Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27439
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D HNCACB' . . . 27439 1
2 '3D HN(COCA)CB' . . . 27439 1
3 '3D HNCO' . . . 27439 1
4 '3D HNCA' . . . 27439 1
5 '3D HCACO' . . . 27439 1
6 '3D HBHA(CO)NH' . . . 27439 1
7 '3D HCCH-COSY' . . . 27439 1
8 '3D HCCH-TOCSY' . . . 27439 1
9 '3D H(CCO)NH' . . . 27439 1
10 '3D 1H-15N TOCSY' . . . 27439 1
11 '3D 1H-15N NOESY' . . . 27439 1
12 '3D 1H-13C NOESY' . . . 27439 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 ALA C C 13 173.805 0.000 . 1 . . . . . 1 ALA C . 27439 1
2 . 1 1 1 1 ALA CA C 13 51.590 0.138 . 1 . . . . . 1 ALA CA . 27439 1
3 . 1 1 1 1 ALA CB C 13 19.195 0.116 . 1 . . . . . 1 ALA CB . 27439 1
4 . 1 1 1 1 ALA HA H 1 4.066 0.009 . 1 . . . . . 1 ALA HA . 27439 1
5 . 1 1 1 1 ALA HB1 H 1 1.523 0.019 . 1 . . . . . 1 ALA HB1 . 27439 1
6 . 1 1 1 1 ALA HB2 H 1 1.523 0.019 . 1 . . . . . 1 ALA HB2 . 27439 1
7 . 1 1 1 1 ALA HB3 H 1 1.523 0.019 . 1 . . . . . 1 ALA HB3 . 27439 1
8 . 1 1 2 2 MET C C 13 176.550 0.000 . 1 . . . . . 2 MET C . 27439 1
9 . 1 1 2 2 MET CA C 13 55.741 0.083 . 1 . . . . . 2 MET CA . 27439 1
10 . 1 1 2 2 MET CB C 13 32.814 0.126 . 1 . . . . . 2 MET CB . 27439 1
11 . 1 1 2 2 MET CG C 13 31.749 0.000 . 1 . . . . . 2 MET CG . 27439 1
12 . 1 1 2 2 MET H H 1 8.701 0.009 . 1 . . . . . 2 MET H . 27439 1
13 . 1 1 2 2 MET HA H 1 4.449 0.000 . 1 . . . . . 2 MET HA . 27439 1
14 . 1 1 2 2 MET HB2 H 1 2.030 0.024 . 2 . . . . . 2 MET HB2 . 27439 1
15 . 1 1 2 2 MET HB3 H 1 2.066 0.000 . 2 . . . . . 2 MET HB3 . 27439 1
16 . 1 1 2 2 MET HG2 H 1 2.594 0.000 . 2 . . . . . 2 MET HG2 . 27439 1
17 . 1 1 2 2 MET HG3 H 1 2.559 0.000 . 2 . . . . . 2 MET HG3 . 27439 1
18 . 1 1 2 2 MET N N 15 120.269 0.084 . 1 . . . . . 2 MET N . 27439 1
19 . 1 1 3 3 GLY C C 13 172.789 0.000 . 1 . . . . . 3 GLY C . 27439 1
20 . 1 1 3 3 GLY CA C 13 45.251 0.083 . 1 . . . . . 3 GLY CA . 27439 1
21 . 1 1 3 3 GLY H H 1 8.470 0.013 . 1 . . . . . 3 GLY H . 27439 1
22 . 1 1 3 3 GLY HA2 H 1 3.891 0.012 . 2 . . . . . 3 GLY HA2 . 27439 1
23 . 1 1 3 3 GLY HA3 H 1 3.892 0.012 . 2 . . . . . 3 GLY HA3 . 27439 1
24 . 1 1 3 3 GLY N N 15 110.865 0.114 . 1 . . . . . 3 GLY N . 27439 1
25 . 1 1 4 4 CYS C C 13 173.767 0.000 . 1 . . . . . 4 CYS C . 27439 1
26 . 1 1 4 4 CYS CA C 13 54.331 0.091 . 1 . . . . . 4 CYS CA . 27439 1
27 . 1 1 4 4 CYS CB C 13 41.710 0.073 . 1 . . . . . 4 CYS CB . 27439 1
28 . 1 1 4 4 CYS H H 1 8.303 0.026 . 1 . . . . . 4 CYS H . 27439 1
29 . 1 1 4 4 CYS HA H 1 4.776 0.011 . 1 . . . . . 4 CYS HA . 27439 1
30 . 1 1 4 4 CYS HB2 H 1 2.962 0.020 . 2 . . . . . 4 CYS HB2 . 27439 1
31 . 1 1 4 4 CYS HB3 H 1 2.965 0.024 . 2 . . . . . 4 CYS HB3 . 27439 1
32 . 1 1 4 4 CYS N N 15 120.916 0.146 . 1 . . . . . 4 CYS N . 27439 1
33 . 1 1 5 5 LYS C C 13 176.961 0.000 . 1 . . . . . 5 LYS C . 27439 1
34 . 1 1 5 5 LYS CA C 13 57.346 0.150 . 1 . . . . . 5 LYS CA . 27439 1
35 . 1 1 5 5 LYS CB C 13 33.458 0.063 . 1 . . . . . 5 LYS CB . 27439 1
36 . 1 1 5 5 LYS CG C 13 25.275 0.042 . 1 . . . . . 5 LYS CG . 27439 1
37 . 1 1 5 5 LYS H H 1 8.688 0.016 . 1 . . . . . 5 LYS H . 27439 1
38 . 1 1 5 5 LYS HA H 1 4.088 0.014 . 1 . . . . . 5 LYS HA . 27439 1
39 . 1 1 5 5 LYS HB2 H 1 1.593 0.007 . 2 . . . . . 5 LYS HB2 . 27439 1
40 . 1 1 5 5 LYS HB3 H 1 1.712 0.015 . 2 . . . . . 5 LYS HB3 . 27439 1
41 . 1 1 5 5 LYS HG2 H 1 1.579 0.021 . 2 . . . . . 5 LYS HG2 . 27439 1
42 . 1 1 5 5 LYS HG3 H 1 1.581 0.020 . 2 . . . . . 5 LYS HG3 . 27439 1
43 . 1 1 5 5 LYS N N 15 130.087 0.119 . 1 . . . . . 5 LYS N . 27439 1
44 . 1 1 6 6 GLU CA C 13 58.496 0.105 . 1 . . . . . 6 GLU CA . 27439 1
45 . 1 1 6 6 GLU CB C 13 29.586 0.110 . 1 . . . . . 6 GLU CB . 27439 1
46 . 1 1 6 6 GLU H H 1 9.056 0.022 . 1 . . . . . 6 GLU H . 27439 1
47 . 1 1 6 6 GLU HA H 1 3.841 0.014 . 1 . . . . . 6 GLU HA . 27439 1
48 . 1 1 6 6 GLU HB2 H 1 1.690 0.020 . 1 . . . . . 6 GLU HB2 . 27439 1
49 . 1 1 6 6 GLU HB3 H 1 1.690 0.020 . 1 . . . . . 6 GLU HB3 . 27439 1
50 . 1 1 6 6 GLU HG2 H 1 2.132 0.013 . 1 . . . . . 6 GLU HG2 . 27439 1
51 . 1 1 6 6 GLU HG3 H 1 2.132 0.013 . 1 . . . . . 6 GLU HG3 . 27439 1
52 . 1 1 6 6 GLU N N 15 123.710 0.111 . 1 . . . . . 6 GLU N . 27439 1
53 . 1 1 7 7 ILE C C 13 174.478 0.000 . 1 . . . . . 7 ILE C . 27439 1
54 . 1 1 7 7 ILE CA C 13 58.406 0.097 . 1 . . . . . 7 ILE CA . 27439 1
55 . 1 1 7 7 ILE CB C 13 35.411 0.143 . 1 . . . . . 7 ILE CB . 27439 1
56 . 1 1 7 7 ILE CD1 C 13 10.832 0.083 . 1 . . . . . 7 ILE CD1 . 27439 1
57 . 1 1 7 7 ILE CG1 C 13 27.396 0.049 . 1 . . . . . 7 ILE CG1 . 27439 1
58 . 1 1 7 7 ILE CG2 C 13 18.710 0.053 . 1 . . . . . 7 ILE CG2 . 27439 1
59 . 1 1 7 7 ILE H H 1 8.286 0.009 . 1 . . . . . 7 ILE H . 27439 1
60 . 1 1 7 7 ILE HA H 1 3.948 0.013 . 1 . . . . . 7 ILE HA . 27439 1
61 . 1 1 7 7 ILE HB H 1 0.198 0.011 . 1 . . . . . 7 ILE HB . 27439 1
62 . 1 1 7 7 ILE HD11 H 1 0.595 0.009 . 1 . . . . . 7 ILE HD11 . 27439 1
63 . 1 1 7 7 ILE HD12 H 1 0.595 0.009 . 1 . . . . . 7 ILE HD12 . 27439 1
64 . 1 1 7 7 ILE HD13 H 1 0.595 0.009 . 1 . . . . . 7 ILE HD13 . 27439 1
65 . 1 1 7 7 ILE HG12 H 1 0.851 0.021 . 2 . . . . . 7 ILE HG12 . 27439 1
66 . 1 1 7 7 ILE HG13 H 1 1.165 0.011 . 2 . . . . . 7 ILE HG13 . 27439 1
67 . 1 1 7 7 ILE HG21 H 1 0.418 0.010 . 1 . . . . . 7 ILE HG21 . 27439 1
68 . 1 1 7 7 ILE HG22 H 1 0.418 0.010 . 1 . . . . . 7 ILE HG22 . 27439 1
69 . 1 1 7 7 ILE HG23 H 1 0.418 0.010 . 1 . . . . . 7 ILE HG23 . 27439 1
70 . 1 1 7 7 ILE N N 15 122.730 0.071 . 1 . . . . . 7 ILE N . 27439 1
71 . 1 1 8 8 GLU C C 13 175.070 0.000 . 1 . . . . . 8 GLU C . 27439 1
72 . 1 1 8 8 GLU CA C 13 53.972 0.082 . 1 . . . . . 8 GLU CA . 27439 1
73 . 1 1 8 8 GLU CB C 13 33.161 0.053 . 1 . . . . . 8 GLU CB . 27439 1
74 . 1 1 8 8 GLU CG C 13 36.537 0.016 . 1 . . . . . 8 GLU CG . 27439 1
75 . 1 1 8 8 GLU H H 1 7.905 0.018 . 1 . . . . . 8 GLU H . 27439 1
76 . 1 1 8 8 GLU HA H 1 4.998 0.009 . 1 . . . . . 8 GLU HA . 27439 1
77 . 1 1 8 8 GLU HB2 H 1 1.789 0.019 . 2 . . . . . 8 GLU HB2 . 27439 1
78 . 1 1 8 8 GLU HB3 H 1 1.607 0.013 . 2 . . . . . 8 GLU HB3 . 27439 1
79 . 1 1 8 8 GLU HG2 H 1 2.126 0.007 . 2 . . . . . 8 GLU HG2 . 27439 1
80 . 1 1 8 8 GLU HG3 H 1 2.143 0.020 . 2 . . . . . 8 GLU HG3 . 27439 1
81 . 1 1 8 8 GLU N N 15 121.868 0.098 . 1 . . . . . 8 GLU N . 27439 1
82 . 1 1 9 9 ILE C C 13 174.376 0.000 . 1 . . . . . 9 ILE C . 27439 1
83 . 1 1 9 9 ILE CA C 13 60.264 0.076 . 1 . . . . . 9 ILE CA . 27439 1
84 . 1 1 9 9 ILE CB C 13 39.734 0.107 . 1 . . . . . 9 ILE CB . 27439 1
85 . 1 1 9 9 ILE CD1 C 13 13.033 0.054 . 1 . . . . . 9 ILE CD1 . 27439 1
86 . 1 1 9 9 ILE CG1 C 13 26.949 0.065 . 1 . . . . . 9 ILE CG1 . 27439 1
87 . 1 1 9 9 ILE CG2 C 13 17.348 0.207 . 1 . . . . . 9 ILE CG2 . 27439 1
88 . 1 1 9 9 ILE H H 1 9.248 0.017 . 1 . . . . . 9 ILE H . 27439 1
89 . 1 1 9 9 ILE HA H 1 4.739 0.008 . 1 . . . . . 9 ILE HA . 27439 1
90 . 1 1 9 9 ILE HB H 1 1.501 0.017 . 1 . . . . . 9 ILE HB . 27439 1
91 . 1 1 9 9 ILE HD11 H 1 0.096 0.009 . 1 . . . . . 9 ILE HD11 . 27439 1
92 . 1 1 9 9 ILE HD12 H 1 0.096 0.009 . 1 . . . . . 9 ILE HD12 . 27439 1
93 . 1 1 9 9 ILE HD13 H 1 0.096 0.009 . 1 . . . . . 9 ILE HD13 . 27439 1
94 . 1 1 9 9 ILE HG12 H 1 0.752 0.038 . 2 . . . . . 9 ILE HG12 . 27439 1
95 . 1 1 9 9 ILE HG13 H 1 1.364 0.019 . 2 . . . . . 9 ILE HG13 . 27439 1
96 . 1 1 9 9 ILE HG21 H 1 0.726 0.022 . 1 . . . . . 9 ILE HG21 . 27439 1
97 . 1 1 9 9 ILE HG22 H 1 0.726 0.022 . 1 . . . . . 9 ILE HG22 . 27439 1
98 . 1 1 9 9 ILE HG23 H 1 0.726 0.022 . 1 . . . . . 9 ILE HG23 . 27439 1
99 . 1 1 9 9 ILE N N 15 123.544 0.065 . 1 . . . . . 9 ILE N . 27439 1
100 . 1 1 10 10 VAL C C 13 174.079 0.000 . 1 . . . . . 10 VAL C . 27439 1
101 . 1 1 10 10 VAL CA C 13 61.148 0.062 . 1 . . . . . 10 VAL CA . 27439 1
102 . 1 1 10 10 VAL CB C 13 33.204 0.057 . 1 . . . . . 10 VAL CB . 27439 1
103 . 1 1 10 10 VAL CG1 C 13 21.146 0.115 . 2 . . . . . 10 VAL CG1 . 27439 1
104 . 1 1 10 10 VAL CG2 C 13 21.045 0.116 . 2 . . . . . 10 VAL CG2 . 27439 1
105 . 1 1 10 10 VAL H H 1 9.256 0.023 . 1 . . . . . 10 VAL H . 27439 1
106 . 1 1 10 10 VAL HA H 1 4.571 0.013 . 1 . . . . . 10 VAL HA . 27439 1
107 . 1 1 10 10 VAL HB H 1 1.948 0.020 . 1 . . . . . 10 VAL HB . 27439 1
108 . 1 1 10 10 VAL HG11 H 1 0.766 0.022 . 2 . . . . . 10 VAL HG11 . 27439 1
109 . 1 1 10 10 VAL HG12 H 1 0.766 0.022 . 2 . . . . . 10 VAL HG12 . 27439 1
110 . 1 1 10 10 VAL HG13 H 1 0.766 0.022 . 2 . . . . . 10 VAL HG13 . 27439 1
111 . 1 1 10 10 VAL HG21 H 1 0.793 0.041 . 2 . . . . . 10 VAL HG21 . 27439 1
112 . 1 1 10 10 VAL HG22 H 1 0.793 0.041 . 2 . . . . . 10 VAL HG22 . 27439 1
113 . 1 1 10 10 VAL HG23 H 1 0.793 0.041 . 2 . . . . . 10 VAL HG23 . 27439 1
114 . 1 1 10 10 VAL N N 15 128.261 0.087 . 1 . . . . . 10 VAL N . 27439 1
115 . 1 1 11 11 ILE C C 13 175.118 0.000 . 1 . . . . . 11 ILE C . 27439 1
116 . 1 1 11 11 ILE CA C 13 58.945 0.054 . 1 . . . . . 11 ILE CA . 27439 1
117 . 1 1 11 11 ILE CB C 13 38.476 0.121 . 1 . . . . . 11 ILE CB . 27439 1
118 . 1 1 11 11 ILE CD1 C 13 12.813 0.049 . 1 . . . . . 11 ILE CD1 . 27439 1
119 . 1 1 11 11 ILE CG1 C 13 27.349 0.158 . 1 . . . . . 11 ILE CG1 . 27439 1
120 . 1 1 11 11 ILE CG2 C 13 17.656 0.028 . 1 . . . . . 11 ILE CG2 . 27439 1
121 . 1 1 11 11 ILE H H 1 9.202 0.013 . 1 . . . . . 11 ILE H . 27439 1
122 . 1 1 11 11 ILE HA H 1 4.835 0.012 . 1 . . . . . 11 ILE HA . 27439 1
123 . 1 1 11 11 ILE HB H 1 1.529 0.016 . 1 . . . . . 11 ILE HB . 27439 1
124 . 1 1 11 11 ILE HD11 H 1 0.763 0.018 . 1 . . . . . 11 ILE HD11 . 27439 1
125 . 1 1 11 11 ILE HD12 H 1 0.763 0.018 . 1 . . . . . 11 ILE HD12 . 27439 1
126 . 1 1 11 11 ILE HD13 H 1 0.763 0.018 . 1 . . . . . 11 ILE HD13 . 27439 1
127 . 1 1 11 11 ILE HG12 H 1 1.270 0.010 . 2 . . . . . 11 ILE HG12 . 27439 1
128 . 1 1 11 11 ILE HG13 H 1 1.262 0.010 . 2 . . . . . 11 ILE HG13 . 27439 1
129 . 1 1 11 11 ILE HG21 H 1 0.345 0.014 . 1 . . . . . 11 ILE HG21 . 27439 1
130 . 1 1 11 11 ILE HG22 H 1 0.345 0.014 . 1 . . . . . 11 ILE HG22 . 27439 1
131 . 1 1 11 11 ILE HG23 H 1 0.345 0.014 . 1 . . . . . 11 ILE HG23 . 27439 1
132 . 1 1 11 11 ILE N N 15 128.033 0.077 . 1 . . . . . 11 ILE N . 27439 1
133 . 1 1 12 12 LYS C C 13 175.387 0.000 . 1 . . . . . 12 LYS C . 27439 1
134 . 1 1 12 12 LYS CA C 13 54.570 0.134 . 1 . . . . . 12 LYS CA . 27439 1
135 . 1 1 12 12 LYS CB C 13 36.467 0.048 . 1 . . . . . 12 LYS CB . 27439 1
136 . 1 1 12 12 LYS CG C 13 24.991 0.000 . 1 . . . . . 12 LYS CG . 27439 1
137 . 1 1 12 12 LYS H H 1 8.588 0.021 . 1 . . . . . 12 LYS H . 27439 1
138 . 1 1 12 12 LYS HA H 1 5.194 0.007 . 1 . . . . . 12 LYS HA . 27439 1
139 . 1 1 12 12 LYS HB2 H 1 1.435 0.020 . 2 . . . . . 12 LYS HB2 . 27439 1
140 . 1 1 12 12 LYS HB3 H 1 1.635 0.018 . 2 . . . . . 12 LYS HB3 . 27439 1
141 . 1 1 12 12 LYS HG2 H 1 1.281 0.007 . 2 . . . . . 12 LYS HG2 . 27439 1
142 . 1 1 12 12 LYS HG3 H 1 1.175 0.001 . 2 . . . . . 12 LYS HG3 . 27439 1
143 . 1 1 12 12 LYS N N 15 123.492 0.071 . 1 . . . . . 12 LYS N . 27439 1
144 . 1 1 13 13 ASN C C 13 175.441 0.000 . 1 . . . . . 13 ASN C . 27439 1
145 . 1 1 13 13 ASN CA C 13 52.409 0.008 . 1 . . . . . 13 ASN CA . 27439 1
146 . 1 1 13 13 ASN CB C 13 38.719 0.040 . 1 . . . . . 13 ASN CB . 27439 1
147 . 1 1 13 13 ASN H H 1 7.811 0.011 . 1 . . . . . 13 ASN H . 27439 1
148 . 1 1 13 13 ASN HA H 1 4.853 0.012 . 1 . . . . . 13 ASN HA . 27439 1
149 . 1 1 13 13 ASN HB2 H 1 3.693 0.017 . 2 . . . . . 13 ASN HB2 . 27439 1
150 . 1 1 13 13 ASN HB3 H 1 2.359 0.023 . 2 . . . . . 13 ASN HB3 . 27439 1
151 . 1 1 13 13 ASN N N 15 119.788 0.069 . 1 . . . . . 13 ASN N . 27439 1
152 . 1 1 14 14 THR C C 13 175.346 0.000 . 1 . . . . . 14 THR C . 27439 1
153 . 1 1 14 14 THR CA C 13 59.689 0.120 . 1 . . . . . 14 THR CA . 27439 1
154 . 1 1 14 14 THR CB C 13 67.574 0.154 . 1 . . . . . 14 THR CB . 27439 1
155 . 1 1 14 14 THR CG2 C 13 22.520 0.091 . 1 . . . . . 14 THR CG2 . 27439 1
156 . 1 1 14 14 THR H H 1 8.139 0.019 . 1 . . . . . 14 THR H . 27439 1
157 . 1 1 14 14 THR HA H 1 4.810 0.040 . 1 . . . . . 14 THR HA . 27439 1
158 . 1 1 14 14 THR HB H 1 4.417 0.024 . 1 . . . . . 14 THR HB . 27439 1
159 . 1 1 14 14 THR HG21 H 1 1.115 0.006 . 1 . . . . . 14 THR HG21 . 27439 1
160 . 1 1 14 14 THR HG22 H 1 1.115 0.006 . 1 . . . . . 14 THR HG22 . 27439 1
161 . 1 1 14 14 THR HG23 H 1 1.115 0.006 . 1 . . . . . 14 THR HG23 . 27439 1
162 . 1 1 14 14 THR N N 15 120.946 0.098 . 1 . . . . . 14 THR N . 27439 1
163 . 1 1 15 15 LEU C C 13 175.662 0.000 . 1 . . . . . 15 LEU C . 27439 1
164 . 1 1 15 15 LEU CA C 13 58.200 0.117 . 1 . . . . . 15 LEU CA . 27439 1
165 . 1 1 15 15 LEU CB C 13 42.883 0.096 . 1 . . . . . 15 LEU CB . 27439 1
166 . 1 1 15 15 LEU CD1 C 13 23.094 0.047 . 1 . . . . . 15 LEU CD1 . 27439 1
167 . 1 1 15 15 LEU CG C 13 27.021 0.060 . 1 . . . . . 15 LEU CG . 27439 1
168 . 1 1 15 15 LEU H H 1 9.078 0.015 . 1 . . . . . 15 LEU H . 27439 1
169 . 1 1 15 15 LEU HA H 1 3.842 0.018 . 1 . . . . . 15 LEU HA . 27439 1
170 . 1 1 15 15 LEU HB2 H 1 2.045 0.011 . 2 . . . . . 15 LEU HB2 . 27439 1
171 . 1 1 15 15 LEU HB3 H 1 1.170 0.010 . 2 . . . . . 15 LEU HB3 . 27439 1
172 . 1 1 15 15 LEU HD11 H 1 0.430 0.005 . 1 . . . . . 15 LEU HD11 . 27439 1
173 . 1 1 15 15 LEU HD12 H 1 0.430 0.005 . 1 . . . . . 15 LEU HD12 . 27439 1
174 . 1 1 15 15 LEU HD13 H 1 0.430 0.005 . 1 . . . . . 15 LEU HD13 . 27439 1
175 . 1 1 15 15 LEU HG H 1 0.715 0.010 . 1 . . . . . 15 LEU HG . 27439 1
176 . 1 1 15 15 LEU N N 15 121.684 0.050 . 1 . . . . . 15 LEU N . 27439 1
177 . 1 1 16 16 GLY CA C 13 43.332 0.000 . 1 . . . . . 16 GLY CA . 27439 1
178 . 1 1 16 16 GLY H H 1 6.231 0.015 . 1 . . . . . 16 GLY H . 27439 1
179 . 1 1 16 16 GLY HA2 H 1 2.967 0.015 . 2 . . . . . 16 GLY HA2 . 27439 1
180 . 1 1 16 16 GLY HA3 H 1 2.955 0.032 . 2 . . . . . 16 GLY HA3 . 27439 1
181 . 1 1 16 16 GLY N N 15 104.568 0.231 . 1 . . . . . 16 GLY N . 27439 1
182 . 1 1 17 17 PRO C C 13 177.313 0.000 . 1 . . . . . 17 PRO C . 27439 1
183 . 1 1 17 17 PRO CA C 13 63.661 0.059 . 1 . . . . . 17 PRO CA . 27439 1
184 . 1 1 17 17 PRO CB C 13 31.824 0.000 . 1 . . . . . 17 PRO CB . 27439 1
185 . 1 1 17 17 PRO HA H 1 3.818 0.012 . 1 . . . . . 17 PRO HA . 27439 1
186 . 1 1 17 17 PRO HB2 H 1 2.224 0.007 . 2 . . . . . 17 PRO HB2 . 27439 1
187 . 1 1 17 17 PRO HB3 H 1 1.795 0.018 . 2 . . . . . 17 PRO HB3 . 27439 1
188 . 1 1 18 18 SER C C 13 173.347 0.000 . 1 . . . . . 18 SER C . 27439 1
189 . 1 1 18 18 SER CA C 13 60.385 0.093 . 1 . . . . . 18 SER CA . 27439 1
190 . 1 1 18 18 SER CB C 13 62.700 0.011 . 1 . . . . . 18 SER CB . 27439 1
191 . 1 1 18 18 SER H H 1 8.747 0.010 . 1 . . . . . 18 SER H . 27439 1
192 . 1 1 18 18 SER HA H 1 4.081 0.014 . 1 . . . . . 18 SER HA . 27439 1
193 . 1 1 18 18 SER HB2 H 1 4.055 0.005 . 2 . . . . . 18 SER HB2 . 27439 1
194 . 1 1 18 18 SER HB3 H 1 4.057 0.005 . 2 . . . . . 18 SER HB3 . 27439 1
195 . 1 1 18 18 SER HG H 1 4.759 0.000 . 1 . . . . . 18 SER HG . 27439 1
196 . 1 1 18 18 SER N N 15 114.683 0.084 . 1 . . . . . 18 SER N . 27439 1
197 . 1 1 19 19 ARG C C 13 174.923 0.000 . 1 . . . . . 19 ARG C . 27439 1
198 . 1 1 19 19 ARG CA C 13 55.757 0.110 . 1 . . . . . 19 ARG CA . 27439 1
199 . 1 1 19 19 ARG CB C 13 30.432 0.144 . 1 . . . . . 19 ARG CB . 27439 1
200 . 1 1 19 19 ARG CD C 13 43.407 0.000 . 1 . . . . . 19 ARG CD . 27439 1
201 . 1 1 19 19 ARG CG C 13 27.530 0.000 . 1 . . . . . 19 ARG CG . 27439 1
202 . 1 1 19 19 ARG H H 1 7.672 0.010 . 1 . . . . . 19 ARG H . 27439 1
203 . 1 1 19 19 ARG HA H 1 4.417 0.014 . 1 . . . . . 19 ARG HA . 27439 1
204 . 1 1 19 19 ARG HB2 H 1 1.806 0.014 . 2 . . . . . 19 ARG HB2 . 27439 1
205 . 1 1 19 19 ARG HB3 H 1 1.598 0.022 . 2 . . . . . 19 ARG HB3 . 27439 1
206 . 1 1 19 19 ARG HD2 H 1 2.419 0.000 . 1 . . . . . 19 ARG HD2 . 27439 1
207 . 1 1 19 19 ARG HG2 H 1 1.286 0.020 . 2 . . . . . 19 ARG HG2 . 27439 1
208 . 1 1 19 19 ARG HG3 H 1 1.288 0.020 . 2 . . . . . 19 ARG HG3 . 27439 1
209 . 1 1 19 19 ARG N N 15 121.321 0.110 . 1 . . . . . 19 ARG N . 27439 1
210 . 1 1 20 20 ILE C C 13 173.762 0.000 . 1 . . . . . 20 ILE C . 27439 1
211 . 1 1 20 20 ILE CA C 13 60.881 0.060 . 1 . . . . . 20 ILE CA . 27439 1
212 . 1 1 20 20 ILE CB C 13 39.591 0.081 . 1 . . . . . 20 ILE CB . 27439 1
213 . 1 1 20 20 ILE CD1 C 13 12.939 0.153 . 1 . . . . . 20 ILE CD1 . 27439 1
214 . 1 1 20 20 ILE CG1 C 13 28.331 0.040 . 1 . . . . . 20 ILE CG1 . 27439 1
215 . 1 1 20 20 ILE CG2 C 13 18.301 0.077 . 1 . . . . . 20 ILE CG2 . 27439 1
216 . 1 1 20 20 ILE H H 1 7.992 0.011 . 1 . . . . . 20 ILE H . 27439 1
217 . 1 1 20 20 ILE HA H 1 4.175 0.007 . 1 . . . . . 20 ILE HA . 27439 1
218 . 1 1 20 20 ILE HB H 1 1.805 0.009 . 1 . . . . . 20 ILE HB . 27439 1
219 . 1 1 20 20 ILE HD11 H 1 0.816 0.021 . 1 . . . . . 20 ILE HD11 . 27439 1
220 . 1 1 20 20 ILE HD12 H 1 0.816 0.021 . 1 . . . . . 20 ILE HD12 . 27439 1
221 . 1 1 20 20 ILE HD13 H 1 0.816 0.021 . 1 . . . . . 20 ILE HD13 . 27439 1
222 . 1 1 20 20 ILE HG12 H 1 1.296 0.017 . 2 . . . . . 20 ILE HG12 . 27439 1
223 . 1 1 20 20 ILE HG13 H 1 1.566 0.029 . 2 . . . . . 20 ILE HG13 . 27439 1
224 . 1 1 20 20 ILE HG21 H 1 1.019 0.012 . 1 . . . . . 20 ILE HG21 . 27439 1
225 . 1 1 20 20 ILE HG22 H 1 1.019 0.012 . 1 . . . . . 20 ILE HG22 . 27439 1
226 . 1 1 20 20 ILE HG23 H 1 1.019 0.012 . 1 . . . . . 20 ILE HG23 . 27439 1
227 . 1 1 20 20 ILE N N 15 124.085 0.118 . 1 . . . . . 20 ILE N . 27439 1
228 . 1 1 21 21 LEU C C 13 174.901 0.000 . 1 . . . . . 21 LEU C . 27439 1
229 . 1 1 21 21 LEU CA C 13 52.816 0.074 . 1 . . . . . 21 LEU CA . 27439 1
230 . 1 1 21 21 LEU CB C 13 47.238 0.076 . 1 . . . . . 21 LEU CB . 27439 1
231 . 1 1 21 21 LEU CG C 13 26.641 0.158 . 1 . . . . . 21 LEU CG . 27439 1
232 . 1 1 21 21 LEU H H 1 8.335 0.015 . 1 . . . . . 21 LEU H . 27439 1
233 . 1 1 21 21 LEU HA H 1 5.100 0.030 . 1 . . . . . 21 LEU HA . 27439 1
234 . 1 1 21 21 LEU HB2 H 1 1.394 0.029 . 2 . . . . . 21 LEU HB2 . 27439 1
235 . 1 1 21 21 LEU HB3 H 1 2.197 0.020 . 2 . . . . . 21 LEU HB3 . 27439 1
236 . 1 1 21 21 LEU N N 15 125.284 0.094 . 1 . . . . . 21 LEU N . 27439 1
237 . 1 1 22 22 GLN CA C 13 54.235 0.023 . 1 . . . . . 22 GLN CA . 27439 1
238 . 1 1 22 22 GLN CB C 13 33.110 0.146 . 1 . . . . . 22 GLN CB . 27439 1
239 . 1 1 22 22 GLN CG C 13 35.397 0.000 . 1 . . . . . 22 GLN CG . 27439 1
240 . 1 1 22 22 GLN H H 1 9.279 0.015 . 1 . . . . . 22 GLN H . 27439 1
241 . 1 1 22 22 GLN HA H 1 5.073 0.010 . 1 . . . . . 22 GLN HA . 27439 1
242 . 1 1 22 22 GLN HB2 H 1 2.138 0.011 . 2 . . . . . 22 GLN HB2 . 27439 1
243 . 1 1 22 22 GLN HB3 H 1 2.141 0.010 . 2 . . . . . 22 GLN HB3 . 27439 1
244 . 1 1 22 22 GLN HG2 H 1 1.595 0.013 . 2 . . . . . 22 GLN HG2 . 27439 1
245 . 1 1 22 22 GLN HG3 H 1 1.820 0.023 . 2 . . . . . 22 GLN HG3 . 27439 1
246 . 1 1 22 22 GLN N N 15 128.979 0.094 . 1 . . . . . 22 GLN N . 27439 1
247 . 1 1 23 23 TYR C C 13 172.850 0.000 . 1 . . . . . 23 TYR C . 27439 1
248 . 1 1 23 23 TYR CA C 13 55.576 0.081 . 1 . . . . . 23 TYR CA . 27439 1
249 . 1 1 23 23 TYR CB C 13 42.790 0.118 . 1 . . . . . 23 TYR CB . 27439 1
250 . 1 1 23 23 TYR H H 1 9.176 0.016 . 1 . . . . . 23 TYR H . 27439 1
251 . 1 1 23 23 TYR HA H 1 5.722 0.013 . 1 . . . . . 23 TYR HA . 27439 1
252 . 1 1 23 23 TYR HB2 H 1 3.025 0.017 . 2 . . . . . 23 TYR HB2 . 27439 1
253 . 1 1 23 23 TYR HB3 H 1 2.472 0.014 . 2 . . . . . 23 TYR HB3 . 27439 1
254 . 1 1 23 23 TYR HD1 H 1 6.873 0.026 . 3 . . . . . 23 TYR HD1 . 27439 1
255 . 1 1 23 23 TYR HD2 H 1 6.873 0.026 . 3 . . . . . 23 TYR HD2 . 27439 1
256 . 1 1 23 23 TYR HE1 H 1 6.504 0.013 . 3 . . . . . 23 TYR HE1 . 27439 1
257 . 1 1 23 23 TYR HE2 H 1 6.504 0.013 . 3 . . . . . 23 TYR HE2 . 27439 1
258 . 1 1 23 23 TYR N N 15 123.541 0.061 . 1 . . . . . 23 TYR N . 27439 1
259 . 1 1 24 24 HIS C C 13 175.831 0.000 . 1 . . . . . 24 HIS C . 27439 1
260 . 1 1 24 24 HIS CA C 13 52.188 0.074 . 1 . . . . . 24 HIS CA . 27439 1
261 . 1 1 24 24 HIS CB C 13 32.432 0.138 . 1 . . . . . 24 HIS CB . 27439 1
262 . 1 1 24 24 HIS H H 1 8.991 0.019 . 1 . . . . . 24 HIS H . 27439 1
263 . 1 1 24 24 HIS HA H 1 5.261 0.010 . 1 . . . . . 24 HIS HA . 27439 1
264 . 1 1 24 24 HIS HB2 H 1 2.683 0.020 . 2 . . . . . 24 HIS HB2 . 27439 1
265 . 1 1 24 24 HIS HB3 H 1 3.265 0.041 . 2 . . . . . 24 HIS HB3 . 27439 1
266 . 1 1 24 24 HIS HD1 H 1 6.594 0.029 . 1 . . . . . 24 HIS HD1 . 27439 1
267 . 1 1 24 24 HIS HE1 H 1 7.671 0.002 . 1 . . . . . 24 HIS HE1 . 27439 1
268 . 1 1 24 24 HIS N N 15 122.720 0.125 . 1 . . . . . 24 HIS N . 27439 1
269 . 1 1 25 25 CYS C C 13 172.164 0.000 . 1 . . . . . 25 CYS C . 27439 1
270 . 1 1 25 25 CYS CA C 13 55.133 0.051 . 1 . . . . . 25 CYS CA . 27439 1
271 . 1 1 25 25 CYS CB C 13 46.205 0.098 . 1 . . . . . 25 CYS CB . 27439 1
272 . 1 1 25 25 CYS H H 1 9.907 0.025 . 1 . . . . . 25 CYS H . 27439 1
273 . 1 1 25 25 CYS HA H 1 5.976 0.008 . 1 . . . . . 25 CYS HA . 27439 1
274 . 1 1 25 25 CYS HB2 H 1 3.066 0.011 . 2 . . . . . 25 CYS HB2 . 27439 1
275 . 1 1 25 25 CYS HB3 H 1 3.309 0.019 . 2 . . . . . 25 CYS HB3 . 27439 1
276 . 1 1 25 25 CYS N N 15 128.066 0.158 . 1 . . . . . 25 CYS N . 27439 1
277 . 1 1 26 26 ARG C C 13 172.345 0.000 . 1 . . . . . 26 ARG C . 27439 1
278 . 1 1 26 26 ARG CA C 13 55.765 0.186 . 1 . . . . . 26 ARG CA . 27439 1
279 . 1 1 26 26 ARG CB C 13 32.654 0.129 . 1 . . . . . 26 ARG CB . 27439 1
280 . 1 1 26 26 ARG CD C 13 44.017 0.000 . 1 . . . . . 26 ARG CD . 27439 1
281 . 1 1 26 26 ARG CG C 13 24.934 0.000 . 1 . . . . . 26 ARG CG . 27439 1
282 . 1 1 26 26 ARG H H 1 9.050 0.011 . 1 . . . . . 26 ARG H . 27439 1
283 . 1 1 26 26 ARG HA H 1 4.725 0.006 . 1 . . . . . 26 ARG HA . 27439 1
284 . 1 1 26 26 ARG HB2 H 1 1.941 0.017 . 2 . . . . . 26 ARG HB2 . 27439 1
285 . 1 1 26 26 ARG HB3 H 1 1.929 0.037 . 2 . . . . . 26 ARG HB3 . 27439 1
286 . 1 1 26 26 ARG N N 15 119.282 0.054 . 1 . . . . . 26 ARG N . 27439 1
287 . 1 1 27 27 SER C C 13 174.760 0.000 . 1 . . . . . 27 SER C . 27439 1
288 . 1 1 27 27 SER CA C 13 54.600 0.096 . 1 . . . . . 27 SER CA . 27439 1
289 . 1 1 27 27 SER CB C 13 65.838 0.148 . 1 . . . . . 27 SER CB . 27439 1
290 . 1 1 27 27 SER H H 1 8.373 0.015 . 1 . . . . . 27 SER H . 27439 1
291 . 1 1 27 27 SER HA H 1 4.830 0.011 . 1 . . . . . 27 SER HA . 27439 1
292 . 1 1 27 27 SER HB2 H 1 3.436 0.012 . 1 . . . . . 27 SER HB2 . 27439 1
293 . 1 1 27 27 SER HB3 H 1 3.436 0.013 . 1 . . . . . 27 SER HB3 . 27439 1
294 . 1 1 27 27 SER N N 15 119.428 0.089 . 1 . . . . . 27 SER N . 27439 1
295 . 1 1 28 28 GLY C C 13 174.338 0.000 . 1 . . . . . 28 GLY C . 27439 1
296 . 1 1 28 28 GLY CA C 13 46.276 0.085 . 1 . . . . . 28 GLY CA . 27439 1
297 . 1 1 28 28 GLY H H 1 8.312 0.011 . 1 . . . . . 28 GLY H . 27439 1
298 . 1 1 28 28 GLY HA2 H 1 3.544 0.014 . 2 . . . . . 28 GLY HA2 . 27439 1
299 . 1 1 28 28 GLY HA3 H 1 3.978 0.018 . 2 . . . . . 28 GLY HA3 . 27439 1
300 . 1 1 28 28 GLY N N 15 107.084 0.066 . 1 . . . . . 28 GLY N . 27439 1
301 . 1 1 29 29 ASN C C 13 175.811 0.000 . 1 . . . . . 29 ASN C . 27439 1
302 . 1 1 29 29 ASN CA C 13 53.673 0.008 . 1 . . . . . 29 ASN CA . 27439 1
303 . 1 1 29 29 ASN CB C 13 40.588 0.069 . 1 . . . . . 29 ASN CB . 27439 1
304 . 1 1 29 29 ASN H H 1 7.974 0.011 . 1 . . . . . 29 ASN H . 27439 1
305 . 1 1 29 29 ASN HA H 1 4.910 0.008 . 1 . . . . . 29 ASN HA . 27439 1
306 . 1 1 29 29 ASN HB2 H 1 2.588 0.006 . 2 . . . . . 29 ASN HB2 . 27439 1
307 . 1 1 29 29 ASN HB3 H 1 2.744 0.007 . 2 . . . . . 29 ASN HB3 . 27439 1
308 . 1 1 29 29 ASN N N 15 116.736 0.074 . 1 . . . . . 29 ASN N . 27439 1
309 . 1 1 30 30 THR C C 13 170.450 0.000 . 1 . . . . . 30 THR C . 27439 1
310 . 1 1 30 30 THR CA C 13 62.184 0.130 . 1 . . . . . 30 THR CA . 27439 1
311 . 1 1 30 30 THR CB C 13 71.925 0.074 . 1 . . . . . 30 THR CB . 27439 1
312 . 1 1 30 30 THR CG2 C 13 21.654 0.040 . 1 . . . . . 30 THR CG2 . 27439 1
313 . 1 1 30 30 THR H H 1 7.240 0.015 . 1 . . . . . 30 THR H . 27439 1
314 . 1 1 30 30 THR HA H 1 4.371 0.023 . 1 . . . . . 30 THR HA . 27439 1
315 . 1 1 30 30 THR HB H 1 3.723 0.012 . 1 . . . . . 30 THR HB . 27439 1
316 . 1 1 30 30 THR HG21 H 1 1.285 0.008 . 1 . . . . . 30 THR HG21 . 27439 1
317 . 1 1 30 30 THR HG22 H 1 1.285 0.008 . 1 . . . . . 30 THR HG22 . 27439 1
318 . 1 1 30 30 THR HG23 H 1 1.285 0.008 . 1 . . . . . 30 THR HG23 . 27439 1
319 . 1 1 30 30 THR N N 15 116.928 0.061 . 1 . . . . . 30 THR N . 27439 1
320 . 1 1 31 31 ASN C C 13 175.452 0.000 . 1 . . . . . 31 ASN C . 27439 1
321 . 1 1 31 31 ASN CA C 13 51.282 0.113 . 1 . . . . . 31 ASN CA . 27439 1
322 . 1 1 31 31 ASN CB C 13 38.817 0.065 . 1 . . . . . 31 ASN CB . 27439 1
323 . 1 1 31 31 ASN H H 1 8.851 0.030 . 1 . . . . . 31 ASN H . 27439 1
324 . 1 1 31 31 ASN HA H 1 4.990 0.008 . 1 . . . . . 31 ASN HA . 27439 1
325 . 1 1 31 31 ASN HB2 H 1 3.072 0.006 . 2 . . . . . 31 ASN HB2 . 27439 1
326 . 1 1 31 31 ASN HB3 H 1 2.858 0.009 . 2 . . . . . 31 ASN HB3 . 27439 1
327 . 1 1 31 31 ASN N N 15 124.172 0.118 . 1 . . . . . 31 ASN N . 27439 1
328 . 1 1 32 32 VAL C C 13 176.495 0.000 . 1 . . . . . 32 VAL C . 27439 1
329 . 1 1 32 32 VAL CA C 13 63.864 0.085 . 1 . . . . . 32 VAL CA . 27439 1
330 . 1 1 32 32 VAL CB C 13 31.889 0.092 . 1 . . . . . 32 VAL CB . 27439 1
331 . 1 1 32 32 VAL CG1 C 13 23.582 0.065 . 2 . . . . . 32 VAL CG1 . 27439 1
332 . 1 1 32 32 VAL CG2 C 13 22.567 0.058 . 2 . . . . . 32 VAL CG2 . 27439 1
333 . 1 1 32 32 VAL H H 1 8.093 0.008 . 1 . . . . . 32 VAL H . 27439 1
334 . 1 1 32 32 VAL HA H 1 3.998 0.019 . 1 . . . . . 32 VAL HA . 27439 1
335 . 1 1 32 32 VAL HB H 1 2.744 0.013 . 1 . . . . . 32 VAL HB . 27439 1
336 . 1 1 32 32 VAL HG11 H 1 1.328 0.015 . 2 . . . . . 32 VAL HG11 . 27439 1
337 . 1 1 32 32 VAL HG12 H 1 1.328 0.015 . 2 . . . . . 32 VAL HG12 . 27439 1
338 . 1 1 32 32 VAL HG13 H 1 1.328 0.015 . 2 . . . . . 32 VAL HG13 . 27439 1
339 . 1 1 32 32 VAL HG21 H 1 1.220 0.010 . 2 . . . . . 32 VAL HG21 . 27439 1
340 . 1 1 32 32 VAL HG22 H 1 1.220 0.010 . 2 . . . . . 32 VAL HG22 . 27439 1
341 . 1 1 32 32 VAL HG23 H 1 1.220 0.010 . 2 . . . . . 32 VAL HG23 . 27439 1
342 . 1 1 32 32 VAL N N 15 125.535 0.086 . 1 . . . . . 32 VAL N . 27439 1
343 . 1 1 33 33 GLY C C 13 171.687 0.000 . 1 . . . . . 33 GLY C . 27439 1
344 . 1 1 33 33 GLY CA C 13 43.367 0.138 . 1 . . . . . 33 GLY CA . 27439 1
345 . 1 1 33 33 GLY H H 1 7.737 0.016 . 1 . . . . . 33 GLY H . 27439 1
346 . 1 1 33 33 GLY HA2 H 1 3.357 0.008 . 2 . . . . . 33 GLY HA2 . 27439 1
347 . 1 1 33 33 GLY HA3 H 1 4.063 0.008 . 2 . . . . . 33 GLY HA3 . 27439 1
348 . 1 1 33 33 GLY N N 15 104.846 0.097 . 1 . . . . . 33 GLY N . 27439 1
349 . 1 1 34 34 VAL C C 13 175.201 0.000 . 1 . . . . . 34 VAL C . 27439 1
350 . 1 1 34 34 VAL CA C 13 64.180 0.099 . 1 . . . . . 34 VAL CA . 27439 1
351 . 1 1 34 34 VAL CB C 13 30.802 0.086 . 1 . . . . . 34 VAL CB . 27439 1
352 . 1 1 34 34 VAL CG1 C 13 20.938 0.064 . 2 . . . . . 34 VAL CG1 . 27439 1
353 . 1 1 34 34 VAL CG2 C 13 21.795 0.067 . 2 . . . . . 34 VAL CG2 . 27439 1
354 . 1 1 34 34 VAL H H 1 7.956 0.019 . 1 . . . . . 34 VAL H . 27439 1
355 . 1 1 34 34 VAL HA H 1 3.349 0.015 . 1 . . . . . 34 VAL HA . 27439 1
356 . 1 1 34 34 VAL HB H 1 1.623 0.014 . 1 . . . . . 34 VAL HB . 27439 1
357 . 1 1 34 34 VAL HG11 H 1 0.526 0.017 . 2 . . . . . 34 VAL HG11 . 27439 1
358 . 1 1 34 34 VAL HG12 H 1 0.526 0.017 . 2 . . . . . 34 VAL HG12 . 27439 1
359 . 1 1 34 34 VAL HG13 H 1 0.526 0.017 . 2 . . . . . 34 VAL HG13 . 27439 1
360 . 1 1 34 34 VAL HG21 H 1 0.560 0.015 . 2 . . . . . 34 VAL HG21 . 27439 1
361 . 1 1 34 34 VAL HG22 H 1 0.560 0.015 . 2 . . . . . 34 VAL HG22 . 27439 1
362 . 1 1 34 34 VAL HG23 H 1 0.560 0.015 . 2 . . . . . 34 VAL HG23 . 27439 1
363 . 1 1 34 34 VAL N N 15 120.234 0.133 . 1 . . . . . 34 VAL N . 27439 1
364 . 1 1 35 35 GLN C C 13 172.821 0.000 . 1 . . . . . 35 GLN C . 27439 1
365 . 1 1 35 35 GLN CA C 13 52.789 0.045 . 1 . . . . . 35 GLN CA . 27439 1
366 . 1 1 35 35 GLN CB C 13 32.043 0.100 . 1 . . . . . 35 GLN CB . 27439 1
367 . 1 1 35 35 GLN H H 1 8.059 0.018 . 1 . . . . . 35 GLN H . 27439 1
368 . 1 1 35 35 GLN HA H 1 4.489 0.015 . 1 . . . . . 35 GLN HA . 27439 1
369 . 1 1 35 35 GLN HB2 H 1 0.465 0.013 . 2 . . . . . 35 GLN HB2 . 27439 1
370 . 1 1 35 35 GLN HB3 H 1 0.467 0.010 . 2 . . . . . 35 GLN HB3 . 27439 1
371 . 1 1 35 35 GLN HG2 H 1 2.144 0.014 . 2 . . . . . 35 GLN HG2 . 27439 1
372 . 1 1 35 35 GLN HG3 H 1 1.983 0.028 . 2 . . . . . 35 GLN HG3 . 27439 1
373 . 1 1 35 35 GLN N N 15 127.028 0.075 . 1 . . . . . 35 GLN N . 27439 1
374 . 1 1 36 36 TYR C C 13 176.713 0.000 . 1 . . . . . 36 TYR C . 27439 1
375 . 1 1 36 36 TYR CA C 13 56.803 0.078 . 1 . . . . . 36 TYR CA . 27439 1
376 . 1 1 36 36 TYR CB C 13 42.526 0.132 . 1 . . . . . 36 TYR CB . 27439 1
377 . 1 1 36 36 TYR H H 1 8.623 0.017 . 1 . . . . . 36 TYR H . 27439 1
378 . 1 1 36 36 TYR HA H 1 5.810 0.012 . 1 . . . . . 36 TYR HA . 27439 1
379 . 1 1 36 36 TYR HB2 H 1 2.716 0.013 . 2 . . . . . 36 TYR HB2 . 27439 1
380 . 1 1 36 36 TYR HB3 H 1 2.927 0.012 . 2 . . . . . 36 TYR HB3 . 27439 1
381 . 1 1 36 36 TYR HD1 H 1 7.038 0.005 . 3 . . . . . 36 TYR HD1 . 27439 1
382 . 1 1 36 36 TYR HD2 H 1 7.038 0.005 . 3 . . . . . 36 TYR HD2 . 27439 1
383 . 1 1 36 36 TYR HE1 H 1 6.797 0.012 . 3 . . . . . 36 TYR HE1 . 27439 1
384 . 1 1 36 36 TYR HE2 H 1 6.797 0.012 . 3 . . . . . 36 TYR HE2 . 27439 1
385 . 1 1 36 36 TYR N N 15 115.747 0.104 . 1 . . . . . 36 TYR N . 27439 1
386 . 1 1 37 37 LEU C C 13 177.147 0.000 . 1 . . . . . 37 LEU C . 27439 1
387 . 1 1 37 37 LEU CA C 13 53.630 0.088 . 1 . . . . . 37 LEU CA . 27439 1
388 . 1 1 37 37 LEU CB C 13 48.934 0.130 . 1 . . . . . 37 LEU CB . 27439 1
389 . 1 1 37 37 LEU CG C 13 24.832 0.096 . 1 . . . . . 37 LEU CG . 27439 1
390 . 1 1 37 37 LEU H H 1 9.467 0.012 . 1 . . . . . 37 LEU H . 27439 1
391 . 1 1 37 37 LEU HA H 1 5.074 0.011 . 1 . . . . . 37 LEU HA . 27439 1
392 . 1 1 37 37 LEU HB2 H 1 1.908 0.013 . 2 . . . . . 37 LEU HB2 . 27439 1
393 . 1 1 37 37 LEU HB3 H 1 1.636 0.023 . 2 . . . . . 37 LEU HB3 . 27439 1
394 . 1 1 37 37 LEU N N 15 123.030 0.067 . 1 . . . . . 37 LEU N . 27439 1
395 . 1 1 38 38 ASN C C 13 175.589 0.000 . 1 . . . . . 38 ASN C . 27439 1
396 . 1 1 38 38 ASN CA C 13 52.774 0.061 . 1 . . . . . 38 ASN CA . 27439 1
397 . 1 1 38 38 ASN CB C 13 39.199 0.054 . 1 . . . . . 38 ASN CB . 27439 1
398 . 1 1 38 38 ASN H H 1 9.272 0.011 . 1 . . . . . 38 ASN H . 27439 1
399 . 1 1 38 38 ASN HA H 1 4.914 0.010 . 1 . . . . . 38 ASN HA . 27439 1
400 . 1 1 38 38 ASN HB2 H 1 3.045 0.010 . 2 . . . . . 38 ASN HB2 . 27439 1
401 . 1 1 38 38 ASN HB3 H 1 2.862 0.021 . 2 . . . . . 38 ASN HB3 . 27439 1
402 . 1 1 38 38 ASN N N 15 125.466 0.067 . 1 . . . . . 38 ASN N . 27439 1
403 . 1 1 39 39 PHE C C 13 176.820 0.000 . 1 . . . . . 39 PHE C . 27439 1
404 . 1 1 39 39 PHE CA C 13 59.238 0.163 . 1 . . . . . 39 PHE CA . 27439 1
405 . 1 1 39 39 PHE CB C 13 38.219 0.101 . 1 . . . . . 39 PHE CB . 27439 1
406 . 1 1 39 39 PHE H H 1 9.137 0.016 . 1 . . . . . 39 PHE H . 27439 1
407 . 1 1 39 39 PHE HA H 1 4.312 0.011 . 1 . . . . . 39 PHE HA . 27439 1
408 . 1 1 39 39 PHE HB2 H 1 2.875 0.012 . 2 . . . . . 39 PHE HB2 . 27439 1
409 . 1 1 39 39 PHE HB3 H 1 3.584 0.020 . 2 . . . . . 39 PHE HB3 . 27439 1
410 . 1 1 39 39 PHE HD1 H 1 7.213 0.010 . 3 . . . . . 39 PHE HD1 . 27439 1
411 . 1 1 39 39 PHE HD2 H 1 7.213 0.010 . 3 . . . . . 39 PHE HD2 . 27439 1
412 . 1 1 39 39 PHE N N 15 123.032 0.081 . 1 . . . . . 39 PHE N . 27439 1
413 . 1 1 40 40 LYS C C 13 175.672 0.000 . 1 . . . . . 40 LYS C . 27439 1
414 . 1 1 40 40 LYS CA C 13 59.513 0.181 . 1 . . . . . 40 LYS CA . 27439 1
415 . 1 1 40 40 LYS CB C 13 29.098 0.138 . 1 . . . . . 40 LYS CB . 27439 1
416 . 1 1 40 40 LYS H H 1 8.443 0.016 . 1 . . . . . 40 LYS H . 27439 1
417 . 1 1 40 40 LYS HA H 1 3.424 0.008 . 1 . . . . . 40 LYS HA . 27439 1
418 . 1 1 40 40 LYS HB2 H 1 1.888 0.005 . 2 . . . . . 40 LYS HB2 . 27439 1
419 . 1 1 40 40 LYS HB3 H 1 1.716 0.011 . 2 . . . . . 40 LYS HB3 . 27439 1
420 . 1 1 40 40 LYS N N 15 122.362 0.051 . 1 . . . . . 40 LYS N . 27439 1
421 . 1 1 41 41 GLY C C 13 172.614 0.000 . 1 . . . . . 41 GLY C . 27439 1
422 . 1 1 41 41 GLY CA C 13 45.511 0.124 . 1 . . . . . 41 GLY CA . 27439 1
423 . 1 1 41 41 GLY H H 1 8.904 0.013 . 1 . . . . . 41 GLY H . 27439 1
424 . 1 1 41 41 GLY HA2 H 1 4.251 0.008 . 2 . . . . . 41 GLY HA2 . 27439 1
425 . 1 1 41 41 GLY HA3 H 1 3.721 0.011 . 2 . . . . . 41 GLY HA3 . 27439 1
426 . 1 1 41 41 GLY N N 15 109.586 0.079 . 1 . . . . . 41 GLY N . 27439 1
427 . 1 1 42 42 THR C C 13 173.711 0.000 . 1 . . . . . 42 THR C . 27439 1
428 . 1 1 42 42 THR CA C 13 60.275 0.086 . 1 . . . . . 42 THR CA . 27439 1
429 . 1 1 42 42 THR CB C 13 72.382 0.069 . 1 . . . . . 42 THR CB . 27439 1
430 . 1 1 42 42 THR CG2 C 13 21.739 0.103 . 1 . . . . . 42 THR CG2 . 27439 1
431 . 1 1 42 42 THR H H 1 8.234 0.008 . 1 . . . . . 42 THR H . 27439 1
432 . 1 1 42 42 THR HA H 1 5.540 0.017 . 1 . . . . . 42 THR HA . 27439 1
433 . 1 1 42 42 THR HB H 1 3.809 0.011 . 1 . . . . . 42 THR HB . 27439 1
434 . 1 1 42 42 THR HG21 H 1 1.003 0.010 . 1 . . . . . 42 THR HG21 . 27439 1
435 . 1 1 42 42 THR HG22 H 1 1.003 0.010 . 1 . . . . . 42 THR HG22 . 27439 1
436 . 1 1 42 42 THR HG23 H 1 1.003 0.010 . 1 . . . . . 42 THR HG23 . 27439 1
437 . 1 1 42 42 THR N N 15 115.533 0.141 . 1 . . . . . 42 THR N . 27439 1
438 . 1 1 43 43 ARG C C 13 176.053 0.000 . 1 . . . . . 43 ARG C . 27439 1
439 . 1 1 43 43 ARG CA C 13 54.958 0.031 . 1 . . . . . 43 ARG CA . 27439 1
440 . 1 1 43 43 ARG CB C 13 33.410 0.124 . 1 . . . . . 43 ARG CB . 27439 1
441 . 1 1 43 43 ARG CD C 13 45.112 0.000 . 1 . . . . . 43 ARG CD . 27439 1
442 . 1 1 43 43 ARG H H 1 9.075 0.009 . 1 . . . . . 43 ARG H . 27439 1
443 . 1 1 43 43 ARG HA H 1 4.663 0.009 . 1 . . . . . 43 ARG HA . 27439 1
444 . 1 1 43 43 ARG HB2 H 1 1.535 0.013 . 2 . . . . . 43 ARG HB2 . 27439 1
445 . 1 1 43 43 ARG HB3 H 1 1.802 0.008 . 2 . . . . . 43 ARG HB3 . 27439 1
446 . 1 1 43 43 ARG N N 15 125.799 0.116 . 1 . . . . . 43 ARG N . 27439 1
447 . 1 1 44 44 ILE C C 13 176.158 0.000 . 1 . . . . . 44 ILE C . 27439 1
448 . 1 1 44 44 ILE CA C 13 60.771 0.148 . 1 . . . . . 44 ILE CA . 27439 1
449 . 1 1 44 44 ILE CB C 13 39.374 0.086 . 1 . . . . . 44 ILE CB . 27439 1
450 . 1 1 44 44 ILE CD1 C 13 13.476 0.150 . 1 . . . . . 44 ILE CD1 . 27439 1
451 . 1 1 44 44 ILE CG1 C 13 28.395 0.078 . 1 . . . . . 44 ILE CG1 . 27439 1
452 . 1 1 44 44 ILE CG2 C 13 17.651 0.153 . 1 . . . . . 44 ILE CG2 . 27439 1
453 . 1 1 44 44 ILE H H 1 8.819 0.008 . 1 . . . . . 44 ILE H . 27439 1
454 . 1 1 44 44 ILE HA H 1 4.828 0.019 . 1 . . . . . 44 ILE HA . 27439 1
455 . 1 1 44 44 ILE HB H 1 1.740 0.015 . 1 . . . . . 44 ILE HB . 27439 1
456 . 1 1 44 44 ILE HD11 H 1 0.785 0.033 . 1 . . . . . 44 ILE HD11 . 27439 1
457 . 1 1 44 44 ILE HD12 H 1 0.785 0.033 . 1 . . . . . 44 ILE HD12 . 27439 1
458 . 1 1 44 44 ILE HD13 H 1 0.785 0.033 . 1 . . . . . 44 ILE HD13 . 27439 1
459 . 1 1 44 44 ILE HG12 H 1 0.982 0.010 . 2 . . . . . 44 ILE HG12 . 27439 1
460 . 1 1 44 44 ILE HG13 H 1 1.541 0.023 . 2 . . . . . 44 ILE HG13 . 27439 1
461 . 1 1 44 44 ILE HG21 H 1 0.731 0.020 . 1 . . . . . 44 ILE HG21 . 27439 1
462 . 1 1 44 44 ILE HG22 H 1 0.731 0.020 . 1 . . . . . 44 ILE HG22 . 27439 1
463 . 1 1 44 44 ILE HG23 H 1 0.731 0.020 . 1 . . . . . 44 ILE HG23 . 27439 1
464 . 1 1 44 44 ILE N N 15 125.568 0.075 . 1 . . . . . 44 ILE N . 27439 1
465 . 1 1 45 45 ILE C C 13 173.991 0.000 . 1 . . . . . 45 ILE C . 27439 1
466 . 1 1 45 45 ILE CA C 13 60.886 0.163 . 1 . . . . . 45 ILE CA . 27439 1
467 . 1 1 45 45 ILE CB C 13 39.908 0.147 . 1 . . . . . 45 ILE CB . 27439 1
468 . 1 1 45 45 ILE CD1 C 13 14.560 0.087 . 1 . . . . . 45 ILE CD1 . 27439 1
469 . 1 1 45 45 ILE CG1 C 13 27.515 0.127 . 1 . . . . . 45 ILE CG1 . 27439 1
470 . 1 1 45 45 ILE CG2 C 13 16.963 0.063 . 1 . . . . . 45 ILE CG2 . 27439 1
471 . 1 1 45 45 ILE H H 1 9.600 0.022 . 1 . . . . . 45 ILE H . 27439 1
472 . 1 1 45 45 ILE HA H 1 4.167 0.010 . 1 . . . . . 45 ILE HA . 27439 1
473 . 1 1 45 45 ILE HB H 1 1.508 0.013 . 1 . . . . . 45 ILE HB . 27439 1
474 . 1 1 45 45 ILE HD11 H 1 0.759 0.017 . 1 . . . . . 45 ILE HD11 . 27439 1
475 . 1 1 45 45 ILE HD12 H 1 0.759 0.017 . 1 . . . . . 45 ILE HD12 . 27439 1
476 . 1 1 45 45 ILE HD13 H 1 0.759 0.017 . 1 . . . . . 45 ILE HD13 . 27439 1
477 . 1 1 45 45 ILE HG12 H 1 0.294 0.008 . 2 . . . . . 45 ILE HG12 . 27439 1
478 . 1 1 45 45 ILE HG13 H 1 0.294 0.009 . 2 . . . . . 45 ILE HG13 . 27439 1
479 . 1 1 45 45 ILE HG21 H 1 0.944 0.018 . 1 . . . . . 45 ILE HG21 . 27439 1
480 . 1 1 45 45 ILE HG22 H 1 0.944 0.018 . 1 . . . . . 45 ILE HG22 . 27439 1
481 . 1 1 45 45 ILE HG23 H 1 0.944 0.018 . 1 . . . . . 45 ILE HG23 . 27439 1
482 . 1 1 45 45 ILE N N 15 132.794 0.096 . 1 . . . . . 45 ILE N . 27439 1
483 . 1 1 46 46 LYS C C 13 176.491 0.000 . 1 . . . . . 46 LYS C . 27439 1
484 . 1 1 46 46 LYS CA C 13 54.033 0.068 . 1 . . . . . 46 LYS CA . 27439 1
485 . 1 1 46 46 LYS CB C 13 35.658 0.042 . 1 . . . . . 46 LYS CB . 27439 1
486 . 1 1 46 46 LYS CG C 13 25.903 0.000 . 1 . . . . . 46 LYS CG . 27439 1
487 . 1 1 46 46 LYS H H 1 8.431 0.016 . 1 . . . . . 46 LYS H . 27439 1
488 . 1 1 46 46 LYS HA H 1 5.678 0.006 . 1 . . . . . 46 LYS HA . 27439 1
489 . 1 1 46 46 LYS HB2 H 1 1.623 0.013 . 2 . . . . . 46 LYS HB2 . 27439 1
490 . 1 1 46 46 LYS HB3 H 1 1.546 0.018 . 2 . . . . . 46 LYS HB3 . 27439 1
491 . 1 1 46 46 LYS N N 15 126.020 0.128 . 1 . . . . . 46 LYS N . 27439 1
492 . 1 1 47 47 PHE C C 13 175.758 0.000 . 1 . . . . . 47 PHE C . 27439 1
493 . 1 1 47 47 PHE CA C 13 56.152 0.016 . 1 . . . . . 47 PHE CA . 27439 1
494 . 1 1 47 47 PHE CB C 13 41.789 0.063 . 1 . . . . . 47 PHE CB . 27439 1
495 . 1 1 47 47 PHE H H 1 8.539 0.011 . 1 . . . . . 47 PHE H . 27439 1
496 . 1 1 47 47 PHE HA H 1 4.991 0.013 . 1 . . . . . 47 PHE HA . 27439 1
497 . 1 1 47 47 PHE HB2 H 1 3.190 0.014 . 2 . . . . . 47 PHE HB2 . 27439 1
498 . 1 1 47 47 PHE HB3 H 1 3.192 0.014 . 2 . . . . . 47 PHE HB3 . 27439 1
499 . 1 1 47 47 PHE HD1 H 1 6.914 0.017 . 3 . . . . . 47 PHE HD1 . 27439 1
500 . 1 1 47 47 PHE HD2 H 1 6.914 0.017 . 3 . . . . . 47 PHE HD2 . 27439 1
501 . 1 1 47 47 PHE HE1 H 1 6.788 0.010 . 3 . . . . . 47 PHE HE1 . 27439 1
502 . 1 1 47 47 PHE HE2 H 1 6.788 0.010 . 3 . . . . . 47 PHE HE2 . 27439 1
503 . 1 1 47 47 PHE N N 15 118.436 0.064 . 1 . . . . . 47 PHE N . 27439 1
504 . 1 1 48 48 LYS C C 13 176.240 0.000 . 1 . . . . . 48 LYS C . 27439 1
505 . 1 1 48 48 LYS CA C 13 54.940 0.037 . 1 . . . . . 48 LYS CA . 27439 1
506 . 1 1 48 48 LYS CB C 13 32.943 0.024 . 1 . . . . . 48 LYS CB . 27439 1
507 . 1 1 48 48 LYS CG C 13 25.062 0.000 . 1 . . . . . 48 LYS CG . 27439 1
508 . 1 1 48 48 LYS H H 1 8.826 0.010 . 1 . . . . . 48 LYS H . 27439 1
509 . 1 1 48 48 LYS HA H 1 4.399 0.012 . 1 . . . . . 48 LYS HA . 27439 1
510 . 1 1 48 48 LYS HB2 H 1 1.804 0.021 . 2 . . . . . 48 LYS HB2 . 27439 1
511 . 1 1 48 48 LYS HB3 H 1 1.805 0.019 . 2 . . . . . 48 LYS HB3 . 27439 1
512 . 1 1 48 48 LYS N N 15 120.542 0.096 . 1 . . . . . 48 LYS N . 27439 1
513 . 1 1 49 49 ASP C C 13 176.045 0.000 . 1 . . . . . 49 ASP C . 27439 1
514 . 1 1 49 49 ASP CA C 13 55.207 0.128 . 1 . . . . . 49 ASP CA . 27439 1
515 . 1 1 49 49 ASP CB C 13 41.499 0.098 . 1 . . . . . 49 ASP CB . 27439 1
516 . 1 1 49 49 ASP H H 1 8.500 0.012 . 1 . . . . . 49 ASP H . 27439 1
517 . 1 1 49 49 ASP HA H 1 4.682 0.004 . 1 . . . . . 49 ASP HA . 27439 1
518 . 1 1 49 49 ASP HB2 H 1 3.236 0.019 . 2 . . . . . 49 ASP HB2 . 27439 1
519 . 1 1 49 49 ASP HB3 H 1 2.651 0.018 . 2 . . . . . 49 ASP HB3 . 27439 1
520 . 1 1 49 49 ASP N N 15 127.572 0.114 . 1 . . . . . 49 ASP N . 27439 1
521 . 1 1 50 50 ASP C C 13 178.482 0.000 . 1 . . . . . 50 ASP C . 27439 1
522 . 1 1 50 50 ASP CA C 13 52.273 0.076 . 1 . . . . . 50 ASP CA . 27439 1
523 . 1 1 50 50 ASP CB C 13 41.656 0.140 . 1 . . . . . 50 ASP CB . 27439 1
524 . 1 1 50 50 ASP H H 1 8.630 0.017 . 1 . . . . . 50 ASP H . 27439 1
525 . 1 1 50 50 ASP HA H 1 4.785 0.013 . 1 . . . . . 50 ASP HA . 27439 1
526 . 1 1 50 50 ASP HB2 H 1 2.632 0.016 . 2 . . . . . 50 ASP HB2 . 27439 1
527 . 1 1 50 50 ASP HB3 H 1 3.225 0.017 . 2 . . . . . 50 ASP HB3 . 27439 1
528 . 1 1 50 50 ASP N N 15 125.784 0.077 . 1 . . . . . 50 ASP N . 27439 1
529 . 1 1 51 51 GLY C C 13 172.991 0.000 . 1 . . . . . 51 GLY C . 27439 1
530 . 1 1 51 51 GLY CA C 13 46.293 0.145 . 1 . . . . . 51 GLY CA . 27439 1
531 . 1 1 51 51 GLY H H 1 9.467 0.023 . 1 . . . . . 51 GLY H . 27439 1
532 . 1 1 51 51 GLY HA2 H 1 3.837 0.029 . 2 . . . . . 51 GLY HA2 . 27439 1
533 . 1 1 51 51 GLY HA3 H 1 4.174 0.017 . 2 . . . . . 51 GLY HA3 . 27439 1
534 . 1 1 51 51 GLY N N 15 110.563 0.103 . 1 . . . . . 51 GLY N . 27439 1
535 . 1 1 52 52 THR C C 13 175.431 0.000 . 1 . . . . . 52 THR C . 27439 1
536 . 1 1 52 52 THR CA C 13 59.914 0.111 . 1 . . . . . 52 THR CA . 27439 1
537 . 1 1 52 52 THR CB C 13 73.481 0.111 . 1 . . . . . 52 THR CB . 27439 1
538 . 1 1 52 52 THR CG2 C 13 20.130 0.070 . 1 . . . . . 52 THR CG2 . 27439 1
539 . 1 1 52 52 THR H H 1 8.177 0.016 . 1 . . . . . 52 THR H . 27439 1
540 . 1 1 52 52 THR HA H 1 4.906 0.010 . 1 . . . . . 52 THR HA . 27439 1
541 . 1 1 52 52 THR HB H 1 4.461 0.012 . 1 . . . . . 52 THR HB . 27439 1
542 . 1 1 52 52 THR HG21 H 1 1.103 0.009 . 1 . . . . . 52 THR HG21 . 27439 1
543 . 1 1 52 52 THR HG22 H 1 1.103 0.009 . 1 . . . . . 52 THR HG22 . 27439 1
544 . 1 1 52 52 THR HG23 H 1 1.103 0.009 . 1 . . . . . 52 THR HG23 . 27439 1
545 . 1 1 52 52 THR N N 15 109.907 0.071 . 1 . . . . . 52 THR N . 27439 1
546 . 1 1 53 53 GLU C C 13 178.275 0.000 . 1 . . . . . 53 GLU C . 27439 1
547 . 1 1 53 53 GLU CA C 13 58.541 0.020 . 1 . . . . . 53 GLU CA . 27439 1
548 . 1 1 53 53 GLU CB C 13 29.221 0.047 . 1 . . . . . 53 GLU CB . 27439 1
549 . 1 1 53 53 GLU CG C 13 35.679 0.088 . 1 . . . . . 53 GLU CG . 27439 1
550 . 1 1 53 53 GLU H H 1 9.173 0.010 . 1 . . . . . 53 GLU H . 27439 1
551 . 1 1 53 53 GLU HA H 1 4.085 0.007 . 1 . . . . . 53 GLU HA . 27439 1
552 . 1 1 53 53 GLU HB2 H 1 2.091 0.030 . 2 . . . . . 53 GLU HB2 . 27439 1
553 . 1 1 53 53 GLU HB3 H 1 2.047 0.007 . 2 . . . . . 53 GLU HB3 . 27439 1
554 . 1 1 53 53 GLU HG2 H 1 2.361 0.009 . 1 . . . . . 53 GLU HG2 . 27439 1
555 . 1 1 53 53 GLU HG3 H 1 2.361 0.009 . 1 . . . . . 53 GLU HG3 . 27439 1
556 . 1 1 53 53 GLU N N 15 118.833 0.057 . 1 . . . . . 53 GLU N . 27439 1
557 . 1 1 54 54 ARG C C 13 177.047 0.000 . 1 . . . . . 54 ARG C . 27439 1
558 . 1 1 54 54 ARG CA C 13 59.303 0.163 . 1 . . . . . 54 ARG CA . 27439 1
559 . 1 1 54 54 ARG CB C 13 30.042 0.040 . 1 . . . . . 54 ARG CB . 27439 1
560 . 1 1 54 54 ARG CD C 13 43.441 0.000 . 1 . . . . . 54 ARG CD . 27439 1
561 . 1 1 54 54 ARG CG C 13 28.071 0.000 . 1 . . . . . 54 ARG CG . 27439 1
562 . 1 1 54 54 ARG H H 1 8.276 0.015 . 1 . . . . . 54 ARG H . 27439 1
563 . 1 1 54 54 ARG HA H 1 4.036 0.009 . 1 . . . . . 54 ARG HA . 27439 1
564 . 1 1 54 54 ARG HB2 H 1 1.780 0.004 . 2 . . . . . 54 ARG HB2 . 27439 1
565 . 1 1 54 54 ARG HB3 H 1 1.628 0.008 . 2 . . . . . 54 ARG HB3 . 27439 1
566 . 1 1 54 54 ARG N N 15 118.493 0.067 . 1 . . . . . 54 ARG N . 27439 1
567 . 1 1 55 55 SER C C 13 170.606 0.000 . 1 . . . . . 55 SER C . 27439 1
568 . 1 1 55 55 SER CA C 13 59.484 0.018 . 1 . . . . . 55 SER CA . 27439 1
569 . 1 1 55 55 SER CB C 13 64.529 0.116 . 1 . . . . . 55 SER CB . 27439 1
570 . 1 1 55 55 SER H H 1 7.948 0.014 . 1 . . . . . 55 SER H . 27439 1
571 . 1 1 55 55 SER HA H 1 4.408 0.008 . 1 . . . . . 55 SER HA . 27439 1
572 . 1 1 55 55 SER HB2 H 1 4.649 0.011 . 2 . . . . . 55 SER HB2 . 27439 1
573 . 1 1 55 55 SER HB3 H 1 4.412 0.011 . 2 . . . . . 55 SER HB3 . 27439 1
574 . 1 1 55 55 SER N N 15 110.618 0.086 . 1 . . . . . 55 SER N . 27439 1
575 . 1 1 56 56 ARG C C 13 176.293 0.000 . 1 . . . . . 56 ARG C . 27439 1
576 . 1 1 56 56 ARG CA C 13 56.246 0.070 . 1 . . . . . 56 ARG CA . 27439 1
577 . 1 1 56 56 ARG CB C 13 30.774 0.138 . 1 . . . . . 56 ARG CB . 27439 1
578 . 1 1 56 56 ARG CD C 13 43.432 0.000 . 1 . . . . . 56 ARG CD . 27439 1
579 . 1 1 56 56 ARG CG C 13 27.603 0.000 . 1 . . . . . 56 ARG CG . 27439 1
580 . 1 1 56 56 ARG H H 1 7.053 0.011 . 1 . . . . . 56 ARG H . 27439 1
581 . 1 1 56 56 ARG HA H 1 4.632 0.025 . 1 . . . . . 56 ARG HA . 27439 1
582 . 1 1 56 56 ARG HB2 H 1 1.924 0.021 . 2 . . . . . 56 ARG HB2 . 27439 1
583 . 1 1 56 56 ARG HB3 H 1 1.605 0.013 . 2 . . . . . 56 ARG HB3 . 27439 1
584 . 1 1 56 56 ARG N N 15 119.081 0.076 . 1 . . . . . 56 ARG N . 27439 1
585 . 1 1 57 57 TRP C C 13 171.332 0.000 . 1 . . . . . 57 TRP C . 27439 1
586 . 1 1 57 57 TRP CA C 13 57.317 0.090 . 1 . . . . . 57 TRP CA . 27439 1
587 . 1 1 57 57 TRP CB C 13 32.286 0.173 . 1 . . . . . 57 TRP CB . 27439 1
588 . 1 1 57 57 TRP H H 1 8.625 0.013 . 1 . . . . . 57 TRP H . 27439 1
589 . 1 1 57 57 TRP HA H 1 4.772 0.007 . 1 . . . . . 57 TRP HA . 27439 1
590 . 1 1 57 57 TRP HB2 H 1 2.741 0.014 . 2 . . . . . 57 TRP HB2 . 27439 1
591 . 1 1 57 57 TRP HB3 H 1 2.862 0.016 . 2 . . . . . 57 TRP HB3 . 27439 1
592 . 1 1 57 57 TRP HE1 H 1 6.726 0.011 . 1 . . . . . 57 TRP HE1 . 27439 1
593 . 1 1 57 57 TRP N N 15 127.009 0.108 . 1 . . . . . 57 TRP N . 27439 1
594 . 1 1 58 58 ASN C C 13 174.960 0.000 . 1 . . . . . 58 ASN C . 27439 1
595 . 1 1 58 58 ASN CA C 13 52.238 0.071 . 1 . . . . . 58 ASN CA . 27439 1
596 . 1 1 58 58 ASN CB C 13 42.912 0.062 . 1 . . . . . 58 ASN CB . 27439 1
597 . 1 1 58 58 ASN H H 1 8.866 0.012 . 1 . . . . . 58 ASN H . 27439 1
598 . 1 1 58 58 ASN HA H 1 5.616 0.007 . 1 . . . . . 58 ASN HA . 27439 1
599 . 1 1 58 58 ASN HB2 H 1 2.599 0.012 . 2 . . . . . 58 ASN HB2 . 27439 1
600 . 1 1 58 58 ASN HB3 H 1 2.469 0.018 . 2 . . . . . 58 ASN HB3 . 27439 1
601 . 1 1 58 58 ASN N N 15 120.343 0.066 . 1 . . . . . 58 ASN N . 27439 1
602 . 1 1 59 59 CYS C C 13 171.110 0.000 . 1 . . . . . 59 CYS C . 27439 1
603 . 1 1 59 59 CYS CA C 13 55.321 0.080 . 1 . . . . . 59 CYS CA . 27439 1
604 . 1 1 59 59 CYS CB C 13 51.047 0.112 . 1 . . . . . 59 CYS CB . 27439 1
605 . 1 1 59 59 CYS H H 1 9.326 0.014 . 1 . . . . . 59 CYS H . 27439 1
606 . 1 1 59 59 CYS HA H 1 5.551 0.010 . 1 . . . . . 59 CYS HA . 27439 1
607 . 1 1 59 59 CYS HB2 H 1 1.935 0.019 . 2 . . . . . 59 CYS HB2 . 27439 1
608 . 1 1 59 59 CYS HB3 H 1 2.738 0.015 . 2 . . . . . 59 CYS HB3 . 27439 1
609 . 1 1 59 59 CYS N N 15 119.000 0.061 . 1 . . . . . 59 CYS N . 27439 1
610 . 1 1 60 60 LEU C C 13 175.977 0.000 . 1 . . . . . 60 LEU C . 27439 1
611 . 1 1 60 60 LEU CA C 13 54.020 0.098 . 1 . . . . . 60 LEU CA . 27439 1
612 . 1 1 60 60 LEU CB C 13 43.714 0.037 . 1 . . . . . 60 LEU CB . 27439 1
613 . 1 1 60 60 LEU H H 1 8.311 0.027 . 1 . . . . . 60 LEU H . 27439 1
614 . 1 1 60 60 LEU HA H 1 5.034 0.009 . 1 . . . . . 60 LEU HA . 27439 1
615 . 1 1 60 60 LEU HB2 H 1 1.837 0.013 . 2 . . . . . 60 LEU HB2 . 27439 1
616 . 1 1 60 60 LEU HB3 H 1 1.704 0.030 . 2 . . . . . 60 LEU HB3 . 27439 1
617 . 1 1 60 60 LEU N N 15 126.616 0.142 . 1 . . . . . 60 LEU N . 27439 1
618 . 1 1 61 61 PHE C C 13 175.464 0.000 . 1 . . . . . 61 PHE C . 27439 1
619 . 1 1 61 61 PHE CA C 13 56.757 0.055 . 1 . . . . . 61 PHE CA . 27439 1
620 . 1 1 61 61 PHE CB C 13 43.544 0.255 . 1 . . . . . 61 PHE CB . 27439 1
621 . 1 1 61 61 PHE H H 1 9.358 0.016 . 1 . . . . . 61 PHE H . 27439 1
622 . 1 1 61 61 PHE HA H 1 5.920 0.014 . 1 . . . . . 61 PHE HA . 27439 1
623 . 1 1 61 61 PHE HB2 H 1 3.022 0.015 . 2 . . . . . 61 PHE HB2 . 27439 1
624 . 1 1 61 61 PHE HB3 H 1 3.447 0.010 . 2 . . . . . 61 PHE HB3 . 27439 1
625 . 1 1 61 61 PHE HD1 H 1 7.318 0.017 . 3 . . . . . 61 PHE HD1 . 27439 1
626 . 1 1 61 61 PHE HD2 H 1 7.318 0.017 . 3 . . . . . 61 PHE HD2 . 27439 1
627 . 1 1 61 61 PHE HE1 H 1 7.085 0.018 . 3 . . . . . 61 PHE HE1 . 27439 1
628 . 1 1 61 61 PHE HE2 H 1 7.085 0.018 . 3 . . . . . 61 PHE HE2 . 27439 1
629 . 1 1 61 61 PHE HZ H 1 7.094 0.009 . 1 . . . . . 61 PHE HZ . 27439 1
630 . 1 1 61 61 PHE N N 15 125.613 0.114 . 1 . . . . . 61 PHE N . 27439 1
631 . 1 1 62 62 ARG C C 13 173.900 0.000 . 1 . . . . . 62 ARG C . 27439 1
632 . 1 1 62 62 ARG CA C 13 55.040 0.117 . 1 . . . . . 62 ARG CA . 27439 1
633 . 1 1 62 62 ARG CB C 13 35.911 0.070 . 1 . . . . . 62 ARG CB . 27439 1
634 . 1 1 62 62 ARG H H 1 9.517 0.018 . 1 . . . . . 62 ARG H . 27439 1
635 . 1 1 62 62 ARG HA H 1 6.259 0.007 . 1 . . . . . 62 ARG HA . 27439 1
636 . 1 1 62 62 ARG HB2 H 1 2.080 0.014 . 2 . . . . . 62 ARG HB2 . 27439 1
637 . 1 1 62 62 ARG HB3 H 1 1.773 0.013 . 2 . . . . . 62 ARG HB3 . 27439 1
638 . 1 1 62 62 ARG N N 15 117.579 0.137 . 1 . . . . . 62 ARG N . 27439 1
639 . 1 1 63 63 GLN C C 13 173.781 0.000 . 1 . . . . . 63 GLN C . 27439 1
640 . 1 1 63 63 GLN CA C 13 55.318 0.000 . 1 . . . . . 63 GLN CA . 27439 1
641 . 1 1 63 63 GLN H H 1 8.780 0.014 . 1 . . . . . 63 GLN H . 27439 1
642 . 1 1 63 63 GLN HA H 1 4.789 0.007 . 1 . . . . . 63 GLN HA . 27439 1
643 . 1 1 63 63 GLN N N 15 113.330 0.147 . 1 . . . . . 63 GLN N . 27439 1
644 . 1 1 64 64 GLY C C 13 175.755 0.000 . 1 . . . . . 64 GLY C . 27439 1
645 . 1 1 64 64 GLY CA C 13 43.327 0.145 . 1 . . . . . 64 GLY CA . 27439 1
646 . 1 1 64 64 GLY H H 1 8.857 0.011 . 1 . . . . . 64 GLY H . 27439 1
647 . 1 1 64 64 GLY HA2 H 1 3.754 0.017 . 2 . . . . . 64 GLY HA2 . 27439 1
648 . 1 1 64 64 GLY HA3 H 1 4.519 0.011 . 2 . . . . . 64 GLY HA3 . 27439 1
649 . 1 1 64 64 GLY N N 15 106.975 0.086 . 1 . . . . . 64 GLY N . 27439 1
650 . 1 1 65 65 ILE CA C 13 62.633 0.096 . 1 . . . . . 65 ILE CA . 27439 1
651 . 1 1 65 65 ILE CB C 13 37.192 0.103 . 1 . . . . . 65 ILE CB . 27439 1
652 . 1 1 65 65 ILE CD1 C 13 12.633 0.100 . 1 . . . . . 65 ILE CD1 . 27439 1
653 . 1 1 65 65 ILE CG1 C 13 28.114 0.056 . 1 . . . . . 65 ILE CG1 . 27439 1
654 . 1 1 65 65 ILE CG2 C 13 16.880 0.059 . 1 . . . . . 65 ILE CG2 . 27439 1
655 . 1 1 65 65 ILE H H 1 8.837 0.007 . 1 . . . . . 65 ILE H . 27439 1
656 . 1 1 65 65 ILE HA H 1 3.930 0.009 . 1 . . . . . 65 ILE HA . 27439 1
657 . 1 1 65 65 ILE HB H 1 1.753 0.007 . 1 . . . . . 65 ILE HB . 27439 1
658 . 1 1 65 65 ILE HD11 H 1 0.927 0.033 . 1 . . . . . 65 ILE HD11 . 27439 1
659 . 1 1 65 65 ILE HD12 H 1 0.927 0.033 . 1 . . . . . 65 ILE HD12 . 27439 1
660 . 1 1 65 65 ILE HD13 H 1 0.927 0.033 . 1 . . . . . 65 ILE HD13 . 27439 1
661 . 1 1 65 65 ILE HG12 H 1 1.270 0.005 . 1 . . . . . 65 ILE HG12 . 27439 1
662 . 1 1 65 65 ILE HG13 H 1 1.270 0.005 . 1 . . . . . 65 ILE HG13 . 27439 1
663 . 1 1 65 65 ILE HG21 H 1 0.951 0.018 . 1 . . . . . 65 ILE HG21 . 27439 1
664 . 1 1 65 65 ILE HG22 H 1 0.951 0.018 . 1 . . . . . 65 ILE HG22 . 27439 1
665 . 1 1 65 65 ILE HG23 H 1 0.951 0.018 . 1 . . . . . 65 ILE HG23 . 27439 1
666 . 1 1 65 65 ILE N N 15 123.724 0.097 . 1 . . . . . 65 ILE N . 27439 1
667 . 1 1 68 68 LYS C C 13 176.310 0.000 . 1 . . . . . 68 LYS C . 27439 1
668 . 1 1 68 68 LYS CA C 13 59.343 0.000 . 1 . . . . . 68 LYS CA . 27439 1
669 . 1 1 68 68 LYS CB C 13 32.879 0.056 . 1 . . . . . 68 LYS CB . 27439 1
670 . 1 1 68 68 LYS HA H 1 3.878 0.010 . 1 . . . . . 68 LYS HA . 27439 1
671 . 1 1 68 68 LYS HB2 H 1 1.802 0.018 . 2 . . . . . 68 LYS HB2 . 27439 1
672 . 1 1 68 68 LYS HB3 H 1 1.451 0.016 . 2 . . . . . 68 LYS HB3 . 27439 1
673 . 1 1 69 69 PHE C C 13 176.000 0.000 . 1 . . . . . 69 PHE C . 27439 1
674 . 1 1 69 69 PHE CA C 13 57.037 0.124 . 1 . . . . . 69 PHE CA . 27439 1
675 . 1 1 69 69 PHE CB C 13 40.519 0.089 . 1 . . . . . 69 PHE CB . 27439 1
676 . 1 1 69 69 PHE H H 1 8.155 0.016 . 1 . . . . . 69 PHE H . 27439 1
677 . 1 1 69 69 PHE HA H 1 5.603 0.010 . 1 . . . . . 69 PHE HA . 27439 1
678 . 1 1 69 69 PHE HB2 H 1 2.850 0.012 . 2 . . . . . 69 PHE HB2 . 27439 1
679 . 1 1 69 69 PHE HB3 H 1 2.762 0.011 . 2 . . . . . 69 PHE HB3 . 27439 1
680 . 1 1 69 69 PHE N N 15 116.984 0.093 . 1 . . . . . 69 PHE N . 27439 1
681 . 1 1 70 70 PHE C C 13 174.746 0.000 . 1 . . . . . 70 PHE C . 27439 1
682 . 1 1 70 70 PHE CA C 13 55.674 0.073 . 1 . . . . . 70 PHE CA . 27439 1
683 . 1 1 70 70 PHE CB C 13 43.911 0.077 . 1 . . . . . 70 PHE CB . 27439 1
684 . 1 1 70 70 PHE H H 1 9.596 0.014 . 1 . . . . . 70 PHE H . 27439 1
685 . 1 1 70 70 PHE HA H 1 6.701 0.011 . 1 . . . . . 70 PHE HA . 27439 1
686 . 1 1 70 70 PHE HB2 H 1 3.320 0.010 . 2 . . . . . 70 PHE HB2 . 27439 1
687 . 1 1 70 70 PHE HB3 H 1 3.154 0.017 . 2 . . . . . 70 PHE HB3 . 27439 1
688 . 1 1 70 70 PHE HD1 H 1 7.216 0.008 . 3 . . . . . 70 PHE HD1 . 27439 1
689 . 1 1 70 70 PHE HD2 H 1 7.216 0.008 . 3 . . . . . 70 PHE HD2 . 27439 1
690 . 1 1 70 70 PHE HE1 H 1 7.368 0.012 . 3 . . . . . 70 PHE HE1 . 27439 1
691 . 1 1 70 70 PHE HE2 H 1 7.368 0.012 . 3 . . . . . 70 PHE HE2 . 27439 1
692 . 1 1 70 70 PHE N N 15 116.442 0.052 . 1 . . . . . 70 PHE N . 27439 1
693 . 1 1 71 71 THR C C 13 171.065 0.000 . 1 . . . . . 71 THR C . 27439 1
694 . 1 1 71 71 THR CA C 13 62.372 0.095 . 1 . . . . . 71 THR CA . 27439 1
695 . 1 1 71 71 THR CB C 13 68.690 0.175 . 1 . . . . . 71 THR CB . 27439 1
696 . 1 1 71 71 THR CG2 C 13 19.483 0.058 . 1 . . . . . 71 THR CG2 . 27439 1
697 . 1 1 71 71 THR H H 1 9.080 0.013 . 1 . . . . . 71 THR H . 27439 1
698 . 1 1 71 71 THR HA H 1 4.439 0.014 . 1 . . . . . 71 THR HA . 27439 1
699 . 1 1 71 71 THR HB H 1 4.149 0.013 . 1 . . . . . 71 THR HB . 27439 1
700 . 1 1 71 71 THR HG21 H 1 0.396 0.014 . 1 . . . . . 71 THR HG21 . 27439 1
701 . 1 1 71 71 THR HG22 H 1 0.396 0.014 . 1 . . . . . 71 THR HG22 . 27439 1
702 . 1 1 71 71 THR HG23 H 1 0.396 0.014 . 1 . . . . . 71 THR HG23 . 27439 1
703 . 1 1 71 71 THR N N 15 113.026 0.109 . 1 . . . . . 71 THR N . 27439 1
704 . 1 1 72 72 GLU C C 13 175.133 0.000 . 1 . . . . . 72 GLU C . 27439 1
705 . 1 1 72 72 GLU CA C 13 55.084 0.059 . 1 . . . . . 72 GLU CA . 27439 1
706 . 1 1 72 72 GLU CB C 13 32.433 0.041 . 1 . . . . . 72 GLU CB . 27439 1
707 . 1 1 72 72 GLU CG C 13 36.745 0.000 . 1 . . . . . 72 GLU CG . 27439 1
708 . 1 1 72 72 GLU H H 1 8.303 0.016 . 1 . . . . . 72 GLU H . 27439 1
709 . 1 1 72 72 GLU HA H 1 5.423 0.012 . 1 . . . . . 72 GLU HA . 27439 1
710 . 1 1 72 72 GLU HB2 H 1 1.971 0.019 . 2 . . . . . 72 GLU HB2 . 27439 1
711 . 1 1 72 72 GLU HB3 H 1 2.105 0.015 . 2 . . . . . 72 GLU HB3 . 27439 1
712 . 1 1 72 72 GLU HG2 H 1 2.181 0.000 . 1 . . . . . 72 GLU HG2 . 27439 1
713 . 1 1 72 72 GLU HG3 H 1 2.181 0.000 . 1 . . . . . 72 GLU HG3 . 27439 1
714 . 1 1 72 72 GLU N N 15 126.899 0.144 . 1 . . . . . 72 GLU N . 27439 1
715 . 1 1 73 73 VAL C C 13 174.393 0.000 . 1 . . . . . 73 VAL C . 27439 1
716 . 1 1 73 73 VAL CA C 13 59.239 0.079 . 1 . . . . . 73 VAL CA . 27439 1
717 . 1 1 73 73 VAL CB C 13 36.029 0.108 . 1 . . . . . 73 VAL CB . 27439 1
718 . 1 1 73 73 VAL CG1 C 13 21.442 0.000 . 2 . . . . . 73 VAL CG1 . 27439 1
719 . 1 1 73 73 VAL CG2 C 13 21.193 0.027 . 2 . . . . . 73 VAL CG2 . 27439 1
720 . 1 1 73 73 VAL H H 1 8.915 0.013 . 1 . . . . . 73 VAL H . 27439 1
721 . 1 1 73 73 VAL HA H 1 4.467 0.012 . 1 . . . . . 73 VAL HA . 27439 1
722 . 1 1 73 73 VAL HB H 1 2.012 0.012 . 1 . . . . . 73 VAL HB . 27439 1
723 . 1 1 73 73 VAL HG11 H 1 0.773 0.017 . 2 . . . . . 73 VAL HG11 . 27439 1
724 . 1 1 73 73 VAL HG12 H 1 0.773 0.017 . 2 . . . . . 73 VAL HG12 . 27439 1
725 . 1 1 73 73 VAL HG13 H 1 0.773 0.017 . 2 . . . . . 73 VAL HG13 . 27439 1
726 . 1 1 73 73 VAL HG21 H 1 0.921 0.033 . 2 . . . . . 73 VAL HG21 . 27439 1
727 . 1 1 73 73 VAL HG22 H 1 0.921 0.033 . 2 . . . . . 73 VAL HG22 . 27439 1
728 . 1 1 73 73 VAL HG23 H 1 0.921 0.033 . 2 . . . . . 73 VAL HG23 . 27439 1
729 . 1 1 73 73 VAL N N 15 120.407 0.060 . 1 . . . . . 73 VAL N . 27439 1
730 . 1 1 74 74 GLU C C 13 173.995 0.000 . 1 . . . . . 74 GLU C . 27439 1
731 . 1 1 74 74 GLU CA C 13 55.917 0.097 . 1 . . . . . 74 GLU CA . 27439 1
732 . 1 1 74 74 GLU CB C 13 29.604 0.169 . 1 . . . . . 74 GLU CB . 27439 1
733 . 1 1 74 74 GLU CG C 13 37.065 0.043 . 1 . . . . . 74 GLU CG . 27439 1
734 . 1 1 74 74 GLU H H 1 8.750 0.019 . 1 . . . . . 74 GLU H . 27439 1
735 . 1 1 74 74 GLU HA H 1 4.766 0.012 . 1 . . . . . 74 GLU HA . 27439 1
736 . 1 1 74 74 GLU HB2 H 1 1.855 0.024 . 2 . . . . . 74 GLU HB2 . 27439 1
737 . 1 1 74 74 GLU HB3 H 1 2.027 0.005 . 2 . . . . . 74 GLU HB3 . 27439 1
738 . 1 1 74 74 GLU HG2 H 1 2.139 0.008 . 2 . . . . . 74 GLU HG2 . 27439 1
739 . 1 1 74 74 GLU HG3 H 1 2.147 0.001 . 2 . . . . . 74 GLU HG3 . 27439 1
740 . 1 1 74 74 GLU N N 15 127.861 0.098 . 1 . . . . . 74 GLU N . 27439 1
741 . 1 1 75 75 ALA C C 13 175.100 0.000 . 1 . . . . . 75 ALA C . 27439 1
742 . 1 1 75 75 ALA CA C 13 52.798 0.078 . 1 . . . . . 75 ALA CA . 27439 1
743 . 1 1 75 75 ALA CB C 13 21.014 0.066 . 1 . . . . . 75 ALA CB . 27439 1
744 . 1 1 75 75 ALA H H 1 8.073 0.013 . 1 . . . . . 75 ALA H . 27439 1
745 . 1 1 75 75 ALA HA H 1 4.070 0.008 . 1 . . . . . 75 ALA HA . 27439 1
746 . 1 1 75 75 ALA HB1 H 1 1.255 0.011 . 1 . . . . . 75 ALA HB1 . 27439 1
747 . 1 1 75 75 ALA HB2 H 1 1.255 0.011 . 1 . . . . . 75 ALA HB2 . 27439 1
748 . 1 1 75 75 ALA HB3 H 1 1.255 0.011 . 1 . . . . . 75 ALA HB3 . 27439 1
749 . 1 1 75 75 ALA N N 15 130.811 0.077 . 1 . . . . . 75 ALA N . 27439 1
750 . 1 1 76 76 TYR C C 13 172.999 0.000 . 1 . . . . . 76 TYR C . 27439 1
751 . 1 1 76 76 TYR CA C 13 59.788 0.083 . 1 . . . . . 76 TYR CA . 27439 1
752 . 1 1 76 76 TYR CB C 13 42.124 0.044 . 1 . . . . . 76 TYR CB . 27439 1
753 . 1 1 76 76 TYR H H 1 7.378 0.014 . 1 . . . . . 76 TYR H . 27439 1
754 . 1 1 76 76 TYR HA H 1 4.327 0.011 . 1 . . . . . 76 TYR HA . 27439 1
755 . 1 1 76 76 TYR HB2 H 1 2.865 0.019 . 2 . . . . . 76 TYR HB2 . 27439 1
756 . 1 1 76 76 TYR HB3 H 1 2.866 0.021 . 2 . . . . . 76 TYR HB3 . 27439 1
757 . 1 1 76 76 TYR HD1 H 1 7.210 0.019 . 3 . . . . . 76 TYR HD1 . 27439 1
758 . 1 1 76 76 TYR HD2 H 1 7.210 0.019 . 3 . . . . . 76 TYR HD2 . 27439 1
759 . 1 1 76 76 TYR HE1 H 1 7.309 0.005 . 3 . . . . . 76 TYR HE1 . 27439 1
760 . 1 1 76 76 TYR HE2 H 1 7.309 0.005 . 3 . . . . . 76 TYR HE2 . 27439 1
761 . 1 1 76 76 TYR N N 15 111.974 0.052 . 1 . . . . . 76 TYR N . 27439 1
762 . 1 1 77 77 ARG CA C 13 51.654 0.000 . 1 . . . . . 77 ARG CA . 27439 1
763 . 1 1 77 77 ARG CB C 13 31.558 0.000 . 1 . . . . . 77 ARG CB . 27439 1
764 . 1 1 77 77 ARG H H 1 7.837 0.029 . 1 . . . . . 77 ARG H . 27439 1
765 . 1 1 77 77 ARG HA H 1 4.680 0.016 . 1 . . . . . 77 ARG HA . 27439 1
766 . 1 1 77 77 ARG HB2 H 1 1.580 0.027 . 2 . . . . . 77 ARG HB2 . 27439 1
767 . 1 1 77 77 ARG HB3 H 1 1.578 0.027 . 2 . . . . . 77 ARG HB3 . 27439 1
768 . 1 1 77 77 ARG HG2 H 1 1.364 0.008 . 2 . . . . . 77 ARG HG2 . 27439 1
769 . 1 1 77 77 ARG HG3 H 1 1.430 0.000 . 2 . . . . . 77 ARG HG3 . 27439 1
770 . 1 1 77 77 ARG N N 15 129.133 0.121 . 1 . . . . . 77 ARG N . 27439 1
771 . 1 1 78 78 PRO C C 13 174.759 0.000 . 1 . . . . . 78 PRO C . 27439 1
772 . 1 1 78 78 PRO CA C 13 62.280 0.070 . 1 . . . . . 78 PRO CA . 27439 1
773 . 1 1 78 78 PRO CB C 13 32.621 0.038 . 1 . . . . . 78 PRO CB . 27439 1
774 . 1 1 78 78 PRO HA H 1 4.157 0.025 . 1 . . . . . 78 PRO HA . 27439 1
775 . 1 1 78 78 PRO HB2 H 1 1.648 0.009 . 2 . . . . . 78 PRO HB2 . 27439 1
776 . 1 1 78 78 PRO HB3 H 1 2.443 0.005 . 2 . . . . . 78 PRO HB3 . 27439 1
777 . 1 1 79 79 ASP C C 13 175.796 0.000 . 1 . . . . . 79 ASP C . 27439 1
778 . 1 1 79 79 ASP CA C 13 52.801 0.095 . 1 . . . . . 79 ASP CA . 27439 1
779 . 1 1 79 79 ASP CB C 13 41.321 0.049 . 1 . . . . . 79 ASP CB . 27439 1
780 . 1 1 79 79 ASP H H 1 9.607 0.013 . 1 . . . . . 79 ASP H . 27439 1
781 . 1 1 79 79 ASP HA H 1 4.613 0.017 . 1 . . . . . 79 ASP HA . 27439 1
782 . 1 1 79 79 ASP HB2 H 1 2.565 0.016 . 2 . . . . . 79 ASP HB2 . 27439 1
783 . 1 1 79 79 ASP HB3 H 1 3.070 0.010 . 2 . . . . . 79 ASP HB3 . 27439 1
784 . 1 1 79 79 ASP N N 15 124.409 0.070 . 1 . . . . . 79 ASP N . 27439 1
785 . 1 1 80 80 LEU C C 13 178.651 0.000 . 1 . . . . . 80 LEU C . 27439 1
786 . 1 1 80 80 LEU CA C 13 56.955 0.087 . 1 . . . . . 80 LEU CA . 27439 1
787 . 1 1 80 80 LEU CB C 13 40.684 0.080 . 1 . . . . . 80 LEU CB . 27439 1
788 . 1 1 80 80 LEU CG C 13 24.696 0.000 . 1 . . . . . 80 LEU CG . 27439 1
789 . 1 1 80 80 LEU H H 1 7.960 0.011 . 1 . . . . . 80 LEU H . 27439 1
790 . 1 1 80 80 LEU HA H 1 4.009 0.008 . 1 . . . . . 80 LEU HA . 27439 1
791 . 1 1 80 80 LEU HB2 H 1 1.702 0.016 . 2 . . . . . 80 LEU HB2 . 27439 1
792 . 1 1 80 80 LEU HB3 H 1 1.478 0.013 . 2 . . . . . 80 LEU HB3 . 27439 1
793 . 1 1 80 80 LEU N N 15 122.435 0.096 . 1 . . . . . 80 LEU N . 27439 1
794 . 1 1 81 81 LYS C C 13 176.414 0.000 . 1 . . . . . 81 LYS C . 27439 1
795 . 1 1 81 81 LYS CA C 13 57.798 0.051 . 1 . . . . . 81 LYS CA . 27439 1
796 . 1 1 81 81 LYS CB C 13 31.134 0.122 . 1 . . . . . 81 LYS CB . 27439 1
797 . 1 1 81 81 LYS CG C 13 25.311 0.000 . 1 . . . . . 81 LYS CG . 27439 1
798 . 1 1 81 81 LYS H H 1 8.866 0.020 . 1 . . . . . 81 LYS H . 27439 1
799 . 1 1 81 81 LYS HA H 1 4.080 0.012 . 1 . . . . . 81 LYS HA . 27439 1
800 . 1 1 81 81 LYS HB2 H 1 1.853 0.009 . 2 . . . . . 81 LYS HB2 . 27439 1
801 . 1 1 81 81 LYS HB3 H 1 1.717 0.014 . 2 . . . . . 81 LYS HB3 . 27439 1
802 . 1 1 81 81 LYS N N 15 114.759 0.094 . 1 . . . . . 81 LYS N . 27439 1
803 . 1 1 82 82 HIS CA C 13 52.833 0.076 . 1 . . . . . 82 HIS CA . 27439 1
804 . 1 1 82 82 HIS CB C 13 28.943 0.033 . 1 . . . . . 82 HIS CB . 27439 1
805 . 1 1 82 82 HIS H H 1 8.610 0.014 . 1 . . . . . 82 HIS H . 27439 1
806 . 1 1 82 82 HIS HA H 1 5.079 0.007 . 1 . . . . . 82 HIS HA . 27439 1
807 . 1 1 82 82 HIS HB2 H 1 2.995 0.011 . 2 . . . . . 82 HIS HB2 . 27439 1
808 . 1 1 82 82 HIS HB3 H 1 3.138 0.006 . 2 . . . . . 82 HIS HB3 . 27439 1
809 . 1 1 82 82 HIS HD1 H 1 6.954 0.000 . 1 . . . . . 82 HIS HD1 . 27439 1
810 . 1 1 82 82 HIS HE1 H 1 7.766 0.000 . 1 . . . . . 82 HIS HE1 . 27439 1
811 . 1 1 82 82 HIS N N 15 117.581 0.101 . 1 . . . . . 82 HIS N . 27439 1
812 . 1 1 83 83 PRO C C 13 176.540 0.000 . 1 . . . . . 83 PRO C . 27439 1
813 . 1 1 83 83 PRO CA C 13 63.227 0.087 . 1 . . . . . 83 PRO CA . 27439 1
814 . 1 1 83 83 PRO CB C 13 31.893 0.000 . 1 . . . . . 83 PRO CB . 27439 1
815 . 1 1 83 83 PRO HA H 1 4.317 0.017 . 1 . . . . . 83 PRO HA . 27439 1
816 . 1 1 83 83 PRO HB2 H 1 1.810 0.016 . 2 . . . . . 83 PRO HB2 . 27439 1
817 . 1 1 83 83 PRO HB3 H 1 2.073 0.006 . 2 . . . . . 83 PRO HB3 . 27439 1
818 . 1 1 84 84 LEU C C 13 176.380 0.000 . 1 . . . . . 84 LEU C . 27439 1
819 . 1 1 84 84 LEU CA C 13 53.813 0.044 . 1 . . . . . 84 LEU CA . 27439 1
820 . 1 1 84 84 LEU CB C 13 43.322 0.068 . 1 . . . . . 84 LEU CB . 27439 1
821 . 1 1 84 84 LEU CG C 13 25.531 0.000 . 1 . . . . . 84 LEU CG . 27439 1
822 . 1 1 84 84 LEU H H 1 8.992 0.010 . 1 . . . . . 84 LEU H . 27439 1
823 . 1 1 84 84 LEU HA H 1 4.763 0.017 . 1 . . . . . 84 LEU HA . 27439 1
824 . 1 1 84 84 LEU HB2 H 1 2.307 0.006 . 2 . . . . . 84 LEU HB2 . 27439 1
825 . 1 1 84 84 LEU HB3 H 1 1.379 0.008 . 2 . . . . . 84 LEU HB3 . 27439 1
826 . 1 1 84 84 LEU N N 15 125.001 0.079 . 1 . . . . . 84 LEU N . 27439 1
827 . 1 1 85 85 CYS C C 13 176.753 0.000 . 1 . . . . . 85 CYS C . 27439 1
828 . 1 1 85 85 CYS CA C 13 54.234 0.113 . 1 . . . . . 85 CYS CA . 27439 1
829 . 1 1 85 85 CYS CB C 13 45.809 0.070 . 1 . . . . . 85 CYS CB . 27439 1
830 . 1 1 85 85 CYS H H 1 8.055 0.008 . 1 . . . . . 85 CYS H . 27439 1
831 . 1 1 85 85 CYS HA H 1 4.876 0.029 . 1 . . . . . 85 CYS HA . 27439 1
832 . 1 1 85 85 CYS HB2 H 1 2.797 0.020 . 2 . . . . . 85 CYS HB2 . 27439 1
833 . 1 1 85 85 CYS HB3 H 1 3.320 0.010 . 2 . . . . . 85 CYS HB3 . 27439 1
834 . 1 1 85 85 CYS N N 15 114.119 0.047 . 1 . . . . . 85 CYS N . 27439 1
835 . 1 1 86 86 GLY C C 13 173.409 0.000 . 1 . . . . . 86 GLY C . 27439 1
836 . 1 1 86 86 GLY CA C 13 47.464 0.129 . 1 . . . . . 86 GLY CA . 27439 1
837 . 1 1 86 86 GLY H H 1 8.070 0.017 . 1 . . . . . 86 GLY H . 27439 1
838 . 1 1 86 86 GLY HA2 H 1 3.676 0.012 . 2 . . . . . 86 GLY HA2 . 27439 1
839 . 1 1 86 86 GLY HA3 H 1 3.740 0.019 . 2 . . . . . 86 GLY HA3 . 27439 1
840 . 1 1 86 86 GLY N N 15 108.711 0.131 . 1 . . . . . 86 GLY N . 27439 1
841 . 1 1 87 87 LYS CA C 13 53.602 0.117 . 1 . . . . . 87 LYS CA . 27439 1
842 . 1 1 87 87 LYS CB C 13 34.088 0.102 . 1 . . . . . 87 LYS CB . 27439 1
843 . 1 1 87 87 LYS H H 1 6.067 0.031 . 1 . . . . . 87 LYS H . 27439 1
844 . 1 1 87 87 LYS HA H 1 4.484 0.015 . 1 . . . . . 87 LYS HA . 27439 1
845 . 1 1 87 87 LYS HB2 H 1 1.727 0.024 . 2 . . . . . 87 LYS HB2 . 27439 1
846 . 1 1 87 87 LYS HB3 H 1 1.718 0.025 . 2 . . . . . 87 LYS HB3 . 27439 1
847 . 1 1 87 87 LYS N N 15 115.254 0.076 . 1 . . . . . 87 LYS N . 27439 1
848 . 1 1 88 88 ARG C C 13 173.903 0.000 . 1 . . . . . 88 ARG C . 27439 1
849 . 1 1 88 88 ARG CA C 13 55.091 0.070 . 1 . . . . . 88 ARG CA . 27439 1
850 . 1 1 88 88 ARG CB C 13 33.052 0.113 . 1 . . . . . 88 ARG CB . 27439 1
851 . 1 1 88 88 ARG CD C 13 43.504 0.000 . 1 . . . . . 88 ARG CD . 27439 1
852 . 1 1 88 88 ARG CG C 13 28.002 0.000 . 1 . . . . . 88 ARG CG . 27439 1
853 . 1 1 88 88 ARG H H 1 8.256 0.010 . 1 . . . . . 88 ARG H . 27439 1
854 . 1 1 88 88 ARG HA H 1 5.249 0.008 . 1 . . . . . 88 ARG HA . 27439 1
855 . 1 1 88 88 ARG HB2 H 1 1.586 0.013 . 2 . . . . . 88 ARG HB2 . 27439 1
856 . 1 1 88 88 ARG HB3 H 1 1.589 0.014 . 2 . . . . . 88 ARG HB3 . 27439 1
857 . 1 1 88 88 ARG N N 15 122.617 0.095 . 1 . . . . . 88 ARG N . 27439 1
858 . 1 1 89 89 TYR C C 13 174.059 0.000 . 1 . . . . . 89 TYR C . 27439 1
859 . 1 1 89 89 TYR CA C 13 55.958 0.033 . 1 . . . . . 89 TYR CA . 27439 1
860 . 1 1 89 89 TYR CB C 13 40.779 0.129 . 1 . . . . . 89 TYR CB . 27439 1
861 . 1 1 89 89 TYR H H 1 8.977 0.015 . 1 . . . . . 89 TYR H . 27439 1
862 . 1 1 89 89 TYR HA H 1 4.971 0.022 . 1 . . . . . 89 TYR HA . 27439 1
863 . 1 1 89 89 TYR HB2 H 1 3.114 0.028 . 2 . . . . . 89 TYR HB2 . 27439 1
864 . 1 1 89 89 TYR HB3 H 1 2.899 0.033 . 2 . . . . . 89 TYR HB3 . 27439 1
865 . 1 1 89 89 TYR N N 15 126.679 0.085 . 1 . . . . . 89 TYR N . 27439 1
866 . 1 1 90 90 GLU C C 13 175.178 0.000 . 1 . . . . . 90 GLU C . 27439 1
867 . 1 1 90 90 GLU CA C 13 54.657 0.069 . 1 . . . . . 90 GLU CA . 27439 1
868 . 1 1 90 90 GLU CB C 13 32.856 0.143 . 1 . . . . . 90 GLU CB . 27439 1
869 . 1 1 90 90 GLU CG C 13 36.688 0.000 . 1 . . . . . 90 GLU CG . 27439 1
870 . 1 1 90 90 GLU H H 1 8.755 0.011 . 1 . . . . . 90 GLU H . 27439 1
871 . 1 1 90 90 GLU HA H 1 5.326 0.009 . 1 . . . . . 90 GLU HA . 27439 1
872 . 1 1 90 90 GLU HB2 H 1 1.919 0.032 . 2 . . . . . 90 GLU HB2 . 27439 1
873 . 1 1 90 90 GLU HB3 H 1 1.955 0.012 . 2 . . . . . 90 GLU HB3 . 27439 1
874 . 1 1 90 90 GLU HG2 H 1 1.751 0.015 . 1 . . . . . 90 GLU HG2 . 27439 1
875 . 1 1 90 90 GLU HG3 H 1 1.752 0.011 . 1 . . . . . 90 GLU HG3 . 27439 1
876 . 1 1 90 90 GLU N N 15 121.544 0.093 . 1 . . . . . 90 GLU N . 27439 1
877 . 1 1 91 91 LEU C C 13 174.382 0.000 . 1 . . . . . 91 LEU C . 27439 1
878 . 1 1 91 91 LEU CA C 13 53.412 0.031 . 1 . . . . . 91 LEU CA . 27439 1
879 . 1 1 91 91 LEU CB C 13 43.666 0.057 . 1 . . . . . 91 LEU CB . 27439 1
880 . 1 1 91 91 LEU CG C 13 25.907 0.000 . 1 . . . . . 91 LEU CG . 27439 1
881 . 1 1 91 91 LEU H H 1 9.688 0.019 . 1 . . . . . 91 LEU H . 27439 1
882 . 1 1 91 91 LEU HA H 1 5.483 0.012 . 1 . . . . . 91 LEU HA . 27439 1
883 . 1 1 91 91 LEU HB2 H 1 1.167 0.009 . 2 . . . . . 91 LEU HB2 . 27439 1
884 . 1 1 91 91 LEU HB3 H 1 1.962 0.013 . 2 . . . . . 91 LEU HB3 . 27439 1
885 . 1 1 91 91 LEU N N 15 129.772 0.101 . 1 . . . . . 91 LEU N . 27439 1
886 . 1 1 92 92 SER C C 13 173.231 0.000 . 1 . . . . . 92 SER C . 27439 1
887 . 1 1 92 92 SER CA C 13 54.945 0.090 . 1 . . . . . 92 SER CA . 27439 1
888 . 1 1 92 92 SER CB C 13 64.523 0.061 . 1 . . . . . 92 SER CB . 27439 1
889 . 1 1 92 92 SER H H 1 9.072 0.017 . 1 . . . . . 92 SER H . 27439 1
890 . 1 1 92 92 SER HA H 1 5.328 0.008 . 1 . . . . . 92 SER HA . 27439 1
891 . 1 1 92 92 SER HB2 H 1 3.614 0.007 . 2 . . . . . 92 SER HB2 . 27439 1
892 . 1 1 92 92 SER HB3 H 1 3.617 0.012 . 2 . . . . . 92 SER HB3 . 27439 1
893 . 1 1 92 92 SER N N 15 115.602 0.082 . 1 . . . . . 92 SER N . 27439 1
894 . 1 1 93 93 ALA CA C 13 51.802 0.145 . 1 . . . . . 93 ALA CA . 27439 1
895 . 1 1 93 93 ALA CB C 13 21.177 0.044 . 1 . . . . . 93 ALA CB . 27439 1
896 . 1 1 93 93 ALA H H 1 8.598 0.014 . 1 . . . . . 93 ALA H . 27439 1
897 . 1 1 93 93 ALA HA H 1 4.605 0.011 . 1 . . . . . 93 ALA HA . 27439 1
898 . 1 1 93 93 ALA HB1 H 1 1.416 0.011 . 1 . . . . . 93 ALA HB1 . 27439 1
899 . 1 1 93 93 ALA HB2 H 1 1.416 0.011 . 1 . . . . . 93 ALA HB2 . 27439 1
900 . 1 1 93 93 ALA HB3 H 1 1.416 0.011 . 1 . . . . . 93 ALA HB3 . 27439 1
901 . 1 1 93 93 ALA N N 15 126.780 0.091 . 1 . . . . . 93 ALA N . 27439 1
902 . 1 1 94 94 ARG C C 13 175.895 0.000 . 1 . . . . . 94 ARG C . 27439 1
903 . 1 1 94 94 ARG CA C 13 54.706 0.072 . 1 . . . . . 94 ARG CA . 27439 1
904 . 1 1 94 94 ARG CB C 13 33.156 0.139 . 1 . . . . . 94 ARG CB . 27439 1
905 . 1 1 94 94 ARG CD C 13 43.164 0.000 . 1 . . . . . 94 ARG CD . 27439 1
906 . 1 1 94 94 ARG CG C 13 27.341 0.000 . 1 . . . . . 94 ARG CG . 27439 1
907 . 1 1 94 94 ARG H H 1 8.174 0.011 . 1 . . . . . 94 ARG H . 27439 1
908 . 1 1 94 94 ARG HA H 1 4.778 0.012 . 1 . . . . . 94 ARG HA . 27439 1
909 . 1 1 94 94 ARG HB2 H 1 2.315 0.010 . 2 . . . . . 94 ARG HB2 . 27439 1
910 . 1 1 94 94 ARG HB3 H 1 2.203 0.006 . 2 . . . . . 94 ARG HB3 . 27439 1
911 . 1 1 94 94 ARG N N 15 123.830 0.071 . 1 . . . . . 94 ARG N . 27439 1
912 . 1 1 95 95 MET C C 13 176.880 0.000 . 1 . . . . . 95 MET C . 27439 1
913 . 1 1 95 95 MET CA C 13 57.244 0.067 . 1 . . . . . 95 MET CA . 27439 1
914 . 1 1 95 95 MET CB C 13 30.279 0.121 . 1 . . . . . 95 MET CB . 27439 1
915 . 1 1 95 95 MET CG C 13 31.819 0.000 . 1 . . . . . 95 MET CG . 27439 1
916 . 1 1 95 95 MET H H 1 9.363 0.011 . 1 . . . . . 95 MET H . 27439 1
917 . 1 1 95 95 MET HA H 1 4.090 0.006 . 1 . . . . . 95 MET HA . 27439 1
918 . 1 1 95 95 MET HB2 H 1 1.974 0.006 . 2 . . . . . 95 MET HB2 . 27439 1
919 . 1 1 95 95 MET HB3 H 1 2.130 0.013 . 2 . . . . . 95 MET HB3 . 27439 1
920 . 1 1 95 95 MET HG2 H 1 2.633 0.006 . 2 . . . . . 95 MET HG2 . 27439 1
921 . 1 1 95 95 MET HG3 H 1 2.677 0.013 . 2 . . . . . 95 MET HG3 . 27439 1
922 . 1 1 95 95 MET N N 15 118.344 0.061 . 1 . . . . . 95 MET N . 27439 1
923 . 1 1 96 96 ASP C C 13 176.575 0.000 . 1 . . . . . 96 ASP C . 27439 1
924 . 1 1 96 96 ASP CA C 13 54.668 0.037 . 1 . . . . . 96 ASP CA . 27439 1
925 . 1 1 96 96 ASP CB C 13 39.864 0.051 . 1 . . . . . 96 ASP CB . 27439 1
926 . 1 1 96 96 ASP H H 1 9.536 0.013 . 1 . . . . . 96 ASP H . 27439 1
927 . 1 1 96 96 ASP HA H 1 4.754 0.033 . 1 . . . . . 96 ASP HA . 27439 1
928 . 1 1 96 96 ASP HB2 H 1 2.642 0.009 . 2 . . . . . 96 ASP HB2 . 27439 1
929 . 1 1 96 96 ASP HB3 H 1 2.756 0.009 . 2 . . . . . 96 ASP HB3 . 27439 1
930 . 1 1 96 96 ASP N N 15 111.181 0.070 . 1 . . . . . 96 ASP N . 27439 1
931 . 1 1 97 97 ALA C C 13 175.446 0.000 . 1 . . . . . 97 ALA C . 27439 1
932 . 1 1 97 97 ALA CA C 13 51.565 0.133 . 1 . . . . . 97 ALA CA . 27439 1
933 . 1 1 97 97 ALA CB C 13 20.747 0.064 . 1 . . . . . 97 ALA CB . 27439 1
934 . 1 1 97 97 ALA H H 1 7.487 0.017 . 1 . . . . . 97 ALA H . 27439 1
935 . 1 1 97 97 ALA HA H 1 4.010 0.033 . 1 . . . . . 97 ALA HA . 27439 1
936 . 1 1 97 97 ALA HB1 H 1 0.973 0.012 . 1 . . . . . 97 ALA HB1 . 27439 1
937 . 1 1 97 97 ALA HB2 H 1 0.973 0.012 . 1 . . . . . 97 ALA HB2 . 27439 1
938 . 1 1 97 97 ALA HB3 H 1 0.973 0.012 . 1 . . . . . 97 ALA HB3 . 27439 1
939 . 1 1 97 97 ALA N N 15 120.578 0.045 . 1 . . . . . 97 ALA N . 27439 1
940 . 1 1 98 98 ILE C C 13 175.315 0.000 . 1 . . . . . 98 ILE C . 27439 1
941 . 1 1 98 98 ILE CA C 13 58.184 0.053 . 1 . . . . . 98 ILE CA . 27439 1
942 . 1 1 98 98 ILE CB C 13 36.619 0.117 . 1 . . . . . 98 ILE CB . 27439 1
943 . 1 1 98 98 ILE CD1 C 13 9.449 0.144 . 1 . . . . . 98 ILE CD1 . 27439 1
944 . 1 1 98 98 ILE CG1 C 13 26.681 0.029 . 1 . . . . . 98 ILE CG1 . 27439 1
945 . 1 1 98 98 ILE CG2 C 13 17.787 0.071 . 1 . . . . . 98 ILE CG2 . 27439 1
946 . 1 1 98 98 ILE H H 1 7.578 0.014 . 1 . . . . . 98 ILE H . 27439 1
947 . 1 1 98 98 ILE HA H 1 4.598 0.014 . 1 . . . . . 98 ILE HA . 27439 1
948 . 1 1 98 98 ILE HB H 1 1.490 0.018 . 1 . . . . . 98 ILE HB . 27439 1
949 . 1 1 98 98 ILE HD11 H 1 -0.240 0.010 . 1 . . . . . 98 ILE HD11 . 27439 1
950 . 1 1 98 98 ILE HD12 H 1 -0.240 0.010 . 1 . . . . . 98 ILE HD12 . 27439 1
951 . 1 1 98 98 ILE HD13 H 1 -0.240 0.010 . 1 . . . . . 98 ILE HD13 . 27439 1
952 . 1 1 98 98 ILE HG12 H 1 0.680 0.021 . 2 . . . . . 98 ILE HG12 . 27439 1
953 . 1 1 98 98 ILE HG13 H 1 0.574 0.017 . 2 . . . . . 98 ILE HG13 . 27439 1
954 . 1 1 98 98 ILE HG21 H 1 0.557 0.012 . 1 . . . . . 98 ILE HG21 . 27439 1
955 . 1 1 98 98 ILE HG22 H 1 0.557 0.012 . 1 . . . . . 98 ILE HG22 . 27439 1
956 . 1 1 98 98 ILE HG23 H 1 0.557 0.012 . 1 . . . . . 98 ILE HG23 . 27439 1
957 . 1 1 98 98 ILE N N 15 116.429 0.072 . 1 . . . . . 98 ILE N . 27439 1
958 . 1 1 99 99 TYR C C 13 174.694 0.000 . 1 . . . . . 99 TYR C . 27439 1
959 . 1 1 99 99 TYR CA C 13 56.990 0.085 . 1 . . . . . 99 TYR CA . 27439 1
960 . 1 1 99 99 TYR CB C 13 40.241 0.042 . 1 . . . . . 99 TYR CB . 27439 1
961 . 1 1 99 99 TYR H H 1 9.512 0.015 . 1 . . . . . 99 TYR H . 27439 1
962 . 1 1 99 99 TYR HA H 1 4.935 0.012 . 1 . . . . . 99 TYR HA . 27439 1
963 . 1 1 99 99 TYR HB2 H 1 3.066 0.022 . 2 . . . . . 99 TYR HB2 . 27439 1
964 . 1 1 99 99 TYR HB3 H 1 2.418 0.012 . 2 . . . . . 99 TYR HB3 . 27439 1
965 . 1 1 99 99 TYR N N 15 129.319 0.074 . 1 . . . . . 99 TYR N . 27439 1
966 . 1 1 100 100 PHE C C 13 174.091 0.000 . 1 . . . . . 100 PHE C . 27439 1
967 . 1 1 100 100 PHE CA C 13 55.268 0.056 . 1 . . . . . 100 PHE CA . 27439 1
968 . 1 1 100 100 PHE CB C 13 44.700 0.118 . 1 . . . . . 100 PHE CB . 27439 1
969 . 1 1 100 100 PHE H H 1 9.334 0.014 . 1 . . . . . 100 PHE H . 27439 1
970 . 1 1 100 100 PHE HA H 1 5.806 0.014 . 1 . . . . . 100 PHE HA . 27439 1
971 . 1 1 100 100 PHE HB2 H 1 2.959 0.017 . 2 . . . . . 100 PHE HB2 . 27439 1
972 . 1 1 100 100 PHE HB3 H 1 2.960 0.017 . 2 . . . . . 100 PHE HB3 . 27439 1
973 . 1 1 100 100 PHE N N 15 122.573 0.082 . 1 . . . . . 100 PHE N . 27439 1
974 . 1 1 101 101 LYS C C 13 173.469 0.000 . 1 . . . . . 101 LYS C . 27439 1
975 . 1 1 101 101 LYS CA C 13 55.386 0.000 . 1 . . . . . 101 LYS CA . 27439 1
976 . 1 1 101 101 LYS CB C 13 37.550 0.094 . 1 . . . . . 101 LYS CB . 27439 1
977 . 1 1 101 101 LYS CD C 13 29.689 0.000 . 1 . . . . . 101 LYS CD . 27439 1
978 . 1 1 101 101 LYS CG C 13 24.654 0.000 . 1 . . . . . 101 LYS CG . 27439 1
979 . 1 1 101 101 LYS H H 1 8.872 0.016 . 1 . . . . . 101 LYS H . 27439 1
980 . 1 1 101 101 LYS HA H 1 4.495 0.016 . 1 . . . . . 101 LYS HA . 27439 1
981 . 1 1 101 101 LYS HB2 H 1 1.762 0.015 . 2 . . . . . 101 LYS HB2 . 27439 1
982 . 1 1 101 101 LYS HB3 H 1 1.529 0.009 . 2 . . . . . 101 LYS HB3 . 27439 1
983 . 1 1 101 101 LYS N N 15 130.268 0.060 . 1 . . . . . 101 LYS N . 27439 1
984 . 1 1 102 102 MET CA C 13 54.590 0.014 . 1 . . . . . 102 MET CA . 27439 1
985 . 1 1 102 102 MET CB C 13 34.060 0.000 . 1 . . . . . 102 MET CB . 27439 1
986 . 1 1 102 102 MET H H 1 8.323 0.015 . 1 . . . . . 102 MET H . 27439 1
987 . 1 1 102 102 MET HA H 1 4.728 0.014 . 1 . . . . . 102 MET HA . 27439 1
988 . 1 1 102 102 MET HB2 H 1 2.052 0.010 . 2 . . . . . 102 MET HB2 . 27439 1
989 . 1 1 102 102 MET HB3 H 1 1.806 0.013 . 2 . . . . . 102 MET HB3 . 27439 1
990 . 1 1 102 102 MET HG2 H 1 2.230 0.000 . 2 . . . . . 102 MET HG2 . 27439 1
991 . 1 1 102 102 MET HG3 H 1 2.373 0.008 . 2 . . . . . 102 MET HG3 . 27439 1
992 . 1 1 102 102 MET N N 15 123.413 0.086 . 1 . . . . . 102 MET N . 27439 1
993 . 1 1 103 103 ASP C C 13 175.085 0.000 . 1 . . . . . 103 ASP C . 27439 1
994 . 1 1 103 103 ASP CA C 13 54.626 0.109 . 1 . . . . . 103 ASP CA . 27439 1
995 . 1 1 103 103 ASP CB C 13 39.592 0.082 . 1 . . . . . 103 ASP CB . 27439 1
996 . 1 1 103 103 ASP H H 1 8.266 0.022 . 1 . . . . . 103 ASP H . 27439 1
997 . 1 1 103 103 ASP HA H 1 4.403 0.018 . 1 . . . . . 103 ASP HA . 27439 1
998 . 1 1 103 103 ASP HB2 H 1 2.961 0.012 . 2 . . . . . 103 ASP HB2 . 27439 1
999 . 1 1 103 103 ASP HB3 H 1 2.955 0.011 . 2 . . . . . 103 ASP HB3 . 27439 1
1000 . 1 1 103 103 ASP N N 15 122.596 0.096 . 1 . . . . . 103 ASP N . 27439 1
1001 . 1 1 104 104 GLU C C 13 173.456 0.000 . 1 . . . . . 104 GLU C . 27439 1
1002 . 1 1 104 104 GLU CA C 13 56.972 0.088 . 1 . . . . . 104 GLU CA . 27439 1
1003 . 1 1 104 104 GLU CB C 13 28.654 0.052 . 1 . . . . . 104 GLU CB . 27439 1
1004 . 1 1 104 104 GLU CG C 13 36.035 0.066 . 1 . . . . . 104 GLU CG . 27439 1
1005 . 1 1 104 104 GLU H H 1 8.743 0.013 . 1 . . . . . 104 GLU H . 27439 1
1006 . 1 1 104 104 GLU HA H 1 4.260 0.009 . 1 . . . . . 104 GLU HA . 27439 1
1007 . 1 1 104 104 GLU HB2 H 1 2.196 0.011 . 2 . . . . . 104 GLU HB2 . 27439 1
1008 . 1 1 104 104 GLU HB3 H 1 1.963 0.016 . 2 . . . . . 104 GLU HB3 . 27439 1
1009 . 1 1 104 104 GLU HG2 H 1 2.325 0.011 . 1 . . . . . 104 GLU HG2 . 27439 1
1010 . 1 1 104 104 GLU HG3 H 1 2.325 0.011 . 1 . . . . . 104 GLU HG3 . 27439 1
1011 . 1 1 104 104 GLU N N 15 117.734 0.087 . 1 . . . . . 104 GLU N . 27439 1
1012 . 1 1 105 105 ARG CA C 13 55.320 0.000 . 1 . . . . . 105 ARG CA . 27439 1
1013 . 1 1 105 105 ARG CB C 13 28.168 0.000 . 1 . . . . . 105 ARG CB . 27439 1
1014 . 1 1 105 105 ARG H H 1 8.182 0.010 . 1 . . . . . 105 ARG H . 27439 1
1015 . 1 1 105 105 ARG HA H 1 4.447 0.000 . 1 . . . . . 105 ARG HA . 27439 1
1016 . 1 1 105 105 ARG HB2 H 1 2.001 0.003 . 2 . . . . . 105 ARG HB2 . 27439 1
1017 . 1 1 105 105 ARG HB3 H 1 1.934 0.000 . 2 . . . . . 105 ARG HB3 . 27439 1
1018 . 1 1 105 105 ARG HD2 H 1 3.229 0.000 . 1 . . . . . 105 ARG HD2 . 27439 1
1019 . 1 1 105 105 ARG HD3 H 1 3.229 0.000 . 1 . . . . . 105 ARG HD3 . 27439 1
1020 . 1 1 105 105 ARG HG2 H 1 1.807 0.002 . 1 . . . . . 105 ARG HG2 . 27439 1
1021 . 1 1 105 105 ARG HG3 H 1 1.807 0.002 . 1 . . . . . 105 ARG HG3 . 27439 1
1022 . 1 1 105 105 ARG N N 15 122.139 0.078 . 1 . . . . . 105 ARG N . 27439 1
1023 . 1 1 107 107 PRO C C 13 176.141 0.000 . 1 . . . . . 107 PRO C . 27439 1
1024 . 1 1 107 107 PRO CA C 13 62.637 0.046 . 1 . . . . . 107 PRO CA . 27439 1
1025 . 1 1 107 107 PRO CB C 13 32.712 0.024 . 1 . . . . . 107 PRO CB . 27439 1
1026 . 1 1 107 107 PRO HA H 1 4.602 0.010 . 1 . . . . . 107 PRO HA . 27439 1
1027 . 1 1 107 107 PRO HB2 H 1 1.872 0.011 . 2 . . . . . 107 PRO HB2 . 27439 1
1028 . 1 1 107 107 PRO HB3 H 1 2.331 0.022 . 2 . . . . . 107 PRO HB3 . 27439 1
1029 . 1 1 108 108 GLN CA C 13 52.009 0.075 . 1 . . . . . 108 GLN CA . 27439 1
1030 . 1 1 108 108 GLN CB C 13 31.132 0.089 . 1 . . . . . 108 GLN CB . 27439 1
1031 . 1 1 108 108 GLN CG C 13 33.223 0.092 . 1 . . . . . 108 GLN CG . 27439 1
1032 . 1 1 108 108 GLN H H 1 8.649 0.011 . 1 . . . . . 108 GLN H . 27439 1
1033 . 1 1 108 108 GLN HA H 1 4.997 0.012 . 1 . . . . . 108 GLN HA . 27439 1
1034 . 1 1 108 108 GLN HB2 H 1 1.961 0.051 . 2 . . . . . 108 GLN HB2 . 27439 1
1035 . 1 1 108 108 GLN HB3 H 1 2.169 0.008 . 2 . . . . . 108 GLN HB3 . 27439 1
1036 . 1 1 108 108 GLN HG2 H 1 2.532 0.020 . 2 . . . . . 108 GLN HG2 . 27439 1
1037 . 1 1 108 108 GLN HG3 H 1 2.409 0.022 . 2 . . . . . 108 GLN HG3 . 27439 1
1038 . 1 1 108 108 GLN N N 15 120.522 0.084 . 1 . . . . . 108 GLN N . 27439 1
1039 . 1 1 109 109 PRO C C 13 173.466 0.000 . 1 . . . . . 109 PRO C . 27439 1
1040 . 1 1 109 109 PRO CA C 13 62.746 0.048 . 1 . . . . . 109 PRO CA . 27439 1
1041 . 1 1 109 109 PRO CB C 13 30.463 0.093 . 1 . . . . . 109 PRO CB . 27439 1
1042 . 1 1 109 109 PRO HA H 1 3.237 0.014 . 1 . . . . . 109 PRO HA . 27439 1
1043 . 1 1 109 109 PRO HB2 H 1 1.168 0.007 . 2 . . . . . 109 PRO HB2 . 27439 1
1044 . 1 1 109 109 PRO HB3 H 1 1.448 0.036 . 2 . . . . . 109 PRO HB3 . 27439 1
1045 . 1 1 110 110 LEU C C 13 175.487 0.000 . 1 . . . . . 110 LEU C . 27439 1
1046 . 1 1 110 110 LEU CA C 13 55.010 0.046 . 1 . . . . . 110 LEU CA . 27439 1
1047 . 1 1 110 110 LEU CB C 13 43.703 0.038 . 1 . . . . . 110 LEU CB . 27439 1
1048 . 1 1 110 110 LEU CG C 13 24.034 0.000 . 1 . . . . . 110 LEU CG . 27439 1
1049 . 1 1 110 110 LEU H H 1 8.911 0.013 . 1 . . . . . 110 LEU H . 27439 1
1050 . 1 1 110 110 LEU HA H 1 4.439 0.019 . 1 . . . . . 110 LEU HA . 27439 1
1051 . 1 1 110 110 LEU HB2 H 1 1.480 0.021 . 2 . . . . . 110 LEU HB2 . 27439 1
1052 . 1 1 110 110 LEU HB3 H 1 1.355 0.009 . 2 . . . . . 110 LEU HB3 . 27439 1
1053 . 1 1 110 110 LEU N N 15 125.987 0.056 . 1 . . . . . 110 LEU N . 27439 1
1054 . 1 1 111 111 ASN C C 13 173.572 0.000 . 1 . . . . . 111 ASN C . 27439 1
1055 . 1 1 111 111 ASN CA C 13 52.618 0.026 . 1 . . . . . 111 ASN CA . 27439 1
1056 . 1 1 111 111 ASN CB C 13 41.716 0.074 . 1 . . . . . 111 ASN CB . 27439 1
1057 . 1 1 111 111 ASN H H 1 6.881 0.015 . 1 . . . . . 111 ASN H . 27439 1
1058 . 1 1 111 111 ASN HA H 1 4.757 0.015 . 1 . . . . . 111 ASN HA . 27439 1
1059 . 1 1 111 111 ASN HB2 H 1 2.123 0.012 . 2 . . . . . 111 ASN HB2 . 27439 1
1060 . 1 1 111 111 ASN HB3 H 1 2.668 0.012 . 2 . . . . . 111 ASN HB3 . 27439 1
1061 . 1 1 111 111 ASN N N 15 113.779 0.062 . 1 . . . . . 111 ASN N . 27439 1
1062 . 1 1 112 112 LYS C C 13 176.106 0.000 . 1 . . . . . 112 LYS C . 27439 1
1063 . 1 1 112 112 LYS CA C 13 55.290 0.092 . 1 . . . . . 112 LYS CA . 27439 1
1064 . 1 1 112 112 LYS CB C 13 33.851 0.085 . 1 . . . . . 112 LYS CB . 27439 1
1065 . 1 1 112 112 LYS CG C 13 24.964 0.000 . 1 . . . . . 112 LYS CG . 27439 1
1066 . 1 1 112 112 LYS H H 1 8.253 0.016 . 1 . . . . . 112 LYS H . 27439 1
1067 . 1 1 112 112 LYS HA H 1 4.225 0.020 . 1 . . . . . 112 LYS HA . 27439 1
1068 . 1 1 112 112 LYS HB2 H 1 2.015 0.018 . 2 . . . . . 112 LYS HB2 . 27439 1
1069 . 1 1 112 112 LYS HB3 H 1 1.718 0.008 . 2 . . . . . 112 LYS HB3 . 27439 1
1070 . 1 1 112 112 LYS N N 15 120.615 0.093 . 1 . . . . . 112 LYS N . 27439 1
1071 . 1 1 113 113 TRP C C 13 176.015 0.000 . 1 . . . . . 113 TRP C . 27439 1
1072 . 1 1 113 113 TRP CA C 13 57.106 0.082 . 1 . . . . . 113 TRP CA . 27439 1
1073 . 1 1 113 113 TRP CB C 13 30.466 0.089 . 1 . . . . . 113 TRP CB . 27439 1
1074 . 1 1 113 113 TRP H H 1 7.200 0.021 . 1 . . . . . 113 TRP H . 27439 1
1075 . 1 1 113 113 TRP HA H 1 4.207 0.023 . 1 . . . . . 113 TRP HA . 27439 1
1076 . 1 1 113 113 TRP HB2 H 1 2.985 0.023 . 2 . . . . . 113 TRP HB2 . 27439 1
1077 . 1 1 113 113 TRP HB3 H 1 3.264 0.014 . 2 . . . . . 113 TRP HB3 . 27439 1
1078 . 1 1 113 113 TRP HE1 H 1 10.372 0.012 . 1 . . . . . 113 TRP HE1 . 27439 1
1079 . 1 1 113 113 TRP N N 15 120.100 2.835 . 1 . . . . . 113 TRP N . 27439 1
1080 . 1 1 114 114 ARG C C 13 173.480 0.000 . 1 . . . . . 114 ARG C . 27439 1
1081 . 1 1 114 114 ARG CA C 13 54.807 0.054 . 1 . . . . . 114 ARG CA . 27439 1
1082 . 1 1 114 114 ARG CB C 13 32.625 0.087 . 1 . . . . . 114 ARG CB . 27439 1
1083 . 1 1 114 114 ARG CD C 13 43.843 0.000 . 1 . . . . . 114 ARG CD . 27439 1
1084 . 1 1 114 114 ARG CG C 13 26.212 0.000 . 1 . . . . . 114 ARG CG . 27439 1
1085 . 1 1 114 114 ARG H H 1 9.218 0.010 . 1 . . . . . 114 ARG H . 27439 1
1086 . 1 1 114 114 ARG HA H 1 4.783 0.010 . 1 . . . . . 114 ARG HA . 27439 1
1087 . 1 1 114 114 ARG HB2 H 1 1.753 0.013 . 2 . . . . . 114 ARG HB2 . 27439 1
1088 . 1 1 114 114 ARG HB3 H 1 1.182 0.011 . 2 . . . . . 114 ARG HB3 . 27439 1
1089 . 1 1 114 114 ARG N N 15 123.509 0.034 . 1 . . . . . 114 ARG N . 27439 1
1090 . 1 1 115 115 SER CA C 13 59.677 0.065 . 1 . . . . . 115 SER CA . 27439 1
1091 . 1 1 115 115 SER CB C 13 65.930 0.057 . 1 . . . . . 115 SER CB . 27439 1
1092 . 1 1 115 115 SER H H 1 7.688 0.014 . 1 . . . . . 115 SER H . 27439 1
1093 . 1 1 115 115 SER HA H 1 4.775 0.022 . 1 . . . . . 115 SER HA . 27439 1
1094 . 1 1 115 115 SER HB2 H 1 3.655 0.017 . 2 . . . . . 115 SER HB2 . 27439 1
1095 . 1 1 115 115 SER HB3 H 1 3.681 0.035 . 2 . . . . . 115 SER HB3 . 27439 1
1096 . 1 1 115 115 SER N N 15 115.707 0.082 . 1 . . . . . 115 SER N . 27439 1
stop_
save_