD23 . 19462 1
179 . 1 . 1 36 36 LEU C C 13 175.019 0.2 . 1 . . 625 . . 36 LEU C . 19462 1
180 . 1 . 1 36 36 LEU CA C 13 55.956 0.2 . 1 . . 627 . . 36 LEU CA . 19462 1
181 . 1 . 1 36 36 LEU CB C 13 43.012 0.2 . 1 . . 626 . . 36 LEU CB . 19462 1
182 . 1 . 1 36 36 LEU CG C 13 27.518 0.2 . 1 . . 939 . . 36 LEU CG . 19462 1
183 . 1 . 1 36 36 LEU CD2 C 13 24.649 0.2 . 1 . . 940 . . 36 LEU CD2 . 19462 1
184 . 1 . 1 36 36 LEU N N 15 127.409 0.2 . 1 . . 624 . . 36 LEU N . 19462 1
185 . 1 . 1 37 37 LYS H H 1 9.255 0.03 . 1 . . 458 . . 37 LYS H . 19462 1
186 . 1 . 1 37 37 LYS HA H 1 4.837 0.03 . 1 . . 759 . . 37 LYS HA . 19462 1
187 . 1 . 1 37 37 LYS HB3 H 1 1.638 0.03 . 1 . . 760 . . 37 LYS HB3 . 19462 1
188 . 1 . 1 37 37 LYS HG3 H 1 1.324 0.03 . 1 . . 761 . . 37 LYS HG3 . 19462 1
189 . 1 . 1 37 37 LYS C C 13 174.299 0.2 . 1 . . 462 . . 37 LYS C . 19462 1
190 . 1 . 1 37 37 LYS CA C 13 54.292 0.2 . 1 . . 460 . . 37 LYS CA . 19462 1
191 . 1 . 1 37 37 LYS CB C 13 35.941 0.2 . 1 . . 461 . . 37 LYS CB . 19462 1
192 . 1 . 1 37 37 LYS N N 15 129.121 0.2 . 1 . . 459 . . 37 LYS N . 19462 1
193 . 1 . 1 38 38 ALA H H 1 9.452 0.03 . 1 . . 479 . . 38 ALA H . 19462 1
194 . 1 . 1 38 38 ALA HA H 1 5.378 0.03 . 1 . . 762 . . 38 ALA HA . 19462 1
195 . 1 . 1 38 38 ALA HB1 H 1 1.133 0.03 . 1 . . 763 . . 38 ALA HB1 . 19462 1
196 . 1 . 1 38 38 ALA HB2 H 1 1.133 0.03 . 1 . . 763 . . 38 ALA HB2 . 19462 1
197 . 1 . 1 38 38 ALA HB3 H 1 1.133 0.03 . 1 . . 763 . . 38 ALA HB3 . 19462 1
198 . 1 . 1 38 38 ALA C C 13 176.940 0.2 . 1 . . 481 . . 38 ALA C . 19462 1
199 . 1 . 1 38 38 ALA CA C 13 50.498 0.2 . 1 . . 483 . . 38 ALA CA . 19462 1
200 . 1 . 1 38 38 ALA CB C 13 24.040 0.2 . 1 . . 482 . . 38 ALA CB . 19462 1
201 . 1 . 1 38 38 ALA N N 15 125.005 0.2 . 1 . . 480 . . 38 ALA N . 19462 1
202 . 1 . 1 53 53 ASN HD21 H 1 7.184 0.03 . 1 . . 995 . . 53 ASN HD21 . 19462 1
203 . 1 . 1 53 53 ASN HD22 H 1 8.062 0.03 . 1 . . 996 . . 53 ASN HD22 . 19462 1
204 . 1 . 1 53 53 ASN ND2 N 15 116.345 0.2 . 1 . . 997 . . 53 ASN ND2 . 19462 1
205 . 1 . 1 55 55 GLY H H 1 9.533 0.03 . 1 . . 801 . . 55 GLY H . 19462 1
206 . 1 . 1 55 55 GLY HA2 H 1 3.228 0.03 . 2 . . 800 . . 55 GLY HA2 . 19462 1
207 . 1 . 1 55 55 GLY HA3 H 1 5.123 0.03 . 2 . . 799 . . 55 GLY HA3 . 19462 1
208 . 1 . 1 55 55 GLY C C 13 171.622 0.2 . 1 . . 621 . . 55 GLY C . 19462 1
209 . 1 . 1 55 55 GLY CA C 13 44.756 0.2 . 1 . . 622 . . 55 GLY CA . 19462 1
210 . 1 . 1 55 55 GLY N N 15 106.553 0.2 . 1 . . 802 . . 55 GLY N . 19462 1
211 . 1 . 1 56 56 ILE H H 1 8.696 0.03 . 1 . . 616 . . 56 ILE H . 19462 1
212 . 1 . 1 56 56 ILE HA H 1 4.848 0.03 . 1 . . 872 . . 56 ILE HA . 19462 1
213 . 1 . 1 56 56 ILE HB H 1 1.862 0.03 . 1 . . 876 . . 56 ILE HB . 19462 1
214 . 1 . 1 56 56 ILE HG12 H 1 1.933 0.03 . 2 . . 878 . . 56 ILE HG12 . 19462 1
215 . 1 . 1 56 56 ILE HG13 H 1 1.216 0.03 . 2 . . 877 . . 56 ILE HG13 . 19462 1
216 . 1 . 1 56 56 ILE HG21 H 1 0.802 0.03 . 1 . . 879 . . 56 ILE HG21 . 19462 1
217 . 1 . 1 56 56 ILE HG22 H 1 0.802 0.03 . 1 . . 879 . . 56 ILE HG22 . 19462 1
218 . 1 . 1 56 56 ILE HG23 H 1 0.802 0.03 . 1 . . 879 . . 56 ILE HG23 . 19462 1
219 . 1 . 1 56 56 ILE HD11 H 1 0.905 0.03 . 1 . . 880 . . 56 ILE HD11 . 19462 1
220 . 1 . 1 56 56 ILE HD12 H 1 0.905 0.03 . 1 . . 880 . . 56 ILE HD12 . 19462 1
221 . 1 . 1 56 56 ILE HD13 H 1 0.905 0.03 . 1 . . 880 . . 56 ILE HD13 . 19462 1
222 . 1 . 1 56 56 ILE C C 13 174.428 0.2 . 1 . . 618 . . 56 ILE C . 19462 1
223 . 1 . 1 56 56 ILE CA C 13 61.826 0.2 . 1 . . 620 . . 56 ILE CA . 19462 1
224 . 1 . 1 56 56 ILE CB C 13 38.752 0.2 . 1 . . 619 . . 56 ILE CB . 19462 1
225 . 1 . 1 56 56 ILE CG1 C 13 27.498 0.2 . 1 . . 873 . . 56 ILE CG1 . 19462 1
226 . 1 . 1 56 56 ILE CG2 C 13 17.766 0.2 . 1 . . 874 . . 56 ILE CG2 . 19462 1
227 . 1 . 1 56 56 ILE CD1 C 13 14.371 0.2 . 1 . . 875 . . 56 ILE CD1 . 19462 1
228 . 1 . 1 56 56 ILE N N 15 120.131 0.2 . 1 . . 617 . . 56 ILE N . 19462 1
229 . 1 . 1 57 57 PHE H H 1 9.810 0.03 . 1 . . 606 . . 57 PHE H . 19462 1
230 . 1 . 1 57 57 PHE HA H 1 5.398 0.03 . 1 . . 890 . . 57 PHE HA . 19462 1
231 . 1 . 1 57 57 PHE HB2 H 1 3.191 0.03 . 1 . . 772 . . 57 PHE HB2 . 19462 1
232 . 1 . 1 57 57 PHE HB3 H 1 2.545 0.03 . 1 . . 771 . . 57 PHE HB3 . 19462 1
233 . 1 . 1 57 57 PHE C C 13 175.512 0.2 . 1 . . 610 . . 57 PHE C . 19462 1
234 . 1 . 1 57 57 PHE CA C 13 56.104 0.2 . 1 . . 609 . . 57 PHE CA . 19462 1
235 . 1 . 1 57 57 PHE CB C 13 42.539 0.2 . 1 . . 608 . . 57 PHE CB . 19462 1
236 . 1 . 1 57 57 PHE N N 15 127.683 0.2 . 1 . . 607 . . 57 PHE N . 19462 1
237 . 1 . 1 58 58 VAL H H 1 9.240 0.03 . 1 . . 611 . . 58 VAL H . 19462 1
238 . 1 . 1 58 58 VAL HA H 1 4.781 0.03 . 1 . . 774 . . 58 VAL HA . 19462 1
239 . 1 . 1 58 58 VAL HB H 1 2.063 0.03 . 1 . . 775 . . 58 VAL HB . 19462 1
240 . 1 . 1 58 58 VAL HG11 H 1 1.083 0.03 . 2 . . 776 . . 58 VAL HG11 . 19462 1
241 . 1 . 1 58 58 VAL HG12 H 1 1.083 0.03 . 2 . . 776 . . 58 VAL HG12 . 19462 1
242 . 1 . 1 58 58 VAL HG13 H 1 1.083 0.03 . 2 . . 776 . . 58 VAL HG13 . 19462 1
243 . 1 . 1 58 58 VAL HG21 H 1 0.926 0.03 . 2 . . 895 . . 58 VAL HG21 . 19462 1
244 . 1 . 1 58 58 VAL HG22 H 1 0.926 0.03 . 2 . . 895 . . 58 VAL HG22 . 19462 1
245 . 1 . 1 58 58 VAL HG23 H 1 0.926 0.03 . 2 . . 895 . . 58 VAL HG23 . 19462 1
246 . 1 . 1 58 58 VAL C C 13 177.500 0.2 . 1 . . 615 . . 58 VAL C . 19462 1
247 . 1 . 1 58 58 VAL CA C 13 61.805 0.2 . 1 . . 613 . . 58 VAL CA . 19462 1
248 . 1 . 1 58 58 VAL CB C 13 34.206 0.2 . 1 . . 614 . . 58 VAL CB . 19462 1
249 . 1 . 1 58 58 VAL CG1 C 13 22.850 0.2 . 2 . . 894 . . 58 VAL CG1 . 19462 1
250 . 1 . 1 58 58 VAL CG2 C 13 21.775 0.2 . 2 . . 893 . . 58 VAL CG2 . 19462 1
251 . 1 . 1 58 58 VAL N N 15 121.948 0.2 . 1 . . 612 . . 58 VAL N . 19462 1
252 . 1 . 1 59 59 ASN H H 1 9.576 0.03 . 1 . . 601 . . 59 ASN H . 19462 1
253 . 1 . 1 59 59 ASN HA H 1 4.471 0.03 . 1 . . 777 . . 59 ASN HA . 19462 1
254 . 1 . 1 59 59 ASN HB2 H 1 3.285 0.03 . 2 . . 778 . . 59 ASN HB2 . 19462 1
255 . 1 . 1 59 59 ASN HB3 H 1 2.825 0.03 . 2 . . 779 . . 59 ASN HB3 . 19462 1
256 . 1 . 1 59 59 ASN C C 13 175.563 0.2 . 1 . . 603 . . 59 ASN C . 19462 1
257 . 1 . 1 59 59 ASN CA C 13 54.927 0.2 . 1 . . 604 . . 59 ASN CA . 19462 1
258 . 1 . 1 59 59 ASN CB C 13 38.312 0.2 . 1 . . 605 . . 59 ASN CB . 19462 1
259 . 1 . 1 59 59 ASN N N 15 128.863 0.2 . 1 . . 602 . . 59 ASN N . 19462 1
260 . 1 . 1 60 60 GLY H H 1 9.263 0.03 . 1 . . 597 . . 60 GLY H . 19462 1
261 . 1 . 1 60 60 GLY HA2 H 1 3.950 0.03 . 1 . . 925 . . 60 GLY HA2 . 19462 1
262 . 1 . 1 60 60 GLY HA3 H 1 3.683 0.03 . 1 . . 926 . . 60 GLY HA3 . 19462 1
263 . 1 . 1 60 60 GLY C C 13 173.801 0.2 . 1 . . 599 . . 60 GLY C . 19462 1
264 . 1 . 1 60 60 GLY CA C 13 45.833 0.2 . 1 . . 600 . . 60 GLY CA . 19462 1
265 . 1 . 1 60 60 GLY N N 15 103.209 0.2 . 1 . . 598 . . 60 GLY N . 19462 1
266 . 1 . 1 61 61 GLU H H 1 8.041 0.03 . 1 . . 592 . . 61 GLU H . 19462 1
267 . 1 . 1 61 61 GLU HA H 1 4.186 0.03 . 1 . . 780 . . 61 GLU HA . 19462 1
268 . 1 . 1 61 61 GLU HB2 H 1 2.017 0.03 . 1 . . 954 . . 61 GLU HB2 . 19462 1
269 . 1 . 1 61 61 GLU HB3 H 1 2.115 0.03 . 1 . . 955 . . 61 GLU HB3 . 19462 1
270 . 1 . 1 61 61 GLU C C 13 180.393 0.2 . 1 . . 594 . . 61 GLU C . 19462 1
271 . 1 . 1 61 61 GLU CA C 13 54.812 0.2 . 1 . . 595 . . 61 GLU CA . 19462 1
272 . 1 . 1 61 61 GLU CB C 13 32.573 0.2 . 1 . . 596 . . 61 GLU CB . 19462 1
273 . 1 . 1 61 61 GLU CG C 13 36.335 0.2 . 1 . . 956 . . 61 GLU CG . 19462 1
274 . 1 . 1 61 61 GLU N N 15 121.669 0.2 . 1 . . 593 . . 61 GLU N . 19462 1
275 . 1 . 1 62 62 LYS H H 1 8.930 0.03 . 1 . . 587 . . 62 LYS H . 19462 1
276 . 1 . 1 62 62 LYS HA H 1 3.644 0.03 . 1 . . 758 . . 62 LYS HA . 19462 1
277 . 1 . 1 62 62 LYS HB3 H 1 1.724 0.03 . 1 . . 757 . . 62 LYS HB3 . 19462 1
278 . 1 . 1 62 62 LYS C C 13 176.844 0.2 . 1 . . 589 . . 62 LYS C . 19462 1
279 . 1 . 1 62 62 LYS CA C 13 57.865 0.2 . 1 . . 590 . . 62 LYS CA . 19462 1
280 . 1 . 1 62 62 LYS CB C 13 31.805 0.2 . 1 . . 591 . . 62 LYS CB . 19462 1
281 . 1 . 1 62 62 LYS N N 15 127.591 0.2 . 1 . . 588 . . 62 LYS N . 19462 1
282 . 1 . 1 63 63 VAL HA H 1 4.523 0.03 . 1 . . 896 . . 63 VAL HA . 19462 1
283 . 1 . 1 63 63 VAL HB H 1 2.244 0.03 . 1 . . 899 . . 63 VAL HB . 19462 1
284 . 1 . 1 63 63 VAL HG11 H 1 0.879 0.03 . 2 . . 901 . . 63 VAL HG11 . 19462 1
285 . 1 . 1 63 63 VAL HG12 H 1 0.879 0.03 . 2 . . 901 . . 63 VAL HG12 . 19462 1
286 . 1 . 1 63 63 VAL HG13 H 1 0.879 0.03 . 2 . . 901 . . 63 VAL HG13 . 19462 1
287 . 1 . 1 63 63 VAL HG21 H 1 1.003 0.03 . 2 . . 900 . . 63 VAL HG21 . 19462 1
288 . 1 . 1 63 63 VAL HG22 H 1 1.003 0.03 . 2 . . 900 . . 63 VAL HG22 . 19462 1
289 . 1 . 1 63 63 VAL HG23 H 1 1.003 0.03 . 2 . . 900 . . 63 VAL HG23 . 19462 1
290 . 1 . 1 63 63 VAL C C 13 175.272 0.2 . 1 . . 584 . . 63 VAL C . 19462 1
291 . 1 . 1 63 63 VAL CA C 13 62.215 0.2 . 1 . . 585 . . 63 VAL CA . 19462 1
292 . 1 . 1 63 63 VAL CB C 13 33.862 0.2 . 1 . . 586 . . 63 VAL CB . 19462 1
293 . 1 . 1 63 63 VAL CG1 C 13 21.840 0.2 . 2 . . 898 . . 63 VAL CG1 . 19462 1
294 . 1 . 1 63 63 VAL CG2 C 13 20.293 0.2 . 2 . . 897 . . 63 VAL CG2 . 19462 1
295 . 1 . 1 64 64 TYR H H 1 7.405 0.03 . 1 . . 579 . . 64 TYR H . 19462 1
296 . 1 . 1 64 64 TYR HA H 1 4.739 0.03 . 1 . . 768 . . 64 TYR HA . 19462 1
297 . 1 . 1 64 64 TYR HB2 H 1 2.181 0.03 . 2 . . 766 . . 64 TYR HB2 . 19462 1
298 . 1 . 1 64 64 TYR HB3 H 1 3.448 0.03 . 2 . . 767 . . 64 TYR HB3 . 19462 1
299 . 1 . 1 64 64 TYR C C 13 172.730 0.2 . 1 . . 581 . . 64 TYR C . 19462 1
300 . 1 . 1 64 64 TYR CA C 13 59.038 0.2 . 1 . . 582 . . 64 TYR CA . 19462 1
301 . 1 . 1 64 64 TYR CB C 13 42.247 0.2 . 1 . . 583 . . 64 TYR CB . 19462 1
302 . 1 . 1 64 64 TYR N N 15 119.372 0.2 . 1 . . 580 . . 64 TYR N . 19462 1
303 . 1 . 1 65 65 THR H H 1 6.845 0.03 . 1 . . 1000 . . 65 THR H . 19462 1
304 . 1 . 1 65 65 THR HA H 1 5.282 0.03 . 1 . . 781 . . 65 THR HA . 19462 1
305 . 1 . 1 65 65 THR HB H 1 3.738 0.03 . 1 . . 909 . . 65 THR HB . 19462 1
306 . 1 . 1 65 65 THR HG21 H 1 0.989 0.03 . 1 . . 782 . . 65 THR HG21 . 19462 1
307 . 1 . 1 65 65 THR HG22 H 1 0.989 0.03 . 1 . . 782 . . 65 THR HG22 . 19462 1
308 . 1 . 1 65 65 THR HG23 H 1 0.989 0.03 . 1 . . 782 . . 65 THR HG23 . 19462 1
309 . 1 . 1 65 65 THR C C 13 171.364 0.2 . 1 . . 467 . . 65 THR C . 19462 1
310 . 1 . 1 65 65 THR CA C 13 60.410 0.2 . 1 . . 468 . . 65 THR CA . 19462 1
311 . 1 . 1 65 65 THR CB C 13 72.038 0.2 . 1 . . 466 . . 65 THR CB . 19462 1
312 . 1 . 1 65 65 THR CG2 C 13 21.119 0.2 . 1 . . 908 . . 65 THR CG2 . 19462 1
313 . 1 . 1 65 65 THR N N 15 120.516 0.2 . 1 . . 1001 . . 65 THR N . 19462 1
314 . 1 . 1 68 68 GLU C C 13 176.403 0.2 . 1 . . 576 . . 68 GLU C . 19462 1
315 . 1 . 1 69 69 LYS H H 1 9.015 0.03 . 1 . . 573 . . 69 LYS H . 19462 1
316 . 1 . 1 69 69 LYS HA H 1 4.463 0.03 . 1 . . 783 . . 69 LYS HA . 19462 1
317 . 1 . 1 69 69 LYS C C 13 179.839 0.2 . 1 . . 575 . . 69 LYS C . 19462 1
318 . 1 . 1 69 69 LYS CA C 13 57.864 0.2 . 1 . . 577 . . 69 LYS CA . 19462 1
319 . 1 . 1 69 69 LYS CB C 13 33.101 0.2 . 1 . . 578 . . 69 LYS CB . 19462 1
320 . 1 . 1 69 69 LYS N N 15 114.908 0.2 . 1 . . 574 . . 69 LYS N . 19462 1
321 . 1 . 1 70 70 SER H H 1 8.082 0.03 . 1 . . 569 . . 70 SER H . 19462 1
322 . 1 . 1 70 70 SER HA H 1 4.450 0.03 . 1 . . 907 . . 70 SER HA . 19462 1
323 . 1 . 1 70 70 SER HB2 H 1 4.099 0.03 . 1 . . 732 . . 70 SER HB2 . 19462 1
324 . 1 . 1 70 70 SER HB3 H 1 4.276 0.03 . 1 . . 733 . . 70 SER HB3 . 19462 1
325 . 1 . 1 70 70 SER CA C 13 59.809 0.2 . 1 . . 571 . . 70 SER CA . 19462 1
326 . 1 . 1 70 70 SER CB C 13 63.643 0.2 . 1 . . 572 . . 70 SER CB . 19462 1
327 . 1 . 1 70 70 SER N N 15 117.708 0.2 . 1 . . 570 . . 70 SER N . 19462 1
328 . 1 . 1 74 74 ASN HD21 H 1 7.557 0.03 . 1 . . 982 . . 74 ASN HD21 . 19462 1
329 . 1 . 1 74 74 ASN HD22 H 1 6.916 0.03 . 1 . . 980 . . 74 ASN HD22 . 19462 1
330 . 1 . 1 74 74 ASN ND2 N 15 112.464 0.2 . 1 . . 981 . . 74 ASN ND2 . 19462 1
331 . 1 . 1 75 75 ILE H H 1 7.782 0.03 . 1 . . 562 . . 75 ILE H . 19462 1
332 . 1 . 1 75 75 ILE HA H 1 3.763 0.03 . 1 . . 866 . . 75 ILE HA . 19462 1
333 . 1 . 1 75 75 ILE HB H 1 1.409 0.03 . 1 . . 867 . . 75 ILE HB . 19462 1
334 . 1 . 1 75 75 ILE HG12 H 1 1.737 0.03 . 2 . . 868 . . 75 ILE HG12 . 19462 1
335 . 1 . 1 75 75 ILE HG13 H 1 0.986 0.03 . 2 . . 869 . . 75 ILE HG13 . 19462 1
336 . 1 . 1 75 75 ILE HG21 H 1 0.242 0.03 . 1 . . 870 . . 75 ILE HG21 . 19462 1
337 . 1 . 1 75 75 ILE HG22 H 1 0.242 0.03 . 1 . . 870 . . 75 ILE HG22 . 19462 1
338 . 1 . 1 75 75 ILE HG23 H 1 0.242 0.03 . 1 . . 870 . . 75 ILE HG23 . 19462 1
339 . 1 . 1 75 75 ILE HD11 H 1 0.795 0.03 . 1 . . 871 . . 75 ILE HD11 . 19462 1
340 . 1 . 1 75 75 ILE HD12 H 1 0.795 0.03 . 1 . . 871 . . 75 ILE HD12 . 19462 1
341 . 1 . 1 75 75 ILE HD13 H 1 0.795 0.03 . 1 . . 871 . . 75 ILE HD13 . 19462 1
342 . 1 . 1 75 75 ILE C C 13 177.889 0.2 . 1 . . 564 . . 75 ILE C . 19462 1
343 . 1 . 1 75 75 ILE CA C 13 65.462 0.2 . 1 . . 565 . . 75 ILE CA . 19462 1
344 . 1 . 1 75 75 ILE CB C 13 39.482 0.2 . 1 . . 862 . . 75 ILE CB . 19462 1
345 . 1 . 1 75 75 ILE CG1 C 13 28.493 0.2 . 1 . . 864 . . 75 ILE CG1 . 19462 1
346 . 1 . 1 75 75 ILE CG2 C 13 18.837 0.2 . 1 . . 865 . . 75 ILE CG2 . 19462 1
347 . 1 . 1 75 75 ILE CD1 C 13 15.027 0.2 . 1 . . 863 . . 75 ILE CD1 . 19462 1
348 . 1 . 1 75 75 ILE N N 15 120.468 0.2 . 1 . . 563 . . 75 ILE N . 19462 1
349 . 1 . 1 77 77 ASN H H 1 7.439 0.03 . 1 . . 685 . . 77 ASN H . 19462 1
350 . 1 . 1 77 77 ASN HA H 1 4.410 0.03 . 1 . . 765 . . 77 ASN HA . 19462 1
351 . 1 . 1 77 77 ASN HB2 H 1 2.918 0.03 . 2 . . 919 . . 77 ASN HB2 . 19462 1
352 . 1 . 1 77 77 ASN HB3 H 1 2.844 0.03 . 2 . . 918 . . 77 ASN HB3 . 19462 1
353 . 1 . 1 77 77 ASN HD21 H 1 6.835 0.03 . 1 . . 966 . . 77 ASN HD21 . 19462 1
354 . 1 . 1 77 77 ASN HD22 H 1 7.793 0.03 . 1 . . 968 . . 77 ASN HD22 . 19462 1
355 . 1 . 1 77 77 ASN C C 13 177.630 0.2 . 1 . . 566 . . 77 ASN C . 19462 1
356 . 1 . 1 77 77 ASN CA C 13 57.520 0.2 . 1 . . 568 . . 77 ASN CA . 19462 1
357 . 1 . 1 77 77 ASN CB C 13 38.992 0.2 . 1 . . 567 . . 77 ASN CB . 19462 1
358 . 1 . 1 77 77 ASN N N 15 119.090 0.2 . 1 . . 686 . . 77 ASN N . 19462 1
359 . 1 . 1 77 77 ASN ND2 N 15 112.846 0.2 . 1 . . 967 . . 77 ASN ND2 . 19462 1
360 . 1 . 1 78 78 ASP H H 1 8.019 0.03 . 1 . . 557 . . 78 ASP H . 19462 1
361 . 1 . 1 78 78 ASP HA H 1 4.189 0.03 . 1 . . 739 . . 78 ASP HA . 19462 1
362 . 1 . 1 78 78 ASP HB2 H 1 3.142 0.03 . 1 . . 738 . . 78 ASP HB2 . 19462 1
363 . 1 . 1 78 78 ASP HB3 H 1 2.233 0.03 . 1 . . 922 . . 78 ASP HB3 . 19462 1
364 . 1 . 1 78 78 ASP C C 13 178.745 0.2 . 1 . . 559 . . 78 ASP C . 19462 1
365 . 1 . 1 78 78 ASP CA C 13 57.022 0.2 . 1 . . 560 . . 78 ASP CA . 19462 1
366 . 1 . 1 78 78 ASP CB C 13 39.662 0.2 . 1 . . 561 . . 78 ASP CB . 19462 1
367 . 1 . 1 78 78 ASP N N 15 119.940 0.2 . 1 . . 558 . . 78 ASP N . 19462 1
368 . 1 . 1 79 79 ILE H H 1 8.010 0.03 . 1 . . 552 . . 79 ILE H . 19462 1
369 . 1 . 1 79 79 ILE HA H 1 3.016 0.03 . 1 . . 764 . . 79 ILE HA . 19462 1
370 . 1 . 1 79 79 ILE HB H 1 1.403 0.03 . 1 . . 857 . . 79 ILE HB . 19462 1
371 . 1 . 1 79 79 ILE HG12 H 1 0.251 0.03 . 2 . . 859 . . 79 ILE HG12 . 19462 1
372 . 1 . 1 79 79 ILE HG13 H 1 1.534 0.03 . 2 . . 858 . . 79 ILE HG13 . 19462 1
373 . 1 . 1 79 79 ILE HG21 H 1 0.508 0.03 . 1 . . 860 . . 79 ILE HG21 . 19462 1
374 . 1 . 1 79 79 ILE HG22 H 1 0.508 0.03 . 1 . . 860 . . 79 ILE HG22 . 19462 1
375 . 1 . 1 79 79 ILE HG23 H 1 0.508 0.03 . 1 . . 860 . . 79 ILE HG23 . 19462 1
376 . 1 . 1 79 79 ILE HD11 H 1 0.375 0.03 . 1 . . 861 . . 79 ILE HD11 . 19462 1
377 . 1 . 1 79 79 ILE HD12 H 1 0.375 0.03 . 1 . . 861 . . 79 ILE HD12 . 19462 1
378 . 1 . 1 79 79 ILE HD13 H 1 0.375 0.03 . 1 . . 861 . . 79 ILE HD13 . 19462 1
379 . 1 . 1 79 79 ILE C C 13 178.994 0.2 . 1 . . 554 . . 79 ILE C . 19462 1
380 . 1 . 1 79 79 ILE CA C 13 66.341 0.2 . 1 . . 555 . . 79 ILE CA . 19462 1
381 . 1 . 1 79 79 ILE CB C 13 38.440 0.2 . 1 . . 556 . . 79 ILE CB . 19462 1
382 . 1 . 1 79 79 ILE CG1 C 13 30.919 0.2 . 1 . . 854 . . 79 ILE CG1 . 19462 1
383 . 1 . 1 79 79 ILE CG2 C 13 17.176 0.2 . 1 . . 855 . . 79 ILE CG2 . 19462 1
384 . 1 . 1 79 79 ILE CD1 C 13 15.441 0.2 . 1 . . 856 . . 79 ILE CD1 . 19462 1
385 . 1 . 1 79 79 ILE N N 15 118.512 0.2 . 1 . . 553 . . 79 ILE N . 19462 1
386 . 1 . 1 80 80 ASN H H 1 8.118 0.03 . 1 . . 545 . . 80 ASN H . 19462 1
387 . 1 . 1 80 80 ASN HA H 1 4.641 0.03 . 1 . . 734 . . 80 ASN HA . 19462 1
388 . 1 . 1 80 80 ASN HB2 H 1 2.818 0.03 . 2 . . 735 . . 80 ASN HB2 . 19462 1
389 . 1 . 1 80 80 ASN HB3 H 1 3.054 0.03 . 2 . . 920 . . 80 ASN HB3 . 19462 1
390 . 1 . 1 80 80 ASN HD21 H 1 7.227 0.03 . 1 . . 977 . . 80 ASN HD21 . 19462 1
391 . 1 . 1 80 80 ASN HD22 H 1 7.788 0.03 . 1 . . 979 . . 80 ASN HD22 . 19462 1
392 . 1 . 1 80 80 ASN C C 13 178.201 0.2 . 1 . . 547 . . 80 ASN C . 19462 1
393 . 1 . 1 80 80 ASN CA C 13 56.542 0.2 . 1 . . 548 . . 80 ASN CA . 19462 1
394 . 1 . 1 80 80 ASN CB C 13 38.225 0.2 . 1 . . 549 . . 80 ASN CB . 19462 1
395 . 1 . 1 80 80 ASN N N 15 118.156 0.2 . 1 . . 546 . . 80 ASN N . 19462 1
396 . 1 . 1 80 80 ASN ND2 N 15 113.079 0.2 . 1 . . 978 . . 80 ASN ND2 . 19462 1
397 . 1 . 1 81 81 LYS H H 1 7.955 0.03 . 1 . . 550 . . 81 LYS H . 19462 1
398 . 1 . 1 81 81 LYS HA H 1 4.190 0.03 . 1 . . 736 . . 81 LYS HA . 19462 1
399 . 1 . 1 81 81 LYS HB2 H 1 1.918 0.03 . 2 . . 737 . . 81 LYS HB2 . 19462 1
400 . 1 . 1 81 81 LYS HB3 H 1 1.851 0.03 . 2 . . 959 . . 81 LYS HB3 . 19462 1
401 . 1 . 1 81 81 LYS HG2 H 1 1.532 0.03 . 2 . . 961 . . 81 LYS HG2 . 19462 1
402 . 1 . 1 81 81 LYS HG3 H 1 1.459 0.03 . 2 . . 960 . . 81 LYS HG3 . 19462 1
403 . 1 . 1 81 81 LYS HD3 H 1 1.707 0.03 . 1 . . 962 . . 81 LYS HD3 . 19462 1
404 . 1 . 1 81 81 LYS C C 13 177.899 0.2 . 1 . . 544 . . 81 LYS C . 19462 1
405 . 1 . 1 81 81 LYS CA C 13 58.549 0.2 . 1 . . 543 . . 81 LYS CA . 19462 1
406 . 1 . 1 81 81 LYS CB C 13 33.087 0.2 . 1 . . 542 . . 81 LYS CB . 19462 1
407 . 1 . 1 81 81 LYS CG C 13 25.359 0.2 . 1 . . 958 . . 81 LYS CG . 19462 1
408 . 1 . 1 81 81 LYS CD C 13 29.397 0.2 . 1 . . 834 . . 81 LYS CD . 19462 1
409 . 1 . 1 81 81 LYS CE C 13 41.978 0.2 . 1 . . 957 . . 81 LYS CE . 19462 1
410 . 1 . 1 81 81 LYS N N 15 120.023 0.2 . 1 . . 551 . . 81 LYS N . 19462 1
411 . 1 . 1 82 82 LEU H H 1 7.358 0.03 . 1 . . 537 . . 82 LEU H . 19462 1
412 . 1 . 1 82 82 LEU HA H 1 4.108 0.03 . 1 . . 791 . . 82 LEU HA . 19462 1
413 . 1 . 1 82 82 LEU HB2 H 1 1.361 0.03 . 1 . . 793 . . 82 LEU HB2 . 19462 1
414 . 1 . 1 82 82 LEU HB3 H 1 1.735 0.03 . 1 . . 792 . . 82 LEU HB3 . 19462 1
415 . 1 . 1 82 82 LEU HG H 1 0.622 0.03 . 1 . . 946 . . 82 LEU HG . 19462 1
416 . 1 . 1 82 82 LEU HD21 H 1 0.856 0.03 . 1 . . 947 . . 82 LEU HD21 . 19462 1
417 . 1 . 1 82 82 LEU HD22 H 1 0.856 0.03 . 1 . . 947 . . 82 LEU HD22 . 19462 1
418 . 1 . 1 82 82 LEU HD23 H 1 0.856 0.03 . 1 . . 947 . . 82 LEU HD23 . 19462 1
419 . 1 . 1 82 82 LEU C C 13 177.138 0.2 . 1 . . 539 . . 82 LEU C . 19462 1
420 . 1 . 1 82 82 LEU CA C 13 56.650 0.2 . 1 . . 540 . . 82 LEU CA . 19462 1
421 . 1 . 1 82 82 LEU CB C 13 43.832 0.2 . 1 . . 541 . . 82 LEU CB . 19462 1
422 . 1 . 1 82 82 LEU CG C 13 26.699 0.2 . 1 . . 944 . . 82 LEU CG . 19462 1
423 . 1 . 1 82 82 LEU CD2 C 13 23.354 0.2 . 1 . . 945 . . 82 LEU CD2 . 19462 1
424 . 1 . 1 82 82 LEU N N 15 118.573 0.2 . 1 . . 538 . . 82 LEU N . 19462 1
425 . 1 . 1 83 83 ASN H H 1 7.516 0.03 . 1 . . 532 . . 83 ASN H . 19462 1
426 . 1 . 1 83 83 ASN HA H 1 4.387 0.03 . 1 . . 788 . . 83 ASN HA . 19462 1
427 . 1 . 1 83 83 ASN HB2 H 1 3.013 0.03 . 1 . . 789 . . 83 ASN HB2 . 19462 1
428 . 1 . 1 83 83 ASN HB3 H 1 2.640 0.03 . 1 . . 790 . . 83 ASN HB3 . 19462 1
429 . 1 . 1 83 83 ASN HD21 H 1 6.618 0.03 . 1 . . 988 . . 83 ASN HD21 . 19462 1
430 . 1 . 1 83 83 ASN HD22 H 1 7.367 0.03 . 1 . . 986 . . 83 ASN HD22 . 19462 1
431 . 1 . 1 83 83 ASN C C 13 174.080 0.2 . 1 . . 534 . . 83 ASN C . 19462 1
432 . 1 . 1 83 83 ASN CA C 13 54.313 0.2 . 1 . . 535 . . 83 ASN CA . 19462 1
433 . 1 . 1 83 83 ASN CB C 13 37.642 0.2 . 1 . . 536 . . 83 ASN CB . 19462 1
434 . 1 . 1 83 83 ASN N N 15 116.466 0.2 . 1 . . 533 . . 83 ASN N . 19462 1
435 . 1 . 1 83 83 ASN ND2 N 15 110.825 0.2 . 1 . . 987 . . 83 ASN ND2 . 19462 1
436 . 1 . 1 84 84 ILE H H 1 9.177 0.03 . 1 . . 527 . . 84 ILE H . 19462 1
437 . 1 . 1 84 84 ILE HA H 1 3.654 0.03 . 1 . . 846 . . 84 ILE HA . 19462 1
438 . 1 . 1 84 84 ILE HB H 1 1.761 0.03 . 1 . . 850 . . 84 ILE HB . 19462 1
439 . 1 . 1 84 84 ILE HG12 H 1 0.985 0.03 . 2 . . 787 . . 84 ILE HG12 . 19462 1
440 . 1 . 1 84 84 ILE HG13 H 1 1.593 0.03 . 2 . . 851 . . 84 ILE HG13 . 19462 1
441 . 1 . 1 84 84 ILE HG21 H 1 0.725 0.03 . 1 . . 852 . . 84 ILE HG21 . 19462 1
442 . 1 . 1 84 84 ILE HG22 H 1 0.725 0.03 . 1 . . 852 . . 84 ILE HG22 . 19462 1
443 . 1 . 1 84 84 ILE HG23 H 1 0.725 0.03 . 1 . . 852 . . 84 ILE HG23 . 19462 1
444 . 1 . 1 84 84 ILE HD11 H 1 0.756 0.03 . 1 . . 853 . . 84 ILE HD11 . 19462 1
445 . 1 . 1 84 84 ILE HD12 H 1 0.756 0.03 . 1 . . 853 . . 84 ILE HD12 . 19462 1
446 . 1 . 1 84 84 ILE HD13 H 1 0.756 0.03 . 1 . . 853 . . 84 ILE HD13 . 19462 1
447 . 1 . 1 84 84 ILE C C 13 175.313 0.2 . 1 . . 529 . . 84 ILE C . 19462 1
448 . 1 . 1 84 84 ILE CA C 13 63.199 0.2 . 1 . . 530 . . 84 ILE CA . 19462 1
449 . 1 . 1 84 84 ILE CB C 13 38.786 0.2 . 1 . . 531 . . 84 ILE CB . 19462 1
450 . 1 . 1 84 84 ILE CG1 C 13 28.798 0.2 . 1 . . 847 . . 84 ILE CG1 . 19462 1
451 . 1 . 1 84 84 ILE CG2 C 13 19.007 0.2 . 1 . . 848 . . 84 ILE CG2 . 19462 1
452 . 1 . 1 84 84 ILE CD1 C 13 14.971 0.2 . 1 . . 849 . . 84 ILE CD1 . 19462 1
453 . 1 . 1 84 84 ILE N N 15 121.076 0.2 . 1 . . 528 . . 84 ILE N . 19462 1
454 . 1 . 1 85 85 LYS H H 1 8.217 0.03 . 1 . . 522 . . 85 LYS H . 19462 1
455 . 1 . 1 85 85 LYS HA H 1 5.272 0.03 . 1 . . 785 . . 85 LYS HA . 19462 1
456 . 1 . 1 85 85 LYS HB2 H 1 1.741 0.03 . 2 . . 786 . . 85 LYS HB2 . 19462 1
457 . 1 . 1 85 85 LYS HB3 H 1 1.899 0.03 . 2 . . 831 . . 85 LYS HB3 . 19462 1
458 . 1 . 1 85 85 LYS HG2 H 1 1.463 0.03 . 2 . . 833 . . 85 LYS HG2 . 19462 1
459 . 1 . 1 85 85 LYS HG3 H 1 1.407 0.03 . 2 . . 832 . . 85 LYS HG3 . 19462 1
460 . 1 . 1 85 85 LYS C C 13 177.432 0.2 . 1 . . 524 . . 85 LYS C . 19462 1
461 . 1 . 1 85 85 LYS CA C 13 54.803 0.2 . 1 . . 526 . . 85 LYS CA . 19462 1
462 . 1 . 1 85 85 LYS CB C 13 35.465 0.2 . 1 . . 525 . . 85 LYS CB . 19462 1
463 . 1 . 1 85 85 LYS CG C 13 25.150 0.2 . 1 . . 828 . . 85 LYS CG . 19462 1
464 . 1 . 1 85 85 LYS CD C 13 29.262 0.2 . 1 . . 829 . . 85 LYS CD . 19462 1
465 . 1 . 1 85 85 LYS CE C 13 42.414 0.2 . 1 . . 830 . . 85 LYS CE . 19462 1
466 . 1 . 1 85 85 LYS N N 15 126.519 0.2 . 1 . . 523 . . 85 LYS N . 19462 1
467 . 1 . 1 86 86 GLY H H 1 8.226 0.03 . 1 . . 491 . . 86 GLY H . 19462 1
468 . 1 . 1 86 86 GLY HA2 H 1 3.648 0.03 . 2 . . 784 . . 86 GLY HA2 . 19462 1
469 . 1 . 1 86 86 GLY HA3 H 1 4.306 0.03 . 2 . . 927 . . 86 GLY HA3 . 19462 1
470 . 1 . 1 86 86 GLY C C 13 172.802 0.2 . 1 . . 494 . . 86 GLY C . 19462 1
471 . 1 . 1 86 86 GLY CA C 13 44.440 0.2 . 1 . . 493 . . 86 GLY CA . 19462 1
472 . 1 . 1 86 86 GLY N N 15 107.226 0.2 . 1 . . 492 . . 86 GLY N . 19462 1
473 . 1 . 1 87 87 PRO HA H 1 4.667 0.03 . 1 . . 808 . . 87 PRO HA . 19462 1
474 . 1 . 1 87 87 PRO HB2 H 1 1.701 0.03 . 2 . . 813 . . 87 PRO HB2 . 19462 1
475 . 1 . 1 87 87 PRO HB3 H 1 1.826 0.03 . 2 . . 812 . . 87 PRO HB3 . 19462 1
476 . 1 . 1 87 87 PRO HG2 H 1 1.589 0.03 . 2 . . 814 . . 87 PRO HG2 . 19462 1
477 . 1 . 1 87 87 PRO HG3 H 1 0.816 0.03 . 2 . . 815 . . 87 PRO HG3 . 19462 1
478 . 1 . 1 87 87 PRO HD2 H 1 3.255 0.03 . 2 . . 817 . . 87 PRO HD2 . 19462 1
479 . 1 . 1 87 87 PRO HD3 H 1 3.412 0.03 . 2 . . 816 . . 87 PRO HD3 . 19462 1
480 . 1 . 1 87 87 PRO C C 13 175.104 0.2 . 1 . . 516 . . 87 PRO C . 19462 1
481 . 1 . 1 87 87 PRO CA C 13 64.154 0.2 . 1 . . 518 . . 87 PRO CA . 19462 1
482 . 1 . 1 87 87 PRO CB C 13 34.036 0.2 . 1 . . 521 . . 87 PRO CB . 19462 1
483 . 1 . 1 87 87 PRO CG C 13 24.096 0.2 . 1 . . 811 . . 87 PRO CG . 19462 1
484 . 1 . 1 87 87 PRO CD C 13 50.026 0.2 . 1 . . 809 . . 87 PRO CD . 19462 1
485 . 1 . 1 88 88 TYR H H 1 8.480 0.03 . 1 . . 513 . . 88 TYR H . 19462 1
486 . 1 . 1 88 88 TYR HA H 1 4.670 0.03 . 1 . . 902 . . 88 TYR HA . 19462 1
487 . 1 . 1 88 88 TYR HB2 H 1 3.345 0.03 . 2 . . 904 . . 88 TYR HB2 . 19462 1
488 . 1 . 1 88 88 TYR HB3 H 1 3.141 0.03 . 2 . . 903 . . 88 TYR HB3 . 19462 1
489 . 1 . 1 88 88 TYR C C 13 176.041 0.2 . 1 . . 515 . . 88 TYR C . 19462 1
490 . 1 . 1 88 88 TYR CA C 13 57.984 0.2 . 1 . . 519 . . 88 TYR CA . 19462 1
491 . 1 . 1 88 88 TYR CB C 13 36.371 0.2 . 1 . . 520 . . 88 TYR CB . 19462 1
492 . 1 . 1 88 88 TYR N N 15 118.100 0.2 . 1 . . 514 . . 88 TYR N . 19462 1
493 . 1 . 1 89 89 ILE H H 1 8.729 0.03 . 1 . . 507 . . 89 ILE H . 19462 1
494 . 1 . 1 89 89 ILE HA H 1 5.097 0.03 . 1 . . 718 . . 89 ILE HA . 19462 1
495 . 1 . 1 89 89 ILE HB H 1 1.731 0.03 . 1 . . 719 . . 89 ILE HB . 19462 1
496 . 1 . 1 89 89 ILE HG13 H 1 0.813 0.03 . 1 . . 720 . . 89 ILE HG13 . 19462 1
497 . 1 . 1 89 89 ILE HG21 H 1 0.810 0.03 . 1 . . 844 . . 89 ILE HG21 . 19462 1
498 . 1 . 1 89 89 ILE HG22 H 1 0.810 0.03 . 1 . . 844 . . 89 ILE HG22 . 19462 1
499 . 1 . 1 89 89 ILE HG23 H 1 0.810 0.03 . 1 . . 844 . . 89 ILE HG23 . 19462 1
500 . 1 . 1 89 89 ILE HD11 H 1 0.861 0.03 . 1 . . 845 . . 89 ILE HD11 . 19462 1
501 . 1 . 1 89 89 ILE HD12 H 1 0.861 0.03 . 1 . . 845 . . 89 ILE HD12 . 19462 1
502 . 1 . 1 89 89 ILE HD13 H 1 0.861 0.03 . 1 . . 845 . . 89 ILE HD13 . 19462 1
503 . 1 . 1 89 89 ILE C C 13 176.726 0.2 . 1 . . 511 . . 89 ILE C . 19462 1
504 . 1 . 1 89 89 ILE CA C 13 61.436 0.2 . 1 . . 510 . . 89 ILE CA . 19462 1
505 . 1 . 1 89 89 ILE CB C 13 40.047 0.2 . 1 . . 509 . . 89 ILE CB . 19462 1
506 . 1 . 1 89 89 ILE CG1 C 13 29.102 0.2 . 1 . . 841 . . 89 ILE CG1 . 19462 1
507 . 1 . 1 89 89 ILE CG2 C 13 18.639 0.2 . 1 . . 842 . . 89 ILE CG2 . 19462 1
508 . 1 . 1 89 89 ILE CD1 C 13 16.037 0.2 . 1 . . 843 . . 89 ILE CD1 . 19462 1
509 . 1 . 1 89 89 ILE N N 15 122.502 0.2 . 1 . . 508 . . 89 ILE N . 19462 1
510 . 1 . 1 90 90 GLU H H 1 9.486 0.03 . 1 . . 502 . . 90 GLU H . 19462 1
511 . 1 . 1 90 90 GLU HA H 1 4.739 0.03 . 1 . . 717 . . 90 GLU HA . 19462 1
512 . 1 . 1 90 90 GLU HB2 H 1 1.904 0.03 . 2 . . 950 . . 90 GLU HB2 . 19462 1
513 . 1 . 1 90 90 GLU HB3 H 1 2.078 0.03 . 2 . . 716 . . 90 GLU HB3 . 19462 1
514 . 1 . 1 90 90 GLU HG2 H 1 2.086 0.03 . 2 . . 952 . . 90 GLU HG2 . 19462 1
515 . 1 . 1 90 90 GLU HG3 H 1 2.211 0.03 . 2 . . 951 . . 90 GLU HG3 . 19462 1
516 . 1 . 1 90 90 GLU C C 13 174.469 0.2 . 1 . . 503 . . 90 GLU C . 19462 1
517 . 1 . 1 90 90 GLU CA C 13 55.687 0.2 . 1 . . 504 . . 90 GLU CA . 19462 1
518 . 1 . 1 90 90 GLU CB C 13 34.974 0.2 . 1 . . 505 . . 90 GLU CB . 19462 1
519 . 1 . 1 90 90 GLU CG C 13 37.511 0.2 . 1 . . 949 . . 90 GLU CG . 19462 1
520 . 1 . 1 90 90 GLU N N 15 128.161 0.2 . 1 . . 501 . . 90 GLU N . 19462 1
521 . 1 . 1 91 91 ILE H H 1 8.766 0.03 . 1 . . 495 . . 91 ILE H . 19462 1
522 . 1 . 1 91 91 ILE HA H 1 5.563 0.03 . 1 . . 712 . . 91 ILE HA . 19462 1
523 . 1 . 1 91 91 ILE HB H 1 2.003 0.03 . 1 . . 713 . . 91 ILE HB . 19462 1
524 . 1 . 1 91 91 ILE HG12 H 1 1.633 0.03 . 2 . . 838 . . 91 ILE HG12 . 19462 1
525 . 1 . 1 91 91 ILE HG13 H 1 1.173 0.03 . 2 . . 714 . . 91 ILE HG13 . 19462 1
526 . 1 . 1 91 91 ILE HG21 H 1 1.106 0.03 . 1 . . 839 . . 91 ILE HG21 . 19462 1
527 . 1 . 1 91 91 ILE HG22 H 1 1.106 0.03 . 1 . . 839 . . 91 ILE HG22 . 19462 1
528 . 1 . 1 91 91 ILE HG23 H 1 1.106 0.03 . 1 . . 839 . . 91 ILE HG23 . 19462 1
529 . 1 . 1 91 91 ILE HD11 H 1 0.861 0.03 . 1 . . 840 . . 91 ILE HD11 . 19462 1
530 . 1 . 1 91 91 ILE HD12 H 1 0.861 0.03 . 1 . . 840 . . 91 ILE HD12 . 19462 1
531 . 1 . 1 91 91 ILE HD13 H 1 0.861 0.03 . 1 . . 840 . . 91 ILE HD13 . 19462 1
532 . 1 . 1 91 91 ILE C C 13 174.872 0.2 . 1 . . 497 . . 91 ILE C . 19462 1
533 . 1 . 1 91 91 ILE CA C 13 61.350 0.2 . 1 . . 498 . . 91 ILE CA . 19462 1
534 . 1 . 1 91 91 ILE CB C 13 39.794 0.2 . 1 . . 499 . . 91 ILE CB . 19462 1
535 . 1 . 1 91 91 ILE CG1 C 13 29.587 0.2 . 1 . . 837 . . 91 ILE CG1 . 19462 1
536 . 1 . 1 91 91 ILE CG2 C 13 18.937 0.2 . 1 . . 836 . . 91 ILE CG2 . 19462 1
537 . 1 . 1 91 91 ILE CD1 C 13 16.118 0.2 . 1 . . 835 . . 91 ILE CD1 . 19462 1
538 . 1 . 1 91 91 ILE N N 15 125.678 0.2 . 1 . . 496 . . 91 ILE N . 19462 1
539 . 1 . 1 92 92 LYS H H 1 9.163 0.03 . 1 . . 474 . . 92 LYS H . 19462 1
540 . 1 . 1 92 92 LYS HA H 1 5.010 0.03 . 1 . . 709 . . 92 LYS HA . 19462 1
541 . 1 . 1 92 92 LYS HB2 H 1 1.803 0.03 . 2 . . 710 . . 92 LYS HB2 . 19462 1
542 . 1 . 1 92 92 LYS HB3 H 1 1.696 0.03 . 2 . . 821 . . 92 LYS HB3 . 19462 1
543 . 1 . 1 92 92 LYS HG2 H 1 1.144 0.03 . 2 . . 822 . . 92 LYS HG2 . 19462 1
544 . 1 . 1 92 92 LYS HG3 H 1 1.266 0.03 . 2 . . 711 . . 92 LYS HG3 . 19462 1
545 . 1 . 1 92 92 LYS HD2 H 1 1.298 0.03 . 2 . . 824 . . 92 LYS HD2 . 19462 1
546 . 1 . 1 92 92 LYS HD3 H 1 1.255 0.03 . 2 . . 823 . . 92 LYS HD3 . 19462 1
547 . 1 . 1 92 92 LYS HE2 H 1 2.262 0.03 . 2 . . 827 . . 92 LYS HE2 . 19462 1
548 . 1 . 1 92 92 LYS HE3 H 1 2.086 0.03 . 2 . . 826 . . 92 LYS HE3 . 19462 1
549 . 1 . 1 92 92 LYS C C 13 174.090 0.2 . 1 . . 506 . . 92 LYS C . 19462 1
550 . 1 . 1 92 92 LYS CA C 13 55.188 0.2 . 1 . . 476 . . 92 LYS CA . 19462 1
551 . 1 . 1 92 92 LYS CB C 13 36.574 0.2 . 1 . . 477 . . 92 LYS CB . 19462 1
552 . 1 . 1 92 92 LYS CG C 13 24.105 0.2 . 1 . . 818 . . 92 LYS CG . 19462 1
553 . 1 . 1 92 92 LYS CD C 13 29.593 0.2 . 1 . . 819 . . 92 LYS CD . 19462 1
554 . 1 . 1 92 92 LYS CE C 13 42.098 0.2 . 1 . . 820 . . 92 LYS CE . 19462 1
555 . 1 . 1 92 92 LYS N N 15 122.015 0.2 . 1 . . 475 . . 92 LYS N . 19462 1
556 . 1 . 1 93 93 GLN H H 1 8.213 0.03 . 1 . . 469 . . 93 GLN H . 19462 1
557 . 1 . 1 93 93 GLN HA H 1 3.697 0.03 . 1 . . 706 . . 93 GLN HA . 19462 1
558 . 1 . 1 93 93 GLN HB2 H 1 1.546 0.03 . 1 . . 707 . . 93 GLN HB2 . 19462 1
559 . 1 . 1 93 93 GLN HB3 H 1 1.049 0.03 . 1 . . 708 . . 93 GLN HB3 . 19462 1
560 . 1 . 1 93 93 GLN HG2 H 1 1.003 0.03 . 2 . . 929 . . 93 GLN HG2 . 19462 1
561 . 1 . 1 93 93 GLN HG3 H 1 1.044 0.03 . 2 . . 930 . . 93 GLN HG3 . 19462 1
562 . 1 . 1 93 93 GLN HE21 H 1 7.242 0.03 . 1 . . 975 . . 93 GLN HE21 . 19462 1
563 . 1 . 1 93 93 GLN HE22 H 1 7.479 0.03 . 1 . . 976 . . 93 GLN HE22 . 19462 1
564 . 1 . 1 93 93 GLN C C 13 175.678 0.2 . 1 . . 478 . . 93 GLN C . 19462 1
565 . 1 . 1 93 93 GLN CA C 13 57.062 0.2 . 1 . . 472 . . 93 GLN CA . 19462 1
566 . 1 . 1 93 93 GLN CB C 13 29.041 0.2 . 1 . . 471 . . 93 GLN CB . 19462 1
567 . 1 . 1 93 93 GLN CG C 13 34.062 0.2 . 1 . . 928 . . 93 GLN CG . 19462 1
568 . 1 . 1 93 93 GLN N N 15 123.794 0.2 . 1 . . 470 . . 93 GLN N . 19462 1
569 . 1 . 1 93 93 GLN NE2 N 15 111.035 0.2 . 1 . . 974 . . 93 GLN NE2 . 19462 1
stop_
save_