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 25168
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $Sample
_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 $N-flpp3sol isotropic 25168 1
2 '3D HNCO' 2 $NC-flpp3sol isotropic 25168 1
3 'HNcaCO (HNcaCO)' 2 $NC-flpp3sol isotropic 25168 1
4 '3D HNCA' 2 $NC-flpp3sol isotropic 25168 1
5 '3D HNCACB' 2 $NC-flpp3sol isotropic 25168 1
6 '3D CBCA(CO)NH' 2 $NC-flpp3sol isotropic 25168 1
7 '3D 1H-15N NOESY' 2 $NC-flpp3sol isotropic 25168 1
8 'CcoNH (C_coNH.relayed)' 2 $NC-flpp3sol isotropic 25168 1
9 '3D HCCH-TOCSY' 2 $NC-flpp3sol isotropic 25168 1
10 '3D H(CCO)NH' 2 $NC-flpp3sol isotropic 25168 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $CcpNmr_Analysis . . 25168 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 2 2 ASP HA H 1 4.725 0.005 . 1 . . 563 . . 2 ASP HA . 25168 1
2 . 1 1 2 2 ASP HB2 H 1 2.756 0.011 . 2 . . 579 . . 2 ASP HB2 . 25168 1
3 . 1 1 2 2 ASP HB3 H 1 2.737 0.017 . 2 . . 580 . . 2 ASP HB3 . 25168 1
4 . 1 1 2 2 ASP C C 13 175.911 0.009 . 1 . . 476 . . 2 ASP C . 25168 1
5 . 1 1 2 2 ASP CA C 13 54.051 0.064 . 1 . . 475 . . 2 ASP CA . 25168 1
6 . 1 1 2 2 ASP CB C 13 41.260 0.028 . 1 . . 477 . . 2 ASP CB . 25168 1
7 . 1 1 3 3 LYS H H 1 8.586 0.003 . 1 . . 330 . . 3 LYS H . 25168 1
8 . 1 1 3 3 LYS HA H 1 4.371 0.004 . 1 . . 562 . . 3 LYS HA . 25168 1
9 . 1 1 3 3 LYS HB2 H 1 1.970 0.006 . 2 . . 570 . . 3 LYS HB2 . 25168 1
10 . 1 1 3 3 LYS HB3 H 1 1.834 0.0 . 2 . . 890 . . 3 LYS HB3 . 25168 1
11 . 1 1 3 3 LYS HG2 H 1 1.529 0.007 . 2 . . 572 . . 3 LYS HG2 . 25168 1
12 . 1 1 3 3 LYS HG3 H 1 1.514 0.014 . 2 . . 891 . . 3 LYS HG3 . 25168 1
13 . 1 1 3 3 LYS HD2 H 1 1.773 0.026 . 1 . . 571 . . 3 LYS HD2 . 25168 1
14 . 1 1 3 3 LYS HE2 H 1 3.071 0.006 . 1 . . 892 . . 3 LYS HE2 . 25168 1
15 . 1 1 3 3 LYS HE3 H 1 3.071 0.006 . 1 . . 893 . . 3 LYS HE3 . 25168 1
16 . 1 1 3 3 LYS C C 13 177.081 0.007 . 1 . . 333 . . 3 LYS C . 25168 1
17 . 1 1 3 3 LYS CA C 13 56.652 0.024 . 1 . . 332 . . 3 LYS CA . 25168 1
18 . 1 1 3 3 LYS CB C 13 32.604 0.017 . 1 . . 331 . . 3 LYS CB . 25168 1
19 . 1 1 3 3 LYS CG C 13 24.516 0.026 . 1 . . 507 . . 3 LYS CG . 25168 1
20 . 1 1 3 3 LYS CD C 13 28.755 0.002 . 1 . . 506 . . 3 LYS CD . 25168 1
21 . 1 1 3 3 LYS CE C 13 41.897 0.154 . 1 . . 508 . . 3 LYS CE . 25168 1
22 . 1 1 3 3 LYS N N 15 121.354 0.033 . 1 . . 329 . . 3 LYS N . 25168 1
23 . 1 1 4 4 GLY H H 1 8.653 0.002 . 1 . . 328 . . 4 GLY H . 25168 1
24 . 1 1 4 4 GLY HA2 H 1 4.042 0.006 . 2 . . 979 . . 4 GLY HA2 . 25168 1
25 . 1 1 4 4 GLY HA3 H 1 4.037 0.001 . 2 . . 980 . . 4 GLY HA3 . 25168 1
26 . 1 1 4 4 GLY C C 13 174.152 0.005 . 1 . . 474 . . 4 GLY C . 25168 1
27 . 1 1 4 4 GLY CA C 13 45.333 0.014 . 1 . . 976 . . 4 GLY CA . 25168 1
28 . 1 1 4 4 GLY N N 15 108.715 0.029 . 1 . . 327 . . 4 GLY N . 25168 1
29 . 1 1 5 5 THR H H 1 8.066 0.003 . 1 . . 858 . . 5 THR H . 25168 1
30 . 1 1 5 5 THR HA H 1 5.015 0.003 . 1 . . 567 . . 5 THR HA . 25168 1
31 . 1 1 5 5 THR HB H 1 3.947 0.005 . 1 . . 566 . . 5 THR HB . 25168 1
32 . 1 1 5 5 THR HG21 H 1 1.014 0.004 . 1 . . 565 . . 5 THR HG21 . 25168 1
33 . 1 1 5 5 THR HG22 H 1 1.014 0.004 . 1 . . 565 . . 5 THR HG22 . 25168 1
34 . 1 1 5 5 THR HG23 H 1 1.014 0.004 . 1 . . 565 . . 5 THR HG23 . 25168 1
35 . 1 1 5 5 THR C C 13 173.749 0.004 . 1 . . 313 . . 5 THR C . 25168 1
36 . 1 1 5 5 THR CA C 13 61.751 0.071 . 1 . . 311 . . 5 THR CA . 25168 1
37 . 1 1 5 5 THR CB C 13 70.150 0.031 . 1 . . 312 . . 5 THR CB . 25168 1
38 . 1 1 5 5 THR CG2 C 13 20.948 0.06 . 1 . . 509 . . 5 THR CG2 . 25168 1
39 . 1 1 5 5 THR N N 15 116.716 0.021 . 1 . . 59 . . 5 THR N . 25168 1
40 . 1 1 6 6 GLN H H 1 9.087 0.004 . 1 . . 307 . . 6 GLN H . 25168 1
41 . 1 1 6 6 GLN HA H 1 4.703 0.004 . 1 . . 856 . . 6 GLN HA . 25168 1
42 . 1 1 6 6 GLN HB2 H 1 2.073 0.012 . 2 . . 581 . . 6 GLN HB2 . 25168 1
43 . 1 1 6 6 GLN HB3 H 1 1.908 0.005 . 2 . . 582 . . 6 GLN HB3 . 25168 1
44 . 1 1 6 6 GLN HG2 H 1 2.280 0.004 . 1 . . 855 . . 6 GLN HG2 . 25168 1
45 . 1 1 6 6 GLN HG3 H 1 2.280 0.004 . 1 . . 857 . . 6 GLN HG3 . 25168 1
46 . 1 1 6 6 GLN C C 13 172.925 0.006 . 1 . . 309 . . 6 GLN C . 25168 1
47 . 1 1 6 6 GLN CA C 13 54.277 0.022 . 1 . . 310 . . 6 GLN CA . 25168 1
48 . 1 1 6 6 GLN CB C 13 32.875 0.07 . 1 . . 308 . . 6 GLN CB . 25168 1
49 . 1 1 6 6 GLN CG C 13 33.651 0.06 . 1 . . 510 . . 6 GLN CG . 25168 1
50 . 1 1 6 6 GLN N N 15 123.560 0.023 . 1 . . 859 . . 6 GLN N . 25168 1
51 . 1 1 7 7 TYR H H 1 8.603 0.002 . 1 . . 303 . . 7 TYR H . 25168 1
52 . 1 1 7 7 TYR HA H 1 5.867 0.004 . 1 . . 568 . . 7 TYR HA . 25168 1
53 . 1 1 7 7 TYR HB2 H 1 3.105 0.002 . 2 . . 583 . . 7 TYR HB2 . 25168 1
54 . 1 1 7 7 TYR HB3 H 1 2.951 0.006 . 2 . . 584 . . 7 TYR HB3 . 25168 1
55 . 1 1 7 7 TYR C C 13 174.678 0.003 . 1 . . 305 . . 7 TYR C . 25168 1
56 . 1 1 7 7 TYR CA C 13 55.860 0.076 . 1 . . 306 . . 7 TYR CA . 25168 1
57 . 1 1 7 7 TYR CB C 13 39.341 0.019 . 1 . . 304 . . 7 TYR CB . 25168 1
58 . 1 1 7 7 TYR N N 15 122.372 0.017 . 1 . . 302 . . 7 TYR N . 25168 1
59 . 1 1 8 8 LYS H H 1 8.746 0.001 . 1 . . 298 . . 8 LYS H . 25168 1
60 . 1 1 8 8 LYS HA H 1 4.520 0.007 . 1 . . 574 . . 8 LYS HA . 25168 1
61 . 1 1 8 8 LYS HB2 H 1 1.687 0.012 . 2 . . 585 . . 8 LYS HB2 . 25168 1
62 . 1 1 8 8 LYS HB3 H 1 1.705 0.015 . 2 . . 586 . . 8 LYS HB3 . 25168 1
63 . 1 1 8 8 LYS HG2 H 1 1.330 0.023 . 2 . . 1007 . . 8 LYS HG2 . 25168 1
64 . 1 1 8 8 LYS HG3 H 1 1.405 0.021 . 2 . . 894 . . 8 LYS HG3 . 25168 1
65 . 1 1 8 8 LYS HD2 H 1 1.683 0.003 . 2 . . 977 . . 8 LYS HD2 . 25168 1
66 . 1 1 8 8 LYS HD3 H 1 1.692 0.012 . 2 . . 1008 . . 8 LYS HD3 . 25168 1
67 . 1 1 8 8 LYS C C 13 175.649 0.007 . 1 . . 301 . . 8 LYS C . 25168 1
68 . 1 1 8 8 LYS CA C 13 55.369 0.098 . 1 . . 300 . . 8 LYS CA . 25168 1
69 . 1 1 8 8 LYS CB C 13 34.977 0.012 . 1 . . 299 . . 8 LYS CB . 25168 1
70 . 1 1 8 8 LYS CG C 13 24.161 0.024 . 1 . . 511 . . 8 LYS CG . 25168 1
71 . 1 1 8 8 LYS CD C 13 28.871 0.081 . 1 . . 1006 . . 8 LYS CD . 25168 1
72 . 1 1 8 8 LYS N N 15 126.432 0.018 . 1 . . 297 . . 8 LYS N . 25168 1
73 . 1 1 9 9 ASP H H 1 9.361 0.002 . 1 . . 293 . . 9 ASP H . 25168 1
74 . 1 1 9 9 ASP HA H 1 4.348 0.004 . 1 . . 587 . . 9 ASP HA . 25168 1
75 . 1 1 9 9 ASP HB2 H 1 3.133 0.008 . 2 . . 588 . . 9 ASP HB2 . 25168 1
76 . 1 1 9 9 ASP HB3 H 1 2.849 0.004 . 2 . . 589 . . 9 ASP HB3 . 25168 1
77 . 1 1 9 9 ASP C C 13 174.362 0.006 . 1 . . 295 . . 9 ASP C . 25168 1
78 . 1 1 9 9 ASP CA C 13 55.278 0.091 . 1 . . 296 . . 9 ASP CA . 25168 1
79 . 1 1 9 9 ASP CB C 13 39.330 0.027 . 1 . . 294 . . 9 ASP CB . 25168 1
80 . 1 1 9 9 ASP N N 15 126.563 0.033 . 1 . . 292 . . 9 ASP N . 25168 1
81 . 1 1 10 10 GLY H H 1 7.986 0.001 . 1 . . 50 . . 10 GLY H . 25168 1
82 . 1 1 10 10 GLY HA2 H 1 3.662 0.002 . 2 . . 590 . . 10 GLY HA2 . 25168 1
83 . 1 1 10 10 GLY HA3 H 1 3.450 0.007 . 2 . . 591 . . 10 GLY HA3 . 25168 1
84 . 1 1 10 10 GLY C C 13 172.387 0.01 . 1 . . 290 . . 10 GLY C . 25168 1
85 . 1 1 10 10 GLY CA C 13 44.936 0.025 . 1 . . 291 . . 10 GLY CA . 25168 1
86 . 1 1 10 10 GLY N N 15 101.961 0.014 . 1 . . 49 . . 10 GLY N . 25168 1
87 . 1 1 11 11 TYR H H 1 8.019 0.002 . 1 . . 52 . . 11 TYR H . 25168 1
88 . 1 1 11 11 TYR HA H 1 4.665 0.002 . 1 . . 592 . . 11 TYR HA . 25168 1
89 . 1 1 11 11 TYR HB2 H 1 3.126 0.023 . 2 . . 569 . . 11 TYR HB2 . 25168 1
90 . 1 1 11 11 TYR HB3 H 1 2.626 0.004 . 2 . . 593 . . 11 TYR HB3 . 25168 1
91 . 1 1 11 11 TYR C C 13 173.722 0.004 . 1 . . 289 . . 11 TYR C . 25168 1
92 . 1 1 11 11 TYR CA C 13 57.504 0.059 . 1 . . 288 . . 11 TYR CA . 25168 1
93 . 1 1 11 11 TYR CB C 13 38.318 0.033 . 1 . . 287 . . 11 TYR CB . 25168 1
94 . 1 1 11 11 TYR N N 15 118.679 0.025 . 1 . . 51 . . 11 TYR N . 25168 1
95 . 1 1 12 12 TYR H H 1 9.608 0.002 . 1 . . 283 . . 12 TYR H . 25168 1
96 . 1 1 12 12 TYR HA H 1 5.309 0.003 . 1 . . 594 . . 12 TYR HA . 25168 1
97 . 1 1 12 12 TYR HB2 H 1 3.558 0.005 . 2 . . 595 . . 12 TYR HB2 . 25168 1
98 . 1 1 12 12 TYR HB3 H 1 2.948 0.001 . 2 . . 596 . . 12 TYR HB3 . 25168 1
99 . 1 1 12 12 TYR C C 13 174.586 0.002 . 1 . . 284 . . 12 TYR C . 25168 1
100 . 1 1 12 12 TYR CA C 13 57.590 0.029 . 1 . . 286 . . 12 TYR CA . 25168 1
101 . 1 1 12 12 TYR CB C 13 41.412 0.026 . 1 . . 285 . . 12 TYR CB . 25168 1
102 . 1 1 12 12 TYR N N 15 125.852 0.018 . 1 . . 282 . . 12 TYR N . 25168 1
103 . 1 1 13 13 ILE H H 1 9.142 0.002 . 1 . . 279 . . 13 ILE H . 25168 1
104 . 1 1 13 13 ILE HA H 1 5.495 0.005 . 1 . . 597 . . 13 ILE HA . 25168 1
105 . 1 1 13 13 ILE HB H 1 1.614 0.012 . 1 . . 598 . . 13 ILE HB . 25168 1
106 . 1 1 13 13 ILE HG12 H 1 1.020 0.021 . 2 . . 895 . . 13 ILE HG12 . 25168 1
107 . 1 1 13 13 ILE HG13 H 1 1.653 0.004 . 2 . . 1088 . . 13 ILE HG13 . 25168 1
108 . 1 1 13 13 ILE HG21 H 1 0.861 0.009 . 1 . . 599 . . 13 ILE HG21 . 25168 1
109 . 1 1 13 13 ILE HG22 H 1 0.861 0.009 . 1 . . 599 . . 13 ILE HG22 . 25168 1
110 . 1 1 13 13 ILE HG23 H 1 0.861 0.009 . 1 . . 599 . . 13 ILE HG23 . 25168 1
111 . 1 1 13 13 ILE HD11 H 1 0.815 0.004 . 1 . . 896 . . 13 ILE HD11 . 25168 1
112 . 1 1 13 13 ILE HD12 H 1 0.815 0.004 . 1 . . 896 . . 13 ILE HD12 . 25168 1
113 . 1 1 13 13 ILE HD13 H 1 0.815 0.004 . 1 . . 896 . . 13 ILE HD13 . 25168 1
114 . 1 1 13 13 ILE C C 13 175.303 0.009 . 1 . . 280 . . 13 ILE C . 25168 1
115 . 1 1 13 13 ILE CA C 13 60.043 0.061 . 1 . . 281 . . 13 ILE CA . 25168 1
116 . 1 1 13 13 ILE CB C 13 41.019 0.109 . 1 . . 473 . . 13 ILE CB . 25168 1
117 . 1 1 13 13 ILE CG1 C 13 26.636 0.064 . 1 . . 512 . . 13 ILE CG1 . 25168 1
118 . 1 1 13 13 ILE CG2 C 13 16.871 0.008 . 1 . . 513 . . 13 ILE CG2 . 25168 1
119 . 1 1 13 13 ILE CD1 C 13 14.150 0.209 . 1 . . 514 . . 13 ILE CD1 . 25168 1
120 . 1 1 13 13 ILE N N 15 128.679 0.027 . 1 . . 278 . . 13 ILE N . 25168 1
121 . 1 1 14 14 THR H H 1 9.136 0.001 . 1 . . 275 . . 14 THR H . 25168 1
122 . 1 1 14 14 THR HA H 1 4.880 0.003 . 1 . . 897 . . 14 THR HA . 25168 1
123 . 1 1 14 14 THR HB H 1 4.048 0.001 . 1 . . 900 . . 14 THR HB . 25168 1
124 . 1 1 14 14 THR HG21 H 1 1.199 0.005 . 1 . . 898 . . 14 THR HG21 . 25168 1
125 . 1 1 14 14 THR HG22 H 1 1.199 0.005 . 1 . . 898 . . 14 THR HG22 . 25168 1
126 . 1 1 14 14 THR HG23 H 1 1.199 0.005 . 1 . . 898 . . 14 THR HG23 . 25168 1
127 . 1 1 14 14 THR C C 13 171.703 0.002 . 1 . . 277 . . 14 THR C . 25168 1
128 . 1 1 14 14 THR CA C 13 60.130 0.021 . 1 . . 899 . . 14 THR CA . 25168 1
129 . 1 1 14 14 THR CB C 13 69.400 0.035 . 1 . . 276 . . 14 THR CB . 25168 1
130 . 1 1 14 14 THR CG2 C 13 18.486 0.018 . 1 . . 515 . . 14 THR CG2 . 25168 1
131 . 1 1 14 14 THR N N 15 119.374 0.024 . 1 . . 274 . . 14 THR N . 25168 1
132 . 1 1 15 15 THR H H 1 8.246 0.005 . 1 . . 270 . . 15 THR H . 25168 1
133 . 1 1 15 15 THR HA H 1 5.321 0.003 . 1 . . 601 . . 15 THR HA . 25168 1
134 . 1 1 15 15 THR HB H 1 4.026 0.003 . 1 . . 602 . . 15 THR HB . 25168 1
135 . 1 1 15 15 THR HG21 H 1 1.089 0.005 . 1 . . 600 . . 15 THR HG21 . 25168 1
136 . 1 1 15 15 THR HG22 H 1 1.089 0.005 . 1 . . 600 . . 15 THR HG22 . 25168 1
137 . 1 1 15 15 THR HG23 H 1 1.089 0.005 . 1 . . 600 . . 15 THR HG23 . 25168 1
138 . 1 1 15 15 THR C C 13 173.745 0.005 . 1 . . 271 . . 15 THR C . 25168 1
139 . 1 1 15 15 THR CA C 13 61.263 0.055 . 1 . . 272 . . 15 THR CA . 25168 1
140 . 1 1 15 15 THR CB C 13 70.278 0.018 . 1 . . 273 . . 15 THR CB . 25168 1
141 . 1 1 15 15 THR CG2 C 13 22.085 0.021 . 1 . . 522 . . 15 THR CG2 . 25168 1
142 . 1 1 15 15 THR N N 15 118.331 0.042 . 1 . . 269 . . 15 THR N . 25168 1
143 . 1 1 16 16 LEU H H 1 9.403 0.002 . 1 . . 266 . . 16 LEU H . 25168 1
144 . 1 1 16 16 LEU HA H 1 4.935 0.005 . 1 . . 982 . . 16 LEU HA . 25168 1
145 . 1 1 16 16 LEU HB2 H 1 1.652 0.01 . 2 . . 1089 . . 16 LEU HB2 . 25168 1
146 . 1 1 16 16 LEU HB3 H 1 1.846 0.004 . 2 . . 1090 . . 16 LEU HB3 . 25168 1
147 . 1 1 16 16 LEU HG H 1 1.831 0.005 . 1 . . 1092 . . 16 LEU HG . 25168 1
148 . 1 1 16 16 LEU HD11 H 1 1.107 0.005 . 2 . . 1094 . . 16 LEU HD11 . 25168 1
149 . 1 1 16 16 LEU HD12 H 1 1.107 0.005 . 2 . . 1094 . . 16 LEU HD12 . 25168 1
150 . 1 1 16 16 LEU HD13 H 1 1.107 0.005 . 2 . . 1094 . . 16 LEU HD13 . 25168 1
151 . 1 1 16 16 LEU HD21 H 1 1.003 0.008 . 2 . . 1096 . . 16 LEU HD21 . 25168 1
152 . 1 1 16 16 LEU HD22 H 1 1.003 0.008 . 2 . . 1096 . . 16 LEU HD22 . 25168 1
153 . 1 1 16 16 LEU HD23 H 1 1.003 0.008 . 2 . . 1096 . . 16 LEU HD23 . 25168 1
154 . 1 1 16 16 LEU C C 13 176.872 0.012 . 1 . . 267 . . 16 LEU C . 25168 1
155 . 1 1 16 16 LEU CA C 13 52.224 0.042 . 1 . . 268 . . 16 LEU CA . 25168 1
156 . 1 1 16 16 LEU CB C 13 45.144 0.098 . 1 . . 981 . . 16 LEU CB . 25168 1
157 . 1 1 16 16 LEU CG C 13 27.101 0.018 . 1 . . 1091 . . 16 LEU CG . 25168 1
158 . 1 1 16 16 LEU CD1 C 13 23.364 0.077 . 2 . . 1093 . . 16 LEU CD1 . 25168 1
159 . 1 1 16 16 LEU CD2 C 13 26.239 0.089 . 2 . . 1095 . . 16 LEU CD2 . 25168 1
160 . 1 1 16 16 LEU N N 15 124.578 0.031 . 1 . . 265 . . 16 LEU N . 25168 1
161 . 1 1 17 17 ASN H H 1 9.255 0.003 . 1 . . 261 . . 17 ASN H . 25168 1
162 . 1 1 17 17 ASN HA H 1 4.966 0.006 . 1 . . 603 . . 17 ASN HA . 25168 1
163 . 1 1 17 17 ASN HB2 H 1 2.785 0.009 . 2 . . 604 . . 17 ASN HB2 . 25168 1
164 . 1 1 17 17 ASN HB3 H 1 2.379 0.003 . 2 . . 605 . . 17 ASN HB3 . 25168 1
165 . 1 1 17 17 ASN C C 13 173.803 0.034 . 1 . . 264 . . 17 ASN C . 25168 1
166 . 1 1 17 17 ASN CA C 13 52.431 0.109 . 1 . . 263 . . 17 ASN CA . 25168 1
167 . 1 1 17 17 ASN CB C 13 36.360 0.039 . 1 . . 262 . . 17 ASN CB . 25168 1
168 . 1 1 17 17 ASN N N 15 126.744 0.026 . 1 . . 260 . . 17 ASN N . 25168 1
169 . 1 1 18 18 TYR H H 1 7.948 0.001 . 1 . . 45 . . 18 TYR H . 25168 1
170 . 1 1 18 18 TYR HA H 1 4.816 0.01 . 1 . . 606 . . 18 TYR HA . 25168 1
171 . 1 1 18 18 TYR HB2 H 1 3.130 0.001 . 2 . . 607 . . 18 TYR HB2 . 25168 1
172 . 1 1 18 18 TYR HB3 H 1 2.180 0.002 . 2 . . 608 . . 18 TYR HB3 . 25168 1
173 . 1 1 18 18 TYR C C 13 173.758 0.002 . 1 . . 349 . . 18 TYR C . 25168 1
174 . 1 1 18 18 TYR CA C 13 55.741 0.048 . 1 . . 347 . . 18 TYR CA . 25168 1
175 . 1 1 18 18 TYR CB C 13 43.447 0.031 . 1 . . 348 . . 18 TYR CB . 25168 1
176 . 1 1 18 18 TYR N N 15 115.164 0.012 . 1 . . 44 . . 18 TYR N . 25168 1
177 . 1 1 19 19 ASN H H 1 8.786 0.001 . 1 . . 346 . . 19 ASN H . 25168 1
178 . 1 1 19 19 ASN HA H 1 4.513 0.006 . 1 . . 609 . . 19 ASN HA . 25168 1
179 . 1 1 19 19 ASN HB2 H 1 3.127 0.002 . 2 . . 610 . . 19 ASN HB2 . 25168 1
180 . 1 1 19 19 ASN HB3 H 1 2.793 0.003 . 2 . . 611 . . 19 ASN HB3 . 25168 1
181 . 1 1 19 19 ASN C C 13 174.688 0.006 . 1 . . 418 . . 19 ASN C . 25168 1
182 . 1 1 19 19 ASN CA C 13 53.781 0.112 . 1 . . 420 . . 19 ASN CA . 25168 1
183 . 1 1 19 19 ASN CB C 13 40.455 0.059 . 1 . . 419 . . 19 ASN CB . 25168 1
184 . 1 1 19 19 ASN N N 15 117.371 0.024 . 1 . . 345 . . 19 ASN N . 25168 1
185 . 1 1 20 20 PHE H H 1 9.168 0.001 . 1 . . 417 . . 20 PHE H . 25168 1
186 . 1 1 20 20 PHE HA H 1 4.595 0.004 . 1 . . 612 . . 20 PHE HA . 25168 1
187 . 1 1 20 20 PHE HB2 H 1 2.880 0.007 . 2 . . 613 . . 20 PHE HB2 . 25168 1
188 . 1 1 20 20 PHE HB3 H 1 3.203 0.002 . 2 . . 614 . . 20 PHE HB3 . 25168 1
189 . 1 1 20 20 PHE C C 13 175.752 0.013 . 1 . . 424 . . 20 PHE C . 25168 1
190 . 1 1 20 20 PHE CA C 13 61.402 0.048 . 1 . . 423 . . 20 PHE CA . 25168 1
191 . 1 1 20 20 PHE CB C 13 41.046 0.04 . 1 . . 491 . . 20 PHE CB . 25168 1
192 . 1 1 20 20 PHE N N 15 126.647 0.019 . 1 . . 416 . . 20 PHE N . 25168 1
193 . 1 1 21 21 ASN H H 1 8.696 0.002 . 1 . . 422 . . 21 ASN H . 25168 1
194 . 1 1 21 21 ASN HA H 1 4.306 0.002 . 1 . . 615 . . 21 ASN HA . 25168 1
195 . 1 1 21 21 ASN HB2 H 1 2.904 0.017 . 2 . . 616 . . 21 ASN HB2 . 25168 1
196 . 1 1 21 21 ASN HB3 H 1 2.938 0.017 . 2 . . 617 . . 21 ASN HB3 . 25168 1
197 . 1 1 21 21 ASN C C 13 177.449 0.004 . 1 . . 494 . . 21 ASN C . 25168 1
198 . 1 1 21 21 ASN CA C 13 56.600 0.009 . 1 . . 493 . . 21 ASN CA . 25168 1
199 . 1 1 21 21 ASN CB C 13 37.938 0.006 . 1 . . 492 . . 21 ASN CB . 25168 1
200 . 1 1 21 21 ASN N N 15 116.436 0.021 . 1 . . 421 . . 21 ASN N . 25168 1
201 . 1 1 22 22 THR H H 1 7.722 0.001 . 1 . . 23 . . 22 THR H . 25168 1
202 . 1 1 22 22 THR HA H 1 4.046 0.011 . 1 . . 901 . . 22 THR HA . 25168 1
203 . 1 1 22 22 THR HB H 1 4.482 0.004 . 1 . . 618 . . 22 THR HB . 25168 1
204 . 1 1 22 22 THR HG21 H 1 1.283 0.003 . 1 . . 619 . . 22 THR HG21 . 25168 1
205 . 1 1 22 22 THR HG22 H 1 1.283 0.003 . 1 . . 619 . . 22 THR HG22 . 25168 1
206 . 1 1 22 22 THR HG23 H 1 1.283 0.003 . 1 . . 619 . . 22 THR HG23 . 25168 1
207 . 1 1 22 22 THR C C 13 176.881 0.002 . 1 . . 325 . . 22 THR C . 25168 1
208 . 1 1 22 22 THR CA C 13 65.858 0.041 . 1 . . 324 . . 22 THR CA . 25168 1
209 . 1 1 22 22 THR CB C 13 68.349 0.05 . 1 . . 326 . . 22 THR CB . 25168 1
210 . 1 1 22 22 THR CG2 C 13 22.534 0.037 . 1 . . 516 . . 22 THR CG2 . 25168 1
211 . 1 1 22 22 THR N N 15 115.944 0.018 . 1 . . 22 . . 22 THR N . 25168 1
212 . 1 1 23 23 VAL H H 1 8.321 0.002 . 1 . . 320 . . 23 VAL H . 25168 1
213 . 1 1 23 23 VAL HA H 1 3.323 0.002 . 1 . . 620 . . 23 VAL HA . 25168 1
214 . 1 1 23 23 VAL HB H 1 2.108 0.005 . 1 . . 621 . . 23 VAL HB . 25168 1
215 . 1 1 23 23 VAL HG11 H 1 0.932 0.019 . 2 . . 623 . . 23 VAL HG11 . 25168 1
216 . 1 1 23 23 VAL HG12 H 1 0.932 0.019 . 2 . . 623 . . 23 VAL HG12 . 25168 1
217 . 1 1 23 23 VAL HG13 H 1 0.932 0.019 . 2 . . 623 . . 23 VAL HG13 . 25168 1
218 . 1 1 23 23 VAL HG21 H 1 0.870 0.014 . 2 . . 622 . . 23 VAL HG21 . 25168 1
219 . 1 1 23 23 VAL HG22 H 1 0.870 0.014 . 2 . . 622 . . 23 VAL HG22 . 25168 1
220 . 1 1 23 23 VAL HG23 H 1 0.870 0.014 . 2 . . 622 . . 23 VAL HG23 . 25168 1
221 . 1 1 23 23 VAL C C 13 178.108 0.01 . 1 . . 321 . . 23 VAL C . 25168 1
222 . 1 1 23 23 VAL CA C 13 66.905 0.039 . 1 . . 323 . . 23 VAL CA . 25168 1
223 . 1 1 23 23 VAL CB C 13 31.207 0.042 . 1 . . 322 . . 23 VAL CB . 25168 1
224 . 1 1 23 23 VAL CG1 C 13 24.259 0.148 . 2 . . 523 . . 23 VAL CG1 . 25168 1
225 . 1 1 23 23 VAL CG2 C 13 22.092 0.068 . 2 . . 524 . . 23 VAL CG2 . 25168 1
226 . 1 1 23 23 VAL N N 15 122.323 0.017 . 1 . . 319 . . 23 VAL N . 25168 1
227 . 1 1 24 24 TYR H H 1 9.036 0.001 . 1 . . 315 . . 24 TYR H . 25168 1
228 . 1 1 24 24 TYR HA H 1 3.774 0.007 . 1 . . 624 . . 24 TYR HA . 25168 1
229 . 1 1 24 24 TYR HB2 H 1 2.654 0.001 . 2 . . 625 . . 24 TYR HB2 . 25168 1
230 . 1 1 24 24 TYR HB3 H 1 2.441 0.009 . 2 . . 626 . . 24 TYR HB3 . 25168 1
231 . 1 1 24 24 TYR C C 13 176.299 0.007 . 1 . . 317 . . 24 TYR C . 25168 1
232 . 1 1 24 24 TYR CA C 13 62.299 0.061 . 1 . . 318 . . 24 TYR CA . 25168 1
233 . 1 1 24 24 TYR CB C 13 36.932 0.059 . 1 . . 316 . . 24 TYR CB . 25168 1
234 . 1 1 24 24 TYR N N 15 123.058 0.029 . 1 . . 314 . . 24 TYR N . 25168 1
235 . 1 1 25 25 ASN H H 1 8.069 0.001 . 1 . . 60 . . 25 ASN H . 25168 1
236 . 1 1 25 25 ASN HA H 1 4.127 0.005 . 1 . . 627 . . 25 ASN HA . 25168 1
237 . 1 1 25 25 ASN HB2 H 1 2.862 0.005 . 2 . . 628 . . 25 ASN HB2 . 25168 1
238 . 1 1 25 25 ASN HB3 H 1 2.735 0.003 . 2 . . 629 . . 25 ASN HB3 . 25168 1
239 . 1 1 25 25 ASN C C 13 177.389 0.01 . 1 . . 443 . . 25 ASN C . 25168 1
240 . 1 1 25 25 ASN CA C 13 56.392 0.042 . 1 . . 442 . . 25 ASN CA . 25168 1
241 . 1 1 25 25 ASN CB C 13 37.845 0.043 . 1 . . 441 . . 25 ASN CB . 25168 1
242 . 1 1 25 25 ASN N N 15 115.727 0.027 . 1 . . 61 . . 25 ASN N . 25168 1
243 . 1 1 26 26 ALA H H 1 7.812 0.003 . 1 . . 860 . . 26 ALA H . 25168 1
244 . 1 1 26 26 ALA HA H 1 4.191 0.004 . 1 . . 564 . . 26 ALA HA . 25168 1
245 . 1 1 26 26 ALA HB1 H 1 1.550 0.007 . 1 . . 851 . . 26 ALA HB1 . 25168 1
246 . 1 1 26 26 ALA HB2 H 1 1.550 0.007 . 1 . . 851 . . 26 ALA HB2 . 25168 1
247 . 1 1 26 26 ALA HB3 H 1 1.550 0.007 . 1 . . 851 . . 26 ALA HB3 . 25168 1
248 . 1 1 26 26 ALA C C 13 179.325 0.004 . 1 . . 446 . . 26 ALA C . 25168 1
249 . 1 1 26 26 ALA CA C 13 54.585 0.193 . 1 . . 445 . . 26 ALA CA . 25168 1
250 . 1 1 26 26 ALA CB C 13 20.609 0.031 . 1 . . 444 . . 26 ALA CB . 25168 1
251 . 1 1 26 26 ALA N N 15 120.195 0.019 . 1 . . 1 . . 26 ALA N . 25168 1
252 . 1 1 27 27 THR H H 1 8.062 0.002 . 1 . . 849 . . 27 THR H . 25168 1
253 . 1 1 27 27 THR HA H 1 3.679 0.006 . 1 . . 863 . . 27 THR HA . 25168 1
254 . 1 1 27 27 THR HB H 1 3.919 0.016 . 1 . . 902 . . 27 THR HB . 25168 1
255 . 1 1 27 27 THR HG21 H 1 0.983 0.002 . 1 . . 861 . . 27 THR HG21 . 25168 1
256 . 1 1 27 27 THR HG22 H 1 0.983 0.002 . 1 . . 861 . . 27 THR HG22 . 25168 1
257 . 1 1 27 27 THR HG23 H 1 0.983 0.002 . 1 . . 861 . . 27 THR HG23 . 25168 1
258 . 1 1 27 27 THR C C 13 175.421 . . 1 . . 468 . . 27 THR C X 25168 1
259 . 1 1 27 27 THR CA C 13 67.038 0.073 . 1 . . 862 . . 27 THR CA . 25168 1
260 . 1 1 27 27 THR N N 15 116.726 0.027 . 1 . . 850 . . 27 THR N . 25168 1
261 . 1 1 28 28 LEU H H 1 8.139 0.001 . 1 . . 99 . . 28 LEU H . 25168 1
262 . 1 1 28 28 LEU HA H 1 3.721 0.005 . 1 . . 630 . . 28 LEU HA . 25168 1
263 . 1 1 28 28 LEU HB2 H 1 1.485 0.006 . 2 . . 1097 . . 28 LEU HB2 . 25168 1
264 . 1 1 28 28 LEU HB3 H 1 1.013 0.009 . 2 . . 1098 . . 28 LEU HB3 . 25168 1
265 . 1 1 28 28 LEU HG H 1 1.293 0.009 . 1 . . 1100 . . 28 LEU HG . 25168 1
266 . 1 1 28 28 LEU HD11 H 1 0.795 0.013 . 2 . . 1102 . . 28 LEU HD11 . 25168 1
267 . 1 1 28 28 LEU HD12 H 1 0.795 0.013 . 2 . . 1102 . . 28 LEU HD12 . 25168 1
268 . 1 1 28 28 LEU HD13 H 1 0.795 0.013 . 2 . . 1102 . . 28 LEU HD13 . 25168 1
269 . 1 1 28 28 LEU HD21 H 1 0.717 0.02 . 2 . . 1104 . . 28 LEU HD21 . 25168 1
270 . 1 1 28 28 LEU HD22 H 1 0.717 0.02 . 2 . . 1104 . . 28 LEU HD22 . 25168 1
271 . 1 1 28 28 LEU HD23 H 1 0.717 0.02 . 2 . . 1104 . . 28 LEU HD23 . 25168 1
272 . 1 1 28 28 LEU C C 13 178.966 0.008 . 1 . . 100 . . 28 LEU C . 25168 1
273 . 1 1 28 28 LEU CA C 13 57.892 0.025 . 1 . . 101 . . 28 LEU CA . 25168 1
274 . 1 1 28 28 LEU CB C 13 41.024 0.075 . 1 . . 102 . . 28 LEU CB . 25168 1
275 . 1 1 28 28 LEU CG C 13 26.227 0.123 . 1 . . 1099 . . 28 LEU CG . 25168 1
276 . 1 1 28 28 LEU CD1 C 13 24.235 0.085 . 2 . . 1101 . . 28 LEU CD1 . 25168 1
277 . 1 1 28 28 LEU CD2 C 13 23.365 0.074 . 2 . . 1103 . . 28 LEU CD2 . 25168 1
278 . 1 1 28 28 LEU N N 15 121.051 0.015 . 1 . . 98 . . 28 LEU N . 25168 1
279 . 1 1 29 29 GLN H H 1 7.978 0.003 . 1 . . 47 . . 29 GLN H . 25168 1
280 . 1 1 29 29 GLN HA H 1 3.955 0.003 . 1 . . 631 . . 29 GLN HA . 25168 1
281 . 1 1 29 29 GLN HB2 H 1 2.121 0.014 . 2 . . 632 . . 29 GLN HB2 . 25168 1
282 . 1 1 29 29 GLN HB3 H 1 1.993 0.005 . 2 . . 633 . . 29 GLN HB3 . 25168 1
283 . 1 1 29 29 GLN HG2 H 1 2.452 0.007 . 2 . . 634 . . 29 GLN HG2 . 25168 1
284 . 1 1 29 29 GLN HG3 H 1 2.312 0.002 . 2 . . 635 . . 29 GLN HG3 . 25168 1
285 . 1 1 29 29 GLN C C 13 177.112 0.007 . 1 . . 95 . . 29 GLN C . 25168 1
286 . 1 1 29 29 GLN CA C 13 58.878 0.053 . 1 . . 96 . . 29 GLN CA . 25168 1
287 . 1 1 29 29 GLN CB C 13 28.012 0.018 . 1 . . 97 . . 29 GLN CB . 25168 1
288 . 1 1 29 29 GLN CG C 13 33.395 0.026 . 1 . . 517 . . 29 GLN CG . 25168 1
289 . 1 1 29 29 GLN N N 15 115.567 0.027 . 1 . . 46 . . 29 GLN N . 25168 1
290 . 1 1 30 30 ALA H H 1 7.294 0.003 . 1 . . 11 . . 30 ALA H . 25168 1
291 . 1 1 30 30 ALA HA H 1 4.845 0.005 . 1 . . 636 . . 30 ALA HA . 25168 1
292 . 1 1 30 30 ALA HB1 H 1 1.314 0.001 . 1 . . 637 . . 30 ALA HB1 . 25168 1
293 . 1 1 30 30 ALA HB2 H 1 1.314 0.001 . 1 . . 637 . . 30 ALA HB2 . 25168 1
294 . 1 1 30 30 ALA HB3 H 1 1.314 0.001 . 1 . . 637 . . 30 ALA HB3 . 25168 1
295 . 1 1 30 30 ALA C C 13 179.755 0.007 . 1 . . 205 . . 30 ALA C . 25168 1
296 . 1 1 30 30 ALA CA C 13 53.809 0.014 . 1 . . 204 . . 30 ALA CA . 25168 1
297 . 1 1 30 30 ALA CB C 13 17.634 0.024 . 1 . . 203 . . 30 ALA CB . 25168 1
298 . 1 1 30 30 ALA N N 15 118.715 0.027 . 1 . . 10 . . 30 ALA N . 25168 1
299 . 1 1 31 31 ILE H H 1 7.577 0.003 . 1 . . 19 . . 31 ILE H . 25168 1
300 . 1 1 31 31 ILE HA H 1 4.042 0.006 . 1 . . 638 . . 31 ILE HA . 25168 1
301 . 1 1 31 31 ILE HB H 1 1.717 0.001 . 1 . . 639 . . 31 ILE HB . 25168 1
302 . 1 1 31 31 ILE HG12 H 1 1.853 0.002 . 1 . . 903 . . 31 ILE HG12 . 25168 1
303 . 1 1 31 31 ILE HG13 H 1 1.853 0.002 . 1 . . 904 . . 31 ILE HG13 . 25168 1
304 . 1 1 31 31 ILE HG21 H 1 0.989 0.007 . 1 . . 640 . . 31 ILE HG21 . 25168 1
305 . 1 1 31 31 ILE HG22 H 1 0.989 0.007 . 1 . . 640 . . 31 ILE HG22 . 25168 1
306 . 1 1 31 31 ILE HG23 H 1 0.989 0.007 . 1 . . 640 . . 31 ILE HG23 . 25168 1
307 . 1 1 31 31 ILE HD11 H 1 0.655 0.007 . 1 . . 641 . . 31 ILE HD11 . 25168 1
308 . 1 1 31 31 ILE HD12 H 1 0.655 0.007 . 1 . . 641 . . 31 ILE HD12 . 25168 1
309 . 1 1 31 31 ILE HD13 H 1 0.655 0.007 . 1 . . 641 . . 31 ILE HD13 . 25168 1
310 . 1 1 31 31 ILE C C 13 180.554 0.006 . 1 . . 201 . . 31 ILE C . 25168 1
311 . 1 1 31 31 ILE CA C 13 63.687 0.039 . 1 . . 200 . . 31 ILE CA . 25168 1
312 . 1 1 31 31 ILE CB C 13 39.478 0.031 . 1 . . 202 . . 31 ILE CB . 25168 1
313 . 1 1 31 31 ILE CG2 C 13 16.927 0.027 . 1 . . 519 . . 31 ILE CG2 . 25168 1
314 . 1 1 31 31 ILE CD1 C 13 13.639 0.109 . 1 . . 518 . . 31 ILE CD1 . 25168 1
315 . 1 1 31 31 ILE N N 15 114.928 0.018 . 1 . . 18 . . 31 ILE N . 25168 1
316 . 1 1 32 32 GLN H H 1 9.409 0.005 . 1 . . 196 . . 32 GLN H . 25168 1
317 . 1 1 32 32 GLN HA H 1 4.258 0.005 . 1 . . 642 . . 32 GLN HA . 25168 1
318 . 1 1 32 32 GLN HB2 H 1 2.144 0.003 . 2 . . 643 . . 32 GLN HB2 . 25168 1
319 . 1 1 32 32 GLN HB3 H 1 2.012 0.005 . 2 . . 644 . . 32 GLN HB3 . 25168 1
320 . 1 1 32 32 GLN HG2 H 1 2.376 0.004 . 2 . . 645 . . 32 GLN HG2 . 25168 1
321 . 1 1 32 32 GLN HG3 H 1 2.523 0.006 . 2 . . 646 . . 32 GLN HG3 . 25168 1
322 . 1 1 32 32 GLN C C 13 177.888 0.01 . 1 . . 197 . . 32 GLN C . 25168 1
323 . 1 1 32 32 GLN CA C 13 58.979 0.057 . 1 . . 199 . . 32 GLN CA . 25168 1
324 . 1 1 32 32 GLN CB C 13 28.546 0.025 . 1 . . 198 . . 32 GLN CB . 25168 1
325 . 1 1 32 32 GLN CG C 13 34.876 0.123 . 1 . . 520 . . 32 GLN CG . 25168 1
326 . 1 1 32 32 GLN N N 15 119.531 0.025 . 1 . . 195 . . 32 GLN N . 25168 1
327 . 1 1 33 33 ASN H H 1 8.695 0.003 . 1 . . 191 . . 33 ASN H . 25168 1
328 . 1 1 33 33 ASN HA H 1 4.899 0.008 . 1 . . 647 . . 33 ASN HA . 25168 1
329 . 1 1 33 33 ASN HB2 H 1 3.018 0.003 . 1 . . 648 . . 33 ASN HB2 . 25168 1
330 . 1 1 33 33 ASN HB3 H 1 3.018 0.003 . 1 . . 649 . . 33 ASN HB3 . 25168 1
331 . 1 1 33 33 ASN C C 13 176.350 0.001 . 1 . . 194 . . 33 ASN C . 25168 1
332 . 1 1 33 33 ASN CA C 13 52.519 0.05 . 1 . . 192 . . 33 ASN CA . 25168 1
333 . 1 1 33 33 ASN CB C 13 37.228 0.055 . 1 . . 193 . . 33 ASN CB . 25168 1
334 . 1 1 33 33 ASN N N 15 111.998 0.03 . 1 . . 190 . . 33 ASN N . 25168 1
335 . 1 1 34 34 GLY H H 1 7.801 0.001 . 1 . . 29 . . 34 GLY H . 25168 1
336 . 1 1 34 34 GLY HA2 H 1 4.086 0.004 . 1 . . 650 . . 34 GLY HA2 . 25168 1
337 . 1 1 34 34 GLY HA3 H 1 4.086 0.004 . 1 . . 651 . . 34 GLY HA3 . 25168 1
338 . 1 1 34 34 GLY C C 13 174.854 0.009 . 1 . . 189 . . 34 GLY C . 25168 1
339 . 1 1 34 34 GLY CA C 13 46.620 0.039 . 1 . . 188 . . 34 GLY CA . 25168 1
340 . 1 1 34 34 GLY N N 15 105.291 0.034 . 1 . . 28 . . 34 GLY N . 25168 1
341 . 1 1 35 35 GLN H H 1 8.469 0.002 . 1 . . 184 . . 35 GLN H . 25168 1
342 . 1 1 35 35 GLN HA H 1 4.290 0.003 . 1 . . 652 . . 35 GLN HA . 25168 1
343 . 1 1 35 35 GLN HB2 H 1 2.198 0.003 . 1 . . 1004 . . 35 GLN HB2 . 25168 1
344 . 1 1 35 35 GLN HB3 H 1 2.198 0.003 . 1 . . 1005 . . 35 GLN HB3 . 25168 1
345 . 1 1 35 35 GLN HG2 H 1 2.482 0.005 . 2 . . 653 . . 35 GLN HG2 . 25168 1
346 . 1 1 35 35 GLN HG3 H 1 2.066 0.001 . 2 . . 1001 . . 35 GLN HG3 . 25168 1
347 . 1 1 35 35 GLN C C 13 177.648 0.001 . 1 . . 187 . . 35 GLN C . 25168 1
348 . 1 1 35 35 GLN CA C 13 58.212 0.016 . 1 . . 185 . . 35 GLN CA . 25168 1
349 . 1 1 35 35 GLN CB C 13 30.692 0.015 . 1 . . 186 . . 35 GLN CB . 25168 1
350 . 1 1 35 35 GLN CG C 13 36.564 0.064 . 1 . . 521 . . 35 GLN CG . 25168 1
351 . 1 1 35 35 GLN N N 15 115.850 0.023 . 1 . . 183 . . 35 GLN N . 25168 1
352 . 1 1 36 36 THR H H 1 7.296 0.004 . 1 . . 13 . . 36 THR H . 25168 1
353 . 1 1 36 36 THR HA H 1 4.293 0.001 . 1 . . 905 . . 36 THR HA . 25168 1
354 . 1 1 36 36 THR HB H 1 3.801 0.009 . 1 . . 654 . . 36 THR HB . 25168 1
355 . 1 1 36 36 THR HG21 H 1 1.058 0.004 . 1 . . 655 . . 36 THR HG21 . 25168 1
356 . 1 1 36 36 THR HG22 H 1 1.058 0.004 . 1 . . 655 . . 36 THR HG22 . 25168 1
357 . 1 1 36 36 THR HG23 H 1 1.058 0.004 . 1 . . 655 . . 36 THR HG23 . 25168 1
358 . 1 1 36 36 THR C C 13 171.374 0.02 . 1 . . 214 . . 36 THR C . 25168 1
359 . 1 1 36 36 THR CA C 13 58.537 0.073 . 1 . . 216 . . 36 THR CA . 25168 1
360 . 1 1 36 36 THR CB C 13 69.687 0.037 . 1 . . 215 . . 36 THR CB . 25168 1
361 . 1 1 36 36 THR CG2 C 13 18.499 0.086 . 1 . . 525 . . 36 THR CG2 . 25168 1
362 . 1 1 36 36 THR N N 15 108.808 0.036 . 1 . . 12 . . 36 THR N . 25168 1
363 . 1 1 37 37 PHE H H 1 7.362 0.004 . 1 . . 17 . . 37 PHE H . 25168 1
364 . 1 1 37 37 PHE HA H 1 4.585 0.003 . 1 . . 656 . . 37 PHE HA . 25168 1
365 . 1 1 37 37 PHE HB2 H 1 2.561 0.004 . 2 . . 657 . . 37 PHE HB2 . 25168 1
366 . 1 1 37 37 PHE HB3 H 1 2.816 0.0 . 2 . . 658 . . 37 PHE HB3 . 25168 1
367 . 1 1 37 37 PHE C C 13 173.010 0.009 . 1 . . 251 . . 37 PHE C . 25168 1
368 . 1 1 37 37 PHE CA C 13 55.193 0.049 . 1 . . 252 . . 37 PHE CA . 25168 1
369 . 1 1 37 37 PHE CB C 13 39.044 0.077 . 1 . . 253 . . 37 PHE CB . 25168 1
370 . 1 1 37 37 PHE N N 15 123.152 0.032 . 1 . . 16 . . 37 PHE N . 25168 1
371 . 1 1 38 38 ASP H H 1 8.672 0.002 . 1 . . 247 . . 38 ASP H . 25168 1
372 . 1 1 38 38 ASP HA H 1 4.575 0.003 . 1 . . 864 . . 38 ASP HA . 25168 1
373 . 1 1 38 38 ASP HB2 H 1 1.884 0.006 . 2 . . 866 . . 38 ASP HB2 . 25168 1
374 . 1 1 38 38 ASP HB3 H 1 1.878 . . 2 . . 911 . . 38 ASP HB3 X 25168 1
375 . 1 1 38 38 ASP C C 13 178.923 0.008 . 1 . . 249 . . 38 ASP C . 25168 1
376 . 1 1 38 38 ASP CA C 13 52.448 0.035 . 1 . . 250 . . 38 ASP CA . 25168 1
377 . 1 1 38 38 ASP CB C 13 42.266 0.026 . 1 . . 248 . . 38 ASP CB . 25168 1
378 . 1 1 38 38 ASP N N 15 118.301 0.042 . 1 . . 246 . . 38 ASP N . 25168 1
379 . 1 1 39 39 TYR H H 1 8.617 0.002 . 1 . . 242 . . 39 TYR H . 25168 1
380 . 1 1 39 39 TYR HA H 1 4.528 0.006 . 1 . . 659 . . 39 TYR HA . 25168 1
381 . 1 1 39 39 TYR HB2 H 1 3.213 0.012 . 2 . . 660 . . 39 TYR HB2 . 25168 1
382 . 1 1 39 39 TYR HB3 H 1 3.184 0.017 . 2 . . 661 . . 39 TYR HB3 . 25168 1
383 . 1 1 39 39 TYR C C 13 176.271 0.004 . 1 . . 244 . . 39 TYR C . 25168 1
384 . 1 1 39 39 TYR CA C 13 59.513 0.057 . 1 . . 245 . . 39 TYR CA . 25168 1
385 . 1 1 39 39 TYR CB C 13 37.020 0.031 . 1 . . 243 . . 39 TYR CB . 25168 1
386 . 1 1 39 39 TYR N N 15 114.927 0.031 . 1 . . 867 . . 39 TYR N . 25168 1
387 . 1 1 40 40 LYS H H 1 7.917 0.003 . 1 . . 868 . . 40 LYS H . 25168 1
388 . 1 1 40 40 LYS HA H 1 4.352 0.004 . 1 . . 662 . . 40 LYS HA . 25168 1
389 . 1 1 40 40 LYS HB2 H 1 1.740 0.005 . 2 . . 663 . . 40 LYS HB2 . 25168 1
390 . 1 1 40 40 LYS HB3 H 1 1.546 0.001 . 2 . . 664 . . 40 LYS HB3 . 25168 1
391 . 1 1 40 40 LYS HG2 H 1 0.891 0.02 . 2 . . 667 . . 40 LYS HG2 . 25168 1
392 . 1 1 40 40 LYS HG3 H 1 0.916 0.014 . 2 . . 668 . . 40 LYS HG3 . 25168 1
393 . 1 1 40 40 LYS HD2 H 1 1.557 0.006 . 1 . . 983 . . 40 LYS HD2 . 25168 1
394 . 1 1 40 40 LYS HE2 H 1 2.968 0.014 . 1 . . 665 . . 40 LYS HE2 . 25168 1
395 . 1 1 40 40 LYS HE3 H 1 2.968 0.014 . 1 . . 666 . . 40 LYS HE3 . 25168 1
396 . 1 1 40 40 LYS C C 13 175.282 0.001 . 1 . . 408 . . 40 LYS C . 25168 1
397 . 1 1 40 40 LYS CA C 13 54.751 0.092 . 1 . . 409 . . 40 LYS CA . 25168 1
398 . 1 1 40 40 LYS CB C 13 31.618 0.016 . 1 . . 410 . . 40 LYS CB . 25168 1
399 . 1 1 40 40 LYS CG C 13 24.142 0.059 . 1 . . 528 . . 40 LYS CG . 25168 1
400 . 1 1 40 40 LYS CD C 13 28.611 0.09 . 1 . . 527 . . 40 LYS CD . 25168 1
401 . 1 1 40 40 LYS CE C 13 41.804 0.093 . 1 . . 526 . . 40 LYS CE . 25168 1
402 . 1 1 40 40 LYS N N 15 120.954 0.018 . 1 . . 39 . . 40 LYS N . 25168 1
403 . 1 1 41 41 SER H H 1 8.379 0.003 . 1 . . 869 . . 41 SER H . 25168 1
404 . 1 1 41 41 SER HA H 1 3.748 0.007 . 1 . . 670 . . 41 SER HA . 25168 1
405 . 1 1 41 41 SER HB2 H 1 3.583 0.009 . 2 . . 669 . . 41 SER HB2 . 25168 1
406 . 1 1 41 41 SER HB3 H 1 3.941 0.007 . 2 . . 1010 . . 41 SER HB3 . 25168 1
407 . 1 1 41 41 SER C C 13 172.797 . . 1 . . 478 . . 41 SER C X 25168 1
408 . 1 1 41 41 SER CA C 13 59.257 0.051 . 1 . . 1009 . . 41 SER CA . 25168 1
409 . 1 1 41 41 SER CB C 13 60.706 0.001 . 1 . . 479 . . 41 SER CB . 25168 1
410 . 1 1 41 41 SER N N 15 110.133 0.037 . 1 . . 407 . . 41 SER N . 25168 1
411 . 1 1 42 42 ASN H H 1 8.569 0.002 . 1 . . 335 . . 42 ASN H . 25168 1
412 . 1 1 42 42 ASN HA H 1 5.217 0.002 . 1 . . 907 . . 42 ASN HA . 25168 1
413 . 1 1 42 42 ASN HB2 H 1 2.702 0.009 . 1 . . 908 . . 42 ASN HB2 . 25168 1
414 . 1 1 42 42 ASN HB3 H 1 2.702 0.009 . 1 . . 909 . . 42 ASN HB3 . 25168 1
415 . 1 1 42 42 ASN C C 13 172.270 . . 1 . . 481 . . 42 ASN C X 25168 1
416 . 1 1 42 42 ASN CA C 13 49.957 0.03 . 1 . . 480 . . 42 ASN CA . 25168 1
417 . 1 1 42 42 ASN CB C 13 38.968 0.035 . 1 . . 906 . . 42 ASN CB . 25168 1
418 . 1 1 42 42 ASN N N 15 119.679 0.026 . 1 . . 334 . . 42 ASN N . 25168 1
419 . 1 1 44 44 TYR HA H 1 3.993 0.004 . 1 . . 671 . . 44 TYR HA . 25168 1
420 . 1 1 44 44 TYR HB2 H 1 2.685 0.005 . 2 . . 672 . . 44 TYR HB2 . 25168 1
421 . 1 1 44 44 TYR HB3 H 1 2.680 0.007 . 2 . . 673 . . 44 TYR HB3 . 25168 1
422 . 1 1 44 44 TYR C C 13 174.282 0.001 . 1 . . 488 . . 44 TYR C . 25168 1
423 . 1 1 44 44 TYR CA C 13 60.588 0.039 . 1 . . 489 . . 44 TYR CA . 25168 1
424 . 1 1 44 44 TYR CB C 13 39.157 0.064 . 1 . . 487 . . 44 TYR CB . 25168 1
425 . 1 1 45 45 ASP H H 1 8.363 0.002 . 1 . . 393 . . 45 ASP H . 25168 1
426 . 1 1 45 45 ASP HA H 1 4.924 0.004 . 1 . . 674 . . 45 ASP HA . 25168 1
427 . 1 1 45 45 ASP HB2 H 1 2.766 0.002 . 2 . . 675 . . 45 ASP HB2 . 25168 1
428 . 1 1 45 45 ASP HB3 H 1 2.953 0.0 . 2 . . 676 . . 45 ASP HB3 . 25168 1
429 . 1 1 45 45 ASP C C 13 176.953 0.014 . 1 . . 395 . . 45 ASP C . 25168 1
430 . 1 1 45 45 ASP CA C 13 53.146 0.009 . 1 . . 396 . . 45 ASP CA . 25168 1
431 . 1 1 45 45 ASP CB C 13 41.669 0.06 . 1 . . 394 . . 45 ASP CB . 25168 1
432 . 1 1 45 45 ASP N N 15 119.875 0.029 . 1 . . 392 . . 45 ASP N . 25168 1
433 . 1 1 46 46 ILE H H 1 8.907 0.002 . 1 . . 391 . . 46 ILE H . 25168 1
434 . 1 1 46 46 ILE HA H 1 4.023 0.004 . 1 . . 677 . . 46 ILE HA . 25168 1
435 . 1 1 46 46 ILE HB H 1 1.871 0.004 . 1 . . 910 . . 46 ILE HB . 25168 1
436 . 1 1 46 46 ILE HG12 H 1 0.770 0.007 . 1 . . 873 . . 46 ILE HG12 . 25168 1
437 . 1 1 46 46 ILE HG13 H 1 0.770 0.007 . 1 . . 874 . . 46 ILE HG13 . 25168 1
438 . 1 1 46 46 ILE HG21 H 1 0.931 0.007 . 1 . . 870 . . 46 ILE HG21 X 25168 1
439 . 1 1 46 46 ILE HG22 H 1 0.931 0.007 . 1 . . 870 . . 46 ILE HG22 X 25168 1
440 . 1 1 46 46 ILE HG23 H 1 0.931 0.007 . 1 . . 870 . . 46 ILE HG23 X 25168 1
441 . 1 1 46 46 ILE HD11 H 1 0.908 0.007 . 1 . . 875 . . 46 ILE HD11 . 25168 1
442 . 1 1 46 46 ILE HD12 H 1 0.908 0.007 . 1 . . 875 . . 46 ILE HD12 . 25168 1
443 . 1 1 46 46 ILE HD13 H 1 0.908 0.007 . 1 . . 875 . . 46 ILE HD13 . 25168 1
444 . 1 1 46 46 ILE C C 13 175.622 0.007 . 1 . . 486 . . 46 ILE C . 25168 1
445 . 1 1 46 46 ILE CA C 13 62.617 0.025 . 1 . . 485 . . 46 ILE CA . 25168 1
446 . 1 1 46 46 ILE CB C 13 38.477 0.075 . 1 . . 484 . . 46 ILE CB . 25168 1
447 . 1 1 46 46 ILE CG1 C 13 28.328 0.15 . 1 . . 872 . . 46 ILE CG1 . 25168 1
448 . 1 1 46 46 ILE CG2 C 13 17.723 0.112 . 1 . . 871 . . 46 ILE CG2 . 25168 1
449 . 1 1 46 46 ILE CD1 C 13 13.451 0.017 . 1 . . 529 . . 46 ILE CD1 . 25168 1
450 . 1 1 46 46 ILE N N 15 127.428 0.027 . 1 . . 390 . . 46 ILE N . 25168 1
451 . 1 1 47 47 SER H H 1 9.307 0.005 . 1 . . 174 . . 47 SER H . 25168 1
452 . 1 1 47 47 SER HA H 1 4.712 . . 1 . . 1012 . . 47 SER HA X 25168 1
453 . 1 1 47 47 SER HB2 H 1 3.887 0.006 . 1 . . 678 . . 47 SER HB2 . 25168 1
454 . 1 1 47 47 SER HB3 H 1 3.887 0.006 . 1 . . 679 . . 47 SER HB3 . 25168 1
455 . 1 1 47 47 SER C C 13 174.902 . . 1 . . 177 . . 47 SER C X 25168 1
456 . 1 1 47 47 SER CA C 13 58.263 0.043 . 1 . . 175 . . 47 SER CA . 25168 1
457 . 1 1 47 47 SER CB C 13 63.866 0.007 . 1 . . 176 . . 47 SER CB . 25168 1
458 . 1 1 47 47 SER N N 15 123.195 0.037 . 1 . . 876 . . 47 SER N . 25168 1
459 . 1 1 48 48 VAL H H 1 7.871 0.002 . 1 . . 34 . . 48 VAL H . 25168 1
460 . 1 1 48 48 VAL HA H 1 4.268 0.004 . 1 . . 680 . . 48 VAL HA . 25168 1
461 . 1 1 48 48 VAL HB H 1 1.876 0.001 . 1 . . 681 . . 48 VAL HB . 25168 1
462 . 1 1 48 48 VAL HG11 H 1 1.014 0.007 . 2 . . 682 . . 48 VAL HG11 . 25168 1
463 . 1 1 48 48 VAL HG12 H 1 1.014 0.007 . 2 . . 682 . . 48 VAL HG12 . 25168 1
464 . 1 1 48 48 VAL HG13 H 1 1.014 0.007 . 2 . . 682 . . 48 VAL HG13 . 25168 1
465 . 1 1 48 48 VAL HG21 H 1 1.003 0.013 . 2 . . 683 . . 48 VAL HG21 . 25168 1
466 . 1 1 48 48 VAL HG22 H 1 1.003 0.013 . 2 . . 683 . . 48 VAL HG22 . 25168 1
467 . 1 1 48 48 VAL HG23 H 1 1.003 0.013 . 2 . . 683 . . 48 VAL HG23 . 25168 1
468 . 1 1 48 48 VAL C C 13 173.611 0.005 . 1 . . 171 . . 48 VAL C . 25168 1
469 . 1 1 48 48 VAL CA C 13 61.897 0.026 . 1 . . 173 . . 48 VAL CA . 25168 1
470 . 1 1 48 48 VAL CB C 13 35.579 0.04 . 1 . . 172 . . 48 VAL CB . 25168 1
471 . 1 1 48 48 VAL CG1 C 13 20.432 0.009 . 1 . . 531 . . 48 VAL CG1 . 25168 1
472 . 1 1 48 48 VAL CG2 C 13 20.432 0.009 . 1 . . 684 . . 48 VAL CG2 . 25168 1
473 . 1 1 48 48 VAL N N 15 123.333 0.034 . 1 . . 877 . . 48 VAL N . 25168 1
474 . 1 1 49 49 ASN H H 1 8.799 0.001 . 1 . . 167 . . 49 ASN H . 25168 1
475 . 1 1 49 49 ASN HA H 1 5.414 0.002 . 1 . . 685 . . 49 ASN HA . 25168 1
476 . 1 1 49 49 ASN HB2 H 1 2.976 0.005 . 2 . . 686 . . 49 ASN HB2 . 25168 1
477 . 1 1 49 49 ASN HB3 H 1 2.709 0.003 . 2 . . 687 . . 49 ASN HB3 . 25168 1
478 . 1 1 49 49 ASN C C 13 173.833 0.009 . 1 . . 170 . . 49 ASN C . 25168 1
479 . 1 1 49 49 ASN CA C 13 51.908 0.05 . 1 . . 169 . . 49 ASN CA . 25168 1
480 . 1 1 49 49 ASN CB C 13 38.067 0.045 . 1 . . 168 . . 49 ASN CB . 25168 1
481 . 1 1 49 49 ASN N N 15 123.538 0.028 . 1 . . 879 . . 49 ASN N . 25168 1
482 . 1 1 50 50 LYS H H 1 9.218 0.001 . 1 . . 878 . . 50 LYS H . 25168 1
483 . 1 1 50 50 LYS HA H 1 4.779 0.005 . 1 . . 688 . . 50 LYS HA . 25168 1
484 . 1 1 50 50 LYS HB2 H 1 1.787 0.011 . 2 . . 691 . . 50 LYS HB2 . 25168 1
485 . 1 1 50 50 LYS HB3 H 1 1.970 0.005 . 2 . . 1076 . . 50 LYS HB3 . 25168 1
486 . 1 1 50 50 LYS HG2 H 1 1.517 0.015 . 2 . . 692 . . 50 LYS HG2 . 25168 1
487 . 1 1 50 50 LYS HG3 H 1 1.553 0.012 . 2 . . 693 . . 50 LYS HG3 . 25168 1
488 . 1 1 50 50 LYS HD2 H 1 1.719 0.007 . 2 . . 984 . . 50 LYS HD2 . 25168 1
489 . 1 1 50 50 LYS HD3 H 1 1.718 0.007 . 2 . . 985 . . 50 LYS HD3 . 25168 1
490 . 1 1 50 50 LYS HE2 H 1 2.999 0.036 . 1 . . 689 . . 50 LYS HE2 . 25168 1
491 . 1 1 50 50 LYS HE3 H 1 2.999 0.036 . 1 . . 690 . . 50 LYS HE3 . 25168 1
492 . 1 1 50 50 LYS C C 13 175.290 0.003 . 1 . . 164 . . 50 LYS C . 25168 1
493 . 1 1 50 50 LYS CA C 13 54.403 0.015 . 1 . . 165 . . 50 LYS CA . 25168 1
494 . 1 1 50 50 LYS CB C 13 35.594 0.053 . 1 . . 166 . . 50 LYS CB . 25168 1
495 . 1 1 50 50 LYS CG C 13 24.207 0.022 . 1 . . 533 . . 50 LYS CG . 25168 1
496 . 1 1 50 50 LYS CD C 13 29.070 0.045 . 1 . . 532 . . 50 LYS CD . 25168 1
497 . 1 1 50 50 LYS CE C 13 41.873 0.132 . 1 . . 1075 . . 50 LYS CE . 25168 1
498 . 1 1 50 50 LYS N N 15 124.011 0.026 . 1 . . 163 . . 50 LYS N . 25168 1
499 . 1 1 51 51 ASN H H 1 8.483 0.001 . 1 . . 159 . . 51 ASN H . 25168 1
500 . 1 1 51 51 ASN HA H 1 5.119 0.003 . 1 . . 694 . . 51 ASN HA . 25168 1
501 . 1 1 51 51 ASN HB2 H 1 2.390 0.004 . 2 . . 695 . . 51 ASN HB2 . 25168 1
502 . 1 1 51 51 ASN HB3 H 1 2.679 0.01 . 2 . . 696 . . 51 ASN HB3 . 25168 1
503 . 1 1 51 51 ASN C C 13 174.977 0.005 . 1 . . 161 . . 51 ASN C . 25168 1
504 . 1 1 51 51 ASN CA C 13 53.029 0.037 . 1 . . 160 . . 51 ASN CA . 25168 1
505 . 1 1 51 51 ASN CB C 13 38.673 0.038 . 1 . . 162 . . 51 ASN CB . 25168 1
506 . 1 1 51 51 ASN N N 15 117.103 0.008 . 1 . . 158 . . 51 ASN N . 25168 1
507 . 1 1 52 52 ASN H H 1 8.401 0.004 . 1 . . 880 . . 52 ASN H . 25168 1
508 . 1 1 52 52 ASN HA H 1 5.118 0.003 . 1 . . 697 . . 52 ASN HA . 25168 1
509 . 1 1 52 52 ASN HB2 H 1 3.486 0.007 . 2 . . 698 . . 52 ASN HB2 . 25168 1
510 . 1 1 52 52 ASN HB3 H 1 2.938 0.002 . 2 . . 699 . . 52 ASN HB3 . 25168 1
511 . 1 1 52 52 ASN C C 13 177.475 0.008 . 1 . . 155 . . 52 ASN C . 25168 1
512 . 1 1 52 52 ASN CA C 13 51.413 0.049 . 1 . . 157 . . 52 ASN CA . 25168 1
513 . 1 1 52 52 ASN CB C 13 38.633 0.035 . 1 . . 156 . . 52 ASN CB . 25168 1
514 . 1 1 52 52 ASN N N 15 122.880 0.023 . 1 . . 154 . . 52 ASN N . 25168 1
515 . 1 1 53 53 GLY H H 1 9.107 0.003 . 1 . . 151 . . 53 GLY H . 25168 1
516 . 1 1 53 53 GLY HA2 H 1 4.508 0.004 . 2 . . 700 . . 53 GLY HA2 . 25168 1
517 . 1 1 53 53 GLY HA3 H 1 3.677 0.001 . 2 . . 701 . . 53 GLY HA3 . 25168 1
518 . 1 1 53 53 GLY C C 13 172.972 0.003 . 1 . . 152 . . 53 GLY C . 25168 1
519 . 1 1 53 53 GLY CA C 13 45.317 0.017 . 1 . . 153 . . 53 GLY CA . 25168 1
520 . 1 1 53 53 GLY N N 15 109.938 0.016 . 1 . . 881 . . 53 GLY N . 25168 1
521 . 1 1 54 54 THR H H 1 8.015 0.002 . 1 . . 882 . . 54 THR H . 25168 1
522 . 1 1 54 54 THR HA H 1 3.734 0.005 . 1 . . 702 . . 54 THR HA . 25168 1
523 . 1 1 54 54 THR HB H 1 4.054 0.002 . 1 . . 1014 . . 54 THR HB . 25168 1
524 . 1 1 54 54 THR HG21 H 1 1.139 0.006 . 1 . . 703 . . 54 THR HG21 . 25168 1
525 . 1 1 54 54 THR HG22 H 1 1.139 0.006 . 1 . . 703 . . 54 THR HG22 . 25168 1
526 . 1 1 54 54 THR HG23 H 1 1.139 0.006 . 1 . . 703 . . 54 THR HG23 . 25168 1
527 . 1 1 54 54 THR C C 13 170.732 0.014 . 1 . . 150 . . 54 THR C . 25168 1
528 . 1 1 54 54 THR CA C 13 63.057 0.074 . 1 . . 1013 . . 54 THR CA . 25168 1
529 . 1 1 54 54 THR CB C 13 70.297 0.033 . 1 . . 149 . . 54 THR CB . 25168 1
530 . 1 1 54 54 THR CG2 C 13 21.033 0.05 . 1 . . 534 . . 54 THR CG2 . 25168 1
531 . 1 1 54 54 THR N N 15 111.926 0.03 . 1 . . 48 . . 54 THR N . 25168 1
532 . 1 1 55 55 ASP H H 1 8.839 0.001 . 1 . . 145 . . 55 ASP H . 25168 1
533 . 1 1 55 55 ASP HA H 1 5.678 0.006 . 1 . . 704 . . 55 ASP HA . 25168 1
534 . 1 1 55 55 ASP HB2 H 1 2.495 0.006 . 2 . . 705 . . 55 ASP HB2 . 25168 1
535 . 1 1 55 55 ASP HB3 H 1 2.649 0.005 . 2 . . 706 . . 55 ASP HB3 . 25168 1
536 . 1 1 55 55 ASP C C 13 174.967 0.008 . 1 . . 146 . . 55 ASP C . 25168 1
537 . 1 1 55 55 ASP CA C 13 53.213 0.026 . 1 . . 148 . . 55 ASP CA . 25168 1
538 . 1 1 55 55 ASP CB C 13 44.381 0.034 . 1 . . 147 . . 55 ASP CB . 25168 1
539 . 1 1 55 55 ASP N N 15 119.647 0.019 . 1 . . 883 . . 55 ASP N . 25168 1
540 . 1 1 56 56 ALA H H 1 9.320 0.001 . 1 . . 141 . . 56 ALA H . 25168 1
541 . 1 1 56 56 ALA HA H 1 5.591 0.01 . 1 . . 707 . . 56 ALA HA . 25168 1
542 . 1 1 56 56 ALA HB1 H 1 1.579 0.01 . 1 . . 708 . . 56 ALA HB1 . 25168 1
543 . 1 1 56 56 ALA HB2 H 1 1.579 0.01 . 1 . . 708 . . 56 ALA HB2 . 25168 1
544 . 1 1 56 56 ALA HB3 H 1 1.579 0.01 . 1 . . 708 . . 56 ALA HB3 . 25168 1
545 . 1 1 56 56 ALA C C 13 176.487 0.006 . 1 . . 144 . . 56 ALA C . 25168 1
546 . 1 1 56 56 ALA CA C 13 50.520 0.075 . 1 . . 143 . . 56 ALA CA . 25168 1
547 . 1 1 56 56 ALA CB C 13 23.472 0.037 . 1 . . 142 . . 56 ALA CB . 25168 1
548 . 1 1 56 56 ALA N N 15 121.567 0.037 . 1 . . 140 . . 56 ALA N . 25168 1
549 . 1 1 57 57 GLU H H 1 9.166 0.001 . 1 . . 137 . . 57 GLU H . 25168 1
550 . 1 1 57 57 GLU HA H 1 5.301 0.003 . 1 . . 709 . . 57 GLU HA . 25168 1
551 . 1 1 57 57 GLU HB2 H 1 2.032 0.004 . 1 . . 711 . . 57 GLU HB2 . 25168 1
552 . 1 1 57 57 GLU HB3 H 1 2.032 0.004 . 1 . . 884 . . 57 GLU HB3 . 25168 1
553 . 1 1 57 57 GLU HG2 H 1 2.169 0.023 . 2 . . 1016 . . 57 GLU HG2 . 25168 1
554 . 1 1 57 57 GLU HG3 H 1 2.236 0.016 . 2 . . 1017 . . 57 GLU HG3 . 25168 1
555 . 1 1 57 57 GLU C C 13 173.358 0.009 . 1 . . 139 . . 57 GLU C . 25168 1
556 . 1 1 57 57 GLU CA C 13 55.629 0.034 . 1 . . 138 . . 57 GLU CA . 25168 1
557 . 1 1 57 57 GLU CB C 13 33.939 0.043 . 1 . . 1015 . . 57 GLU CB . 25168 1
558 . 1 1 57 57 GLU CG C 13 36.301 0.024 . 1 . . 710 . . 57 GLU CG . 25168 1
559 . 1 1 57 57 GLU N N 15 121.757 0.033 . 1 . . 136 . . 57 GLU N . 25168 1
560 . 1 1 58 58 ILE H H 1 9.245 0.002 . 1 . . 132 . . 58 ILE H . 25168 1
561 . 1 1 58 58 ILE HA H 1 5.173 0.004 . 1 . . 712 . . 58 ILE HA . 25168 1
562 . 1 1 58 58 ILE HB H 1 1.492 0.004 . 1 . . 1078 . . 58 ILE HB . 25168 1
563 . 1 1 58 58 ILE HG12 H 1 1.625 0.009 . 1 . . 713 . . 58 ILE HG12 . 25168 1
564 . 1 1 58 58 ILE HG13 H 1 1.625 0.009 . 1 . . 714 . . 58 ILE HG13 . 25168 1
565 . 1 1 58 58 ILE HG21 H 1 0.882 0.006 . 1 . . 716 . . 58 ILE HG21 . 25168 1
566 . 1 1 58 58 ILE HG22 H 1 0.882 0.006 . 1 . . 716 . . 58 ILE HG22 . 25168 1
567 . 1 1 58 58 ILE HG23 H 1 0.882 0.006 . 1 . . 716 . . 58 ILE HG23 . 25168 1
568 . 1 1 58 58 ILE HD11 H 1 0.664 0.004 . 1 . . 715 . . 58 ILE HD11 . 25168 1
569 . 1 1 58 58 ILE HD12 H 1 0.664 0.004 . 1 . . 715 . . 58 ILE HD12 . 25168 1
570 . 1 1 58 58 ILE HD13 H 1 0.664 0.004 . 1 . . 715 . . 58 ILE HD13 . 25168 1
571 . 1 1 58 58 ILE C C 13 175.099 0.003 . 1 . . 135 . . 58 ILE C . 25168 1
572 . 1 1 58 58 ILE CA C 13 59.510 0.052 . 1 . . 133 . . 58 ILE CA . 25168 1
573 . 1 1 58 58 ILE CB C 13 41.665 0.037 . 1 . . 134 . . 58 ILE CB . 25168 1
574 . 1 1 58 58 ILE CG1 C 13 26.980 0.05 . 1 . . 537 . . 58 ILE CG1 . 25168 1
575 . 1 1 58 58 ILE CG2 C 13 17.563 0.026 . 1 . . 1077 . . 58 ILE CG2 . 25168 1
576 . 1 1 58 58 ILE CD1 C 13 14.274 0.038 . 1 . . 538 . . 58 ILE CD1 . 25168 1
577 . 1 1 58 58 ILE N N 15 123.196 0.027 . 1 . . 131 . . 58 ILE N . 25168 1
578 . 1 1 59 59 VAL H H 1 9.221 0.002 . 1 . . 127 . . 59 VAL H . 25168 1
579 . 1 1 59 59 VAL HA H 1 4.563 0.008 . 1 . . 717 . . 59 VAL HA . 25168 1
580 . 1 1 59 59 VAL HB H 1 1.994 0.01 . 1 . . 718 . . 59 VAL HB . 25168 1
581 . 1 1 59 59 VAL HG11 H 1 1.012 0.013 . 2 . . 719 . . 59 VAL HG11 . 25168 1
582 . 1 1 59 59 VAL HG12 H 1 1.012 0.013 . 2 . . 719 . . 59 VAL HG12 . 25168 1
583 . 1 1 59 59 VAL HG13 H 1 1.012 0.013 . 2 . . 719 . . 59 VAL HG13 . 25168 1
584 . 1 1 59 59 VAL HG21 H 1 0.988 0.011 . 2 . . 720 . . 59 VAL HG21 . 25168 1
585 . 1 1 59 59 VAL HG22 H 1 0.988 0.011 . 2 . . 720 . . 59 VAL HG22 . 25168 1
586 . 1 1 59 59 VAL HG23 H 1 0.988 0.011 . 2 . . 720 . . 59 VAL HG23 . 25168 1
587 . 1 1 59 59 VAL C C 13 173.959 0.01 . 1 . . 130 . . 59 VAL C . 25168 1
588 . 1 1 59 59 VAL CA C 13 62.316 0.073 . 1 . . 128 . . 59 VAL CA . 25168 1
589 . 1 1 59 59 VAL CB C 13 33.421 0.053 . 1 . . 129 . . 59 VAL CB . 25168 1
590 . 1 1 59 59 VAL CG1 C 13 21.179 0.028 . 2 . . 535 . . 59 VAL CG1 . 25168 1
591 . 1 1 59 59 VAL CG2 C 13 20.278 0.076 . 2 . . 536 . . 59 VAL CG2 . 25168 1
592 . 1 1 59 59 VAL N N 15 126.832 0.029 . 1 . . 126 . . 59 VAL N . 25168 1
593 . 1 1 60 60 SER H H 1 8.754 0.002 . 1 . . 122 . . 60 SER H . 25168 1
594 . 1 1 60 60 SER HA H 1 5.622 0.0 . 1 . . 912 . . 60 SER HA . 25168 1
595 . 1 1 60 60 SER HB2 H 1 3.446 0.002 . 2 . . 721 . . 60 SER HB2 . 25168 1
596 . 1 1 60 60 SER HB3 H 1 3.583 0.001 . 2 . . 722 . . 60 SER HB3 . 25168 1
597 . 1 1 60 60 SER C C 13 172.687 0.003 . 1 . . 125 . . 60 SER C . 25168 1
598 . 1 1 60 60 SER CA C 13 56.967 0.044 . 1 . . 124 . . 60 SER CA . 25168 1
599 . 1 1 60 60 SER CB C 13 68.373 0.018 . 1 . . 123 . . 60 SER CB . 25168 1
600 . 1 1 60 60 SER N N 15 121.956 0.02 . 1 . . 121 . . 60 SER N . 25168 1
601 . 1 1 61 61 ALA H H 1 8.790 0.002 . 1 . . 117 . . 61 ALA H . 25168 1
602 . 1 1 61 61 ALA HA H 1 5.086 0.008 . 1 . . 723 . . 61 ALA HA . 25168 1
603 . 1 1 61 61 ALA HB1 H 1 1.541 0.004 . 1 . . 724 . . 61 ALA HB1 . 25168 1
604 . 1 1 61 61 ALA HB2 H 1 1.541 0.004 . 1 . . 724 . . 61 ALA HB2 . 25168 1
605 . 1 1 61 61 ALA HB3 H 1 1.541 0.004 . 1 . . 724 . . 61 ALA HB3 . 25168 1
606 . 1 1 61 61 ALA C C 13 176.140 0.017 . 1 . . 120 . . 61 ALA C . 25168 1
607 . 1 1 61 61 ALA CA C 13 52.141 0.113 . 1 . . 118 . . 61 ALA CA . 25168 1
608 . 1 1 61 61 ALA CB C 13 21.610 0.019 . 1 . . 119 . . 61 ALA CB . 25168 1
609 . 1 1 61 61 ALA N N 15 119.026 0.02 . 1 . . 116 . . 61 ALA N . 25168 1
610 . 1 1 62 62 SER H H 1 8.662 0.003 . 1 . . 113 . . 62 SER H . 25168 1
611 . 1 1 62 62 SER HA H 1 4.967 0.001 . 1 . . 987 . . 62 SER HA . 25168 1
612 . 1 1 62 62 SER HB2 H 1 4.458 0.009 . 2 . . 988 . . 62 SER HB2 . 25168 1
613 . 1 1 62 62 SER HB3 H 1 4.831 . . 2 . . 989 . . 62 SER HB3 X 25168 1
614 . 1 1 62 62 SER C C 13 176.783 0.019 . 1 . . 115 . . 62 SER C . 25168 1
615 . 1 1 62 62 SER CA C 13 56.972 0.068 . 1 . . 986 . . 62 SER CA . 25168 1
616 . 1 1 62 62 SER CB C 13 63.928 0.141 . 1 . . 114 . . 62 SER CB . 25168 1
617 . 1 1 62 62 SER N N 15 114.564 0.02 . 1 . . 112 . . 62 SER N . 25168 1
618 . 1 1 63 63 ASP H H 1 9.686 0.003 . 1 . . 108 . . 63 ASP H . 25168 1
619 . 1 1 63 63 ASP HA H 1 4.519 0.004 . 1 . . 725 . . 63 ASP HA . 25168 1
620 . 1 1 63 63 ASP HB2 H 1 2.787 0.004 . 2 . . 726 . . 63 ASP HB2 . 25168 1
621 . 1 1 63 63 ASP HB3 H 1 3.015 0.006 . 2 . . 727 . . 63 ASP HB3 . 25168 1
622 . 1 1 63 63 ASP C C 13 177.042 0.015 . 1 . . 111 . . 63 ASP C . 25168 1
623 . 1 1 63 63 ASP CA C 13 55.386 0.03 . 1 . . 110 . . 63 ASP CA . 25168 1
624 . 1 1 63 63 ASP CB C 13 40.432 0.091 . 1 . . 109 . . 63 ASP CB . 25168 1
625 . 1 1 63 63 ASP N N 15 127.982 0.04 . 1 . . 107 . . 63 ASP N . 25168 1
626 . 1 1 64 64 SER H H 1 8.237 0.002 . 1 . . 104 . . 64 SER H . 25168 1
627 . 1 1 64 64 SER HA H 1 4.743 0.007 . 1 . . 913 . . 64 SER HA . 25168 1
628 . 1 1 64 64 SER HB2 H 1 3.978 0.025 . 2 . . 914 . . 64 SER HB2 . 25168 1
629 . 1 1 64 64 SER HB3 H 1 3.929 0.024 . 2 . . 916 . . 64 SER HB3 . 25168 1
630 . 1 1 64 64 SER C C 13 174.257 0.005 . 1 . . 106 . . 64 SER C . 25168 1
631 . 1 1 64 64 SER CA C 13 58.409 0.052 . 1 . . 915 . . 64 SER CA . 25168 1
632 . 1 1 64 64 SER CB C 13 64.180 0.002 . 1 . . 105 . . 64 SER CB . 25168 1
633 . 1 1 64 64 SER N N 15 111.607 0.023 . 1 . . 103 . . 64 SER N . 25168 1
634 . 1 1 65 65 ASP H H 1 7.054 0.003 . 1 . . 7 . . 65 ASP H . 25168 1
635 . 1 1 65 65 ASP HA H 1 4.802 . . 1 . . 728 . . 65 ASP HA X 25168 1
636 . 1 1 65 65 ASP HB2 H 1 2.934 . . 1 . . 729 . . 65 ASP HB2 X 25168 1
637 . 1 1 65 65 ASP HB3 H 1 2.934 . . 1 . . 730 . . 65 ASP HB3 X 25168 1
638 . 1 1 65 65 ASP C C 13 176.101 0.007 . 1 . . 353 . . 65 ASP C . 25168 1
639 . 1 1 65 65 ASP CA C 13 53.830 0.022 . 1 . . 354 . . 65 ASP CA . 25168 1
640 . 1 1 65 65 ASP CB C 13 41.008 0.026 . 1 . . 352 . . 65 ASP CB . 25168 1
641 . 1 1 65 65 ASP N N 15 118.195 0.013 . 1 . . 6 . . 65 ASP N . 25168 1
642 . 1 1 66 66 SER H H 1 9.118 0.002 . 1 . . 351 . . 66 SER H . 25168 1
643 . 1 1 66 66 SER HB2 H 1 4.282 0.008 . 2 . . 731 . . 66 SER HB2 . 25168 1
644 . 1 1 66 66 SER HB3 H 1 4.059 0.004 . 2 . . 732 . . 66 SER HB3 . 25168 1
645 . 1 1 66 66 SER C C 13 174.938 . . 1 . . 470 . . 66 SER C X 25168 1
646 . 1 1 66 66 SER CA C 13 60.889 0.03 . 1 . . 472 . . 66 SER CA . 25168 1
647 . 1 1 66 66 SER CB C 13 62.659 0.047 . 1 . . 471 . . 66 SER CB . 25168 1
648 . 1 1 66 66 SER N N 15 121.141 0.034 . 1 . . 350 . . 66 SER N . 25168 1
649 . 1 1 67 67 THR H H 1 8.517 0.002 . 1 . . 210 . . 67 THR H . 25168 1
650 . 1 1 67 67 THR HA H 1 4.476 0.022 . 1 . . 734 . . 67 THR HA . 25168 1
651 . 1 1 67 67 THR HB H 1 4.422 0.003 . 1 . . 1018 . . 67 THR HB . 25168 1
652 . 1 1 67 67 THR HG21 H 1 1.345 0.004 . 1 . . 733 . . 67 THR HG21 . 25168 1
653 . 1 1 67 67 THR HG22 H 1 1.345 0.004 . 1 . . 733 . . 67 THR HG22 . 25168 1
654 . 1 1 67 67 THR HG23 H 1 1.345 0.004 . 1 . . 733 . . 67 THR HG23 . 25168 1
655 . 1 1 67 67 THR C C 13 175.478 0.013 . 1 . . 213 . . 67 THR C . 25168 1
656 . 1 1 67 67 THR CA C 13 63.019 0.065 . 1 . . 212 . . 67 THR CA . 25168 1
657 . 1 1 67 67 THR CB C 13 68.967 0.072 . 1 . . 211 . . 67 THR CB . 25168 1
658 . 1 1 67 67 THR CG2 C 13 21.570 0.075 . 1 . . 539 . . 67 THR CG2 . 25168 1
659 . 1 1 67 67 THR N N 15 110.725 0.022 . 1 . . 209 . . 67 THR N . 25168 1
660 . 1 1 68 68 ASP H H 1 8.054 0.001 . 1 . . 56 . . 68 ASP H . 25168 1
661 . 1 1 68 68 ASP HA H 1 5.097 0.003 . 1 . . 735 . . 68 ASP HA . 25168 1
662 . 1 1 68 68 ASP HB2 H 1 2.743 0.003 . 2 . . 736 . . 68 ASP HB2 . 25168 1
663 . 1 1 68 68 ASP HB3 H 1 3.589 0.005 . 2 . . 737 . . 68 ASP HB3 . 25168 1
664 . 1 1 68 68 ASP C C 13 173.578 0.038 . 1 . . 207 . . 68 ASP C . 25168 1
665 . 1 1 68 68 ASP CA C 13 52.550 0.114 . 1 . . 208 . . 68 ASP CA . 25168 1
666 . 1 1 68 68 ASP CB C 13 39.227 0.065 . 1 . . 206 . . 68 ASP CB . 25168 1
667 . 1 1 68 68 ASP N N 15 123.801 0.032 . 1 . . 55 . . 68 ASP N . 25168 1
668 . 1 1 69 69 SER H H 1 7.351 0.002 . 1 . . 15 . . 69 SER H . 25168 1
669 . 1 1 69 69 SER HA H 1 5.025 0.001 . 1 . . 917 . . 69 SER HA . 25168 1
670 . 1 1 69 69 SER HB2 H 1 3.801 0.001 . 2 . . 738 . . 69 SER HB2 . 25168 1
671 . 1 1 69 69 SER HB3 H 1 4.218 0.001 . 2 . . 919 . . 69 SER HB3 . 25168 1
672 . 1 1 69 69 SER C C 13 173.477 0.012 . 1 . . 375 . . 69 SER C . 25168 1
673 . 1 1 69 69 SER CA C 13 55.922 0.029 . 1 . . 918 . . 69 SER CA . 25168 1
674 . 1 1 69 69 SER CB C 13 66.871 0.019 . 1 . . 376 . . 69 SER CB . 25168 1
675 . 1 1 69 69 SER N N 15 114.146 0.018 . 1 . . 14 . . 69 SER N . 25168 1
676 . 1 1 70 70 LEU H H 1 8.467 0.002 . 1 . . 371 . . 70 LEU H . 25168 1
677 . 1 1 70 70 LEU HA H 1 4.584 0.004 . 1 . . 739 . . 70 LEU HA . 25168 1
678 . 1 1 70 70 LEU HB2 H 1 0.734 0.022 . 2 . . 741 . . 70 LEU HB2 . 25168 1
679 . 1 1 70 70 LEU HB3 H 1 0.457 0.006 . 2 . . 920 . . 70 LEU HB3 . 25168 1
680 . 1 1 70 70 LEU HG H 1 0.335 0.008 . 1 . . 921 . . 70 LEU HG . 25168 1
681 . 1 1 70 70 LEU HD11 H 1 -0.420 0.007 . 1 . . 922 . . 70 LEU HD11 . 25168 1
682 . 1 1 70 70 LEU HD12 H 1 -0.420 0.007 . 1 . . 922 . . 70 LEU HD12 . 25168 1
683 . 1 1 70 70 LEU HD13 H 1 -0.420 0.007 . 1 . . 922 . . 70 LEU HD13 . 25168 1
684 . 1 1 70 70 LEU C C 13 173.775 0.007 . 1 . . 373 . . 70 LEU C . 25168 1
685 . 1 1 70 70 LEU CA C 13 54.817 0.034 . 1 . . 374 . . 70 LEU CA . 25168 1
686 . 1 1 70 70 LEU CB C 13 41.308 0.06 . 1 . . 372 . . 70 LEU CB . 25168 1
687 . 1 1 70 70 LEU CG C 13 26.020 0.059 . 1 . . 540 . . 70 LEU CG . 25168 1
688 . 1 1 70 70 LEU CD1 C 13 20.289 0.059 . 1 . . 996 . . 70 LEU CD1 . 25168 1
689 . 1 1 70 70 LEU N N 15 123.509 0.042 . 1 . . 370 . . 70 LEU N . 25168 1
690 . 1 1 71 71 GLN H H 1 8.656 0.001 . 1 . . 367 . . 71 GLN H . 25168 1
691 . 1 1 71 71 GLN HA H 1 5.402 0.003 . 1 . . 742 . . 71 GLN HA . 25168 1
692 . 1 1 71 71 GLN HB2 H 1 2.114 0.005 . 2 . . 1024 . . 71 GLN HB2 . 25168 1
693 . 1 1 71 71 GLN HB3 H 1 2.292 0.005 . 2 . . 1022 . . 71 GLN HB3 . 25168 1
694 . 1 1 71 71 GLN HG2 H 1 2.465 0.014 . 2 . . 1019 . . 71 GLN HG2 . 25168 1
695 . 1 1 71 71 GLN HG3 H 1 2.479 0.008 . 2 . . 1021 . . 71 GLN HG3 . 25168 1
696 . 1 1 71 71 GLN C C 13 173.755 0.02 . 1 . . 369 . . 71 GLN C . 25168 1
697 . 1 1 71 71 GLN CA C 13 53.547 0.134 . 1 . . 368 . . 71 GLN CA . 25168 1
698 . 1 1 71 71 GLN CB C 13 31.579 0.04 . 1 . . 1020 . . 71 GLN CB . 25168 1
699 . 1 1 71 71 GLN CG C 13 33.787 0.071 . 1 . . 1023 . . 71 GLN CG . 25168 1
700 . 1 1 71 71 GLN N N 15 127.174 0.022 . 1 . . 366 . . 71 GLN N . 25168 1
701 . 1 1 72 72 VAL H H 1 9.336 0.001 . 1 . . 363 . . 72 VAL H . 25168 1
702 . 1 1 72 72 VAL HA H 1 5.337 0.004 . 1 . . 743 . . 72 VAL HA . 25168 1
703 . 1 1 72 72 VAL HB H 1 1.848 0.016 . 1 . . 1105 . . 72 VAL HB . 25168 1
704 . 1 1 72 72 VAL HG11 H 1 0.737 0.007 . 2 . . 1108 . . 72 VAL HG11 . 25168 1
705 . 1 1 72 72 VAL HG12 H 1 0.737 0.007 . 2 . . 1108 . . 72 VAL HG12 . 25168 1
706 . 1 1 72 72 VAL HG13 H 1 0.737 0.007 . 2 . . 1108 . . 72 VAL HG13 . 25168 1
707 . 1 1 72 72 VAL HG21 H 1 0.994 0.005 . 2 . . 1109 . . 72 VAL HG21 . 25168 1
708 . 1 1 72 72 VAL HG22 H 1 0.994 0.005 . 2 . . 1109 . . 72 VAL HG22 . 25168 1
709 . 1 1 72 72 VAL HG23 H 1 0.994 0.005 . 2 . . 1109 . . 72 VAL HG23 . 25168 1
710 . 1 1 72 72 VAL C C 13 173.714 0.007 . 1 . . 364 . . 72 VAL C . 25168 1
711 . 1 1 72 72 VAL CA C 13 60.067 0.065 . 1 . . 365 . . 72 VAL CA . 25168 1
712 . 1 1 72 72 VAL CB C 13 35.279 0.136 . 1 . . 1025 . . 72 VAL CB . 25168 1
713 . 1 1 72 72 VAL CG1 C 13 20.391 0.033 . 2 . . 1106 . . 72 VAL CG1 . 25168 1
714 . 1 1 72 72 VAL CG2 C 13 21.943 0.073 . 2 . . 1107 . . 72 VAL CG2 . 25168 1
715 . 1 1 72 72 VAL N N 15 122.789 0.038 . 1 . . 362 . . 72 VAL N . 25168 1
716 . 1 1 73 73 ALA H H 1 9.449 0.002 . 1 . . 358 . . 73 ALA H . 25168 1
717 . 1 1 73 73 ALA HA H 1 5.598 0.003 . 1 . . 744 . . 73 ALA HA . 25168 1
718 . 1 1 73 73 ALA HB1 H 1 1.568 0.003 . 1 . . 745 . . 73 ALA HB1 . 25168 1
719 . 1 1 73 73 ALA HB2 H 1 1.568 0.003 . 1 . . 745 . . 73 ALA HB2 . 25168 1
720 . 1 1 73 73 ALA HB3 H 1 1.568 0.003 . 1 . . 745 . . 73 ALA HB3 . 25168 1
721 . 1 1 73 73 ALA C C 13 176.557 0.008 . 1 . . 360 . . 73 ALA C . 25168 1
722 . 1 1 73 73 ALA CA C 13 50.251 0.075 . 1 . . 361 . . 73 ALA CA . 25168 1
723 . 1 1 73 73 ALA CB C 13 21.667 0.028 . 1 . . 359 . . 73 ALA CB . 25168 1
724 . 1 1 73 73 ALA N N 15 128.740 0.021 . 1 . . 357 . . 73 ALA N . 25168 1
725 . 1 1 74 74 MET H H 1 9.266 0.002 . 1 . . 356 . . 74 MET H . 25168 1
726 . 1 1 74 74 MET HA H 1 5.801 0.004 . 1 . . 746 . . 74 MET HA . 25168 1
727 . 1 1 74 74 MET HB2 H 1 2.152 0.007 . 2 . . 923 . . 74 MET HB2 . 25168 1
728 . 1 1 74 74 MET HB3 H 1 1.977 0.009 . 2 . . 924 . . 74 MET HB3 . 25168 1
729 . 1 1 74 74 MET HG2 H 1 2.481 0.004 . 2 . . 1081 . . 74 MET HG2 . 25168 1
730 . 1 1 74 74 MET HG3 H 1 2.366 0.005 . 2 . . 1083 . . 74 MET HG3 . 25168 1
731 . 1 1 74 74 MET HE1 H 1 1.956 0.006 . 1 . . 1084 . . 74 MET HE1 X 25168 1
732 . 1 1 74 74 MET HE2 H 1 1.956 0.006 . 1 . . 1084 . . 74 MET HE2 X 25168 1
733 . 1 1 74 74 MET HE3 H 1 1.956 0.006 . 1 . . 1084 . . 74 MET HE3 X 25168 1
734 . 1 1 74 74 MET C C 13 174.317 0.019 . 1 . . 389 . . 74 MET C . 25168 1
735 . 1 1 74 74 MET CA C 13 53.988 0.056 . 1 . . 388 . . 74 MET CA . 25168 1
736 . 1 1 74 74 MET CB C 13 38.735 0.088 . 1 . . 1082 . . 74 MET CB . 25168 1
737 . 1 1 74 74 MET CG C 13 32.020 0.039 . 1 . . 530 . . 74 MET CG . 25168 1
738 . 1 1 74 74 MET CE C 13 17.702 0.037 . 1 . . 747 . . 74 MET CE . 25168 1
739 . 1 1 74 74 MET N N 15 117.949 0.025 . 1 . . 355 . . 74 MET N . 25168 1
740 . 1 1 75 75 LYS H H 1 9.313 0.003 . 1 . . 385 . . 75 LYS H . 25168 1
741 . 1 1 75 75 LYS HA H 1 5.408 0.003 . 1 . . 748 . . 75 LYS HA . 25168 1
742 . 1 1 75 75 LYS HB2 H 1 1.771 0.017 . 2 . . 925 . . 75 LYS HB2 . 25168 1
743 . 1 1 75 75 LYS HB3 H 1 1.898 0.006 . 2 . . 926 . . 75 LYS HB3 . 25168 1
744 . 1 1 75 75 LYS HG2 H 1 1.439 0.007 . 2 . . 927 . . 75 LYS HG2 . 25168 1
745 . 1 1 75 75 LYS HG3 H 1 1.570 0.012 . 2 . . 928 . . 75 LYS HG3 . 25168 1
746 . 1 1 75 75 LYS HD2 H 1 1.711 0.001 . 1 . . 1029 . . 75 LYS HD2 . 25168 1
747 . 1 1 75 75 LYS HD3 H 1 1.711 0.001 . 1 . . 1030 . . 75 LYS HD3 . 25168 1
748 . 1 1 75 75 LYS HE2 H 1 2.987 0.012 . 2 . . 1027 . . 75 LYS HE2 . 25168 1
749 . 1 1 75 75 LYS HE3 H 1 2.987 0.012 . 2 . . 1028 . . 75 LYS HE3 . 25168 1
750 . 1 1 75 75 LYS C C 13 174.393 0.011 . 1 . . 387 . . 75 LYS C . 25168 1
751 . 1 1 75 75 LYS CA C 13 54.534 0.04 . 1 . . 386 . . 75 LYS CA . 25168 1
752 . 1 1 75 75 LYS CB C 13 36.727 0.095 . 1 . . 1026 . . 75 LYS CB . 25168 1
753 . 1 1 75 75 LYS CG C 13 23.713 0.053 . 1 . . 542 . . 75 LYS CG . 25168 1
754 . 1 1 75 75 LYS CD C 13 28.591 0.036 . 1 . . 541 . . 75 LYS CD . 25168 1
755 . 1 1 75 75 LYS CE C 13 41.079 0.011 . 1 . . 543 . . 75 LYS CE . 25168 1
756 . 1 1 75 75 LYS N N 15 123.324 0.057 . 1 . . 384 . . 75 LYS N . 25168 1
757 . 1 1 76 76 LYS H H 1 8.925 0.003 . 1 . . 380 . . 76 LYS H . 25168 1
758 . 1 1 76 76 LYS HA H 1 4.290 0.007 . 1 . . 749 . . 76 LYS HA . 25168 1
759 . 1 1 76 76 LYS HB2 H 1 1.711 0.008 . 2 . . 929 . . 76 LYS HB2 . 25168 1
760 . 1 1 76 76 LYS HB3 H 1 1.105 0.006 . 2 . . 930 . . 76 LYS HB3 . 25168 1
761 . 1 1 76 76 LYS HG2 H 1 1.853 0.003 . 2 . . 931 . . 76 LYS HG2 . 25168 1
762 . 1 1 76 76 LYS HG3 H 1 1.302 0.009 . 2 . . 932 . . 76 LYS HG3 . 25168 1
763 . 1 1 76 76 LYS HD2 H 1 1.676 . . 1 . . 1031 . . 76 LYS HD2 X 25168 1
764 . 1 1 76 76 LYS HD3 H 1 1.676 . . 1 . . 1032 . . 76 LYS HD3 X 25168 1
765 . 1 1 76 76 LYS HE2 H 1 3.045 0.013 . 1 . . 750 . . 76 LYS HE2 . 25168 1
766 . 1 1 76 76 LYS HE3 H 1 3.045 0.013 . 1 . . 933 . . 76 LYS HE3 . 25168 1
767 . 1 1 76 76 LYS C C 13 174.426 0.015 . 1 . . 383 . . 76 LYS C . 25168 1
768 . 1 1 76 76 LYS CA C 13 58.058 0.09 . 1 . . 382 . . 76 LYS CA . 25168 1
769 . 1 1 76 76 LYS CB C 13 33.392 0.045 . 1 . . 381 . . 76 LYS CB . 25168 1
770 . 1 1 76 76 LYS CG C 13 24.323 0.067 . 1 . . 546 . . 76 LYS CG . 25168 1
771 . 1 1 76 76 LYS CD C 13 29.909 0.147 . 1 . . 545 . . 76 LYS CD . 25168 1
772 . 1 1 76 76 LYS CE C 13 41.880 0.035 . 1 . . 544 . . 76 LYS CE . 25168 1
773 . 1 1 76 76 LYS N N 15 128.192 0.045 . 1 . . 379 . . 76 LYS N . 25168 1
774 . 1 1 77 77 LEU H H 1 8.432 0.002 . 1 . . 378 . . 77 LEU H . 25168 1
775 . 1 1 77 77 LEU CA C 13 51.891 0.012 . 1 . . 483 . . 77 LEU CA . 25168 1
776 . 1 1 77 77 LEU CB C 13 41.498 . . 1 . . 482 . . 77 LEU CB X 25168 1
777 . 1 1 77 77 LEU N N 15 128.380 0.041 . 1 . . 377 . . 77 LEU N . 25168 1
778 . 1 1 78 78 PRO HA H 1 4.478 0.005 . 1 . . 751 . . 78 PRO HA . 25168 1
779 . 1 1 78 78 PRO HB2 H 1 2.415 0.006 . 2 . . 752 . . 78 PRO HB2 . 25168 1
780 . 1 1 78 78 PRO HB3 H 1 1.828 0.005 . 2 . . 755 . . 78 PRO HB3 . 25168 1
781 . 1 1 78 78 PRO HG2 H 1 2.045 0.021 . 2 . . 1033 . . 78 PRO HG2 . 25168 1
782 . 1 1 78 78 PRO HG3 H 1 2.066 0.01 . 2 . . 1034 . . 78 PRO HG3 . 25168 1
783 . 1 1 78 78 PRO HD2 H 1 3.840 0.005 . 2 . . 753 . . 78 PRO HD2 . 25168 1
784 . 1 1 78 78 PRO HD3 H 1 3.636 0.008 . 2 . . 754 . . 78 PRO HD3 . 25168 1
785 . 1 1 78 78 PRO C C 13 175.892 0.009 . 1 . . 465 . . 78 PRO C . 25168 1
786 . 1 1 78 78 PRO CA C 13 62.821 0.066 . 1 . . 467 . . 78 PRO CA . 25168 1
787 . 1 1 78 78 PRO CB C 13 32.055 0.086 . 1 . . 466 . . 78 PRO CB . 25168 1
788 . 1 1 78 78 PRO CG C 13 27.429 0.074 . 1 . . 548 . . 78 PRO CG . 25168 1
789 . 1 1 78 78 PRO CD C 13 50.316 0.031 . 1 . . 547 . . 78 PRO CD . 25168 1
790 . 1 1 79 79 ASN H H 1 8.757 0.003 . 1 . . 91 . . 79 ASN H . 25168 1
791 . 1 1 79 79 ASN HA H 1 4.372 0.001 . 1 . . 756 . . 79 ASN HA . 25168 1
792 . 1 1 79 79 ASN HB2 H 1 2.899 0.004 . 1 . . 757 . . 79 ASN HB2 . 25168 1
793 . 1 1 79 79 ASN HB3 H 1 2.899 0.004 . 1 . . 1035 . . 79 ASN HB3 . 25168 1
794 . 1 1 79 79 ASN C C 13 174.653 0.008 . 1 . . 94 . . 79 ASN C . 25168 1
795 . 1 1 79 79 ASN CA C 13 53.469 0.037 . 1 . . 93 . . 79 ASN CA . 25168 1
796 . 1 1 79 79 ASN CB C 13 36.312 0.019 . 1 . . 92 . . 79 ASN CB . 25168 1
797 . 1 1 79 79 ASN N N 15 113.083 0.022 . 1 . . 90 . . 79 ASN N . 25168 1
798 . 1 1 80 80 ASN H H 1 8.672 0.002 . 1 . . 86 . . 80 ASN H . 25168 1
799 . 1 1 80 80 ASN HA H 1 4.437 0.005 . 1 . . 758 . . 80 ASN HA . 25168 1
800 . 1 1 80 80 ASN HB2 H 1 2.938 0.003 . 1 . . 759 . . 80 ASN HB2 . 25168 1
801 . 1 1 80 80 ASN HB3 H 1 2.938 0.003 . 1 . . 760 . . 80 ASN HB3 . 25168 1
802 . 1 1 80 80 ASN C C 13 171.829 0.0 . 1 . . 87 . . 80 ASN C . 25168 1
803 . 1 1 80 80 ASN CA C 13 54.259 0.073 . 1 . . 89 . . 80 ASN CA . 25168 1
804 . 1 1 80 80 ASN CB C 13 36.924 0.034 . 1 . . 88 . . 80 ASN CB . 25168 1
805 . 1 1 80 80 ASN N N 15 111.684 0.016 . 1 . . 85 . . 80 ASN N . 25168 1
806 . 1 1 81 81 ALA H H 1 6.678 0.003 . 1 . . 5 . . 81 ALA H . 25168 1
807 . 1 1 81 81 ALA HA H 1 5.224 0.004 . 1 . . 761 . . 81 ALA HA . 25168 1
808 . 1 1 81 81 ALA HB1 H 1 1.349 0.004 . 1 . . 762 . . 81 ALA HB1 . 25168 1
809 . 1 1 81 81 ALA HB2 H 1 1.349 0.004 . 1 . . 762 . . 81 ALA HB2 . 25168 1
810 . 1 1 81 81 ALA HB3 H 1 1.349 0.004 . 1 . . 762 . . 81 ALA HB3 . 25168 1
811 . 1 1 81 81 ALA C C 13 177.085 0.009 . 1 . . 82 . . 81 ALA C . 25168 1
812 . 1 1 81 81 ALA CA C 13 50.443 0.044 . 1 . . 83 . . 81 ALA CA . 25168 1
813 . 1 1 81 81 ALA CB C 13 21.829 0.031 . 1 . . 84 . . 81 ALA CB . 25168 1
814 . 1 1 81 81 ALA N N 15 116.181 0.016 . 1 . . 4 . . 81 ALA N . 25168 1
815 . 1 1 82 82 THR H H 1 9.107 0.001 . 1 . . 79 . . 82 THR H . 25168 1
816 . 1 1 82 82 THR HA H 1 5.159 0.002 . 1 . . 764 . . 82 THR HA . 25168 1
817 . 1 1 82 82 THR HB H 1 3.942 0.005 . 1 . . 1037 . . 82 THR HB . 25168 1
818 . 1 1 82 82 THR HG21 H 1 1.273 0.003 . 1 . . 763 . . 82 THR HG21 . 25168 1
819 . 1 1 82 82 THR HG22 H 1 1.273 0.003 . 1 . . 763 . . 82 THR HG22 . 25168 1
820 . 1 1 82 82 THR HG23 H 1 1.273 0.003 . 1 . . 763 . . 82 THR HG23 . 25168 1
821 . 1 1 82 82 THR C C 13 172.832 0.005 . 1 . . 81 . . 82 THR C . 25168 1
822 . 1 1 82 82 THR CA C 13 62.805 0.107 . 1 . . 1036 . . 82 THR CA . 25168 1
823 . 1 1 82 82 THR CB C 13 72.941 0.111 . 1 . . 80 . . 82 THR CB . 25168 1
824 . 1 1 82 82 THR CG2 C 13 21.325 0.03 . 1 . . 553 . . 82 THR CG2 . 25168 1
825 . 1 1 82 82 THR N N 15 115.533 0.012 . 1 . . 78 . . 82 THR N . 25168 1
826 . 1 1 83 83 ARG H H 1 9.379 0.002 . 1 . . 75 . . 83 ARG H . 25168 1
827 . 1 1 83 83 ARG HA H 1 5.118 0.005 . 1 . . 765 . . 83 ARG HA . 25168 1
828 . 1 1 83 83 ARG HB2 H 1 1.813 0.008 . 2 . . 768 . . 83 ARG HB2 . 25168 1
829 . 1 1 83 83 ARG HB3 H 1 2.059 0.004 . 2 . . 1042 . . 83 ARG HB3 . 25168 1
830 . 1 1 83 83 ARG HG2 H 1 1.633 0.005 . 2 . . 1039 . . 83 ARG HG2 . 25168 1
831 . 1 1 83 83 ARG HG3 H 1 1.633 0.004 . 2 . . 1040 . . 83 ARG HG3 . 25168 1
832 . 1 1 83 83 ARG HD2 H 1 3.099 0.004 . 2 . . 766 . . 83 ARG HD2 . 25168 1
833 . 1 1 83 83 ARG HD3 H 1 3.241 0.008 . 2 . . 767 . . 83 ARG HD3 . 25168 1
834 . 1 1 83 83 ARG C C 13 174.528 0.006 . 1 . . 77 . . 83 ARG C . 25168 1
835 . 1 1 83 83 ARG CA C 13 54.926 0.069 . 1 . . 76 . . 83 ARG CA . 25168 1
836 . 1 1 83 83 ARG CB C 13 31.568 0.061 . 1 . . 1038 . . 83 ARG CB . 25168 1
837 . 1 1 83 83 ARG CG C 13 26.547 0.071 . 1 . . 549 . . 83 ARG CG . 25168 1
838 . 1 1 83 83 ARG CD C 13 43.631 0.108 . 1 . . 1041 . . 83 ARG CD . 25168 1
839 . 1 1 83 83 ARG N N 15 128.325 0.025 . 1 . . 74 . . 83 ARG N . 25168 1
840 . 1 1 84 84 ILE H H 1 9.714 0.002 . 1 . . 70 . . 84 ILE H . 25168 1
841 . 1 1 84 84 ILE HA H 1 5.471 0.006 . 1 . . 769 . . 84 ILE HA . 25168 1
842 . 1 1 84 84 ILE HB H 1 1.520 0.004 . 1 . . 770 . . 84 ILE HB . 25168 1
843 . 1 1 84 84 ILE HG12 H 1 1.051 0.015 . 2 . . 771 . . 84 ILE HG12 . 25168 1
844 . 1 1 84 84 ILE HG13 H 1 1.720 0.004 . 2 . . 772 . . 84 ILE HG13 . 25168 1
845 . 1 1 84 84 ILE HG21 H 1 1.062 0.015 . 1 . . 773 . . 84 ILE HG21 . 25168 1
846 . 1 1 84 84 ILE HG22 H 1 1.062 0.015 . 1 . . 773 . . 84 ILE HG22 . 25168 1
847 . 1 1 84 84 ILE HG23 H 1 1.062 0.015 . 1 . . 773 . . 84 ILE HG23 . 25168 1
848 . 1 1 84 84 ILE HD11 H 1 0.818 0.007 . 1 . . 774 . . 84 ILE HD11 . 25168 1
849 . 1 1 84 84 ILE HD12 H 1 0.818 0.007 . 1 . . 774 . . 84 ILE HD12 . 25168 1
850 . 1 1 84 84 ILE HD13 H 1 0.818 0.007 . 1 . . 774 . . 84 ILE HD13 . 25168 1
851 . 1 1 84 84 ILE C C 13 170.960 0.006 . 1 . . 71 . . 84 ILE C . 25168 1
852 . 1 1 84 84 ILE CA C 13 59.067 0.042 . 1 . . 72 . . 84 ILE CA . 25168 1
853 . 1 1 84 84 ILE CB C 13 43.010 0.065 . 1 . . 73 . . 84 ILE CB . 25168 1
854 . 1 1 84 84 ILE CG1 C 13 29.372 0.065 . 1 . . 550 . . 84 ILE CG1 . 25168 1
855 . 1 1 84 84 ILE CG2 C 13 15.764 0.08 . 1 . . 551 . . 84 ILE CG2 . 25168 1
856 . 1 1 84 84 ILE CD1 C 13 14.632 0.124 . 1 . . 552 . . 84 ILE CD1 . 25168 1
857 . 1 1 84 84 ILE N N 15 129.260 0.046 . 1 . . 69 . . 84 ILE N . 25168 1
858 . 1 1 85 85 SER H H 1 9.203 0.003 . 1 . . 65 . . 85 SER H . 25168 1
859 . 1 1 85 85 SER HA H 1 5.814 0.002 . 1 . . 934 . . 85 SER HA . 25168 1
860 . 1 1 85 85 SER HB2 H 1 3.766 0.006 . 1 . . 832 . . 85 SER HB2 . 25168 1
861 . 1 1 85 85 SER HB3 H 1 3.766 0.006 . 1 . . 833 . . 85 SER HB3 . 25168 1
862 . 1 1 85 85 SER C C 13 174.171 0.008 . 1 . . 68 . . 85 SER C . 25168 1
863 . 1 1 85 85 SER CA C 13 55.473 0.025 . 1 . . 66 . . 85 SER CA . 25168 1
864 . 1 1 85 85 SER CB C 13 64.665 0.055 . 1 . . 67 . . 85 SER CB . 25168 1
865 . 1 1 85 85 SER N N 15 120.020 0.03 . 1 . . 64 . . 85 SER N . 25168 1
866 . 1 1 86 86 ILE H H 1 9.824 0.002 . 1 . . 3 . . 86 ILE H . 25168 1
867 . 1 1 86 86 ILE HA H 1 4.860 0.007 . 1 . . 837 . . 86 ILE HA . 25168 1
868 . 1 1 86 86 ILE HB H 1 1.988 0.008 . 1 . . 943 . . 86 ILE HB . 25168 1
869 . 1 1 86 86 ILE HG12 H 1 1.827 0.008 . 2 . . 944 . . 86 ILE HG12 . 25168 1
870 . 1 1 86 86 ILE HG13 H 1 1.088 0.029 . 2 . . 945 . . 86 ILE HG13 . 25168 1
871 . 1 1 86 86 ILE HG21 H 1 0.927 0.006 . 1 . . 942 . . 86 ILE HG21 . 25168 1
872 . 1 1 86 86 ILE HG22 H 1 0.927 0.006 . 1 . . 942 . . 86 ILE HG22 . 25168 1
873 . 1 1 86 86 ILE HG23 H 1 0.927 0.006 . 1 . . 942 . . 86 ILE HG23 . 25168 1
874 . 1 1 86 86 ILE HD11 H 1 1.066 0.007 . 1 . . 941 . . 86 ILE HD11 . 25168 1
875 . 1 1 86 86 ILE HD12 H 1 1.066 0.007 . 1 . . 941 . . 86 ILE HD12 . 25168 1
876 . 1 1 86 86 ILE HD13 H 1 1.066 0.007 . 1 . . 941 . . 86 ILE HD13 . 25168 1
877 . 1 1 86 86 ILE C C 13 174.663 0.005 . 1 . . 258 . . 86 ILE C . 25168 1
878 . 1 1 86 86 ILE CA C 13 60.277 0.052 . 1 . . 259 . . 86 ILE CA . 25168 1
879 . 1 1 86 86 ILE CB C 13 43.434 0.059 . 1 . . 831 . . 86 ILE CB . 25168 1
880 . 1 1 86 86 ILE CG1 C 13 27.952 0.101 . 1 . . 834 . . 86 ILE CG1 . 25168 1
881 . 1 1 86 86 ILE CG2 C 13 19.161 0.156 . 1 . . 835 . . 86 ILE CG2 . 25168 1
882 . 1 1 86 86 ILE CD1 C 13 15.139 0.089 . 1 . . 836 . . 86 ILE CD1 . 25168 1
883 . 1 1 86 86 ILE N N 15 125.960 0.033 . 1 . . 2 . . 86 ILE N . 25168 1
884 . 1 1 87 87 LYS H H 1 9.250 0.002 . 1 . . 255 . . 87 LYS H . 25168 1
885 . 1 1 87 87 LYS HA H 1 5.160 0.006 . 1 . . 843 . . 87 LYS HA . 25168 1
886 . 1 1 87 87 LYS HB2 H 1 1.406 0.0 . 2 . . 844 . . 87 LYS HB2 . 25168 1
887 . 1 1 87 87 LYS HB3 H 1 0.675 0.008 . 2 . . 935 . . 87 LYS HB3 . 25168 1
888 . 1 1 87 87 LYS HG2 H 1 1.039 0.004 . 2 . . 937 . . 87 LYS HG2 . 25168 1
889 . 1 1 87 87 LYS HG3 H 1 0.872 0.042 . 2 . . 938 . . 87 LYS HG3 . 25168 1
890 . 1 1 87 87 LYS HD2 H 1 0.527 0.004 . 2 . . 997 . . 87 LYS HD2 . 25168 1
891 . 1 1 87 87 LYS HD3 H 1 0.939 0.007 . 2 . . 998 . . 87 LYS HD3 . 25168 1
892 . 1 1 87 87 LYS HE2 H 1 2.327 0.004 . 2 . . 939 . . 87 LYS HE2 . 25168 1
893 . 1 1 87 87 LYS HE3 H 1 2.752 0.007 . 2 . . 940 . . 87 LYS HE3 . 25168 1
894 . 1 1 87 87 LYS C C 13 175.983 . . 1 . . 848 . . 87 LYS C X 25168 1
895 . 1 1 87 87 LYS CA C 13 55.419 0.039 . 1 . . 256 . . 87 LYS CA . 25168 1
896 . 1 1 87 87 LYS CB C 13 35.704 0.048 . 1 . . 257 . . 87 LYS CB . 25168 1
897 . 1 1 87 87 LYS CG C 13 24.052 0.088 . 1 . . 842 . . 87 LYS CG . 25168 1
898 . 1 1 87 87 LYS CD C 13 29.124 0.046 . 1 . . 846 . . 87 LYS CD . 25168 1
899 . 1 1 87 87 LYS CE C 13 42.300 0.097 . 1 . . 841 . . 87 LYS CE . 25168 1
900 . 1 1 87 87 LYS N N 15 127.158 0.026 . 1 . . 254 . . 87 LYS N . 25168 1
901 . 1 1 88 88 TYR H H 1 7.947 0.003 . 1 . . 43 . . 88 TYR H . 25168 1
902 . 1 1 88 88 TYR HA H 1 5.063 0.003 . 1 . . 852 . . 88 TYR HA . 25168 1
903 . 1 1 88 88 TYR HB2 H 1 3.162 0.004 . 2 . . 853 . . 88 TYR HB2 . 25168 1
904 . 1 1 88 88 TYR HB3 H 1 2.622 0.01 . 2 . . 854 . . 88 TYR HB3 . 25168 1
905 . 1 1 88 88 TYR C C 13 175.948 0.014 . 1 . . 847 . . 88 TYR C . 25168 1
906 . 1 1 88 88 TYR CA C 13 58.001 0.044 . 1 . . 459 . . 88 TYR CA . 25168 1
907 . 1 1 88 88 TYR CB C 13 40.814 0.051 . 1 . . 458 . . 88 TYR CB . 25168 1
908 . 1 1 88 88 TYR N N 15 129.652 0.033 . 1 . . 42 . . 88 TYR N . 25168 1
909 . 1 1 89 89 GLY H H 1 8.486 0.004 . 1 . . 404 . . 89 GLY H . 25168 1
910 . 1 1 89 89 GLY HA2 H 1 4.183 0.006 . 2 . . 775 . . 89 GLY HA2 . 25168 1
911 . 1 1 89 89 GLY HA3 H 1 4.471 0.003 . 2 . . 776 . . 89 GLY HA3 . 25168 1
912 . 1 1 89 89 GLY C C 13 172.923 0.003 . 1 . . 405 . . 89 GLY C . 25168 1
913 . 1 1 89 89 GLY CA C 13 44.520 0.025 . 1 . . 406 . . 89 GLY CA . 25168 1
914 . 1 1 89 89 GLY N N 15 109.310 0.034 . 1 . . 403 . . 89 GLY N . 25168 1
915 . 1 1 90 90 SER H H 1 8.863 0.003 . 1 . . 402 . . 90 SER H . 25168 1
916 . 1 1 90 90 SER HA H 1 4.339 0.003 . 1 . . 1044 . . 90 SER HA . 25168 1
917 . 1 1 90 90 SER HB2 H 1 3.988 0.008 . 1 . . 947 . . 90 SER HB2 . 25168 1
918 . 1 1 90 90 SER HB3 H 1 3.988 0.008 . 1 . . 948 . . 90 SER HB3 . 25168 1
919 . 1 1 90 90 SER C C 13 176.993 . . 1 . . 469 . . 90 SER C X 25168 1
920 . 1 1 90 90 SER CA C 13 60.205 0.057 . 1 . . 946 . . 90 SER CA . 25168 1
921 . 1 1 90 90 SER CB C 13 62.993 0.055 . 1 . . 1043 . . 90 SER CB . 25168 1
922 . 1 1 90 90 SER N N 15 113.119 0.02 . 1 . . 401 . . 90 SER N . 25168 1
923 . 1 1 91 91 GLN H H 1 8.825 0.004 . 1 . . 179 . . 91 GLN H . 25168 1
924 . 1 1 91 91 GLN HA H 1 4.613 0.001 . 1 . . 1046 . . 91 GLN HA . 25168 1
925 . 1 1 91 91 GLN HB2 H 1 2.413 0.002 . 2 . . 1045 . . 91 GLN HB2 . 25168 1
926 . 1 1 91 91 GLN HB3 H 1 2.148 0.006 . 2 . . 1047 . . 91 GLN HB3 . 25168 1
927 . 1 1 91 91 GLN HG2 H 1 2.482 0.006 . 1 . . 1048 . . 91 GLN HG2 . 25168 1
928 . 1 1 91 91 GLN HG3 H 1 2.482 0.006 . 1 . . 1049 . . 91 GLN HG3 . 25168 1
929 . 1 1 91 91 GLN C C 13 176.641 0.001 . 1 . . 181 . . 91 GLN C . 25168 1
930 . 1 1 91 91 GLN CA C 13 54.921 0.033 . 1 . . 180 . . 91 GLN CA . 25168 1
931 . 1 1 91 91 GLN CB C 13 30.294 0.096 . 1 . . 182 . . 91 GLN CB . 25168 1
932 . 1 1 91 91 GLN CG C 13 33.744 0.083 . 1 . . 554 . . 91 GLN CG . 25168 1
933 . 1 1 91 91 GLN N N 15 116.396 0.077 . 1 . . 178 . . 91 GLN N . 25168 1
934 . 1 1 92 92 GLY H H 1 7.179 0.003 . 1 . . 9 . . 92 GLY H . 25168 1
935 . 1 1 92 92 GLY HA2 H 1 4.055 0.004 . 2 . . 777 . . 92 GLY HA2 . 25168 1
936 . 1 1 92 92 GLY HA3 H 1 5.053 0.002 . 2 . . 778 . . 92 GLY HA3 . 25168 1
937 . 1 1 92 92 GLY C C 13 174.317 0.007 . 1 . . 400 . . 92 GLY C . 25168 1
938 . 1 1 92 92 GLY CA C 13 46.386 0.044 . 1 . . 399 . . 92 GLY CA . 25168 1
939 . 1 1 92 92 GLY N N 15 106.749 0.023 . 1 . . 8 . . 92 GLY N . 25168 1
940 . 1 1 93 93 ASN H H 1 8.839 0.001 . 1 . . 398 . . 93 ASN H . 25168 1
941 . 1 1 93 93 ASN HA H 1 4.037 . . 1 . . 954 . . 93 ASN HA . 25168 1
942 . 1 1 93 93 ASN HB3 H 1 2.140 . . 1 . . 956 . . 93 ASN HB3 . 25168 1
943 . 1 1 93 93 ASN C C 13 176.513 . . 1 . . 490 . . 93 ASN C X 25168 1
944 . 1 1 93 93 ASN CA C 13 54.389 0.012 . 1 . . 952 . . 93 ASN CA . 25168 1
945 . 1 1 93 93 ASN CB C 13 39.992 . . 1 . . 504 . . 93 ASN CB . 25168 1
946 . 1 1 93 93 ASN N N 15 114.014 0.025 . 1 . . 397 . . 93 ASN N . 25168 1
947 . 1 1 95 95 ILE H H 1 7.827 0.002 . 1 . . 228 . . 95 ILE H . 25168 1
948 . 1 1 95 95 ILE HA H 1 3.772 0.003 . 1 . . 779 . . 95 ILE HA . 25168 1
949 . 1 1 95 95 ILE HB H 1 1.978 0.005 . 1 . . 1051 . . 95 ILE HB . 25168 1
950 . 1 1 95 95 ILE HG12 H 1 1.612 0.01 . 2 . . 780 . . 95 ILE HG12 . 25168 1
951 . 1 1 95 95 ILE HG13 H 1 1.232 0.008 . 2 . . 781 . . 95 ILE HG13 . 25168 1
952 . 1 1 95 95 ILE HG21 H 1 0.891 0.006 . 1 . . 782 . . 95 ILE HG21 . 25168 1
953 . 1 1 95 95 ILE HG22 H 1 0.891 0.006 . 1 . . 782 . . 95 ILE HG22 . 25168 1
954 . 1 1 95 95 ILE HG23 H 1 0.891 0.006 . 1 . . 782 . . 95 ILE HG23 . 25168 1
955 . 1 1 95 95 ILE HD11 H 1 0.898 0.008 . 1 . . 783 . . 95 ILE HD11 . 25168 1
956 . 1 1 95 95 ILE HD12 H 1 0.898 0.008 . 1 . . 783 . . 95 ILE HD12 . 25168 1
957 . 1 1 95 95 ILE HD13 H 1 0.898 0.008 . 1 . . 783 . . 95 ILE HD13 . 25168 1
958 . 1 1 95 95 ILE C C 13 179.216 0.011 . 1 . . 231 . . 95 ILE C . 25168 1
959 . 1 1 95 95 ILE CA C 13 64.279 0.05 . 1 . . 232 . . 95 ILE CA . 25168 1
960 . 1 1 95 95 ILE CB C 13 37.079 0.09 . 1 . . 230 . . 95 ILE CB . 25168 1
961 . 1 1 95 95 ILE CG1 C 13 28.553 0.052 . 1 . . 1050 . . 95 ILE CG1 . 25168 1
962 . 1 1 95 95 ILE CG2 C 13 16.724 0.096 . 1 . . 555 . . 95 ILE CG2 . 25168 1
963 . 1 1 95 95 ILE CD1 C 13 12.148 0.051 . 1 . . 556 . . 95 ILE CD1 . 25168 1
964 . 1 1 95 95 ILE N N 15 123.346 0.01 . 1 . . 229 . . 95 ILE N . 25168 1
965 . 1 1 96 96 ARG H H 1 8.059 0.001 . 1 . . 58 . . 96 ARG H . 25168 1
966 . 1 1 96 96 ARG HA H 1 3.873 0.003 . 1 . . 784 . . 96 ARG HA . 25168 1
967 . 1 1 96 96 ARG HB2 H 1 0.876 0.026 . 1 . . 973 . . 96 ARG HB2 . 25168 1
968 . 1 1 96 96 ARG HG2 H 1 1.146 0.013 . 2 . . 785 . . 96 ARG HG2 . 25168 1
969 . 1 1 96 96 ARG HG3 H 1 1.492 0.005 . 2 . . 786 . . 96 ARG HG3 . 25168 1
970 . 1 1 96 96 ARG HD2 H 1 2.938 0.003 . 2 . . 974 . . 96 ARG HD2 . 25168 1
971 . 1 1 96 96 ARG HD3 H 1 2.149 0.0 . 2 . . 975 . . 96 ARG HD3 . 25168 1
972 . 1 1 96 96 ARG C C 13 179.366 0.012 . 1 . . 227 . . 96 ARG C . 25168 1
973 . 1 1 96 96 ARG CA C 13 58.823 0.042 . 1 . . 226 . . 96 ARG CA . 25168 1
974 . 1 1 96 96 ARG CB C 13 30.032 0.069 . 1 . . 225 . . 96 ARG CB . 25168 1
975 . 1 1 96 96 ARG CG C 13 27.006 0.118 . 1 . . 999 . . 96 ARG CG . 25168 1
976 . 1 1 96 96 ARG CD C 13 43.138 0.011 . 1 . . 787 . . 96 ARG CD . 25168 1
977 . 1 1 96 96 ARG N N 15 118.992 0.021 . 1 . . 57 . . 96 ARG N . 25168 1
978 . 1 1 97 97 SER H H 1 7.790 0.002 . 1 . . 27 . . 97 SER H . 25168 1
979 . 1 1 97 97 SER C C 13 174.059 0.012 . 1 . . 968 . . 97 SER C . 25168 1
980 . 1 1 97 97 SER CA C 13 63.293 0.07 . 1 . . 971 . . 97 SER CA . 25168 1
981 . 1 1 97 97 SER N N 15 114.751 0.023 . 1 . . 26 . . 97 SER N . 25168 1
982 . 1 1 98 98 SER H H 1 7.851 0.001 . 1 . . 38 . . 98 SER H . 25168 1
983 . 1 1 98 98 SER C C 13 177.846 . . 1 . . 451 . . 98 SER C X 25168 1
984 . 1 1 98 98 SER CA C 13 60.841 0.058 . 1 . . 505 . . 98 SER CA . 25168 1
985 . 1 1 98 98 SER CB C 13 61.823 0.014 . 1 . . 454 . . 98 SER CB . 25168 1
986 . 1 1 98 98 SER N N 15 115.275 0.032 . 1 . . 37 . . 98 SER N . 25168 1
987 . 1 1 99 99 ALA H H 1 7.815 0.002 . 1 . . 36 . . 99 ALA H . 25168 1
988 . 1 1 99 99 ALA HA H 1 4.242 0.002 . 1 . . 788 . . 99 ALA HA . 25168 1
989 . 1 1 99 99 ALA HB1 H 1 1.498 0.005 . 1 . . 789 . . 99 ALA HB1 . 25168 1
990 . 1 1 99 99 ALA HB2 H 1 1.498 0.005 . 1 . . 789 . . 99 ALA HB2 . 25168 1
991 . 1 1 99 99 ALA HB3 H 1 1.498 0.005 . 1 . . 789 . . 99 ALA HB3 . 25168 1
992 . 1 1 99 99 ALA C C 13 180.557 0.011 . 1 . . 222 . . 99 ALA C . 25168 1
993 . 1 1 99 99 ALA CA C 13 54.421 0.027 . 1 . . 224 . . 99 ALA CA . 25168 1
994 . 1 1 99 99 ALA CB C 13 17.340 0.013 . 1 . . 223 . . 99 ALA CB . 25168 1
995 . 1 1 99 99 ALA N N 15 123.483 0.025 . 1 . . 35 . . 99 ALA N . 25168 1
996 . 1 1 100 100 LEU H H 1 8.023 0.002 . 1 . . 54 . . 100 LEU H . 25168 1
997 . 1 1 100 100 LEU HA H 1 4.239 0.002 . 1 . . 790 . . 100 LEU HA . 25168 1
998 . 1 1 100 100 LEU HB2 H 1 2.332 0.005 . 2 . . 1111 . . 100 LEU HB2 . 25168 1
999 . 1 1 100 100 LEU HB3 H 1 2.099 0.005 . 2 . . 1112 . . 100 LEU HB3 . 25168 1
1000 . 1 1 100 100 LEU HG H 1 1.728 0.003 . 1 . . 1114 . . 100 LEU HG . 25168 1
1001 . 1 1 100 100 LEU HD11 H 1 0.925 0.011 . 2 . . 1116 . . 100 LEU HD11 . 25168 1
1002 . 1 1 100 100 LEU HD12 H 1 0.925 0.011 . 2 . . 1116 . . 100 LEU HD12 . 25168 1
1003 . 1 1 100 100 LEU HD13 H 1 0.925 0.011 . 2 . . 1116 . . 100 LEU HD13 . 25168 1
1004 . 1 1 100 100 LEU HD21 H 1 0.972 0.014 . 2 . . 1117 . . 100 LEU HD21 . 25168 1
1005 . 1 1 100 100 LEU HD22 H 1 0.972 0.014 . 2 . . 1117 . . 100 LEU HD22 . 25168 1
1006 . 1 1 100 100 LEU HD23 H 1 0.972 0.014 . 2 . . 1117 . . 100 LEU HD23 . 25168 1
1007 . 1 1 100 100 LEU C C 13 178.334 0.004 . 1 . . 221 . . 100 LEU C . 25168 1
1008 . 1 1 100 100 LEU CA C 13 57.454 0.044 . 1 . . 220 . . 100 LEU CA . 25168 1
1009 . 1 1 100 100 LEU CB C 13 39.638 0.065 . 1 . . 219 . . 100 LEU CB . 25168 1
1010 . 1 1 100 100 LEU CG C 13 26.535 0.108 . 1 . . 1113 . . 100 LEU CG . 25168 1
1011 . 1 1 100 100 LEU CD1 C 13 22.180 0.126 . 2 . . 1115 . . 100 LEU CD1 . 25168 1
1012 . 1 1 100 100 LEU CD2 C 13 25.386 0.055 . 2 . . 1110 . . 100 LEU CD2 . 25168 1
1013 . 1 1 100 100 LEU N N 15 120.477 0.018 . 1 . . 53 . . 100 LEU N . 25168 1
1014 . 1 1 101 101 ILE H H 1 7.754 0.002 . 1 . . 25 . . 101 ILE H . 25168 1
1015 . 1 1 101 101 ILE HA H 1 3.794 0.003 . 1 . . 794 . . 101 ILE HA . 25168 1
1016 . 1 1 101 101 ILE HB H 1 2.471 0.004 . 1 . . 795 . . 101 ILE HB . 25168 1
1017 . 1 1 101 101 ILE HG12 H 1 1.740 0.007 . 2 . . 1053 . . 101 ILE HG12 . 25168 1
1018 . 1 1 101 101 ILE HG13 H 1 1.740 0.007 . 2 . . 1054 . . 101 ILE HG13 . 25168 1
1019 . 1 1 101 101 ILE HG21 H 1 1.071 0.004 . 1 . . 796 . . 101 ILE HG21 . 25168 1
1020 . 1 1 101 101 ILE HG22 H 1 1.071 0.004 . 1 . . 796 . . 101 ILE HG22 . 25168 1
1021 . 1 1 101 101 ILE HG23 H 1 1.071 0.004 . 1 . . 796 . . 101 ILE HG23 . 25168 1
1022 . 1 1 101 101 ILE HD11 H 1 0.872 0.007 . 1 . . 797 . . 101 ILE HD11 . 25168 1
1023 . 1 1 101 101 ILE HD12 H 1 0.872 0.007 . 1 . . 797 . . 101 ILE HD12 . 25168 1
1024 . 1 1 101 101 ILE HD13 H 1 0.872 0.007 . 1 . . 797 . . 101 ILE HD13 . 25168 1
1025 . 1 1 101 101 ILE C C 13 177.429 0.061 . 1 . . 217 . . 101 ILE C . 25168 1
1026 . 1 1 101 101 ILE CA C 13 62.630 0.025 . 1 . . 218 . . 101 ILE CA . 25168 1
1027 . 1 1 101 101 ILE CB C 13 34.612 0.076 . 1 . . 1052 . . 101 ILE CB . 25168 1
1028 . 1 1 101 101 ILE CG1 C 13 27.050 0.106 . 1 . . 791 . . 101 ILE CG1 . 25168 1
1029 . 1 1 101 101 ILE CG2 C 13 17.455 0.054 . 1 . . 792 . . 101 ILE CG2 . 25168 1
1030 . 1 1 101 101 ILE CD1 C 13 10.915 0.052 . 1 . . 793 . . 101 ILE CD1 . 25168 1
1031 . 1 1 101 101 ILE N N 15 118.321 0.033 . 1 . . 24 . . 101 ILE N . 25168 1
1032 . 1 1 102 102 GLY H H 1 7.613 0.003 . 1 . . 21 . . 102 GLY H . 25168 1
1033 . 1 1 102 102 GLY HA2 H 1 3.969 0.004 . 2 . . 798 . . 102 GLY HA2 . 25168 1
1034 . 1 1 102 102 GLY HA3 H 1 4.110 0.001 . 2 . . 799 . . 102 GLY HA3 . 25168 1
1035 . 1 1 102 102 GLY C C 13 177.326 0.01 . 1 . . 241 . . 102 GLY C . 25168 1
1036 . 1 1 102 102 GLY CA C 13 47.111 0.033 . 1 . . 800 . . 102 GLY CA . 25168 1
1037 . 1 1 102 102 GLY N N 15 104.596 0.016 . 1 . . 20 . . 102 GLY N . 25168 1
1038 . 1 1 103 103 ILE H H 1 7.843 0.002 . 1 . . 32 . . 103 ILE H . 25168 1
1039 . 1 1 103 103 ILE HA H 1 3.770 0.006 . 1 . . 1055 . . 103 ILE HA . 25168 1
1040 . 1 1 103 103 ILE HB H 1 2.117 0.006 . 1 . . 1056 . . 103 ILE HB . 25168 1
1041 . 1 1 103 103 ILE HG12 H 1 1.801 0.013 . 2 . . 1057 . . 103 ILE HG12 . 25168 1
1042 . 1 1 103 103 ILE HG13 H 1 1.115 0.006 . 2 . . 1059 . . 103 ILE HG13 . 25168 1
1043 . 1 1 103 103 ILE HG21 H 1 0.799 0.013 . 1 . . 1061 . . 103 ILE HG21 . 25168 1
1044 . 1 1 103 103 ILE HG22 H 1 0.799 0.013 . 1 . . 1061 . . 103 ILE HG22 . 25168 1
1045 . 1 1 103 103 ILE HG23 H 1 0.799 0.013 . 1 . . 1061 . . 103 ILE HG23 . 25168 1
1046 . 1 1 103 103 ILE HD11 H 1 0.790 0.01 . 1 . . 1062 . . 103 ILE HD11 . 25168 1
1047 . 1 1 103 103 ILE HD12 H 1 0.790 0.01 . 1 . . 1062 . . 103 ILE HD12 . 25168 1
1048 . 1 1 103 103 ILE HD13 H 1 0.790 0.01 . 1 . . 1062 . . 103 ILE HD13 . 25168 1
1049 . 1 1 103 103 ILE C C 13 178.275 0.01 . 1 . . 343 . . 103 ILE C . 25168 1
1050 . 1 1 103 103 ILE CA C 13 64.366 0.034 . 1 . . 342 . . 103 ILE CA . 25168 1
1051 . 1 1 103 103 ILE CB C 13 37.932 0.065 . 1 . . 344 . . 103 ILE CB . 25168 1
1052 . 1 1 103 103 ILE CG1 C 13 28.642 0.075 . 1 . . 1060 . . 103 ILE CG1 . 25168 1
1053 . 1 1 103 103 ILE CG2 C 13 17.905 0.086 . 1 . . 1058 . . 103 ILE CG2 . 25168 1
1054 . 1 1 103 103 ILE CD1 C 13 12.789 0.044 . 1 . . 801 . . 103 ILE CD1 . 25168 1
1055 . 1 1 103 103 ILE N N 15 123.909 0.055 . 1 . . 33 . . 103 ILE N . 25168 1
1056 . 1 1 104 104 ILE H H 1 8.785 0.002 . 1 . . 339 . . 104 ILE H . 25168 1
1057 . 1 1 104 104 ILE HA H 1 3.300 0.008 . 1 . . 1064 . . 104 ILE HA . 25168 1
1058 . 1 1 104 104 ILE HB H 1 1.985 0.01 . 1 . . 1070 . . 104 ILE HB . 25168 1
1059 . 1 1 104 104 ILE HG12 H 1 0.820 0.036 . 2 . . 1068 . . 104 ILE HG12 . 25168 1
1060 . 1 1 104 104 ILE HG13 H 1 1.765 0.01 . 2 . . 1069 . . 104 ILE HG13 . 25168 1
1061 . 1 1 104 104 ILE HG21 H 1 0.769 0.014 . 1 . . 1065 . . 104 ILE HG21 . 25168 1
1062 . 1 1 104 104 ILE HG22 H 1 0.769 0.014 . 1 . . 1065 . . 104 ILE HG22 . 25168 1
1063 . 1 1 104 104 ILE HG23 H 1 0.769 0.014 . 1 . . 1065 . . 104 ILE HG23 . 25168 1
1064 . 1 1 104 104 ILE HD11 H 1 0.782 0.018 . 1 . . 1066 . . 104 ILE HD11 . 25168 1
1065 . 1 1 104 104 ILE HD12 H 1 0.782 0.018 . 1 . . 1066 . . 104 ILE HD12 . 25168 1
1066 . 1 1 104 104 ILE HD13 H 1 0.782 0.018 . 1 . . 1066 . . 104 ILE HD13 . 25168 1
1067 . 1 1 104 104 ILE C C 13 177.884 0.007 . 1 . . 341 . . 104 ILE C . 25168 1
1068 . 1 1 104 104 ILE CA C 13 66.476 0.081 . 1 . . 1063 . . 104 ILE CA . 25168 1
1069 . 1 1 104 104 ILE CB C 13 38.293 0.081 . 1 . . 340 . . 104 ILE CB . 25168 1
1070 . 1 1 104 104 ILE CG1 C 13 29.115 0.109 . 1 . . 1067 . . 104 ILE CG1 . 25168 1
1071 . 1 1 104 104 ILE CG2 C 13 16.333 0.018 . 1 . . 804 . . 104 ILE CG2 . 25168 1
1072 . 1 1 104 104 ILE CD1 C 13 15.251 0.063 . 1 . . 805 . . 104 ILE CD1 . 25168 1
1073 . 1 1 104 104 ILE N N 15 121.710 0.029 . 1 . . 338 . . 104 ILE N . 25168 1
1074 . 1 1 105 105 GLU H H 1 9.000 0.001 . 1 . . 337 . . 105 GLU H . 25168 1
1075 . 1 1 105 105 GLU HA H 1 3.708 0.003 . 1 . . 806 . . 105 GLU HA . 25168 1
1076 . 1 1 105 105 GLU HB2 H 1 2.146 0.034 . 2 . . 1071 . . 105 GLU HB2 . 25168 1
1077 . 1 1 105 105 GLU HB3 H 1 2.219 0.016 . 2 . . 1072 . . 105 GLU HB3 . 25168 1
1078 . 1 1 105 105 GLU HG2 H 1 2.615 0.005 . 2 . . 1073 . . 105 GLU HG2 . 25168 1
1079 . 1 1 105 105 GLU HG3 H 1 2.209 0.007 . 2 . . 1074 . . 105 GLU HG3 . 25168 1
1080 . 1 1 105 105 GLU C C 13 179.078 0.009 . 1 . . 415 . . 105 GLU C . 25168 1
1081 . 1 1 105 105 GLU CA C 13 60.626 0.036 . 1 . . 413 . . 105 GLU CA . 25168 1
1082 . 1 1 105 105 GLU CB C 13 29.295 0.029 . 1 . . 414 . . 105 GLU CB . 25168 1
1083 . 1 1 105 105 GLU CG C 13 37.861 0.051 . 1 . . 558 . . 105 GLU CG . 25168 1
1084 . 1 1 105 105 GLU N N 15 117.231 0.025 . 1 . . 336 . . 105 GLU N . 25168 1
1085 . 1 1 106 106 GLY H H 1 8.241 0.002 . 1 . . 412 . . 106 GLY H . 25168 1
1086 . 1 1 106 106 GLY HA2 H 1 3.841 0.001 . 2 . . 810 . . 106 GLY HA2 . 25168 1
1087 . 1 1 106 106 GLY HA3 H 1 4.059 0.005 . 2 . . 811 . . 106 GLY HA3 . 25168 1
1088 . 1 1 106 106 GLY C C 13 176.202 0.008 . 1 . . 428 . . 106 GLY C . 25168 1
1089 . 1 1 106 106 GLY CA C 13 46.954 0.036 . 1 . . 427 . . 106 GLY CA . 25168 1
1090 . 1 1 106 106 GLY N N 15 106.610 0.033 . 1 . . 411 . . 106 GLY N . 25168 1
1091 . 1 1 107 107 ASN H H 1 8.378 0.002 . 1 . . 426 . . 107 ASN H . 25168 1
1092 . 1 1 107 107 ASN HA H 1 4.590 0.005 . 1 . . 812 . . 107 ASN HA . 25168 1
1093 . 1 1 107 107 ASN HB2 H 1 2.902 0.006 . 2 . . 813 . . 107 ASN HB2 . 25168 1
1094 . 1 1 107 107 ASN HB3 H 1 3.182 0.002 . 2 . . 814 . . 107 ASN HB3 . 25168 1
1095 . 1 1 107 107 ASN C C 13 178.607 0.009 . 1 . . 435 . . 107 ASN C . 25168 1
1096 . 1 1 107 107 ASN CA C 13 54.709 0.04 . 1 . . 434 . . 107 ASN CA . 25168 1
1097 . 1 1 107 107 ASN CB C 13 36.966 0.021 . 1 . . 433 . . 107 ASN CB . 25168 1
1098 . 1 1 107 107 ASN N N 15 122.003 0.016 . 1 . . 425 . . 107 ASN N . 25168 1
1099 . 1 1 108 108 ILE H H 1 8.148 0.001 . 1 . . 432 . . 108 ILE H . 25168 1
1100 . 1 1 108 108 ILE HA H 1 3.513 0.003 . 1 . . 815 . . 108 ILE HA . 25168 1
1101 . 1 1 108 108 ILE HB H 1 1.539 0.008 . 1 . . 1087 . . 108 ILE HB . 25168 1
1102 . 1 1 108 108 ILE HG12 H 1 0.459 0.008 . 1 . . 967 . . 108 ILE HG12 . 25168 1
1103 . 1 1 108 108 ILE HG21 H 1 0.205 0.005 . 1 . . 816 . . 108 ILE HG21 . 25168 1
1104 . 1 1 108 108 ILE HG22 H 1 0.205 0.005 . 1 . . 816 . . 108 ILE HG22 . 25168 1
1105 . 1 1 108 108 ILE HG23 H 1 0.205 0.005 . 1 . . 816 . . 108 ILE HG23 . 25168 1
1106 . 1 1 108 108 ILE HD11 H 1 0.247 0.006 . 1 . . 1085 . . 108 ILE HD11 . 25168 1
1107 . 1 1 108 108 ILE HD12 H 1 0.247 0.006 . 1 . . 1085 . . 108 ILE HD12 . 25168 1
1108 . 1 1 108 108 ILE HD13 H 1 0.247 0.006 . 1 . . 1085 . . 108 ILE HD13 . 25168 1
1109 . 1 1 108 108 ILE C C 13 177.542 0.003 . 1 . . 496 . . 108 ILE C . 25168 1
1110 . 1 1 108 108 ILE CA C 13 65.296 0.046 . 1 . . 497 . . 108 ILE CA . 25168 1
1111 . 1 1 108 108 ILE CB C 13 37.762 0.117 . 1 . . 495 . . 108 ILE CB . 25168 1
1112 . 1 1 108 108 ILE CG1 C 13 28.546 0.076 . 1 . . 1086 . . 108 ILE CG1 . 25168 1
1113 . 1 1 108 108 ILE CG2 C 13 15.721 0.035 . 1 . . 561 . . 108 ILE CG2 . 25168 1
1114 . 1 1 108 108 ILE CD1 C 13 14.590 0.025 . 1 . . 560 . . 108 ILE CD1 . 25168 1
1115 . 1 1 108 108 ILE N N 15 123.276 0.027 . 1 . . 431 . . 108 ILE N . 25168 1
1116 . 1 1 109 109 ARG H H 1 8.226 0.003 . 1 . . 502 . . 109 ARG H . 25168 1
1117 . 1 1 109 109 ARG HA H 1 4.053 0.005 . 1 . . 818 . . 109 ARG HA . 25168 1
1118 . 1 1 109 109 ARG HB2 H 1 1.874 0.01 . 2 . . 961 . . 109 ARG HB2 . 25168 1
1119 . 1 1 109 109 ARG HB3 H 1 1.874 0.009 . 2 . . 963 . . 109 ARG HB3 . 25168 1
1120 . 1 1 109 109 ARG HG2 H 1 1.821 0.025 . 2 . . 962 . . 109 ARG HG2 . 25168 1
1121 . 1 1 109 109 ARG HG3 H 1 1.570 0.007 . 2 . . 964 . . 109 ARG HG3 . 25168 1
1122 . 1 1 109 109 ARG HD2 H 1 3.223 0.0 . 2 . . 965 . . 109 ARG HD2 . 25168 1
1123 . 1 1 109 109 ARG HD3 H 1 3.266 0.006 . 2 . . 966 . . 109 ARG HD3 . 25168 1
1124 . 1 1 109 109 ARG CA C 13 59.104 0.046 . 1 . . 819 . . 109 ARG CA . 25168 1
1125 . 1 1 109 109 ARG CB C 13 29.914 0.103 . 1 . . 501 . . 109 ARG CB . 25168 1
1126 . 1 1 109 109 ARG CG C 13 27.503 0.074 . 1 . . 822 . . 109 ARG CG . 25168 1
1127 . 1 1 109 109 ARG CD C 13 43.258 0.043 . 1 . . 559 . . 109 ARG CD . 25168 1
1128 . 1 1 109 109 ARG N N 15 118.348 0.024 . 1 . . 503 . . 109 ARG N . 25168 1
1129 . 1 1 110 110 TYR H H 1 8.228 0.003 . 1 . . 430 . . 110 TYR H . 25168 1
1130 . 1 1 110 110 TYR HA H 1 4.342 0.005 . 1 . . 823 . . 110 TYR HA . 25168 1
1131 . 1 1 110 110 TYR HB2 H 1 3.158 0.006 . 1 . . 959 . . 110 TYR HB2 . 25168 1
1132 . 1 1 110 110 TYR HB3 H 1 3.158 0.006 . 1 . . 960 . . 110 TYR HB3 . 25168 1
1133 . 1 1 110 110 TYR C C 13 177.436 0.011 . 1 . . 455 . . 110 TYR C . 25168 1
1134 . 1 1 110 110 TYR CA C 13 60.348 0.051 . 1 . . 457 . . 110 TYR CA . 25168 1
1135 . 1 1 110 110 TYR CB C 13 37.986 0.158 . 1 . . 456 . . 110 TYR CB . 25168 1
1136 . 1 1 110 110 TYR N N 15 118.273 0.027 . 1 . . 429 . . 110 TYR N . 25168 1
1137 . 1 1 111 111 ALA H H 1 7.934 0.003 . 1 . . 41 . . 111 ALA H . 25168 1
1138 . 1 1 111 111 ALA HA H 1 4.172 0.002 . 1 . . 824 . . 111 ALA HA . 25168 1
1139 . 1 1 111 111 ALA HB1 H 1 1.566 0.004 . 1 . . 825 . . 111 ALA HB1 . 25168 1
1140 . 1 1 111 111 ALA HB2 H 1 1.566 0.004 . 1 . . 825 . . 111 ALA HB2 . 25168 1
1141 . 1 1 111 111 ALA HB3 H 1 1.566 0.004 . 1 . . 825 . . 111 ALA HB3 . 25168 1
1142 . 1 1 111 111 ALA C C 13 178.771 0.006 . 1 . . 240 . . 111 ALA C . 25168 1
1143 . 1 1 111 111 ALA CA C 13 53.963 0.047 . 1 . . 238 . . 111 ALA CA . 25168 1
1144 . 1 1 111 111 ALA CB C 13 18.138 0.054 . 1 . . 239 . . 111 ALA CB . 25168 1
1145 . 1 1 111 111 ALA N N 15 121.606 0.033 . 1 . . 40 . . 111 ALA N . 25168 1
1146 . 1 1 112 112 ASN H H 1 8.214 0.001 . 1 . . 234 . . 112 ASN H . 25168 1
1147 . 1 1 112 112 ASN HA H 1 4.712 0.009 . 1 . . 826 . . 112 ASN HA . 25168 1
1148 . 1 1 112 112 ASN HB2 H 1 2.942 0.005 . 1 . . 827 . . 112 ASN HB2 . 25168 1
1149 . 1 1 112 112 ASN HB3 H 1 2.942 0.005 . 1 . . 828 . . 112 ASN HB3 . 25168 1
1150 . 1 1 112 112 ASN C C 13 176.131 0.005 . 1 . . 237 . . 112 ASN C . 25168 1
1151 . 1 1 112 112 ASN CA C 13 53.868 0.025 . 1 . . 235 . . 112 ASN CA . 25168 1
1152 . 1 1 112 112 ASN CB C 13 38.411 0.041 . 1 . . 236 . . 112 ASN CB . 25168 1
1153 . 1 1 112 112 ASN N N 15 114.676 0.013 . 1 . . 233 . . 112 ASN N . 25168 1
1154 . 1 1 113 113 THR H H 1 7.833 0.002 . 1 . . 31 . . 113 THR H . 25168 1
1155 . 1 1 113 113 THR HA H 1 4.284 0.004 . 1 . . 958 . . 113 THR HA . 25168 1
1156 . 1 1 113 113 THR HB H 1 4.172 0.007 . 1 . . 830 . . 113 THR HB . 25168 1
1157 . 1 1 113 113 THR HG21 H 1 1.142 0.005 . 1 . . 829 . . 113 THR HG21 . 25168 1
1158 . 1 1 113 113 THR HG22 H 1 1.142 0.005 . 1 . . 829 . . 113 THR HG22 . 25168 1
1159 . 1 1 113 113 THR HG23 H 1 1.142 0.005 . 1 . . 829 . . 113 THR HG23 . 25168 1
1160 . 1 1 113 113 THR C C 13 174.344 0.009 . 1 . . 438 . . 113 THR C . 25168 1
1161 . 1 1 113 113 THR CA C 13 62.464 0.045 . 1 . . 439 . . 113 THR CA . 25168 1
1162 . 1 1 113 113 THR CB C 13 69.748 0.138 . 1 . . 440 . . 113 THR CB . 25168 1
1163 . 1 1 113 113 THR CG2 C 13 21.019 0.034 . 1 . . 557 . . 113 THR CG2 . 25168 1
1164 . 1 1 113 113 THR N N 15 111.096 0.037 . 1 . . 30 . . 113 THR N . 25168 1
1165 . 1 1 114 114 HIS H H 1 8.023 0.002 . 1 . . 437 . . 114 HIS H . 25168 1
1166 . 1 1 114 114 HIS C C 13 174.467 . . 1 . . 500 . . 114 HIS C X 25168 1
1167 . 1 1 114 114 HIS CA C 13 56.193 0.029 . 1 . . 499 . . 114 HIS CA . 25168 1
1168 . 1 1 114 114 HIS CB C 13 29.388 . . 1 . . 498 . . 114 HIS CB . 25168 1
1169 . 1 1 114 114 HIS N N 15 119.443 0.034 . 1 . . 436 . . 114 HIS N . 25168 1
1170 . 1 1 115 115 HIS H H 1 8.123 0.001 . 1 . . 63 . . 115 HIS H . 25168 1
1171 . 1 1 115 115 HIS C C 13 179.129 . . 1 . . 463 . . 115 HIS C . 25168 1
1172 . 1 1 115 115 HIS CA C 13 57.098 0.001 . 1 . . 464 . . 115 HIS CA . 25168 1
1173 . 1 1 115 115 HIS N N 15 124.619 0.03 . 1 . . 62 . . 115 HIS N . 25168 1
1174 . 1 1 116 116 HIS H H 1 8.123 . . 1 . . 990 . . 116 HIS H X 25168 1
1175 . 1 1 116 116 HIS N N 15 124.615 . . 1 . . 991 . . 116 HIS N X 25168 1
1176 . 1 1 117 117 HIS H H 1 8.123 . . 1 . . 992 . . 117 HIS H X 25168 1
1177 . 1 1 117 117 HIS N N 15 124.615 . . 1 . . 993 . . 117 HIS N X 25168 1
1178 . 1 1 118 118 HIS H H 1 8.123 . . 1 . . 994 . . 118 HIS H X 25168 1
1179 . 1 1 118 118 HIS N N 15 124.615 . . 1 . . 995 . . 118 HIS N X 25168 1
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