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 17839
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 17839 1
2 '3D CBCA(CO)NH' . . . 17839 1
3 '3D HNCACB' . . . 17839 1
4 '3D C(CO)NH' . . . 17839 1
5 '3D HNCO' . . . 17839 1
7 '3D 1H-13C NOESY aliphatic' . . . 17839 1
8 '3D 1H-13C NOESY aromatic' . . . 17839 1
9 '3D H(CCO)NH' . . . 17839 1
10 '3D HBHA(CO)NH' . . . 17839 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 1 1 THR C C 13 173.523 0.5 . 1 . . . A 1 THR C . 17839 1
2 . 1 1 1 1 THR CA C 13 61.668 0.5 . 1 . . . A 1 THR CA . 17839 1
3 . 1 1 1 1 THR CB C 13 69.923 0.5 . 1 . . . A 1 THR CB . 17839 1
4 . 1 1 1 1 THR CG2 C 13 21.312 0.5 . 1 . . . A 1 THR CG2 . 17839 1
5 . 1 1 2 2 THR H H 1 7.994 0.005 . 1 . . . A 2 THR H . 17839 1
6 . 1 1 2 2 THR HA H 1 4.125 0.022 . 1 . . . A 2 THR HA . 17839 1
7 . 1 1 2 2 THR HB H 1 3.95 0.001 . 1 . . . A 2 THR HB . 17839 1
8 . 1 1 2 2 THR HG21 H 1 0.917 0.032 . 1 . . . A 2 THR HG# . 17839 1
9 . 1 1 2 2 THR HG22 H 1 0.917 0.032 . 1 . . . A 2 THR HG# . 17839 1
10 . 1 1 2 2 THR HG23 H 1 0.917 0.032 . 1 . . . A 2 THR HG# . 17839 1
11 . 1 1 2 2 THR C C 13 173.743 0.5 . 1 . . . A 2 THR C . 17839 1
12 . 1 1 2 2 THR CA C 13 61.651 0.156 . 1 . . . A 2 THR CA . 17839 1
13 . 1 1 2 2 THR CB C 13 69.626 0.124 . 1 . . . A 2 THR CB . 17839 1
14 . 1 1 2 2 THR CG2 C 13 21.312 0.5 . 1 . . . A 2 THR CG2 . 17839 1
15 . 1 1 2 2 THR N N 15 128.64 0.032 . 1 . . . A 2 THR N . 17839 1
16 . 1 1 3 3 TYR H H 1 8.325 0.013 . 1 . . . A 3 TYR H . 17839 1
17 . 1 1 3 3 TYR HA H 1 4.182 0.022 . 1 . . . A 3 TYR HA . 17839 1
18 . 1 1 3 3 TYR HB2 H 1 2.69 0.024 . 1 . . . A 3 TYR HB2 . 17839 1
19 . 1 1 3 3 TYR HB3 H 1 2.69 0.024 . 1 . . . A 3 TYR HB3 . 17839 1
20 . 1 1 3 3 TYR HD1 H 1 6.896 0.05 . 1 . . . A 3 TYR HD1 . 17839 1
21 . 1 1 3 3 TYR HD2 H 1 6.896 0.05 . 1 . . . A 3 TYR HD2 . 17839 1
22 . 1 1 3 3 TYR HE1 H 1 6.649 0.11 . 1 . . . A 3 TYR HE1 . 17839 1
23 . 1 1 3 3 TYR HE2 H 1 6.649 0.11 . 1 . . . A 3 TYR HE2 . 17839 1
24 . 1 1 3 3 TYR C C 13 175.675 0.5 . 1 . . . A 3 TYR C . 17839 1
25 . 1 1 3 3 TYR CA C 13 58.3 0.058 . 1 . . . A 3 TYR CA . 17839 1
26 . 1 1 3 3 TYR CB C 13 38.518 0.095 . 1 . . . A 3 TYR CB . 17839 1
27 . 1 1 3 3 TYR CE1 C 13 118.066 0.5 . 1 . . . A 3 TYR CE1 . 17839 1
28 . 1 1 3 3 TYR CE2 C 13 118.066 0.5 . 1 . . . A 3 TYR CE2 . 17839 1
29 . 1 1 3 3 TYR N N 15 124.112 0.042 . 1 . . . A 3 TYR N . 17839 1
30 . 1 1 4 4 LYS H H 1 8.027 0.032 . 1 . . . A 4 LYS H . 17839 1
31 . 1 1 4 4 LYS HA H 1 3.883 0.026 . 1 . . . A 4 LYS HA . 17839 1
32 . 1 1 4 4 LYS HB2 H 1 1.436 0.019 . 1 . . . A 4 LYS HB2 . 17839 1
33 . 1 1 4 4 LYS HB3 H 1 1.436 0.019 . 1 . . . A 4 LYS HB3 . 17839 1
34 . 1 1 4 4 LYS HG2 H 1 0.993 0.008 . 1 . . . A 4 LYS HG2 . 17839 1
35 . 1 1 4 4 LYS HG3 H 1 0.993 0.008 . 1 . . . A 4 LYS HG3 . 17839 1
36 . 1 1 4 4 LYS HE2 H 1 2.709 0.05 . 1 . . . A 4 LYS HE2 . 17839 1
37 . 1 1 4 4 LYS HE3 H 1 2.709 0.05 . 1 . . . A 4 LYS HE3 . 17839 1
38 . 1 1 4 4 LYS C C 13 175.923 0.5 . 1 . . . A 4 LYS C . 17839 1
39 . 1 1 4 4 LYS CA C 13 56.423 0.023 . 1 . . . A 4 LYS CA . 17839 1
40 . 1 1 4 4 LYS CB C 13 32.767 0.213 . 1 . . . A 4 LYS CB . 17839 1
41 . 1 1 4 4 LYS CG C 13 24.371 0.5 . 1 . . . A 4 LYS CG . 17839 1
42 . 1 1 4 4 LYS CD C 13 28.938 0.5 . 1 . . . A 4 LYS CD . 17839 1
43 . 1 1 4 4 LYS CE C 13 38.978 0.5 . 1 . . . A 4 LYS CE . 17839 1
44 . 1 1 4 4 LYS N N 15 122.769 0.5 . 1 . . . A 4 LYS N . 17839 1
45 . 1 1 5 5 LEU H H 1 7.919 0.028 . 1 . . . A 5 LEU H . 17839 1
46 . 1 1 5 5 LEU HA H 1 4.06 0.018 . 1 . . . A 5 LEU HA . 17839 1
47 . 1 1 5 5 LEU HB2 H 1 1.399 0.016 . 1 . . . A 5 LEU HB2 . 17839 1
48 . 1 1 5 5 LEU HB3 H 1 1.399 0.016 . 1 . . . A 5 LEU HB3 . 17839 1
49 . 1 1 5 5 LEU HG H 1 1.489 0.024 . 1 . . . A 5 LEU HG . 17839 1
50 . 1 1 5 5 LEU HD11 H 1 0.637 0.009 . 2 . . . A 5 LEU HD1 . 17839 1
51 . 1 1 5 5 LEU HD12 H 1 0.637 0.009 . 2 . . . A 5 LEU HD1 . 17839 1
52 . 1 1 5 5 LEU HD13 H 1 0.637 0.009 . 2 . . . A 5 LEU HD1 . 17839 1
53 . 1 1 5 5 LEU C C 13 177.167 0.5 . 1 . . . A 5 LEU C . 17839 1
54 . 1 1 5 5 LEU CA C 13 55.289 0.002 . 1 . . . A 5 LEU CA . 17839 1
55 . 1 1 5 5 LEU CB C 13 42.015 0.039 . 1 . . . A 5 LEU CB . 17839 1
56 . 1 1 5 5 LEU CG C 13 27.181 0.5 . 1 . . . A 5 LEU CG . 17839 1
57 . 1 1 5 5 LEU CD1 C 13 23.786 0.5 . 1 . . . A 5 LEU CD1 . 17839 1
58 . 1 1 5 5 LEU N N 15 122.314 0.012 . 1 . . . A 5 LEU N . 17839 1
59 . 1 1 6 6 ILE H H 1 7.998 0.026 . 1 . . . A 6 ILE H . 17839 1
60 . 1 1 6 6 ILE HA H 1 3.865 0.026 . 1 . . . A 6 ILE HA . 17839 1
61 . 1 1 6 6 ILE HB H 1 1.703 0.016 . 1 . . . A 6 ILE HB . 17839 1
62 . 1 1 6 6 ILE HG12 H 1 1.298 0.044 . 1 . . . A 6 ILE HG12 . 17839 1
63 . 1 1 6 6 ILE HG13 H 1 1.298 0.044 . 1 . . . A 6 ILE HG13 . 17839 1
64 . 1 1 6 6 ILE HD11 H 1 0.655 0.02 . 1 . . . A 6 ILE HD1 . 17839 1
65 . 1 1 6 6 ILE HD12 H 1 0.655 0.02 . 1 . . . A 6 ILE HD1 . 17839 1
66 . 1 1 6 6 ILE HD13 H 1 0.655 0.02 . 1 . . . A 6 ILE HD1 . 17839 1
67 . 1 1 6 6 ILE C C 13 176.231 0.5 . 1 . . . A 6 ILE C . 17839 1
68 . 1 1 6 6 ILE CA C 13 61.39 0.22 . 1 . . . A 6 ILE CA . 17839 1
69 . 1 1 6 6 ILE CB C 13 37.859 0.036 . 1 . . . A 6 ILE CB . 17839 1
70 . 1 1 6 6 ILE CG1 C 13 27.503 0.5 . 1 . . . A 6 ILE CG1 . 17839 1
71 . 1 1 6 6 ILE CD1 C 13 17.229 0.5 . 1 . . . A 6 ILE CD1 . 17839 1
72 . 1 1 6 6 ILE N N 15 122.789 0.5 . 1 . . . A 6 ILE N . 17839 1
73 . 1 1 7 7 LEU H H 1 8.099 0.015 . 1 . . . A 7 LEU H . 17839 1
74 . 1 1 7 7 LEU HA H 1 4.18 0.018 . 1 . . . A 7 LEU HA . 17839 1
75 . 1 1 7 7 LEU HB2 H 1 1.436 0.026 . 1 . . . A 7 LEU HB2 . 17839 1
76 . 1 1 7 7 LEU HB3 H 1 1.436 0.026 . 1 . . . A 7 LEU HB3 . 17839 1
77 . 1 1 7 7 LEU HG H 1 1.556 0.034 . 1 . . . A 7 LEU HG . 17839 1
78 . 1 1 7 7 LEU HD11 H 1 0.653 0.05 . 2 . . . A 7 LEU HD1 . 17839 1
79 . 1 1 7 7 LEU HD12 H 1 0.653 0.05 . 2 . . . A 7 LEU HD1 . 17839 1
80 . 1 1 7 7 LEU HD13 H 1 0.653 0.05 . 2 . . . A 7 LEU HD1 . 17839 1
81 . 1 1 7 7 LEU C C 13 177.079 0.5 . 1 . . . A 7 LEU C . 17839 1
82 . 1 1 7 7 LEU CA C 13 55.056 0.039 . 1 . . . A 7 LEU CA . 17839 1
83 . 1 1 7 7 LEU CB C 13 42.718 0.039 . 1 . . . A 7 LEU CB . 17839 1
84 . 1 1 7 7 LEU CG C 13 25.21 0.097 . 1 . . . A 7 LEU CG . 17839 1
85 . 1 1 7 7 LEU N N 15 125.831 0.047 . 1 . . . A 7 LEU N . 17839 1
86 . 1 1 8 8 ASN H H 1 8.058 0.029 . 1 . . . A 8 ASN H . 17839 1
87 . 1 1 8 8 ASN HA H 1 4.474 0.025 . 1 . . . A 8 ASN HA . 17839 1
88 . 1 1 8 8 ASN HB2 H 1 2.852 0.03 . 2 . . . A 8 ASN HB2 . 17839 1
89 . 1 1 8 8 ASN HB3 H 1 2.661 0.019 . 2 . . . A 8 ASN HB3 . 17839 1
90 . 1 1 8 8 ASN C C 13 175.25 0.5 . 1 . . . A 8 ASN C . 17839 1
91 . 1 1 8 8 ASN CA C 13 52.483 0.088 . 1 . . . A 8 ASN CA . 17839 1
92 . 1 1 8 8 ASN CB C 13 38.877 0.102 . 1 . . . A 8 ASN CB . 17839 1
93 . 1 1 8 8 ASN N N 15 118.052 0.066 . 1 . . . A 8 ASN N . 17839 1
94 . 1 1 9 9 LEU H H 1 8.251 0.01 . 1 . . . A 9 LEU H . 17839 1
95 . 1 1 9 9 LEU HA H 1 3.652 0.016 . 1 . . . A 9 LEU HA . 17839 1
96 . 1 1 9 9 LEU HB2 H 1 1.213 0.074 . 1 . . . A 9 LEU HB2 . 17839 1
97 . 1 1 9 9 LEU HB3 H 1 1.213 0.074 . 1 . . . A 9 LEU HB3 . 17839 1
98 . 1 1 9 9 LEU HG H 1 1.673 0.05 . 1 . . . A 9 LEU HG . 17839 1
99 . 1 1 9 9 LEU HD11 H 1 0.319 0.015 . 2 . . . A 9 LEU HD1 . 17839 1
100 . 1 1 9 9 LEU HD12 H 1 0.319 0.015 . 2 . . . A 9 LEU HD1 . 17839 1
101 . 1 1 9 9 LEU HD13 H 1 0.319 0.015 . 2 . . . A 9 LEU HD1 . 17839 1
102 . 1 1 9 9 LEU C C 13 177.065 0.5 . 1 . . . A 9 LEU C . 17839 1
103 . 1 1 9 9 LEU CA C 13 58.524 0.021 . 1 . . . A 9 LEU CA . 17839 1
104 . 1 1 9 9 LEU CB C 13 41.95 0.1 . 1 . . . A 9 LEU CB . 17839 1
105 . 1 1 9 9 LEU CG C 13 25.524 0.111 . 1 . . . A 9 LEU CG . 17839 1
106 . 1 1 9 9 LEU CD1 C 13 23.405 0.5 . 1 . . . A 9 LEU CD1 . 17839 1
107 . 1 1 9 9 LEU N N 15 121.908 0.019 . 1 . . . A 9 LEU N . 17839 1
108 . 1 1 10 10 LYS H H 1 7.94 0.012 . 1 . . . A 10 LYS H . 17839 1
109 . 1 1 10 10 LYS HA H 1 3.66 0.013 . 1 . . . A 10 LYS HA . 17839 1
110 . 1 1 10 10 LYS HB2 H 1 1.712 0.029 . 1 . . . A 10 LYS HB2 . 17839 1
111 . 1 1 10 10 LYS HB3 H 1 1.712 0.029 . 1 . . . A 10 LYS HB3 . 17839 1
112 . 1 1 10 10 LYS HD2 H 1 1.26 0.05 . 1 . . . A 10 LYS HD2 . 17839 1
113 . 1 1 10 10 LYS HD3 H 1 1.26 0.05 . 1 . . . A 10 LYS HD3 . 17839 1
114 . 1 1 10 10 LYS C C 13 178.689 0.5 . 1 . . . A 10 LYS C . 17839 1
115 . 1 1 10 10 LYS CA C 13 59.8 0.161 . 1 . . . A 10 LYS CA . 17839 1
116 . 1 1 10 10 LYS CB C 13 32.269 0.12 . 1 . . . A 10 LYS CB . 17839 1
117 . 1 1 10 10 LYS CG C 13 25.191 0.5 . 1 . . . A 10 LYS CG . 17839 1
118 . 1 1 10 10 LYS CE C 13 42.081 0.5 . 1 . . . A 10 LYS CE . 17839 1
119 . 1 1 10 10 LYS N N 15 118.87 0.11 . 1 . . . A 10 LYS N . 17839 1
120 . 1 1 11 11 GLN H H 1 7.549 0.024 . 1 . . . A 11 GLN H . 17839 1
121 . 1 1 11 11 GLN HA H 1 3.897 0.022 . 1 . . . A 11 GLN HA . 17839 1
122 . 1 1 11 11 GLN HB2 H 1 1.992 0.051 . 1 . . . A 11 GLN HB2 . 17839 1
123 . 1 1 11 11 GLN HB3 H 1 1.992 0.051 . 1 . . . A 11 GLN HB3 . 17839 1
124 . 1 1 11 11 GLN HG2 H 1 2.238 0.082 . 2 . . . A 11 GLN HG2 . 17839 1
125 . 1 1 11 11 GLN HG3 H 1 2.385 0.006 . 2 . . . A 11 GLN HG3 . 17839 1
126 . 1 1 11 11 GLN C C 13 179.084 0.5 . 1 . . . A 11 GLN C . 17839 1
127 . 1 1 11 11 GLN CA C 13 59.185 0.152 . 1 . . . A 11 GLN CA . 17839 1
128 . 1 1 11 11 GLN CB C 13 29.471 0.133 . 1 . . . A 11 GLN CB . 17839 1
129 . 1 1 11 11 GLN CG C 13 33.199 0.06 . 1 . . . A 11 GLN CG . 17839 1
130 . 1 1 11 11 GLN N N 15 117.959 0.5 . 1 . . . A 11 GLN N . 17839 1
131 . 1 1 12 12 ALA H H 1 8.363 0.015 . 1 . . . A 12 ALA H . 17839 1
132 . 1 1 12 12 ALA HA H 1 3.903 0.02 . 1 . . . A 12 ALA HA . 17839 1
133 . 1 1 12 12 ALA HB1 H 1 1.101 0.032 . 1 . . . A 12 ALA HB . 17839 1
134 . 1 1 12 12 ALA HB2 H 1 1.101 0.032 . 1 . . . A 12 ALA HB . 17839 1
135 . 1 1 12 12 ALA HB3 H 1 1.101 0.032 . 1 . . . A 12 ALA HB . 17839 1
136 . 1 1 12 12 ALA C C 13 179.596 0.5 . 1 . . . A 12 ALA C . 17839 1
137 . 1 1 12 12 ALA CA C 13 55.423 0.022 . 1 . . . A 12 ALA CA . 17839 1
138 . 1 1 12 12 ALA CB C 13 18.216 0.064 . 1 . . . A 12 ALA CB . 17839 1
139 . 1 1 12 12 ALA N N 15 122.975 0.5 . 1 . . . A 12 ALA N . 17839 1
140 . 1 1 13 13 LYS H H 1 8.097 0.026 . 1 . . . A 13 LYS H . 17839 1
141 . 1 1 13 13 LYS HA H 1 3.337 0.085 . 1 . . . A 13 LYS HA . 17839 1
142 . 1 1 13 13 LYS HB2 H 1 1.626 0.061 . 1 . . . A 13 LYS HB2 . 17839 1
143 . 1 1 13 13 LYS HB3 H 1 1.626 0.061 . 1 . . . A 13 LYS HB3 . 17839 1
144 . 1 1 13 13 LYS HD2 H 1 1.418 0.028 . 1 . . . A 13 LYS HD2 . 17839 1
145 . 1 1 13 13 LYS HD3 H 1 1.418 0.028 . 1 . . . A 13 LYS HD3 . 17839 1
146 . 1 1 13 13 LYS C C 13 177.621 0.5 . 1 . . . A 13 LYS C . 17839 1
147 . 1 1 13 13 LYS CA C 13 60.687 0.157 . 1 . . . A 13 LYS CA . 17839 1
148 . 1 1 13 13 LYS CB C 13 32.883 0.028 . 1 . . . A 13 LYS CB . 17839 1
149 . 1 1 13 13 LYS CE C 13 41.993 0.5 . 1 . . . A 13 LYS CE . 17839 1
150 . 1 1 13 13 LYS N N 15 116.93 0.012 . 1 . . . A 13 LYS N . 17839 1
151 . 1 1 14 14 GLU H H 1 7.582 0.022 . 1 . . . A 14 GLU H . 17839 1
152 . 1 1 14 14 GLU HA H 1 3.714 0.073 . 1 . . . A 14 GLU HA . 17839 1
153 . 1 1 14 14 GLU HB2 H 1 1.88 0.018 . 1 . . . A 14 GLU HB2 . 17839 1
154 . 1 1 14 14 GLU HB3 H 1 1.88 0.018 . 1 . . . A 14 GLU HB3 . 17839 1
155 . 1 1 14 14 GLU HG2 H 1 2.245 0.009 . 1 . . . A 14 GLU HG2 . 17839 1
156 . 1 1 14 14 GLU HG3 H 1 2.245 0.009 . 1 . . . A 14 GLU HG3 . 17839 1
157 . 1 1 14 14 GLU C C 13 180.065 0.5 . 1 . . . A 14 GLU C . 17839 1
158 . 1 1 14 14 GLU CA C 13 59.584 0.023 . 1 . . . A 14 GLU CA . 17839 1
159 . 1 1 14 14 GLU CB C 13 29.189 0.189 . 1 . . . A 14 GLU CB . 17839 1
160 . 1 1 14 14 GLU CG C 13 36.402 0.5 . 1 . . . A 14 GLU CG . 17839 1
161 . 1 1 14 14 GLU N N 15 116.977 0.5 . 1 . . . A 14 GLU N . 17839 1
162 . 1 1 15 15 GLU H H 1 8.313 0.035 . 1 . . . A 15 GLU H . 17839 1
163 . 1 1 15 15 GLU HA H 1 3.909 0.024 . 1 . . . A 15 GLU HA . 17839 1
164 . 1 1 15 15 GLU HB2 H 1 1.959 0.039 . 1 . . . A 15 GLU HB2 . 17839 1
165 . 1 1 15 15 GLU HB3 H 1 1.959 0.039 . 1 . . . A 15 GLU HB3 . 17839 1
166 . 1 1 15 15 GLU HG2 H 1 2.158 0.063 . 2 . . . A 15 GLU HG2 . 17839 1
167 . 1 1 15 15 GLU HG3 H 1 2.358 0.044 . 2 . . . A 15 GLU HG3 . 17839 1
168 . 1 1 15 15 GLU C C 13 178.367 0.5 . 1 . . . A 15 GLU C . 17839 1
169 . 1 1 15 15 GLU CA C 13 58.599 0.23 . 1 . . . A 15 GLU CA . 17839 1
170 . 1 1 15 15 GLU CB C 13 29.035 0.031 . 1 . . . A 15 GLU CB . 17839 1
171 . 1 1 15 15 GLU CG C 13 33.416 0.5 . 1 . . . A 15 GLU CG . 17839 1
172 . 1 1 15 15 GLU N N 15 119.464 0.015 . 1 . . . A 15 GLU N . 17839 1
173 . 1 1 16 16 ALA H H 1 8.427 0.029 . 1 . . . A 16 ALA H . 17839 1
174 . 1 1 16 16 ALA HA H 1 3.778 0.012 . 1 . . . A 16 ALA HA . 17839 1
175 . 1 1 16 16 ALA HB1 H 1 0.949 0.024 . 1 . . . A 16 ALA HB . 17839 1
176 . 1 1 16 16 ALA HB2 H 1 0.949 0.024 . 1 . . . A 16 ALA HB . 17839 1
177 . 1 1 16 16 ALA HB3 H 1 0.949 0.024 . 1 . . . A 16 ALA HB . 17839 1
178 . 1 1 16 16 ALA C C 13 179.245 0.5 . 1 . . . A 16 ALA C . 17839 1
179 . 1 1 16 16 ALA CA C 13 55.332 0.04 . 1 . . . A 16 ALA CA . 17839 1
180 . 1 1 16 16 ALA CB C 13 18.756 0.5 . 1 . . . A 16 ALA CB . 17839 1
181 . 1 1 16 16 ALA N N 15 122.073 0.003 . 1 . . . A 16 ALA N . 17839 1
182 . 1 1 17 17 ILE H H 1 8.177 0.014 . 1 . . . A 17 ILE H . 17839 1
183 . 1 1 17 17 ILE HA H 1 3.099 0.015 . 1 . . . A 17 ILE HA . 17839 1
184 . 1 1 17 17 ILE HB H 1 1.574 0.013 . 1 . . . A 17 ILE HB . 17839 1
185 . 1 1 17 17 ILE HG21 H 1 0.774 0.01 . 1 . . . A 17 ILE HG2 . 17839 1
186 . 1 1 17 17 ILE HG22 H 1 0.774 0.01 . 1 . . . A 17 ILE HG2 . 17839 1
187 . 1 1 17 17 ILE HG23 H 1 0.774 0.01 . 1 . . . A 17 ILE HG2 . 17839 1
188 . 1 1 17 17 ILE HD11 H 1 0.496 0.05 . 1 . . . A 17 ILE HD1 . 17839 1
189 . 1 1 17 17 ILE HD12 H 1 0.496 0.05 . 1 . . . A 17 ILE HD1 . 17839 1
190 . 1 1 17 17 ILE HD13 H 1 0.496 0.05 . 1 . . . A 17 ILE HD1 . 17839 1
191 . 1 1 17 17 ILE C C 13 177.196 0.5 . 1 . . . A 17 ILE C . 17839 1
192 . 1 1 17 17 ILE CA C 13 65.069 0.053 . 1 . . . A 17 ILE CA . 17839 1
193 . 1 1 17 17 ILE CB C 13 36.634 0.02 . 1 . . . A 17 ILE CB . 17839 1
194 . 1 1 17 17 ILE N N 15 117.151 0.032 . 1 . . . A 17 ILE N . 17839 1
195 . 1 1 18 18 LYS H H 1 7.525 0.017 . 1 . . . A 18 LYS H . 17839 1
196 . 1 1 18 18 LYS HA H 1 3.669 0.036 . 1 . . . A 18 LYS HA . 17839 1
197 . 1 1 18 18 LYS HB2 H 1 1.648 0.012 . 1 . . . A 18 LYS HB2 . 17839 1
198 . 1 1 18 18 LYS HB3 H 1 1.648 0.012 . 1 . . . A 18 LYS HB3 . 17839 1
199 . 1 1 18 18 LYS C C 13 178.279 0.5 . 1 . . . A 18 LYS C . 17839 1
200 . 1 1 18 18 LYS CA C 13 59.975 0.5 . 1 . . . A 18 LYS CA . 17839 1
201 . 1 1 18 18 LYS CB C 13 32.015 0.174 . 1 . . . A 18 LYS CB . 17839 1
202 . 1 1 18 18 LYS N N 15 119.317 0.009 . 1 . . . A 18 LYS N . 17839 1
203 . 1 1 19 19 GLU H H 1 8.226 0.021 . 1 . . . A 19 GLU H . 17839 1
204 . 1 1 19 19 GLU HA H 1 3.925 0.038 . 1 . . . A 19 GLU HA . 17839 1
205 . 1 1 19 19 GLU HB2 H 1 1.991 0.002 . 2 . . . A 19 GLU HB2 . 17839 1
206 . 1 1 19 19 GLU HB3 H 1 1.822 0.067 . 2 . . . A 19 GLU HB3 . 17839 1
207 . 1 1 19 19 GLU HG2 H 1 1.979 0.039 . 1 . . . A 19 GLU HG2 . 17839 1
208 . 1 1 19 19 GLU HG3 H 1 1.979 0.039 . 1 . . . A 19 GLU HG3 . 17839 1
209 . 1 1 19 19 GLU C C 13 178.104 0.5 . 1 . . . A 19 GLU C . 17839 1
210 . 1 1 19 19 GLU CA C 13 58.905 0.124 . 1 . . . A 19 GLU CA . 17839 1
211 . 1 1 19 19 GLU CB C 13 28.531 0.5 . 1 . . . A 19 GLU CB . 17839 1
212 . 1 1 19 19 GLU CG C 13 36.285 0.5 . 1 . . . A 19 GLU CG . 17839 1
213 . 1 1 19 19 GLU N N 15 119.267 0.5 . 1 . . . A 19 GLU N . 17839 1
214 . 1 1 20 20 LEU H H 1 8.018 0.017 . 1 . . . A 20 LEU H . 17839 1
215 . 1 1 20 20 LEU HA H 1 3.923 0.005 . 1 . . . A 20 LEU HA . 17839 1
216 . 1 1 20 20 LEU HD11 H 1 0.592 0.061 . 2 . . . A 20 LEU HD1 . 17839 1
217 . 1 1 20 20 LEU HD12 H 1 0.592 0.061 . 2 . . . A 20 LEU HD1 . 17839 1
218 . 1 1 20 20 LEU HD13 H 1 0.592 0.061 . 2 . . . A 20 LEU HD1 . 17839 1
219 . 1 1 20 20 LEU C C 13 179.991 0.5 . 1 . . . A 20 LEU C . 17839 1
220 . 1 1 20 20 LEU CA C 13 58.102 0.5 . 1 . . . A 20 LEU CA . 17839 1
221 . 1 1 20 20 LEU CB C 13 40.825 0.5 . 1 . . . A 20 LEU CB . 17839 1
222 . 1 1 20 20 LEU N N 15 120.447 0.034 . 1 . . . A 20 LEU N . 17839 1
223 . 1 1 21 21 VAL H H 1 9.048 0.021 . 1 . . . A 21 VAL H . 17839 1
224 . 1 1 21 21 VAL HA H 1 3.818 0.074 . 1 . . . A 21 VAL HA . 17839 1
225 . 1 1 21 21 VAL HB H 1 2.142 0.073 . 1 . . . A 21 VAL HB . 17839 1
226 . 1 1 21 21 VAL HG11 H 1 0.768 0.038 . 2 . . . A 21 VAL HG1 . 17839 1
227 . 1 1 21 21 VAL HG12 H 1 0.768 0.038 . 2 . . . A 21 VAL HG1 . 17839 1
228 . 1 1 21 21 VAL HG13 H 1 0.768 0.038 . 2 . . . A 21 VAL HG1 . 17839 1
229 . 1 1 21 21 VAL C C 13 177.431 0.5 . 1 . . . A 21 VAL C . 17839 1
230 . 1 1 21 21 VAL CA C 13 66.379 0.016 . 1 . . . A 21 VAL CA . 17839 1
231 . 1 1 21 21 VAL CB C 13 31.987 0.5 . 1 . . . A 21 VAL CB . 17839 1
232 . 1 1 21 21 VAL CG1 C 13 23.127 0.5 . 1 . . . A 21 VAL CG1 . 17839 1
233 . 1 1 21 21 VAL N N 15 124.479 0.5 . 1 . . . A 21 VAL N . 17839 1
234 . 1 1 22 22 ASP H H 1 8.077 0.021 . 1 . . . A 22 ASP H . 17839 1
235 . 1 1 22 22 ASP HA H 1 3.944 0.017 . 1 . . . A 22 ASP HA . 17839 1
236 . 1 1 22 22 ASP HB2 H 1 2.666 0.006 . 2 . . . A 22 ASP HB2 . 17839 1
237 . 1 1 22 22 ASP HB3 H 1 2.497 0.021 . 2 . . . A 22 ASP HB3 . 17839 1
238 . 1 1 22 22 ASP C C 13 179.713 0.5 . 1 . . . A 22 ASP C . 17839 1
239 . 1 1 22 22 ASP CA C 13 57.116 0.156 . 1 . . . A 22 ASP CA . 17839 1
240 . 1 1 22 22 ASP CB C 13 39.5 0.167 . 1 . . . A 22 ASP CB . 17839 1
241 . 1 1 22 22 ASP N N 15 121.941 0.5 . 1 . . . A 22 ASP N . 17839 1
242 . 1 1 23 23 ALA H H 1 6.897 0.015 . 1 . . . A 23 ALA H . 17839 1
243 . 1 1 23 23 ALA HA H 1 4.18 0.085 . 1 . . . A 23 ALA HA . 17839 1
244 . 1 1 23 23 ALA HB1 H 1 1.327 0.042 . 1 . . . A 23 ALA HB . 17839 1
245 . 1 1 23 23 ALA HB2 H 1 1.327 0.042 . 1 . . . A 23 ALA HB . 17839 1
246 . 1 1 23 23 ALA HB3 H 1 1.327 0.042 . 1 . . . A 23 ALA HB . 17839 1
247 . 1 1 23 23 ALA C C 13 177.855 0.5 . 1 . . . A 23 ALA C . 17839 1
248 . 1 1 23 23 ALA CA C 13 52.301 0.5 . 1 . . . A 23 ALA CA . 17839 1
249 . 1 1 23 23 ALA CB C 13 18.99 0.5 . 1 . . . A 23 ALA CB . 17839 1
250 . 1 1 23 23 ALA N N 15 116.831 0.5 . 1 . . . A 23 ALA N . 17839 1
251 . 1 1 24 24 GLY H H 1 8.002 0.006 . 1 . . . A 24 GLY H . 17839 1
252 . 1 1 24 24 GLY HA2 H 1 3.949 0.03 . 2 . . . A 24 GLY HA2 . 17839 1
253 . 1 1 24 24 GLY HA3 H 1 3.745 0.009 . 2 . . . A 24 GLY HA3 . 17839 1
254 . 1 1 24 24 GLY C C 13 174.665 0.5 . 1 . . . A 24 GLY C . 17839 1
255 . 1 1 24 24 GLY CA C 13 45.811 0.067 . 1 . . . A 24 GLY CA . 17839 1
256 . 1 1 24 24 GLY N N 15 107.83 0.035 . 1 . . . A 24 GLY N . 17839 1
257 . 1 1 25 25 THR H H 1 7.784 0.018 . 1 . . . A 25 THR H . 17839 1
258 . 1 1 25 25 THR HA H 1 3.818 0.062 . 1 . . . A 25 THR HA . 17839 1
259 . 1 1 25 25 THR HB H 1 3.59 0.044 . 1 . . . A 25 THR HB . 17839 1
260 . 1 1 25 25 THR HG21 H 1 1.298 0.035 . 1 . . . A 25 THR HG2 . 17839 1
261 . 1 1 25 25 THR HG22 H 1 1.298 0.035 . 1 . . . A 25 THR HG2 . 17839 1
262 . 1 1 25 25 THR HG23 H 1 1.298 0.035 . 1 . . . A 25 THR HG2 . 17839 1
263 . 1 1 25 25 THR C C 13 173.187 0.5 . 1 . . . A 25 THR C . 17839 1
264 . 1 1 25 25 THR CA C 13 64.001 0.009 . 1 . . . A 25 THR CA . 17839 1
265 . 1 1 25 25 THR CB C 13 69.674 0.073 . 1 . . . A 25 THR CB . 17839 1
266 . 1 1 25 25 THR N N 15 117.914 0.025 . 1 . . . A 25 THR N . 17839 1
267 . 1 1 26 26 ALA H H 1 8.749 0.018 . 1 . . . A 26 ALA H . 17839 1
268 . 1 1 26 26 ALA HA H 1 3.997 0.034 . 1 . . . A 26 ALA HA . 17839 1
269 . 1 1 26 26 ALA HB1 H 1 1.258 0.024 . 1 . . . A 26 ALA HB . 17839 1
270 . 1 1 26 26 ALA HB2 H 1 1.258 0.024 . 1 . . . A 26 ALA HB . 17839 1
271 . 1 1 26 26 ALA HB3 H 1 1.258 0.024 . 1 . . . A 26 ALA HB . 17839 1
272 . 1 1 26 26 ALA C C 13 177.884 0.5 . 1 . . . A 26 ALA C . 17839 1
273 . 1 1 26 26 ALA CA C 13 53.109 0.017 . 1 . . . A 26 ALA CA . 17839 1
274 . 1 1 26 26 ALA CB C 13 18.868 0.079 . 1 . . . A 26 ALA CB . 17839 1
275 . 1 1 26 26 ALA N N 15 128.48 0.009 . 1 . . . A 26 ALA N . 17839 1
276 . 1 1 27 27 GLU H H 1 8.15 0.024 . 1 . . . A 27 GLU H . 17839 1
277 . 1 1 27 27 GLU HA H 1 2.239 0.038 . 1 . . . A 27 GLU HA . 17839 1
278 . 1 1 27 27 GLU HB2 H 1 1.548 0.012 . 1 . . . A 27 GLU HB2 . 17839 1
279 . 1 1 27 27 GLU HB3 H 1 1.548 0.012 . 1 . . . A 27 GLU HB3 . 17839 1
280 . 1 1 27 27 GLU HG2 H 1 1.889 0.028 . 1 . . . A 27 GLU HG2 . 17839 1
281 . 1 1 27 27 GLU HG3 H 1 1.889 0.028 . 1 . . . A 27 GLU HG3 . 17839 1
282 . 1 1 27 27 GLU C C 13 178.631 0.5 . 1 . . . A 27 GLU C . 17839 1
283 . 1 1 27 27 GLU CA C 13 57.838 0.12 . 1 . . . A 27 GLU CA . 17839 1
284 . 1 1 27 27 GLU CB C 13 28.918 0.071 . 1 . . . A 27 GLU CB . 17839 1
285 . 1 1 27 27 GLU CG C 13 35.919 0.5 . 1 . . . A 27 GLU CG . 17839 1
286 . 1 1 27 27 GLU N N 15 120.909 0.045 . 1 . . . A 27 GLU N . 17839 1
287 . 1 1 28 28 LYS H H 1 7.989 0.011 . 1 . . . A 28 LYS H . 17839 1
288 . 1 1 28 28 LYS HA H 1 3.789 0.04 . 1 . . . A 28 LYS HA . 17839 1
289 . 1 1 28 28 LYS HB2 H 1 2.21 0.013 . 1 . . . A 28 LYS HB2 . 17839 1
290 . 1 1 28 28 LYS HB3 H 1 2.21 0.013 . 1 . . . A 28 LYS HB3 . 17839 1
291 . 1 1 28 28 LYS HD2 H 1 1.406 0.089 . 1 . . . A 28 LYS HD2 . 17839 1
292 . 1 1 28 28 LYS HD3 H 1 1.406 0.089 . 1 . . . A 28 LYS HD3 . 17839 1
293 . 1 1 28 28 LYS C C 13 177.211 0.5 . 1 . . . A 28 LYS C . 17839 1
294 . 1 1 28 28 LYS CA C 13 58.09 0.01 . 1 . . . A 28 LYS CA . 17839 1
295 . 1 1 28 28 LYS CB C 13 30.996 0.26 . 1 . . . A 28 LYS CB . 17839 1
296 . 1 1 28 28 LYS N N 15 117.447 0.02 . 1 . . . A 28 LYS N . 17839 1
297 . 1 1 29 29 TYR H H 1 7.273 0.019 . 1 . . . A 29 TYR H . 17839 1
298 . 1 1 29 29 TYR HA H 1 4.387 0.024 . 1 . . . A 29 TYR HA . 17839 1
299 . 1 1 29 29 TYR HB2 H 1 3.103 0.039 . 2 . . . A 29 TYR HB2 . 17839 1
300 . 1 1 29 29 TYR HB3 H 1 2.5 0.02 . 2 . . . A 29 TYR HB3 . 17839 1
301 . 1 1 29 29 TYR HD1 H 1 6.964 0.006 . 1 . . . A 29 TYR HD1 . 17839 1
302 . 1 1 29 29 TYR HD2 H 1 6.964 0.006 . 1 . . . A 29 TYR HD2 . 17839 1
303 . 1 1 29 29 TYR HE1 H 1 6.678 0.024 . 1 . . . A 29 TYR HE1 . 17839 1
304 . 1 1 29 29 TYR HE2 H 1 6.678 0.024 . 1 . . . A 29 TYR HE2 . 17839 1
305 . 1 1 29 29 TYR C C 13 177.313 0.5 . 1 . . . A 29 TYR C . 17839 1
306 . 1 1 29 29 TYR CA C 13 59.358 0.04 . 1 . . . A 29 TYR CA . 17839 1
307 . 1 1 29 29 TYR CB C 13 38.456 0.026 . 1 . . . A 29 TYR CB . 17839 1
308 . 1 1 29 29 TYR CD1 C 13 126.886 0.5 . 1 . . . A 29 TYR CD1 . 17839 1
309 . 1 1 29 29 TYR CD2 C 13 126.886 0.5 . 1 . . . A 29 TYR CD2 . 17839 1
310 . 1 1 29 29 TYR CE1 C 13 118.394 0.5 . 1 . . . A 29 TYR CE1 . 17839 1
311 . 1 1 29 29 TYR CE2 C 13 118.394 0.5 . 1 . . . A 29 TYR CE2 . 17839 1
312 . 1 1 29 29 TYR N N 15 116.462 0.022 . 1 . . . A 29 TYR N . 17839 1
313 . 1 1 30 30 PHE H H 1 7.991 0.013 . 1 . . . A 30 PHE H . 17839 1
314 . 1 1 30 30 PHE HA H 1 4.08 0.017 . 1 . . . A 30 PHE HA . 17839 1
315 . 1 1 30 30 PHE HB2 H 1 3.072 0.028 . 1 . . . A 30 PHE HB2 . 17839 1
316 . 1 1 30 30 PHE HB3 H 1 3.072 0.028 . 1 . . . A 30 PHE HB3 . 17839 1
317 . 1 1 30 30 PHE HD1 H 1 6.95 0.035 . 1 . . . A 30 PHE HD1 . 17839 1
318 . 1 1 30 30 PHE HD2 H 1 6.95 0.035 . 1 . . . A 30 PHE HD2 . 17839 1
319 . 1 1 30 30 PHE C C 13 178.762 0.5 . 1 . . . A 30 PHE C . 17839 1
320 . 1 1 30 30 PHE CA C 13 58.572 0.031 . 1 . . . A 30 PHE CA . 17839 1
321 . 1 1 30 30 PHE CB C 13 42.121 0.009 . 1 . . . A 30 PHE CB . 17839 1
322 . 1 1 30 30 PHE N N 15 119.334 0.042 . 1 . . . A 30 PHE N . 17839 1
323 . 1 1 31 31 LYS H H 1 7.916 0.026 . 1 . . . A 31 LYS H . 17839 1
324 . 1 1 31 31 LYS HA H 1 3.904 0.053 . 1 . . . A 31 LYS HA . 17839 1
325 . 1 1 31 31 LYS HB2 H 1 1.623 0.017 . 1 . . . A 31 LYS HB2 . 17839 1
326 . 1 1 31 31 LYS HB3 H 1 1.623 0.017 . 1 . . . A 31 LYS HB3 . 17839 1
327 . 1 1 31 31 LYS HG2 H 1 1.268 0.017 . 1 . . . A 31 LYS HG2 . 17839 1
328 . 1 1 31 31 LYS HG3 H 1 1.268 0.017 . 1 . . . A 31 LYS HG3 . 17839 1
329 . 1 1 31 31 LYS HE2 H 1 2.481 0.001 . 1 . . . A 31 LYS HE2 . 17839 1
330 . 1 1 31 31 LYS HE3 H 1 2.481 0.001 . 1 . . . A 31 LYS HE3 . 17839 1
331 . 1 1 31 31 LYS C C 13 177.694 0.5 . 1 . . . A 31 LYS C . 17839 1
332 . 1 1 31 31 LYS CA C 13 58.62 0.054 . 1 . . . A 31 LYS CA . 17839 1
333 . 1 1 31 31 LYS CB C 13 31.552 0.122 . 1 . . . A 31 LYS CB . 17839 1
334 . 1 1 31 31 LYS CG C 13 23.669 0.5 . 1 . . . A 31 LYS CG . 17839 1
335 . 1 1 31 31 LYS CE C 13 41.671 0.5 . 1 . . . A 31 LYS CE . 17839 1
336 . 1 1 31 31 LYS N N 15 118.612 0.002 . 1 . . . A 31 LYS N . 17839 1
337 . 1 1 32 32 LEU H H 1 7.316 0.02 . 1 . . . A 32 LEU H . 17839 1
338 . 1 1 32 32 LEU HA H 1 3.765 0.099 . 1 . . . A 32 LEU HA . 17839 1
339 . 1 1 32 32 LEU HB2 H 1 1.939 0.017 . 2 . . . A 32 LEU HB2 . 17839 1
340 . 1 1 32 32 LEU HB3 H 1 1.392 0.046 . 2 . . . A 32 LEU HB3 . 17839 1
341 . 1 1 32 32 LEU HG H 1 1.675 0.017 . 1 . . . A 32 LEU HG . 17839 1
342 . 1 1 32 32 LEU HD11 H 1 0.685 0.029 . 2 . . . A 32 LEU HD1 . 17839 1
343 . 1 1 32 32 LEU HD12 H 1 0.685 0.029 . 2 . . . A 32 LEU HD1 . 17839 1
344 . 1 1 32 32 LEU HD13 H 1 0.685 0.029 . 2 . . . A 32 LEU HD1 . 17839 1
345 . 1 1 32 32 LEU C C 13 177.021 0.5 . 1 . . . A 32 LEU C . 17839 1
346 . 1 1 32 32 LEU CA C 13 57.341 0.5 . 1 . . . A 32 LEU CA . 17839 1
347 . 1 1 32 32 LEU CB C 13 41.417 0.5 . 1 . . . A 32 LEU CB . 17839 1
348 . 1 1 32 32 LEU N N 15 117.737 0.043 . 1 . . . A 32 LEU N . 17839 1
349 . 1 1 33 33 ILE H H 1 7.62 0.012 . 1 . . . A 33 ILE H . 17839 1
350 . 1 1 33 33 ILE HA H 1 3.652 0.08 . 1 . . . A 33 ILE HA . 17839 1
351 . 1 1 33 33 ILE HB H 1 2.097 0.025 . 1 . . . A 33 ILE HB . 17839 1
352 . 1 1 33 33 ILE HG12 H 1 1.299 0.026 . 1 . . . A 33 ILE HG12 . 17839 1
353 . 1 1 33 33 ILE HG13 H 1 1.299 0.026 . 1 . . . A 33 ILE HG13 . 17839 1
354 . 1 1 33 33 ILE HD11 H 1 0.658 0.019 . 1 . . . A 33 ILE HD1 . 17839 1
355 . 1 1 33 33 ILE HD12 H 1 0.658 0.019 . 1 . . . A 33 ILE HD1 . 17839 1
356 . 1 1 33 33 ILE HD13 H 1 0.658 0.019 . 1 . . . A 33 ILE HD1 . 17839 1
357 . 1 1 33 33 ILE C C 13 177.489 0.5 . 1 . . . A 33 ILE C . 17839 1
358 . 1 1 33 33 ILE CA C 13 61.785 0.5 . 1 . . . A 33 ILE CA . 17839 1
359 . 1 1 33 33 ILE CB C 13 35.702 0.5 . 1 . . . A 33 ILE CB . 17839 1
360 . 1 1 33 33 ILE N N 15 119.064 0.5 . 1 . . . A 33 ILE N . 17839 1
361 . 1 1 34 34 ALA H H 1 7.594 0.014 . 1 . . . A 34 ALA H . 17839 1
362 . 1 1 34 34 ALA HA H 1 3.78 0.03 . 1 . . . A 34 ALA HA . 17839 1
363 . 1 1 34 34 ALA HB1 H 1 1.223 0.022 . 1 . . . A 34 ALA HB . 17839 1
364 . 1 1 34 34 ALA HB2 H 1 1.223 0.022 . 1 . . . A 34 ALA HB . 17839 1
365 . 1 1 34 34 ALA HB3 H 1 1.223 0.022 . 1 . . . A 34 ALA HB . 17839 1
366 . 1 1 34 34 ALA C C 13 179.128 0.5 . 1 . . . A 34 ALA C . 17839 1
367 . 1 1 34 34 ALA CA C 13 54.852 0.037 . 1 . . . A 34 ALA CA . 17839 1
368 . 1 1 34 34 ALA CB C 13 18.25 0.116 . 1 . . . A 34 ALA CB . 17839 1
369 . 1 1 34 34 ALA N N 15 119.319 0.006 . 1 . . . A 34 ALA N . 17839 1
370 . 1 1 35 35 ASN H H 1 7.264 0.017 . 1 . . . A 35 ASN H . 17839 1
371 . 1 1 35 35 ASN HA H 1 4.493 0.016 . 1 . . . A 35 ASN HA . 17839 1
372 . 1 1 35 35 ASN HB2 H 1 2.658 0.033 . 2 . . . A 35 ASN HB2 . 17839 1
373 . 1 1 35 35 ASN HB3 H 1 2.499 0.023 . 2 . . . A 35 ASN HB3 . 17839 1
374 . 1 1 35 35 ASN C C 13 175.265 0.5 . 1 . . . A 35 ASN C . 17839 1
375 . 1 1 35 35 ASN CA C 13 52.596 0.002 . 1 . . . A 35 ASN CA . 17839 1
376 . 1 1 35 35 ASN CB C 13 38.907 0.082 . 1 . . . A 35 ASN CB . 17839 1
377 . 1 1 35 35 ASN N N 15 112.212 0.018 . 1 . . . A 35 ASN N . 17839 1
378 . 1 1 36 36 ALA H H 1 7.27 0.018 . 1 . . . A 36 ALA H . 17839 1
379 . 1 1 36 36 ALA HA H 1 4.009 0.026 . 1 . . . A 36 ALA HA . 17839 1
380 . 1 1 36 36 ALA HB1 H 1 1.201 0.017 . 1 . . . A 36 ALA HB . 17839 1
381 . 1 1 36 36 ALA HB2 H 1 1.201 0.017 . 1 . . . A 36 ALA HB . 17839 1
382 . 1 1 36 36 ALA HB3 H 1 1.201 0.017 . 1 . . . A 36 ALA HB . 17839 1
383 . 1 1 36 36 ALA C C 13 177.826 0.5 . 1 . . . A 36 ALA C . 17839 1
384 . 1 1 36 36 ALA CA C 13 53.137 0.044 . 1 . . . A 36 ALA CA . 17839 1
385 . 1 1 36 36 ALA CB C 13 19.517 0.5 . 1 . . . A 36 ALA CB . 17839 1
386 . 1 1 36 36 ALA N N 15 124.435 0.043 . 1 . . . A 36 ALA N . 17839 1
387 . 1 1 37 37 LYS H H 1 8.682 0.016 . 1 . . . A 37 LYS H . 17839 1
388 . 1 1 37 37 LYS HA H 1 4.173 0.045 . 1 . . . A 37 LYS HA . 17839 1
389 . 1 1 37 37 LYS HB2 H 1 1.819 0.023 . 2 . . . A 37 LYS HB2 . 17839 1
390 . 1 1 37 37 LYS HB3 H 1 1.556 0.033 . 2 . . . A 37 LYS HB3 . 17839 1
391 . 1 1 37 37 LYS HG2 H 1 1.324 0.012 . 1 . . . A 37 LYS HG2 . 17839 1
392 . 1 1 37 37 LYS HG3 H 1 1.324 0.012 . 1 . . . A 37 LYS HG3 . 17839 1
393 . 1 1 37 37 LYS C C 13 176.772 0.5 . 1 . . . A 37 LYS C . 17839 1
394 . 1 1 37 37 LYS CA C 13 56.537 0.024 . 1 . . . A 37 LYS CA . 17839 1
395 . 1 1 37 37 LYS CB C 13 34.899 0.095 . 1 . . . A 37 LYS CB . 17839 1
396 . 1 1 37 37 LYS CG C 13 25.088 0.5 . 1 . . . A 37 LYS CG . 17839 1
397 . 1 1 37 37 LYS CD C 13 28.542 0.5 . 1 . . . A 37 LYS CD . 17839 1
398 . 1 1 37 37 LYS CE C 13 41.539 0.5 . 1 . . . A 37 LYS CE . 17839 1
399 . 1 1 37 37 LYS N N 15 116.671 0.024 . 1 . . . A 37 LYS N . 17839 1
400 . 1 1 38 38 THR H H 1 7.232 0.013 . 1 . . . A 38 THR H . 17839 1
401 . 1 1 38 38 THR HA H 1 4.541 0.026 . 1 . . . A 38 THR HA . 17839 1
402 . 1 1 38 38 THR HB H 1 4.392 0.041 . 1 . . . A 38 THR HB . 17839 1
403 . 1 1 38 38 THR HG21 H 1 0.966 0.018 . 1 . . . A 38 THR HG2 . 17839 1
404 . 1 1 38 38 THR HG22 H 1 0.966 0.018 . 1 . . . A 38 THR HG2 . 17839 1
405 . 1 1 38 38 THR HG23 H 1 0.966 0.018 . 1 . . . A 38 THR HG2 . 17839 1
406 . 1 1 38 38 THR C C 13 173.816 0.5 . 1 . . . A 38 THR C . 17839 1
407 . 1 1 38 38 THR CA C 13 58.209 0.005 . 1 . . . A 38 THR CA . 17839 1
408 . 1 1 38 38 THR CB C 13 72.726 0.109 . 1 . . . A 38 THR CB . 17839 1
409 . 1 1 38 38 THR CG2 C 13 21.927 0.5 . 1 . . . A 38 THR CG2 . 17839 1
410 . 1 1 38 38 THR N N 15 106.22 0.5 . 1 . . . A 38 THR N . 17839 1
411 . 1 1 39 39 VAL H H 1 8.835 0.018 . 1 . . . A 39 VAL H . 17839 1
412 . 1 1 39 39 VAL HA H 1 2.878 0.037 . 1 . . . A 39 VAL HA . 17839 1
413 . 1 1 39 39 VAL HB H 1 1.628 0.02 . 1 . . . A 39 VAL HB . 17839 1
414 . 1 1 39 39 VAL HG11 H 1 0.661 0.048 . 2 . . . A 39 VAL HG1 . 17839 1
415 . 1 1 39 39 VAL HG12 H 1 0.661 0.048 . 2 . . . A 39 VAL HG1 . 17839 1
416 . 1 1 39 39 VAL HG13 H 1 0.661 0.048 . 2 . . . A 39 VAL HG1 . 17839 1
417 . 1 1 39 39 VAL C C 13 176.655 0.5 . 1 . . . A 39 VAL C . 17839 1
418 . 1 1 39 39 VAL CA C 13 67.118 0.053 . 1 . . . A 39 VAL CA . 17839 1
419 . 1 1 39 39 VAL CB C 13 31.26 0.256 . 1 . . . A 39 VAL CB . 17839 1
420 . 1 1 39 39 VAL N N 15 122.896 0.5 . 1 . . . A 39 VAL N . 17839 1
421 . 1 1 40 40 GLU H H 1 8.735 0.013 . 1 . . . A 40 GLU H . 17839 1
422 . 1 1 40 40 GLU HA H 1 3.782 0.023 . 1 . . . A 40 GLU HA . 17839 1
423 . 1 1 40 40 GLU HB2 H 1 1.786 0.025 . 1 . . . A 40 GLU HB2 . 17839 1
424 . 1 1 40 40 GLU HB3 H 1 1.786 0.025 . 1 . . . A 40 GLU HB3 . 17839 1
425 . 1 1 40 40 GLU HG2 H 1 2.117 0.023 . 1 . . . A 40 GLU HG2 . 17839 1
426 . 1 1 40 40 GLU HG3 H 1 2.117 0.023 . 1 . . . A 40 GLU HG3 . 17839 1
427 . 1 1 40 40 GLU C C 13 179.362 0.5 . 1 . . . A 40 GLU C . 17839 1
428 . 1 1 40 40 GLU CA C 13 59.924 0.134 . 1 . . . A 40 GLU CA . 17839 1
429 . 1 1 40 40 GLU CB C 13 28.256 0.156 . 1 . . . A 40 GLU CB . 17839 1
430 . 1 1 40 40 GLU CG C 13 36.68 0.5 . 1 . . . A 40 GLU CG . 17839 1
431 . 1 1 40 40 GLU N N 15 117.945 0.025 . 1 . . . A 40 GLU N . 17839 1
432 . 1 1 41 41 GLY H H 1 8.019 0.011 . 1 . . . A 41 GLY H . 17839 1
433 . 1 1 41 41 GLY HA2 H 1 3.603 0.023 . 2 . . . A 41 GLY HA2 . 17839 1
434 . 1 1 41 41 GLY HA3 H 1 2.457 0.041 . 2 . . . A 41 GLY HA3 . 17839 1
435 . 1 1 41 41 GLY C C 13 176.275 0.5 . 1 . . . A 41 GLY C . 17839 1
436 . 1 1 41 41 GLY CA C 13 46.305 0.147 . 1 . . . A 41 GLY CA . 17839 1
437 . 1 1 41 41 GLY N N 15 108.576 0.055 . 1 . . . A 41 GLY N . 17839 1
438 . 1 1 42 42 VAL H H 1 7.705 0.015 . 1 . . . A 42 VAL H . 17839 1
439 . 1 1 42 42 VAL HA H 1 3.743 0.016 . 1 . . . A 42 VAL HA . 17839 1
440 . 1 1 42 42 VAL HB H 1 2.006 0.057 . 1 . . . A 42 VAL HB . 17839 1
441 . 1 1 42 42 VAL HG11 H 1 0.611 0.026 . 2 . . . A 42 VAL HG1 . 17839 1
442 . 1 1 42 42 VAL HG12 H 1 0.611 0.026 . 2 . . . A 42 VAL HG1 . 17839 1
443 . 1 1 42 42 VAL HG13 H 1 0.611 0.026 . 2 . . . A 42 VAL HG1 . 17839 1
444 . 1 1 42 42 VAL HG21 H 1 0.681 0.044 . 2 . . . A 42 VAL HG2 . 17839 1
445 . 1 1 42 42 VAL HG22 H 1 0.681 0.044 . 2 . . . A 42 VAL HG2 . 17839 1
446 . 1 1 42 42 VAL HG23 H 1 0.681 0.044 . 2 . . . A 42 VAL HG2 . 17839 1
447 . 1 1 42 42 VAL C C 13 177.211 0.5 . 1 . . . A 42 VAL C . 17839 1
448 . 1 1 42 42 VAL CA C 13 67.317 0.115 . 1 . . . A 42 VAL CA . 17839 1
449 . 1 1 42 42 VAL CB C 13 30.233 0.002 . 1 . . . A 42 VAL CB . 17839 1
450 . 1 1 42 42 VAL CG1 C 13 23.688 0.5 . 1 . . . A 42 VAL CG1 . 17839 1
451 . 1 1 42 42 VAL N N 15 122.823 0.5 . 1 . . . A 42 VAL N . 17839 1
452 . 1 1 43 43 TRP H H 1 7.497 0.048 . 1 . . . A 43 TRP H . 17839 1
453 . 1 1 43 43 TRP HA H 1 4.312 0.032 . 1 . . . A 43 TRP HA . 17839 1
454 . 1 1 43 43 TRP HB2 H 1 3.194 0.025 . 2 . . . A 43 TRP HB2 . 17839 1
455 . 1 1 43 43 TRP HB3 H 1 3.09 0.012 . 2 . . . A 43 TRP HB3 . 17839 1
456 . 1 1 43 43 TRP HD1 H 1 6.933 0.036 . 1 . . . A 43 TRP HD1 . 17839 1
457 . 1 1 43 43 TRP HE1 H 1 9.882 0.004 . 1 . . . A 43 TRP HE1 . 17839 1
458 . 1 1 43 43 TRP HE3 H 1 7.276 0.033 . 1 . . . A 43 TRP HE3 . 17839 1
459 . 1 1 43 43 TRP HZ2 H 1 7.234 0.002 . 1 . . . A 43 TRP HZ2 . 17839 1
460 . 1 1 43 43 TRP HZ3 H 1 6.926 0.004 . 1 . . . A 43 TRP HZ3 . 17839 1
461 . 1 1 43 43 TRP HH2 H 1 6.801 0.105 . 1 . . . A 43 TRP HH2 . 17839 1
462 . 1 1 43 43 TRP C C 13 178.879 0.5 . 1 . . . A 43 TRP C . 17839 1
463 . 1 1 43 43 TRP CA C 13 59.233 0.03 . 1 . . . A 43 TRP CA . 17839 1
464 . 1 1 43 43 TRP CB C 13 28.803 0.076 . 1 . . . A 43 TRP CB . 17839 1
465 . 1 1 43 43 TRP CD1 C 13 129.535 0.5 . 1 . . . A 43 TRP CD1 . 17839 1
466 . 1 1 43 43 TRP CE3 C 13 120.116 0.012 . 1 . . . A 43 TRP CE3 . 17839 1
467 . 1 1 43 43 TRP CZ2 C 13 114.529 0.5 . 1 . . . A 43 TRP CZ2 . 17839 1
468 . 1 1 43 43 TRP CZ3 C 13 123.992 0.5 . 1 . . . A 43 TRP CZ3 . 17839 1
469 . 1 1 43 43 TRP CH2 C 13 121.152 0.5 . 1 . . . A 43 TRP CH2 . 17839 1
470 . 1 1 43 43 TRP N N 15 119.439 0.5 . 1 . . . A 43 TRP N . 17839 1
471 . 1 1 43 43 TRP NE1 N 15 128.274 0.5 . 1 . . . A 43 TRP NE1 . 17839 1
472 . 1 1 44 44 THR H H 1 8.278 0.034 . 1 . . . A 44 THR H . 17839 1
473 . 1 1 44 44 THR HA H 1 3.877 0.034 . 1 . . . A 44 THR HA . 17839 1
474 . 1 1 44 44 THR HB H 1 4.099 0.081 . 1 . . . A 44 THR HB . 17839 1
475 . 1 1 44 44 THR HG21 H 1 1.059 0.024 . 1 . . . A 44 THR HG2 . 17839 1
476 . 1 1 44 44 THR HG22 H 1 1.059 0.024 . 1 . . . A 44 THR HG2 . 17839 1
477 . 1 1 44 44 THR HG23 H 1 1.059 0.024 . 1 . . . A 44 THR HG2 . 17839 1
478 . 1 1 44 44 THR C C 13 177.299 0.5 . 1 . . . A 44 THR C . 17839 1
479 . 1 1 44 44 THR CA C 13 66.178 0.002 . 1 . . . A 44 THR CA . 17839 1
480 . 1 1 44 44 THR CB C 13 68.938 0.106 . 1 . . . A 44 THR CB . 17839 1
481 . 1 1 44 44 THR CG2 C 13 22.161 0.5 . 1 . . . A 44 THR CG2 . 17839 1
482 . 1 1 44 44 THR N N 15 115.13 0.02 . 1 . . . A 44 THR N . 17839 1
483 . 1 1 45 45 LEU H H 1 7.835 0.016 . 1 . . . A 45 LEU H . 17839 1
484 . 1 1 45 45 LEU HA H 1 3.939 0.038 . 1 . . . A 45 LEU HA . 17839 1
485 . 1 1 45 45 LEU HB2 H 1 1.671 0.049 . 1 . . . A 45 LEU HB2 . 17839 1
486 . 1 1 45 45 LEU HB3 H 1 1.671 0.049 . 1 . . . A 45 LEU HB3 . 17839 1
487 . 1 1 45 45 LEU HG H 1 1.098 0.016 . 1 . . . A 45 LEU HG . 17839 1
488 . 1 1 45 45 LEU HD11 H 1 0.642 0.009 . 2 . . . A 45 LEU HD1 . 17839 1
489 . 1 1 45 45 LEU HD12 H 1 0.642 0.009 . 2 . . . A 45 LEU HD1 . 17839 1
490 . 1 1 45 45 LEU HD13 H 1 0.642 0.009 . 2 . . . A 45 LEU HD1 . 17839 1
491 . 1 1 45 45 LEU C C 13 178.235 0.5 . 1 . . . A 45 LEU C . 17839 1
492 . 1 1 45 45 LEU CA C 13 57.647 0.036 . 1 . . . A 45 LEU CA . 17839 1
493 . 1 1 45 45 LEU CB C 13 42.308 0.037 . 1 . . . A 45 LEU CB . 17839 1
494 . 1 1 45 45 LEU CG C 13 24.678 0.5 . 1 . . . A 45 LEU CG . 17839 1
495 . 1 1 45 45 LEU N N 15 123.159 0.018 . 1 . . . A 45 LEU N . 17839 1
496 . 1 1 46 46 LYS H H 1 8.521 0.025 . 1 . . . A 46 LYS H . 17839 1
497 . 1 1 46 46 LYS HA H 1 3.52 0.025 . 1 . . . A 46 LYS HA . 17839 1
498 . 1 1 46 46 LYS HB2 H 1 1.811 0.082 . 1 . . . A 46 LYS HB2 . 17839 1
499 . 1 1 46 46 LYS HB3 H 1 1.811 0.082 . 1 . . . A 46 LYS HB3 . 17839 1
500 . 1 1 46 46 LYS HG2 H 1 1.222 0.018 . 1 . . . A 46 LYS HG2 . 17839 1
501 . 1 1 46 46 LYS HG3 H 1 1.222 0.018 . 1 . . . A 46 LYS HG3 . 17839 1
502 . 1 1 46 46 LYS C C 13 177.518 0.5 . 1 . . . A 46 LYS C . 17839 1
503 . 1 1 46 46 LYS CA C 13 60.558 0.002 . 1 . . . A 46 LYS CA . 17839 1
504 . 1 1 46 46 LYS CB C 13 30.225 0.066 . 1 . . . A 46 LYS CB . 17839 1
505 . 1 1 46 46 LYS N N 15 119.348 0.022 . 1 . . . A 46 LYS N . 17839 1
506 . 1 1 47 47 ASP H H 1 7.45 0.012 . 1 . . . A 47 ASP H . 17839 1
507 . 1 1 47 47 ASP HA H 1 3.736 0.089 . 1 . . . A 47 ASP HA . 17839 1
508 . 1 1 47 47 ASP HB2 H 1 2.484 0.029 . 1 . . . A 47 ASP HB2 . 17839 1
509 . 1 1 47 47 ASP HB3 H 1 2.484 0.029 . 1 . . . A 47 ASP HB3 . 17839 1
510 . 1 1 47 47 ASP C C 13 178.689 0.5 . 1 . . . A 47 ASP C . 17839 1
511 . 1 1 47 47 ASP CA C 13 57.139 0.024 . 1 . . . A 47 ASP CA . 17839 1
512 . 1 1 47 47 ASP CB C 13 39.796 0.157 . 1 . . . A 47 ASP CB . 17839 1
513 . 1 1 47 47 ASP N N 15 117.39 0.5 . 1 . . . A 47 ASP N . 17839 1
514 . 1 1 48 48 GLU H H 1 7.732 0.068 . 1 . . . A 48 GLU H . 17839 1
515 . 1 1 48 48 GLU HA H 1 3.76 0.013 . 1 . . . A 48 GLU HA . 17839 1
516 . 1 1 48 48 GLU HB2 H 1 1.855 0.025 . 1 . . . A 48 GLU HB2 . 17839 1
517 . 1 1 48 48 GLU HB3 H 1 1.855 0.025 . 1 . . . A 48 GLU HB3 . 17839 1
518 . 1 1 48 48 GLU C C 13 179.201 0.5 . 1 . . . A 48 GLU C . 17839 1
519 . 1 1 48 48 GLU CA C 13 59.072 0.021 . 1 . . . A 48 GLU CA . 17839 1
520 . 1 1 48 48 GLU CB C 13 29.661 0.044 . 1 . . . A 48 GLU CB . 17839 1
521 . 1 1 48 48 GLU CG C 13 35.685 0.5 . 1 . . . A 48 GLU CG . 17839 1
522 . 1 1 48 48 GLU N N 15 121.902 0.018 . 1 . . . A 48 GLU N . 17839 1
523 . 1 1 49 49 ILE H H 1 8.551 0.01 . 1 . . . A 49 ILE H . 17839 1
524 . 1 1 49 49 ILE HA H 1 3.58 0.04 . 1 . . . A 49 ILE HA . 17839 1
525 . 1 1 49 49 ILE HB H 1 1.47 0.049 . 1 . . . A 49 ILE HB . 17839 1
526 . 1 1 49 49 ILE HD11 H 1 0.555 0.043 . 1 . . . A 49 ILE HD1 . 17839 1
527 . 1 1 49 49 ILE HD12 H 1 0.555 0.043 . 1 . . . A 49 ILE HD1 . 17839 1
528 . 1 1 49 49 ILE HD13 H 1 0.555 0.043 . 1 . . . A 49 ILE HD1 . 17839 1
529 . 1 1 49 49 ILE C C 13 178.704 0.5 . 1 . . . A 49 ILE C . 17839 1
530 . 1 1 49 49 ILE CA C 13 64.001 0.153 . 1 . . . A 49 ILE CA . 17839 1
531 . 1 1 49 49 ILE CB C 13 37.963 0.5 . 1 . . . A 49 ILE CB . 17839 1
532 . 1 1 49 49 ILE N N 15 120.605 0.01 . 1 . . . A 49 ILE N . 17839 1
533 . 1 1 50 50 LYS H H 1 7.567 0.024 . 1 . . . A 50 LYS H . 17839 1
534 . 1 1 50 50 LYS HA H 1 3.709 0.06 . 1 . . . A 50 LYS HA . 17839 1
535 . 1 1 50 50 LYS HB2 H 1 1.65 0.055 . 1 . . . A 50 LYS HB2 . 17839 1
536 . 1 1 50 50 LYS HB3 H 1 1.65 0.055 . 1 . . . A 50 LYS HB3 . 17839 1
537 . 1 1 50 50 LYS HE2 H 1 2.767 0.05 . 1 . . . A 50 LYS HE2 . 17839 1
538 . 1 1 50 50 LYS HE3 H 1 2.767 0.05 . 1 . . . A 50 LYS HE3 . 17839 1
539 . 1 1 50 50 LYS C C 13 177.753 0.5 . 1 . . . A 50 LYS C . 17839 1
540 . 1 1 50 50 LYS CA C 13 59.664 0.186 . 1 . . . A 50 LYS CA . 17839 1
541 . 1 1 50 50 LYS CB C 13 32.153 0.137 . 1 . . . A 50 LYS CB . 17839 1
542 . 1 1 50 50 LYS CG C 13 25.44 0.5 . 1 . . . A 50 LYS CG . 17839 1
543 . 1 1 50 50 LYS N N 15 119.061 0.178 . 1 . . . A 50 LYS N . 17839 1
544 . 1 1 51 51 THR H H 1 7.426 0.003 . 1 . . . A 51 THR H . 17839 1
545 . 1 1 51 51 THR HA H 1 4.148 0.003 . 1 . . . A 51 THR HA . 17839 1
546 . 1 1 51 51 THR HB H 1 3.853 0.055 . 1 . . . A 51 THR HB . 17839 1
547 . 1 1 51 51 THR HG21 H 1 0.963 0.029 . 1 . . . A 51 THR HG2 . 17839 1
548 . 1 1 51 51 THR HG22 H 1 0.963 0.029 . 1 . . . A 51 THR HG2 . 17839 1
549 . 1 1 51 51 THR HG23 H 1 0.963 0.029 . 1 . . . A 51 THR HG2 . 17839 1
550 . 1 1 51 51 THR C C 13 175.44 0.5 . 1 . . . A 51 THR C . 17839 1
551 . 1 1 51 51 THR CA C 13 63.347 0.134 . 1 . . . A 51 THR CA . 17839 1
552 . 1 1 51 51 THR CB C 13 69.707 0.23 . 1 . . . A 51 THR CB . 17839 1
553 . 1 1 51 51 THR N N 15 109.727 0.046 . 1 . . . A 51 THR N . 17839 1
554 . 1 1 52 52 PHE H H 1 7.446 0.018 . 1 . . . A 52 PHE H . 17839 1
555 . 1 1 52 52 PHE HA H 1 4.508 0.043 . 1 . . . A 52 PHE HA . 17839 1
556 . 1 1 52 52 PHE HB2 H 1 2.965 0.021 . 2 . . . A 52 PHE HB2 . 17839 1
557 . 1 1 52 52 PHE HB3 H 1 2.869 0.027 . 2 . . . A 52 PHE HB3 . 17839 1
558 . 1 1 52 52 PHE HD1 H 1 6.639 0.025 . 1 . . . A 52 PHE HD1 . 17839 1
559 . 1 1 52 52 PHE HD2 H 1 6.639 0.025 . 1 . . . A 52 PHE HD2 . 17839 1
560 . 1 1 52 52 PHE HE1 H 1 6.958 0.044 . 1 . . . A 52 PHE HE1 . 17839 1
561 . 1 1 52 52 PHE HE2 H 1 6.958 0.044 . 1 . . . A 52 PHE HE2 . 17839 1
562 . 1 1 52 52 PHE C C 13 176.816 0.5 . 1 . . . A 52 PHE C . 17839 1
563 . 1 1 52 52 PHE CA C 13 56.96 0.034 . 1 . . . A 52 PHE CA . 17839 1
564 . 1 1 52 52 PHE CB C 13 37.524 0.063 . 1 . . . A 52 PHE CB . 17839 1
565 . 1 1 52 52 PHE CD1 C 13 130.709 0.5 . 1 . . . A 52 PHE CD1 . 17839 1
566 . 1 1 52 52 PHE CD2 C 13 130.709 0.5 . 1 . . . A 52 PHE CD2 . 17839 1
567 . 1 1 52 52 PHE CE1 C 13 132.594 0.5 . 1 . . . A 52 PHE CE1 . 17839 1
568 . 1 1 52 52 PHE CE2 C 13 132.594 0.5 . 1 . . . A 52 PHE CE2 . 17839 1
569 . 1 1 52 52 PHE N N 15 120.966 0.038 . 1 . . . A 52 PHE N . 17839 1
570 . 1 1 53 53 THR H H 1 7.953 0.029 . 1 . . . A 53 THR H . 17839 1
571 . 1 1 53 53 THR HA H 1 4.223 0.019 . 1 . . . A 53 THR HA . 17839 1
572 . 1 1 53 53 THR HB H 1 4.089 0.009 . 1 . . . A 53 THR HB . 17839 1
573 . 1 1 53 53 THR HG21 H 1 1.007 0.05 . 1 . . . A 53 THR HG2 . 17839 1
574 . 1 1 53 53 THR HG22 H 1 1.007 0.05 . 1 . . . A 53 THR HG2 . 17839 1
575 . 1 1 53 53 THR HG23 H 1 1.007 0.05 . 1 . . . A 53 THR HG2 . 17839 1
576 . 1 1 53 53 THR C C 13 180.987 0.5 . 1 . . . A 53 THR C . 17839 1
577 . 1 1 53 53 THR CA C 13 58.214 0.5 . 1 . . . A 53 THR CA . 17839 1
578 . 1 1 53 53 THR CB C 13 70.157 0.5 . 1 . . . A 53 THR CB . 17839 1
579 . 1 1 53 53 THR N N 15 114.357 0.017 . 1 . . . A 53 THR N . 17839 1
580 . 1 1 54 54 VAL H H 1 8.045 0.02 . 1 . . . A 54 VAL H . 17839 1
581 . 1 1 54 54 VAL HA H 1 4.102 0.037 . 1 . . . A 54 VAL HA . 17839 1
582 . 1 1 54 54 VAL HB H 1 1.998 0.003 . 1 . . . A 54 VAL HB . 17839 1
583 . 1 1 54 54 VAL HG11 H 1 0.752 0.025 . 2 . . . A 54 VAL HG1 . 17839 1
584 . 1 1 54 54 VAL HG12 H 1 0.752 0.025 . 2 . . . A 54 VAL HG1 . 17839 1
585 . 1 1 54 54 VAL HG13 H 1 0.752 0.025 . 2 . . . A 54 VAL HG1 . 17839 1
586 . 1 1 54 54 VAL C C 13 179.509 0.5 . 1 . . . A 54 VAL C . 17839 1
587 . 1 1 54 54 VAL CA C 13 62.553 0.01 . 1 . . . A 54 VAL CA . 17839 1
588 . 1 1 54 54 VAL CB C 13 32.722 0.048 . 1 . . . A 54 VAL CB . 17839 1
589 . 1 1 54 54 VAL CG1 C 13 20.815 0.5 . 1 . . . A 54 VAL CG1 . 17839 1
590 . 1 1 54 54 VAL N N 15 122.097 0.5 . 1 . . . A 54 VAL N . 17839 1
591 . 1 1 55 55 THR H H 1 8.209 0.007 . 1 . . . A 55 THR H . 17839 1
592 . 1 1 55 55 THR HA H 1 4.235 0.05 . 1 . . . A 55 THR HA . 17839 1
593 . 1 1 55 55 THR HB H 1 4.015 0.05 . 1 . . . A 55 THR HB . 17839 1
594 . 1 1 55 55 THR HG21 H 1 0.967 0.05 . 1 . . . A 55 THR HG2 . 17839 1
595 . 1 1 55 55 THR HG22 H 1 0.967 0.05 . 1 . . . A 55 THR HG2 . 17839 1
596 . 1 1 55 55 THR HG23 H 1 0.967 0.05 . 1 . . . A 55 THR HG2 . 17839 1
597 . 1 1 55 55 THR CA C 13 61.732 0.5 . 1 . . . A 55 THR CA . 17839 1
598 . 1 1 55 55 THR CB C 13 69.869 0.5 . 1 . . . A 55 THR CB . 17839 1
599 . 1 1 55 55 THR N N 15 118.59 0.004 . 1 . . . A 55 THR N . 17839 1
600 . 1 1 56 56 GLU H H 1 7.993 0.002 . 1 . . . A 56 GLU H . 17839 1
601 . 1 1 56 56 GLU CA C 13 57.985 0.5 . 1 . . . A 56 GLU CA . 17839 1
602 . 1 1 56 56 GLU CB C 13 30.469 0.5 . 1 . . . A 56 GLU CB . 17839 1
603 . 1 1 56 56 GLU N N 15 128.656 0.056 . 1 . . . A 56 GLU N . 17839 1
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