Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30505
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 $chem_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' . . . 30505 1
2 '3D HNCO' . . . 30505 1
3 '3D HNCACB' . . . 30505 1
4 '3D HN(CA)CO' . . . 30505 1
5 '3D CBCA(CO)NH' . . . 30505 1
6 '3D HCCH-TOCSY' . . . 30505 1
7 '3D HCCH-COSY' . . . 30505 1
8 '2D 1H-13C HSQC' . . . 30505 1
9 '3D 1H-13C NOESY' . . . 30505 1
10 '3D 1H-15N NOESY' . . . 30505 1
11 '2D 1H-15N HSQC' . . . 30505 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 GLY HA3 H 1 3.877 . . 1 . . 605 . A 1 GLY HA3 . 30505 1
2 . 1 1 1 1 GLY CA C 13 43.540 . . 1 . . 606 . A 1 GLY CA . 30505 1
3 . 1 1 2 2 SER HA H 1 4.495 0.004 . 1 . . 607 . A 2 SER HA . 30505 1
4 . 1 1 2 2 SER HB2 H 1 3.824 0.003 . 1 . . 608 . A 2 SER HB2 . 30505 1
5 . 1 1 2 2 SER C C 13 174.367 . . 1 . . 410 . A 2 SER C . 30505 1
6 . 1 1 2 2 SER CA C 13 58.310 0.021 . 1 . . 407 . A 2 SER CA . 30505 1
7 . 1 1 2 2 SER CB C 13 64.246 0.056 . 1 . . 408 . A 2 SER CB . 30505 1
8 . 1 1 3 3 GLY H H 1 8.409 0.007 . 1 . . 72 . A 3 GLY H . 30505 1
9 . 1 1 3 3 GLY HA2 H 1 3.877 0.006 . 2 . . 550 . A 3 GLY HA2 . 30505 1
10 . 1 1 3 3 GLY HA3 H 1 4.082 0.003 . 2 . . 551 . A 3 GLY HA3 . 30505 1
11 . 1 1 3 3 GLY C C 13 173.789 0.023 . 1 . . 409 . A 3 GLY C . 30505 1
12 . 1 1 3 3 GLY CA C 13 45.148 0.03 . 1 . . 406 . A 3 GLY CA . 30505 1
13 . 1 1 3 3 GLY N N 15 110.345 0.039 . 1 . . 73 . A 3 GLY N . 30505 1
14 . 1 1 4 4 TRP H H 1 8.151 0.003 . 1 . . 55 . A 4 TRP H . 30505 1
15 . 1 1 4 4 TRP HA H 1 4.751 0.002 . 1 . . 654 . A 4 TRP HA . 30505 1
16 . 1 1 4 4 TRP HB2 H 1 3.069 0.005 . 2 . . 652 . A 4 TRP HB2 . 30505 1
17 . 1 1 4 4 TRP HB3 H 1 3.193 0.004 . 2 . . 653 . A 4 TRP HB3 . 30505 1
18 . 1 1 4 4 TRP HD1 H 1 7.280 0.002 . 1 . . 887 . A 4 TRP HD1 . 30505 1
19 . 1 1 4 4 TRP HE1 H 1 10.521 0.003 . 1 . . 27 . A 4 TRP HE1 . 30505 1
20 . 1 1 4 4 TRP HE3 H 1 7.677 0.003 . 1 . . 888 . A 4 TRP HE3 . 30505 1
21 . 1 1 4 4 TRP HZ2 H 1 7.421 0.005 . 1 . . 895 . A 4 TRP HZ2 . 30505 1
22 . 1 1 4 4 TRP HZ3 H 1 6.913 0.0 . 1 . . 891 . A 4 TRP HZ3 . 30505 1
23 . 1 1 4 4 TRP HH2 H 1 7.118 0.004 . 1 . . 893 . A 4 TRP HH2 . 30505 1
24 . 1 1 4 4 TRP C C 13 176.439 0.03 . 1 . . 411 . A 4 TRP C . 30505 1
25 . 1 1 4 4 TRP CA C 13 57.634 0.023 . 1 . . 405 . A 4 TRP CA . 30505 1
26 . 1 1 4 4 TRP CB C 13 31.912 0.04 . 1 . . 404 . A 4 TRP CB . 30505 1
27 . 1 1 4 4 TRP CD1 C 13 127.521 . . 1 . . 889 . A 4 TRP CD1 . 30505 1
28 . 1 1 4 4 TRP CE3 C 13 121.177 . . 1 . . 890 . A 4 TRP CE3 . 30505 1
29 . 1 1 4 4 TRP CZ2 C 13 114.838 . . 1 . . 896 . A 4 TRP CZ2 . 30505 1
30 . 1 1 4 4 TRP CZ3 C 13 121.647 . . 1 . . 892 . A 4 TRP CZ3 . 30505 1
31 . 1 1 4 4 TRP CH2 C 13 123.765 . . 1 . . 894 . A 4 TRP CH2 . 30505 1
32 . 1 1 4 4 TRP N N 15 120.683 0.023 . 1 . . 56 . A 4 TRP N . 30505 1
33 . 1 1 4 4 TRP NE1 N 15 129.626 0.059 . 1 . . 28 . A 4 TRP NE1 . 30505 1
34 . 1 1 5 5 GLU H H 1 8.653 0.007 . 1 . . 29 . A 5 GLU H . 30505 1
35 . 1 1 5 5 GLU HA H 1 4.492 0.004 . 1 . . 902 . A 5 GLU HA . 30505 1
36 . 1 1 5 5 GLU HB2 H 1 1.776 0.004 . 1 . . 903 . A 5 GLU HB2 . 30505 1
37 . 1 1 5 5 GLU HG2 H 1 2.167 0.003 . 1 . . 904 . A 5 GLU HG2 . 30505 1
38 . 1 1 5 5 GLU C C 13 175.479 . . 1 . . 413 . A 5 GLU C . 30505 1
39 . 1 1 5 5 GLU CA C 13 55.509 0.105 . 1 . . 412 . A 5 GLU CA . 30505 1
40 . 1 1 5 5 GLU CB C 13 31.691 0.067 . 1 . . 901 . A 5 GLU CB . 30505 1
41 . 1 1 5 5 GLU CG C 13 36.241 0.028 . 1 . . 905 . A 5 GLU CG . 30505 1
42 . 1 1 5 5 GLU N N 15 120.759 0.052 . 1 . . 30 . A 5 GLU N . 30505 1
43 . 1 1 7 7 LYS HA H 1 4.390 0.003 . 1 . . 867 . A 7 LYS HA . 30505 1
44 . 1 1 7 7 LYS HB2 H 1 1.825 0.008 . 1 . . 869 . A 7 LYS HB2 . 30505 1
45 . 1 1 7 7 LYS HG2 H 1 1.403 0.005 . 1 . . 871 . A 7 LYS HG2 . 30505 1
46 . 1 1 7 7 LYS HD2 H 1 1.638 0.006 . 1 . . 870 . A 7 LYS HD2 . 30505 1
47 . 1 1 7 7 LYS HE2 H 1 2.910 0.012 . 2 . . 868 . A 7 LYS HE2 . 30505 1
48 . 1 1 7 7 LYS HE3 H 1 2.871 0.008 . 2 . . 872 . A 7 LYS HE3 . 30505 1
49 . 1 1 7 7 LYS C C 13 177.384 . . 1 . . 201 . A 7 LYS C . 30505 1
50 . 1 1 7 7 LYS CA C 13 57.674 0.041 . 1 . . 202 . A 7 LYS CA . 30505 1
51 . 1 1 7 7 LYS CB C 13 32.764 0.053 . 1 . . 203 . A 7 LYS CB . 30505 1
52 . 1 1 7 7 LYS CG C 13 24.796 0.02 . 1 . . 865 . A 7 LYS CG . 30505 1
53 . 1 1 7 7 LYS CD C 13 29.305 0.04 . 1 . . 866 . A 7 LYS CD . 30505 1
54 . 1 1 7 7 LYS CE C 13 41.997 0.019 . 1 . . 864 . A 7 LYS CE . 30505 1
55 . 1 1 8 8 THR H H 1 7.949 0.01 . 1 . . 66 . A 8 THR H . 30505 1
56 . 1 1 8 8 THR HA H 1 4.321 0.011 . 1 . . 618 . A 8 THR HA . 30505 1
57 . 1 1 8 8 THR HB H 1 4.302 0.005 . 1 . . 619 . A 8 THR HB . 30505 1
58 . 1 1 8 8 THR HG21 H 1 1.140 0.003 . 1 . . 617 . A 8 THR HG21 . 30505 1
59 . 1 1 8 8 THR HG22 H 1 1.140 0.003 . 1 . . 617 . A 8 THR HG22 . 30505 1
60 . 1 1 8 8 THR HG23 H 1 1.140 0.003 . 1 . . 617 . A 8 THR HG23 . 30505 1
61 . 1 1 8 8 THR C C 13 175.378 0.032 . 1 . . 194 . A 8 THR C . 30505 1
62 . 1 1 8 8 THR CA C 13 61.982 0.07 . 1 . . 191 . A 8 THR CA . 30505 1
63 . 1 1 8 8 THR CB C 13 70.028 0.056 . 1 . . 190 . A 8 THR CB . 30505 1
64 . 1 1 8 8 THR CG2 C 13 21.612 0.026 . 1 . . 616 . A 8 THR CG2 . 30505 1
65 . 1 1 8 8 THR N N 15 110.232 0.045 . 1 . . 67 . A 8 THR N . 30505 1
66 . 1 1 9 9 GLY H H 1 8.026 0.013 . 1 . . 35 . A 9 GLY H . 30505 1
67 . 1 1 9 9 GLY HA2 H 1 3.929 0.011 . 2 . . 552 . A 9 GLY HA2 . 30505 1
68 . 1 1 9 9 GLY HA3 H 1 3.969 0.006 . 2 . . 553 . A 9 GLY HA3 . 30505 1
69 . 1 1 9 9 GLY C C 13 174.277 0.036 . 1 . . 193 . A 9 GLY C . 30505 1
70 . 1 1 9 9 GLY CA C 13 46.098 0.019 . 1 . . 192 . A 9 GLY CA . 30505 1
71 . 1 1 9 9 GLY N N 15 110.771 0.062 . 1 . . 36 . A 9 GLY N . 30505 1
72 . 1 1 10 10 SER H H 1 7.795 0.008 . 1 . . 147 . A 10 SER H . 30505 1
73 . 1 1 10 10 SER HA H 1 4.369 0.004 . 1 . . 609 . A 10 SER HA . 30505 1
74 . 1 1 10 10 SER HB2 H 1 3.744 0.01 . 1 . . 610 . A 10 SER HB2 . 30505 1
75 . 1 1 10 10 SER C C 13 173.562 0.018 . 1 . . 197 . A 10 SER C . 30505 1
76 . 1 1 10 10 SER CA C 13 58.907 0.043 . 1 . . 195 . A 10 SER CA . 30505 1
77 . 1 1 10 10 SER CB C 13 64.348 0.022 . 1 . . 196 . A 10 SER CB . 30505 1
78 . 1 1 10 10 SER N N 15 113.681 0.032 . 1 . . 148 . A 10 SER N . 30505 1
79 . 1 1 11 11 CYS H H 1 8.728 0.011 . 1 . . 5 . A 11 CYS H . 30505 1
80 . 1 1 11 11 CYS HA H 1 4.705 0.008 . 1 . . 493 . A 11 CYS HA . 30505 1
81 . 1 1 11 11 CYS HB2 H 1 3.192 0.003 . 2 . . 494 . A 11 CYS HB2 . 30505 1
82 . 1 1 11 11 CYS HB3 H 1 2.419 0.007 . 2 . . 495 . A 11 CYS HB3 . 30505 1
83 . 1 1 11 11 CYS C C 13 174.375 . . 1 . . 200 . A 11 CYS C . 30505 1
84 . 1 1 11 11 CYS CA C 13 54.076 0.053 . 1 . . 199 . A 11 CYS CA . 30505 1
85 . 1 1 11 11 CYS CB C 13 37.533 0.046 . 1 . . 198 . A 11 CYS CB . 30505 1
86 . 1 1 11 11 CYS N N 15 120.981 0.059 . 1 . . 6 . A 11 CYS N . 30505 1
87 . 1 1 12 12 ASN HA H 1 4.519 0.004 . 1 . . 454 . A 12 ASN HA . 30505 1
88 . 1 1 12 12 ASN HB2 H 1 2.867 0.008 . 2 . . 452 . A 12 ASN HB2 . 30505 1
89 . 1 1 12 12 ASN HB3 H 1 2.850 0.003 . 2 . . 453 . A 12 ASN HB3 . 30505 1
90 . 1 1 12 12 ASN HD21 H 1 6.925 0.001 . 1 . . 84 . A 12 ASN HD21 . 30505 1
91 . 1 1 12 12 ASN HD22 H 1 7.618 0.001 . 1 . . 153 . A 12 ASN HD22 . 30505 1
92 . 1 1 12 12 ASN C C 13 176.279 0.03 . 1 . . 324 . A 12 ASN C . 30505 1
93 . 1 1 12 12 ASN CA C 13 55.876 0.018 . 1 . . 326 . A 12 ASN CA . 30505 1
94 . 1 1 12 12 ASN CB C 13 38.508 0.075 . 1 . . 325 . A 12 ASN CB . 30505 1
95 . 1 1 12 12 ASN ND2 N 15 112.893 0.051 . 1 . . 85 . A 12 ASN ND2 . 30505 1
96 . 1 1 13 13 THR H H 1 7.864 0.006 . 1 . . 145 . A 13 THR H . 30505 1
97 . 1 1 13 13 THR HA H 1 4.493 0.005 . 1 . . 622 . A 13 THR HA . 30505 1
98 . 1 1 13 13 THR HB H 1 4.376 0.004 . 1 . . 623 . A 13 THR HB . 30505 1
99 . 1 1 13 13 THR HG21 H 1 1.175 0.004 . 1 . . 621 . A 13 THR HG21 . 30505 1
100 . 1 1 13 13 THR HG22 H 1 1.175 0.004 . 1 . . 621 . A 13 THR HG22 . 30505 1
101 . 1 1 13 13 THR HG23 H 1 1.175 0.004 . 1 . . 621 . A 13 THR HG23 . 30505 1
102 . 1 1 13 13 THR C C 13 174.220 0.037 . 1 . . 323 . A 13 THR C . 30505 1
103 . 1 1 13 13 THR CA C 13 61.236 0.088 . 1 . . 321 . A 13 THR CA . 30505 1
104 . 1 1 13 13 THR CB C 13 69.939 0.013 . 1 . . 322 . A 13 THR CB . 30505 1
105 . 1 1 13 13 THR CG2 C 13 21.585 0.034 . 1 . . 620 . A 13 THR CG2 . 30505 1
106 . 1 1 13 13 THR N N 15 108.803 0.028 . 1 . . 146 . A 13 THR N . 30505 1
107 . 1 1 14 14 GLY H H 1 7.467 0.005 . 1 . . 319 . A 14 GLY H . 30505 1
108 . 1 1 14 14 GLY HA2 H 1 3.811 0.002 . 2 . . 554 . A 14 GLY HA2 . 30505 1
109 . 1 1 14 14 GLY HA3 H 1 4.257 0.003 . 2 . . 555 . A 14 GLY HA3 . 30505 1
110 . 1 1 14 14 GLY C C 13 172.769 0.027 . 1 . . 318 . A 14 GLY C . 30505 1
111 . 1 1 14 14 GLY CA C 13 44.669 0.016 . 1 . . 260 . A 14 GLY CA . 30505 1
112 . 1 1 14 14 GLY N N 15 110.449 0.046 . 1 . . 320 . A 14 GLY N . 30505 1
113 . 1 1 15 15 LYS H H 1 8.907 0.005 . 1 . . 156 . A 15 LYS H . 30505 1
114 . 1 1 15 15 LYS HA H 1 4.662 0.004 . 1 . . 818 . A 15 LYS HA . 30505 1
115 . 1 1 15 15 LYS HB2 H 1 1.691 0.008 . 2 . . 821 . A 15 LYS HB2 . 30505 1
116 . 1 1 15 15 LYS HB3 H 1 1.464 0.009 . 2 . . 822 . A 15 LYS HB3 . 30505 1
117 . 1 1 15 15 LYS HG2 H 1 1.398 0.007 . 1 . . 820 . A 15 LYS HG2 . 30505 1
118 . 1 1 15 15 LYS HD2 H 1 1.719 0.005 . 2 . . 823 . A 15 LYS HD2 . 30505 1
119 . 1 1 15 15 LYS HD3 H 1 1.606 0.005 . 2 . . 824 . A 15 LYS HD3 . 30505 1
120 . 1 1 15 15 LYS HE2 H 1 3.061 0.005 . 2 . . 819 . A 15 LYS HE2 . 30505 1
121 . 1 1 15 15 LYS HE3 H 1 3.071 0.003 . 2 . . 825 . A 15 LYS HE3 . 30505 1
122 . 1 1 15 15 LYS C C 13 175.413 0.033 . 1 . . 259 . A 15 LYS C . 30505 1
123 . 1 1 15 15 LYS CA C 13 54.483 0.025 . 1 . . 258 . A 15 LYS CA . 30505 1
124 . 1 1 15 15 LYS CB C 13 35.024 0.096 . 1 . . 257 . A 15 LYS CB . 30505 1
125 . 1 1 15 15 LYS CG C 13 25.188 0.025 . 1 . . 816 . A 15 LYS CG . 30505 1
126 . 1 1 15 15 LYS CD C 13 29.724 0.042 . 1 . . 817 . A 15 LYS CD . 30505 1
127 . 1 1 15 15 LYS CE C 13 42.611 0.021 . 1 . . 815 . A 15 LYS CE . 30505 1
128 . 1 1 15 15 LYS N N 15 119.723 0.032 . 1 . . 157 . A 15 LYS N . 30505 1
129 . 1 1 16 16 LEU H H 1 8.426 0.01 . 1 . . 90 . A 16 LEU H . 30505 1
130 . 1 1 16 16 LEU HA H 1 4.854 0.005 . 1 . . 757 . A 16 LEU HA . 30505 1
131 . 1 1 16 16 LEU HB2 H 1 1.313 0.005 . 2 . . 759 . A 16 LEU HB2 . 30505 1
132 . 1 1 16 16 LEU HB3 H 1 1.705 0.005 . 2 . . 760 . A 16 LEU HB3 . 30505 1
133 . 1 1 16 16 LEU HG H 1 1.615 0.007 . 1 . . 761 . A 16 LEU HG . 30505 1
134 . 1 1 16 16 LEU HD11 H 1 0.794 0.009 . 2 . . 762 . A 16 LEU HD11 . 30505 1
135 . 1 1 16 16 LEU HD12 H 1 0.794 0.009 . 2 . . 762 . A 16 LEU HD12 . 30505 1
136 . 1 1 16 16 LEU HD13 H 1 0.794 0.009 . 2 . . 762 . A 16 LEU HD13 . 30505 1
137 . 1 1 16 16 LEU HD21 H 1 0.819 0.004 . 2 . . 917 . A 16 LEU HD21 . 30505 1
138 . 1 1 16 16 LEU HD22 H 1 0.819 0.004 . 2 . . 917 . A 16 LEU HD22 . 30505 1
139 . 1 1 16 16 LEU HD23 H 1 0.819 0.004 . 2 . . 917 . A 16 LEU HD23 . 30505 1
140 . 1 1 16 16 LEU C C 13 176.585 0.041 . 1 . . 263 . A 16 LEU C . 30505 1
141 . 1 1 16 16 LEU CA C 13 55.069 0.034 . 1 . . 262 . A 16 LEU CA . 30505 1
142 . 1 1 16 16 LEU CB C 13 44.064 0.045 . 1 . . 261 . A 16 LEU CB . 30505 1
143 . 1 1 16 16 LEU CG C 13 27.329 0.111 . 1 . . 758 . A 16 LEU CG . 30505 1
144 . 1 1 16 16 LEU CD1 C 13 25.267 0.088 . 2 . . 756 . A 16 LEU CD1 . 30505 1
145 . 1 1 16 16 LEU CD2 C 13 25.566 0.028 . 2 . . 918 . A 16 LEU CD2 . 30505 1
146 . 1 1 16 16 LEU N N 15 126.062 0.043 . 1 . . 91 . A 16 LEU N . 30505 1
147 . 1 1 17 17 ALA H H 1 8.850 0.004 . 1 . . 151 . A 17 ALA H . 30505 1
148 . 1 1 17 17 ALA HA H 1 4.522 0.004 . 1 . . 436 . A 17 ALA HA . 30505 1
149 . 1 1 17 17 ALA HB1 H 1 1.325 0.006 . 1 . . 434 . A 17 ALA HB1 . 30505 1
150 . 1 1 17 17 ALA HB2 H 1 1.325 0.006 . 1 . . 434 . A 17 ALA HB2 . 30505 1
151 . 1 1 17 17 ALA HB3 H 1 1.325 0.006 . 1 . . 434 . A 17 ALA HB3 . 30505 1
152 . 1 1 17 17 ALA CA C 13 52.078 0.039 . 1 . . 437 . A 17 ALA CA . 30505 1
153 . 1 1 17 17 ALA CB C 13 23.322 0.055 . 1 . . 435 . A 17 ALA CB . 30505 1
154 . 1 1 17 17 ALA N N 15 125.034 0.052 . 1 . . 152 . A 17 ALA N . 30505 1
155 . 1 1 18 18 CYS H H 1 9.227 0.006 . 1 . . 438 . A 18 CYS H . 30505 1
156 . 1 1 18 18 CYS HA H 1 4.906 0.006 . 1 . . 441 . A 18 CYS HA . 30505 1
157 . 1 1 18 18 CYS HB2 H 1 3.443 0.004 . 2 . . 440 . A 18 CYS HB2 . 30505 1
158 . 1 1 18 18 CYS HB3 H 1 2.303 0.004 . 2 . . 442 . A 18 CYS HB3 . 30505 1
159 . 1 1 18 18 CYS C C 13 173.921 0.009 . 1 . . 313 . A 18 CYS C . 30505 1
160 . 1 1 18 18 CYS CA C 13 54.002 0.057 . 1 . . 312 . A 18 CYS CA . 30505 1
161 . 1 1 18 18 CYS CB C 13 38.801 0.047 . 1 . . 311 . A 18 CYS CB . 30505 1
162 . 1 1 18 18 CYS N N 15 124.459 0.014 . 1 . . 439 . A 18 CYS N . 30505 1
163 . 1 1 19 19 CYS H H 1 8.686 0.014 . 1 . . 123 . A 19 CYS H . 30505 1
164 . 1 1 19 19 CYS HA H 1 5.348 0.004 . 1 . . 477 . A 19 CYS HA . 30505 1
165 . 1 1 19 19 CYS HB2 H 1 2.593 0.006 . 2 . . 475 . A 19 CYS HB2 . 30505 1
166 . 1 1 19 19 CYS HB3 H 1 2.778 0.005 . 2 . . 476 . A 19 CYS HB3 . 30505 1
167 . 1 1 19 19 CYS C C 13 172.077 0.038 . 1 . . 310 . A 19 CYS C . 30505 1
168 . 1 1 19 19 CYS CA C 13 56.789 0.032 . 1 . . 309 . A 19 CYS CA . 30505 1
169 . 1 1 19 19 CYS CB C 13 50.061 0.021 . 1 . . 308 . A 19 CYS CB . 30505 1
170 . 1 1 19 19 CYS N N 15 125.206 0.044 . 1 . . 124 . A 19 CYS N . 30505 1
171 . 1 1 20 20 ASP H H 1 8.520 0.011 . 1 . . 70 . A 20 ASP H . 30505 1
172 . 1 1 20 20 ASP HA H 1 5.066 0.004 . 1 . . 455 . A 20 ASP HA . 30505 1
173 . 1 1 20 20 ASP HB2 H 1 2.350 0.005 . 2 . . 456 . A 20 ASP HB2 . 30505 1
174 . 1 1 20 20 ASP HB3 H 1 2.976 0.007 . 2 . . 457 . A 20 ASP HB3 . 30505 1
175 . 1 1 20 20 ASP C C 13 176.784 0.037 . 1 . . 307 . A 20 ASP C . 30505 1
176 . 1 1 20 20 ASP CA C 13 52.225 0.035 . 1 . . 305 . A 20 ASP CA . 30505 1
177 . 1 1 20 20 ASP CB C 13 41.503 0.047 . 1 . . 306 . A 20 ASP CB . 30505 1
178 . 1 1 20 20 ASP N N 15 121.282 0.039 . 1 . . 71 . A 20 ASP N . 30505 1
179 . 1 1 21 21 THR H H 1 8.338 0.005 . 1 . . 25 . A 21 THR H . 30505 1
180 . 1 1 21 21 THR HA H 1 3.937 0.003 . 1 . . 627 . A 21 THR HA . 30505 1
181 . 1 1 21 21 THR HB H 1 4.384 0.004 . 1 . . 626 . A 21 THR HB . 30505 1
182 . 1 1 21 21 THR HG21 H 1 1.046 0.003 . 1 . . 625 . A 21 THR HG21 . 30505 1
183 . 1 1 21 21 THR HG22 H 1 1.046 0.003 . 1 . . 625 . A 21 THR HG22 . 30505 1
184 . 1 1 21 21 THR HG23 H 1 1.046 0.003 . 1 . . 625 . A 21 THR HG23 . 30505 1
185 . 1 1 21 21 THR C C 13 174.877 0.02 . 1 . . 304 . A 21 THR C . 30505 1
186 . 1 1 21 21 THR CA C 13 63.563 0.065 . 1 . . 302 . A 21 THR CA . 30505 1
187 . 1 1 21 21 THR CB C 13 68.095 0.03 . 1 . . 303 . A 21 THR CB . 30505 1
188 . 1 1 21 21 THR CG2 C 13 21.408 0.014 . 1 . . 624 . A 21 THR CG2 . 30505 1
189 . 1 1 21 21 THR N N 15 113.316 0.026 . 1 . . 26 . A 21 THR N . 30505 1
190 . 1 1 22 22 ASN H H 1 8.529 0.007 . 1 . . 102 . A 22 ASN H . 30505 1
191 . 1 1 22 22 ASN HA H 1 4.795 0.013 . 1 . . 443 . A 22 ASN HA . 30505 1
192 . 1 1 22 22 ASN HB2 H 1 2.815 0.008 . 2 . . 444 . A 22 ASN HB2 . 30505 1
193 . 1 1 22 22 ASN HB3 H 1 2.872 0.009 . 2 . . 445 . A 22 ASN HB3 . 30505 1
194 . 1 1 22 22 ASN HD21 H 1 7.886 0.003 . 1 . . 98 . A 22 ASN HD21 . 30505 1
195 . 1 1 22 22 ASN HD22 H 1 6.972 0.004 . 1 . . 104 . A 22 ASN HD22 . 30505 1
196 . 1 1 22 22 ASN C C 13 175.092 0.015 . 1 . . 301 . A 22 ASN C . 30505 1
197 . 1 1 22 22 ASN CA C 13 53.566 0.053 . 1 . . 300 . A 22 ASN CA . 30505 1
198 . 1 1 22 22 ASN CB C 13 39.590 0.04 . 1 . . 299 . A 22 ASN CB . 30505 1
199 . 1 1 22 22 ASN N N 15 117.152 0.029 . 1 . . 103 . A 22 ASN N . 30505 1
200 . 1 1 22 22 ASN ND2 N 15 115.543 0.034 . 1 . . 99 . A 22 ASN ND2 . 30505 1
201 . 1 1 23 23 LYS H H 1 7.655 0.007 . 1 . . 107 . A 23 LYS H . 30505 1
202 . 1 1 23 23 LYS HA H 1 4.536 0.004 . 1 . . 829 . A 23 LYS HA . 30505 1
203 . 1 1 23 23 LYS HB2 H 1 1.899 0.004 . 2 . . 831 . A 23 LYS HB2 . 30505 1
204 . 1 1 23 23 LYS HB3 H 1 1.755 0.005 . 2 . . 832 . A 23 LYS HB3 . 30505 1
205 . 1 1 23 23 LYS HG2 H 1 1.296 0.006 . 1 . . 834 . A 23 LYS HG2 . 30505 1
206 . 1 1 23 23 LYS HD2 H 1 1.639 0.004 . 1 . . 833 . A 23 LYS HD2 . 30505 1
207 . 1 1 23 23 LYS HE2 H 1 2.974 0.004 . 1 . . 830 . A 23 LYS HE2 . 30505 1
208 . 1 1 23 23 LYS C C 13 174.120 0.026 . 1 . . 295 . A 23 LYS C . 30505 1
209 . 1 1 23 23 LYS CA C 13 54.866 0.047 . 1 . . 298 . A 23 LYS CA . 30505 1
210 . 1 1 23 23 LYS CB C 13 32.663 0.045 . 1 . . 297 . A 23 LYS CB . 30505 1
211 . 1 1 23 23 LYS CG C 13 24.867 0.065 . 1 . . 827 . A 23 LYS CG . 30505 1
212 . 1 1 23 23 LYS CD C 13 29.215 0.031 . 1 . . 828 . A 23 LYS CD . 30505 1
213 . 1 1 23 23 LYS CE C 13 42.276 0.013 . 1 . . 826 . A 23 LYS CE . 30505 1
214 . 1 1 23 23 LYS N N 15 123.649 0.033 . 1 . . 108 . A 23 LYS N . 30505 1
215 . 1 1 24 24 LYS H H 1 7.961 0.002 . 1 . . 39 . A 24 LYS H . 30505 1
216 . 1 1 24 24 LYS HA H 1 4.786 0.009 . 1 . . 838 . A 24 LYS HA . 30505 1
217 . 1 1 24 24 LYS HB2 H 1 1.837 0.005 . 2 . . 840 . A 24 LYS HB2 . 30505 1
218 . 1 1 24 24 LYS HB3 H 1 1.748 0.007 . 2 . . 841 . A 24 LYS HB3 . 30505 1
219 . 1 1 24 24 LYS HG2 H 1 1.508 0.003 . 2 . . 843 . A 24 LYS HG2 . 30505 1
220 . 1 1 24 24 LYS HG3 H 1 1.401 0.004 . 2 . . 844 . A 24 LYS HG3 . 30505 1
221 . 1 1 24 24 LYS HD2 H 1 1.665 0.007 . 1 . . 842 . A 24 LYS HD2 . 30505 1
222 . 1 1 24 24 LYS HE2 H 1 2.991 0.003 . 1 . . 839 . A 24 LYS HE2 . 30505 1
223 . 1 1 24 24 LYS C C 13 177.391 0.02 . 1 . . 292 . A 24 LYS C . 30505 1
224 . 1 1 24 24 LYS CA C 13 56.247 0.04 . 1 . . 291 . A 24 LYS CA . 30505 1
225 . 1 1 24 24 LYS CB C 13 33.194 0.035 . 1 . . 290 . A 24 LYS CB . 30505 1
226 . 1 1 24 24 LYS CG C 13 25.664 0.031 . 1 . . 837 . A 24 LYS CG . 30505 1
227 . 1 1 24 24 LYS CD C 13 29.107 0.04 . 1 . . 836 . A 24 LYS CD . 30505 1
228 . 1 1 24 24 LYS CE C 13 42.399 0.035 . 1 . . 835 . A 24 LYS CE . 30505 1
229 . 1 1 24 24 LYS N N 15 122.813 0.025 . 1 . . 40 . A 24 LYS N . 30505 1
230 . 1 1 25 25 VAL H H 1 8.345 0.004 . 1 . . 121 . A 25 VAL H . 30505 1
231 . 1 1 25 25 VAL HA H 1 4.167 0.003 . 1 . . 657 . A 25 VAL HA . 30505 1
232 . 1 1 25 25 VAL HB H 1 1.797 0.004 . 1 . . 658 . A 25 VAL HB . 30505 1
233 . 1 1 25 25 VAL HG11 H 1 0.823 0.008 . 2 . . 656 . A 25 VAL HG11 . 30505 1
234 . 1 1 25 25 VAL HG12 H 1 0.823 0.008 . 2 . . 656 . A 25 VAL HG12 . 30505 1
235 . 1 1 25 25 VAL HG13 H 1 0.823 0.008 . 2 . . 656 . A 25 VAL HG13 . 30505 1
236 . 1 1 25 25 VAL HG21 H 1 0.789 0.009 . 2 . . 659 . A 25 VAL HG21 . 30505 1
237 . 1 1 25 25 VAL HG22 H 1 0.789 0.009 . 2 . . 659 . A 25 VAL HG22 . 30505 1
238 . 1 1 25 25 VAL HG23 H 1 0.789 0.009 . 2 . . 659 . A 25 VAL HG23 . 30505 1
239 . 1 1 25 25 VAL C C 13 175.093 0.008 . 1 . . 296 . A 25 VAL C . 30505 1
240 . 1 1 25 25 VAL CA C 13 61.451 0.027 . 1 . . 294 . A 25 VAL CA . 30505 1
241 . 1 1 25 25 VAL CB C 13 33.593 0.05 . 1 . . 293 . A 25 VAL CB . 30505 1
242 . 1 1 25 25 VAL CG1 C 13 21.019 0.013 . 2 . . 660 . A 25 VAL CG1 . 30505 1
243 . 1 1 25 25 VAL CG2 C 13 20.783 0.064 . 2 . . 655 . A 25 VAL CG2 . 30505 1
244 . 1 1 25 25 VAL N N 15 122.995 0.049 . 1 . . 122 . A 25 VAL N . 30505 1
245 . 1 1 26 26 GLN H H 1 8.509 0.004 . 1 . . 129 . A 26 GLN H . 30505 1
246 . 1 1 26 26 GLN HA H 1 4.455 0.003 . 1 . . 497 . A 26 GLN HA . 30505 1
247 . 1 1 26 26 GLN HB2 H 1 1.948 0.006 . 2 . . 498 . A 26 GLN HB2 . 30505 1
248 . 1 1 26 26 GLN HB3 H 1 2.058 0.006 . 2 . . 499 . A 26 GLN HB3 . 30505 1
249 . 1 1 26 26 GLN HG2 H 1 2.324 0.004 . 1 . . 500 . A 26 GLN HG2 . 30505 1
250 . 1 1 26 26 GLN HE21 H 1 7.529 0.007 . 1 . . 59 . A 26 GLN HE21 . 30505 1
251 . 1 1 26 26 GLN HE22 H 1 6.849 0.001 . 1 . . 65 . A 26 GLN HE22 . 30505 1
252 . 1 1 26 26 GLN C C 13 175.465 . . 1 . . 168 . A 26 GLN C . 30505 1
253 . 1 1 26 26 GLN CA C 13 55.201 0.035 . 1 . . 170 . A 26 GLN CA . 30505 1
254 . 1 1 26 26 GLN CB C 13 29.683 0.04 . 1 . . 169 . A 26 GLN CB . 30505 1
255 . 1 1 26 26 GLN CG C 13 33.847 0.028 . 1 . . 496 . A 26 GLN CG . 30505 1
256 . 1 1 26 26 GLN N N 15 125.121 0.085 . 1 . . 130 . A 26 GLN N . 30505 1
257 . 1 1 26 26 GLN NE2 N 15 112.249 0.083 . 1 . . 60 . A 26 GLN NE2 . 30505 1
258 . 1 1 27 27 LYS H H 1 8.519 0.002 . 1 . . 9 . A 27 LYS H . 30505 1
259 . 1 1 27 27 LYS HA H 1 4.356 0.004 . 1 . . 848 . A 27 LYS HA . 30505 1
260 . 1 1 27 27 LYS HB2 H 1 1.811 0.008 . 2 . . 850 . A 27 LYS HB2 . 30505 1
261 . 1 1 27 27 LYS HB3 H 1 1.713 0.004 . 2 . . 851 . A 27 LYS HB3 . 30505 1
262 . 1 1 27 27 LYS HG2 H 1 1.388 0.008 . 1 . . 852 . A 27 LYS HG2 . 30505 1
263 . 1 1 27 27 LYS HD2 H 1 1.617 0.003 . 1 . . 853 . A 27 LYS HD2 . 30505 1
264 . 1 1 27 27 LYS HE2 H 1 2.890 0.002 . 1 . . 849 . A 27 LYS HE2 . 30505 1
265 . 1 1 27 27 LYS C C 13 176.427 0.021 . 1 . . 166 . A 27 LYS C . 30505 1
266 . 1 1 27 27 LYS CA C 13 56.129 0.048 . 1 . . 164 . A 27 LYS CA . 30505 1
267 . 1 1 27 27 LYS CB C 13 33.448 0.024 . 1 . . 165 . A 27 LYS CB . 30505 1
268 . 1 1 27 27 LYS CG C 13 24.778 0.081 . 1 . . 847 . A 27 LYS CG . 30505 1
269 . 1 1 27 27 LYS CD C 13 29.106 0.077 . 1 . . 846 . A 27 LYS CD . 30505 1
270 . 1 1 27 27 LYS CE C 13 41.806 0.032 . 1 . . 845 . A 27 LYS CE . 30505 1
271 . 1 1 27 27 LYS N N 15 124.819 0.077 . 1 . . 10 . A 27 LYS N . 30505 1
272 . 1 1 28 28 SER H H 1 8.602 0.008 . 1 . . 105 . A 28 SER H . 30505 1
273 . 1 1 28 28 SER HA H 1 4.557 0.006 . 1 . . 612 . A 28 SER HA . 30505 1
274 . 1 1 28 28 SER HB2 H 1 3.885 0.015 . 1 . . 611 . A 28 SER HB2 . 30505 1
275 . 1 1 28 28 SER C C 13 174.872 0.02 . 1 . . 167 . A 28 SER C . 30505 1
276 . 1 1 28 28 SER CA C 13 58.304 0.023 . 1 . . 162 . A 28 SER CA . 30505 1
277 . 1 1 28 28 SER CB C 13 63.888 0.009 . 1 . . 163 . A 28 SER CB . 30505 1
278 . 1 1 28 28 SER N N 15 117.622 0.052 . 1 . . 106 . A 28 SER N . 30505 1
279 . 1 1 29 29 THR H H 1 8.316 0.002 . 1 . . 119 . A 29 THR H . 30505 1
280 . 1 1 29 29 THR HA H 1 4.394 0.003 . 1 . . 631 . A 29 THR HA . 30505 1
281 . 1 1 29 29 THR HB H 1 4.311 0.005 . 1 . . 630 . A 29 THR HB . 30505 1
282 . 1 1 29 29 THR HG21 H 1 1.204 0.005 . 1 . . 629 . A 29 THR HG21 . 30505 1
283 . 1 1 29 29 THR HG22 H 1 1.204 0.005 . 1 . . 629 . A 29 THR HG22 . 30505 1
284 . 1 1 29 29 THR HG23 H 1 1.204 0.005 . 1 . . 629 . A 29 THR HG23 . 30505 1
285 . 1 1 29 29 THR C C 13 175.196 0.001 . 1 . . 171 . A 29 THR C . 30505 1
286 . 1 1 29 29 THR CA C 13 61.964 0.057 . 1 . . 161 . A 29 THR CA . 30505 1
287 . 1 1 29 29 THR CB C 13 69.887 0.02 . 1 . . 160 . A 29 THR CB . 30505 1
288 . 1 1 29 29 THR CG2 C 13 21.662 0.014 . 1 . . 628 . A 29 THR CG2 . 30505 1
289 . 1 1 29 29 THR N N 15 115.272 0.054 . 1 . . 120 . A 29 THR N . 30505 1
290 . 1 1 30 30 GLY H H 1 8.427 0.003 . 1 . . 31 . A 30 GLY H . 30505 1
291 . 1 1 30 30 GLY HA2 H 1 3.967 0.01 . 2 . . 556 . A 30 GLY HA2 . 30505 1
292 . 1 1 30 30 GLY HA3 H 1 4.025 0.011 . 2 . . 557 . A 30 GLY HA3 . 30505 1
293 . 1 1 30 30 GLY C C 13 174.363 . . 1 . . 172 . A 30 GLY C . 30505 1
294 . 1 1 30 30 GLY CA C 13 45.406 0.048 . 1 . . 173 . A 30 GLY CA . 30505 1
295 . 1 1 30 30 GLY N N 15 110.922 0.045 . 1 . . 32 . A 30 GLY N . 30505 1
296 . 1 1 31 31 GLU H H 1 8.323 0.002 . 1 . . 47 . A 31 GLU H . 30505 1
297 . 1 1 31 31 GLU HA H 1 4.286 0.003 . 1 . . 524 . A 31 GLU HA . 30505 1
298 . 1 1 31 31 GLU HB2 H 1 1.935 0.002 . 2 . . 521 . A 31 GLU HB2 . 30505 1
299 . 1 1 31 31 GLU HB3 H 1 2.072 0.002 . 2 . . 522 . A 31 GLU HB3 . 30505 1
300 . 1 1 31 31 GLU HG2 H 1 2.253 0.002 . 1 . . 523 . A 31 GLU HG2 . 30505 1
301 . 1 1 31 31 GLU C C 13 176.965 0.037 . 1 . . 176 . A 31 GLU C . 30505 1
302 . 1 1 31 31 GLU CA C 13 56.932 0.045 . 1 . . 175 . A 31 GLU CA . 30505 1
303 . 1 1 31 31 GLU CB C 13 30.277 0.06 . 1 . . 174 . A 31 GLU CB . 30505 1
304 . 1 1 31 31 GLU CG C 13 36.357 0.052 . 1 . . 520 . A 31 GLU CG . 30505 1
305 . 1 1 31 31 GLU N N 15 120.733 0.022 . 1 . . 48 . A 31 GLU N . 30505 1
306 . 1 1 32 32 GLU H H 1 8.622 0.002 . 1 . . 41 . A 32 GLU H . 30505 1
307 . 1 1 32 32 GLU HA H 1 4.279 0.006 . 1 . . 526 . A 32 GLU HA . 30505 1
308 . 1 1 32 32 GLU HB2 H 1 1.986 0.008 . 2 . . 527 . A 32 GLU HB2 . 30505 1
309 . 1 1 32 32 GLU HB3 H 1 2.085 0.002 . 2 . . 528 . A 32 GLU HB3 . 30505 1
310 . 1 1 32 32 GLU HG2 H 1 2.279 0.002 . 1 . . 529 . A 32 GLU HG2 . 30505 1
311 . 1 1 32 32 GLU C C 13 176.833 0.02 . 1 . . 179 . A 32 GLU C . 30505 1
312 . 1 1 32 32 GLU CA C 13 57.096 0.083 . 1 . . 177 . A 32 GLU CA . 30505 1
313 . 1 1 32 32 GLU CB C 13 29.876 0.042 . 1 . . 178 . A 32 GLU CB . 30505 1
314 . 1 1 32 32 GLU CG C 13 36.294 0.006 . 1 . . 525 . A 32 GLU CG . 30505 1
315 . 1 1 32 32 GLU N N 15 121.613 0.034 . 1 . . 42 . A 32 GLU N . 30505 1
316 . 1 1 33 33 SER H H 1 8.291 0.004 . 1 . . 181 . A 33 SER H . 30505 1
317 . 1 1 33 33 SER HA H 1 4.398 0.003 . 1 . . 613 . A 33 SER HA . 30505 1
318 . 1 1 33 33 SER HB2 H 1 3.914 0.016 . 2 . . 614 . A 33 SER HB2 . 30505 1
319 . 1 1 33 33 SER HB3 H 1 3.882 0.012 . 2 . . 615 . A 33 SER HB3 . 30505 1
320 . 1 1 33 33 SER C C 13 175.266 0.023 . 1 . . 184 . A 33 SER C . 30505 1
321 . 1 1 33 33 SER CA C 13 58.942 0.022 . 1 . . 183 . A 33 SER CA . 30505 1
322 . 1 1 33 33 SER CB C 13 63.859 0.015 . 1 . . 180 . A 33 SER CB . 30505 1
323 . 1 1 33 33 SER N N 15 116.318 0.066 . 1 . . 182 . A 33 SER N . 30505 1
324 . 1 1 34 34 GLY H H 1 8.366 0.002 . 1 . . 2 . A 34 GLY H . 30505 1
325 . 1 1 34 34 GLY HA2 H 1 3.957 0.009 . 1 . . 558 . A 34 GLY HA2 . 30505 1
326 . 1 1 34 34 GLY C C 13 174.144 0.03 . 1 . . 186 . A 34 GLY C . 30505 1
327 . 1 1 34 34 GLY CA C 13 45.579 0.039 . 1 . . 185 . A 34 GLY CA . 30505 1
328 . 1 1 34 34 GLY N N 15 110.627 0.043 . 1 . . 22 . A 34 GLY N . 30505 1
329 . 1 1 35 35 LEU H H 1 7.921 0.003 . 1 . . 3 . A 35 LEU H . 30505 1
330 . 1 1 35 35 LEU HA H 1 4.313 0.013 . 1 . . 766 . A 35 LEU HA . 30505 1
331 . 1 1 35 35 LEU HB2 H 1 1.566 0.013 . 1 . . 767 . A 35 LEU HB2 . 30505 1
332 . 1 1 35 35 LEU HG H 1 1.554 0.008 . 1 . . 768 . A 35 LEU HG . 30505 1
333 . 1 1 35 35 LEU HD11 H 1 0.888 0.009 . 2 . . 769 . A 35 LEU HD11 . 30505 1
334 . 1 1 35 35 LEU HD12 H 1 0.888 0.009 . 2 . . 769 . A 35 LEU HD12 . 30505 1
335 . 1 1 35 35 LEU HD13 H 1 0.888 0.009 . 2 . . 769 . A 35 LEU HD13 . 30505 1
336 . 1 1 35 35 LEU HD21 H 1 0.834 0.004 . 2 . . 770 . A 35 LEU HD21 . 30505 1
337 . 1 1 35 35 LEU HD22 H 1 0.834 0.004 . 2 . . 770 . A 35 LEU HD22 . 30505 1
338 . 1 1 35 35 LEU HD23 H 1 0.834 0.004 . 2 . . 770 . A 35 LEU HD23 . 30505 1
339 . 1 1 35 35 LEU C C 13 177.162 0.027 . 1 . . 420 . A 35 LEU C . 30505 1
340 . 1 1 35 35 LEU CA C 13 55.258 0.044 . 1 . . 188 . A 35 LEU CA . 30505 1
341 . 1 1 35 35 LEU CB C 13 42.440 0.049 . 1 . . 189 . A 35 LEU CB . 30505 1
342 . 1 1 35 35 LEU CG C 13 26.921 0.019 . 1 . . 763 . A 35 LEU CG . 30505 1
343 . 1 1 35 35 LEU CD1 C 13 24.963 0.023 . 2 . . 764 . A 35 LEU CD1 . 30505 1
344 . 1 1 35 35 LEU CD2 C 13 23.480 0.059 . 2 . . 765 . A 35 LEU CD2 . 30505 1
345 . 1 1 35 35 LEU N N 15 121.000 0.057 . 1 . . 4 . A 35 LEU N . 30505 1
346 . 1 1 36 36 LEU H H 1 8.083 0.003 . 1 . . 421 . A 36 LEU H . 30505 1
347 . 1 1 36 36 LEU HA H 1 4.311 0.005 . 1 . . 774 . A 36 LEU HA . 30505 1
348 . 1 1 36 36 LEU HB2 H 1 1.494 0.006 . 2 . . 912 . A 36 LEU HB2 . 30505 1
349 . 1 1 36 36 LEU HB3 H 1 1.583 0.003 . 2 . . 913 . A 36 LEU HB3 . 30505 1
350 . 1 1 36 36 LEU HG H 1 1.599 . . 1 . . 919 . A 36 LEU HG . 30505 1
351 . 1 1 36 36 LEU HD11 H 1 0.829 0.002 . 2 . . 910 . A 36 LEU HD11 . 30505 1
352 . 1 1 36 36 LEU HD12 H 1 0.829 0.002 . 2 . . 910 . A 36 LEU HD12 . 30505 1
353 . 1 1 36 36 LEU HD13 H 1 0.829 0.002 . 2 . . 910 . A 36 LEU HD13 . 30505 1
354 . 1 1 36 36 LEU HD21 H 1 0.899 0.001 . 2 . . 911 . A 36 LEU HD21 . 30505 1
355 . 1 1 36 36 LEU HD22 H 1 0.899 0.001 . 2 . . 911 . A 36 LEU HD22 . 30505 1
356 . 1 1 36 36 LEU HD23 H 1 0.899 0.001 . 2 . . 911 . A 36 LEU HD23 . 30505 1
357 . 1 1 36 36 LEU C C 13 176.960 0.019 . 1 . . 187 . A 36 LEU C . 30505 1
358 . 1 1 36 36 LEU CA C 13 55.171 0.042 . 1 . . 208 . A 36 LEU CA . 30505 1
359 . 1 1 36 36 LEU CB C 13 42.411 0.028 . 1 . . 207 . A 36 LEU CB . 30505 1
360 . 1 1 36 36 LEU CG C 13 26.929 . . 1 . . 771 . A 36 LEU CG . 30505 1
361 . 1 1 36 36 LEU CD1 C 13 23.589 0.001 . 2 . . 773 . A 36 LEU CD1 . 30505 1
362 . 1 1 36 36 LEU CD2 C 13 24.864 0.086 . 2 . . 772 . A 36 LEU CD2 . 30505 1
363 . 1 1 36 36 LEU N N 15 121.549 0.019 . 1 . . 422 . A 36 LEU N . 30505 1
364 . 1 1 37 37 HIS H H 1 8.409 0.003 . 1 . . 94 . A 37 HIS H . 30505 1
365 . 1 1 37 37 HIS HA H 1 4.758 0.012 . 1 . . 569 . A 37 HIS HA . 30505 1
366 . 1 1 37 37 HIS HB2 H 1 3.143 0.003 . 2 . . 567 . A 37 HIS HB2 . 30505 1
367 . 1 1 37 37 HIS HB3 H 1 3.257 0.001 . 2 . . 568 . A 37 HIS HB3 . 30505 1
368 . 1 1 37 37 HIS HD2 H 1 7.196 0.008 . 1 . . 899 . A 37 HIS HD2 . 30505 1
369 . 1 1 37 37 HIS HE1 H 1 8.337 . . 1 . . 897 . A 37 HIS HE1 . 30505 1
370 . 1 1 37 37 HIS C C 13 174.893 0.033 . 1 . . 204 . A 37 HIS C . 30505 1
371 . 1 1 37 37 HIS CA C 13 55.493 0.039 . 1 . . 206 . A 37 HIS CA . 30505 1
372 . 1 1 37 37 HIS CB C 13 29.632 0.067 . 1 . . 205 . A 37 HIS CB . 30505 1
373 . 1 1 37 37 HIS CD2 C 13 120.149 . . 1 . . 900 . A 37 HIS CD2 . 30505 1
374 . 1 1 37 37 HIS CE1 C 13 137.131 . . 1 . . 898 . A 37 HIS CE1 . 30505 1
375 . 1 1 37 37 HIS N N 15 119.596 0.015 . 1 . . 95 . A 37 HIS N . 30505 1
376 . 1 1 38 38 THR H H 1 8.156 0.004 . 1 . . 209 . A 38 THR H . 30505 1
377 . 1 1 38 38 THR HA H 1 4.332 0.005 . 1 . . 633 . A 38 THR HA . 30505 1
378 . 1 1 38 38 THR HB H 1 4.240 0.009 . 1 . . 632 . A 38 THR HB . 30505 1
379 . 1 1 38 38 THR HG21 H 1 1.173 0.005 . 1 . . 634 . A 38 THR HG21 . 30505 1
380 . 1 1 38 38 THR HG22 H 1 1.173 0.005 . 1 . . 634 . A 38 THR HG22 . 30505 1
381 . 1 1 38 38 THR HG23 H 1 1.173 0.005 . 1 . . 634 . A 38 THR HG23 . 30505 1
382 . 1 1 38 38 THR C C 13 176.198 . . 1 . . 213 . A 38 THR C . 30505 1
383 . 1 1 38 38 THR CA C 13 62.099 0.068 . 1 . . 212 . A 38 THR CA . 30505 1
384 . 1 1 38 38 THR CB C 13 69.785 0.033 . 1 . . 211 . A 38 THR CB . 30505 1
385 . 1 1 38 38 THR CG2 C 13 21.619 0.038 . 1 . . 635 . A 38 THR CG2 . 30505 1
386 . 1 1 38 38 THR N N 15 115.084 0.053 . 1 . . 210 . A 38 THR N . 30505 1
387 . 1 1 39 39 GLY H H 1 8.419 0.004 . 1 . . 316 . A 39 GLY H . 30505 1
388 . 1 1 39 39 GLY HA2 H 1 3.935 0.002 . 2 . . 559 . A 39 GLY HA2 . 30505 1
389 . 1 1 39 39 GLY HA3 H 1 4.018 0.003 . 2 . . 560 . A 39 GLY HA3 . 30505 1
390 . 1 1 39 39 GLY C C 13 173.756 0.0 . 1 . . 378 . A 39 GLY C . 30505 1
391 . 1 1 39 39 GLY CA C 13 45.310 0.026 . 1 . . 379 . A 39 GLY CA . 30505 1
392 . 1 1 39 39 GLY N N 15 110.955 0.026 . 1 . . 317 . A 39 GLY N . 30505 1
393 . 1 1 40 40 ASP H H 1 8.211 0.005 . 1 . . 78 . A 40 ASP H . 30505 1
394 . 1 1 40 40 ASP HA H 1 4.627 0.004 . 1 . . 463 . A 40 ASP HA . 30505 1
395 . 1 1 40 40 ASP HB2 H 1 2.596 0.004 . 2 . . 461 . A 40 ASP HB2 . 30505 1
396 . 1 1 40 40 ASP HB3 H 1 2.684 0.004 . 2 . . 462 . A 40 ASP HB3 . 30505 1
397 . 1 1 40 40 ASP C C 13 176.240 . . 1 . . 377 . A 40 ASP C . 30505 1
398 . 1 1 40 40 ASP CA C 13 54.526 0.019 . 1 . . 375 . A 40 ASP CA . 30505 1
399 . 1 1 40 40 ASP CB C 13 41.312 0.098 . 1 . . 376 . A 40 ASP CB . 30505 1
400 . 1 1 40 40 ASP N N 15 120.555 0.028 . 1 . . 79 . A 40 ASP N . 30505 1
401 . 1 1 41 41 VAL H H 1 8.053 0.002 . 1 . . 127 . A 41 VAL H . 30505 1
402 . 1 1 41 41 VAL HA H 1 4.083 0.005 . 1 . . 663 . A 41 VAL HA . 30505 1
403 . 1 1 41 41 VAL HB H 1 2.064 0.003 . 1 . . 664 . A 41 VAL HB . 30505 1
404 . 1 1 41 41 VAL HG11 H 1 0.905 0.003 . 2 . . 665 . A 41 VAL HG11 . 30505 1
405 . 1 1 41 41 VAL HG12 H 1 0.905 0.003 . 2 . . 665 . A 41 VAL HG12 . 30505 1
406 . 1 1 41 41 VAL HG13 H 1 0.905 0.003 . 2 . . 665 . A 41 VAL HG13 . 30505 1
407 . 1 1 41 41 VAL HG21 H 1 0.898 0.007 . 2 . . 666 . A 41 VAL HG21 . 30505 1
408 . 1 1 41 41 VAL HG22 H 1 0.898 0.007 . 2 . . 666 . A 41 VAL HG22 . 30505 1
409 . 1 1 41 41 VAL HG23 H 1 0.898 0.007 . 2 . . 666 . A 41 VAL HG23 . 30505 1
410 . 1 1 41 41 VAL C C 13 176.082 0.016 . 1 . . 387 . A 41 VAL C . 30505 1
411 . 1 1 41 41 VAL CA C 13 62.459 0.033 . 1 . . 380 . A 41 VAL CA . 30505 1
412 . 1 1 41 41 VAL CB C 13 32.708 0.024 . 1 . . 385 . A 41 VAL CB . 30505 1
413 . 1 1 41 41 VAL CG1 C 13 20.447 0.047 . 2 . . 661 . A 41 VAL CG1 . 30505 1
414 . 1 1 41 41 VAL CG2 C 13 21.323 0.0 . 2 . . 662 . A 41 VAL CG2 . 30505 1
415 . 1 1 41 41 VAL N N 15 119.841 0.036 . 1 . . 128 . A 41 VAL N . 30505 1
416 . 1 1 42 42 LEU H H 1 8.283 0.004 . 1 . . 109 . A 42 LEU H . 30505 1
417 . 1 1 42 42 LEU HA H 1 4.343 0.006 . 1 . . 778 . A 42 LEU HA . 30505 1
418 . 1 1 42 42 LEU HB2 H 1 1.608 0.015 . 2 . . 779 . A 42 LEU HB2 . 30505 1
419 . 1 1 42 42 LEU HB3 H 1 1.561 0.005 . 2 . . 780 . A 42 LEU HB3 . 30505 1
420 . 1 1 42 42 LEU HG H 1 1.584 0.007 . 1 . . 781 . A 42 LEU HG . 30505 1
421 . 1 1 42 42 LEU HD11 H 1 0.840 0.004 . 2 . . 782 . A 42 LEU HD11 . 30505 1
422 . 1 1 42 42 LEU HD12 H 1 0.840 0.004 . 2 . . 782 . A 42 LEU HD12 . 30505 1
423 . 1 1 42 42 LEU HD13 H 1 0.840 0.004 . 2 . . 782 . A 42 LEU HD13 . 30505 1
424 . 1 1 42 42 LEU HD21 H 1 0.839 0.002 . 2 . . 783 . A 42 LEU HD21 . 30505 1
425 . 1 1 42 42 LEU HD22 H 1 0.839 0.002 . 2 . . 783 . A 42 LEU HD22 . 30505 1
426 . 1 1 42 42 LEU HD23 H 1 0.839 0.002 . 2 . . 783 . A 42 LEU HD23 . 30505 1
427 . 1 1 42 42 LEU C C 13 176.879 0.034 . 1 . . 386 . A 42 LEU C . 30505 1
428 . 1 1 42 42 LEU CA C 13 55.170 0.046 . 1 . . 383 . A 42 LEU CA . 30505 1
429 . 1 1 42 42 LEU CB C 13 42.359 0.048 . 1 . . 384 . A 42 LEU CB . 30505 1
430 . 1 1 42 42 LEU CG C 13 26.996 0.058 . 1 . . 775 . A 42 LEU CG . 30505 1
431 . 1 1 42 42 LEU CD1 C 13 24.903 0.017 . 2 . . 776 . A 42 LEU CD1 . 30505 1
432 . 1 1 42 42 LEU CD2 C 13 23.503 0.006 . 2 . . 777 . A 42 LEU CD2 . 30505 1
433 . 1 1 42 42 LEU N N 15 125.346 0.073 . 1 . . 110 . A 42 LEU N . 30505 1
434 . 1 1 43 43 ASP H H 1 8.247 0.002 . 1 . . 15 . A 43 ASP H . 30505 1
435 . 1 1 43 43 ASP HA H 1 4.583 0.009 . 1 . . 460 . A 43 ASP HA . 30505 1
436 . 1 1 43 43 ASP HB2 H 1 2.608 0.006 . 2 . . 458 . A 43 ASP HB2 . 30505 1
437 . 1 1 43 43 ASP HB3 H 1 2.669 0.013 . 2 . . 459 . A 43 ASP HB3 . 30505 1
438 . 1 1 43 43 ASP C C 13 175.790 0.034 . 1 . . 389 . A 43 ASP C . 30505 1
439 . 1 1 43 43 ASP CA C 13 54.515 0.026 . 1 . . 388 . A 43 ASP CA . 30505 1
440 . 1 1 43 43 ASP CB C 13 41.151 0.046 . 1 . . 390 . A 43 ASP CB . 30505 1
441 . 1 1 43 43 ASP N N 15 120.852 0.024 . 1 . . 16 . A 43 ASP N . 30505 1
442 . 1 1 44 44 GLN H H 1 8.054 0.005 . 1 . . 382 . A 44 GLN H . 30505 1
443 . 1 1 44 44 GLN HA H 1 4.576 0.004 . 1 . . 502 . A 44 GLN HA . 30505 1
444 . 1 1 44 44 GLN HB2 H 1 1.938 0.008 . 2 . . 503 . A 44 GLN HB2 . 30505 1
445 . 1 1 44 44 GLN HB3 H 1 1.892 0.007 . 2 . . 506 . A 44 GLN HB3 . 30505 1
446 . 1 1 44 44 GLN HG2 H 1 2.200 0.006 . 2 . . 504 . A 44 GLN HG2 . 30505 1
447 . 1 1 44 44 GLN HG3 H 1 2.292 0.003 . 2 . . 505 . A 44 GLN HG3 . 30505 1
448 . 1 1 44 44 GLN HE21 H 1 7.493 0.008 . 1 . . 428 . A 44 GLN HE21 . 30505 1
449 . 1 1 44 44 GLN HE22 H 1 6.854 0.002 . 1 . . 507 . A 44 GLN HE22 . 30505 1
450 . 1 1 44 44 GLN C C 13 175.186 0.02 . 1 . . 391 . A 44 GLN C . 30505 1
451 . 1 1 44 44 GLN CA C 13 55.418 0.036 . 1 . . 392 . A 44 GLN CA . 30505 1
452 . 1 1 44 44 GLN CB C 13 30.550 0.053 . 1 . . 393 . A 44 GLN CB . 30505 1
453 . 1 1 44 44 GLN CG C 13 33.967 0.059 . 1 . . 501 . A 44 GLN CG . 30505 1
454 . 1 1 44 44 GLN N N 15 119.827 0.035 . 1 . . 381 . A 44 GLN N . 30505 1
455 . 1 1 44 44 GLN NE2 N 15 111.926 0.039 . 1 . . 429 . A 44 GLN NE2 . 30505 1
456 . 1 1 45 45 VAL H H 1 8.328 0.003 . 1 . . 86 . A 45 VAL H . 30505 1
457 . 1 1 45 45 VAL HA H 1 4.147 0.004 . 1 . . 668 . A 45 VAL HA . 30505 1
458 . 1 1 45 45 VAL HB H 1 2.144 0.004 . 1 . . 667 . A 45 VAL HB . 30505 1
459 . 1 1 45 45 VAL HG11 H 1 0.953 0.007 . 2 . . 669 . A 45 VAL HG11 . 30505 1
460 . 1 1 45 45 VAL HG12 H 1 0.953 0.007 . 2 . . 669 . A 45 VAL HG12 . 30505 1
461 . 1 1 45 45 VAL HG13 H 1 0.953 0.007 . 2 . . 669 . A 45 VAL HG13 . 30505 1
462 . 1 1 45 45 VAL HG21 H 1 0.919 0.009 . 2 . . 670 . A 45 VAL HG21 . 30505 1
463 . 1 1 45 45 VAL HG22 H 1 0.919 0.009 . 2 . . 670 . A 45 VAL HG22 . 30505 1
464 . 1 1 45 45 VAL HG23 H 1 0.919 0.009 . 2 . . 670 . A 45 VAL HG23 . 30505 1
465 . 1 1 45 45 VAL C C 13 174.585 0.03 . 1 . . 396 . A 45 VAL C . 30505 1
466 . 1 1 45 45 VAL CA C 13 62.586 0.042 . 1 . . 394 . A 45 VAL CA . 30505 1
467 . 1 1 45 45 VAL CB C 13 32.836 0.031 . 1 . . 395 . A 45 VAL CB . 30505 1
468 . 1 1 45 45 VAL CG1 C 13 20.887 0.026 . 2 . . 671 . A 45 VAL CG1 . 30505 1
469 . 1 1 45 45 VAL CG2 C 13 21.409 . . 2 . . 672 . A 45 VAL CG2 . 30505 1
470 . 1 1 45 45 VAL N N 15 123.170 0.071 . 1 . . 87 . A 45 VAL N . 30505 1
471 . 1 1 46 46 ALA H H 1 8.667 0.006 . 1 . . 141 . A 46 ALA H . 30505 1
472 . 1 1 46 46 ALA HA H 1 5.623 0.006 . 1 . . 431 . A 46 ALA HA . 30505 1
473 . 1 1 46 46 ALA HB1 H 1 1.215 0.005 . 1 . . 430 . A 46 ALA HB1 . 30505 1
474 . 1 1 46 46 ALA HB2 H 1 1.215 0.005 . 1 . . 430 . A 46 ALA HB2 . 30505 1
475 . 1 1 46 46 ALA HB3 H 1 1.215 0.005 . 1 . . 430 . A 46 ALA HB3 . 30505 1
476 . 1 1 46 46 ALA C C 13 176.920 0.042 . 1 . . 358 . A 46 ALA C . 30505 1
477 . 1 1 46 46 ALA CA C 13 50.355 0.04 . 1 . . 356 . A 46 ALA CA . 30505 1
478 . 1 1 46 46 ALA CB C 13 21.041 0.043 . 1 . . 357 . A 46 ALA CB . 30505 1
479 . 1 1 46 46 ALA N N 15 133.641 0.086 . 1 . . 142 . A 46 ALA N . 30505 1
480 . 1 1 47 47 ILE H H 1 9.180 0.006 . 1 . . 143 . A 47 ILE H . 30505 1
481 . 1 1 47 47 ILE HA H 1 5.337 0.005 . 1 . . 687 . A 47 ILE HA . 30505 1
482 . 1 1 47 47 ILE HB H 1 2.149 0.005 . 1 . . 688 . A 47 ILE HB . 30505 1
483 . 1 1 47 47 ILE HG12 H 1 1.237 0.011 . 2 . . 691 . A 47 ILE HG12 . 30505 1
484 . 1 1 47 47 ILE HG13 H 1 1.141 0.017 . 2 . . 692 . A 47 ILE HG13 . 30505 1
485 . 1 1 47 47 ILE HG21 H 1 0.757 0.005 . 1 . . 689 . A 47 ILE HG21 . 30505 1
486 . 1 1 47 47 ILE HG22 H 1 0.757 0.005 . 1 . . 689 . A 47 ILE HG22 . 30505 1
487 . 1 1 47 47 ILE HG23 H 1 0.757 0.005 . 1 . . 689 . A 47 ILE HG23 . 30505 1
488 . 1 1 47 47 ILE HD11 H 1 0.627 0.005 . 1 . . 690 . A 47 ILE HD11 . 30505 1
489 . 1 1 47 47 ILE HD12 H 1 0.627 0.005 . 1 . . 690 . A 47 ILE HD12 . 30505 1
490 . 1 1 47 47 ILE HD13 H 1 0.627 0.005 . 1 . . 690 . A 47 ILE HD13 . 30505 1
491 . 1 1 47 47 ILE C C 13 174.525 0.05 . 1 . . 359 . A 47 ILE C . 30505 1
492 . 1 1 47 47 ILE CA C 13 59.356 0.037 . 1 . . 355 . A 47 ILE CA . 30505 1
493 . 1 1 47 47 ILE CB C 13 41.736 0.02 . 1 . . 354 . A 47 ILE CB . 30505 1
494 . 1 1 47 47 ILE CG1 C 13 23.779 0.048 . 1 . . 693 . A 47 ILE CG1 . 30505 1
495 . 1 1 47 47 ILE CG2 C 13 17.678 0.031 . 1 . . 686 . A 47 ILE CG2 . 30505 1
496 . 1 1 47 47 ILE CD1 C 13 15.516 0.031 . 1 . . 685 . A 47 ILE CD1 . 30505 1
497 . 1 1 47 47 ILE N N 15 116.796 0.042 . 1 . . 144 . A 47 ILE N . 30505 1
498 . 1 1 48 48 GLN H H 1 8.096 0.014 . 1 . . 158 . A 48 GLN H . 30505 1
499 . 1 1 48 48 GLN HA H 1 4.565 0.007 . 1 . . 509 . A 48 GLN HA . 30505 1
500 . 1 1 48 48 GLN HB2 H 1 1.965 0.003 . 2 . . 511 . A 48 GLN HB2 . 30505 1
501 . 1 1 48 48 GLN HB3 H 1 2.203 0.003 . 2 . . 512 . A 48 GLN HB3 . 30505 1
502 . 1 1 48 48 GLN HG2 H 1 2.375 0.013 . 2 . . 510 . A 48 GLN HG2 . 30505 1
503 . 1 1 48 48 GLN HG3 H 1 2.416 0.011 . 2 . . 513 . A 48 GLN HG3 . 30505 1
504 . 1 1 48 48 GLN HE21 H 1 7.516 0.002 . 1 . . 23 . A 48 GLN HE21 . 30505 1
505 . 1 1 48 48 GLN HE22 H 1 6.916 0.003 . 1 . . 514 . A 48 GLN HE22 . 30505 1
506 . 1 1 48 48 GLN C C 13 175.922 0.004 . 1 . . 360 . A 48 GLN C . 30505 1
507 . 1 1 48 48 GLN CA C 13 56.626 0.027 . 1 . . 362 . A 48 GLN CA . 30505 1
508 . 1 1 48 48 GLN CB C 13 30.658 0.049 . 1 . . 361 . A 48 GLN CB . 30505 1
509 . 1 1 48 48 GLN CG C 13 34.816 0.061 . 1 . . 508 . A 48 GLN CG . 30505 1
510 . 1 1 48 48 GLN N N 15 120.016 0.033 . 1 . . 159 . A 48 GLN N . 30505 1
511 . 1 1 48 48 GLN NE2 N 15 112.367 0.048 . 1 . . 24 . A 48 GLN NE2 . 30505 1
512 . 1 1 49 49 CYS H H 1 8.694 0.004 . 1 . . 100 . A 49 CYS H . 30505 1
513 . 1 1 49 49 CYS HA H 1 5.274 0.003 . 1 . . 478 . A 49 CYS HA . 30505 1
514 . 1 1 49 49 CYS HB2 H 1 3.130 0.005 . 2 . . 479 . A 49 CYS HB2 . 30505 1
515 . 1 1 49 49 CYS HB3 H 1 3.006 0.006 . 2 . . 480 . A 49 CYS HB3 . 30505 1
516 . 1 1 49 49 CYS C C 13 172.861 0.045 . 1 . . 363 . A 49 CYS C . 30505 1
517 . 1 1 49 49 CYS CA C 13 56.748 0.047 . 1 . . 365 . A 49 CYS CA . 30505 1
518 . 1 1 49 49 CYS CB C 13 47.681 0.035 . 1 . . 364 . A 49 CYS CB . 30505 1
519 . 1 1 49 49 CYS N N 15 125.477 0.066 . 1 . . 101 . A 49 CYS N . 30505 1
520 . 1 1 50 50 THR H H 1 8.656 0.005 . 1 . . 149 . A 50 THR H . 30505 1
521 . 1 1 50 50 THR HA H 1 4.501 0.006 . 1 . . 639 . A 50 THR HA . 30505 1
522 . 1 1 50 50 THR HB H 1 4.250 0.003 . 1 . . 638 . A 50 THR HB . 30505 1
523 . 1 1 50 50 THR HG21 H 1 1.242 0.006 . 1 . . 637 . A 50 THR HG21 . 30505 1
524 . 1 1 50 50 THR HG22 H 1 1.242 0.006 . 1 . . 637 . A 50 THR HG22 . 30505 1
525 . 1 1 50 50 THR HG23 H 1 1.242 0.006 . 1 . . 637 . A 50 THR HG23 . 30505 1
526 . 1 1 50 50 THR C C 13 174.259 0.027 . 1 . . 368 . A 50 THR C . 30505 1
527 . 1 1 50 50 THR CA C 13 61.223 0.03 . 1 . . 366 . A 50 THR CA . 30505 1
528 . 1 1 50 50 THR CB C 13 71.210 0.033 . 1 . . 367 . A 50 THR CB . 30505 1
529 . 1 1 50 50 THR CG2 C 13 21.774 0.056 . 1 . . 636 . A 50 THR CG2 . 30505 1
530 . 1 1 50 50 THR N N 15 111.443 0.041 . 1 . . 150 . A 50 THR N . 30505 1
531 . 1 1 51 51 GLN H H 1 8.443 0.007 . 1 . . 49 . A 51 GLN H . 30505 1
532 . 1 1 51 51 GLN HA H 1 4.289 0.008 . 1 . . 516 . A 51 GLN HA . 30505 1
533 . 1 1 51 51 GLN HB2 H 1 2.004 0.004 . 1 . . 517 . A 51 GLN HB2 . 30505 1
534 . 1 1 51 51 GLN HG2 H 1 2.385 0.003 . 1 . . 518 . A 51 GLN HG2 . 30505 1
535 . 1 1 51 51 GLN HE21 H 1 7.693 0.006 . 1 . . 33 . A 51 GLN HE21 . 30505 1
536 . 1 1 51 51 GLN HE22 H 1 6.913 0.006 . 1 . . 519 . A 51 GLN HE22 . 30505 1
537 . 1 1 51 51 GLN C C 13 175.722 0.037 . 1 . . 369 . A 51 GLN C . 30505 1
538 . 1 1 51 51 GLN CA C 13 56.421 0.039 . 1 . . 370 . A 51 GLN CA . 30505 1
539 . 1 1 51 51 GLN CB C 13 29.670 0.025 . 1 . . 371 . A 51 GLN CB . 30505 1
540 . 1 1 51 51 GLN CG C 13 33.993 0.047 . 1 . . 515 . A 51 GLN CG . 30505 1
541 . 1 1 51 51 GLN N N 15 121.519 0.067 . 1 . . 50 . A 51 GLN N . 30505 1
542 . 1 1 51 51 GLN NE2 N 15 112.314 0.055 . 1 . . 34 . A 51 GLN NE2 . 30505 1
543 . 1 1 52 52 ILE H H 1 8.245 0.003 . 1 . . 139 . A 52 ILE H . 30505 1
544 . 1 1 52 52 ILE HA H 1 4.219 0.006 . 1 . . 703 . A 52 ILE HA . 30505 1
545 . 1 1 52 52 ILE HB H 1 1.603 0.004 . 1 . . 704 . A 52 ILE HB . 30505 1
546 . 1 1 52 52 ILE HG12 H 1 0.998 0.005 . 2 . . 708 . A 52 ILE HG12 . 30505 1
547 . 1 1 52 52 ILE HG13 H 1 1.323 0.003 . 2 . . 709 . A 52 ILE HG13 . 30505 1
548 . 1 1 52 52 ILE HG21 H 1 0.781 0.004 . 1 . . 707 . A 52 ILE HG21 . 30505 1
549 . 1 1 52 52 ILE HG22 H 1 0.781 0.004 . 1 . . 707 . A 52 ILE HG22 . 30505 1
550 . 1 1 52 52 ILE HG23 H 1 0.781 0.004 . 1 . . 707 . A 52 ILE HG23 . 30505 1
551 . 1 1 52 52 ILE HD11 H 1 0.696 0.007 . 1 . . 710 . A 52 ILE HD11 . 30505 1
552 . 1 1 52 52 ILE HD12 H 1 0.696 0.007 . 1 . . 710 . A 52 ILE HD12 . 30505 1
553 . 1 1 52 52 ILE HD13 H 1 0.696 0.007 . 1 . . 710 . A 52 ILE HD13 . 30505 1
554 . 1 1 52 52 ILE C C 13 175.690 . . 1 . . 372 . A 52 ILE C . 30505 1
555 . 1 1 52 52 ILE CA C 13 58.827 0.025 . 1 . . 373 . A 52 ILE CA . 30505 1
556 . 1 1 52 52 ILE CB C 13 38.840 0.054 . 1 . . 374 . A 52 ILE CB . 30505 1
557 . 1 1 52 52 ILE CG1 C 13 27.056 0.052 . 1 . . 706 . A 52 ILE CG1 . 30505 1
558 . 1 1 52 52 ILE CG2 C 13 17.411 0.014 . 1 . . 711 . A 52 ILE CG2 . 30505 1
559 . 1 1 52 52 ILE CD1 C 13 13.516 0.043 . 1 . . 705 . A 52 ILE CD1 . 30505 1
560 . 1 1 52 52 ILE N N 15 124.653 0.065 . 1 . . 140 . A 52 ILE N . 30505 1
561 . 1 1 53 53 PRO HA H 1 4.212 0.004 . 1 . . 572 . A 53 PRO HA . 30505 1
562 . 1 1 53 53 PRO HB2 H 1 1.709 0.006 . 2 . . 573 . A 53 PRO HB2 . 30505 1
563 . 1 1 53 53 PRO HB3 H 1 1.945 0.004 . 2 . . 574 . A 53 PRO HB3 . 30505 1
564 . 1 1 53 53 PRO HG2 H 1 1.462 0.009 . 2 . . 575 . A 53 PRO HG2 . 30505 1
565 . 1 1 53 53 PRO HG3 H 1 1.637 0.004 . 2 . . 576 . A 53 PRO HG3 . 30505 1
566 . 1 1 53 53 PRO HD2 H 1 3.052 0.012 . 1 . . 604 . A 53 PRO HD2 . 30505 1
567 . 1 1 53 53 PRO C C 13 176.102 . . 1 . . 426 . A 53 PRO C . 30505 1
568 . 1 1 53 53 PRO CA C 13 62.914 0.036 . 1 . . 427 . A 53 PRO CA . 30505 1
569 . 1 1 53 53 PRO CB C 13 31.907 0.066 . 1 . . 423 . A 53 PRO CB . 30505 1
570 . 1 1 53 53 PRO CG C 13 27.238 0.053 . 1 . . 571 . A 53 PRO CG . 30505 1
571 . 1 1 53 53 PRO CD C 13 50.490 0.05 . 1 . . 570 . A 53 PRO CD . 30505 1
572 . 1 1 54 54 LEU H H 1 8.167 0.007 . 1 . . 424 . A 54 LEU H . 30505 1
573 . 1 1 54 54 LEU HA H 1 4.235 0.004 . 1 . . 786 . A 54 LEU HA . 30505 1
574 . 1 1 54 54 LEU HB2 H 1 1.541 0.007 . 1 . . 788 . A 54 LEU HB2 . 30505 1
575 . 1 1 54 54 LEU HG H 1 1.555 0.016 . 1 . . 793 . A 54 LEU HG . 30505 1
576 . 1 1 54 54 LEU HD11 H 1 0.830 0.006 . 2 . . 787 . A 54 LEU HD11 . 30505 1
577 . 1 1 54 54 LEU HD12 H 1 0.830 0.006 . 2 . . 787 . A 54 LEU HD12 . 30505 1
578 . 1 1 54 54 LEU HD13 H 1 0.830 0.006 . 2 . . 787 . A 54 LEU HD13 . 30505 1
579 . 1 1 54 54 LEU HD21 H 1 0.815 0.016 . 2 . . 914 . A 54 LEU HD21 . 30505 1
580 . 1 1 54 54 LEU HD22 H 1 0.815 0.016 . 2 . . 914 . A 54 LEU HD22 . 30505 1
581 . 1 1 54 54 LEU HD23 H 1 0.815 0.016 . 2 . . 914 . A 54 LEU HD23 . 30505 1
582 . 1 1 54 54 LEU C C 13 177.024 0.036 . 1 . . 414 . A 54 LEU C . 30505 1
583 . 1 1 54 54 LEU CA C 13 55.172 0.015 . 1 . . 415 . A 54 LEU CA . 30505 1
584 . 1 1 54 54 LEU CB C 13 42.336 0.05 . 1 . . 416 . A 54 LEU CB . 30505 1
585 . 1 1 54 54 LEU CG C 13 26.972 0.043 . 1 . . 784 . A 54 LEU CG . 30505 1
586 . 1 1 54 54 LEU CD1 C 13 24.790 0.032 . 2 . . 785 . A 54 LEU CD1 . 30505 1
587 . 1 1 54 54 LEU CD2 C 13 23.630 0.007 . 2 . . 915 . A 54 LEU CD2 . 30505 1
588 . 1 1 54 54 LEU N N 15 121.450 0.032 . 1 . . 425 . A 54 LEU N . 30505 1
589 . 1 1 55 55 LEU H H 1 7.630 0.004 . 1 . . 76 . A 55 LEU H . 30505 1
590 . 1 1 55 55 LEU HA H 1 4.387 0.004 . 1 . . 792 . A 55 LEU HA . 30505 1
591 . 1 1 55 55 LEU HB2 H 1 1.543 0.004 . 1 . . 791 . A 55 LEU HB2 . 30505 1
592 . 1 1 55 55 LEU HG H 1 1.539 0.003 . 1 . . 916 . A 55 LEU HG . 30505 1
593 . 1 1 55 55 LEU HD11 H 1 0.865 0.005 . 2 . . 794 . A 55 LEU HD11 . 30505 1
594 . 1 1 55 55 LEU HD12 H 1 0.865 0.005 . 2 . . 794 . A 55 LEU HD12 . 30505 1
595 . 1 1 55 55 LEU HD13 H 1 0.865 0.005 . 2 . . 794 . A 55 LEU HD13 . 30505 1
596 . 1 1 55 55 LEU HD21 H 1 0.851 0.011 . 2 . . 795 . A 55 LEU HD21 . 30505 1
597 . 1 1 55 55 LEU HD22 H 1 0.851 0.011 . 2 . . 795 . A 55 LEU HD22 . 30505 1
598 . 1 1 55 55 LEU HD23 H 1 0.851 0.011 . 2 . . 795 . A 55 LEU HD23 . 30505 1
599 . 1 1 55 55 LEU C C 13 176.265 0.013 . 1 . . 349 . A 55 LEU C . 30505 1
600 . 1 1 55 55 LEU CA C 13 54.464 0.081 . 1 . . 347 . A 55 LEU CA . 30505 1
601 . 1 1 55 55 LEU CB C 13 43.018 0.057 . 1 . . 348 . A 55 LEU CB . 30505 1
602 . 1 1 55 55 LEU CG C 13 26.942 0.044 . 1 . . 789 . A 55 LEU CG . 30505 1
603 . 1 1 55 55 LEU CD1 C 13 25.247 0.02 . 2 . . 790 . A 55 LEU CD1 . 30505 1
604 . 1 1 55 55 LEU CD2 C 13 23.322 0.009 . 2 . . 796 . A 55 LEU CD2 . 30505 1
605 . 1 1 55 55 LEU N N 15 121.261 0.031 . 1 . . 77 . A 55 LEU N . 30505 1
606 . 1 1 56 56 ILE H H 1 7.917 0.002 . 1 . . 133 . A 56 ILE H . 30505 1
607 . 1 1 56 56 ILE HA H 1 4.154 0.003 . 1 . . 697 . A 56 ILE HA . 30505 1
608 . 1 1 56 56 ILE HB H 1 1.824 0.006 . 1 . . 698 . A 56 ILE HB . 30505 1
609 . 1 1 56 56 ILE HG12 H 1 1.429 0.005 . 2 . . 699 . A 56 ILE HG12 . 30505 1
610 . 1 1 56 56 ILE HG13 H 1 1.153 0.005 . 2 . . 700 . A 56 ILE HG13 . 30505 1
611 . 1 1 56 56 ILE HG21 H 1 0.868 0.011 . 1 . . 701 . A 56 ILE HG21 . 30505 1
612 . 1 1 56 56 ILE HG22 H 1 0.868 0.011 . 1 . . 701 . A 56 ILE HG22 . 30505 1
613 . 1 1 56 56 ILE HG23 H 1 0.868 0.011 . 1 . . 701 . A 56 ILE HG23 . 30505 1
614 . 1 1 56 56 ILE HD11 H 1 0.837 0.003 . 1 . . 702 . A 56 ILE HD11 . 30505 1
615 . 1 1 56 56 ILE HD12 H 1 0.837 0.003 . 1 . . 702 . A 56 ILE HD12 . 30505 1
616 . 1 1 56 56 ILE HD13 H 1 0.837 0.003 . 1 . . 702 . A 56 ILE HD13 . 30505 1
617 . 1 1 56 56 ILE C C 13 176.625 0.026 . 1 . . 346 . A 56 ILE C . 30505 1
618 . 1 1 56 56 ILE CA C 13 61.141 0.027 . 1 . . 344 . A 56 ILE CA . 30505 1
619 . 1 1 56 56 ILE CB C 13 38.897 0.033 . 1 . . 345 . A 56 ILE CB . 30505 1
620 . 1 1 56 56 ILE CG1 C 13 27.304 0.032 . 1 . . 694 . A 56 ILE CG1 . 30505 1
621 . 1 1 56 56 ILE CG2 C 13 17.508 0.035 . 1 . . 695 . A 56 ILE CG2 . 30505 1
622 . 1 1 56 56 ILE CD1 C 13 13.028 0.033 . 1 . . 696 . A 56 ILE CD1 . 30505 1
623 . 1 1 56 56 ILE N N 15 119.788 0.057 . 1 . . 134 . A 56 ILE N . 30505 1
624 . 1 1 57 57 GLY H H 1 8.560 0.002 . 1 . . 1 . A 57 GLY H . 30505 1
625 . 1 1 57 57 GLY HA2 H 1 3.883 0.003 . 2 . . 561 . A 57 GLY HA2 . 30505 1
626 . 1 1 57 57 GLY HA3 H 1 3.947 0.006 . 2 . . 562 . A 57 GLY HA3 . 30505 1
627 . 1 1 57 57 GLY C C 13 173.974 0.021 . 1 . . 343 . A 57 GLY C . 30505 1
628 . 1 1 57 57 GLY CA C 13 45.818 0.047 . 1 . . 342 . A 57 GLY CA . 30505 1
629 . 1 1 57 57 GLY N N 15 112.922 0.024 . 1 . . 17 . A 57 GLY N . 30505 1
630 . 1 1 58 58 ILE H H 1 7.746 0.011 . 1 . . 13 . A 58 ILE H . 30505 1
631 . 1 1 58 58 ILE HA H 1 4.299 0.006 . 1 . . 715 . A 58 ILE HA . 30505 1
632 . 1 1 58 58 ILE HB H 1 1.911 0.005 . 1 . . 716 . A 58 ILE HB . 30505 1
633 . 1 1 58 58 ILE HG12 H 1 1.364 0.003 . 2 . . 717 . A 58 ILE HG12 . 30505 1
634 . 1 1 58 58 ILE HG13 H 1 1.136 0.005 . 2 . . 718 . A 58 ILE HG13 . 30505 1
635 . 1 1 58 58 ILE HG21 H 1 0.936 0.007 . 1 . . 719 . A 58 ILE HG21 . 30505 1
636 . 1 1 58 58 ILE HG22 H 1 0.936 0.007 . 1 . . 719 . A 58 ILE HG22 . 30505 1
637 . 1 1 58 58 ILE HG23 H 1 0.936 0.007 . 1 . . 719 . A 58 ILE HG23 . 30505 1
638 . 1 1 58 58 ILE HD11 H 1 0.770 0.004 . 1 . . 720 . A 58 ILE HD11 . 30505 1
639 . 1 1 58 58 ILE HD12 H 1 0.770 0.004 . 1 . . 720 . A 58 ILE HD12 . 30505 1
640 . 1 1 58 58 ILE HD13 H 1 0.770 0.004 . 1 . . 720 . A 58 ILE HD13 . 30505 1
641 . 1 1 58 58 ILE C C 13 174.916 0.015 . 1 . . 340 . A 58 ILE C . 30505 1
642 . 1 1 58 58 ILE CA C 13 59.771 0.025 . 1 . . 339 . A 58 ILE CA . 30505 1
643 . 1 1 58 58 ILE CB C 13 38.942 0.024 . 1 . . 338 . A 58 ILE CB . 30505 1
644 . 1 1 58 58 ILE CG1 C 13 26.867 0.021 . 1 . . 714 . A 58 ILE CG1 . 30505 1
645 . 1 1 58 58 ILE CG2 C 13 18.251 0.053 . 1 . . 712 . A 58 ILE CG2 . 30505 1
646 . 1 1 58 58 ILE CD1 C 13 12.486 0.015 . 1 . . 713 . A 58 ILE CD1 . 30505 1
647 . 1 1 58 58 ILE N N 15 119.681 0.06 . 1 . . 14 . A 58 ILE N . 30505 1
648 . 1 1 59 59 ALA H H 1 8.743 0.006 . 1 . . 51 . A 59 ALA H . 30505 1
649 . 1 1 59 59 ALA HA H 1 4.627 0.004 . 1 . . 433 . A 59 ALA HA . 30505 1
650 . 1 1 59 59 ALA HB1 H 1 1.551 0.004 . 1 . . 432 . A 59 ALA HB1 . 30505 1
651 . 1 1 59 59 ALA HB2 H 1 1.551 0.004 . 1 . . 432 . A 59 ALA HB2 . 30505 1
652 . 1 1 59 59 ALA HB3 H 1 1.551 0.004 . 1 . . 432 . A 59 ALA HB3 . 30505 1
653 . 1 1 59 59 ALA C C 13 178.832 . . 1 . . 341 . A 59 ALA C . 30505 1
654 . 1 1 59 59 ALA CA C 13 51.557 0.041 . 1 . . 337 . A 59 ALA CA . 30505 1
655 . 1 1 59 59 ALA CB C 13 19.094 0.03 . 1 . . 336 . A 59 ALA CB . 30505 1
656 . 1 1 59 59 ALA N N 15 128.280 0.033 . 1 . . 52 . A 59 ALA N . 30505 1
657 . 1 1 60 60 ILE H H 1 9.119 0.013 . 1 . . 909 . A 60 ILE H . 30505 1
658 . 1 1 60 60 ILE HA H 1 3.799 0.005 . 1 . . 721 . A 60 ILE HA . 30505 1
659 . 1 1 60 60 ILE HB H 1 1.615 0.004 . 1 . . 722 . A 60 ILE HB . 30505 1
660 . 1 1 60 60 ILE HG12 H 1 0.661 0.01 . 1 . . 727 . A 60 ILE HG12 . 30505 1
661 . 1 1 60 60 ILE HG21 H 1 0.861 0.007 . 1 . . 726 . A 60 ILE HG21 . 30505 1
662 . 1 1 60 60 ILE HG22 H 1 0.861 0.007 . 1 . . 726 . A 60 ILE HG22 . 30505 1
663 . 1 1 60 60 ILE HG23 H 1 0.861 0.007 . 1 . . 726 . A 60 ILE HG23 . 30505 1
664 . 1 1 60 60 ILE HD11 H 1 0.185 0.013 . 1 . . 728 . A 60 ILE HD11 . 30505 1
665 . 1 1 60 60 ILE HD12 H 1 0.185 0.013 . 1 . . 728 . A 60 ILE HD12 . 30505 1
666 . 1 1 60 60 ILE HD13 H 1 0.185 0.013 . 1 . . 728 . A 60 ILE HD13 . 30505 1
667 . 1 1 60 60 ILE C C 13 176.169 . . 1 . . 419 . A 60 ILE C . 30505 1
668 . 1 1 60 60 ILE CA C 13 64.031 0.049 . 1 . . 417 . A 60 ILE CA . 30505 1
669 . 1 1 60 60 ILE CB C 13 38.291 0.065 . 1 . . 418 . A 60 ILE CB . 30505 1
670 . 1 1 60 60 ILE CG1 C 13 29.316 0.056 . 1 . . 723 . A 60 ILE CG1 . 30505 1
671 . 1 1 60 60 ILE CG2 C 13 16.426 0.044 . 1 . . 724 . A 60 ILE CG2 . 30505 1
672 . 1 1 60 60 ILE CD1 C 13 13.707 0.052 . 1 . . 725 . A 60 ILE CD1 . 30505 1
673 . 1 1 61 61 GLU H H 1 9.725 0.006 . 1 . . 37 . A 61 GLU H . 30505 1
674 . 1 1 61 61 GLU HA H 1 3.843 0.004 . 1 . . 531 . A 61 GLU HA . 30505 1
675 . 1 1 61 61 GLU HB2 H 1 1.873 0.011 . 2 . . 532 . A 61 GLU HB2 . 30505 1
676 . 1 1 61 61 GLU HB3 H 1 2.036 0.005 . 2 . . 533 . A 61 GLU HB3 . 30505 1
677 . 1 1 61 61 GLU HG2 H 1 2.533 0.005 . 2 . . 534 . A 61 GLU HG2 . 30505 1
678 . 1 1 61 61 GLU HG3 H 1 2.065 0.012 . 2 . . 920 . A 61 GLU HG3 . 30505 1
679 . 1 1 61 61 GLU C C 13 177.038 . . 1 . . 234 . A 61 GLU C . 30505 1
680 . 1 1 61 61 GLU CA C 13 60.034 0.055 . 1 . . 233 . A 61 GLU CA . 30505 1
681 . 1 1 61 61 GLU CB C 13 28.627 0.038 . 1 . . 232 . A 61 GLU CB . 30505 1
682 . 1 1 61 61 GLU CG C 13 37.259 0.036 . 1 . . 530 . A 61 GLU CG . 30505 1
683 . 1 1 61 61 GLU N N 15 120.702 0.025 . 1 . . 38 . A 61 GLU N . 30505 1
684 . 1 1 62 62 ASP H H 1 7.361 0.006 . 1 . . 96 . A 62 ASP H . 30505 1
685 . 1 1 62 62 ASP HA H 1 4.705 0.007 . 1 . . 465 . A 62 ASP HA . 30505 1
686 . 1 1 62 62 ASP HB2 H 1 2.785 0.007 . 1 . . 464 . A 62 ASP HB2 . 30505 1
687 . 1 1 62 62 ASP C C 13 176.776 0.018 . 1 . . 231 . A 62 ASP C . 30505 1
688 . 1 1 62 62 ASP CA C 13 55.443 0.067 . 1 . . 230 . A 62 ASP CA . 30505 1
689 . 1 1 62 62 ASP CB C 13 41.974 0.04 . 1 . . 229 . A 62 ASP CB . 30505 1
690 . 1 1 62 62 ASP N N 15 115.647 0.032 . 1 . . 97 . A 62 ASP N . 30505 1
691 . 1 1 63 63 GLU H H 1 7.535 0.007 . 1 . . 125 . A 63 GLU H . 30505 1
692 . 1 1 63 63 GLU HA H 1 4.492 0.003 . 1 . . 536 . A 63 GLU HA . 30505 1
693 . 1 1 63 63 GLU HB2 H 1 1.927 0.003 . 2 . . 537 . A 63 GLU HB2 . 30505 1
694 . 1 1 63 63 GLU HB3 H 1 2.186 0.005 . 2 . . 538 . A 63 GLU HB3 . 30505 1
695 . 1 1 63 63 GLU HG2 H 1 2.320 0.018 . 2 . . 539 . A 63 GLU HG2 . 30505 1
696 . 1 1 63 63 GLU HG3 H 1 2.374 0.005 . 2 . . 540 . A 63 GLU HG3 . 30505 1
697 . 1 1 63 63 GLU C C 13 176.341 0.017 . 1 . . 226 . A 63 GLU C . 30505 1
698 . 1 1 63 63 GLU CA C 13 56.577 0.051 . 1 . . 228 . A 63 GLU CA . 30505 1
699 . 1 1 63 63 GLU CB C 13 31.852 0.037 . 1 . . 227 . A 63 GLU CB . 30505 1
700 . 1 1 63 63 GLU CG C 13 35.731 0.057 . 1 . . 535 . A 63 GLU CG . 30505 1
701 . 1 1 63 63 GLU N N 15 116.925 0.032 . 1 . . 126 . A 63 GLU N . 30505 1
702 . 1 1 64 64 CYS H H 1 8.029 0.009 . 1 . . 154 . A 64 CYS H . 30505 1
703 . 1 1 64 64 CYS HA H 1 4.736 0.006 . 1 . . 483 . A 64 CYS HA . 30505 1
704 . 1 1 64 64 CYS HB2 H 1 2.587 0.005 . 2 . . 481 . A 64 CYS HB2 . 30505 1
705 . 1 1 64 64 CYS HB3 H 1 2.842 0.005 . 2 . . 482 . A 64 CYS HB3 . 30505 1
706 . 1 1 64 64 CYS C C 13 174.501 0.035 . 1 . . 223 . A 64 CYS C . 30505 1
707 . 1 1 64 64 CYS CA C 13 54.940 0.049 . 1 . . 225 . A 64 CYS CA . 30505 1
708 . 1 1 64 64 CYS CB C 13 38.139 0.043 . 1 . . 224 . A 64 CYS CB . 30505 1
709 . 1 1 64 64 CYS N N 15 116.417 0.018 . 1 . . 155 . A 64 CYS N . 30505 1
710 . 1 1 65 65 LYS H H 1 9.176 0.012 . 1 . . 18 . A 65 LYS H . 30505 1
711 . 1 1 65 65 LYS HA H 1 4.484 0.003 . 1 . . 857 . A 65 LYS HA . 30505 1
712 . 1 1 65 65 LYS HB2 H 1 2.041 0.006 . 2 . . 859 . A 65 LYS HB2 . 30505 1
713 . 1 1 65 65 LYS HB3 H 1 1.696 0.009 . 2 . . 860 . A 65 LYS HB3 . 30505 1
714 . 1 1 65 65 LYS HG2 H 1 1.485 0.011 . 2 . . 861 . A 65 LYS HG2 . 30505 1
715 . 1 1 65 65 LYS HG3 H 1 1.541 0.006 . 2 . . 862 . A 65 LYS HG3 . 30505 1
716 . 1 1 65 65 LYS HD2 H 1 1.619 0.006 . 1 . . 863 . A 65 LYS HD2 . 30505 1
717 . 1 1 65 65 LYS HE2 H 1 3.025 0.005 . 1 . . 858 . A 65 LYS HE2 . 30505 1
718 . 1 1 65 65 LYS C C 13 176.339 0.02 . 1 . . 222 . A 65 LYS C . 30505 1
719 . 1 1 65 65 LYS CA C 13 55.855 0.036 . 1 . . 221 . A 65 LYS CA . 30505 1
720 . 1 1 65 65 LYS CB C 13 31.597 0.049 . 1 . . 220 . A 65 LYS CB . 30505 1
721 . 1 1 65 65 LYS CG C 13 24.682 0.016 . 1 . . 856 . A 65 LYS CG . 30505 1
722 . 1 1 65 65 LYS CD C 13 28.229 0.043 . 1 . . 855 . A 65 LYS CD . 30505 1
723 . 1 1 65 65 LYS CE C 13 42.438 0.018 . 1 . . 854 . A 65 LYS CE . 30505 1
724 . 1 1 65 65 LYS N N 15 128.480 0.079 . 1 . . 19 . A 65 LYS N . 30505 1
725 . 1 1 66 66 ASN H H 1 7.028 0.007 . 1 . . 45 . A 66 ASN H . 30505 1
726 . 1 1 66 66 ASN HA H 1 5.002 0.004 . 1 . . 446 . A 66 ASN HA . 30505 1
727 . 1 1 66 66 ASN HB2 H 1 2.898 0.004 . 2 . . 447 . A 66 ASN HB2 . 30505 1
728 . 1 1 66 66 ASN HB3 H 1 2.217 0.004 . 2 . . 448 . A 66 ASN HB3 . 30505 1
729 . 1 1 66 66 ASN HD21 H 1 7.468 0.017 . 1 . . 75 . A 66 ASN HD21 . 30505 1
730 . 1 1 66 66 ASN HD22 H 1 6.911 0.003 . 1 . . 135 . A 66 ASN HD22 . 30505 1
731 . 1 1 66 66 ASN C C 13 172.699 0.012 . 1 . . 216 . A 66 ASN C . 30505 1
732 . 1 1 66 66 ASN CA C 13 52.761 0.028 . 1 . . 215 . A 66 ASN CA . 30505 1
733 . 1 1 66 66 ASN CB C 13 39.170 0.02 . 1 . . 214 . A 66 ASN CB . 30505 1
734 . 1 1 66 66 ASN N N 15 119.490 0.028 . 1 . . 46 . A 66 ASN N . 30505 1
735 . 1 1 66 66 ASN ND2 N 15 111.883 0.038 . 1 . . 136 . A 66 ASN ND2 . 30505 1
736 . 1 1 67 67 THR H H 1 8.541 0.003 . 1 . . 80 . A 67 THR H . 30505 1
737 . 1 1 67 67 THR HA H 1 4.831 0.007 . 1 . . 642 . A 67 THR HA . 30505 1
738 . 1 1 67 67 THR HB H 1 4.118 0.005 . 1 . . 640 . A 67 THR HB . 30505 1
739 . 1 1 67 67 THR HG21 H 1 1.141 0.005 . 1 . . 641 . A 67 THR HG21 . 30505 1
740 . 1 1 67 67 THR HG22 H 1 1.141 0.005 . 1 . . 641 . A 67 THR HG22 . 30505 1
741 . 1 1 67 67 THR HG23 H 1 1.141 0.005 . 1 . . 641 . A 67 THR HG23 . 30505 1
742 . 1 1 67 67 THR C C 13 172.328 . . 1 . . 217 . A 67 THR C . 30505 1
743 . 1 1 67 67 THR CA C 13 60.465 0.03 . 1 . . 218 . A 67 THR CA . 30505 1
744 . 1 1 67 67 THR CB C 13 70.777 0.029 . 1 . . 219 . A 67 THR CB . 30505 1
745 . 1 1 67 67 THR CG2 C 13 21.233 0.062 . 1 . . 643 . A 67 THR CG2 . 30505 1
746 . 1 1 67 67 THR N N 15 120.118 0.047 . 1 . . 81 . A 67 THR N . 30505 1
747 . 1 1 68 68 PRO HA H 1 4.587 0.006 . 1 . . 579 . A 68 PRO HA . 30505 1
748 . 1 1 68 68 PRO HB2 H 1 1.905 0.011 . 2 . . 580 . A 68 PRO HB2 . 30505 1
749 . 1 1 68 68 PRO HB3 H 1 1.837 0.007 . 2 . . 581 . A 68 PRO HB3 . 30505 1
750 . 1 1 68 68 PRO HG2 H 1 1.615 0.007 . 2 . . 582 . A 68 PRO HG2 . 30505 1
751 . 1 1 68 68 PRO HG3 H 1 2.189 0.006 . 2 . . 583 . A 68 PRO HG3 . 30505 1
752 . 1 1 68 68 PRO HD2 H 1 3.854 0.006 . 2 . . 584 . A 68 PRO HD2 . 30505 1
753 . 1 1 68 68 PRO HD3 H 1 3.935 0.006 . 2 . . 585 . A 68 PRO HD3 . 30505 1
754 . 1 1 68 68 PRO C C 13 175.926 0.026 . 1 . . 256 . A 68 PRO C . 30505 1
755 . 1 1 68 68 PRO CA C 13 62.826 0.053 . 1 . . 254 . A 68 PRO CA . 30505 1
756 . 1 1 68 68 PRO CB C 13 31.679 0.026 . 1 . . 255 . A 68 PRO CB . 30505 1
757 . 1 1 68 68 PRO CG C 13 28.207 0.056 . 1 . . 577 . A 68 PRO CG . 30505 1
758 . 1 1 68 68 PRO CD C 13 51.403 0.054 . 1 . . 578 . A 68 PRO CD . 30505 1
759 . 1 1 69 69 THR H H 1 9.182 0.007 . 1 . . 92 . A 69 THR H . 30505 1
760 . 1 1 69 69 THR HA H 1 4.942 0.007 . 1 . . 647 . A 69 THR HA . 30505 1
761 . 1 1 69 69 THR HB H 1 3.563 0.003 . 1 . . 646 . A 69 THR HB . 30505 1
762 . 1 1 69 69 THR HG21 H 1 0.746 0.004 . 1 . . 645 . A 69 THR HG21 . 30505 1
763 . 1 1 69 69 THR HG22 H 1 0.746 0.004 . 1 . . 645 . A 69 THR HG22 . 30505 1
764 . 1 1 69 69 THR HG23 H 1 0.746 0.004 . 1 . . 645 . A 69 THR HG23 . 30505 1
765 . 1 1 69 69 THR C C 13 171.339 0.022 . 1 . . 253 . A 69 THR C . 30505 1
766 . 1 1 69 69 THR CA C 13 60.152 0.022 . 1 . . 251 . A 69 THR CA . 30505 1
767 . 1 1 69 69 THR CB C 13 72.139 0.018 . 1 . . 252 . A 69 THR CB . 30505 1
768 . 1 1 69 69 THR CG2 C 13 21.693 0.038 . 1 . . 644 . A 69 THR CG2 . 30505 1
769 . 1 1 69 69 THR N N 15 118.321 0.063 . 1 . . 93 . A 69 THR N . 30505 1
770 . 1 1 70 70 CYS H H 1 8.727 0.007 . 1 . . 11 . A 70 CYS H . 30505 1
771 . 1 1 70 70 CYS HA H 1 5.216 0.004 . 1 . . 484 . A 70 CYS HA . 30505 1
772 . 1 1 70 70 CYS HB2 H 1 3.002 0.004 . 2 . . 485 . A 70 CYS HB2 . 30505 1
773 . 1 1 70 70 CYS HB3 H 1 2.668 0.005 . 2 . . 486 . A 70 CYS HB3 . 30505 1
774 . 1 1 70 70 CYS C C 13 175.232 0.031 . 1 . . 250 . A 70 CYS C . 30505 1
775 . 1 1 70 70 CYS CA C 13 53.301 0.023 . 1 . . 249 . A 70 CYS CA . 30505 1
776 . 1 1 70 70 CYS CB C 13 38.367 0.043 . 1 . . 244 . A 70 CYS CB . 30505 1
777 . 1 1 70 70 CYS N N 15 119.384 0.022 . 1 . . 12 . A 70 CYS N . 30505 1
778 . 1 1 71 71 CYS H H 1 9.578 0.003 . 1 . . 43 . A 71 CYS H . 30505 1
779 . 1 1 71 71 CYS HA H 1 5.125 0.004 . 1 . . 487 . A 71 CYS HA . 30505 1
780 . 1 1 71 71 CYS HB2 H 1 3.391 0.003 . 2 . . 488 . A 71 CYS HB2 . 30505 1
781 . 1 1 71 71 CYS HB3 H 1 2.518 0.006 . 2 . . 489 . A 71 CYS HB3 . 30505 1
782 . 1 1 71 71 CYS C C 13 174.010 0.023 . 1 . . 237 . A 71 CYS C . 30505 1
783 . 1 1 71 71 CYS CA C 13 55.696 0.029 . 1 . . 236 . A 71 CYS CA . 30505 1
784 . 1 1 71 71 CYS CB C 13 45.356 0.03 . 1 . . 235 . A 71 CYS CB . 30505 1
785 . 1 1 71 71 CYS N N 15 127.482 0.083 . 1 . . 44 . A 71 CYS N . 30505 1
786 . 1 1 72 72 GLU H H 1 8.205 0.009 . 1 . . 53 . A 72 GLU H . 30505 1
787 . 1 1 72 72 GLU HA H 1 4.121 0.008 . 1 . . 542 . A 72 GLU HA . 30505 1
788 . 1 1 72 72 GLU HB2 H 1 2.089 0.002 . 1 . . 544 . A 72 GLU HB2 . 30505 1
789 . 1 1 72 72 GLU HG2 H 1 2.672 0.004 . 2 . . 543 . A 72 GLU HG2 . 30505 1
790 . 1 1 72 72 GLU HG3 H 1 2.311 0.004 . 2 . . 545 . A 72 GLU HG3 . 30505 1
791 . 1 1 72 72 GLU C C 13 176.975 0.041 . 1 . . 240 . A 72 GLU C . 30505 1
792 . 1 1 72 72 GLU CA C 13 59.388 0.038 . 1 . . 239 . A 72 GLU CA . 30505 1
793 . 1 1 72 72 GLU CB C 13 30.707 0.037 . 1 . . 238 . A 72 GLU CB . 30505 1
794 . 1 1 72 72 GLU CG C 13 36.719 0.04 . 1 . . 541 . A 72 GLU CG . 30505 1
795 . 1 1 72 72 GLU N N 15 124.459 0.023 . 1 . . 54 . A 72 GLU N . 30505 1
796 . 1 1 73 73 ASP H H 1 8.026 0.006 . 1 . . 88 . A 73 ASP H . 30505 1
797 . 1 1 73 73 ASP HA H 1 4.720 0.007 . 1 . . 468 . A 73 ASP HA . 30505 1
798 . 1 1 73 73 ASP HB2 H 1 2.385 0.004 . 2 . . 466 . A 73 ASP HB2 . 30505 1
799 . 1 1 73 73 ASP HB3 H 1 2.578 0.007 . 2 . . 467 . A 73 ASP HB3 . 30505 1
800 . 1 1 73 73 ASP C C 13 173.613 0.029 . 1 . . 243 . A 73 ASP C . 30505 1
801 . 1 1 73 73 ASP CA C 13 52.926 0.05 . 1 . . 242 . A 73 ASP CA . 30505 1
802 . 1 1 73 73 ASP CB C 13 44.396 0.03 . 1 . . 241 . A 73 ASP CB . 30505 1
803 . 1 1 73 73 ASP N N 15 113.007 0.037 . 1 . . 89 . A 73 ASP N . 30505 1
804 . 1 1 74 74 VAL H H 1 8.712 0.005 . 1 . . 115 . A 74 VAL H . 30505 1
805 . 1 1 74 74 VAL HA H 1 4.981 0.006 . 1 . . 675 . A 74 VAL HA . 30505 1
806 . 1 1 74 74 VAL HB H 1 1.891 0.003 . 1 . . 676 . A 74 VAL HB . 30505 1
807 . 1 1 74 74 VAL HG11 H 1 0.839 0.003 . 2 . . 677 . A 74 VAL HG11 . 30505 1
808 . 1 1 74 74 VAL HG12 H 1 0.839 0.003 . 2 . . 677 . A 74 VAL HG12 . 30505 1
809 . 1 1 74 74 VAL HG13 H 1 0.839 0.003 . 2 . . 677 . A 74 VAL HG13 . 30505 1
810 . 1 1 74 74 VAL HG21 H 1 0.774 0.005 . 2 . . 678 . A 74 VAL HG21 . 30505 1
811 . 1 1 74 74 VAL HG22 H 1 0.774 0.005 . 2 . . 678 . A 74 VAL HG22 . 30505 1
812 . 1 1 74 74 VAL HG23 H 1 0.774 0.005 . 2 . . 678 . A 74 VAL HG23 . 30505 1
813 . 1 1 74 74 VAL C C 13 175.081 0.003 . 1 . . 247 . A 74 VAL C . 30505 1
814 . 1 1 74 74 VAL CA C 13 60.664 0.042 . 1 . . 246 . A 74 VAL CA . 30505 1
815 . 1 1 74 74 VAL CB C 13 35.649 0.033 . 1 . . 245 . A 74 VAL CB . 30505 1
816 . 1 1 74 74 VAL CG1 C 13 21.504 0.012 . 2 . . 674 . A 74 VAL CG1 . 30505 1
817 . 1 1 74 74 VAL CG2 C 13 20.415 0.022 . 2 . . 673 . A 74 VAL CG2 . 30505 1
818 . 1 1 74 74 VAL N N 15 117.065 0.051 . 1 . . 116 . A 74 VAL N . 30505 1
819 . 1 1 75 75 GLU H H 1 9.370 0.005 . 1 . . 82 . A 75 GLU H . 30505 1
820 . 1 1 75 75 GLU HA H 1 4.656 0.016 . 1 . . 547 . A 75 GLU HA . 30505 1
821 . 1 1 75 75 GLU HB2 H 1 2.074 0.007 . 1 . . 548 . A 75 GLU HB2 . 30505 1
822 . 1 1 75 75 GLU HG2 H 1 2.076 0.006 . 2 . . 906 . A 75 GLU HG2 . 30505 1
823 . 1 1 75 75 GLU HG3 H 1 2.168 0.003 . 2 . . 907 . A 75 GLU HG3 . 30505 1
824 . 1 1 75 75 GLU C C 13 176.181 0.009 . 1 . . 248 . A 75 GLU C . 30505 1
825 . 1 1 75 75 GLU CA C 13 54.622 0.085 . 1 . . 398 . A 75 GLU CA . 30505 1
826 . 1 1 75 75 GLU CB C 13 32.916 0.06 . 1 . . 401 . A 75 GLU CB . 30505 1
827 . 1 1 75 75 GLU CG C 13 36.052 0.057 . 1 . . 546 . A 75 GLU CG . 30505 1
828 . 1 1 75 75 GLU N N 15 124.295 0.02 . 1 . . 83 . A 75 GLU N . 30505 1
829 . 1 1 76 76 ASP H H 1 8.889 0.003 . 1 . . 61 . A 76 ASP H . 30505 1
830 . 1 1 76 76 ASP HA H 1 4.250 0.003 . 1 . . 471 . A 76 ASP HA . 30505 1
831 . 1 1 76 76 ASP HB2 H 1 2.523 0.008 . 2 . . 469 . A 76 ASP HB2 . 30505 1
832 . 1 1 76 76 ASP HB3 H 1 2.873 0.005 . 2 . . 470 . A 76 ASP HB3 . 30505 1
833 . 1 1 76 76 ASP C C 13 176.505 0.024 . 1 . . 397 . A 76 ASP C . 30505 1
834 . 1 1 76 76 ASP CA C 13 55.669 0.061 . 1 . . 399 . A 76 ASP CA . 30505 1
835 . 1 1 76 76 ASP CB C 13 39.607 0.044 . 1 . . 402 . A 76 ASP CB . 30505 1
836 . 1 1 76 76 ASP N N 15 120.556 0.044 . 1 . . 62 . A 76 ASP N . 30505 1
837 . 1 1 77 77 ASP H H 1 8.596 0.002 . 1 . . 113 . A 77 ASP H . 30505 1
838 . 1 1 77 77 ASP HA H 1 4.254 0.01 . 1 . . 473 . A 77 ASP HA . 30505 1
839 . 1 1 77 77 ASP HB2 H 1 2.655 0.004 . 2 . . 472 . A 77 ASP HB2 . 30505 1
840 . 1 1 77 77 ASP HB3 H 1 2.923 0.006 . 2 . . 474 . A 77 ASP HB3 . 30505 1
841 . 1 1 77 77 ASP CA C 13 55.256 0.08 . 1 . . 400 . A 77 ASP CA . 30505 1
842 . 1 1 77 77 ASP CB C 13 39.793 0.034 . 1 . . 403 . A 77 ASP CB . 30505 1
843 . 1 1 77 77 ASP N N 15 115.370 0.046 . 1 . . 114 . A 77 ASP N . 30505 1
844 . 1 1 78 78 GLY H H 1 7.552 0.002 . 1 . . 908 . A 78 GLY H . 30505 1
845 . 1 1 78 78 GLY HA2 H 1 4.317 0.008 . 2 . . 563 . A 78 GLY HA2 . 30505 1
846 . 1 1 78 78 GLY HA3 H 1 3.388 0.003 . 2 . . 564 . A 78 GLY HA3 . 30505 1
847 . 1 1 78 78 GLY C C 13 173.412 . . 1 . . 289 . A 78 GLY C . 30505 1
848 . 1 1 78 78 GLY CA C 13 44.836 0.03 . 1 . . 288 . A 78 GLY CA . 30505 1
849 . 1 1 79 79 LEU H H 1 7.368 0.014 . 1 . . 131 . A 79 LEU H . 30505 1
850 . 1 1 79 79 LEU HA H 1 4.347 0.005 . 1 . . 800 . A 79 LEU HA . 30505 1
851 . 1 1 79 79 LEU HB2 H 1 1.677 0.008 . 2 . . 801 . A 79 LEU HB2 . 30505 1
852 . 1 1 79 79 LEU HB3 H 1 1.881 0.004 . 2 . . 802 . A 79 LEU HB3 . 30505 1
853 . 1 1 79 79 LEU HG H 1 1.701 0.012 . 1 . . 803 . A 79 LEU HG . 30505 1
854 . 1 1 79 79 LEU HD11 H 1 0.952 0.004 . 2 . . 804 . A 79 LEU HD11 . 30505 1
855 . 1 1 79 79 LEU HD12 H 1 0.952 0.004 . 2 . . 804 . A 79 LEU HD12 . 30505 1
856 . 1 1 79 79 LEU HD13 H 1 0.952 0.004 . 2 . . 804 . A 79 LEU HD13 . 30505 1
857 . 1 1 79 79 LEU HD21 H 1 0.869 0.007 . 2 . . 805 . A 79 LEU HD21 . 30505 1
858 . 1 1 79 79 LEU HD22 H 1 0.869 0.007 . 2 . . 805 . A 79 LEU HD22 . 30505 1
859 . 1 1 79 79 LEU HD23 H 1 0.869 0.007 . 2 . . 805 . A 79 LEU HD23 . 30505 1
860 . 1 1 79 79 LEU C C 13 177.310 . . 1 . . 287 . A 79 LEU C . 30505 1
861 . 1 1 79 79 LEU CA C 13 55.963 0.065 . 1 . . 286 . A 79 LEU CA . 30505 1
862 . 1 1 79 79 LEU CB C 13 42.034 0.042 . 1 . . 285 . A 79 LEU CB . 30505 1
863 . 1 1 79 79 LEU CG C 13 27.101 0.07 . 1 . . 799 . A 79 LEU CG . 30505 1
864 . 1 1 79 79 LEU CD1 C 13 25.361 0.057 . 2 . . 798 . A 79 LEU CD1 . 30505 1
865 . 1 1 79 79 LEU CD2 C 13 23.032 0.033 . 2 . . 797 . A 79 LEU CD2 . 30505 1
866 . 1 1 79 79 LEU N N 15 116.925 0.025 . 1 . . 132 . A 79 LEU N . 30505 1
867 . 1 1 80 80 VAL H H 1 7.674 0.006 . 1 . . 117 . A 80 VAL H . 30505 1
868 . 1 1 80 80 VAL HA H 1 4.721 0.004 . 1 . . 679 . A 80 VAL HA . 30505 1
869 . 1 1 80 80 VAL HB H 1 1.660 0.01 . 1 . . 682 . A 80 VAL HB . 30505 1
870 . 1 1 80 80 VAL HG11 H 1 0.877 0.006 . 2 . . 680 . A 80 VAL HG11 . 30505 1
871 . 1 1 80 80 VAL HG12 H 1 0.877 0.006 . 2 . . 680 . A 80 VAL HG12 . 30505 1
872 . 1 1 80 80 VAL HG13 H 1 0.877 0.006 . 2 . . 680 . A 80 VAL HG13 . 30505 1
873 . 1 1 80 80 VAL HG21 H 1 0.763 0.004 . 2 . . 681 . A 80 VAL HG21 . 30505 1
874 . 1 1 80 80 VAL HG22 H 1 0.763 0.004 . 2 . . 681 . A 80 VAL HG22 . 30505 1
875 . 1 1 80 80 VAL HG23 H 1 0.763 0.004 . 2 . . 681 . A 80 VAL HG23 . 30505 1
876 . 1 1 80 80 VAL C C 13 174.398 0.051 . 1 . . 282 . A 80 VAL C . 30505 1
877 . 1 1 80 80 VAL CA C 13 61.202 0.041 . 1 . . 283 . A 80 VAL CA . 30505 1
878 . 1 1 80 80 VAL CB C 13 34.852 0.035 . 1 . . 284 . A 80 VAL CB . 30505 1
879 . 1 1 80 80 VAL CG1 C 13 21.854 0.021 . 2 . . 684 . A 80 VAL CG1 . 30505 1
880 . 1 1 80 80 VAL CG2 C 13 21.756 0.011 . 2 . . 683 . A 80 VAL CG2 . 30505 1
881 . 1 1 80 80 VAL N N 15 119.984 0.112 . 1 . . 118 . A 80 VAL N . 30505 1
882 . 1 1 81 81 GLY H H 1 9.253 0.004 . 1 . . 111 . A 81 GLY H . 30505 1
883 . 1 1 81 81 GLY HA2 H 1 3.646 0.014 . 2 . . 565 . A 81 GLY HA2 . 30505 1
884 . 1 1 81 81 GLY HA3 H 1 4.495 0.005 . 2 . . 566 . A 81 GLY HA3 . 30505 1
885 . 1 1 81 81 GLY C C 13 171.984 0.045 . 1 . . 281 . A 81 GLY C . 30505 1
886 . 1 1 81 81 GLY CA C 13 45.241 0.023 . 1 . . 278 . A 81 GLY CA . 30505 1
887 . 1 1 81 81 GLY N N 15 117.067 0.055 . 1 . . 112 . A 81 GLY N . 30505 1
888 . 1 1 82 82 ILE H H 1 8.531 0.01 . 1 . . 270 . A 82 ILE H . 30505 1
889 . 1 1 82 82 ILE HA H 1 4.447 0.004 . 1 . . 732 . A 82 ILE HA . 30505 1
890 . 1 1 82 82 ILE HB H 1 1.640 0.004 . 1 . . 733 . A 82 ILE HB . 30505 1
891 . 1 1 82 82 ILE HG12 H 1 1.273 0.006 . 2 . . 734 . A 82 ILE HG12 . 30505 1
892 . 1 1 82 82 ILE HG13 H 1 1.040 0.006 . 2 . . 735 . A 82 ILE HG13 . 30505 1
893 . 1 1 82 82 ILE HG21 H 1 0.736 0.004 . 1 . . 736 . A 82 ILE HG21 . 30505 1
894 . 1 1 82 82 ILE HG22 H 1 0.736 0.004 . 1 . . 736 . A 82 ILE HG22 . 30505 1
895 . 1 1 82 82 ILE HG23 H 1 0.736 0.004 . 1 . . 736 . A 82 ILE HG23 . 30505 1
896 . 1 1 82 82 ILE HD11 H 1 0.599 0.007 . 1 . . 737 . A 82 ILE HD11 . 30505 1
897 . 1 1 82 82 ILE HD12 H 1 0.599 0.007 . 1 . . 737 . A 82 ILE HD12 . 30505 1
898 . 1 1 82 82 ILE HD13 H 1 0.599 0.007 . 1 . . 737 . A 82 ILE HD13 . 30505 1
899 . 1 1 82 82 ILE C C 13 174.772 0.029 . 1 . . 280 . A 82 ILE C . 30505 1
900 . 1 1 82 82 ILE CA C 13 59.174 0.024 . 1 . . 276 . A 82 ILE CA . 30505 1
901 . 1 1 82 82 ILE CB C 13 38.394 0.033 . 1 . . 277 . A 82 ILE CB . 30505 1
902 . 1 1 82 82 ILE CG1 C 13 26.979 0.032 . 1 . . 729 . A 82 ILE CG1 . 30505 1
903 . 1 1 82 82 ILE CG2 C 13 17.776 0.022 . 1 . . 730 . A 82 ILE CG2 . 30505 1
904 . 1 1 82 82 ILE CD1 C 13 11.920 0.069 . 1 . . 731 . A 82 ILE CD1 . 30505 1
905 . 1 1 82 82 ILE N N 15 124.272 0.045 . 1 . . 271 . A 82 ILE N . 30505 1
906 . 1 1 83 83 ASN H H 1 8.941 0.003 . 1 . . 272 . A 83 ASN H . 30505 1
907 . 1 1 83 83 ASN HA H 1 4.452 0.003 . 1 . . 449 . A 83 ASN HA . 30505 1
908 . 1 1 83 83 ASN HB2 H 1 2.979 0.012 . 2 . . 450 . A 83 ASN HB2 . 30505 1
909 . 1 1 83 83 ASN HB3 H 1 2.924 0.011 . 2 . . 451 . A 83 ASN HB3 . 30505 1
910 . 1 1 83 83 ASN HD21 H 1 7.775 0.003 . 1 . . 68 . A 83 ASN HD21 . 30505 1
911 . 1 1 83 83 ASN HD22 H 1 6.958 0.005 . 1 . . 74 . A 83 ASN HD22 . 30505 1
912 . 1 1 83 83 ASN C C 13 174.347 0.034 . 1 . . 279 . A 83 ASN C . 30505 1
913 . 1 1 83 83 ASN CA C 13 53.974 0.05 . 1 . . 274 . A 83 ASN CA . 30505 1
914 . 1 1 83 83 ASN CB C 13 36.112 0.023 . 1 . . 275 . A 83 ASN CB . 30505 1
915 . 1 1 83 83 ASN N N 15 124.872 0.031 . 1 . . 273 . A 83 ASN N . 30505 1
916 . 1 1 83 83 ASN ND2 N 15 112.013 0.05 . 1 . . 69 . A 83 ASN ND2 . 30505 1
917 . 1 1 84 84 CYS H H 1 9.303 0.01 . 1 . . 63 . A 84 CYS H . 30505 1
918 . 1 1 84 84 CYS HA H 1 5.250 0.005 . 1 . . 492 . A 84 CYS HA . 30505 1
919 . 1 1 84 84 CYS HB2 H 1 2.660 0.007 . 2 . . 490 . A 84 CYS HB2 . 30505 1
920 . 1 1 84 84 CYS HB3 H 1 2.838 0.004 . 2 . . 491 . A 84 CYS HB3 . 30505 1
921 . 1 1 84 84 CYS C C 13 174.987 0.019 . 1 . . 266 . A 84 CYS C . 30505 1
922 . 1 1 84 84 CYS CA C 13 56.283 0.034 . 1 . . 265 . A 84 CYS CA . 30505 1
923 . 1 1 84 84 CYS CB C 13 45.786 0.024 . 1 . . 264 . A 84 CYS CB . 30505 1
924 . 1 1 84 84 CYS N N 15 122.171 0.055 . 1 . . 64 . A 84 CYS N . 30505 1
925 . 1 1 85 85 THR H H 1 8.758 0.005 . 1 . . 20 . A 85 THR H . 30505 1
926 . 1 1 85 85 THR HA H 1 4.811 0.006 . 1 . . 650 . A 85 THR HA . 30505 1
927 . 1 1 85 85 THR HB H 1 4.046 0.004 . 1 . . 648 . A 85 THR HB . 30505 1
928 . 1 1 85 85 THR HG21 H 1 1.268 0.005 . 1 . . 649 . A 85 THR HG21 . 30505 1
929 . 1 1 85 85 THR HG22 H 1 1.268 0.005 . 1 . . 649 . A 85 THR HG22 . 30505 1
930 . 1 1 85 85 THR HG23 H 1 1.268 0.005 . 1 . . 649 . A 85 THR HG23 . 30505 1
931 . 1 1 85 85 THR C C 13 172.100 . . 1 . . 267 . A 85 THR C . 30505 1
932 . 1 1 85 85 THR CA C 13 59.143 0.052 . 1 . . 268 . A 85 THR CA . 30505 1
933 . 1 1 85 85 THR CB C 13 71.305 0.021 . 1 . . 269 . A 85 THR CB . 30505 1
934 . 1 1 85 85 THR CG2 C 13 21.033 0.05 . 1 . . 651 . A 85 THR CG2 . 30505 1
935 . 1 1 85 85 THR N N 15 119.671 0.051 . 1 . . 21 . A 85 THR N . 30505 1
936 . 1 1 86 86 PRO HA H 1 4.499 0.011 . 1 . . 588 . A 86 PRO HA . 30505 1
937 . 1 1 86 86 PRO HB2 H 1 1.831 0.004 . 2 . . 589 . A 86 PRO HB2 . 30505 1
938 . 1 1 86 86 PRO HB3 H 1 2.205 0.006 . 2 . . 590 . A 86 PRO HB3 . 30505 1
939 . 1 1 86 86 PRO HG2 H 1 1.739 0.005 . 2 . . 591 . A 86 PRO HG2 . 30505 1
940 . 1 1 86 86 PRO HG3 H 1 2.177 0.007 . 2 . . 592 . A 86 PRO HG3 . 30505 1
941 . 1 1 86 86 PRO HD2 H 1 3.729 0.006 . 2 . . 593 . A 86 PRO HD2 . 30505 1
942 . 1 1 86 86 PRO HD3 H 1 3.849 0.006 . 2 . . 594 . A 86 PRO HD3 . 30505 1
943 . 1 1 86 86 PRO C C 13 176.285 0.015 . 1 . . 353 . A 86 PRO C . 30505 1
944 . 1 1 86 86 PRO CA C 13 63.321 0.046 . 1 . . 351 . A 86 PRO CA . 30505 1
945 . 1 1 86 86 PRO CB C 13 32.296 0.053 . 1 . . 350 . A 86 PRO CB . 30505 1
946 . 1 1 86 86 PRO CG C 13 28.094 0.053 . 1 . . 586 . A 86 PRO CG . 30505 1
947 . 1 1 86 86 PRO CD C 13 51.586 0.049 . 1 . . 587 . A 86 PRO CD . 30505 1
948 . 1 1 87 87 ILE H H 1 7.785 0.015 . 1 . . 57 . A 87 ILE H . 30505 1
949 . 1 1 87 87 ILE HA H 1 4.418 0.003 . 1 . . 738 . A 87 ILE HA . 30505 1
950 . 1 1 87 87 ILE HB H 1 1.707 0.005 . 1 . . 745 . A 87 ILE HB . 30505 1
951 . 1 1 87 87 ILE HG12 H 1 0.825 0.006 . 2 . . 743 . A 87 ILE HG12 . 30505 1
952 . 1 1 87 87 ILE HG13 H 1 1.340 0.005 . 2 . . 744 . A 87 ILE HG13 . 30505 1
953 . 1 1 87 87 ILE HG21 H 1 0.818 0.006 . 1 . . 746 . A 87 ILE HG21 . 30505 1
954 . 1 1 87 87 ILE HG22 H 1 0.818 0.006 . 1 . . 746 . A 87 ILE HG22 . 30505 1
955 . 1 1 87 87 ILE HG23 H 1 0.818 0.006 . 1 . . 746 . A 87 ILE HG23 . 30505 1
956 . 1 1 87 87 ILE HD11 H 1 0.614 0.005 . 1 . . 742 . A 87 ILE HD11 . 30505 1
957 . 1 1 87 87 ILE HD12 H 1 0.614 0.005 . 1 . . 742 . A 87 ILE HD12 . 30505 1
958 . 1 1 87 87 ILE HD13 H 1 0.614 0.005 . 1 . . 742 . A 87 ILE HD13 . 30505 1
959 . 1 1 87 87 ILE C C 13 173.926 . . 1 . . 352 . A 87 ILE C . 30505 1
960 . 1 1 87 87 ILE CA C 13 59.327 0.054 . 1 . . 314 . A 87 ILE CA . 30505 1
961 . 1 1 87 87 ILE CB C 13 38.199 0.035 . 1 . . 315 . A 87 ILE CB . 30505 1
962 . 1 1 87 87 ILE CG1 C 13 26.968 0.052 . 1 . . 739 . A 87 ILE CG1 . 30505 1
963 . 1 1 87 87 ILE CG2 C 13 17.622 0.047 . 1 . . 740 . A 87 ILE CG2 . 30505 1
964 . 1 1 87 87 ILE CD1 C 13 13.904 0.045 . 1 . . 741 . A 87 ILE CD1 . 30505 1
965 . 1 1 87 87 ILE N N 15 122.214 0.035 . 1 . . 58 . A 87 ILE N . 30505 1
966 . 1 1 88 88 PRO HA H 1 4.410 0.003 . 1 . . 597 . A 88 PRO HA . 30505 1
967 . 1 1 88 88 PRO HB2 H 1 2.248 0.004 . 2 . . 598 . A 88 PRO HB2 . 30505 1
968 . 1 1 88 88 PRO HB3 H 1 1.939 0.008 . 2 . . 599 . A 88 PRO HB3 . 30505 1
969 . 1 1 88 88 PRO HG2 H 1 2.080 0.005 . 2 . . 600 . A 88 PRO HG2 . 30505 1
970 . 1 1 88 88 PRO HG3 H 1 1.972 0.009 . 2 . . 601 . A 88 PRO HG3 . 30505 1
971 . 1 1 88 88 PRO HD2 H 1 3.634 0.004 . 2 . . 602 . A 88 PRO HD2 . 30505 1
972 . 1 1 88 88 PRO HD3 H 1 3.844 0.005 . 2 . . 603 . A 88 PRO HD3 . 30505 1
973 . 1 1 88 88 PRO C C 13 176.241 . . 1 . . 335 . A 88 PRO C . 30505 1
974 . 1 1 88 88 PRO CA C 13 63.093 0.043 . 1 . . 333 . A 88 PRO CA . 30505 1
975 . 1 1 88 88 PRO CB C 13 31.922 0.032 . 1 . . 334 . A 88 PRO CB . 30505 1
976 . 1 1 88 88 PRO CG C 13 27.602 0.021 . 1 . . 595 . A 88 PRO CG . 30505 1
977 . 1 1 88 88 PRO CD C 13 50.871 0.041 . 1 . . 596 . A 88 PRO CD . 30505 1
978 . 1 1 89 89 LEU H H 1 8.284 0.008 . 1 . . 7 . A 89 LEU H . 30505 1
979 . 1 1 89 89 LEU HA H 1 4.395 0.005 . 1 . . 809 . A 89 LEU HA . 30505 1
980 . 1 1 89 89 LEU HB2 H 1 1.639 0.005 . 2 . . 812 . A 89 LEU HB2 . 30505 1
981 . 1 1 89 89 LEU HB3 H 1 1.603 0.01 . 2 . . 813 . A 89 LEU HB3 . 30505 1
982 . 1 1 89 89 LEU HG H 1 1.695 0.002 . 1 . . 814 . A 89 LEU HG . 30505 1
983 . 1 1 89 89 LEU HD11 H 1 0.927 0.006 . 2 . . 810 . A 89 LEU HD11 . 30505 1
984 . 1 1 89 89 LEU HD12 H 1 0.927 0.006 . 2 . . 810 . A 89 LEU HD12 . 30505 1
985 . 1 1 89 89 LEU HD13 H 1 0.927 0.006 . 2 . . 810 . A 89 LEU HD13 . 30505 1
986 . 1 1 89 89 LEU HD21 H 1 0.837 0.004 . 2 . . 811 . A 89 LEU HD21 . 30505 1
987 . 1 1 89 89 LEU HD22 H 1 0.837 0.004 . 2 . . 811 . A 89 LEU HD22 . 30505 1
988 . 1 1 89 89 LEU HD23 H 1 0.837 0.004 . 2 . . 811 . A 89 LEU HD23 . 30505 1
989 . 1 1 89 89 LEU C C 13 176.299 . . 1 . . 331 . A 89 LEU C . 30505 1
990 . 1 1 89 89 LEU CA C 13 54.878 0.068 . 1 . . 330 . A 89 LEU CA . 30505 1
991 . 1 1 89 89 LEU CB C 13 42.370 0.022 . 1 . . 329 . A 89 LEU CB . 30505 1
992 . 1 1 89 89 LEU CG C 13 26.975 0.081 . 1 . . 806 . A 89 LEU CG . 30505 1
993 . 1 1 89 89 LEU CD1 C 13 25.344 0.025 . 2 . . 807 . A 89 LEU CD1 . 30505 1
994 . 1 1 89 89 LEU CD2 C 13 23.338 0.036 . 2 . . 808 . A 89 LEU CD2 . 30505 1
995 . 1 1 89 89 LEU N N 15 122.721 0.035 . 1 . . 8 . A 89 LEU N . 30505 1
996 . 1 1 90 90 ILE H H 1 7.481 0.004 . 1 . . 137 . A 90 ILE H . 30505 1
997 . 1 1 90 90 ILE HA H 1 4.064 0.005 . 1 . . 747 . A 90 ILE HA . 30505 1
998 . 1 1 90 90 ILE HB H 1 1.796 0.003 . 1 . . 751 . A 90 ILE HB . 30505 1
999 . 1 1 90 90 ILE HG12 H 1 1.383 0.005 . 2 . . 752 . A 90 ILE HG12 . 30505 1
1000 . 1 1 90 90 ILE HG13 H 1 1.104 0.007 . 2 . . 753 . A 90 ILE HG13 . 30505 1
1001 . 1 1 90 90 ILE HG21 H 1 0.854 0.004 . 1 . . 754 . A 90 ILE HG21 . 30505 1
1002 . 1 1 90 90 ILE HG22 H 1 0.854 0.004 . 1 . . 754 . A 90 ILE HG22 . 30505 1
1003 . 1 1 90 90 ILE HG23 H 1 0.854 0.004 . 1 . . 754 . A 90 ILE HG23 . 30505 1
1004 . 1 1 90 90 ILE HD11 H 1 0.847 0.004 . 1 . . 755 . A 90 ILE HD11 . 30505 1
1005 . 1 1 90 90 ILE HD12 H 1 0.847 0.004 . 1 . . 755 . A 90 ILE HD12 . 30505 1
1006 . 1 1 90 90 ILE HD13 H 1 0.847 0.004 . 1 . . 755 . A 90 ILE HD13 . 30505 1
1007 . 1 1 90 90 ILE C C 13 172.575 . . 1 . . 332 . A 90 ILE C . 30505 1
1008 . 1 1 90 90 ILE CA C 13 62.516 0.023 . 1 . . 327 . A 90 ILE CA . 30505 1
1009 . 1 1 90 90 ILE CB C 13 40.126 0.043 . 1 . . 328 . A 90 ILE CB . 30505 1
1010 . 1 1 90 90 ILE CG1 C 13 27.286 0.036 . 1 . . 748 . A 90 ILE CG1 . 30505 1
1011 . 1 1 90 90 ILE CG2 C 13 18.023 0.066 . 1 . . 749 . A 90 ILE CG2 . 30505 1
1012 . 1 1 90 90 ILE CD1 C 13 13.712 0.023 . 1 . . 750 . A 90 ILE CD1 . 30505 1
1013 . 1 1 90 90 ILE N N 15 124.221 0.017 . 1 . . 138 . A 90 ILE N . 30505 1
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