Content for NMR-STAR saveframe, "chemical_shift_1"
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11336
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11336 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11336 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 $XWINNMR . . 11336 1
2 $NMRPipe . . 11336 1
3 $NMRView . . 11336 1
4 $Kujira . . 11336 1
5 $CYANA . . 11336 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.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 7 7 GLY HA2 H 1 4.035 0.030 . 1 . . . . 7 GLY HA2 . 11336 1
2 . 1 1 7 7 GLY HA3 H 1 4.035 0.030 . 1 . . . . 7 GLY HA3 . 11336 1
3 . 1 1 7 7 GLY C C 13 174.544 0.300 . 1 . . . . 7 GLY C . 11336 1
4 . 1 1 7 7 GLY CA C 13 45.480 0.300 . 1 . . . . 7 GLY CA . 11336 1
5 . 1 1 8 8 THR H H 1 8.128 0.030 . 1 . . . . 8 THR H . 11336 1
6 . 1 1 8 8 THR HA H 1 4.349 0.030 . 1 . . . . 8 THR HA . 11336 1
7 . 1 1 8 8 THR HB H 1 4.267 0.030 . 1 . . . . 8 THR HB . 11336 1
8 . 1 1 8 8 THR HG21 H 1 1.193 0.030 . 1 . . . . 8 THR HG2 . 11336 1
9 . 1 1 8 8 THR HG22 H 1 1.193 0.030 . 1 . . . . 8 THR HG2 . 11336 1
10 . 1 1 8 8 THR HG23 H 1 1.193 0.030 . 1 . . . . 8 THR HG2 . 11336 1
11 . 1 1 8 8 THR C C 13 175.298 0.300 . 1 . . . . 8 THR C . 11336 1
12 . 1 1 8 8 THR CA C 13 61.671 0.300 . 1 . . . . 8 THR CA . 11336 1
13 . 1 1 8 8 THR CB C 13 69.836 0.300 . 1 . . . . 8 THR CB . 11336 1
14 . 1 1 8 8 THR CG2 C 13 21.492 0.300 . 1 . . . . 8 THR CG2 . 11336 1
15 . 1 1 8 8 THR N N 15 112.939 0.300 . 1 . . . . 8 THR N . 11336 1
16 . 1 1 9 9 GLY H H 1 8.449 0.030 . 1 . . . . 9 GLY H . 11336 1
17 . 1 1 9 9 GLY HA2 H 1 3.937 0.030 . 1 . . . . 9 GLY HA2 . 11336 1
18 . 1 1 9 9 GLY HA3 H 1 3.937 0.030 . 1 . . . . 9 GLY HA3 . 11336 1
19 . 1 1 9 9 GLY C C 13 173.906 0.300 . 1 . . . . 9 GLY C . 11336 1
20 . 1 1 9 9 GLY CA C 13 45.301 0.300 . 1 . . . . 9 GLY CA . 11336 1
21 . 1 1 9 9 GLY N N 15 111.134 0.300 . 1 . . . . 9 GLY N . 11336 1
22 . 1 1 10 10 LEU H H 1 8.065 0.030 . 1 . . . . 10 LEU H . 11336 1
23 . 1 1 10 10 LEU HA H 1 4.324 0.030 . 1 . . . . 10 LEU HA . 11336 1
24 . 1 1 10 10 LEU HB2 H 1 1.572 0.030 . 2 . . . . 10 LEU HB2 . 11336 1
25 . 1 1 10 10 LEU HB3 H 1 1.518 0.030 . 2 . . . . 10 LEU HB3 . 11336 1
26 . 1 1 10 10 LEU HD11 H 1 0.877 0.030 . 1 . . . . 10 LEU HD1 . 11336 1
27 . 1 1 10 10 LEU HD12 H 1 0.877 0.030 . 1 . . . . 10 LEU HD1 . 11336 1
28 . 1 1 10 10 LEU HD13 H 1 0.877 0.030 . 1 . . . . 10 LEU HD1 . 11336 1
29 . 1 1 10 10 LEU HD21 H 1 0.830 0.030 . 1 . . . . 10 LEU HD2 . 11336 1
30 . 1 1 10 10 LEU HD22 H 1 0.830 0.030 . 1 . . . . 10 LEU HD2 . 11336 1
31 . 1 1 10 10 LEU HD23 H 1 0.830 0.030 . 1 . . . . 10 LEU HD2 . 11336 1
32 . 1 1 10 10 LEU HG H 1 1.553 0.030 . 1 . . . . 10 LEU HG . 11336 1
33 . 1 1 10 10 LEU C C 13 177.174 0.300 . 1 . . . . 10 LEU C . 11336 1
34 . 1 1 10 10 LEU CA C 13 55.040 0.300 . 1 . . . . 10 LEU CA . 11336 1
35 . 1 1 10 10 LEU CB C 13 42.397 0.300 . 1 . . . . 10 LEU CB . 11336 1
36 . 1 1 10 10 LEU CD1 C 13 24.914 0.300 . 2 . . . . 10 LEU CD1 . 11336 1
37 . 1 1 10 10 LEU CD2 C 13 23.464 0.300 . 2 . . . . 10 LEU CD2 . 11336 1
38 . 1 1 10 10 LEU CG C 13 27.096 0.300 . 1 . . . . 10 LEU CG . 11336 1
39 . 1 1 10 10 LEU N N 15 121.580 0.300 . 1 . . . . 10 LEU N . 11336 1
40 . 1 1 11 11 ARG H H 1 8.358 0.030 . 1 . . . . 11 ARG H . 11336 1
41 . 1 1 11 11 ARG HA H 1 4.598 0.030 . 1 . . . . 11 ARG HA . 11336 1
42 . 1 1 11 11 ARG HB2 H 1 1.691 0.030 . 2 . . . . 11 ARG HB2 . 11336 1
43 . 1 1 11 11 ARG HB3 H 1 1.792 0.030 . 2 . . . . 11 ARG HB3 . 11336 1
44 . 1 1 11 11 ARG HD2 H 1 3.163 0.030 . 1 . . . . 11 ARG HD2 . 11336 1
45 . 1 1 11 11 ARG HD3 H 1 3.163 0.030 . 1 . . . . 11 ARG HD3 . 11336 1
46 . 1 1 11 11 ARG HG2 H 1 1.615 0.030 . 1 . . . . 11 ARG HG2 . 11336 1
47 . 1 1 11 11 ARG HG3 H 1 1.615 0.030 . 1 . . . . 11 ARG HG3 . 11336 1
48 . 1 1 11 11 ARG C C 13 174.185 0.300 . 1 . . . . 11 ARG C . 11336 1
49 . 1 1 11 11 ARG CA C 13 53.755 0.300 . 1 . . . . 11 ARG CA . 11336 1
50 . 1 1 11 11 ARG CB C 13 30.189 0.300 . 1 . . . . 11 ARG CB . 11336 1
51 . 1 1 11 11 ARG CD C 13 43.338 0.300 . 1 . . . . 11 ARG CD . 11336 1
52 . 1 1 11 11 ARG CG C 13 26.767 0.300 . 1 . . . . 11 ARG CG . 11336 1
53 . 1 1 11 11 ARG N N 15 123.184 0.300 . 1 . . . . 11 ARG N . 11336 1
54 . 1 1 12 12 PRO HA H 1 4.405 0.030 . 1 . . . . 12 PRO HA . 11336 1
55 . 1 1 12 12 PRO HB2 H 1 1.885 0.030 . 2 . . . . 12 PRO HB2 . 11336 1
56 . 1 1 12 12 PRO HB3 H 1 2.269 0.030 . 2 . . . . 12 PRO HB3 . 11336 1
57 . 1 1 12 12 PRO HD2 H 1 3.572 0.030 . 2 . . . . 12 PRO HD2 . 11336 1
58 . 1 1 12 12 PRO HD3 H 1 3.769 0.030 . 2 . . . . 12 PRO HD3 . 11336 1
59 . 1 1 12 12 PRO HG2 H 1 1.995 0.030 . 2 . . . . 12 PRO HG2 . 11336 1
60 . 1 1 12 12 PRO HG3 H 1 1.946 0.030 . 2 . . . . 12 PRO HG3 . 11336 1
61 . 1 1 12 12 PRO C C 13 177.054 0.300 . 1 . . . . 12 PRO C . 11336 1
62 . 1 1 12 12 PRO CA C 13 63.182 0.300 . 1 . . . . 12 PRO CA . 11336 1
63 . 1 1 12 12 PRO CB C 13 32.170 0.300 . 1 . . . . 12 PRO CB . 11336 1
64 . 1 1 12 12 PRO CD C 13 50.657 0.300 . 1 . . . . 12 PRO CD . 11336 1
65 . 1 1 12 12 PRO CG C 13 27.429 0.300 . 1 . . . . 12 PRO CG . 11336 1
66 . 1 1 13 13 SER H H 1 8.459 0.030 . 1 . . . . 13 SER H . 11336 1
67 . 1 1 13 13 SER HA H 1 4.500 0.030 . 1 . . . . 13 SER HA . 11336 1
68 . 1 1 13 13 SER HB2 H 1 3.903 0.030 . 1 . . . . 13 SER HB2 . 11336 1
69 . 1 1 13 13 SER HB3 H 1 3.903 0.030 . 1 . . . . 13 SER HB3 . 11336 1
70 . 1 1 13 13 SER C C 13 175.061 0.300 . 1 . . . . 13 SER C . 11336 1
71 . 1 1 13 13 SER CA C 13 58.601 0.300 . 1 . . . . 13 SER CA . 11336 1
72 . 1 1 13 13 SER CB C 13 63.680 0.300 . 1 . . . . 13 SER CB . 11336 1
73 . 1 1 13 13 SER N N 15 116.631 0.300 . 1 . . . . 13 SER N . 11336 1
74 . 1 1 14 14 GLY H H 1 8.456 0.030 . 1 . . . . 14 GLY H . 11336 1
75 . 1 1 14 14 GLY HA2 H 1 3.947 0.030 . 1 . . . . 14 GLY HA2 . 11336 1
76 . 1 1 14 14 GLY HA3 H 1 3.947 0.030 . 1 . . . . 14 GLY HA3 . 11336 1
77 . 1 1 14 14 GLY C C 13 174.206 0.300 . 1 . . . . 14 GLY C . 11336 1
78 . 1 1 14 14 GLY CA C 13 45.369 0.300 . 1 . . . . 14 GLY CA . 11336 1
79 . 1 1 14 14 GLY N N 15 110.794 0.300 . 1 . . . . 14 GLY N . 11336 1
80 . 1 1 15 15 THR H H 1 8.035 0.030 . 1 . . . . 15 THR H . 11336 1
81 . 1 1 15 15 THR HA H 1 4.347 0.030 . 1 . . . . 15 THR HA . 11336 1
82 . 1 1 15 15 THR HB H 1 4.173 0.030 . 1 . . . . 15 THR HB . 11336 1
83 . 1 1 15 15 THR HG21 H 1 1.158 0.030 . 1 . . . . 15 THR HG2 . 11336 1
84 . 1 1 15 15 THR HG22 H 1 1.158 0.030 . 1 . . . . 15 THR HG2 . 11336 1
85 . 1 1 15 15 THR HG23 H 1 1.158 0.030 . 1 . . . . 15 THR HG2 . 11336 1
86 . 1 1 15 15 THR C C 13 174.513 0.300 . 1 . . . . 15 THR C . 11336 1
87 . 1 1 15 15 THR CA C 13 61.736 0.300 . 1 . . . . 15 THR CA . 11336 1
88 . 1 1 15 15 THR CB C 13 69.967 0.300 . 1 . . . . 15 THR CB . 11336 1
89 . 1 1 15 15 THR CG2 C 13 21.609 0.300 . 1 . . . . 15 THR CG2 . 11336 1
90 . 1 1 15 15 THR N N 15 113.540 0.300 . 1 . . . . 15 THR N . 11336 1
91 . 1 1 16 16 VAL H H 1 8.104 0.030 . 1 . . . . 16 VAL H . 11336 1
92 . 1 1 16 16 VAL HA H 1 4.118 0.030 . 1 . . . . 16 VAL HA . 11336 1
93 . 1 1 16 16 VAL HB H 1 2.022 0.030 . 1 . . . . 16 VAL HB . 11336 1
94 . 1 1 16 16 VAL HG11 H 1 0.891 0.030 . 1 . . . . 16 VAL HG1 . 11336 1
95 . 1 1 16 16 VAL HG12 H 1 0.891 0.030 . 1 . . . . 16 VAL HG1 . 11336 1
96 . 1 1 16 16 VAL HG13 H 1 0.891 0.030 . 1 . . . . 16 VAL HG1 . 11336 1
97 . 1 1 16 16 VAL HG21 H 1 0.841 0.030 . 1 . . . . 16 VAL HG2 . 11336 1
98 . 1 1 16 16 VAL HG22 H 1 0.841 0.030 . 1 . . . . 16 VAL HG2 . 11336 1
99 . 1 1 16 16 VAL HG23 H 1 0.841 0.030 . 1 . . . . 16 VAL HG2 . 11336 1
100 . 1 1 16 16 VAL C C 13 174.505 0.300 . 1 . . . . 16 VAL C . 11336 1
101 . 1 1 16 16 VAL CA C 13 62.339 0.300 . 1 . . . . 16 VAL CA . 11336 1
102 . 1 1 16 16 VAL CB C 13 32.941 0.300 . 1 . . . . 16 VAL CB . 11336 1
103 . 1 1 16 16 VAL CG1 C 13 20.815 0.300 . 2 . . . . 16 VAL CG1 . 11336 1
104 . 1 1 16 16 VAL CG2 C 13 21.316 0.300 . 2 . . . . 16 VAL CG2 . 11336 1
105 . 1 1 16 16 VAL N N 15 122.974 0.300 . 1 . . . . 16 VAL N . 11336 1
106 . 1 1 17 17 SER H H 1 7.924 0.030 . 1 . . . . 17 SER H . 11336 1
107 . 1 1 17 17 SER HA H 1 4.828 0.030 . 1 . . . . 17 SER HA . 11336 1
108 . 1 1 17 17 SER HB2 H 1 3.615 0.030 . 2 . . . . 17 SER HB2 . 11336 1
109 . 1 1 17 17 SER HB3 H 1 3.467 0.030 . 2 . . . . 17 SER HB3 . 11336 1
110 . 1 1 17 17 SER C C 13 172.144 0.300 . 1 . . . . 17 SER C . 11336 1
111 . 1 1 17 17 SER CA C 13 56.917 0.300 . 1 . . . . 17 SER CA . 11336 1
112 . 1 1 17 17 SER CB C 13 65.544 0.300 . 1 . . . . 17 SER CB . 11336 1
113 . 1 1 17 17 SER N N 15 117.804 0.300 . 1 . . . . 17 SER N . 11336 1
114 . 1 1 18 18 CYS H H 1 8.145 0.030 . 1 . . . . 18 CYS H . 11336 1
115 . 1 1 18 18 CYS HA H 1 4.872 0.030 . 1 . . . . 18 CYS HA . 11336 1
116 . 1 1 18 18 CYS HB2 H 1 2.723 0.030 . 2 . . . . 18 CYS HB2 . 11336 1
117 . 1 1 18 18 CYS HB3 H 1 3.633 0.030 . 2 . . . . 18 CYS HB3 . 11336 1
118 . 1 1 18 18 CYS C C 13 175.931 0.300 . 1 . . . . 18 CYS C . 11336 1
119 . 1 1 18 18 CYS CA C 13 55.584 0.300 . 1 . . . . 18 CYS CA . 11336 1
120 . 1 1 18 18 CYS CB C 13 32.329 0.300 . 1 . . . . 18 CYS CB . 11336 1
121 . 1 1 18 18 CYS N N 15 123.726 0.300 . 1 . . . . 18 CYS N . 11336 1
122 . 1 1 19 19 PRO HA H 1 4.555 0.030 . 1 . . . . 19 PRO HA . 11336 1
123 . 1 1 19 19 PRO HB2 H 1 2.187 0.030 . 2 . . . . 19 PRO HB2 . 11336 1
124 . 1 1 19 19 PRO HB3 H 1 2.076 0.030 . 2 . . . . 19 PRO HB3 . 11336 1
125 . 1 1 19 19 PRO HD2 H 1 4.321 0.030 . 2 . . . . 19 PRO HD2 . 11336 1
126 . 1 1 19 19 PRO HD3 H 1 3.848 0.030 . 2 . . . . 19 PRO HD3 . 11336 1
127 . 1 1 19 19 PRO HG2 H 1 2.063 0.030 . 2 . . . . 19 PRO HG2 . 11336 1
128 . 1 1 19 19 PRO HG3 H 1 1.934 0.030 . 2 . . . . 19 PRO HG3 . 11336 1
129 . 1 1 19 19 PRO C C 13 176.107 0.300 . 1 . . . . 19 PRO C . 11336 1
130 . 1 1 19 19 PRO CA C 13 64.211 0.300 . 1 . . . . 19 PRO CA . 11336 1
131 . 1 1 19 19 PRO CB C 13 32.251 0.300 . 1 . . . . 19 PRO CB . 11336 1
132 . 1 1 19 19 PRO CD C 13 51.697 0.300 . 1 . . . . 19 PRO CD . 11336 1
133 . 1 1 19 19 PRO CG C 13 27.478 0.300 . 1 . . . . 19 PRO CG . 11336 1
134 . 1 1 20 20 ILE H H 1 8.631 0.030 . 1 . . . . 20 ILE H . 11336 1
135 . 1 1 20 20 ILE HA H 1 4.160 0.030 . 1 . . . . 20 ILE HA . 11336 1
136 . 1 1 20 20 ILE HB H 1 2.436 0.030 . 1 . . . . 20 ILE HB . 11336 1
137 . 1 1 20 20 ILE HD11 H 1 0.763 0.030 . 1 . . . . 20 ILE HD1 . 11336 1
138 . 1 1 20 20 ILE HD12 H 1 0.763 0.030 . 1 . . . . 20 ILE HD1 . 11336 1
139 . 1 1 20 20 ILE HD13 H 1 0.763 0.030 . 1 . . . . 20 ILE HD1 . 11336 1
140 . 1 1 20 20 ILE HG12 H 1 1.692 0.030 . 2 . . . . 20 ILE HG12 . 11336 1
141 . 1 1 20 20 ILE HG13 H 1 1.272 0.030 . 2 . . . . 20 ILE HG13 . 11336 1
142 . 1 1 20 20 ILE HG21 H 1 0.972 0.030 . 1 . . . . 20 ILE HG2 . 11336 1
143 . 1 1 20 20 ILE HG22 H 1 0.972 0.030 . 1 . . . . 20 ILE HG2 . 11336 1
144 . 1 1 20 20 ILE HG23 H 1 0.972 0.030 . 1 . . . . 20 ILE HG2 . 11336 1
145 . 1 1 20 20 ILE C C 13 176.402 0.300 . 1 . . . . 20 ILE C . 11336 1
146 . 1 1 20 20 ILE CA C 13 64.141 0.300 . 1 . . . . 20 ILE CA . 11336 1
147 . 1 1 20 20 ILE CB C 13 36.646 0.300 . 1 . . . . 20 ILE CB . 11336 1
148 . 1 1 20 20 ILE CD1 C 13 12.971 0.300 . 1 . . . . 20 ILE CD1 . 11336 1
149 . 1 1 20 20 ILE CG1 C 13 28.063 0.300 . 1 . . . . 20 ILE CG1 . 11336 1
150 . 1 1 20 20 ILE CG2 C 13 17.365 0.300 . 1 . . . . 20 ILE CG2 . 11336 1
151 . 1 1 20 20 ILE N N 15 122.472 0.300 . 1 . . . . 20 ILE N . 11336 1
152 . 1 1 21 21 CYS H H 1 7.938 0.030 . 1 . . . . 21 CYS H . 11336 1
153 . 1 1 21 21 CYS HA H 1 4.526 0.030 . 1 . . . . 21 CYS HA . 11336 1
154 . 1 1 21 21 CYS HB2 H 1 3.144 0.030 . 2 . . . . 21 CYS HB2 . 11336 1
155 . 1 1 21 21 CYS HB3 H 1 2.705 0.030 . 2 . . . . 21 CYS HB3 . 11336 1
156 . 1 1 21 21 CYS C C 13 176.428 0.300 . 1 . . . . 21 CYS C . 11336 1
157 . 1 1 21 21 CYS CA C 13 59.426 0.300 . 1 . . . . 21 CYS CA . 11336 1
158 . 1 1 21 21 CYS CB C 13 31.299 0.300 . 1 . . . . 21 CYS CB . 11336 1
159 . 1 1 21 21 CYS N N 15 118.803 0.300 . 1 . . . . 21 CYS N . 11336 1
160 . 1 1 22 22 MET H H 1 7.632 0.030 . 1 . . . . 22 MET H . 11336 1
161 . 1 1 22 22 MET HA H 1 4.444 0.030 . 1 . . . . 22 MET HA . 11336 1
162 . 1 1 22 22 MET HB2 H 1 2.240 0.030 . 2 . . . . 22 MET HB2 . 11336 1
163 . 1 1 22 22 MET HB3 H 1 2.484 0.030 . 2 . . . . 22 MET HB3 . 11336 1
164 . 1 1 22 22 MET HE1 H 1 2.032 0.030 . 1 . . . . 22 MET HE . 11336 1
165 . 1 1 22 22 MET HE2 H 1 2.032 0.030 . 1 . . . . 22 MET HE . 11336 1
166 . 1 1 22 22 MET HE3 H 1 2.032 0.030 . 1 . . . . 22 MET HE . 11336 1
167 . 1 1 22 22 MET HG2 H 1 2.489 0.030 . 2 . . . . 22 MET HG2 . 11336 1
168 . 1 1 22 22 MET HG3 H 1 2.272 0.030 . 2 . . . . 22 MET HG3 . 11336 1
169 . 1 1 22 22 MET C C 13 175.721 0.300 . 1 . . . . 22 MET C . 11336 1
170 . 1 1 22 22 MET CA C 13 57.089 0.300 . 1 . . . . 22 MET CA . 11336 1
171 . 1 1 22 22 MET CB C 13 28.490 0.300 . 1 . . . . 22 MET CB . 11336 1
172 . 1 1 22 22 MET CE C 13 16.838 0.300 . 1 . . . . 22 MET CE . 11336 1
173 . 1 1 22 22 MET CG C 13 32.800 0.300 . 1 . . . . 22 MET CG . 11336 1
174 . 1 1 22 22 MET N N 15 115.436 0.300 . 1 . . . . 22 MET N . 11336 1
175 . 1 1 23 23 ASP H H 1 8.443 0.030 . 1 . . . . 23 ASP H . 11336 1
176 . 1 1 23 23 ASP HA H 1 4.705 0.030 . 1 . . . . 23 ASP HA . 11336 1
177 . 1 1 23 23 ASP HB2 H 1 3.044 0.030 . 2 . . . . 23 ASP HB2 . 11336 1
178 . 1 1 23 23 ASP HB3 H 1 2.604 0.030 . 2 . . . . 23 ASP HB3 . 11336 1
179 . 1 1 23 23 ASP C C 13 176.446 0.300 . 1 . . . . 23 ASP C . 11336 1
180 . 1 1 23 23 ASP CA C 13 55.422 0.300 . 1 . . . . 23 ASP CA . 11336 1
181 . 1 1 23 23 ASP CB C 13 42.231 0.300 . 1 . . . . 23 ASP CB . 11336 1
182 . 1 1 23 23 ASP N N 15 123.044 0.300 . 1 . . . . 23 ASP N . 11336 1
183 . 1 1 24 24 GLY H H 1 8.384 0.030 . 1 . . . . 24 GLY H . 11336 1
184 . 1 1 24 24 GLY HA2 H 1 3.888 0.030 . 2 . . . . 24 GLY HA2 . 11336 1
185 . 1 1 24 24 GLY HA3 H 1 4.431 0.030 . 2 . . . . 24 GLY HA3 . 11336 1
186 . 1 1 24 24 GLY C C 13 174.142 0.300 . 1 . . . . 24 GLY C . 11336 1
187 . 1 1 24 24 GLY CA C 13 43.918 0.300 . 1 . . . . 24 GLY CA . 11336 1
188 . 1 1 24 24 GLY N N 15 106.478 0.300 . 1 . . . . 24 GLY N . 11336 1
189 . 1 1 25 25 TYR H H 1 8.103 0.030 . 1 . . . . 25 TYR H . 11336 1
190 . 1 1 25 25 TYR HA H 1 3.856 0.030 . 1 . . . . 25 TYR HA . 11336 1
191 . 1 1 25 25 TYR HB2 H 1 2.969 0.030 . 2 . . . . 25 TYR HB2 . 11336 1
192 . 1 1 25 25 TYR HB3 H 1 3.143 0.030 . 2 . . . . 25 TYR HB3 . 11336 1
193 . 1 1 25 25 TYR HD1 H 1 6.946 0.030 . 1 . . . . 25 TYR HD1 . 11336 1
194 . 1 1 25 25 TYR HD2 H 1 6.946 0.030 . 1 . . . . 25 TYR HD2 . 11336 1
195 . 1 1 25 25 TYR HE1 H 1 6.735 0.030 . 1 . . . . 25 TYR HE1 . 11336 1
196 . 1 1 25 25 TYR HE2 H 1 6.735 0.030 . 1 . . . . 25 TYR HE2 . 11336 1
197 . 1 1 25 25 TYR C C 13 176.359 0.300 . 1 . . . . 25 TYR C . 11336 1
198 . 1 1 25 25 TYR CA C 13 62.493 0.300 . 1 . . . . 25 TYR CA . 11336 1
199 . 1 1 25 25 TYR CB C 13 39.001 0.300 . 1 . . . . 25 TYR CB . 11336 1
200 . 1 1 25 25 TYR CD1 C 13 132.675 0.300 . 1 . . . . 25 TYR CD1 . 11336 1
201 . 1 1 25 25 TYR CD2 C 13 132.675 0.300 . 1 . . . . 25 TYR CD2 . 11336 1
202 . 1 1 25 25 TYR CE1 C 13 118.355 0.300 . 1 . . . . 25 TYR CE1 . 11336 1
203 . 1 1 25 25 TYR CE2 C 13 118.355 0.300 . 1 . . . . 25 TYR CE2 . 11336 1
204 . 1 1 25 25 TYR N N 15 119.304 0.300 . 1 . . . . 25 TYR N . 11336 1
205 . 1 1 26 26 SER H H 1 8.749 0.030 . 1 . . . . 26 SER H . 11336 1
206 . 1 1 26 26 SER HA H 1 4.806 0.030 . 1 . . . . 26 SER HA . 11336 1
207 . 1 1 26 26 SER HB2 H 1 3.853 0.030 . 2 . . . . 26 SER HB2 . 11336 1
208 . 1 1 26 26 SER HB3 H 1 3.963 0.030 . 2 . . . . 26 SER HB3 . 11336 1
209 . 1 1 26 26 SER C C 13 176.325 0.300 . 1 . . . . 26 SER C . 11336 1
210 . 1 1 26 26 SER CA C 13 61.886 0.300 . 1 . . . . 26 SER CA . 11336 1
211 . 1 1 26 26 SER CB C 13 62.301 0.300 . 1 . . . . 26 SER CB . 11336 1
212 . 1 1 26 26 SER N N 15 111.745 0.300 . 1 . . . . 26 SER N . 11336 1
213 . 1 1 27 27 GLU H H 1 7.691 0.030 . 1 . . . . 27 GLU H . 11336 1
214 . 1 1 27 27 GLU HA H 1 3.936 0.030 . 1 . . . . 27 GLU HA . 11336 1
215 . 1 1 27 27 GLU HB2 H 1 2.215 0.030 . 2 . . . . 27 GLU HB2 . 11336 1
216 . 1 1 27 27 GLU HB3 H 1 1.856 0.030 . 2 . . . . 27 GLU HB3 . 11336 1
217 . 1 1 27 27 GLU HG2 H 1 2.425 0.030 . 2 . . . . 27 GLU HG2 . 11336 1
218 . 1 1 27 27 GLU HG3 H 1 2.143 0.030 . 2 . . . . 27 GLU HG3 . 11336 1
219 . 1 1 27 27 GLU C C 13 178.578 0.300 . 1 . . . . 27 GLU C . 11336 1
220 . 1 1 27 27 GLU CA C 13 59.839 0.300 . 1 . . . . 27 GLU CA . 11336 1
221 . 1 1 27 27 GLU CB C 13 29.452 0.300 . 1 . . . . 27 GLU CB . 11336 1
222 . 1 1 27 27 GLU CG C 13 37.622 0.300 . 1 . . . . 27 GLU CG . 11336 1
223 . 1 1 27 27 GLU N N 15 121.080 0.300 . 1 . . . . 27 GLU N . 11336 1
224 . 1 1 28 28 ILE H H 1 8.018 0.030 . 1 . . . . 28 ILE H . 11336 1
225 . 1 1 28 28 ILE HA H 1 3.556 0.030 . 1 . . . . 28 ILE HA . 11336 1
226 . 1 1 28 28 ILE HB H 1 1.792 0.030 . 1 . . . . 28 ILE HB . 11336 1
227 . 1 1 28 28 ILE HD11 H 1 0.612 0.030 . 1 . . . . 28 ILE HD1 . 11336 1
228 . 1 1 28 28 ILE HD12 H 1 0.612 0.030 . 1 . . . . 28 ILE HD1 . 11336 1
229 . 1 1 28 28 ILE HD13 H 1 0.612 0.030 . 1 . . . . 28 ILE HD1 . 11336 1
230 . 1 1 28 28 ILE HG12 H 1 1.729 0.030 . 2 . . . . 28 ILE HG12 . 11336 1
231 . 1 1 28 28 ILE HG13 H 1 0.710 0.030 . 2 . . . . 28 ILE HG13 . 11336 1
232 . 1 1 28 28 ILE HG21 H 1 0.588 0.030 . 1 . . . . 28 ILE HG2 . 11336 1
233 . 1 1 28 28 ILE HG22 H 1 0.588 0.030 . 1 . . . . 28 ILE HG2 . 11336 1
234 . 1 1 28 28 ILE HG23 H 1 0.588 0.030 . 1 . . . . 28 ILE HG2 . 11336 1
235 . 1 1 28 28 ILE C C 13 176.521 0.300 . 1 . . . . 28 ILE C . 11336 1
236 . 1 1 28 28 ILE CA C 13 65.528 0.300 . 1 . . . . 28 ILE CA . 11336 1
237 . 1 1 28 28 ILE CB C 13 38.598 0.300 . 1 . . . . 28 ILE CB . 11336 1
238 . 1 1 28 28 ILE CD1 C 13 14.575 0.300 . 1 . . . . 28 ILE CD1 . 11336 1
239 . 1 1 28 28 ILE CG1 C 13 30.217 0.300 . 1 . . . . 28 ILE CG1 . 11336 1
240 . 1 1 28 28 ILE CG2 C 13 17.657 0.300 . 1 . . . . 28 ILE CG2 . 11336 1
241 . 1 1 28 28 ILE N N 15 121.368 0.300 . 1 . . . . 28 ILE N . 11336 1
242 . 1 1 29 29 VAL H H 1 7.654 0.030 . 1 . . . . 29 VAL H . 11336 1
243 . 1 1 29 29 VAL HA H 1 4.147 0.030 . 1 . . . . 29 VAL HA . 11336 1
244 . 1 1 29 29 VAL HB H 1 2.006 0.030 . 1 . . . . 29 VAL HB . 11336 1
245 . 1 1 29 29 VAL HG11 H 1 0.739 0.030 . 1 . . . . 29 VAL HG1 . 11336 1
246 . 1 1 29 29 VAL HG12 H 1 0.739 0.030 . 1 . . . . 29 VAL HG1 . 11336 1
247 . 1 1 29 29 VAL HG13 H 1 0.739 0.030 . 1 . . . . 29 VAL HG1 . 11336 1
248 . 1 1 29 29 VAL HG21 H 1 0.716 0.030 . 1 . . . . 29 VAL HG2 . 11336 1
249 . 1 1 29 29 VAL HG22 H 1 0.716 0.030 . 1 . . . . 29 VAL HG2 . 11336 1
250 . 1 1 29 29 VAL HG23 H 1 0.716 0.030 . 1 . . . . 29 VAL HG2 . 11336 1
251 . 1 1 29 29 VAL C C 13 181.154 0.300 . 1 . . . . 29 VAL C . 11336 1
252 . 1 1 29 29 VAL CA C 13 64.177 0.300 . 1 . . . . 29 VAL CA . 11336 1
253 . 1 1 29 29 VAL CB C 13 31.536 0.300 . 1 . . . . 29 VAL CB . 11336 1
254 . 1 1 29 29 VAL CG1 C 13 20.998 0.300 . 2 . . . . 29 VAL CG1 . 11336 1
255 . 1 1 29 29 VAL CG2 C 13 20.135 0.300 . 2 . . . . 29 VAL CG2 . 11336 1
256 . 1 1 29 29 VAL N N 15 111.710 0.300 . 1 . . . . 29 VAL N . 11336 1
257 . 1 1 30 30 GLN H H 1 7.889 0.030 . 1 . . . . 30 GLN H . 11336 1
258 . 1 1 30 30 GLN HA H 1 4.110 0.030 . 1 . . . . 30 GLN HA . 11336 1
259 . 1 1 30 30 GLN HB2 H 1 2.065 0.030 . 2 . . . . 30 GLN HB2 . 11336 1
260 . 1 1 30 30 GLN HB3 H 1 2.257 0.030 . 2 . . . . 30 GLN HB3 . 11336 1
261 . 1 1 30 30 GLN HE21 H 1 7.451 0.030 . 2 . . . . 30 GLN HE21 . 11336 1
262 . 1 1 30 30 GLN HE22 H 1 6.827 0.030 . 2 . . . . 30 GLN HE22 . 11336 1
263 . 1 1 30 30 GLN HG2 H 1 2.453 0.030 . 1 . . . . 30 GLN HG2 . 11336 1
264 . 1 1 30 30 GLN HG3 H 1 2.453 0.030 . 1 . . . . 30 GLN HG3 . 11336 1
265 . 1 1 30 30 GLN C C 13 176.786 0.300 . 1 . . . . 30 GLN C . 11336 1
266 . 1 1 30 30 GLN CA C 13 58.448 0.300 . 1 . . . . 30 GLN CA . 11336 1
267 . 1 1 30 30 GLN CB C 13 28.350 0.300 . 1 . . . . 30 GLN CB . 11336 1
268 . 1 1 30 30 GLN CG C 13 33.908 0.300 . 1 . . . . 30 GLN CG . 11336 1
269 . 1 1 30 30 GLN N N 15 120.886 0.300 . 1 . . . . 30 GLN N . 11336 1
270 . 1 1 30 30 GLN NE2 N 15 111.519 0.300 . 1 . . . . 30 GLN NE2 . 11336 1
271 . 1 1 31 31 ASN H H 1 7.446 0.030 . 1 . . . . 31 ASN H . 11336 1
272 . 1 1 31 31 ASN HA H 1 4.999 0.030 . 1 . . . . 31 ASN HA . 11336 1
273 . 1 1 31 31 ASN HB2 H 1 3.084 0.030 . 2 . . . . 31 ASN HB2 . 11336 1
274 . 1 1 31 31 ASN HB3 H 1 2.798 0.030 . 2 . . . . 31 ASN HB3 . 11336 1
275 . 1 1 31 31 ASN HD21 H 1 6.725 0.030 . 2 . . . . 31 ASN HD21 . 11336 1
276 . 1 1 31 31 ASN HD22 H 1 7.614 0.030 . 2 . . . . 31 ASN HD22 . 11336 1
277 . 1 1 31 31 ASN C C 13 176.259 0.300 . 1 . . . . 31 ASN C . 11336 1
278 . 1 1 31 31 ASN CA C 13 51.919 0.300 . 1 . . . . 31 ASN CA . 11336 1
279 . 1 1 31 31 ASN CB C 13 38.353 0.300 . 1 . . . . 31 ASN CB . 11336 1
280 . 1 1 31 31 ASN N N 15 114.130 0.300 . 1 . . . . 31 ASN N . 11336 1
281 . 1 1 31 31 ASN ND2 N 15 109.582 0.300 . 1 . . . . 31 ASN ND2 . 11336 1
282 . 1 1 32 32 GLY H H 1 7.732 0.030 . 1 . . . . 32 GLY H . 11336 1
283 . 1 1 32 32 GLY HA2 H 1 3.815 0.030 . 2 . . . . 32 GLY HA2 . 11336 1
284 . 1 1 32 32 GLY HA3 H 1 4.101 0.030 . 2 . . . . 32 GLY HA3 . 11336 1
285 . 1 1 32 32 GLY C C 13 174.976 0.300 . 1 . . . . 32 GLY C . 11336 1
286 . 1 1 32 32 GLY CA C 13 46.273 0.300 . 1 . . . . 32 GLY CA . 11336 1
287 . 1 1 32 32 GLY N N 15 105.623 0.300 . 1 . . . . 32 GLY N . 11336 1
288 . 1 1 33 33 ARG H H 1 7.638 0.030 . 1 . . . . 33 ARG H . 11336 1
289 . 1 1 33 33 ARG HA H 1 4.360 0.030 . 1 . . . . 33 ARG HA . 11336 1
290 . 1 1 33 33 ARG HB2 H 1 1.771 0.030 . 2 . . . . 33 ARG HB2 . 11336 1
291 . 1 1 33 33 ARG HB3 H 1 2.418 0.030 . 2 . . . . 33 ARG HB3 . 11336 1
292 . 1 1 33 33 ARG HD2 H 1 3.480 0.030 . 2 . . . . 33 ARG HD2 . 11336 1
293 . 1 1 33 33 ARG HD3 H 1 3.587 0.030 . 2 . . . . 33 ARG HD3 . 11336 1
294 . 1 1 33 33 ARG HG2 H 1 1.627 0.030 . 2 . . . . 33 ARG HG2 . 11336 1
295 . 1 1 33 33 ARG HG3 H 1 1.754 0.030 . 2 . . . . 33 ARG HG3 . 11336 1
296 . 1 1 33 33 ARG C C 13 173.608 0.300 . 1 . . . . 33 ARG C . 11336 1
297 . 1 1 33 33 ARG CA C 13 55.608 0.300 . 1 . . . . 33 ARG CA . 11336 1
298 . 1 1 33 33 ARG CB C 13 33.961 0.300 . 1 . . . . 33 ARG CB . 11336 1
299 . 1 1 33 33 ARG CD C 13 45.240 0.300 . 1 . . . . 33 ARG CD . 11336 1
300 . 1 1 33 33 ARG CG C 13 27.484 0.300 . 1 . . . . 33 ARG CG . 11336 1
301 . 1 1 33 33 ARG N N 15 118.913 0.300 . 1 . . . . 33 ARG N . 11336 1
302 . 1 1 34 34 LEU H H 1 7.949 0.030 . 1 . . . . 34 LEU H . 11336 1
303 . 1 1 34 34 LEU HA H 1 4.689 0.030 . 1 . . . . 34 LEU HA . 11336 1
304 . 1 1 34 34 LEU HB2 H 1 1.578 0.030 . 2 . . . . 34 LEU HB2 . 11336 1
305 . 1 1 34 34 LEU HB3 H 1 1.382 0.030 . 2 . . . . 34 LEU HB3 . 11336 1
306 . 1 1 34 34 LEU HD11 H 1 0.883 0.030 . 1 . . . . 34 LEU HD1 . 11336 1
307 . 1 1 34 34 LEU HD12 H 1 0.883 0.030 . 1 . . . . 34 LEU HD1 . 11336 1
308 . 1 1 34 34 LEU HD13 H 1 0.883 0.030 . 1 . . . . 34 LEU HD1 . 11336 1
309 . 1 1 34 34 LEU HD21 H 1 0.880 0.030 . 1 . . . . 34 LEU HD2 . 11336 1
310 . 1 1 34 34 LEU HD22 H 1 0.880 0.030 . 1 . . . . 34 LEU HD2 . 11336 1
311 . 1 1 34 34 LEU HD23 H 1 0.880 0.030 . 1 . . . . 34 LEU HD2 . 11336 1
312 . 1 1 34 34 LEU HG H 1 1.591 0.030 . 1 . . . . 34 LEU HG . 11336 1
313 . 1 1 34 34 LEU C C 13 176.626 0.300 . 1 . . . . 34 LEU C . 11336 1
314 . 1 1 34 34 LEU CA C 13 52.986 0.300 . 1 . . . . 34 LEU CA . 11336 1
315 . 1 1 34 34 LEU CB C 13 45.197 0.300 . 1 . . . . 34 LEU CB . 11336 1
316 . 1 1 34 34 LEU CD1 C 13 25.304 0.300 . 2 . . . . 34 LEU CD1 . 11336 1
317 . 1 1 34 34 LEU CD2 C 13 23.608 0.300 . 2 . . . . 34 LEU CD2 . 11336 1
318 . 1 1 34 34 LEU CG C 13 27.275 0.300 . 1 . . . . 34 LEU CG . 11336 1
319 . 1 1 34 34 LEU N N 15 117.587 0.300 . 1 . . . . 34 LEU N . 11336 1
320 . 1 1 35 35 ILE H H 1 8.369 0.030 . 1 . . . . 35 ILE H . 11336 1
321 . 1 1 35 35 ILE HA H 1 4.448 0.030 . 1 . . . . 35 ILE HA . 11336 1
322 . 1 1 35 35 ILE HB H 1 1.860 0.030 . 1 . . . . 35 ILE HB . 11336 1
323 . 1 1 35 35 ILE HD11 H 1 0.636 0.030 . 1 . . . . 35 ILE HD1 . 11336 1
324 . 1 1 35 35 ILE HD12 H 1 0.636 0.030 . 1 . . . . 35 ILE HD1 . 11336 1
325 . 1 1 35 35 ILE HD13 H 1 0.636 0.030 . 1 . . . . 35 ILE HD1 . 11336 1
326 . 1 1 35 35 ILE HG12 H 1 1.241 0.030 . 2 . . . . 35 ILE HG12 . 11336 1
327 . 1 1 35 35 ILE HG13 H 1 1.447 0.030 . 2 . . . . 35 ILE HG13 . 11336 1
328 . 1 1 35 35 ILE HG21 H 1 0.762 0.030 . 1 . . . . 35 ILE HG2 . 11336 1
329 . 1 1 35 35 ILE HG22 H 1 0.762 0.030 . 1 . . . . 35 ILE HG2 . 11336 1
330 . 1 1 35 35 ILE HG23 H 1 0.762 0.030 . 1 . . . . 35 ILE HG2 . 11336 1
331 . 1 1 35 35 ILE C C 13 175.857 0.300 . 1 . . . . 35 ILE C . 11336 1
332 . 1 1 35 35 ILE CA C 13 60.148 0.300 . 1 . . . . 35 ILE CA . 11336 1
333 . 1 1 35 35 ILE CB C 13 37.040 0.300 . 1 . . . . 35 ILE CB . 11336 1
334 . 1 1 35 35 ILE CD1 C 13 12.122 0.300 . 1 . . . . 35 ILE CD1 . 11336 1
335 . 1 1 35 35 ILE CG1 C 13 27.686 0.300 . 1 . . . . 35 ILE CG1 . 11336 1
336 . 1 1 35 35 ILE CG2 C 13 18.216 0.300 . 1 . . . . 35 ILE CG2 . 11336 1
337 . 1 1 35 35 ILE N N 15 120.666 0.300 . 1 . . . . 35 ILE N . 11336 1
338 . 1 1 36 36 VAL H H 1 9.198 0.030 . 1 . . . . 36 VAL H . 11336 1
339 . 1 1 36 36 VAL HA H 1 4.534 0.030 . 1 . . . . 36 VAL HA . 11336 1
340 . 1 1 36 36 VAL HB H 1 2.021 0.030 . 1 . . . . 36 VAL HB . 11336 1
341 . 1 1 36 36 VAL HG11 H 1 0.832 0.030 . 1 . . . . 36 VAL HG1 . 11336 1
342 . 1 1 36 36 VAL HG12 H 1 0.832 0.030 . 1 . . . . 36 VAL HG1 . 11336 1
343 . 1 1 36 36 VAL HG13 H 1 0.832 0.030 . 1 . . . . 36 VAL HG1 . 11336 1
344 . 1 1 36 36 VAL HG21 H 1 0.787 0.030 . 1 . . . . 36 VAL HG2 . 11336 1
345 . 1 1 36 36 VAL HG22 H 1 0.787 0.030 . 1 . . . . 36 VAL HG2 . 11336 1
346 . 1 1 36 36 VAL HG23 H 1 0.787 0.030 . 1 . . . . 36 VAL HG2 . 11336 1
347 . 1 1 36 36 VAL C C 13 173.450 0.300 . 1 . . . . 36 VAL C . 11336 1
348 . 1 1 36 36 VAL CA C 13 60.137 0.300 . 1 . . . . 36 VAL CA . 11336 1
349 . 1 1 36 36 VAL CB C 13 34.926 0.300 . 1 . . . . 36 VAL CB . 11336 1
350 . 1 1 36 36 VAL CG1 C 13 21.749 0.300 . 2 . . . . 36 VAL CG1 . 11336 1
351 . 1 1 36 36 VAL CG2 C 13 19.989 0.300 . 2 . . . . 36 VAL CG2 . 11336 1
352 . 1 1 36 36 VAL N N 15 126.042 0.300 . 1 . . . . 36 VAL N . 11336 1
353 . 1 1 37 37 SER H H 1 8.262 0.030 . 1 . . . . 37 SER H . 11336 1
354 . 1 1 37 37 SER HA H 1 5.573 0.030 . 1 . . . . 37 SER HA . 11336 1
355 . 1 1 37 37 SER HB2 H 1 3.630 0.030 . 2 . . . . 37 SER HB2 . 11336 1
356 . 1 1 37 37 SER HB3 H 1 3.712 0.030 . 2 . . . . 37 SER HB3 . 11336 1
357 . 1 1 37 37 SER C C 13 175.956 0.300 . 1 . . . . 37 SER C . 11336 1
358 . 1 1 37 37 SER CA C 13 55.956 0.300 . 1 . . . . 37 SER CA . 11336 1
359 . 1 1 37 37 SER CB C 13 65.320 0.300 . 1 . . . . 37 SER CB . 11336 1
360 . 1 1 37 37 SER N N 15 115.782 0.300 . 1 . . . . 37 SER N . 11336 1
361 . 1 1 38 38 THR H H 1 9.274 0.030 . 1 . . . . 38 THR H . 11336 1
362 . 1 1 38 38 THR HA H 1 4.811 0.030 . 1 . . . . 38 THR HA . 11336 1
363 . 1 1 38 38 THR HB H 1 4.665 0.030 . 1 . . . . 38 THR HB . 11336 1
364 . 1 1 38 38 THR HG21 H 1 1.543 0.030 . 1 . . . . 38 THR HG2 . 11336 1
365 . 1 1 38 38 THR HG22 H 1 1.543 0.030 . 1 . . . . 38 THR HG2 . 11336 1
366 . 1 1 38 38 THR HG23 H 1 1.543 0.030 . 1 . . . . 38 THR HG2 . 11336 1
367 . 1 1 38 38 THR C C 13 178.405 0.300 . 1 . . . . 38 THR C . 11336 1
368 . 1 1 38 38 THR CA C 13 61.210 0.300 . 1 . . . . 38 THR CA . 11336 1
369 . 1 1 38 38 THR CB C 13 70.996 0.300 . 1 . . . . 38 THR CB . 11336 1
370 . 1 1 38 38 THR CG2 C 13 23.431 0.300 . 1 . . . . 38 THR CG2 . 11336 1
371 . 1 1 38 38 THR N N 15 115.904 0.300 . 1 . . . . 38 THR N . 11336 1
372 . 1 1 39 39 GLU H H 1 7.015 0.030 . 1 . . . . 39 GLU H . 11336 1
373 . 1 1 39 39 GLU HA H 1 4.157 0.030 . 1 . . . . 39 GLU HA . 11336 1
374 . 1 1 39 39 GLU HB2 H 1 2.180 0.030 . 1 . . . . 39 GLU HB2 . 11336 1
375 . 1 1 39 39 GLU HB3 H 1 2.180 0.030 . 1 . . . . 39 GLU HB3 . 11336 1
376 . 1 1 39 39 GLU HG2 H 1 2.371 0.030 . 1 . . . . 39 GLU HG2 . 11336 1
377 . 1 1 39 39 GLU HG3 H 1 2.371 0.030 . 1 . . . . 39 GLU HG3 . 11336 1
378 . 1 1 39 39 GLU C C 13 176.483 0.300 . 1 . . . . 39 GLU C . 11336 1
379 . 1 1 39 39 GLU CA C 13 59.186 0.300 . 1 . . . . 39 GLU CA . 11336 1
380 . 1 1 39 39 GLU CB C 13 29.397 0.300 . 1 . . . . 39 GLU CB . 11336 1
381 . 1 1 39 39 GLU CG C 13 36.475 0.300 . 1 . . . . 39 GLU CG . 11336 1
382 . 1 1 40 40 CYS H H 1 7.713 0.030 . 1 . . . . 40 CYS H . 11336 1
383 . 1 1 40 40 CYS HA H 1 4.514 0.030 . 1 . . . . 40 CYS HA . 11336 1
384 . 1 1 40 40 CYS HB2 H 1 2.749 0.030 . 2 . . . . 40 CYS HB2 . 11336 1
385 . 1 1 40 40 CYS HB3 H 1 3.266 0.030 . 2 . . . . 40 CYS HB3 . 11336 1
386 . 1 1 40 40 CYS C C 13 174.624 0.300 . 1 . . . . 40 CYS C . 11336 1
387 . 1 1 40 40 CYS CA C 13 55.697 0.300 . 1 . . . . 40 CYS CA . 11336 1
388 . 1 1 40 40 CYS CB C 13 29.280 0.300 . 1 . . . . 40 CYS CB . 11336 1
389 . 1 1 40 40 CYS N N 15 113.724 0.300 . 1 . . . . 40 CYS N . 11336 1
390 . 1 1 41 41 GLY H H 1 7.862 0.030 . 1 . . . . 41 GLY H . 11336 1
391 . 1 1 41 41 GLY HA2 H 1 3.543 0.030 . 2 . . . . 41 GLY HA2 . 11336 1
392 . 1 1 41 41 GLY HA3 H 1 3.748 0.030 . 2 . . . . 41 GLY HA3 . 11336 1
393 . 1 1 41 41 GLY C C 13 173.570 0.300 . 1 . . . . 41 GLY C . 11336 1
394 . 1 1 41 41 GLY CA C 13 45.798 0.300 . 1 . . . . 41 GLY CA . 11336 1
395 . 1 1 41 41 GLY N N 15 109.925 0.300 . 1 . . . . 41 GLY N . 11336 1
396 . 1 1 42 42 HIS H H 1 7.825 0.030 . 1 . . . . 42 HIS H . 11336 1
397 . 1 1 42 42 HIS HA H 1 4.803 0.030 . 1 . . . . 42 HIS HA . 11336 1
398 . 1 1 42 42 HIS HB2 H 1 3.201 0.030 . 1 . . . . 42 HIS HB2 . 11336 1
399 . 1 1 42 42 HIS HB3 H 1 3.201 0.030 . 1 . . . . 42 HIS HB3 . 11336 1
400 . 1 1 42 42 HIS HD2 H 1 7.272 0.030 . 1 . . . . 42 HIS HD2 . 11336 1
401 . 1 1 42 42 HIS HE1 H 1 7.853 0.030 . 1 . . . . 42 HIS HE1 . 11336 1
402 . 1 1 42 42 HIS C C 13 172.556 0.300 . 1 . . . . 42 HIS C . 11336 1
403 . 1 1 42 42 HIS CA C 13 58.266 0.300 . 1 . . . . 42 HIS CA . 11336 1
404 . 1 1 42 42 HIS CB C 13 32.017 0.300 . 1 . . . . 42 HIS CB . 11336 1
405 . 1 1 42 42 HIS CD2 C 13 118.993 0.300 . 1 . . . . 42 HIS CD2 . 11336 1
406 . 1 1 42 42 HIS CE1 C 13 139.327 0.300 . 1 . . . . 42 HIS CE1 . 11336 1
407 . 1 1 42 42 HIS N N 15 121.652 0.300 . 1 . . . . 42 HIS N . 11336 1
408 . 1 1 43 43 VAL H H 1 7.490 0.030 . 1 . . . . 43 VAL H . 11336 1
409 . 1 1 43 43 VAL HA H 1 4.976 0.030 . 1 . . . . 43 VAL HA . 11336 1
410 . 1 1 43 43 VAL HB H 1 1.738 0.030 . 1 . . . . 43 VAL HB . 11336 1
411 . 1 1 43 43 VAL HG11 H 1 0.775 0.030 . 1 . . . . 43 VAL HG1 . 11336 1
412 . 1 1 43 43 VAL HG12 H 1 0.775 0.030 . 1 . . . . 43 VAL HG1 . 11336 1
413 . 1 1 43 43 VAL HG13 H 1 0.775 0.030 . 1 . . . . 43 VAL HG1 . 11336 1
414 . 1 1 43 43 VAL HG21 H 1 0.810 0.030 . 1 . . . . 43 VAL HG2 . 11336 1
415 . 1 1 43 43 VAL HG22 H 1 0.810 0.030 . 1 . . . . 43 VAL HG2 . 11336 1
416 . 1 1 43 43 VAL HG23 H 1 0.810 0.030 . 1 . . . . 43 VAL HG2 . 11336 1
417 . 1 1 43 43 VAL C C 13 174.274 0.300 . 1 . . . . 43 VAL C . 11336 1
418 . 1 1 43 43 VAL CA C 13 61.286 0.300 . 1 . . . . 43 VAL CA . 11336 1
419 . 1 1 43 43 VAL CB C 13 33.966 0.300 . 1 . . . . 43 VAL CB . 11336 1
420 . 1 1 43 43 VAL CG1 C 13 21.749 0.300 . 2 . . . . 43 VAL CG1 . 11336 1
421 . 1 1 43 43 VAL CG2 C 13 21.058 0.300 . 2 . . . . 43 VAL CG2 . 11336 1
422 . 1 1 43 43 VAL N N 15 121.335 0.300 . 1 . . . . 43 VAL N . 11336 1
423 . 1 1 44 44 PHE H H 1 8.574 0.030 . 1 . . . . 44 PHE H . 11336 1
424 . 1 1 44 44 PHE HA H 1 5.168 0.030 . 1 . . . . 44 PHE HA . 11336 1
425 . 1 1 44 44 PHE HB2 H 1 3.559 0.030 . 2 . . . . 44 PHE HB2 . 11336 1
426 . 1 1 44 44 PHE HB3 H 1 2.398 0.030 . 2 . . . . 44 PHE HB3 . 11336 1
427 . 1 1 44 44 PHE HD1 H 1 7.141 0.030 . 1 . . . . 44 PHE HD1 . 11336 1
428 . 1 1 44 44 PHE HD2 H 1 7.141 0.030 . 1 . . . . 44 PHE HD2 . 11336 1
429 . 1 1 44 44 PHE HE1 H 1 7.298 0.030 . 1 . . . . 44 PHE HE1 . 11336 1
430 . 1 1 44 44 PHE HE2 H 1 7.298 0.030 . 1 . . . . 44 PHE HE2 . 11336 1
431 . 1 1 44 44 PHE HZ H 1 7.508 0.030 . 1 . . . . 44 PHE HZ . 11336 1
432 . 1 1 44 44 PHE C C 13 175.122 0.300 . 1 . . . . 44 PHE C . 11336 1
433 . 1 1 44 44 PHE CA C 13 56.106 0.300 . 1 . . . . 44 PHE CA . 11336 1
434 . 1 1 44 44 PHE CB C 13 46.812 0.300 . 1 . . . . 44 PHE CB . 11336 1
435 . 1 1 44 44 PHE CD1 C 13 132.731 0.300 . 1 . . . . 44 PHE CD1 . 11336 1
436 . 1 1 44 44 PHE CD2 C 13 132.731 0.300 . 1 . . . . 44 PHE CD2 . 11336 1
437 . 1 1 44 44 PHE CE1 C 13 130.927 0.300 . 1 . . . . 44 PHE CE1 . 11336 1
438 . 1 1 44 44 PHE CE2 C 13 130.927 0.300 . 1 . . . . 44 PHE CE2 . 11336 1
439 . 1 1 44 44 PHE CZ C 13 130.899 0.300 . 1 . . . . 44 PHE CZ . 11336 1
440 . 1 1 44 44 PHE N N 15 119.959 0.300 . 1 . . . . 44 PHE N . 11336 1
441 . 1 1 45 45 CYS H H 1 9.857 0.030 . 1 . . . . 45 CYS H . 11336 1
442 . 1 1 45 45 CYS HA H 1 5.792 0.030 . 1 . . . . 45 CYS HA . 11336 1
443 . 1 1 45 45 CYS HB2 H 1 2.905 0.030 . 2 . . . . 45 CYS HB2 . 11336 1
444 . 1 1 45 45 CYS HB3 H 1 3.289 0.030 . 2 . . . . 45 CYS HB3 . 11336 1
445 . 1 1 45 45 CYS C C 13 177.189 0.300 . 1 . . . . 45 CYS C . 11336 1
446 . 1 1 45 45 CYS CA C 13 57.882 0.300 . 1 . . . . 45 CYS CA . 11336 1
447 . 1 1 45 45 CYS CB C 13 32.172 0.300 . 1 . . . . 45 CYS CB . 11336 1
448 . 1 1 45 45 CYS N N 15 116.638 0.300 . 1 . . . . 45 CYS N . 11336 1
449 . 1 1 46 46 SER H H 1 9.221 0.030 . 1 . . . . 46 SER H . 11336 1
450 . 1 1 46 46 SER HA H 1 3.881 0.030 . 1 . . . . 46 SER HA . 11336 1
451 . 1 1 46 46 SER HB2 H 1 3.870 0.030 . 2 . . . . 46 SER HB2 . 11336 1
452 . 1 1 46 46 SER HB3 H 1 3.991 0.030 . 2 . . . . 46 SER HB3 . 11336 1
453 . 1 1 46 46 SER C C 13 176.826 0.300 . 1 . . . . 46 SER C . 11336 1
454 . 1 1 46 46 SER CA C 13 60.783 0.300 . 1 . . . . 46 SER CA . 11336 1
455 . 1 1 46 46 SER CB C 13 61.557 0.300 . 1 . . . . 46 SER CB . 11336 1
456 . 1 1 46 46 SER N N 15 113.645 0.300 . 1 . . . . 46 SER N . 11336 1
457 . 1 1 47 47 GLN H H 1 7.235 0.030 . 1 . . . . 47 GLN H . 11336 1
458 . 1 1 47 47 GLN HA H 1 4.072 0.030 . 1 . . . . 47 GLN HA . 11336 1
459 . 1 1 47 47 GLN HB2 H 1 2.337 0.030 . 2 . . . . 47 GLN HB2 . 11336 1
460 . 1 1 47 47 GLN HB3 H 1 2.072 0.030 . 2 . . . . 47 GLN HB3 . 11336 1
461 . 1 1 47 47 GLN HE21 H 1 7.800 0.030 . 2 . . . . 47 GLN HE21 . 11336 1
462 . 1 1 47 47 GLN HE22 H 1 6.872 0.030 . 2 . . . . 47 GLN HE22 . 11336 1
463 . 1 1 47 47 GLN HG2 H 1 2.299 0.030 . 2 . . . . 47 GLN HG2 . 11336 1
464 . 1 1 47 47 GLN HG3 H 1 2.362 0.030 . 2 . . . . 47 GLN HG3 . 11336 1
465 . 1 1 47 47 GLN C C 13 176.949 0.300 . 1 . . . . 47 GLN C . 11336 1
466 . 1 1 47 47 GLN CA C 13 58.869 0.300 . 1 . . . . 47 GLN CA . 11336 1
467 . 1 1 47 47 GLN CB C 13 29.920 0.300 . 1 . . . . 47 GLN CB . 11336 1
468 . 1 1 47 47 GLN CG C 13 33.818 0.300 . 1 . . . . 47 GLN CG . 11336 1
469 . 1 1 47 47 GLN N N 15 123.348 0.300 . 1 . . . . 47 GLN N . 11336 1
470 . 1 1 47 47 GLN NE2 N 15 114.327 0.300 . 1 . . . . 47 GLN NE2 . 11336 1
471 . 1 1 48 48 CYS H H 1 8.997 0.030 . 1 . . . . 48 CYS H . 11336 1
472 . 1 1 48 48 CYS HA H 1 3.977 0.030 . 1 . . . . 48 CYS HA . 11336 1
473 . 1 1 48 48 CYS HB2 H 1 3.043 0.030 . 2 . . . . 48 CYS HB2 . 11336 1
474 . 1 1 48 48 CYS HB3 H 1 2.834 0.030 . 2 . . . . 48 CYS HB3 . 11336 1
475 . 1 1 48 48 CYS C C 13 179.761 0.300 . 1 . . . . 48 CYS C . 11336 1
476 . 1 1 48 48 CYS CA C 13 64.762 0.300 . 1 . . . . 48 CYS CA . 11336 1
477 . 1 1 48 48 CYS CB C 13 29.981 0.300 . 1 . . . . 48 CYS CB . 11336 1
478 . 1 1 48 48 CYS N N 15 123.085 0.300 . 1 . . . . 48 CYS N . 11336 1
479 . 1 1 49 49 LEU H H 1 8.131 0.030 . 1 . . . . 49 LEU H . 11336 1
480 . 1 1 49 49 LEU HA H 1 3.767 0.030 . 1 . . . . 49 LEU HA . 11336 1
481 . 1 1 49 49 LEU HB2 H 1 1.727 0.030 . 2 . . . . 49 LEU HB2 . 11336 1
482 . 1 1 49 49 LEU HB3 H 1 1.178 0.030 . 2 . . . . 49 LEU HB3 . 11336 1
483 . 1 1 49 49 LEU HD11 H 1 0.375 0.030 . 1 . . . . 49 LEU HD1 . 11336 1
484 . 1 1 49 49 LEU HD12 H 1 0.375 0.030 . 1 . . . . 49 LEU HD1 . 11336 1
485 . 1 1 49 49 LEU HD13 H 1 0.375 0.030 . 1 . . . . 49 LEU HD1 . 11336 1
486 . 1 1 49 49 LEU HD21 H 1 0.699 0.030 . 1 . . . . 49 LEU HD2 . 11336 1
487 . 1 1 49 49 LEU HD22 H 1 0.699 0.030 . 1 . . . . 49 LEU HD2 . 11336 1
488 . 1 1 49 49 LEU HD23 H 1 0.699 0.030 . 1 . . . . 49 LEU HD2 . 11336 1
489 . 1 1 49 49 LEU HG H 1 1.424 0.030 . 1 . . . . 49 LEU HG . 11336 1
490 . 1 1 49 49 LEU C C 13 177.446 0.300 . 1 . . . . 49 LEU C . 11336 1
491 . 1 1 49 49 LEU CA C 13 57.926 0.300 . 1 . . . . 49 LEU CA . 11336 1
492 . 1 1 49 49 LEU CB C 13 41.352 0.300 . 1 . . . . 49 LEU CB . 11336 1
493 . 1 1 49 49 LEU CD1 C 13 21.888 0.300 . 2 . . . . 49 LEU CD1 . 11336 1
494 . 1 1 49 49 LEU CD2 C 13 26.031 0.300 . 2 . . . . 49 LEU CD2 . 11336 1
495 . 1 1 49 49 LEU CG C 13 26.659 0.300 . 1 . . . . 49 LEU CG . 11336 1
496 . 1 1 49 49 LEU N N 15 119.426 0.300 . 1 . . . . 49 LEU N . 11336 1
497 . 1 1 50 50 ARG H H 1 7.612 0.030 . 1 . . . . 50 ARG H . 11336 1
498 . 1 1 50 50 ARG HA H 1 3.861 0.030 . 1 . . . . 50 ARG HA . 11336 1
499 . 1 1 50 50 ARG HB2 H 1 1.971 0.030 . 1 . . . . 50 ARG HB2 . 11336 1
500 . 1 1 50 50 ARG HB3 H 1 1.971 0.030 . 1 . . . . 50 ARG HB3 . 11336 1
501 . 1 1 50 50 ARG HD2 H 1 3.200 0.030 . 1 . . . . 50 ARG HD2 . 11336 1
502 . 1 1 50 50 ARG HD3 H 1 3.200 0.030 . 1 . . . . 50 ARG HD3 . 11336 1
503 . 1 1 50 50 ARG HG2 H 1 1.770 0.030 . 2 . . . . 50 ARG HG2 . 11336 1
504 . 1 1 50 50 ARG HG3 H 1 1.558 0.030 . 2 . . . . 50 ARG HG3 . 11336 1
505 . 1 1 50 50 ARG C C 13 179.403 0.300 . 1 . . . . 50 ARG C . 11336 1
506 . 1 1 50 50 ARG CA C 13 59.732 0.300 . 1 . . . . 50 ARG CA . 11336 1
507 . 1 1 50 50 ARG CB C 13 29.726 0.300 . 1 . . . . 50 ARG CB . 11336 1
508 . 1 1 50 50 ARG CD C 13 43.542 0.300 . 1 . . . . 50 ARG CD . 11336 1
509 . 1 1 50 50 ARG CG C 13 27.213 0.300 . 1 . . . . 50 ARG CG . 11336 1
510 . 1 1 50 50 ARG N N 15 118.242 0.300 . 1 . . . . 50 ARG N . 11336 1
511 . 1 1 51 51 ASP H H 1 8.283 0.030 . 1 . . . . 51 ASP H . 11336 1
512 . 1 1 51 51 ASP HA H 1 4.365 0.030 . 1 . . . . 51 ASP HA . 11336 1
513 . 1 1 51 51 ASP HB2 H 1 2.712 0.030 . 2 . . . . 51 ASP HB2 . 11336 1
514 . 1 1 51 51 ASP HB3 H 1 2.625 0.030 . 2 . . . . 51 ASP HB3 . 11336 1
515 . 1 1 51 51 ASP C C 13 178.926 0.300 . 1 . . . . 51 ASP C . 11336 1
516 . 1 1 51 51 ASP CA C 13 57.339 0.300 . 1 . . . . 51 ASP CA . 11336 1
517 . 1 1 51 51 ASP CB C 13 40.027 0.300 . 1 . . . . 51 ASP CB . 11336 1
518 . 1 1 51 51 ASP N N 15 118.541 0.300 . 1 . . . . 51 ASP N . 11336 1
519 . 1 1 52 52 SER H H 1 7.918 0.030 . 1 . . . . 52 SER H . 11336 1
520 . 1 1 52 52 SER HA H 1 4.249 0.030 . 1 . . . . 52 SER HA . 11336 1
521 . 1 1 52 52 SER HB2 H 1 3.814 0.030 . 2 . . . . 52 SER HB2 . 11336 1
522 . 1 1 52 52 SER HB3 H 1 3.945 0.030 . 2 . . . . 52 SER HB3 . 11336 1
523 . 1 1 52 52 SER C C 13 177.378 0.300 . 1 . . . . 52 SER C . 11336 1
524 . 1 1 52 52 SER CA C 13 62.052 0.300 . 1 . . . . 52 SER CA . 11336 1
525 . 1 1 52 52 SER CB C 13 63.102 0.300 . 1 . . . . 52 SER CB . 11336 1
526 . 1 1 52 52 SER N N 15 116.504 0.300 . 1 . . . . 52 SER N . 11336 1
527 . 1 1 53 53 LEU H H 1 8.110 0.030 . 1 . . . . 53 LEU H . 11336 1
528 . 1 1 53 53 LEU HA H 1 4.737 0.030 . 1 . . . . 53 LEU HA . 11336 1
529 . 1 1 53 53 LEU HB2 H 1 1.740 0.030 . 2 . . . . 53 LEU HB2 . 11336 1
530 . 1 1 53 53 LEU HB3 H 1 1.469 0.030 . 2 . . . . 53 LEU HB3 . 11336 1
531 . 1 1 53 53 LEU HD11 H 1 0.758 0.030 . 1 . . . . 53 LEU HD1 . 11336 1
532 . 1 1 53 53 LEU HD12 H 1 0.758 0.030 . 1 . . . . 53 LEU HD1 . 11336 1
533 . 1 1 53 53 LEU HD13 H 1 0.758 0.030 . 1 . . . . 53 LEU HD1 . 11336 1
534 . 1 1 53 53 LEU HD21 H 1 0.704 0.030 . 1 . . . . 53 LEU HD2 . 11336 1
535 . 1 1 53 53 LEU HD22 H 1 0.704 0.030 . 1 . . . . 53 LEU HD2 . 11336 1
536 . 1 1 53 53 LEU HD23 H 1 0.704 0.030 . 1 . . . . 53 LEU HD2 . 11336 1
537 . 1 1 53 53 LEU HG H 1 1.736 0.030 . 1 . . . . 53 LEU HG . 11336 1
538 . 1 1 53 53 LEU C C 13 178.305 0.300 . 1 . . . . 53 LEU C . 11336 1
539 . 1 1 53 53 LEU CA C 13 55.801 0.300 . 1 . . . . 53 LEU CA . 11336 1
540 . 1 1 53 53 LEU CB C 13 41.385 0.300 . 1 . . . . 53 LEU CB . 11336 1
541 . 1 1 53 53 LEU CD1 C 13 22.482 0.300 . 2 . . . . 53 LEU CD1 . 11336 1
542 . 1 1 53 53 LEU CD2 C 13 26.054 0.300 . 2 . . . . 53 LEU CD2 . 11336 1
543 . 1 1 53 53 LEU CG C 13 26.818 0.300 . 1 . . . . 53 LEU CG . 11336 1
544 . 1 1 53 53 LEU N N 15 121.020 0.300 . 1 . . . . 53 LEU N . 11336 1
545 . 1 1 54 54 LYS H H 1 7.310 0.030 . 1 . . . . 54 LYS H . 11336 1
546 . 1 1 54 54 LYS HA H 1 4.045 0.030 . 1 . . . . 54 LYS HA . 11336 1
547 . 1 1 54 54 LYS HB2 H 1 1.846 0.030 . 1 . . . . 54 LYS HB2 . 11336 1
548 . 1 1 54 54 LYS HB3 H 1 1.846 0.030 . 1 . . . . 54 LYS HB3 . 11336 1
549 . 1 1 54 54 LYS HD2 H 1 1.703 0.030 . 1 . . . . 54 LYS HD2 . 11336 1
550 . 1 1 54 54 LYS HD3 H 1 1.703 0.030 . 1 . . . . 54 LYS HD3 . 11336 1
551 . 1 1 54 54 LYS HE2 H 1 2.968 0.030 . 1 . . . . 54 LYS HE2 . 11336 1
552 . 1 1 54 54 LYS HE3 H 1 2.968 0.030 . 1 . . . . 54 LYS HE3 . 11336 1
553 . 1 1 54 54 LYS HG2 H 1 1.637 0.030 . 2 . . . . 54 LYS HG2 . 11336 1
554 . 1 1 54 54 LYS HG3 H 1 1.430 0.030 . 2 . . . . 54 LYS HG3 . 11336 1
555 . 1 1 54 54 LYS C C 13 177.495 0.300 . 1 . . . . 54 LYS C . 11336 1
556 . 1 1 54 54 LYS CA C 13 58.701 0.300 . 1 . . . . 54 LYS CA . 11336 1
557 . 1 1 54 54 LYS CB C 13 32.433 0.300 . 1 . . . . 54 LYS CB . 11336 1
558 . 1 1 54 54 LYS CD C 13 29.375 0.300 . 1 . . . . 54 LYS CD . 11336 1
559 . 1 1 54 54 LYS CE C 13 42.122 0.300 . 1 . . . . 54 LYS CE . 11336 1
560 . 1 1 54 54 LYS CG C 13 25.057 0.300 . 1 . . . . 54 LYS CG . 11336 1
561 . 1 1 54 54 LYS N N 15 117.957 0.300 . 1 . . . . 54 LYS N . 11336 1
562 . 1 1 55 55 ASN H H 1 7.639 0.030 . 1 . . . . 55 ASN H . 11336 1
563 . 1 1 55 55 ASN HA H 1 4.796 0.030 . 1 . . . . 55 ASN HA . 11336 1
564 . 1 1 55 55 ASN HB2 H 1 2.865 0.030 . 2 . . . . 55 ASN HB2 . 11336 1
565 . 1 1 55 55 ASN HB3 H 1 2.773 0.030 . 2 . . . . 55 ASN HB3 . 11336 1
566 . 1 1 55 55 ASN HD21 H 1 6.920 0.030 . 2 . . . . 55 ASN HD21 . 11336 1
567 . 1 1 55 55 ASN HD22 H 1 7.671 0.030 . 2 . . . . 55 ASN HD22 . 11336 1
568 . 1 1 55 55 ASN C C 13 174.540 0.300 . 1 . . . . 55 ASN C . 11336 1
569 . 1 1 55 55 ASN CA C 13 53.785 0.300 . 1 . . . . 55 ASN CA . 11336 1
570 . 1 1 55 55 ASN CB C 13 40.264 0.300 . 1 . . . . 55 ASN CB . 11336 1
571 . 1 1 55 55 ASN N N 15 114.654 0.300 . 1 . . . . 55 ASN N . 11336 1
572 . 1 1 55 55 ASN ND2 N 15 114.257 0.300 . 1 . . . . 55 ASN ND2 . 11336 1
573 . 1 1 56 56 ALA H H 1 7.896 0.030 . 1 . . . . 56 ALA H . 11336 1
574 . 1 1 56 56 ALA HA H 1 4.490 0.030 . 1 . . . . 56 ALA HA . 11336 1
575 . 1 1 56 56 ALA HB1 H 1 1.394 0.030 . 1 . . . . 56 ALA HB . 11336 1
576 . 1 1 56 56 ALA HB2 H 1 1.394 0.030 . 1 . . . . 56 ALA HB . 11336 1
577 . 1 1 56 56 ALA HB3 H 1 1.394 0.030 . 1 . . . . 56 ALA HB . 11336 1
578 . 1 1 56 56 ALA C C 13 176.421 0.300 . 1 . . . . 56 ALA C . 11336 1
579 . 1 1 56 56 ALA CA C 13 52.389 0.300 . 1 . . . . 56 ALA CA . 11336 1
580 . 1 1 56 56 ALA CB C 13 21.497 0.300 . 1 . . . . 56 ALA CB . 11336 1
581 . 1 1 56 56 ALA N N 15 121.067 0.300 . 1 . . . . 56 ALA N . 11336 1
582 . 1 1 57 57 ASN HA H 1 4.847 0.030 . 1 . . . . 57 ASN HA . 11336 1
583 . 1 1 57 57 ASN HB2 H 1 2.943 0.030 . 2 . . . . 57 ASN HB2 . 11336 1
584 . 1 1 57 57 ASN HB3 H 1 3.009 0.030 . 2 . . . . 57 ASN HB3 . 11336 1
585 . 1 1 57 57 ASN HD21 H 1 7.539 0.030 . 2 . . . . 57 ASN HD21 . 11336 1
586 . 1 1 57 57 ASN HD22 H 1 6.819 0.030 . 2 . . . . 57 ASN HD22 . 11336 1
587 . 1 1 57 57 ASN C C 13 174.417 0.300 . 1 . . . . 57 ASN C . 11336 1
588 . 1 1 57 57 ASN CA C 13 52.582 0.300 . 1 . . . . 57 ASN CA . 11336 1
589 . 1 1 57 57 ASN CB C 13 37.629 0.300 . 1 . . . . 57 ASN CB . 11336 1
590 . 1 1 57 57 ASN ND2 N 15 110.999 0.300 . 1 . . . . 57 ASN ND2 . 11336 1
591 . 1 1 58 58 THR H H 1 7.128 0.030 . 1 . . . . 58 THR H . 11336 1
592 . 1 1 58 58 THR HA H 1 4.753 0.030 . 1 . . . . 58 THR HA . 11336 1
593 . 1 1 58 58 THR HB H 1 3.633 0.030 . 1 . . . . 58 THR HB . 11336 1
594 . 1 1 58 58 THR HG21 H 1 0.956 0.030 . 1 . . . . 58 THR HG2 . 11336 1
595 . 1 1 58 58 THR HG22 H 1 0.956 0.030 . 1 . . . . 58 THR HG2 . 11336 1
596 . 1 1 58 58 THR HG23 H 1 0.956 0.030 . 1 . . . . 58 THR HG2 . 11336 1
597 . 1 1 58 58 THR C C 13 173.510 0.300 . 1 . . . . 58 THR C . 11336 1
598 . 1 1 58 58 THR CA C 13 58.346 0.300 . 1 . . . . 58 THR CA . 11336 1
599 . 1 1 58 58 THR CB C 13 71.825 0.300 . 1 . . . . 58 THR CB . 11336 1
600 . 1 1 58 58 THR CG2 C 13 22.063 0.300 . 1 . . . . 58 THR CG2 . 11336 1
601 . 1 1 58 58 THR N N 15 106.800 0.300 . 1 . . . . 58 THR N . 11336 1
602 . 1 1 59 59 CYS H H 1 9.055 0.030 . 1 . . . . 59 CYS H . 11336 1
603 . 1 1 59 59 CYS HA H 1 4.260 0.030 . 1 . . . . 59 CYS HA . 11336 1
604 . 1 1 59 59 CYS HB2 H 1 3.064 0.030 . 2 . . . . 59 CYS HB2 . 11336 1
605 . 1 1 59 59 CYS HB3 H 1 3.198 0.030 . 2 . . . . 59 CYS HB3 . 11336 1
606 . 1 1 59 59 CYS C C 13 176.700 0.300 . 1 . . . . 59 CYS C . 11336 1
607 . 1 1 59 59 CYS CA C 13 57.337 0.300 . 1 . . . . 59 CYS CA . 11336 1
608 . 1 1 59 59 CYS CB C 13 31.563 0.300 . 1 . . . . 59 CYS CB . 11336 1
609 . 1 1 59 59 CYS N N 15 125.092 0.300 . 1 . . . . 59 CYS N . 11336 1
610 . 1 1 60 60 PRO HA H 1 4.201 0.030 . 1 . . . . 60 PRO HA . 11336 1
611 . 1 1 60 60 PRO HB2 H 1 1.873 0.030 . 2 . . . . 60 PRO HB2 . 11336 1
612 . 1 1 60 60 PRO HB3 H 1 2.359 0.030 . 2 . . . . 60 PRO HB3 . 11336 1
613 . 1 1 60 60 PRO HD2 H 1 3.378 0.030 . 2 . . . . 60 PRO HD2 . 11336 1
614 . 1 1 60 60 PRO HD3 H 1 3.741 0.030 . 2 . . . . 60 PRO HD3 . 11336 1
615 . 1 1 60 60 PRO HG2 H 1 1.737 0.030 . 2 . . . . 60 PRO HG2 . 11336 1
616 . 1 1 60 60 PRO HG3 H 1 1.185 0.030 . 2 . . . . 60 PRO HG3 . 11336 1
617 . 1 1 60 60 PRO C C 13 177.030 0.300 . 1 . . . . 60 PRO C . 11336 1
618 . 1 1 60 60 PRO CA C 13 64.752 0.300 . 1 . . . . 60 PRO CA . 11336 1
619 . 1 1 60 60 PRO CB C 13 32.590 0.300 . 1 . . . . 60 PRO CB . 11336 1
620 . 1 1 60 60 PRO CD C 13 50.760 0.300 . 1 . . . . 60 PRO CD . 11336 1
621 . 1 1 60 60 PRO CG C 13 26.662 0.300 . 1 . . . . 60 PRO CG . 11336 1
622 . 1 1 61 61 THR H H 1 9.096 0.030 . 1 . . . . 61 THR H . 11336 1
623 . 1 1 61 61 THR HA H 1 4.243 0.030 . 1 . . . . 61 THR HA . 11336 1
624 . 1 1 61 61 THR HB H 1 3.447 0.030 . 1 . . . . 61 THR HB . 11336 1
625 . 1 1 61 61 THR HG21 H 1 0.620 0.030 . 1 . . . . 61 THR HG2 . 11336 1
626 . 1 1 61 61 THR HG22 H 1 0.620 0.030 . 1 . . . . 61 THR HG2 . 11336 1
627 . 1 1 61 61 THR HG23 H 1 0.620 0.030 . 1 . . . . 61 THR HG2 . 11336 1
628 . 1 1 61 61 THR C C 13 177.795 0.300 . 1 . . . . 61 THR C . 11336 1
629 . 1 1 61 61 THR CA C 13 65.382 0.300 . 1 . . . . 61 THR CA . 11336 1
630 . 1 1 61 61 THR CB C 13 69.302 0.300 . 1 . . . . 61 THR CB . 11336 1
631 . 1 1 61 61 THR CG2 C 13 21.216 0.300 . 1 . . . . 61 THR CG2 . 11336 1
632 . 1 1 61 61 THR N N 15 115.967 0.300 . 1 . . . . 61 THR N . 11336 1
633 . 1 1 62 62 CYS H H 1 8.221 0.030 . 1 . . . . 62 CYS H . 11336 1
634 . 1 1 62 62 CYS HA H 1 4.932 0.030 . 1 . . . . 62 CYS HA . 11336 1
635 . 1 1 62 62 CYS HB2 H 1 3.322 0.030 . 2 . . . . 62 CYS HB2 . 11336 1
636 . 1 1 62 62 CYS HB3 H 1 2.453 0.030 . 2 . . . . 62 CYS HB3 . 11336 1
637 . 1 1 62 62 CYS C C 13 175.932 0.300 . 1 . . . . 62 CYS C . 11336 1
638 . 1 1 62 62 CYS CA C 13 58.803 0.300 . 1 . . . . 62 CYS CA . 11336 1
639 . 1 1 62 62 CYS CB C 13 32.601 0.300 . 1 . . . . 62 CYS CB . 11336 1
640 . 1 1 62 62 CYS N N 15 120.307 0.300 . 1 . . . . 62 CYS N . 11336 1
641 . 1 1 63 63 ARG H H 1 8.297 0.030 . 1 . . . . 63 ARG H . 11336 1
642 . 1 1 63 63 ARG HA H 1 4.007 0.030 . 1 . . . . 63 ARG HA . 11336 1
643 . 1 1 63 63 ARG HB2 H 1 2.046 0.030 . 2 . . . . 63 ARG HB2 . 11336 1
644 . 1 1 63 63 ARG HB3 H 1 2.118 0.030 . 2 . . . . 63 ARG HB3 . 11336 1
645 . 1 1 63 63 ARG HD2 H 1 3.136 0.030 . 2 . . . . 63 ARG HD2 . 11336 1
646 . 1 1 63 63 ARG HD3 H 1 3.037 0.030 . 2 . . . . 63 ARG HD3 . 11336 1
647 . 1 1 63 63 ARG HG2 H 1 1.512 0.030 . 2 . . . . 63 ARG HG2 . 11336 1
648 . 1 1 63 63 ARG HG3 H 1 1.466 0.030 . 2 . . . . 63 ARG HG3 . 11336 1
649 . 1 1 63 63 ARG C C 13 174.635 0.300 . 1 . . . . 63 ARG C . 11336 1
650 . 1 1 63 63 ARG CA C 13 57.982 0.300 . 1 . . . . 63 ARG CA . 11336 1
651 . 1 1 63 63 ARG CB C 13 27.037 0.300 . 1 . . . . 63 ARG CB . 11336 1
652 . 1 1 63 63 ARG CD C 13 43.023 0.300 . 1 . . . . 63 ARG CD . 11336 1
653 . 1 1 63 63 ARG CG C 13 27.420 0.300 . 1 . . . . 63 ARG CG . 11336 1
654 . 1 1 63 63 ARG N N 15 117.465 0.300 . 1 . . . . 63 ARG N . 11336 1
655 . 1 1 64 64 LYS H H 1 8.039 0.030 . 1 . . . . 64 LYS H . 11336 1
656 . 1 1 64 64 LYS HA H 1 4.259 0.030 . 1 . . . . 64 LYS HA . 11336 1
657 . 1 1 64 64 LYS HB2 H 1 1.956 0.030 . 2 . . . . 64 LYS HB2 . 11336 1
658 . 1 1 64 64 LYS HB3 H 1 1.810 0.030 . 2 . . . . 64 LYS HB3 . 11336 1
659 . 1 1 64 64 LYS HD2 H 1 1.669 0.030 . 1 . . . . 64 LYS HD2 . 11336 1
660 . 1 1 64 64 LYS HD3 H 1 1.669 0.030 . 1 . . . . 64 LYS HD3 . 11336 1
661 . 1 1 64 64 LYS HE2 H 1 3.048 0.030 . 1 . . . . 64 LYS HE2 . 11336 1
662 . 1 1 64 64 LYS HE3 H 1 3.048 0.030 . 1 . . . . 64 LYS HE3 . 11336 1
663 . 1 1 64 64 LYS HG2 H 1 1.669 0.030 . 2 . . . . 64 LYS HG2 . 11336 1
664 . 1 1 64 64 LYS HG3 H 1 1.512 0.030 . 2 . . . . 64 LYS HG3 . 11336 1
665 . 1 1 64 64 LYS C C 13 176.811 0.300 . 1 . . . . 64 LYS C . 11336 1
666 . 1 1 64 64 LYS CA C 13 57.396 0.300 . 1 . . . . 64 LYS CA . 11336 1
667 . 1 1 64 64 LYS CB C 13 33.741 0.300 . 1 . . . . 64 LYS CB . 11336 1
668 . 1 1 64 64 LYS CD C 13 29.225 0.300 . 1 . . . . 64 LYS CD . 11336 1
669 . 1 1 64 64 LYS CE C 13 42.239 0.300 . 1 . . . . 64 LYS CE . 11336 1
670 . 1 1 64 64 LYS CG C 13 26.331 0.300 . 1 . . . . 64 LYS CG . 11336 1
671 . 1 1 64 64 LYS N N 15 121.196 0.300 . 1 . . . . 64 LYS N . 11336 1
672 . 1 1 65 65 LYS H H 1 8.519 0.030 . 1 . . . . 65 LYS H . 11336 1
673 . 1 1 65 65 LYS HA H 1 4.224 0.030 . 1 . . . . 65 LYS HA . 11336 1
674 . 1 1 65 65 LYS HB2 H 1 1.734 0.030 . 1 . . . . 65 LYS HB2 . 11336 1
675 . 1 1 65 65 LYS HB3 H 1 1.734 0.030 . 1 . . . . 65 LYS HB3 . 11336 1
676 . 1 1 65 65 LYS HD2 H 1 1.665 0.030 . 1 . . . . 65 LYS HD2 . 11336 1
677 . 1 1 65 65 LYS HD3 H 1 1.665 0.030 . 1 . . . . 65 LYS HD3 . 11336 1
678 . 1 1 65 65 LYS HE2 H 1 2.966 0.030 . 1 . . . . 65 LYS HE2 . 11336 1
679 . 1 1 65 65 LYS HE3 H 1 2.966 0.030 . 1 . . . . 65 LYS HE3 . 11336 1
680 . 1 1 65 65 LYS HG2 H 1 1.278 0.030 . 2 . . . . 65 LYS HG2 . 11336 1
681 . 1 1 65 65 LYS HG3 H 1 1.441 0.030 . 2 . . . . 65 LYS HG3 . 11336 1
682 . 1 1 65 65 LYS C C 13 176.730 0.300 . 1 . . . . 65 LYS C . 11336 1
683 . 1 1 65 65 LYS CA C 13 57.827 0.300 . 1 . . . . 65 LYS CA . 11336 1
684 . 1 1 65 65 LYS CB C 13 32.417 0.300 . 1 . . . . 65 LYS CB . 11336 1
685 . 1 1 65 65 LYS CD C 13 29.147 0.300 . 1 . . . . 65 LYS CD . 11336 1
686 . 1 1 65 65 LYS CE C 13 42.156 0.300 . 1 . . . . 65 LYS CE . 11336 1
687 . 1 1 65 65 LYS CG C 13 25.018 0.300 . 1 . . . . 65 LYS CG . 11336 1
688 . 1 1 65 65 LYS N N 15 123.217 0.300 . 1 . . . . 65 LYS N . 11336 1
689 . 1 1 66 66 ILE H H 1 8.198 0.030 . 1 . . . . 66 ILE H . 11336 1
690 . 1 1 66 66 ILE HA H 1 4.451 0.030 . 1 . . . . 66 ILE HA . 11336 1
691 . 1 1 66 66 ILE HB H 1 1.876 0.030 . 1 . . . . 66 ILE HB . 11336 1
692 . 1 1 66 66 ILE HD11 H 1 0.803 0.030 . 1 . . . . 66 ILE HD1 . 11336 1
693 . 1 1 66 66 ILE HD12 H 1 0.803 0.030 . 1 . . . . 66 ILE HD1 . 11336 1
694 . 1 1 66 66 ILE HD13 H 1 0.803 0.030 . 1 . . . . 66 ILE HD1 . 11336 1
695 . 1 1 66 66 ILE HG12 H 1 1.293 0.030 . 2 . . . . 66 ILE HG12 . 11336 1
696 . 1 1 66 66 ILE HG13 H 1 0.973 0.030 . 2 . . . . 66 ILE HG13 . 11336 1
697 . 1 1 66 66 ILE HG21 H 1 0.947 0.030 . 1 . . . . 66 ILE HG2 . 11336 1
698 . 1 1 66 66 ILE HG22 H 1 0.947 0.030 . 1 . . . . 66 ILE HG2 . 11336 1
699 . 1 1 66 66 ILE HG23 H 1 0.947 0.030 . 1 . . . . 66 ILE HG2 . 11336 1
700 . 1 1 66 66 ILE C C 13 175.242 0.300 . 1 . . . . 66 ILE C . 11336 1
701 . 1 1 66 66 ILE CA C 13 60.065 0.300 . 1 . . . . 66 ILE CA . 11336 1
702 . 1 1 66 66 ILE CB C 13 40.195 0.300 . 1 . . . . 66 ILE CB . 11336 1
703 . 1 1 66 66 ILE CD1 C 13 13.670 0.300 . 1 . . . . 66 ILE CD1 . 11336 1
704 . 1 1 66 66 ILE CG1 C 13 26.134 0.300 . 1 . . . . 66 ILE CG1 . 11336 1
705 . 1 1 66 66 ILE CG2 C 13 18.289 0.300 . 1 . . . . 66 ILE CG2 . 11336 1
706 . 1 1 66 66 ILE N N 15 122.001 0.300 . 1 . . . . 66 ILE N . 11336 1
707 . 1 1 67 67 ASN H H 1 8.711 0.030 . 1 . . . . 67 ASN H . 11336 1
708 . 1 1 67 67 ASN HA H 1 4.793 0.030 . 1 . . . . 67 ASN HA . 11336 1
709 . 1 1 67 67 ASN HB2 H 1 2.772 0.030 . 2 . . . . 67 ASN HB2 . 11336 1
710 . 1 1 67 67 ASN HB3 H 1 2.673 0.030 . 2 . . . . 67 ASN HB3 . 11336 1
711 . 1 1 67 67 ASN HD21 H 1 6.857 0.030 . 2 . . . . 67 ASN HD21 . 11336 1
712 . 1 1 67 67 ASN HD22 H 1 7.758 0.030 . 2 . . . . 67 ASN HD22 . 11336 1
713 . 1 1 67 67 ASN C C 13 174.526 0.300 . 1 . . . . 67 ASN C . 11336 1
714 . 1 1 67 67 ASN CA C 13 52.850 0.300 . 1 . . . . 67 ASN CA . 11336 1
715 . 1 1 67 67 ASN CB C 13 39.614 0.300 . 1 . . . . 67 ASN CB . 11336 1
716 . 1 1 67 67 ASN N N 15 122.207 0.300 . 1 . . . . 67 ASN N . 11336 1
717 . 1 1 67 67 ASN ND2 N 15 113.603 0.300 . 1 . . . . 67 ASN ND2 . 11336 1
718 . 1 1 68 68 HIS H H 1 8.328 0.030 . 1 . . . . 68 HIS H . 11336 1
719 . 1 1 68 68 HIS HA H 1 4.562 0.030 . 1 . . . . 68 HIS HA . 11336 1
720 . 1 1 68 68 HIS HB2 H 1 3.014 0.030 . 1 . . . . 68 HIS HB2 . 11336 1
721 . 1 1 68 68 HIS HB3 H 1 3.014 0.030 . 1 . . . . 68 HIS HB3 . 11336 1
722 . 1 1 68 68 HIS HD2 H 1 6.962 0.030 . 1 . . . . 68 HIS HD2 . 11336 1
723 . 1 1 68 68 HIS HE1 H 1 7.819 0.030 . 1 . . . . 68 HIS HE1 . 11336 1
724 . 1 1 68 68 HIS C C 13 173.972 0.300 . 1 . . . . 68 HIS C . 11336 1
725 . 1 1 68 68 HIS CA C 13 56.460 0.300 . 1 . . . . 68 HIS CA . 11336 1
726 . 1 1 68 68 HIS CB C 13 31.231 0.300 . 1 . . . . 68 HIS CB . 11336 1
727 . 1 1 68 68 HIS CD2 C 13 120.297 0.300 . 1 . . . . 68 HIS CD2 . 11336 1
728 . 1 1 68 68 HIS CE1 C 13 138.194 0.300 . 1 . . . . 68 HIS CE1 . 11336 1
729 . 1 1 68 68 HIS N N 15 121.075 0.300 . 1 . . . . 68 HIS N . 11336 1
730 . 1 1 69 69 LYS H H 1 7.795 0.030 . 1 . . . . 69 LYS H . 11336 1
731 . 1 1 69 69 LYS HA H 1 4.093 0.030 . 1 . . . . 69 LYS HA . 11336 1
732 . 1 1 69 69 LYS HB2 H 1 1.651 0.030 . 2 . . . . 69 LYS HB2 . 11336 1
733 . 1 1 69 69 LYS HB3 H 1 1.769 0.030 . 2 . . . . 69 LYS HB3 . 11336 1
734 . 1 1 69 69 LYS HD2 H 1 1.621 0.030 . 1 . . . . 69 LYS HD2 . 11336 1
735 . 1 1 69 69 LYS HD3 H 1 1.621 0.030 . 1 . . . . 69 LYS HD3 . 11336 1
736 . 1 1 69 69 LYS HE2 H 1 2.962 0.030 . 1 . . . . 69 LYS HE2 . 11336 1
737 . 1 1 69 69 LYS HE3 H 1 2.962 0.030 . 1 . . . . 69 LYS HE3 . 11336 1
738 . 1 1 69 69 LYS HG2 H 1 1.313 0.030 . 1 . . . . 69 LYS HG2 . 11336 1
739 . 1 1 69 69 LYS HG3 H 1 1.313 0.030 . 1 . . . . 69 LYS HG3 . 11336 1
740 . 1 1 69 69 LYS C C 13 181.082 0.300 . 1 . . . . 69 LYS C . 11336 1
741 . 1 1 69 69 LYS CA C 13 57.680 0.300 . 1 . . . . 69 LYS CA . 11336 1
742 . 1 1 69 69 LYS CB C 13 33.791 0.300 . 1 . . . . 69 LYS CB . 11336 1
743 . 1 1 69 69 LYS CD C 13 29.344 0.300 . 1 . . . . 69 LYS CD . 11336 1
744 . 1 1 69 69 LYS CE C 13 42.353 0.300 . 1 . . . . 69 LYS CE . 11336 1
745 . 1 1 69 69 LYS CG C 13 24.680 0.300 . 1 . . . . 69 LYS CG . 11336 1
746 . 1 1 69 69 LYS N N 15 128.070 0.300 . 1 . . . . 69 LYS N . 11336 1
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