Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 19172
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 19172 1
2 '2D 1H-13C HSQC' . . . 19172 1
3 '3D HNCO' . . . 19172 1
4 '3D HNCACB' . . . 19172 1
5 '3D CBCA(CO)NH' . . . 19172 1
6 '3D HBHA(CO)NH' . . . 19172 1
7 '3D HCCH-TOCSY' . . . 19172 1
8 '3D C(CO)NH' . . . 19172 1
9 HBCBCGCDHD . . . 19172 1
10 HBCBCGCDCEHE . . . 19172 1
11 '3D 1H-15N NOESY' . . . 19172 1
12 '3D 1H-13C NOESY' . . . 19172 1
13 '2D 1H-1H NOESY' . . . 19172 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 3 3 HIS HA H 1 4.65641 0.00108 . 1 . . . . 3 His Ha . 19172 1
2 . 1 1 3 3 HIS HB2 H 1 3.07322 0.00159 . 1 . . . . 3 His Hb2 . 19172 1
3 . 1 1 3 3 HIS HB3 H 1 3.14060 0.00138 . 1 . . . . 3 His Hb3 . 19172 1
4 . 1 1 3 3 HIS HD2 H 1 7.05138 0.08 . 1 . . . . 3 His Hd2 . 19172 1
5 . 1 1 3 3 HIS C C 13 175.28853 0.08 . 1 . . . . 3 His C . 19172 1
6 . 1 1 3 3 HIS CA C 13 56.20639 0.04252 . 1 . . . . 3 His Ca . 19172 1
7 . 1 1 3 3 HIS CB C 13 30.16201 0.06711 . 1 . . . . 3 His Cb . 19172 1
8 . 1 1 3 3 HIS CD2 C 13 119.90796 0.08 . 1 . . . . 3 His Cd2 . 19172 1
9 . 1 1 4 4 MET H H 1 8.36343 0.00993 . 1 . . . . 4 Met H . 19172 1
10 . 1 1 4 4 MET HA H 1 4.30056 0.00241 . 1 . . . . 4 Met Ha . 19172 1
11 . 1 1 4 4 MET HB2 H 1 1.75849 1.45723e-04 . 1 . . . . 4 Met Hb2 . 19172 1
12 . 1 1 4 4 MET HB3 H 1 1.82835 1.71256e-04 . 1 . . . . 4 Met Hb3 . 19172 1
13 . 1 1 4 4 MET HG2 H 1 2.27785 4.07983e-04 . 1 . . . . 4 Met Hg2 . 19172 1
14 . 1 1 4 4 MET HG3 H 1 2.27785 4.07983e-04 . 1 . . . . 4 Met Hg3 . 19172 1
15 . 1 1 4 4 MET HE1 H 1 1.38477 0.00111 . 1 . . . . 4 Met He* . 19172 1
16 . 1 1 4 4 MET HE2 H 1 1.38477 0.00111 . 1 . . . . 4 Met He* . 19172 1
17 . 1 1 4 4 MET HE3 H 1 1.38477 0.00111 . 1 . . . . 4 Met He* . 19172 1
18 . 1 1 4 4 MET C C 13 175.90344 0.08 . 1 . . . . 4 Met C . 19172 1
19 . 1 1 4 4 MET CA C 13 55.98334 0.02106 . 1 . . . . 4 Met Ca . 19172 1
20 . 1 1 4 4 MET CB C 13 32.40644 0.05124 . 1 . . . . 4 Met Cb . 19172 1
21 . 1 1 4 4 MET CG C 13 31.70459 0.00204 . 1 . . . . 4 Met Cg . 19172 1
22 . 1 1 4 4 MET CE C 13 16.54837 0.07322 . 1 . . . . 4 Met Ce . 19172 1
23 . 1 1 4 4 MET N N 15 121.97587 0.00702 . 1 . . . . 4 Met N . 19172 1
24 . 1 1 5 5 THR H H 1 7.78956 0.00207 . 1 . . . . 5 Thr H . 19172 1
25 . 1 1 5 5 THR HA H 1 4.18484 0.00159 . 1 . . . . 5 Thr Ha . 19172 1
26 . 1 1 5 5 THR HB H 1 3.92042 0.00260 . 1 . . . . 5 Thr Hb . 19172 1
27 . 1 1 5 5 THR HG21 H 1 0.82371 1.40934e-04 . 1 . . . . 5 Thr Hg2* . 19172 1
28 . 1 1 5 5 THR HG22 H 1 0.82371 1.40934e-04 . 1 . . . . 5 Thr Hg2* . 19172 1
29 . 1 1 5 5 THR HG23 H 1 0.82371 1.40934e-04 . 1 . . . . 5 Thr Hg2* . 19172 1
30 . 1 1 5 5 THR C C 13 173.78847 0.08 . 1 . . . . 5 Thr C . 19172 1
31 . 1 1 5 5 THR CA C 13 61.84447 0.06416 . 1 . . . . 5 Thr Ca . 19172 1
32 . 1 1 5 5 THR CB C 13 68.89583 0.04094 . 1 . . . . 5 Thr Cb . 19172 1
33 . 1 1 5 5 THR CG2 C 13 21.07826 5.42154e-04 . 1 . . . . 5 Thr Cg2 . 19172 1
34 . 1 1 5 5 THR N N 15 114.33902 0.02764 . 1 . . . . 5 Thr N . 19172 1
35 . 1 1 6 6 SER H H 1 8.17681 0.00273 . 1 . . . . 6 Ser H . 19172 1
36 . 1 1 6 6 SER HA H 1 4.37193 0.00279 . 1 . . . . 6 Ser Ha . 19172 1
37 . 1 1 6 6 SER HB2 H 1 3.75080 0.00702 . 1 . . . . 6 Ser Hb2 . 19172 1
38 . 1 1 6 6 SER HB3 H 1 3.84449 0.01198 . 1 . . . . 6 Ser Hb3 . 19172 1
39 . 1 1 6 6 SER C C 13 174.48625 0.08 . 1 . . . . 6 Ser C . 19172 1
40 . 1 1 6 6 SER CA C 13 58.22988 0.07461 . 1 . . . . 6 Ser Ca . 19172 1
41 . 1 1 6 6 SER CB C 13 63.84664 0.06060 . 1 . . . . 6 Ser Cb . 19172 1
42 . 1 1 6 6 SER N N 15 118.25611 0.01761 . 1 . . . . 6 Ser N . 19172 1
43 . 1 1 7 7 GLU H H 1 7.83462 0.00677 . 1 . . . . 7 Glu H . 19172 1
44 . 1 1 7 7 GLU HA H 1 3.98403 0.00533 . 1 . . . . 7 Glu Ha . 19172 1
45 . 1 1 7 7 GLU HB2 H 1 0.44082 0.00809 . 1 . . . . 7 Glu Hb2 . 19172 1
46 . 1 1 7 7 GLU HB3 H 1 0.53641 0.00294 . 1 . . . . 7 Glu Hb3 . 19172 1
47 . 1 1 7 7 GLU HG2 H 1 1.93701 0.00285 . 1 . . . . 7 Glu Hg2 . 19172 1
48 . 1 1 7 7 GLU HG3 H 1 2.00314 0.00386 . 1 . . . . 7 Glu Hg3 . 19172 1
49 . 1 1 7 7 GLU C C 13 178.09817 0.08 . 1 . . . . 7 Glu C . 19172 1
50 . 1 1 7 7 GLU CA C 13 55.98136 0.08396 . 1 . . . . 7 Glu Ca . 19172 1
51 . 1 1 7 7 GLU CB C 13 28.20654 0.16969 . 1 . . . . 7 Glu Cb . 19172 1
52 . 1 1 7 7 GLU CG C 13 35.62373 0.12065 . 1 . . . . 7 Glu Cg . 19172 1
53 . 1 1 7 7 GLU N N 15 122.19229 0.01598 . 1 . . . . 7 Glu N . 19172 1
54 . 1 1 8 8 ARG H H 1 8.80720 0.00279 . 1 . . . . 8 Arg H . 19172 1
55 . 1 1 8 8 ARG HA H 1 4.02549 0.00594 . 1 . . . . 8 Arg Ha . 19172 1
56 . 1 1 8 8 ARG HB2 H 1 1.54891 0.00822 . 1 . . . . 8 Arg Hb2 . 19172 1
57 . 1 1 8 8 ARG HB3 H 1 1.88634 0.00359 . 1 . . . . 8 Arg Hb3 . 19172 1
58 . 1 1 8 8 ARG HG2 H 1 1.73222 0.01043 . 1 . . . . 8 Arg Hg2 . 19172 1
59 . 1 1 8 8 ARG HG3 H 1 1.73222 0.01043 . 1 . . . . 8 Arg Hg3 . 19172 1
60 . 1 1 8 8 ARG HD2 H 1 3.12466 0.00212 . 1 . . . . 8 Arg Hd2 . 19172 1
61 . 1 1 8 8 ARG HD3 H 1 3.12466 0.00212 . 1 . . . . 8 Arg Hd3 . 19172 1
62 . 1 1 8 8 ARG C C 13 174.91604 0.08 . 1 . . . . 8 Arg C . 19172 1
63 . 1 1 8 8 ARG CA C 13 57.70373 0.06480 . 1 . . . . 8 Arg Ca . 19172 1
64 . 1 1 8 8 ARG CB C 13 29.73614 0.13289 . 1 . . . . 8 Arg Cb . 19172 1
65 . 1 1 8 8 ARG CG C 13 27.50544 0.14650 . 1 . . . . 8 Arg Cg . 19172 1
66 . 1 1 8 8 ARG CD C 13 43.21374 0.16765 . 1 . . . . 8 Arg Cd . 19172 1
67 . 1 1 8 8 ARG N N 15 120.45722 0.01439 . 1 . . . . 8 Arg N . 19172 1
68 . 1 1 9 9 TRP H H 1 6.32063 0.00199 . 1 . . . . 9 Trp H . 19172 1
69 . 1 1 9 9 TRP HA H 1 4.93855 0.00402 . 1 . . . . 9 Trp Ha . 19172 1
70 . 1 1 9 9 TRP HB2 H 1 3.01239 0.00776 . 1 . . . . 9 Trp Hb2 . 19172 1
71 . 1 1 9 9 TRP HB3 H 1 3.75075 0.00430 . 1 . . . . 9 Trp Hb3 . 19172 1
72 . 1 1 9 9 TRP HD1 H 1 7.45482 0.00270 . 1 . . . . 9 Trp Hd1 . 19172 1
73 . 1 1 9 9 TRP HE1 H 1 10.84215 0.00294 . 1 . . . . 9 Trp He1 . 19172 1
74 . 1 1 9 9 TRP HE3 H 1 6.67810 0.00307 . 1 . . . . 9 Trp He3 . 19172 1
75 . 1 1 9 9 TRP HZ2 H 1 7.53874 0.00171 . 1 . . . . 9 Trp Hz2 . 19172 1
76 . 1 1 9 9 TRP HZ3 H 1 7.41855 0.00281 . 1 . . . . 9 Trp Hz3 . 19172 1
77 . 1 1 9 9 TRP HH2 H 1 6.68380 0.00181 . 1 . . . . 9 Trp Hh2 . 19172 1
78 . 1 1 9 9 TRP C C 13 176.06612 0.08 . 1 . . . . 9 Trp C . 19172 1
79 . 1 1 9 9 TRP CA C 13 54.46059 0.07329 . 1 . . . . 9 Trp Ca . 19172 1
80 . 1 1 9 9 TRP CB C 13 29.61671 0.14789 . 1 . . . . 9 Trp Cb . 19172 1
81 . 1 1 9 9 TRP CD1 C 13 129.67368 0.05861 . 1 . . . . 9 Trp Cd1 . 19172 1
82 . 1 1 9 9 TRP CE3 C 13 121.37735 0.02407 . 1 . . . . 9 Trp Ce3 . 19172 1
83 . 1 1 9 9 TRP CZ2 C 13 115.35363 0.07950 . 1 . . . . 9 Trp Cz2 . 19172 1
84 . 1 1 9 9 TRP CZ3 C 13 120.39903 0.09451 . 1 . . . . 9 Trp Cz3 . 19172 1
85 . 1 1 9 9 TRP CH2 C 13 124.20881 0.07433 . 1 . . . . 9 Trp Ch2 . 19172 1
86 . 1 1 9 9 TRP N N 15 109.89139 0.00485 . 1 . . . . 9 Trp N . 19172 1
87 . 1 1 9 9 TRP NE1 N 15 132.32988 0.01373 . 1 . . . . 9 Trp Ne1 . 19172 1
88 . 1 1 10 10 PHE H H 1 7.73796 0.00169 . 1 . . . . 10 Phe H . 19172 1
89 . 1 1 10 10 PHE HA H 1 5.48169 0.00267 . 1 . . . . 10 Phe Ha . 19172 1
90 . 1 1 10 10 PHE HB2 H 1 2.53675 0.00653 . 1 . . . . 10 Phe Hb2 . 19172 1
91 . 1 1 10 10 PHE HB3 H 1 3.03558 0.00438 . 1 . . . . 10 Phe Hb3 . 19172 1
92 . 1 1 10 10 PHE HD1 H 1 7.18171 0.00336 . 1 . . . . 10 Phe Hd* . 19172 1
93 . 1 1 10 10 PHE HD2 H 1 7.18171 0.00336 . 1 . . . . 10 Phe Hd* . 19172 1
94 . 1 1 10 10 PHE HE1 H 1 7.39855 0.00319 . 1 . . . . 10 Phe He* . 19172 1
95 . 1 1 10 10 PHE HE2 H 1 7.39855 0.00319 . 1 . . . . 10 Phe He* . 19172 1
96 . 1 1 10 10 PHE HZ H 1 7.76287 0.00300 . 1 . . . . 10 Phe Hz . 19172 1
97 . 1 1 10 10 PHE C C 13 175.07367 0.08 . 1 . . . . 10 Phe C . 19172 1
98 . 1 1 10 10 PHE CA C 13 57.50685 0.06649 . 1 . . . . 10 Phe Ca . 19172 1
99 . 1 1 10 10 PHE CB C 13 38.92440 0.03729 . 1 . . . . 10 Phe Cb . 19172 1
100 . 1 1 10 10 PHE CD1 C 13 132.36187 0.03196 . 1 . . . . 10 Phe Cd* . 19172 1
101 . 1 1 10 10 PHE CD2 C 13 132.36187 0.03196 . 1 . . . . 10 Phe Cd* . 19172 1
102 . 1 1 10 10 PHE CE1 C 13 132.87691 0.02657 . 1 . . . . 10 Phe Ce* . 19172 1
103 . 1 1 10 10 PHE CE2 C 13 132.87691 0.02657 . 1 . . . . 10 Phe Ce* . 19172 1
104 . 1 1 10 10 PHE CZ C 13 131.81206 0.08 . 1 . . . . 10 Phe Cz . 19172 1
105 . 1 1 10 10 PHE N N 15 123.74489 0.00640 . 1 . . . . 10 Phe N . 19172 1
106 . 1 1 11 11 HIS H H 1 9.16805 0.00253 . 1 . . . . 11 His H . 19172 1
107 . 1 1 11 11 HIS HA H 1 4.21443 0.00309 . 1 . . . . 11 His Ha . 19172 1
108 . 1 1 11 11 HIS HB2 H 1 2.54038 0.00839 . 1 . . . . 11 His Hb2 . 19172 1
109 . 1 1 11 11 HIS HB3 H 1 3.27598 0.00213 . 1 . . . . 11 His Hb3 . 19172 1
110 . 1 1 11 11 HIS HD2 H 1 7.40000 0.00214 . 1 . . . . 11 His Hd2 . 19172 1
111 . 1 1 11 11 HIS HE1 H 1 7.25650 0.00609 . 1 . . . . 11 His He1 . 19172 1
112 . 1 1 11 11 HIS C C 13 175.20490 0.08 . 1 . . . . 11 His C . 19172 1
113 . 1 1 11 11 HIS CA C 13 56.70341 0.18416 . 1 . . . . 11 His Ca . 19172 1
114 . 1 1 11 11 HIS CB C 13 33.88581 0.13289 . 1 . . . . 11 His Cb . 19172 1
115 . 1 1 11 11 HIS CD2 C 13 117.70666 0.06879 . 1 . . . . 11 His Cd2 . 19172 1
116 . 1 1 11 11 HIS CE1 C 13 135.61068 0.02464 . 1 . . . . 11 His Ce1 . 19172 1
117 . 1 1 11 11 HIS N N 15 126.11693 0.01119 . 1 . . . . 11 His N . 19172 1
118 . 1 1 12 12 GLY H H 1 5.33867 0.00398 . 1 . . . . 12 Gly H . 19172 1
119 . 1 1 12 12 GLY HA2 H 1 3.34467 0.00721 . 1 . . . . 12 Gly Ha2 . 19172 1
120 . 1 1 12 12 GLY HA3 H 1 3.74561 0.00533 . 1 . . . . 12 Gly Ha3 . 19172 1
121 . 1 1 12 12 GLY C C 13 173.81309 0.08 . 1 . . . . 12 Gly C . 19172 1
122 . 1 1 12 12 GLY CA C 13 47.73328 0.12622 . 1 . . . . 12 Gly Ca . 19172 1
123 . 1 1 12 12 GLY N N 15 104.14548 0.01043 . 1 . . . . 12 Gly N . 19172 1
124 . 1 1 13 13 HIS H H 1 8.80702 0.00638 . 1 . . . . 13 His H . 19172 1
125 . 1 1 13 13 HIS HA H 1 4.58701 0.00455 . 1 . . . . 13 His Ha . 19172 1
126 . 1 1 13 13 HIS HB2 H 1 3.07524 0.00316 . 1 . . . . 13 His Hb2 . 19172 1
127 . 1 1 13 13 HIS HB3 H 1 3.30549 0.01015 . 1 . . . . 13 His Hb3 . 19172 1
128 . 1 1 13 13 HIS HD2 H 1 7.18032 0.00136 . 1 . . . . 13 His Hd2 . 19172 1
129 . 1 1 13 13 HIS C C 13 172.80408 0.08 . 1 . . . . 13 His C . 19172 1
130 . 1 1 13 13 HIS CA C 13 56.27440 0.07701 . 1 . . . . 13 His Ca . 19172 1
131 . 1 1 13 13 HIS CB C 13 27.78831 0.12102 . 1 . . . . 13 His Cb . 19172 1
132 . 1 1 13 13 HIS CD2 C 13 120.41360 0.00158 . 1 . . . . 13 His Cd2 . 19172 1
133 . 1 1 13 13 HIS N N 15 126.87769 0.02456 . 1 . . . . 13 His N . 19172 1
134 . 1 1 14 14 LEU H H 1 7.76810 0.00439 . 1 . . . . 14 Leu H . 19172 1
135 . 1 1 14 14 LEU HA H 1 4.34609 0.00208 . 1 . . . . 14 Leu Ha . 19172 1
136 . 1 1 14 14 LEU HB2 H 1 1.37290 0.00430 . 1 . . . . 14 Leu Hb2 . 19172 1
137 . 1 1 14 14 LEU HB3 H 1 1.42536 0.01317 . 1 . . . . 14 Leu Hb3 . 19172 1
138 . 1 1 14 14 LEU HG H 1 1.71630 0.00568 . 1 . . . . 14 Leu Hg . 19172 1
139 . 1 1 14 14 LEU HD11 H 1 0.96154 0.00261 . 1 . . . . 14 Leu Hd1* . 19172 1
140 . 1 1 14 14 LEU HD12 H 1 0.96154 0.00261 . 1 . . . . 14 Leu Hd1* . 19172 1
141 . 1 1 14 14 LEU HD13 H 1 0.96154 0.00261 . 1 . . . . 14 Leu Hd1* . 19172 1
142 . 1 1 14 14 LEU HD21 H 1 0.66313 0.00228 . 1 . . . . 14 Leu Hd2* . 19172 1
143 . 1 1 14 14 LEU HD22 H 1 0.66313 0.00228 . 1 . . . . 14 Leu Hd2* . 19172 1
144 . 1 1 14 14 LEU HD23 H 1 0.66313 0.00228 . 1 . . . . 14 Leu Hd2* . 19172 1
145 . 1 1 14 14 LEU C C 13 174.92105 0.08 . 1 . . . . 14 Leu C . 19172 1
146 . 1 1 14 14 LEU CA C 13 54.80475 0.09268 . 1 . . . . 14 Leu Ca . 19172 1
147 . 1 1 14 14 LEU CB C 13 45.18918 0.02699 . 1 . . . . 14 Leu Cb . 19172 1
148 . 1 1 14 14 LEU CG C 13 26.44999 0.00199 . 1 . . . . 14 Leu Cg . 19172 1
149 . 1 1 14 14 LEU CD1 C 13 25.08648 0.10181 . 1 . . . . 14 Leu Cd1 . 19172 1
150 . 1 1 14 14 LEU CD2 C 13 26.95571 0.12831 . 1 . . . . 14 Leu Cd2 . 19172 1
151 . 1 1 14 14 LEU N N 15 129.89215 0.02736 . 1 . . . . 14 Leu N . 19172 1
152 . 1 1 15 15 SER H H 1 8.85897 0.00195 . 1 . . . . 15 Ser H . 19172 1
153 . 1 1 15 15 SER HA H 1 4.43831 0.00359 . 1 . . . . 15 Ser Ha . 19172 1
154 . 1 1 15 15 SER HB2 H 1 3.96634 0.00747 . 1 . . . . 15 Ser Hb2 . 19172 1
155 . 1 1 15 15 SER HB3 H 1 4.26194 0.00393 . 1 . . . . 15 Ser Hb3 . 19172 1
156 . 1 1 15 15 SER C C 13 175.49368 0.08 . 1 . . . . 15 Ser C . 19172 1
157 . 1 1 15 15 SER CA C 13 57.61741 0.13709 . 1 . . . . 15 Ser Ca . 19172 1
158 . 1 1 15 15 SER CB C 13 65.55448 0.05756 . 1 . . . . 15 Ser Cb . 19172 1
159 . 1 1 15 15 SER N N 15 123.14196 0.01921 . 1 . . . . 15 Ser N . 19172 1
160 . 1 1 16 16 GLY H H 1 9.86705 0.01142 . 1 . . . . 16 Gly H . 19172 1
161 . 1 1 16 16 GLY HA2 H 1 3.36032 0.00482 . 1 . . . . 16 Gly Ha2 . 19172 1
162 . 1 1 16 16 GLY HA3 H 1 3.77557 0.00131 . 1 . . . . 16 Gly Ha3 . 19172 1
163 . 1 1 16 16 GLY C C 13 176.48360 0.08 . 1 . . . . 16 Gly C . 19172 1
164 . 1 1 16 16 GLY CA C 13 47.84373 0.17120 . 1 . . . . 16 Gly Ca . 19172 1
165 . 1 1 16 16 GLY N N 15 111.50493 0.02005 . 1 . . . . 16 Gly N . 19172 1
166 . 1 1 17 17 LYS H H 1 8.19854 0.00123 . 1 . . . . 17 Lys H . 19172 1
167 . 1 1 17 17 LYS HA H 1 4.03501 0.00172 . 1 . . . . 17 Lys Ha . 19172 1
168 . 1 1 17 17 LYS HB2 H 1 1.71304 0.00278 . 1 . . . . 17 Lys Hb2 . 19172 1
169 . 1 1 17 17 LYS HB3 H 1 1.79125 0.00150 . 1 . . . . 17 Lys Hb3 . 19172 1
170 . 1 1 17 17 LYS HG2 H 1 1.42018 0.00143 . 1 . . . . 17 Lys Hg2 . 19172 1
171 . 1 1 17 17 LYS HG3 H 1 1.48882 9.58195e-04 . 1 . . . . 17 Lys Hg3 . 19172 1
172 . 1 1 17 17 LYS HD2 H 1 1.65676 3.60480e-04 . 1 . . . . 17 Lys Hd2 . 19172 1
173 . 1 1 17 17 LYS HD3 H 1 1.65676 3.60480e-04 . 1 . . . . 17 Lys Hd3 . 19172 1
174 . 1 1 17 17 LYS HE2 H 1 2.96668 3.38425e-04 . 1 . . . . 17 Lys He2 . 19172 1
175 . 1 1 17 17 LYS HE3 H 1 2.96668 3.38425e-04 . 1 . . . . 17 Lys He3 . 19172 1
176 . 1 1 17 17 LYS C C 13 180.08531 0.08 . 1 . . . . 17 Lys C . 19172 1
177 . 1 1 17 17 LYS CA C 13 58.84761 0.06182 . 1 . . . . 17 Lys Ca . 19172 1
178 . 1 1 17 17 LYS CB C 13 32.27105 0.02717 . 1 . . . . 17 Lys Cb . 19172 1
179 . 1 1 17 17 LYS CG C 13 24.78980 0.00388 . 1 . . . . 17 Lys Cg . 19172 1
180 . 1 1 17 17 LYS CD C 13 28.71909 0.01881 . 1 . . . . 17 Lys Cd . 19172 1
181 . 1 1 17 17 LYS CE C 13 42.02828 0.00554 . 1 . . . . 17 Lys Ce . 19172 1
182 . 1 1 17 17 LYS N N 15 120.63149 0.01168 . 1 . . . . 17 Lys N . 19172 1
183 . 1 1 18 18 GLU H H 1 7.80182 0.00249 . 1 . . . . 18 Glu H . 19172 1
184 . 1 1 18 18 GLU HA H 1 3.97437 0.00335 . 1 . . . . 18 Glu Ha . 19172 1
185 . 1 1 18 18 GLU HB2 H 1 1.97966 0.00347 . 1 . . . . 18 Glu Hb2 . 19172 1
186 . 1 1 18 18 GLU HB3 H 1 2.15192 0.00636 . 1 . . . . 18 Glu Hb3 . 19172 1
187 . 1 1 18 18 GLU HG2 H 1 2.22302 0.00654 . 1 . . . . 18 Glu Hg2 . 19172 1
188 . 1 1 18 18 GLU HG3 H 1 2.27818 0.00303 . 1 . . . . 18 Glu Hg3 . 19172 1
189 . 1 1 18 18 GLU C C 13 179.58418 0.08 . 1 . . . . 18 Glu C . 19172 1
190 . 1 1 18 18 GLU CA C 13 59.08597 0.07767 . 1 . . . . 18 Glu Ca . 19172 1
191 . 1 1 18 18 GLU CB C 13 29.87345 0.13992 . 1 . . . . 18 Glu Cb . 19172 1
192 . 1 1 18 18 GLU CG C 13 37.41378 0.13351 . 1 . . . . 18 Glu Cg . 19172 1
193 . 1 1 18 18 GLU N N 15 120.61700 0.01329 . 1 . . . . 18 Glu N . 19172 1
194 . 1 1 19 19 ALA H H 1 8.78974 0.00436 . 1 . . . . 19 Ala H . 19172 1
195 . 1 1 19 19 ALA HA H 1 3.86203 0.00255 . 1 . . . . 19 Ala Ha . 19172 1
196 . 1 1 19 19 ALA HB1 H 1 1.43921 0.00171 . 1 . . . . 19 Ala Hb* . 19172 1
197 . 1 1 19 19 ALA HB2 H 1 1.43921 0.00171 . 1 . . . . 19 Ala Hb* . 19172 1
198 . 1 1 19 19 ALA HB3 H 1 1.43921 0.00171 . 1 . . . . 19 Ala Hb* . 19172 1
199 . 1 1 19 19 ALA C C 13 178.96524 0.08 . 1 . . . . 19 Ala C . 19172 1
200 . 1 1 19 19 ALA CA C 13 55.29175 0.06468 . 1 . . . . 19 Ala Ca . 19172 1
201 . 1 1 19 19 ALA CB C 13 18.49925 0.13711 . 1 . . . . 19 Ala Cb . 19172 1
202 . 1 1 19 19 ALA N N 15 122.27858 0.04163 . 1 . . . . 19 Ala N . 19172 1
203 . 1 1 20 20 GLU H H 1 8.60119 0.00279 . 1 . . . . 20 Glu H . 19172 1
204 . 1 1 20 20 GLU HA H 1 3.78954 0.00122 . 1 . . . . 20 Glu Ha . 19172 1
205 . 1 1 20 20 GLU HB2 H 1 2.11775 0.00579 . 1 . . . . 20 Glu Hb2 . 19172 1
206 . 1 1 20 20 GLU HB3 H 1 2.22821 0.00658 . 1 . . . . 20 Glu Hb3 . 19172 1
207 . 1 1 20 20 GLU HG2 H 1 2.62515 0.00420 . 1 . . . . 20 Glu Hg2 . 19172 1
208 . 1 1 20 20 GLU HG3 H 1 2.62515 0.00420 . 1 . . . . 20 Glu Hg3 . 19172 1
209 . 1 1 20 20 GLU C C 13 178.87349 0.08 . 1 . . . . 20 Glu C . 19172 1
210 . 1 1 20 20 GLU CA C 13 60.15261 0.07951 . 1 . . . . 20 Glu Ca . 19172 1
211 . 1 1 20 20 GLU CB C 13 28.82481 0.11794 . 1 . . . . 20 Glu Cb . 19172 1
212 . 1 1 20 20 GLU CG C 13 36.80312 0.13425 . 1 . . . . 20 Glu Cg . 19172 1
213 . 1 1 20 20 GLU N N 15 116.86618 0.01921 . 1 . . . . 20 Glu N . 19172 1
214 . 1 1 21 21 LYS H H 1 7.79922 0.00141 . 1 . . . . 21 Lys H . 19172 1
215 . 1 1 21 21 LYS HA H 1 4.00204 0.00595 . 1 . . . . 21 Lys Ha . 19172 1
216 . 1 1 21 21 LYS HB2 H 1 1.84783 3.01552e-04 . 1 . . . . 21 Lys Hb2 . 19172 1
217 . 1 1 21 21 LYS HB3 H 1 1.92814 1.06898e-04 . 1 . . . . 21 Lys Hb3 . 19172 1
218 . 1 1 21 21 LYS HG2 H 1 1.28598 0.00782 . 1 . . . . 21 Lys Hg2 . 19172 1
219 . 1 1 21 21 LYS HG3 H 1 1.44963 0.00162 . 1 . . . . 21 Lys Hg3 . 19172 1
220 . 1 1 21 21 LYS HD2 H 1 1.65484 6.61793e-04 . 1 . . . . 21 Lys Hd2 . 19172 1
221 . 1 1 21 21 LYS HD3 H 1 1.65484 6.61793e-04 . 1 . . . . 21 Lys Hd3 . 19172 1
222 . 1 1 21 21 LYS HE2 H 1 2.96201 3.27119e-04 . 1 . . . . 21 Lys He2 . 19172 1
223 . 1 1 21 21 LYS HE3 H 1 2.96201 3.27119e-04 . 1 . . . . 21 Lys He3 . 19172 1
224 . 1 1 21 21 LYS C C 13 178.07374 0.08 . 1 . . . . 21 Lys C . 19172 1
225 . 1 1 21 21 LYS CA C 13 60.13956 0.07624 . 1 . . . . 21 Lys Ca . 19172 1
226 . 1 1 21 21 LYS CB C 13 32.52310 0.01928 . 1 . . . . 21 Lys Cb . 19172 1
227 . 1 1 21 21 LYS CG C 13 24.62433 0.02579 . 1 . . . . 21 Lys Cg . 19172 1
228 . 1 1 21 21 LYS CD C 13 29.48532 0.01215 . 1 . . . . 21 Lys Cd . 19172 1
229 . 1 1 21 21 LYS CE C 13 42.08876 2.29690e-04 . 1 . . . . 21 Lys Ce . 19172 1
230 . 1 1 21 21 LYS N N 15 122.63062 0.00994 . 1 . . . . 21 Lys N . 19172 1
231 . 1 1 22 22 LEU H H 1 7.93387 0.00222 . 1 . . . . 22 Leu H . 19172 1
232 . 1 1 22 22 LEU HA H 1 4.05090 0.00405 . 1 . . . . 22 Leu Ha . 19172 1
233 . 1 1 22 22 LEU HB2 H 1 1.31970 0.00205 . 1 . . . . 22 Leu Hb2 . 19172 1
234 . 1 1 22 22 LEU HB3 H 1 1.64970 0.00447 . 1 . . . . 22 Leu Hb3 . 19172 1
235 . 1 1 22 22 LEU HG H 1 1.64512 0.00311 . 1 . . . . 22 Leu Hg . 19172 1
236 . 1 1 22 22 LEU HD11 H 1 0.84347 0.00943 . 1 . . . . 22 Leu Hd1* . 19172 1
237 . 1 1 22 22 LEU HD12 H 1 0.84347 0.00943 . 1 . . . . 22 Leu Hd1* . 19172 1
238 . 1 1 22 22 LEU HD13 H 1 0.84347 0.00943 . 1 . . . . 22 Leu Hd1* . 19172 1
239 . 1 1 22 22 LEU HD21 H 1 0.82991 0.00519 . 1 . . . . 22 Leu Hd2* . 19172 1
240 . 1 1 22 22 LEU HD22 H 1 0.82991 0.00519 . 1 . . . . 22 Leu Hd2* . 19172 1
241 . 1 1 22 22 LEU HD23 H 1 0.82991 0.00519 . 1 . . . . 22 Leu Hd2* . 19172 1
242 . 1 1 22 22 LEU C C 13 179.51858 0.08 . 1 . . . . 22 Leu C . 19172 1
243 . 1 1 22 22 LEU CA C 13 58.27205 0.06506 . 1 . . . . 22 Leu Ca . 19172 1
244 . 1 1 22 22 LEU CB C 13 42.86295 0.05857 . 1 . . . . 22 Leu Cb . 19172 1
245 . 1 1 22 22 LEU CG C 13 27.11524 0.14168 . 1 . . . . 22 Leu Cg . 19172 1
246 . 1 1 22 22 LEU CD1 C 13 25.41842 0.11417 . 1 . . . . 22 Leu Cd1 . 19172 1
247 . 1 1 22 22 LEU CD2 C 13 23.70835 0.01981 . 1 . . . . 22 Leu Cd2 . 19172 1
248 . 1 1 22 22 LEU N N 15 118.95857 0.01562 . 1 . . . . 22 Leu N . 19172 1
249 . 1 1 23 23 LEU H H 1 8.39549 0.00327 . 1 . . . . 23 Leu H . 19172 1
250 . 1 1 23 23 LEU HA H 1 3.64373 0.00273 . 1 . . . . 23 Leu Ha . 19172 1
251 . 1 1 23 23 LEU HB2 H 1 0.99503 0.00502 . 1 . . . . 23 Leu Hb2 . 19172 1
252 . 1 1 23 23 LEU HB3 H 1 1.81340 0.00232 . 1 . . . . 23 Leu Hb3 . 19172 1
253 . 1 1 23 23 LEU HG H 1 1.50561 0.00654 . 1 . . . . 23 Leu Hg . 19172 1
254 . 1 1 23 23 LEU HD11 H 1 0.53517 0.00209 . 1 . . . . 23 Leu Hd1* . 19172 1
255 . 1 1 23 23 LEU HD12 H 1 0.53517 0.00209 . 1 . . . . 23 Leu Hd1* . 19172 1
256 . 1 1 23 23 LEU HD13 H 1 0.53517 0.00209 . 1 . . . . 23 Leu Hd1* . 19172 1
257 . 1 1 23 23 LEU HD21 H 1 0.58520 0.00314 . 1 . . . . 23 Leu Hd2* . 19172 1
258 . 1 1 23 23 LEU HD22 H 1 0.58520 0.00314 . 1 . . . . 23 Leu Hd2* . 19172 1
259 . 1 1 23 23 LEU HD23 H 1 0.58520 0.00314 . 1 . . . . 23 Leu Hd2* . 19172 1
260 . 1 1 23 23 LEU C C 13 179.66177 0.08 . 1 . . . . 23 Leu C . 19172 1
261 . 1 1 23 23 LEU CA C 13 57.90542 0.07884 . 1 . . . . 23 Leu Ca . 19172 1
262 . 1 1 23 23 LEU CB C 13 42.48505 0.10532 . 1 . . . . 23 Leu Cb . 19172 1
263 . 1 1 23 23 LEU CG C 13 28.05934 0.11039 . 1 . . . . 23 Leu Cg . 19172 1
264 . 1 1 23 23 LEU CD1 C 13 26.56558 0.02259 . 1 . . . . 23 Leu Cd1 . 19172 1
265 . 1 1 23 23 LEU CD2 C 13 23.70716 0.03459 . 1 . . . . 23 Leu Cd2 . 19172 1
266 . 1 1 23 23 LEU N N 15 116.42205 0.00757 . 1 . . . . 23 Leu N . 19172 1
267 . 1 1 24 24 THR H H 1 8.16131 0.00209 . 1 . . . . 24 Thr H . 19172 1
268 . 1 1 24 24 THR HA H 1 3.80872 0.00333 . 1 . . . . 24 Thr Ha . 19172 1
269 . 1 1 24 24 THR HB H 1 4.27104 0.00398 . 1 . . . . 24 Thr Hb . 19172 1
270 . 1 1 24 24 THR HG21 H 1 1.16857 7.40272e-04 . 1 . . . . 24 Thr Hg2* . 19172 1
271 . 1 1 24 24 THR HG22 H 1 1.16857 7.40272e-04 . 1 . . . . 24 Thr Hg2* . 19172 1
272 . 1 1 24 24 THR HG23 H 1 1.16857 7.40272e-04 . 1 . . . . 24 Thr Hg2* . 19172 1
273 . 1 1 24 24 THR C C 13 175.16954 0.08 . 1 . . . . 24 Thr C . 19172 1
274 . 1 1 24 24 THR CA C 13 66.35300 0.07055 . 1 . . . . 24 Thr Ca . 19172 1
275 . 1 1 24 24 THR CB C 13 68.87971 0.06690 . 1 . . . . 24 Thr Cb . 19172 1
276 . 1 1 24 24 THR CG2 C 13 20.94613 0.00247 . 1 . . . . 24 Thr Cg2 . 19172 1
277 . 1 1 24 24 THR N N 15 115.15711 0.01845 . 1 . . . . 24 Thr N . 19172 1
278 . 1 1 25 25 GLU H H 1 8.23537 0.00153 . 1 . . . . 25 Glu H . 19172 1
279 . 1 1 25 25 GLU HA H 1 4.17268 0.00228 . 1 . . . . 25 Glu Ha . 19172 1
280 . 1 1 25 25 GLU HB2 H 1 1.98572 0.00892 . 1 . . . . 25 Glu Hb2 . 19172 1
281 . 1 1 25 25 GLU HB3 H 1 2.10712 0.01105 . 1 . . . . 25 Glu Hb3 . 19172 1
282 . 1 1 25 25 GLU HG2 H 1 2.20847 0.00426 . 1 . . . . 25 Glu Hg2 . 19172 1
283 . 1 1 25 25 GLU HG3 H 1 2.52231 0.00453 . 1 . . . . 25 Glu Hg3 . 19172 1
284 . 1 1 25 25 GLU C C 13 178.65745 0.08 . 1 . . . . 25 Glu C . 19172 1
285 . 1 1 25 25 GLU CA C 13 59.05033 0.07926 . 1 . . . . 25 Glu Ca . 19172 1
286 . 1 1 25 25 GLU CB C 13 30.69347 0.15280 . 1 . . . . 25 Glu Cb . 19172 1
287 . 1 1 25 25 GLU CG C 13 36.91862 0.16270 . 1 . . . . 25 Glu Cg . 19172 1
288 . 1 1 25 25 GLU N N 15 119.29759 0.01455 . 1 . . . . 25 Glu N . 19172 1
289 . 1 1 26 26 LYS H H 1 8.27482 0.00228 . 1 . . . . 26 Lys H . 19172 1
290 . 1 1 26 26 LYS HA H 1 4.64694 0.00486 . 1 . . . . 26 Lys Ha . 19172 1
291 . 1 1 26 26 LYS HB2 H 1 1.85341 0.00360 . 1 . . . . 26 Lys Hb2 . 19172 1
292 . 1 1 26 26 LYS HB3 H 1 1.95914 0.00780 . 1 . . . . 26 Lys Hb3 . 19172 1
293 . 1 1 26 26 LYS HG2 H 1 1.40569 1.74701e-04 . 1 . . . . 26 Lys Hg2 . 19172 1
294 . 1 1 26 26 LYS HG3 H 1 1.49761 2.24554e-04 . 1 . . . . 26 Lys Hg3 . 19172 1
295 . 1 1 26 26 LYS HD2 H 1 1.63584 0.00338 . 1 . . . . 26 Lys Hd2 . 19172 1
296 . 1 1 26 26 LYS HD3 H 1 1.66353 2.74764e-04 . 1 . . . . 26 Lys Hd3 . 19172 1
297 . 1 1 26 26 LYS HE2 H 1 2.95766 1.08659e-04 . 1 . . . . 26 Lys He2 . 19172 1
298 . 1 1 26 26 LYS HE3 H 1 2.95766 1.08659e-04 . 1 . . . . 26 Lys He3 . 19172 1
299 . 1 1 26 26 LYS C C 13 177.17170 0.08 . 1 . . . . 26 Lys C . 19172 1
300 . 1 1 26 26 LYS CA C 13 55.51957 0.15041 . 1 . . . . 26 Lys Ca . 19172 1
301 . 1 1 26 26 LYS CB C 13 34.55497 0.13842 . 1 . . . . 26 Lys Cb . 19172 1
302 . 1 1 26 26 LYS CG C 13 25.05891 0.00625 . 1 . . . . 26 Lys Cg . 19172 1
303 . 1 1 26 26 LYS CD C 13 28.92974 0.00279 . 1 . . . . 26 Lys Cd . 19172 1
304 . 1 1 26 26 LYS CE C 13 42.21021 0.00117 . 1 . . . . 26 Lys Ce . 19172 1
305 . 1 1 26 26 LYS N N 15 113.61834 0.00969 . 1 . . . . 26 Lys N . 19172 1
306 . 1 1 27 27 GLY H H 1 7.14893 0.00222 . 1 . . . . 27 Gly H . 19172 1
307 . 1 1 27 27 GLY HA2 H 1 3.69069 0.00421 . 1 . . . . 27 Gly Ha2 . 19172 1
308 . 1 1 27 27 GLY HA3 H 1 4.32071 0.00249 . 1 . . . . 27 Gly Ha3 . 19172 1
309 . 1 1 27 27 GLY C C 13 170.99657 0.08 .1 . . . . . 27 Gly C . 19172 1
310 . 1 1 27 27 GLY CA C 13 43.88179 0.01648 . 1 . . . . 27 Gly Ca . 19172 1
311 . 1 1 27 27 GLY N N 15 106.72526 0.01345 . 1 . . . . 27 Gly N . 19172 1
312 . 1 1 28 28 LYS H H 1 8.47076 0.00193 . 1 . . . . 28 Lys H . 19172 1
313 . 1 1 28 28 LYS HA H 1 4.57998 0.00306 . 1 . . . . 28 Lys Ha . 19172 1
314 . 1 1 28 28 LYS HB2 H 1 1.66996 0.00479 . 1 . . . . 28 Lys Hb2 . 19172 1
315 . 1 1 28 28 LYS HB3 H 1 2.01180 0.00299 . 1 . . . . 28 Lys Hb3 . 19172 1
316 . 1 1 28 28 LYS HG2 H 1 1.29641 8.01390e-04 . 1 . . . . 28 Lys Hg2 . 19172 1
317 . 1 1 28 28 LYS HG3 H 1 1.34813 0.00104 . 1 . . . . 28 Lys Hg3 . 19172 1
318 . 1 1 28 28 LYS HD2 H 1 1.63675 3.88677e-04 . 1 . . . . 28 Lys Hd2 . 19172 1
319 . 1 1 28 28 LYS HD3 H 1 1.63675 3.88677e-04 . 1 . . . . 28 Lys Hd3 . 19172 1
320 . 1 1 28 28 LYS HE2 H 1 2.91715 0.00106 . 1 . . . . 28 Lys He2 . 19172 1
321 . 1 1 28 28 LYS HE3 H 1 2.91715 0.00106 . 1 . . . . 28 Lys He3 . 19172 1
322 . 1 1 28 28 LYS C C 13 175.41207 0.08 . 1 . . . . 28 Lys C . 19172 1
323 . 1 1 28 28 LYS CA C 13 53.98339 0.03065 . 1 . . . . 28 Lys Ca . 19172 1
324 . 1 1 28 28 LYS CB C 13 35.73213 0.03656 . 1 . . . . 28 Lys Cb . 19172 1
325 . 1 1 28 28 LYS CG C 13 24.18687 0.03317 . 1 . . . . 28 Lys Cg . 19172 1
326 . 1 1 28 28 LYS CD C 13 29.00469 0.00398 . 1 . . . . 28 Lys Cd . 19172 1
327 . 1 1 28 28 LYS CE C 13 42.21072 0.00138 . 1 . . . . 28 Lys Ce . 19172 1
328 . 1 1 28 28 LYS N N 15 116.05737 0.01154 . 1 . . . . 28 Lys N . 19172 1
329 . 1 1 29 29 HIS H H 1 9.05419 0.00432 . 1 . . . . 29 His H . 19172 1
330 . 1 1 29 29 HIS HA H 1 4.02934 0.00492 . 1 . . . . 29 His Ha . 19172 1
331 . 1 1 29 29 HIS HB2 H 1 2.96436 0.00571 . 1 . . . . 29 His Hb2 . 19172 1
332 . 1 1 29 29 HIS HB3 H 1 3.05397 0.00866 . 1 . . . . 29 His Hb3 . 19172 1
333 . 1 1 29 29 HIS HD2 H 1 6.87190 0.00175 . 1 . . . . 29 His Hd2 . 19172 1
334 . 1 1 29 29 HIS C C 13 177.75546 0.08 . 1 . . . . 29 His C . 19172 1
335 . 1 1 29 29 HIS CA C 13 60.57655 0.18901 . 1 . . . . 29 His Ca . 19172 1
336 . 1 1 29 29 HIS CB C 13 30.65485 0.20426 . 1 . . . . 29 His Cb . 19172 1
337 . 1 1 29 29 HIS CD2 C 13 118.23579 0.08 . 1 . . . . 29 His Cd2 . 19172 1
338 . 1 1 29 29 HIS N N 15 121.18632 0.01997 . 1 . . . . 29 His N . 19172 1
339 . 1 1 30 30 GLY H H 1 8.66508 0.00356 . 1 . . . . 30 Gly H . 19172 1
340 . 1 1 30 30 GLY HA2 H 1 3.64852 0.00621 . 1 . . . . 30 Gly Ha2 . 19172 1
341 . 1 1 30 30 GLY HA3 H 1 3.90911 0.00621 . 1 . . . . 30 Gly Ha3 . 19172 1
342 . 1 1 30 30 GLY C C 13 175.35814 0.08 . 1 . . . . 30 Gly C . 19172 1
343 . 1 1 30 30 GLY CA C 13 45.41796 0.14924 . 1 . . . . 30 Gly Ca . 19172 1
344 . 1 1 30 30 GLY N N 15 116.13860 0.00999 . 1 . . . . 30 Gly N . 19172 1
345 . 1 1 31 31 SER H H 1 8.75076 0.00219 . 1 . . . . 31 Ser H . 19172 1
346 . 1 1 31 31 SER HA H 1 5.87569 0.00204 . 1 . . . . 31 Ser Ha . 19172 1
347 . 1 1 31 31 SER HB2 H 1 3.77363 0.00286 . 1 . . . . 31 Ser Hb2 . 19172 1
348 . 1 1 31 31 SER HB3 H 1 3.91137 0.00468 . 1 . . . . 31 Ser Hb3 . 19172 1
349 . 1 1 31 31 SER C C 13 172.97411 0.08 . 1 . . . . 31 Ser C . 19172 1
350 . 1 1 31 31 SER CA C 13 60.38932 0.06919 . 1 . . . . 31 Ser Ca . 19172 1
351 . 1 1 31 31 SER CB C 13 63.56601 0.15494 . 1 . . . . 31 Ser Cb . 19172 1
352 . 1 1 31 31 SER N N 15 120.69314 0.01130 . 1 . . . . 31 Ser N . 19172 1
353 . 1 1 32 32 PHE H H 1 7.52436 0.00230 . 1 . . . . 32 Phe H . 19172 1
354 . 1 1 32 32 PHE HA H 1 5.99805 0.00252 . 1 . . . . 32 Phe Ha . 19172 1
355 . 1 1 32 32 PHE HB2 H 1 2.68229 0.00286 . 1 . . . . 32 Phe Hb2 . 19172 1
356 . 1 1 32 32 PHE HB3 H 1 2.84689 0.00255 . 1 . . . . 32 Phe Hb3 . 19172 1
357 . 1 1 32 32 PHE HE1 H 1 6.54912 0.08 . 1 . . . . 32 Phe He* . 19172 1
358 . 1 1 32 32 PHE HE2 H 1 6.54912 0.08 . 1 . . . . 32 Phe He* . 19172 1
359 . 1 1 32 32 PHE HZ H 1 6.67736 0.00358 . 1 . . . . 32 Phe Hz . 19172 1
360 . 1 1 32 32 PHE C C 13 171.11183 0.08 . 1 . . . . 32 Phe C . 19172 1
361 . 1 1 32 32 PHE CA C 13 55.22820 0.07952 . 1 . . . . 32 Phe Ca . 19172 1
362 . 1 1 32 32 PHE CB C 13 44.62738 0.06820 . 1 . . . . 32 Phe Cb . 19172 1
363 . 1 1 32 32 PHE CZ C 13 129.14121 0.19273 . 1 . . . . 32 Phe Cz . 19172 1
364 . 1 1 32 32 PHE N N 15 116.43128 0.01719 . 1 . . . . 32 Phe N . 19172 1
365 . 1 1 33 33 LEU H H 1 9.04158 0.00155 . 1 . . . . 33 Leu H . 19172 1
366 . 1 1 33 33 LEU HA H 1 5.01546 0.00443 . 1 . . . . 33 Leu Ha . 19172 1
367 . 1 1 33 33 LEU HB2 H 1 1.80425 0.00803 . 1 . . . . 33 Leu Hb2 . 19172 1
368 . 1 1 33 33 LEU HB3 H 1 1.95526 0.00570 . 1 . . . . 33 Leu Hb3 . 19172 1
369 . 1 1 33 33 LEU HG H 1 1.64686 0.01033 . 1 . . . . 33 Leu Hg . 19172 1
370 . 1 1 33 33 LEU HD11 H 1 0.56927 0.00171 . 1 . . . . 33 Leu Hd1* . 19172 1
371 . 1 1 33 33 LEU HD12 H 1 0.56927 0.00171 . 1 . . . . 33 Leu Hd1* . 19172 1
372 . 1 1 33 33 LEU HD13 H 1 0.56927 0.00171 . 1 . . . . 33 Leu Hd1* . 19172 1
373 . 1 1 33 33 LEU HD21 H 1 0.14194 0.00279 . 1 . . . . 33 Leu Hd2* . 19172 1
374 . 1 1 33 33 LEU HD22 H 1 0.14194 0.00279 . 1 . . . . 33 Leu Hd2* . 19172 1
375 . 1 1 33 33 LEU HD23 H 1 0.14194 0.00279 . 1 . . . . 33 Leu Hd2* . 19172 1
376 . 1 1 33 33 LEU C C 13 174.48899 0.08 . 1 . . . . 33 Leu C . 19172 1
377 . 1 1 33 33 LEU CA C 13 54.29922 0.15544 . 1 . . . . 33 Leu Ca . 19172 1
378 . 1 1 33 33 LEU CB C 13 44.85516 0.14323 . 1 . . . . 33 Leu Cb . 19172 1
379 . 1 1 33 33 LEU CG C 13 25.09108 0.08669 . 1 . . . . 33 Leu Cg . 19172 1
380 . 1 1 33 33 LEU CD1 C 13 25.19251 0.14137 . 1 . . . . 33 Leu Cd1 . 19172 1
381 . 1 1 33 33 LEU CD2 C 13 26.93805 0.01850 . 1 . . . . 33 Leu Cd2 . 19172 1
382 . 1 1 33 33 LEU N N 15 115.23528 0.01186 . 1 . . . . 33 Leu N . 19172 1
383 . 1 1 34 34 VAL H H 1 9.34397 0.00230 . 1 . . . . 34 Val H . 19172 1
384 . 1 1 34 34 VAL HA H 1 5.70291 0.00258 . 1 . . . . 34 Val Ha . 19172 1
385 . 1 1 34 34 VAL HB H 1 2.39953 0.00967 . 1 . . . . 34 Val Hb . 19172 1
386 . 1 1 34 34 VAL HG11 H 1 1.32277 0.00145 . 1 . . . . 34 Val Hg1* . 19172 1
387 . 1 1 34 34 VAL HG12 H 1 1.32277 0.00145 . 1 . . . . 34 Val Hg1* . 19172 1
388 . 1 1 34 34 VAL HG13 H 1 1.32277 0.00145 . 1 . . . . 34 Val Hg1* . 19172 1
389 . 1 1 34 34 VAL HG21 H 1 0.91637 0.00206 . 1 . . . . 34 Val Hg2* . 19172 1
390 . 1 1 34 34 VAL HG22 H 1 0.91637 0.00206 . 1 . . . . 34 Val Hg2* . 19172 1
391 . 1 1 34 34 VAL HG23 H 1 0.91637 0.00206 . 1 . . . . 34 Val Hg2* . 19172 1
392 . 1 1 34 34 VAL C C 13 173.06566 0.08 . 1 . . . . 34 Val C . 19172 1
393 . 1 1 34 34 VAL CA C 13 60.61699 0.05866 . 1 . . . . 34 Val Ca . 19172 1
394 . 1 1 34 34 VAL CB C 13 34.60427 0.05628 . 1 . . . . 34 Val Cb . 19172 1
395 . 1 1 34 34 VAL CG1 C 13 22.66897 0.01931 . 1 . . . . 34 Val Cg1 . 19172 1
396 . 1 1 34 34 VAL CG2 C 13 23.50295 0.01998 . 1 . . . . 34 Val Cg2 . 19172 1
397 . 1 1 34 34 VAL N N 15 120.02143 0.01018 . 1 . . . . 34 Val N . 19172 1
398 . 1 1 35 35 ARG H H 1 9.46462 0.00191 . 1 . . . . 35 Arg H . 19172 1
399 . 1 1 35 35 ARG HA H 1 5.00919 0.00343 . 1 . . . . 35 Arg Ha . 19172 1
400 . 1 1 35 35 ARG HB2 H 1 1.27128 0.00700 . 1 . . . . 35 Arg Hb2 . 19172 1
401 . 1 1 35 35 ARG HB3 H 1 2.25329 0.00582 . 1 . . . . 35 Arg Hb3 . 19172 1
402 . 1 1 35 35 ARG HG2 H 1 1.53801 0.00344 . 1 . . . . 35 Arg Hg2 . 19172 1
403 . 1 1 35 35 ARG HG3 H 1 1.53801 0.00344 . 1 . . . . 35 Arg Hg3 . 19172 1
404 . 1 1 35 35 ARG HD2 H 1 2.37029 0.00736 . 1 . . . . 35 Arg Hd2 . 19172 1
405 . 1 1 35 35 ARG HD3 H 1 3.38063 0.00570 . 1 . . . . 35 Arg Hd3 . 19172 1
406 . 1 1 35 35 ARG C C 13 174.41970 0.08 . 1 . . . . 35 Arg C . 19172 1
407 . 1 1 35 35 ARG CA C 13 53.22998 0.14583 . 1 . . . . 35 Arg Ca . 19172 1
408 . 1 1 35 35 ARG CB C 13 34.32403 0.14073 . 1 . . . . 35 Arg Cb . 19172 1
409 . 1 1 35 35 ARG CG C 13 25.80007 0.15076 . 1 . . . . 35 Arg Cg . 19172 1
410 . 1 1 35 35 ARG CD C 13 43.23344 0.15714 . 1 . . . . 35 Arg Cd . 19172 1
411 . 1 1 35 35 ARG N N 15 123.88471 0.01086 . 1 . . . . 35 Arg N . 19172 1
412 . 1 1 36 36 GLU H H 1 8.65926 0.00197 . 1 . . . . 36 Glu H . 19172 1
413 . 1 1 36 36 GLU HA H 1 4.31308 0.00394 . 1 . . . . 36 Glu Ha . 19172 1
414 . 1 1 36 36 GLU HB2 H 1 1.88111 0.00258 . 1 . . . . 36 Glu Hb2 . 19172 1
415 . 1 1 36 36 GLU HB3 H 1 1.98399 0.00313 . 1 . . . . 36 Glu Hb3 . 19172 1
416 . 1 1 36 36 GLU HG2 H 1 2.57453 0.00321 . 1 . . . . 36 Glu Hg2 . 19172 1
417 . 1 1 36 36 GLU HG3 H 1 2.57453 0.00321 . 1 . . . . 36 Glu Hg3 . 19172 1
418 . 1 1 36 36 GLU C C 13 176.37250 0.08 . 1 . . . . 36 Glu C . 19172 1
419 . 1 1 36 36 GLU CA C 13 57.10196 0.11555 . 1 . . . . 36 Glu Ca . 19172 1
420 . 1 1 36 36 GLU CB C 13 30.63912 0.03142 . 1 . . . . 36 Glu Cb . 19172 1
421 . 1 1 36 36 GLU CG C 13 37.01603 0.13034 . 1 . . . . 36 Glu Cg . 19172 1
422 . 1 1 36 36 GLU N N 15 120.68131 0.02349 . 1 . . . . 36 Glu N . 19172 1
423 . 1 1 37 37 SER H H 1 7.84150 0.00397 . 1 . . . . 37 Ser H . 19172 1
424 . 1 1 37 37 SER HA H 1 4.43405 0.00448 . 1 . . . . 37 Ser Ha . 19172 1
425 . 1 1 37 37 SER HB2 H 1 3.41237 0.00242 . 1 . . . . 37 Ser Hb2 . 19172 1
426 . 1 1 37 37 SER HB3 H 1 3.71204 0.01111 . 1 . . . . 37 Ser Hb3 . 19172 1
427 . 1 1 37 37 SER C C 13 176.52023 0.08 . 1 . . . . 37 Ser C . 19172 1
428 . 1 1 37 37 SER CA C 13 57.48213 0.11985 . 1 . . . . 37 Ser Ca . 19172 1
429 . 1 1 37 37 SER CB C 13 63.57485 0.13758 . 1 . . . . 37 Ser Cb . 19172 1
430 . 1 1 37 37 SER N N 15 115.34740 0.01522 . 1 . . . . 37 Ser N . 19172 1
431 . 1 1 38 38 GLN H H 1 10.55671 0.01602 . 1 . . . . 38 Gln H . 19172 1
432 . 1 1 38 38 GLN HA H 1 4.23527 0.00170 . 1 . . . . 38 Gln Ha . 19172 1
433 . 1 1 38 38 GLN HB2 H 1 2.02453 0.00862 . 1 . . . . 38 Gln Hb2 . 19172 1
434 . 1 1 38 38 GLN HB3 H 1 2.10276 0.00887 . 1 . . . . 38 Gln Hb3 . 19172 1
435 . 1 1 38 38 GLN HG2 H 1 2.41176 0.00462 . 1 . . . . 38 Gln Hg2 . 19172 1
436 . 1 1 38 38 GLN HG3 H 1 2.41176 0.00462 . 1 . . . . 38 Gln Hg3 . 19172 1
437 . 1 1 38 38 GLN HE21 H 1 6.85738 0.00193 . 1 . . . . 38 Gln He21 . 19172 1
438 . 1 1 38 38 GLN HE22 H 1 7.22545 0.00138 . 1 . . . . 38 Gln He22 . 19172 1
439 . 1 1 38 38 GLN C C 13 177.58635 0.08 . 1 . . . . 38 Gln C . 19172 1
440 . 1 1 38 38 GLN CA C 13 57.20650 0.03000 . 1 . . . . 38 Gln Ca . 19172 1
441 . 1 1 38 38 GLN CB C 13 28.27382 0.07642 . 1 . . . . 38 Gln Cb . 19172 1
442 . 1 1 38 38 GLN CG C 13 34.86647 0.07982 . 1 . . . . 38 Gln Cg . 19172 1
443 . 1 1 38 38 GLN N N 15 129.09649 0.02284 . 1 . . . . 38 Gln N . 19172 1
444 . 1 1 38 38 GLN NE2 N 15 111.44520 0.03269 . 1 . . . . 38 Gln Ne2 . 19172 1
445 . 1 1 39 39 SER H H 1 9.05160 0.01582 . 1 . . . . 39 Ser H . 19172 1
446 . 1 1 39 39 SER HA H 1 4.20913 0.00351 . 1 . . . . 39 Ser Ha . 19172 1
447 . 1 1 39 39 SER HB2 H 1 3.76094 6.15039e-04 . 1 . . . . 39 Ser Hb2 . 19172 1
448 . 1 1 39 39 SER HB3 H 1 3.85610 0.01249 . 1 . . . . 39 Ser Hb3 . 19172 1
449 . 1 1 39 39 SER C C 13 175.11727 0.08 . 1 . . . . 39 Ser C . 19172 1
450 . 1 1 39 39 SER CA C 13 60.50522 0.07163 . 1 . . . . 39 Ser Ca . 19172 1
451 . 1 1 39 39 SER CB C 13 63.48869 0.03545 . 1 . . . . 39 Ser Cb . 19172 1
452 . 1 1 39 39 SER N N 15 116.31195 0.04112 . 1 . . . . 39 Ser N . 19172 1
453 . 1 1 40 40 HIS H H 1 8.21275 0.00696 . 1 . . . . 40 His H . 19172 1
454 . 1 1 40 40 HIS HA H 1 4.77988 0.02629 . 1 . . . . 40 His Ha . 19172 1
455 . 1 1 40 40 HIS HB2 H 1 3.06249 0.00364 . 1 . . . . 40 His Hb2 . 19172 1
456 . 1 1 40 40 HIS HB3 H 1 3.31358 0.00449 . 1 . . . . 40 His Hb3 . 19172 1
457 . 1 1 40 40 HIS HD2 H 1 7.25760 0.00473 . 1 . . . . 40 His Hd2 . 19172 1
458 . 1 1 40 40 HIS CA C 13 53.06550 0.03800 . 1 . . . . 40 His Ca . 19172 1
459 . 1 1 40 40 HIS CB C 13 28.84226 0.17625 . 1 . . . . 40 His Cb . 19172 1
460 . 1 1 40 40 HIS CD2 C 13 120.28228 0.08 . 1 . . . . 40 His Cd2 . 19172 1
461 . 1 1 40 40 HIS N N 15 123.15479 0.03967 . 1 . . . . 40 His N . 19172 1
462 . 1 1 41 41 PRO HA H 1 4.28929 0.00410 . 1 . . . . 41 Pro Ha . 19172 1
463 . 1 1 41 41 PRO HB2 H 1 1.84979 0.00436 . 1 . . . . 41 Pro Hb2 . 19172 1
464 . 1 1 41 41 PRO HB3 H 1 2.27034 0.00499 . 1 . . . . 41 Pro Hb3 . 19172 1
465 . 1 1 41 41 PRO HG2 H 1 1.85866 0.00265 . 1 . . . . 41 Pro Hg2 . 19172 1
466 . 1 1 41 41 PRO HG3 H 1 2.04501 0.00400 . 1 . . . . 41 Pro Hg3 . 19172 1
467 . 1 1 41 41 PRO HD2 H 1 3.31731 0.00217 . 1 . . . . 41 Pro Hd2 . 19172 1
468 . 1 1 41 41 PRO HD3 H 1 3.46489 0.00271 . 1 . . . . 41 Pro Hd3 . 19172 1
469 . 1 1 41 41 PRO C C 13 177.87032 0.08 . 1 . . . . 41 Pro C . 19172 1
470 . 1 1 41 41 PRO CA C 13 64.31646 0.05191 . 1 . . . . 41 Pro Ca . 19172 1
471 . 1 1 41 41 PRO CB C 13 31.54761 0.06916 . 1 . . . . 41 Pro Cb . 19172 1
472 . 1 1 41 41 PRO CG C 13 27.71926 0.17970 . 1 . . . . 41 Pro Cg . 19172 1
473 . 1 1 41 41 PRO CD C 13 50.19943 0.14753 . 1 . . . . 41 Pro Cd . 19172 1
474 . 1 1 42 42 GLY H H 1 8.94814 0.00271 . 1 . . . . 42 Gly H . 19172 1
475 . 1 1 42 42 GLY HA2 H 1 3.47021 0.00644 . 1 . . . . 42 Gly Ha2 . 19172 1
476 . 1 1 42 42 GLY HA3 H 1 4.41040 0.00272 . 1 . . . . 42 Gly Ha3 . 19172 1
477 . 1 1 42 42 GLY C C 13 173.14870 0.08 . 1 . . . . 42 Gly C . 19172 1
478 . 1 1 42 42 GLY CA C 13 45.16070 0.03419 . 1 . . . . 42 Gly Ca . 19172 1
479 . 1 1 42 42 GLY N N 15 115.82643 0.01986 . 1 . . . . 42 Gly N . 19172 1
480 . 1 1 43 43 ASP H H 1 7.95467 0.00364 . 1 . . . . 43 Asp H . 19172 1
481 . 1 1 43 43 ASP HA H 1 5.26588 0.00326 . 1 . . . . 43 Asp Ha . 19172 1
482 . 1 1 43 43 ASP HB2 H 1 2.94141 0.00417 . 1 . . . . 43 Asp Hb2 . 19172 1
483 . 1 1 43 43 ASP HB3 H 1 3.13080 6.83936e-04 . 1 . . . . 43 Asp Hb3 . 19172 1
484 . 1 1 43 43 ASP C C 13 176.13656 0.08 . 1 . . . . 43 Asp C . 19172 1
485 . 1 1 43 43 ASP CA C 13 53.42556 0.10156 . 1 . . . . 43 Asp Ca . 19172 1
486 . 1 1 43 43 ASP CB C 13 42.03744 0.02000 . 1 . . . . 43 Asp Cb . 19172 1
487 . 1 1 43 43 ASP N N 15 119.13021 0.01806 . 1 . . . . 43 Asp N . 19172 1
488 . 1 1 44 44 PHE H H 1 9.13635 0.00207 . 1 . . . . 44 Phe H . 19172 1
489 . 1 1 44 44 PHE HA H 1 5.30896 0.00250 . 1 . . . . 44 Phe Ha . 19172 1
490 . 1 1 44 44 PHE HB2 H 1 2.76923 0.00492 . 1 . . . . 44 Phe Hb2 . 19172 1
491 . 1 1 44 44 PHE HB3 H 1 3.23858 0.00256 . 1 . . . . 44 Phe Hb3 . 19172 1
492 . 1 1 44 44 PHE HD1 H 1 7.23973 0.00270 . 1 . . . . 44 Phe Hd* . 19172 1
493 . 1 1 44 44 PHE HD2 H 1 7.23973 0.00270 . 1 . . . . 44 Phe Hd* . 19172 1
494 . 1 1 44 44 PHE HE1 H 1 7.58945 0.00142 . 1 . . . . 44 Phe He* . 19172 1
495 . 1 1 44 44 PHE HE2 H 1 7.58945 0.00142 . 1 . . . . 44 Phe He* . 19172 1
496 . 1 1 44 44 PHE HZ H 1 7.40595 9.66420e-04 . 1 . . . . 44 Phe Hz . 19172 1
497 . 1 1 44 44 PHE C C 13 173.25708 0.08 . 1 . . . . 44 Phe C . 19172 1
498 . 1 1 44 44 PHE CA C 13 57.12764 0.07867 . 1 . . . . 44 Phe Ca . 19172 1
499 . 1 1 44 44 PHE CB C 13 43.71253 0.01689 . 1 . . . . 44 Phe Cb . 19172 1
500 . 1 1 44 44 PHE CD1 C 13 131.41174 0.07150 . 1 . . . . 44 Phe Cd* . 19172 1
501 . 1 1 44 44 PHE CD2 C 13 131.41174 0.07150 . 1 . . . . 44 Phe Cd* . 19172 1
502 . 1 1 44 44 PHE CE1 C 13 131.09553 0.13506 . 1 . . . . 44 Phe Ce* . 19172 1
503 . 1 1 44 44 PHE CE2 C 13 131.09553 0.13506 . 1 . . . . 44 Phe Ce* . 19172 1
504 . 1 1 44 44 PHE CZ C 13 130.21271 0.08 . 1 . . . . 44 Phe Cz . 19172 1
505 . 1 1 44 44 PHE N N 15 117.68081 0.01776 . 1 . . . . 44 Phe N . 19172 1
506 . 1 1 45 45 VAL H H 1 9.52812 0.00248 . 1 . . . . 45 Val H . 19172 1
507 . 1 1 45 45 VAL HA H 1 4.81538 0.00283 . 1 . . . . 45 Val Ha . 19172 1
508 . 1 1 45 45 VAL HB H 1 1.69205 0.00241 . 1 . . . . 45 Val Hb . 19172 1
509 . 1 1 45 45 VAL HG11 H 1 0.99203 0.00214 . 1 . . . . 45 Val Hg1* . 19172 1
510 . 1 1 45 45 VAL HG12 H 1 0.99203 0.00214 . 1 . . . . 45 Val Hg1* . 19172 1
511 . 1 1 45 45 VAL HG13 H 1 0.99203 0.00214 . 1 . . . . 45 Val Hg1* . 19172 1
512 . 1 1 45 45 VAL HG21 H 1 0.95923 0.00264 . 1 . . . . 45 Val Hg2* . 19172 1
513 . 1 1 45 45 VAL HG22 H 1 0.95923 0.00264 . 1 . . . . 45 Val Hg2* . 19172 1
514 . 1 1 45 45 VAL HG23 H 1 0.95923 0.00264 . 1 . . . . 45 Val Hg2* . 19172 1
515 . 1 1 45 45 VAL C C 13 174.26467 0.08 . 1 . . . . 45 Val C . 19172 1
516 . 1 1 45 45 VAL CA C 13 61.39541 0.06471 . 1 . . . . 45 Val Ca . 19172 1
517 . 1 1 45 45 VAL CB C 13 36.23379 0.09056 . 1 . . . . 45 Val Cb . 19172 1
518 . 1 1 45 45 VAL CG1 C 13 22.83992 0.12550 . 1 . . . . 45 Val Cg1 . 19172 1
519 . 1 1 45 45 VAL CG2 C 13 21.47378 0.11855 . 1 . . . . 45 Val Cg2 . 19172 1
520 . 1 1 45 45 VAL N N 15 119.38494 0.00958 . 1 . . . . 45 Val N . 19172 1
521 . 1 1 46 46 LEU H H 1 9.40400 0.00235 . 1 . . . . 46 Leu H . 19172 1
522 . 1 1 46 46 LEU HA H 1 5.11288 0.00253 . 1 . . . . 46 Leu Ha . 19172 1
523 . 1 1 46 46 LEU HB2 H 1 1.26724 0.00598 . 1 . . . . 46 Leu Hb2 . 19172 1
524 . 1 1 46 46 LEU HB3 H 1 1.81208 0.00430 . 1 . . . . 46 Leu Hb3 . 19172 1
525 . 1 1 46 46 LEU HG H 1 1.36411 0.00311 . 1 . . . . 46 Leu Hg . 19172 1
526 . 1 1 46 46 LEU HD11 H 1 0.53339 0.00115 . 1 . . . . 46 Leu Hd1* . 19172 1
527 . 1 1 46 46 LEU HD12 H 1 0.53339 0.00115 . 1 . . . . 46 Leu Hd1* . 19172 1
528 . 1 1 46 46 LEU HD13 H 1 0.53339 0.00115 . 1 . . . . 46 Leu Hd1* . 19172 1
529 . 1 1 46 46 LEU HD21 H 1 0.45327 0.00195 . 1 . . . . 46 Leu Hd2* . 19172 1
530 . 1 1 46 46 LEU HD22 H 1 0.45327 0.00195 . 1 . . . . 46 Leu Hd2* . 19172 1
531 . 1 1 46 46 LEU HD23 H 1 0.45327 0.00195 . 1 . . . . 46 Leu Hd2* . 19172 1
532 . 1 1 46 46 LEU C C 13 174.88257 0.08 . 1 . . . . 46 Leu C . 19172 1
533 . 1 1 46 46 LEU CA C 13 53.25285 0.02754 . 1 . . . . 46 Leu Ca . 19172 1
534 . 1 1 46 46 LEU CB C 13 44.26489 0.03116 . 1 . . . . 46 Leu Cb . 19172 1
535 . 1 1 46 46 LEU CG C 13 27.40228 0.01250 . 1 . . . . 46 Leu Cg . 19172 1
536 . 1 1 46 46 LEU CD1 C 13 24.42477 0.05706 . 1 . . . . 46 Leu Cd1 . 19172 1
537 . 1 1 46 46 LEU CD2 C 13 25.84924 0.07660 . 1 . . . . 46 Leu Cd2 . 19172 1
538 . 1 1 46 46 LEU N N 15 129.90246 0.01003 . 1 . . . . 46 Leu N . 19172 1
539 . 1 1 47 47 SER H H 1 9.11988 0.00167 . 1 . . . . 47 Ser H . 19172 1
540 . 1 1 47 47 SER HA H 1 5.35353 0.00226 . 1 . . . . 47 Ser Ha . 19172 1
541 . 1 1 47 47 SER HB2 H 1 3.35855 0.00331 . 1 . . . . 47 Ser Hb2 . 19172 1
542 . 1 1 47 47 SER HB3 H 1 3.38989 0.00370 . 1 . . . . 47 Ser Hb3 . 19172 1
543 . 1 1 47 47 SER C C 13 172.94957 0.08 . 1 . . . . 47 Ser C . 19172 1
544 . 1 1 47 47 SER CA C 13 59.24746 0.05270 . 1 . . . . 47 Ser Ca . 19172 1
545 . 1 1 47 47 SER CB C 13 64.63443 0.02671 . 1 . . . . 47 Ser Cb . 19172 1
546 . 1 1 47 47 SER N N 15 125.82542 0.01963 . 1 . . . . 47 Ser N . 19172 1
547 . 1 1 48 48 VAL H H 1 8.81829 0.00227 . 1 . . . . 48 Val H . 19172 1
548 . 1 1 48 48 VAL HA H 1 4.94416 0.00191 . 1 . . . . 48 Val Ha . 19172 1
549 . 1 1 48 48 VAL HB H 1 1.68345 0.00530 . 1 . . . . 48 Val Hb . 19172 1
550 . 1 1 48 48 VAL HG11 H 1 0.71676 0.00228 . 1 . . . . 48 Val Hg1* . 19172 1
551 . 1 1 48 48 VAL HG12 H 1 0.71676 0.00228 . 1 . . . . 48 Val Hg1* . 19172 1
552 . 1 1 48 48 VAL HG13 H 1 0.71676 0.00228 . 1 . . . . 48 Val Hg1* . 19172 1
553 . 1 1 48 48 VAL HG21 H 1 0.68156 0.00160 . 1 . . . . 48 Val Hg2* . 19172 1
554 . 1 1 48 48 VAL HG22 H 1 0.68156 0.00160 . 1 . . . . 48 Val Hg2* . 19172 1
555 . 1 1 48 48 VAL HG23 H 1 0.68156 0.00160 . 1 . . . . 48 Val Hg2* . 19172 1
556 . 1 1 48 48 VAL C C 13 174.84391 0.08 . 1 . . . . 48 Val C . 19172 1
557 . 1 1 48 48 VAL CA C 13 59.80647 0.03026 . 1 . . . . 48 Val Ca . 19172 1
558 . 1 1 48 48 VAL CB C 13 36.01778 0.04517 . 1 . . . . 48 Val Cb . 19172 1
559 . 1 1 48 48 VAL CG1 C 13 20.71819 0.01232 . 1 . . . . 48 Val Cg1 . 19172 1
560 . 1 1 48 48 VAL CG2 C 13 21.31716 0.10876 . 1 . . . . 48 Val Cg2 . 19172 1
561 . 1 1 48 48 VAL N N 15 122.84490 0.01867 . 1 . . . . 48 Val N . 19172 1
562 . 1 1 49 49 ARG H H 1 9.04003 0.00240 . 1 . . . . 49 Arg H . 19172 1
563 . 1 1 49 49 ARG HA H 1 4.98118 0.00582 . 1 . . . . 49 Arg Ha . 19172 1
564 . 1 1 49 49 ARG HB2 H 1 1.42139 0.00430 . 1 . . . . 49 Arg Hb2 . 19172 1
565 . 1 1 49 49 ARG HB3 H 1 2.19461 0.00482 . 1 . . . . 49 Arg Hb3 . 19172 1
566 . 1 1 49 49 ARG HG2 H 1 1.55666 0.00720 . 1 . . . . 49 Arg Hg2 . 19172 1
567 . 1 1 49 49 ARG HG3 H 1 1.55666 0.00720 . 1 . . . . 49 Arg Hg3 . 19172 1
568 . 1 1 49 49 ARG HD2 H 1 2.59954 0.00349 . 1 . . . . 49 Arg Hd2 . 19172 1
569 . 1 1 49 49 ARG HD3 H 1 2.91969 0.00685 . 1 . . . . 49 Arg Hd3 . 19172 1
570 . 1 1 49 49 ARG C C 13 173.93379 0.08 . 1 . . . . 49 Arg C . 19172 1
571 . 1 1 49 49 ARG CA C 13 55.04639 0.06303 . 1 . . . . 49 Arg Ca . 19172 1
572 . 1 1 49 49 ARG CB C 13 31.51703 0.11044 . 1 . . . . 49 Arg Cb . 19172 1
573 . 1 1 49 49 ARG CG C 13 27.85745 0.08564 . 1 . . . . 49 Arg Cg . 19172 1
574 . 1 1 49 49 ARG CD C 13 43.52819 0.15113 . 1 . . . . 49 Arg Cd . 19172 1
575 . 1 1 49 49 ARG N N 15 128.50975 0.00623 . 1 . . . . 49 Arg N . 19172 1
576 . 1 1 50 50 THR H H 1 8.77253 0.00739 . 1 . . . . 50 Thr H . 19172 1
577 . 1 1 50 50 THR HA H 1 4.64511 0.00573 . 1 . . . . 50 Thr Ha . 19172 1
578 . 1 1 50 50 THR HB H 1 4.24846 0.00310 . 1 . . . . 50 Thr Hb . 19172 1
579 . 1 1 50 50 THR HG21 H 1 1.12507 0.00319 . 1 . . . . 50 Thr Hg2* . 19172 1
580 . 1 1 50 50 THR HG22 H 1 1.12507 0.00319 . 1 . . . . 50 Thr Hg2* . 19172 1
581 . 1 1 50 50 THR HG23 H 1 1.12507 0.00319 . 1 . . . . 50 Thr Hg2* . 19172 1
582 . 1 1 50 50 THR C C 13 174.68939 0.08 . 1 . . . . 50 Thr C . 19172 1
583 . 1 1 50 50 THR CA C 13 61.04897 0.16131 . 1 . . . . 50 Thr Ca . 19172 1
584 . 1 1 50 50 THR CB C 13 70.25990 0.07560 . 1 . . . . 50 Thr Cb . 19172 1
585 . 1 1 50 50 THR CG2 C 13 22.23396 0.07412 . 1 . . . . 50 Thr Cg2 . 19172 1
586 . 1 1 50 50 THR N N 15 122.01119 0.04794 . 1 . . . . 50 Thr N . 19172 1
587 . 1 1 51 51 GLY H H 1 9.64886 0.01604 . 1 . . . . 51 Gly H . 19172 1
588 . 1 1 51 51 GLY HA2 H 1 3.97514 0.00256 . 1 . . . . 51 Gly Ha2 . 19172 1
589 . 1 1 51 51 GLY HA3 H 1 4.11272 9.41870e-04 . 1 . . . . 51 Gly Ha3 . 19172 1
590 . 1 1 51 51 GLY C C 13 173.10131 0.08 . 1 . . . . 51 Gly C . 19172 1
591 . 1 1 51 51 GLY CA C 13 45.02491 0.05093 . 1 . . . . 51 Gly Ca . 19172 1
592 . 1 1 51 51 GLY N N 15 112.48180 0.03726 . 1 . . . . 51 Gly N . 19172 1
593 . 1 1 52 52 ASP H H 1 8.39226 0.00213 . 1 . . . . 52 Asp H . 19172 1
594 . 1 1 52 52 ASP HA H 1 4.62002 0.00181 . 1 . . . . 52 Asp Ha . 19172 1
595 . 1 1 52 52 ASP HB2 H 1 2.57437 0.00381 . 1 . . . . 52 Asp Hb2 . 19172 1
596 . 1 1 52 52 ASP HB3 H 1 2.66191 0.00368 . 1 . . . . 52 Asp Hb3 . 19172 1
597 . 1 1 52 52 ASP C C 13 176.14122 0.08 . 1 . . . . 52 Asp C . 19172 1
598 . 1 1 52 52 ASP CA C 13 53.94594 0.04214 . 1 . . . . 52 Asp Ca . 19172 1
599 . 1 1 52 52 ASP CB C 13 42.16885 0.04585 . 1 . . . . 52 Asp Cb . 19172 1
600 . 1 1 52 52 ASP N N 15 120.65708 0.00807 . 1 . . . . 52 Asp N . 19172 1
601 . 1 1 53 53 ASP H H 1 8.53354 0.00295 . 1 . . . . 53 Asp H . 19172 1
602 . 1 1 53 53 ASP HA H 1 4.49648 0.01618 . 1 . . . . 53 Asp Ha . 19172 1
603 . 1 1 53 53 ASP HB2 H 1 2.58047 0.00360 . 1 . . . . 53 Asp Hb2 . 19172 1
604 . 1 1 53 53 ASP HB3 H 1 2.66445 0.00946 . 1 . . . . 53 Asp Hb3 . 19172 1
605 . 1 1 53 53 ASP C C 13 176.45576 0.08 . 1 . . . . 53 Asp C . 19172 1
606 . 1 1 53 53 ASP CA C 13 55.03373 0.07795 . 1 . . . . 53 Asp Ca . 19172 1
607 . 1 1 53 53 ASP CB C 13 41.01674 0.05256 . 1 . . . . 53 Asp Cb . 19172 1
608 . 1 1 53 53 ASP N N 15 120.62832 0.00756 . 1 . . . . 53 Asp N . 19172 1
609 . 1 1 54 54 LYS H H 1 8.33448 0.00165 . 1 . . . . 54 Lys H . 19172 1
610 . 1 1 54 54 LYS HA H 1 4.31358 0.00427 . 1 . . . . 54 Lys Ha . 19172 1
611 . 1 1 54 54 LYS HB2 H 1 1.77509 0.00448 . 1 . . . . 54 Lys Hb2 . 19172 1
612 . 1 1 54 54 LYS HB3 H 1 1.86431 0.00850 . 1 . . . . 54 Lys Hb3 . 19172 1
613 . 1 1 54 54 LYS HG2 H 1 1.35756 3.51417e-05 . 1 . . . . 54 Lys Hg2 . 19172 1
614 . 1 1 54 54 LYS HG3 H 1 1.40053 5.61825e-04 . 1 . . . . 54 Lys Hg3 . 19172 1
615 . 1 1 54 54 LYS HD2 H 1 1.65023 2.40236e-05 . 1 . . . . 54 Lys Hd2 . 19172 1
616 . 1 1 54 54 LYS HD3 H 1 1.65023 2.40236e-05 . 1 . . . . 54 Lys Hd3 . 19172 1
617 . 1 1 54 54 LYS HE2 H 1 2.97075 8.04565e-04 . 1 . . . . 54 Lys He2 . 19172 1
618 . 1 1 54 54 LYS HE3 H 1 2.97075 8.04565e-04 . 1 . . . . 54 Lys He3 . 19172 1
619 . 1 1 54 54 LYS C C 13 177.08647 0.08 .1 . . . . . 54 Lys C . 19172 1
620 . 1 1 54 54 LYS CA C 13 56.27068 0.04444 . 1 . . . . 54 Lys Ca . 19172 1
621 . 1 1 54 54 LYS CB C 13 32.71726 0.04207 . 1 . . . . 54 Lys Cb . 19172 1
622 . 1 1 54 54 LYS CG C 13 24.70793 0.00606 . 1 . . . . 54 Lys Cg . 19172 1
623 . 1 1 54 54 LYS CD C 13 28.90010 0.00320 . 1 . . . . 54 Lys Cd . 19172 1
624 . 1 1 54 54 LYS CE C 13 42.11131 0.00297 . 1 . . . . 54 Lys Ce . 19172 1
625 . 1 1 54 54 LYS N N 15 120.29786 0.01780 . 1 . . . . 54 Lys N . 19172 1
626 . 1 1 55 55 GLY H H 1 8.26168 0.00242 . 1 . . . . 55 Gly H . 19172 1
627 . 1 1 55 55 GLY HA2 H 1 3.88635 0.00231 . 1 . . . . 55 Gly Ha2 . 19172 1
628 . 1 1 55 55 GLY HA3 H 1 3.96017 0.01285 . 1 . . . . 55 Gly Ha3 . 19172 1
629 . 1 1 55 55 GLY C C 13 174.33238 0.08 . 1 . . . . 55 Gly C . 19172 1
630 . 1 1 55 55 GLY CA C 13 45.54023 0.05811 . 1 . . . . 55 Gly Ca . 19172 1
631 . 1 1 55 55 GLY N N 15 109.25216 0.00763 . 1 . . . . 55 Gly N . 19172 1
632 . 1 1 56 56 GLU H H 1 8.45239 0.00265 . 1 . . . . 56 Glu H . 19172 1
633 . 1 1 56 56 GLU HA H 1 4.28648 0.00184 . 1 . . . . 56 Glu Ha . 19172 1
634 . 1 1 56 56 GLU HB2 H 1 1.91845 0.00498 . 1 . . . . 56 Glu Hb2 . 19172 1
635 . 1 1 56 56 GLU HB3 H 1 2.05951 0.00206 . 1 . . . . 56 Glu Hb3 . 19172 1
636 . 1 1 56 56 GLU HG2 H 1 2.22929 0.00559 . 1 . . . . 56 Glu Hg2 . 19172 1
637 . 1 1 56 56 GLU HG3 H 1 2.22929 0.00559 . 1 . . . . 56 Glu Hg3 . 19172 1
638 . 1 1 56 56 GLU C C 13 176.79748 0.08 . 1 . . . . 56 Glu C . 19172 1
639 . 1 1 56 56 GLU CA C 13 56.75725 0.02738 . 1 . . . . 56 Glu Ca . 19172 1
640 . 1 1 56 56 GLU CB C 13 30.26853 0.11021 . 1 . . . . 56 Glu Cb . 19172 1
641 . 1 1 56 56 GLU CG C 13 36.29314 0.04045 . 1 . . . . 56 Glu Cg . 19172 1
642 . 1 1 56 56 GLU N N 15 120.60107 0.00984 . 1 . . . . 56 Glu N . 19172 1
643 . 1 1 57 57 SER H H 1 8.37065 0.00185 . 1 . . . . 57 Ser H . 19172 1
644 . 1 1 57 57 SER HA H 1 4.44058 0.00230 . 1 . . . . 57 Ser Ha . 19172 1
645 . 1 1 57 57 SER HB2 H 1 3.87516 0.00642 . 1 . . . . 57 Ser Hb2 . 19172 1
646 . 1 1 57 57 SER HB3 H 1 3.87516 0.00642 . 1 . . . . 57 Ser Hb3 . 19172 1
647 . 1 1 57 57 SER C C 13 174.70246 0.08 . 1 . . . . 57 Ser C . 19172 1
648 . 1 1 57 57 SER CA C 13 58.35570 0.07614 . 1 . . . . 57 Ser Ca . 19172 1
649 . 1 1 57 57 SER CB C 13 63.85097 0.05038 . 1 . . . . 57 Ser Cb . 19172 1
650 . 1 1 57 57 SER N N 15 115.78260 0.01985 . 1 . . . . 57 Ser N . 19172 1
651 . 1 1 58 58 ASN H H 1 8.55699 0.00159 . 1 . . . . 58 Asn H . 19172 1
652 . 1 1 58 58 ASN HA H 1 4.70250 0.00962 . 1 . . . . 58 Asn Ha . 19172 1
653 . 1 1 58 58 ASN HB2 H 1 2.74695 0.00509 . 1 . . . . 58 Asn Hb2 . 19172 1
654 . 1 1 58 58 ASN HB3 H 1 2.85028 0.00517 . 1 . . . . 58 Asn Hb3 . 19172 1
655 . 1 1 58 58 ASN HD21 H 1 6.90675 0.00258 . 1 . . . . 58 Asn Hd21 . 19172 1
656 . 1 1 58 58 ASN HD22 H 1 7.59682 0.00268 . 1 . . . . 58 Asn Hd22 . 19172 1
657 . 1 1 58 58 ASN C C 13 175.16954 0.08 . 1 . . . . 58 Asn C . 19172 1
658 . 1 1 58 58 ASN CA C 13 53.69125 0.04467 . 1 . . . . 58 Asn Ca . 19172 1
659 . 1 1 58 58 ASN CB C 13 38.66390 0.02135 . 1 . . . . 58 Asn Cb . 19172 1
660 . 1 1 58 58 ASN N N 15 120.51477 0.02238 . 1 . . . . 58 Asn N . 19172 1
661 . 1 1 58 58 ASN ND2 N 15 113.02903 0.01755 . 1 . . . . 58 Asn Nd2 . 19172 1
662 . 1 1 59 59 ASP H H 1 8.22457 0.00142 . 1 . . . . 59 Asp H . 19172 1
663 . 1 1 59 59 ASP HA H 1 4.53491 0.00248 . 1 . . . . 59 Asp Ha . 19172 1
664 . 1 1 59 59 ASP HB2 H 1 2.60103 0.00449 . 1 . . . . 59 Asp Hb2 . 19172 1
665 . 1 1 59 59 ASP HB3 H 1 2.73137 2.27287e-04 . 1 . . . . 59 Asp Hb3 . 19172 1
666 . 1 1 59 59 ASP C C 13 176.83913 0.08 . 1 . . . . 59 Asp C . 19172 1
667 . 1 1 59 59 ASP CA C 13 54.49470 0.06562 . 1 . . . . 59 Asp Ca . 19172 1
668 . 1 1 59 59 ASP CB C 13 41.02132 0.01989 . 1 . . . . 59 Asp Cb . 19172 1
669 . 1 1 59 59 ASP N N 15 119.23408 0.02054 . 1 . . . . 59 Asp N . 19172 1
670 . 1 1 60 60 GLY H H 1 8.27625 0.00212 . 1 . . . . 60 Gly H . 19172 1
671 . 1 1 60 60 GLY HA2 H 1 3.87165 0.00788 . 1 . . . . 60 Gly Ha2 . 19172 1
672 . 1 1 60 60 GLY HA3 H 1 3.94288 3.08681e-04 . 1 . . . . 60 Gly Ha3 . 19172 1
673 . 1 1 60 60 GLY C C 13 174.31893 0.08 . 1 . . . . 60 Gly C . 19172 1
674 . 1 1 60 60 GLY CA C 13 45.73199 0.08756 . 1 . . . . 60 Gly Ca . 19172 1
675 . 1 1 60 60 GLY N N 15 108.57591 0.01004 . 1 . . . . 60 Gly N . 19172 1
676 . 1 1 61 61 LYS H H 1 7.96812 0.00193 . 1 . . . . 61 Lys H . 19172 1
677 . 1 1 61 61 LYS HA H 1 4.37221 7.76150e-04 . 1 . . . . 61 Lys Ha . 19172 1
678 . 1 1 61 61 LYS HB2 H 1 1.74303 0.00209 . 1 . . . . 61 Lys Hb2 . 19172 1
679 . 1 1 61 61 LYS HB3 H 1 1.80748 0.00568 . 1 . . . . 61 Lys Hb3 . 19172 1
680 . 1 1 61 61 LYS HG2 H 1 1.40392 2.76653e-04 . 1 . . . . 61 Lys Hg2 . 19172 1
681 . 1 1 61 61 LYS HG3 H 1 1.40392 2.76653e-04 . 1 . . . . 61 Lys Hg3 . 19172 1
682 . 1 1 61 61 LYS HD2 H 1 1.65173 9.80515e-05 . 1 . . . . 61 Lys Hd2 . 19172 1
683 . 1 1 61 61 LYS HD3 H 1 1.65173 9.80515e-05 . 1 . . . . 61 Lys Hd3 . 19172 1
684 . 1 1 61 61 LYS HE2 H 1 2.97290 8.62259e-04 . 1 . . . . 61 Lys He2 . 19172 1
685 . 1 1 61 61 LYS HE3 H 1 2.97290 8.62259e-04 . 1 . . . . 61 Lys He3 . 19172 1
686 . 1 1 61 61 LYS C C 13 176.63268 0.08 . 1 . . . . 61 Lys C . 19172 1
687 . 1 1 61 61 LYS CA C 13 56.05145 0.01545 . 1 . . . . 61 Lys Ca . 19172 1
688 . 1 1 61 61 LYS CB C 13 33.18952 0.07120 . 1 . . . . 61 Lys Cb . 19172 1
689 . 1 1 61 61 LYS CG C 13 24.79098 3.11208e-04 . 1 . . . . 61 Lys Cg . 19172 1
690 . 1 1 61 61 LYS CD C 13 28.94921 7.10695e-05 . 1 . . . . 61 Lys Cd . 19172 1
691 . 1 1 61 61 LYS CE C 13 42.19755 0.00216 . 1 . . . . 61 Lys Ce . 19172 1
692 . 1 1 61 61 LYS N N 15 120.37565 0.01898 . 1 . . . . 61 Lys N . 19172 1
693 . 1 1 62 62 SER H H 1 8.29507 0.00257 . 1 . . . . 62 Ser H . 19172 1
694 . 1 1 62 62 SER HA H 1 4.54634 0.00500 . 1 . . . . 62 Ser Ha . 19172 1
695 . 1 1 62 62 SER HB2 H 1 3.76084 0.00537 . 1 . . . . 62 Ser Hb2 . 19172 1
696 . 1 1 62 62 SER HB3 H 1 3.76084 0.00537 . 1 . . . . 62 Ser Hb3 . 19172 1
697 . 1 1 62 62 SER C C 13 174.24365 0.08 . 1 . . . . 62 Ser C . 19172 1
698 . 1 1 62 62 SER CA C 13 58.47831 0.14298 . 1 . . . . 62 Ser Ca . 19172 1
699 . 1 1 62 62 SER CB C 13 64.20790 0.11918 . 1 . . . . 62 Ser Cb . 19172 1
700 . 1 1 62 62 SER N N 15 117.01117 0.01153 . 1 . . . . 62 Ser N . 19172 1
701 . 1 1 63 63 LYS H H 1 8.63132 0.00230 . 1 . . . . 63 Lys H . 19172 1
702 . 1 1 63 63 LYS HA H 1 4.38471 0.00116 . 1 . . . . 63 Lys Ha . 19172 1
703 . 1 1 63 63 LYS HB2 H 1 1.65291 5.02451e-04 . 1 . . . . 63 Lys Hb2 . 19172 1
704 . 1 1 63 63 LYS HB3 H 1 1.79391 5.15102e-04 . 1 . . . . 63 Lys Hb3 . 19172 1
705 . 1 1 63 63 LYS HG2 H 1 1.32703 0.08 . 1 . . . . 63 Lys Hg2 . 19172 1
706 . 1 1 63 63 LYS HG3 H 1 1.37648 0.08 . 1 . . . . 63 Lys Hg3 . 19172 1
707 . 1 1 63 63 LYS HD2 H 1 1.58491 0.00105 . 1 . . . . 63 Lys Hd2 . 19172 1
708 . 1 1 63 63 LYS HD3 H 1 1.58491 0.00105 . 1 . . . . 63 Lys Hd3 . 19172 1
709 . 1 1 63 63 LYS HE2 H 1 2.91271 9.55422e-05 . 1 . . . . 63 Lys He2 . 19172 1
710 . 1 1 63 63 LYS HE3 H 1 2.96982 3.87725e-05 . 1 . . . . 63 Lys He3 . 19172 1
711 . 1 1 63 63 LYS C C 13 175.03851 0.08 . 1 . . . . 63 Lys C . 19172 1
712 . 1 1 63 63 LYS CA C 13 56.07040 0.06471 . 1 . . . . 63 Lys Ca . 19172 1
713 . 1 1 63 63 LYS CB C 13 34.29756 0.02108 . 1 . . . . 63 Lys Cb . 19172 1
714 . 1 1 63 63 LYS CD C 13 29.18479 0.01227 . 1 . . . . 63 Lys Cd . 19172 1
715 . 1 1 63 63 LYS CE C 13 42.23627 3.30889e-04 . 1 . . . . 63 Lys Ce . 19172 1
716 . 1 1 63 63 LYS N N 15 123.01507 0.00727 . 1 . . . . 63 Lys N . 19172 1
717 . 1 1 64 64 VAL H H 1 8.11383 0.00238 . 1 . . . . 64 Val H . 19172 1
718 . 1 1 64 64 VAL HA H 1 4.77231 0.00152 . 1 . . . . 64 Val Ha . 19172 1
719 . 1 1 64 64 VAL HB H 1 1.62399 0.00805 . 1 . . . . 64 Val Hb . 19172 1
720 . 1 1 64 64 VAL HG11 H 1 0.21096 0.00524 . 1 . . . . 64 Val Hg1* . 19172 1
721 . 1 1 64 64 VAL HG12 H 1 0.21096 0.00524 . 1 . . . . 64 Val Hg1* . 19172 1
722 . 1 1 64 64 VAL HG13 H 1 0.21096 0.00524 . 1 . . . . 64 Val Hg1* . 19172 1
723 . 1 1 64 64 VAL HG21 H 1 0.75274 0.00238 . 1 . . . . 64 Val Hg2* . 19172 1
724 . 1 1 64 64 VAL HG22 H 1 0.75274 0.00238 . 1 . . . . 64 Val Hg2* . 19172 1
725 . 1 1 64 64 VAL HG23 H 1 0.75274 0.00238 . 1 . . . . 64 Val Hg2* . 19172 1
726 . 1 1 64 64 VAL C C 13 174.32904 0.08 . 1 . . . . 64 Val C . 19172 1
727 . 1 1 64 64 VAL CA C 13 60.51887 0.03014 . 1 . . . . 64 Val Ca . 19172 1
728 . 1 1 64 64 VAL CB C 13 34.88681 0.13386 . 1 . . . . 64 Val Cb . 19172 1
729 . 1 1 64 64 VAL CG1 C 13 21.31635 0.01599 . 1 . . . . 64 Val Cg1 . 19172 1
730 . 1 1 64 64 VAL CG2 C 13 22.42842 0.03388 . 1 . . . . 64 Val Cg2 . 19172 1
731 . 1 1 64 64 VAL N N 15 121.36756 0.01152 . 1 . . . . 64 Val N . 19172 1
732 . 1 1 65 65 THR H H 1 8.80443 0.00316 . 1 . . . . 65 Thr H . 19172 1
733 . 1 1 65 65 THR HA H 1 4.27922 0.00123 . 1 . . . . 65 Thr Ha . 19172 1
734 . 1 1 65 65 THR HB H 1 3.56831 0.00234 . 1 . . . . 65 Thr Hb . 19172 1
735 . 1 1 65 65 THR HG21 H 1 1.07068 0.00185 . 1 . . . . 65 Thr Hg2* . 19172 1
736 . 1 1 65 65 THR HG22 H 1 1.07068 0.00185 . 1 . . . . 65 Thr Hg2* . 19172 1
737 . 1 1 65 65 THR HG23 H 1 1.07068 0.00185 . 1 . . . . 65 Thr Hg2* . 19172 1
738 . 1 1 65 65 THR C C 13 171.65610 0.08 . 1 . . . . 65 Thr C . 19172 1
739 . 1 1 65 65 THR CA C 13 61.49029 0.02388 . 1 . . . . 65 Thr Ca . 19172 1
740 . 1 1 65 65 THR CB C 13 70.64420 0.02228 . 1 . . . . 65 Thr Cb . 19172 1
741 . 1 1 65 65 THR CG2 C 13 21.88055 0.04979 . 1 . . . . 65 Thr Cg2 . 19172 1
742 . 1 1 65 65 THR N N 15 124.45412 0.01654 . 1 . . . . 65 Thr N . 19172 1
743 . 1 1 66 66 HIS H H 1 8.73539 0.00216 . 1 . . . . 66 His H . 19172 1
744 . 1 1 66 66 HIS HA H 1 5.02724 0.00367 . 1 . . . . 66 His Ha . 19172 1
745 . 1 1 66 66 HIS HB2 H 1 2.66005 0.00283 . 1 . . . . 66 His Hb2 . 19172 1
746 . 1 1 66 66 HIS HB3 H 1 2.94838 0.00539 . 1 . . . . 66 His Hb3 . 19172 1
747 . 1 1 66 66 HIS HD2 H 1 7.10080 0.00954 . 1 . . . . 66 His Hd2 . 19172 1
748 . 1 1 66 66 HIS HE1 H 1 7.41377 0.00344 . 1 . . . . 66 His He1 . 19172 1
749 . 1 1 66 66 HIS C C 13 174.77634 0.08 . 1 . . . . 66 His C . 19172 1
750 . 1 1 66 66 HIS CA C 13 54.76377 0.05317 . 1 . . . . 66 His Ca . 19172 1
751 . 1 1 66 66 HIS CB C 13 31.69740 0.13700 . 1 . . . . 66 His Cb . 19172 1
752 . 1 1 66 66 HIS CD2 C 13 120.86356 0.05285 . 1 . . . . 66 His Cd2 . 19172 1
753 . 1 1 66 66 HIS CE1 C 13 138.11458 0.05170 . 1 . . . . 66 His Ce1 . 19172 1
754 . 1 1 66 66 HIS N N 15 126.42756 0.01386 . 1 . . . . 66 His N . 19172 1
755 . 1 1 67 67 VAL H H 1 9.57123 0.00324 . 1 . . . . 67 Val H . 19172 1
756 . 1 1 67 67 VAL HA H 1 4.12355 0.00306 . 1 . . . . 67 Val Ha . 19172 1
757 . 1 1 67 67 VAL HB H 1 2.13386 0.00406 . 1 . . . . 67 Val Hb . 19172 1
758 . 1 1 67 67 VAL HG11 H 1 0.84481 0.00238 . 1 . . . . 67 Val Hg1* . 19172 1
759 . 1 1 67 67 VAL HG12 H 1 0.84481 0.00238 . 1 . . . . 67 Val Hg1* . 19172 1
760 . 1 1 67 67 VAL HG13 H 1 0.84481 0.00238 . 1 . . . . 67 Val Hg1* . 19172 1
761 . 1 1 67 67 VAL HG21 H 1 0.75188 0.00148 . 1 . . . . 67 Val Hg2* . 19172 1
762 . 1 1 67 67 VAL HG22 H 1 0.75188 0.00148 . 1 . . . . 67 Val Hg2* . 19172 1
763 . 1 1 67 67 VAL HG23 H 1 0.75188 0.00148 . 1 . . . . 67 Val Hg2* . 19172 1
764 . 1 1 67 67 VAL C C 13 174.95168 0.08 . 1 . . . . 67 Val C . 19172 1
765 . 1 1 67 67 VAL CA C 13 61.82618 0.07993 . 1 . . . . 67 Val Ca . 19172 1
766 . 1 1 67 67 VAL CB C 13 33.67919 0.16245 . 1 . . . . 67 Val Cb . 19172 1
767 . 1 1 67 67 VAL CG1 C 13 21.16252 0.19842 . 1 . . . . 67 Val Cg1 . 19172 1
768 . 1 1 67 67 VAL CG2 C 13 21.07552 0.10496 . 1 . . . . 67 Val Cg2 . 19172 1
769 . 1 1 67 67 VAL N N 15 127.84046 0.01186 . 1 . . . . 67 Val N . 19172 1
770 . 1 1 68 68 MET H H 1 8.70469 0.00148 . 1 . . . . 68 Met H . 19172 1
771 . 1 1 68 68 MET HA H 1 4.57691 0.00333 . 1 . . . . 68 Met Ha . 19172 1
772 . 1 1 68 68 MET HB2 H 1 1.94268 0.00293 . 1 . . . . 68 Met Hb2 . 19172 1
773 . 1 1 68 68 MET HB3 H 1 2.01094 0.00137 . 1 . . . . 68 Met Hb3 . 19172 1
774 . 1 1 68 68 MET HG2 H 1 2.52710 0.08 . 1 . . . . 68 Met Hg2 . 19172 1
775 . 1 1 68 68 MET HG3 H 1 2.52710 0.08 . 1 . . . . 68 Met Hg3 . 19172 1
776 . 1 1 68 68 MET HE1 H 1 1.90816 8.70589e-04 . 1 . . . . 68 Met He* . 19172 1
777 . 1 1 68 68 MET HE2 H 1 1.90816 8.70589e-04 . 1 . . . . 68 Met He* . 19172 1
778 . 1 1 68 68 MET HE3 H 1 1.90816 8.70589e-04 . 1 . . . . 68 Met He* . 19172 1
779 . 1 1 68 68 MET C C 13 175.43688 0.08 . 1 . . . . 68 Met C . 19172 1
780 . 1 1 68 68 MET CA C 13 56.03941 0.04803 . 1 . . . . 68 Met Ca . 19172 1
781 . 1 1 68 68 MET CB C 13 31.78966 0.15918 . 1 . . . . 68 Met Cb . 19172 1
782 . 1 1 68 68 MET CE C 13 16.16304 0.01763 . 1 . . . . 68 Met Ce . 19172 1
783 . 1 1 68 68 MET N N 15 127.25496 0.01057 . 1 . . . . 68 Met N . 19172 1
784 . 1 1 69 69 ILE H H 1 9.02797 0.00507 . 1 . . . . 69 Ile H . 19172 1
785 . 1 1 69 69 ILE HA H 1 4.62244 0.00540 . 1 . . . . 69 Ile Ha . 19172 1
786 . 1 1 69 69 ILE HB H 1 1.83119 0.00909 . 1 . . . . 69 Ile Hb . 19172 1
787 . 1 1 69 69 ILE HG12 H 1 0.78365 2.61029e-04 . 1 . . . . 69 Ile Hg12 . 19172 1
788 . 1 1 69 69 ILE HG13 H 1 1.69753 0.00282 . 1 . . . . 69 Ile Hg13 . 19172 1
789 . 1 1 69 69 ILE HG21 H 1 1.03005 0.00124 . 1 . . . . 69 Ile Hg2* . 19172 1
790 . 1 1 69 69 ILE HG22 H 1 1.03005 0.00124 . 1 . . . . 69 Ile Hg2* . 19172 1
791 . 1 1 69 69 ILE HG23 H 1 1.03005 0.00124 . 1 . . . . 69 Ile Hg2* . 19172 1
792 . 1 1 69 69 ILE HD11 H 1 0.73852 0.00150 . 1 . . . . 69 Ile Hd1* . 19172 1
793 . 1 1 69 69 ILE HD12 H 1 0.73852 0.00150 . 1 . . . . 69 Ile Hd1* . 19172 1
794 . 1 1 69 69 ILE HD13 H 1 0.73852 0.00150 . 1 . . . . 69 Ile Hd1* . 19172 1
795 . 1 1 69 69 ILE C C 13 175.57041 0.08 . 1 . . . . 69 Ile C . 19172 1
796 . 1 1 69 69 ILE CA C 13 60.01338 0.14880 . 1 . . . . 69 Ile Ca . 19172 1
797 . 1 1 69 69 ILE CB C 13 39.60219 0.05982 . 1 . . . . 69 Ile Cb . 19172 1
798 . 1 1 69 69 ILE CG1 C 13 26.14685 0.07007 . 1 . . . . 69 Ile Cg1 . 19172 1
799 . 1 1 69 69 ILE CG2 C 13 18.56920 0.00284 . 1 . . . . 69 Ile Cg2 . 19172 1
800 . 1 1 69 69 ILE CD1 C 13 15.12082 0.00788 . 1 . . . . 69 Ile Cd1 . 19172 1
801 . 1 1 69 69 ILE N N 15 125.60321 0.01656 . 1 . . . . 69 Ile N . 19172 1
802 . 1 1 70 70 ARG H H 1 8.77322 0.00271 . 1 . . . . 70 Arg H . 19172 1
803 . 1 1 70 70 ARG HA H 1 4.41941 0.00355 . 1 . . . . 70 Arg Ha . 19172 1
804 . 1 1 70 70 ARG HB2 H 1 1.81603 0.00923 . 1 . . . . 70 Arg Hb2 . 19172 1
805 . 1 1 70 70 ARG HB3 H 1 1.91101 0.00474 . 1 . . . . 70 Arg Hb3 . 19172 1
806 . 1 1 70 70 ARG HG2 H 1 1.69777 0.00300 . 1 . . . . 70 Arg Hg2 . 19172 1
807 . 1 1 70 70 ARG HG3 H 1 1.69777 0.00300 . 1 . . . . 70 Arg Hg3 . 19172 1
808 . 1 1 70 70 ARG HD2 H 1 3.11159 0.00654 . 1 . . . . 70 Arg Hd2 . 19172 1
809 . 1 1 70 70 ARG HD3 H 1 3.16886 0.00535 . 1 . . . . 70 Arg Hd3 . 19172 1
810 . 1 1 70 70 ARG C C 13 175.55310 0.08 . 1 . . . . 70 Arg C . 19172 1
811 . 1 1 70 70 ARG CA C 13 55.61664 0.11489 . 1 . . . . 70 Arg Ca . 19172 1
812 . 1 1 70 70 ARG CB C 13 31.59577 0.10910 . 1 . . . . 70 Arg Cb . 19172 1
813 . 1 1 70 70 ARG CG C 13 26.65861 0.05458 . 1 . . . . 70 Arg Cg . 19172 1
814 . 1 1 70 70 ARG CD C 13 43.75701 0.11187 . 1 . . . . 70 Arg Cd . 19172 1
815 . 1 1 70 70 ARG N N 15 127.96648 0.01083 . 1 . . . . 70 Arg N . 19172 1
816 . 1 1 71 71 CYS H H 1 8.79280 0.00278 . 1 . . . . 71 Cys H . 19172 1
817 . 1 1 71 71 CYS HA H 1 5.07078 0.00283 . 1 . . . . 71 Cys Ha . 19172 1
818 . 1 1 71 71 CYS HB2 H 1 2.71160 0.00255 . 1 . . . . 71 Cys Hb2 . 19172 1
819 . 1 1 71 71 CYS HB3 H 1 3.16013 0.00304 . 1 . . . . 71 Cys Hb3 . 19172 1
820 . 1 1 71 71 CYS C C 13 174.58247 0.08 . 1 . . . . 71 Cys C . 19172 1
821 . 1 1 71 71 CYS CA C 13 57.11275 0.06123 . 1 . . . . 71 Cys Ca . 19172 1
822 . 1 1 71 71 CYS CB C 13 28.24362 0.12236 . 1 . . . . 71 Cys Cb . 19172 1
823 . 1 1 71 71 CYS N N 15 125.09418 0.01951 . 1 . . . . 71 Cys N . 19172 1
824 . 1 1 72 72 GLN H H 1 8.63464 0.00227 . 1 . . . . 72 Gln H . 19172 1
825 . 1 1 72 72 GLN HA H 1 4.58678 0.00132 . 1 . . . . 72 Gln Ha . 19172 1
826 . 1 1 72 72 GLN HB2 H 1 1.83750 1.18191e-04 . 1 . . . . 72 Gln Hb2 . 19172 1
827 . 1 1 72 72 GLN HB3 H 1 1.93916 6.73335e-05 . 1 . . . . 72 Gln Hb3 . 19172 1
828 . 1 1 72 72 GLN HG2 H 1 2.17394 0.00289 . 1 . . . . 72 Gln Hg2 . 19172 1
829 . 1 1 72 72 GLN HG3 H 1 2.24231 0.00340 . 1 . . . . 72 Gln Hg3 . 19172 1
830 . 1 1 72 72 GLN HE21 H 1 6.68834 0.00347 . 1 . . . . 72 Gln He21 . 19172 1
831 . 1 1 72 72 GLN HE22 H 1 7.63248 0.00289 . 1 . . . . 72 Gln He22 . 19172 1
832 . 1 1 72 72 GLN C C 13 175.06274 0.08 . 1 . . . . 72 Gln C . 19172 1
833 . 1 1 72 72 GLN CA C 13 55.09278 0.06206 . 1 . . . . 72 Gln Ca . 19172 1
834 . 1 1 72 72 GLN CB C 13 31.50507 0.02328 . 1 . . . . 72 Gln Cb . 19172 1
835 . 1 1 72 72 GLN CG C 13 33.83275 0.08864 . 1 . . . . 72 Gln Cg . 19172 1
836 . 1 1 72 72 GLN N N 15 127.84579 0.01170 . 1 . . . . 72 Gln N . 19172 1
837 . 1 1 72 72 GLN NE2 N 15 111.63800 0.03313 . 1 . . . . 72 Gln Ne2 . 19172 1
838 . 1 1 73 73 GLU H H 1 9.32750 0.00170 . 1 . . . . 73 Glu H . 19172 1
839 . 1 1 73 73 GLU HA H 1 3.75395 0.00209 . 1 . . . . 73 Glu Ha . 19172 1
840 . 1 1 73 73 GLU HB2 H 1 1.94313 0.00800 . 1 . . . . 73 Glu Hb2 . 19172 1
841 . 1 1 73 73 GLU HB3 H 1 2.09990 0.00247 . 1 . . . . 73 Glu Hb3 . 19172 1
842 . 1 1 73 73 GLU HG2 H 1 2.16418 0.00210 . 1 . . . . 73 Glu Hg2 . 19172 1
843 . 1 1 73 73 GLU HG3 H 1 2.16418 0.00210 . 1 . . . . 73 Glu Hg3 . 19172 1
844 . 1 1 73 73 GLU C C 13 174.88807 0.08 . 1 . . . . 73 Glu C . 19172 1
845 . 1 1 73 73 GLU CA C 13 57.33668 0.05987 . 1 . . . . 73 Glu Ca . 19172 1
846 . 1 1 73 73 GLU CB C 13 27.57031 0.10772 . 1 . . . . 73 Glu Cb . 19172 1
847 . 1 1 73 73 GLU CG C 13 37.00652 0.13857 . 1 . . . . 73 Glu Cg . 19172 1
848 . 1 1 73 73 GLU N N 15 125.18858 0.00484 . 1 . . . . 73 Glu N . 19172 1
849 . 1 1 74 74 LEU H H 1 8.33096 0.00141 . 1 . . . . 74 Leu H . 19172 1
850 . 1 1 74 74 LEU HA H 1 3.46032 0.00183 . 1 . . . . 74 Leu Ha . 19172 1
851 . 1 1 74 74 LEU HB2 H 1 1.63572 0.00499 . 1 . . . . 74 Leu Hb2 . 19172 1
852 . 1 1 74 74 LEU HB3 H 1 2.08833 0.00394 . 1 . . . . 74 Leu Hb3 . 19172 1
853 . 1 1 74 74 LEU HG H 1 1.45313 0.01135 . 1 . . . . 74 Leu Hg . 19172 1
854 . 1 1 74 74 LEU HD11 H 1 0.87577 7.85280e-04 . 1 . . . . 74 Leu Hd1* . 19172 1
855 . 1 1 74 74 LEU HD12 H 1 0.87577 7.85280e-04 . 1 . . . . 74 Leu Hd1* . 19172 1
856 . 1 1 74 74 LEU HD13 H 1 0.87577 7.85280e-04 . 1 . . . . 74 Leu Hd1* . 19172 1
857 . 1 1 74 74 LEU HD21 H 1 0.81621 0.00107 . 1 . . . . 74 Leu Hd2* . 19172 1
858 . 1 1 74 74 LEU HD22 H 1 0.81621 0.00107 . 1 . . . . 74 Leu Hd2* . 19172 1
859 . 1 1 74 74 LEU HD23 H 1 0.81621 0.00107 . 1 . . . . 74 Leu Hd2* . 19172 1
860 . 1 1 74 74 LEU C C 13 175.28240 0.08 . 1 . . . . 74 Leu C . 19172 1
861 . 1 1 74 74 LEU CA C 13 56.58273 0.07605 . 1 . . . . 74 Leu Ca . 19172 1
862 . 1 1 74 74 LEU CB C 13 39.36338 0.03305 . 1 . . . . 74 Leu Cb . 19172 1
863 . 1 1 74 74 LEU CG C 13 27.19029 0.09980 . 1 . . . . 74 Leu Cg . 19172 1
864 . 1 1 74 74 LEU CD1 C 13 25.38772 0.02311 . 1 . . . . 74 Leu Cd1 . 19172 1
865 . 1 1 74 74 LEU CD2 C 13 22.64913 0.07486 . 1 . . . . 74 Leu Cd2 . 19172 1
866 . 1 1 74 74 LEU N N 15 109.17798 0.01106 . 1 . . . . 74 Leu N . 19172 1
867 . 1 1 75 75 LYS H H 1 7.53333 0.00240 . 1 . . . . 75 Lys H . 19172 1
868 . 1 1 75 75 LYS HA H 1 4.99211 0.00534 . 1 . . . . 75 Lys Ha . 19172 1
869 . 1 1 75 75 LYS HB2 H 1 1.57352 0.00566 . 1 . . . . 75 Lys Hb2 . 19172 1
870 . 1 1 75 75 LYS HB3 H 1 1.76371 0.00406 . 1 . . . . 75 Lys Hb3 . 19172 1
871 . 1 1 75 75 LYS HG2 H 1 1.35568 0.00150 . 1 . . . . 75 Lys Hg2 . 19172 1
872 . 1 1 75 75 LYS HG3 H 1 1.35568 0.00150 . 1 . . . . 75 Lys Hg3 . 19172 1
873 . 1 1 75 75 LYS HE2 H 1 2.89995 0.00191 . 1 . . . . 75 Lys He2 . 19172 1
874 . 1 1 75 75 LYS HE3 H 1 2.89995 0.00191 . 1 . . . . 75 Lys He3 . 19172 1
875 . 1 1 75 75 LYS C C 13 175.89064 0.08 .1 . . . . . 75 Lys C . 19172 1
876 . 1 1 75 75 LYS CA C 13 53.96496 0.04278 . 1 . . . . 75 Lys Ca . 19172 1
877 . 1 1 75 75 LYS CB C 13 36.15985 0.03508 . 1 . . . . 75 Lys Cb . 19172 1
878 . 1 1 75 75 LYS CG C 13 24.98674 7.17539e-04 . 1 . . . . 75 Lys Cg . 19172 1
879 . 1 1 75 75 LYS CD C 13 29.06447 0.08 .1 . . . . . 75 Lys Cd . 19172 1
880 . 1 1 75 75 LYS CE C 13 42.49090 0.00969 . 1 . . . . 75 Lys Ce . 19172 1
881 . 1 1 75 75 LYS N N 15 118.03269 0.01127 . 1 . . . . 75 Lys N . 19172 1
882 . 1 1 76 76 TYR H H 1 9.28215 0.00434 . 1 . . . . 76 Tyr H . 19172 1
883 . 1 1 76 76 TYR HA H 1 5.75781 0.00349 . 1 . . . . 76 Tyr Ha . 19172 1
884 . 1 1 76 76 TYR HB2 H 1 2.55236 0.00190 . 1 . . . . 76 Tyr Hb2 . 19172 1
885 . 1 1 76 76 TYR HB3 H 1 2.74550 0.00419 . 1 . . . . 76 Tyr Hb3 . 19172 1
886 . 1 1 76 76 TYR HD1 H 1 6.86780 0.00303 . 1 . . . . 76 Tyr Hd* . 19172 1
887 . 1 1 76 76 TYR HD2 H 1 6.86780 0.00303 . 1 . . . . 76 Tyr Hd* . 19172 1
888 . 1 1 76 76 TYR HE1 H 1 6.73991 0.00300 . 1 . . . . 76 Tyr He* . 19172 1
889 . 1 1 76 76 TYR HE2 H 1 6.73991 0.00300 . 1 . . . . 76 Tyr He* . 19172 1
890 . 1 1 76 76 TYR C C 13 175.87235 0.08 .1 . . . . . 76 Tyr C . 19172 1
891 . 1 1 76 76 TYR CA C 13 56.98441 0.06187 . 1 . . . . 76 Tyr Ca . 19172 1
892 . 1 1 76 76 TYR CB C 13 42.01932 0.14263 . 1 . . . . 76 Tyr Cb . 19172 1
893 . 1 1 76 76 TYR CD1 C 13 132.59181 0.04774 . 1 . . . . 76 Tyr Cd* . 19172 1
894 . 1 1 76 76 TYR CD2 C 13 132.59181 0.04774 . 1 . . . . 76 Tyr Cd* . 19172 1
895 . 1 1 76 76 TYR CE1 C 13 118.74643 0.01781 . 1 . . . . 76 Tyr Ce* . 19172 1
896 . 1 1 76 76 TYR CE2 C 13 118.74643 0.01781 . 1 . . . . 76 Tyr Ce* . 19172 1
897 . 1 1 76 76 TYR N N 15 120.02432 0.01054 . 1 . . . . 76 Tyr N . 19172 1
898 . 1 1 77 77 ASP H H 1 9.14240 0.00165 . 1 . . . . 77 Asp H . 19172 1
899 . 1 1 77 77 ASP HA H 1 5.23164 0.00726 . 1 . . . . 77 Asp Ha . 19172 1
900 . 1 1 77 77 ASP HB2 H 1 2.77710 0.00200 . 1 . . . . 77 Asp Hb2 . 19172 1
901 . 1 1 77 77 ASP HB3 H 1 2.83461 0.00508 . 1 . . . . 77 Asp Hb3 . 19172 1
902 . 1 1 77 77 ASP C C 13 174.06779 0.08 .1 . . . . . 77 Asp C . 19172 1
903 . 1 1 77 77 ASP CA C 13 54.19101 0.02631 . 1 . . . . 77 Asp Ca . 19172 1
904 . 1 1 77 77 ASP CB C 13 45.70103 0.04179 . 1 . . . . 77 Asp Cb . 19172 1
905 . 1 1 77 77 ASP N N 15 119.62694 0.01232 . 1 . . . . 77 Asp N . 19172 1
906 . 1 1 78 78 VAL H H 1 8.79270 0.00622 . 1 . . . . 78 Val H . 19172 1
907 . 1 1 78 78 VAL HA H 1 4.96164 0.00537 . 1 . . . . 78 Val Ha . 19172 1
908 . 1 1 78 78 VAL HB H 1 2.30972 0.00443 . 1 . . . . 78 Val Hb . 19172 1
909 . 1 1 78 78 VAL HG11 H 1 0.80026 0.00246 . 1 . . . . 78 Val Hg1* . 19172 1
910 . 1 1 78 78 VAL HG12 H 1 0.80026 0.00246 . 1 . . . . 78 Val Hg1* . 19172 1
911 . 1 1 78 78 VAL HG13 H 1 0.80026 0.00246 . 1 . . . . 78 Val Hg1* . 19172 1
912 . 1 1 78 78 VAL HG21 H 1 0.79646 0.00113 . 1 . . . . 78 Val Hg2* . 19172 1
913 . 1 1 78 78 VAL HG22 H 1 0.79646 0.00113 . 1 . . . . 78 Val Hg2* . 19172 1
914 . 1 1 78 78 VAL HG23 H 1 0.79646 0.00113 . 1 . . . . 78 Val Hg2* . 19172 1
915 . 1 1 78 78 VAL C C 13 177.25328 0.08 .1 . . . . . 78 Val C . 19172 1
916 . 1 1 78 78 VAL CA C 13 60.29290 0.03978 . 1 . . . . 78 Val Ca . 19172 1
917 . 1 1 78 78 VAL CB C 13 31.75735 0.04439 . 1 . . . . 78 Val Cb . 19172 1
918 . 1 1 78 78 VAL CG1 C 13 22.46652 0.16975 . 1 . . . . 78 Val Cg1 . 19172 1
919 . 1 1 78 78 VAL CG2 C 13 20.36062 0.11226 . 1 . . . . 78 Val Cg2 . 19172 1
920 . 1 1 78 78 VAL N N 15 114.21824 0.04118 . 1 . . . . 78 Val N . 19172 1
921 . 1 1 79 79 GLY H H 1 9.37505 0.00329 . 1 . . . . 79 Gly H . 19172 1
922 . 1 1 79 79 GLY HA2 H 1 3.66910 0.00777 . 1 . . . . 79 Gly Ha2 . 19172 1
923 . 1 1 79 79 GLY HA3 H 1 4.18693 0.00603 . 1 . . . . 79 Gly Ha3 . 19172 1
924 . 1 1 79 79 GLY C C 13 174.92665 0.08 .1 . . . . . 79 Gly C . 19172 1
925 . 1 1 79 79 GLY CA C 13 45.79684 0.09543 . 1 . . . . 79 Gly Ca . 19172 1
926 . 1 1 79 79 GLY N N 15 113.04694 0.02194 . 1 . . . . 79 Gly N . 19172 1
927 . 1 1 80 80 GLY H H 1 8.19299 0.00412 . 1 . . . . 80 Gly H . 19172 1
928 . 1 1 80 80 GLY HA2 H 1 3.97018 0.00195 . 1 . . . . 80 Gly Ha2 . 19172 1
929 . 1 1 80 80 GLY HA3 H 1 4.08747 0.00998 . 1 . . . . 80 Gly Ha3 . 19172 1
930 . 1 1 80 80 GLY C C 13 174.43621 0.08 . 1 . . . . 80 Gly C . 19172 1
931 . 1 1 80 80 GLY CA C 13 44.92831 0.01756 . 1 . . . . 80 Gly Ca . 19172 1
932 . 1 1 80 80 GLY N N 15 107.89383 0.01721 . 1 . . . . 80 Gly N . 19172 1
933 . 1 1 81 81 GLY H H 1 8.41586 0.00230 . 1 . . . . 81 Gly H . 19172 1
934 . 1 1 81 81 GLY HA2 H 1 3.87464 8.43390e-06 . 1 . . . . 81 Gly Ha2 . 19172 1
935 . 1 1 81 81 GLY HA3 H 1 4.02513 4.76665e-04 . 1 . . . . 81 Gly Ha3 . 19172 1
936 . 1 1 81 81 GLY C C 13 173.69188 0.08 . 1 . . . . 81 Gly C . 19172 1
937 . 1 1 81 81 GLY CA C 13 45.11029 0.01263 . 1 . . . . 81 Gly Ca . 19172 1
938 . 1 1 81 81 GLY N N 15 108.28879 0.00854 . 1 . . . . 81 Gly N . 19172 1
939 . 1 1 82 82 GLU H H 1 7.98703 0.00338 . 1 . . . . 82 Glu H . 19172 1
940 . 1 1 82 82 GLU HA H 1 3.97268 0.00388 . 1 . . . . 82 Glu Ha . 19172 1
941 . 1 1 82 82 GLU HB2 H 1 1.40641 0.00379 . 1 . . . . 82 Glu Hb2 . 19172 1
942 . 1 1 82 82 GLU HB3 H 1 1.64397 0.00473 . 1 . . . . 82 Glu Hb3 . 19172 1
943 . 1 1 82 82 GLU HG2 H 1 1.80980 4.40499e-04 . 1 . . . . 82 Glu Hg2 . 19172 1
944 . 1 1 82 82 GLU HG3 H 1 1.88290 0.00396 . 1 . . . . 82 Glu Hg3 . 19172 1
945 . 1 1 82 82 GLU C C 13 174.27604 0.08 . 1 . . . . 82 Glu C . 19172 1
946 . 1 1 82 82 GLU CA C 13 56.40908 0.07150 . 1 . . . . 82 Glu Ca . 19172 1
947 . 1 1 82 82 GLU CB C 13 30.28038 0.14218 . 1 . . . . 82 Glu Cb . 19172 1
948 . 1 1 82 82 GLU CG C 13 35.79078 0.03029 . 1 . . . . 82 Glu Cg . 19172 1
949 . 1 1 82 82 GLU N N 15 120.72630 0.01309 . 1 . . . . 82 Glu N . 19172 1
950 . 1 1 83 83 ARG H H 1 7.87631 0.00294 . 1 . . . . 83 Arg H . 19172 1
951 . 1 1 83 83 ARG HA H 1 4.90087 0.00981 . 1 . . . . 83 Arg Ha . 19172 1
952 . 1 1 83 83 ARG HB2 H 1 1.55620 0.00597 . 1 . . . . 83 Arg Hb2 . 19172 1
953 . 1 1 83 83 ARG HB3 H 1 1.55620 0.00597 . 1 . . . . 83 Arg Hb3 . 19172 1
954 . 1 1 83 83 ARG HG2 H 1 1.48557 0.00702 . 1 . . . . 83 Arg Hg2 . 19172 1
955 . 1 1 83 83 ARG HG3 H 1 1.48557 0.00702 . 1 . . . . 83 Arg Hg3 . 19172 1
956 . 1 1 83 83 ARG HD2 H 1 3.08019 0.00478 . 1 . . . . 83 Arg Hd2 . 19172 1
957 . 1 1 83 83 ARG HD3 H 1 3.08019 0.00478 . 1 . . . . 83 Arg Hd3 . 19172 1
958 . 1 1 83 83 ARG C C 13 176.02035 0.08 . 1 . . . . 83 Arg C . 19172 1
959 . 1 1 83 83 ARG CA C 13 54.33705 0.05157 . 1 . . . . 83 Arg Ca . 19172 1
960 . 1 1 83 83 ARG CB C 13 32.88517 0.02523 . 1 . . . . 83 Arg Cb . 19172 1
961 . 1 1 83 83 ARG CG C 13 26.95578 0.01547 . 1 . . . . 83 Arg Cg . 19172 1
962 . 1 1 83 83 ARG CD C 13 43.98119 0.11517 . 1 . . . . 83 Arg Cd . 19172 1
963 . 1 1 83 83 ARG N N 15 119.64774 0.02137 . 1 . . . . 83 Arg N . 19172 1
964 . 1 1 84 84 PHE H H 1 9.39728 0.00333 . 1 . . . . 84 Phe H . 19172 1
965 . 1 1 84 84 PHE HA H 1 4.86937 0.00266 . 1 . . . . 84 Phe Ha . 19172 1
966 . 1 1 84 84 PHE HB2 H 1 2.79342 0.00767 . 1 . . . . 84 Phe Hb2 . 19172 1
967 . 1 1 84 84 PHE HB3 H 1 3.39934 0.00399 . 1 . . . . 84 Phe Hb3 . 19172 1
968 . 1 1 84 84 PHE HD1 H 1 7.29322 0.00127 . 1 . . . . 84 Phe Hd* . 19172 1
969 . 1 1 84 84 PHE HD2 H 1 7.29322 0.00127 . 1 . . . . 84 Phe Hd* . 19172 1
970 . 1 1 84 84 PHE HE1 H 1 6.96927 0.00255 . 1 . . . . 84 Phe He* . 19172 1
971 . 1 1 84 84 PHE HE2 H 1 6.96927 0.00255 . 1 . . . . 84 Phe He* . 19172 1
972 . 1 1 84 84 PHE HZ H 1 5.91769 8.93267e-04 . 1 . . . . 84 Phe Hz . 19172 1
973 . 1 1 84 84 PHE C C 13 176.28513 0.08 . 1 . . . . 84 Phe C . 19172 1
974 . 1 1 84 84 PHE CA C 13 57.49382 0.04955 . 1 . . . . 84 Phe Ca . 19172 1
975 . 1 1 84 84 PHE CB C 13 43.96471 0.17505 . 1 . . . . 84 Phe Cb . 19172 1
976 . 1 1 84 84 PHE CD1 C 13 131.50718 0.04060 . 1 . . . . 84 Phe Cd* . 19172 1
977 . 1 1 84 84 PHE CD2 C 13 131.50718 0.04060 . 1 . . . . 84 Phe Cd* . 19172 1
978 . 1 1 84 84 PHE CE1 C 13 131.47954 0.04206 . 1 . . . . 84 Phe Ce* . 19172 1
979 . 1 1 84 84 PHE CE2 C 13 131.47954 0.04206 . 1 . . . . 84 Phe Ce* . 19172 1
980 . 1 1 84 84 PHE CZ C 13 129.04648 0.01697 . 1 . . . . 84 Phe Cz . 19172 1
981 . 1 1 84 84 PHE N N 15 119.80344 0.02154 . 1 . . . . 84 Phe N . 19172 1
982 . 1 1 85 85 ASP H H 1 10.00148 0.00301 . 1 . . . . 85 Asp H . 19172 1
983 . 1 1 85 85 ASP HA H 1 4.88355 0.00339 . 1 . . . . 85 Asp Ha . 19172 1
984 . 1 1 85 85 ASP HB2 H 1 2.74612 0.00182 . 1 . . . . 85 Asp Hb2 . 19172 1
985 . 1 1 85 85 ASP HB3 H 1 2.94680 0.00490 . 1 . . . . 85 Asp Hb3 . 19172 1
986 . 1 1 85 85 ASP C C 13 175.40028 0.08 . 1 . . . . 85 Asp C . 19172 1
987 . 1 1 85 85 ASP CA C 13 56.06751 0.05289 . 1 . . . . 85 Asp Ca . 19172 1
988 . 1 1 85 85 ASP CB C 13 41.88451 0.15498 . 1 . . . . 85 Asp Cb . 19172 1
989 . 1 1 85 85 ASP N N 15 120.63843 0.00830 . 1 . . . . 85 Asp N . 19172 1
990 . 1 1 86 86 SER H H 1 7.56387 0.00178 . 1 . . . . 86 Ser H . 19172 1
991 . 1 1 86 86 SER HA H 1 4.70567 0.00405 . 1 . . . . 86 Ser Ha . 19172 1
992 . 1 1 86 86 SER HB2 H 1 3.99138 0.00351 . 1 . . . . 86 Ser Hb2 . 19172 1
993 . 1 1 86 86 SER HB3 H 1 4.12866 0.00429 . 1 . . . . 86 Ser Hb3 . 19172 1
994 . 1 1 86 86 SER C C 13 173.89406 0.08 . 1 . . . . 86 Ser C . 19172 1
995 . 1 1 86 86 SER CA C 13 56.60545 0.15808 . 1 . . . . 86 Ser Ca . 19172 1
996 . 1 1 86 86 SER CB C 13 66.46180 0.08453 . 1 . . . . 86 Ser Cb . 19172 1
997 . 1 1 86 86 SER N N 15 108.70088 0.00971 . 1 . . . . 86 Ser N . 19172 1
998 . 1 1 87 87 LEU H H 1 8.62913 0.00218 . 1 . . . . 87 Leu H . 19172 1
999 . 1 1 87 87 LEU HA H 1 3.57646 0.00261 . 1 . . . . 87 Leu Ha . 19172 1
1000 . 1 1 87 87 LEU HB2 H 1 1.17220 0.00502 . 1 . . . . 87 Leu Hb2 . 19172 1
1001 . 1 1 87 87 LEU HB3 H 1 1.47888 0.00513 . 1 . . . . 87 Leu Hb3 . 19172 1
1002 . 1 1 87 87 LEU HG H 1 0.72369 0.00605 . 1 . . . . 87 Leu Hg . 19172 1
1003 . 1 1 87 87 LEU HD11 H 1 0.08483 0.00243 . 1 . . . . 87 Leu Hd1* . 19172 1
1004 . 1 1 87 87 LEU HD12 H 1 0.08483 0.00243 . 1 . . . . 87 Leu Hd1* . 19172 1
1005 . 1 1 87 87 LEU HD13 H 1 0.08483 0.00243 . 1 . . . . 87 Leu Hd1* . 19172 1
1006 . 1 1 87 87 LEU HD21 H 1 0.29422 0.00213 . 1 . . . . 87 Leu Hd2* . 19172 1
1007 . 1 1 87 87 LEU HD22 H 1 0.29422 0.00213 . 1 . . . . 87 Leu Hd2* . 19172 1
1008 . 1 1 87 87 LEU HD23 H 1 0.29422 0.00213 . 1 . . . . 87 Leu Hd2* . 19172 1
1009 . 1 1 87 87 LEU C C 13 178.27064 0.08 . 1 . . . . 87 Leu C . 19172 1
1010 . 1 1 87 87 LEU CA C 13 57.14253 0.03756 . 1 . . . . 87 Leu Ca . 19172 1
1011 . 1 1 87 87 LEU CB C 13 42.05745 0.03571 . 1 . . . . 87 Leu Cb . 19172 1
1012 . 1 1 87 87 LEU CG C 13 26.47870 0.07423 . 1 . . . . 87 Leu Cg . 19172 1
1013 . 1 1 87 87 LEU CD1 C 13 24.57966 0.01229 . 1 . . . . 87 Leu Cd1 . 19172 1
1014 . 1 1 87 87 LEU CD2 C 13 23.99580 0.03077 . 1 . . . . 87 Leu Cd2 . 19172 1
1015 . 1 1 87 87 LEU N N 15 121.84581 0.01678 . 1 . . . . 87 Leu N . 19172 1
1016 . 1 1 88 88 THR H H 1 7.89425 0.00168 . 1 . . . . 88 Thr H . 19172 1
1017 . 1 1 88 88 THR HA H 1 4.08433 0.00661 . 1 . . . . 88 Thr Ha . 19172 1
1018 . 1 1 88 88 THR HB H 1 4.00571 9.20672e-04 . 1 . . . . 88 Thr Hb . 19172 1
1019 . 1 1 88 88 THR HG21 H 1 1.37157 0.00122 . 1 . . . . 88 Thr Hg2* . 19172 1
1020 . 1 1 88 88 THR HG22 H 1 1.37157 0.00122 . 1 . . . . 88 Thr Hg2* . 19172 1
1021 . 1 1 88 88 THR HG23 H 1 1.37157 0.00122 . 1 . . . . 88 Thr Hg2* . 19172 1
1022 . 1 1 88 88 THR C C 13 175.25704 0.08 . 1 . . . . 88 Thr C . 19172 1
1023 . 1 1 88 88 THR CA C 13 67.16942 0.07123 . 1 . . . . 88 Thr Ca . 19172 1
1024 . 1 1 88 88 THR CB C 13 68.68387 0.06077 . 1 . . . . 88 Thr Cb . 19172 1
1025 . 1 1 88 88 THR CG2 C 13 22.35558 0.08679 . 1 . . . . 88 Thr Cg2 . 19172 1
1026 . 1 1 88 88 THR N N 15 114.66496 0.01669 . 1 . . . . 88 Thr N . 19172 1
1027 . 1 1 89 89 ASP H H 1 7.75334 0.00251 . 1 . . . . 89 Asp H . 19172 1
1028 . 1 1 89 89 ASP HA H 1 4.22720 0.00276 . 1 . . . . 89 Asp Ha . 19172 1
1029 . 1 1 89 89 ASP HB2 H 1 2.77570 0.00733 . 1 . . . . 89 Asp Hb2 . 19172 1
1030 . 1 1 89 89 ASP HB3 H 1 2.91059 0.01137 . 1 . . . . 89 Asp Hb3 . 19172 1
1031 . 1 1 89 89 ASP C C 13 177.92565 0.08 . 1 . . . . 89 Asp C . 19172 1
1032 . 1 1 89 89 ASP CA C 13 57.13264 0.05267 . 1 . . . . 89 Asp Ca . 19172 1
1033 . 1 1 89 89 ASP CB C 13 40.78138 0.11435 . 1 . . . . 89 Asp Cb . 19172 1
1034 . 1 1 89 89 ASP N N 15 121.04613 0.02248 . 1 . . . . 89 Asp N . 19172 1
1035 . 1 1 90 90 LEU H H 1 6.96538 0.00193 . 1 . . . . 90 Leu H . 19172 1
1036 . 1 1 90 90 LEU HA H 1 2.18165 0.00347 . 1 . . . . 90 Leu Ha . 19172 1
1037 . 1 1 90 90 LEU HB2 H 1 1.22299 0.00318 . 1 . . . . 90 Leu Hb2 . 19172 1
1038 . 1 1 90 90 LEU HB3 H 1 1.66286 0.00269 . 1 . . . . 90 Leu Hb3 . 19172 1
1039 . 1 1 90 90 LEU HG H 1 1.42504 0.00373 . 1 . . . . 90 Leu Hg . 19172 1
1040 . 1 1 90 90 LEU HD11 H 1 0.94523 0.00403 . 1 . . . . 90 Leu Hd1* . 19172 1
1041 . 1 1 90 90 LEU HD12 H 1 0.94523 0.00403 . 1 . . . . 90 Leu Hd1* . 19172 1
1042 . 1 1 90 90 LEU HD13 H 1 0.94523 0.00403 . 1 . . . . 90 Leu Hd1* . 19172 1
1043 . 1 1 90 90 LEU HD21 H 1 0.55509 0.00151 . 1 . . . . 90 Leu Hd2* . 19172 1
1044 . 1 1 90 90 LEU HD22 H 1 0.55509 0.00151 . 1 . . . . 90 Leu Hd2* . 19172 1
1045 . 1 1 90 90 LEU HD23 H 1 0.55509 0.00151 . 1 . . . . 90 Leu Hd2* . 19172 1
1046 . 1 1 90 90 LEU C C 13 177.25575 0.08 . 1 . . . . 90 Leu C . 19172 1
1047 . 1 1 90 90 LEU CA C 13 58.94450 0.00987 . 1 . . . . 90 Leu Ca . 19172 1
1048 . 1 1 90 90 LEU CB C 13 42.19205 0.02737 . 1 . . . . 90 Leu Cb . 19172 1
1049 . 1 1 90 90 LEU CG C 13 27.71211 0.09726 . 1 . . . . 90 Leu Cg . 19172 1
1050 . 1 1 90 90 LEU CD1 C 13 28.74807 0.10919 . 1 . . . . 90 Leu Cd1 . 19172 1
1051 . 1 1 90 90 LEU CD2 C 13 24.13601 0.02419 . 1 . . . . 90 Leu Cd2 . 19172 1
1052 . 1 1 90 90 LEU N N 15 122.52111 0.01950 . 1 . . . . 90 Leu N . 19172 1
1053 . 1 1 91 91 VAL H H 1 7.99600 0.00313 . 1 . . . . 91 Val H . 19172 1
1054 . 1 1 91 91 VAL HA H 1 2.78166 0.00346 . 1 . . . . 91 Val Ha . 19172 1
1055 . 1 1 91 91 VAL HB H 1 1.57242 0.00509 . 1 . . . . 91 Val Hb . 19172 1
1056 . 1 1 91 91 VAL HG11 H 1 -0.02307 0.00352 . 1 . . . . 91 Val Hg1* . 19172 1
1057 . 1 1 91 91 VAL HG12 H 1 -0.02307 0.00352 . 1 . . . . 91 Val Hg1* . 19172 1
1058 . 1 1 91 91 VAL HG13 H 1 -0.02307 0.00352 . 1 . . . . 91 Val Hg1* . 19172 1
1059 . 1 1 91 91 VAL HG21 H 1 -0.11991 0.00228 . 1 . . . . 91 Val Hg2* . 19172 1
1060 . 1 1 91 91 VAL HG22 H 1 -0.11991 0.00228 . 1 . . . . 91 Val Hg2* . 19172 1
1061 . 1 1 91 91 VAL HG23 H 1 -0.11991 0.00228 . 1 . . . . 91 Val Hg2* . 19172 1
1062 . 1 1 91 91 VAL C C 13 177.26976 0.08 . 1 . . . . 91 Val C . 19172 1
1063 . 1 1 91 91 VAL CA C 13 67.18033 0.04720 . 1 . . . . 91 Val Ca . 19172 1
1064 . 1 1 91 91 VAL CB C 13 31.58787 0.15869 . 1 . . . . 91 Val Cb . 19172 1
1065 . 1 1 91 91 VAL CG1 C 13 20.98525 0.02882 . 1 . . . . 91 Val Cg1 . 19172 1
1066 . 1 1 91 91 VAL CG2 C 13 22.26405 0.01141 . 1 . . . . 91 Val Cg2 . 19172 1
1067 . 1 1 91 91 VAL N N 15 120.03405 0.01474 . 1 . . . . 91 Val N . 19172 1
1068 . 1 1 92 92 GLU H H 1 8.25885 0.00457 . 1 . . . . 92 Glu H . 19172 1
1069 . 1 1 92 92 GLU HA H 1 3.74406 0.00154 . 1 . . . . 92 Glu Ha . 19172 1
1070 . 1 1 92 92 GLU HB2 H 1 1.97182 0.00302 . 1 . . . . 92 Glu Hb2 . 19172 1
1071 . 1 1 92 92 GLU HB3 H 1 1.98288 0.00413 . 1 . . . . 92 Glu Hb3 . 19172 1
1072 . 1 1 92 92 GLU HG2 H 1 2.36069 0.00613 . 1 . . . . 92 Glu Hg2 . 19172 1
1073 . 1 1 92 92 GLU HG3 H 1 2.45786 0.00842 . 1 . . . . 92 Glu Hg3 . 19172 1
1074 . 1 1 92 92 GLU C C 13 179.67109 0.08 . 1 . . . . 92 Glu C . 19172 1
1075 . 1 1 92 92 GLU CA C 13 58.97081 0.03129 . 1 . . . . 92 Glu Ca . 19172 1
1076 . 1 1 92 92 GLU CB C 13 29.05188 0.07456 . 1 . . . . 92 Glu Cb . 19172 1
1077 . 1 1 92 92 GLU CG C 13 36.34646 0.13860 . 1 . . . . 92 Glu Cg . 19172 1
1078 . 1 1 92 92 GLU N N 15 115.90574 0.03627 . 1 . . . . 92 Glu N . 19172 1
1079 . 1 1 93 93 HIS H H 1 7.70372 0.00182 . 1 . . . . 93 His H . 19172 1
1080 . 1 1 93 93 HIS HA H 1 3.98409 0.00176 . 1 . . . . 93 His Ha . 19172 1
1081 . 1 1 93 93 HIS HB2 H 1 2.63229 0.00584 . 1 . . . . 93 His Hb2 . 19172 1
1082 . 1 1 93 93 HIS HB3 H 1 2.80327 0.01135 . 1 . . . . 93 His Hb3 . 19172 1
1083 . 1 1 93 93 HIS C C 13 178.65484 0.08 . 1 . . . . 93 His C . 19172 1
1084 . 1 1 93 93 HIS CA C 13 60.81886 0.16508 . 1 . . . . 93 His Ca . 19172 1
1085 . 1 1 93 93 HIS CB C 13 30.71334 0.06126 . 1 . . . . 93 His Cb . 19172 1
1086 . 1 1 93 93 HIS N N 15 118.43640 0.04453 . 1 . . . . 93 His N . 19172 1
1087 . 1 1 94 94 TYR H H 1 7.70261 0.00196 . 1 . . . . 94 Tyr H . 19172 1
1088 . 1 1 94 94 TYR HA H 1 4.72527 0.00371 . 1 . . . . 94 Tyr Ha . 19172 1
1089 . 1 1 94 94 TYR HB2 H 1 2.22209 0.00330 . 1 . . . . 94 Tyr Hb2 . 19172 1
1090 . 1 1 94 94 TYR HB3 H 1 3.19278 0.00447 . 1 . . . . 94 Tyr Hb3 . 19172 1
1091 . 1 1 94 94 TYR HD1 H 1 7.21340 0.00254 . 1 . . . . 94 Tyr Hd* . 19172 1
1092 . 1 1 94 94 TYR HD2 H 1 7.21340 0.00254 . 1 . . . . 94 Tyr Hd* . 19172 1
1093 . 1 1 94 94 TYR HE1 H 1 6.86109 0.00227 . 1 . . . . 94 Tyr He* . 19172 1
1094 . 1 1 94 94 TYR HE2 H 1 6.86109 0.00227 . 1 . . . . 94 Tyr He* . 19172 1
1095 . 1 1 94 94 TYR C C 13 176.44509 0.08 . 1 . . . . 94 Tyr C . 19172 1
1096 . 1 1 94 94 TYR CA C 13 61.17583 0.05483 . 1 . . . . 94 Tyr Ca . 19172 1
1097 . 1 1 94 94 TYR CB C 13 37.15792 0.13430 . 1 . . . . 94 Tyr Cb . 19172 1
1098 . 1 1 94 94 TYR CD1 C 13 133.53865 0.01904 . 1 . . . . 94 Tyr Cd* . 19172 1
1099 . 1 1 94 94 TYR CD2 C 13 133.53865 0.01904 . 1 . . . . 94 Tyr Cd* . 19172 1
1100 . 1 1 94 94 TYR CE1 C 13 118.18489 0.07874 . 1 . . . . 94 Tyr Ce* . 19172 1
1101 . 1 1 94 94 TYR CE2 C 13 118.18489 0.07874 . 1 . . . . 94 Tyr Ce* . 19172 1
1102 . 1 1 94 94 TYR N N 15 117.27544 0.01632 . 1 . . . . 94 Tyr N . 19172 1
1103 . 1 1 95 95 LYS H H 1 7.79588 0.00243 . 1 . . . . 95 Lys H . 19172 1
1104 . 1 1 95 95 LYS HA H 1 4.20624 0.00745 . 1 . . . . 95 Lys Ha . 19172 1
1105 . 1 1 95 95 LYS HB2 H 1 1.69086 0.00367 . 1 . . . . 95 Lys Hb2 . 19172 1
1106 . 1 1 95 95 LYS HB3 H 1 1.79461 0.00875 . 1 . . . . 95 Lys Hb3 . 19172 1
1107 . 1 1 95 95 LYS HG2 H 1 1.11711 0.00358 . 1 . . . . 95 Lys Hg2 . 19172 1
1108 . 1 1 95 95 LYS HG3 H 1 1.11711 0.00358 . 1 . . . . 95 Lys Hg3 . 19172 1
1109 . 1 1 95 95 LYS HD2 H 1 1.47944 0.00301 . 1 . . . . 95 Lys Hd2 . 19172 1
1110 . 1 1 95 95 LYS HD3 H 1 1.47944 0.00301 . 1 . . . . 95 Lys Hd3 . 19172 1
1111 . 1 1 95 95 LYS HE2 H 1 2.97126 0.00163 . 1 . . . . 95 Lys He2 . 19172 1
1112 . 1 1 95 95 LYS HE3 H 1 2.97126 0.00163 . 1 . . . . 95 Lys He3 . 19172 1
1113 . 1 1 95 95 LYS C C 13 178.22692 0.08 . 1 . . . . 95 Lys C . 19172 1
1114 . 1 1 95 95 LYS CA C 13 58.91139 0.05720 . 1 . . . . 95 Lys Ca . 19172 1
1115 . 1 1 95 95 LYS CB C 13 33.12998 0.03501 . 1 . . . . 95 Lys Cb . 19172 1
1116 . 1 1 95 95 LYS CG C 13 25.45178 0.04983 . 1 . . . . 95 Lys Cg . 19172 1
1117 . 1 1 95 95 LYS CD C 13 30.16589 9.49447e-04 . 1 . . . . 95 Lys Cd . 19172 1
1118 . 1 1 95 95 LYS CE C 13 41.44709 0.00294 . 1 . . . . 95 Lys Ce . 19172 1
1119 . 1 1 95 95 LYS N N 15 119.46723 0.01862 . 1 . . . . 95 Lys N . 19172 1
1120 . 1 1 96 96 LYS H H 1 6.92289 0.00276 . 1 . . . . 96 Lys H . 19172 1
1121 . 1 1 96 96 LYS HA H 1 4.23322 0.00229 . 1 . . . . 96 Lys Ha . 19172 1
1122 . 1 1 96 96 LYS HB2 H 1 1.62579 0.01100 . 1 . . . . 96 Lys Hb2 . 19172 1
1123 . 1 1 96 96 LYS HB3 H 1 1.75526 0.00773 . 1 . . . . 96 Lys Hb3 . 19172 1
1124 . 1 1 96 96 LYS HG2 H 1 1.32818 0.00161 . 1 . . . . 96 Lys Hg2 . 19172 1
1125 . 1 1 96 96 LYS HG3 H 1 1.39413 0.00441 . 1 . . . . 96 Lys Hg3 . 19172 1
1126 . 1 1 96 96 LYS HE2 H 1 2.93974 0.00168 . 1 . . . . 96 Lys He2 . 19172 1
1127 . 1 1 96 96 LYS HE3 H 1 2.93974 0.00168 . 1 . . . . 96 Lys He3 . 19172 1
1128 . 1 1 96 96 LYS C C 13 175.43643 0.08 . 1 . . . . 96 Lys C . 19172 1
1129 . 1 1 96 96 LYS CA C 13 56.70656 0.01243 . 1 . . . . 96 Lys Ca . 19172 1
1130 . 1 1 96 96 LYS CB C 13 34.26234 0.05247 . 1 . . . . 96 Lys Cb . 19172 1
1131 . 1 1 96 96 LYS CG C 13 24.90472 0.00283 . 1 . . . . 96 Lys Cg . 19172 1
1132 . 1 1 96 96 LYS CD C 13 29.03202 0.08 . 1 . . . . 96 Lys Cd . 19172 1
1133 . 1 1 96 96 LYS CE C 13 42.06604 2.17653e-04 . 1 . . . . 96 Lys Ce . 19172 1
1134 . 1 1 96 96 LYS N N 15 116.13374 0.02569 . 1 . . . . 96 Lys N . 19172 1
1135 . 1 1 97 97 ASN H H 1 7.59344 0.00381 . 1 . . . . 97 Asn H . 19172 1
1136 . 1 1 97 97 ASN HA H 1 5.01107 0.00205 . 1 . . . . 97 Asn Ha . 19172 1
1137 . 1 1 97 97 ASN HB2 H 1 1.87536 0.00372 . 1 . . . . 97 Asn Hb2 . 19172 1
1138 . 1 1 97 97 ASN HB3 H 1 2.29024 0.00243 . 1 . . . . 97 Asn Hb3 . 19172 1
1139 . 1 1 97 97 ASN HD21 H 1 6.42870 0.01280 . 1 . . . . 97 Asn Hd21 . 19172 1
1140 . 1 1 97 97 ASN HD22 H 1 6.90845 0.00756 . 1 . . . . 97 Asn Hd22 . 19172 1
1141 . 1 1 97 97 ASN CA C 13 50.74171 0.13648 . 1 . . . . 97 Asn Ca . 19172 1
1142 . 1 1 97 97 ASN CB C 13 40.81291 0.14400 . 1 . . . . 97 Asn Cb . 19172 1
1143 . 1 1 97 97 ASN N N 15 118.15626 0.01501 . 1 . . . . 97 Asn N . 19172 1
1144 . 1 1 97 97 ASN ND2 N 15 116.04442 0.04575 . 1 . . . . 97 Asn Nd2 . 19172 1
1145 . 1 1 98 98 PRO HA H 1 4.57440 0.00443 . 1 . . . . 98 Pro Ha . 19172 1
1146 . 1 1 98 98 PRO HB2 H 1 1.74390 0.00474 . 1 . . . . 98 Pro Hb2 . 19172 1
1147 . 1 1 98 98 PRO HB3 H 1 2.13796 0.00406 . 1 . . . . 98 Pro Hb3 . 19172 1
1148 . 1 1 98 98 PRO HG2 H 1 1.96581 0.00138 . 1 . . . . 98 Pro Hg2 . 19172 1
1149 . 1 1 98 98 PRO HG3 H 1 1.96581 0.00138 . 1 . . . . 98 Pro Hg3 . 19172 1
1150 . 1 1 98 98 PRO HD2 H 1 3.56101 0.00393 . 1 . . . . 98 Pro Hd2 . 19172 1
1151 . 1 1 98 98 PRO HD3 H 1 3.67475 0.00203 . 1 . . . . 98 Pro Hd3 . 19172 1
1152 . 1 1 98 98 PRO C C 13 176.60980 0.08 . 1 . . . . 98 Pro C . 19172 1
1153 . 1 1 98 98 PRO CA C 13 62.94690 0.08879 . 1 . . . . 98 Pro Ca . 19172 1
1154 . 1 1 98 98 PRO CB C 13 32.58206 0.07874 . 1 . . . . 98 Pro Cb . 19172 1
1155 . 1 1 98 98 PRO CG C 13 27.28606 0.11127 . 1 . . . . 98 Pro Cg . 19172 1
1156 . 1 1 98 98 PRO CD C 13 50.37145 0.13830 . 1 . . . . 98 Pro Cd . 19172 1
1157 . 1 1 99 99 MET H H 1 8.65297 0.00184 . 1 . . . . 99 Met H . 19172 1
1158 . 1 1 99 99 MET HA H 1 4.48131 0.00892 . 1 . . . . 99 Met Ha . 19172 1
1159 . 1 1 99 99 MET HB2 H 1 1.78945 0.00360 . 1 . . . . 99 Met Hb2 . 19172 1
1160 . 1 1 99 99 MET HB3 H 1 1.88630 0.00853 . 1 . . . . 99 Met Hb3 . 19172 1
1161 . 1 1 99 99 MET HG2 H 1 2.08857 0.00208 . 1 . . . . 99 Met Hg2 . 19172 1
1162 . 1 1 99 99 MET HG3 H 1 2.08857 0.00208 . 1 . . . . 99 Met Hg3 . 19172 1
1163 . 1 1 99 99 MET HE1 H 1 1.88424 0.00166 . 1 . . . . 99 Met He* . 19172 1
1164 . 1 1 99 99 MET HE2 H 1 1.88424 0.00166 . 1 . . . . 99 Met He* . 19172 1
1165 . 1 1 99 99 MET HE3 H 1 1.88424 0.00166 . 1 . . . . 99 Met He* . 19172 1
1166 . 1 1 99 99 MET C C 13 174.71476 0.08 . 1 . . . . 99 Met C . 19172 1
1167 . 1 1 99 99 MET CA C 13 55.30586 0.06484 . 1 . . . . 99 Met Ca . 19172 1
1168 . 1 1 99 99 MET CB C 13 34.85298 0.09235 . 1 . . . . 99 Met Cb . 19172 1
1169 . 1 1 99 99 MET CG C 13 31.99157 0.10646 . 1 . . . . 99 Met Cg . 19172 1
1170 . 1 1 99 99 MET CE C 13 16.95245 0.07846 . 1 . . . . 99 Met Ce . 19172 1
1171 . 1 1 99 99 MET N N 15 121.29610 0.00735 . 1 . . . . 99 Met N . 19172 1
1172 . 1 1 100 100 VAL H H 1 8.23963 0.00244 . 1 . . . . 100 Val H . 19172 1
1173 . 1 1 100 100 VAL HA H 1 4.37960 0.00227 . 1 . . . . 100 Val Ha . 19172 1
1174 . 1 1 100 100 VAL HB H 1 1.96976 0.00546 . 1 . . . . 100 Val Hb . 19172 1
1175 . 1 1 100 100 VAL HG11 H 1 0.86971 6.15809e-04 . 1 . . . . 100 Val Hg1* . 19172 1
1176 . 1 1 100 100 VAL HG12 H 1 0.86971 6.15809e-04 . 1 . . . . 100 Val Hg1* . 19172 1
1177 . 1 1 100 100 VAL HG13 H 1 0.86971 6.15809e-04 . 1 . . . . 100 Val Hg1* . 19172 1
1178 . 1 1 100 100 VAL HG21 H 1 0.88831 0.00104 . 1 . . . . 100 Val Hg2* . 19172 1
1179 . 1 1 100 100 VAL HG22 H 1 0.88831 0.00104 . 1 . . . . 100 Val Hg2* . 19172 1
1180 . 1 1 100 100 VAL HG23 H 1 0.88831 0.00104 . 1 . . . . 100 Val Hg2* . 19172 1
1181 . 1 1 100 100 VAL C C 13 176.46701 0.08 . 1 . . . . 100 Val C . 19172 1
1182 . 1 1 100 100 VAL CA C 13 61.98722 0.04444 . 1 . . . . 100 Val Ca . 19172 1
1183 . 1 1 100 100 VAL CB C 13 32.65932 0.04215 . 1 . . . . 100 Val Cb . 19172 1
1184 . 1 1 100 100 VAL CG1 C 13 20.91559 0.03103 . 1 . . . . 100 Val Cg1 . 19172 1
1185 . 1 1 100 100 VAL CG2 C 13 20.80554 0.07917 . 1 . . . . 100 Val Cg2 . 19172 1
1186 . 1 1 100 100 VAL N N 15 123.15556 0.02112 . 1 . . . . 100 Val N . 19172 1
1187 . 1 1 101 101 GLU H H 1 8.68790 0.00262 . 1 . . . . 101 Glu H . 19172 1
1188 . 1 1 101 101 GLU HA H 1 4.41829 0.00182 . 1 . . . . 101 Glu Ha . 19172 1
1189 . 1 1 101 101 GLU HB2 H 1 2.03085 0.01099 . 1 . . . . 101 Glu Hb2 . 19172 1
1190 . 1 1 101 101 GLU HB3 H 1 2.11875 0.00559 . 1 . . . . 101 Glu Hb3 . 19172 1
1191 . 1 1 101 101 GLU HG2 H 1 2.29311 0.00175 . 1 . . . . 101 Glu Hg2 . 19172 1
1192 . 1 1 101 101 GLU HG3 H 1 2.29311 0.00175 . 1 . . . . 101 Glu Hg3 . 19172 1
1193 . 1 1 101 101 GLU C C 13 177.35034 0.08 . 1 . . . . 101 Glu C . 19172 1
1194 . 1 1 101 101 GLU CA C 13 56.61825 0.04521 . 1 . . . . 101 Glu Ca . 19172 1
1195 . 1 1 101 101 GLU CB C 13 30.60092 0.03332 . 1 . . . . 101 Glu Cb . 19172 1
1196 . 1 1 101 101 GLU CG C 13 36.67774 0.16490 . 1 . . . . 101 Glu Cg . 19172 1
1197 . 1 1 101 101 GLU N N 15 126.18176 0.00944 . 1 . . . . 101 Glu N . 19172 1
1198 . 1 1 102 102 THR H H 1 8.27789 0.00204 . 1 . . . . 102 Thr H . 19172 1
1199 . 1 1 102 102 THR HA H 1 4.06364 0.00232 . 1 . . . . 102 Thr Ha . 19172 1
1200 . 1 1 102 102 THR HB H 1 4.11297 0.00233 . 1 . . . . 102 Thr Hb . 19172 1
1201 . 1 1 102 102 THR HG21 H 1 1.22478 6.00599e-04 . 1 . . . . 102 Thr Hg2* . 19172 1
1202 . 1 1 102 102 THR HG22 H 1 1.22478 6.00599e-04 . 1 . . . . 102 Thr Hg2* . 19172 1
1203 . 1 1 102 102 THR HG23 H 1 1.22478 6.00599e-04 . 1 . . . . 102 Thr Hg2* . 19172 1
1204 . 1 1 102 102 THR C C 13 175.11678 0.08 . 1 . . . . 102 Thr C . 19172 1
1205 . 1 1 102 102 THR CA C 13 64.51615 0.11877 . 1 . . . . 102 Thr Ca . 19172 1
1206 . 1 1 102 102 THR CB C 13 69.43020 0.03008 . 1 . . . . 102 Thr Cb . 19172 1
1207 . 1 1 102 102 THR CG2 C 13 21.82345 0.00243 . 1 . . . . 102 Thr Cg2 . 19172 1
1208 . 1 1 102 102 THR N N 15 115.64628 0.02551 . 1 . . . . 102 Thr N . 19172 1
1209 . 1 1 103 103 LEU H H 1 8.28256 0.00231 . 1 . . . . 103 Leu H . 19172 1
1210 . 1 1 103 103 LEU HA H 1 4.27235 0.01084 . 1 . . . . 103 Leu Ha . 19172 1
1211 . 1 1 103 103 LEU HB2 H 1 1.64734 0.00655 . 1 . . . . 103 Leu Hb2 . 19172 1
1212 . 1 1 103 103 LEU HB3 H 1 1.85533 0.00418 . 1 . . . . 103 Leu Hb3 . 19172 1
1213 . 1 1 103 103 LEU HG H 1 1.62826 6.21207e-04 . 1 . . . . 103 Leu Hg . 19172 1
1214 . 1 1 103 103 LEU HD11 H 1 0.90002 0.00127 . 1 . . . . 103 Leu Hd1* . 19172 1
1215 . 1 1 103 103 LEU HD12 H 1 0.90002 0.00127 . 1 . . . . 103 Leu Hd1* . 19172 1
1216 . 1 1 103 103 LEU HD13 H 1 0.90002 0.00127 . 1 . . . . 103 Leu Hd1* . 19172 1
1217 . 1 1 103 103 LEU HD21 H 1 0.84841 0.00108 . 1 . . . . 103 Leu Hd2* . 19172 1
1218 . 1 1 103 103 LEU HD22 H 1 0.84841 0.00108 . 1 . . . . 103 Leu Hd2* . 19172 1
1219 . 1 1 103 103 LEU HD23 H 1 0.84841 0.00108 . 1 . . . . 103 Leu Hd2* . 19172 1
1220 . 1 1 103 103 LEU C C 13 178.05247 0.08 . 1 . . . . 103 Leu C . 19172 1
1221 . 1 1 103 103 LEU CA C 13 55.72566 0.06267 . 1 . . . . 103 Leu Ca . 19172 1
1222 . 1 1 103 103 LEU CB C 13 41.13078 0.04806 . 1 . . . . 103 Leu Cb . 19172 1
1223 . 1 1 103 103 LEU CG C 13 27.13582 0.00677 . 1 . . . . 103 Leu Cg . 19172 1
1224 . 1 1 103 103 LEU CD1 C 13 25.09954 0.03615 . 1 . . . . 103 Leu Cd1 . 19172 1
1225 . 1 1 103 103 LEU CD2 C 13 22.94346 0.01936 . 1 . . . . 103 Leu Cd2 . 19172 1
1226 . 1 1 103 103 LEU N N 15 120.30757 0.02476 . 1 . . . . 103 Leu N . 19172 1
1227 . 1 1 104 104 GLY H H 1 8.25968 0.00173 . 1 . . . . 104 Gly H . 19172 1
1228 . 1 1 104 104 GLY HA2 H 1 3.64171 0.00695 . 1 . . . . 104 Gly Ha2 . 19172 1
1229 . 1 1 104 104 GLY HA3 H 1 4.20412 0.00425 . 1 . . . . 104 Gly Ha3 . 19172 1
1230 . 1 1 104 104 GLY C C 13 174.31844 0.08 . 1 . . . . 104 Gly C . 19172 1
1231 . 1 1 104 104 GLY CA C 13 45.58405 0.10636 . 1 . . . . 104 Gly Ca . 19172 1
1232 . 1 1 104 104 GLY N N 15 107.80329 0.01416 . 1 . . . . 104 Gly N . 19172 1
1233 . 1 1 105 105 THR H H 1 7.77231 0.00294 . 1 . . . . 105 Thr H . 19172 1
1234 . 1 1 105 105 THR HA H 1 4.33012 0.00104 . 1 . . . . 105 Thr Ha . 19172 1
1235 . 1 1 105 105 THR HB H 1 4.11295 0.00415 . 1 . . . . 105 Thr Hb . 19172 1
1236 . 1 1 105 105 THR HG21 H 1 1.22648 0.00218 . 1 . . . . 105 Thr Hg2* . 19172 1
1237 . 1 1 105 105 THR HG22 H 1 1.22648 0.00218 . 1 . . . . 105 Thr Hg2* . 19172 1
1238 . 1 1 105 105 THR HG23 H 1 1.22648 0.00218 . 1 . . . . 105 Thr Hg2* . 19172 1
1239 . 1 1 105 105 THR C C 13 172.90304 0.08 . 1 . . . . 105 Thr C . 19172 1
1240 . 1 1 105 105 THR CA C 13 62.01435 0.12321 . 1 . . . . 105 Thr Ca . 19172 1
1241 . 1 1 105 105 THR CB C 13 69.86392 0.05825 . 1 . . . . 105 Thr Cb . 19172 1
1242 . 1 1 105 105 THR CG2 C 13 21.99921 0.06025 . 1 . . . . 105 Thr Cg2 . 19172 1
1243 . 1 1 105 105 THR N N 15 115.12619 0.01332 . 1 . . . . 105 Thr N . 19172 1
1244 . 1 1 106 106 VAL H H 1 8.34749 0.00185 . 1 . . . . 106 Val H . 19172 1
1245 . 1 1 106 106 VAL HA H 1 4.51654 0.00355 . 1 . . . . 106 Val Ha . 19172 1
1246 . 1 1 106 106 VAL HB H 1 1.94533 0.00618 . 1 . . . . 106 Val Hb . 19172 1
1247 . 1 1 106 106 VAL HG11 H 1 0.82895 0.00506 . 1 . . . . 106 Val Hg1* . 19172 1
1248 . 1 1 106 106 VAL HG12 H 1 0.82895 0.00506 . 1 . . . . 106 Val Hg1* . 19172 1
1249 . 1 1 106 106 VAL HG13 H 1 0.82895 0.00506 . 1 . . . . 106 Val Hg1* . 19172 1
1250 . 1 1 106 106 VAL HG21 H 1 0.92532 0.00199 . 1 . . . . 106 Val Hg2* . 19172 1
1251 . 1 1 106 106 VAL HG22 H 1 0.92532 0.00199 . 1 . . . . 106 Val Hg2* . 19172 1
1252 . 1 1 106 106 VAL HG23 H 1 0.92532 0.00199 . 1 . . . . 106 Val Hg2* . 19172 1
1253 . 1 1 106 106 VAL C C 13 175.66806 0.08 . 1 . . . . 106 Val C . 19172 1
1254 . 1 1 106 106 VAL CA C 13 61.73998 0.03623 . 1 . . . . 106 Val Ca . 19172 1
1255 . 1 1 106 106 VAL CB C 13 33.03758 0.13417 . 1 . . . . 106 Val Cb . 19172 1
1256 . 1 1 106 106 VAL CG1 C 13 21.44395 0.06032 . 1 . . . . 106 Val Cg1 . 19172 1
1257 . 1 1 106 106 VAL CG2 C 13 21.10434 0.18812 . 1 . . . . 106 Val Cg2 . 19172 1
1258 . 1 1 106 106 VAL N N 15 122.96700 0.01502 . 1 . . . . 106 Val N . 19172 1
1259 . 1 1 107 107 LEU H H 1 8.88079 0.00567 . 1 . . . . 107 Leu H . 19172 1
1260 . 1 1 107 107 LEU HA H 1 4.47583 0.00239 . 1 . . . . 107 Leu Ha . 19172 1
1261 . 1 1 107 107 LEU HB2 H 1 1.30555 0.00452 . 1 . . . . 107 Leu Hb2 . 19172 1
1262 . 1 1 107 107 LEU HB3 H 1 1.48634 0.00627 . 1 . . . . 107 Leu Hb3 . 19172 1
1263 . 1 1 107 107 LEU HG H 1 1.36936 0.00195 . 1 . . . . 107 Leu Hg . 19172 1
1264 . 1 1 107 107 LEU HD11 H 1 0.63138 0.00112 . 1 . . . . 107 Leu Hd1* . 19172 1
1265 . 1 1 107 107 LEU HD12 H 1 0.63138 0.00112 . 1 . . . . 107 Leu Hd1* . 19172 1
1266 . 1 1 107 107 LEU HD13 H 1 0.63138 0.00112 . 1 . . . . 107 Leu Hd1* . 19172 1
1267 . 1 1 107 107 LEU HD21 H 1 0.61146 9.88452e-04 . 1 . . . . 107 Leu Hd2* . 19172 1
1268 . 1 1 107 107 LEU HD22 H 1 0.61146 9.88452e-04 . 1 . . . . 107 Leu Hd2* . 19172 1
1269 . 1 1 107 107 LEU HD23 H 1 0.61146 9.88452e-04 . 1 . . . . 107 Leu Hd2* . 19172 1
1270 . 1 1 107 107 LEU C C 13 174.51177 0.08 . 1 . . . . 107 Leu C . 19172 1
1271 . 1 1 107 107 LEU CA C 13 53.73514 0.01864 . 1 . . . . 107 Leu Ca . 19172 1
1272 . 1 1 107 107 LEU CB C 13 43.38985 0.01644 . 1 . . . . 107 Leu Cb . 19172 1
1273 . 1 1 107 107 LEU CG C 13 26.95273 0.10934 . 1 . . . . 107 Leu Cg . 19172 1
1274 . 1 1 107 107 LEU CD1 C 13 25.11235 0.06258 . 1 . . . . 107 Leu Cd1 . 19172 1
1275 . 1 1 107 107 LEU CD2 C 13 24.63059 0.00780 . 1 . . . . 107 Leu Cd2 . 19172 1
1276 . 1 1 107 107 LEU N N 15 128.31016 0.01054 . 1 . . . . 107 Leu N . 19172 1
1277 . 1 1 108 108 GLN H H 1 7.92101 0.00352 . 1 . . . . 108 Gln H . 19172 1
1278 . 1 1 108 108 GLN HA H 1 4.47258 0.00268 . 1 . . . . 108 Gln Ha . 19172 1
1279 . 1 1 108 108 GLN HB2 H 1 1.79801 0.00485 . 1 . . . . 108 Gln Hb2 . 19172 1
1280 . 1 1 108 108 GLN HB3 H 1 1.79801 0.00485 . 1 . . . . 108 Gln Hb3 . 19172 1
1281 . 1 1 108 108 GLN HG2 H 1 2.12246 0.00473 . 1 . . . . 108 Gln Hg2 . 19172 1
1282 . 1 1 108 108 GLN HG3 H 1 2.15032 0.00775 . 1 . . . . 108 Gln Hg3 . 19172 1
1283 . 1 1 108 108 GLN HE21 H 1 6.64175 0.00338 . 1 . . . . 108 Gln He21 . 19172 1
1284 . 1 1 108 108 GLN HE22 H 1 7.38031 0.00224 . 1 . . . . 108 Gln He22 . 19172 1
1285 . 1 1 108 108 GLN C C 13 174.29784 0.08 . 1 . . . . 108 Gln C . 19172 1
1286 . 1 1 108 108 GLN CA C 13 54.80608 0.11763 . 1 . . . . 108 Gln Ca . 19172 1
1287 . 1 1 108 108 GLN CB C 13 30.95812 0.14311 . 1 . . . . 108 Gln Cb . 19172 1
1288 . 1 1 108 108 GLN CG C 13 34.01823 0.12283 . 1 . . . . 108 Gln Cg . 19172 1
1289 . 1 1 108 108 GLN N N 15 122.39802 0.01444 . 1 . . . . 108 Gln N . 19172 1
1290 . 1 1 108 108 GLN NE2 N 15 111.87691 0.04964 . 1 . . . . 108 Gln Ne2 . 19172 1
1291 . 1 1 109 109 LEU H H 1 8.45968 0.00250 . 1 . . . . 109 Leu H . 19172 1
1292 . 1 1 109 109 LEU HA H 1 4.08592 0.00341 . 1 . . . . 109 Leu Ha . 19172 1
1293 . 1 1 109 109 LEU HB2 H 1 0.53525 0.00447 . 1 . . . . 109 Leu Hb2 . 19172 1
1294 . 1 1 109 109 LEU HB3 H 1 1.24573 0.01097 . 1 . . . . 109 Leu Hb3 . 19172 1
1295 . 1 1 109 109 LEU HG H 1 1.20259 0.00508 . 1 . . . . 109 Leu Hg . 19172 1
1296 . 1 1 109 109 LEU HD11 H 1 0.02437 0.00204 . 1 . . . . 109 Leu Hd1* . 19172 1
1297 . 1 1 109 109 LEU HD12 H 1 0.02437 0.00204 . 1 . . . . 109 Leu Hd1* . 19172 1
1298 . 1 1 109 109 LEU HD13 H 1 0.02437 0.00204 . 1 . . . . 109 Leu Hd1* . 19172 1
1299 . 1 1 109 109 LEU HD21 H 1 0.08279 0.00192 . 1 . . . . 109 Leu Hd2* . 19172 1
1300 . 1 1 109 109 LEU HD22 H 1 0.08279 0.00192 . 1 . . . . 109 Leu Hd2* . 19172 1
1301 . 1 1 109 109 LEU HD23 H 1 0.08279 0.00192 . 1 . . . . 109 Leu Hd2* . 19172 1
1302 . 1 1 109 109 LEU C C 13 176.64073 0.08 . 1 . . . . 109 Leu C . 19172 1
1303 . 1 1 109 109 LEU CA C 13 54.71584 0.07580 . 1 . . . . 109 Leu Ca . 19172 1
1304 . 1 1 109 109 LEU CB C 13 40.33885 0.04183 . 1 . . . . 109 Leu Cb . 19172 1
1305 . 1 1 109 109 LEU CG C 13 26.96444 0.10666 . 1 . . . . 109 Leu Cg . 19172 1
1306 . 1 1 109 109 LEU CD1 C 13 24.57990 0.05117 . 1 . . . . 109 Leu Cd1 . 19172 1
1307 . 1 1 109 109 LEU CD2 C 13 23.26766 0.10725 . 1 . . . . 109 Leu Cd2 . 19172 1
1308 . 1 1 109 109 LEU N N 15 124.39368 0.01248 . 1 . . . . 109 Leu N . 19172 1
1309 . 1 1 110 110 LYS H H 1 9.10379 0.00404 . 1 . . . . 110 Lys H . 19172 1
1310 . 1 1 110 110 LYS HA H 1 4.51426 0.00220 . 1 . . . . 110 Lys Ha . 19172 1
1311 . 1 1 110 110 LYS HB2 H 1 1.65914 0.00233 . 1 . . . . 110 Lys Hb2 . 19172 1
1312 . 1 1 110 110 LYS HB3 H 1 1.89949 0.00270 . 1 . . . . 110 Lys Hb3 . 19172 1
1313 . 1 1 110 110 LYS HG2 H 1 1.32558 5.39335e-04 . 1 . . . . 110 Lys Hg2 . 19172 1
1314 . 1 1 110 110 LYS HG3 H 1 1.42051 3.53901e-05 . 1 . . . . 110 Lys Hg3 . 19172 1
1315 . 1 1 110 110 LYS HD2 H 1 1.71376 7.83049e-04 . 1 . . . . 110 Lys Hd2 . 19172 1
1316 . 1 1 110 110 LYS HD3 H 1 1.71376 7.83049e-04 . 1 . . . . 110 Lys Hd3 . 19172 1
1317 . 1 1 110 110 LYS HE2 H 1 2.95553 8.45068e-05 . 1 . . . . 110 Lys He2 . 19172 1
1318 . 1 1 110 110 LYS HE3 H 1 2.95553 8.45068e-05 . 1 . . . . 110 Lys He3 . 19172 1
1319 . 1 1 110 110 LYS C C 13 175.90168 0.08 . 1 . . . . 110 Lys C . 19172 1
1320 . 1 1 110 110 LYS CA C 13 57.15871 0.09131 . 1 . . . . 110 Lys Ca . 19172 1
1321 . 1 1 110 110 LYS CB C 13 33.26158 0.02294 . 1 . . . . 110 Lys Cb . 19172 1
1322 . 1 1 110 110 LYS CG C 13 25.14322 0.00478 . 1 . . . . 110 Lys Cg . 19172 1
1323 . 1 1 110 110 LYS CD C 13 28.59766 0.00737 . 1 . . . . 110 Lys Cd . 19172 1
1324 . 1 1 110 110 LYS CE C 13 41.93661 5.93655e-04 . 1 . . . . 110 Lys Ce . 19172 1
1325 . 1 1 110 110 LYS N N 15 122.16602 0.01461 . 1 . . . . 110 Lys N . 19172 1
1326 . 1 1 111 111 GLN H H 1 7.50839 0.00140 . 1 . . . . 111 Gln H . 19172 1
1327 . 1 1 111 111 GLN HA H 1 4.93073 0.00246 . 1 . . . . 111 Gln Ha . 19172 1
1328 . 1 1 111 111 GLN HB2 H 1 1.90952 0.00349 . 1 . . . . 111 Gln Hb2 . 19172 1
1329 . 1 1 111 111 GLN HB3 H 1 2.29162 0.00234 . 1 . . . . 111 Gln Hb3 . 19172 1
1330 . 1 1 111 111 GLN HG2 H 1 2.30948 0.00266 . 1 . . . . 111 Gln Hg2 . 19172 1
1331 . 1 1 111 111 GLN HG3 H 1 2.30948 0.00266 . 1 . . . . 111 Gln Hg3 . 19172 1
1332 . 1 1 111 111 GLN HE21 H 1 6.68342 0.00314 . 1 . . . . 111 Gln He21 . 19172 1
1333 . 1 1 111 111 GLN HE22 H 1 7.35715 0.00353 . 1 . . . . 111 Gln He22 . 19172 1
1334 . 1 1 111 111 GLN CA C 13 53.31826 0.04827 . 1 . . . . 111 Gln Ca . 19172 1
1335 . 1 1 111 111 GLN CB C 13 29.19396 0.18927 . 1 . . . . 111 Gln Cb . 19172 1
1336 . 1 1 111 111 GLN CG C 13 32.46444 0.06254 . 1 . . . . 111 Gln Cg . 19172 1
1337 . 1 1 111 111 GLN N N 15 115.69916 0.01784 . 1 . . . . 111 Gln N . 19172 1
1338 . 1 1 111 111 GLN NE2 N 15 112.42879 0.03498 . 1 . . . . 111 Gln Ne2 . 19172 1
1339 . 1 1 112 112 PRO HA H 1 3.16879 0.00264 . 1 . . . . 112 Pro Ha . 19172 1
1340 . 1 1 112 112 PRO HB2 H 1 1.72733 0.00509 . 1 . . . . 112 Pro Hb2 . 19172 1
1341 . 1 1 112 112 PRO HB3 H 1 1.82072 0.00360 . 1 . . . . 112 Pro Hb3 . 19172 1
1342 . 1 1 112 112 PRO HG2 H 1 1.77974 0.01394 . 1 . . . . 112 Pro Hg2 . 19172 1
1343 . 1 1 112 112 PRO HG3 H 1 1.77974 0.01394 . 1 . . . . 112 Pro Hg3 . 19172 1
1344 . 1 1 112 112 PRO HD2 H 1 3.63670 0.00215 . 1 . . . . 112 Pro Hd2 . 19172 1
1345 . 1 1 112 112 PRO HD3 H 1 3.83413 0.00174 . 1 . . . . 112 Pro Hd3 . 19172 1
1346 . 1 1 112 112 PRO C C 13 176.55306 0.08 . 1 . . . . 112 Pro C . 19172 1
1347 . 1 1 112 112 PRO CA C 13 61.57715 0.01968 . 1 . . . . 112 Pro Ca . 19172 1
1348 . 1 1 112 112 PRO CB C 13 33.10928 0.11173 . 1 . . . . 112 Pro Cb . 19172 1
1349 . 1 1 112 112 PRO CG C 13 27.10844 0.00152 . 1 . . . . 112 Pro Cg . 19172 1
1350 . 1 1 112 112 PRO CD C 13 50.66590 0.08812 . 1 . . . . 112 Pro Cd . 19172 1
1351 . 1 1 113 113 LEU H H 1 8.60716 0.00302 . 1 . . . . 113 Leu H . 19172 1
1352 . 1 1 113 113 LEU HA H 1 4.53762 0.01294 . 1 . . . . 113 Leu Ha . 19172 1
1353 . 1 1 113 113 LEU HB2 H 1 1.03460 0.00370 . 1 . . . . 113 Leu Hb2 . 19172 1
1354 . 1 1 113 113 LEU HB3 H 1 1.78167 0.00358 . 1 . . . . 113 Leu Hb3 . 19172 1
1355 . 1 1 113 113 LEU HG H 1 1.47287 0.00380 . 1 . . . . 113 Leu Hg . 19172 1
1356 . 1 1 113 113 LEU HD11 H 1 0.75264 0.00232 . 1 . . . . 113 Leu Hd1* . 19172 1
1357 . 1 1 113 113 LEU HD12 H 1 0.75264 0.00232 . 1 . . . . 113 Leu Hd1* . 19172 1
1358 . 1 1 113 113 LEU HD13 H 1 0.75264 0.00232 . 1 . . . . 113 Leu Hd1* . 19172 1
1359 . 1 1 113 113 LEU HD21 H 1 0.72052 0.00133 . 1 . . . . 113 Leu Hd2* . 19172 1
1360 . 1 1 113 113 LEU HD22 H 1 0.72052 0.00133 . 1 . . . . 113 Leu Hd2* . 19172 1
1361 . 1 1 113 113 LEU HD23 H 1 0.72052 0.00133 . 1 . . . . 113 Leu Hd2* . 19172 1
1362 . 1 1 113 113 LEU C C 13 175.48295 0.08 . 1 . . . . 113 Leu C . 19172 1
1363 . 1 1 113 113 LEU CA C 13 53.81318 0.03714 . 1 . . . . 113 Leu Ca . 19172 1
1364 . 1 1 113 113 LEU CB C 13 41.65258 0.04000 . 1 . . . . 113 Leu Cb . 19172 1
1365 . 1 1 113 113 LEU CG C 13 28.30673 0.09891 . 1 . . . . 113 Leu Cg . 19172 1
1366 . 1 1 113 113 LEU CD1 C 13 25.20337 0.02189 . 1 . . . . 113 Leu Cd1 . 19172 1
1367 . 1 1 113 113 LEU CD2 C 13 26.03835 0.02251 . 1 . . . . 113 Leu Cd2 . 19172 1
1368 . 1 1 113 113 LEU N N 15 125.74697 0.01451 . 1 . . . . 113 Leu N . 19172 1
1369 . 1 1 114 114 ASN H H 1 8.51718 0.00355 . 1 . . . . 114 Asn H . 19172 1
1370 . 1 1 114 114 ASN HA H 1 4.89232 6.40125e-04 . 1 . . . . 114 Asn Ha . 19172 1
1371 . 1 1 114 114 ASN HB2 H 1 2.56072 0.00863 . 1 . . . . 114 Asn Hb2 . 19172 1
1372 . 1 1 114 114 ASN HB3 H 1 2.64890 0.00317 . 1 . . . . 114 Asn Hb3 . 19172 1
1373 . 1 1 114 114 ASN HD21 H 1 6.53697 0.00521 . 1 . . . . 114 Asn Hd21 . 19172 1
1374 . 1 1 114 114 ASN HD22 H 1 7.37829 0.00580 . 1 . . . . 114 Asn Hd22 . 19172 1
1375 . 1 1 114 114 ASN C C 13 176.98931 0.08 . 1 . . . . 114 Asn C . 19172 1
1376 . 1 1 114 114 ASN CA C 13 52.86751 0.09006 . 1 . . . . 114 Asn Ca . 19172 1
1377 . 1 1 114 114 ASN CB C 13 39.56278 0.05198 . 1 . . . . 114 Asn Cb . 19172 1
1378 . 1 1 114 114 ASN N N 15 125.11403 0.01592 . 1 . . . . 114 Asn N . 19172 1
1379 . 1 1 114 114 ASN ND2 N 15 109.76053 0.03017 . 1 . . . . 114 Asn Nd2 . 19172 1
1380 . 1 1 115 115 THR H H 1 8.51377 0.00279 . 1 . . . . 115 Thr H . 19172 1
1381 . 1 1 115 115 THR HA H 1 3.92604 0.00160 . 1 . . . . 115 Thr Ha . 19172 1
1382 . 1 1 115 115 THR HB H 1 3.61790 0.00364 . 1 . . . . 115 Thr Hb . 19172 1
1383 . 1 1 115 115 THR HG21 H 1 0.66191 0.00295 . 1 . . . . 115 Thr Hg2* . 19172 1
1384 . 1 1 115 115 THR HG22 H 1 0.66191 0.00295 . 1 . . . . 115 Thr Hg2* . 19172 1
1385 . 1 1 115 115 THR HG23 H 1 0.66191 0.00295 . 1 . . . . 115 Thr Hg2* . 19172 1
1386 . 1 1 115 115 THR C C 13 174.39986 0.08 . 1 . . . . 115 Thr C . 19172 1
1387 . 1 1 115 115 THR CA C 13 61.30933 0.06532 . 1 . . . . 115 Thr Ca . 19172 1
1388 . 1 1 115 115 THR CB C 13 69.46922 0.07239 . 1 . . . . 115 Thr Cb . 19172 1
1389 . 1 1 115 115 THR CG2 C 13 20.62168 0.18604 . 1 . . . . 115 Thr Cg2 . 19172 1
1390 . 1 1 115 115 THR N N 15 113.98446 0.00654 . 1 . . . . 115 Thr N . 19172 1
1391 . 1 1 116 116 THR H H 1 8.22812 0.00175 . 1 . . . . 116 Thr H . 19172 1
1392 . 1 1 116 116 THR HA H 1 4.30631 0.00362 . 1 . . . . 116 Thr Ha . 19172 1
1393 . 1 1 116 116 THR HB H 1 4.24879 0.00431 . 1 . . . . 116 Thr Hb . 19172 1
1394 . 1 1 116 116 THR HG21 H 1 1.16520 0.00435 . 1 . . . . 116 Thr Hg2* . 19172 1
1395 . 1 1 116 116 THR HG22 H 1 1.16520 0.00435 . 1 . . . . 116 Thr Hg2* . 19172 1
1396 . 1 1 116 116 THR HG23 H 1 1.16520 0.00435 . 1 . . . . 116 Thr Hg2* . 19172 1
1397 . 1 1 116 116 THR C C 13 174.49000 0.08 . 1 . . . . 116 Thr C . 19172 1
1398 . 1 1 116 116 THR CA C 13 61.86435 0.15049 . 1 . . . . 116 Thr Ca . 19172 1
1399 . 1 1 116 116 THR CB C 13 69.65844 0.05883 . 1 . . . . 116 Thr Cb . 19172 1
1400 . 1 1 116 116 THR CG2 C 13 21.72974 0.10402 . 1 . . . . 116 Thr Cg2 . 19172 1
1401 . 1 1 116 116 THR N N 15 115.22116 0.01281 . 1 . . . . 116 Thr N . 19172 1
1402 . 1 1 117 117 ARG H H 1 8.18379 0.00754 . 1 . . . . 117 Arg H . 19172 1
1403 . 1 1 117 117 ARG HA H 1 4.31678 0.00354 . 1 . . . . 117 Arg Ha . 19172 1
1404 . 1 1 117 117 ARG HB2 H 1 1.65705 0.00748 . 1 . . . . 117 Arg Hb2 . 19172 1
1405 . 1 1 117 117 ARG HB3 H 1 1.78418 0.00635 . 1 . . . . 117 Arg Hb3 . 19172 1
1406 . 1 1 117 117 ARG HG2 H 1 1.56492 0.00264 . 1 . . . . 117 Arg Hg2 . 19172 1
1407 . 1 1 117 117 ARG HG3 H 1 1.56492 0.00264 . 1 . . . . 117 Arg Hg3 . 19172 1
1408 . 1 1 117 117 ARG HD2 H 1 3.14882 0.00116 . 1 . . . . 117 Arg Hd2 . 19172 1
1409 . 1 1 117 117 ARG HD3 H 1 3.14882 0.00116 . 1 . . . . 117 Arg Hd3 . 19172 1
1410 . 1 1 117 117 ARG C C 13 175.01281 0.08 . 1 . . . . 117 Arg C . 19172 1
1411 . 1 1 117 117 ARG CA C 13 56.28836 0.04583 . 1 . . . . 117 Arg Ca . 19172 1
1412 . 1 1 117 117 ARG CB C 13 30.82876 0.03274 . 1 . . . . 117 Arg Cb . 19172 1
1413 . 1 1 117 117 ARG CG C 13 26.93256 0.13792 . 1 . . . . 117 Arg Cg . 19172 1
1414 . 1 1 117 117 ARG CD C 13 43.34237 0.03101 . 1 . . . . 117 Arg Cd . 19172 1
1415 . 1 1 117 117 ARG N N 15 124.48070 0.02210 . 1 . . . . 117 Arg N . 19172 1
1416 . 1 1 118 118 ILE H H 1 7.74533 0.00240 . 1 . . . . 118 Ile H . 19172 1
1417 . 1 1 118 118 ILE HA H 1 4.02048 0.00321 . 1 . . . . 118 Ile Ha . 19172 1
1418 . 1 1 118 118 ILE HB H 1 1.77087 0.00277 . 1 . . . . 118 Ile Hb . 19172 1
1419 . 1 1 118 118 ILE HG12 H 1 1.08197 0.00263 . 1 . . . . 118 Ile Hg12 . 19172 1
1420 . 1 1 118 118 ILE HG13 H 1 1.36597 9.50975e-04 . 1 . . . . 118 Ile Hg13 . 19172 1
1421 . 1 1 118 118 ILE HG21 H 1 0.83556 0.00153 . 1 . . . . 118 Ile Hg2* . 19172 1
1422 . 1 1 118 118 ILE HG22 H 1 0.83556 0.00153 . 1 . . . . 118 Ile Hg2* . 19172 1
1423 . 1 1 118 118 ILE HG23 H 1 0.83556 0.00153 . 1 . . . . 118 Ile Hg2* . 19172 1
1424 . 1 1 118 118 ILE HD11 H 1 0.81311 0.00180 . 1 . . . . 118 Ile Hd1* . 19172 1
1425 . 1 1 118 118 ILE HD12 H 1 0.81311 0.00180 . 1 . . . . 118 Ile Hd1* . 19172 1
1426 . 1 1 118 118 ILE HD13 H 1 0.81311 0.00180 . 1 . . . . 118 Ile Hd1* . 19172 1
1427 . 1 1 118 118 ILE CA C 13 63.10530 0.10984 . 1 . . . . 118 Ile Ca . 19172 1
1428 . 1 1 118 118 ILE CB C 13 39.73557 0.13631 . 1 . . . . 118 Ile Cb . 19172 1
1429 . 1 1 118 118 ILE CG1 C 13 27.23284 0.02295 . 1 . . . . 118 Ile Cg1 . 19172 1
1430 . 1 1 118 118 ILE CG2 C 13 18.01214 0.08538 . 1 . . . . 118 Ile Cg2 . 19172 1
1431 . 1 1 118 118 ILE CD1 C 13 13.48162 0.09180 . 1 . . . . 118 Ile Cd1 . 19172 1
1432 . 1 1 118 118 ILE N N 15 126.89065 0.02116 . 1 . . . . 118 Ile N . 19172 1
stop_
save_