Content for NMR-STAR saveframe, assigned_chemical_shifts_1
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 52678
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name dpucMGP
_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 $chem_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' . . . 52678 1
5 '3D HNCO' . . . 52678 1
6 '3D HN(CA)CO' . . . 52678 1
7 '3D CBCANH' . . . 52678 1
8 '3D (H)CC(CO)NH' . . . 52678 1
9 '3D HCCH-TOCSY' . . . 52678 1
10 '3D (H)N(CA)NNH' . . . 52678 1
11 '3D (H)N(COCA)NNH' . . . 52678 1
12 '3D 1H-15N NOESY' . . . 52678 1
13 '3D 1H-15N TOCSY' . . . 52678 1
14 '3D 1H-13C NOESY aliphatic' . . . 52678 1
15 '3D 1H-13C NOESY aromatic' . . . 52678 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $software_2 . . 52678 1
3 $software_3 . . 52678 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 TYR C C 13 171.73 0 . 1 . . . . . 1 TYR C . 52678 1
2 . 1 . 1 1 1 TYR CA C 13 57.19244427 0 . 1 . . . . . 1 TYR CA . 52678 1
3 . 1 . 1 1 1 TYR CB C 13 38.59984619 0 . 1 . . . . . 1 TYR CB . 52678 1
4 . 1 . 1 2 2 GLU H H 1 8.504395348 0.01154384107 . 1 . . . . . 2 GLU H . 52678 1
5 . 1 . 1 2 2 GLU HA H 1 4.348348771 0.002760510174 . 1 . . . . . 2 GLU HA . 52678 1
6 . 1 . 1 2 2 GLU HB2 H 1 1.853924258 0.00255417612 . 2 . . . . . 2 GLU HB2 . 52678 1
7 . 1 . 1 2 2 GLU HB3 H 1 1.953579919 0.008860627012 . 2 . . . . . 2 GLU HB3 . 52678 1
8 . 1 . 1 2 2 GLU HG2 H 1 2.32396403 0.000097 . 2 . . . . . 2 GLU HG2 . 52678 1
9 . 1 . 1 2 2 GLU HG3 H 1 2.32449439 0.0003667905291 . 2 . . . . . 2 GLU HG3 . 52678 1
10 . 1 . 1 2 2 GLU C C 13 174.793 0 . 1 . . . . . 2 GLU C . 52678 1
11 . 1 . 1 2 2 GLU CA C 13 55.09759897 0.0000038738 . 1 . . . . . 2 GLU CA . 52678 1
12 . 1 . 1 2 2 GLU CB C 13 29.43209901 0.000005692 . 1 . . . . . 2 GLU CB . 52678 1
13 . 1 . 1 2 2 GLU CG C 13 32.57469876 0.0000061436 . 1 . . . . . 2 GLU CG . 52678 1
14 . 1 . 1 2 2 GLU N N 15 124.0409 0 . 1 . . . . . 2 GLU N . 52678 1
15 . 1 . 1 3 3 SER H H 1 8.574707928 0.001968459445 . 1 . . . . . 3 SER H . 52678 1
16 . 1 . 1 3 3 SER HA H 1 4.316471614 0.0004140465083 . 1 . . . . . 3 SER HA . 52678 1
17 . 1 . 1 3 3 SER HB2 H 1 3.819503612 0.00411718026 . 2 . . . . . 3 SER HB2 . 52678 1
18 . 1 . 1 3 3 SER HB3 H 1 3.891869027 0.0002349642956 . 2 . . . . . 3 SER HB3 . 52678 1
19 . 1 . 1 3 3 SER C C 13 174.412 0 . 1 . . . . . 3 SER C . 52678 1
20 . 1 . 1 3 3 SER CA C 13 58.23840191 0.00000812 . 1 . . . . . 3 SER CA . 52678 1
21 . 1 . 1 3 3 SER CB C 13 63.86769179 0.00000213 . 1 . . . . . 3 SER CB . 52678 1
22 . 1 . 1 3 3 SER N N 15 118.507 0.000001907 . 1 . . . . . 3 SER N . 52678 1
23 . 1 . 1 4 4 HIS H H 1 8.772698648 0.0004785395572 . 1 . . . . . 4 HIS H . 52678 1
24 . 1 . 1 4 4 HIS HA H 1 4.65596124 0.005025113603 . 1 . . . . . 4 HIS HA . 52678 1
25 . 1 . 1 4 4 HIS HB2 H 1 3.15030855 0.00416481538 . 2 . . . . . 4 HIS HB2 . 52678 1
26 . 1 . 1 4 4 HIS HB3 H 1 3.249012659 0.001202072403 . 2 . . . . . 4 HIS HB3 . 52678 1
27 . 1 . 1 4 4 HIS C C 13 174.519 0 . 1 . . . . . 4 HIS C . 52678 1
28 . 1 . 1 4 4 HIS CA C 13 55.62039677 0.0000116 . 1 . . . . . 4 HIS CA . 52678 1
29 . 1 . 1 4 4 HIS CB C 13 28.64570011 0.000000337 . 1 . . . . . 4 HIS CB . 52678 1
30 . 1 . 1 4 4 HIS N N 15 120.476 0.00000522 . 1 . . . . . 4 HIS N . 52678 1
31 . 1 . 1 5 5 GLU H H 1 8.484961112 0.001017777715 . 1 . . . . . 5 GLU H . 52678 1
32 . 1 . 1 5 5 GLU HA H 1 4.298911044 0.00582961429 . 1 . . . . . 5 GLU HA . 52678 1
33 . 1 . 1 5 5 GLU HB2 H 1 1.967796255 0.0006400763577 . 2 . . . . . 5 GLU HB2 . 52678 1
34 . 1 . 1 5 5 GLU HB3 H 1 2.027979554 0.003498680365 . 2 . . . . . 5 GLU HB3 . 52678 1
35 . 1 . 1 5 5 GLU HG2 H 1 2.405343348 0.001149615219 . 1 . . . . . 5 GLU HG2 . 52678 1
36 . 1 . 1 5 5 GLU HG3 H 1 2.405653177 0.001153433932 . 1 . . . . . 5 GLU HG3 . 52678 1
37 . 1 . 1 5 5 GLU C C 13 176.269 0 . 1 . . . . . 5 GLU C . 52678 1
38 . 1 . 1 5 5 GLU CA C 13 56.14400137 0.0000074 . 1 . . . . . 5 GLU CA . 52678 1
39 . 1 . 1 5 5 GLU CB C 13 28.64809968 0.000002997 . 1 . . . . . 5 GLU CB . 52678 1
40 . 1 . 1 5 5 GLU CG C 13 33.1 0.0000004768 . 1 . . . . . 5 GLU CG . 52678 1
41 . 1 . 1 5 5 GLU N N 15 121.351 0.000002336 . 1 . . . . . 5 GLU N . 52678 1
42 . 1 . 1 6 6 SER H H 1 8.512267506 0.0003346900533 . 1 . . . . . 6 SER H . 52678 1
43 . 1 . 1 6 6 SER HA H 1 4.386314217 0.004819072256 . 1 . . . . . 6 SER HA . 52678 1
44 . 1 . 1 6 6 SER HB2 H 1 3.857470539 0.0001182726933 . 2 . . . . . 6 SER HB2 . 52678 1
45 . 1 . 1 6 6 SER HB3 H 1 3.89861136 0.0001066267955 . 2 . . . . . 6 SER HB3 . 52678 1
46 . 1 . 1 6 6 SER C C 13 174.793 0 . 1 . . . . . 6 SER C . 52678 1
47 . 1 . 1 6 6 SER CA C 13 58.50190201 0.00000879 . 1 . . . . . 6 SER CA . 52678 1
48 . 1 . 1 6 6 SER CB C 13 63.60609176 0.00000178 . 1 . . . . . 6 SER CB . 52678 1
49 . 1 . 1 6 6 SER N N 15 117.632 0.0000033 . 1 . . . . . 6 SER N . 52678 1
50 . 1 . 1 7 7 MET H H 1 8.484947963 0.001578872983 . 1 . . . . . 7 MET H . 52678 1
51 . 1 . 1 7 7 MET HA H 1 4.426033813 0.0003826831726 . 1 . . . . . 7 MET HA . 52678 1
52 . 1 . 1 7 7 MET HB2 H 1 1.972460595 0.005181683973 . 2 . . . . . 7 MET HB2 . 52678 1
53 . 1 . 1 7 7 MET HB3 H 1 2.072455239 0.002295461924 . 2 . . . . . 7 MET HB3 . 52678 1
54 . 1 . 1 7 7 MET HG2 H 1 2.487735019 0.001050296593 . 2 . . . . . 7 MET HG2 . 52678 1
55 . 1 . 1 7 7 MET HG3 H 1 2.569662579 0.001304075399 . 2 . . . . . 7 MET HG3 . 52678 1
56 . 1 . 1 7 7 MET C C 13 176.652 0 . 1 . . . . . 7 MET C . 52678 1
57 . 1 . 1 7 7 MET CA C 13 55.88239942 0.0000030 . 1 . . . . . 7 MET CA . 52678 1
58 . 1 . 1 7 7 MET CB C 13 32.31399979 0.00000126 . 1 . . . . . 7 MET CB . 52678 1
59 . 1 . 1 7 7 MET CG C 13 31.78810106 0.0000069755 . 1 . . . . . 7 MET CG . 52678 1
60 . 1 . 1 7 7 MET N N 15 122.335 0.000003568 . 1 . . . . . 7 MET N . 52678 1
61 . 1 . 1 8 8 GLU H H 1 8.314706325 0.004868888983 . 1 . . . . . 8 GLU H . 52678 1
62 . 1 . 1 8 8 GLU HA H 1 4.261812156 0.0004882600583 . 1 . . . . . 8 GLU HA . 52678 1
63 . 1 . 1 8 8 GLU HB2 H 1 1.891918419 0.003502788105 . 2 . . . . . 8 GLU HB2 . 52678 1
64 . 1 . 1 8 8 GLU HB3 H 1 1.989580455 0.004728710134 . 2 . . . . . 8 GLU HB3 . 52678 1
65 . 1 . 1 8 8 GLU HG2 H 1 2.383377765 0.004085808718 . 1 . . . . . 8 GLU HG2 . 52678 1
66 . 1 . 1 8 8 GLU HG3 H 1 2.383603176 0.004071637897 . 1 . . . . . 8 GLU HG3 . 52678 1
67 . 1 . 1 8 8 GLU C C 13 176.433 0 . 1 . . . . . 8 GLU C . 52678 1
68 . 1 . 1 8 8 GLU CA C 13 56.24063775 0.00000726 . 1 . . . . . 8 GLU CA . 52678 1
69 . 1 . 1 8 8 GLU CB C 13 28.38709941 0.0000046598 . 1 . . . . . 8 GLU CB . 52678 1
70 . 1 . 1 8 8 GLU CG C 13 32.8371 0.0000004768 . 1 . . . . . 8 GLU CG . 52678 1
71 . 1 . 1 8 8 GLU N N 15 120.7416 0.000004046 . 1 . . . . . 8 GLU N . 52678 1
72 . 1 . 1 9 9 SER H H 1 8.274619447 0.00261143011 . 1 . . . . . 9 SER H . 52678 1
73 . 1 . 1 9 9 SER HA H 1 4.303289866 0.002165387504 . 1 . . . . . 9 SER HA . 52678 1
74 . 1 . 1 9 9 SER HB2 H 1 3.791708012 0.003976874132 . 1 . . . . . 9 SER HB2 . 52678 1
75 . 1 . 1 9 9 SER HB3 H 1 3.791880766 0.003921673104 . 1 . . . . . 9 SER HB3 . 52678 1
76 . 1 . 1 9 9 SER C C 13 174.574 0 . 1 . . . . . 9 SER C . 52678 1
77 . 1 . 1 9 9 SER CA C 13 58.76400003 0.00000095 . 1 . . . . . 9 SER CA . 52678 1
78 . 1 . 1 9 9 SER CB C 13 63.2167 0.000002336 . 1 . . . . . 9 SER CB . 52678 1
79 . 1 . 1 9 9 SER N N 15 116.539 0.0000048628 . 1 . . . . . 9 SER N . 52678 1
80 . 1 . 1 10 10 TYR H H 1 8.074497707 0.0005972888753 . 1 . . . . . 10 TYR H . 52678 1
81 . 1 . 1 10 10 TYR HA H 1 4.480730101 0.0003549182184 . 1 . . . . . 10 TYR HA . 52678 1
82 . 1 . 1 10 10 TYR HB2 H 1 2.972804279 0.01455510782 . 2 . . . . . 10 TYR HB2 . 52678 1
83 . 1 . 1 10 10 TYR HB3 H 1 2.996170116 0.01308884966 . 2 . . . . . 10 TYR HB3 . 52678 1
84 . 1 . 1 10 10 TYR HD1 H 1 7.061240729 0.0001312460171 . 1 . . . . . 10 TYR HD# . 52678 1
85 . 1 . 1 10 10 TYR HD2 H 1 7.061240729 0.0001312460171 . 1 . . . . . 10 TYR HD# . 52678 1
86 . 1 . 1 10 10 TYR HE1 H 1 6.794378476 0.000011677 . 1 . . . . . 10 TYR HE# . 52678 1
87 . 1 . 1 10 10 TYR HE2 H 1 6.794378476 0.000011677 . 1 . . . . . 10 TYR HE# . 52678 1
88 . 1 . 1 10 10 TYR C C 13 175.832 0 . 1 . . . . . 10 TYR C . 52678 1
89 . 1 . 1 10 10 TYR CA C 13 58.2390011 0.000004046 . 1 . . . . . 10 TYR CA . 52678 1
90 . 1 . 1 10 10 TYR CB C 13 38.33809934 0.0000040179 . 1 . . . . . 10 TYR CB . 52678 1
91 . 1 . 1 10 10 TYR CD1 C 13 133.3700061 0 . 1 . . . . . 10 TYR CD# . 52678 1
92 . 1 . 1 10 10 TYR CD2 C 13 133.3700061 0 . 1 . . . . . 10 TYR CD# . 52678 1
93 . 1 . 1 10 10 TYR CE1 C 13 118.4990488 0 . 1 . . . . . 10 TYR CE# . 52678 1
94 . 1 . 1 10 10 TYR CE2 C 13 118.4990488 0 . 1 . . . . . 10 TYR CE# . 52678 1
95 . 1 . 1 10 10 TYR N N 15 121.789 0.000004046 . 1 . . . . . 10 TYR N . 52678 1
96 . 1 . 1 11 11 GLU H H 1 8.057344737 0.004143109043 . 1 . . . . . 11 GLU H . 52678 1
97 . 1 . 1 11 11 GLU HA H 1 4.20291714 0.003913104134 . 1 . . . . . 11 GLU HA . 52678 1
98 . 1 . 1 11 11 GLU HB2 H 1 1.885443213 0.000749415033 . 2 . . . . . 11 GLU HB2 . 52678 1
99 . 1 . 1 11 11 GLU HB3 H 1 1.990452559 0.002350316492 . 2 . . . . . 11 GLU HB3 . 52678 1
100 . 1 . 1 11 11 GLU HG2 H 1 2.323727475 0.00208251993 . 1 . . . . . 11 GLU HG2 . 52678 1
101 . 1 . 1 11 11 GLU HG3 H 1 2.323877825 0.002016428312 . 1 . . . . . 11 GLU HG3 . 52678 1
102 . 1 . 1 11 11 GLU C C 13 175.668 0 . 1 . . . . . 11 GLU C . 52678 1
103 . 1 . 1 11 11 GLU CA C 13 55.62099841 0.0000073253 . 1 . . . . . 11 GLU CA . 52678 1
104 . 1 . 1 11 11 GLU CB C 13 28.64800064 0.000004684 . 1 . . . . . 11 GLU CB . 52678 1
105 . 1 . 1 11 11 GLU CG C 13 32.57987584 0.000755225915 . 1 . . . . . 11 GLU CG . 52678 1
106 . 1 . 1 11 11 GLU N N 15 120.801 0.0000013 . 1 . . . . . 11 GLU N . 52678 1
107 . 1 . 1 12 12 LEU H H 1 8.082343984 0.003968184769 . 1 . . . . . 12 LEU H . 52678 1
108 . 1 . 1 12 12 LEU HA H 1 4.229967233 0.003835681984 . 1 . . . . . 12 LEU HA . 52678 1
109 . 1 . 1 12 12 LEU HB2 H 1 1.502813907 0.0009137505552 . 2 . . . . . 12 LEU HB2 . 52678 1
110 . 1 . 1 12 12 LEU HB3 H 1 1.589540313 0.006994029963 . 2 . . . . . 12 LEU HB3 . 52678 1
111 . 1 . 1 12 12 LEU HG H 1 1.559632799 0.007794008645 . 1 . . . . . 12 LEU HG . 52678 1
112 . 1 . 1 12 12 LEU HD11 H 1 0.8237851297 0.003387237591 . 2 . . . . . 12 LEU HD1# . 52678 1
113 . 1 . 1 12 12 LEU HD12 H 1 0.8237851297 0.003387237591 . 2 . . . . . 12 LEU HD1# . 52678 1
114 . 1 . 1 12 12 LEU HD13 H 1 0.8237851297 0.003387237591 . 2 . . . . . 12 LEU HD1# . 52678 1
115 . 1 . 1 12 12 LEU HD21 H 1 0.8786523654 0.003644971898 . 2 . . . . . 12 LEU HD2# . 52678 1
116 . 1 . 1 12 12 LEU HD22 H 1 0.8786523654 0.003644971898 . 2 . . . . . 12 LEU HD2# . 52678 1
117 . 1 . 1 12 12 LEU HD23 H 1 0.8786523654 0.003644971898 . 2 . . . . . 12 LEU HD2# . 52678 1
118 . 1 . 1 12 12 LEU C C 13 176.707 0 . 1 . . . . . 12 LEU C . 52678 1
119 . 1 . 1 12 12 LEU CA C 13 55.23170821 0.00000165 . 1 . . . . . 12 LEU CA . 52678 1
120 . 1 . 1 12 12 LEU CB C 13 42.26550054 0.00000429 . 1 . . . . . 12 LEU CB . 52678 1
121 . 1 . 1 12 12 LEU CG C 13 26.86719172 0.000001545 . 1 . . . . . 12 LEU CG . 52678 1
122 . 1 . 1 12 12 LEU CD1 C 13 23.41417208 0.00000468 . 2 . . . . . 12 LEU CD1 . 52678 1
123 . 1 . 1 12 12 LEU CD2 C 13 24.6094 0.00000101 . 2 . . . . . 12 LEU CD2 . 52678 1
124 . 1 . 1 12 12 LEU N N 15 122.335 0.000001907 . 1 . . . . . 12 LEU N . 52678 1
125 . 1 . 1 13 13 ASN H H 1 8.307383416 0.0005872690269 . 1 . . . . . 13 ASN H . 52678 1
126 . 1 . 1 13 13 ASN HA H 1 4.864510848 0.01082382953 . 1 . . . . . 13 ASN HA . 52678 1
127 . 1 . 1 13 13 ASN HB2 H 1 2.701179636 0.001311961068 . 2 . . . . . 13 ASN HB2 . 52678 1
128 . 1 . 1 13 13 ASN HB3 H 1 2.810660239 0.001210683117 . 2 . . . . . 13 ASN HB3 . 52678 1
129 . 1 . 1 13 13 ASN HD21 H 1 7.679668854 0.0000264 . 1 . . . . . 13 ASN HD21 . 52678 1
130 . 1 . 1 13 13 ASN C C 13 173.481 0 . 1 . . . . . 13 ASN C . 52678 1
131 . 1 . 1 13 13 ASN CA C 13 51.06150656 0.000016 . 1 . . . . . 13 ASN CA . 52678 1
132 . 1 . 1 13 13 ASN CB C 13 38.72799227 0.0000024777 . 1 . . . . . 13 ASN CB . 52678 1
133 . 1 . 1 13 13 ASN N N 15 120.038 0.0000013 . 1 . . . . . 13 ASN N . 52678 1
134 . 1 . 1 14 14 PRO HA H 1 4.29307654 0.002878097976 . 1 . . . . . 14 PRO HA . 52678 1
135 . 1 . 1 14 14 PRO HB2 H 1 1.583382143 0.003602238815 . 2 . . . . . 14 PRO HB2 . 52678 1
136 . 1 . 1 14 14 PRO HB3 H 1 2.076925528 0.0009582348095 . 2 . . . . . 14 PRO HB3 . 52678 1
137 . 1 . 1 14 14 PRO HG2 H 1 1.57214484 0.003589502134 . 2 . . . . . 14 PRO HG2 . 52678 1
138 . 1 . 1 14 14 PRO HG3 H 1 1.826520349 0.002573877443 . 2 . . . . . 14 PRO HG3 . 52678 1
139 . 1 . 1 14 14 PRO HD2 H 1 3.617975689 0.00003223 . 2 . . . . . 14 PRO HD2 . 52678 1
140 . 1 . 1 14 14 PRO HD3 H 1 3.672779356 0.0000545676 . 2 . . . . . 14 PRO HD3 . 52678 1
141 . 1 . 1 14 14 PRO C C 13 176.817 0 . 1 . . . . . 14 PRO C . 52678 1
142 . 1 . 1 14 14 PRO CA C 13 63.47600085 0.00000316 . 1 . . . . . 14 PRO CA . 52678 1
143 . 1 . 1 14 14 PRO CB C 13 31.78940019 0.000001545 . 1 . . . . . 14 PRO CB . 52678 1
144 . 1 . 1 14 14 PRO CG C 13 26.55210069 0.0000055 . 1 . . . . . 14 PRO CG . 52678 1
145 . 1 . 1 14 14 PRO CD C 13 50.64439971 0.000002523 . 1 . . . . . 14 PRO CD . 52678 1
146 . 1 . 1 15 15 PHE H H 1 8.17687323 0.001139009466 . 1 . . . . . 15 PHE H . 52678 1
147 . 1 . 1 15 15 PHE HA H 1 4.535452454 0.000308922473 . 1 . . . . . 15 PHE HA . 52678 1
148 . 1 . 1 15 15 PHE HB2 H 1 2.998029007 0.004647059812 . 2 . . . . . 15 PHE HB2 . 52678 1
149 . 1 . 1 15 15 PHE HB3 H 1 3.13977442 0.001333464612 . 2 . . . . . 15 PHE HB3 . 52678 1
150 . 1 . 1 15 15 PHE HD1 H 1 7.233289649 0.008291617857 . 1 . . . . . 15 PHE HD# . 52678 1
151 . 1 . 1 15 15 PHE HD2 H 1 7.233289649 0.008291617857 . 1 . . . . . 15 PHE HD# . 52678 1
152 . 1 . 1 15 15 PHE HE1 H 1 7.322721019 0.001339757009 . 1 . . . . . 15 PHE HE# . 52678 1
153 . 1 . 1 15 15 PHE HE2 H 1 7.322721019 0.001339757009 . 1 . . . . . 15 PHE HE# . 52678 1
154 . 1 . 1 15 15 PHE HZ H 1 7.305880534 0.008648178441 . 1 . . . . . 15 PHE HZ . 52678 1
155 . 1 . 1 15 15 PHE C C 13 176.051 0 . 1 . . . . . 15 PHE C . 52678 1
156 . 1 . 1 15 15 PHE CA C 13 57.97739897 0.000004672 . 1 . . . . . 15 PHE CA . 52678 1
157 . 1 . 1 15 15 PHE CB C 13 38.86120087 0.000004744 . 1 . . . . . 15 PHE CB . 52678 1
158 . 1 . 1 15 15 PHE CD1 C 13 131.6204817 0 . 1 . . . . . 15 PHE CD# . 52678 1
159 . 1 . 1 15 15 PHE CD2 C 13 131.6204817 0 . 1 . . . . . 15 PHE CD# . 52678 1
160 . 1 . 1 15 15 PHE CE1 C 13 130.9644101 0 . 1 . . . . . 15 PHE CE# . 52678 1
161 . 1 . 1 15 15 PHE CE2 C 13 130.9644101 0 . 1 . . . . . 15 PHE CE# . 52678 1
162 . 1 . 1 15 15 PHE CZ C 13 130.1989931 0 . 1 . . . . . 15 PHE CZ . 52678 1
163 . 1 . 1 15 15 PHE N N 15 119.1630196 0.000074 . 1 . . . . . 15 PHE N . 52678 1
164 . 1 . 1 16 16 ILE H H 1 7.671437906 0.002780576668 . 1 . . . . . 16 ILE H . 52678 1
165 . 1 . 1 16 16 ILE HA H 1 4.019891369 0.002574310786 . 1 . . . . . 16 ILE HA . 52678 1
166 . 1 . 1 16 16 ILE HB H 1 1.771029139 0.003823459079 . 1 . . . . . 16 ILE HB . 52678 1
167 . 1 . 1 16 16 ILE HG12 H 1 1.125648129 0.004845472835 . 2 . . . . . 16 ILE HG12 . 52678 1
168 . 1 . 1 16 16 ILE HG13 H 1 1.416373069 0.003309947506 . 2 . . . . . 16 ILE HG13 . 52678 1
169 . 1 . 1 16 16 ILE HG21 H 1 0.8249259157 0.00003565 . 1 . . . . . 16 ILE HG2# . 52678 1
170 . 1 . 1 16 16 ILE HG22 H 1 0.8249259157 0.00003565 . 1 . . . . . 16 ILE HG2# . 52678 1
171 . 1 . 1 16 16 ILE HG23 H 1 0.8249259157 0.00003565 . 1 . . . . . 16 ILE HG2# . 52678 1
172 . 1 . 1 16 16 ILE HD11 H 1 0.8187495739 0.002130153404 . 1 . . . . . 16 ILE HD1# . 52678 1
173 . 1 . 1 16 16 ILE HD12 H 1 0.8187495739 0.002130153404 . 1 . . . . . 16 ILE HD1# . 52678 1
174 . 1 . 1 16 16 ILE HD13 H 1 0.8187495739 0.002130153404 . 1 . . . . . 16 ILE HD1# . 52678 1
175 . 1 . 1 16 16 ILE C C 13 175.504 0 . 1 . . . . . 16 ILE C . 52678 1
176 . 1 . 1 16 16 ILE CA C 13 61.24517533 0.000004768 . 1 . . . . . 16 ILE CA . 52678 1
177 . 1 . 1 16 16 ILE CB C 13 38.59940073 0.00000381 . 1 . . . . . 16 ILE CB . 52678 1
178 . 1 . 1 16 16 ILE CG1 C 13 27.33820073 0.0000057715 . 1 . . . . . 16 ILE CG1 . 52678 1
179 . 1 . 1 16 16 ILE CG2 C 13 17.12380043 0.0000024 . 1 . . . . . 16 ILE CG2 . 52678 1
180 . 1 . 1 16 16 ILE CD1 C 13 12.67270163 0.000008139 . 1 . . . . . 16 ILE CD1 . 52678 1
181 . 1 . 1 16 16 ILE N N 15 121.5889021 0.000007864 . 1 . . . . . 16 ILE N . 52678 1
182 . 1 . 1 17 17 ASN H H 1 8.450282683 0.00185990834 . 1 . . . . . 17 ASN H . 52678 1
183 . 1 . 1 17 17 ASN HA H 1 4.622586112 0.002790511613 . 1 . . . . . 17 ASN HA . 52678 1
184 . 1 . 1 17 17 ASN HB2 H 1 2.70166287 0.001560777196 . 2 . . . . . 17 ASN HB2 . 52678 1
185 . 1 . 1 17 17 ASN HB3 H 1 2.823597898 0.00315438865 . 2 . . . . . 17 ASN HB3 . 52678 1
186 . 1 . 1 17 17 ASN HD21 H 1 7.67965688 0.0000595 . 1 . . . . . 17 ASN HD21 . 52678 1
187 . 1 . 1 17 17 ASN C C 13 175.176 0 . 1 . . . . . 17 ASN C . 52678 1
188 . 1 . 1 17 17 ASN CA C 13 53.26369754 0.0000104687 . 1 . . . . . 17 ASN CA . 52678 1
189 . 1 . 1 17 17 ASN CB C 13 38.47040825 0.000001784 . 1 . . . . . 17 ASN CB . 52678 1
190 . 1 . 1 17 17 ASN N N 15 122.007 0.0000013 . 1 . . . . . 17 ASN N . 52678 1
191 . 1 . 1 18 18 ARG H H 1 8.274206637 0.00290701494 . 1 . . . . . 18 ARG H . 52678 1
192 . 1 . 1 18 18 ARG HA H 1 4.235326108 0 . 1 . . . . . 18 ARG HA . 52678 1
193 . 1 . 1 18 18 ARG C C 13 176.324 0 . 1 . . . . . 18 ARG C . 52678 1
194 . 1 . 1 18 18 ARG CA C 13 56.27710912 0 . 1 . . . . . 18 ARG CA . 52678 1
195 . 1 . 1 18 18 ARG CB C 13 30.47796208 0 . 1 . . . . . 18 ARG CB . 52678 1
196 . 1 . 1 18 18 ARG CG C 13 26.81401191 0 . 1 . . . . . 18 ARG CG . 52678 1
197 . 1 . 1 18 18 ARG CD C 13 43.05038189 0 . 1 . . . . . 18 ARG CD . 52678 1
198 . 1 . 1 18 18 ARG N N 15 122.0076412 0.001544202811 . 1 . . . . . 18 ARG N . 52678 1
199 . 1 . 1 19 19 ARG H H 1 8.382470559 0.0002055721253 . 1 . . . . . 19 ARG H . 52678 1
200 . 1 . 1 19 19 ARG HA H 1 4.228517811 0.002483829429 . 1 . . . . . 19 ARG HA . 52678 1
201 . 1 . 1 19 19 ARG HB2 H 1 1.776305378 0.0005390735417 . 2 . . . . . 19 ARG HB2 . 52678 1
202 . 1 . 1 19 19 ARG HB3 H 1 1.783311431 0.001137932621 . 2 . . . . . 19 ARG HB3 . 52678 1
203 . 1 . 1 19 19 ARG HG2 H 1 1.564321022 0.0003675597263 . 2 . . . . . 19 ARG HG2 . 52678 1
204 . 1 . 1 19 19 ARG HG3 H 1 1.57109133 0.0005458323565 . 2 . . . . . 19 ARG HG3 . 52678 1
205 . 1 . 1 19 19 ARG HD2 H 1 3.139031903 0.0008301786567 . 1 . . . . . 19 ARG HD2 . 52678 1
206 . 1 . 1 19 19 ARG HD3 H 1 3.139413722 0.0007930917254 . 1 . . . . . 19 ARG HD3 . 52678 1
207 . 1 . 1 19 19 ARG C C 13 176.16 0 . 1 . . . . . 19 ARG C . 52678 1
208 . 1 . 1 19 19 ARG CA C 13 56.40619918 0.00000543678 . 1 . . . . . 19 ARG CA . 52678 1
209 . 1 . 1 19 19 ARG CB C 13 30.48050051 0.000004046 . 1 . . . . . 19 ARG CB . 52678 1
210 . 1 . 1 19 19 ARG CG C 13 26.81489927 0.00000522 . 1 . . . . . 19 ARG CG . 52678 1
211 . 1 . 1 19 19 ARG CD C 13 43.04990079 0.00000539 . 1 . . . . . 19 ARG CD . 52678 1
212 . 1 . 1 19 19 ARG N N 15 121.9 0.00000426 . 1 . . . . . 19 ARG N . 52678 1
213 . 1 . 1 20 20 ASN H H 1 8.478329074 0.000050938 . 1 . . . . . 20 ASN H . 52678 1
214 . 1 . 1 20 20 ASN HA H 1 4.623151664 0.00234488777 . 1 . . . . . 20 ASN HA . 52678 1
215 . 1 . 1 20 20 ASN HB2 H 1 2.701297772 0.001570059713 . 2 . . . . . 20 ASN HB2 . 52678 1
216 . 1 . 1 20 20 ASN HB3 H 1 2.816853506 0.001142410958 . 2 . . . . . 20 ASN HB3 . 52678 1
217 . 1 . 1 20 20 ASN HD21 H 1 7.680314334 0.0005575964216 . 1 . . . . . 20 ASN HD21 . 52678 1
218 . 1 . 1 20 20 ASN C C 13 175.066 0 . 1 . . . . . 20 ASN C . 52678 1
219 . 1 . 1 20 20 ASN CA C 13 53.00170073 0.00000278 . 1 . . . . . 20 ASN CA . 52678 1
220 . 1 . 1 20 20 ASN CB C 13 38.59870003 0.0000015 . 1 . . . . . 20 ASN CB . 52678 1
221 . 1 . 1 20 20 ASN N N 15 119.8939986 0.000002697 . 1 . . . . . 20 ASN N . 52678 1
222 . 1 . 1 21 21 ALA H H 1 8.375590033 0.0000282 . 1 . . . . . 21 ALA H . 52678 1
223 . 1 . 1 21 21 ALA HA H 1 4.218345294 0.004585895295 . 1 . . . . . 21 ALA HA . 52678 1
224 . 1 . 1 21 21 ALA HB1 H 1 1.359622432 0.00189806176 . 1 . . . . . 21 ALA HB# . 52678 1
225 . 1 . 1 21 21 ALA HB2 H 1 1.359622432 0.00189806176 . 1 . . . . . 21 ALA HB# . 52678 1
226 . 1 . 1 21 21 ALA HB3 H 1 1.359622432 0.00189806176 . 1 . . . . . 21 ALA HB# . 52678 1
227 . 1 . 1 21 21 ALA C C 13 177.636 0 . 1 . . . . . 21 ALA C . 52678 1
228 . 1 . 1 21 21 ALA CA C 13 52.87510791 0.0000022 . 1 . . . . . 21 ALA CA . 52678 1
229 . 1 . 1 21 21 ALA CB C 13 19.09180539 0.0000041 . 1 . . . . . 21 ALA CB . 52678 1
230 . 1 . 1 21 21 ALA N N 15 124.632 0.000004046 . 1 . . . . . 21 ALA N . 52678 1
231 . 1 . 1 22 22 ASN H H 1 8.503354216 0.002888255496 . 1 . . . . . 22 ASN H . 52678 1
232 . 1 . 1 22 22 ASN HA H 1 4.672350533 0.0002298401861 . 1 . . . . . 22 ASN HA . 52678 1
233 . 1 . 1 22 22 ASN HB2 H 1 2.728594517 0.0012414401 . 2 . . . . . 22 ASN HB2 . 52678 1
234 . 1 . 1 22 22 ASN HB3 H 1 2.768403573 0.001838054557 . 2 . . . . . 22 ASN HB3 . 52678 1
235 . 1 . 1 22 22 ASN HD21 H 1 7.652302903 0.0000097 . 1 . . . . . 22 ASN HD21 . 52678 1
236 . 1 . 1 22 22 ASN C C 13 175.395 0 . 1 . . . . . 22 ASN C . 52678 1
237 . 1 . 1 22 22 ASN CA C 13 53.26309794 0.0000087 . 1 . . . . . 22 ASN CA . 52678 1
238 . 1 . 1 22 22 ASN CB C 13 38.59910102 0.00000666 . 1 . . . . . 22 ASN CB . 52678 1
239 . 1 . 1 22 22 ASN N N 15 117.523 0.0000038 . 1 . . . . . 22 ASN N . 52678 1
240 . 1 . 1 23 23 THR H H 1 8.006619495 0.0007958585822 . 1 . . . . . 23 THR H . 52678 1
241 . 1 . 1 23 23 THR HA H 1 4.22074703 0.0009217109632 . 1 . . . . . 23 THR HA . 52678 1
242 . 1 . 1 23 23 THR HB H 1 4.125103667 0.0006262767157 . 1 . . . . . 23 THR HB . 52678 1
243 . 1 . 1 23 23 THR HG21 H 1 1.097978785 0.003053520735 . 1 . . . . . 23 THR HG2# . 52678 1
244 . 1 . 1 23 23 THR HG22 H 1 1.097978785 0.003053520735 . 1 . . . . . 23 THR HG2# . 52678 1
245 . 1 . 1 23 23 THR HG23 H 1 1.097978785 0.003053520735 . 1 . . . . . 23 THR HG2# . 52678 1
246 . 1 . 1 23 23 THR C C 13 174.027 0 . 1 . . . . . 23 THR C . 52678 1
247 . 1 . 1 23 23 THR CA C 13 61.90809952 0.0000013 . 1 . . . . . 23 THR CA . 52678 1
248 . 1 . 1 23 23 THR CB C 13 69.76159902 0.0000038 . 1 . . . . . 23 THR CB . 52678 1
249 . 1 . 1 23 23 THR CG2 C 13 21.31459876 0.0000070 . 1 . . . . . 23 THR CG2 . 52678 1
250 . 1 . 1 23 23 THR N N 15 114.2024019 0.000006877 . 1 . . . . . 23 THR N . 52678 1
251 . 1 . 1 24 24 PHE H H 1 8.276218995 0.003878616907 . 1 . . . . . 24 PHE H . 52678 1
252 . 1 . 1 24 24 PHE HA H 1 4.567210954 0.002949434681 . 1 . . . . . 24 PHE HA . 52678 1
253 . 1 . 1 24 24 PHE HB2 H 1 3.029718644 0.001224919322 . 1 . . . . . 24 PHE HB2 . 52678 1
254 . 1 . 1 24 24 PHE HB3 H 1 3.029958166 0.001257303897 . 1 . . . . . 24 PHE HB3 . 52678 1
255 . 1 . 1 24 24 PHE HD1 H 1 7.189555935 0.00190690331 . 1 . . . . . 24 PHE HD# . 52678 1
256 . 1 . 1 24 24 PHE HD2 H 1 7.189555935 0.00190690331 . 1 . . . . . 24 PHE HD# . 52678 1
257 . 1 . 1 24 24 PHE HE1 H 1 7.290133131 0.004792155272 . 1 . . . . . 24 PHE HE# . 52678 1
258 . 1 . 1 24 24 PHE HE2 H 1 7.290133131 0.004792155272 . 1 . . . . . 24 PHE HE# . 52678 1
259 . 1 . 1 24 24 PHE HZ H 1 7.268402034 0.001437393013 . 1 . . . . . 24 PHE HZ . 52678 1
260 . 1 . 1 24 24 PHE C C 13 175.012 0 . 1 . . . . . 24 PHE C . 52678 1
261 . 1 . 1 24 24 PHE CA C 13 57.85020803 0.0000013 . 1 . . . . . 24 PHE CA . 52678 1
262 . 1 . 1 24 24 PHE CB C 13 39.51289173 0.00000158 . 1 . . . . . 24 PHE CB . 52678 1
263 . 1 . 1 24 24 PHE CD1 C 13 131.6204817 0 . 1 . . . . . 24 PHE CD# . 52678 1
264 . 1 . 1 24 24 PHE CD2 C 13 131.6204817 0 . 1 . . . . . 24 PHE CD# . 52678 1
265 . 1 . 1 24 24 PHE CE1 C 13 131.1831006 0 . 1 . . . . . 24 PHE CE# . 52678 1
266 . 1 . 1 24 24 PHE CE2 C 13 131.1831006 0 . 1 . . . . . 24 PHE CE# . 52678 1
267 . 1 . 1 24 24 PHE CZ C 13 129.6522668 0 . 1 . . . . . 24 PHE CZ . 52678 1
268 . 1 . 1 24 24 PHE N N 15 123.4803 0.00000381 . 1 . . . . . 24 PHE N . 52678 1
269 . 1 . 1 25 25 ILE H H 1 8.038738965 0.005162728071 . 1 . . . . . 25 ILE H . 52678 1
270 . 1 . 1 25 25 ILE HA H 1 4.097602751 0.0006577758552 . 1 . . . . . 25 ILE HA . 52678 1
271 . 1 . 1 25 25 ILE HB H 1 1.666485985 0.0006276837887 . 1 . . . . . 25 ILE HB . 52678 1
272 . 1 . 1 25 25 ILE HG12 H 1 1.06441213 0.0001293480815 . 2 . . . . . 25 ILE HG12 . 52678 1
273 . 1 . 1 25 25 ILE HG13 H 1 1.39276217 0.0004051140258 . 2 . . . . . 25 ILE HG13 . 52678 1
274 . 1 . 1 25 25 ILE HG21 H 1 0.7911706808 0.001576364781 . 1 . . . . . 25 ILE HG2# . 52678 1
275 . 1 . 1 25 25 ILE HG22 H 1 0.7911706808 0.001576364781 . 1 . . . . . 25 ILE HG2# . 52678 1
276 . 1 . 1 25 25 ILE HG23 H 1 0.7911706808 0.001576364781 . 1 . . . . . 25 ILE HG2# . 52678 1
277 . 1 . 1 25 25 ILE HD11 H 1 0.7586409469 0.003272435409 . 1 . . . . . 25 ILE HD1# . 52678 1
278 . 1 . 1 25 25 ILE HD12 H 1 0.7586409469 0.003272435409 . 1 . . . . . 25 ILE HD1# . 52678 1
279 . 1 . 1 25 25 ILE HD13 H 1 0.7586409469 0.003272435409 . 1 . . . . . 25 ILE HD1# . 52678 1
280 . 1 . 1 25 25 ILE C C 13 175.34 0 . 1 . . . . . 25 ILE C . 52678 1
281 . 1 . 1 25 25 ILE CA C 13 60.20600822 0.000002861 . 1 . . . . . 25 ILE CA . 52678 1
282 . 1 . 1 25 25 ILE CB C 13 38.73230824 0.000001719 . 1 . . . . . 25 ILE CB . 52678 1
283 . 1 . 1 25 25 ILE CG1 C 13 26.94490833 0.0000004768 . 1 . . . . . 25 ILE CG1 . 52678 1
284 . 1 . 1 25 25 ILE CG2 C 13 17.2575083 0.0000013696 . 1 . . . . . 25 ILE CG2 . 52678 1
285 . 1 . 1 25 25 ILE CD1 C 13 12.54580826 0.00000144 . 1 . . . . . 25 ILE CD1 . 52678 1
286 . 1 . 1 25 25 ILE N N 15 125.0181971 0.000010 . 1 . . . . . 25 ILE N . 52678 1
287 . 1 . 1 26 26 SER H H 1 8.527571614 0.005341465049 . 1 . . . . . 26 SER H . 52678 1
288 . 1 . 1 26 26 SER HA H 1 4.567207081 0.002994748466 . 1 . . . . . 26 SER HA . 52678 1
289 . 1 . 1 26 26 SER HB2 H 1 3.888553706 0.005231093794 . 2 . . . . . 26 SER HB2 . 52678 1
290 . 1 . 1 26 26 SER HB3 H 1 4.065599001 0.003831774659 . 2 . . . . . 26 SER HB3 . 52678 1
291 . 1 . 1 26 26 SER C C 13 173.097 0 . 1 . . . . . 26 SER C . 52678 1
292 . 1 . 1 26 26 SER CA C 13 56.40589998 0.000000674 . 1 . . . . . 26 SER CA . 52678 1
293 . 1 . 1 26 26 SER CB C 13 63.21549888 0.00000694 . 1 . . . . . 26 SER CB . 52678 1
294 . 1 . 1 26 26 SER N N 15 122.772 0.000005722 . 1 . . . . . 26 SER N . 52678 1
295 . 1 . 1 27 27 PRO HA H 1 4.289084676 0.001112729588 . 1 . . . . . 27 PRO HA . 52678 1
296 . 1 . 1 27 27 PRO HB2 H 1 1.901727332 0.004880676274 . 2 . . . . . 27 PRO HB2 . 52678 1
297 . 1 . 1 27 27 PRO HB3 H 1 2.323212521 0.001181435434 . 2 . . . . . 27 PRO HB3 . 52678 1
298 . 1 . 1 27 27 PRO HG2 H 1 2.031108134 0.00318029806 . 2 . . . . . 27 PRO HG2 . 52678 1
299 . 1 . 1 27 27 PRO HG3 H 1 2.096605966 0.01112287334 . 2 . . . . . 27 PRO HG3 . 52678 1
300 . 1 . 1 27 27 PRO HD2 H 1 3.846171213 0.01264328812 . 2 . . . . . 27 PRO HD2 . 52678 1
301 . 1 . 1 27 27 PRO HD3 H 1 3.873323778 0.01334806964 . 2 . . . . . 27 PRO HD3 . 52678 1
302 . 1 . 1 27 27 PRO C C 13 178.02 0 . 1 . . . . . 27 PRO C . 52678 1
303 . 1 . 1 27 27 PRO CA C 13 64.26139907 0.000004672 . 1 . . . . . 27 PRO CA . 52678 1
304 . 1 . 1 27 27 PRO CB C 13 31.78959969 0.0000022618 . 1 . . . . . 27 PRO CB . 52678 1
305 . 1 . 1 27 27 PRO CG C 13 27.59979997 0.0000013 . 1 . . . . . 27 PRO CG . 52678 1
306 . 1 . 1 27 27 PRO CD C 13 50.64379997 0.0000015 . 1 . . . . . 27 PRO CD . 52678 1
307 . 1 . 1 28 28 GLN H H 1 8.457860058 0.001678240944 . 1 . . . . . 28 GLN H . 52678 1
308 . 1 . 1 28 28 GLN HA H 1 4.175658395 0.003898287532 . 1 . . . . . 28 GLN HA . 52678 1
309 . 1 . 1 28 28 GLN HB2 H 1 1.990662755 0.002376042237 . 2 . . . . . 28 GLN HB2 . 52678 1
310 . 1 . 1 28 28 GLN HB3 H 1 2.028004347 0.003349464006 . 2 . . . . . 28 GLN HB3 . 52678 1
311 . 1 . 1 28 28 GLN HG2 H 1 2.372424621 0.0009810531294 . 2 . . . . . 28 GLN HG2 . 52678 1
312 . 1 . 1 28 28 GLN HG3 H 1 2.37853797 0.0009845935655 . 2 . . . . . 28 GLN HG3 . 52678 1
313 . 1 . 1 28 28 GLN C C 13 177.09 0 . 1 . . . . . 28 GLN C . 52678 1
314 . 1 . 1 28 28 GLN CA C 13 57.32059178 0.000002523 . 1 . . . . . 28 GLN CA . 52678 1
315 . 1 . 1 28 28 GLN CB C 13 28.64770084 0.00000575 . 1 . . . . . 28 GLN CB . 52678 1
316 . 1 . 1 28 28 GLN CG C 13 33.88439998 0.00000143 . 1 . . . . . 28 GLN CG . 52678 1
317 . 1 . 1 28 28 GLN N N 15 118.6575032 0.0000118 . 1 . . . . . 28 GLN N . 52678 1
318 . 1 . 1 29 29 GLN H H 1 8.189920642 0.003992900359 . 1 . . . . . 29 GLN H . 52678 1
319 . 1 . 1 29 29 GLN HA H 1 4.148241946 0.003808733152 . 1 . . . . . 29 GLN HA . 52678 1
320 . 1 . 1 29 29 GLN HB2 H 1 1.993732197 0.002319140024 . 2 . . . . . 29 GLN HB2 . 52678 1
321 . 1 . 1 29 29 GLN HB3 H 1 2.020892009 0.000048 . 2 . . . . . 29 GLN HB3 . 52678 1
322 . 1 . 1 29 29 GLN HG2 H 1 2.312779784 0.004554702238 . 1 . . . . . 29 GLN HG2 . 52678 1
323 . 1 . 1 29 29 GLN HG3 H 1 2.31305337 0.004670004237 . 1 . . . . . 29 GLN HG3 . 52678 1
324 . 1 . 1 29 29 GLN C C 13 177.199 0 . 1 . . . . . 29 GLN C . 52678 1
325 . 1 . 1 29 29 GLN CA C 13 56.79709175 0.000002523 . 1 . . . . . 29 GLN CA . 52678 1
326 . 1 . 1 29 29 GLN CB C 13 28.64809915 0.0000061 . 1 . . . . . 29 GLN CB . 52678 1
327 . 1 . 1 29 29 GLN CG C 13 33.6221998 0.00000243 . 1 . . . . . 29 GLN CG . 52678 1
328 . 1 . 1 29 29 GLN N N 15 121.023 0.0000038 . 1 . . . . . 29 GLN N . 52678 1
329 . 1 . 1 30 30 ARG H H 1 8.279803945 0.0001649184586 . 1 . . . . . 30 ARG H . 52678 1
330 . 1 . 1 30 30 ARG HA H 1 4.070257182 0.0006898029059 . 1 . . . . . 30 ARG HA . 52678 1
331 . 1 . 1 30 30 ARG HB2 H 1 1.721263036 0.0006005264836 . 1 . . . . . 30 ARG HB2 . 52678 1
332 . 1 . 1 30 30 ARG HB3 H 1 1.721578807 0.0007403263123 . 1 . . . . . 30 ARG HB3 . 52678 1
333 . 1 . 1 30 30 ARG HG2 H 1 1.447585524 0.000480937524 . 2 . . . . . 30 ARG HG2 . 52678 1
334 . 1 . 1 30 30 ARG HG3 H 1 1.52561398 0.002810983666 . 2 . . . . . 30 ARG HG3 . 52678 1
335 . 1 . 1 30 30 ARG HD2 H 1 3.122907143 0.004221896818 . 1 . . . . . 30 ARG HD2 . 52678 1
336 . 1 . 1 30 30 ARG HD3 H 1 3.123152234 0.004335571239 . 1 . . . . . 30 ARG HD3 . 52678 1
337 . 1 . 1 30 30 ARG C C 13 177.145 0 . 1 . . . . . 30 ARG C . 52678 1
338 . 1 . 1 30 30 ARG CA C 13 57.45409991 0.0000022366 . 1 . . . . . 30 ARG CA . 52678 1
339 . 1 . 1 30 30 ARG CB C 13 30.2191997 0.000002384 . 1 . . . . . 30 ARG CB . 52678 1
340 . 1 . 1 30 30 ARG CG C 13 27.20314844 0.0000058885 . 1 . . . . . 30 ARG CG . 52678 1
341 . 1 . 1 30 30 ARG CD C 13 43.20314841 0.000005581 . 1 . . . . . 30 ARG CD . 52678 1
342 . 1 . 1 30 30 ARG N N 15 121.679 0.00000556 . 1 . . . . . 30 ARG N . 52678 1
343 . 1 . 1 31 31 TRP H H 1 8.184233953 0.001889392569 . 1 . . . . . 31 TRP H . 52678 1
344 . 1 . 1 31 31 TRP HA H 1 4.513071751 0.004067721367 . 1 . . . . . 31 TRP HA . 52678 1
345 . 1 . 1 31 31 TRP HB2 H 1 3.281967843 0.001869069979 . 1 . . . . . 31 TRP HB2 . 52678 1
346 . 1 . 1 31 31 TRP HB3 H 1 3.28206083 0.001865027823 . 1 . . . . . 31 TRP HB3 . 52678 1
347 . 1 . 1 31 31 TRP HD1 H 1 7.217086374 0.001978184272 . 1 . . . . . 31 TRP HD1 . 52678 1
348 . 1 . 1 31 31 TRP HE1 H 1 10.13986571 0.0000099 . 1 . . . . . 31 TRP HE1 . 52678 1
349 . 1 . 1 31 31 TRP HE3 H 1 7.544761423 0.005738560584 . 1 . . . . . 31 TRP HE3 . 52678 1
350 . 1 . 1 31 31 TRP HZ2 H 1 7.424924659 0.002615113007 . 1 . . . . . 31 TRP HZ2 . 52678 1
351 . 1 . 1 31 31 TRP HZ3 H 1 7.079752805 0.001763376264 . 1 . . . . . 31 TRP HZ3 . 52678 1
352 . 1 . 1 31 31 TRP HH2 H 1 7.185289927 0.00255706257 . 1 . . . . . 31 TRP HH2 . 52678 1
353 . 1 . 1 31 31 TRP C C 13 176.598 0 . 1 . . . . . 31 TRP C . 52678 1
354 . 1 . 1 31 31 TRP CA C 13 58.23990201 0.000009047 . 1 . . . . . 31 TRP CA . 52678 1
355 . 1 . 1 31 31 TRP CB C 13 29.17149972 0.0000023 . 1 . . . . . 31 TRP CB . 52678 1
356 . 1 . 1 31 31 TRP CD1 C 13 127.1176613 0.0000019 . 1 . . . . . 31 TRP CD1 . 52678 1
357 . 1 . 1 31 31 TRP CE3 C 13 120.0102184 0.0000013 . 1 . . . . . 31 TRP CE3 . 52678 1
358 . 1 . 1 31 31 TRP CZ2 C 13 114.6522668 0.0000013 . 1 . . . . . 31 TRP CZ2 . 52678 1
359 . 1 . 1 31 31 TRP CZ3 C 13 121.9784334 0.0000019 . 1 . . . . . 31 TRP CZ3 . 52678 1
360 . 1 . 1 31 31 TRP CH2 C 13 124.60272 0.0000013 . 1 . . . . . 31 TRP CH2 . 52678 1
361 . 1 . 1 31 31 TRP N N 15 121.305 0.000002336 . 1 . . . . . 31 TRP N . 52678 1
362 . 1 . 1 32 32 ARG H H 1 7.923335218 0.004586774394 . 1 . . . . . 32 ARG H . 52678 1
363 . 1 . 1 32 32 ARG HA H 1 3.939656764 0.001371103979 . 1 . . . . . 32 ARG HA . 52678 1
364 . 1 . 1 32 32 ARG HB2 H 1 1.654337047 0.003069137585 . 2 . . . . . 32 ARG HB2 . 52678 1
365 . 1 . 1 32 32 ARG HB3 H 1 1.707591161 0.002595014362 . 2 . . . . . 32 ARG HB3 . 52678 1
366 . 1 . 1 32 32 ARG HG2 H 1 1.455450533 0.003103028382 . 2 . . . . . 32 ARG HG2 . 52678 1
367 . 1 . 1 32 32 ARG HG3 H 1 1.516131029 0.0007368647609 . 2 . . . . . 32 ARG HG3 . 52678 1
368 . 1 . 1 32 32 ARG HD2 H 1 3.075388471 0.007486922682 . 2 . . . . . 32 ARG HD2 . 52678 1
369 . 1 . 1 32 32 ARG HD3 H 1 3.080168647 0.004403314725 . 2 . . . . . 32 ARG HD3 . 52678 1
370 . 1 . 1 32 32 ARG C C 13 176.379 0 . 1 . . . . . 32 ARG C . 52678 1
371 . 1 . 1 32 32 ARG CA C 13 56.79669183 0.0000015 . 1 . . . . . 32 ARG CA . 52678 1
372 . 1 . 1 32 32 ARG CB C 13 30.61460834 0.0000022 . 1 . . . . . 32 ARG CB . 52678 1
373 . 1 . 1 32 32 ARG CG C 13 27.21282487 0.0000036 . 1 . . . . . 32 ARG CG . 52678 1
374 . 1 . 1 32 32 ARG CD C 13 43.31239888 0.00000669 . 1 . . . . . 32 ARG CD . 52678 1
375 . 1 . 1 32 32 ARG N N 15 121.57 0.0000019 . 1 . . . . . 32 ARG N . 52678 1
376 . 1 . 1 33 33 ALA H H 1 8.012585251 0.001311764706 . 1 . . . . . 33 ALA H . 52678 1
377 . 1 . 1 33 33 ALA HA H 1 4.075420004 0.002212851229 . 1 . . . . . 33 ALA HA . 52678 1
378 . 1 . 1 33 33 ALA HB1 H 1 1.365472406 0.001116072144 . 1 . . . . . 33 ALA HB# . 52678 1
379 . 1 . 1 33 33 ALA HB2 H 1 1.365472406 0.001116072144 . 1 . . . . . 33 ALA HB# . 52678 1
380 . 1 . 1 33 33 ALA HB3 H 1 1.365472406 0.001116072144 . 1 . . . . . 33 ALA HB# . 52678 1
381 . 1 . 1 33 33 ALA C C 13 178.512 0 . 1 . . . . . 33 ALA C . 52678 1
382 . 1 . 1 33 33 ALA CA C 13 53.13570809 0.000001168 . 1 . . . . . 33 ALA CA . 52678 1
383 . 1 . 1 33 33 ALA CB C 13 18.56910817 0.000001617 . 1 . . . . . 33 ALA CB . 52678 1
384 . 1 . 1 33 33 ALA N N 15 123.319 0.000004046 . 1 . . . . . 33 ALA N . 52678 1
385 . 1 . 1 34 34 LYS H H 1 8.094846608 0.0007328829674 . 1 . . . . . 34 LYS H . 52678 1
386 . 1 . 1 34 34 LYS HA H 1 4.13696189 0.003430230764 . 1 . . . . . 34 LYS HA . 52678 1
387 . 1 . 1 34 34 LYS HB2 H 1 1.762403366 0.002413983223 . 2 . . . . . 34 LYS HB2 . 52678 1
388 . 1 . 1 34 34 LYS HB3 H 1 1.763174078 0.002476508387 . 2 . . . . . 34 LYS HB3 . 52678 1
389 . 1 . 1 34 34 LYS HG2 H 1 1.344258569 0.002206688369 . 2 . . . . . 34 LYS HG2 . 52678 1
390 . 1 . 1 34 34 LYS HG3 H 1 1.441536081 0.0009276867559 . 2 . . . . . 34 LYS HG3 . 52678 1
391 . 1 . 1 34 34 LYS HD2 H 1 1.632751871 0.0002678326862 . 2 . . . . . 34 LYS HD2 . 52678 1
392 . 1 . 1 34 34 LYS HD3 H 1 1.633426081 0.0006382364228 . 2 . . . . . 34 LYS HD3 . 52678 1
393 . 1 . 1 34 34 LYS HE2 H 1 2.926337558 0.0009714218608 . 1 . . . . . 34 LYS HE2 . 52678 1
394 . 1 . 1 34 34 LYS HE3 H 1 2.92677175 0.001124468404 . 1 . . . . . 34 LYS HE3 . 52678 1
395 . 1 . 1 34 34 LYS C C 13 177.528 0 . 1 . . . . . 34 LYS C . 52678 1
396 . 1 . 1 34 34 LYS CA C 13 57.19179948 0.0000013487 . 1 . . . . . 34 LYS CA . 52678 1
397 . 1 . 1 34 34 LYS CB C 13 32.57579957 0.0000027392 . 1 . . . . . 34 LYS CB . 52678 1
398 . 1 . 1 34 34 LYS CG C 13 24.80472349 0.000002676 . 1 . . . . . 34 LYS CG . 52678 1
399 . 1 . 1 34 34 LYS CD C 13 28.93753146 0.0000049669 . 1 . . . . . 34 LYS CD . 52678 1
400 . 1 . 1 34 34 LYS CE C 13 41.81259669 0.0000014305 . 1 . . . . . 34 LYS CE . 52678 1
401 . 1 . 1 34 34 LYS N N 15 120.913 0.0000019 . 1 . . . . . 34 LYS N . 52678 1
402 . 1 . 1 35 35 VAL H H 1 8.102039826 0.005169243766 . 1 . . . . . 35 VAL H . 52678 1
403 . 1 . 1 35 35 VAL HA H 1 3.80105609 0.002328445913 . 1 . . . . . 35 VAL HA . 52678 1
404 . 1 . 1 35 35 VAL HB H 1 1.935502097 0.002275903139 . 1 . . . . . 35 VAL HB . 52678 1
405 . 1 . 1 35 35 VAL HG11 H 1 0.7496707469 0.001574014311 . 2 . . . . . 35 VAL HG1# . 52678 1
406 . 1 . 1 35 35 VAL HG12 H 1 0.7496707469 0.001574014311 . 2 . . . . . 35 VAL HG1# . 52678 1
407 . 1 . 1 35 35 VAL HG13 H 1 0.7496707469 0.001574014311 . 2 . . . . . 35 VAL HG1# . 52678 1
408 . 1 . 1 35 35 VAL HG21 H 1 0.8314486042 0.002669266102 . 2 . . . . . 35 VAL HG2# . 52678 1
409 . 1 . 1 35 35 VAL HG22 H 1 0.8314486042 0.002669266102 . 2 . . . . . 35 VAL HG2# . 52678 1
410 . 1 . 1 35 35 VAL HG23 H 1 0.8314486042 0.002669266102 . 2 . . . . . 35 VAL HG2# . 52678 1
411 . 1 . 1 35 35 VAL C C 13 176.926 0 . 1 . . . . . 35 VAL C . 52678 1
412 . 1 . 1 35 35 VAL CA C 13 63.60980818 0.0000024314 . 1 . . . . . 35 VAL CA . 52678 1
413 . 1 . 1 35 35 VAL CB C 13 32.31409653 0.000017 . 1 . . . . . 35 VAL CB . 52678 1
414 . 1 . 1 35 35 VAL CG1 C 13 21.07033774 0.00001057 . 2 . . . . . 35 VAL CG1 . 52678 1
415 . 1 . 1 35 35 VAL CG2 C 13 20.93753223 0.0000002384 . 2 . . . . . 35 VAL CG2 . 52678 1
416 . 1 . 1 35 35 VAL N N 15 121.898 0.000002336 . 1 . . . . . 35 VAL N . 52678 1
417 . 1 . 1 36 36 GLN H H 1 8.362055621 0.0008640216199 . 1 . . . . . 36 GLN H . 52678 1
418 . 1 . 1 36 36 GLN HA H 1 4.162338346 0.008694037247 . 1 . . . . . 36 GLN HA . 52678 1
419 . 1 . 1 36 36 GLN HB2 H 1 1.982689018 0.001354865267 . 2 . . . . . 36 GLN HB2 . 52678 1
420 . 1 . 1 36 36 GLN HB3 H 1 2.022254818 0.0007228959728 . 2 . . . . . 36 GLN HB3 . 52678 1
421 . 1 . 1 36 36 GLN HG2 H 1 2.318549266 0.002017331263 . 2 . . . . . 36 GLN HG2 . 52678 1
422 . 1 . 1 36 36 GLN HG3 H 1 2.345710637 0.001707196006 . 2 . . . . . 36 GLN HG3 . 52678 1
423 . 1 . 1 36 36 GLN C C 13 176.652 0 . 1 . . . . . 36 GLN C . 52678 1
424 . 1 . 1 36 36 GLN CA C 13 56.40620603 0.000030 . 1 . . . . . 36 GLN CA . 52678 1
425 . 1 . 1 36 36 GLN CB C 13 28.90789917 0.000005384 . 1 . . . . . 36 GLN CB . 52678 1
426 . 1 . 1 36 36 GLN CG C 13 33.36249957 0.0000032 . 1 . . . . . 36 GLN CG . 52678 1
427 . 1 . 1 36 36 GLN N N 15 122.773 0.00000522 . 1 . . . . . 36 GLN N . 52678 1
428 . 1 . 1 37 37 GLU H H 1 8.348042156 0.001557944673 . 1 . . . . . 37 GLU H . 52678 1
429 . 1 . 1 37 37 GLU HA H 1 4.261858652 0.0004910587506 . 1 . . . . . 37 GLU HA . 52678 1
430 . 1 . 1 37 37 GLU HB2 H 1 1.974768971 0.00033849803 . 1 . . . . . 37 GLU HB2 . 52678 1
431 . 1 . 1 37 37 GLU HB3 H 1 1.975180997 0.0006027632277 . 1 . . . . . 37 GLU HB3 . 52678 1
432 . 1 . 1 37 37 GLU HG2 H 1 2.392442341 0.0002779027891 . 1 . . . . . 37 GLU HG2 . 52678 1
433 . 1 . 1 37 37 GLU HG3 H 1 2.392811803 0.0004940106799 . 1 . . . . . 37 GLU HG3 . 52678 1
434 . 1 . 1 37 37 GLU C C 13 176.488 0 . 1 . . . . . 37 GLU C . 52678 1
435 . 1 . 1 37 37 GLU CA C 13 56.4061995 0.000003234 . 1 . . . . . 37 GLU CA . 52678 1
436 . 1 . 1 37 37 GLU CB C 13 28.78080825 0.0000010115 . 1 . . . . . 37 GLU CB . 52678 1
437 . 1 . 1 37 37 GLU CG C 13 32.97180817 0.000001784 . 1 . . . . . 37 GLU CG . 52678 1
438 . 1 . 1 37 37 GLU N N 15 122.007 0.0000013 . 1 . . . . . 37 GLU N . 52678 1
439 . 1 . 1 38 38 ARG H H 1 8.280397792 0.0006845494716 . 1 . . . . . 38 ARG H . 52678 1
440 . 1 . 1 38 38 ARG HA H 1 4.235037953 0.0000257 . 1 . . . . . 38 ARG HA . 52678 1
441 . 1 . 1 38 38 ARG C C 13 176.981 0 . 1 . . . . . 38 ARG C . 52678 1
442 . 1 . 1 38 38 ARG CA C 13 56.92888875 0 . 1 . . . . . 38 ARG CA . 52678 1
443 . 1 . 1 38 38 ARG CB C 13 30.22044546 0 . 1 . . . . . 38 ARG CB . 52678 1
444 . 1 . 1 38 38 ARG CG C 13 26.81401574 0 . 1 . . . . . 38 ARG CG . 52678 1
445 . 1 . 1 38 38 ARG CD C 13 43.24 0 . 1 . . . . . 38 ARG CD . 52678 1
446 . 1 . 1 38 38 ARG N N 15 122.116 0 . 1 . . . . . 38 ARG N . 52678 1
447 . 1 . 1 39 39 ILE H H 1 8.167001009 0.004092054628 . 1 . . . . . 39 ILE H . 52678 1
448 . 1 . 1 39 39 ILE HA H 1 3.96043154 0.002897424246 . 1 . . . . . 39 ILE HA . 52678 1
449 . 1 . 1 39 39 ILE HB H 1 1.81493104 0.004840540417 . 1 . . . . . 39 ILE HB . 52678 1
450 . 1 . 1 39 39 ILE HG12 H 1 1.126130172 0.004565583309 . 2 . . . . . 39 ILE HG12 . 52678 1
451 . 1 . 1 39 39 ILE HG13 H 1 1.508435421 0.002615233815 . 2 . . . . . 39 ILE HG13 . 52678 1
452 . 1 . 1 39 39 ILE HG21 H 1 0.8505101949 0.002960867936 . 1 . . . . . 39 ILE HG2# . 52678 1
453 . 1 . 1 39 39 ILE HG22 H 1 0.8505101949 0.002960867936 . 1 . . . . . 39 ILE HG2# . 52678 1
454 . 1 . 1 39 39 ILE HG23 H 1 0.8505101949 0.002960867936 . 1 . . . . . 39 ILE HG2# . 52678 1
455 . 1 . 1 39 39 ILE HD11 H 1 0.8082185422 0.00613618581 . 1 . . . . . 39 ILE HD1# . 52678 1
456 . 1 . 1 39 39 ILE HD12 H 1 0.8082185422 0.00613618581 . 1 . . . . . 39 ILE HD1# . 52678 1
457 . 1 . 1 39 39 ILE HD13 H 1 0.8082185422 0.00613618581 . 1 . . . . . 39 ILE HD1# . 52678 1
458 . 1 . 1 39 39 ILE C C 13 176.981 0 . 1 . . . . . 39 ILE C . 52678 1
459 . 1 . 1 39 39 ILE CA C 13 62.03820825 0.0000013 . 1 . . . . . 39 ILE CA . 52678 1
460 . 1 . 1 39 39 ILE CB C 13 38.33689985 0.000001066 . 1 . . . . . 39 ILE CB . 52678 1
461 . 1 . 1 39 39 ILE CG1 C 13 27.59830062 0.00000522 . 1 . . . . . 39 ILE CG1 . 52678 1
462 . 1 . 1 39 39 ILE CG2 C 13 17.12409951 0.0000033 . 1 . . . . . 39 ILE CG2 . 52678 1
463 . 1 . 1 39 39 ILE CD1 C 13 12.80590826 0.0000014 . 1 . . . . . 39 ILE CD1 . 52678 1
464 . 1 . 1 39 39 ILE N N 15 122.2257647 0.000077 . 1 . . . . . 39 ILE N . 52678 1
465 . 1 . 1 40 40 ARG H H 1 8.374241261 0.003972155074 . 1 . . . . . 40 ARG H . 52678 1
466 . 1 . 1 40 40 ARG HA H 1 4.213176324 0.0008438684172 . 1 . . . . . 40 ARG HA . 52678 1
467 . 1 . 1 40 40 ARG HB2 H 1 1.782643438 0.002212578444 . 2 . . . . . 40 ARG HB2 . 52678 1
468 . 1 . 1 40 40 ARG HB3 H 1 1.803336469 0.0006560923679 . 2 . . . . . 40 ARG HB3 . 52678 1
469 . 1 . 1 40 40 ARG HG2 H 1 1.570959204 0.0001017803764 . 2 . . . . . 40 ARG HG2 . 52678 1
470 . 1 . 1 40 40 ARG HG3 H 1 1.636042657 0.008085120828 . 2 . . . . . 40 ARG HG3 . 52678 1
471 . 1 . 1 40 40 ARG HD2 H 1 3.132138536 0.001165430748 . 2 . . . . . 40 ARG HD2 . 52678 1
472 . 1 . 1 40 40 ARG HD3 H 1 3.139857453 0.001529703173 . 2 . . . . . 40 ARG HD3 . 52678 1
473 . 1 . 1 40 40 ARG C C 13 176.816 0 . 1 . . . . . 40 ARG C . 52678 1
474 . 1 . 1 40 40 ARG CA C 13 56.67380077 0.000004623 . 1 . . . . . 40 ARG CA . 52678 1
475 . 1 . 1 40 40 ARG CB C 13 30.48159965 0.0000027 . 1 . . . . . 40 ARG CB . 52678 1
476 . 1 . 1 40 40 ARG CG C 13 27.07034017 0.00000473 . 1 . . . . . 40 ARG CG . 52678 1
477 . 1 . 1 40 40 ARG CD C 13 43.18300834 0.000000674 . 1 . . . . . 40 ARG CD . 52678 1
478 . 1 . 1 40 40 ARG N N 15 124.851 0.0000033 . 1 . . . . . 40 ARG N . 52678 1
479 . 1 . 1 41 41 GLU H H 1 8.362146473 0.0003266490285 . 1 . . . . . 41 GLU H . 52678 1
480 . 1 . 1 41 41 GLU HA H 1 4.247312251 0.009382616016 . 1 . . . . . 41 GLU HA . 52678 1
481 . 1 . 1 41 41 GLU HB2 H 1 1.983023621 0.002863778653 . 2 . . . . . 41 GLU HB2 . 52678 1
482 . 1 . 1 41 41 GLU HB3 H 1 2.063209639 0.001835127034 . 2 . . . . . 41 GLU HB3 . 52678 1
483 . 1 . 1 41 41 GLU HG2 H 1 2.419759652 0.0001730962243 . 2 . . . . . 41 GLU HG2 . 52678 1
484 . 1 . 1 41 41 GLU HG3 H 1 2.45999943 0.002629576687 . 2 . . . . . 41 GLU HG3 . 52678 1
485 . 1 . 1 41 41 GLU C C 13 176.324 0 . 1 . . . . . 41 GLU C . 52678 1
486 . 1 . 1 41 41 GLU CA C 13 56.27760813 0.000002523 . 1 . . . . . 41 GLU CA . 52678 1
487 . 1 . 1 41 41 GLU CB C 13 28.78090827 0.0000015 . 1 . . . . . 41 GLU CB . 52678 1
488 . 1 . 1 41 41 GLU CG C 13 33.287 0.0000013 . 1 . . . . . 41 GLU CG . 52678 1
489 . 1 . 1 41 41 GLU N N 15 121.57 0.0000013 . 1 . . . . . 41 GLU N . 52678 1
490 . 1 . 1 42 42 ARG H H 1 8.354826592 0.00006183 . 1 . . . . . 42 ARG H . 52678 1
491 . 1 . 1 42 42 ARG HA H 1 4.255081268 0.004555213017 . 1 . . . . . 42 ARG HA . 52678 1
492 . 1 . 1 42 42 ARG HB2 H 1 1.776234981 0.000949381976 . 2 . . . . . 42 ARG HB2 . 52678 1
493 . 1 . 1 42 42 ARG HB3 H 1 1.803251589 0.0008960498637 . 2 . . . . . 42 ARG HB3 . 52678 1
494 . 1 . 1 42 42 ARG HG2 H 1 1.579717235 0.002690034459 . 2 . . . . . 42 ARG HG2 . 52678 1
495 . 1 . 1 42 42 ARG HG3 H 1 1.580009629 0.002737173813 . 2 . . . . . 42 ARG HG3 . 52678 1
496 . 1 . 1 42 42 ARG HD2 H 1 3.144757266 0.002198810191 . 1 . . . . . 42 ARG HD2 . 52678 1
497 . 1 . 1 42 42 ARG HD3 H 1 3.145077455 0.002240090406 . 1 . . . . . 42 ARG HD3 . 52678 1
498 . 1 . 1 42 42 ARG C C 13 176.379 0 . 1 . . . . . 42 ARG C . 52678 1
499 . 1 . 1 42 42 ARG CA C 13 56.27750824 0.000002523 . 1 . . . . . 42 ARG CA . 52678 1
500 . 1 . 1 42 42 ARG CB C 13 30.61390837 0.0000013 . 1 . . . . . 42 ARG CB . 52678 1
501 . 1 . 1 42 42 ARG CG C 13 26.9454051 0 . 1 . . . . . 42 ARG CG . 52678 1
502 . 1 . 1 42 42 ARG CD C 13 43.27348999 0.0000026 . 1 . . . . . 42 ARG CD . 52678 1
503 . 1 . 1 42 42 ARG N N 15 122.226 0.00000426 . 1 . . . . . 42 ARG N . 52678 1
504 . 1 . 1 43 43 SER H H 1 8.307200037 0.000051 . 1 . . . . . 43 SER H . 52678 1
505 . 1 . 1 43 43 SER HA H 1 4.403607189 0.00267131994 . 1 . . . . . 43 SER HA . 52678 1
506 . 1 . 1 43 43 SER HB2 H 1 3.823615868 0.0006062953996 . 1 . . . . . 43 SER HB2 . 52678 1
507 . 1 . 1 43 43 SER HB3 H 1 3.823892357 0.0005972739603 . 1 . . . . . 43 SER HB3 . 52678 1
508 . 1 . 1 43 43 SER C C 13 174.027 0 . 1 . . . . . 43 SER C . 52678 1
509 . 1 . 1 43 43 SER CA C 13 58.23969936 0.0000030 . 1 . . . . . 43 SER CA . 52678 1
510 . 1 . 1 43 43 SER CB C 13 63.73939958 0.000003568 . 1 . . . . . 43 SER CB . 52678 1
511 . 1 . 1 43 43 SER N N 15 117.3605 0.00000556 . 1 . . . . . 43 SER N . 52678 1
512 . 1 . 1 44 44 LYS H H 1 8.394461935 0.002666970178 . 1 . . . . . 44 LYS H . 52678 1
513 . 1 . 1 44 44 LYS HA H 1 4.538646832 0.003022051514 . 1 . . . . . 44 LYS HA . 52678 1
514 . 1 . 1 44 44 LYS HB2 H 1 1.666009292 0.001419683184 . 2 . . . . . 44 LYS HB2 . 52678 1
515 . 1 . 1 44 44 LYS HB3 H 1 1.743678693 0.002370596728 . 2 . . . . . 44 LYS HB3 . 52678 1
516 . 1 . 1 44 44 LYS HG2 H 1 1.403644402 0.005964041999 . 2 . . . . . 44 LYS HG2 . 52678 1
517 . 1 . 1 44 44 LYS HG3 H 1 1.474705249 0.0007132449564 . 2 . . . . . 44 LYS HG3 . 52678 1
518 . 1 . 1 44 44 LYS HD2 H 1 1.624788764 0.00818487117 . 1 . . . . . 44 LYS HD2 . 52678 1
519 . 1 . 1 44 44 LYS HD3 H 1 1.625112278 0.008245443382 . 1 . . . . . 44 LYS HD3 . 52678 1
520 . 1 . 1 44 44 LYS HE2 H 1 2.952783887 0.001734912923 . 1 . . . . . 44 LYS HE2 . 52678 1
521 . 1 . 1 44 44 LYS HE3 H 1 2.952978313 0.001762080606 . 1 . . . . . 44 LYS HE3 . 52678 1
522 . 1 . 1 44 44 LYS C C 13 174.301 0 . 1 . . . . . 44 LYS C . 52678 1
523 . 1 . 1 44 44 LYS CA C 13 54.43959179 0.000001784 . 1 . . . . . 44 LYS CA . 52678 1
524 . 1 . 1 44 44 LYS CB C 13 32.44860837 0.00000095 . 1 . . . . . 44 LYS CB . 52678 1
525 . 1 . 1 44 44 LYS CG C 13 24.8829374 0.000000674 . 1 . . . . . 44 LYS CG . 52678 1
526 . 1 . 1 44 44 LYS CD C 13 29.23952045 0.00000165 . 1 . . . . . 44 LYS CD . 52678 1
527 . 1 . 1 44 44 LYS CE C 13 41.94540517 0.00000143 . 1 . . . . . 44 LYS CE . 52678 1
528 . 1 . 1 44 44 LYS N N 15 124.633 0.0000019073 . 1 . . . . . 44 LYS N . 52678 1
529 . 1 . 1 45 45 PRO HA H 1 4.399506051 0.001939613116 . 1 . . . . . 45 PRO HA . 52678 1
530 . 1 . 1 45 45 PRO HB2 H 1 1.738083353 0.01215710896 . 2 . . . . . 45 PRO HB2 . 52678 1
531 . 1 . 1 45 45 PRO HB3 H 1 2.251603276 0.008517887939 . 2 . . . . . 45 PRO HB3 . 52678 1
532 . 1 . 1 45 45 PRO HG2 H 1 1.96146289 0.0002346830375 . 2 . . . . . 45 PRO HG2 . 52678 1
533 . 1 . 1 45 45 PRO HG3 H 1 1.968160847 0.0003759529611 . 2 . . . . . 45 PRO HG3 . 52678 1
534 . 1 . 1 45 45 PRO HD2 H 1 3.578886965 0.001977566845 . 2 . . . . . 45 PRO HD2 . 52678 1
535 . 1 . 1 45 45 PRO HD3 H 1 3.824305926 0.0009092146965 . 2 . . . . . 45 PRO HD3 . 52678 1
536 . 1 . 1 45 45 PRO C C 13 176.981 0 . 1 . . . . . 45 PRO C . 52678 1
537 . 1 . 1 45 45 PRO CA C 13 62.82 0.000002023 . 1 . . . . . 45 PRO CA . 52678 1
538 . 1 . 1 45 45 PRO CB C 13 31.98 0.00000095367 . 1 . . . . . 45 PRO CB . 52678 1
539 . 1 . 1 45 45 PRO CG C 13 27.3377 0.0000008259 . 1 . . . . . 45 PRO CG . 52678 1
540 . 1 . 1 45 45 PRO CD C 13 50.38270517 0.00000389725 . 1 . . . . . 45 PRO CD . 52678 1
541 . 1 . 1 46 46 VAL H H 1 8.421034815 0.002899734954 . 1 . . . . . 46 VAL H . 52678 1
542 . 1 . 1 46 46 VAL HA H 1 3.85963051 0.006736523022 . 1 . . . . . 46 VAL HA . 52678 1
543 . 1 . 1 46 46 VAL HB H 1 1.939839683 0.001593618869 . 1 . . . . . 46 VAL HB . 52678 1
544 . 1 . 1 46 46 VAL HG11 H 1 0.8132580384 0.008391094029 . 2 . . . . . 46 VAL HG1# . 52678 1
545 . 1 . 1 46 46 VAL HG12 H 1 0.8132580384 0.008391094029 . 2 . . . . . 46 VAL HG1# . 52678 1
546 . 1 . 1 46 46 VAL HG13 H 1 0.8132580384 0.008391094029 . 2 . . . . . 46 VAL HG1# . 52678 1
547 . 1 . 1 46 46 VAL HG21 H 1 0.9002678459 0.001493552118 . 2 . . . . . 46 VAL HG2# . 52678 1
548 . 1 . 1 46 46 VAL HG22 H 1 0.9002678459 0.001493552118 . 2 . . . . . 46 VAL HG2# . 52678 1
549 . 1 . 1 46 46 VAL HG23 H 1 0.9002678459 0.001493552118 . 2 . . . . . 46 VAL HG2# . 52678 1
550 . 1 . 1 46 46 VAL C C 13 176.379 0 . 1 . . . . . 46 VAL C . 52678 1
551 . 1 . 1 46 46 VAL CA C 13 63.21528326 0.00008198 . 1 . . . . . 46 VAL CA . 52678 1
552 . 1 . 1 46 46 VAL CB C 13 32.4457296 0.002394878063 . 1 . . . . . 46 VAL CB . 52678 1
553 . 1 . 1 46 46 VAL CG1 C 13 20.7909 0.00000101 . 2 . . . . . 46 VAL CG1 . 52678 1
554 . 1 . 1 46 46 VAL CG2 C 13 20.92370847 0.000001039 . 2 . . . . . 46 VAL CG2 . 52678 1
555 . 1 . 1 46 46 VAL N N 15 121.6798134 0.000291500036 . 1 . . . . . 46 VAL N . 52678 1
556 . 1 . 1 47 47 HIS H H 1 8.714636103 0.003674397626 . 1 . . . . . 47 HIS H . 52678 1
557 . 1 . 1 47 47 HIS HA H 1 4.55249514 0.005775986363 . 1 . . . . . 47 HIS HA . 52678 1
558 . 1 . 1 47 47 HIS HB2 H 1 3.139376575 0.001240740061 . 2 . . . . . 47 HIS HB2 . 52678 1
559 . 1 . 1 47 47 HIS HB3 H 1 3.166245107 0.0002073222757 . 2 . . . . . 47 HIS HB3 . 52678 1
560 . 1 . 1 47 47 HIS HD2 H 1 7.262156485 0.01214874795 . 1 . . . . . 47 HIS HD2 . 52678 1
561 . 1 . 1 47 47 HIS C C 13 174.904 0 . 1 . . . . . 47 HIS C . 52678 1
562 . 1 . 1 47 47 HIS CA C 13 55.62062076 0.001696085977 . 1 . . . . . 47 HIS CA . 52678 1
563 . 1 . 1 47 47 HIS CB C 13 28.3862 0.000001066 . 1 . . . . . 47 HIS CB . 52678 1
564 . 1 . 1 47 47 HIS N N 15 120.6944993 0.0000038 . 1 . . . . . 47 HIS N . 52678 1
565 . 1 . 1 48 48 GLU H H 1 8.208450378 0.008314457992 . 1 . . . . . 48 GLU H . 52678 1
566 . 1 . 1 48 48 GLU HA H 1 4.207075083 0.0005663347423 . 1 . . . . . 48 GLU HA . 52678 1
567 . 1 . 1 48 48 GLU HB2 H 1 1.899228217 0.001911349403 . 2 . . . . . 48 GLU HB2 . 52678 1
568 . 1 . 1 48 48 GLU HB3 H 1 1.981777812 0.0001126175898 . 2 . . . . . 48 GLU HB3 . 52678 1
569 . 1 . 1 48 48 GLU HG2 H 1 2.323871607 0.001239709256 . 2 . . . . . 48 GLU HG2 . 52678 1
570 . 1 . 1 48 48 GLU HG3 H 1 2.324477641 0.0009360969195 . 2 . . . . . 48 GLU HG3 . 52678 1
571 . 1 . 1 48 48 GLU C C 13 176.488 0 . 1 . . . . . 48 GLU C . 52678 1
572 . 1 . 1 48 48 GLU CA C 13 56.27389179 0.0000006743 . 1 . . . . . 48 GLU CA . 52678 1
573 . 1 . 1 48 48 GLU CB C 13 28.6486003 0.0000029778 . 1 . . . . . 48 GLU CB . 52678 1
574 . 1 . 1 48 48 GLU CG C 13 32.96990833 0.000001966 . 1 . . . . . 48 GLU CG . 52678 1
575 . 1 . 1 48 48 GLU N N 15 122.3350983 0.000007629 . 1 . . . . . 48 GLU N . 52678 1
576 . 1 . 1 49 49 LEU H H 1 8.275597453 0.003994294887 . 1 . . . . . 49 LEU H . 52678 1
577 . 1 . 1 49 49 LEU HA H 1 3.98989222 0.002531403318 . 1 . . . . . 49 LEU HA . 52678 1
578 . 1 . 1 49 49 LEU HB2 H 1 1.397936765 0.006406337832 . 2 . . . . . 49 LEU HB2 . 52678 1
579 . 1 . 1 49 49 LEU HB3 H 1 1.584373739 0.0006356930277 . 2 . . . . . 49 LEU HB3 . 52678 1
580 . 1 . 1 49 49 LEU HG H 1 1.502715599 0.0001021123661 . 1 . . . . . 49 LEU HG . 52678 1
581 . 1 . 1 49 49 LEU HD11 H 1 0.7592206202 0.003580854827 . 2 . . . . . 49 LEU HD1# . 52678 1
582 . 1 . 1 49 49 LEU HD12 H 1 0.7592206202 0.003580854827 . 2 . . . . . 49 LEU HD1# . 52678 1
583 . 1 . 1 49 49 LEU HD13 H 1 0.7592206202 0.003580854827 . 2 . . . . . 49 LEU HD1# . 52678 1
584 . 1 . 1 49 49 LEU HD21 H 1 0.8115042944 0.000913261622 . 2 . . . . . 49 LEU HD2# . 52678 1
585 . 1 . 1 49 49 LEU HD22 H 1 0.8115042944 0.000913261622 . 2 . . . . . 49 LEU HD2# . 52678 1
586 . 1 . 1 49 49 LEU HD23 H 1 0.8115042944 0.000913261622 . 2 . . . . . 49 LEU HD2# . 52678 1
587 . 1 . 1 49 49 LEU C C 13 178.294 0 . 1 . . . . . 49 LEU C . 52678 1
588 . 1 . 1 49 49 LEU CA C 13 56.40670931 0.00000436976 . 1 . . . . . 49 LEU CA . 52678 1
589 . 1 . 1 49 49 LEU CB C 13 41.62 0.000002336 . 1 . . . . . 49 LEU CB . 52678 1
590 . 1 . 1 49 49 LEU CG C 13 26.90931859 0.0000004768 . 1 . . . . . 49 LEU CG . 52678 1
591 . 1 . 1 49 49 LEU CD1 C 13 23.32021178 0.0000008259 . 2 . . . . . 49 LEU CD1 . 52678 1
592 . 1 . 1 49 49 LEU CD2 C 13 25.04651012 0.000000584 . 2 . . . . . 49 LEU CD2 . 52678 1
593 . 1 . 1 49 49 LEU N N 15 123.1006662 0.0000479 . 1 . . . . . 49 LEU N . 52678 1
594 . 1 . 1 50 50 ASN H H 1 8.275496972 0.005668404639 . 1 . . . . . 50 ASN H . 52678 1
595 . 1 . 1 50 50 ASN HA H 1 4.144580886 0.005865358209 . 1 . . . . . 50 ASN HA . 52678 1
596 . 1 . 1 50 50 ASN HB2 H 1 2.097055121 0.007942626044 . 2 . . . . . 50 ASN HB2 . 52678 1
597 . 1 . 1 50 50 ASN HB3 H 1 2.379294896 0.00356509899 . 2 . . . . . 50 ASN HB3 . 52678 1
598 . 1 . 1 50 50 ASN HD21 H 1 7.023584525 0.00001176 . 1 . . . . . 50 ASN HD21 . 52678 1
599 . 1 . 1 50 50 ASN C C 13 176.324 0 . 1 . . . . . 50 ASN C . 52678 1
600 . 1 . 1 50 50 ASN CA C 13 54.57339624 0.000013 . 1 . . . . . 50 ASN CA . 52678 1
601 . 1 . 1 50 50 ASN CB C 13 36.7661 0.00000095 . 1 . . . . . 50 ASN CB . 52678 1
602 . 1 . 1 50 50 ASN N N 15 119.4913305 0.0000033 . 1 . . . . . 50 ASN N . 52678 1
603 . 1 . 1 51 51 ARG H H 1 7.841755171 0.001299901454 . 1 . . . . . 51 ARG H . 52678 1
604 . 1 . 1 51 51 ARG HA H 1 3.797131802 0.004333330386 . 1 . . . . . 51 ARG HA . 52678 1
605 . 1 . 1 51 51 ARG HB2 H 1 1.439943572 0.002499958529 . 2 . . . . . 51 ARG HB2 . 52678 1
606 . 1 . 1 51 51 ARG HB3 H 1 1.549128461 0.004201263233 . 2 . . . . . 51 ARG HB3 . 52678 1
607 . 1 . 1 51 51 ARG HG2 H 1 0.9002453809 0.0000343 . 2 . . . . . 51 ARG HG2 . 52678 1
608 . 1 . 1 51 51 ARG HG3 H 1 0.9007955864 0.00184435706 . 2 . . . . . 51 ARG HG3 . 52678 1
609 . 1 . 1 51 51 ARG HD2 H 1 2.588343011 0.007998666217 . 2 . . . . . 51 ARG HD2 . 52678 1
610 . 1 . 1 51 51 ARG HD3 H 1 2.663073574 0.004718936676 . 2 . . . . . 51 ARG HD3 . 52678 1
611 . 1 . 1 51 51 ARG C C 13 177.473 0 . 1 . . . . . 51 ARG C . 52678 1
612 . 1 . 1 51 51 ARG CA C 13 59.02540367 0.000011 . 1 . . . . . 51 ARG CA . 52678 1
613 . 1 . 1 51 51 ARG CB C 13 29.56219947 0.03214781227 . 1 . . . . . 51 ARG CB . 52678 1
614 . 1 . 1 51 51 ARG CG C 13 26.4301 0.0000004768 . 1 . . . . . 51 ARG CG . 52678 1
615 . 1 . 1 51 51 ARG N N 15 121.5695 0.000004046 . 1 . . . . . 51 ARG N . 52678 1
616 . 1 . 1 52 52 GLU H H 1 7.890323034 0.002311244086 . 1 . . . . . 52 GLU H . 52678 1
617 . 1 . 1 52 52 GLU HA H 1 3.936193938 0.00300457257 . 1 . . . . . 52 GLU HA . 52678 1
618 . 1 . 1 52 52 GLU HB2 H 1 2.022155975 0.0009337783375 . 2 . . . . . 52 GLU HB2 . 52678 1
619 . 1 . 1 52 52 GLU HB3 H 1 2.028765491 0.00270332661 . 2 . . . . . 52 GLU HB3 . 52678 1
620 . 1 . 1 52 52 GLU HG2 H 1 2.406428769 0.002418966359 . 2 . . . . . 52 GLU HG2 . 52678 1
621 . 1 . 1 52 52 GLU HG3 H 1 2.486344539 0.004377835242 . 2 . . . . . 52 GLU HG3 . 52678 1
622 . 1 . 1 52 52 GLU C C 13 177.801 0 . 1 . . . . . 52 GLU C . 52678 1
623 . 1 . 1 52 52 GLU CA C 13 59.02539765 0.00001295 . 1 . . . . . 52 GLU CA . 52678 1
624 . 1 . 1 52 52 GLU CB C 13 28.12429927 0.000004498 . 1 . . . . . 52 GLU CB . 52678 1
625 . 1 . 1 52 52 GLU CG C 13 33.761 0.00000095 . 1 . . . . . 52 GLU CG . 52678 1
626 . 1 . 1 52 52 GLU N N 15 118.397796 0.000013 . 1 . . . . . 52 GLU N . 52678 1
627 . 1 . 1 53 53 ALA H H 1 8.033370228 0.001634987023 . 1 . . . . . 53 ALA H . 52678 1
628 . 1 . 1 53 53 ALA HA H 1 4.070514191 0.0007448244015 . 1 . . . . . 53 ALA HA . 52678 1
629 . 1 . 1 53 53 ALA HB1 H 1 1.227616867 0.002349466716 . 1 . . . . . 53 ALA HB# . 52678 1
630 . 1 . 1 53 53 ALA HB2 H 1 1.227616867 0.002349466716 . 1 . . . . . 53 ALA HB# . 52678 1
631 . 1 . 1 53 53 ALA HB3 H 1 1.227616867 0.002349466716 . 1 . . . . . 53 ALA HB# . 52678 1
632 . 1 . 1 53 53 ALA C C 13 180.481 0 . 1 . . . . . 53 ALA C . 52678 1
633 . 1 . 1 53 53 ALA CA C 13 54.83530336 0.00001068 . 1 . . . . . 53 ALA CA . 52678 1
634 . 1 . 1 53 53 ALA CB C 13 17.64949993 0.000000674 . 1 . . . . . 53 ALA CB . 52678 1
635 . 1 . 1 53 53 ALA N N 15 120.5828 0.00000486 . 1 . . . . . 53 ALA N . 52678 1
636 . 1 . 1 54 54 CYS H H 1 8.076443903 0.008260460974 . 1 . . . . . 54 CYS H . 52678 1
637 . 1 . 1 54 54 CYS HA H 1 4.775925811 0.008979457436 . 1 . . . . . 54 CYS HA . 52678 1
638 . 1 . 1 54 54 CYS HB2 H 1 3.276056346 0.0007905590725 . 2 . . . . . 54 CYS HB2 . 52678 1
639 . 1 . 1 54 54 CYS HB3 H 1 3.282008691 0.001216820606 . 2 . . . . . 54 CYS HB3 . 52678 1
640 . 1 . 1 54 54 CYS C C 13 175.668 0 . 1 . . . . . 54 CYS C . 52678 1
641 . 1 . 1 54 54 CYS CA C 13 57.97790209 0.000004768 . 1 . . . . . 54 CYS CA . 52678 1
642 . 1 . 1 54 54 CYS CB C 13 41.21679943 0.0000029394 . 1 . . . . . 54 CYS CB . 52678 1
643 . 1 . 1 54 54 CYS N N 15 115.225 0.000002697 . 1 . . . . . 54 CYS N . 52678 1
644 . 1 . 1 55 55 ASP H H 1 8.67670249 0.005351212828 . 1 . . . . . 55 ASP H . 52678 1
645 . 1 . 1 55 55 ASP HA H 1 4.517046579 0.009739011177 . 1 . . . . . 55 ASP HA . 52678 1
646 . 1 . 1 55 55 ASP HB2 H 1 2.803285097 0.00007426 . 2 . . . . . 55 ASP HB2 . 52678 1
647 . 1 . 1 55 55 ASP HB3 H 1 2.810533828 0.001079259873 . 2 . . . . . 55 ASP HB3 . 52678 1
648 . 1 . 1 55 55 ASP C C 13 176.434 0 . 1 . . . . . 55 ASP C . 52678 1
649 . 1 . 1 55 55 ASP CA C 13 55.88330229 0.0000083139 . 1 . . . . . 55 ASP CA . 52678 1
650 . 1 . 1 55 55 ASP CB C 13 38.21 0.0000008259 . 1 . . . . . 55 ASP CB . 52678 1
651 . 1 . 1 55 55 ASP N N 15 116.7538537 0.01673693323 . 1 . . . . . 55 ASP N . 52678 1
652 . 1 . 1 56 56 ASP H H 1 7.753478546 0.005611577013 . 1 . . . . . 56 ASP H . 52678 1
653 . 1 . 1 56 56 ASP HA H 1 4.70375533 0.00318956743 . 1 . . . . . 56 ASP HA . 52678 1
654 . 1 . 1 56 56 ASP HB2 H 1 2.921418446 0.01084300447 . 2 . . . . . 56 ASP HB2 . 52678 1
655 . 1 . 1 56 56 ASP HB3 H 1 3.045751509 0.006278313669 . 2 . . . . . 56 ASP HB3 . 52678 1
656 . 1 . 1 56 56 ASP C C 13 173.972 0 . 1 . . . . . 56 ASP C . 52678 1
657 . 1 . 1 56 56 ASP CA C 13 53.52610141 0.0000049554 . 1 . . . . . 56 ASP CA . 52678 1
658 . 1 . 1 56 56 ASP CB C 13 38.5989 0.00000095 . 1 . . . . . 56 ASP CB . 52678 1
659 . 1 . 1 56 56 ASP N N 15 116.21 0.0000038 . 1 . . . . . 56 ASP N . 52678 1
660 . 1 . 1 57 57 TYR H H 1 8.000688349 0.003572933906 . 1 . . . . . 57 TYR H . 52678 1
661 . 1 . 1 57 57 TYR HA H 1 5.194453381 0.003414062926 . 1 . . . . . 57 TYR HA . 52678 1
662 . 1 . 1 57 57 TYR HB2 H 1 3.141627586 0.002020100268 . 2 . . . . . 57 TYR HB2 . 52678 1
663 . 1 . 1 57 57 TYR HB3 H 1 3.304755251 0.001764238315 . 2 . . . . . 57 TYR HB3 . 52678 1
664 . 1 . 1 57 57 TYR HD1 H 1 7.039967838 0.006840856212 . 1 . . . . . 57 TYR HD# . 52678 1
665 . 1 . 1 57 57 TYR HD2 H 1 7.039967838 0.006840856212 . 1 . . . . . 57 TYR HD# . 52678 1
666 . 1 . 1 57 57 TYR HE1 H 1 6.75246426 0.001315307774 . 1 . . . . . 57 TYR HE# . 52678 1
667 . 1 . 1 57 57 TYR HE2 H 1 6.75246426 0.001315307774 . 1 . . . . . 57 TYR HE# . 52678 1
668 . 1 . 1 57 57 TYR C C 13 174.902 0 . 1 . . . . . 57 TYR C . 52678 1
669 . 1 . 1 57 57 TYR CA C 13 54.04978814 0.00001676 . 1 . . . . . 57 TYR CA . 52678 1
670 . 1 . 1 57 57 TYR CB C 13 38.8613 0.00000158 . 1 . . . . . 57 TYR CB . 52678 1
671 . 1 . 1 57 57 TYR CD1 C 13 131.8391723 0.00000467 . 1 . . . . . 57 TYR CD# . 52678 1
672 . 1 . 1 57 57 TYR CD2 C 13 131.8391723 0.00000467 . 1 . . . . . 57 TYR CD# . 52678 1
673 . 1 . 1 57 57 TYR CE1 C 13 118.3897035 0.0000019 . 1 . . . . . 57 TYR CE# . 52678 1
674 . 1 . 1 57 57 TYR CE2 C 13 118.3897035 0.0000019 . 1 . . . . . 57 TYR CE# . 52678 1
675 . 1 . 1 57 57 TYR N N 15 123.15 0.000005046 . 1 . . . . . 57 TYR N . 52678 1
676 . 1 . 1 58 58 ARG H H 1 9.070679648 0.009559386294 . 1 . . . . . 58 ARG H . 52678 1
677 . 1 . 1 58 58 ARG HA H 1 4.016770074 0.002317201516 . 1 . . . . . 58 ARG HA . 52678 1
678 . 1 . 1 58 58 ARG HB2 H 1 1.755556815 0.001744049721 . 2 . . . . . 58 ARG HB2 . 52678 1
679 . 1 . 1 58 58 ARG HB3 H 1 1.857929461 0.0007944768376 . 2 . . . . . 58 ARG HB3 . 52678 1
680 . 1 . 1 58 58 ARG HG2 H 1 1.585387363 0.01477308952 . 2 . . . . . 58 ARG HG2 . 52678 1
681 . 1 . 1 58 58 ARG HG3 H 1 1.620135916 0.01503417443 . 2 . . . . . 58 ARG HG3 . 52678 1
682 . 1 . 1 58 58 ARG HD2 H 1 3.199252565 0.001700267666 . 1 . . . . . 58 ARG HD2 . 52678 1
683 . 1 . 1 58 58 ARG HD3 H 1 3.199338942 0.001816996947 . 1 . . . . . 58 ARG HD3 . 52678 1
684 . 1 . 1 58 58 ARG C C 13 177.145 0 . 1 . . . . . 58 ARG C . 52678 1
685 . 1 . 1 58 58 ARG CA C 13 60.46280826 0.000001168 . 1 . . . . . 58 ARG CA . 52678 1
686 . 1 . 1 58 58 ARG CB C 13 29.48280834 0.00000168587 . 1 . . . . . 58 ARG CB . 52678 1
687 . 1 . 1 58 58 ARG CG C 13 26.81541694 0.0000016518 . 1 . . . . . 58 ARG CG . 52678 1
688 . 1 . 1 58 58 ARG CD C 13 42.91679153 0.00000178416 . 1 . . . . . 58 ARG CD . 52678 1
689 . 1 . 1 58 58 ARG N N 15 129.772 0.000001907 . 1 . . . . . 58 ARG N . 52678 1
690 . 1 . 1 59 59 LEU H H 1 7.102238292 0.003186427598 . 1 . . . . . 59 LEU H . 52678 1
691 . 1 . 1 59 59 LEU HA H 1 3.746893935 0.009588089649 . 1 . . . . . 59 LEU HA . 52678 1
692 . 1 . 1 59 59 LEU HB2 H 1 0.7633738269 0.002806809474 . 2 . . . . . 59 LEU HB2 . 52678 1
693 . 1 . 1 59 59 LEU HB3 H 1 0.9850381338 0.005795600013 . 2 . . . . . 59 LEU HB3 . 52678 1
694 . 1 . 1 59 59 LEU HG H 1 1.42020469 0.001469865394 . 1 . . . . . 59 LEU HG . 52678 1
695 . 1 . 1 59 59 LEU HD11 H 1 0.7912571206 0.001787091205 . 2 . . . . . 59 LEU HD1# . 52678 1
696 . 1 . 1 59 59 LEU HD12 H 1 0.7912571206 0.001787091205 . 2 . . . . . 59 LEU HD1# . 52678 1
697 . 1 . 1 59 59 LEU HD13 H 1 0.7912571206 0.001787091205 . 2 . . . . . 59 LEU HD1# . 52678 1
698 . 1 . 1 59 59 LEU HD21 H 1 0.8800875409 0.004349624292 . 2 . . . . . 59 LEU HD2# . 52678 1
699 . 1 . 1 59 59 LEU HD22 H 1 0.8800875409 0.004349624292 . 2 . . . . . 59 LEU HD2# . 52678 1
700 . 1 . 1 59 59 LEU HD23 H 1 0.8800875409 0.004349624292 . 2 . . . . . 59 LEU HD2# . 52678 1
701 . 1 . 1 59 59 LEU C C 13 179.114 0 . 1 . . . . . 59 LEU C . 52678 1
702 . 1 . 1 59 59 LEU CA C 13 57.97689869 0.00000599 . 1 . . . . . 59 LEU CA . 52678 1
703 . 1 . 1 59 59 LEU CB C 13 41.08790829 0.000001966 . 1 . . . . . 59 LEU CB . 52678 1
704 . 1 . 1 59 59 LEU CG C 13 26.94289153 0.000000337 . 1 . . . . . 59 LEU CG . 52678 1
705 . 1 . 1 59 59 LEU CD1 C 13 22.99068141 0.000000674 . 2 . . . . . 59 LEU CD1 . 52678 1
706 . 1 . 1 59 59 LEU CD2 C 13 24.85483946 0.00000139 . 2 . . . . . 59 LEU CD2 . 52678 1
707 . 1 . 1 59 59 LEU N N 15 113.6946283 0.0000086 . 1 . . . . . 59 LEU N . 52678 1
708 . 1 . 1 60 60 CYS H H 1 6.854975208 0.003933444895 . 1 . . . . . 60 CYS H . 52678 1
709 . 1 . 1 60 60 CYS HA H 1 3.84689326 0.01025341709 . 1 . . . . . 60 CYS HA . 52678 1
710 . 1 . 1 60 60 CYS HB2 H 1 2.459545585 0.001922520467 . 1 . . . . . 60 CYS HB2 . 52678 1
711 . 1 . 1 60 60 CYS HB3 H 1 2.45971982 0.001925946379 . 1 . . . . . 60 CYS HB3 . 52678 1
712 . 1 . 1 60 60 CYS C C 13 175.558 0 . 1 . . . . . 60 CYS C . 52678 1
713 . 1 . 1 60 60 CYS CA C 13 60.99120693 0.0000033 . 1 . . . . . 60 CYS CA . 52678 1
714 . 1 . 1 60 60 CYS CB C 13 40.04020777 0.0000022868 . 1 . . . . . 60 CYS CB . 52678 1
715 . 1 . 1 60 60 CYS N N 15 117.413 0.000003568 . 1 . . . . . 60 CYS N . 52678 1
716 . 1 . 1 61 61 GLU H H 1 8.172122119 0.004428035407 . 1 . . . . . 61 GLU H . 52678 1
717 . 1 . 1 61 61 GLU HA H 1 3.634019467 0.002843300689 . 1 . . . . . 61 GLU HA . 52678 1
718 . 1 . 1 61 61 GLU HB2 H 1 2.291412566 0.00203186597 . 2 . . . . . 61 GLU HB2 . 52678 1
719 . 1 . 1 61 61 GLU HB3 H 1 2.352217553 0.002627447575 . 2 . . . . . 61 GLU HB3 . 52678 1
720 . 1 . 1 61 61 GLU HG2 H 1 2.445781608 0.01088851611 . 2 . . . . . 61 GLU HG2 . 52678 1
721 . 1 . 1 61 61 GLU HG3 H 1 2.721175708 0.00410827278 . 2 . . . . . 61 GLU HG3 . 52678 1
722 . 1 . 1 61 61 GLU C C 13 178.239 0 . 1 . . . . . 61 GLU C . 52678 1
723 . 1 . 1 61 61 GLU CA C 13 60.2020786 0.00003289 . 1 . . . . . 61 GLU CA . 52678 1
724 . 1 . 1 61 61 GLU CB C 13 27.72527565 0.0000051 . 1 . . . . . 61 GLU CB . 52678 1
725 . 1 . 1 61 61 GLU CG C 13 32.95231664 0.000001966 . 1 . . . . . 61 GLU CG . 52678 1
726 . 1 . 1 61 61 GLU N N 15 123.538 0.00000467 . 1 . . . . . 61 GLU N . 52678 1
727 . 1 . 1 62 62 ARG H H 1 8.280789378 0.001692389971 . 1 . . . . . 62 ARG H . 52678 1
728 . 1 . 1 62 62 ARG HA H 1 3.927413357 0.006516557706 . 1 . . . . . 62 ARG HA . 52678 1
729 . 1 . 1 62 62 ARG HB2 H 1 1.826299555 0.002534216038 . 2 . . . . . 62 ARG HB2 . 52678 1
730 . 1 . 1 62 62 ARG HB3 H 1 1.837187453 0.002457686555 . 2 . . . . . 62 ARG HB3 . 52678 1
731 . 1 . 1 62 62 ARG HG2 H 1 1.715343322 0.001470954731 . 2 . . . . . 62 ARG HG2 . 52678 1
732 . 1 . 1 62 62 ARG HG3 H 1 1.80342615 0.001322228792 . 2 . . . . . 62 ARG HG3 . 52678 1
733 . 1 . 1 62 62 ARG HD2 H 1 3.132366333 0.002181268307 . 1 . . . . . 62 ARG HD2 . 52678 1
734 . 1 . 1 62 62 ARG HD3 H 1 3.132559669 0.002215243527 . 1 . . . . . 62 ARG HD3 . 52678 1
735 . 1 . 1 62 62 ARG C C 13 179.168 0 . 1 . . . . . 62 ARG C . 52678 1
736 . 1 . 1 62 62 ARG CA C 13 58.74119838 0.000002023 . 1 . . . . . 62 ARG CA . 52678 1
737 . 1 . 1 62 62 ARG CB C 13 29.95739383 0.00004406 . 1 . . . . . 62 ARG CB . 52678 1
738 . 1 . 1 62 62 ARG CG C 13 27.07580018 0.000000584 . 1 . . . . . 62 ARG CG . 52678 1
739 . 1 . 1 62 62 ARG CD C 13 43.20260723 0.00000243 . 1 . . . . . 62 ARG CD . 52678 1
740 . 1 . 1 62 62 ARG N N 15 115.992 0.000005722 . 1 . . . . . 62 ARG N . 52678 1
741 . 1 . 1 63 63 TYR H H 1 7.5583696 0.00495614293 . 1 . . . . . 63 TYR H . 52678 1
742 . 1 . 1 63 63 TYR HA H 1 4.293043517 0.002896971952 . 1 . . . . . 63 TYR HA . 52678 1
743 . 1 . 1 63 63 TYR HB2 H 1 3.309174915 0.005221127973 . 2 . . . . . 63 TYR HB2 . 52678 1
744 . 1 . 1 63 63 TYR HB3 H 1 3.577152926 0.002593089323 . 2 . . . . . 63 TYR HB3 . 52678 1
745 . 1 . 1 63 63 TYR HD1 H 1 7.071144389 0.007076159787 . 1 . . . . . 63 TYR HD# . 52678 1
746 . 1 . 1 63 63 TYR HD2 H 1 7.071144389 0.007076159787 . 1 . . . . . 63 TYR HD# . 52678 1
747 . 1 . 1 63 63 TYR HE1 H 1 6.408037056 0.008356292417 . 1 . . . . . 63 TYR HE# . 52678 1
748 . 1 . 1 63 63 TYR HE2 H 1 6.408037056 0.008356292417 . 1 . . . . . 63 TYR HE# . 52678 1
749 . 1 . 1 63 63 TYR C C 13 178.567 0 . 1 . . . . . 63 TYR C . 52678 1
750 . 1 . 1 63 63 TYR CA C 13 61.90610061 0.000001784 . 1 . . . . . 63 TYR CA . 52678 1
751 . 1 . 1 63 63 TYR CB C 13 39.51960875 0.00000316 . 1 . . . . . 63 TYR CB . 52678 1
752 . 1 . 1 63 63 TYR CD1 C 13 132.932625 0 . 1 . . . . . 63 TYR CD# . 52678 1
753 . 1 . 1 63 63 TYR CD2 C 13 132.932625 0 . 1 . . . . . 63 TYR CD# . 52678 1
754 . 1 . 1 63 63 TYR CE1 C 13 118.3897035 0 . 1 . . . . . 63 TYR CE# . 52678 1
755 . 1 . 1 63 63 TYR CE2 C 13 118.3897035 0 . 1 . . . . . 63 TYR CE# . 52678 1
756 . 1 . 1 63 63 TYR N N 15 122.335 0.000003568 . 1 . . . . . 63 TYR N . 52678 1
757 . 1 . 1 64 64 ALA H H 1 9.00085534 0.006285693993 . 1 . . . . . 64 ALA H . 52678 1
758 . 1 . 1 64 64 ALA HA H 1 3.694634761 0.006802614536 . 1 . . . . . 64 ALA HA . 52678 1
759 . 1 . 1 64 64 ALA HB1 H 1 0.5404126675 0.009439105881 . 1 . . . . . 64 ALA HB# . 52678 1
760 . 1 . 1 64 64 ALA HB2 H 1 0.5404126675 0.009439105881 . 1 . . . . . 64 ALA HB# . 52678 1
761 . 1 . 1 64 64 ALA HB3 H 1 0.5404126675 0.009439105881 . 1 . . . . . 64 ALA HB# . 52678 1
762 . 1 . 1 64 64 ALA C C 13 180.371 0 . 1 . . . . . 64 ALA C . 52678 1
763 . 1 . 1 64 64 ALA CA C 13 53.64589764 0.000009246 . 1 . . . . . 64 ALA CA . 52678 1
764 . 1 . 1 64 64 ALA CB C 13 17.01539869 0.000007192 . 1 . . . . . 64 ALA CB . 52678 1
765 . 1 . 1 64 64 ALA N N 15 121.71 0.00000426 . 1 . . . . . 64 ALA N . 52678 1
766 . 1 . 1 65 65 MET H H 1 7.565261542 0.00455700834 . 1 . . . . . 65 MET H . 52678 1
767 . 1 . 1 65 65 MET HA H 1 4.102656835 0.003881022769 . 1 . . . . . 65 MET HA . 52678 1
768 . 1 . 1 65 65 MET HB2 H 1 2.064476785 0.002184115256 . 2 . . . . . 65 MET HB2 . 52678 1
769 . 1 . 1 65 65 MET HB3 H 1 2.103464316 0.005244124352 . 2 . . . . . 65 MET HB3 . 52678 1
770 . 1 . 1 65 65 MET HG2 H 1 2.652323759 0.001009168132 . 2 . . . . . 65 MET HG2 . 52678 1
771 . 1 . 1 65 65 MET HG3 H 1 2.789258087 0.001725377459 . 2 . . . . . 65 MET HG3 . 52678 1
772 . 1 . 1 65 65 MET C C 13 176.488 0 . 1 . . . . . 65 MET C . 52678 1
773 . 1 . 1 65 65 MET CA C 13 57.58690797 0.00000278 . 1 . . . . . 65 MET CA . 52678 1
774 . 1 . 1 65 65 MET CB C 13 32.72685258 0.00000907 . 1 . . . . . 65 MET CB . 52678 1
775 . 1 . 1 65 65 MET CG C 13 31.92966013 0.000005946 . 1 . . . . . 65 MET CG . 52678 1
776 . 1 . 1 65 65 MET N N 15 116.21 0.000004046 . 1 . . . . . 65 MET N . 52678 1
777 . 1 . 1 66 66 VAL H H 1 6.931092546 0.007841933835 . 1 . . . . . 66 VAL H . 52678 1
778 . 1 . 1 66 66 VAL HA H 1 3.713376041 0.003070944958 . 1 . . . . . 66 VAL HA . 52678 1
779 . 1 . 1 66 66 VAL HB H 1 1.37307242 0.004997243499 . 1 . . . . . 66 VAL HB . 52678 1
780 . 1 . 1 66 66 VAL HG11 H 1 -0.1072666342 0.003954277108 . 2 . . . . . 66 VAL HG1# . 52678 1
781 . 1 . 1 66 66 VAL HG12 H 1 -0.1072666342 0.003954277108 . 2 . . . . . 66 VAL HG1# . 52678 1
782 . 1 . 1 66 66 VAL HG13 H 1 -0.1072666342 0.003954277108 . 2 . . . . . 66 VAL HG1# . 52678 1
783 . 1 . 1 66 66 VAL HG21 H 1 0.7408518954 0.003278216876 . 2 . . . . . 66 VAL HG2# . 52678 1
784 . 1 . 1 66 66 VAL HG22 H 1 0.7408518954 0.003278216876 . 2 . . . . . 66 VAL HG2# . 52678 1
785 . 1 . 1 66 66 VAL HG23 H 1 0.7408518954 0.003278216876 . 2 . . . . . 66 VAL HG2# . 52678 1
786 . 1 . 1 66 66 VAL C C 13 177.199 0 . 1 . . . . . 66 VAL C . 52678 1
787 . 1 . 1 66 66 VAL CA C 13 64.12929193 0.00000213 . 1 . . . . . 66 VAL CA . 52678 1
788 . 1 . 1 66 66 VAL CB C 13 33.65651012 0.0000013 . 1 . . . . . 66 VAL CB . 52678 1
789 . 1 . 1 66 66 VAL CG1 C 13 20.34383058 0.000000584 . 2 . . . . . 66 VAL CG1 . 52678 1
790 . 1 . 1 66 66 VAL CG2 C 13 21.40629835 0.000000584 . 2 . . . . . 66 VAL CG2 . 52678 1
791 . 1 . 1 66 66 VAL N N 15 117.085 0.000001907 . 1 . . . . . 66 VAL N . 52678 1
792 . 1 . 1 67 67 TYR H H 1 8.150843996 0.006491516149 . 1 . . . . . 67 TYR H . 52678 1
793 . 1 . 1 67 67 TYR HA H 1 4.426001781 0.0003925507558 . 1 . . . . . 67 TYR HA . 52678 1
794 . 1 . 1 67 67 TYR HB2 H 1 2.14738142 0.01343158244 . 2 . . . . . 67 TYR HB2 . 52678 1
795 . 1 . 1 67 67 TYR HB3 H 1 3.089507987 0.003277488137 . 2 . . . . . 67 TYR HB3 . 52678 1
796 . 1 . 1 67 67 TYR HD1 H 1 6.364987676 0.003639272995 . 1 . . . . . 67 TYR HD# . 52678 1
797 . 1 . 1 67 67 TYR HD2 H 1 6.364987676 0.003639272995 . 1 . . . . . 67 TYR HD# . 52678 1
798 . 1 . 1 67 67 TYR HE1 H 1 6.509626697 0.004680519426 . 1 . . . . . 67 TYR HE# . 52678 1
799 . 1 . 1 67 67 TYR HE2 H 1 6.509626697 0.004680519426 . 1 . . . . . 67 TYR HE# . 52678 1
800 . 1 . 1 67 67 TYR C C 13 176.488 0 . 1 . . . . . 67 TYR C . 52678 1
801 . 1 . 1 67 67 TYR CA C 13 58.7635983 0.0000068 . 1 . . . . . 67 TYR CA . 52678 1
802 . 1 . 1 67 67 TYR CB C 13 40.17019981 0.000001168 . 1 . . . . . 67 TYR CB . 52678 1
803 . 1 . 1 67 67 TYR CD1 C 13 133.2606608 0.0000033 . 1 . . . . . 67 TYR CD# . 52678 1
804 . 1 . 1 67 67 TYR CD2 C 13 133.2606608 0.0000033 . 1 . . . . . 67 TYR CD# . 52678 1
805 . 1 . 1 67 67 TYR CE1 C 13 117.8429771 0.000002336 . 1 . . . . . 67 TYR CE# . 52678 1
806 . 1 . 1 67 67 TYR CE2 C 13 117.8429771 0.000002336 . 1 . . . . . 67 TYR CE# . 52678 1
807 . 1 . 1 67 67 TYR N N 15 115.4449609 0.0000794 . 1 . . . . . 67 TYR N . 52678 1
808 . 1 . 1 68 68 GLY H H 1 7.923563896 0.003226010551 . 1 . . . . . 68 GLY H . 52678 1
809 . 1 . 1 68 68 GLY HA2 H 1 3.915180054 0.004659412287 . 2 . . . . . 68 GLY HA2 . 52678 1
810 . 1 . 1 68 68 GLY HA3 H 1 4.585434962 0.003910914665 . 2 . . . . . 68 GLY HA3 . 52678 1
811 . 1 . 1 68 68 GLY C C 13 173.863 0 . 1 . . . . . 68 GLY C . 52678 1
812 . 1 . 1 68 68 GLY CA C 13 44.36040095 0.00000457 . 1 . . . . . 68 GLY CA . 52678 1
813 . 1 . 1 68 68 GLY N N 15 110.195 0.000003568 . 1 . . . . . 68 GLY N . 52678 1
814 . 1 . 1 69 69 TYR H H 1 8.841925035 0.008361701023 . 1 . . . . . 69 TYR H . 52678 1
815 . 1 . 1 69 69 TYR HA H 1 3.988636788 0.001746301519 . 1 . . . . . 69 TYR HA . 52678 1
816 . 1 . 1 69 69 TYR HB2 H 1 2.844397634 0.0001000978158 . 2 . . . . . 69 TYR HB2 . 52678 1
817 . 1 . 1 69 69 TYR HB3 H 1 2.905986568 0.0000332 . 2 . . . . . 69 TYR HB3 . 52678 1
818 . 1 . 1 69 69 TYR HD1 H 1 7.113318176 0.005162732844 . 1 . . . . . 69 TYR HD# . 52678 1
819 . 1 . 1 69 69 TYR HD2 H 1 7.113318176 0.005162732844 . 1 . . . . . 69 TYR HD# . 52678 1
820 . 1 . 1 69 69 TYR HE1 H 1 6.693649489 0.001955962672 . 1 . . . . . 69 TYR HE# . 52678 1
821 . 1 . 1 69 69 TYR HE2 H 1 6.693649489 0.001955962672 . 1 . . . . . 69 TYR HE# . 52678 1
822 . 1 . 1 69 69 TYR C C 13 177.801 0 . 1 . . . . . 69 TYR C . 52678 1
823 . 1 . 1 69 69 TYR CA C 13 63.73930099 0.00000535 . 1 . . . . . 69 TYR CA . 52678 1
824 . 1 . 1 69 69 TYR CB C 13 38.33750138 0.000006777 . 1 . . . . . 69 TYR CB . 52678 1
825 . 1 . 1 69 69 TYR CD1 C 13 132.4952439 0.0000019 . 1 . . . . . 69 TYR CD# . 52678 1
826 . 1 . 1 69 69 TYR CD2 C 13 132.4952439 0.0000019 . 1 . . . . . 69 TYR CD# . 52678 1
827 . 1 . 1 69 69 TYR CE1 C 13 118.171013 0.0000033 . 1 . . . . . 69 TYR CE# . 52678 1
828 . 1 . 1 69 69 TYR CE2 C 13 118.171013 0.0000033 . 1 . . . . . 69 TYR CE# . 52678 1
829 . 1 . 1 69 69 TYR N N 15 118.7259842 0.0000365 . 1 . . . . . 69 TYR N . 52678 1
830 . 1 . 1 70 70 ASN H H 1 8.883796489 0.002840728961 . 1 . . . . . 70 ASN H . 52678 1
831 . 1 . 1 70 70 ASN HA H 1 4.479939193 0.004288007252 . 1 . . . . . 70 ASN HA . 52678 1
832 . 1 . 1 70 70 ASN HB2 H 1 2.804948406 0.0041533273 . 1 . . . . . 70 ASN HB2 . 52678 1
833 . 1 . 1 70 70 ASN HB3 H 1 2.805154471 0.004077090739 . 1 . . . . . 70 ASN HB3 . 52678 1
834 . 1 . 1 70 70 ASN HD21 H 1 7.1329 0 . 1 . . . . . 70 ASN HD21 . 52678 1
835 . 1 . 1 70 70 ASN HD22 H 1 7.843661325 0.0000011588 . 1 . . . . . 70 ASN HD22 . 52678 1
836 . 1 . 1 70 70 ASN C C 13 177.746 0 . 1 . . . . . 70 ASN C . 52678 1
837 . 1 . 1 70 70 ASN CA C 13 57.33340079 0.000003932 . 1 . . . . . 70 ASN CA . 52678 1
838 . 1 . 1 70 70 ASN CB C 13 37.81369927 0.000005478 . 1 . . . . . 70 ASN CB . 52678 1
839 . 1 . 1 70 70 ASN N N 15 119.88 0.000004473 . 1 . . . . . 70 ASN N . 52678 1
840 . 1 . 1 71 71 ALA H H 1 8.834283944 0.003745888609 . 1 . . . . . 71 ALA H . 52678 1
841 . 1 . 1 71 71 ALA HA H 1 4.201644515 0.00335549454 . 1 . . . . . 71 ALA HA . 52678 1
842 . 1 . 1 71 71 ALA HB1 H 1 1.54332089 0.005910019143 . 1 . . . . . 71 ALA HB# . 52678 1
843 . 1 . 1 71 71 ALA HB2 H 1 1.54332089 0.005910019143 . 1 . . . . . 71 ALA HB# . 52678 1
844 . 1 . 1 71 71 ALA HB3 H 1 1.54332089 0.005910019143 . 1 . . . . . 71 ALA HB# . 52678 1
845 . 1 . 1 71 71 ALA C C 13 181.137 0 . 1 . . . . . 71 ALA C . 52678 1
846 . 1 . 1 71 71 ALA CA C 13 54.57240249 0.00000922 . 1 . . . . . 71 ALA CA . 52678 1
847 . 1 . 1 71 71 ALA CB C 13 18.43479913 0.0000058885 . 1 . . . . . 71 ALA CB . 52678 1
848 . 1 . 1 71 71 ALA N N 15 121.8310032 0.000007979 . 1 . . . . . 71 ALA N . 52678 1
849 . 1 . 1 72 72 ALA H H 1 8.103816044 0.006831476387 . 1 . . . . . 72 ALA H . 52678 1
850 . 1 . 1 72 72 ALA HA H 1 4.261733813 0.0004894465411 . 1 . . . . . 72 ALA HA . 52678 1
851 . 1 . 1 72 72 ALA HB1 H 1 1.954534812 0.007341101417 . 1 . . . . . 72 ALA HB# . 52678 1
852 . 1 . 1 72 72 ALA HB2 H 1 1.954534812 0.007341101417 . 1 . . . . . 72 ALA HB# . 52678 1
853 . 1 . 1 72 72 ALA HB3 H 1 1.954534812 0.007341101417 . 1 . . . . . 72 ALA HB# . 52678 1
854 . 1 . 1 72 72 ALA C C 13 178.676 0 . 1 . . . . . 72 ALA C . 52678 1
855 . 1 . 1 72 72 ALA CA C 13 55.88290266 0.0000104 . 1 . . . . . 72 ALA CA . 52678 1
856 . 1 . 1 72 72 ALA CB C 13 19.7452 0.00000063 . 1 . . . . . 72 ALA CB . 52678 1
857 . 1 . 1 72 72 ALA N N 15 121.6 0.000002336 . 1 . . . . . 72 ALA N . 52678 1
858 . 1 . 1 73 73 TYR H H 1 9.259590888 0.004544284072 . 1 . . . . . 73 TYR H . 52678 1
859 . 1 . 1 73 73 TYR HA H 1 4.344689202 0.004576053361 . 1 . . . . . 73 TYR HA . 52678 1
860 . 1 . 1 73 73 TYR HB2 H 1 3.172429613 0.001297779386 . 2 . . . . . 73 TYR HB2 . 52678 1
861 . 1 . 1 73 73 TYR HB3 H 1 3.214110547 0.0000665665 . 2 . . . . . 73 TYR HB3 . 52678 1
862 . 1 . 1 73 73 TYR HD1 H 1 6.970433106 0.002067252911 . 1 . . . . . 73 TYR HD# . 52678 1
863 . 1 . 1 73 73 TYR HD2 H 1 6.970433106 0.002067252911 . 1 . . . . . 73 TYR HD# . 52678 1
864 . 1 . 1 73 73 TYR HE1 H 1 6.42623871 0.00420751173 . 1 . . . . . 73 TYR HE# . 52678 1
865 . 1 . 1 73 73 TYR HE2 H 1 6.42623871 0.00420751173 . 1 . . . . . 73 TYR HE# . 52678 1
866 . 1 . 1 73 73 TYR C C 13 178.457 0 . 1 . . . . . 73 TYR C . 52678 1
867 . 1 . 1 73 73 TYR CA C 13 62.01219864 0.0000063618 . 1 . . . . . 73 TYR CA . 52678 1
868 . 1 . 1 73 73 TYR CB C 13 38.07499846 0.0000083276 . 1 . . . . . 73 TYR CB . 52678 1
869 . 1 . 1 73 73 TYR CD1 C 13 133.0419703 0.0000038 . 1 . . . . . 73 TYR CD# . 52678 1
870 . 1 . 1 73 73 TYR CD2 C 13 133.0419703 0.0000038 . 1 . . . . . 73 TYR CD# . 52678 1
871 . 1 . 1 73 73 TYR CE1 C 13 118.2803582 0 . 1 . . . . . 73 TYR CE# . 52678 1
872 . 1 . 1 73 73 TYR CE2 C 13 118.2803582 0 . 1 . . . . . 73 TYR CE# . 52678 1
873 . 1 . 1 73 73 TYR N N 15 119.7699816 0.0000387 . 1 . . . . . 73 TYR N . 52678 1
874 . 1 . 1 74 74 ASN H H 1 7.994987877 0.006169765527 . 1 . . . . . 74 ASN H . 52678 1
875 . 1 . 1 74 74 ASN HA H 1 4.371252211 0.0004563931582 . 1 . . . . . 74 ASN HA . 52678 1
876 . 1 . 1 74 74 ASN HB2 H 1 2.769130173 0.00003219 . 2 . . . . . 74 ASN HB2 . 52678 1
877 . 1 . 1 74 74 ASN HB3 H 1 2.844852339 0.001710632077 . 2 . . . . . 74 ASN HB3 . 52678 1
878 . 1 . 1 74 74 ASN HD21 H 1 6.968890671 0.000005935 . 1 . . . . . 74 ASN HD21 . 52678 1
879 . 1 . 1 74 74 ASN HD22 H 1 7.652303439 0.000008809 . 1 . . . . . 74 ASN HD22 . 52678 1
880 . 1 . 1 74 74 ASN C C 13 176.105 0 . 1 . . . . . 74 ASN C . 52678 1
881 . 1 . 1 74 74 ASN CA C 13 55.6210984 0.0000066 . 1 . . . . . 74 ASN CA . 52678 1
882 . 1 . 1 74 74 ASN CB C 13 38.07550029 0.0000026 . 1 . . . . . 74 ASN CB . 52678 1
883 . 1 . 1 74 74 ASN N N 15 116.101 0.000002697 . 1 . . . . . 74 ASN N . 52678 1
884 . 1 . 1 75 75 ARG H H 1 7.591543624 0.007635569545 . 1 . . . . . 75 ARG H . 52678 1
885 . 1 . 1 75 75 ARG HA H 1 3.824575465 0.004173322585 . 1 . . . . . 75 ARG HA . 52678 1
886 . 1 . 1 75 75 ARG HB2 H 1 1.255983497 0.0003111205638 . 2 . . . . . 75 ARG HB2 . 52678 1
887 . 1 . 1 75 75 ARG HB3 H 1 1.282909318 0.001531706751 . 2 . . . . . 75 ARG HB3 . 52678 1
888 . 1 . 1 75 75 ARG HG2 H 1 -0.1895754569 0.005550492449 . 2 . . . . . 75 ARG HG2 . 52678 1
889 . 1 . 1 75 75 ARG HG3 H 1 0.5992930901 0.002125335141 . 2 . . . . . 75 ARG HG3 . 52678 1
890 . 1 . 1 75 75 ARG HD2 H 1 1.774812536 0.002642844725 . 2 . . . . . 75 ARG HD2 . 52678 1
891 . 1 . 1 75 75 ARG HD3 H 1 2.257206543 0.003967279748 . 2 . . . . . 75 ARG HD3 . 52678 1
892 . 1 . 1 75 75 ARG C C 13 177.473 0 . 1 . . . . . 75 ARG C . 52678 1
893 . 1 . 1 75 75 ARG CA C 13 57.97810176 0.000008259 . 1 . . . . . 75 ARG CA . 52678 1
894 . 1 . 1 75 75 ARG CB C 13 29.95789936 0.000004708 . 1 . . . . . 75 ARG CB . 52678 1
895 . 1 . 1 75 75 ARG CG C 13 26.16110832 0.00000168587 . 1 . . . . . 75 ARG CG . 52678 1
896 . 1 . 1 75 75 ARG CD C 13 42.60944677 0.00000603 . 1 . . . . . 75 ARG CD . 52678 1
897 . 1 . 1 75 75 ARG N N 15 118.288 0.00000603 . 1 . . . . . 75 ARG N . 52678 1
898 . 1 . 1 76 76 TYR H H 1 7.896613217 0.001743781467 . 1 . . . . . 76 TYR H . 52678 1
899 . 1 . 1 76 76 TYR HA H 1 4.211718114 0.002582430137 . 1 . . . . . 76 TYR HA . 52678 1
900 . 1 . 1 76 76 TYR HB2 H 1 2.350382166 0.001686800225 . 2 . . . . . 76 TYR HB2 . 52678 1
901 . 1 . 1 76 76 TYR HB3 H 1 2.592367071 0.00182075859 . 2 . . . . . 76 TYR HB3 . 52678 1
902 . 1 . 1 76 76 TYR HD1 H 1 7.193032529 0.006338452084 . 1 . . . . . 76 TYR HD# . 52678 1
903 . 1 . 1 76 76 TYR HD2 H 1 7.193032529 0.006338452084 . 1 . . . . . 76 TYR HD# . 52678 1
904 . 1 . 1 76 76 TYR HE1 H 1 6.427004705 0.004653248054 . 1 . . . . . 76 TYR HE# . 52678 1
905 . 1 . 1 76 76 TYR HE2 H 1 6.427004705 0.004653248054 . 1 . . . . . 76 TYR HE# . 52678 1
906 . 1 . 1 76 76 TYR C C 13 175.613 0 . 1 . . . . . 76 TYR C . 52678 1
907 . 1 . 1 76 76 TYR CA C 13 60.85599952 0.00000165 . 1 . . . . . 76 TYR CA . 52678 1
908 . 1 . 1 76 76 TYR CB C 13 39.78060816 0.0000015 . 1 . . . . . 76 TYR CB . 52678 1
909 . 1 . 1 76 76 TYR CD1 C 13 132.8232797 0.0000038 . 1 . . . . . 76 TYR CD# . 52678 1
910 . 1 . 1 76 76 TYR CD2 C 13 132.8232797 0.0000038 . 1 . . . . . 76 TYR CD# . 52678 1
911 . 1 . 1 76 76 TYR CE1 C 13 118.0616677 0.0000019 . 1 . . . . . 76 TYR CE# . 52678 1
912 . 1 . 1 76 76 TYR CE2 C 13 118.0616677 0.0000019 . 1 . . . . . 76 TYR CE# . 52678 1
913 . 1 . 1 76 76 TYR N N 15 113.0389304 0.000151601224 . 1 . . . . . 76 TYR N . 52678 1
914 . 1 . 1 77 77 PHE H H 1 8.357550774 0.007961267201 . 1 . . . . . 77 PHE H . 52678 1
915 . 1 . 1 77 77 PHE HA H 1 4.645542762 0.001638100042 . 1 . . . . . 77 PHE HA . 52678 1
916 . 1 . 1 77 77 PHE HB2 H 1 2.185938704 0.002821938796 . 2 . . . . . 77 PHE HB2 . 52678 1
917 . 1 . 1 77 77 PHE HB3 H 1 2.920539988 0.002083060614 . 2 . . . . . 77 PHE HB3 . 52678 1
918 . 1 . 1 77 77 PHE HD1 H 1 7.162512475 0.001820220445 . 1 . . . . . 77 PHE HD# . 52678 1
919 . 1 . 1 77 77 PHE HD2 H 1 7.162512475 0.001820220445 . 1 . . . . . 77 PHE HD# . 52678 1
920 . 1 . 1 77 77 PHE HE1 H 1 7.330348156 0.005274930809 . 1 . . . . . 77 PHE HE# . 52678 1
921 . 1 . 1 77 77 PHE HE2 H 1 7.330348156 0.005274930809 . 1 . . . . . 77 PHE HE# . 52678 1
922 . 1 . 1 77 77 PHE HZ H 1 7.132963756 0.002070472504 . 1 . . . . . 77 PHE HZ . 52678 1
923 . 1 . 1 77 77 PHE C C 13 175.449 0 . 1 . . . . . 77 PHE C . 52678 1
924 . 1 . 1 77 77 PHE CA C 13 57.84269294 0.0000033036 . 1 . . . . . 77 PHE CA . 52678 1
925 . 1 . 1 77 77 PHE CB C 13 39.25810821 0.00000178416 . 1 . . . . . 77 PHE CB . 52678 1
926 . 1 . 1 77 77 PHE CD1 C 13 132.1672081 0.000003814697 . 1 . . . . . 77 PHE CD# . 52678 1
927 . 1 . 1 77 77 PHE CD2 C 13 132.1672081 0.000003814697 . 1 . . . . . 77 PHE CD# . 52678 1
928 . 1 . 1 77 77 PHE CE1 C 13 130.4176837 0 . 1 . . . . . 77 PHE CE# . 52678 1
929 . 1 . 1 77 77 PHE CE2 C 13 130.4176837 0 . 1 . . . . . 77 PHE CE# . 52678 1
930 . 1 . 1 77 77 PHE CZ C 13 129.1055404 0.000001907 . 1 . . . . . 77 PHE CZ . 52678 1
931 . 1 . 1 77 77 PHE N N 15 117.632 0.000001907 . 1 . . . . . 77 PHE N . 52678 1
932 . 1 . 1 78 78 ARG H H 1 7.562381505 0.003280811379 . 1 . . . . . 78 ARG H . 52678 1
933 . 1 . 1 78 78 ARG HA H 1 4.298330567 0.006144274413 . 1 . . . . . 78 ARG HA . 52678 1
934 . 1 . 1 78 78 ARG HB2 H 1 1.837984513 0.001098406408 . 2 . . . . . 78 ARG HB2 . 52678 1
935 . 1 . 1 78 78 ARG HB3 H 1 1.845069552 0.0002536760158 . 2 . . . . . 78 ARG HB3 . 52678 1
936 . 1 . 1 78 78 ARG HG2 H 1 1.584478052 0.000553042689 . 2 . . . . . 78 ARG HG2 . 52678 1
937 . 1 . 1 78 78 ARG HG3 H 1 1.639186452 0.0006430763884 . 2 . . . . . 78 ARG HG3 . 52678 1
938 . 1 . 1 78 78 ARG HD2 H 1 3.198611094 0.004982944811 . 2 . . . . . 78 ARG HD2 . 52678 1
939 . 1 . 1 78 78 ARG HD3 H 1 3.199323449 0.002130942971 . 2 . . . . . 78 ARG HD3 . 52678 1
940 . 1 . 1 78 78 ARG C C 13 176.215 0 . 1 . . . . . 78 ARG C . 52678 1
941 . 1 . 1 78 78 ARG CA C 13 56.40820046 0.0000029394 . 1 . . . . . 78 ARG CA . 52678 1
942 . 1 . 1 78 78 ARG CB C 13 30.48200051 0.00000443484 . 1 . . . . . 78 ARG CB . 52678 1
943 . 1 . 1 78 78 ARG CG C 13 27.012 0.00000825906 . 1 . . . . . 78 ARG CG . 52678 1
944 . 1 . 1 78 78 ARG CD C 13 43.14068158 0.0000016518 . 1 . . . . . 78 ARG CD . 52678 1
945 . 1 . 1 78 78 ARG N N 15 120.476 0.00000426 . 1 . . . . . 78 ARG N . 52678 1
946 . 1 . 1 79 79 LYS H H 1 8.378472394 0.00578821291 . 1 . . . . . 79 LYS H . 52678 1
947 . 1 . 1 79 79 LYS HA H 1 4.238389416 0.002796769291 . 1 . . . . . 79 LYS HA . 52678 1
948 . 1 . 1 79 79 LYS HB2 H 1 1.735561488 0.000291508827 . 2 . . . . . 79 LYS HB2 . 52678 1
949 . 1 . 1 79 79 LYS HB3 H 1 1.74682769 0.0004742919746 . 2 . . . . . 79 LYS HB3 . 52678 1
950 . 1 . 1 79 79 LYS HG2 H 1 1.370296165 0.003680002815 . 2 . . . . . 79 LYS HG2 . 52678 1
951 . 1 . 1 79 79 LYS HG3 H 1 1.37923455 0.0005161562974 . 2 . . . . . 79 LYS HG3 . 52678 1
952 . 1 . 1 79 79 LYS HD2 H 1 1.625143606 0.0001762439765 . 2 . . . . . 79 LYS HD2 . 52678 1
953 . 1 . 1 79 79 LYS HD3 H 1 1.633297239 0.001915759171 . 2 . . . . . 79 LYS HD3 . 52678 1
954 . 1 . 1 79 79 LYS HE2 H 1 2.940525016 0.001625882416 . 2 . . . . . 79 LYS HE2 . 52678 1
955 . 1 . 1 79 79 LYS HE3 H 1 2.947158551 0.0004933945442 . 2 . . . . . 79 LYS HE3 . 52678 1
956 . 1 . 1 79 79 LYS C C 13 176.597 0 . 1 . . . . . 79 LYS C . 52678 1
957 . 1 . 1 79 79 LYS CA C 13 56.14568125 0.0000974 . 1 . . . . . 79 LYS CA . 52678 1
958 . 1 . 1 79 79 LYS CB C 13 32.83749997 0.0000013 . 1 . . . . . 79 LYS CB . 52678 1
959 . 1 . 1 79 79 LYS CG C 13 24.71930068 0.0000057 . 1 . . . . . 79 LYS CG . 52678 1
960 . 1 . 1 79 79 LYS CD C 13 28.91150541 0.02099194907 . 1 . . . . . 79 LYS CD . 52678 1
961 . 1 . 1 79 79 LYS CE C 13 42.0026998 0.0000015 . 1 . . . . . 79 LYS CE . 52678 1
962 . 1 . 1 79 79 LYS N N 15 122.335 0.000002697 . 1 . . . . . 79 LYS N . 52678 1
963 . 1 . 1 80 80 ARG H H 1 8.409935094 0.0001949463 . 1 . . . . . 80 ARG H . 52678 1
964 . 1 . 1 80 80 ARG HA H 1 4.255826814 0.00256474 . 1 . . . . . 80 ARG HA . 52678 1
965 . 1 . 1 80 80 ARG HB2 H 1 1.708314039 0.00008297 . 2 . . . . . 80 ARG HB2 . 52678 1
966 . 1 . 1 80 80 ARG HB3 H 1 1.721660934 0.0005625066823 . 2 . . . . . 80 ARG HB3 . 52678 1
967 . 1 . 1 80 80 ARG HG2 H 1 1.570989807 0.0003342393568 . 2 . . . . . 80 ARG HG2 . 52678 1
968 . 1 . 1 80 80 ARG HG3 H 1 1.591893646 0.000457649575 . 2 . . . . . 80 ARG HG3 . 52678 1
969 . 1 . 1 80 80 ARG HD2 H 1 3.121232898 0.005016092187 . 2 . . . . . 80 ARG HD2 . 52678 1
970 . 1 . 1 80 80 ARG HD3 H 1 3.121860091 0.004754152575 . 2 . . . . . 80 ARG HD3 . 52678 1
971 . 1 . 1 80 80 ARG C C 13 176.27 0 . 1 . . . . . 80 ARG C . 52678 1
972 . 1 . 1 80 80 ARG CA C 13 55.88360121 0.000007387 . 1 . . . . . 80 ARG CA . 52678 1
973 . 1 . 1 80 80 ARG CB C 13 30.74229956 0.0000041295 . 1 . . . . . 80 ARG CB . 52678 1
974 . 1 . 1 80 80 ARG CG C 13 26.81100014 0.00000184678 . 1 . . . . . 80 ARG CG . 52678 1
975 . 1 . 1 80 80 ARG CD C 13 43.05130048 0.0000037546 . 1 . . . . . 80 ARG CD . 52678 1
976 . 1 . 1 80 80 ARG N N 15 123.047 0.0000033 . 1 . . . . . 80 ARG N . 52678 1
977 . 1 . 1 81 81 ARG H H 1 8.575660059 0.00320082599 . 1 . . . . . 81 ARG H . 52678 1
978 . 1 . 1 81 81 ARG HA H 1 4.270629685 0.005992188875 . 1 . . . . . 81 ARG HA . 52678 1
979 . 1 . 1 81 81 ARG HB2 H 1 1.75595049 0.0003028629652 . 2 . . . . . 81 ARG HB2 . 52678 1
980 . 1 . 1 81 81 ARG HB3 H 1 1.817597852 0.000063 . 2 . . . . . 81 ARG HB3 . 52678 1
981 . 1 . 1 81 81 ARG HG2 H 1 1.579116019 0.002139890951 . 2 . . . . . 81 ARG HG2 . 52678 1
982 . 1 . 1 81 81 ARG HG3 H 1 1.625944275 0.00009888 . 2 . . . . . 81 ARG HG3 . 52678 1
983 . 1 . 1 81 81 ARG HD2 H 1 3.150220927 0.003741939929 . 2 . . . . . 81 ARG HD2 . 52678 1
984 . 1 . 1 81 81 ARG HD3 H 1 3.150788336 0.003621544538 . 2 . . . . . 81 ARG HD3 . 52678 1
985 . 1 . 1 81 81 ARG C C 13 176.817 0 . 1 . . . . . 81 ARG C . 52678 1
986 . 1 . 1 81 81 ARG CA C 13 56.4062 0.00000165 . 1 . . . . . 81 ARG CA . 52678 1
987 . 1 . 1 81 81 ARG CB C 13 30.74199995 0.00000165 . 1 . . . . . 81 ARG CB . 52678 1
988 . 1 . 1 81 81 ARG CG C 13 26.94680835 0.0000004768 . 1 . . . . . 81 ARG CG . 52678 1
989 . 1 . 1 81 81 ARG CD C 13 43.04899978 0.0000017 . 1 . . . . . 81 ARG CD . 52678 1
990 . 1 . 1 81 81 ARG N N 15 123.648 0.00000301578 . 1 . . . . . 81 ARG N . 52678 1
991 . 1 . 1 82 82 GLY H H 1 8.611188727 0.001167176894 . 1 . . . . . 82 GLY H . 52678 1
992 . 1 . 1 82 82 GLY HA2 H 1 3.981187972 0.001474389508 . 1 . . . . . 82 GLY HA2 . 52678 1
993 . 1 . 1 82 82 GLY HA3 H 1 3.981315512 0.001517869224 . 1 . . . . . 82 GLY HA3 . 52678 1
994 . 1 . 1 82 82 GLY C C 13 174.136 0 . 1 . . . . . 82 GLY C . 52678 1
995 . 1 . 1 82 82 GLY CA C 13 45.1453006 0.00000309 . 1 . . . . . 82 GLY CA . 52678 1
996 . 1 . 1 82 82 GLY N N 15 111.07 0.000003568 . 1 . . . . . 82 GLY N . 52678 1
997 . 1 . 1 83 83 THR H H 1 8.088586343 0.0006411726356 . 1 . . . . . 83 THR H . 52678 1
998 . 1 . 1 83 83 THR HA H 1 4.321379718 0.002620409506 . 1 . . . . . 83 THR HA . 52678 1
999 . 1 . 1 83 83 THR HB H 1 4.212710927 0.001997093266 . 1 . . . . . 83 THR HB . 52678 1
1000 . 1 . 1 83 83 THR HG21 H 1 1.168611407 0.002620595017 . 1 . . . . . 83 THR HG2# . 52678 1
1001 . 1 . 1 83 83 THR HG22 H 1 1.168611407 0.002620595017 . 1 . . . . . 83 THR HG2# . 52678 1
1002 . 1 . 1 83 83 THR HG23 H 1 1.168611407 0.002620595017 . 1 . . . . . 83 THR HG2# . 52678 1
1003 . 1 . 1 83 83 THR C C 13 174.082 0 . 1 . . . . . 83 THR C . 52678 1
1004 . 1 . 1 83 83 THR CA C 13 61.6435972 0.000001087 . 1 . . . . . 83 THR CA . 52678 1
1005 . 1 . 1 83 83 THR CB C 13 70.02390212 0.000007448 . 1 . . . . . 83 THR CB . 52678 1
1006 . 1 . 1 83 83 THR CG2 C 13 21.31500111 0.00000575 . 1 . . . . . 83 THR CG2 . 52678 1
1007 . 1 . 1 83 83 THR N N 15 113.7185023 0.000007008 . 1 . . . . . 83 THR N . 52678 1
1008 . 1 . 1 84 84 LYS H H 1 8.238709328 0.0000147 . 1 . . . . . 84 LYS H . 52678 1
1009 . 1 . 1 84 84 LYS HA H 1 4.180297766 0 . 1 . . . . . 84 LYS HA . 52678 1
1010 . 1 . 1 84 84 LYS C C 13 180.317 0 . 1 . . . . . 84 LYS C . 52678 1
1011 . 1 . 1 84 84 LYS N N 15 127.1508851 0 . 1 . . . . . 84 LYS N . 52678 1
stop_
save_