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 53037
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name Assigned_chemical_shift_Mid2
_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' . . . 53037 1
2 '3D HNCACB' . . . 53037 1
3 '3D CBCACONH' . . . 53037 1
4 '3D H(CCO)NH' . . . 53037 1
5 '3D HNCO' . . . 53037 1
6 '3D HNHA' . . . 53037 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 53037 1
2 $software_2 . . 53037 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 2 2 HIS H H 1 7.824415821 0.001498998843 . . . . . . . 637 HIS H . 53037 1
2 . 1 . 1 2 2 HIS HA H 1 4.304107988 . . . . . . . . 637 HIS HA . 53037 1
3 . 1 . 1 2 2 HIS CA C 13 54.8704559 . . . . . . . . 637 HIS CA . 53037 1
4 . 1 . 1 2 2 HIS CB C 13 28.26430587 . . . . . . . . 637 HIS CB . 53037 1
5 . 1 . 1 2 2 HIS N N 15 125.7222039 0.008243885259 . . . . . . . 637 HIS N . 53037 1
6 . 1 . 1 6 6 ALA C C 13 175.4382672 . . . . . . . . 641 ALA C . 53037 1
7 . 1 . 1 6 6 ALA CA C 13 49.9037212 0.0262007778 . . . . . . . 641 ALA CA . 53037 1
8 . 1 . 1 6 6 ALA CB C 13 16.48621739 0.02943729818 . . . . . . . 641 ALA CB . 53037 1
9 . 1 . 1 7 7 GLY H H 1 8.265899146 0.003992156959 . . . . . . . 642 GLY H . 53037 1
10 . 1 . 1 7 7 GLY C C 13 171.2311903 . . . . . . . . 642 GLY C . 53037 1
11 . 1 . 1 7 7 GLY CA C 13 42.5897413 0.05226137887 . . . . . . . 642 GLY CA . 53037 1
12 . 1 . 1 7 7 GLY N N 15 108.0135634 0.04431765121 . . . . . . . 642 GLY N . 53037 1
13 . 1 . 1 8 8 ILE H H 1 7.776239106 0.001210230826 . . . . . . . 643 ILE H . 53037 1
14 . 1 . 1 8 8 ILE HA H 1 4.092905557 . . . . . . . . 643 ILE HA . 53037 1
15 . 1 . 1 8 8 ILE C C 13 173.2331887 . . . . . . . . 643 ILE C . 53037 1
16 . 1 . 1 8 8 ILE CA C 13 58.24896071 0.0288634843 . . . . . . . 643 ILE CA . 53037 1
17 . 1 . 1 8 8 ILE CB C 13 36.12283957 0.01894992406 . . . . . . . 643 ILE CB . 53037 1
18 . 1 . 1 8 8 ILE CG1 C 13 24.2969936 . . . . . . . . 643 ILE CG1 . 53037 1
19 . 1 . 1 8 8 ILE CG2 C 13 14.82975872 . . . . . . . . 643 ILE CG2 . 53037 1
20 . 1 . 1 8 8 ILE CD1 C 13 10.18608712 . . . . . . . . 643 ILE CD1 . 53037 1
21 . 1 . 1 8 8 ILE N N 15 119.8209124 0.01070420468 . . . . . . . 643 ILE N . 53037 1
22 . 1 . 1 9 9 LYS H H 1 8.291344379 0.0008720187968 . . . . . . . 644 LYS H . 53037 1
23 . 1 . 1 9 9 LYS HA H 1 4.283666293 . . . . . . . . 644 LYS HA . 53037 1
24 . 1 . 1 9 9 LYS C C 13 173.2450458 . . . . . . . . 644 LYS C . 53037 1
25 . 1 . 1 9 9 LYS CA C 13 53.33047754 0.02542183048 . . . . . . . 644 LYS CA . 53037 1
26 . 1 . 1 9 9 LYS CB C 13 30.45436953 0.03619223955 . . . . . . . 644 LYS CB . 53037 1
27 . 1 . 1 9 9 LYS CG C 13 22.05957033 . . . . . . . . 644 LYS CG . 53037 1
28 . 1 . 1 9 9 LYS CD C 13 26.27678578 . . . . . . . . 644 LYS CD . 53037 1
29 . 1 . 1 9 9 LYS CE C 13 39.47535721 . . . . . . . . 644 LYS CE . 53037 1
30 . 1 . 1 9 9 LYS N N 15 125.965918 0.03523289726 . . . . . . . 644 LYS N . 53037 1
31 . 1 . 1 10 10 ILE H H 1 8.158613892 0.000962295014 . . . . . . . 645 ILE H . 53037 1
32 . 1 . 1 10 10 ILE HA H 1 4.052813631 . . . . . . . . 645 ILE HA . 53037 1
33 . 1 . 1 10 10 ILE C C 13 173.1262397 . . . . . . . . 645 ILE C . 53037 1
34 . 1 . 1 10 10 ILE CA C 13 58.14099616 0.1189716127 . . . . . . . 645 ILE CA . 53037 1
35 . 1 . 1 10 10 ILE CB C 13 35.83688251 0.03027057854 . . . . . . . 645 ILE CB . 53037 1
36 . 1 . 1 10 10 ILE CG1 C 13 24.32964947 . . . . . . . . 645 ILE CG1 . 53037 1
37 . 1 . 1 10 10 ILE CG2 C 13 14.83124733 . . . . . . . . 645 ILE CG2 . 53037 1
38 . 1 . 1 10 10 ILE CD1 C 13 9.897415859 . . . . . . . . 645 ILE CD1 . 53037 1
39 . 1 . 1 10 10 ILE N N 15 123.6849778 0.0332545197 . . . . . . . 645 ILE N . 53037 1
40 . 1 . 1 11 11 LEU H H 1 8.246755856 0.0009529856565 . . . . . . . 646 LEU H . 53037 1
41 . 1 . 1 11 11 LEU HA H 1 4.307010493 . . . . . . . . 646 LEU HA . 53037 1
42 . 1 . 1 11 11 LEU C C 13 174.0267128 . . . . . . . . 646 LEU C . 53037 1
43 . 1 . 1 11 11 LEU CA C 13 52.06961455 0.03192652345 . . . . . . . 646 LEU CA . 53037 1
44 . 1 . 1 11 11 LEU CB C 13 39.66169354 0.0211334152 . . . . . . . 646 LEU CB . 53037 1
45 . 1 . 1 11 11 LEU CG C 13 24.24071569 . . . . . . . . 646 LEU CG . 53037 1
46 . 1 . 1 11 11 LEU CD1 C 13 22.06570539 . . . . . . . . 646 LEU CD1 . 53037 1
47 . 1 . 1 11 11 LEU CD2 C 13 20.79169748 . . . . . . . . 646 LEU CD2 . 53037 1
48 . 1 . 1 11 11 LEU N N 15 126.6967671 0.04128218715 . . . . . . . 646 LEU N . 53037 1
49 . 1 . 1 12 12 GLU H H 1 8.260968348 0.0005994629932 . . . . . . . 647 GLU H . 53037 1
50 . 1 . 1 12 12 GLU HA H 1 4.511527422 . . . . . . . . 647 GLU HA . 53037 1
51 . 1 . 1 12 12 GLU CA C 13 51.44529632 . . . . . . . . 647 GLU CA . 53037 1
52 . 1 . 1 12 12 GLU CB C 13 27.01782765 . . . . . . . . 647 GLU CB . 53037 1
53 . 1 . 1 12 12 GLU N N 15 123.226608 0.01254356782 . . . . . . . 647 GLU N . 53037 1
54 . 1 . 1 13 13 PRO C C 13 174.3152208 . . . . . . . . 648 PRO C . 53037 1
55 . 1 . 1 13 13 PRO CA C 13 60.49221033 0.01955439803 . . . . . . . 648 PRO CA . 53037 1
56 . 1 . 1 13 13 PRO CB C 13 29.40686127 0.02439896372 . . . . . . . 648 PRO CB . 53037 1
57 . 1 . 1 13 13 PRO CG C 13 24.72951575 . . . . . . . . 648 PRO CG . 53037 1
58 . 1 . 1 14 14 GLU H H 1 8.484242628 0.00106887148 . . . . . . . 649 GLU H . 53037 1
59 . 1 . 1 14 14 GLU HA H 1 4.177533755 . . . . . . . . 649 GLU HA . 53037 1
60 . 1 . 1 14 14 GLU C C 13 174.0401608 . . . . . . . . 649 GLU C . 53037 1
61 . 1 . 1 14 14 GLU CA C 13 53.8919318 0.03740686343 . . . . . . . 649 GLU CA . 53037 1
62 . 1 . 1 14 14 GLU CB C 13 27.64797588 0.008162526915 . . . . . . . 649 GLU CB . 53037 1
63 . 1 . 1 14 14 GLU CG C 13 33.66072951 . . . . . . . . 649 GLU CG . 53037 1
64 . 1 . 1 14 14 GLU N N 15 121.2011259 0.03245230501 . . . . . . . 649 GLU N . 53037 1
65 . 1 . 1 15 15 GLU H H 1 8.452453575 0.0004289876432 . . . . . . . 650 GLU H . 53037 1
66 . 1 . 1 15 15 GLU HA H 1 4.183487446 . . . . . . . . 650 GLU HA . 53037 1
67 . 1 . 1 15 15 GLU C C 13 174.3858546 . . . . . . . . 650 GLU C . 53037 1
68 . 1 . 1 15 15 GLU CA C 13 54.26931209 0.0607885862 . . . . . . . 650 GLU CA . 53037 1
69 . 1 . 1 15 15 GLU CB C 13 27.61019791 0.04319271162 . . . . . . . 650 GLU CB . 53037 1
70 . 1 . 1 15 15 GLU CG C 13 33.60838119 . . . . . . . . 650 GLU CG . 53037 1
71 . 1 . 1 15 15 GLU N N 15 122.5475918 0.06023488079 . . . . . . . 650 GLU N . 53037 1
72 . 1 . 1 16 16 GLY H H 1 8.474828728 0.0007293458443 . . . . . . . 651 GLY H . 53037 1
73 . 1 . 1 16 16 GLY HA2 H 1 3.937160416 . . . . . . . . 651 GLY HA# . 53037 1
74 . 1 . 1 16 16 GLY HA3 H 1 3.937160416 . . . . . . . . 651 GLY HA# . 53037 1
75 . 1 . 1 16 16 GLY C C 13 171.5726977 . . . . . . . . 651 GLY C . 53037 1
76 . 1 . 1 16 16 GLY CA C 13 42.6684956 0.01808933955 . . . . . . . 651 GLY CA . 53037 1
77 . 1 . 1 16 16 GLY N N 15 110.7759287 0.007396006318 . . . . . . . 651 GLY N . 53037 1
78 . 1 . 1 17 17 SER H H 1 8.083572548 0.001866799722 . . . . . . . 652 SER H . 53037 1
79 . 1 . 1 17 17 SER HA H 1 4.391138476 . . . . . . . . 652 SER HA . 53037 1
80 . 1 . 1 17 17 SER C C 13 171.836963 . . . . . . . . 652 SER C . 53037 1
81 . 1 . 1 17 17 SER CA C 13 55.7937475 0.02274683218 . . . . . . . 652 SER CA . 53037 1
82 . 1 . 1 17 17 SER CB C 13 61.37421657 0.06516702846 . . . . . . . 652 SER CB . 53037 1
83 . 1 . 1 17 17 SER N N 15 115.318456 0.008731634138 . . . . . . . 652 SER N . 53037 1
84 . 1 . 1 18 18 GLU H H 1 8.526339726 0.001240507269 . . . . . . . 653 GLU H . 53037 1
85 . 1 . 1 18 18 GLU HA H 1 4.245984525 . . . . . . . . 653 GLU HA . 53037 1
86 . 1 . 1 18 18 GLU C C 13 173.707192 . . . . . . . . 653 GLU C . 53037 1
87 . 1 . 1 18 18 GLU CA C 13 53.92351095 0.01689148555 . . . . . . . 653 GLU CA . 53037 1
88 . 1 . 1 18 18 GLU CB C 13 27.44025759 0.03753276467 . . . . . . . 653 GLU CB . 53037 1
89 . 1 . 1 18 18 GLU CG C 13 33.61943945 . . . . . . . . 653 GLU CG . 53037 1
90 . 1 . 1 18 18 GLU N N 15 122.8185252 0.02442157961 . . . . . . . 653 GLU N . 53037 1
91 . 1 . 1 19 19 VAL H H 1 8.067833812 0.0009524404471 . . . . . . . 654 VAL H . 53037 1
92 . 1 . 1 19 19 VAL HA H 1 4.052847708 . . . . . . . . 654 VAL HA . 53037 1
93 . 1 . 1 19 19 VAL C C 13 173.3507676 . . . . . . . . 654 VAL C . 53037 1
94 . 1 . 1 19 19 VAL CA C 13 59.53518851 0.04413125314 . . . . . . . 654 VAL CA . 53037 1
95 . 1 . 1 19 19 VAL CB C 13 30.08324879 0.07305085888 . . . . . . . 654 VAL CB . 53037 1
96 . 1 . 1 19 19 VAL CG1 C 13 18.56291673 . . . . . . . . 654 VAL CG1 . 53037 1
97 . 1 . 1 19 19 VAL CG2 C 13 17.92205582 . . . . . . . . 654 VAL CG2 . 53037 1
98 . 1 . 1 19 19 VAL N N 15 121.0997034 0.000001907 . . . . . . . 654 VAL N . 53037 1
99 . 1 . 1 20 20 SER H H 1 8.317736514 0.002193792371 . . . . . . . 655 SER H . 53037 1
100 . 1 . 1 20 20 SER HA H 1 4.450750284 . . . . . . . . 655 SER HA . 53037 1
101 . 1 . 1 20 20 SER C C 13 171.5550148 . . . . . . . . 655 SER C . 53037 1
102 . 1 . 1 20 20 SER CA C 13 55.44399362 0.05089144752 . . . . . . . 655 SER CA . 53037 1
103 . 1 . 1 20 20 SER CB C 13 61.13119403 0.01705236479 . . . . . . . 655 SER CB . 53037 1
104 . 1 . 1 20 20 SER N N 15 120.0341975 0.1296630742 . . . . . . . 655 SER N . 53037 1
105 . 1 . 1 21 21 VAL H H 1 8.13809868 0.001201957887 . . . . . . . 656 VAL H . 53037 1
106 . 1 . 1 21 21 VAL HA H 1 4.111202336 . . . . . . . . 656 VAL HA . 53037 1
107 . 1 . 1 21 21 VAL C C 13 174.6471493 . . . . . . . . 656 VAL C . 53037 1
108 . 1 . 1 21 21 VAL CA C 13 59.41402766 0.08918109415 . . . . . . . 656 VAL CA . 53037 1
109 . 1 . 1 21 21 VAL CB C 13 30.16241784 0.01726065991 . . . . . . . 656 VAL CB . 53037 1
110 . 1 . 1 21 21 VAL CG1 C 13 18.28907141 . . . . . . . . 656 VAL CG1 . 53037 1
111 . 1 . 1 21 21 VAL CG2 C 13 17.6770112 . . . . . . . . 656 VAL CG2 . 53037 1
112 . 1 . 1 21 21 VAL N N 15 122.5503259 0.03810115838 . . . . . . . 656 VAL N . 53037 1
113 . 1 . 1 22 22 VAL H H 1 8.181713294 0.001393488698 . . . . . . . 657 VAL H . 53037 1
114 . 1 . 1 22 22 VAL HA H 1 4.090899064 . . . . . . . . 657 VAL HA . 53037 1
115 . 1 . 1 22 22 VAL C C 13 173.6930246 . . . . . . . . 657 VAL C . 53037 1
116 . 1 . 1 22 22 VAL CA C 13 59.45787473 0.05094328703 . . . . . . . 657 VAL CA . 53037 1
117 . 1 . 1 22 22 VAL CB C 13 30.14700824 0.01997637653 . . . . . . . 657 VAL CB . 53037 1
118 . 1 . 1 22 22 VAL CG1 C 13 18.54346049 . . . . . . . . 657 VAL CG1 . 53037 1
119 . 1 . 1 22 22 VAL CG2 C 13 17.73823844 . . . . . . . . 657 VAL CG2 . 53037 1
120 . 1 . 1 22 22 VAL N N 15 124.6754214 0.0000013 . . . . . . . 657 VAL N . 53037 1
121 . 1 . 1 23 23 THR H H 1 8.159687008 0.0007974354908 . . . . . . . 658 THR H . 53037 1
122 . 1 . 1 23 23 THR HA H 1 4.275692951 . . . . . . . . 658 THR HA . 53037 1
123 . 1 . 1 23 23 THR C C 13 171.735631 . . . . . . . . 658 THR C . 53037 1
124 . 1 . 1 23 23 THR CA C 13 58.75822932 0.09348802157 . . . . . . . 658 THR CA . 53037 1
125 . 1 . 1 23 23 THR CB C 13 67.33134013 0.03783783192 . . . . . . . 658 THR CB . 53037 1
126 . 1 . 1 23 23 THR CG2 C 13 18.92922313 . . . . . . . . 658 THR CG . 53037 1
127 . 1 . 1 23 23 THR N N 15 118.1100192 0.03657854907 . . . . . . . 658 THR N . 53037 1
128 . 1 . 1 24 24 VAL H H 1 8.202259438 0.0006763576023 . . . . . . . 659 VAL H . 53037 1
129 . 1 . 1 24 24 VAL HA H 1 4.0577713 . . . . . . . . 659 VAL HA . 53037 1
130 . 1 . 1 24 24 VAL C C 13 173.1180231 . . . . . . . . 659 VAL C . 53037 1
131 . 1 . 1 24 24 VAL CA C 13 59.58314493 0.01757712491 . . . . . . . 659 VAL CA . 53037 1
132 . 1 . 1 24 24 VAL CB C 13 30.16844527 0.01019660943 . . . . . . . 659 VAL CB . 53037 1
133 . 1 . 1 24 24 VAL CG1 C 13 18.53069356 . . . . . . . . 659 VAL CG1 . 53037 1
134 . 1 . 1 24 24 VAL CG2 C 13 17.65936789 . . . . . . . . 659 VAL CG2 . 53037 1
135 . 1 . 1 24 24 VAL N N 15 122.2378519 0.02477787042 . . . . . . . 659 VAL N . 53037 1
136 . 1 . 1 25 25 ASP H H 1 8.237144904 0.0009653373951 . . . . . . . 660 ASP H . 53037 1
137 . 1 . 1 25 25 ASP HA H 1 4.507631623 . . . . . . . . 660 ASP HA . 53037 1
138 . 1 . 1 25 25 ASP C C 13 173.3809717 . . . . . . . . 660 ASP C . 53037 1
139 . 1 . 1 25 25 ASP CA C 13 51.8296629 0.04268473692 . . . . . . . 660 ASP CA . 53037 1
140 . 1 . 1 25 25 ASP CB C 13 38.6200513 0.01333527315 . . . . . . . 660 ASP CB . 53037 1
141 . 1 . 1 25 25 ASP N N 15 123.7330944 0.01200858671 . . . . . . . 660 ASP N . 53037 1
142 . 1 . 1 26 26 ASP H H 1 8.16681154 0.0008418134378 . . . . . . . 661 ASP H . 53037 1
143 . 1 . 1 26 26 ASP HA H 1 4.469503218 . . . . . . . . 661 ASP HA . 53037 1
144 . 1 . 1 26 26 ASP C C 13 173.7391046 . . . . . . . . 661 ASP C . 53037 1
145 . 1 . 1 26 26 ASP CA C 13 51.94518005 0.09436807413 . . . . . . . 661 ASP CA . 53037 1
146 . 1 . 1 26 26 ASP CB C 13 38.33024546 0.007149070001 . . . . . . . 661 ASP CB . 53037 1
147 . 1 . 1 26 26 ASP N N 15 120.7718894 0.0253822865 . . . . . . . 661 ASP N . 53037 1
148 . 1 . 1 27 27 MET H H 1 8.19967921 0.0007907506579 . . . . . . . 662 MET H . 53037 1
149 . 1 . 1 27 27 MET HA H 1 4.331178443 . . . . . . . . 662 MET HA . 53037 1
150 . 1 . 1 27 27 MET C C 13 174.0054899 . . . . . . . . 662 MET C . 53037 1
151 . 1 . 1 27 27 MET CA C 13 53.36768302 0.01720131461 . . . . . . . 662 MET CA . 53037 1
152 . 1 . 1 27 27 MET CB C 13 29.87100256 0.1189889899 . . . . . . . 662 MET CB . 53037 1
153 . 1 . 1 27 27 MET CG C 13 29.3737532 . . . . . . . . 662 MET CG . 53037 1
154 . 1 . 1 27 27 MET CE C 13 16.65044057 . . . . . . . . 662 MET CE . 53037 1
155 . 1 . 1 27 27 MET N N 15 119.8631366 0.01978479898 . . . . . . . 662 MET N . 53037 1
156 . 1 . 1 28 28 VAL H H 1 8.002603206 0.0007677902024 . . . . . . . 663 VAL H . 53037 1
157 . 1 . 1 28 28 VAL HA H 1 3.994522075 . . . . . . . . 663 VAL HA . 53037 1
158 . 1 . 1 28 28 VAL C C 13 173.961282 . . . . . . . . 663 VAL C . 53037 1
159 . 1 . 1 28 28 VAL CA C 13 60.42072758 0.03707694148 . . . . . . . 663 VAL CA . 53037 1
160 . 1 . 1 28 28 VAL CB C 13 29.84500831 0.0103508063 . . . . . . . 663 VAL CB . 53037 1
161 . 1 . 1 28 28 VAL CG1 C 13 18.30603573 . . . . . . . . 663 VAL CG1 . 53037 1
162 . 1 . 1 28 28 VAL CG2 C 13 18.30603573 . . . . . . . . 663 VAL CG2 . 53037 1
163 . 1 . 1 28 28 VAL N N 15 121.2935588 0.06352916554 . . . . . . . 663 VAL N . 53037 1
164 . 1 . 1 29 29 THR H H 1 8.13152372 0.0007904135244 . . . . . . . 664 THR H . 53037 1
165 . 1 . 1 29 29 THR HA H 1 4.187339127 . . . . . . . . 664 THR HA . 53037 1
166 . 1 . 1 29 29 THR C C 13 171.9301734 . . . . . . . . 664 THR C . 53037 1
167 . 1 . 1 29 29 THR CA C 13 59.70441497 0.1093052278 . . . . . . . 664 THR CA . 53037 1
168 . 1 . 1 29 29 THR CB C 13 66.88798267 0.07664882877 . . . . . . . 664 THR CB . 53037 1
169 . 1 . 1 29 29 THR CG2 C 13 18.92723479 . . . . . . . . 664 THR CG . 53037 1
170 . 1 . 1 29 29 THR N N 15 118.5994696 0.02623582997 . . . . . . . 664 THR N . 53037 1
171 . 1 . 1 30 30 LEU H H 1 8.150447237 0.001711963038 . . . . . . . 665 LEU H . 53037 1
172 . 1 . 1 30 30 LEU HA H 1 4.250526188 . . . . . . . . 665 LEU HA . 53037 1
173 . 1 . 1 30 30 LEU C C 13 173.1843364 . . . . . . . . 665 LEU C . 53037 1
174 . 1 . 1 30 30 LEU CA C 13 52.71478127 0.02481525074 . . . . . . . 665 LEU CA . 53037 1
175 . 1 . 1 30 30 LEU CB C 13 39.66533549 0.04242805074 . . . . . . . 665 LEU CB . 53037 1
176 . 1 . 1 30 30 LEU CG C 13 24.25121654 . . . . . . . . 665 LEU CG . 53037 1
177 . 1 . 1 30 30 LEU CD1 C 13 22.21750875 . . . . . . . . 665 LEU CD1 . 53037 1
178 . 1 . 1 30 30 LEU CD2 C 13 20.79363958 . . . . . . . . 665 LEU CD2 . 53037 1
179 . 1 . 1 30 30 LEU N N 15 124.6419335 0.01002043335 . . . . . . . 665 LEU N . 53037 1
180 . 1 . 1 31 31 ALA H H 1 8.184889777 0.001557762692 . . . . . . . 666 ALA H . 53037 1
181 . 1 . 1 31 31 ALA HA H 1 4.154816001 . . . . . . . . 666 ALA HA . 53037 1
182 . 1 . 1 31 31 ALA C C 13 175.5771034 . . . . . . . . 666 ALA C . 53037 1
183 . 1 . 1 31 31 ALA CA C 13 50.18569745 0.008242540581 . . . . . . . 666 ALA CA . 53037 1
184 . 1 . 1 31 31 ALA CB C 13 16.33571122 0.02545108042 . . . . . . . 666 ALA CB . 53037 1
185 . 1 . 1 31 31 ALA N N 15 124.5093261 0.03783044277 . . . . . . . 666 ALA N . 53037 1
186 . 1 . 1 32 32 THR H H 1 7.971641865 0.001553513873 . . . . . . . 667 THR H . 53037 1
187 . 1 . 1 32 32 THR HA H 1 4.147813865 . . . . . . . . 667 THR HA . 53037 1
188 . 1 . 1 32 32 THR C C 13 172.4974113 . . . . . . . . 667 THR C . 53037 1
189 . 1 . 1 32 32 THR CA C 13 59.92397428 0.03274774645 . . . . . . . 667 THR CA . 53037 1
190 . 1 . 1 32 32 THR CB C 13 66.87472889 0.02180977813 . . . . . . . 667 THR CB . 53037 1
191 . 1 . 1 32 32 THR CG2 C 13 18.90965123 . . . . . . . . 667 THR CG . 53037 1
192 . 1 . 1 32 32 THR N N 15 113.1714112 0.04962060951 . . . . . . . 667 THR N . 53037 1
193 . 1 . 1 33 33 GLU H H 1 8.303912293 0.001732635333 . . . . . . . 668 GLU H . 53037 1
194 . 1 . 1 33 33 GLU HA H 1 4.164484711 . . . . . . . . 668 GLU HA . 53037 1
195 . 1 . 1 33 33 GLU C C 13 173.9707327 . . . . . . . . 668 GLU C . 53037 1
196 . 1 . 1 33 33 GLU CA C 13 54.42260894 0.04255019794 . . . . . . . 668 GLU CA . 53037 1
197 . 1 . 1 33 33 GLU CB C 13 27.33876961 0.02287462593 . . . . . . . 668 GLU CB . 53037 1
198 . 1 . 1 33 33 GLU CG C 13 33.63223808 . . . . . . . . 668 GLU CG . 53037 1
199 . 1 . 1 33 33 GLU N N 15 122.8836443 0.02054686001 . . . . . . . 668 GLU N . 53037 1
200 . 1 . 1 34 34 ALA H H 1 8.104731584 0.002432805625 . . . . . . . 669 ALA H . 53037 1
201 . 1 . 1 34 34 ALA HA H 1 4.201763824 . . . . . . . . 669 ALA HA . 53037 1
202 . 1 . 1 34 34 ALA C C 13 175.4047459 . . . . . . . . 669 ALA C . 53037 1
203 . 1 . 1 34 34 ALA CA C 13 50.18332643 0.002784674053 . . . . . . . 669 ALA CA . 53037 1
204 . 1 . 1 34 34 ALA CB C 13 16.19801346 0.01466250763 . . . . . . . 669 ALA CB . 53037 1
205 . 1 . 1 34 34 ALA N N 15 124.3328293 0.02038631057 . . . . . . . 669 ALA N . 53037 1
206 . 1 . 1 35 35 LEU H H 1 7.957452492 0.0008344931811 . . . . . . . 670 LEU H . 53037 1
207 . 1 . 1 35 35 LEU HA H 1 4.19047136 . . . . . . . . 670 LEU HA . 53037 1
208 . 1 . 1 35 35 LEU C C 13 174.8582578 . . . . . . . . 670 LEU C . 53037 1
209 . 1 . 1 35 35 LEU CA C 13 52.66789169 0.01773705623 . . . . . . . 670 LEU CA . 53037 1
210 . 1 . 1 35 35 LEU CB C 13 39.56411458 0.007960972737 . . . . . . . 670 LEU CB . 53037 1
211 . 1 . 1 35 35 LEU CG C 13 24.23463859 . . . . . . . . 670 LEU CG . 53037 1
212 . 1 . 1 35 35 LEU CD1 C 13 22.06726705 . . . . . . . . 670 LEU CD1 . 53037 1
213 . 1 . 1 35 35 LEU CD2 C 13 20.82762048 . . . . . . . . 670 LEU CD2 . 53037 1
214 . 1 . 1 35 35 LEU N N 15 120.8284427 0.04611859561 . . . . . . . 670 LEU N . 53037 1
215 . 1 . 1 36 36 ALA H H 1 8.044185482 0.001019609625 . . . . . . . 671 ALA H . 53037 1
216 . 1 . 1 36 36 ALA HA H 1 4.192373803 . . . . . . . . 671 ALA HA . 53037 1
217 . 1 . 1 36 36 ALA C C 13 175.1071869 . . . . . . . . 671 ALA C . 53037 1
218 . 1 . 1 36 36 ALA CA C 13 49.99304609 0.08008812284 . . . . . . . 671 ALA CA . 53037 1
219 . 1 . 1 36 36 ALA CB C 13 16.37354214 0.02246362557 . . . . . . . 671 ALA CB . 53037 1
220 . 1 . 1 36 36 ALA N N 15 124.2212238 0.0414886798 . . . . . . . 671 ALA N . 53037 1
221 . 1 . 1 37 37 ALA H H 1 8.093358298 0.0009381210015 . . . . . . . 672 ALA H . 53037 1
222 . 1 . 1 37 37 ALA HA H 1 4.27291103 . . . . . . . . 672 ALA HA . 53037 1
223 . 1 . 1 37 37 ALA C C 13 175.4491257 . . . . . . . . 672 ALA C . 53037 1
224 . 1 . 1 37 37 ALA CA C 13 50.16296103 0.02819685076 . . . . . . . 672 ALA CA . 53037 1
225 . 1 . 1 37 37 ALA CB C 13 16.39835181 0.009478981436 . . . . . . . 672 ALA CB . 53037 1
226 . 1 . 1 37 37 ALA N N 15 122.6388976 0.02537099946 . . . . . . . 672 ALA N . 53037 1
227 . 1 . 1 38 38 THR H H 1 7.88787295 0.001591037136 . . . . . . . 673 THR H . 53037 1
228 . 1 . 1 38 38 THR HA H 1 4.19469629 . . . . . . . . 673 THR HA . 53037 1
229 . 1 . 1 38 38 THR C C 13 171.6817714 . . . . . . . . 673 THR C . 53037 1
230 . 1 . 1 38 38 THR CA C 13 59.24348958 0.02700905615 . . . . . . . 673 THR CA . 53037 1
231 . 1 . 1 38 38 THR CB C 13 67.0904347 0.02182326723 . . . . . . . 673 THR CB . 53037 1
232 . 1 . 1 38 38 THR CG2 C 13 18.9197524 . . . . . . . . 673 THR CG . 53037 1
233 . 1 . 1 38 38 THR N N 15 112.3936341 0.03183287713 . . . . . . . 673 THR N . 53037 1
234 . 1 . 1 39 39 ALA H H 1 8.099804404 0.001604056152 . . . . . . . 674 ALA H . 53037 1
235 . 1 . 1 39 39 ALA C C 13 175.0467771 . . . . . . . . 674 ALA C . 53037 1
236 . 1 . 1 39 39 ALA CA C 13 49.8903217 0.01118854791 . . . . . . . 674 ALA CA . 53037 1
237 . 1 . 1 39 39 ALA CB C 13 16.52510942 0.01528685478 . . . . . . . 674 ALA CB . 53037 1
238 . 1 . 1 39 39 ALA N N 15 126.254882 0.04584063124 . . . . . . . 674 ALA N . 53037 1
239 . 1 . 1 40 40 VAL H H 1 8.013556876 0.001509764865 . . . . . . . 675 VAL H . 53037 1
240 . 1 . 1 40 40 VAL HA H 1 4.048844103 . . . . . . . . 675 VAL HA . 53037 1
241 . 1 . 1 40 40 VAL C C 13 173.8518799 . . . . . . . . 675 VAL C . 53037 1
242 . 1 . 1 40 40 VAL CA C 13 59.8492447 0.04705931864 . . . . . . . 675 VAL CA . 53037 1
243 . 1 . 1 40 40 VAL CB C 13 29.88628994 0.02598965418 . . . . . . . 675 VAL CB . 53037 1
244 . 1 . 1 40 40 VAL CG1 C 13 18.58642299 . . . . . . . . 675 VAL CG1 . 53037 1
245 . 1 . 1 40 40 VAL CG2 C 13 17.9928877 . . . . . . . . 675 VAL CG2 . 53037 1
246 . 1 . 1 40 40 VAL N N 15 119.153883 0.0331200457 . . . . . . . 675 VAL N . 53037 1
247 . 1 . 1 41 41 THR H H 1 8.086164076 0.0008150701873 . . . . . . . 676 THR H . 53037 1
248 . 1 . 1 41 41 THR HA H 1 4.234570508 . . . . . . . . 676 THR HA . 53037 1
249 . 1 . 1 41 41 THR CA C 13 59.29853545 . . . . . . . . 676 THR CA . 53037 1
250 . 1 . 1 41 41 THR CB C 13 67.07497862 . . . . . . . . 676 THR CB . 53037 1
251 . 1 . 1 41 41 THR N N 15 117.8630485 0.004769349761 . . . . . . . 676 THR N . 53037 1
252 . 1 . 1 42 42 GLN C C 13 172.8769491 . . . . . . . . 677 GLN C . 53037 1
253 . 1 . 1 42 42 GLN CA C 13 52.96911448 0.03274165216 . . . . . . . 677 GLN CA . 53037 1
254 . 1 . 1 42 42 GLN CB C 13 26.76265446 0.003004823943 . . . . . . . 677 GLN CB . 53037 1
255 . 1 . 1 42 42 GLN CG C 13 31.11480956 . . . . . . . . 677 GLN CG . 53037 1
256 . 1 . 1 43 43 LEU H H 1 8.210138654 0.001191987504 . . . . . . . 678 LEU H . 53037 1
257 . 1 . 1 43 43 LEU HA H 1 4.31289301 . . . . . . . . 678 LEU HA . 53037 1
258 . 1 . 1 43 43 LEU C C 13 174.6337261 . . . . . . . . 678 LEU C . 53037 1
259 . 1 . 1 43 43 LEU CA C 13 52.40993782 0.02556239765 . . . . . . . 678 LEU CA . 53037 1
260 . 1 . 1 43 43 LEU CB C 13 39.76439407 0.0547030576 . . . . . . . 678 LEU CB . 53037 1
261 . 1 . 1 43 43 LEU CG C 13 24.23483437 . . . . . . . . 678 LEU CG . 53037 1
262 . 1 . 1 43 43 LEU CD1 C 13 22.06328029 . . . . . . . . 678 LEU CD1 . 53037 1
263 . 1 . 1 43 43 LEU CD2 C 13 20.78880264 . . . . . . . . 678 LEU CD2 . 53037 1
264 . 1 . 1 43 43 LEU N N 15 123.6555256 0.004047500535 . . . . . . . 678 LEU N . 53037 1
265 . 1 . 1 44 44 THR H H 1 8.097114131 0.001791298313 . . . . . . . 679 THR H . 53037 1
266 . 1 . 1 44 44 THR HA H 1 4.247698994 . . . . . . . . 679 THR HA . 53037 1
267 . 1 . 1 44 44 THR C C 13 171.4236099 . . . . . . . . 679 THR C . 53037 1
268 . 1 . 1 44 44 THR CA C 13 59.25414756 0.02325424563 . . . . . . . 679 THR CA . 53037 1
269 . 1 . 1 44 44 THR CB C 13 67.06529355 0.02068229304 . . . . . . . 679 THR CB . 53037 1
270 . 1 . 1 44 44 THR CG2 C 13 18.91479095 . . . . . . . . 679 THR CG . 53037 1
271 . 1 . 1 44 44 THR N N 15 116.1213259 0.03631392907 . . . . . . . 679 THR N . 53037 1
272 . 1 . 1 45 45 VAL H H 1 8.097376109 0.001646583222 . . . . . . . 680 VAL H . 53037 1
273 . 1 . 1 45 45 VAL HA H 1 4.051237392 . . . . . . . . 680 VAL HA . 53037 1
274 . 1 . 1 45 45 VAL C C 13 173.0105114 . . . . . . . . 680 VAL C . 53037 1
275 . 1 . 1 45 45 VAL CA C 13 59.32452591 0.04997104594 . . . . . . . 680 VAL CA . 53037 1
276 . 1 . 1 45 45 VAL CB C 13 30.13814427 0.02356055696 . . . . . . . 680 VAL CB . 53037 1
277 . 1 . 1 45 45 VAL CG1 C 13 18.18106878 . . . . . . . . 680 VAL CG1 . 53037 1
278 . 1 . 1 45 45 VAL CG2 C 13 18.18106878 . . . . . . . . 680 VAL CG2 . 53037 1
279 . 1 . 1 45 45 VAL N N 15 123.6075024 0.06773994778 . . . . . . . 680 VAL N . 53037 1
280 . 1 . 1 46 46 VAL H H 1 8.190229022 0.001032678528 . . . . . . . 681 VAL H . 53037 1
281 . 1 . 1 46 46 VAL HA H 1 4.33897274 . . . . . . . . 681 VAL HA . 53037 1
282 . 1 . 1 46 46 VAL CA C 13 57.09088861 . . . . . . . . 681 VAL CA . 53037 1
283 . 1 . 1 46 46 VAL CB C 13 29.94619368 . . . . . . . . 681 VAL CB . 53037 1
284 . 1 . 1 46 46 VAL N N 15 126.4737047 0.007994058783 . . . . . . . 681 VAL N . 53037 1
285 . 1 . 1 47 47 PRO C C 13 174.0671233 . . . . . . . . 682 PRO C . 53037 1
286 . 1 . 1 47 47 PRO CA C 13 60.16136239 0.03800963744 . . . . . . . 682 PRO CA . 53037 1
287 . 1 . 1 47 47 PRO CB C 13 29.43883463 0.05134491988 . . . . . . . 682 PRO CB . 53037 1
288 . 1 . 1 47 47 PRO CG C 13 24.6600833 . . . . . . . . 682 PRO CG . 53037 1
289 . 1 . 1 47 47 PRO CD C 13 48.32937632 . . . . . . . . 682 PRO CD . 53037 1
290 . 1 . 1 48 48 VAL H H 1 8.148975967 0.000972356079 . . . . . . . 683 VAL H . 53037 1
291 . 1 . 1 48 48 VAL HA H 1 3.981022386 . . . . . . . . 683 VAL HA . 53037 1
292 . 1 . 1 48 48 VAL C C 13 174.2015744 . . . . . . . . 683 VAL C . 53037 1
293 . 1 . 1 48 48 VAL CA C 13 59.90932938 0.0251586157 . . . . . . . 683 VAL CA . 53037 1
294 . 1 . 1 48 48 VAL CB C 13 30.04350533 0.06612656016 . . . . . . . 683 VAL CB . 53037 1
295 . 1 . 1 48 48 VAL CG1 C 13 18.2137534 . . . . . . . . 683 VAL CG1 . 53037 1
296 . 1 . 1 48 48 VAL CG2 C 13 18.2137534 . . . . . . . . 683 VAL CG2 . 53037 1
297 . 1 . 1 48 48 VAL N N 15 120.6158506 0.02968176185 . . . . . . . 683 VAL N . 53037 1
298 . 1 . 1 49 49 GLY H H 1 8.401887116 0.001494022485 . . . . . . . 684 GLY H . 53037 1
299 . 1 . 1 49 49 GLY HA2 H 1 3.874243064 . . . . . . . . 684 GLY HA# . 53037 1
300 . 1 . 1 49 49 GLY HA3 H 1 3.874243064 . . . . . . . . 684 GLY HA# . 53037 1
301 . 1 . 1 49 49 GLY C C 13 171.0343128 . . . . . . . . 684 GLY C . 53037 1
302 . 1 . 1 49 49 GLY CA C 13 42.39539553 0.01634403296 . . . . . . . 684 GLY CA . 53037 1
303 . 1 . 1 49 49 GLY N N 15 112.6655977 0.07484853093 . . . . . . . 684 GLY N . 53037 1
304 . 1 . 1 50 50 ALA H H 1 8.023988994 0.001813195768 . . . . . . . 685 ALA H . 53037 1
305 . 1 . 1 50 50 ALA HA H 1 4.247611389 . . . . . . . . 685 ALA HA . 53037 1
306 . 1 . 1 50 50 ALA C C 13 174.6274677 . . . . . . . . 685 ALA C . 53037 1
307 . 1 . 1 50 50 ALA CA C 13 49.5250832 0.0401727043 . . . . . . . 685 ALA CA . 53037 1
308 . 1 . 1 50 50 ALA CB C 13 16.7260307 0.01651196973 . . . . . . . 685 ALA CB . 53037 1
309 . 1 . 1 50 50 ALA N N 15 123.7787986 0.009742254833 . . . . . . . 685 ALA N . 53037 1
310 . 1 . 1 51 51 ALA H H 1 8.193802791 0.002594551683 . . . . . . . 686 ALA H . 53037 1
311 . 1 . 1 51 51 ALA HA H 1 4.264894435 . . . . . . . . 686 ALA HA . 53037 1
312 . 1 . 1 51 51 ALA C C 13 174.9531616 . . . . . . . . 686 ALA C . 53037 1
313 . 1 . 1 51 51 ALA CA C 13 49.57957702 0.01077864841 . . . . . . . 686 ALA CA . 53037 1
314 . 1 . 1 51 51 ALA CB C 13 16.4472683 0.02036942961 . . . . . . . 686 ALA CB . 53037 1
315 . 1 . 1 51 51 ALA N N 15 123.3686683 0.009181482134 . . . . . . . 686 ALA N . 53037 1
316 . 1 . 1 52 52 VAL H H 1 8.056929877 0.001241076692 . . . . . . . 687 VAL H . 53037 1
317 . 1 . 1 52 52 VAL HA H 1 4.107887329 . . . . . . . . 687 VAL HA . 53037 1
318 . 1 . 1 52 52 VAL C C 13 173.4473477 . . . . . . . . 687 VAL C . 53037 1
319 . 1 . 1 52 52 VAL CA C 13 59.45408662 0.04718145021 . . . . . . . 687 VAL CA . 53037 1
320 . 1 . 1 52 52 VAL CB C 13 30.16892001 0.008415179565 . . . . . . . 687 VAL CB . 53037 1
321 . 1 . 1 52 52 VAL CG1 C 13 18.59364949 . . . . . . . . 687 VAL CG1 . 53037 1
322 . 1 . 1 52 52 VAL CG2 C 13 18.01887542 . . . . . . . . 687 VAL CG2 . 53037 1
323 . 1 . 1 52 52 VAL N N 15 119.5387168 0.01178863845 . . . . . . . 687 VAL N . 53037 1
324 . 1 . 1 53 53 THR H H 1 8.307709619 0.0010615494 . . . . . . . 688 THR H . 53037 1
325 . 1 . 1 53 53 THR HA H 1 4.353217467 . . . . . . . . 688 THR HA . 53037 1
326 . 1 . 1 53 53 THR C C 13 171.4560626 . . . . . . . . 688 THR C . 53037 1
327 . 1 . 1 53 53 THR CA C 13 58.71416116 0.03996197492 . . . . . . . 688 THR CA . 53037 1
328 . 1 . 1 53 53 THR CB C 13 67.25250072 0.1209053263 . . . . . . . 688 THR CB . 53037 1
329 . 1 . 1 53 53 THR CG2 C 13 18.91598944 . . . . . . . . 688 THR CG . 53037 1
330 . 1 . 1 53 53 THR N N 15 119.514698 0.01885411263 . . . . . . . 688 THR N . 53037 1
331 . 1 . 1 54 54 ALA H H 1 8.316193829 0.000986968222 . . . . . . . 689 ALA H . 53037 1
332 . 1 . 1 54 54 ALA HA H 1 4.24772507 . . . . . . . . 689 ALA HA . 53037 1
333 . 1 . 1 54 54 ALA C C 13 174.6063576 . . . . . . . . 689 ALA C . 53037 1
334 . 1 . 1 54 54 ALA CA C 13 49.87850016 0.005182638109 . . . . . . . 689 ALA CA . 53037 1
335 . 1 . 1 54 54 ALA CB C 13 16.62441304 0.04019253062 . . . . . . . 689 ALA CB . 53037 1
336 . 1 . 1 54 54 ALA N N 15 126.5525433 0.03052143192 . . . . . . . 689 ALA N . 53037 1
337 . 1 . 1 55 55 ASP H H 1 8.240271456 0.0012158016 . . . . . . . 690 ASP H . 53037 1
338 . 1 . 1 55 55 ASP HA H 1 4.499521468 . . . . . . . . 690 ASP HA . 53037 1
339 . 1 . 1 55 55 ASP C C 13 173.934467 . . . . . . . . 690 ASP C . 53037 1
340 . 1 . 1 55 55 ASP CA C 13 51.79603983 0.07126502522 . . . . . . . 690 ASP CA . 53037 1
341 . 1 . 1 55 55 ASP CB C 13 38.58559903 0.02685169897 . . . . . . . 690 ASP CB . 53037 1
342 . 1 . 1 55 55 ASP N N 15 119.8414801 0.01896203721 . . . . . . . 690 ASP N . 53037 1
343 . 1 . 1 56 56 GLU H H 1 8.407293223 0.00167434008 . . . . . . . 691 GLU H . 53037 1
344 . 1 . 1 56 56 GLU HA H 1 4.213093698 . . . . . . . . 691 GLU HA . 53037 1
345 . 1 . 1 56 56 GLU C C 13 174.3237193 . . . . . . . . 691 GLU C . 53037 1
346 . 1 . 1 56 56 GLU CA C 13 54.495554 0.03010025591 . . . . . . . 691 GLU CA . 53037 1
347 . 1 . 1 56 56 GLU CB C 13 27.36331935 0.01101646212 . . . . . . . 691 GLU CB . 53037 1
348 . 1 . 1 56 56 GLU CG C 13 33.66405623 . . . . . . . . 691 GLU CG . 53037 1
349 . 1 . 1 56 56 GLU N N 15 121.8158922 0.014308118 . . . . . . . 691 GLU N . 53037 1
350 . 1 . 1 57 57 THR H H 1 8.143531642 0.0007835941259 . . . . . . . 692 THR H . 53037 1
351 . 1 . 1 57 57 THR HA H 1 4.12838087 . . . . . . . . 692 THR HA . 53037 1
352 . 1 . 1 57 57 THR C C 13 172.3550453 . . . . . . . . 692 THR C . 53037 1
353 . 1 . 1 57 57 THR CA C 13 60.39720694 0.1146315668 . . . . . . . 692 THR CA . 53037 1
354 . 1 . 1 57 57 THR CB C 13 66.80784996 0.01599150802 . . . . . . . 692 THR CB . 53037 1
355 . 1 . 1 57 57 THR CG2 C 13 18.93849772 . . . . . . . . 692 THR CG . 53037 1
356 . 1 . 1 57 57 THR N N 15 114.6047443 0.04970116519 . . . . . . . 692 THR N . 53037 1
357 . 1 . 1 58 58 GLU H H 1 8.199343099 0.0008954130094 . . . . . . . 693 GLU H . 53037 1
358 . 1 . 1 58 58 GLU HA H 1 4.179969301 . . . . . . . . 693 GLU HA . 53037 1
359 . 1 . 1 58 58 GLU C C 13 174.275057 . . . . . . . . 693 GLU C . 53037 1
360 . 1 . 1 58 58 GLU CA C 13 54.47341454 0.02513040373 . . . . . . . 693 GLU CA . 53037 1
361 . 1 . 1 58 58 GLU CB C 13 27.3959868 0.006327465177 . . . . . . . 693 GLU CB . 53037 1
362 . 1 . 1 58 58 GLU N N 15 123.0473931 0.0286622346 . . . . . . . 693 GLU N . 53037 1
363 . 1 . 1 59 59 VAL H H 1 7.954087651 0.001279778558 . . . . . . . 694 VAL H . 53037 1
364 . 1 . 1 59 59 VAL HA H 1 3.919883393 . . . . . . . . 694 VAL HA . 53037 1
365 . 1 . 1 59 59 VAL C C 13 173.8576222 . . . . . . . . 694 VAL C . 53037 1
366 . 1 . 1 59 59 VAL CA C 13 60.54758643 0.03429196417 . . . . . . . 694 VAL CA . 53037 1
367 . 1 . 1 59 59 VAL CB C 13 29.79616716 0.05698768018 . . . . . . . 694 VAL CB . 53037 1
368 . 1 . 1 59 59 VAL CG1 C 13 18.74773834 . . . . . . . . 694 VAL CG1 . 53037 1
369 . 1 . 1 59 59 VAL CG2 C 13 18.27942692 . . . . . . . . 694 VAL CG2 . 53037 1
370 . 1 . 1 59 59 VAL N N 15 121.3773283 0.007342237174 . . . . . . . 694 VAL N . 53037 1
371 . 1 . 1 60 60 LEU H H 1 8.07867147 0.00134808166 . . . . . . . 695 LEU H . 53037 1
372 . 1 . 1 60 60 LEU HA H 1 4.255855866 . . . . . . . . 695 LEU HA . 53037 1
373 . 1 . 1 60 60 LEU C C 13 174.9335387 . . . . . . . . 695 LEU C . 53037 1
374 . 1 . 1 60 60 LEU CA C 13 52.92956849 0.05837022066 . . . . . . . 695 LEU CA . 53037 1
375 . 1 . 1 60 60 LEU CB C 13 39.35193243 0.05568401391 . . . . . . . 695 LEU CB . 53037 1
376 . 1 . 1 60 60 LEU CG C 13 24.25853179 . . . . . . . . 695 LEU CG . 53037 1
377 . 1 . 1 60 60 LEU CD1 C 13 22.05337898 . . . . . . . . 695 LEU CD1 . 53037 1
378 . 1 . 1 60 60 LEU CD2 C 13 20.81504945 . . . . . . . . 695 LEU CD2 . 53037 1
379 . 1 . 1 60 60 LEU N N 15 124.6490435 0.01476351727 . . . . . . . 695 LEU N . 53037 1
380 . 1 . 1 61 61 LYS H H 1 8.094262558 0.0009098120533 . . . . . . . 696 LYS H . 53037 1
381 . 1 . 1 61 61 LYS HA H 1 4.142731978 . . . . . . . . 696 LYS HA . 53037 1
382 . 1 . 1 61 61 LYS CA C 13 54.06368021 . . . . . . . . 696 LYS CA . 53037 1
383 . 1 . 1 61 61 LYS CB C 13 30.18333801 . . . . . . . . 696 LYS CB . 53037 1
384 . 1 . 1 61 61 LYS N N 15 121.8002068 0.008931813061 . . . . . . . 696 LYS N . 53037 1
385 . 1 . 1 62 62 ALA H H 1 8.111266507 . . . . . . . . 697 ALA H . 53037 1
386 . 1 . 1 62 62 ALA HA H 1 4.220157526 . . . . . . . . 697 ALA HA . 53037 1
387 . 1 . 1 62 62 ALA C C 13 175.3170909 . . . . . . . . 697 ALA C . 53037 1
388 . 1 . 1 62 62 ALA N N 15 124.472219 . . . . . . . . 697 ALA N . 53037 1
389 . 1 . 1 63 63 GLU H H 1 8.236149616 0.0004627459102 . . . . . . . 698 GLU H . 53037 1
390 . 1 . 1 63 63 GLU HA H 1 4.168018334 . . . . . . . . 698 GLU HA . 53037 1
391 . 1 . 1 63 63 GLU C C 13 174.3706313 . . . . . . . . 698 GLU C . 53037 1
392 . 1 . 1 63 63 GLU CA C 13 54.13483277 0.05258753175 . . . . . . . 698 GLU CA . 53037 1
393 . 1 . 1 63 63 GLU CB C 13 27.46463666 0.02739709959 . . . . . . . 698 GLU CB . 53037 1
394 . 1 . 1 63 63 GLU CG C 13 33.59755288 . . . . . . . . 698 GLU CG . 53037 1
395 . 1 . 1 63 63 GLU N N 15 119.9654755 0.04439642296 . . . . . . . 698 GLU N . 53037 1
396 . 1 . 1 64 64 ILE H H 1 8.066267719 0.000686069678 . . . . . . . 699 ILE H . 53037 1
397 . 1 . 1 64 64 ILE HA H 1 4.052755784 . . . . . . . . 699 ILE HA . 53037 1
398 . 1 . 1 64 64 ILE C C 13 173.9601977 . . . . . . . . 699 ILE C . 53037 1
399 . 1 . 1 64 64 ILE CA C 13 59.03996596 0.0731460716 . . . . . . . 699 ILE CA . 53037 1
400 . 1 . 1 64 64 ILE CB C 13 35.81944752 0.02666851834 . . . . . . . 699 ILE CB . 53037 1
401 . 1 . 1 64 64 ILE CG1 C 13 24.83953951 . . . . . . . . 699 ILE CG1 . 53037 1
402 . 1 . 1 64 64 ILE CG2 C 13 14.84233263 . . . . . . . . 699 ILE CG2 . 53037 1
403 . 1 . 1 64 64 ILE CD1 C 13 10.23603622 . . . . . . . . 699 ILE CD1 . 53037 1
404 . 1 . 1 64 64 ILE N N 15 121.5397301 0.06627788538 . . . . . . . 699 ILE N . 53037 1
405 . 1 . 1 65 65 SER H H 1 8.198362426 0.003995247465 . . . . . . . 700 SER H . 53037 1
406 . 1 . 1 65 65 SER HA H 1 4.294422298 . . . . . . . . 700 SER HA . 53037 1
407 . 1 . 1 65 65 SER CA C 13 56.03766198 . . . . . . . . 700 SER CA . 53037 1
408 . 1 . 1 65 65 SER N N 15 118.7180708 0.01234806523 . . . . . . . 700 SER N . 53037 1
409 . 1 . 1 66 66 LYS H H 1 8.133729981 . . . . . . . . 701 LYS H . 53037 1
410 . 1 . 1 66 66 LYS C C 13 173.9111915 . . . . . . . . 701 LYS C . 53037 1
411 . 1 . 1 66 66 LYS CA C 13 53.97620599 0.01546989042 . . . . . . . 701 LYS CA . 53037 1
412 . 1 . 1 66 66 LYS CB C 13 30.11959004 0.003498389426 . . . . . . . 701 LYS CB . 53037 1
413 . 1 . 1 66 66 LYS N N 15 123.2808854 . . . . . . . . 701 LYS N . 53037 1
414 . 1 . 1 67 67 ALA H H 1 8.0778676 0.0006964669376 . . . . . . . 702 ALA H . 53037 1
415 . 1 . 1 67 67 ALA HA H 1 4.200052441 . . . . . . . . 702 ALA HA . 53037 1
416 . 1 . 1 67 67 ALA C C 13 175.0377121 . . . . . . . . 702 ALA C . 53037 1
417 . 1 . 1 67 67 ALA CA C 13 49.88138482 0.01034452984 . . . . . . . 702 ALA CA . 53037 1
418 . 1 . 1 67 67 ALA CB C 13 16.410591 0.006472248251 . . . . . . . 702 ALA CB . 53037 1
419 . 1 . 1 67 67 ALA N N 15 124.4854696 0.01577010769 . . . . . . . 702 ALA N . 53037 1
420 . 1 . 1 68 68 VAL H H 1 7.966639495 0.001249187527 . . . . . . . 703 VAL H . 53037 1
421 . 1 . 1 68 68 VAL HA H 1 3.979408486 . . . . . . . . 703 VAL HA . 53037 1
422 . 1 . 1 68 68 VAL C C 13 173.4582808 . . . . . . . . 703 VAL C . 53037 1
423 . 1 . 1 68 68 VAL CA C 13 59.62714636 0.0454358699 . . . . . . . 703 VAL CA . 53037 1
424 . 1 . 1 68 68 VAL CB C 13 30.09502848 0.07464198674 . . . . . . . 703 VAL CB . 53037 1
425 . 1 . 1 68 68 VAL CG1 C 13 18.4593759 . . . . . . . . 703 VAL CG1 . 53037 1
426 . 1 . 1 68 68 VAL CG2 C 13 18.08338555 . . . . . . . . 703 VAL CG2 . 53037 1
427 . 1 . 1 68 68 VAL N N 15 119.5336811 0.008489101273 . . . . . . . 703 VAL N . 53037 1
428 . 1 . 1 69 69 LYS H H 1 8.236838914 0.00129853646 . . . . . . . 704 LYS H . 53037 1
429 . 1 . 1 69 69 LYS HA H 1 4.233257504 . . . . . . . . 704 LYS HA . 53037 1
430 . 1 . 1 69 69 LYS CA C 13 53.61992843 . . . . . . . . 704 LYS CA . 53037 1
431 . 1 . 1 69 69 LYS CB C 13 30.41031547 . . . . . . . . 704 LYS CB . 53037 1
432 . 1 . 1 69 69 LYS N N 15 125.0746638 0.05247823956 . . . . . . . 704 LYS N . 53037 1
433 . 1 . 1 70 70 GLN C C 13 173.2108094 . . . . . . . . 705 GLN C . 53037 1
434 . 1 . 1 70 70 GLN CA C 13 53.04778387 0.01992953985 . . . . . . . 705 GLN CA . 53037 1
435 . 1 . 1 70 70 GLN CB C 13 26.75889444 0.01893389053 . . . . . . . 705 GLN CB . 53037 1
436 . 1 . 1 70 70 GLN CG C 13 31.10262697 . . . . . . . . 705 GLN CG . 53037 1
437 . 1 . 1 71 71 VAL H H 1 8.139127895 0.0008980769238 . . . . . . . 706 VAL H . 53037 1
438 . 1 . 1 71 71 VAL HA H 1 3.992092786 . . . . . . . . 706 VAL HA . 53037 1
439 . 1 . 1 71 71 VAL C C 13 173.278062 . . . . . . . . 706 VAL C . 53037 1
440 . 1 . 1 71 71 VAL CA C 13 59.69903522 0.03269915431 . . . . . . . 706 VAL CA . 53037 1
441 . 1 . 1 71 71 VAL CB C 13 30.12572885 0.02977267986 . . . . . . . 706 VAL CB . 53037 1
442 . 1 . 1 71 71 VAL CG1 C 13 18.55554336 . . . . . . . . 706 VAL CG1 . 53037 1
443 . 1 . 1 71 71 VAL CG2 C 13 17.99804227 . . . . . . . . 706 VAL CG2 . 53037 1
444 . 1 . 1 71 71 VAL N N 15 121.7868163 0.02408566039 . . . . . . . 706 VAL N . 53037 1
445 . 1 . 1 72 72 GLN H H 1 8.394694726 0.0009800724878 . . . . . . . 707 GLN H . 53037 1
446 . 1 . 1 72 72 GLN HA H 1 4.282889596 . . . . . . . . 707 GLN HA . 53037 1
447 . 1 . 1 72 72 GLN C C 13 172.9991576 . . . . . . . . 707 GLN C . 53037 1
448 . 1 . 1 72 72 GLN CA C 13 53.00288481 0.01865672668 . . . . . . . 707 GLN CA . 53037 1
449 . 1 . 1 72 72 GLN CB C 13 26.77304663 0.04305488688 . . . . . . . 707 GLN CB . 53037 1
450 . 1 . 1 72 72 GLN CG C 13 31.11454079 . . . . . . . . 707 GLN CG . 53037 1
451 . 1 . 1 72 72 GLN N N 15 124.0466084 0.008591272249 . . . . . . . 707 GLN N . 53037 1
452 . 1 . 1 73 73 GLU H H 1 8.402101288 0.001160027183 . . . . . . . 708 GLU H . 53037 1
453 . 1 . 1 73 73 GLU HA H 1 4.186416099 . . . . . . . . 708 GLU HA . 53037 1
454 . 1 . 1 73 73 GLU C C 13 173.5219822 . . . . . . . . 708 GLU C . 53037 1
455 . 1 . 1 73 73 GLU CA C 13 53.9001733 0.02335771168 . . . . . . . 708 GLU CA . 53037 1
456 . 1 . 1 73 73 GLU CB C 13 27.73935527 0.02951145175 . . . . . . . 708 GLU CB . 53037 1
457 . 1 . 1 73 73 GLU CG C 13 33.62629745 . . . . . . . . 708 GLU CG . 53037 1
458 . 1 . 1 73 73 GLU N N 15 122.7741507 0.01842363557 . . . . . . . 708 GLU N . 53037 1
459 . 1 . 1 74 74 GLU H H 1 8.343483964 0.001598911682 . . . . . . . 709 GLU H . 53037 1
460 . 1 . 1 74 74 GLU HA H 1 4.175092782 . . . . . . . . 709 GLU HA . 53037 1
461 . 1 . 1 74 74 GLU C C 13 173.1034104 . . . . . . . . 709 GLU C . 53037 1
462 . 1 . 1 74 74 GLU CA C 13 53.62286164 . . . . . . . . 709 GLU CA . 53037 1
463 . 1 . 1 74 74 GLU CB C 13 27.8549683 . . . . . . . . 709 GLU CB . 53037 1
464 . 1 . 1 74 74 GLU CG C 13 33.5854359 . . . . . . . . 709 GLU CG . 53037 1
465 . 1 . 1 74 74 GLU N N 15 121.7892058 0.02692608142 . . . . . . . 709 GLU N . 53037 1
466 . 1 . 1 75 75 ASP H H 1 8.366443979 0.0006452327979 . . . . . . . 710 ASP H . 53037 1
467 . 1 . 1 75 75 ASP HA H 1 4.77198587 . . . . . . . . 710 ASP HA . 53037 1
468 . 1 . 1 75 75 ASP CA C 13 49.22404689 . . . . . . . . 710 ASP CA . 53037 1
469 . 1 . 1 75 75 ASP CB C 13 38.88344615 . . . . . . . . 710 ASP CB . 53037 1
470 . 1 . 1 75 75 ASP N N 15 123.406068 0.03337389112 . . . . . . . 710 ASP N . 53037 1
471 . 1 . 1 76 76 PRO C C 13 174.597139 . . . . . . . . 711 PRO C . 53037 1
472 . 1 . 1 76 76 PRO CA C 13 61.11560742 0.02036235273 . . . . . . . 711 PRO CA . 53037 1
473 . 1 . 1 76 76 PRO CB C 13 29.46365128 0.01965412145 . . . . . . . 711 PRO CB . 53037 1
474 . 1 . 1 76 76 PRO CG C 13 24.25834563 . . . . . . . . 711 PRO CG . 53037 1
475 . 1 . 1 76 76 PRO CD C 13 48.31032266 . . . . . . . . 711 PRO CD . 53037 1
476 . 1 . 1 77 77 ASN H H 1 8.51119582 0.001871299145 . . . . . . . 712 ASN H . 53037 1
477 . 1 . 1 77 77 ASN HA H 1 4.622552813 . . . . . . . . 712 ASN HA . 53037 1
478 . 1 . 1 77 77 ASN C C 13 173.1238589 . . . . . . . . 712 ASN C . 53037 1
479 . 1 . 1 77 77 ASN CA C 13 51.13491232 0.02825949222 . . . . . . . 712 ASN CA . 53037 1
480 . 1 . 1 77 77 ASN CB C 13 36.0142148 0.02672737278 . . . . . . . 712 ASN CB . 53037 1
481 . 1 . 1 77 77 ASN N N 15 117.1681304 0.04709182672 . . . . . . . 712 ASN N . 53037 1
482 . 1 . 1 78 78 THR H H 1 7.77436408 0.002246122509 . . . . . . . 713 THR H . 53037 1
483 . 1 . 1 78 78 THR HA H 1 4.100730178 . . . . . . . . 713 THR HA . 53037 1
484 . 1 . 1 78 78 THR CA C 13 60.1771386 . . . . . . . . 713 THR CA . 53037 1
485 . 1 . 1 78 78 THR CB C 13 66.82377112 . . . . . . . . 713 THR CB . 53037 1
486 . 1 . 1 78 78 THR N N 15 113.3516249 0.02883870072 . . . . . . . 713 THR N . 53037 1
487 . 1 . 1 79 79 HIS C C 13 172.5533386 . . . . . . . . 714 HIS C . 53037 1
488 . 1 . 1 79 79 HIS CA C 13 53.90009803 0.03364851664 . . . . . . . 714 HIS CA . 53037 1
489 . 1 . 1 79 79 HIS CB C 13 27.86982662 0.03477470853 . . . . . . . 714 HIS CB . 53037 1
490 . 1 . 1 80 80 ILE H H 1 7.73422652 0.001404930741 . . . . . . . 715 ILE H . 53037 1
491 . 1 . 1 80 80 ILE HA H 1 3.921221066 . . . . . . . . 715 ILE HA . 53037 1
492 . 1 . 1 80 80 ILE C C 13 173.0858164 . . . . . . . . 715 ILE C . 53037 1
493 . 1 . 1 80 80 ILE CA C 13 58.66238008 0.03221079218 . . . . . . . 715 ILE CA . 53037 1
494 . 1 . 1 80 80 ILE CB C 13 35.80269535 0.01909988999 . . . . . . . 715 ILE CB . 53037 1
495 . 1 . 1 80 80 ILE CG1 C 13 24.59915382 . . . . . . . . 715 ILE CG1 . 53037 1
496 . 1 . 1 80 80 ILE CG2 C 13 14.54278111 . . . . . . . . 715 ILE CG2 . 53037 1
497 . 1 . 1 80 80 ILE CD1 C 13 10.13071422 . . . . . . . . 715 ILE CD1 . 53037 1
498 . 1 . 1 80 80 ILE N N 15 121.5683665 0.0200190948 . . . . . . . 715 ILE N . 53037 1
499 . 1 . 1 81 81 LEU H H 1 8.066373611 0.0009427287764 . . . . . . . 716 LEU H . 53037 1
500 . 1 . 1 81 81 LEU HA H 1 4.178213658 . . . . . . . . 716 LEU HA . 53037 1
501 . 1 . 1 81 81 LEU C C 13 174.0976272 . . . . . . . . 716 LEU C . 53037 1
502 . 1 . 1 81 81 LEU CA C 13 52.35611361 0.02485314004 . . . . . . . 716 LEU CA . 53037 1
503 . 1 . 1 81 81 LEU CB C 13 39.58393869 0.01132606389 . . . . . . . 716 LEU CB . 53037 1
504 . 1 . 1 81 81 LEU CG C 13 24.20660234 . . . . . . . . 716 LEU CG . 53037 1
505 . 1 . 1 81 81 LEU CD1 C 13 22.04749987 . . . . . . . . 716 LEU CD1 . 53037 1
506 . 1 . 1 81 81 LEU CD2 C 13 20.77405548 . . . . . . . . 716 LEU CD2 . 53037 1
507 . 1 . 1 81 81 LEU N N 15 125.0930925 0.008906424537 . . . . . . . 716 LEU N . 53037 1
508 . 1 . 1 82 82 TYR H H 1 7.944718329 0.0009235361896 . . . . . . . 717 TYR H . 53037 1
509 . 1 . 1 82 82 TYR HA H 1 4.385102017 . . . . . . . . 717 TYR HA . 53037 1
510 . 1 . 1 82 82 TYR CA C 13 55.17917196 . . . . . . . . 717 TYR CA . 53037 1
511 . 1 . 1 82 82 TYR CB C 13 36.12694271 . . . . . . . . 717 TYR CB . 53037 1
512 . 1 . 1 82 82 TYR N N 15 120.3808478 0.01275291615 . . . . . . . 717 TYR N . 53037 1
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