Variant

Genome Chromosome Position VCF ID Ref Alt mRNA Change mRNA Info
GRCh37 chr6 27839952 . C A CCDS4636.1:NM_003533.2:c.142Gcc>Tcc_NP_003524.1:p.48A>S Homo sapiens histone cluster 1 H3 family member i (HIST1H3I), 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)
1u35 2 P68433 100.0 8e-97 X-RAY
 2005-09-27 ALA C:48 A:447 45.0 0.391 H -58.4 -46.8 8.0 0.07 0.321 D:Q5T006:0.322
 DG
DT
DG
DA
DA
DC
HOH
 8.938
9.098
8.011
4.932
3.086
7.655
8.233
 N
O
CB
CB
N
N
CB
 OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:48 E:647 43.0 0.374 H -56.6 -53.0 7.0 0.061 0.313 H:Q5T006:0.313
 DT
DG
DA
DA
DC
DC
DT
DG
HOH
 8.859
8.209
4.899
3.108
8.068
9.960
9.723
8.978
7.232
 O
CB
N
N
N
CB
N
N
O
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
2cv5 2 P68431 100.0 8e-97 X-RAY
 2005-06-28 ALA C:48 A:47 51.0 0.443 H -65.6 -41.4 9.0 0.078 0.365 D:P62805:0.365
 DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.633
8.767
9.960
9.234
7.988
4.817
3.107
7.987
3.449
 N
N
N
O
CB
CB
N
N
CA
 O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA G:48 E:47 48.0 0.417 H -58.5 -41.6 12.0 0.104 0.313 H:P62805:0.313
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.832
9.592
8.066
4.628
2.931
7.647
9.703
9.815
8.849
5.643
 N
O
CB
CB
N
N
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5c3i 2 P68431 100.0 8e-97 X-RAY
 2015-07-29 ALA B:48 NA:NA DO NA DO DO DO NA NA NA
ALA F:48 F:47 146.0 1.0 360.0 123.3 NA NA NA
ALA J:48 NA:NA DO NA DO DO DO NA NA NA
ALA N:48 NA:NA DO NA DO DO DO NA NA NA
ALA R:48 NA:NA DO NA DO DO DO NA NA NA
ALA V:48 NA:NA DO NA DO DO DO NA NA NA
5xf3 1 P68431 100.0 8e-97 X-RAY
 2017-10-11 ALA A:48 A:47 51.0 0.443 H -42.5 -55.5 8.0 0.07 0.373 B:P62805:0.374
 DC
DG
DT
DG
DA
DA
DC
 9.908
8.806
8.998
8.209
4.962
3.323
7.917
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 51.0 0.443 H -56.3 -50.4 9.0 0.078 0.365 F:P62805:0.365
 DT
DG
DA
DA
DC
DC
DG
 9.427
8.134
4.734
2.953
7.942
9.602
8.861
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
5xf4 1 P68431 100.0 8e-97 X-RAY
 2017-10-11 ALA A:48 A:47 52.0 0.452 H -44.3 -58.1 9.0 0.078 0.374 B:P62805:0.374
 DC
DG
DT
DG
DA
DA
DC
 9.935
8.907
9.046
8.070
4.913
3.229
7.864
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 51.0 0.443 H -56.9 -50.9 9.0 0.078 0.365 F:P62805:0.365
 DT
DG
DA
DA
DC
DC
DG
 9.490
8.116
4.747
2.910
7.881
9.466
8.858
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
5xf5 1 P68431 100.0 8e-97 X-RAY
 2017-10-11 ALA A:48 A:47 50.0 0.435 H -53.6 -56.7 8.0 0.07 0.365 B:P62805:0.365
 DC
DG
DT
DG
DA
DA
DC
 9.593
8.668
9.273
8.217
4.933
3.231
8.038
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 50.0 0.435 H -52.1 -52.8 10.0 0.087 0.348 F:P62805:0.348
 DT
DG
DA
DA
DC
DC
DG
 9.263
8.292
4.800
3.091
7.807
9.758
8.873
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6hts 5 P68431 100.0 8e-97 EM
 2018-11-07 ALA I:48 I:47 58.0 0.504 H -48.7 -48.2 58.0 0.504 0.0 DG
DT
DG
DT
DG
 9.295
7.910
7.815
5.822
4.787
 N
N
CB
CB
CB
 O3'
OP1
O3'
OP1
OP2
ALA M:48 M:47 49.0 0.426 H -64.9 -48.7 11.0 0.096 0.33 N:P62805:0.33
 DG
DC
DC
DG
DC
 9.217
8.169
5.064
2.937
8.262
 CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
6l9z 1 P68431 100.0 8e-97 X-RAY
 2021-02-17 ALA A:48 A:47 48.0 0.417 H -53.3 -49.8 8.0 0.07 0.347 B:P62805:0.348
 DC
DG
DA
DT
DC
DG
DT
DG
HOH
 9.503
9.692
8.847
9.518
8.132
4.780
2.954
7.756
8.040
 CB
N
N
N
CB
N
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:48 E:47 53.0 0.461 H -49.6 -56.5 12.0 0.104 0.357 F:P62805:0.357
 DT
DC
DC
DG
DC
DG
DG
DT
HOH
 9.127
8.035
4.680
2.951
7.736
9.516
9.685
8.938
8.017
 O
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
ALA K:48 K:47 53.0 0.461 H -50.2 -55.9 11.0 0.096 0.365 L:P62805:0.365
 DA
DC
DC
DG
DC
DG
DT
DT
CA
HOH
 9.781
8.109
4.809
3.003
8.022
9.517
9.216
8.764
9.493
7.734
 O
CB
N
N
N
CB
C
N
C
CB
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
CA
O
ALA O:48 O:47 52.0 0.452 H -57.0 -56.6 11.0 0.096 0.356 P:P62805:0.357
 DC
DG
DA
DT
DC
DG
DT
DG
HOH
 9.292
9.619
8.705
9.222
8.111
4.815
2.976
7.880
5.951
 CB
N
N
O
CB
N
N
N
C
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
6la2 1 P68431 100.0 8e-97 X-RAY
 2021-02-17 ALA A:48 e:47 49.0 0.426 H -43.3 -62.7 6.0 0.052 0.374 B:P62805:0.374
 DA
DC
DC
DG
DC
DG
DT
 8.712
8.102
4.730
2.546
7.874
8.788
9.143
 N
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA E:48 i:47 46.0 0.4 H -43.1 -62.9 7.0 0.061 0.339 F:P62805:0.339
 DC
DA
DT
DC
DG
DT
DG
 9.036
8.995
8.897
8.305
5.005
3.347
7.854
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA K:48 A:47 48.0 0.417 H -43.4 -62.7 7.0 0.061 0.356 L:P62805:0.357
 DT
DC
DC
DG
DC
DG
DT
 9.112
8.086
4.856
2.845
8.017
9.014
9.543
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA O:48 E:47 46.0 0.4 H -43.3 -62.6 7.0 0.061 0.339 P:P62805:0.339
 DC
DG
DA
DT
DC
DG
DT
DG
 9.250
9.940
8.976
9.081
8.239
4.908
3.158
7.931
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA U:48 K:47 48.0 0.417 H -43.7 -62.5 7.0 0.061 0.356 V:P62805:0.357
 DA
DC
DC
DG
DC
DG
DT
DT
 9.023
8.280
4.765
3.082
7.611
8.767
9.979
9.217
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA Y:48 O:47 45.0 0.391 H -43.1 -63.0 8.0 0.07 0.321 Z:P62805:0.322
 DC
DA
DT
DC
DG
DT
DG
 8.951
9.127
9.069
7.939
4.835
3.167
8.467
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA EA:48 U:47 48.0 0.417 H -43.6 -62.3 6.0 0.052 0.365 FA:P62805:0.365
 DA
DT
DC
DC
DG
DC
DG
DG
DT
 9.787
9.007
8.092
4.911
3.378
7.957
8.948
9.691
9.328
 N
O
CB
N
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA IA:48 Y:47 47.0 0.409 H -43.1 -63.0 5.0 0.043 0.366 JA:P62805:0.365
 DC
DA
DT
DC
DG
DT
DG
 9.032
9.221
8.991
8.080
4.904
3.096
8.675
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
6la8 1 P68431 100.0 8e-97 X-RAY
 2020-10-07 ALA A:48 A:47 51.0 0.443 H -37.3 -57.4 8.0 0.07 0.373 B:P62805:0.374
 DC
DG
DA
DT
DC
DG
DT
DG
 9.260
9.824
9.153
9.160
8.171
5.119
3.009
7.740
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 50.0 0.435 H -37.4 -57.1 7.0 0.061 0.374 F:P62805:0.374
 DT
DC
DC
DG
DC
DG
DT
 9.146
8.187
4.838
2.895
7.824
9.195
9.164
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA K:48 K:47 52.0 0.452 H -37.3 -57.4 8.0 0.07 0.382 L:P62805:0.383
 DC
DA
DT
DC
DG
DT
DG
 9.245
9.196
9.139
8.202
5.121
3.094
7.502
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA O:48 O:47 49.0 0.426 H -37.0 -57.7 7.0 0.061 0.365 P:P62805:0.365
 DT
DC
DC
DG
DC
DG
DT
 8.980
8.029
4.930
3.116
7.790
9.231
9.165
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6la9 1 P68431 100.0 8e-97 X-RAY
 2020-10-07 ALA A:48 A:47 45.0 0.391 H -40.2 -58.1 10.0 0.087 0.304 B:P62805:0.304
 DC
DG
DA
DT
DC
DG
DT
DG
 8.904
9.841
8.738
9.587
7.969
4.847
3.164
8.449
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 47.0 0.409 H -40.2 -57.9 8.0 0.07 0.339 F:P62805:0.339
 DT
DC
DC
DG
DC
DG
DG
DT
 9.370
8.117
5.014
3.178
7.886
8.958
9.640
8.982
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
ALA K:48 K:47 49.0 0.426 H -39.6 -57.9 7.0 0.061 0.365 L:P62805:0.365
 DC
DG
DA
DT
DC
DG
DT
DG
 9.058
9.514
8.656
9.927
8.190
4.941
3.116
7.670
 CB
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA O:48 O:47 45.0 0.391 H -39.3 -59.1 10.0 0.087 0.304 P:P62805:0.304
 DT
DC
DC
DG
DC
DG
DG
DT
 9.255
7.938
4.773
2.864
7.711
8.798
9.961
8.903
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
6lab 1 P68431 100.0 8e-97 X-RAY
 2021-02-17 ALA A:48 A:47 45.0 0.391 H -50.2 -58.3 8.0 0.07 0.321 B:P62805:0.322
 DC
DT
DG
DA
DA
DC
DG
DT
DG
 9.945
9.298
6.928
9.377
9.008
8.526
5.309
3.780
7.712
 CB
C
C
N
O
CB
N
N
N
 C5'
O3'
OP1
OP1
OP1
O3'
O3'
OP2
OP2
ALA E:48 E:47 50.0 0.435 H -67.2 -36.9 9.0 0.078 0.357 F:P62805:0.357
 DT
DC
DG
DT
DG
DC
DG
 9.389
8.232
5.015
3.248
8.018
9.531
8.886
 N
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA K:48 K:47 45.0 0.391 H -40.0 -57.8 8.0 0.07 0.321 L:P62805:0.322
 DC
DT
DG
DA
DA
DC
DG
DT
DG
 9.084
9.332
8.018
9.182
9.101
8.372
5.051
3.427
7.930
 CB
C
C
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA O:48 O:47 51.0 0.443 H -49.4 -45.6 10.0 0.087 0.356 P:P62805:0.357
 DT
DC
DG
DT
DG
DC
DG
 9.400
8.034
4.816
3.300
7.840
8.926
9.066
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6ler 1 P68431 100.0 8e-97 X-RAY
 2021-03-03 ALA A:48 K:47 47.0 0.409 H -44.6 -56.7 NA NA NA
ALA E:48 O:47 50.0 0.435 H -54.6 -58.4 NA NA NA
ALA K:48 A:47 47.0 0.409 H -45.9 -53.0 9.0 0.078 0.331 L:P62805:0.33
 DC
DG
DT
DC
DG
DT
DG
HOH
 8.929
9.599
8.030
8.396
4.947
2.739
7.878
7.871
 N
N
O
CB
N
N
N
CB
 OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA O:48 E:47 42.0 0.365 H -46.2 -58.7 6.0 0.052 0.313 P:P62805:0.313
 DA
DT
DC
DC
DG
DC
DG
DT
DG
 9.896
8.937
8.166
4.862
3.053
7.838
9.055
9.853
8.867
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
6m3v 1 P68431 100.0 8e-97 X-RAY
 2020-10-07 ALA A:48 A:47 41.0 0.357 H -26.2 -59.7 5.0 0.043 0.314 B:P62805:0.313
 DT
DC
DC
DG
DC
DG
DA
 9.458
7.959
4.798
2.904
7.608
9.448
9.476
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA E:48 E:47 45.0 0.391 H -26.1 -59.9 5.0 0.043 0.348 F:P62805:0.348
 DC
DA
DT
DC
DG
DT
DG
 9.743
9.551
8.808
8.180
5.055
3.565
8.765
 CB
N
O
CB
N
N
N
 O5'
OP1
OP1
O3'
O3'
OP1
OP2
ALA K:48 K:47 44.0 0.383 H -25.3 -60.3 4.0 0.035 0.348 L:P62805:0.348
 DA
DG
DC
DG
DT
DG
 9.174
8.511
8.117
4.897
3.090
7.868
 N
N
CB
N
N
N
 OP2
OP1
O3'
O3'
OP1
OP2
ALA O:48 O:47 43.0 0.374 H -26.3 -59.9 5.0 0.043 0.331 P:P62805:0.33
 DT
DC
DC
DG
DC
DT
 8.945
8.237
5.114
3.459
8.023
9.418
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6m44 1 P68431 100.0 8e-97 X-RAY
 2020-10-07 ALA A:48 A:47 41.0 0.357 H -42.0 -60.1 6.0 0.052 0.305 B:P62805:0.304
 DT
DC
DC
DG
DC
DG
DG
DA
 9.182
8.285
4.898
3.421
7.869
9.603
9.704
9.208
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA E:48 E:47 46.0 0.4 H -42.6 -59.6 7.0 0.061 0.339 F:P62805:0.339
 DC
DA
DT
DC
DG
DT
DG
 8.747
9.162
8.801
8.121
5.213
3.198
7.949
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA K:48 K:47 45.0 0.391 H -42.6 -59.6 6.0 0.052 0.339 L:P62805:0.339
 DC
DA
DG
DC
DG
DT
DG
 9.728
9.043
9.083
8.178
4.768
3.011
7.827
 CB
N
N
CB
N
N
N
 C5'
OP1
OP1
O3'
O3'
OP1
OP2
ALA O:48 O:47 42.0 0.365 H -42.2 -60.0 4.0 0.035 0.33 P:P62805:0.33
 DA
DT
DC
DC
DG
DC
DG
DG
DT
 9.890
8.560
8.389
5.195
3.212
7.611
9.244
9.921
8.845
 N
O
CB
N
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
6m4d 1 P68431 100.0 8e-97 EM
 2020-09-23 ALA A:48 NA:NA DO NA DO DO DO NA NA NA
ALA E:48 NA:NA DO NA DO DO DO NA NA NA
6m4g 3 P68431 100.0 8e-97 EM
 2020-09-23 ALA C:48 NA:NA DO NA DO DO DO NA NA NA
ALA F:48 NA:NA DO NA DO DO DO NA NA NA
6m4h 3 P68431 100.0 8e-97 EM
 2020-09-23 ALA C:48 NA:NA DO NA DO DO DO NA NA NA
ALA G:48 NA:NA DO NA DO DO DO NA NA NA
6upk 1 P68431 100.0 8e-97 EM
 2019-12-11 ALA A:48 NA:NA DO NA DO DO DO NA NA NA
ALA E:48 E:47 37.0 0.322 H -69.5 -27.5 9.0 0.078 0.244 F:P62805:0.243
 DC
DC
DG
DC
DG
 8.648
6.227
5.889
9.990
9.537
 CB
CB
N
N
CB
 O3'
OP1
OP1
OP2
OP1
6upl 1 P68431 100.0 8e-97 EM
 2019-12-11 ALA A:48 A:47 44.0 0.383 H -68.2 -31.7 7.0 0.061 0.322 B:P62805:0.322
 DG
DT
DG
 6.896
5.466
9.413
 CB
N
N
 O3'
OP1
OP1
ALA E:48 E:47 40.0 0.348 H -70.5 -28.7 22.0 0.191 0.157 F:P62805:0.157
 DC
DC
DG
DC
 8.763
4.695
3.466
8.878
 CB
CB
N
N
 O3'
O3'
OP1
OP2
6v92 23 P68431 100.0 8e-97 EM
 2020-01-15 ALA BA:48 a:47 51.0 0.443 H -65.7 -41.3 10.0 0.087 0.356 CA:P62805:0.357
 DT
DT
DT
DC
DG
DA
DA
DC
 9.633
8.767
9.961
9.234
7.988
4.817
3.107
7.987
 N
N
N
O
CB
CB
N
N
 O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA FA:48 e:47 47.0 0.409 H -58.5 -41.6 11.0 0.096 0.313 GA:P62805:0.313
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.832
9.592
8.066
4.628
2.931
7.647
9.703
9.815
8.848
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
7dbp 2 P68431 100.0 8e-97 EM
 2020-12-23 ALA B:48 A:47 51.0 0.443 H -64.1 -47.0 15.0 0.13 0.313 C:P62805:0.313
 DT
DC
DA
DG
DT
DG
DC
 9.793
9.260
9.502
9.342
5.916
4.237
8.652
 N
N
N
CB
CB
N
N
 C5'
OP1
OP1
O3'
O3'
OP1
OP2
ALA F:48 E:47 49.0 0.426 H -64.1 -46.9 28.0 0.243 0.183 G:P62805:0.183
 DA
DC
DC
DC
DG
DC
DC
 8.953
9.627
5.737
4.222
8.418
9.587
8.408
 N
CB
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
C5'
OP1
7k5x 1 P68431 100.0 8e-97 EM
 2020-11-25 ALA A:48 A:47 46.0 0.4 H -61.4 -35.1 8.0 0.07 0.33 B:P62805:0.33
 DT
DC
DC
DG
DC
DG
DC
 9.395
8.310
5.490
3.341
8.075
9.843
8.949
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA E:48 E:47 50.0 0.435 H -61.1 -45.6 11.0 0.096 0.339 F:P62805:0.339
 DC
DC
DT
DC
DG
DT
DG
 9.631
8.789
9.269
8.227
4.849
3.091
7.671
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
7k5y 1 P68431 100.0 8e-97 EM
 2020-11-25 ALA A:48 A:47 51.0 0.443 H -61.2 -45.9 11.0 0.096 0.347 B:P62805:0.348
 DT
DC
DC
DG
DC
DG
DT
DC
 9.045
8.011
5.237
3.042
7.952
9.375
9.740
8.824
 N
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
ALA E:48 E:47 51.0 0.443 H -62.3 -46.4 11.0 0.096 0.347 F:P62805:0.348
 DC
DC
DC
DT
DC
DG
DT
DG
 9.457
9.978
8.739
9.484
8.078
4.907
3.088
7.844
 CB
N
N
N
CB
CB
N
N
 OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
7k60 1 P68431 100.0 8e-97 EM
 2020-11-25 ALA A:48 A:47 48.0 0.417 H -61.3 -46.3 11.0 0.096 0.321 B:P62805:0.322
 DT
DC
DC
DG
DC
DG
DC
 9.224
8.155
5.189
3.232
7.749
9.680
8.917
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA E:48 E:47 52.0 0.452 H -61.6 -40.5 11.0 0.096 0.356 F:P62805:0.357
 DC
DC
DC
DT
DC
DG
DT
DG
 9.505
9.945
8.581
9.335
8.490
5.091
3.318
7.779
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
7k61 1 P68431 100.0 8e-97 EM
 2020-11-25 ALA A:48 A:47 51.0 0.443 H -62.6 -49.9 12.0 0.104 0.339 B:P62805:0.339
 DT
DC
DC
DG
DC
DG
DT
DC
 9.283
7.932
5.154
3.024
7.677
9.031
9.777
8.530
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA E:48 E:47 47.0 0.409 H -62.8 -42.8 10.0 0.087 0.322 F:P62805:0.322
 DC
DC
DC
DT
DC
DG
DT
DG
 9.158
9.627
8.431
9.320
7.966
4.919
2.947
7.579
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
7k63 1 P68431 100.0 8e-97 EM
 2020-11-25 ALA A:48 A:47 49.0 0.426 H -61.7 -41.5 11.0 0.096 0.33 B:P62805:0.33
 DT
DC
DC
DG
DC
DG
DT
DC
 9.304
7.944
4.881
2.840
7.502
9.733
9.974
8.585
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA E:48 E:47 50.0 0.435 H -62.8 -43.9 11.0 0.096 0.339 F:P62805:0.339
 DC
DC
DT
DC
DG
DT
DG
 9.160
8.541
8.849
8.077
4.792
2.920
7.742
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
7nl0 1 P68431 100.0 8e-97 EM
 2021-08-11 ALA A:48 A:47 44.0 0.383 H -61.7 -44.5 7.0 0.061 0.322 B:P62805:0.322
 DT
DT
DT
DT
DT
DT
DT
DA
 8.754
8.583
9.670
9.357
8.276
5.812
3.841
7.753
 CB
N
N
O
CB
CB
N
N
 OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 53.0 0.461 H -61.4 -45.6 10.0 0.087 0.374 F:P62805:0.374
 DA
DA
DG
DG
DC
 8.364
5.629
3.539
8.139
9.750
 CB
N
N
N
CB
 O3'
O3'
OP1
OP1
C5'
7v6q 2 P68431 100.0 8e-97 X-RAY
 2021-12-29 ALA B:48 B:47 47.0 0.409 H -69.6 -40.5 4.0 0.035 0.374 D:P49321:0.374
ALA F:48 F:47 46.0 0.4 H -70.0 -41.2 NA NA NA
7cow 3 P68431 100.0 9e-97 X-RAY
 2021-08-11 ALA C:50 A:47 45.0 0.391 H -51.4 -66.2 7.0 0.061 0.33 D:P62805:0.33
 DT
DC
DC
DG
DC
DG
DG
DA
 8.681
8.123
4.860
2.928
7.622
9.775
9.846
8.854
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA G:50 E:47 47.0 0.409 H -31.3 -63.2 9.0 0.078 0.331 H:P62805:0.33
 DC
DA
DT
DC
DG
DT
DG
 9.164
9.455
9.301
7.905
4.773
2.921
7.355
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA K:50 K:47 49.0 0.426 H -46.8 -60.1 8.0 0.07 0.356 L:P62805:0.357
 DC
DA
DA
DG
DC
DG
DT
DG
 9.287
9.707
9.489
9.181
8.443
5.035
3.010
7.893
 CB
N
N
N
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA O:50 O:47 48.0 0.417 H -40.3 -57.7 9.0 0.078 0.339 P:P62805:0.339
 DT
DC
DC
DG
DC
DG
DT
 9.487
8.083
4.906
2.910
7.428
9.492
8.863
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
3afa 1 P68431 100.0 1e-96 X-RAY
 2010-05-26 ALA A:51 A:47 51.0 0.443 H -63.0 -49.2 10.0 0.087 0.356 B:P62805:0.357
 DC
DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.850
9.875
8.717
9.865
9.181
7.997
4.593
2.906
7.897
7.983
 CB
N
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -58.7 -44.8 10.0 0.087 0.356 F:P62805:0.357
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.843
9.342
8.114
4.739
3.034
8.029
9.735
9.914
8.715
3.401
 N
O
CB
CB
N
N
CB
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
3azi 1 P68431 100.0 1e-96 X-RAY
 2011-09-21 ALA A:51 A:47 38.0 0.33 H -53.3 -57.2 5.0 0.043 0.287 B:P62805:0.287
 DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.626
8.887
9.959
8.552
8.544
4.903
3.223
7.567
9.376
 C
N
N
O
CB
CB
N
N
O
 OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 49.0 0.426 H -58.4 -45.6 10.0 0.087 0.339 F:P62805:0.339
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.733
9.420
8.015
4.476
3.086
7.548
9.833
9.871
8.930
8.479
 N
O
CB
CB
N
N
CB
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
3azj 1 P68431 100.0 1e-96 X-RAY
 2011-09-21 ALA A:51 A:47 45.0 0.391 H -43.4 -61.0 6.0 0.052 0.339 B:P62805:0.339
 DC
DT
DT
DC
DG
DA
DA
DC
 9.616
9.968
8.966
9.137
8.191
4.812
2.948
8.071
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 46.0 0.4 H -54.7 -49.3 8.0 0.07 0.33 F:P62805:0.33
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.807
9.276
8.230
4.849
2.968
8.166
9.673
9.766
8.712
 N
O
CB
N
N
N
CB
C
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
3azk 1 P68431 100.0 1e-96 X-RAY
 2011-09-21 ALA A:51 A:47 49.0 0.426 H -49.0 -48.8 8.0 0.07 0.356 B:P62805:0.357
 DC
DT
DC
DG
DA
DA
DC
 9.833
9.043
9.013
8.059
4.558
2.795
7.734
 CB
N
N
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 46.0 0.4 H -50.2 -67.2 9.0 0.078 0.322 F:P62805:0.322
 DA
DT
DT
DG
DA
DA
DT
DG
 9.987
8.667
8.493
4.928
3.053
7.952
9.846
9.067
 O
O
CB
N
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
3azl 1 P68431 100.0 1e-96 X-RAY
 2011-09-21 ALA A:51 A:47 51.0 0.443 H -64.1 -54.3 8.0 0.07 0.373 B:P62805:0.374
 DC
DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.772
9.969
8.529
9.902
8.973
8.142
4.911
3.064
8.087
7.067
 CB
N
N
N
O
CB
CB
N
N
CA
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 52.0 0.452 H -58.5 -46.5 11.0 0.096 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.196
8.102
4.878
3.052
8.024
9.843
9.921
8.862
3.655
 O
CB
N
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
3azm 1 P68431 100.0 1e-96 X-RAY
 2011-09-21 ALA A:51 A:47 46.0 0.4 H -47.6 -53.3 6.0 0.052 0.348 B:P62805:0.348
 DT
DT
DT
DC
DG
DA
DA
DC
 9.801
9.292
9.671
8.818
8.421
5.031
3.282
8.209
 N
N
N
O
CB
N
N
N
 O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 50.0 0.435 H -63.4 -52.4 9.0 0.078 0.357 F:P62805:0.357
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.957
9.275
8.264
4.956
2.756
8.150
9.391
9.894
9.106
 N
O
CB
N
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3azn 1 P68431 100.0 1e-96 X-RAY
 2011-09-21 ALA A:51 A:47 45.0 0.391 H -53.4 -52.9 7.0 0.061 0.33 B:P62805:0.33
 DC
DT
DC
DG
DA
DA
DC
 9.769
8.644
8.957
8.097
4.789
2.973
8.036
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 45.0 0.391 H -52.3 -56.2 9.0 0.078 0.313 F:P62805:0.313
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.833
8.753
8.306
4.971
3.058
7.971
9.815
9.866
8.942
 N
O
CB
N
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3w96 1 P68431 100.0 1e-96 X-RAY
 2013-08-28 ALA A:51 A:47 40.0 0.348 H -35.2 -61.4 4.0 0.035 0.313 B:P62805:0.313
 DC
DT
DT
DC
DG
DA
DA
DC
 9.871
9.885
9.235
9.196
8.544
5.152
3.254
8.205
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 54.0 0.47 H -62.1 -50.2 10.0 0.087 0.383 F:P62805:0.383
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.968
9.382
8.235
4.924
2.860
8.193
9.627
9.907
9.008
 N
O
CB
N
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3w97 1 P68431 100.0 1e-96 X-RAY
 2013-08-28 ALA A:51 A:47 42.0 0.365 H -45.5 -43.2 3.0 0.026 0.339 B:P62805:0.339
 DC
DT
DC
DG
DA
DA
DC
 9.746
9.138
9.749
8.419
5.040
3.432
8.377
 CB
N
N
CB
N
N
N
 OP1
OP1
OP2
O3'
O3'
OP1
OP2
ALA E:51 E:47 50.0 0.435 H -58.8 -43.5 8.0 0.07 0.365 F:P62805:0.365
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.773
9.403
8.322
4.986
3.118
7.614
9.654
9.903
9.015
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3w99 1 P68431 100.0 1e-96 X-RAY
 2013-08-28 ALA A:51 A:47 45.0 0.391 H -36.8 -59.0 5.0 0.043 0.348 B:P62805:0.348
 DT
DT
DC
DG
DA
DA
DC
 9.635
9.278
9.348
8.763
4.912
3.180
8.032
 C
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 54.0 0.47 H -57.3 -45.0 11.0 0.096 0.374 F:P62805:0.374
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.908
9.747
8.056
4.526
2.969
7.981
9.745
9.913
9.085
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3wa9 1 P68431 100.0 1e-96 X-RAY
 2013-12-18 ALA A:51 A:47 49.0 0.426 H -48.4 -58.4 9.0 0.078 0.348 B:P62805:0.348
 DC
DT
DC
DG
DA
DA
DC
 9.681
8.991
8.961
8.185
4.861
2.990
7.799
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -49.8 -44.2 9.0 0.078 0.365 F:P62805:0.365
 DA
DT
DT
DG
DA
DA
DT
DG
 9.976
8.964
8.146
4.747
3.047
7.864
9.648
8.680
 N
O
CB
CB
N
N
CB
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
3waa 1 P68431 100.0 1e-96 X-RAY
 2013-12-18 ALA A:51 A:47 49.0 0.426 H -54.4 -46.6 10.0 0.087 0.339 B:P62805:0.339
 DC
DT
DT
DC
DG
DA
DA
DC
 9.579
9.997
8.734
9.259
8.187
4.647
3.030
7.620
 CB
N
N
C
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 53.0 0.461 H -52.5 -46.7 10.0 0.087 0.374 F:P62805:0.374
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.932
8.858
8.448
5.006
3.050
7.870
9.721
9.919
8.887
 N
O
CB
N
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3wkj 1 P68431 100.0 1e-96 X-RAY
 2014-04-09 ALA A:51 A:47 47.0 0.409 H -65.9 -46.0 7.0 0.061 0.348 B:P62805:0.348
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.779
9.846
8.867
9.254
8.106
4.775
3.051
8.101
7.905
 CB
N
N
C
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 53.0 0.461 H -55.7 -49.2 10.0 0.087 0.374 F:P62805:0.374
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.985
9.325
8.275
4.797
3.084
7.977
9.744
9.893
8.929
3.642
 N
O
CB
CB
N
N
CB
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
4ym5 1 P68431 100.0 1e-96 X-RAY
 2015-12-02 ALA A:51 A:47 40.0 0.348 H -58.3 -59.7 5.0 0.043 0.305 B:P62805:0.304
 DT
DG
DT
DG
DA
DA
DC
 9.768
8.918
8.943
8.406
5.254
3.268
7.962
 N
N
O
CB
N
N
N
 C5'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 46.0 0.4 H -57.4 -61.5 9.0 0.078 0.322 F:P62805:0.322
 DT
DG
DA
DA
DC
DC
DT
DG
 8.842
8.409
4.901
2.916
8.264
8.902
9.657
8.432
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
4ym6 1 P68431 100.0 1e-96 X-RAY
 2015-12-02 ALA A:51 A:47 50.0 0.435 H -53.2 -67.5 7.0 0.061 0.374 B:P62805:0.374
 DC
DT
DT
DC
DG
DA
DA
DC
 8.745
9.940
8.796
8.938
8.494
5.047
3.220
8.153
 CB
C
N
O
CB
N
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -55.2 -66.4 8.0 0.07 0.373 F:P62805:0.374
 DT
DT
DG
DA
DA
DT
DT
DG
 8.641
8.835
5.461
3.666
8.064
9.046
9.660
8.852
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
5av5 1 P68431 100.0 1e-96 X-RAY
 2015-12-23 ALA A:51 A:47 50.0 0.435 H -60.6 -47.4 9.0 0.078 0.357 B:P62805:0.357
 DT
DT
DG
DT
DT
DG
DA
DA
HOH
 9.867
9.969
8.727
9.140
8.229
4.817
3.122
7.890
6.159
 CB
N
N
O
CB
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -59.4 -43.9 10.0 0.087 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.303
8.223
4.905
3.105
7.884
9.792
9.924
8.706
4.064
 C
CB
CB
N
N
CB
N
N
CA
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5av6 1 P68431 100.0 1e-96 X-RAY
 2015-12-23 ALA A:51 A:47 50.0 0.435 H -60.3 -47.7 9.0 0.078 0.357 B:P62805:0.357
 DT
DT
DG
DT
DT
DG
DA
DA
HOH
 9.549
9.935
8.697
9.270
8.162
4.768
3.021
7.863
5.968
 CB
N
N
C
CB
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 52.0 0.452 H -58.8 -44.0 10.0 0.087 0.365 F:P62805:0.365
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.386
8.105
4.810
3.054
7.831
9.811
9.939
8.725
3.687
 C
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5av8 1 P68431 100.0 1e-96 X-RAY
 2015-12-23 ALA A:51 A:47 51.0 0.443 H -62.5 -43.8 10.0 0.087 0.356 B:P62805:0.357
 DT
DG
DT
DT
DG
DA
DA
HOH
 9.708
8.739
9.240
8.156
4.654
2.997
7.930
6.135
 CB
N
C
CB
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -56.4 -43.8 10.0 0.087 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DG
HOH
 9.430
8.160
4.784
3.112
7.825
9.716
8.738
3.796
 C
CB
CB
N
N
CB
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5av9 1 P68431 100.0 1e-96 X-RAY
 2015-12-23 ALA A:51 A:47 50.0 0.435 H -59.5 -44.5 9.0 0.078 0.357 B:P62805:0.357
 DT
DT
DG
DT
DT
DG
DA
DA
HOH
 9.650
9.995
8.738
9.246
8.163
4.790
3.024
7.895
3.629
 CB
N
N
C
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 52.0 0.452 H -60.2 -43.8 11.0 0.096 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.380
8.115
4.800
3.121
7.838
9.791
9.991
8.730
3.763
 C
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5avb 1 P68431 100.0 1e-96 X-RAY
 2015-12-23 ALA A:51 A:47 52.0 0.452 H -62.4 -47.6 9.0 0.078 0.374 B:P62805:0.374
 DT
DG
DT
DT
DG
DA
DA
HOH
 9.888
8.726
9.091
8.236
4.731
3.056
7.884
8.048
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -61.3 -40.3 10.0 0.087 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DG
HOH
 9.325
8.166
4.939
3.150
7.880
8.776
6.106
 C
CB
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O
5avc 1 P68431 100.0 1e-96 X-RAY
 2015-12-23 ALA A:51 A:47 50.0 0.435 H -59.3 -47.4 9.0 0.078 0.357 B:P62805:0.357
 DT
DG
DT
DT
DG
DA
DA
HOH
 9.882
8.673
9.216
8.219
4.805
3.040
7.920
6.199
 CB
N
O
CB
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 52.0 0.452 H -62.0 -42.3 10.0 0.087 0.365 F:P62805:0.365
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.296
8.185
4.789
3.097
7.807
9.971
9.969
8.708
3.947
 C
CB
CB
N
N
CB
N
N
CA
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5b1m 1 P68433 100.0 1e-96 X-RAY
 2017-02-15 ALA A:51 A:47 52.0 0.452 H -66.0 -45.6 10.0 0.087 0.365 B:P62806:0.365
 DC
DT
DT
DC
DG
DA
DA
DC
 9.889
9.776
8.593
9.023
8.273
4.815
3.204
8.077
 CB
N
N
O
CB
CB
N
N
 OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 52.0 0.452 H -70.1 -42.3 11.0 0.096 0.356 F:P62806:0.357
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.734
8.874
8.243
4.780
3.108
8.040
9.952
8.651
7.545
 N
O
CB
CB
N
N
CB
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5b24 1 P68431 100.0 1e-96 X-RAY
 2016-03-02 ALA A:51 A:47 51.0 0.443 H -59.3 -52.9 8.0 0.07 0.373 B:P62805:0.374
 DC
DT
DC
DG
DA
DA
DC
 9.751
8.671
9.638
8.167
4.925
3.088
8.716
 CB
N
N
CB
N
N
N
 OP1
OP1
OP2
O3'
O3'
OP1
OP2
ALA E:51 E:47 41.0 0.357 H -69.2 -48.2 4.0 0.035 0.322 F:P62805:0.322
 DA
DT
DT
DG
DA
DA
DG
 9.958
9.130
8.786
5.540
4.165
8.227
8.853
 N
O
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
5b2i 1 P68431 100.0 1e-96 X-RAY
 2016-06-15 ALA A:51 A:47 47.0 0.409 H -61.9 -54.0 8.0 0.07 0.339 B:P62805:0.339
 DG
DT
DG
DA
DA
DC
 9.041
8.962
8.217
5.164
3.444
7.870
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 53.0 0.461 H -66.0 -55.5 9.0 0.078 0.383 F:P62805:0.383
 DT
DT
DG
DA
DA
DT
DG
 8.911
8.491
5.038
3.232
7.876
9.750
8.849
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
5b2j 1 P68431 100.0 1e-96 X-RAY
 2016-06-15 ALA A:51 A:47 49.0 0.426 H -61.5 -40.7 8.0 0.07 0.356 B:P62805:0.357
 DT
DG
DT
DG
DA
DA
DC
HOH
 9.985
8.650
9.466
8.032
4.926
3.177
7.752
9.622
 N
N
C
CB
CB
N
N
O
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 56.0 0.487 H -61.6 -43.6 12.0 0.104 0.383 F:P62805:0.383
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.408
8.249
4.824
3.005
7.792
9.330
9.916
8.713
7.793
 C
CB
CB
N
N
CB
N
N
O
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5b31 1 P68431 100.0 1e-96 X-RAY
 2016-08-03 ALA A:51 A:47 50.0 0.435 H -54.6 -60.4 9.0 0.078 0.357 B:P62805:0.357
 DC
DT
DC
DG
DA
DA
DC
HOH
 9.489
8.704
8.889
8.213
4.772
3.028
7.720
4.051
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -61.8 -42.5 10.0 0.087 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DG
HOH
 9.317
8.123
4.721
3.063
7.936
9.655
8.799
3.917
 O
CB
CB
N
N
CB
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5cpi 1 P68431 100.0 1e-96 X-RAY
 2015-10-28 ALA A:51 A:47 40.0 0.348 H -58.8 -54.9 12.0 0.104 0.244 B:P62805:0.243
 DC
DT
DC
DC
DA
DT
 9.776
9.075
8.754
4.912
3.167
8.076
 N
N
CB
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 50.0 0.435 H -58.2 -65.8 8.0 0.07 0.365 F:P62805:0.365
 DG
DC
DT
DC
DG
DG
 8.408
5.204
3.279
8.120
9.331
9.039
 CB
N
N
N
CB
N
 O3'
O3'
OP1
OP2
OP1
OP1
5cpj 1 P68431 100.0 1e-96 X-RAY
 2015-10-28 ALA A:51 A:47 38.0 0.33 H -66.6 -50.6 8.0 0.07 0.26 B:P62805:0.261
 DT
DC
DT
DC
DC
DC
DA
DT
 9.227
9.953
8.645
9.948
8.172
5.139
3.580
8.753
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 48.0 0.417 H -65.3 -53.4 6.0 0.052 0.365 F:P62805:0.365
 DA
DT
DG
DC
DT
DC
DG
DG
 9.874
9.130
8.135
5.277
3.501
8.364
9.449
8.550
 N
N
CB
N
N
N
CB
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
5cpk 1 P68431 100.0 1e-96 X-RAY
 2015-10-28 ALA A:51 A:47 49.0 0.426 H -62.2 -57.7 8.0 0.07 0.356 B:P62805:0.357
 DT
DT
DG
DC
DC
DT
DG
DT
 9.484
8.872
8.780
9.516
8.012
5.188
3.370
8.256
 CB
C
N
O
CB
N
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -61.0 -57.0 11.0 0.096 0.347 F:P62805:0.348
 DG
DA
DC
DT
DT
5CM
DT
DT
DG
 9.911
9.020
8.213
4.857
2.954
8.288
9.349
9.817
8.693
 N
O
CB
CB
N
N
CB
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
5gse 1 P68431 100.0 1e-96 X-RAY
 2017-05-03 ALA A:51 A:47 51.0 0.443 H -65.2 -46.0 11.0 0.096 0.347 B:P62805:0.348
 DG
DG
DT
DA
DC
DC
DC
DG
DC
 9.051
9.514
7.548
8.807
9.396
7.764
4.904
2.785
8.050
 CB
C
C
N
N
CB
CB
N
N
 OP1
O3'
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -64.0 -62.9 12.0 0.104 0.339 F:P62805:0.339
 DT
DC
DG
DT
DG
DC
DC
DC
 9.594
8.085
4.585
2.790
7.713
9.645
9.585
8.677
 N
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA K:51 K:47 104.0 0.904 360.0 80.4 103.0 0.896 0.008 L:P62805:0.009
 DC
DG
DT
DG
DA
DC
 9.641
4.390
2.363
7.186
9.476
9.310
 N
N
N
CB
N
N
 O3'
O3'
OP1
OP1
C4'
OP1
ALA O:51 O:47 52.0 0.452 H -63.0 -60.1 10.0 0.087 0.365 P:P62805:0.365
 DG
DT
DC
DT
DC
DC
DG
DC
 9.866
9.600
8.435
9.426
8.065
4.653
2.952
7.697
 CB
N
N
N
CB
CB
N
N
 C5'
C5'
OP1
OP1
O3'
O3'
OP1
OP2
5gtc 1 P68431 100.0 1e-96 X-RAY
 2017-06-28 ALA A:51 A:47 52.0 0.452 H -54.9 -50.3 9.0 0.078 0.374 B:P62805:0.374
 DC
DT
DT
DT
DC
DG
DA
DA
DC
 9.699
9.816
8.706
9.950
8.827
8.276
4.870
2.990
8.117
 CB
N
N
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -54.8 -49.5 10.0 0.087 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DG
 9.138
8.216
4.938
2.967
8.008
9.768
9.013
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
5jrg 1 P68431 100.0 1e-96 X-RAY
 2017-03-08 ALA A:51 A:47 48.0 0.417 H -64.5 -47.8 9.0 0.078 0.339 B:P62805:0.339
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.844
9.414
8.491
9.324
8.329
4.849
2.959
7.832
7.909
 CB
C
N
N
CB
CB
N
N
CB
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 49.0 0.426 H -62.1 -47.1 11.0 0.096 0.33 F:P62805:0.33
 DA
DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.853
9.041
8.202
4.844
3.024
7.808
9.635
9.925
8.671
6.193
 N
O
CB
CB
N
N
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5y0c 2 P68431 100.0 1e-96 X-RAY
 2018-07-18 ALA C:51 A:47 50.0 0.435 H -57.5 -49.2 9.0 0.078 0.357 D:P62805:0.357
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.886
9.712
8.683
9.258
8.081
4.951
3.110
7.867
5.857
 CB
N
N
O
CB
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:51 E:47 49.0 0.426 H -58.5 -49.8 10.0 0.087 0.339 H:P62805:0.339
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.810
8.677
8.159
4.845
2.987
7.761
9.964
8.709
5.645
 N
O
CB
CB
N
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O
5y0d 1 P68431 100.0 1e-96 X-RAY
 2018-07-18 ALA A:51 A:47 51.0 0.443 H -50.0 -50.1 10.0 0.087 0.356 B:P62805:0.357
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.702
9.791
8.703
8.981
8.061
4.833
3.083
7.849
4.590
 CB
N
N
O
CB
CB
N
N
CA
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -51.1 -49.0 11.0 0.096 0.347 F:P62805:0.348
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.900
8.849
8.175
4.826
2.995
7.840
9.771
9.935
8.805
3.628
 N
O
CB
N
N
N
CB
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5z30 1 P68431 100.0 1e-96 X-RAY
 2018-07-18 ALA A:51 A:47 51.0 0.443 H -59.5 -49.0 11.0 0.096 0.347 B:P62805:0.348
 DC
DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.814
9.741
8.823
9.963
8.843
8.056
4.802
3.084
7.944
7.368
 CB
N
N
N
O
CB
CB
N
N
O
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -59.1 -46.7 11.0 0.096 0.347 F:P62805:0.348
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 8.984
8.164
4.852
3.054
8.059
9.795
9.990
8.752
6.949
 O
CB
CB
N
N
CB
C
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
O
6hkt 1 P68431 100.0 1e-96 X-RAY
 2018-10-31 ALA A:51 A:47 49.0 0.426 H -63.7 -47.8 11.0 0.096 0.33 B:P62805:0.33
 DC
DC
DC
DT
DC
DG
DT
DG
 8.806
9.186
8.420
9.507
8.150
5.075
3.304
8.193
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 52.0 0.452 H -59.6 -42.4 10.0 0.087 0.365 F:P62805:0.365
 DC
DC
DG
DC
DG
DC
 7.125
4.428
2.921
8.295
9.014
9.737
 CB
N
N
N
CB
N
 O3'
O3'
OP2
OP2
OP1
OP1
ALA K:51 a:47 53.0 0.461 H -59.2 -44.5 12.0 0.104 0.357 L:P62805:0.357
 DC
DC
DC
DT
DC
DG
DT
DG
 8.575
9.420
8.519
9.848
7.708
4.903
3.360
8.402
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA O:51 e:47 52.0 0.452 H -63.6 -47.4 14.0 0.122 0.33 P:P62805:0.33
 DT
DC
DC
DG
DC
DG
DT
DC
 9.250
8.081
4.624
2.808
7.706
9.345
9.885
8.928
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA S:51 K:47 49.0 0.426 H -64.0 -51.6 8.0 0.07 0.356 T:P62805:0.357
 DC
DC
DT
DC
DG
DT
DG
 9.285
9.276
9.559
8.606
5.705
3.989
8.972
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA W:51 O:47 50.0 0.435 H -63.7 -44.9 7.0 0.061 0.374 X:P62805:0.374
 DT
DC
DC
DG
DC
DG
 9.291
8.734
5.741
3.864
8.857
9.722
 N
CB
N
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
ALA AA:51 k:47 51.0 0.443 H -59.7 -45.6 8.0 0.07 0.373 BA:P62805:0.374
 DC
DC
DT
DC
DG
DT
DG
 9.236
9.402
9.817
7.734
5.016
3.489
8.253
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP2
OP2
ALA EA:51 o:47 59.0 0.513 H -63.3 -47.6 11.0 0.096 0.417 FA:P62805:0.417
 DT
DC
DC
DG
DC
DG
DC
 9.837
7.509
4.507
2.913
7.959
9.316
9.583
 N
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA IA:51 U:47 51.0 0.443 H -64.7 -46.6 8.0 0.07 0.373 JA:P62805:0.374
 DC
DC
DT
DC
DG
DT
DG
 9.202
9.221
9.627
7.753
4.881
3.372
8.129
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA MA:51 Y:47 51.0 0.443 H -59.0 -41.4 9.0 0.078 0.365 NA:P62805:0.365
 DC
DC
DG
DC
DG
 7.083
4.580
3.087
8.575
8.915
 CB
N
N
N
CB
 O3'
O3'
OP2
OP2
OP1
ALA QA:51 u:47 50.0 0.435 H -58.7 -43.6 11.0 0.096 0.339 RA:P62805:0.339
 DC
DC
DG
DT
DC
DG
DT
DG
 9.370
9.481
9.908
9.374
7.867
4.843
3.300
7.777
 CB
N
N
N
CB
CB
N
N
 OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA UA:51 y:47 52.0 0.452 H -65.2 -47.9 11.0 0.096 0.356 VA:P62805:0.357
 DT
DC
DC
DG
DC
DG
DT
DC
 9.266
7.925
4.908
3.166
8.269
9.198
9.950
9.705
 N
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
6jou 1 P68431 100.0 1e-96 X-RAY
 2020-03-25 ALA A:51 A:47 51.0 0.443 H -59.6 -47.3 9.0 0.078 0.365 B:P62805:0.365
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.930
9.759
8.822
9.001
8.110
4.842
3.117
8.094
7.798
 CB
N
N
O
CB
N
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 53.0 0.461 H -55.8 -44.5 12.0 0.104 0.357 F:P62805:0.357
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.827
8.654
8.140
4.820
3.104
7.881
9.696
8.806
3.565
 N
O
CB
N
N
N
CB
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
6jr0 1 P68431 100.0 1e-96 X-RAY
 2019-10-02 ALA A:51 A:47 49.0 0.426 H -61.7 -46.3 9.0 0.078 0.348 B:P62805:0.348
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.915
9.681
8.753
9.291
8.001
4.898
3.192
7.837
7.910
 CB
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -61.9 -46.9 11.0 0.096 0.347 F:P62805:0.348
 DT
DT
DG
DA
DA
DG
HOH
 9.292
8.063
4.864
2.890
7.870
8.753
3.765
 O
CB
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O
6jr1 1 P68431 100.0 1e-96 X-RAY
 2019-10-02 ALA A:51 A:47 52.0 0.452 H -61.2 -43.0 10.0 0.087 0.365 B:P62805:0.365
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.979
9.726
8.690
9.300
7.980
4.856
3.095
7.751
5.910
 CB
N
N
O
CB
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -60.7 -42.2 11.0 0.096 0.347 F:P62805:0.348
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.881
8.912
8.188
4.807
2.974
7.789
9.952
8.761
3.480
 N
O
CB
CB
N
N
CB
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
6k1i 1 P68431 100.0 1e-96 X-RAY
 2020-01-15 ALA A:51 A:47 49.0 0.426 H -51.7 -46.0 12.0 0.104 0.322 B:P62805:0.322
 DC
DA
DT
DA
DT
DC
DG
DT
DG
HOH
 9.172
9.672
9.125
9.709
9.098
8.513
4.657
2.814
7.715
7.067
 CB
N
N
N
N
CB
CB
N
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 50.0 0.435 H -61.2 -54.8 10.0 0.087 0.348 F:P62805:0.348
 DT
DC
DC
DG
DC
DG
DA
DT
HOH
 8.795
8.172
4.927
2.990
8.077
8.849
9.592
9.026
7.924
 O
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
6k1j 1 P68431 100.0 1e-96 X-RAY
 2020-01-15 ALA A:51 A:47 41.0 0.357 H -47.4 -68.2 7.0 0.061 0.296 B:P62805:0.296
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.654
8.837
8.791
8.245
4.824
2.916
7.876
8.403
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 48.0 0.417 H -52.0 -57.7 7.0 0.061 0.356 F:P62805:0.357
 DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.046
8.118
4.880
3.029
7.755
9.709
9.997
8.757
7.705
 O
CB
N
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
6k1k 1 P68431 100.0 1e-96 X-RAY
 2020-01-15 ALA A:51 A:47 51.0 0.443 H -60.1 -45.8 11.0 0.096 0.347 B:P62805:0.348
 DC
DT
DG
DA
DT
DC
DG
DT
DG
HOH
 9.072
9.885
8.857
9.820
8.912
8.062
4.691
3.083
7.981
8.008
 CB
N
N
N
N
CB
CB
N
N
CB
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -58.7 -48.6 8.0 0.07 0.373 F:P62805:0.374
 DT
DC
DG
DT
DG
DC
DT
DG
HOH
 9.702
8.279
4.874
3.178
8.047
9.212
9.846
8.935
8.180
 O
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
6kvd 2 P68431 100.0 1e-96 X-RAY
 2019-12-18 ALA C:51 A:47 53.0 0.461 H -56.9 -44.9 9.0 0.078 0.383 D:P62805:0.383
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.821
9.839
8.758
9.104
8.005
4.844
2.993
8.022
7.918
 CB
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:51 E:47 51.0 0.443 H -58.2 -41.7 11.0 0.096 0.347 H:P62805:0.348
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.067
8.192
4.831
3.047
7.833
9.723
9.937
8.691
5.629
 O
CB
CB
N
N
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
6l49 7 P68431 100.0 1e-96 EM
 2019-12-04 ALA K:51 K:47 50.0 0.435 H -63.2 -43.8 9.0 0.078 0.357 L:P62805:0.357
 DG
DA
DG
DT
DC
DG
DT
DG
 9.327
8.990
9.510
9.414
8.306
4.668
2.600
7.421
 N
N
N
O
CB
CB
N
N
 OP1
OP2
OP1
OP1
O3'
O3'
OP1
OP2
ALA O:51 O:47 54.0 0.47 H -65.2 -43.8 14.0 0.122 0.348 P:P62805:0.348
 DC
DC
DG
DC
DT
DG
 7.124
4.458
3.011
7.609
9.595
9.009
 CB
CB
N
N
N
N
 O3'
O3'
OP2
OP2
O5'
OP1
ALA S:51 S:47 52.0 0.452 H -69.2 -41.4 13.0 0.113 0.339 T:P62805:0.339
 DC
DG
DC
DG
DT
DG
 9.665
9.909
7.212
4.433
2.849
8.081
 CB
N
CB
CB
N
N
 OP1
OP1
O3'
C3'
OP2
OP2
ALA W:51 W:47 52.0 0.452 H -64.0 -41.1 10.0 0.087 0.365 X:P62805:0.365
 DA
DT
DC
DC
DG
DC
DT
 9.571
8.562
9.293
5.523
3.267
8.037
8.670
 N
O
CB
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O4'
6l4a 1 P68431 100.0 1e-96 EM
 2019-12-04 ALA A:51 A:47 52.0 0.452 H -66.7 -39.7 12.0 0.104 0.348 B:P62805:0.348
 DC
DG
DT
DC
DG
DT
DG
 9.886
9.674
9.345
8.220
5.216
3.718
8.223
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP2
OP2
ALA E:51 E:47 49.0 0.426 H -65.3 -41.5 9.0 0.078 0.348 F:P62805:0.348
 DA
DC
DC
DG
DC
DG
 8.871
8.400
5.210
3.460
8.245
9.924
 N
CB
N
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
ALA K:51 K:47 52.0 0.452 H -64.5 -45.6 9.0 0.078 0.374 L:P62805:0.374
 DC
DG
DA
DC
DG
DT
DG
 9.911
9.970
8.831
8.154
5.042
3.607
8.455
 CB
N
N
CB
N
N
N
 OP1
C5'
OP2
O3'
O3'
OP2
OP2
ALA O:51 O:47 52.0 0.452 H -66.3 -41.4 11.0 0.096 0.356 P:P62805:0.357
 DA
DT
DC
DC
DG
DC
DG
 9.834
8.843
8.529
5.091
3.211
7.946
8.952
 N
N
CB
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
ALA S:51 S:47 51.0 0.443 H -64.4 -46.5 10.0 0.087 0.356 T:P62805:0.357
 DC
DG
DT
DC
DG
DT
DG
 9.763
9.933
9.224
7.981
4.923
3.477
8.186
 CB
N
N
CB
N
N
N
 OP1
O3'
OP1
O3'
O3'
OP2
OP2
ALA W:51 W:47 51.0 0.443 H -66.8 -40.8 10.0 0.087 0.356 X:P62805:0.357
 DT
DC
DC
DG
DC
DT
 9.559
8.735
4.951
3.354
8.040
9.902
 N
CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
C4'
6r8y 1 P68431 100.0 1e-96 EM
 2019-06-12 ALA A:51 A:48 52.0 0.452 H -62.5 -41.8 8.0 0.07 0.382 B:P62805:0.383
 DC
DT
DG
DT
DG
DA
DA
DC
 9.603
9.506
8.640
9.234
7.961
3.749
3.020
7.625
 HB3
H
H
O
HB2
HB2
H
H
 OP1
H4'
OP1
OP1
O3'
H3'
OP1
OP2
ALA E:51 E:48 51.0 0.443 H -61.4 -43.7 7.0 0.061 0.382 F:P62805:0.383
 DT
DG
DA
DA
DC
DG
DC
DT
DG
 9.215
7.671
3.358
1.955
7.678
9.467
9.028
9.225
8.551
 O
HB2
HB2
H
H
HB3
HB3
H
H
 OP1
O3'
H3'
OP1
OP2
H4'
OP1
H5''
OP1
6r8z 1 P68431 100.0 1e-96 EM
 2019-06-12 ALA A:51 A:48 45.0 0.391 H -62.4 -41.1 6.0 0.052 0.339 B:P62805:0.339
 DG
DC
DT
DG
DT
DG
DA
DA
DC
 9.887
9.289
9.839
9.014
9.978
8.333
4.040
3.611
8.169
 HB3
HB3
C
H
O
HB2
HB2
H
H
 H5''
OP1
OP1
OP1
OP1
O3'
H3'
OP1
OP2
ALA E:51 E:48 52.0 0.452 H -62.0 -42.1 13.0 0.113 0.339 F:P62805:0.339
 DA
DT
DG
DA
DA
DC
DG
DT
DG
 9.393
9.197
8.163
3.337
2.091
6.852
9.967
8.850
8.885
 N
O
HB2
HB2
H
H
HB3
H
H
 H5''
OP1
O3'
H3'
OP1
OP2
H4'
H5''
OP1
6r90 1 P68431 100.0 1e-96 EM
 2019-06-12 ALA A:51 A:48 53.0 0.461 H -60.2 -41.6 8.0 0.07 0.391 B:P62805:0.391
 DG
DC
DT
DG
DT
DG
DA
DA
DC
 9.457
9.735
9.667
8.889
9.465
8.266
3.743
2.414
8.042
 HB3
HB3
H
H
O
HB2
HB2
H
H
 H4'
H5'
H5''
OP1
OP1
O3'
H3'
OP1
OP2
ALA E:51 E:48 49.0 0.426 H -61.0 -43.4 9.0 0.078 0.348 F:P62805:0.348
 DA
DT
DG
DA
DA
DC
DG
DC
DT
DG
 9.399
9.810
6.903
3.044
2.383
7.378
9.720
9.749
9.295
8.173
 N
O
HB2
HB2
H
H
HB3
HB3
H
H
 H5''
OP1
O3'
H3'
OP1
OP2
H4'
H5''
O3'
OP1
6r91 1 P68431 100.0 1e-96 EM
 2019-06-12 ALA A:51 A:48 49.0 0.426 H -57.3 -46.6 5.0 0.043 0.383 B:P62805:0.383
 DT
DC
DA
DC
DA
DC
DA
DT
DG
 8.364
8.876
9.960
9.747
9.554
8.904
3.610
2.143
6.782
 HB3
HB3
H
N
O
HB2
HB2
H
H
 H4'
OP1
OP1
H5''
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:48 44.0 0.383 H -56.5 -46.9 7.0 0.061 0.322 F:P62805:0.322
 DG
DC
DT
DG
DG
DA
DT
 8.109
3.671
2.168
7.957
9.216
8.872
9.265
 HB2
HB2
H
H
HB3
HB3
N
 O3'
O3'
OP1
OP1
H4'
OP1
OP1
6r92 4 P68431 100.0 1e-96 EM
 2019-06-12 ALA D:51 A:48 43.0 0.374 H -57.0 -47.0 7.0 0.061 0.313 E:P62805:0.313
 DC
DT
DG
DA
DT
DG
DA
DA
 9.362
9.368
9.353
8.859
8.372
4.260
2.520
7.615
 HB3
HB3
H
O
HB2
HB2
HB2
H
 H5''
OP1
H5''
OP1
O3'
H3'
OP1
OP2
ALA H:51 E:48 43.0 0.374 H -57.0 -47.0 7.0 0.061 0.313 I:P62805:0.313
 DC
DA
DA
DC
DA
DG
DT
DT
 9.723
8.192
4.255
2.968
7.640
9.871
8.657
9.345
 O
HB2
HB2
H
H
HB3
H
H
 OP1
O3'
H3'
OP1
OP2
H5''
H5''
OP1
6r93 3 P68431 100.0 1e-96 EM
 2019-06-12 ALA C:51 A:48 48.0 0.417 H -56.4 -46.4 5.0 0.043 0.374 D:P62805:0.374
 DC
DT
DG
DA
DT
DG
DA
DA
DC
 9.913
9.286
9.099
9.938
8.733
8.571
4.015
2.585
8.131
 HB3
H
H
N
O
HB2
HB2
H
H
 OP1
H4'
OP1
OP1
OP1
O3'
H3'
OP1
OP2
ALA G:51 E:48 46.0 0.4 H -54.0 -45.5 5.0 0.043 0.357 H:P62805:0.357
 DA
DT
DG
DA
DA
DC
DC
DT
DG
 9.612
9.123
7.833
3.505
2.119
7.641
9.795
9.361
8.655
 N
O
HB2
HB2
H
H
HB3
H
H
 H5''
OP1
O3'
H3'
OP1
OP2
H5''
H4'
OP1
6r94 3 P68431 100.0 1e-96 EM
 2019-06-12 ALA C:51 A:48 49.0 0.426 H -57.1 -47.3 11.0 0.096 0.33 D:P62805:0.33
 DC
DT
DG
DT
DG
DA
DA
DC
 9.736
8.630
9.071
9.014
8.059
3.812
2.483
8.173
 HB3
H
H
O
HB2
HB2
H
H
 OP1
H5''
OP1
OP1
O3'
H3'
OP1
OP2
ALA G:51 E:48 51.0 0.443 H -56.6 -47.2 10.0 0.087 0.356 H:P62805:0.357
 DT
DG
DA
DA
DC
DC
DT
DG
 9.208
8.161
3.843
2.390
7.572
9.571
9.012
8.824
 O
HB2
HB2
H
H
HB3
H
H
 OP1
O3'
H3'
OP1
OP2
OP1
H5''
OP1
6t90 1 P68431 100.0 1e-96 EM
 2020-05-06 ALA A:51 A:48 53.0 0.461 H -58.0 -39.6 10.0 0.087 0.374 B:P62805:0.374
 DC
DT
DC
DG
DT
DG
 8.929
9.859
8.967
5.726
3.925
8.519
 CB
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
6t93 1 P68431 100.0 1e-96 EM
 2020-05-06 ALA A:51 A:48 46.0 0.4 H -59.1 -38.7 11.0 0.096 0.304 B:P62805:0.304
 DC
DC
DT
DC
DG
DT
DG
 9.686
8.875
9.704
8.812
5.734
3.803
8.130
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:48 53.0 0.461 H -58.1 -39.4 13.0 0.113 0.348 F:P62805:0.348
 DC
DC
DG
DC
DG
DC
 8.439
5.485
3.595
8.408
9.637
9.119
 CB
CB
N
N
CB
N
 O3'
O3'
OP1
OP2
OP1
OP1
6usj 3 P68431 100.0 1e-96 EM
 2020-10-14 ALA C:51 A:47 45.0 0.391 H -56.3 -45.6 6.0 0.052 0.339 D:P62805:0.339
 DG
DC
DA
DC
DC
DG
DC
 8.886
9.867
8.972
8.269
4.630
2.931
8.001
 CB
N
N
CB
CB
N
N
 OP1
C5'
OP1
O3'
O3'
OP1
OP2
ALA G:51 E:47 43.0 0.374 H -59.6 -44.6 7.0 0.061 0.313 H:P62805:0.313
 DT
DC
DG
DT
DG
DA
DC
DC
DC
 9.864
7.738
4.283
2.953
8.251
9.823
7.975
9.911
8.654
 O
CB
CB
N
N
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
C5'
OP1
O3'
OP1
ALA M:51 K:47 44.0 0.383 H -56.3 -45.5 6.0 0.052 0.331 N:P62805:0.33
 DG
DC
DA
DC
DC
DG
DC
 8.853
9.732
8.975
8.288
4.615
2.928
8.004
 CB
N
N
CB
CB
N
N
 OP1
C5'
OP1
O3'
O3'
OP1
OP2
ALA Q:51 O:47 44.0 0.383 H -60.0 -45.2 7.0 0.061 0.322 R:P62805:0.322
 DT
DC
DG
DT
DG
DA
DC
DC
DC
 9.838
7.738
4.310
2.962
8.258
9.835
7.988
9.823
8.540
 O
CB
CB
N
N
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
C5'
OP1
O3'
OP1
6v2k 1 P68431 100.0 1e-96 X-RAY
 2020-11-25 ALA A:51 A:47 51.0 0.443 H -58.4 -45.8 9.0 0.078 0.365 B:P62805:0.365
 DC
DT
DT
DC
DG
DA
DA
DC
 9.783
9.622
8.710
9.043
8.253
4.875
3.098
8.130
 CB
C
N
O
CB
N
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -58.4 -42.0 10.0 0.087 0.356 F:P62805:0.357
 DA
DT
DT
DG
DA
DA
DT
DG
 9.807
8.791
8.206
4.803
3.131
8.022
9.780
8.820
 N
O
CB
CB
N
N
CB
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
6yov 1 P68431 100.0 1e-96 EM
 2020-05-06 ALA A:51 A:48 52.0 0.452 H -58.1 -41.9 8.0 0.07 0.382 B:P62805:0.383
 DA
DC
DG
DC
DG
DT
DG
 9.848
8.964
9.806
8.485
5.591
3.776
8.557
 CB
CB
N
CB
N
N
N
 O3'
OP1
OP1
O3'
O3'
OP1
OP2
7c0m 1 P68431 100.0 1e-96 EM
 2020-09-16 ALA A:51 A:47 54.0 0.47 H -67.0 -36.7 8.0 0.07 0.4 B:P62805:0.4
 DC
DC
DG
DT
DC
DG
DT
DG
 8.860
9.621
8.788
9.736
8.517
5.426
3.770
8.398
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 53.0 0.461 H -64.5 -50.1 10.0 0.087 0.374 F:P62805:0.374
 DT
DC
DC
DG
DC
DG
DT
DG
 9.889
8.372
5.645
3.337
8.316
8.562
9.495
8.770
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA L:51 a:47 53.0 0.461 H -67.0 -36.7 7.0 0.061 0.4 M:P62805:0.4
 DC
DC
DG
DT
DC
DG
DT
DG
 8.860
9.620
8.788
9.736
8.517
5.426
3.770
8.397
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA P:51 e:47 53.0 0.461 H -64.4 -50.2 11.0 0.096 0.365 Q:P62805:0.365
 DT
DC
DC
DG
DC
DG
DT
DG
 9.889
8.371
5.645
3.336
8.315
8.561
9.495
8.770
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
7d1z 1 P68431 100.0 1e-96 EM
 2021-02-10 ALA A:51 A:47 51.0 0.443 H -64.7 -42.6 9.0 0.078 0.365 B:P62805:0.365
 DC
DG
DT
DC
DG
DT
DG
 9.677
9.183
9.909
8.338
5.335
3.288
7.817
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 52.0 0.452 H -60.4 -49.0 9.0 0.078 0.374 K:P62805:0.374
 DT
DC
DC
DG
DC
DG
DT
DG
 9.709
8.243
5.409
3.184
8.037
8.736
9.983
8.792
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
7scy 3 P68431 100.0 1e-96 EM
 2022-01-12 ALA C:51 A:47 47.0 0.409 H -57.4 -40.7 13.0 0.113 0.296 D:P62805:0.296
 DG
DT
DC
DG
DT
DG
DA
DC
DC
DC
 9.345
9.358
7.239
2.856
2.033
7.596
9.105
8.678
8.580
7.939
 N
O
HB1
HB1
H
H
HB2
HB2
H
H
 H5''
OP1
O3'
H3'
OP1
OP2
H5''
OP1
H5''
OP1
ALA G:51 E:47 43.0 0.374 H -57.2 -37.9 9.0 0.078 0.296 H:P62805:0.296
 DG
DG
DT
DC
DA
DT
DC
DC
DG
DC
 9.211
8.386
8.515
8.592
9.671
9.454
7.208
3.259
1.909
7.448
 HB3
HB3
N
H
N
O
HB1
HB1
H
H
 H5''
H5''
H5''
OP1
H5''
OP1
O3'
H3'
OP1
OP2
7scz 3 P68431 100.0 1e-96 EM
 2022-01-19 ALA C:51 A:47 50.0 0.435 H -58.5 -44.3 11.0 0.096 0.339 D:P62805:0.339
 DG
DT
DC
DG
DT
DG
DA
DC
DC
DC
 9.738
9.459
7.376
3.152
2.056
7.732
9.305
8.596
8.598
8.118
 N
O
HB1
HB1
H
H
HB2
HB2
H
H
 H4'
OP1
O3'
H3'
OP1
OP2
H5''
OP1
H5''
OP1
ALA G:51 E:47 49.0 0.426 H -56.6 -41.4 10.0 0.087 0.339 H:P62805:0.339
 DG
DG
DT
DC
DA
DT
DC
DC
DG
DC
 9.111
8.317
8.458
8.591
9.740
9.436
7.227
3.253
1.988
7.670
 HB3
HB3
H
H
N
O
HB1
HB1
H
H
 H5''
OP1
H5''
OP1
H4'
OP1
O3'
H3'
OP1
OP2
7lya 1 P68431 100.0 2e-96 EM
 2021-07-28 ALA A:52 A:47 54.0 0.47 H -65.0 -46.8 11.0 0.096 0.374 B:P62805:0.374
 DC
DC
DT
DC
DG
DT
DG
 9.694
9.038
9.668
8.415
5.306
3.346
8.071
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA D:52 E:47 53.0 0.461 H -65.0 -46.8 11.0 0.096 0.365 E:P62805:0.365
 DT
DC
DC
DG
DC
DG
DT
DC
 9.810
8.301
5.532
3.279
8.257
9.534
9.589
9.051
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
7lyb 1 P68431 100.0 2e-96 EM
 2021-07-28 ALA A:52 A:47 53.0 0.461 H -59.5 -43.6 11.0 0.096 0.365 B:P62805:0.365
 DC
DC
DC
DT
DC
DG
DT
DG
 9.621
9.920
9.203
9.789
8.497
5.344
3.407
8.251
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA D:52 E:47 54.0 0.47 H -59.5 -43.7 13.0 0.113 0.357 E:P62805:0.357
 DT
DC
DC
DG
DC
DG
DC
 9.830
8.285
5.526
3.182
8.181
9.888
8.766
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
7lyc 1 P68431 100.0 2e-96 EM
 2021-06-16 ALA A:52 A:47 49.0 0.426 H -62.1 -42.5 9.0 0.078 0.348 B:P62805:0.348
 DC
DC
DT
DC
DG
DT
DG
 9.240
8.752
9.476
8.167
5.065
3.358
8.070
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA D:52 E:47 48.0 0.417 H -62.1 -42.5 9.0 0.078 0.339 E:P62805:0.339
 DT
DC
DC
DG
DC
DG
DT
DC
 9.470
8.002
5.444
3.189
7.999
9.411
9.572
8.848
 N
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
3azf 1 P68431 99.26 4e-96 X-RAY
 2011-09-21 ALA A:51 A:47 51.0 0.443 H -66.4 -44.7 9.0 0.078 0.365 B:P62805:0.365
 DC
DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.745
9.953
8.539
9.938
9.450
8.018
4.677
2.923
8.011
5.757
 CB
N
N
N
C
CB
CB
N
N
C
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -60.0 -48.3 10.0 0.087 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.680
8.230
4.654
2.869
8.185
9.769
9.849
8.807
5.807
 O
CB
CB
N
N
CB
N
N
N
 OP2
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
3aze 1 P68431 99.26 4e-96 X-RAY
 2011-09-21 ALA A:51 A:47 49.0 0.426 H -50.8 -47.0 8.0 0.07 0.356 B:P62805:0.357
 DC
DT
DT
DT
DC
DG
DA
DA
DC
 9.936
9.570
8.340
9.552
8.649
8.649
4.713
3.153
8.088
 CB
N
N
N
O
CB
N
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 47.0 0.409 H -64.3 -50.4 11.0 0.096 0.313 F:P62805:0.313
 DA
DT
DT
DG
DA
DA
DT
DG
 9.950
8.912
8.382
4.220
3.191
7.625
9.583
9.056
 N
N
CB
CB
N
N
CB
N
 OP1
OP1
O3'
O3'
OP1
OP2
OP1
OP1
3azh 1 P68431 99.26 4e-96 X-RAY
 2011-09-21 ALA A:51 A:47 47.0 0.409 H -64.2 -51.8 9.0 0.078 0.331 B:P62805:0.33
 DC
DT
DT
DT
DC
DG
DA
DA
DC
 9.458
9.674
8.472
9.776
9.707
8.106
4.532
2.976
7.558
 CB
N
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 54.0 0.47 H -45.2 -44.7 11.0 0.096 0.374 F:P62805:0.374
 DT
DT
DG
DA
DA
DT
DT
DG
 9.503
7.818
4.698
3.043
8.035
9.767
9.838
8.983
 N
CB
CB
N
N
CB
N
N
 OP2
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3azg 1 P68431 99.26 4e-96 X-RAY
 2011-09-21 ALA A:51 A:47 50.0 0.435 H -56.1 -47.7 9.0 0.078 0.357 B:P62805:0.357
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.736
8.597
9.995
9.221
8.103
4.678
3.002
8.097
8.073
 CB
N
N
C
CB
CB
N
N
CB
 OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 52.0 0.452 H -56.0 -49.4 11.0 0.096 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.614
8.123
4.718
3.055
7.937
9.873
9.995
8.785
4.731
 O
CB
CB
N
N
CB
N
N
CB
 OP2
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
3ayw 1 P68431 99.26 4e-96 X-RAY
 2011-09-21 ALA A:51 A:47 48.0 0.417 H -50.6 -60.1 5.0 0.043 0.374 B:P62805:0.374
 DT
DC
DG
DA
DA
DC
 8.791
8.871
8.379
4.879
2.950
7.778
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 50.0 0.435 H -53.8 -50.2 11.0 0.096 0.339 F:P62805:0.339
 DT
DT
DG
DA
DA
DT
DT
DG
 9.180
8.441
4.592
2.880
7.947
9.840
9.880
9.024
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3x1s 1 P68431 100.0 7e-96 X-RAY
 2015-09-23 ALA A:47 A:47 49.0 0.426 H -62.8 -52.4 10.0 0.087 0.339 B:P62805:0.339
 DC
DT
DT
DC
DG
DA
DA
DC
 9.965
9.646
8.646
9.266
8.344
5.039
3.070
7.995
 CB
N
N
N
CB
N
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 50.0 0.435 H -63.2 -52.7 11.0 0.096 0.339 F:P62805:0.339
 DA
DT
DT
DG
DA
DA
DT
DG
 9.706
9.039
8.241
4.981
3.004
7.969
9.571
8.806
 N
O
CB
CB
N
N
CB
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
3x1t 2 P68431 100.0 7e-96 X-RAY
 2015-09-23 ALA C:47 A:47 50.0 0.435 H -60.7 -50.0 9.0 0.078 0.357 D:P62805:0.357
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.899
9.966
8.958
8.966
8.217
4.968
3.036
7.947
9.338
 CB
N
N
C
CB
CB
N
N
O
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 53.0 0.461 H -61.6 -50.5 10.0 0.087 0.374 H:P62805:0.374
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.987
9.195
8.265
4.849
3.059
7.959
9.562
8.586
3.938
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
3x1u 2 P68431 100.0 7e-96 X-RAY
 2015-09-23 ALA C:47 A:47 41.0 0.357 H -48.7 -56.4 3.0 0.026 0.331 D:P62805:0.33
 DT
DT
DC
DG
DA
DA
DC
 9.696
8.973
9.181
8.526
5.225
3.039
7.605
 C
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA G:47 E:47 45.0 0.391 H -50.4 -55.6 6.0 0.052 0.339 H:P62805:0.339
 DT
DT
DG
DA
DA
DT
DG
 9.240
8.355
5.124
3.070
8.498
9.575
8.696
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
C5'
OP1
3x1v 2 P68431 100.0 7e-96 X-RAY
 2015-09-23 ALA C:47 A:47 47.0 0.409 H -58.6 -48.8 6.0 0.052 0.357 D:P62805:0.357
 DC
DT
DT
DT
DC
DG
DA
DA
DC
 9.834
8.978
8.675
9.995
9.046
8.455
5.156
3.035
7.991
 CB
C
N
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA G:47 E:47 50.0 0.435 H -60.7 -48.2 10.0 0.087 0.348 H:P62805:0.348
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.926
8.688
8.347
4.978
3.001
8.293
9.989
8.833
4.470
 N
O
CB
N
N
N
CB
N
CA
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5gsu 1 P68431 100.0 7e-96 X-RAY
 2017-02-15 ALA A:47 A:47 43.0 0.374 H -59.1 -53.7 6.0 0.052 0.322 C:P62805:0.322
 DC
DT
DT
DC
DG
DA
DA
DC
 9.720
9.950
8.915
9.155
8.134
4.908
2.915
8.159
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA B:47 E:47 46.0 0.4 H -59.9 -53.5 7.0 0.061 0.339 D:P62805:0.339
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.984
8.949
8.352
4.926
3.099
8.072
9.759
9.984
8.660
 N
O
CB
N
N
N
CB
C
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
5gt0 1 P68431 100.0 7e-96 X-RAY
 2017-02-15 ALA A:47 A:47 48.0 0.417 H -58.8 -50.2 8.0 0.07 0.347 C:P62805:0.348
 DC
DT
DT
DC
DG
DA
DA
DC
 9.944
9.723
8.534
9.157
8.038
4.727
2.877
7.899
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA B:47 E:47 52.0 0.452 H -57.8 -47.0 10.0 0.087 0.365 D:P62805:0.365
 DT
DT
DG
DA
DA
DT
DG
 9.255
8.059
4.820
2.836
7.988
9.864
8.901
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
5gt3 1 P68431 100.0 7e-96 X-RAY
 2017-02-15 ALA A:47 A:47 53.0 0.461 H -55.2 -46.6 12.0 0.104 0.357 B:P62805:0.357
 DC
DT
DC
DG
DA
DA
DC
 9.855
8.958
9.215
8.159
4.942
2.986
8.351
 CB
N
C
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 55.0 0.478 H -54.7 -47.1 12.0 0.104 0.374 F:P62805:0.374
 DT
DT
DG
DA
DA
DT
DG
 9.059
8.299
4.795
2.932
8.047
9.701
8.822
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
7bwd 5 P68431 100.0 7e-96 EM
 2021-04-14 ALA E:47 E:47 47.0 0.409 H -66.7 -31.9 10.0 0.087 0.322 B:P62805:0.322
 DC
DG
DT
DC
DG
DT
DG
 9.475
9.761
9.523
9.431
6.052
4.182
7.788
 N
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA F:47 A:47 51.0 0.443 H -65.4 -42.8 8.0 0.07 0.373 I:P62805:0.374
 DT
DC
DC
DG
DC
DC
 9.431
9.550
5.709
3.919
8.031
9.188
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6t90 5 P68431 100.0 2e-95 EM
 2020-05-06 ALA E:51 E:48 49.0 0.426 H -59.4 -39.4 9.0 0.078 0.348 F:P62805:0.348
 DC
DC
DG
DC
DG
 8.846
5.764
3.967
8.715
9.266
 CB
N
N
N
CB
 O3'
O3'
OP1
OP2
OP1
6yov 5 P68431 100.0 2e-95 EM
 2020-05-06 ALA E:51 E:48 60.0 0.522 H -55.8 -40.7 9.0 0.078 0.444 F:P62805:0.443
 DC
DC
DG
DC
DG
 7.965
5.069
3.358
7.823
9.537
 CB
CB
N
N
CB
 O3'
O3'
OP1
OP2
OP1
1eqz 4 P84229 99.26 2e-95 X-RAY
 2000-04-17 ALA E:48 C:47 52.0 0.452 H -58.1 -49.3 8.0 0.07 0.382 F:P62801:0.383
 DC
DT
DG
DT
DG
DA
DA
DC
HOH
 9.631
9.876
8.682
9.008
8.157
4.722
3.121
7.950
4.263
 CB
N
N
O
CB
N
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA I:48 G:47 50.0 0.435 H -61.2 -43.0 12.0 0.104 0.331 J:P62801:0.33
 DT
DT
DG
DA
DA
DT
DG
HOH
 9.191
8.006
4.599
3.013
7.875
9.875
8.645
3.496
 O
CB
CB
N
N
N
N
CB
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
O
1hq3 3 P84229 99.26 2e-95 X-RAY
 2001-01-24 ALA C:48 C:47 43.0 0.374 H -59.1 -54.7 3.0 0.026 0.348 D:P62801:0.348
 PO4
CL
HOH
 7.988
5.855
6.230
 N
CB
CB
 O4
CL
O
ALA G:48 G:47 47.0 0.409 H -55.5 -46.3 2.0 0.017 0.392 H:P62801:0.391
 CL
HOH
 5.716
4.263
 CB
CB
 CL
O
1tzy 3 P84229 99.26 2e-95 X-RAY
 2004-08-03 ALA C:48 C:47 43.0 0.374 H -66.4 -44.3 4.0 0.035 0.339 D:P62801:0.339
 PO4
CL
HOH
 6.310
5.776
3.794
 O
CB
CB
 O1
CL
O
ALA G:48 G:47 43.0 0.374 H -55.2 -46.4 2.0 0.017 0.357 H:P62801:0.357
 CL
HOH
 5.826
3.904
 CB
N
 CL
O
2aro 3 P84229 99.26 2e-95 X-RAY
 2005-08-30 ALA C:48 C:47 43.0 0.374 H -51.4 -51.5 2.0 0.017 0.357 D:P62801:0.357
 PO4
CL
HOH
 7.664
5.874
6.967
 O
CB
O
 O3
CL
O
ALA G:48 G:47 46.0 0.4 H -49.4 -50.4 4.0 0.035 0.365 H:P62801:0.365
 CL
HOH
 5.874
4.836
 CB
CA
 CL
O
2f8n 2 P84233 99.26 2e-95 X-RAY
 2006-05-23 ALA C:48 A:447 43.0 0.374 H -61.0 -47.9 7.0 0.061 0.313 D:P62799:0.313
 DT
DG
DA
DT
DG
DA
DA
DC
HOH
 9.952
8.919
9.900
9.286
8.171
4.734
2.901
7.793
3.831
 N
N
N
O
CB
CB
N
N
CB
 O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA F:48 E:647 49.0 0.426 H -57.1 -48.7 10.0 0.087 0.339 G:P62799:0.339
 DA
DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.823
9.064
8.229
4.825
2.844
7.883
9.705
9.741
8.937
7.893
 N
O
CB
N
N
N
CB
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
2hio 3 P84229 99.26 2e-95 X-RAY
 2000-01-12 ALA C:48 C:47 39.0 0.339 H -55.8 -60.6 6.0 0.052 0.287 D:P62801:0.287
4kgc 1 P84233 99.26 2e-95 X-RAY
 2014-03-26 ALA A:48 A:47 48.0 0.417 H -58.9 -57.4 7.0 0.061 0.356 B:P62799:0.357
 DC
DG
DT
DG
DA
DA
DC
 9.733
8.783
9.253
8.223
4.713
3.037
7.850
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 52.0 0.452 H -57.2 -47.2 9.0 0.078 0.374 F:P62799:0.374
 DT
DG
DA
DA
DC
DC
DT
DG
 9.306
8.155
4.695
3.089
8.064
9.852
9.781
8.699
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
4ld9 1 P84233 99.26 2e-95 X-RAY
 2013-08-14 ALA A:48 A:47 47.0 0.409 H -42.6 -54.3 7.0 0.061 0.348 B:P62799:0.348
 DG
DA
DT
DC
DC
DG
DC
 9.141
9.780
9.024
8.353
5.323
3.661
8.239
 N
N
O
CB
CB
N
N
 OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 43.0 0.374 H -55.1 -53.7 9.0 0.078 0.296 F:P62799:0.296
 DG
DT
DC
DG
DT
DG
DC
DG
 9.770
9.108
8.633
5.212
3.527
8.297
9.892
9.180
 N
O
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
4uuz 1 P02299 99.26 2e-95 X-RAY
 2015-02-11 ALA A:48 NA:NA DO NA DO DO DO NA NA NA
5kgf 1 P84233 99.26 2e-95 EM
 2016-07-27 ALA A:48 A:47 33.0 0.287 H -51.4 -50.5 1.0 0.009 0.278 B:P62799:0.278
 DG
DG
DT
DC
DG
DT
DG
 9.333
9.857
8.543
8.541
5.131
3.452
8.126
 N
N
O
CB
N
N
N
 OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 38.0 0.33 H -51.5 -50.3 3.0 0.026 0.304 F:P62799:0.304
 DT
DC
DC
DG
DC
DG
 8.619
8.862
5.355
3.651
8.271
9.480
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
5x0x 1 P84233 99.26 2e-95 EM
 2017-04-19 ALA A:48 A:47 41.0 0.357 H -53.1 -62.3 9.0 0.078 0.279 B:P62799:0.278
 DA
DT
DC
DC
DG
DC
DC
 9.988
8.708
8.697
5.188
3.164
7.934
8.886
 O
O
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
ALA E:48 E:47 41.0 0.357 H -53.1 -62.3 9.0 0.078 0.279 F:P62799:0.278
 DG
DC
DG
DT
DG
 8.929
9.050
5.219
3.271
8.122
 N
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
6dzt 1 P02299 99.26 2e-95 EM
 2019-05-22 ALA A:48 A:47 46.0 0.4 H -67.1 -42.6 10.0 0.087 0.313 B:P84040:0.313
 DG
DT
DC
DT
DC
DC
DG
DC
 9.493
9.960
8.662
9.312
8.058
5.320
3.321
7.847
 CB
N
N
O
CB
CB
N
N
 OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 51.0 0.443 H -66.0 -45.1 10.0 0.087 0.356 F:P84040:0.357
 DT
DC
DG
DT
DG
DC
DC
DC
 9.425
8.053
5.023
3.278
7.793
9.383
9.852
8.729
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
6kw3 2 P84233 99.26 2e-95 EM
 2019-11-13 ALA B:48 N:47 47.0 0.409 H -65.8 -49.3 8.0 0.07 0.339 A:P62799:0.339
 DC
DC
DG
DC
DT
DC
 9.245
6.466
4.151
8.656
8.398
9.781
 CB
N
N
N
N
N
 O3'
O3'
OP1
OP2
OP1
OP1
ALA D:48 Q:47 40.0 0.348 H -70.7 -27.7 9.0 0.078 0.27 E:P62799:0.27
 DC
DG
DT
DG
 9.882
5.072
3.098
7.480
 CB
CB
N
N
 O3'
O3'
OP1
OP2
6kw4 1 P84233 99.26 2e-95 EM
 2019-11-13 ALA A:48 N:47 42.0 0.365 H -70.7 -41.9 10.0 0.087 0.278 B:P62799:0.278
 DC
DC
DG
DC
DT
DC
 9.448
7.492
6.269
9.049
9.602
9.326
 CB
CB
N
N
N
N
 O3'
OP1
OP1
OP2
OP1
OP1
ALA D:48 Q:47 45.0 0.391 H -71.3 -34.6 6.0 0.052 0.339 E:P62799:0.339
 DC
DG
DT
DG
 8.811
6.703
4.910
8.932
 CB
CB
N
N
 O3'
OP1
OP1
OP2
6kw5 16 P84233 99.26 2e-95 EM
 2020-09-09 ALA Q:48 R:47 49.0 0.426 H -59.2 -52.5 7.0 0.061 0.365 R:P62799:0.365
 DT
DC
DC
DG
DC
DG
DG
DT
DC
 9.265
9.188
5.784
3.663
8.689
9.961
8.767
8.628
7.620
 O
CB
N
N
N
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
C5'
OP1
ALA T:48 V:47 49.0 0.426 H -63.5 -47.7 9.0 0.078 0.348 N:P62799:0.348
 DC
DT
DC
DG
DT
DG
 9.371
9.433
9.074
6.470
4.325
8.455
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
6o22 4 P84233 99.26 2e-95 NMR
SOLUTION SCATTERING
 2019-07-31 ALA E:48 NA:NA DO NA DO DO DO NA NA NA
6pwe 1 P02299 99.26 2e-95 EM
 2019-08-21 ALA A:48 A:47 48.0 0.417 G -63.4 -38.3 11.0 0.096 0.321 B:A0A0B4KFZ9:0.322
 DT
DC
DT
DC
DC
DG
DC
 9.673
9.012
9.698
9.013
5.432
3.868
8.539
 N
N
O
CB
N
N
N
 O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 47.0 0.409 G -63.3 -38.2 10.0 0.087 0.322 F:A0A0B4KFZ9:0.322
 DC
DG
DT
DG
DC
DC
 8.982
5.519
3.460
8.281
9.652
8.874
 CB
N
N
N
C
N
 O3'
O3'
OP1
OP2
OP1
OP1
6pwf 1 P02299 99.26 2e-95 EM
 2019-08-21 ALA A:48 A:47 60.0 0.522 T -64.5 -18.7 17.0 0.148 0.374 B:A0A0B4KFZ9:0.374
 DG
DC
DC
DC
DG
DC
 9.479
9.746
8.111
5.129
3.387
7.902
 CB
N
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP2
OP2
ALA E:48 E:47 60.0 0.522 T -64.5 -18.7 18.0 0.157 0.365 F:A0A0B4KFZ9:0.365
 DC
DG
DT
DG
DC
DC
 8.328
5.037
3.428
7.925
8.630
9.328
 CB
CB
N
N
CB
N
 O3'
O3'
OP1
OP2
OP1
OP1
6wkr 9 P84233 99.26 2e-95 EM
 2021-02-03 ALA I:48 I:47 41.0 0.357 H -55.6 -63.3 9.0 0.078 0.279 J:P62799:0.278
 DC
DA
DC
DC
DC
DG
 9.304
8.988
9.379
5.060
3.812
8.056
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP2
OP2
ALA M:48 O:47 41.0 0.357 H -55.5 -52.5 7.0 0.061 0.296 N:P62799:0.296
 DA
DG
DT
DG
DC
DC
 9.677
9.166
5.822
3.835
8.288
9.616
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
7jo9 1 Q71DI3 99.26 2e-95 EM
 2020-09-16 ALA A:48 A:47 54.0 0.47 H -59.6 -49.7 14.0 0.122 0.348 B:P62805:0.348
 DC
DT
DC
DC
DG
DC
 9.441
9.883
8.747
5.729
3.739
8.278
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 61.0 0.53 H -63.3 -44.4 11.0 0.096 0.434 F:P62805:0.435
 DC
DG
DT
DG
DC
 8.872
5.423
3.638
8.199
9.477
 CB
N
N
N
N
 O3'
O3'
OP1
OP2
OP1
7joa 1 Q71DI3 99.26 2e-95 EM
 2020-09-16 ALA A:48 A:47 51.0 0.443 H -60.4 -42.9 13.0 0.113 0.33 B:P62805:0.33
 DC
DC
DC
DG
DC
 9.115
8.859
5.735
3.831
8.251
 N
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 54.0 0.47 H -60.7 -43.3 12.0 0.104 0.366 F:P62805:0.365
 DC
DG
DT
DG
DC
DC
 8.842
5.658
3.801
8.146
9.925
9.034
 CB
N
N
N
CB
N
 O3'
O3'
OP1
OP2
OP1
OP1
7kbd 1 P84233 99.26 2e-95 EM
 2021-09-15 ALA A:48 A:47 50.0 0.435 H -62.3 -48.7 13.0 0.113 0.322 B:P62799:0.322
 DG
DT
DG
DT
DC
DC
DG
DC
 9.276
9.726
8.718
8.812
8.442
5.428
3.401
7.979
 CB
N
N
O
CB
N
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 51.0 0.443 H -62.3 -48.6 11.0 0.096 0.347 F:P62799:0.348
 DT
DC
DG
DT
DG
DC
DG
 9.494
8.319
5.253
3.185
7.922
9.598
8.783
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
7kbe 1 P84233 99.26 2e-95 EM
 2021-09-15 ALA A:48 A:47 39.0 0.339 H -61.5 -45.1 7.0 0.061 0.278 B:P62799:0.278
 DG
DG
DT
DC
DC
DG
DC
 9.569
8.850
9.738
8.171
5.423
3.412
8.106
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 46.0 0.4 H -62.9 -43.5 9.0 0.078 0.322 F:P62799:0.322
 DT
DC
DG
DT
DG
DT
DG
 9.703
8.593
5.344
3.281
7.898
9.782
9.005
 O
CB
N
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
C5'
OP1
7kbf 1 P84233 99.26 2e-95 EM
 2021-09-15 ALA A:48 A:47 52.0 0.452 H -56.2 -68.2 11.0 0.096 0.356 B:P62799:0.357
 DG
DT
DC
DG
DT
DG
 8.416
8.786
8.857
5.146
3.244
7.591
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP2
OP2
ALA E:48 E:47 37.0 0.322 H -50.4 -46.8 11.0 0.096 0.226 F:P62799:0.226
 DA
DT
DC
DG
DT
DG
DG
 9.915
8.808
8.489
5.083
3.663
7.517
8.622
 N
O
CB
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
3av1 1 Q71DI3 99.26 2e-95 X-RAY
 2011-06-01 ALA A:51 A:47 53.0 0.461 H -62.5 -47.3 11.0 0.096 0.365 B:P62805:0.365
 DC
DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.694
9.819
8.679
10.000
9.204
7.981
4.541
2.869
7.949
7.578
 CB
N
N
N
N
CB
CB
N
N
CB
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 52.0 0.452 H -58.6 -47.6 11.0 0.096 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.393
8.105
4.821
3.060
8.004
9.834
9.985
8.764
4.488
 O
CB
N
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5b0z 1 Q71DI3 99.26 2e-95 X-RAY
 2016-01-27 ALA A:51 A:47 51.0 0.443 H -58.5 -47.7 9.0 0.078 0.365 B:P62805:0.365
 DC
DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.978
9.592
8.668
9.995
8.980
8.218
4.905
3.199
7.939
3.903
 CB
C
N
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 49.0 0.426 H -60.3 -43.7 9.0 0.078 0.348 F:P62805:0.348
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.629
8.574
8.238
4.864
3.106
7.954
9.822
9.927
8.703
3.709
 N
O
CB
N
N
N
CB
N
N
CA
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5b1l 1 ? 97.79 5e-95 X-RAY
 2017-02-15 ALA A:51 A:47 49.0 0.426 H -56.2 -48.8 8.0 0.07 0.356 B:P62806:0.357
 DC
DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.669
9.574
8.665
9.809
9.074
8.109
4.861
3.074
8.138
6.032
 CB
C
N
N
N
CB
CB
N
N
C
 OP1
OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 51.0 0.443 H -54.1 -48.2 11.0 0.096 0.347 F:P62806:0.348
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.718
8.757
8.147
4.829
3.046
8.008
9.520
9.930
8.821
4.062
 N
O
CB
N
N
N
CB
N
N
CA
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
7e8d 1 P68431 99.26 6e-95 EM
 2021-11-10 ALA A:47 A:47 52.0 0.452 H -64.3 -42.9 11.0 0.096 0.356 B:P62805:0.357
 DT
DC
DC
DG
DC
DC
 9.403
8.041
5.162
2.975
7.661
8.754
 N
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
ALA E:47 E:47 50.0 0.435 H -63.3 -44.3 11.0 0.096 0.339 F:P62805:0.339
 DC
DC
DG
DT
DG
 9.225
8.151
5.108
3.295
7.725
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
6g0l 1 Q92133 98.53 7e-95 EM
 2018-08-22 ALA A:48 A:47 47.0 0.409 H -76.4 -38.4 10.0 0.087 0.322 B:P62799:0.322
 DC
DG
DT
DG
 8.616
5.166
3.534
8.145
 CB
CB
N
N
 O3'
O3'
OP1
OP2
ALA E:48 E:47 60.0 0.522 T -20.8 -57.0 20.0 0.174 0.348 F:P62799:0.348
 DC
DC
DG
DC
DG
DG
 9.581
4.566
2.308
7.208
8.940
7.883
 CB
CB
N
N
CB
CB
 O3'
O3'
OP1
OP2
C5'
OP1
6vz4 1 Q92133 98.53 7e-95 EM
 2020-12-02 ALA A:48 A:48 44.0 0.383 H -55.5 -46.3 7.0 0.061 0.322 B:P62799:0.322
 DT
DC
DC
DG
DC
DG
DT
DC
 9.817
8.823
6.123
3.977
8.397
9.722
9.753
9.374
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
ALA E:48 E:48 44.0 0.383 H -56.1 -44.1 10.0 0.087 0.296 F:P62799:0.296
 DC
DC
DC
DG
DT
DG
 9.761
8.817
8.681
5.627
3.882
8.125
 CB
N
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
5b0y 1 Q71DI3 98.53 9e-95 X-RAY
 2016-01-27 ALA A:48 A:47 50.0 0.435 H -61.1 -47.6 10.0 0.087 0.348 B:P62805:0.348
 DT
DT
DC
DG
DA
DA
DC
 9.944
8.701
9.178
8.051
4.778
2.989
8.017
 N
N
O
CB
CB
N
N
 O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 53.0 0.461 H -61.6 -45.8 12.0 0.104 0.357 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DG
HOH
 9.276
8.112
4.740
3.080
8.099
9.797
8.850
9.732
 O
CB
N
N
N
CB
N
O
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
3lel 1 P84233 98.53 1e-94 X-RAY
 2010-05-19 ALA A:48 A:47 42.0 0.365 H -45.3 -57.9 6.0 0.052 0.313 B:P62799:0.313
 DT
DG
DT
DA
DG
DA
DA
 9.881
9.084
9.099
8.456
4.941
3.275
7.973
 C
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 48.0 0.417 H -48.9 -61.5 8.0 0.07 0.347 F:P62799:0.348
 DA
DT
DA
DG
DA
DA
DG
 9.949
8.942
8.423
4.820
3.261
7.836
8.674
 N
O
CB
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
ALA K:48 K:47 50.0 0.435 H -64.7 -55.0 NA NA NA
ALA O:48 O:47 47.0 0.409 H -61.8 -61.4 NA NA NA
4zux 1 P84233 98.53 1e-94 X-RAY
 2016-02-24 ALA A:48 A:47 46.0 0.4 H -63.4 -57.0 8.0 0.07 0.33 B:P62799:0.33
 DG
DT
DC
DG
DT
DG
 8.911
9.806
8.307
4.304
2.577
7.420
 N
O
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 47.0 0.409 H -57.0 -56.9 7.0 0.061 0.348 F:P62799:0.348
 DT
DC
DC
DG
DC
DG
DT
DG
 9.535
7.777
4.026
2.382
7.355
8.901
9.587
8.782
 N
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA K:48 K:47 50.0 0.435 H -63.3 -57.4 NA NA NA
ALA O:48 O:47 48.0 0.417 H -63.6 -57.0 NA NA NA
5e5a 2 P84233 98.53 1e-94 X-RAY
 2016-02-03 ALA C:48 A:47 48.0 0.417 H -58.7 -46.0 9.0 0.078 0.339 D:P62799:0.339
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.450
8.796
9.343
8.119
4.820
3.132
7.984
5.992
 CB
N
C
CB
CB
N
N
C
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:48 E:47 50.0 0.435 H -60.0 -44.4 13.0 0.113 0.322 H:P62799:0.322
 DT
DT
DG
DA
DA
DG
DG
HOH
 9.288
8.276
4.862
3.000
7.833
9.772
8.701
5.875
 C
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5o9g 1 P84233 98.53 1e-94 EM
 2017-10-11 ALA A:48 A:47 47.0 0.409 H -62.8 -41.4 10.0 0.087 0.322 B:P62799:0.322
 DC
DG
DT
DG
 9.660
6.287
4.602
9.384
 CB
CB
N
N
 O3'
O3'
OP1
OP2
ALA E:48 E:47 48.0 0.417 H -63.8 -34.9 7.0 0.061 0.356 F:P62799:0.357
 DT
DC
DC
DG
DC
DG
 8.987
8.560
6.482
4.267
9.299
9.944
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6i84 1 P84233 98.53 1e-94 EM
 2019-01-02 ALA A:48 M:47 58.0 0.504 H -63.4 -52.8 13.0 0.113 0.391 F:P62799:0.391
 DT
DC
DG
DT
DG
 9.638
9.870
5.852
4.273
7.582
 O
CB
CB
N
N
 OP1
O3'
O3'
OP2
OP2
ALA H:48 S:47 57.0 0.496 H -66.3 -30.2 14.0 0.122 0.374 I:P62799:0.374
 DC
DC
DG
DC
DT
DG
 8.838
6.344
4.966
8.231
5.978
7.892
 CB
N
N
N
C
N
 O3'
O3'
OP2
O3'
OP1
OP1
6j99 1 A0A310TTQ1 98.53 1e-94 EM
 2019-02-27 ALA A:48 A:47 48.0 0.417 H -66.6 -64.6 5.0 0.043 0.374 B:P62799:0.374
 DA
DC
DC
DC
DT
DC
DG
DT
DG
 9.909
9.741
9.454
9.959
8.980
8.410
5.749
6.643
9.119
 CB
CB
N
N
O
CB
CB
N
N
 O3'
OP1
OP1
OP1
OP1
O3'
C5'
O5'
OP2
ALA E:48 E:47 48.0 0.417 H -66.6 -64.6 5.0 0.043 0.374 F:P62799:0.374
 DT
DC
DC
DG
DC
DG
DT
DC
 8.909
8.983
5.707
3.366
7.766
9.964
9.414
8.709
 O
CB
N
N
N
CB
C
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
6ne3 1 P84233 98.53 1e-94 EM
 2019-07-17 ALA A:48 A:47 52.0 0.452 H -61.3 -45.0 13.0 0.113 0.339 B:P62799:0.339
 DC
DT
DG
DT
DA
DC
DG
 9.981
9.767
8.665
8.656
5.063
3.271
7.944
 CB
C
N
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 52.0 0.452 H -65.8 -37.5 11.0 0.096 0.356 F:P62799:0.357
 DC
DG
DC
DG
DT
DC
 9.234
8.510
5.220
3.331
7.758
9.116
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6pwv 4 P84233 98.53 1e-94 EM
 2019-12-18 ALA D:48 G:47 56.0 0.487 H -62.8 -33.1 24.0 0.209 0.278 E:P62799:0.278
 DA
DT
DC
DC
DG
DC
DC
 9.523
9.459
7.833
4.671
2.963
7.376
9.552
 N
O
CB
CB
N
N
N
 C5'
OP1
O3'
C3'
OP2
OP2
OP1
ALA H:48 K:47 54.0 0.47 H -62.8 -33.1 21.0 0.183 0.287 I:P62799:0.287
 DC
DC
DG
DT
DC
DG
DT
DG
 9.991
8.589
9.319
9.360
8.082
4.461
2.736
6.926
 N
N
N
O
CB
CB
N
N
 O3'
OP1
C5'
OP1
O3'
C3'
OP2
OP2
6pww 4 P84233 98.53 1e-94 EM
 2019-12-18 ALA D:48 G:47 52.0 0.452 H -64.9 -34.6 16.0 0.139 0.313 E:P62799:0.313
 DA
DT
DC
DC
DG
DC
DC
 9.435
9.690
8.018
4.544
3.165
7.304
9.506
 N
O
CB
CB
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
OP1
ALA H:48 K:47 53.0 0.461 H -64.9 -34.5 16.0 0.139 0.322 M:P62799:0.322
 DC
DC
DG
DT
DC
DG
DT
DG
 9.807
8.655
9.395
9.495
8.255
4.661
3.001
7.167
 N
N
N
O
CB
CB
N
N
 O3'
OP1
C5'
OP1
O3'
C3'
OP2
OP2
6pwx 2 P84233 98.53 1e-94 EM
 2019-12-18 ALA B:48 G:47 53.0 0.461 H -63.1 -43.5 12.0 0.104 0.357 C:P62799:0.357
 DA
DT
DC
DC
DG
DC
DT
DC
 9.713
9.013
8.525
5.002
3.661
7.255
9.725
9.025
 N
O
CB
CB
N
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
C5'
OP1
ALA F:48 K:47 54.0 0.47 H -63.1 -43.5 11.0 0.096 0.374 K:P62799:0.374
 DC
DC
DC
DG
DT
DC
DG
DT
DG
 9.897
9.492
8.514
9.886
8.953
8.443
4.654
3.232
7.240
 CB
N
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP2
OP2
6ryr 1 P84233 98.53 1e-94 EM
 2020-07-15 ALA A:48 A:47 46.0 0.4 H -59.3 -43.4 8.0 0.07 0.33 B:P62799:0.33
 DC
DC
DT
DC
DG
DT
DG
 9.826
9.963
9.569
8.387
5.194
3.330
8.033
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 46.0 0.4 H -61.3 -44.8 4.0 0.035 0.365 F:P62799:0.365
 DT
DC
DC
DG
DC
DT
 8.763
8.659
5.442
3.588
7.926
9.497
 N
CB
CB
N
N
C
 OP1
O3'
O3'
OP1
OP2
OP1
6ryu 1 P84233 98.53 1e-94 EM
 2020-07-15 ALA A:48 A:47 49.0 0.426 H -69.9 -30.4 9.0 0.078 0.348 B:P62799:0.348
 DC
DG
DT
DC
DG
DT
DG
 9.910
9.351
8.462
8.689
5.611
3.835
7.831
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 48.0 0.417 H -65.8 -34.7 8.0 0.07 0.347 F:P62799:0.348
 DT
DC
DC
DG
DC
DT
DG
 9.528
8.934
5.598
3.891
7.673
9.953
9.141
 N
CB
N
N
N
N
N
 OP1
O3'
O3'
OP2
OP2
O3'
OP1
6w5i 5 P84233 98.53 1e-94 EM
 2021-03-31 ALA E:48 G:47 55.0 0.478 H -62.8 -33.2 22.0 0.191 0.287 F:P62799:0.287
 DC
DC
DG
DC
DC
 7.360
4.180
2.816
7.764
9.307
 CB
N
N
N
N
 O3'
O3'
OP1
OP2
OP1
ALA I:48 K:47 55.0 0.478 H -62.8 -33.2 21.0 0.183 0.295 J:P62799:0.296
 DC
DG
DT
DC
DG
DT
DG
 8.813
9.964
9.955
7.767
4.544
2.833
7.510
 N
N
O
CB
CB
N
N
 OP1
C5'
OP1
O3'
C3'
OP2
OP2
6w5m 5 P84233 98.53 1e-94 EM
 2021-03-31 ALA E:48 G:47 55.0 0.478 H -62.9 -33.0 20.0 0.174 0.304 F:P62799:0.304
 DT
DC
DC
DG
DC
DC
 9.963
7.625
4.561
3.155
7.907
9.538
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP2
OP2
OP1
ALA I:48 K:47 55.0 0.478 H -62.9 -33.0 22.0 0.191 0.287 J:P62799:0.287
 DC
DG
DT
DC
DG
DT
DG
 8.596
9.700
9.635
7.844
4.458
2.643
7.179
 N
N
O
CB
CB
N
N
 OP1
C5'
OP1
O3'
C3'
OP2
OP2
6w5n 5 P84233 98.53 1e-94 EM
 2021-03-31 ALA E:48 G:47 54.0 0.47 H -62.8 -33.1 15.0 0.13 0.34 F:P62799:0.339
 DC
DC
DG
DC
DC
 7.516
4.583
3.168
8.106
9.577
 CB
N
N
N
N
 O3'
O3'
OP2
OP2
OP1
ALA I:48 K:47 54.0 0.47 H -62.9 -33.0 20.0 0.174 0.296 J:P62799:0.296
 DC
DC
DG
DT
DG
 8.620
7.538
4.321
2.729
7.550
 N
CB
N
N
N
 OP1
O3'
O3'
OP2
OP2
7nkx 11 P84233 98.53 1e-94 EM
 2021-08-25 ALA K:48 NA:NA DO NA DO DO DO NA NA NA
ALA O:48 e:47 49.0 0.426 H -63.4 -46.8 10.0 0.087 0.339 P:P62799:0.339
 DT
DC
DC
DG
DC
DG
DT
 9.313
8.560
4.980
3.630
6.539
9.830
9.888
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP2
OP2
OP1
OP1
7nky 20 P84233 98.53 1e-94 EM
 2021-07-07 ALA T:48 a:47 72.0 0.626 H -58.3 -41.2 32.0 0.278 0.348 U:P62799:0.348
 DC
DG
DT
DG
DA
DC
 8.104
3.917
2.824
7.490
9.694
9.400
 CB
CB
N
N
CB
CB
 O3'
O3'
OP1
OP2
C5'
OP1
ALA X:48 e:47 48.0 0.417 H -63.5 -42.1 9.0 0.078 0.339 Y:P62799:0.339
 DT
DG
DT
DC
DC
DG
DC
 9.787
8.665
9.502
8.120
4.693
2.910
7.857
 N
N
N
CB
CB
N
N
 O3'
OP1
OP1
O3'
O3'
OP1
OP2
6t79 1 Q71DI3 98.53 1e-94 EM
 2020-04-29 ALA A:48 A:47 49.0 0.426 H -63.1 -44.1 5.0 0.043 0.383 B:P62805:0.383
 DG
DA
DC
DC
DA
DA
DC
DA
 9.702
9.763
8.607
9.848
8.003
4.663
2.780
7.820
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 42.0 0.365 H -64.2 -42.7 7.0 0.061 0.304 F:P62805:0.304
 DA
DT
DT
DA
DT
DA
DG
DA
 9.769
8.089
5.135
3.243
7.854
9.872
9.761
8.666
 N
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
6t7a 1 Q71DI3 98.53 1e-94 EM
 2020-04-29 ALA A:48 A:47 37.0 0.322 H -67.7 -36.0 3.0 0.026 0.296 B:P62805:0.296
 DG
DA
DA
DC
DA
 9.117
8.643
5.347
3.398
8.156
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 54.0 0.47 H -64.2 -36.7 10.0 0.087 0.383 F:P62805:0.383
 DT
DT
DA
DT
DA
 8.184
5.058
2.992
7.873
9.762
 CB
CB
N
N
CB
 O3'
O3'
OP1
OP2
OP1
6t7b 1 Q71DI3 98.53 1e-94 EM
 2020-04-29 ALA A:48 A:47 50.0 NA H -67.7 -36.1 43.0 NA NA B:P62805:NA
 DA
DA
DC
DA
 9.839
5.574
3.399
8.157
 CA
N
N
N
 O3'
O3'
OP1
OP2
ALA E:48 E:47 54.0 NA H -64.3 -36.7 41.0 NA NA F:P62805:NA
 DT
DT
DA
DT
 9.495
5.243
2.991
7.873
 CA
N
N
N
 O3'
O3'
OP1
OP2
6t7c 1 Q71DI3 98.53 1e-94 EM
 2020-04-29 ALA A:48 A:47 35.0 0.304 H -67.4 -35.6 3.0 0.026 0.278 B:P62805:0.278
 DG
DA
DA
DC
DA
 9.249
8.648
5.375
3.416
8.189
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 54.0 0.47 H -63.9 -36.8 10.0 0.087 0.383 F:P62805:0.383
 DT
DT
DA
DT
DA
 8.238
5.101
3.002
7.846
9.799
 CB
CB
N
N
CB
 O3'
O3'
OP1
OP2
OP1
6t7d 1 Q71DI3 98.53 1e-94 EM
 2020-04-29 ALA A:48 A:47 54.0 NA H -63.4 -47.8 54.0 NA NA DA
DC
DA
 5.442
3.378
7.787
 N
N
N
 O3'
OP1
OP2
ALA E:48 E:47 52.0 NA H -66.8 -40.6 45.0 NA NA F:P62805:NA
 DC
DA
DT
DA
DT
DG
DG
 9.789
8.678
6.319
3.912
8.020
8.848
8.551
 N
N
N
N
N
N
N
 O3'
OP1
O3'
OP1
OP2
C5'
OP1
3a6n 1 Q16695 97.06 1e-94 X-RAY
 2010-05-26 ALA A:51 A:47 49.0 0.426 H -56.6 -47.9 10.0 0.087 0.339 B:P62805:0.339
 DC
DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.470
9.888
8.844
9.954
9.152
8.046
4.686
2.965
7.880
6.906
 CB
N
N
N
C
CB
CB
N
N
CA
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 50.0 0.435 H -55.7 -49.1 10.0 0.087 0.348 F:P62805:0.348
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.905
9.393
8.100
4.694
2.984
7.893
9.462
9.810
8.755
5.897
 N
O
CB
CB
N
N
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5b40 1 Q71DI3 98.53 1e-94 X-RAY
 2016-06-22 ALA A:51 A:47 47.0 0.409 H -54.1 -56.2 8.0 0.07 0.339 B:P62805:0.339
 DC
DT
DC
DG
DA
DA
DC
 9.295
8.669
9.548
7.691
4.751
2.990
7.970
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 49.0 0.426 H -53.2 -55.8 8.0 0.07 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DT
DG
 9.432
8.048
4.811
2.980
7.960
9.049
9.176
8.938
 O
CB
N
N
N
CB
C
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
2io5 2 P84233 99.26 2e-94 X-RAY
 2007-02-27 ALA B:47 NA:NA DO NA DO DO DO NA NA NA
2nqb 2 P02299 99.26 2e-94 X-RAY
 2007-09-11 ALA C:47 A:447 49.0 0.426 H -64.2 -43.7 10.0 0.087 0.339 D:P84040:0.339
 DG
DT
DG
DA
DA
DC
HOH
 8.710
9.175
8.158
4.752
3.004
7.840
3.949
 N
O
CB
CB
N
N
CB
 OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 49.0 0.426 H -59.3 -44.9 10.0 0.087 0.339 H:P84040:0.339
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.892
9.231
8.170
4.819
3.096
7.989
9.941
8.775
3.671
 N
O
CB
CB
N
N
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O
2pyo 3 P02299 99.26 2e-94 X-RAY
 2007-11-06 ALA C:47 A:47 47.0 0.409 H -55.7 -57.1 10.0 0.087 0.322 D:P84040:0.322
 DT
DT
DG
DA
DT
DT
DG
DA
DA
HOH
 9.688
9.922
8.631
9.805
8.791
8.184
4.651
2.849
7.710
9.743
 CB
N
N
N
O
CB
CB
N
N
O
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 50.0 0.435 H -57.8 -42.1 9.0 0.078 0.357 H:P84040:0.357
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.896
9.269
8.222
4.818
3.010
8.010
9.684
9.868
8.765
5.959
 N
C
CB
CB
N
N
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
3c9k 3 P84229 99.26 2e-94 EM
 2009-01-06 ALA C:47 C:47 38.0 0.33 H -55.7 -60.7 7.0 0.061 0.269 D:P62801:0.27
D:P62801:0.27
ALA G:47 G:47 38.0 0.33 H -55.7 -60.7 7.0 0.061 0.269 H:P62801:0.27
H:P62801:0.27
4qlc 3 P02299 99.26 2e-94 X-RAY
 2015-07-22 ALA C:47 A:47 48.0 0.417 H -56.5 -52.9 9.0 0.078 0.339 D:P84040:0.339
 DC
DC
DC
DT
DC
DG
DT
DG
 9.456
9.624
8.779
9.614
7.907
4.593
2.862
7.690
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA G:47 E:47 44.0 0.383 H -58.5 -50.5 9.0 0.078 0.305 H:P84040:0.304
 DT
DC
DC
DG
DC
DG
DT
DC
 8.961
8.060
5.000
3.231
7.763
9.483
9.769
8.908
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
5x0y 1 P84233 99.26 2e-94 EM
 2017-04-19 ALA A:47 A:47 47.0 0.409 H -50.3 -50.9 7.0 0.061 0.348 B:P62799:0.348
 DT
DC
DC
DG
DC
DC
 9.878
8.386
5.050
3.531
7.491
9.364
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
ALA E:47 E:47 48.0 0.417 H -50.3 -50.9 4.0 0.035 0.382 F:P62799:0.383
 DC
DC
DG
DT
DG
 8.804
9.383
5.189
3.533
7.366
 N
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
6fml 9 Q71DI3 99.26 2e-94 EM
 2018-04-25 ALA M:47 M:47 50.0 0.435 H -60.9 -49.2 13.0 0.113 0.322 N:P62805:0.322
 DC
DG
DT
DG
DA
DC
 8.408
5.007
3.190
7.792
9.650
8.924
 CB
CB
N
N
CB
CB
 O3'
O3'
OP1
OP2
O3'
OP1
ALA Q:47 Q:47 45.0 0.391 H -70.8 -43.9 11.0 0.096 0.295 R:P62805:0.296
 DG
DT
DC
DT
DC
DC
DG
DC
 9.797
9.804
8.586
9.137
8.165
4.945
3.465
7.775
 CB
N
N
N
CB
CB
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
7eg6 2 P84233 99.26 2e-94 EM
 2022-01-12 ALA B:47 A:47 49.0 0.426 H -65.1 -41.7 9.0 0.078 0.348 C:P62799:0.348
 DT
DC
DC
DG
DC
DG
DC
 9.662
8.487
5.753
3.610
8.219
9.375
9.120
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA F:47 E:47 51.0 0.443 H -63.9 -46.0 10.0 0.087 0.356 G:P62799:0.357
 DC
DC
DC
DT
DC
DG
DT
DG
 9.351
9.869
9.053
9.653
8.496
5.144
3.522
8.004
 CB
N
N
O
CB
CB
N
N
 OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
7egp 11 P84233 99.26 2e-94 EM
 2022-01-12 ALA L:47 O:47 40.0 0.348 H -66.3 -32.4 8.0 0.07 0.278 M:P62799:0.278
 DC
DC
DG
DT
DG
 9.709
8.877
6.142
4.008
8.428
 N
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
ALA P:47 S:47 38.0 0.33 H -67.0 -47.7 4.0 0.035 0.295 Q:P62799:0.296
 DT
DC
DC
DG
DC
DT
DC
 8.937
8.697
6.501
4.306
9.158
9.457
8.294
 O
CB
CB
N
N
N
N
 OP1
O3'
C5'
OP1
OP2
OP1
OP1
7enn 2 P84233 99.26 2e-94 EM
 2021-07-14 ALA B:47 A:47 51.0 0.443 H -64.4 -44.5 11.0 0.096 0.347 C:P62799:0.348
 DT
DC
DC
DG
DC
DG
DC
 9.674
8.344
5.516
3.364
8.100
9.440
9.207
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA F:47 E:47 51.0 0.443 H -62.7 -43.0 10.0 0.087 0.356 G:P62799:0.357
 DC
DC
DT
DC
DG
DT
DG
 9.502
8.956
9.586
8.383
5.293
3.401
7.973
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
6ugm 1 Q92133 98.52 6e-94 EM
 2019-11-20 ALA A:47 A:47 53.0 0.461 H -61.8 -58.7 11.0 0.096 0.365 B:P62799:0.365
 DT
DC
DC
DG
DC
DG
DT
DC
 9.699
8.653
5.480
3.793
8.025
9.665
9.757
8.989
 O
CB
N
N
N
CB
C
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
ALA E:47 E:47 41.0 0.357 H -66.2 -41.2 11.0 0.096 0.261 F:P62799:0.261
 DC
DC
DC
DT
DC
DG
DT
DG
 9.597
8.962
8.855
9.814
8.703
5.756
3.760
7.810
 CB
C
N
O
CB
N
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
6uh5 1 Q92133 98.52 6e-94 EM
 2019-11-20 ALA A:47 A:47 55.0 0.478 H -60.8 -60.8 9.0 0.078 0.4 B:P62799:0.4
 DT
DC
DC
DG
DC
DG
DC
 9.191
8.476
5.574
3.638
8.111
9.439
8.936
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA E:47 E:47 40.0 0.348 H -55.4 -54.5 9.0 0.078 0.27 F:P62799:0.27
 DC
DC
DC
DT
DC
DG
DT
DG
 9.571
9.776
8.614
9.220
8.598
5.571
3.365
7.920
 CB
C
N
O
CB
N
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
6nzo 1 A0A310TTQ1 97.79 8e-94 EM
 2019-08-28 ALA A:48 A:47 50.0 0.435 H -58.6 -48.3 7.0 0.061 0.374 B:P62799:0.374
 DT
DC
DC
DG
DC
DG
DT
DC
 9.216
8.612
5.825
3.651
8.171
9.696
9.744
9.002
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
ALA E:48 E:47 53.0 0.461 H -61.1 -50.1 10.0 0.087 0.374 F:P62799:0.374
 DC
DC
DG
DT
DG
 9.557
8.330
4.589
2.758
7.451
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
6px1 1 A0A310TTQ1 97.79 8e-94 EM
 2019-08-28 ALA A:48 A:47 61.0 0.53 H -66.4 -42.0 12.0 0.104 0.426 B:P62799:0.426
 DT
DC
DC
DG
DC
DG
DT
DC
 9.245
8.069
5.404
3.295
8.043
9.405
9.841
8.840
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
ALA E:48 E:47 56.0 0.487 H -65.3 -44.1 12.0 0.104 0.383 F:P62799:0.383
 DC
DC
DC
DT
DC
DG
DT
DG
 9.366
9.872
8.769
9.318
8.107
4.960
3.144
7.862
 CB
N
N
O
CB
CB
N
N
 OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
6px3 1 A0A310TTQ1 97.79 8e-94 EM
 2019-08-28 ALA A:48 A:47 50.0 0.435 H -58.6 -48.3 6.0 0.052 0.383 B:P62799:0.383
 DT
DC
DC
DG
DC
DG
DT
DC
 9.216
8.612
5.825
3.650
8.171
9.697
9.743
9.002
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
ALA E:48 E:47 53.0 0.461 H -61.1 -50.1 10.0 0.087 0.374 F:P62799:0.374
 DC
DC
DG
DT
DG
 9.556
8.330
4.588
2.759
7.451
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
7mbm 5 A0A310TTQ1 97.79 8e-94 EM
 2021-12-29 ALA E:48 G:47 52.0 0.452 H -63.5 -42.8 15.0 0.13 0.322 F:P62799:0.322
 DC
DG
DT
DG
DC
 9.309
5.946
3.976
9.139
9.708
 CB
N
N
N
N
 O3'
O3'
OP2
OP2
OP1
ALA I:48 K:47 52.0 0.452 H -63.5 -42.7 13.0 0.113 0.339 J:P62799:0.339
 DC
DC
DC
DG
DC
 9.820
8.724
6.092
4.208
8.489
 N
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
7mbn 5 A0A310TTQ1 97.79 8e-94 EM
 2021-12-29 ALA E:48 G:47 53.0 0.461 H -62.8 -33.2 22.0 0.191 0.27 F:P62799:0.27
 DA
DT
DC
DC
DG
DC
DC
 9.067
9.173
7.741
4.108
2.529
6.575
9.144
 N
O
CB
CB
N
N
N
 C5'
OP1
O3'
O3'
OP2
OP2
OP1
ALA I:48 K:47 53.0 0.461 H -62.9 -33.1 21.0 0.183 0.278 J:P62799:0.278
 DC
DC
DG
DT
DC
DG
DT
DG
 9.748
8.260
9.313
9.456
7.771
3.984
2.294
6.577
 N
N
N
O
CB
CB
N
N
 O3'
OP1
C5'
OP1
O3'
C3'
OP2
OP2
6zhx 1 A0A310TTQ1 97.79 8e-94 EM
 2020-12-23 ALA A:48 A:47 52.0 0.452 H -56.9 -48.9 10.0 0.087 0.365 B:P62799:0.365
 DA
DC
DC
DG
DG
DT
DC
DG
DT
DG
 9.022
8.069
8.906
8.387
9.532
9.775
7.135
2.875
2.018
7.607
 HB2
HB2
H
H
N
O
HB3
HB3
H
H
 H4'
OP1
H5''
OP1
H5''
OP1
O3'
H3'
OP1
OP2
ALA E:48 E:47 49.0 0.426 H -57.2 -43.7 10.0 0.087 0.339 F:P62799:0.339
 DA
DC
DC
DG
DC
DG
DG
DT
DG
 9.581
7.357
3.321
2.181
7.773
9.345
8.317
8.532
8.289
 N
HB2
HB2
H
H
HB3
HB3
H
H
 H4'
O3'
H3'
OP1
OP2
H4'
OP1
H5''
OP1
6zhy 1 A0A310TTQ1 97.79 8e-94 EM
 2020-12-23 ALA A:48 A:47 55.0 0.478 H -55.1 -40.0 10.0 0.087 0.391 B:P62799:0.391
 DA
DC
DC
DG
DT
DG
 8.821
7.878
6.814
2.992
1.977
8.245
 HB2
HB2
HB3
HB3
H
H
 H5''
OP1
O3'
H3'
OP1
OP2
ALA E:48 E:47 49.0 0.426 H -52.6 -45.9 9.0 0.078 0.348 F:P62799:0.348
 DA
DC
DC
DG
DC
DG
DG
DT
DG
 9.729
7.277
3.479
2.303
7.932
9.270
8.170
8.525
8.341
 N
HB2
HB2
H
H
HB3
HB3
H
H
 H4'
O3'
H3'
OP1
OP2
H4'
OP1
H5''
OP1
7otq 2 P84233 97.79 8e-94 EM
 2021-09-15 ALA B:48 A:47 36.0 0.313 H -54.8 -35.1 9.0 0.078 0.235 C:P62799:0.235
 DC
DG
DG
DT
DC
DG
DT
DG
 9.643
8.986
9.822
9.483
8.222
3.668
2.332
7.487
 H
H
N
N
HB1
HB1
H
H
 O3'
OP1
H5''
OP1
O3'
H3'
OP1
OP2
ALA F:48 E:47 33.0 0.287 H -44.5 -40.7 3.0 0.026 0.261 G:P62799:0.261
 DA
DT
DC
DC
DG
DC
DG
DG
DT
DG
 9.947
8.609
7.891
3.993
2.349
7.550
9.494
9.792
9.250
8.725
 N
N
HB1
HB1
H
H
HB2
HB2
H
H
 H5''
OP1
O3'
O3'
OP1
OP2
H5''
H5'
H4'
OP1
1kx3 2 P84233 98.52 1e-93 X-RAY
 2002-12-25 ALA C:47 A:47 49.0 0.426 H -59.3 -49.3 10.0 0.087 0.339 D:P62799:0.339
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.726
8.761
9.062
8.223
4.861
3.034
7.811
3.582
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 50.0 0.435 H -55.3 -46.9 10.0 0.087 0.348 H:P62799:0.348
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.925
9.206
8.144
4.721
3.056
7.803
9.547
9.891
8.645
3.368
 N
O
CB
CB
N
N
CB
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
1kx4 2 P16105 98.52 1e-93 X-RAY
 2002-12-25 ALA C:47 A:47 46.0 0.4 H -59.7 -49.0 9.0 0.078 0.322 D:P02304:0.322
 DC
DA
DG
DA
DG
DA
DA
DG
HOH
 9.354
9.491
8.682
9.521
7.971
4.795
3.047
7.945
3.215
 CB
N
N
N
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 50.0 0.435 H -57.9 -49.2 11.0 0.096 0.339 H:P02304:0.339
 DA
DT
DG
DA
DA
DT
DA
DG
HOH
 9.432
8.146
4.656
2.831
7.798
9.591
9.817
8.854
3.634
 O
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
1kx5 3 P16105 98.52 1e-93 X-RAY
 2002-12-25 ALA C:47 A:47 50.0 0.435 H -60.4 -47.9 10.0 0.087 0.348 D:P02304:0.348
 DT
DT
DG
DT
DT
DG
DA
DA
HOH
 9.511
9.942
8.794
9.148
8.105
4.768
3.018
7.946
3.477
 CB
N
N
O
CB
N
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 51.0 0.443 H -62.0 -42.6 11.0 0.096 0.347 H:P02304:0.348
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.258
8.149
4.789
3.116
7.881
9.736
9.844
8.705
3.642
 N
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
1s32 2 30268544 98.52 1e-93 X-RAY
 2004-05-11 ALA C:47 A:447 49.0 0.426 H -56.8 -48.0 9.0 0.078 0.348 D:P02304:0.348
 DC
DT
DG
DT
DG
DA
DA
DC
HOH
 9.851
9.892
8.768
9.117
8.186
4.822
2.982
7.820
4.087
 CB
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 50.0 0.435 H -59.6 -47.3 10.0 0.087 0.348 H:P02304:0.348
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.993
9.215
8.203
4.754
3.137
7.916
9.915
8.684
3.535
 N
O
CB
CB
N
N
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O
1zbb 3 P84233 98.52 1e-93 X-RAY
 2005-07-12 ALA C:47 A:47 51.0 0.443 H -60.2 -48.0 10.0 0.087 0.356 D:P62799:0.357
 DT
DG
DA
DA
DT
 8.090
4.764
3.019
7.931
9.505
 CB
N
N
N
CB
 O3'
O3'
OP1
OP2
OP1
ALA G:47 E:47 50.0 0.435 H -62.0 -42.5 10.0 0.087 0.348 H:P62799:0.348
 DT
DT
DG
DA
DA
 9.727
8.132
4.787
3.114
7.867
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
ALA K:47 a:47 51.0 0.443 H -60.4 -47.9 10.0 0.087 0.356 L:P62799:0.357
 DT
DG
DA
DA
DT
 8.092
4.764
3.015
7.929
9.509
 CB
N
N
N
CB
 O3'
O3'
OP1
OP2
OP1
ALA O:47 e:47 50.0 0.435 H -62.1 -42.6 10.0 0.087 0.348 P:P62799:0.348
 DT
DT
DG
DA
DA
 9.723
8.134
4.787
3.117
7.869
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
2fj7 3 30268544 98.52 1e-93 X-RAY
 2006-09-26 ALA C:47 A:47 52.0 0.452 H -126.1 -50.6 20.0 0.174 0.278 D:P62799:0.278
 DA
DT
DT
DG
DA
DA
DG
 9.537
9.260
8.213
4.454
3.988
8.637
9.583
 N
N
CB
CB
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
OP1
ALA G:47 E:47 51.0 0.443 H -63.4 -67.9 8.0 0.07 0.373 H:P62799:0.374
 DT
DG
DT
DA
DA
DT
DT
 9.663
8.542
9.535
9.202
5.052
3.854
8.442
 C
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
2nzd 3 288992 98.52 1e-93 X-RAY
 2007-04-10 ALA C:47 A:47 47.0 0.409 H -53.4 -54.9 7.0 0.061 0.348 D:P62799:0.348
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.627
8.778
9.179
8.352
4.901
3.171
8.343
7.514
 CB
N
O
CB
CB
N
N
O
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 48.0 0.417 H -58.1 -45.6 9.0 0.078 0.339 H:P62799:0.339
 DA
DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.855
9.439
8.261
4.676
3.082
8.083
9.933
9.881
8.464
6.868
 N
N
CB
CB
N
N
CB
N
N
CA
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
O
3b6f 3 P84233 98.52 1e-93 X-RAY
 2007-12-25 ALA C:47 A:47 49.0 0.426 H -59.5 -63.5 8.0 0.07 0.356 D:P62799:0.357
 DT
DG
DT
DT
DG
DA
DA
 9.522
8.894
9.065
8.476
4.938
3.135
7.973
 C
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA G:47 E:47 49.0 0.426 H -60.3 -51.5 6.0 0.052 0.374 H:P62799:0.374
 DT
DT
DG
DA
DA
DT
DT
DG
 9.544
8.089
4.906
3.522
8.602
9.702
9.836
8.872
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3b6g 3 P84233 98.52 1e-93 X-RAY
 2007-12-25 ALA C:47 A:47 50.0 0.435 H -71.4 -54.5 12.0 0.104 0.331 D:P62799:0.33
 DT
DG
DT
DT
DG
DA
DA
 9.937
8.543
8.909
8.114
4.372
2.912
7.491
 C
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA G:47 E:47 44.0 0.383 H -52.9 -52.1 8.0 0.07 0.313 H:P62799:0.313
 DA
DT
DT
DG
DA
DA
DT
DG
 9.974
9.260
8.388
5.087
3.470
8.174
9.674
8.877
 N
O
CB
N
N
N
C
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
3c1b 1 P02302 98.52 1e-93 X-RAY
 2008-10-07 ALA A:47 A:447 51.0 0.443 H -59.9 -49.2 10.0 0.087 0.356 B:P62799:0.357
 DC
DT
DG
DA
DT
DG
DA
DA
DC
HOH
 9.908
9.960
8.672
9.899
9.181
8.143
4.784
3.062
7.793
3.946
 CB
N
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:47 E:647 49.0 0.426 H -56.7 -47.6 10.0 0.087 0.339 F:P62799:0.339
 DA
DT
DT
DG
DA
DA
DG
DT
DG
HOH
 10.000
9.263
8.208
4.834
3.008
7.903
9.696
9.976
8.778
3.429
 N
O
CB
CB
N
N
CB
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
3kuy 1 P84233 98.52 1e-93 X-RAY
 2010-01-05 ALA A:47 A:47 48.0 0.417 H -57.2 -50.3 7.0 0.061 0.356 B:P62799:0.357
 DG
DT
DG
DA
DA
DC
 8.809
9.448
8.337
4.946
3.229
8.042
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 50.0 0.435 H -53.0 -49.5 9.0 0.078 0.357 F:P62799:0.357
 DT
DG
DA
DA
DC
DC
DT
DG
 9.338
8.312
4.965
2.958
8.086
9.812
9.824
8.732
 C
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
3lja 1 P84233 98.52 1e-93 X-RAY
 2010-04-14 ALA A:47 A:47 45.0 0.391 H -56.8 -55.3 7.0 0.061 0.33 B:P62799:0.33
 DT
DG
DT
DT
DG
DA
DA
 9.755
8.989
9.130
8.397
4.800
3.117
7.878
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 51.0 0.443 H -55.9 -48.3 11.0 0.096 0.347 F:P62799:0.348
 DT
DT
DG
DA
DA
DT
DG
 9.363
8.305
4.755
3.118
8.065
9.555
8.890
 C
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
3lz0 1 P84233 98.52 1e-93 X-RAY
 2010-09-15 ALA A:47 A:47 49.0 0.426 H -63.0 -56.9 9.0 0.078 0.348 B:P62799:0.348
 DC
DG
DT
DC
DG
DT
DG
 9.374
8.981
9.125
8.329
5.081
3.289
8.306
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 49.0 0.426 H -55.8 -56.9 8.0 0.07 0.356 F:P62799:0.357
 DT
DC
DC
DG
DC
DG
DT
DG
 9.138
8.319
4.952
3.204
8.067
9.163
9.689
9.057
 N
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3lz1 1 P84233 98.52 1e-93 X-RAY
 2010-09-15 ALA A:47 A:47 49.0 0.426 H -56.4 -60.6 10.0 0.087 0.339 B:P62799:0.339
 DG
DG
DT
DC
DC
DG
DC
 9.374
9.053
9.120
8.467
5.177
3.219
8.403
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 48.0 0.417 H -53.5 -53.6 7.0 0.061 0.356 F:P62799:0.357
 DT
DC
DG
DT
DG
DC
DC
DG
 9.211
8.296
4.844
3.095
8.148
9.202
9.820
9.076
 N
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3mgp 1 P84233 98.52 1e-93 X-RAY
 2010-06-16 ALA A:47 A:47 46.0 0.4 H -59.3 -56.5 8.0 0.07 0.33 B:P62799:0.33
 DC
DG
DT
DG
DA
DA
DC
 9.909
9.069
9.322
8.365
4.912
3.244
8.108
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 52.0 0.452 H -59.3 -57.3 10.0 0.087 0.365 F:P62799:0.365
 DT
DC
DT
DG
DA
DG
DG
 9.355
8.315
5.145
3.334
8.238
9.882
8.930
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
C5'
OP1
3mgq 1 P84233 98.52 1e-93 X-RAY
 2010-06-16 ALA A:47 A:47 48.0 0.417 H -54.0 -58.5 9.0 0.078 0.339 B:P62799:0.339
 DC
DT
DG
DT
DG
DA
DA
DC
 9.902
9.992
8.925
9.222
8.231
5.032
3.240
8.007
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 52.0 0.452 H -63.6 -52.7 10.0 0.087 0.365 F:P62799:0.365
 DT
DC
DT
DG
DA
DT
DG
 9.253
8.243
4.980
3.123
8.244
9.960
8.799
 O
CB
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
3mgr 1 P84233 98.52 1e-93 X-RAY
 2010-06-16 ALA A:47 A:47 50.0 0.435 H -58.3 -52.4 10.0 0.087 0.348 B:P62799:0.348
 DT
DG
DT
DT
DG
DA
DA
 9.733
8.892
9.176
8.068
4.744
3.145
8.009
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 51.0 0.443 H -48.1 -51.6 11.0 0.096 0.347 F:P62799:0.348
 DT
DT
DG
DA
DA
DT
DG
 9.345
8.199
4.691
3.092
8.032
9.740
8.836
 C
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
3mgs 1 P84233 98.52 1e-93 X-RAY
 2010-06-16 ALA A:47 A:47 49.0 0.426 H -53.4 -53.7 8.0 0.07 0.356 B:P62799:0.357
 DT
DG
DT
DT
DG
DA
DA
 9.865
8.969
9.230
8.407
5.036
3.236
7.995
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 49.0 0.426 H -51.2 -52.8 10.0 0.087 0.339 F:P62799:0.339
 DT
DT
DG
DA
DA
DT
DG
 9.260
8.365
4.963
3.180
8.036
9.901
8.843
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
3mnn 1 P84233 98.52 1e-93 X-RAY
 2011-04-06 ALA A:47 A:47 49.0 0.426 H -62.2 -51.1 8.0 0.07 0.356 B:P62799:0.357
 DC
DG
DT
DG
DA
DA
DC
 9.679
8.795
9.481
8.195
4.810
3.080
7.779
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 51.0 0.443 H -50.1 -56.3 10.0 0.087 0.356 F:P62799:0.357
 DT
DG
DA
DA
DC
DC
DT
DG
 9.105
8.213
4.744
3.050
7.948
9.717
9.964
8.822
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3mvd 1 P84233 98.52 1e-93 X-RAY
 2010-08-25 ALA A:47 A:47 47.0 0.409 H -56.0 -53.0 8.0 0.07 0.339 B:P62799:0.339
 DA
DT
DC
DC
DG
DC
DG
DT
DC
 9.959
9.027
8.100
4.836
3.084
7.538
9.301
9.664
8.802
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA E:47 E:47 47.0 0.409 H -58.6 -50.1 9.0 0.078 0.331 F:P62799:0.33
 DC
DC
DC
DT
DC
DG
DT
DG
 9.044
9.468
8.721
9.253
8.120
5.004
3.136
7.632
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3o62 1 P84233 98.52 1e-93 X-RAY
 2011-01-05 ALA A:47 A:47 31.0 0.27 H -50.5 -51.1 4.0 0.035 0.235 B:P62799:0.235
 DA
DC
DG
DA
DA
DC
 9.722
7.967
8.432
5.059
2.938
9.389
 N
N
CB
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 42.0 0.365 H -59.7 -52.6 7.0 0.061 0.304 F:P62799:0.304
 DA
DT
DT
DC
DA
DA
DG
DT
DG
 9.768
9.480
8.603
4.568
3.030
7.034
9.218
9.120
7.465
 N
O
CB
CB
N
N
CB
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
3reh 1 P84233 98.52 1e-93 X-RAY
 2012-03-14 ALA A:47 A:47 46.0 0.4 H -52.8 -56.1 7.0 0.061 0.339 B:P62799:0.339
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.487
8.822
9.180
8.370
4.881
3.305
8.110
7.495
 CB
N
O
CB
CB
N
N
O
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:47 E:47 52.0 0.452 H -65.4 -41.1 10.0 0.087 0.365 F:P62799:0.365
 DA
DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.839
9.362
8.181
4.572
3.169
8.011
9.955
9.728
8.542
7.230
 N
N
CB
CB
N
N
CB
N
N
CA
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
O
3rei 1 P84233 98.52 1e-93 X-RAY
 2012-03-14 ALA A:47 A:47 49.0 0.426 H -59.2 -53.7 7.0 0.061 0.365 B:P62799:0.365
 DC
DG
DT
DG
DA
DA
DC
 9.664
8.843
9.062
8.388
4.821
3.287
8.138
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 53.0 0.461 H -58.4 -50.7 10.0 0.087 0.374 F:P62799:0.374
 DA
DT
DG
DA
DA
DC
DC
DT
DG
 9.961
9.431
8.157
4.748
3.123
8.132
9.817
9.883
8.712
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
3rej 1 P84233 98.52 1e-93 X-RAY
 2012-03-14 ALA A:47 A:47 50.0 0.435 H -66.6 -50.0 11.0 0.096 0.339 B:P62799:0.339
 DC
DA
DG
DA
DG
DA
DA
DG
HOH
 9.408
9.661
8.888
8.919
8.010
4.739
3.127
8.047
3.390
 CB
N
N
N
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:47 E:47 53.0 0.461 H -55.3 -43.1 10.0 0.087 0.374 F:P62799:0.374
 DA
DT
DG
DA
DA
DT
DA
DG
HOH
 9.244
7.987
4.734
3.199
7.861
9.573
9.992
8.926
3.276
 N
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
3rek 1 P84233 98.52 1e-93 X-RAY
 2012-03-14 ALA A:47 A:47 49.0 0.426 H -70.1 -45.2 11.0 0.096 0.33 B:P62799:0.33
 DC
DA
DG
DA
DG
DA
DA
DG
 9.288
9.677
8.873
8.842
7.948
4.754
3.184
8.151
 CB
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 50.0 0.435 H -51.3 -53.1 10.0 0.087 0.348 F:P62799:0.348
 DA
DT
DG
DA
DA
DT
DG
 9.342
8.045
4.904
3.146
7.890
9.309
8.845
 N
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
3rel 1 P84233 98.52 1e-93 X-RAY
 2012-03-14 ALA A:47 A:47 49.0 0.426 H -66.0 -50.8 11.0 0.096 0.33 B:P62799:0.33
 DC
DA
DG
DA
DG
DA
DA
DG
 9.231
9.702
8.716
8.999
8.090
5.009
3.177
8.285
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 50.0 0.435 H -50.2 -60.3 10.0 0.087 0.348 F:P62799:0.348
 DA
DA
DT
DG
DA
DA
DT
DG
 9.981
9.003
8.146
4.940
3.029
7.776
9.320
8.931
 N
O
CB
CB
N
N
CB
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
3tu4 1 P84233 98.52 1e-93 X-RAY
 2011-11-23 ALA A:47 A:47 45.0 0.391 H -56.5 -49.5 11.0 0.096 0.295 B:P62799:0.296
 DT
DC
DC
DG
DC
DG
DT
DC
 9.124
8.039
4.817
2.917
7.808
9.447
9.648
8.676
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA E:47 E:47 44.0 0.383 H -54.8 -46.4 8.0 0.07 0.313 F:P62799:0.313
 DC
DC
DC
DG
DT
DC
DG
DT
DG
 9.529
9.844
8.690
9.933
8.878
8.199
4.897
3.128
7.781
 CB
N
N
N
O
CB
N
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
3ut9 1 P84233 98.52 1e-93 X-RAY
 2012-04-11 ALA A:47 A:47 51.0 0.443 H -54.7 -49.4 9.0 0.078 0.365 B:P62799:0.365
 DC
DT
DG
DA
DT
DC
DG
DT
DG
HOH
 9.196
9.874
9.088
9.712
8.757
8.158
4.863
3.263
8.030
8.864
 CB
N
N
N
N
CB
N
N
N
O
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:47 E:47 49.0 0.426 H -58.6 -54.5 11.0 0.096 0.33 F:P62799:0.33
 DA
DT
DC
DG
DT
DG
DC
DG
HOH
 9.693
8.987
8.202
4.751
3.042
7.998
9.111
8.801
7.672
 N
O
CB
CB
N
N
CB
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
3uta 1 P84233 98.52 1e-93 X-RAY
 2012-04-11 ALA A:47 A:47 53.0 0.461 H -64.2 -53.3 9.0 0.078 0.383 B:P62799:0.383
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.893
8.893
9.318
8.091
4.783
3.038
7.835
7.972
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:47 E:47 51.0 0.443 H -60.2 -46.4 9.0 0.078 0.365 F:P62799:0.365
 DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.263
8.142
4.714
3.172
7.938
9.837
9.882
8.738
8.195
 C
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
3utb 1 P84233 98.52 1e-93 X-RAY
 2012-04-11 ALA A:47 A:47 49.0 0.426 H -60.1 -48.5 10.0 0.087 0.339 B:P62799:0.339
 DC
DA
DG
DA
DG
DA
DA
DG
HOH
 9.494
9.692
8.721
8.950
7.910
4.818
3.150
8.106
3.947
 CB
N
N
N
CB
CB
N
N
CA
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:47 E:47 52.0 0.452 H -55.1 -48.9 10.0 0.087 0.365 F:P62799:0.365
 DA
DT
DG
DA
DA
DT
DA
DG
HOH
 9.472
8.141
4.728
3.043
7.960
9.252
9.844
8.924
4.829
 N
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
4j8u 1 P84233 98.52 1e-93 X-RAY
 2013-04-17 ALA A:47 A:47 46.0 0.4 H -58.1 -51.1 6.0 0.052 0.348 B:P62799:0.348
 DC
DG
DT
DG
DA
DA
DC
 9.701
8.876
9.428
8.239
4.952
3.249
8.017
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 52.0 0.452 H -57.0 -51.1 10.0 0.087 0.365 F:P62799:0.365
 DT
DG
DA
DA
DC
DC
DT
DG
 9.388
8.209
4.721
3.006
7.932
9.758
9.802
8.598
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
4j8v 1 P84233 98.52 1e-93 X-RAY
 2013-05-08 ALA A:47 A:47 49.0 0.426 H -61.4 -47.4 7.0 0.061 0.365 B:P62799:0.365
 DT
DG
DA
DA
DC
 9.426
8.273
4.892
3.290
8.027
 N
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 53.0 0.461 H -60.9 -45.2 NA NA NA
4j8w 1 P84233 98.52 1e-93 X-RAY
 2013-04-17 ALA A:47 A:47 49.0 0.426 H -61.3 -49.7 7.0 0.061 0.365 B:P62799:0.365
 DC
DG
DT
DG
DA
DA
DC
 9.805
8.911
9.435
8.184
4.892
3.226
8.049
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 52.0 0.452 H -55.8 -49.4 9.0 0.078 0.374 F:P62799:0.374
 DT
DG
DA
DA
DC
DC
DT
DG
 9.446
8.171
4.673
3.053
8.004
9.794
9.856
8.627
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
4j8x 1 P84233 98.52 1e-93 X-RAY
 2013-05-08 ALA A:47 A:47 50.0 0.435 H -56.7 -54.8 6.0 0.052 0.383 B:P62799:0.383
 DC
DG
 9.721
8.938
 CB
N
 OP1
OP1
ALA E:47 E:47 50.0 0.435 H -52.7 -51.5 NA NA NA
4r8p 1 P84233 98.52 1e-93 X-RAY
 2014-11-05 ALA A:47 A:47 51.0 0.443 H -60.8 -49.2 13.0 0.113 0.33 B:P62799:0.33
 DA
DC
DC
DC
DT
DC
DG
DT
DG
 9.643
8.987
9.735
8.844
9.150
8.279
5.088
3.101
7.815
 CB
CB
N
N
N
CB
CB
N
N
 O3'
OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 43.0 0.374 H -70.9 -44.2 10.0 0.087 0.287 F:P62799:0.287
 DA
DT
DC
DC
DG
DC
DG
DT
DC
 9.950
9.067
8.158
4.699
3.243
7.717
9.714
9.733
8.576
 N
N
CB
CB
N
N
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
4wu8 3 P84233 98.52 1e-93 X-RAY
 2015-09-02 ALA C:47 A:47 48.0 0.417 H -58.1 -49.5 8.0 0.07 0.347 D:P62799:0.348
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.878
8.824
9.283
8.058
4.765
3.212
7.882
7.861
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 53.0 0.461 H -51.8 -47.4 11.0 0.096 0.365 H:P62799:0.365
 DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.454
8.127
4.683
3.019
7.875
9.750
9.869
8.865
8.133
 C
CB
N
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
4wu9 1 P84233 98.52 1e-93 X-RAY
 2015-09-02 ALA A:47 A:47 49.0 0.426 H -51.8 -51.4 7.0 0.061 0.365 B:P62799:0.365
 DC
DT
DG
DT
DG
DA
DA
DC
 9.954
9.703
8.914
9.183
8.095
4.865
3.199
8.044
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 48.0 0.417 H -57.7 -53.6 10.0 0.087 0.33 F:P62799:0.33
 DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.203
8.262
4.924
3.150
8.126
9.719
9.880
8.570
8.153
 O
CB
N
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
4xuj 1 P84233 98.52 1e-93 X-RAY
 2016-01-27 ALA A:47 A:47 45.0 0.391 H -46.7 -57.1 7.0 0.061 0.33 B:P62799:0.33
 DC
DG
DT
DG
DA
DA
DC
 9.672
9.002
9.293
8.290
4.929
3.312
7.885
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 48.0 0.417 H -57.6 -52.6 8.0 0.07 0.347 F:P62799:0.348
 DA
DT
DG
DA
DA
DC
DC
DT
DG
 9.984
9.363
8.423
4.772
3.314
7.910
9.641
9.864
8.695
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
5cp6 3 P84233 98.52 1e-93 X-RAY
 2016-06-01 ALA C:47 A:47 45.0 0.391 H -45.1 -57.2 5.0 0.043 0.348 D:P62799:0.348
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.661
8.841
9.264
8.180
4.929
3.141
8.109
7.542
 CB
N
O
CB
N
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 51.0 0.443 H -52.6 -48.0 8.0 0.07 0.373 H:P62799:0.374
 DT
DG
DA
DA
DC
DC
DG
HOH
 9.391
8.272
4.936
3.153
7.868
9.922
8.882
8.177
 O
CB
N
N
N
CB
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5dnm 1 P84233 98.52 1e-93 X-RAY
 2016-09-14 ALA A:47 A:47 47.0 0.409 H -56.0 -52.5 6.0 0.052 0.357 B:P62799:0.357
 DC
DG
DT
DG
DA
DA
DC
 9.741
8.996
9.459
8.167
4.851
3.028
7.787
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 51.0 0.443 H -57.5 -50.6 9.0 0.078 0.365 F:P62799:0.365
 DT
DG
DA
DA
DC
DC
DT
DG
 9.218
8.165
4.879
3.057
7.984
9.665
9.833
8.844
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
5dnn 1 P84233 98.52 1e-93 X-RAY
 2016-09-14 ALA A:47 A:47 48.0 0.417 H -58.1 -54.3 7.0 0.061 0.356 B:P62799:0.357
 DC
DG
DT
DG
DA
DA
DC
 9.691
8.809
9.491
8.222
4.901
3.091
7.858
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 51.0 0.443 H -57.7 -52.1 9.0 0.078 0.365 F:P62799:0.365
 DT
DG
DA
DA
DC
DC
DT
DG
 9.156
8.200
4.806
3.156
8.031
9.719
9.909
8.780
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
5hq2 1 P84233 98.52 1e-93 X-RAY
 2016-03-23 ALA A:47 A:47 68.0 0.591 H -67.6 -25.4 46.0 0.4 0.191 B:P62799:0.191
 DC
DC
DT
DC
DG
DT
DG
 9.848
8.982
9.326
8.035
5.002
3.213
7.671
 N
N
N
CB
CB
N
N
 C5'
OP1
OP1
O3'
O3'
OP1
OP2
5nl0 1 P84233 98.52 1e-93 X-RAY
 2017-05-17 ALA A:47 A:47 51.0 0.443 H -59.6 -46.0 9.0 0.078 0.365 B:P62799:0.365
 DC
DG
DT
DC
DG
DT
DG
 9.182
8.975
8.668
7.968
4.757
3.279
8.259
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 53.0 0.461 H -55.7 -49.0 12.0 0.104 0.357 F:P62799:0.357
 DA
DT
DC
DG
DT
DG
DC
DG
 9.916
8.675
8.017
4.763
3.025
8.250
8.816
9.105
 N
O
CB
N
N
N
CB
N
 C5'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA K:47 K:47 50.0 0.435 H -54.9 -49.0 NA NA NA
5oxv 5 P84233 98.52 1e-93 X-RAY
 2017-10-11 ALA E:47 O:47 50.0 0.435 H -55.8 -56.9 8.0 0.07 0.365 D:P62799:0.365
 DG
DT
DC
DT
DC
DC
DG
DC
 9.162
9.646
8.534
9.140
8.318
4.952
3.205
8.068
 CB
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA I:47 K:47 49.0 0.426 H -63.0 -56.9 9.0 0.078 0.348 H:P62799:0.348
 DT
DC
DG
DT
DG
DC
DC
 9.125
8.329
5.081
3.290
8.307
9.374
9.206
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA N:47 E:47 50.0 0.435 H -55.8 -56.9 8.0 0.07 0.365 M:P62799:0.365
 DG
DT
DC
DT
DC
DC
DG
DC
 9.163
9.520
8.835
9.139
8.319
4.952
3.205
8.067
 CB
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA R:47 A:47 48.0 0.417 H -63.0 -56.9 9.0 0.078 0.339 Q:P62799:0.339
 DT
DC
DG
DT
DG
DC
DC
 9.126
8.330
5.081
3.289
8.305
9.375
9.065
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
5oy7 2 Q92133 98.52 1e-93 X-RAY
 2017-09-20 ALA B:47 M:47 48.0 0.417 H -55.8 -56.9 7.0 0.061 0.356 C:P62799:0.357
 DC
DC
DG
DC
DG
DC
DC
 8.320
4.952
3.204
8.068
9.162
9.991
9.011
 CB
CB
N
N
CB
N
N
 O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA F:47 Q:47 49.0 0.426 H -63.0 -56.9 9.0 0.078 0.348 G:P62799:0.348
 DC
DC
DC
DT
DC
DG
DT
DG
 9.374
9.441
8.860
9.605
8.329
5.081
3.288
8.307
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA H:47 I:47 49.0 0.426 H -62.9 -56.9 10.0 0.087 0.339 I:P62799:0.339
 DC
DC
DT
DC
DG
DT
DG
 9.376
9.391
9.660
8.328
5.081
3.288
8.306
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA J:47 A:47 49.0 0.426 H -63.0 -56.9 9.0 0.078 0.348 K:P62799:0.348
 DC
DC
DT
DC
DG
DT
DG
 9.374
9.085
9.672
8.329
5.082
3.289
8.308
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA N:47 E:47 49.0 0.426 H -55.6 -56.9 8.0 0.07 0.356 O:P62799:0.357
 DA
DA
DC
DC
DG
DC
DG
DC
DC
 9.835
8.585
8.320
4.952
3.205
8.067
9.162
9.420
8.841
 N
N
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
ALA U:47 U:47 50.0 0.435 H -55.7 -56.9 8.0 0.07 0.365 V:P62799:0.365
 DA
DC
DC
DG
DC
DG
 9.264
8.320
4.951
3.203
8.068
9.163
 O
CB
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
ALA Y:47 Y:47 49.0 0.426 H -63.0 -56.9 9.0 0.078 0.348 Z:P62799:0.348
 DC
DC
DC
DT
DC
DG
DT
DG
 9.375
9.663
8.714
9.566
8.329
5.081
3.288
8.306
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA CA:47 c:47 49.0 0.426 H -55.8 -56.9 8.0 0.07 0.356 DA:P62799:0.357
 DT
DC
DC
DG
DC
DG
DC
 9.353
8.319
4.952
3.205
8.067
9.163
9.021
 N
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
5xf6 1 P84233 98.52 1e-93 X-RAY
 2017-10-11 ALA A:47 A:47 49.0 0.426 H -57.2 -50.8 6.0 0.052 0.374 B:P62799:0.374
 DC
DG
DT
DG
DA
DA
DC
 9.679
9.053
9.508
8.165
4.871
2.943
7.741
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 52.0 0.452 H -61.3 -50.3 9.0 0.078 0.374 F:P62799:0.374
 DT
DG
DA
DA
DC
DC
DT
DG
 9.203
8.194
4.781
3.076
7.961
9.630
9.791
8.796
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
5z3l 1 P84233 98.52 1e-93 EM
 2019-04-03 ALA A:47 A:47 49.0 0.426 H -63.2 -39.8 9.0 0.078 0.348 B:P62799:0.348
 DT
DC
DC
DG
DC
DT
DC
 9.770
8.665
4.951
3.211
7.679
9.791
8.454
 O
CB
CB
N
N
C
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA E:47 E:47 49.0 0.426 H -63.1 -39.8 17.0 0.148 0.278 F:P62799:0.278
 DC
DC
DC
DT
DG
DT
DG
 9.451
9.231
8.593
9.735
5.842
4.189
8.333
 CB
N
N
N
CB
N
N
 OP1
O3'
OP1
OP1
O3'
OP1
OP2
5z3o 1 P84233 98.52 1e-93 EM
 2019-04-03 ALA A:47 A:47 48.0 0.417 H -60.7 -47.1 8.0 0.07 0.347 B:P62799:0.348
 DT
DC
DC
DG
DC
DC
 9.448
8.842
5.861
3.873
7.834
8.964
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
ALA E:47 E:47 49.0 0.426 H -60.7 -47.0 11.0 0.096 0.33 F:P62799:0.33
 DA
DC
DC
DG
DG
DT
DG
 9.981
9.339
9.015
9.728
5.966
4.140
8.251
 CB
CB
N
O
N
N
N
 O3'
OP1
OP1
OP1
O3'
OP1
OP2
5z3u 2 P84233 98.52 1e-93 EM
 2019-05-22 ALA B:47 A:47 44.0 0.383 H -56.7 -60.4 11.0 0.096 0.287 C:P62799:0.287
 DT
DC
DC
DG
DC
DG
DT
DC
 8.784
8.979
5.669
3.663
8.126
9.833
9.867
8.981
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA F:47 E:47 44.0 0.383 H -56.7 -60.4 8.0 0.07 0.313 G:P62799:0.313
 DC
DC
DC
DT
DC
DG
DT
DG
 9.663
9.691
8.968
9.312
9.049
5.492
3.698
8.278
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
5z3v 2 P84233 98.52 1e-93 EM
 2019-05-22 ALA B:47 A:47 50.0 0.435 H -62.6 -42.5 13.0 0.113 0.322 C:P62799:0.322
 DT
DC
DC
DG
DC
DC
 9.923
8.387
5.369
3.365
7.821
9.013
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
ALA F:47 E:47 50.0 0.435 H -62.7 -42.5 14.0 0.122 0.313 G:P62799:0.313
 DC
DC
DT
DC
DG
DT
DG
 9.991
8.724
9.704
8.445
5.272
3.753
7.970
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
6esf 1 P84233 98.52 1e-93 EM
 2017-12-20 ALA A:47 A:47 42.0 0.365 H -66.7 -58.9 8.0 0.07 0.295 B:P62799:0.296
 DG
DC
DT
DC
DC
DG
DC
 8.476
8.731
9.409
8.994
5.410
3.403
7.793
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 45.0 0.391 H -68.2 -52.1 10.0 0.087 0.304 F:P62799:0.304
 DT
DC
DG
DT
DG
DC
DC
 9.492
8.930
5.027
3.610
7.676
8.707
8.661
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6esg 1 P84233 98.52 1e-93 EM
 2017-12-20 ALA A:47 A:47 52.0 0.452 H -63.2 -36.8 41.0 0.357 0.095 B:P62799:0.096
 DG
DC
DC
DC
DG
DC
 9.694
8.035
6.549
3.788
2.458
7.973
 CB
N
CB
CB
N
N
 N2
OP1
O3'
C3'
OP1
OP2
ALA E:47 E:47 42.0 0.365 H -68.4 -31.8 19.0 0.165 0.2 F:P62799:0.2
 DG
DG
DT
DG
 8.901
5.238
3.364
7.897
 N
CB
CB
N
 OP1
O3'
OP1
OP2
6esh 1 P84233 98.52 1e-93 EM
 2017-12-20 ALA A:47 A:47 50.0 0.435 H -61.0 -56.8 22.0 0.191 0.244 B:P62799:0.243
 DC
DA
DT
DC
DC
DG
DC
 9.039
9.806
9.194
8.588
4.978
3.770
7.285
 N
N
O
CB
CB
CB
N
 OP1
O3'
OP1
O3'
O3'
OP2
OP2
ALA E:47 E:47 46.0 0.4 H -63.0 -52.8 13.0 0.113 0.287 F:P62799:0.287
 DG
DT
DG
DA
DC
 5.248
3.335
7.059
9.496
8.504
 CB
CB
N
CB
CB
 O3'
OP1
OP1
C5'
OP1
6esi 1 P84233 98.52 1e-93 EM
 2017-12-20 ALA A:47 A:47 49.0 0.426 H -70.6 -26.5 9.0 0.078 0.348 B:P62799:0.243
G:Q6AZJ8:0.139
 DG
DG
DT
DC
DT
DC
DG
DC
 9.719
8.434
9.747
8.506
9.913
7.138
5.169
7.805
 CB
CB
C
C
O
N
N
N
 OP1
OP1
O5'
OP1
OP1
O3'
OP1
OP1
ALA E:47 NA:NA DO NA DO DO DO NA NA NA
6iro 2 A0A310TTQ1 98.52 1e-93 EM
 2019-04-03 ALA B:47 A:47 53.0 0.461 H -65.8 -46.9 10.0 0.087 0.374 C:P62799:0.374
 DT
DC
DC
DG
DC
DT
DC
 9.577
8.555
5.643
3.687
8.147
9.913
8.841
 O
CB
N
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
C5'
OP1
ALA F:47 E:47 56.0 0.487 H -65.3 -43.8 11.0 0.096 0.391 G:P62799:0.391
 DC
DC
DC
DG
DC
DG
DT
DG
 9.550
9.963
9.142
9.572
8.839
5.284
3.447
7.987
 CB
N
N
C
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6jyl 1 A0A310TTQ1 98.52 1e-93 EM
 2019-05-29 ALA A:47 A:47 49.0 0.426 H -64.4 -47.2 12.0 0.104 0.322 B:P62799:0.322
 DT
DC
DC
DG
DC
DG
DC
 9.806
8.681
5.615
3.488
8.155
9.871
8.961
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA E:47 E:47 49.0 0.426 H -63.6 -46.9 12.0 0.104 0.322 F:P62799:0.322
 DC
DC
DC
DT
DC
DG
DT
DG
 9.763
9.882
9.022
9.616
8.556
5.206
3.524
7.914
 CB
N
N
O
CB
CB
N
N
 OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
6k1p 1 A0A310TTQ1 98.52 1e-93 EM
 2019-05-29 ALA A:47 A:47 55.0 0.478 H -66.6 -39.4 13.0 0.113 0.365 B:P62799:0.365
 DT
DC
DC
DG
DC
DC
 9.629
8.893
5.898
3.769
8.405
9.173
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
ALA E:47 E:47 52.0 0.452 H -62.0 -47.6 11.0 0.096 0.356 F:P62799:0.357
 DC
DC
DC
DC
DG
DT
DG
 9.984
9.960
9.212
8.939
5.616
3.801
8.456
 CB
N
N
CB
N
N
N
 OP1
O3'
OP1
O3'
O3'
OP1
OP2
6kiu 1 A0A310TTQ1 98.52 1e-93 EM
 2019-09-11 ALA A:47 A:47 55.0 0.478 H -64.7 -45.3 15.0 0.13 0.348 B:P62799:0.348
 DC
DC
DG
DT
DG
 9.300
8.829
5.293
3.181
8.252
 N
CB
N
N
N
 OP1
O3'
O3'
OP2
OP2
ALA E:47 E:47 55.0 0.478 H -64.5 -45.4 13.0 0.113 0.365 F:P62799:0.365
 DT
DC
DC
DG
DC
DC
 9.411
8.739
5.649
3.702
8.389
9.217
 N
CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6kiv 1 A0A310TTQ1 98.52 1e-93 EM
 2019-09-11 ALA A:47 A:47 55.0 0.478 H -63.2 -50.1 15.0 0.13 0.348 B:P62799:0.348
 DC
DC
DG
DT
DG
 9.247
8.955
4.722
3.208
7.904
 N
CB
N
N
N
 OP1
O3'
O3'
OP2
OP2
ALA E:47 E:47 53.0 0.461 H -63.3 -50.1 10.0 0.087 0.374 F:P62799:0.374
 DC
DC
DG
DC
DC
 9.048
6.582
4.182
8.639
9.182
 CB
N
N
N
N
 O3'
O3'
OP2
OP2
OP1
6kiw 1 A0A310TTQ1 98.52 1e-93 EM
 2019-09-11 ALA A:47 A:47 48.0 0.417 H -90.3 -51.1 8.0 0.07 0.347 B:P62799:0.348
 DC
DC
DT
DC
DG
DT
DG
 9.887
8.792
9.289
9.301
5.532
3.377
8.404
 N
N
O
CB
N
N
N
 C5'
OP1
OP1
O3'
O3'
OP2
OP2
ALA E:47 E:47 48.0 0.417 H -90.3 -51.1 5.0 0.043 0.374 F:P62799:0.374
 DT
DC
DC
DG
DC
DC
 9.236
9.420
6.149
3.994
8.663
9.398
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6kix 1 A0A310TTQ1 98.52 1e-93 EM
 2019-09-11 ALA A:47 A:47 51.0 0.443 H -63.6 -42.8 17.0 0.148 0.295 B:P62799:0.296
 DC
DC
DG
DT
DG
 9.378
8.983
5.216
3.141
8.085
 N
CB
CB
N
N
 OP1
O3'
O3'
OP2
OP2
ALA E:47 E:47 51.0 0.443 H -63.5 -42.8 14.0 0.122 0.321 F:P62799:0.322
 DT
DC
DC
DG
DC
DC
 9.426
9.084
6.039
4.331
7.954
9.266
 N
CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6kiz 1 A0A310TTQ1 98.52 1e-93 EM
 2019-09-11 ALA A:47 A:47 44.0 0.383 H -63.4 -39.5 12.0 0.104 0.279 B:P62799:0.278
 DC
DC
DG
DT
DG
 9.578
9.146
5.048
3.149
8.062
 N
CB
CB
N
N
 OP1
O3'
O3'
OP2
OP2
ALA E:47 E:47 45.0 0.391 H -63.5 -39.5 12.0 0.104 0.287 F:P62799:0.287
 DT
DC
DC
DG
DC
DC
 9.003
9.144
6.378
4.489
8.488
9.304
 N
CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6nn6 1 P84233 98.52 1e-93 EM
 2019-02-13 ALA A:47 A:47 51.0 0.443 H -69.5 -28.8 12.0 0.104 0.339 B:P62799:0.339
 DC
DG
DT
DC
DG
DT
DG
 9.720
8.967
9.025
8.631
5.794
4.028
8.054
 N
N
O
CB
CB
N
N
 C5'
OP1
OP1
O3'
O3'
OP2
OP2
ALA E:47 E:47 46.0 0.4 H -69.1 -29.7 11.0 0.096 0.304 F:P62799:0.304
 DT
DC
DC
DG
DC
DT
DG
 9.556
8.438
5.363
3.717
8.303
9.455
9.047
 N
CB
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6nog 1 P84233 98.52 1e-93 EM
 2019-02-20 ALA A:47 A:47 45.0 0.391 H -63.1 -34.1 13.0 0.113 0.278 C:P62799:0.278
 DT
DC
DC
DG
DC
DT
DC
 9.379
9.080
5.511
3.590
7.893
9.487
9.379
 N
CB
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA B:47 E:47 46.0 0.4 H -62.4 -37.9 9.0 0.078 0.322 D:P62799:0.322
 DC
DC
DT
DC
DG
DT
DG
 9.753
9.533
9.579
8.855
5.251
3.295
7.756
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
6o96 1 P84233 98.52 1e-93 EM
 2019-04-24 ALA A:47 A:47 52.0 0.452 H -64.0 -45.8 10.0 0.087 0.365 B:P62799:0.365
 DT
DC
DC
DG
DC
DG
DT
DC
 8.852
8.319
5.160
2.929
7.725
9.288
9.548
8.924
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA E:47 E:47 50.0 0.435 H -64.6 -41.7 10.0 0.087 0.348 F:P62799:0.348
 DC
DC
DC
DT
DC
DG
DT
DG
 9.486
9.976
8.786
9.224
8.443
5.024
3.072
7.452
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6om3 1 P84233 98.52 1e-93 X-RAY
 2019-07-10 ALA A:47 A:47 50.0 0.435 H -63.9 -47.8 10.0 0.087 0.348 B:P62799:0.348
 DA
DT
DC
DC
DG
DC
DG
DT
DC
 9.957
9.412
8.112
5.046
2.953
7.926
9.290
9.750
8.583
 N
O
CB
N
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA E:47 E:47 47.0 0.409 H -64.5 -42.8 8.0 0.07 0.339 F:P62799:0.339
 DC
DC
DG
DT
DC
DG
DT
DG
 9.805
9.038
9.654
9.006
8.256
4.948
3.089
7.694
 CB
N
N
O
CB
CB
N
N
 OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA M:47 M:47 50.0 0.435 H -63.5 -44.6 NA NA NA
ALA Q:47 Q:47 45.0 0.391 H -63.5 -45.1 NA NA NA
6pa7 1 P84233 98.52 1e-93 EM
 2020-06-17 ALA A:47 A:47 44.0 0.383 H -60.6 -52.6 10.0 0.087 0.296 B:P62799:0.296
 DT
DC
DC
DG
DC
DG
DT
DC
 9.434
8.239
5.089
2.811
8.192
9.270
9.347
8.081
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA E:47 E:47 44.0 0.383 H -60.3 -53.1 8.0 0.07 0.313 F:P62799:0.313
 DA
DC
DC
DC
DT
DC
DG
DT
DG
 9.950
9.233
9.836
8.934
9.105
8.399
5.275
2.924
8.208
 CB
CB
N
N
O
CB
N
N
N
 O3'
OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
6r1u 1 P84233 98.52 1e-93 EM
 2019-04-24 ALA A:47 A:47 39.0 0.339 H -66.8 -58.7 7.0 0.061 0.278 B:P62799:0.278
 DG
DC
DT
DC
DC
DG
DC
 8.477
8.730
9.408
8.994
5.409
3.404
7.794
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 45.0 0.391 H -68.2 -52.1 11.0 0.096 0.295 F:P62799:0.296
 DT
DC
DG
DT
DG
DC
DC
 9.492
8.929
5.026
3.610
7.674
8.706
8.660
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6r25 4 A0A310TTQ1 98.52 1e-93 EM
 2019-04-24 ALA D:47 A:47 41.0 0.357 H -66.8 -58.8 8.0 0.07 0.287 E:None:0.287
 DG
DC
DT
DC
DC
DG
DC
 8.476
8.731
9.409
8.994
5.409
3.405
7.794
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA H:47 E:47 45.0 0.391 H -68.2 -52.1 10.0 0.087 0.304 I:None:0.304
 DT
DC
DG
DT
DG
DC
DC
 9.493
8.929
5.027
3.610
7.674
8.708
8.661
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6t9l 1 P84233 98.52 1e-93 EM
 2020-01-29 ALA A:47 A:47 51.0 0.443 H -62.2 -49.1 11.0 0.096 0.347 B:P62799:0.348
 DG
DT
DC
DG
DT
DG
 9.464
9.762
8.769
5.745
4.021
8.161
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 51.0 0.443 H -63.3 -47.4 10.0 0.087 0.356 F:P62799:0.357
 DT
DC
DC
DG
DC
DG
DG
 9.826
8.603
5.668
3.470
8.636
9.923
9.238
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6tda 1 P84233 98.52 1e-93 EM
 2020-03-18 ALA A:47 A:47 52.0 0.452 H -60.7 -44.7 9.0 0.078 0.374 B:P62799:0.374
 DT
DC
DC
DG
DC
DG
DG
DT
DG
 9.017
8.406
5.441
3.181
8.342
9.910
9.393
9.395
9.593
 O
CB
N
N
N
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
OP1
OP2
ALA E:47 E:47 54.0 0.47 H -59.8 -47.6 8.0 0.07 0.4 F:P62799:0.4
 DC
DC
DG
DT
DG
 9.579
8.929
5.540
3.832
8.423
 CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
6uxw 1 P84233 98.52 1e-93 EM
 2020-03-18 ALA A:47 R:47 51.0 0.443 H -62.6 -42.5 14.0 0.122 0.321 B:P62799:0.322
 DT
DC
DC
DG
DC
DG
 9.921
8.387
5.369
3.365
7.819
9.012
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
ALA E:47 V:47 49.0 0.426 H -62.7 -42.5 13.0 0.113 0.313 F:P62799:0.313
 DC
DG
DT
DC
DG
DT
DG
 9.990
8.724
9.703
8.446
5.271
3.752
7.969
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
6wz5 1 P84233 98.52 1e-93 EM
 2020-09-16 ALA A:47 A:47 52.0 0.452 H -65.8 -42.7 11.0 0.096 0.356 B:P62799:0.357
 DG
DT
DC
DT
DC
DC
DG
DC
 9.434
9.899
8.718
9.210
8.059
5.076
3.111
7.871
 CB
N
N
N
CB
CB
N
N
 OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 50.0 0.435 H -64.4 -44.9 9.0 0.078 0.357 F:P62799:0.357
 DT
DC
DG
DT
DG
DC
DC
DC
 9.288
8.038
4.849
2.897
7.692
9.320
9.834
8.648
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
6wz9 1 P84233 98.52 1e-93 EM
 2020-09-16 ALA A:47 A:47 52.0 0.452 H -65.2 -41.8 11.0 0.096 0.356 B:P62799:0.357
 DG
DC
DT
DC
DC
DG
DC
 9.694
8.871
9.267
7.867
4.884
3.000
7.795
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 50.0 0.435 H -63.6 -44.1 11.0 0.096 0.339 F:P62799:0.339
 DT
DC
DG
DT
DG
DC
DC
DC
 9.261
7.921
4.774
2.794
7.654
9.422
9.637
8.526
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
6x0n 1 P84233 98.52 1e-93 EM
 2020-09-16 ALA A:47 A:47 51.0 0.443 H -64.9 -42.6 11.0 0.096 0.347 B:P62799:0.348
 DG
DT
DC
DA
DT
DC
DC
DG
DC
 9.747
9.112
8.037
9.801
8.929
7.053
4.892
3.320
8.003
 CB
N
N
N
O
CB
N
N
N
 OP1
C5'
OP1
O3'
OP1
O3'
O3'
OP2
OP2
ALA E:47 E:47 49.0 0.426 H -63.4 -44.4 11.0 0.096 0.33 F:P62799:0.33
 DG
DT
DC
DG
DT
DG
DC
DC
DC
 9.813
8.961
6.855
4.583
3.156
8.005
9.132
9.118
8.054
 N
N
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
C3'
OP2
OP2
OP1
O3'
OP1
ALA K:47 a:47 49.0 0.426 H -64.6 -41.9 11.0 0.096 0.33 L:P62799:0.33
 DG
DT
DC
DA
DT
DC
DC
DG
DC
 9.527
9.248
8.463
9.440
8.393
6.883
4.143
2.536
7.552
 CB
N
N
N
N
CB
CB
N
N
 OP1
C5'
OP1
O3'
OP1
O3'
C3'
OP1
OP2
ALA O:47 e:47 47.0 0.409 H -62.9 -43.7 11.0 0.096 0.313 P:P62799:0.313
 DG
DT
DC
DG
DT
DG
DC
DC
DC
 9.811
9.090
6.913
4.196
2.837
7.638
8.774
8.916
7.828
 N
N
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
C3'
OP2
OP2
OP1
O3'
OP1
7at8 3 P84233 98.52 1e-93 EM
 2020-12-09 ALA C:47 D:47 54.0 0.47 H -61.5 -48.7 8.0 0.07 0.4 D:P62799:0.4
 DT
DT
DC
DG
DT
DG
 9.929
9.810
8.508
5.520
3.900
8.321
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA G:47 H:47 55.0 0.478 H -61.8 -49.1 15.0 0.13 0.348 H:P62799:0.348
 DT
DC
DC
DG
DC
DG
DC
 9.690
8.728
5.866
3.695
8.843
9.957
9.472
 N
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
7e8i 3 A0A310TTQ1 98.52 1e-93 EM
 2021-06-30 ALA C:47 A:47 49.0 0.426 H -60.7 -48.4 10.0 0.087 0.339 D:P62799:0.339
 DT
DC
DG
DT
DG
DA
DC
DC
DC
 9.205
8.182
4.883
3.346
8.138
9.789
9.555
9.880
8.741
 O
CB
CB
N
N
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
ALA G:47 E:47 53.0 0.461 H -65.2 -34.5 9.0 0.078 0.383 H:P62799:0.383
 DG
DT
DC
DT
DC
DC
DG
DC
 9.838
8.342
8.782
9.994
8.409
5.503
3.167
8.166
 CB
C
N
O
CB
N
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
7oh9 1 P84233 98.52 1e-93 EM
 2021-07-28 ALA A:47 A:47 45.0 0.391 H -62.4 -46.2 11.0 0.096 0.295 B:P62799:0.296
 DC
DG
DG
DC
DG
DT
DG
 9.369
9.724
9.770
8.169
4.740
3.251
7.468
 CB
N
N
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 50.0 0.435 H -63.1 -42.3 9.0 0.078 0.357 F:P62799:0.357
 DT
DC
DC
DG
DC
DG
DT
DG
 9.638
7.839
5.081
2.874
7.841
9.655
9.966
8.699
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
7oha 1 P84233 98.52 1e-93 EM
 2021-07-28 ALA A:47 A:47 51.0 0.443 H -62.5 -42.9 10.0 0.087 0.356 B:P62799:0.357
 DC
DC
DG
DT
DG
 9.016
8.187
5.078
3.227
8.015
 CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 55.0 0.478 H -60.5 -43.3 10.0 0.087 0.391 F:P62799:0.391
 DT
DC
DC
DG
DC
DG
DT
DG
 9.657
7.578
5.058
2.810
8.123
9.526
9.813
8.644
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
7ohb 1 P84233 98.52 1e-93 EM
 2021-07-28 ALA A:47 A:47 43.0 0.374 H -62.4 -44.0 6.0 0.052 0.322 B:P62799:0.322
 DC
DC
DG
DC
DG
DT
DG
 9.833
9.777
9.059
8.589
5.099
3.453
7.590
 CB
N
N
CB
CB
N
N
 OP1
C5'
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 42.0 0.365 H -63.6 -43.7 10.0 0.087 0.278 F:P62799:0.278
 DA
DT
DC
DC
DG
DC
DG
DT
DG
 9.957
9.029
8.290
5.288
3.542
7.503
9.747
9.480
8.333
 N
N
CB
CB
N
N
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
7ohc 1 P84233 98.52 1e-93 EM
 2021-07-28 ALA A:47 A:47 51.0 0.443 H -64.1 -42.8 9.0 0.078 0.365 B:P62799:0.365
 DC
DC
DG
DT
DC
DG
DT
DG
 9.508
9.726
8.901
9.044
8.063
4.961
3.141
7.814
 CB
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 55.0 0.478 H -65.2 -43.4 10.0 0.087 0.391 F:P62799:0.391
 DT
DC
DC
DG
DC
DG
DT
DG
 9.380
7.845
5.240
2.905
7.889
9.347
9.484
8.438
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
6x59 1 Q71DI3 98.52 1e-93 EM
 2020-09-16 ALA A:47 A:47 55.0 0.478 H -65.2 -41.4 12.0 0.104 0.374 B:P62805:0.374
 DC
DC
DT
DC
DG
DT
DG
 9.613
9.210
9.678
8.350
5.277
3.327
8.086
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 55.0 0.478 H -65.3 -41.4 12.0 0.104 0.374 F:P62805:0.374
 DT
DC
DC
DG
DC
DG
DC
 9.397
8.317
5.499
3.285
8.129
9.927
9.198
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6x5a 1 Q71DI3 98.52 1e-93 EM
 2020-09-16 ALA A:47 A:47 53.0 0.461 H -64.9 -41.0 10.0 0.087 0.374 B:P62805:0.374
 DC
DT
DC
DG
DT
DG
 9.376
9.234
8.677
5.574
3.820
7.936
 N
N
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 53.0 0.461 H -65.0 -41.1 9.0 0.078 0.383 F:P62805:0.383
 DT
DC
DC
DG
DC
DC
 9.394
8.329
5.571
3.482
8.310
9.929
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6xjd 1 Q71DI3 98.52 1e-93 EM
 2020-09-16 ALA A:47 A:47 33.0 0.287 H -62.9 -34.4 3.0 0.026 0.261 B:P62805:0.261
 DC
DT
DC
DG
DT
DG
 9.845
9.482
8.933
5.939
4.065
8.623
 N
O
CB
CB
N
N
 OP1
OP1
O3'
C3'
OP1
OP2
ALA E:47 E:47 33.0 0.287 H -62.9 -34.4 7.0 0.061 0.226 F:P62805:0.226
 DA
DT
DC
DC
DG
DC
DC
 9.347
8.945
8.030
5.726
4.625
9.656
9.889
 N
O
CB
CB
N
N
N
 OP1
OP1
O3'
OP1
OP1
OP2
OP1
7jzv 5 Q71DI3 98.52 1e-93 EM
 2021-02-17 ALA E:47 P:47 59.0 0.513 H -59.1 -34.5 19.0 0.165 0.348 F:P62805:0.348
 DG
DT
DT
DC
DC
DG
DC
 9.615
9.857
8.998
8.859
5.450
3.310
8.710
 CB
N
O
CB
CB
N
N
 OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA K:47 p:47 67.0 0.583 H -56.3 -38.8 14.0 0.122 0.461 L:P62805:0.461
 DC
DG
DT
DG
DA
DC
 9.159
5.612
3.613
8.098
9.735
8.763
 CB
N
N
N
CB
CB
 O3'
O3'
OP1
OP2
O3'
OP1
1f66 2 Q7ZT64 97.79 1e-93 X-RAY
 2000-11-27 ALA C:48 A:447 49.0 0.426 H -52.9 -47.6 9.0 0.078 0.348 D:P62806:0.348
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.948
8.739
9.176
8.151
4.479
3.081
7.786
3.969
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:48 E:647 51.0 0.443 H -63.5 -45.4 11.0 0.096 0.347 H:P62806:0.348
 DA
DT
DT
DG
DA
DA
DG
DT
DG
HOH
 9.832
8.854
8.227
4.705
3.024
8.027
9.956
9.842
8.737
6.077
 N
O
CB
CB
N
N
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
7m1x 3 A0A310TTQ1 97.79 1e-93 EM
 2021-09-29 ALA C:48 A:447 47.0 0.409 H -59.7 -53.5 12.0 0.104 0.305 D:P62799:0.304
 DG
DC
DC
DG
DC
 8.914
8.806
5.431
3.458
8.333
 CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
ALA G:48 E:647 59.0 0.513 H -62.7 -42.8 8.0 0.07 0.443 H:P62799:0.443
 DT
DC
DG
DT
DG
DC
DC
 9.902
8.397
5.407
3.785
7.830
9.449
9.253
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
3kxb 1 P84233 97.78 4e-93 X-RAY
 2010-06-23 ALA A:47 A:47 40.0 0.348 H -53.6 -47.4 4.0 0.035 0.313 B:P62799:0.313
 DG
DT
DG
DA
DA
DC
HOH
 8.728
8.686
8.372
5.676
3.278
8.325
4.863
 N
O
CB
N
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:47 E:47 63.0 0.548 H -54.6 -55.3 15.0 0.13 0.418 F:P62799:0.417
 DT
DT
DG
DA
DA
DT
DG
HOH
 8.808
8.524
6.444
4.107
8.710
9.822
8.663
7.858
 O
CB
CB
N
N
N
N
CB
 OP1
O3'
OP1
OP1
OP2
O3'
OP1
O
3av2 1 P84243 96.32 6e-93 X-RAY
 2011-06-01 ALA A:51 A:47 50.0 0.435 H -56.1 -51.4 10.0 0.087 0.348 B:P62805:0.348
 DC
DT
DT
DT
DC
DG
DA
DA
DC
 9.724
9.926
8.826
9.981
9.061
8.130
4.596
2.926
7.767
 CB
N
N
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -55.6 -46.2 11.0 0.096 0.347 F:P62805:0.348
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.555
8.168
4.701
3.086
8.153
9.688
9.872
8.794
5.846
 O
CB
CB
N
N
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5b32 1 P84243 96.32 6e-93 X-RAY
 2016-08-03 ALA A:51 A:47 53.0 0.461 H -61.6 -46.1 10.0 0.087 0.374 B:P62805:0.374
 DC
DT
DT
DC
DG
DA
DA
DC
HOH
 9.710
9.438
8.622
9.345
8.119
4.865
2.985
8.049
8.199
 CB
N
N
N
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 52.0 0.452 H -60.2 -47.6 9.0 0.078 0.374 F:P62805:0.374
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.987
9.100
8.144
4.851
3.052
7.824
9.612
8.609
7.337
 N
O
CB
CB
N
N
CB
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5b33 1 P84243 96.32 6e-93 X-RAY
 2016-08-03 ALA A:51 A:47 48.0 0.417 H -51.6 -54.0 9.0 0.078 0.339 B:P62805:0.339
 DC
DT
DT
DC
DG
DA
DA
DC
 9.703
9.936
8.942
9.072
8.358
4.755
3.038
7.797
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -64.7 -39.5 9.0 0.078 0.365 F:P62805:0.365
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.987
9.189
8.314
4.807
3.121
8.063
9.779
9.890
8.661
 N
C
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
5x7x 1 P84243 96.32 6e-93 X-RAY
 2017-04-19 ALA A:51 A:47 50.0 0.435 H -57.7 -50.6 9.0 0.078 0.357 B:P62805:0.357
 DC
DT
DT
DT
DC
DG
DA
DA
DC
HOH
 9.961
9.712
8.637
9.872
9.164
8.003
4.855
3.028
8.060
5.773
 CB
N
N
N
O
CB
CB
N
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:51 E:47 49.0 0.426 H -57.5 -49.6 10.0 0.087 0.339 F:P62805:0.339
 DA
DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.793
9.078
8.129
4.883
2.966
7.794
9.872
9.977
9.002
4.214
 N
O
CB
CB
N
N
CB
N
N
CA
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5xm0 1 P84244 96.32 6e-93 X-RAY
 2018-03-07 ALA A:51 A:47 51.0 0.443 H -59.0 -49.4 10.0 0.087 0.356 B:P62806:0.357
 DT
DC
DG
DA
DA
DC
 8.883
9.109
8.204
4.832
3.068
7.968
 N
N
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 54.0 0.47 H -58.9 -49.0 10.0 0.087 0.383 F:P62806:0.383
 DT
DT
DG
DA
DA
DT
DG
 9.302
8.147
4.851
3.083
8.040
9.786
8.761
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6a5l 16 P84243 96.32 6e-93 EM
 2018-10-03 ALA P:51 a:47 56.0 0.487 H -64.1 -48.6 12.0 0.104 0.383 Q:P62805:0.383
 DC
DG
DT
DG
DT
 9.887
6.220
4.347
8.704
9.182
 CB
N
N
N
O
 O3'
O3'
OP1
OP2
OP1
ALA T:51 e:47 61.0 0.53 H -62.7 -47.1 15.0 0.13 0.4 U:P62805:0.4
 DA
DT
DC
DC
DG
DC
DT
DG
 9.341
8.455
8.693
5.947
3.921
8.223
9.238
9.975
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6a5o 16 P84243 96.32 6e-93 EM
 2018-10-03 ALA P:51 a:47 48.0 0.417 H -65.5 -51.3 9.0 0.078 0.339 Q:P62805:0.339
 DC
DT
DC
DG
DT
DG
 8.993
9.301
8.807
5.068
3.033
7.926
 CB
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA T:51 e:47 57.0 0.496 H -68.6 -54.7 13.0 0.113 0.383 U:P62805:0.383
 DA
DT
DC
DC
DG
DC
DG
DT
DG
 9.993
9.098
8.254
4.547
2.849
7.715
9.023
9.294
8.625
 N
N
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
6a5p 16 P84243 96.32 6e-93 EM
 2018-10-03 ALA P:51 a:47 47.0 0.409 H -65.5 -51.3 9.0 0.078 0.331 Q:P62805:0.33
 DC
DC
DG
DT
DG
 9.422
9.978
5.925
4.400
8.912
 CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
ALA T:51 e:47 58.0 0.504 H -68.7 -54.6 13.0 0.113 0.391 U:P62805:0.391
 DA
DT
DC
DC
DG
DC
DT
DG
 9.958
9.154
8.690
4.586
2.935
7.571
9.851
9.027
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
C5'
OP1
6a5r 16 P84243 96.32 6e-93 EM
 2018-10-03 ALA P:51 a:47 49.0 0.426 H -65.5 -51.3 10.0 0.087 0.339 Q:P62805:0.339
 DC
DC
DG
DT
DG
 9.421
9.977
5.924
4.399
8.912
 CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
ALA T:51 e:47 59.0 0.513 H -68.6 -54.7 14.0 0.122 0.391 U:P62805:0.391
 DA
DT
DC
DC
DG
DC
DT
DG
 9.959
9.155
8.689
4.586
2.935
7.571
9.852
9.027
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
C5'
OP1
6a5t 16 P84243 96.32 6e-93 EM
 2018-10-03 ALA P:51 a:47 58.0 0.504 H -64.1 -48.7 13.0 0.113 0.391 Q:P62805:0.391
 DC
DG
DT
DG
 9.886
6.221
4.348
8.704
 CB
N
N
N
 O3'
O3'
OP1
OP2
ALA T:51 e:47 61.0 0.53 H -62.8 -46.9 14.0 0.122 0.408 U:P62805:0.409
 DA
DT
DC
DC
DG
DC
DT
DG
 9.340
8.455
8.694
5.947
3.921
8.223
9.237
9.974
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6a5u 16 P84243 96.32 6e-93 EM
 2018-10-03 ALA P:51 a:47 57.0 0.496 H -64.0 -48.6 13.0 0.113 0.383 Q:P62805:0.383
 DC
DG
DT
DG
DT
 9.887
6.220
4.346
8.704
9.182
 CB
N
N
N
O
 O3'
O3'
OP1
OP2
OP1
ALA T:51 e:47 60.0 0.522 H -62.6 -47.1 14.0 0.122 0.4 U:P62805:0.4
 DA
DT
DC
DC
DG
DC
DT
DG
 9.341
8.456
8.694
5.947
3.921
8.222
9.239
9.976
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6inq 16 P84243 96.32 6e-93 EM
 2019-04-03 ALA P:51 a:47 57.0 0.496 H -64.0 -48.7 13.0 0.113 0.383 Q:P62805:0.383
 DC
DG
DT
DG
DT
 9.886
6.220
4.347
8.705
9.182
 CB
N
N
N
O
 O3'
O3'
OP1
OP2
OP1
ALA T:51 e:47 60.0 0.522 H -62.7 -47.0 14.0 0.122 0.4 U:P62805:0.4
 DA
DT
DC
DC
DG
DC
DT
DG
 9.340
8.455
8.693
5.948
3.922
8.224
9.238
9.975
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6ir9 19 P84243 96.32 6e-93 EM
 2019-02-20 ALA S:51 a:47 56.0 0.487 H -64.1 -48.6 13.0 0.113 0.374 T:P62805:0.374
 DC
DG
DT
DG
 9.886
6.220
4.347
8.704
 CB
N
N
N
 O3'
O3'
OP1
OP2
ALA W:51 e:47 61.0 0.53 H -62.7 -47.0 15.0 0.13 0.4 X:P62805:0.4
 DA
DT
DC
DC
DG
DC
DT
DG
 9.342
8.456
8.694
5.946
3.921
8.225
9.239
9.975
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6j4w 19 P84243 96.32 6e-93 EM
 2019-02-20 ALA S:51 a:47 49.0 0.426 H -65.6 -51.3 10.0 0.087 0.339 T:P62805:0.339
 DC
DC
DG
DT
DG
 9.421
9.977
5.924
4.400
8.913
 CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
ALA W:51 e:47 59.0 0.513 H -68.7 -54.6 13.0 0.113 0.4 X:P62805:0.4
 DA
DT
DC
DC
DG
DC
DT
DG
 9.957
9.154
8.690
4.587
2.936
7.571
9.850
9.027
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
C5'
OP1
6j4x 19 P84243 96.32 6e-93 EM
 2019-02-20 ALA S:51 a:47 57.0 0.496 H -64.0 -48.6 13.0 0.113 0.383 T:P62805:0.383
 DC
DG
DT
DG
 9.887
6.219
4.347
8.703
 CB
N
N
N
 O3'
O3'
OP1
OP2
ALA W:51 e:47 61.0 0.53 H -62.6 -46.9 14.0 0.122 0.408 X:P62805:0.409
 DA
DT
DC
DC
DG
DC
DT
DG
 9.342
8.457
8.694
5.946
3.920
8.225
9.239
9.976
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6j4y 19 P84243 96.32 6e-93 EM
 2019-02-20 ALA S:51 a:47 57.0 0.496 H -64.1 -48.5 14.0 0.122 0.374 T:P62805:0.374
 DC
DG
DT
DG
 9.885
6.220
4.347
8.704
 CB
N
N
N
 O3'
O3'
OP1
OP2
ALA W:51 e:47 60.0 0.522 H -62.6 -47.1 14.0 0.122 0.4 X:P62805:0.4
 DA
DT
DC
DC
DG
DC
DT
DG
 9.340
8.455
8.694
5.946
3.920
8.224
9.239
9.976
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6j4z 18 P84243 96.32 6e-93 EM
 2019-02-20 ALA R:51 a:47 58.0 0.504 H -64.0 -48.6 12.0 0.104 0.4 S:P62805:0.4
 DC
DG
DT
DG
DT
 9.887
6.220
4.347
8.704
9.182
 CB
N
N
N
O
 O3'
O3'
OP1
OP2
OP1
ALA V:51 e:47 60.0 0.522 H -62.6 -47.1 14.0 0.122 0.4 W:P62805:0.4
 DA
DT
DC
DC
DG
DC
DT
DG
 9.341
8.456
8.694
5.948
3.922
8.222
9.238
9.976
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6j50 18 P84243 96.32 6e-93 EM
 2019-02-20 ALA R:51 a:47 58.0 0.504 H -64.0 -48.7 13.0 0.113 0.391 S:P62805:0.391
 DC
DG
DT
DG
DT
 9.888
6.221
4.348
8.705
9.181
 CB
N
N
N
O
 O3'
O3'
OP1
OP2
OP1
ALA V:51 e:47 59.0 0.513 H -62.6 -47.0 14.0 0.122 0.391 W:P62805:0.391
 DA
DT
DC
DC
DG
DC
DT
DG
 9.342
8.457
8.694
5.947
3.920
8.222
9.238
9.976
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6j51 19 P84243 96.32 6e-93 EM
 2019-02-20 ALA S:51 a:47 55.0 0.478 H -64.0 -48.6 12.0 0.104 0.374 T:P62805:0.374
 DC
DG
DT
DG
DT
 9.888
6.221
4.348
8.705
9.181
 CB
N
N
N
O
 O3'
O3'
OP1
OP2
OP1
ALA W:51 e:47 59.0 0.513 H -62.6 -47.0 13.0 0.113 0.4 X:P62805:0.4
 DA
DT
DC
DC
DG
DC
DT
DG
 9.341
8.456
8.693
5.946
3.920
8.221
9.238
9.976
 N
N
CB
CB
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O5'
OP1
6r1u 9 A0A310TTQ1 97.78 6e-93 EM
 2019-04-24 ALA M:47 NA:NA DO NA DO DO DO NA NA NA
6r25 3 A0A310TTQ1 97.78 6e-93 EM
 2019-04-24 ALA C:47 NA:NA DO NA DO DO DO NA NA NA
6vyp 1 A0A310TTQ1 97.78 6e-93 X-RAY
 2020-05-27 ALA A:47 A:47 52.0 0.452 H -60.7 -48.6 12.0 0.104 0.348 B:P62799:0.348
 DC
DC
DC
DG
DT
DC
DG
DT
DG
 9.656
9.936
9.235
9.486
8.842
8.497
4.802
3.224
7.701
 CB
N
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 52.0 0.452 H -60.2 -47.9 11.0 0.096 0.356 F:P62799:0.357
 DA
DT
DC
DC
DG
DC
DG
DT
DC
 9.610
9.219
8.378
4.960
3.178
7.989
9.293
9.953
8.831
 N
N
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA K:47 a:47 54.0 0.47 H -61.2 -48.8 NA NA NA
ALA O:47 e:47 54.0 0.47 H -60.4 -48.1 NA NA NA
4hga 2 P84243 96.32 7e-93 X-RAY
 2012-11-07 ALA B:48 B:47 64.0 0.557 -72.5 130.0 64.0 0.557 0.0 HOH
 8.802
 O
 O
6ltj 1 Q6PI79 96.32 7e-93 EM
 2020-02-12 ALA A:48 A:44 56.0 0.487 H -62.4 -42.7 11.0 0.096 0.391 B:P62799:0.391
 DC
DC
DG
DC
DG
 8.230
5.337
3.336
8.147
8.846
 CB
CB
N
N
CB
 O3'
O3'
OP1
OP1
OP1
ALA E:48 E:47 55.0 0.478 H -62.3 -42.8 14.0 0.122 0.356 F:P62799:0.357
 DC
DC
DG
DT
DG
 9.065
8.064
4.812
3.100
7.893
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
6r0c 1 P84243 96.32 7e-93 EM
 2019-09-25 ALA A:48 A:47 54.0 0.47 H -63.9 -39.2 10.0 0.087 0.383 B:P62805:0.383
 DC
DC
DT
DG
 9.701
6.180
4.766
8.856
 CB
N
N
N
 O3'
O3'
OP1
OP2
ALA E:48 E:47 43.0 0.374 H -66.0 -43.2 7.0 0.061 0.313 F:P62805:0.313
 DT
DT
DG
DT
DC
DG
 9.652
9.155
5.506
4.122
8.320
9.295
 O
CB
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6rny 1 P84243 96.32 7e-93 EM
 2019-09-25 ALA A:48 A:47 51.0 0.443 H -67.1 -45.2 16.0 0.139 0.304 B:P62805:0.304
 DT
DC
DT
DG
DC
DC
DT
DG
 9.681
9.029
9.726
8.790
8.364
5.169
2.965
8.028
 CB
N
N
O
CB
CB
N
N
 OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP2
ALA E:48 E:47 50.0 0.435 H -67.1 -45.3 14.0 0.122 0.313 F:P62805:0.313
 DT
DG
DT
DC
DT
DG
DA
 8.275
5.396
3.145
8.507
9.971
9.867
8.444
 CB
CB
N
N
CB
N
N
 O3'
C3'
OP1
OP1
OP1
C5'
OP1
3c1c 1 P02302 97.78 8e-93 X-RAY
 2008-10-07 ALA A:47 A:447 52.0 0.452 H -55.6 -52.3 11.0 0.096 0.356 B:P62799:0.357
 DG
DA
DT
DG
DA
DA
DC
HOH
 8.894
9.894
8.863
8.214
4.666
2.829
7.561
8.543
 N
N
O
CB
CB
N
N
O
 OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:47 E:647 53.0 0.461 H -44.8 -45.9 11.0 0.096 0.365 F:P62799:0.365
 DT
DT
DG
DA
DA
DG
HOH
 9.475
8.329
4.975
2.978
8.147
9.002
7.676
 O
CB
N
N
N
N
O
 OP1
O3'
O3'
OP1
OP2
OP1
O
5f99 1 P84233 97.78 8e-93 X-RAY
 2016-02-03 ALA A:47 A:47 45.0 0.391 H -46.6 -62.9 8.0 0.07 0.321 B:P62799:0.322
 DT
DG
DC
DA
DC
DG
DA
HOH
 9.963
8.938
8.992
8.178
5.273
3.205
8.088
8.005
 N
N
O
CB
N
N
N
CB
 O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:47 E:47 53.0 0.461 H -54.5 -53.8 10.0 0.087 0.374 F:P62799:0.374
 DA
DA
DC
DT
DT
DT
DA
DG
HOH
 9.815
8.688
8.092
4.953
2.929
8.478
9.446
9.096
4.500
 N
O
CB
CB
N
N
CB
N
CA
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5omx 3 P84233 97.78 8e-93 X-RAY
 2017-11-15 ALA C:47 A:47 46.0 0.4 H -67.2 -45.3 8.0 0.07 0.33 D:P62799:0.33
 DT
DT
DG
DT
DT
DG
DA
DA
HOH
 9.871
9.843
8.851
9.220
8.315
4.913
3.078
7.984
9.350
 CB
N
N
O
CB
CB
N
N
O
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 50.0 0.435 H -62.4 -44.7 10.0 0.087 0.348 H:P62799:0.348
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.323
8.124
4.937
3.122
7.914
9.940
9.981
8.878
6.064
 O
CB
CB
N
N
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
6s01 1 A0A310TTQ1 97.78 8e-93 EM
 2019-12-18 ALA A:47 A:47 52.0 0.452 H -69.2 -44.1 12.0 0.104 0.348 B:P62799:0.348
 DC
DC
DT
DC
DG
DT
DG
 8.520
8.963
9.805
8.280
5.217
3.194
7.848
 C
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:47 E:47 49.0 0.426 H -68.6 -46.2 10.0 0.087 0.339 F:P62799:0.339
 DT
DC
DC
DG
DC
DG
DT
DG
 9.026
8.522
5.450
3.472
7.962
9.919
9.466
9.169
 N
CB
N
N
N
CB
C
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
3wtp 5 P84243 96.32 1e-92 X-RAY
 2014-12-03 ALA E:52 E:47 49.0 0.426 H -58.0 -51.1 8.0 0.07 0.356 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DG
 9.535
8.205
5.026
2.947
7.911
9.637
8.705
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
1zla 2 288992 97.78 1e-92 X-RAY
 2006-02-28 ALA C:47 A:447 53.0 0.461 H -61.6 -38.5 9.0 0.078 0.383 D:P62799:0.383
 DG
DT
DG
DA
DA
DC
HOH
 9.103
9.379
8.249
5.028
3.072
7.890
4.143
 N
C
CB
CB
N
N
CB
 OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 51.0 0.443 H -56.6 -44.2 9.0 0.078 0.365 H:P62799:0.365
 DA
DT
DT
DG
DA
DA
DG
DG
 9.845
9.455
8.290
4.755
2.968
8.050
9.928
8.664
 N
C
CB
CB
N
N
CB
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
5kdm 1 P84243 96.3 5e-92 X-RAY
 2016-09-07 ALA A:47 A:47 64.0 0.557 -58.2 148.1 64.0 0.557 0.0
7a08 6 P84243 96.3 5e-92 EM
 2020-09-23 ALA F:47 d:47 50.0 0.435 H -88.7 -33.9 7.0 0.061 0.374 K:P62805:0.374
 DT
DC
DC
DG
DC
DG
DT
DC
 9.351
7.960
5.116
3.050
8.238
9.838
9.633
8.704
 N
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA J:47 NA:NA DO NA DO DO DO NA NA NA
1p3b 2 Q7ZT64 97.04 1e-91 X-RAY
 2004-02-24 ALA C:47 A:447 45.0 0.391 H -54.6 -58.6 7.0 0.061 0.33 D:P62799:0.33
 DC
DT
DG
DT
DG
DA
DA
DC
HOH
 9.513
9.899
8.954
8.816
8.322
5.010
3.017
7.706
9.724
 CB
N
N
O
CB
N
N
N
O
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 47.0 0.409 H -45.2 -51.8 7.0 0.061 0.348 H:P62799:0.348
 DT
DT
DG
DA
DA
DG
DG
HOH
 8.972
8.159
4.912
2.759
8.097
9.261
8.961
6.202
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
1p3f 2 Q7ZT64 97.04 1e-91 X-RAY
 2004-02-24 ALA C:47 A:447 50.0 0.435 H -59.1 -52.1 8.0 0.07 0.365 D:P62799:0.365
 DC
DT
DG
DT
DG
DA
DA
DC
HOH
 9.668
9.929
8.893
8.932
8.172
4.904
3.001
7.741
7.870
 CB
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 50.0 0.435 H -53.7 -48.7 9.0 0.078 0.357 H:P62799:0.357
 DT
DT
DG
DA
DA
DG
DG
HOH
 9.328
8.156
5.010
2.863
8.056
9.542
8.692
6.656
 O
CB
N
N
N
CB
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
1p3g 2 Q7ZT64 97.04 1e-91 X-RAY
 2004-02-24 ALA C:47 A:447 48.0 0.417 H -60.2 -48.1 7.0 0.061 0.356 D:P62799:0.357
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.763
8.856
9.366
8.191
4.945
3.013
7.920
6.386
 CB
N
O
CB
CB
N
N
C
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 51.0 0.443 H -63.5 -44.1 11.0 0.096 0.347 H:P62799:0.348
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.788
9.442
7.999
4.551
2.812
8.210
9.909
8.715
5.935
 N
C
CB
CB
N
N
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O
1p3i 2 Q7ZT64 97.04 1e-91 X-RAY
 2004-02-24 ALA C:47 A:447 51.0 0.443 H -58.6 -47.8 9.0 0.078 0.365 D:P62799:0.365
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.566
8.800
9.276
7.930
4.801
2.991
8.223
4.493
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 51.0 0.443 H -65.6 -39.4 11.0 0.096 0.347 H:P62799:0.348
 DT
DT
DG
DA
DA
DG
DT
DG
HOH
 9.498
7.959
4.687
3.002
8.017
9.555
9.895
8.768
4.697
 C
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
1p3o 2 Q7ZT64 97.04 1e-91 X-RAY
 2004-02-24 ALA C:47 A:447 46.0 0.4 H -54.8 -61.0 7.0 0.061 0.339 D:P62799:0.339
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.634
8.720
8.885
8.317
4.969
2.869
7.844
7.411
 CB
N
O
CB
N
N
N
O
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 51.0 0.443 H -55.9 -51.0 9.0 0.078 0.365 H:P62799:0.365
 DA
DT
DT
DG
DA
DA
DG
DT
DG
HOH
 9.964
9.310
8.233
4.945
3.046
8.199
9.943
9.889
8.779
5.855
 N
O
CB
CB
N
N
CB
N
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
1p3p 2 Q7ZT64 97.04 1e-91 X-RAY
 2004-02-24 ALA C:47 A:447 46.0 0.4 H -63.2 -47.6 8.0 0.07 0.33 D:P62799:0.33
 DC
DG
DA
DT
DG
DA
DA
DC
HOH
 9.816
8.709
9.955
8.956
8.301
4.960
3.208
7.817
7.613
 CB
N
N
O
CB
CB
N
N
O
 OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 53.0 0.461 H -64.2 -40.8 9.0 0.078 0.383 H:P62799:0.383
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.927
9.449
8.243
4.873
2.879
8.147
9.960
8.705
6.027
 N
C
CB
CB
N
N
C
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
7cro 1 Q92133 96.3 1e-91 EM
 2020-10-21 ALA A:47 M:47 63.0 0.548 H -103.5 -16.3 15.0 0.13 0.418 B:P62799:0.417
 DC
DC
DG
DC
DG
 8.671
5.772
4.176
8.867
9.986
 CB
CB
N
N
CB
 O3'
O3'
OP1
OP2
OP1
ALA E:47 E:47 55.0 0.478 T -65.8 -45.9 13.0 0.113 0.365 F:P62799:0.365
 DC
DC
DG
DT
DG
 9.784
8.625
5.835
4.097
8.297
 N
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
7crp 1 Q92133 96.3 1e-91 EM
 2020-10-21 ALA A:47 M:47 54.0 0.47 T -99.4 -11.5 14.0 0.122 0.348 B:P62799:0.348
 DC
DC
DG
DC
 8.801
5.758
4.087
9.103
 CB
CB
N
N
 O3'
O3'
OP1
OP2
ALA E:47 E:47 50.0 0.435 H -73.3 -45.7 14.0 0.122 0.313 F:P62799:0.313
 DC
DT
DC
DG
DT
DG
 9.529
9.994
8.589
5.749
3.940
8.168
 N
O
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
7crq 1 Q92133 96.3 1e-91 EM
 2020-10-21 ALA A:47 M:47 60.0 0.522 H -94.5 -18.7 17.0 0.148 0.374 B:P62799:0.374
 DC
DC
DG
DC
 8.748
5.786
3.975
8.977
 CB
CB
N
N
 O3'
O3'
OP1
OP2
ALA E:47 E:47 50.0 0.435 T -94.1 -41.8 13.0 0.113 0.322 F:P62799:0.322
 DC
DG
DT
DG
 8.807
6.073
4.251
8.747
 CB
CB
N
N
 O3'
O3'
OP1
OP2
7crr 1 Q92133 96.3 1e-91 EM
 2020-10-21 ALA A:47 M:47 59.0 0.513 T -97.5 -24.7 15.0 0.13 0.383 B:P62799:0.383
 DC
DC
DG
DC
DG
 8.415
5.378
3.716
9.001
9.466
 CB
CB
N
N
CB
 O3'
O3'
OP1
OP2
OP1
ALA E:47 E:47 54.0 0.47 T -86.8 -42.1 17.0 0.148 0.322 F:P62799:0.322
 DC
DT
DC
DG
DT
DG
 9.167
9.620
8.621
5.175
3.525
7.889
 N
O
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
1m18 2 P02302 96.3 2e-91 X-RAY
 2003-02-18 ALA C:47 A:447 52.0 0.452 H -58.2 -51.9 10.0 0.087 0.365 D:P02304:0.365
 DC
DT
DG
DT
DG
DA
DA
DC
HOH
 9.764
9.981
8.691
9.054
8.187
4.828
2.950
7.919
4.332
 CB
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 51.0 0.443 H -63.1 -47.3 10.0 0.087 0.356 H:P02304:0.357
 DA
DT
DT
DG
DA
DA
DT
DG
HOH
 9.911
9.154
8.270
4.796
2.984
7.972
9.897
8.685
3.792
 N
O
CB
N
N
N
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O
1m19 2 P02302 96.3 2e-91 X-RAY
 2003-02-18 ALA C:47 A:447 48.0 0.417 H -60.7 -42.8 10.0 0.087 0.33 D:P02304:0.33
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.838
8.583
9.446
8.066
4.691
3.191
7.918
6.999
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 51.0 0.443 H -56.2 -46.0 11.0 0.096 0.347 H:P02304:0.348
 DT
DT
DG
DA
DA
DT
DG
HOH
 8.990
8.178
4.764
3.099
8.007
9.970
8.829
3.445
 O
CB
CB
N
N
N
N
CB
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
O
1m1a 2 P02302 96.3 2e-91 X-RAY
 2003-02-18 ALA C:47 A:447 50.0 0.435 H -62.0 -49.8 7.0 0.061 0.374 D:P02304:0.374
 DG
DT
DG
DT
DT
DG
DA
DA
HOH
 9.915
9.772
8.683
9.228
8.135
4.822
2.929
8.038
9.264
 CB
N
N
O
CB
CB
N
N
O
 OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 49.0 0.426 H -58.1 -55.4 10.0 0.087 0.339 H:P02304:0.339
 DA
DT
DG
DA
DA
DC
DC
DG
HOH
 9.615
8.576
8.201
4.717
2.971
8.004
9.824
9.958
6.686
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5xm1 1 ? 94.85 2e-91 X-RAY
 2018-03-07 ALA A:51 A:47 50.0 0.435 H -56.0 -53.5 10.0 0.087 0.348 B:P62806:0.348
 DC
DT
DT
DC
DG
DA
DA
DC
 9.743
9.977
8.803
9.126
8.272
4.950
2.936
8.355
 CB
C
N
O
CB
N
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 54.0 0.47 H -53.8 -52.9 11.0 0.096 0.374 F:P62806:0.374
 DT
DT
DG
DA
DA
DT
DT
DG
 9.086
8.262
4.827
2.994
8.119
9.477
9.935
8.823
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
6ven 1 P84233 96.3 2e-91 EM
 2020-01-15 ALA A:47 A:47 55.0 0.478 H -66.2 -48.5 9.0 0.078 0.4 B:P62799:0.4
 DT
DC
DC
DG
DC
DG
DC
 9.574
8.435
5.596
3.481
8.101
9.723
9.139
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA E:47 E:47 50.0 0.435 H -63.4 -49.3 5.0 0.043 0.392 F:P62799:0.391
 DC
DC
DT
DC
DG
DT
DG
 9.252
8.816
9.770
8.813
5.404
3.441
8.371
 CB
N
O
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
6nj9 1 P84233 96.3 2e-91 EM
 2019-02-20 ALA A:47 A:47 53.0 0.461 H -65.3 -47.5 12.0 0.104 0.357 B:P62799:0.357
 DT
DC
DC
DG
DC
DG
DC
 9.638
8.425
5.414
3.350
8.422
9.697
9.084
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA E:47 E:47 53.0 0.461 H -65.4 -47.5 10.0 0.087 0.374 F:P62799:0.374
 DC
DC
DT
DC
DG
DT
DG
 9.705
9.109
9.468
8.427
5.283
3.365
7.978
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
6nqa 8 P84233 96.3 2e-91 EM
 2019-02-20 ALA H:47 E:47 59.0 0.513 H -64.7 -41.3 10.0 0.087 0.426 C:P62799:0.426
 DT
DC
DC
DG
DC
DG
DC
 9.760
9.069
5.870
3.599
8.411
9.891
9.414
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
ALA I:47 A:47 58.0 0.504 H -65.4 -43.2 9.0 0.078 0.426 L:P62799:0.426
 DC
DC
DT
DC
DG
DT
DG
 9.735
8.989
9.585
8.949
5.266
3.396
7.677
 N
N
O
CB
N
N
N
 C5'
OP1
OP1
O3'
O3'
OP1
OP2
5gxq 1 ? 94.12 3e-91 X-RAY
 2017-04-19 ALA A:51 A:47 52.0 0.452 H -62.7 -51.8 11.0 0.096 0.356 B:P62805:0.357
 DC
DT
DT
DC
DG
DA
DA
DC
 9.975
9.981
8.654
9.137
8.159
4.683
2.982
7.805
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 53.0 0.461 H -59.3 -42.8 12.0 0.104 0.357 F:P62805:0.357
 DT
DT
DG
DA
DA
DT
DT
DG
 9.421
8.160
4.884
3.052
7.983
9.676
9.999
8.613
 O
CB
CB
N
N
CB
C
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
1p3k 2 Q7ZT64 96.3 6e-91 X-RAY
 2004-02-24 ALA C:47 A:447 40.0 0.348 H -66.7 -53.5 5.0 0.043 0.305 D:P62799:0.304
 DG
DA
DT
DG
DA
DA
DC
HOH
 8.608
9.901
8.661
8.673
5.103
3.135
8.019
8.974
 N
N
O
CB
CB
N
N
O
 OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 46.0 0.4 H -50.8 -46.3 9.0 0.078 0.322 H:P62799:0.322
 DA
DT
DT
DG
DA
DA
DG
DT
DG
HOH
 9.957
9.276
8.380
4.931
2.678
8.006
9.852
9.924
8.771
8.225
 N
C
CB
CB
N
N
CB
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5ong 3 P84233 97.04 6e-91 X-RAY
 2017-11-22 ALA C:47 A:47 46.0 0.4 H -60.6 -47.9 9.0 0.078 0.322 D:P62799:0.322
 DT
G47
DG
DA
DT
DT
DG
DA
DA
 9.600
9.627
9.082
9.807
9.271
8.318
4.796
3.197
7.229
 CB
N
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA G:47 E:47 53.0 0.461 H -66.6 -43.7 9.0 0.078 0.383 H:P62799:0.383
 DT
DT
DG
DA
DA
DT
G47
DG
HOH
 9.369
8.220
4.768
3.056
7.832
9.864
9.869
9.151
8.679
 C
CB
CB
N
N
CB
N
N
O
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5onw 3 P84233 97.04 6e-91 X-RAY
 2017-11-22 ALA C:47 A:47 51.0 0.443 H -59.9 -54.0 10.0 0.087 0.356 D:P62799:0.357
 DT
DG
DA
DT
DT
DG
DA
DA
HOH
 9.625
9.046
9.891
9.429
8.490
5.120
3.122
7.914
9.109
 CB
N
N
O
CB
CB
N
N
O
 OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 47.0 0.409 H -69.0 -40.7 9.0 0.078 0.331 H:P62799:0.33
 DT
DT
DG
DA
DA
DT
DG
HOH
 9.121
8.353
4.874
3.132
7.788
9.929
9.271
9.082
 N
CB
CB
N
N
CB
N
O
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
1p3a 2 Q7ZT64 96.3 7e-91 X-RAY
 2004-02-24 ALA C:47 A:447 44.0 0.383 H -60.8 -48.6 7.0 0.061 0.322 D:P62799:0.322
 DG
DT
DG
DA
DA
DC
 8.709
8.696
8.276
5.018
3.256
7.845
 N
O
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA G:47 E:647 51.0 0.443 H -58.1 -43.4 8.0 0.07 0.373 H:P62799:0.374
 DA
DT
DT
DG
DA
DA
DG
DT
DG
HOH
 9.907
9.097
8.389
4.956
2.836
8.172
9.888
9.785
8.660
8.521
 N
C
CB
CB
N
N
CB
C
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
O
1p3m 2 Q7ZT64 96.3 8e-91 X-RAY
 2004-02-24 ALA C:47 A:447 42.0 0.365 H -63.3 -67.4 5.0 0.043 0.322 D:P62799:0.322
 DC
DT
DG
DA
DT
DG
DA
DA
DC
HOH
 9.787
9.808
8.655
9.989
8.723
8.517
5.954
3.489
8.507
9.505
 CB
N
N
N
O
CB
N
N
N
O
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 46.0 0.4 H -54.8 -48.5 6.0 0.052 0.348 H:P62799:0.348
 DA
DT
DT
DG
DA
DA
DG
DG
HOH
 9.942
8.720
8.465
5.181
3.241
8.822
9.917
8.834
7.421
 N
O
CB
CB
N
N
CB
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
1p34 2 Q7ZT64 96.3 1e-90 X-RAY
 2004-02-24 ALA C:47 A:447 51.0 0.443 H -64.7 -48.3 8.0 0.07 0.373 D:P62799:0.374
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.511
8.891
9.035
8.391
4.779
3.018
7.804
8.200
 CB
N
O
CB
CB
N
N
O
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 49.0 0.426 H -60.4 -47.2 10.0 0.087 0.339 H:P62799:0.339
 DT
DT
DG
DA
DA
DG
DG
HOH
 9.141
8.249
4.442
2.939
8.162
9.770
8.846
5.867
 O
CB
CB
N
N
CB
N
C
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
1p3l 2 Q7ZT64 96.3 1e-90 X-RAY
 2004-02-24 ALA C:47 A:447 45.0 0.391 H -54.2 -55.2 5.0 0.043 0.348 D:P62799:0.348
 DT
DG
DT
DG
DA
DA
DC
HOH
 9.924
8.674
8.551
8.529
5.659
3.530
8.404
6.527
 N
N
O
CB
N
N
N
N
 O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:647 49.0 0.426 H -55.5 -54.5 5.0 0.043 0.383 H:P62799:0.383
 DT
DT
DG
DA
DA
DT
DG
HOH
 8.781
8.639
6.331
4.234
8.826
9.868
8.773
3.760
 O
CB
N
N
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
O
4h9o 1 P84243 94.07 3e-90 X-RAY
 2012-10-10 ALA A:47 A:47 56.0 0.487 -70.3 144.0 56.0 0.487 0.0 PO4
PO4
HOH
 6.233
8.785
2.907
 C
C
N
 O4
O2
O
4h9n 1 P84243 93.33 6e-89 X-RAY
 2012-10-10 ALA A:47 A:47 32.0 0.278 -71.7 143.9 32.0 0.278 0.0 PO4
PO4
HOH
 6.230
8.796
2.870
 C
C
N
 O1
O1
O
4h9q 1 P84243 93.33 6e-89 X-RAY
 2012-10-17 ALA A:47 A:47 31.0 0.27 -74.3 144.3 31.0 0.27 0.0 PO4
PO4
HOH
 8.767
6.304
2.915
 C
C
N
 O3
O3
O
4h9s 1 P84243 91.85 3e-87 X-RAY
 2012-10-17 ALA A:47 A:47 30.0 0.261 -76.5 156.9 30.0 0.261 0.0 HOH
 8.287
 O
 O
ALA B:47 B:47 31.0 0.27 -72.4 143.6 NA NA NA
4z5t 1 Q6NXT2 93.38 5e-87 X-RAY
 2016-02-10 ALA A:50 A:46 48.0 0.417 H -60.9 -50.1 9.0 0.078 0.339 B:P62805:0.339
 DC
DT
DT
DC
DG
DA
DA
DC
 9.475
9.793
8.826
9.842
8.216
4.832
3.040
8.084
 CB
N
N
O
CB
CB
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:50 E:46 45.0 0.391 H -61.0 -47.9 8.0 0.07 0.321 F:P62805:0.322
 DT
DT
DG
DA
DA
DT
DG
 9.329
8.520
5.173
3.015
7.809
9.503
8.614
 O
CB
N
N
N
C
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
4kud 1 P61830 88.97 4e-86 X-RAY
 2013-08-07 ALA A:48 A:47 45.0 0.391 H -56.6 -60.6 7.0 0.061 0.33 B:P02309:0.33
 DC
DT
DG
DT
DG
DA
DA
DC
HOH
 9.817
9.461
8.735
9.398
8.101
4.745
2.874
7.631
7.573
 CB
C
N
O
CB
CB
N
N
CA
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:48 E:47 47.0 0.409 H -54.0 -58.3 11.0 0.096 0.313 F:P02309:0.313
 DT
DT
DG
DA
DA
DG
DT
DG
HOH
 9.790
8.288
4.760
2.950
8.091
9.806
8.460
8.912
7.102
 O
CB
CB
N
N
CB
N
N
O
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
O
5zba 3 P61830 88.97 4e-86 X-RAY
 2018-07-25 ALA C:48 C:47 98.0 0.852 -88.9 126.7 70.0 0.609 0.243 D:P02309:0.243
 IOD
 5.445
 O
 I
5zbb 3 P61830 88.97 4e-86 X-RAY
 2018-07-25 ALA C:48 C:47 96.0 0.835 -87.4 143.8 63.0 0.548 0.287 D:P02309:0.287
 IOD
 5.398
 O
 I
7k7g 1 P61830 88.97 4e-86 EM
 2021-03-31 ALA A:48 A:48 54.0 0.47 S -138.7 -25.5 13.0 0.113 0.357 B:P02309:0.357
 DC
DG
DT
DG
 8.913
5.960
5.062
7.972
 CB
CB
N
N
 OP1
O3'
OP1
OP1
ALA E:48 E:48 54.0 0.47 S -138.7 -25.4 12.0 0.104 0.366 F:P02309:0.365
 DC
DC
DG
DC
DG
DG
 9.763
6.951
5.193
8.150
9.602
8.858
 CB
N
N
N
CB
CB
 O3'
O3'
OP2
OP1
C5'
OP1
6gej 2 P61830 88.24 2e-85 EM
 2018-10-17 ALA B:48 A:47 48.0 0.417 H -63.3 -38.7 7.0 0.061 0.356 E:P02309:0.357
 DC
DG
DT
DG
 9.260
5.356
3.595
7.983
 CB
N
N
N
 O3'
O3'
OP1
OP2
ALA C:48 B:47 49.0 0.426 H -63.3 -38.7 7.0 0.061 0.365 D:P02309:0.365
 DC
DC
DG
DC
DC
 8.926
5.610
3.682
8.821
9.503
 CB
N
N
N
N
 O3'
O3'
OP1
OP2
OP1
6gen 2 P61830 88.24 2e-85 EM
 2018-10-17 ALA B:48 A:47 53.0 0.461 H -68.5 -34.7 9.0 0.078 0.383 E:P02309:0.383
 DC
DG
DT
DG
 9.201
5.360
3.747
7.987
 CB
N
N
N
 O3'
O3'
OP1
OP2
ALA C:48 B:47 51.0 0.443 H -68.5 -34.7 9.0 0.078 0.365 D:P02309:0.365
 DC
DC
DG
DC
DT
DC
 8.984
5.749
3.859
8.774
9.620
8.993
 CB
N
N
N
C
N
 O3'
O3'
OP1
OP2
OP1
OP1
4jjn 1 P61830 88.89 4e-85 X-RAY
 2013-05-15 ALA A:47 A:47 47.0 0.409 H -61.7 -50.0 12.0 0.104 0.305 B:P02309:0.304
 DT
DC
DC
DG
DC
DG
DT
DC
 9.581
8.076
4.642
2.862
7.777
9.156
9.557
8.627
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA E:47 E:47 45.0 0.391 H -60.2 -43.4 11.0 0.096 0.295 F:P02309:0.296
 DC
DC
DC
DG
DT
DC
DG
DT
DG
 9.486
9.567
8.706
9.804
9.051
8.090
4.706
3.330
7.697
 CB
N
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
1id3 2 P61830 88.15 2e-84 X-RAY
 2001-09-28 ALA C:47 A:47 45.0 0.391 H -55.3 -65.3 7.0 0.061 0.33 D:P02309:0.33
 DC
DT
DG
DT
DG
DA
DA
DC
HOH
 9.601
9.661
8.703
8.997
8.533
4.916
3.094
8.061
7.843
 CB
N
N
O
CB
N
N
N
O
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA G:47 E:47 45.0 0.391 H -54.3 -49.6 10.0 0.087 0.304 H:P02309:0.304
 DA
DT
DT
DG
DA
DA
DT
DG
MN
 9.987
9.000
8.262
4.465
2.868
7.565
9.697
8.616
8.508
 N
O
CB
CB
N
N
N
N
O
 O3'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
MN
4h9p 1 P84243 93.33 2e-81 X-RAY
 2012-10-17 ALA A:47 A:47 48.0 0.417 -70.5 145.3 48.0 0.417 0.0 PO4
HOH
 6.037
3.387
 C
CB
 O3
O
4h9r 1 P84243 93.33 2e-81 X-RAY
 2012-10-17 ALA A:47 A:47 39.0 0.339 -70.0 146.2 39.0 0.339 0.0 PO4
PO4
HOH
 8.633
6.300
3.001
 C
C
N
 O3
O2
O
7dbh 1 ? 89.31 3e-80 EM
 2022-01-19 ALA A:51 NA:NA DO NA DO DO DO NA NA NA
ALA E:51 NA:NA DO NA DO DO DO NA NA NA
7vbm 1 ? 89.31 3e-80 EM
 2022-01-19 ALA A:51 NA:NA DO NA DO DO DO NA NA NA
ALA E:51 NA:NA DO NA DO DO DO NA NA NA
5zbx 1 P68431,P49450 85.51 5e-80 X-RAY
 2019-02-13 ALA A:51 A:47 47.0 0.409 H -66.4 -44.2 9.0 0.078 0.331 B:P62805:0.33
 DT
DT
DT
DC
DG
DA
DA
DC
 9.778
8.873
9.991
8.991
8.021
5.041
3.112
8.211
 C
N
N
O
CB
CB
N
N
 OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -63.5 -43.9 11.0 0.096 0.347 F:P62805:0.348
 DT
DT
DG
DA
DA
DT
DG
 9.216
8.226
4.894
3.103
8.027
9.929
8.853
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
1aoi 2 P02302 98.28 8e-80 X-RAY
 1998-09-30 ALA C:28 A:47 50.0 0.435 H -56.2 -43.7 9.0 0.078 0.357 D:P62799:0.357
 DG
DT
DG
DA
DA
DC
 9.005
9.026
8.243
4.826
3.001
7.577
 N
C
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA G:28 E:47 51.0 0.443 H -54.3 -35.6 8.0 0.07 0.373 H:P62799:0.374
 DT
DT
DG
DA
DA
DT
DG
HOH
 9.401
8.033
4.903
3.138
7.911
9.605
8.862
7.976
 N
CB
CB
N
N
CB
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
5z23 1 P68431,P49450 84.06 9e-78 X-RAY
 2019-02-13 ALA A:51 A:47 51.0 0.443 H -61.7 -42.9 8.0 0.07 0.373 B:P62805:0.374
 DC
DT
DG
DT
DG
DA
DA
DC
 9.722
9.997
8.603
9.738
8.150
4.829
3.152
7.960
 CB
C
N
N
CB
CB
N
N
 OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:51 E:47 51.0 0.443 H -61.1 -46.7 8.0 0.07 0.373 F:P62805:0.374
 DA
DT
DT
DG
DA
DA
DT
DT
DG
 9.945
8.851
8.255
5.269
3.012
8.364
9.425
9.478
8.559
 N
N
CB
N
N
N
CB
C
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
5bs7 1 P84233 99.1 2e-77 X-RAY
 2015-07-08 ALA A:23 NA:NA DO NA DO DO DO NA NA NA
ALA B:23 NA:NA DO NA DO DO DO NA NA NA
5bsa 1 P84233 99.09 9e-77 X-RAY
 2015-07-08 ALA A:22 NA:NA DO NA DO DO DO NA NA NA
ALA B:22 NA:NA DO NA DO DO DO NA NA NA
3w98 1 P68431 100.0 1e-76 X-RAY
 2013-08-28 ALA A:24 A:47 44.0 0.383 H -47.8 -54.8 7.0 0.061 0.322 B:P62805:0.322
 DC
DT
DT
DC
DG
DA
DA
DC
 9.774
9.808
9.263
9.427
8.184
4.770
3.195
7.980
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:24 E:47 48.0 0.417 H -51.5 -46.6 9.0 0.078 0.339 F:P62805:0.339
 DT
DT
DG
DA
DA
DG
 9.424
8.232
5.092
3.082
8.349
9.291
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
4z2m 2 P68431 100.0 7e-72 X-RAY
 2016-03-09 ALA B:14 NA:NA DO NA DO DO DO NA NA NA
ALA D:14 NA:NA DO NA DO DO DO NA NA NA
6ipu 1 P68431 100.0 7e-69 X-RAY
 2020-01-15 ALA A:10 A:47 52.0 0.452 H -56.4 -50.2 9.0 0.078 0.374 B:P62805:0.374
 DC
DT
DG
DT
DG
DA
DA
DC
HOH
 9.664
9.941
8.736
9.397
8.002
4.799
3.047
7.889
4.253
 CB
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:10 E:47 52.0 0.452 H -52.0 -48.8 10.0 0.087 0.365 F:P62805:0.365
 DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.398
8.085
4.789
3.045
7.763
9.825
9.855
8.782
3.538
 O
CB
N
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
6iq4 1 P68431 100.0 7e-69 X-RAY
 2019-10-30 ALA A:10 A:47 50.0 0.435 H -58.2 -54.9 9.0 0.078 0.357 B:P62805:0.357
 DC
DG
DT
DG
DA
DA
DC
HOH
 9.692
8.879
9.354
8.059
4.696
2.956
7.822
8.056
 CB
N
O
CB
CB
N
N
CB
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:10 E:47 55.0 0.478 H -52.8 -47.5 10.0 0.087 0.391 F:P62805:0.391
 DT
DG
DA
DA
DC
DC
DT
DG
HOH
 9.424
8.111
4.726
2.999
7.796
9.893
9.974
8.789
6.822
 O
CB
CB
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
6jxd 1 P68431 100.0 7e-69 X-RAY
 2020-01-15 ALA A:10 A:47 49.0 0.426 H -46.2 -49.3 11.0 0.096 0.33 B:P62805:0.33
 DC
DA
DT
DA
DT
DC
DG
DT
DG
HOH
 9.060
9.717
8.964
9.891
8.721
8.433
4.860
2.921
7.819
7.909
 CB
N
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
7ccq 1 P68431 100.0 7e-69 EM
 2020-10-07 ALA A:10 A:47 44.0 0.383 H -69.2 -44.8 10.0 0.087 0.296 B:None:0.296
 DG
DT
DC
DT
DC
DC
DG
DC
 9.625
9.458
8.692
9.488
8.511
4.813
3.420
7.675
 CB
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:10 E:47 49.0 0.426 H -64.7 -40.4 9.0 0.078 0.348 F:None:0.348
 DT
DC
DG
DT
DG
DC
DC
DC
 9.698
8.614
5.091
3.041
7.845
9.817
9.449
8.586
 O
CB
CB
N
N
CB
C
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
7ccr 1 P68431 100.0 7e-69 EM
 2020-10-07 ALA A:10 A:47 41.0 0.357 H -68.9 -46.1 5.0 0.043 0.314 B:None:0.313
 DT
DC
DA
DT
DC
DC
DG
DC
 9.422
9.954
9.590
8.737
8.982
5.321
3.845
7.890
 N
N
N
N
CB
CB
N
N
 C5'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:10 E:47 45.0 0.391 H -63.1 -38.7 6.0 0.052 0.339 F:None:0.339
 DT
DC
DG
DT
DG
DC
DC
DC
 9.491
8.433
5.098
3.306
8.333
9.884
9.091
8.921
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
ALA L:10 L:47 42.0 0.365 H -68.8 -46.0 5.0 0.043 0.322 M:None:0.322
 DT
DC
DA
DT
DC
DC
DG
DC
 9.423
9.955
9.590
8.737
8.982
5.321
3.845
7.890
 N
N
N
N
CB
CB
N
N
 C5'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA P:10 P:47 44.0 0.383 H -63.1 -38.7 5.0 0.043 0.34 Q:None:0.339
 DT
DC
DG
DT
DG
DC
DC
DC
 9.491
8.434
5.098
3.306
8.332
9.884
9.091
8.921
 O
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
OP1
7ea5 1 A0A310TTQ1 97.03 2e-68 EM
 2021-07-14 ALA A:14 A:47 49.0 0.426 H -65.6 -48.0 13.0 0.113 0.313 B:None:0.313
 DC
DG
DT
DG
 8.909
5.484
3.612
8.751
 CB
CB
N
N
 O3'
O3'
OP2
OP2
ALA E:14 E:47 48.0 0.417 H -66.6 -45.3 10.0 0.087 0.33 F:None:0.33
 DT
DC
DC
DG
DC
DC
 9.913
8.642
5.751
3.464
8.689
9.377
 O
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
6jxd 5 P68431 100.0 3e-68 X-RAY
 2020-01-15 ALA E:10 E:47 50.0 0.435 H -55.6 -50.1 10.0 0.087 0.348 F:P62805:0.348
 DT
DC
DC
DG
DC
DG
DA
DT
HOH
 8.829
8.195
5.008
3.108
8.086
8.825
9.828
9.003
8.053
 O
CB
N
N
N
CB
N
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
5wcu 1 P02299 98.98 1e-67 X-RAY
 2018-10-31 ALA A:10 A:47 43.0 0.374 H -60.0 -45.6 7.0 0.061 0.313 B:P84040:0.313
 DA
DC
DC
DC
DT
DC
DG
DT
DG
 9.806
9.324
8.638
8.003
9.132
8.227
4.813
2.822
8.256
 CB
CB
N
N
N
CB
CB
N
N
 O3'
OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:10 E:47 57.0 0.496 H -60.6 -46.2 15.0 0.13 0.366 F:P84040:0.365
 DA
DT
DC
DC
DG
DC
DC
 9.576
8.708
8.025
4.400
2.921
7.317
8.897
 N
O
CB
CB
N
N
N
 C5'
OP1
O3'
O3'
OP1
OP2
OP1
ALA K:10 K:47 50.0 0.435 H -60.2 -45.8 NA NA NA
ALA O:10 O:47 52.0 0.452 H -60.3 -46.0 NA NA NA
6jm9 3 P84233 98.98 1e-67 EM
 2019-05-15 ALA C:10 A:47 49.0 0.426 H -59.3 -49.3 9.0 0.078 0.348 D:P62799:0.348
 DC
DG
DA
DA
DC
 9.725
8.223
4.860
3.035
7.811
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
ALA G:10 E:47 50.0 0.435 H -55.2 -47.0 9.0 0.078 0.357 H:P62799:0.357
 DT
DG
DA
DA
DT
 8.144
4.721
3.056
7.803
9.548
 CB
CB
N
N
CB
 O3'
O3'
OP1
OP2
OP1
6jma 2 P84233 98.98 1e-67 EM
 2019-05-15 ALA C:10 A:47 48.0 0.417 H -59.3 -49.3 9.0 0.078 0.339 D:P62799:0.339
 DC
DG
DA
DA
DC
 9.726
8.223
4.860
3.034
7.811
 CB
CB
CB
N
N
 OP1
O3'
O3'
OP1
OP2
ALA G:10 E:47 51.0 0.443 H -55.2 -46.9 10.0 0.087 0.356 H:P62799:0.357
 DT
DG
DA
DA
DT
 8.144
4.721
3.056
7.802
9.547
 CB
CB
N
N
CB
 O3'
O3'
OP1
OP2
OP1
6r1t 1 A0A310TTQ1 97.98 1e-67 EM
 2019-04-24 ALA A:11 A:47 39.0 0.339 H -66.8 -58.8 7.0 0.061 0.278 B:None:0.278
 DG
DC
DT
DC
DC
DG
DC
 8.476
8.731
9.408
8.994
5.409
3.404
7.794
 CB
N
O
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:11 E:47 45.0 0.391 H -68.2 -52.1 11.0 0.096 0.295 F:None:0.296
 DT
DC
DG
DT
DG
DC
DC
 9.492
8.929
5.026
3.610
7.676
8.707
8.660
 O
CB
CB
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
7ktq 1 A0A310TTQ1 97.98 1e-67 EM
 2021-02-03 ALA A:11 A:47 51.0 0.443 H -60.2 -52.1 11.0 0.096 0.347 B:P62799:0.348
 DC
DT
DC
DG
DT
DG
 9.630
9.177
8.282
5.302
2.953
7.820
 N
O
CB
N
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:11 E:47 54.0 0.47 H -59.9 -52.1 14.0 0.122 0.348 F:P62799:0.348
 DT
DC
DC
DG
DC
DT
DC
 9.301
8.282
5.449
3.148
8.044
9.983
8.917
 O
CB
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
7ea8 2 ? 95.05 3e-67 EM
 2021-07-14 ALA B:15 A:47 50.0 0.435 H -69.0 -42.9 12.0 0.104 0.331 C:None:0.33
 DC
DG
DT
DG
 8.727
5.242
3.352
8.622
 CB
CB
N
N
 O3'
O3'
OP2
OP2
ALA F:15 E:47 50.0 0.435 H -66.6 -45.0 11.0 0.096 0.339 G:None:0.339
 DC
DC
DG
DC
DC
 8.488
5.960
3.712
8.681
9.622
 CB
N
N
N
N
 O3'
O3'
OP1
OP2
OP1
6iy2 1 A0A310TTQ1 97.0 3e-67 EM
 2019-04-03 ALA A:12 A:47 48.0 0.417 H -62.5 -39.0 10.0 0.087 0.33 B:P62799:0.33
 DC
DG
DC
DA
DC
DG
DA
 9.799
9.113
9.190
8.422
5.703
3.432
8.099
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:12 E:47 53.0 0.461 H -65.3 -45.4 12.0 0.104 0.357 F:P62799:0.357
 DA
DC
DT
DT
DT
DA
DG
 9.541
8.665
5.502
3.559
8.313
9.259
9.016
 O
CB
N
N
N
CB
N
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
6iy3 1 A0A310TTQ1 97.0 3e-67 EM
 2019-04-03 ALA A:12 A:47 52.0 0.452 H -65.0 -37.9 7.0 0.061 0.391 B:P62799:0.391
 DC
DG
DA
DA
DC
DG
DA
 9.572
9.170
9.539
8.592
5.641
4.006
8.730
 CB
N
N
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:12 E:47 47.0 0.409 H -64.6 -39.9 10.0 0.087 0.322 F:P62799:0.322
 DA
DC
DT
DT
DT
DA
DA
DG
 9.929
8.528
5.777
3.691
8.360
9.911
9.926
9.157
 N
CB
N
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
6yn1 3 A0A310TTQ1 97.96 7e-67 X-RAY
 2021-11-17 ALA C:11 C:47 44.0 0.383 H -58.9 -50.9 1.0 0.009 0.374 D:P62799:0.374
 HOH
 7.284
 N
 O
ALA H:11 H:47 46.0 0.4 H -62.8 -45.5 4.0 0.035 0.365 I:P62799:0.365
 HOH
 6.979
 CB
 O
ALA M:11 M:47 44.0 0.383 H -56.3 -48.1 NA NA NA
ALA R:11 R:47 46.0 0.4 H -63.4 -44.8 NA NA NA
ALA W:11 W:47 44.0 0.383 H -59.3 -46.0 NA NA NA
ALA BA:11 b:47 48.0 0.417 H -67.2 -44.4 NA NA NA
ALA GA:11 g:47 44.0 0.383 H -60.1 -46.1 NA NA NA
ALA LA:11 l:47 47.0 0.409 H -63.2 -47.4 NA NA NA
4xzq 1 P84233 97.96 8e-67 X-RAY
 2015-10-14 ALA A:10 A:447 48.0 0.417 H -66.8 -44.0 9.0 0.078 0.339 B:P62799:0.339
 DT
DG
DT
DT
DG
DA
DA
HOH
 9.900
8.891
9.036
8.174
4.862
3.143
7.958
6.124
 CB
N
O
CB
CB
N
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:10 E:647 50.0 0.435 H -57.0 -44.3 10.0 0.087 0.348 F:P62799:0.348
 DT
DT
DG
DA
DA
DT
DT
DG
HOH
 9.449
8.190
4.778
3.055
7.888
9.817
9.979
8.865
5.827
 O
CB
CB
N
N
CB
N
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
O
4ys3 1 P84233 97.96 8e-67 X-RAY
 2015-10-14 ALA A:10 A:447 49.0 0.426 H -51.4 -47.3 8.0 0.07 0.356 B:P62799:0.357
 DG
DT
DT
DG
DA
DA
HOH
 9.090
9.080
8.101
4.785
3.102
7.968
7.451
 N
O
CB
CB
N
N
O
 OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:10 E:647 48.0 0.417 H -49.7 -45.4 9.0 0.078 0.339 F:P62799:0.339
 DT
DT
DG
DA
DA
DT
DG
HOH
 9.355
8.548
5.085
3.101
8.127
9.809
8.902
7.824
 C
CB
N
N
N
CB
N
O
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
4z66 1 P84233 97.96 8e-67 X-RAY
 2015-10-14 ALA A:10 A:447 52.0 0.452 H -64.1 -43.9 12.0 0.104 0.348 B:P62799:0.348
 DT
DT
DG
DT
DT
DG
DA
DA
HOH
 9.808
9.981
8.814
9.152
8.041
4.658
2.959
7.856
8.148
 CB
N
N
O
CB
CB
N
N
CB
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
ALA E:10 E:647 51.0 0.443 H -56.0 -42.6 10.0 0.087 0.356 F:P62799:0.357
 DT
DT
DG
DA
DA
DT
DG
HOH
 9.511
8.232
4.866
3.103
8.009
9.903
8.820
3.580
 C
CB
CB
N
N
CB
N
CB
 OP1
O3'
O3'
OP1
OP2
OP1
OP1
O
6fq5 1 ? 97.96 8e-67 EM
 2018-04-18 ALA A:11 A:47 53.0 0.461 H -57.1 -53.5 16.0 0.139 0.322 B:P62799:0.322
 DG
DT
DC
DT
DC
DC
DG
DC
 9.245
9.210
8.817
9.438
8.521
5.118
2.937
7.763
 CB
N
N
N
CB
CB
N
N
 OP1
C5'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:11 E:47 45.0 0.391 H -59.7 -50.3 11.0 0.096 0.295 F:P62799:0.296
 DT
DC
DG
DT
DG
DC
DC
DC
 9.633
8.466
4.500
2.607
7.335
8.687
9.475
9.470
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
6fq6 1 ? 97.96 8e-67 EM
 2018-04-18 ALA A:11 A:47 55.0 0.478 H -58.9 -57.8 11.0 0.096 0.382 B:P62799:0.383
 DG
DG
DC
DT
DC
DC
DC
DG
DC
 9.980
8.832
9.934
8.167
8.637
8.715
4.741
2.832
7.232
 CB
CB
N
C
N
CB
CB
N
N
 C4'
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:11 E:47 48.0 0.417 H -59.5 -48.1 5.0 0.043 0.374 F:P62799:0.374
 DC
DG
DT
DG
DA
DC
DC
DC
 8.973
4.758
2.630
7.033
9.186
8.460
8.469
9.186
 CB
CB
N
N
CB
CB
C
N
 O3'
O3'
OP1
OP2
C5'
OP1
OP1
OP1
6fq8 1 P02302 97.96 8e-67 EM
 2018-04-18 ALA A:11 A:47 49.0 0.426 H -58.4 -59.4 1.0 0.009 0.417 B:P62799:0.417
 DG
DC
DT
DC
DC
DC
DG
DC
 8.869
9.989
7.840
8.239
9.680
6.010
4.248
7.715
 CB
C
C
N
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP2
OP2
ALA E:11 E:47 54.0 0.47 H -60.6 -47.7 17.0 0.148 0.322 F:P62799:0.322
 DC
DG
DT
DG
DA
DC
DC
DC
 8.665
4.625
2.565
7.481
9.694
8.955
9.414
9.268
 CB
CB
N
N
CB
CB
N
N
 O3'
O3'
OP1
OP2
C5'
OP1
C5'
OP1
6ke9 1 P68431 100.0 1e-66 X-RAY
 2020-04-22 ALA A:8 A:47 49.0 0.426 H -58.5 -51.5 11.0 0.096 0.33 B:P62805:0.33
 DG
DT
DG
DT
DT
DA
DA
DC
 9.582
9.923
8.565
9.347
8.209
4.719
3.169
8.013
 CB
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:8 E:47 49.0 0.426 H -58.4 -51.3 10.0 0.087 0.339 F:P62805:0.339
 DG
DG
DG
DT
DT
DA
DG
 8.855
8.458
5.483
3.740
8.313
9.794
8.704
 N
CB
CB
N
N
N
N
 OP1
O3'
C3'
OP2
OP2
O3'
OP1
6l9h 1 P68431 100.0 1e-66 X-RAY
 2020-04-22 ALA A:8 A:47 47.0 0.409 H -60.0 -46.9 10.0 0.087 0.322 B:P62805:0.322
 DG
DT
DG
DT
DT
DA
DA
DC
 9.081
9.946
8.591
9.393
8.044
4.864
3.286
8.151
 CB
N
N
N
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:8 E:47 50.0 0.435 H -60.1 -46.3 10.0 0.087 0.348 F:P62805:0.348
 DG
DG
DG
DT
DT
DA
DG
 9.277
8.377
5.181
3.106
8.059
9.749
8.791
 N
CB
CB
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
6le9 1 P68431 100.0 1e-66 X-RAY
 2020-04-22 ALA A:8 A:47 49.0 0.426 H -60.6 -46.9 11.0 0.096 0.33 B:P62805:0.33
 DA
DA
DG
DG
DG
DG
DG
DT
DT
 9.514
9.806
8.870
9.917
9.390
7.873
4.923
3.326
8.298
 CB
N
N
N
O
CB
N
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:8 E:47 44.0 0.383 H -59.5 -46.5 8.0 0.07 0.313 F:P62805:0.313
 DT
DT
DA
DA
DC
DT
DG
 9.054
8.804
5.334
3.038
8.084
9.742
8.609
 N
CB
N
N
N
N
N
 OP1
O3'
O3'
OP1
OP2
O3'
OP1
6y5d 1 Q71DI3 97.96 2e-66 EM
 2020-09-23 ALA A:10 A:48 52.0 0.452 H -55.7 -42.5 12.0 0.104 0.348 B:P62805:0.348
 DC
DC
DC
DG
DT
DG
 9.222
9.315
8.083
5.274
3.396
8.136
 CB
N
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA E:10 E:48 53.0 0.461 H -55.5 -43.3 7.0 0.061 0.4 F:P62805:0.4
 DC
DC
DG
DC
DG
DT
DC
 8.466
5.688
3.760
8.591
9.071
9.868
8.874
 CB
N
N
N
CB
N
N
 O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA M:10 M:48 54.0 0.47 H -55.8 -42.3 16.0 0.139 0.331 N:P62805:0.33
 DC
DC
DC
DG
DT
DG
 9.258
9.700
7.349
4.873
3.235
8.126
 CB
N
CB
CB
N
N
 OP1
OP1
O3'
O3'
OP1
OP2
ALA Q:10 Q:48 50.0 0.435 H -55.9 -42.8 7.0 0.061 0.374 R:P62805:0.374
 DC
DC
DG
DC
DG
DT
DC
 8.285
5.437
3.496
8.388
8.991
9.812
8.766
 CB
N
N
N
CB
N
N
 O3'
O3'
OP1
OP2
OP1
O3'
OP1
3kwq 1 P84233 96.94 3e-66 X-RAY
 2010-05-12 ALA A:10 A:47 49.0 0.426 H -58.1 -58.7 6.0 0.052 0.374 B:P62799:0.374
 DT
DG
DT
DG
DA
DA
DC
 9.966
8.843
8.487
8.614
5.641
3.315
8.114
 N
N
O
CB
N
N
N
 O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:10 E:47 46.0 0.4 H -61.9 -62.5 8.0 0.07 0.33 F:P62799:0.33
 DA
DT
DT
DG
DA
DA
DG
DT
DG
 9.953
8.555
8.518
6.168
3.688
8.454
9.959
9.635
8.713
 N
O
CB
N
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
6ftx 1 S4RAZ3 97.94 4e-66 EM
 2018-08-08 ALA A:10 A:47 49.0 0.426 H -76.5 -38.5 11.0 0.096 0.33 B:P62799:0.33
 DG
DG
DT
DC
DG
DT
DG
 9.535
9.926
9.908
9.034
4.829
3.075
8.306
 N
N
N
CB
CB
N
N
 OP1
O3'
OP1
O3'
O3'
OP1
OP2
6z6p 5 A0A310TTQ1 97.94 4e-66 EM
 2021-02-17 ALA E:10 A:47 53.0 0.461 H -58.7 -41.5 19.0 0.165 0.296 F:P62799:0.296
 DC
DG
DT
DG
DT
DC
DG
DT
DG
 8.353
7.519
7.820
7.007
8.371
7.961
5.108
3.953
8.701
 N
N
N
N
O
CB
CB
N
N
 O3'
OP1
O3'
OP1
OP1
O3'
C3'
OP2
OP2
7k6p 1 P84233 96.94 5e-66 EM
 2021-02-10 ALA A:11 A:47 52.0 0.452 H -64.5 -43.5 9.0 0.078 0.374 B:P62799:0.374
 DC
DC
DC
DG
DT
DC
DG
DT
DG
 9.330
9.455
8.844
9.974
9.014
8.123
4.822
2.653
7.632
 CB
N
N
N
O
CB
N
N
N
 OP1
O3'
OP1
O3'
OP1
O3'
O3'
OP1
OP2
ALA E:11 E:47 51.0 0.443 H -62.8 -45.7 9.0 0.078 0.365 F:P62799:0.365
 DA
DT
DC
DC
DG
DC
DG
DT
DC
 9.698
8.402
8.175
4.593
2.759
7.632
9.059
9.386
8.631
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O5'
OP1
7k6q 1 P84233 96.94 5e-66 EM
 2021-02-10 ALA A:11 A:47 54.0 0.47 H -61.4 -46.4 8.0 0.07 0.4 B:P62799:0.4
 DC
DC
DC
DT
DC
DG
DT
DG
 9.158
9.414
8.812
9.117
8.100
4.882
2.628
7.729
 CB
N
N
O
CB
N
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:11 E:47 52.0 0.452 H -63.0 -43.5 10.0 0.087 0.365 F:P62799:0.365
 DA
DT
DC
DC
DG
DC
DG
DT
DC
 9.607
8.395
8.066
4.501
2.671
7.551
9.557
9.236
8.741
 N
O
CB
CB
N
N
CB
N
N
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
5mlu 1 P84233 97.94 8e-66 X-RAY
 2017-05-10 ALA A:9 A:47 54.0 0.47 H -62.9 -48.6 11.0 0.096 0.374 B:P62799:0.374
 DG
DG
DA
DT
DC
DC
DG
DC
HOH
 9.473
9.044
9.791
8.893
8.002
5.065
3.010
8.163
7.290
 CB
N
N
O
CB
N
N
N
CB
 OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
O
ALA E:9 E:47 44.0 0.383 H -63.7 -48.0 8.0 0.07 0.313 F:P62799:0.313
 DG
DT
DC
DG
DT
DG
DC
DC
DG
HOH
 9.781
9.199
8.213
4.794
3.092
7.999
9.782
9.499
8.744
8.728
 N
N
CB
CB
N
N
CB
N
N
CB
 O3'
OP1
O3'
O3'
OP1
OP2
OP1
C5'
OP1
O
6z6p 9 P84233 97.94 8e-66 EM
 2021-02-17 ALA I:9 E:47 55.0 0.478 H -64.1 -52.6 9.0 0.078 0.4 J:P62799:0.4
 DA
DT
DC
DC
DG
DG
DT
DG
 8.936
9.284
7.610
5.167
5.093
9.084
9.617
9.568
 N
O
CB
CB
N
CB
N
N
 OP1
OP1
O3'
OP1
OP2
OP1
C5'
OP1
6ftx 5 P02302 97.94 1e-65 EM
 2018-08-08 ALA E:22 E:47 60.0 0.522 T -21.0 -56.9 20.0 0.174 0.348 F:P62799:0.348
 DC
DG
DC
DG
DG
 6.090
4.134
9.157
8.981
7.342
 N
N
N
CB
CB
 O3'
OP1
OP2
C5'
OP1
6y5e 1 Q71DI3 97.92 3e-65 EM
 2020-09-23 ALA A:10 A:48 52.0 0.452 H -56.0 -42.5 12.0 0.104 0.348 B:P62805:0.348
 DC
DC
DT
DC
DG
DT
DG
 9.147
8.990
9.993
8.420
5.415
3.460
8.174
 CB
N
N
CB
CB
N
N
 OP1
OP1
OP1
O3'
O3'
OP1
OP2
ALA E:10 E:48 53.0 0.461 H -56.1 -43.3 8.0 0.07 0.391 F:P62805:0.391
 DT
DC
DC
DG
DC
DG
DT
DC
 9.840
8.398
5.575
3.684
8.295
9.388
9.993
9.004
 N
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
4x23 3 P02299 98.92 5e-63 X-RAY
 2014-12-10 ALA C:8 A:47 44.0 0.383 H -56.0 -44.5 11.0 0.096 0.287 D:P84040:0.287
 DC
DC
DC
DT
DC
DG
DT
DG
 8.873
9.402
8.547
9.560
7.961
4.669
2.871
7.724
 CB
N
N
O
CB
CB
N
N
 OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
ALA G:8 E:47 41.0 0.357 H -56.4 -44.4 10.0 0.087 0.27 H:P84040:0.27
 DT
DC
DC
DG
DC
DG
DT
DC
 9.572
8.130
4.784
3.078
7.786
9.372
9.668
8.665
 O
CB
CB
N
N
CB
N
N
 OP1
O3'
O3'
OP1
OP2
OP1
O3'
OP1
ALA O:8 K:47 39.0 0.339 H -56.8 -45.0 NA NA NA
ALA S:8 O:47 41.0 0.357 H -56.0 -45.5 NA NA NA
5t1g 2 P68431 100.0 1.0 X-RAY
 2016-09-14 ALA B:10 B:47 101.0 0.878 -88.0 123.0 43.0 0.374 0.504 A:P83916:0.504
 UNX
UNX
 9.610
9.543
 N
CB
 UNK
UNK
5t1i 2 P68431 100.0 1.0 X-RAY
 2016-09-14 ALA C:10 C:47 98.0 0.852 -89.2 100.3 25.0 0.217 0.635 A:Q13185:0.261
B:Q13185:0.391
 UNX
UNX
HOH
 7.255
4.398
8.136
 O
O
N
 UNK
UNK
O

AlphaFold DB

Entity Residue Monomer View
ID Entity Uniprot Identity Evalue Name Label Auth ASA rASA SS φ ψ
af-p68431-f1 1 P68431 100.0 3e-97 ALA A:48 A:48 46.0 0.4 H -59.0 -46.8
af-q71di3-f1 1 Q71DI3 99.26 7e-96 ALA A:48 A:48 47.0 0.409 H -58.9 -47.1
af-q16695-f1 1 Q16695 97.06 4e-95 ALA A:48 A:48 47.0 0.409 H -58.8 -47.1
af-q5tec6-f1 1 Q5TEC6 97.06 3e-93 ALA A:48 A:48 48.0 0.417 H -58.8 -48.0
af-p84243-f1 1 P84243 96.32 3e-93 ALA A:48 A:48 47.0 0.409 H -59.2 -46.6
af-q6nxt2-f1 1 Q6NXT2 93.38 2e-87 ALA A:47 A:47 46.0 0.4 H -59.0 -46.5