Variant

Genome Chromosome Position VCF ID Ref Alt mRNA Change mRNA Info
GRCh37 chr6 27100974 . G A CCDS4619.1:NM_021064.4:c.124Gag>Aag_NP_066408.1:p.42E>K Homo sapiens histone cluster 1 H2A family member g (HIST1H2AG), 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)
6r0c 3 P0C0S8 100.0 6e-90 EM
2019-09-25 GLU C:42 C:41 186.0 0.979 S -79.8 -60.6 125.0 0.658 0.321 D:P62807:0.147
G:P0C0S8:0.174
DC
DT
DT
DA
DT
DA
DG
9.185
7.100
7.633
9.974
7.142
5.316
7.414
CB
CB
CB
OE1
O
O
O
O3'
C5'
OP1
OP1
O3'
C5'
OP2
GLU G:42 G:41 176.0 0.926 S -89.7 -31.7 136.0 0.716 0.21 C:P0C0S8:0.047
H:P62807:0.163
DC
DT
DA
DT
DG
DG
6.756
4.960
7.437
7.481
5.306
7.754
O
O
O
OE2
OE2
OE1
O3'
OP1
OP1
O3'
OP1
OP2
6rny 3 P0C0S8 100.0 6e-90 EM
2019-09-25 GLU C:42 C:41 184.0 0.968 S -86.1 -42.5 138.0 0.726 0.242 G:P0C0S8:0.095
D:P62807:0.158
DC
DA
DG
DT
DT
9.834
8.508
9.985
7.747
7.754
OE2
OE2
O
O
OE2
OP2
OP1
O3'
OP2
OP1
GLU G:42 G:41 183.0 0.963 S -86.1 -42.6 153.0 0.805 0.158 H:P62807:0.1
C:P0C0S8:0.058
DC
DT
DA
DT
DG
DG
5.504
4.484
5.726
7.462
5.424
7.826
O
O
O
OE1
OE1
N
O3'
C5'
OP1
O3'
OP1
OP1
6se0 5 Q6FI13 98.46 3e-89 EM
2019-08-14 GLU G:42 G:41 194.0 1.0 S -63.5 -46.2 91.0 0.479 0.521 H:P62807:0.253
C:Q6FI13:0.295
DT
DA
DG
DG
DG
DA
6.496
4.832
7.042
9.777
7.190
6.456
O
O
O
CB
OE1
OE1
O3'
OP1
OP2
O3'
O3'
OP1
6se6 3 Q6FI13 98.46 3e-89 EM
2019-08-14 GLU C:42 C:41 150.0 0.789 S -65.5 -40.7 100.0 0.526 0.263 G:Q6FI13:0.126
D:P62807:0.137
DT
DA
DG
DG
DG
DA
DC
7.611
5.458
6.777
9.167
6.519
4.726
6.751
OE2
OE1
OE1
OE2
O
O
OE2
C5'
C5'
OP1
OP1
O3'
C5'
OP1
GLU G:42 G:41 195.0 1.0 S -66.2 -36.3 155.0 0.816 0.184 C:Q6FI13:0.111
H:P62807:0.1
DT
DA
DG
DG
DG
DA
DA
DC
6.565
4.708
6.957
8.264
6.174
8.298
9.334
7.543
O
O
O
OE2
OE2
CB
OE1
OE1
O3'
C5'
OP2
O3'
OP1
OP1
O3'
OP2
6see 3 Q6FI13 98.46 3e-89 EM
2019-08-14 GLU C:42 C:41 189.0 0.995 S -68.1 -46.6 115.0 0.605 0.39 D:P62807:0.184
G:Q6FI13:0.205
DT
DA
DG
DG
DG
DA
6.541
4.571
6.761
9.693
7.301
6.726
O
O
O
CB
CB
OE1
O3'
C5'
OP2
O3'
C5'
OP1
GLU G:42 G:41 189.0 0.995 S -73.4 -38.2 146.0 0.768 0.227 C:Q6FI13:0.116
H:P62807:0.105
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.536
6.791
8.342
9.233
7.180
9.975
5.899
4.070
6.997
OE2
OE1
CB
OE2
OE2
OE2
O
O
O
C5'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP2
6sef 3 Q6FI13 98.46 3e-89 EM
2019-08-14 GLU C:42 C:41 148.0 0.779 S -71.6 -18.1 100.0 0.526 0.253 D:P62807:0.184
G:Q6FI13:0.068
DG
DT
DA
DG
DG
DG
DA
DC
9.629
7.234
4.710
6.457
9.461
5.971
4.266
6.672
OE2
OE2
OE2
OE2
OE1
O
O
O
N2
O3'
C5'
OP1
OP1
O3'
OP1
OP2
GLU G:42 G:41 179.0 0.942 S -67.5 -17.6 129.0 0.679 0.263 H:P62807:0.153
C:Q6FI13:0.116
DT
DA
DG
DG
DG
DA
5.980
3.983
6.405
8.889
6.376
7.625
O
O
O
OE1
OE1
CD
O3'
C5'
OP2
O3'
C5'
OP1
6seg 3 Q6FI13 98.46 3e-89 EM
2019-08-14 GLU C:42 C:41 194.0 1.0 S -62.8 -41.5 144.0 0.758 0.242 D:P62807:0.184
G:Q6FI13:0.084
DG
DT
DA
DG
DA
DG
DG
DA
DC
9.939
6.798
4.530
6.819
9.824
7.731
5.904
4.148
6.878
OE1
OE2
OE2
OE2
OE1
OE1
O
O
O
O3'
O3'
C5'
OP1
O3'
OP1
O3'
C5'
OP2
GLU G:42 G:41 196.0 1.0 S -74.5 -11.0 139.0 0.732 0.268 C:Q6FI13:0.121
H:P62807:0.184
DT
DA
DG
DG
DG
DA
DA
DC
6.132
4.274
6.585
6.616
4.639
6.938
9.678
7.817
O
O
O
OE2
OE2
OE2
OE1
OE1
O3'
C5'
OP2
O3'
OP1
OP1
O3'
OP1
6y5d 3 Q6FI13 98.46 3e-89 EM
2020-09-23 GLU C:42 C:42 176.0 0.926 S -66.1 -36.1 99.0 0.521 0.405 D:O60814:0.184
G:Q6FI13:0.221
DA
DG
DG
DG
DA
DC
7.451
7.287
9.060
5.572
3.907
6.285
CB
OE1
CG
O
O
O
C5'
OP1
OP1
O3'
OP1
OP2
GLU G:42 G:42 179.0 0.942 S -56.9 -38.5 130.0 0.684 0.258 H:O60814:0.168
C:Q6FI13:0.089
DT
DA
DG
DG
DG
DA
DA
DC
6.069
4.325
6.343
6.421
5.637
7.659
9.936
7.804
O
O
O
OE2
OE1
OE1
OE2
OE2
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
GLU O:42 O:42 185.0 0.974 S -65.8 -36.5 114.0 0.6 0.374 P:O60814:0.211
S:Q6FI13:0.163
DA
DG
DG
DG
DA
DC
PTD
7.191
6.846
9.755
5.631
4.065
6.644
6.041
CB
OE1
CG
O
O
O
OE2
C5'
OP1
OP1
O3'
C5'
OP2
C2
GLU S:42 S:42 184.0 0.968 S -65.9 -36.2 108.0 0.568 0.4 T:O60814:0.184
O:Q6FI13:0.216
DT
DA
DG
DG
DG
DA
DC
5.991
4.407
6.400
9.093
7.896
7.486
9.300
O
O
O
CB
CG
OE1
CG
O3'
OP1
OP2
O3'
OP1
OP1
OP2
2cv5 4 P28001 98.46 4e-89 X-RAY
2005-06-28 GLU E:42 C:41 188.0 0.989 S -62.7 -35.2 154.0 0.811 0.178 F:O60814:0.1
I:P28001:0.074
DT
DT
DG
DT
DA
DT
DA
DC
HOH
6.624
5.552
9.333
9.978
8.345
6.177
4.461
5.408
3.030
CG
CG
CB
OE2
OE2
O
O
OE2
N
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU I:42 G:41 186.0 0.979 S -57.9 -33.5 145.0 0.763 0.216 J:O60814:0.137
E:P28001:0.079
DA
DT
DA
DT
DT
DG
DG
DC
HOH
5.822
4.085
6.634
9.278
6.903
4.482
6.933
7.858
4.841
O
O
OE1
OE1
OE2
OE2
OE2
OE1
O
O3'
OP1
OP1
O3'
O3'
C5'
OP2
OP1
O
5xf3 3 P04908 98.46 4e-89 X-RAY
2017-10-11 GLU C:42 C:41 189.0 0.995 S -50.6 -46.9 126.0 0.663 0.332 D:P06899:0.126
G:P04908:0.211
DT
DG
DG
DA
DC
DA
DT
DA
8.998
6.653
7.691
9.478
7.407
5.786
4.212
6.712
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:42 G:41 193.0 1.0 S -57.6 -33.5 134.0 0.705 0.295 H:P06899:0.116
C:P04908:0.195
DT
DA
DC
DT
DT
DG
DT
DA
5.987
4.634
6.298
7.014
6.138
7.958
9.512
7.906
O
O
O
CB
CB
CB
OE1
OE1
O3'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
5xf4 3 P04908 98.46 4e-89 X-RAY
2017-10-11 GLU C:42 C:41 190.0 1.0 S -50.2 -56.6 123.0 0.647 0.353 D:P06899:0.126
G:P04908:0.226
DT
DG
DG
DA
DC
DA
DT
DA
9.024
6.611
7.773
9.594
7.538
6.061
4.338
6.885
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:42 G:41 190.0 1.0 S -55.7 -49.6 132.0 0.695 0.305 H:P06899:0.1
C:P04908:0.211
DT
DA
DC
DT
DT
DG
DT
DA
6.032
4.418
6.529
7.035
6.253
7.894
9.606
8.134
O
O
O
CB
CG
CB
OE1
OE1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
5xf5 3 P04908 98.46 4e-89 X-RAY
2017-10-11 GLU C:42 C:41 193.0 1.0 S -61.4 -47.6 127.0 0.668 0.332 G:P04908:0.232
D:P06899:0.121
DT
DG
DG
DA
DC
DA
DT
DA
9.327
6.789
7.726
9.263
7.170
6.086
4.355
6.986
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:42 G:41 187.0 0.984 S -54.4 -51.8 122.0 0.642 0.342 C:P04908:0.226
H:P06899:0.116
DT
DA
DC
DT
DT
DG
DT
DA
6.107
4.357
6.509
7.055
5.966
7.624
9.785
8.422
O
O
O
CB
CG
CB
OE1
OE1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP2
6buz 3 P04908 98.46 4e-89 EM
2017-12-20 GLU C:42 C:42 191.0 1.0 S -84.7 -52.4 147.0 0.774 0.226 G:P04908:0.095
D:P06899:0.147
DT
DA
DG
DG
DG
DA
DC
7.876
6.215
7.682
8.111
6.210
4.257
6.672
OE2
OE1
OE1
OE2
O
O
O
C5'
C5'
OP1
OP1
O3'
OP1
OP2
GLU G:42 G:42 192.0 1.0 S -84.8 -52.4 146.0 0.768 0.232 H:P06899:0.132
C:P04908:0.111
DT
DA
DG
DG
DG
DA
DC
6.413
4.580
6.972
6.854
5.181
7.466
8.738
O
O
O
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
6e0c 3 P04908 98.46 4e-89 EM
2019-05-22 GLU C:42 C:41 186.0 0.979 S -88.1 -23.1 146.0 0.768 0.211 G:P04908:0.053
D:P06899:0.153
DG
DA
DC
DT
DA
DG
DG
5.616
4.198
6.583
6.589
4.640
6.806
8.179
O
O
O
OE2
OE2
OE2
OE1
O3'
OP1
OP2
O3'
C5'
OP2
OP1
GLU G:42 G:41 191.0 1.0 S -70.9 -37.5 147.0 0.774 0.226 C:P04908:0.063
H:P06899:0.168
DG
DG
DG
DA
DC
DT
DA
DG
9.990
7.089
4.874
7.559
8.061
5.899
4.363
6.724
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C4'
OP1
OP2
OP1
O3'
OP1
OP2
6e0p 3 P04908 98.46 4e-89 EM
2019-05-22 GLU C:42 C:41 193.0 1.0 S -74.0 -35.0 128.0 0.674 0.326 D:P06899:0.121
G:P04908:0.226
DA
DT
DG
DC
DT
DC
DA
DC
5.968
4.452
6.480
9.264
7.243
7.882
9.917
8.396
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP1
C4'
OP1
OP1
O3'
OP1
GLU G:42 G:41 188.0 0.989 S -70.3 -38.1 140.0 0.737 0.252 H:P06899:0.179
C:P04908:0.068
DT
DT
DT
DG
DG
DT
DA
DC
8.656
6.474
4.451
7.098
9.160
5.980
4.331
6.976
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C5'
OP1
OP1
OP1
O3'
OP1
OP2
6hts 7 P04908 98.46 4e-89 EM
2018-11-07 GLU K:42 K:41 192.0 1.0 S -63.0 -42.4 143.0 0.753 0.247 O:P04908:0.168
L:P06899:0.089
DG
DA
DC
DG
DT
DA
DG
6.227
4.328
6.690
9.490
6.325
4.653
7.796
O
O
O
OE2
OE2
OE1
OE1
O3'
C5'
OP2
O3'
O3'
C5'
P
GLU O:42 O:41 192.0 1.0 S -63.0 -42.4 168.0 0.884 0.116 K:P04908:0.126
P:P06899:0.005
DG
DG
DA
DG
DA
DC
DC
DC
DT
DA
9.912
8.369
7.734
9.937
7.972
5.878
8.841
7.745
5.727
6.046
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
OE2
O3'
C5'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP1
6l9z 3 P04908 98.46 4e-89 X-RAY
2021-02-17 GLU C:42 C:41 183.0 0.963 S -65.0 -32.7 145.0 0.763 0.2 G:P04908:0.063
D:P06899:0.137
DG
DT
DA
DG
DA
DG
DG
DA
DC
K
8.905
6.347
4.631
7.558
9.874
7.901
5.763
4.072
6.258
9.425
OE2
OE2
OE2
OE1
CG
CG
O
O
O
N
O3'
C4'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
K
GLU G:42 G:41 183.0 0.963 S -64.9 -42.7 148.0 0.779 0.184 C:P04908:0.047
H:P06899:0.137
DT
DA
DG
DG
DT
DA
DA
DC
K
5.833
4.335
6.387
8.638
6.262
4.535
7.809
8.100
9.289
O
O
O
OE2
OE2
OE2
OE1
OE2
N
O3'
OP1
OP2
O3'
C5'
OP1
OP2
OP1
K
GLU M:42 M:41 189.0 0.995 S -71.0 -33.8 152.0 0.8 0.195 Q:P04908:0.053
N:P06899:0.142
DT
DA
DG
DG
DT
DA
DA
DA
DC
DC
K
HOH
5.925
4.280
6.553
9.653
6.925
4.862
6.996
9.051
6.757
9.038
9.500
9.382
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
OE2
N
N
O3'
OP1
OP2
O3'
O3'
OP1
OP2
O3'
OP1
OP2
K
O
GLU Q:42 Q:41 190.0 1.0 S -57.2 -42.7 152.0 0.8 0.2 M:P04908:0.053
R:P06899:0.147
DG
DT
DA
DG
DG
DG
DA
DC
K
HOH
8.805
6.522
4.639
7.310
7.954
5.637
4.035
6.367
9.299
7.001
OE2
OE2
OE2
OE1
OE2
O
O
O
N
N
O3'
C5'
OP1
OP2
OP1
O3'
OP1
OP1
K
O
6la2 3 P04908 98.46 4e-89 X-RAY
2021-02-17 GLU C:42 g:41 182.0 0.958 S -54.7 -57.9 142.0 0.747 0.211 G:P04908:0.074
D:P06899:0.137
DT
DA
DG
DG
DT
DA
DA
DA
DC
DC
6.072
4.162
6.006
8.777
6.803
5.102
7.627
8.646
6.191
8.972
O
O
O
OE2
OE2
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP2
O3'
OP1
OP2
GLU G:42 k:41 184.0 0.968 S -53.7 -58.3 147.0 0.774 0.194 H:P06899:0.137
C:P04908:0.058
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.194
6.296
4.459
7.183
9.403
7.116
9.410
5.871
4.159
6.587
OE2
OE2
OE1
OE1
OE2
OE2
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
OP1
GLU M:42 C:41 183.0 0.963 S -53.3 -58.5 148.0 0.779 0.184 Q:P04908:0.053
N:P06899:0.132
DT
DA
DG
DG
DT
DA
DA
DA
DC
DC
5.845
4.083
6.163
9.122
6.918
5.001
7.389
8.618
6.170
8.866
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP2
O3'
OP1
OP2
GLU Q:42 G:41 184.0 0.968 S -53.5 -58.1 144.0 0.758 0.21 R:P06899:0.147
M:P04908:0.063
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.188
6.312
4.533
7.257
9.451
7.227
9.328
5.912
4.148
6.568
OE2
OE2
OE1
OE1
OE2
OE2
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
OP1
GLU W:42 M:41 183.0 0.963 S -52.9 -58.3 139.0 0.732 0.231 AA:P04908:0.084
X:P06899:0.147
DT
DA
DG
DG
DT
DA
DA
DA
DC
DC
6.540
4.786
6.055
9.147
6.504
4.496
7.247
9.238
7.054
9.219
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
OE2
O3'
C5'
OP2
O3'
O3'
OP1
OP2
O3'
OP1
OP2
GLU AA:42 Q:41 195.0 1.0 S -52.8 -57.9 148.0 0.779 0.221 BA:P06899:0.142
W:P04908:0.1
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.162
6.499
7.971
8.349
6.266
9.146
5.788
3.844
6.397
OE2
OE2
CB
OE2
OE2
OE2
O
O
O
C5'
OP1
OP1
O3'
OP1
OP1
O3'
C5'
OP1
GLU GA:42 W:41 186.0 0.979 S -51.6 -58.9 144.0 0.758 0.221 HA:P06899:0.168
KA:P04908:0.053
DT
DA
DG
DG
DT
DA
DA
DA
DC
DC
6.000
4.587
6.542
8.667
6.446
4.363
6.765
9.965
7.602
8.971
O
O
O
OE2
OE1
OE2
OE1
OE2
OE2
OE2
O3'
C5'
OP2
O3'
O3'
OP1
OP2
O3'
OP1
OP2
GLU KA:42 a:41 182.0 0.958 S -53.3 -57.8 141.0 0.742 0.216 GA:P04908:0.068
LA:P06899:0.153
DG
DT
DA
DG
DA
DG
DG
DA
DC
8.232
6.242
4.601
7.393
9.664
7.512
6.047
4.083
6.172
OE2
OE2
OE1
OE1
OE2
OE2
O
O
OE2
O3'
C5'
C5'
OP2
O3'
OP1
O3'
C5'
OP1
6la8 3 P04908 98.46 4e-89 X-RAY
2020-10-07 GLU C:42 C:41 188.0 0.989 S -54.9 -49.6 136.0 0.716 0.273 G:P04908:0.095
D:P06899:0.179
DG
DT
DA
DG
DG
DG
DA
DC
9.478
6.110
4.182
7.758
8.452
6.127
4.290
6.842
OE2
OE2
OE2
OE1
CG
O
O
O
O3'
O3'
OP1
OP2
OP1
O3'
OP1
OP1
GLU G:42 G:41 189.0 0.995 S -55.9 -48.2 151.0 0.795 0.2 H:P06899:0.137
C:P04908:0.068
DT
DA
DG
DG
DT
DA
DA
DA
DC
6.051
4.632
6.272
8.538
5.527
5.203
8.087
9.918
7.614
O
O
O
OE2
OE2
OE2
CB
CD
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP1
O3'
OP1
GLU M:42 M:41 188.0 0.989 S -55.6 -49.3 140.0 0.737 0.252 Q:P04908:0.079
N:P06899:0.179
DG
DT
DA
DG
DG
DG
DA
DC
8.836
6.397
4.209
7.539
8.348
6.324
4.666
6.348
OE2
OE2
OE2
CB
OE2
O
O
O
O3'
O3'
OP1
OP1
OP1
O3'
C5'
OP1
GLU Q:42 Q:41 191.0 1.0 S -56.8 -48.9 144.0 0.758 0.242 M:P04908:0.084
R:P06899:0.163
DT
DA
DG
DG
DT
DA
DA
DC
DC
6.088
4.534
6.497
9.183
5.496
4.628
7.716
7.700
9.911
O
O
O
OE2
OE2
OE2
CB
OE2
OE2
O3'
OP1
OP2
N2
O3'
OP1
OP1
OP1
OP2
6la9 3 P04908 98.46 4e-89 X-RAY
2020-10-07 GLU C:42 C:41 197.0 1.0 S -60.6 -52.9 146.0 0.768 0.232 D:P06899:0.079
G:P04908:0.189
DT
DA
DG
DA
DG
DG
DA
DC
CA
CA
CA
HOH
9.377
7.128
8.068
8.530
6.327
5.939
4.182
6.554
4.107
8.535
6.448
3.224
CB
CB
CB
OE1
OE1
O
O
O
OE2
OE2
OE1
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
CA
CA
CA
O
GLU G:42 G:41 189.0 0.995 S -60.1 -54.0 140.0 0.737 0.258 H:P06899:0.184
C:P04908:0.074
DT
DA
DG
DG
DT
DA
DA
DC
DC
CA
CA
CA
HOH
6.055
4.172
6.201
8.696
4.938
4.853
7.172
8.297
9.855
4.854
2.565
6.321
7.138
O
O
O
OE2
OE2
OE1
OE1
OE2
OE2
CB
OE2
OE2
CB
O3'
OP1
OP1
O3'
O3'
C5'
OP1
OP1
OP2
CA
CA
CA
O
GLU M:42 M:41 192.0 1.0 S -59.8 -53.5 156.0 0.821 0.179 Q:P04908:0.074
N:P06899:0.116
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.410
7.040
4.823
7.663
8.819
6.793
9.421
6.404
4.468
6.423
OE2
OE2
OE2
CB
OE1
OE1
OE2
O
O
O
O3'
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU Q:42 Q:41 188.0 0.989 S -58.8 -53.9 146.0 0.768 0.221 M:P04908:0.079
R:P06899:0.147
DT
DA
DG
DG
DT
DA
DA
DC
DC
5.997
4.812
6.513
8.962
5.118
4.393
7.580
7.887
9.868
O
O
O
OE2
OE2
OE2
OE1
OE2
OE2
O3'
C5'
OP1
O3'
O3'
OP1
OP2
OP1
OP2
6lab 3 P04908 98.46 4e-89 X-RAY
2021-02-17 GLU C:42 C:41 182.0 0.958 S -67.4 -44.6 137.0 0.721 0.237 D:P06899:0.163
G:P04908:0.074
DG
DT
DA
DG
DC
DG
DA
DC
K
9.310
6.895
4.978
7.700
7.965
5.929
4.443
6.481
9.342
OE2
OE2
OE2
OE1
OE2
O
O
O
N
O3'
C4'
OP1
OP2
OP1
O3'
OP1
OP2
K
GLU G:42 G:41 181.0 0.953 S -78.5 -38.0 157.0 0.826 0.127 C:P04908:0.042
H:P06899:0.084
DG
DA
DC
DG
DT
DA
DG
DA
DC
DC
K
5.817
4.090
5.730
9.703
7.078
5.256
8.406
7.934
5.952
9.515
9.634
O
O
O
OE2
OE2
OE2
OE2
OE1
OE1
OE1
N
O3'
C5'
OP2
O3'
C5'
OP1
OP2
O3'
OP1
OP2
K
GLU M:42 M:41 185.0 0.974 S -68.3 -45.5 149.0 0.784 0.19 Q:P04908:0.047
N:P06899:0.142
DG
DT
DA
DG
DC
DG
DA
DC
K
9.391
7.025
5.092
7.558
8.173
5.729
4.151
6.467
9.415
OE2
OE2
OE2
OE1
CG
O
O
O
N
O3'
C4'
C5'
OP2
OP1
O3'
OP1
OP2
K
GLU Q:42 Q:41 188.0 0.989 S -68.8 -40.4 152.0 0.8 0.189 M:P04908:0.047
R:P06899:0.137
DG
DA
DC
DG
DT
DA
DG
DC
K
5.909
4.279
6.334
9.153
6.692
4.571
8.315
8.528
9.550
O
O
O
OE2
OE2
OE2
OE1
OE2
N
O3'
C5'
OP2
O3'
C4'
OP1
OP2
OP1
K
6ler 3 P04908 98.46 4e-89 X-RAY
2021-03-03 GLU C:42 M:41 190.0 1.0 S -60.3 -53.3 NA NA NA
GLU G:42 Q:41 188.0 0.989 S -68.4 -30.0 NA NA NA
GLU M:42 C:41 188.0 0.989 S -52.5 -55.2 139.0 0.732 0.257 N:P06899:0.179
Q:P04908:0.074
DG
DT
DA
DG
DG
DG
DA
DC
8.831
6.231
4.235
6.762
8.316
5.960
4.495
6.598
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C4'
OP1
OP2
OP1
O3'
OP1
OP2
GLU Q:42 G:41 190.0 1.0 S -44.6 -59.9 148.0 0.779 0.221 M:P04908:0.068
R:P06899:0.153
DT
DA
DG
DG
DT
DA
DA
DC
DC
6.049
4.369
6.562
9.046
6.527
4.260
7.073
7.796
9.950
O
O
O
OE2
OE2
OE2
OE1
OE2
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
OP2
6m3v 3 P04908 98.46 4e-89 X-RAY
2020-10-07 GLU C:42 C:41 181.0 0.953 S -78.3 -44.1 146.0 0.768 0.185 D:P06899:0.126
G:P04908:0.063
DT
DA
DG
DG
DT
DA
DA
DA
DC
DC
4.900
3.338
6.965
9.571
6.478
5.006
7.675
8.967
6.958
8.962
O
O
O
OE2
OE2
OE2
CB
OE2
OE2
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP1
O3'
OP1
OP2
GLU G:42 G:41 178.0 0.937 S -77.0 -44.3 137.0 0.721 0.216 C:P04908:0.053
H:P06899:0.158
DG
DT
DA
DG
DA
DG
DG
DA
DC
8.878
5.558
4.689
8.594
9.495
7.127
6.117
4.042
6.202
OE2
OE2
OE2
OE1
OE2
OE2
O
O
O
O3'
O3'
OP1
P
O3'
OP1
O3'
C5'
OP2
GLU M:42 M:41 176.0 0.926 S -78.0 -44.4 146.0 0.768 0.158 Q:P04908:0.037
N:P06899:0.121
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.518
6.092
4.351
8.177
9.338
6.920
9.672
5.965
3.806
5.573
OE2
OE2
OE1
OE1
OE2
OE2
OE2
O
O
OE2
O3'
C5'
OP1
P
O3'
OP1
OP2
O3'
C5'
OP1
GLU Q:42 Q:41 177.0 0.932 S -78.2 -43.8 146.0 0.768 0.164 M:P04908:0.037
R:P06899:0.126
DT
DA
DG
DG
DT
DA
DA
DA
DC
DC
4.962
4.007
6.034
9.201
5.628
4.842
7.798
8.947
6.853
8.827
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
OE2
O3'
C5'
OP1
O3'
O3'
C5'
OP1
O3'
OP1
OP2
6m44 3 P04908 98.46 4e-89 X-RAY
2020-10-07 GLU C:42 C:41 191.0 1.0 S -52.0 -46.9 151.0 0.795 0.205 D:P06899:0.158
G:P04908:0.053
DT
DA
DG
DG
DT
DA
DA
DA
DC
DC
4.412
3.176
7.039
9.780
6.673
4.680
7.390
8.862
6.427
8.425
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
OP2
GLU G:42 G:41 185.0 0.974 S -53.7 -46.3 146.0 0.768 0.206 H:P06899:0.137
C:P04908:0.068
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.766
5.576
4.951
8.371
7.913
5.647
9.092
6.033
3.897
5.732
OE2
OE1
OE1
OE1
OE2
OE2
OE2
O
O
O
O3'
O3'
C5'
OP2
O3'
OP1
OP2
O3'
C5'
OP1
GLU M:42 M:41 178.0 0.937 S -53.2 -46.3 138.0 0.726 0.211 Q:P04908:0.063
N:P06899:0.147
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.894
6.628
4.977
7.748
9.885
7.673
9.815
6.272
4.385
6.350
OE2
OE2
OE1
OE1
OE2
OE2
OE2
O
O
O
N2
C5'
C5'
OP2
O3'
OP1
OP2
O3'
C5'
OP2
GLU Q:42 Q:41 185.0 0.974 S -53.0 -47.0 142.0 0.747 0.227 R:P06899:0.168
M:P04908:0.058
DT
DA
DG
DG
DT
DA
DA
DC
5.641
4.056
6.205
8.340
5.565
4.429
7.423
8.220
O
O
OE2
OE2
OE2
OE1
OE1
OE2
O3'
C5'
OP1
O3'
O3'
C5'
OP1
OP1
6o1d 3 P04908 98.46 4e-89 EM
2019-05-22 GLU C:42 C:41 191.0 1.0 S -67.8 -63.7 138.0 0.726 0.274 G:P04908:0.158
D:P06899:0.121
DA
DT
DG
DC
DT
DC
DC
6.567
4.720
7.077
9.278
7.448
7.855
9.207
O
O
O
OE1
CB
CB
OE2
O3'
OP1
OP1
O5'
C5'
OP1
OP1
GLU G:42 G:41 183.0 0.963 S -75.5 -61.3 142.0 0.747 0.216 H:P06899:0.132
C:P04908:0.079
DT
DT
DT
DG
DG
DT
DA
DC
8.964
6.422
4.548
8.130
9.647
6.266
4.414
6.942
OE2
OE2
OE2
OE1
OE2
O
O
OE2
O3'
C5'
OP1
OP2
OP1
O3'
OP1
OP1
6v92 25 P04908 98.46 4e-89 EM
2020-01-15 GLU DA:42 c:41 191.0 1.0 S -62.8 -35.3 158.0 0.832 0.168 EA:O60814:0.095
HA:P04908:0.074
DT
DT
DG
DT
DA
DT
DA
DC
6.624
5.552
9.334
9.979
8.345
6.178
4.461
5.409
CG
CG
CB
OE2
OE2
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU HA:42 g:41 188.0 0.989 S -57.9 -33.6 145.0 0.763 0.226 DA:P04908:0.089
IA:O60814:0.137
DA
DT
DA
DT
DT
DG
DG
DC
5.821
4.086
6.633
9.278
6.903
4.483
6.932
7.857
O
O
OE1
OE1
OE2
OE2
OE2
OE1
O3'
OP1
OP1
O3'
O3'
C5'
OP2
OP1
7by0 3 P04908 98.46 4e-89 EM
2021-02-10 GLU C:42 C:41 149.0 0.784 S -97.3 -50.4 122.0 0.642 0.142 G:P04908:0.095
D:P06899:0.042
DA
DG
DA
DG
DG
DA
DC
8.344
8.895
9.934
8.030
5.056
3.107
6.957
CG
C
OE1
OE1
O
O
OE2
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:42 G:41 154.0 0.811 S -82.3 -31.3 107.0 0.563 0.248 C:P04908:0.068
H:P06899:0.179
DT
DA
DG
DG
DG
DG
DC
7.937
4.299
4.588
9.523
5.582
4.948
9.907
O
O
O
OE2
OE2
OE2
CB
O3'
O3'
OP1
O3'
O3'
OP1
OP1
7dbp 4 P04908 98.46 4e-89 EM
2020-12-23 GLU D:42 C:41 199.0 1.0 S -75.7 -31.1 168.0 0.884 0.116 H:P04908:0.132
E:O60814:0.026
DG
DT
DA
DA
DA
DC
DC
9.032
7.086
8.891
9.086
5.554
3.262
6.809
OE1
OE1
C
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
GLU H:42 G:41 201.0 1.0 S -75.7 -31.1 175.0 0.921 0.079 D:P04908:0.126
I:O60814:0.011
DC
DT
DA
DG
DA
DG
DC
5.106
2.895
6.803
9.505
7.351
8.785
8.709
O
O
O
OE1
OE1
C
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP1
7k5x 3 P04908 98.46 4e-89 EM
2020-11-25 GLU C:42 C:41 167.0 0.879 S -77.2 -18.7 115.0 0.605 0.274 D:P06899:0.184
G:P04908:0.089
DT
DA
DG
DG
DG
DA
DC
5.823
4.147
6.396
6.794
4.252
6.022
9.762
O
O
O
OE2
OE2
OE2
OE1
O3'
C5'
OP2
O3'
C5'
OP1
OP1
GLU G:42 G:41 189.0 0.995 S -66.7 -39.8 147.0 0.774 0.221 C:P04908:0.068
H:P06899:0.147
DT
DA
DG
DG
DG
DA
DC
7.289
5.022
7.634
8.050
5.651
4.065
6.725
OE2
OE2
OE1
OE2
O
O
O
C5'
OP1
OP1
OP1
O3'
OP1
OP2
7k5y 3 P04908 98.46 4e-89 EM
2020-11-25 GLU C:42 C:41 192.0 1.0 S -68.6 -32.8 146.0 0.768 0.232 D:P06899:0.084
G:P04908:0.158
DT
DA
DG
DG
DG
DA
DA
DC
5.907
4.094
6.328
9.493
7.001
7.960
8.750
7.134
O
O
O
CB
CB
CB
OE1
OE1
O3'
C5'
OP2
O3'
C5'
OP1
O3'
OP1
GLU G:42 G:41 190.0 1.0 S -72.0 -33.3 152.0 0.8 0.2 H:P06899:0.126
C:P04908:0.079
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.961
7.375
5.297
7.934
9.605
7.287
9.472
5.639
4.111
6.199
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP2
O3'
C5'
OP2
7k60 3 P04908 98.46 4e-89 EM
2020-11-25 GLU C:42 C:41 181.0 0.953 S -62.4 -47.5 136.0 0.716 0.237 D:P06899:0.179
G:P04908:0.058
DT
DA
DG
DG
DG
DG
DA
DC
5.924
4.490
6.581
9.326
5.831
4.011
6.632
8.809
O
O
O
OE2
OE2
OE1
OE1
OE2
O3'
C5'
OP2
O3'
O3'
C5'
OP1
OP1
GLU G:42 G:41 186.0 0.979 S -72.3 -46.4 148.0 0.779 0.2 H:P06899:0.137
C:P04908:0.063
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.391
7.183
5.298
7.960
9.555
7.190
9.957
5.211
3.559
6.360
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP2
7k61 3 P04908 98.46 4e-89 EM
2020-11-25 GLU C:42 C:41 183.0 0.963 S -65.0 -42.3 131.0 0.689 0.274 G:P04908:0.079
D:P06899:0.195
DT
DA
DG
DG
DG
DG
DA
DC
5.577
4.231
6.645
9.352
6.226
4.009
6.704
8.164
O
O
O
OE2
OE2
OE2
OE1
OE2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
OP1
GLU G:42 G:41 184.0 0.968 S -66.4 -39.3 140.0 0.737 0.231 H:P06899:0.168
C:P04908:0.063
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.427
6.746
4.491
7.264
9.914
7.611
9.890
5.447
4.062
6.594
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
O
O3'
C4'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP2
7k63 3 P04908 98.46 4e-89 EM
2020-11-25 GLU C:42 C:41 185.0 0.974 S -61.8 -39.5 137.0 0.721 0.253 D:P06899:0.174
G:P04908:0.079
DT
DA
DG
DG
DG
DG
DA
DC
5.703
4.299
6.627
9.355
6.083
4.047
6.994
8.106
O
O
O
OE2
OE2
OE2
OE1
OE2
O3'
C5'
OP2
O3'
O3'
OP1
OP1
OP1
GLU G:42 G:41 193.0 1.0 S -67.9 -33.3 122.0 0.642 0.358 H:P06899:0.147
C:P04908:0.226
DT
DA
DG
DA
DG
DG
DA
DC
9.279
6.745
7.355
9.207
7.499
5.228
3.829
6.713
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
7nl0 3 P04908 98.46 4e-89 EM
2021-08-11 GLU C:42 C:41 172.0 0.905 S -77.8 -57.8 120.0 0.632 0.273 D:P06899:0.158
G:P04908:0.121
DC
DT
DT
DC
DT
DC
DC
8.978
6.766
7.361
9.569
5.710
3.864
7.183
CB
CB
OE2
CG
O
O
O
O3'
OP1
OP1
OP2
O3'
OP1
OP1
GLU G:42 G:41 172.0 0.905 S -80.7 18.5 134.0 0.705 0.2 H:P06899:0.126
C:P04908:0.074
DC
DT
DC
DG
DA
DT
DC
5.698
4.219
5.820
6.122
4.357
7.163
8.999
O
O
O
OE2
OE2
OE2
OE1
O3'
OP1
OP2
O3'
C5'
OP1
OP1
3a6n 3 P04908 98.46 5e-89 X-RAY
2010-05-26 GLU C:45 C:41 195.0 1.0 S -56.2 -54.9 152.0 0.8 0.2 D:P06899:0.1
G:P04908:0.126
DT
DT
DG
DT
DA
DT
DA
DC
HOH
8.339
6.625
8.227
8.989
6.884
6.373
4.516
6.499
5.646
CB
CB
CB
OE2
OE2
O
O
O
N
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU G:45 G:41 182.0 0.958 S -61.8 -40.8 141.0 0.742 0.216 C:P04908:0.084
H:P06899:0.137
DA
DT
DA
DT
DT
DG
DG
DC
HOH
5.712
4.215
5.968
8.594
5.535
3.746
7.559
8.935
2.896
O
O
OE1
OE1
OE2
OE2
OE2
OE1
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP1
O
3afa 3 P04908 98.46 5e-89 X-RAY
2010-05-26 GLU C:45 C:41 194.0 1.0 S -59.9 -49.6 150.0 0.789 0.211 D:P06899:0.105
G:P04908:0.126
DT
DT
DG
DT
DA
DT
DA
DC
HOH
7.660
6.144
8.320
8.855
6.849
6.404
4.583
6.225
2.936
CG
CG
CB
OE2
OE2
O
O
O
N
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU G:45 G:41 188.0 0.989 S -68.7 -39.6 144.0 0.758 0.231 C:P04908:0.074
H:P06899:0.158
DA
DT
DA
DT
DT
DG
DG
DC
MN
HOH
5.876
4.260
6.911
8.569
6.083
4.054
6.485
9.040
9.911
6.271
O
O
O
OE1
OE1
OE1
OE2
OE1
OE1
CA
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP1
MN
O
3an2 3 P04908 98.46 5e-89 X-RAY
2011-07-20 GLU C:45 C:41 198.0 1.0 S -125.6 -8.0 135.0 0.711 0.289 D:P06899:0.063
G:P04908:0.279
DA
DG
DA
DC
DA
DT
DG
DC
DA
8.476
7.324
9.949
8.147
6.276
9.929
5.969
4.613
5.462
O
OE1
C
OE2
OE1
OE1
O
O
O
O3'
OP1
OP1
OP1
OP1
OP2
O3'
C5'
OP2
GLU G:45 G:41 163.0 0.858 S -101.5 -35.5 122.0 0.642 0.216 H:P06899:0.089
C:P04908:0.137
DG
DC
DA
DT
DA
DG
DA
DA
5.161
3.378
5.041
9.567
6.525
4.838
8.734
8.205
O
O
OE1
OE2
OE2
OE2
OE2
OE1
O3'
OP1
OP1
O3'
O3'
C5'
P
OP1
3av1 3 P04908 98.46 5e-89 X-RAY
2011-06-01 GLU C:45 C:41 192.0 1.0 S -76.4 -34.4 139.0 0.732 0.268 G:P04908:0.195
D:P06899:0.084
DT
DT
DG
DT
DA
DT
DA
DC
HOH
8.499
7.073
8.649
9.227
7.380
6.008
4.140
6.621
2.888
CB
CB
N
OE2
OE2
O
O
O
N
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU G:45 G:41 193.0 1.0 S -63.3 -38.2 148.0 0.779 0.221 H:P06899:0.168
C:P04908:0.074
DA
DT
DA
DT
DT
DG
DG
DC
HOH
5.824
4.362
6.634
8.572
5.666
4.046
6.817
9.174
5.544
O
O
O
OE1
OE1
OE1
OE2
OE1
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP1
O
3av2 3 P04908 98.46 5e-89 X-RAY
2011-06-01 GLU C:45 C:41 197.0 1.0 S -54.2 -61.3 158.0 0.832 0.168 G:P04908:0.105
D:P06899:0.105
DT
DT
DG
DT
DA
DT
DA
DC
7.703
6.576
8.087
8.652
6.490
6.685
4.801
6.221
CG
CG
CB
OE2
OE2
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 184.0 0.968 S -69.0 -45.9 137.0 0.721 0.247 H:P06899:0.179
C:P04908:0.068
DA
DT
DA
DT
DT
DG
DG
DC
HOH
5.975
4.344
6.937
8.473
6.256
4.055
6.160
9.275
9.839
O
O
O
OE1
OE1
OE1
OE2
OE1
OE1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP1
O
3ayw 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 185.0 0.974 S -64.0 -45.4 119.0 0.626 0.348 D:P06899:0.084
G:P04908:0.263
DT
DT
DG
DT
DA
DT
DA
DC
8.067
7.054
8.692
9.174
7.877
6.249
4.310
6.376
CB
CB
CB
OE1
OE1
O
O
O
O3'
OP1
OP2
O3'
OP2
O3'
OP1
OP2
GLU G:45 G:41 173.0 0.911 S -72.5 -45.6 134.0 0.705 0.206 H:P06899:0.147
C:P04908:0.058
DA
DT
DA
DT
DT
DG
DG
DC
MN
5.685
4.200
6.399
7.981
5.774
3.848
6.889
8.553
9.578
O
O
OE1
OE1
OE1
OE2
OE2
OE1
OE2
O3'
OP1
OP1
O3'
C4'
C5'
OP2
OP1
MN
3aze 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 182.0 0.958 S -60.7 -28.8 137.0 0.721 0.237 G:P04908:0.111
D:P06899:0.126
DT
DT
DG
DT
DA
DT
DA
DC
6.858
5.571
6.945
9.691
7.504
6.804
4.756
6.420
CG
CG
CB
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 187.0 0.984 S -69.2 -46.0 143.0 0.753 0.231 H:P06899:0.116
C:P04908:0.116
DA
DT
DA
DT
DG
DG
DA
DC
6.007
4.559
6.801
7.200
5.500
7.683
9.944
7.714
O
O
O
CG
CG
CB
OE2
OE2
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP2
3azf 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 189.0 0.995 S -60.8 -39.9 140.0 0.737 0.258 G:P04908:0.158
D:P06899:0.1
DT
DT
DG
DT
DA
DT
DA
DC
HOH
8.011
6.286
8.213
8.861
7.122
6.144
3.963
6.245
5.507
CG
CG
CB
OE2
OE2
O
O
O
N
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
O
GLU G:45 G:41 186.0 0.979 S -69.2 -35.1 140.0 0.737 0.242 H:P06899:0.163
C:P04908:0.079
DA
DT
DA
DT
DT
DG
DG
DC
HOH
5.992
4.190
7.163
8.920
6.183
4.096
6.968
9.454
3.929
O
O
O
OE1
OE1
OE1
OE2
OE1
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP2
O
3azg 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 194.0 1.0 S -69.3 -43.7 147.0 0.774 0.226 D:P06899:0.1
G:P04908:0.147
DT
DT
DG
DT
DA
DT
DA
DC
7.311
6.686
8.113
8.654
7.250
6.124
4.370
6.004
CG
CG
CB
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 189.0 0.995 S -66.7 -40.4 148.0 0.779 0.216 C:P04908:0.074
H:P06899:0.142
DA
DT
DA
DT
DT
DG
DG
DC
5.933
4.332
6.903
8.577
6.077
4.022
6.996
8.830
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP2
3azh 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 185.0 0.974 S -55.1 -63.1 123.0 0.647 0.327 D:P06899:0.1
G:P04908:0.226
DT
DT
DG
DA
DT
DA
DC
8.305
6.391
8.206
9.281
6.392
4.263
6.042
CB
CB
CB
OE1
O
O
O
O3'
OP1
OP1
OP2
O3'
OP1
OP2
GLU G:45 G:41 188.0 0.989 S -77.5 -47.3 152.0 0.8 0.189 H:P06899:0.111
C:P04908:0.074
DA
DT
DA
DT
DT
DG
DG
DA
DC
6.020
3.952
7.230
9.152
6.428
4.354
8.232
9.830
7.356
O
O
O
OE2
OE2
OE2
OE2
OE1
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP2
O3'
OP2
3azi 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 182.0 0.958 S -70.6 -28.7 144.0 0.758 0.2 D:P06899:0.1
G:P04908:0.1
DT
DT
DG
DT
DA
DT
DA
DC
8.885
6.796
7.989
9.410
7.083
6.192
4.384
5.707
CG
CG
CB
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 185.0 0.974 S -54.8 -34.8 133.0 0.7 0.274 H:P06899:0.184
C:P04908:0.084
DA
DT
DA
DT
DT
DG
DG
DC
6.026
4.719
6.203
8.332
5.481
3.754
5.642
9.583
O
O
O
OE1
OE1
OE1
OE2
CG
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP2
3azj 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 196.0 1.0 S -56.2 -52.0 142.0 0.747 0.253 D:P06899:0.116
G:P04908:0.168
DT
DT
DG
DT
DA
DT
DA
DC
7.914
6.702
7.948
9.025
7.743
6.278
4.207
6.423
CG
CG
CB
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 184.0 0.968 S -71.0 -44.0 137.0 0.721 0.247 H:P06899:0.158
C:P04908:0.095
DA
DT
DA
DT
DT
DG
DG
DC
5.841
4.073
6.832
8.598
6.707
4.513
6.916
8.202
O
O
O
OE1
OE2
OE2
OE2
OE1
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP1
3azk 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 184.0 0.968 S -94.7 -34.8 136.0 0.716 0.252 G:P04908:0.158
D:P06899:0.089
DT
DT
DG
DA
DT
DA
DC
7.993
7.169
8.239
8.337
6.198
4.332
6.388
CG
CB
N
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
GLU G:45 G:41 181.0 0.953 S -91.0 -47.2 137.0 0.721 0.232 H:P06899:0.158
C:P04908:0.074
DA
DT
DA
DT
DT
DG
DG
DC
6.027
4.434
6.590
8.800
6.354
4.372
6.917
8.841
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
3azl 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 188.0 0.989 S -63.2 -48.6 139.0 0.732 0.257 D:P06899:0.111
G:P04908:0.153
DT
DT
DG
DT
DA
DT
DA
DC
HOH
7.234
6.572
8.052
8.912
7.295
6.283
4.490
6.456
5.128
CG
CG
CB
OE2
OE2
O
O
O
N
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU G:45 G:41 187.0 0.984 S -74.2 -37.7 142.0 0.747 0.237 H:P06899:0.158
C:P04908:0.079
DA
DT
DA
DT
DT
DG
DG
DC
HOH
5.825
4.264
6.997
8.921
6.436
4.224
6.949
8.884
5.484
O
O
O
OE1
OE1
OE1
OE2
OE1
N
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP2
O
3azm 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 179.0 0.942 S -59.5 -56.3 128.0 0.674 0.268 D:P06899:0.126
G:P04908:0.137
DT
DT
DG
DT
DA
DT
DA
DC
7.989
5.853
7.178
9.245
7.015
6.274
4.698
6.634
CG
CG
CB
OE2
OE2
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 163.0 0.858 S -50.9 -46.5 119.0 0.626 0.232 H:P06899:0.126
C:P04908:0.1
DA
DT
DA
DT
DT
DG
DG
DC
5.506
4.424
5.399
8.713
6.300
4.552
7.264
8.628
OE2
O
OE1
OE1
OE1
OE2
OE2
OE1
O3'
OP1
OP1
O3'
C4'
C5'
OP1
OP1
3azn 3 P04908 98.46 5e-89 X-RAY
2011-09-21 GLU C:45 C:41 191.0 1.0 S -54.7 -60.7 145.0 0.763 0.237 G:P04908:0.147
D:P06899:0.095
DT
DT
DG
DT
DA
DT
DA
DC
7.935
6.359
8.340
9.133
7.082
6.364
4.605
6.433
CG
CG
CB
OE2
OE2
O
O
O
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 187.0 0.984 S -72.6 -42.3 147.0 0.774 0.21 H:P06899:0.147
C:P04908:0.058
DA
DT
DA
DT
DT
DG
DG
DC
5.825
4.162
6.659
8.715
6.694
4.777
7.194
8.278
O
O
O
OE1
OE1
OE2
OE2
OE1
O3'
OP1
OP1
O3'
C4'
OP1
OP2
OP1
3w97 3 P04908 98.46 5e-89 X-RAY
2013-08-28 GLU C:45 C:41 184.0 0.968 S -70.4 -46.9 150.0 0.789 0.179 D:P06899:0.084
G:P04908:0.095
DT
DT
DG
DT
DA
DT
DA
DC
8.138
6.938
8.602
9.318
6.903
6.416
4.658
5.975
CG
CG
CB
OE1
OE1
O
O
OE1
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 200.0 1.0 S -73.2 -31.6 160.0 0.842 0.158 H:P06899:0.132
C:P04908:0.074
DA
DT
DA
DT
DT
DG
DG
DA
DC
5.982
4.500
6.238
9.988
6.876
5.338
8.429
9.719
7.502
O
O
O
OE1
OE2
OE2
OE2
OE1
OE1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP2
3w98 3 P04908 98.46 5e-89 X-RAY
2013-08-28 GLU C:45 C:41 182.0 0.958 S -83.5 -37.5 148.0 0.779 0.179 D:P06899:0.105
G:P04908:0.074
DT
DT
DG
DT
DA
DT
DA
DC
7.585
5.799
8.195
9.154
7.004
5.868
4.095
5.437
CG
CG
CB
OE1
OE1
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 179.0 0.942 S -65.3 -49.3 129.0 0.679 0.263 H:P06899:0.147
C:P04908:0.116
DA
DT
DA
DT
DT
DG
DG
DC
6.028
4.506
6.920
9.403
7.334
4.930
7.783
8.563
O
O
O
OE1
OE1
OE1
CG
OE2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP2
3w99 3 P04908 98.46 5e-89 X-RAY
2013-08-28 GLU C:45 C:41 203.0 1.0 S -57.7 -39.3 156.0 0.821 0.179 D:P06899:0.105
G:P04908:0.142
DT
DT
DG
DT
DA
DC
DT
DA
DC
8.012
6.505
8.273
9.106
6.755
9.982
6.443
4.513
6.294
OE1
OE1
CB
OE1
OE1
OE1
O
O
OE1
OP1
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU G:45 G:41 189.0 0.995 S -53.8 -47.3 127.0 0.668 0.327 H:P06899:0.137
C:P04908:0.189
DA
DT
DA
DT
DG
DG
DA
DC
5.905
4.482
6.073
8.292
6.034
8.157
9.545
7.542
O
O
OE1
CG
CG
CB
OE1
OE1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
3wkj 3 P04908 98.46 5e-89 X-RAY
2014-04-09 GLU C:45 C:41 197.0 1.0 S -48.6 -66.0 142.0 0.747 0.253 D:Q96A08:0.137
G:P04908:0.158
DT
DT
DG
DT
DA
DT
DA
DC
7.513
5.326
7.345
9.111
7.061
6.608
4.801
6.552
CG
CG
CB
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 187.0 0.984 S -60.9 -46.9 139.0 0.732 0.252 H:Q96A08:0.189
C:P04908:0.063
DA
DT
DA
DT
DT
DG
DG
DC
5.454
4.199
6.667
7.895
5.975
3.584
6.332
9.171
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP1
O3'
O5'
OP1
OP2
OP1
3wtp 3 P04908 98.46 5e-89 X-RAY
2014-12-03 GLU C:45 C:41 187.0 0.984 S -65.5 -34.3 154.0 0.811 0.173 D:P06899:0.095
G:P04908:0.079
DT
DT
DG
DT
DA
DT
DA
DC
7.006
5.612
8.224
9.506
8.152
5.928
4.157
5.856
CG
CG
CB
OE2
OE2
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 189.0 0.995 S -62.3 -36.4 141.0 0.742 0.253 C:P04908:0.095
H:P06899:0.163
DA
DT
DA
DT
DT
DG
DG
DC
5.790
4.105
7.281
9.785
6.239
4.060
7.162
8.458
O
O
O
OE1
OE1
OE1
OE1
OE2
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP1
4ym5 3 P04908 98.46 5e-89 X-RAY
2015-12-02 GLU C:45 C:41 195.0 1.0 S -57.3 -49.0 144.0 0.758 0.242 D:P06899:0.116
G:P04908:0.153
DT
DT
DT
DG
DA
DC
DT
DA
DC
9.803
7.243
5.315
8.094
9.421
7.688
5.982
4.193
5.961
OE1
OE1
OE1
OE1
OE2
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP2
O3'
OP1
OP2
GLU G:45 G:41 184.0 0.968 S -59.6 -50.2 138.0 0.726 0.242 H:P06899:0.111
C:P04908:0.137
DT
DA
DC
DT
DT
DG
DA
DC
5.765
3.786
6.769
7.663
5.709
8.137
9.290
7.344
O
O
O
OE1
OE1
OE1
OE2
OE2
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
4ym6 3 P04908 98.46 5e-89 X-RAY
2015-12-02 GLU C:45 C:41 189.0 0.995 S -61.3 -53.0 148.0 0.779 0.216 D:P06899:0.137
G:P04908:0.079
DT
DT
DT
DG
DT
DA
DC
DT
DA
DC
9.801
5.938
4.092
7.538
9.285
7.143
9.954
5.943
4.397
5.651
OE2
OE2
OE2
OE2
OE1
OE1
OE1
O
O
O
O3'
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP2
GLU G:45 G:41 188.0 0.989 S -64.9 -51.8 147.0 0.774 0.215 H:P06899:0.142
C:P04908:0.074
DA
DT
DA
DT
DG
DG
DA
DC
6.045
4.441
6.713
6.912
4.667
8.017
9.735
7.272
O
O
O
OE2
OE2
OE2
OE1
OE1
O3'
OP1
OP1
O3'
OP1
P
O3'
OP2
4z5t 3 P04908 98.46 5e-89 X-RAY
2016-02-10 GLU C:45 C:41 187.0 0.984 S -57.8 -41.5 128.0 0.674 0.31 D:P06899:0.079
G:P04908:0.226
DT
DT
DG
DT
DA
DT
DA
DC
8.134
6.881
8.299
9.324
7.738
5.756
3.926
5.375
CB
CB
CB
OE2
OE1
O
O
OE1
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 195.0 1.0 S -58.5 -42.8 110.0 0.579 0.421 H:P06899:0.116
C:P04908:0.337
DA
DT
DA
DT
DG
DG
DA
DC
6.146
4.488
6.786
9.059
6.881
7.436
9.054
7.032
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
5av5 3 P04908 98.46 5e-89 X-RAY
2015-12-23 GLU C:45 C:41 182.0 0.958 S -64.9 -43.5 141.0 0.742 0.216 D:P06899:0.142
G:P04908:0.079
DT
DT
DG
DG
DA
DA
DT
DA
HOH
9.127
6.809
4.847
7.603
9.244
6.020
4.136
7.043
3.824
OE2
OE2
OE2
OE1
OE2
O
O
O
O
O3'
O3'
OP1
OP2
OP1
O3'
OP1
OP2
O
GLU G:45 G:41 180.0 0.947 S -67.7 -41.6 134.0 0.705 0.242 C:P04908:0.084
H:P06899:0.153
DA
DT
DA
DT
DT
DG
DG
DA
HOH
5.975
4.200
6.903
8.715
6.143
4.442
6.912
9.785
8.858
O
O
O
OE2
OE2
OE2
OE1
OE2
CB
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
O
5av6 3 P04908 98.46 5e-89 X-RAY
2015-12-23 GLU C:45 C:41 175.0 0.921 S -64.9 -41.5 136.0 0.716 0.205 G:P04908:0.074
D:P06899:0.137
DT
DT
DG
DG
DA
DA
DT
DA
HOH
9.161
6.473
4.461
7.489
9.674
6.161
4.376
7.039
5.103
OE2
OE2
OE2
OE1
CG
O
O
O
N
O3'
O3'
OP1
OP2
OP1
O3'
OP1
OP2
O
GLU G:45 G:41 183.0 0.963 S -63.3 -44.1 137.0 0.721 0.242 C:P04908:0.089
H:P06899:0.153
DA
DT
DA
DT
DT
DG
DG
DA
HOH
5.949
4.264
7.072
8.820
6.213
4.329
7.071
9.789
2.985
O
O
O
OE2
OE2
OE2
OE1
OE2
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
O
5av8 3 P04908 98.46 5e-89 X-RAY
2015-12-23 GLU C:45 C:41 176.0 0.926 S -64.7 -41.1 135.0 0.711 0.215 D:P06899:0.142
G:P04908:0.079
DT
DT
DG
DG
DA
DA
DT
DA
HOH
9.309
6.367
4.309
7.362
9.401
6.048
4.272
7.012
2.910
OE2
OE2
OE2
OE2
OE1
O
O
O
N
O3'
O3'
C5'
OP2
OP2
O3'
OP1
OP2
O
GLU G:45 G:41 181.0 0.953 S -65.0 -40.0 135.0 0.711 0.242 C:P04908:0.089
H:P06899:0.153
DA
DT
DA
DT
DT
DG
DG
DA
HOH
5.937
4.248
7.130
8.757
6.366
4.333
7.155
9.598
9.355
O
O
O
OE2
OE2
OE2
OE1
OE2
N
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
O
5av9 3 P04908 98.46 5e-89 X-RAY
2015-12-23 GLU C:45 C:41 179.0 0.942 S -62.3 -41.7 137.0 0.721 0.221 D:P06899:0.137
G:P04908:0.084
DT
DT
DG
DG
DA
DA
DT
DA
HOH
9.215
6.461
4.496
7.505
9.723
6.116
4.320
7.057
5.078
OE2
OE2
OE2
OE1
OE1
O
O
O
N
O3'
O3'
OP1
OP2
OP2
O3'
OP1
OP2
O
GLU G:45 G:41 183.0 0.963 S -62.2 -44.0 137.0 0.721 0.242 H:P06899:0.153
C:P04908:0.095
DA
DT
DA
DT
DT
DG
DG
DA
HOH
5.954
4.265
7.028
8.865
6.383
4.336
7.190
9.517
6.660
O
O
O
OE2
OE2
OE2
OE1
OE2
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
O
5avb 3 P04908 98.46 5e-89 X-RAY
2015-12-23 GLU C:45 C:41 187.0 0.984 S -63.1 -46.9 146.0 0.768 0.216 D:P06899:0.132
G:P04908:0.089
DT
DT
DG
DG
DA
DA
DT
DA
HOH
9.286
6.900
4.911
7.770
9.034
6.116
4.229
7.060
3.916
OE2
OE2
OE2
OE2
OE1
O
O
O
O
O3'
O3'
OP1
OP2
OP2
O3'
OP1
OP2
O
GLU G:45 G:41 176.0 0.926 S -66.9 -44.8 130.0 0.684 0.242 H:P06899:0.158
C:P04908:0.084
DA
DT
DA
DT
DT
DG
DG
DA
HOH
5.979
4.212
7.030
8.633
5.947
4.028
6.908
9.881
8.726
O
O
O
OE2
OE2
OE2
OE1
OE2
CB
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
O
5avc 3 P04908 98.46 5e-89 X-RAY
2015-12-23 GLU C:45 C:41 183.0 0.963 S -62.6 -47.4 142.0 0.747 0.216 D:P06899:0.132
G:P04908:0.084
DT
DT
DG
DG
DA
DA
DT
DA
HOH
9.162
6.828
4.671
7.733
9.524
6.095
4.197
7.024
5.241
OE2
OE2
OE2
OE1
OE1
O
O
O
N
O3'
O3'
OP1
OP2
OP2
O3'
OP1
OP2
O
GLU G:45 G:41 180.0 0.947 S -68.4 -41.8 135.0 0.711 0.236 C:P04908:0.084
H:P06899:0.158
DA
DT
DA
DT
DT
DG
DG
DA
HOH
5.969
4.220
6.949
8.592
6.256
4.347
6.719
9.524
9.522
O
O
O
OE2
OE2
OE2
OE1
OE2
N
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
O
5ay8 3 P04908 98.46 5e-89 X-RAY
2016-04-06 GLU C:45 C:41 196.0 1.0 S -65.1 -46.7 164.0 0.863 0.137 D:P06899:0.095
G:P04908:0.074
DT
DT
DT
DG
DT
DA
DT
DA
DC
9.711
7.373
6.688
7.721
8.799
6.700
5.973
4.399
5.630
OE1
OE1
OE1
CB
OE2
OE2
O
O
OE1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 184.0 0.968 S -66.9 -45.4 143.0 0.753 0.215 H:P06899:0.163
C:P04908:0.047
DA
DT
DA
DT
DT
DG
DG
DC
5.701
4.028
6.376
9.835
5.823
3.920
6.661
8.718
O
O
O
OE1
OE2
OE2
OE2
OE1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP1
5b0y 3 P04908 98.46 5e-89 X-RAY
2016-01-27 GLU C:45 C:41 189.0 0.995 S -72.2 -29.2 146.0 0.768 0.227 D:P06899:0.089
G:P04908:0.142
DT
DT
DG
DT
DA
DT
DA
DC
7.567
6.645
8.435
9.970
8.615
6.002
4.331
6.456
CB
CB
CB
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP2
O3'
OP1
OP2
GLU G:45 G:41 194.0 1.0 S -50.9 -42.6 145.0 0.763 0.237 C:P04908:0.089
H:P06899:0.168
DA
DT
DA
DT
DT
DG
DG
DC
MN
HOH
6.135
4.494
7.218
9.843
6.091
4.040
6.980
9.187
9.942
6.672
O
O
O
OE2
OE2
OE2
OE1
CG
OE2
OE2
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP1
MN
O
5b0z 3 P04908 98.46 5e-89 X-RAY
2016-01-27 GLU C:45 C:41 201.0 1.0 S -71.3 -34.3 160.0 0.842 0.158 D:P06899:0.111
G:P04908:0.105
DT
DT
DT
DG
DA
DT
DA
DC
HOH
9.968
6.773
5.370
8.217
8.656
5.892
4.043
5.967
2.550
OE1
OE1
OE1
CB
OE2
O
O
O
N
O3'
O3'
OP1
OP1
OP2
O3'
OP1
OP2
O
GLU G:45 G:41 187.0 0.984 S -73.4 -33.4 155.0 0.816 0.168 H:P06899:0.121
C:P04908:0.047
DA
DT
DA
DT
DT
DG
DG
DC
DA
HOH
5.869
4.185
6.720
9.490
7.027
5.302
7.964
8.228
9.731
2.829
O
O
OE2
OE2
OE2
OE2
OE1
OE2
OE2
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5b1l 3 P22752 98.46 5e-89 X-RAY
2017-02-15 GLU C:45 C:41 195.0 1.0 S -67.2 -36.8 160.0 0.842 0.158 G:P22752:0.058
D:Q9D2U9:0.126
DT
DT
DT
DG
DT
DA
DT
DA
DC
HOH
8.225
5.227
3.641
8.242
9.809
7.892
5.962
4.138
5.948
2.881
OE2
OE1
OE1
OE1
OE2
OE2
O
O
OE2
N
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU G:45 G:41 190.0 1.0 S -63.7 -37.9 142.0 0.747 0.253 C:P22752:0.1
H:Q9D2U9:0.158
DA
DT
DA
DT
DT
DG
DG
DC
DA
HOH
5.847
4.270
7.125
9.557
6.667
4.708
7.112
7.666
9.439
2.886
O
O
O
OE1
OE2
OE2
OE2
OE1
OE1
O
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP1
OP1
O
5b1m 3 P22752 98.46 5e-89 X-RAY
2017-02-15 GLU C:45 C:41 193.0 1.0 S -62.9 -43.5 130.0 0.684 0.316 G:P22752:0.242
D:Q9D2U9:0.095
DT
DT
DG
DT
DA
DT
DA
DC
HOH
6.900
5.510
8.115
9.679
8.576
5.963
4.152
6.038
2.737
CB
CB
CB
OE1
OE1
O
O
O
N
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU G:45 G:41 196.0 1.0 S -67.6 -38.7 129.0 0.679 0.321 C:P22752:0.247
H:Q9D2U9:0.105
DA
DT
DA
DT
DG
DG
DA
DC
HOH
5.897
4.189
7.158
9.445
6.933
7.933
8.919
7.073
6.381
O
O
O
CB
CB
CB
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
O
5b24 3 P04908 98.46 5e-89 X-RAY
2016-03-02 GLU C:45 C:41 184.0 0.968 S -63.4 -38.5 151.0 0.795 0.173 D:P06899:0.089
G:P04908:0.089
DT
DT
DG
DT
DA
DT
DA
DC
7.762
6.432
8.242
9.093
7.037
6.458
4.541
4.780
CG
CG
CB
OE2
OE2
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 196.0 1.0 S -57.6 -45.8 143.0 0.753 0.247 H:P06899:0.168
C:P04908:0.116
DA
DT
DA
DT
DT
DG
DG
DA
DC
DA
6.233
4.622
6.805
9.423
6.367
4.481
7.122
9.958
7.710
9.755
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP1
O3'
O3'
C5'
OP2
O3'
OP2
OP2
5b2i 3 P04908 98.46 5e-89 X-RAY
2016-06-15 GLU C:45 C:41 185.0 0.974 S -77.4 -33.5 140.0 0.737 0.237 D:P06899:0.079
G:P04908:0.158
DT
DG
DG
DT
DA
DA
DT
DA
9.239
7.121
8.506
8.895
7.128
5.835
4.484
6.646
CG
CB
N
OE2
OE2
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 184.0 0.968 S -71.6 -22.8 127.0 0.668 0.3 H:P06899:0.184
C:P04908:0.121
DA
DT
DA
DT
DG
DG
DA
5.519
3.917
6.834
5.920
3.811
6.575
9.415
O
O
O
OE2
OE2
OE2
OE1
O3'
OP1
OP2
O3'
C5'
OP2
OP1
5b2j 3 P04908 98.46 5e-89 X-RAY
2016-06-15 GLU C:45 C:41 188.0 0.989 S -72.0 -39.2 114.0 0.6 0.389 D:P06899:0.095
G:P04908:0.295
DT
DG
DG
DT
DA
DA
DT
DA
8.768
6.643
8.105
9.225
7.385
5.883
4.112
6.902
CG
CB
CB
OE2
OE2
O
O
O
O3'
C5'
OP2
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 192.0 1.0 S -69.4 -37.2 135.0 0.711 0.289 H:P06899:0.079
C:P04908:0.216
DA
DT
DA
DT
DG
DG
DT
DA
5.758
4.142
6.136
8.517
6.842
8.229
8.913
7.155
O
O
OE2
CG
CG
CB
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
5b31 3 P04908 98.46 5e-89 X-RAY
2016-08-03 GLU C:45 C:41 190.0 1.0 S -61.7 -49.4 74.0 0.389 0.611 D:P06899:0.111
G:P0C0S5:0.5
DT
DT
DG
DT
DA
DC
DT
DA
DC
HOH
7.267
5.730
7.438
8.918
6.993
9.971
6.163
4.330
6.080
4.981
CG
CG
CB
OE2
OE2
OE2
O
O
OE2
O
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O
5b32 3 P04908 98.46 5e-89 X-RAY
2016-08-03 GLU C:45 C:41 186.0 0.979 S -67.8 -38.1 68.0 0.358 0.621 D:P06899:0.1
G:P0C0S5:0.526
DT
DT
DT
DG
DT
DA
DT
DA
DC
HOH
9.346
7.208
5.716
8.776
9.097
8.054
6.006
4.385
5.765
8.417
OE1
OE1
CB
CB
OE2
OE2
O
O
O
O
O3'
O3'
OP1
OP1
O3'
OP2
O3'
OP1
OP2
O
5b40 3 P04908 98.46 5e-89 X-RAY
2016-06-22 GLU C:45 C:41 192.0 1.0 S -99.5 -15.5 130.0 0.684 0.316 D:P06899:0.184
G:P04908:0.142
DT
DT
DG
DA
DT
DA
DC
6.954
4.920
7.398
8.384
5.847
4.359
6.071
OE2
OE2
OE2
OE1
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP1
GLU G:45 G:41 180.0 0.947 S -103.0 -17.7 121.0 0.637 0.31 H:P06899:0.137
C:P04908:0.179
DA
DT
DA
DT
DG
DG
DC
5.660
4.398
6.504
7.977
6.380
7.849
8.093
O
O
O
OE1
OE1
N
OE1
O3'
OP1
OP1
O3'
OP1
OP1
OP1
5cpi 3 P04908 98.46 5e-89 X-RAY
2015-10-28 GLU C:45 C:41 199.0 1.0 S -66.7 -35.3 109.0 0.574 0.426 D:P06899:0.084
G:P04908:0.395
DT
DG
DT
DA
DT
DT
DC
7.768
5.945
9.213
6.887
6.165
4.472
5.599
CB
CB
OE1
OE1
O
O
OE1
O3'
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 200.0 1.0 S -66.7 -30.7 111.0 0.584 0.416 C:P04908:0.411
H:P06899:0.063
DG
DT
DA
DT
DT
DC
DT
DC
5.755
4.139
5.869
8.953
6.915
8.904
9.064
6.893
O
O
O
CB
CB
N
OE1
OE1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
5cpj 3 P04908 98.46 5e-89 X-RAY
2015-10-28 GLU C:45 C:41 190.0 1.0 S -65.4 -24.0 114.0 0.6 0.4 D:P06899:0.053
G:P04908:0.347
DT
DG
DA
DT
DA
DT
DT
DC
8.384
6.924
9.949
8.847
7.081
6.140
4.336
4.572
CB
CB
N
OE2
OE1
O
O
OE1
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 203.0 1.0 S -65.8 -17.5 137.0 0.721 0.279 H:P06899:0.037
C:P04908:0.311
DG
DT
DA
DA
DT
DT
5CM
DT
DC
DC
5.735
4.352
6.247
9.339
7.825
6.488
8.887
7.602
5.263
9.213
O
O
O
OE1
OE1
OE1
C
OE2
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
O3'
OP1
OP2
5cpk 3 P04908 98.46 5e-89 X-RAY
2015-10-28 GLU C:45 C:41 193.0 1.0 S -71.3 -21.3 168.0 0.884 0.116 G:P04908:0.089
D:P06899:0.042
DT
DG
DG
DA
DT
DT
DG
DA
8.661
6.846
8.525
8.463
6.360
5.482
3.802
5.676
OE2
OE1
N
OE2
OE2
O
O
OE2
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 189.0 0.995 S -66.6 -31.0 154.0 0.811 0.184 C:P04908:0.063
H:P06899:0.126
DA
DA
DT
DG
DA
DA
DG
DA
DT
5.892
4.372
6.884
6.201
4.455
7.414
8.868
6.435
9.748
O
O
O
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
OP2
5gse 3 P04908 98.46 5e-89 X-RAY
2017-05-03 GLU C:45 C:41 176.0 0.926 S -87.4 -62.2 159.0 0.837 0.089 D:P06899:0.026
G:P04908:0.063
DG
DG
DA
DA
DC
DC
DT
DA
DG
7.660
6.546
8.575
8.244
6.624
9.354
5.807
4.139
4.722
OE2
CG
C
OE1
OE2
OE2
O
O
OE2
C4'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU G:45 G:41 185.0 0.974 S -72.2 -37.1 118.0 0.621 0.353 H:P06899:0.1
C:P04908:0.253
DG
DA
DC
DT
DA
DG
DA
DG
5.795
4.107
6.215
8.913
6.779
7.693
9.117
7.361
O
O
O
CB
CB
CG
OE1
OE1
O3'
C5'
OP2
O3'
C5'
OP1
O3'
OP1
GLU M:45 M:41 139.0 0.732 S -67.3 -37.6 125.0 0.658 0.074 N:P06899:0.074
DG
DA
DC
DT
DA
DG
6.256
4.675
6.526
9.085
6.854
7.840
O
O
O
CG
CG
CB
O3'
OP1
OP2
O3'
C5'
OP1
5gtc 3 P04908 98.46 5e-89 X-RAY
2017-06-28 GLU C:45 C:41 181.0 0.953 S -59.4 -46.9 119.0 0.626 0.327 D:P06899:0.121
G:P04908:0.211
DT
DT
DG
DT
DA
DT
DA
DC
7.233
5.696
7.636
8.942
6.844
6.257
4.613
5.572
CG
CG
CB
OE2
OE2
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 198.0 1.0 S -60.5 -39.7 124.0 0.653 0.347 H:P06899:0.084
C:P04908:0.305
DA
DT
DA
DT
DG
DG
DA
DC
6.316
4.726
6.641
7.901
6.833
7.738
8.545
6.596
O
O
O
CG
CG
CB
OE2
OE2
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
5gxq 3 P04908 98.46 5e-89 X-RAY
2017-04-19 GLU C:45 C:41 192.0 1.0 S -62.1 -43.4 147.0 0.774 0.226 D:P06899:0.1
G:P04908:0.137
DT
DT
DG
DT
DA
DT
DA
DC
8.242
6.173
8.011
8.436
6.749
6.223
4.437
6.414
CG
CG
CB
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 188.0 0.989 S -73.5 -33.8 147.0 0.774 0.215 H:P06899:0.147
C:P04908:0.074
DA
DT
DA
DT
DT
DG
DG
DC
5.904
4.358
6.920
8.651
6.096
3.811
7.124
9.284
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP2
O3'
C4'
OP1
OP2
OP2
5jrg 3 P04908 98.46 5e-89 X-RAY
2017-03-08 GLU C:45 C:41 189.0 0.995 S -62.9 -41.8 140.0 0.737 0.258 D:P06899:0.111
G:P04908:0.153
DT
DG
DG
DT
DA
DA
DT
DA
HOH
8.688
6.648
7.575
9.912
8.104
5.862
4.334
6.465
2.853
CG
CG
CB
OE2
OE2
O
O
OE2
N
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU G:45 G:41 189.0 0.995 S -63.0 -41.5 140.0 0.737 0.258 H:P06899:0.116
C:P04908:0.142
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.896
4.220
5.625
8.458
6.299
7.643
9.355
7.034
3.072
O
O
OE1
CG
CG
CB
OE1
OE1
N
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
O
5x7x 3 P04908 98.46 5e-89 X-RAY
2017-04-19 GLU C:45 C:41 191.0 1.0 S -68.0 -36.1 160.0 0.842 0.158 D:P06899:0.095
G:P04908:0.068
DT
DT
DT
DG
DT
DA
DT
DA
DC
HOH
9.380
7.002
5.844
9.820
9.179
7.379
6.076
4.168
4.771
3.048
OE2
CG
CG
CB
OE2
OE2
O
O
OE2
N
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU G:45 G:41 186.0 0.979 S -68.7 -33.9 147.0 0.774 0.205 H:P06899:0.132
C:P04908:0.074
DA
DT
DA
DT
DG
DG
DA
DC
DA
HOH
5.932
4.208
6.752
6.478
4.516
7.094
9.811
7.426
9.288
2.856
O
O
O
OE1
OE1
OE1
OE2
OE2
OE2
OE2
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP1
OP1
O
5xm0 3 C0HKE1 98.46 5e-89 X-RAY
2018-03-07 GLU C:45 C:41 195.0 1.0 S -50.7 -64.7 163.0 0.858 0.142 G:C0HKE1:0.053
D:Q9D2U9:0.116
DT
DT
DT
DG
DT
DA
DC
DT
DA
DC
8.801
7.020
6.005
7.418
9.285
6.989
9.451
6.315
4.377
5.771
OE2
OE2
CD
CB
OE2
OE2
OE2
O
O
OE2
O3'
OP1
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU G:45 G:41 184.0 0.968 S -63.8 -55.8 143.0 0.753 0.215 H:Q9D2U9:0.153
C:C0HKE1:0.068
DA
DT
DA
DT
DT
DG
DG
DC
5.931
4.270
6.957
8.717
6.086
3.919
6.869
9.559
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP2
5xm1 3 C0HKE1 98.46 5e-89 X-RAY
2018-03-07 GLU C:45 C:41 192.0 1.0 S -57.4 -52.3 152.0 0.8 0.2 D:Q9D2U9:0.095
G:C0HKE1:0.116
DT
DT
DG
DT
DA
DT
DA
DC
8.014
6.969
7.487
8.755
6.698
6.518
4.951
6.409
CG
CG
CB
OE2
OE2
O
O
OE2
O3'
O5'
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 192.0 1.0 S -59.5 -48.1 148.0 0.779 0.221 H:Q9D2U9:0.137
C:C0HKE1:0.095
DA
DT
DA
DT
DT
DG
DG
DC
5.876
4.250
6.803
8.663
6.678
4.528
7.551
8.606
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP2
O3'
C4'
OP1
OP2
OP1
5y0c 4 P04908 98.46 5e-89 X-RAY
2018-07-18 GLU E:45 C:41 192.0 1.0 S -68.9 -32.7 134.0 0.705 0.295 F:P06899:0.089
I:P04908:0.211
DT
DT
DT
DG
DT
DA
DT
DA
DC
HOH
9.639
7.482
6.132
9.798
9.271
7.924
5.912
4.033
5.654
2.641
OE1
CB
CB
C
OE2
OE2
O
O
OE1
O
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU I:45 G:41 192.0 1.0 S -69.3 -32.3 121.0 0.637 0.363 J:P06899:0.095
E:P04908:0.279
DA
DT
DA
DT
DG
DG
DA
DC
HOH
5.887
4.087
6.785
9.227
7.162
8.158
9.124
7.130
2.868
O
O
O
CB
CB
CB
OE2
OE1
N
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
O
5y0d 3 P04908 98.46 5e-89 X-RAY
2018-07-18 GLU C:45 C:41 191.0 1.0 S -73.9 -29.3 157.0 0.826 0.174 D:P06899:0.116
G:P04908:0.063
DT
DT
DT
DG
DT
DA
DT
DA
DC
HOH
8.726
5.861
4.755
9.892
9.523
7.793
6.074
4.202
6.036
2.734
OE2
OE1
OE1
C
OE2
OE2
O
O
O
O
O3'
O3'
OP1
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU G:45 G:41 189.0 0.995 S -70.3 -33.3 143.0 0.753 0.242 H:P06899:0.137
C:P04908:0.111
DA
DT
DA
DT
DT
DG
DG
DC
DA
HOH
5.915
4.190
6.803
9.502
6.544
4.787
6.898
7.775
9.144
2.904
O
O
OE2
OE2
OE1
OE1
OE1
OE2
OE2
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5zbx 3 P04908 98.46 5e-89 X-RAY
2019-02-13 GLU C:45 C:41 181.0 0.953 S -63.6 -29.6 124.0 0.653 0.3 D:P06899:0.084
G:P04908:0.216
DT
DT
DG
DA
DT
DA
DC
7.474
6.048
8.662
8.216
6.014
4.443
5.234
CB
CB
CB
OE2
O
O
OE2
O3'
OP1
OP1
OP1
O3'
OP1
OP1
GLU G:45 G:41 191.0 1.0 S -63.7 -30.4 115.0 0.605 0.395 H:P06899:0.111
C:P04908:0.289
DA
DT
DA
DT
DG
DG
DA
DC
5.837
4.217
6.672
9.402
7.095
7.849
9.704
7.393
O
O
OE2
CB
CB
CB
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP2
O3'
OP1
6a5l 18 P04908 98.46 5e-89 EM
2018-10-03 GLU R:45 c:41 203.0 1.0 S -93.9 -47.4 160.0 0.842 0.158 S:P06899:0.158
V:P04908:0.095
DT
DA
DG
DG
DA
DC
DA
DG
8.700
6.796
7.921
6.441
4.835
6.277
9.917
7.740
OE2
OE1
CB
O
O
O
OE2
OE2
C5'
O5'
OP1
O3'
OP1
OP2
O3'
OP1
GLU V:45 g:41 193.0 1.0 S -87.7 -46.4 144.0 0.758 0.242 W:P06899:0.068
R:P04908:0.189
DA
DC
DA
DA
DG
DG
DG
DT
9.946
8.353
7.009
4.942
7.350
8.768
6.605
8.216
OE1
OE1
O
O
O
CB
CB
CB
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
6a5o 18 P04908 98.46 5e-89 EM
2018-10-03 GLU R:45 c:41 173.0 0.911 S -75.1 -63.7 138.0 0.726 0.185 S:P06899:0.137
V:P04908:0.047
DG
DT
DA
DG
DA
DG
DA
DG
DA
DC
8.862
6.129
4.301
6.737
9.772
7.569
9.332
5.205
3.690
6.309
OE2
OE2
OE1
OE1
OE2
OE2
OE2
O
O
O
N2
C4'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU V:45 g:41 191.0 1.0 S -88.5 -48.0 127.0 0.668 0.332 W:P06899:0.147
R:P04908:0.2
DC
DA
DA
DG
DG
DG
DT
DA
DC
9.978
4.618
3.452
6.343
8.337
6.038
6.939
8.734
6.482
C
O
O
O
CB
CB
CB
OE1
OE1
O3'
O3'
OP1
P
C4'
C5'
OP1
O3'
OP1
6a5p 18 P04908 98.46 5e-89 EM
2018-10-03 GLU R:45 c:41 167.0 0.879 S -75.2 -63.6 132.0 0.695 0.184 S:P06899:0.137
V:P04908:0.053
DG
DT
DA
DG
DG
DG
DA
DC
9.599
6.976
4.606
7.057
8.926
6.675
4.975
6.856
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C4'
OP1
OP1
OP1
O3'
OP1
OP2
GLU V:45 g:41 187.0 0.984 S -88.5 -47.9 123.0 0.647 0.337 W:P06899:0.147
R:P04908:0.195
DA
DA
DG
DG
DG
DT
DC
5.559
3.978
7.176
8.670
6.722
7.393
8.212
O
O
O
CB
CB
CB
OE1
O3'
OP1
OP2
O3'
C5'
OP1
OP1
6a5r 18 P04908 98.46 5e-89 EM
2018-10-03 GLU R:45 c:41 170.0 0.895 S -75.2 -63.6 136.0 0.716 0.179 S:P06899:0.132
V:P04908:0.053
DG
DT
DA
DG
DG
DA
DC
9.599
6.975
4.605
7.058
6.675
4.975
6.855
OE2
OE2
OE2
OE1
O
O
O
O3'
C4'
OP1
OP1
O3'
OP1
OP2
GLU V:45 g:41 189.0 0.995 S -88.6 -47.8 124.0 0.653 0.342 W:P06899:0.153
R:P04908:0.189
DC
8.212
OE1
OP1
6a5t 18 P04908 98.46 5e-89 EM
2018-10-03 GLU R:45 c:41 202.0 1.0 S -94.0 -47.3 159.0 0.837 0.163 S:P06899:0.158
V:P04908:0.095
DT
DA
DG
DG
DA
DC
8.700
6.796
7.920
6.442
4.836
6.277
OE2
OE1
CB
O
O
O
C5'
O5'
OP1
O3'
OP1
OP2
GLU V:45 g:41 193.0 1.0 S -87.7 -46.5 145.0 0.763 0.237 W:P06899:0.063
R:P04908:0.189
DA
DC
9.945
8.353
OE1
OE1
O3'
OP1
6a5u 18 P04908 98.46 5e-89 EM
2018-10-03 GLU R:45 c:41 199.0 1.0 S -93.9 -47.3 157.0 0.826 0.174 S:P06899:0.153
V:P04908:0.089
DT
DA
DG
DG
DA
DC
DA
DG
8.699
6.797
7.921
6.441
4.835
6.278
9.917
7.741
OE2
OE1
CB
O
O
O
OE2
OE2
C5'
O5'
OP1
O3'
OP1
OP2
O3'
OP1
GLU V:45 g:41 191.0 1.0 S -87.7 -46.4 141.0 0.742 0.258 W:P06899:0.074
R:P04908:0.189
DA
DC
DA
DA
DG
DG
DG
DT
9.946
8.352
7.009
4.942
7.351
8.769
6.606
8.215
OE1
OE1
O
O
O
CB
CB
CB
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
6hkt 3 P04908 98.46 5e-89 X-RAY
2018-10-31 GLU C:45 C:41 191.0 1.0 S -55.2 -60.3 147.0 0.774 0.226 G:P04908:0.063
D:P06899:0.168
DT
DA
DG
DA
DG
DT
DG
DA
DC
6.683
4.864
6.895
9.433
7.236
9.532
5.309
3.930
6.604
OE2
OE1
CB
OE2
OE2
OE2
O
O
O
O3'
O5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU G:45 G:41 190.0 1.0 S -56.8 -48.7 140.0 0.737 0.263 H:P06899:0.168
C:P04908:0.095
DC
DT
DA
DG
DG
DG
DA
DA
DC
9.927
4.630
3.271
6.669
6.617
4.406
6.691
9.263
6.897
C
O
O
O
OE1
OE1
OE1
OE2
OE2
O3'
O3'
OP1
OP2
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OP1
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OP1
GLU M:45 c:41 193.0 1.0 S -57.8 -47.9 153.0 0.805 0.195 N:P06899:0.168
Q:P04908:0.042
DT
DA
DG
DA
DG
DT
DC
DG
DA
DC
5.554
3.162
5.893
9.879
7.750
9.786
9.563
4.286
3.229
7.415
OE1
OE1
OE1
OE2
OE2
OE2
C
O
O
O
O3'
C5'
P
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OP1
OP2
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OP1
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GLU Q:45 g:41 188.0 0.989 S -53.2 -58.9 138.0 0.726 0.263 M:P04908:0.105
R:P06899:0.158
DT
DA
DG
DG
DG
DA
DA
DC
6.670
5.296
7.299
7.584
5.268
7.379
9.591
7.299
O
O
O
OE2
OE2
CB
OE2
OE2
O3'
OP1
OP2
C4'
OP1
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OP1
GLU U:45 M:41 193.0 1.0 S -53.2 -48.6 139.0 0.732 0.268 Y:P04908:0.105
V:P06899:0.184
DT
DA
DG
DA
DG
DT
DG
DA
DC
7.252
5.390
7.379
8.838
6.668
9.520
5.948
4.387
6.568
OE1
OE1
CB
OE2
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
OP2
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OP1
OP1
GLU Y:45 Q:41 194.0 1.0 S -54.2 -37.9 159.0 0.837 0.163 Z:P06899:0.095
U:P04908:0.089
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
5.168
3.881
6.582
9.908
6.618
4.556
7.594
8.485
6.263
9.176
O
O
O
OE1
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP2
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OP1
OP2
GLU CA:45 m:41 193.0 1.0 S -57.8 -45.6 156.0 0.821 0.179 DA:P06899:0.137
GA:P04908:0.058
DG
DT
DA
DG
DA
DG
DT
DC
DG
DA
DC
9.691
6.005
4.032
7.130
8.497
6.309
8.830
9.804
4.194
3.034
6.643
OE1
OE1
OE1
CB
OE2
OE2
OE2
C
O
O
O
N2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
O3'
OP1
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GLU GA:45 q:41 187.0 0.984 S -53.5 -61.5 142.0 0.747 0.237 HA:P06899:0.184
CA:P04908:0.053
DC
DT
DA
DG
DG
DG
DG
DA
DC
9.821
4.804
3.574
7.078
9.064
5.769
3.746
6.309
8.371
C
O
O
O
OE2
OE2
OE1
CB
OE2
O3'
O3'
OP1
OP2
O3'
C4'
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GLU KA:45 W:41 189.0 0.995 S -54.4 -59.0 144.0 0.758 0.237 LA:P06899:0.158
OA:P04908:0.089
DT
DA
DG
DA
DG
DT
DG
DA
DC
7.622
5.595
7.878
8.256
6.120
9.020
5.932
4.472
6.144
OE2
OE1
CB
OE2
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
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GLU OA:45 0:41 195.0 1.0 S -56.3 -50.0 140.0 0.737 0.263 PA:P06899:0.184
KA:P04908:0.111
DT
DA
DG
DG
DG
DA
DA
DC
DC
5.233
4.027
7.038
6.637
4.557
6.952
8.985
6.720
9.582
O
O
O
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP2
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OP1
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OP1
OP2
GLU SA:45 w:41 189.0 0.995 S -56.4 -44.2 141.0 0.742 0.253 TA:P06899:0.179
WA:P04908:0.079
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.938
6.390
4.379
7.300
8.217
6.100
9.137
4.817
3.535
6.130
OE1
OE1
OE1
OE1
OE2
OE2
OE2
O
O
OE2
N2
O3'
C5'
OP1
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OP1
OP2
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OP1
GLU WA:45 2:41 188.0 0.989 S -55.6 -60.8 140.0 0.737 0.252 SA:P04908:0.089
XA:P06899:0.163
DT
DA
DG
DG
DG
DG
DA
DC
5.282
3.950
7.314
9.555
6.139
4.046
6.254
8.375
O
O
O
OE2
OE2
OE2
CB
OE2
O3'
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OP2
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O3'
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6inq 18 P04908 98.46 5e-89 EM
2019-04-03 GLU R:45 c:41 199.0 1.0 S -93.9 -47.3 156.0 0.821 0.179 S:P06899:0.147
V:P04908:0.1
DT
DA
DG
DG
DA
DC
DA
DG
8.699
6.797
7.920
6.440
4.833
6.277
9.918
7.741
OE2
OE1
CB
O
O
O
OE2
OE2
C5'
O5'
OP1
O3'
OP1
OP2
O3'
OP1
GLU V:45 g:41 189.0 0.995 S -87.6 -46.5 142.0 0.747 0.248 W:P06899:0.063
R:P04908:0.184
DA
DC
DA
DA
DG
DG
9.946
8.353
7.008
4.942
7.351
8.768
OE1
OE1
O
O
O
CB
O3'
OP1
O3'
OP1
OP2
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6ir9 21 P04908 98.46 5e-89 EM
2019-02-20 GLU U:45 c:41 200.0 1.0 S -94.0 -47.4 158.0 0.832 0.168 V:P06899:0.153
Y:P04908:0.089
DT
DA
DG
DG
DA
DC
8.701
6.797
7.921
6.440
4.835
6.276
OE2
OE1
CB
O
O
O
C5'
O5'
OP1
O3'
OP1
OP2
GLU Y:45 g:41 192.0 1.0 S -87.7 -46.5 143.0 0.753 0.247 Z:P06899:0.063
U:P04908:0.195
DA
DC
9.947
8.354
OE1
OE1
O3'
OP1
6j4w 21 P04908 98.46 5e-89 EM
2019-02-20 GLU U:45 c:41 169.0 0.889 S -75.1 -63.7 133.0 0.7 0.189 V:P06899:0.142
Y:P04908:0.053
DG
DT
DA
DG
DG
DG
DA
DC
9.600
6.977
4.607
7.058
8.926
6.675
4.974
6.855
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C4'
OP1
OP1
OP1
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OP1
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GLU Y:45 g:41 188.0 0.989 S -88.6 -47.8 124.0 0.653 0.336 Z:P06899:0.142
U:P04908:0.189
DA
DA
DG
DG
DG
DT
DC
5.559
3.977
7.176
8.670
6.724
7.393
8.212
O
O
O
CB
CB
CB
OE1
O3'
OP1
OP2
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6j4x 21 P04908 98.46 5e-89 EM
2019-02-20 GLU U:45 c:41 203.0 1.0 S -94.0 -47.4 160.0 0.842 0.158 V:P06899:0.153
Y:P04908:0.089
DT
DA
DG
DG
DA
DC
8.702
6.796
7.922
6.442
4.837
6.278
OE2
OE1
CB
O
O
O
C5'
O5'
OP1
O3'
OP1
OP2
GLU Y:45 g:41 190.0 1.0 S -87.7 -46.6 142.0 0.747 0.253 Z:P06899:0.063
U:P04908:0.184
DA
DC
9.946
8.355
OE1
OE1
O3'
OP1
6j4y 21 P04908 98.46 5e-89 EM
2019-02-20 GLU U:45 c:41 200.0 1.0 S -94.0 -47.3 158.0 0.832 0.168 V:P06899:0.153
Y:P04908:0.095
DT
DA
DG
DG
DA
DC
8.700
6.796
7.922
6.441
4.835
6.274
OE2
OE1
CB
O
O
O
C5'
O5'
OP1
O3'
OP1
OP2
GLU Y:45 g:41 191.0 1.0 S -87.6 -46.6 143.0 0.753 0.247 Z:P06899:0.068
U:P04908:0.184
DA
DC
9.947
8.355
OE1
OE1
O3'
OP1
6j4z 20 P04908 98.46 5e-89 EM
2019-02-20 GLU T:45 c:41 201.0 1.0 S -93.9 -47.5 158.0 0.832 0.168 X:P04908:0.095
U:P06899:0.153
DT
DA
DG
DG
DA
DC
DA
DG
8.700
6.796
7.921
6.442
4.836
6.277
9.917
7.740
OE2
OE1
CB
O
O
O
OE2
OE2
C5'
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OP1
O3'
OP1
OP2
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GLU X:45 g:41 192.0 1.0 S -87.7 -46.3 144.0 0.758 0.242 T:P04908:0.184
Y:P06899:0.068
DA
DC
DA
DA
DG
DG
DG
DT
9.945
8.352
7.008
4.942
7.351
8.770
6.606
8.215
OE1
OE1
O
O
O
CB
CB
CB
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6j50 20 P04908 98.46 5e-89 EM
2019-02-20 GLU T:45 c:41 198.0 1.0 S -94.0 -47.5 158.0 0.832 0.168 X:P04908:0.084
U:P06899:0.137
DT
DA
DG
DG
DA
DC
DA
DG
8.700
6.797
7.920
6.441
4.836
6.278
9.916
7.739
OE2
OE1
CB
O
O
O
OE2
OE2
C5'
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O3'
OP1
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GLU X:45 g:41 188.0 0.989 S -87.7 -46.3 143.0 0.753 0.236 T:P04908:0.179
Y:P06899:0.058
DA
DC
DA
DA
DG
DG
DG
DT
9.946
8.353
7.008
4.941
7.350
8.770
6.607
8.215
OE1
OE1
O
O
O
CB
CB
CB
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6j51 21 P04908 98.46 5e-89 EM
2019-02-20 GLU U:45 c:41 201.0 1.0 S -94.0 -47.5 158.0 0.832 0.168 V:P06899:0.158
Y:P04908:0.095
DT
DA
DG
DG
DA
DC
DA
DG
8.699
6.797
7.920
6.441
4.834
6.277
9.917
7.740
OE2
OE1
CB
O
O
O
OE2
OE2
C5'
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OP1
O3'
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GLU Y:45 g:41 191.0 1.0 S -87.7 -46.3 142.0 0.747 0.253 Z:P06899:0.068
U:P04908:0.184
DA
DC
DA
DA
DG
DG
DG
DT
9.946
8.352
7.007
4.941
7.350
8.770
6.606
8.215
OE1
OE1
O
O
O
CB
CB
CB
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6kxv 3 P04908 98.46 5e-89 X-RAY
2020-07-22 GLU C:45 C:41 194.0 1.0 S -65.2 -48.5 138.0 0.726 0.274 D:P06899:0.068
G:P04908:0.226
DT
DT
DG
DT
DA
DT
DA
DC
8.223
6.598
8.912
8.721
6.660
6.172
4.583
5.164
CG
CB
CB
OE2
OE2
O
O
OE2
O3'
OP1
OP1
O3'
OP1
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OP1
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GLU G:45 G:41 205.0 1.0 S -65.8 -45.6 151.0 0.795 0.205 H:P06899:0.121
C:P04908:0.163
DA
DT
DA
DT
DG
DG
DA
DC
5.703
3.829
6.558
7.582
5.907
8.363
8.552
6.398
O
O
O
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OE1
CB
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6l49 3 P04908 98.46 5e-89 EM
2019-12-04 GLU C:45 C:41 158.0 0.832 S -111.0 -10.2 124.0 0.653 0.179 D:P06899:0.168
G:P04908:0.005
DG
DT
DA
DG
DG
DG
DA
DC
9.032
6.779
4.475
7.865
8.459
5.429
3.642
6.098
OE1
OE2
OE2
OE2
OE1
O
O
O
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O3'
OP1
OP1
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GLU G:45 G:41 170.0 0.895 S -83.9 -33.8 131.0 0.689 0.206 H:P06899:0.158
C:P04908:0.053
DT
DA
DG
DG
DG
DG
DA
DC
5.699
3.858
6.630
9.398
5.708
4.246
6.768
8.330
O
O
OE2
OE1
OE1
OE1
OE1
OE2
O3'
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OP1
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GLU M:45 M:41 179.0 0.942 S -73.7 -51.8 141.0 0.742 0.2 N:P06899:0.126
Q:P04908:0.068
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
7.465
4.761
2.949
7.040
9.823
7.445
9.087
5.358
3.848
6.473
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
O
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GLU Q:45 Q:41 197.0 1.0 S -71.9 -49.4 139.0 0.732 0.268 M:P04908:0.137
R:P06899:0.179
DT
DA
DG
DG
DG
DG
DA
DA
DC
5.391
3.342
6.497
9.414
5.146
3.758
6.848
9.742
7.424
O
O
O
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OE1
OE1
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GLU U:45 U:41 174.0 0.916 S -68.3 -44.5 130.0 0.684 0.232 V:P06899:0.153
Y:P04908:0.084
DC
DG
DT
DA
DG
DG
DC
DG
DA
DC
9.676
6.872
3.969
2.947
6.226
8.217
9.977
5.200
3.394
6.085
OE2
OE2
OE2
OE2
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CG
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O
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GLU Y:45 Y:41 198.0 1.0 S -74.3 -42.4 136.0 0.716 0.284 Z:P06899:0.158
U:P04908:0.174
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
5.379
3.363
6.418
9.082
6.300
4.229
7.545
9.069
6.784
9.726
O
O
O
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6l4a 3 P04908 98.46 5e-89 EM
2019-12-04 GLU C:45 C:41 197.0 1.0 S -69.8 -55.6 156.0 0.821 0.179 D:P06899:0.142
G:P04908:0.079
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.830
6.035
4.368
7.503
9.524
7.250
9.420
5.577
3.932
6.425
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
O
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C4'
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GLU G:45 G:41 199.0 1.0 S -70.4 -41.8 136.0 0.716 0.284 C:P04908:0.174
H:P06899:0.163
DT
DA
DG
DG
DG
DA
DC
5.615
3.656
6.543
6.644
4.431
6.723
8.145
O
O
O
OE1
OE1
OE1
OE2
O3'
C5'
P
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OP1
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GLU M:45 M:41 184.0 0.968 S -69.0 -54.6 138.0 0.726 0.242 N:P06899:0.158
Q:P04908:0.089
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.122
5.429
3.906
7.066
9.742
7.493
9.683
5.625
4.093
6.581
OE2
OE2
OE2
OE1
OE2
OE2
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O
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C5'
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GLU Q:45 Q:41 200.0 1.0 S -69.3 -39.1 134.0 0.705 0.295 R:P06899:0.168
M:P04908:0.189
DT
DA
DG
DG
DG
DA
DC
5.718
3.754
6.627
6.552
4.407
6.734
8.066
O
O
O
OE1
OE1
OE1
OE2
O3'
C5'
P
O3'
C5'
OP1
OP2
GLU U:45 U:41 193.0 1.0 S -67.5 -46.2 144.0 0.758 0.242 Y:P04908:0.089
V:P06899:0.174
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.936
5.975
4.146
7.139
9.958
7.710
9.725
5.389
3.858
6.542
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
O
O3'
O3'
OP1
OP2
O3'
OP1
OP2
O3'
C5'
OP1
GLU Y:45 Y:41 202.0 1.0 S -70.7 -38.1 134.0 0.705 0.295 Z:P06899:0.158
U:P04908:0.205
DT
DA
DG
DG
DG
DA
DA
DC
5.770
3.759
6.552
7.060
4.810
7.122
9.740
7.927
O
O
O
OE1
OE1
OE1
OE2
OE2
O3'
C5'
P
O3'
C5'
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6r8y 3 P04908 98.46 5e-89 EM
2019-06-12 GLU C:45 C:42 181.0 0.953 S -64.6 -45.0 116.0 0.611 0.342 D:P06899:0.132
G:P04908:0.216
DT
DT
DG
DC
DT
DA
DC
6.882
5.723
7.889
9.228
6.725
3.925
6.544
HB3
HG2
HB2
HG3
O
O
O
O3'
OP1
OP1
OP1
O3'
H5''
OP2
GLU G:45 G:42 181.0 0.953 S -68.8 -46.1 118.0 0.621 0.332 H:P06899:0.116
C:P04908:0.221
DT
DA
DC
DT
DT
DG
DC
6.756
3.815
6.306
7.051
5.031
7.671
8.963
O
O
O
HB3
HB3
HB2
HG3
O3'
H5''
OP2
O3'
OP1
OP1
OP1
6r8z 3 P04908 98.46 5e-89 EM
2019-06-12 GLU C:45 C:42 188.0 0.989 S -64.8 -52.9 122.0 0.642 0.347 D:P06899:0.116
G:P04908:0.232
DT
DT
DG
DC
DT
DA
DC
6.669
5.323
7.916
9.055
7.114
4.418
6.382
HB3
HB3
HB2
HG2
O
O
O
O3'
OP1
OP1
OP1
O3'
H5'
OP2
GLU G:45 G:42 181.0 0.953 S -65.3 -48.2 148.0 0.779 0.174 C:P04908:0.1
H:P06899:0.079
DT
DA
DC
DT
DT
DT
DG
DA
DC
6.496
4.149
6.086
9.642
6.688
5.123
7.335
9.491
7.585
O
O
OE2
OE2
HG2
HG2
HB3
OE2
OE2
O3'
H5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
6r90 3 P04908 98.46 5e-89 EM
2019-06-12 GLU C:45 C:42 191.0 1.0 S -66.4 -36.9 136.0 0.716 0.284 D:P06899:0.084
G:P04908:0.205
DT
DT
DG
DA
DC
DT
DA
DC
7.212
5.964
7.975
9.404
7.886
6.109
3.787
7.247
HB3
HB3
HB2
OE2
OE2
O
O
OE1
O3'
H5''
OP1
H3'
OP1
O3'
H5''
OP1
GLU G:45 G:42 185.0 0.974 S -68.3 -37.0 134.0 0.705 0.269 C:P04908:0.195
H:P06899:0.074
DT
DA
DC
DT
DT
DG
DA
DC
6.545
3.976
5.443
7.126
5.868
7.163
8.782
7.979
O
O
OE1
HB3
HB3
HB2
OE2
OE2
O3'
H5''
OP1
H4'
OP1
OP1
H3'
OP2
6r91 3 P04908 98.46 5e-89 EM
2019-06-12 GLU C:45 C:42 183.0 0.963 S -68.6 -37.9 141.0 0.742 0.221 D:P06899:0.058
G:P04908:0.163
DG
DT
DA
DT
DA
DA
DA
DC
DT
9.292
6.605
5.103
7.843
9.872
7.835
5.667
3.597
5.870
HG3
HG2
HG2
HB3
OE1
OE2
O
O
OE2
H21
H4'
H5'
OP1
O3'
OP1
O3'
H5''
OP1
GLU G:45 G:42 188.0 0.989 S -68.5 -39.0 147.0 0.774 0.215 H:P06899:0.053
C:P04908:0.163
DA
DA
DA
DG
DA
DA
DC
DT
5.703
3.273
5.616
6.411
5.420
7.894
9.218
7.715
O
O
OE2
HG2
HB3
HB3
OE2
OE2
O3'
H5''
OP1
O3'
H5''
OP1
O3'
OP1
6r92 6 P04908 98.46 5e-89 EM
2019-06-12 GLU F:45 C:42 190.0 1.0 S -69.3 -38.7 138.0 0.726 0.274 J:P04908:0.174
G:P06899:0.105
DT
DG
DG
DC
DA
DA
DT
DA
6.708
5.713
7.735
9.452
7.368
6.154
3.902
5.614
HG2
HG2
HB3
OE2
OE2
O
O
OE2
H5''
OP1
OP1
O3'
OP1
O3'
H5''
OP1
GLU J:45 G:42 190.0 1.0 S -68.1 -39.8 134.0 0.705 0.295 K:P06899:0.121
F:P04908:0.174
DA
DC
DA
DA
DT
DT
DT
DT
DA
6.196
3.808
5.448
9.798
5.794
4.967
7.432
9.775
8.032
O
O
OE2
HG2
HG2
HG2
HB3
OE2
OE2
O3'
H5''
OP1
O3'
O3'
OP1
OP1
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6r93 5 P04908 98.46 5e-89 EM
2019-06-12 GLU E:45 C:42 182.0 0.958 S -69.4 -39.1 128.0 0.674 0.284 F:P06899:0.111
I:P04908:0.179
DT
DT
DT
DG
DA
DC
DT
DA
DC
9.427
6.576
5.384
7.405
9.413
7.913
6.408
3.568
4.850
HG2
HG2
HG2
HB3
OE2
OE2
O
O
OE2
O3'
H4'
OP1
OP1
O3'
OP1
O3'
H5''
OP1
GLU I:45 G:42 187.0 0.984 S -68.2 -39.4 133.0 0.7 0.284 E:P04908:0.211
J:P06899:0.074
DT
DA
DC
DT
DT
DG
DA
DC
6.888
4.358
5.795
6.530
5.590
9.510
9.162
6.911
O
O
OE2
HG2
HG2
HB3
OE2
OE2
O3'
H5'
OP1
O3'
OP1
OP1
O3'
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6r94 5 P04908 98.46 5e-89 EM
2019-06-12 GLU E:45 C:42 199.0 1.0 S -67.9 -37.4 154.0 0.811 0.189 F:P06899:0.147
I:P04908:0.089
DT
DT
DG
DC
DT
DA
DC
6.192
4.438
8.362
8.610
6.749
4.296
6.669
OE2
OE2
HB2
OE1
O
O
O
O3'
OP1
OP1
OP1
O3'
H5''
OP2
GLU I:45 G:42 189.0 0.995 S -68.0 -39.0 147.0 0.774 0.221 E:P04908:0.126
J:P06899:0.095
DT
DA
DC
DT
DT
DG
DA
DC
6.503
4.225
6.480
7.206
6.265
8.198
8.901
7.269
O
O
OE2
HG2
HG2
HB3
OE2
OE2
O3'
H5''
OP1
O3'
OP1
OP1
O3'
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6t90 3 P04908 98.46 5e-89 EM
2020-05-06 GLU C:45 C:42 192.0 1.0 S -71.2 -34.7 142.0 0.747 0.253 G:P04908:0.111
D:P06899:0.153
DT
DA
DG
DG
DG
DA
DC
7.925
5.731
7.496
8.571
5.905
4.138
6.650
OE1
OE1
OE1
OE2
O
O
O
O3'
OP1
OP1
OP2
O3'
OP1
OP2
GLU G:45 G:42 186.0 0.979 S -68.1 -36.1 115.0 0.605 0.374 H:P06899:0.153
C:P04908:0.221
DT
DA
DG
DG
DG
DA
DC
PTD
5.929
4.177
6.631
8.943
7.386
7.692
9.847
9.936
O
O
O
CB
CG
OE1
CG
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
C1
6t93 3 P04908 98.46 5e-89 EM
2020-05-06 GLU C:45 C:42 183.0 0.963 S -69.7 -37.8 112.0 0.589 0.374 D:P06899:0.158
G:P04908:0.216
DA
DG
DG
DG
DA
DC
7.473
7.495
9.755
6.036
4.171
6.640
CB
OE1
CG
O
O
O
C5'
OP1
OP2
O3'
OP1
OP2
GLU G:45 G:42 175.0 0.921 S -69.2 -41.1 132.0 0.695 0.226 C:P04908:0.105
H:P06899:0.121
DT
DA
DG
DG
DG
DA
DA
DC
6.522
4.592
6.271
8.846
7.413
7.538
9.455
7.693
O
O
OE2
CG
CG
CB
OE2
OE2
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
6usj 5 Q08AJ9 98.46 5e-89 EM
2020-10-14 GLU E:45 C:41 194.0 1.0 S -71.1 -25.6 120.0 0.632 0.368 F:P06899:0.105
I:Q08AJ9:0.284
DG
DG
DA
DA
DC
DT
DA
DG
9.931
7.405
7.867
8.898
7.758
5.964
3.910
6.310
CB
CB
C
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
C5'
OP2
GLU I:45 G:41 195.0 1.0 S -77.7 -22.0 117.0 0.616 0.384 J:P06899:0.111
E:Q08AJ9:0.3
DG
DA
DC
DT
DA
DG
DA
DG
4.819
3.733
7.388
9.718
7.072
7.749
8.936
7.358
O
O
O
CB
CB
C
OE1
OE1
O3'
C5'
P
O3'
C5'
OP1
O3'
OP2
GLU O:45 M:41 193.0 1.0 S -71.2 -25.6 120.0 0.632 0.368 S:Q08AJ9:0.284
P:P06899:0.095
DG
DG
DA
DA
DC
DT
DA
DG
9.930
7.405
7.866
8.898
7.757
5.965
3.911
6.312
CB
CB
C
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
C5'
OP2
GLU S:45 Q:41 194.0 1.0 S -77.6 -22.1 117.0 0.616 0.384 O:Q08AJ9:0.3
T:P06899:0.111
DG
DA
DC
DT
DA
DG
DA
DG
4.819
3.730
7.386
9.716
7.070
7.748
8.934
7.359
O
O
O
CB
CB
C
OE1
OE1
O3'
C5'
P
O3'
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O3'
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6v2k 3 Q08AJ9 98.46 5e-89 X-RAY
2020-11-25 GLU C:45 C:41 192.0 1.0 S -72.5 -28.5 119.0 0.626 0.374 D:P06899:0.068
G:Q08AJ9:0.311
DT
DT
DG
DT
DA
DT
DA
DC
7.319
6.078
9.284
9.499
8.074
5.888
4.185
5.998
CB
CB
C
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 184.0 0.968 S -74.6 -31.1 111.0 0.584 0.384 H:P06899:0.079
C:Q08AJ9:0.311
DA
DT
DA
DT
DG
DG
DA
DC
5.808
4.079
7.142
9.582
7.536
8.044
8.350
6.378
O
O
O
CB
CB
N
OE2
OE2
O3'
OP1
OP2
O3'
C5'
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6yov 3 P04908 98.46 5e-89 EM
2020-05-06 GLU C:45 C:42 192.0 1.0 S -89.3 -35.8 132.0 0.695 0.305 D:P06899:0.147
G:P04908:0.168
DT
DA
DG
DG
DG
DA
DC
8.929
6.740
8.020
8.496
5.974
4.209
6.440
OE1
OE1
OE1
OE2
O
O
O
O3'
OP1
OP2
OP2
O3'
OP1
OP2
GLU G:45 G:42 187.0 0.984 S -77.3 -32.8 116.0 0.611 0.373 H:P06899:0.2
C:P04908:0.174
DT
DA
DG
DG
DG
DA
DC
5.814
3.909
6.306
8.923
7.198
7.493
9.991
O
O
O
CB
OE2
OE1
CG
O3'
C5'
OP2
O3'
OP1
OP1
OP1
7bxt 3 P04908 98.46 5e-89 EM
2021-02-10 GLU C:45 C:41 186.0 0.979 S -81.8 -4.4 144.0 0.758 0.221 D:Q16778:0.132
G:P04908:0.084
DT
DA
DG
DA
DG
DG
DA
DC
8.603
6.546
7.590
9.815
8.141
5.801
3.969
6.193
OE2
OE2
OE2
OE1
OE1
O
O
O
O3'
OP1
OP2
O3'
OP2
O3'
C5'
OP2
GLU G:45 G:41 171.0 0.9 S -73.8 -59.9 96.0 0.505 0.395 H:Q16778:0.142
C:P04908:0.258
DT
DA
DG
DG
DG
DA
DC
6.305
4.454
6.438
9.766
7.397
8.016
8.729
O
O
O
CB
CB
CB
OE2
O3'
C5'
OP2
O3'
C5'
OP1
OP2
7c0m 3 P04908 98.46 5e-89 EM
2020-09-16 GLU C:45 C:41 180.0 0.947 S -68.2 -41.7 142.0 0.747 0.2 D:P06899:0.089
G:P04908:0.111
DT
DA
DG
DA
DG
DG
DA
DC
8.924
7.022
8.032
8.332
6.253
6.085
4.483
5.479
CG
CG
CB
OE2
OE2
O
O
OE1
C4'
C5'
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:45 G:41 195.0 1.0 S -60.1 -35.9 138.0 0.726 0.274 C:P04908:0.179
H:P06899:0.121
DT
DA
DG
DG
DG
DA
DC
5.881
4.292
6.402
7.004
4.995
7.579
9.065
O
O
O
OE1
OE1
OE1
OE1
O3'
OP1
OP2
O3'
OP1
OP1
OP1
GLU N:45 c:41 181.0 0.953 S -68.1 -41.8 142.0 0.747 0.206 O:P06899:0.089
R:P04908:0.121
DT
DA
DG
DA
DG
DG
DA
DC
8.924
7.023
8.033
8.331
6.253
6.084
4.483
5.478
CG
CG
CB
OE2
OE2
O
O
OE1
C4'
C5'
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O3'
OP1
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OP1
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GLU R:45 g:41 196.0 1.0 S -60.0 -35.9 140.0 0.737 0.263 N:P04908:0.174
S:P06899:0.126
DT
DA
DG
DG
DG
DA
DC
5.881
4.292
6.401
7.004
4.995
7.580
9.064
O
O
O
OE1
OE1
OE1
OE1
O3'
OP1
OP2
O3'
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OP1
OP1
7d1z 3 P04908 98.46 5e-89 EM
2021-02-10 GLU C:45 C:41 186.0 0.979 S -64.8 -18.8 140.0 0.737 0.242 F:P04908:0.105
D:P06899:0.137
DG
DT
DA
DG
DA
DG
DG
DA
DC
9.655
6.569
4.599
7.611
9.984
7.726
5.469
4.114
6.690
OE2
OE2
OE2
OE2
OE1
OE1
O
O
O
O3'
C4'
OP1
OP1
O3'
OP1
O3'
C5'
OP1
GLU F:45 G:41 186.0 0.979 S -60.9 -61.6 148.0 0.779 0.2 G:P06899:0.079
C:P04908:0.121
DT
DA
DG
DG
DG
DA
DA
DC
5.769
4.025
6.767
9.214
6.888
7.657
8.949
7.128
O
O
O
CB
CB
CB
OE2
OE2
O3'
OP1
OP1
O3'
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O3'
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7d20 3 P04908 98.46 5e-89 EM
2021-02-10 GLU D:45 C:41 191.0 1.0 S -61.0 -21.9 145.0 0.763 0.237 G:P04908:0.116
E:P06899:0.137
DG
DT
DA
DG
DG
DG
DA
DC
9.556
6.685
4.446
7.526
8.492
6.020
4.527
6.956
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C4'
OP1
OP1
OP1
O3'
C5'
OP1
GLU G:45 G:41 202.0 1.0 S -55.0 -52.8 152.0 0.8 0.2 K:P06899:0.121
D:P04908:0.147
DT
DA
DG
DG
DG
DA
DA
DC
6.023
4.407
6.777
7.559
5.322
7.931
8.865
6.902
O
O
O
OE1
OE1
OE1
OE2
OE2
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
7dbh 3 C0HKE1 98.46 5e-89 EM
2022-01-19 GLU C:45 C:41 154.0 0.811 S -47.1 -60.4 109.0 0.574 0.237 D:Q9D2U9:0.137
G:C0HKE1:0.1
DG
DT
DA
DG
DG
DG
DA
DC
9.439
7.728
5.236
6.552
9.261
6.005
4.707
6.144
OE2
OE2
OE1
OE1
CG
OE1
O
OE2
O3'
C5'
C5'
OP1
OP1
O3'
OP1
OP1
GLU G:45 G:41 184.0 0.968 S -65.7 -48.1 95.0 0.5 0.468 H:Q9D2U9:0.295
C:C0HKE1:0.232
DT
DA
DG
DG
DG
DA
DC
5.901
4.374
6.552
9.396
7.235
6.750
9.851
O
O
O
CB
CB
OE1
CG
O3'
C5'
OP2
O3'
O5'
OP1
OP1
7scy 5 Q08AJ9 98.46 5e-89 EM
2022-01-12 GLU E:45 C:41 193.0 1.0 S -68.7 -24.3 155.0 0.816 0.184 I:Q08AJ9:0.105
F:P06899:0.095
DG
DA
DC
DT
DA
DG
DA
DG
5.078
3.226
6.855
7.524
5.325
6.877
8.940
6.981
O
O
O
HB3
HB3
HB2
OE1
OE1
O3'
H5''
OP2
H5''
H5''
OP1
O3'
OP1
GLU I:45 G:41 189.0 0.995 S -67.6 -30.2 144.0 0.758 0.237 E:Q08AJ9:0.137
J:P06899:0.1
DG
DG
DA
DA
DC
DT
DA
DG
7.638
5.197
6.671
8.473
7.338
5.339
3.291
6.224
HB3
HB3
HB2
OE2
OE2
O
O
O
H5''
H5''
OP1
H3'
OP2
O3'
H5''
OP2
7scz 5 Q08AJ9 98.46 5e-89 EM
2022-01-19 GLU E:45 C:41 190.0 1.0 S -59.4 -39.2 119.0 0.626 0.374 F:P06899:0.111
I:Q08AJ9:0.263
DG
DA
DC
DT
DA
DG
DA
DG
6.318
3.291
6.770
7.833
4.881
6.417
9.300
7.743
O
O
O
HB3
HB2
HB2
OE2
OE1
O3'
H5''
OP2
H5''
H5''
OP1
H3'
OP2
GLU I:45 G:41 195.0 1.0 S -65.0 -31.8 138.0 0.726 0.274 J:P06899:0.132
E:Q08AJ9:0.168
DG
DG
DA
DA
DC
DT
DA
DG
8.025
5.470
6.327
9.267
7.710
6.344
3.408
6.662
HB3
HB3
HB2
OE2
OE2
O
O
O
H4'
H5''
OP1
H3'
OP2
O3'
H5''
OP2
7vbm 3 C0HKE1 98.46 5e-89 EM
2022-01-19 GLU C:45 C:41 191.0 1.0 S -66.1 -24.1 132.0 0.695 0.305 D:Q9D2U9:0.163
G:C0HKE1:0.147
DT
DA
DG
DA
DG
DG
DA
DC
6.601
4.457
7.046
9.659
7.893
5.940
4.652
6.858
OE1
OE1
OE1
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP2
O3'
OP1
OP1
GLU G:45 G:41 184.0 0.968 S -88.8 5.4 146.0 0.768 0.2 C:C0HKE1:0.011
H:Q9D2U9:0.189
DT
DA
DG
DG
DG
DA
DC
5.751
4.071
6.998
7.345
5.091
7.016
8.064
O
O
O
OE2
OE2
OE2
OE1
O3'
C5'
OP2
O3'
C5'
OP2
OP1
7cow 5 P04908 98.46 5e-89 X-RAY
2021-08-11 GLU E:44 C:41 189.0 0.995 S -75.2 -50.0 146.0 0.768 0.227 I:P04908:0.074
F:P06899:0.147
DT
DA
DG
DT
DA
DA
DA
DC
5.296
4.010
6.684
6.683
4.645
7.472
9.056
7.058
O
O
O
OE1
OE1
OE1
OE2
OE2
O3'
OP1
OP2
O3'
C5'
P
O3'
OP1
GLU I:44 G:41 182.0 0.958 S -61.1 -55.4 142.0 0.747 0.211 E:P04908:0.079
J:P06899:0.132
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.079
4.864
4.193
7.327
9.984
7.839
9.708
6.115
4.364
6.501
OE2
OE2
OE2
OE1
CG
OE2
OE2
O
O
O
O3'
O3'
OP1
OP2
O3'
OP1
OP2
O3'
OP1
OP2
GLU M:44 M:41 183.0 0.963 S -65.5 -48.2 132.0 0.695 0.268 N:P06899:0.163
Q:P04908:0.1
DG
DT
DA
DG
DG
DT
DG
DA
DC
9.833
6.381
4.723
7.567
7.700
9.686
5.876
4.312
6.673
OE2
OE2
OE2
OE1
OE2
OE2
O
O
O
N2
C5'
OP1
OP2
OP1
OP2
O3'
C5'
OP2
GLU Q:44 Q:41 190.0 1.0 S -71.5 -43.7 147.0 0.774 0.226 M:P04908:0.074
R:P06899:0.158
DT
DA
DG
DT
DA
DA
DA
DC
DC
5.569
4.015
6.353
6.645
4.619
7.680
8.765
6.937
9.639
O
O
O
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP1
O3'
OP1
P
O3'
OP1
OP2
6c0w 3 Q93077 98.46 5e-89 EM
2018-01-17 GLU C:42 C:41 202.0 1.0 S -79.8 -1.1 121.0 0.637 0.363 D:P62807:0.079
G:Q93077:0.353
DT
DA
DG
DA
DG
DG
DA
DC
9.844
7.574
8.269
9.140
7.644
6.318
4.649
7.099
OE1
OE1
C
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
C5'
OP1
GLU G:42 G:41 176.0 0.926 S -77.1 -28.0 132.0 0.695 0.231 H:P62807:0.111
C:Q93077:0.126
DT
DA
DG
DG
DG
DA
DC
6.036
4.688
6.207
6.202
5.662
8.291
8.324
O
O
OE2
OE1
OE1
OE1
OE2
O3'
OP1
OP1
O3'
O5'
OP1
OP1
6upk 3 Q93077 98.46 5e-89 EM
2019-12-11 GLU C:42 C:41 192.0 1.0 S -73.0 -31.5 170.0 0.895 0.105 D:P62807:0.116
DG
DT
DA
DG
DG
DA
9.930
8.735
6.881
9.232
4.609
3.066
O
CB
CB
CB
O
O
N2
C4'
OP1
OP1
O3'
OP1
6upl 3 Q93077 98.46 5e-89 EM
2019-12-11 GLU C:42 C:41 170.0 0.895 S -70.4 -37.2 122.0 0.642 0.253 D:P62807:0.116
G:Q93077:0.137
DT
DA
DG
DA
DG
DA
8.317
6.268
7.382
8.942
5.391
3.677
CG
CG
CB
OE1
O
O
C4'
C5'
OP2
O3'
O3'
C5'
GLU G:42 K:41 178.0 0.937 S -71.8 -63.3 141.0 0.742 0.195 C:Q93077:0.016
H:P62807:0.174
DC
DT
DA
DG
DG
DG
DA
8.335
6.820
5.361
7.110
3.909
3.227
6.126
OE2
O
O
OE2
OE2
OE1
OE1
O2
C4'
OP1
N2
O3'
O5'
OP1
2f8n 7 Q8CGP6 98.46 6e-89 X-RAY
2006-05-23 GLU J:61 K:41 168.0 0.884 S -86.0 -56.8 115.0 0.605 0.279 I:O75367:0.174
E:Q9D2U9:0.105
DT
DT
DG
DA
DC
DT
DA
DC
HOH
9.283
7.027
7.611
8.778
6.703
5.681
3.805
6.829
3.750
CB
CB
CB
OE2
OE2
O
O
O
OE1
O3'
O5'
OP1
O3'
OP2
O3'
OP1
OP2
O
6t79 3 P04908 98.46 7e-89 EM
2020-04-29 GLU C:63 C:41 191.0 1.0 S -76.8 -26.6 140.0 0.737 0.263 D:O60814:0.211
G:P04908:0.063
DT
DG
DT
DT
DC
DA
DA
DC
9.498
5.899
3.803
6.403
9.124
5.684
4.023
6.131
OE1
OE2
OE2
OE2
OE1
O
O
O
O3'
O3'
OP1
OP2
OP1
O3'
C5'
OP2
GLU G:63 G:41 198.0 1.0 S -76.8 -26.6 159.0 0.837 0.163 H:O60814:0.116
C:P04908:0.089
DG
DC
DC
DA
DT
DT
DA
DA
DC
5.382
4.070
6.338
9.659
7.004
4.704
8.306
9.987
8.170
O
O
O
OE1
OE1
OE1
N
OE2
OE2
O3'
O5'
OP2
O3'
O3'
OP1
OP1
O3'
OP2
6t7a 3 P04908 98.46 7e-89 EM
2020-04-29 GLU C:63 C:41 202.0 1.0 S -81.6 -44.4 154.0 0.811 0.189 G:P04908:0.132
D:O60814:0.116
DT
DG
DT
DT
DC
DA
DA
DC
9.888
6.594
4.081
8.769
8.095
5.869
4.044
6.725
OE1
OE1
OE1
OE1
OE2
O
O
O
O3'
O3'
OP1
OP2
OP1
O3'
C5'
OP2
GLU G:63 G:41 201.0 1.0 S -81.6 -44.4 132.0 0.695 0.305 H:O60814:0.105
C:P04908:0.258
DG
DC
DC
DA
DT
DT
DA
DA
DC
6.228
4.602
6.784
9.750
5.565
3.867
9.011
9.587
8.225
O
O
O
OE1
OE1
OE1
N
OE2
OE2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
6t7b 3 P04908 98.46 7e-89 EM
2020-04-29 GLU C:63 C:41 93.0 NA S -81.7 -44.4 85.0 NA NA D:O60814:NA
DG
DT
DT
DA
DA
DC
9.191
7.405
8.773
5.869
4.043
6.725
C
CA
N
O
O
O
C4'
OP1
OP1
O3'
C5'
OP2
GLU G:63 G:41 92.0 NA S -81.7 -44.4 86.0 NA NA H:O60814:NA
DG
DC
DC
DT
DT
DA
6.228
4.603
6.785
7.970
6.800
9.011
O
O
O
C
CA
N
O3'
OP1
OP1
O3'
OP1
OP1
6t7c 3 P04908 98.46 7e-89 EM
2020-04-29 GLU C:63 C:41 200.0 1.0 S -82.2 -44.9 145.0 0.763 0.237 D:O60814:0.116
G:P04908:0.174
DG
DT
DT
DC
DA
DA
DC
6.760
4.393
8.738
8.225
5.898
4.097
6.847
OE1
OE1
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
C5'
OP2
GLU G:63 G:41 201.0 1.0 S -82.1 -44.9 151.0 0.795 0.205 H:O60814:0.111
C:P04908:0.153
DG
DC
DC
DA
DT
DT
DA
DA
DC
6.075
4.434
6.707
9.651
5.492
3.873
9.064
9.676
8.318
O
O
O
OE1
OE1
OE1
N
OE2
OE2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
6t7d 3 P04908 98.46 7e-89 EM
2020-04-29 GLU C:63 C:41 89.0 NA S -75.6 -59.5 78.0 NA NA D:O60814:NA
DT
DT
DA
DA
DC
8.071
8.592
5.261
3.247
7.589
C
N
O
O
O
C5'
OP1
O3'
OP1
OP2
GLU G:63 G:41 89.0 NA S -75.5 -59.5 80.0 NA NA H:O60814:NA
DT
DG
DC
DC
DT
DT
DA
9.754
5.920
3.971
9.155
9.713
8.024
8.565
O
O
O
O
C
C
N
O3'
O3'
OP2
OP2
O3'
C5'
OP1
6jr0 3 P04908 97.69 7e-89 X-RAY
2019-10-02 GLU C:45 C:41 172.0 0.905 S -60.0 -31.5 133.0 0.7 0.205 G:P04908:0.105
D:P06899:0.1
DA
DT
DA
DT
DG
DG
DA
DC
HOH
5.986
4.031
6.061
7.531
6.023
7.969
9.839
7.518
2.994
O
O
OE2
OE1
OE1
CB
OE2
OE2
N
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
O
GLU G:45 G:41 184.0 0.968 S -58.2 -36.5 142.0 0.747 0.221 C:P04908:0.063
H:P06899:0.163
DT
DT
DT
DG
DA
DT
DA
DC
HOH
8.092
4.540
3.183
7.963
9.457
5.988
4.151
6.289
3.611
OE2
OE1
OE1
OE1
OE2
O
O
O
O
O3'
O3'
OP1
OP1
OP1
O3'
OP1
OP2
O
6fml 11 P0C0S9 100.0 9e-89 EM
2018-04-25 GLU O:41 O:41 190.0 1.0 S -65.9 -65.5 149.0 0.784 0.216 S:P0C0S9:0.053
P:P62807:0.168
DG
DA
DC
DG
DT
DA
DG
DG
6.234
4.295
6.811
8.978
6.290
4.358
6.962
9.175
O
O
O
OE2
OE2
OE2
OE1
OE2
O3'
C5'
OP1
N2
O3'
C5'
OP1
OP1
GLU S:41 S:41 190.0 1.0 S -65.7 -44.4 145.0 0.763 0.237 T:P62807:0.168
O:P0C0S9:0.063
DG
DG
DG
DA
DC
DT
DA
DG
9.120
6.512
4.821
7.564
8.288
5.937
3.933
6.535
OE2
OE2
OE1
OE1
OE2
O
O
O
O3'
O3'
C5'
OP1
OP1
O3'
C5'
OP2
6x59 3 P0C0S8 100.0 9e-89 EM
2020-09-16 GLU C:41 C:41 183.0 0.963 S -73.3 -40.2 120.0 0.632 0.331 G:P0C0S8:0.142
D:P62807:0.189
DT
DA
DG
DG
DA
DC
9.657
7.005
7.161
5.690
4.118
6.939
CB
CB
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
OP2
GLU G:41 G:41 184.0 0.968 S -74.5 -38.5 144.0 0.758 0.21 H:P62807:0.153
C:P0C0S8:0.053
DT
DA
DG
DG
DG
DA
DC
6.016
4.563
6.990
6.248
4.535
7.120
7.977
O
O
O
OE1
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP1
6x5a 3 P0C0S8 100.0 9e-89 EM
2020-09-16 GLU C:41 C:41 181.0 0.953 S -74.4 -39.8 121.0 0.637 0.316 G:P0C0S8:0.137
D:P62807:0.179
DT
DA
DG
DG
DA
DC
9.310
6.917
7.708
5.392
3.596
6.988
CB
CB
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
OP2
GLU G:41 G:41 188.0 0.989 S -74.8 -39.0 125.0 0.658 0.331 H:P62807:0.121
C:P0C0S8:0.211
DT
DA
DG
DG
DG
DA
DC
5.858
4.510
7.187
7.959
6.312
8.332
9.806
O
O
O
CB
CB
CB
OE1
O3'
C5'
OP2
O3'
C5'
OP1
OP1
6xjd 3 P0C0S8 100.0 9e-89 EM
2020-09-16 GLU C:41 C:41 182.0 0.958 S -107.1 -43.6 124.0 0.653 0.305 G:P0C0S8:0.063
D:P62807:0.237
DG
DT
DA
DG
DC
DG
DA
DC
9.808
8.680
6.615
7.443
9.784
4.563
3.452
6.651
O
OE2
OE2
OE2
O
O
O
O
N2
O3'
OP1
OP2
O3'
O3'
O5'
OP2
GLU G:41 G:41 157.0 0.826 S -71.3 -54.5 141.0 0.742 0.084 C:P0C0S8:0.016
H:P62807:0.074
DC
DT
DA
DG
DA
DG
DG
DG
DA
DC
9.155
4.503
2.938
5.916
8.612
8.356
7.901
6.557
8.728
9.413
OE2
O
O
OE2
OE2
OE2
OE1
OE1
OE1
CG
O2
O3'
OP1
P
C2
N2
C4'
C5'
OP1
OP1
7e8d 3 P0C0S8 100.0 9e-89 EM
2021-11-10 GLU C:41 C:41 187.0 0.984 S -80.5 -9.7 139.0 0.732 0.252 D:P06899:0.168
G:P0C0S8:0.084
DT
DA
DG
DG
DG
DA
DC
5.477
4.148
6.651
5.959
4.205
7.059
7.906
O
O
O
OE2
OE2
OE2
OE1
O3'
C5'
OP1
O3'
C5'
OP1
OP1
GLU G:41 G:41 181.0 0.953 S -78.0 -17.1 139.0 0.732 0.221 C:P0C0S8:0.079
H:P06899:0.142
DG
DT
DA
DG
DG
DG
DA
DC
9.596
6.334
4.278
7.136
8.542
5.460
4.084
6.568
OE2
OE2
OE2
CG
OE1
O
O
O
O3'
O3'
C5'
OP1
OP1
O3'
OP1
OP1
7jo9 3 P0C0S8 100.0 9e-89 EM
2020-09-16 GLU C:41 C:41 189.0 0.995 S -67.4 -43.0 144.0 0.758 0.237 D:P62807:0.147
G:P0C0S8:0.089
DG
DG
DA
DC
DT
DA
DG
7.474
5.570
7.384
8.548
6.441
4.747
7.142
OE1
OE1
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
GLU G:41 G:41 192.0 1.0 S -67.5 -42.9 148.0 0.779 0.221 C:P0C0S8:0.1
H:P62807:0.132
DG
DA
DC
DT
DA
DG
DG
6.614
4.852
7.262
7.083
5.570
7.267
8.305
O
O
O
OE2
OE1
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
7joa 3 P0C0S8 100.0 9e-89 EM
2020-09-16 GLU C:41 C:41 189.0 0.995 S -67.3 -41.0 140.0 0.737 0.258 D:P62807:0.153
G:P0C0S8:0.105
DG
DG
DA
DC
DT
DA
DG
7.837
5.555
7.247
8.714
6.700
5.121
7.223
OE1
OE2
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP1
GLU G:41 G:41 188.0 0.989 S -67.4 -41.0 137.0 0.721 0.268 H:P62807:0.158
C:P0C0S8:0.116
DG
DA
DC
DT
DA
DG
DG
6.587
5.045
7.485
7.147
5.205
6.930
8.771
O
O
O
OE2
OE1
OE1
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
2rvq 1 P04908 98.46 1e-88 NMR
2016-05-25 GLU A:45 C:41 153.0 0.805 S -61.6 -39.1 117.0 0.616 0.189 B:P06899:0.189
7bg9 4 B2R5B3 99.23 1e-88 EM
2021-04-28 GLU D:42 L:42 193.0 1.0 S -80.0 -47.9 191.0 1.0 0.0 C:B4DR52:0.011
G
C
C
G
C
9.424
7.628
6.760
7.537
9.964
OE2
O
O
O
O
OP2
N4
N4
O6
N4
6jr1 3 P04908 96.92 1e-88 X-RAY
2019-10-02 GLU C:45 C:41 191.0 1.0 S -66.6 -34.0 154.0 0.811 0.189 D:P06899:0.137
G:P04908:0.058
DT
DT
DT
DG
DA
DT
DA
DC
HOH
7.890
5.236
4.585
9.078
9.459
5.940
4.107
6.328
3.145
OE2
OE2
OE1
CB
OE2
O
O
O
N
O3'
O3'
OP1
OP1
OP2
O3'
OP1
OP2
O
GLU G:45 G:41 186.0 0.979 S -65.2 -35.9 143.0 0.753 0.226 H:P06899:0.153
C:P04908:0.074
DA
DT
DA
DT
DT
DG
DG
DC
HOH
5.986
4.103
7.206
9.722
6.689
4.793
7.547
8.495
2.949
O
O
O
OE1
OE1
OE1
OE2
OE1
N
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
O
5kgf 3 P0C0S8 97.69 1e-88 EM
2016-07-27 GLU C:42 C:41 188.0 0.989 S -60.6 -45.7 136.0 0.716 0.273 G:P0C0S8:0.105
D:P62807:0.174
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.964
6.226
4.465
6.646
9.592
7.581
9.103
6.305
5.269
6.649
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
O
O3'
O3'
OP1
OP1
O3'
OP1
OP2
O3'
C5'
OP1
GLU G:42 G:41 181.0 0.953 S -60.6 -45.5 137.0 0.721 0.232 C:P0C0S8:0.047
H:P62807:0.184
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
5.475
4.175
6.429
8.864
5.918
4.107
6.648
9.919
7.493
9.809
O
O
O
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O3'
OP1
P
O3'
C4'
OP1
OP1
O3'
OP1
OP2
5gt3 3 P20671 99.22 2e-88 X-RAY
2017-02-15 GLU C:41 C:41 193.0 1.0 S -60.9 -65.2 144.0 0.758 0.242 G:P20671:0.147
D:Q96A08:0.111
DT
DT
DG
DT
DA
DT
DA
DC
HOH
8.117
6.431
7.443
9.616
7.537
6.369
4.501
6.579
7.733
CB
OE2
CB
OE2
OE2
O
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU G:41 G:41 187.0 0.984 S -61.1 -63.0 158.0 0.832 0.152 H:Q96A08:0.084
C:P20671:0.068
DA
DT
DA
DT
DT
DG
DG
DA
DC
6.318
4.397
5.888
9.785
7.691
6.457
7.810
8.746
6.397
O
O
OE1
OE1
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
7jzv 3 Q6FI13 98.45 3e-88 EM
2021-02-17 GLU C:45 N:41 185.0 0.974 S -60.9 -37.8 142.0 0.747 0.227 D:O60814:0.1
I:Q6FI13:0.126
DG
DG
DA
DA
DC
DT
DA
DG
8.831
6.536
7.613
8.612
6.771
5.845
4.236
5.708
CG
CG
CB
OE2
OE2
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU I:45 n:41 166.0 0.874 S -63.0 -38.0 114.0 0.6 0.274 C:Q6FI13:0.174
J:O60814:0.095
DG
DA
DC
DT
DA
DG
DA
DG
5.736
4.126
6.040
9.554
7.252
7.937
8.693
6.606
O
O
OE2
CG
CG
CB
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
6se0 3 Q6FI13 98.45 4e-88 EM
2019-08-14 GLU C:41 C:41 196.0 1.0 S -79.5 -24.4 141.0 0.742 0.258 D:P62807:0.079
G:Q6FI13:0.211
DT
DA
DG
DA
DG
DG
DA
DC
9.675
7.423
8.409
8.717
7.405
5.414
4.053
6.317
CB
CB
N
OE2
OE2
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
C5'
OP2
5z23 3 P04908 96.15 5e-88 X-RAY
2019-02-13 GLU C:45 C:41 198.0 1.0 S -65.1 -33.4 98.0 0.516 0.484 D:P06899:0.074
G:P04908:0.447
DT
DT
DG
DT
DA
DT
DA
DC
7.926
6.557
8.083
9.064
7.488
5.915
4.206
6.526
CB
CB
CB
OE1
OE1
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 154.0 0.811 S -75.2 -31.6 79.0 0.416 0.395 H:P06899:0.079
C:P04908:0.321
DA
DT
DA
DT
DG
DG
DA
DC
6.073
4.248
6.882
9.276
7.261
8.070
8.488
7.086
O
O
O
CB
CB
N
OE2
OE2
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
3x1s 3 P04908 98.45 5e-88 X-RAY
2015-09-23 GLU C:41 C:41 185.0 0.974 S -70.6 -31.9 139.0 0.732 0.242 D:P33778:0.053
G:P04908:0.189
DT
DT
DG
DT
DA
DT
DA
DC
HOH
8.044
6.393
8.564
9.238
7.591
5.738
4.044
5.907
3.002
CB
CB
C
OE2
OE2
O
O
OE2
OE1
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU G:41 G:41 185.0 0.974 S -67.9 -47.7 124.0 0.653 0.321 H:P33778:0.142
C:P04908:0.184
DA
DT
DA
DT
DG
DG
DA
DC
HOH
5.731
3.866
6.709
7.592
5.703
7.827
9.060
7.133
4.729
O
O
O
OE1
OE1
OE1
OE2
OE2
O
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP1
O
3x1v 4 P04908 98.45 5e-88 X-RAY
2015-09-23 GLU E:41 C:41 198.0 1.0 S -65.5 -42.3 121.0 0.637 0.363 F:P70696:0.084
I:P04908:0.326
DT
DT
DG
DT
DA
DT
DA
DC
7.353
5.625
8.100
9.455
8.023
6.111
4.399
5.938
CB
CB
CB
OE2
OE1
O
O
OE1
O3'
OP1
OP1
OP1
OP1
O3'
OP1
OP1
GLU I:41 G:41 196.0 1.0 S -64.8 -38.2 114.0 0.6 0.4 J:P70696:0.1
E:P04908:0.337
DA
DT
DA
DT
DG
DG
DA
DC
5.841
4.191
6.987
8.840
6.508
7.898
8.300
6.180
O
O
O
CG
CB
CB
OE2
OE2
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP1
7bwd 3 P04908 98.45 5e-88 EM
2021-04-14 GLU C:41 G:41 187.0 0.984 S -87.8 -45.2 139.0 0.732 0.252 D:O60814:0.179
H:P04908:0.074
DT
DA
DG
DG
DG
DA
DC
6.486
4.715
6.702
9.109
6.668
5.002
6.915
OE2
OE1
OE1
OE2
O
O
O
O3'
OP1
OP1
OP2
O3'
C5'
OP2
GLU H:41 C:41 181.0 0.953 S -89.7 -51.0 142.0 0.747 0.206 G:O60814:0.095
C:P04908:0.111
DT
DA
DG
DG
DG
DA
DC
6.745
4.839
6.169
9.178
7.328
8.256
8.338
O
O
OE2
CG
CG
CB
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
7a08 4 Q93077 98.45 7e-88 EM
2020-09-23 GLU D:41 b:41 186.0 0.979 S -70.7 -26.8 143.0 0.753 0.226 E:P62807:0.153
H:Q93077:0.074
DT
DA
DG
DA
DG
DT
DG
DA
DC
7.469
4.629
7.250
9.573
7.483
9.921
5.773
4.322
6.601
OE1
OE1
OE1
OE2
OE2
OE2
O
O
O
O3'
C5'
OP2
O3'
OP1
OP2
O3'
OP1
OP2
GLU H:41 f:41 192.0 1.0 S -55.1 -48.0 150.0 0.789 0.211 D:Q93077:0.063
I:P62807:0.158
DT
DA
DG
DG
DG
DA
DC
5.627
4.170
6.824
7.029
4.935
7.556
7.873
O
O
O
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
1eqz 2 P02263 96.92 3e-85 X-RAY
2000-04-17 GLU C:42 A:41 198.0 1.0 S -58.6 -42.7 124.0 0.653 0.347 G:P02263:0.268
D:P02279:0.142
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.385
6.852
8.050
9.228
7.873
5.972
4.208
6.919
2.762
CB
CB
CB
OE1
OE1
O
O
O
N
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU G:42 E:41 191.0 1.0 S -62.1 -36.5 122.0 0.642 0.358 H:P02279:0.105
C:P02263:0.263
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.763
4.022
6.631
9.063
6.668
8.079
9.960
8.140
3.190
O
O
O
CB
CB
CB
OE1
OE1
O
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP1
O
1hq3 1 P02263 96.92 3e-85 X-RAY
2001-01-24 GLU A:42 A:41 187.0 0.984 S -63.6 -38.9 147.0 0.774 0.21 B:P02279:0.168
E:P02263:0.042
HOH
2.734
N
O
GLU E:42 E:41 211.0 1.0 S -60.8 -45.8 172.0 0.905 0.095 A:P02263:0.063
F:P02279:0.142
HOH
2.761
N
O
1tzy 1 P02263 96.92 3e-85 X-RAY
2004-08-03 GLU A:42 A:41 195.0 1.0 S -66.0 -40.0 157.0 0.826 0.174 E:P02263:0.047
B:P02279:0.158
HOH
2.658
O
O
GLU E:42 E:41 207.0 1.0 S -58.9 -44.6 170.0 0.895 0.105 A:P02263:0.047
F:P02279:0.153
HOH
2.989
N
O
2aro 1 P02263 96.92 3e-85 X-RAY
2005-08-30 GLU A:42 A:41 198.0 1.0 S -63.5 -39.2 154.0 0.811 0.189 E:P02263:0.053
B:P02279:0.179
HOH
2.643
OE2
O
GLU E:42 E:41 212.0 1.0 S -61.4 -46.8 176.0 0.926 0.074 A:P02263:0.063
F:P02279:0.121
HOH
3.094
N
O
4kgc 3 Q6AZJ8 93.85 7e-85 X-RAY
2014-03-26 GLU C:42 C:41 196.0 1.0 S -62.7 -52.9 144.0 0.758 0.242 D:P02281:0.111
G:Q6AZJ8:0.163
DT
DT
DG
DA
DC
DT
DA
DC
HRU
8.049
6.805
7.282
9.139
6.823
6.014
4.261
7.354
2.836
OE1
OE1
CB
OE1
OE1
O
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
N1B
GLU G:42 G:41 197.0 1.0 S -50.2 -43.0 140.0 0.737 0.263 H:P02281:0.105
C:Q6AZJ8:0.2
DT
DA
DC
DT
DT
DT
DG
DA
DC
HRU
5.977
4.379
6.362
9.725
6.640
5.617
7.565
9.496
7.475
3.030
O
O
O
OE1
OE1
CB
CB
OE2
OE1
OE1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
C8A
4ld9 3 Q6AZJ8 93.85 7e-85 X-RAY
2013-08-14 GLU C:42 C:41 167.0 0.879 S -61.8 -47.0 125.0 0.658 0.221 D:P02281:0.116
G:Q6AZJ8:0.105
DG
DG
DA
DC
DT
DA
DG
5.551
4.343
7.542
8.116
6.007
4.345
6.806
OE2
OE2
CB
CG
O
O
OE1
O3'
C5'
OP1
OP1
O3'
OP1
OP1
GLU G:42 G:41 172.0 0.905 S -63.4 -57.8 132.0 0.695 0.21 C:Q6AZJ8:0.058
H:P02281:0.147
DG
DA
DC
DT
DA
DG
DG
5.263
3.414
6.455
7.492
5.072
6.916
9.332
O
O
O
OE1
OE1
CD
OE1
O3'
OP1
OP2
C4'
C5'
OP1
OP1
4zux 3 P06897 93.85 7e-85 X-RAY
2016-02-24 GLU C:42 C:41 182.0 0.958 S -52.6 -61.4 125.0 0.658 0.3 D:P02281:0.126
G:P06897:0.179
DG
DT
DA
DG
DG
DG
DA
DC
8.945
5.452
3.768
6.851
8.510
5.504
4.061
6.206
OE2
OE2
OE2
OE1
CG
O
O
O
O3'
O3'
C5'
OP1
OP1
O3'
OP1
OP2
GLU G:42 G:41 187.0 0.984 S -43.8 -64.6 149.0 0.784 0.2 H:P02281:0.042
C:P06897:0.158
DT
DA
DG
DG
DA
DA
DC
6.103
4.294
6.515
8.279
8.574
8.044
6.588
O
O
O
CB
CB
OE1
OE1
O3'
OP1
OP2
C5'
OP1
O3'
OP1
GLU M:42 M:41 187.0 0.984 S -52.6 -61.2 NA NA NA
GLU Q:42 Q:41 186.0 0.979 S -53.0 -61.0 NA NA NA
5e5a 4 Q6AZJ8 93.85 7e-85 X-RAY
2016-02-03 GLU E:42 C:41 189.0 0.995 S -57.5 -50.1 129.0 0.679 0.316 F:P02281:0.111
I:Q6AZJ8:0.211
DT
DT
DG
DT
DA
DT
DA
DC
HOH
7.755
6.452
7.624
9.808
7.850
6.206
4.242
6.673
2.791
CB
CG
CB
OE2
OE2
O
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU I:42 G:41 192.0 1.0 S -58.3 -48.0 148.0 0.779 0.221 J:P02281:0.111
E:Q6AZJ8:0.116
DA
DT
DA
DT
DT
DG
DG
DA
DC
DA
HOH
6.084
4.190
7.269
9.892
7.551
5.470
7.507
9.454
7.497
9.835
7.533
O
O
O
OE2
OE2
OE2
CB
OE2
OE2
OE2
OE1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP2
OP2
O
5o9g 3 Q6AZJ8 93.85 7e-85 EM
2017-10-11 GLU C:42 C:41 178.0 0.937 S -71.6 -44.0 143.0 0.753 0.184 D:P02281:0.084
G:Q6AZJ8:0.1
DT
DA
DG
DA
DG
DG
DA
DC
9.235
7.179
8.970
8.174
6.077
5.419
3.825
7.452
CG
CG
CB
OE2
OE2
O
O
OE2
C4'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:42 G:41 197.0 1.0 S -71.7 -32.4 158.0 0.832 0.168 C:Q6AZJ8:0.116
H:P02281:0.095
DT
DA
DG
DG
DG
DA
DA
DC
6.612
4.149
6.122
8.106
6.605
8.184
9.168
7.106
O
O
OE2
CG
CG
CB
OE2
OE2
O3'
C5'
OP1
O3'
C5'
OP1
O3'
OP1
5oxv 3 Q6AZJ8 93.85 7e-85 X-RAY
2017-10-11 GLU C:42 Q:41 186.0 0.979 S -42.6 -65.3 134.0 0.705 0.274 B:P02281:0.126
G:Q6AZJ8:0.153
DG
DG
DA
DA
DC
DT
DA
DG
7.504
5.218
7.266
8.862
6.853
5.778
4.213
6.861
OE1
OE1
CB
OE2
OE2
O
O
O
C4'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:42 M:41 185.0 0.974 S -53.2 -61.5 143.0 0.753 0.221 C:Q6AZJ8:0.084
F:P02281:0.137
DG
DA
DC
DG
DT
DA
DG
DA
DG
DT
5.814
4.486
6.278
9.590
6.101
4.429
7.148
9.578
7.789
9.484
O
O
O
OE2
OE2
OE2
OE1
CG
OE2
OE2
O3'
OP1
OP1
N2
O3'
C5'
OP1
O3'
OP1
OP2
GLU L:42 G:41 187.0 0.984 S -42.6 -65.3 135.0 0.711 0.273 P:Q6AZJ8:0.153
K:P02281:0.126
DG
DG
DA
DA
DC
DT
DA
DG
7.504
5.218
7.267
8.863
6.854
5.779
4.214
6.861
OE1
OE1
CB
OE2
OE2
O
O
O
C4'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU P:42 C:41 184.0 0.968 S -53.4 -61.4 142.0 0.747 0.221 O:P02281:0.132
L:Q6AZJ8:0.084
DG
DA
DC
DG
DT
DA
DG
DA
DG
DT
5.814
4.486
6.278
9.589
6.102
4.429
7.149
9.576
7.789
9.484
O
O
O
OE2
OE2
OE2
OE1
CG
OE2
OE2
O3'
OP1
OP1
N2
O3'
C5'
OP1
O3'
OP1
OP2
5oy7 4 Q6AZJ8 93.85 7e-85 X-RAY
2017-09-20 GLU D:42 O:41 185.0 0.974 S -42.8 -65.1 132.0 0.695 0.279 E:P02281:0.121
R:Q6AZJ8:0.153
DT
DA
DG
DG
DG
DA
DA
DC
5.778
4.213
6.861
7.505
5.218
7.267
8.863
6.852
O
O
O
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP2
C4'
OP1
OP1
O3'
OP1
GLU L:42 C:41 184.0 0.968 S -53.2 -61.5 141.0 0.742 0.226 P:Q6AZJ8:0.089
M:P02281:0.137
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.588
6.101
4.430
7.149
9.577
7.789
9.485
5.813
4.486
6.278
OE2
OE2
OE2
OE1
CG
OE2
OE2
O
O
O
N2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU P:42 G:41 188.0 0.989 S -42.5 -65.3 135.0 0.711 0.278 Q:P02281:0.126
L:Q6AZJ8:0.153
DT
DA
DG
DG
DG
DA
DA
DC
5.778
4.215
6.861
7.505
5.217
7.268
8.861
6.853
O
O
O
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP2
C4'
OP1
OP1
O3'
OP1
GLU R:42 K:41 184.0 0.968 S -53.0 -61.7 144.0 0.758 0.21 D:Q6AZJ8:0.084
A:P02281:0.126
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.588
6.100
4.428
7.146
9.579
7.790
9.485
5.813
4.486
6.277
OE2
OE2
OE2
OE1
CG
OE2
OE2
O
O
O
N2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU S:42 S:41 183.0 0.963 S -53.1 -61.5 142.0 0.747 0.216 T:P02281:0.137
W:Q6AZJ8:0.084
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.588
6.100
4.429
7.147
9.576
7.788
9.482
5.814
4.486
6.279
OE2
OE2
OE2
OE1
CG
OE2
OE2
O
O
O
N2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU W:42 W:41 185.0 0.974 S -42.5 -65.2 131.0 0.689 0.285 S:Q6AZJ8:0.158
X:P02281:0.132
DT
DA
DG
DG
DG
DA
DA
DC
5.779
4.214
6.862
7.506
5.219
7.269
8.861
6.852
O
O
O
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP2
C4'
OP1
OP1
O3'
OP1
GLU AA:42 a:41 182.0 0.958 S -53.2 -61.4 142.0 0.747 0.211 EA:Q6AZJ8:0.084
BA:P02281:0.126
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.588
6.099
4.428
7.149
9.577
7.789
9.485
5.813
4.486
6.277
OE2
OE2
OE2
OE1
CG
OE2
OE2
O
O
O
N2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU EA:42 e:41 187.0 0.984 S -42.6 -65.3 131.0 0.689 0.295 AA:Q6AZJ8:0.163
FA:P02281:0.132
DT
DA
DG
DG
DG
DA
DA
DC
5.778
4.215
6.860
7.503
5.218
7.267
8.863
6.852
O
O
O
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP2
C4'
OP1
OP1
O3'
OP1
5x0x 3 Q6AZJ8 93.85 7e-85 EM
2017-04-19 GLU C:42 C:41 183.0 0.963 S -73.0 -42.4 130.0 0.684 0.279 D:P02281:0.179
G:Q6AZJ8:0.1
DT
DA
DG
DG
DG
DA
DC
6.035
4.800
7.274
6.025
4.506
6.357
9.063
O
O
O
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP1
GLU G:42 G:41 186.0 0.979 S -73.0 -42.4 133.0 0.7 0.279 H:P02281:0.174
C:Q6AZJ8:0.105
DT
DA
DG
DG
DG
DA
DC
7.025
4.641
7.018
8.774
6.318
4.574
6.806
OE2
OE2
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP1
6i84 2 P06897 93.85 7e-85 EM
2019-01-02 GLU B:42 Q:41 197.0 1.0 S -86.0 -60.3 147.0 0.774 0.226 G:P02281:0.263
DG
DT
DA
DG
DC
DG
DA
DC
9.290
6.017
4.004
7.264
9.075
5.679
3.807
6.057
O
OE1
OE1
OE1
C
O
O
O
N2
O3'
OP1
P
O3'
O3'
O5'
OP2
GLU C:42 V:41 159.0 0.837 S -84.9 -34.5 138.0 0.726 0.111 J:P02281:0.111
DC
DT
DA
DG
DG
DG
DG
DA
DC
9.092
4.456
2.806
6.412
9.271
7.569
5.429
6.932
9.062
O
O
O
OE1
OE2
OE2
OE2
CG
OE1
O3'
O3'
OP1
OP1
N2
O3'
O5'
OP1
OP1
6j99 3 Q6AZJ8 93.85 7e-85 EM
2019-02-27 GLU C:42 C:41 196.0 1.0 S -66.8 -40.8 125.0 0.658 0.342 G:Q6AZJ8:0.216
D:P02281:0.158
DT
DA
DG
DA
DG
DG
DA
DC
7.816
5.684
7.174
9.112
7.434
6.837
4.670
6.637
OE1
OE1
OE1
OE2
OE2
O
O
O
O3'
OP1
OP2
O3'
OP1
O3'
C5'
OP2
GLU G:42 G:41 174.0 0.916 S -67.4 -59.2 124.0 0.653 0.263 H:P02281:0.195
C:Q6AZJ8:0.063
DT
DA
DG
DG
DG
DG
DA
DC
5.828
4.503
6.614
8.823
5.584
3.434
6.529
8.732
O
O
O
OE2
OE2
OE1
OE1
OE2
O3'
O5'
OP2
O3'
O3'
C5'
P
OP1
6kw3 3 Q6AZJ8 93.85 7e-85 EM
2019-11-13 GLU C:42 O:41 174.0 0.916 S -73.8 -56.2 136.0 0.716 0.2 F:Q6AZJ8:0.068
Y:A0A1L8G0X3:0.137
DC
DT
DA
DG
DG
DG
DG
DA
9.623
6.115
3.839
6.294
9.822
6.515
4.962
6.977
OE1
O
O
OE2
OE2
OE1
OE1
OE1
O2
O3'
C5'
OP1
N2
O3'
C5'
OP1
GLU F:42 S:41 176.0 0.926 S -78.6 -54.7 146.0 0.768 0.158 Z:A0A1L8G0X3:0.116
C:Q6AZJ8:0.042
DG
DT
DA
DG
DG
DC
DG
DA
DC
9.388
5.867
4.922
7.737
9.248
9.790
5.520
3.484
5.626
OE1
OE1
OE1
OE1
CG
OE1
O
O
OE2
N2
O3'
C5'
OP1
OP1
O2
O3'
OP1
OP1
6kw4 3 Q6AZJ8 93.85 7e-85 EM
2019-11-13 GLU C:42 O:41 162.0 0.853 S -73.1 -63.6 140.0 0.737 0.116 Y:A0A1L8G0X3:0.116
DC
DT
DA
DG
DA
DG
DG
DG
DA
9.350
5.728
3.340
5.198
9.781
8.371
6.803
4.320
6.698
OE2
O
OE2
OE2
OE2
OE2
OE1
OE1
OE1
O2
O3'
C4'
OP1
C2
N2
O3'
C5'
OP1
GLU F:42 S:41 161.0 0.847 S -73.0 -63.7 133.0 0.7 0.147 X:A0A1L8G0X3:0.147
DG
DT
DA
DG
DC
DG
DA
DC
8.505
6.013
3.919
6.966
9.321
5.484
3.604
5.856
OE2
OE1
OE1
OE1
OE1
O
OE2
OE2
N2
O3'
C5'
P
O3'
O3'
C5'
OP1
6kw5 17 Q6AZJ8 93.85 7e-85 EM
2020-09-09 GLU S:42 T:41 186.0 0.979 S -75.7 -38.2 142.0 0.747 0.232 U:Q6AZJ8:0.111
V:A0A1L8G0X3:0.121
DT
DA
DG
DG
DG
DG
DA
DC
6.729
5.472
7.528
9.827
6.334
4.231
5.857
9.931
O
O
O
OE2
OE2
OE2
CB
OE2
O3'
C5'
OP2
O3'
O3'
OP1
OP1
OP2
GLU U:42 O:41 194.0 1.0 S -79.0 -48.7 133.0 0.7 0.3 S:Q6AZJ8:0.174
W:A0A1L8G0X3:0.147
DT
DA
DG
DA
DG
DG
DA
DC
9.408
7.399
9.383
9.881
7.548
6.584
4.667
5.240
OE1
OE1
OE1
OE2
OE2
O
O
O
O5'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
6n1z 2 Q6AZJ8 93.85 7e-85 X-RAY
2019-03-20 GLU B:42 B:42 177.0 0.932 S -104.3 5.6 160.0 0.842 0.09 C:P02281:0.089
GLU E:42 E:42 187.0 0.984 S -108.0 8.1 NA NA NA
6o96 3 Q6AZJ8 93.85 7e-85 EM
2019-04-24 GLU C:42 C:41 182.0 0.958 S -74.0 -43.8 139.0 0.732 0.226 D:P02281:0.116
G:Q6AZJ8:0.116
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
6.246
4.287
6.562
9.812
6.673
4.847
7.439
8.846
7.078
9.587
O
O
O
OE1
OE1
OE1
OE1
OE2
OE2
OE2
O3'
C5'
OP2
O3'
O3'
C5'
OP1
O3'
OP1
OP2
GLU G:42 G:41 191.0 1.0 S -77.1 -12.4 133.0 0.7 0.3 C:Q6AZJ8:0.121
H:P02281:0.189
DT
DA
DG
DA
DG
DG
DA
DC
6.729
4.603
6.105
9.814
7.897
6.062
4.048
6.308
OE2
OE2
OE2
OE1
OE1
O
O
O
O3'
O5'
OP1
O3'
OP1
O3'
C5'
OP2
6om3 3 Q6AZJ8 93.85 7e-85 X-RAY
2019-07-10 GLU C:42 C:41 191.0 1.0 S -64.1 -46.2 145.0 0.763 0.237 D:P02281:0.163
G:Q6AZJ8:0.079
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
5.816
4.168
6.850
9.223
5.784
3.831
6.942
9.482
7.473
9.197
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
OE2
O3'
C5'
OP2
O3'
O3'
C5'
OP1
O3'
OP1
OP2
GLU G:42 G:41 111.0 NA S -66.4 -45.5 79.0 NA NA H:P02281:NA
C:Q6AZJ8:NA
DT
DA
DG
DG
DG
DA
DC
9.088
6.835
7.585
9.955
5.966
4.372
6.468
CB
CB
CB
CB
O
O
O
O3'
C5'
OP1
OP1
O3'
C5'
OP2
GLU O:42 O:41 190.0 1.0 S -65.4 -40.2 NA NA NA
GLU S:42 S:41 187.0 0.984 S -67.2 -40.0 NA NA NA
6ryr 3 P06897 93.85 7e-85 EM
2020-07-15 GLU C:42 C:41 164.0 0.863 S -63.8 -41.8 117.0 0.616 0.247 D:P02281:0.126
G:P06897:0.121
DG
DT
DA
DG
DG
DG
DA
DC
9.961
5.735
5.395
7.313
8.171
6.424
4.091
6.390
OE1
OE1
OE1
OE2
OE1
O
O
O
O3'
O3'
C5'
OP1
OP1
O3'
OP1
OP2
GLU G:42 G:41 188.0 0.989 S -83.6 -11.8 141.0 0.742 0.247 C:P06897:0.079
H:P02281:0.163
DT
DA
DG
DG
DG
DA
DC
5.477
3.889
6.566
7.120
4.908
6.829
8.230
O
O
O
OE2
OE2
OE2
OE1
O3'
C5'
OP2
O3'
C5'
OP1
OP1
6ryu 3 P06897 93.85 7e-85 EM
2020-07-15 GLU C:42 C:41 192.0 1.0 S -73.6 -50.5 136.0 0.716 0.284 D:P02281:0.158
G:P06897:0.137
DT
DA
DG
DG
DG
DA
DC
5.840
5.052
7.256
8.641
5.962
4.193
6.726
OE2
OE2
OE1
OE2
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
OP2
GLU G:42 G:41 189.0 0.995 S -67.8 -48.2 119.0 0.626 0.369 H:P02281:0.147
C:P06897:0.221
DT
DA
DG
DG
DG
DA
DC
5.684
4.041
6.323
7.434
5.151
7.366
9.252
O
O
O
OE1
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP2
6vz4 3 Q6AZJ8 93.85 7e-85 EM
2020-12-02 GLU C:42 C:42 178.0 0.937 S -72.8 -40.9 132.0 0.695 0.242 D:Q92130:0.116
G:Q6AZJ8:0.126
DT
DA
DG
DG
DG
DA
DA
DC
6.164
4.432
5.935
8.482
6.256
7.086
9.311
7.044
O
O
OE2
CG
CG
CB
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
GLU G:42 G:42 180.0 0.947 S -72.5 -41.4 130.0 0.684 0.263 H:Q92130:0.126
C:Q6AZJ8:0.132
DT
DA
DG
DA
DG
DG
DA
DC
9.137
6.696
7.632
8.903
6.902
5.885
4.220
5.677
CG
CG
CB
OE2
OE2
O
O
OE2
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP1
6zhx 3 P06897 93.85 7e-85 EM
2020-12-23 GLU C:42 C:41 159.0 0.837 S -66.5 -30.1 118.0 0.621 0.216 G:P06897:0.1
D:P02281:0.116
DG
DT
DA
DG
DA
DG
DG
DA
DC
8.702
6.325
3.664
6.460
9.904
7.640
6.014
3.724
5.877
OE1
OE1
OE1
HB3
OE2
OE2
O
O
OE2
H22
H4'
H5''
OP1
O3'
OP1
O3'
H5''
OP1
GLU G:42 G:41 183.0 0.963 S -65.6 -27.0 140.0 0.737 0.226 C:P06897:0.089
H:P02281:0.137
DT
DA
DG
DG
DG
DG
DA
DA
DC
5.684
3.618
5.971
9.206
6.121
3.540
6.469
9.711
7.962
O
O
OE2
OE2
OE1
OE1
HB3
HG3
HG2
O3'
H5''
OP1
H22
H4'
H5''
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H3'
OP1
6zhy 3 P06897 93.85 7e-85 EM
2020-12-23 GLU C:42 C:41 156.0 0.821 S -61.1 -29.6 122.0 0.642 0.179 D:P02281:0.179
DG
DT
DA
DG
DG
DA
DC
8.095
5.717
2.864
6.475
5.829
3.470
6.007
OE2
OE2
OE1
OE1
O
O
O
H22
H4'
H5''
P
O3'
H5''
OP1
7nkx 13 P06897 93.85 7e-85 EM
2021-08-25 GLU M:42 c:41 192.0 1.0 S -62.9 -33.2 114.0 0.6 0.4 Q:P06897:0.305
N:P02281:0.116
DT
DA
DG
DG
DA
DC
9.343
6.814
6.979
6.241
4.547
6.058
CB
CB
CB
O
O
O
O3'
C5'
OP1
O3'
OP1
OP1
GLU Q:42 g:41 166.0 0.874 S -70.2 -37.5 104.0 0.547 0.327 R:P02281:0.163
M:P06897:0.168
DC
8.169
CB
OP1
7nky 22 P06897 93.85 7e-85 EM
2021-07-07 GLU V:42 c:41 187.0 0.984 S -64.2 -30.4 147.0 0.774 0.21 Z:P06897:0.105
W:P02281:0.105
DG
DA
DC
DG
DT
DA
DG
4.909
3.434
4.516
9.986
7.618
5.969
8.136
O
O
OE2
O
OE2
CG
CB
O3'
C5'
OP1
N2
C5'
C5'
OP1
GLU Z:42 g:41 163.0 0.858 S -62.7 -39.8 125.0 0.658 0.2 V:P06897:0.116
AA:P02281:0.084
DT
DG
DA
DC
DC
8.873
8.508
8.817
6.411
9.659
OE1
OE1
OE2
OE2
OE2
OP1
OP1
O3'
OP1
OP2
7otq 4 P06897 93.85 7e-85 EM
2021-09-15 GLU D:42 C:41 193.0 1.0 S -62.6 -30.0 135.0 0.711 0.289 E:P02281:0.2
H:P06897:0.105
DT
DA
DG
DA
DG
DG
DA
DC
6.820
4.637
6.365
9.880
7.852
6.497
4.086
6.591
OE1
OE1
HB3
OE2
OE2
O
O
O
O3'
H5''
OP1
O3'
OP1
O3'
H5''
OP2
GLU H:42 G:41 192.0 1.0 S -63.4 -30.6 153.0 0.805 0.195 D:P06897:0.1
I:P02281:0.111
DT
DA
DG
DG
DG
DA
DA
DC
6.385
4.408
6.498
7.879
5.189
6.772
9.659
7.597
O
O
O
OE1
OE1
HB3
OE2
OE2
O3'
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6ftx 3 P06897 93.85 2e-84 EM
2018-08-08 GLU C:42 C:41 195.0 1.0 S -60.4 -68.4 140.0 0.737 0.263 G:P06897:0.063
D:F6TNY0:0.253
DT
DA
DG
DG
DG
DA
DC
6.294
4.380
5.475
9.434
6.056
4.381
7.886
OE2
OE1
OE1
OE2
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
OP1
GLU G:42 G:41 191.0 1.0 S -62.6 -38.7 134.0 0.705 0.295 H:F6TNY0:0.116
C:P06897:0.184
DT
DA
DG
DG
DG
DA
DC
6.801
4.563
5.984
7.660
5.312
7.590
8.703
O
O
O
OE1
OE1
CB
OE1
O3'
C4'
OP1
O3'
OP1
OP1
OP1
6g0l 5 P06897 93.85 2e-84 EM
2018-08-22 GLU G:42 G:41 193.0 1.0 S -62.5 -38.8 136.0 0.716 0.284 H:A0A1L8G0X3:0.121
C:P06897:0.179
DC
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
9.925
4.358
2.611
5.733
9.458
6.573
5.063
7.550
9.637
7.476
9.776
C
O
O
O
OE1
OE1
OE1
CB
OE2
OE1
OE1
O3'
O3'
C5'
P
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OP1
O3'
OP1
OP2
6ne3 3 P06897 93.85 2e-84 EM
2019-07-17 GLU C:42 C:41 158.0 0.832 S -69.4 -59.1 117.0 0.616 0.216 D:A0A1L8FQ56:0.158
G:P06897:0.058
DA
DG
DA
DC
DC
DA
DC
DG
9.547
6.712
4.447
6.866
9.505
5.804
4.217
6.489
OE1
OE1
OE1
OE2
CG
O
O
O
N3
C4'
C5'
P
OP1
O3'
OP1
OP2
GLU G:42 G:41 190.0 1.0 S -71.3 -19.8 138.0 0.726 0.274 C:P06897:0.105
H:A0A1L8FQ56:0.168
DG
DT
DC
DA
DG
DG
DG
5.113
3.730
6.591
6.496
4.069
6.181
9.125
O
O
O
OE2
OE2
OE2
OE1
O3'
OP1
OP1
O3'
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OP1
OP1
2hio 1 P02263 96.9 3e-84 X-RAY
2000-01-12 GLU A:41 A:41 194.0 1.0 S -82.0 -51.3 127.0 0.668 0.332 B:P02279:0.179
A:P02263:0.184
3c9k 1 P02263 96.9 3e-84 EM
2009-01-06 GLU A:41 A:41 194.0 1.0 S -81.9 -51.3 126.0 0.663 0.337 B:P0C1H5:0.195
E:P02263:0.174
B:P0C1H5:0.195
E:P02263:0.174
GLU E:41 E:41 194.0 1.0 S -81.9 -51.3 126.0 0.663 0.337 A:P02263:0.174
A:P02263:0.174
F:P0C1H5:0.195
F:P0C1H5:0.195
6ltj 3 P06897 93.85 7e-84 EM
2020-02-12 GLU C:42 C:41 191.0 1.0 S -79.2 -13.9 154.0 0.811 0.189 G:P06897:0.068
D:Q92131:0.132
DT
DA
DG
DA
DG
DG
DG
DC
6.489
4.552
6.047
9.781
6.435
4.143
6.761
8.438
O
O
O
OE1
OE1
OE1
OE1
OE2
O3'
O5'
OP1
N3
C4'
OP1
OP1
OP1
GLU G:42 G:41 187.0 0.984 S -70.6 -36.3 106.0 0.558 0.426 C:P06897:0.242
H:Q92131:0.211
DT
DA
DG
DG
DG
DA
DC
9.743
7.185
8.662
8.322
5.563
4.026
6.546
CB
CB
CB
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
C5'
OP1
6w5i 7 Q6AZJ8 93.8 9e-84 EM
2021-03-31 GLU G:44 I:41 181.0 0.953 S -68.4 -60.1 112.0 0.589 0.364 K:Q6AZJ8:0.221
H:P02281:0.147
DT
DA
DG
DG
DG
DA
DC
5.598
3.931
6.141
9.498
7.276
7.481
9.158
O
O
O
CB
CB
OE1
CG
O3'
OP1
OP2
O5'
C5'
OP1
OP2
GLU K:44 M:41 188.0 0.989 S -72.5 -27.6 117.0 0.616 0.373 G:Q6AZJ8:0.216
L:P02281:0.158
DT
DA
DG
DG
DG
DA
DC
9.618
7.636
8.620
8.454
5.888
4.115
5.376
CB
CB
OE1
CG
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
6kvd 4 Q9BTM1 97.58 1e-83 X-RAY
2019-12-18 GLU E:45 C:41 196.0 1.0 S -64.9 -31.1 160.0 0.842 0.158 F:P06899:0.079
I:Q9BTM1:0.111
DT
DT
DT
DG
DT
DA
DT
DA
DC
HOH
9.941
7.130
5.762
8.479
9.975
8.660
5.889
4.091
6.273
2.952
OE2
CB
CB
CB
OE1
OE2
O
O
O
N
O3'
O3'
OP1
OP1
OP1
OP1
O3'
OP1
OP2
O
GLU I:45 G:41 182.0 0.958 S -64.2 -30.1 142.0 0.747 0.211 J:P06899:0.132
E:Q9BTM1:0.084
DA
DT
DA
DT
DT
DG
DG
DC
HOH
5.831
4.108
7.127
9.435
6.468
4.652
7.833
8.656
2.872
O
O
OE1
OE1
OE1
OE1
OE2
OE2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP1
O
1zbb 5 P06897 93.8 1e-83 X-RAY
2005-07-12 GLU E:41 C:41 189.0 0.995 S -68.3 -34.1 131.0 0.689 0.306 I:P06897:0.211
F:P02281:0.111
DA
DT
DA
DT
DG
DG
DT
DA
5.885
4.003
7.056
9.596
7.141
8.214
9.463
8.113
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
GLU I:41 G:41 177.0 0.932 S -55.4 -47.3 126.0 0.663 0.269 E:P06897:0.084
J:P02281:0.184
DT
DT
DG
DG
DA
DA
DT
DA
8.911
6.244
3.904
6.074
9.248
6.092
4.296
7.147
OE2
OE1
OE1
OE1
OE2
O
O
O
O3'
O3'
C5'
OP2
OP1
O3'
OP1
OP2
GLU M:41 c:41 190.0 1.0 S -68.3 -34.1 131.0 0.689 0.311 N:P02281:0.111
Q:P06897:0.205
DA
DT
DA
DT
DG
DG
DT
DA
5.883
4.000
7.052
9.596
7.140
8.213
9.460
8.113
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
GLU Q:41 g:41 179.0 0.942 S -55.3 -47.4 126.0 0.663 0.279 M:P06897:0.084
R:P02281:0.195
DT
DT
DG
DG
DA
DA
DT
DA
8.909
6.242
3.904
6.073
9.250
6.093
4.296
7.150
OE2
OE1
OE1
OE1
OE2
O
O
O
O3'
O3'
C5'
OP2
OP1
O3'
OP1
OP2
2fj7 5 30268540 93.8 1e-83 X-RAY
2006-09-26 GLU E:41 C:41 153.0 0.805 S -72.7 -49.7 106.0 0.558 0.247 I:30268540:0.137
F:P02281:0.111
DA
DT
DA
DT
DG
DG
DG
DA
6.298
4.746
7.174
9.164
6.910
8.779
9.466
7.076
O
O
O
CG
CG
CB
OE2
OE2
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
GLU I:41 G:41 136.0 0.716 S -117.5 -84.3 106.0 0.558 0.158 E:30268540:0.089
J:P02281:0.068
DA
DA
DA
DA
DT
DA
DT
DG
DA
9.977
7.743
6.360
9.449
8.696
6.948
6.383
4.361
6.778
OE1
OE1
OE1
C
OE2
OE2
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
3kxb 3 Q6AZJ8 93.8 1e-83 X-RAY
2010-06-23 GLU C:41 C:41 188.0 0.989 S -54.2 -46.6 115.0 0.605 0.384 D:P02281:0.116
G:Q6AZJ8:0.279
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.372
6.799
7.973
9.554
8.269
5.830
3.935
7.092
8.170
CB
CB
CB
OE1
OE1
O
O
O
CG
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU G:41 G:41 168.0 0.884 S -67.0 -43.8 101.0 0.532 0.352 H:P02281:0.126
C:Q6AZJ8:0.226
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.837
4.318
7.240
8.808
6.341
7.721
9.765
7.871
3.208
O
O
O
CB
CB
CB
OE1
OE1
CB
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP2
O
3lja 3 Q6AZJ8 93.8 1e-83 X-RAY
2010-04-14 GLU C:41 C:41 192.0 1.0 S -60.3 -36.4 126.0 0.663 0.337 G:Q6AZJ8:0.242
D:P02281:0.132
DT
DG
DG
DT
DA
DA
DT
DA
9.593
6.889
7.856
9.050
8.015
5.789
4.202
7.098
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:41 G:41 181.0 0.953 S -54.4 -38.1 127.0 0.668 0.285 C:Q6AZJ8:0.111
H:P02281:0.174
DA
DT
DA
DT
DT
DG
DG
DA
5.899
4.313
7.224
9.510
6.385
4.206
6.103
8.837
O
O
O
OE2
OE1
OE1
OE1
OE2
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP2
3mvd 3 Q6AZJ8 93.8 1e-83 X-RAY
2010-08-25 GLU C:41 C:41 193.0 1.0 S -57.7 -39.6 146.0 0.768 0.232 D:P02281:0.184
G:Q6AZJ8:0.063
DT
DA
DG
DG
DG
DG
DA
DC
5.892
4.265
6.481
8.855
6.300
4.242
6.955
8.625
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
C5'
OP2
N2
C4'
OP1
OP2
OP1
GLU G:41 G:41 188.0 0.989 S -71.6 -28.4 152.0 0.8 0.189 C:Q6AZJ8:0.047
H:P02281:0.147
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.475
6.967
4.483
7.279
9.711
7.418
9.939
5.413
4.085
6.315
OE2
OE1
OE1
OE1
OE2
OE2
OE2
O
O
O
O3'
O3'
C5'
OP2
O3'
OP1
OP2
O3'
OP1
OP2
3reh 3 P06897 93.8 1e-83 X-RAY
2012-03-14 GLU C:41 C:41 194.0 1.0 S -61.3 -41.6 131.0 0.689 0.311 G:P06897:0.216
D:P02281:0.121
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.266
6.792
7.732
9.251
7.780
5.833
4.322
7.124
7.008
CB
CB
CB
OE1
OE1
O
O
O
OE2
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU G:41 G:41 192.0 1.0 S -57.1 -37.0 142.0 0.747 0.253 H:P02281:0.068
C:P06897:0.195
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.751
4.283
6.838
9.175
6.904
8.260
9.032
7.236
3.846
O
O
O
CB
CB
CB
OE1
OE1
CG
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP1
O
3rei 3 P06897 93.8 1e-83 X-RAY
2012-03-14 GLU C:41 C:41 192.0 1.0 S -57.2 -48.3 130.0 0.684 0.316 D:P02281:0.126
G:P06897:0.2
DT
DG
DG
DT
DA
DA
DT
DA
9.088
6.741
7.533
9.131
7.606
6.002
4.424
6.992
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU G:41 G:41 192.0 1.0 S -53.6 -36.8 135.0 0.711 0.289 H:P02281:0.089
C:P06897:0.211
DA
DT
DA
DT
DG
DG
DT
DA
PT
5.880
4.425
6.693
8.854
6.687
8.157
9.179
7.404
9.110
O
O
O
CB
CB
CB
OE1
OE1
N
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP1
PT
3rej 3 P06897 93.8 1e-83 X-RAY
2012-03-14 GLU C:41 C:41 187.0 0.984 S -57.6 -40.8 144.0 0.758 0.226 D:P02281:0.142
G:P06897:0.084
DT
DG
DT
DA
DC
DA
DC
DT
HOH
6.373
4.209
7.419
9.709
7.579
5.615
3.750
6.511
2.361
OE2
OE2
OE2
OE1
OE1
O
O
O
OE2
O3'
C5'
P
O3'
OP1
O3'
OP1
OP1
O
GLU G:41 G:41 197.0 1.0 S -59.7 -41.4 150.0 0.789 0.211 C:P06897:0.153
H:P02281:0.095
DC
DA
DC
DG
DT
DC
DC
DT
HOH
5.811
4.163
6.424
6.948
4.744
7.760
8.929
6.685
4.368
O
O
O
OE1
OE1
CB
OE2
OE2
N
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
O
3rek 3 P06897 93.8 1e-83 X-RAY
2012-03-14 GLU C:41 C:41 188.0 0.989 S -51.6 -40.0 146.0 0.768 0.221 D:P02281:0.126
G:P06897:0.095
DG
DT
DG
DT
DA
DC
DA
DC
DT
9.966
6.185
4.050
7.556
9.909
7.756
5.765
3.967
6.310
OE2
OE2
OE2
OE2
OE1
OE1
O
O
O
O3'
O3'
OP1
P
O3'
OP1
O3'
OP1
OP1
GLU G:41 G:41 195.0 1.0 S -58.9 -48.2 151.0 0.795 0.205 H:P02281:0.1
C:P06897:0.126
DC
DA
DC
DG
DT
DC
DC
DT
5.786
4.162
6.354
6.720
4.570
7.613
8.789
6.513
O
O
O
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
3rel 3 P06897 93.8 1e-83 X-RAY
2012-03-14 GLU C:41 C:41 189.0 0.995 S -53.6 -39.8 146.0 0.768 0.227 D:P02281:0.137
G:P06897:0.084
DG
DT
DG
DT
DC
DA
DC
DT
9.934
6.296
4.009
7.523
7.618
5.588
3.852
6.219
OE2
OE2
OE2
OE2
OE1
O
O
O
O3'
O3'
C5'
P
OP1
O3'
OP1
OP1
GLU G:41 G:41 195.0 1.0 S -48.4 -56.6 148.0 0.779 0.221 H:P02281:0.095
C:P06897:0.153
DC
DA
DC
DG
DT
DC
DC
DT
5.920
4.336
6.272
6.919
4.892
7.667
9.287
6.926
O
O
O
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
3tu4 3 Q6AZJ8 93.8 1e-83 X-RAY
2011-11-23 GLU C:41 C:41 185.0 0.974 S -58.8 -34.9 138.0 0.726 0.248 D:P02281:0.163
G:Q6AZJ8:0.084
DT
DA
DG
DG
DG
DG
DA
DC
5.763
4.414
6.475
9.221
5.999
4.116
7.252
8.458
O
O
O
OE1
OE1
OE1
OE2
CG
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP1
GLU G:41 G:41 177.0 0.932 S -54.4 -33.6 131.0 0.689 0.243 H:P02281:0.168
C:Q6AZJ8:0.074
DG
DT
DA
DG
DG
DG
DA
DC
9.093
6.086
4.067
7.227
8.414
5.921
4.541
6.479
OE1
OE1
OE1
OE2
CG
O
O
O
N2
O3'
C5'
OP2
OP1
O3'
OP1
OP2
3ut9 3 Q6AZJ8 93.8 1e-83 X-RAY
2012-04-11 GLU C:41 C:41 193.0 1.0 S -51.3 -54.4 152.0 0.8 0.2 G:Q6AZJ8:0.089
D:P02281:0.132
DG
DT
DA
DG
DA
DC
DC
DG
DA
DC
HOH
9.805
6.794
4.738
7.696
8.321
6.360
9.418
5.701
4.202
6.377
4.957
OE1
OE1
OE1
OE1
OE2
OE2
OE2
O
O
O
N
O3'
O3'
OP1
OP2
O3'
OP1
OP2
O3'
OP1
OP2
O
GLU G:41 G:41 188.0 0.989 S -46.8 -65.3 144.0 0.758 0.231 C:Q6AZJ8:0.079
H:P02281:0.158
DG
DA
DC
DG
DT
DA
DG
DC
DC
HOH
5.819
4.396
6.402
9.667
6.797
4.665
7.354
7.813
9.959
4.207
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
N
O3'
OP1
OP2
N2
O3'
OP1
OP2
OP1
OP2
O
3uta 3 Q6AZJ8 93.8 1e-83 X-RAY
2012-04-11 GLU C:41 C:41 190.0 1.0 S -63.5 -41.3 139.0 0.732 0.268 D:P02281:0.1
G:Q6AZJ8:0.174
DT
DG
DG
DA
DC
DA
DT
DA
HOH
9.345
7.358
8.352
8.463
6.191
6.009
4.134
7.068
2.731
CB
CB
CB
OE1
OE1
O
O
O
N
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU G:41 G:41 195.0 1.0 S -56.0 -42.0 132.0 0.695 0.305 H:P02281:0.095
C:Q6AZJ8:0.237
DT
DA
DC
DT
DT
DT
DG
DT
DA
HOH
5.739
4.173
6.342
9.793
6.944
5.720
7.953
9.325
7.729
9.675
O
O
O
OE1
CB
CB
CB
OE1
OE1
OE2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP2
O
3utb 3 Q6AZJ8 93.8 1e-83 X-RAY
2012-04-11 GLU C:41 C:41 191.0 1.0 S -58.4 -47.4 148.0 0.779 0.221 D:P02281:0.153
G:Q6AZJ8:0.079
DG
DT
DG
DT
DC
DA
DC
DT
HOH
9.715
5.985
3.983
7.512
8.184
5.703
4.301
6.357
2.624
OE2
OE2
OE2
OE2
CG
O
O
O
OE2
O3'
O3'
OP1
P
OP1
O3'
OP1
OP1
O
GLU G:41 G:41 196.0 1.0 S -62.0 -43.7 151.0 0.795 0.205 H:P02281:0.095
C:Q6AZJ8:0.137
DC
DA
DC
DG
DT
DC
DC
DT
HOH
5.595
3.965
6.131
6.855
4.756
8.157
8.820
6.531
4.383
O
O
O
OE1
OE1
CB
OE2
OE2
CA
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
O
4r8p 3 Q6AZJ8 93.8 1e-83 X-RAY
2014-11-05 GLU C:41 C:41 193.0 1.0 S -65.8 -65.4 155.0 0.816 0.184 G:Q6AZJ8:0.042
D:P02281:0.158
DG
DT
DA
DG
DG
DG
DA
DC
8.814
6.163
4.401
7.189
9.025
6.143
4.254
6.926
OE2
OE2
OE2
CB
OE2
O
O
O
N2
O3'
C5'
OP1
OP1
O3'
C5'
OP1
GLU G:41 G:41 188.0 0.989 S -65.6 -44.5 146.0 0.768 0.221 C:Q6AZJ8:0.058
H:P02281:0.163
DT
DA
DG
DG
DG
DG
DA
DC
5.685
3.813
6.450
9.069
6.266
4.702
7.646
8.172
O
O
O
OE2
OE2
OE2
OE1
OE2
O3'
C5'
OP2
O3'
O3'
OP1
OP1
OP1
4wu8 5 P06897 93.8 1e-83 X-RAY
2015-09-02 GLU E:41 C:41 196.0 1.0 S -59.8 -44.5 120.0 0.632 0.368 F:P02281:0.158
I:P06897:0.268
DT
DG
DG
DT
DA
DA
DT
DA
9.469
7.029
8.057
9.326
7.870
6.211
4.305
6.984
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU I:41 G:41 196.0 1.0 S -50.0 -39.4 146.0 0.768 0.232 E:P06897:0.137
J:P02281:0.126
DA
DT
DA
DT
DT
DG
DG
DT
DA
5.849
4.232
6.948
9.843
7.602
5.294
7.546
9.734
7.787
O
O
O
OE1
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP2
O3'
C4'
OP1
OP1
O3'
OP2
4wu9 3 P06897 93.8 1e-83 X-RAY
2015-09-02 GLU C:41 C:41 190.0 1.0 S -55.6 -58.0 118.0 0.621 0.379 D:P02281:0.158
G:P06897:0.247
DT
DG
DG
DA
DA
DT
DA
8.764
6.617
7.680
8.445
6.158
4.329
7.031
CB
CB
CB
OE1
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
OP2
GLU G:41 G:41 199.0 1.0 S -59.9 -33.5 142.0 0.747 0.253 H:P02281:0.132
C:P06897:0.174
DA
DT
DA
DT
DG
DG
DA
5.958
4.018
6.982
7.346
4.905
8.008
8.439
O
O
O
OE1
OE1
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP2
OP2
5f99 3 P06897 93.8 1e-83 X-RAY
2016-02-03 GLU C:41 C:41 187.0 0.984 S -60.5 -56.1 149.0 0.784 0.2 D:P02281:0.126
G:P06897:0.068
DT
DG
DT
DG
DA
DC
DC
DA
DA
DC
HOH
9.775
7.008
4.748
7.775
8.477
6.645
9.292
5.409
4.038
5.390
2.760
OE2
OE1
OE1
CB
OE2
OE2
OE2
O
O
O
N
O3'
O3'
OP1
OP1
O3'
OP2
OP2
O3'
OP1
OP2
O
GLU G:41 G:41 185.0 0.974 S -47.0 -62.2 134.0 0.705 0.269 H:P02281:0.158
C:P06897:0.116
DG
DA
DC
DG
DC
DC
DG
DC
HOH
5.953
4.773
6.516
9.467
6.276
4.150
6.880
7.888
2.664
O
O
O
OE2
OE2
OE2
OE2
OE1
N
O3'
OP1
OP2
O3'
O3'
C5'
OP1
OP2
O
5hq2 3 Q6AZJ8 93.8 1e-83 X-RAY
2016-03-23 GLU C:41 G:41 115.0 NA S -65.7 -58.1 91.0 NA NA D:P02281:NA
C:Q6AZJ8:NA
DG
DA
DG
DG
DG
DA
6.716
7.687
8.810
9.903
7.387
5.137
O
CB
CB
CB
O
O
OP2
C5'
OP1
OP1
O3'
C5'
5nl0 3 P06897 93.8 1e-83 X-RAY
2017-05-17 GLU C:41 C:41 192.0 1.0 S -51.7 -54.2 150.0 0.789 0.211 G:P06897:0.095
D:P02281:0.126
DT
DA
DG
DA
DC
DC
DG
DA
DC
7.192
5.081
7.963
8.077
6.177
9.444
6.001
4.413
6.361
OE1
OE1
OE1
OE2
OE2
OE2
O
O
O
O3'
OP1
OP2
O3'
OP1
OP2
O3'
OP1
OP2
GLU G:41 G:41 191.0 1.0 S -51.5 -56.1 143.0 0.753 0.247 H:P02281:0.158
C:P06897:0.1
DG
DA
DC
DT
DA
DG
DA
DC
DC
6.132
4.681
6.274
7.256
5.016
7.938
9.438
7.293
9.751
O
O
O
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP2
O3'
OP1
OP2
O3'
OP1
OP2
GLU M:41 M:41 193.0 1.0 S -51.8 -54.3 NA NA NA
5ong 5 Q6AZJ8 93.8 1e-83 X-RAY
2017-11-22 GLU E:41 C:41 179.0 0.942 S -71.2 -43.8 143.0 0.753 0.189 I:Q6AZJ8:0.105
F:P02281:0.089
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.311
6.952
7.947
9.782
7.722
6.154
4.215
5.798
8.471
CG
CG
CB
OE2
OE2
O
O
OE2
O
C4'
C5'
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU I:41 G:41 180.0 0.947 S -67.4 -37.6 91.0 0.479 0.468 J:P02281:0.321
E:Q6AZJ8:0.226
DA
DT
DA
DT
DG
DG
5.757
3.829
6.859
9.301
6.790
6.901
O
O
O
CB
CB
OE1
O3'
OP1
OP2
O3'
C5'
OP1
5x0y 3 Q6AZJ8 93.8 1e-83 EM
2017-04-19 GLU C:41 C:41 194.0 1.0 S -64.9 -15.7 163.0 0.858 0.142 G:Q6AZJ8:0.079
D:P02281:0.079
DT
DA
DG
DG
DG
DA
DA
DC
6.334
4.601
6.357
8.614
6.704
8.437
9.254
7.117
O
O
O
OE2
OE1
N
OE2
OE2
O3'
C5'
OP2
C5'
OP1
OP1
O3'
OP1
GLU G:41 G:41 195.0 1.0 S -65.0 -15.7 165.0 0.868 0.132 H:P02281:0.079
C:Q6AZJ8:0.079
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.718
6.900
8.428
9.238
7.376
9.911
5.909
4.341
6.736
OE2
OE1
N
OE2
OE2
OE2
O
O
O
C5'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP2
5z3l 3 Q6AZJ8 93.8 1e-83 EM
2019-04-03 GLU C:41 C:41 172.0 0.905 S -72.6 -22.4 130.0 0.684 0.221 G:Q6AZJ8:0.079
D:P02281:0.142
DT
DA
DG
DG
DG
DG
DC
7.790
5.377
5.743
7.342
5.177
7.122
9.210
O
O
O
OE2
OE1
OE1
OE2
O3'
C4'
OP1
O3'
C5'
OP1
OP1
GLU G:41 G:41 175.0 0.921 S -72.6 -22.4 139.0 0.732 0.189 C:Q6AZJ8:0.063
H:P02281:0.132
DT
DA
DG
DG
DG
DA
DC
8.247
6.419
7.889
7.985
6.887
4.763
7.268
OE1
OE1
OE1
OE2
O
O
OE2
O3'
O5'
OP1
OP1
O3'
OP1
OP1
5z3o 3 Q6AZJ8 93.8 1e-83 EM
2019-04-03 GLU C:41 C:41 174.0 0.916 S -72.4 -23.7 141.0 0.742 0.174 D:P02281:0.121
G:Q6AZJ8:0.053
DT
DA
DG
DA
DG
DG
DG
DC
6.440
4.575
4.562
9.885
6.892
5.009
7.279
8.297
O
O
OE2
OE2
OE1
OE1
OE1
OE2
O3'
OP1
OP1
O3'
O3'
C5'
OP1
OP1
GLU G:41 G:41 174.0 0.916 S -72.3 -23.8 146.0 0.768 0.148 C:Q6AZJ8:0.042
H:P02281:0.111
DG
DT
DA
DG
DG
DG
DA
DC
9.978
7.831
5.882
8.122
7.750
5.758
3.737
6.306
OE2
OE1
OE1
OE1
CG
O
O
OE2
N2
O3'
O5'
OP1
OP2
O3'
OP1
OP1
5z3u 4 Q6AZJ8 93.8 1e-83 EM
2019-05-22 GLU D:41 C:41 185.0 0.974 S -72.0 -39.7 142.0 0.747 0.227 E:P02281:0.095
H:Q6AZJ8:0.132
DT
DA
DG
DG
DG
DA
DA
DC
6.409
4.591
5.988
7.916
6.140
7.835
9.739
7.333
O
O
O
OE2
OE1
OE1
OE2
OE2
O3'
OP1
OP2
C4'
OP1
OP1
O3'
OP1
GLU H:41 G:41 185.0 0.974 S -72.0 -39.7 142.0 0.747 0.227 D:Q6AZJ8:0.126
I:P02281:0.1
DG
DT
DA
DG
DG
DG
DA
DC
9.680
7.620
5.772
8.005
7.732
6.165
4.451
6.081
OE2
OE2
OE1
CB
OE2
O
O
OE2
O3'
C4'
OP1
OP1
OP2
O3'
OP1
OP1
5z3v 4 Q6AZJ8 93.8 1e-83 EM
2019-05-22 GLU D:41 C:41 192.0 1.0 S -79.2 -30.6 150.0 0.789 0.211 E:P02281:0.132
H:Q6AZJ8:0.095
DT
DA
DG
DG
DG
DA
DA
DC
6.201
4.548
6.839
7.540
5.630
7.404
9.328
7.418
O
O
O
OE2
OE2
OE1
OE2
OE2
O3'
C5'
OP2
O3'
OP1
OP1
O3'
OP1
GLU H:41 G:41 194.0 1.0 S -79.2 -30.6 154.0 0.811 0.189 D:Q6AZJ8:0.089
I:P02281:0.126
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.461
6.434
8.822
8.595
6.493
9.616
6.269
4.546
6.705
OE2
OE2
CB
OE2
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP2
6esf 3 Q6AZJ8 93.8 1e-83 EM
2017-12-20 GLU C:41 C:41 195.0 1.0 S -79.9 -24.7 155.0 0.816 0.184 D:P02281:0.126
G:Q6AZJ8:0.089
DG
DG
DG
DA
DA
DC
DT
DA
DG
9.698
7.569
5.325
8.229
8.742
8.008
6.567
4.348
6.245
OE2
OE1
OE1
N
OE2
OE2
O
O
O
O3'
O3'
OP1
OP1
O3'
OP1
O3'
C5'
OP2
GLU G:41 G:41 201.0 1.0 S -65.5 -30.8 161.0 0.847 0.153 C:Q6AZJ8:0.116
H:P02281:0.1
DG
DA
DC
DG
DT
DA
DG
DA
DG
DT
5.007
3.104
8.595
9.667
7.750
5.875
8.215
8.808
6.918
9.661
O
O
OE2
OE2
OE2
OE1
N
OE2
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
O3'
OP2
OP2
6esg 3 Q6AZJ8 93.8 1e-83 EM
2017-12-20 GLU C:41 C:41 204.0 1.0 S -77.8 -49.0 194.0 1.0 0.0 D:P02281:0.011
G:Q6AZJ8:0.037
DG
DG
DA
DA
DC
DT
DA
DG
8.923
6.716
8.679
8.660
6.803
5.388
3.342
6.711
OE2
OE1
N
OE2
OE2
O
O
O
C5'
OP1
OP1
O3'
OP2
O3'
C5'
P
GLU G:41 G:41 179.0 0.942 S -78.1 -48.9 155.0 0.816 0.126 H:P02281:0.126
DC
DG
DA
DC
DG
DT
DA
DG
DG
9.108
4.503
3.584
8.764
8.505
7.015
4.621
7.081
9.432
O
O
O
OE2
OE2
OE2
OE2
OE1
OE2
O3'
O3'
OP1
OP1
N2
O3'
OP1
OP2
OP1
6esh 3 Q6AZJ8 93.8 1e-83 EM
2017-12-20 GLU C:41 C:41 192.0 1.0 S -65.9 -37.5 190.0 1.0 0.0 D:P02281:0.005
G:Q6AZJ8:0.011
DA
DG
DG
DA
DC
DT
DA
DG
DT
9.982
9.052
8.077
9.649
7.433
4.822
2.902
3.117
9.795
OE2
OE1
OE1
OE1
OE1
O
OE2
OE2
OE2
C2
C5'
OP1
O3'
OP1
O3'
O3'
OP1
P
GLU G:41 G:41 188.0 0.989 S -74.8 -34.5 145.0 0.763 0.226 H:P02281:0.153
C:Q6AZJ8:0.074
DG
DA
DC
DT
DA
DG
DA
DG
5.792
4.262
6.481
7.820
5.462
7.562
9.909
7.763
O
O
O
OE2
OE1
OE1
OE2
OE2
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
6esi 3 Q6AZJ8 93.8 1e-83 EM
2017-12-20 GLU C:41 C:41 167.0 0.879 S -83.2 -37.5 167.0 0.879 0.0 DG
DG
DG
DT
DA
DG
8.372
7.217
7.277
5.060
3.012
4.041
OE2
OE1
OE1
O
O
OE2
O3'
OP1
OP1
O3'
OP1
OP1
GLU G:41 G:41 243.0 1.0 360.0 -24.7 208.0 1.0 0.0 H:P02281:0.184
DA
DC
DG
DA
DC
DT
DC
DG
DT
DA
DG
7.120
4.300
3.038
2.969
7.862
9.248
7.745
2.903
3.588
4.047
6.920
OE1
OE2
OE2
O
O
OE2
OE2
OE2
OE2
OE1
N
C2
O2
O4'
OP1
P
O4
O2
N2
O4'
O4'
OP1
6iro 4 Q6AZJ8 93.8 1e-83 EM
2019-04-03 GLU D:41 C:41 172.0 0.905 S -85.8 -22.9 138.0 0.726 0.179 E:P02281:0.116
H:Q6AZJ8:0.063
DT
DA
DG
DG
DG
DG
DC
6.463
4.964
5.605
7.274
5.474
6.392
8.349
O
O
OE2
OE1
OE1
OE1
OE2
O3'
C5'
OP1
O3'
O5'
OP1
OP1
GLU H:41 G:41 173.0 0.911 S -75.3 -22.8 147.0 0.774 0.137 D:Q6AZJ8:0.042
I:P02281:0.095
DT
DA
DG
DA
DG
DG
DA
DC
8.269
5.825
7.497
9.942
8.071
5.981
4.333
6.322
OE1
OE1
OE1
OE2
OE2
O
O
OE2
C4'
C5'
OP1
O3'
OP2
O3'
OP1
OP1
6jyl 3 Q6AZJ8 93.8 1e-83 EM
2019-05-29 GLU C:41 C:41 190.0 1.0 S -76.4 -46.4 143.0 0.753 0.247 D:P02281:0.132
G:Q6AZJ8:0.116
DT
DA
DG
DG
DG
DA
DC
6.170
4.396
6.958
7.427
5.313
8.021
7.939
O
O
O
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
GLU G:41 G:41 189.0 0.995 S -71.1 -52.4 147.0 0.774 0.221 C:Q6AZJ8:0.095
H:P02281:0.126
DG
DT
DA
DG
DG
DG
DA
DC
9.881
7.627
5.444
7.799
7.880
6.152
4.378
7.027
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
O3'
OP1
OP1
OP1
O3'
OP1
OP2
6k1p 3 Q6AZJ8 93.8 1e-83 EM
2019-05-29 GLU C:41 C:41 184.0 0.968 S -79.0 -54.9 141.0 0.742 0.226 D:P02281:0.111
G:Q6AZJ8:0.111
DT
DA
DG
DG
DG
DA
DC
6.525
4.550
7.155
7.202
5.577
7.583
8.308
O
O
O
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
GLU G:41 G:41 190.0 1.0 S -69.5 -45.8 135.0 0.711 0.289 C:Q6AZJ8:0.132
H:P02281:0.153
DT
DA
DG
DG
DG
DA
DC
7.835
5.533
7.714
8.771
6.537
4.516
7.334
OE2
OE2
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
6kiu 3 Q6AZJ8 93.8 1e-83 EM
2019-09-11 GLU C:41 C:41 190.0 1.0 S -79.3 -46.7 137.0 0.721 0.279 D:P02281:0.163
G:Q6AZJ8:0.116
DT
DA
DG
DG
DG
DA
DC
7.897
5.563
7.710
9.610
5.759
3.859
7.238
OE1
OE1
OE1
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP2
GLU G:41 G:41 198.0 1.0 S -84.1 -37.8 158.0 0.832 0.168 C:Q6AZJ8:0.074
H:P02281:0.142
DT
DA
DG
DG
DG
DA
DC
5.913
4.122
7.236
7.797
6.061
8.253
7.952
O
O
O
OE1
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP1
6kiv 3 Q6AZJ8 93.8 1e-83 EM
2019-09-11 GLU C:41 C:41 185.0 0.974 S -75.6 -60.7 129.0 0.679 0.295 D:P02281:0.132
G:Q6AZJ8:0.163
DT
DA
DG
DG
DG
DA
DC
8.262
6.145
7.966
9.112
6.195
4.189
7.041
OE1
OE1
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
GLU G:41 G:41 186.0 0.979 S -78.0 -48.6 135.0 0.711 0.268 H:P02281:0.168
C:Q6AZJ8:0.095
DT
DA
DG
DG
DG
DA
DC
6.703
4.476
7.081
6.815
5.162
7.303
9.709
O
O
O
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP2
6kiw 3 Q6AZJ8 93.8 1e-83 EM
2019-09-11 GLU C:41 C:41 196.0 1.0 S -90.2 -31.1 126.0 0.663 0.337 G:Q6AZJ8:0.242
D:P02281:0.126
DT
DA
DG
DG
DG
DA
DC
9.190
7.152
8.072
9.069
5.969
4.154
7.001
OE1
OE1
OE1
OE2
O
O
O
O3'
OP1
OP1
OP2
O3'
OP1
OP2
GLU G:41 G:41 187.0 0.984 S -76.0 -39.2 127.0 0.668 0.316 C:Q6AZJ8:0.116
H:P02281:0.2
DT
DA
DG
DG
DG
DA
DC
6.534
4.779
7.568
6.864
5.126
6.811
9.293
O
O
O
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP2
6kix 3 Q6AZJ8 93.8 1e-83 EM
2019-09-11 GLU C:41 C:41 177.0 0.932 S -75.9 -62.7 116.0 0.611 0.321 G:Q6AZJ8:0.137
D:P02281:0.189
DT
DA
DG
DG
DA
DC
8.164
5.668
7.383
6.445
4.454
7.697
OE1
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
OP2
GLU G:41 G:41 178.0 0.937 S -79.7 -55.4 127.0 0.668 0.269 H:P02281:0.205
C:Q6AZJ8:0.063
DT
DA
DG
DG
DG
DA
DC
6.324
4.545
7.387
6.711
4.974
6.715
9.730
O
O
O
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
6kiz 3 Q6AZJ8 93.8 1e-83 EM
2019-09-11 GLU C:41 C:41 184.0 0.968 S -92.8 -58.3 127.0 0.668 0.3 D:P02281:0.142
G:Q6AZJ8:0.163
DT
DA
DG
DG
DG
DA
DC
8.824
6.523
8.376
9.328
5.946
3.889
7.149
OE1
OE1
OE1
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP2
GLU G:41 G:41 185.0 0.974 S -75.7 -61.8 138.0 0.726 0.248 C:Q6AZJ8:0.058
H:P02281:0.195
DT
DA
DG
DG
DG
DA
6.707
4.740
7.792
7.018
5.467
6.948
O
O
O
OE2
OE2
OE1
O3'
OP1
OP2
O3'
C5'
OP1
6nj9 3 P06897 93.8 1e-83 EM
2019-02-20 GLU C:41 C:41 187.0 0.984 S -68.9 -32.1 134.0 0.705 0.279 D:P02281:0.153
G:P06897:0.121
DT
DA
DG
DG
DG
DG
DA
DC
6.042
4.446
6.966
9.784
6.265
4.191
7.481
9.667
O
O
O
OE2
OE2
OE2
CB
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP1
OP1
GLU G:41 G:41 187.0 0.984 S -69.0 -32.0 135.0 0.711 0.273 C:P06897:0.116
H:P02281:0.158
DG
DT
DA
DG
DG
DG
DA
DC
9.929
5.795
4.285
7.649
9.631
5.950
4.372
6.996
OE2
OE2
OE2
CB
OE2
O
O
O
O3'
O3'
OP1
OP1
OP1
O3'
OP1
OP2
6nn6 3 P06897 93.8 1e-83 EM
2019-02-13 GLU C:41 C:41 161.0 0.847 S -73.2 -61.5 115.0 0.605 0.242 D:P02281:0.179
G:P06897:0.068
DT
DA
DG
DG
DA
DC
7.637
5.403
6.787
6.716
4.719
7.180
OE2
OE2
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
OP1
GLU G:41 G:41 165.0 0.868 S -74.8 -58.8 114.0 0.6 0.268 C:P06897:0.184
H:P02281:0.084
DT
DA
DG
DG
DA
DC
5.980
3.917
7.465
7.908
8.662
9.487
O
O
O
CB
CB
OE1
O3'
OP1
OP2
C5'
OP1
OP1
6nog 3 P06897 93.8 1e-83 EM
2019-02-20 GLU E:41 C:41 198.0 1.0 S -68.0 -37.7 154.0 0.811 0.189 F:P06897:0.116
G:P02281:0.116
DT
DA
DG
DG
DG
DA
DC
6.323
4.207
6.550
7.582
5.470
7.559
8.576
O
O
O
OE1
OE1
CB
OE1
O3'
C5'
OP2
O3'
OP1
OP1
OP1
GLU F:41 G:41 195.0 1.0 S -66.0 -37.4 137.0 0.721 0.279 E:P06897:0.179
H:P02281:0.121
DT
DA
DG
DA
DG
DG
DA
DC
9.097
6.812
8.004
9.670
8.132
6.114
4.240
7.025
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
C5'
OP2
6nqa 4 P06897 93.8 1e-83 EM
2019-02-20 GLU D:41 G:41 185.0 0.974 S -71.6 -59.3 142.0 0.747 0.227 E:P02281:0.111
K:P06897:0.121
DT
DA
DG
DG
DG
DA
DA
DC
7.025
4.978
7.012
8.884
6.560
7.603
9.101
7.346
O
O
O
CG
CG
CB
OE2
OE2
O3'
C5'
OP2
O3'
C5'
OP1
O3'
OP1
GLU K:41 C:41 182.0 0.958 S -89.4 -56.9 124.0 0.653 0.305 J:P02281:0.089
D:P06897:0.216
DA
DG
DA
DG
DG
DA
DC
7.610
8.577
9.366
7.918
6.871
4.903
6.932
CB
CB
OE2
OE2
O
O
O
C5'
OP1
O3'
OP2
O3'
OP1
OP2
6pa7 3 P06897 93.8 1e-83 EM
2020-06-17 GLU C:41 C:41 194.0 1.0 S -73.5 -48.4 153.0 0.805 0.195 D:P02281:0.153
G:P06897:0.063
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
5.467
3.963
6.110
9.230
5.897
4.096
7.306
9.519
7.178
9.641
O
O
O
OE2
OE2
OE1
OE1
OE2
OE2
OE2
O3'
O5'
OP2
O3'
O3'
C5'
OP1
O3'
OP1
OP2
GLU G:41 G:41 194.0 1.0 S -73.0 -49.4 155.0 0.816 0.184 H:P02281:0.137
C:P06897:0.074
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.515
6.421
4.784
7.744
9.666
7.299
9.911
5.304
3.761
6.516
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
O
O3'
C5'
OP1
P
O3'
OP1
OP1
O3'
C5'
OP2
6pwv 6 P06897 93.8 1e-83 EM
2019-12-18 GLU F:41 I:41 181.0 0.953 S -68.4 -60.1 106.0 0.558 0.395 G:P02281:0.179
J:P06897:0.216
DT
DA
DG
DG
DG
DA
DC
5.123
3.562
6.041
9.204
6.839
7.036
9.477
O
O
O
CB
CB
OE1
CG
O3'
OP1
OP2
O5'
C5'
OP1
OP2
GLU J:41 M:41 185.0 0.974 S -72.6 -27.5 120.0 0.632 0.342 F:P06897:0.168
K:P02281:0.168
DT
DA
DG
DG
DG
DA
DC
8.452
6.476
7.456
9.104
5.403
3.852
5.880
CB
CB
OE1
CG
O
O
O
O3'
C5'
OP1
OP1
O3'
O5'
OP2
6pww 6 P06897 93.8 1e-83 EM
2019-12-18 GLU F:41 I:41 194.0 1.0 S -65.5 -48.9 152.0 0.8 0.2 I:P06897:0.063
G:P02281:0.158
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
5.213
3.588
6.108
8.691
6.256
5.148
7.485
9.985
7.704
9.208
O
O
O
OE2
OE2
OE1
CB
OE2
OE2
OE2
O3'
C5'
OP2
O3'
O5'
C5'
OP1
O3'
OP1
OP1
GLU I:41 M:41 189.0 0.995 S -66.5 -34.9 128.0 0.674 0.321 F:P06897:0.137
J:P02281:0.179
DT
DA
DG
DG
DG
DA
DC
8.359
6.479
7.280
8.927
5.724
4.096
5.826
CB
CB
OE1
CG
O
O
O
O3'
OP1
OP1
OP1
O3'
O5'
OP2
6pwx 4 P06897 93.8 1e-83 EM
2019-12-18 GLU D:41 I:41 195.0 1.0 S -66.3 -35.8 148.0 0.779 0.221 G:P06897:0.105
E:P02281:0.142
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
6.080
4.077
6.212
9.395
6.923
5.333
7.663
9.982
7.863
9.763
O
O
O
OE2
OE2
OE2
CB
OE2
OE2
OE2
O3'
C5'
OP2
O3'
O5'
OP1
OP1
O3'
OP1
OP1
GLU G:41 M:41 189.0 0.995 S -68.4 -32.0 106.0 0.558 0.437 D:P06897:0.263
H:P02281:0.174
DT
DA
DG
DG
DG
DA
DC
8.825
6.778
7.267
9.126
5.810
4.244
5.748
CB
CB
OE1
CG
O
O
O
O3'
OP1
OP1
OP2
O3'
O5'
OP2
6r1u 3 Q6AZJ8 93.8 1e-83 EM
2019-04-24 GLU C:41 C:41 194.0 1.0 S -79.9 -24.7 153.0 0.805 0.195 D:P02281:0.126
G:Q6AZJ8:0.095
DG
DG
DG
DA
DA
DC
DT
DA
DG
9.698
7.569
5.326
8.229
8.743
8.009
6.567
4.348
6.245
OE2
OE1
OE1
N
OE2
OE2
O
O
O
O3'
O3'
OP1
OP1
O3'
OP1
O3'
C5'
OP2
GLU G:41 G:41 200.0 1.0 S -65.4 -30.8 159.0 0.837 0.163 H:P02281:0.1
C:Q6AZJ8:0.116
DG
DA
DC
DG
DT
DA
DG
DA
DG
DT
5.007
3.104
8.595
9.668
7.750
5.876
8.214
8.808
6.919
9.660
O
O
OE2
OE2
OE2
OE1
N
OE2
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
O3'
OP2
OP2
6r25 6 Q6AZJ8 93.8 1e-83 EM
2019-04-24 GLU F:41 C:41 195.0 1.0 S -79.9 -24.7 155.0 0.816 0.184 J:Q6AZJ8:0.084
G:None:0.126
DG
DG
DG
DA
DA
DC
DT
DA
DG
9.697
7.569
5.326
8.229
8.742
8.008
6.567
4.348
6.245
OE2
OE1
OE1
N
OE2
OE2
O
O
O
O3'
O3'
OP1
OP1
O3'
OP1
O3'
C5'
OP2
GLU J:41 G:41 201.0 1.0 S -65.4 -30.8 160.0 0.842 0.158 K:None:0.089
F:Q6AZJ8:0.121
DG
DA
DC
DG
DT
DA
DG
DA
DG
DT
5.008
3.104
8.594
9.668
7.751
5.875
8.215
8.808
6.919
9.661
O
O
OE2
OE2
OE2
OE1
N
OE2
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
O3'
OP2
OP2
6s01 3 Q6AZJ8 93.8 1e-83 EM
2019-12-18 GLU C:41 C:41 183.0 0.963 S -81.4 -27.3 122.0 0.642 0.321 D:P02281:0.089
G:Q6AZJ8:0.237
DT
DA
DG
DA
DG
DG
DA
DC
9.473
7.154
7.832
9.083
7.045
5.536
3.867
6.516
CG
CB
CB
OE2
OE2
O
O
OE2
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:41 G:41 186.0 0.979 S -81.4 -27.3 122.0 0.642 0.337 C:Q6AZJ8:0.247
H:P02281:0.089
DT
DA
DG
DG
DG
DA
DA
DC
5.773
4.181
6.251
9.282
7.253
7.742
9.255
7.443
O
O
OE2
CG
CB
CB
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
6t9l 3 Q6AZJ8 93.8 1e-83 EM
2020-01-29 GLU C:41 C:41 183.0 0.963 S -75.0 -58.9 142.0 0.747 0.216 D:P02281:0.174
G:Q6AZJ8:0.042
DG
DT
DA
DG
DG
DG
DA
DC
9.479
6.728
4.619
6.884
9.693
6.303
4.462
7.451
OE2
OE2
OE1
OE1
OE2
O
O
O
O3'
O3'
C5'
OP1
OP1
O3'
OP1
OP2
GLU G:41 G:41 190.0 1.0 S -82.3 -56.8 132.0 0.695 0.305 C:Q6AZJ8:0.2
H:F6R8G8:0.105
DT
DA
DG
DG
DG
DA
DC
7.061
4.954
7.250
9.351
7.284
7.990
9.056
O
O
O
CB
CB
CB
OE1
O3'
C5'
OP2
O3'
C5'
OP1
OP1
6tda 3 Q6AZJ8 93.8 1e-83 EM
2020-03-18 GLU C:41 C:41 167.0 0.879 S -85.4 -31.8 130.0 0.684 0.195 G:Q6AZJ8:0.074
D:P02281:0.121
DT
DA
DG
DG
DG
DA
DC
6.213
4.513
5.773
6.265
4.726
7.606
8.234
O
O
OE2
OE1
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP1
GLU G:41 G:41 184.0 0.968 S -92.7 -21.9 132.0 0.695 0.273 H:P02281:0.179
C:Q6AZJ8:0.1
DT
DA
DG
DG
DG
DA
DC
6.311
3.664
6.274
9.101
5.106
3.562
6.689
OE1
OE1
OE1
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP1
6tem 3 Q6AZJ8 93.8 1e-83 EM
2020-04-08 GLU C:41 C:41 175.0 0.921 S -75.0 -47.4 119.0 0.626 0.295 G:Q6AZJ8:0.184
D:P02281:0.116
DT
DA
DG
DG
DG
DA
DC
9.826
7.595
8.043
9.573
5.006
3.216
6.889
CB
CB
OE1
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP2
GLU G:41 G:41 172.0 0.905 S -75.3 -59.9 132.0 0.695 0.21 C:Q6AZJ8:0.111
H:P02281:0.1
DT
DA
DG
DG
DG
DA
DC
5.321
3.323
7.426
9.722
7.695
7.637
8.979
O
O
O
CB
CB
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP2
6uxw 3 P06897 93.8 1e-83 EM
2020-03-18 GLU C:41 T:41 195.0 1.0 S -79.1 -30.6 152.0 0.8 0.2 D:P02281:0.137
G:P06897:0.089
DT
DA
DG
DG
DG
DA
DA
DC
6.201
4.546
6.838
7.540
5.630
7.405
9.326
7.418
O
O
O
OE2
OE2
OE1
OE2
OE2
O3'
C5'
OP2
O3'
OP1
OP1
O3'
OP1
GLU G:41 X:41 191.0 1.0 S -79.1 -30.7 152.0 0.8 0.2 C:P06897:0.084
H:P02281:0.121
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.460
6.433
8.823
8.595
6.493
9.617
6.269
4.546
6.704
OE2
OE2
CB
OE2
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP2
6ven 3 P06897 93.8 1e-83 EM
2020-01-15 GLU C:41 C:41 185.0 0.974 S -74.8 -39.0 136.0 0.716 0.258 D:P02281:0.153
G:P06897:0.111
DT
DA
DG
DG
DG
DA
DC
6.503
4.729
6.786
7.076
5.181
6.882
8.090
O
O
O
OE2
OE2
OE1
OE2
O3'
C5'
OP1
O3'
OP1
OP1
OP1
GLU G:41 G:41 190.0 1.0 S -72.2 -23.3 141.0 0.742 0.258 C:P06897:0.111
H:P02281:0.147
DT
DA
DG
DA
DG
DG
DA
DC
7.562
5.318
7.619
9.740
7.467
5.709
4.439
7.108
OE1
OE1
OE1
OE2
OE2
O
O
O
O3'
OP1
OP2
O3'
OP1
O3'
C5'
OP1
6vyp 3 P06897 93.8 1e-83 X-RAY
2020-05-27 GLU C:41 C:41 195.0 1.0 S -65.1 -38.4 142.0 0.747 0.253 D:P02281:0.142
G:P06897:0.142
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.366
6.150
7.494
7.755
6.153
9.994
5.243
3.747
6.190
OE1
CB
CB
OE2
OE1
OE1
O
O
O
C5'
C5'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
GLU G:41 G:41 196.0 1.0 S -65.2 -59.1 123.0 0.647 0.353 H:P02281:0.147
C:P06897:0.247
DT
DA
DG
DG
DG
DA
DA
DC
5.513
4.151
6.752
8.380
6.074
7.183
8.285
6.211
O
O
O
OE1
CB
CB
OE2
OE1
O3'
C5'
OP2
C4'
C5'
OP1
O3'
OP1
GLU M:41 c:41 193.0 1.0 S -65.8 -33.8 NA NA NA
GLU Q:41 g:41 194.0 1.0 S -65.0 -48.0 NA NA NA
6w5m 7 P06897 93.8 1e-83 EM
2021-03-31 GLU G:41 I:41 181.0 0.953 S -68.4 -60.1 106.0 0.558 0.395 K:P06897:0.211
H:P02281:0.184
DT
DA
DG
DG
DG
DA
DC
5.278
3.593
6.165
9.373
7.079
7.265
9.366
O
O
O
CB
CB
OE1
CG
O3'
OP1
OP2
O5'
C5'
OP1
OP2
GLU K:41 M:41 186.0 0.979 S -72.6 -27.5 121.0 0.637 0.342 G:P06897:0.174
L:P02281:0.174
DT
DA
DG
DG
DG
DA
DC
8.800
6.799
7.608
9.167
5.444
3.926
5.862
CB
CB
OE1
CG
O
O
O
O3'
C5'
OP1
OP1
O3'
O5'
OP2
6w5n 7 P06897 93.8 1e-83 EM
2021-03-31 GLU G:41 I:41 182.0 0.958 S -68.4 -60.2 109.0 0.574 0.384 H:P02281:0.179
K:P06897:0.205
DT
DA
DG
DG
DG
DA
DC
5.089
3.440
5.873
9.326
7.154
7.322
9.265
O
O
O
CB
CB
OE1
CG
O3'
OP1
OP2
O5'
C5'
OP1
OP2
GLU K:41 M:41 188.0 0.989 S -72.5 -27.6 122.0 0.642 0.347 G:P06897:0.184
L:P02281:0.163
DT
DA
DG
DG
DG
DA
DC
8.792
6.821
7.949
8.618
5.600
3.959
5.630
CB
CB
OE1
CG
O
O
O
O3'
OP1
OP1
OP1
O3'
O5'
OP2
6wz5 3 Q6AZJ8 93.8 1e-83 EM
2020-09-16 GLU C:41 C:41 188.0 0.989 S -68.8 -36.7 149.0 0.784 0.205 D:P02281:0.142
G:Q6AZJ8:0.058
DG
DG
DG
DA
DC
DT
DA
DG
9.722
6.267
4.406
7.369
8.302
5.757
4.378
6.603
OE1
OE1
OE1
OE1
OE2
O
O
O
N2
O3'
C5'
P
OP1
O3'
OP1
OP2
GLU G:41 G:41 188.0 0.989 S -64.1 -35.6 146.0 0.768 0.221 H:P02281:0.147
C:Q6AZJ8:0.074
DG
DA
DC
DG
DT
DA
DG
DG
5.755
4.423
6.742
9.966
6.385
4.269
7.100
8.146
O
O
O
OE1
OE1
OE1
OE1
OE2
O3'
OP1
OP2
N2
O3'
C5'
P
OP1
6wz9 3 Q6AZJ8 93.8 1e-83 EM
2020-09-16 GLU C:41 C:41 185.0 0.974 S -68.6 -37.2 148.0 0.779 0.195 D:P02281:0.132
G:Q6AZJ8:0.063
DG
DG
DG
DA
DC
DT
DA
DG
9.795
6.298
4.365
7.474
8.507
5.861
4.363
6.682
OE1
OE1
OE1
OE1
OE2
O
O
O
O3'
O3'
OP1
P
OP1
O3'
C5'
OP2
GLU G:41 G:41 187.0 0.984 S -64.7 -36.2 110.0 0.579 0.405 C:Q6AZJ8:0.189
H:P02281:0.216
DG
DA
DC
DT
DA
DG
DG
5.894
4.538
6.600
9.573
7.246
7.401
9.572
O
O
O
CB
CB
OE2
CG
O3'
C5'
OP2
O3'
C5'
OP2
OP1
6x0n 3 Q6AZJ8 93.8 1e-83 EM
2020-09-16 GLU C:41 C:41 187.0 0.984 S -68.1 -36.7 148.0 0.779 0.205 D:P02281:0.147
G:Q6AZJ8:0.058
DG
DG
DG
DA
DC
DT
DA
DG
9.208
6.624
4.254
6.598
9.803
5.390
3.841
6.700
OE1
OE1
OE1
OE1
OE2
O
O
O
N2
O3'
C5'
P
OP2
O3'
OP1
OP2
GLU G:41 G:41 185.0 0.974 S -64.3 -35.9 149.0 0.784 0.19 C:Q6AZJ8:0.053
H:P02281:0.137
DG
DA
DC
DG
DT
DA
DG
DG
5.341
3.988
6.594
9.324
6.519
4.096
6.376
9.689
O
O
O
OE1
OE1
OE1
OE1
OE2
O3'
OP1
OP2
N2
O3'
C5'
P
OP1
GLU M:41 c:41 189.0 0.995 S -68.5 -37.2 155.0 0.816 0.179 Q:Q6AZJ8:0.068
N:P02281:0.111
DG
DG
DG
DA
DC
DT
DA
DG
9.620
6.792
4.767
7.645
8.435
5.642
3.949
6.762
OE1
OE1
OE1
OE1
OE2
O
O
O
N2
O3'
C5'
P
OP1
O3'
OP1
OP2
GLU Q:41 g:41 184.0 0.968 S -64.9 -36.4 100.0 0.526 0.442 M:Q6AZJ8:0.232
R:P02281:0.211
DG
DA
DC
DT
DA
DG
5.530
4.184
6.449
9.618
7.220
6.906
O
O
O
CB
CB
OE1
O3'
C5'
OP2
O3'
C5'
OP1
7at8 5 Q6AZJ8 93.8 1e-83 EM
2020-12-09 GLU E:41 F:41 177.0 0.932 S -75.3 -58.6 136.0 0.716 0.216 F:P02281:0.158
I:Q6AZJ8:0.058
DG
DT
DA
DG
DG
DG
DA
DC
9.801
7.420
5.270
7.932
8.135
6.479
4.448
7.138
OE2
OE2
OE1
OE1
OE2
O
O
O
O3'
O3'
C5'
OP1
OP1
O3'
OP1
OP2
GLU I:41 J:41 183.0 0.963 S -75.1 -58.6 132.0 0.695 0.268 E:Q6AZJ8:0.147
J:P02281:0.121
DT
DA
DG
DG
DG
DA
DA
DC
7.641
5.427
7.283
9.574
7.561
8.267
9.408
8.063
O
O
O
OE1
CB
CB
OE2
OE2
O3'
C5'
OP2
O3'
C5'
OP1
O3'
OP1
7cro 3 Q6AZJ8 93.8 1e-83 EM
2020-10-21 GLU C:41 C:41 181.0 0.953 S -89.8 -57.2 145.0 0.763 0.19 D:Q6AZK7:0.105
G:Q6AZJ8:0.084
DT
DA
DG
DG
DG
DA
DC
6.183
4.093
7.536
8.212
6.178
8.391
9.337
O
O
O
OE2
OE2
CB
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
GLU G:41 G:41 186.0 0.979 S -102.7 -27.3 149.0 0.784 0.195 H:Q6AZK7:0.137
C:Q6AZJ8:0.053
DT
DA
DG
DG
DG
DA
DC
7.792
5.984
8.277
8.318
6.095
4.453
7.564
OE2
OE2
OE1
OE2
O
O
O
O3'
OP1
OP2
OP1
O3'
OP1
OP2
7crp 3 Q6AZJ8 93.8 1e-83 EM
2020-10-21 GLU C:41 C:41 182.0 0.958 S -79.7 -41.4 146.0 0.768 0.19 D:Q6AZK7:0.153
G:Q6AZJ8:0.037
DT
DA
DG
DG
DG
DA
5.937
4.355
7.337
6.934
4.951
7.807
O
O
O
OE2
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
GLU G:41 G:41 182.0 0.958 S -89.3 -29.4 153.0 0.805 0.153 H:Q6AZK7:0.116
C:Q6AZJ8:0.037
DT
DA
DG
DG
DG
DA
DC
6.220
4.980
8.454
9.816
5.870
4.269
7.335
OE2
OE2
CB
OE1
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
7crq 3 Q6AZJ8 93.8 1e-83 EM
2020-10-21 GLU C:41 C:41 181.0 0.953 S -99.7 -25.1 149.0 0.784 0.169 D:Q6AZK7:0.126
G:Q6AZJ8:0.042
DT
DA
DG
DG
DG
DA
DC
6.136
4.614
7.245
7.448
5.450
7.761
9.200
O
O
O
OE1
OE1
OE1
OE2
O3'
OP1
OP1
O3'
OP1
OP1
OP2
GLU G:41 G:41 185.0 0.974 S -85.9 -26.6 149.0 0.784 0.19 H:Q6AZK7:0.142
C:Q6AZJ8:0.042
DT
DA
DG
DG
DG
DA
DC
6.570
5.383
8.147
9.749
5.870
4.336
7.488
OE2
OE2
OE1
OE2
O
O
O
O3'
OP1
OP2
OP1
O3'
OP1
OP2
7crr 3 Q6AZJ8 93.8 1e-83 EM
2020-10-21 GLU C:41 C:41 178.0 0.937 S -80.7 -58.0 140.0 0.737 0.2 D:Q6AZK7:0.137
G:Q6AZJ8:0.058
DT
DA
DG
DG
DG
DG
DA
DC
6.051
4.456
7.067
9.780
6.738
4.673
7.233
9.936
O
O
O
OE2
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
O3'
C5'
OP1
OP1
GLU G:41 G:41 185.0 0.974 S -61.0 -40.8 140.0 0.737 0.237 H:Q6AZK7:0.132
C:Q6AZJ8:0.111
DT
DA
DG
DG
DG
DA
DC
6.874
4.975
7.389
8.729
6.377
4.570
7.114
OE1
OE1
OE1
OE2
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
OP2
7eg6 4 P06897 93.8 1e-83 EM
2022-01-12 GLU D:41 C:41 190.0 1.0 S -69.7 -45.4 146.0 0.768 0.232 H:P06897:0.084
E:P02281:0.142
DT
DA
DG
DG
DG
DG
DA
DC
6.141
4.528
6.871
9.303
6.564
4.710
7.148
8.777
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP1
OP1
GLU H:41 G:41 187.0 0.984 S -73.3 -39.9 145.0 0.763 0.221 D:P06897:0.068
I:P02281:0.153
DG
DT
DA
DG
DG
DG
DA
DC
9.720
6.671
4.506
6.916
8.350
5.813
4.299
6.766
OE2
OE2
OE1
OE1
OE2
O
O
O
O3'
O3'
C5'
OP1
OP1
O3'
C5'
OP2
7egp 13 Q6AZJ8 93.8 1e-83 EM
2022-01-12 GLU N:41 Q:41 163.0 0.858 S -74.6 -62.4 131.0 0.689 0.169 O:P02281:0.168
DC
DG
DT
DA
DG
DC
DG
DA
DC
8.056
7.022
5.543
3.280
5.726
7.466
4.959
2.890
5.324
OE1
OE1
OE2
OE2
OE2
OE1
O
O
CG
O2
N2
O3'
C5'
OP1
O2
O3'
OP1
OP1
GLU R:41 U:41 163.0 0.858 S -71.0 -60.7 125.0 0.658 0.2 S:P02281:0.2
DC
DC
DT
DA
DG
DA
DG
DG
DG
DA
9.542
7.953
4.941
2.959
5.884
9.080
7.090
5.826
3.781
4.991
OE2
OE2
O
O
O
OE2
OE2
OE2
OE2
OE1
O2
O2
O3'
O5'
OP2
C2
N2
C4'
O5'
OP1
7enn 4 P06897 93.8 1e-83 EM
2021-07-14 GLU D:41 C:41 187.0 0.984 S -67.4 -40.7 146.0 0.768 0.216 E:P02281:0.142
H:P06897:0.074
DT
DA
DG
DG
DG
DG
DA
DC
5.840
4.316
6.755
9.793
6.863
4.914
7.413
8.147
O
O
O
OE2
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP1
OP1
GLU H:41 G:41 195.0 1.0 S -62.9 -42.9 151.0 0.795 0.205 D:P06897:0.084
I:P02281:0.147
DG
DT
DA
DG
DG
DG
DA
DC
9.626
6.958
4.791
7.439
8.032
5.987
4.440
6.746
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C4'
OP1
OP1
OP1
O3'
OP1
OP2
7mbm 7 Q6AZJ8 93.8 1e-83 EM
2021-12-29 GLU G:41 I:41 178.0 0.937 S -75.8 -62.8 113.0 0.595 0.342 H:P02281:0.174
K:Q6AZJ8:0.174
DG
DA
DC
DT
DA
DG
6.900
4.990
7.956
8.504
6.091
7.770
O
O
O
OE1
OE1
OE1
O3'
OP1
OP2
O3'
C5'
OP1
GLU K:41 M:41 177.0 0.932 S -79.7 -55.4 135.0 0.711 0.221 G:Q6AZJ8:0.068
L:P02281:0.147
DG
DG
DA
DC
DT
DA
DG
7.070
5.275
7.431
9.041
6.674
4.917
7.261
OE2
OE2
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
7mbn 7 Q6AZJ8 93.8 1e-83 EM
2021-12-29 GLU G:41 I:41 185.0 0.974 S -68.4 -60.2 112.0 0.589 0.385 K:Q6AZJ8:0.205
H:P02281:0.184
DT
DA
DG
DG
DG
DA
DC
4.780
3.087
6.177
9.322
6.814
6.757
9.899
O
O
O
CB
CB
OE1
CG
O3'
OP1
OP2
O5'
O3'
OP1
OP2
GLU K:41 M:41 190.0 1.0 S -72.6 -27.6 129.0 0.679 0.321 G:Q6AZJ8:0.142
L:P02281:0.179
DT
DA
DG
DG
DG
DA
DC
8.925
6.863
7.620
9.277
5.060
3.504
5.655
CB
CB
OE1
CG
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
OP2
7oh9 3 Q6AZJ8 93.8 1e-83 EM
2021-07-28 GLU C:41 C:41 188.0 0.989 S -73.6 -18.7 140.0 0.737 0.252 D:P02281:0.163
G:Q6AZJ8:0.089
DG
DT
DA
DG
DA
DG
DG
DA
DC
9.984
6.331
4.309
6.490
9.644
7.776
5.391
3.687
6.498
OE2
OE2
OE2
OE2
OE1
OE1
O
O
O
O3'
O3'
O5'
OP2
O3'
OP1
O3'
C5'
OP2
GLU G:41 G:41 193.0 1.0 S -73.7 -18.8 141.0 0.742 0.258 C:Q6AZJ8:0.1
H:P02281:0.184
DT
DA
DG
DG
DG
DA
DA
DC
5.660
3.907
6.292
5.650
3.768
6.323
9.725
7.843
O
O
O
OE2
OE2
OE2
OE1
OE1
O3'
C5'
OP2
O3'
C5'
OP1
O3'
OP2
7oha 3 Q6AZJ8 93.8 1e-83 EM
2021-07-28 GLU C:41 C:41 190.0 1.0 S -71.1 -25.1 132.0 0.695 0.305 D:P02281:0.174
G:Q6AZJ8:0.132
DT
DA
DG
DA
DG
DG
DA
DC
6.094
3.784
6.346
9.777
7.707
5.385
3.763
6.487
OE2
OE2
OE2
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
C5'
OP2
GLU G:41 G:41 171.0 0.9 S -71.5 -25.7 122.0 0.642 0.258 C:Q6AZJ8:0.084
H:P02281:0.174
DC
DT
DA
DG
DG
DG
DG
DA
DC
9.964
5.293
3.597
6.298
9.291
5.999
3.432
5.680
8.754
OE2
O
O
O
OE2
OE2
OE2
OE2
CB
O2
O3'
C5'
OP1
N2
O3'
C5'
OP1
OP1
7ohb 3 Q6AZJ8 93.8 1e-83 EM
2021-07-28 GLU C:41 C:41 186.0 0.979 S -67.7 -39.9 139.0 0.732 0.247 G:Q6AZJ8:0.105
D:P02281:0.142
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.779
6.309
4.376
6.510
9.756
7.328
9.822
5.730
4.173
6.696
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O
O
O
O3'
C4'
OP1
OP1
O3'
OP1
OP2
O3'
C5'
OP2
GLU G:41 G:41 187.0 0.984 S -67.8 -39.7 130.0 0.684 0.3 H:P02281:0.179
C:Q6AZJ8:0.121
DT
DA
DG
DG
DG
DG
DA
DC
6.033
4.323
6.506
9.362
6.083
4.003
6.692
7.938
O
O
O
OE2
OE2
OE2
OE1
OE2
O3'
C5'
OP1
O3'
O3'
OP1
OP1
OP1
7ohc 3 Q6AZJ8 93.8 1e-83 EM
2021-07-28 GLU C:41 C:41 185.0 0.974 S -71.0 -25.7 140.0 0.737 0.237 D:P02281:0.153
G:Q6AZJ8:0.084
DG
DT
DA
DG
DA
DG
DG
DA
DC
9.216
5.764
3.948
5.986
9.903
7.636
5.524
3.863
6.407
OE2
OE2
OE2
OE2
OE1
OE1
O
O
O
N2
O3'
O5'
OP1
O3'
OP1
O3'
C5'
OP2
GLU G:41 G:41 187.0 0.984 S -71.6 -22.1 141.0 0.742 0.242 C:Q6AZJ8:0.084
H:P02281:0.163
DT
DA
DG
DG
DG
DG
DA
DC
5.588
3.826
6.285
9.853
5.977
3.902
6.394
8.112
O
O
O
OE2
OE1
OE1
OE1
OE2
O3'
C5'
OP1
O3'
O3'
C5'
OP1
OP1
6wkr 11 P06897 93.08 1e-83 EM
2021-02-03 GLU K:42 K:41 177.0 0.932 S -86.8 -39.0 142.0 0.747 0.185 L:P02281:0.089
O:P06897:0.095
DG
DA
DG
DC
DC
DT
DA
9.662
7.253
7.978
8.727
7.079
5.317
7.017
CG
CG
CB
OE1
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
OP1
GLU O:42 R:41 180.0 0.947 S -89.9 -47.1 134.0 0.705 0.242 K:P06897:0.063
P:P02281:0.179
DA
DC
DC
DG
DT
DA
6.242
4.352
7.034
7.550
5.367
6.344
O
O
O
OE2
OE2
OE1
O3'
OP1
OP2
O3'
O5'
OP1
1m18 4 P06897 93.8 2e-83 X-RAY
2003-02-18 GLU E:41 C:841 190.0 1.0 S -66.8 -35.3 141.0 0.742 0.258 F:P02281:0.1
I:P06897:0.158
DT
DT
DG
DT
DA
DC
DT
DA
DC
1SZ
HOH
9.577
7.243
8.291
7.413
5.666
9.217
5.683
3.462
6.219
8.527
2.881
CB
CB
N
OE1
OE1
OE1
O
O
O
O
N
O3'
O5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
C25
O
GLU I:41 G:1041 187.0 0.984 S -68.3 -35.9 122.0 0.642 0.342 J:P02281:0.1
E:P06897:0.242
DA
DT
DA
DT
DG
DG
DA
DC
HOH
5.505
3.992
6.670
8.698
6.256
7.986
8.939
6.551
2.985
O
O
O
CB
CB
CB
OE1
OE1
OE1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
O
1m19 4 P06897 93.8 2e-83 X-RAY
2003-02-18 GLU E:41 C:841 189.0 0.995 S -69.1 -42.6 129.0 0.679 0.316 I:P06897:0.205
F:P02281:0.116
DT
DT
DG
DT
DA
DT
DA
DC
ABU
PYB
HOH
8.375
6.782
8.152
8.724
6.237
5.692
3.925
6.355
7.429
9.650
2.954
CB
CB
CB
OE1
OE1
O
O
O
O
O
O
O3'
C5'
OP2
O3'
OP1
O3'
OP1
OP1
CG
N
O
GLU I:41 G:1041 194.0 1.0 S -62.6 -38.5 143.0 0.753 0.247 E:P06897:0.158
J:P02281:0.111
DA
DT
DA
DT
DG
DG
DA
DC
ABU
PYB
HOH
5.608
4.098
5.905
8.610
6.229
8.243
8.628
6.495
6.815
8.761
2.468
O
O
O
CB
CB
CB
OE2
OE2
O
O
OE1
O3'
OP1
OP1
O3'
C5'
OP2
O3'
OP1
CG
N
O
1m1a 4 P06897 93.8 2e-83 X-RAY
2003-02-18 GLU E:41 C:841 187.0 0.984 S -56.6 -43.6 136.0 0.716 0.268 I:P06897:0.137
F:P02281:0.132
DT
DG
DG
DA
DC
DA
DT
DA
HOH
8.111
6.123
7.756
8.869
6.443
6.125
4.283
6.785
3.968
CG
CG
CB
OE2
OE2
O
O
O
OE2
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 195.0 1.0 S -56.4 -58.8 145.0 0.763 0.237 J:P02281:0.105
E:P06897:0.158
DT
DA
DC
DT
DT
DT
DG
DT
DA
DC
HOH
6.184
4.472
6.112
9.363
7.341
6.574
8.023
9.514
7.454
9.989
2.753
O
O
O
OE1
OE1
CB
CB
OE2
OE1
OE1
O
O3'
OP1
OP2
O3'
O3'
C5'
OP1
O3'
OP2
OP2
O
1p34 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 190.0 1.0 S -70.6 -44.4 129.0 0.679 0.321 F:P02281:0.121
I:Q7ZT66:0.195
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.461
6.706
7.889
9.520
8.183
5.971
4.153
7.455
2.487
CB
CB
CB
OE1
OE1
O
O
O
N
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 192.0 1.0 S -59.8 -49.5 126.0 0.663 0.337 J:P02281:0.132
E:Q7ZT66:0.211
DA
DT
DA
DT
DG
DG
DT
DA
HOH
6.125
4.337
7.300
8.997
6.525
7.861
9.689
8.002
5.709
O
O
O
CB
CB
CB
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
O
1p3a 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 183.0 0.963 S -64.1 -43.2 128.0 0.674 0.289 F:P02281:0.147
I:Q7ZT66:0.174
DT
DG
DG
DT
DA
DA
DT
DA
9.156
6.672
7.579
9.275
8.165
5.876
3.816
7.296
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU I:41 G:1041 189.0 0.995 S -73.4 -39.8 131.0 0.689 0.306 J:P02281:0.121
E:Q7ZT66:0.179
DA
DT
DA
DT
DG
DG
DT
DA
5.829
4.332
7.378
8.705
6.348
7.739
9.838
7.972
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP2
1p3b 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 177.0 0.932 S -61.8 -49.3 119.0 0.626 0.306 F:P02281:0.116
I:Q7ZT66:0.189
DT
DG
DG
DT
DA
DA
DT
DA
HOH
8.946
6.545
8.099
9.587
8.180
5.938
4.095
7.373
3.106
CB
CB
CB
OE1
OE1
O
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 188.0 0.989 S -73.0 -29.5 153.0 0.805 0.184 J:P02281:0.142
E:Q7ZT66:0.042
DA
DT
DA
DT
DT
DG
DG
DT
DA
HOH
5.731
4.264
6.985
9.477
6.296
4.410
7.357
9.383
7.306
8.027
O
O
O
OE1
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP2
O3'
OP2
O
1p3f 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 190.0 1.0 S -64.5 -32.8 143.0 0.753 0.247 F:P02281:0.1
I:Q7ZT66:0.153
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.623
7.193
8.024
9.286
7.655
5.818
4.086
7.056
8.521
CB
CB
CB
OE1
OE1
O
O
O
OE2
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 188.0 0.989 S -70.1 -35.4 146.0 0.768 0.221 J:P02281:0.111
E:Q7ZT66:0.111
DA
DT
DA
DT
DT
DG
DG
DT
DA
HOH
5.922
4.174
6.792
9.854
7.336
5.150
7.669
9.284
7.344
5.063
O
O
O
OE1
OE1
OE1
CB
OE2
OE2
N
O3'
OP1
OP2
O3'
O3'
OP1
OP2
O3'
OP2
O
1p3g 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 191.0 1.0 S -63.0 -50.7 127.0 0.668 0.332 F:P02281:0.153
I:Q7ZT66:0.2
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.156
6.524
7.582
9.475
8.365
6.100
4.071
7.250
3.447
CB
CB
CB
OE1
OE1
O
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 194.0 1.0 S -66.4 -45.5 128.0 0.674 0.326 J:P02281:0.137
E:Q7ZT66:0.211
DA
DT
DA
DT
DG
DG
DT
DA
HOH
6.042
4.481
7.468
8.558
6.183
7.699
9.941
8.015
5.836
O
O
O
CB
CB
CB
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP2
O
1p3i 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 185.0 0.974 S -59.0 -49.8 130.0 0.684 0.29 F:P02281:0.126
I:Q7ZT66:0.168
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.156
6.579
7.885
9.226
8.059
6.461
4.939
7.316
5.576
CB
CB
CB
OE1
OE1
O
O
O
N
O3'
C5'
OP1
O3'
OP2
O3'
O5'
OP2
O
GLU I:41 G:1041 183.0 0.963 S -62.1 -41.0 143.0 0.753 0.21 J:P02281:0.137
E:Q7ZT66:0.074
DA
DT
DA
DT
DT
DG
DG
DA
HOH
6.172
4.470
7.296
9.760
6.089
4.176
7.101
7.927
9.340
O
O
O
OE1
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP2
O
1p3k 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 192.0 1.0 S -62.4 -29.6 129.0 0.679 0.321 F:P02281:0.121
I:Q7ZT66:0.211
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.197
6.655
7.952
9.265
8.009
5.920
3.952
7.197
4.092
CB
CB
CB
OE1
OE1
O
O
O
O
O3'
C5'
OP2
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 191.0 1.0 S -60.1 -49.7 137.0 0.721 0.279 J:P02281:0.111
E:Q7ZT66:0.174
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.899
4.228
7.229
8.811
6.297
7.635
9.627
7.841
6.269
O
O
O
CB
CB
CB
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
O
1p3l 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 189.0 0.995 S -66.9 -41.3 123.0 0.647 0.348 F:P02281:0.116
I:Q7ZT66:0.247
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.440
6.857
8.041
9.441
8.139
5.956
4.018
7.161
3.286
CB
CB
CB
OE1
OE1
O
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 193.0 1.0 S -68.2 -44.6 123.0 0.647 0.353 J:P02281:0.142
E:Q7ZT66:0.226
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.896
4.334
7.252
8.725
6.332
7.652
9.795
7.908
2.730
O
O
O
CB
CB
CB
OE1
OE1
N
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP2
O
1p3m 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 187.0 0.984 S -58.6 -44.9 135.0 0.711 0.273 F:P02281:0.121
I:Q7ZT66:0.147
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.400
6.752
7.822
9.854
8.085
5.905
3.988
7.067
5.002
CB
CB
CB
OE1
OE1
O
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 192.0 1.0 S -70.1 -44.5 122.0 0.642 0.358 J:P02281:0.163
E:Q7ZT66:0.205
DA
DT
DA
DT
DG
DG
DA
HOH
5.906
4.197
6.858
8.756
6.170
7.737
8.283
4.114
O
O
O
OE1
CB
CG
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP2
OP2
O
1p3o 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 195.0 1.0 S -60.5 -45.8 131.0 0.689 0.311 I:Q7ZT66:0.205
F:P02281:0.137
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.198
6.500
7.756
9.364
8.010
5.998
4.067
7.481
3.418
CB
CB
CB
OE1
OE1
O
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 191.0 1.0 S -61.6 -48.2 132.0 0.695 0.305 J:P02281:0.111
E:Q7ZT66:0.2
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.979
4.254
7.253
8.728
6.285
7.720
9.555
7.770
3.793
O
O
O
CB
CB
CB
OE1
OE1
CB
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
O
1p3p 4 Q7ZT66 93.8 2e-83 X-RAY
2004-02-24 GLU E:41 C:841 192.0 1.0 S -60.4 -48.8 135.0 0.711 0.289 F:P02281:0.116
I:Q7ZT66:0.184
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.379
6.832
7.801
9.356
7.860
6.112
4.058
7.835
2.555
CB
CB
CB
OE1
OE1
O
O
O
N
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:1041 192.0 1.0 S -62.4 -48.7 135.0 0.711 0.289 J:P02281:0.121
E:Q7ZT66:0.179
DA
DT
DA
DT
DG
DG
DT
DA
HOH
6.050
4.350
7.193
8.644
6.305
7.930
9.584
7.789
5.557
O
O
O
CB
CB
CB
OE1
OE1
N
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP2
O
6g0l 3 P06897 93.08 2e-83 EM
2018-08-22 GLU C:42 C:41 194.0 1.0 S -60.4 -68.5 140.0 0.737 0.263 D:A0A1L8G0X3:0.247
G:P06897:0.058
DG
DT
DA
DG
DG
DT
DG
DA
DC
8.694
4.584
2.848
5.427
8.505
9.422
5.725
4.450
7.015
OE2
OE2
OE1
OE1
OE2
OE2
O
O
O
O3'
O3'
C5'
OP2
OP1
OP2
O3'
C5'
OP1
3c1b 3 P06897 93.02 4e-83 X-RAY
2008-10-07 GLU C:41 C:841 179.0 0.942 S -60.7 -43.0 136.0 0.716 0.226 D:Q28D68:0.153
G:P06897:0.074
DT
DT
DG
DG
DA
DA
DT
DA
HOH
8.721
6.212
4.080
7.138
9.740
5.925
3.988
7.296
2.704
OE1
OE1
OE1
OE2
OE1
O
O
O
N
O3'
O3'
OP1
OP2
OP1
O3'
OP1
OP2
O
GLU G:41 G:1041 184.0 0.968 S -56.0 -46.5 128.0 0.674 0.294 H:Q28D68:0.211
C:P06897:0.084
DA
DT
DA
DT
DT
DG
DG
DA
HOH
6.162
4.396
7.386
9.025
5.519
3.644
6.870
9.972
2.654
O
O
O
OE2
OE2
OE2
OE1
CG
N
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP2
O
3c1c 3 P06897 93.02 4e-83 X-RAY
2008-10-07 GLU C:41 C:841 188.0 0.989 S -58.3 -58.8 130.0 0.684 0.305 D:Q28D68:0.121
G:P06897:0.189
DT
DG
DG
DA
DA
DT
DA
HOH
9.416
6.796
7.991
8.375
6.297
4.409
7.397
4.063
CB
CB
CB
OE2
O
O
O
O
O3'
C5'
OP2
OP2
O3'
OP1
OP2
O
GLU G:41 G:1041 172.0 0.905 S -62.1 -57.0 119.0 0.626 0.279 H:Q28D68:0.121
C:P06897:0.158
DA
DT
DA
DT
DG
DG
DT
DA
HOH
6.010
4.256
6.714
7.969
5.840
7.571
9.823
8.072
2.607
O
O
OE1
CG
CG
CB
OE2
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP2
O3'
OP2
O
5gsu 3 Q96QV6 93.08 5e-83 X-RAY
2017-02-15 GLU E:41 C:43 193.0 1.0 S -77.3 -47.9 141.0 0.742 0.258 F:Q96QV6:0.184
G:Q96A08:0.095
DT
DT
DG
DT
DA
DT
DA
DC
HOH
8.174
6.796
7.728
9.694
7.623
5.909
4.221
6.057
9.661
CB
CB
CB
OE1
OE1
O
O
O
N
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU F:41 G:43 203.0 1.0 S -75.4 -44.1 168.0 0.884 0.116 H:Q96A08:0.111
E:Q96QV6:0.074
DA
DT
DA
DT
DG
DG
DA
DC
5.844
4.218
6.690
7.661
5.672
8.027
8.858
6.796
O
O
O
OE1
OE1
N
OE2
OE2
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
5gt0 3 Q96QV6 93.08 5e-83 X-RAY
2017-02-15 GLU E:41 C:41 202.0 1.0 S -66.5 -27.5 165.0 0.868 0.132 F:Q96QV6:0.068
G:P62807:0.126
DT
DT
DT
DG
DA
DT
DA
DC
HOH
9.862
6.113
4.149
7.907
8.412
5.945
4.391
6.251
3.023
OE1
OE1
OE1
CB
OE2
O
O
O
N
O3'
O3'
OP1
OP1
OP2
O3'
OP1
OP1
O
GLU F:41 G:41 184.0 0.968 S -62.4 -29.3 144.0 0.758 0.21 H:P62807:0.158
E:Q96QV6:0.053
DA
DT
DA
DT
DT
DG
DG
DC
HOH
5.865
4.207
7.329
9.706
6.561
4.615
7.430
8.697
9.395
O
O
O
OE1
OE1
OE1
OE2
CG
N
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP1
O
7e8i 5 Q6AZJ8 93.02 9e-83 EM
2021-06-30 GLU E:41 C:41 192.0 1.0 S -95.0 -42.1 146.0 0.768 0.232 F:P02281:0.105
I:Q6AZJ8:0.137
DG
DA
DC
DT
DA
DG
DA
DG
5.311
3.873
6.534
8.315
6.020
8.363
9.502
7.702
O
O
O
OE2
OE2
CB
OE1
OE1
O3'
OP1
OP2
C4'
OP1
OP1
O3'
OP1
GLU I:41 G:41 190.0 1.0 S -63.5 -35.9 147.0 0.774 0.226 E:Q6AZJ8:0.105
J:P02281:0.121
DG
DG
DG
DA
DC
DT
DA
DG
8.994
6.692
4.958
7.872
8.443
6.144
4.229
6.710
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C4'
OP1
OP2
OP1
O3'
C5'
OP1
5omx 5 Q6AZJ8 93.02 1e-82 X-RAY
2017-11-15 GLU E:41 C:41 196.0 1.0 S -71.3 -43.8 126.0 0.663 0.337 F:P02281:0.153
I:Q6AZJ8:0.221
DT
DG
DG
DA
DA
DT
DA
8.354
6.102
7.160
9.528
5.899
4.169
7.206
OE1
OE1
OE1
OE2
O
O
O
O3'
C5'
OP2
OP2
O3'
OP1
OP2
GLU I:41 G:41 190.0 1.0 S -44.7 -43.4 150.0 0.789 0.211 E:Q6AZJ8:0.037
J:P02281:0.174
DA
DT
DA
DT
DT
DG
DG
DA
6.079
4.338
7.182
9.637
6.020
4.229
6.830
9.802
O
O
O
OE2
OE1
OE1
OE1
OE2
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP2
5onw 5 Q6AZJ8 93.02 1e-82 X-RAY
2017-11-22 GLU E:41 C:41 189.0 0.995 S -57.9 -37.1 157.0 0.826 0.169 F:P02281:0.142
I:Q6AZJ8:0.021
DT
DT
DG
DG
DA
DT
DA
9.052
6.258
4.232
7.235
5.951
4.032
7.282
OE1
OE1
OE1
OE1
O
O
O
O3'
O3'
OP1
OP2
O3'
OP1
OP1
GLU I:41 G:41 189.0 0.995 S -63.5 -35.4 148.0 0.779 0.216 E:Q6AZJ8:0.037
J:P02281:0.179
DA
DT
DA
DT
DG
DG
6.090
4.103
7.056
7.606
5.474
7.515
O
O
O
OE2
OE2
OE1
O3'
OP1
OP1
O3'
OP1
OP2
1zla 4 30268540 91.47 1e-81 X-RAY
2006-02-28 GLU E:41 C:841 187.0 0.984 S -57.3 -59.9 127.0 0.668 0.316 F:296216:0.121
I:30268540:0.195
DT
DG
DG
DT
DA
DA
DT
DA
9.184
6.482
7.603
9.554
8.437
6.147
4.205
7.229
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU I:41 G:1041 194.0 1.0 S -64.7 -48.1 125.0 0.658 0.342 J:296216:0.137
E:30268540:0.232
DA
DT
DA
DT
DG
DG
DA
5.978
4.335
7.329
8.741
6.302
7.421
8.276
O
O
O
CB
CB
CB
OE1
O3'
OP1
OP2
O3'
C5'
OP1
OP2
3w96 3 P04908 98.33 2e-81 X-RAY
2013-08-28 GLU C:36 C:41 194.0 1.0 S -69.6 -40.9 157.0 0.826 0.174 G:P04908:0.089
D:P06899:0.111
DT
DT
DG
DT
DA
DC
DT
DA
DC
8.012
6.252
8.064
8.662
6.383
9.849
6.180
4.360
5.477
CG
CG
CB
OE1
OE1
OE1
O
O
O
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP2
GLU G:36 G:41 191.0 1.0 S -62.5 -41.2 138.0 0.726 0.274 H:P06899:0.147
C:P04908:0.132
DA
DT
DA
DT
DT
DG
DG
DA
DC
6.151
4.833
6.452
9.637
7.233
5.835
8.068
9.962
7.648
O
O
O
OE1
CG
CG
CB
OE1
OE1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP2
7lya 6 P04908 98.31 3e-80 EM
2021-07-28 GLU I:31 C:41 183.0 0.963 S -81.1 -34.2 142.0 0.747 0.216 J:P04908:0.068
C:P06899:0.147
DG
DT
DA
DG
DG
DG
DA
DC
9.804
6.945
4.676
8.100
9.178
5.836
4.256
6.933
OE2
OE2
OE2
CB
OE2
O
O
O
O3'
O3'
OP1
OP1
OP1
O3'
OP1
OP2
GLU J:31 G:41 184.0 0.968 S -85.3 -33.1 147.0 0.774 0.194 I:P04908:0.063
F:P06899:0.132
DT
DA
DG
DG
DG
DG
DA
DC
5.935
4.378
6.895
9.952
6.677
4.546
7.921
9.348
O
O
O
OE2
OE2
OE2
OE2
CD
O3'
OP1
OP2
O3'
O3'
OP1
OP1
OP1
7lyb 9 P04908 98.31 3e-80 EM
2021-07-28 GLU L:31 C:41 187.0 0.984 S -73.2 -48.9 145.0 0.763 0.221 M:P04908:0.105
C:P06899:0.121
DT
DA
DG
DG
DG
DA
DC
7.811
5.562
7.963
8.260
6.009
4.389
6.819
OE2
OE2
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
GLU M:31 G:41 186.0 0.979 S -73.4 -44.3 149.0 0.784 0.195 L:P04908:0.074
F:P06899:0.121
DT
DA
DG
DG
DG
DG
DA
DC
5.914
4.378
6.811
9.702
6.933
4.890
7.619
8.789
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP2
O3'
C4'
OP1
OP1
OP1
7lyc 8 P04908 98.31 3e-80 EM
2021-06-16 GLU K:31 C:41 183.0 0.963 S -68.0 -39.5 145.0 0.763 0.2 C:P06899:0.137
L:P04908:0.058
DG
DT
DA
DG
DG
DG
DA
DC
9.663
6.698
4.696
7.510
8.795
5.504
4.094
6.685
OE2
OE2
OE2
OE2
CG
O
O
O
O3'
O3'
C5'
OP1
OP1
O3'
OP1
OP2
GLU L:31 G:41 185.0 0.974 S -65.0 -41.3 145.0 0.763 0.211 K:P04908:0.074
F:P06899:0.137
DT
DA
DG
DG
DG
DG
DA
DC
5.890
4.313
6.695
9.447
6.338
4.668
7.575
8.887
O
O
O
OE2
OE2
OE1
OE1
CG
O3'
C5'
OP1
O3'
O3'
OP1
OP1
OP1
6k1i 3 P16104 95.12 1e-79 X-RAY
2020-01-15 GLU C:45 C:41 202.0 1.0 S -49.3 -42.9 129.0 0.679 0.321 G:P16104:0.205
D:P06899:0.247
DT
DA
DG
DG
DG
DA
DC
8.000
5.803
7.740
8.824
5.819
4.152
6.069
OE1
OE1
OE1
CG
O
O
O
O3'
OP1
OP2
OP1
O3'
C5'
OP1
GLU G:45 G:41 203.0 1.0 S -54.0 -41.7 149.0 0.784 0.216 H:P06899:0.142
C:P16104:0.153
DT
DA
DG
DT
DA
DA
DC
5.891
4.477
6.202
6.085
4.717
7.626
8.096
O
O
O
OE2
OE2
CB
OE1
O3'
OP1
OP1
O3'
OP1
OP1
OP1
6k1j 3 P16104 95.12 1e-79 X-RAY
2020-01-15 GLU C:45 C:41 189.0 0.995 S -65.4 -36.5 123.0 0.647 0.348 G:P16104:0.226
D:P06899:0.126
DT
DG
DG
DA
DC
DA
DT
DA
9.502
6.517
7.903
9.406
7.759
5.851
4.453
6.496
CB
CB
CB
OE1
OE1
O
O
O
C5'
C5'
OP2
O3'
OP1
O3'
OP1
OP2
GLU G:45 G:41 198.0 1.0 S -59.3 -34.8 112.0 0.589 0.411 C:P16104:0.263
H:P06899:0.189
DT
DA
DC
DT
DT
DG
DA
5.539
3.765
6.281
7.100
5.444
7.139
9.662
O
O
O
OE2
OE2
OE2
OE1
O3'
OP1
OP2
O3'
OP1
OP1
OP2
6k1k 3 P16104 95.12 1e-79 X-RAY
2020-01-15 GLU C:45 C:41 196.0 1.0 S -62.4 -25.6 155.0 0.816 0.184 G:P16104:0.137
D:P06899:0.079
DT
DA
DG
DA
DC
DG
DA
DC
HOH
8.426
6.910
8.359
7.733
5.765
5.380
4.146
5.827
6.436
OE1
OE1
C
OE2
OE1
O
O
OE2
N
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU G:45 G:41 198.0 1.0 S -59.4 -32.3 126.0 0.663 0.337 C:P16104:0.316
H:P06899:0.068
DG
DA
DC
DT
DA
DG
DA
DC
HOH
5.440
4.005
6.243
9.605
7.191
8.124
8.887
7.343
3.311
O
O
O
CB
CB
CB
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
O
1s32 4 30268540 96.64 2e-79 X-RAY
2004-05-11 GLU E:41 C:841 180.0 0.947 S -67.6 -38.0 106.0 0.558 0.389 I:30268540:0.284
F:30268542:0.116
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.647
6.914
8.008
9.142
7.046
5.590
4.037
6.444
2.906
CB
CB
CB
OE1
OE1
O
O
O
OE2
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP1
O
GLU I:41 G:1041 182.0 0.958 S -63.1 -48.0 113.0 0.595 0.363 E:30268540:0.258
J:30268542:0.105
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.777
3.977
6.564
9.066
6.523
7.883
9.569
7.304
3.360
O
O
O
CB
CB
CB
OE2
OE1
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
OP1
O
2nzd 5 Q6AZJ8 96.64 2e-79 X-RAY
2007-04-10 GLU E:41 C:41 195.0 1.0 S -66.3 -44.1 121.0 0.637 0.363 I:Q6AZJ8:0.274
F:P02281:0.111
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.416
7.260
7.837
9.777
8.067
5.948
4.165
7.072
6.643
CB
CB
CB
OE1
OE1
O
O
O
OE2
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:41 193.0 1.0 S -53.5 -40.6 132.0 0.695 0.305 J:P02281:0.095
E:Q6AZJ8:0.226
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.990
4.442
6.758
9.174
6.870
8.156
9.529
7.968
4.150
O
O
O
CB
CB
CB
OE1
OE1
CG
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
O
3kuy 3 Q6AZJ8 96.64 2e-79 X-RAY
2010-01-05 GLU C:41 C:41 197.0 1.0 S -59.9 -54.7 123.0 0.647 0.353 D:Q92130:0.147
G:Q6AZJ8:0.268
DT
DG
DG
DT
DA
DA
DT
DA
9.298
7.014
7.877
9.802
8.108
6.354
4.451
6.968
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU G:41 G:41 193.0 1.0 S -54.1 -75.4 142.0 0.747 0.253 H:Q92130:0.142
C:Q6AZJ8:0.132
DA
DT
DA
DT
DT
DG
DG
DT
DA
6.035
4.176
7.212
9.437
6.851
4.407
7.684
9.706
7.891
O
O
O
OE1
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP1
O3'
OP2
3lz0 3 Q6AZJ8 96.64 2e-79 X-RAY
2010-09-15 GLU C:41 C:41 186.0 0.979 S -53.2 -61.5 144.0 0.758 0.221 D:P02281:0.137
G:Q6AZJ8:0.084
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.589
6.100
4.429
7.149
9.578
7.789
9.484
5.814
4.485
6.278
OE2
OE2
OE2
OE1
CG
OE2
OE2
O
O
O
N2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU G:41 G:41 186.0 0.979 S -42.6 -65.3 132.0 0.695 0.284 C:Q6AZJ8:0.153
H:P02281:0.132
DT
DA
DG
DG
DG
DA
DA
DC
5.778
4.214
6.860
7.504
5.218
7.268
8.862
6.853
O
O
O
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP2
C4'
OP1
OP1
O3'
OP1
3lz1 3 Q6AZJ8 96.64 2e-79 X-RAY
2010-09-15 GLU C:41 C:41 184.0 0.968 S -56.5 -48.1 142.0 0.747 0.221 D:P02281:0.126
G:Q6AZJ8:0.095
DG
DG
DG
DA
DA
DC
DC
DT
DA
DG
9.674
6.259
4.688
7.100
9.367
7.771
9.590
6.000
4.409
6.252
OE2
OE2
OE2
OE1
CG
OE2
OE2
O
O
O
O3'
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
GLU G:41 G:41 190.0 1.0 S -40.8 -62.2 131.0 0.689 0.311 H:P02281:0.132
C:Q6AZJ8:0.179
DG
DA
DC
DT
DA
DG
DA
DG
5.699
4.187
7.005
7.987
5.690
7.164
8.884
6.877
O
O
O
OE1
OE1
CB
OE2
OE1
O3'
OP1
P
C5'
OP1
OP1
O3'
OP1
3mgp 3 Q6AZJ8 96.64 2e-79 X-RAY
2010-06-16 GLU C:41 C:41 194.0 1.0 S -69.9 -44.2 135.0 0.711 0.289 D:P02281:0.105
G:Q6AZJ8:0.205
DT
DG
DG
DA
DA
DT
DA
9.658
7.142
8.047
8.463
5.960
4.232
7.570
CB
CB
CB
OE1
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP2
GLU G:41 G:41 177.0 0.932 S -55.4 -36.8 127.0 0.668 0.264 H:P02281:0.163
C:Q6AZJ8:0.1
DA
DT
DA
DT
DT
DG
DG
5.923
4.254
6.900
9.046
5.719
3.834
6.628
O
O
O
OE2
OE2
OE2
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP2
3mgq 3 Q6AZJ8 96.64 2e-79 X-RAY
2010-06-16 GLU C:41 C:41 187.0 0.984 S -64.4 -30.8 129.0 0.679 0.305 G:Q6AZJ8:0.2
D:P02281:0.1
DT
DG
DG
DA
DA
DT
DA
9.081
6.830
8.049
9.100
6.065
4.272
7.480
CB
CB
CB
OE1
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP2
GLU G:41 G:41 175.0 0.921 S -51.8 -50.4 123.0 0.647 0.274 H:P02281:0.168
C:Q6AZJ8:0.1
DA
DT
DA
DT
DT
DG
DG
NI
6.379
4.594
6.921
8.970
5.837
4.520
6.582
9.856
O
O
OE2
OE2
OE2
OE1
OE1
OE1
O3'
OP1
OP1
O3'
O3'
O5'
OP2
NI
3mgr 3 Q6AZJ8 96.64 2e-79 X-RAY
2010-06-16 GLU C:41 C:41 188.0 0.989 S -69.4 -40.2 127.0 0.668 0.321 D:P02281:0.126
G:Q6AZJ8:0.226
DT
DG
DG
DT
DA
DA
DT
DA
9.645
7.168
8.196
9.435
8.194
5.950
4.113
6.966
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU G:41 G:41 183.0 0.963 S -54.4 -38.6 129.0 0.679 0.284 H:P02281:0.179
C:Q6AZJ8:0.111
DA
DT
DA
DT
DT
DG
DG
DA
5.860
4.161
6.979
8.996
6.244
4.285
6.308
9.265
O
O
O
OE2
OE1
OE2
OE1
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP2
3mgs 3 Q6AZJ8 96.64 2e-79 X-RAY
2010-06-16 GLU C:41 C:41 193.0 1.0 S -61.1 -43.3 129.0 0.679 0.321 D:P02281:0.142
G:Q6AZJ8:0.237
DT
DG
DG
DT
DA
DA
DT
DA
9.634
6.952
8.047
9.333
8.088
6.158
4.357
7.221
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP2
O3'
OP2
O3'
OP1
OP2
GLU G:41 G:41 182.0 0.958 S -58.3 -32.3 128.0 0.674 0.284 H:P02281:0.174
C:Q6AZJ8:0.116
DA
DT
DA
DT
DT
DG
DG
DA
6.068
4.478
7.222
9.071
6.696
4.464
6.331
9.204
O
O
O
OE2
OE1
OE2
OE1
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP2
3mnn 3 Q6AZJ8 96.64 2e-79 X-RAY
2011-04-06 GLU C:41 C:41 189.0 0.995 S -53.4 -58.6 121.0 0.637 0.358 D:P02281:0.153
G:Q6AZJ8:0.242
DT
DG
DG
DT
DA
DA
DT
DA
9.245
6.904
7.838
9.481
7.860
6.174
4.245
7.103
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:41 G:41 197.0 1.0 S -56.0 -33.1 124.0 0.653 0.347 H:P02281:0.121
C:Q6AZJ8:0.263
DA
DT
DA
DT
DG
DG
DT
DA
5.904
4.255
6.655
7.653
6.221
7.883
9.956
8.145
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP2
3x1t 4 Q8CGP4 91.06 5e-78 X-RAY
2015-09-23 GLN E:41 C:41 197.0 1.0 S -62.1 -49.9 152.0 0.844 0.156 F:P70696:0.106
I:Q8CGP4:0.144
DT
DT
DG
DT
DA
DT
DA
DC
8.142
6.791
7.650
9.362
7.548
6.293
4.425
6.467
CB
CB
CB
NE2
NE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLN I:41 G:41 190.0 1.0 S -90.5 -34.2 143.0 0.794 0.206 J:P70696:0.211
E:Q8CGP4:0.05
DA
DT
DA
DT
DG
DG
DC
MN
5.797
4.164
6.756
5.883
3.710
6.126
8.998
9.554
O
O
O
OE1
OE1
OE1
NE2
OE1
O3'
OP1
OP2
O3'
C5'
OP2
OP2
MN
3x1u 4 Q8CGP4 91.06 5e-78 X-RAY
2015-09-23 GLN E:41 C:41 206.0 1.0 S -59.0 -39.2 140.0 0.778 0.222 F:P33778:0.133
I:Q8CGP4:0.233
DT
DT
DG
DA
DT
DA
DC
HOH
8.039
6.574
8.028
8.734
6.338
4.707
6.479
6.599
CB
OE1
CB
NE2
O
O
O
N
O3'
OP1
OP2
OP1
O3'
OP1
OP2
O
GLN I:41 G:41 184.0 1.0 S -61.0 -41.1 144.0 0.8 0.2 J:P33778:0.139
E:Q8CGP4:0.083
DA
DT
DA
DT
DT
DG
DG
DC
6.114
4.483
6.977
8.951
5.595
3.653
7.425
9.102
O
O
O
NE2
NE2
NE2
OE1
OE1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
OP2
1kx3 4 P06897 96.58 7e-78 X-RAY
2002-12-25 GLU E:41 C:41 193.0 1.0 S -66.2 -37.9 128.0 0.674 0.326 F:P02281:0.111
I:P06897:0.226
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.598
7.035
8.075
9.080
8.067
5.995
4.048
7.458
2.910
CB
CB
CB
OE1
OE1
O
O
O
OE1
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:41 195.0 1.0 S -66.2 -37.0 123.0 0.647 0.353 J:P02281:0.121
E:P06897:0.274
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.892
4.164
7.193
8.971
6.661
8.031
9.519
8.114
2.870
O
O
O
CB
CB
CB
OE1
OE1
N
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
O
1kx4 4 P06897 96.58 7e-78 X-RAY
2002-12-25 GLU E:41 C:41 185.0 0.974 S -53.9 -33.6 131.0 0.689 0.285 F:P02281:0.174
I:P06897:0.116
DG
DT
DG
DT
DC
DA
DC
DT
HOH
9.856
5.738
3.322
6.995
8.361
5.631
3.994
6.620
2.670
OE2
OE2
OE2
OE2
OE1
O
O
O
OE2
N2
O3'
C5'
P
OP1
O3'
OP1
OP1
O
GLU I:41 G:41 202.0 1.0 S -70.5 -30.2 156.0 0.821 0.179 J:P02281:0.095
E:P06897:0.147
DC
DA
DC
DG
DT
DC
DC
DT
HOH
5.562
3.963
6.148
7.375
5.235
8.336
9.002
6.680
4.302
O
O
O
OE1
OE1
N
OE2
OE2
CG
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
O
1kx5 5 P06897 96.58 7e-78 X-RAY
2002-12-25 GLU E:41 C:41 192.0 1.0 S -68.3 -34.2 131.0 0.689 0.311 I:P06897:0.216
F:P02281:0.116
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.608
7.153
8.234
9.470
8.118
5.895
4.009
7.061
2.542
CB
CB
CB
OE1
OE1
O
O
O
OE1
O3'
C5'
OP2
O3'
OP2
O3'
OP1
OP2
O
GLU I:41 G:41 178.0 0.937 S -55.3 -47.3 125.0 0.658 0.279 E:P06897:0.095
J:P02281:0.189
DA
DT
DA
DT
DT
DG
DG
DA
HOH
6.103
4.302
7.153
8.911
6.251
3.913
6.087
9.266
2.607
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP1
O
3b6f 5 Q6AZJ8 96.58 7e-78 X-RAY
2007-12-25 GLU E:41 C:41 161.0 0.847 S -80.3 -52.4 107.0 0.563 0.284 F:P02281:0.068
I:Q6AZJ8:0.242
DT
DG
DG
DT
DA
DA
DT
DA
9.824
7.816
8.914
9.564
7.814
5.500
3.654
5.776
CB
CB
N
CG
CG
O
O
O
C5'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU I:41 G:41 181.0 0.953 S -80.8 -42.6 144.0 0.758 0.195 E:Q6AZJ8:0.074
J:P02281:0.126
DA
DT
DA
DT
DT
DG
DG
DA
DC
5.601
3.959
6.284
9.238
6.795
4.653
7.577
8.322
9.705
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP2
OP2
3b6g 5 Q6AZJ8 96.58 7e-78 X-RAY
2007-12-25 GLU E:41 C:41 168.0 0.884 S -77.3 -63.7 108.0 0.568 0.316 F:P02281:0.105
I:Q6AZJ8:0.216
DT
DG
DG
DT
DA
DA
DT
DA
9.889
7.376
8.327
9.457
7.618
6.161
4.412
7.247
CG
CB
N
OE1
OE1
O
O
O
C5'
C5'
OP1
O3'
OP1
O3'
OP1
OP1
GLU I:41 G:41 181.0 0.953 S -63.1 -39.7 131.0 0.689 0.264 E:Q6AZJ8:0.105
J:P02281:0.158
DA
DT
DA
DT
DG
DG
DA
6.102
4.242
6.659
7.003
4.591
6.417
8.829
O
O
O
OE1
OE1
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP2
OP2
3lel 3 Q6AZJ8 96.58 7e-78 X-RAY
2010-05-19 GLU C:41 C:41 179.0 0.942 S -65.7 -41.6 124.0 0.653 0.289 G:Q6AZJ8:0.189
D:P02281:0.1
DT
DG
DG
DT
DA
DA
DT
DA
9.297
7.320
8.321
8.946
7.020
6.277
4.359
7.417
CG
CB
N
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:41 G:41 183.0 0.963 S -47.1 -55.5 136.0 0.716 0.247 C:Q6AZJ8:0.111
H:P02281:0.137
DA
DT
DA
DT
DT
DG
DG
DA
6.281
4.641
6.718
8.918
6.597
4.472
7.081
9.540
O
O
OE2
OE2
OE2
OE1
OE1
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP2
OP1
GLU M:41 M:41 180.0 0.947 S -62.7 -52.5 NA NA NA
GLU Q:41 Q:41 169.0 0.889 S -56.5 -42.1 NA NA NA
3o62 3 P06897 96.58 7e-78 X-RAY
2011-01-05 GLU C:41 C:41 200.0 1.0 S -54.3 -37.1 146.0 0.768 0.232 D:P02281:0.084
G:P06897:0.2
DT
DT
DG
DG
DA
DT
DA
DT
DA
9.383
7.536
5.876
8.160
9.231
6.860
5.799
3.898
6.670
OE1
OE1
OE1
CB
OE2
OE2
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:41 G:41 201.0 1.0 S -53.2 -37.4 148.0 0.779 0.221 H:P02281:0.079
C:P06897:0.2
DT
DA
DT
DA
DC
DC
DT
DA
DC
6.271
4.810
5.878
8.051
5.597
8.373
8.217
6.335
9.619
O
O
O
OE1
OE1
CB
OE2
OE2
OE1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
OP2
4j8u 3 P06897 96.58 7e-78 X-RAY
2013-04-17 GLU C:41 C:41 190.0 1.0 S -61.1 -50.6 131.0 0.689 0.311 D:P02281:0.116
G:P06897:0.195
DT
DG
DG
DT
DA
DA
DT
DA
9.050
6.688
7.903
9.460
7.891
5.992
4.253
6.901
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:41 G:41 190.0 1.0 S -56.9 -34.0 137.0 0.721 0.279 C:P06897:0.195
H:P02281:0.079
DA
DT
DA
DT
DG
DG
DT
DA
ELJ
5.956
4.375
6.555
8.531
6.560
8.155
9.446
7.894
9.970
O
O
O
CB
CB
CB
OE1
OE1
OE2
O3'
OP1
OP2
O3'
O5'
OP1
O3'
OP2
C22
4j8v 3 Q6AZJ8 96.58 7e-78 X-RAY
2013-05-08 GLU C:41 C:41 192.0 1.0 S -59.1 -50.7 168.0 0.884 0.116 D:P02281:0.126
DA
DT
DA
6.048
4.272
7.031
O
O
O
O3'
OP1
OP2
GLU G:41 G:41 192.0 1.0 S -58.4 -36.9 NA NA NA
4j8w 3 Q6AZJ8 96.58 7e-78 X-RAY
2013-04-17 GLU C:41 C:41 192.0 1.0 S -62.8 -45.4 133.0 0.7 0.3 D:P02281:0.116
G:Q6AZJ8:0.195
DT
DG
DG
DT
DA
DA
DT
DA
1MK
9.144
6.779
7.940
9.320
7.771
5.920
4.317
7.027
9.784
CB
CB
CB
OE1
OE1
O
O
O
OE2
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
C22
GLU G:41 G:41 192.0 1.0 S -58.8 -33.8 139.0 0.732 0.268 C:Q6AZJ8:0.2
H:P02281:0.079
DA
DT
DA
DT
DG
DG
DT
DA
5.797
4.282
6.678
8.781
6.810
7.992
9.398
7.742
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP1
4j8x 3 Q6AZJ8 96.58 7e-78 X-RAY
2013-05-08 GLU C:41 C:41 193.0 1.0 S -56.8 -55.4 170.0 0.895 0.105 D:P02281:0.121
DT
DG
DG
DT
DA
9.076
6.619
7.918
9.350
7.763
CB
CB
CB
OE1
OE1
O3'
C5'
OP1
O3'
OP2
GLU G:41 G:41 194.0 1.0 S -43.7 -43.0 NA NA NA
4xuj 3 Q6AZJ8 96.58 7e-78 X-RAY
2016-01-27 GLU C:41 C:41 194.0 1.0 S -67.2 -44.4 126.0 0.663 0.337 D:P02281:0.132
G:Q6AZJ8:0.226
DT
DG
DG
DT
DA
DA
DT
DA
9.199
6.794
7.750
9.764
8.043
5.967
4.388
7.085
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:41 G:41 191.0 1.0 S -62.8 -36.4 128.0 0.674 0.326 C:Q6AZJ8:0.205
H:P02281:0.126
DA
DT
DA
DT
DG
DG
DA
5.960
4.304
6.788
7.969
6.072
7.615
8.620
O
O
O
CB
CB
CB
OE1
O3'
OP1
OP2
O3'
O5'
OP1
OP2
5cp6 5 Q6AZJ8 96.58 7e-78 X-RAY
2016-06-01 GLU E:41 C:41 194.0 1.0 S -58.9 -53.7 123.0 0.647 0.353 I:Q6AZJ8:0.253
F:P02281:0.142
DT
DG
DG
DT
DA
DA
DT
DA
9.546
7.019
8.208
9.309
7.961
6.181
4.360
7.130
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU I:41 G:41 200.0 1.0 S -36.9 -44.4 148.0 0.779 0.221 E:Q6AZJ8:0.163
J:P02281:0.116
DA
DT
DA
DT
DT
DG
DG
DT
DA
5.958
4.421
6.887
9.468
7.511
5.384
7.798
9.669
7.921
O
O
O
OE1
OE1
OE1
CB
OE2
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP1
O3'
OP2
5dnm 3 Q6AZJ8 96.58 7e-78 X-RAY
2016-09-14 GLU C:41 C:41 187.0 0.984 S -56.4 -54.6 122.0 0.642 0.342 G:Q6AZJ8:0.232
D:P02281:0.137
DT
DG
DG
DT
DA
DA
DT
DA
9.254
6.776
7.715
9.644
7.950
6.131
4.229
7.105
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:41 G:41 194.0 1.0 S -52.4 -42.5 127.0 0.668 0.332 H:P02281:0.126
C:Q6AZJ8:0.221
DA
DT
DA
DT
DG
DG
DA
6.073
4.285
6.769
7.561
6.072
7.692
8.228
O
O
O
CB
CG
CB
OE1
O3'
OP1
OP2
O3'
OP1
OP1
OP2
5dnn 3 Q6AZJ8 96.58 7e-78 X-RAY
2016-09-14 GLU C:41 C:41 189.0 0.995 S -55.1 -57.0 121.0 0.637 0.358 D:P02281:0.158
G:Q6AZJ8:0.237
DT
DG
DG
DT
DA
DA
DT
DA
9.180
6.743
7.736
9.644
7.898
6.147
4.244
7.257
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:41 G:41 192.0 1.0 S -52.1 -40.4 125.0 0.658 0.342 C:Q6AZJ8:0.232
H:P02281:0.121
DA
DT
DA
DT
DG
DG
DT
DA
6.029
4.331
6.669
7.507
6.095
7.853
9.886
8.071
O
O
O
CB
CG
CB
OE1
OE1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP2
5xf6 3 Q6AZJ8 96.58 7e-78 X-RAY
2017-10-11 GLU C:41 C:41 190.0 1.0 S -52.5 -55.1 124.0 0.653 0.347 D:P02281:0.137
G:Q6AZJ8:0.221
DT
DG
DG
DT
DA
DA
DT
DA
9.234
6.836
7.577
9.461
7.816
6.177
4.235
7.216
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:41 G:41 199.0 1.0 S -46.4 -41.2 137.0 0.721 0.279 C:Q6AZJ8:0.2
H:P02281:0.126
DA
DT
DA
DT
DG
DG
DA
6.020
4.319
6.662
7.656
6.056
7.697
8.342
O
O
O
CB
CG
CB
OE1
O3'
OP1
OP2
O3'
OP1
OP1
OP2
1aoi 4 P06897 96.55 4e-77 X-RAY
1998-09-30 GLU E:38 C:41 191.0 1.0 S -62.5 -57.8 124.0 0.653 0.347 F:P02281:0.126
I:P06897:0.232
DT
DG
DG
DT
DA
DA
DT
DA
9.311
6.815
7.917
9.536
8.652
6.358
4.298
7.293
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU I:38 G:41 186.0 0.979 S -76.0 -54.8 123.0 0.647 0.332 J:P02281:0.142
E:P06897:0.195
DA
DT
DA
DT
DG
DG
DA
6.068
4.377
7.332
8.842
6.237
7.688
8.865
O
O
O
CB
CB
CB
OE1
O3'
OP1
OP2
O3'
C5'
OP2
OP2
6jma 4 Q6AZJ8 93.97 3e-75 EM
2019-05-15 GLU E:28 C:41 191.0 1.0 S -66.2 -37.9 126.0 0.663 0.337 F:P02281:0.116
I:Q6AZJ8:0.232
DT
DG
DG
DT
DA
DA
DT
DA
9.597
7.034
8.075
9.080
8.066
5.995
4.049
7.458
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU I:28 G:41 195.0 1.0 S -66.2 -36.9 121.0 0.637 0.363 J:P02281:0.126
E:Q6AZJ8:0.279
DA
DT
DA
DT
DG
DG
DT
DA
5.892
4.163
7.193
8.971
6.661
8.030
9.519
8.114
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
6iy2 3 Q6AZJ8 96.46 5e-75 EM
2019-04-03 GLU C:33 C:41 188.0 0.989 S -77.4 -63.9 124.0 0.653 0.336 G:Q6AZJ8:0.232
D:A0A1L8FQA5:0.105
DT
DG
DT
DA
DC
DA
DA
DC
7.752
5.681
8.459
9.070
7.360
6.015
4.026
7.667
OE1
OE1
CB
OE2
OE2
O
O
O
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:33 G:41 184.0 0.968 S -72.8 -35.8 140.0 0.737 0.231 H:A0A1L8FQA5:0.142
C:Q6AZJ8:0.084
DG
DA
DC
DG
DC
DC
DG
DC
6.016
4.793
6.849
9.115
6.635
4.812
6.344
8.966
O
O
O
OE2
OE2
OE2
OE1
OE2
O3'
O5'
OP2
O3'
C4'
OP1
OP1
OP1
6iy3 3 Q6AZJ8 96.46 5e-75 EM
2019-04-03 GLU C:33 C:41 191.0 1.0 S -68.0 -53.3 132.0 0.695 0.305 D:A0A1L8FQA5:0.168
G:Q6AZJ8:0.147
DG
DT
DG
DC
DA
DA
DC
7.229
5.073
6.850
9.025
5.807
3.924
7.126
OE1
OE1
OE1
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP2
GLU G:33 G:41 187.0 0.984 S -78.2 -34.7 135.0 0.711 0.273 H:A0A1L8FQA5:0.147
C:Q6AZJ8:0.121
DG
DA
DC
DG
DC
DC
DC
6.678
4.873
7.508
5.971
4.397
7.531
7.883
O
O
O
OE2
OE2
OE1
OE2
O3'
C5'
OP2
O3'
OP1
OP2
OP1
6r1t 3 Q6AZJ8 97.27 1e-73 EM
2019-04-24 GLU C:32 C:41 194.0 1.0 S -79.9 -24.7 153.0 0.805 0.195 G:Q6AZJ8:0.095
D:A0A1L8FQ56:0.126
DG
DG
DG
DA
DA
DC
DT
DA
DG
9.698
7.569
5.325
8.229
8.742
8.008
6.567
4.347
6.245
OE2
OE1
OE1
N
OE2
OE2
O
O
O
O3'
O3'
OP1
OP1
O3'
OP1
O3'
C5'
OP2
GLU G:32 G:41 200.0 1.0 S -65.5 -30.8 159.0 0.837 0.163 C:Q6AZJ8:0.116
H:A0A1L8FQ56:0.1
DG
DA
DC
DG
DT
DA
DG
DA
DG
DT
5.007
3.104
8.595
9.667
7.750
5.875
8.214
8.808
6.918
9.661
O
O
OE2
OE2
OE2
OE1
N
OE2
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
O3'
OP2
OP2
6fq5 3 Q6AZJ8 96.36 9e-73 EM
2018-04-18 GLU C:33 C:41 195.0 1.0 S -58.5 -41.5 146.0 0.768 0.232 D:A0A1L8FQ56:0.163
G:Q6AZJ8:0.095
DG
DG
DG
DA
DC
DT
DA
DG
8.740
6.399
4.240
6.749
9.219
6.303
4.592
6.798
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C4'
OP1
OP2
OP2
O3'
C5'
OP2
GLU G:33 G:41 186.0 0.979 S -71.9 -29.8 143.0 0.753 0.226 H:A0A1L8FQ56:0.153
C:Q6AZJ8:0.068
DG
DA
DC
DG
DT
DA
DG
DG
5.750
4.318
7.321
9.031
7.031
5.386
6.337
8.616
O
O
O
OE2
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
C5'
OP1
OP2
OP2
6fq6 3 Q6AZJ8 96.36 9e-73 EM
2018-04-18 GLU C:33 C:41 189.0 0.995 S -59.6 -44.5 143.0 0.753 0.242 D:A0A1L8FQ56:0.195
G:Q6AZJ8:0.047
DG
DG
DG
DA
DC
DT
DA
DG
8.037
5.375
3.263
7.025
9.570
5.776
3.859
6.186
OE2
OE2
OE2
OE1
CG
O
O
O
O3'
C4'
OP1
OP2
OP1
O3'
C5'
OP1
GLU G:33 G:41 190.0 1.0 S -71.6 -34.3 143.0 0.753 0.247 H:A0A1L8FQ56:0.205
C:Q6AZJ8:0.047
DG
DA
DC
DG
DT
DA
DG
DG
5.208
3.923
6.263
8.504
6.283
4.274
7.177
8.475
O
O
O
OE2
OE2
OE1
OE1
OE2
O3'
C5'
OP2
O3'
C4'
C5'
OP2
OP1
6fq8 3 Q6AZJ8 96.36 9e-73 EM
2018-04-18 GLU C:33 C:41 189.0 0.995 S -58.8 -45.1 140.0 0.737 0.258 G:Q6AZJ8:0.063
D:A0A1L8FQ56:0.2
DG
DG
DG
DA
DC
DC
DT
DA
DG
8.024
5.306
3.230
6.188
9.153
9.774
5.739
3.784
5.881
OE2
OE2
OE2
OE1
OE2
OE2
O
O
O
O3'
O3'
OP1
OP2
OP1
O2
O3'
C5'
OP1
GLU G:33 G:41 190.0 1.0 S -72.2 -34.9 140.0 0.737 0.263 C:Q6AZJ8:0.068
H:A0A1L8FQ56:0.195
DG
DA
DC
DG
DT
DA
DG
DG
DT
4.946
3.852
6.774
8.562
5.630
3.391
6.663
8.961
9.694
O
O
O
OE2
OE2
OE2
OE1
OE2
OE2
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
OP1
6y5e 6 Q16777 98.15 2e-72 EM
2020-09-23 GLU G:31 G:42 184.0 0.968 S -57.0 -38.8 139.0 0.732 0.236 C:Q16777:0.079
H:O60814:0.163
DT
DA
DG
DG
DG
DA
DC
5.936
4.250
6.359
6.126
5.446
7.383
8.016
O
O
O
OE2
OE1
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
6y5e 3 Q16777 98.13 1e-71 EM
2020-09-23 GLU C:31 C:42 180.0 0.947 S -66.0 -35.3 102.0 0.537 0.41 D:O60814:0.174
G:Q16777:0.237
DA
DG
DG
DG
DA
DC
PTD
7.533
7.471
9.000
5.919
4.205
6.414
8.910
CB
OE1
CG
O
O
O
OE2
C5'
OP1
OP1
O3'
C5'
OP2
C1
6ipu 3 P04908 98.13 1e-71 X-RAY
2020-01-15 GLU C:29 C:41 193.0 1.0 S -59.1 -51.0 128.0 0.674 0.326 D:P06899:0.121
G:P04908:0.221
DT
DG
DG
DA
DC
DA
DT
DA
9.165
6.363
7.649
9.261
7.452
5.897
4.136
6.736
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:29 G:41 199.0 1.0 S -63.7 -40.3 140.0 0.737 0.263 H:P06899:0.153
C:P04908:0.153
DT
DA
DC
DT
DT
DT
DG
DA
5.849
4.124
6.471
9.835
6.160
4.809
8.040
8.809
O
O
O
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP1
OP2
3kwq 3 Q6AZJ8 97.2 2e-71 X-RAY
2010-05-12 GLU C:28 C:41 187.0 0.984 S -68.4 -56.4 134.0 0.705 0.279 G:Q6AZJ8:0.189
D:P02281:0.089
DT
DG
DG
DT
DA
DA
DT
DA
9.448
6.782
7.929
9.523
8.193
5.892
3.803
7.520
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU G:28 G:41 197.0 1.0 S -73.1 -45.9 132.0 0.695 0.305 H:P02281:0.126
C:Q6AZJ8:0.216
DA
DT
DA
DT
DG
DG
DT
DA
5.642
4.137
7.202
9.081
6.482
7.643
9.706
7.929
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
4xzq 3 Q6AZJ8 97.2 2e-71 X-RAY
2015-10-14 GLU C:28 C:841 185.0 0.974 S -71.4 -33.2 122.0 0.642 0.332 D:P02281:0.095
G:Q6AZJ8:0.242
DT
DG
DG
DT
DA
DA
DT
DA
9.657
7.242
8.326
9.062
7.821
5.947
3.957
6.936
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:28 G:1041 186.0 0.979 S -61.8 -40.7 125.0 0.658 0.321 H:P02281:0.111
C:Q6AZJ8:0.211
DA
DT
DA
DT
DG
DG
DT
DA
5.628
4.061
7.087
8.956
6.625
8.060
9.906
8.126
O
O
O
CB
CB
CB
OE2
OE1
O3'
OP1
OP2
O3'
C5'
OP2
OP1
OP1
4ys3 3 Q6AZJ8 97.2 2e-71 X-RAY
2015-10-14 GLU C:28 C:841 192.0 1.0 S -57.0 -58.3 134.0 0.705 0.295 D:P02281:0.132
G:Q6AZJ8:0.174
DT
DG
DG
DT
DA
DA
DT
DA
9.094
6.585
7.783
9.599
8.220
5.950
3.982
7.136
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:28 G:1041 203.0 1.0 S -60.8 -38.4 145.0 0.763 0.237 C:Q6AZJ8:0.184
H:P02281:0.121
DA
DT
DA
DT
DG
DG
DT
DA
5.843
4.384
7.070
8.858
6.697
7.963
9.732
8.347
O
O
O
CB
CB
CB
OE2
OE1
O3'
OP1
OP2
O3'
C5'
OP2
OP1
OP2
4z66 3 Q6AZJ8 97.2 2e-71 X-RAY
2015-10-14 GLU C:28 C:841 186.0 0.979 S -65.3 -35.7 135.0 0.711 0.268 G:Q6AZJ8:0.163
D:P02281:0.1
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.706
7.153
8.254
8.897
7.697
6.043
4.155
7.262
3.608
CB
CB
CB
OE1
OE1
O
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU G:28 G:1041 185.0 0.974 S -67.0 -38.1 138.0 0.726 0.248 H:P02281:0.153
C:Q6AZJ8:0.095
DA
DT
DA
DT
DT
DG
DG
DA
HOH
5.893
4.290
7.267
9.017
5.774
4.013
7.495
9.617
9.161
O
O
O
OE2
OE2
OE2
OE2
OE1
OE1
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
O
6jm9 5 Q6AZJ8 97.2 2e-71 EM
2019-05-15 GLU E:28 C:41 193.0 1.0 S -66.2 -37.9 127.0 0.668 0.332 I:Q6AZJ8:0.226
F:P02281:0.121
DT
DG
DG
DT
DA
DA
DT
DA
9.597
7.034
8.074
9.080
8.066
5.995
4.048
7.458
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
GLU I:28 G:41 196.0 1.0 S -66.2 -36.9 121.0 0.637 0.363 E:Q6AZJ8:0.284
J:P02281:0.132
DA
DT
DA
DT
DG
DG
DT
DA
5.891
4.163
7.193
8.972
6.660
8.030
9.519
8.114
O
O
O
CB
CB
CB
OE1
OE1
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP2
6ugm 3 Q6AZJ8 97.2 3e-71 EM
2019-11-20 GLU C:30 C:41 168.0 0.884 S -77.7 -49.1 114.0 0.6 0.284 D:A0A1L8FQ56:0.111
G:Q6AZJ8:0.174
DT
DA
DG
DG
DG
DA
DA
DC
7.186
5.160
6.091
8.463
6.561
7.044
9.939
8.132
O
O
OE2
CG
CG
CB
OE1
OE2
O3'
O5'
OP1
O3'
O5'
OP1
O3'
OP1
GLU G:30 G:41 170.0 0.895 S -63.9 -49.7 118.0 0.621 0.274 C:Q6AZJ8:0.174
H:P02281:0.1
DT
DA
DG
DG
DG
DA
DC
8.993
6.515
7.621
8.152
6.013
4.244
6.654
CG
CG
CB
OE2
O
O
OE2
O3'
C5'
OP1
OP1
O3'
OP1
OP1
6uh5 3 Q6AZJ8 97.2 3e-71 EM
2019-11-20 GLU C:30 C:41 177.0 0.932 S -76.7 -51.6 128.0 0.674 0.258 D:A0A1L8FQ56:0.1
G:Q6AZJ8:0.158
DT
DA
DG
DG
DG
DA
DA
DC
5.982
4.136
6.250
8.916
6.867
7.044
9.514
7.662
O
O
OE2
CG
CG
CB
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
GLU G:30 G:41 176.0 0.926 S -74.0 -54.2 140.0 0.737 0.189 C:Q6AZJ8:0.047
H:A0A1L8FQ56:0.147
DT
DA
DG
DA
DG
DG
DA
DC
8.010
5.525
7.418
9.927
7.839
6.005
4.322
7.039
OE1
OE1
OE1
OE2
OE2
O
O
O
O3'
C5'
OP2
O3'
OP1
O3'
OP1
OP2
7k6p 3 P06897 97.2 3e-71 EM
2021-02-10 GLU C:30 C:41 186.0 0.979 S -62.9 -36.1 133.0 0.7 0.279 G:P06897:0.116
D:P02281:0.163
DG
DT
DA
DG
DG
DG
DA
DC
8.743
6.433
4.651
7.294
8.113
5.632
4.236
6.325
OE2
OE2
OE2
OE1
OE2
O
O
O
O3'
C4'
OP1
OP2
OP1
O3'
OP1
OP2
GLU G:30 G:41 193.0 1.0 S -61.3 -41.1 144.0 0.758 0.242 H:P02281:0.153
C:P06897:0.111
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
6.211
4.388
6.744
8.994
6.195
4.053
6.754
9.977
7.730
9.553
O
O
O
OE2
OE2
OE2
OE1
OE2
OE2
OE2
O3'
C5'
OP2
O3'
O3'
OP1
OP1
O3'
OP1
OP2
7k6q 3 P06897 97.2 3e-71 EM
2021-02-10 GLU C:30 C:41 185.0 0.974 S -63.1 -40.1 145.0 0.763 0.211 D:P02281:0.089
G:P06897:0.116
DT
DA
DG
DA
DG
DG
DA
DC
8.607
6.511
8.419
7.787
5.877
5.678
4.211
5.726
CG
CG
CB
OE1
OE1
O
O
OE1
C4'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:30 G:41 184.0 0.968 S -61.9 -35.1 143.0 0.753 0.215 C:P06897:0.032
H:P02281:0.184
DT
DA
DG
DG
DG
DG
DA
DC
6.149
4.237
6.616
8.786
5.978
4.142
6.968
8.305
O
O
O
OE2
OE2
OE1
OE1
CG
O3'
C5'
OP2
O3'
O3'
C5'
OP1
OP1
6iq4 3 P04908 98.11 7e-71 X-RAY
2019-10-30 GLU C:28 C:41 190.0 1.0 S -59.7 -48.1 124.0 0.653 0.347 D:P06899:0.126
G:P04908:0.221
DT
DG
DG
DA
DC
DA
DT
DA
HOH
9.204
6.774
7.836
9.022
6.855
6.053
4.368
6.911
9.173
CB
CB
CB
OE1
OE1
O
O
O
OE2
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
O
GLU G:28 G:41 199.0 1.0 S -61.6 -35.7 137.0 0.721 0.279 H:P06899:0.163
C:P04908:0.163
DT
DA
DC
DT
DT
DG
DA
5.866
4.238
6.431
6.419
4.581
7.665
9.172
O
O
O
OE1
OE1
OE2
OE1
O3'
OP1
OP1
O3'
OP1
OP1
OP2
6jxd 7 P04908 98.11 7e-71 X-RAY
2020-01-15 GLU G:29 G:41 196.0 1.0 S -51.4 -54.2 155.0 0.816 0.184 H:P06899:0.132
C:P04908:0.084
DT
DA
DG
DG
DT
DA
DA
DC
6.088
4.489
6.342
9.812
6.347
4.428
7.540
8.202
O
O
O
OE2
OE2
OE2
CB
CD
O3'
OP1
OP1
N2
O3'
OP1
OP1
OP1
6jxd 3 P04908 98.11 7e-71 X-RAY
2020-01-15 GLU C:30 C:41 195.0 1.0 S -50.8 -51.8 150.0 0.789 0.211 D:P06899:0.142
G:P04908:0.095
DG
DT
DA
DG
DG
DG
DA
DC
HOH
9.867
6.811
4.608
7.585
8.611
6.225
4.479
6.462
9.747
OE1
OE1
OE1
OE1
OE2
O
O
O
N
N2
O3'
OP1
OP1
OP2
O3'
OP1
OP1
O
5g2e 2 P06897 97.17 1e-70 X-RAY
2016-08-03 GLU C:30 C:41 185.0 0.974 S -63.0 -34.4 NA NA NA
GLU G:30 G:41 184.0 0.968 S -63.0 -34.4 NA NA NA
GLU K:30 K:41 184.0 0.968 S -63.0 -34.4 146.0 0.768 0.2 L:P02281:0.2
GLU O:30 O:41 185.0 0.974 S -63.0 -34.4 NA NA NA
GLU S:30 S:41 185.0 0.974 S -62.9 -34.4 NA NA NA
GLU W:30 W:41 184.0 0.968 S -63.0 -34.3 NA NA NA
6yn1 1 Q6AZJ8 97.17 1e-70 X-RAY
2021-11-17 GLU A:30 A:41 176.0 0.926 S -55.7 -30.3 142.0 0.747 0.179 B:A0A1L8FQA5:0.095
F:Q6AZJ8:0.089
GLU F:30 F:41 195.0 1.0 S -86.8 -21.3 161.0 0.847 0.153 A:Q6AZJ8:0.105
G:A0A1L8FQA5:0.079
GLU K:30 K:41 201.0 1.0 S -59.0 -34.2 NA NA NA
GLU P:30 P:41 172.0 0.905 S -73.3 -45.4 NA NA NA
GLU U:30 U:41 191.0 1.0 S -69.3 -29.8 NA NA NA
GLU Z:30 Z:41 165.0 0.868 S -61.3 -38.1 NA NA NA
GLU EA:30 e:41 210.0 1.0 S -63.2 -30.7 NA NA NA
GLU JA:30 j:41 161.0 0.847 S -73.5 -31.7 NA NA NA
6ke9 3 P04908 98.1 3e-70 X-RAY
2020-04-22 GLU C:28 C:41 188.0 0.989 S -56.3 -47.2 151.0 0.795 0.194 D:O60814:0.137
G:P04908:0.063
DA
DG
DG
DG
DT
DA
DA
DC
8.931
5.967
4.171
7.569
8.095
5.538
4.262
6.710
OE2
OE1
OE1
OE1
CG
O
O
O
O3'
O3'
OP1
OP2
OP1
O3'
OP1
OP1
GLU G:28 G:41 204.0 1.0 S -53.3 -51.6 155.0 0.816 0.184 C:P04908:0.079
H:O60814:0.179
DG
DG
DT
DT
DC
DC
DT
DA
DA
DC
DC
9.863
5.655
4.343
6.683
9.261
5.067
3.759
7.125
9.495
7.125
9.501
OE1
O
O
O
OE1
OE1
OE1
OE1
OE2
OE2
OE2
N2
O3'
OP1
OP1
O3'
O3'
C5'
OP1
O3'
OP1
OP2
6l9h 3 P04908 98.1 3e-70 X-RAY
2020-04-22 GLU C:28 C:41 183.0 0.963 S -60.2 -54.0 137.0 0.721 0.242 G:P04908:0.068
D:O60814:0.174
DA
DG
DG
DG
DT
DA
DA
DC
9.496
5.911
4.190
7.478
8.320
5.821
4.364
7.144
OE1
OE1
OE1
CB
CG
O
O
OE2
O3'
O3'
C5'
OP1
OP1
O3'
OP1
OP1
GLU G:28 G:41 196.0 1.0 S -59.0 -55.1 146.0 0.768 0.232 C:P04908:0.074
H:O60814:0.189
DG
DG
DT
DT
DC
DC
DT
DA
DC
9.689
5.780
4.265
6.855
9.461
5.565
4.013
7.393
7.927
OE1
O
O
O
OE1
OE1
OE1
CB
OE2
N2
O3'
OP1
OP1
O3'
O3'
C5'
OP1
OP1
6le9 3 P04908 98.1 3e-70 X-RAY
2020-04-22 GLU C:28 C:41 183.0 0.963 S -61.2 -52.7 138.0 0.726 0.237 D:O60814:0.168
G:P04908:0.068
DC
DC
DT
DA
DC
DG
DG
DT
DT
8.977
6.151
4.422
7.068
8.244
9.480
5.759
4.297
7.090
OE2
OE2
OE2
OE1
OE2
OE2
O
O
O
O3'
O3'
C5'
OP1
OP1
N2
O3'
OP1
OP1
GLU G:28 G:41 199.0 1.0 S -58.4 -55.7 149.0 0.784 0.216 H:O60814:0.163
C:P04908:0.095
DA
DA
DC
DG
DG
DG
DT
DT
DA
5.756
4.396
6.924
5.943
4.101
7.129
9.788
7.713
9.912
O
O
O
OE1
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP2
O3'
C5'
OP2
O3'
OP1
OP2
7ea8 4 P20671 99.04 5e-70 EM
2021-07-14 GLU D:28 C:41 194.0 1.0 S -79.4 -40.9 145.0 0.763 0.237 E:None:0.147
H:P20671:0.105
DT
DA
DG
DG
DG
DA
DC
8.157
5.962
8.029
8.998
5.481
3.631
6.971
OE1
OE1
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
GLU H:28 G:41 181.0 0.953 S -85.7 -45.6 136.0 0.716 0.237 D:P20671:0.042
I:None:0.195
DT
DA
DG
DG
DG
DA
DC
6.557
4.701
7.513
6.847
4.820
7.331
9.345
O
O
O
OE2
OE2
OE1
OE2
O3'
OP1
OP2
O3'
OP1
OP1
OP1
7ea5 3 Q6AZJ8 97.14 6e-70 EM
2021-07-14 GLU C:29 C:41 195.0 1.0 S -77.6 -44.3 140.0 0.737 0.263 D:A0A1L8FQA5:0.132
G:Q6AZJ8:0.158
DT
DA
DG
DA
DG
DG
DA
DC
8.286
6.039
8.338
9.961
8.252
5.729
3.775
6.963
OE1
OE1
OE1
OE2
OE2
O
O
O
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
GLU G:29 G:41 202.0 1.0 S -79.6 -33.6 158.0 0.832 0.168 H:A0A1L8FQA5:0.163
C:Q6AZJ8:0.063
DT
DA
DG
DG
DG
DA
DC
6.373
4.555
7.298
6.712
5.317
8.128
8.576
O
O
O
OE2
OE1
OE1
OE2
O3'
C5'
OP2
O3'
C5'
OP1
OP1
7ktq 3 Q6AZJ8 97.14 6e-70 EM
2021-02-03 GLU C:29 C:41 194.0 1.0 S -74.0 -48.4 132.0 0.695 0.305 D:A0A1L8FQA5:0.111
G:Q6AZJ8:0.216
DT
DA
DG
DA
DG
DG
DA
DC
9.689
7.667
8.067
9.039
7.260
5.574
3.821
6.837
CB
CB
CB
OE1
OE1
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:29 G:41 193.0 1.0 S -72.8 -49.4 154.0 0.811 0.189 C:Q6AZJ8:0.068
H:A0A1L8FQA5:0.137
DT
DA
DG
DG
DG
DG
DA
DC
5.647
4.315
6.634
9.572
6.227
4.667
7.377
7.949
O
O
O
OE2
OE2
OE1
OE1
OE2
O3'
O5'
OP2
O3'
O3'
C5'
OP1
OP1
5mlu 3 P06897 97.14 6e-70 X-RAY
2017-05-10 GLU C:28 C:41 176.0 0.926 S -62.5 -39.0 132.0 0.695 0.231 D:A0A1B8Y853:0.147
G:P06897:0.079
DG
DG
DG
DA
DA
DC
DC
DT
DA
DG
9.055
5.761
4.345
7.439
9.826
7.734
9.749
6.136
4.168
6.379
OE2
OE2
OE2
OE1
CG
OE2
OE2
O
O
O
O3'
O3'
C5'
OP2
O3'
OP1
OP2
O3'
C5'
OP2
GLU G:28 G:41 193.0 1.0 S -65.4 -39.1 150.0 0.789 0.211 H:A0A1B8Y853:0.142
C:P06897:0.089
DG
DA
DC
DG
DT
DA
DG
DA
DG
DT
HOH
5.672
3.781
6.474
9.588
6.853
4.673
7.712
8.389
6.392
9.010
8.708
O
O
O
OE2
OE1
OE1
OE1
OE2
OE2
OE2
N
O3'
C5'
OP2
O3'
O3'
C5'
OP1
O3'
OP1
OP2
O
6z6p 11 P06897 97.14 6e-70 EM
2021-02-17 GLU K:28 G:41 192.0 1.0 S -82.7 -62.3 126.0 0.663 0.337 L:A0A1L8FQ56:0.084
G:Q6AZJ8:0.263
DT
DA
DG
DG
DG
DA
6.844
5.021
7.627
9.343
6.817
8.162
O
O
O
OE1
OE1
CB
O3'
OP1
OP2
O3'
OP1
OP1
6muo 3 Q93077 97.14 1e-69 EM
2019-07-24 GLU C:29 C:41 197.0 1.0 S -78.2 -1.9 130.0 0.684 0.316 D:Q5QNW6:0.074
G:Q93077:0.274
DT
DT
DG
DG
DT
DA
DC
9.825
7.614
8.490
9.127
6.719
5.140
7.230
OE1
OE1
C
OE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP1
GLU G:29 G:41 166.0 0.874 S -89.0 -38.0 127.0 0.668 0.206 C:Q93077:0.079
H:Q5QNW6:0.121
DA
DT
DG
DT
DC
DT
DC
5.710
4.098
6.400
8.963
7.125
4.863
7.487
O
O
OE2
OE2
OE1
OE1
OE1
O3'
OP1
OP1
O3'
O3'
C5'
OP1
6mup 3 Q93077 97.14 1e-69 EM
2019-07-24 GLU C:29 C:41 202.0 1.0 S -67.0 -28.2 142.0 0.747 0.253 G:Q93077:0.232
D:Q5QNW6:0.084
DT
DT
DG
DG
DT
DA
DC
8.562
6.213
8.330
9.444
6.776
5.032
7.067
OE1
OE1
OE1
OE2
O
O
O
O3'
OP1
OP1
OP1
O3'
OP1
OP2
GLU G:29 G:41 169.0 0.889 S -83.2 -24.1 139.0 0.732 0.157 C:Q93077:0.105
H:Q5QNW6:0.053
DA
DT
DG
DC
DT
DC
DC
6.714
4.842
5.636
8.027
6.391
8.816
9.294
O
O
OE2
OE1
OE1
N
OE2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
7ccq 3 P04908 98.06 7e-69 EM
2020-10-07 GLU C:27 C:41 190.0 1.0 S -77.8 -56.8 154.0 0.811 0.189 D:P06899:0.126
G:P04908:0.063
DG
DG
DG
DA
DA
DC
DT
DA
DG
9.380
6.719
5.228
7.874
9.707
7.595
5.504
3.769
6.225
OE2
OE2
OE1
CB
OE2
OE2
O
O
O
O3'
C5'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:27 G:41 197.0 1.0 S -71.1 -33.6 145.0 0.763 0.237 H:P06899:0.142
C:P04908:0.132
DG
DA
DC
DG
DT
DA
DG
DA
DG
DT
5.511
4.035
6.601
9.624
7.533
5.265
7.559
9.883
7.590
9.798
O
O
O
OE2
OE2
OE1
OE1
OE2
OE2
OE2
O3'
OP1
OP2
O3'
O3'
C5'
OP1
O3'
OP1
OP2
7ccr 3 P04908 98.06 7e-69 EM
2020-10-07 GLU C:27 C:41 188.0 0.989 S -78.7 -52.6 153.0 0.805 0.184 D:P06899:0.079
G:P04908:0.105
DG
DG
DG
DA
DA
DC
DT
DA
DG
9.734
7.292
5.990
8.405
9.137
7.307
5.107
3.349
5.034
OE2
OE2
OE1
N
OE2
OE2
O
O
OE2
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU G:27 G:41 197.0 1.0 S -73.2 -33.1 155.0 0.816 0.184 H:P06899:0.132
C:P04908:0.089
DG
DA
DC
DT
DA
DG
DA
DG
DT
4.945
3.314
6.924
8.026
5.410
7.405
9.662
7.410
9.987
O
O
OE2
OE1
OE1
CB
OE2
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP2
GLU N:27 N:41 187.0 0.984 S -78.7 -52.6 151.0 0.795 0.189 O:P06899:0.084
R:P04908:0.111
DG
DG
DG
DA
DA
DC
DT
DA
DG
9.735
7.292
5.990
8.405
9.137
7.306
5.107
3.349
5.034
OE2
OE2
OE1
N
OE2
OE2
O
O
OE2
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
GLU R:27 R:41 195.0 1.0 S -73.2 -33.1 152.0 0.8 0.2 N:P04908:0.089
S:P06899:0.137
DG
DA
DC
DT
DA
DG
DA
DG
DT
4.945
3.313
6.924
8.027
5.409
7.405
9.662
7.410
9.986
O
O
OE2
OE1
OE1
CB
OE2
OE2
OE2
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP2
6z6p 7 Q6AZJ8 97.09 1e-68 EM
2021-02-17 GLU G:26 C:41 162.0 0.853 S -79.8 -66.3 132.0 0.695 0.158 H:A0A1L8FQA5:0.111
K:P06897:0.053
DG
DT
DA
DG
DG
DA
DC
9.573
7.769
5.616
7.010
6.142
4.252
6.255
OE2
OE2
OE1
CB
O
O
OE2
N2
C4'
C5'
OP1
O3'
OP1
OP1
6nzo 3 P0CH09,Q6AZJ8 93.46 7e-68 EM
2019-08-28 GLU C:133 C:41 198.0 1.0 S -61.2 -39.9 108.0 0.568 0.432 D:P02281:0.137
G:P0CH09+Q6AZJ8:0.337
DT
DA
DG
DG
DG
DA
DC
5.776
4.240
6.703
7.571
5.426
7.918
8.723
O
O
O
OE1
OE1
CB
OE1
O3'
C5'
OP2
O3'
OP1
OP1
OP2
GLU G:133 G:41 197.0 1.0 S -72.4 -28.6 120.0 0.632 0.368 H:P02281:0.142
C:P0CH09+Q6AZJ8:0.284
DT
DA
DG
DA
DG
DG
DA
DC
8.524
7.034
8.240
8.472
7.125
5.808
4.102
5.901
CB
CB
N
OE2
OE2
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
C5'
OP2
6px1 3 P0CH09,Q6AZJ8 93.46 7e-68 EM
2019-08-28 GLU C:133 C:41 188.0 0.989 S -81.7 -24.0 145.0 0.763 0.226 G:P0CH09+Q6AZJ8:0.068
D:P02281:0.163
DT
DA
DG
DG
DG
DG
DA
DA
DC
DC
5.661
4.064
6.595
9.899
6.751
4.632
6.701
9.385
7.170
9.400
O
O
O
OE1
OE2
OE2
OE2
OE1
OE1
OE1
O3'
C5'
OP2
O3'
O3'
C5'
OP1
O3'
OP1
OP2
GLU G:133 G:41 188.0 0.989 S -70.2 -29.2 140.0 0.737 0.252 H:P02281:0.168
C:P0CH09+Q6AZJ8:0.084
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.842
5.922
4.543
6.836
9.345
7.230
9.344
5.821
4.304
6.632
OE1
OE1
OE2
OE2
OE1
OE1
OE1
O
O
O
O3'
O3'
C5'
OP2
O3'
OP1
OP2
O3'
C5'
OP1
6px3 3 P0CH09,Q6AZJ8 93.46 7e-68 EM
2019-08-28 GLU C:133 C:41 200.0 1.0 S -61.2 -39.9 109.0 0.574 0.426 G:P0CH09+Q6AZJ8:0.342
D:P02281:0.142
DT
DA
DG
DG
DG
DA
DC
5.776
4.240
6.703
7.571
5.426
7.918
8.724
O
O
O
OE1
OE1
CB
OE1
O3'
C5'
OP2
O3'
OP1
OP1
OP2
GLU G:133 G:41 196.0 1.0 S -72.4 -28.6 120.0 0.632 0.368 C:P0CH09+Q6AZJ8:0.279
H:P02281:0.142
DT
DA
DG
DA
DG
DG
DA
DC
8.524
7.034
8.240
8.472
7.125
5.808
4.102
5.902
CB
CB
N
OE2
OE2
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
C5'
OP2
6dzt 3 P84051 92.45 9e-68 EM
2019-05-22 GLU C:41 C:41 177.0 0.932 S -82.3 -23.7 142.0 0.747 0.185 D:P02283:0.126
G:P84051:0.058
DG
DG
DG
DA
DC
DT
DA
DG
9.632
6.581
4.543
7.137
7.716
5.641
4.180
6.317
OE1
OE1
OE1
OE1
OE2
O
O
OE2
N2
O3'
C5'
OP1
OP1
O3'
C5'
OP1
GLU G:41 G:41 171.0 0.9 S -70.1 -29.3 129.0 0.679 0.221 H:P02283:0.142
C:P84051:0.079
DG
DA
DC
DG
DT
DA
DG
DA
DG
5.926
4.436
6.311
9.745
5.777
4.396
7.180
9.827
7.608
O
O
OE2
OE1
OE1
OE1
OE1
OE2
OE2
O3'
C5'
OP1
N2
O3'
C5'
P
O3'
OP1
6pwe 3 P84051 92.45 9e-68 EM
2019-08-21 GLU C:41 C:40 148.0 0.779 S -79.7 -48.9 99.0 0.521 0.258 D:P02283:0.058
G:P84051:0.211
DG
DG
DA
DC
DT
DA
DG
9.799
8.292
8.765
8.390
5.456
3.370
4.409
CG
CG
C
OE1
O
O
OE2
C5'
C5'
OP1
OP1
O3'
OP1
OP1
GLU G:41 G:40 147.0 0.774 S -79.7 -48.9 100.0 0.526 0.248 C:P84051:0.2
H:P02283:0.047
DG
DA
DC
DA
DG
DA
DG
5.777
3.732
4.592
8.343
9.014
9.471
7.735
O
O
OE2
CG
C
OE1
OE1
O3'
OP1
OP2
C5'
OP1
O3'
OP1
6pwf 3 P84051 92.45 9e-68 EM
2019-08-21 GLU C:41 C:40 180.0 0.947 S -75.9 -61.4 131.0 0.689 0.258 D:P02283:0.053
G:P84051:0.205
DG
DG
DG
DA
DC
DT
DA
DG
7.828
6.322
8.642
9.834
8.152
5.375
3.764
5.018
CG
CG
CB
OE1
OE2
O
O
OE2
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
GLU G:41 G:40 170.0 0.895 S -97.6 -45.1 115.0 0.605 0.29 C:P84051:0.205
H:P02283:0.089
DG
DA
DC
DA
DG
DA
DG
5.676
3.901
6.071
7.377
8.032
9.016
7.516
O
O
OE2
CG
CB
OE1
OE2
O3'
OP1
OP1
C5'
OP1
O3'
OP2
2nqb 4 P84051 92.45 1e-67 X-RAY
2007-09-11 GLU E:40 C:841 191.0 1.0 S -67.0 -33.0 124.0 0.653 0.347 F:P02283:0.089
I:P84051:0.258
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.631
7.047
8.308
9.474
8.312
5.873
3.965
7.121
5.683
CB
CB
CB
OE1
OE1
O
O
O
N
O3'
C5'
OP1
O3'
OP2
O3'
OP1
OP2
O
GLU I:40 G:1041 194.0 1.0 S -63.3 -31.5 135.0 0.711 0.289 J:P02283:0.116
E:P84051:0.2
DA
DT
DA
DT
DG
DG
DT
DA
HOH
5.763
4.300
6.940
8.890
6.626
8.200
9.449
7.721
5.804
O
O
O
CB
CB
CB
OE1
OE1
N
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP2
O
4qlc 5 P84051 92.45 1e-67 X-RAY
2015-07-22 GLU E:40 C:40 194.0 1.0 S -58.7 -38.7 134.0 0.705 0.295 I:P84051:0.184
F:P02283:0.132
DT
DA
DG
DA
DG
DG
DA
DC
8.296
6.174
6.653
9.758
7.952
5.420
3.617
6.649
CB
CB
CB
OE2
OE2
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
C5'
OP2
GLU I:40 G:40 200.0 1.0 S -70.8 -29.2 147.0 0.774 0.226 J:P02283:0.153
E:P84051:0.126
DT
DA
DG
DG
DG
DA
DA
DC
DC
5.124
3.732
6.315
6.855
4.477
7.106
9.345
7.440
9.659
O
O
O
OE2
OE2
CB
OE1
OE1
OE1
O3'
C5'
OP2
O3'
C5'
OP1
O3'
OP2
OP2
7pj1 1 P84051 92.45 1e-67 NMR
2021-12-08 GLU A:40 A:40 141.0 0.742 S -98.4 -38.9 99.0 0.521 0.221 B:P02283:0.221
2pyo 5 P84051 92.45 1e-67 X-RAY
2007-11-06 GLU E:40 C:40 192.0 1.0 S -67.4 -42.5 142.0 0.747 0.253 I:P84051:0.163
F:P02283:0.1
DT
DG
DG
DT
DA
DA
DT
DA
HOH
9.423
7.067
8.415
8.953
7.808
5.891
4.016
7.153
2.488
CB
CB
CB
OE2
OE2
O
O
O
N
O3'
C5'
OP2
O3'
OP2
O3'
OP1
OP2
O
GLU I:40 G:40 184.0 0.968 S -55.2 -48.3 136.0 0.716 0.252 J:P02283:0.174
E:P84051:0.084
DA
DT
DA
DT
DT
DG
DG
DA
HOH
6.024
4.438
7.276
8.975
6.179
3.786
6.210
9.008
3.453
O
O
O
OE2
OE1
OE1
OE1
OE2
OE1
O3'
OP1
OP2
O3'
O3'
C5'
OP2
OP1
O
6k00 2 P04255,P09588 84.87 3e-67 X-RAY
2019-10-09 GLN C:129 D:156 120.0 0.667 S -68.2 137.7 101.0 0.561 0.106 A:Q19007:0.106
6k03 1 P04255,P09588 84.87 3e-67 X-RAY
2019-10-09 GLN A:129 D:156 22.0 0.122 S -99.4 118.9 22.0 0.122 0.0
6k09 2 P04255,P09588 84.87 3e-67 X-RAY
2019-10-09 GLN C:129 D:156 138.0 0.767 S -71.2 -36.5 138.0 0.767 0.0
5wcu 3 P84051 92.31 6e-66 X-RAY
2018-10-31 GLU C:27 C:41 187.0 0.984 S -67.9 -44.9 141.0 0.742 0.242 D:P02283:0.174
G:P84051:0.068
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
8.473
5.535
3.817
6.577
9.999
7.607
9.888
5.327
3.330
6.020
OE1
OE1
OE2
OE2
OE1
OE1
OE1
O
O
O
N2
O3'
C5'
OP2
O3'
OP1
OP2
O3'
C5'
OP2
GLU G:27 G:41 188.0 0.989 S -67.9 -45.3 144.0 0.758 0.231 C:P84051:0.063
H:P02283:0.168
DT
DA
DG
DG
DG
DG
DA
DC
DC
5.740
3.823
6.504
8.580
5.277
3.857
7.355
7.963
9.394
O
O
O
OE2
OE2
OE1
OE1
OE2
OE2
O3'
C5'
OP1
O3'
O3'
C5'
OP2
OP1
OP2
GLU M:27 M:41 186.0 0.979 S -68.1 -44.8 NA NA NA
GLU Q:27 Q:41 186.0 0.979 S -67.9 -44.9 NA NA NA
4x23 5 P84051 92.16 1e-64 X-RAY
2014-12-10 GLU E:26 C:40 194.0 1.0 S -75.2 -47.9 122.0 0.642 0.358 F:P02283:0.121
I:P84051:0.258
DT
DA
DG
DA
DG
DG
DA
DC
9.179
6.511
8.233
8.764
7.093
5.146
3.694
6.127
CB
CB
CB
OE2
OE2
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLU I:26 G:40 182.0 0.958 S -76.3 -44.6 94.0 0.495 0.463 E:P84051:0.242
J:P02283:0.221
DT
DA
DG
DG
DG
DA
DC
5.241
3.442
5.875
8.936
5.997
6.791
9.546
O
O
O
CG
CG
OE1
CB
O3'
C5'
OP2
O3'
C5'
OP1
OP1
GLU Q:26 M:40 179.0 0.942 S -76.3 -45.4 NA NA NA
GLU U:26 Q:40 173.0 0.911 S -75.8 -45.2 NA NA NA
6kbb 1 P20671 97.89 2e-62 X-RAY
2020-01-29 GLU A:31 C:41 122.0 0.642 S -84.2 130.0 13.0 0.068 0.574 B:Q16778:0.574
HOH
7.541
O
O
GLU D:31 A:41 133.0 0.7 S -84.1 133.5 NA NA NA
7on1 5 A0A6A5Q1K4 81.25 4e-62 EM
2021-07-07 GLN F:45 g:43 191.0 1.0 S -73.0 -38.9 152.0 0.844 0.156 G:A0A6A5PZQ7:0.111
H:A0A6A5Q1K4:0.1
DT
DA
DG
DG
DG
DA
DA
DC
6.643
4.688
7.618
7.963
6.542
7.985
9.032
6.928
O
O
O
CG
CG
CB
NE2
NE2
O3'
C5'
P
O3'
OP1
OP1
O3'
OP1
GLN H:45 c:43 194.0 1.0 S -75.4 -35.7 151.0 0.839 0.161 C:A0A6A5PZQ7:0.156
F:A0A6A5Q1K4:0.078
DG
DT
DA
DG
DA
DG
DG
DA
DC
9.416
7.528
5.437
8.040
9.713
7.555
5.636
3.964
7.590
NE2
NE2
NE2
OE1
NE2
NE2
O
O
O
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
4kud 3 P04912 81.25 5e-62 X-RAY
2013-08-07 GLN C:43 C:42 188.0 1.0 S -55.1 -28.5 148.0 0.822 0.178 G:P04912:0.056
D:P02293:0.167
DT
DT
DG
DG
DA
DT
DA
HOH
8.704
4.229
3.096
7.152
5.995
4.516
6.704
5.198
NE2
NE2
NE2
CD
O
O
O
N
O3'
O3'
OP1
OP1
O3'
O5'
OP2
O
GLN G:43 G:42 186.0 1.0 S -53.6 -46.3 139.0 0.772 0.228 H:P02293:0.189
C:P04912:0.072
DA
DT
DA
DT
DT
DG
DG
HOH
6.079
4.327
7.477
9.036
5.220
3.331
7.276
8.766
O
O
O
NE2
NE2
NE2
NE2
N
O3'
OP1
OP2
O3'
O3'
OP1
OP1
O
4wnn 1 P04911 81.25 5e-62 X-RAY
2015-10-21 GLN A:43 A:42 183.0 1.0 S -67.9 -35.7 149.0 0.828 0.172 B:P02293:0.189
HOH
2.850
N
O
GLN C:43 C:42 186.0 1.0 S -65.6 -35.3 NA NA NA
GLN E:43 E:42 165.0 0.917 S -67.1 -37.0 NA NA NA
GLN G:43 G:42 169.0 0.939 S -72.8 -31.5 NA NA NA
6gej 4 P04911 81.25 5e-62 EM
2018-10-17 GLN F:43 E:42 195.0 1.0 S -80.4 -41.3 105.0 0.583 0.417 G:P04911:0.417
H:P02293:0.133
DT
DA
DG
DG
DT
DG
DA
DC
9.251
7.122
8.131
9.550
7.835
5.705
3.922
6.574
CB
CB
CB
NE2
NE2
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
C5'
OP2
GLN G:43 F:42 194.0 1.0 S -80.5 -41.3 111.0 0.617 0.383 I:P02293:0.133
F:P04911:0.389
DA
DG
DT
DG
DG
DG
DA
DC
6.493
4.360
6.656
9.102
6.814
8.017
8.996
7.319
O
O
O
CB
CB
CB
NE2
NE2
O3'
C5'
OP2
O3'
C5'
OP1
O3'
OP1
6gen 4 P04911 81.25 5e-62 EM
2018-10-17 GLN F:43 E:42 196.0 1.0 S -86.2 -45.0 105.0 0.583 0.417 G:P04911:0.422
H:P02293:0.122
DT
DA
DG
DG
DT
DG
DA
DC
9.338
7.199
8.155
9.241
7.560
5.852
3.972
6.803
CB
CB
CB
NE2
NE2
O
O
O
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
GLN G:43 F:42 191.0 1.0 S -86.2 -45.0 112.0 0.622 0.378 F:P04911:0.361
I:P02293:0.144
DA
DG
DT
DG
DG
DG
DA
DC
6.304
4.117
6.673
8.892
6.687
7.923
8.887
7.182
O
O
O
CB
CB
CB
NE2
NE2
O3'
C5'
OP2
O3'
C5'
OP1
O3'
OP1
7k78 3 P04911 81.25 5e-62 EM
2021-03-31 GLN C:43 C:43 190.0 1.0 S -64.4 -39.7 151.0 0.839 0.161 G:P04911:0.083
D:P02293:0.128
DT
DT
DT
DA
DA
DA
DA
DT
8.700
5.735
4.862
8.000
9.383
5.776
4.059
6.934
OE1
OE1
OE1
CB
NE2
O
O
O
O3'
O3'
OP1
OP1
OP1
O3'
OP1
OP2
GLN G:43 G:43 188.0 1.0 S -65.3 -38.1 144.0 0.8 0.2 H:P02293:0.167
C:P04911:0.078
DG
DA
DA
DG
DG
DA
DA
DT
6.164
4.597
6.723
9.040
4.995
3.344
7.752
9.738
O
O
O
OE1
OE1
OE1
OE1
CG
O3'
OP1
OP1
O3'
O3'
OP1
OP1
OP1
7k7g 3 P04911 81.25 5e-62 EM
2021-03-31 GLN C:43 C:43 184.0 1.0 S -72.1 -47.7 144.0 0.8 0.2 G:P04911:0.067
D:P02293:0.156
DG
DT
DA
DG
DG
DA
DC
9.337
6.534
4.252
6.367
6.206
4.735
6.995
OE1
OE1
OE1
OE1
O
O
O
N2
O3'
OP1
OP2
O3'
OP1
OP2
GLN G:43 G:43 191.0 1.0 S -72.4 -45.2 125.0 0.694 0.306 H:P02293:0.106
C:P04911:0.261
DG
DA
DA
DG
DA
DA
DA
DC
6.066
4.280
7.904
8.397
7.049
7.902
9.313
7.539
O
O
O
CG
CB
CB
NE2
NE2
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
4jjn 3 P04912 81.25 5e-62 X-RAY
2013-05-15 GLN C:42 C:42 188.0 1.0 S -59.1 -48.4 144.0 0.8 0.2 D:P02294:0.183
G:P04912:0.061
DT
DA
DG
DG
DG
DG
DA
DC
DC
5.680
4.208
6.836
9.428
5.866
3.940
7.184
8.084
9.902
O
O
O
NE2
NE2
NE2
OE1
NE2
NE2
O3'
OP1
OP2
O3'
O3'
OP1
OP2
OP1
OP2
GLN G:42 G:42 196.0 1.0 S -56.3 -60.2 153.0 0.85 0.15 H:P02294:0.178
C:P04912:0.061
DG
DT
DA
DG
DA
DG
DT
DG
DA
DC
9.187
6.392
4.321
7.381
9.942
7.755
9.618
5.916
4.266
6.805
NE2
NE2
NE2
CB
NE2
NE2
NE2
O
O
O
O3'
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP2
1id3 4 P04911 81.25 5e-62 X-RAY
2001-09-28 GLN E:42 C:42 197.0 1.0 S -62.5 -52.1 147.0 0.817 0.183 F:P02294:0.2
I:P04911:0.083
DT
DT
DG
DG
DA
DT
DA
HOH
9.169
4.682
3.279
7.056
6.304
4.889
7.736
5.277
OE1
OE1
OE1
OE1
O
O
O
CG
O3'
O3'
C5'
OP1
O3'
OP1
OP2
O
GLN I:42 G:42 178.0 0.989 S -59.4 -51.2 140.0 0.778 0.211 J:P02294:0.167
E:P04911:0.05
DA
DT
DA
DT
DT
DG
DG
DA
HOH
6.019
4.123
7.893
8.481
5.825
3.831
7.459
9.328
7.469
O
O
O
NE2
NE2
NE2
CB
CG
O
O3'
OP1
OP2
O3'
O3'
OP1
OP1
OP1
O
5bt1 2 P04911 81.25 7e-62 X-RAY
2016-10-26 GLN C:54 C:42 170.0 0.944 S -55.3 -40.5 147.0 0.817 0.127 D:P02293:0.128
6qld 19 P04911 84.76 3e-61 EM
2019-10-02 GLN T:27 g:43 188.0 1.0 S -79.8 -50.8 151.0 0.839 0.161 U:P02293:0.206
DC
DT
DA
DG
DG
DG
DG
DA
9.848
4.890
3.030
8.174
8.061
3.984
3.500
8.850
O
O
O
O
NE2
NE2
OE1
OE1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
P
5vey 1 P06899,P04908 96.81 6e-61 NMR
2017-05-17 GLU A:130 A:130 150.0 0.789 S -66.3 -38.7 150.0 0.789 0.0
6k01 1 Q6AZJ8 97.83 1e-60 X-RAY
2019-10-09 GLU A:28 C:42 170.0 0.895 S -71.5 -58.5 126.0 0.663 0.232 B:P02281:0.232
2xql 1 P02263 98.9 3e-60 EM
2010-11-03 GLU A:27 A:41 196.0 1.0 S -82.0 -51.3 160.0 0.842 0.158 B:P0C1H4:0.189
GLU C:27 C:41 194.0 1.0 S -82.0 -51.3 159.0 0.837 0.163 D:P0C1H4:0.184
GLU E:27 E:41 194.0 1.0 S -82.0 -51.3 158.0 0.832 0.168 F:P0C1H4:0.189
GLU G:27 G:41 193.0 1.0 S -82.0 -51.3 156.0 0.821 0.179 H:P0C1H4:0.195
GLU I:27 I:41 194.0 1.0 S -82.0 -51.3 158.0 0.832 0.168 J:P0C1H4:0.189
6w4l 1 P02281,P06897 97.83 2e-59 X-RAY
2020-05-06 GLU A:123 A:1042 144.0 0.758 S -61.3 -39.5 144.0 0.758 0.0 HOH
4.795
O
O
6qld 21 P04911 84.31 8e-59 EM
2019-10-02 GLN V:27 i:43 188.0 1.0 S -99.5 -58.0 132.0 0.733 0.267 T:P04911:0.167
Q:P02294:0.15
DT
DA
DG
DG
DG
DA
DC
7.323
5.603
7.772
9.098
4.793
3.143
7.676
OE1
OE1
OE1
NE2
O
O
O
O3'
C5'
OP1
OP2
O3'
OP1
OP2
4kha 2 Q6AZJ8 96.67 2e-58 X-RAY
2013-05-29 GLU B:31 B:41 207.0 1.0 S -63.9 -39.1 180.0 0.947 0.053 A:G0SDN1+P02281:0.142
HOH
4.380
O
O
7dlx 1 B3LG63,B3LG62 83.51 2e-56 X-RAY
2021-06-16 GLN A:138 A:172 157.0 0.872 S -82.1 -43.3 157.0 0.872 0.0 HOH
4.371
O
O
GLN B:138 B:172 147.0 0.817 S -77.0 -40.3 NA NA NA
GLN C:138 C:172 163.0 0.906 S -76.2 -47.8 NA NA NA
GLN D:138 D:172 134.0 0.744 S -77.6 -26.7 NA NA NA
GLN E:138 E:172 151.0 0.839 S -63.6 -41.8 NA NA NA
GLN F:138 F:172 151.0 0.839 S -65.9 -53.6 NA NA NA
GLN G:138 G:172 157.0 0.872 S -58.7 -64.5 NA NA NA
GLN H:138 H:172 149.0 0.828 S -62.3 -65.0 NA NA NA
7bp2 1 Q9LD28 81.52 4e-51 X-RAY
2020-11-11 GLU A:30 A:41 190.0 1.0 S -62.6 -40.0 166.0 0.874 0.126 B:Q9LQQ4:0.126
HOH
2.750
OE1
O
GLU C:30 C:41 191.0 1.0 S -54.6 -50.2 NA NA NA
7bp4 1 Q9LD28 81.52 4e-51 X-RAY
2020-11-11 GLU A:30 G:43 159.0 0.837 S -86.7 -27.7 81.0 0.426 0.411 B:Q9LQQ4:0.411
HOH
4.350
O
O
GLU D:30 A:43 198.0 1.0 S -81.3 -32.7 NA NA NA
7bp5 1 Q9LD28 81.52 4e-51 X-RAY
2020-11-11 GLU A:30 A:43 182.0 0.958 S -60.1 -47.2 158.0 0.832 0.126 B:Q9LQQ4:0.126
HOH
2.666
OE1
O
7bp6 1 Q9LD28 81.52 4e-51 X-RAY
2020-11-11 GLU A:30 C:43 170.0 0.895 S -66.0 -39.6 140.0 0.737 0.158 B:Q9LQQ4:0.158
HOH
2.543
OE1
O
7c7x 1 Q9LD28 81.52 4e-51 X-RAY
2020-11-11 GLU A:30 C:41 172.0 0.905 S -79.9 -12.9 169.0 0.889 0.016 B:Q9LQQ4:0.016
GOL
HOH
6.801
5.041
N
OE1
O3
O
GLU E:30 A:41 175.0 0.921 S -86.0 -26.5 167.0 0.879 0.042 C:Q9CA59:0.016
F:Q9LQQ4:0.032
HOH
6.247
O
O
6m2m 1 O81826 80.43 9e-51 X-RAY
2020-10-21 GLU A:30 E:43 176.0 0.926 S -70.8 -58.7 108.0 0.568 0.358 I:Q9LQQ4:0.353
H:Q9LQQ4:0.011
GLU B:30 A:43 176.0 0.926 S -73.2 -47.4 101.0 0.532 0.394 K:Q9LQQ4:0.347
L:Q9LQQ4:0.042
M:Q2R2Z3:0.011
GLU C:30 C:43 174.0 0.916 S -69.3 -46.9 108.0 0.568 0.348 D:Q9LQQ4:0.332
J:Q9LQQ4:0.037
GLU E:30 G:43 177.0 0.932 S -89.5 -28.3 67.0 0.353 0.579 J:Q9LQQ4:0.279
H:Q9LQQ4:0.374
HOH
4.617
OE2
O
GLU F:30 I:43 192.0 1.0 S -93.1 -31.4 80.0 0.421 0.579 L:Q9LQQ4:0.389
H:Q9LQQ4:0.279
GLU G:30 K:43 169.0 0.889 S -91.0 -23.3 54.0 0.284 0.605 J:Q9LQQ4:0.405
L:Q9LQQ4:0.268

AlphaFold DB

Entity Residue Monomer View
ID Entity Uniprot Identity Evalue Name Label Auth ASA rASA SS φ ψ
af-p0c0s8-f1 1 P0C0S8 100.0 3e-90 GLU A:42 A:42 196.0 1.0 S -58.9 -36.7
af-p20671-f1 1 P20671 99.23 5e-90 GLU A:42 A:42 197.0 1.0 S -61.1 -35.8
af-q6fi13-f1 1 Q6FI13 98.46 1e-89 GLU A:42 A:42 198.0 1.0 S -59.2 -36.6
af-p04908-f1 1 P04908 98.46 1e-89 GLU A:42 A:42 195.0 1.0 S -61.3 -33.9
af-q93077-f1 1 Q93077 98.46 2e-89 GLU A:42 A:42 198.0 1.0 S -58.9 -36.0
af-q7l7l0-f1 1 Q7L7L0 97.69 5e-89 GLU A:42 A:42 196.0 1.0 S -61.8 -34.5
af-q96kk5-f1 1 Q96KK5 100.0 7e-89 GLU A:42 A:42 196.0 1.0 S -59.0 -35.6
af-q99878-f1 1 Q99878 99.22 3e-88 GLU A:42 A:42 199.0 1.0 S -58.4 -36.5
af-q16777-f1 1 Q16777 96.92 5e-86 GLU A:42 A:42 200.0 1.0 S -59.3 -36.4
af-q8iue6-f1 1 Q8IUE6 94.62 1e-84 GLU A:42 A:42 200.0 1.0 S -59.0 -36.8
af-q96qv6-f1 1 Q96QV6 93.13 2e-84 GLU A:42 A:42 194.0 1.0 S -58.6 -37.1
af-q9btm1-f1 1 Q9BTM1 97.58 4e-84 GLU A:42 A:42 200.0 1.0 S -58.8 -35.8
af-p16104-f1 1 P16104 95.12 4e-80 GLU A:42 A:42 184.0 0.968 S -59.6 -38.7