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 7350
_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 HNCO . . . 7350 1
2 HNCACO . . . 7350 1
3 HNCACB . . . 7350 1
4 CBCACONH . . . 7350 1
5 HNCA . . . 7350 1
6 HBHACONH . . . 7350 1
7 HNCAHA . . . 7350 1
8 CCH-COSY . . . 7350 1
9 HCCH-TOCSY . . . 7350 1
10 HNH-NOESY . . . 7350 1
11 HCH-NOESY . . . 7350 1
12 'CNH- NOESY' . . . 7350 1
13 HH-NOESY . . . 7350 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 MET HA H 1 4.026 0.004 . . . . . . 1 MET HA . 7350 1
2 . 1 1 1 1 MET HB2 H 1 2.112 0.004 . . . . . . 1 MET HB1 . 7350 1
3 . 1 1 1 1 MET HB3 H 1 2.058 0.004 . . . . . . 1 MET HB2 . 7350 1
4 . 1 1 1 1 MET HE1 H 1 2.043 0.010 . . . . . . 1 MET QE . 7350 1
5 . 1 1 1 1 MET HE2 H 1 2.043 0.010 . . . . . . 1 MET QE . 7350 1
6 . 1 1 1 1 MET HE3 H 1 2.043 0.010 . . . . . . 1 MET QE . 7350 1
7 . 1 1 1 1 MET HG2 H 1 2.567 0.010 . . . . . . 1 MET HG1 . 7350 1
8 . 1 1 1 1 MET HG3 H 1 2.534 0.030 . . . . . . 1 MET HG2 . 7350 1
9 . 1 1 1 1 MET CB C 13 30.995 0.100 . . . . . . 1 MET CB . 7350 1
10 . 1 1 1 1 MET CE C 13 71.156 0.100 . . . . . . 1 MET CE . 7350 1
11 . 1 1 1 1 MET CG C 13 28.274 0.100 . . . . . . 1 MET CG . 7350 1
12 . 1 1 2 2 GLU HA H 1 4.380 0.015 . . . . . . 2 GLU HA . 7350 1
13 . 1 1 2 2 GLU HB2 H 1 2.120 0.005 . . . . . . 2 GLU HB1 . 7350 1
14 . 1 1 2 2 GLU HB3 H 1 1.944 0.008 . . . . . . 2 GLU HB2 . 7350 1
15 . 1 1 2 2 GLU HG2 H 1 2.317 0.010 . . . . . . 2 GLU HG1 . 7350 1
16 . 1 1 2 2 GLU HG3 H 1 2.301 0.015 . . . . . . 2 GLU HG2 . 7350 1
17 . 1 1 2 2 GLU CA C 13 53.725 0.100 . . . . . . 2 GLU CA . 7350 1
18 . 1 1 2 2 GLU CB C 13 27.594 0.100 . . . . . . 2 GLU CB . 7350 1
19 . 1 1 2 2 GLU CG C 13 33.553 0.100 . . . . . . 2 GLU CG . 7350 1
20 . 1 1 3 3 MET H H 1 8.786 0.010 . . . . . . 3 MET H . 7350 1
21 . 1 1 3 3 MET HA H 1 4.388 0.005 . . . . . . 3 MET HA . 7350 1
22 . 1 1 3 3 MET HB2 H 1 2.068 0.015 . . . . . . 3 MET HB1 . 7350 1
23 . 1 1 3 3 MET HB3 H 1 2.068 0.015 . . . . . . 3 MET HB2 . 7350 1
24 . 1 1 3 3 MET HE1 H 1 2.043 0.010 . . . . . . 3 MET QE . 7350 1
25 . 1 1 3 3 MET HE2 H 1 2.043 0.010 . . . . . . 3 MET QE . 7350 1
26 . 1 1 3 3 MET HE3 H 1 2.043 0.010 . . . . . . 3 MET QE . 7350 1
27 . 1 1 3 3 MET HG2 H 1 2.612 0.015 . . . . . . 3 MET HG1 . 7350 1
28 . 1 1 3 3 MET HG3 H 1 2.575 0.010 . . . . . . 3 MET HG2 . 7350 1
29 . 1 1 3 3 MET C C 13 174.957 0.100 . . . . . . 3 MET C . 7350 1
30 . 1 1 3 3 MET CA C 13 54.033 0.100 . . . . . . 3 MET CA . 7350 1
31 . 1 1 3 3 MET CB C 13 29.754 0.100 . . . . . . 3 MET CB . 7350 1
32 . 1 1 3 3 MET CE C 13 71.156 0.100 . . . . . . 3 MET CE . 7350 1
33 . 1 1 3 3 MET CG C 13 29.544 0.100 . . . . . . 3 MET CG . 7350 1
34 . 1 1 3 3 MET N N 15 123.131 0.100 . . . . . . 3 MET N . 7350 1
35 . 1 1 4 4 GLY H H 1 8.695 0.010 . . . . . . 4 GLY H . 7350 1
36 . 1 1 4 4 GLY HA2 H 1 3.961 0.009 . . . . . . 4 GLY HA1 . 7350 1
37 . 1 1 4 4 GLY HA3 H 1 3.852 0.006 . . . . . . 4 GLY HA2 . 7350 1
38 . 1 1 4 4 GLY C C 13 172.952 0.100 . . . . . . 4 GLY C . 7350 1
39 . 1 1 4 4 GLY CA C 13 43.855 0.100 . . . . . . 4 GLY CA . 7350 1
40 . 1 1 4 4 GLY N N 15 109.240 0.100 . . . . . . 4 GLY N . 7350 1
41 . 1 1 5 5 GLN H H 1 8.028 0.010 . . . . . . 5 GLN H . 7350 1
42 . 1 1 5 5 GLN HA H 1 4.254 0.005 . . . . . . 5 GLN HA . 7350 1
43 . 1 1 5 5 GLN HB2 H 1 2.161 0.005 . . . . . . 5 GLN HB1 . 7350 1
44 . 1 1 5 5 GLN HB3 H 1 2.080 0.001 . . . . . . 5 GLN HB2 . 7350 1
45 . 1 1 5 5 GLN HE21 H 1 7.557 0.010 . . . . . . 5 GLN HE21 . 7350 1
46 . 1 1 5 5 GLN HE22 H 1 6.882 0.010 . . . . . . 5 GLN HE22 . 7350 1
47 . 1 1 5 5 GLN HG2 H 1 2.449 0.004 . . . . . . 5 GLN HG1 . 7350 1
48 . 1 1 5 5 GLN HG3 H 1 2.372 0.007 . . . . . . 5 GLN HG2 . 7350 1
49 . 1 1 5 5 GLN C C 13 175.185 0.100 . . . . . . 5 GLN C . 7350 1
50 . 1 1 5 5 GLN CA C 13 54.807 0.100 . . . . . . 5 GLN CA . 7350 1
51 . 1 1 5 5 GLN CB C 13 26.166 0.100 . . . . . . 5 GLN CB . 7350 1
52 . 1 1 5 5 GLN CG C 13 31.356 0.100 . . . . . . 5 GLN CG . 7350 1
53 . 1 1 5 5 GLN N N 15 119.958 0.100 . . . . . . 5 GLN N . 7350 1
54 . 1 1 5 5 GLN NE2 N 15 112.594 0.100 . . . . . . 5 GLN NE2 . 7350 1
55 . 1 1 6 6 LEU H H 1 8.166 0.010 . . . . . . 6 LEU H . 7350 1
56 . 1 1 6 6 LEU HA H 1 4.053 0.006 . . . . . . 6 LEU HA . 7350 1
57 . 1 1 6 6 LEU HB2 H 1 1.603 0.015 . . . . . . 6 LEU HB1 . 7350 1
58 . 1 1 6 6 LEU HB3 H 1 1.774 0.015 . . . . . . 6 LEU HB2 . 7350 1
59 . 1 1 6 6 LEU HD11 H 1 0.856 0.010 . . . . . . 6 LEU QD1 . 7350 1
60 . 1 1 6 6 LEU HD12 H 1 0.856 0.010 . . . . . . 6 LEU QD1 . 7350 1
61 . 1 1 6 6 LEU HD13 H 1 0.856 0.010 . . . . . . 6 LEU QD1 . 7350 1
62 . 1 1 6 6 LEU HD21 H 1 0.913 0.015 . . . . . . 6 LEU QD2 . 7350 1
63 . 1 1 6 6 LEU HD22 H 1 0.913 0.015 . . . . . . 6 LEU QD2 . 7350 1
64 . 1 1 6 6 LEU HD23 H 1 0.913 0.015 . . . . . . 6 LEU QD2 . 7350 1
65 . 1 1 6 6 LEU HG H 1 1.539 0.004 . . . . . . 6 LEU HG . 7350 1
66 . 1 1 6 6 LEU C C 13 175.765 0.100 . . . . . . 6 LEU C . 7350 1
67 . 1 1 6 6 LEU CA C 13 55.343 0.100 . . . . . . 6 LEU CA . 7350 1
68 . 1 1 6 6 LEU CB C 13 38.864 0.100 . . . . . . 6 LEU CB . 7350 1
69 . 1 1 6 6 LEU CD1 C 13 22.294 0.100 . . . . . . 6 LEU CD1 . 7350 1
70 . 1 1 6 6 LEU CD2 C 13 21.282 0.100 . . . . . . 6 LEU CD2 . 7350 1
71 . 1 1 6 6 LEU CG C 13 24.603 0.100 . . . . . . 6 LEU CG . 7350 1
72 . 1 1 6 6 LEU N N 15 122.147 0.100 . . . . . . 6 LEU N . 7350 1
73 . 1 1 7 7 LYS H H 1 8.379 0.010 . . . . . . 7 LYS H . 7350 1
74 . 1 1 7 7 LYS HA H 1 3.820 0.006 . . . . . . 7 LYS HA . 7350 1
75 . 1 1 7 7 LYS HB2 H 1 1.881 0.010 . . . . . . 7 LYS HB1 . 7350 1
76 . 1 1 7 7 LYS HB3 H 1 1.845 0.010 . . . . . . 7 LYS HB2 . 7350 1
77 . 1 1 7 7 LYS HD2 H 1 1.661 0.010 . . . . . . 7 LYS HD1 . 7350 1
78 . 1 1 7 7 LYS HD3 H 1 1.661 0.010 . . . . . . 7 LYS HD2 . 7350 1
79 . 1 1 7 7 LYS HE2 H 1 2.941 0.010 . . . . . . 7 LYS HE1 . 7350 1
80 . 1 1 7 7 LYS HE3 H 1 2.941 0.010 . . . . . . 7 LYS HE2 . 7350 1
81 . 1 1 7 7 LYS HG2 H 1 1.502 0.015 . . . . . . 7 LYS HG1 . 7350 1
82 . 1 1 7 7 LYS HG3 H 1 1.323 0.015 . . . . . . 7 LYS HG2 . 7350 1
83 . 1 1 7 7 LYS C C 13 175.996 0.100 . . . . . . 7 LYS C . 7350 1
84 . 1 1 7 7 LYS CA C 13 57.440 0.100 . . . . . . 7 LYS CA . 7350 1
85 . 1 1 7 7 LYS CB C 13 29.296 0.100 . . . . . . 7 LYS CB . 7350 1
86 . 1 1 7 7 LYS CD C 13 26.661 0.100 . . . . . . 7 LYS CD . 7350 1
87 . 1 1 7 7 LYS CE C 13 39.391 0.100 . . . . . . 7 LYS CE . 7350 1
88 . 1 1 7 7 LYS CG C 13 22.727 0.100 . . . . . . 7 LYS CG . 7350 1
89 . 1 1 7 7 LYS N N 15 118.349 0.100 . . . . . . 7 LYS N . 7350 1
90 . 1 1 8 8 ASN H H 1 7.797 0.010 . . . . . . 8 ASN H . 7350 1
91 . 1 1 8 8 ASN HA H 1 4.442 0.015 . . . . . . 8 ASN HA . 7350 1
92 . 1 1 8 8 ASN HB2 H 1 2.839 0.015 . . . . . . 8 ASN HB1 . 7350 1
93 . 1 1 8 8 ASN HB3 H 1 2.839 0.015 . . . . . . 8 ASN HB2 . 7350 1
94 . 1 1 8 8 ASN HD21 H 1 7.588 0.010 . . . . . . 8 ASN HD21 . 7350 1
95 . 1 1 8 8 ASN HD22 H 1 6.917 0.010 . . . . . . 8 ASN HD22 . 7350 1
96 . 1 1 8 8 ASN C C 13 174.791 0.100 . . . . . . 8 ASN C . 7350 1
97 . 1 1 8 8 ASN CA C 13 53.489 0.100 . . . . . . 8 ASN CA . 7350 1
98 . 1 1 8 8 ASN CB C 13 35.683 0.100 . . . . . . 8 ASN CB . 7350 1
99 . 1 1 8 8 ASN N N 15 117.612 0.100 . . . . . . 8 ASN N . 7350 1
100 . 1 1 8 8 ASN ND2 N 15 112.418 0.100 . . . . . . 8 ASN ND2 . 7350 1
101 . 1 1 9 9 LYS H H 1 8.028 0.010 . . . . . . 9 LYS H . 7350 1
102 . 1 1 9 9 LYS HA H 1 4.097 0.015 . . . . . . 9 LYS HA . 7350 1
103 . 1 1 9 9 LYS HB2 H 1 1.868 0.015 . . . . . . 9 LYS HB1 . 7350 1
104 . 1 1 9 9 LYS HB3 H 1 2.041 0.010 . . . . . . 9 LYS HB2 . 7350 1
105 . 1 1 9 9 LYS HD2 H 1 1.603 0.010 . . . . . . 9 LYS HD1 . 7350 1
106 . 1 1 9 9 LYS HD3 H 1 1.603 0.010 . . . . . . 9 LYS HD2 . 7350 1
107 . 1 1 9 9 LYS HE2 H 1 2.956 0.010 . . . . . . 9 LYS HE1 . 7350 1
108 . 1 1 9 9 LYS HE3 H 1 2.956 0.010 . . . . . . 9 LYS HE2 . 7350 1
109 . 1 1 9 9 LYS HG2 H 1 1.674 0.015 . . . . . . 9 LYS HG1 . 7350 1
110 . 1 1 9 9 LYS HG3 H 1 1.488 0.003 . . . . . . 9 LYS HG2 . 7350 1
111 . 1 1 9 9 LYS C C 13 177.275 0.100 . . . . . . 9 LYS C . 7350 1
112 . 1 1 9 9 LYS CA C 13 57.032 0.100 . . . . . . 9 LYS CA . 7350 1
113 . 1 1 9 9 LYS CB C 13 30.184 0.100 . . . . . . 9 LYS CB . 7350 1
114 . 1 1 9 9 LYS CD C 13 26.673 0.100 . . . . . . 9 LYS CD . 7350 1
115 . 1 1 9 9 LYS CE C 13 39.480 0.100 . . . . . . 9 LYS CE . 7350 1
116 . 1 1 9 9 LYS CG C 13 23.182 0.100 . . . . . . 9 LYS CG . 7350 1
117 . 1 1 9 9 LYS N N 15 120.506 0.100 . . . . . . 9 LYS N . 7350 1
118 . 1 1 10 10 ILE H H 1 8.526 0.010 . . . . . . 10 ILE H . 7350 1
119 . 1 1 10 10 ILE HA H 1 3.410 0.002 . . . . . . 10 ILE HA . 7350 1
120 . 1 1 10 10 ILE HB H 1 1.904 0.010 . . . . . . 10 ILE HB . 7350 1
121 . 1 1 10 10 ILE HD11 H 1 0.685 0.010 . . . . . . 10 ILE QD1 . 7350 1
122 . 1 1 10 10 ILE HD12 H 1 0.685 0.010 . . . . . . 10 ILE QD1 . 7350 1
123 . 1 1 10 10 ILE HD13 H 1 0.685 0.010 . . . . . . 10 ILE QD1 . 7350 1
124 . 1 1 10 10 ILE HG12 H 1 0.755 0.010 . . . . . . 10 ILE HG11 . 7350 1
125 . 1 1 10 10 ILE HG13 H 1 1.767 0.010 . . . . . . 10 ILE HG12 . 7350 1
126 . 1 1 10 10 ILE HG21 H 1 0.797 0.015 . . . . . . 10 ILE QG2 . 7350 1
127 . 1 1 10 10 ILE HG22 H 1 0.797 0.015 . . . . . . 10 ILE QG2 . 7350 1
128 . 1 1 10 10 ILE HG23 H 1 0.797 0.015 . . . . . . 10 ILE QG2 . 7350 1
129 . 1 1 10 10 ILE C C 13 174.342 0.100 . . . . . . 10 ILE C . 7350 1
130 . 1 1 10 10 ILE CA C 13 63.589 0.100 . . . . . . 10 ILE CA . 7350 1
131 . 1 1 10 10 ILE CB C 13 35.272 0.100 . . . . . . 10 ILE CB . 7350 1
132 . 1 1 10 10 ILE CD1 C 13 11.359 0.100 . . . . . . 10 ILE CD1 . 7350 1
133 . 1 1 10 10 ILE CG1 C 13 29.255 0.100 . . . . . . 10 ILE CG1 . 7350 1
134 . 1 1 10 10 ILE CG2 C 13 14.224 0.100 . . . . . . 10 ILE CG2 . 7350 1
135 . 1 1 10 10 ILE N N 15 121.427 0.100 . . . . . . 10 ILE N . 7350 1
136 . 1 1 11 11 GLU H H 1 8.086 0.010 . . . . . . 11 GLU H . 7350 1
137 . 1 1 11 11 GLU HA H 1 3.977 0.004 . . . . . . 11 GLU HA . 7350 1
138 . 1 1 11 11 GLU HB2 H 1 2.054 0.015 . . . . . . 11 GLU HB1 . 7350 1
139 . 1 1 11 11 GLU HB3 H 1 2.130 0.015 . . . . . . 11 GLU HB2 . 7350 1
140 . 1 1 11 11 GLU HG2 H 1 2.354 0.015 . . . . . . 11 GLU HG1 . 7350 1
141 . 1 1 11 11 GLU HG3 H 1 2.247 0.015 . . . . . . 11 GLU HG2 . 7350 1
142 . 1 1 11 11 GLU C C 13 176.315 0.100 . . . . . . 11 GLU C . 7350 1
143 . 1 1 11 11 GLU CA C 13 56.658 0.100 . . . . . . 11 GLU CA . 7350 1
144 . 1 1 11 11 GLU CB C 13 26.316 0.100 . . . . . . 11 GLU CB . 7350 1
145 . 1 1 11 11 GLU CG C 13 32.867 0.100 . . . . . . 11 GLU CG . 7350 1
146 . 1 1 11 11 GLU N N 15 119.831 0.100 . . . . . . 11 GLU N . 7350 1
147 . 1 1 12 12 ASN H H 1 8.005 0.010 . . . . . . 12 ASN H . 7350 1
148 . 1 1 12 12 ASN HA H 1 4.439 0.015 . . . . . . 12 ASN HA . 7350 1
149 . 1 1 12 12 ASN HB2 H 1 2.829 0.001 . . . . . . 12 ASN HB1 . 7350 1
150 . 1 1 12 12 ASN HB3 H 1 2.829 0.001 . . . . . . 12 ASN HB2 . 7350 1
151 . 1 1 12 12 ASN HD21 H 1 7.559 0.010 . . . . . . 12 ASN HD21 . 7350 1
152 . 1 1 12 12 ASN HD22 H 1 6.818 0.010 . . . . . . 12 ASN HD22 . 7350 1
153 . 1 1 12 12 ASN C C 13 174.898 0.100 . . . . . . 12 ASN C . 7350 1
154 . 1 1 12 12 ASN CA C 13 53.673 0.100 . . . . . . 12 ASN CA . 7350 1
155 . 1 1 12 12 ASN CB C 13 35.615 0.100 . . . . . . 12 ASN CB . 7350 1
156 . 1 1 12 12 ASN N N 15 116.912 0.100 . . . . . . 12 ASN N . 7350 1
157 . 1 1 12 12 ASN ND2 N 15 112.560 0.100 . . . . . . 12 ASN ND2 . 7350 1
158 . 1 1 13 13 LYS H H 1 8.128 0.010 . . . . . . 13 LYS H . 7350 1
159 . 1 1 13 13 LYS HA H 1 4.123 0.004 . . . . . . 13 LYS HA . 7350 1
160 . 1 1 13 13 LYS HB2 H 1 1.785 0.009 . . . . . . 13 LYS HB1 . 7350 1
161 . 1 1 13 13 LYS HB3 H 1 1.909 0.022 . . . . . . 13 LYS HB2 . 7350 1
162 . 1 1 13 13 LYS HD2 H 1 1.764 0.010 . . . . . . 13 LYS HD1 . 7350 1
163 . 1 1 13 13 LYS HD3 H 1 1.963 0.008 . . . . . . 13 LYS HD2 . 7350 1
164 . 1 1 13 13 LYS HE2 H 1 3.002 0.003 . . . . . . 13 LYS HE1 . 7350 1
165 . 1 1 13 13 LYS HE3 H 1 2.711 0.003 . . . . . . 13 LYS HE2 . 7350 1
166 . 1 1 13 13 LYS HG2 H 1 1.409 0.011 . . . . . . 13 LYS HG1 . 7350 1
167 . 1 1 13 13 LYS HG3 H 1 1.530 0.032 . . . . . . 13 LYS HG2 . 7350 1
168 . 1 1 13 13 LYS C C 13 175.823 0.100 . . . . . . 13 LYS C . 7350 1
169 . 1 1 13 13 LYS CA C 13 54.224 0.100 . . . . . . 13 LYS CA . 7350 1
170 . 1 1 13 13 LYS CB C 13 27.493 0.100 . . . . . . 13 LYS CB . 7350 1
171 . 1 1 13 13 LYS CD C 13 23.602 0.100 . . . . . . 13 LYS CD . 7350 1
172 . 1 1 13 13 LYS CE C 13 38.765 0.100 . . . . . . 13 LYS CE . 7350 1
173 . 1 1 13 13 LYS CG C 13 21.872 0.100 . . . . . . 13 LYS CG . 7350 1
174 . 1 1 13 13 LYS N N 15 120.599 0.100 . . . . . . 13 LYS N . 7350 1
175 . 1 1 14 14 LYS H H 1 8.724 0.010 . . . . . . 14 LYS H . 7350 1
176 . 1 1 14 14 LYS HA H 1 3.707 0.010 . . . . . . 14 LYS HA . 7350 1
177 . 1 1 14 14 LYS HB2 H 1 2.002 0.010 . . . . . . 14 LYS HB1 . 7350 1
178 . 1 1 14 14 LYS HB3 H 1 1.860 0.010 . . . . . . 14 LYS HB2 . 7350 1
179 . 1 1 14 14 LYS HD2 H 1 1.706 0.010 . . . . . . 14 LYS HD1 . 7350 1
180 . 1 1 14 14 LYS HD3 H 1 1.528 0.015 . . . . . . 14 LYS HD2 . 7350 1
181 . 1 1 14 14 LYS HE2 H 1 2.791 0.008 . . . . . . 14 LYS HE1 . 7350 1
182 . 1 1 14 14 LYS HE3 H 1 2.704 0.004 . . . . . . 14 LYS HE2 . 7350 1
183 . 1 1 14 14 LYS HG2 H 1 1.122 0.010 . . . . . . 14 LYS HG1 . 7350 1
184 . 1 1 14 14 LYS HG3 H 1 1.534 0.015 . . . . . . 14 LYS HG2 . 7350 1
185 . 1 1 14 14 LYS C C 13 175.209 0.100 . . . . . . 14 LYS C . 7350 1
186 . 1 1 14 14 LYS CA C 13 57.717 0.100 . . . . . . 14 LYS CA . 7350 1
187 . 1 1 14 14 LYS CB C 13 29.301 0.100 . . . . . . 14 LYS CB . 7350 1
188 . 1 1 14 14 LYS CD C 13 26.806 0.100 . . . . . . 14 LYS CD . 7350 1
189 . 1 1 14 14 LYS CE C 13 38.604 0.100 . . . . . . 14 LYS CE . 7350 1
190 . 1 1 14 14 LYS CG C 13 21.995 0.100 . . . . . . 14 LYS CG . 7350 1
191 . 1 1 14 14 LYS N N 15 119.511 0.100 . . . . . . 14 LYS N . 7350 1
192 . 1 1 15 15 LYS H H 1 7.804 0.010 . . . . . . 15 LYS H . 7350 1
193 . 1 1 15 15 LYS HA H 1 3.881 0.015 . . . . . . 15 LYS HA . 7350 1
194 . 1 1 15 15 LYS HB2 H 1 2.009 0.010 . . . . . . 15 LYS HB1 . 7350 1
195 . 1 1 15 15 LYS HB3 H 1 1.925 0.010 . . . . . . 15 LYS HB2 . 7350 1
196 . 1 1 15 15 LYS HD2 H 1 1.697 0.010 . . . . . . 15 LYS HD1 . 7350 1
197 . 1 1 15 15 LYS HD3 H 1 1.697 0.010 . . . . . . 15 LYS HD2 . 7350 1
198 . 1 1 15 15 LYS HE2 H 1 2.958 0.010 . . . . . . 15 LYS HE1 . 7350 1
199 . 1 1 15 15 LYS HE3 H 1 2.958 0.010 . . . . . . 15 LYS HE2 . 7350 1
200 . 1 1 15 15 LYS HG2 H 1 1.689 0.015 . . . . . . 15 LYS HG1 . 7350 1
201 . 1 1 15 15 LYS HG3 H 1 1.386 0.015 . . . . . . 15 LYS HG2 . 7350 1
202 . 1 1 15 15 LYS C C 13 176.794 0.100 . . . . . . 15 LYS C . 7350 1
203 . 1 1 15 15 LYS CA C 13 57.640 0.100 . . . . . . 15 LYS CA . 7350 1
204 . 1 1 15 15 LYS CB C 13 29.434 0.100 . . . . . . 15 LYS CB . 7350 1
205 . 1 1 15 15 LYS CD C 13 26.768 0.100 . . . . . . 15 LYS CD . 7350 1
206 . 1 1 15 15 LYS CE C 13 39.504 0.100 . . . . . . 15 LYS CE . 7350 1
207 . 1 1 15 15 LYS CG C 13 23.114 0.100 . . . . . . 15 LYS CG . 7350 1
208 . 1 1 15 15 LYS N N 15 117.560 0.100 . . . . . . 15 LYS N . 7350 1
209 . 1 1 16 16 GLU H H 1 7.963 0.010 . . . . . . 16 GLU H . 7350 1
210 . 1 1 16 16 GLU HA H 1 3.993 0.015 . . . . . . 16 GLU HA . 7350 1
211 . 1 1 16 16 GLU HB2 H 1 1.872 0.010 . . . . . . 16 GLU HB1 . 7350 1
212 . 1 1 16 16 GLU HB3 H 1 2.372 0.015 . . . . . . 16 GLU HB2 . 7350 1
213 . 1 1 16 16 GLU HG2 H 1 2.232 0.010 . . . . . . 16 GLU HG1 . 7350 1
214 . 1 1 16 16 GLU HG3 H 1 2.663 0.010 . . . . . . 16 GLU HG2 . 7350 1
215 . 1 1 16 16 GLU C C 13 176.961 0.100 . . . . . . 16 GLU C . 7350 1
216 . 1 1 16 16 GLU CA C 13 56.539 0.100 . . . . . . 16 GLU CA . 7350 1
217 . 1 1 16 16 GLU CB C 13 27.543 0.100 . . . . . . 16 GLU CB . 7350 1
218 . 1 1 16 16 GLU CG C 13 33.711 0.100 . . . . . . 16 GLU CG . 7350 1
219 . 1 1 16 16 GLU N N 15 118.730 0.100 . . . . . . 16 GLU N . 7350 1
220 . 1 1 17 17 LEU H H 1 8.134 0.010 . . . . . . 17 LEU H . 7350 1
221 . 1 1 17 17 LEU HA H 1 4.040 0.015 . . . . . . 17 LEU HA . 7350 1
222 . 1 1 17 17 LEU HB2 H 1 2.141 0.015 . . . . . . 17 LEU HB1 . 7350 1
223 . 1 1 17 17 LEU HB3 H 1 1.494 0.003 . . . . . . 17 LEU HB2 . 7350 1
224 . 1 1 17 17 LEU HD11 H 1 0.939 0.008 . . . . . . 17 LEU QD1 . 7350 1
225 . 1 1 17 17 LEU HD12 H 1 0.939 0.008 . . . . . . 17 LEU QD1 . 7350 1
226 . 1 1 17 17 LEU HD13 H 1 0.939 0.008 . . . . . . 17 LEU QD1 . 7350 1
227 . 1 1 17 17 LEU HD21 H 1 0.940 0.004 . . . . . . 17 LEU QD2 . 7350 1
228 . 1 1 17 17 LEU HD22 H 1 0.940 0.004 . . . . . . 17 LEU QD2 . 7350 1
229 . 1 1 17 17 LEU HD23 H 1 0.940 0.004 . . . . . . 17 LEU QD2 . 7350 1
230 . 1 1 17 17 LEU HG H 1 1.663 0.007 . . . . . . 17 LEU HG . 7350 1
231 . 1 1 17 17 LEU C C 13 175.161 0.100 . . . . . . 17 LEU C . 7350 1
232 . 1 1 17 17 LEU CA C 13 55.965 0.100 . . . . . . 17 LEU CA . 7350 1
233 . 1 1 17 17 LEU CB C 13 39.231 0.100 . . . . . . 17 LEU CB . 7350 1
234 . 1 1 17 17 LEU CD1 C 13 23.968 0.100 . . . . . . 17 LEU CD1 . 7350 1
235 . 1 1 17 17 LEU CD2 C 13 21.652 0.100 . . . . . . 17 LEU CD2 . 7350 1
236 . 1 1 17 17 LEU CG C 13 24.826 0.100 . . . . . . 17 LEU CG . 7350 1
237 . 1 1 17 17 LEU N N 15 120.495 0.100 . . . . . . 17 LEU N . 7350 1
238 . 1 1 18 18 ILE H H 1 8.417 0.010 . . . . . . 18 ILE H . 7350 1
239 . 1 1 18 18 ILE HA H 1 3.513 0.012 . . . . . . 18 ILE HA . 7350 1
240 . 1 1 18 18 ILE HB H 1 1.850 0.010 . . . . . . 18 ILE HB . 7350 1
241 . 1 1 18 18 ILE HD11 H 1 0.800 0.010 . . . . . . 18 ILE QD1 . 7350 1
242 . 1 1 18 18 ILE HD12 H 1 0.800 0.010 . . . . . . 18 ILE QD1 . 7350 1
243 . 1 1 18 18 ILE HD13 H 1 0.800 0.010 . . . . . . 18 ILE QD1 . 7350 1
244 . 1 1 18 18 ILE HG12 H 1 0.773 0.008 . . . . . . 18 ILE HG11 . 7350 1
245 . 1 1 18 18 ILE HG13 H 1 1.768 0.005 . . . . . . 18 ILE HG12 . 7350 1
246 . 1 1 18 18 ILE HG21 H 1 0.864 0.010 . . . . . . 18 ILE QG2 . 7350 1
247 . 1 1 18 18 ILE HG22 H 1 0.864 0.010 . . . . . . 18 ILE QG2 . 7350 1
248 . 1 1 18 18 ILE HG23 H 1 0.864 0.010 . . . . . . 18 ILE QG2 . 7350 1
249 . 1 1 18 18 ILE C C 13 174.425 0.100 . . . . . . 18 ILE C . 7350 1
250 . 1 1 18 18 ILE CA C 13 63.610 0.100 . . . . . . 18 ILE CA . 7350 1
251 . 1 1 18 18 ILE CB C 13 35.687 0.100 . . . . . . 18 ILE CB . 7350 1
252 . 1 1 18 18 ILE CD1 C 13 12.105 0.100 . . . . . . 18 ILE CD1 . 7350 1
253 . 1 1 18 18 ILE CG1 C 13 27.338 0.100 . . . . . . 18 ILE CG1 . 7350 1
254 . 1 1 18 18 ILE CG2 C 13 15.007 0.100 . . . . . . 18 ILE CG2 . 7350 1
255 . 1 1 18 18 ILE N N 15 119.102 0.100 . . . . . . 18 ILE N . 7350 1
256 . 1 1 19 19 GLN H H 1 7.937 0.010 . . . . . . 19 GLN H . 7350 1
257 . 1 1 19 19 GLN HA H 1 3.968 0.004 . . . . . . 19 GLN HA . 7350 1
258 . 1 1 19 19 GLN HB2 H 1 2.127 0.015 . . . . . . 19 GLN HB1 . 7350 1
259 . 1 1 19 19 GLN HB3 H 1 2.092 0.005 . . . . . . 19 GLN HB2 . 7350 1
260 . 1 1 19 19 GLN HE21 H 1 7.428 0.010 . . . . . . 19 GLN HE21 . 7350 1
261 . 1 1 19 19 GLN HE22 H 1 6.864 0.010 . . . . . . 19 GLN HE22 . 7350 1
262 . 1 1 19 19 GLN HG2 H 1 2.383 0.015 . . . . . . 19 GLN HG1 . 7350 1
263 . 1 1 19 19 GLN HG3 H 1 2.521 0.015 . . . . . . 19 GLN HG2 . 7350 1
264 . 1 1 19 19 GLN C C 13 176.169 0.100 . . . . . . 19 GLN C . 7350 1
265 . 1 1 19 19 GLN CA C 13 56.108 0.100 . . . . . . 19 GLN CA . 7350 1
266 . 1 1 19 19 GLN CB C 13 25.865 0.100 . . . . . . 19 GLN CB . 7350 1
267 . 1 1 19 19 GLN CG C 13 31.618 0.100 . . . . . . 19 GLN CG . 7350 1
268 . 1 1 19 19 GLN N N 15 115.970 0.100 . . . . . . 19 GLN N . 7350 1
269 . 1 1 19 19 GLN NE2 N 15 111.760 0.100 . . . . . . 19 GLN NE2 . 7350 1
270 . 1 1 20 20 LEU H H 1 7.581 0.010 . . . . . . 20 LEU H . 7350 1
271 . 1 1 20 20 LEU HA H 1 4.046 0.015 . . . . . . 20 LEU HA . 7350 1
272 . 1 1 20 20 LEU HB2 H 1 1.970 0.010 . . . . . . 20 LEU HB1 . 7350 1
273 . 1 1 20 20 LEU HB3 H 1 1.374 0.008 . . . . . . 20 LEU HB2 . 7350 1
274 . 1 1 20 20 LEU HD11 H 1 0.820 0.001 . . . . . . 20 LEU QD1 . 7350 1
275 . 1 1 20 20 LEU HD12 H 1 0.820 0.001 . . . . . . 20 LEU QD1 . 7350 1
276 . 1 1 20 20 LEU HD13 H 1 0.820 0.001 . . . . . . 20 LEU QD1 . 7350 1
277 . 1 1 20 20 LEU HD21 H 1 0.771 0.003 . . . . . . 20 LEU QD2 . 7350 1
278 . 1 1 20 20 LEU HD22 H 1 0.771 0.003 . . . . . . 20 LEU QD2 . 7350 1
279 . 1 1 20 20 LEU HD23 H 1 0.771 0.003 . . . . . . 20 LEU QD2 . 7350 1
280 . 1 1 20 20 LEU HG H 1 1.870 0.009 . . . . . . 20 LEU HG . 7350 1
281 . 1 1 20 20 LEU C C 13 175.923 0.100 . . . . . . 20 LEU C . 7350 1
282 . 1 1 20 20 LEU CA C 13 55.370 0.100 . . . . . . 20 LEU CA . 7350 1
283 . 1 1 20 20 LEU CB C 13 40.426 0.100 . . . . . . 20 LEU CB . 7350 1
284 . 1 1 20 20 LEU CD1 C 13 20.878 0.100 . . . . . . 20 LEU CD1 . 7350 1
285 . 1 1 20 20 LEU CD2 C 13 23.966 0.100 . . . . . . 20 LEU CD2 . 7350 1
286 . 1 1 20 20 LEU CG C 13 24.225 0.100 . . . . . . 20 LEU CG . 7350 1
287 . 1 1 20 20 LEU N N 15 118.758 0.100 . . . . . . 20 LEU N . 7350 1
288 . 1 1 21 21 VAL H H 1 8.029 0.010 . . . . . . 21 VAL H . 7350 1
289 . 1 1 21 21 VAL HA H 1 3.500 0.009 . . . . . . 21 VAL HA . 7350 1
290 . 1 1 21 21 VAL HB H 1 1.813 0.015 . . . . . . 21 VAL HB . 7350 1
291 . 1 1 21 21 VAL HG11 H 1 0.291 0.004 . . . . . . 21 VAL QG1 . 7350 1
292 . 1 1 21 21 VAL HG12 H 1 0.291 0.004 . . . . . . 21 VAL QG1 . 7350 1
293 . 1 1 21 21 VAL HG13 H 1 0.291 0.004 . . . . . . 21 VAL QG1 . 7350 1
294 . 1 1 21 21 VAL HG21 H 1 0.690 0.005 . . . . . . 21 VAL QG2 . 7350 1
295 . 1 1 21 21 VAL HG22 H 1 0.690 0.005 . . . . . . 21 VAL QG2 . 7350 1
296 . 1 1 21 21 VAL HG23 H 1 0.690 0.005 . . . . . . 21 VAL QG2 . 7350 1
297 . 1 1 21 21 VAL C C 13 175.827 0.100 . . . . . . 21 VAL C . 7350 1
298 . 1 1 21 21 VAL CA C 13 63.833 0.100 . . . . . . 21 VAL CA . 7350 1
299 . 1 1 21 21 VAL CB C 13 28.699 0.100 . . . . . . 21 VAL CB . 7350 1
300 . 1 1 21 21 VAL CG1 C 13 18.077 0.100 . . . . . . 21 VAL CG1 . 7350 1
301 . 1 1 21 21 VAL CG2 C 13 19.692 0.100 . . . . . . 21 VAL CG2 . 7350 1
302 . 1 1 21 21 VAL N N 15 118.486 0.100 . . . . . . 21 VAL N . 7350 1
303 . 1 1 22 22 ALA H H 1 8.542 0.010 . . . . . . 22 ALA H . 7350 1
304 . 1 1 22 22 ALA HA H 1 3.986 0.006 . . . . . . 22 ALA HA . 7350 1
305 . 1 1 22 22 ALA HB1 H 1 1.498 0.015 . . . . . . 22 ALA QB . 7350 1
306 . 1 1 22 22 ALA HB2 H 1 1.498 0.015 . . . . . . 22 ALA QB . 7350 1
307 . 1 1 22 22 ALA HB3 H 1 1.498 0.015 . . . . . . 22 ALA QB . 7350 1
308 . 1 1 22 22 ALA C C 13 177.995 0.100 . . . . . . 22 ALA C . 7350 1
309 . 1 1 22 22 ALA CA C 13 52.408 0.100 . . . . . . 22 ALA CA . 7350 1
310 . 1 1 22 22 ALA CB C 13 15.900 0.100 . . . . . . 22 ALA CB . 7350 1
311 . 1 1 22 22 ALA N N 15 120.633 0.100 . . . . . . 22 ALA N . 7350 1
312 . 1 1 23 23 ARG H H 1 7.789 0.010 . . . . . . 23 ARG H . 7350 1
313 . 1 1 23 23 ARG HA H 1 4.128 0.015 . . . . . . 23 ARG HA . 7350 1
314 . 1 1 23 23 ARG HB2 H 1 1.994 0.015 . . . . . . 23 ARG HB1 . 7350 1
315 . 1 1 23 23 ARG HB3 H 1 2.079 0.015 . . . . . . 23 ARG HB2 . 7350 1
316 . 1 1 23 23 ARG HD2 H 1 3.166 0.006 . . . . . . 23 ARG HD1 . 7350 1
317 . 1 1 23 23 ARG HD3 H 1 3.166 0.006 . . . . . . 23 ARG HD2 . 7350 1
318 . 1 1 23 23 ARG HG2 H 1 1.924 0.002 . . . . . . 23 ARG HG1 . 7350 1
319 . 1 1 23 23 ARG HG3 H 1 1.755 0.007 . . . . . . 23 ARG HG2 . 7350 1
320 . 1 1 23 23 ARG C C 13 174.475 0.100 . . . . . . 23 ARG C . 7350 1
321 . 1 1 23 23 ARG CA C 13 55.242 0.100 . . . . . . 23 ARG CA . 7350 1
322 . 1 1 23 23 ARG CB C 13 27.249 0.100 . . . . . . 23 ARG CB . 7350 1
323 . 1 1 23 23 ARG CD C 13 41.043 0.100 . . . . . . 23 ARG CD . 7350 1
324 . 1 1 23 23 ARG CG C 13 24.831 0.100 . . . . . . 23 ARG CG . 7350 1
325 . 1 1 23 23 ARG N N 15 117.910 0.100 . . . . . . 23 ARG N . 7350 1
326 . 1 1 24 24 HIS H H 1 7.948 0.010 . . . . . . 24 HIS H . 7350 1
327 . 1 1 24 24 HIS HA H 1 4.387 0.008 . . . . . . 24 HIS HA . 7350 1
328 . 1 1 24 24 HIS HB2 H 1 2.946 0.004 . . . . . . 24 HIS HB1 . 7350 1
329 . 1 1 24 24 HIS HB3 H 1 3.376 0.015 . . . . . . 24 HIS HB2 . 7350 1
330 . 1 1 24 24 HIS HD2 H 1 6.925 0.007 . . . . . . 24 HIS HD2 . 7350 1
331 . 1 1 24 24 HIS C C 13 172.538 0.100 . . . . . . 24 HIS C . 7350 1
332 . 1 1 24 24 HIS CA C 13 54.831 0.100 . . . . . . 24 HIS CA . 7350 1
333 . 1 1 24 24 HIS CB C 13 27.176 0.100 . . . . . . 24 HIS CB . 7350 1
334 . 1 1 24 24 HIS CD2 C 13 119.161 0.100 . . . . . . 24 HIS CD2 . 7350 1
335 . 1 1 24 24 HIS N N 15 118.834 0.100 . . . . . . 24 HIS N . 7350 1
336 . 1 1 25 25 GLY H H 1 7.750 0.010 . . . . . . 25 GLY H . 7350 1
337 . 1 1 25 25 GLY HA2 H 1 4.194 0.004 . . . . . . 25 GLY HA1 . 7350 1
338 . 1 1 25 25 GLY HA3 H 1 3.666 0.003 . . . . . . 25 GLY HA2 . 7350 1
339 . 1 1 25 25 GLY C C 13 171.296 0.100 . . . . . . 25 GLY C . 7350 1
340 . 1 1 25 25 GLY CA C 13 43.048 0.100 . . . . . . 25 GLY CA . 7350 1
341 . 1 1 25 25 GLY N N 15 104.698 0.100 . . . . . . 25 GLY N . 7350 1
342 . 1 1 26 26 LEU H H 1 7.130 0.010 . . . . . . 26 LEU H . 7350 1
343 . 1 1 26 26 LEU HA H 1 4.383 0.001 . . . . . . 26 LEU HA . 7350 1
344 . 1 1 26 26 LEU HB2 H 1 1.437 0.015 . . . . . . 26 LEU HB1 . 7350 1
345 . 1 1 26 26 LEU HB3 H 1 1.614 0.001 . . . . . . 26 LEU HB2 . 7350 1
346 . 1 1 26 26 LEU HD11 H 1 0.871 0.010 . . . . . . 26 LEU QD1 . 7350 1
347 . 1 1 26 26 LEU HD12 H 1 0.871 0.010 . . . . . . 26 LEU QD1 . 7350 1
348 . 1 1 26 26 LEU HD13 H 1 0.871 0.010 . . . . . . 26 LEU QD1 . 7350 1
349 . 1 1 26 26 LEU HD21 H 1 0.794 0.001 . . . . . . 26 LEU QD2 . 7350 1
350 . 1 1 26 26 LEU HD22 H 1 0.794 0.001 . . . . . . 26 LEU QD2 . 7350 1
351 . 1 1 26 26 LEU HD23 H 1 0.794 0.001 . . . . . . 26 LEU QD2 . 7350 1
352 . 1 1 26 26 LEU HG H 1 1.771 0.002 . . . . . . 26 LEU HG . 7350 1
353 . 1 1 26 26 LEU C C 13 173.358 0.100 . . . . . . 26 LEU C . 7350 1
354 . 1 1 26 26 LEU CA C 13 52.546 0.100 . . . . . . 26 LEU CA . 7350 1
355 . 1 1 26 26 LEU CB C 13 41.273 0.100 . . . . . . 26 LEU CB . 7350 1
356 . 1 1 26 26 LEU CD1 C 13 22.283 0.100 . . . . . . 26 LEU CD1 . 7350 1
357 . 1 1 26 26 LEU CD2 C 13 21.968 0.100 . . . . . . 26 LEU CD2 . 7350 1
358 . 1 1 26 26 LEU CG C 13 25.220 0.100 . . . . . . 26 LEU CG . 7350 1
359 . 1 1 26 26 LEU N N 15 121.559 0.100 . . . . . . 26 LEU N . 7350 1
360 . 1 1 27 27 ASP H H 1 8.277 0.010 . . . . . . 27 ASP H . 7350 1
361 . 1 1 27 27 ASP HA H 1 4.566 0.008 . . . . . . 27 ASP HA . 7350 1
362 . 1 1 27 27 ASP HB2 H 1 2.901 0.001 . . . . . . 27 ASP HB1 . 7350 1
363 . 1 1 27 27 ASP HB3 H 1 2.818 0.015 . . . . . . 27 ASP HB2 . 7350 1
364 . 1 1 27 27 ASP C C 13 173.858 0.100 . . . . . . 27 ASP C . 7350 1
365 . 1 1 27 27 ASP CA C 13 51.007 0.100 . . . . . . 27 ASP CA . 7350 1
366 . 1 1 27 27 ASP CB C 13 39.077 0.100 . . . . . . 27 ASP CB . 7350 1
367 . 1 1 27 27 ASP N N 15 122.310 0.100 . . . . . . 27 ASP N . 7350 1
368 . 1 1 28 28 HIS H H 1 8.822 0.010 . . . . . . 28 HIS H . 7350 1
369 . 1 1 28 28 HIS HA H 1 4.162 0.003 . . . . . . 28 HIS HA . 7350 1
370 . 1 1 28 28 HIS HB2 H 1 3.308 0.015 . . . . . . 28 HIS HB1 . 7350 1
371 . 1 1 28 28 HIS HB3 H 1 3.184 0.015 . . . . . . 28 HIS HB2 . 7350 1
372 . 1 1 28 28 HIS C C 13 174.130 0.100 . . . . . . 28 HIS C . 7350 1
373 . 1 1 28 28 HIS CA C 13 57.469 0.100 . . . . . . 28 HIS CA . 7350 1
374 . 1 1 28 28 HIS CB C 13 26.847 0.100 . . . . . . 28 HIS CB . 7350 1
375 . 1 1 28 28 HIS N N 15 119.587 0.100 . . . . . . 28 HIS N . 7350 1
376 . 1 1 29 29 ASP H H 1 8.540 0.010 . . . . . . 29 ASP H . 7350 1
377 . 1 1 29 29 ASP HA H 1 4.292 0.007 . . . . . . 29 ASP HA . 7350 1
378 . 1 1 29 29 ASP HB2 H 1 2.670 0.015 . . . . . . 29 ASP HB1 . 7350 1
379 . 1 1 29 29 ASP HB3 H 1 2.720 0.015 . . . . . . 29 ASP HB2 . 7350 1
380 . 1 1 29 29 ASP C C 13 176.399 0.100 . . . . . . 29 ASP C . 7350 1
381 . 1 1 29 29 ASP CA C 13 54.711 0.100 . . . . . . 29 ASP CA . 7350 1
382 . 1 1 29 29 ASP CB C 13 37.220 0.100 . . . . . . 29 ASP CB . 7350 1
383 . 1 1 29 29 ASP N N 15 117.385 0.100 . . . . . . 29 ASP N . 7350 1
384 . 1 1 30 30 LYS H H 1 7.919 0.010 . . . . . . 30 LYS H . 7350 1
385 . 1 1 30 30 LYS HA H 1 4.252 0.008 . . . . . . 30 LYS HA . 7350 1
386 . 1 1 30 30 LYS HB2 H 1 2.147 0.015 . . . . . . 30 LYS HB1 . 7350 1
387 . 1 1 30 30 LYS HB3 H 1 1.981 0.015 . . . . . . 30 LYS HB2 . 7350 1
388 . 1 1 30 30 LYS HD2 H 1 1.862 0.010 . . . . . . 30 LYS HD1 . 7350 1
389 . 1 1 30 30 LYS HD3 H 1 1.774 0.015 . . . . . . 30 LYS HD2 . 7350 1
390 . 1 1 30 30 LYS HE2 H 1 3.051 0.015 . . . . . . 30 LYS HE1 . 7350 1
391 . 1 1 30 30 LYS HE3 H 1 3.051 0.015 . . . . . . 30 LYS HE2 . 7350 1
392 . 1 1 30 30 LYS HG2 H 1 1.657 0.003 . . . . . . 30 LYS HG1 . 7350 1
393 . 1 1 30 30 LYS HG3 H 1 1.850 0.008 . . . . . . 30 LYS HG2 . 7350 1
394 . 1 1 30 30 LYS C C 13 175.846 0.100 . . . . . . 30 LYS C . 7350 1
395 . 1 1 30 30 LYS CA C 13 56.226 0.100 . . . . . . 30 LYS CA . 7350 1
396 . 1 1 30 30 LYS CB C 13 30.424 0.100 . . . . . . 30 LYS CB . 7350 1
397 . 1 1 30 30 LYS CD C 13 26.591 0.100 . . . . . . 30 LYS CD . 7350 1
398 . 1 1 30 30 LYS CE C 13 39.624 0.100 . . . . . . 30 LYS CE . 7350 1
399 . 1 1 30 30 LYS CG C 13 23.446 0.100 . . . . . . 30 LYS CG . 7350 1
400 . 1 1 30 30 LYS N N 15 120.197 0.100 . . . . . . 30 LYS N . 7350 1
401 . 1 1 31 31 VAL H H 1 8.236 0.010 . . . . . . 31 VAL H . 7350 1
402 . 1 1 31 31 VAL HA H 1 3.352 0.007 . . . . . . 31 VAL HA . 7350 1
403 . 1 1 31 31 VAL HB H 1 2.158 0.010 . . . . . . 31 VAL HB . 7350 1
404 . 1 1 31 31 VAL HG11 H 1 0.927 0.014 . . . . . . 31 VAL QG1 . 7350 1
405 . 1 1 31 31 VAL HG12 H 1 0.927 0.014 . . . . . . 31 VAL QG1 . 7350 1
406 . 1 1 31 31 VAL HG13 H 1 0.927 0.014 . . . . . . 31 VAL QG1 . 7350 1
407 . 1 1 31 31 VAL HG21 H 1 0.838 0.010 . . . . . . 31 VAL QG2 . 7350 1
408 . 1 1 31 31 VAL HG22 H 1 0.838 0.010 . . . . . . 31 VAL QG2 . 7350 1
409 . 1 1 31 31 VAL HG23 H 1 0.838 0.010 . . . . . . 31 VAL QG2 . 7350 1
410 . 1 1 31 31 VAL C C 13 176.125 0.100 . . . . . . 31 VAL C . 7350 1
411 . 1 1 31 31 VAL CA C 13 64.757 0.100 . . . . . . 31 VAL CA . 7350 1
412 . 1 1 31 31 VAL CB C 13 28.581 0.100 . . . . . . 31 VAL CB . 7350 1
413 . 1 1 31 31 VAL CG1 C 13 21.779 0.100 . . . . . . 31 VAL CG1 . 7350 1
414 . 1 1 31 31 VAL CG2 C 13 18.849 0.100 . . . . . . 31 VAL CG2 . 7350 1
415 . 1 1 31 31 VAL N N 15 121.020 0.100 . . . . . . 31 VAL N . 7350 1
416 . 1 1 32 32 LEU H H 1 7.717 0.010 . . . . . . 32 LEU H . 7350 1
417 . 1 1 32 32 LEU HA H 1 3.940 0.006 . . . . . . 32 LEU HA . 7350 1
418 . 1 1 32 32 LEU HB2 H 1 1.769 0.015 . . . . . . 32 LEU HB1 . 7350 1
419 . 1 1 32 32 LEU HB3 H 1 1.512 0.010 . . . . . . 32 LEU HB2 . 7350 1
420 . 1 1 32 32 LEU HD11 H 1 0.812 0.015 . . . . . . 32 LEU QD1 . 7350 1
421 . 1 1 32 32 LEU HD12 H 1 0.812 0.015 . . . . . . 32 LEU QD1 . 7350 1
422 . 1 1 32 32 LEU HD13 H 1 0.812 0.015 . . . . . . 32 LEU QD1 . 7350 1
423 . 1 1 32 32 LEU HD21 H 1 0.788 0.009 . . . . . . 32 LEU QD2 . 7350 1
424 . 1 1 32 32 LEU HD22 H 1 0.788 0.009 . . . . . . 32 LEU QD2 . 7350 1
425 . 1 1 32 32 LEU HD23 H 1 0.788 0.009 . . . . . . 32 LEU QD2 . 7350 1
426 . 1 1 32 32 LEU HG H 1 1.491 0.015 . . . . . . 32 LEU HG . 7350 1
427 . 1 1 32 32 LEU C C 13 176.979 0.100 . . . . . . 32 LEU C . 7350 1
428 . 1 1 32 32 LEU CA C 13 55.433 0.100 . . . . . . 32 LEU CA . 7350 1
429 . 1 1 32 32 LEU CB C 13 38.631 0.100 . . . . . . 32 LEU CB . 7350 1
430 . 1 1 32 32 LEU CD1 C 13 22.183 0.100 . . . . . . 32 LEU CD1 . 7350 1
431 . 1 1 32 32 LEU CD2 C 13 20.340 0.100 . . . . . . 32 LEU CD2 . 7350 1
432 . 1 1 32 32 LEU CG C 13 24.068 0.100 . . . . . . 32 LEU CG . 7350 1
433 . 1 1 32 32 LEU N N 15 120.652 0.100 . . . . . . 32 LEU N . 7350 1
434 . 1 1 33 33 LEU H H 1 7.522 0.010 . . . . . . 33 LEU H . 7350 1
435 . 1 1 33 33 LEU HA H 1 4.040 0.018 . . . . . . 33 LEU HA . 7350 1
436 . 1 1 33 33 LEU HB2 H 1 1.875 0.014 . . . . . . 33 LEU HB1 . 7350 1
437 . 1 1 33 33 LEU HB3 H 1 1.971 0.007 . . . . . . 33 LEU HB2 . 7350 1
438 . 1 1 33 33 LEU HD11 H 1 1.026 0.010 . . . . . . 33 LEU QD1 . 7350 1
439 . 1 1 33 33 LEU HD12 H 1 1.026 0.010 . . . . . . 33 LEU QD1 . 7350 1
440 . 1 1 33 33 LEU HD13 H 1 1.026 0.010 . . . . . . 33 LEU QD1 . 7350 1
441 . 1 1 33 33 LEU HD21 H 1 0.953 0.015 . . . . . . 33 LEU QD2 . 7350 1
442 . 1 1 33 33 LEU HD22 H 1 0.953 0.015 . . . . . . 33 LEU QD2 . 7350 1
443 . 1 1 33 33 LEU HD23 H 1 0.953 0.015 . . . . . . 33 LEU QD2 . 7350 1
444 . 1 1 33 33 LEU HG H 1 1.930 0.010 . . . . . . 33 LEU HG . 7350 1
445 . 1 1 33 33 LEU C C 13 175.416 0.100 . . . . . . 33 LEU C . 7350 1
446 . 1 1 33 33 LEU CA C 13 55.456 0.100 . . . . . . 33 LEU CA . 7350 1
447 . 1 1 33 33 LEU CB C 13 39.047 0.100 . . . . . . 33 LEU CB . 7350 1
448 . 1 1 33 33 LEU CD1 C 13 22.168 0.100 . . . . . . 33 LEU CD1 . 7350 1
449 . 1 1 33 33 LEU CD2 C 13 20.871 0.100 . . . . . . 33 LEU CD2 . 7350 1
450 . 1 1 33 33 LEU CG C 13 24.036 0.100 . . . . . . 33 LEU CG . 7350 1
451 . 1 1 33 33 LEU N N 15 120.697 0.100 . . . . . . 33 LEU N . 7350 1
452 . 1 1 34 34 PHE H H 1 8.263 0.010 . . . . . . 34 PHE H . 7350 1
453 . 1 1 34 34 PHE HA H 1 3.434 0.009 . . . . . . 34 PHE HA . 7350 1
454 . 1 1 34 34 PHE HB2 H 1 2.613 0.015 . . . . . . 34 PHE HB1 . 7350 1
455 . 1 1 34 34 PHE HB3 H 1 1.847 0.015 . . . . . . 34 PHE HB2 . 7350 1
456 . 1 1 34 34 PHE HD1 H 1 6.700 0.004 . . . . . . 34 PHE QD . 7350 1
457 . 1 1 34 34 PHE HD2 H 1 6.700 0.004 . . . . . . 34 PHE QD . 7350 1
458 . 1 1 34 34 PHE HE1 H 1 6.883 0.006 . . . . . . 34 PHE QE . 7350 1
459 . 1 1 34 34 PHE HE2 H 1 6.883 0.006 . . . . . . 34 PHE QE . 7350 1
460 . 1 1 34 34 PHE HZ H 1 6.786 0.025 . . . . . . 34 PHE HZ . 7350 1
461 . 1 1 34 34 PHE C C 13 173.650 0.100 . . . . . . 34 PHE C . 7350 1
462 . 1 1 34 34 PHE CA C 13 58.060 0.100 . . . . . . 34 PHE CA . 7350 1
463 . 1 1 34 34 PHE CB C 13 35.396 0.100 . . . . . . 34 PHE CB . 7350 1
464 . 1 1 34 34 PHE CD1 C 13 128.814 0.100 . . . . . . 34 PHE CD1 . 7350 1
465 . 1 1 34 34 PHE CD2 C 13 128.814 0.100 . . . . . . 34 PHE CD2 . 7350 1
466 . 1 1 34 34 PHE CE1 C 13 127.331 0.100 . . . . . . 34 PHE CE1 . 7350 1
467 . 1 1 34 34 PHE CE2 C 13 127.331 0.100 . . . . . . 34 PHE CE2 . 7350 1
468 . 1 1 34 34 PHE CZ C 13 125.216 0.100 . . . . . . 34 PHE CZ . 7350 1
469 . 1 1 34 34 PHE N N 15 120.263 0.100 . . . . . . 34 PHE N . 7350 1
470 . 1 1 35 35 SER H H 1 8.306 0.011 . . . . . . 35 SER H . 7350 1
471 . 1 1 35 35 SER HA H 1 3.565 0.003 . . . . . . 35 SER HA . 7350 1
472 . 1 1 35 35 SER HB2 H 1 3.942 0.010 . . . . . . 35 SER HB1 . 7350 1
473 . 1 1 35 35 SER HB3 H 1 3.942 0.011 . . . . . . 35 SER HB2 . 7350 1
474 . 1 1 35 35 SER C C 13 173.163 0.100 . . . . . . 35 SER C . 7350 1
475 . 1 1 35 35 SER CA C 13 59.216 0.100 . . . . . . 35 SER CA . 7350 1
476 . 1 1 35 35 SER CB C 13 60.245 0.100 . . . . . . 35 SER CB . 7350 1
477 . 1 1 35 35 SER N N 15 112.662 0.100 . . . . . . 35 SER N . 7350 1
478 . 1 1 36 36 ARG H H 1 7.835 0.010 . . . . . . 36 ARG H . 7350 1
479 . 1 1 36 36 ARG HA H 1 4.054 0.015 . . . . . . 36 ARG HA . 7350 1
480 . 1 1 36 36 ARG HB2 H 1 1.973 0.004 . . . . . . 36 ARG HB1 . 7350 1
481 . 1 1 36 36 ARG HB3 H 1 1.973 0.004 . . . . . . 36 ARG HB2 . 7350 1
482 . 1 1 36 36 ARG HD2 H 1 3.162 0.005 . . . . . . 36 ARG HD1 . 7350 1
483 . 1 1 36 36 ARG HD3 H 1 3.162 0.005 . . . . . . 36 ARG HD2 . 7350 1
484 . 1 1 36 36 ARG HE H 1 7.143 0.010 . . . . . . 36 ARG HE . 7350 1
485 . 1 1 36 36 ARG HG2 H 1 1.860 0.010 . . . . . . 36 ARG HG1 . 7350 1
486 . 1 1 36 36 ARG HG3 H 1 1.570 0.009 . . . . . . 36 ARG HG2 . 7350 1
487 . 1 1 36 36 ARG C C 13 176.699 0.100 . . . . . . 36 ARG C . 7350 1
488 . 1 1 36 36 ARG CA C 13 56.465 0.100 . . . . . . 36 ARG CA . 7350 1
489 . 1 1 36 36 ARG CB C 13 27.471 0.100 . . . . . . 36 ARG CB . 7350 1
490 . 1 1 36 36 ARG CD C 13 40.950 0.100 . . . . . . 36 ARG CD . 7350 1
491 . 1 1 36 36 ARG CG C 13 24.406 0.100 . . . . . . 36 ARG CG . 7350 1
492 . 1 1 36 36 ARG N N 15 121.162 0.100 . . . . . . 36 ARG N . 7350 1
493 . 1 1 36 36 ARG NE N 15 112.524 0.100 . . . . . . 36 ARG NE . 7350 1
494 . 1 1 37 37 ASP H H 1 8.409 0.010 . . . . . . 37 ASP H . 7350 1
495 . 1 1 37 37 ASP HA H 1 4.406 0.004 . . . . . . 37 ASP HA . 7350 1
496 . 1 1 37 37 ASP HB2 H 1 2.566 0.006 . . . . . . 37 ASP HB1 . 7350 1
497 . 1 1 37 37 ASP HB3 H 1 2.717 0.015 . . . . . . 37 ASP HB2 . 7350 1
498 . 1 1 37 37 ASP C C 13 176.800 0.100 . . . . . . 37 ASP C . 7350 1
499 . 1 1 37 37 ASP CA C 13 54.726 0.100 . . . . . . 37 ASP CA . 7350 1
500 . 1 1 37 37 ASP CB C 13 37.597 0.100 . . . . . . 37 ASP CB . 7350 1
501 . 1 1 37 37 ASP N N 15 122.222 0.100 . . . . . . 37 ASP N . 7350 1
502 . 1 1 38 38 LEU H H 1 8.714 0.010 . . . . . . 38 LEU H . 7350 1
503 . 1 1 38 38 LEU HA H 1 3.795 0.008 . . . . . . 38 LEU HA . 7350 1
504 . 1 1 38 38 LEU HB2 H 1 0.775 0.010 . . . . . . 38 LEU HB1 . 7350 1
505 . 1 1 38 38 LEU HB3 H 1 1.536 0.015 . . . . . . 38 LEU HB2 . 7350 1
506 . 1 1 38 38 LEU HD11 H 1 0.626 0.015 . . . . . . 38 LEU QD1 . 7350 1
507 . 1 1 38 38 LEU HD12 H 1 0.626 0.015 . . . . . . 38 LEU QD1 . 7350 1
508 . 1 1 38 38 LEU HD13 H 1 0.626 0.015 . . . . . . 38 LEU QD1 . 7350 1
509 . 1 1 38 38 LEU HD21 H 1 0.669 0.015 . . . . . . 38 LEU QD2 . 7350 1
510 . 1 1 38 38 LEU HD22 H 1 0.669 0.015 . . . . . . 38 LEU QD2 . 7350 1
511 . 1 1 38 38 LEU HD23 H 1 0.669 0.015 . . . . . . 38 LEU QD2 . 7350 1
512 . 1 1 38 38 LEU HG H 1 1.333 0.010 . . . . . . 38 LEU HG . 7350 1
513 . 1 1 38 38 LEU C C 13 175.239 0.100 . . . . . . 38 LEU C . 7350 1
514 . 1 1 38 38 LEU CA C 13 55.026 0.100 . . . . . . 38 LEU CA . 7350 1
515 . 1 1 38 38 LEU CB C 13 38.413 0.100 . . . . . . 38 LEU CB . 7350 1
516 . 1 1 38 38 LEU CD1 C 13 20.928 0.100 . . . . . . 38 LEU CD1 . 7350 1
517 . 1 1 38 38 LEU CD2 C 13 24.231 0.100 . . . . . . 38 LEU CD2 . 7350 1
518 . 1 1 38 38 LEU CG C 13 24.183 0.100 . . . . . . 38 LEU CG . 7350 1
519 . 1 1 38 38 LEU N N 15 124.500 0.100 . . . . . . 38 LEU N . 7350 1
520 . 1 1 39 39 ASP H H 1 7.931 0.010 . . . . . . 39 ASP H . 7350 1
521 . 1 1 39 39 ASP HA H 1 4.190 0.006 . . . . . . 39 ASP HA . 7350 1
522 . 1 1 39 39 ASP HB2 H 1 2.831 0.010 . . . . . . 39 ASP HB1 . 7350 1
523 . 1 1 39 39 ASP HB3 H 1 2.574 0.010 . . . . . . 39 ASP HB2 . 7350 1
524 . 1 1 39 39 ASP C C 13 176.016 0.100 . . . . . . 39 ASP C . 7350 1
525 . 1 1 39 39 ASP CA C 13 55.136 0.100 . . . . . . 39 ASP CA . 7350 1
526 . 1 1 39 39 ASP CB C 13 38.043 0.100 . . . . . . 39 ASP CB . 7350 1
527 . 1 1 39 39 ASP N N 15 119.422 0.100 . . . . . . 39 ASP N . 7350 1
528 . 1 1 40 40 LYS H H 1 7.845 0.010 . . . . . . 40 LYS H . 7350 1
529 . 1 1 40 40 LYS HA H 1 3.954 0.015 . . . . . . 40 LYS HA . 7350 1
530 . 1 1 40 40 LYS HB2 H 1 1.925 0.010 . . . . . . 40 LYS HB1 . 7350 1
531 . 1 1 40 40 LYS HB3 H 1 1.899 0.010 . . . . . . 40 LYS HB2 . 7350 1
532 . 1 1 40 40 LYS HD2 H 1 1.711 0.010 . . . . . . 40 LYS HD1 . 7350 1
533 . 1 1 40 40 LYS HD3 H 1 1.711 0.010 . . . . . . 40 LYS HD2 . 7350 1
534 . 1 1 40 40 LYS HE2 H 1 2.953 0.010 . . . . . . 40 LYS HE1 . 7350 1
535 . 1 1 40 40 LYS HE3 H 1 2.953 0.010 . . . . . . 40 LYS HE2 . 7350 1
536 . 1 1 40 40 LYS HG2 H 1 1.654 0.010 . . . . . . 40 LYS HG1 . 7350 1
537 . 1 1 40 40 LYS HG3 H 1 1.457 0.010 . . . . . . 40 LYS HG2 . 7350 1
538 . 1 1 40 40 LYS C C 13 176.327 0.100 . . . . . . 40 LYS C . 7350 1
539 . 1 1 40 40 LYS CA C 13 57.018 0.100 . . . . . . 40 LYS CA . 7350 1
540 . 1 1 40 40 LYS CB C 13 30.020 0.100 . . . . . . 40 LYS CB . 7350 1
541 . 1 1 40 40 LYS CD C 13 26.867 0.100 . . . . . . 40 LYS CD . 7350 1
542 . 1 1 40 40 LYS CE C 13 39.395 0.100 . . . . . . 40 LYS CE . 7350 1
543 . 1 1 40 40 LYS CG C 13 22.665 0.100 . . . . . . 40 LYS CG . 7350 1
544 . 1 1 40 40 LYS N N 15 118.255 0.100 . . . . . . 40 LYS N . 7350 1
545 . 1 1 41 41 LEU H H 1 7.890 0.010 . . . . . . 41 LEU H . 7350 1
546 . 1 1 41 41 LEU HA H 1 4.318 0.006 . . . . . . 41 LEU HA . 7350 1
547 . 1 1 41 41 LEU HB2 H 1 2.060 0.010 . . . . . . 41 LEU HB1 . 7350 1
548 . 1 1 41 41 LEU HB3 H 1 1.769 0.010 . . . . . . 41 LEU HB2 . 7350 1
549 . 1 1 41 41 LEU HD11 H 1 0.726 0.010 . . . . . . 41 LEU QD1 . 7350 1
550 . 1 1 41 41 LEU HD12 H 1 0.726 0.010 . . . . . . 41 LEU QD1 . 7350 1
551 . 1 1 41 41 LEU HD13 H 1 0.726 0.010 . . . . . . 41 LEU QD1 . 7350 1
552 . 1 1 41 41 LEU HD21 H 1 1.233 0.015 . . . . . . 41 LEU QD2 . 7350 1
553 . 1 1 41 41 LEU HD22 H 1 1.233 0.015 . . . . . . 41 LEU QD2 . 7350 1
554 . 1 1 41 41 LEU HD23 H 1 1.233 0.015 . . . . . . 41 LEU QD2 . 7350 1
555 . 1 1 41 41 LEU HG H 1 1.839 0.010 . . . . . . 41 LEU HG . 7350 1
556 . 1 1 41 41 LEU C C 13 175.717 0.100 . . . . . . 41 LEU C . 7350 1
557 . 1 1 41 41 LEU CA C 13 55.570 0.100 . . . . . . 41 LEU CA . 7350 1
558 . 1 1 41 41 LEU CB C 13 39.544 0.100 . . . . . . 41 LEU CB . 7350 1
559 . 1 1 41 41 LEU CD1 C 13 23.255 0.100 . . . . . . 41 LEU CD1 . 7350 1
560 . 1 1 41 41 LEU CD2 C 13 22.547 0.100 . . . . . . 41 LEU CD2 . 7350 1
561 . 1 1 41 41 LEU CG C 13 24.903 0.100 . . . . . . 41 LEU CG . 7350 1
562 . 1 1 41 41 LEU N N 15 121.537 0.100 . . . . . . 41 LEU N . 7350 1
563 . 1 1 42 42 ILE H H 1 8.361 0.010 . . . . . . 42 ILE H . 7350 1
564 . 1 1 42 42 ILE HA H 1 3.576 0.002 . . . . . . 42 ILE HA . 7350 1
565 . 1 1 42 42 ILE HB H 1 1.929 0.015 . . . . . . 42 ILE HB . 7350 1
566 . 1 1 42 42 ILE HD11 H 1 0.831 0.003 . . . . . . 42 ILE QD1 . 7350 1
567 . 1 1 42 42 ILE HD12 H 1 0.831 0.003 . . . . . . 42 ILE QD1 . 7350 1
568 . 1 1 42 42 ILE HD13 H 1 0.831 0.003 . . . . . . 42 ILE QD1 . 7350 1
569 . 1 1 42 42 ILE HG12 H 1 1.069 0.010 . . . . . . 42 ILE HG11 . 7350 1
570 . 1 1 42 42 ILE HG13 H 1 1.907 0.010 . . . . . . 42 ILE HG12 . 7350 1
571 . 1 1 42 42 ILE HG21 H 1 0.786 0.015 . . . . . . 42 ILE QG2 . 7350 1
572 . 1 1 42 42 ILE HG22 H 1 0.786 0.015 . . . . . . 42 ILE QG2 . 7350 1
573 . 1 1 42 42 ILE HG23 H 1 0.786 0.015 . . . . . . 42 ILE QG2 . 7350 1
574 . 1 1 42 42 ILE C C 13 175.549 0.100 . . . . . . 42 ILE C . 7350 1
575 . 1 1 42 42 ILE CA C 13 63.399 0.100 . . . . . . 42 ILE CA . 7350 1
576 . 1 1 42 42 ILE CB C 13 35.192 0.100 . . . . . . 42 ILE CB . 7350 1
577 . 1 1 42 42 ILE CD1 C 13 11.497 0.100 . . . . . . 42 ILE CD1 . 7350 1
578 . 1 1 42 42 ILE CG1 C 13 27.616 0.100 . . . . . . 42 ILE CG1 . 7350 1
579 . 1 1 42 42 ILE CG2 C 13 15.241 0.100 . . . . . . 42 ILE CG2 . 7350 1
580 . 1 1 42 42 ILE N N 15 117.746 0.100 . . . . . . 42 ILE N . 7350 1
581 . 1 1 43 43 ASN H H 1 8.336 0.010 . . . . . . 43 ASN H . 7350 1
582 . 1 1 43 43 ASN HA H 1 4.267 0.007 . . . . . . 43 ASN HA . 7350 1
583 . 1 1 43 43 ASN HB2 H 1 2.822 0.010 . . . . . . 43 ASN HB1 . 7350 1
584 . 1 1 43 43 ASN HB3 H 1 2.722 0.010 . . . . . . 43 ASN HB2 . 7350 1
585 . 1 1 43 43 ASN HD21 H 1 7.413 0.010 . . . . . . 43 ASN HD21 . 7350 1
586 . 1 1 43 43 ASN HD22 H 1 6.813 0.010 . . . . . . 43 ASN HD22 . 7350 1
587 . 1 1 43 43 ASN C C 13 174.822 0.100 . . . . . . 43 ASN C . 7350 1
588 . 1 1 43 43 ASN CA C 13 53.620 0.100 . . . . . . 43 ASN CA . 7350 1
589 . 1 1 43 43 ASN CB C 13 35.375 0.100 . . . . . . 43 ASN CB . 7350 1
590 . 1 1 43 43 ASN N N 15 117.030 0.100 . . . . . . 43 ASN N . 7350 1
591 . 1 1 43 43 ASN ND2 N 15 112.151 0.100 . . . . . . 43 ASN ND2 . 7350 1
592 . 1 1 44 44 LYS H H 1 7.912 0.011 . . . . . . 44 LYS H . 7350 1
593 . 1 1 44 44 LYS HA H 1 3.937 0.003 . . . . . . 44 LYS HA . 7350 1
594 . 1 1 44 44 LYS HB2 H 1 2.018 0.010 . . . . . . 44 LYS HB1 . 7350 1
595 . 1 1 44 44 LYS HB3 H 1 1.924 0.010 . . . . . . 44 LYS HB2 . 7350 1
596 . 1 1 44 44 LYS HD2 H 1 1.580 0.010 . . . . . . 44 LYS HD1 . 7350 1
597 . 1 1 44 44 LYS HD3 H 1 1.523 0.010 . . . . . . 44 LYS HD2 . 7350 1
598 . 1 1 44 44 LYS HE2 H 1 2.709 0.008 . . . . . . 44 LYS HE1 . 7350 1
599 . 1 1 44 44 LYS HE3 H 1 2.709 0.008 . . . . . . 44 LYS HE2 . 7350 1
600 . 1 1 44 44 LYS HG2 H 1 0.757 0.015 . . . . . . 44 LYS HG1 . 7350 1
601 . 1 1 44 44 LYS HG3 H 1 1.226 0.010 . . . . . . 44 LYS HG2 . 7350 1
602 . 1 1 44 44 LYS C C 13 175.649 0.100 . . . . . . 44 LYS C . 7350 1
603 . 1 1 44 44 LYS CA C 13 56.487 0.100 . . . . . . 44 LYS CA . 7350 1
604 . 1 1 44 44 LYS CB C 13 29.495 0.100 . . . . . . 44 LYS CB . 7350 1
605 . 1 1 44 44 LYS CD C 13 26.944 0.100 . . . . . . 44 LYS CD . 7350 1
606 . 1 1 44 44 LYS CE C 13 39.414 0.100 . . . . . . 44 LYS CE . 7350 1
607 . 1 1 44 44 LYS CG C 13 21.869 0.100 . . . . . . 44 LYS CG . 7350 1
608 . 1 1 44 44 LYS N N 15 119.779 0.100 . . . . . . 44 LYS N . 7350 1
609 . 1 1 45 45 PHE H H 1 7.473 0.010 . . . . . . 45 PHE H . 7350 1
610 . 1 1 45 45 PHE HA H 1 4.219 0.008 . . . . . . 45 PHE HA . 7350 1
611 . 1 1 45 45 PHE HB2 H 1 2.844 0.015 . . . . . . 45 PHE HB1 . 7350 1
612 . 1 1 45 45 PHE HB3 H 1 2.518 0.015 . . . . . . 45 PHE HB2 . 7350 1
613 . 1 1 45 45 PHE HD1 H 1 7.511 0.008 . . . . . . 45 PHE QD . 7350 1
614 . 1 1 45 45 PHE HD2 H 1 7.511 0.008 . . . . . . 45 PHE QD . 7350 1
615 . 1 1 45 45 PHE HE1 H 1 7.281 0.001 . . . . . . 45 PHE QE . 7350 1
616 . 1 1 45 45 PHE HE2 H 1 7.281 0.001 . . . . . . 45 PHE QE . 7350 1
617 . 1 1 45 45 PHE HZ H 1 7.537 0.015 . . . . . . 45 PHE HZ . 7350 1
618 . 1 1 45 45 PHE C C 13 173.523 0.100 . . . . . . 45 PHE C . 7350 1
619 . 1 1 45 45 PHE CA C 13 58.213 0.100 . . . . . . 45 PHE CA . 7350 1
620 . 1 1 45 45 PHE CB C 13 37.021 0.100 . . . . . . 45 PHE CB . 7350 1
621 . 1 1 45 45 PHE CD1 C 13 129.226 0.100 . . . . . . 45 PHE CD1 . 7350 1
622 . 1 1 45 45 PHE CD2 C 13 129.226 0.100 . . . . . . 45 PHE CD2 . 7350 1
623 . 1 1 45 45 PHE CE1 C 13 127.353 0.100 . . . . . . 45 PHE CE1 . 7350 1
624 . 1 1 45 45 PHE CE2 C 13 127.353 0.100 . . . . . . 45 PHE CE2 . 7350 1
625 . 1 1 45 45 PHE CZ C 13 126.806 0.100 . . . . . . 45 PHE CZ . 7350 1
626 . 1 1 45 45 PHE N N 15 115.208 0.100 . . . . . . 45 PHE N . 7350 1
627 . 1 1 46 46 MET H H 1 8.092 0.010 . . . . . . 46 MET H . 7350 1
628 . 1 1 46 46 MET HA H 1 4.332 0.002 . . . . . . 46 MET HA . 7350 1
629 . 1 1 46 46 MET HB2 H 1 1.889 0.010 . . . . . . 46 MET HB1 . 7350 1
630 . 1 1 46 46 MET HB3 H 1 1.889 0.010 . . . . . . 46 MET HB2 . 7350 1
631 . 1 1 46 46 MET HE1 H 1 1.571 0.008 . . . . . . 46 MET QE . 7350 1
632 . 1 1 46 46 MET HE2 H 1 1.571 0.008 . . . . . . 46 MET QE . 7350 1
633 . 1 1 46 46 MET HE3 H 1 1.571 0.008 . . . . . . 46 MET QE . 7350 1
634 . 1 1 46 46 MET HG2 H 1 2.445 0.010 . . . . . . 46 MET HG1 . 7350 1
635 . 1 1 46 46 MET HG3 H 1 2.167 0.009 . . . . . . 46 MET HG2 . 7350 1
636 . 1 1 46 46 MET C C 13 173.398 0.100 . . . . . . 46 MET C . 7350 1
637 . 1 1 46 46 MET CA C 13 53.247 0.100 . . . . . . 46 MET CA . 7350 1
638 . 1 1 46 46 MET CB C 13 30.220 0.100 . . . . . . 46 MET CB . 7350 1
639 . 1 1 46 46 MET CE C 13 13.920 0.100 . . . . . . 46 MET CE . 7350 1
640 . 1 1 46 46 MET CG C 13 29.793 0.100 . . . . . . 46 MET CG . 7350 1
641 . 1 1 46 46 MET N N 15 116.651 0.100 . . . . . . 46 MET N . 7350 1
642 . 1 1 47 47 ASN H H 1 7.780 0.010 . . . . . . 47 ASN H . 7350 1
643 . 1 1 47 47 ASN HA H 1 4.708 0.010 . . . . . . 47 ASN HA . 7350 1
644 . 1 1 47 47 ASN HB2 H 1 2.693 0.002 . . . . . . 47 ASN HB1 . 7350 1
645 . 1 1 47 47 ASN HB3 H 1 2.866 0.015 . . . . . . 47 ASN HB2 . 7350 1
646 . 1 1 47 47 ASN HD21 H 1 7.515 0.010 . . . . . . 47 ASN HD21 . 7350 1
647 . 1 1 47 47 ASN HD22 H 1 6.785 0.010 . . . . . . 47 ASN HD22 . 7350 1
648 . 1 1 47 47 ASN C C 13 172.370 0.100 . . . . . . 47 ASN C . 7350 1
649 . 1 1 47 47 ASN CA C 13 50.699 0.100 . . . . . . 47 ASN CA . 7350 1
650 . 1 1 47 47 ASN CB C 13 35.877 0.100 . . . . . . 47 ASN CB . 7350 1
651 . 1 1 47 47 ASN N N 15 117.874 0.100 . . . . . . 47 ASN N . 7350 1
652 . 1 1 47 47 ASN ND2 N 15 112.529 0.100 . . . . . . 47 ASN ND2 . 7350 1
653 . 1 1 48 48 VAL H H 1 7.813 0.010 . . . . . . 48 VAL H . 7350 1
654 . 1 1 48 48 VAL HA H 1 4.025 0.002 . . . . . . 48 VAL HA . 7350 1
655 . 1 1 48 48 VAL HB H 1 2.057 0.010 . . . . . . 48 VAL HB . 7350 1
656 . 1 1 48 48 VAL HG11 H 1 0.882 0.010 . . . . . . 48 VAL QG1 . 7350 1
657 . 1 1 48 48 VAL HG12 H 1 0.882 0.010 . . . . . . 48 VAL QG1 . 7350 1
658 . 1 1 48 48 VAL HG13 H 1 0.882 0.010 . . . . . . 48 VAL QG1 . 7350 1
659 . 1 1 48 48 VAL HG21 H 1 0.885 0.010 . . . . . . 48 VAL QG2 . 7350 1
660 . 1 1 48 48 VAL HG22 H 1 0.885 0.010 . . . . . . 48 VAL QG2 . 7350 1
661 . 1 1 48 48 VAL HG23 H 1 0.885 0.010 . . . . . . 48 VAL QG2 . 7350 1
662 . 1 1 48 48 VAL C C 13 173.532 0.100 . . . . . . 48 VAL C . 7350 1
663 . 1 1 48 48 VAL CA C 13 59.912 0.100 . . . . . . 48 VAL CA . 7350 1
664 . 1 1 48 48 VAL CB C 13 29.855 0.100 . . . . . . 48 VAL CB . 7350 1
665 . 1 1 48 48 VAL CG1 C 13 18.652 0.100 . . . . . . 48 VAL CG1 . 7350 1
666 . 1 1 48 48 VAL CG2 C 13 18.151 0.100 . . . . . . 48 VAL CG2 . 7350 1
667 . 1 1 48 48 VAL N N 15 119.708 0.100 . . . . . . 48 VAL N . 7350 1
668 . 1 1 49 49 LYS H H 1 8.292 0.010 . . . . . . 49 LYS H . 7350 1
669 . 1 1 49 49 LYS HA H 1 4.276 0.002 . . . . . . 49 LYS HA . 7350 1
670 . 1 1 49 49 LYS HB2 H 1 1.722 0.010 . . . . . . 49 LYS HB1 . 7350 1
671 . 1 1 49 49 LYS HB3 H 1 1.797 0.010 . . . . . . 49 LYS HB2 . 7350 1
672 . 1 1 49 49 LYS HD2 H 1 1.631 0.010 . . . . . . 49 LYS HD1 . 7350 1
673 . 1 1 49 49 LYS HD3 H 1 1.631 0.010 . . . . . . 49 LYS HD2 . 7350 1
674 . 1 1 49 49 LYS HE2 H 1 2.954 0.010 . . . . . . 49 LYS HE1 . 7350 1
675 . 1 1 49 49 LYS HE3 H 1 2.954 0.010 . . . . . . 49 LYS HE2 . 7350 1
676 . 1 1 49 49 LYS HG2 H 1 1.411 0.015 . . . . . . 49 LYS HG1 . 7350 1
677 . 1 1 49 49 LYS HG3 H 1 1.375 0.010 . . . . . . 49 LYS HG2 . 7350 1
678 . 1 1 49 49 LYS C C 13 173.558 0.100 . . . . . . 49 LYS C . 7350 1
679 . 1 1 49 49 LYS CA C 13 53.631 0.100 . . . . . . 49 LYS CA . 7350 1
680 . 1 1 49 49 LYS CB C 13 30.358 0.100 . . . . . . 49 LYS CB . 7350 1
681 . 1 1 49 49 LYS CD C 13 26.381 0.100 . . . . . . 49 LYS CD . 7350 1
682 . 1 1 49 49 LYS CE C 13 39.442 0.100 . . . . . . 49 LYS CE . 7350 1
683 . 1 1 49 49 LYS CG C 13 22.017 0.100 . . . . . . 49 LYS CG . 7350 1
684 . 1 1 49 49 LYS N N 15 124.657 0.100 . . . . . . 49 LYS N . 7350 1
685 . 1 1 50 50 ASP H H 1 8.189 0.010 . . . . . . 50 ASP H . 7350 1
686 . 1 1 50 50 ASP HA H 1 4.524 0.015 . . . . . . 50 ASP HA . 7350 1
687 . 1 1 50 50 ASP HB2 H 1 2.562 0.004 . . . . . . 50 ASP HB1 . 7350 1
688 . 1 1 50 50 ASP HB3 H 1 2.641 0.001 . . . . . . 50 ASP HB2 . 7350 1
689 . 1 1 50 50 ASP C C 13 173.459 0.100 . . . . . . 50 ASP C . 7350 1
690 . 1 1 50 50 ASP CA C 13 51.871 0.100 . . . . . . 50 ASP CA . 7350 1
691 . 1 1 50 50 ASP CB C 13 38.662 0.100 . . . . . . 50 ASP CB . 7350 1
692 . 1 1 50 50 ASP N N 15 121.415 0.100 . . . . . . 50 ASP N . 7350 1
693 . 1 1 51 51 LYS H H 1 8.183 0.010 . . . . . . 51 LYS H . 7350 1
694 . 1 1 51 51 LYS HA H 1 4.233 0.005 . . . . . . 51 LYS HA . 7350 1
695 . 1 1 51 51 LYS HB2 H 1 1.698 0.010 . . . . . . 51 LYS HB1 . 7350 1
696 . 1 1 51 51 LYS HB3 H 1 1.756 0.015 . . . . . . 51 LYS HB2 . 7350 1
697 . 1 1 51 51 LYS HD2 H 1 1.636 0.010 . . . . . . 51 LYS HD1 . 7350 1
698 . 1 1 51 51 LYS HD3 H 1 1.636 0.010 . . . . . . 51 LYS HD2 . 7350 1
699 . 1 1 51 51 LYS HE2 H 1 2.952 0.010 . . . . . . 51 LYS HE1 . 7350 1
700 . 1 1 51 51 LYS HE3 H 1 2.952 0.010 . . . . . . 51 LYS HE2 . 7350 1
701 . 1 1 51 51 LYS HG2 H 1 1.329 0.010 . . . . . . 51 LYS HG1 . 7350 1
702 . 1 1 51 51 LYS HG3 H 1 1.367 0.010 . . . . . . 51 LYS HG2 . 7350 1
703 . 1 1 51 51 LYS C C 13 173.829 0.100 . . . . . . 51 LYS C . 7350 1
704 . 1 1 51 51 LYS CA C 13 53.701 0.100 . . . . . . 51 LYS CA . 7350 1
705 . 1 1 51 51 LYS CB C 13 30.361 0.100 . . . . . . 51 LYS CB . 7350 1
706 . 1 1 51 51 LYS CD C 13 26.424 0.100 . . . . . . 51 LYS CD . 7350 1
707 . 1 1 51 51 LYS CE C 13 39.438 0.100 . . . . . . 51 LYS CE . 7350 1
708 . 1 1 51 51 LYS CG C 13 22.043 0.100 . . . . . . 51 LYS CG . 7350 1
709 . 1 1 51 51 LYS N N 15 121.377 0.100 . . . . . . 51 LYS N . 7350 1
710 . 1 1 52 52 VAL H H 1 8.016 0.010 . . . . . . 52 VAL H . 7350 1
711 . 1 1 52 52 VAL HA H 1 3.960 0.004 . . . . . . 52 VAL HA . 7350 1
712 . 1 1 52 52 VAL HB H 1 1.967 0.010 . . . . . . 52 VAL HB . 7350 1
713 . 1 1 52 52 VAL HG11 H 1 0.849 0.015 . . . . . . 52 VAL QG1 . 7350 1
714 . 1 1 52 52 VAL HG12 H 1 0.849 0.015 . . . . . . 52 VAL QG1 . 7350 1
715 . 1 1 52 52 VAL HG13 H 1 0.849 0.015 . . . . . . 52 VAL QG1 . 7350 1
716 . 1 1 52 52 VAL HG21 H 1 0.794 0.015 . . . . . . 52 VAL QG2 . 7350 1
717 . 1 1 52 52 VAL HG22 H 1 0.794 0.015 . . . . . . 52 VAL QG2 . 7350 1
718 . 1 1 52 52 VAL HG23 H 1 0.794 0.015 . . . . . . 52 VAL QG2 . 7350 1
719 . 1 1 52 52 VAL C C 13 173.358 0.100 . . . . . . 52 VAL C . 7350 1
720 . 1 1 52 52 VAL CA C 13 59.907 0.100 . . . . . . 52 VAL CA . 7350 1
721 . 1 1 52 52 VAL CB C 13 29.929 0.100 . . . . . . 52 VAL CB . 7350 1
722 . 1 1 52 52 VAL CG1 C 13 18.107 0.100 . . . . . . 52 VAL CG1 . 7350 1
723 . 1 1 52 52 VAL CG2 C 13 18.362 0.100 . . . . . . 52 VAL CG2 . 7350 1
724 . 1 1 52 52 VAL N N 15 120.641 0.100 . . . . . . 52 VAL N . 7350 1
725 . 1 1 53 53 HIS H H 1 8.411 0.010 . . . . . . 53 HIS H . 7350 1
726 . 1 1 53 53 HIS HA H 1 4.618 0.015 . . . . . . 53 HIS HA . 7350 1
727 . 1 1 53 53 HIS HB2 H 1 3.143 0.010 . . . . . . 53 HIS HB1 . 7350 1
728 . 1 1 53 53 HIS HB3 H 1 3.056 0.010 . . . . . . 53 HIS HB2 . 7350 1
729 . 1 1 53 53 HIS C C 13 172.089 0.100 . . . . . . 53 HIS C . 7350 1
730 . 1 1 53 53 HIS CA C 13 53.096 0.100 . . . . . . 53 HIS CA . 7350 1
731 . 1 1 53 53 HIS CB C 13 27.271 0.100 . . . . . . 53 HIS CB . 7350 1
732 . 1 1 53 53 HIS N N 15 123.109 0.100 . . . . . . 53 HIS N . 7350 1
733 . 1 1 54 54 LYS H H 1 8.280 0.010 . . . . . . 54 LYS H . 7350 1
734 . 1 1 54 54 LYS HA H 1 4.223 0.015 . . . . . . 54 LYS HA . 7350 1
735 . 1 1 54 54 LYS HB2 H 1 1.752 0.010 . . . . . . 54 LYS HB1 . 7350 1
736 . 1 1 54 54 LYS HB3 H 1 1.632 0.010 . . . . . . 54 LYS HB2 . 7350 1
737 . 1 1 54 54 LYS HD2 H 1 1.685 0.010 . . . . . . 54 LYS HD1 . 7350 1
738 . 1 1 54 54 LYS HD3 H 1 1.685 0.010 . . . . . . 54 LYS HD2 . 7350 1
739 . 1 1 54 54 LYS HE2 H 1 2.941 0.010 . . . . . . 54 LYS HE1 . 7350 1
740 . 1 1 54 54 LYS HE3 H 1 2.941 0.010 . . . . . . 54 LYS HE2 . 7350 1
741 . 1 1 54 54 LYS HG2 H 1 1.365 0.010 . . . . . . 54 LYS HG1 . 7350 1
742 . 1 1 54 54 LYS HG3 H 1 1.316 0.010 . . . . . . 54 LYS HG2 . 7350 1
743 . 1 1 54 54 LYS C C 13 173.477 0.100 . . . . . . 54 LYS C . 7350 1
744 . 1 1 54 54 LYS CA C 13 53.736 0.100 . . . . . . 54 LYS CA . 7350 1
745 . 1 1 54 54 LYS CB C 13 30.462 0.100 . . . . . . 54 LYS CB . 7350 1
746 . 1 1 54 54 LYS CD C 13 26.416 0.100 . . . . . . 54 LYS CD . 7350 1
747 . 1 1 54 54 LYS CE C 13 39.441 0.100 . . . . . . 54 LYS CE . 7350 1
748 . 1 1 54 54 LYS CG C 13 22.045 0.100 . . . . . . 54 LYS CG . 7350 1
749 . 1 1 54 54 LYS N N 15 123.277 0.100 . . . . . . 54 LYS N . 7350 1
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