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 31155
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $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' . . . 31155 1
2 '3D CBCA(CO)NH' . . . 31155 1
3 '3D HNCACB' . . . 31155 1
4 '3D HNCO' . . . 31155 1
5 '2D 1H-13C HSQC' . . . 31155 1
6 '3D HCCH-TOCSY' . . . 31155 1
7 '3D 1H-13C NOESY' . . . 31155 1
8 '3D H(CCO)NH' . . . 31155 1
9 '3D 1H-15N NOESY' . . . 31155 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 GLY HA2 H 1 3.644 0 . 2 . . . . A -5 GLY HA2 . 31155 1
2 . 1 . 1 1 1 GLY HA3 H 1 3.644 0 . 2 . . . . A -5 GLY HA3 . 31155 1
3 . 1 . 1 1 1 GLY CA C 13 44.369 0 . 1 . . . . A -5 GLY CA . 31155 1
4 . 1 . 1 2 2 SER HA H 1 4.424 0 . 1 . . . . A -4 SER HA . 31155 1
5 . 1 . 1 2 2 SER HB2 H 1 3.618 0 . 2 . . . . A -4 SER HB2 . 31155 1
6 . 1 . 1 2 2 SER HB3 H 1 3.618 0 . 2 . . . . A -4 SER HB3 . 31155 1
7 . 1 . 1 2 2 SER CA C 13 58.101 0 . 1 . . . . A -4 SER CA . 31155 1
8 . 1 . 1 2 2 SER CB C 13 62.982 0 . 1 . . . . A -4 SER CB . 31155 1
9 . 1 . 1 3 3 HIS HA H 1 4.564 0 . 1 . . . . A -3 HIS HA . 31155 1
10 . 1 . 1 3 3 HIS HB2 H 1 3.046 0 . 2 . . . . A -3 HIS HB2 . 31155 1
11 . 1 . 1 3 3 HIS HB3 H 1 3.03 0 . 2 . . . . A -3 HIS HB3 . 31155 1
12 . 1 . 1 3 3 HIS CA C 13 56.669 0 . 1 . . . . A -3 HIS CA . 31155 1
13 . 1 . 1 3 3 HIS CB C 13 30.896 0 . 1 . . . . A -3 HIS CB . 31155 1
14 . 1 . 1 4 4 MET HA H 1 4.368 0 . 1 . . . . A -2 MET HA . 31155 1
15 . 1 . 1 4 4 MET HB2 H 1 2.461 0 . 2 . . . . A -2 MET HB2 . 31155 1
16 . 1 . 1 4 4 MET HB3 H 1 2.298 0 . 2 . . . . A -2 MET HB3 . 31155 1
17 . 1 . 1 4 4 MET HG2 H 1 2.415 0 . 2 . . . . A -2 MET HG2 . 31155 1
18 . 1 . 1 4 4 MET HG3 H 1 2.357 0 . 2 . . . . A -2 MET HG3 . 31155 1
19 . 1 . 1 4 4 MET HE1 H 1 2.022 0 . 1 . . . . A -2 MET HE1 . 31155 1
20 . 1 . 1 4 4 MET HE2 H 1 2.022 0 . 1 . . . . A -2 MET HE2 . 31155 1
21 . 1 . 1 4 4 MET HE3 H 1 2.022 0 . 1 . . . . A -2 MET HE3 . 31155 1
22 . 1 . 1 4 4 MET CA C 13 55.237 0 . 1 . . . . A -2 MET CA . 31155 1
23 . 1 . 1 4 4 MET CB C 13 32.362 0.016 . 1 . . . . A -2 MET CB . 31155 1
24 . 1 . 1 4 4 MET CG C 13 31.77 0 . 1 . . . . A -2 MET CG . 31155 1
25 . 1 . 1 4 4 MET CE C 13 16.793 0 . 1 . . . . A -2 MET CE . 31155 1
26 . 1 . 1 5 5 ALA HA H 1 4.303 0 . 1 . . . . A -1 ALA HA . 31155 1
27 . 1 . 1 5 5 ALA HB1 H 1 1.365 0 . 1 . . . . A -1 ALA HB1 . 31155 1
28 . 1 . 1 5 5 ALA HB2 H 1 1.365 0 . 1 . . . . A -1 ALA HB2 . 31155 1
29 . 1 . 1 5 5 ALA HB3 H 1 1.365 0 . 1 . . . . A -1 ALA HB3 . 31155 1
30 . 1 . 1 5 5 ALA CA C 13 52.373 0 . 1 . . . . A -1 ALA CA . 31155 1
31 . 1 . 1 5 5 ALA CB C 13 19.221 0 . 1 . . . . A -1 ALA CB . 31155 1
32 . 1 . 1 6 6 SER HA H 1 4.472 0 . 1 . . . . A 0 SER HA . 31155 1
33 . 1 . 1 6 6 SER HB2 H 1 3.783 0 . 2 . . . . A 0 SER HB2 . 31155 1
34 . 1 . 1 6 6 SER HB3 H 1 3.774 0 . 2 . . . . A 0 SER HB3 . 31155 1
35 . 1 . 1 6 6 SER CA C 13 58.055 0 . 1 . . . . A 0 SER CA . 31155 1
36 . 1 . 1 6 6 SER CB C 13 63.738 0.001 . 1 . . . . A 0 SER CB . 31155 1
37 . 1 . 1 7 7 THR H H 1 8.244 0 . 1 . . . . A 643 THR H . 31155 1
38 . 1 . 1 7 7 THR HA H 1 4.342 0 . 1 . . . . A 643 THR HA . 31155 1
39 . 1 . 1 7 7 THR HB H 1 4.255 0 . 1 . . . . A 643 THR HB . 31155 1
40 . 1 . 1 7 7 THR HG21 H 1 1.167 0 . 1 . . . . A 643 THR HG21 . 31155 1
41 . 1 . 1 7 7 THR HG22 H 1 1.167 0 . 1 . . . . A 643 THR HG22 . 31155 1
42 . 1 . 1 7 7 THR HG23 H 1 1.167 0 . 1 . . . . A 643 THR HG23 . 31155 1
43 . 1 . 1 7 7 THR CA C 13 61.751 0 . 1 . . . . A 643 THR CA . 31155 1
44 . 1 . 1 7 7 THR CB C 13 69.604 0 . 1 . . . . A 643 THR CB . 31155 1
45 . 1 . 1 7 7 THR CG2 C 13 21.528 0 . 1 . . . . A 643 THR CG2 . 31155 1
46 . 1 . 1 7 7 THR N N 15 117.47 0 . 1 . . . . A 643 THR N . 31155 1
47 . 1 . 1 8 8 GLY HA2 H 1 3.933 0 . 2 . . . . A 644 GLY HA2 . 31155 1
48 . 1 . 1 8 8 GLY HA3 H 1 3.951 0 . 2 . . . . A 644 GLY HA3 . 31155 1
49 . 1 . 1 8 8 GLY C C 13 174.03 0 . 1 . . . . A 644 GLY C . 31155 1
50 . 1 . 1 8 8 GLY CA C 13 45.235 0 . 1 . . . . A 644 GLY CA . 31155 1
51 . 1 . 1 9 9 GLU H H 1 8.24 0 . 1 . . . . A 645 GLU H . 31155 1
52 . 1 . 1 9 9 GLU HA H 1 4.242 0 . 1 . . . . A 645 GLU HA . 31155 1
53 . 1 . 1 9 9 GLU HB2 H 1 2.043 0 . 2 . . . . A 645 GLU HB2 . 31155 1
54 . 1 . 1 9 9 GLU HB3 H 1 1.906 0 . 2 . . . . A 645 GLU HB3 . 31155 1
55 . 1 . 1 9 9 GLU HG2 H 1 2.23 0 . 2 . . . . A 645 GLU HG2 . 31155 1
56 . 1 . 1 9 9 GLU HG3 H 1 2.202 0 . 2 . . . . A 645 GLU HG3 . 31155 1
57 . 1 . 1 9 9 GLU CA C 13 56.425 0 . 1 . . . . A 645 GLU CA . 31155 1
58 . 1 . 1 9 9 GLU CB C 13 30.279 0 . 1 . . . . A 645 GLU CB . 31155 1
59 . 1 . 1 9 9 GLU CG C 13 36.379 0 . 1 . . . . A 645 GLU CG . 31155 1
60 . 1 . 1 9 9 GLU N N 15 119.916 0 . 1 . . . . A 645 GLU N . 31155 1
61 . 1 . 1 10 10 ASN H H 1 8.248 0 . 1 . . . . A 646 ASN H . 31155 1
62 . 1 . 1 10 10 ASN HA H 1 4.798 0 . 1 . . . . A 646 ASN HA . 31155 1
63 . 1 . 1 10 10 ASN HB2 H 1 2.819 0 . 2 . . . . A 646 ASN HB2 . 31155 1
64 . 1 . 1 10 10 ASN HB3 H 1 2.74 0 . 2 . . . . A 646 ASN HB3 . 31155 1
65 . 1 . 1 10 10 ASN C C 13 174.03 0 . 1 . . . . A 646 ASN C . 31155 1
66 . 1 . 1 10 10 ASN CA C 13 52.837 0 . 1 . . . . A 646 ASN CA . 31155 1
67 . 1 . 1 10 10 ASN CB C 13 38.557 0.002 . 1 . . . . A 646 ASN CB . 31155 1
68 . 1 . 1 10 10 ASN N N 15 116.224 0 . 1 . . . . A 646 ASN N . 31155 1
69 . 1 . 1 11 11 VAL H H 1 7.722 0 . 1 . . . . A 647 VAL H . 31155 1
70 . 1 . 1 11 11 VAL HA H 1 4.98 0 . 1 . . . . A 647 VAL HA . 31155 1
71 . 1 . 1 11 11 VAL HB H 1 1.844 0 . 1 . . . . A 647 VAL HB . 31155 1
72 . 1 . 1 11 11 VAL HG11 H 1 0.801 0 . 2 . . . . A 647 VAL HG11 . 31155 1
73 . 1 . 1 11 11 VAL HG12 H 1 0.801 0 . 2 . . . . A 647 VAL HG12 . 31155 1
74 . 1 . 1 11 11 VAL HG13 H 1 0.801 0 . 2 . . . . A 647 VAL HG13 . 31155 1
75 . 1 . 1 11 11 VAL HG21 H 1 0.79 0 . 2 . . . . A 647 VAL HG21 . 31155 1
76 . 1 . 1 11 11 VAL HG22 H 1 0.79 0 . 2 . . . . A 647 VAL HG22 . 31155 1
77 . 1 . 1 11 11 VAL HG23 H 1 0.79 0 . 2 . . . . A 647 VAL HG23 . 31155 1
78 . 1 . 1 11 11 VAL C C 13 174.941 0 . 1 . . . . A 647 VAL C . 31155 1
79 . 1 . 1 11 11 VAL CA C 13 60.365 0 . 1 . . . . A 647 VAL CA . 31155 1
80 . 1 . 1 11 11 VAL CB C 13 34.461 0 . 1 . . . . A 647 VAL CB . 31155 1
81 . 1 . 1 11 11 VAL CG1 C 13 21.466 0 . 2 . . . . A 647 VAL CG1 . 31155 1
82 . 1 . 1 11 11 VAL CG2 C 13 19.732 0 . 2 . . . . A 647 VAL CG2 . 31155 1
83 . 1 . 1 11 11 VAL N N 15 117.631 0 . 1 . . . . A 647 VAL N . 31155 1
84 . 1 . 1 12 12 ILE H H 1 9.073 0 . 1 . . . . A 648 ILE H . 31155 1
85 . 1 . 1 12 12 ILE HA H 1 4.632 0 . 1 . . . . A 648 ILE HA . 31155 1
86 . 1 . 1 12 12 ILE HB H 1 1.752 0 . 1 . . . . A 648 ILE HB . 31155 1
87 . 1 . 1 12 12 ILE HG12 H 1 1.163 0 . 2 . . . . A 648 ILE HG12 . 31155 1
88 . 1 . 1 12 12 ILE HG13 H 1 1.163 0 . 2 . . . . A 648 ILE HG13 . 31155 1
89 . 1 . 1 12 12 ILE HG21 H 1 0.722 0 . 1 . . . . A 648 ILE HG21 . 31155 1
90 . 1 . 1 12 12 ILE HG22 H 1 0.722 0 . 1 . . . . A 648 ILE HG22 . 31155 1
91 . 1 . 1 12 12 ILE HG23 H 1 0.722 0 . 1 . . . . A 648 ILE HG23 . 31155 1
92 . 1 . 1 12 12 ILE HD11 H 1 0.731 0 . 1 . . . . A 648 ILE HD11 . 31155 1
93 . 1 . 1 12 12 ILE HD12 H 1 0.731 0 . 1 . . . . A 648 ILE HD12 . 31155 1
94 . 1 . 1 12 12 ILE HD13 H 1 0.731 0 . 1 . . . . A 648 ILE HD13 . 31155 1
95 . 1 . 1 12 12 ILE C C 13 173.527 0 . 1 . . . . A 648 ILE C . 31155 1
96 . 1 . 1 12 12 ILE CA C 13 58.831 0 . 1 . . . . A 648 ILE CA . 31155 1
97 . 1 . 1 12 12 ILE CB C 13 42.922 0 . 1 . . . . A 648 ILE CB . 31155 1
98 . 1 . 1 12 12 ILE CG1 C 13 28.719 0 . 1 . . . . A 648 ILE CG1 . 31155 1
99 . 1 . 1 12 12 ILE CG2 C 13 16.801 0 . 1 . . . . A 648 ILE CG2 . 31155 1
100 . 1 . 1 12 12 ILE CD1 C 13 14.157 0 . 1 . . . . A 648 ILE CD1 . 31155 1
101 . 1 . 1 12 12 ILE N N 15 122.447 0 . 1 . . . . A 648 ILE N . 31155 1
102 . 1 . 1 13 13 SER H H 1 8.537 0 . 1 . . . . A 649 SER H . 31155 1
103 . 1 . 1 13 13 SER HA H 1 4.976 0 . 1 . . . . A 649 SER HA . 31155 1
104 . 1 . 1 13 13 SER HB2 H 1 4.203 0 . 2 . . . . A 649 SER HB2 . 31155 1
105 . 1 . 1 13 13 SER HB3 H 1 3.901 0 . 2 . . . . A 649 SER HB3 . 31155 1
106 . 1 . 1 13 13 SER C C 13 175.569 0 . 1 . . . . A 649 SER C . 31155 1
107 . 1 . 1 13 13 SER CA C 13 57.223 0 . 1 . . . . A 649 SER CA . 31155 1
108 . 1 . 1 13 13 SER CB C 13 63.978 0 . 1 . . . . A 649 SER CB . 31155 1
109 . 1 . 1 13 13 SER N N 15 120.455 0 . 1 . . . . A 649 SER N . 31155 1
110 . 1 . 1 14 14 VAL H H 1 8.78 0 . 1 . . . . A 650 VAL H . 31155 1
111 . 1 . 1 14 14 VAL HA H 1 3.391 0 . 1 . . . . A 650 VAL HA . 31155 1
112 . 1 . 1 14 14 VAL HB H 1 2.133 0 . 1 . . . . A 650 VAL HB . 31155 1
113 . 1 . 1 14 14 VAL HG11 H 1 1.008 0 . 2 . . . . A 650 VAL HG11 . 31155 1
114 . 1 . 1 14 14 VAL HG12 H 1 1.008 0 . 2 . . . . A 650 VAL HG12 . 31155 1
115 . 1 . 1 14 14 VAL HG13 H 1 1.008 0 . 2 . . . . A 650 VAL HG13 . 31155 1
116 . 1 . 1 14 14 VAL HG21 H 1 0.938 0 . 2 . . . . A 650 VAL HG21 . 31155 1
117 . 1 . 1 14 14 VAL HG22 H 1 0.938 0 . 2 . . . . A 650 VAL HG22 . 31155 1
118 . 1 . 1 14 14 VAL HG23 H 1 0.938 0 . 2 . . . . A 650 VAL HG23 . 31155 1
119 . 1 . 1 14 14 VAL C C 13 177.078 0 . 1 . . . . A 650 VAL C . 31155 1
120 . 1 . 1 14 14 VAL CA C 13 66.825 0 . 1 . . . . A 650 VAL CA . 31155 1
121 . 1 . 1 14 14 VAL CB C 13 31.618 0 . 1 . . . . A 650 VAL CB . 31155 1
122 . 1 . 1 14 14 VAL CG1 C 13 23.115 0 . 2 . . . . A 650 VAL CG1 . 31155 1
123 . 1 . 1 14 14 VAL CG2 C 13 21.092 0 . 2 . . . . A 650 VAL CG2 . 31155 1
124 . 1 . 1 14 14 VAL N N 15 125.226 0 . 1 . . . . A 650 VAL N . 31155 1
125 . 1 . 1 15 15 ALA H H 1 8.33 0 . 1 . . . . A 651 ALA H . 31155 1
126 . 1 . 1 15 15 ALA HA H 1 3.969 0 . 1 . . . . A 651 ALA HA . 31155 1
127 . 1 . 1 15 15 ALA HB1 H 1 1.345 0 . 1 . . . . A 651 ALA HB1 . 31155 1
128 . 1 . 1 15 15 ALA HB2 H 1 1.345 0 . 1 . . . . A 651 ALA HB2 . 31155 1
129 . 1 . 1 15 15 ALA HB3 H 1 1.345 0 . 1 . . . . A 651 ALA HB3 . 31155 1
130 . 1 . 1 15 15 ALA C C 13 180.377 0 . 1 . . . . A 651 ALA C . 31155 1
131 . 1 . 1 15 15 ALA CA C 13 55.283 0 . 1 . . . . A 651 ALA CA . 31155 1
132 . 1 . 1 15 15 ALA CB C 13 18.246 0 . 1 . . . . A 651 ALA CB . 31155 1
133 . 1 . 1 15 15 ALA N N 15 120.363 0 . 1 . . . . A 651 ALA N . 31155 1
134 . 1 . 1 16 16 GLU H H 1 7.756 0 . 1 . . . . A 652 GLU H . 31155 1
135 . 1 . 1 16 16 GLU HA H 1 4.019 0 . 1 . . . . A 652 GLU HA . 31155 1
136 . 1 . 1 16 16 GLU HB2 H 1 2.12 0 . 2 . . . . A 652 GLU HB2 . 31155 1
137 . 1 . 1 16 16 GLU HB3 H 1 2.094 0 . 2 . . . . A 652 GLU HB3 . 31155 1
138 . 1 . 1 16 16 GLU HG2 H 1 2.402 0 . 2 . . . . A 652 GLU HG2 . 31155 1
139 . 1 . 1 16 16 GLU HG3 H 1 2.127 0 . 2 . . . . A 652 GLU HG3 . 31155 1
140 . 1 . 1 16 16 GLU C C 13 178.241 0 . 1 . . . . A 652 GLU C . 31155 1
141 . 1 . 1 16 16 GLU CA C 13 58.647 0 . 1 . . . . A 652 GLU CA . 31155 1
142 . 1 . 1 16 16 GLU CB C 13 29.626 0.005 . 1 . . . . A 652 GLU CB . 31155 1
143 . 1 . 1 16 16 GLU CG C 13 36.625 0.002 . 1 . . . . A 652 GLU CG . 31155 1
144 . 1 . 1 16 16 GLU N N 15 117.353 0 . 1 . . . . A 652 GLU N . 31155 1
145 . 1 . 1 17 17 LEU H H 1 7.752 0 . 1 . . . . A 653 LEU H . 31155 1
146 . 1 . 1 17 17 LEU HA H 1 4.17 0 . 1 . . . . A 653 LEU HA . 31155 1
147 . 1 . 1 17 17 LEU HB2 H 1 1.967 0 . 2 . . . . A 653 LEU HB2 . 31155 1
148 . 1 . 1 17 17 LEU HB3 H 1 1.461 0 . 2 . . . . A 653 LEU HB3 . 31155 1
149 . 1 . 1 17 17 LEU HG H 1 1.893 0 . 1 . . . . A 653 LEU HG . 31155 1
150 . 1 . 1 17 17 LEU HD11 H 1 0.747 0 . 2 . . . . A 653 LEU HD11 . 31155 1
151 . 1 . 1 17 17 LEU HD12 H 1 0.747 0 . 2 . . . . A 653 LEU HD12 . 31155 1
152 . 1 . 1 17 17 LEU HD13 H 1 0.747 0 . 2 . . . . A 653 LEU HD13 . 31155 1
153 . 1 . 1 17 17 LEU HD21 H 1 0.803 0 . 2 . . . . A 653 LEU HD21 . 31155 1
154 . 1 . 1 17 17 LEU HD22 H 1 0.803 0 . 2 . . . . A 653 LEU HD22 . 31155 1
155 . 1 . 1 17 17 LEU HD23 H 1 0.803 0 . 2 . . . . A 653 LEU HD23 . 31155 1
156 . 1 . 1 17 17 LEU CA C 13 56.579 0 . 1 . . . . A 653 LEU CA . 31155 1
157 . 1 . 1 17 17 LEU CB C 13 42.827 0 . 1 . . . . A 653 LEU CB . 31155 1
158 . 1 . 1 17 17 LEU CG C 13 26.611 0 . 1 . . . . A 653 LEU CG . 31155 1
159 . 1 . 1 17 17 LEU CD1 C 13 26.707 0 . 2 . . . . A 653 LEU CD1 . 31155 1
160 . 1 . 1 17 17 LEU CD2 C 13 25.933 0 . 2 . . . . A 653 LEU CD2 . 31155 1
161 . 1 . 1 17 17 LEU N N 15 117.908 0 . 1 . . . . A 653 LEU N . 31155 1
162 . 1 . 1 18 18 ILE HA H 1 3.461 0 . 1 . . . . A 654 ILE HA . 31155 1
163 . 1 . 1 18 18 ILE HB H 1 1.851 0 . 1 . . . . A 654 ILE HB . 31155 1
164 . 1 . 1 18 18 ILE HG12 H 1 1.103 0 . 2 . . . . A 654 ILE HG12 . 31155 1
165 . 1 . 1 18 18 ILE HG13 H 1 1.103 0 . 2 . . . . A 654 ILE HG13 . 31155 1
166 . 1 . 1 18 18 ILE HG21 H 1 0.81 0 . 1 . . . . A 654 ILE HG21 . 31155 1
167 . 1 . 1 18 18 ILE HG22 H 1 0.81 0 . 1 . . . . A 654 ILE HG22 . 31155 1
168 . 1 . 1 18 18 ILE HG23 H 1 0.81 0 . 1 . . . . A 654 ILE HG23 . 31155 1
169 . 1 . 1 18 18 ILE HD11 H 1 0.718 0 . 1 . . . . A 654 ILE HD11 . 31155 1
170 . 1 . 1 18 18 ILE HD12 H 1 0.718 0 . 1 . . . . A 654 ILE HD12 . 31155 1
171 . 1 . 1 18 18 ILE HD13 H 1 0.718 0 . 1 . . . . A 654 ILE HD13 . 31155 1
172 . 1 . 1 18 18 ILE C C 13 177.832 0 . 1 . . . . A 654 ILE C . 31155 1
173 . 1 . 1 18 18 ILE CA C 13 65.125 0 . 1 . . . . A 654 ILE CA . 31155 1
174 . 1 . 1 18 18 ILE CB C 13 37.246 0 . 1 . . . . A 654 ILE CB . 31155 1
175 . 1 . 1 18 18 ILE CG1 C 13 29.142 0 . 1 . . . . A 654 ILE CG1 . 31155 1
176 . 1 . 1 18 18 ILE CG2 C 13 17.382 0 . 1 . . . . A 654 ILE CG2 . 31155 1
177 . 1 . 1 18 18 ILE CD1 C 13 13.208 0 . 1 . . . . A 654 ILE CD1 . 31155 1
178 . 1 . 1 19 19 ASN H H 1 7.916 0 . 1 . . . . A 655 ASN H . 31155 1
179 . 1 . 1 19 19 ASN HA H 1 4.323 0 . 1 . . . . A 655 ASN HA . 31155 1
180 . 1 . 1 19 19 ASN HB2 H 1 2.77 0 . 2 . . . . A 655 ASN HB2 . 31155 1
181 . 1 . 1 19 19 ASN HB3 H 1 2.754 0 . 2 . . . . A 655 ASN HB3 . 31155 1
182 . 1 . 1 19 19 ASN C C 13 177.518 0 . 1 . . . . A 655 ASN C . 31155 1
183 . 1 . 1 19 19 ASN CA C 13 56.002 0 . 1 . . . . A 655 ASN CA . 31155 1
184 . 1 . 1 19 19 ASN CB C 13 38.316 0.004 . 1 . . . . A 655 ASN CB . 31155 1
185 . 1 . 1 19 19 ASN N N 15 116.705 0 . 1 . . . . A 655 ASN N . 31155 1
186 . 1 . 1 20 20 ALA H H 1 8.122 0 . 1 . . . . A 656 ALA H . 31155 1
187 . 1 . 1 20 20 ALA HA H 1 4.162 0 . 1 . . . . A 656 ALA HA . 31155 1
188 . 1 . 1 20 20 ALA HB1 H 1 1.46 0 . 1 . . . . A 656 ALA HB1 . 31155 1
189 . 1 . 1 20 20 ALA HB2 H 1 1.46 0 . 1 . . . . A 656 ALA HB2 . 31155 1
190 . 1 . 1 20 20 ALA HB3 H 1 1.46 0 . 1 . . . . A 656 ALA HB3 . 31155 1
191 . 1 . 1 20 20 ALA C C 13 179.875 0 . 1 . . . . A 656 ALA C . 31155 1
192 . 1 . 1 20 20 ALA CA C 13 54.327 0 . 1 . . . . A 656 ALA CA . 31155 1
193 . 1 . 1 20 20 ALA CB C 13 18.455 0 . 1 . . . . A 656 ALA CB . 31155 1
194 . 1 . 1 20 20 ALA N N 15 121.521 0 . 1 . . . . A 656 ALA N . 31155 1
195 . 1 . 1 21 21 MET H H 1 8.075 0 . 1 . . . . A 657 MET H . 31155 1
196 . 1 . 1 21 21 MET HA H 1 3.982 0 . 1 . . . . A 657 MET HA . 31155 1
197 . 1 . 1 21 21 MET HB2 H 1 2.634 0 . 2 . . . . A 657 MET HB2 . 31155 1
198 . 1 . 1 21 21 MET HB3 H 1 2.446 0 . 2 . . . . A 657 MET HB3 . 31155 1
199 . 1 . 1 21 21 MET HG2 H 1 2.119 0 . 2 . . . . A 657 MET HG2 . 31155 1
200 . 1 . 1 21 21 MET HG3 H 1 1.971 0.128 . 2 . . . . A 657 MET HG3 . 31155 1
201 . 1 . 1 21 21 MET HE1 H 1 1.889 0 . 1 . . . . A 657 MET HE1 . 31155 1
202 . 1 . 1 21 21 MET HE2 H 1 1.889 0 . 1 . . . . A 657 MET HE2 . 31155 1
203 . 1 . 1 21 21 MET HE3 H 1 1.889 0 . 1 . . . . A 657 MET HE3 . 31155 1
204 . 1 . 1 21 21 MET C C 13 177.549 0 . 1 . . . . A 657 MET C . 31155 1
205 . 1 . 1 21 21 MET CA C 13 56.723 0 . 1 . . . . A 657 MET CA . 31155 1
206 . 1 . 1 21 21 MET CB C 13 33.041 0.007 . 1 . . . . A 657 MET CB . 31155 1
207 . 1 . 1 21 21 MET CG C 13 31.299 0 . 1 . . . . A 657 MET CG . 31155 1
208 . 1 . 1 21 21 MET CE C 13 17.062 0 . 1 . . . . A 657 MET CE . 31155 1
209 . 1 . 1 21 21 MET N N 15 115.593 0 . 1 . . . . A 657 MET N . 31155 1
210 . 1 . 1 22 22 LYS H H 1 7.732 0 . 1 . . . . A 658 LYS H . 31155 1
211 . 1 . 1 22 22 LYS HA H 1 4.108 0 . 1 . . . . A 658 LYS HA . 31155 1
212 . 1 . 1 22 22 LYS HB2 H 1 1.715 0 . 2 . . . . A 658 LYS HB2 . 31155 1
213 . 1 . 1 22 22 LYS HB3 H 1 1.708 0 . 2 . . . . A 658 LYS HB3 . 31155 1
214 . 1 . 1 22 22 LYS HG2 H 1 1.575 0 . 2 . . . . A 658 LYS HG2 . 31155 1
215 . 1 . 1 22 22 LYS HG3 H 1 1.475 0 . 2 . . . . A 658 LYS HG3 . 31155 1
216 . 1 . 1 22 22 LYS HD2 H 1 1.628 0 . 2 . . . . A 658 LYS HD2 . 31155 1
217 . 1 . 1 22 22 LYS HD3 H 1 1.559 0 . 2 . . . . A 658 LYS HD3 . 31155 1
218 . 1 . 1 22 22 LYS HE2 H 1 2.915 0 . 2 . . . . A 658 LYS HE2 . 31155 1
219 . 1 . 1 22 22 LYS HE3 H 1 2.915 0 . 2 . . . . A 658 LYS HE3 . 31155 1
220 . 1 . 1 22 22 LYS C C 13 177.486 0 . 1 . . . . A 658 LYS C . 31155 1
221 . 1 . 1 22 22 LYS CA C 13 58.629 0 . 1 . . . . A 658 LYS CA . 31155 1
222 . 1 . 1 22 22 LYS CB C 13 32.569 0 . 1 . . . . A 658 LYS CB . 31155 1
223 . 1 . 1 22 22 LYS CG C 13 25.129 0 . 1 . . . . A 658 LYS CG . 31155 1
224 . 1 . 1 22 22 LYS CD C 13 28.916 0.006 . 1 . . . . A 658 LYS CD . 31155 1
225 . 1 . 1 22 22 LYS CE C 13 42.018 0 . 1 . . . . A 658 LYS CE . 31155 1
226 . 1 . 1 22 22 LYS N N 15 118.974 0 . 1 . . . . A 658 LYS N . 31155 1
227 . 1 . 1 23 23 GLN H H 1 7.716 0 . 1 . . . . A 659 GLN H . 31155 1
228 . 1 . 1 23 23 GLN HA H 1 4.241 0 . 1 . . . . A 659 GLN HA . 31155 1
229 . 1 . 1 23 23 GLN HG2 H 1 2.399 0 . 2 . . . . A 659 GLN HG2 . 31155 1
230 . 1 . 1 23 23 GLN HG3 H 1 2.381 0 . 2 . . . . A 659 GLN HG3 . 31155 1
231 . 1 . 1 23 23 GLN C C 13 176.072 0 . 1 . . . . A 659 GLN C . 31155 1
232 . 1 . 1 23 23 GLN CA C 13 56.076 0 . 1 . . . . A 659 GLN CA . 31155 1
233 . 1 . 1 23 23 GLN CG C 13 33.854 0 . 1 . . . . A 659 GLN CG . 31155 1
234 . 1 . 1 23 23 GLN N N 15 114.806 0 . 1 . . . . A 659 GLN N . 31155 1
235 . 1 . 1 24 24 VAL H H 1 7.662 0 . 1 . . . . A 660 VAL H . 31155 1
236 . 1 . 1 24 24 VAL HA H 1 3.885 0 . 1 . . . . A 660 VAL HA . 31155 1
237 . 1 . 1 24 24 VAL HB H 1 1.969 0 . 1 . . . . A 660 VAL HB . 31155 1
238 . 1 . 1 24 24 VAL HG11 H 1 0.871 0 . 2 . . . . A 660 VAL HG11 . 31155 1
239 . 1 . 1 24 24 VAL HG12 H 1 0.871 0 . 2 . . . . A 660 VAL HG12 . 31155 1
240 . 1 . 1 24 24 VAL HG13 H 1 0.871 0 . 2 . . . . A 660 VAL HG13 . 31155 1
241 . 1 . 1 24 24 VAL HG21 H 1 0.822 0 . 2 . . . . A 660 VAL HG21 . 31155 1
242 . 1 . 1 24 24 VAL HG22 H 1 0.822 0 . 2 . . . . A 660 VAL HG22 . 31155 1
243 . 1 . 1 24 24 VAL HG23 H 1 0.822 0 . 2 . . . . A 660 VAL HG23 . 31155 1
244 . 1 . 1 24 24 VAL CA C 13 61.985 0 . 1 . . . . A 660 VAL CA . 31155 1
245 . 1 . 1 24 24 VAL CB C 13 31.694 0 . 1 . . . . A 660 VAL CB . 31155 1
246 . 1 . 1 24 24 VAL CG1 C 13 21.382 0 . 2 . . . . A 660 VAL CG1 . 31155 1
247 . 1 . 1 24 24 VAL CG2 C 13 21.328 0 . 2 . . . . A 660 VAL CG2 . 31155 1
248 . 1 . 1 24 24 VAL N N 15 118.834 0 . 1 . . . . A 660 VAL N . 31155 1
249 . 1 . 1 25 25 LYS H H 1 7.846 0 . 1 . . . . A 661 LYS H . 31155 1
250 . 1 . 1 25 25 LYS HB2 H 1 1.994 0 . 2 . . . . A 661 LYS HB2 . 31155 1
251 . 1 . 1 25 25 LYS HB3 H 1 1.981 0 . 2 . . . . A 661 LYS HB3 . 31155 1
252 . 1 . 1 25 25 LYS HG2 H 1 1.64 0 . 2 . . . . A 661 LYS HG2 . 31155 1
253 . 1 . 1 25 25 LYS HG3 H 1 1.497 0 . 2 . . . . A 661 LYS HG3 . 31155 1
254 . 1 . 1 25 25 LYS HD2 H 1 1.575 0 . 2 . . . . A 661 LYS HD2 . 31155 1
255 . 1 . 1 25 25 LYS HD3 H 1 1.537 0 . 2 . . . . A 661 LYS HD3 . 31155 1
256 . 1 . 1 25 25 LYS HE2 H 1 2.896 0 . 2 . . . . A 661 LYS HE2 . 31155 1
257 . 1 . 1 25 25 LYS HE3 H 1 2.896 0 . 2 . . . . A 661 LYS HE3 . 31155 1
258 . 1 . 1 25 25 LYS CB C 13 32.777 0.003 . 1 . . . . A 661 LYS CB . 31155 1
259 . 1 . 1 25 25 LYS CG C 13 25.535 0.005 . 1 . . . . A 661 LYS CG . 31155 1
260 . 1 . 1 25 25 LYS CD C 13 26.996 0.015 . 1 . . . . A 661 LYS CD . 31155 1
261 . 1 . 1 25 25 LYS CE C 13 41.771 0 . 1 . . . . A 661 LYS CE . 31155 1
262 . 1 . 1 25 25 LYS N N 15 119.098 0 . 1 . . . . A 661 LYS N . 31155 1
263 . 1 . 1 26 26 HIS H H 1 8.681 0 . 1 . . . . A 662 HIS H . 31155 1
264 . 1 . 1 26 26 HIS HA H 1 4.492 0 . 1 . . . . A 662 HIS HA . 31155 1
265 . 1 . 1 26 26 HIS HB2 H 1 3.141 0 . 2 . . . . A 662 HIS HB2 . 31155 1
266 . 1 . 1 26 26 HIS HB3 H 1 3 0 . 2 . . . . A 662 HIS HB3 . 31155 1
267 . 1 . 1 26 26 HIS CA C 13 55.245 0 . 1 . . . . A 662 HIS CA . 31155 1
268 . 1 . 1 26 26 HIS CB C 13 30.36 0 . 1 . . . . A 662 HIS CB . 31155 1
269 . 1 . 1 26 26 HIS N N 15 119.96 0 . 1 . . . . A 662 HIS N . 31155 1
270 . 1 . 1 27 27 ILE H H 1 7.449 0 . 1 . . . . A 663 ILE H . 31155 1
271 . 1 . 1 27 27 ILE HB H 1 1.874 0 . 1 . . . . A 663 ILE HB . 31155 1
272 . 1 . 1 27 27 ILE HG12 H 1 1.012 0 . 2 . . . . A 663 ILE HG12 . 31155 1
273 . 1 . 1 27 27 ILE HG13 H 1 1.012 0 . 2 . . . . A 663 ILE HG13 . 31155 1
274 . 1 . 1 27 27 ILE HG21 H 1 0.81 0 . 1 . . . . A 663 ILE HG21 . 31155 1
275 . 1 . 1 27 27 ILE HG22 H 1 0.81 0 . 1 . . . . A 663 ILE HG22 . 31155 1
276 . 1 . 1 27 27 ILE HG23 H 1 0.81 0 . 1 . . . . A 663 ILE HG23 . 31155 1
277 . 1 . 1 27 27 ILE HD11 H 1 0.709 0 . 1 . . . . A 663 ILE HD11 . 31155 1
278 . 1 . 1 27 27 ILE HD12 H 1 0.709 0 . 1 . . . . A 663 ILE HD12 . 31155 1
279 . 1 . 1 27 27 ILE HD13 H 1 0.709 0 . 1 . . . . A 663 ILE HD13 . 31155 1
280 . 1 . 1 27 27 ILE CB C 13 36.96 0 . 1 . . . . A 663 ILE CB . 31155 1
281 . 1 . 1 27 27 ILE CG1 C 13 29.193 0 . 1 . . . . A 663 ILE CG1 . 31155 1
282 . 1 . 1 27 27 ILE CG2 C 13 17.174 0 . 1 . . . . A 663 ILE CG2 . 31155 1
283 . 1 . 1 27 27 ILE CD1 C 13 13.405 0 . 1 . . . . A 663 ILE CD1 . 31155 1
284 . 1 . 1 27 27 ILE N N 15 122.579 0 . 1 . . . . A 663 ILE N . 31155 1
285 . 1 . 1 28 28 PRO HA H 1 4.477 0 . 1 . . . . A 664 PRO HA . 31155 1
286 . 1 . 1 28 28 PRO HB2 H 1 1.57 0 . 2 . . . . A 664 PRO HB2 . 31155 1
287 . 1 . 1 28 28 PRO HB3 H 1 1.291 0 . 2 . . . . A 664 PRO HB3 . 31155 1
288 . 1 . 1 28 28 PRO HG2 H 1 2.056 0 . 2 . . . . A 664 PRO HG2 . 31155 1
289 . 1 . 1 28 28 PRO HG3 H 1 2.031 0 . 2 . . . . A 664 PRO HG3 . 31155 1
290 . 1 . 1 28 28 PRO HD2 H 1 3.875 0 . 2 . . . . A 664 PRO HD2 . 31155 1
291 . 1 . 1 28 28 PRO HD3 H 1 3.472 0 . 2 . . . . A 664 PRO HD3 . 31155 1
292 . 1 . 1 28 28 PRO CA C 13 62.628 0 . 1 . . . . A 664 PRO CA . 31155 1
293 . 1 . 1 28 28 PRO CB C 13 31.899 0.018 . 1 . . . . A 664 PRO CB . 31155 1
294 . 1 . 1 28 28 PRO CG C 13 27.813 0 . 1 . . . . A 664 PRO CG . 31155 1
295 . 1 . 1 28 28 PRO CD C 13 51.162 0 . 1 . . . . A 664 PRO CD . 31155 1
296 . 1 . 1 29 29 GLU H H 1 9.053 0 . 1 . . . . A 665 GLU H . 31155 1
297 . 1 . 1 29 29 GLU HA H 1 3.852 0 . 1 . . . . A 665 GLU HA . 31155 1
298 . 1 . 1 29 29 GLU HB2 H 1 2.06 0 . 2 . . . . A 665 GLU HB2 . 31155 1
299 . 1 . 1 29 29 GLU HB3 H 1 2.008 0 . 2 . . . . A 665 GLU HB3 . 31155 1
300 . 1 . 1 29 29 GLU HG2 H 1 2.176 0 . 2 . . . . A 665 GLU HG2 . 31155 1
301 . 1 . 1 29 29 GLU HG3 H 1 2.161 0 . 2 . . . . A 665 GLU HG3 . 31155 1
302 . 1 . 1 29 29 GLU CA C 13 59.941 0 . 1 . . . . A 665 GLU CA . 31155 1
303 . 1 . 1 29 29 GLU CB C 13 29.448 0.002 . 1 . . . . A 665 GLU CB . 31155 1
304 . 1 . 1 29 29 GLU CG C 13 36.275 0.006 . 1 . . . . A 665 GLU CG . 31155 1
305 . 1 . 1 29 29 GLU N N 15 125.293 0 . 1 . . . . A 665 GLU N . 31155 1
306 . 1 . 1 30 30 SER H H 1 8.215 0 . 1 . . . . A 666 SER H . 31155 1
307 . 1 . 1 30 30 SER HA H 1 4.171 0 . 1 . . . . A 666 SER HA . 31155 1
308 . 1 . 1 30 30 SER HB2 H 1 3.865 0 . 2 . . . . A 666 SER HB2 . 31155 1
309 . 1 . 1 30 30 SER HB3 H 1 3.817 0 . 2 . . . . A 666 SER HB3 . 31155 1
310 . 1 . 1 30 30 SER C C 13 176.795 0 . 1 . . . . A 666 SER C . 31155 1
311 . 1 . 1 30 30 SER CA C 13 60.596 0 . 1 . . . . A 666 SER CA . 31155 1
312 . 1 . 1 30 30 SER CB C 13 63.585 0 . 1 . . . . A 666 SER CB . 31155 1
313 . 1 . 1 30 30 SER N N 15 116.48 0 . 1 . . . . A 666 SER N . 31155 1
314 . 1 . 1 31 31 LYS H H 1 7.468 0 . 1 . . . . A 667 LYS H . 31155 1
315 . 1 . 1 31 31 LYS HA H 1 4.24 0 . 1 . . . . A 667 LYS HA . 31155 1
316 . 1 . 1 31 31 LYS HB2 H 1 1.874 0 . 2 . . . . A 667 LYS HB2 . 31155 1
317 . 1 . 1 31 31 LYS HB3 H 1 1.736 0 . 2 . . . . A 667 LYS HB3 . 31155 1
318 . 1 . 1 31 31 LYS HG2 H 1 1.593 0 . 2 . . . . A 667 LYS HG2 . 31155 1
319 . 1 . 1 31 31 LYS HG3 H 1 1.498 0 . 2 . . . . A 667 LYS HG3 . 31155 1
320 . 1 . 1 31 31 LYS HE2 H 1 3.053 0 . 2 . . . . A 667 LYS HE2 . 31155 1
321 . 1 . 1 31 31 LYS HE3 H 1 3.053 0 . 2 . . . . A 667 LYS HE3 . 31155 1
322 . 1 . 1 31 31 LYS C C 13 177.832 0 . 1 . . . . A 667 LYS C . 31155 1
323 . 1 . 1 31 31 LYS CA C 13 57.075 0 . 1 . . . . A 667 LYS CA . 31155 1
324 . 1 . 1 31 31 LYS CB C 13 32.748 0 . 1 . . . . A 667 LYS CB . 31155 1
325 . 1 . 1 31 31 LYS CG C 13 25.237 0.005 . 1 . . . . A 667 LYS CG . 31155 1
326 . 1 . 1 31 31 LYS CE C 13 42.732 0 . 1 . . . . A 667 LYS CE . 31155 1
327 . 1 . 1 31 31 LYS N N 15 121.031 0 . 1 . . . . A 667 LYS N . 31155 1
328 . 1 . 1 32 32 LEU H H 1 7.708 0 . 1 . . . . A 668 LEU H . 31155 1
329 . 1 . 1 32 32 LEU HA H 1 3.922 0 . 1 . . . . A 668 LEU HA . 31155 1
330 . 1 . 1 32 32 LEU HB2 H 1 1.747 0 . 2 . . . . A 668 LEU HB2 . 31155 1
331 . 1 . 1 32 32 LEU HB3 H 1 1.601 0 . 2 . . . . A 668 LEU HB3 . 31155 1
332 . 1 . 1 32 32 LEU HD11 H 1 0.845 0 . 2 . . . . A 668 LEU HD11 . 31155 1
333 . 1 . 1 32 32 LEU HD12 H 1 0.845 0 . 2 . . . . A 668 LEU HD12 . 31155 1
334 . 1 . 1 32 32 LEU HD13 H 1 0.845 0 . 2 . . . . A 668 LEU HD13 . 31155 1
335 . 1 . 1 32 32 LEU HD21 H 1 0.858 0 . 2 . . . . A 668 LEU HD21 . 31155 1
336 . 1 . 1 32 32 LEU HD22 H 1 0.858 0 . 2 . . . . A 668 LEU HD22 . 31155 1
337 . 1 . 1 32 32 LEU HD23 H 1 0.858 0 . 2 . . . . A 668 LEU HD23 . 31155 1
338 . 1 . 1 32 32 LEU C C 13 178.241 0 . 1 . . . . A 668 LEU C . 31155 1
339 . 1 . 1 32 32 LEU CA C 13 57.754 0 . 1 . . . . A 668 LEU CA . 31155 1
340 . 1 . 1 32 32 LEU CB C 13 41.929 0.005 . 1 . . . . A 668 LEU CB . 31155 1
341 . 1 . 1 32 32 LEU CD1 C 13 24.224 0 . 2 . . . . A 668 LEU CD1 . 31155 1
342 . 1 . 1 32 32 LEU CD2 C 13 22.841 0 . 2 . . . . A 668 LEU CD2 . 31155 1
343 . 1 . 1 32 32 LEU N N 15 119.9 0 . 1 . . . . A 668 LEU N . 31155 1
344 . 1 . 1 33 33 THR H H 1 8.477 0 . 1 . . . . A 669 THR H . 31155 1
345 . 1 . 1 33 33 THR HA H 1 3.683 0 . 1 . . . . A 669 THR HA . 31155 1
346 . 1 . 1 33 33 THR HB H 1 4.181 0 . 1 . . . . A 669 THR HB . 31155 1
347 . 1 . 1 33 33 THR HG21 H 1 1.203 0 . 1 . . . . A 669 THR HG21 . 31155 1
348 . 1 . 1 33 33 THR HG22 H 1 1.203 0 . 1 . . . . A 669 THR HG22 . 31155 1
349 . 1 . 1 33 33 THR HG23 H 1 1.203 0 . 1 . . . . A 669 THR HG23 . 31155 1
350 . 1 . 1 33 33 THR C C 13 176.889 0 . 1 . . . . A 669 THR C . 31155 1
351 . 1 . 1 33 33 THR CA C 13 66.516 0 . 1 . . . . A 669 THR CA . 31155 1
352 . 1 . 1 33 33 THR CB C 13 68.126 0 . 1 . . . . A 669 THR CB . 31155 1
353 . 1 . 1 33 33 THR CG2 C 13 21.899 0 . 1 . . . . A 669 THR CG2 . 31155 1
354 . 1 . 1 33 33 THR N N 15 112.491 0 . 1 . . . . A 669 THR N . 31155 1
355 . 1 . 1 34 34 SER H H 1 7.579 0 . 1 . . . . A 670 SER H . 31155 1
356 . 1 . 1 34 34 SER HA H 1 4.197 0 . 1 . . . . A 670 SER HA . 31155 1
357 . 1 . 1 34 34 SER HB2 H 1 3.941 0 . 2 . . . . A 670 SER HB2 . 31155 1
358 . 1 . 1 34 34 SER HB3 H 1 3.789 0 . 2 . . . . A 670 SER HB3 . 31155 1
359 . 1 . 1 34 34 SER C C 13 176.544 0 . 1 . . . . A 670 SER C . 31155 1
360 . 1 . 1 34 34 SER CA C 13 61.631 0 . 1 . . . . A 670 SER CA . 31155 1
361 . 1 . 1 34 34 SER CB C 13 62.998 0 . 1 . . . . A 670 SER CB . 31155 1
362 . 1 . 1 34 34 SER N N 15 117.677 0 . 1 . . . . A 670 SER N . 31155 1
363 . 1 . 1 35 35 LEU H H 1 8.02 0 . 1 . . . . A 671 LEU H . 31155 1
364 . 1 . 1 35 35 LEU HA H 1 3.815 0 . 1 . . . . A 671 LEU HA . 31155 1
365 . 1 . 1 35 35 LEU HB2 H 1 1.895 0 . 2 . . . . A 671 LEU HB2 . 31155 1
366 . 1 . 1 35 35 LEU HB3 H 1 1.618 0 . 2 . . . . A 671 LEU HB3 . 31155 1
367 . 1 . 1 35 35 LEU HD11 H 1 0.774 0 . 2 . . . . A 671 LEU HD11 . 31155 1
368 . 1 . 1 35 35 LEU HD12 H 1 0.774 0 . 2 . . . . A 671 LEU HD12 . 31155 1
369 . 1 . 1 35 35 LEU HD13 H 1 0.774 0 . 2 . . . . A 671 LEU HD13 . 31155 1
370 . 1 . 1 35 35 LEU HD21 H 1 0.833 0 . 2 . . . . A 671 LEU HD21 . 31155 1
371 . 1 . 1 35 35 LEU HD22 H 1 0.833 0 . 2 . . . . A 671 LEU HD22 . 31155 1
372 . 1 . 1 35 35 LEU HD23 H 1 0.833 0 . 2 . . . . A 671 LEU HD23 . 31155 1
373 . 1 . 1 35 35 LEU C C 13 177.078 0 . 1 . . . . A 671 LEU C . 31155 1
374 . 1 . 1 35 35 LEU CA C 13 57.929 0 . 1 . . . . A 671 LEU CA . 31155 1
375 . 1 . 1 35 35 LEU CB C 13 42.023 0.01 . 1 . . . . A 671 LEU CB . 31155 1
376 . 1 . 1 35 35 LEU CD1 C 13 24.522 0 . 2 . . . . A 671 LEU CD1 . 31155 1
377 . 1 . 1 35 35 LEU CD2 C 13 23.459 0 . 2 . . . . A 671 LEU CD2 . 31155 1
378 . 1 . 1 35 35 LEU N N 15 123.837 0 . 1 . . . . A 671 LEU N . 31155 1
379 . 1 . 1 36 36 ALA H H 1 8.189 0 . 1 . . . . A 672 ALA H . 31155 1
380 . 1 . 1 36 36 ALA HA H 1 3.731 0 . 1 . . . . A 672 ALA HA . 31155 1
381 . 1 . 1 36 36 ALA HB1 H 1 1.292 0 . 1 . . . . A 672 ALA HB1 . 31155 1
382 . 1 . 1 36 36 ALA HB2 H 1 1.292 0 . 1 . . . . A 672 ALA HB2 . 31155 1
383 . 1 . 1 36 36 ALA HB3 H 1 1.292 0 . 1 . . . . A 672 ALA HB3 . 31155 1
384 . 1 . 1 36 36 ALA C C 13 177.926 0 . 1 . . . . A 672 ALA C . 31155 1
385 . 1 . 1 36 36 ALA CA C 13 55.237 0 . 1 . . . . A 672 ALA CA . 31155 1
386 . 1 . 1 36 36 ALA CB C 13 18.238 0 . 1 . . . . A 672 ALA CB . 31155 1
387 . 1 . 1 36 36 ALA N N 15 118.511 0 . 1 . . . . A 672 ALA N . 31155 1
388 . 1 . 1 37 37 ALA H H 1 7.65 0 . 1 . . . . A 673 ALA H . 31155 1
389 . 1 . 1 37 37 ALA HA H 1 4.034 0 . 1 . . . . A 673 ALA HA . 31155 1
390 . 1 . 1 37 37 ALA HB1 H 1 1.425 0 . 1 . . . . A 673 ALA HB1 . 31155 1
391 . 1 . 1 37 37 ALA HB2 H 1 1.425 0 . 1 . . . . A 673 ALA HB2 . 31155 1
392 . 1 . 1 37 37 ALA HB3 H 1 1.425 0 . 1 . . . . A 673 ALA HB3 . 31155 1
393 . 1 . 1 37 37 ALA C C 13 179.655 0 . 1 . . . . A 673 ALA C . 31155 1
394 . 1 . 1 37 37 ALA CA C 13 54.444 0 . 1 . . . . A 673 ALA CA . 31155 1
395 . 1 . 1 37 37 ALA CB C 13 18.035 0 . 1 . . . . A 673 ALA CB . 31155 1
396 . 1 . 1 37 37 ALA N N 15 115.501 0 . 1 . . . . A 673 ALA N . 31155 1
397 . 1 . 1 38 38 ALA H H 1 7.426 0 . 1 . . . . A 674 ALA H . 31155 1
398 . 1 . 1 38 38 ALA HA H 1 3.968 0 . 1 . . . . A 674 ALA HA . 31155 1
399 . 1 . 1 38 38 ALA HB1 H 1 1.338 0 . 1 . . . . A 674 ALA HB1 . 31155 1
400 . 1 . 1 38 38 ALA HB2 H 1 1.338 0 . 1 . . . . A 674 ALA HB2 . 31155 1
401 . 1 . 1 38 38 ALA HB3 H 1 1.338 0 . 1 . . . . A 674 ALA HB3 . 31155 1
402 . 1 . 1 38 38 ALA C C 13 177.172 0 . 1 . . . . A 674 ALA C . 31155 1
403 . 1 . 1 38 38 ALA CA C 13 53.733 0 . 1 . . . . A 674 ALA CA . 31155 1
404 . 1 . 1 38 38 ALA CB C 13 18.098 0 . 1 . . . . A 674 ALA CB . 31155 1
405 . 1 . 1 38 38 ALA N N 15 118.974 0 . 1 . . . . A 674 ALA N . 31155 1
406 . 1 . 1 39 39 LEU H H 1 7.402 0 . 1 . . . . A 675 LEU H . 31155 1
407 . 1 . 1 39 39 LEU HA H 1 4.165 0 . 1 . . . . A 675 LEU HA . 31155 1
408 . 1 . 1 39 39 LEU HB2 H 1 1.845 0 . 2 . . . . A 675 LEU HB2 . 31155 1
409 . 1 . 1 39 39 LEU HB3 H 1 1.61 0 . 2 . . . . A 675 LEU HB3 . 31155 1
410 . 1 . 1 39 39 LEU HG H 1 1.838 0 . 1 . . . . A 675 LEU HG . 31155 1
411 . 1 . 1 39 39 LEU HD11 H 1 0.707 0 . 2 . . . . A 675 LEU HD11 . 31155 1
412 . 1 . 1 39 39 LEU HD12 H 1 0.707 0 . 2 . . . . A 675 LEU HD12 . 31155 1
413 . 1 . 1 39 39 LEU HD13 H 1 0.707 0 . 2 . . . . A 675 LEU HD13 . 31155 1
414 . 1 . 1 39 39 LEU HD21 H 1 0.848 0 . 2 . . . . A 675 LEU HD21 . 31155 1
415 . 1 . 1 39 39 LEU HD22 H 1 0.848 0 . 2 . . . . A 675 LEU HD22 . 31155 1
416 . 1 . 1 39 39 LEU HD23 H 1 0.848 0 . 2 . . . . A 675 LEU HD23 . 31155 1
417 . 1 . 1 39 39 LEU C C 13 176.921 0 . 1 . . . . A 675 LEU C . 31155 1
418 . 1 . 1 39 39 LEU CA C 13 56.764 0 . 1 . . . . A 675 LEU CA . 31155 1
419 . 1 . 1 39 39 LEU CB C 13 42.408 0 . 1 . . . . A 675 LEU CB . 31155 1
420 . 1 . 1 39 39 LEU CG C 13 27.524 0 . 1 . . . . A 675 LEU CG . 31155 1
421 . 1 . 1 39 39 LEU CD1 C 13 24.736 0 . 2 . . . . A 675 LEU CD1 . 31155 1
422 . 1 . 1 39 39 LEU CD2 C 13 23.787 0 . 2 . . . . A 675 LEU CD2 . 31155 1
423 . 1 . 1 39 39 LEU N N 15 115.13 0 . 1 . . . . A 675 LEU N . 31155 1
424 . 1 . 1 40 40 ASP H H 1 7.056 0 . 1 . . . . A 676 ASP H . 31155 1
425 . 1 . 1 40 40 ASP HA H 1 4.798 0 . 1 . . . . A 676 ASP HA . 31155 1
426 . 1 . 1 40 40 ASP HB2 H 1 3.061 0 . 2 . . . . A 676 ASP HB2 . 31155 1
427 . 1 . 1 40 40 ASP HB3 H 1 2.298 0 . 2 . . . . A 676 ASP HB3 . 31155 1
428 . 1 . 1 40 40 ASP C C 13 177.329 0 . 1 . . . . A 676 ASP C . 31155 1
429 . 1 . 1 40 40 ASP CA C 13 52.029 0 . 1 . . . . A 676 ASP CA . 31155 1
430 . 1 . 1 40 40 ASP CB C 13 38.63 0 . 1 . . . . A 676 ASP CB . 31155 1
431 . 1 . 1 40 40 ASP N N 15 115.13 0 . 1 . . . . A 676 ASP N . 31155 1
432 . 1 . 1 41 41 GLU H H 1 8.167 0 . 1 . . . . A 677 GLU H . 31155 1
433 . 1 . 1 41 41 GLU HA H 1 4.095 0 . 1 . . . . A 677 GLU HA . 31155 1
434 . 1 . 1 41 41 GLU HB2 H 1 2.019 0 . 2 . . . . A 677 GLU HB2 . 31155 1
435 . 1 . 1 41 41 GLU HB3 H 1 1.904 0 . 2 . . . . A 677 GLU HB3 . 31155 1
436 . 1 . 1 41 41 GLU HG2 H 1 2.299 0 . 2 . . . . A 677 GLU HG2 . 31155 1
437 . 1 . 1 41 41 GLU HG3 H 1 2.237 0 . 2 . . . . A 677 GLU HG3 . 31155 1
438 . 1 . 1 41 41 GLU C C 13 177.675 0 . 1 . . . . A 677 GLU C . 31155 1
439 . 1 . 1 41 41 GLU CA C 13 59.705 0 . 1 . . . . A 677 GLU CA . 31155 1
440 . 1 . 1 41 41 GLU CB C 13 32.322 0.01 . 1 . . . . A 677 GLU CB . 31155 1
441 . 1 . 1 41 41 GLU CG C 13 36.007 0 . 1 . . . . A 677 GLU CG . 31155 1
442 . 1 . 1 41 41 GLU N N 15 130.18 0 . 1 . . . . A 677 GLU N . 31155 1
443 . 1 . 1 42 42 ASN H H 1 8.179 0 . 1 . . . . A 678 ASN H . 31155 1
444 . 1 . 1 42 42 ASN HA H 1 4.632 0 . 1 . . . . A 678 ASN HA . 31155 1
445 . 1 . 1 42 42 ASN HB2 H 1 3.236 0 . 2 . . . . A 678 ASN HB2 . 31155 1
446 . 1 . 1 42 42 ASN HB3 H 1 2.95 0 . 2 . . . . A 678 ASN HB3 . 31155 1
447 . 1 . 1 42 42 ASN C C 13 174.532 0 . 1 . . . . A 678 ASN C . 31155 1
448 . 1 . 1 42 42 ASN CA C 13 51.65 0 . 1 . . . . A 678 ASN CA . 31155 1
449 . 1 . 1 42 42 ASN CB C 13 36.639 0.008 . 1 . . . . A 678 ASN CB . 31155 1
450 . 1 . 1 42 42 ASN N N 15 111.656 0 . 1 . . . . A 678 ASN N . 31155 1
451 . 1 . 1 43 43 LYS H H 1 7.865 0 . 1 . . . . A 679 LYS H . 31155 1
452 . 1 . 1 43 43 LYS HA H 1 4.055 0 . 1 . . . . A 679 LYS HA . 31155 1
453 . 1 . 1 43 43 LYS HB2 H 1 1.804 0 . 2 . . . . A 679 LYS HB2 . 31155 1
454 . 1 . 1 43 43 LYS HB3 H 1 1.597 0 . 2 . . . . A 679 LYS HB3 . 31155 1
455 . 1 . 1 43 43 LYS HG2 H 1 1.24 0 . 2 . . . . A 679 LYS HG2 . 31155 1
456 . 1 . 1 43 43 LYS HG3 H 1 1.028 0 . 2 . . . . A 679 LYS HG3 . 31155 1
457 . 1 . 1 43 43 LYS HD2 H 1 1.587 0 . 2 . . . . A 679 LYS HD2 . 31155 1
458 . 1 . 1 43 43 LYS HD3 H 1 1.471 0 . 2 . . . . A 679 LYS HD3 . 31155 1
459 . 1 . 1 43 43 LYS HE2 H 1 3.041 0 . 2 . . . . A 679 LYS HE2 . 31155 1
460 . 1 . 1 43 43 LYS HE3 H 1 3.041 0 . 2 . . . . A 679 LYS HE3 . 31155 1
461 . 1 . 1 43 43 LYS C C 13 176.135 0 . 1 . . . . A 679 LYS C . 31155 1
462 . 1 . 1 43 43 LYS CA C 13 55.534 0 . 1 . . . . A 679 LYS CA . 31155 1
463 . 1 . 1 43 43 LYS CB C 13 28.426 0.002 . 1 . . . . A 679 LYS CB . 31155 1
464 . 1 . 1 43 43 LYS CG C 13 24.072 0 . 1 . . . . A 679 LYS CG . 31155 1
465 . 1 . 1 43 43 LYS CD C 13 27.019 0.008 . 1 . . . . A 679 LYS CD . 31155 1
466 . 1 . 1 43 43 LYS CE C 13 42.46 0 . 1 . . . . A 679 LYS CE . 31155 1
467 . 1 . 1 43 43 LYS N N 15 115.732 0 . 1 . . . . A 679 LYS N . 31155 1
468 . 1 . 1 44 44 ASP H H 1 8.425 0 . 1 . . . . A 680 ASP H . 31155 1
469 . 1 . 1 44 44 ASP HA H 1 4.609 0 . 1 . . . . A 680 ASP HA . 31155 1
470 . 1 . 1 44 44 ASP HB2 H 1 3.027 0 . 2 . . . . A 680 ASP HB2 . 31155 1
471 . 1 . 1 44 44 ASP HB3 H 1 2.341 0 . 2 . . . . A 680 ASP HB3 . 31155 1
472 . 1 . 1 44 44 ASP C C 13 178.052 0 . 1 . . . . A 680 ASP C . 31155 1
473 . 1 . 1 44 44 ASP CA C 13 52.598 0 . 1 . . . . A 680 ASP CA . 31155 1
474 . 1 . 1 44 44 ASP CB C 13 40.946 0.028 . 1 . . . . A 680 ASP CB . 31155 1
475 . 1 . 1 44 44 ASP N N 15 118.048 0 . 1 . . . . A 680 ASP N . 31155 1
476 . 1 . 1 45 45 GLY H H 1 10.582 0 . 1 . . . . A 681 GLY H . 31155 1
477 . 1 . 1 45 45 GLY HA2 H 1 3.492 0 . 2 . . . . A 681 GLY HA2 . 31155 1
478 . 1 . 1 45 45 GLY HA3 H 1 4.151 0 . 2 . . . . A 681 GLY HA3 . 31155 1
479 . 1 . 1 45 45 GLY C C 13 173.998 0 . 1 . . . . A 681 GLY C . 31155 1
480 . 1 . 1 45 45 GLY CA C 13 45.596 0 . 1 . . . . A 681 GLY CA . 31155 1
481 . 1 . 1 45 45 GLY N N 15 112.956 0 . 1 . . . . A 681 GLY N . 31155 1
482 . 1 . 1 46 46 LYS H H 1 8.363 0 . 1 . . . . A 682 LYS H . 31155 1
483 . 1 . 1 46 46 LYS HA H 1 5.052 0 . 1 . . . . A 682 LYS HA . 31155 1
484 . 1 . 1 46 46 LYS HB2 H 1 1.853 0 . 2 . . . . A 682 LYS HB2 . 31155 1
485 . 1 . 1 46 46 LYS HB3 H 1 1.768 0 . 2 . . . . A 682 LYS HB3 . 31155 1
486 . 1 . 1 46 46 LYS HG2 H 1 1.171 0 . 2 . . . . A 682 LYS HG2 . 31155 1
487 . 1 . 1 46 46 LYS HG3 H 1 1.072 0 . 2 . . . . A 682 LYS HG3 . 31155 1
488 . 1 . 1 46 46 LYS HD2 H 1 1.644 0 . 2 . . . . A 682 LYS HD2 . 31155 1
489 . 1 . 1 46 46 LYS HD3 H 1 1.506 0 . 2 . . . . A 682 LYS HD3 . 31155 1
490 . 1 . 1 46 46 LYS HE2 H 1 2.827 0 . 2 . . . . A 682 LYS HE2 . 31155 1
491 . 1 . 1 46 46 LYS HE3 H 1 2.827 0 . 2 . . . . A 682 LYS HE3 . 31155 1
492 . 1 . 1 46 46 LYS C C 13 175.412 0 . 1 . . . . A 682 LYS C . 31155 1
493 . 1 . 1 46 46 LYS CA C 13 54.764 0 . 1 . . . . A 682 LYS CA . 31155 1
494 . 1 . 1 46 46 LYS CB C 13 34.681 0.021 . 1 . . . . A 682 LYS CB . 31155 1
495 . 1 . 1 46 46 LYS CG C 13 24.661 0.005 . 1 . . . . A 682 LYS CG . 31155 1
496 . 1 . 1 46 46 LYS CD C 13 28.988 0.011 . 1 . . . . A 682 LYS CD . 31155 1
497 . 1 . 1 46 46 LYS CE C 13 41.952 0 . 1 . . . . A 682 LYS CE . 31155 1
498 . 1 . 1 46 46 LYS N N 15 120.916 0 . 1 . . . . A 682 LYS N . 31155 1
499 . 1 . 1 47 47 VAL H H 1 8.905 0 . 1 . . . . A 683 VAL H . 31155 1
500 . 1 . 1 47 47 VAL HA H 1 4.862 0 . 1 . . . . A 683 VAL HA . 31155 1
501 . 1 . 1 47 47 VAL HB H 1 2.128 0 . 1 . . . . A 683 VAL HB . 31155 1
502 . 1 . 1 47 47 VAL HG11 H 1 0.804 0 . 2 . . . . A 683 VAL HG11 . 31155 1
503 . 1 . 1 47 47 VAL HG12 H 1 0.804 0 . 2 . . . . A 683 VAL HG12 . 31155 1
504 . 1 . 1 47 47 VAL HG13 H 1 0.804 0 . 2 . . . . A 683 VAL HG13 . 31155 1
505 . 1 . 1 47 47 VAL HG21 H 1 0.628 0 . 2 . . . . A 683 VAL HG21 . 31155 1
506 . 1 . 1 47 47 VAL HG22 H 1 0.628 0 . 2 . . . . A 683 VAL HG22 . 31155 1
507 . 1 . 1 47 47 VAL HG23 H 1 0.628 0 . 2 . . . . A 683 VAL HG23 . 31155 1
508 . 1 . 1 47 47 VAL C C 13 173.841 0 . 1 . . . . A 683 VAL C . 31155 1
509 . 1 . 1 47 47 VAL CA C 13 58.905 0 . 1 . . . . A 683 VAL CA . 31155 1
510 . 1 . 1 47 47 VAL CB C 13 35.246 0 . 1 . . . . A 683 VAL CB . 31155 1
511 . 1 . 1 47 47 VAL CG1 C 13 22.174 0 . 2 . . . . A 683 VAL CG1 . 31155 1
512 . 1 . 1 47 47 VAL CG2 C 13 19.189 0 . 2 . . . . A 683 VAL CG2 . 31155 1
513 . 1 . 1 47 47 VAL N N 15 117.677 0 . 1 . . . . A 683 VAL N . 31155 1
514 . 1 . 1 48 48 ASN H H 1 9.935 0 . 1 . . . . A 684 ASN H . 31155 1
515 . 1 . 1 48 48 ASN HA H 1 4.929 0 . 1 . . . . A 684 ASN HA . 31155 1
516 . 1 . 1 48 48 ASN HB2 H 1 3.072 0 . 2 . . . . A 684 ASN HB2 . 31155 1
517 . 1 . 1 48 48 ASN HB3 H 1 2.964 0 . 2 . . . . A 684 ASN HB3 . 31155 1
518 . 1 . 1 48 48 ASN C C 13 176.544 0 . 1 . . . . A 684 ASN C . 31155 1
519 . 1 . 1 48 48 ASN CA C 13 52.367 0 . 1 . . . . A 684 ASN CA . 31155 1
520 . 1 . 1 48 48 ASN CB C 13 38.606 0.003 . 1 . . . . A 684 ASN CB . 31155 1
521 . 1 . 1 48 48 ASN N N 15 122.308 0 . 1 . . . . A 684 ASN N . 31155 1
522 . 1 . 1 49 49 ILE H H 1 8.715 0 . 1 . . . . A 685 ILE H . 31155 1
523 . 1 . 1 49 49 ILE HA H 1 3.512 0 . 1 . . . . A 685 ILE HA . 31155 1
524 . 1 . 1 49 49 ILE HB H 1 1.813 0 . 1 . . . . A 685 ILE HB . 31155 1
525 . 1 . 1 49 49 ILE HG12 H 1 0.89 0 . 2 . . . . A 685 ILE HG12 . 31155 1
526 . 1 . 1 49 49 ILE HG13 H 1 0.89 0 . 2 . . . . A 685 ILE HG13 . 31155 1
527 . 1 . 1 49 49 ILE HG21 H 1 0.86 0 . 1 . . . . A 685 ILE HG21 . 31155 1
528 . 1 . 1 49 49 ILE HG22 H 1 0.86 0 . 1 . . . . A 685 ILE HG22 . 31155 1
529 . 1 . 1 49 49 ILE HG23 H 1 0.86 0 . 1 . . . . A 685 ILE HG23 . 31155 1
530 . 1 . 1 49 49 ILE HD11 H 1 0.762 0 . 1 . . . . A 685 ILE HD11 . 31155 1
531 . 1 . 1 49 49 ILE HD12 H 1 0.762 0 . 1 . . . . A 685 ILE HD12 . 31155 1
532 . 1 . 1 49 49 ILE HD13 H 1 0.762 0 . 1 . . . . A 685 ILE HD13 . 31155 1
533 . 1 . 1 49 49 ILE C C 13 176.261 0 . 1 . . . . A 685 ILE C . 31155 1
534 . 1 . 1 49 49 ILE CA C 13 64.774 0 . 1 . . . . A 685 ILE CA . 31155 1
535 . 1 . 1 49 49 ILE CB C 13 38.615 0 . 1 . . . . A 685 ILE CB . 31155 1
536 . 1 . 1 49 49 ILE CG1 C 13 29.884 0 . 1 . . . . A 685 ILE CG1 . 31155 1
537 . 1 . 1 49 49 ILE CG2 C 13 17.747 0 . 1 . . . . A 685 ILE CG2 . 31155 1
538 . 1 . 1 49 49 ILE CD1 C 13 13.662 0 . 1 . . . . A 685 ILE CD1 . 31155 1
539 . 1 . 1 49 49 ILE N N 15 126.847 0 . 1 . . . . A 685 ILE N . 31155 1
540 . 1 . 1 50 50 ASP H H 1 8.51 0 . 1 . . . . A 686 ASP H . 31155 1
541 . 1 . 1 50 50 ASP HA H 1 4.232 0 . 1 . . . . A 686 ASP HA . 31155 1
542 . 1 . 1 50 50 ASP HB2 H 1 2.614 0 . 2 . . . . A 686 ASP HB2 . 31155 1
543 . 1 . 1 50 50 ASP HB3 H 1 2.586 0 . 2 . . . . A 686 ASP HB3 . 31155 1
544 . 1 . 1 50 50 ASP C C 13 178.9 0 . 1 . . . . A 686 ASP C . 31155 1
545 . 1 . 1 50 50 ASP CA C 13 57.415 0 . 1 . . . . A 686 ASP CA . 31155 1
546 . 1 . 1 50 50 ASP CB C 13 39.896 0 . 1 . . . . A 686 ASP CB . 31155 1
547 . 1 . 1 50 50 ASP N N 15 118.048 0 . 1 . . . . A 686 ASP N . 31155 1
548 . 1 . 1 51 51 ASP H H 1 7.3 0 . 1 . . . . A 687 ASP H . 31155 1
549 . 1 . 1 51 51 ASP HA H 1 4.512 0 . 1 . . . . A 687 ASP HA . 31155 1
550 . 1 . 1 51 51 ASP HB2 H 1 2.993 0 . 2 . . . . A 687 ASP HB2 . 31155 1
551 . 1 . 1 51 51 ASP HB3 H 1 2.67 0 . 2 . . . . A 687 ASP HB3 . 31155 1
552 . 1 . 1 51 51 ASP C C 13 177.015 0 . 1 . . . . A 687 ASP C . 31155 1
553 . 1 . 1 51 51 ASP CA C 13 57.347 0 . 1 . . . . A 687 ASP CA . 31155 1
554 . 1 . 1 51 51 ASP CB C 13 41.074 0.002 . 1 . . . . A 687 ASP CB . 31155 1
555 . 1 . 1 51 51 ASP N N 15 119.9 0 . 1 . . . . A 687 ASP N . 31155 1
556 . 1 . 1 52 52 LEU H H 1 7.806 0 . 1 . . . . A 688 LEU H . 31155 1
557 . 1 . 1 52 52 LEU HA H 1 3.888 0 . 1 . . . . A 688 LEU HA . 31155 1
558 . 1 . 1 52 52 LEU HB2 H 1 2.046 0 . 2 . . . . A 688 LEU HB2 . 31155 1
559 . 1 . 1 52 52 LEU HB3 H 1 1.331 0 . 2 . . . . A 688 LEU HB3 . 31155 1
560 . 1 . 1 52 52 LEU HD11 H 1 0.779 0 . 2 . . . . A 688 LEU HD11 . 31155 1
561 . 1 . 1 52 52 LEU HD12 H 1 0.779 0 . 2 . . . . A 688 LEU HD12 . 31155 1
562 . 1 . 1 52 52 LEU HD13 H 1 0.779 0 . 2 . . . . A 688 LEU HD13 . 31155 1
563 . 1 . 1 52 52 LEU HD21 H 1 0.72 0 . 2 . . . . A 688 LEU HD21 . 31155 1
564 . 1 . 1 52 52 LEU HD22 H 1 0.72 0 . 2 . . . . A 688 LEU HD22 . 31155 1
565 . 1 . 1 52 52 LEU HD23 H 1 0.72 0 . 2 . . . . A 688 LEU HD23 . 31155 1
566 . 1 . 1 52 52 LEU C C 13 178.303 0 . 1 . . . . A 688 LEU C . 31155 1
567 . 1 . 1 52 52 LEU CA C 13 58.147 0 . 1 . . . . A 688 LEU CA . 31155 1
568 . 1 . 1 52 52 LEU CB C 13 41.451 0.02 . 1 . . . . A 688 LEU CB . 31155 1
569 . 1 . 1 52 52 LEU CD1 C 13 25.465 0 . 2 . . . . A 688 LEU CD1 . 31155 1
570 . 1 . 1 52 52 LEU CD2 C 13 23.467 0 . 2 . . . . A 688 LEU CD2 . 31155 1
571 . 1 . 1 52 52 LEU N N 15 120.918 0 . 1 . . . . A 688 LEU N . 31155 1
572 . 1 . 1 53 53 VAL H H 1 8.433 0 . 1 . . . . A 689 VAL H . 31155 1
573 . 1 . 1 53 53 VAL HA H 1 3.425 0 . 1 . . . . A 689 VAL HA . 31155 1
574 . 1 . 1 53 53 VAL HB H 1 1.928 0 . 1 . . . . A 689 VAL HB . 31155 1
575 . 1 . 1 53 53 VAL HG11 H 1 0.85 0 . 2 . . . . A 689 VAL HG11 . 31155 1
576 . 1 . 1 53 53 VAL HG12 H 1 0.85 0 . 2 . . . . A 689 VAL HG12 . 31155 1
577 . 1 . 1 53 53 VAL HG13 H 1 0.85 0 . 2 . . . . A 689 VAL HG13 . 31155 1
578 . 1 . 1 53 53 VAL HG21 H 1 0.795 0 . 2 . . . . A 689 VAL HG21 . 31155 1
579 . 1 . 1 53 53 VAL HG22 H 1 0.795 0 . 2 . . . . A 689 VAL HG22 . 31155 1
580 . 1 . 1 53 53 VAL HG23 H 1 0.795 0 . 2 . . . . A 689 VAL HG23 . 31155 1
581 . 1 . 1 53 53 VAL C C 13 177.486 0 . 1 . . . . A 689 VAL C . 31155 1
582 . 1 . 1 53 53 VAL CA C 13 66.735 0 . 1 . . . . A 689 VAL CA . 31155 1
583 . 1 . 1 53 53 VAL CB C 13 31.521 0 . 1 . . . . A 689 VAL CB . 31155 1
584 . 1 . 1 53 53 VAL CG1 C 13 21.701 0 . 2 . . . . A 689 VAL CG1 . 31155 1
585 . 1 . 1 53 53 VAL CG2 C 13 21.438 0 . 2 . . . . A 689 VAL CG2 . 31155 1
586 . 1 . 1 53 53 VAL N N 15 116.982 0 . 1 . . . . A 689 VAL N . 31155 1
587 . 1 . 1 54 54 LYS H H 1 7.469 0 . 1 . . . . A 690 LYS H . 31155 1
588 . 1 . 1 54 54 LYS HA H 1 4.02 0 . 1 . . . . A 690 LYS HA . 31155 1
589 . 1 . 1 54 54 LYS HB2 H 1 1.859 0 . 2 . . . . A 690 LYS HB2 . 31155 1
590 . 1 . 1 54 54 LYS HB3 H 1 1.851 0 . 2 . . . . A 690 LYS HB3 . 31155 1
591 . 1 . 1 54 54 LYS HG2 H 1 1.564 0 . 2 . . . . A 690 LYS HG2 . 31155 1
592 . 1 . 1 54 54 LYS HG3 H 1 1.461 0 . 2 . . . . A 690 LYS HG3 . 31155 1
593 . 1 . 1 54 54 LYS HD2 H 1 1.629 0 . 2 . . . . A 690 LYS HD2 . 31155 1
594 . 1 . 1 54 54 LYS HD3 H 1 1.408 0 . 2 . . . . A 690 LYS HD3 . 31155 1
595 . 1 . 1 54 54 LYS HE2 H 1 2.942 0 . 2 . . . . A 690 LYS HE2 . 31155 1
596 . 1 . 1 54 54 LYS HE3 H 1 2.942 0 . 2 . . . . A 690 LYS HE3 . 31155 1
597 . 1 . 1 54 54 LYS C C 13 178.995 0 . 1 . . . . A 690 LYS C . 31155 1
598 . 1 . 1 54 54 LYS CA C 13 58.767 0 . 1 . . . . A 690 LYS CA . 31155 1
599 . 1 . 1 54 54 LYS CB C 13 32.238 0 . 1 . . . . A 690 LYS CB . 31155 1
600 . 1 . 1 54 54 LYS CG C 13 25.016 0 . 1 . . . . A 690 LYS CG . 31155 1
601 . 1 . 1 54 54 LYS CD C 13 29.112 0.028 . 1 . . . . A 690 LYS CD . 31155 1
602 . 1 . 1 54 54 LYS CE C 13 41.766 0 . 1 . . . . A 690 LYS CE . 31155 1
603 . 1 . 1 54 54 LYS N N 15 118.279 0 . 1 . . . . A 690 LYS N . 31155 1
604 . 1 . 1 55 55 VAL H H 1 7.841 0 . 1 . . . . A 691 VAL H . 31155 1
605 . 1 . 1 55 55 VAL HA H 1 3.742 0 . 1 . . . . A 691 VAL HA . 31155 1
606 . 1 . 1 55 55 VAL HB H 1 1.95 0 . 1 . . . . A 691 VAL HB . 31155 1
607 . 1 . 1 55 55 VAL HG11 H 1 0.95 0 . 2 . . . . A 691 VAL HG11 . 31155 1
608 . 1 . 1 55 55 VAL HG12 H 1 0.95 0 . 2 . . . . A 691 VAL HG12 . 31155 1
609 . 1 . 1 55 55 VAL HG13 H 1 0.95 0 . 2 . . . . A 691 VAL HG13 . 31155 1
610 . 1 . 1 55 55 VAL HG21 H 1 0.783 0 . 2 . . . . A 691 VAL HG21 . 31155 1
611 . 1 . 1 55 55 VAL HG22 H 1 0.783 0 . 2 . . . . A 691 VAL HG22 . 31155 1
612 . 1 . 1 55 55 VAL HG23 H 1 0.783 0 . 2 . . . . A 691 VAL HG23 . 31155 1
613 . 1 . 1 55 55 VAL C C 13 177.361 0 . 1 . . . . A 691 VAL C . 31155 1
614 . 1 . 1 55 55 VAL CA C 13 65.626 0 . 1 . . . . A 691 VAL CA . 31155 1
615 . 1 . 1 55 55 VAL CB C 13 31.561 0 . 1 . . . . A 691 VAL CB . 31155 1
616 . 1 . 1 55 55 VAL CG1 C 13 23.809 0 . 2 . . . . A 691 VAL CG1 . 31155 1
617 . 1 . 1 55 55 VAL CG2 C 13 22.35 0 . 2 . . . . A 691 VAL CG2 . 31155 1
618 . 1 . 1 55 55 VAL N N 15 116.982 0 . 1 . . . . A 691 VAL N . 31155 1
619 . 1 . 1 56 56 ILE H H 1 8.19 0 . 1 . . . . A 692 ILE H . 31155 1
620 . 1 . 1 56 56 ILE HA H 1 3.485 0 . 1 . . . . A 692 ILE HA . 31155 1
621 . 1 . 1 56 56 ILE HB H 1 1.936 0 . 1 . . . . A 692 ILE HB . 31155 1
622 . 1 . 1 56 56 ILE HG12 H 1 0.969 0 . 2 . . . . A 692 ILE HG12 . 31155 1
623 . 1 . 1 56 56 ILE HG13 H 1 0.969 0 . 2 . . . . A 692 ILE HG13 . 31155 1
624 . 1 . 1 56 56 ILE HG21 H 1 0.824 0 . 1 . . . . A 692 ILE HG21 . 31155 1
625 . 1 . 1 56 56 ILE HG22 H 1 0.824 0 . 1 . . . . A 692 ILE HG22 . 31155 1
626 . 1 . 1 56 56 ILE HG23 H 1 0.824 0 . 1 . . . . A 692 ILE HG23 . 31155 1
627 . 1 . 1 56 56 ILE HD11 H 1 0.653 0 . 1 . . . . A 692 ILE HD11 . 31155 1
628 . 1 . 1 56 56 ILE HD12 H 1 0.653 0 . 1 . . . . A 692 ILE HD12 . 31155 1
629 . 1 . 1 56 56 ILE HD13 H 1 0.653 0 . 1 . . . . A 692 ILE HD13 . 31155 1
630 . 1 . 1 56 56 ILE C C 13 177.581 0 . 1 . . . . A 692 ILE C . 31155 1
631 . 1 . 1 56 56 ILE CA C 13 65.132 0 . 1 . . . . A 692 ILE CA . 31155 1
632 . 1 . 1 56 56 ILE CB C 13 37.151 0 . 1 . . . . A 692 ILE CB . 31155 1
633 . 1 . 1 56 56 ILE CG1 C 13 29.364 0 . 1 . . . . A 692 ILE CG1 . 31155 1
634 . 1 . 1 56 56 ILE CG2 C 13 17.382 0 . 1 . . . . A 692 ILE CG2 . 31155 1
635 . 1 . 1 56 56 ILE CD1 C 13 13.18 0 . 1 . . . . A 692 ILE CD1 . 31155 1
636 . 1 . 1 56 56 ILE N N 15 119.761 0 . 1 . . . . A 692 ILE N . 31155 1
637 . 1 . 1 57 57 GLU H H 1 7.999 0 . 1 . . . . A 693 GLU H . 31155 1
638 . 1 . 1 57 57 GLU HA H 1 4.173 0 . 1 . . . . A 693 GLU HA . 31155 1
639 . 1 . 1 57 57 GLU HB2 H 1 2.038 0 . 2 . . . . A 693 GLU HB2 . 31155 1
640 . 1 . 1 57 57 GLU HB3 H 1 2.019 0 . 2 . . . . A 693 GLU HB3 . 31155 1
641 . 1 . 1 57 57 GLU HG2 H 1 2.279 0 . 2 . . . . A 693 GLU HG2 . 31155 1
642 . 1 . 1 57 57 GLU HG3 H 1 2.254 0 . 2 . . . . A 693 GLU HG3 . 31155 1
643 . 1 . 1 57 57 GLU C C 13 179.089 0 . 1 . . . . A 693 GLU C . 31155 1
644 . 1 . 1 57 57 GLU CA C 13 58.411 0 . 1 . . . . A 693 GLU CA . 31155 1
645 . 1 . 1 57 57 GLU CB C 13 29.602 0.001 . 1 . . . . A 693 GLU CB . 31155 1
646 . 1 . 1 57 57 GLU CG C 13 36.74 0.002 . 1 . . . . A 693 GLU CG . 31155 1
647 . 1 . 1 57 57 GLU N N 15 117.677 0 . 1 . . . . A 693 GLU N . 31155 1
648 . 1 . 1 58 58 LEU H H 1 8.169 0 . 1 . . . . A 694 LEU H . 31155 1
649 . 1 . 1 58 58 LEU HA H 1 3.883 0 . 1 . . . . A 694 LEU HA . 31155 1
650 . 1 . 1 58 58 LEU HB2 H 1 1.971 0 . 2 . . . . A 694 LEU HB2 . 31155 1
651 . 1 . 1 58 58 LEU HB3 H 1 1.527 0 . 2 . . . . A 694 LEU HB3 . 31155 1
652 . 1 . 1 58 58 LEU HD11 H 1 0.711 0 . 2 . . . . A 694 LEU HD11 . 31155 1
653 . 1 . 1 58 58 LEU HD12 H 1 0.711 0 . 2 . . . . A 694 LEU HD12 . 31155 1
654 . 1 . 1 58 58 LEU HD13 H 1 0.711 0 . 2 . . . . A 694 LEU HD13 . 31155 1
655 . 1 . 1 58 58 LEU HD21 H 1 0.816 0 . 2 . . . . A 694 LEU HD21 . 31155 1
656 . 1 . 1 58 58 LEU HD22 H 1 0.816 0 . 2 . . . . A 694 LEU HD22 . 31155 1
657 . 1 . 1 58 58 LEU HD23 H 1 0.816 0 . 2 . . . . A 694 LEU HD23 . 31155 1
658 . 1 . 1 58 58 LEU C C 13 178.021 0 . 1 . . . . A 694 LEU C . 31155 1
659 . 1 . 1 58 58 LEU CA C 13 57.759 0 . 1 . . . . A 694 LEU CA . 31155 1
660 . 1 . 1 58 58 LEU CB C 13 41.719 0.002 . 1 . . . . A 694 LEU CB . 31155 1
661 . 1 . 1 58 58 LEU CD1 C 13 24.478 0 . 2 . . . . A 694 LEU CD1 . 31155 1
662 . 1 . 1 58 58 LEU CD2 C 13 24.82 0 . 2 . . . . A 694 LEU CD2 . 31155 1
663 . 1 . 1 58 58 LEU N N 15 122.308 0 . 1 . . . . A 694 LEU N . 31155 1
664 . 1 . 1 59 59 VAL H H 1 8.13 0 . 1 . . . . A 695 VAL H . 31155 1
665 . 1 . 1 59 59 VAL HA H 1 3.624 0 . 1 . . . . A 695 VAL HA . 31155 1
666 . 1 . 1 59 59 VAL HB H 1 2.03 0 . 1 . . . . A 695 VAL HB . 31155 1
667 . 1 . 1 59 59 VAL HG11 H 1 0.884 0 . 2 . . . . A 695 VAL HG11 . 31155 1
668 . 1 . 1 59 59 VAL HG12 H 1 0.884 0 . 2 . . . . A 695 VAL HG12 . 31155 1
669 . 1 . 1 59 59 VAL HG13 H 1 0.884 0 . 2 . . . . A 695 VAL HG13 . 31155 1
670 . 1 . 1 59 59 VAL HG21 H 1 0.922 0 . 2 . . . . A 695 VAL HG21 . 31155 1
671 . 1 . 1 59 59 VAL HG22 H 1 0.922 0 . 2 . . . . A 695 VAL HG22 . 31155 1
672 . 1 . 1 59 59 VAL HG23 H 1 0.922 0 . 2 . . . . A 695 VAL HG23 . 31155 1
673 . 1 . 1 59 59 VAL CA C 13 66.187 0 . 1 . . . . A 695 VAL CA . 31155 1
674 . 1 . 1 59 59 VAL CB C 13 32.107 0 . 1 . . . . A 695 VAL CB . 31155 1
675 . 1 . 1 59 59 VAL CG1 C 13 21.394 0 . 2 . . . . A 695 VAL CG1 . 31155 1
676 . 1 . 1 59 59 VAL CG2 C 13 20.874 0 . 2 . . . . A 695 VAL CG2 . 31155 1
677 . 1 . 1 59 59 VAL N N 15 116.751 0 . 1 . . . . A 695 VAL N . 31155 1
678 . 1 . 1 60 60 ASP H H 1 8.486 0 . 1 . . . . A 696 ASP H . 31155 1
679 . 1 . 1 60 60 ASP HA H 1 4.575 0 . 1 . . . . A 696 ASP HA . 31155 1
680 . 1 . 1 60 60 ASP HB2 H 1 2.699 0 . 2 . . . . A 696 ASP HB2 . 31155 1
681 . 1 . 1 60 60 ASP HB3 H 1 2.622 0 . 2 . . . . A 696 ASP HB3 . 31155 1
682 . 1 . 1 60 60 ASP C C 13 175.852 0 . 1 . . . . A 696 ASP C . 31155 1
683 . 1 . 1 60 60 ASP CA C 13 54.393 0 . 1 . . . . A 696 ASP CA . 31155 1
684 . 1 . 1 60 60 ASP CB C 13 41.606 0 . 1 . . . . A 696 ASP CB . 31155 1
685 . 1 . 1 60 60 ASP N N 15 119.162 0 . 1 . . . . A 696 ASP N . 31155 1
686 . 1 . 1 61 61 LYS H H 1 8.052 0 . 1 . . . . A 697 LYS H . 31155 1
687 . 1 . 1 61 61 LYS HA H 1 4.281 0 . 1 . . . . A 697 LYS HA . 31155 1
688 . 1 . 1 61 61 LYS HB2 H 1 1.834 0 . 2 . . . . A 697 LYS HB2 . 31155 1
689 . 1 . 1 61 61 LYS HB3 H 1 1.761 0 . 2 . . . . A 697 LYS HB3 . 31155 1
690 . 1 . 1 61 61 LYS HG2 H 1 1.406 0 . 2 . . . . A 697 LYS HG2 . 31155 1
691 . 1 . 1 61 61 LYS HG3 H 1 1.333 0 . 2 . . . . A 697 LYS HG3 . 31155 1
692 . 1 . 1 61 61 LYS HD2 H 1 1.638 0 . 2 . . . . A 697 LYS HD2 . 31155 1
693 . 1 . 1 61 61 LYS HD3 H 1 1.481 0 . 2 . . . . A 697 LYS HD3 . 31155 1
694 . 1 . 1 61 61 LYS HE2 H 1 2.96 0 . 2 . . . . A 697 LYS HE2 . 31155 1
695 . 1 . 1 61 61 LYS HE3 H 1 2.96 0 . 2 . . . . A 697 LYS HE3 . 31155 1
696 . 1 . 1 61 61 LYS C C 13 176.324 0 . 1 . . . . A 697 LYS C . 31155 1
697 . 1 . 1 61 61 LYS CA C 13 56.095 0 . 1 . . . . A 697 LYS CA . 31155 1
698 . 1 . 1 61 61 LYS CB C 13 33.054 0.003 . 1 . . . . A 697 LYS CB . 31155 1
699 . 1 . 1 61 61 LYS CG C 13 24.619 0.012 . 1 . . . . A 697 LYS CG . 31155 1
700 . 1 . 1 61 61 LYS CD C 13 29.084 0 . 1 . . . . A 697 LYS CD . 31155 1
701 . 1 . 1 61 61 LYS CE C 13 41.969 0 . 1 . . . . A 697 LYS CE . 31155 1
702 . 1 . 1 61 61 LYS N N 15 121.567 0 . 1 . . . . A 697 LYS N . 31155 1
703 . 1 . 1 62 62 GLU H H 1 8.434 0 . 1 . . . . A 698 GLU H . 31155 1
704 . 1 . 1 62 62 GLU HA H 1 4.275 0 . 1 . . . . A 698 GLU HA . 31155 1
705 . 1 . 1 62 62 GLU HB2 H 1 2.006 0 . 2 . . . . A 698 GLU HB2 . 31155 1
706 . 1 . 1 62 62 GLU HB3 H 1 1.874 0 . 2 . . . . A 698 GLU HB3 . 31155 1
707 . 1 . 1 62 62 GLU HG2 H 1 2.229 0 . 2 . . . . A 698 GLU HG2 . 31155 1
708 . 1 . 1 62 62 GLU HG3 H 1 2.205 0 . 2 . . . . A 698 GLU HG3 . 31155 1
709 . 1 . 1 62 62 GLU C C 13 175.192 0 . 1 . . . . A 698 GLU C . 31155 1
710 . 1 . 1 62 62 GLU CA C 13 56.446 0 . 1 . . . . A 698 GLU CA . 31155 1
711 . 1 . 1 62 62 GLU CB C 13 30.368 0.013 . 1 . . . . A 698 GLU CB . 31155 1
712 . 1 . 1 62 62 GLU CG C 13 36.058 0.025 . 1 . . . . A 698 GLU CG . 31155 1
713 . 1 . 1 62 62 GLU N N 15 123.23 0 . 1 . . . . A 698 GLU N . 31155 1
714 . 1 . 1 63 63 ASP H H 1 8.042 0 . 1 . . . . A 699 ASP H . 31155 1
715 . 1 . 1 63 63 ASP HA H 1 4.344 0 . 1 . . . . A 699 ASP HA . 31155 1
716 . 1 . 1 63 63 ASP HB2 H 1 2.585 0 . 2 . . . . A 699 ASP HB2 . 31155 1
717 . 1 . 1 63 63 ASP HB3 H 1 2.559 0 . 2 . . . . A 699 ASP HB3 . 31155 1
718 . 1 . 1 63 63 ASP CA C 13 55.468 0 . 1 . . . . A 699 ASP CA . 31155 1
719 . 1 . 1 63 63 ASP CB C 13 42.149 0 . 1 . . . . A 699 ASP CB . 31155 1
720 . 1 . 1 63 63 ASP N N 15 127.541 0 . 1 . . . . A 699 ASP N . 31155 1
stop_
save_