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 18351
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 28
_Assigned_chem_shift_list.Sample_condition_list_label $CondSet1
_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 'T2:1 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
2 'T2:2 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
3 'T2:3 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
4 'T2:4 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
5 'T2:5 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
6 'T2:6 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
7 'T2:7 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
8 'T2:8 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
9 'T2:9 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
10 'T2:10 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
11 'T2:11 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
12 'T2:12 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
13 'T2:13 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
14 'T2:14 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
15 'T2:15 (H[n[T2(N)]])' 1 $13C15N_03 isotropic 18351 1
16 'T1:1 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
17 'T1:2 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
18 'T1:3 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
19 'T1:4 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
20 'T1:5 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
21 'T1:6 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
22 'T1:7 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
23 'T1:8 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
24 'T1:9 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
25 'T1:10 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
26 'T1:11 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
27 'T1:12 (H[n[T1(N)]])' 1 $13C15N_03 isotropic 18351 1
28 'htNOE 1 (H[n[Trho(N)]])' 1 $13C15N_03 isotropic 18351 1
29 'htNOE 2 (H[n[Trho(N)]])' 1 $13C15N_03 isotropic 18351 1
30 '3D 1H-13C NOESY' 2 $13C15N_02 isotropic 18351 1
32 '3D 1H-15N NOESY' 3 $15N isotropic 18351 1
33 '2D 1H-1H NOESY' 4 $unlabeled isotropic 18351 1
34 '3D HNCO' 5 $13C15N_01 isotropic 18351 1
35 'HNcaCO (H[N[ca[CO]]])' 5 $13C15N_01 isotropic 18351 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 PRO HA H 1 4.329 0.002 . 1 . . 512 . . 2 PRO HA . 18351 1
2 . 1 1 2 2 PRO HB2 H 1 2.203 0.002 . 1 . . 645 . . 2 PRO HB2 . 18351 1
3 . 1 1 2 2 PRO HB3 H 1 1.760 0.002 . 1 . . 646 . . 2 PRO HB3 . 18351 1
4 . 1 1 2 2 PRO HG2 H 1 1.918 0.0 . 1 . . 677 . . 2 PRO HG2 . 18351 1
5 . 1 1 2 2 PRO HG3 H 1 1.862 0.002 . 1 . . 676 . . 2 PRO HG3 . 18351 1
6 . 1 1 2 2 PRO HD2 H 1 3.626 0.002 . 1 . . 673 . . 2 PRO HD2 . 18351 1
7 . 1 1 2 2 PRO HD3 H 1 3.497 0.003 . 1 . . 674 . . 2 PRO HD3 . 18351 1
8 . 1 1 2 2 PRO C C 13 176.492 0.014 . 1 . . 271 . . 2 PRO C . 18351 1
9 . 1 1 2 2 PRO CA C 13 63.208 0.0 . 1 . . 460 . . 2 PRO CA . 18351 1
10 . 1 1 2 2 PRO CB C 13 31.990 . . 1 . . 675 . . 2 PRO CB . 18351 1
11 . 1 1 2 2 PRO CG C 13 27.537 0.002 . 1 . . 514 . . 2 PRO CG . 18351 1
12 . 1 1 2 2 PRO CD C 13 50.774 0.005 . 1 . . 513 . . 2 PRO CD . 18351 1
13 . 1 1 3 3 ALA H H 1 8.430 0.005 . 1 . . 98 . . 3 ALA H . 18351 1
14 . 1 1 3 3 ALA HA H 1 4.099 0.003 . 1 . . 334 . . 3 ALA HA . 18351 1
15 . 1 1 3 3 ALA HB1 H 1 1.239 0.002 . 1 . . 335 . . 3 ALA HB1 . 18351 1
16 . 1 1 3 3 ALA HB2 H 1 1.239 0.002 . 1 . . 335 . . 3 ALA HB2 . 18351 1
17 . 1 1 3 3 ALA HB3 H 1 1.239 0.002 . 1 . . 335 . . 3 ALA HB3 . 18351 1
18 . 1 1 3 3 ALA C C 13 177.683 0.007 . 1 . . 284 . . 3 ALA C . 18351 1
19 . 1 1 3 3 ALA CA C 13 52.526 0.0 . 1 . . 154 . . 3 ALA CA . 18351 1
20 . 1 1 3 3 ALA CB C 13 18.987 0.0213 . 1 . . 155 . . 3 ALA CB . 18351 1
21 . 1 1 3 3 ALA N N 15 125.390 0.088 . 1 . . 99 . . 3 ALA N . 18351 1
22 . 1 1 4 4 ALA H H 1 8.270 0.004 . 1 . . 76 . . 4 ALA H . 18351 1
23 . 1 1 4 4 ALA HA H 1 4.122 0.005 . 1 . . 647 . . 4 ALA HA . 18351 1
24 . 1 1 4 4 ALA HB1 H 1 1.231 0.004 . 1 . . 468 . . 4 ALA HB1 . 18351 1
25 . 1 1 4 4 ALA HB2 H 1 1.231 0.004 . 1 . . 468 . . 4 ALA HB2 . 18351 1
26 . 1 1 4 4 ALA HB3 H 1 1.231 0.004 . 1 . . 468 . . 4 ALA HB3 . 18351 1
27 . 1 1 4 4 ALA C C 13 177.893 0.025 . 1 . . 294 . . 4 ALA C . 18351 1
28 . 1 1 4 4 ALA CA C 13 52.505 0.0234 . 1 . . 204 . . 4 ALA CA . 18351 1
29 . 1 1 4 4 ALA CB C 13 18.987 0.0213 . 1 . . 203 . . 4 ALA CB . 18351 1
30 . 1 1 4 4 ALA N N 15 123.545 0.082 . 1 . . 77 . . 4 ALA N . 18351 1
31 . 1 1 5 5 MET H H 1 8.249 0.006 . 1 . . 95 . . 5 MET H . 18351 1
32 . 1 1 5 5 MET HA H 1 4.295 0.006 . 1 . . 471 . . 5 MET HA . 18351 1
33 . 1 1 5 5 MET HB2 H 1 1.931 0.005 . 1 . . 469 . . 5 MET HB2 . 18351 1
34 . 1 1 5 5 MET HB3 H 1 1.858 0.002 . 1 . . 470 . . 5 MET HB3 . 18351 1
35 . 1 1 5 5 MET HG2 H 1 2.460 0.003 . 1 . . 601 . . 5 MET HG2 . 18351 1
36 . 1 1 5 5 MET HG3 H 1 2.396 0.002 . 1 . . 603 . . 5 MET HG3 . 18351 1
37 . 1 1 5 5 MET C C 13 176.374 0.015 . 1 . . 282 . . 5 MET C . 18351 1
38 . 1 1 5 5 MET CA C 13 55.422 0.005 . 1 . . 146 . . 5 MET CA . 18351 1
39 . 1 1 5 5 MET CB C 13 32.779 0.0213 . 1 . . 145 . . 5 MET CB . 18351 1
40 . 1 1 5 5 MET CG C 13 31.997 0.0 . 1 . . 602 . . 5 MET CG . 18351 1
41 . 1 1 5 5 MET N N 15 119.773 0.084 . 1 . . 96 . . 5 MET N . 18351 1
42 . 1 1 6 6 GLU H H 1 8.338 0.004 . 1 . . 31 . . 6 GLU H . 18351 1
43 . 1 1 6 6 GLU HA H 1 4.127 0.004 . 1 . . 604 . . 6 GLU HA . 18351 1
44 . 1 1 6 6 GLU HB2 H 1 1.888 0.001 . 1 . . 607 . . 6 GLU HB2 . 18351 1
45 . 1 1 6 6 GLU HB3 H 1 1.804 0.001 . 1 . . 608 . . 6 GLU HB3 . 18351 1
46 . 1 1 6 6 GLU HG2 H 1 2.153 0.005 . 1 . . 605 . . 6 GLU HG2 . 18351 1
47 . 1 1 6 6 GLU HG3 H 1 2.114 0.005 . 1 . . 649 . . 6 GLU HG3 . 18351 1
48 . 1 1 6 6 GLU C C 13 176.343 0.007 . 1 . . 280 . . 6 GLU C . 18351 1
49 . 1 1 6 6 GLU CA C 13 56.463 0.003 . 1 . . 457 . . 6 GLU CA . 18351 1
50 . 1 1 6 6 GLU CB C 13 30.080 0.003 . 1 . . 648 . . 6 GLU CB . 18351 1
51 . 1 1 6 6 GLU CG C 13 36.104 0.0 . 1 . . 606 . . 6 GLU CG . 18351 1
52 . 1 1 6 6 GLU N N 15 122.756 0.086 . 1 . . 32 . . 6 GLU N . 18351 1
53 . 1 1 7 7 ARG H H 1 8.321 0.005 . 1 . . 461 . . 7 ARG H . 18351 1
54 . 1 1 7 7 ARG HA H 1 4.170 0.005 . 1 . . 650 . . 7 ARG HA . 18351 1
55 . 1 1 7 7 ARG HB2 H 1 1.693 0.004 . 1 . . 657 . . 7 ARG HB2 . 18351 1
56 . 1 1 7 7 ARG HB3 H 1 1.626 0.002 . 1 . . 651 . . 7 ARG HB3 . 18351 1
57 . 1 1 7 7 ARG HG2 H 1 1.498 0.001 . 1 . . 652 . . 7 ARG HG2 . 18351 1
58 . 1 1 7 7 ARG HG3 H 1 1.452 0.002 . 1 . . 656 . . 7 ARG HG3 . 18351 1
59 . 1 1 7 7 ARG HD2 H 1 3.062 0.003 . 1 . . 653 . . 7 ARG HD2 . 18351 1
60 . 1 1 7 7 ARG HD3 H 1 3.062 0.003 . 1 . . 654 . . 7 ARG HD3 . 18351 1
61 . 1 1 7 7 ARG HE H 1 7.111 0.001 . 1 . . 660 . . 7 ARG HE . 18351 1
62 . 1 1 7 7 ARG C C 13 176.201 0.001 . 1 . . 281 . . 7 ARG C . 18351 1
63 . 1 1 7 7 ARG CA C 13 56.200 0.0 . 1 . . 463 . . 7 ARG CA . 18351 1
64 . 1 1 7 7 ARG CB C 13 30.550 0.001 . 1 . . 464 . . 7 ARG CB . 18351 1
65 . 1 1 7 7 ARG CG C 13 27.219 0.004 . 1 . . 658 . . 7 ARG CG . 18351 1
66 . 1 1 7 7 ARG CD C 13 43.448 0.0 . 1 . . 655 . . 7 ARG CD . 18351 1
67 . 1 1 7 7 ARG N N 15 122.608 0.074 . 1 . . 462 . . 7 ARG N . 18351 1
68 . 1 1 7 7 ARG NE N 15 114.530 0.024 . 1 . . 659 . . 7 ARG NE . 18351 1
69 . 1 1 8 8 GLN H H 1 8.437 0.002 . 1 . . 458 . . 8 GLN H . 18351 1
70 . 1 1 8 8 GLN HA H 1 4.229 0.003 . 1 . . 325 . . 8 GLN HA . 18351 1
71 . 1 1 8 8 GLN HB2 H 1 1.924 0.001 . 1 . . 327 . . 8 GLN HB2 . 18351 1
72 . 1 1 8 8 GLN HB3 H 1 1.830 0.001 . 1 . . 326 . . 8 GLN HB3 . 18351 1
73 . 1 1 8 8 GLN HG2 H 1 2.213 0.003 . 1 . . 671 . . 8 GLN HG2 . 18351 1
74 . 1 1 8 8 GLN HG3 H 1 2.213 0.003 . 1 . . 670 . . 8 GLN HG3 . 18351 1
75 . 1 1 8 8 GLN HE21 H 1 7.485 0.001 . 1 . . 793 . . 8 GLN HE21 . 18351 1
76 . 1 1 8 8 GLN HE22 H 1 6.808 0.001 . 1 . . 791 . . 8 GLN HE22 . 18351 1
77 . 1 1 8 8 GLN C C 13 175.786 0.005 . 1 . . 276 . . 8 GLN C . 18351 1
78 . 1 1 8 8 GLN CA C 13 55.425 0.001 . 1 . . 610 . . 8 GLN CA . 18351 1
79 . 1 1 8 8 GLN CB C 13 29.392 0.0 . 1 . . 223 . . 8 GLN CB . 18351 1
80 . 1 1 8 8 GLN CG C 13 33.850 0.0165 . 1 . . 351 . . 8 GLN CG . 18351 1
81 . 1 1 8 8 GLN CD C 13 180.498 0.0229 . 1 . . 709 . . 8 GLN CD . 18351 1
82 . 1 1 8 8 GLN N N 15 122.871 0.062 . 1 . . 459 . . 8 GLN N . 18351 1
83 . 1 1 8 8 GLN NE2 N 15 113.172 0.122 . 1 . . 792 . . 8 GLN NE2 . 18351 1
84 . 1 1 9 9 VAL H H 1 8.325 0.006 . 1 . . 7 . . 9 VAL H . 18351 1
85 . 1 1 9 9 VAL HA H 1 4.300 0.003 . 1 . . 638 . . 9 VAL HA . 18351 1
86 . 1 1 9 9 VAL HB H 1 1.989 0.002 . 1 . . 640 . . 9 VAL HB . 18351 1
87 . 1 1 9 9 VAL HG11 H 1 0.829 0.001 . 1 . . 644 . . 9 VAL HG11 . 18351 1
88 . 1 1 9 9 VAL HG12 H 1 0.829 0.001 . 1 . . 644 . . 9 VAL HG12 . 18351 1
89 . 1 1 9 9 VAL HG13 H 1 0.829 0.001 . 1 . . 644 . . 9 VAL HG13 . 18351 1
90 . 1 1 9 9 VAL HG21 H 1 0.883 0.0 . 1 . . 642 . . 9 VAL HG21 . 18351 1
91 . 1 1 9 9 VAL HG22 H 1 0.883 0.0 . 1 . . 642 . . 9 VAL HG22 . 18351 1
92 . 1 1 9 9 VAL HG23 H 1 0.883 0.0 . 1 . . 642 . . 9 VAL HG23 . 18351 1
93 . 1 1 9 9 VAL C C 13 174.536 0.020174 . 1 . . 275 . . 9 VAL C . 18351 1
94 . 1 1 9 9 VAL CA C 13 59.977 0.003 . 1 . . 587 . . 9 VAL CA . 18351 1
95 . 1 1 9 9 VAL CB C 13 32.652 0.04 . 1 . . 639 . . 9 VAL CB . 18351 1
96 . 1 1 9 9 VAL CG1 C 13 20.298 0.0 . 1 . . 643 . . 9 VAL CG1 . 18351 1
97 . 1 1 9 9 VAL CG2 C 13 20.848 0.0 . 1 . . 641 . . 9 VAL CG2 . 18351 1
98 . 1 1 9 9 VAL N N 15 123.998 0.089 . 1 . . 8 . . 9 VAL N . 18351 1
99 . 1 1 10 10 PRO HA H 1 4.300 0.001 . 1 . . 357 . . 10 PRO HA . 18351 1
100 . 1 1 10 10 PRO HB2 H 1 2.172 0.003 . 1 . . 473 . . 10 PRO HB2 . 18351 1
101 . 1 1 10 10 PRO HB3 H 1 1.736 0.002 . 1 . . 472 . . 10 PRO HB3 . 18351 1
102 . 1 1 10 10 PRO HG2 H 1 1.890 0.001 . 1 . . 629 . . 10 PRO HG2 . 18351 1
103 . 1 1 10 10 PRO HG3 H 1 1.853 0.001 . 1 . . 630 . . 10 PRO HG3 . 18351 1
104 . 1 1 10 10 PRO HD2 H 1 3.750 0.003 . 1 . . 627 . . 10 PRO HD2 . 18351 1
105 . 1 1 10 10 PRO HD3 H 1 3.570 0.004 . 1 . . 628 . . 10 PRO HD3 . 18351 1
106 . 1 1 10 10 PRO C C 13 176.249 0.025 . 1 . . 255 . . 10 PRO C . 18351 1
107 . 1 1 10 10 PRO CA C 13 63.199 0.004 . 1 . . 319 . . 10 PRO CA . 18351 1
108 . 1 1 10 10 PRO CB C 13 32.220 0.0 . 1 . . 318 . . 10 PRO CB . 18351 1
109 . 1 1 10 10 PRO CG C 13 27.388 0.0 . 1 . . 356 . . 10 PRO CG . 18351 1
110 . 1 1 10 10 PRO CD C 13 51.233 0.0 . 1 . . 355 . . 10 PRO CD . 18351 1
111 . 1 1 11 11 TYR H H 1 8.504 0.002 . 1 . . 21 . . 11 TYR H . 18351 1
112 . 1 1 11 11 TYR HA H 1 4.552 0.001 . 1 . . 315 . . 11 TYR HA . 18351 1
113 . 1 1 11 11 TYR HB2 H 1 3.053 0.005 . 1 . . 316 . . 11 TYR HB2 . 18351 1
114 . 1 1 11 11 TYR HB3 H 1 2.402 0.002 . 1 . . 317 . . 11 TYR HB3 . 18351 1
115 . 1 1 11 11 TYR HE1 H 1 6.776 0.003 . 3 . . 739 . . 11 TYR HE1 . 18351 1
116 . 1 1 11 11 TYR HE2 H 1 6.776 0.003 . 3 . . 739 . . 11 TYR HE2 . 18351 1
117 . 1 1 11 11 TYR C C 13 175.116 0.015 . 1 . . 254 . . 11 TYR C . 18351 1
118 . 1 1 11 11 TYR CA C 13 57.163 0.004 . 1 . . 243 . . 11 TYR CA . 18351 1
119 . 1 1 11 11 TYR CB C 13 39.383 0.002 . 1 . . 242 . . 11 TYR CB . 18351 1
120 . 1 1 11 11 TYR N N 15 123.080 0.073 . 1 . . 22 . . 11 TYR N . 18351 1
121 . 1 1 12 12 THR H H 1 8.279 0.003 . 1 . . 68 . . 12 THR H . 18351 1
122 . 1 1 12 12 THR HA H 1 4.240 0.004 . 1 . . 476 . . 12 THR HA . 18351 1
123 . 1 1 12 12 THR HB H 1 3.756 0.003 . 1 . . 563 . . 12 THR HB . 18351 1
124 . 1 1 12 12 THR HG21 H 1 0.965 0.002 . 1 . . 711 . . 12 THR HG21 . 18351 1
125 . 1 1 12 12 THR HG22 H 1 0.965 0.002 . 1 . . 711 . . 12 THR HG22 . 18351 1
126 . 1 1 12 12 THR HG23 H 1 0.965 0.002 . 1 . . 711 . . 12 THR HG23 . 18351 1
127 . 1 1 12 12 THR C C 13 172.605 0.020174 . 1 . . 247 . . 12 THR C . 18351 1
128 . 1 1 12 12 THR CA C 13 58.208 0.022 . 1 . . 314 . . 12 THR CA . 18351 1
129 . 1 1 12 12 THR CB C 13 69.853 0.005 . 1 . . 241 . . 12 THR CB . 18351 1
130 . 1 1 12 12 THR CG2 C 13 21.322 0.009 . 1 . . 737 . . 12 THR CG2 . 18351 1
131 . 1 1 12 12 THR N N 15 127.278 0.079 . 1 . . 69 . . 12 THR N . 18351 1
132 . 1 1 13 13 PRO HA H 1 3.664 0.002 . 1 . . 417 . . 13 PRO HA . 18351 1
133 . 1 1 13 13 PRO HB2 H 1 1.980 0.001 . 1 . . 418 . . 13 PRO HB2 . 18351 1
134 . 1 1 13 13 PRO HB3 H 1 1.871 0.001 . 1 . . 419 . . 13 PRO HB3 . 18351 1
135 . 1 1 13 13 PRO HG2 H 1 1.783 0.004 . 1 . . 631 . . 13 PRO HG2 . 18351 1
136 . 1 1 13 13 PRO HG3 H 1 1.411 0.002 . 1 . . 632 . . 13 PRO HG3 . 18351 1
137 . 1 1 13 13 PRO HD2 H 1 2.519 0.004 . 1 . . 752 . . 13 PRO HD2 . 18351 1
138 . 1 1 13 13 PRO HD3 H 1 2.518 0.004 . 1 . . 745 . . 13 PRO HD3 . 18351 1
139 . 1 1 13 13 PRO C C 13 177.031 0.020174 . 1 . . 257 . . 13 PRO C . 18351 1
140 . 1 1 13 13 PRO CA C 13 63.860 0.0234 . 1 . . 153 . . 13 PRO CA . 18351 1
141 . 1 1 13 13 PRO CB C 13 32.032 0.003 . 1 . . 152 . . 13 PRO CB . 18351 1
142 . 1 1 13 13 PRO CG C 13 27.330 0.003 . 1 . . 532 . . 13 PRO CG . 18351 1
143 . 1 1 13 13 PRO CD C 13 50.961 0.007 . 1 . . 751 . . 13 PRO CD . 18351 1
144 . 1 1 14 14 CYS H H 1 7.270 0.002 . 1 . . 60 . . 14 CYS H . 18351 1
145 . 1 1 14 14 CYS HA H 1 4.969 0.002 . 1 . . 410 . . 14 CYS HA . 18351 1
146 . 1 1 14 14 CYS HB2 H 1 3.920 0.003 . 1 . . 409 . . 14 CYS HB2 . 18351 1
147 . 1 1 14 14 CYS HB3 H 1 2.147 0.003 . 1 . . 408 . . 14 CYS HB3 . 18351 1
148 . 1 1 14 14 CYS C C 13 172.613 0.013 . 1 . . 256 . . 14 CYS C . 18351 1
149 . 1 1 14 14 CYS CA C 13 52.333 0.053 . 1 . . 150 . . 14 CYS CA . 18351 1
150 . 1 1 14 14 CYS CB C 13 41.600 . . 1 . . 151 . . 14 CYS CB . 18351 1
151 . 1 1 14 14 CYS N N 15 113.677 0.067 . 1 . . 61 . . 14 CYS N . 18351 1
152 . 1 1 15 15 SER H H 1 8.404 0.001 . 1 . . 80 . . 15 SER H . 18351 1
153 . 1 1 15 15 SER HA H 1 4.526 0.002 . 1 . . 432 . . 15 SER HA . 18351 1
154 . 1 1 15 15 SER HB2 H 1 3.631 0.004 . 1 . . 753 . . 15 SER HB2 . 18351 1
155 . 1 1 15 15 SER HB3 H 1 3.632 0.002 . 1 . . 433 . . 15 SER HB3 . 18351 1
156 . 1 1 15 15 SER C C 13 172.398 0.052 . 1 . . 274 . . 15 SER C . 18351 1
157 . 1 1 15 15 SER CA C 13 57.541 0.0 . 1 . . 149 . . 15 SER CA . 18351 1
158 . 1 1 15 15 SER CB C 13 65.807 0.018 . 1 . . 148 . . 15 SER CB . 18351 1
159 . 1 1 15 15 SER N N 15 115.685 0.064 . 1 . . 81 . . 15 SER N . 18351 1
160 . 1 1 16 16 GLY H H 1 8.548 0.002 . 1 . . 56 . . 16 GLY H . 18351 1
161 . 1 1 16 16 GLY HA2 H 1 3.820 0.002 . 1 . . 474 . . 16 GLY HA2 . 18351 1
162 . 1 1 16 16 GLY HA3 H 1 3.512 0.004 . 1 . . 475 . . 16 GLY HA3 . 18351 1
163 . 1 1 16 16 GLY C C 13 173.903 0.002 . 1 . . 290 . . 16 GLY C . 18351 1
164 . 1 1 16 16 GLY CA C 13 45.050 0.0234 . 1 . . 147 . . 16 GLY CA . 18351 1
165 . 1 1 16 16 GLY N N 15 108.947 0.081 . 1 . . 57 . . 16 GLY N . 18351 1
166 . 1 1 17 17 LEU H H 1 8.286 0.002 . 1 . . 17 . . 17 LEU H . 18351 1
167 . 1 1 17 17 LEU HA H 1 3.820 0.002 . 1 . . 395 . . 17 LEU HA . 18351 1
168 . 1 1 17 17 LEU HB2 H 1 1.418 0.003 . 1 . . 394 . . 17 LEU HB2 . 18351 1
169 . 1 1 17 17 LEU HB3 H 1 1.419 0.003 . 1 . . 746 . . 17 LEU HB3 . 18351 1
170 . 1 1 17 17 LEU HG H 1 0.988 0.002 . 1 . . 598 . . 17 LEU HG . 18351 1
171 . 1 1 17 17 LEU HD11 H 1 0.636 0.004 . 1 . . 727 . . 17 LEU HD11 . 18351 1
172 . 1 1 17 17 LEU HD12 H 1 0.636 0.004 . 1 . . 727 . . 17 LEU HD12 . 18351 1
173 . 1 1 17 17 LEU HD13 H 1 0.636 0.004 . 1 . . 727 . . 17 LEU HD13 . 18351 1
174 . 1 1 17 17 LEU HD21 H 1 0.685 0.001 . 1 . . 600 . . 17 LEU HD21 . 18351 1
175 . 1 1 17 17 LEU HD22 H 1 0.685 0.001 . 1 . . 600 . . 17 LEU HD22 . 18351 1
176 . 1 1 17 17 LEU HD23 H 1 0.685 0.001 . 1 . . 600 . . 17 LEU HD23 . 18351 1
177 . 1 1 17 17 LEU C C 13 178.593 0.020174 . 1 . . 301 . . 17 LEU C . 18351 1
178 . 1 1 17 17 LEU CA C 13 58.000 0.0234 . 1 . . 188 . . 17 LEU CA . 18351 1
179 . 1 1 17 17 LEU CB C 13 42.375 0.0 . 1 . . 187 . . 17 LEU CB . 18351 1
180 . 1 1 17 17 LEU CG C 13 26.478 0.001 . 1 . . 545 . . 17 LEU CG . 18351 1
181 . 1 1 17 17 LEU CD1 C 13 25.294 0.037 . 1 . . 726 . . 17 LEU CD1 . 18351 1
182 . 1 1 17 17 LEU CD2 C 13 23.086 0.0234 . 1 . . 599 . . 17 LEU CD2 . 18351 1
183 . 1 1 17 17 LEU N N 15 125.603 0.09 . 1 . . 18 . . 17 LEU N . 18351 1
184 . 1 1 18 18 TYR H H 1 8.337 0.002 . 1 . . 29 . . 18 TYR H . 18351 1
185 . 1 1 18 18 TYR HA H 1 4.020 0.004 . 1 . . 438 . . 18 TYR HA . 18351 1
186 . 1 1 18 18 TYR HB2 H 1 2.741 0.001 . 1 . . 439 . . 18 TYR HB2 . 18351 1
187 . 1 1 18 18 TYR HB3 H 1 2.348 0.005 . 1 . . 440 . . 18 TYR HB3 . 18351 1
188 . 1 1 18 18 TYR HD1 H 1 6.988 0.004 . 3 . . 719 . . 18 TYR HD1 . 18351 1
189 . 1 1 18 18 TYR HD2 H 1 6.988 0.004 . 3 . . 719 . . 18 TYR HD2 . 18351 1
190 . 1 1 18 18 TYR HE1 H 1 6.386 0.004 . 3 . . 721 . . 18 TYR HE1 . 18351 1
191 . 1 1 18 18 TYR HE2 H 1 6.386 0.004 . 3 . . 721 . . 18 TYR HE2 . 18351 1
192 . 1 1 18 18 TYR C C 13 177.150 0.017 . 1 . . 262 . . 18 TYR C . 18351 1
193 . 1 1 18 18 TYR CA C 13 55.385 0.0 . 1 . . 185 . . 18 TYR CA . 18351 1
194 . 1 1 18 18 TYR CB C 13 34.511 0.034 . 1 . . 186 . . 18 TYR CB . 18351 1
195 . 1 1 18 18 TYR CD1 C 13 132.935 0.023 . 3 . . 720 . . 18 TYR CD1 . 18351 1
196 . 1 1 18 18 TYR CD2 C 13 132.935 0.023 . 3 . . 720 . . 18 TYR CD2 . 18351 1
197 . 1 1 18 18 TYR CE1 C 13 117.202 0.02 . 3 . . 722 . . 18 TYR CE1 . 18351 1
198 . 1 1 18 18 TYR CE2 C 13 117.202 0.02 . 3 . . 722 . . 18 TYR CE2 . 18351 1
199 . 1 1 18 18 TYR N N 15 118.706 0.062 . 1 . . 30 . . 18 TYR N . 18351 1
200 . 1 1 19 19 GLY H H 1 6.995 0.003 . 1 . . 66 . . 19 GLY H . 18351 1
201 . 1 1 19 19 GLY HA2 H 1 3.461 0.002 . 1 . . 391 . . 19 GLY HA2 . 18351 1
202 . 1 1 19 19 GLY HA3 H 1 3.333 0.001 . 1 . . 390 . . 19 GLY HA3 . 18351 1
203 . 1 1 19 19 GLY C C 13 174.741 0.018 . 1 . . 253 . . 19 GLY C . 18351 1
204 . 1 1 19 19 GLY CA C 13 46.605 0.0 . 1 . . 115 . . 19 GLY CA . 18351 1
205 . 1 1 19 19 GLY N N 15 106.452 0.05 . 1 . . 67 . . 19 GLY N . 18351 1
206 . 1 1 20 20 THR H H 1 8.713 0.003 . 1 . . 87 . . 20 THR H . 18351 1
207 . 1 1 20 20 THR HA H 1 4.323 0.002 . 1 . . 309 . . 20 THR HA . 18351 1
208 . 1 1 20 20 THR HB H 1 3.772 0.005 . 1 . . 311 . . 20 THR HB . 18351 1
209 . 1 1 20 20 THR HG21 H 1 0.994 0.005 . 1 . . 734 . . 20 THR HG21 . 18351 1
210 . 1 1 20 20 THR HG22 H 1 0.994 0.005 . 1 . . 734 . . 20 THR HG22 . 18351 1
211 . 1 1 20 20 THR HG23 H 1 0.994 0.005 . 1 . . 734 . . 20 THR HG23 . 18351 1
212 . 1 1 20 20 THR C C 13 174.167 0.020174 . 1 . . 310 . . 20 THR C . 18351 1
213 . 1 1 20 20 THR CA C 13 62.449 0.022 . 1 . . 456 . . 20 THR CA . 18351 1
214 . 1 1 20 20 THR CB C 13 69.948 0.0 . 1 . . 339 . . 20 THR CB . 18351 1
215 . 1 1 20 20 THR CG2 C 13 21.699 0.0 . 1 . . 338 . . 20 THR CG2 . 18351 1
216 . 1 1 20 20 THR N N 15 118.824 0.078 . 1 . . 88 . . 20 THR N . 18351 1
217 . 1 1 21 21 ALA H H 1 8.981 0.002 . 1 . . 210 . . 21 ALA H . 18351 1
218 . 1 1 21 21 ALA HA H 1 4.935 0.003 . 1 . . 444 . . 21 ALA HA . 18351 1
219 . 1 1 21 21 ALA HB1 H 1 0.994 0.002 . 1 . . 443 . . 21 ALA HB1 . 18351 1
220 . 1 1 21 21 ALA HB2 H 1 0.994 0.002 . 1 . . 443 . . 21 ALA HB2 . 18351 1
221 . 1 1 21 21 ALA HB3 H 1 0.994 0.002 . 1 . . 443 . . 21 ALA HB3 . 18351 1
222 . 1 1 21 21 ALA C C 13 178.577 0.004 . 1 . . 305 . . 21 ALA C . 18351 1
223 . 1 1 21 21 ALA CA C 13 53.146 0.012 . 1 . . 207 . . 21 ALA CA . 18351 1
224 . 1 1 21 21 ALA CB C 13 18.774 0.003 . 1 . . 208 . . 21 ALA CB . 18351 1
225 . 1 1 21 21 ALA N N 15 133.280 0.081 . 1 . . 209 . . 21 ALA N . 18351 1
226 . 1 1 22 22 GLN H H 1 9.529 0.003 . 1 . . 117 . . 22 GLN H . 18351 1
227 . 1 1 22 22 GLN HA H 1 4.880 0.006 . 1 . . 477 . . 22 GLN HA . 18351 1
228 . 1 1 22 22 GLN HB2 H 1 2.010 0.001 . 1 . . 566 . . 22 GLN HB2 . 18351 1
229 . 1 1 22 22 GLN HB3 H 1 1.613 0.001 . 1 . . 723 . . 22 GLN HB3 . 18351 1
230 . 1 1 22 22 GLN HG2 H 1 1.833 0.002 . 1 . . 725 . . 22 GLN HG2 . 18351 1
231 . 1 1 22 22 GLN HG3 H 1 1.832 0.003 . 1 . . 724 . . 22 GLN HG3 . 18351 1
232 . 1 1 22 22 GLN HE21 H 1 7.611 0.003 . 1 . . 588 . . 22 GLN HE21 . 18351 1
233 . 1 1 22 22 GLN HE22 H 1 6.313 0.002 . 1 . . 590 . . 22 GLN HE22 . 18351 1
234 . 1 1 22 22 GLN C C 13 175.898 0.003 . 1 . . 244 . . 22 GLN C . 18351 1
235 . 1 1 22 22 GLN CA C 13 54.797 0.003 . 1 . . 442 . . 22 GLN CA . 18351 1
236 . 1 1 22 22 GLN CB C 13 35.852 0.0213 . 1 . . 441 . . 22 GLN CB . 18351 1
237 . 1 1 22 22 GLN CG C 13 34.516 0.0165 . 1 . . 478 . . 22 GLN CG . 18351 1
238 . 1 1 22 22 GLN N N 15 123.493 0.078 . 1 . . 118 . . 22 GLN N . 18351 1
239 . 1 1 22 22 GLN NE2 N 15 111.499 0.076 . 1 . . 589 . . 22 GLN NE2 . 18351 1
240 . 1 1 23 23 CYS H H 1 8.713 0.002 . 1 . . 11 . . 23 CYS H . 18351 1
241 . 1 1 23 23 CYS HA H 1 5.645 0.003 . 1 . . 445 . . 23 CYS HA . 18351 1
242 . 1 1 23 23 CYS HB2 H 1 3.120 0.004 . 1 . . 446 . . 23 CYS HB2 . 18351 1
243 . 1 1 23 23 CYS HB3 H 1 2.730 0.002 . 1 . . 447 . . 23 CYS HB3 . 18351 1
244 . 1 1 23 23 CYS C C 13 174.371 0.014 . 1 . . 296 . . 23 CYS C . 18351 1
245 . 1 1 23 23 CYS CA C 13 53.057 0.0 . 1 . . 116 . . 23 CYS CA . 18351 1
246 . 1 1 23 23 CYS CB C 13 37.425 0.096 . 1 . . 119 . . 23 CYS CB . 18351 1
247 . 1 1 23 23 CYS N N 15 116.479 0.076 . 1 . . 12 . . 23 CYS N . 18351 1
248 . 1 1 24 24 CYS H H 1 8.821 0.006 . 1 . . 179 . . 24 CYS H . 18351 1
249 . 1 1 24 24 CYS HA H 1 4.797 0.002 . 1 . . 538 . . 24 CYS HA . 18351 1
250 . 1 1 24 24 CYS HB2 H 1 3.284 0.001 . 1 . . 346 . . 24 CYS HB2 . 18351 1
251 . 1 1 24 24 CYS HB3 H 1 2.992 0.003 . 1 . . 347 . . 24 CYS HB3 . 18351 1
252 . 1 1 24 24 CYS C C 13 174.208 0.020174 . 1 . . 266 . . 24 CYS C . 18351 1
253 . 1 1 24 24 CYS CB C 13 51.055 0.006 . 1 . . 183 . . 24 CYS CB . 18351 1
254 . 1 1 24 24 CYS N N 15 117.708 0.06 . 1 . . 180 . . 24 CYS N . 18351 1
255 . 1 1 25 25 ALA H H 1 8.940 0.002 . 1 . . 83 . . 25 ALA H . 18351 1
256 . 1 1 25 25 ALA HA H 1 4.561 0.004 . 1 . . 406 . . 25 ALA HA . 18351 1
257 . 1 1 25 25 ALA HB1 H 1 1.399 0.002 . 1 . . 407 . . 25 ALA HB1 . 18351 1
258 . 1 1 25 25 ALA HB2 H 1 1.399 0.002 . 1 . . 407 . . 25 ALA HB2 . 18351 1
259 . 1 1 25 25 ALA HB3 H 1 1.399 0.002 . 1 . . 407 . . 25 ALA HB3 . 18351 1
260 . 1 1 25 25 ALA C C 13 176.703 0.017 . 1 . . 265 . . 25 ALA C . 18351 1
261 . 1 1 25 25 ALA CA C 13 51.206 0.067 . 1 . . 177 . . 25 ALA CA . 18351 1
262 . 1 1 25 25 ALA CB C 13 20.176 0.001 . 1 . . 176 . . 25 ALA CB . 18351 1
263 . 1 1 25 25 ALA N N 15 125.644 0.055 . 1 . . 84 . . 25 ALA N . 18351 1
264 . 1 1 26 26 THR H H 1 8.448 0.002 . 1 . . 100 . . 26 THR H . 18351 1
265 . 1 1 26 26 THR HA H 1 4.645 0.003 . 1 . . 362 . . 26 THR HA . 18351 1
266 . 1 1 26 26 THR HB H 1 3.710 0.003 . 1 . . 363 . . 26 THR HB . 18351 1
267 . 1 1 26 26 THR HG1 H 1 5.971 0.004 . 1 . . 743 . . 26 THR HG1 . 18351 1
268 . 1 1 26 26 THR HG21 H 1 0.996 0.003 . 1 . . 583 . . 26 THR HG21 . 18351 1
269 . 1 1 26 26 THR HG22 H 1 0.996 0.003 . 1 . . 583 . . 26 THR HG22 . 18351 1
270 . 1 1 26 26 THR HG23 H 1 0.996 0.003 . 1 . . 583 . . 26 THR HG23 . 18351 1
271 . 1 1 26 26 THR C C 13 173.372 0.01 . 1 . . 287 . . 26 THR C . 18351 1
272 . 1 1 26 26 THR CA C 13 59.603 0.006 . 1 . . 547 . . 26 THR CA . 18351 1
273 . 1 1 26 26 THR CB C 13 70.981 0.064 . 1 . . 174 . . 26 THR CB . 18351 1
274 . 1 1 26 26 THR CG2 C 13 17.354 0.0 . 1 . . 364 . . 26 THR CG2 . 18351 1
275 . 1 1 26 26 THR N N 15 116.331 0.076 . 1 . . 101 . . 26 THR N . 18351 1
276 . 1 1 27 27 ASP H H 1 8.898 0.003 . 1 . . 41 . . 27 ASP H . 18351 1
277 . 1 1 27 27 ASP HA H 1 4.700 0.003 . 1 . . 387 . . 27 ASP HA . 18351 1
278 . 1 1 27 27 ASP HB2 H 1 3.008 0.004 . 1 . . 388 . . 27 ASP HB2 . 18351 1
279 . 1 1 27 27 ASP HB3 H 1 2.403 0.002 . 1 . . 389 . . 27 ASP HB3 . 18351 1
280 . 1 1 27 27 ASP C C 13 178.225 0.053 . 1 . . 288 . . 27 ASP C . 18351 1
281 . 1 1 27 27 ASP CA C 13 52.097 0.009 . 1 . . 136 . . 27 ASP CA . 18351 1
282 . 1 1 27 27 ASP CB C 13 42.902 0.013 . 1 . . 137 . . 27 ASP CB . 18351 1
283 . 1 1 27 27 ASP N N 15 122.248 0.063 . 1 . . 42 . . 27 ASP N . 18351 1
284 . 1 1 28 28 VAL H H 1 8.244 0.002 . 1 . . 111 . . 28 VAL H . 18351 1
285 . 1 1 28 28 VAL HA H 1 3.771 0.003 . 1 . . 396 . . 28 VAL HA . 18351 1
286 . 1 1 28 28 VAL HB H 1 2.040 0.002 . 1 . . 397 . . 28 VAL HB . 18351 1
287 . 1 1 28 28 VAL HG11 H 1 0.862 0.002 . 1 . . 666 . . 28 VAL HG11 . 18351 1
288 . 1 1 28 28 VAL HG12 H 1 0.862 0.002 . 1 . . 666 . . 28 VAL HG12 . 18351 1
289 . 1 1 28 28 VAL HG13 H 1 0.862 0.002 . 1 . . 666 . . 28 VAL HG13 . 18351 1
290 . 1 1 28 28 VAL HG21 H 1 0.894 0.001 . 1 . . 546 . . 28 VAL HG21 . 18351 1
291 . 1 1 28 28 VAL HG22 H 1 0.894 0.001 . 1 . . 546 . . 28 VAL HG22 . 18351 1
292 . 1 1 28 28 VAL HG23 H 1 0.894 0.001 . 1 . . 546 . . 28 VAL HG23 . 18351 1
293 . 1 1 28 28 VAL C C 13 176.968 0.065 . 1 . . 252 . . 28 VAL C . 18351 1
294 . 1 1 28 28 VAL CA C 13 65.180 0.0234 . 1 . . 189 . . 28 VAL CA . 18351 1
295 . 1 1 28 28 VAL CB C 13 31.717 0.0 . 1 . . 178 . . 28 VAL CB . 18351 1
296 . 1 1 28 28 VAL CG1 C 13 20.698 0.0171 . 1 . . 398 . . 28 VAL CG1 . 18351 1
297 . 1 1 28 28 VAL CG2 C 13 21.238 0.0179 . 1 . . 665 . . 28 VAL CG2 . 18351 1
298 . 1 1 28 28 VAL N N 15 118.857 0.092 . 1 . . 112 . . 28 VAL N . 18351 1
299 . 1 1 29 29 LEU H H 1 7.236 0.003 . 1 . . 1 . . 29 LEU H . 18351 1
300 . 1 1 29 29 LEU HA H 1 4.182 0.003 . 1 . . 427 . . 29 LEU HA . 18351 1
301 . 1 1 29 29 LEU HB2 H 1 1.847 0.001 . 1 . . 428 . . 29 LEU HB2 . 18351 1
302 . 1 1 29 29 LEU HB3 H 1 1.419 0.002 . 1 . . 429 . . 29 LEU HB3 . 18351 1
303 . 1 1 29 29 LEU HG H 1 1.470 0.005 . 1 . . 564 . . 29 LEU HG . 18351 1
304 . 1 1 29 29 LEU HD11 H 1 0.711 0.002 . 1 . . 761 . . 29 LEU HD11 . 18351 1
305 . 1 1 29 29 LEU HD12 H 1 0.711 0.002 . 1 . . 761 . . 29 LEU HD12 . 18351 1
306 . 1 1 29 29 LEU HD13 H 1 0.711 0.002 . 1 . . 761 . . 29 LEU HD13 . 18351 1
307 . 1 1 29 29 LEU HD21 H 1 0.777 0.001 . 1 . . 565 . . 29 LEU HD21 . 18351 1
308 . 1 1 29 29 LEU HD22 H 1 0.777 0.001 . 1 . . 565 . . 29 LEU HD22 . 18351 1
309 . 1 1 29 29 LEU HD23 H 1 0.777 0.001 . 1 . . 565 . . 29 LEU HD23 . 18351 1
310 . 1 1 29 29 LEU C C 13 178.150 0.005 . 1 . . 251 . . 29 LEU C . 18351 1
311 . 1 1 29 29 LEU CA C 13 55.175 0.0234 . 1 . . 114 . . 29 LEU CA . 18351 1
312 . 1 1 29 29 LEU CB C 13 41.840 0.0 . 1 . . 113 . . 29 LEU CB . 18351 1
313 . 1 1 29 29 LEU CG C 13 27.207 0.0 . 1 . . 430 . . 29 LEU CG . 18351 1
314 . 1 1 29 29 LEU CD1 C 13 22.309 0.005 . 1 . . 537 . . 29 LEU CD1 . 18351 1
315 . 1 1 29 29 LEU CD2 C 13 25.272 0.0 . 1 . . 431 . . 29 LEU CD2 . 18351 1
316 . 1 1 29 29 LEU N N 15 117.669 0.071 . 1 . . 2 . . 29 LEU N . 18351 1
317 . 1 1 30 30 GLY H H 1 7.764 0.003 . 1 . . 85 . . 30 GLY H . 18351 1
318 . 1 1 30 30 GLY HA2 H 1 3.904 0.006 . 1 . . 379 . . 30 GLY HA2 . 18351 1
319 . 1 1 30 30 GLY HA3 H 1 3.762 0.006 . 1 . . 380 . . 30 GLY HA3 . 18351 1
320 . 1 1 30 30 GLY C C 13 175.244 0.001 . 1 . . 297 . . 30 GLY C . 18351 1
321 . 1 1 30 30 GLY CA C 13 46.511 0.045 . 1 . . 190 . . 30 GLY CA . 18351 1
322 . 1 1 30 30 GLY N N 15 109.595 0.056 . 1 . . 86 . . 30 GLY N . 18351 1
323 . 1 1 31 31 VAL H H 1 8.486 0.003 . 1 . . 58 . . 31 VAL H . 18351 1
324 . 1 1 31 31 VAL HA H 1 3.882 0.006 . 1 . . 353 . . 31 VAL HA . 18351 1
325 . 1 1 31 31 VAL HB H 1 1.928 0.003 . 1 . . 352 . . 31 VAL HB . 18351 1
326 . 1 1 31 31 VAL HG11 H 1 0.714 0.002 . 1 . . 669 . . 31 VAL HG11 . 18351 1
327 . 1 1 31 31 VAL HG12 H 1 0.714 0.002 . 1 . . 669 . . 31 VAL HG12 . 18351 1
328 . 1 1 31 31 VAL HG13 H 1 0.714 0.002 . 1 . . 669 . . 31 VAL HG13 . 18351 1
329 . 1 1 31 31 VAL HG21 H 1 0.711 0.007 . 1 . . 553 . . 31 VAL HG21 . 18351 1
330 . 1 1 31 31 VAL HG22 H 1 0.711 0.007 . 1 . . 553 . . 31 VAL HG22 . 18351 1
331 . 1 1 31 31 VAL HG23 H 1 0.711 0.007 . 1 . . 553 . . 31 VAL HG23 . 18351 1
332 . 1 1 31 31 VAL C C 13 176.585 0.005 . 1 . . 285 . . 31 VAL C . 18351 1
333 . 1 1 31 31 VAL CA C 13 63.063 0.005 . 1 . . 192 . . 31 VAL CA . 18351 1
334 . 1 1 31 31 VAL CB C 13 33.734 0.0213 . 1 . . 191 . . 31 VAL CB . 18351 1
335 . 1 1 31 31 VAL CG1 C 13 21.190 0.0171 . 1 . . 354 . . 31 VAL CG1 . 18351 1
336 . 1 1 31 31 VAL CG2 C 13 21.190 0.0179 . 1 . . 668 . . 31 VAL CG2 . 18351 1
337 . 1 1 31 31 VAL N N 15 120.554 0.075 . 1 . . 59 . . 31 VAL N . 18351 1
338 . 1 1 32 32 ALA H H 1 8.147 0.002 . 1 . . 49 . . 32 ALA H . 18351 1
339 . 1 1 32 32 ALA HA H 1 4.071 0.003 . 1 . . 383 . . 32 ALA HA . 18351 1
340 . 1 1 32 32 ALA HB1 H 1 1.136 0.004 . 1 . . 384 . . 32 ALA HB1 . 18351 1
341 . 1 1 32 32 ALA HB2 H 1 1.136 0.004 . 1 . . 384 . . 32 ALA HB2 . 18351 1
342 . 1 1 32 32 ALA HB3 H 1 1.136 0.004 . 1 . . 384 . . 32 ALA HB3 . 18351 1
343 . 1 1 32 32 ALA C C 13 176.416 0.017 . 1 . . 286 . . 32 ALA C . 18351 1
344 . 1 1 32 32 ALA CA C 13 52.287 0.01 . 1 . . 194 . . 32 ALA CA . 18351 1
345 . 1 1 32 32 ALA CB C 13 20.394 0.033 . 1 . . 193 . . 32 ALA CB . 18351 1
346 . 1 1 32 32 ALA N N 15 123.297 0.055 . 1 . . 50 . . 32 ALA N . 18351 1
347 . 1 1 33 33 ASP H H 1 8.305 0.006 . 1 . . 5 . . 33 ASP H . 18351 1
348 . 1 1 33 33 ASP HA H 1 4.915 0.002 . 1 . . 481 . . 33 ASP HA . 18351 1
349 . 1 1 33 33 ASP HB2 H 1 2.305 0.002 . 1 . . 558 . . 33 ASP HB2 . 18351 1
350 . 1 1 33 33 ASP HB3 H 1 2.214 0.004 . 1 . . 559 . . 33 ASP HB3 . 18351 1
351 . 1 1 33 33 ASP C C 13 173.648 0.016 . 1 . . 479 . . 33 ASP C . 18351 1
352 . 1 1 33 33 ASP CA C 13 54.867 0.025 . 1 . . 195 . . 33 ASP CA . 18351 1
353 . 1 1 33 33 ASP CB C 13 43.997 0.021 . 1 . . 196 . . 33 ASP CB . 18351 1
354 . 1 1 33 33 ASP N N 15 119.798 0.079 . 1 . . 6 . . 33 ASP N . 18351 1
355 . 1 1 34 34 LEU H H 1 8.101 0.003 . 1 . . 15 . . 34 LEU H . 18351 1
356 . 1 1 34 34 LEU HA H 1 4.493 0.002 . 1 . . 485 . . 34 LEU HA . 18351 1
357 . 1 1 34 34 LEU HB2 H 1 1.316 0.003 . 1 . . 487 . . 34 LEU HB2 . 18351 1
358 . 1 1 34 34 LEU HB3 H 1 1.096 0.005 . 1 . . 486 . . 34 LEU HB3 . 18351 1
359 . 1 1 34 34 LEU HG H 1 1.146 0.001 . 1 . . 611 . . 34 LEU HG . 18351 1
360 . 1 1 34 34 LEU HD11 H 1 0.555 0.002 . 1 . . 570 . . 34 LEU HD11 . 18351 1
361 . 1 1 34 34 LEU HD12 H 1 0.555 0.002 . 1 . . 570 . . 34 LEU HD12 . 18351 1
362 . 1 1 34 34 LEU HD13 H 1 0.555 0.002 . 1 . . 570 . . 34 LEU HD13 . 18351 1
363 . 1 1 34 34 LEU HD21 H 1 0.661 0.003 . 1 . . 728 . . 34 LEU HD21 . 18351 1
364 . 1 1 34 34 LEU HD22 H 1 0.661 0.003 . 1 . . 728 . . 34 LEU HD22 . 18351 1
365 . 1 1 34 34 LEU HD23 H 1 0.661 0.003 . 1 . . 728 . . 34 LEU HD23 . 18351 1
366 . 1 1 34 34 LEU C C 13 175.020 0.024 . 1 . . 480 . . 34 LEU C . 18351 1
367 . 1 1 34 34 LEU CA C 13 53.248 0.027 . 1 . . 198 . . 34 LEU CA . 18351 1
368 . 1 1 34 34 LEU CB C 13 45.121 0.0 . 1 . . 197 . . 34 LEU CB . 18351 1
369 . 1 1 34 34 LEU CG C 13 27.144 0.02 . 1 . . 539 . . 34 LEU CG . 18351 1
370 . 1 1 34 34 LEU CD1 C 13 25.424 0.017 . 1 . . 541 . . 34 LEU CD1 . 18351 1
371 . 1 1 34 34 LEU CD2 C 13 23.227 0.008 . 1 . . 540 . . 34 LEU CD2 . 18351 1
372 . 1 1 34 34 LEU N N 15 123.335 0.065 . 1 . . 16 . . 34 LEU N . 18351 1
373 . 1 1 35 35 ASP H H 1 8.844 0.013 . 1 . . 104 . . 35 ASP H . 18351 1
374 . 1 1 35 35 ASP HA H 1 4.112 0.005 . 1 . . 482 . . 35 ASP HA . 18351 1
375 . 1 1 35 35 ASP HB2 H 1 2.738 0.003 . 1 . . 518 . . 35 ASP HB2 . 18351 1
376 . 1 1 35 35 ASP HB3 H 1 2.387 0.003 . 1 . . 517 . . 35 ASP HB3 . 18351 1
377 . 1 1 35 35 ASP C C 13 175.066 0.003 . 1 . . 483 . . 35 ASP C . 18351 1
378 . 1 1 35 35 ASP CA C 13 54.918 0.008 . 1 . . 710 . . 35 ASP CA . 18351 1
379 . 1 1 35 35 ASP CB C 13 39.290 0.013 . 1 . . 516 . . 35 ASP CB . 18351 1
380 . 1 1 35 35 ASP N N 15 119.125 0.048 . 1 . . 105 . . 35 ASP N . 18351 1
381 . 1 1 36 36 CYS H H 1 8.066 0.009 . 1 . . 23 . . 36 CYS H . 18351 1
382 . 1 1 36 36 CYS HA H 1 5.253 0.005 . 1 . . 328 . . 36 CYS HA . 18351 1
383 . 1 1 36 36 CYS HB2 H 1 3.088 0.002 . 1 . . 329 . . 36 CYS HB2 . 18351 1
384 . 1 1 36 36 CYS HB3 H 1 2.574 0.003 . 1 . . 331 . . 36 CYS HB3 . 18351 1
385 . 1 1 36 36 CYS C C 13 175.637 0.013 . 1 . . 484 . . 36 CYS C . 18351 1
386 . 1 1 36 36 CYS CA C 13 57.286 0.045 . 1 . . 332 . . 36 CYS CA . 18351 1
387 . 1 1 36 36 CYS CB C 13 42.770 . . 1 . . 333 . . 36 CYS CB . 18351 1
388 . 1 1 36 36 CYS N N 15 115.304 0.061 . 1 . . 24 . . 36 CYS N . 18351 1
389 . 1 1 37 37 ALA H H 1 8.845 0.004 . 1 . . 97 . . 37 ALA H . 18351 1
390 . 1 1 37 37 ALA HA H 1 4.435 0.003 . 1 . . 392 . . 37 ALA HA . 18351 1
391 . 1 1 37 37 ALA HB1 H 1 1.317 0.003 . 1 . . 393 . . 37 ALA HB1 . 18351 1
392 . 1 1 37 37 ALA HB2 H 1 1.317 0.003 . 1 . . 393 . . 37 ALA HB2 . 18351 1
393 . 1 1 37 37 ALA HB3 H 1 1.317 0.003 . 1 . . 393 . . 37 ALA HB3 . 18351 1
394 . 1 1 37 37 ALA C C 13 175.906 0.015 . 1 . . 289 . . 37 ALA C . 18351 1
395 . 1 1 37 37 ALA CA C 13 51.425 0.058 . 1 . . 173 . . 37 ALA CA . 18351 1
396 . 1 1 37 37 ALA CB C 13 22.490 0.03 . 1 . . 172 . . 37 ALA CB . 18351 1
397 . 1 1 37 37 ALA N N 15 123.681 0.047 . 1 . . 330 . . 37 ALA N . 18351 1
398 . 1 1 38 38 ASN H H 1 8.607 0.002 . 1 . . 106 . . 38 ASN H . 18351 1
399 . 1 1 38 38 ASN HA H 1 4.608 0.005 . 1 . . 531 . . 38 ASN HA . 18351 1
400 . 1 1 38 38 ASN HB2 H 1 2.672 0.007 . 1 . . 530 . . 38 ASN HB2 . 18351 1
401 . 1 1 38 38 ASN HB3 H 1 2.490 0.004 . 1 . . 529 . . 38 ASN HB3 . 18351 1
402 . 1 1 38 38 ASN HD21 H 1 7.561 0.001 . 1 . . 526 . . 38 ASN HD21 . 18351 1
403 . 1 1 38 38 ASN HD22 H 1 6.735 0.004 . 1 . . 527 . . 38 ASN HD22 . 18351 1
404 . 1 1 38 38 ASN C C 13 173.857 0.020174 . 1 . . 307 . . 38 ASN C . 18351 1
405 . 1 1 38 38 ASN CA C 13 52.048 0.038 . 1 . . 206 . . 38 ASN CA . 18351 1
406 . 1 1 38 38 ASN CB C 13 36.408 0.029 . 1 . . 205 . . 38 ASN CB . 18351 1
407 . 1 1 38 38 ASN N N 15 118.773 0.091 . 1 . . 107 . . 38 ASN N . 18351 1
408 . 1 1 38 38 ASN ND2 N 15 111.341 0.037 . 1 . . 528 . . 38 ASN ND2 . 18351 1
409 . 1 1 39 39 PRO HA H 1 4.5711 0.00151 . 1 . . 759 . . 39 PRO HA . 18351 1
410 . 1 1 39 39 PRO HB2 H 1 2.17888 0.00168 . 1 . . 778 . . 39 PRO HB2 . 18351 1
411 . 1 1 39 39 PRO HB3 H 1 2.179 0.00172 . 1 . . 777 . . 39 PRO HB3 . 18351 1
412 . 1 1 39 39 PRO HG2 H 1 1.82526 0.00141 . 1 . . 781 . . 39 PRO HG2 . 18351 1
413 . 1 1 39 39 PRO HG3 H 1 1.8253 0.00144 . 1 . . 780 . . 39 PRO HG3 . 18351 1
414 . 1 1 39 39 PRO HD2 H 1 3.96049 0.00314 . 1 . . 744 . . 39 PRO HD2 . 18351 1
415 . 1 1 39 39 PRO HD3 H 1 3.40512 0.0022 . 1 . . 758 . . 39 PRO HD3 . 18351 1
416 . 1 1 39 39 PRO CA C 13 61.13855 0.04278 . 1 . . 775 . . 39 PRO CA . 18351 1
417 . 1 1 39 39 PRO CB C 13 31.3757 0.02861 . 1 . . 779 . . 39 PRO CB . 18351 1
418 . 1 1 39 39 PRO CG C 13 28.78 0.0213 . 1 . . 782 . . 39 PRO CG . 18351 1
419 . 1 1 39 39 PRO CD C 13 50.39395 0.01616 . 1 . . 776 . . 39 PRO CD . 18351 1
420 . 1 1 40 40 PRO HA H 1 4.441 0.001 . 1 . . 373 . . 40 PRO HA . 18351 1
421 . 1 1 40 40 PRO HB2 H 1 2.152 0.005 . 1 . . 374 . . 40 PRO HB2 . 18351 1
422 . 1 1 40 40 PRO HB3 H 1 1.951 0.003 . 1 . . 375 . . 40 PRO HB3 . 18351 1
423 . 1 1 40 40 PRO HG2 H 1 1.866 0.004 . 1 . . 633 . . 40 PRO HG2 . 18351 1
424 . 1 1 40 40 PRO HG3 H 1 1.680 0.003 . 1 . . 634 . . 40 PRO HG3 . 18351 1
425 . 1 1 40 40 PRO HD2 H 1 3.764 0.005 . 1 . . 741 . . 40 PRO HD2 . 18351 1
426 . 1 1 40 40 PRO HD3 H 1 3.238 0.004 . 1 . . 740 . . 40 PRO HD3 . 18351 1
427 . 1 1 40 40 PRO C C 13 174.477 0.062 . 1 . . 269 . . 40 PRO C . 18351 1
428 . 1 1 40 40 PRO CA C 13 63.465 0.033 . 1 . . 239 . . 40 PRO CA . 18351 1
429 . 1 1 40 40 PRO CB C 13 30.389 0.003 . 1 . . 238 . . 40 PRO CB . 18351 1
430 . 1 1 40 40 PRO CG C 13 27.290 0.072 . 1 . . 376 . . 40 PRO CG . 18351 1
431 . 1 1 40 40 PRO CD C 13 50.827 0.06 . 1 . . 742 . . 40 PRO CD . 18351 1
432 . 1 1 41 41 ALA H H 1 7.231 0.003 . 1 . . 235 . . 41 ALA H . 18351 1
433 . 1 1 41 41 ALA HA H 1 4.398 0.004 . 1 . . 404 . . 41 ALA HA . 18351 1
434 . 1 1 41 41 ALA HB1 H 1 1.176 0.003 . 1 . . 405 . . 41 ALA HB1 . 18351 1
435 . 1 1 41 41 ALA HB2 H 1 1.176 0.003 . 1 . . 405 . . 41 ALA HB2 . 18351 1
436 . 1 1 41 41 ALA HB3 H 1 1.176 0.003 . 1 . . 405 . . 41 ALA HB3 . 18351 1
437 . 1 1 41 41 ALA C C 13 176.259 0.02 . 1 . . 268 . . 41 ALA C . 18351 1
438 . 1 1 41 41 ALA CA C 13 51.368 0.001 . 1 . . 236 . . 41 ALA CA . 18351 1
439 . 1 1 41 41 ALA CB C 13 22.619 0.069 . 1 . . 237 . . 41 ALA CB . 18351 1
440 . 1 1 41 41 ALA N N 15 120.790 0.075 . 1 . . 53 . . 41 ALA N . 18351 1
441 . 1 1 42 42 THR H H 1 8.300 0.006 . 1 . . 39 . . 42 THR H . 18351 1
442 . 1 1 42 42 THR HA H 1 4.035 0.002 . 1 . . 489 . . 42 THR HA . 18351 1
443 . 1 1 42 42 THR HB H 1 3.881 0.003 . 1 . . 490 . . 42 THR HB . 18351 1
444 . 1 1 42 42 THR HG21 H 1 1.070 0.003 . 1 . . 584 . . 42 THR HG21 . 18351 1
445 . 1 1 42 42 THR HG22 H 1 1.070 0.003 . 1 . . 584 . . 42 THR HG22 . 18351 1
446 . 1 1 42 42 THR HG23 H 1 1.070 0.003 . 1 . . 584 . . 42 THR HG23 . 18351 1
447 . 1 1 42 42 THR C C 13 174.682 0.029 . 1 . . 295 . . 42 THR C . 18351 1
448 . 1 1 42 42 THR CA C 13 62.905 0.017 . 1 . . 175 . . 42 THR CA . 18351 1
449 . 1 1 42 42 THR CB C 13 68.940 0.004 . 1 . . 234 . . 42 THR CB . 18351 1
450 . 1 1 42 42 THR CG2 C 13 22.002 0.022 . 1 . . 342 . . 42 THR CG2 . 18351 1
451 . 1 1 42 42 THR N N 15 116.566 0.116 . 1 . . 40 . . 42 THR N . 18351 1
452 . 1 1 43 43 LEU H H 1 8.547 0.002 . 1 . . 37 . . 43 LEU H . 18351 1
453 . 1 1 43 43 LEU HA H 1 4.640 0.004 . 1 . . 488 . . 43 LEU HA . 18351 1
454 . 1 1 43 43 LEU HB2 H 1 1.823 0.006 . 1 . . 571 . . 43 LEU HB2 . 18351 1
455 . 1 1 43 43 LEU HB3 H 1 0.997 0.006 . 1 . . 572 . . 43 LEU HB3 . 18351 1
456 . 1 1 43 43 LEU HG H 1 1.616 0.005 . 1 . . 560 . . 43 LEU HG . 18351 1
457 . 1 1 43 43 LEU HD11 H 1 0.033 0.007 . 1 . . 614 . . 43 LEU HD11 . 18351 1
458 . 1 1 43 43 LEU HD12 H 1 0.033 0.007 . 1 . . 614 . . 43 LEU HD12 . 18351 1
459 . 1 1 43 43 LEU HD13 H 1 0.033 0.007 . 1 . . 614 . . 43 LEU HD13 . 18351 1
460 . 1 1 43 43 LEU HD21 H 1 0.394 0.004 . 1 . . 615 . . 43 LEU HD21 . 18351 1
461 . 1 1 43 43 LEU HD22 H 1 0.394 0.004 . 1 . . 615 . . 43 LEU HD22 . 18351 1
462 . 1 1 43 43 LEU HD23 H 1 0.394 0.004 . 1 . . 615 . . 43 LEU HD23 . 18351 1
463 . 1 1 43 43 LEU C C 13 178.154 0.020174 . 1 . . 248 . . 43 LEU C . 18351 1
464 . 1 1 43 43 LEU CA C 13 54.315 0.059 . 1 . . 233 . . 43 LEU CA . 18351 1
465 . 1 1 43 43 LEU CB C 13 43.658 0.073 . 1 . . 232 . . 43 LEU CB . 18351 1
466 . 1 1 43 43 LEU CG C 13 25.869 0.084 . 1 . . 612 . . 43 LEU CG . 18351 1
467 . 1 1 43 43 LEU CD1 C 13 24.925 0.024 . 1 . . 763 . . 43 LEU CD1 . 18351 1
468 . 1 1 43 43 LEU CD2 C 13 22.986 0.031 . 1 . . 613 . . 43 LEU CD2 . 18351 1
469 . 1 1 43 43 LEU N N 15 127.092 0.087 . 1 . . 38 . . 43 LEU N . 18351 1
470 . 1 1 44 44 ALA H H 1 7.804 0.001 . 1 . . 750 . . 44 ALA H . 18351 1
471 . 1 1 44 44 ALA HA H 1 4.213 0.004 . 1 . . 437 . . 44 ALA HA . 18351 1
472 . 1 1 44 44 ALA HB1 H 1 1.043 0.002 . 1 . . 436 . . 44 ALA HB1 . 18351 1
473 . 1 1 44 44 ALA HB2 H 1 1.043 0.002 . 1 . . 436 . . 44 ALA HB2 . 18351 1
474 . 1 1 44 44 ALA HB3 H 1 1.043 0.002 . 1 . . 436 . . 44 ALA HB3 . 18351 1
475 . 1 1 44 44 ALA C C 13 177.412 0.020174 . 1 . . 278 . . 44 ALA C . 18351 1
476 . 1 1 44 44 ALA CA C 13 53.950 0.023 . 1 . . 132 . . 44 ALA CA . 18351 1
477 . 1 1 44 44 ALA CB C 13 20.842 0.038 . 1 . . 131 . . 44 ALA CB . 18351 1
478 . 1 1 45 45 ASN H H 1 7.141 0.005 . 1 . . 91 . . 45 ASN H . 18351 1
479 . 1 1 45 45 ASN HA H 1 2.523 0.002 . 1 . . 525 . . 45 ASN HA . 18351 1
480 . 1 1 45 45 ASN HB2 H 1 3.070 0.001 . 1 . . 491 . . 45 ASN HB2 . 18351 1
481 . 1 1 45 45 ASN HB3 H 1 2.572 0.002 . 1 . . 594 . . 45 ASN HB3 . 18351 1
482 . 1 1 45 45 ASN HD21 H 1 7.376 0.001 . 1 . . 523 . . 45 ASN HD21 . 18351 1
483 . 1 1 45 45 ASN HD22 H 1 6.652 0.003 . 1 . . 524 . . 45 ASN HD22 . 18351 1
484 . 1 1 45 45 ASN C C 13 174.728 0.027 . 1 . . 273 . . 45 ASN C . 18351 1
485 . 1 1 45 45 ASN CA C 13 51.311 0.0 . 1 . . 129 . . 45 ASN CA . 18351 1
486 . 1 1 45 45 ASN CB C 13 38.184 0.01 . 1 . . 130 . . 45 ASN CB . 18351 1
487 . 1 1 45 45 ASN N N 15 108.814 0.059 . 1 . . 92 . . 45 ASN N . 18351 1
488 . 1 1 45 45 ASN ND2 N 15 115.521 0.042 . 1 . . 522 . . 45 ASN ND2 . 18351 1
489 . 1 1 46 46 ALA H H 1 8.626 0.004 . 1 . . 45 . . 46 ALA H . 18351 1
490 . 1 1 46 46 ALA HA H 1 4.474 0.004 . 1 . . 415 . . 46 ALA HA . 18351 1
491 . 1 1 46 46 ALA HB1 H 1 1.401 0.004 . 1 . . 416 . . 46 ALA HB1 . 18351 1
492 . 1 1 46 46 ALA HB2 H 1 1.401 0.004 . 1 . . 416 . . 46 ALA HB2 . 18351 1
493 . 1 1 46 46 ALA HB3 H 1 1.401 0.004 . 1 . . 416 . . 46 ALA HB3 . 18351 1
494 . 1 1 46 46 ALA C C 13 179.290 0.01 . 1 . . 272 . . 46 ALA C . 18351 1
495 . 1 1 46 46 ALA CA C 13 56.308 0.068 . 1 . . 133 . . 46 ALA CA . 18351 1
496 . 1 1 46 46 ALA CB C 13 18.087 0.043 . 1 . . 134 . . 46 ALA CB . 18351 1
497 . 1 1 46 46 ALA N N 15 123.396 0.067 . 1 . . 46 . . 46 ALA N . 18351 1
498 . 1 1 47 47 THR H H 1 7.993 0.003 . 1 . . 89 . . 47 THR H . 18351 1
499 . 1 1 47 47 THR HA H 1 3.865 0.002 . 1 . . 321 . . 47 THR HA . 18351 1
500 . 1 1 47 47 THR HB H 1 3.998 0.003 . 1 . . 320 . . 47 THR HB . 18351 1
501 . 1 1 47 47 THR HG21 H 1 1.128 0.005 . 1 . . 586 . . 47 THR HG21 . 18351 1
502 . 1 1 47 47 THR HG22 H 1 1.128 0.005 . 1 . . 586 . . 47 THR HG22 . 18351 1
503 . 1 1 47 47 THR HG23 H 1 1.128 0.005 . 1 . . 586 . . 47 THR HG23 . 18351 1
504 . 1 1 47 47 THR C C 13 176.908 0.020174 . 1 . . 299 . . 47 THR C . 18351 1
505 . 1 1 47 47 THR CA C 13 66.569 0.009 . 1 . . 161 . . 47 THR CA . 18351 1
506 . 1 1 47 47 THR CB C 13 68.479 0.034 . 1 . . 160 . . 47 THR CB . 18351 1
507 . 1 1 47 47 THR CG2 C 13 21.997 0.013 . 1 . . 738 . . 47 THR CG2 . 18351 1
508 . 1 1 47 47 THR N N 15 115.121 0.058 . 1 . . 90 . . 47 THR N . 18351 1
509 . 1 1 48 48 HIS H H 1 8.529 0.003 . 1 . . 64 . . 48 HIS H . 18351 1
510 . 1 1 48 48 HIS HA H 1 4.498 0.004 . 1 . . 492 . . 48 HIS HA . 18351 1
511 . 1 1 48 48 HIS HB2 H 1 3.118 0.003 . 1 . . 552 . . 48 HIS HB2 . 18351 1
512 . 1 1 48 48 HIS HB3 H 1 2.940 0.003 . 1 . . 551 . . 48 HIS HB3 . 18351 1
513 . 1 1 48 48 HIS HD2 H 1 6.899 0.002 . 1 . . 717 . . 48 HIS HD2 . 18351 1
514 . 1 1 48 48 HIS C C 13 178.892 0.011 . 1 . . 300 . . 48 HIS C . 18351 1
515 . 1 1 48 48 HIS CA C 13 58.543 0.075 . 1 . . 135 . . 48 HIS CA . 18351 1
516 . 1 1 48 48 HIS CB C 13 32.948 0.041 . 1 . . 215 . . 48 HIS CB . 18351 1
517 . 1 1 48 48 HIS CD2 C 13 115.953 0.088 . 1 . . 718 . . 48 HIS CD2 . 18351 1
518 . 1 1 48 48 HIS N N 15 124.271 0.083 . 1 . . 65 . . 48 HIS N . 18351 1
519 . 1 1 49 49 PHE H H 1 8.498 0.004 . 1 . . 216 . . 49 PHE H . 18351 1
520 . 1 1 49 49 PHE HA H 1 4.498 0.006 . 1 . . 609 . . 49 PHE HA . 18351 1
521 . 1 1 49 49 PHE HB2 H 1 3.932 0.004 . 1 . . 580 . . 49 PHE HB2 . 18351 1
522 . 1 1 49 49 PHE HB3 H 1 3.291 0.004 . 1 . . 581 . . 49 PHE HB3 . 18351 1
523 . 1 1 49 49 PHE HD1 H 1 7.392 0.002 . 3 . . 747 . . 49 PHE HD1 . 18351 1
524 . 1 1 49 49 PHE HD2 H 1 7.392 0.002 . 3 . . 747 . . 49 PHE HD2 . 18351 1
525 . 1 1 49 49 PHE HE1 H 1 6.935 0.003 . 3 . . 748 . . 49 PHE HE1 . 18351 1
526 . 1 1 49 49 PHE HE2 H 1 6.935 0.003 . 3 . . 748 . . 49 PHE HE2 . 18351 1
527 . 1 1 49 49 PHE HZ H 1 7.618 0.002 . 1 . . 749 . . 49 PHE HZ . 18351 1
528 . 1 1 49 49 PHE C C 13 176.641 0.002 . 1 . . 337 . . 49 PHE C . 18351 1
529 . 1 1 49 49 PHE CA C 13 57.758 0.056 . 1 . . 218 . . 49 PHE CA . 18351 1
530 . 1 1 49 49 PHE CB C 13 38.259 0.034 . 1 . . 336 . . 49 PHE CB . 18351 1
531 . 1 1 49 49 PHE N N 15 124.704 0.061 . 1 . . 217 . . 49 PHE N . 18351 1
532 . 1 1 50 50 GLU H H 1 8.252 0.002 . 1 . . 43 . . 50 GLU H . 18351 1
533 . 1 1 50 50 GLU HA H 1 3.780 0.003 . 1 . . 412 . . 50 GLU HA . 18351 1
534 . 1 1 50 50 GLU HB2 H 1 2.147 0.004 . 1 . . 413 . . 50 GLU HB2 . 18351 1
535 . 1 1 50 50 GLU HB3 H 1 2.056 0.002 . 1 . . 414 . . 50 GLU HB3 . 18351 1
536 . 1 1 50 50 GLU HG2 H 1 2.151 0.002 . 1 . . 567 . . 50 GLU HG2 . 18351 1
537 . 1 1 50 50 GLU HG3 H 1 2.151 0.003 . 1 . . 729 . . 50 GLU HG3 . 18351 1
538 . 1 1 50 50 GLU C C 13 179.406 0.004 . 1 . . 302 . . 50 GLU C . 18351 1
539 . 1 1 50 50 GLU CA C 13 59.790 0.016 . 1 . . 170 . . 50 GLU CA . 18351 1
540 . 1 1 50 50 GLU CB C 13 29.368 0.023 . 1 . . 171 . . 50 GLU CB . 18351 1
541 . 1 1 50 50 GLU CG C 13 35.078 0.0 . 1 . . 411 . . 50 GLU CG . 18351 1
542 . 1 1 50 50 GLU N N 15 119.243 0.047 . 1 . . 44 . . 50 GLU N . 18351 1
543 . 1 1 51 51 SER H H 1 8.729 0.002 . 1 . . 51 . . 51 SER H . 18351 1
544 . 1 1 51 51 SER HA H 1 4.132 0.001 . 1 . . 368 . . 51 SER HA . 18351 1
545 . 1 1 51 51 SER HB2 H 1 3.926 0.002 . 1 . . 369 . . 51 SER HB2 . 18351 1
546 . 1 1 51 51 SER HB3 H 1 3.860 0.001 . 1 . . 370 . . 51 SER HB3 . 18351 1
547 . 1 1 51 51 SER C C 13 177.458 0.020174 . 1 . . 304 . . 51 SER C . 18351 1
548 . 1 1 51 51 SER CA C 13 61.804 0.0234 . 1 . . 163 . . 51 SER CA . 18351 1
549 . 1 1 51 51 SER CB C 13 62.723 0.035 . 1 . . 162 . . 51 SER CB . 18351 1
550 . 1 1 51 51 SER N N 15 115.471 0.067 . 1 . . 52 . . 51 SER N . 18351 1
551 . 1 1 52 52 THR H H 1 8.520 0.005 . 1 . . 72 . . 52 THR H . 18351 1
552 . 1 1 52 52 THR HA H 1 3.752 0.004 . 1 . . 494 . . 52 THR HA . 18351 1
553 . 1 1 52 52 THR HB H 1 4.260 0.005 . 1 . . 403 . . 52 THR HB . 18351 1
554 . 1 1 52 52 THR HG21 H 1 0.952 0.007 . 1 . . 585 . . 52 THR HG21 . 18351 1
555 . 1 1 52 52 THR HG22 H 1 0.952 0.007 . 1 . . 585 . . 52 THR HG22 . 18351 1
556 . 1 1 52 52 THR HG23 H 1 0.952 0.007 . 1 . . 585 . . 52 THR HG23 . 18351 1
557 . 1 1 52 52 THR C C 13 176.565 0.020174 . 1 . . 493 . . 52 THR C . 18351 1
558 . 1 1 52 52 THR CA C 13 67.127 0.047 . 1 . . 213 . . 52 THR CA . 18351 1
559 . 1 1 52 52 THR CB C 13 68.337 0.02 . 1 . . 214 . . 52 THR CB . 18351 1
560 . 1 1 52 52 THR CG2 C 13 20.694 0.039 . 1 . . 402 . . 52 THR CG2 . 18351 1
561 . 1 1 52 52 THR N N 15 121.712 0.097 . 1 . . 73 . . 52 THR N . 18351 1
562 . 1 1 53 53 CYS H H 1 7.624 0.004 . 1 . . 70 . . 53 CYS H . 18351 1
563 . 1 1 53 53 CYS HA H 1 4.513 0.003 . 1 . . 348 . . 53 CYS HA . 18351 1
564 . 1 1 53 53 CYS HB2 H 1 2.394 0.006 . 1 . . 349 . . 53 CYS HB2 . 18351 1
565 . 1 1 53 53 CYS HB3 H 1 2.273 0.001 . 1 . . 350 . . 53 CYS HB3 . 18351 1
566 . 1 1 53 53 CYS C C 13 177.488 0.029 . 1 . . 298 . . 53 CYS C . 18351 1
567 . 1 1 53 53 CYS CA C 13 54.211 0.034 . 1 . . 158 . . 53 CYS CA . 18351 1
568 . 1 1 53 53 CYS CB C 13 34.237 0.0213 . 1 . . 159 . . 53 CYS CB . 18351 1
569 . 1 1 53 53 CYS N N 15 116.803 0.067 . 1 . . 71 . . 53 CYS N . 18351 1
570 . 1 1 54 54 ALA H H 1 8.770 0.009 . 1 . . 54 . . 54 ALA H . 18351 1
571 . 1 1 54 54 ALA HA H 1 4.265 0.004 . 1 . . 372 . . 54 ALA HA . 18351 1
572 . 1 1 54 54 ALA HB1 H 1 1.409 0.003 . 1 . . 371 . . 54 ALA HB1 . 18351 1
573 . 1 1 54 54 ALA HB2 H 1 1.409 0.003 . 1 . . 371 . . 54 ALA HB2 . 18351 1
574 . 1 1 54 54 ALA HB3 H 1 1.409 0.003 . 1 . . 371 . . 54 ALA HB3 . 18351 1
575 . 1 1 54 54 ALA C C 13 181.576 0.026 . 1 . . 264 . . 54 ALA C . 18351 1
576 . 1 1 54 54 ALA CA C 13 55.394 0.0 . 1 . . 157 . . 54 ALA CA . 18351 1
577 . 1 1 54 54 ALA CB C 13 18.010 0.038 . 1 . . 156 . . 54 ALA CB . 18351 1
578 . 1 1 54 54 ALA N N 15 125.608 0.072 . 1 . . 55 . . 54 ALA N . 18351 1
579 . 1 1 55 55 ALA H H 1 7.704 0.003 . 1 . . 82 . . 55 ALA H . 18351 1
580 . 1 1 55 55 ALA HA H 1 4.105 0.003 . 1 . . 434 . . 55 ALA HA . 18351 1
581 . 1 1 55 55 ALA HB1 H 1 1.470 0.006 . 1 . . 435 . . 55 ALA HB1 . 18351 1
582 . 1 1 55 55 ALA HB2 H 1 1.470 0.006 . 1 . . 435 . . 55 ALA HB2 . 18351 1
583 . 1 1 55 55 ALA HB3 H 1 1.470 0.006 . 1 . . 435 . . 55 ALA HB3 . 18351 1
584 . 1 1 55 55 ALA C C 13 179.175 0.007 . 1 . . 263 . . 55 ALA C . 18351 1
585 . 1 1 55 55 ALA CA C 13 54.695 0.02 . 1 . . 141 . . 55 ALA CA . 18351 1
586 . 1 1 55 55 ALA CB C 13 18.421 0.032 . 1 . . 142 . . 55 ALA CB . 18351 1
587 . 1 1 55 55 ALA N N 15 120.785 0.067 . 1 . . 240 . . 55 ALA N . 18351 1
588 . 1 1 56 56 ILE H H 1 7.044 0.002 . 1 . . 25 . . 56 ILE H . 18351 1
589 . 1 1 56 56 ILE HA H 1 4.570 0.002 . 1 . . 424 . . 56 ILE HA . 18351 1
590 . 1 1 56 56 ILE HB H 1 2.142 0.004 . 1 . . 423 . . 56 ILE HB . 18351 1
591 . 1 1 56 56 ILE HG12 H 1 1.181 0.003 . 1 . . 568 . . 56 ILE HG12 . 18351 1
592 . 1 1 56 56 ILE HG13 H 1 1.179 0.004 . 1 . . 760 . . 56 ILE HG13 . 18351 1
593 . 1 1 56 56 ILE HG21 H 1 0.787 0.003 . 1 . . 543 . . 56 ILE HG21 . 18351 1
594 . 1 1 56 56 ILE HG22 H 1 0.787 0.003 . 1 . . 543 . . 56 ILE HG22 . 18351 1
595 . 1 1 56 56 ILE HG23 H 1 0.787 0.003 . 1 . . 543 . . 56 ILE HG23 . 18351 1
596 . 1 1 56 56 ILE HD11 H 1 0.664 0.003 . 1 . . 569 . . 56 ILE HD11 . 18351 1
597 . 1 1 56 56 ILE HD12 H 1 0.664 0.003 . 1 . . 569 . . 56 ILE HD12 . 18351 1
598 . 1 1 56 56 ILE HD13 H 1 0.664 0.003 . 1 . . 569 . . 56 ILE HD13 . 18351 1
599 . 1 1 56 56 ILE C C 13 176.009 0.038 . 1 . . 283 . . 56 ILE C . 18351 1
600 . 1 1 56 56 ILE CA C 13 60.493 0.049 . 1 . . 138 . . 56 ILE CA . 18351 1
601 . 1 1 56 56 ILE CB C 13 37.674 0.028 . 1 . . 139 . . 56 ILE CB . 18351 1
602 . 1 1 56 56 ILE CG1 C 13 27.142 0.025 . 1 . . 425 . . 56 ILE CG1 . 18351 1
603 . 1 1 56 56 ILE CG2 C 13 17.931 0.042 . 1 . . 426 . . 56 ILE CG2 . 18351 1
604 . 1 1 56 56 ILE CD1 C 13 14.218 0.047 . 1 . . 536 . . 56 ILE CD1 . 18351 1
605 . 1 1 56 56 ILE N N 15 108.842 0.06 . 1 . . 26 . . 56 ILE N . 18351 1
606 . 1 1 57 57 GLY H H 1 7.830 0.002 . 1 . . 109 . . 57 GLY H . 18351 1
607 . 1 1 57 57 GLY HA2 H 1 3.904 0.001 . 1 . . 381 . . 57 GLY HA2 . 18351 1
608 . 1 1 57 57 GLY HA3 H 1 3.744 0.001 . 1 . . 382 . . 57 GLY HA3 . 18351 1
609 . 1 1 57 57 GLY C C 13 174.849 0.015 . 1 . . 291 . . 57 GLY C . 18351 1
610 . 1 1 57 57 GLY CA C 13 46.488 0.006 . 1 . . 140 . . 57 GLY CA . 18351 1
611 . 1 1 57 57 GLY N N 15 109.815 0.048 . 1 . . 110 . . 57 GLY N . 18351 1
612 . 1 1 58 58 GLN H H 1 7.832 0.002 . 1 . . 33 . . 58 GLN H . 18351 1
613 . 1 1 58 58 GLN HA H 1 4.417 0.004 . 1 . . 495 . . 58 GLN HA . 18351 1
614 . 1 1 58 58 GLN HB2 H 1 1.810 0.001 . 1 . . 636 . . 58 GLN HB2 . 18351 1
615 . 1 1 58 58 GLN HB3 H 1 1.404 0.003 . 1 . . 637 . . 58 GLN HB3 . 18351 1
616 . 1 1 58 58 GLN HG2 H 1 2.317 0.003 . 1 . . 635 . . 58 GLN HG2 . 18351 1
617 . 1 1 58 58 GLN HG3 H 1 1.693 0.003 . 1 . . 788 . . 58 GLN HG3 . 18351 1
618 . 1 1 58 58 GLN HE21 H 1 7.071 0.002 . 1 . . 519 . . 58 GLN HE21 . 18351 1
619 . 1 1 58 58 GLN HE22 H 1 6.101 0.002 . 1 . . 521 . . 58 GLN HE22 . 18351 1
620 . 1 1 58 58 GLN C C 13 173.716 0.021 . 1 . . 306 . . 58 GLN C . 18351 1
621 . 1 1 58 58 GLN CA C 13 55.009 0.007 . 1 . . 144 . . 58 GLN CA . 18351 1
622 . 1 1 58 58 GLN CB C 13 32.954 0.0213 . 1 . . 143 . . 58 GLN CB . 18351 1
623 . 1 1 58 58 GLN CG C 13 34.585 0.001 . 1 . . 787 . . 58 GLN CG . 18351 1
624 . 1 1 58 58 GLN N N 15 119.935 0.06 . 1 . . 34 . . 58 GLN N . 18351 1
625 . 1 1 58 58 GLN NE2 N 15 105.168 0.076 . 1 . . 520 . . 58 GLN NE2 . 18351 1
626 . 1 1 59 59 ARG H H 1 8.855 0.002 . 1 . . 181 . . 59 ARG H . 18351 1
627 . 1 1 59 59 ARG HA H 1 4.639 0.002 . 1 . . 496 . . 59 ARG HA . 18351 1
628 . 1 1 59 59 ARG HB2 H 1 1.741 0.003 . 1 . . 715 . . 59 ARG HB2 . 18351 1
629 . 1 1 59 59 ARG HB3 H 1 1.522 0.005 . 1 . . 716 . . 59 ARG HB3 . 18351 1
630 . 1 1 59 59 ARG HG2 H 1 1.521 0.003 . 1 . . 731 . . 59 ARG HG2 . 18351 1
631 . 1 1 59 59 ARG HG3 H 1 1.188 0.005 . 1 . . 730 . . 59 ARG HG3 . 18351 1
632 . 1 1 59 59 ARG HD2 H 1 2.901 0.002 . 1 . . 596 . . 59 ARG HD2 . 18351 1
633 . 1 1 59 59 ARG HD3 H 1 2.900 0.002 . 1 . . 764 . . 59 ARG HD3 . 18351 1
634 . 1 1 59 59 ARG C C 13 174.380 0.020174 . 1 . . 277 . . 59 ARG C . 18351 1
635 . 1 1 59 59 ARG CA C 13 54.411 0.054 . 1 . . 453 . . 59 ARG CA . 18351 1
636 . 1 1 59 59 ARG CB C 13 33.320 0.018 . 1 . . 454 . . 59 ARG CB . 18351 1
637 . 1 1 59 59 ARG CG C 13 25.527 0.043 . 1 . . 597 . . 59 ARG CG . 18351 1
638 . 1 1 59 59 ARG CD C 13 44.583 0.019 . 1 . . 595 . . 59 ARG CD . 18351 1
639 . 1 1 59 59 ARG N N 15 117.593 0.058 . 1 . . 182 . . 59 ARG N . 18351 1
640 . 1 1 60 60 ALA H H 1 8.310 0.034 . 1 . . 789 . . 60 ALA H . 18351 1
641 . 1 1 60 60 ALA HA H 1 4.282 0.002 . 1 . . 455 . . 60 ALA HA . 18351 1
642 . 1 1 60 60 ALA HB1 H 1 -0.345 0.003 . 1 . . 467 . . 60 ALA HB1 . 18351 1
643 . 1 1 60 60 ALA HB2 H 1 -0.345 0.003 . 1 . . 467 . . 60 ALA HB2 . 18351 1
644 . 1 1 60 60 ALA HB3 H 1 -0.345 0.003 . 1 . . 467 . . 60 ALA HB3 . 18351 1
645 . 1 1 60 60 ALA C C 13 176.590 0.012 . 1 . . 260 . . 60 ALA C . 18351 1
646 . 1 1 60 60 ALA CA C 13 52.662 0.029 . 1 . . 451 . . 60 ALA CA . 18351 1
647 . 1 1 60 60 ALA N N 15 126.235 0.025 . 1 . . 790 . . 60 ALA N . 18351 1
648 . 1 1 61 61 ARG H H 1 8.792 0.006 . 1 . . 465 . . 61 ARG H . 18351 1
649 . 1 1 61 61 ARG HA H 1 4.577 0.004 . 1 . . 515 . . 61 ARG HA . 18351 1
650 . 1 1 61 61 ARG HB2 H 1 1.615 0.004 . 1 . . 768 . . 61 ARG HB2 . 18351 1
651 . 1 1 61 61 ARG HB3 H 1 1.422 0.0 . 1 . . 756 . . 61 ARG HB3 . 18351 1
652 . 1 1 61 61 ARG HG2 H 1 1.398 0.001 . 1 . . 769 . . 61 ARG HG2 . 18351 1
653 . 1 1 61 61 ARG HG3 H 1 1.401 0.005 . 1 . . 755 . . 61 ARG HG3 . 18351 1
654 . 1 1 61 61 ARG HD2 H 1 2.856 0.005 . 1 . . 765 . . 61 ARG HD2 . 18351 1
655 . 1 1 61 61 ARG HD3 H 1 2.538 0.004 . 1 . . 767 . . 61 ARG HD3 . 18351 1
656 . 1 1 61 61 ARG C C 13 174.707 0.012 . 1 . . 308 . . 61 ARG C . 18351 1
657 . 1 1 61 61 ARG CA C 13 53.327 0.066 . 1 . . 228 . . 61 ARG CA . 18351 1
658 . 1 1 61 61 ARG CB C 13 36.089 0.0213 . 1 . . 227 . . 61 ARG CB . 18351 1
659 . 1 1 61 61 ARG CD C 13 41.631 0.065 . 1 . . 766 . . 61 ARG CD . 18351 1
660 . 1 1 61 61 ARG N N 15 120.358 0.082 . 1 . . 466 . . 61 ARG N . 18351 1
661 . 1 1 62 62 CYS H H 1 8.536 0.003 . 1 . . 19 . . 62 CYS H . 18351 1
662 . 1 1 62 62 CYS HA H 1 5.341 0.004 . 1 . . 448 . . 62 CYS HA . 18351 1
663 . 1 1 62 62 CYS HB2 H 1 3.439 0.004 . 1 . . 449 . . 62 CYS HB2 . 18351 1
664 . 1 1 62 62 CYS HB3 H 1 2.383 0.006 . 1 . . 450 . . 62 CYS HB3 . 18351 1
665 . 1 1 62 62 CYS C C 13 175.378 0.004 . 1 . . 303 . . 62 CYS C . 18351 1
666 . 1 1 62 62 CYS CA C 13 53.434 0.027 . 1 . . 231 . . 62 CYS CA . 18351 1
667 . 1 1 62 62 CYS CB C 13 40.889 0.06 . 1 . . 226 . . 62 CYS CB . 18351 1
668 . 1 1 62 62 CYS N N 15 118.872 0.059 . 1 . . 20 . . 62 CYS N . 18351 1
669 . 1 1 63 63 CYS H H 1 9.296 0.003 . 1 . . 229 . . 63 CYS H . 18351 1
670 . 1 1 63 63 CYS HA H 1 5.658 0.007 . 1 . . 367 . . 63 CYS HA . 18351 1
671 . 1 1 63 63 CYS HB2 H 1 2.398 0.005 . 1 . . 365 . . 63 CYS HB2 . 18351 1
672 . 1 1 63 63 CYS HB3 H 1 2.971 0.005 . 1 . . 366 . . 63 CYS HB3 . 18351 1
673 . 1 1 63 63 CYS C C 13 173.530 0.083 . 1 . . 270 . . 63 CYS C . 18351 1
674 . 1 1 63 63 CYS CA C 13 56.326 0.08 . 1 . . 169 . . 63 CYS CA . 18351 1
675 . 1 1 63 63 CYS CB C 13 48.187 0.063 . 1 . . 168 . . 63 CYS CB . 18351 1
676 . 1 1 63 63 CYS N N 15 122.195 0.077 . 1 . . 230 . . 63 CYS N . 18351 1
677 . 1 1 64 64 VAL H H 1 8.571 0.003 . 1 . . 164 . . 64 VAL H . 18351 1
678 . 1 1 64 64 VAL HA H 1 4.117 0.004 . 1 . . 344 . . 64 VAL HA . 18351 1
679 . 1 1 64 64 VAL HB H 1 1.864 0.004 . 1 . . 345 . . 64 VAL HB . 18351 1
680 . 1 1 64 64 VAL HG11 H 1 0.302 0.003 . 1 . . 561 . . 64 VAL HG11 . 18351 1
681 . 1 1 64 64 VAL HG12 H 1 0.302 0.003 . 1 . . 561 . . 64 VAL HG12 . 18351 1
682 . 1 1 64 64 VAL HG13 H 1 0.302 0.003 . 1 . . 561 . . 64 VAL HG13 . 18351 1
683 . 1 1 64 64 VAL HG21 H 1 0.606 0.003 . 1 . . 562 . . 64 VAL HG21 . 18351 1
684 . 1 1 64 64 VAL HG22 H 1 0.606 0.003 . 1 . . 562 . . 64 VAL HG22 . 18351 1
685 . 1 1 64 64 VAL HG23 H 1 0.606 0.003 . 1 . . 562 . . 64 VAL HG23 . 18351 1
686 . 1 1 64 64 VAL C C 13 176.051 0.047 . 1 . . 258 . . 64 VAL C . 18351 1
687 . 1 1 64 64 VAL CA C 13 61.829 0.01 . 1 . . 166 . . 64 VAL CA . 18351 1
688 . 1 1 64 64 VAL CB C 13 32.260 0.011 . 1 . . 167 . . 64 VAL CB . 18351 1
689 . 1 1 64 64 VAL CG1 C 13 20.460 0.019 . 1 . . 343 . . 64 VAL CG1 . 18351 1
690 . 1 1 64 64 VAL CG2 C 13 20.991 0.013 . 1 . . 667 . . 64 VAL CG2 . 18351 1
691 . 1 1 64 64 VAL N N 15 121.732 0.078 . 1 . . 165 . . 64 VAL N . 18351 1
692 . 1 1 65 65 LEU H H 1 8.020 0.003 . 1 . . 9 . . 65 LEU H . 18351 1
693 . 1 1 65 65 LEU HA H 1 4.195 0.0 . 1 . . 497 . . 65 LEU HA . 18351 1
694 . 1 1 65 65 LEU HB2 H 1 1.444 0.005 . 1 . . 621 . . 65 LEU HB2 . 18351 1
695 . 1 1 65 65 LEU HB3 H 1 1.374 0.001 . 1 . . 616 . . 65 LEU HB3 . 18351 1
696 . 1 1 65 65 LEU HG H 1 1.434 0.001 . 1 . . 617 . . 65 LEU HG . 18351 1
697 . 1 1 65 65 LEU HD11 H 1 0.679 0.001 . 1 . . 619 . . 65 LEU HD11 . 18351 1
698 . 1 1 65 65 LEU HD12 H 1 0.679 0.001 . 1 . . 619 . . 65 LEU HD12 . 18351 1
699 . 1 1 65 65 LEU HD13 H 1 0.679 0.001 . 1 . . 619 . . 65 LEU HD13 . 18351 1
700 . 1 1 65 65 LEU HD21 H 1 0.775 0.002 . 1 . . 618 . . 65 LEU HD21 . 18351 1
701 . 1 1 65 65 LEU HD22 H 1 0.775 0.002 . 1 . . 618 . . 65 LEU HD22 . 18351 1
702 . 1 1 65 65 LEU HD23 H 1 0.775 0.002 . 1 . . 618 . . 65 LEU HD23 . 18351 1
703 . 1 1 65 65 LEU C C 13 175.887 0.020174 . 1 . . 259 . . 65 LEU C . 18351 1
704 . 1 1 65 65 LEU CA C 13 53.788 0.0 . 1 . . 225 . . 65 LEU CA . 18351 1
705 . 1 1 65 65 LEU CB C 13 41.515 0.0213 . 1 . . 224 . . 65 LEU CB . 18351 1
706 . 1 1 65 65 LEU CG C 13 26.989 0.0 . 1 . . 573 . . 65 LEU CG . 18351 1
707 . 1 1 65 65 LEU CD1 C 13 24.378 0.0 . 1 . . 620 . . 65 LEU CD1 . 18351 1
708 . 1 1 65 65 LEU CD2 C 13 24.888 0.001 . 1 . . 574 . . 65 LEU CD2 . 18351 1
709 . 1 1 65 65 LEU N N 15 127.175 0.054 . 1 . . 10 . . 65 LEU N . 18351 1
710 . 1 1 66 66 PRO HA H 1 4.194 0.001 . 1 . . 361 . . 66 PRO HA . 18351 1
711 . 1 1 66 66 PRO HB2 H 1 1.966 0.002 . 1 . . 360 . . 66 PRO HB2 . 18351 1
712 . 1 1 66 66 PRO HB3 H 1 1.727 0.001 . 1 . . 359 . . 66 PRO HB3 . 18351 1
713 . 1 1 66 66 PRO HG2 H 1 1.840 0.003 . 1 . . 754 . . 66 PRO HG2 . 18351 1
714 . 1 1 66 66 PRO HG3 H 1 1.685 0.001 . 1 . . 773 . . 66 PRO HG3 . 18351 1
715 . 1 1 66 66 PRO HD2 H 1 3.699 0.003 . 1 . . 770 . . 66 PRO HD2 . 18351 1
716 . 1 1 66 66 PRO HD3 H 1 3.499 0.002 . 1 . . 772 . . 66 PRO HD3 . 18351 1
717 . 1 1 66 66 PRO C C 13 176.853 0.024 . 1 . . 261 . . 66 PRO C . 18351 1
718 . 1 1 66 66 PRO CA C 13 63.293 0.003 . 1 . . 222 . . 66 PRO CA . 18351 1
719 . 1 1 66 66 PRO CB C 13 32.526 0.017 . 1 . . 219 . . 66 PRO CB . 18351 1
720 . 1 1 66 66 PRO CG C 13 27.115 0.0 . 1 . . 358 . . 66 PRO CG . 18351 1
721 . 1 1 66 66 PRO CD C 13 51.503 0.015 . 1 . . 771 . . 66 PRO CD . 18351 1
722 . 1 1 67 67 ILE H H 1 8.096 0.004 . 1 . . 3 . . 67 ILE H . 18351 1
723 . 1 1 67 67 ILE HA H 1 4.052 0.004 . 1 . . 499 . . 67 ILE HA . 18351 1
724 . 1 1 67 67 ILE HB H 1 1.492 0.002 . 1 . . 501 . . 67 ILE HB . 18351 1
725 . 1 1 67 67 ILE HG12 H 1 1.275 0.004 . 1 . . 548 . . 67 ILE HG12 . 18351 1
726 . 1 1 67 67 ILE HG13 H 1 0.923 0.004 . 1 . . 549 . . 67 ILE HG13 . 18351 1
727 . 1 1 67 67 ILE HG21 H 1 0.727 0.004 . 1 . . 550 . . 67 ILE HG21 . 18351 1
728 . 1 1 67 67 ILE HG22 H 1 0.727 0.004 . 1 . . 550 . . 67 ILE HG22 . 18351 1
729 . 1 1 67 67 ILE HG23 H 1 0.727 0.004 . 1 . . 550 . . 67 ILE HG23 . 18351 1
730 . 1 1 67 67 ILE HD11 H 1 0.671 0.003 . 1 . . 544 . . 67 ILE HD11 . 18351 1
731 . 1 1 67 67 ILE HD12 H 1 0.671 0.003 . 1 . . 544 . . 67 ILE HD12 . 18351 1
732 . 1 1 67 67 ILE HD13 H 1 0.671 0.003 . 1 . . 544 . . 67 ILE HD13 . 18351 1
733 . 1 1 67 67 ILE C C 13 175.917 0.014 . 1 . . 498 . . 67 ILE C . 18351 1
734 . 1 1 67 67 ILE CA C 13 60.128 0.012 . 1 . . 221 . . 67 ILE CA . 18351 1
735 . 1 1 67 67 ILE CB C 13 40.542 0.02 . 1 . . 220 . . 67 ILE CB . 18351 1
736 . 1 1 67 67 ILE CG1 C 13 27.044 0.023 . 1 . . 534 . . 67 ILE CG1 . 18351 1
737 . 1 1 67 67 ILE CG2 C 13 17.353 0.021 . 1 . . 533 . . 67 ILE CG2 . 18351 1
738 . 1 1 67 67 ILE CD1 C 13 13.145 0.059 . 1 . . 535 . . 67 ILE CD1 . 18351 1
739 . 1 1 67 67 ILE N N 15 122.787 0.091 . 1 . . 4 . . 67 ILE N . 18351 1
740 . 1 1 68 68 LEU H H 1 8.326 0.003 . 1 . . 78 . . 68 LEU H . 18351 1
741 . 1 1 68 68 LEU HA H 1 3.978 0.003 . 1 . . 500 . . 68 LEU HA . 18351 1
742 . 1 1 68 68 LEU HB2 H 1 1.490 0.001 . 1 . . 504 . . 68 LEU HB2 . 18351 1
743 . 1 1 68 68 LEU HB3 H 1 1.427 0.0 . 1 . . 732 . . 68 LEU HB3 . 18351 1
744 . 1 1 68 68 LEU HG H 1 1.476 0.004 . 1 . . 624 . . 68 LEU HG . 18351 1
745 . 1 1 68 68 LEU HD11 H 1 0.758 0.0 . 1 . . 623 . . 68 LEU HD11 . 18351 1
746 . 1 1 68 68 LEU HD12 H 1 0.758 0.0 . 1 . . 623 . . 68 LEU HD12 . 18351 1
747 . 1 1 68 68 LEU HD13 H 1 0.758 0.0 . 1 . . 623 . . 68 LEU HD13 . 18351 1
748 . 1 1 68 68 LEU HD21 H 1 0.802 0.001 . 1 . . 622 . . 68 LEU HD21 . 18351 1
749 . 1 1 68 68 LEU HD22 H 1 0.802 0.001 . 1 . . 622 . . 68 LEU HD22 . 18351 1
750 . 1 1 68 68 LEU HD23 H 1 0.802 0.001 . 1 . . 622 . . 68 LEU HD23 . 18351 1
751 . 1 1 68 68 LEU C C 13 178.124 0.006 . 1 . . 279 . . 68 LEU C . 18351 1
752 . 1 1 68 68 LEU CA C 13 56.960 0.016 . 1 . . 121 . . 68 LEU CA . 18351 1
753 . 1 1 68 68 LEU CB C 13 41.520 0.015 . 1 . . 420 . . 68 LEU CB . 18351 1
754 . 1 1 68 68 LEU CG C 13 27.006 0.072 . 1 . . 503 . . 68 LEU CG . 18351 1
755 . 1 1 68 68 LEU CD1 C 13 24.457 0.0193 . 1 . . 502 . . 68 LEU CD1 . 18351 1
756 . 1 1 68 68 LEU CD2 C 13 24.507 0.017 . 1 . . 762 . . 68 LEU CD2 . 18351 1
757 . 1 1 68 68 LEU N N 15 126.490 0.077 . 1 . . 79 . . 68 LEU N . 18351 1
758 . 1 1 69 69 GLY H H 1 8.816 0.004 . 1 . . 47 . . 69 GLY H . 18351 1
759 . 1 1 69 69 GLY HA2 H 1 4.074 0.001 . 1 . . 505 . . 69 GLY HA2 . 18351 1
760 . 1 1 69 69 GLY HA3 H 1 3.556 0.001 . 1 . . 386 . . 69 GLY HA3 . 18351 1
761 . 1 1 69 69 GLY C C 13 174.038 0.036 . 1 . . 250 . . 69 GLY C . 18351 1
762 . 1 1 69 69 GLY CA C 13 45.221 0.0234 . 1 . . 120 . . 69 GLY CA . 18351 1
763 . 1 1 69 69 GLY N N 15 113.021 0.082 . 1 . . 48 . . 69 GLY N . 18351 1
764 . 1 1 70 70 GLN H H 1 7.932 0.002 . 1 . . 13 . . 70 GLN H . 18351 1
765 . 1 1 70 70 GLN HA H 1 4.449 0.004 . 1 . . 506 . . 70 GLN HA . 18351 1
766 . 1 1 70 70 GLN HB2 H 1 2.043 0.005 . 1 . . 662 . . 70 GLN HB2 . 18351 1
767 . 1 1 70 70 GLN HB3 H 1 1.839 0.003 . 1 . . 507 . . 70 GLN HB3 . 18351 1
768 . 1 1 70 70 GLN HG2 H 1 2.154 0.004 . 1 . . 664 . . 70 GLN HG2 . 18351 1
769 . 1 1 70 70 GLN HG3 H 1 2.153 0.004 . 1 . . 663 . . 70 GLN HG3 . 18351 1
770 . 1 1 70 70 GLN HE21 H 1 7.568 0.0 . 1 . . 591 . . 70 GLN HE21 . 18351 1
771 . 1 1 70 70 GLN HE22 H 1 6.786 0.001 . 1 . . 593 . . 70 GLN HE22 . 18351 1
772 . 1 1 70 70 GLN C C 13 175.510 0.0 . 1 . . 249 . . 70 GLN C . 18351 1
773 . 1 1 70 70 GLN CA C 13 54.235 0.005 . 1 . . 211 . . 70 GLN CA . 18351 1
774 . 1 1 70 70 GLN CB C 13 30.773 0.009 . 1 . . 212 . . 70 GLN CB . 18351 1
775 . 1 1 70 70 GLN CG C 13 33.893 0.021 . 1 . . 661 . . 70 GLN CG . 18351 1
776 . 1 1 70 70 GLN N N 15 119.303 0.062 . 1 . . 14 . . 70 GLN N . 18351 1
777 . 1 1 70 70 GLN NE2 N 15 113.138 0.025 . 1 . . 592 . . 70 GLN NE2 . 18351 1
778 . 1 1 71 71 ASP H H 1 8.440 0.004 . 1 . . 27 . . 71 ASP H . 18351 1
779 . 1 1 71 71 ASP HA H 1 4.457 0.001 . 1 . . 322 . . 71 ASP HA . 18351 1
780 . 1 1 71 71 ASP HB2 H 1 2.609 0.002 . 1 . . 323 . . 71 ASP HB2 . 18351 1
781 . 1 1 71 71 ASP HB3 H 1 2.367 0.005 . 1 . . 324 . . 71 ASP HB3 . 18351 1
782 . 1 1 71 71 ASP C C 13 176.149 0.024 . 1 . . 267 . . 71 ASP C . 18351 1
783 . 1 1 71 71 ASP CA C 13 54.481 0.001 . 1 . . 202 . . 71 ASP CA . 18351 1
784 . 1 1 71 71 ASP CB C 13 40.982 0.0 . 1 . . 201 . . 71 ASP CB . 18351 1
785 . 1 1 71 71 ASP N N 15 122.994 0.1 . 1 . . 28 . . 71 ASP N . 18351 1
786 . 1 1 72 72 ILE H H 1 8.464 0.002 . 1 . . 35 . . 72 ILE H . 18351 1
787 . 1 1 72 72 ILE HA H 1 4.045 0.002 . 1 . . 312 . . 72 ILE HA . 18351 1
788 . 1 1 72 72 ILE HB H 1 1.666 0.004 . 1 . . 313 . . 72 ILE HB . 18351 1
789 . 1 1 72 72 ILE HG12 H 1 1.556 0.004 . 1 . . 554 . . 72 ILE HG12 . 18351 1
790 . 1 1 72 72 ILE HG13 H 1 1.169 0.003 . 1 . . 555 . . 72 ILE HG13 . 18351 1
791 . 1 1 72 72 ILE HG21 H 1 0.848 0.003 . 1 . . 556 . . 72 ILE HG21 . 18351 1
792 . 1 1 72 72 ILE HG22 H 1 0.848 0.003 . 1 . . 556 . . 72 ILE HG22 . 18351 1
793 . 1 1 72 72 ILE HG23 H 1 0.848 0.003 . 1 . . 556 . . 72 ILE HG23 . 18351 1
794 . 1 1 72 72 ILE HD11 H 1 0.746 0.001 . 1 . . 557 . . 72 ILE HD11 . 18351 1
795 . 1 1 72 72 ILE HD12 H 1 0.746 0.001 . 1 . . 557 . . 72 ILE HD12 . 18351 1
796 . 1 1 72 72 ILE HD13 H 1 0.746 0.001 . 1 . . 557 . . 72 ILE HD13 . 18351 1
797 . 1 1 72 72 ILE C C 13 174.143 0.023 . 1 . . 245 . . 72 ILE C . 18351 1
798 . 1 1 72 72 ILE CA C 13 61.703 0.053 . 1 . . 199 . . 72 ILE CA . 18351 1
799 . 1 1 72 72 ILE CB C 13 39.691 0.018 . 1 . . 200 . . 72 ILE CB . 18351 1
800 . 1 1 72 72 ILE CG1 C 13 29.541 0.018 . 1 . . 341 . . 72 ILE CG1 . 18351 1
801 . 1 1 72 72 ILE CG2 C 13 17.879 0.024 . 1 . . 340 . . 72 ILE CG2 . 18351 1
802 . 1 1 72 72 ILE CD1 C 13 14.178 0.001 . 1 . . 542 . . 72 ILE CD1 . 18351 1
803 . 1 1 72 72 ILE N N 15 124.268 0.07 . 1 . . 36 . . 72 ILE N . 18351 1
804 . 1 1 73 73 LEU H H 1 7.761 0.003 . 1 . . 62 . . 73 LEU H . 18351 1
805 . 1 1 73 73 LEU HA H 1 4.761 0.006 . 1 . . 508 . . 73 LEU HA . 18351 1
806 . 1 1 73 73 LEU HB2 H 1 1.543 0.004 . 1 . . 385 . . 73 LEU HB2 . 18351 1
807 . 1 1 73 73 LEU HB3 H 1 1.543 0.003 . 1 . . 626 . . 73 LEU HB3 . 18351 1
808 . 1 1 73 73 LEU HG H 1 1.546 0.005 . 1 . . 625 . . 73 LEU HG . 18351 1
809 . 1 1 73 73 LEU HD11 H 1 0.796 0.005 . 1 . . 578 . . 73 LEU HD11 . 18351 1
810 . 1 1 73 73 LEU HD12 H 1 0.796 0.005 . 1 . . 578 . . 73 LEU HD12 . 18351 1
811 . 1 1 73 73 LEU HD13 H 1 0.796 0.005 . 1 . . 578 . . 73 LEU HD13 . 18351 1
812 . 1 1 73 73 LEU HD21 H 1 0.800 0.006 . 1 . . 579 . . 73 LEU HD21 . 18351 1
813 . 1 1 73 73 LEU HD22 H 1 0.800 0.006 . 1 . . 579 . . 73 LEU HD22 . 18351 1
814 . 1 1 73 73 LEU HD23 H 1 0.800 0.006 . 1 . . 579 . . 73 LEU HD23 . 18351 1
815 . 1 1 73 73 LEU C C 13 175.850 0.011 . 1 . . 246 . . 73 LEU C . 18351 1
816 . 1 1 73 73 LEU CA C 13 54.257 0.063 . 1 . . 125 . . 73 LEU CA . 18351 1
817 . 1 1 73 73 LEU CB C 13 44.317 0.022 . 1 . . 126 . . 73 LEU CB . 18351 1
818 . 1 1 73 73 LEU CG C 13 26.818 0.04 . 1 . . 575 . . 73 LEU CG . 18351 1
819 . 1 1 73 73 LEU CD1 C 13 24.032 0.002 . 1 . . 577 . . 73 LEU CD1 . 18351 1
820 . 1 1 73 73 LEU CD2 C 13 25.230 0.03 . 1 . . 576 . . 73 LEU CD2 . 18351 1
821 . 1 1 73 73 LEU N N 15 129.093 0.069 . 1 . . 63 . . 73 LEU N . 18351 1
822 . 1 1 74 74 CYS H H 1 8.483 0.002 . 1 . . 74 . . 74 CYS H . 18351 1
823 . 1 1 74 74 CYS HA H 1 5.665 0.006 . 1 . . 399 . . 74 CYS HA . 18351 1
824 . 1 1 74 74 CYS HB2 H 1 3.361 0.009 . 1 . . 400 . . 74 CYS HB2 . 18351 1
825 . 1 1 74 74 CYS HB3 H 1 2.693 0.008 . 1 . . 401 . . 74 CYS HB3 . 18351 1
826 . 1 1 74 74 CYS C C 13 172.440 0.068 . 1 . . 293 . . 74 CYS C . 18351 1
827 . 1 1 74 74 CYS CA C 13 55.962 0.033 . 1 . . 128 . . 74 CYS CA . 18351 1
828 . 1 1 74 74 CYS CB C 13 50.510 0.044 . 1 . . 127 . . 74 CYS CB . 18351 1
829 . 1 1 74 74 CYS N N 15 119.585 0.066 . 1 . . 75 . . 74 CYS N . 18351 1
830 . 1 1 75 75 GLN H H 1 9.112 0.003 . 1 . . 93 . . 75 GLN H . 18351 1
831 . 1 1 75 75 GLN HA H 1 4.462 0.004 . 1 . . 378 . . 75 GLN HA . 18351 1
832 . 1 1 75 75 GLN HB2 H 1 1.526 0.004 . 1 . . 377 . . 75 GLN HB2 . 18351 1
833 . 1 1 75 75 GLN HB3 H 1 1.526 0.003 . 1 . . 733 . . 75 GLN HB3 . 18351 1
834 . 1 1 75 75 GLN HG3 H 1 1.682 0.003 . 1 . . 672 . . 75 GLN HG3 . 18351 1
835 . 1 1 75 75 GLN HE21 H 1 6.711 0.002 . 1 . . 678 . . 75 GLN HE21 . 18351 1
836 . 1 1 75 75 GLN HE22 H 1 6.356 0.002 . 1 . . 680 . . 75 GLN HE22 . 18351 1
837 . 1 1 75 75 GLN C C 13 174.389 0.012 . 1 . . 292 . . 75 GLN C . 18351 1
838 . 1 1 75 75 GLN CA C 13 53.856 0.096 . 1 . . 122 . . 75 GLN CA . 18351 1
839 . 1 1 75 75 GLN CB C 13 31.997 0.055 . 1 . . 509 . . 75 GLN CB . 18351 1
840 . 1 1 75 75 GLN N N 15 117.513 0.09 . 1 . . 94 . . 75 GLN N . 18351 1
841 . 1 1 75 75 GLN NE2 N 15 110.144 0.052 . 1 . . 679 . . 75 GLN NE2 . 18351 1
842 . 1 1 76 76 THR H H 1 8.384 0.003 . 1 . . 102 . . 76 THR H . 18351 1
843 . 1 1 76 76 THR HA H 1 4.239 0.004 . 1 . . 511 . . 76 THR HA . 18351 1
844 . 1 1 76 76 THR HB H 1 3.708 0.001 . 1 . . 582 . . 76 THR HB . 18351 1
845 . 1 1 76 76 THR HG21 H 1 1.227 0.003 . 1 . . 735 . . 76 THR HG21 . 18351 1
846 . 1 1 76 76 THR HG22 H 1 1.227 0.003 . 1 . . 735 . . 76 THR HG22 . 18351 1
847 . 1 1 76 76 THR HG23 H 1 1.227 0.003 . 1 . . 735 . . 76 THR HG23 . 18351 1
848 . 1 1 76 76 THR C C 13 173.130 0.020174 . 1 . . 510 . . 76 THR C . 18351 1
849 . 1 1 76 76 THR CA C 13 62.125 0.021 . 1 . . 124 . . 76 THR CA . 18351 1
850 . 1 1 76 76 THR CB C 13 70.192 0.0 . 1 . . 123 . . 76 THR CB . 18351 1
851 . 1 1 76 76 THR CG2 C 13 21.994 0.033 . 1 . . 736 . . 76 THR CG2 . 18351 1
852 . 1 1 76 76 THR N N 15 120.701 0.069 . 1 . . 103 . . 76 THR N . 18351 1
853 . 1 1 77 77 PRO HA H 1 4.321 0.002 . 1 . . 712 . . 77 PRO HA . 18351 1
854 . 1 1 77 77 PRO HB2 H 1 2.425 0.003 . 1 . . 713 . . 77 PRO HB2 . 18351 1
855 . 1 1 77 77 PRO HB3 H 1 1.649 0.002 . 1 . . 714 . . 77 PRO HB3 . 18351 1
856 . 1 1 77 77 PRO HG2 H 1 1.756 0.004 . 1 . . 784 . . 77 PRO HG2 . 18351 1
857 . 1 1 77 77 PRO HG3 H 1 1.289 0.003 . 1 . . 783 . . 77 PRO HG3 . 18351 1
858 . 1 1 77 77 PRO HD2 H 1 4.095 0.004 . 1 . . 786 . . 77 PRO HD2 . 18351 1
859 . 1 1 77 77 PRO HD3 H 1 3.251 0.004 . 1 . . 757 . . 77 PRO HD3 . 18351 1
860 . 1 1 77 77 PRO C C 13 175.701 0.029 . 1 . . 708 . . 77 PRO C . 18351 1
861 . 1 1 77 77 PRO CA C 13 62.693 0.005 . 1 . . 705 . . 77 PRO CA . 18351 1
862 . 1 1 77 77 PRO CB C 13 32.359 0.003 . 1 . . 706 . . 77 PRO CB . 18351 1
863 . 1 1 77 77 PRO CG C 13 29.001 0.0 . 1 . . 707 . . 77 PRO CG . 18351 1
864 . 1 1 77 77 PRO CD C 13 52.491 0.042 . 1 . . 785 . . 77 PRO CD . 18351 1
865 . 1 1 78 78 ALA H H 1 9.035 0.003 . 1 . . 681 . . 78 ALA H . 18351 1
866 . 1 1 78 78 ALA HA H 1 4.086 0.002 . 1 . . 689 . . 78 ALA HA . 18351 1
867 . 1 1 78 78 ALA HB1 H 1 1.320 0.002 . 1 . . 422 . . 78 ALA HB1 . 18351 1
868 . 1 1 78 78 ALA HB2 H 1 1.320 0.002 . 1 . . 422 . . 78 ALA HB2 . 18351 1
869 . 1 1 78 78 ALA HB3 H 1 1.320 0.002 . 1 . . 422 . . 78 ALA HB3 . 18351 1
870 . 1 1 78 78 ALA C C 13 178.904 0.015 . 1 . . 682 . . 78 ALA C . 18351 1
871 . 1 1 78 78 ALA CA C 13 53.906 0.0234 . 1 . . 421 . . 78 ALA CA . 18351 1
872 . 1 1 78 78 ALA CB C 13 18.505 0.01 . 1 . . 683 . . 78 ALA CB . 18351 1
873 . 1 1 78 78 ALA N N 15 125.693 0.067 . 1 . . 108 . . 78 ALA N . 18351 1
874 . 1 1 79 79 GLY H H 1 8.628 0.004 . 1 . . 685 . . 79 GLY H . 18351 1
875 . 1 1 79 79 GLY HA2 H 1 4.078 0.006 . 1 . . 684 . . 79 GLY HA2 . 18351 1
876 . 1 1 79 79 GLY HA3 H 1 3.548 0.002 . 1 . . 690 . . 79 GLY HA3 . 18351 1
877 . 1 1 79 79 GLY C C 13 173.270 0.051 . 1 . . 687 . . 79 GLY C . 18351 1
878 . 1 1 79 79 GLY CA C 13 45.126 0.0 . 1 . . 688 . . 79 GLY CA . 18351 1
879 . 1 1 79 79 GLY N N 15 110.649 0.067 . 1 . . 686 . . 79 GLY N . 18351 1
880 . 1 1 80 80 LEU H H 1 7.430 0.002 . 1 . . 691 . . 80 LEU H . 18351 1
881 . 1 1 80 80 LEU HA H 1 4.252 0.003 . 1 . . 696 . . 80 LEU HA . 18351 1
882 . 1 1 80 80 LEU HB2 H 1 1.437 0.002 . 1 . . 701 . . 80 LEU HB2 . 18351 1
883 . 1 1 80 80 LEU HB3 H 1 1.438 0.004 . 1 . . 700 . . 80 LEU HB3 . 18351 1
884 . 1 1 80 80 LEU HG H 1 1.236 0.001 . 1 . . 702 . . 80 LEU HG . 18351 1
885 . 1 1 80 80 LEU HD11 H 1 0.611 0.003 . 1 . . 703 . . 80 LEU HD11 . 18351 1
886 . 1 1 80 80 LEU HD12 H 1 0.611 0.003 . 1 . . 703 . . 80 LEU HD12 . 18351 1
887 . 1 1 80 80 LEU HD13 H 1 0.611 0.003 . 1 . . 703 . . 80 LEU HD13 . 18351 1
888 . 1 1 80 80 LEU HD21 H 1 0.666 0.001 . 1 . . 704 . . 80 LEU HD21 . 18351 1
889 . 1 1 80 80 LEU HD22 H 1 0.666 0.001 . 1 . . 704 . . 80 LEU HD22 . 18351 1
890 . 1 1 80 80 LEU HD23 H 1 0.666 0.001 . 1 . . 704 . . 80 LEU HD23 . 18351 1
891 . 1 1 80 80 LEU C C 13 181.482 0.020174 . 1 . . 695 . . 80 LEU C . 18351 1
892 . 1 1 80 80 LEU CA C 13 55.449 0.001 . 1 . . 694 . . 80 LEU CA . 18351 1
893 . 1 1 80 80 LEU CB C 13 43.562 0.039 . 1 . . 693 . . 80 LEU CB . 18351 1
894 . 1 1 80 80 LEU CG C 13 27.622 0.0 . 1 . . 697 . . 80 LEU CG . 18351 1
895 . 1 1 80 80 LEU CD1 C 13 25.430 0.001 . 1 . . 698 . . 80 LEU CD1 . 18351 1
896 . 1 1 80 80 LEU CD2 C 13 22.485 0.012 . 1 . . 699 . . 80 LEU CD2 . 18351 1
897 . 1 1 80 80 LEU N N 15 126.618 0.058 . 1 . . 692 . . 80 LEU N . 18351 1
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