Content for NMR-STAR saveframe, "chem_shift_list_1"
save_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 7083
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing
_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 1H15N_HSQC 2 $sample_2 isotropic 7083 1
2 HNCACB 3 $sample_3 isotropic 7083 1
3 CBCA(CO)NH 3 $sample_3 isotropic 7083 1
4 1H_2DNOESY 1 $sample_1 isotropic 7083 1
5 1H_2D_TOCSY 1 $sample_1 isotropic 7083 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $SPARKY . . 7083 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 HA H 1 4.070 0.01 . 1 . . . . . 1 ALA HA . 7083 1
2 . 1 1 1 1 ALA HB1 H 1 1.583 0.01 . 1 . . . . . 1 ALA HB . 7083 1
3 . 1 1 1 1 ALA HB2 H 1 1.583 0.01 . 1 . . . . . 1 ALA HB . 7083 1
4 . 1 1 1 1 ALA HB3 H 1 1.583 0.01 . 1 . . . . . 1 ALA HB . 7083 1
5 . 1 1 1 1 ALA C C 13 171.66 0.1 . 1 . . . . . 1 ALA C . 7083 1
6 . 1 1 1 1 ALA CA C 13 49.697 0.05 . 1 . . . . . 1 ALA CA . 7083 1
7 . 1 1 1 1 ALA CB C 13 17.760 0.05 . 1 . . . . . 1 ALA CB . 7083 1
8 . 1 1 2 2 SER H H 1 8.503 0.01 . 1 . . . . . 2 SER H . 7083 1
9 . 1 1 2 2 SER HA H 1 4.266 0.01 . 1 . . . . . 2 SER HA . 7083 1
10 . 1 1 2 2 SER HB2 H 1 3.645 0.01 . 1 . . . . . 2 SER HB2 . 7083 1
11 . 1 1 2 2 SER HB3 H 1 3.565 0.01 . 1 . . . . . 2 SER HB3 . 7083 1
12 . 1 1 2 2 SER C C 13 170.49 0.1 . 1 . . . . . 2 SER C . 7083 1
13 . 1 1 2 2 SER CA C 13 55.644 0.05 . 1 . . . . . 2 SER CA . 7083 1
14 . 1 1 2 2 SER CB C 13 61.547 0.05 . 1 . . . . . 2 SER CB . 7083 1
15 . 1 1 2 2 SER N N 15 117.01 0.1 . 1 . . . . . 2 SER N . 7083 1
16 . 1 1 3 3 ILE H H 1 7.763 0.01 . 1 . . . . . 3 ILE H . 7083 1
17 . 1 1 3 3 ILE HA H 1 2.859 0.01 . 1 . . . . . 3 ILE HA . 7083 1
18 . 1 1 3 3 ILE HB H 1 1.131 0.01 . 1 . . . . . 3 ILE HB . 7083 1
19 . 1 1 3 3 ILE HG12 H 1 0.507 0.01 . 1 . . . . . 3 ILE HG12 . 7083 1
20 . 1 1 3 3 ILE HG21 H 1 0.281 0.01 . 1 . . . . . 3 ILE HG2 . 7083 1
21 . 1 1 3 3 ILE HG22 H 1 0.281 0.01 . 1 . . . . . 3 ILE HG2 . 7083 1
22 . 1 1 3 3 ILE HG23 H 1 0.281 0.01 . 1 . . . . . 3 ILE HG2 . 7083 1
23 . 1 1 3 3 ILE HD11 H 1 0.897 0.01 . 1 . . . . . 3 ILE HD1 . 7083 1
24 . 1 1 3 3 ILE HD12 H 1 0.897 0.01 . 1 . . . . . 3 ILE HD1 . 7083 1
25 . 1 1 3 3 ILE HD13 H 1 0.897 0.01 . 1 . . . . . 3 ILE HD1 . 7083 1
26 . 1 1 3 3 ILE C C 13 171.61 0.1 . 1 . . . . . 3 ILE C . 7083 1
27 . 1 1 3 3 ILE CA C 13 56.582 0.05 . 1 . . . . . 3 ILE CA . 7083 1
28 . 1 1 3 3 ILE CB C 13 36.609 0.05 . 1 . . . . . 3 ILE CB . 7083 1
29 . 1 1 3 3 ILE N N 15 122.99 0.1 . 1 . . . . . 3 ILE N . 7083 1
30 . 1 1 4 4 PRO HA H 1 3.981 0.01 . 1 . . . . . 4 PRO HA . 7083 1
31 . 1 1 4 4 PRO HB2 H 1 1.922 0.01 . 1 . . . . . 4 PRO HB2 . 7083 1
32 . 1 1 4 4 PRO HB3 H 1 1.445 0.01 . 1 . . . . . 4 PRO HB3 . 7083 1
33 . 1 1 4 4 PRO HG2 H 1 1.135 0.01 . 1 . . . . . 4 PRO HG2 . 7083 1
34 . 1 1 4 4 PRO HG3 H 1 0.937 0.01 . 1 . . . . . 4 PRO HG3 . 7083 1
35 . 1 1 4 4 PRO HD3 H 1 2.485 0.01 . 1 . . . . . 4 PRO HD3 . 7083 1
36 . 1 1 4 4 PRO C C 13 172.42 0.1 . 1 . . . . . 4 PRO C . 7083 1
37 . 1 1 4 4 PRO CA C 13 59.894 0.05 . 1 . . . . . 4 PRO CA . 7083 1
38 . 1 1 4 4 PRO CB C 13 29.293 0.05 . 1 . . . . . 4 PRO CB . 7083 1
39 . 1 1 5 5 SER H H 1 7.778 0.01 . 1 . . . . . 5 SER H . 7083 1
40 . 1 1 5 5 SER HA H 1 4.216 0.01 . 1 . . . . . 5 SER HA . 7083 1
41 . 1 1 5 5 SER HB2 H 1 3.691 0.01 . 1 . . . . . 5 SER HB2 . 7083 1
42 . 1 1 5 5 SER HB3 H 1 3.626 0.01 . 1 . . . . . 5 SER HB3 . 7083 1
43 . 1 1 5 5 SER C C 13 173.35 0.1 . 1 . . . . . 5 SER C . 7083 1
44 . 1 1 5 5 SER CA C 13 56.949 0.05 . 1 . . . . . 5 SER CA . 7083 1
45 . 1 1 5 5 SER CB C 13 61.472 0.05 . 1 . . . . . 5 SER CB . 7083 1
46 . 1 1 5 5 SER N N 15 112.11 0.1 . 1 . . . . . 5 SER N . 7083 1
47 . 1 1 6 6 SER H H 1 8.077 0.01 . 1 . . . . . 6 SER H . 7083 1
48 . 1 1 6 6 SER HA H 1 4.405 0.01 . 1 . . . . . 6 SER HA . 7083 1
49 . 1 1 6 6 SER HB2 H 1 3.642 0.01 . 1 . . . . . 6 SER HB2 . 7083 1
50 . 1 1 6 6 SER HB3 H 1 3.576 0.01 . 1 . . . . . 6 SER HB3 . 7083 1
51 . 1 1 6 6 SER C C 13 172.22 0.1 . 1 . . . . . 6 SER C . 7083 1
52 . 1 1 6 6 SER CA C 13 56.853 0.05 . 1 . . . . . 6 SER CA . 7083 1
53 . 1 1 6 6 SER CB C 13 62.709 0.05 . 1 . . . . . 6 SER CB . 7083 1
54 . 1 1 6 6 SER N N 15 113.19 0.1 . 1 . . . . . 6 SER N . 7083 1
55 . 1 1 7 7 ALA H H 1 8.057 0.01 . 1 . . . . . 7 ALA H . 7083 1
56 . 1 1 7 7 ALA HA H 1 4.185 0.01 . 1 . . . . . 7 ALA HA . 7083 1
57 . 1 1 7 7 ALA HB1 H 1 1.316 0.01 . 1 . . . . . 7 ALA HB . 7083 1
58 . 1 1 7 7 ALA HB2 H 1 1.316 0.01 . 1 . . . . . 7 ALA HB . 7083 1
59 . 1 1 7 7 ALA HB3 H 1 1.316 0.01 . 1 . . . . . 7 ALA HB . 7083 1
60 . 1 1 7 7 ALA C C 13 176.46 0.1 . 1 . . . . . 7 ALA C . 7083 1
61 . 1 1 7 7 ALA CA C 13 50.672 0.05 . 1 . . . . . 7 ALA CA . 7083 1
62 . 1 1 7 7 ALA CB C 13 17.581 0.05 . 1 . . . . . 7 ALA CB . 7083 1
63 . 1 1 7 7 ALA N N 15 125.09 0.1 . 1 . . . . . 7 ALA N . 7083 1
64 . 1 1 8 8 SER H H 1 8.813 0.01 . 1 . . . . . 8 SER H . 7083 1
65 . 1 1 8 8 SER HA H 1 3.935 0.01 . 1 . . . . . 8 SER HA . 7083 1
66 . 1 1 8 8 SER HB2 H 1 3.156 0.01 . 1 . . . . . 8 SER HB2 . 7083 1
67 . 1 1 8 8 SER HB3 H 1 3.042 0.01 . 1 . . . . . 8 SER HB3 . 7083 1
68 . 1 1 8 8 SER C C 13 169.48 0.1 . 1 . . . . . 8 SER C . 7083 1
69 . 1 1 8 8 SER CA C 13 59.340 0.05 . 1 . . . . . 8 SER CA . 7083 1
70 . 1 1 8 8 SER CB C 13 61.016 0.05 . 1 . . . . . 8 SER CB . 7083 1
71 . 1 1 8 8 SER N N 15 118.18 0.1 . 1 . . . . . 8 SER N . 7083 1
72 . 1 1 9 9 VAL H H 1 7.215 0.01 . 1 . . . . . 9 VAL H . 7083 1
73 . 1 1 9 9 VAL HA H 1 4.898 0.01 . 1 . . . . . 9 VAL HA . 7083 1
74 . 1 1 9 9 VAL HB H 1 1.952 0.01 . 1 . . . . . 9 VAL HB . 7083 1
75 . 1 1 9 9 VAL HG11 H 1 0.620 0.01 . 1 . . . . . 9 VAL HG1 . 7083 1
76 . 1 1 9 9 VAL HG12 H 1 0.620 0.01 . 1 . . . . . 9 VAL HG1 . 7083 1
77 . 1 1 9 9 VAL HG13 H 1 0.620 0.01 . 1 . . . . . 9 VAL HG1 . 7083 1
78 . 1 1 9 9 VAL HG21 H 1 0.600 0.01 . 1 . . . . . 9 VAL HG2 . 7083 1
79 . 1 1 9 9 VAL HG22 H 1 0.600 0.01 . 1 . . . . . 9 VAL HG2 . 7083 1
80 . 1 1 9 9 VAL HG23 H 1 0.600 0.01 . 1 . . . . . 9 VAL HG2 . 7083 1
81 . 1 1 9 9 VAL C C 13 169.96 0.1 . 1 . . . . . 9 VAL C . 7083 1
82 . 1 1 9 9 VAL CA C 13 56.456 0.05 . 1 . . . . . 9 VAL CA . 7083 1
83 . 1 1 9 9 VAL CB C 13 31.357 0.05 . 1 . . . . . 9 VAL CB . 7083 1
84 . 1 1 9 9 VAL N N 15 114.95 0.1 . 1 . . . . . 9 VAL N . 7083 1
85 . 1 1 10 10 GLN H H 1 8.817 0.01 . 1 . . . . . 10 GLN H . 7083 1
86 . 1 1 10 10 GLN HA H 1 4.661 0.01 . 1 . . . . . 10 GLN HA . 7083 1
87 . 1 1 10 10 GLN HB2 H 1 1.520 0.01 . 1 . . . . . 10 GLN HB2 . 7083 1
88 . 1 1 10 10 GLN HB3 H 1 1.937 0.01 . 1 . . . . . 10 GLN HB3 . 7083 1
89 . 1 1 10 10 GLN HG2 H 1 2.488 0.01 . 1 . . . . . 10 GLN HG2 . 7083 1
90 . 1 1 10 10 GLN HG3 H 1 2.262 0.01 . 1 . . . . . 10 GLN HG3 . 7083 1
91 . 1 1 10 10 GLN HE21 H 1 7.269 0.01 . 1 . . . . . 10 GLN HE21 . 7083 1
92 . 1 1 10 10 GLN HE22 H 1 6.871 0.01 . 1 . . . . . 10 GLN HE22 . 7083 1
93 . 1 1 10 10 GLN C C 13 172.07 0.1 . 1 . . . . . 10 GLN C . 7083 1
94 . 1 1 10 10 GLN CA C 13 52.891 0.05 . 1 . . . . . 10 GLN CA . 7083 1
95 . 1 1 10 10 GLN CB C 13 31.480 0.05 . 1 . . . . . 10 GLN CB . 7083 1
96 . 1 1 10 10 GLN N N 15 125.61 0.1 . 1 . . . . . 10 GLN N . 7083 1
97 . 1 1 10 10 GLN NE2 N 15 110.91 0.1 . 1 . . . . . 10 GLN NE2 . 7083 1
98 . 1 1 11 11 LEU H H 1 9.634 0.01 . 1 . . . . . 11 LEU H . 7083 1
99 . 1 1 11 11 LEU HA H 1 3.795 0.01 . 1 . . . . . 11 LEU HA . 7083 1
100 . 1 1 11 11 LEU HB2 H 1 1.659 0.01 . 1 . . . . . 11 LEU HB2 . 7083 1
101 . 1 1 11 11 LEU HB3 H 1 1.097 0.01 . 1 . . . . . 11 LEU HB3 . 7083 1
102 . 1 1 11 11 LEU HG H 1 1.195 0.01 . 1 . . . . . 11 LEU HG . 7083 1
103 . 1 1 11 11 LEU HD11 H 1 0.814 0.01 . 1 . . . . . 11 LEU HD1 . 7083 1
104 . 1 1 11 11 LEU HD12 H 1 0.814 0.01 . 1 . . . . . 11 LEU HD1 . 7083 1
105 . 1 1 11 11 LEU HD13 H 1 0.814 0.01 . 1 . . . . . 11 LEU HD1 . 7083 1
106 . 1 1 11 11 LEU HD21 H 1 0.116 0.01 . 1 . . . . . 11 LEU HD2 . 7083 1
107 . 1 1 11 11 LEU HD22 H 1 0.116 0.01 . 1 . . . . . 11 LEU HD2 . 7083 1
108 . 1 1 11 11 LEU HD23 H 1 0.116 0.01 . 1 . . . . . 11 LEU HD2 . 7083 1
109 . 1 1 11 11 LEU C C 13 173.05 0.1 . 1 . . . . . 11 LEU C . 7083 1
110 . 1 1 11 11 LEU CA C 13 55.140 0.05 . 1 . . . . . 11 LEU CA . 7083 1
111 . 1 1 11 11 LEU CB C 13 40.647 0.05 . 1 . . . . . 11 LEU CB . 7083 1
112 . 1 1 11 11 LEU N N 15 130.62 0.1 . 1 . . . . . 11 LEU N . 7083 1
113 . 1 1 12 12 ASP H H 1 8.817 0.01 . 1 . . . . . 12 ASP H . 7083 1
114 . 1 1 12 12 ASP HA H 1 4.756 0.01 . 1 . . . . . 12 ASP HA . 7083 1
115 . 1 1 12 12 ASP HB2 H 1 2.186 0.01 . 1 . . . . . 12 ASP HB2 . 7083 1
116 . 1 1 12 12 ASP HB3 H 1 1.753 0.01 . 1 . . . . . 12 ASP HB3 . 7083 1
117 . 1 1 12 12 ASP C C 13 172.25 0.1 . 1 . . . . . 12 ASP C . 7083 1
118 . 1 1 12 12 ASP CA C 13 52.846 0.05 . 1 . . . . . 12 ASP CA . 7083 1
119 . 1 1 12 12 ASP CB C 13 39.149 0.05 . 1 . . . . . 12 ASP CB . 7083 1
120 . 1 1 12 12 ASP N N 15 125.80 0.1 . 1 . . . . . 12 ASP N . 7083 1
121 . 1 1 13 13 SER H H 1 7.447 0.01 . 1 . . . . . 13 SER H . 7083 1
122 . 1 1 13 13 SER HA H 1 4.493 0.01 . 1 . . . . . 13 SER HA . 7083 1
123 . 1 1 13 13 SER HB2 H 1 3.531 0.01 . 1 . . . . . 13 SER HB2 . 7083 1
124 . 1 1 13 13 SER HB3 H 1 3.556 0.01 . 1 . . . . . 13 SER HB3 . 7083 1
125 . 1 1 13 13 SER C C 13 169.30 0.1 . 1 . . . . . 13 SER C . 7083 1
126 . 1 1 13 13 SER CA C 13 54.373 0.05 . 1 . . . . . 13 SER CA . 7083 1
127 . 1 1 13 13 SER CB C 13 62.855 0.05 . 1 . . . . . 13 SER CB . 7083 1
128 . 1 1 13 13 SER N N 15 107.69 0.1 . 1 . . . . . 13 SER N . 7083 1
129 . 1 1 14 14 TYR H H 1 8.098 0.01 . 1 . . . . . 14 TYR H . 7083 1
130 . 1 1 14 14 TYR HA H 1 5.277 0.01 . 1 . . . . . 14 TYR HA . 7083 1
131 . 1 1 14 14 TYR HB2 H 1 2.982 0.01 . 1 . . . . . 14 TYR HB2 . 7083 1
132 . 1 1 14 14 TYR HB3 H 1 2.752 0.01 . 1 . . . . . 14 TYR HB3 . 7083 1
133 . 1 1 14 14 TYR HD1 H 1 6.878 0.01 . 1 . . . . . 14 TYR HD1 . 7083 1
134 . 1 1 14 14 TYR HD2 H 1 6.877 0.01 . 1 . . . . . 14 TYR HD2 . 7083 1
135 . 1 1 14 14 TYR HE1 H 1 6.811 0.01 . 1 . . . . . 14 TYR HE1 . 7083 1
136 . 1 1 14 14 TYR HE2 H 1 6.811 0.01 . 1 . . . . . 14 TYR HE2 . 7083 1
137 . 1 1 14 14 TYR C C 13 170.51 0.1 . 1 . . . . . 14 TYR C . 7083 1
138 . 1 1 14 14 TYR CA C 13 54.078 0.05 . 1 . . . . . 14 TYR CA . 7083 1
139 . 1 1 14 14 TYR CB C 13 39.324 0.05 . 1 . . . . . 14 TYR CB . 7083 1
140 . 1 1 14 14 TYR N N 15 114.89 0.1 . 1 . . . . . 14 TYR N . 7083 1
141 . 1 1 15 15 ASN H H 1 9.321 0.01 . 1 . . . . . 15 ASN H . 7083 1
142 . 1 1 15 15 ASN HA H 1 4.578 0.01 . 1 . . . . . 15 ASN HA . 7083 1
143 . 1 1 15 15 ASN HB2 H 1 2.333 0.01 . 1 . . . . . 15 ASN HB2 . 7083 1
144 . 1 1 15 15 ASN HB3 H 1 2.224 0.01 . 1 . . . . . 15 ASN HB3 . 7083 1
145 . 1 1 15 15 ASN HD21 H 1 7.324 0.01 . 1 . . . . . 15 ASN HD21 . 7083 1
146 . 1 1 15 15 ASN HD22 H 1 6.633 0.01 . 1 . . . . . 15 ASN HD22 . 7083 1
147 . 1 1 15 15 ASN C C 13 170.89 0.1 . 1 . . . . . 15 ASN C . 7083 1
148 . 1 1 15 15 ASN CA C 13 50.781 0.05 . 1 . . . . . 15 ASN CA . 7083 1
149 . 1 1 15 15 ASN CB C 13 41.211 0.05 . 1 . . . . . 15 ASN CB . 7083 1
150 . 1 1 15 15 ASN N N 15 118.01 0.1 . 1 . . . . . 15 ASN N . 7083 1
151 . 1 1 15 15 ASN ND2 N 15 113.18 0.1 . 1 . . . . . 15 ASN ND2 . 7083 1
152 . 1 1 16 16 TYR H H 1 8.686 0.01 . 1 . . . . . 16 TYR H . 7083 1
153 . 1 1 16 16 TYR HA H 1 5.573 0.01 . 1 . . . . . 16 TYR HA . 7083 1
154 . 1 1 16 16 TYR HB2 H 1 2.961 0.01 . 1 . . . . . 16 TYR HB2 . 7083 1
155 . 1 1 16 16 TYR HB3 H 1 2.854 0.01 . 1 . . . . . 16 TYR HB3 . 7083 1
156 . 1 1 16 16 TYR HD1 H 1 6.913 0.01 . 1 . . . . . 16 TYR HD1 . 7083 1
157 . 1 1 16 16 TYR HE1 H 1 6.562 0.01 . 1 . . . . . 16 TYR HE1 . 7083 1
158 . 1 1 16 16 TYR C C 13 172.06 0.1 . 1 . . . . . 16 TYR C . 7083 1
159 . 1 1 16 16 TYR CA C 13 54.665 0.05 . 1 . . . . . 16 TYR CA . 7083 1
160 . 1 1 16 16 TYR CB C 13 38.974 0.05 . 1 . . . . . 16 TYR CB . 7083 1
161 . 1 1 16 16 TYR N N 15 122.01 0.1 . 1 . . . . . 16 TYR N . 7083 1
162 . 1 1 17 17 ASP H H 1 7.304 0.01 . 1 . . . . . 17 ASP H . 7083 1
163 . 1 1 17 17 ASP HA H 1 4.535 0.01 . 1 . . . . . 17 ASP HA . 7083 1
164 . 1 1 17 17 ASP HB2 H 1 2.918 0.01 . 1 . . . . . 17 ASP HB2 . 7083 1
165 . 1 1 17 17 ASP HB3 H 1 2.267 0.01 . 1 . . . . . 17 ASP HB3 . 7083 1
166 . 1 1 17 17 ASP C C 13 174.38 0.1 . 1 . . . . . 17 ASP C . 7083 1
167 . 1 1 17 17 ASP CA C 13 50.026 0.05 . 1 . . . . . 17 ASP CA . 7083 1
168 . 1 1 17 17 ASP CB C 13 39.241 0.05 . 1 . . . . . 17 ASP CB . 7083 1
169 . 1 1 17 17 ASP N N 15 125.92 0.1 . 1 . . . . . 17 ASP N . 7083 1
170 . 1 1 18 18 GLY H H 1 7.266 0.01 . 9 . . . . . 18 GLY H . 7083 1
171 . 1 1 18 18 GLY HA2 H 1 4.077 0.01 . 9 . . . . . 18 GLY HA2 . 7083 1
172 . 1 1 18 18 GLY HA3 H 1 2.878 0.01 . 9 . . . . . 18 GLY HA3 . 7083 1
173 . 1 1 18 18 GLY C C 13 170.76 0.1 . 9 . . . . . 18 GLY C . 7083 1
174 . 1 1 18 18 GLY CA C 13 43.160 0.05 . 9 . . . . . 18 GLY CA . 7083 1
175 . 1 1 18 18 GLY N N 15 102.20 0.1 . 9 . . . . . 18 GLY N . 7083 1
176 . 1 1 19 19 SER H H 1 7.965 0.01 . 1 . . . . . 19 SER H . 7083 1
177 . 1 1 19 19 SER HA H 1 4.483 0.01 . 1 . . . . . 19 SER HA . 7083 1
178 . 1 1 19 19 SER HB2 H 1 3.569 0.01 . 1 . . . . . 19 SER HB2 . 7083 1
179 . 1 1 19 19 SER HB3 H 1 3.531 0.01 . 1 . . . . . 19 SER HB3 . 7083 1
180 . 1 1 19 19 SER C C 13 171.07 0.1 . 1 . . . . . 19 SER C . 7083 1
181 . 1 1 19 19 SER CA C 13 57.985 0.05 . 1 . . . . . 19 SER CA . 7083 1
182 . 1 1 19 19 SER CB C 13 62.799 0.05 . 1 . . . . . 19 SER CB . 7083 1
183 . 1 1 19 19 SER N N 15 114.32 0.1 . 1 . . . . . 19 SER N . 7083 1
184 . 1 1 20 20 THR H H 1 9.700 0.01 . 1 . . . . . 20 THR H . 7083 1
185 . 1 1 20 20 THR HA H 1 4.688 0.01 . 1 . . . . . 20 THR HA . 7083 1
186 . 1 1 20 20 THR HB H 1 3.706 0.01 . 1 . . . . . 20 THR HB . 7083 1
187 . 1 1 20 20 THR HG21 H 1 0.816 0.01 . 1 . . . . . 20 THR HG2 . 7083 1
188 . 1 1 20 20 THR HG22 H 1 0.816 0.01 . 1 . . . . . 20 THR HG2 . 7083 1
189 . 1 1 20 20 THR HG23 H 1 0.816 0.01 . 1 . . . . . 20 THR HG2 . 7083 1
190 . 1 1 20 20 THR C C 13 171.34 0.1 . 1 . . . . . 20 THR C . 7083 1
191 . 1 1 20 20 THR CA C 13 60.593 0.05 . 1 . . . . . 20 THR CA . 7083 1
192 . 1 1 20 20 THR CB C 13 67.118 0.05 . 1 . . . . . 20 THR CB . 7083 1
193 . 1 1 20 20 THR N N 15 121.00 0.1 . 1 . . . . . 20 THR N . 7083 1
194 . 1 1 21 21 PHE H H 1 9.280 0.01 . 1 . . . . . 21 PHE H . 7083 1
195 . 1 1 21 21 PHE HA H 1 5.764 0.01 . 1 . . . . . 21 PHE HA . 7083 1
196 . 1 1 21 21 PHE HB2 H 1 2.724 0.01 . 1 . . . . . 21 PHE HB2 . 7083 1
197 . 1 1 21 21 PHE HB3 H 1 2.703 0.01 . 1 . . . . . 21 PHE HB3 . 7083 1
198 . 1 1 21 21 PHE HD1 H 1 6.652 0.01 . 1 . . . . . 21 PHE HD1 . 7083 1
199 . 1 1 21 21 PHE HE1 H 1 6.041 0.01 . 1 . . . . . 21 PHE HE1 . 7083 1
200 . 1 1 21 21 PHE C C 13 170.09 0.1 . 1 . . . . . 21 PHE C . 7083 1
201 . 1 1 21 21 PHE CA C 13 51.343 0.05 . 1 . . . . . 21 PHE CA . 7083 1
202 . 1 1 21 21 PHE CB C 13 39.678 0.05 . 1 . . . . . 21 PHE CB . 7083 1
203 . 1 1 21 21 PHE N N 15 132.31 0.1 . 1 . . . . . 21 PHE N . 7083 1
204 . 1 1 22 22 SER H H 1 8.838 0.01 . 1 . . . . . 22 SER H . 7083 1
205 . 1 1 22 22 SER HA H 1 4.379 0.01 . 1 . . . . . 22 SER HA . 7083 1
206 . 1 1 22 22 SER HB2 H 1 3.592 0.01 . 1 . . . . . 22 SER HB2 . 7083 1
207 . 1 1 22 22 SER HB3 H 1 3.420 0.01 . 1 . . . . . 22 SER HB3 . 7083 1
208 . 1 1 22 22 SER C C 13 169.49 0.1 . 1 . . . . . 22 SER C . 7083 1
209 . 1 1 22 22 SER CA C 13 53.974 0.05 . 1 . . . . . 22 SER CA . 7083 1
210 . 1 1 22 22 SER CB C 13 64.780 0.05 . 1 . . . . . 22 SER CB . 7083 1
211 . 1 1 22 22 SER N N 15 121.04 0.1 . 1 . . . . . 22 SER N . 7083 1
212 . 1 1 23 23 GLY H H 1 6.444 0.01 . 1 . . . . . 23 GLY H . 7083 1
213 . 1 1 23 23 GLY HA2 H 1 3.619 0.01 . 1 . . . . . 23 GLY HA2 . 7083 1
214 . 1 1 23 23 GLY HA3 H 1 3.420 0.01 . 1 . . . . . 23 GLY HA3 . 7083 1
215 . 1 1 23 23 GLY C C 13 169.13 0.1 . 1 . . . . . 23 GLY C . 7083 1
216 . 1 1 23 23 GLY CA C 13 44.996 0.05 . 1 . . . . . 23 GLY CA . 7083 1
217 . 1 1 23 23 GLY N N 15 102.72 0.1 . 1 . . . . . 23 GLY N . 7083 1
218 . 1 1 24 24 LYS H H 1 8.204 0.01 . 1 . . . . . 24 LYS H . 7083 1
219 . 1 1 24 24 LYS HA H 1 4.833 0.01 . 1 . . . . . 24 LYS HA . 7083 1
220 . 1 1 24 24 LYS HB2 H 1 1.272 0.01 . 1 . . . . . 24 LYS HB2 . 7083 1
221 . 1 1 24 24 LYS HG2 H 1 0.812 0.01 . 1 . . . . . 24 LYS HG2 . 7083 1
222 . 1 1 24 24 LYS C C 13 172.66 0.1 . 1 . . . . . 24 LYS C . 7083 1
223 . 1 1 24 24 LYS CA C 13 52.981 0.05 . 1 . . . . . 24 LYS CA . 7083 1
224 . 1 1 24 24 LYS CB C 13 34.252 0.05 . 1 . . . . . 24 LYS CB . 7083 1
225 . 1 1 24 24 LYS N N 15 117.20 0.1 . 1 . . . . . 24 LYS N . 7083 1
226 . 1 1 25 25 ILE H H 1 9.390 0.01 . 1 . . . . . 25 ILE H . 7083 1
227 . 1 1 25 25 ILE HA H 1 4.068 0.01 . 1 . . . . . 25 ILE HA . 7083 1
228 . 1 1 25 25 ILE HB H 1 1.457 0.01 . 1 . . . . . 25 ILE HB . 7083 1
229 . 1 1 25 25 ILE HG12 H 1 0.653 0.01 . 1 . . . . . 25 ILE HG12 . 7083 1
230 . 1 1 25 25 ILE HG21 H 1 0.572 0.01 . 1 . . . . . 25 ILE HG2 . 7083 1
231 . 1 1 25 25 ILE HG22 H 1 0.572 0.01 . 1 . . . . . 25 ILE HG2 . 7083 1
232 . 1 1 25 25 ILE HG23 H 1 0.572 0.01 . 1 . . . . . 25 ILE HG2 . 7083 1
233 . 1 1 25 25 ILE HD11 H 1 0.447 0.01 . 1 . . . . . 25 ILE HD1 . 7083 1
234 . 1 1 25 25 ILE HD12 H 1 0.447 0.01 . 1 . . . . . 25 ILE HD1 . 7083 1
235 . 1 1 25 25 ILE HD13 H 1 0.447 0.01 . 1 . . . . . 25 ILE HD1 . 7083 1
236 . 1 1 25 25 ILE C C 13 172.78 0.1 . 1 . . . . . 25 ILE C . 7083 1
237 . 1 1 25 25 ILE CA C 13 59.157 0.05 . 1 . . . . . 25 ILE CA . 7083 1
238 . 1 1 25 25 ILE CB C 13 41.379 0.05 . 1 . . . . . 25 ILE CB . 7083 1
239 . 1 1 25 25 ILE N N 15 123.79 0.1 . 1 . . . . . 25 ILE N . 7083 1
240 . 1 1 26 26 TYR H H 1 9.124 0.01 . 1 . . . . . 26 TYR H . 7083 1
241 . 1 1 26 26 TYR HA H 1 4.826 0.01 . 1 . . . . . 26 TYR HA . 7083 1
242 . 1 1 26 26 TYR HB2 H 1 2.930 0.01 . 1 . . . . . 26 TYR HB2 . 7083 1
243 . 1 1 26 26 TYR HB3 H 1 2.380 0.01 . 1 . . . . . 26 TYR HB3 . 7083 1
244 . 1 1 26 26 TYR HD1 H 1 6.494 0.01 . 1 . . . . . 26 TYR HD1 . 7083 1
245 . 1 1 26 26 TYR HE1 H 1 6.365 0.01 . 1 . . . . . 26 TYR HE1 . 7083 1
246 . 1 1 26 26 TYR C C 13 173.47 0.1 . 1 . . . . . 26 TYR C . 7083 1
247 . 1 1 26 26 TYR CA C 13 55.904 0.05 . 1 . . . . . 26 TYR CA . 7083 1
248 . 1 1 26 26 TYR CB C 13 37.457 0.05 . 1 . . . . . 26 TYR CB . 7083 1
249 . 1 1 26 26 TYR N N 15 124.20 0.1 . 1 . . . . . 26 TYR N . 7083 1
250 . 1 1 27 27 VAL H H 1 9.149 0.01 . 1 . . . . . 27 VAL H . 7083 1
251 . 1 1 27 27 VAL HA H 1 4.013 0.01 . 1 . . . . . 27 VAL HA . 7083 1
252 . 1 1 27 27 VAL HB H 1 1.464 0.01 . 1 . . . . . 27 VAL HB . 7083 1
253 . 1 1 27 27 VAL HG11 H 1 0.052 0.01 . 1 . . . . . 27 VAL HG1 . 7083 1
254 . 1 1 27 27 VAL HG12 H 1 0.052 0.01 . 1 . . . . . 27 VAL HG1 . 7083 1
255 . 1 1 27 27 VAL HG13 H 1 0.052 0.01 . 1 . . . . . 27 VAL HG1 . 7083 1
256 . 1 1 27 27 VAL HG21 H 1 -0.448 0.01 . 1 . . . . . 27 VAL HG2 . 7083 1
257 . 1 1 27 27 VAL HG22 H 1 -0.448 0.01 . 1 . . . . . 27 VAL HG2 . 7083 1
258 . 1 1 27 27 VAL HG23 H 1 -0.448 0.01 . 1 . . . . . 27 VAL HG2 . 7083 1
259 . 1 1 27 27 VAL C C 13 172.67 0.1 . 1 . . . . . 27 VAL C . 7083 1
260 . 1 1 27 27 VAL CA C 13 58.984 0.05 . 1 . . . . . 27 VAL CA . 7083 1
261 . 1 1 27 27 VAL CB C 13 33.195 0.05 . 1 . . . . . 27 VAL CB . 7083 1
262 . 1 1 27 27 VAL N N 15 122.90 0.1 . 1 . . . . . 27 VAL N . 7083 1
263 . 1 1 28 28 LYS H H 1 8.590 0.01 . 1 . . . . . 28 LYS H . 7083 1
264 . 1 1 28 28 LYS HA H 1 3.146 0.01 . 1 . . . . . 28 LYS HA . 7083 1
265 . 1 1 28 28 LYS HB2 H 1 1.430 0.01 . 1 . . . . . 28 LYS HB2 . 7083 1
266 . 1 1 28 28 LYS HG2 H 1 1.145 0.01 . 1 . . . . . 28 LYS HG2 . 7083 1
267 . 1 1 28 28 LYS HZ1 H 1 8.691 0.01 . 1 . . . . . 28 LYS HZ . 7083 1
268 . 1 1 28 28 LYS HZ2 H 1 8.691 0.01 . 1 . . . . . 28 LYS HZ . 7083 1
269 . 1 1 28 28 LYS HZ3 H 1 8.691 0.01 . 1 . . . . . 28 LYS HZ . 7083 1
270 . 1 1 28 28 LYS C C 13 174.93 0.1 . 1 . . . . . 28 LYS C . 7083 1
271 . 1 1 28 28 LYS CA C 13 54.984 0.05 . 1 . . . . . 28 LYS CA . 7083 1
272 . 1 1 28 28 LYS CB C 13 31.618 0.05 . 1 . . . . . 28 LYS CB . 7083 1
273 . 1 1 28 28 LYS N N 15 128.97 0.1 . 1 . . . . . 28 LYS N . 7083 1
274 . 1 1 28 28 LYS NZ N 15 117.51 0.1 . 1 . . . . . 28 LYS NZ . 7083 1
275 . 1 1 29 29 ASN H H 1 9.049 0.01 . 1 . . . . . 29 ASN H . 7083 1
276 . 1 1 29 29 ASN HA H 1 4.372 0.01 . 1 . . . . . 29 ASN HA . 7083 1
277 . 1 1 29 29 ASN HB2 H 1 2.781 0.01 . 1 . . . . . 29 ASN HB2 . 7083 1
278 . 1 1 29 29 ASN HB3 H 1 2.083 0.01 . 1 . . . . . 29 ASN HB3 . 7083 1
279 . 1 1 29 29 ASN HD21 H 1 7.517 0.01 . 1 . . . . . 29 ASN HD21 . 7083 1
280 . 1 1 29 29 ASN HD22 H 1 6.427 0.01 . 1 . . . . . 29 ASN HD22 . 7083 1
281 . 1 1 29 29 ASN C C 13 172.26 0.1 . 1 . . . . . 29 ASN C . 7083 1
282 . 1 1 29 29 ASN CA C 13 50.209 0.05 . 1 . . . . . 29 ASN CA . 7083 1
283 . 1 1 29 29 ASN CB C 13 33.468 0.05 . 1 . . . . . 29 ASN CB . 7083 1
284 . 1 1 29 29 ASN N N 15 128.03 0.1 . 1 . . . . . 29 ASN N . 7083 1
285 . 1 1 29 29 ASN ND2 N 15 110.93 0.1 . 1 . . . . . 29 ASN ND2 . 7083 1
286 . 1 1 30 30 ILE H H 1 7.444 0.01 . 1 . . . . . 30 ILE H . 7083 1
287 . 1 1 30 30 ILE HA H 1 3.507 0.01 . 1 . . . . . 30 ILE HA . 7083 1
288 . 1 1 30 30 ILE HB H 1 1.385 0.01 . 1 . . . . . 30 ILE HB . 7083 1
289 . 1 1 30 30 ILE HG12 H 1 1.080 0.01 . 1 . . . . . 30 ILE HG12 . 7083 1
290 . 1 1 30 30 ILE HG13 H 1 0.790 0.01 . 1 . . . . . 30 ILE HG13 . 7083 1
291 . 1 1 30 30 ILE HG21 H 1 0.672 0.01 . 1 . . . . . 30 ILE HG2 . 7083 1
292 . 1 1 30 30 ILE HG22 H 1 0.672 0.01 . 1 . . . . . 30 ILE HG2 . 7083 1
293 . 1 1 30 30 ILE HG23 H 1 0.672 0.01 . 1 . . . . . 30 ILE HG2 . 7083 1
294 . 1 1 30 30 ILE HD11 H 1 0.537 0.01 . 1 . . . . . 30 ILE HD1 . 7083 1
295 . 1 1 30 30 ILE HD12 H 1 0.537 0.01 . 1 . . . . . 30 ILE HD1 . 7083 1
296 . 1 1 30 30 ILE HD13 H 1 0.537 0.01 . 1 . . . . . 30 ILE HD1 . 7083 1
297 . 1 1 30 30 ILE C C 13 172.56 0.1 . 1 . . . . . 30 ILE C . 7083 1
298 . 1 1 30 30 ILE CA C 13 61.136 0.05 . 1 . . . . . 30 ILE CA . 7083 1
299 . 1 1 30 30 ILE CB C 13 37.950 0.05 . 1 . . . . . 30 ILE CB . 7083 1
300 . 1 1 30 30 ILE N N 15 124.97 0.1 . 1 . . . . . 30 ILE N . 7083 1
301 . 1 1 31 31 ALA H H 1 7.132 0.01 . 1 . . . . . 31 ALA H . 7083 1
302 . 1 1 31 31 ALA HA H 1 4.161 0.01 . 1 . . . . . 31 ALA HA . 7083 1
303 . 1 1 31 31 ALA HB1 H 1 1.170 0.01 . 1 . . . . . 31 ALA HB . 7083 1
304 . 1 1 31 31 ALA HB2 H 1 1.170 0.01 . 1 . . . . . 31 ALA HB . 7083 1
305 . 1 1 31 31 ALA HB3 H 1 1.170 0.01 . 1 . . . . . 31 ALA HB . 7083 1
306 . 1 1 31 31 ALA C C 13 173.41 0.1 . 1 . . . . . 31 ALA C . 7083 1
307 . 1 1 31 31 ALA CA C 13 48.645 0.05 . 1 . . . . . 31 ALA CA . 7083 1
308 . 1 1 31 31 ALA CB C 13 18.888 0.05 . 1 . . . . . 31 ALA CB . 7083 1
309 . 1 1 31 31 ALA N N 15 117.72 0.1 . 1 . . . . . 31 ALA N . 7083 1
310 . 1 1 32 32 TYR H H 1 8.059 0.01 . 1 . . . . . 32 TYR H . 7083 1
311 . 1 1 32 32 TYR HA H 1 4.146 0.01 . 1 . . . . . 32 TYR HA . 7083 1
312 . 1 1 32 32 TYR HB2 H 1 2.900 0.01 . 1 . . . . . 32 TYR HB2 . 7083 1
313 . 1 1 32 32 TYR HB3 H 1 2.776 0.01 . 1 . . . . . 32 TYR HB3 . 7083 1
314 . 1 1 32 32 TYR HD1 H 1 6.949 0.01 . 1 . . . . . 32 TYR HD1 . 7083 1
315 . 1 1 32 32 TYR HE1 H 1 6.594 0.01 . 1 . . . . . 32 TYR HE1 . 7083 1
316 . 1 1 32 32 TYR C C 13 174.71 0.1 . 1 . . . . . 32 TYR C . 7083 1
317 . 1 1 32 32 TYR CA C 13 58.918 0.05 . 1 . . . . . 32 TYR CA . 7083 1
318 . 1 1 32 32 TYR CB C 13 36.858 0.05 . 1 . . . . . 32 TYR CB . 7083 1
319 . 1 1 32 32 TYR N N 15 117.32 0.1 . 1 . . . . . 32 TYR N . 7083 1
320 . 1 1 33 33 SER H H 1 8.060 0.01 . 1 . . . . . 33 SER H . 7083 1
321 . 1 1 33 33 SER HA H 1 4.216 0.01 . 1 . . . . . 33 SER HA . 7083 1
322 . 1 1 33 33 SER HB2 H 1 3.748 0.01 . 1 . . . . . 33 SER HB2 . 7083 1
323 . 1 1 33 33 SER HB3 H 1 3.651 0.01 . 1 . . . . . 33 SER HB3 . 7083 1
324 . 1 1 33 33 SER C C 13 171.37 0.1 . 1 . . . . . 33 SER C . 7083 1
325 . 1 1 33 33 SER CA C 13 56.084 0.05 . 1 . . . . . 33 SER CA . 7083 1
326 . 1 1 33 33 SER CB C 13 60.133 0.05 . 1 . . . . . 33 SER CB . 7083 1
327 . 1 1 33 33 SER N N 15 114.01 0.1 . 1 . . . . . 33 SER N . 7083 1
328 . 1 1 34 34 LYS H H 1 8.075 0.01 . 1 . . . . . 34 LYS H . 7083 1
329 . 1 1 34 34 LYS HA H 1 4.661 0.01 . 1 . . . . . 34 LYS HA . 7083 1
330 . 1 1 34 34 LYS HB2 H 1 1.749 0.01 . 1 . . . . . 34 LYS HB2 . 7083 1
331 . 1 1 34 34 LYS HB3 H 1 1.777 0.01 . 1 . . . . . 34 LYS HB3 . 7083 1
332 . 1 1 34 34 LYS HG2 H 1 1.184 0.01 . 1 . . . . . 34 LYS HG2 . 7083 1
333 . 1 1 34 34 LYS HG3 H 1 1.153 0.01 . 1 . . . . . 34 LYS HG3 . 7083 1
334 . 1 1 34 34 LYS HD2 H 1 1.599 0.01 . 1 . . . . . 34 LYS HD2 . 7083 1
335 . 1 1 34 34 LYS HD3 H 1 1.460 0.01 . 1 . . . . . 34 LYS HD3 . 7083 1
336 . 1 1 34 34 LYS C C 13 173.39 0.1 . 1 . . . . . 34 LYS C . 7083 1
337 . 1 1 34 34 LYS CA C 13 53.520 0.05 . 1 . . . . . 34 LYS CA . 7083 1
338 . 1 1 34 34 LYS CB C 13 36.116 0.05 . 1 . . . . . 34 LYS CB . 7083 1
339 . 1 1 34 34 LYS N N 15 124.90 0.1 . 1 . . . . . 34 LYS N . 7083 1
340 . 1 1 35 35 LYS H H 1 8.067 0.01 . 1 . . . . . 35 LYS H . 7083 1
341 . 1 1 35 35 LYS HA H 1 4.366 0.01 . 1 . . . . . 35 LYS HA . 7083 1
342 . 1 1 35 35 LYS HB2 H 1 1.646 0.01 . 1 . . . . . 35 LYS HB2 . 7083 1
343 . 1 1 35 35 LYS HB3 H 1 1.566 0.01 . 1 . . . . . 35 LYS HB3 . 7083 1
344 . 1 1 35 35 LYS HG2 H 1 1.235 0.01 . 1 . . . . . 35 LYS HG2 . 7083 1
345 . 1 1 35 35 LYS HG3 H 1 1.209 0.01 . 1 . . . . . 35 LYS HG3 . 7083 1
346 . 1 1 35 35 LYS HD2 H 1 1.492 0.01 . 1 . . . . . 35 LYS HD2 . 7083 1
347 . 1 1 35 35 LYS HE2 H 1 2.744 0.01 . 1 . . . . . 35 LYS HE2 . 7083 1
348 . 1 1 35 35 LYS C C 13 172.85 0.1 . 1 . . . . . 35 LYS C . 7083 1
349 . 1 1 35 35 LYS CA C 13 54.439 0.05 . 1 . . . . . 35 LYS CA . 7083 1
350 . 1 1 35 35 LYS CB C 13 33.331 0.05 . 1 . . . . . 35 LYS CB . 7083 1
351 . 1 1 35 35 LYS N N 15 119.79 0.1 . 1 . . . . . 35 LYS N . 7083 1
352 . 1 1 36 36 VAL H H 1 8.754 0.01 . 1 . . . . . 36 VAL H . 7083 1
353 . 1 1 36 36 VAL HA H 1 4.598 0.01 . 1 . . . . . 36 VAL HA . 7083 1
354 . 1 1 36 36 VAL HB H 1 1.503 0.01 . 1 . . . . . 36 VAL HB . 7083 1
355 . 1 1 36 36 VAL HG11 H 1 0.220 0.01 . 1 . . . . . 36 VAL HG1 . 7083 1
356 . 1 1 36 36 VAL HG12 H 1 0.220 0.01 . 1 . . . . . 36 VAL HG1 . 7083 1
357 . 1 1 36 36 VAL HG13 H 1 0.220 0.01 . 1 . . . . . 36 VAL HG1 . 7083 1
358 . 1 1 36 36 VAL HG21 H 1 -0.644 0.01 . 1 . . . . . 36 VAL HG2 . 7083 1
359 . 1 1 36 36 VAL HG22 H 1 -0.644 0.01 . 1 . . . . . 36 VAL HG2 . 7083 1
360 . 1 1 36 36 VAL HG23 H 1 -0.644 0.01 . 1 . . . . . 36 VAL HG2 . 7083 1
361 . 1 1 36 36 VAL C C 13 171.53 0.1 . 1 . . . . . 36 VAL C . 7083 1
362 . 1 1 36 36 VAL CA C 13 59.312 0.05 . 1 . . . . . 36 VAL CA . 7083 1
363 . 1 1 36 36 VAL CB C 13 31.023 0.05 . 1 . . . . . 36 VAL CB . 7083 1
364 . 1 1 36 36 VAL N N 15 129.69 0.1 . 1 . . . . . 36 VAL N . 7083 1
365 . 1 1 37 37 THR H H 1 9.167 0.01 . 1 . . . . . 37 THR H . 7083 1
366 . 1 1 37 37 THR HA H 1 4.849 0.01 . 1 . . . . . 37 THR HA . 7083 1
367 . 1 1 37 37 THR HB H 1 3.649 0.01 . 1 . . . . . 37 THR HB . 7083 1
368 . 1 1 37 37 THR HG21 H 1 0.941 0.01 . 1 . . . . . 37 THR HG2 . 7083 1
369 . 1 1 37 37 THR HG22 H 1 0.941 0.01 . 1 . . . . . 37 THR HG2 . 7083 1
370 . 1 1 37 37 THR HG23 H 1 0.941 0.01 . 1 . . . . . 37 THR HG2 . 7083 1
371 . 1 1 37 37 THR C C 13 170.03 0.1 . 1 . . . . . 37 THR C . 7083 1
372 . 1 1 37 37 THR CA C 13 57.850 0.05 . 1 . . . . . 37 THR CA . 7083 1
373 . 1 1 37 37 THR CB C 13 70.185 0.05 . 1 . . . . . 37 THR CB . 7083 1
374 . 1 1 37 37 THR N N 15 120.14 0.1 . 1 . . . . . 37 THR N . 7083 1
375 . 1 1 38 38 VAL H H 1 9.060 0.01 . 1 . . . . . 38 VAL H . 7083 1
376 . 1 1 38 38 VAL HA H 1 4.143 0.01 . 1 . . . . . 38 VAL HA . 7083 1
377 . 1 1 38 38 VAL HB H 1 1.353 0.01 . 1 . . . . . 38 VAL HB . 7083 1
378 . 1 1 38 38 VAL HG11 H 1 0.253 0.01 . 1 . . . . . 38 VAL HG1 . 7083 1
379 . 1 1 38 38 VAL HG12 H 1 0.253 0.01 . 1 . . . . . 38 VAL HG1 . 7083 1
380 . 1 1 38 38 VAL HG13 H 1 0.253 0.01 . 1 . . . . . 38 VAL HG1 . 7083 1
381 . 1 1 38 38 VAL HG21 H 1 -0.583 0.01 . 1 . . . . . 38 VAL HG2 . 7083 1
382 . 1 1 38 38 VAL HG22 H 1 -0.583 0.01 . 1 . . . . . 38 VAL HG2 . 7083 1
383 . 1 1 38 38 VAL HG23 H 1 -0.583 0.01 . 1 . . . . . 38 VAL HG2 . 7083 1
384 . 1 1 38 38 VAL C C 13 171.63 0.1 . 1 . . . . . 38 VAL C . 7083 1
385 . 1 1 38 38 VAL CA C 13 59.502 0.05 . 1 . . . . . 38 VAL CA . 7083 1
386 . 1 1 38 38 VAL CB C 13 30.034 0.05 . 1 . . . . . 38 VAL CB . 7083 1
387 . 1 1 38 38 VAL N N 15 124.88 0.1 . 1 . . . . . 38 VAL N . 7083 1
388 . 1 1 39 39 VAL H H 1 8.358 0.01 . 1 . . . . . 39 VAL H . 7083 1
389 . 1 1 39 39 VAL HA H 1 4.567 0.01 . 1 . . . . . 39 VAL HA . 7083 1
390 . 1 1 39 39 VAL HB H 1 0.739 0.01 . 1 . . . . . 39 VAL HB . 7083 1
391 . 1 1 39 39 VAL HG11 H 1 0.458 0.01 . 1 . . . . . 39 VAL HG1 . 7083 1
392 . 1 1 39 39 VAL HG12 H 1 0.458 0.01 . 1 . . . . . 39 VAL HG1 . 7083 1
393 . 1 1 39 39 VAL HG13 H 1 0.458 0.01 . 1 . . . . . 39 VAL HG1 . 7083 1
394 . 1 1 39 39 VAL HG21 H 1 0.413 0.01 . 1 . . . . . 39 VAL HG2 . 7083 1
395 . 1 1 39 39 VAL HG22 H 1 0.413 0.01 . 1 . . . . . 39 VAL HG2 . 7083 1
396 . 1 1 39 39 VAL HG23 H 1 0.413 0.01 . 1 . . . . . 39 VAL HG2 . 7083 1
397 . 1 1 39 39 VAL C C 13 173.59 0.1 . 1 . . . . . 39 VAL C . 7083 1
398 . 1 1 39 39 VAL CA C 13 58.921 0.05 . 1 . . . . . 39 VAL CA . 7083 1
399 . 1 1 39 39 VAL CB C 13 30.583 0.05 . 1 . . . . . 39 VAL CB . 7083 1
400 . 1 1 39 39 VAL N N 15 129.42 0.1 . 1 . . . . . 39 VAL N . 7083 1
401 . 1 1 40 40 TYR H H 1 8.500 0.01 . 1 . . . . . 40 TYR H . 7083 1
402 . 1 1 40 40 TYR HA H 1 5.466 0.01 . 1 . . . . . 40 TYR HA . 7083 1
403 . 1 1 40 40 TYR HB2 H 1 2.855 0.01 . 1 . . . . . 40 TYR HB2 . 7083 1
404 . 1 1 40 40 TYR HB3 H 1 2.141 0.01 . 1 . . . . . 40 TYR HB3 . 7083 1
405 . 1 1 40 40 TYR HD1 H 1 6.361 0.01 . 1 . . . . . 40 TYR HD1 . 7083 1
406 . 1 1 40 40 TYR HE1 H 1 6.258 0.01 . 1 . . . . . 40 TYR HE1 . 7083 1
407 . 1 1 40 40 TYR C C 13 170.44 0.1 . 1 . . . . . 40 TYR C . 7083 1
408 . 1 1 40 40 TYR CA C 13 53.178 0.05 . 1 . . . . . 40 TYR CA . 7083 1
409 . 1 1 40 40 TYR CB C 13 41.835 0.05 . 1 . . . . . 40 TYR CB . 7083 1
410 . 1 1 40 40 TYR N N 15 120.21 0.1 . 1 . . . . . 40 TYR N . 7083 1
411 . 1 1 41 41 ALA H H 1 8.026 0.01 . 1 . . . . . 41 ALA H . 7083 1
412 . 1 1 41 41 ALA HA H 1 3.733 0.01 . 1 . . . . . 41 ALA HA . 7083 1
413 . 1 1 41 41 ALA HB1 H 1 -0.562 0.01 . 1 . . . . . 41 ALA HB . 7083 1
414 . 1 1 41 41 ALA HB2 H 1 -0.562 0.01 . 1 . . . . . 41 ALA HB . 7083 1
415 . 1 1 41 41 ALA HB3 H 1 -0.562 0.01 . 1 . . . . . 41 ALA HB . 7083 1
416 . 1 1 41 41 ALA C C 13 175.58 0.1 . 1 . . . . . 41 ALA C . 7083 1
417 . 1 1 41 41 ALA CA C 13 46.335 0.05 . 1 . . . . . 41 ALA CA . 7083 1
418 . 1 1 41 41 ALA CB C 13 17.087 0.05 . 1 . . . . . 41 ALA CB . 7083 1
419 . 1 1 41 41 ALA N N 15 124.69 0.1 . 1 . . . . . 41 ALA N . 7083 1
420 . 1 1 42 42 ASP H H 1 7.436 0.01 . 1 . . . . . 42 ASP H . 7083 1
421 . 1 1 42 42 ASP HA H 1 4.375 0.01 . 1 . . . . . 42 ASP HA . 7083 1
422 . 1 1 42 42 ASP HB2 H 1 3.114 0.01 . 1 . . . . . 42 ASP HB2 . 7083 1
423 . 1 1 42 42 ASP HB3 H 1 2.332 0.01 . 1 . . . . . 42 ASP HB3 . 7083 1
424 . 1 1 42 42 ASP C C 13 174.40 0.1 . 1 . . . . . 42 ASP C . 7083 1
425 . 1 1 42 42 ASP CA C 13 50.853 0.05 . 1 . . . . . 42 ASP CA . 7083 1
426 . 1 1 42 42 ASP CB C 13 38.118 0.05 . 1 . . . . . 42 ASP CB . 7083 1
427 . 1 1 42 42 ASP N N 15 121.60 0.1 . 1 . . . . . 42 ASP N . 7083 1
428 . 1 1 43 43 GLY H H 1 8.067 0.01 . 1 . . . . . 43 GLY H . 7083 1
429 . 1 1 43 43 GLY HA2 H 1 3.609 0.01 . 1 . . . . . 43 GLY HA2 . 7083 1
430 . 1 1 43 43 GLY HA3 H 1 3.381 0.01 . 1 . . . . . 43 GLY HA3 . 7083 1
431 . 1 1 43 43 GLY C C 13 172.76 0.1 . 1 . . . . . 43 GLY C . 7083 1
432 . 1 1 43 43 GLY CA C 13 44.667 0.05 . 1 . . . . . 43 GLY CA . 7083 1
433 . 1 1 43 43 GLY N N 15 103.06 0.1 . 1 . . . . . 43 GLY N . 7083 1
434 . 1 1 44 44 SER H H 1 8.077 0.01 . 1 . . . . . 44 SER H . 7083 1
435 . 1 1 44 44 SER HA H 1 4.404 0.01 . 1 . . . . . 44 SER HA . 7083 1
436 . 1 1 44 44 SER HB2 H 1 3.771 0.01 . 1 . . . . . 44 SER HB2 . 7083 1
437 . 1 1 44 44 SER HB3 H 1 3.696 0.01 . 1 . . . . . 44 SER HB3 . 7083 1
438 . 1 1 44 44 SER C C 13 171.60 0.1 . 1 . . . . . 44 SER C . 7083 1
439 . 1 1 44 44 SER CA C 13 55.280 0.05 . 1 . . . . . 44 SER CA . 7083 1
440 . 1 1 44 44 SER CB C 13 61.225 0.05 . 1 . . . . . 44 SER CB . 7083 1
441 . 1 1 44 44 SER N N 15 116.43 0.1 . 1 . . . . . 44 SER N . 7083 1
442 . 1 1 45 45 ASP H H 1 8.468 0.01 . 1 . . . . . 45 ASP H . 7083 1
443 . 1 1 45 45 ASP HA H 1 3.803 0.01 . 1 . . . . . 45 ASP HA . 7083 1
444 . 1 1 45 45 ASP HB2 H 1 3.081 0.01 . 1 . . . . . 45 ASP HB2 . 7083 1
445 . 1 1 45 45 ASP HB3 H 1 2.096 0.01 . 1 . . . . . 45 ASP HB3 . 7083 1
446 . 1 1 45 45 ASP C C 13 170.38 0.1 . 1 . . . . . 45 ASP C . 7083 1
447 . 1 1 45 45 ASP CA C 13 51.762 0.05 . 1 . . . . . 45 ASP CA . 7083 1
448 . 1 1 45 45 ASP CB C 13 37.383 0.05 . 1 . . . . . 45 ASP CB . 7083 1
449 . 1 1 45 45 ASP N N 15 120.03 0.1 . 1 . . . . . 45 ASP N . 7083 1
450 . 1 1 46 46 ASN H H 1 7.663 0.01 . 1 . . . . . 46 ASN H . 7083 1
451 . 1 1 46 46 ASN HA H 1 4.622 0.01 . 1 . . . . . 46 ASN HA . 7083 1
452 . 1 1 46 46 ASN HB2 H 1 2.966 0.01 . 1 . . . . . 46 ASN HB2 . 7083 1
453 . 1 1 46 46 ASN HB3 H 1 2.374 0.01 . 1 . . . . . 46 ASN HB3 . 7083 1
454 . 1 1 46 46 ASN HD21 H 1 7.560 0.01 . 1 . . . . . 46 ASN HD21 . 7083 1
455 . 1 1 46 46 ASN HD22 H 1 6.762 0.01 . 1 . . . . . 46 ASN HD22 . 7083 1
456 . 1 1 46 46 ASN C C 13 174.56 0.1 . 1 . . . . . 46 ASN C . 7083 1
457 . 1 1 46 46 ASN CA C 13 49.880 0.05 . 1 . . . . . 46 ASN CA . 7083 1
458 . 1 1 46 46 ASN CB C 13 36.886 0.05 . 1 . . . . . 46 ASN CB . 7083 1
459 . 1 1 46 46 ASN N N 15 115.23 0.1 . 1 . . . . . 46 ASN N . 7083 1
460 . 1 1 46 46 ASN ND2 N 15 112.76 0.1 . 1 . . . . . 46 ASN ND2 . 7083 1
461 . 1 1 47 47 TRP H H 1 9.027 0.01 . 1 . . . . . 47 TRP H . 7083 1
462 . 1 1 47 47 TRP HA H 1 4.052 0.01 . 1 . . . . . 47 TRP HA . 7083 1
463 . 1 1 47 47 TRP HB2 H 1 3.196 0.01 . 1 . . . . . 47 TRP HB2 . 7083 1
464 . 1 1 47 47 TRP HB3 H 1 2.915 0.01 . 1 . . . . . 47 TRP HB3 . 7083 1
465 . 1 1 47 47 TRP HD1 H 1 7.213 0.01 . 1 . . . . . 47 TRP HD1 . 7083 1
466 . 1 1 47 47 TRP HE1 H 1 9.926 0.01 . 1 . . . . . 47 TRP HE1 . 7083 1
467 . 1 1 47 47 TRP HE3 H 1 6.718 0.01 . 1 . . . . . 47 TRP HE3 . 7083 1
468 . 1 1 47 47 TRP HZ2 H 1 6.973 0.01 . 1 . . . . . 47 TRP HZ2 . 7083 1
469 . 1 1 47 47 TRP HZ3 H 1 7.276 0.01 . 1 . . . . . 47 TRP HZ3 . 7083 1
470 . 1 1 47 47 TRP HH2 H 1 6.582 0.01 . 1 . . . . . 47 TRP HH2 . 7083 1
471 . 1 1 47 47 TRP C C 13 176.00 0.1 . 1 . . . . . 47 TRP C . 7083 1
472 . 1 1 47 47 TRP CA C 13 56.078 0.05 . 1 . . . . . 47 TRP CA . 7083 1
473 . 1 1 47 47 TRP CB C 13 26.977 0.05 . 1 . . . . . 47 TRP CB . 7083 1
474 . 1 1 47 47 TRP N N 15 125.99 0.1 . 1 . . . . . 47 TRP N . 7083 1
475 . 1 1 47 47 TRP NE1 N 15 130.01 0.1 . 1 . . . . . 47 TRP NE1 . 7083 1
476 . 1 1 48 48 ASN H H 1 9.070 0.01 . 1 . . . . . 48 ASN H . 7083 1
477 . 1 1 48 48 ASN HA H 1 4.162 0.01 . 1 . . . . . 48 ASN HA . 7083 1
478 . 1 1 48 48 ASN HB2 H 1 2.646 0.01 . 1 . . . . . 48 ASN HB2 . 7083 1
479 . 1 1 48 48 ASN HB3 H 1 2.257 0.01 . 1 . . . . . 48 ASN HB3 . 7083 1
480 . 1 1 48 48 ASN HD21 H 1 7.049 0.01 . 1 . . . . . 48 ASN HD21 . 7083 1
481 . 1 1 48 48 ASN HD22 H 1 6.518 0.01 . 1 . . . . . 48 ASN HD22 . 7083 1
482 . 1 1 48 48 ASN C C 13 173.92 0.1 . 1 . . . . . 48 ASN C . 7083 1
483 . 1 1 48 48 ASN CA C 13 51.542 0.05 . 1 . . . . . 48 ASN CA . 7083 1
484 . 1 1 48 48 ASN CB C 13 35.007 0.05 . 1 . . . . . 48 ASN CB . 7083 1
485 . 1 1 48 48 ASN N N 15 121.50 0.1 . 1 . . . . . 48 ASN N . 7083 1
486 . 1 1 48 48 ASN ND2 N 15 109.89 0.1 . 1 . . . . . 48 ASN ND2 . 7083 1
487 . 1 1 49 49 ASN H H 1 9.108 0.01 . 1 . . . . . 49 ASN H . 7083 1
488 . 1 1 49 49 ASN HA H 1 4.092 0.01 . 1 . . . . . 49 ASN HA . 7083 1
489 . 1 1 49 49 ASN HB2 H 1 2.785 0.01 . 1 . . . . . 49 ASN HB2 . 7083 1
490 . 1 1 49 49 ASN HB3 H 1 2.418 0.01 . 1 . . . . . 49 ASN HB3 . 7083 1
491 . 1 1 49 49 ASN HD21 H 1 7.378 0.01 . 1 . . . . . 49 ASN HD21 . 7083 1
492 . 1 1 49 49 ASN HD22 H 1 6.640 0.01 . 1 . . . . . 49 ASN HD22 . 7083 1
493 . 1 1 49 49 ASN C C 13 172.58 0.1 . 1 . . . . . 49 ASN C . 7083 1
494 . 1 1 49 49 ASN CA C 13 52.154 0.05 . 1 . . . . . 49 ASN CA . 7083 1
495 . 1 1 49 49 ASN CB C 13 34.858 0.05 . 1 . . . . . 49 ASN CB . 7083 1
496 . 1 1 49 49 ASN N N 15 115.19 0.1 . 1 . . . . . 49 ASN N . 7083 1
497 . 1 1 49 49 ASN ND2 N 15 112.81 0.1 . 1 . . . . . 49 ASN ND2 . 7083 1
498 . 1 1 50 50 ASN H H 1 7.258 0.01 . 1 . . . . . 50 ASN H . 7083 1
499 . 1 1 50 50 ASN HA H 1 4.522 0.01 . 1 . . . . . 50 ASN HA . 7083 1
500 . 1 1 50 50 ASN HB2 H 1 2.864 0.01 . 1 . . . . . 50 ASN HB2 . 7083 1
501 . 1 1 50 50 ASN HB3 H 1 2.673 0.01 . 1 . . . . . 50 ASN HB3 . 7083 1
502 . 1 1 50 50 ASN HD21 H 1 7.213 0.01 . 1 . . . . . 50 ASN HD21 . 7083 1
503 . 1 1 50 50 ASN HD22 H 1 6.532 0.01 . 1 . . . . . 50 ASN HD22 . 7083 1
504 . 1 1 50 50 ASN C C 13 172.67 0.1 . 1 . . . . . 50 ASN C . 7083 1
505 . 1 1 50 50 ASN CA C 13 52.718 0.05 . 1 . . . . . 50 ASN CA . 7083 1
506 . 1 1 50 50 ASN CB C 13 34.193 0.05 . 1 . . . . . 50 ASN CB . 7083 1
507 . 1 1 50 50 ASN N N 15 110.83 0.1 . 1 . . . . . 50 ASN N . 7083 1
508 . 1 1 50 50 ASN ND2 N 15 114.21 0.1 . 1 . . . . . 50 ASN ND2 . 7083 1
509 . 1 1 51 51 GLY H H 1 7.258 0.01 . 1 . . . . . 51 GLY H . 7083 1
510 . 1 1 51 51 GLY HA2 H 1 4.090 0.01 . 1 . . . . . 51 GLY HA2 . 7083 1
511 . 1 1 51 51 GLY HA3 H 1 3.443 0.01 . 1 . . . . . 51 GLY HA3 . 7083 1
512 . 1 1 51 51 GLY C C 13 172.70 0.1 . 1 . . . . . 51 GLY C . 7083 1
513 . 1 1 51 51 GLY CA C 13 42.659 0.05 . 1 . . . . . 51 GLY CA . 7083 1
514 . 1 1 51 51 GLY N N 15 102.22 0.1 . 1 . . . . . 51 GLY N . 7083 1
515 . 1 1 52 52 ASN H H 1 9.185 0.01 . 1 . . . . . 52 ASN H . 7083 1
516 . 1 1 52 52 ASN HA H 1 4.550 0.01 . 1 . . . . . 52 ASN HA . 7083 1
517 . 1 1 52 52 ASN HB2 H 1 2.732 0.01 . 1 . . . . . 52 ASN HB2 . 7083 1
518 . 1 1 52 52 ASN HB3 H 1 0.775 0.01 . 1 . . . . . 52 ASN HB3 . 7083 1
519 . 1 1 52 52 ASN HD21 H 1 6.586 0.01 . 1 . . . . . 52 ASN HD21 . 7083 1
520 . 1 1 52 52 ASN HD22 H 1 6.443 0.01 . 1 . . . . . 52 ASN HD22 . 7083 1
521 . 1 1 52 52 ASN C C 13 169.36 0.1 . 1 . . . . . 52 ASN C . 7083 1
522 . 1 1 52 52 ASN CA C 13 48.916 0.05 . 1 . . . . . 52 ASN CA . 7083 1
523 . 1 1 52 52 ASN CB C 13 32.116 0.05 . 1 . . . . . 52 ASN CB . 7083 1
524 . 1 1 52 52 ASN N N 15 124.49 0.1 . 1 . . . . . 52 ASN N . 7083 1
525 . 1 1 52 52 ASN ND2 N 15 111.30 0.1 . 1 . . . . . 52 ASN ND2 . 7083 1
526 . 1 1 53 53 ILE H H 1 7.446 0.01 . 1 . . . . . 53 ILE H . 7083 1
527 . 1 1 53 53 ILE HA H 1 5.161 0.01 . 1 . . . . . 53 ILE HA . 7083 1
528 . 1 1 53 53 ILE HB H 1 1.414 0.01 . 1 . . . . . 53 ILE HB . 7083 1
529 . 1 1 53 53 ILE HG12 H 1 0.944 0.01 . 1 . . . . . 53 ILE HG12 . 7083 1
530 . 1 1 53 53 ILE HG13 H 1 0.706 0.01 . 1 . . . . . 53 ILE HG13 . 7083 1
531 . 1 1 53 53 ILE HG21 H 1 0.637 0.01 . 1 . . . . . 53 ILE HG2 . 7083 1
532 . 1 1 53 53 ILE HG22 H 1 0.637 0.01 . 1 . . . . . 53 ILE HG2 . 7083 1
533 . 1 1 53 53 ILE HG23 H 1 0.637 0.01 . 1 . . . . . 53 ILE HG2 . 7083 1
534 . 1 1 53 53 ILE HD11 H 1 0.445 0.01 . 1 . . . . . 53 ILE HD1 . 7083 1
535 . 1 1 53 53 ILE HD12 H 1 0.445 0.01 . 1 . . . . . 53 ILE HD1 . 7083 1
536 . 1 1 53 53 ILE HD13 H 1 0.445 0.01 . 1 . . . . . 53 ILE HD1 . 7083 1
537 . 1 1 53 53 ILE C C 13 174.29 0.1 . 1 . . . . . 53 ILE C . 7083 1
538 . 1 1 53 53 ILE CA C 13 56.657 0.05 . 1 . . . . . 53 ILE CA . 7083 1
539 . 1 1 53 53 ILE CB C 13 40.690 0.05 . 1 . . . . . 53 ILE CB . 7083 1
540 . 1 1 53 53 ILE N N 15 117.60 0.1 . 1 . . . . . 53 ILE N . 7083 1
541 . 1 1 54 54 ILE H H 1 9.033 0.01 . 1 . . . . . 54 ILE H . 7083 1
542 . 1 1 54 54 ILE HA H 1 4.060 0.01 . 1 . . . . . 54 ILE HA . 7083 1
543 . 1 1 54 54 ILE HB H 1 1.200 0.01 . 1 . . . . . 54 ILE HB . 7083 1
544 . 1 1 54 54 ILE HG12 H 1 0.953 0.01 . 1 . . . . . 54 ILE HG12 . 7083 1
545 . 1 1 54 54 ILE HG13 H 1 0.841 0.01 . 1 . . . . . 54 ILE HG13 . 7083 1
546 . 1 1 54 54 ILE HG21 H 1 0.656 0.01 . 1 . . . . . 54 ILE HG2 . 7083 1
547 . 1 1 54 54 ILE HG22 H 1 0.656 0.01 . 1 . . . . . 54 ILE HG2 . 7083 1
548 . 1 1 54 54 ILE HG23 H 1 0.656 0.01 . 1 . . . . . 54 ILE HG2 . 7083 1
549 . 1 1 54 54 ILE HD11 H 1 0.596 0.01 . 1 . . . . . 54 ILE HD1 . 7083 1
550 . 1 1 54 54 ILE HD12 H 1 0.596 0.01 . 1 . . . . . 54 ILE HD1 . 7083 1
551 . 1 1 54 54 ILE HD13 H 1 0.596 0.01 . 1 . . . . . 54 ILE HD1 . 7083 1
552 . 1 1 54 54 ILE C C 13 172.40 0.1 . 1 . . . . . 54 ILE C . 7083 1
553 . 1 1 54 54 ILE CA C 13 57.755 0.05 . 1 . . . . . 54 ILE CA . 7083 1
554 . 1 1 54 54 ILE CB C 13 40.268 0.05 . 1 . . . . . 54 ILE CB . 7083 1
555 . 1 1 54 54 ILE N N 15 125.20 0.1 . 1 . . . . . 54 ILE N . 7083 1
556 . 1 1 55 55 ALA H H 1 8.852 0.01 . 1 . . . . . 55 ALA H . 7083 1
557 . 1 1 55 55 ALA HA H 1 4.542 0.01 . 1 . . . . . 55 ALA HA . 7083 1
558 . 1 1 55 55 ALA HB1 H 1 1.328 0.01 . 1 . . . . . 55 ALA HB . 7083 1
559 . 1 1 55 55 ALA HB2 H 1 1.328 0.01 . 1 . . . . . 55 ALA HB . 7083 1
560 . 1 1 55 55 ALA HB3 H 1 1.328 0.01 . 1 . . . . . 55 ALA HB . 7083 1
561 . 1 1 55 55 ALA C C 13 174.72 0.1 . 1 . . . . . 55 ALA C . 7083 1
562 . 1 1 55 55 ALA CA C 13 50.090 0.05 . 1 . . . . . 55 ALA CA . 7083 1
563 . 1 1 55 55 ALA CB C 13 16.986 0.05 . 1 . . . . . 55 ALA CB . 7083 1
564 . 1 1 55 55 ALA N N 15 130.09 0.1 . 1 . . . . . 55 ALA N . 7083 1
565 . 1 1 56 56 ALA H H 1 8.599 0.01 . 1 . . . . . 56 ALA H . 7083 1
566 . 1 1 56 56 ALA HA H 1 4.918 0.01 . 1 . . . . . 56 ALA HA . 7083 1
567 . 1 1 56 56 ALA HB1 H 1 1.268 0.01 . 1 . . . . . 56 ALA HB . 7083 1
568 . 1 1 56 56 ALA HB2 H 1 1.268 0.01 . 1 . . . . . 56 ALA HB . 7083 1
569 . 1 1 56 56 ALA HB3 H 1 1.268 0.01 . 1 . . . . . 56 ALA HB . 7083 1
570 . 1 1 56 56 ALA C C 13 174.00 0.1 . 1 . . . . . 56 ALA C . 7083 1
571 . 1 1 56 56 ALA CA C 13 48.216 0.05 . 1 . . . . . 56 ALA CA . 7083 1
572 . 1 1 56 56 ALA CB C 13 18.613 0.05 . 1 . . . . . 56 ALA CB . 7083 1
573 . 1 1 56 56 ALA N N 15 126.28 0.1 . 1 . . . . . 56 ALA N . 7083 1
574 . 1 1 57 57 SER H H 1 9.312 0.01 . 1 . . . . . 57 SER H . 7083 1
575 . 1 1 57 57 SER HA H 1 4.691 0.01 . 1 . . . . . 57 SER HA . 7083 1
576 . 1 1 57 57 SER HB2 H 1 3.558 0.01 . 1 . . . . . 57 SER HB2 . 7083 1
577 . 1 1 57 57 SER HB3 H 1 3.432 0.01 . 1 . . . . . 57 SER HB3 . 7083 1
578 . 1 1 57 57 SER C C 13 170.25 0.1 . 1 . . . . . 57 SER C . 7083 1
579 . 1 1 57 57 SER CA C 13 55.156 0.05 . 1 . . . . . 57 SER CA . 7083 1
580 . 1 1 57 57 SER CB C 13 63.897 0.05 . 1 . . . . . 57 SER CB . 7083 1
581 . 1 1 57 57 SER N N 15 113.96 0.1 . 1 . . . . . 57 SER N . 7083 1
582 . 1 1 58 58 PHE H H 1 7.509 0.01 . 1 . . . . . 58 PHE H . 7083 1
583 . 1 1 58 58 PHE HA H 1 4.670 0.01 . 1 . . . . . 58 PHE HA . 7083 1
584 . 1 1 58 58 PHE HB2 H 1 2.017 0.01 . 1 . . . . . 58 PHE HB2 . 7083 1
585 . 1 1 58 58 PHE HB3 H 1 1.751 0.01 . 1 . . . . . 58 PHE HB3 . 7083 1
586 . 1 1 58 58 PHE HD1 H 1 6.672 0.01 . 1 . . . . . 58 PHE HD1 . 7083 1
587 . 1 1 58 58 PHE HE1 H 1 6.945 0.01 . 1 . . . . . 58 PHE HE1 . 7083 1
588 . 1 1 58 58 PHE C C 13 172.74 0.1 . 1 . . . . . 58 PHE C . 7083 1
589 . 1 1 58 58 PHE CA C 13 56.123 0.05 . 1 . . . . . 58 PHE CA . 7083 1
590 . 1 1 58 58 PHE CB C 13 36.714 0.05 . 1 . . . . . 58 PHE CB . 7083 1
591 . 1 1 58 58 PHE N N 15 125.00 0.1 . 1 . . . . . 58 PHE N . 7083 1
592 . 1 1 59 59 SER H H 1 8.015 0.01 . 1 . . . . . 59 SER H . 7083 1
593 . 1 1 59 59 SER HA H 1 4.186 0.01 . 1 . . . . . 59 SER HA . 7083 1
594 . 1 1 59 59 SER HB2 H 1 3.223 0.01 . 1 . . . . . 59 SER HB2 . 7083 1
595 . 1 1 59 59 SER HB3 H 1 3.252 0.01 . 1 . . . . . 59 SER HB3 . 7083 1
596 . 1 1 59 59 SER C C 13 172.03 0.1 . 1 . . . . . 59 SER C . 7083 1
597 . 1 1 59 59 SER CA C 13 55.627 0.05 . 1 . . . . . 59 SER CA . 7083 1
598 . 1 1 59 59 SER CB C 13 61.764 0.05 . 1 . . . . . 59 SER CB . 7083 1
599 . 1 1 59 59 SER N N 15 122.42 0.1 . 1 . . . . . 59 SER N . 7083 1
600 . 1 1 60 60 GLY H H 1 6.431 0.01 . 1 . . . . . 60 GLY H . 7083 1
601 . 1 1 60 60 GLY HA2 H 1 3.848 0.01 . 1 . . . . . 60 GLY HA2 . 7083 1
602 . 1 1 60 60 GLY HA3 H 1 3.442 0.01 . 1 . . . . . 60 GLY HA3 . 7083 1
603 . 1 1 60 60 GLY C C 13 167.05 0.1 . 1 . . . . . 60 GLY C . 7083 1
604 . 1 1 60 60 GLY CA C 13 43.829 0.05 . 1 . . . . . 60 GLY CA . 7083 1
605 . 1 1 60 60 GLY N N 15 104.41 0.1 . 1 . . . . . 60 GLY N . 7083 1
606 . 1 1 61 61 PRO HA H 1 4.587 0.01 . 1 . . . . . 61 PRO HA . 7083 1
607 . 1 1 61 61 PRO HB2 H 1 2.399 0.01 . 1 . . . . . 61 PRO HB2 . 7083 1
608 . 1 1 61 61 PRO HB3 H 1 1.896 0.01 . 1 . . . . . 61 PRO HB3 . 7083 1
609 . 1 1 61 61 PRO HG2 H 1 2.060 0.01 . 1 . . . . . 61 PRO HG2 . 7083 1
610 . 1 1 61 61 PRO HD2 H 1 3.609 0.01 . 1 . . . . . 61 PRO HD2 . 7083 1
611 . 1 1 61 61 PRO HD3 H 1 3.508 0.01 . 1 . . . . . 61 PRO HD3 . 7083 1
612 . 1 1 61 61 PRO C C 13 173.94 0.1 . 1 . . . . . 61 PRO C . 7083 1
613 . 1 1 61 61 PRO CA C 13 60.366 0.05 . 1 . . . . . 61 PRO CA . 7083 1
614 . 1 1 61 61 PRO CB C 13 30.602 0.05 . 1 . . . . . 61 PRO CB . 7083 1
615 . 1 1 62 62 ILE H H 1 7.849 0.01 . 1 . . . . . 62 ILE H . 7083 1
616 . 1 1 62 62 ILE HA H 1 4.058 0.01 . 1 . . . . . 62 ILE HA . 7083 1
617 . 1 1 62 62 ILE HB H 1 1.487 0.01 . 1 . . . . . 62 ILE HB . 7083 1
618 . 1 1 62 62 ILE HG12 H 1 0.955 0.01 . 1 . . . . . 62 ILE HG12 . 7083 1
619 . 1 1 62 62 ILE HG13 H 1 0.463 0.01 . 1 . . . . . 62 ILE HG13 . 7083 1
620 . 1 1 62 62 ILE HG21 H 1 0.598 0.01 . 1 . . . . . 62 ILE HG2 . 7083 1
621 . 1 1 62 62 ILE HG22 H 1 0.598 0.01 . 1 . . . . . 62 ILE HG2 . 7083 1
622 . 1 1 62 62 ILE HG23 H 1 0.598 0.01 . 1 . . . . . 62 ILE HG2 . 7083 1
623 . 1 1 62 62 ILE HD11 H 1 -0.021 0.01 . 1 . . . . . 62 ILE HD1 . 7083 1
624 . 1 1 62 62 ILE HD12 H 1 -0.021 0.01 . 1 . . . . . 62 ILE HD1 . 7083 1
625 . 1 1 62 62 ILE HD13 H 1 -0.021 0.01 . 1 . . . . . 62 ILE HD1 . 7083 1
626 . 1 1 62 62 ILE C C 13 174.19 0.1 . 1 . . . . . 62 ILE C . 7083 1
627 . 1 1 62 62 ILE CA C 13 58.989 0.05 . 1 . . . . . 62 ILE CA . 7083 1
628 . 1 1 62 62 ILE CB C 13 34.907 0.05 . 1 . . . . . 62 ILE CB . 7083 1
629 . 1 1 62 62 ILE N N 15 121.08 0.1 . 1 . . . . . 62 ILE N . 7083 1
630 . 1 1 63 63 SER H H 1 8.540 0.01 . 1 . . . . . 63 SER H . 7083 1
631 . 1 1 63 63 SER HA H 1 4.064 0.01 . 1 . . . . . 63 SER HA . 7083 1
632 . 1 1 63 63 SER HB2 H 1 3.693 0.01 . 1 . . . . . 63 SER HB2 . 7083 1
633 . 1 1 63 63 SER HB3 H 1 3.640 0.01 . 1 . . . . . 63 SER HB3 . 7083 1
634 . 1 1 63 63 SER C C 13 173.05 0.1 . 1 . . . . . 63 SER C . 7083 1
635 . 1 1 63 63 SER CA C 13 57.955 0.05 . 1 . . . . . 63 SER CA . 7083 1
636 . 1 1 63 63 SER CB C 13 60.644 0.05 . 1 . . . . . 63 SER CB . 7083 1
637 . 1 1 63 63 SER N N 15 124.11 0.1 . 1 . . . . . 63 SER N . 7083 1
638 . 1 1 64 64 GLY H H 1 8.877 0.01 . 1 . . . . . 64 GLY H . 7083 1
639 . 1 1 64 64 GLY HA2 H 1 3.942 0.01 . 1 . . . . . 64 GLY HA2 . 7083 1
640 . 1 1 64 64 GLY HA3 H 1 3.624 0.01 . 1 . . . . . 64 GLY HA3 . 7083 1
641 . 1 1 64 64 GLY C C 13 171.05 0.1 . 1 . . . . . 64 GLY C . 7083 1
642 . 1 1 64 64 GLY CA C 13 43.437 0.05 . 1 . . . . . 64 GLY CA . 7083 1
643 . 1 1 64 64 GLY N N 15 113.00 0.1 . 1 . . . . . 64 GLY N . 7083 1
644 . 1 1 65 65 SER H H 1 7.896 0.01 . 1 . . . . . 65 SER H . 7083 1
645 . 1 1 65 65 SER HA H 1 4.851 0.01 . 1 . . . . . 65 SER HA . 7083 1
646 . 1 1 65 65 SER HB2 H 1 3.946 0.01 . 1 . . . . . 65 SER HB2 . 7083 1
647 . 1 1 65 65 SER HB3 H 1 3.604 0.01 . 1 . . . . . 65 SER HB3 . 7083 1
648 . 1 1 65 65 SER C C 13 170.97 0.1 . 1 . . . . . 65 SER C . 7083 1
649 . 1 1 65 65 SER CA C 13 54.832 0.05 . 1 . . . . . 65 SER CA . 7083 1
650 . 1 1 65 65 SER CB C 13 65.887 0.05 . 1 . . . . . 65 SER CB . 7083 1
651 . 1 1 65 65 SER N N 15 114.62 0.1 . 1 . . . . . 65 SER N . 7083 1
652 . 1 1 66 66 ASN H H 1 8.770 0.01 . 1 . . . . . 66 ASN H . 7083 1
653 . 1 1 66 66 ASN HA H 1 5.007 0.01 . 1 . . . . . 66 ASN HA . 7083 1
654 . 1 1 66 66 ASN HB2 H 1 2.574 0.01 . 1 . . . . . 66 ASN HB2 . 7083 1
655 . 1 1 66 66 ASN HB3 H 1 2.363 0.01 . 1 . . . . . 66 ASN HB3 . 7083 1
656 . 1 1 66 66 ASN HD21 H 1 7.203 0.01 . 1 . . . . . 66 ASN HD21 . 7083 1
657 . 1 1 66 66 ASN HD22 H 1 6.499 0.01 . 1 . . . . . 66 ASN HD22 . 7083 1
658 . 1 1 66 66 ASN C C 13 171.28 0.1 . 1 . . . . . 66 ASN C . 7083 1
659 . 1 1 66 66 ASN CA C 13 49.938 0.05 . 1 . . . . . 66 ASN CA . 7083 1
660 . 1 1 66 66 ASN CB C 13 36.219 0.05 . 1 . . . . . 66 ASN CB . 7083 1
661 . 1 1 66 66 ASN N N 15 117.59 0.1 . 1 . . . . . 66 ASN N . 7083 1
662 . 1 1 66 66 ASN ND2 N 15 110.40 0.1 . 1 . . . . . 66 ASN ND2 . 7083 1
663 . 1 1 67 67 TYR H H 1 8.653 0.01 . 1 . . . . . 67 TYR H . 7083 1
664 . 1 1 67 67 TYR HA H 1 4.791 0.01 . 1 . . . . . 67 TYR HA . 7083 1
665 . 1 1 67 67 TYR HB2 H 1 2.660 0.01 . 1 . . . . . 67 TYR HB2 . 7083 1
666 . 1 1 67 67 TYR HB3 H 1 2.493 0.01 . 1 . . . . . 67 TYR HB3 . 7083 1
667 . 1 1 67 67 TYR HD1 H 1 6.511 0.01 . 1 . . . . . 67 TYR HD1 . 7083 1
668 . 1 1 67 67 TYR HE1 H 1 6.412 0.01 . 1 . . . . . 67 TYR HE1 . 7083 1
669 . 1 1 67 67 TYR C C 13 172.38 0.1 . 1 . . . . . 67 TYR C . 7083 1
670 . 1 1 67 67 TYR CA C 13 55.858 0.05 . 1 . . . . . 67 TYR CA . 7083 1
671 . 1 1 67 67 TYR CB C 13 40.876 0.05 . 1 . . . . . 67 TYR CB . 7083 1
672 . 1 1 67 67 TYR N N 15 116.79 0.1 . 1 . . . . . 67 TYR N . 7083 1
673 . 1 1 68 68 GLU H H 1 9.171 0.01 . 1 . . . . . 68 GLU H . 7083 1
674 . 1 1 68 68 GLU HA H 1 4.665 0.01 . 1 . . . . . 68 GLU HA . 7083 1
675 . 1 1 68 68 GLU HB2 H 1 2.123 0.01 . 1 . . . . . 68 GLU HB2 . 7083 1
676 . 1 1 68 68 GLU HB3 H 1 2.097 0.01 . 1 . . . . . 68 GLU HB3 . 7083 1
677 . 1 1 68 68 GLU HG2 H 1 2.347 0.01 . 1 . . . . . 68 GLU HG2 . 7083 1
678 . 1 1 68 68 GLU C C 13 172.97 0.1 . 1 . . . . . 68 GLU C . 7083 1
679 . 1 1 68 68 GLU CA C 13 51.572 0.05 . 1 . . . . . 68 GLU CA . 7083 1
680 . 1 1 68 68 GLU CB C 13 31.575 0.05 . 1 . . . . . 68 GLU CB . 7083 1
681 . 1 1 68 68 GLU N N 15 118.61 0.1 . 1 . . . . . 68 GLU N . 7083 1
682 . 1 1 69 69 TYR H H 1 9.004 0.01 . 1 . . . . . 69 TYR H . 7083 1
683 . 1 1 69 69 TYR HA H 1 5.542 0.01 . 1 . . . . . 69 TYR HA . 7083 1
684 . 1 1 69 69 TYR HB2 H 1 2.496 0.01 . 1 . . . . . 69 TYR HB2 . 7083 1
685 . 1 1 69 69 TYR HD1 H 1 6.664 0.01 . 1 . . . . . 69 TYR HD1 . 7083 1
686 . 1 1 69 69 TYR HE1 H 1 6.135 0.01 . 1 . . . . . 69 TYR HE1 . 7083 1
687 . 1 1 69 69 TYR C C 13 174.12 0.1 . 1 . . . . . 69 TYR C . 7083 1
688 . 1 1 69 69 TYR CA C 13 55.032 0.05 . 1 . . . . . 69 TYR CA . 7083 1
689 . 1 1 69 69 TYR CB C 13 38.508 0.05 . 1 . . . . . 69 TYR CB . 7083 1
690 . 1 1 69 69 TYR N N 15 119.02 0.1 . 1 . . . . . 69 TYR N . 7083 1
691 . 1 1 70 70 TRP H H 1 9.436 0.01 . 1 . . . . . 70 TRP H . 7083 1
692 . 1 1 70 70 TRP HA H 1 4.989 0.01 . 1 . . . . . 70 TRP HA . 7083 1
693 . 1 1 70 70 TRP HB2 H 1 2.861 0.01 . 1 . . . . . 70 TRP HB2 . 7083 1
694 . 1 1 70 70 TRP HB3 H 1 2.557 0.01 . 1 . . . . . 70 TRP HB3 . 7083 1
695 . 1 1 70 70 TRP HD1 H 1 6.842 0.01 . 1 . . . . . 70 TRP HD1 . 7083 1
696 . 1 1 70 70 TRP HE1 H 1 11.861 0.01 . 1 . . . . . 70 TRP HE1 . 7083 1
697 . 1 1 70 70 TRP HE3 H 1 6.953 0.01 . 1 . . . . . 70 TRP HE3 . 7083 1
698 . 1 1 70 70 TRP HZ2 H 1 6.671 0.01 . 1 . . . . . 70 TRP HZ2 . 7083 1
699 . 1 1 70 70 TRP HZ3 H 1 7.097 0.01 . 1 . . . . . 70 TRP HZ3 . 7083 1
700 . 1 1 70 70 TRP HH2 H 1 7.433 0.01 . 1 . . . . . 70 TRP HH2 . 7083 1
701 . 1 1 70 70 TRP C C 13 172.96 0.1 . 1 . . . . . 70 TRP C . 7083 1
702 . 1 1 70 70 TRP CA C 13 54.843 0.05 . 1 . . . . . 70 TRP CA . 7083 1
703 . 1 1 70 70 TRP CB C 13 28.968 0.05 . 1 . . . . . 70 TRP CB . 7083 1
704 . 1 1 70 70 TRP N N 15 124.63 0.1 . 1 . . . . . 70 TRP N . 7083 1
705 . 1 1 70 70 TRP NE1 N 15 133.49 0.1 . 1 . . . . . 70 TRP NE1 . 7083 1
706 . 1 1 71 71 THR H H 1 9.255 0.01 . 1 . . . . . 71 THR H . 7083 1
707 . 1 1 71 71 THR HA H 1 5.141 0.01 . 1 . . . . . 71 THR HA . 7083 1
708 . 1 1 71 71 THR HB H 1 3.950 0.01 . 1 . . . . . 71 THR HB . 7083 1
709 . 1 1 71 71 THR HG21 H 1 0.774 0.01 . 1 . . . . . 71 THR HG2 . 7083 1
710 . 1 1 71 71 THR HG22 H 1 0.774 0.01 . 1 . . . . . 71 THR HG2 . 7083 1
711 . 1 1 71 71 THR HG23 H 1 0.774 0.01 . 1 . . . . . 71 THR HG2 . 7083 1
712 . 1 1 71 71 THR C C 13 170.20 0.1 . 1 . . . . . 71 THR C . 7083 1
713 . 1 1 71 71 THR CA C 13 56.990 0.05 . 1 . . . . . 71 THR CA . 7083 1
714 . 1 1 71 71 THR CB C 13 69.700 0.05 . 1 . . . . . 71 THR CB . 7083 1
715 . 1 1 71 71 THR N N 15 112.20 0.1 . 1 . . . . . 71 THR N . 7083 1
716 . 1 1 72 72 PHE H H 1 7.588 0.01 . 1 . . . . . 72 PHE H . 7083 1
717 . 1 1 72 72 PHE HA H 1 5.043 0.01 . 1 . . . . . 72 PHE HA . 7083 1
718 . 1 1 72 72 PHE HB2 H 1 2.550 0.01 . 1 . . . . . 72 PHE HB2 . 7083 1
719 . 1 1 72 72 PHE HB3 H 1 2.380 0.01 . 1 . . . . . 72 PHE HB3 . 7083 1
720 . 1 1 72 72 PHE HD1 H 1 6.193 0.01 . 1 . . . . . 72 PHE HD1 . 7083 1
721 . 1 1 72 72 PHE HE1 H 1 5.852 0.01 . 1 . . . . . 72 PHE HE1 . 7083 1
722 . 1 1 72 72 PHE C C 13 171.52 0.1 . 1 . . . . . 72 PHE C . 7083 1
723 . 1 1 72 72 PHE CA C 13 53.023 0.05 . 1 . . . . . 72 PHE CA . 7083 1
724 . 1 1 72 72 PHE CB C 13 40.215 0.05 . 1 . . . . . 72 PHE CB . 7083 1
725 . 1 1 72 72 PHE N N 15 114.80 0.1 . 1 . . . . . 72 PHE N . 7083 1
726 . 1 1 73 73 SER H H 1 8.133 0.01 . 1 . . . . . 73 SER H . 7083 1
727 . 1 1 73 73 SER HA H 1 4.702 0.01 . 1 . . . . . 73 SER HA . 7083 1
728 . 1 1 73 73 SER HB2 H 1 3.492 0.01 . 1 . . . . . 73 SER HB2 . 7083 1
729 . 1 1 73 73 SER HB3 H 1 3.335 0.01 . 1 . . . . . 73 SER HB3 . 7083 1
730 . 1 1 73 73 SER C C 13 170.89 0.1 . 1 . . . . . 73 SER C . 7083 1
731 . 1 1 73 73 SER CA C 13 55.956 0.05 . 1 . . . . . 73 SER CA . 7083 1
732 . 1 1 73 73 SER CB C 13 60.876 0.05 . 1 . . . . . 73 SER CB . 7083 1
733 . 1 1 73 73 SER N N 15 113.25 0.1 . 1 . . . . . 73 SER N . 7083 1
734 . 1 1 74 74 ALA H H 1 9.064 0.01 . 1 . . . . . 74 ALA H . 7083 1
735 . 1 1 74 74 ALA HA H 1 4.590 0.01 . 1 . . . . . 74 ALA HA . 7083 1
736 . 1 1 74 74 ALA HB1 H 1 1.318 0.01 . 1 . . . . . 74 ALA HB . 7083 1
737 . 1 1 74 74 ALA HB2 H 1 1.318 0.01 . 1 . . . . . 74 ALA HB . 7083 1
738 . 1 1 74 74 ALA HB3 H 1 1.318 0.01 . 1 . . . . . 74 ALA HB . 7083 1
739 . 1 1 74 74 ALA C C 13 173.37 0.1 . 1 . . . . . 74 ALA C . 7083 1
740 . 1 1 74 74 ALA CA C 13 49.367 0.05 . 1 . . . . . 74 ALA CA . 7083 1
741 . 1 1 74 74 ALA CB C 13 21.532 0.05 . 1 . . . . . 74 ALA CB . 7083 1
742 . 1 1 74 74 ALA N N 15 128.85 0.1 . 1 . . . . . 74 ALA N . 7083 1
743 . 1 1 75 75 SER H H 1 8.542 0.01 . 1 . . . . . 75 SER H . 7083 1
744 . 1 1 75 75 SER HA H 1 4.975 0.01 . 1 . . . . . 75 SER HA . 7083 1
745 . 1 1 75 75 SER HB2 H 1 3.722 0.01 . 1 . . . . . 75 SER HB2 . 7083 1
746 . 1 1 75 75 SER HB3 H 1 3.627 0.01 . 1 . . . . . 75 SER HB3 . 7083 1
747 . 1 1 75 75 SER C C 13 172.03 0.1 . 1 . . . . . 75 SER C . 7083 1
748 . 1 1 75 75 SER CA C 13 55.524 0.05 . 1 . . . . . 75 SER CA . 7083 1
749 . 1 1 75 75 SER CB C 13 60.456 0.05 . 1 . . . . . 75 SER CB . 7083 1
750 . 1 1 75 75 SER N N 15 117.60 0.1 . 1 . . . . . 75 SER N . 7083 1
751 . 1 1 76 76 VAL H H 1 8.119 0.01 . 1 . . . . . 76 VAL H . 7083 1
752 . 1 1 76 76 VAL HA H 1 4.226 0.01 . 1 . . . . . 76 VAL HA . 7083 1
753 . 1 1 76 76 VAL HB H 1 1.516 0.01 . 1 . . . . . 76 VAL HB . 7083 1
754 . 1 1 76 76 VAL HG11 H 1 0.433 0.01 . 1 . . . . . 76 VAL HG1 . 7083 1
755 . 1 1 76 76 VAL HG12 H 1 0.433 0.01 . 1 . . . . . 76 VAL HG1 . 7083 1
756 . 1 1 76 76 VAL HG13 H 1 0.433 0.01 . 1 . . . . . 76 VAL HG1 . 7083 1
757 . 1 1 76 76 VAL HG21 H 1 0.219 0.01 . 1 . . . . . 76 VAL HG2 . 7083 1
758 . 1 1 76 76 VAL HG22 H 1 0.219 0.01 . 1 . . . . . 76 VAL HG2 . 7083 1
759 . 1 1 76 76 VAL HG23 H 1 0.219 0.01 . 1 . . . . . 76 VAL HG2 . 7083 1
760 . 1 1 76 76 VAL C C 13 172.64 0.1 . 1 . . . . . 76 VAL C . 7083 1
761 . 1 1 76 76 VAL CA C 13 58.341 0.05 . 1 . . . . . 76 VAL CA . 7083 1
762 . 1 1 76 76 VAL CB C 13 33.850 0.05 . 1 . . . . . 76 VAL CB . 7083 1
763 . 1 1 76 76 VAL N N 15 124.61 0.1 . 1 . . . . . 76 VAL N . 7083 1
764 . 1 1 77 77 LYS H H 1 8.686 0.01 . 1 . . . . . 77 LYS H . 7083 1
765 . 1 1 77 77 LYS HA H 1 4.245 0.01 . 1 . . . . . 77 LYS HA . 7083 1
766 . 1 1 77 77 LYS HB2 H 1 1.714 0.01 . 1 . . . . . 77 LYS HB2 . 7083 1
767 . 1 1 77 77 LYS HB3 H 1 1.625 0.01 . 1 . . . . . 77 LYS HB3 . 7083 1
768 . 1 1 77 77 LYS HG2 H 1 1.343 0.01 . 1 . . . . . 77 LYS HG2 . 7083 1
769 . 1 1 77 77 LYS HG3 H 1 1.306 0.01 . 1 . . . . . 77 LYS HG3 . 7083 1
770 . 1 1 77 77 LYS HD2 H 1 1.556 0.01 . 1 . . . . . 77 LYS HD2 . 7083 1
771 . 1 1 77 77 LYS HE2 H 1 2.841 0.01 . 1 . . . . . 77 LYS HE2 . 7083 1
772 . 1 1 77 77 LYS C C 13 173.97 0.1 . 1 . . . . . 77 LYS C . 7083 1
773 . 1 1 77 77 LYS CA C 13 54.202 0.05 . 1 . . . . . 77 LYS CA . 7083 1
774 . 1 1 77 77 LYS CB C 13 30.358 0.05 . 1 . . . . . 77 LYS CB . 7083 1
775 . 1 1 77 77 LYS N N 15 127.11 0.1 . 1 . . . . . 77 LYS N . 7083 1
776 . 1 1 78 78 GLY H H 1 7.093 0.01 . 1 . . . . . 78 GLY H . 7083 1
777 . 1 1 78 78 GLY HA2 H 1 3.835 0.01 . 1 . . . . . 78 GLY HA2 . 7083 1
778 . 1 1 78 78 GLY HA3 H 1 3.675 0.01 . 1 . . . . . 78 GLY HA3 . 7083 1
779 . 1 1 78 78 GLY C C 13 168.88 0.1 . 1 . . . . . 78 GLY C . 7083 1
780 . 1 1 78 78 GLY CA C 13 43.191 0.05 . 1 . . . . . 78 GLY CA . 7083 1
781 . 1 1 78 78 GLY N N 15 107.65 0.1 . 1 . . . . . 78 GLY N . 7083 1
782 . 1 1 79 79 ILE H H 1 7.646 0.01 . 1 . . . . . 79 ILE H . 7083 1
783 . 1 1 79 79 ILE HA H 1 4.333 0.01 . 1 . . . . . 79 ILE HA . 7083 1
784 . 1 1 79 79 ILE HB H 1 0.846 0.01 . 1 . . . . . 79 ILE HB . 7083 1
785 . 1 1 79 79 ILE HG12 H 1 -0.220 0.01 . 1 . . . . . 79 ILE HG12 . 7083 1
786 . 1 1 79 79 ILE HG13 H 1 1.038 0.01 . 1 . . . . . 79 ILE HG13 . 7083 1
787 . 1 1 79 79 ILE HG21 H 1 -0.630 0.01 . 1 . . . . . 79 ILE HG2 . 7083 1
788 . 1 1 79 79 ILE HG22 H 1 -0.630 0.01 . 1 . . . . . 79 ILE HG2 . 7083 1
789 . 1 1 79 79 ILE HG23 H 1 -0.630 0.01 . 1 . . . . . 79 ILE HG2 . 7083 1
790 . 1 1 79 79 ILE HD11 H 1 -1.182 0.01 . 1 . . . . . 79 ILE HD1 . 7083 1
791 . 1 1 79 79 ILE HD12 H 1 -1.182 0.01 . 1 . . . . . 79 ILE HD1 . 7083 1
792 . 1 1 79 79 ILE HD13 H 1 -1.182 0.01 . 1 . . . . . 79 ILE HD1 . 7083 1
793 . 1 1 79 79 ILE C C 13 170.10 0.1 . 1 . . . . . 79 ILE C . 7083 1
794 . 1 1 79 79 ILE CA C 13 57.243 0.05 . 1 . . . . . 79 ILE CA . 7083 1
795 . 1 1 79 79 ILE CB C 13 35.925 0.05 . 1 . . . . . 79 ILE CB . 7083 1
796 . 1 1 79 79 ILE N N 15 120.00 0.1 . 1 . . . . . 79 ILE N . 7083 1
797 . 1 1 80 80 LYS H H 1 7.523 0.01 . 1 . . . . . 80 LYS H . 7083 1
798 . 1 1 80 80 LYS HA H 1 4.407 0.01 . 1 . . . . . 80 LYS HA . 7083 1
799 . 1 1 80 80 LYS HB2 H 1 1.470 0.01 . 1 . . . . . 80 LYS HB2 . 7083 1
800 . 1 1 80 80 LYS HG2 H 1 1.185 0.01 . 1 . . . . . 80 LYS HG2 . 7083 1
801 . 1 1 80 80 LYS HD2 H 1 1.213 0.01 . 1 . . . . . 80 LYS HD2 . 7083 1
802 . 1 1 80 80 LYS C C 13 173.93 0.1 . 1 . . . . . 80 LYS C . 7083 1
803 . 1 1 80 80 LYS CA C 13 53.385 0.05 . 1 . . . . . 80 LYS CA . 7083 1
804 . 1 1 80 80 LYS CB C 13 33.767 0.05 . 1 . . . . . 80 LYS CB . 7083 1
805 . 1 1 80 80 LYS N N 15 123.50 0.1 . 1 . . . . . 80 LYS N . 7083 1
806 . 1 1 81 81 GLU H H 1 6.781 0.01 . 1 . . . . . 81 GLU H . 7083 1
807 . 1 1 81 81 GLU HA H 1 5.518 0.01 . 1 . . . . . 81 GLU HA . 7083 1
808 . 1 1 81 81 GLU HB2 H 1 2.308 0.01 . 1 . . . . . 81 GLU HB2 . 7083 1
809 . 1 1 81 81 GLU HB3 H 1 1.725 0.01 . 1 . . . . . 81 GLU HB3 . 7083 1
810 . 1 1 81 81 GLU HG2 H 1 1.853 0.01 . 1 . . . . . 81 GLU HG2 . 7083 1
811 . 1 1 81 81 GLU C C 13 172.46 0.1 . 1 . . . . . 81 GLU C . 7083 1
812 . 1 1 81 81 GLU CA C 13 51.927 0.05 . 1 . . . . . 81 GLU CA . 7083 1
813 . 1 1 81 81 GLU CB C 13 30.024 0.05 . 1 . . . . . 81 GLU CB . 7083 1
814 . 1 1 81 81 GLU N N 15 111.60 0.1 . 1 . . . . . 81 GLU N . 7083 1
815 . 1 1 82 82 PHE H H 1 8.716 0.01 . 1 . . . . . 82 PHE H . 7083 1
816 . 1 1 82 82 PHE HA H 1 5.691 0.01 . 1 . . . . . 82 PHE HA . 7083 1
817 . 1 1 82 82 PHE HB2 H 1 2.940 0.01 . 1 . . . . . 82 PHE HB2 . 7083 1
818 . 1 1 82 82 PHE HB3 H 1 2.754 0.01 . 1 . . . . . 82 PHE HB3 . 7083 1
819 . 1 1 82 82 PHE HD1 H 1 6.367 0.01 . 1 . . . . . 82 PHE HD1 . 7083 1
820 . 1 1 82 82 PHE HE1 H 1 6.489 0.01 . 1 . . . . . 82 PHE HE1 . 7083 1
821 . 1 1 82 82 PHE C C 13 169.91 0.1 . 1 . . . . . 82 PHE C . 7083 1
822 . 1 1 82 82 PHE CA C 13 55.496 0.05 . 1 . . . . . 82 PHE CA . 7083 1
823 . 1 1 82 82 PHE CB C 13 39.909 0.05 . 1 . . . . . 82 PHE CB . 7083 1
824 . 1 1 82 82 PHE N N 15 113.32 0.1 . 1 . . . . . 82 PHE N . 7083 1
825 . 1 1 83 83 TYR H H 1 9.250 0.01 . 1 . . . . . 83 TYR H . 7083 1
826 . 1 1 83 83 TYR HA H 1 5.012 0.01 . 1 . . . . . 83 TYR HA . 7083 1
827 . 1 1 83 83 TYR HB2 H 1 3.218 0.01 . 1 . . . . . 83 TYR HB2 . 7083 1
828 . 1 1 83 83 TYR HD1 H 1 6.835 0.01 . 1 . . . . . 83 TYR HD1 . 7083 1
829 . 1 1 83 83 TYR HE1 H 1 6.198 0.01 . 1 . . . . . 83 TYR HE1 . 7083 1
830 . 1 1 83 83 TYR C C 13 169.86 0.1 . 1 . . . . . 83 TYR C . 7083 1
831 . 1 1 83 83 TYR CA C 13 54.409 0.05 . 1 . . . . . 83 TYR CA . 7083 1
832 . 1 1 83 83 TYR CB C 13 38.866 0.05 . 1 . . . . . 83 TYR CB . 7083 1
833 . 1 1 83 83 TYR N N 15 114.39 0.1 . 1 . . . . . 83 TYR N . 7083 1
834 . 1 1 84 84 ILE H H 1 8.639 0.01 . 1 . . . . . 84 ILE H . 7083 1
835 . 1 1 84 84 ILE HA H 1 4.917 0.01 . 1 . . . . . 84 ILE HA . 7083 1
836 . 1 1 84 84 ILE HB H 1 1.879 0.01 . 1 . . . . . 84 ILE HB . 7083 1
837 . 1 1 84 84 ILE HG12 H 1 0.849 0.01 . 1 . . . . . 84 ILE HG12 . 7083 1
838 . 1 1 84 84 ILE HG21 H 1 0.683 0.01 . 1 . . . . . 84 ILE HG2 . 7083 1
839 . 1 1 84 84 ILE HG22 H 1 0.683 0.01 . 1 . . . . . 84 ILE HG2 . 7083 1
840 . 1 1 84 84 ILE HG23 H 1 0.683 0.01 . 1 . . . . . 84 ILE HG2 . 7083 1
841 . 1 1 84 84 ILE HD11 H 1 0.446 0.01 . 1 . . . . . 84 ILE HD1 . 7083 1
842 . 1 1 84 84 ILE HD12 H 1 0.446 0.01 . 1 . . . . . 84 ILE HD1 . 7083 1
843 . 1 1 84 84 ILE HD13 H 1 0.446 0.01 . 1 . . . . . 84 ILE HD1 . 7083 1
844 . 1 1 84 84 ILE C C 13 171.83 0.1 . 1 . . . . . 84 ILE C . 7083 1
845 . 1 1 84 84 ILE CA C 13 57.210 0.05 . 1 . . . . . 84 ILE CA . 7083 1
846 . 1 1 84 84 ILE CB C 13 38.029 0.05 . 1 . . . . . 84 ILE CB . 7083 1
847 . 1 1 84 84 ILE N N 15 118.30 0.1 . 1 . . . . . 84 ILE N . 7083 1
848 . 1 1 85 85 LYS H H 1 9.482 0.01 . 1 . . . . . 85 LYS H . 7083 1
849 . 1 1 85 85 LYS HA H 1 4.849 0.01 . 1 . . . . . 85 LYS HA . 7083 1
850 . 1 1 85 85 LYS HB2 H 1 1.841 0.01 . 1 . . . . . 85 LYS HB2 . 7083 1
851 . 1 1 85 85 LYS HB3 H 1 1.818 0.01 . 1 . . . . . 85 LYS HB3 . 7083 1
852 . 1 1 85 85 LYS HG2 H 1 1.330 0.01 . 1 . . . . . 85 LYS HG2 . 7083 1
853 . 1 1 85 85 LYS HG3 H 1 1.473 0.01 . 1 . . . . . 85 LYS HG3 . 7083 1
854 . 1 1 85 85 LYS HD2 H 1 1.019 0.01 . 1 . . . . . 85 LYS HD2 . 7083 1
855 . 1 1 85 85 LYS HD3 H 1 0.941 0.01 . 1 . . . . . 85 LYS HD3 . 7083 1
856 . 1 1 85 85 LYS HE2 H 1 2.678 0.01 . 1 . . . . . 85 LYS HE2 . 7083 1
857 . 1 1 85 85 LYS C C 13 170.82 0.1 . 1 . . . . . 85 LYS C . 7083 1
858 . 1 1 85 85 LYS CA C 13 52.929 0.05 . 1 . . . . . 85 LYS CA . 7083 1
859 . 1 1 85 85 LYS CB C 13 34.826 0.05 . 1 . . . . . 85 LYS CB . 7083 1
860 . 1 1 85 85 LYS N N 15 129.40 0.1 . 1 . . . . . 85 LYS N . 7083 1
861 . 1 1 86 86 TYR H H 1 9.170 0.01 . 1 . . . . . 86 TYR H . 7083 1
862 . 1 1 86 86 TYR HA H 1 5.557 0.01 . 1 . . . . . 86 TYR HA . 7083 1
863 . 1 1 86 86 TYR HB2 H 1 2.774 0.01 . 1 . . . . . 86 TYR HB2 . 7083 1
864 . 1 1 86 86 TYR HB3 H 1 2.477 0.01 . 1 . . . . . 86 TYR HB3 . 7083 1
865 . 1 1 86 86 TYR HD1 H 1 6.495 0.01 . 1 . . . . . 86 TYR HD1 . 7083 1
866 . 1 1 86 86 TYR HE1 H 1 6.164 0.01 . 1 . . . . . 86 TYR HE1 . 7083 1
867 . 1 1 86 86 TYR C C 13 170.54 0.1 . 1 . . . . . 86 TYR C . 7083 1
868 . 1 1 86 86 TYR CA C 13 50.396 0.05 . 1 . . . . . 86 TYR CA . 7083 1
869 . 1 1 86 86 TYR CB C 13 38.181 0.05 . 1 . . . . . 86 TYR CB . 7083 1
870 . 1 1 86 86 TYR N N 15 128.09 0.1 . 1 . . . . . 86 TYR N . 7083 1
871 . 1 1 87 87 GLU H H 1 9.157 0.01 . 1 . . . . . 87 GLU H . 7083 1
872 . 1 1 87 87 GLU HA H 1 4.925 0.01 . 1 . . . . . 87 GLU HA . 7083 1
873 . 1 1 87 87 GLU HB2 H 1 1.619 0.01 . 1 . . . . . 87 GLU HB2 . 7083 1
874 . 1 1 87 87 GLU HB3 H 1 1.722 0.01 . 1 . . . . . 87 GLU HB3 . 7083 1
875 . 1 1 87 87 GLU HG2 H 1 2.018 0.01 . 1 . . . . . 87 GLU HG2 . 7083 1
876 . 1 1 87 87 GLU HG3 H 1 1.815 0.01 . 1 . . . . . 87 GLU HG3 . 7083 1
877 . 1 1 87 87 GLU C C 13 172.72 0.1 . 1 . . . . . 87 GLU C . 7083 1
878 . 1 1 87 87 GLU CA C 13 52.092 0.05 . 1 . . . . . 87 GLU CA . 7083 1
879 . 1 1 87 87 GLU CB C 13 30.639 0.05 . 1 . . . . . 87 GLU CB . 7083 1
880 . 1 1 87 87 GLU N N 15 128.16 0.1 . 1 . . . . . 87 GLU N . 7083 1
881 . 1 1 88 88 VAL H H 1 8.167 0.01 . 1 . . . . . 88 VAL H . 7083 1
882 . 1 1 88 88 VAL HA H 1 4.237 0.01 . 1 . . . . . 88 VAL HA . 7083 1
883 . 1 1 88 88 VAL HB H 1 1.852 0.01 . 1 . . . . . 88 VAL HB . 7083 1
884 . 1 1 88 88 VAL HG11 H 1 0.760 0.01 . 1 . . . . . 88 VAL HG1 . 7083 1
885 . 1 1 88 88 VAL HG12 H 1 0.760 0.01 . 1 . . . . . 88 VAL HG1 . 7083 1
886 . 1 1 88 88 VAL HG13 H 1 0.760 0.01 . 1 . . . . . 88 VAL HG1 . 7083 1
887 . 1 1 88 88 VAL HG21 H 1 0.202 0.01 . 1 . . . . . 88 VAL HG2 . 7083 1
888 . 1 1 88 88 VAL HG22 H 1 0.202 0.01 . 1 . . . . . 88 VAL HG2 . 7083 1
889 . 1 1 88 88 VAL HG23 H 1 0.202 0.01 . 1 . . . . . 88 VAL HG2 . 7083 1
890 . 1 1 88 88 VAL C C 13 171.22 0.1 . 1 . . . . . 88 VAL C . 7083 1
891 . 1 1 88 88 VAL CA C 13 58.403 0.05 . 1 . . . . . 88 VAL CA . 7083 1
892 . 1 1 88 88 VAL CB C 13 30.874 0.05 . 1 . . . . . 88 VAL CB . 7083 1
893 . 1 1 88 88 VAL N N 15 122.89 0.1 . 1 . . . . . 88 VAL N . 7083 1
894 . 1 1 89 89 SER H H 1 9.314 0.01 . 1 . . . . . 89 SER H . 7083 1
895 . 1 1 89 89 SER HA H 1 3.731 0.01 . 1 . . . . . 89 SER HA . 7083 1
896 . 1 1 89 89 SER HB2 H 1 3.423 0.01 . 1 . . . . . 89 SER HB2 . 7083 1
897 . 1 1 89 89 SER HB3 H 1 3.876 0.01 . 1 . . . . . 89 SER HB3 . 7083 1
898 . 1 1 89 89 SER C C 13 172.24 0.1 . 1 . . . . . 89 SER C . 7083 1
899 . 1 1 89 89 SER CA C 13 55.942 0.05 . 1 . . . . . 89 SER CA . 7083 1
900 . 1 1 89 89 SER CB C 13 60.359 0.05 . 1 . . . . . 89 SER CB . 7083 1
901 . 1 1 89 89 SER N N 15 122.71 0.1 . 1 . . . . . 89 SER N . 7083 1
902 . 1 1 90 90 GLY H H 1 8.423 0.01 . 1 . . . . . 90 GLY H . 7083 1
903 . 1 1 90 90 GLY HA2 H 1 3.866 0.01 . 1 . . . . . 90 GLY HA2 . 7083 1
904 . 1 1 90 90 GLY HA3 H 1 3.371 0.01 . 1 . . . . . 90 GLY HA3 . 7083 1
905 . 1 1 90 90 GLY C C 13 171.66 0.1 . 1 . . . . . 90 GLY C . 7083 1
906 . 1 1 90 90 GLY CA C 13 43.093 0.05 . 1 . . . . . 90 GLY CA . 7083 1
907 . 1 1 90 90 GLY N N 15 105.33 0.1 . 1 . . . . . 90 GLY N . 7083 1
908 . 1 1 91 91 LYS H H 1 7.879 0.01 . 1 . . . . . 91 LYS H . 7083 1
909 . 1 1 91 91 LYS HA H 1 4.242 0.01 . 1 . . . . . 91 LYS HA . 7083 1
910 . 1 1 91 91 LYS HB2 H 1 1.400 0.01 . 1 . . . . . 91 LYS HB2 . 7083 1
911 . 1 1 91 91 LYS HG2 H 1 1.037 0.01 . 1 . . . . . 91 LYS HG2 . 7083 1
912 . 1 1 91 91 LYS HG3 H 1 1.079 0.01 . 1 . . . . . 91 LYS HG3 . 7083 1
913 . 1 1 91 91 LYS HD2 H 1 1.823 0.01 . 1 . . . . . 91 LYS HD2 . 7083 1
914 . 1 1 91 91 LYS HE2 H 1 2.737 0.01 . 1 . . . . . 91 LYS HE2 . 7083 1
915 . 1 1 91 91 LYS C C 13 172.76 0.1 . 1 . . . . . 91 LYS C . 7083 1
916 . 1 1 91 91 LYS CA C 13 51.978 0.05 . 1 . . . . . 91 LYS CA . 7083 1
917 . 1 1 91 91 LYS CB C 13 32.945 0.05 . 1 . . . . . 91 LYS CB . 7083 1
918 . 1 1 91 91 LYS N N 15 121.50 0.1 . 1 . . . . . 91 LYS N . 7083 1
919 . 1 1 92 92 THR H H 1 7.591 0.01 . 1 . . . . . 92 THR H . 7083 1
920 . 1 1 92 92 THR HA H 1 4.496 0.01 . 1 . . . . . 92 THR HA . 7083 1
921 . 1 1 92 92 THR HB H 1 3.366 0.01 . 1 . . . . . 92 THR HB . 7083 1
922 . 1 1 92 92 THR HG21 H 1 0.435 0.01 . 1 . . . . . 92 THR HG2 . 7083 1
923 . 1 1 92 92 THR HG22 H 1 0.435 0.01 . 1 . . . . . 92 THR HG2 . 7083 1
924 . 1 1 92 92 THR HG23 H 1 0.435 0.01 . 1 . . . . . 92 THR HG2 . 7083 1
925 . 1 1 92 92 THR C C 13 170.03 0.1 . 1 . . . . . 92 THR C . 7083 1
926 . 1 1 92 92 THR CA C 13 59.475 0.05 . 1 . . . . . 92 THR CA . 7083 1
927 . 1 1 92 92 THR CB C 13 67.855 0.05 . 1 . . . . . 92 THR CB . 7083 1
928 . 1 1 92 92 THR N N 15 115.60 0.1 . 1 . . . . . 92 THR N . 7083 1
929 . 1 1 93 93 TYR H H 1 9.229 0.01 . 1 . . . . . 93 TYR H . 7083 1
930 . 1 1 93 93 TYR HA H 1 4.538 0.01 . 1 . . . . . 93 TYR HA . 7083 1
931 . 1 1 93 93 TYR HB2 H 1 3.159 0.01 . 1 . . . . . 93 TYR HB2 . 7083 1
932 . 1 1 93 93 TYR HB3 H 1 2.398 0.01 . 1 . . . . . 93 TYR HB3 . 7083 1
933 . 1 1 93 93 TYR HD1 H 1 6.631 0.01 . 1 . . . . . 93 TYR HD1 . 7083 1
934 . 1 1 93 93 TYR HE1 H 1 6.306 0.01 . 1 . . . . . 93 TYR HE1 . 7083 1
935 . 1 1 93 93 TYR C C 13 171.32 0.1 . 1 . . . . . 93 TYR C . 7083 1
936 . 1 1 93 93 TYR CA C 13 53.600 0.05 . 1 . . . . . 93 TYR CA . 7083 1
937 . 1 1 93 93 TYR CB C 13 39.820 0.05 . 1 . . . . . 93 TYR CB . 7083 1
938 . 1 1 93 93 TYR N N 15 125.99 0.1 . 1 . . . . . 93 TYR N . 7083 1
939 . 1 1 94 94 TYR H H 1 8.828 0.01 . 1 . . . . . 94 TYR H . 7083 1
940 . 1 1 94 94 TYR HA H 1 5.494 0.01 . 1 . . . . . 94 TYR HA . 7083 1
941 . 1 1 94 94 TYR HB2 H 1 2.580 0.01 . 1 . . . . . 94 TYR HB2 . 7083 1
942 . 1 1 94 94 TYR HB3 H 1 2.501 0.01 . 1 . . . . . 94 TYR HB3 . 7083 1
943 . 1 1 94 94 TYR HD1 H 1 6.870 0.01 . 1 . . . . . 94 TYR HD1 . 7083 1
944 . 1 1 94 94 TYR HE1 H 1 6.459 0.01 . 1 . . . . . 94 TYR HE1 . 7083 1
945 . 1 1 94 94 TYR C C 13 175.35 0.1 . 1 . . . . . 94 TYR C . 7083 1
946 . 1 1 94 94 TYR CA C 13 54.310 0.05 . 1 . . . . . 94 TYR CA . 7083 1
947 . 1 1 94 94 TYR CB C 13 40.207 0.05 . 1 . . . . . 94 TYR CB . 7083 1
948 . 1 1 94 94 TYR N N 15 116.81 0.1 . 1 . . . . . 94 TYR N . 7083 1
949 . 1 1 95 95 ASP H H 1 8.761 0.01 . 1 . . . . . 95 ASP H . 7083 1
950 . 1 1 95 95 ASP HA H 1 5.070 0.01 . 1 . . . . . 95 ASP HA . 7083 1
951 . 1 1 95 95 ASP HB2 H 1 2.833 0.01 . 1 . . . . . 95 ASP HB2 . 7083 1
952 . 1 1 95 95 ASP HB3 H 1 2.722 0.01 . 1 . . . . . 95 ASP HB3 . 7083 1
953 . 1 1 95 95 ASP C C 13 174.27 0.1 . 1 . . . . . 95 ASP C . 7083 1
954 . 1 1 95 95 ASP CA C 13 52.193 0.05 . 1 . . . . . 95 ASP CA . 7083 1
955 . 1 1 95 95 ASP CB C 13 39.576 0.05 . 1 . . . . . 95 ASP CB . 7083 1
956 . 1 1 95 95 ASP N N 15 117.22 0.1 . 1 . . . . . 95 ASP N . 7083 1
957 . 1 1 96 96 ASN H H 1 8.383 0.01 . 1 . . . . . 96 ASN H . 7083 1
958 . 1 1 96 96 ASN HA H 1 4.797 0.01 . 1 . . . . . 96 ASN HA . 7083 1
959 . 1 1 96 96 ASN HB2 H 1 3.117 0.01 . 1 . . . . . 96 ASN HB2 . 7083 1
960 . 1 1 96 96 ASN HB3 H 1 1.936 0.01 . 1 . . . . . 96 ASN HB3 . 7083 1
961 . 1 1 96 96 ASN HD21 H 1 6.940 0.01 . 1 . . . . . 96 ASN HD21 . 7083 1
962 . 1 1 96 96 ASN HD22 H 1 6.588 0.01 . 1 . . . . . 96 ASN HD22 . 7083 1
963 . 1 1 96 96 ASN C C 13 173.35 0.1 . 1 . . . . . 96 ASN C . 7083 1
964 . 1 1 96 96 ASN CA C 13 47.822 0.05 . 1 . . . . . 96 ASN CA . 7083 1
965 . 1 1 96 96 ASN CB C 13 35.686 0.05 . 1 . . . . . 96 ASN CB . 7083 1
966 . 1 1 96 96 ASN N N 15 121.12 0.1 . 1 . . . . . 96 ASN N . 7083 1
967 . 1 1 96 96 ASN ND2 N 15 111.21 0.1 . 1 . . . . . 96 ASN ND2 . 7083 1
968 . 1 1 97 97 ASN H H 1 8.667 0.01 . 1 . . . . . 97 ASN H . 7083 1
969 . 1 1 97 97 ASN HA H 1 3.997 0.01 . 1 . . . . . 97 ASN HA . 7083 1
970 . 1 1 97 97 ASN HB2 H 1 2.102 0.01 . 1 . . . . . 97 ASN HB2 . 7083 1
971 . 1 1 97 97 ASN HB3 H 1 -0.090 0.01 . 1 . . . . . 97 ASN HB3 . 7083 1
972 . 1 1 97 97 ASN HD21 H 1 6.571 0.01 . 1 . . . . . 97 ASN HD21 . 7083 1
973 . 1 1 97 97 ASN HD22 H 1 6.474 0.01 . 1 . . . . . 97 ASN HD22 . 7083 1
974 . 1 1 97 97 ASN C C 13 173.96 0.1 . 1 . . . . . 97 ASN C . 7083 1
975 . 1 1 97 97 ASN CA C 13 50.700 0.05 . 1 . . . . . 97 ASN CA . 7083 1
976 . 1 1 97 97 ASN CB C 13 32.683 0.05 . 1 . . . . . 97 ASN CB . 7083 1
977 . 1 1 97 97 ASN N N 15 119.61 0.1 . 1 . . . . . 97 ASN N . 7083 1
978 . 1 1 97 97 ASN ND2 N 15 108.79 0.1 . 1 . . . . . 97 ASN ND2 . 7083 1
979 . 1 1 98 98 ASN H H 1 9.169 0.01 . 1 . . . . . 98 ASN H . 7083 1
980 . 1 1 98 98 ASN HA H 1 4.186 0.01 . 1 . . . . . 98 ASN HA . 7083 1
981 . 1 1 98 98 ASN HB2 H 1 2.493 0.01 . 1 . . . . . 98 ASN HB2 . 7083 1
982 . 1 1 98 98 ASN HB3 H 1 2.821 0.01 . 1 . . . . . 98 ASN HB3 . 7083 1
983 . 1 1 98 98 ASN HD21 H 1 7.425 0.01 . 1 . . . . . 98 ASN HD21 . 7083 1
984 . 1 1 98 98 ASN HD22 H 1 6.711 0.01 . 1 . . . . . 98 ASN HD22 . 7083 1
985 . 1 1 98 98 ASN C C 13 172.37 0.1 . 1 . . . . . 98 ASN C . 7083 1
986 . 1 1 98 98 ASN CA C 13 52.232 0.05 . 1 . . . . . 98 ASN CA . 7083 1
987 . 1 1 98 98 ASN CB C 13 34.889 0.05 . 1 . . . . . 98 ASN CB . 7083 1
988 . 1 1 98 98 ASN N N 15 116.79 0.1 . 1 . . . . . 98 ASN N . 7083 1
989 . 1 1 98 98 ASN ND2 N 15 113.38 0.1 . 1 . . . . . 98 ASN ND2 . 7083 1
990 . 1 1 99 99 SER H H 1 7.165 0.01 . 1 . . . . . 99 SER H . 7083 1
991 . 1 1 99 99 SER HA H 1 3.323 0.01 . 1 . . . . . 99 SER HA . 7083 1
992 . 1 1 99 99 SER HB2 H 1 3.660 0.01 . 1 . . . . . 99 SER HB2 . 7083 1
993 . 1 1 99 99 SER HB3 H 1 3.988 0.01 . 1 . . . . . 99 SER HB3 . 7083 1
994 . 1 1 99 99 SER C C 13 170.48 0.1 . 1 . . . . . 99 SER C . 7083 1
995 . 1 1 99 99 SER CA C 13 59.543 0.05 . 1 . . . . . 99 SER CA . 7083 1
996 . 1 1 99 99 SER N N 15 108.49 0.1 . 1 . . . . . 99 SER N . 7083 1
997 . 1 1 100 100 ALA H H 1 7.177 0.01 . 1 . . . . . 100 ALA H . 7083 1
998 . 1 1 100 100 ALA HA H 1 4.025 0.01 . 1 . . . . . 100 ALA HA . 7083 1
999 . 1 1 100 100 ALA HB1 H 1 1.322 0.01 . 1 . . . . . 100 ALA HB . 7083 1
1000 . 1 1 100 100 ALA HB2 H 1 1.322 0.01 . 1 . . . . . 100 ALA HB . 7083 1
1001 . 1 1 100 100 ALA HB3 H 1 1.322 0.01 . 1 . . . . . 100 ALA HB . 7083 1
1002 . 1 1 100 100 ALA C C 13 176.95 0.1 . 1 . . . . . 100 ALA C . 7083 1
1003 . 1 1 100 100 ALA CA C 13 51.344 0.05 . 1 . . . . . 100 ALA CA . 7083 1
1004 . 1 1 100 100 ALA CB C 13 18.135 0.05 . 1 . . . . . 100 ALA CB . 7083 1
1005 . 1 1 100 100 ALA N N 15 123.98 0.1 . 1 . . . . . 100 ALA N . 7083 1
1006 . 1 1 101 101 ASN H H 1 7.899 0.01 . 1 . . . . . 101 ASN H . 7083 1
1007 . 1 1 101 101 ASN HA H 1 3.542 0.01 . 1 . . . . . 101 ASN HA . 7083 1
1008 . 1 1 101 101 ASN HB2 H 1 2.503 0.01 . 1 . . . . . 101 ASN HB2 . 7083 1
1009 . 1 1 101 101 ASN HD21 H 1 6.957 0.01 . 1 . . . . . 101 ASN HD21 . 7083 1
1010 . 1 1 101 101 ASN HD22 H 1 6.309 0.01 . 1 . . . . . 101 ASN HD22 . 7083 1
1011 . 1 1 101 101 ASN C C 13 171.72 0.1 . 1 . . . . . 101 ASN C . 7083 1
1012 . 1 1 101 101 ASN CA C 13 52.649 0.05 . 1 . . . . . 101 ASN CA . 7083 1
1013 . 1 1 101 101 ASN CB C 13 36.478 0.05 . 1 . . . . . 101 ASN CB . 7083 1
1014 . 1 1 101 101 ASN N N 15 105.30 0.1 . 1 . . . . . 101 ASN N . 7083 1
1015 . 1 1 101 101 ASN ND2 N 15 111.51 0.1 . 1 . . . . . 101 ASN ND2 . 7083 1
1016 . 1 1 102 102 TYR H H 1 8.265 0.01 . 1 . . . . . 102 TYR H . 7083 1
1017 . 1 1 102 102 TYR HA H 1 4.175 0.01 . 1 . . . . . 102 TYR HA . 7083 1
1018 . 1 1 102 102 TYR HB2 H 1 1.767 0.01 . 1 . . . . . 102 TYR HB2 . 7083 1
1019 . 1 1 102 102 TYR HB3 H 1 0.482 0.01 . 1 . . . . . 102 TYR HB3 . 7083 1
1020 . 1 1 102 102 TYR HD1 H 1 6.667 0.01 . 1 . . . . . 102 TYR HD1 . 7083 1
1021 . 1 1 102 102 TYR HE1 H 1 6.138 0.01 . 1 . . . . . 102 TYR HE1 . 7083 1
1022 . 1 1 102 102 TYR C C 13 173.23 0.1 . 1 . . . . . 102 TYR C . 7083 1
1023 . 1 1 102 102 TYR CA C 13 56.832 0.05 . 1 . . . . . 102 TYR CA . 7083 1
1024 . 1 1 102 102 TYR CB C 13 35.776 0.05 . 1 . . . . . 102 TYR CB . 7083 1
1025 . 1 1 102 102 TYR N N 15 119.39 0.1 . 1 . . . . . 102 TYR N . 7083 1
1026 . 1 1 103 103 GLN H H 1 8.559 0.01 . 1 . . . . . 103 GLN H . 7083 1
1027 . 1 1 103 103 GLN HA H 1 4.326 0.01 . 1 . . . . . 103 GLN HA . 7083 1
1028 . 1 1 103 103 GLN HB2 H 1 1.821 0.01 . 1 . . . . . 103 GLN HB2 . 7083 1
1029 . 1 1 103 103 GLN HB3 H 1 1.779 0.01 . 1 . . . . . 103 GLN HB3 . 7083 1
1030 . 1 1 103 103 GLN HG2 H 1 2.218 0.01 . 1 . . . . . 103 GLN HG2 . 7083 1
1031 . 1 1 103 103 GLN HG3 H 1 2.020 0.01 . 1 . . . . . 103 GLN HG3 . 7083 1
1032 . 1 1 103 103 GLN HE21 H 1 6.665 0.01 . 1 . . . . . 103 GLN HE21 . 7083 1
1033 . 1 1 103 103 GLN HE22 H 1 6.990 0.01 . 1 . . . . . 103 GLN HE22 . 7083 1
1034 . 1 1 103 103 GLN C C 13 173.83 0.1 . 1 . . . . . 103 GLN C . 7083 1
1035 . 1 1 103 103 GLN CA C 13 51.953 0.05 . 1 . . . . . 103 GLN CA . 7083 1
1036 . 1 1 103 103 GLN CB C 13 27.007 0.05 . 1 . . . . . 103 GLN CB . 7083 1
1037 . 1 1 103 103 GLN N N 15 120.60 0.1 . 1 . . . . . 103 GLN N . 7083 1
1038 . 1 1 103 103 GLN NE2 N 15 115.98 0.1 . 1 . . . . . 103 GLN NE2 . 7083 1
1039 . 1 1 104 104 VAL H H 1 7.857 0.01 . 1 . . . . . 104 VAL H . 7083 1
1040 . 1 1 104 104 VAL HA H 1 4.148 0.01 . 1 . . . . . 104 VAL HA . 7083 1
1041 . 1 1 104 104 VAL HB H 1 1.416 0.01 . 1 . . . . . 104 VAL HB . 7083 1
1042 . 1 1 104 104 VAL HG11 H 1 0.573 0.01 . 1 . . . . . 104 VAL HG1 . 7083 1
1043 . 1 1 104 104 VAL HG12 H 1 0.573 0.01 . 1 . . . . . 104 VAL HG1 . 7083 1
1044 . 1 1 104 104 VAL HG13 H 1 0.573 0.01 . 1 . . . . . 104 VAL HG1 . 7083 1
1045 . 1 1 104 104 VAL HG21 H 1 0.325 0.01 . 1 . . . . . 104 VAL HG2 . 7083 1
1046 . 1 1 104 104 VAL HG22 H 1 0.325 0.01 . 1 . . . . . 104 VAL HG2 . 7083 1
1047 . 1 1 104 104 VAL HG23 H 1 0.325 0.01 . 1 . . . . . 104 VAL HG2 . 7083 1
1048 . 1 1 104 104 VAL C C 13 173.26 0.1 . 1 . . . . . 104 VAL C . 7083 1
1049 . 1 1 104 104 VAL CA C 13 60.406 0.05 . 1 . . . . . 104 VAL CA . 7083 1
1050 . 1 1 104 104 VAL CB C 13 30.011 0.05 . 1 . . . . . 104 VAL CB . 7083 1
1051 . 1 1 104 104 VAL N N 15 124.02 0.1 . 1 . . . . . 104 VAL N . 7083 1
1052 . 1 1 105 105 SER H H 1 8.323 0.01 . 1 . . . . . 105 SER H . 7083 1
1053 . 1 1 105 105 SER HA H 1 4.576 0.01 . 1 . . . . . 105 SER HA . 7083 1
1054 . 1 1 105 105 SER HB2 H 1 3.768 0.01 . 1 . . . . . 105 SER HB2 . 7083 1
1055 . 1 1 105 105 SER C C 13 171.40 0.1 . 1 . . . . . 105 SER C . 7083 1
1056 . 1 1 105 105 SER CA C 13 55.545 0.05 . 1 . . . . . 105 SER CA . 7083 1
1057 . 1 1 105 105 SER CB C 13 62.249 0.05 . 1 . . . . . 105 SER CB . 7083 1
1058 . 1 1 105 105 SER N N 15 121.40 0.1 . 1 . . . . . 105 SER N . 7083 1
1059 . 1 1 106 106 THR H H 1 7.830 0.01 . 1 . . . . . 106 THR H . 7083 1
1060 . 1 1 106 106 THR HA H 1 4.154 0.01 . 1 . . . . . 106 THR HA . 7083 1
1061 . 1 1 106 106 THR HB H 1 4.134 0.01 . 1 . . . . . 106 THR HB . 7083 1
1062 . 1 1 106 106 THR HG21 H 1 1.020 0.01 . 1 . . . . . 106 THR HG2 . 7083 1
1063 . 1 1 106 106 THR HG22 H 1 1.020 0.01 . 1 . . . . . 106 THR HG2 . 7083 1
1064 . 1 1 106 106 THR HG23 H 1 1.020 0.01 . 1 . . . . . 106 THR HG2 . 7083 1
1065 . 1 1 106 106 THR C C 13 176.79 0.1 . 1 . . . . . 106 THR C . 7083 1
1066 . 1 1 106 106 THR CA C 13 60.710 0.05 . 1 . . . . . 106 THR CA . 7083 1
1067 . 1 1 106 106 THR CB C 13 68.276 0.05 . 1 . . . . . 106 THR CB . 7083 1
1068 . 1 1 106 106 THR N N 15 119.88 0.1 . 1 . . . . . 106 THR N . 7083 1
stop_
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