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 27378
_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 0.001
_Assigned_chem_shift_list.Chem_shift_13C_err 0.011
_Assigned_chem_shift_list.Chem_shift_15N_err 0.01
_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
;
A designates that the subunit that contains this residue is bound to the bis-THF side of the inhibitor.
B designates that the subunit that contains this residue is bound to the aniline side of the inhibitor.
If blank, the assignment to bis-THF or aniline functional group part of the inhibitor is unknown.
;
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 27378 1
2 '3D HNCA' . . . 27378 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 $NMRPipe . . 27378 1
2 $NMRDraw . . 27378 1
3 $TopSpin . . 27378 1
4 $Analysis . . 27378 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 PRO CA C 13 62.023 0.011 . 6 . . . . . 1 Pro CA . 27378 1
2 . 1 1 2 2 GLN H H 1 8.537 0.001 . 6 . . . . . 2 Gln H . 27378 1
3 . 1 1 2 2 GLN CA C 13 55.549 0.011 . 6 . . . . . 2 Gln CA . 27378 1
4 . 1 1 2 2 GLN N N 15 120.354 0.01 . 6 . . . . . 2 Gln N . 27378 1
5 . 1 1 3 3 ILE H H 1 9.408 0.001 . 6 . . . . . 3 Ile H . 27378 1
6 . 1 1 3 3 ILE CA C 13 60.618 0.011 . 6 . . . . . 3 Ile CA . 27378 1
7 . 1 1 3 3 ILE N N 15 128.235 0.01 . 6 . . . . . 3 Ile N . 27378 1
8 . 1 1 4 4 THR H H 1 8.337 0.001 . 6 . . . . . 4 Thr H . 27378 1
9 . 1 1 4 4 THR CA C 13 60.778 0.011 . 6 . . . . . 4 Thr CA . 27378 1
10 . 1 1 4 4 THR N N 15 115.752 0.01 . 6 . . . . . 4 Thr N . 27378 1
11 . 1 1 5 5 LEU H H 1 9.15 0.001 . 6 . . . . . 5 Leu H . 27378 1
12 . 1 1 5 5 LEU CA C 13 54.094 0.011 . 6 . . . . . 5 Leu CA . 27378 1
13 . 1 1 5 5 LEU N N 15 116.833 0.01 . 6 . . . . . 5 Leu N . 27378 1
14 . 1 1 6 6 TRP H H 1 7.329 0.001 . 6 . . . . . 6 Trp H . 27378 1
15 . 1 1 6 6 TRP CA C 13 58.977 0.011 . 6 . . . . . 6 Trp CA . 27378 1
16 . 1 1 6 6 TRP N N 15 120.865 0.01 . 6 . . . . . 6 Trp N . 27378 1
17 . 1 1 7 7 LYS H H 1 7.458 0.001 . 6 . . . . . 7 Lys H . 27378 1
18 . 1 1 7 7 LYS CA C 13 53.494 0.011 . 6 . . . . . 7 Lys CA . 27378 1
19 . 1 1 7 7 LYS N N 15 115.14 0.01 . 6 . . . . . 7 Lys N . 27378 1
20 . 1 1 8 8 ARG H H 1 8.834 0.001 . 6 . . . . . 8 Arg H . 27378 1
21 . 1 1 8 8 ARG CA C 13 56.112 0.011 . 6 . . . . . 8 Arg CA . 27378 1
22 . 1 1 8 8 ARG N N 15 120.51 0.01 . 6 . . . . . 8 Arg N . 27378 1
23 . 1 1 9 9 PRO CA C 13 61.706 0.011 . 6 . . . . . 9 Pro CA . 27378 1
24 . 1 1 10 10 LEU H H 1 7.612 0.001 . 6 . . . . . 10 Leu H . 27378 1
25 . 1 1 10 10 LEU CA C 13 53.635 0.011 . 6 . . . . . 10 Leu CA . 27378 1
26 . 1 1 10 10 LEU N N 15 126.975 0.01 . 6 . . . . . 10 Leu N . 27378 1
27 . 1 1 11 11 VAL H H 1 9.169 0.001 . 6 . . . . . 11 Val H . 27378 1
28 . 1 1 11 11 VAL CA C 13 58.663 0.011 . 6 . . . . . 11 Val CA . 27378 1
29 . 1 1 11 11 VAL N N 15 120.076 0.01 . 6 . . . . . 11 Val N . 27378 1
30 . 1 1 12 12 THR H H 1 8.522 0.001 . 6 . . . . . 12 Thr H . 27378 1
31 . 1 1 12 12 THR CA C 13 62.765 0.011 . 6 . . . . . 12 Thr CA . 27378 1
32 . 1 1 12 12 THR N N 15 116.18 0.01 . 6 . . . . . 12 Thr N . 27378 1
33 . 1 1 13 13 ILE H H 1 9.305 0.001 . 6 . . . . . 13 Ile H . 27378 1
34 . 1 1 13 13 ILE CA C 13 57.994 0.011 . 6 . . . . . 13 Ile CA . 27378 1
35 . 1 1 13 13 ILE N N 15 121.05 0.01 . 6 . . . . . 13 Ile N . 27378 1
36 . 1 1 14 14 ARG H H 1 8.59 0.001 . 6 . . . . . 14 Arg H . 27378 1
37 . 1 1 14 14 ARG CA C 13 54.656 0.011 . 6 . . . . . 14 Arg CA . 27378 1
38 . 1 1 14 14 ARG N N 15 120.572 0.01 . 6 . . . . . 14 Arg N . 27378 1
39 . 1 1 15 15 ILE H H 1 8.908 0.001 . 6 . . . . . 15 Ile H . 27378 1
40 . 1 1 15 15 ILE CA C 13 59.101 0.011 . 6 . . . . . 15 Ile CA . 27378 1
41 . 1 1 15 15 ILE N N 15 124.82 0.01 . 6 . . . . . 15 Ile N . 27378 1
42 . 1 1 16 16 GLY H H 1 9.729 0.001 . 6 . . . . . 16 Gly H . 27378 1
43 . 1 1 16 16 GLY CA C 13 46.909 0.011 . 6 . . . . . 16 Gly CA . 27378 1
44 . 1 1 16 16 GLY N N 15 118.144 0.01 . 6 . . . . . 16 Gly N . 27378 1
45 . 1 1 17 17 GLY H H 1 8.765 0.001 . 6 . . . . . 17 Gly H . 27378 1
46 . 1 1 17 17 GLY CA C 13 45.036 0.011 . 6 . . . . . 17 Gly CA . 27378 1
47 . 1 1 17 17 GLY N N 15 105.52 0.01 . 6 . . . . . 17 Gly N . 27378 1
48 . 1 1 18 18 GLN H H 1 8.003 0.001 . 6 . . . . . 18 Gln H . 27378 1
49 . 1 1 18 18 GLN CA C 13 54.246 0.011 . 6 . . . . . 18 Gln CA . 27378 1
50 . 1 1 18 18 GLN N N 15 119.947 0.01 . 6 . . . . . 18 Gln N . 27378 1
51 . 1 1 19 19 LEU H H 1 8.461 0.001 . 6 . . . . . 19 Leu H . 27378 1
52 . 1 1 19 19 LEU CA C 13 54.151 0.011 . 6 . . . . . 19 Leu CA . 27378 1
53 . 1 1 19 19 LEU N N 15 123.376 0.01 . 6 . . . . . 19 Leu N . 27378 1
54 . 1 1 20 20 LYS H H 1 8.982 0.001 . 6 . . . . . 20 Lys H . 27378 1
55 . 1 1 20 20 LYS CA C 13 54.117 0.011 . 6 . . . . . 20 Lys CA . 27378 1
56 . 1 1 20 20 LYS N N 15 123.227 0.01 . 6 . . . . . 20 Lys N . 27378 1
57 . 1 1 21 21 GLU H H 1 8.654 0.001 . 6 . . . . . 21 Glu H . 27378 1
58 . 1 1 21 21 GLU CA C 13 55.093 0.011 . 6 . . . . . 21 Glu CA . 27378 1
59 . 1 1 21 21 GLU N N 15 120.64 0.01 . 6 . . . . . 21 Glu N . 27378 1
60 . 1 1 22 22 ALA H H 1 9.31 0.001 . 1 . . . . . 22 Ala H A 27378 1
61 . 1 1 22 22 ALA CA C 13 50.705 0.011 . 1 . . . . . 22 Ala CA A 27378 1
62 . 1 1 22 22 ALA N N 15 125.548 0.01 . 1 . . . . . 22 Ala N A 27378 1
63 . 1 1 23 23 LEU H H 1 8.776 0.001 . 1 . . . . . 23 Leu H A 27378 1
64 . 1 1 23 23 LEU CA C 13 53.259 0.011 . 1 . . . . . 23 Leu CA A 27378 1
65 . 1 1 23 23 LEU N N 15 121.888 0.01 . 1 . . . . . 23 Leu N A 27378 1
66 . 1 1 24 24 LEU H H 1 8.411 0.001 . 1 . . . . . 24 Leu H A 27378 1
67 . 1 1 24 24 LEU CA C 13 55.542 0.011 . 1 . . . . . 24 Leu CA A 27378 1
68 . 1 1 24 24 LEU N N 15 125.341 0.01 . 1 . . . . . 24 Leu N A 27378 1
69 . 1 1 25 25 ASP H H 1 8.698 0.001 . 1 . . . . . 25 Asp H A 27378 1
70 . 1 1 25 25 ASP CA C 13 52.264 0.011 . 1 . . . . . 25 Asp CA A 27378 1
71 . 1 1 25 25 ASP N N 15 128.875 0.01 . 1 . . . . . 25 Asp N A 27378 1
72 . 1 1 26 26 THR H H 1 8.215 0.001 . 1 . . . . . 26 Thr H A 27378 1
73 . 1 1 26 26 THR CA C 13 65.528 0.011 . 1 . . . . . 26 Thr CA A 27378 1
74 . 1 1 26 26 THR N N 15 111.071 0.01 . 1 . . . . . 26 Thr N A 27378 1
75 . 1 1 27 27 GLY H H 1 7.821 0.001 . 1 . . . . . 27 Gly H A 27378 1
76 . 1 1 27 27 GLY CA C 13 45.34 0.011 . 1 . . . . . 27 Gly CA A 27378 1
77 . 1 1 27 27 GLY N N 15 108.859 0.01 . 1 . . . . . 27 Gly N A 27378 1
78 . 1 1 28 28 ALA H H 1 7.581 0.001 . 1 . . . . . 28 Ala H A 27378 1
79 . 1 1 28 28 ALA CA C 13 50.014 0.011 . 1 . . . . . 28 Ala CA A 27378 1
80 . 1 1 28 28 ALA N N 15 126.505 0.01 . 1 . . . . . 28 Ala N A 27378 1
81 . 1 1 29 29 ASP H H 1 8.688 0.001 . 1 . . . . . 29 Asp H A 27378 1
82 . 1 1 29 29 ASP CA C 13 57.693 0.011 . 1 . . . . . 29 Asp CA A 27378 1
83 . 1 1 29 29 ASP N N 15 125.937 0.01 . 1 . . . . . 29 Asp N A 27378 1
84 . 1 1 30 30 ASP H H 1 7.602 0.001 . 1 . . . . . 30 Asp H A 27378 1
85 . 1 1 30 30 ASP CA C 13 52.877 0.011 . 1 . . . . . 30 Asp CA A 27378 1
86 . 1 1 30 30 ASP N N 15 115.638 0.01 . 1 . . . . . 30 Asp N A 27378 1
87 . 1 1 31 31 THR H H 1 8.253 0.001 . 1 . . . . . 31 Thr H A 27378 1
88 . 1 1 31 31 THR CA C 13 63.088 0.011 . 1 . . . . . 31 Thr CA A 27378 1
89 . 1 1 31 31 THR N N 15 117.133 0.01 . 1 . . . . . 31 Thr N A 27378 1
90 . 1 1 32 32 VAL H H 1 8.318 0.001 . 1 . . . . . 32 Val H A 27378 1
91 . 1 1 32 32 VAL CA C 13 59.989 0.011 . 1 . . . . . 32 Val CA A 27378 1
92 . 1 1 32 32 VAL N N 15 128.12 0.01 . 1 . . . . . 32 Val N A 27378 1
93 . 1 1 33 33 ILE H H 1 9.245 0.001 . 1 . . . . . 33 Ile H A 27378 1
94 . 1 1 33 33 ILE CA C 13 57.138 0.011 . 1 . . . . . 33 Ile CA A 27378 1
95 . 1 1 33 33 ILE N N 15 125.942 0.01 . 1 . . . . . 33 Ile N A 27378 1
96 . 1 1 34 34 GLU H H 1 8.064 0.001 . 1 . . . . . 34 Glu H A 27378 1
97 . 1 1 34 34 GLU CA C 13 55.223 0.011 . 1 . . . . . 34 Glu CA A 27378 1
98 . 1 1 34 34 GLU N N 15 120.019 0.01 . 1 . . . . . 34 Glu N A 27378 1
99 . 1 1 35 35 GLU H H 1 7.54 0.001 . 1 . . . . . 35 Glu H A 27378 1
100 . 1 1 35 35 GLU CA C 13 58.163 0.011 . 1 . . . . . 35 Glu CA A 27378 1
101 . 1 1 35 35 GLU N N 15 115.073 0.01 . 1 . . . . . 35 Glu N A 27378 1
102 . 1 1 36 36 MET H H 1 6.979 0.001 . 1 . . . . . 36 Met H A 27378 1
103 . 1 1 36 36 MET CA C 13 54.708 0.011 . 1 . . . . . 36 Met CA A 27378 1
104 . 1 1 36 36 MET N N 15 120.515 0.01 . 1 . . . . . 36 Met N A 27378 1
105 . 1 1 37 37 ASN H H 1 8.631 0.001 . 6 . . . . . 37 Asn H . 27378 1
106 . 1 1 37 37 ASN CA C 13 52.602 0.011 . 6 . . . . . 37 Asn CA . 27378 1
107 . 1 1 37 37 ASN N N 15 118.687 0.01 . 6 . . . . . 37 Asn N . 27378 1
108 . 1 1 38 38 LEU H H 1 7.261 0.001 . 6 . . . . . 38 Leu H . 27378 1
109 . 1 1 38 38 LEU CA C 13 51.844 0.011 . 6 . . . . . 38 Leu CA . 27378 1
110 . 1 1 38 38 LEU N N 15 124.555 0.01 . 6 . . . . . 38 Leu N . 27378 1
111 . 1 1 39 39 PRO CA C 13 62.677 0.011 . 6 . . . . . 39 Pro CA . 27378 1
112 . 1 1 40 40 GLY H H 1 8.381 0.001 . 6 . . . . . 40 Gly H . 27378 1
113 . 1 1 40 40 GLY CA C 13 44.301 0.011 . 6 . . . . . 40 Gly CA . 27378 1
114 . 1 1 40 40 GLY N N 15 106.078 0.01 . 6 . . . . . 40 Gly N . 27378 1
115 . 1 1 41 41 LYS H H 1 8.399 0.001 . 6 . . . . . 41 Lys H . 27378 1
116 . 1 1 41 41 LYS CA C 13 56.236 0.011 . 6 . . . . . 41 Lys CA . 27378 1
117 . 1 1 41 41 LYS N N 15 119.167 0.01 . 6 . . . . . 41 Lys N . 27378 1
118 . 1 1 42 42 TRP H H 1 7.406 0.001 . 6 . . . . . 42 Trp H . 27378 1
119 . 1 1 42 42 TRP CA C 13 53.898 0.011 . 6 . . . . . 42 Trp CA . 27378 1
120 . 1 1 42 42 TRP N N 15 118.258 0.01 . 6 . . . . . 42 Trp N . 27378 1
121 . 1 1 43 43 LYS H H 1 8.353 0.001 . 6 . . . . . 43 Lys H . 27378 1
122 . 1 1 43 43 LYS CA C 13 52.884 0.011 . 6 . . . . . 43 Lys CA . 27378 1
123 . 1 1 43 43 LYS N N 15 117.96 0.01 . 6 . . . . . 43 Lys N . 27378 1
124 . 1 1 44 44 PRO CA C 13 62.935 0.011 . 6 . . . . . 44 Pro CA . 27378 1
125 . 1 1 45 45 LYS H H 1 8.546 0.001 . 1 . . . . . 45 Lys H A 27378 1
126 . 1 1 45 45 LYS CA C 13 55.51 0.011 . 1 . . . . . 45 Lys CA A 27378 1
127 . 1 1 45 45 LYS N N 15 121.692 0.01 . 1 . . . . . 45 Lys N A 27378 1
128 . 1 1 46 46 MET H H 1 8.504 0.001 . 1 . . . . . 46 Met H A 27378 1
129 . 1 1 46 46 MET CA C 13 53.741 0.011 . 1 . . . . . 46 Met CA A 27378 1
130 . 1 1 46 46 MET N N 15 121.599 0.01 . 1 . . . . . 46 Met N A 27378 1
131 . 1 1 47 47 ILE H H 1 8.871 0.001 . 1 . . . . . 47 Ile H A 27378 1
132 . 1 1 47 47 ILE CA C 13 59.048 0.011 . 1 . . . . . 47 Ile CA A 27378 1
133 . 1 1 47 47 ILE N N 15 118.026 0.01 . 1 . . . . . 47 Ile N A 27378 1
134 . 1 1 48 48 GLY H H 1 8.294 0.001 . 1 . . . . . 48 Gly H A 27378 1
135 . 1 1 48 48 GLY CA C 13 44.088 0.011 . 1 . . . . . 48 Gly CA A 27378 1
136 . 1 1 48 48 GLY N N 15 111.656 0.01 . 1 . . . . . 48 Gly N A 27378 1
137 . 1 1 49 49 GLY H H 1 7.501 0.001 . 1 . . . . . 49 Gly H A 27378 1
138 . 1 1 49 49 GLY CA C 13 43.606 0.011 . 1 . . . . . 49 Gly CA A 27378 1
139 . 1 1 49 49 GLY N N 15 109.001 0.01 . 1 . . . . . 49 Gly N A 27378 1
140 . 1 1 50 50 ILE H H 1 8.795 0.001 . 1 . . . . . 50 Ile H A 27378 1
141 . 1 1 50 50 ILE CA C 13 64.074 0.011 . 1 . . . . . 50 Ile CA A 27378 1
142 . 1 1 50 50 ILE N N 15 123.232 0.01 . 1 . . . . . 50 Ile N A 27378 1
143 . 1 1 51 51 GLY H H 1 7.782 0.001 . 1 . . . . . 51 Gly H A 27378 1
144 . 1 1 51 51 GLY N N 15 103.351 0.01 . 1 . . . . . 51 Gly N A 27378 1
145 . 1 1 52 52 GLY H H 1 6.904 0.001 . 1 . . . . . 52 Gly H A 27378 1
146 . 1 1 52 52 GLY CA C 13 44.15 0.011 . 1 . . . . . 52 Gly CA A 27378 1
147 . 1 1 52 52 GLY N N 15 105.902 0.01 . 1 . . . . . 52 Gly N A 27378 1
148 . 1 1 53 53 PHE H H 1 8.24 0.001 . 1 . . . . . 53 Phe H A 27378 1
149 . 1 1 53 53 PHE CA C 13 56.435 0.011 . 1 . . . . . 53 Phe CA A 27378 1
150 . 1 1 53 53 PHE N N 15 118.675 0.01 . 1 . . . . . 53 Phe N A 27378 1
151 . 1 1 54 54 ILE H H 1 8.998 0.001 . 1 . . . . . 54 Ile H A 27378 1
152 . 1 1 54 54 ILE CA C 13 59.654 0.011 . 1 . . . . . 54 Ile CA A 27378 1
153 . 1 1 54 54 ILE N N 15 112.997 0.01 . 1 . . . . . 54 Ile N A 27378 1
154 . 1 1 55 55 LYS H H 1 8.538 0.001 . 1 . . . . . 55 Lys H A 27378 1
155 . 1 1 55 55 LYS CA C 13 56.152 0.011 . 1 . . . . . 55 Lys CA A 27378 1
156 . 1 1 55 55 LYS N N 15 123.875 0.01 . 1 . . . . . 55 Lys N A 27378 1
157 . 1 1 56 56 VAL H H 1 8.966 0.001 . 1 . . . . . 56 Val H A 27378 1
158 . 1 1 56 56 VAL CA C 13 58.024 0.011 . 1 . . . . . 56 Val CA A 27378 1
159 . 1 1 56 56 VAL N N 15 115.537 0.01 . 1 . . . . . 56 Val N A 27378 1
160 . 1 1 57 57 ARG H H 1 8.845 0.001 . 1 . . . . . 57 Arg H A 27378 1
161 . 1 1 57 57 ARG CA C 13 55.559 0.011 . 1 . . . . . 57 Arg CA A 27378 1
162 . 1 1 57 57 ARG N N 15 118.936 0.01 . 1 . . . . . 57 Arg N A 27378 1
163 . 1 1 58 58 GLN H H 1 9.666 0.001 . 1 . . . . . 58 Gln H A 27378 1
164 . 1 1 58 58 GLN CA C 13 55.785 0.011 . 1 . . . . . 58 Gln CA A 27378 1
165 . 1 1 58 58 GLN N N 15 123.853 0.01 . 1 . . . . . 58 Gln N A 27378 1
166 . 1 1 59 59 TYR H H 1 9.159 0.001 . 1 . . . . . 59 Tyr H A 27378 1
167 . 1 1 59 59 TYR CA C 13 57.314 0.011 . 1 . . . . . 59 Tyr CA A 27378 1
168 . 1 1 59 59 TYR N N 15 129.164 0.01 . 1 . . . . . 59 Tyr N A 27378 1
169 . 1 1 60 60 ASP H H 1 8.919 0.001 . 1 . . . . . 60 Asp H A 27378 1
170 . 1 1 60 60 ASP CA C 13 53.77 0.011 . 1 . . . . . 60 Asp CA A 27378 1
171 . 1 1 60 60 ASP N N 15 121.091 0.01 . 1 . . . . . 60 Asp N A 27378 1
172 . 1 1 61 61 GLN H H 1 8.986 0.001 . 1 . . . . . 61 Gln H A 27378 1
173 . 1 1 61 61 GLN CA C 13 56.289 0.011 . 1 . . . . . 61 Gln CA A 27378 1
174 . 1 1 61 61 GLN N N 15 114.245 0.01 . 1 . . . . . 61 Gln N A 27378 1
175 . 1 1 62 62 ILE H H 1 8.767 0.001 . 1 . . . . . 62 Ile H A 27378 1
176 . 1 1 62 62 ILE CA C 13 55.239 0.011 . 1 . . . . . 62 Ile CA A 27378 1
177 . 1 1 62 62 ILE N N 15 122.206 0.01 . 1 . . . . . 62 Ile N A 27378 1
178 . 1 1 63 63 PRO CA C 13 61.853 0.011 . 6 . . . . . 63 Pro CA . 27378 1
179 . 1 1 64 64 ILE H H 1 8.838 0.001 . 6 . . . . . 64 Ile H . 27378 1
180 . 1 1 64 64 ILE CA C 13 59.551 0.011 . 6 . . . . . 64 Ile CA . 27378 1
181 . 1 1 64 64 ILE N N 15 123.18 0.01 . 6 . . . . . 64 Ile N . 27378 1
182 . 1 1 65 65 GLU H H 1 8.273 0.001 . 6 . . . . . 65 Glu H . 27378 1
183 . 1 1 65 65 GLU CA C 13 54.216 0.011 . 6 . . . . . 65 Glu CA . 27378 1
184 . 1 1 65 65 GLU N N 15 125.432 0.01 . 6 . . . . . 65 Glu N . 27378 1
185 . 1 1 66 66 ILE H H 1 9.147 0.001 . 6 . . . . . 66 Ile H . 27378 1
186 . 1 1 66 66 ILE CA C 13 60.32 0.011 . 6 . . . . . 66 Ile CA . 27378 1
187 . 1 1 66 66 ILE N N 15 125.006 0.01 . 6 . . . . . 66 Ile N . 27378 1
188 . 1 1 67 67 ALA H H 1 9.012 0.001 . 6 . . . . . 67 Ala H . 27378 1
189 . 1 1 67 67 ALA CA C 13 53.222 0.011 . 6 . . . . . 67 Ala CA . 27378 1
190 . 1 1 67 67 ALA N N 15 131.092 0.01 . 6 . . . . . 67 Ala N . 27378 1
191 . 1 1 68 68 GLY H H 1 8.677 0.001 . 6 . . . . . 68 Gly H . 27378 1
192 . 1 1 68 68 GLY CA C 13 45.412 0.011 . 6 . . . . . 68 Gly CA . 27378 1
193 . 1 1 68 68 GLY N N 15 103.047 0.01 . 6 . . . . . 68 Gly N . 27378 1
194 . 1 1 69 69 HIS H H 1 8.305 0.001 . 6 . . . . . 69 His H . 27378 1
195 . 1 1 69 69 HIS CA C 13 54.524 0.011 . 6 . . . . . 69 His CA . 27378 1
196 . 1 1 69 69 HIS N N 15 119.449 0.01 . 6 . . . . . 69 His N . 27378 1
197 . 1 1 70 70 LYS H H 1 8.986 0.001 . 6 . . . . . 70 Lys H . 27378 1
198 . 1 1 70 70 LYS CA C 13 57.74 0.011 . 6 . . . . . 70 Lys CA . 27378 1
199 . 1 1 70 70 LYS N N 15 125.534 0.01 . 6 . . . . . 70 Lys N . 27378 1
200 . 1 1 71 71 ALA H H 1 8.808 0.001 . 6 . . . . . 71 Ala H . 27378 1
201 . 1 1 71 71 ALA CA C 13 50.792 0.011 . 6 . . . . . 71 Ala CA . 27378 1
202 . 1 1 71 71 ALA N N 15 126.334 0.01 . 6 . . . . . 71 Ala N . 27378 1
203 . 1 1 72 72 ILE H H 1 8.463 0.001 . 6 . . . . . 72 Ile H . 27378 1
204 . 1 1 72 72 ILE CA C 13 60.001 0.011 . 6 . . . . . 72 Ile CA . 27378 1
205 . 1 1 72 72 ILE N N 15 119.464 0.01 . 6 . . . . . 72 Ile N . 27378 1
206 . 1 1 73 73 GLY H H 1 8.449 0.001 . 6 . . . . . 73 Gly H . 27378 1
207 . 1 1 73 73 GLY CA C 13 46.018 0.011 . 6 . . . . . 73 Gly CA . 27378 1
208 . 1 1 73 73 GLY N N 15 112.24 0.01 . 6 . . . . . 73 Gly N . 27378 1
209 . 1 1 74 74 THR H H 1 8.73 0.001 . 6 . . . . . 74 Thr H . 27378 1
210 . 1 1 74 74 THR CA C 13 63.457 0.011 . 6 . . . . . 74 Thr CA . 27378 1
211 . 1 1 74 74 THR N N 15 118.53 0.01 . 6 . . . . . 74 Thr N . 27378 1
212 . 1 1 75 75 VAL H H 1 9.241 0.001 . 6 . . . . . 75 Val H . 27378 1
213 . 1 1 75 75 VAL CA C 13 61.458 0.011 . 6 . . . . . 75 Val CA . 27378 1
214 . 1 1 75 75 VAL N N 15 126.683 0.01 . 6 . . . . . 75 Val N . 27378 1
215 . 1 1 76 76 LEU H H 1 8.187 0.001 . 6 . . . . . 76 Leu H . 27378 1
216 . 1 1 76 76 LEU CA C 13 52.318 0.011 . 6 . . . . . 76 Leu CA . 27378 1
217 . 1 1 76 76 LEU N N 15 125.135 0.01 . 6 . . . . . 76 Leu N . 27378 1
218 . 1 1 77 77 VAL H H 1 9.104 0.001 . 6 . . . . . 77 Val H . 27378 1
219 . 1 1 77 77 VAL CA C 13 59.881 0.011 . 6 . . . . . 77 Val CA . 27378 1
220 . 1 1 77 77 VAL N N 15 121.368 0.01 . 6 . . . . . 77 Val N . 27378 1
221 . 1 1 78 78 GLY H H 1 8.96 0.001 . 6 . . . . . 78 Gly H . 27378 1
222 . 1 1 78 78 GLY CA C 13 45.825 0.011 . 6 . . . . . 78 Gly CA . 27378 1
223 . 1 1 78 78 GLY N N 15 113.717 0.01 . 6 . . . . . 78 Gly N . 27378 1
224 . 1 1 79 79 PRO CA C 13 63.266 0.011 . 6 . . . . . 79 Pro CA . 27378 1
225 . 1 1 80 80 THR H H 1 8.324 0.001 . 6 . . . . . 80 Thr H . 27378 1
226 . 1 1 80 80 THR CA C 13 56.44 0.011 . 6 . . . . . 80 Thr CA . 27378 1
227 . 1 1 80 80 THR N N 15 119.115 0.01 . 6 . . . . . 80 Thr N . 27378 1
228 . 1 1 81 81 PRO CA C 13 63.963 0.011 . 6 . . . . . 81 Pro CA . 27378 1
229 . 1 1 82 82 VAL H H 1 7.15 0.001 . 1 . . . . . 82 Val H A 27378 1
230 . 1 1 82 82 VAL CA C 13 60.069 0.011 . 1 . . . . . 82 Val CA A 27378 1
231 . 1 1 82 82 VAL N N 15 115.639 0.01 . 1 . . . . . 82 Val N A 27378 1
232 . 1 1 83 83 ASN H H 1 8.616 0.001 . 1 . . . . . 83 Asn H A 27378 1
233 . 1 1 83 83 ASN CA C 13 53.753 0.011 . 1 . . . . . 83 Asn CA A 27378 1
234 . 1 1 83 83 ASN N N 15 121.57 0.01 . 1 . . . . . 83 Asn N A 27378 1
235 . 1 1 84 84 ILE H H 1 9.418 0.001 . 1 . . . . . 84 Ile H A 27378 1
236 . 1 1 84 84 ILE CA C 13 59.774 0.011 . 1 . . . . . 84 Ile CA A 27378 1
237 . 1 1 84 84 ILE N N 15 120.807 0.01 . 1 . . . . . 84 Ile N A 27378 1
238 . 1 1 85 85 ILE H H 1 8.737 0.001 . 1 . . . . . 85 Ile H A 27378 1
239 . 1 1 85 85 ILE CA C 13 57.852 0.011 . 1 . . . . . 85 Ile CA A 27378 1
240 . 1 1 85 85 ILE N N 15 122.101 0.01 . 1 . . . . . 85 Ile N A 27378 1
241 . 1 1 86 86 GLY H H 1 8.155 0.001 . 1 . . . . . 86 Gly H A 27378 1
242 . 1 1 86 86 GLY CA C 13 43.444 0.011 . 1 . . . . . 86 Gly CA A 27378 1
243 . 1 1 86 86 GLY N N 15 113.748 0.01 . 1 . . . . . 86 Gly N A 27378 1
244 . 1 1 87 87 ARG H H 1 9.391 0.001 . 1 . . . . . 87 Arg H A 27378 1
245 . 1 1 87 87 ARG CA C 13 61.305 0.011 . 1 . . . . . 87 Arg CA A 27378 1
246 . 1 1 87 87 ARG N N 15 116.763 0.01 . 1 . . . . . 87 Arg N A 27378 1
247 . 1 1 88 88 ASN H H 1 7.959 0.001 . 1 . . . . . 88 Asn H A 27378 1
248 . 1 1 88 88 ASN CA C 13 56.963 0.011 . 1 . . . . . 88 Asn CA A 27378 1
249 . 1 1 88 88 ASN N N 15 115.957 0.01 . 1 . . . . . 88 Asn N A 27378 1
250 . 1 1 89 89 LEU H H 1 6.885 0.001 . 1 . . . . . 89 Leu H A 27378 1
251 . 1 1 89 89 LEU CA C 13 55.193 0.011 . 1 . . . . . 89 Leu CA A 27378 1
252 . 1 1 89 89 LEU N N 15 116.401 0.01 . 1 . . . . . 89 Leu N A 27378 1
253 . 1 1 90 90 LEU H H 1 8.276 0.001 . 6 . . . . . 90 Leu H . 27378 1
254 . 1 1 90 90 LEU CA C 13 57.845 0.011 . 6 . . . . . 90 Leu CA . 27378 1
255 . 1 1 90 90 LEU N N 15 120.103 0.01 . 6 . . . . . 90 Leu N . 27378 1
256 . 1 1 91 91 THR H H 1 7.85 0.001 . 6 . . . . . 91 Thr H . 27378 1
257 . 1 1 91 91 THR CA C 13 63.564 0.011 . 6 . . . . . 91 Thr CA . 27378 1
258 . 1 1 91 91 THR N N 15 106.146 0.01 . 6 . . . . . 91 Thr N . 27378 1
259 . 1 1 92 92 GLN H H 1 6.65 0.001 . 6 . . . . . 92 Gln H . 27378 1
260 . 1 1 92 92 GLN CA C 13 57.74 0.011 . 6 . . . . . 92 Gln CA . 27378 1
261 . 1 1 92 92 GLN N N 15 120.131 0.01 . 6 . . . . . 92 Gln N . 27378 1
262 . 1 1 93 93 ILE H H 1 6.932 0.001 . 6 . . . . . 93 Ile H . 27378 1
263 . 1 1 93 93 ILE CA C 13 60.465 0.011 . 6 . . . . . 93 Ile CA . 27378 1
264 . 1 1 93 93 ILE N N 15 108.593 0.01 . 6 . . . . . 93 Ile N . 27378 1
265 . 1 1 94 94 GLY H H 1 7.218 0.001 . 6 . . . . . 94 Gly H . 27378 1
266 . 1 1 94 94 GLY CA C 13 45.951 0.011 . 6 . . . . . 94 Gly CA . 27378 1
267 . 1 1 94 94 GLY N N 15 108.169 0.01 . 6 . . . . . 94 Gly N . 27378 1
268 . 1 1 95 95 ALA H H 1 7.529 0.001 . 6 . . . . . 95 Ala H . 27378 1
269 . 1 1 95 95 ALA CA C 13 51.421 0.011 . 6 . . . . . 95 Ala CA . 27378 1
270 . 1 1 95 95 ALA N N 15 120.43 0.01 . 6 . . . . . 95 Ala N . 27378 1
271 . 1 1 96 96 THR H H 1 8.991 0.001 . 6 . . . . . 96 Thr H . 27378 1
272 . 1 1 96 96 THR CA C 13 59.365 0.011 . 6 . . . . . 96 Thr CA . 27378 1
273 . 1 1 96 96 THR N N 15 108.994 0.01 . 6 . . . . . 96 Thr N . 27378 1
274 . 1 1 97 97 LEU H H 1 8.564 0.001 . 6 . . . . . 97 Leu H . 27378 1
275 . 1 1 97 97 LEU CA C 13 53.349 0.011 . 6 . . . . . 97 Leu CA . 27378 1
276 . 1 1 97 97 LEU N N 15 121.217 0.01 . 6 . . . . . 97 Leu N . 27378 1
277 . 1 1 98 98 ASN H H 1 8.911 0.001 . 6 . . . . . 98 Asn H . 27378 1
278 . 1 1 98 98 ASN CA C 13 52.845 0.011 . 6 . . . . . 98 Asn CA . 27378 1
279 . 1 1 98 98 ASN N N 15 121.648 0.01 . 6 . . . . . 98 Asn N . 27378 1
280 . 1 1 99 99 PHE H H 1 8.005 0.001 . 6 . . . . . 99 Phe H . 27378 1
281 . 1 1 99 99 PHE CA C 13 58.904 0.011 . 6 . . . . . 99 Phe CA . 27378 1
282 . 1 1 99 99 PHE N N 15 122.07 0.01 . 6 . . . . . 99 Phe N . 27378 1
283 . 2 1 2 2 GLN CA C 13 55.469 0.011 . 6 . . . . . 2 Gln CA . 27378 1
284 . 2 1 3 3 ILE H H 1 9.478 0.001 . 6 . . . . . 3 Ile H . 27378 1
285 . 2 1 3 3 ILE CA C 13 55.481 0.011 . 6 . . . . . 3 Ile CA . 27378 1
286 . 2 1 3 3 ILE N N 15 128.103 0.01 . 6 . . . . . 3 Ile N . 27378 1
287 . 2 1 4 4 THR H H 1 8.337 0.001 . 6 . . . . . 4 Thr H . 27378 1
288 . 2 1 4 4 THR CA C 13 60.813 0.011 . 6 . . . . . 4 Thr CA . 27378 1
289 . 2 1 4 4 THR N N 15 115.752 0.01 . 6 . . . . . 4 Thr N . 27378 1
290 . 2 1 5 5 LEU H H 1 9.125 0.001 . 6 . . . . . 5 Leu H . 27378 1
291 . 2 1 5 5 LEU CA C 13 54.112 0.011 . 6 . . . . . 5 Leu CA . 27378 1
292 . 2 1 5 5 LEU N N 15 116.926 0.01 . 6 . . . . . 5 Leu N . 27378 1
293 . 2 1 7 7 LYS CA C 13 53.558 0.011 . 6 . . . . . 7 Lys CA . 27378 1
294 . 2 1 8 8 ARG H H 1 8.791 0.001 . 6 . . . . . 8 Arg H . 27378 1
295 . 2 1 8 8 ARG CA C 13 56.12 0.011 . 6 . . . . . 8 Arg CA . 27378 1
296 . 2 1 8 8 ARG N N 15 120.691 0.01 . 6 . . . . . 8 Arg N . 27378 1
297 . 2 1 9 9 PRO CA C 13 61.631 0.011 . 6 . . . . . 9 Pro CA . 27378 1
298 . 2 1 10 10 LEU H H 1 7.642 0.001 . 6 . . . . . 10 Leu H . 27378 1
299 . 2 1 10 10 LEU CA C 13 53.71 0.011 . 6 . . . . . 10 Leu CA . 27378 1
300 . 2 1 10 10 LEU N N 15 126.507 0.01 . 6 . . . . . 10 Leu N . 27378 1
301 . 2 1 11 11 VAL H H 1 9.171 0.001 . 6 . . . . . 11 Val H . 27378 1
302 . 2 1 11 11 VAL N N 15 115.871 0.01 . 6 . . . . . 11 Val N . 27378 1
303 . 2 1 12 12 THR H H 1 8.508 0.001 . 6 . . . . . 12 Thr H . 27378 1
304 . 2 1 12 12 THR N N 15 116.862 0.01 . 6 . . . . . 12 Thr N . 27378 1
305 . 2 1 13 13 ILE H H 1 9.315 0.001 . 6 . . . . . 13 Ile H . 27378 1
306 . 2 1 13 13 ILE CA C 13 57.966 0.011 . 6 . . . . . 13 Ile CA . 27378 1
307 . 2 1 13 13 ILE N N 15 120.729 0.01 . 6 . . . . . 13 Ile N . 27378 1
308 . 2 1 14 14 ARG H H 1 8.55 0.001 . 6 . . . . . 14 Arg H . 27378 1
309 . 2 1 14 14 ARG N N 15 119.945 0.01 . 6 . . . . . 14 Arg N . 27378 1
310 . 2 1 15 15 ILE H H 1 8.944 0.001 . 6 . . . . . 15 Ile H . 27378 1
311 . 2 1 15 15 ILE N N 15 124.94 0.01 . 6 . . . . . 15 Ile N . 27378 1
312 . 2 1 18 18 GLN H H 1 8.026 0.001 . 6 . . . . . 18 Gln H . 27378 1
313 . 2 1 18 18 GLN N N 15 119.999 0.01 . 6 . . . . . 18 Gln N . 27378 1
314 . 2 1 21 21 GLU CA C 13 54.941 0.011 . 6 . . . . . 21 Glu CA . 27378 1
315 . 2 1 22 22 ALA H H 1 9.254 0.001 . 1 . . . . . 22 Ala H B 27378 1
316 . 2 1 22 22 ALA CA C 13 50.725 0.011 . 1 . . . . . 22 Ala CA B 27378 1
317 . 2 1 22 22 ALA N N 15 125.738 0.01 . 1 . . . . . 22 Ala N B 27378 1
318 . 2 1 23 23 LEU H H 1 8.748 0.001 . 1 . . . . . 23 Leu H B 27378 1
319 . 2 1 23 23 LEU CA C 13 53.711 0.011 . 1 . . . . . 23 Leu CA B 27378 1
320 . 2 1 23 23 LEU N N 15 120.834 0.01 . 1 . . . . . 23 Leu N B 27378 1
321 . 2 1 24 24 LEU H H 1 8.282 0.001 . 1 . . . . . 24 Leu H B 27378 1
322 . 2 1 24 24 LEU CA C 13 54.757 0.011 . 1 . . . . . 24 Leu CA B 27378 1
323 . 2 1 24 24 LEU N N 15 122.615 0.01 . 1 . . . . . 24 Leu N B 27378 1
324 . 2 1 25 25 ASP H H 1 8.67 0.001 . 1 . . . . . 25 Asp H B 27378 1
325 . 2 1 25 25 ASP CA C 13 53.185 0.011 . 1 . . . . . 25 Asp CA B 27378 1
326 . 2 1 25 25 ASP N N 15 127.008 0.01 . 1 . . . . . 25 Asp N B 27378 1
327 . 2 1 26 26 THR H H 1 8.418 0.001 . 1 . . . . . 26 Thr H B 27378 1
328 . 2 1 26 26 THR N N 15 112.633 0.01 . 1 . . . . . 26 Thr N B 27378 1
329 . 2 1 27 27 GLY H H 1 9.436 0.001 . 1 . . . . . 27 Gly H B 27378 1
330 . 2 1 27 27 GLY CA C 13 44.992 0.011 . 1 . . . . . 27 Gly CA B 27378 1
331 . 2 1 27 27 GLY N N 15 109.268 0.01 . 1 . . . . . 27 Gly N B 27378 1
332 . 2 1 28 28 ALA H H 1 6.893 0.001 . 1 . . . . . 28 Ala H B 27378 1
333 . 2 1 28 28 ALA CA C 13 49.066 0.011 . 1 . . . . . 28 Ala CA B 27378 1
334 . 2 1 28 28 ALA N N 15 124.433 0.01 . 1 . . . . . 28 Ala N B 27378 1
335 . 2 1 29 29 ASP H H 1 8.538 0.001 . 1 . . . . . 29 Asp H B 27378 1
336 . 2 1 29 29 ASP CA C 13 58.281 0.011 . 1 . . . . . 29 Asp CA B 27378 1
337 . 2 1 29 29 ASP N N 15 124.466 0.01 . 1 . . . . . 29 Asp N B 27378 1
338 . 2 1 30 30 ASP H H 1 7.169 0.001 . 1 . . . . . 30 Asp H B 27378 1
339 . 2 1 30 30 ASP CA C 13 52.867 0.011 . 1 . . . . . 30 Asp CA B 27378 1
340 . 2 1 30 30 ASP N N 15 112.923 0.01 . 1 . . . . . 30 Asp N B 27378 1
341 . 2 1 31 31 THR H H 1 7.756 0.001 . 1 . . . . . 31 Thr H B 27378 1
342 . 2 1 31 31 THR CA C 13 63.797 0.011 . 1 . . . . . 31 Thr CA B 27378 1
343 . 2 1 31 31 THR N N 15 119.641 0.01 . 1 . . . . . 31 Thr N B 27378 1
344 . 2 1 32 32 VAL H H 1 9.081 0.001 . 1 . . . . . 32 Val H B 27378 1
345 . 2 1 32 32 VAL CA C 13 59.286 0.011 . 1 . . . . . 32 Val CA B 27378 1
346 . 2 1 32 32 VAL N N 15 127.94 0.01 . 1 . . . . . 32 Val N B 27378 1
347 . 2 1 33 33 ILE H H 1 9.235 0.001 . 1 . . . . . 33 Ile H B 27378 1
348 . 2 1 33 33 ILE CA C 13 56.795 0.011 . 1 . . . . . 33 Ile CA B 27378 1
349 . 2 1 33 33 ILE N N 15 125.875 0.01 . 1 . . . . . 33 Ile N B 27378 1
350 . 2 1 34 34 GLU H H 1 8.00 0.001 . 1 . . . . . 34 Glu H B 27378 1
351 . 2 1 34 34 GLU CA C 13 55.288 0.011 . 1 . . . . . 34 Glu CA B 27378 1
352 . 2 1 34 34 GLU N N 15 120.042 0.01 . 1 . . . . . 34 Glu N B 27378 1
353 . 2 1 35 35 GLU H H 1 7.231 0.001 . 1 . . . . . 35 Glu H B 27378 1
354 . 2 1 35 35 GLU CA C 13 58.306 0.011 . 1 . . . . . 35 Glu CA B 27378 1
355 . 2 1 35 35 GLU N N 15 115.093 0.01 . 1 . . . . . 35 Glu N B 27378 1
356 . 2 1 36 36 MET H H 1 6.964 0.001 . 1 . . . . . 36 Met H B 27378 1
357 . 2 1 36 36 MET CA C 13 54.676 0.011 . 6 . . . . . 36 Met CA B 27378 1
358 . 2 1 36 36 MET N N 15 120.724 0.01 . 1 . . . . . 36 Met N B 27378 1
359 . 2 1 37 37 ASN H H 1 8.65 0.001 . 6 . . . . . 37 Asn H . 27378 1
360 . 2 1 37 37 ASN CA C 13 52.53 0.011 . 6 . . . . . 37 Asn CA . 27378 1
361 . 2 1 37 37 ASN N N 15 118.779 0.01 . 6 . . . . . 37 Asn N . 27378 1
362 . 2 1 38 38 LEU H H 1 7.396 0.001 . 6 . . . . . 38 Leu H . 27378 1
363 . 2 1 38 38 LEU CA C 13 51.755 0.011 . 6 . . . . . 38 Leu CA . 27378 1
364 . 2 1 38 38 LEU N N 15 124.814 0.01 . 6 . . . . . 38 Leu N . 27378 1
365 . 2 1 41 41 LYS H H 1 8.403 0.001 . 6 . . . . . 41 Lys H . 27378 1
366 . 2 1 41 41 LYS CA C 13 56.202 0.011 . 6 . . . . . 41 Lys CA . 27378 1
367 . 2 1 41 41 LYS N N 15 119.067 0.01 . 6 . . . . . 41 Lys N . 27378 1
368 . 2 1 42 42 TRP H H 1 7.384 0.001 . 6 . . . . . 42 Trp H . 27378 1
369 . 2 1 42 42 TRP CA C 13 53.702 0.011 . 6 . . . . . 42 Trp CA . 27378 1
370 . 2 1 42 42 TRP N N 15 117.772 0.01 . 6 . . . . . 42 Trp N . 27378 1
371 . 2 1 43 43 LYS H H 1 8.222 0.001 . 6 . . . . . 43 Lys H . 27378 1
372 . 2 1 43 43 LYS CA C 13 52.828 0.011 . 6 . . . . . 43 Lys CA . 27378 1
373 . 2 1 43 43 LYS N N 15 117.808 0.01 . 6 . . . . . 43 Lys N . 27378 1
374 . 2 1 46 46 MET H H 1 8.437 0.001 . 1 . . . . . 46 Met H B 27378 1
375 . 2 1 46 46 MET CA C 13 54.226 0.011 . 1 . . . . . 46 Met CA B 27378 1
376 . 2 1 46 46 MET N N 15 122.399 0.01 . 1 . . . . . 46 Met N B 27378 1
377 . 2 1 47 47 ILE H H 1 8.641 0.001 . 1 . . . . . 47 Ile H B 27378 1
378 . 2 1 47 47 ILE N N 15 116.257 0.01 . 1 . . . . . 47 Ile N B 27378 1
379 . 2 1 48 48 GLY H H 1 8.481 0.001 . 1 . . . . . 48 Gly H B 27378 1
380 . 2 1 48 48 GLY CA C 13 44.594 0.011 . 1 . . . . . 48 Gly CA B 27378 1
381 . 2 1 48 48 GLY N N 15 108.493 0.01 . 1 . . . . . 48 Gly N B 27378 1
382 . 2 1 49 49 GLY H H 1 7.47 0.001 . 1 . . . . . 49 Gly H B 27378 1
383 . 2 1 49 49 GLY N N 15 107.031 0.01 . 1 . . . . . 49 Gly N B 27378 1
384 . 2 1 50 50 ILE H H 1 8.431 0.001 . 1 . . . . . 50 Ile H B 27378 1
385 . 2 1 50 50 ILE N N 15 126.159 0.01 . 1 . . . . . 50 Ile N B 27378 1
386 . 2 1 52 52 GLY H H 1 7.234 0.001 . 1 . . . . . 52 Gly H B 27378 1
387 . 2 1 52 52 GLY CA C 13 44.304 0.011 . 1 . . . . . 52 Gly CA B 27378 1
388 . 2 1 52 52 GLY N N 15 104.823 0.01 . 1 . . . . . 52 Gly N B 27378 1
389 . 2 1 53 53 PHE H H 1 8.458 0.001 . 1 . . . . . 53 Phe H B 27378 1
390 . 2 1 53 53 PHE CA C 13 56.223 0.011 . 1 . . . . . 53 Phe CA B 27378 1
391 . 2 1 53 53 PHE N N 15 119.375 0.01 . 1 . . . . . 53 Phe N B 27378 1
392 . 2 1 54 54 ILE H H 1 8.649 0.001 . 1 . . . . . 54 Ile H B 27378 1
393 . 2 1 54 54 ILE CA C 13 59.628 0.011 . 1 . . . . . 54 Ile CA B 27378 1
394 . 2 1 54 54 ILE N N 15 111.919 0.01 . 1 . . . . . 54 Ile N B 27378 1
395 . 2 1 55 55 LYS CA C 13 56.185 0.011 . 1 . . . . . 55 Lys CA B 27378 1
396 . 2 1 56 56 VAL H H 1 8.83 0.001 . 1 . . . . . 56 Val H B 27378 1
397 . 2 1 56 56 VAL CA C 13 57.99 0.011 . 1 . . . . . 56 Val CA B 27378 1
398 . 2 1 56 56 VAL N N 15 115.231 0.01 . 1 . . . . . 56 Val N B 27378 1
399 . 2 1 57 57 ARG H H 1 9.053 0.001 . 1 . . . . . 57 Arg H B 27378 1
400 . 2 1 57 57 ARG CA C 13 55.294 0.011 . 1 . . . . . 57 Arg CA B 27378 1
401 . 2 1 57 57 ARG N N 15 119.325 0.01 . 1 . . . . . 57 Arg N B 27378 1
402 . 2 1 58 58 GLN H H 1 9.742 0.001 . 1 . . . . . 58 Gln H B 27378 1
403 . 2 1 58 58 GLN CA C 13 56.026 0.011 . 1 . . . . . 58 Gln CA B 27378 1
404 . 2 1 58 58 GLN N N 15 123.518 0.01 . 1 . . . . . 58 Gln N B 27378 1
405 . 2 1 59 59 TYR H H 1 9.161 0.001 . 1 . . . . . 59 Tyr H B 27378 1
406 . 2 1 59 59 TYR CA C 13 57.465 0.011 . 1 . . . . . 59 Tyr CA B 27378 1
407 . 2 1 59 59 TYR N N 15 129.116 0.01 . 1 . . . . . 59 Tyr N B 27378 1
408 . 2 1 60 60 ASP H H 1 8.988 0.001 . 1 . . . . . 60 Asp H B 27378 1
409 . 2 1 60 60 ASP CA C 13 53.697 0.011 . 1 . . . . . 60 Asp CA B 27378 1
410 . 2 1 60 60 ASP N N 15 120.616 0.01 . 1 . . . . . 60 Asp N B 27378 1
411 . 2 1 61 61 GLN H H 1 8.917 0.001 . 1 . . . . . 61 Gln H B 27378 1
412 . 2 1 61 61 GLN CA C 13 56.271 0.011 . 1 . . . . . 61 Gln CA B 27378 1
413 . 2 1 61 61 GLN N N 15 114.059 0.01 . 1 . . . . . 61 Gln N B 27378 1
414 . 2 1 62 62 ILE H H 1 8.739 0.001 . 1 . . . . . 62 Ile H B 27378 1
415 . 2 1 62 62 ILE CA C 13 55.062 0.011 . 1 . . . . . 62 Ile CA B 27378 1
416 . 2 1 62 62 ILE N N 15 122.395 0.01 . 1 . . . . . 62 Ile N B 27378 1
417 . 2 1 63 63 PRO CA C 13 61.915 0.011 . 6 . . . . . 63 Pro CA . 27378 1
418 . 2 1 64 64 ILE H H 1 8.89 0.001 . 6 . . . . . 64 Ile H . 27378 1
419 . 2 1 64 64 ILE CA C 13 59.176 0.011 . 6 . . . . . 64 Ile CA . 27378 1
420 . 2 1 64 64 ILE N N 15 123.877 0.01 . 6 . . . . . 64 Ile N . 27378 1
421 . 2 1 65 65 GLU CA C 13 54.197 0.011 . 6 . . . . . 65 Glu CA . 27378 1
422 . 2 1 66 66 ILE H H 1 9.175 0.001 . 6 . . . . . 66 Ile H . 27378 1
423 . 2 1 66 66 ILE N N 15 125.009 0.01 . 6 . . . . . 66 Ile N . 27378 1
424 . 2 1 68 68 GLY H H 1 8.696 0.001 . 6 . . . . . 68 Gly H . 27378 1
425 . 2 1 68 68 GLY N N 15 103.085 0.01 . 6 . . . . . 68 Gly N . 27378 1
426 . 2 1 72 72 ILE H H 1 8.462 0.001 . 6 . . . . . 72 Ile H . 27378 1
427 . 2 1 72 72 ILE N N 15 119.472 0.01 . 6 . . . . . 72 Ile N . 27378 1
428 . 2 1 73 73 GLY H H 1 8.506 0.001 . 6 . . . . . 73 Gly H . 27378 1
429 . 2 1 73 73 GLY CA C 13 46.008 0.011 . 6 . . . . . 73 Gly CA . 27378 1
430 . 2 1 73 73 GLY N N 15 112.472 0.01 . 6 . . . . . 73 Gly N . 27378 1
431 . 2 1 74 74 THR H H 1 8.63 0.001 . 6 . . . . . 74 Thr H . 27378 1
432 . 2 1 74 74 THR CA C 13 63.562 0.011 . 6 . . . . . 74 Thr CA . 27378 1
433 . 2 1 74 74 THR N N 15 118.796 0.01 . 6 . . . . . 74 Thr N . 27378 1
434 . 2 1 75 75 VAL H H 1 9.041 0.001 . 6 . . . . . 75 Val H . 27378 1
435 . 2 1 75 75 VAL CA C 13 61.674 0.011 . 6 . . . . . 75 Val CA . 27378 1
436 . 2 1 75 75 VAL N N 15 125.024 0.01 . 6 . . . . . 75 Val N . 27378 1
437 . 2 1 76 76 LEU H H 1 8.246 0.001 . 6 . . . . . 76 Leu H . 27378 1
438 . 2 1 76 76 LEU CA C 13 52.42 0.011 . 6 . . . . . 76 Leu CA . 27378 1
439 . 2 1 76 76 LEU N N 15 125.312 0.01 . 6 . . . . . 76 Leu N . 27378 1
440 . 2 1 77 77 VAL H H 1 9.121 0.001 . 6 . . . . . 77 Val H . 27378 1
441 . 2 1 77 77 VAL CA C 13 59.83 0.011 . 6 . . . . . 77 Val CA . 27378 1
442 . 2 1 77 77 VAL N N 15 121.92 0.01 . 6 . . . . . 77 Val N . 27378 1
443 . 2 1 78 78 GLY H H 1 9.048 0.001 . 6 . . . . . 78 Gly H . 27378 1
444 . 2 1 78 78 GLY CA C 13 45.856 0.011 . 6 . . . . . 78 Gly CA . 27378 1
445 . 2 1 78 78 GLY N N 15 114.968 0.01 . 6 . . . . . 78 Gly N . 27378 1
446 . 2 1 79 79 PRO CA C 13 63.336 0.011 . 6 . . . . . 79 Pro CA . 27378 1
447 . 2 1 80 80 THR H H 1 8.33 0.001 . 6 . . . . . 80 Thr H . 27378 1
448 . 2 1 80 80 THR CA C 13 56.549 0.011 . 6 . . . . . 80 Thr CA . 27378 1
449 . 2 1 80 80 THR N N 15 119.935 0.01 . 6 . . . . . 80 Thr N . 27378 1
450 . 2 1 81 81 PRO CA C 13 63.995 0.011 . 6 . . . . . 81 Pro CA . 27378 1
451 . 2 1 82 82 VAL H H 1 6.942 0.001 . 1 . . . . . 82 Val H B 27378 1
452 . 2 1 82 82 VAL CA C 13 59.458 0.011 . 1 . . . . . 82 Val CA B 27378 1
453 . 2 1 82 82 VAL N N 15 113.865 0.01 . 1 . . . . . 82 Val N B 27378 1
454 . 2 1 83 83 ASN H H 1 8.502 0.001 . 1 . . . . . 83 Asn H B 27378 1
455 . 2 1 83 83 ASN CA C 13 54.046 0.011 . 1 . . . . . 83 Asn CA B 27378 1
456 . 2 1 83 83 ASN N N 15 122.367 0.01 . 1 . . . . . 83 Asn N B 27378 1
457 . 2 1 84 84 ILE H H 1 9.728 0.001 . 1 . . . . . 84 Ile H B 27378 1
458 . 2 1 84 84 ILE CA C 13 61.278 0.011 . 1 . . . . . 84 Ile CA B 27378 1
459 . 2 1 84 84 ILE N N 15 126.48 0.01 . 1 . . . . . 84 Ile N B 27378 1
460 . 2 1 85 85 ILE H H 1 9.252 0.001 . 1 . . . . . 85 Ile H B 27378 1
461 . 2 1 85 85 ILE CA C 13 58.213 0.011 . 1 . . . . . 85 Ile CA B 27378 1
462 . 2 1 85 85 ILE N N 15 126.024 0.01 . 1 . . . . . 85 Ile N B 27378 1
463 . 2 1 86 86 GLY H H 1 8.047 0.001 . 1 . . . . . 86 Gly H B 27378 1
464 . 2 1 86 86 GLY CA C 13 43.537 0.011 . 1 . . . . . 86 Gly CA B 27378 1
465 . 2 1 86 86 GLY N N 15 112.461 0.01 . 1 . . . . . 86 Gly N B 27378 1
466 . 2 1 87 87 ARG H H 1 9.218 0.001 . 1 . . . . . 87 Arg H B 27378 1
467 . 2 1 87 87 ARG CA C 13 61.364 0.011 . 1 . . . . . 87 Arg CA B 27378 1
468 . 2 1 87 87 ARG N N 15 116.957 0.01 . 1 . . . . . 87 Arg N B 27378 1
469 . 2 1 88 88 ASN H H 1 7.884 0.001 . 1 . . . . . 88 Asn H B 27378 1
470 . 2 1 88 88 ASN CA C 13 56.79 0.011 . 1 . . . . . 88 Asn CA B 27378 1
471 . 2 1 88 88 ASN N N 15 115.129 0.01 . 1 . . . . . 88 Asn N B 27378 1
472 . 2 1 89 89 LEU H H 1 6.948 0.001 . 1 . . . . . 89 Leu H B 27378 1
473 . 2 1 89 89 LEU CA C 13 55.122 0.011 . 1 . . . . . 89 Leu CA B 27378 1
474 . 2 1 89 89 LEU N N 15 115.853 0.01 . 1 . . . . . 89 Leu N B 27378 1
475 . 2 1 92 92 GLN H H 1 6.701 0.001 . 6 . . . . . 92 Gln H . 27378 1
476 . 2 1 92 92 GLN N N 15 120.414 0.01 . 6 . . . . . 92 Gln N . 27378 1
477 . 2 1 93 93 ILE H H 1 6.952 0.001 . 6 . . . . . 93 Ile H . 27378 1
478 . 2 1 93 93 ILE CA C 13 60.508 0.011 . 6 . . . . . 93 Ile CA . 27378 1
479 . 2 1 93 93 ILE N N 15 108.671 0.01 . 6 . . . . . 93 Ile N . 27378 1
480 . 2 1 94 94 GLY CA C 13 45.973 0.011 . 6 . . . . . 94 Gly CA . 27378 1
481 . 2 1 95 95 ALA H H 1 7.48 0.001 . 6 . . . . . 95 Ala H . 27378 1
482 . 2 1 95 95 ALA CA C 13 51.497 0.011 . 6 . . . . . 95 Ala CA . 27378 1
483 . 2 1 95 95 ALA N N 15 120.272 0.01 . 6 . . . . . 95 Ala N . 27378 1
484 . 2 1 96 96 THR H H 1 8.982 0.001 . 6 . . . . . 96 Thr H . 27378 1
485 . 2 1 96 96 THR CA C 13 59.408 0.011 . 6 . . . . . 96 Thr CA . 27378 1
486 . 2 1 96 96 THR N N 15 108.976 0.01 . 6 . . . . . 96 Thr N . 27378 1
487 . 2 1 97 97 LEU H H 1 8.494 0.001 . 6 . . . . . 97 Leu H . 27378 1
488 . 2 1 97 97 LEU CA C 13 53.223 0.011 . 6 . . . . . 97 Leu CA . 27378 1
489 . 2 1 97 97 LEU N N 15 121.72 0.01 . 6 . . . . . 97 Leu N . 27378 1
490 . 2 1 98 98 ASN H H 1 8.902 0.001 . 6 . . . . . 98 Asn H . 27378 1
491 . 2 1 98 98 ASN CA C 13 52.778 0.011 . 6 . . . . . 98 Asn CA . 27378 1
492 . 2 1 98 98 ASN N N 15 121.51 0.01 . 6 . . . . . 98 Asn N . 27378 1
493 . 2 1 99 99 PHE H H 1 7.966 0.001 . 6 . . . . . 99 Phe H . 27378 1
494 . 2 1 99 99 PHE CA C 13 58.974 0.011 . 6 . . . . . 99 Phe CA . 27378 1
495 . 2 1 99 99 PHE N N 15 121.618 0.01 . 6 . . . . . 99 Phe N . 27378 1
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