Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 26645
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.03
_Assigned_chem_shift_list.Chem_shift_13C_err 0.25
_Assigned_chem_shift_list.Chem_shift_15N_err 0.1
_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 'From Spectra resolution cross-checked with CCPNMR values'
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D HNCA' . . . 26645 1
2 '2D 1H-15N HSQC' . . . 26645 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 $CCPNMR . . 26645 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 2 2 ALA C C 13 177.806 0.000 . . . . . . 515 A C . 26645 1
2 . 1 1 2 2 ALA CA C 13 52.610 0.011 . . . . . . 515 A CA . 26645 1
3 . 1 1 2 2 ALA CB C 13 19.377 0.000 . . . . . . 515 A CB . 26645 1
4 . 1 1 3 3 MET H H 1 8.524 0.003 . . . . . . 516 M HN . 26645 1
5 . 1 1 3 3 MET C C 13 176.767 0.000 . . . . . . 516 M C . 26645 1
6 . 1 1 3 3 MET CA C 13 55.628 0.024 . . . . . . 516 M CA . 26645 1
7 . 1 1 3 3 MET CB C 13 32.767 0.000 . . . . . . 516 M CB . 26645 1
8 . 1 1 3 3 MET N N 15 119.901 0.130 . . . . . . 516 M N . 26645 1
9 . 1 1 4 4 GLY H H 1 8.421 0.003 . . . . . . 517 G HN . 26645 1
10 . 1 1 4 4 GLY C C 13 176.251 0.000 . . . . . . 517 G C . 26645 1
11 . 1 1 4 4 GLY CA C 13 45.433 0.000 . . . . . . 517 G CA . 26645 1
12 . 1 1 4 4 GLY N N 15 110.200 0.009 . . . . . . 517 G N . 26645 1
13 . 1 1 5 5 CYS H H 1 7.817 0.003 . . . . . . 518 C HN . 26645 1
14 . 1 1 5 5 CYS C C 13 174.455 0.000 . . . . . . 518 C C . 26645 1
15 . 1 1 5 5 CYS CA C 13 55.772 0.000 . . . . . . 518 C CA . 26645 1
16 . 1 1 5 5 CYS CB C 13 29.439 0.000 . . . . . . 518 C CB . 26645 1
17 . 1 1 5 5 CYS N N 15 117.643 0.001 . . . . . . 518 C N . 26645 1
18 . 1 1 6 6 VAL H H 1 8.045 0.002 . . . . . . 519 V HN . 26645 1
19 . 1 1 6 6 VAL C C 13 176.085 0.000 . . . . . . 519 V C . 26645 1
20 . 1 1 6 6 VAL CA C 13 62.398 0.000 . . . . . . 519 V CA . 26645 1
21 . 1 1 6 6 VAL CB C 13 32.632 0.000 . . . . . . 519 V CB . 26645 1
22 . 1 1 6 6 VAL N N 15 121.231 0.012 . . . . . . 519 V N . 26645 1
23 . 1 1 7 7 LYS H H 1 8.419 0.003 . . . . . . 520 K HN . 26645 1
24 . 1 1 7 7 LYS C C 13 176.497 0.000 . . . . . . 520 K C . 26645 1
25 . 1 1 7 7 LYS CA C 13 56.529 0.000 . . . . . . 520 K CA . 26645 1
26 . 1 1 7 7 LYS CB C 13 33.022 0.000 . . . . . . 520 K CB . 26645 1
27 . 1 1 7 7 LYS N N 15 125.545 0.027 . . . . . . 520 K N . 26645 1
28 . 1 1 8 8 SER H H 1 8.318 0.003 . . . . . . 521 S HN . 26645 1
29 . 1 1 8 8 SER C C 13 174.561 0.000 . . . . . . 521 S C . 26645 1
30 . 1 1 8 8 SER CA C 13 58.500 0.011 . . . . . . 521 S CA . 26645 1
31 . 1 1 8 8 SER CB C 13 63.817 0.000 . . . . . . 521 S CB . 26645 1
32 . 1 1 8 8 SER N N 15 117.200 0.027 . . . . . . 521 S N . 26645 1
33 . 1 1 9 9 GLU H H 1 8.499 0.003 . . . . . . 522 E HN . 26645 1
34 . 1 1 9 9 GLU C C 13 176.492 0.000 . . . . . . 522 E C . 26645 1
35 . 1 1 9 9 GLU CA C 13 56.683 0.004 . . . . . . 522 E CA . 26645 1
36 . 1 1 9 9 GLU CB C 13 30.200 0.000 . . . . . . 522 E CB . 26645 1
37 . 1 1 9 9 GLU N N 15 122.770 0.021 . . . . . . 522 E N . 26645 1
38 . 1 1 10 10 MET H H 1 8.304 0.002 . . . . . . 523 M HN . 26645 1
39 . 1 1 10 10 MET C C 13 176.107 0.000 . . . . . . 523 M C . 26645 1
40 . 1 1 10 10 MET CA C 13 55.404 0.000 . . . . . . 523 M CA . 26645 1
41 . 1 1 10 10 MET CB C 13 33.106 0.000 . . . . . . 523 M CB . 26645 1
42 . 1 1 10 10 MET N N 15 120.385 0.080 . . . . . . 523 M N . 26645 1
43 . 1 1 11 11 GLY H H 1 7.869 0.002 . . . . . . 524 G HN . 26645 1
44 . 1 1 11 11 GLY CA C 13 44.743 0.000 . . . . . . 524 G CA . 26645 1
45 . 1 1 11 11 GLY N N 15 109.484 0.017 . . . . . . 524 G N . 26645 1
46 . 1 1 12 12 PRO C C 13 176.678 0.000 . . . . . . 525 P C . 26645 1
47 . 1 1 12 12 PRO CA C 13 63.517 0.006 . . . . . . 525 P CA . 26645 1
48 . 1 1 12 12 PRO CB C 13 31.664 0.000 . . . . . . 525 P CB . 26645 1
49 . 1 1 13 13 TRP H H 1 7.838 0.003 . . . . . . 526 W HN . 26645 1
50 . 1 1 13 13 TRP HE1 H 1 10.182 0.000 . . . . . . 526 W HE1 . 26645 1
51 . 1 1 13 13 TRP C C 13 176.333 0.000 . . . . . . 526 W C . 26645 1
52 . 1 1 13 13 TRP CA C 13 57.566 0.023 . . . . . . 526 W CA . 26645 1
53 . 1 1 13 13 TRP CB C 13 28.879 0.000 . . . . . . 526 W CB . 26645 1
54 . 1 1 13 13 TRP N N 15 119.741 0.025 . . . . . . 526 W N . 26645 1
55 . 1 1 14 14 MET H H 1 7.758 0.003 . . . . . . 527 M HN . 26645 1
56 . 1 1 14 14 MET C C 13 175.742 0.000 . . . . . . 527 M C . 26645 1
57 . 1 1 14 14 MET CA C 13 55.529 0.000 . . . . . . 527 M CA . 26645 1
58 . 1 1 14 14 MET CB C 13 32.913 0.007 . . . . . . 527 M CB . 26645 1
59 . 1 1 14 14 MET N N 15 121.502 0.008 . . . . . . 527 M N . 26645 1
60 . 1 1 15 15 ASP H H 1 8.128 0.002 . . . . . . 528 D HN . 26645 1
61 . 1 1 15 15 ASP C C 13 176.340 0.000 . . . . . . 528 D C . 26645 1
62 . 1 1 15 15 ASP CA C 13 54.838 0.000 . . . . . . 528 D CA . 26645 1
63 . 1 1 15 15 ASP CB C 13 41.213 0.000 . . . . . . 528 D CB . 26645 1
64 . 1 1 15 15 ASP N N 15 120.960 0.025 . . . . . . 528 D N . 26645 1
65 . 1 1 16 16 SER H H 1 8.046 0.002 . . . . . . 529 S HN . 26645 1
66 . 1 1 16 16 SER C C 13 174.184 0.000 . . . . . . 529 S C . 26645 1
67 . 1 1 16 16 SER CA C 13 58.535 0.000 . . . . . . 529 S CA . 26645 1
68 . 1 1 16 16 SER CB C 13 63.749 0.000 . . . . . . 529 S CB . 26645 1
69 . 1 1 16 16 SER N N 15 114.766 0.013 . . . . . . 529 S N . 26645 1
70 . 1 1 17 17 TYR H H 1 8.144 0.004 . . . . . . 530 Y HN . 26645 1
71 . 1 1 17 17 TYR C C 13 175.721 0.000 . . . . . . 530 Y C . 26645 1
72 . 1 1 17 17 TYR CA C 13 55.781 0.000 . . . . . . 530 Y CA . 26645 1
73 . 1 1 17 17 TYR CB C 13 38.828 0.000 . . . . . . 530 Y CB . 26645 1
74 . 1 1 17 17 TYR N N 15 122.316 0.092 . . . . . . 530 Y N . 26645 1
75 . 1 1 18 18 SER H H 1 8.159 0.003 . . . . . . 531 S HN . 26645 1
76 . 1 1 18 18 SER C C 13 174.174 0.000 . . . . . . 531 S C . 26645 1
77 . 1 1 18 18 SER CA C 13 58.014 0.024 . . . . . . 531 S CA . 26645 1
78 . 1 1 18 18 SER CB C 13 64.063 0.000 . . . . . . 531 S CB . 26645 1
79 . 1 1 18 18 SER N N 15 118.129 0.016 . . . . . . 531 S N . 26645 1
80 . 1 1 19 19 GLY H H 1 7.442 0.003 . . . . . . 532 G HN . 26645 1
81 . 1 1 19 19 GLY CA C 13 44.802 0.000 . . . . . . 532 G CA . 26645 1
82 . 1 1 19 19 GLY N N 15 109.987 0.005 . . . . . . 532 G N . 26645 1
83 . 1 1 20 20 PRO C C 13 177.045 0.000 . . . . . . 533 P C . 26645 1
84 . 1 1 20 20 PRO CA C 13 63.548 0.000 . . . . . . 533 P CA . 26645 1
85 . 1 1 20 20 PRO CB C 13 31.798 0.000 . . . . . . 533 P CB . 26645 1
86 . 1 1 21 21 TYR H H 1 8.208 0.002 . . . . . . 534 Y HN . 26645 1
87 . 1 1 21 21 TYR C C 13 176.427 0.000 . . . . . . 534 Y C . 26645 1
88 . 1 1 21 21 TYR CA C 13 57.710 0.026 . . . . . . 534 Y CA . 26645 1
89 . 1 1 21 21 TYR CB C 13 38.432 0.000 . . . . . . 534 Y CB . 26645 1
90 . 1 1 21 21 TYR N N 15 119.636 0.232 . . . . . . 534 Y N . 26645 1
91 . 1 1 22 22 GLY H H 1 8.055 0.002 . . . . . . 535 G HN . 26645 1
92 . 1 1 22 22 GLY C C 13 173.812 0.000 . . . . . . 535 G C . 26645 1
93 . 1 1 22 22 GLY CA C 13 45.593 0.016 . . . . . . 535 G CA . 26645 1
94 . 1 1 22 22 GLY N N 15 109.640 0.022 . . . . . . 535 G N . 26645 1
95 . 1 1 23 23 ASP H H 1 8.169 0.002 . . . . . . 536 D HN . 26645 1
96 . 1 1 23 23 ASP C C 13 176.462 0.000 . . . . . . 536 D C . 26645 1
97 . 1 1 23 23 ASP CA C 13 54.323 0.009 . . . . . . 536 D CA . 26645 1
98 . 1 1 23 23 ASP CB C 13 41.147 0.000 . . . . . . 536 D CB . 26645 1
99 . 1 1 23 23 ASP N N 15 120.329 0.019 . . . . . . 536 D N . 26645 1
100 . 1 1 24 24 MET H H 1 8.294 0.002 . . . . . . 537 M HN . 26645 1
101 . 1 1 24 24 MET C C 13 176.366 0.000 . . . . . . 537 M C . 26645 1
102 . 1 1 24 24 MET CA C 13 55.980 0.000 . . . . . . 537 M CA . 26645 1
103 . 1 1 24 24 MET CB C 13 32.425 0.000 . . . . . . 537 M CB . 26645 1
104 . 1 1 24 24 MET N N 15 120.962 0.042 . . . . . . 537 M N . 26645 1
105 . 1 1 25 25 ARG H H 1 8.279 0.005 . . . . . . 538 R HN . 26645 1
106 . 1 1 25 25 ARG C C 13 176.394 0.000 . . . . . . 538 R C . 26645 1
107 . 1 1 25 25 ARG CA C 13 56.493 0.002 . . . . . . 538 R CA . 26645 1
108 . 1 1 25 25 ARG CB C 13 30.435 0.000 . . . . . . 538 R CB . 26645 1
109 . 1 1 25 25 ARG N N 15 121.372 0.035 . . . . . . 538 R N . 26645 1
110 . 1 1 26 26 LEU H H 1 8.156 0.003 . . . . . . 539 L HN . 26645 1
111 . 1 1 26 26 LEU C C 13 177.599 0.000 . . . . . . 539 L C . 26645 1
112 . 1 1 26 26 LEU CA C 13 55.370 0.000 . . . . . . 539 L CA . 26645 1
113 . 1 1 26 26 LEU CB C 13 42.313 0.000 . . . . . . 539 L CB . 26645 1
114 . 1 1 26 26 LEU N N 15 122.413 0.014 . . . . . . 539 L N . 26645 1
115 . 1 1 27 27 GLU H H 1 8.444 0.017 . . . . . . 540 E HN . 26645 1
116 . 1 1 27 27 GLU C C 13 176.795 0.000 . . . . . . 540 E C . 26645 1
117 . 1 1 27 27 GLU CA C 13 57.083 0.000 . . . . . . 540 E CA . 26645 1
118 . 1 1 27 27 GLU CB C 13 30.122 0.000 . . . . . . 540 E CB . 26645 1
119 . 1 1 27 27 GLU N N 15 121.352 0.178 . . . . . . 540 E N . 26645 1
120 . 1 1 28 28 THR H H 1 8.007 0.002 . . . . . . 541 T HN . 26645 1
121 . 1 1 28 28 THR C C 13 174.461 0.000 . . . . . . 541 T C . 26645 1
122 . 1 1 28 28 THR CA C 13 61.995 0.000 . . . . . . 541 T CA . 26645 1
123 . 1 1 28 28 THR CB C 13 69.788 0.000 . . . . . . 541 T CB . 26645 1
124 . 1 1 28 28 THR N N 15 113.935 0.020 . . . . . . 541 T N . 26645 1
125 . 1 1 29 29 ALA H H 1 8.201 0.002 . . . . . . 542 A HN . 26645 1
126 . 1 1 29 29 ALA C C 13 177.769 0.000 . . . . . . 542 A C . 26645 1
127 . 1 1 29 29 ALA CA C 13 52.779 0.033 . . . . . . 542 A CA . 26645 1
128 . 1 1 29 29 ALA CB C 13 19.175 0.000 . . . . . . 542 A CB . 26645 1
129 . 1 1 29 29 ALA N N 15 125.933 0.027 . . . . . . 542 A N . 26645 1
130 . 1 1 30 30 ARG H H 1 8.184 0.002 . . . . . . 543 R HN . 26645 1
131 . 1 1 30 30 ARG C C 13 176.083 0.000 . . . . . . 543 R C . 26645 1
132 . 1 1 30 30 ARG CA C 13 56.322 0.000 . . . . . . 543 R CA . 26645 1
133 . 1 1 30 30 ARG CB C 13 30.794 0.000 . . . . . . 543 R CB . 26645 1
134 . 1 1 30 30 ARG N N 15 119.718 0.029 . . . . . . 543 R N . 26645 1
135 . 1 1 31 31 ASP H H 1 8.206 0.003 . . . . . . 544 D HN . 26645 1
136 . 1 1 31 31 ASP C C 13 176.317 0.000 . . . . . . 544 D C . 26645 1
137 . 1 1 31 31 ASP CA C 13 54.492 0.000 . . . . . . 544 D CA . 26645 1
138 . 1 1 31 31 ASP CB C 13 41.173 0.000 . . . . . . 544 D CB . 26645 1
139 . 1 1 31 31 ASP N N 15 119.881 0.028 . . . . . . 544 D N . 26645 1
140 . 1 1 32 32 HIS H H 1 8.302 0.004 . . . . . . 545 H HN . 26645 1
141 . 1 1 32 32 HIS C C 13 174.610 0.000 . . . . . . 545 H C . 26645 1
142 . 1 1 32 32 HIS CA C 13 58.314 0.015 . . . . . . 545 H CA . 26645 1
143 . 1 1 32 32 HIS CB C 13 28.185 0.000 . . . . . . 545 H CB . 26645 1
144 . 1 1 32 32 HIS N N 15 120.380 0.034 . . . . . . 545 H N . 26645 1
145 . 1 1 33 33 VAL H H 1 8.262 0.003 . . . . . . 546 V HN . 26645 1
146 . 1 1 33 33 VAL C C 13 175.749 0.000 . . . . . . 546 V C . 26645 1
147 . 1 1 33 33 VAL CA C 13 62.441 0.000 . . . . . . 546 V CA . 26645 1
148 . 1 1 33 33 VAL CB C 13 32.666 0.005 . . . . . . 546 V CB . 26645 1
149 . 1 1 33 33 VAL N N 15 122.896 0.018 . . . . . . 546 V N . 26645 1
150 . 1 1 34 34 LEU H H 1 8.291 0.003 . . . . . . 547 L HN . 26645 1
151 . 1 1 34 34 LEU CA C 13 52.819 0.000 . . . . . . 547 L CA . 26645 1
152 . 1 1 34 34 LEU N N 15 127.160 0.018 . . . . . . 547 L N . 26645 1
153 . 1 1 35 35 PRO C C 13 177.058 0.000 . . . . . . 548 P C . 26645 1
154 . 1 1 35 35 PRO CA C 13 62.986 0.021 . . . . . . 548 P CA . 26645 1
155 . 1 1 35 35 PRO CB C 13 32.005 0.000 . . . . . . 548 P CB . 26645 1
156 . 1 1 36 36 ILE H H 1 8.109 0.001 . . . . . . 549 I HN . 26645 1
157 . 1 1 36 36 ILE C C 13 175.825 0.000 . . . . . . 549 I C . 26645 1
158 . 1 1 36 36 ILE CA C 13 61.774 0.015 . . . . . . 549 I CA . 26645 1
159 . 1 1 36 36 ILE CB C 13 38.845 0.000 . . . . . . 549 I CB . 26645 1
160 . 1 1 36 36 ILE N N 15 119.962 0.024 . . . . . . 549 I N . 26645 1
161 . 1 1 37 37 ASP H H 1 8.208 0.002 . . . . . . 550 D HN . 26645 1
162 . 1 1 37 37 ASP C C 13 175.687 0.000 . . . . . . 550 D C . 26645 1
163 . 1 1 37 37 ASP CA C 13 54.033 0.037 . . . . . . 550 D CA . 26645 1
164 . 1 1 37 37 ASP CB C 13 40.921 0.000 . . . . . . 550 D CB . 26645 1
165 . 1 1 37 37 ASP N N 15 121.734 0.014 . . . . . . 550 D N . 26645 1
166 . 1 1 38 38 TYR H H 1 7.819 0.003 . . . . . . 551 Y HN . 26645 1
167 . 1 1 38 38 TYR C C 13 174.975 0.000 . . . . . . 551 Y C . 26645 1
168 . 1 1 38 38 TYR CA C 13 58.466 0.016 . . . . . . 551 Y CA . 26645 1
169 . 1 1 38 38 TYR CB C 13 39.008 0.000 . . . . . . 551 Y CB . 26645 1
170 . 1 1 38 38 TYR N N 15 120.073 0.011 . . . . . . 551 Y N . 26645 1
171 . 1 1 39 39 TYR H H 1 7.856 0.003 . . . . . . 552 Y HN . 26645 1
172 . 1 1 39 39 TYR C C 13 174.263 0.000 . . . . . . 552 Y C . 26645 1
173 . 1 1 39 39 TYR CA C 13 57.862 0.014 . . . . . . 552 Y CA . 26645 1
174 . 1 1 39 39 TYR CB C 13 39.057 0.000 . . . . . . 552 Y CB . 26645 1
175 . 1 1 39 39 TYR N N 15 121.303 0.019 . . . . . . 552 Y N . 26645 1
176 . 1 1 40 40 PHE H H 1 7.825 0.003 . . . . . . 553 F HN . 26645 1
177 . 1 1 40 40 PHE CA C 13 54.997 0.000 . . . . . . 553 F CA . 26645 1
178 . 1 1 40 40 PHE N N 15 123.643 0.023 . . . . . . 553 F N . 26645 1
179 . 1 1 42 42 PRO C C 13 177.087 0.000 . . . . . . 555 P C . 26645 1
180 . 1 1 42 42 PRO CA C 13 63.296 0.022 . . . . . . 555 P CA . 26645 1
181 . 1 1 42 42 PRO CB C 13 31.998 0.000 . . . . . . 555 P CB . 26645 1
182 . 1 1 43 43 GLN H H 1 8.489 0.002 . . . . . . 556 Q HN . 26645 1
183 . 1 1 43 43 GLN C C 13 175.861 0.000 . . . . . . 556 Q C . 26645 1
184 . 1 1 43 43 GLN CA C 13 56.123 0.001 . . . . . . 556 Q CA . 26645 1
185 . 1 1 43 43 GLN CB C 13 29.333 0.000 . . . . . . 556 Q CB . 26645 1
186 . 1 1 43 43 GLN N N 15 119.680 0.026 . . . . . . 556 Q N . 26645 1
187 . 1 1 44 44 LYS H H 1 8.472 0.004 . . . . . . 557 K HN . 26645 1
188 . 1 1 44 44 LYS C C 13 176.143 0.000 . . . . . . 557 K C . 26645 1
189 . 1 1 44 44 LYS CA C 13 55.565 0.002 . . . . . . 557 K CA . 26645 1
190 . 1 1 44 44 LYS CB C 13 33.576 0.000 . . . . . . 557 K CB . 26645 1
191 . 1 1 44 44 LYS N N 15 121.744 0.129 . . . . . . 557 K N . 26645 1
192 . 1 1 45 45 THR H H 1 7.873 0.003 . . . . . . 558 T HN . 26645 1
193 . 1 1 45 45 THR C C 13 172.639 0.000 . . . . . . 558 T C . 26645 1
194 . 1 1 45 45 THR CA C 13 60.772 0.003 . . . . . . 558 T CA . 26645 1
195 . 1 1 45 45 THR CB C 13 71.263 0.000 . . . . . . 558 T CB . 26645 1
196 . 1 1 45 45 THR N N 15 114.947 0.016 . . . . . . 558 T N . 26645 1
197 . 1 1 46 46 CYS H H 1 9.353 0.002 . . . . . . 559 C HN . 26645 1
198 . 1 1 46 46 CYS C C 13 177.834 0.000 . . . . . . 559 C C . 26645 1
199 . 1 1 46 46 CYS CA C 13 59.419 0.003 . . . . . . 559 C CA . 26645 1
200 . 1 1 46 46 CYS CB C 13 30.724 0.000 . . . . . . 559 C CB . 26645 1
201 . 1 1 46 46 CYS N N 15 123.684 0.034 . . . . . . 559 C N . 26645 1
202 . 1 1 47 47 LEU H H 1 8.777 0.002 . . . . . . 560 L HN . 26645 1
203 . 1 1 47 47 LEU C C 13 176.071 0.000 . . . . . . 560 L C . 26645 1
204 . 1 1 47 47 LEU CA C 13 57.226 0.028 . . . . . . 560 L CA . 26645 1
205 . 1 1 47 47 LEU CB C 13 42.720 0.000 . . . . . . 560 L CB . 26645 1
206 . 1 1 47 47 LEU N N 15 132.470 0.041 . . . . . . 560 L N . 26645 1
207 . 1 1 48 48 ILE H H 1 9.146 0.003 . . . . . . 561 I HN . 26645 1
208 . 1 1 48 48 ILE C C 13 176.391 0.000 . . . . . . 561 I C . 26645 1
209 . 1 1 48 48 ILE CA C 13 62.909 0.012 . . . . . . 561 I CA . 26645 1
210 . 1 1 48 48 ILE CB C 13 35.932 0.000 . . . . . . 561 I CB . 26645 1
211 . 1 1 48 48 ILE N N 15 120.985 0.030 . . . . . . 561 I N . 26645 1
212 . 1 1 49 49 CYS H H 1 8.342 0.004 . . . . . . 562 C HN . 26645 1
213 . 1 1 49 49 CYS C C 13 175.997 0.000 . . . . . . 562 C C . 26645 1
214 . 1 1 49 49 CYS CA C 13 58.019 0.004 . . . . . . 562 C CA . 26645 1
215 . 1 1 49 49 CYS CB C 13 34.493 0.000 . . . . . . 562 C CB . 26645 1
216 . 1 1 49 49 CYS N N 15 116.573 0.008 . . . . . . 562 C N . 26645 1
217 . 1 1 50 50 GLY H H 1 7.807 0.003 . . . . . . 563 G HN . 26645 1
218 . 1 1 50 50 GLY C C 13 173.888 0.000 . . . . . . 563 G C . 26645 1
219 . 1 1 50 50 GLY CA C 13 46.400 0.007 . . . . . . 563 G CA . 26645 1
220 . 1 1 50 50 GLY N N 15 110.515 0.022 . . . . . . 563 G N . 26645 1
221 . 1 1 51 51 ASP H H 1 8.757 0.002 . . . . . . 564 D HN . 26645 1
222 . 1 1 51 51 ASP C C 13 173.914 0.000 . . . . . . 564 D C . 26645 1
223 . 1 1 51 51 ASP CA C 13 53.202 0.011 . . . . . . 564 D CA . 26645 1
224 . 1 1 51 51 ASP CB C 13 42.395 0.000 . . . . . . 564 D CB . 26645 1
225 . 1 1 51 51 ASP N N 15 121.831 0.125 . . . . . . 564 D N . 26645 1
226 . 1 1 52 52 GLU H H 1 8.886 0.000 . . . . . . 565 E HN . 26645 1
227 . 1 1 52 52 GLU C C 13 176.161 0.000 . . . . . . 565 E C . 26645 1
228 . 1 1 52 52 GLU CA C 13 57.663 0.013 . . . . . . 565 E CA . 26645 1
229 . 1 1 52 52 GLU CB C 13 29.824 0.000 . . . . . . 565 E CB . 26645 1
230 . 1 1 52 52 GLU N N 15 121.980 0.148 . . . . . . 565 E N . 26645 1
231 . 1 1 53 53 ALA H H 1 8.280 0.002 . . . . . . 566 A HN . 26645 1
232 . 1 1 53 53 ALA C C 13 176.701 0.000 . . . . . . 566 A C . 26645 1
233 . 1 1 53 53 ALA CA C 13 51.564 0.021 . . . . . . 566 A CA . 26645 1
234 . 1 1 53 53 ALA CB C 13 19.519 0.000 . . . . . . 566 A CB . 26645 1
235 . 1 1 53 53 ALA N N 15 126.588 0.039 . . . . . . 566 A N . 26645 1
236 . 1 1 54 54 SER H H 1 9.153 0.003 . . . . . . 567 S HN . 26645 1
237 . 1 1 54 54 SER C C 13 174.820 0.000 . . . . . . 567 S C . 26645 1
238 . 1 1 54 54 SER CA C 13 57.381 0.033 . . . . . . 567 S CA . 26645 1
239 . 1 1 54 54 SER CB C 13 64.725 0.000 . . . . . . 567 S CB . 26645 1
240 . 1 1 54 54 SER N N 15 114.751 0.025 . . . . . . 567 S N . 26645 1
241 . 1 1 55 55 GLY H H 1 7.619 0.002 . . . . . . 568 G HN . 26645 1
242 . 1 1 55 55 GLY C C 13 175.827 0.000 . . . . . . 568 G C . 26645 1
243 . 1 1 55 55 GLY CA C 13 44.564 0.007 . . . . . . 568 G CA . 26645 1
244 . 1 1 55 55 GLY N N 15 108.793 0.033 . . . . . . 568 G N . 26645 1
245 . 1 1 56 56 CYS H H 1 8.138 0.000 . . . . . . 569 C HN . 26645 1
246 . 1 1 56 56 CYS C C 13 173.928 0.000 . . . . . . 569 C C . 26645 1
247 . 1 1 56 56 CYS CA C 13 57.639 0.050 . . . . . . 569 C CA . 26645 1
248 . 1 1 56 56 CYS CB C 13 26.345 0.000 . . . . . . 569 C CB . 26645 1
249 . 1 1 56 56 CYS N N 15 118.992 0.000 . . . . . . 569 C N . 26645 1
250 . 1 1 57 57 HIS H H 1 8.873 0.003 . . . . . . 570 H HN . 26645 1
251 . 1 1 57 57 HIS C C 13 173.816 0.000 . . . . . . 570 H C . 26645 1
252 . 1 1 57 57 HIS CA C 13 55.029 0.013 . . . . . . 570 H CA . 26645 1
253 . 1 1 57 57 HIS CB C 13 31.710 0.000 . . . . . . 570 H CB . 26645 1
254 . 1 1 57 57 HIS N N 15 126.551 0.081 . . . . . . 570 H N . 26645 1
255 . 1 1 58 58 TYR H H 1 8.773 0.002 . . . . . . 571 Y HN . 26645 1
256 . 1 1 58 58 TYR C C 13 174.642 0.000 . . . . . . 571 Y C . 26645 1
257 . 1 1 58 58 TYR CA C 13 58.649 0.024 . . . . . . 571 Y CA . 26645 1
258 . 1 1 58 58 TYR CB C 13 35.178 0.000 . . . . . . 571 Y CB . 26645 1
259 . 1 1 58 58 TYR N N 15 118.016 0.025 . . . . . . 571 Y N . 26645 1
260 . 1 1 59 59 GLY H H 1 8.064 0.002 . . . . . . 572 G HN . 26645 1
261 . 1 1 59 59 GLY C C 13 174.477 0.000 . . . . . . 572 G C . 26645 1
262 . 1 1 59 59 GLY CA C 13 44.721 0.007 . . . . . . 572 G CA . 26645 1
263 . 1 1 59 59 GLY N N 15 100.813 0.019 . . . . . . 572 G N . 26645 1
264 . 1 1 60 60 ALA H H 1 7.775 0.003 . . . . . . 573 A HN . 26645 1
265 . 1 1 60 60 ALA C C 13 175.293 0.000 . . . . . . 573 A C . 26645 1
266 . 1 1 60 60 ALA CA C 13 50.679 0.007 . . . . . . 573 A CA . 26645 1
267 . 1 1 60 60 ALA CB C 13 23.023 0.000 . . . . . . 573 A CB . 26645 1
268 . 1 1 60 60 ALA N N 15 122.091 0.031 . . . . . . 573 A N . 26645 1
269 . 1 1 61 61 LEU H H 1 8.039 0.002 . . . . . . 574 L HN . 26645 1
270 . 1 1 61 61 LEU C C 13 175.214 0.000 . . . . . . 574 L C . 26645 1
271 . 1 1 61 61 LEU CA C 13 55.790 0.039 . . . . . . 574 L CA . 26645 1
272 . 1 1 61 61 LEU CB C 13 41.820 0.000 . . . . . . 574 L CB . 26645 1
273 . 1 1 61 61 LEU N N 15 124.495 0.039 . . . . . . 574 L N . 26645 1
274 . 1 1 62 62 THR H H 1 8.491 0.003 . . . . . . 575 T HN . 26645 1
275 . 1 1 62 62 THR C C 13 175.143 0.000 . . . . . . 575 T C . 26645 1
276 . 1 1 62 62 THR CA C 13 59.400 0.017 . . . . . . 575 T CA . 26645 1
277 . 1 1 62 62 THR CB C 13 74.537 0.000 . . . . . . 575 T CB . 26645 1
278 . 1 1 62 62 THR N N 15 116.116 0.029 . . . . . . 575 T N . 26645 1
279 . 1 1 63 63 CYS H H 1 9.211 0.004 . . . . . . 576 C HN . 26645 1
280 . 1 1 63 63 CYS C C 13 176.806 0.000 . . . . . . 576 C C . 26645 1
281 . 1 1 63 63 CYS CA C 13 57.746 0.072 . . . . . . 576 C CA . 26645 1
282 . 1 1 63 63 CYS CB C 13 33.035 0.000 . . . . . . 576 C CB . 26645 1
283 . 1 1 63 63 CYS N N 15 117.275 0.033 . . . . . . 576 C N . 26645 1
284 . 1 1 64 64 GLY H H 1 9.084 0.004 . . . . . . 577 G HN . 26645 1
285 . 1 1 64 64 GLY C C 13 175.548 0.000 . . . . . . 577 G C . 26645 1
286 . 1 1 64 64 GLY CA C 13 47.313 0.024 . . . . . . 577 G CA . 26645 1
287 . 1 1 64 64 GLY N N 15 108.425 0.042 . . . . . . 577 G N . 26645 1
288 . 1 1 65 65 SER H H 1 8.087 0.002 . . . . . . 578 S HN . 26645 1
289 . 1 1 65 65 SER C C 13 179.176 0.000 . . . . . . 578 S C . 26645 1
290 . 1 1 65 65 SER CA C 13 61.460 0.021 . . . . . . 578 S CA . 26645 1
291 . 1 1 65 65 SER CB C 13 62.883 0.000 . . . . . . 578 S CB . 26645 1
292 . 1 1 65 65 SER N N 15 117.263 0.015 . . . . . . 578 S N . 26645 1
293 . 1 1 66 66 CYS H H 1 9.490 0.002 . . . . . . 579 C HN . 26645 1
294 . 1 1 66 66 CYS C C 13 176.679 0.000 . . . . . . 579 C C . 26645 1
295 . 1 1 66 66 CYS CA C 13 65.309 0.030 . . . . . . 579 C CA . 26645 1
296 . 1 1 66 66 CYS CB C 13 28.931 0.000 . . . . . . 579 C CB . 26645 1
297 . 1 1 66 66 CYS N N 15 125.357 0.037 . . . . . . 579 C N . 26645 1
298 . 1 1 67 67 LYS H H 1 7.760 0.004 . . . . . . 580 K HN . 26645 1
299 . 1 1 67 67 LYS C C 13 177.103 0.000 . . . . . . 580 K C . 26645 1
300 . 1 1 67 67 LYS CA C 13 60.824 0.021 . . . . . . 580 K CA . 26645 1
301 . 1 1 67 67 LYS CB C 13 32.229 0.000 . . . . . . 580 K CB . 26645 1
302 . 1 1 67 67 LYS N N 15 119.798 0.104 . . . . . . 580 K N . 26645 1
303 . 1 1 68 68 VAL H H 1 7.504 0.002 . . . . . . 581 V HN . 26645 1
304 . 1 1 68 68 VAL C C 13 178.052 0.000 . . . . . . 581 V C . 26645 1
305 . 1 1 68 68 VAL CA C 13 65.964 0.004 . . . . . . 581 V CA . 26645 1
306 . 1 1 68 68 VAL CB C 13 31.955 0.000 . . . . . . 581 V CB . 26645 1
307 . 1 1 68 68 VAL N N 15 116.745 0.024 . . . . . . 581 V N . 26645 1
308 . 1 1 69 69 PHE H H 1 8.308 0.030 . . . . . . 582 F HN . 26645 1
309 . 1 1 69 69 PHE C C 13 176.531 0.000 . . . . . . 582 F C . 26645 1
310 . 1 1 69 69 PHE CA C 13 61.214 0.023 . . . . . . 582 F CA . 26645 1
311 . 1 1 69 69 PHE CB C 13 39.412 0.000 . . . . . . 582 F CB . 26645 1
312 . 1 1 69 69 PHE N N 15 120.184 0.538 . . . . . . 582 F N . 26645 1
313 . 1 1 70 70 PHE H H 1 8.623 0.001 . . . . . . 583 F HN . 26645 1
314 . 1 1 70 70 PHE C C 13 175.616 0.000 . . . . . . 583 F C . 26645 1
315 . 1 1 70 70 PHE CA C 13 62.315 0.031 . . . . . . 583 F CA . 26645 1
316 . 1 1 70 70 PHE CB C 13 39.432 0.000 . . . . . . 583 F CB . 26645 1
317 . 1 1 70 70 PHE N N 15 120.046 0.021 . . . . . . 583 F N . 26645 1
318 . 1 1 71 71 LYS H H 1 7.766 0.003 . . . . . . 584 K HN . 26645 1
319 . 1 1 71 71 LYS C C 13 177.711 0.000 . . . . . . 584 K C . 26645 1
320 . 1 1 71 71 LYS CA C 13 59.774 0.003 . . . . . . 584 K CA . 26645 1
321 . 1 1 71 71 LYS CB C 13 32.683 0.000 . . . . . . 584 K CB . 26645 1
322 . 1 1 71 71 LYS N N 15 117.557 0.028 . . . . . . 584 K N . 26645 1
323 . 1 1 72 72 ARG H H 1 7.583 0.002 . . . . . . 585 R HN . 26645 1
324 . 1 1 72 72 ARG C C 13 179.432 0.000 . . . . . . 585 R C . 26645 1
325 . 1 1 72 72 ARG CA C 13 58.500 0.001 . . . . . . 585 R CA . 26645 1
326 . 1 1 72 72 ARG CB C 13 30.203 0.000 . . . . . . 585 R CB . 26645 1
327 . 1 1 72 72 ARG N N 15 114.576 0.016 . . . . . . 585 R N . 26645 1
328 . 1 1 73 73 ALA H H 1 8.071 0.002 . . . . . . 586 A HN . 26645 1
329 . 1 1 73 73 ALA C C 13 179.921 0.000 . . . . . . 586 A C . 26645 1
330 . 1 1 73 73 ALA CA C 13 54.149 0.000 . . . . . . 586 A CA . 26645 1
331 . 1 1 73 73 ALA CB C 13 19.607 0.000 . . . . . . 586 A CB . 26645 1
332 . 1 1 73 73 ALA N N 15 122.021 0.032 . . . . . . 586 A N . 26645 1
333 . 1 1 74 74 ALA H H 1 8.510 0.002 . . . . . . 587 A HN . 26645 1
334 . 1 1 74 74 ALA C C 13 180.303 0.000 . . . . . . 587 A C . 26645 1
335 . 1 1 74 74 ALA CA C 13 54.233 0.041 . . . . . . 587 A CA . 26645 1
336 . 1 1 74 74 ALA CB C 13 18.054 0.000 . . . . . . 587 A CB . 26645 1
337 . 1 1 74 74 ALA N N 15 120.187 0.014 . . . . . . 587 A N . 26645 1
338 . 1 1 75 75 GLU H H 1 7.838 0.003 . . . . . . 588 E HN . 26645 1
339 . 1 1 75 75 GLU C C 13 178.168 0.000 . . . . . . 588 E C . 26645 1
340 . 1 1 75 75 GLU CA C 13 58.118 0.014 . . . . . . 588 E CA . 26645 1
341 . 1 1 75 75 GLU CB C 13 29.577 0.000 . . . . . . 588 E CB . 26645 1
342 . 1 1 75 75 GLU N N 15 116.687 0.024 . . . . . . 588 E N . 26645 1
343 . 1 1 76 76 GLY H H 1 7.477 0.002 . . . . . . 589 G HN . 26645 1
344 . 1 1 76 76 GLY C C 13 173.907 0.000 . . . . . . 589 G C . 26645 1
345 . 1 1 76 76 GLY CA C 13 45.450 0.034 . . . . . . 589 G CA . 26645 1
346 . 1 1 76 76 GLY N N 15 105.175 0.017 . . . . . . 589 G N . 26645 1
347 . 1 1 77 77 LYS H H 1 7.787 0.003 . . . . . . 590 K HN . 26645 1
348 . 1 1 77 77 LYS C C 13 176.370 0.000 . . . . . . 590 K C . 26645 1
349 . 1 1 77 77 LYS CA C 13 56.836 0.018 . . . . . . 590 K CA . 26645 1
350 . 1 1 77 77 LYS CB C 13 30.791 0.000 . . . . . . 590 K CB . 26645 1
351 . 1 1 77 77 LYS N N 15 117.304 0.016 . . . . . . 590 K N . 26645 1
352 . 1 1 78 78 GLN H H 1 7.977 0.002 . . . . . . 591 Q HN . 26645 1
353 . 1 1 78 78 GLN C C 13 174.984 0.000 . . . . . . 591 Q C . 26645 1
354 . 1 1 78 78 GLN CA C 13 55.762 0.084 . . . . . . 591 Q CA . 26645 1
355 . 1 1 78 78 GLN CB C 13 29.287 0.000 . . . . . . 591 Q CB . 26645 1
356 . 1 1 78 78 GLN N N 15 117.750 0.025 . . . . . . 591 Q N . 26645 1
357 . 1 1 79 79 LYS H H 1 8.147 0.000 . . . . . . 592 K HN . 26645 1
358 . 1 1 79 79 LYS C C 13 175.515 0.000 . . . . . . 592 K C . 26645 1
359 . 1 1 79 79 LYS CA C 13 54.885 0.031 . . . . . . 592 K CA . 26645 1
360 . 1 1 79 79 LYS CB C 13 33.052 0.000 . . . . . . 592 K CB . 26645 1
361 . 1 1 79 79 LYS N N 15 122.300 0.020 . . . . . . 592 K N . 26645 1
362 . 1 1 80 80 TYR H H 1 8.374 0.003 . . . . . . 593 Y HN . 26645 1
363 . 1 1 80 80 TYR C C 13 175.223 0.000 . . . . . . 593 Y C . 26645 1
364 . 1 1 80 80 TYR CA C 13 56.508 0.006 . . . . . . 593 Y CA . 26645 1
365 . 1 1 80 80 TYR CB C 13 40.350 0.000 . . . . . . 593 Y CB . 26645 1
366 . 1 1 80 80 TYR N N 15 122.559 0.017 . . . . . . 593 Y N . 26645 1
367 . 1 1 81 81 LEU H H 1 8.788 0.002 . . . . . . 594 L HN . 26645 1
368 . 1 1 81 81 LEU C C 13 176.333 0.000 . . . . . . 594 L C . 26645 1
369 . 1 1 81 81 LEU CA C 13 53.717 0.004 . . . . . . 594 L CA . 26645 1
370 . 1 1 81 81 LEU CB C 13 44.524 0.000 . . . . . . 594 L CB . 26645 1
371 . 1 1 81 81 LEU N N 15 123.630 0.016 . . . . . . 594 L N . 26645 1
372 . 1 1 82 82 CYS H H 1 8.940 0.002 . . . . . . 595 C HN . 26645 1
373 . 1 1 82 82 CYS C C 13 176.088 0.000 . . . . . . 595 C C . 26645 1
374 . 1 1 82 82 CYS CA C 13 60.148 0.002 . . . . . . 595 C CA . 26645 1
375 . 1 1 82 82 CYS CB C 13 30.372 0.000 . . . . . . 595 C CB . 26645 1
376 . 1 1 82 82 CYS N N 15 129.053 0.042 . . . . . . 595 C N . 26645 1
377 . 1 1 83 83 ALA H H 1 9.437 0.002 . . . . . . 596 A HN . 26645 1
378 . 1 1 83 83 ALA C C 13 177.560 0.000 . . . . . . 596 A C . 26645 1
379 . 1 1 83 83 ALA CA C 13 53.107 0.016 . . . . . . 596 A CA . 26645 1
380 . 1 1 83 83 ALA CB C 13 19.153 0.000 . . . . . . 596 A CB . 26645 1
381 . 1 1 83 83 ALA N N 15 133.008 0.043 . . . . . . 596 A N . 26645 1
382 . 1 1 84 84 SER H H 1 9.642 0.003 . . . . . . 597 S HN . 26645 1
383 . 1 1 84 84 SER C C 13 174.215 0.000 . . . . . . 597 S C . 26645 1
384 . 1 1 84 84 SER CA C 13 56.221 0.006 . . . . . . 597 S CA . 26645 1
385 . 1 1 84 84 SER CB C 13 62.571 0.000 . . . . . . 597 S CB . 26645 1
386 . 1 1 84 84 SER N N 15 121.588 0.030 . . . . . . 597 S N . 26645 1
387 . 1 1 85 85 ARG H H 1 8.441 0.004 . . . . . . 598 R HN . 26645 1
388 . 1 1 85 85 ARG C C 13 175.109 0.000 . . . . . . 598 R C . 26645 1
389 . 1 1 85 85 ARG CA C 13 54.959 0.000 . . . . . . 598 R CA . 26645 1
390 . 1 1 85 85 ARG CB C 13 29.591 0.000 . . . . . . 598 R CB . 26645 1
391 . 1 1 85 85 ARG N N 15 124.040 0.005 . . . . . . 598 R N . 26645 1
392 . 1 1 86 86 ASN H H 1 9.358 0.001 . . . . . . 599 N HN . 26645 1
393 . 1 1 86 86 ASN C C 13 174.497 0.000 . . . . . . 599 N C . 26645 1
394 . 1 1 86 86 ASN CA C 13 54.996 0.015 . . . . . . 599 N CA . 26645 1
395 . 1 1 86 86 ASN CB C 13 36.931 0.000 . . . . . . 599 N CB . 26645 1
396 . 1 1 86 86 ASN N N 15 118.615 0.031 . . . . . . 599 N N . 26645 1
397 . 1 1 87 87 ASP H H 1 8.539 0.003 . . . . . . 600 D HN . 26645 1
398 . 1 1 87 87 ASP C C 13 175.877 0.000 . . . . . . 600 D C . 26645 1
399 . 1 1 87 87 ASP CA C 13 53.018 0.022 . . . . . . 600 D CA . 26645 1
400 . 1 1 87 87 ASP CB C 13 40.983 0.000 . . . . . . 600 D CB . 26645 1
401 . 1 1 87 87 ASP N N 15 117.848 0.025 . . . . . . 600 D N . 26645 1
402 . 1 1 88 88 CYS H H 1 8.690 0.001 . . . . . . 601 C HN . 26645 1
403 . 1 1 88 88 CYS C C 13 176.149 0.000 . . . . . . 601 C C . 26645 1
404 . 1 1 88 88 CYS N N 15 123.993 0.022 . . . . . . 601 C N . 26645 1
405 . 1 1 89 89 THR H H 1 8.511 0.005 . . . . . . 602 T HN . 26645 1
406 . 1 1 89 89 THR C C 13 173.146 0.000 . . . . . . 602 T C . 26645 1
407 . 1 1 89 89 THR CA C 13 63.254 0.000 . . . . . . 602 T CA . 26645 1
408 . 1 1 89 89 THR CB C 13 69.198 0.000 . . . . . . 602 T CB . 26645 1
409 . 1 1 89 89 THR N N 15 119.086 0.040 . . . . . . 602 T N . 26645 1
410 . 1 1 90 90 ILE H H 1 8.723 0.004 . . . . . . 603 I HN . 26645 1
411 . 1 1 90 90 ILE N N 15 128.037 0.009 . . . . . . 603 I N . 26645 1
412 . 1 1 91 91 ASP C C 13 177.321 0.000 . . . . . . 604 D C . 26645 1
413 . 1 1 91 91 ASP CA C 13 52.250 0.032 . . . . . . 604 D CA . 26645 1
414 . 1 1 91 91 ASP CB C 13 42.177 0.000 . . . . . . 604 D CB . 26645 1
415 . 1 1 92 92 LYS H H 1 8.338 0.002 . . . . . . 605 K HN . 26645 1
416 . 1 1 92 92 LYS C C 13 176.143 0.000 . . . . . . 605 K C . 26645 1
417 . 1 1 92 92 LYS CA C 13 59.509 0.037 . . . . . . 605 K CA . 26645 1
418 . 1 1 92 92 LYS CB C 13 32.326 0.000 . . . . . . 605 K CB . 26645 1
419 . 1 1 92 92 LYS N N 15 117.986 0.037 . . . . . . 605 K N . 26645 1
420 . 1 1 93 93 PHE H H 1 7.745 0.003 . . . . . . 606 F HN . 26645 1
421 . 1 1 93 93 PHE C C 13 177.947 0.000 . . . . . . 606 F C . 26645 1
422 . 1 1 93 93 PHE CA C 13 58.777 0.036 . . . . . . 606 F CA . 26645 1
423 . 1 1 93 93 PHE CB C 13 39.474 0.000 . . . . . . 606 F CB . 26645 1
424 . 1 1 93 93 PHE N N 15 116.416 0.032 . . . . . . 606 F N . 26645 1
425 . 1 1 94 94 ARG H H 1 8.351 0.003 . . . . . . 607 R HN . 26645 1
426 . 1 1 94 94 ARG C C 13 177.788 0.000 . . . . . . 607 R C . 26645 1
427 . 1 1 94 94 ARG CA C 13 56.429 0.045 . . . . . . 607 R CA . 26645 1
428 . 1 1 94 94 ARG CB C 13 31.329 0.000 . . . . . . 607 R CB . 26645 1
429 . 1 1 94 94 ARG N N 15 117.993 0.038 . . . . . . 607 R N . 26645 1
430 . 1 1 95 95 ARG H H 1 7.978 0.003 . . . . . . 608 R HN . 26645 1
431 . 1 1 95 95 ARG C C 13 175.777 0.000 . . . . . . 608 R C . 26645 1
432 . 1 1 95 95 ARG CA C 13 58.980 0.026 . . . . . . 608 R CA . 26645 1
433 . 1 1 95 95 ARG CB C 13 29.047 0.000 . . . . . . 608 R CB . 26645 1
434 . 1 1 95 95 ARG N N 15 118.969 0.049 . . . . . . 608 R N . 26645 1
435 . 1 1 96 96 LYS H H 1 8.073 0.002 . . . . . . 609 K HN . 26645 1
436 . 1 1 96 96 LYS C C 13 176.953 0.000 . . . . . . 609 K C . 26645 1
437 . 1 1 96 96 LYS CA C 13 57.277 0.006 . . . . . . 609 K CA . 26645 1
438 . 1 1 96 96 LYS CB C 13 32.196 0.000 . . . . . . 609 K CB . 26645 1
439 . 1 1 96 96 LYS N N 15 117.116 0.098 . . . . . . 609 K N . 26645 1
440 . 1 1 97 97 ASN H H 1 7.990 0.002 . . . . . . 610 N HN . 26645 1
441 . 1 1 97 97 ASN CA C 13 55.063 0.000 . . . . . . 610 N CA . 26645 1
442 . 1 1 97 97 ASN N N 15 116.980 0.016 . . . . . . 610 N N . 26645 1
443 . 1 1 99 99 PRO C C 13 177.536 0.000 . . . . . . 612 P C . 26645 1
444 . 1 1 99 99 PRO CA C 13 64.392 0.000 . . . . . . 612 P CA . 26645 1
445 . 1 1 99 99 PRO CB C 13 31.269 0.000 . . . . . . 612 P CB . 26645 1
446 . 1 1 100 100 SER H H 1 7.896 0.003 . . . . . . 613 S HN . 26645 1
447 . 1 1 100 100 SER C C 13 178.553 0.000 . . . . . . 613 S C . 26645 1
448 . 1 1 100 100 SER CA C 13 62.273 0.000 . . . . . . 613 S CA . 26645 1
449 . 1 1 100 100 SER CB C 13 64.038 0.000 . . . . . . 613 S CB . 26645 1
450 . 1 1 100 100 SER N N 15 110.888 0.020 . . . . . . 613 S N . 26645 1
451 . 1 1 101 101 CYS H H 1 9.550 0.002 . . . . . . 614 C HN . 26645 1
452 . 1 1 101 101 CYS C C 13 173.783 0.000 . . . . . . 614 C C . 26645 1
453 . 1 1 101 101 CYS CA C 13 65.079 0.041 . . . . . . 614 C CA . 26645 1
454 . 1 1 101 101 CYS CB C 13 30.125 0.000 . . . . . . 614 C CB . 26645 1
455 . 1 1 101 101 CYS N N 15 123.158 0.030 . . . . . . 614 C N . 26645 1
456 . 1 1 102 102 ARG H H 1 8.300 0.001 . . . . . . 615 R HN . 26645 1
457 . 1 1 102 102 ARG C C 13 177.646 0.000 . . . . . . 615 R C . 26645 1
458 . 1 1 102 102 ARG CA C 13 60.184 0.016 . . . . . . 615 R CA . 26645 1
459 . 1 1 102 102 ARG CB C 13 30.980 0.000 . . . . . . 615 R CB . 26645 1
460 . 1 1 102 102 ARG N N 15 120.942 0.001 . . . . . . 615 R N . 26645 1
461 . 1 1 103 103 LEU H H 1 8.820 0.002 . . . . . . 616 L HN . 26645 1
462 . 1 1 103 103 LEU C C 13 178.039 0.000 . . . . . . 616 L C . 26645 1
463 . 1 1 103 103 LEU CB C 13 41.924 0.000 . . . . . . 616 L CB . 26645 1
464 . 1 1 103 103 LEU CA C 13 58.655 0.030 . . . . . . 616 L CA . 26645 1
465 . 1 1 103 103 LEU N N 15 120.358 0.024 . . . . . . 616 L N . 26645 1
466 . 1 1 104 104 ARG H H 1 8.342 0.016 . . . . . . 617 R HN . 26645 1
467 . 1 1 104 104 ARG C C 13 179.289 0.000 . . . . . . 617 R C . 26645 1
468 . 1 1 104 104 ARG CA C 13 60.220 0.000 . . . . . . 617 R CA . 26645 1
469 . 1 1 104 104 ARG CB C 13 29.611 0.000 . . . . . . 617 R CB . 26645 1
470 . 1 1 104 104 ARG N N 15 119.498 0.227 . . . . . . 617 R N . 26645 1
471 . 1 1 105 105 LYS H H 1 8.048 0.001 . . . . . . 618 K HN . 26645 1
472 . 1 1 105 105 LYS C C 13 179.448 0.000 . . . . . . 618 K C . 26645 1
473 . 1 1 105 105 LYS CA C 13 59.889 0.000 . . . . . . 618 K CA . 26645 1
474 . 1 1 105 105 LYS CB C 13 32.797 0.000 . . . . . . 618 K CB . 26645 1
475 . 1 1 105 105 LYS N N 15 118.759 0.038 . . . . . . 618 K N . 26645 1
476 . 1 1 106 106 CYS H H 1 8.116 0.003 . . . . . . 619 C HN . 26645 1
477 . 1 1 106 106 CYS C C 13 177.305 0.000 . . . . . . 619 C C . 26645 1
478 . 1 1 106 106 CYS CA C 13 63.859 0.025 . . . . . . 619 C CA . 26645 1
479 . 1 1 106 106 CYS CB C 13 28.019 0.000 . . . . . . 619 C CB . 26645 1
480 . 1 1 106 106 CYS N N 15 119.202 0.133 . . . . . . 619 C N . 26645 1
481 . 1 1 107 107 TYR H H 1 8.192 0.002 . . . . . . 620 Y HN . 26645 1
482 . 1 1 107 107 TYR C C 13 181.936 0.000 . . . . . . 620 Y C . 26645 1
483 . 1 1 107 107 TYR CA C 13 61.304 0.029 . . . . . . 620 Y CA . 26645 1
484 . 1 1 107 107 TYR CB C 13 37.316 0.000 . . . . . . 620 Y CB . 26645 1
485 . 1 1 107 107 TYR N N 15 118.842 0.017 . . . . . . 620 Y N . 26645 1
486 . 1 1 108 108 GLU H H 1 9.040 0.003 . . . . . . 621 E HN . 26645 1
487 . 1 1 108 108 GLU C C 13 177.961 0.000 . . . . . . 621 E C . 26645 1
488 . 1 1 108 108 GLU CA C 13 59.395 0.015 . . . . . . 621 E CA . 26645 1
489 . 1 1 108 108 GLU CB C 13 29.416 0.000 . . . . . . 621 E CB . 26645 1
490 . 1 1 108 108 GLU N N 15 123.309 0.037 . . . . . . 621 E N . 26645 1
491 . 1 1 109 109 ALA H H 1 7.774 0.001 . . . . . . 622 A HN . 26645 1
492 . 1 1 109 109 ALA C C 13 176.539 0.000 . . . . . . 622 A C . 26645 1
493 . 1 1 109 109 ALA CA C 13 52.364 0.031 . . . . . . 622 A CA . 26645 1
494 . 1 1 109 109 ALA CB C 13 18.690 0.000 . . . . . . 622 A CB . 26645 1
495 . 1 1 109 109 ALA N N 15 119.987 0.049 . . . . . . 622 A N . 26645 1
496 . 1 1 110 110 GLY H H 1 7.805 0.003 . . . . . . 623 G HN . 26645 1
497 . 1 1 110 110 GLY C C 13 174.867 0.000 . . . . . . 623 G C . 26645 1
498 . 1 1 110 110 GLY CA C 13 44.797 0.005 . . . . . . 623 G CA . 26645 1
499 . 1 1 110 110 GLY N N 15 104.378 0.025 . . . . . . 623 G N . 26645 1
500 . 1 1 111 111 MET H H 1 7.535 0.002 . . . . . . 624 M HN . 26645 1
501 . 1 1 111 111 MET C C 13 176.054 0.000 . . . . . . 624 M C . 26645 1
502 . 1 1 111 111 MET CA C 13 56.918 0.000 . . . . . . 624 M CA . 26645 1
503 . 1 1 111 111 MET CB C 13 32.906 0.000 . . . . . . 624 M CB . 26645 1
504 . 1 1 111 111 MET N N 15 118.354 0.025 . . . . . . 624 M N . 26645 1
505 . 1 1 112 112 THR H H 1 8.428 0.003 . . . . . . 625 T HN . 26645 1
506 . 1 1 112 112 THR C C 13 173.090 0.000 . . . . . . 625 T C . 26645 1
507 . 1 1 112 112 THR CA C 13 60.064 0.027 . . . . . . 625 T CA . 26645 1
508 . 1 1 112 112 THR CB C 13 70.849 0.000 . . . . . . 625 T CB . 26645 1
509 . 1 1 112 112 THR N N 15 113.515 0.016 . . . . . . 625 T N . 26645 1
510 . 1 1 113 113 LEU H H 1 8.933 0.002 . . . . . . 626 L HN . 26645 1
511 . 1 1 113 113 LEU C C 13 177.074 0.000 . . . . . . 626 L C . 26645 1
512 . 1 1 113 113 LEU CA C 13 55.700 0.000 . . . . . . 626 L CA . 26645 1
513 . 1 1 113 113 LEU CB C 13 42.241 0.000 . . . . . . 626 L CB . 26645 1
514 . 1 1 113 113 LEU N N 15 125.966 0.018 . . . . . . 626 L N . 26645 1
515 . 1 1 114 114 GLY H H 1 8.152 0.001 . . . . . . 627 G HN . 26645 1
516 . 1 1 114 114 GLY CA C 13 46.124 0.000 . . . . . . 627 G CA . 26645 1
517 . 1 1 114 114 GLY N N 15 115.403 0.017 . . . . . . 627 G N . 26645 1
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