Variant

Genome Chromosome Position VCF ID Ref Alt mRNA Change mRNA Info
GRCh37 chr1 149784885 . C A CCDS41388.1:NM_001123375.2:c.352Gtg>Ttg_NP_001116847.1:p.118V>L Homo sapiens histone cluster 2 H3 family member d (HIST2H3D), mRNA.
pdb_id: 
label_asym_id: 
label_seq_id: 
label_comp_id: 
auth_asym_id: 
auth_seq_id: 
alphafold_id: 
label_asym_id: 
label_seq_id: 
label_comp_id: 
auth_asym_id: 
auth_seq_id: 

PDB

Entity Residue Monomer BioUnit Ligand View
PDB Entity Uniprot Identity Evalue ExpMethod Date Name Label Auth ASA rASA SS φ ψ ASA rASA ΔASA Interaction Name Distance Atom(p) Atom(l)
1eqz 4 P84229 100.0 2e-96 X-RAY
 2000-04-17 VAL E:118 C:117 128.0 0.826 S -131.3 4.8 42.0 0.271 0.555 F:P62801:0.323
G:P02263:0.303
 DG
DC
DG
DG
DG
DA
MN
HOH
 8.170
4.857
2.826
8.330
8.474
7.250
8.921
2.589
 CB
N
N
N
O
O
N
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL I:118 G:117 130.0 0.839 S -132.9 -3.3 52.0 0.335 0.504 J:P62801:0.31
C:P02263:0.265
 DT
DG
DC
DG
DG
DA
K
HOH
 8.463
7.312
7.073
3.999
2.836
8.158
8.620
2.877
 O
O
CG1
CG1
N
N
CG1
O
 O3'
OP1
O3'
C3'
OP1
OP2
K
O
1hq3 3 P84229 100.0 2e-96 X-RAY
 2001-01-24 VAL C:118 C:117 126.0 0.813 S -122.0 -3.4 44.0 0.284 0.529 D:P62801:0.361
E:P02263:0.226
 CL
CL
HOH
 7.733
3.026
2.733
 O
N
O
 CL
CL
O
VAL G:118 G:117 128.0 0.826 S -116.6 -13.5 49.0 0.316 0.51 A:P02263:0.206
H:P62801:0.374
 CL
CL
HOH
 3.191
7.659
2.856
 N
O
O
 CL
CL
O
1tzy 3 P84229 100.0 2e-96 X-RAY
 2004-08-03 VAL C:118 C:117 131.0 0.845 S -114.7 -11.6 49.0 0.316 0.529 D:P62801:0.368
E:P02263:0.245
 CL
CL
HOH
 7.713
3.237
2.731
 O
N
O
 CL
CL
O
VAL G:118 G:117 131.0 0.845 S -116.5 -11.7 47.0 0.303 0.542 H:P62801:0.368
A:P02263:0.245
 CL
CL
HOH
 3.119
7.579
2.890
 N
O
O
 CL
CL
O
2aro 3 P84229 100.0 2e-96 X-RAY
 2005-08-30 VAL C:118 C:117 134.0 0.865 S -100.0 -16.5 50.0 0.323 0.542 D:P62801:0.387
E:P02263:0.219
 CL
CL
HOH
 7.721
3.106
2.731
 O
N
O
 CL
CL
O
VAL G:118 G:117 136.0 0.877 S -98.1 -18.8 48.0 0.31 0.567 H:P62801:0.413
A:P02263:0.219
 CL
CL
HOH
 3.204
7.661
2.806
 N
O
O
 CL
CL
O
2f8n 2 P84233 100.0 2e-96 X-RAY
 2006-05-23 VAL C:118 A:517 123.0 0.794 -150.7 11.1 43.0 0.277 0.517 D:P62799:0.316
I:O75367:0.258
 DG
DC
DG
DG
DG
DA
HOH
 7.497
4.455
2.782
8.295
8.526
7.175
7.211
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL F:118 E:717 130.0 0.839 S -119.5 3.3 51.0 0.329 0.51 G:P62799:0.303
J:Q8CGP6:0.271
 DG
DA
DG
DC
DG
DG
HOH
 8.453
7.152
7.073
4.109
2.941
8.182
2.638
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
2hio 3 P84229 100.0 2e-96 X-RAY
 2000-01-12 VAL C:118 C:117 121.0 0.781 S -121.1 -23.7 33.0 0.213 0.568 D:P62801:0.413
A:P02263:0.2
4kgc 1 P84233 100.0 2e-96 X-RAY
 2014-03-26 VAL A:118 A:117 133.0 0.858 S -132.5 7.9 52.0 0.335 0.523 B:P62799:0.303
G:Q6AZJ8:0.29
 DG
DC
DT
DG
DG
DA
 6.986
3.743
2.778
8.208
8.156
7.096
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 132.0 0.852 S -122.5 2.0 53.0 0.342 0.51 C:Q6AZJ8:0.258
F:P62799:0.303
 DG
DA
DG
DC
DT
DG
 8.219
7.361
6.881
3.844
2.809
8.368
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
4ld9 1 P84233 100.0 2e-96 X-RAY
 2013-08-14 VAL A:118 A:117 125.0 0.806 S -136.4 -9.2 42.0 0.271 0.535 B:P62799:0.348
G:Q6AZJ8:0.258
 DG
DG
DA
DC
DC
DC
 7.504
4.285
2.587
8.474
8.319
7.590
 CG1
CG1
N
N
CG1
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 124.0 0.8 S -127.3 -29.2 61.0 0.394 0.406 C:Q6AZJ8:0.168
F:P62799:0.297
 DC
DG
DA
DC
DG
DC
 9.120
8.038
7.566
4.806
2.689
8.246
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
4uuz 1 P02299 100.0 2e-96 X-RAY
 2015-02-11 VAL A:118 A:117 137.0 0.884 S -93.6 -38.8 68.0 0.439 0.445 B:P84040:0.445
5kgf 1 P84233 100.0 2e-96 EM
 2016-07-27 VAL A:118 A:117 141.0 0.91 S -65.2 -7.6 65.0 0.419 0.491 B:P62799:0.31
G:P0C0S8:0.245
 DA
DC
DG
DC
DC
DG
 6.358
2.894
2.027
8.326
8.253
7.257
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 142.0 0.916 S -65.1 -7.8 77.0 0.497 0.419 C:P0C0S8:0.232
F:P62799:0.271
 DC
DC
DG
DG
DA
DC
 8.566
7.731
6.030
3.597
2.861
8.527
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
5x0x 1 P84233 100.0 2e-96 EM
 2017-04-19 VAL A:118 A:117 134.0 0.865 S -98.9 2.1 67.0 0.432 0.433 B:P62799:0.303
G:Q6AZJ8:0.194
 DC
DC
DG
DG
DA
DC
 8.684
7.630
6.672
3.947
3.178
8.396
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:118 E:117 130.0 0.839 S -98.8 2.0 66.0 0.426 0.413 C:Q6AZJ8:0.174
F:P62799:0.29
 DA
DC
DG
DC
DC
DG
 6.665
4.207
2.803
8.315
8.956
7.749
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
6dzt 1 P02299 100.0 2e-96 EM
 2019-05-22 VAL A:118 A:117 130.0 0.839 S -126.0 -7.5 53.0 0.342 0.497 B:P84040:0.29
G:P84051:0.252
 DG
DG
DA
DC
DC
DC
 6.632
4.157
3.265
8.513
8.341
7.153
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:118 E:117 129.0 0.832 S -120.8 -7.6 51.0 0.329 0.503 C:P84051:0.271
F:P84040:0.284
 DC
DG
DA
DC
DG
DC
 8.418
7.311
6.706
4.238
3.120
8.307
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
6kw3 2 P84233 100.0 2e-96 EM
 2019-11-13 VAL B:118 N:117 137.0 0.884 S -116.4 -4.1 38.0 0.245 0.639 F:Q6AZJ8:0.226
A:P62799:0.497
 DC
DC
DG
DG
DA
DC
 8.416
7.313
7.059
3.568
2.682
8.435
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL D:118 Q:117 134.0 0.865 S -106.8 4.1 47.0 0.303 0.562 C:Q6AZJ8:0.239
E:P62799:0.387
 DA
DC
DG
DC
DC
DG
 7.068
4.120
2.643
8.704
8.878
7.262
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
OP1
OP1
6kw4 1 P84233 100.0 2e-96 EM
 2019-11-13 VAL A:118 N:117 110.0 0.71 S -128.6 -21.3 41.0 0.265 0.445 F:Q6AZJ8:0.219
B:P62799:0.323
 DC
DC
DG
DG
DA
DC
 9.169
7.872
7.710
4.739
3.245
8.668
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL D:118 Q:117 129.0 0.832 S -85.9 -7.4 45.0 0.29 0.542 E:P62799:0.4
C:Q6AZJ8:0.239
 DA
DC
DG
DC
DC
DG
 6.862
4.382
3.237
8.543
7.949
7.169
 CG2
CG2
N
N
CG2
O
 O3'
O5'
OP1
OP1
O3'
OP1
6kw5 16 P84233 100.0 2e-96 EM
 2020-09-09 VAL Q:118 R:117 129.0 0.832 S -119.3 -0.5 56.0 0.361 0.471 U:Q6AZJ8:0.226
R:P62799:0.303
 DC
DC
DG
DG
DA
DC
 9.093
8.058
6.552
4.475
3.379
8.957
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL T:118 V:117 133.0 0.858 S -120.8 2.3 68.0 0.439 0.419 S:Q6AZJ8:0.142
N:P62799:0.297
 DA
DC
DG
DC
DC
DG
 7.398
4.415
3.310
8.342
9.098
7.883
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
6o22 4 P84233 100.0 2e-96 NMR
SOLUTION SCATTERING
 2019-07-31 VAL E:118 E:117 140.0 0.903 S -62.1 -47.9 90.0 0.581 0.322 F:P62799:0.323
6pwe 1 P02299 100.0 2e-96 EM
 2019-08-21 VAL A:118 A:117 131.0 0.845 S -115.6 18.5 53.0 0.342 0.503 B:A0A0B4KFZ9:0.277
G:P84051:0.277
 DG
DG
DA
DC
DC
DC
 6.898
4.110
2.782
8.496
8.976
8.075
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL E:118 E:117 130.0 0.839 S -115.6 18.5 47.0 0.303 0.536 C:P84051:0.297
F:A0A0B4KFZ9:0.31
 DC
DG
DA
DC
DG
DC
 8.938
7.887
6.759
4.144
3.198
8.908
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6pwf 1 P02299 100.0 2e-96 EM
 2019-08-21 VAL A:118 A:117 132.0 0.852 S -115.9 31.0 55.0 0.355 0.497 B:A0A0B4KFZ9:0.31
G:P84051:0.252
 DG
DG
DA
DC
DC
DC
 7.104
4.213
3.701
9.883
8.405
7.874
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
P
O3'
OP1
VAL E:118 E:117 131.0 0.845 S -115.8 31.0 46.0 0.297 0.548 C:P84051:0.329
F:A0A0B4KFZ9:0.297
 DC
DG
DA
DC
DG
DC
 8.500
7.668
7.049
4.076
3.339
8.351
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6wkr 9 P84233 100.0 2e-96 EM
 2021-02-03 VAL I:118 I:117 138.0 0.89 S -132.5 -8.1 71.0 0.458 0.432 J:P62799:0.297
O:P06897:0.2
 DG
DA
DC
DA
DC
DC
 7.285
3.786
2.904
8.243
8.672
7.550
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL M:118 O:117 143.0 0.923 S -131.3 -18.6 68.0 0.439 0.484 K:P06897:0.232
N:P62799:0.323
 DG
DT
DT
DA
DC
DG
 8.816
7.668
8.332
4.559
2.551
8.581
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
P
7jo9 1 Q71DI3 100.0 2e-96 EM
 2020-09-16 VAL A:118 A:117 130.0 0.839 S -132.1 1.4 51.0 0.329 0.51 B:P62805:0.329
G:P0C0S8:0.219
 DG
DG
DA
DC
DC
DC
 7.480
4.645
3.261
8.675
8.966
7.898
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 131.0 0.845 S -128.7 -23.8 54.0 0.348 0.497 C:P0C0S8:0.174
F:P62805:0.361
 DC
DG
DA
DC
DG
DC
 9.449
8.134
7.832
5.261
3.182
8.452
 C
O
CG2
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
7joa 1 Q71DI3 100.0 2e-96 EM
 2020-09-16 VAL A:118 A:117 129.0 0.832 S -132.3 3.3 54.0 0.348 0.484 B:P62805:0.303
G:P0C0S8:0.2
 DG
DG
DA
DC
DC
DC
 7.461
4.571
3.272
8.637
9.062
7.838
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 129.0 0.832 S -127.3 -25.1 54.0 0.348 0.484 C:P0C0S8:0.206
F:P62805:0.329
 DC
DG
DA
DC
DG
DC
 9.477
8.263
8.056
5.374
3.213
8.401
 C
O
CG2
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
7kbd 1 P84233 100.0 2e-96 EM
 2021-09-15 VAL A:118 A:117 123.0 0.794 S -130.3 -19.3 42.0 0.271 0.523 B:P62799:0.335
G:Q6DKE3:0.245
 DG
DG
DA
DC
DC
DC
 7.213
4.730
3.308
8.571
8.934
7.716
 CG2
CG2
CG2
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:118 E:117 123.0 0.794 S -130.3 -19.4 42.0 0.271 0.523 C:Q6DKE3:0.252
F:P62799:0.348
 DC
DG
DA
DC
DG
DC
 8.990
7.570
7.030
4.545
3.036
8.878
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
7kbe 1 P84233 100.0 2e-96 EM
 2021-09-15 VAL A:118 A:117 127.0 0.819 S -122.4 -24.0 40.0 0.258 0.561 B:P62799:0.394
G:Q6DKE3:0.206
 DG
DG
DA
DC
DC
DC
 6.992
4.549
3.308
8.625
8.614
8.119
 CG2
CG2
CG2
N
CG2
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:118 E:117 132.0 0.852 S -110.6 -10.4 51.0 0.329 0.523 C:Q6DKE3:0.239
F:P62799:0.342
 DC
DG
DA
DC
DG
DC
 8.960
7.753
6.862
4.265
2.808
8.686
 CG2
O
CG2
CG2
N
N
 C4'
OP1
O3'
C5'
OP1
OP2
7kbf 1 P84233 100.0 2e-96 EM
 2021-09-15 VAL A:118 A:117 139.0 0.897 S -104.9 5.0 84.0 0.542 0.355 B:P62799:0.271
G:Q6DKE3:0.11
 DA
DC
DG
DG
DC
DG
 6.483
3.707
2.919
8.474
8.347
7.818
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 130.0 0.839 S -127.4 -3.4 67.0 0.432 0.407 C:Q6DKE3:0.097
F:P62799:0.31
 DC
DG
DA
DC
DG
DG
 8.682
7.469
6.910
4.073
3.866
8.404
 O
O
CG2
CG2
CG2
N
 C5'
OP1
O3'
O3'
OP1
OP2
3av1 1 Q71DI3 100.0 2e-96 X-RAY
 2011-06-01 VAL A:121 A:117 124.0 0.8 S -130.0 -6.7 45.0 0.29 0.51 B:P62805:0.335
G:P04908:0.245
 DG
DC
DT
DG
DG
DA
HOH
 8.287
4.838
2.783
8.034
8.172
7.448
2.662
 CB
CB
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 126.0 0.813 S -128.7 -8.3 46.0 0.297 0.516 C:P04908:0.232
F:P62805:0.348
 DT
DG
DC
DT
DG
DA
HOH
 8.521
7.284
8.138
4.860
2.691
8.361
2.609
 O
O
CG2
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
5b0z 1 Q71DI3 100.0 2e-96 X-RAY
 2016-01-27 VAL A:121 A:117 134.0 0.865 S -120.4 0.2 46.0 0.297 0.568 B:P62805:0.329
G:P04908:0.31
 DG
DC
DT
DG
DG
DA
HOH
 8.183
4.775
2.769
8.211
8.361
7.342
2.788
 CB
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 134.0 0.865 S -119.6 -1.3 46.0 0.297 0.568 C:P04908:0.29
F:P62805:0.355
 DT
DG
DC
DT
DG
DA
HOH
 8.432
7.376
7.946
4.703
2.823
8.675
2.662
 O
O
CB
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
6g0l 1 Q92133 99.26 9e-96 EM
 2018-08-22 VAL A:118 A:117 133.0 0.858 -141.5 -19.9 109.0 0.703 0.155 B:P62799:0.155
 DA
DC
DG
DC
DG
DC
DG
 6.331
2.538
2.087
7.037
9.990
8.082
7.020
 CG1
CG1
CB
CG2
CG1
O
O
 O3'
O3'
OP1
N4
N2
C5'
OP1
VAL E:118 E:117 142.0 0.916 S -111.6 21.0 50.0 0.323 0.593 C:P06897:0.239
F:P62799:0.394
 DC
DC
DG
DG
DA
DC
 7.055
5.996
6.092
3.039
2.413
8.812
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6vz4 1 Q92133 99.26 9e-96 EM
 2020-12-02 VAL A:118 A:118 133.0 0.858 S -113.8 -5.0 53.0 0.342 0.516 B:P62799:0.323
G:Q6AZJ8:0.258
 DC
DC
DG
DG
DA
DC
 8.458
7.078
6.625
4.009
2.740
8.372
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL E:118 E:118 131.0 0.845 S -112.0 -3.9 49.0 0.316 0.529 C:Q6AZJ8:0.271
F:P62799:0.329
 DA
DC
DG
DC
DC
DG
 6.837
4.257
2.682
8.324
8.461
7.252
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
3lel 1 P84233 99.26 1e-95 X-RAY
 2010-05-19 VAL A:118 A:117 140.0 0.903 S -130.4 16.4 52.0 0.335 0.568 B:P62799:0.329
G:Q6AZJ8:0.303
 DA
DA
DA
DG
DA
DG
MN
 6.839
3.939
2.894
8.057
7.925
7.081
8.707
 CG2
CG2
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
MN
VAL E:118 E:117 130.0 0.839 S -110.1 -8.0 51.0 0.329 0.51 C:Q6AZJ8:0.232
F:P62799:0.335
 DA
DG
DA
DA
DA
DG
MN
 8.658
7.413
7.049
3.704
2.882
8.856
9.958
 O
O
CG2
CG2
N
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
MN
VAL K:118 K:117 125.0 0.806 S -137.3 2.3 NA NA NA
VAL O:118 O:117 132.0 0.852 S -120.0 8.7 NA NA NA
4zux 1 P84233 99.26 1e-95 X-RAY
 2016-02-24 VAL A:118 A:117 142.0 0.916 S -128.7 -13.5 77.0 0.497 0.419 B:P62799:0.381
G:P06897:0.039
 DA
DC
DG
DC
DA
DC
DG
 7.311
4.032
2.652
7.767
9.833
7.399
6.860
 CG2
CG2
N
N
C
O
O
 O3'
O3'
OP1
OP2
O3'
O3'
OP1
VAL E:118 E:117 144.0 0.929 S -136.1 -7.8 68.0 0.439 0.49 C:P06897:0.187
F:P62799:0.342
 DC
DC
DG
DG
DA
DC
 7.506
6.986
7.183
4.060
2.341
7.489
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL K:118 K:117 143.0 0.923 S -128.9 -13.8 NA NA NA
VAL O:118 O:117 145.0 0.935 S -128.8 -13.7 NA NA NA
5e5a 2 P84233 99.26 1e-95 X-RAY
 2016-02-03 VAL C:118 A:117 135.0 0.871 S -121.8 -5.6 53.0 0.342 0.529 I:Q6AZJ8:0.271
D:P62799:0.329
 DG
DC
DG
DG
DG
DA
HOH
 6.939
5.153
2.936
7.985
8.138
7.258
8.702
 CG1
CG1
N
N
O
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
O
VAL G:118 E:117 131.0 0.845 S -122.2 -1.0 56.0 0.361 0.484 H:P62799:0.29
E:Q6AZJ8:0.252
 DT
DG
DC
DG
DG
DA
HOH
 8.444
7.225
6.667
3.969
2.755
8.443
2.757
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
C3'
OP1
OP2
O
5o9g 1 P84233 99.26 1e-95 EM
 2017-10-11 VAL A:118 A:117 125.0 0.806 S -136.9 -15.7 45.0 0.29 0.516 B:P62799:0.458
G:Q6AZJ8:0.097
 DA
DC
DG
DC
DC
DG
 7.432
4.864
3.065
9.693
9.003
7.902
 CG1
CG1
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 119.0 0.768 S -111.1 -24.6 34.0 0.219 0.549 C:Q6AZJ8:0.155
F:P62799:0.458
 DC
DC
DG
DG
DA
DC
 9.284
9.136
7.178
3.569
2.394
8.119
 CG1
O
CG1
CG1
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6i84 1 P84233 99.26 1e-95 EM
 2019-01-02 VAL A:118 M:117 132.0 0.852 S -90.1 -28.1 46.0 0.297 0.555 F:P62799:0.445
C:P06897:0.168
 DA
DC
DG
DC
DG
 5.651
4.027
4.411
7.839
6.761
 CG2
CG2
N
O
O
 O3'
C5'
OP1
O3'
OP1
VAL H:118 S:117 155.0 1.0 S -81.8 -29.1 53.0 0.342 0.658 B:P06897:0.284
I:P62799:0.452
 DC
DC
DC
DC
DG
DG
DG
DA
DC
 9.994
7.819
7.382
7.258
9.219
6.918
3.677
2.806
7.467
 CG2
CG2
O
O
CG2
CG2
CG2
N
N
 O2
O4'
O3'
OP1
N2
O3'
O3'
OP1
OP2
6j99 1 A0A310TTQ1 99.26 1e-95 EM
 2019-02-27 VAL A:118 A:117 144.0 0.929 S -72.9 -33.5 65.0 0.419 0.51 B:P62799:0.348
G:Q6AZJ8:0.258
 DA
DC
DG
DC
DC
DG
 6.070
4.139
2.583
8.128
8.766
8.030
 CG1
CB
N
N
C
O
 O3'
C3'
OP1
OP2
C5'
OP1
VAL E:118 E:117 141.0 0.91 S -73.0 -33.5 71.0 0.458 0.452 F:P62799:0.323
C:Q6AZJ8:0.206
 DC
DC
DG
DG
DA
DC
 9.120
8.205
6.297
3.693
2.622
8.529
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6ne3 1 P84233 99.26 1e-95 EM
 2019-07-17 VAL A:118 A:117 123.0 0.794 S -112.9 -39.4 53.0 0.342 0.452 B:P62799:0.316
G:P06897:0.206
 DG
DC
DG
DC
DT
DA
 7.996
5.160
2.852
8.036
9.136
7.926
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 127.0 0.819 S -117.0 -45.3 29.0 0.187 0.632 C:P06897:0.355
F:P62799:0.394
 DG
DC
DG
DG
DG
DG
 9.106
7.824
7.744
4.747
2.694
8.525
 CG1
CG1
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6pwv 4 P84233 99.26 1e-95 EM
 2019-12-18 VAL D:118 G:117 149.0 0.961 S -96.8 -16.9 61.0 0.394 0.567 E:P62799:0.51
J:P06897:0.097
 DC
DC
DG
DG
DA
DC
 7.693
6.580
5.976
3.667
2.962
8.380
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL H:118 K:117 148.0 0.955 S -96.8 -16.8 62.0 0.4 0.555 I:P62799:0.497
F:P06897:0.103
 DA
DC
DG
DC
DC
DG
 6.601
3.588
2.329
8.383
7.688
6.607
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6pww 4 P84233 99.26 1e-95 EM
 2019-12-18 VAL D:118 G:117 125.0 0.806 S -96.5 -20.3 52.0 0.335 0.471 E:P62799:0.361
I:P06897:0.2
 DC
DC
DG
DG
DA
DC
 8.417
7.129
6.303
3.728
2.671
8.313
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL H:118 K:117 127.0 0.819 S -96.6 -20.3 55.0 0.355 0.464 F:P06897:0.148
M:P62799:0.342
 DA
DC
DG
DC
DC
DG
 6.890
3.661
2.364
8.233
8.523
7.385
 CG1
CG1
N
N
C
O
 O3'
C3'
OP1
OP2
C5'
OP1
6pwx 2 P84233 99.26 1e-95 EM
 2019-12-18 VAL B:118 G:117 133.0 0.858 S -119.1 1.0 52.0 0.335 0.523 G:P06897:0.297
C:P62799:0.277
 DC
DC
DG
DG
DA
DC
 8.396
7.410
6.714
3.627
2.445
8.368
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL F:118 K:117 133.0 0.858 S -119.1 1.0 58.0 0.374 0.484 D:P06897:0.252
K:P62799:0.284
 DA
DC
DG
DC
DC
DG
 6.724
3.996
2.455
8.586
8.666
7.700
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6ryr 1 P84233 99.26 1e-95 EM
 2020-07-15 VAL A:118 A:117 128.0 0.826 S -103.6 -20.6 47.0 0.303 0.523 B:P62799:0.335
G:P06897:0.258
 DA
DC
DG
DC
DC
DG
 7.626
4.330
2.530
8.275
8.394
7.665
 CB
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 138.0 0.89 S -103.4 -13.7 52.0 0.335 0.555 C:P06897:0.258
F:P62799:0.329
 DC
DC
DG
DG
DA
DC
 8.213
7.166
6.442
3.692
2.606
8.558
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
6ryu 1 P84233 99.26 1e-95 EM
 2020-07-15 VAL A:118 A:117 124.0 0.8 S -113.9 -33.7 47.0 0.303 0.497 G:P06897:0.174
B:P62799:0.374
 DA
DC
DG
DC
DC
DG
 7.076
4.267
2.513
8.370
8.666
7.872
 CG2
CG2
N
N
C
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL E:118 E:117 129.0 0.832 S -131.3 -10.0 49.0 0.316 0.516 C:P06897:0.258
F:P62799:0.329
 DC
DC
DG
DG
DA
DC
 8.677
7.972
6.147
3.672
2.658
8.431
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6w5i 5 P84233 99.26 1e-95 EM
 2021-03-31 VAL E:118 G:117 151.0 0.974 S -96.7 -17.0 71.0 0.458 0.516 K:Q6AZJ8:0.052
F:P62799:0.497
 DC
DC
DG
DG
DA
DC
 8.291
7.383
5.759
3.384
2.767
8.222
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL I:118 K:117 150.0 0.968 S -96.8 -16.9 67.0 0.432 0.536 J:P62799:0.465
G:Q6AZJ8:0.097
 DA
DC
DG
DC
DC
DG
 6.726
3.704
2.417
8.401
8.316
7.370
 CG1
CG1
N
N
O
O
 O3'
C4'
OP1
OP2
C5'
OP1
6w5m 5 P84233 99.26 1e-95 EM
 2021-03-31 VAL E:118 G:117 147.0 0.948 S -96.9 -16.8 59.0 0.381 0.567 K:P06897:0.129
F:P62799:0.484
 DC
DC
DG
DG
DA
DC
 8.473
7.427
6.296
3.945
3.111
8.518
 O
O
CG1
CG1
CG1
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL I:118 K:117 149.0 0.961 S -96.9 -16.7 58.0 0.374 0.587 J:P62799:0.523
G:P06897:0.116
 DA
DC
DG
DC
DC
DG
 6.737
3.712
2.626
8.559
8.181
7.073
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6w5n 5 P84233 99.26 1e-95 EM
 2021-03-31 VAL E:118 G:117 150.0 0.968 S -96.8 -16.8 77.0 0.497 0.471 K:P06897:0.065
F:P62799:0.432
 DC
DC
DG
DG
DA
DC
 8.635
7.583
6.289
3.961
3.187
8.597
 O
O
CG1
CG1
CG1
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL I:118 K:117 148.0 0.955 S -97.0 -16.7 64.0 0.413 0.542 J:P62799:0.471
G:P06897:0.11
 DA
DC
DG
DC
DC
DG
 6.720
3.589
2.531
8.283
8.186
7.435
 CG1
CG1
N
N
O
O
 O3'
C3'
OP1
OP2
C5'
OP1
7nkx 11 P84233 99.26 1e-95 EM
 2021-08-25 VAL K:118 a:117 130.0 0.839 S -97.0 -33.9 67.0 0.432 0.407 L:P62799:0.406
 DA
DC
DG
DC
DC
DG
 6.400
3.939
3.070
8.390
8.323
8.086
 CG2
CG2
N
N
CG2
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL O:118 e:117 112.0 0.723 S -100.9 -37.3 47.0 0.303 0.42 P:P62799:0.258
M:P06897:0.239
 DC
DC
DG
DG
DA
DC
 8.947
6.953
6.734
4.340
3.779
8.179
 O
O
CG2
CG2
CG2
N
 O3'
OP1
O3'
O3'
OP1
OP2
7nky 20 P84233 99.26 1e-95 EM
 2021-07-07 VAL T:118 a:117 133.0 0.858 S -81.9 -9.2 92.0 0.594 0.264 U:P62799:0.265
 DC
DG
DA
DC
DG
DC
 9.143
7.963
6.487
3.399
2.578
8.460
 O
O
CG2
CG2
N
N
 C5'
OP1
O3'
C3'
OP1
OP2
VAL X:118 e:117 117.0 0.755 S -73.1 -40.2 40.0 0.258 0.497 V:P06897:0.232
Y:P62799:0.329
 DG
DG
DA
DC
DC
DC
 6.234
3.456
2.646
8.356
9.049
8.203
 CG1
CG1
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
7cow 3 P68431 99.26 1e-95 X-RAY
 2021-08-11 VAL C:120 A:117 128.0 0.826 S -129.8 -35.5 40.0 0.258 0.568 D:P62805:0.381
I:P04908:0.258
 DC
DC
DA
DG
DA
DC
 8.514
8.106
7.386
4.871
2.714
8.522
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL G:120 E:117 126.0 0.813 S -160.8 -36.4 45.0 0.29 0.523 H:P62805:0.342
E:P04908:0.252
 DA
DC
DG
DC
DC
DG
 7.363
4.847
2.904
8.378
7.924
6.962
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL K:120 K:117 129.0 0.832 S -145.2 -5.1 46.0 0.297 0.535 L:P62805:0.348
Q:P04908:0.258
 DA
DC
DG
DC
DC
DG
 6.720
4.844
3.168
9.035
8.304
6.858
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
P
O3'
OP1
VAL O:120 O:117 126.0 0.813 S -137.1 -11.6 45.0 0.29 0.523 M:P04908:0.232
P:P62805:0.355
 DC
DC
DA
DG
DA
DC
 7.923
7.291
7.338
4.965
2.920
8.528
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
5b0y 1 Q71DI3 99.26 1e-95 X-RAY
 2016-01-27 VAL A:118 A:117 127.0 0.819 S -115.3 -5.1 43.0 0.277 0.542 B:P62805:0.348
G:P04908:0.265
 DG
DC
DT
DG
DG
DA
 8.431
4.734
2.822
8.065
8.315
7.443
 CB
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 130.0 0.839 S -113.3 -6.0 47.0 0.303 0.536 C:P04908:0.258
F:P62805:0.342
 DT
DG
DC
DT
DG
DA
MN
 8.482
7.373
7.944
4.691
2.720
8.604
7.962
 O
O
CG1
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
MN
1u35 2 P68433 99.26 2e-95 X-RAY
 2005-09-27 VAL C:118 A:517 126.0 0.813 S -121.6 -5.6 47.0 0.303 0.51 D:Q5T006:0.323
I:O75367:0.271
 DG
DC
DG
DG
DG
DA
HOH
 7.373
4.492
2.808
8.394
8.198
7.378
2.633
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:118 E:717 130.0 0.839 S -118.0 -8.1 48.0 0.31 0.529 H:Q5T006:0.297
E:O75367:0.284
 DG
DA
DG
DC
DG
DG
HOH
 8.330
7.396
6.965
3.899
3.011
8.244
2.646
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
2cv5 2 P68431 99.26 2e-95 X-RAY
 2005-06-28 VAL C:118 A:117 127.0 0.819 S -128.0 1.0 41.0 0.265 0.554 D:P62805:0.335
I:P28001:0.284
 DG
DC
DT
DG
DG
DA
HOH
 8.637
4.873
2.812
8.107
8.175
7.511
2.790
 CB
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:118 E:117 133.0 0.858 S -117.0 -10.1 48.0 0.31 0.548 H:P62805:0.342
E:P28001:0.277
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.353
7.483
7.990
4.732
2.642
8.545
7.978
2.714
 O
O
CG1
N
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5c3i 2 P68431 99.26 2e-95 X-RAY
 2015-07-29 VAL B:118 B:117 149.0 0.961 S -107.3 -13.0 NA NA NA
VAL F:118 F:117 148.0 0.955 S -94.7 -14.9 NA NA NA
VAL J:118 J:117 145.0 0.935 S -109.2 -43.3 89.0 0.574 0.361 L:P49736:0.084
K:P62805:0.342
VAL N:118 N:117 135.0 0.871 S -106.1 -31.1 NA NA NA
VAL R:118 R:117 149.0 0.961 S -96.8 -24.4 NA NA NA
VAL V:118 V:117 145.0 0.935 S -93.1 -18.3 NA NA NA
5xf3 1 P68431 99.26 2e-95 X-RAY
 2017-10-11 VAL A:118 A:117 126.0 0.813 S -132.8 13.0 48.0 0.31 0.503 B:P62805:0.271
G:P04908:0.277
 DG
DC
DT
DG
DG
DA
 7.214
3.953
2.720
8.222
8.327
7.180
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 127.0 0.819 S -128.8 0.6 55.0 0.355 0.464 C:P04908:0.252
F:P62805:0.265
 DG
DA
DG
DC
DT
DG
 8.271
7.391
7.088
4.007
2.765
8.155
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5xf4 1 P68431 99.26 2e-95 X-RAY
 2017-10-11 VAL A:118 A:117 124.0 0.8 S -129.4 8.2 48.0 0.31 0.49 B:P62805:0.258
G:P04908:0.277
 DG
DC
DT
DG
DG
DA
 7.275
4.123
2.780
8.199
8.361
7.333
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 129.0 0.832 S -118.3 -0.8 53.0 0.342 0.49 C:P04908:0.252
F:P62805:0.297
 DG
DA
DG
DC
DT
DG
 8.194
7.336
7.120
3.946
2.819
8.145
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5xf5 1 P68431 99.26 2e-95 X-RAY
 2017-10-11 VAL A:118 A:117 126.0 0.813 S -126.2 6.8 47.0 0.303 0.51 B:P62805:0.303
G:P04908:0.258
 DG
DC
DT
DG
DG
DA
 7.175
3.863
2.780
8.236
8.280
7.209
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 130.0 0.839 S -123.6 11.6 49.0 0.316 0.523 C:P04908:0.245
F:P62805:0.329
 DG
DA
DG
DC
DT
DG
 8.205
7.330
7.192
4.144
2.757
8.148
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6hts 5 P68431 99.26 2e-95 EM
 2018-11-07 VAL I:118 I:117 138.0 0.89 S -92.3 2.6 57.0 0.368 0.522 J:P62805:0.277
O:P04908:0.277
 DC
DG
DA
DC
DG
DC
 7.819
6.901
6.427
3.694
2.589
9.534
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL M:118 M:117 137.0 0.884 S -77.2 -9.9 54.0 0.348 0.536 N:P62805:0.419
K:P04908:0.181
 DG
DG
DA
DC
DC
DC
 6.482
3.755
2.567
8.388
8.081
6.964
 CG1
CG1
N
N
CG1
O
 O3'
C3'
OP1
OP2
O3'
OP1
6l9z 1 P68431 99.26 2e-95 X-RAY
 2021-02-17 VAL A:118 A:117 129.0 0.832 S -117.6 -6.0 47.0 0.303 0.529 B:P62805:0.335
G:P04908:0.265
 DA
DC
DG
DC
DC
DG
HOH
 7.386
5.055
2.822
8.504
8.282
7.464
2.639
 CG1
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:118 E:117 133.0 0.858 S -113.8 -5.5 46.0 0.297 0.561 C:P04908:0.271
F:P62805:0.355
 DC
DC
DA
DG
DA
DC
HOH
 7.993
7.374
7.523
4.903
2.816
8.531
2.575
 O
O
CG1
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
VAL K:118 K:117 129.0 0.832 S -124.6 2.7 46.0 0.297 0.535 Q:P04908:0.252
L:P62805:0.355
 DC
DC
DA
DG
DA
DC
HOH
 8.181
7.301
7.368
4.971
2.774
8.642
2.570
 O
O
CG1
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
VAL O:118 O:117 129.0 0.832 S -115.8 -6.9 46.0 0.297 0.535 M:P04908:0.252
P:P62805:0.335
 DA
DC
DG
DC
DC
DG
CA
HOH
 7.316
4.890
2.895
8.350
8.133
7.378
8.573
2.720
 CG1
CG1
N
N
O
O
N
O
 O3'
O5'
OP1
OP2
O3'
OP1
CA
O
6la2 1 P68431 99.26 2e-95 X-RAY
 2021-02-17 VAL A:118 e:117 133.0 0.858 S -126.3 -9.3 47.0 0.303 0.555 B:P62805:0.361
G:P04908:0.265
 DC
DC
DA
DG
DA
DC
 8.029
7.081
7.239
4.971
2.667
8.370
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:118 i:117 134.0 0.865 S -127.2 -11.1 51.0 0.329 0.536 C:P04908:0.271
F:P62805:0.355
 DA
DC
DG
DC
DC
DG
 7.330
4.968
2.778
8.790
7.975
7.170
 CG1
CG1
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL K:118 A:117 135.0 0.871 S -126.1 -9.6 50.0 0.323 0.548 Q:P04908:0.303
L:P62805:0.323
 DC
DC
DA
DG
DA
DC
 8.167
7.476
7.336
4.973
2.663
8.339
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL O:118 E:117 133.0 0.858 S -126.8 -8.9 43.0 0.277 0.581 M:P04908:0.31
P:P62805:0.361
 DA
DC
DG
DC
DC
DG
 7.546
5.102
2.702
8.663
8.023
7.308
 CG1
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL U:118 K:117 135.0 0.871 S -126.2 -10.4 47.0 0.303 0.568 AA:P04908:0.284
V:P62805:0.368
 DC
DC
DA
DG
DA
DC
 8.330
7.397
7.133
4.830
2.579
8.341
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
VAL Y:118 O:117 135.0 0.871 S -126.0 -11.5 47.0 0.303 0.568 W:P04908:0.271
Z:P62805:0.387
 DA
DC
DG
DC
DC
DG
 7.326
4.750
2.915
8.410
8.247
7.230
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL EA:118 U:117 131.0 0.845 S -125.7 -11.1 48.0 0.31 0.535 KA:P04908:0.303
FA:P62805:0.31
 DC
DC
DA
DG
DA
DC
 8.511
7.796
7.246
4.943
2.667
8.382
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
VAL IA:118 Y:117 132.0 0.852 S -126.1 -11.5 49.0 0.316 0.536 JA:P62805:0.348
GA:P04908:0.258
 DA
DC
DG
DC
DC
DG
 7.454
4.770
2.944
8.237
8.405
7.383
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
6la8 1 P68431 99.26 2e-95 X-RAY
 2020-10-07 VAL A:118 A:117 125.0 0.806 S -129.4 -19.8 41.0 0.265 0.541 B:P62805:0.348
G:P04908:0.258
 DA
DC
DG
DC
DC
DG
 7.254
4.948
3.085
8.423
8.394
7.581
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 129.0 0.832 S -127.6 -20.2 47.0 0.303 0.529 C:P04908:0.245
F:P62805:0.342
 DC
DC
DA
DG
DA
DC
 8.468
7.774
7.429
4.932
2.631
8.328
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL K:118 K:117 126.0 0.813 S -128.0 -19.5 48.0 0.31 0.503 Q:P04908:0.252
L:P62805:0.316
 DA
DC
DG
DC
DC
DG
 7.444
4.608
2.710
8.555
8.484
7.821
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL O:118 O:117 126.0 0.813 S -128.7 -19.9 46.0 0.297 0.516 M:P04908:0.258
P:P62805:0.329
 DC
DC
DA
DG
DA
DC
 8.419
7.614
7.359
4.648
2.898
8.195
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6la9 1 P68431 99.26 2e-95 X-RAY
 2020-10-07 VAL A:118 A:117 129.0 0.832 S -115.6 -15.1 43.0 0.277 0.555 B:P62805:0.361
G:P04908:0.258
 DA
DC
DG
DC
DC
DG
 7.511
4.805
2.805
8.321
8.401
7.881
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 129.0 0.832 S -114.4 -17.4 50.0 0.323 0.509 C:P04908:0.252
F:P62805:0.316
 DC
DC
DA
DG
DA
DC
 8.534
7.827
7.245
4.936
2.668
8.488
 O
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL K:118 K:117 128.0 0.826 S -115.3 -16.0 48.0 0.31 0.516 Q:P04908:0.265
L:P62805:0.31
 DA
DC
DG
DC
DC
DG
 7.512
4.696
2.746
8.324
8.427
7.781
 CG1
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL O:118 O:117 130.0 0.839 S -114.0 -16.8 45.0 0.29 0.549 P:P62805:0.361
M:P04908:0.252
 DC
DC
DA
DG
DA
DC
 8.238
7.659
7.129
4.477
2.792
8.363
 O
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP2
OP2
6lab 1 P68431 99.26 2e-95 X-RAY
 2021-02-17 VAL A:118 A:117 127.0 0.819 S -100.0 -28.5 48.0 0.31 0.509 B:P62805:0.348
G:P04908:0.232
 DA
DC
DG
DG
DC
DG
 7.634
4.612
2.714
8.593
8.619
7.492
 CB
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 134.0 0.865 S -101.0 -12.9 55.0 0.355 0.51 C:P04908:0.232
F:P62805:0.335
 DC
DG
DA
DC
DG
DG
 8.100
7.368
7.554
4.424
2.635
8.434
 O
O
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL K:118 K:117 129.0 0.832 S -110.6 -24.2 49.0 0.316 0.516 Q:P04908:0.219
L:P62805:0.348
 DA
DC
DG
DG
DC
DG
 6.637
4.358
2.884
8.246
8.402
7.604
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL O:118 O:117 128.0 0.826 S -124.8 -23.3 51.0 0.329 0.497 M:P04908:0.226
P:P62805:0.335
 DC
DG
DA
DC
DG
DG
 8.041
7.403
7.065
4.318
2.800
7.964
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6ler 1 P68431 99.26 2e-95 X-RAY
 2021-03-03 VAL A:118 K:117 128.0 0.826 S -125.4 -9.1 NA NA NA
VAL E:118 O:117 123.0 0.794 S -145.4 -18.4 NA NA NA
VAL K:118 A:117 130.0 0.839 S -132.0 -11.2 43.0 0.277 0.562 Q:P04908:0.277
L:P62805:0.348
 DA
DC
DG
DC
DC
DG
HOH
 7.212
4.498
2.674
8.537
8.443
7.427
2.490
 CG1
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL O:118 E:117 128.0 0.826 S -129.9 -14.3 45.0 0.29 0.536 M:P04908:0.252
P:P62805:0.348
 DC
DC
DA
DG
DA
DC
 8.204
7.515
7.319
4.901
2.794
8.636
 O
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6m3v 1 P68431 99.26 2e-95 X-RAY
 2020-10-07 VAL A:118 A:117 130.0 0.839 S -136.2 -32.2 42.0 0.271 0.568 B:P62805:0.387
G:P04908:0.271
 DC
DC
DA
DG
DA
DC
 7.949
7.720
7.323
4.888
2.556
8.820
 O
O
CB
CB
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
VAL E:118 E:117 130.0 0.839 S -138.0 -32.4 52.0 0.335 0.504 C:P04908:0.239
F:P62805:0.368
 DA
DC
DG
DC
DC
DG
 7.493
4.472
2.347
8.497
8.394
7.907
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL K:118 K:117 129.0 0.832 S -137.5 -32.2 50.0 0.323 0.509 Q:P04908:0.284
L:P62805:0.31
 DA
DC
DG
DC
DC
DG
 7.065
4.971
2.799
9.223
8.545
7.783
 CG1
N
N
N
O
O
 O3'
O3'
OP1
OP1
O3'
OP1
VAL O:118 O:117 127.0 0.819 S -134.6 -33.2 53.0 0.342 0.477 M:P04908:0.245
P:P62805:0.316
 DC
DC
DA
DG
DA
DC
 8.453
7.991
7.394
4.591
2.855
8.200
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6m44 1 P68431 99.26 2e-95 X-RAY
 2020-10-07 VAL A:118 A:117 133.0 0.858 S -103.7 -16.6 47.0 0.303 0.555 B:P62805:0.368
G:P04908:0.265
 DC
DC
DA
DG
DA
DC
 8.095
7.500
7.357
4.974
2.882
8.419
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:118 E:117 135.0 0.871 S -103.9 -18.3 52.0 0.335 0.536 C:P04908:0.239
F:P62805:0.374
 DA
DC
DG
DC
DC
DG
 6.964
4.626
2.574
8.459
8.269
7.555
 CG1
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL K:118 K:117 134.0 0.865 S -102.5 -20.1 55.0 0.355 0.51 Q:P04908:0.239
L:P62805:0.348
 DA
DC
DG
DC
DC
DG
 6.692
4.611
2.620
9.350
8.448
7.541
 CG1
CB
N
N
O
O
 O3'
O5'
OP1
P
O3'
OP1
VAL O:118 O:117 134.0 0.865 S -102.7 -19.3 54.0 0.348 0.517 M:P04908:0.219
P:P62805:0.374
 DC
DC
DA
DG
DA
DC
 8.604
7.692
6.690
4.707
2.796
8.256
 O
O
CG1
CG2
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
6m4d 1 P68431 99.26 2e-95 EM
 2020-09-23 VAL A:118 A:117 119.0 0.768 S -102.4 -16.9 69.0 0.445 0.323 B:P62805:0.323
 DC
DC
DG
DG
DA
DC
 9.038
8.300
6.533
4.033
2.610
7.894
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O5'
OP1
OP1
VAL E:118 E:117 120.0 0.774 S -102.4 -16.9 76.0 0.49 0.284 F:P62805:0.284
 DA
DC
DG
DC
DC
DG
 6.459
4.231
3.140
8.793
8.981
7.267
 CG1
CG1
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
6m4g 3 P68431 99.26 2e-95 EM
 2020-09-23 VAL C:118 A:117 129.0 0.832 S -114.2 -40.7 81.0 0.523 0.309 D:P62805:0.31
 DC
DG
DA
DC
DG
DC
 8.709
7.881
7.017
4.685
3.277
8.982
 CG1
O
CB
CG1
N
N
 O3'
OP1
O3'
OP1
OP1
OP2
VAL F:118 E:117 130.0 0.839 S -114.2 -40.7 81.0 0.523 0.316 G:P62805:0.316
 DG
DG
DA
DC
DC
DC
 6.979
4.960
3.333
8.980
8.561
7.790
 CG2
CG2
CB
N
C
O
 O3'
O5'
OP1
OP2
O3'
OP1
6m4h 3 P68431 99.26 2e-95 EM
 2020-09-23 VAL C:118 A:117 131.0 0.845 S -114.1 -40.7 83.0 0.535 0.31 D:P62805:0.31
 DC
DG
DA
DC
DG
DC
 8.796
7.623
6.944
4.696
3.156
9.021
 O
O
CG1
CG2
CB
N
 O3'
OP1
O3'
OP1
OP1
OP2
VAL G:118 E:117 130.0 0.839 S -114.1 -40.7 81.0 0.523 0.316 H:P62805:0.316
 DG
DG
DA
DC
DC
DC
 6.983
4.766
2.718
8.966
8.637
7.655
 CG2
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
6upk 1 P68431 99.26 2e-95 EM
 2019-12-11 VAL A:118 A:117 150.0 0.968 S -87.9 -31.6 102.0 0.658 0.31 B:P62805:0.284
H:None:0.026
 DA
DC
DG
DC
DC
DG
 5.338
3.313
2.710
9.532
8.315
7.574
 CG2
CG2
N
N
O
O
 O3'
OP1
OP1
OP2
O3'
OP1
VAL E:118 E:117 151.0 0.974 S -64.7 -36.2 97.0 0.626 0.348 F:P62805:0.348
 DC
DC
DG
DG
DA
DC
 8.026
8.061
5.595
3.298
2.125
9.004
 C
CG1
CG1
CG2
N
N
 OP1
OP1
O3'
C5'
OP1
P
6upl 1 P68431 99.26 2e-95 EM
 2019-12-11 VAL A:118 A:117 126.0 0.813 -128.6 -17.1 67.0 0.432 0.381 B:P62805:0.381
 DA
DC
DG
DC
DA
DC
DG
 6.191
3.463
2.772
8.440
9.325
6.711
6.219
 CG1
CG1
N
N
O
O
O
 O3'
C5'
OP1
OP2
O3'
O3'
OP1
VAL E:118 E:117 134.0 0.865 S -108.8 -47.2 72.0 0.465 0.4 F:P62805:0.4
 DC
DC
DC
DG
DG
DA
DC
 9.192
7.053
8.023
7.378
2.441
1.106
5.616
 C
C
CG1
CG2
CG2
CB
N
 C4'
OP1
C5'
O3'
O3'
OP1
OP2
6v92 23 P68431 99.26 2e-95 EM
 2020-01-15 VAL BA:118 a:117 129.0 0.832 S -128.0 1.0 41.0 0.265 0.567 CA:P62805:0.335
HA:P04908:0.297
 DG
DC
DT
DG
DG
DA
 8.637
4.873
2.812
8.107
8.175
7.511
 CB
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL FA:118 e:117 129.0 0.832 S -117.0 -10.0 47.0 0.303 0.529 DA:P04908:0.258
GA:P62805:0.335
 DT
DG
DC
DT
DG
DA
 8.353
7.483
7.990
4.732
2.643
8.544
 O
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
7dbp 2 P68431 99.26 2e-95 EM
 2020-12-23 VAL B:118 A:117 125.0 0.806 S -118.2 -50.2 63.0 0.406 0.4 C:P62805:0.245
H:P04908:0.219
 DT
DA
DC
DG
DG
DT
 8.425
4.779
2.996
8.297
9.624
9.832
 CG2
CB
N
N
C
CG1
 O3'
O3'
OP1
OP2
O5'
C5'
VAL F:118 E:117 125.0 0.806 S -118.2 -50.2 66.0 0.426 0.38 G:P62805:0.245
D:P04908:0.187
 DC
DC
DG
DA
DC
DA
 9.517
8.893
8.906
5.688
4.191
8.874
 C
CG1
CG2
CB
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
7k5x 1 P68431 99.26 2e-95 EM
 2020-11-25 VAL A:118 A:117 130.0 0.839 S -115.5 -7.6 57.0 0.368 0.471 B:P62805:0.29
G:P04908:0.232
 DC
DC
DG
DG
DA
DC
 8.058
7.056
6.594
3.830
2.684
8.521
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL E:118 E:117 133.0 0.858 S -109.1 -18.8 62.0 0.4 0.458 C:P04908:0.206
F:P62805:0.323
 DA
DC
DG
DC
DC
DG
 7.455
4.935
2.612
8.229
8.364
7.763
 CG2
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
7k5y 1 P68431 99.26 2e-95 EM
 2020-11-25 VAL A:118 A:117 128.0 0.826 S -119.6 -4.7 58.0 0.374 0.452 B:P62805:0.277
G:P04908:0.219
 DC
DC
DG
DG
DA
DC
 8.236
6.903
6.415
3.883
2.622
8.522
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL E:118 E:117 128.0 0.826 S -120.0 -17.8 56.0 0.361 0.465 C:P04908:0.252
F:P62805:0.265
 DA
DC
DG
DC
DC
DG
 6.637
4.164
2.909
8.516
8.482
7.412
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
7k60 1 P68431 99.26 2e-95 EM
 2020-11-25 VAL A:118 A:117 127.0 0.819 S -126.3 -2.8 56.0 0.361 0.458 B:P62805:0.303
G:P04908:0.219
 DC
DC
DG
DG
DA
DC
 8.352
7.029
6.727
3.993
2.688
8.313
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:118 E:117 126.0 0.813 S -128.4 -9.0 55.0 0.355 0.458 C:P04908:0.219
F:P62805:0.316
 DA
DC
DG
DC
DC
DG
 6.800
4.251
2.779
8.496
8.499
7.184
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
7k61 1 P68431 99.26 2e-95 EM
 2020-11-25 VAL A:118 A:117 126.0 0.813 S -118.6 -14.8 59.0 0.381 0.432 B:P62805:0.271
G:P04908:0.206
 DC
DC
DG
DG
DA
DC
 8.310
7.253
6.490
3.846
2.553
8.297
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:118 E:117 124.0 0.8 S -118.3 -19.1 53.0 0.342 0.458 C:P04908:0.226
F:P62805:0.284
 DA
DC
DG
DC
DC
DG
 6.676
4.206
2.862
8.388
8.451
7.184
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
7k63 1 P68431 99.26 2e-95 EM
 2020-11-25 VAL A:118 A:117 124.0 0.8 S -123.3 -20.3 53.0 0.342 0.458 B:P62805:0.29
G:P04908:0.226
 DC
DC
DG
DG
DA
DC
 8.608
7.549
6.810
3.916
2.573
8.371
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:118 E:117 126.0 0.813 S -115.9 -18.3 50.0 0.323 0.49 C:P04908:0.245
F:P62805:0.303
 DA
DC
DG
DC
DC
DG
 6.633
4.106
2.675
8.292
8.229
7.304
 CG2
CG2
N
N
CG2
O
 O3'
C5'
OP1
OP2
O3'
OP1
7nl0 1 P68431 99.26 2e-95 EM
 2021-08-11 VAL A:118 A:117 130.0 0.839 S -126.8 -22.0 55.0 0.355 0.484 G:P04908:0.239
B:P62805:0.303
 DG
DT
DA
DG
DT
DT
 7.942
4.511
2.814
8.268
8.153
7.847
 CG2
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 127.0 0.819 S -131.1 -13.6 41.0 0.265 0.554 C:P04908:0.252
F:P62805:0.387
 DA
DA
DA
DC
DT
DT
 8.553
7.096
6.263
3.930
2.666
8.528
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
7v6q 2 P68431 99.26 2e-95 X-RAY
 2021-12-29 VAL B:118 B:117 148.0 0.955 S -84.0 -35.6 98.0 0.632 0.323 C:P62805:0.323
 1PE
 8.259
 O
 C22
VAL F:118 F:117 142.0 0.916 S -85.4 -35.8 NA NA NA
3afa 1 P68431 99.26 2e-95 X-RAY
 2010-05-26 VAL A:121 A:117 126.0 0.813 S -126.7 -5.0 45.0 0.29 0.523 B:P62805:0.342
G:P04908:0.252
 DG
DC
DT
DG
DG
DA
HOH
 8.067
4.754
2.743
8.262
8.018
7.399
2.824
 CG1
CB
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 124.0 0.8 S -127.6 -9.5 43.0 0.277 0.523 C:P04908:0.252
F:P62805:0.342
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.444
7.332
8.071
4.846
2.701
8.505
8.175
2.739
 O
O
CB
N
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
3azi 1 P68431 99.26 2e-95 X-RAY
 2011-09-21 VAL A:121 A:117 120.0 0.774 S -151.7 7.4 48.0 0.31 0.464 B:P62805:0.284
G:P04908:0.265
 DG
DC
DT
DG
DG
DA
HOH
 7.894
4.772
2.677
7.753
8.556
7.470
8.785
 CG1
CB
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 124.0 0.8 S -123.8 -12.2 46.0 0.297 0.503 C:P04908:0.252
F:P62805:0.303
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.195
7.399
7.631
4.585
2.655
8.277
8.153
2.441
 O
O
CG1
CB
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
3azj 1 P68431 99.26 2e-95 X-RAY
 2011-09-21 VAL A:121 A:117 128.0 0.826 S -125.4 -0.6 59.0 0.381 0.445 B:P62805:0.445
 DG
DC
DT
DG
DG
DA
 7.528
4.237
2.725
8.157
8.207
7.356
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 130.0 0.839 S -117.1 -23.4 69.0 0.445 0.394 F:P62805:0.394
 DT
DG
DC
DT
DG
DA
MN
 8.366
7.483
8.075
4.912
2.756
8.389
8.099
 O
O
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
MN
3azk 1 P68431 99.26 2e-95 X-RAY
 2011-09-21 VAL A:121 A:117 126.0 0.813 S -139.3 6.1 41.0 0.265 0.548 B:P62805:0.348
G:P04908:0.297
 DG
DC
DT
DG
DG
DA
 8.299
4.857
2.693
7.893
8.011
7.371
 CB
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 125.0 0.806 S -145.0 -4.5 35.0 0.226 0.58 C:P04908:0.297
F:P62805:0.355
 DT
DG
DC
DT
DG
DA
MN
 8.247
7.311
7.732
4.503
2.619
8.215
8.305
 O
O
CG1
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
MN
3azl 1 P68431 99.26 2e-95 X-RAY
 2011-09-21 VAL A:121 A:117 130.0 0.839 S -135.1 -1.2 44.0 0.284 0.555 B:P62805:0.342
G:P04908:0.284
 DG
DC
DT
DG
DG
DA
HOH
 8.170
4.905
2.795
8.122
8.147
7.552
2.912
 CG1
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 128.0 0.826 S -142.3 -3.0 42.0 0.271 0.555 C:P04908:0.284
F:P62805:0.342
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.224
7.313
7.154
4.319
2.757
8.288
8.316
2.877
 O
O
CG1
CG1
N
N
CG1
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
3azm 1 P68431 99.26 2e-95 X-RAY
 2011-09-21 VAL A:121 A:117 121.0 0.781 S -149.8 5.1 45.0 0.29 0.491 B:P62805:0.271
G:P04908:0.323
 DG
DC
DT
DG
DG
DA
 8.393
4.815
2.728
8.118
8.692
7.178
 CG2
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 128.0 0.826 S -115.1 -4.9 45.0 0.29 0.536 C:P04908:0.284
F:P62805:0.323
 DT
DG
DC
DT
DG
DA
MN
 8.323
7.544
8.165
4.698
2.882
8.170
8.253
 O
O
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
MN
3azn 1 P68431 99.26 2e-95 X-RAY
 2011-09-21 VAL A:121 A:117 127.0 0.819 S -135.3 -3.7 49.0 0.316 0.503 B:P62805:0.329
G:P04908:0.258
 DG
DC
DT
DG
DG
DA
 7.215
3.709
2.888
7.632
8.055
7.491
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 122.0 0.787 S -138.4 -1.0 42.0 0.271 0.516 C:P04908:0.258
F:P62805:0.335
 DT
DG
DC
DT
DG
DA
MN
 8.205
7.358
7.286
4.055
2.793
8.231
8.048
 O
O
CG1
CG1
N
N
CG1
 O3'
OP1
O3'
O3'
OP1
OP2
MN
3w96 1 P68431 99.26 2e-95 X-RAY
 2013-08-28 VAL A:121 A:117 121.0 0.781 S -130.9 6.3 42.0 0.271 0.51 B:P62805:0.316
G:P04908:0.29
 DG
DC
DT
DG
DG
DA
 8.121
4.676
2.644
8.506
8.045
7.378
 CG2
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 121.0 0.781 S -130.6 1.2 45.0 0.29 0.491 C:P04908:0.252
F:P62805:0.284
 DT
DG
DC
DT
DG
DA
 8.616
7.489
8.113
4.634
2.889
7.890
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3w97 1 P68431 99.26 2e-95 X-RAY
 2013-08-28 VAL A:121 A:117 127.0 0.819 -147.9 32.1 55.0 0.355 0.464 B:P62805:0.239
G:P04908:0.31
 DG
DC
DT
DG
DG
DA
 8.431
4.885
2.605
7.784
8.484
7.168
 CB
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 126.0 0.813 S -140.0 16.3 48.0 0.31 0.503 C:P04908:0.245
F:P62805:0.316
 DT
DG
DC
DT
DG
DA
 8.361
7.232
8.492
4.677
2.768
7.855
 O
O
CB
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3w99 1 P68431 99.26 2e-95 X-RAY
 2013-08-28 VAL A:121 A:117 122.0 0.787 -153.3 13.4 40.0 0.258 0.529 B:P62805:0.297
G:P04908:0.323
 DG
DC
DT
DG
DG
DA
 8.635
5.285
2.906
7.804
8.835
7.326
 CB
N
N
N
O
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:121 E:117 120.0 0.774 S -128.4 -11.7 44.0 0.284 0.49 C:P04908:0.252
F:P62805:0.297
 DT
DG
DC
DT
DG
DA
 8.534
7.748
8.310
4.632
2.710
7.916
 O
O
CB
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3wa9 1 P68431 99.26 2e-95 X-RAY
 2013-12-18 VAL A:121 A:117 127.0 0.819 S -127.0 -14.4 44.0 0.284 0.535 B:P62805:0.361
G:P0C0S5:0.252
 DG
DC
DT
DG
DG
DA
 7.357
4.781
2.818
8.080
8.411
7.487
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 126.0 0.813 S -141.4 -20.5 40.0 0.258 0.555 C:P0C0S5:0.252
F:P62805:0.368
 DT
DG
DC
DT
DG
DA
 8.423
7.187
7.475
5.014
2.849
8.554
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
3waa 1 P68431 99.26 2e-95 X-RAY
 2013-12-18 VAL A:121 A:117 125.0 0.806 S -142.7 -21.5 44.0 0.284 0.522 B:P62805:0.361
G:Q71UI9:0.213
 DG
DC
DT
DG
DG
DA
 7.893
4.971
2.896
8.242
8.403
7.370
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 128.0 0.826 S -142.0 -24.0 43.0 0.277 0.549 C:Q71UI9:0.245
F:P62805:0.374
 DT
DG
DC
DT
DG
DA
 8.848
7.465
7.699
5.081
3.113
8.571
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3wkj 1 P68431 99.26 2e-95 X-RAY
 2014-04-09 VAL A:121 A:117 126.0 0.813 S -139.0 0.3 44.0 0.284 0.529 B:P62805:0.348
G:P04908:0.252
 DG
DC
DT
DG
DG
DA
HOH
 8.217
4.906
2.888
7.994
7.690
7.348
3.042
 CG2
CB
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 124.0 0.8 S -137.0 -3.5 40.0 0.258 0.542 C:P04908:0.265
F:P62805:0.348
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.559
7.499
7.343
4.505
2.783
8.283
8.146
2.754
 O
O
CG1
CG1
N
N
N
O
 O3'
OP1
O3'
C3'
OP1
OP2
MN
O
4ym5 1 P68431 99.26 2e-95 X-RAY
 2015-12-02 VAL A:121 A:117 134.0 0.865 S -95.1 -4.3 47.0 0.303 0.562 B:P62805:0.374
G:P04908:0.277
 DG
DC
DT
DG
DG
DA
 7.482
4.544
2.952
8.469
8.628
7.552
 CG2
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 142.0 0.916 S -93.3 -6.6 44.0 0.284 0.632 C:P04908:0.252
F:P62805:0.465
 DG
DA
DG
DC
DT
DG
 8.469
7.847
7.018
4.424
2.967
8.302
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
4ym6 1 P68431 99.26 2e-95 X-RAY
 2015-12-02 VAL A:121 A:117 129.0 0.832 S -120.3 -8.0 46.0 0.297 0.535 B:P62805:0.368
G:P04908:0.232
 DG
DC
DT
DG
DG
DA
 7.655
4.884
2.438
8.341
8.355
7.110
 CB
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 129.0 0.832 S -119.2 -7.8 44.0 0.284 0.548 C:P04908:0.245
F:P62805:0.368
 DT
DG
DC
DT
DG
DA
 8.775
7.197
7.895
4.700
2.500
8.506
 C
O
CB
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
5av5 1 P68431 99.26 2e-95 X-RAY
 2015-12-23 VAL A:121 A:117 134.0 0.865 S -119.6 -1.5 57.0 0.368 0.497 B:P62805:0.277
G:P04908:0.277
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.709
3.741
2.761
8.318
8.290
7.385
8.106
2.918
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL E:121 E:117 127.0 0.819 S -113.9 -9.9 49.0 0.316 0.503 F:P62805:0.387
C:P04908:0.187
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.227
7.340
6.911
3.432
2.676
8.380
8.228
2.851
 O
O
CG1
CG1
N
N
CG1
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5av6 1 P68431 99.26 2e-95 X-RAY
 2015-12-23 VAL A:121 A:117 134.0 0.865 S -118.3 0.6 55.0 0.355 0.51 B:P62805:0.277
G:P04908:0.284
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.711
3.822
2.725
8.305
8.231
7.243
8.391
2.875
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL E:121 E:117 126.0 0.813 S -113.5 -11.4 50.0 0.323 0.49 F:P62805:0.368
C:P04908:0.181
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.404
7.368
6.784
3.454
2.729
8.424
8.252
2.679
 O
O
CG1
CG1
N
N
CG1
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5av8 1 P68431 99.26 2e-95 X-RAY
 2015-12-23 VAL A:121 A:117 137.0 0.884 S -116.7 -1.9 56.0 0.361 0.523 G:P04908:0.284
B:P62805:0.29
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.599
3.648
2.883
8.366
8.219
7.315
8.205
2.840
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL E:121 E:117 127.0 0.819 S -106.9 -9.8 50.0 0.323 0.496 C:P04908:0.181
F:P62805:0.381
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.291
7.313
6.706
3.420
2.851
8.483
8.063
2.729
 O
O
CG1
CG1
N
N
CG1
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5av9 1 P68431 99.26 2e-95 X-RAY
 2015-12-23 VAL A:121 A:117 132.0 0.852 S -119.7 -0.7 55.0 0.355 0.497 B:P62805:0.271
G:P04908:0.29
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.731
3.772
2.785
8.332
8.229
7.254
8.290
2.836
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL E:121 E:117 126.0 0.813 S -114.3 -9.9 51.0 0.329 0.484 C:P04908:0.174
F:P62805:0.381
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.360
7.319
6.746
3.381
2.743
8.365
8.088
2.730
 O
O
CG1
CG1
N
N
CG1
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5avb 1 P68431 99.26 2e-95 X-RAY
 2015-12-23 VAL A:121 A:117 134.0 0.865 S -123.1 1.4 54.0 0.348 0.517 G:P04908:0.277
B:P62805:0.29
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.795
3.789
2.768
8.307
8.263
7.361
8.066
2.876
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL E:121 E:117 128.0 0.826 S -112.8 -8.7 50.0 0.323 0.503 C:P04908:0.194
F:P62805:0.381
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.264
7.422
6.851
3.569
2.646
8.406
8.120
2.828
 O
O
CG1
CG1
N
N
CG1
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5avc 1 P68431 99.26 2e-95 X-RAY
 2015-12-23 VAL A:121 A:117 131.0 0.845 S -123.3 3.2 56.0 0.361 0.484 B:P62805:0.258
G:P04908:0.271
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.757
3.837
2.784
8.304
8.313
7.387
8.246
2.883
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL E:121 E:117 127.0 0.819 S -122.9 -4.4 49.0 0.316 0.503 C:P04908:0.206
F:P62805:0.361
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.127
7.289
6.962
3.689
2.620
8.256
8.423
2.826
 O
O
CG1
CG1
N
N
CG1
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5b1m 1 P68433 99.26 2e-95 X-RAY
 2017-02-15 VAL A:121 A:117 132.0 0.852 S -113.0 4.8 51.0 0.329 0.523 G:P22752:0.271
B:P62806:0.29
 DG
DC
DT
DG
DG
DA
HOH
 6.909
3.836
3.023
8.444
8.369
7.434
9.273
 CG2
CG2
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 125.0 0.806 S -121.1 -9.4 44.0 0.284 0.522 C:P22752:0.258
F:P62806:0.329
 DT
DG
DC
DT
DG
DA
HOH
 8.720
7.512
7.283
4.672
2.697
8.657
2.661
 CG1
O
CG1
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
5b24 1 P68431 99.26 2e-95 X-RAY
 2016-03-02 VAL A:121 A:117 123.0 0.794 S -138.1 -13.0 51.0 0.329 0.465 G:P04908:0.232
B:P62805:0.316
 DG
DC
DT
DG
DG
DA
 8.090
4.470
2.657
7.825
8.763
7.873
 CG1
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:121 E:117 124.0 0.8 S -111.6 -18.1 49.0 0.316 0.484 C:P04908:0.245
F:P62805:0.31
 DT
DG
DC
DT
DG
DA
 8.725
7.872
7.919
4.809
2.558
8.163
 C
O
CB
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
5b2i 1 P68431 99.26 2e-95 X-RAY
 2016-06-15 VAL A:121 A:117 130.0 0.839 S -129.6 -9.8 49.0 0.316 0.523 B:P62805:0.374
G:P04908:0.226
 DC
DG
DT
DG
DG
DA
 8.012
5.075
2.895
7.932
8.325
7.414
 CG2
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 128.0 0.826 S -135.6 -3.9 50.0 0.323 0.503 C:P04908:0.239
F:P62805:0.31
 DT
DG
DG
DT
DG
DA
MN
 8.199
7.499
6.944
3.852
2.805
8.638
9.502
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
MN
5b2j 1 P68431 99.26 2e-95 X-RAY
 2016-06-15 VAL A:121 A:117 130.0 0.839 S -116.5 -13.3 49.0 0.316 0.523 B:P62805:0.342
G:P04908:0.245
 5CM
DG
DT
DG
DG
DA
 8.153
4.770
2.732
8.200
8.381
7.443
 CG2
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 129.0 0.832 S -115.3 1.4 47.0 0.303 0.529 F:P62805:0.342
C:P04908:0.245
 DT
DG
DG
DT
DG
DA
MN
HOH
 8.158
7.475
6.665
3.838
2.691
8.509
8.231
8.939
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5b31 1 P68431 99.26 2e-95 X-RAY
 2016-08-03 VAL A:121 A:117 128.0 0.826 S -113.4 -1.5 51.0 0.329 0.497 B:P62805:0.303
G:P0C0S5:0.245
 DG
DC
DT
DG
DG
DA
HOH
 7.109
3.850
2.899
8.394
8.272
7.315
2.751
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 125.0 0.806 S -116.1 -7.4 52.0 0.335 0.471 F:P62805:0.323
C:P04908:0.194
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.307
7.135
6.885
3.751
2.738
8.626
8.033
2.792
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5cpi 1 P68431 99.26 2e-95 X-RAY
 2015-10-28 VAL A:121 A:117 125.0 0.806 S -108.3 -4.2 49.0 0.316 0.49 B:P62805:0.297
G:P04908:0.258
 DA
DT
DT
DT
DC
DC
 8.078
4.612
2.528
8.078
9.226
8.308
 CG2
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:121 E:117 130.0 0.839 S -105.2 -3.8 43.0 0.277 0.562 C:P04908:0.265
F:P62805:0.368
 DG
DC
DT
DG
DT
DT
 8.652
8.196
7.614
4.655
2.698
8.309
 C
O
CG2
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
5cpj 1 P68431 99.26 2e-95 X-RAY
 2015-10-28 VAL A:121 A:117 128.0 0.826 S -96.1 -5.9 37.0 0.239 0.587 B:P62805:0.439
G:P04908:0.239
 DA
DT
DT
DT
DC
DC
 7.602
4.031
2.650
8.134
8.755
7.936
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 142.0 0.916 S -92.8 -7.8 66.0 0.426 0.49 C:P04908:0.129
F:P62805:0.458
 DG
DC
DT
DG
DT
DT
 8.452
7.851
6.757
3.547
2.731
8.287
 O
CG1
CG1
CB
N
N
 O3'
C5'
O3'
O3'
OP1
OP2
5cpk 1 P68431 99.26 2e-95 X-RAY
 2015-10-28 VAL A:121 A:117 127.0 0.819 S -111.3 0.1 50.0 0.323 0.496 B:P62805:0.329
G:P04908:0.232
 DC
DT
DC
DA
DC
DT
 7.559
4.366
3.274
8.557
7.915
7.399
 CB
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 132.0 0.852 S -108.6 -6.4 45.0 0.29 0.562 C:P04908:0.265
F:P62805:0.368
 DC
DT
DT
DT
DC
DC
 8.324
7.322
7.795
4.566
2.849
8.456
 O
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5gse 1 P68431 99.26 2e-95 X-RAY
 2017-05-03 VAL A:121 A:117 129.0 0.832 S -129.1 -10.4 64.0 0.413 0.419 B:P62805:0.258
G:P04908:0.194
 DG
DG
DA
DC
DC
DC
 6.539
3.807
3.070
8.687
7.967
7.265
 CG2
CG2
CG2
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 125.0 0.806 S -123.3 -6.2 56.0 0.361 0.445 C:P04908:0.232
F:P62805:0.245
 DC
DG
DA
DC
DG
DC
 7.968
7.287
6.659
4.108
2.647
8.205
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL K:121 K:117 130.0 0.839 S -128.6 -13.5 70.0 0.452 0.387 L:P62805:0.387
 DC
DG
DA
DC
DG
DC
 8.384
7.540
6.711
4.569
2.587
8.370
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
OP1
OP1
OP2
VAL O:121 O:117 135.0 0.871 S -128.8 -12.0 47.0 0.303 0.568 P:P62805:0.355
M:P04908:0.29
 DG
DG
DA
DC
DC
DC
 7.393
4.641
2.831
9.110
8.089
7.658
 CG1
CB
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
5gtc 1 P68431 99.26 2e-95 X-RAY
 2017-06-28 VAL A:121 A:117 127.0 0.819 S -129.0 -8.3 45.0 0.29 0.529 B:P62805:0.329
G:P04908:0.252
 DG
DC
DT
DG
DG
DA
 7.991
5.297
3.240
7.972
8.419
7.395
 CG1
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 130.0 0.839 S -122.6 -7.3 46.0 0.297 0.542 C:P04908:0.265
F:P62805:0.329
 DT
DG
DC
DT
DG
DA
MN
 8.521
7.418
7.944
4.750
2.727
8.308
8.063
 O
O
CG1
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
MN
5jrg 1 P68431 99.26 2e-95 X-RAY
 2017-03-08 VAL A:121 A:117 126.0 0.813 S -119.9 9.8 51.0 0.329 0.484 B:P62805:0.297
G:P04908:0.245
 DG
DC
DT
DG
DG
DA
HOH
 7.309
4.030
2.690
8.274
8.584
7.364
6.393
 CG2
CG2
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 129.0 0.832 S -122.0 8.1 52.0 0.335 0.497 C:P04908:0.258
F:P62805:0.29
 DG
DA
DG
DC
DT
DG
HOH
 8.495
7.355
7.090
3.959
2.823
8.274
2.593
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
5y0c 2 P68431 99.26 2e-95 X-RAY
 2018-07-18 VAL C:121 A:117 132.0 0.852 S -120.9 -0.3 53.0 0.342 0.51 D:P62805:0.297
I:P04908:0.284
 DG
DC
DT
DG
DG
DA
HOH
 6.992
4.078
2.723
8.156
8.080
7.114
3.732
 CG2
CG2
N
N
O
O
CG1
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL G:121 E:117 135.0 0.871 S -121.2 -2.9 49.0 0.316 0.555 E:P04908:0.284
H:P62805:0.335
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.355
7.088
7.454
4.549
2.661
8.556
7.905
2.834
 O
O
CG1
N
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5y0d 1 P68431 99.26 2e-95 X-RAY
 2018-07-18 VAL A:121 A:117 130.0 0.839 S -125.2 -6.7 43.0 0.277 0.562 B:P62805:0.335
G:P04908:0.29
 DG
DC
DT
DG
DG
DA
HOH
 8.181
4.929
2.847
8.113
8.267
7.277
2.676
 CG1
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 129.0 0.832 S -124.4 -7.6 44.0 0.284 0.548 C:P04908:0.29
F:P62805:0.316
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.420
7.321
7.733
4.737
2.658
8.550
8.215
2.555
 O
O
CG1
N
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5z30 1 P68431 99.26 2e-95 X-RAY
 2018-07-18 VAL A:121 A:117 130.0 0.839 S -115.6 -3.7 45.0 0.29 0.549 B:P62805:0.342
G:P0C0S5:0.265
 DG
DC
DT
DG
DG
DA
 7.155
4.356
2.998
8.330
8.227
7.440
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 134.0 0.865 S -111.4 -3.4 49.0 0.316 0.549 C:P0C0S5:0.258
F:P62805:0.348
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.290
7.182
6.752
3.827
2.750
8.901
7.868
2.694
 O
O
CG2
CG2
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
6hkt 1 P68431 99.26 2e-95 X-RAY
 2018-10-31 VAL A:121 A:117 133.0 0.858 S -99.0 -23.7 43.0 0.277 0.581 B:P62805:0.361
G:P04908:0.265
 DA
DC
DG
DC
DC
DG
 7.778
4.926
3.038
8.951
8.725
7.939
 CG1
CB
N
N
CG1
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 134.0 0.865 S -100.3 -26.8 56.0 0.361 0.504 C:P04908:0.265
F:P62805:0.303
 DC
DC
DG
DG
DA
DC
 8.376
7.731
7.449
4.237
2.666
7.922
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL K:121 a:117 133.0 0.858 S -102.0 -25.7 65.0 0.419 0.439 Q:P04908:0.194
L:P62805:0.316
 DA
DC
DG
DC
DC
DG
 8.181
4.784
3.122
8.482
8.938
8.139
 CG1
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL O:121 e:117 135.0 0.871 S -96.0 -24.2 46.0 0.297 0.574 M:P04908:0.342
P:P62805:0.31
 DC
DC
DG
DG
DA
DC
 8.124
7.226
7.284
4.431
2.678
8.429
 CG1
O
CB
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL S:121 K:117 136.0 0.877 S -100.8 -25.5 49.0 0.316 0.561 Y:P04908:0.29
T:P62805:0.342
 DA
DC
DG
DC
DC
DG
 8.239
5.168
3.172
8.698
9.438
8.334
 CG1
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL W:121 O:117 135.0 0.871 S -98.4 -27.3 55.0 0.355 0.516 X:P62805:0.297
U:P04908:0.271
 DC
DC
DG
DG
DA
DC
 9.541
8.338
8.158
5.153
3.556
8.715
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL AA:121 k:117 134.0 0.865 S -98.8 -25.9 39.0 0.252 0.613 BA:P62805:0.368
GA:P04908:0.316
 DA
DC
DG
DC
DC
DG
 8.356
4.691
3.026
8.375
8.825
8.083
 CG2
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL EA:121 o:117 135.0 0.871 S -97.3 -23.9 61.0 0.394 0.477 FA:P62805:0.303
CA:P04908:0.219
 DC
DC
DG
DG
DA
DC
 8.406
7.879
7.115
3.914
2.205
7.849
 CG1
CG1
CG1
CB
N
N
 O3'
C5'
O3'
O3'
OP1
OP2
VAL IA:121 U:117 132.0 0.852 S -98.6 -24.6 43.0 0.277 0.575 JA:P62805:0.355
OA:P04908:0.323
 DA
DC
DG
DC
DC
DG
 8.136
4.911
3.052
8.719
8.493
7.864
 CG1
CB
N
N
CG1
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL MA:121 Y:117 134.0 0.865 S -102.1 -24.3 52.0 0.335 0.53 NA:P62805:0.348
KA:P04908:0.252
 DC
DC
DG
DG
DA
DC
 8.589
7.703
8.166
4.486
2.973
7.661
 CG1
CG1
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL QA:121 u:117 134.0 0.865 S -96.4 -24.4 50.0 0.323 0.542 WA:P04908:0.297
RA:P62805:0.342
 DA
DC
DG
DC
DC
DG
 7.318
4.258
2.346
8.638
8.400
7.530
 CG2
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL UA:121 y:117 133.0 0.858 S -102.4 -25.0 46.0 0.297 0.561 SA:P04908:0.31
VA:P62805:0.323
 DC
DC
DG
DG
DA
DC
 8.796
7.884
7.772
4.911
3.171
8.527
 CG1
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6jou 1 P68431 99.26 2e-95 X-RAY
 2020-03-25 VAL A:121 A:117 134.0 0.865 S -108.5 -5.2 49.0 0.316 0.549 B:P62805:0.335
G:P0C0S5:0.277
 DG
DC
DT
DG
DG
DA
HOH
 7.433
3.726
2.948
8.436
8.449
7.344
2.845
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 131.0 0.845 S -106.3 -2.4 49.0 0.316 0.529 C:P0C0S5:0.271
F:P62805:0.31
 DT
DG
DC
DT
DG
DA
HOH
 8.402
7.285
6.823
3.796
2.826
8.989
2.620
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
6jr0 1 P68431 99.26 2e-95 X-RAY
 2019-10-02 VAL A:121 A:117 127.0 0.819 S -111.4 3.5 45.0 0.29 0.529 B:P62805:0.31
C:P04908:0.277
 DG
DC
DT
DG
DG
DA
HOH
 7.162
4.339
2.860
8.182
8.219
7.293
2.441
 CG2
CG2
N
N
O
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 128.0 0.826 S -111.8 3.2 51.0 0.329 0.497 G:P04908:0.265
F:P62805:0.29
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.331
7.074
6.527
3.930
2.707
8.594
7.943
2.732
 O
O
CG2
CG2
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
6jr1 1 P68431 99.26 2e-95 X-RAY
 2019-10-02 VAL A:121 A:117 132.0 0.852 S -111.6 4.6 49.0 0.316 0.536 G:P04908:0.277
B:P62805:0.316
 DG
DC
DT
DG
DG
DA
HOH
 7.069
4.244
2.808
8.086
8.090
7.318
2.885
 CG2
CG2
N
N
O
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 132.0 0.852 S -110.8 4.1 54.0 0.348 0.504 C:P04908:0.271
F:P62805:0.29
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.344
7.040
6.358
3.927
2.790
8.794
7.984
2.766
 O
O
CG2
CG2
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
6k1i 1 P68431 99.26 2e-95 X-RAY
 2020-01-15 VAL A:121 A:117 132.0 0.852 S -115.7 -16.0 51.0 0.329 0.523 B:P62805:0.342
G:P16104:0.245
 DA
DC
DG
DC
DC
DG
HOH
 6.920
4.903
2.867
9.282
9.469
7.331
2.518
 CG1
CG1
N
N
C
O
O
 O3'
O5'
OP1
P
C4'
OP1
O
VAL E:121 E:117 130.0 0.839 S -123.4 -11.6 43.0 0.277 0.562 C:P16104:0.277
F:P62805:0.355
 DC
DC
DA
DG
DA
DC
HOH
 8.221
7.602
7.064
4.638
2.797
8.205
2.398
 O
O
CG1
CG1
N
N
O
 O3'
OP1
O3'
C5'
OP1
OP2
O
6k1j 1 P68431 99.26 2e-95 X-RAY
 2020-01-15 VAL A:121 A:117 131.0 0.845 S -123.6 9.1 53.0 0.342 0.503 B:P62805:0.277
G:P16104:0.284
 DG
DC
DT
DG
DG
DA
HOH
 7.009
3.866
2.913
8.345
8.210
7.201
2.692
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 129.0 0.832 S -121.9 -1.8 54.0 0.348 0.484 C:P16104:0.245
F:P62805:0.29
 DG
DA
DG
DC
DT
DG
HOH
 8.458
7.566
7.112
3.796
2.972
8.201
2.524
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
6k1k 1 P68431 99.26 2e-95 X-RAY
 2020-01-15 VAL A:121 A:117 131.0 0.845 S -118.4 -3.6 48.0 0.31 0.535 G:P16104:0.245
B:P62805:0.342
 DA
DC
DG
DG
DC
DG
MN
HOH
 6.824
4.522
2.699
8.289
8.049
7.286
8.691
2.810
 CG1
N
N
N
O
O
N
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL E:121 E:117 133.0 0.858 S -117.7 -6.0 50.0 0.323 0.535 F:P62805:0.342
C:P16104:0.265
 DC
DG
DA
DC
DG
DG
MN
HOH
 8.217
7.104
7.258
4.758
2.902
8.515
8.744
2.698
 O
O
CG1
N
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
6kvd 2 P68431 99.26 2e-95 X-RAY
 2019-12-18 VAL C:121 A:117 131.0 0.845 S -113.9 2.6 50.0 0.323 0.522 D:P62805:0.297
I:Q9BTM1:0.284
 DG
DC
DT
DG
DG
DA
HOH
 7.083
4.154
2.955
8.300
8.217
7.274
2.851
 CG2
CG2
N
N
O
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL G:121 E:117 129.0 0.832 S -111.1 2.8 50.0 0.323 0.509 E:Q9BTM1:0.271
H:P62805:0.303
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.458
7.239
6.594
4.056
2.769
8.934
8.104
2.619
 O
O
CG2
CG2
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
6l49 7 P68431 99.26 2e-95 EM
 2019-12-04 VAL K:121 K:117 130.0 0.839 S -115.2 -14.9 48.0 0.31 0.529 Q:P04908:0.342
L:P62805:0.239
 DA
DC
DG
DC
DC
DG
 5.291
3.313
2.691
8.325
8.461
7.944
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL O:121 O:117 127.0 0.819 S -113.1 -11.6 34.0 0.219 0.6 M:P04908:0.316
P:P62805:0.361
 DC
DC
DC
DG
DG
DA
DC
 9.823
8.597
7.578
7.128
3.388
2.464
7.750
 C
O
O
CG2
CG2
N
N
 O3'
O3'
OP1
O3'
O3'
OP1
OP2
VAL S:121 S:117 125.0 0.806 S -113.2 -17.5 33.0 0.213 0.593 T:P62805:0.368
Y:P04908:0.329
 DA
DC
DG
DC
DC
DG
 6.446
3.977
2.744
7.859
8.250
7.714
 CG1
CG1
N
N
O
O
 O3'
C5'
OP2
OP2
C5'
OP1
VAL W:121 W:117 124.0 0.8 S -126.0 -18.4 47.0 0.303 0.497 X:P62805:0.239
U:P04908:0.316
 DC
DG
DG
DA
DC
 8.123
6.052
3.722
2.577
8.181
 O
CG2
CG2
N
N
 OP1
O3'
C5'
OP1
OP2
6l4a 1 P68431 99.26 2e-95 EM
 2019-12-04 VAL A:121 A:117 123.0 0.794 S -126.5 -17.9 39.0 0.252 0.542 B:P62805:0.348
G:P04908:0.271
 DA
DC
DG
DC
DC
DG
 6.569
3.822
2.836
8.004
8.808
7.424
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL E:121 E:117 125.0 0.806 S -126.2 -12.8 44.0 0.284 0.522 C:P04908:0.258
F:P62805:0.348
 DC
DC
DG
DG
DA
DC
 8.734
7.466
6.635
3.461
2.492
7.947
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL K:121 K:117 125.0 0.806 S -126.1 -13.5 40.0 0.258 0.548 Q:P04908:0.297
L:P62805:0.342
 DA
DC
DG
DC
DC
DG
 6.582
3.751
2.779
8.100
8.620
7.363
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL O:121 O:117 126.0 0.813 S -124.4 -11.7 44.0 0.284 0.529 P:P62805:0.342
M:P04908:0.271
 DC
DC
DG
DG
DA
DC
 8.677
7.388
6.737
3.650
2.602
8.030
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL S:121 S:117 126.0 0.813 S -130.8 -15.2 40.0 0.258 0.555 Y:P04908:0.29
T:P62805:0.342
 DA
DC
DG
DC
DC
DG
 6.338
3.734
2.817
8.454
8.650
7.363
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL W:121 W:117 126.0 0.813 S -122.3 -13.3 45.0 0.29 0.523 X:P62805:0.355
U:P04908:0.252
 DC
DC
DG
DG
DA
DC
 8.629
7.293
6.708
3.673
2.606
8.140
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6r8y 1 P68431 99.26 2e-95 EM
 2019-06-12 VAL A:121 A:118 126.0 0.813 S -123.7 -12.4 58.0 0.374 0.439 B:P62805:0.258
G:P04908:0.232
 DG
DC
DT
DG
DG
DA
 7.323
3.355
1.618
7.228
8.104
7.816
 HG21
HB
H
H
C
HG12
 O3'
H3'
OP1
OP2
H5''
H5'
VAL E:121 E:118 127.0 0.819 S -121.1 -15.3 62.0 0.4 0.419 C:P04908:0.226
F:P62805:0.265
 DG
DA
DG
DC
DT
DG
 7.873
7.852
6.852
3.862
2.111
7.304
 C
HG12
HB
HB
H
H
 H5'
H5'
O3'
H3'
OP1
OP2
6r8z 1 P68431 99.26 2e-95 EM
 2019-06-12 VAL A:121 A:118 125.0 0.806 S -125.5 -14.3 55.0 0.355 0.451 B:P62805:0.277
G:P04908:0.226
 DG
DC
DT
DG
DG
DA
 7.101
3.686
1.750
7.013
8.259
7.611
 HG21
HB
H
H
C
HG12
 O3'
H3'
OP1
OP2
H5''
H5'
VAL E:121 E:118 129.0 0.832 S -123.7 -8.0 65.0 0.419 0.413 C:P04908:0.155
F:P62805:0.297
 DG
DA
DG
DC
DT
DG
 7.701
7.972
7.113
3.734
1.835
7.386
 O
HG12
HB
HB
H
H
 H5'
H5'
O3'
H5''
OP1
OP2
6r90 1 P68431 99.26 2e-95 EM
 2019-06-12 VAL A:121 A:118 123.0 0.794 -119.9 -5.3 52.0 0.335 0.459 G:P04908:0.29
B:P62805:0.226
 DG
DC
DT
DG
DT
DG
DA
 5.699
2.354
2.443
8.690
9.789
7.717
8.025
 HG21
HG21
H
H
HG23
HG23
HG23
 O3'
H5''
OP1
OP1
H1'
H4'
H5'
VAL E:121 E:118 127.0 0.819 S -118.5 -2.3 55.0 0.355 0.464 C:P04908:0.245
F:P62805:0.258
 DT
DG
DA
DG
DC
DT
DG
 9.979
7.592
7.769
5.946
3.030
2.169
7.480
 HG23
HG23
O
HG21
HG22
H
H
 O3'
H4'
OP1
O3'
H3'
OP1
OP2
6r91 1 P68431 99.26 2e-95 EM
 2019-06-12 VAL A:121 A:118 131.0 0.845 S -118.6 -1.8 67.0 0.432 0.413 B:P62805:0.297
G:P04908:0.142
 DT
DC
DA
DG
DC
DC
DA
 5.410
2.939
1.937
7.714
9.629
7.934
7.520
 HG12
HB
H
H
H
O
HG12
 O3'
H5''
OP1
OP2
H42
H4'
H5'
VAL E:121 E:118 132.0 0.852 S -119.3 -1.8 70.0 0.452 0.4 C:P04908:0.168
F:P62805:0.258
 DG
DC
DG
DA
DA
DC
 7.966
7.600
6.384
2.832
1.801
7.614
 O
HG12
HG11
HB
H
H
 H4'
H5''
O3'
H3'
OP1
OP2
6r92 4 P68431 99.26 2e-95 EM
 2019-06-12 VAL D:121 A:118 130.0 0.839 S -118.3 -1.7 50.0 0.323 0.516 E:P62805:0.361
J:P04908:0.213
 DC
DT
DG
DG
DT
DG
DA
 7.488
3.958
2.799
7.590
7.222
7.168
9.281
 HB
HG23
H
H
C
O
HG12
 O3'
H3'
OP1
OP2
H5''
OP1
OP1
VAL H:121 E:118 132.0 0.852 S -118.4 -1.7 66.0 0.426 0.426 I:P62805:0.368
F:P04908:0.11
 DA
DA
DA
DG
DC
DT
 7.891
7.014
7.384
3.384
1.770
7.355
 O
O
HG21
HG23
H
H
 O3'
OP1
O3'
H3'
OP1
H73
6r93 3 P68431 99.26 2e-95 EM
 2019-06-12 VAL C:121 A:118 128.0 0.826 S -118.9 -2.0 66.0 0.426 0.4 D:P62805:0.277
I:P04908:0.174
 DG
DC
DT
DG
DG
DA
 7.731
4.250
2.466
7.577
7.903
7.837
 HG23
HB
H
H
C
HG12
 O3'
H3'
OP1
OP2
H5'
H5'
VAL G:121 E:118 127.0 0.819 S -119.9 -2.3 69.0 0.445 0.374 E:P04908:0.155
H:P62805:0.277
 DG
DA
DG
DC
DT
DG
 7.801
7.585
6.915
3.812
1.908
6.654
 O
HG12
HG21
HB
H
H
 H5'
H5'
O3'
O3'
OP1
OP2
6r94 3 P68431 99.26 2e-95 EM
 2019-06-12 VAL C:121 A:118 129.0 0.832 S -119.2 -1.9 48.0 0.31 0.522 D:P62805:0.297
I:P04908:0.29
 DG
DC
DT
DG
DG
DA
 7.666
3.784
1.820
7.297
8.386
7.720
 HG21
H
H
H
O
HG12
 O3'
O3'
OP1
OP2
H4'
H5'
VAL G:121 E:118 127.0 0.819 S -119.5 -2.3 55.0 0.355 0.464 E:P04908:0.232
H:P62805:0.277
 DG
DA
DG
DC
DT
DG
 8.804
8.023
7.293
3.602
2.038
7.486
 O
HG12
HB
HB
H
H
 H4'
H5''
O3'
H5''
OP1
OP2
6t90 1 P68431 99.26 2e-95 EM
 2020-05-06 VAL A:121 A:118 131.0 0.845 S -102.7 -40.3 49.0 0.316 0.529 B:P62805:0.374
G:P04908:0.226
 DA
DC
DG
DC
DC
DG
 7.461
4.770
3.017
8.749
8.799
7.892
 CG2
CB
N
N
C
O
 O3'
O3'
OP1
OP2
O3'
OP1
6t93 1 P68431 99.26 2e-95 EM
 2020-05-06 VAL A:121 A:118 132.0 0.852 S -101.1 -38.4 53.0 0.342 0.51 B:P62805:0.348
G:P04908:0.226
 DA
DC
DG
DC
DC
DG
 7.484
4.771
2.891
8.190
8.599
7.641
 CG2
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:118 132.0 0.852 S -104.3 -36.9 50.0 0.323 0.529 C:P04908:0.206
F:P62805:0.387
 DC
DC
DG
DG
DA
DC
 8.509
7.605
7.315
4.953
2.914
8.672
 O
O
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6usj 3 P68431 99.26 2e-95 EM
 2020-10-14 VAL C:121 A:117 134.0 0.865 S -104.1 -17.9 49.0 0.316 0.549 D:P62805:0.355
I:Q08AJ9:0.258
 DG
DG
DA
DC
DC
DC
 6.328
3.680
2.898
8.922
8.335
7.160
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL G:121 E:117 140.0 0.903 S -91.3 -31.0 53.0 0.342 0.561 H:P62805:0.406
E:Q08AJ9:0.219
 DC
DG
DA
DC
DG
DC
 8.680
7.246
5.904
3.620
2.899
8.700
 C
O
CG2
CG2
N
N
 C5'
OP1
O3'
O5'
OP1
OP2
VAL M:121 K:117 133.0 0.858 S -104.2 -17.9 49.0 0.316 0.542 S:Q08AJ9:0.265
N:P62805:0.355
 DG
DG
DA
DC
DC
DC
 6.328
3.681
2.899
8.922
8.361
7.163
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL Q:121 O:117 140.0 0.903 S -91.5 -31.0 53.0 0.342 0.561 R:P62805:0.413
O:Q08AJ9:0.219
 DC
DG
DA
DC
DG
DC
 8.685
7.243
5.896
3.615
2.896
8.696
 C
O
CG2
CG2
N
N
 C5'
OP1
O3'
O5'
OP1
OP2
6v2k 1 P68431 99.26 2e-95 X-RAY
 2020-11-25 VAL A:121 A:117 128.0 0.826 S -126.9 1.5 46.0 0.297 0.529 B:P62805:0.303
G:Q08AJ9:0.284
 DG
DC
DT
DG
DG
DA
 7.090
4.213
2.899
8.216
8.171
7.452
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 128.0 0.826 S -124.3 -1.6 53.0 0.342 0.484 C:Q08AJ9:0.226
F:P62805:0.31
 DT
DG
DC
DT
DG
DA
MN
 8.533
7.213
6.569
3.825
2.571
8.499
7.991
 O
O
CG2
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
MN
6yov 1 P68431 99.26 2e-95 EM
 2020-05-06 VAL A:121 A:118 129.0 0.832 S -104.2 -37.5 50.0 0.323 0.509 B:P62805:0.368
G:P04908:0.187
 DA
DC
DG
DC
DC
DG
 7.527
4.693
2.742
8.244
8.013
7.274
 CG2
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
7c0m 1 P68431 99.26 2e-95 EM
 2020-09-16 VAL A:121 A:117 124.0 0.8 S -122.1 -30.3 46.0 0.297 0.503 B:P62805:0.342
G:P04908:0.239
 DA
DC
DG
DC
DC
DG
 7.359
5.209
3.396
8.183
8.654
8.138
 CG1
CB
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:121 E:117 120.0 0.774 S -124.2 -24.9 48.0 0.31 0.464 C:P04908:0.226
F:P62805:0.323
 DC
DC
DG
DG
DA
DC
 8.870
7.688
7.651
4.729
2.493
7.845
 O
O
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL L:121 a:117 125.0 0.806 S -122.1 -30.3 46.0 0.297 0.509 M:P62805:0.342
R:P04908:0.245
 DA
DC
DG
DC
DC
DG
 7.358
5.209
3.395
8.182
8.654
8.138
 CG1
CB
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL P:121 e:117 119.0 0.768 S -124.2 -25.0 46.0 0.297 0.471 N:P04908:0.226
Q:P62805:0.323
 DC
DC
DG
DG
DA
DC
 8.871
7.689
7.652
4.729
2.492
7.844
 O
O
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
7d1z 1 P68431 99.26 2e-95 EM
 2021-02-10 VAL A:121 A:117 131.0 0.845 S -128.0 -25.0 48.0 0.31 0.535 B:P62805:0.361
F:P04908:0.245
 DA
DC
DG
DC
DC
DG
 7.056
5.105
3.118
8.402
8.620
7.847
 CG1
CG2
N
N
O
O
 O3'
OP1
OP1
OP2
O3'
OP1
VAL E:121 E:117 124.0 0.8 S -128.4 -24.8 43.0 0.277 0.523 K:P62805:0.342
C:P04908:0.252
 DC
DC
DG
DG
DA
DC
 8.539
7.495
7.592
5.053
2.766
8.120
 O
O
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
7scy 3 P68431 99.26 2e-95 EM
 2022-01-12 VAL C:121 A:117 137.0 0.884 S -96.9 -3.4 51.0 0.329 0.555 D:P62805:0.342
I:Q08AJ9:0.277
 DG
DA
DC
DG
DA
DC
DG
DC
 9.974
9.918
7.024
6.938
5.694
2.499
1.835
8.063
 HG23
HG21
HG21
O
HG22
HG22
H
H
 H21
H4'
H4'
OP1
O3'
H5''
OP1
OP2
VAL G:121 E:117 142.0 0.916 S -69.6 -24.5 63.0 0.406 0.51 E:Q08AJ9:0.219
H:P62805:0.355
 DG
DG
DG
DA
DC
DC
DC
DC
DG
 9.768
5.411
2.333
2.122
7.418
9.886
7.268
6.504
9.957
 HB
HG23
HB
H
H
HB
HG12
HG12
HG11
 H22
O3'
H3'
OP2
H5
H4'
H4'
H5''
OP1
7scz 3 P68431 99.26 2e-95 EM
 2022-01-19 VAL C:121 A:117 124.0 0.8 S -112.6 -21.3 46.0 0.297 0.503 D:P62805:0.303
I:Q08AJ9:0.245
 DC
DG
DA
DC
DG
DC
 7.257
6.797
6.160
2.939
1.862
7.893
 HG21
HG21
HG23
HG23
H
H
 H4'
H5''
O3'
H5''
OP1
OP2
VAL G:121 E:117 132.0 0.852 S -78.3 -36.1 52.0 0.335 0.517 H:P62805:0.355
E:Q08AJ9:0.219
 DG
DG
DA
DC
DC
DC
DG
 6.361
3.097
2.033
7.964
7.417
6.655
9.626
 HG22
HB
H
H
HG13
HG13
HG11
 O3'
H5''
OP1
OP2
H4'
H5''
OP1
2io5 2 P84233 100.0 2e-95 X-RAY
 2007-02-27 VAL B:117 B:117 120.0 0.774 -71.6 -32.2 72.0 0.465 0.309 C:P62799:0.31
2nqb 2 P02299 100.0 2e-95 X-RAY
 2007-09-11 VAL C:117 A:517 132.0 0.852 S -126.9 1.8 55.0 0.355 0.497 I:P84051:0.271
D:P84040:0.271
 DG
DC
DG
DG
DG
DA
HOH
 6.963
3.863
2.850
8.251
8.182
7.215
2.889
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 131.0 0.845 S -128.0 2.9 53.0 0.342 0.503 H:P84040:0.31
E:P84051:0.239
 DT
DG
DC
DG
DG
DA
HOH
 8.216
7.249
7.208
4.108
2.878
8.425
2.614
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
2pyo 3 P02299 100.0 2e-95 X-RAY
 2007-11-06 VAL C:117 A:117 130.0 0.839 S -136.2 0.7 51.0 0.329 0.51 D:P84040:0.29
I:P84051:0.29
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.769
3.783
2.755
8.276
8.309
7.414
8.085
4.366
 CG2
CG2
N
N
O
O
CG2
CG1
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL G:117 E:117 131.0 0.845 S -130.4 4.5 51.0 0.329 0.516 H:P84040:0.342
E:P84051:0.239
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.110
7.166
6.848
3.914
2.730
8.445
8.351
2.730
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
3c9k 3 P84229 100.0 2e-95 EM
 2009-01-06 VAL C:117 C:117 125.0 0.806 S -121.1 -23.7 35.0 0.226 0.58 D:P62801:0.419
D:P62801:0.419
E:P02263:0.219
E:P02263:0.219
VAL G:117 G:117 125.0 0.806 S -121.0 -23.7 35.0 0.226 0.58 A:P02263:0.219
A:P02263:0.219
H:P62801:0.419
H:P62801:0.419
4qlc 3 P02299 100.0 2e-95 X-RAY
 2015-07-22 VAL C:117 A:117 133.0 0.858 S -121.6 1.4 55.0 0.355 0.503 D:P84040:0.316
I:P84051:0.219
 DA
DC
DG
DC
DC
DG
 6.528
3.921
2.684
8.135
7.675
6.903
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL G:117 E:117 131.0 0.845 S -127.3 8.1 51.0 0.329 0.516 H:P84040:0.316
E:P84051:0.239
 DC
DC
DG
DG
DA
DC
 7.674
7.010
6.349
3.783
2.879
8.390
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5x0y 1 P84233 100.0 2e-95 EM
 2017-04-19 VAL A:117 A:117 145.0 0.935 S -89.4 5.3 82.0 0.529 0.406 B:P62799:0.142
G:Q6AZJ8:0.277
 DC
DC
DG
DG
DA
DC
 8.400
7.922
6.747
3.519
2.415
9.246
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL E:117 E:117 146.0 0.942 S -89.3 5.2 83.0 0.535 0.407 C:Q6AZJ8:0.277
F:P62799:0.168
 DA
DC
DG
DC
DC
DG
 6.596
3.475
2.584
8.803
9.123
8.017
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
6fml 9 Q71DI3 100.0 2e-95 EM
 2018-04-25 VAL M:117 M:117 140.0 0.903 S -107.9 14.8 63.0 0.406 0.497 N:P62805:0.239
S:P0C0S9:0.31
 DC
DG
DA
DC
DG
DC
 8.314
7.292
5.995
3.948
2.722
8.664
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL Q:117 Q:117 129.0 0.832 S -114.9 -10.8 49.0 0.316 0.516 O:P0C0S9:0.239
R:P62805:0.355
 DG
DG
DA
DC
DC
DC
 6.345
3.839
2.566
8.515
8.552
7.399
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
7eg6 2 P84233 100.0 2e-95 EM
 2022-01-12 VAL B:117 A:117 131.0 0.845 S -115.5 -6.4 53.0 0.342 0.503 H:P06897:0.232
C:P62799:0.329
 DC
DC
DG
DG
DA
DC
 8.473
7.161
6.542
3.991
2.870
8.643
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL F:117 E:117 134.0 0.865 S -121.0 -3.1 57.0 0.368 0.497 G:P62799:0.355
D:P06897:0.187
 DA
DC
DG
DC
DC
DG
 6.497
4.042
2.823
8.540
8.413
7.089
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
7egp 11 P84233 100.0 2e-95 EM
 2022-01-12 VAL L:117 O:117 120.0 0.774 S -104.3 -24.8 54.0 0.348 0.426 R:Q6AZJ8:0.2
M:P62799:0.29
 DA
DC
DG
DC
DA
DC
DG
 5.376
3.600
2.481
8.078
9.435
7.411
7.533
 CG2
CG2
N
N
C
O
O
 O3'
O5'
OP1
OP2
O3'
O5'
OP1
VAL P:117 S:117 113.0 0.729 S -119.3 -20.8 47.0 0.303 0.426 Q:P62799:0.271
N:Q6AZJ8:0.206
 DC
DC
DC
DG
DG
DA
DC
 9.356
6.916
6.902
7.873
4.059
2.558
8.187
 C
O
O
CG2
CG2
N
N
 C5'
C5'
OP1
O3'
O3'
OP1
OP2
7enn 2 P84233 100.0 2e-95 EM
 2021-07-14 VAL B:117 A:117 131.0 0.845 S -119.6 -9.4 61.0 0.394 0.451 C:P62799:0.258
H:P06897:0.232
 DC
DC
DG
DG
DA
DC
 8.648
7.393
6.724
4.066
2.880
8.482
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL F:117 E:117 129.0 0.832 S -119.3 -14.0 54.0 0.348 0.484 D:P06897:0.239
G:P62799:0.29
 DA
DC
DG
DC
DC
DG
 6.808
4.351
3.219
8.676
8.508
7.296
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
5b40 1 Q71DI3 99.26 4e-95 X-RAY
 2016-06-22 VAL A:121 A:117 124.0 0.8 S -144.7 -13.1 43.0 0.277 0.523 B:P62805:0.342
G:P04908:0.239
 DG
DC
DT
DG
DG
DA
 7.176
4.890
2.918
8.023
8.244
7.721
 CG1
CG1
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:121 E:117 117.0 0.755 S -144.8 -15.5 34.0 0.219 0.536 C:P04908:0.239
F:P62805:0.368
 DT
DG
DC
DT
DG
DA
 8.620
7.678
6.974
4.564
2.777
8.179
 CG1
O
CG1
CG1
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
6t79 1 Q71DI3 99.26 4e-95 EM
 2020-04-29 VAL A:118 A:117 130.0 0.839 S -106.8 -24.4 56.0 0.361 0.478 B:P62805:0.271
G:P04908:0.245
 DC
DG
DG
DT
DA
DA
 6.392
3.777
2.655
8.876
9.123
7.963
 CG2
CG2
N
N
CG2
O
 O3'
C3'
OP1
C7
C4'
OP1
VAL E:118 E:117 129.0 0.832 S -109.2 -16.1 56.0 0.361 0.471 C:P04908:0.226
F:P62805:0.277
 DT
DT
DC
DA
DA
DT
 8.710
7.702
6.221
3.809
2.557
8.460
 CG2
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6t7a 1 Q71DI3 99.26 4e-95 EM
 2020-04-29 VAL A:118 A:117 122.0 0.787 S -115.0 -36.9 53.0 0.342 0.445 B:P62805:0.297
G:P04908:0.206
 DC
DG
DG
DT
DA
DA
 6.624
3.692
2.600
8.770
8.957
7.981
 CG2
CG2
N
N
C
O
 O3'
C5'
OP1
OP2
C5'
OP1
VAL E:118 E:117 140.0 0.903 S -82.9 -30.4 59.0 0.381 0.522 C:P04908:0.226
F:P62805:0.374
 DT
DT
DC
DA
DA
DT
 8.775
8.128
7.254
4.400
2.555
8.332
 O
O
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6t7b 1 Q71DI3 99.26 4e-95 EM
 2020-04-29 VAL A:118 A:117 79.0 NA S -115.0 -37.0 63.0 NA NA B:P62805:NA
 DC
DG
DG
DT
DA
DA
 9.066
4.729
2.600
8.769
8.958
7.980
 N
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:118 E:117 89.0 NA S -83.0 -30.4 74.0 NA NA F:P62805:NA
 DT
DT
DC
DA
DA
DT
 8.775
8.128
8.890
4.398
2.554
8.332
 O
O
CA
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6t7c 1 Q71DI3 99.26 4e-95 EM
 2020-04-29 VAL A:118 A:117 120.0 0.774 S -115.5 -37.5 51.0 0.329 0.445 B:P62805:0.284
G:P04908:0.206
 DC
DG
DG
DT
DA
DA
 6.645
3.666
2.539
8.744
8.920
8.014
 CG2
CG2
N
N
C
O
 O3'
C5'
OP1
OP2
C5'
OP1
VAL E:118 E:117 137.0 0.884 S -83.4 -30.3 59.0 0.381 0.503 C:P04908:0.213
F:P62805:0.368
 DT
DT
DC
DA
DA
DT
 8.727
8.091
7.303
4.388
2.511
8.312
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6t7d 1 Q71DI3 99.26 4e-95 EM
 2020-04-29 VAL A:118 A:117 83.0 NA S -114.5 -36.2 65.0 NA NA B:P62805:NA
 DC
DG
DG
DT
DA
DA
 9.393
5.006
3.134
9.170
9.363
8.239
 CA
N
N
N
C
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 94.0 NA S -111.4 13.5 73.0 NA NA F:P62805:NA
 DT
DT
DC
DA
DA
DT
 8.601
7.487
8.832
5.058
2.780
8.937
 O
O
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
7lya 1 P68431 99.26 4e-95 EM
 2021-07-28 VAL A:122 A:117 129.0 0.832 S -130.0 -13.5 56.0 0.361 0.471 B:P62805:0.297
J:P04908:0.206
 DA
DC
DG
DC
DC
DG
 6.638
4.340
3.157
8.669
8.436
7.698
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL D:122 E:117 130.0 0.839 S -130.0 -13.4 58.0 0.374 0.465 E:P62805:0.277
I:P04908:0.219
 DC
DC
DG
DG
DA
DC
 8.629
7.514
6.795
4.144
3.062
8.594
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
7lyb 1 P68431 99.26 4e-95 EM
 2021-07-28 VAL A:122 A:117 129.0 0.832 S -117.1 -5.6 59.0 0.381 0.451 B:P62805:0.252
M:P04908:0.232
 DA
DC
DG
DC
DC
DG
 6.605
4.640
3.205
8.276
9.132
7.665
 CG2
CG2
CG2
N
C
O
 O3'
C5'
OP1
OP2
C5'
OP1
VAL D:122 E:117 130.0 0.839 S -117.2 -5.6 59.0 0.381 0.458 L:P04908:0.232
E:P62805:0.245
 DC
DC
DG
DG
DA
DC
 8.615
7.556
6.752
4.039
3.113
8.702
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
7lyc 1 P68431 99.26 4e-95 EM
 2021-06-16 VAL A:122 A:117 129.0 0.832 S -117.1 -30.4 56.0 0.361 0.471 B:P62805:0.303
L:P04908:0.226
 DA
DC
DG
DC
DC
DG
 7.291
4.959
3.015
8.584
8.477
7.772
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL D:122 E:117 131.0 0.845 S -118.5 -25.9 51.0 0.329 0.516 K:P04908:0.226
E:P62805:0.348
 DC
DC
DG
DG
DA
DC
 8.450
7.488
7.412
4.784
2.746
8.324
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
3azf 1 P68431 98.53 6e-95 X-RAY
 2011-09-21 VAL A:121 A:117 126.0 0.813 S -131.2 -3.2 46.0 0.297 0.516 G:P04908:0.245
B:P62805:0.335
 DG
DC
DT
DG
DG
DA
HOH
 8.111
4.839
2.702
7.864
8.153
7.323
2.984
 CG1
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 126.0 0.813 S -134.1 -10.8 42.0 0.271 0.542 C:P04908:0.239
F:P62805:0.348
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.472
7.295
7.743
5.023
2.840
8.424
8.327
2.821
 O
O
CG1
CB
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
3aze 1 P68431 98.53 6e-95 X-RAY
 2011-09-21 VAL A:121 A:117 124.0 0.8 S -160.9 4.0 50.0 0.323 0.477 B:P62805:0.335
G:P04908:0.232
 DG
DC
DT
DG
DG
DA
 6.818
3.299
2.843
7.670
8.145
6.810
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 124.0 0.8 S -124.7 1.9 46.0 0.297 0.503 C:P04908:0.258
F:P62805:0.316
 DT
DG
DC
DT
DG
DA
MN
 8.697
7.238
7.469
4.099
3.102
8.208
8.052
 O
O
CG1
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
MN
3azh 1 P68431 98.53 6e-95 X-RAY
 2011-09-21 VAL A:121 A:117 131.0 0.845 S -133.4 -4.6 44.0 0.284 0.561 B:P62805:0.348
G:P04908:0.316
 DG
DC
DT
DG
DG
DA
 6.972
4.268
2.725
8.090
8.072
7.293
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 131.0 0.845 S -116.7 5.1 40.0 0.258 0.587 C:P04908:0.277
F:P62805:0.381
 DT
DG
DC
DT
DG
DA
MN
 7.983
7.389
7.090
3.972
2.750
8.383
8.102
 O
O
CG1
CG1
N
N
CG1
 O3'
OP1
O3'
C3'
OP1
OP2
MN
3azg 1 P68431 98.53 6e-95 X-RAY
 2011-09-21 VAL A:121 A:117 124.0 0.8 S -129.8 -2.8 48.0 0.31 0.49 B:P62805:0.323
G:P04908:0.232
 DG
DC
DT
DG
DG
DA
HOH
 7.326
4.314
2.667
8.139
8.359
7.333
2.824
 CG1
CG1
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 126.0 0.813 S -123.5 -11.2 44.0 0.284 0.529 C:P04908:0.245
F:P62805:0.342
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.523
7.322
8.080
4.815
2.700
8.483
8.314
2.686
 O
O
CB
N
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
3ayw 1 P68431 98.53 6e-95 X-RAY
 2011-09-21 VAL A:121 A:117 128.0 0.826 S -130.6 -4.1 43.0 0.277 0.549 B:P62805:0.329
G:P04908:0.316
 DG
DC
DT
DG
DG
DA
 7.319
4.957
2.735
7.890
8.288
7.701
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 125.0 0.806 S -131.8 -5.2 45.0 0.29 0.516 C:P04908:0.29
F:P62805:0.303
 DT
DG
DC
DT
DG
DA
MN
 8.738
7.113
7.119
4.285
3.023
8.425
8.247
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
C3'
OP1
OP2
MN
6ugm 1 Q92133 99.26 8e-95 EM
 2019-11-20 VAL A:117 A:117 137.0 0.884 S -127.4 -6.8 48.0 0.31 0.574 B:P62799:0.419
G:Q6AZJ8:0.213
 DC
DC
DG
DG
DA
DC
 7.964
7.194
6.540
4.074
2.983
8.768
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
VAL E:117 E:117 130.0 0.839 S -123.3 12.7 47.0 0.303 0.536 C:Q6AZJ8:0.206
F:P62799:0.374
 DA
DC
DG
DC
DC
DG
 7.004
4.549
3.065
8.668
8.258
7.370
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
6uh5 1 Q92133 99.26 8e-95 EM
 2019-11-20 VAL A:117 A:117 133.0 0.858 S -133.3 14.7 49.0 0.316 0.542 B:P62799:0.374
G:Q6AZJ8:0.239
 DC
DC
DG
DG
DA
DC
 7.962
7.062
6.534
3.894
2.590
8.721
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:117 E:117 129.0 0.832 S -124.7 20.0 45.0 0.29 0.542 C:Q6AZJ8:0.29
F:P62799:0.31
 DA
DC
DG
DC
DC
DG
 6.919
4.350
2.941
8.590
8.085
7.368
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
6nzo 1 A0A310TTQ1 98.53 1e-94 EM
 2019-08-28 VAL A:118 A:117 137.0 0.884 S -120.2 -0.9 47.0 0.303 0.581 B:P62799:0.368
G:P0CH09+Q6AZJ8:0.284
 DC
DC
DG
DG
DA
DC
 9.006
7.671
6.837
4.100
3.141
8.667
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:118 E:117 121.0 0.781 S -125.8 5.5 46.0 0.297 0.484 C:P0CH09+Q6AZJ8:0.187
F:P62799:0.374
 DA
DC
DG
DC
DC
DG
 7.443
5.031
2.874
8.255
8.450
7.172
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
6px1 1 A0A310TTQ1 98.53 1e-94 EM
 2019-08-28 VAL A:118 A:117 129.0 0.832 S -126.3 -7.6 44.0 0.284 0.548 B:P62799:0.348
G:P0CH09+Q6AZJ8:0.271
 DC
DC
DG
DG
DA
DC
 8.533
7.270
6.569
4.110
2.999
8.587
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
VAL E:118 E:117 129.0 0.832 S -120.6 -7.4 48.0 0.31 0.522 C:P0CH09+Q6AZJ8:0.284
F:P62799:0.31
 DA
DC
DG
DC
DC
DG
 6.715
4.240
3.048
8.460
8.520
7.315
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
6px3 1 A0A310TTQ1 98.53 1e-94 EM
 2019-08-28 VAL A:118 A:117 137.0 0.884 S -120.2 -0.9 47.0 0.303 0.581 B:P62799:0.368
G:P0CH09+Q6AZJ8:0.29
 DC
DC
DG
DG
DA
DC
 9.007
7.671
6.837
4.100
3.141
8.667
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:118 E:117 120.0 0.774 S -125.8 5.5 45.0 0.29 0.484 C:P0CH09+Q6AZJ8:0.187
F:P62799:0.374
 DA
DC
DG
DC
DC
DG
 7.442
5.031
2.873
8.254
8.449
7.171
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
7mbm 5 A0A310TTQ1 98.53 1e-94 EM
 2021-12-29 VAL E:118 G:117 120.0 0.774 S -125.3 -51.4 56.0 0.361 0.413 F:P62799:0.284
K:Q6AZJ8:0.181
 DG
DA
DC
DG
DC
 8.742
8.250
6.084
3.865
8.469
 CG1
CG2
CB
N
N
 OP1
O3'
O3'
OP1
OP2
VAL I:118 K:117 121.0 0.781 S -125.4 -51.4 63.0 0.406 0.375 J:P62799:0.245
G:Q6AZJ8:0.174
 DG
DG
DA
DC
DC
DC
 8.145
5.505
3.436
8.230
9.447
8.584
 CG2
CG2
N
N
CG1
CG1
 O3'
C5'
OP1
OP2
O3'
OP1
7mbn 5 A0A310TTQ1 98.53 1e-94 EM
 2021-12-29 VAL E:118 G:117 148.0 0.955 S -96.8 -16.9 63.0 0.406 0.549 K:Q6AZJ8:0.039
F:P62799:0.523
 DC
DC
DG
DG
DG
DA
DC
 6.973
5.962
9.481
5.327
3.202
2.416
8.545
 O
O
CG1
CG1
CG1
N
N
 O3'
OP1
N2
O3'
C5'
OP1
OP2
VAL I:118 K:117 150.0 0.968 S -96.8 -16.9 71.0 0.458 0.51 J:P62799:0.49
G:Q6AZJ8:0.039
 DA
DC
DG
DC
DA
DC
DG
 6.037
3.042
2.055
8.341
9.809
7.426
6.481
 CG1
CG1
N
N
C
O
O
 O3'
C5'
OP1
OP2
O3'
O3'
OP1
1kx3 2 P84233 99.26 1e-94 X-RAY
 2002-12-25 VAL C:117 A:117 130.0 0.839 S -129.9 4.9 51.0 0.329 0.51 D:P62799:0.277
I:P06897:0.29
 DG
DC
DT
DG
DG
DA
HOH
 6.893
3.900
2.787
8.327
8.288
7.192
2.767
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:117 128.0 0.826 S -124.2 -2.6 56.0 0.361 0.465 H:P62799:0.277
E:P06897:0.239
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.435
7.220
6.944
3.995
2.915
8.702
7.988
2.634
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
1kx4 2 P16105 99.26 1e-94 X-RAY
 2002-12-25 VAL C:117 A:117 131.0 0.845 S -135.1 3.5 46.0 0.297 0.548 D:P02304:0.316
I:P06897:0.297
 DA
DC
DT
DG
DG
DA
HOH
 8.276
4.729
2.660
8.130
7.936
7.512
3.362
 CB
N
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:117 129.0 0.832 S -127.6 -3.0 49.0 0.316 0.516 H:P02304:0.329
E:P06897:0.252
 DT
DG
DC
DT
DG
DA
HOH
 7.915
7.068
7.785
4.802
2.757
8.293
2.781
 O
O
CB
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
1kx5 3 P16105 99.26 1e-94 X-RAY
 2002-12-25 VAL C:117 A:117 132.0 0.852 S -120.3 -1.3 55.0 0.355 0.497 D:P02304:0.265
I:P06897:0.284
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.700
3.817
2.760
8.220
8.295
7.200
8.210
2.706
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL G:117 E:117 129.0 0.832 S -119.2 -0.3 55.0 0.355 0.477 E:P06897:0.245
H:P02304:0.284
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.395
7.206
6.981
3.877
2.959
8.741
8.503
2.768
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
1s32 2 30268544 99.26 1e-94 X-RAY
 2004-05-11 VAL C:117 A:517 133.0 0.858 S -121.5 -0.1 55.0 0.355 0.503 D:P02304:0.265
I:30268540:0.258
 DG
DC
DG
DG
DG
DA
MN
HOH
 6.746
3.836
2.850
8.207
8.389
7.236
8.488
2.725
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL G:117 E:717 131.0 0.845 S -122.8 -0.8 59.0 0.381 0.464 H:P02304:0.277
E:30268540:0.239
 DT
DG
DC
DG
DG
DA
MN
HOH
 8.267
7.254
7.103
3.919
2.910
8.497
8.447
2.747
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
1zbb 3 P84233 99.26 1e-94 X-RAY
 2005-07-12 VAL C:117 A:117 131.0 0.845 S -120.1 -1.4 53.0 0.342 0.503 D:P62799:0.265
I:P06897:0.284
 DT
DG
DC
DT
DG
DG
 8.276
7.182
6.695
3.815
2.756
8.203
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL G:117 E:117 132.0 0.852 S -119.3 -0.3 54.0 0.348 0.504 E:P06897:0.258
H:P62799:0.31
 DC
DT
DG
DG
DT
DG
 6.979
3.872
2.954
8.721
8.378
7.189
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL K:117 a:117 130.0 0.839 S -120.1 -1.3 54.0 0.348 0.491 L:P62799:0.265
Q:P06897:0.284
 DT
DG
DC
DT
DG
DG
 8.277
7.180
6.697
3.817
2.761
8.207
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL O:117 e:117 131.0 0.845 S -119.3 -0.3 53.0 0.342 0.503 M:P06897:0.258
P:P62799:0.31
 DC
DT
DG
DG
DT
DG
 6.980
3.869
2.955
8.721
8.383
7.192
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
2fj7 3 30268544 99.26 1e-94 X-RAY
 2006-09-26 VAL C:117 A:117 117.0 0.755 -166.9 10.0 33.0 0.213 0.542 D:P62799:0.4
I:30268540:0.258
 DT
DG
DC
DT
DG
DA
 8.174
8.264
7.392
4.872
2.883
8.130
 O
O
CG2
CG2
CG2
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL G:117 E:117 129.0 0.832 -134.5 18.9 49.0 0.316 0.516 E:30268540:0.252
H:P62799:0.303
 DG
DG
DC
DT
DA
DA
 6.850
3.509
2.883
8.077
8.472
7.332
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
C7
C5'
OP1
2nzd 3 288992 99.26 1e-94 X-RAY
 2007-04-10 VAL C:117 A:117 130.0 0.839 S -126.0 -2.6 53.0 0.342 0.497 D:P62799:0.265
I:Q6AZJ8:0.284
 DG
DC
DT
DG
DG
DA
HOH
 6.755
3.833
2.769
8.340
8.562
7.425
7.651
 CG2
CG2
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:117 133.0 0.858 S -126.3 -1.0 51.0 0.329 0.529 E:Q6AZJ8:0.271
H:P62799:0.323
 DG
DA
DG
DC
DT
DG
HOH
 8.451
7.438
7.024
4.129
2.741
8.215
6.782
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
O
3b6f 3 P84233 99.26 1e-94 X-RAY
 2007-12-25 VAL C:117 A:117 123.0 0.794 S -140.4 -19.2 40.0 0.258 0.536 D:P62799:0.316
I:Q6AZJ8:0.258
 DC
DT
DG
DG
DT
DG
 7.293
3.801
3.270
9.170
9.045
7.620
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL G:117 E:117 132.0 0.852 S -122.1 -4.9 52.0 0.335 0.517 E:Q6AZJ8:0.232
H:P62799:0.335
 DT
DG
DC
DT
DG
DG
 7.603
6.852
6.718
3.573
2.815
9.062
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3b6g 3 P84233 99.26 1e-94 X-RAY
 2007-12-25 VAL C:117 A:117 126.0 0.813 S -134.2 7.3 51.0 0.329 0.484 D:P62799:0.245
I:Q6AZJ8:0.284
 DC
DT
DG
DG
DT
DG
 7.019
4.131
3.003
8.459
8.267
7.006
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL G:117 E:117 132.0 0.852 S -142.3 14.7 56.0 0.361 0.491 E:Q6AZJ8:0.297
H:P62799:0.271
 DT
DG
DC
DT
DG
DG
 7.995
7.643
6.986
3.346
2.877
8.552
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3c1b 1 P02302 99.26 1e-94 X-RAY
 2008-10-07 VAL A:117 A:517 129.0 0.832 S -124.0 3.8 50.0 0.323 0.509 B:P62799:0.271
G:P06897:0.303
 DG
DC
DG
DG
DG
DA
HOH
 6.998
3.818
2.698
8.322
8.404
7.359
2.626
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:117 E:717 130.0 0.839 S -124.6 -0.7 56.0 0.361 0.478 C:P06897:0.252
F:P62799:0.284
 DT
DG
DC
DG
DG
DA
HOH
 8.427
7.269
6.941
3.849
2.846
8.539
2.761
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
3kuy 1 P84233 99.26 1e-94 X-RAY
 2010-01-05 VAL A:117 A:117 130.0 0.839 S -132.6 1.5 51.0 0.329 0.51 B:P62799:0.303
G:Q6AZJ8:0.271
 DG
DC
DT
DG
DG
DA
 6.854
3.463
2.621
8.148
8.406
7.300
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 134.0 0.865 S -123.4 3.5 52.0 0.335 0.53 C:Q6AZJ8:0.265
F:P62799:0.329
 DG
DA
DG
DC
DT
DG
 8.481
7.391
7.065
4.097
2.806
8.300
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3lja 1 P84233 99.26 1e-94 X-RAY
 2010-04-14 VAL A:117 A:117 129.0 0.832 S -137.7 6.5 51.0 0.329 0.503 B:P62799:0.271
G:Q6AZJ8:0.297
 DC
DT
DG
DG
DT
DG
MN
MN
 6.939
3.840
2.862
8.342
8.410
7.278
8.097
8.527
 CG2
CG2
N
N
O
O
CG2
N
 O3'
O3'
OP1
OP2
O3'
OP1
MN
MN
VAL E:117 E:117 134.0 0.865 S -127.3 4.9 52.0 0.335 0.53 C:Q6AZJ8:0.258
F:P62799:0.323
 DT
DG
DC
DT
DG
DG
MN
 8.474
7.221
7.024
4.374
2.898
8.843
8.591
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
MN
3lz0 1 P84233 99.26 1e-94 X-RAY
 2010-09-15 VAL A:117 A:117 129.0 0.832 S -129.1 -13.5 42.0 0.271 0.561 G:Q6AZJ8:0.284
B:P62799:0.31
 DA
DC
DG
DC
DC
DG
 7.502
4.577
2.685
8.581
8.696
7.554
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 130.0 0.839 S -137.3 -6.8 50.0 0.323 0.516 C:Q6AZJ8:0.277
F:P62799:0.297
 DC
DC
DG
DG
DA
DC
 8.081
7.248
7.022
4.530
2.561
8.009
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
3lz1 1 P84233 99.26 1e-94 X-RAY
 2010-09-15 VAL A:117 A:117 125.0 0.806 S -136.0 -11.6 42.0 0.271 0.535 B:P62799:0.277
G:Q6AZJ8:0.29
 DG
DG
DA
DC
DC
DC
 7.562
4.396
2.805
8.636
8.775
7.523
 CG1
CG1
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:117 E:117 128.0 0.826 S -143.0 -10.0 50.0 0.323 0.503 C:Q6AZJ8:0.265
F:P62799:0.284
 DC
DG
DA
DC
DG
DC
 8.234
7.284
7.286
4.628
2.583
8.006
 O
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3mgp 1 P84233 99.26 1e-94 X-RAY
 2010-06-16 VAL A:117 A:117 136.0 0.877 S -125.4 4.4 50.0 0.323 0.554 B:P62799:0.31
G:Q6AZJ8:0.31
 DG
DC
DT
DG
DG
DA
CO
 6.899
3.827
2.845
8.265
8.300
7.276
9.494
 CG2
CG2
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
CO
VAL E:117 E:117 127.0 0.819 S -132.1 -0.7 52.0 0.335 0.484 C:Q6AZJ8:0.219
F:P62799:0.303
 DC
DT
DT
DG
DG
DA
CO
 8.004
7.290
7.536
3.854
2.967
8.502
9.481
 O
O
CG2
CG2
N
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
CO
3mgq 1 P84233 99.26 1e-94 X-RAY
 2010-06-16 VAL A:117 A:117 133.0 0.858 S -128.6 11.2 55.0 0.355 0.503 B:P62799:0.29
G:Q6AZJ8:0.252
 DG
DC
DT
DG
DG
DA
NI
 6.940
4.024
2.895
8.162
8.037
7.224
9.356
 CG2
CG2
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
NI
VAL E:117 E:117 130.0 0.839 S -138.3 2.6 50.0 0.323 0.516 C:Q6AZJ8:0.226
F:P62799:0.329
 DC
DT
DT
DG
DG
DA
 7.953
7.179
7.353
3.888
2.878
8.648
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
3mgr 1 P84233 99.26 1e-94 X-RAY
 2010-06-16 VAL A:117 A:117 136.0 0.877 S -124.9 0.6 54.0 0.348 0.529 B:P62799:0.284
G:Q6AZJ8:0.303
 DC
DT
DG
DG
DT
DG
MN
 6.725
3.638
2.781
8.408
8.165
7.192
8.032
 CG2
CG2
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
MN
VAL E:117 E:117 131.0 0.845 S -113.0 -7.3 53.0 0.342 0.503 C:Q6AZJ8:0.245
F:P62799:0.31
 DT
DG
DC
DT
DG
DG
MN
 8.345
7.319
6.818
3.827
2.900
8.778
8.398
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
MN
3mgs 1 P84233 99.26 1e-94 X-RAY
 2010-06-16 VAL A:117 A:117 129.0 0.832 S -125.4 4.0 45.0 0.29 0.542 B:P62799:0.316
G:Q6AZJ8:0.297
 DC
DT
DG
DG
DT
DG
MN
 6.930
3.825
2.988
8.479
8.169
7.058
8.573
 CG2
CG2
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
MN
VAL E:117 E:117 129.0 0.832 S -118.4 -5.8 51.0 0.329 0.503 C:Q6AZJ8:0.239
F:P62799:0.316
 DT
DG
DC
DT
DG
DG
MN
 8.358
7.112
7.004
3.897
2.890
8.808
8.725
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
MN
3mnn 1 P84233 99.26 1e-94 X-RAY
 2011-04-06 VAL A:117 A:117 133.0 0.858 S -123.6 9.7 52.0 0.335 0.523 B:P62799:0.284
G:Q6AZJ8:0.29
 DG
DC
DT
DG
DG
DA
 6.846
3.633
2.687
8.352
8.316
7.320
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 134.0 0.865 S -116.6 2.9 54.0 0.348 0.517 C:Q6AZJ8:0.258
F:P62799:0.31
 DG
DA
DG
DC
DT
DG
 8.464
7.472
6.852
3.778
2.788
8.379
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3mvd 1 P84233 99.26 1e-94 X-RAY
 2010-08-25 VAL A:117 A:117 130.0 0.839 S -121.4 1.0 57.0 0.368 0.471 B:P62799:0.265
G:Q6AZJ8:0.258
 DC
DC
DG
DG
DA
DC
 8.293
7.434
6.397
3.744
2.820
8.636
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:117 E:117 130.0 0.839 S -127.8 8.9 53.0 0.342 0.497 C:Q6AZJ8:0.271
F:P62799:0.271
 DA
DC
DG
DC
DC
DG
 6.660
4.100
2.732
8.526
8.022
7.400
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
3o62 1 P84233 99.26 1e-94 X-RAY
 2011-01-05 VAL A:117 A:117 137.0 0.884 S -123.0 -20.8 67.0 0.432 0.452 B:P62799:0.368
G:P06897:0.148
 DC
DC
DG
DG
DA
 7.532
4.005
2.895
8.621
7.668
 CG2
CG2
N
O
O
 O3'
C3'
OP1
O3'
OP1
VAL E:117 E:117 120.0 0.774 -142.3 7.1 40.0 0.258 0.516 C:P06897:0.226
F:P62799:0.335
 DC
DT
DC
DG
DG
DG
DA
 9.847
8.187
7.110
8.043
4.316
2.772
7.614
 C
O
O
CG1
CB
N
N
 O3'
C5'
OP1
O3'
O3'
OP1
OP2
3reh 1 P84233 99.26 1e-94 X-RAY
 2012-03-14 VAL A:117 A:117 136.0 0.877 S -117.0 6.9 56.0 0.361 0.516 B:P62799:0.277
G:P06897:0.297
 DG
DC
DT
DG
DG
DA
HOH
 6.707
3.737
2.691
8.335
8.497
7.317
7.795
 CG2
CG2
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:117 E:117 132.0 0.852 S -122.3 -0.5 53.0 0.342 0.51 C:P06897:0.258
F:P62799:0.31
 DG
DA
DG
DC
DT
DG
HOH
 8.335
7.323
6.868
3.833
2.741
8.385
2.756
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
3rei 1 P84233 99.26 1e-94 X-RAY
 2012-03-14 VAL A:117 A:117 136.0 0.877 S -117.3 5.6 55.0 0.355 0.522 B:P62799:0.29
G:P06897:0.29
 DG
DC
DT
DG
DG
DA
PT
 6.849
3.609
2.785
8.265
8.416
7.362
9.752
 CG2
CG2
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
PT
VAL E:117 E:117 131.0 0.845 S -121.1 -0.1 49.0 0.316 0.529 C:P06897:0.265
F:P62799:0.316
 DG
DA
DG
DC
DT
DG
PT
 8.322
7.341
6.947
4.009
2.722
8.396
9.641
 O
O
CG2
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
PT
3rej 1 P84233 99.26 1e-94 X-RAY
 2012-03-14 VAL A:117 A:117 132.0 0.852 S -121.2 2.7 47.0 0.303 0.549 G:P06897:0.284
B:P62799:0.342
 DA
DC
DT
DG
DG
DA
HOH
 8.151
4.617
2.569
8.408
8.048
7.418
3.563
 CB
N
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:117 E:117 130.0 0.839 S -133.9 -12.5 51.0 0.329 0.51 C:P06897:0.239
F:P62799:0.323
 DT
DG
DC
DT
DG
DA
HOH
 8.156
7.324
7.341
4.804
2.664
8.723
2.771
 O
O
CG1
CB
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
3rek 1 P84233 99.26 1e-94 X-RAY
 2012-03-14 VAL A:117 A:117 132.0 0.852 S -121.7 0.2 46.0 0.297 0.555 B:P62799:0.342
G:P06897:0.277
 DA
DC
DT
DG
DG
DA
PT
 7.916
4.708
2.597
8.312
8.210
7.458
8.573
 CG1
N
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
PT
VAL E:117 E:117 130.0 0.839 S -137.7 -14.4 49.0 0.316 0.523 C:P06897:0.245
F:P62799:0.329
 DT
DG
DC
DT
DG
DA
PT
PT
 8.147
7.376
7.324
4.772
2.649
8.703
8.402
9.031
 O
O
CG1
CB
N
N
CG2
N
 O3'
OP1
O3'
O3'
OP1
OP2
PT
PT
3rel 1 P84233 99.26 1e-94 X-RAY
 2012-03-14 VAL A:117 A:117 134.0 0.865 S -111.2 -6.1 48.0 0.31 0.555 B:P62799:0.329
G:P06897:0.284
 DA
DC
DT
DG
DG
DA
PT
 7.905
4.825
2.698
8.302
8.553
7.717
9.863
 CG1
N
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
PT
VAL E:117 E:117 131.0 0.845 S -138.6 -15.1 51.0 0.329 0.516 C:P06897:0.245
F:P62799:0.342
 DT
DG
DC
DT
DG
DA
PT
 8.281
7.455
7.344
4.883
2.745
8.417
8.500
 O
O
CG1
CB
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
PT
3tu4 1 P84233 99.26 1e-94 X-RAY
 2011-11-23 VAL A:117 A:117 137.0 0.884 S -99.0 -1.2 57.0 0.368 0.516 B:P62799:0.265
G:Q6AZJ8:0.303
 DC
DC
DG
DG
DA
DG
 8.176
7.618
6.610
3.729
2.848
8.603
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL E:117 E:117 132.0 0.852 S -98.9 -2.0 50.0 0.323 0.529 C:Q6AZJ8:0.277
F:P62799:0.297
 DA
DC
DG
DG
DC
DG
 6.757
3.938
2.886
8.468
8.240
7.556
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
3ut9 1 P84233 99.26 1e-94 X-RAY
 2012-04-11 VAL A:117 A:117 137.0 0.884 S -115.0 -13.7 53.0 0.342 0.542 B:P62799:0.335
G:Q6AZJ8:0.265
 DA
DC
DG
DG
DC
DG
MN
 6.710
4.382
2.747
8.383
8.096
7.403
8.960
 CG1
CG1
N
N
O
O
N
 O3'
C5'
OP1
OP2
O3'
OP1
MN
VAL E:117 E:117 136.0 0.877 S -112.9 -9.8 45.0 0.29 0.587 F:P62799:0.387
C:Q6AZJ8:0.265
 DC
DG
DA
DC
DG
DG
MN
HOH
 8.181
7.305
7.142
4.453
2.707
8.474
8.825
2.570
 O
O
CG1
CB
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
3uta 1 P84233 99.26 1e-94 X-RAY
 2012-04-11 VAL A:117 A:117 137.0 0.884 S -116.4 3.3 51.0 0.329 0.555 B:P62799:0.316
G:Q6AZJ8:0.303
 DG
DC
DT
DG
DG
DA
MN
HOH
 6.904
3.670
2.807
8.347
8.227
7.126
9.552
2.715
 CG2
CG2
N
N
O
O
N
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL E:117 E:117 131.0 0.845 S -115.2 -4.2 55.0 0.355 0.49 C:Q6AZJ8:0.245
F:P62799:0.29
 DG
DA
DG
DC
DT
DG
HOH
 8.501
7.356
7.025
3.549
2.972
8.309
2.658
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
3utb 1 P84233 99.26 1e-94 X-RAY
 2012-04-11 VAL A:117 A:117 130.0 0.839 S -121.0 -6.3 45.0 0.29 0.549 G:Q6AZJ8:0.29
B:P62799:0.335
 DA
DC
DT
DG
DG
DA
HOH
 8.185
4.632
2.756
8.329
8.257
7.633
3.829
 CG1
N
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:117 E:117 131.0 0.845 S -126.7 -8.8 50.0 0.323 0.522 F:P62799:0.323
C:Q6AZJ8:0.245
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.131
7.464
7.096
4.627
2.705
8.546
8.171
2.692
 O
O
CG1
CB
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
4j8u 1 P84233 99.26 1e-94 X-RAY
 2013-04-17 VAL A:117 A:117 134.0 0.865 S -121.4 4.6 55.0 0.355 0.51 B:P62799:0.271
G:P06897:0.303
 DG
DC
DT
DG
DG
DA
 6.684
3.676
2.801
8.211
8.328
7.285
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 134.0 0.865 S -121.7 1.2 51.0 0.329 0.536 C:P06897:0.271
F:P62799:0.329
 DG
DA
DG
DC
DT
DG
 8.409
7.466
6.834
3.765
2.801
8.394
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
4j8v 1 P84233 99.26 1e-94 X-RAY
 2013-05-08 VAL A:117 A:117 135.0 0.871 S -123.3 1.0 95.0 0.613 0.258 B:P62799:0.258
 DG
DA
 8.494
7.359
 O
O
 O3'
OP1
VAL E:117 E:117 132.0 0.852 S -123.3 0.7 NA NA NA
4j8w 1 P84233 99.26 1e-94 X-RAY
 2013-04-17 VAL A:117 A:117 132.0 0.852 S -120.6 4.9 54.0 0.348 0.504 B:P62799:0.252
G:Q6AZJ8:0.31
 DG
DC
DT
DG
DG
DA
 6.771
3.652
2.800
8.172
8.445
7.339
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 127.0 0.819 S -122.8 0.2 49.0 0.316 0.503 F:P62799:0.297
C:Q6AZJ8:0.252
 DG
DA
DG
DC
DT
DG
 8.417
7.510
6.884
3.727
2.774
8.393
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
4j8x 1 P84233 99.26 1e-94 X-RAY
 2013-05-08 VAL A:117 A:117 128.0 0.826 S -131.7 14.6 90.0 0.581 0.245 B:P62799:0.245
 DG
DC
DT
DG
 6.877
3.659
2.804
8.181
 CG2
CG2
N
N
 O3'
O3'
OP1
OP2
VAL E:117 E:117 127.0 0.819 S -122.1 5.6 NA NA NA
4r8p 1 P84233 99.26 1e-94 X-RAY
 2014-11-05 VAL A:117 A:117 138.0 0.89 S -108.0 14.8 61.0 0.394 0.496 B:P62799:0.239
G:Q6AZJ8:0.31
 DA
DC
DG
DC
DC
DG
 6.038
3.936
2.735
8.734
8.358
7.438
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 127.0 0.819 S -115.1 -10.8 46.0 0.297 0.522 C:Q6AZJ8:0.252
F:P62799:0.348
 DC
DC
DG
DG
DA
DC
 8.620
7.535
6.369
3.999
2.642
8.575
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
4wu8 3 P84233 99.26 1e-94 X-RAY
 2015-09-02 VAL C:117 A:117 131.0 0.845 S -126.0 3.6 54.0 0.348 0.497 D:P62799:0.271
I:P06897:0.277
 DG
DC
DT
DG
DG
DA
HOH
 7.001
3.752
2.841
8.266
8.190
7.205
2.703
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:117 132.0 0.852 S -127.1 9.0 51.0 0.329 0.523 E:P06897:0.258
H:P62799:0.329
 DG
DA
DG
DC
DT
DG
HOH
 8.061
7.148
7.069
4.019
2.850
8.563
2.740
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
4wu9 1 P84233 99.26 1e-94 X-RAY
 2015-09-02 VAL A:117 A:117 126.0 0.813 S -128.0 -4.8 46.0 0.297 0.516 B:P62799:0.31
G:P06897:0.265
 DG
DC
DT
DG
DG
DA
 7.189
3.560
2.941
8.191
8.209
7.460
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 132.0 0.852 S -115.3 2.2 45.0 0.29 0.562 C:P06897:0.252
F:P62799:0.374
 DG
DA
DG
DC
DT
DG
HOH
 8.124
7.425
7.130
4.249
2.719
8.285
2.947
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
4xuj 1 P84233 99.26 1e-94 X-RAY
 2016-01-27 VAL A:117 A:117 127.0 0.819 S -138.8 10.1 51.0 0.329 0.49 G:Q6AZJ8:0.277
B:P62799:0.265
 DG
DC
DT
DG
DG
DA
 7.104
3.794
2.791
8.099
8.214
7.042
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:117 E:117 127.0 0.819 S -127.0 -3.2 46.0 0.297 0.522 F:P62799:0.316
C:Q6AZJ8:0.258
 DG
DA
DG
DC
DT
DG
 8.596
7.236
6.923
3.919
2.880
8.305
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5cp6 3 P84233 99.26 1e-94 X-RAY
 2016-06-01 VAL C:117 A:117 127.0 0.819 S -127.6 2.1 51.0 0.329 0.49 D:P62799:0.265
I:Q6AZJ8:0.271
 DG
DC
DT
DG
DG
DA
HOH
 7.094
3.961
2.801
8.291
8.390
7.338
2.894
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:117 130.0 0.839 S -121.2 10.3 51.0 0.329 0.51 H:P62799:0.316
E:Q6AZJ8:0.252
 DG
DA
DG
DC
DT
DG
HOH
 8.048
7.284
6.990
3.781
2.663
8.352
2.729
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
5dnm 1 P84233 99.26 1e-94 X-RAY
 2016-09-14 VAL A:117 A:117 130.0 0.839 S -128.7 11.1 49.0 0.316 0.523 B:P62799:0.29
G:Q6AZJ8:0.29
 DG
DC
DT
DG
DG
DA
 7.015
3.837
2.770
8.267
8.165
7.172
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 133.0 0.858 S -118.8 2.5 52.0 0.335 0.523 C:Q6AZJ8:0.258
F:P62799:0.316
 DG
DA
DG
DC
DT
DG
 8.415
7.393
6.984
3.962
2.869
8.369
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5dnn 1 P84233 99.26 1e-94 X-RAY
 2016-09-14 VAL A:117 A:117 132.0 0.852 S -128.0 6.9 50.0 0.323 0.529 B:P62799:0.297
G:Q6AZJ8:0.297
 DG
DC
DT
DG
DG
DA
 6.876
3.779
2.698
8.281
8.288
7.293
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 132.0 0.852 S -118.1 -1.7 52.0 0.335 0.517 C:Q6AZJ8:0.252
F:P62799:0.31
 DG
DA
DG
DC
DT
DG
 8.493
7.458
6.851
3.853
2.808
8.409
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5hq2 1 P84233 99.26 1e-94 X-RAY
 2016-03-23 VAL A:117 A:117 116.0 NA S -101.6 -27.0 76.0 NA NA B:P62799:NA
C:Q6AZJ8:NA
 DA
DC
DG
DC
DC
DG
 7.115
4.856
2.729
8.570
8.954
8.042
 CB
CB
N
N
C
O
 O3'
OP1
OP1
OP2
C5'
OP1
5nl0 1 P84233 99.26 1e-94 X-RAY
 2017-05-17 VAL A:117 A:117 137.0 0.884 S -105.4 -14.2 53.0 0.342 0.542 G:P06897:0.252
B:P62799:0.342
 DA
DC
DG
DG
DC
DG
 7.145
4.525
2.797
8.165
8.343
7.694
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 132.0 0.852 S -114.9 -13.4 44.0 0.284 0.568 C:P06897:0.265
F:P62799:0.381
 DC
DG
DA
DC
DG
DG
 8.572
7.782
7.280
4.528
2.841
8.251
 CG1
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL K:117 K:117 134.0 0.865 S -114.7 -13.2 NA NA NA
5oxv 5 P84233 99.26 1e-94 X-RAY
 2017-10-11 VAL E:117 O:117 127.0 0.819 S -137.3 -6.9 48.0 0.31 0.509 D:P62799:0.297
G:Q6AZJ8:0.265
 DG
DG
DA
DC
DC
DC
 7.021
4.530
2.562
8.010
8.082
7.247
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL I:117 K:117 128.0 0.826 S -129.1 -13.5 42.0 0.271 0.555 C:Q6AZJ8:0.284
H:P62799:0.31
 DC
DG
DA
DC
DG
DC
 8.695
7.553
7.502
4.576
2.684
8.581
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL N:117 E:117 128.0 0.826 S -137.3 -6.8 50.0 0.323 0.503 P:Q6AZJ8:0.271
M:P62799:0.284
 DG
DG
DA
DC
DC
DC
 7.022
4.531
2.562
8.010
8.080
7.247
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL R:117 A:117 128.0 0.826 S -129.1 -13.5 42.0 0.271 0.555 L:Q6AZJ8:0.284
Q:P62799:0.31
 DC
DG
DA
DC
DG
DC
 8.696
7.554
7.501
4.577
2.684
8.580
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5oy7 2 Q92133 99.26 1e-94 X-RAY
 2017-09-20 VAL B:117 M:117 131.0 0.845 S -137.3 -6.8 51.0 0.329 0.516 C:P62799:0.297
R:Q6AZJ8:0.284
 DC
DC
DG
DG
DA
DC
 8.082
7.248
7.023
4.531
2.561
8.011
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL F:117 Q:117 129.0 0.832 S -129.0 -13.5 42.0 0.271 0.561 G:P62799:0.31
W:Q6AZJ8:0.29
 DA
DC
DG
DC
DC
DG
 7.503
4.576
2.685
8.581
8.698
7.556
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL H:117 I:117 129.0 0.832 S -129.1 -13.4 45.0 0.29 0.542 D:Q6AZJ8:0.297
I:P62799:0.258
 DA
DC
DG
DC
DC
DG
 7.500
4.575
2.686
8.582
8.695
7.553
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL J:117 A:117 128.0 0.826 S -129.1 -13.5 43.0 0.277 0.549 P:Q6AZJ8:0.284
K:P62799:0.31
 DA
DC
DG
DC
DC
DG
 7.501
4.577
2.684
8.581
8.696
7.553
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL N:117 E:117 129.0 0.832 S -137.4 -6.8 49.0 0.316 0.516 L:Q6AZJ8:0.277
O:P62799:0.29
 DC
DC
DG
DG
DA
DC
 8.081
7.249
7.022
4.531
2.562
8.010
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL U:117 U:117 129.0 0.832 S -137.4 -6.8 51.0 0.329 0.503 V:P62799:0.29
S:Q6AZJ8:0.265
 DC
DC
DG
DG
DA
DC
 8.081
7.249
7.021
4.530
2.561
8.008
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL Y:117 Y:117 127.0 0.819 S -129.1 -13.4 41.0 0.265 0.554 Z:P62799:0.297
EA:Q6AZJ8:0.297
 DA
DC
DG
DC
DC
DG
 7.503
4.576
2.684
8.581
8.697
7.555
 CG1
CG1
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL CA:117 c:117 128.0 0.826 S -137.3 -7.0 49.0 0.316 0.51 DA:P62799:0.297
AA:Q6AZJ8:0.277
 DC
DC
DG
DG
DA
DC
 8.082
7.248
7.022
4.530
2.561
8.011
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
5xf6 1 P84233 99.26 1e-94 X-RAY
 2017-10-11 VAL A:117 A:117 127.0 0.819 S -135.6 12.4 48.0 0.31 0.509 B:P62799:0.277
G:Q6AZJ8:0.284
 DG
DC
DT
DG
DG
DA
 7.124
3.740
2.765
8.246
8.269
7.170
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 130.0 0.839 S -121.2 2.1 51.0 0.329 0.51 C:Q6AZJ8:0.252
F:P62799:0.31
 DG
DA
DG
DC
DT
DG
 8.417
7.401
7.023
3.963
2.834
8.230
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5z3l 1 P84233 99.26 1e-94 EM
 2019-04-03 VAL A:117 A:117 121.0 0.781 -65.4 -32.8 61.0 0.394 0.387 B:P62799:0.258
G:Q6AZJ8:0.148
 DC
DC
DG
DG
DA
DC
 9.057
8.089
8.524
5.331
2.950
9.770
 CG1
CG1
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
P
VAL E:117 E:117 123.0 0.794 -65.4 -32.8 80.0 0.516 0.278 F:P62799:0.277
 DA
DC
DG
DC
DG
 8.323
5.846
3.845
8.346
9.311
 CB
N
N
N
O
 O3'
O3'
OP2
OP2
OP1
5z3o 1 P84233 99.26 1e-94 EM
 2019-04-03 VAL A:117 A:117 129.0 0.832 S -70.6 -20.0 60.0 0.387 0.445 B:P62799:0.335
G:Q6AZJ8:0.174
 DC
DC
DG
DG
DA
DC
 8.799
7.831
6.967
4.052
2.671
9.700
 CG1
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
P
VAL E:117 E:117 128.0 0.826 S -70.6 -20.0 72.0 0.465 0.361 C:Q6AZJ8:0.123
F:P62799:0.303
 DA
DC
DG
DC
DG
 6.608
4.610
3.195
8.247
8.755
 CG1
CG1
CG1
N
O
 O3'
C5'
OP1
OP2
OP1
5z3u 2 P84233 99.26 1e-94 EM
 2019-05-22 VAL B:117 A:117 130.0 0.839 S -98.4 -4.9 61.0 0.394 0.445 C:P62799:0.265
H:Q6AZJ8:0.239
 DC
DC
DG
DG
DA
DC
 8.961
8.069
6.873
4.410
3.012
8.627
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL F:117 E:117 132.0 0.852 S -98.3 -4.9 60.0 0.387 0.465 D:Q6AZJ8:0.232
G:P62799:0.297
 DA
DC
DG
DC
DC
DG
 7.184
4.058
2.967
8.405
9.084
8.005
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
5z3v 2 P84233 99.26 1e-94 EM
 2019-05-22 VAL B:117 A:117 136.0 0.877 S -94.0 2.0 58.0 0.374 0.503 C:P62799:0.335
H:Q6AZJ8:0.232
 DC
DC
DG
DG
DA
DC
 8.510
7.438
6.533
3.753
2.852
8.733
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL F:117 E:117 137.0 0.884 S -94.0 2.0 60.0 0.387 0.497 D:Q6AZJ8:0.213
G:P62799:0.348
 DA
DC
DG
DC
DC
DG
 6.485
4.306
3.175
8.737
8.622
7.574
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6esf 1 P84233 99.26 1e-94 EM
 2017-12-20 VAL A:117 A:117 134.0 0.865 S -120.9 30.6 57.0 0.368 0.497 B:P62799:0.271
G:Q6AZJ8:0.277
 DG
DG
DA
DC
DC
DC
 6.512
3.978
2.698
8.645
8.577
7.328
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 135.0 0.871 S -105.8 16.6 56.0 0.361 0.51 C:Q6AZJ8:0.316
F:P62799:0.252
 DC
DG
DA
DC
DG
DC
 9.392
7.912
6.463
4.026
3.470
8.765
 O
O
CG2
CG2
N
N
 C5'
OP1
O3'
O5'
OP1
OP2
6esg 1 P84233 99.26 1e-94 EM
 2017-12-20 VAL A:117 A:117 146.0 0.942 S -96.1 6.7 44.0 0.284 0.658 B:P62799:0.426
G:Q6AZJ8:0.239
 DG
DG
DA
DC
DC
DC
 8.096
3.996
2.658
8.619
7.659
7.532
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 138.0 0.89 S -118.0 -6.7 65.0 0.419 0.471 C:Q6AZJ8:0.142
F:P62799:0.323
 DC
DG
DA
DC
DG
DC
 9.319
7.946
5.854
3.610
3.167
8.381
 O
O
CG2
CG2
N
N
 C5'
OP1
O3'
O5'
OP1
OP2
6esh 1 P84233 99.26 1e-94 EM
 2017-12-20 VAL A:117 A:117 138.0 0.89 S -122.0 1.6 46.0 0.297 0.593 B:P62799:0.445
G:Q6AZJ8:0.219
 DG
DG
DA
DC
DC
DC
 7.003
4.003
2.480
8.189
7.786
6.724
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 125.0 0.806 -132.3 6.7 62.0 0.4 0.406 C:Q6AZJ8:0.2
F:P62799:0.2
 DC
DG
DA
DC
DG
DC
 9.159
8.950
5.735
3.291
2.629
8.743
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
6esi 1 P84233 99.26 1e-94 EM
 2017-12-20 VAL A:117 A:117 136.0 0.877 S -109.9 -4.6 83.0 0.535 0.342 B:P62799:0.206
G:Q6AZJ8:0.155
 DG
DG
DA
DC
 6.605
3.995
2.600
7.748
 CG2
CG2
N
N
 O3'
O3'
OP1
OP2
VAL E:117 E:117 148.0 0.955 S -126.5 11.9 77.0 0.497 0.458 F:P62799:0.458
 DA
DC
DG
DC
 6.764
3.502
2.522
7.042
 CG2
CG2
N
N
 O3'
O3'
OP1
OP2
6iro 2 A0A310TTQ1 99.26 1e-94 EM
 2019-04-03 VAL B:117 A:117 123.0 0.794 S -130.4 -20.2 48.0 0.31 0.484 C:P62799:0.387
H:Q6AZJ8:0.174
 DC
DC
DG
DG
DA
DC
 8.981
7.899
6.800
4.118
3.040
9.471
 CG1
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
P
VAL F:117 E:117 126.0 0.813 S -132.8 2.5 52.0 0.335 0.478 D:Q6AZJ8:0.187
G:P62799:0.361
 DA
DC
DG
DC
DC
DG
 7.042
4.359
3.263
8.684
8.587
7.460
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6jyl 1 A0A310TTQ1 99.26 1e-94 EM
 2019-05-29 VAL A:117 A:117 129.0 0.832 S -121.2 2.2 50.0 0.323 0.509 B:P62799:0.348
G:Q6AZJ8:0.232
 DC
DC
DG
DG
DA
DC
 8.875
7.589
6.834
4.057
3.232
8.664
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL E:117 E:117 129.0 0.832 S -125.4 -2.7 59.0 0.381 0.451 C:Q6AZJ8:0.239
F:P62799:0.265
 DA
DC
DG
DC
DC
DG
 7.014
4.208
3.050
8.619
9.123
7.573
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6k1p 1 A0A310TTQ1 99.26 1e-94 EM
 2019-05-29 VAL A:117 A:117 134.0 0.865 S -117.7 6.5 57.0 0.368 0.497 B:P62799:0.284
G:Q6AZJ8:0.265
 DC
DC
DG
DG
DA
DC
 9.252
7.975
7.191
4.325
3.469
9.091
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL E:117 E:117 128.0 0.826 S -124.3 5.1 57.0 0.368 0.458 C:Q6AZJ8:0.239
F:P62799:0.271
 DA
DC
DG
DC
DC
DG
 6.861
4.689
3.611
8.707
9.326
7.903
 CG2
CG2
CG2
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6kiu 1 A0A310TTQ1 99.26 1e-94 EM
 2019-09-11 VAL A:117 A:117 131.0 0.845 S -122.6 -40.4 60.0 0.387 0.458 G:Q6AZJ8:0.219
B:P62799:0.297
 DA
DC
DG
DC
DC
DG
 7.590
5.325
3.149
8.560
9.422
7.908
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:117 E:117 130.0 0.839 S -122.7 -40.3 62.0 0.4 0.439 C:Q6AZJ8:0.213
F:P62799:0.284
 DC
DC
DG
DG
DA
DC
 9.221
8.103
7.631
5.044
2.927
8.531
 C
O
CG2
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
6kiv 1 A0A310TTQ1 99.26 1e-94 EM
 2019-09-11 VAL A:117 A:117 122.0 0.787 -124.0 -43.6 51.0 0.329 0.458 B:P62799:0.342
G:Q6AZJ8:0.194
 DA
DC
DG
DC
DC
DG
 8.724
6.005
3.945
8.248
9.004
8.286
 CG2
N
N
N
C
O
 O3'
O3'
OP2
OP2
C5'
OP1
VAL E:117 E:117 124.0 0.8 -124.0 -43.6 55.0 0.355 0.445 C:Q6AZJ8:0.213
F:P62799:0.297
 DC
DC
DG
DG
DG
DA
DC
 9.218
8.321
9.994
8.413
4.975
2.772
8.041
 CG1
O
CG1
CG2
N
N
N
 O3'
OP1
OP1
O3'
O3'
OP1
OP2
6kiw 1 A0A310TTQ1 99.26 1e-94 EM
 2019-09-11 VAL A:117 A:117 130.0 0.839 S -122.8 -29.5 67.0 0.432 0.407 B:P62799:0.297
G:Q6AZJ8:0.181
 DA
DC
DG
DC
DC
DG
 7.674
5.475
3.969
8.018
9.326
7.948
 CG2
CG2
N
N
O
O
 O3'
OP1
OP1
OP2
O3'
OP1
VAL E:117 E:117 132.0 0.852 S -122.7 -29.5 63.0 0.406 0.446 C:Q6AZJ8:0.213
F:P62799:0.31
 DC
DC
DG
DG
DA
DC
 9.549
8.367
7.938
4.933
2.711
8.019
 C
O
CG2
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
6kix 1 A0A310TTQ1 99.26 1e-94 EM
 2019-09-11 VAL A:117 A:117 121.0 0.781 S -125.2 -51.5 65.0 0.419 0.362 B:P62799:0.316
G:Q6AZJ8:0.071
 DA
DC
DG
DC
DC
DG
 7.293
5.163
2.964
8.198
9.259
7.953
 CG2
CG2
N
N
CG1
CG1
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:117 E:117 121.0 0.781 S -125.2 -51.4 66.0 0.426 0.355 C:Q6AZJ8:0.129
F:P62799:0.277
 DC
DC
DG
DG
DA
DC
 8.816
7.965
7.297
4.700
2.685
8.183
 CG1
CG1
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6kiz 1 A0A310TTQ1 99.26 1e-94 EM
 2019-09-11 VAL A:117 A:117 135.0 0.871 S -120.6 -29.0 51.0 0.329 0.542 B:P62799:0.452
G:Q6AZJ8:0.161
 DA
DC
DG
DC
DC
DG
 7.891
5.864
3.963
8.274
9.517
8.606
 CG2
CG2
N
N
C
O
 O3'
O5'
OP2
OP2
C5'
OP1
VAL E:117 E:117 135.0 0.871 S -120.7 -29.0 71.0 0.458 0.413 C:Q6AZJ8:0.142
F:P62799:0.335
 DC
DC
DG
DG
DA
DC
 9.484
8.203
7.684
4.595
2.652
8.306
 CG1
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
6nn6 1 P84233 99.26 1e-94 EM
 2019-02-13 VAL A:117 A:117 129.0 0.832 S -125.2 -27.3 55.0 0.355 0.477 B:P62799:0.323
G:P06897:0.226
 DA
DC
DG
DC
DC
DG
 7.996
5.527
3.192
8.685
8.982
8.234
 CG2
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 126.0 0.813 S -124.5 -30.7 55.0 0.355 0.458 C:P06897:0.206
F:P62799:0.329
 DC
DC
DG
DG
DA
DC
 9.039
7.882
7.568
5.199
2.929
8.672
 CG1
CG1
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6nog 1 P84233 99.26 1e-94 EM
 2019-02-20 VAL A:117 A:117 127.0 0.819 -116.5 33.0 72.0 0.465 0.354 F:P06897:0.284
C:P62799:0.129
 DC
DC
DG
DG
DA
DC
 9.455
8.220
8.180
5.308
3.193
8.216
 O
O
CB
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
VAL B:117 E:117 125.0 0.806 -122.8 30.4 63.0 0.406 0.4 D:P62799:0.168
E:P06897:0.277
 DA
DC
DG
DC
DC
DG
 6.752
4.677
3.460
8.385
9.514
8.426
 CG2
CG2
N
N
O
O
 O3'
OP1
OP1
OP2
O3'
OP1
6o96 1 P84233 99.26 1e-94 EM
 2019-04-24 VAL A:117 A:117 124.0 0.8 S -129.7 3.0 47.0 0.303 0.497 B:P62799:0.303
G:Q6AZJ8:0.271
 DC
DC
DG
DG
DA
DG
 8.856
7.525
6.718
4.195
2.637
8.206
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL E:117 E:117 117.0 0.755 S -129.8 -8.1 36.0 0.232 0.523 C:Q6AZJ8:0.252
F:P62799:0.342
 DA
DC
DG
DG
DC
DG
 6.517
4.482
2.916
8.226
8.911
7.742
 CG2
CG2
N
N
CG2
O
 O3'
O5'
OP1
OP2
O3'
OP1
6om3 1 P84233 99.26 1e-94 X-RAY
 2019-07-10 VAL A:117 A:117 129.0 0.832 S -110.7 -3.0 53.0 0.342 0.49 B:P62799:0.284
G:Q6AZJ8:0.265
 DC
DC
DG
DG
DA
DG
 8.421
7.201
6.580
3.811
2.581
8.414
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:117 E:117 134.0 0.865 S -119.6 5.7 60.0 0.387 0.478 C:Q6AZJ8:0.258
F:P62799:0.252
 DA
DC
DG
DG
DC
DG
 6.488
3.995
2.930
8.460
8.299
7.081
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL M:117 M:117 127.0 0.819 S -117.1 -13.1 NA NA NA
VAL Q:117 Q:117 127.0 0.819 S -121.5 -3.5 NA NA NA
6pa7 1 P84233 99.26 1e-94 EM
 2020-06-17 VAL A:117 A:117 133.0 0.858 S -124.6 6.1 45.0 0.29 0.568 B:P62799:0.374
G:P06897:0.265
 DC
DC
DG
DG
DA
DC
 8.333
7.292
6.537
3.768
2.568
8.521
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL E:117 E:117 134.0 0.865 S -110.6 7.5 50.0 0.323 0.542 C:P06897:0.258
F:P62799:0.355
 DA
DC
DG
DC
DC
DG
 6.358
3.710
2.587
8.484
8.464
6.965
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6r1u 1 P84233 99.26 1e-94 EM
 2019-04-24 VAL A:117 A:117 136.0 0.877 S -120.9 30.6 58.0 0.374 0.503 B:P62799:0.265
G:Q6AZJ8:0.284
 DG
DG
DA
DC
DC
DC
 6.514
3.980
2.699
8.644
8.577
7.327
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 134.0 0.865 S -105.9 16.6 58.0 0.374 0.491 C:Q6AZJ8:0.303
F:P62799:0.245
 DC
DG
DA
DC
DG
DC
 9.392
7.912
6.462
4.025
3.470
8.766
 O
O
CG2
CG2
N
N
 C5'
OP1
O3'
O5'
OP1
OP2
6r25 4 A0A310TTQ1 99.26 1e-94 EM
 2019-04-24 VAL D:117 A:117 134.0 0.865 S -120.9 30.6 56.0 0.361 0.504 E:None:0.265
J:Q6AZJ8:0.284
 DG
DG
DA
DC
DC
DC
 6.513
3.981
2.699
8.645
8.577
7.327
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL H:117 E:117 136.0 0.877 S -105.8 16.5 57.0 0.368 0.509 I:None:0.265
F:Q6AZJ8:0.31
 DC
DG
DA
DC
DG
DC
 9.391
7.912
6.463
4.025
3.470
8.766
 O
O
CG2
CG2
N
N
 C5'
OP1
O3'
O5'
OP1
OP2
6t9l 1 P84233 99.26 1e-94 EM
 2020-01-29 VAL A:117 A:117 131.0 0.845 S -115.4 -44.8 62.0 0.4 0.445 B:P62799:0.316
G:Q6AZJ8:0.206
 DA
DC
DG
DC
DC
DG
 8.194
5.807
3.925
8.274
8.699
7.727
 CG2
CG2
N
N
CG1
CG1
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:117 E:117 137.0 0.884 S -118.4 -27.1 77.0 0.497 0.387 C:Q6AZJ8:0.174
F:P62799:0.271
 DC
DC
DG
DG
DA
DC
 9.438
8.359
7.988
4.675
3.160
7.827
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6tda 1 P84233 99.26 1e-94 EM
 2020-03-18 VAL A:117 A:117 137.0 0.884 S -123.5 17.3 59.0 0.381 0.503 B:P62799:0.316
G:Q6AZJ8:0.245
 DC
DC
DG
DG
DA
DC
 8.206
7.332
6.306
4.010
2.865
8.783
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:117 E:117 141.0 0.91 S -85.3 -11.3 67.0 0.432 0.478 F:P62799:0.258
C:Q6AZJ8:0.258
 DA
DC
DG
DC
DC
DG
 6.264
3.646
2.774
9.004
8.759
7.621
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6uxw 1 P84233 99.26 1e-94 EM
 2020-03-18 VAL A:117 R:117 137.0 0.884 S -94.0 2.0 59.0 0.381 0.503 B:P62799:0.342
G:P06897:0.239
 DC
DC
DG
DG
DA
DC
 8.509
7.438
6.532
3.754
2.852
8.734
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL E:117 V:117 137.0 0.884 S -94.0 1.8 61.0 0.394 0.49 C:P06897:0.206
F:P62799:0.342
 DA
DC
DG
DC
DC
DG
 6.486
4.306
3.176
8.737
8.622
7.574
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
6wz5 1 P84233 99.26 1e-94 EM
 2020-09-16 VAL A:117 A:117 131.0 0.845 S -111.4 4.8 55.0 0.355 0.49 B:P62799:0.271
G:Q6AZJ8:0.265
 DG
DG
DA
DC
DC
DC
 6.465
3.791
2.811
8.422
8.168
7.325
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 133.0 0.858 S -112.8 1.6 57.0 0.368 0.49 C:Q6AZJ8:0.252
F:P62799:0.284
 DC
DG
DA
DC
DG
DC
 8.160
7.213
6.492
3.984
2.754
8.397
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
6wz9 1 P84233 99.26 1e-94 EM
 2020-09-16 VAL A:117 A:117 134.0 0.865 S -111.7 4.6 51.0 0.329 0.536 G:Q6AZJ8:0.277
B:P62799:0.31
 DG
DG
DA
DC
DC
DC
 6.598
3.822
2.560
8.239
8.044
7.178
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 131.0 0.845 S -112.8 1.5 53.0 0.342 0.503 C:Q6AZJ8:0.252
F:P62799:0.297
 DC
DG
DA
DC
DG
DC
 8.541
7.582
6.545
4.044
2.691
8.448
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
6x0n 1 P84233 99.26 1e-94 EM
 2020-09-16 VAL A:117 A:117 131.0 0.845 S -110.9 4.8 45.0 0.29 0.555 B:P62799:0.271
G:Q6AZJ8:0.361
 DG
DG
DA
DC
DC
DC
 6.891
4.248
3.339
8.836
7.953
7.033
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 134.0 0.865 S -111.8 1.9 47.0 0.303 0.562 C:Q6AZJ8:0.355
F:P62799:0.284
 DC
DG
DA
DC
DG
DC
 7.723
6.788
6.472
4.019
3.391
9.147
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
VAL K:117 a:117 138.0 0.89 S -111.0 3.9 52.0 0.335 0.555 Q:Q6AZJ8:0.381
L:P62799:0.239
 DG
DG
DA
DC
DC
DC
 6.253
3.742
3.001
8.918
7.445
6.894
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL O:117 e:117 133.0 0.858 S -111.8 0.6 52.0 0.335 0.523 M:Q6AZJ8:0.342
P:P62799:0.252
 DC
DG
DA
DC
DG
DC
 8.694
7.898
6.547
4.115
3.505
8.882
 O
O
CG2
CG2
CG2
N
 O3'
OP1
O3'
O5'
OP1
OP2
7at8 3 P84233 99.26 1e-94 EM
 2020-12-09 VAL C:117 D:117 125.0 0.806 S -115.5 -44.6 58.0 0.374 0.432 D:P62799:0.303
I:Q6AZJ8:0.174
 DA
DC
DG
DC
DC
DG
 8.147
5.823
3.953
8.616
8.879
7.959
 CG2
CG2
N
N
CG1
CG1
 O3'
O5'
OP1
OP2
O3'
OP1
VAL G:117 H:117 132.0 0.852 S -115.7 -45.2 57.0 0.368 0.484 E:Q6AZJ8:0.297
H:P62799:0.252
 DC
DG
DG
DA
DC
 9.286
8.008
5.435
3.893
8.760
 O
CG1
CB
C
N
 OP1
O3'
O3'
OP1
OP2
7e8i 3 A0A310TTQ1 99.26 1e-94 EM
 2021-06-30 VAL C:117 A:117 134.0 0.865 S -115.1 -43.1 44.0 0.284 0.581 D:P62799:0.426
I:Q6AZJ8:0.239
 DC
DG
DA
DC
DG
DC
 8.718
7.718
6.517
4.345
3.460
8.053
 C
O
CG2
CG2
N
N
 O3'
OP1
O3'
OP1
OP1
OP2
VAL G:117 E:117 131.0 0.845 S -125.0 -20.9 50.0 0.323 0.522 H:P62799:0.381
E:Q6AZJ8:0.206
 DG
DG
DA
DC
DC
DC
 6.185
3.664
2.600
8.332
8.636
7.780
 CG1
CG1
N
N
CG1
O
 O3'
C5'
OP1
OP2
O3'
OP1
7oh9 1 P84233 99.26 1e-94 EM
 2021-07-28 VAL A:117 A:117 124.0 0.8 S -119.9 -23.3 51.0 0.329 0.471 B:P62799:0.265
G:Q6AZJ8:0.258
 DA
DC
DG
DC
DC
DG
 6.675
4.189
3.022
8.429
8.893
7.624
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:117 E:117 124.0 0.8 S -121.0 -44.5 46.0 0.297 0.503 C:Q6AZJ8:0.226
F:P62799:0.342
 DC
DC
DG
DG
DA
DC
 8.617
7.588
7.325
4.801
2.606
8.151
 CG1
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
7oha 1 P84233 99.26 1e-94 EM
 2021-07-28 VAL A:117 A:117 126.0 0.813 S -119.4 -46.3 43.0 0.277 0.536 B:P62799:0.361
G:Q6AZJ8:0.226
 DA
DC
DG
DC
DC
DG
 6.612
4.710
2.706
8.610
8.418
7.569
 CG1
CG1
N
N
CG1
O
 O3'
OP1
OP1
OP2
O3'
OP1
VAL E:117 E:117 124.0 0.8 S -120.4 -40.5 47.0 0.303 0.497 C:Q6AZJ8:0.232
F:P62799:0.323
 DC
DC
DG
DG
DA
DC
 8.491
8.022
7.505
4.934
2.748
8.473
 C
O
CG2
CB
N
N
 C5'
OP1
O3'
C3'
OP1
OP2
7ohb 1 P84233 99.26 1e-94 EM
 2021-07-28 VAL A:117 A:117 131.0 0.845 S -120.3 -30.3 52.0 0.335 0.51 B:P62799:0.374
G:Q6AZJ8:0.206
 DA
DC
DG
DC
DC
DG
 7.048
4.858
2.637
8.602
8.849
7.433
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:117 E:117 120.0 0.774 S -120.9 -28.3 46.0 0.297 0.477 C:Q6AZJ8:0.226
F:P62799:0.316
 DC
DC
DG
DG
DA
DC
 8.855
7.466
6.521
3.948
2.721
8.734
 CG2
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
7ohc 1 P84233 99.26 1e-94 EM
 2021-07-28 VAL A:117 A:117 125.0 0.806 S -118.3 -38.1 52.0 0.335 0.471 B:P62799:0.277
G:Q6AZJ8:0.239
 DA
DC
DG
DC
DC
DG
 6.095
3.938
2.812
8.657
8.776
7.465
 CG2
CG2
N
N
CG2
O
 O3'
O5'
OP1
OP2
C4'
OP1
VAL E:117 E:117 126.0 0.813 S -120.0 -41.8 44.0 0.284 0.529 C:Q6AZJ8:0.232
F:P62799:0.335
 DC
DC
DG
DG
DA
DC
 8.685
7.631
7.553
4.860
2.772
8.439
 CG1
O
CB
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
3x1s 1 P68431 99.26 2e-94 X-RAY
 2015-09-23 VAL A:117 A:117 122.0 0.787 S -130.8 -29.9 47.0 0.303 0.484 B:P62805:0.335
G:P04908:0.219
 DG
DC
DT
DG
DG
DA
 7.978
5.017
2.687
7.803
8.797
7.389
 CG2
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:117 E:117 122.0 0.787 S -119.4 -31.0 49.0 0.316 0.471 C:P04908:0.226
F:P62805:0.316
 DT
DG
DC
DT
DG
DA
 8.667
7.803
7.712
4.422
2.571
8.294
 C
O
CG2
CB
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
3x1t 2 P68431 99.26 2e-94 X-RAY
 2015-09-23 VAL C:117 A:117 130.0 0.839 S -125.9 -15.8 46.0 0.297 0.542 D:P62805:0.323
I:Q8CGP4:0.297
 DG
DC
DT
DG
DG
DA
HOH
 7.444
5.100
2.979
8.162
8.485
7.569
5.599
 CG1
CG1
N
N
O
O
N
 O3'
O5'
OP1
OP2
O3'
OP1
O
VAL G:117 E:117 133.0 0.858 S -121.1 -19.1 38.0 0.245 0.613 H:P62805:0.406
E:Q8CGP4:0.252
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.641
7.231
7.640
4.796
2.663
8.304
8.216
2.973
 C
O
CG1
CB
N
N
N
O
 C5'
OP1
O3'
O3'
OP1
OP2
MN
O
3x1u 2 P68431 99.26 2e-94 X-RAY
 2015-09-23 VAL C:117 A:117 131.0 0.845 S -133.9 -3.1 43.0 0.277 0.568 D:P62805:0.361
I:Q8CGP4:0.297
 DG
DC
DT
DG
DG
DA
 7.834
5.250
2.970
7.907
8.441
7.402
 CG1
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL G:117 E:117 121.0 0.781 -130.7 -5.6 48.0 0.31 0.471 H:P62805:0.323
E:Q8CGP4:0.219
 DT
DG
DC
DT
DG
DA
 8.612
7.566
6.789
3.514
2.579
7.997
 CG1
O
CG1
CG1
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
3x1v 2 P68431 99.26 2e-94 X-RAY
 2015-09-23 VAL C:117 A:117 134.0 0.865 S -119.1 -13.3 47.0 0.303 0.562 D:P62805:0.335
I:P04908:0.29
 DG
DC
DT
DG
DG
DA
HOH
 7.895
5.121
2.840
8.191
8.464
7.419
5.571
 CG1
N
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:117 133.0 0.858 S -118.5 -14.5 48.0 0.31 0.548 H:P62805:0.335
E:P04908:0.271
 DT
DG
DC
DT
DG
DA
CL
 8.583
7.380
7.142
4.744
2.673
8.385
8.120
 O
O
CG1
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
CL
5gsu 1 P68431 99.26 2e-94 X-RAY
 2017-02-15 VAL A:117 A:117 128.0 0.826 S -124.6 6.3 50.0 0.323 0.503 F:Q96QV6:0.29
C:P62805:0.284
 DG
DC
DT
DG
DG
DA
 6.862
4.150
3.124
8.303
7.876
7.367
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL B:117 E:117 127.0 0.819 S -122.4 4.0 45.0 0.29 0.529 D:P62805:0.342
E:Q96QV6:0.245
 DT
DG
DC
DT
DG
DA
MN
 8.440
7.140
6.799
3.996
2.685
8.507
8.233
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
MN
5gt0 1 P68431 99.26 2e-94 X-RAY
 2017-02-15 VAL A:117 A:117 133.0 0.858 S -116.1 9.3 46.0 0.297 0.561 F:Q96QV6:0.284
C:P62805:0.342
 DG
DC
DT
DG
DG
DA
 7.207
4.778
3.053
8.546
8.256
7.485
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL B:117 E:117 137.0 0.884 S -115.2 8.5 51.0 0.329 0.555 D:P62805:0.323
E:Q96QV6:0.284
 DT
DG
DC
DT
DG
DA
CL
HOH
 8.377
7.284
6.834
4.353
2.917
8.839
8.150
4.041
 O
O
CG2
CG2
N
N
CG1
CG1
 O3'
OP1
O3'
O3'
OP1
OP2
CL
O
5gt3 1 P68431 99.26 2e-94 X-RAY
 2017-02-15 VAL A:117 A:117 130.0 0.839 S -124.7 11.9 50.0 0.323 0.516 B:P62805:0.335
G:P20671:0.252
 DG
DC
DT
DG
DG
DA
 7.271
4.588
3.041
8.328
7.975
7.284
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 131.0 0.845 S -124.1 12.1 49.0 0.316 0.529 C:P20671:0.252
F:P62805:0.323
 DT
DG
DC
DT
DG
DA
MN
 8.328
7.245
7.137
4.535
2.755
8.536
8.173
 O
O
CG2
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
MN
7bwd 5 P68431 99.26 2e-94 EM
 2021-04-14 VAL E:117 E:117 123.0 0.794 -123.4 -45.5 55.0 0.355 0.439 H:P04908:0.226
B:P62805:0.271
 DA
DC
DG
DC
DC
DG
 8.255
5.486
3.241
8.686
9.629
8.768
 CG1
N
N
N
C
CG1
 O3'
O3'
OP1
OP2
C5'
OP1
VAL F:117 A:117 121.0 0.781 -112.2 -33.3 55.0 0.355 0.426 C:P04908:0.232
I:P62805:0.258
 DC
DC
DG
DG
DA
DC
 9.845
8.757
8.016
5.214
2.868
8.329
 C
O
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
1f66 2 Q7ZT64 98.53 2e-94 X-RAY
 2000-11-27 VAL C:118 A:517 131.0 0.845 S -129.0 3.1 52.0 0.335 0.51 I:P17317:0.258
D:P62806:0.31
 DG
DC
DG
DG
DG
DA
MN
HOH
 6.995
3.951
2.940
8.420
8.262
7.338
8.657
2.695
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL G:118 E:717 132.0 0.852 S -124.8 -4.3 55.0 0.355 0.497 H:P62806:0.29
E:P17317:0.258
 DT
DG
DC
DG
DG
DA
MN
HOH
 8.523
7.379
7.134
4.064
2.952
8.581
8.600
2.664
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
C3'
OP1
OP2
MN
O
7m1x 3 A0A310TTQ1 98.53 2e-94 EM
 2021-09-29 VAL C:118 A:517 125.0 0.806 S -132.0 -2.8 69.0 0.445 0.361 D:P62799:0.361
 DG
DG
DA
DC
DC
DC
 6.479
3.890
3.020
8.122
8.430
7.277
 CG1
CG1
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL G:118 E:717 138.0 0.89 S -121.6 -30.8 61.0 0.394 0.496 H:P62799:0.329
E:P0C0S6:0.226
 DC
DG
DA
DC
DG
DC
 9.045
7.943
7.229
5.210
3.548
7.644
 C
O
CG2
CG2
N
N
 C5'
OP1
O3'
O5'
OP2
OP2
6zhx 1 A0A310TTQ1 98.53 3e-94 EM
 2020-12-23 VAL A:118 A:117 136.0 0.877 S -108.4 -19.4 55.0 0.355 0.522 B:P62799:0.335
G:P06897:0.252
 DA
DC
DG
DC
DC
DG
 6.074
3.151
1.866
7.939
7.196
6.619
 HG11
HG11
H
H
HG12
HG12
 O3'
H5''
OP1
OP2
H4'
H5''
VAL E:118 E:117 133.0 0.858 S -113.5 -25.8 52.0 0.335 0.523 C:P06897:0.258
F:P62799:0.323
 DC
DC
DG
DG
DA
DC
 7.645
6.781
6.559
2.801
1.835
8.077
 HG12
HG12
HG11
HB
H
H
 H4'
H5''
O3'
H3'
OP1
OP2
6zhy 1 A0A310TTQ1 98.53 3e-94 EM
 2020-12-23 VAL A:118 A:117 135.0 0.871 S -104.4 -35.0 86.0 0.555 0.316 B:P62799:0.316
 DA
DC
DG
DC
DC
DG
 6.262
2.811
1.969
7.781
6.965
6.786
 HG21
HB
H
H
HG12
HG12
 O3'
H5''
OP1
H5
H4'
H5''
VAL E:118 E:117 133.0 0.858 S -107.7 -36.0 56.0 0.361 0.497 F:P62799:0.355
C:P06897:0.219
 DC
DC
DG
DG
DG
DA
DC
 7.975
7.020
9.989
6.205
2.969
1.826
7.798
 HB
HG12
HG11
HG21
HB
H
H
 H4'
H5''
OP1
O3'
H3'
OP1
OP2
7otq 2 P84233 98.53 3e-94 EM
 2021-09-15 VAL B:118 A:117 139.0 0.897 S -88.2 -36.3 59.0 0.381 0.516 C:P62799:0.348
H:P06897:0.219
 DA
DC
DG
DC
DC
DG
 6.626
3.177
1.608
7.501
7.718
6.725
 HG22
HB
H
H
C
HG12
 O3'
O3'
OP1
OP2
H5''
H5''
VAL F:118 E:117 137.0 0.884 S -110.6 -5.9 61.0 0.394 0.49 D:P06897:0.226
G:P62799:0.277
 DC
DC
DC
DG
DG
DA
DC
 9.957
7.311
7.677
5.845
2.261
1.900
7.573
 HG23
HG23
HG23
HG21
HG22
H
H
 H4'
H4'
H5'
O3'
H3'
OP1
OP2
6t90 5 P68431 99.25 3e-94 EM
 2020-05-06 VAL E:121 E:118 130.0 0.839 S -101.5 -40.4 53.0 0.342 0.497 C:P04908:0.206
F:P62805:0.361
 DC
DC
DG
DG
DA
DC
 8.981
7.895
7.603
5.048
2.954
8.818
 CG1
O
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6yov 5 P68431 99.25 3e-94 EM
 2020-05-06 VAL E:121 E:118 123.0 0.794 S -109.5 -42.5 38.0 0.245 0.549 F:P62805:0.394
C:P04908:0.226
 DC
DC
DG
DG
DA
DC
 8.439
7.592
7.683
5.057
2.783
8.711
 CG1
CG1
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6x59 1 Q71DI3 99.26 4e-94 EM
 2020-09-16 VAL A:117 A:117 120.0 0.774 S -124.6 -19.1 53.0 0.342 0.432 B:P62805:0.265
G:P0C0S8:0.194
 DA
DC
DG
DC
DC
DG
 6.756
4.177
3.080
8.602
8.730
7.639
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:117 E:117 121.0 0.781 S -124.6 -19.2 56.0 0.361 0.42 C:P0C0S8:0.213
F:P62805:0.245
 DC
DC
DG
DG
DA
DC
 8.678
7.556
6.746
4.101
3.063
8.621
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
6x5a 1 Q71DI3 99.26 4e-94 EM
 2020-09-16 VAL A:117 A:117 125.0 0.806 S -123.9 -19.6 52.0 0.335 0.471 B:P62805:0.297
G:P0C0S8:0.232
 DA
DC
DG
DC
DC
DG
 6.691
4.265
3.076
9.252
8.429
7.280
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:117 E:117 128.0 0.826 S -123.9 -19.6 58.0 0.374 0.452 C:P0C0S8:0.187
F:P62805:0.303
 DC
DC
DG
DG
DA
DC
 8.795
7.606
6.782
4.148
3.157
8.866
 O
O
CG2
CG2
CG2
N
 O3'
OP1
O3'
C3'
OP1
OP2
6xjd 1 Q71DI3 99.26 4e-94 EM
 2020-09-16 VAL A:117 A:117 143.0 0.923 S -126.2 -22.0 86.0 0.555 0.368 B:P62805:0.31
G:P0C0S8:0.077
 DA
DC
DG
DC
DG
 6.637
4.188
3.296
8.404
7.326
 CG2
CG2
N
O
O
 O3'
O5'
OP1
O3'
OP1
VAL E:117 E:117 145.0 0.935 S -126.2 -21.9 91.0 0.587 0.348 C:P0C0S8:0.039
F:P62805:0.323
 DC
DC
DG
DG
DA
DC
 8.427
7.446
6.733
3.303
3.120
8.504
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
7jzv 5 Q71DI3 99.26 4e-94 EM
 2021-02-17 VAL E:117 P:117 132.0 0.852 S -104.5 -38.3 53.0 0.342 0.51 I:Q6FI13:0.219
F:P62805:0.361
 DG
DG
DA
DC
DC
DC
 7.342
4.285
2.435
8.176
8.599
7.655
 CG2
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL K:117 p:117 122.0 0.787 S -104.4 -39.3 44.0 0.284 0.503 L:P62805:0.368
C:Q6FI13:0.2
 DC
DG
DA
DC
DG
DC
 8.875
7.431
7.323
4.286
2.306
8.048
 C
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3kxb 1 P84233 98.52 5e-94 X-RAY
 2010-06-23 VAL A:117 A:117 136.0 0.877 S -125.1 -24.7 58.0 0.374 0.503 G:Q6AZJ8:0.2
B:P62799:0.361
 DG
DC
DG
DG
DG
DA
HOH
 7.073
3.726
2.980
8.248
8.278
6.955
9.118
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP1
O3'
OP1
O
VAL E:117 E:117 137.0 0.884 S -122.5 -16.3 62.0 0.4 0.484 C:Q6AZJ8:0.2
F:P62799:0.335
 DT
DG
DC
DG
DG
DA
HOH
 8.136
7.088
7.279
3.893
2.934
8.414
4.618
 O
O
CG2
CG2
N
N
CG1
 O3'
OP1
O3'
O3'
OP1
OP1
O
5b1l 1 ? 97.06 9e-94 X-RAY
 2017-02-15 VAL A:121 A:117 134.0 0.865 S -113.3 -5.8 41.0 0.265 0.6 B:P62806:0.368
G:P22752:0.297
 DG
DC
DT
DG
DG
DA
HOH
 8.007
4.942
2.852
8.210
8.092
7.291
2.872
 CG1
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 135.0 0.871 S -113.2 -5.4 48.0 0.31 0.561 F:P62806:0.361
C:P22752:0.258
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.198
7.232
7.149
4.651
2.675
8.541
7.924
2.820
 O
O
CG1
N
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
4hga 2 P84243 97.06 9e-94 X-RAY
 2012-11-07 VAL B:118 B:117 67.0 0.432 -113.7 152.9 57.0 0.368 0.064 C:P62805:0.058
A:Q9UER7:0.006
 PC4
HOH
 8.589
4.000
 CG1
O
 PT
O
6ltj 1 Q6PI79 97.06 9e-94 EM
 2020-02-12 VAL A:118 A:114 126.0 0.813 S -99.8 -29.0 61.0 0.394 0.419 B:P62799:0.419
 DC
DC
DG
DG
DA
DC
 8.507
8.439
6.293
3.559
2.716
9.368
 CG1
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
P
VAL E:118 E:117 125.0 0.806 S -99.8 -28.9 63.0 0.406 0.4 F:P62799:0.4
 DA
DC
DG
DC
DC
DG
 6.334
3.617
2.375
8.218
8.610
8.298
 CG1
CG1
N
N
CG1
O
 O3'
C5'
OP1
OP2
O3'
OP1
6r0c 1 P84243 97.06 9e-94 EM
 2019-09-25 VAL A:118 A:117 134.0 0.865 S -113.3 -39.8 72.0 0.465 0.4 B:P62805:0.316
G:P0C0S8:0.142
 DC
DT
DT
DG
DC
DC
 8.045
4.542
2.794
8.304
9.083
8.099
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:118 E:117 134.0 0.865 S -124.1 21.2 65.0 0.419 0.446 C:P0C0S8:0.213
F:P62805:0.258
 DT
DG
DT
DT
DG
DC
 8.553
7.388
7.033
4.165
3.089
8.617
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6rny 1 P84243 97.06 9e-94 EM
 2019-09-25 VAL A:118 A:117 133.0 0.858 S -120.0 9.5 47.0 0.303 0.555 G:P0C0S8:0.284
B:P62805:0.368
 DC
DT
DT
DG
DC
DC
 6.502
4.014
2.591
8.745
8.374
6.358
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
C5'
OP1
VAL E:118 E:117 131.0 0.845 S -119.9 9.5 48.0 0.31 0.535 C:P0C0S8:0.271
F:P62805:0.329
 DT
DG
DT
DT
DG
DC
 8.323
6.212
6.507
4.296
3.410
8.833
 O
O
CG2
CG2
CG2
N
 O3'
OP1
O3'
C3'
OP1
OP2
6r1u 9 A0A310TTQ1 98.52 9e-94 EM
 2019-04-24 VAL M:117 NA:NA DO NA DO DO DO NA NA NA
6r25 3 A0A310TTQ1 98.52 9e-94 EM
 2019-04-24 VAL C:117 NA:NA DO NA DO DO DO NA NA NA
6vyp 1 A0A310TTQ1 98.52 9e-94 X-RAY
 2020-05-27 VAL A:117 A:117 125.0 0.806 S -122.7 -26.4 51.0 0.329 0.477 B:P62799:0.297
G:P06897:0.245
 DA
DC
DG
DC
DC
DG
 7.653
4.636
2.473
8.373
8.941
7.890
 CG2
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:117 E:117 130.0 0.839 S -122.7 -28.6 56.0 0.361 0.478 C:P06897:0.258
F:P62799:0.29
 DC
DC
DG
DG
DA
DC
 8.850
7.782
7.186
4.334
2.468
8.144
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL K:117 a:117 130.0 0.839 S -122.7 -28.2 NA NA NA
VAL O:117 e:117 129.0 0.832 S -122.0 -26.8 NA NA NA
3av2 1 P84243 97.06 1e-93 X-RAY
 2011-06-01 VAL A:121 A:117 122.0 0.787 S -130.2 -7.9 42.0 0.271 0.516 G:P04908:0.258
B:P62805:0.329
 DG
DC
DT
DG
DG
DA
HOH
 7.895
4.965
2.781
8.240
8.291
7.470
3.658
 CG1
CB
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 126.0 0.813 S -137.9 -12.5 45.0 0.29 0.523 C:P04908:0.239
F:P62805:0.348
 DT
DG
DC
DT
DG
DA
HOH
 8.468
7.274
8.026
4.989
2.803
8.345
2.896
 O
O
CG1
CB
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
5b32 1 P84243 97.06 1e-93 X-RAY
 2016-08-03 VAL A:121 A:117 129.0 0.832 S -112.2 -14.9 49.0 0.316 0.516 B:P62805:0.361
G:P0C0S5:0.226
 DG
DC
DT
DG
DG
DA
HOH
 7.834
4.631
2.709
8.186
8.498
7.521
2.717
 CG2
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 131.0 0.845 S -110.2 -13.2 53.0 0.342 0.503 C:P04908:0.206
F:P62805:0.368
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.182
7.355
7.335
4.677
2.681
8.607
7.739
2.668
 O
O
CG2
N
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5b33 1 P84243 97.06 1e-93 X-RAY
 2016-08-03 VAL A:121 A:117 129.0 0.832 S -145.9 -15.7 43.0 0.277 0.555 G:P0C0S5:0.258
B:P62805:0.361
 DG
DC
DT
DG
DG
DA
 7.648
5.091
3.007
8.343
8.598
7.409
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 132.0 0.852 S -138.4 -14.7 39.0 0.252 0.6 C:P0C0S5:0.277
F:P62805:0.387
 DT
DG
DC
DT
DG
DA
 8.422
7.445
7.262
4.768
2.855
8.597
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
5x7x 1 P84243 97.06 1e-93 X-RAY
 2017-04-19 VAL A:121 A:117 134.0 0.865 S -116.3 -7.0 45.0 0.29 0.575 B:P62805:0.348
G:P04908:0.303
 DG
DC
DT
DG
DG
DA
HOH
 8.034
5.134
2.853
8.118
8.139
7.118
2.659
 CG1
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 135.0 0.871 S -115.8 -8.6 50.0 0.323 0.548 C:P04908:0.277
F:P62805:0.342
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.262
7.114
7.256
4.553
2.583
8.289
7.994
2.879
 O
O
CG1
N
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
5xm0 1 P84244 97.06 1e-93 X-RAY
 2018-03-07 VAL A:121 A:117 124.0 0.8 S -137.1 2.4 48.0 0.31 0.49 B:P62806:0.297
G:C0HKE1:0.245
 DG
DC
DT
DG
DG
DA
HOH
 7.243
4.291
2.899
8.197
8.226
7.335
9.951
 CG2
CG2
N
N
O
O
N
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:121 E:117 130.0 0.839 S -137.9 -16.8 46.0 0.297 0.542 C:C0HKE1:0.265
F:P62806:0.348
 DT
DG
DC
DT
DG
DA
 8.359
7.473
7.724
4.903
2.787
8.443
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6a5l 16 P84243 97.06 1e-93 EM
 2018-10-03 VAL P:121 a:117 133.0 0.858 S -111.1 -23.2 56.0 0.361 0.497 V:P04908:0.174
Q:P62805:0.387
 DA
DC
DG
DC
DC
DG
 8.930
4.830
2.648
8.145
9.190
7.733
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL T:121 e:117 127.0 0.819 S -116.8 -32.2 55.0 0.355 0.464 U:P62805:0.29
R:P04908:0.213
 DC
DC
DG
DG
DA
DC
 9.598
8.476
7.877
4.893
3.111
7.955
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6a5o 16 P84243 97.06 1e-93 EM
 2018-10-03 VAL P:121 a:117 126.0 0.813 S -111.2 -27.3 52.0 0.335 0.478 V:P04908:0.226
Q:P62805:0.31
 DA
DC
DG
DC
DC
DG
 8.103
4.201
2.234
8.348
7.848
7.237
 CG2
N
N
N
O
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL T:121 e:117 129.0 0.832 S -109.2 -28.2 79.0 0.51 0.322 U:P62805:0.213
R:P04908:0.142
 DC
DC
DG
DG
DA
DC
 8.883
8.184
6.805
4.040
2.521
7.750
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6a5p 16 P84243 97.06 1e-93 EM
 2018-10-03 VAL P:121 a:117 126.0 0.813 S -111.3 -27.3 53.0 0.342 0.471 V:P04908:0.219
Q:P62805:0.31
 DA
DC
DG
DC
DC
DG
 8.360
5.133
2.859
8.494
9.191
8.077
 CB
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL T:121 e:117 129.0 0.832 S -109.2 -28.2 77.0 0.497 0.335 U:P62805:0.219
R:P04908:0.148
 DC
DC
DG
DG
DA
DC
 9.501
8.396
7.562
4.046
2.493
7.772
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6a5r 16 P84243 97.06 1e-93 EM
 2018-10-03 VAL P:121 a:117 127.0 0.819 S -111.2 -27.3 53.0 0.342 0.477 V:P04908:0.226
Q:P62805:0.31
 DA
DC
DG
DC
DC
DG
 8.359
5.134
2.858
8.494
9.190
8.078
 CB
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL T:121 e:117 131.0 0.845 S -109.3 -28.1 79.0 0.51 0.335 U:P62805:0.226
R:P04908:0.142
 DC
DC
DG
DG
DA
DC
 9.501
8.396
7.562
4.046
2.492
7.771
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6a5t 16 P84243 97.06 1e-93 EM
 2018-10-03 VAL P:121 a:117 132.0 0.852 S -111.1 -23.2 56.0 0.361 0.491 V:P04908:0.174
Q:P62805:0.374
 DA
DC
DG
DC
DC
DG
 8.930
4.830
2.648
8.146
9.189
7.733
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL T:121 e:117 128.0 0.826 S -116.8 -32.2 57.0 0.368 0.458 U:P62805:0.29
R:P04908:0.213
 DC
DC
DG
DG
DA
DC
 9.600
8.477
7.876
4.893
3.110
7.955
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6a5u 16 P84243 97.06 1e-93 EM
 2018-10-03 VAL P:121 a:117 135.0 0.871 S -111.1 -23.3 57.0 0.368 0.503 V:P04908:0.187
Q:P62805:0.387
 DA
DC
DG
DC
DC
DG
 8.931
4.830
2.648
8.146
9.191
7.733
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL T:121 e:117 128.0 0.826 S -116.8 -32.3 57.0 0.368 0.458 U:P62805:0.297
R:P04908:0.206
 DC
DC
DG
DG
DA
DC
 9.597
8.475
7.877
4.892
3.111
7.954
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6inq 16 P84243 97.06 1e-93 EM
 2019-04-03 VAL P:121 a:117 134.0 0.865 S -111.2 -23.1 57.0 0.368 0.497 V:P04908:0.174
Q:P62805:0.381
 DA
DC
DG
DC
DC
DG
 8.930
4.829
2.648
8.146
9.189
7.731
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL T:121 e:117 129.0 0.832 S -116.8 -32.1 57.0 0.368 0.464 U:P62805:0.297
R:P04908:0.206
 DC
DC
DG
DG
DA
DC
 9.598
8.474
7.876
4.893
3.112
7.956
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6ir9 19 P84243 97.06 1e-93 EM
 2019-02-20 VAL S:121 a:117 135.0 0.871 S -111.1 -23.3 57.0 0.368 0.503 T:P62805:0.387
Y:P04908:0.181
 DA
DC
DG
DC
DC
DG
 8.929
4.831
2.649
8.147
9.190
7.731
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL W:121 e:117 127.0 0.819 S -116.7 -32.1 57.0 0.368 0.451 X:P62805:0.29
U:P04908:0.206
 DC
DC
DG
DG
DA
DC
 9.599
8.476
7.877
4.892
3.110
7.954
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6j4w 19 P84243 97.06 1e-93 EM
 2019-02-20 VAL S:121 a:117 126.0 0.813 S -111.1 -27.4 53.0 0.342 0.471 T:P62805:0.303
Y:P04908:0.226
 DA
DC
DG
DC
DC
DG
 8.360
5.133
2.859
8.494
9.190
8.078
 CB
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL W:121 e:117 130.0 0.839 S -109.2 -28.1 79.0 0.51 0.329 X:P62805:0.213
U:P04908:0.142
 DC
DC
DG
DG
DA
DC
 9.502
8.396
7.561
4.045
2.493
7.772
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6j4x 19 P84243 97.06 1e-93 EM
 2019-02-20 VAL S:121 a:117 133.0 0.858 S -111.2 -23.3 56.0 0.361 0.497 T:P62805:0.387
Y:P04908:0.168
 DA
DC
DG
DC
DC
DG
 8.931
4.832
2.648
8.147
9.188
7.732
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL W:121 e:117 127.0 0.819 S -116.7 -32.1 57.0 0.368 0.451 X:P62805:0.284
U:P04908:0.206
 DC
DC
DG
DG
DA
DC
 9.598
8.477
7.878
4.892
3.111
7.954
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6j4y 19 P84243 97.06 1e-93 EM
 2019-02-20 VAL S:121 a:117 134.0 0.865 S -111.1 -23.2 56.0 0.361 0.504 T:P62805:0.387
Y:P04908:0.181
 DA
DC
DG
DC
DC
DG
 8.930
4.831
2.649
8.148
9.190
7.732
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL W:121 e:117 126.0 0.813 S -116.8 -32.1 56.0 0.361 0.452 X:P62805:0.284
U:P04908:0.219
 DC
DC
DG
DG
DA
DC
 9.598
8.476
7.875
4.893
3.111
7.954
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6j4z 18 P84243 97.06 1e-93 EM
 2019-02-20 VAL R:121 a:117 136.0 0.877 S -111.0 -23.2 57.0 0.368 0.509 S:P62805:0.394
X:P04908:0.174
 DA
DC
DG
DC
DC
DG
 8.931
4.830
2.648
8.146
9.191
7.733
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL V:121 e:117 128.0 0.826 S -116.7 -32.3 57.0 0.368 0.458 T:P04908:0.206
W:P62805:0.29
 DC
DC
DG
DG
DA
DC
 9.598
8.476
7.877
4.891
3.110
7.954
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6j50 18 P84243 97.06 1e-93 EM
 2019-02-20 VAL R:121 a:117 136.0 0.877 S -111.1 -23.2 57.0 0.368 0.509 S:P62805:0.394
X:P04908:0.181
 DA
DC
DG
DC
DC
DG
 8.931
4.830
2.648
8.146
9.191
7.734
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL V:121 e:117 129.0 0.832 S -116.7 -32.3 57.0 0.368 0.464 T:P04908:0.213
W:P62805:0.297
 DC
DC
DG
DG
DA
DC
 9.598
8.476
7.878
4.891
3.111
7.954
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6j51 19 P84243 97.06 1e-93 EM
 2019-02-20 VAL S:121 a:117 134.0 0.865 S -111.0 -23.2 56.0 0.361 0.504 T:P62805:0.387
Y:P04908:0.174
 DA
DC
DG
DC
DC
DG
 8.932
4.829
2.648
8.146
9.191
7.732
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP2
VAL W:121 e:117 127.0 0.819 S -116.8 -32.4 56.0 0.361 0.458 X:P62805:0.29
U:P04908:0.206
 DC
DC
DG
DG
DA
DC
 9.598
8.475
7.877
4.892
3.111
7.954
 C
O
CG2
CB
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
7e8d 1 P68431 98.52 1e-93 EM
 2021-11-10 VAL A:117 A:117 130.0 0.839 S -119.4 -27.9 54.0 0.348 0.491 B:P62805:0.316
G:P0C0S8:0.239
 DC
DC
DG
DG
DA
DC
 8.938
7.526
7.296
4.833
2.692
8.591
 C
O
CG2
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
VAL E:117 E:117 127.0 0.819 S -125.5 -0.5 48.0 0.31 0.509 C:P0C0S8:0.271
F:P62805:0.29
 DA
DC
DG
DC
DC
DG
 6.789
4.219
3.081
8.502
8.385
7.244
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
1zla 2 288992 98.52 2e-93 X-RAY
 2006-02-28 VAL C:117 A:517 121.0 0.781 S -138.7 22.3 53.0 0.342 0.439 D:P62799:0.213
I:30268540:0.277
 DG
DC
DG
DG
DG
DA
HOH
 6.825
3.824
2.814
8.220
8.066
7.149
5.582
 CG2
CG2
N
N
O
O
C
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 117.0 0.755 S -130.5 8.1 45.0 0.29 0.465 H:P62799:0.284
E:30268540:0.232
 DT
DG
DC
DG
DG
DA
HOH
 8.302
7.282
7.281
4.231
2.790
8.577
4.978
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
C3'
OP1
OP2
O
3a6n 1 Q16695 96.32 2e-93 X-RAY
 2010-05-26 VAL A:121 A:117 120.0 0.774 S -145.4 -7.7 41.0 0.265 0.509 B:P62805:0.355
G:P04908:0.245
 DG
DC
DT
DG
DG
DA
HOH
 7.331
3.828
2.658
7.991
8.327
7.526
9.504
 CG1
CG1
N
N
CG1
O
O
 O3'
O3'
OP1
OP2
C4'
OP1
O
VAL E:121 E:117 120.0 0.774 S -144.5 -8.2 40.0 0.258 0.516 C:P04908:0.213
F:P62805:0.381
 DT
DG
DC
DT
DG
DA
MN
HOH
 8.265
7.309
7.068
3.914
2.784
8.388
8.211
2.664
 O
O
CG1
CG1
N
N
CG1
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
3wtp 5 P84243 97.06 2e-93 X-RAY
 2014-12-03 VAL E:122 E:117 135.0 0.871 S -108.3 -15.0 46.0 0.297 0.574 C:P04908:0.29
F:P62805:0.348
 DT
DG
DC
DT
DG
DA
 8.537
7.384
7.606
4.607
2.663
8.617
 O
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3c1c 1 P02302 98.52 3e-93 X-RAY
 2008-10-07 VAL A:117 A:517 128.0 0.826 S -147.2 -2.5 43.0 0.277 0.549 B:P62799:0.342
G:P06897:0.31
 DG
DC
DG
DG
DG
DA
HOH
 8.076
4.800
2.723
8.293
8.157
7.208
6.080
 CG1
CB
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:117 E:717 129.0 0.832 S -133.7 8.5 58.0 0.374 0.458 C:P06897:0.239
F:P62799:0.265
 DT
DG
DC
DG
DG
DA
HOH
 8.183
7.445
7.074
3.972
2.895
8.466
3.954
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
O
5f99 1 P84233 98.52 3e-93 X-RAY
 2016-02-03 VAL A:117 A:117 129.0 0.832 S -147.2 -4.1 42.0 0.271 0.561 B:P62799:0.348
G:P06897:0.303
 DA
DC
DT
DT
DA
DC
HOH
 7.794
4.771
2.615
7.747
8.372
7.441
2.632
 CG1
N
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:117 E:117 128.0 0.826 S -118.8 -2.1 46.0 0.297 0.529 C:P06897:0.284
F:P62799:0.297
 DC
DT
DG
DA
DA
DG
HOH
 8.288
7.105
7.085
3.755
2.810
8.251
2.647
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
5omx 3 P84233 98.52 3e-93 X-RAY
 2017-11-15 VAL C:117 A:117 131.0 0.845 S -131.6 5.4 53.0 0.342 0.503 D:P62799:0.265
I:Q6AZJ8:0.277
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.958
3.910
2.816
8.399
8.262
7.241
8.695
7.354
 CG2
CG2
N
N
O
O
CG2
CG1
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL G:117 E:117 129.0 0.832 S -129.3 7.1 55.0 0.355 0.477 H:P62799:0.284
E:Q6AZJ8:0.239
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.031
7.290
7.114
3.911
2.752
8.526
8.458
8.942
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
6s01 1 A0A310TTQ1 98.52 3e-93 EM
 2019-12-18 VAL A:117 A:117 128.0 0.826 S -121.6 -18.0 49.0 0.316 0.51 B:P62799:0.31
G:Q6AZJ8:0.245
 DA
DC
DG
DC
DC
DG
 6.724
4.140
2.916
8.643
8.493
7.627
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL E:117 E:117 129.0 0.832 S -117.3 -39.5 44.0 0.284 0.548 C:Q6AZJ8:0.232
F:P62799:0.381
 DC
DC
DG
DG
DA
DC
 9.020
8.035
7.146
5.126
2.839
8.494
 C
O
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5kdm 1 P84243 97.04 8e-93 X-RAY
 2016-09-07 VAL A:117 A:117 80.0 0.516 -115.7 139.2 80.0 0.516 0.0
7a08 6 P84243 97.04 8e-93 EM
 2020-09-23 VAL F:117 d:117 122.0 0.787 S -112.3 -33.8 47.0 0.303 0.484 D:Q93077:0.213
K:P62805:0.323
 DC
DC
DG
DG
DA
DC
 8.753
8.220
6.683
4.199
3.199
8.843
 CG2
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL J:117 h:117 133.0 0.858 S -123.4 -25.0 90.0 0.581 0.277 G:P62805:0.277
 DA
DC
DG
DC
DC
DG
 7.152
4.992
2.847
8.342
8.073
7.730
 CG2
CB
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
1m18 2 P02302 97.04 1e-92 X-RAY
 2003-02-18 VAL C:117 A:517 130.0 0.839 S -131.9 8.6 53.0 0.342 0.497 I:P06897:0.284
D:P02304:0.265
 DG
DC
DG
DG
DG
DA
MN
HOH
 7.025
3.997
2.826
8.191
8.261
7.270
8.824
3.844
 CG2
CG2
N
N
O
O
CG2
CG1
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL G:117 E:717 133.0 0.858 S -127.0 4.5 56.0 0.361 0.497 H:P02304:0.29
E:P06897:0.258
 DT
DG
DC
DG
DG
DA
MN
HOH
 8.435
7.365
7.062
3.899
2.839
8.477
8.751
2.615
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
1m19 2 P02302 97.04 1e-92 X-RAY
 2003-02-18 VAL C:117 A:517 134.0 0.865 S -116.0 4.3 55.0 0.355 0.51 I:P06897:0.297
D:P02304:0.271
 DG
DC
DG
DG
DG
DA
MN
HOH
 7.064
4.033
2.897
8.369
8.301
7.401
8.614
2.726
 CG2
CG2
N
N
O
O
CG2
O
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL G:117 E:717 130.0 0.839 S -119.6 2.1 56.0 0.361 0.478 H:P02304:0.297
E:P06897:0.226
 DT
DG
DC
DG
DG
DA
MN
HOH
 8.340
7.378
7.121
3.834
2.935
8.369
8.583
2.720
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
1m1a 2 P02302 97.04 1e-92 X-RAY
 2003-02-18 VAL C:117 A:517 123.0 0.794 S -132.8 -5.2 48.0 0.31 0.484 D:P02304:0.271
I:P06897:0.271
 DC
DG
DG
DA
DT
DG
MN
HOH
 7.439
4.080
2.640
8.377
8.474
7.405
8.792
7.695
 CG2
CG2
N
N
O
O
CG2
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL G:117 E:717 129.0 0.832 S -125.5 -3.1 54.0 0.348 0.484 H:P02304:0.29
E:P06897:0.252
 DG
DA
DG
DC
DG
DG
MN
HOH
 8.569
7.401
7.075
4.117
2.771
8.542
8.356
3.660
 O
O
CG2
CG2
N
N
CG2
CG1
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
1p3b 2 Q7ZT64 97.78 1e-92 X-RAY
 2004-02-24 VAL C:117 A:517 129.0 0.832 S -131.2 9.3 62.0 0.4 0.432 D:P62799:0.187
I:Q7ZT66:0.277
 DG
DC
DG
DG
DG
DA
HOH
 6.580
3.911
2.853
9.291
8.112
7.189
8.087
 CG2
CG2
N
N
O
O
CG1
 O3'
C3'
OP1
P
O3'
OP1
O
VAL G:117 E:717 129.0 0.832 S -133.5 -2.0 61.0 0.394 0.438 H:P62799:0.226
E:Q7ZT66:0.239
 DT
DG
DC
DG
DG
DA
HOH
 8.379
7.312
6.189
3.575
2.736
8.609
3.948
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
C3'
OP1
OP2
O
1p3f 2 Q7ZT64 97.78 1e-92 X-RAY
 2004-02-24 VAL C:117 A:517 128.0 0.826 S -132.2 9.1 53.0 0.342 0.484 I:Q7ZT66:0.297
D:P62799:0.239
 DG
DC
DG
DG
DG
DA
HOH
 6.765
4.168
2.741
8.507
7.972
7.290
2.952
 CG2
CG2
N
N
O
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 124.0 0.8 S -124.2 2.1 46.0 0.297 0.503 H:P62799:0.316
E:Q7ZT66:0.245
 DT
DG
DC
DG
DG
DA
HOH
 8.244
7.378
6.629
3.945
3.099
8.727
3.015
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
C3'
OP1
OP2
O
1p3g 2 Q7ZT64 97.78 1e-92 X-RAY
 2004-02-24 VAL C:117 A:517 128.0 0.826 S -127.2 -4.9 48.0 0.31 0.516 D:P62799:0.297
I:Q7ZT66:0.277
 DG
DC
DG
DG
DG
DA
HOH
 6.944
3.980
3.109
8.494
8.337
7.154
2.689
 CG2
CG2
N
N
O
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 129.0 0.832 S -125.9 -3.3 49.0 0.316 0.516 H:P62799:0.329
E:Q7ZT66:0.232
 DT
DG
DC
DG
DG
DA
HOH
 8.495
7.135
7.080
3.832
2.976
8.590
2.815
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
C3'
OP1
OP2
O
1p3i 2 Q7ZT64 97.78 1e-92 X-RAY
 2004-02-24 VAL C:117 A:517 129.0 0.832 S -133.5 8.2 49.0 0.316 0.516 I:Q7ZT66:0.303
D:P62799:0.265
 DG
DC
DG
DG
DG
DA
HOH
 6.601
3.856
2.856
8.268
8.342
7.068
2.844
 CG2
CG2
N
N
O
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 128.0 0.826 S -132.7 8.9 53.0 0.342 0.484 H:P62799:0.271
E:Q7ZT66:0.258
 DT
DG
DC
DG
DG
DA
HOH
 8.604
6.898
6.634
3.799
2.818
8.488
2.810
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
C3'
OP1
OP2
O
1p3o 2 Q7ZT64 97.78 1e-92 X-RAY
 2004-02-24 VAL C:117 A:517 130.0 0.839 S -132.5 11.3 53.0 0.342 0.497 I:Q7ZT66:0.297
D:P62799:0.271
 DG
DC
DG
DG
DG
DA
HOH
 7.061
3.952
2.715
8.207
8.306
7.042
8.336
 CG2
CG2
N
N
O
O
CG2
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 129.0 0.832 S -121.0 3.0 53.0 0.342 0.49 H:P62799:0.29
E:Q7ZT66:0.252
 DT
DG
DC
DG
DG
DA
HOH
 8.560
7.462
7.111
4.000
2.986
8.538
4.047
 O
O
CG2
CG2
N
N
CG1
 O3'
OP1
O3'
C3'
OP1
OP2
O
1p3p 2 Q7ZT64 97.78 1e-92 X-RAY
 2004-02-24 VAL C:117 A:517 131.0 0.845 S -131.3 2.9 54.0 0.348 0.497 I:Q7ZT66:0.29
D:P62799:0.265
 DG
DC
DG
DG
DG
DA
HOH
 6.815
3.901
3.072
8.554
8.263
7.185
2.778
 CG2
CG2
N
N
O
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 130.0 0.839 S -129.2 1.2 51.0 0.329 0.51 H:P62799:0.316
E:Q7ZT66:0.239
 DT
DG
DC
DG
DG
DA
HOH
 8.145
7.140
7.150
3.978
2.849
8.649
2.932
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
C3'
OP1
OP2
O
7cro 1 Q92133 97.04 2e-92 EM
 2020-10-21 VAL A:117 M:117 132.0 0.852 S -129.3 -25.8 55.0 0.355 0.497 B:P62799:0.355
G:Q6AZJ8:0.174
 DC
DC
DG
DG
DA
DC
 9.135
8.334
8.434
5.377
3.324
8.660
 CG1
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL E:117 E:117 129.0 0.832 S -133.3 -9.9 63.0 0.406 0.426 C:Q6AZJ8:0.2
F:P62799:0.245
 DA
DC
DG
DC
DC
DG
 7.021
4.482
2.953
8.961
9.133
8.167
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
7crp 1 Q92133 97.04 2e-92 EM
 2020-10-21 VAL A:117 M:117 138.0 0.89 S -128.5 -24.7 65.0 0.419 0.471 B:P62799:0.316
G:Q6AZJ8:0.194
 DC
DC
DG
DG
DA
DC
 9.205
8.224
7.934
5.490
3.292
8.566
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL E:117 E:117 138.0 0.89 S -131.4 -7.9 71.0 0.458 0.432 C:Q6AZJ8:0.2
F:P62799:0.252
 DA
DC
DG
DC
DC
DG
 7.169
4.966
3.109
8.883
8.918
8.031
 CG2
CG2
CG2
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
7crq 1 Q92133 97.04 2e-92 EM
 2020-10-21 VAL A:117 M:117 135.0 0.871 S -128.8 -25.3 61.0 0.394 0.477 B:P62799:0.303
G:Q6AZJ8:0.219
 DC
DC
DG
DG
DA
DC
 9.364
8.125
8.236
5.502
3.228
8.707
 O
O
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL E:117 E:117 138.0 0.89 S -132.7 -2.0 66.0 0.426 0.464 C:Q6AZJ8:0.232
F:P62799:0.252
 DA
DC
DG
DC
DC
DG
 7.208
4.810
3.096
8.897
8.939
8.020
 CG2
CG2
CG2
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
7crr 1 Q92133 97.04 2e-92 EM
 2020-10-21 VAL A:117 M:117 134.0 0.865 S -126.1 -28.1 58.0 0.374 0.491 B:P62799:0.368
G:Q6AZJ8:0.168
 DC
DC
DG
DG
DA
DC
 9.203
8.278
7.419
4.991
3.067
8.676
 CG1
O
CG2
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:117 E:117 129.0 0.832 S -133.1 -14.0 59.0 0.381 0.451 C:Q6AZJ8:0.194
F:P62799:0.284
 DA
DC
DG
DC
DC
DG
 6.898
4.887
3.091
9.127
9.149
7.867
 CG2
CG2
CG2
N
CG2
O
 O3'
C5'
OP1
OP2
O3'
OP1
6ven 1 P84233 97.04 2e-92 EM
 2020-01-15 VAL A:117 A:117 131.0 0.845 S -123.9 -28.0 40.0 0.258 0.587 B:P62799:0.4
G:P06897:0.232
 DC
DC
DG
DG
DA
DC
 8.840
8.162
7.094
4.646
2.506
8.151
 CG1
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL E:117 E:117 127.0 0.819 S -124.8 -51.2 56.0 0.361 0.458 C:P06897:0.181
F:P62799:0.303
 DA
DC
DG
DC
DC
DG
 7.261
4.978
3.075
8.577
8.702
8.323
 CG2
CB
N
N
CG1
CG1
 O3'
C5'
OP1
OP2
O3'
OP1
6nj9 1 P84233 97.04 2e-92 EM
 2019-02-20 VAL A:117 A:117 129.0 0.832 S -127.8 -39.9 51.0 0.329 0.503 B:P62799:0.329
G:P06897:0.219
 DC
DC
DG
DG
DA
DC
 8.767
7.834
7.509
5.112
3.071
8.401
 CG1
O
CG1
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
VAL E:117 E:117 128.0 0.826 S -127.8 -39.9 50.0 0.323 0.503 C:P06897:0.213
F:P62799:0.329
 DA
DC
DG
DC
DC
DG
 7.350
5.321
3.141
8.417
8.710
7.855
 CG1
CB
N
N
CG1
O
 O3'
C3'
OP1
OP2
O3'
OP1
6nqa 8 P84233 97.04 2e-92 EM
 2019-02-20 VAL H:117 E:117 132.0 0.852 S -113.5 -44.5 70.0 0.452 0.4 K:P06897:0.252
C:P62799:0.226
 DC
DC
DG
DG
DA
DC
 9.882
9.018
7.238
5.112
3.135
8.712
 C
O
CG1
CB
N
N
 C5'
OP1
O3'
C3'
OP1
OP2
VAL I:117 A:117 131.0 0.845 S -110.8 -45.7 61.0 0.394 0.451 D:P06897:0.271
L:P62799:0.258
 DA
DC
DG
DC
DG
 7.303
5.212
3.088
8.320
9.030
 CG1
CB
N
N
O
 O3'
C5'
OP1
OP2
OP1
5xm1 1 ? 95.59 3e-92 X-RAY
 2018-03-07 VAL A:121 A:117 123.0 0.794 S -136.8 -15.9 47.0 0.303 0.491 B:P62806:0.329
G:C0HKE1:0.239
 DG
DC
DT
DG
DG
DA
 8.198
4.895
2.793
8.111
8.667
7.391
 CG2
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 124.0 0.8 S -130.5 -14.7 42.0 0.271 0.529 C:C0HKE1:0.232
F:P62806:0.355
 DT
DG
DC
DT
DG
DA
 8.436
7.441
8.208
4.732
2.902
8.232
 O
O
CG1
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5gxq 1 ? 94.85 4e-92 X-RAY
 2017-04-19 VAL A:121 A:117 124.0 0.8 S -112.5 3.2 47.0 0.303 0.497 B:P62805:0.316
G:P04908:0.245
 DG
DC
DT
DG
DG
DA
 7.015
4.131
2.858
8.372
8.281
7.418
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 128.0 0.826 S -125.9 -2.0 50.0 0.323 0.503 C:P04908:0.232
F:P62805:0.316
 DT
DG
DC
DT
DG
DA
 8.350
7.366
7.139
4.505
2.825
8.684
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
1p3a 2 Q7ZT64 97.04 8e-92 X-RAY
 2004-02-24 VAL C:117 A:517 128.0 0.826 S -141.8 1.9 56.0 0.361 0.465 I:Q7ZT66:0.265
D:P62799:0.239
 DG
DC
DG
DG
DG
DA
HOH
 6.894
4.100
3.017
8.647
8.471
7.176
7.465
 CG2
CG2
CG2
N
O
O
CG2
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 130.0 0.839 S -125.9 -1.1 55.0 0.355 0.484 H:P62799:0.284
E:Q7ZT66:0.265
 DT
DG
DC
DG
DG
DA
HOH
 8.395
7.442
6.956
3.904
3.057
8.729
7.925
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
C3'
OP1
OP2
O
5ong 3 P84233 97.78 9e-92 X-RAY
 2017-11-22 VAL C:117 A:117 129.0 0.832 S -113.1 -25.4 55.0 0.355 0.477 D:P62799:0.31
I:Q6AZJ8:0.226
 DC
DT
DG
DG
DT
DG
MN
 7.811
4.989
2.756
8.384
8.728
7.760
8.428
 CG2
N
N
N
C
O
CG2
 O3'
O3'
OP1
OP2
C5'
OP1
MN
VAL G:117 E:117 137.0 0.884 S -90.5 -16.9 55.0 0.355 0.529 H:P62799:0.342
E:Q6AZJ8:0.245
 DT
DG
DC
DT
DG
DG
MN
 8.258
7.633
7.400
4.773
2.580
8.536
7.935
 O
O
CG2
N
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
MN
5onw 3 P84233 97.78 9e-92 X-RAY
 2017-11-22 VAL C:117 A:117 132.0 0.852 S -116.2 2.4 54.0 0.348 0.504 D:P62799:0.29
I:Q6AZJ8:0.29
 DC
DT
DG
DG
DT
DG
MN
HOH
 6.986
4.102
2.603
8.571
8.411
7.201
8.491
8.517
 CG2
CG2
N
N
O
O
CG2
O
 O3'
C3'
OP1
OP2
O3'
OP1
MN
O
VAL G:117 E:117 131.0 0.845 S -114.7 4.0 56.0 0.361 0.484 H:P62799:0.284
E:Q6AZJ8:0.245
 DT
DG
DC
DT
DG
DG
MN
HOH
 8.179
7.250
6.818
4.128
2.648
8.542
8.383
8.438
 O
O
CG2
CG2
N
N
CG2
O
 O3'
OP1
O3'
O3'
OP1
OP2
MN
O
1p3k 2 Q7ZT64 97.04 9e-92 X-RAY
 2004-02-24 VAL C:117 A:517 137.0 0.884 S -127.5 -4.4 61.0 0.394 0.49 D:P62799:0.31
I:Q7ZT66:0.239
 DG
DC
DG
DG
DG
DA
HOH
 6.557
3.856
3.040
8.490
8.561
7.252
7.787
 CG2
CG2
N
N
O
O
CG2
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 135.0 0.871 S -122.4 -14.2 63.0 0.406 0.465 H:P62799:0.284
E:Q7ZT66:0.226
 DT
DG
DC
DG
DG
DA
HOH
 8.539
7.409
6.515
3.686
2.854
8.622
2.873
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
C3'
OP1
OP2
O
1p3m 2 Q7ZT64 97.04 1e-91 X-RAY
 2004-02-24 VAL C:117 A:517 125.0 0.806 S -135.5 -9.0 58.0 0.374 0.432 D:P62799:0.265
I:Q7ZT66:0.219
 DG
DC
DG
DG
DG
DA
HOH
 6.771
3.726
2.668
8.135
8.155
6.887
8.188
 CG2
CG2
N
N
O
O
CG2
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 123.0 0.794 S -128.6 -11.9 54.0 0.348 0.446 H:P62799:0.277
E:Q7ZT66:0.213
 DT
DG
DC
DG
DG
DA
HOH
 8.075
7.198
6.745
4.021
2.680
8.624
3.046
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
C3'
OP1
OP2
O
1p3l 2 Q7ZT64 97.04 1e-91 X-RAY
 2004-02-24 VAL C:117 A:517 126.0 0.813 S -122.2 -15.9 54.0 0.348 0.465 D:P62799:0.297
I:Q7ZT66:0.219
 DG
DC
DG
DG
DG
DA
HOH
 7.079
3.745
2.977
8.243
8.306
6.983
2.696
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP1
O3'
OP1
O
VAL G:117 E:717 128.0 0.826 S -117.9 -17.1 60.0 0.387 0.439 H:P62799:0.297
E:Q7ZT66:0.194
 DT
DG
DC
DG
DG
DA
HOH
 8.166
7.185
7.150
3.786
3.084
8.326
2.819
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP1
O
1p34 2 Q7ZT64 97.04 2e-91 X-RAY
 2004-02-24 VAL C:117 A:517 135.0 0.871 S -133.8 21.6 61.0 0.394 0.477 I:Q7ZT66:0.316
D:P62799:0.206
 DG
DC
DG
DG
DG
DA
HOH
 6.310
3.970
2.966
8.423
8.322
7.307
3.637
 CG2
CG2
N
N
O
O
CG1
 O3'
O5'
OP1
OP2
O3'
OP1
O
VAL G:117 E:717 134.0 0.865 S -131.0 12.0 63.0 0.406 0.459 H:P62799:0.226
E:Q7ZT66:0.271
 DT
DG
DC
DG
DG
DA
HOH
 8.336
7.295
6.446
4.000
2.975
8.698
2.876
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
C5'
OP1
OP2
O
4h9o 1 P84243 94.07 1e-90 X-RAY
 2012-10-10 VAL A:117 A:117 78.0 0.503 -107.7 173.1 62.0 0.4 0.103 B:P62805:0.103
 PO4
HOH
 6.296
4.913
 CG1
O
 O2
O
4h9n 1 P84243 93.33 4e-89 X-RAY
 2012-10-10 VAL A:117 A:117 78.0 0.503 -118.3 153.1 65.0 0.419 0.084 B:P62805:0.084
 PO4
HOH
 6.243
2.821
 CG2
N
 O1
O
4h9q 1 P84243 93.33 4e-89 X-RAY
 2012-10-17 VAL A:117 A:117 76.0 0.49 -121.1 151.1 64.0 0.413 0.077 B:P62805:0.077
 PO4
HOH
 6.045
4.948
 CG2
O
 O3
O
4z5t 1 Q6NXT2 94.12 4e-88 X-RAY
 2016-02-10 VAL A:120 A:116 131.0 0.845 S -101.7 -11.6 50.0 0.323 0.522 B:P62805:0.368
G:P04908:0.226
 DG
DC
DT
DG
DG
DA
 7.344
5.010
3.008
8.184
8.297
7.373
 CG1
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:120 E:116 128.0 0.826 S -102.3 -11.5 52.0 0.335 0.491 C:P04908:0.245
F:P62805:0.323
 DT
DG
DC
DT
DG
DA
 8.831
7.494
7.572
4.596
2.503
8.310
 O
O
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
4h9s 1 P84243 91.85 7e-88 X-RAY
 2012-10-17 VAL A:117 A:117 77.0 0.497 -136.5 130.5 38.0 0.245 0.252 F:Q9UER7:0.103
C:P62805:0.168
 HOH
 3.620
 CG1
 O
VAL B:117 B:117 76.0 0.49 -116.6 148.2 NA NA NA
4kud 1 P61830 88.97 1e-85 X-RAY
 2013-08-07 VAL A:118 A:117 136.0 0.877 S -119.5 -0.2 51.0 0.329 0.548 B:P02309:0.335
G:P04912:0.297
 DG
DC
DG
DG
DG
DA
 7.214
4.582
2.700
8.314
8.200
7.389
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:118 E:117 135.0 0.871 S -123.1 -6.8 57.0 0.368 0.503 C:P04912:0.284
F:P02309:0.31
 DT
DG
DC
DG
DG
DA
 8.123
7.659
7.153
3.934
2.579
8.227
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
5zba 3 P61830 88.97 1e-85 X-RAY
 2018-07-25 VAL C:118 C:117 132.0 0.852 S -101.9 -29.0 80.0 0.516 0.336 D:P02309:0.335
 IOD
IOD
 3.592
8.133
 N
C
 I
I
5zbb 3 P61830 88.97 1e-85 X-RAY
 2018-07-25 VAL C:118 C:117 134.0 0.865 S -112.5 -34.6 83.0 0.535 0.33 D:P02309:0.329
 IOD
 3.818
 N
 I
7k7g 1 P61830 88.97 1e-85 EM
 2021-03-31 VAL A:118 A:118 140.0 0.903 S -111.2 2.8 71.0 0.458 0.445 B:P02309:0.335
G:P04911:0.148
 DA
DC
DG
DC
DC
DG
 6.324
3.918
3.308
8.778
8.171
7.633
 CG2
CG2
CG2
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:118 E:118 137.0 0.884 S -111.2 2.9 93.0 0.6 0.284 F:P02309:0.284
 DC
DC
DG
DG
DA
DC
 8.948
7.670
6.744
3.619
2.702
7.931
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6gej 2 P61830 88.24 8e-85 EM
 2018-10-17 VAL B:118 A:117 141.0 0.91 S -99.9 -2.6 56.0 0.361 0.549 G:P04911:0.148
E:P02309:0.432
 DA
DC
DG
DC
DC
DG
 7.656
4.610
3.278
9.264
8.577
7.211
 CG2
CG2
N
N
CG2
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL C:118 B:117 143.0 0.923 S -99.9 -2.5 51.0 0.329 0.594 F:P04911:0.232
D:P02309:0.432
 DC
DC
DG
DG
DA
DC
 8.599
7.769
7.303
4.150
2.552
8.155
 CG2
O
CG2
CG2
N
N
 C4'
OP1
O3'
O3'
OP1
OP2
6gen 2 P61830 88.24 8e-85 EM
 2018-10-17 VAL B:118 A:117 138.0 0.89 S -105.2 -1.2 50.0 0.323 0.567 G:P04911:0.181
E:P02309:0.419
 DA
DC
DG
DC
DC
DG
 8.157
5.013
3.398
9.407
8.844
7.416
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL C:118 B:117 142.0 0.916 S -105.2 -1.2 55.0 0.355 0.561 D:P02309:0.426
F:P04911:0.194
 DC
DC
DG
DG
DA
DC
 8.961
7.598
7.612
4.617
2.827
8.229
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
4jjn 1 P61830 88.89 1e-84 X-RAY
 2013-05-15 VAL A:117 A:117 130.0 0.839 S -136.2 5.6 57.0 0.368 0.471 B:P02309:0.239
G:P04912:0.284
 DC
DC
DG
DG
DA
DC
 7.868
7.443
6.489
3.568
2.840
8.476
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL E:117 E:117 130.0 0.839 S -134.6 19.3 62.0 0.4 0.439 C:P04912:0.297
F:P02309:0.213
 DA
DC
DG
DC
DC
DG
 6.576
3.759
2.814
8.392
7.989
7.769
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
1id3 2 P61830 88.15 7e-84 X-RAY
 2001-09-28 VAL C:117 A:117 122.0 0.787 S -137.3 9.9 51.0 0.329 0.458 D:P02309:0.265
I:P04911:0.239
 DG
DC
DG
DG
DG
DA
MN
HOH
 7.312
4.135
2.748
8.293
8.291
7.457
8.468
6.423
 CG2
CG2
N
N
O
O
CG1
CG1
 O3'
O3'
OP1
OP2
O3'
OP1
MN
O
VAL G:117 E:117 122.0 0.787 S -141.7 17.4 53.0 0.342 0.445 H:P02309:0.226
E:P04911:0.252
 DT
DG
DC
DG
DG
DA
HOH
 8.643
7.541
7.314
4.224
2.750
8.489
8.747
 O
O
CG2
CG2
N
N
C
 O3'
OP1
O3'
C3'
OP1
OP2
O
4h9p 1 P84243 93.33 1e-81 X-RAY
 2012-10-17 VAL A:117 A:117 88.0 0.568 -116.7 173.1 72.0 0.465 0.103 B:P62805:0.103
 PO4
HOH
 6.744
3.708
 CG2
CG1
 O1
O
4h9r 1 P84243 93.33 1e-81 X-RAY
 2012-10-17 VAL A:117 A:117 77.0 0.497 -116.9 173.2 63.0 0.406 0.091 B:P62805:0.09
 PO4
HOH
 6.965
4.246
 CG1
C
 O3
O
7dbh 1 ? 88.24 1e-81 EM
 2022-01-19 VAL A:121 A:117 133.0 0.858 S -126.4 -21.6 94.0 0.606 0.252 B:P62806:0.252
 DA
DC
DG
DC
DC
DG
 7.147
4.312
2.437
7.846
8.083
7.295
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:121 E:117 129.0 0.832 S -116.3 -16.4 79.0 0.51 0.322 F:P62806:0.323
 DC
DC
DG
DG
DA
DC
 8.489
7.837
7.249
4.730
2.469
7.871
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
7vbm 1 ? 88.24 1e-81 EM
 2022-01-19 VAL A:121 A:117 131.0 0.845 S -114.4 -26.4 68.0 0.439 0.406 B:P62806:0.406
 DA
DC
DG
DC
DC
DG
 7.074
4.812
3.591
8.214
8.447
7.753
 CG2
CG2
N
N
O
O
 O3'
OP1
OP1
OP2
O3'
OP1
VAL E:121 E:117 137.0 0.884 S -124.8 -26.3 76.0 0.49 0.394 F:P62806:0.394
 DC
DC
DG
DG
DA
DC
 8.831
7.959
6.929
4.598
2.494
8.309
 O
O
CG1
CB
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
1aoi 2 P02302 99.14 8e-81 X-RAY
 1998-09-30 VAL C:98 A:117 130.0 0.839 S -134.6 -23.8 48.0 0.31 0.529 I:P06897:0.271
D:P62799:0.316
 DG
DC
DT
DG
DG
DA
 7.495
4.915
2.867
8.644
8.350
7.439
 CG1
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL G:98 E:117 130.0 0.839 S -130.0 -22.3 56.0 0.361 0.478 H:P62799:0.329
E:P06897:0.219
 DT
DG
DC
DT
DG
DA
HOH
 8.276
7.478
7.743
5.018
2.724
8.572
7.505
 O
O
CG2
CB
N
N
CG1
 O3'
OP1
O3'
O3'
OP1
OP2
O
5zbx 1 P68431,P49450 85.51 3e-80 X-RAY
 2019-02-13 VAL A:123 A:119 106.0 0.684 S -126.0 -14.0 49.0 0.316 0.368 B:P62805:0.258
G:P04908:0.123
 DG
DC
DT
DG
DG
DA
 7.815
5.031
2.812
8.048
8.083
7.367
 CG1
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:123 E:119 105.0 0.677 S -121.7 -16.1 53.0 0.342 0.335 C:P04908:0.129
F:P62805:0.239
 DT
DG
DC
DT
DG
DA
MN
 8.388
7.264
6.980
4.601
2.416
8.330
8.060
 O
O
CG1
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
MN
5bs7 1 P84233 100.0 3e-78 X-RAY
 2015-07-08 VAL A:93 A:117 122.0 0.787 S -127.8 -54.5 71.0 0.458 0.329 C:P62799:0.226
E:Q68D10:0.097
 SO4
 6.489
 CG1
 O4
VAL B:93 B:117 126.0 0.813 S -123.4 -50.2 60.0 0.387 0.426 D:P62799:0.329
E:Q68D10:0.09
 HOH
 8.350
 CG2
 O
5z23 1 P68431,P49450 84.06 5e-78 X-RAY
 2019-02-13 VAL A:123 A:119 108.0 0.697 S -119.5 -4.8 51.0 0.329 0.368 B:P62805:0.239
G:P04908:0.155
 DG
DC
DT
DG
DG
DA
 6.905
3.793
2.656
8.305
8.341
7.180
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:123 E:119 106.0 0.684 S -121.8 -9.0 59.0 0.381 0.303 C:P04908:0.129
F:P62805:0.181
 DT
DG
DC
DT
DG
DA
 8.463
7.444
6.218
3.929
2.800
8.690
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
5bsa 1 P84233 100.0 1e-77 X-RAY
 2015-07-08 VAL A:92 A:117 124.0 0.8 S -168.1 -31.2 58.0 0.374 0.426 C:P62799:0.342
E:Q68D10:0.084
VAL B:92 B:117 112.0 0.723 S -161.2 -43.8 54.0 0.348 0.375 D:P62799:0.265
E:Q68D10:0.11
3w98 1 P68431 99.07 1e-75 X-RAY
 2013-08-28 VAL A:94 A:117 123.0 0.794 S -129.5 7.9 48.0 0.31 0.484 B:P62805:0.303
G:P04908:0.265
 DG
DC
DT
DG
DG
DA
 8.218
4.698
2.614
8.183
8.277
7.697
 CG2
N
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:94 E:117 121.0 0.781 S -97.8 -13.8 43.0 0.277 0.504 C:P04908:0.245
F:P62805:0.316
 DT
DG
DC
DT
DG
DA
 8.844
7.904
8.288
4.740
2.872
8.058
 O
O
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
4z2m 2 P68431 99.02 9e-71 X-RAY
 2016-03-09 VAL B:84 G:117 134.0 0.865 S -95.2 -16.2 74.0 0.477 0.388 C:P62805:0.387
VAL D:84 I:117 143.0 0.923 S -66.8 -40.6 69.0 0.445 0.478 A:Q9Y5B9:0.213
E:P62805:0.31
7ea5 1 A0A310TTQ1 98.02 2e-69 EM
 2021-07-14 VAL A:84 A:117 133.0 0.858 S -112.1 -40.9 54.0 0.348 0.51 B:None:0.355
G:Q6AZJ8:0.239
 DA
DC
DG
DC
DC
DG
 7.870
5.632
3.440
8.325
9.053
7.866
 CG2
CB
N
N
CG1
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL E:84 E:117 138.0 0.89 S -115.5 -31.5 60.0 0.387 0.503 C:Q6AZJ8:0.219
F:None:0.355
 DC
DC
DG
DG
DA
DC
 9.094
7.755
7.612
5.005
2.694
8.554
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
5wcu 1 P02299 100.0 2e-68 X-RAY
 2018-10-31 VAL A:80 A:117 146.0 0.942 S -94.5 -7.8 63.0 0.406 0.536 B:P84040:0.329
G:P84051:0.303
 DA
DC
DG
DC
DC
DG
 7.004
4.602
3.136
8.196
9.194
8.885
 CG1
CG2
C
N
O
O
 O3'
C3'
OP1
C5
O3'
OP1
VAL E:80 E:117 143.0 0.923 S -94.6 -7.3 60.0 0.387 0.536 C:P84051:0.252
F:P84040:0.381
 DC
DC
DC
DG
DG
DA
DC
 9.955
7.921
6.726
6.481
3.969
2.258
8.365
 C
O
O
CG2
CB
N
N
 O3'
O3'
OP1
O3'
C5'
OP1
OP2
VAL K:80 K:117 149.0 0.961 S -94.5 -7.6 NA NA NA
VAL O:80 O:117 145.0 0.935 S -94.2 -7.4 NA NA NA
6jm9 3 P84233 100.0 2e-68 EM
 2019-05-15 VAL C:80 A:117 131.0 0.845 S -129.8 4.9 52.0 0.335 0.51 D:P62799:0.284
I:Q6AZJ8:0.29
 DG
DC
DT
DG
DG
DA
 6.894
3.900
2.788
8.328
8.289
7.193
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL G:80 E:117 128.0 0.826 S -124.1 -2.6 55.0 0.355 0.471 H:P62799:0.284
E:Q6AZJ8:0.239
 DT
DG
DC
DT
DG
DA
 8.434
7.219
6.944
3.996
2.916
8.702
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6jma 2 P84233 100.0 2e-68 EM
 2019-05-15 VAL C:80 A:117 131.0 0.845 S -129.8 4.8 51.0 0.329 0.516 I:Q6AZJ8:0.297
D:P62799:0.277
 DG
DC
DT
DG
DG
DA
 6.893
3.900
2.788
8.328
8.289
7.192
 CG2
CG2
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL G:80 E:117 128.0 0.826 S -124.2 -2.6 54.0 0.348 0.478 H:P62799:0.284
E:Q6AZJ8:0.245
 DT
DG
DC
DT
DG
DA
 8.435
7.220
6.944
3.996
2.915
8.702
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6r1t 1 A0A310TTQ1 98.99 2e-68 EM
 2019-04-24 VAL A:81 A:117 136.0 0.877 S -120.8 30.7 58.0 0.374 0.503 B:None:0.265
G:Q6AZJ8:0.284
 DG
DG
DA
DC
DC
DC
 6.513
3.979
2.698
8.645
8.577
7.327
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:81 E:117 134.0 0.865 S -105.8 16.6 58.0 0.374 0.491 C:Q6AZJ8:0.303
F:None:0.245
 DC
DG
DA
DC
DG
DC
 9.392
7.913
6.463
4.026
3.471
8.765
 O
O
CG2
CG2
N
N
 C5'
OP1
O3'
O5'
OP1
OP2
7ktq 1 A0A310TTQ1 98.99 2e-68 EM
 2021-02-03 VAL A:81 A:117 130.0 0.839 S -124.6 6.0 49.0 0.316 0.523 B:P62799:0.316
G:Q6AZJ8:0.265
 DA
DC
DG
DC
DC
DG
 6.854
4.208
3.086
8.507
8.488
6.887
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
VAL E:81 E:117 134.0 0.865 S -110.6 6.3 50.0 0.323 0.542 C:Q6AZJ8:0.206
F:P62799:0.426
 DC
DC
DG
DG
DA
DC
 8.409
7.273
6.542
3.786
2.526
8.492
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
C3'
OP1
OP2
7ea8 2 ? 96.04 4e-68 EM
 2021-07-14 VAL B:85 A:117 137.0 0.884 S -116.1 -41.5 61.0 0.394 0.49 H:P20671:0.213
C:None:0.348
 DA
DC
DG
DC
DC
DG
 7.607
5.551
3.285
8.559
8.930
7.931
 CG2
CB
N
N
C
O
 O3'
C5'
OP1
OP2
C5'
OP1
VAL F:85 E:117 128.0 0.826 S -118.6 -43.1 56.0 0.361 0.465 D:P20671:0.2
G:None:0.316
 DC
DC
DG
DG
DA
DC
 9.115
7.869
7.721
5.455
3.172
8.621
 CG1
CG1
CG2
CB
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6fq5 1 ? 98.98 6e-68 EM
 2018-04-18 VAL A:81 A:117 131.0 0.845 S -121.4 0.3 63.0 0.406 0.439 B:P62799:0.316
G:Q6AZJ8:0.174
 DG
DG
DA
DC
DC
DC
 6.235
3.759
2.443
8.338
8.830
7.696
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
C5'
OP1
VAL E:81 E:117 129.0 0.832 S -128.0 8.0 63.0 0.406 0.426 C:Q6AZJ8:0.181
F:P62799:0.284
 DC
DG
DA
DC
DG
DC
 8.971
7.850
6.033
3.490
2.415
8.255
 O
O
CG2
CG2
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
6fq6 1 ? 98.98 6e-68 EM
 2018-04-18 VAL A:81 A:117 130.0 0.839 S -122.0 -2.8 63.0 0.406 0.433 G:Q6AZJ8:0.2
B:P62799:0.29
 DG
DG
DA
DC
DC
DC
 6.090
3.617
2.570
8.244
9.424
8.713
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:81 E:117 128.0 0.826 S -126.6 4.1 69.0 0.445 0.381 C:Q6AZJ8:0.187
F:P62799:0.226
 DC
DG
DA
DC
DG
DC
 9.282
8.934
5.853
3.397
2.509
8.104
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
O5'
OP1
OP2
6fq8 1 P02302 98.98 6e-68 EM
 2018-04-18 VAL A:81 A:117 125.0 0.806 S -119.6 -2.4 53.0 0.342 0.464 B:P62799:0.355
G:Q6AZJ8:0.168
 DG
DG
DA
DC
DC
DC
 6.143
3.645
2.584
8.594
9.896
9.046
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:81 E:117 142.0 0.916 S -122.5 5.2 65.0 0.419 0.497 C:Q6AZJ8:0.148
F:P62799:0.394
 DC
DG
DA
DC
DG
DC
 9.496
9.429
6.067
3.562
2.601
8.281
 O
O
CG2
CG2
N
N
 C5'
OP1
O3'
O5'
OP1
OP2
4xzq 1 P84233 98.98 9e-68 X-RAY
 2015-10-14 VAL A:80 A:517 132.0 0.852 S -119.6 5.5 54.0 0.348 0.504 G:Q6AZJ8:0.277
B:P62799:0.284
 DC
DT
DG
DG
DT
DG
HOH
 6.730
3.839
2.849
8.344
8.098
7.178
2.810
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:80 E:717 131.0 0.845 S -122.0 2.0 52.0 0.335 0.51 C:Q6AZJ8:0.252
F:P62799:0.316
 DT
DG
DC
DT
DG
DG
HOH
 8.223
7.283
7.102
4.171
2.832
8.501
2.752
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
4ys3 1 P84233 98.98 9e-68 X-RAY
 2015-10-14 VAL A:80 A:517 127.0 0.819 S -134.6 -19.4 46.0 0.297 0.522 B:P62799:0.316
G:Q6AZJ8:0.284
 DC
DT
DG
DG
DT
DG
HOH
 7.826
5.218
2.824
8.187
8.501
7.620
2.759
 CG1
CB
N
N
O
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL E:80 E:717 130.0 0.839 S -145.5 12.9 58.0 0.374 0.465 C:Q6AZJ8:0.245
F:P62799:0.265
 DT
DG
DC
DT
DG
DG
HOH
 8.309
7.065
7.165
4.186
2.963
8.435
3.370
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
4z66 1 P84233 98.98 9e-68 X-RAY
 2015-10-14 VAL A:80 A:517 130.0 0.839 S -127.6 -1.8 50.0 0.323 0.516 B:P62799:0.29
G:Q6AZJ8:0.284
 DC
DT
DG
DG
DT
DG
HOH
 6.854
3.821
2.792
8.384
8.269
7.422
2.665
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:80 E:717 130.0 0.839 S -126.9 5.6 56.0 0.361 0.478 C:Q6AZJ8:0.245
F:P62799:0.284
 DT
DG
DC
DT
DG
DG
HOH
 8.149
7.233
7.062
4.032
2.827
8.704
2.911
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
6yn1 3 A0A310TTQ1 98.98 9e-68 X-RAY
 2021-11-17 VAL C:81 C:117 129.0 0.832 S -99.6 -11.7 55.0 0.355 0.477 D:P62799:0.31
F:Q6AZJ8:0.226
 HOH
 2.698
 O
 O
VAL H:81 H:117 135.0 0.871 S -99.2 -15.5 57.0 0.368 0.503 I:P62799:0.361
A:Q6AZJ8:0.213
 GOL
HOH
 9.150
2.654
 O
O
 O1
O
VAL M:81 M:117 130.0 0.839 S -101.5 -16.1 NA NA NA
VAL R:81 R:117 133.0 0.858 S -96.4 -16.1 NA NA NA
VAL W:81 W:117 130.0 0.839 S -105.4 -10.8 NA NA NA
VAL BA:81 b:117 134.0 0.865 S -98.3 -13.0 NA NA NA
VAL GA:81 g:117 132.0 0.852 S -101.9 -6.8 NA NA NA
VAL LA:81 l:117 127.0 0.819 S -106.0 -14.2 NA NA NA
6iy2 1 A0A310TTQ1 98.0 1e-67 EM
 2019-04-03 VAL A:82 A:117 124.0 0.8 S -119.5 -44.2 49.0 0.316 0.484 B:P62799:0.348
G:Q6AZJ8:0.213
 DA
DC
DT
DT
DA
DC
 7.379
4.730
2.801
8.166
8.968
8.009
 CG2
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:82 E:117 129.0 0.832 S -127.3 -28.2 51.0 0.329 0.503 C:Q6AZJ8:0.239
F:P62799:0.348
 DC
DT
DG
DA
DA
DG
 8.744
8.051
8.165
4.860
3.379
8.209
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6iy3 1 A0A310TTQ1 98.0 1e-67 EM
 2019-04-03 VAL A:82 A:117 123.0 0.794 S -123.6 -42.5 54.0 0.348 0.446 B:P62799:0.323
G:Q6AZJ8:0.174
 DA
DC
DT
DT
DA
DC
 8.012
4.860
2.970
8.598
8.958
8.404
 CG2
N
N
N
C
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:82 E:117 125.0 0.806 S -120.9 -42.4 51.0 0.329 0.477 C:Q6AZJ8:0.232
F:P62799:0.316
 DC
DT
DG
DA
DA
DG
 8.860
8.182
7.619
4.702
2.468
8.334
 CG1
CG1
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6ipu 1 P68431 98.98 1e-67 X-RAY
 2020-01-15 VAL A:80 A:117 129.0 0.832 S -122.0 3.1 51.0 0.329 0.503 B:P62805:0.277
G:P04908:0.29
 DG
DC
DT
DG
DG
DA
HOH
 6.995
3.793
2.942
8.287
8.267
7.238
2.654
 CG2
CG2
N
N
O
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
O
VAL E:80 E:117 131.0 0.845 S -117.2 -2.7 56.0 0.361 0.484 C:P04908:0.239
F:P62805:0.29
 DG
DA
DG
DC
DT
DG
HOH
 8.278
7.271
7.031
3.756
2.893
8.325
2.669
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
6iq4 1 P68431 98.98 1e-67 X-RAY
 2019-10-30 VAL A:80 A:117 129.0 0.832 S -122.3 5.8 50.0 0.323 0.509 B:P62805:0.277
G:P04908:0.29
 DG
DC
DT
DG
DG
DA
XIS
HOH
 6.944
3.823
2.770
8.269
8.218
7.267
8.511
2.642
 CG2
CG2
N
N
O
O
CG1
O
 O3'
O3'
OP1
OP2
O3'
OP1
C10
O
VAL E:80 E:117 130.0 0.839 S -121.9 1.9 54.0 0.348 0.491 F:P62805:0.303
C:P04908:0.239
 DG
DA
DG
DC
DT
DG
HOH
 8.198
7.332
6.932
3.780
2.800
8.457
2.680
 O
O
CG2
CG2
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O
6jxd 1 P68431 98.98 1e-67 X-RAY
 2020-01-15 VAL A:80 A:117 133.0 0.858 S -113.7 -3.9 44.0 0.284 0.574 G:P04908:0.265
B:P62805:0.374
 DA
DC
DG
DC
DC
DG
HOH
 7.121
4.919
3.045
9.452
9.434
7.392
2.625
 CG1
CG1
N
N
O
O
O
 O3'
O5'
OP1
P
C4'
OP1
O
7ccq 1 P68431 98.98 1e-67 EM
 2020-10-07 VAL A:80 A:117 130.0 0.839 S -116.8 -1.7 57.0 0.368 0.471 B:None:0.323
G:P04908:0.213
 DG
DG
DA
DC
DC
DC
 6.355
3.736
2.933
8.881
8.540
7.261
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL E:80 E:117 122.0 0.787 S -132.9 -11.1 42.0 0.271 0.516 C:P04908:0.206
F:None:0.406
 DC
DG
DA
DC
DG
DC
 9.120
7.955
6.470
3.680
2.651
8.191
 CG1
O
CG1
CG1
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
7ccr 1 P68431 98.98 1e-67 EM
 2020-10-07 VAL A:80 A:117 129.0 0.832 S -116.6 -3.2 56.0 0.361 0.471 G:P04908:0.2
B:None:0.329
 DG
DG
DA
DC
DC
DC
 6.369
3.655
2.938
9.305
8.318
6.949
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL E:80 E:117 120.0 0.774 S -133.2 -10.5 39.0 0.252 0.522 C:P04908:0.213
F:None:0.394
 DC
DG
DA
DC
DG
DC
 9.302
8.387
6.349
3.560
2.709
8.313
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
VAL L:80 L:117 131.0 0.845 S -116.5 -3.2 58.0 0.374 0.471 M:None:0.329
R:P04908:0.2
 DG
DG
DA
DC
DC
DC
 6.369
3.656
2.938
9.305
8.318
6.949
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL P:80 P:117 120.0 0.774 S -133.2 -10.5 41.0 0.265 0.509 N:P04908:0.226
Q:None:0.374
 DC
DG
DA
DC
DG
DC
 9.301
8.387
6.348
3.559
2.709
8.314
 O
O
CG1
CG1
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
3kwq 1 P84233 97.96 3e-67 X-RAY
 2010-05-12 VAL A:80 A:117 132.0 0.852 S -126.8 -12.1 55.0 0.355 0.497 B:P62799:0.361
G:Q6AZJ8:0.2
 DG
DC
DG
DG
DG
DA
 7.029
3.966
3.336
8.342
8.269
6.848
 CG2
CG2
N
N
O
O
 O3'
C3'
OP1
OP1
O3'
OP1
VAL E:80 E:117 127.0 0.819 S -141.2 -6.7 52.0 0.335 0.484 C:Q6AZJ8:0.226
F:P62799:0.323
 DT
DG
DC
DG
DG
DA
HOH
 7.938
6.636
7.372
4.177
3.136
8.642
7.533
 O
O
CG2
CG2
N
N
CG2
 O3'
OP1
O3'
O3'
OP1
OP2
O
6ftx 1 S4RAZ3 98.97 4e-67 EM
 2018-08-08 VAL A:80 A:117 129.0 0.832 -141.6 -19.8 106.0 0.684 0.148 B:P62799:0.148
 DA
DC
DG
DC
DC
DG
 6.916
3.227
2.965
7.883
8.971
7.987
 CG1
CB
CB
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
6z6p 5 A0A310TTQ1 98.97 4e-67 EM
 2021-02-17 VAL E:80 A:117 142.0 0.916 S -103.9 -26.1 42.0 0.271 0.645 F:P62799:0.471
K:P06897:0.232
 DA
DC
DG
DC
DC
DG
 6.832
3.599
2.492
9.218
8.726
8.540
 CG1
CG1
N
N
CG1
O
 O3'
O3'
OP1
OP2
C4'
OP1
6y5d 1 Q71DI3 98.98 4e-67 EM
 2020-09-23 VAL A:80 A:118 133.0 0.858 S -88.1 -38.1 46.0 0.297 0.561 B:P62805:0.419
G:Q6FI13:0.213
 DA
DC
DG
DC
DC
DG
 7.164
4.635
2.665
8.516
8.046
7.118
 CG2
N
N
N
CG1
CG1
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:80 E:118 133.0 0.858 S -104.9 -38.8 54.0 0.348 0.51 C:Q6FI13:0.2
F:P62805:0.374
 DC
DC
DG
DG
DA
DC
 8.662
7.686
7.162
4.674
2.852
8.636
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL M:80 M:118 127.0 0.819 S -101.4 -38.5 64.0 0.413 0.406 N:P62805:0.406
 DA
DC
DG
DC
DC
DG
 7.372
4.433
2.534
7.980
7.810
6.999
 CG2
CB
N
N
CG1
CG1
 O3'
O3'
OP1
OP2
O3'
OP1
VAL Q:80 Q:118 129.0 0.832 S -101.8 -38.7 43.0 0.277 0.555 R:P62805:0.406
O:Q6FI13:0.232
 DC
DC
DG
DG
DA
DC
 8.772
7.786
7.166
4.606
2.889
8.695
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6jxd 5 P68431 98.97 5e-67 X-RAY
 2020-01-15 VAL E:80 E:117 132.0 0.852 S -124.4 -5.8 47.0 0.303 0.549 F:P62805:0.335
C:P04908:0.265
 DC
DC
DA
DG
DA
DC
HOH
 8.303
7.178
6.913
4.473
2.824
8.361
2.760
 O
O
CG1
CG1
N
N
O
 O3'
OP1
O3'
C5'
OP1
OP2
O
7k6p 1 P84233 97.96 5e-67 EM
 2021-02-10 VAL A:81 A:117 126.0 0.813 S -102.1 -10.4 45.0 0.29 0.523 B:P62799:0.335
G:P06897:0.258
 DA
DC
DG
DG
DC
DG
 6.712
4.022
3.224
8.506
8.734
7.366
 CG2
CG2
CG2
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL E:81 E:117 126.0 0.813 S -104.3 -19.9 41.0 0.265 0.548 C:P06897:0.284
F:P62799:0.342
 DC
DC
DG
DG
DA
DG
 8.829
7.336
6.444
3.734
2.784
8.422
 C
O
CG2
CG2
N
N
 C5'
OP1
O3'
C5'
OP1
OP2
7k6q 1 P84233 97.96 5e-67 EM
 2021-02-10 VAL A:81 A:117 119.0 0.768 S -107.1 -10.5 49.0 0.316 0.452 B:P62799:0.335
G:P06897:0.181
 DA
DC
DG
DG
DC
DG
 6.666
4.177
3.150
8.508
8.143
7.159
 CG2
CG2
N
N
O
O
 O3'
O5'
OP1
OP2
O3'
OP1
VAL E:81 E:117 124.0 0.8 S -109.1 -14.7 39.0 0.252 0.548 C:P06897:0.284
F:P62799:0.342
 DC
DC
DG
DG
DA
DG
 8.609
7.102
6.545
3.781
2.676
8.364
 C
O
CG2
CG2
N
N
 C5'
OP1
O3'
C5'
OP1
OP2
5mlu 1 P84233 98.97 1e-66 X-RAY
 2017-05-10 VAL A:79 A:117 132.0 0.852 S -106.8 -17.0 57.0 0.368 0.484 G:P06897:0.252
B:P62799:0.31
 DG
DG
DA
DC
DC
DC
HOH
 6.897
4.133
2.524
8.190
8.635
7.547
2.572
 CG2
CG2
N
N
O
O
O
 O3'
C3'
OP1
OP2
O3'
OP1
O
VAL E:79 E:117 129.0 0.832 S -119.2 -2.9 54.0 0.348 0.484 C:P06897:0.258
F:P62799:0.265
 DC
DG
DA
DC
DG
DC
HOH
 8.590
7.281
6.603
3.845
2.838
8.457
4.151
 O
O
CG2
CG2
N
N
CG1
 O3'
OP1
O3'
O3'
OP1
OP2
O
6z6p 9 P84233 98.97 1e-66 EM
 2021-02-17 VAL I:79 E:117 137.0 0.884 S -127.3 -28.6 38.0 0.245 0.639 J:P62799:0.406
G:Q6AZJ8:0.31
 DC
DC
DC
DG
DG
DA
 9.993
8.066
7.270
6.785
4.579
4.592
 C
CG1
CG1
CG1
CG1
N
 O3'
O3'
OP1
O3'
O5'
OP2
6ftx 5 P02302 98.97 2e-66 EM
 2018-08-08 VAL E:92 E:117 142.0 0.916 S -111.6 21.0 48.0 0.31 0.606 F:P62799:0.4
C:P06897:0.252
 DC
DC
DG
DG
DA
DC
 9.184
8.806
6.538
4.031
3.025
8.507
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6y5e 1 Q71DI3 98.96 8e-66 EM
 2020-09-23 VAL A:80 A:118 132.0 0.852 S -100.3 -37.9 52.0 0.335 0.517 B:P62805:0.381
G:Q16777:0.206
 DA
DC
DG
DC
DC
DG
 7.195
4.722
2.810
8.583
8.580
7.637
 CG2
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:80 E:118 131.0 0.845 S -105.4 -39.2 49.0 0.316 0.529 C:Q16777:0.219
F:P62805:0.381
 DC
DC
DG
DG
DA
DC
 8.614
7.596
7.373
4.883
2.916
8.688
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
6ke9 1 P68431 98.96 2e-65 X-RAY
 2020-04-22 VAL A:78 A:117 130.0 0.839 S -112.9 -35.4 53.0 0.342 0.497 B:P62805:0.355
G:P04908:0.226
 DG
DG
DT
DT
DT
DA
 8.333
4.672
3.079
7.975
8.847
7.987
 CG1
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:78 E:117 132.0 0.852 S -112.8 -35.7 56.0 0.361 0.491 C:P04908:0.239
F:P62805:0.329
 DG
DG
DT
DT
DA
DA
DC
 8.876
7.657
9.981
7.666
4.669
3.025
8.695
 C
CG1
CG1
CG2
CB
N
N
 O3'
OP1
OP1
O3'
O3'
OP1
OP2
6l9h 1 P68431 98.96 2e-65 X-RAY
 2020-04-22 VAL A:78 A:117 137.0 0.884 S -117.0 -21.4 46.0 0.297 0.587 B:P62805:0.381
G:P04908:0.284
 DG
DG
DT
DT
DT
DA
 8.033
4.523
2.697
8.069
8.548
7.233
 CG2
CB
N
N
C
O
 O3'
O3'
OP1
OP2
C5'
OP1
VAL E:78 E:117 135.0 0.871 S -116.2 -21.1 49.0 0.316 0.555 C:P04908:0.265
F:P62805:0.361
 DG
DG
DT
DA
DA
DC
 8.505
7.112
7.777
4.531
2.710
8.703
 O
O
CG2
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
6le9 1 P68431 98.96 2e-65 X-RAY
 2020-04-22 VAL A:78 A:117 135.0 0.871 S -122.2 -21.3 45.0 0.29 0.581 B:P62805:0.419
G:P04908:0.258
 DT
DA
DA
DC
DG
DG
 8.156
4.454
2.734
8.009
8.524
7.381
 CG2
CB
N
N
O
O
 O3'
O3'
OP1
OP2
O3'
OP1
VAL E:78 E:117 135.0 0.871 S -122.0 -20.0 53.0 0.342 0.529 C:P04908:0.226
F:P62805:0.374
 DT
DA
DG
DG
DT
DT
 8.953
7.053
7.746
4.670
2.802
8.513
 O
O
CG2
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
4x23 3 P02299 100.0 6e-64 X-RAY
 2014-12-10 VAL C:78 A:117 130.0 0.839 S -102.6 -4.3 47.0 0.303 0.536 D:P84040:0.335
I:P84051:0.265
 DA
DC
DG
DC
DC
DG
 6.365
3.666
2.558
8.330
8.167
7.576
 CG2
CG2
N
N
O
O
 O3'
C5'
OP1
OP2
O3'
OP1
VAL G:78 E:117 128.0 0.826 S -103.6 -5.4 49.0 0.316 0.51 E:P84051:0.265
H:P84040:0.316
 DC
DC
DG
DG
DA
DC
 8.560
7.642
6.517
3.684
2.648
8.595
 O
O
CG2
CG2
N
N
 O3'
OP1
O3'
C5'
OP1
OP2
VAL O:78 K:117 133.0 0.858 S -103.1 -4.7 NA NA NA
VAL S:78 O:117 130.0 0.839 S -103.4 -4.8 NA NA NA
5bo0 1 Q71DI3 100.0 1e-53 X-RAY
 2015-06-17 VAL A:62 A:117 148.0 0.955 S -95.0 -11.0 107.0 0.69 0.265 B:P62805:0.265
5bnv 1 P84243 96.2 1e-50 X-RAY
 2015-06-17 VAL A:61 A:117 139.0 0.897 S -85.5 -30.8 86.0 0.555 0.342 B:P62805:0.342
F:P49736:0.032
 HOH
 2.788
 O
 O
VAL C:61 D:117 139.0 0.897 S -89.4 -19.4 76.0 0.49 0.407 D:P62805:0.4
E:P49736:0.019
 HOH
 3.248
 N
 O
5bnx 1 P84243 96.2 1e-50 X-RAY
 2015-06-17 VAL A:61 A:117 150.0 0.968 S -94.5 -12.0 105.0 0.677 0.291 B:P62805:0.277
C:P49736:0.019
 HOH
 2.967
 O
 O
5ja4 1 P84243 96.2 1e-50 X-RAY
 2016-06-15 VAL A:61 A:117 139.0 0.897 S -86.6 -22.8 98.0 0.632 0.265 B:P62805:0.265
C:P49736:0.006
 HOH
 2.858
 O
 O
7ciz 1 P84243 96.2 1e-50 X-RAY
 2021-04-14 VAL A:61 A:117 132.0 0.852 S -103.2 -25.3 83.0 0.535 0.317 B:P62805:0.31
C:P49736:0.039
 HOH
 2.810
 O
 O
VAL D:61 E:117 131.0 0.845 S -104.0 -30.0 NA NA NA
VAL G:61 I:117 137.0 0.884 S -99.5 -22.7 NA NA NA
7cj0 1 P84243 96.2 1e-50 X-RAY
 2021-04-14 VAL A:61 E:117 124.0 0.8 S -101.6 -4.8 1.0 0.006 0.794 B:P62805:0.458
D:Q8WXX5:0.523
 HOH
 8.231
 N
 O
VAL E:61 B:117 121.0 0.781 S -117.4 -12.1 NA NA NA
2hue 2 Q92133 98.67 2e-49 X-RAY
 2006-11-21 VAL B:59 B:117 141.0 0.91 S -102.6 -7.7 90.0 0.581 0.329 C:P62799:0.329
 GOL
SO4
HOH
 9.595
8.334
2.752
 N
N
O
 C1
O4
O
4eo5 2 P84233 98.67 3e-49 X-RAY
 2012-06-13 VAL B:58 B:117 139.0 0.897 S -108.0 -18.1 99.0 0.639 0.258 C:P62799:0.258
 HOH
 2.817
 O
 O
4zbj 2 Q10453 94.67 6e-47 X-RAY
 2015-07-15 VAL B:59 B:117 145.0 0.935 S -109.4 -20.6 138.0 0.89 0.045 C:P62799:0.045
 CL
HOH
 9.410
3.042
 N
N
 CL
O

AlphaFold DB

Entity Residue Monomer View
ID Entity Uniprot Identity Evalue Name Label Auth ASA rASA SS φ ψ
af-q71di3-f1 1 Q71DI3 100.0 7e-97 VAL A:118 A:118 136.0 0.877 S -106.9 -12.1
af-p68431-f1 1 P68431 99.26 7e-96 VAL A:118 A:118 134.0 0.865 S -106.8 -11.8
af-p84243-f1 1 P84243 97.06 4e-94 VAL A:118 A:118 134.0 0.865 S -105.4 -13.4
af-q16695-f1 1 Q16695 96.32 7e-94 VAL A:118 A:118 135.0 0.871 S -121.3 -11.0
af-q5tec6-f1 1 Q5TEC6 97.06 1e-93 VAL A:118 A:118 137.0 0.884 S -106.5 -10.1
af-q6nxt2-f1 1 Q6NXT2 94.12 1e-88 VAL A:117 A:117 134.0 0.865 S -106.7 -10.9
af-p0dpk5-f1 1 P0DPK5 80.15 4e-76 VAL A:118 A:118 138.0 0.89 S -101.1 -22.4