Variant

Genome Chromosome Position VCF ID Ref Alt mRNA Change mRNA Info
GRCh37 chr6 26204978 . C A CCDS4593.1:NM_003545.3:c.106Cgg>Agg_NP_003536.1:p.36R>R Homo sapiens histone cluster 1 H4 family member e (HIST1H4E), 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)
7cow 4 P62805 100.0 4e-68 X-RAY
2021-08-11 ARG D:38 B:35 92.0 0.409 H -52.3 -43.9 70.0 0.311 0.098 C:P68431:0.098
DA
DC
DC
DG
DC
DA
DA
DC
DG
DC
DG
9.790
5.378
3.114
4.756
8.079
8.337
9.915
9.499
8.809
9.795
9.993
NH2
NH2
NH2
NH1
NH2
CD
NE
NH2
NH2
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
O6
ARG H:38 F:35 90.0 0.4 H -51.9 -50.5 72.0 0.32 0.08 G:P68431:0.08
DA
DC
DG
DC
DC
DG
DT
DG
HOH
8.060
8.505
9.386
9.739
5.654
3.331
4.537
8.244
8.787
CD
CD
NE
NH1
NH1
NH1
NH2
NH2
N
OP2
OP2
O6
N4
O3'
OP2
OP2
N7
O
ARG L:38 L:35 97.0 0.431 H -62.9 -47.1 83.0 0.369 0.062 K:P68431:0.062
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.027
9.924
9.595
9.170
9.399
9.787
5.227
2.721
4.315
8.039
CB
CD
CZ
NH1
NH1
NH1
NH1
NH1
NH2
NH2
OP2
C5
O6
N4
N6
O3'
O3'
OP2
OP2
N7
ARG P:38 P:35 97.0 0.431 H -61.9 -61.9 78.0 0.347 0.084 O:P68431:0.084
DC
DC
DG
DC
DA
DA
DC
DG
5.271
2.858
4.764
8.503
7.949
9.420
9.756
8.968
NH2
NH2
NH1
NH2
CD
CB
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
1eqz 5 P62801 100.0 4e-68 X-RAY
2000-04-17 ARG F:36 D:35 80.0 0.356 H -63.5 -42.3 69.0 0.307 0.049 E:P84229:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
K
HOH
8.665
9.419
9.192
9.472
9.343
4.768
2.500
4.831
8.421
5.769
2.861
N
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH2
NH2
OP1
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
K
O
ARG J:36 H:35 80.0 0.356 H -67.9 -49.0 66.0 0.293 0.063 I:P84229:0.062
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.152
4.635
6.476
6.982
8.055
9.765
7.366
5.710
7.129
7.791
2.714
NH1
NH1
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O4
O
1f66 3 P62806 100.0 4e-68 X-RAY
2000-11-27 ARG D:36 B:35 102.0 0.453 H -69.1 -36.5 91.0 0.404 0.049 C:Q7ZT64:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.646
9.398
9.040
9.090
9.571
4.699
2.342
4.903
8.251
3.099
N
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH2
NH1
OP1
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:36 F:235 85.0 0.378 H -68.0 -38.3 75.0 0.333 0.045 G:Q7ZT64:0.044
DC
DT
DG
DA
DA
DA
DT
DG
DT
HOH
9.390
5.247
2.815
5.189
8.542
8.380
8.441
9.725
9.574
2.762
NH2
NH2
NH2
NH1
NH1
CD
CD
NE
NH2
NE
O3'
O3'
OP2
OP2
N6
OP2
C7
O6
O4
O
1hq3 4 P62801 100.0 4e-68 X-RAY
2001-01-24 ARG D:36 D:35 78.0 0.347 H -59.0 -45.0 63.0 0.28 0.067 C:P84229:0.067
PO4
CL
CL
HOH
4.636
5.242
8.763
2.134
NH2
CD
N
NH2
O2
CL
CL
O
ARG H:36 H:35 79.0 0.351 H -64.4 -44.3 66.0 0.293 0.058 G:P84229:0.058
CL
CL
HOH
3.624
8.748
2.587
NH1
NH2
CD
CL
CL
O
1tzy 4 P62801 100.0 4e-68 X-RAY
2004-08-03 ARG D:36 D:35 81.0 0.36 H -64.1 -41.6 64.0 0.284 0.076 C:P84229:0.076
PO4
CL
CL
HOH
7.074
5.342
7.433
2.430
NH2
CD
NH2
NE
O2
CL
CL
O
ARG H:36 H:35 79.0 0.351 H -62.8 -46.1 65.0 0.289 0.062 G:P84229:0.062
CL
CL
HOH
3.568
8.595
2.634
NH1
NH2
NH2
CL
CL
O
1u35 3 Q5T006 100.0 4e-68 X-RAY
2005-09-27 ARG D:36 B:35 72.0 0.32 H -59.1 -43.3 64.0 0.284 0.036 C:P68433:0.036
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.441
9.502
8.895
8.816
4.861
2.469
5.605
8.877
3.125
CB
CB
NE
NH2
NH2
NH2
NH1
NH2
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG H:36 F:235 94.0 0.418 H -65.4 -46.0 77.0 0.342 0.076 G:P68433:0.076
DG
DA
DA
DC
DC
DA
DT
DG
HOH
5.254
3.078
4.024
8.161
8.451
8.905
8.976
9.752
8.624
NH1
NH1
NH2
NH2
CB
CD
CD
NH1
CG
O3'
OP2
OP2
C5
OP2
OP2
C7
O6
O
2aro 4 P62801 100.0 4e-68 X-RAY
2005-08-30 ARG D:36 D:35 76.0 0.338 H -63.8 -39.6 57.0 0.253 0.085 C:P84229:0.084
PO4
CL
CL
HOH
2.761
5.343
7.325
2.326
NH2
CD
NH2
NE
O2
CL
CL
O
ARG H:36 H:35 80.0 0.356 H -64.7 -42.6 69.0 0.307 0.049 G:P84229:0.049
CL
CL
HOH
3.135
8.603
2.806
NH1
NH2
NH2
CL
CL
O
2cv5 3 P62805 100.0 4e-68 X-RAY
2005-06-28 ARG D:36 B:35 94.0 0.418 H -58.1 -49.1 85.0 0.378 0.04 C:P68431:0.04
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.434
8.581
9.356
9.474
4.968
3.061
4.372
7.360
3.437
N
CG
NE
NH2
NH1
NH1
NH2
NH2
NH1
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG H:36 F:35 85.0 0.378 H -63.2 -44.4 55.0 0.244 0.134 G:P68431:0.133
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.156
6.072
6.627
9.071
9.417
7.940
5.580
6.989
9.440
2.800
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
2f8n 3 P62799 100.0 4e-68 X-RAY
2006-05-23 ARG D:36 B:35 79.0 0.351 H -62.3 -42.9 66.0 0.293 0.058 C:P84233:0.058
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.282
9.400
8.391
8.060
5.343
3.087
5.969
7.993
3.805
CB
NE
NH2
NH2
NH1
NH2
NH1
NH2
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG G:36 F:235 93.0 0.413 H -75.5 -40.4 82.0 0.364 0.049 F:P84233:0.049
DG
DA
DA
DC
DC
DA
DT
DG
HOH
4.740
2.516
5.111
7.698
8.139
9.365
9.666
9.613
2.928
NH2
NH2
NH2
NH2
CB
CB
NH1
NH2
CD
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
O
3nqu 2 P62805 100.0 4e-68 X-RAY
2010-08-25 ARG B:36 B:35 93.0 0.413 H -76.8 -35.8 93.0 0.413 0.0 SO4
SO4
HOH
6.907
2.670
6.910
NH2
NH1
NH2
O1
O3
O
3r45 2 P62805 100.0 4e-68 X-RAY
2011-04-06 ARG B:36 B:35 93.0 0.413 H -67.5 -42.8 93.0 0.413 0.0 SO4
SO4
SO4
GOL
HOH
6.951
2.950
6.841
4.902
5.346
NH2
NH2
NH2
CD
O
O2
O4
O4
O2
O
4hga 3 P62805 100.0 4e-68 X-RAY
2012-11-07 ARG C:36 C:35 124.0 0.551 H -59.4 -43.8 124.0 0.551 0.0 HOH
5.680
NH2
O
4kgc 2 P62799 100.0 4e-68 X-RAY
2014-03-26 ARG B:36 B:35 82.0 0.364 H -59.6 -42.3 69.0 0.307 0.057 A:P84233:0.058
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.511
9.250
9.533
9.888
9.246
4.873
2.529
4.667
8.294
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:36 F:35 78.0 0.347 H -57.7 -44.9 64.0 0.284 0.063 E:P84233:0.062
DG
DA
DA
DC
DA
DC
DA
DT
DG
DT
5.599
3.517
6.156
7.396
9.642
8.455
8.890
7.788
8.466
9.824
NH1
NH1
NH1
NH2
NH2
CB
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
O4
4ld9 2 P62799 100.0 4e-68 X-RAY
2013-08-14 ARG B:36 B:35 95.0 0.422 H -56.2 -66.0 87.0 0.387 0.035 A:P84233:0.036
DA
DA
DC
DG
DC
DC
DC
DC
DG
DC
DG
8.539
9.661
8.493
8.219
8.781
9.768
4.709
2.811
5.624
7.553
9.713
CB
N
NH2
NH2
NH2
NH2
NH1
NH2
NH1
NH2
NH2
OP2
OP2
N4
O6
N4
O3'
O3'
OP2
OP2
N4
O6
ARG F:36 F:35 81.0 0.36 H -49.5 -32.5 60.0 0.267 0.093 E:P84233:0.093
DC
DG
DT
DG
DA
DA
DC
DG
DC
6.963
4.597
5.364
8.541
9.476
6.989
8.809
9.480
9.754
NE
NE
NH2
NH2
NH1
NH1
NH1
NH1
CD
O3'
OP2
OP2
N7
O3'
OP2
C5
O6
N4
4z2m 3 P62805 100.0 4e-68 X-RAY
2016-03-09 ARG C:36 H:35 89.0 0.396 H -57.9 -48.1 46.0 0.204 0.192 A:Q9Y5B9:0.191
ARG E:36 J:35 116.0 0.516 H -55.0 -44.9 116.0 0.516 0.0
4zux 2 P62799 100.0 4e-68 X-RAY
2016-02-24 ARG B:36 B:35 82.0 0.364 H -83.1 -64.1 71.0 0.316 0.048 A:P84233:0.049
DA
DC
DG
DC
DA
DC
DG
DT
DG
7.694
8.952
9.657
8.351
9.147
5.989
3.541
5.129
8.680
CB
NE
NE
NH2
NH2
NH2
NH2
NH1
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
OP2
O6
ARG F:36 F:35 93.0 0.413 H -69.1 -46.9 76.0 0.338 0.075 E:P84233:0.076
DC
DC
DG
DC
DG
DA
DA
DC
DG
6.088
3.816
4.711
6.577
9.482
7.937
7.981
8.052
8.022
NH2
NH2
NH2
NH2
NH2
NH1
CD
NE
NH2
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
ARG L:36 L:35 80.0 0.356 H -82.9 -63.8 NA NA NA
ARG P:36 P:35 90.0 0.4 H -82.8 -63.7 NA NA NA
5c3i 3 P62805 100.0 4e-68 X-RAY
2015-07-29 ARG C:36 C:35 80.0 0.356 H -57.9 -51.6 NA NA NA
ARG G:36 G:35 86.0 0.382 H -59.4 -46.0 NA NA NA
ARG K:36 K:35 83.0 0.369 H -59.6 -45.5 39.0 0.173 0.196 L:P49736:0.196
ARG O:36 O:35 89.0 0.396 H -62.7 -44.7 NA NA NA
ARG S:36 S:35 85.0 0.378 H -60.2 -40.6 NA NA NA
ARG W:36 W:35 88.0 0.391 H -61.9 -42.6 NA NA NA
5e5a 3 P62799 100.0 4e-68 X-RAY
2016-02-03 ARG D:36 B:35 86.0 0.382 H -57.1 -41.2 78.0 0.347 0.035 C:P84233:0.036
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.589
9.294
9.369
9.260
9.529
4.675
2.286
4.470
7.865
3.243
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH2
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:36 F:35 92.0 0.409 H -58.0 -40.8 86.0 0.382 0.027 G:P84233:0.027
DC
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
9.436
4.762
2.353
4.430
7.960
9.712
8.467
8.460
9.261
9.066
3.348
NH2
NH2
NH2
NH1
NH1
NH1
CB
CD
CZ
NH2
CD
O3'
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
5kgf 2 P62799 100.0 4e-68 EM
2016-07-27 ARG B:36 B:35 113.0 0.502 H -48.1 -45.4 105.0 0.467 0.035 A:P84233:0.036
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.208
8.729
7.624
7.886
8.681
5.790
3.314
3.738
6.684
8.343
CB
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
NH1
OP2
C5
O6
N4
N6
C2'
OP2
C7
O6
N4
ARG F:36 F:35 112.0 0.498 H -48.2 -45.4 103.0 0.458 0.04 E:P84233:0.04
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
5.196
2.676
5.446
6.340
8.980
8.953
9.237
8.067
7.727
9.835
NH2
NH2
NH1
NH1
NH1
N
NH1
NH1
NH1
NH2
O3'
OP2
N7
N4
O6
OP1
N7
N4
O6
N4
5o9g 2 P62799 100.0 4e-68 EM
2017-10-11 ARG B:36 B:35 88.0 0.391 H -64.2 -39.6 88.0 0.391 0.0 DA
DC
DA
DC
DG
DT
DG
8.414
9.090
9.595
5.222
2.760
5.066
9.812
CB
NH2
NH2
NH2
NH2
NH1
NH2
OP1
OP2
O3'
O3'
OP2
OP2
O6
ARG F:36 F:35 90.0 0.4 H -67.5 -48.2 85.0 0.378 0.022 E:P84233:0.022
DC
DC
DC
DG
DC
DA
DA
DC
DG
8.805
4.551
3.464
5.932
8.135
8.001
8.754
9.796
9.188
NH1
NH1
NH2
NH2
NH2
CB
CB
NH2
NH2
O3'
C3'
OP1
OP2
N4
OP2
OP2
N4
O6
5omx 4 P62799 100.0 4e-68 X-RAY
2017-11-15 ARG D:36 B:35 85.0 0.378 H -70.6 -34.1 74.0 0.329 0.049 C:P84233:0.049
DA
DT
DG
DT
DT
DT
DG
DA
DA
DC
HOH
7.627
6.770
7.980
8.226
9.808
6.889
4.376
6.434
7.627
8.390
8.780
NH1
NH1
NH1
NH2
NH2
NH2
NH2
CD
NH1
NH1
N
OP2
C7
O6
O4
O4
O3'
OP2
OP2
N6
N4
O
ARG H:36 F:35 77.0 0.342 H -62.8 -47.0 65.0 0.289 0.053 G:P84233:0.053
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.864
5.662
6.439
7.617
8.887
8.769
6.308
6.290
7.829
7.992
2.560
NE
NE
CD
NH2
NH1
NH1
NH1
NH1
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O
5ong 4 P62799 100.0 4e-68 X-RAY
2017-11-22 ARG D:36 B:35 76.0 0.338 H -62.5 -47.3 66.0 0.293 0.045 C:P84233:0.044
DA
DT
DG
DT
DT
DG
DA
DA
DC
HOH
8.389
7.736
9.287
9.113
5.084
2.765
5.875
8.513
9.990
6.357
CB
NH1
NH1
NH1
NH2
NH2
NE
NH2
NH1
NH1
OP2
C7
O6
O4
O3'
OP2
OP2
N6
N4
O
ARG H:36 F:35 89.0 0.396 H -63.6 -42.0 79.0 0.351 0.045 G:P84233:0.044
DT
DG
DA
DA
DC
DA
DC
DA
DT
DG
DT
DT
HOH
7.447
4.973
6.643
6.950
7.682
9.866
9.118
6.894
5.520
6.911
7.651
9.895
8.469
CD
NH1
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH1
N
O3'
OP2
OP2
N6
N4
N6
O3'
OP2
C7
O6
O4
O4
O
5onw 4 P62799 100.0 4e-68 X-RAY
2017-11-22 ARG D:36 B:35 72.0 0.32 H -56.7 -39.6 61.0 0.271 0.049 C:P84233:0.049
DA
DT
DG
DT
DT
DG
DA
DA
8.249
8.590
9.477
8.810
5.511
3.333
5.698
8.435
CB
NE
NH2
NH2
NH1
NH2
NH1
NH2
OP2
C7
O6
O4
O3'
OP2
OP2
N6
ARG H:36 F:35 89.0 0.396 H -63.7 -47.0 54.0 0.24 0.156 G:P84233:0.156
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
7.929
5.770
6.170
9.312
9.248
8.730
6.216
7.301
9.362
8.523
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
N
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O
5x0x 2 P62799 100.0 4e-68 EM
2017-04-19 ARG B:36 B:35 119.0 0.529 H -59.2 -43.2 107.0 0.476 0.053 A:P84233:0.053
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.026
3.850
3.957
6.407
8.985
8.533
9.014
7.844
7.718
8.455
NH2
NH2
NH2
NH1
NH1
CB
CB
NH1
NH1
NH1
O3'
C2'
OP2
N4
O6
OP2
OP2
N4
O6
N4
ARG F:36 F:35 117.0 0.52 H -59.2 -43.2 105.0 0.467 0.053 E:P84233:0.053
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.090
8.862
8.948
7.715
9.025
6.291
4.033
4.067
6.993
8.801
CB
CB
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O6
N4
N6
O3'
C2'
OP2
O6
N4
5xf3 2 P62805 100.0 4e-68 X-RAY
2017-10-11 ARG B:36 B:35 83.0 0.369 H -61.7 -36.7 69.0 0.307 0.062 A:P68431:0.062
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.831
9.531
9.242
9.439
9.662
5.003
2.640
4.848
7.736
CB
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:36 F:35 80.0 0.356 H -67.4 -35.2 66.0 0.293 0.063 E:P68431:0.062
DG
DA
DA
DC
DA
DC
DA
DT
DG
5.930
3.758
6.212
7.180
9.673
8.541
8.253
7.483
8.353
NH1
NH1
NH1
NH2
NH2
NE
NH2
NH2
NH2
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
5xf4 2 P62805 100.0 4e-68 X-RAY
2017-10-11 ARG B:36 B:35 93.0 0.413 H -55.7 -31.4 78.0 0.347 0.066 A:P68431:0.067
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
8.930
9.561
8.777
8.965
9.846
9.736
5.033
2.620
4.524
7.592
CB
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH1
NH2
OP2
OP2
C7
O6
O4
O3'
O3'
OP2
OP2
N4
ARG F:36 F:35 80.0 0.356 H -62.9 -40.9 66.0 0.293 0.063 E:P68431:0.062
DG
DA
DA
DC
DA
DC
DA
DT
DG
5.937
3.656
6.375
7.061
9.452
8.496
8.228
7.412
8.214
NH1
NH1
CD
NH2
NH2
NE
NH2
NH2
NH2
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
5xf5 2 P62805 100.0 4e-68 X-RAY
2017-10-11 ARG B:36 B:35 83.0 0.369 H -64.2 -34.8 71.0 0.316 0.053 A:P68431:0.053
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.608
9.435
9.390
9.794
9.396
4.642
2.329
4.605
8.019
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:36 F:35 79.0 0.351 H -65.5 -41.8 66.0 0.293 0.058 E:P68431:0.058
DG
DA
DA
DC
DA
DC
DA
DT
DG
5.915
3.767
6.086
7.002
9.530
8.465
8.410
7.410
8.377
NH1
NH1
NH1
NH2
NH2
NE
NH2
NH2
NH2
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
6buz 2 P62805 100.0 4e-68 EM
2017-12-20 ARG B:36 B:36 108.0 0.48 H -67.4 -33.3 97.0 0.431 0.049 A:P49450:0.049
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.686
9.149
8.293
7.786
9.375
5.858
3.758
3.993
7.584
8.660
N
CD
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP1
OP2
O6
N4
N6
O3'
O5'
OP2
O6
N4
ARG F:36 F:36 104.0 0.462 H -67.4 -33.3 94.0 0.418 0.044 E:P49450:0.044
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
5.885
3.695
4.139
7.432
9.416
8.921
8.958
8.669
8.284
9.247
NH2
NH2
NH2
NH1
NH1
N
CD
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
6e0c 2 P62805 100.0 4e-68 EM
2019-05-22 ARG B:36 B:35 79.0 0.351 H -66.3 -37.9 71.0 0.316 0.035 A:P49450:0.036
DC
DG
DT
DG
DC
DA
DA
DC
DG
DC
DA
7.326
4.975
5.805
8.109
8.834
9.390
6.977
6.644
8.283
8.192
9.890
CD
NE
NH1
NH1
NH1
NH1
NH1
NH2
NH1
NH2
NH2
O3'
OP2
C7
O6
N4
O3'
OP2
OP2
O6
N4
N6
ARG F:36 F:35 73.0 0.324 H -66.6 -37.4 64.0 0.284 0.04 E:P49450:0.04
DA
DA
DA
DC
DG
DC
DC
DC
DG
DC
DG
9.600
7.218
6.964
7.601
8.567
9.845
7.270
4.823
6.311
7.551
8.944
NH1
NH1
NH2
NH1
NH2
NH2
NE
NE
CD
NH1
NH1
O3'
OP2
OP2
N4
O6
N4
O3'
OP2
OP2
N4
O6
6e0p 2 P62805 100.0 4e-68 EM
2019-05-22 ARG B:36 B:35 82.0 0.364 H -62.5 -37.0 71.0 0.316 0.048 A:P49450:0.049
DA
DA
DA
DC
DT
DT
DG
DG
DA
DG
DT
6.706
4.250
6.479
7.688
8.813
9.217
7.112
7.223
7.952
8.278
9.673
NE
NE
CD
NH1
NH1
NH1
NH1
NH1
NH1
NH2
NH2
O3'
OP2
OP2
N4
O4
O3'
OP2
OP2
N6
O6
O4
ARG F:36 F:35 81.0 0.36 H -62.5 -37.0 71.0 0.316 0.044 E:P49450:0.044
DG
DC
DA
DT
DG
DT
DG
DA
DA
DC
DA
9.603
7.251
7.124
7.007
8.341
9.739
6.622
4.165
6.422
7.628
9.051
NH1
NH1
NH1
NH2
NH2
NH2
NE
NE
CD
NH1
NH1
O3'
OP2
OP2
C7
O6
O4
O3'
OP2
OP2
N4
N6
6ftx 2 P62799 100.0 4e-68 EM
2018-08-08 ARG B:36 B:35 71.0 0.316 H -66.8 -43.2 71.0 0.316 0.0 DA
DA
DC
DG
DC
DC
DG
DT
DG
8.609
6.666
6.853
9.545
9.679
7.447
5.478
6.729
8.221
NH2
NH2
NH1
NH1
NH1
CD
CD
NE
NH2
C2'
OP2
OP2
O6
N4
O3'
OP2
OP2
O6
ARG F:36 F:35 86.0 0.382 H -60.4 -35.3 86.0 0.382 0.0 DC
DC
DG
DC
DA
DA
4.317
2.467
5.369
7.813
8.823
9.886
NH1
NH1
NH2
NH2
N
CD
O3'
OP2
OP2
N4
OP1
C8
6g0l 2 P62799 100.0 4e-68 EM
2018-08-22 ARG B:36 B:35 70.0 0.311 H -66.8 -43.2 70.0 0.311 0.0 DA
DA
DC
DG
DC
DC
DG
DT
DG
8.181
5.846
6.889
9.035
9.365
7.665
5.245
6.308
9.038
NH2
NH2
NH1
NH1
NH1
CD
CD
NE
NH1
O3'
OP2
OP2
O6
N4
O3'
OP2
C7
O6
ARG F:36 F:35 85.0 0.378 H -60.4 -35.2 85.0 0.378 0.0 DC
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
DC
DG
9.954
4.916
2.641
5.001
6.088
9.789
9.826
7.630
8.188
7.854
7.866
9.536
9.536
NH1
NH1
NH1
NH2
NH2
NH2
N
N
CD
CZ
NH2
NH1
NH2
O3'
C3'
OP2
OP2
N4
O6
O3'
OP1
OP2
N4
O6
N4
N2
6hts 6 P62805 100.0 4e-68 EM
2018-11-07 ARG J:36 J:35 93.0 0.413 H -64.8 -39.9 88.0 0.391 0.022 I:P68431:0.022
DC
DG
DT
DG
DA
DA
DC
8.368
6.272
5.792
9.643
7.967
5.490
8.454
CD
CD
NE
NE
NH1
NH1
NH1
O3'
OP2
OP2
N7
O3'
OP2
OP2
ARG N:36 N:35 93.0 0.413 H -63.0 -41.3 55.0 0.244 0.169 M:P68431:0.169
DA
DA
DA
DC
DC
DC
DG
DC
7.688
5.247
8.464
9.673
8.183
5.746
6.465
8.868
NH2
NH2
NH2
NH2
CD
CD
CD
NE
O3'
OP2
N7
N4
O3'
OP2
OP2
N4
6i84 5 P62799 100.0 4e-68 EM
2019-01-02 ARG F:36 O:35 78.0 0.347 H -69.2 -31.9 78.0 0.347 0.0 DA
DA
DC
DG
DT
DG
9.286
9.144
4.647
2.816
5.154
9.188
CB
NH2
NH2
NH2
NH1
NH1
OP2
O3'
O3'
OP2
C7
O6
ARG I:36 U:35 122.0 0.542 H -71.1 -36.9 93.0 0.413 0.129 H:P84233:0.129
DC
DC
DG
DC
DG
DT
DA
DA
DC
6.461
4.074
4.458
8.655
9.784
9.958
8.211
8.269
9.186
NE
NE
NH2
NH2
NH1
NH1
N
NH1
NH1
O3'
OP2
OP2
N4
O6
O4
OP2
N6
N4
6j99 2 P62799 100.0 4e-68 EM
2019-02-27 ARG B:36 B:35 85.0 0.378 H -63.9 -34.7 85.0 0.378 0.0 DA
DC
DG
DC
DA
DC
DG
DT
DG
9.155
9.163
9.508
8.782
8.163
4.788
2.624
6.143
9.290
CB
NE
NE
NH2
NH2
NH1
NH1
NH2
NE
O5'
OP2
O6
N4
O3'
O3'
OP2
C7
O6
ARG F:36 F:35 89.0 0.396 H -65.4 -39.0 89.0 0.396 0.0 DC
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
9.651
5.389
3.035
5.715
7.515
9.773
7.973
8.613
8.449
7.997
9.228
NH2
NH1
NH1
NH1
CZ
NE
CD
NE
NH2
NH2
NH2
O3'
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
6kw3 1 P62799 100.0 4e-68 EM
2019-11-13 ARG A:36 B:35 84.0 0.373 H -68.9 -29.3 66.0 0.293 0.08 B:P84233:0.08
DC
DC
DG
DC
DG
DA
DA
DC
DG
6.656
4.421
4.088
5.635
9.576
8.473
8.769
8.658
9.626
NE
NE
NH2
NH1
NH1
N
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP2
N6
N4
O6
ARG E:36 R:35 100.0 0.444 H -64.8 -37.7 78.0 0.347 0.097 D:P84233:0.098
DA
DA
DC
DG
DC
DG
DT
DG
DC
9.287
7.035
8.155
9.455
7.367
5.108
3.726
7.797
9.127
NH1
NH1
CD
NH1
NE
NE
NH2
NH2
NH1
C2'
OP2
OP2
O6
O3'
OP2
OP2
OP2
N4
6kw4 2 P62799 100.0 4e-68 EM
2019-11-13 ARG B:36 B:35 98.0 0.436 H -67.9 -17.3 92.0 0.409 0.027 A:P84233:0.027
DC
DC
DG
DC
DG
DA
DA
DC
DG
DG
5.365
3.065
5.785
7.124
9.770
8.830
9.558
7.561
8.630
9.885
NH2
NH2
NH2
NH1
NH1
C
NH1
CD
CZ
NH2
O3'
OP2
OP2
N4
O6
OP2
N6
N4
O6
N2
ARG E:36 R:35 84.0 0.373 H -65.3 -24.7 63.0 0.28 0.093 D:P84233:0.093
DA
DC
DG
DC
DC
DG
DT
DG
DC
8.057
7.408
8.458
9.404
7.338
4.848
4.450
8.019
8.248
NH1
CD
NH1
NE
NE
NE
NH2
NH2
NH1
C2'
OP2
O6
N4
O3'
OP2
C7
OP2
N4
6kw5 13 P62799 100.0 4e-68 EM
2020-09-09 ARG N:36 W:35 105.0 0.467 H -68.5 -34.8 90.0 0.4 0.067 T:P84233:0.067
DA
DC
DG
DC
DC
DG
DT
DG
DC
8.046
8.213
9.184
9.547
6.686
4.420
5.337
9.105
9.671
NH1
CD
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O6
N4
O3'
OP2
OP2
O6
N4
ARG R:36 S:35 86.0 0.382 H -59.9 -45.3 74.0 0.329 0.053 Q:P84233:0.053
DC
DC
DG
DC
DA
DA
DC
DG
6.281
3.816
4.106
7.772
8.441
8.694
9.423
8.672
NH1
NH1
NH2
NH1
CB
CG
NH1
NH1
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6l9z 2 P62805 100.0 4e-68 X-RAY
2021-02-17 ARG B:36 B:35 84.0 0.373 H -61.3 -45.9 73.0 0.324 0.049 A:P68431:0.049
DA
DC
DC
DG
DT
DG
8.262
8.809
5.351
3.124
4.778
8.831
CD
CD
NH1
NH1
NH2
NH2
OP2
OP2
O3'
OP2
OP2
N7
ARG F:36 F:35 92.0 0.409 H -56.9 -44.0 75.0 0.333 0.076 E:P68431:0.076
DA
DC
DC
DG
DC
DA
DA
DC
DG
HOH
9.977
4.747
2.457
4.544
7.973
8.355
9.678
9.565
9.446
3.083
NH2
NH2
NH2
NH1
NH1
CB
N
NE
NH2
CD
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
O
ARG L:36 L:35 90.0 0.4 H -69.3 -44.5 77.0 0.342 0.058 K:P68431:0.058
DC
DC
DG
DC
DA
DA
DC
DG
HOH
5.287
3.004
4.302
8.029
8.406
8.871
9.875
9.472
3.687
NH1
NH1
NH2
NH2
CD
CD
NE
NH2
NH1
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
O
ARG P:36 P:35 91.0 0.404 H -68.8 -41.9 80.0 0.356 0.048 O:P68431:0.049
DA
DC
DC
DA
DC
DG
DT
DG
HOH
8.506
9.635
9.726
9.906
4.878
2.556
4.710
8.657
2.820
CD
N
NH2
NH2
NH2
NH2
NH1
NH1
CD
OP2
OP2
N4
N6
O3'
OP2
OP2
N7
O
6la2 2 P62805 100.0 4e-68 X-RAY
2021-02-17 ARG B:36 f:35 97.0 0.431 H -41.7 -63.6 79.0 0.351 0.08 A:P68431:0.08
DC
DC
DG
DC
DA
DA
DC
DG
DC
5.521
3.047
3.714
7.558
8.461
9.406
9.043
8.375
9.840
NH1
NH1
NH2
NH1
CB
CD
NH1
NH1
NH1
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG F:36 j:35 97.0 0.431 H -42.1 -63.4 77.0 0.342 0.089 E:P68431:0.089
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.522
9.857
9.883
9.109
9.423
5.189
2.831
4.338
8.253
CD
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O6
N4
N6
O3'
OP2
OP2
N7
ARG L:36 B:35 95.0 0.422 H -42.0 -63.4 76.0 0.338 0.084 K:P68431:0.084
DC
DC
DG
DC
DA
DA
DC
DG
DC
5.268
2.795
4.109
7.697
8.486
9.015
9.079
8.502
9.937
NH1
NH1
NH2
NH2
CD
CD
NH1
NH1
NH1
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG P:36 F:35 100.0 0.444 H -42.1 -63.6 79.0 0.351 0.093 O:P68431:0.093
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.210
9.809
9.786
9.169
9.569
5.308
3.024
4.193
8.298
CB
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O6
N4
N6
O3'
OP2
OP2
N7
ARG V:36 L:35 96.0 0.427 H -41.6 -63.7 77.0 0.342 0.085 U:P68431:0.084
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
5.432
3.123
3.932
7.484
9.619
8.478
8.942
8.998
8.351
9.915
NH1
NH1
NH2
NH2
NH2
N
CD
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP1
OP2
N4
O6
N4
ARG Z:36 P:35 99.0 0.44 H -41.9 -63.4 80.0 0.356 0.084 Y:P68431:0.084
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
DC
8.093
9.897
9.770
9.160
9.395
9.931
5.041
2.596
4.642
8.003
9.998
CB
CB
NH2
NH2
NH2
NH2
NH2
NH2
NH1
NH2
NH1
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
N4
ARG FA:36 V:35 98.0 0.436 H -41.8 -63.9 78.0 0.347 0.089 EA:P68431:0.089
DC
DC
DG
DC
DG
DA
DA
DC
DG
5.248
2.937
4.085
7.619
9.814
8.406
8.932
9.195
8.526
NH1
NH1
NH2
NH2
NH2
N
CD
NH1
NH1
O3'
OP2
OP2
N4
O6
OP1
OP2
N4
O6
ARG JA:36 Z:35 99.0 0.44 H -41.8 -63.5 79.0 0.351 0.089 IA:P68431:0.089
DA
DG
DC
DA
DC
DG
DT
DG
8.276
9.938
9.474
9.724
4.927
2.600
4.254
8.424
CB
CZ
NH2
NH2
NH2
NH2
NH1
NH1
OP2
O6
N4
N6
O3'
OP2
OP2
O6
6la8 2 P62805 100.0 4e-68 X-RAY
2020-10-07 ARG B:36 B:35 90.0 0.4 H -40.4 -54.8 59.0 0.262 0.138 A:P68431:0.138
DA
DA
DC
DG
DC
DG
DT
DG
9.434
6.915
9.026
9.928
7.555
5.180
5.198
8.585
NH1
NH1
NH1
NH1
CD
CD
NH2
NH2
C2'
OP2
C5
O6
O3'
OP2
OP2
N7
ARG F:36 F:35 76.0 0.338 H -41.0 -54.6 62.0 0.276 0.062 E:P68431:0.062
DC
DC
DG
DC
DA
DA
DC
DG
5.675
3.386
4.983
8.011
7.715
9.200
9.614
9.138
NH2
NH2
NH1
CZ
CD
NE
NE
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG L:36 L:35 89.0 0.396 H -41.3 -54.2 58.0 0.258 0.138 K:P68431:0.138
DA
DA
DC
DG
DC
DG
DT
DG
DC
8.961
6.734
9.146
9.694
7.440
5.229
5.358
8.426
9.899
NH1
NH1
NH1
NH1
CD
CD
NH2
NH2
NH2
C2'
OP2
OP2
O6
O3'
OP2
OP2
N7
N4
ARG P:36 P:35 78.0 0.347 H -40.5 -54.9 62.0 0.276 0.071 O:P68431:0.071
DA
DC
DC
DG
DC
DA
DA
DC
DG
9.904
5.766
3.254
5.190
9.241
7.932
9.436
9.283
9.493
NH2
NH2
NH2
NH1
NE
CD
NE
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6la9 2 P62805 100.0 4e-68 X-RAY
2020-10-07 ARG B:36 B:35 93.0 0.413 H -43.2 -50.9 67.0 0.298 0.115 A:P68431:0.116
DA
DA
DC
DG
DC
DG
DT
DG
DC
9.622
7.080
8.792
9.417
6.944
4.711
4.766
7.592
9.582
NH1
NH1
CD
NH2
NE
NE
NH2
NH2
NH2
O3'
OP2
OP2
O6
O3'
OP2
OP2
N7
N4
ARG F:36 F:35 85.0 0.378 H -43.3 -50.8 71.0 0.316 0.062 E:P68431:0.062
DA
DC
DC
DG
DC
DA
DA
DC
DG
9.295
5.213
2.856
5.086
8.521
8.131
9.550
9.562
9.462
NH2
NH2
NH2
NH1
NE
CD
NE
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG L:36 L:35 88.0 0.391 H -43.2 -50.5 61.0 0.271 0.12 K:P68431:0.12
DA
DA
DC
DG
DC
DG
DT
DG
9.271
6.864
8.939
9.739
7.281
5.036
4.897
8.305
NH1
NH1
NH1
NH1
NE
CD
NH2
NH2
C2'
OP2
OP2
O6
O3'
OP2
OP2
N7
ARG P:36 P:35 84.0 0.373 H -43.3 -50.8 67.0 0.298 0.075 O:P68431:0.076
DA
DC
DC
DG
DC
DA
DA
DC
DG
9.617
5.100
2.738
4.864
9.146
8.170
9.565
9.628
9.663
NH2
NH2
NH2
NH1
CZ
CD
NE
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6lab 2 P62805 100.0 4e-68 X-RAY
2021-02-17 ARG B:36 B:35 92.0 0.409 H -61.2 -33.4 66.0 0.293 0.116 A:P68431:0.116
DA
DA
DC
DG
DC
DC
DG
DT
DG
DC
9.536
7.054
8.113
9.005
9.115
7.056
4.670
5.661
8.187
9.548
NH1
NH1
NH1
NH1
NH1
CD
CD
NH2
NH2
NH2
O3'
OP2
OP2
O6
N4
O3'
OP2
C7
N7
N4
ARG F:36 F:35 100.0 0.444 H -40.6 -52.2 80.0 0.356 0.088 E:P68431:0.089
DA
DC
DG
DT
DG
DA
DC
DG
DC
DA
9.845
4.909
2.561
4.261
8.056
8.269
9.563
9.684
9.276
9.803
NH2
NH2
NH2
NH1
NH1
CB
CB
NH1
NH1
NH1
O3'
O3'
OP2
C7
N7
OP2
OP2
O6
N4
N6
ARG L:36 L:35 94.0 0.418 H -60.5 -54.1 66.0 0.293 0.125 K:P68431:0.124
DA
DA
DC
DG
DC
DG
DT
DG
DC
9.323
6.896
8.650
9.243
7.470
5.157
5.087
8.640
9.938
NH1
NH1
NH1
NH1
CD
CD
NH2
NH2
NH1
O3'
OP2
C5
O6
O3'
OP2
OP2
N7
N4
ARG P:36 P:35 88.0 0.391 H -58.2 -47.6 75.0 0.333 0.058 O:P68431:0.058
DC
DG
DT
DG
DA
DC
DG
DC
DA
5.387
2.903
4.955
8.515
8.356
9.780
9.773
8.958
9.720
NH2
NH2
NH1
NH2
CD
CB
NH2
NH2
NH2
O3'
OP2
OP2
O6
OP2
OP2
O6
N4
N6
6ler 2 P62805 100.0 4e-68 X-RAY
2021-03-03 ARG B:36 L:35 92.0 0.409 H -51.2 -52.0 NA NA NA
ARG F:36 P:35 95.0 0.422 H -57.8 -41.5 NA NA NA
ARG L:36 B:35 86.0 0.382 H -57.2 -40.1 54.0 0.24 0.142 K:P68431:0.142
DA
DA
DC
DG
DC
DG
DT
DG
HOH
9.215
6.774
8.747
9.527
7.781
5.440
5.051
8.596
9.688
NH1
NH1
NH1
NH1
NE
CD
NH2
NH2
O
O3'
OP2
C5
O6
O3'
OP2
OP2
N7
O
ARG P:36 F:35 93.0 0.413 H -59.7 -39.4 76.0 0.338 0.075 O:P68431:0.076
DC
DC
DG
DC
DA
DA
DC
DG
5.011
2.722
4.241
7.954
8.361
9.664
9.458
9.150
NH2
NH2
NH1
NH1
CD
CB
NE
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6ltj 2 P62799 100.0 4e-68 EM
2020-02-12 ARG B:36 B:35 71.0 0.316 H -66.0 -38.7 61.0 0.271 0.045 A:Q6PI79:0.044
DC
DC
DC
DG
DC
DA
DA
DC
DG
8.940
5.107
2.941
5.623
9.467
7.879
8.729
9.621
9.980
NH2
NH1
NH2
NH1
NE
CB
NE
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:36 F:35 98.0 0.436 H -70.5 -34.2 89.0 0.396 0.04 E:Q6PI79:0.04
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
7.901
7.307
8.618
8.050
9.616
6.627
4.341
4.950
7.598
9.256
NH2
NH1
NH2
NH1
NH1
NE
NE
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
6m3v 2 P62805 100.0 4e-68 X-RAY
2020-10-07 ARG B:36 B:35 106.0 0.471 H -29.4 -58.6 80.0 0.356 0.115 A:P68431:0.116
DC
DC
DG
DC
DA
DC
DG
DC
5.433
3.137
3.881
7.494
8.145
9.242
8.698
9.963
NH2
NH2
NH1
NH2
CD
NH2
NH2
NH2
O3'
OP2
OP2
N4
OP2
N4
O6
N4
ARG F:36 F:35 105.0 0.467 H -29.9 -59.0 75.0 0.333 0.134 E:P68431:0.133
DA
DC
DG
DC
DA
DC
DG
DT
DG
7.961
9.228
9.596
9.048
9.066
5.880
3.817
4.042
7.614
CB
CD
NH1
NH1
NH1
NH1
NH1
NH2
NH1
OP1
OP2
O6
N4
N6
O3'
OP2
OP2
O6
ARG L:36 L:35 107.0 0.476 H -29.4 -58.7 78.0 0.347 0.129 K:P68431:0.129
DA
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
9.797
7.569
8.700
8.916
8.664
8.898
5.884
3.686
3.630
7.249
9.618
CB
CB
CD
NH1
NH1
NH1
NH1
NH1
NH2
NH1
NH2
O3'
OP2
OP2
O6
N4
N6
O3'
OP2
OP2
O6
N4
ARG P:36 P:35 103.0 0.458 H -29.7 -58.9 80.0 0.356 0.102 O:P68431:0.102
DC
DC
DG
DC
DA
DA
DC
DG
5.163
2.971
4.020
7.918
8.530
9.938
9.690
9.164
NH2
NH2
NH1
NH1
CB
N
NE
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6m44 2 P62805 100.0 4e-68 X-RAY
2020-10-07 ARG B:36 B:35 92.0 0.409 H -36.2 -56.1 73.0 0.324 0.085 A:P68431:0.084
DA
DC
DC
DG
DC
DA
DA
DC
DG
9.770
5.192
2.845
4.498
8.319
7.854
9.514
9.696
9.222
NH2
NH2
NH2
NH1
NH2
CD
NE
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:36 F:35 94.0 0.418 H -35.8 -56.6 70.0 0.311 0.107 E:P68431:0.107
DA
DC
DG
DC
DA
DC
DG
DT
DG
7.869
8.873
9.939
9.584
9.352
5.422
3.173
3.706
7.848
CB
CD
NE
NH1
NH1
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
OP2
N7
ARG L:36 L:35 99.0 0.44 H -36.1 -56.1 75.0 0.333 0.107 K:P68431:0.107
DA
DC
DG
DC
DA
DC
DG
DT
DG
7.994
9.567
9.875
9.049
9.041
5.417
3.093
4.149
8.386
CB
CD
CD
NH1
NH1
NH1
NH1
NH2
NH2
OP2
C5
N7
N4
N6
O3'
OP2
OP2
N7
ARG P:36 P:35 91.0 0.404 H -36.4 -56.2 69.0 0.307 0.097 O:P68431:0.098
DA
DC
DC
DG
DC
DA
DA
DC
DG
9.555
5.363
3.144
4.405
8.093
7.997
9.656
9.795
8.870
NH2
NH2
NH2
NH1
NH2
CD
CB
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6m4d 2 P62805 100.0 4e-68 EM
2020-09-23 ARG B:36 B:35 109.0 0.484 H -63.3 -55.0 109.0 0.484 0.0 DC
DC
DC
DG
DC
DA
DA
DA
DC
DG
DC
DG
DG
DG
9.131
4.419
2.074
4.136
7.465
9.744
7.576
7.874
8.934
8.598
8.659
9.135
8.281
9.749
NH2
NH2
NH2
NH1
NH2
N
CB
CD
NE
NH2
NH2
NH2
NH2
NH2
O3'
C2'
OP2
OP2
N4
O3'
OP2
OP2
N4
O6
N4
O6
N2
N2
ARG F:36 F:35 108.0 0.48 H -63.3 -55.0 108.0 0.48 0.0 DA
DA
DC
DG
DC
DA
DC
DG
DA
DC
DG
DT
DG
9.118
7.216
8.309
9.547
8.717
8.077
9.475
8.651
9.300
4.363
2.579
4.250
8.242
CD
N
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
O6
N4
N6
N4
N2
O3'
C2'
OP2
C7
O6
6m4g 4 P62805 100.0 4e-68 EM
2020-09-23 ARG D:36 B:35 71.0 0.316 H -68.2 -34.9 71.0 0.316 0.0 DA
DC
DG
DT
DG
DA
DC
DC
9.093
4.848
2.728
5.743
9.486
8.388
9.581
9.507
NH2
NH1
NH2
NH1
NH2
CB
NE
NH2
O3'
O3'
OP2
OP2
O6
OP2
OP2
N4
ARG G:36 F:35 75.0 0.333 H -68.2 -34.9 75.0 0.333 0.0 DA
DA
DC
DG
DC
DC
DC
DG
DC
8.455
9.457
9.996
9.757
8.829
4.816
2.667
5.815
9.227
CB
NE
NH2
NH2
NH2
NH1
NH2
NH1
NH2
OP2
OP2
N4
O6
O3'
O3'
OP2
OP2
N4
6m4h 4 P62805 100.0 4e-68 EM
2020-09-23 ARG D:36 B:35 75.0 0.333 H -68.2 -34.8 75.0 0.333 0.0 DA
DC
DG
DT
DG
DA
DC
DC
DA
8.576
4.588
2.368
5.499
8.960
8.080
9.407
9.623
9.804
NH2
NH1
NH2
NH1
NH2
N
NE
NH2
NH2
O3'
O3'
OP2
OP2
O6
OP1
OP2
N4
N6
ARG H:36 F:35 73.0 0.324 H -68.2 -34.9 73.0 0.324 0.0 DA
DA
DC
DG
DC
DC
DC
DC
DG
DC
8.065
9.553
9.952
9.214
9.710
8.947
4.806
2.439
5.291
8.376
N
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH1
NH2
OP1
OP2
N4
O6
N4
O3'
O3'
OP2
OP2
N4
6ne3 2 P62799 100.0 4e-68 EM
2019-07-17 ARG B:36 B:35 82.0 0.364 H -65.4 -40.4 74.0 0.329 0.035 A:P84233:0.036
DG
DC
DA
DC
DG
DT
DA
DC
DG
7.766
8.981
9.952
9.461
9.785
5.263
2.956
6.036
9.556
CB
NE
NE
NH2
NH2
NH1
NH1
NH1
CZ
OP2
OP2
N6
N4
O3'
O3'
OP2
OP2
O6
ARG F:36 F:35 101.0 0.449 H -69.0 -37.4 96.0 0.427 0.022 E:P84233:0.022
DG
DC
DG
DT
DT
DA
DA
DA
DA
DC
6.096
3.963
4.642
6.477
9.091
8.098
8.671
7.939
7.381
9.301
NH2
NH2
NH2
NH1
NH1
CB
NH1
NH1
NH1
NH1
O3'
OP2
OP2
C7
O4
OP2
N7
N6
N6
N4
6nzo 2 P62799 100.0 4e-68 EM
2019-08-28 ARG B:36 B:35 83.0 0.369 H -62.4 -35.1 80.0 0.356 0.013 A:A0A310TTQ1:0.013
DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
9.209
4.890
2.483
4.788
8.086
7.728
8.229
9.104
8.972
9.706
NH1
NH2
NH1
NH2
NH2
CB
CD
CD
NH1
NH1
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG F:36 F:35 98.0 0.436 H -60.5 -46.6 92.0 0.409 0.027 E:A0A310TTQ1:0.027
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
7.989
7.924
8.191
8.182
9.092
6.401
4.234
4.553
7.336
8.715
CB
NH1
NH1
NH1
NH1
NH2
NH2
NH1
NH1
NH1
OP2
C5
O6
N4
N6
C2'
OP2
C7
O6
N4
6o1d 2 P62805 100.0 4e-68 EM
2019-05-22 ARG B:36 B:35 78.0 0.347 H -65.2 -37.4 69.0 0.307 0.04 A:P49450:0.04
DA
DA
DA
DC
DT
DT
DG
DG
DA
DG
DT
6.731
4.362
6.474
7.444
9.133
9.666
7.602
7.461
8.511
8.254
9.938
NE
NE
CD
NH2
NH1
NH1
NH1
NH1
NH1
NH2
NH2
O3'
OP2
OP2
N4
O4
O3'
OP2
OP2
N6
O6
O4
ARG F:36 F:35 91.0 0.404 H -63.3 -37.2 81.0 0.36 0.044 E:P49450:0.044
DG
DC
DA
DT
DG
DT
DG
DA
DA
DC
DA
9.392
6.984
7.442
7.180
8.285
9.355
6.838
4.547
6.325
7.405
9.313
NH1
NH1
NH1
NH2
NH2
NH2
NE
NE
CD
NH2
NH1
O3'
OP2
OP2
C7
O6
O4
O3'
OP2
OP2
N4
N6
6o22 5 P62799 100.0 4e-68 NMR
SOLUTION SCATTERING
2019-07-31 ARG F:36 F:35 127.0 0.564 H -59.4 -32.1 127.0 0.564 0.0
6o96 2 P62799 100.0 4e-68 EM
2019-04-24 ARG B:36 B:35 77.0 0.342 H -66.5 -41.1 66.0 0.293 0.049 A:P84233:0.049
DC
DC
DC
DG
DC
DA
DA
DC
DG
8.801
4.898
2.413
5.415
8.717
8.025
9.005
9.546
9.406
NH2
NH2
NH2
NH1
NE
CB
CB
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:36 F:35 81.0 0.36 H -66.5 -39.3 71.0 0.316 0.044 E:P84233:0.044
DA
DC
DC
DA
DC
DG
DT
DG
8.144
8.564
9.712
9.570
4.887
2.461
4.974
9.116
CB
CD
CD
NH1
NH1
NH1
NH2
NE
OP2
OP2
N4
O3'
O3'
OP2
OP2
O6
6om3 2 P62799 100.0 4e-68 X-RAY
2019-07-10 ARG B:36 B:35 90.0 0.4 H -60.5 -45.5 76.0 0.338 0.062 A:P84233:0.062
DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
9.852
5.698
3.195
5.107
7.507
7.919
9.153
8.654
8.334
9.510
NH2
NH2
NH2
NH1
NH2
CB
NE
NH2
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG F:36 F:35 22.0 NA H -62.8 -42.3 17.0 NA NA E:P84233:NA
DA
DC
DC
DG
DT
8.391
9.442
9.587
7.349
8.823
CB
CB
CB
CB
CB
OP2
OP2
O3'
OP2
OP2
ARG N:36 N:35 88.0 0.391 H -61.2 -45.2 NA NA NA
ARG R:36 R:35 96.0 0.427 H -59.1 -45.5 NA NA NA
6pa7 2 P62799 100.0 4e-68 EM
2020-06-17 ARG B:36 B:35 78.0 0.347 H -68.3 -40.4 69.0 0.307 0.04 A:P84233:0.04
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
DC
6.793
4.645
5.645
7.490
9.281
9.582
7.234
7.307
7.791
8.361
9.222
NH2
NE
CD
NH2
NH1
NH1
NH1
NH1
NH1
NH2
NH2
C2'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
O6
N4
ARG F:36 F:35 91.0 0.404 H -68.9 -37.2 83.0 0.369 0.035 E:P84233:0.036
DA
DC
DC
DA
DC
DG
DT
DG
7.894
8.574
9.923
9.745
4.987
2.532
4.010
9.087
CB
CD
NH1
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
OP2
N7
6pwv 5 P62799 100.0 4e-68 EM
2019-12-18 ARG E:36 H:35 77.0 0.342 H -68.9 -28.6 76.0 0.338 0.004 D:P84233:0.004
DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
DG
9.672
5.132
2.723
6.188
7.867
7.616
8.037
8.842
9.073
9.370
9.955
NH2
NH2
NH2
NH2
NH2
CG
CD
CD
CZ
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
N2
ARG I:36 L:35 76.0 0.338 H -68.9 -28.6 76.0 0.338 0.0 DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.010
8.079
8.869
9.010
9.384
5.205
3.033
4.482
8.568
9.668
CG
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NE
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
6pww 5 P62799 100.0 4e-68 EM
2019-12-18 ARG E:36 H:35 74.0 0.329 H -69.2 -29.0 74.0 0.329 0.0 DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
9.550
5.012
2.662
5.969
7.918
7.751
8.175
9.125
8.960
9.478
NH2
NH2
NH2
NH2
NE
CG
CD
CD
CZ
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG M:36 L:35 75.0 0.333 H -69.2 -28.9 75.0 0.333 0.0 DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
7.976
8.530
9.197
9.435
9.856
5.071
2.833
4.699
9.030
9.898
CG
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
CD
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
6pwx 3 P62799 100.0 4e-68 EM
2019-12-18 ARG C:36 H:35 113.0 0.502 H -68.3 -42.3 113.0 0.502 0.0 DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
5.454
3.318
4.076
5.696
8.810
8.220
9.044
7.688
7.003
8.714
NH2
NH2
NH2
NH1
NH1
CB
N
NH1
NH1
NH1
O3'
O5'
OP2
N4
O6
OP2
OP2
N4
O6
N4
ARG K:36 L:35 112.0 0.498 H -68.2 -42.3 112.0 0.498 0.0 DA
DC
DG
DC
DA
DG
DC
DG
DT
DG
DC
8.408
9.017
7.986
7.856
8.584
9.760
5.079
2.726
3.335
6.962
8.608
N
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
NH1
OP1
N4
O6
N4
N6
N2
O3'
O5'
C7
O6
N4
6px1 2 P62799 100.0 4e-68 EM
2019-08-28 ARG B:36 B:35 83.0 0.369 H -69.0 -34.6 83.0 0.369 0.0 DC
DC
DC
DG
DC
DA
DA
DC
DG
9.349
4.917
2.541
4.668
8.217
8.008
8.509
9.351
9.603
NH1
NH1
NH1
NH2
NH2
CB
CD
CD
CZ
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:36 F:35 89.0 0.396 H -69.0 -35.0 89.0 0.396 0.0 DA
DC
DG
DC
DA
DC
DG
DT
DG
8.079
8.435
9.924
9.577
9.429
4.958
2.584
4.545
8.504
CB
CD
NE
CZ
NH1
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
O3'
O3'
OP2
OP2
N7
6px3 2 P62799 100.0 4e-68 EM
2019-08-28 ARG B:36 B:35 82.0 0.364 H -62.4 -35.1 79.0 0.351 0.013 A:A0A310TTQ1:0.013
DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
9.210
4.891
2.483
4.788
8.086
7.727
8.229
9.104
8.972
9.705
NH1
NH2
NH1
NH2
NH2
CB
CD
CD
NH1
NH1
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG F:36 F:35 100.0 0.444 H -60.5 -46.6 93.0 0.413 0.031 E:A0A310TTQ1:0.031
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
7.989
7.923
8.191
8.182
9.092
6.401
4.234
4.552
7.335
8.715
CB
NH1
NH1
NH1
NH1
NH2
NH2
NH1
NH1
NH1
OP2
C5
O6
N4
N6
C2'
OP2
C7
O6
N4
6r0c 2 P62805 100.0 4e-68 EM
2019-09-25 ARG B:36 B:35 93.0 0.413 H -60.5 -46.6 87.0 0.387 0.026 A:P84243:0.027
DA
DG
DC
DC
DA
DC
DC
DT
DG
8.112
8.325
9.182
8.899
9.895
6.435
4.102
5.772
8.656
CB
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH2
OP2
OP2
N4
N4
N6
O3'
OP2
C7
O6
ARG F:36 F:35 94.0 0.418 H -47.7 -46.1 94.0 0.418 0.0 DT
DT
DG
DT
DC
DT
DA
DA
DG
DA
9.835
5.771
3.271
5.412
8.481
8.553
8.727
9.774
9.126
9.249
NH2
NH2
NH2
NH2
NH2
CD
NE
NH2
NH2
NH2
O3'
O3'
OP2
C7
N4
OP2
OP2
N6
O6
N6
6r8y 5 P62805 100.0 4e-68 EM
2019-06-12 ARG F:36 F:36 93.0 0.413 H -61.9 -39.4 84.0 0.373 0.04 E:P68431:0.04
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
9.047
4.167
2.246
5.057
7.291
8.200
9.517
8.465
8.874
9.487
NH2
HH12
HH12
HH11
HH21
HB3
H
HH21
HH21
HH21
O3'
O3'
O5'
OP2
H41
OP2
OP2
H72
O6
O4
6rny 2 P62805 100.0 4e-68 EM
2019-09-25 ARG B:36 B:35 103.0 0.458 H -67.3 -39.2 93.0 0.413 0.045 A:P84243:0.044
DA
DG
DC
DC
DA
DG
DC
DC
DT
DG
DG
8.159
8.307
7.922
7.463
8.254
9.829
5.820
3.792
3.890
6.546
9.192
N
NH1
NH1
NH1
NH2
NH2
NH2
NH2
NH1
NH1
NH1
OP1
OP2
N4
N4
N6
O3'
O3'
OP2
C7
O6
O6
ARG F:36 F:35 101.0 0.449 H -67.2 -39.3 93.0 0.413 0.036 E:P84243:0.036
DT
DG
DT
DC
DT
DG
DT
DA
DA
DG
DA
6.960
6.127
4.561
6.779
8.404
9.478
7.351
7.805
7.192
8.016
9.075
NH2
NH2
NH1
NH1
NH1
NH1
CB
NH1
NH1
NH1
NH2
C2'
OP2
C7
N4
O4
O3'
OP2
N7
N6
O6
N6
6ryr 2 P62799 100.0 4e-68 EM
2020-07-15 ARG B:36 B:35 82.0 0.364 H -62.4 -39.9 73.0 0.324 0.04 A:P84233:0.04
DA
DC
DC
DG
DT
DG
8.261
8.731
4.951
2.845
4.356
8.665
CB
CD
NH1
NH1
NH2
NH2
OP2
OP2
O3'
OP2
OP2
N7
ARG F:36 F:35 90.0 0.4 H -62.9 -43.1 77.0 0.342 0.058 E:P84233:0.058
DC
DC
DG
DC
DA
DA
DC
DG
4.929
2.987
4.701
7.626
8.150
8.928
9.286
9.196
NH2
NH2
NH2
NH1
CB
CG
NH1
NH1
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6ryu 2 P62799 100.0 4e-68 EM
2020-07-15 ARG B:36 B:35 99.0 0.44 H -62.7 -34.8 86.0 0.382 0.058 A:P84233:0.058
DA
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
DC
9.918
7.512
9.253
9.017
8.440
9.266
9.558
5.079
3.067
5.011
7.914
9.782
CG
CG
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
NH1
O3'
OP2
C5
O6
N4
N6
O3'
O3'
OP2
C7
O6
N4
ARG F:36 F:35 100.0 0.444 H -62.6 -34.8 89.0 0.396 0.048 E:P84233:0.049
DC
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
9.569
4.680
2.562
6.127
7.460
9.691
8.034
9.309
8.448
8.121
9.246
NH2
NH2
NH2
NH1
NH1
NH1
CG
CB
NH1
NH1
NH1
O3'
O3'
OP2
N7
N4
O6
OP2
OP2
N4
O6
N4
6se0 2 P62805 100.0 4e-68 EM
2019-08-14 ARG B:36 B:35 86.0 0.382 H -62.8 -38.4 86.0 0.382 0.0 DA
DA
DC
DG
DC
DC
DG
DT
DG
DC
9.271
6.879
6.048
8.280
8.507
7.225
4.915
6.258
8.423
9.154
NH1
NH1
NH2
NH2
NH2
CD
CD
NH1
NH1
NH1
O3'
OP2
OP2
N7
N4
O3'
OP2
C7
O6
N4
ARG F:36 F:35 105.0 0.467 H -67.5 -29.9 105.0 0.467 0.0 DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
4.939
2.985
4.460
7.166
9.573
8.720
9.319
8.212
7.937
9.008
NH2
NH2
NH2
NH1
NH1
CB
CD
NH1
NH1
NH1
O3'
O5'
OP2
N4
O6
OP2
OP2
N4
O6
N4
6se6 2 P62805 100.0 4e-68 EM
2019-08-14 ARG B:36 B:35 99.0 0.44 H -66.7 -40.4 92.0 0.409 0.031 A:P49450:0.031
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.842
7.845
8.438
8.147
9.419
7.055
4.627
4.803
7.840
9.190
CB
NH1
NH2
NH1
NH1
CZ
CZ
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
ARG F:36 F:35 110.0 0.489 H -62.4 -39.5 102.0 0.453 0.036 E:P49450:0.036
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
DG
DG
6.292
3.589
3.483
6.769
8.917
8.494
8.983
7.977
8.272
9.992
9.925
9.889
NH2
NH2
NH2
NH1
NH1
CB
NH1
NH1
NH1
NH1
NH2
NH2
O3'
C2'
OP2
N4
O6
OP2
N7
N4
O6
N4
N2
N2
6see 2 P62805 100.0 4e-68 EM
2019-08-14 ARG B:36 B:35 108.0 0.48 H -64.5 -44.1 108.0 0.48 0.0 DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.098
4.162
5.679
6.594
8.722
8.525
8.798
7.464
7.696
8.943
NH1
NH1
NH2
NH2
NH2
CB
NH1
NH2
NH2
NH1
C3'
OP2
N7
N4
O6
OP2
OP2
N4
O6
N4
ARG F:36 F:35 70.0 0.311 H -64.9 -42.2 53.0 0.236 0.075 E:P49450:0.076
DA
DA
DC
DC
DG
DT
9.265
6.784
8.678
7.092
4.769
6.385
NH1
NH1
NH1
CD
CD
NE
O3'
OP2
OP2
O3'
OP2
OP2
6sef 2 P62805 100.0 4e-68 EM
2019-08-14 ARG B:36 B:35 85.0 0.378 H -65.0 -44.2 85.0 0.378 0.0 DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.254
7.858
8.116
8.123
9.178
6.977
4.587
4.903
7.732
9.035
CB
NH1
NH2
NH2
NH2
NH1
CZ
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
C2'
OP2
C7
O6
N4
ARG F:36 F:35 122.0 0.542 H -62.3 -45.5 122.0 0.542 0.0 DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
DG
DG
4.717
2.791
4.124
7.045
9.249
8.315
9.168
8.168
8.185
9.407
9.977
9.155
NH2
NH2
NH2
NH1
NH1
CB
CB
NH1
NH1
NH1
NH2
NH2
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
N2
N2
6seg 2 P62805 100.0 4e-68 EM
2019-08-14 ARG B:36 B:35 116.0 0.516 H -66.0 -36.2 109.0 0.484 0.032 A:P49450:0.031
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
DC
8.291
8.391
8.353
8.339
8.631
9.387
5.704
3.310
3.909
7.604
8.756
CB
NH2
NH2
NH2
NH1
NH1
NH1
NH1
NH2
NH2
NH2
OP2
C5
O6
N4
N6
O3'
C2'
OP2
C7
O6
N4
ARG F:36 F:35 91.0 0.404 H -63.5 -38.5 74.0 0.329 0.075 E:P49450:0.076
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.423
4.224
3.499
6.855
9.290
8.020
9.127
8.621
8.204
9.686
NH1
NH1
NH2
NH1
NH1
CB
CD
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
6t79 2 P62805 100.0 4e-68 EM
2020-04-29 ARG B:36 B:35 92.0 0.409 H -64.9 -31.1 89.0 0.396 0.013 A:Q71DI3:0.013
DC
DT
DT
DT
DG
DA
DA
DC
DA
DA
8.660
8.226
9.441
9.322
9.786
4.771
2.796
4.455
7.720
9.955
N
NH1
NH1
NH1
NH2
NH2
NH2
NH2
NH1
NH1
OP2
C7
O4
O4
O6
O3'
O5'
OP2
N7
N6
ARG F:36 F:35 107.0 0.476 H -64.8 -33.7 87.0 0.387 0.089 E:Q71DI3:0.089
DT
DT
DA
DT
DT
DA
DA
DA
DA
6.235
3.796
3.639
6.514
9.431
8.091
9.184
8.925
9.375
NE
NE
NH2
NH1
NH1
NH1
CD
NH1
NH1
O3'
OP2
OP2
C7
O4
OP2
OP2
N6
N6
6t7a 2 P62805 100.0 4e-68 EM
2020-04-29 ARG B:36 B:35 95.0 0.422 H -63.5 -29.3 91.0 0.404 0.018 A:Q71DI3:0.018
DC
DT
DT
DT
DG
DA
DA
DC
DA
DA
8.144
7.940
8.820
8.901
9.219
5.707
3.398
4.315
7.624
9.449
N
NH1
NH1
NH1
NH1
NH1
NH1
NH2
NH1
NH1
OP2
C7
C7
O4
O6
O3'
OP2
OP2
N6
N6
ARG F:36 F:35 108.0 0.48 H -63.2 -34.7 108.0 0.48 0.0 DT
DT
DA
DT
DT
DA
DA
DA
DA
DT
5.781
3.811
4.228
6.620
9.890
8.826
8.620
9.135
9.207
9.870
NH2
NH2
NH2
NH1
NH1
CB
CD
NH1
NH2
NH2
O3'
OP2
OP2
C7
O4
OP2
OP2
N6
N6
O4
6t7b 2 P62805 100.0 4e-68 EM
2020-04-29 ARG B:36 B:35 50.0 NA H -63.5 -29.2 50.0 NA NA DC
DT
DA
DA
DC
8.142
9.314
9.513
7.404
9.353
N
N
CA
CA
O
OP2
OP2
O3'
OP1
OP2
ARG F:36 F:35 51.0 NA H -63.2 -34.6 51.0 NA NA DT
DT
DA
DA
DA
9.670
7.670
9.307
8.830
9.503
CA
CA
O
N
N
O3'
OP1
OP2
OP2
OP2
6t7c 2 P62805 100.0 4e-68 EM
2020-04-29 ARG B:36 B:35 94.0 0.418 H -63.3 -29.3 90.0 0.4 0.018 A:Q71DI3:0.018
DC
DT
DT
DT
DG
DA
DA
DC
DA
DA
8.148
8.214
8.866
8.909
9.186
5.687
3.384
4.206
7.598
9.406
N
NH1
NH1
NH1
NH1
NH1
NH1
NH2
NH1
NH1
OP2
C7
O4
O4
O6
O3'
OP2
OP2
N6
N6
ARG F:36 F:35 109.0 0.484 H -63.1 -34.5 109.0 0.484 0.0 DT
DT
DA
DT
DT
DA
DA
DA
DA
DT
5.754
3.848
4.278
6.609
9.943
8.937
8.644
9.201
9.292
9.933
NH2
NH2
NH2
NH1
NH1
CB
CD
NH1
NH2
NH2
O3'
O5'
OP2
C7
O4
OP2
OP2
N6
N6
O4
6t7d 2 P62805 100.0 4e-68 EM
2020-04-29 ARG B:36 B:35 49.0 NA H -63.4 -42.1 49.0 NA NA DC
DT
DA
8.502
9.252
8.509
N
N
CA
OP2
OP2
OP1
ARG F:36 F:35 47.0 NA H -66.3 -37.0 47.0 NA NA DT
DA
DA
8.485
8.759
9.302
CA
N
N
OP2
OP2
OP2
6tem 2 P62799 100.0 4e-68 EM
2020-04-08 ARG B:36 B:35 127.0 0.564 H -80.0 -19.3 118.0 0.524 0.04 A:P49450:0.04
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.017
8.067
8.070
8.210
9.474
6.249
3.927
4.033
7.252
8.053
NE
NH2
NH2
NH1
NH1
NH1
NH1
NH1
NH2
NH2
OP2
C5
O6
N4
N6
O3'
OP2
C7
O6
N4
ARG F:36 F:35 94.0 0.418 H -64.7 -40.8 86.0 0.382 0.036 E:P49450:0.036
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.294
4.221
5.601
6.998
8.823
8.369
8.654
7.074
8.134
9.402
NH2
NH2
NH1
NH1
NH1
CB
NH2
NH1
NH1
NH2
C2'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
6upk 2 P62805 100.0 4e-68 EM
2019-12-11 ARG B:36 B:35 62.0 0.276 H -69.2 -30.0 62.0 0.276 0.0 DA
DC
DA
DC
DG
DT
8.362
8.961
9.228
3.927
2.033
4.890
N
CG
NH1
NH1
NH1
NH2
OP1
OP2
O3'
O3'
OP2
OP2
ARG F:36 F:35 69.0 0.307 H -70.4 -35.7 66.0 0.293 0.014 E:P68431:0.013
DC
DC
DC
DG
DC
DA
DA
DC
DG
8.549
5.725
4.236
9.701
8.598
8.032
6.844
9.260
9.206
NH2
NH2
NE
CD
NH1
NH1
NH1
NH1
NH1
O3'
C3'
OP2
OP2
N4
OP2
OP2
N4
O6
6upl 2 P62805 100.0 4e-68 EM
2019-12-11 ARG B:36 B:35 103.0 0.458 H -68.7 -35.0 103.0 0.458 0.0 DA
DA
DC
DC
DG
DC
DG
DT
DG
8.923
6.879
7.335
9.556
9.953
5.672
3.523
3.709
9.338
N
N
CG
NH1
NH2
NH2
NH1
NH2
NH1
O3'
OP1
OP2
N4
N2
O3'
OP2
OP2
O6
ARG F:36 F:35 89.0 0.396 H -65.8 -43.0 68.0 0.302 0.094 E:P68431:0.093
DC
DC
DG
DA
DA
DA
DA
6.882
5.085
6.888
9.860
6.197
3.868
7.660
CG
CG
CD
NH2
NH2
NH2
NH2
O3'
OP1
OP2
O3'
C2'
OP2
OP2
6v92 24 P62805 100.0 4e-68 EM
2020-01-15 ARG CA:36 b:35 93.0 0.413 H -58.1 -49.1 84.0 0.373 0.04 BA:P68431:0.04
DC
DA
DT
DG
DG
DA
DA
DC
8.434
8.580
9.356
9.474
4.968
3.061
4.372
7.360
N
CG
NE
NH2
NH1
NH1
NH2
NH2
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
ARG GA:36 f:35 87.0 0.387 H -63.1 -44.4 56.0 0.249 0.138 FA:P68431:0.138
DT
DG
DA
DA
DC
DC
DA
DT
DG
8.157
6.073
6.627
9.071
9.417
7.940
5.580
6.989
9.440
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
6vz4 2 P62799 100.0 4e-68 EM
2020-12-02 ARG B:36 B:36 87.0 0.387 H -53.8 -46.4 76.0 0.338 0.049 A:Q92133:0.049
DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
9.809
5.469
2.954
5.410
8.200
8.440
9.220
9.631
9.326
9.607
NH2
NH2
NH2
NH1
NH2
CB
N
NH2
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG F:36 F:36 92.0 0.409 H -56.7 -42.8 87.0 0.387 0.022 E:Q92133:0.022
DA
DC
DA
DC
DG
DT
DG
8.161
8.154
9.910
5.364
2.968
4.730
8.814
CD
CD
NH1
NH1
NH1
NH2
NH2
OP2
OP2
O3'
O3'
OP2
OP2
N7
6w5i 6 P62799 100.0 4e-68 EM
2021-03-31 ARG F:36 H:35 76.0 0.338 H -68.9 -28.7 76.0 0.338 0.0 DC
DC
DC
DG
DC
DA
DA
DA
DC
DG
DC
DG
9.186
4.503
2.137
6.072
8.022
9.875
7.457
7.943
8.657
8.825
9.150
9.874
NH2
NH2
NH2
NH2
NE
CG
CG
CD
CD
CZ
NH2
NH2
O3'
O3'
OP2
OP2
N4
O3'
OP2
OP2
N4
O6
N4
N2
ARG J:36 L:35 76.0 0.338 H -68.9 -28.6 76.0 0.338 0.0 DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
7.842
7.578
8.859
8.966
9.424
9.550
4.851
2.569
4.988
9.121
CG
CD
NE
NH2
NH2
NH1
NH2
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
6w5m 6 P62799 100.0 4e-68 EM
2021-03-31 ARG F:36 H:35 76.0 0.338 H -69.0 -28.4 76.0 0.338 0.0 DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
DG
9.279
4.595
2.280
6.024
8.173
7.784
8.271
9.018
9.257
9.567
9.977
NH1
NH2
NH2
NH2
NE
CG
CD
CD
CZ
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
N2
ARG J:36 L:35 78.0 0.347 H -68.9 -28.5 77.0 0.342 0.005 I:P84233:0.004
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.117
8.290
9.057
9.215
9.610
9.841
4.982
2.876
4.900
9.073
CG
CD
CD
NH1
NH2
NH1
NH2
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
6w5n 6 P62799 100.0 4e-68 EM
2021-03-31 ARG F:36 H:35 76.0 0.338 H -68.9 -28.6 76.0 0.338 0.0 DC
DC
DC
DG
DC
DA
DA
DA
DC
DG
DC
DG
9.195
4.696
2.257
6.158
7.851
9.870
7.444
7.934
8.559
8.775
9.109
9.778
NH2
NH2
NH2
NH2
NH2
CG
CG
CD
CD
CZ
NH2
NH2
O3'
O3'
OP2
N7
N4
O3'
OP2
OP2
N4
O6
N4
N2
ARG J:36 L:35 78.0 0.347 H -69.1 -28.4 78.0 0.347 0.0 DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.062
8.178
8.957
9.084
9.465
9.508
4.640
2.479
4.665
8.905
CG
CD
CD
NH1
NH2
NH1
NH2
NH2
NH2
NE
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
6wkr 10 P62799 100.0 4e-68 EM
2021-02-03 ARG J:36 J:35 76.0 0.338 H -55.9 -41.2 65.0 0.289 0.049 I:P84233:0.049
DA
DC
DG
DC
DG
DC
DC
DC
DG
8.261
7.280
9.127
8.994
9.837
6.922
4.512
7.619
8.992
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH1
NH2
OP2
OP2
N7
N4
O6
C3'
OP2
C5
O6
ARG N:36 Q:35 78.0 0.347 H -53.4 -45.2 70.0 0.311 0.036 M:P84233:0.036
DG
DT
DG
DC
DA
DA
6.159
3.940
5.901
8.924
8.020
8.339
NH2
NH2
NH2
NH2
CD
CD
O3'
OP2
OP2
N4
OP2
OP2
6y5d 2 P62805 100.0 4e-68 EM
2020-09-23 ARG B:36 B:36 81.0 0.36 H -60.6 -39.1 76.0 0.338 0.022 A:Q71DI3:0.022
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.334
9.469
9.708
9.110
9.838
9.575
5.220
2.871
5.000
8.406
CB
CB
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG F:36 F:36 75.0 0.333 H -58.8 -43.5 75.0 0.333 0.0 DC
DC
DG
DC
DA
DA
5.011
2.778
4.674
9.267
8.812
9.022
NH1
NH1
NH2
NH2
CD
CD
O3'
OP2
OP2
N4
OP2
OP2
ARG N:36 N:36 93.0 0.413 H -63.4 -40.2 93.0 0.413 0.0 DA
DC
DG
DC
DA
DC
DG
DT
DG
8.835
7.822
8.533
8.256
9.635
5.373
2.852
5.411
8.215
NH1
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH1
C2'
OP2
N7
N4
N6
O3'
OP2
C7
O6
ARG R:36 R:36 101.0 0.449 H -63.1 -40.0 89.0 0.396 0.053 Q:Q71DI3:0.053
DC
DC
DG
DC
DG
DA
DA
DC
DG
5.656
3.674
4.022
7.138
9.112
9.149
9.227
8.342
8.444
NH2
NH2
NH2
NH1
NH1
N
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP1
N7
N4
O6
6zhx 2 P62799 100.0 4e-68 EM
2020-12-23 ARG B:36 B:35 78.0 0.347 H -57.1 -49.6 69.0 0.307 0.04 A:A0A310TTQ1:0.04
DA
DA
DC
DG
DC
DA
DG
DA
DC
DG
DT
DG
DC
9.420
7.198
7.872
8.503
7.271
7.756
9.447
8.551
4.038
1.771
4.271
7.883
8.793
HB3
HB3
HE
HH21
HH21
HH21
HH22
HH22
HH22
HH22
HH21
HH21
HE
H3'
OP2
H5
O6
H42
H62
H21
H2''
H2''
OP2
H71
O6
H42
ARG F:36 F:35 91.0 0.404 H -56.8 -48.9 62.0 0.276 0.128 E:A0A310TTQ1:0.129
DC
DC
DG
DC
DA
DA
DA
DC
DG
6.174
4.139
3.976
6.612
8.749
6.804
8.251
8.477
9.485
HE
HH21
HH21
HH21
HH11
HH11
HD3
HD3
HD2
H2''
H3'
OP2
H5
H2''
OP2
OP2
H42
O6
6zhy 2 P62799 100.0 4e-68 EM
2020-12-23 ARG B:36 B:35 77.0 0.342 H -56.0 -46.5 68.0 0.302 0.04 A:A0A310TTQ1:0.04
DA
DA
DC
DG
DC
DA
DC
DG
DA
DC
DG
DT
DG
DC
9.491
7.270
8.129
8.769
7.650
7.534
9.893
9.136
8.366
3.814
1.749
3.354
7.870
8.620
HB3
HB3
HE
HH21
HH21
HH21
HH21
HH22
HH22
HH12
HH22
HH21
HH21
HE
H2''
OP2
H5
O6
H42
H62
H41
H21
O3'
O3'
OP2
H71
O6
H42
ARG F:36 F:35 80.0 0.356 H -55.0 -44.2 53.0 0.236 0.12 E:A0A310TTQ1:0.12
DC
DC
DG
DC
DA
DA
DA
DC
DG
6.028
3.878
4.732
7.488
9.006
6.879
8.193
8.328
9.494
HE
HE
HH21
HH12
HH11
HH11
HD3
HD3
HD2
H2''
OP2
OP2
H5
H3'
OP2
OP2
H42
O6
7dbp 3 P62805 100.0 4e-68 EM
2020-12-23 ARG C:36 B:35 91.0 0.404 H -64.8 -44.3 91.0 0.404 0.0 DA
DG
DC
DG
DT
DG
DC
8.605
8.869
9.664
4.854
2.704
6.030
8.523
CB
NH2
NH2
NH2
NH1
NH1
NH2
OP2
O6
O3'
O3'
OP1
OP2
N4
ARG G:36 F:35 82.0 0.364 H -64.7 -44.3 82.0 0.364 0.0 DC
DC
DC
DC
DG
DA
DC
9.446
5.573
3.220
6.008
9.236
8.950
9.949
NH2
NH2
NH2
NH1
NH2
CB
NH2
O3'
O3'
OP2
OP2
O6
OP2
N4
7jo9 2 P62805 100.0 4e-68 EM
2020-09-16 ARG B:36 B:35 89.0 0.396 H -60.8 -43.2 88.0 0.391 0.005 A:Q71DI3:0.004
DA
DA
DC
DG
DC
DC
DG
DC
8.443
8.838
9.948
9.767
5.506
3.112
4.911
8.402
CB
CD
CD
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
O3'
OP2
OP2
N4
ARG F:36 F:35 91.0 0.404 H -60.9 -46.7 85.0 0.378 0.026 E:Q71DI3:0.027
DC
DG
DT
DG
DC
DA
DC
DG
DC
DA
6.963
4.499
5.458
7.735
9.144
8.384
8.395
8.585
8.535
9.677
NH2
NH2
NH1
NH1
NH1
CB
NH2
NH1
NH1
NH1
O3'
OP2
C7
O6
N4
OP2
OP2
O6
N4
N6
7joa 2 P62805 100.0 4e-68 EM
2020-09-16 ARG B:36 B:35 89.0 0.396 H -58.3 -46.4 88.0 0.391 0.005 A:Q71DI3:0.004
DA
DA
DC
DG
DC
DC
DG
DC
8.298
8.596
9.866
9.950
5.720
3.297
5.093
8.454
CB
CD
CD
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
O3'
OP2
OP2
N4
ARG F:36 F:35 90.0 0.4 H -58.4 -48.8 82.0 0.364 0.036 E:Q71DI3:0.036
DA
DC
DG
DT
DG
DC
DA
DC
DG
DC
DA
9.920
5.981
3.500
5.706
8.021
9.456
8.230
8.695
9.031
8.655
9.771
NH2
NH2
NH2
NH1
NH1
NH1
CB
NH1
NH1
NH1
NH1
O3'
O3'
OP2
C7
O6
N4
OP2
OP2
O6
N4
N6
7k5x 2 P62805 100.0 4e-68 EM
2020-11-25 ARG B:36 B:35 93.0 0.413 H -63.7 -42.9 87.0 0.387 0.026 A:P68431:0.027
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.654
5.247
2.811
4.765
8.061
8.065
8.319
9.304
9.473
NH1
NH1
NH1
NH2
NH2
CB
CD
NE
CZ
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:36 F:35 79.0 0.351 H -63.5 -42.6 72.0 0.32 0.031 E:P68431:0.031
DA
DC
DC
DA
DC
DG
DT
DG
8.279
8.246
9.906
9.517
5.128
2.848
4.733
9.049
CB
CD
NH1
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
OP2
N7
7k5y 2 P62805 100.0 4e-68 EM
2020-11-25 ARG B:36 B:35 72.0 0.32 H -62.4 -42.1 64.0 0.284 0.036 A:P68431:0.036
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.906
5.139
2.815
5.247
8.512
8.135
8.373
9.393
9.723
NH1
NH2
NH2
NH2
NE
CD
CD
CD
NE
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:36 F:35 86.0 0.382 H -62.1 -43.2 73.0 0.324 0.058 E:P68431:0.058
DA
DC
DG
DC
DC
DG
DT
DG
8.131
8.237
9.666
9.842
5.494
3.199
4.716
8.465
CB
CD
NE
NE
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
O3'
OP2
OP2
N7
7k60 2 P62805 100.0 4e-68 EM
2020-11-25 ARG B:36 B:35 89.0 0.396 H -60.8 -45.2 77.0 0.342 0.054 A:P68431:0.053
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
DC
7.351
4.925
7.269
6.743
8.460
8.986
6.608
5.778
6.577
7.565
9.810
CD
CD
CD
NH2
NH2
NH1
NH1
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
O6
N4
ARG F:36 F:35 94.0 0.418 H -61.7 -48.1 94.0 0.418 0.0 DA
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
DG
8.978
6.426
5.595
7.245
7.533
9.419
7.804
5.467
5.727
7.307
8.347
9.678
NH1
NH2
NH2
NH2
NH2
NH2
CD
CD
NH1
NH2
NH1
NH2
C2'
C2'
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
O6
7k61 2 P62805 100.0 4e-68 EM
2020-11-25 ARG B:36 B:35 81.0 0.36 H -62.8 -41.6 71.0 0.316 0.044 A:P68431:0.044
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.306
4.951
2.561
4.685
7.991
8.127
8.339
9.328
9.409
NH1
NH1
NH1
NH2
NH2
CB
CD
CD
CZ
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:36 F:35 74.0 0.329 H -63.4 -41.0 63.0 0.28 0.049 E:P68431:0.049
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.092
8.400
9.803
9.610
9.367
5.051
2.858
4.977
8.832
CB
CD
CD
NH1
NH1
NH2
NH1
NH2
NH2
OP2
OP2
O6
N4
O3'
O3'
OP2
C7
O6
7k63 2 P62805 100.0 4e-68 EM
2020-11-25 ARG B:36 B:35 72.0 0.32 H -62.9 -41.9 60.0 0.267 0.053 A:P68431:0.053
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
DC
6.760
4.437
6.439
7.583
8.948
9.402
7.004
7.231
7.453
8.169
9.535
NH2
NE
CD
NH1
NH1
NH1
NH1
NH1
NH1
NH2
NH2
C2'
OP2
OP2
N4
O6
O3'
OP2
OP2
N4
O6
N4
ARG F:36 F:35 90.0 0.4 H -61.9 -43.4 79.0 0.351 0.049 E:P68431:0.049
DA
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
DG
9.003
6.401
5.583
7.250
7.224
9.307
7.580
5.182
5.681
7.258
8.405
9.919
NH2
NH2
NH2
NH2
NH2
NH2
CD
CD
NH1
NH2
NH2
NH2
O3'
C2'
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
O6
7kbd 2 P62799 100.0 4e-68 EM
2021-09-15 ARG B:36 B:35 85.0 0.378 H -61.9 -39.5 77.0 0.342 0.036 A:P84233:0.036
DA
DA
DC
DC
DC
DC
DG
DC
8.207
8.451
9.508
9.569
5.018
3.131
5.636
8.780
CB
CD
CD
NH1
NH2
NH2
NH2
NE
OP2
OP2
N4
O3'
O3'
OP2
OP2
N4
ARG F:36 F:35 82.0 0.364 H -59.2 -43.7 72.0 0.32 0.044 E:P84233:0.044
DA
DC
DG
DT
DG
DA
DC
DC
9.601
4.957
2.949
5.345
9.185
8.368
8.393
9.958
NH1
NH2
NH2
NH2
NE
CB
CD
NH1
O3'
O3'
OP2
OP2
O6
OP2
OP2
N4
7kbe 2 P62799 100.0 4e-68 EM
2021-09-15 ARG B:36 B:35 99.0 0.44 H -62.7 -41.2 89.0 0.396 0.044 A:P84233:0.044
DA
DA
DC
DG
DC
DC
DG
DC
8.144
8.866
9.865
9.637
4.866
2.673
4.159
7.637
CB
CD
NE
CZ
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
O3'
OP2
OP2
N4
ARG F:36 F:35 99.0 0.44 H -59.5 -47.2 84.0 0.373 0.067 E:P84233:0.067
DA
DC
DG
DT
DG
DC
DA
DC
DC
9.893
4.739
2.907
4.876
8.130
9.902
7.860
8.620
9.660
NH2
NH2
NH2
NH1
NH1
NH1
CB
CG
NH1
O3'
O3'
O5'
OP2
N7
N4
OP2
OP2
N4
7kbf 2 P62799 100.0 4e-68 EM
2021-09-15 ARG B:36 B:35 104.0 0.462 H -49.8 -63.5 94.0 0.418 0.044 A:P84233:0.044
DA
DA
DC
DA
DC
DG
DT
DG
9.729
7.666
8.725
9.958
4.893
2.833
4.764
8.568
CB
CB
CB
NH1
NH1
NH1
NH2
NH2
O3'
OP2
OP2
O3'
O3'
OP1
OP2
N7
ARG F:36 F:35 73.0 0.324 H -46.7 -63.9 73.0 0.324 0.0 DC
DG
DT
DG
DC
DA
DA
DC
DG
DC
8.174
5.856
7.438
8.635
9.362
8.780
6.304
4.922
7.806
8.241
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
C7
O6
N4
O3'
C2'
OP2
N7
N4
7m1x 4 P62799 100.0 4e-68 EM
2021-09-29 ARG D:36 B:35 95.0 0.422 H -64.6 -48.7 83.0 0.369 0.053 C:A0A310TTQ1:0.053
DA
DA
DC
DG
DC
DC
DC
DC
DG
DC
DG
8.147
8.488
8.524
8.583
9.940
9.938
5.753
3.364
6.345
8.148
9.966
CB
NH2
NH2
NH2
NH2
NH1
NH1
NH1
CD
NH2
NH2
OP2
OP2
N4
O6
N4
O3'
O3'
OP2
OP2
N4
O6
ARG H:36 F:235 77.0 0.342 H -58.6 -45.3 77.0 0.342 0.0 DA
DC
DG
DT
DG
DA
DC
DC
8.774
4.817
2.437
6.117
9.330
8.039
9.435
9.967
NH2
NH2
NH2
NH1
NE
CD
CB
NE
O3'
O3'
OP2
OP2
O6
OP2
OP2
N4
7mbm 6 P62799 100.0 4e-68 EM
2021-12-29 ARG F:36 H:35 91.0 0.404 H -65.1 -39.5 89.0 0.396 0.008 E:A0A310TTQ1:0.009
DA
DC
DG
DT
DA
DC
9.865
5.189
2.911
6.937
9.444
9.748
NH2
NH1
NH1
NH1
CB
NE
O3'
O3'
OP2
C7
OP2
OP2
ARG J:36 L:35 84.0 0.373 H -65.9 -41.7 82.0 0.364 0.009 I:A0A310TTQ1:0.009
DA
DA
DC
DC
DC
DG
8.994
9.361
9.680
5.581
3.276
7.030
CD
NE
NH2
NH1
NH1
NH1
OP2
OP2
O3'
O3'
OP2
OP2
7mbn 6 P62799 100.0 4e-68 EM
2021-12-29 ARG F:36 H:35 77.0 0.342 H -68.9 -28.6 75.0 0.333 0.009 E:A0A310TTQ1:0.009
DC
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
DC
DG
DG
9.730
5.250
2.868
5.682
7.251
9.475
9.619
7.170
7.885
8.254
8.490
8.943
9.960
9.687
NH1
NH2
NH2
NH2
NH2
NE
CG
CG
CD
CD
CZ
NH2
NH2
NH2
O3'
O3'
OP2
N7
N4
O6
O3'
OP2
OP2
N4
O6
N4
N1
N2
ARG J:36 L:35 76.0 0.338 H -68.9 -28.6 75.0 0.333 0.005 I:A0A310TTQ1:0.004
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
7.865
8.121
8.596
8.734
9.229
5.236
3.114
4.323
8.423
9.489
CG
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NE
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
7nkx 12 P62799 100.0 4e-68 EM
2021-08-25 ARG L:36 b:35 81.0 0.36 H -57.3 -49.1 81.0 0.36 0.0 DA
DA
DC
DC
DA
DG
DA
DC
DG
DT
DG
9.832
7.735
9.017
9.320
9.445
9.924
9.672
4.711
2.695
4.381
8.820
CB
CB
CB
NH1
NH1
NH2
NH1
NH2
NH1
NH2
NH1
O3'
OP2
OP2
N4
N6
N2
O3'
O3'
OP2
OP2
O6
ARG P:36 f:35 94.0 0.418 H -56.8 -51.7 80.0 0.356 0.062 O:P84233:0.062
DC
DC
DC
DG
DC
DA
DA
DC
DG
DG
9.790
4.645
2.526
4.927
7.789
8.227
9.144
9.566
9.377
9.905
NH1
NH1
NH1
NH2
NH2
CB
CB
CD
NH2
NH1
O3'
O3'
OP2
OP2
C5
OP2
OP2
N4
O6
N2
7nky 21 P62799 100.0 4e-68 EM
2021-07-07 ARG U:36 b:35 59.0 0.262 H -65.0 -42.2 59.0 0.262 0.0 DA
DC
DG
DT
DG
DA
DC
DC
9.385
4.681
2.631
4.945
9.123
9.020
8.556
9.828
NH1
NH1
NH1
NH2
NE
N
CD
NE
O3'
O3'
OP2
OP2
O6
OP1
OP2
N4
ARG Y:36 f:35 98.0 0.436 H -62.5 -40.9 98.0 0.436 0.0 DA
DA
DC
DG
DC
DG
DG
DC
DC
DG
DC
DG
9.164
8.714
7.337
6.911
8.676
9.569
9.576
5.354
3.139
4.607
5.772
8.494
N
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH2
NH2
NH1
NH1
OP1
N7
N4
O6
N4
N1
N2
O3'
OP2
OP2
N4
O6
7nl0 2 P62805 100.0 4e-68 EM
2021-08-11 ARG B:36 B:35 81.0 0.36 H -66.4 -40.8 70.0 0.311 0.049 A:P68431:0.049
DG
DA
DA
DT
DA
DT
DT
DT
DA
8.259
9.572
9.818
9.284
9.540
5.333
2.935
5.685
9.013
CB
NE
NE
NH2
NH2
NH2
NH2
NH1
NH2
OP2
OP2
N6
O4
O3'
O3'
OP2
OP2
N6
ARG F:36 F:35 77.0 0.342 H -61.1 -42.7 70.0 0.311 0.031 E:P68431:0.031
DG
DA
DA
DG
DG
DC
DT
DT
9.440
5.159
2.810
5.330
9.498
8.296
8.278
9.111
NH1
NH1
NH1
NH2
NE
CB
CD
CD
O3'
O3'
OP2
OP2
O6
OP2
C7
C7
7otq 3 P62799 100.0 4e-68 EM
2021-09-15 ARG C:36 B:35 74.0 0.329 H -55.1 -48.7 74.0 0.329 0.0 DA
DC
DG
DC
DA
DG
DA
DC
DG
DT
DG
DC
7.895
7.701
9.615
8.978
8.664
9.145
8.014
3.938
1.958
3.739
8.075
9.795
HB2
HD3
HD3
HD2
HH22
HH22
HH12
HH12
HH22
HH21
HH21
HE
OP2
OP2
N7
H42
H62
H21
O3'
H3'
OP2
H73
O6
H41
ARG G:36 F:35 75.0 0.333 H -61.1 -42.7 70.0 0.311 0.022 F:P84233:0.022
DC
DC
DC
DG
DC
DA
DA
DA
DC
DG
DC
DG
9.020
4.301
2.139
4.802
7.166
9.333
7.292
7.955
8.317
9.981
9.626
9.764
HH21
HH21
HH21
HH22
HH11
HB2
HB2
HG3
HD3
HD2
HD2
HH21
O3'
O3'
OP1
OP2
H42
H2''
OP2
OP2
H42
O6
H41
H21
3a6n 2 P62805 100.0 4e-68 X-RAY
2010-05-26 ARG B:39 B:35 88.0 0.391 H -58.3 -52.2 76.0 0.338 0.053 A:Q16695:0.053
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.361
8.592
9.837
9.995
4.737
2.649
4.198
8.111
3.421
N
CG
CG
NH2
NH1
NH1
NH2
NH2
NH2
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 85.0 0.378 H -61.1 -45.6 55.0 0.244 0.134 E:Q16695:0.133
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.059
5.856
6.451
8.896
9.456
7.759
5.368
6.990
9.339
2.719
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
CD
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
3afa 2 P62805 100.0 4e-68 X-RAY
2010-05-26 ARG B:39 B:35 86.0 0.382 H -61.7 -50.8 72.0 0.32 0.062 A:P68431:0.062
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.521
8.563
9.614
9.937
4.850
2.682
4.202
7.958
3.760
N
CG
CD
NH1
NH1
NH1
NH2
NH2
NH1
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 90.0 0.4 H -63.9 -47.1 59.0 0.262 0.138 E:P68431:0.138
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.350
6.192
6.408
9.103
9.230
7.670
5.362
6.982
9.244
2.634
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
3an2 2 B2R4R0 100.0 4e-68 X-RAY
2011-07-20 ARG B:39 B:35 99.0 0.44 H -64.8 -71.1 87.0 0.387 0.053 A:P49450:0.053
DT
DC
DT
DA
DC
DA
DA
DA
8.495
8.970
8.652
5.943
3.983
4.525
8.230
9.587
N
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP1
N4
O4
O3'
O5'
OP2
N7
N6
ARG F:39 F:35 88.0 0.391 H -77.8 -24.5 68.0 0.302 0.089 E:P49450:0.089
DA
DC
DA
DA
DA
DT
DT
DC
DT
DT
7.303
5.234
5.988
7.775
8.497
8.520
5.920
8.544
8.690
9.543
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NE
O3'
OP1
OP2
N7
N6
C2'
C7
C5
O4
O4
3av1 2 P62805 100.0 4e-68 X-RAY
2011-06-01 ARG B:39 B:35 94.0 0.418 H -67.8 -45.1 77.0 0.342 0.076 A:Q71DI3:0.076
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.431
8.647
9.536
9.757
5.055
2.926
4.181
7.709
4.177
N
CG
NE
NH2
NH1
NH1
NH2
NH2
NH1
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 89.0 0.396 H -64.3 -45.0 57.0 0.253 0.143 E:Q71DI3:0.142
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.433
6.192
6.405
9.093
9.442
7.602
5.233
7.160
9.490
4.127
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
3av2 2 P62805 100.0 4e-68 X-RAY
2011-06-01 ARG B:39 B:35 91.0 0.404 H -59.9 -52.4 77.0 0.342 0.062 A:P84243:0.062
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.322
8.470
9.650
9.924
4.913
2.680
4.184
8.054
3.647
CB
CG
CG
NH1
NH1
NH1
NH2
NH2
NH1
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 85.0 0.378 H -65.8 -42.4 63.0 0.28 0.098 E:P84243:0.098
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.784
5.455
6.678
8.868
8.880
8.091
5.820
6.870
8.984
9.976
5.902
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NH2
NE
CD
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O4
O
3ayw 2 P62805 100.0 4e-68 X-RAY
2011-09-21 ARG B:39 B:35 74.0 0.329 H -61.2 -47.9 65.0 0.289 0.04 A:P68431:0.04
DC
DA
DT
DG
DG
DA
DA
DC
8.395
8.776
9.097
9.910
5.040
2.851
4.727
8.490
CB
CD
CD
NH1
NH1
NH1
NH2
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 75.0 0.333 H -45.4 -51.1 50.0 0.222 0.111 E:P68431:0.111
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.861
5.362
6.500
8.918
9.506
8.216
6.004
7.356
9.539
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C3'
OP2
C7
O6
3aze 2 P62805 100.0 4e-68 X-RAY
2011-09-21 ARG B:39 B:35 83.0 0.369 H -87.6 -43.7 50.0 0.222 0.147 A:P68431:0.147
DG
DC
DA
DT
DG
DA
DA
DC
DA
8.888
7.075
9.272
9.529
7.802
5.520
6.506
9.053
9.989
NH2
NH2
NE
NE
CD
CD
NH1
NE
NH2
C3'
OP2
OP2
C7
O3'
OP2
OP2
N4
N6
ARG F:39 F:35 84.0 0.373 H -61.6 -42.2 62.0 0.276 0.097 E:P68431:0.098
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
7.240
4.847
6.289
8.588
8.907
8.625
6.438
6.579
8.787
9.926
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O4
3azf 2 P62805 100.0 4e-68 X-RAY
2011-09-21 ARG B:39 B:35 87.0 0.387 H -56.6 -48.8 75.0 0.333 0.054 A:P68431:0.053
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.571
8.548
9.951
9.968
4.893
2.771
4.299
7.952
3.212
N
CG
NE
NH2
NH1
NH1
NH2
NH2
NE
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 84.0 0.373 H -62.5 -43.7 57.0 0.253 0.12 E:P68431:0.12
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.082
5.819
6.816
9.144
9.474
7.916
5.577
7.048
9.428
4.242
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
3azg 2 P62805 100.0 4e-68 X-RAY
2011-09-21 ARG B:39 B:35 88.0 0.391 H -62.8 -47.9 73.0 0.324 0.067 A:P68431:0.067
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.560
8.545
9.695
9.963
4.944
2.702
4.284
7.954
4.049
N
CG
NE
NH2
NH1
NH1
NH2
NH2
NH1
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 87.0 0.387 H -65.6 -46.2 59.0 0.262 0.125 E:P68431:0.124
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.311
6.083
6.418
9.180
9.358
7.708
5.345
6.887
9.318
5.087
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
CD
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
3azh 2 P62805 100.0 4e-68 X-RAY
2011-09-21 ARG B:39 B:35 86.0 0.382 H -55.5 -46.1 72.0 0.32 0.062 A:P68431:0.062
DC
DA
DT
DG
DG
DA
DA
DC
8.330
9.082
8.760
9.274
4.978
2.650
5.892
8.073
CB
NH1
NH1
NH2
NH2
NH2
NE
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 82.0 0.364 H -62.5 -28.2 70.0 0.311 0.053 E:P68431:0.053
DT
DG
DA
DA
DC
DA
DT
DG
DT
5.104
2.868
6.123
8.006
9.560
7.662
8.053
8.760
8.627
NH2
NH2
NH2
NH1
NH1
CG
NH1
NH1
NH1
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
3w96 2 P62805 100.0 4e-68 X-RAY
2013-08-28 ARG B:39 B:35 82.0 0.364 H -43.5 -44.9 54.0 0.24 0.124 A:P68431:0.124
DG
DC
DA
DT
DG
DA
DA
DC
9.253
7.046
8.839
9.032
7.590
5.384
5.970
8.902
NH2
NH2
NE
NE
CD
CD
NH1
NE
C2'
OP2
OP2
C7
O3'
OP2
OP2
N4
ARG F:39 F:35 88.0 0.391 H -60.3 -58.8 67.0 0.298 0.093 E:P68431:0.093
DT
DG
DA
DA
DA
DT
DG
6.104
3.838
4.366
8.615
8.049
7.962
9.625
NH1
NH1
NH2
NH2
CD
CD
CD
O3'
OP2
OP2
N7
OP2
C7
O6
3w97 2 P62805 100.0 4e-68 X-RAY
2013-08-28 ARG B:39 B:35 97.0 0.431 H -55.5 -34.3 70.0 0.311 0.12 A:P68431:0.12
DC
DA
DT
DG
DA
DA
DC
DA
8.397
8.927
9.261
7.183
4.794
5.005
8.511
9.890
NH2
NE
NE
NH1
CD
NH1
NH2
NH2
OP2
OP2
C7
O3'
OP2
OP2
C5
N6
ARG F:39 F:35 89.0 0.396 H -52.3 -66.3 66.0 0.293 0.103 E:P68431:0.102
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.562
5.221
6.421
8.906
9.064
8.948
6.632
7.334
8.950
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N7
N4
C3'
OP2
C7
O6
3w98 2 P62805 100.0 4e-68 X-RAY
2013-08-28 ARG B:39 B:35 106.0 0.471 H -56.7 -41.8 81.0 0.36 0.111 A:P68431:0.111
DC
DA
DT
DG
DA
DA
DC
DA
8.926
9.061
9.016
5.515
3.639
4.017
7.696
9.958
N
CD
CD
NH1
NH1
NH2
NH2
NH2
OP1
OP2
C7
O3'
OP1
OP2
C5
N6
ARG F:39 F:35 88.0 0.391 H -57.5 -62.6 72.0 0.32 0.071 E:P68431:0.071
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
6.275
3.851
4.817
7.908
9.726
7.778
7.712
9.346
8.730
9.920
NH2
NH2
NH1
NH2
NH2
CD
NE
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O4
3wa9 2 P62805 100.0 4e-68 X-RAY
2013-12-18 ARG B:39 B:35 87.0 0.387 H -51.2 -52.0 74.0 0.329 0.058 A:P68431:0.058
DC
DA
DT
DG
DG
DA
DA
DC
8.319
8.719
9.889
9.810
4.871
2.629
4.118
8.129
CB
CG
CG
NH1
NH1
NH1
NH2
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 81.0 0.36 H -61.1 -51.9 53.0 0.236 0.124 E:P68431:0.124
DT
DG
DA
DA
DC
DC
DA
DT
DG
8.020
5.819
6.497
8.957
9.307
7.953
5.578
7.041
9.109
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
C3'
OP2
C7
O6
3waa 2 P62805 100.0 4e-68 X-RAY
2013-12-18 ARG B:39 B:35 92.0 0.409 H -61.1 -42.5 71.0 0.316 0.093 A:P68431:0.093
DC
DA
DT
DG
DG
DA
DA
DC
8.628
8.904
8.975
9.861
5.242
3.123
4.174
8.349
N
CD
CD
CZ
NH1
NH1
NH2
NH2
OP1
OP2
C7
O6
O3'
OP2
OP2
C5
ARG F:39 F:35 84.0 0.373 H -55.0 -50.1 56.0 0.249 0.124 E:P68431:0.124
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.894
5.607
6.371
8.962
9.725
8.492
6.230
7.688
9.157
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
3wkj 2 P62805 100.0 4e-68 X-RAY
2014-04-09 ARG B:39 B:35 94.0 0.418 H -62.8 -42.2 74.0 0.329 0.089 A:P68431:0.089
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.658
8.674
9.821
9.794
5.051
3.048
4.200
7.773
8.818
N
CG
NE
NH2
NH1
NH1
NH2
NH2
N
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 85.0 0.378 H -65.4 -46.8 58.0 0.258 0.12 E:P68431:0.12
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.164
5.968
6.687
9.125
9.783
8.002
5.482
7.352
9.555
2.587
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
3wtp 2 P62805 100.0 4e-68 X-RAY
2014-12-03 ARG B:39 B:35 83.0 0.369 H -52.6 -45.3 66.0 0.293 0.076 A:P49450:0.076
DC
DA
DT
DG
DA
DA
DC
8.645
8.464
8.927
4.895
2.927
4.149
8.789
N
CD
CD
NH1
NH1
NH2
NE
OP1
OP2
C7
O3'
OP2
OP2
N4
ARG F:39 F:35 82.0 0.364 H -55.9 -46.2 55.0 0.244 0.12 E:P84243:0.12
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.904
5.729
6.409
9.111
9.581
8.038
5.579
6.913
9.391
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
4ym5 2 P62805 100.0 4e-68 X-RAY
2015-12-02 ARG B:39 B:35 99.0 0.44 H -63.8 -47.2 73.0 0.324 0.116 A:P68431:0.116
DC
DA
DT
DG
DG
DA
DA
DC
8.242
8.856
8.909
9.463
6.646
4.248
3.743
8.017
CB
CD
CD
NE
NE
NE
NH2
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 100.0 0.444 H -66.8 -48.3 75.0 0.333 0.111 E:P68431:0.111
DG
DA
DA
DC
DA
DC
DA
DT
DG
6.787
4.560
3.823
7.778
9.288
8.018
8.865
8.769
9.564
NE
NE
NH2
NH2
NH2
CB
CD
CD
NE
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
4ym6 2 P62805 100.0 4e-68 X-RAY
2015-12-02 ARG B:39 B:35 81.0 0.36 H -58.8 -47.7 55.0 0.244 0.116 A:P68431:0.116
DG
DC
DA
DT
DG
DA
DA
DC
8.139
5.771
8.510
9.579
8.165
5.885
6.992
9.312
NH2
NH2
NE
NE
CD
CD
NH1
CD
O3'
OP2
OP2
C7
O3'
OP2
OP2
N4
ARG F:39 F:35 82.0 0.364 H -59.6 -51.0 55.0 0.244 0.12 E:P68431:0.12
DT
DG
DA
DC
DA
DT
DG
7.798
5.299
6.916
7.956
5.778
7.501
9.759
CD
CD
CD
NH2
NH2
NE
NE
O3'
OP2
OP2
C2'
OP2
C7
O6
4z5t 2 P62805 100.0 4e-68 X-RAY
2016-02-10 ARG B:39 B:35 94.0 0.418 H -67.1 -42.8 52.0 0.231 0.187 A:Q6NXT2:0.187
DG
DC
DA
DT
DG
DA
DA
DC
DA
8.415
5.938
8.805
9.564
8.454
6.289
6.458
9.116
9.613
NH1
NH1
NH1
NH1
CG
CD
NE
NH1
NH1
C2'
OP2
OP2
C7
O3'
OP2
OP2
N4
N6
ARG F:39 F:35 90.0 0.4 H -65.1 -41.8 52.0 0.231 0.169 E:Q6NXT2:0.169
DT
DG
DA
DA
DC
DC
DA
DT
DG
8.578
6.360
6.366
9.618
9.633
7.407
5.111
8.013
9.978
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N7
N4
C3'
OP2
C7
O6
5ay8 2 P62805 100.0 4e-68 X-RAY
2016-04-06 ARG B:39 B:35 85.0 0.378 H -61.8 -40.4 74.0 0.329 0.049 A:None:0.049
DC
DA
DT
DG
DG
DA
DA
DC
MN
8.521
8.905
9.254
9.773
5.189
2.927
4.461
7.707
8.785
CB
CD
CD
CZ
NH1
NH1
NH2
NH2
N
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
MN
ARG F:39 F:35 76.0 0.338 H -62.9 -38.6 66.0 0.293 0.045 E:None:0.044
DT
DG
DA
DA
DA
DT
DG
5.432
3.127
4.766
9.224
8.510
8.078
9.647
NH2
NH1
NH2
CZ
CD
CD
CD
O3'
OP2
OP2
N6
OP2
C7
O6
5b0y 2 P62805 100.0 4e-68 X-RAY
2016-01-27 ARG B:39 B:35 86.0 0.382 H -56.1 -41.3 76.0 0.338 0.044 A:Q71DI3:0.044
DC
DA
DT
DG
DG
DA
DA
DC
8.646
8.628
8.879
9.921
5.263
2.977
4.402
7.878
CB
CD
CD
CZ
NH1
NH1
NH2
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 87.0 0.387 H -54.6 -46.4 57.0 0.253 0.134 E:Q71DI3:0.133
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.103
5.898
6.542
8.933
9.168
7.892
5.381
6.997
9.266
6.967
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
5b0z 2 P62805 100.0 4e-68 X-RAY
2016-01-27 ARG B:39 B:35 81.0 0.36 H -53.6 -43.4 69.0 0.307 0.053 A:Q71DI3:0.053
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.253
9.430
9.065
9.862
5.305
2.937
5.030
8.714
3.461
CD
NE
NE
NH2
NH2
NH2
NH1
NE
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 78.0 0.347 H -57.5 -45.1 66.0 0.293 0.054 E:Q71DI3:0.053
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
5.664
3.357
6.397
7.906
9.790
8.280
7.574
8.523
8.404
2.983
NH1
NH1
CD
NH2
NH2
CB
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
5b1l 2 P62806 100.0 4e-68 X-RAY
2017-02-15 ARG B:39 B:35 79.0 0.351 H -57.4 -45.3 68.0 0.302 0.049 A:None:0.049
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.676
9.180
8.593
9.244
5.595
3.090
5.135
8.156
3.058
CD
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 88.0 0.391 H -59.5 -46.6 65.0 0.289 0.102 E:None:0.102
DT
DG
DA
DA
DC
DA
DC
DA
DT
DG
DT
HOH
7.874
5.809
6.333
7.879
8.039
9.968
8.201
5.752
5.770
8.139
9.332
3.952
CD
CD
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
N6
O3'
OP2
C7
O6
O4
O
5b1m 2 P62806 100.0 4e-68 X-RAY
2017-02-15 ARG B:39 B:35 66.0 0.293 H -56.5 -44.7 59.0 0.262 0.031 A:P68433:0.031
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.540
8.868
8.982
9.781
9.681
4.612
2.700
6.391
8.697
9.100
CB
CG
NH1
NH1
NH2
NH2
NH2
NH2
NE
N
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG F:39 F:35 93.0 0.413 H -58.5 -43.1 73.0 0.324 0.089 E:P68433:0.089
DT
DG
DA
DA
DC
DA
DC
DA
DT
DG
DT
HOH
8.119
5.875
6.343
7.646
8.105
9.909
8.208
5.783
5.451
7.606
8.834
3.601
CD
CD
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
N6
O3'
OP2
C7
O6
O4
O
5b24 2 P62805 100.0 4e-68 X-RAY
2016-03-02 ARG B:39 B:35 88.0 0.391 H -62.5 -41.2 75.0 0.333 0.058 A:P68431:0.058
DC
DA
DT
DG
DG
DA
DA
DC
8.547
9.015
8.997
9.305
4.686
2.454
4.434
7.960
CD
CB
NE
NH2
NH2
NH2
NH1
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 100.0 0.444 H -67.5 -29.2 66.0 0.293 0.151 E:P68431:0.151
DT
DG
DA
DA
DC
DA
DC
DA
DT
DG
8.973
6.796
7.675
8.822
8.250
9.853
7.640
5.506
6.449
8.727
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
N6
C2'
OP2
C7
O6
5b2i 2 P62805 100.0 4e-68 X-RAY
2016-06-15 ARG B:39 B:35 85.0 0.378 H -60.9 -40.2 74.0 0.329 0.049 A:P68431:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.845
9.431
9.339
9.229
9.463
4.941
2.536
5.416
8.822
CB
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH2
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:39 F:35 77.0 0.342 H -65.9 -41.1 65.0 0.289 0.053 E:P68431:0.053
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
6.715
4.229
6.589
7.902
9.516
9.828
7.360
7.048
8.201
8.910
NH2
NH2
NE
NH2
NH1
NH1
NH1
NH1
NH1
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
5b2j 2 P62805 100.0 4e-68 X-RAY
2016-06-15 ARG B:39 B:35 74.0 0.329 H -61.6 -39.1 63.0 0.28 0.049 A:P68431:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.650
9.117
9.166
9.119
9.401
5.144
2.742
5.518
8.429
7.472
CB
NE
NH2
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
OP2
C7
O6
O3'
C3'
OP2
OP2
N4
O
ARG F:39 F:35 71.0 0.316 H -56.4 -47.5 59.0 0.262 0.054 E:P68431:0.053
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.314
4.841
6.393
7.685
8.741
9.505
7.109
6.469
7.808
8.370
4.756
NH2
NH2
CD
NH2
NH1
NH1
NH1
NH1
NH1
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O
5b31 2 P62805 100.0 4e-68 X-RAY
2016-08-03 ARG B:39 B:35 83.0 0.369 H -57.6 -48.7 71.0 0.316 0.053 A:P68431:0.053
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.365
9.155
9.450
9.777
4.923
2.931
5.012
8.696
3.206
CB
CB
NH1
NH2
NH2
NH2
NH2
NH2
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 85.0 0.378 H -52.5 -51.7 54.0 0.24 0.138 E:P68431:0.138
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.147
5.867
6.550
9.027
9.152
7.669
5.328
6.866
9.240
2.794
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
5b32 2 P62805 100.0 4e-68 X-RAY
2016-08-03 ARG B:39 B:35 83.0 0.369 H -62.4 -44.7 70.0 0.311 0.058 A:P84243:0.058
DC
DA
DT
DG
DA
DA
DC
8.516
9.201
9.402
4.840
2.886
5.009
8.453
N
CB
NH1
NH2
NH2
NH2
NH2
OP1
OP2
C7
O3'
OP2
OP2
N4
ARG F:39 F:35 89.0 0.396 H -63.6 -40.3 63.0 0.28 0.116 E:P84243:0.116
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.787
5.727
6.570
8.157
8.162
7.982
5.511
5.921
8.212
9.657
3.942
CD
CD
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O
5b33 2 P62805 100.0 4e-68 X-RAY
2016-08-03 ARG B:39 B:35 89.0 0.396 H -56.9 -49.6 70.0 0.311 0.085 A:P84243:0.084
DC
DA
DT
DG
DG
DA
DA
DC
8.323
9.216
9.258
9.585
4.577
2.565
4.586
8.640
CB
CD
CD
NH2
NH2
NH2
NH1
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 80.0 0.356 H -65.2 -42.8 59.0 0.262 0.094 E:P84243:0.093
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.427
5.145
6.344
8.557
9.152
8.684
6.262
7.173
9.125
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
5cpi 2 P62805 100.0 4e-68 X-RAY
2015-10-28 ARG B:39 B:35 87.0 0.387 H -64.7 -48.0 85.0 0.378 0.009 A:P68431:0.009
DC
DA
DA
DA
DC
DC
DA
DT
8.861
8.743
9.805
8.846
5.422
3.276
4.261
7.598
CB
CD
NH1
NH1
NH2
NH1
NH2
NH1
OP2
OP2
N6
N6
O3'
OP2
OP2
O4
ARG F:39 F:35 96.0 0.427 H -68.5 -47.7 86.0 0.382 0.045 E:P68431:0.044
DG
DC
DT
DC
DA
DT
DT
DT
DG
DA
4.476
2.501
4.164
6.886
8.880
7.823
8.243
8.695
8.409
9.372
NH2
NH2
NH1
NH1
NH1
CB
NH1
NH1
NH1
NH1
O3'
OP2
C7
N4
N6
OP2
C7
C7
O6
N6
5cpj 2 P62805 100.0 4e-68 X-RAY
2015-10-28 ARG B:39 B:35 113.0 0.502 H -69.6 -38.0 87.0 0.387 0.115 A:P68431:0.116
DT
DC
DA
DA
DA
DC
DC
DA
DT
DT
9.878
7.478
8.443
8.707
8.962
9.132
6.920
5.985
6.096
8.675
CG
NE
CG
NH1
NH1
NH1
NH1
NH1
NH1
NH1
O3'
OP2
OP2
N6
N6
O3'
C2'
OP2
C7
O4
ARG F:39 F:35 122.0 0.542 H -69.0 -45.9 90.0 0.4 0.142 E:P68431:0.142
DG
DC
DT
DC
DA
DA
DT
DT
DT
DG
DA
7.607
5.451
4.609
6.027
7.738
9.431
7.708
6.433
6.787
7.905
9.701
CD
CD
NH1
NH1
NH1
NH2
NH2
NH1
NH1
NH1
NH1
O3'
OP2
C7
N4
N6
C2'
OP2
C7
O4
O6
N6
5cpk 2 P62805 100.0 4e-68 X-RAY
2015-10-28 ARG B:39 B:35 86.0 0.382 H -72.9 -35.7 74.0 0.329 0.053 A:P68431:0.053
5CM
DG
DA
DA
DC
DT
DG
DT
DT
7.836
8.080
8.422
8.201
5.561
3.318
6.280
7.967
9.801
CD
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
OP2
N6
N6
O3'
OP2
OP2
O4
O4
ARG F:39 F:35 81.0 0.36 H -71.5 -41.9 71.0 0.316 0.044 E:P68431:0.044
DC
DT
DT
5CM
DG
DT
DT
5CM
DG
DA
6.739
4.253
5.650
7.335
8.746
8.036
5.886
7.259
7.857
9.215
NH1
NH1
NH2
NH2
NH2
NE
NH2
NH2
NH2
NH2
O3'
OP2
C7
C5A
O6
OP2
C7
C5A
O6
N6
5gse 2 P62805 100.0 4e-68 X-RAY
2017-05-03 ARG B:39 B:35 91.0 0.404 H -55.2 -44.9 84.0 0.373 0.031 A:P68431:0.031
DA
DA
DC
DG
DC
DG
DC
DC
DC
DG
DC
8.315
9.228
9.440
8.866
9.290
9.722
8.740
4.731
2.364
4.624
7.217
CB
CB
NE
NH2
NH2
NH2
NH1
NH2
NH1
NH2
NH2
OP2
OP2
N4
O6
N4
N2
O3'
O3'
OP2
OP2
N4
ARG F:39 F:35 92.0 0.409 H -56.8 -42.9 87.0 0.387 0.022 E:P68431:0.022
DA
DC
DG
DT
DG
DA
DC
DC
DA
DG
9.738
4.818
2.590
4.396
8.027
8.295
9.643
9.090
9.523
9.701
NH1
NH2
NH1
NH2
NH2
CB
N
CZ
NH2
NH2
O3'
O3'
OP2
C7
O6
OP2
OP2
N4
N6
N2
ARG L:39 L:35 99.0 0.44 H -55.5 -55.4 90.0 0.4 0.04 K:P68431:0.04
DA
DC
DG
DT
DG
DA
DC
DC
DA
9.773
4.386
2.150
4.086
8.590
8.196
8.929
9.808
9.982
NH1
NH1
NH1
NH2
NH2
CB
CG
NH2
NH2
O3'
O3'
OP2
OP2
O6
OP2
OP2
N4
N6
ARG P:39 P:35 86.0 0.382 H -56.3 -45.4 79.0 0.351 0.031 O:P68431:0.031
DA
DA
DC
DG
DC
DC
DC
DC
DG
DC
8.718
9.649
9.478
9.443
9.949
9.018
4.554
2.369
4.342
7.842
CB
CB
NE
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
N4
O3'
O3'
OP2
OP2
N4
5gtc 2 P62805 100.0 4e-68 X-RAY
2017-06-28 ARG B:39 B:35 100.0 0.444 H -66.8 -37.8 72.0 0.32 0.124 A:P68431:0.124
DG
DC
DA
DT
DG
DG
DA
DA
DC
DA
8.889
6.853
8.638
9.137
9.835
7.736
5.510
5.350
8.092
8.886
NH2
NH2
NH2
NH2
NE
CD
CD
NH1
NH2
NH2
C2'
OP2
N7
O4
O6
O3'
OP2
OP2
C5
N6
ARG F:39 F:35 86.0 0.382 H -65.0 -37.1 53.0 0.236 0.146 E:P68431:0.147
DT
DG
DA
DA
DC
DC
DA
DT
DG
8.234
5.984
6.653
9.040
9.868
7.826
5.335
7.451
9.703
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
5gxq 2 P62805 100.0 4e-68 X-RAY
2017-04-19 ARG B:39 B:35 93.0 0.413 H -57.4 -47.3 82.0 0.364 0.049 A:None:0.049
DC
DA
DT
DG
DG
DA
DA
DC
8.486
8.726
9.582
9.412
4.833
2.636
3.873
7.590
CB
CG
NH2
NH2
NH1
NH1
NH2
NH2
OP2
OP2
O4
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 86.0 0.382 H -63.2 -47.4 56.0 0.249 0.133 E:None:0.133
DT
DG
DA
DA
DC
DC
DA
DT
DG
8.101
5.888
6.537
9.120
9.322
7.782
5.462
7.052
9.270
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C3'
OP2
C7
O6
5jrg 2 P62805 100.0 4e-68 X-RAY
2017-03-08 ARG B:39 B:35 73.0 0.324 H -66.6 -41.6 63.0 0.28 0.044 A:P68431:0.044
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.711
9.039
9.076
9.211
9.951
5.443
3.005
5.110
8.201
8.688
N
NE
NH2
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP1
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG F:39 F:35 75.0 0.333 H -65.9 -43.0 67.0 0.298 0.035 E:P68431:0.036
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
9.862
5.474
3.061
5.492
8.270
8.537
8.918
8.648
9.078
5.713
NH2
NH1
NH2
NH1
NH2
CD
NE
NH2
NH2
NH1
O3'
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
O
5x7x 2 P62805 100.0 4e-68 X-RAY
2017-04-19 ARG B:39 B:35 94.0 0.418 H -60.5 -40.7 82.0 0.364 0.054 A:P84243:0.053
DC
DA
DT
DG
DG
DA
DA
DC
DA
HOH
8.640
8.746
9.043
9.254
4.911
2.724
4.632
7.361
9.755
4.010
N
CG
NH2
NH2
NH1
NH1
NH2
NH2
NH2
NH2
OP1
OP2
O4
O6
O3'
OP2
OP2
N4
N6
O
ARG F:39 F:35 88.0 0.391 H -60.0 -42.4 53.0 0.236 0.155 E:P84243:0.156
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.486
6.315
6.544
9.310
9.653
7.659
5.327
7.068
9.685
2.371
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
5xm0 2 P62806 100.0 4e-68 X-RAY
2018-03-07 ARG B:39 B:35 93.0 0.413 H -54.2 -50.2 79.0 0.351 0.062 A:P84244:0.062
DC
DA
DT
DG
DG
DA
DA
DC
8.450
8.761
9.753
9.557
4.922
2.624
4.053
7.935
CB
CG
NH1
NH1
NH1
NH1
NH2
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 83.0 0.369 H -59.1 -48.3 59.0 0.262 0.107 E:P84244:0.107
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.806
5.536
6.619
8.834
9.197
8.102
5.741
7.056
8.878
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C3'
OP2
C7
O6
5xm1 2 P62806 100.0 4e-68 X-RAY
2018-03-07 ARG B:39 B:35 98.0 0.436 H -61.8 -49.0 78.0 0.347 0.089 A:None:0.089
DC
DA
DT
DG
DG
DA
DA
DC
8.467
8.680
9.173
9.225
5.089
2.726
3.935
7.850
CB
CG
NH1
NH1
NH1
NH1
NH2
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 82.0 0.364 H -64.6 -47.9 63.0 0.28 0.084 E:None:0.084
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
7.584
5.341
6.794
8.171
8.381
8.341
6.162
6.618
8.601
9.989
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O4
5y0c 3 P62805 100.0 4e-68 X-RAY
2018-07-18 ARG D:39 B:35 86.0 0.382 H -58.9 -43.8 79.0 0.351 0.031 C:P68431:0.031
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.610
8.561
8.991
9.909
9.930
5.165
2.817
4.621
8.282
4.857
CB
CD
CD
NH2
NH1
NH1
NH1
NH2
NH2
NH2
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:39 F:35 82.0 0.364 H -58.7 -44.8 69.0 0.307 0.057 G:P68431:0.058
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.442
4.951
6.286
7.121
7.839
9.355
6.964
5.555
7.352
8.044
2.928
NH1
NH1
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O
5y0d 2 P62805 100.0 4e-68 X-RAY
2018-07-18 ARG B:39 B:35 89.0 0.396 H -64.0 -41.1 80.0 0.356 0.04 A:P68431:0.04
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.633
9.212
9.454
9.584
5.101
3.156
4.881
8.032
3.193
CB
CD
CD
NH2
NH2
NH2
NH2
NH2
NE
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 85.0 0.378 H -59.4 -44.7 73.0 0.324 0.054 E:P68431:0.053
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
DT
HOH
7.301
5.003
6.431
6.808
8.588
9.271
6.851
6.056
7.794
7.598
9.464
3.183
NH2
NH2
CD
NH2
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH2
C2'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O4
O
5z23 2 P62805 100.0 4e-68 X-RAY
2019-02-13 ARG B:39 B:35 79.0 0.351 H -70.2 -32.2 72.0 0.32 0.031 A:P68431+P49450:0.031
DC
DA
DT
DG
DG
DA
DA
DC
8.809
8.820
9.352
9.725
5.091
2.736
4.819
8.615
N
CD
CD
NH1
NH1
NH1
NH2
CZ
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 79.0 0.351 H -71.1 -30.1 73.0 0.324 0.027 E:P68431+P49450:0.027
DC
DT
DG
DA
DA
DA
DT
DT
9.668
5.409
3.030
4.664
9.092
8.491
8.028
9.885
NH1
NH1
NH1
NH2
CZ
CD
CD
NH1
O3'
O3'
OP2
OP2
N6
OP2
C7
O4
5z30 2 P62805 100.0 4e-68 X-RAY
2018-07-18 ARG B:39 B:35 82.0 0.364 H -63.0 -39.9 72.0 0.32 0.044 A:P68431:0.044
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.600
8.522
9.316
9.576
4.940
2.872
4.678
7.876
9.073
N
CG
NE
NH2
NH1
NH1
NH2
NH2
N
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 89.0 0.396 H -62.7 -42.4 55.0 0.244 0.152 E:P68431:0.151
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.051
5.903
6.496
9.016
9.017
8.129
5.668
7.092
9.194
7.578
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O
5zbx 2 P62805 100.0 4e-68 X-RAY
2019-02-13 ARG B:39 B:35 80.0 0.356 H -60.8 -43.3 79.0 0.351 0.005 A:P68431+P49450:0.004
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.549
8.643
9.128
9.874
9.961
5.210
2.959
4.667
8.090
N
CD
CD
NE
NH1
NH2
NH1
NH2
NH2
OP1
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:39 F:35 97.0 0.431 H -59.9 -45.4 93.0 0.413 0.018 E:P68431+P49450:0.018
DC
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
9.585
4.759
2.288
5.818
7.643
9.040
8.216
7.840
8.307
8.027
9.258
NH2
NH2
NH2
NH2
NH1
NH1
CB
NH1
NH1
NH1
NH2
O3'
O3'
OP2
N7
N6
N4
OP2
C7
O6
O4
O4
6a5l 17 P62805 100.0 4e-68 EM
2018-10-03 ARG Q:39 b:35 117.0 0.52 H -58.1 -49.5 102.0 0.453 0.067 P:P84243:0.067
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.705
9.728
9.617
8.992
6.197
4.911
4.721
8.127
9.723
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG U:39 f:35 85.0 0.378 H -63.7 -43.8 77.0 0.342 0.036 T:P84243:0.036
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.764
5.520
5.154
8.293
9.943
9.547
7.504
8.887
9.492
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6a5o 17 P62805 100.0 4e-68 EM
2018-10-03 ARG Q:39 b:35 91.0 0.404 H -65.2 -44.5 80.0 0.356 0.048 P:P84243:0.049
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
7.977
8.631
9.082
8.685
9.148
9.196
5.003
2.628
5.136
8.345
CB
N
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
C2'
OP2
C7
O6
ARG U:39 f:35 96.0 0.427 H -62.5 -40.5 83.0 0.369 0.058 T:P84243:0.058
DC
DC
DG
DC
DG
DA
DA
DC
DG
6.613
4.152
4.458
7.546
9.705
7.975
8.788
8.704
9.018
NE
NE
NH2
NH1
NH1
NH1
CD
NH1
CZ
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
6a5p 17 P62805 100.0 4e-68 EM
2018-10-03 ARG Q:39 b:35 90.0 0.4 H -65.2 -43.9 81.0 0.36 0.04 P:P84243:0.04
DA
DC
DC
DC
DG
DT
DG
8.571
8.970
9.020
5.442
2.971
5.812
9.039
CB
NE
NH2
NH2
NH2
NH2
NH2
OP2
OP2
N4
O3'
OP2
C7
O6
ARG U:39 f:35 94.0 0.418 H -62.5 -40.5 82.0 0.364 0.054 T:P84243:0.053
DC
DC
DG
DC
DA
DA
DC
7.222
4.916
3.845
8.104
7.488
8.019
9.121
NE
NE
NH2
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
OP2
OP2
N4
6a5r 17 P62805 100.0 4e-68 EM
2018-10-03 ARG Q:39 b:35 90.0 0.4 H -65.2 -44.0 81.0 0.36 0.04 P:P84243:0.04
DA
DC
DC
DC
DG
DT
DG
8.570
8.970
9.020
5.442
2.971
5.811
9.040
CB
NE
NH2
NH2
NH2
NH2
NH2
OP2
OP2
N4
O3'
OP2
C7
O6
ARG U:39 f:35 94.0 0.418 H -62.4 -40.6 82.0 0.364 0.054 T:P84243:0.053
DC
DC
DG
DC
DA
DA
DC
7.222
4.916
3.845
8.105
7.489
8.019
9.122
NE
NE
NH2
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
OP2
OP2
N4
6a5t 17 P62805 100.0 4e-68 EM
2018-10-03 ARG Q:39 b:35 119.0 0.529 H -58.0 -49.5 104.0 0.462 0.067 P:P84243:0.067
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.704
9.727
9.616
8.991
6.198
4.913
4.719
8.127
9.722
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG U:39 f:35 84.0 0.373 H -63.7 -43.9 76.0 0.338 0.035 T:P84243:0.036
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.764
5.520
5.154
8.294
9.943
9.302
7.504
8.887
9.491
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6a5u 17 P62805 100.0 4e-68 EM
2018-10-03 ARG Q:39 b:35 117.0 0.52 H -58.1 -49.4 103.0 0.458 0.062 P:P84243:0.062
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.705
9.729
9.617
8.992
6.197
4.911
4.721
8.127
9.723
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG U:39 f:35 86.0 0.382 H -63.7 -43.8 78.0 0.347 0.035 T:P84243:0.036
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.763
5.519
5.152
8.292
9.944
9.350
7.504
8.886
9.492
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6hkt 2 P62805 100.0 4e-68 X-RAY
2018-10-31 ARG B:39 B:35 72.0 0.32 H -62.1 -44.8 66.0 0.293 0.027 A:P68431:0.027
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
9.035
9.588
9.928
9.240
9.729
9.297
4.849
2.761
5.896
9.014
CB
N
NE
NH2
NH2
NH2
NH1
NH1
CZ
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG F:39 F:35 78.0 0.347 H -64.2 -42.1 66.0 0.293 0.054 E:P68431:0.053
DC
DC
DG
DC
DA
DA
DC
DG
5.138
2.778
6.562
8.180
8.789
9.257
9.311
8.728
NH1
NH1
NH1
NH2
N
NE
NH2
NH2
O3'
OP2
OP2
N4
OP1
OP2
N4
O6
ARG L:39 b:35 76.0 0.338 H -63.8 -43.8 65.0 0.289 0.049 K:P68431:0.049
DA
DC
DC
DA
DC
DG
DT
DG
9.264
9.971
9.428
9.766
5.041
3.082
5.670
8.891
N
N
NH2
NH2
NH1
NH1
NH2
NH2
OP1
OP2
N4
O3'
O3'
OP2
C7
O6
ARG P:39 f:35 71.0 0.316 H -62.4 -44.8 58.0 0.258 0.058 O:P68431:0.058
DC
DC
DG
DC
DA
DA
DC
DG
6.012
3.804
5.909
8.067
8.411
9.654
9.494
8.932
NH1
NH1
NH1
NH2
N
NE
NH2
NH2
O3'
OP2
OP2
N4
OP1
OP2
N4
O6
ARG T:39 L:35 72.0 0.32 H -61.0 -45.2 66.0 0.293 0.027 S:P68431:0.027
DA
DC
DG
DC
DC
DG
DT
DG
8.005
9.001
9.581
9.079
5.732
3.585
5.767
8.772
CB
NE
NH2
NH2
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
O3'
OP2
C7
O6
ARG X:39 P:35 80.0 0.356 H -64.0 -44.4 71.0 0.316 0.04 W:P68431:0.04
DC
DC
DG
DC
DA
DA
DC
DG
5.351
3.032
5.788
8.035
8.492
9.586
9.249
8.724
NH1
NH1
NH1
NH2
CB
NE
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG BA:39 l:35 79.0 0.351 H -64.3 -43.2 75.0 0.333 0.018 AA:P68431:0.018
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.725
8.651
9.457
8.557
9.122
9.166
4.892
2.539
5.613
8.608
CB
NE
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG FA:39 p:35 73.0 0.324 H -60.7 -45.4 73.0 0.324 0.0 DC
DC
DG
DC
DA
DA
DA
DC
DG
DC
5.528
3.412
7.102
8.069
9.984
7.898
8.265
8.560
8.416
9.975
NH1
NH1
NH1
CZ
CB
CB
NE
NE
NH2
NH2
O3'
OP2
OP2
N4
O3'
OP2
OP2
N4
O6
N4
ARG JA:39 V:35 72.0 0.32 H -61.1 -46.4 64.0 0.284 0.036 IA:P68431:0.036
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.971
9.295
9.763
9.117
9.700
9.408
5.065
2.876
6.016
9.020
CB
NE
NE
NH2
NH2
NH2
NH1
NH1
CZ
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG NA:39 Z:35 80.0 0.356 H -64.4 -44.1 71.0 0.316 0.04 MA:P68431:0.04
DC
DC
DC
DG
DC
DA
DA
DG
9.092
4.433
2.101
7.327
8.860
9.586
9.700
9.508
NH2
NH1
NH1
NH1
NE
N
NE
NH2
O3'
O3'
OP2
OP2
N4
OP1
OP2
O6
ARG RA:39 v:35 78.0 0.347 H -64.2 -44.3 68.0 0.302 0.045 QA:P68431:0.044
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.604
9.137
9.630
8.819
9.701
9.910
5.326
3.212
5.657
8.635
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG VA:39 z:35 74.0 0.329 H -61.4 -45.5 65.0 0.289 0.04 UA:P68431:0.04
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.993
5.111
2.804
6.568
8.416
8.683
9.321
9.366
9.020
NH2
NH1
NH1
NH1
NE
N
N
NE
NH2
O3'
O3'
OP2
OP2
N4
OP1
OP2
N4
O6
6inq 17 P62805 100.0 4e-68 EM
2019-04-03 ARG Q:39 b:35 117.0 0.52 H -58.0 -49.6 104.0 0.462 0.058 P:P84243:0.058
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.706
9.729
9.618
8.993
6.195
4.910
4.721
8.129
9.724
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG U:39 f:35 83.0 0.369 H -63.8 -43.8 76.0 0.338 0.031 T:P84243:0.031
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.764
5.520
5.154
8.293
9.943
9.548
7.505
8.888
9.492
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6ir9 20 P62805 100.0 4e-68 EM
2019-02-20 ARG T:39 b:35 116.0 0.516 H -58.0 -49.6 100.0 0.444 0.072 S:P84243:0.071
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.705
9.727
9.617
8.993
6.198
4.911
4.719
8.129
9.723
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG X:39 f:35 83.0 0.369 H -63.8 -43.9 75.0 0.333 0.036 W:P84243:0.036
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.764
5.519
5.155
8.293
9.943
9.547
7.505
8.886
9.493
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6j4w 20 P62805 100.0 4e-68 EM
2019-02-20 ARG T:39 b:35 91.0 0.404 H -65.2 -44.0 82.0 0.364 0.04 S:P84243:0.04
DA
DC
DC
DC
DG
DT
DG
8.572
8.971
9.019
5.442
2.970
5.812
9.039
CB
NE
NH2
NH2
NH2
NH2
NH2
OP2
OP2
N4
O3'
OP2
C7
O6
ARG X:39 f:35 94.0 0.418 H -62.5 -40.5 81.0 0.36 0.058 W:P84243:0.058
DC
DC
DG
DC
DA
DA
DA
DC
7.221
4.916
3.844
8.103
10.000
7.487
8.019
9.119
NE
NE
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O3'
OP2
OP2
N4
6j4x 20 P62805 100.0 4e-68 EM
2019-02-20 ARG T:39 b:35 119.0 0.529 H -58.0 -49.6 104.0 0.462 0.067 S:P84243:0.067
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.704
9.726
9.618
8.993
6.197
4.913
4.720
8.129
9.723
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG X:39 f:35 86.0 0.382 H -63.7 -43.9 78.0 0.347 0.035 W:P84243:0.036
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.764
5.519
5.154
8.294
9.943
9.547
7.504
8.887
9.492
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6j4y 20 P62805 100.0 4e-68 EM
2019-02-20 ARG T:39 b:35 120.0 0.533 H -58.2 -49.5 106.0 0.471 0.062 S:P84243:0.062
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.703
9.727
9.616
8.993
6.198
4.914
4.719
8.130
9.724
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG X:39 f:35 84.0 0.373 H -63.8 -43.8 76.0 0.338 0.035 W:P84243:0.036
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.765
5.519
5.154
8.294
9.943
9.549
7.506
8.887
9.492
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6j4z 19 P62805 100.0 4e-68 EM
2019-02-20 ARG S:39 b:35 118.0 0.524 H -58.1 -49.4 104.0 0.462 0.062 R:P84243:0.062
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.705
9.728
9.617
8.991
6.197
4.911
4.722
8.126
9.722
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG W:39 f:35 84.0 0.373 H -63.7 -43.8 77.0 0.342 0.031 V:P84243:0.031
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.764
5.519
5.152
8.292
9.944
9.486
7.504
8.886
9.492
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6j50 19 P62805 100.0 4e-68 EM
2019-02-20 ARG S:39 b:35 117.0 0.52 H -58.1 -49.5 103.0 0.458 0.062 R:P84243:0.062
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.706
9.729
9.617
8.992
6.198
4.910
4.721
8.126
9.722
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG W:39 f:35 85.0 0.378 H -63.7 -43.7 77.0 0.342 0.036 V:P84243:0.036
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.763
5.520
5.152
8.292
9.943
9.547
7.503
8.885
9.492
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6j51 20 P62805 100.0 4e-68 EM
2019-02-20 ARG T:39 b:35 120.0 0.533 H -58.1 -49.5 106.0 0.471 0.062 S:P84243:0.062
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.704
9.729
9.617
8.992
6.198
4.912
4.722
8.127
9.721
CD
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
C5
O6
N4
O3'
O5'
OP2
O6
N4
ARG X:39 f:35 84.0 0.373 H -63.8 -43.7 76.0 0.338 0.035 W:P84243:0.036
DC
DC
DG
DC
DG
DA
DA
DA
DC
7.763
5.519
5.151
8.291
9.944
9.547
7.504
8.886
9.492
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
OP2
N4
6jou 2 P62805 100.0 4e-68 X-RAY
2020-03-25 ARG B:39 B:35 73.0 0.324 H -59.8 -40.8 65.0 0.289 0.035 A:P68431:0.036
DC
DA
DT
DT
DG
DA
DA
DC
HOH
8.596
8.406
8.931
9.869
5.297
3.055
4.877
8.304
3.229
CB
CD
CD
NH1
NH1
NH1
NH2
NH2
NH1
OP2
OP2
C7
O3'
O3'
OP2
OP2
N4
O
ARG F:39 F:35 86.0 0.382 H -58.4 -43.9 53.0 0.236 0.146 E:P68431:0.147
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.245
6.064
6.547
9.004
8.764
7.858
5.376
7.007
9.168
2.654
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O
6jr0 2 P62805 100.0 4e-68 X-RAY
2019-10-02 ARG B:39 B:35 72.0 0.32 H -66.0 -43.0 62.0 0.276 0.044 A:P68431:0.044
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.713
9.347
8.808
9.238
5.599
3.588
6.106
8.085
8.126
N
NE
NH2
NH2
NH1
NH1
NH1
NH2
CD
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 85.0 0.378 H -65.6 -44.8 72.0 0.32 0.058 E:P68431:0.058
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
HOH
6.323
3.965
6.175
7.123
8.481
8.008
6.651
7.844
7.881
9.999
3.443
NH1
NH1
NH1
NH2
NH2
NE
NH2
NH2
NH2
NH2
CZ
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O4
O
6jr1 2 P62805 100.0 4e-68 X-RAY
2019-10-02 ARG B:39 B:35 74.0 0.329 H -63.0 -43.1 65.0 0.289 0.04 A:P68431:0.04
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.549
9.288
8.985
9.422
5.458
3.444
5.665
8.365
3.150
N
NE
NH2
NH2
NH1
NH2
NH1
NH2
NH2
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 78.0 0.347 H -63.3 -45.0 64.0 0.284 0.063 E:P68431:0.062
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
8.142
5.796
6.350
7.511
8.212
8.803
6.310
5.918
7.497
8.156
3.032
NE
NE
CD
NH2
NH2
NH1
NH1
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O
6k1i 2 P62805 100.0 4e-68 X-RAY
2020-01-15 ARG B:39 B:35 87.0 0.387 H -53.8 -56.8 79.0 0.351 0.036 A:P68431:0.036
DA
DC
DG
DC
DA
DG
DA
DC
DG
DT
DG
8.327
9.085
9.770
9.285
9.341
9.901
9.818
3.934
2.332
4.670
8.444
CB
CD
NE
NH2
NH2
NH2
NH1
NH2
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
N2
O3'
O3'
OP2
C7
O6
ARG F:39 F:35 76.0 0.338 H -65.0 -51.2 66.0 0.293 0.045 E:P68431:0.044
DC
DC
DG
DC
DA
DA
DC
DG
HOH
5.549
3.616
5.643
8.551
8.391
9.188
9.332
9.109
9.466
NH1
NH1
NH1
NH2
CD
NE
NH2
NH2
NH1
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
O
6k1j 2 P62805 100.0 4e-68 X-RAY
2020-01-15 ARG B:39 B:35 80.0 0.356 H -56.4 -44.7 69.0 0.307 0.049 A:P68431:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.609
9.271
9.546
9.905
9.429
4.624
2.430
4.583
8.500
7.435
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH2
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG F:39 F:35 84.0 0.373 H -64.4 -52.6 78.0 0.347 0.026 E:P68431:0.027
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
9.884
5.045
3.146
4.754
8.128
8.845
9.182
9.027
9.973
9.788
NH1
NH2
NH1
NH2
NH2
CB
CD
CD
NH2
O
O3'
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
O
6k1k 2 P62805 100.0 4e-68 X-RAY
2020-01-15 ARG B:39 B:35 92.0 0.409 H -54.5 -52.3 63.0 0.28 0.129 A:P68431:0.129
DA
DA
DC
DG
DC
DG
DT
DG
DC
HOH
8.783
6.415
8.478
9.758
7.705
5.496
5.522
8.285
9.796
5.504
NH1
NH1
NH1
NH1
CD
CD
NH2
NH2
NH2
NH1
C2'
OP2
C5
O6
O3'
OP2
OP2
N7
N4
O
ARG F:39 F:35 76.0 0.338 H -66.7 -33.7 65.0 0.289 0.049 E:P68431:0.049
DC
DG
DT
DG
DA
DC
DG
DC
HOH
5.641
3.480
5.681
8.794
8.409
9.431
9.959
9.019
7.597
NH1
NH1
NH2
NH2
CB
NE
NH2
NH2
CD
O3'
OP2
C7
O6
OP2
OP2
N7
N4
O
6kvd 3 P62805 100.0 4e-68 X-RAY
2019-12-18 ARG D:39 B:35 82.0 0.364 H -59.8 -44.5 74.0 0.329 0.035 C:P68431:0.036
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.690
8.599
8.829
9.888
5.305
3.071
4.639
8.076
3.162
CB
CD
CD
NE
NH1
NH1
NH2
NH2
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG H:39 F:35 75.0 0.333 H -59.8 -47.3 63.0 0.28 0.053 G:P68431:0.053
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.293
4.776
6.505
7.537
7.903
9.287
6.924
5.453
7.140
8.103
4.248
NH2
NH2
CD
NH1
NH1
NH1
NH1
NH1
NH1
NH1
CZ
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O
6kxv 2 P62805 100.0 4e-68 X-RAY
2020-07-22 ARG B:39 B:35 114.0 0.507 H -60.3 -43.4 90.0 0.4 0.107 A:Q4QHB5:0.107
DC
DA
DT
DG
DG
DA
DA
DC
DA
8.079
8.938
8.922
8.998
5.818
3.849
4.462
7.174
8.817
N
CG
NH2
NH1
NH1
NH1
NH2
NH2
NH2
OP1
OP2
O4
O6
O3'
OP2
OP2
N4
N6
ARG F:39 F:35 107.0 0.476 H -59.6 -44.0 79.0 0.351 0.125 E:Q4QHB5:0.124
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.414
5.039
4.254
8.547
8.962
9.173
6.923
7.712
9.451
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N7
N4
C2'
OP2
C7
O6
6l49 2 P62805 100.0 4e-68 EM
2019-12-04 ARG B:39 B:35 122.0 0.542 H -61.8 -45.1 103.0 0.458 0.084 A:P49450:0.084
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.177
9.061
7.231
8.594
9.543
6.703
3.514
2.434
7.423
7.172
CD
NH1
NH1
NH1
NH1
CZ
NH2
NH2
NH2
NH1
OP2
C5
O6
N4
N6
O3'
C3'
OP2
OP2
N4
ARG F:39 F:35 99.0 0.44 H -63.6 -42.9 82.0 0.364 0.076 E:P49450:0.076
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.447
5.007
5.132
8.083
9.877
7.685
5.926
7.105
7.444
9.768
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N4
O6
C2'
OP2
N7
N4
O6
ARG L:39 L:35 89.0 0.396 H -66.5 -40.9 77.0 0.342 0.054 K:P68431:0.053
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
DC
7.836
8.549
7.497
7.515
8.595
9.072
4.981
2.679
4.138
7.740
8.413
N
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH2
NH2
NE
OP1
OP2
N7
N4
N6
O3'
O3'
OP2
C7
O6
N4
ARG P:39 P:35 97.0 0.431 H -65.3 -43.3 64.0 0.284 0.147 O:P68431:0.147
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.193
4.763
5.628
7.148
9.457
9.200
7.210
7.330
8.462
9.011
NE
NE
NH2
NH2
NH1
NH1
NH1
NH1
NH1
CZ
O3'
OP2
OP2
N4
O6
C2'
OP2
N7
N4
O6
ARG T:39 T:35 84.0 0.373 H -65.6 -38.6 68.0 0.302 0.071 S:P68431:0.071
DA
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
9.998
7.690
8.416
8.132
8.993
9.228
5.416
3.206
3.845
9.121
9.253
CB
CD
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH2
NE
O3'
OP2
OP2
N7
N4
N6
O3'
OP2
C7
O6
N4
ARG X:39 X:35 106.0 0.471 H -65.1 -42.7 85.0 0.378 0.093 W:P68431:0.093
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
6.926
4.630
4.435
6.651
9.182
8.210
6.301
7.554
8.422
8.692
CD
CD
NH2
NH2
NH1
NH1
NH1
NH1
NH1
NH1
C3'
OP2
OP2
N4
O6
C2'
OP2
N7
N4
O6
6l4a 2 P62805 100.0 4e-68 EM
2019-12-04 ARG B:39 B:35 84.0 0.373 H -66.8 -43.1 70.0 0.311 0.062 A:P68431:0.062
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.035
8.362
9.403
9.091
9.684
9.946
5.739
3.259
5.400
8.754
CB
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG F:39 F:35 101.0 0.449 H -64.5 -43.4 69.0 0.307 0.142 E:P68431:0.142
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.560
5.085
5.323
8.322
9.937
8.791
6.586
8.607
8.599
9.750
CD
CD
NH2
NH1
NH1
NH1
NH1
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
N7
N4
O6
ARG L:39 L:35 86.0 0.382 H -68.1 -42.5 73.0 0.324 0.058 K:P68431:0.058
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
DC
8.120
8.499
8.922
8.815
9.238
9.613
5.534
3.157
4.783
8.559
9.907
CB
NE
NH2
NH2
NH2
NH2
NH1
NH2
NH2
NH2
NE
OP2
OP2
N7
N4
N6
O3'
O3'
OP2
C7
O6
N4
ARG P:39 P:35 99.0 0.44 H -65.1 -43.3 68.0 0.302 0.138 O:P68431:0.138
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.498
5.016
5.205
7.702
9.206
8.995
6.825
8.444
8.389
9.369
CD
CD
NH2
NH1
NH1
NH1
NH1
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
N7
N4
O6
ARG T:39 T:35 87.0 0.387 H -66.4 -44.5 74.0 0.329 0.058 S:P68431:0.058
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
DC
8.177
8.454
9.082
8.966
9.317
9.494
5.725
3.201
4.903
8.577
9.951
CB
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NE
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
N4
ARG X:39 X:35 99.0 0.44 H -65.1 -43.5 70.0 0.311 0.129 W:P68431:0.129
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.752
5.285
5.378
7.803
9.619
9.013
6.795
8.445
8.155
9.486
CD
CD
NH2
NH1
NH1
NH1
NH1
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
C2'
OP2
N7
N4
O6
6r8y 2 P62805 100.0 4e-68 EM
2019-06-12 ARG B:39 B:36 81.0 0.36 H -62.6 -44.6 73.0 0.324 0.036 A:P68431:0.036
DG
DC
DA
DT
DG
DT
DG
DA
DA
DC
DA
9.688
7.722
8.695
8.038
9.100
8.059
3.950
1.941
5.618
7.541
9.936
HB3
HB3
HE
HH21
HH21
HH22
HH22
HH12
HD3
HE
HE
H3'
OP2
OP2
H72
O6
O3'
H3'
OP1
OP2
H41
H61
6r8z 2 P62805 100.0 4e-68 EM
2019-06-12 ARG B:39 B:36 82.0 0.364 H -63.5 -42.1 74.0 0.329 0.035 A:P68431:0.036
DG
DC
DA
DT
DG
DT
DG
DA
DA
DC
9.864
8.212
9.253
8.333
9.640
8.490
4.221
2.101
6.685
8.492
HB3
HB3
HE
HH21
HH21
HH22
HH12
HH12
HH11
HE
H3'
OP2
OP2
H72
O6
O3'
O3'
OP1
OP2
H41
ARG F:39 F:36 72.0 0.32 H -66.1 -40.3 67.0 0.298 0.022 E:P68431:0.022
DT
DG
DA
DA
DC
DA
DG
DC
DA
DT
DG
DT
8.983
4.685
2.536
5.838
6.861
9.746
9.912
8.036
7.526
6.946
8.460
9.973
HH12
HH12
HH12
HD3
HH21
HH21
HB3
HB3
HH21
HH21
HH21
HH22
O3'
H3'
OP2
OP2
H41
H61
H3'
OP2
OP2
H72
O6
O4
6r90 2 P62805 100.0 4e-68 EM
2019-06-12 ARG B:39 B:36 79.0 0.351 H -57.0 -45.5 74.0 0.329 0.022 A:P68431:0.022
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
8.066
8.969
7.894
9.507
9.975
8.631
4.419
2.318
3.713
7.162
HD3
HD2
HD2
HH22
HH12
HH12
HH12
HH12
HH21
HH21
H2''
OP2
H72
O6
O4
H2''
O3'
OP2
OP2
H41
ARG F:39 F:36 72.0 0.32 H -61.6 -41.4 62.0 0.276 0.044 E:P68431:0.044
DG
DA
DA
DC
DA
DG
DC
DA
DT
DG
5.433
3.774
5.835
6.630
8.459
8.181
7.133
7.824
7.073
8.535
HH11
HD3
HD2
HH22
HH21
HH21
HH21
HH22
HH22
HH22
H3'
OP2
OP2
H41
H62
H2''
OP2
OP2
H72
O6
6r91 2 P62805 100.0 4e-68 EM
2019-06-12 ARG B:39 B:36 76.0 0.338 H -62.5 -44.7 76.0 0.338 0.0 DA
DG
DG
DC
DA
DG
DT
DA
DC
DA
DT
DG
DC
8.348
9.282
9.578
9.123
9.414
9.142
9.639
8.611
4.142
2.174
4.538
8.214
9.424
HB3
H
HE
HH21
HH21
HH22
HH12
HH22
HH22
HH12
HD3
HD3
HD2
OP2
OP2
O6
H41
H61
H22
H4'
H2''
O3'
H5''
OP2
OP2
H41
ARG F:39 F:36 86.0 0.382 H -58.9 -45.1 77.0 0.342 0.04 E:P68431:0.04
DA
DG
DC
DT
DG
DA
DG
DT
DT
DC
DA
DG
9.220
3.791
1.674
3.338
8.880
9.931
8.529
7.601
7.918
8.383
8.354
8.922
HH22
HH22
HH22
HH22
HH21
HH21
HB3
HE
HH21
HH21
HH22
HH22
O3'
H2''
OP2
H71
O6
H61
OP2
H72
H72
H41
H61
H1
6r92 5 P62805 100.0 4e-68 EM
2019-06-12 ARG E:39 B:36 78.0 0.347 H -60.3 -45.3 68.0 0.302 0.045 D:P68431:0.044
DC
DA
DT
DG
DT
DT
DC
DT
DG
DA
DA
DC
9.369
7.326
7.012
8.848
9.141
9.954
9.243
4.965
2.920
4.836
8.646
9.578
HD2
HD2
HE
HH21
HH22
HH22
HH22
HH12
HH12
HH11
HH22
HD2
H2''
OP2
H71
N7
H71
O4
O3'
O3'
OP2
OP2
H62
H41
ARG I:39 F:36 80.0 0.356 H -60.3 -45.3 70.0 0.311 0.045 H:P68431:0.044
DG
DA
DA
DC
DA
DG
DG
DC
DA
DT
DG
9.130
4.416
2.122
5.035
8.487
9.679
7.676
8.564
9.426
9.420
9.249
HH22
HH22
HH12
HH11
HH22
HB3
HD2
HD2
HH21
HH21
HH22
H2''
H3'
OP2
OP2
H62
H3'
OP2
H5
H62
O4
O6
6r93 4 P62805 100.0 4e-68 EM
2019-06-12 ARG D:39 B:36 84.0 0.373 H -61.5 -44.2 79.0 0.351 0.022 C:P68431:0.022
DG
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
9.972
7.876
8.818
8.108
9.171
9.732
8.338
4.195
1.891
5.137
7.779
HD2
HB3
HE
HH21
HH21
HH22
HH22
HH22
HH22
HH11
NH2
H2''
OP2
OP2
H71
O6
O4
O3'
H2''
OP2
OP2
H41
ARG H:39 F:36 81.0 0.36 H -58.6 -44.5 73.0 0.324 0.036 G:P68431:0.036
DT
DG
DA
DA
DC
DG
DC
DA
DT
DG
DT
8.279
3.971
1.792
5.047
7.848
9.564
7.427
8.960
8.204
9.256
9.636
HH22
HH22
HH22
HH11
NH2
HB3
HB3
HE
HH21
HH21
HH22
O3'
H2''
OP2
OP2
H41
H3'
OP2
OP2
H72
O6
O4
6r94 4 P62805 100.0 4e-68 EM
2019-06-12 ARG D:39 B:36 74.0 0.329 H -62.1 -44.9 70.0 0.311 0.018 C:P68431:0.018
DG
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
9.800
7.737
7.596
7.533
8.780
9.588
8.780
4.022
1.940
6.543
7.401
HD2
HD2
HE
HH21
HH21
HH22
HH22
HH12
HH12
HD3
HE
H2''
OP2
OP2
H72
O6
O4
H2''
H3'
OP2
OP2
H41
ARG H:39 F:36 80.0 0.356 H -58.8 -44.7 72.0 0.32 0.036 G:P68431:0.036
DT
DG
DA
DA
DC
DC
DA
DT
DG
8.897
3.836
1.990
4.927
7.811
7.835
8.823
8.305
9.437
HH22
HH22
HH22
HH11
NH2
HD2
HE
HH21
HH21
O3'
H3'
OP2
OP2
H41
OP2
OP2
H71
O6
6t90 2 P62805 100.0 4e-68 EM
2020-05-06 ARG B:39 B:36 88.0 0.391 H -62.3 -40.6 82.0 0.364 0.027 A:P68431:0.027
DA
DC
DC
DG
DT
DG
8.451
8.895
5.639
3.335
4.798
9.427
CD
CD
NH1
NH1
NH2
NH2
OP2
OP2
O3'
OP2
OP2
N7
ARG F:39 F:36 96.0 0.427 H -64.8 -41.0 88.0 0.391 0.036 E:P68431:0.036
DC
DC
DG
DC
DA
DA
5.453
2.994
4.800
9.024
8.567
9.013
NH1
NH1
NH2
NH2
CB
CD
O3'
OP2
OP2
N4
OP2
OP2
6t93 2 P62805 100.0 4e-68 EM
2020-05-06 ARG B:39 B:36 95.0 0.422 H -57.0 -49.4 93.0 0.413 0.009 A:P68431:0.009
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.327
9.385
9.654
8.930
9.433
5.528
3.010
5.285
8.290
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
ARG F:39 F:36 85.0 0.378 H -57.3 -48.6 81.0 0.36 0.018 E:P68431:0.018
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.939
5.541
3.041
6.654
8.697
8.536
9.578
9.538
9.096
NH2
NH2
NH2
NH1
NH2
CD
NE
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6usj 4 P62805 100.0 4e-68 EM
2020-10-14 ARG D:39 B:35 93.0 0.413 H -60.5 -46.7 90.0 0.4 0.013 C:P68431:0.013
DA
DA
DC
DG
DG
DC
DC
DC
DG
DC
8.239
8.409
9.759
9.652
9.964
9.741
5.036
2.700
5.301
7.734
CB
CD
NE
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
N2
O3'
O3'
OP2
OP2
N4
ARG H:39 F:35 109.0 0.484 H -62.1 -44.4 99.0 0.44 0.044 G:P68431:0.044
DA
DC
DG
DT
DG
DC
DG
DA
DC
DG
DC
DA
9.530
4.567
2.737
3.861
7.536
8.351
9.977
8.189
7.049
8.166
8.273
8.600
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH1
O3'
O3'
OP2
C7
O6
N4
O6
OP2
C5
O6
N4
N6
ARG N:39 L:35 94.0 0.418 H -60.7 -46.6 91.0 0.404 0.014 M:P68431:0.013
DA
DA
DC
DG
DG
DC
DC
DC
DG
DC
8.242
8.418
9.756
9.636
9.956
9.730
5.030
2.701
5.328
7.723
CB
CD
NE
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
N2
O3'
O3'
OP2
OP2
N4
ARG R:39 P:35 108.0 0.48 H -62.0 -44.7 97.0 0.431 0.049 Q:P68431:0.049
DA
DC
DG
DT
DG
DC
DG
DA
DC
DG
DC
DA
9.508
4.544
2.737
3.854
7.556
8.366
9.972
8.190
7.030
8.160
8.263
8.611
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH1
O3'
O3'
OP2
C7
O6
N4
O6
OP2
C5
O6
N4
N6
6v2k 2 P62805 100.0 4e-68 X-RAY
2020-11-25 ARG B:39 B:35 89.0 0.396 H -58.9 -41.3 76.0 0.338 0.058 A:P68431:0.058
DC
DA
DT
DG
DG
DA
DA
DC
8.624
8.465
8.820
9.696
5.279
3.212
4.271
8.056
N
CD
CD
NE
NH1
NH1
NH2
NH2
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 81.0 0.36 H -60.0 -43.1 72.0 0.32 0.04 E:P68431:0.04
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
7.115
4.586
6.375
7.432
8.196
9.178
6.838
5.475
7.443
8.101
NH1
NH1
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
6yov 6 P62805 100.0 4e-68 EM
2020-05-06 ARG F:39 F:36 91.0 0.404 H -61.6 -44.2 91.0 0.404 0.0 DC
DC
DG
DC
DG
DA
DA
DC
DG
5.589
3.125
6.500
7.579
9.582
8.621
8.875
8.308
8.888
NH2
NH2
NH1
NH1
NH1
CB
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
7bxt 2 P62805 100.0 4e-68 EM
2021-02-10 ARG B:39 B:35 94.0 0.418 H -59.4 -53.6 94.0 0.418 0.0 DA
DC
DG
DC
DA
DC
DG
DT
DG
7.763
8.614
9.598
9.264
9.544
4.995
2.973
5.189
8.702
CB
CD
CD
NH1
NH1
NH1
NH1
NH2
NH1
OP2
OP2
O6
N4
O3'
O3'
OP2
OP2
O6
ARG F:39 F:35 101.0 0.449 H -65.0 -33.8 92.0 0.409 0.04 E:Q6XXM1:0.04
DC
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
DG
9.912
4.967
2.811
4.825
7.350
9.996
8.543
9.742
8.703
8.199
8.916
9.762
NH2
NH1
NH2
NH1
NH2
NH2
CB
NE
NH2
NH2
NH2
NH2
O3'
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
O6
7c0m 2 P62805 100.0 4e-68 EM
2020-09-16 ARG B:39 B:35 67.0 0.298 H -61.8 -39.4 58.0 0.258 0.04 A:P68431:0.04
DA
DC
DC
DA
DC
DG
DT
DG
8.021
8.717
9.410
9.612
5.588
3.463
5.952
9.324
CD
NE
NH2
NH2
NH1
NH2
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
C7
O6
ARG F:39 F:35 82.0 0.364 H -60.8 -42.2 76.0 0.338 0.026 E:P68431:0.027
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.167
3.805
4.958
6.920
8.943
8.262
8.672
7.618
8.139
9.078
NH1
NH1
NH1
NH2
NH2
CB
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
ARG M:39 b:35 67.0 0.298 H -61.7 -39.4 59.0 0.262 0.036 L:P68431:0.036
DA
DC
DC
DA
DC
DG
DT
DG
8.022
8.717
9.410
9.612
5.588
3.463
5.950
9.323
CD
NE
NH2
NH2
NH1
NH2
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
C7
O6
ARG Q:39 f:35 80.0 0.356 H -60.9 -42.1 73.0 0.324 0.032 P:P68431:0.031
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.166
3.804
4.958
6.920
8.943
8.262
8.672
7.619
8.140
9.077
NH1
NH1
NH1
NH2
NH2
CB
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
7d1z 2 P62805 100.0 4e-68 EM
2021-02-10 ARG B:39 B:35 71.0 0.316 H -67.7 -35.5 59.0 0.262 0.054 A:P68431:0.053
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.054
9.056
9.882
9.349
9.620
9.540
5.566
3.103
5.499
8.923
CD
NE
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG K:39 F:35 84.0 0.373 H -71.3 -32.9 68.0 0.302 0.071 E:P68431:0.071
DC
DC
DG
DC
DA
DA
DC
DG
5.393
3.129
5.066
8.425
8.476
8.261
9.447
9.905
NH2
NH2
NH2
NH2
N
CD
NH1
NH2
O3'
OP2
OP2
N4
OP1
OP2
N4
O6
7d20 2 P62805 100.0 4e-68 EM
2021-02-10 ARG C:39 B:35 74.0 0.329 H -68.4 -37.7 62.0 0.276 0.053 B:P49450:0.053
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.137
8.181
8.533
8.022
8.793
5.484
3.218
4.936
7.896
9.380
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
ARG F:39 F:35 87.0 0.387 H -63.3 -42.0 83.0 0.369 0.018 A:P49450:0.018
DC
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
9.911
5.772
3.713
6.106
6.609
8.345
7.765
6.987
6.685
7.241
8.908
NH1
NH1
NH1
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
C2'
OP2
OP2
N4
O6
C2'
OP2
N4
O6
N4
7dbh 2 P62806 100.0 4e-68 EM
2022-01-19 ARG B:39 B:35 88.0 0.391 H -63.9 -41.4 88.0 0.391 0.0 DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.529
8.893
9.923
9.503
9.682
9.887
5.330
3.252
5.782
9.306
N
NE
NE
NH2
NH2
NH2
NH1
NH2
NH2
NH2
OP1
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG F:39 F:35 66.0 0.293 H -61.0 -44.8 66.0 0.293 0.0 DC
DC
DC
DG
DC
DA
DA
DC
DG
9.852
4.516
2.421
4.003
8.816
8.072
8.798
9.514
9.971
NH1
NH1
NH1
NH2
NE
N
CD
CD
NE
O3'
O3'
OP2
OP2
N4
OP1
OP2
N4
O6
7scy 4 P62805 100.0 4e-68 EM
2022-01-12 ARG D:39 B:35 87.0 0.387 H -58.2 -50.6 81.0 0.36 0.027 C:P68431:0.027
DA
DC
DG
DT
DG
DC
DA
DA
DC
DG
DC
DA
DC
DG
7.886
3.886
1.758
3.499
8.157
9.685
9.376
7.066
7.302
9.638
8.747
8.618
9.834
8.535
HH12
HH12
HH12
HH21
HH21
HE
HB2
HB2
HD3
HD2
HD2
HH22
HH22
HH22
O3'
H3'
OP2
H73
N7
H42
O3'
OP2
H5
N7
H42
H61
H41
H21
ARG H:39 F:35 95.0 0.422 H -60.8 -48.8 87.0 0.387 0.035 G:P68431:0.036
DA
DA
DA
DC
DG
DC
DG
DC
DC
DC
DG
DC
DG
DT
7.896
6.452
6.664
5.137
6.989
8.312
9.334
9.888
5.969
3.737
5.517
5.034
7.530
9.977
HH21
HH21
HH22
HH22
HH22
HH12
HH12
HH11
HH11
HH11
HD2
HH22
HH22
HH22
H2''
OP2
N7
H42
O6
H41
H1
O3'
H3'
OP2
OP2
H42
O6
O4
7scz 4 P62805 100.0 4e-68 EM
2022-01-19 ARG D:39 B:35 91.0 0.404 H -56.0 -47.6 87.0 0.387 0.017 C:P68431:0.018
DA
DC
DG
DT
DG
DC
DA
DA
DC
DG
DC
DA
DC
DG
8.275
3.911
1.745
3.596
7.951
9.666
9.207
7.220
7.670
9.678
8.759
8.543
9.943
8.752
HH12
HH12
HH12
HH21
HH21
HH21
HD3
HB2
HD3
HD2
HD2
HH22
HH22
HH22
O3'
H3'
OP2
H72
N7
H42
H2''
OP2
H5
N7
H42
H61
H41
H21
ARG H:39 F:35 93.0 0.413 H -56.6 -47.7 85.0 0.378 0.035 G:P68431:0.036
DA
DA
DA
DC
DG
DC
DG
DC
DC
DG
DC
DG
DT
7.219
6.192
6.114
4.889
6.862
7.746
9.359
5.634
3.516
5.848
5.237
7.394
9.456
HH21
HH21
HH22
HH22
HH22
HH12
HH12
HH11
HH11
HD2
HH22
HH22
HH22
H2''
OP2
N7
H42
O6
H41
H1
H2''
OP2
OP2
H42
O6
O4
7vbm 2 P62806 100.0 4e-68 EM
2022-01-19 ARG B:39 B:35 102.0 0.453 H -61.9 -43.9 102.0 0.453 0.0 DA
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
9.552
7.103
6.391
7.718
8.344
9.931
7.040
4.813
5.966
7.824
8.493
NH1
NH1
NH2
NH2
NH2
NH2
CD
CD
NH2
NH2
NH2
C2'
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
ARG F:39 F:35 70.0 0.311 H -61.3 -44.9 70.0 0.311 0.0 DC
DC
DG
DC
DA
DA
DC
4.856
2.923
4.413
9.126
8.366
9.436
9.896
NH1
NH1
NH2
NE
CB
CD
CD
O3'
OP1
OP2
N4
OP2
OP2
N4
5av5 2 P62805 100.0 5e-68 X-RAY
2015-12-23 ARG B:37 B:35 90.0 0.4 H -60.9 -44.3 54.0 0.24 0.16 A:P68431:0.16
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.467
5.977
7.250
9.957
8.512
6.428
6.350
9.601
9.757
9.910
NH1
NH1
NH1
NH1
CD
CD
NE
CD
NH1
O
O3'
OP2
C7
O6
O3'
OP2
OP2
N6
N4
O
ARG F:37 F:35 89.0 0.396 H -61.7 -46.9 56.0 0.249 0.147 E:P68431:0.147
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.621
6.576
6.520
9.156
9.568
7.735
5.298
7.091
9.236
2.400
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
5av6 2 P62805 100.0 5e-68 X-RAY
2015-12-23 ARG B:37 B:35 86.0 0.382 H -60.9 -45.7 47.0 0.209 0.173 A:P68431:0.173
DC
DA
DT
DT
DG
DA
DA
DC
HOH
8.574
6.083
7.273
8.371
6.253
6.395
9.885
9.682
5.429
NH1
NH1
NH1
CD
CD
NE
CD
NH1
NH2
O3'
OP2
C7
O3'
OP2
OP2
N6
N4
O
ARG F:37 F:35 86.0 0.382 H -62.5 -44.4 52.0 0.231 0.151 E:P68431:0.151
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.504
6.414
6.584
9.339
9.749
7.738
5.282
7.217
9.519
2.654
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
5av8 2 P62805 100.0 5e-68 X-RAY
2015-12-23 ARG B:37 B:35 86.0 0.382 H -55.0 -48.5 48.0 0.213 0.169 A:P68431:0.169
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.514
6.011
7.156
9.822
8.215
5.990
6.298
9.498
9.511
2.685
NH1
NH1
NH1
NH1
CD
CD
NE
CD
NH1
NH2
O3'
OP2
C7
O6
O3'
OP2
OP2
N6
N4
O
ARG F:37 F:35 83.0 0.369 H -60.3 -44.3 50.0 0.222 0.147 E:P68431:0.147
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.508
6.295
6.570
9.362
9.931
7.705
5.186
7.310
9.581
2.629
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O
5av9 2 P62805 100.0 5e-68 X-RAY
2015-12-23 ARG B:37 B:35 93.0 0.413 H -59.4 -44.6 53.0 0.236 0.177 A:P68431:0.178
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.419
5.921
7.211
9.892
8.512
6.384
6.320
9.643
9.600
3.424
NH1
NH1
NH1
NH1
CD
CD
NE
CD
NH1
NH2
O3'
OP2
C7
O6
O3'
OP2
OP2
N6
N4
O
ARG F:37 F:35 87.0 0.387 H -61.9 -45.3 53.0 0.236 0.151 E:P68431:0.151
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.576
6.466
6.615
9.248
9.755
7.642
5.176
7.208
9.559
2.592
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
5avb 2 P62805 100.0 5e-68 X-RAY
2015-12-23 ARG B:37 B:35 88.0 0.391 H -62.4 -45.8 56.0 0.249 0.142 A:P68431:0.142
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.520
6.037
7.046
9.864
8.394
6.333
6.315
9.670
9.721
9.892
NH1
NH1
NH1
NH1
CD
CD
NE
CD
NH1
O
O3'
OP2
C7
O6
O3'
OP2
OP2
N6
N4
O
ARG F:37 F:35 88.0 0.391 H -62.4 -42.9 53.0 0.236 0.155 E:P68431:0.156
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.419
6.343
6.567
9.051
9.569
7.853
5.368
7.139
9.194
3.457
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NE
NH1
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
5avc 2 P62805 100.0 5e-68 X-RAY
2015-12-23 ARG B:37 B:35 89.0 0.396 H -62.8 -44.1 54.0 0.24 0.156 A:P68431:0.156
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.477
5.993
7.195
9.830
8.461
6.385
6.513
9.635
9.615
NH1
NH1
NH1
NH1
CD
CD
NE
CD
NH1
O3'
OP2
C7
O6
O3'
OP2
OP2
N6
N4
ARG F:37 F:35 88.0 0.391 H -64.0 -42.6 55.0 0.244 0.147 E:P68431:0.147
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
8.457
6.367
6.602
9.062
9.461
7.765
5.302
6.999
9.150
2.714
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O
7lya 2 P62805 100.0 8e-68 EM
2021-07-28 ARG B:40 B:35 98.0 0.436 H -62.3 -38.1 80.0 0.356 0.08 A:P68431:0.08
DA
DA
DC
DG
DC
DC
DG
DT
DG
DC
8.468
6.093
7.014
7.951
8.672
7.508
5.242
6.393
7.916
8.473
NH2
NH2
NH2
NH2
NH2
CD
CD
CZ
NH2
NH2
O3'
OP2
C5
O6
N4
O3'
OP2
C7
O6
N4
ARG E:40 F:35 92.0 0.409 H -68.4 -36.6 84.0 0.373 0.036 D:P68431:0.036
DC
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
9.567
5.604
3.237
6.700
7.235
9.332
8.587
8.815
8.063
8.340
9.754
NH2
NH2
NH2
NH1
NH1
NH1
CB
NH1
NH1
NH1
NH2
O3'
C3'
OP2
N7
N4
O6
OP2
N7
N4
O6
N4
7lyb 2 P62805 100.0 8e-68 EM
2021-07-28 ARG B:40 B:35 88.0 0.391 H -58.7 -44.4 82.0 0.364 0.027 A:P68431:0.027
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.265
8.995
9.800
9.228
9.982
6.112
3.622
4.822
8.721
CB
CG
NH1
NH1
NH1
NH1
NH1
NH2
NH1
OP2
OP2
O6
N4
N6
O3'
OP2
OP2
O6
ARG E:40 F:35 103.0 0.458 H -61.3 -43.7 93.0 0.413 0.045 D:P68431:0.044
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
5.644
3.220
5.660
6.956
9.341
8.944
9.648
8.781
8.711
9.459
NH2
NH2
NH1
NH1
NH1
CB
NH1
NH1
NH1
NH2
C2'
OP2
OP2
N4
O6
OP2
N7
N4
O6
N4
7lyc 2 P62805 100.0 8e-68 EM
2021-06-16 ARG B:40 B:35 90.0 0.4 H -64.7 -40.2 76.0 0.338 0.062 A:P68431:0.062
DA
DC
DC
DA
DA
DC
DG
DT
DG
8.296
8.792
9.497
9.779
9.550
4.921
2.658
4.353
8.253
CB
CD
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
N6
O3'
O3'
OP2
C7
N7
ARG E:40 F:35 81.0 0.36 H -68.4 -35.2 74.0 0.329 0.031 D:P68431:0.031
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.480
5.054
2.654
4.682
8.300
8.664
8.760
9.719
9.525
NH1
NH1
NH1
NH2
NH2
CD
CD
CD
NH1
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
3azi 2 P62805 99.03 9e-68 X-RAY
2011-09-21 ARG B:39 B:35 122.0 0.542 H -79.2 -38.0 89.0 0.396 0.146 A:P68431:0.147
DC
DA
DT
DG
DG
DA
DA
DC
DA
8.623
9.704
9.638
9.143
6.252
4.236
3.913
7.375
9.739
N
CB
NH1
NH1
NH1
NH1
NH2
NH1
NH1
OP1
OP2
O4
O6
O3'
C2'
OP2
N4
N6
ARG F:39 F:35 91.0 0.404 H -76.9 -29.4 65.0 0.289 0.115 E:P68431:0.116
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
7.796
5.672
6.550
8.789
8.933
8.155
5.610
7.062
9.019
7.555
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O
3azj 2 P62805 99.03 9e-68 X-RAY
2011-09-21 ARG B:39 B:35 84.0 0.373 H -58.0 -45.9 74.0 0.329 0.044 A:P68431:0.044
DC
DA
DT
DG
DG
DA
DA
DC
8.537
8.513
9.587
9.364
4.956
2.701
4.011
8.023
CG
CG
NH1
NH1
NH1
NH1
NH2
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 83.0 0.369 H -69.0 -41.1 58.0 0.258 0.111 E:P68431:0.111
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
7.653
5.425
6.240
8.744
9.036
8.418
6.214
7.238
9.203
9.764
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NE
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O4
3azn 2 P62805 99.03 9e-68 X-RAY
2011-09-21 ARG B:39 B:35 93.0 0.413 H -58.1 -53.8 76.0 0.338 0.075 A:P68431:0.076
DC
DA
DT
DG
DG
DA
DA
DC
8.559
8.504
9.776
9.629
4.953
2.808
4.135
7.637
CB
CG
CG
NH2
NH1
NH1
NH2
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:39 F:35 78.0 0.347 H -68.6 -43.4 55.0 0.244 0.103 E:P68431:0.102
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.750
5.622
6.653
9.146
9.177
8.316
6.051
7.357
9.326
CD
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
3azm 2 P62805 99.03 9e-68 X-RAY
2011-09-21 ARG B:39 B:35 113.0 0.502 H -74.1 -45.8 100.0 0.444 0.058 A:P68431:0.058
DC
DA
DT
DG
DT
DG
DA
DA
DC
DA
8.853
9.459
8.393
8.072
9.540
5.684
3.528
4.143
6.713
9.076
N
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP1
OP2
O4
O6
O4
O3'
OP2
OP2
N4
N6
ARG F:39 F:35 92.0 0.409 H -62.1 -56.2 62.0 0.276 0.133 E:P68431:0.133
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
8.076
6.004
6.986
7.921
8.032
8.674
6.323
6.079
7.780
9.362
CD
CD
NE
NH1
NH1
NH2
NH2
NH1
NH1
NH1
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O4
3azk 2 P62805 99.03 9e-68 X-RAY
2011-09-21 ARG B:39 B:35 95.0 0.422 H -67.5 -46.9 80.0 0.356 0.066 A:P68431:0.067
DC
DA
DT
DG
DT
DG
DA
DA
DC
DA
8.485
9.197
8.707
8.862
9.901
5.781
3.561
4.678
6.921
9.441
CB
CB
NH2
NH2
NH2
NH1
NH1
NH2
NH2
NH2
OP2
OP2
O4
O6
O4
O3'
OP2
OP2
N4
N6
ARG F:39 F:35 83.0 0.369 H -70.8 -45.7 58.0 0.258 0.111 E:P68431:0.111
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.688
5.488
6.641
8.937
9.241
8.504
6.129
7.175
9.331
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
3azl 2 P62805 99.03 9e-68 X-RAY
2011-09-21 ARG B:39 B:35 85.0 0.378 H -65.4 -43.3 70.0 0.311 0.067 A:P68431:0.067
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.644
8.587
9.917
9.858
4.988
2.906
4.206
7.982
3.089
CB
CG
CD
NH1
NH1
NH1
NH2
NH2
NE
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:39 F:35 87.0 0.387 H -63.1 -40.8 71.0 0.316 0.071 E:P68431:0.071
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.498
5.344
6.606
7.577
8.248
9.180
6.841
5.531
7.268
8.126
4.920
CD
CD
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O4
O
4uuz 2 P84040 99.03 1e-67 X-RAY
2015-02-11 ARG B:36 B:35 96.0 0.427 H -69.0 -41.7 38.0 0.169 0.258 C:P49736:0.258
6pwe 2 A0A0B4KFZ9 99.03 1e-67 EM
2019-08-21 ARG B:36 B:35 91.0 0.404 H -66.4 -50.7 86.0 0.382 0.022 A:P02299:0.022
DA
DA
DC
DG
DC
DC
DG
DC
DG
8.328
9.007
9.289
9.294
4.960
2.904
4.964
7.936
9.962
CB
CB
NE
NH2
NH2
NH1
NH2
NH2
NE
OP2
OP2
N4
O6
O3'
OP2
OP2
N4
O6
ARG F:36 F:35 92.0 0.409 H -66.4 -50.8 85.0 0.378 0.031 E:P02299:0.031
DC
DG
DT
DG
DA
DC
DC
4.906
2.923
4.603
8.697
8.392
9.534
9.951
NH2
NH2
NH2
NH2
CB
CB
NH2
O3'
O5'
OP2
N7
OP2
OP2
N4
6pwf 2 A0A0B4KFZ9 99.03 1e-67 EM
2019-08-21 ARG B:36 B:35 96.0 0.427 H -69.2 -55.1 86.0 0.382 0.045 A:P02299:0.044
DA
DA
DC
DG
DC
DC
DC
DG
DC
8.097
8.780
9.388
9.647
9.952
5.232
2.843
5.043
8.436
CD
CD
NH1
NH1
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
N4
O3'
OP2
OP2
N4
ARG F:36 F:35 95.0 0.422 H -64.4 -46.2 88.0 0.391 0.031 E:P02299:0.031
DC
DG
DT
DG
DA
DC
DG
DC
DA
5.322
2.888
4.718
8.206
8.565
8.445
8.943
9.649
9.872
NH1
NH1
NH2
NH2
N
CD
CZ
NH1
NH1
O3'
OP2
OP2
N7
OP1
OP2
O6
N4
N6
6xws 2 A0A0B4KFZ9 99.03 1e-67 X-RAY
2020-04-15 ARG B:36 B:36 92.0 0.409 H -57.4 -42.5 92.0 0.409 0.0
6xwt 2 A0A0B4KFZ9 99.03 1e-67 X-RAY
2020-04-01 ARG B:36 B:36 96.0 0.427 H -59.3 -41.8 96.0 0.427 0.0
ARG D:36 D:36 100.0 0.444 H -60.3 -42.3 100.0 0.444 0.0
6c0w 2 P62805 100.0 2e-67 EM
2018-01-17 ARG B:36 B:35 91.0 0.404 H -69.0 -37.7 82.0 0.364 0.04 A:P49450:0.04
DA
DC
DC
DA
DC
DG
DT
DG
8.365
9.390
9.597
9.797
5.336
2.968
5.817
9.653
CB
NE
NH2
NH2
NH2
NH2
NH1
NH2
OP2
OP2
N4
O3'
O3'
OP2
OP2
O6
ARG F:36 F:35 101.0 0.449 H -66.2 -43.0 85.0 0.378 0.071 E:P49450:0.071
DC
DC
DG
DC
DA
DA
DA
DC
7.962
5.699
5.486
9.259
8.543
6.258
8.846
9.487
CD
CD
NH1
NE
NH2
NH2
NE
NE
O3'
OP2
OP2
N4
C2'
OP2
OP2
N4
7by0 2 P62805 100.0 2e-67 EM
2021-02-10 ARG B:36 B:35 92.0 0.409 H -66.7 -46.5 92.0 0.409 0.0 DA
DA
DG
DC
DA
DC
DG
DT
DG
8.991
8.301
9.943
8.734
8.803
4.763
2.458
4.890
8.135
CB
CG
NH1
NH2
NH1
NH2
NH2
NH2
NH2
C5'
OP2
N7
N4
O3'
O3'
OP2
C7
O6
ARG F:36 F:35 87.0 0.387 H -68.2 -27.5 87.0 0.387 0.0 DC
DC
DC
DG
DC
DA
DC
DG
7.937
4.797
2.432
7.351
8.556
7.912
9.460
9.883
NH2
NH1
NH1
NH1
NE
N
NE
NH2
O3'
O3'
OP2
N7
N4
OP2
N4
O6
2hio 4 P62801 99.03 4e-67 X-RAY
2000-01-12 ARG D:36 D:35 92.0 0.409 H -64.3 -44.3 83.0 0.369 0.04 C:P84229:0.04
5b40 2 P62805 99.03 4e-67 X-RAY
2016-06-22 ARG B:39 B:35 100.0 0.444 H -69.4 -22.4 89.0 0.396 0.048 A:Q71DI3:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
DA
8.130
8.712
7.817
8.045
9.290
4.577
2.236
6.526
7.534
9.325
N
NH1
NH1
NH1
NH2
NH2
NH2
NE
NH1
NH1
OP1
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
N6
ARG F:39 F:35 113.0 0.502 H -68.9 -21.1 73.0 0.324 0.178 E:Q71DI3:0.178
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
8.738
6.457
5.130
8.169
8.032
8.928
6.617
7.497
9.164
9.898
NH1
NH1
NH1
NH2
NH2
NH2
NE
NE
NE
NE
O3'
C2'
OP2
N7
N4
C2'
OP2
C7
O6
O4
1kx3 3 P62799 100.0 5e-67 X-RAY
2002-12-25 ARG D:35 B:35 94.0 0.418 H -64.3 -39.7 81.0 0.36 0.058 C:P84233:0.058
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.596
9.477
9.354
9.461
4.694
2.439
4.120
8.089
3.168
CB
CB
NH2
NH2
NH2
NH2
NH1
NH1
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
C5
O
ARG H:35 F:35 70.0 0.311 H -60.6 -43.5 58.0 0.258 0.053 G:P84233:0.053
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
5.895
3.632
6.434
8.026
9.715
8.277
7.785
8.692
8.360
2.380
NH1
NH1
CD
NH2
NE
CB
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
1kx4 3 P02304 100.0 5e-67 X-RAY
2002-12-25 ARG D:35 B:35 90.0 0.4 H -65.8 -47.5 80.0 0.356 0.044 C:P16105:0.044
DA
DA
DA
DC
DT
DG
DA
DA
DG
HOH
8.388
9.601
9.849
9.490
9.275
4.774
2.569
4.724
8.920
3.307
CB
N
NE
NH2
NH2
NH2
NH2
NH1
NH1
CD
OP2
OP2
N6
N4
O3'
O3'
OP2
OP2
N7
O
ARG H:35 F:35 93.0 0.413 H -69.8 -51.4 54.0 0.24 0.173 G:P16105:0.173
DT
DG
DA
DA
DA
DA
DA
DC
HOH
8.315
6.213
6.148
9.199
8.713
6.289
9.174
9.732
3.329
CD
CD
NE
CD
NH1
NH1
NH1
NH1
CD
O3'
OP2
OP2
N6
O3'
OP2
OP2
N4
O
1kx5 4 P02304 100.0 5e-67 X-RAY
2002-12-25 ARG D:35 B:35 73.0 0.324 H -60.0 -41.5 60.0 0.267 0.057 C:P16105:0.058
DA
DT
DG
DT
DT
DG
DA
DA
HOH
8.431
7.901
9.542
9.601
5.341
2.929
6.088
8.985
2.769
CB
NH1
NH1
NH1
NH2
NH2
NE
NH1
NH1
OP2
C7
O6
O4
O3'
OP2
OP2
N6
O
ARG H:35 F:35 81.0 0.36 H -60.6 -44.1 68.0 0.302 0.058 G:P16105:0.058
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.911
5.454
6.427
7.352
8.415
8.795
6.274
5.534
7.361
8.006
2.268
NE
NE
CD
NH2
NH2
NH1
NH1
NH2
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O4
O
1m18 3 P02304 100.0 5e-67 X-RAY
2003-02-18 ARG D:35 B:35 93.0 0.413 H -61.0 -47.3 80.0 0.356 0.057 C:P02302:0.058
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.273
9.021
9.393
9.464
4.532
2.430
4.386
8.311
3.614
CB
CG
NE
NH2
NH2
NH2
NH1
NH1
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG H:35 F:235 107.0 0.476 H -65.0 -48.9 95.0 0.422 0.054 G:P02302:0.053
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
HOH
4.725
2.384
4.178
7.540
9.939
8.297
8.866
9.436
8.619
9.548
3.165
NH2
NH2
NH1
NH2
NH1
CB
CD
NH2
NH2
NH2
CD
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O4
O
1m19 3 P02304 100.0 5e-67 X-RAY
2003-02-18 ARG D:35 B:35 82.0 0.364 H -67.1 -39.5 69.0 0.307 0.057 C:P02302:0.058
DG
DC
DA
DT
DG
DT
DG
DA
DA
DC
DA
HOH
9.428
7.062
7.822
7.437
7.548
9.804
6.987
4.742
6.229
6.823
8.769
3.163
NH1
NH1
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH1
O3'
OP2
OP2
C7
O6
O4
C2'
OP2
N7
N4
N6
O
ARG H:35 F:235 88.0 0.391 H -64.8 -44.2 80.0 0.356 0.035 G:P02302:0.036
DT
DG
DA
DA
DA
DT
DG
DT
HOH
4.942
2.826
4.642
7.957
8.033
8.681
9.360
9.741
2.850
NH1
NH1
NH2
NH2
CG
CG
NE
NH2
NE
O3'
OP2
OP2
N6
OP2
C7
O6
O4
O
1m1a 3 P02304 100.0 5e-67 X-RAY
2003-02-18 ARG D:35 B:35 83.0 0.369 H -48.7 -35.3 73.0 0.324 0.045 C:P02302:0.044
DA
DT
DG
DT
DT
DT
DG
DA
DA
DC
HOH
8.759
7.002
8.452
8.496
9.854
5.498
3.262
5.818
7.702
9.062
5.011
CB
NH2
NH2
NH2
NH2
NH1
NH1
NH1
NH2
NH2
NH1
OP2
C7
O6
O4
O4
O3'
OP2
OP2
N6
N4
O
ARG H:35 F:235 87.0 0.387 H -72.8 -32.7 80.0 0.356 0.031 G:P02302:0.031
DG
DA
DA
DC
DA
DG
DC
DA
DT
DG
HOH
6.345
3.908
6.618
6.967
8.234
9.956
7.565
7.467
6.772
8.074
3.513
NH1
NH1
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N4
N6
O3'
OP2
N7
C7
O6
O
1p34 3 P62799 100.0 5e-67 X-RAY
2004-02-24 ARG D:35 B:35 77.0 0.342 H -63.7 -51.6 65.0 0.289 0.053 C:Q7ZT64:0.053
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.391
9.394
9.112
9.277
9.490
5.282
2.892
5.160
8.519
9.095
CB
NE
NH2
NH2
NH2
NH2
NH2
NH1
NH2
N
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:235 84.0 0.373 H -69.0 -44.3 73.0 0.324 0.049 G:Q7ZT64:0.049
DC
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
HOH
9.948
5.861
3.663
6.453
8.062
9.827
8.232
7.870
8.937
8.378
9.928
2.543
NH2
NH1
NH1
NH1
NH2
NE
CD
NE
NH2
NH2
NH2
NE
O3'
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O4
O
1p3a 3 P62799 100.0 5e-67 X-RAY
2004-02-24 ARG D:35 B:35 86.0 0.382 H -57.9 -35.1 76.0 0.338 0.044 C:Q7ZT64:0.044
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.606
9.273
9.224
9.265
9.141
4.834
2.547
5.130
7.588
9.070
CB
CB
NH1
NH1
NH2
NH2
NH2
NH1
NH1
N
OP2
OP2
O4
O6
O3'
C3'
OP2
OP2
N4
O
ARG H:35 F:235 82.0 0.364 H -70.5 -43.3 73.0 0.324 0.04 G:Q7ZT64:0.04
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
HOH
5.931
3.671
6.781
7.540
9.115
8.203
7.485
8.282
7.847
9.424
8.677
NH1
NH1
NH2
NH2
NH2
CB
NH2
NH2
NH2
NH2
N
O3'
OP2
N7
N6
N4
OP2
C7
O6
O4
O4
O
1p3k 3 P62799 100.0 5e-67 X-RAY
2004-02-24 ARG D:35 B:35 76.0 0.338 H -68.9 -40.3 63.0 0.28 0.058 C:Q7ZT64:0.058
DC
DA
DT
DT
DG
DA
DA
DC
HOH
8.463
9.452
9.661
9.728
4.831
2.465
5.189
9.024
8.783
CB
CB
NE
NH2
NH2
NH2
NH1
NE
N
OP2
OP2
C7
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:235 110.0 0.489 H -78.1 -39.7 96.0 0.427 0.062 G:Q7ZT64:0.062
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
HOH
4.991
2.652
4.359
7.578
8.864
8.222
8.549
9.121
8.865
9.790
5.191
NH2
NH2
NH1
NH1
NH1
CB
CD
NH1
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O4
O
1p3l 3 P62799 100.0 5e-67 X-RAY
2004-02-24 ARG D:35 B:35 83.0 0.369 H -65.0 -40.2 70.0 0.311 0.058 C:Q7ZT64:0.058
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.745
9.287
9.334
9.883
4.985
2.607
4.894
9.151
8.889
CB
CB
NE
NH2
NH2
NH2
NH1
NH2
N
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG H:35 F:235 85.0 0.378 H -62.2 -42.4 75.0 0.333 0.045 G:Q7ZT64:0.044
DT
DG
DA
DA
DA
DT
HOH
4.980
2.681
4.160
9.012
8.331
8.682
2.771
NH1
NH1
NH2
NH2
CG
NE
NH2
O3'
OP2
OP1
N6
OP2
C7
O
1p3m 3 P62799 100.0 5e-67 X-RAY
2004-02-24 ARG D:35 B:35 66.0 0.293 H -57.2 -42.4 56.0 0.249 0.044 C:Q7ZT64:0.044
DC
DA
DT
DT
DG
DA
DA
DC
8.704
9.203
9.048
9.309
5.052
2.664
5.759
9.362
CB
CB
NE
NH2
NH2
NH2
NH1
NE
OP2
OP2
C7
O3'
O3'
OP2
OP2
N4
ARG H:35 F:235 76.0 0.338 H -68.4 -47.9 67.0 0.298 0.04 G:Q7ZT64:0.04
DC
DT
DG
DA
DA
DA
DT
DG
HOH
9.739
5.080
2.667
5.297
9.416
8.405
8.611
9.828
8.626
NH2
NH2
NH2
NH1
NE
CB
CD
NE
N
O3'
O3'
OP2
OP2
N6
OP2
C7
O6
O
1s32 3 P02304 100.0 5e-67 X-RAY
2004-05-11 ARG D:35 B:35 85.0 0.378 H -67.1 -40.3 73.0 0.324 0.054 C:30268544:0.053
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.664
9.446
9.246
9.842
9.406
4.887
2.568
4.625
8.593
3.029
N
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH1
NH1
OP1
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:235 88.0 0.391 H -59.1 -50.6 82.0 0.364 0.027 G:30268544:0.027
DC
DT
DG
DA
HOH
9.785
4.758
2.549
4.709
2.625
NH1
NH1
NH1
NH2
NH2
O3'
O3'
OP2
OP2
O
1zbb 4 P62799 100.0 5e-67 X-RAY
2005-07-12 ARG D:35 B:35 71.0 0.316 H -60.1 -41.4 60.0 0.267 0.049 C:P84233:0.049
DT
DG
DA
DA
DA
DT
DG
DT
5.339
2.930
6.079
8.972
8.414
7.880
9.523
9.591
NH2
NH2
NE
NH1
CB
NH1
NH1
NH1
O3'
OP2
OP2
N6
OP2
C7
O6
O4
ARG H:35 F:35 81.0 0.36 H -60.4 -44.2 67.0 0.298 0.062 G:P84233:0.062
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
8.776
6.264
5.521
7.350
8.000
7.902
5.449
6.424
7.348
8.400
NH1
NH1
NH2
NH2
NH2
NE
NE
CD
NH2
NH2
C2'
OP2
C7
O6
O4
O3'
OP2
OP2
N6
N4
ARG L:35 b:35 72.0 0.32 H -60.1 -41.4 61.0 0.271 0.049 K:P84233:0.049
DT
DG
DA
DA
DA
DT
DG
DT
5.340
2.928
6.078
8.966
8.416
7.881
9.519
9.583
NH2
NH2
NE
NH1
CB
NH1
NH1
NH1
O3'
OP2
OP2
N6
OP2
C7
O6
O4
ARG P:35 f:35 82.0 0.364 H -60.7 -44.0 68.0 0.302 0.062 O:P84233:0.062
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
8.775
6.264
5.522
7.355
8.002
7.899
5.448
6.422
7.350
8.406
NH1
NH1
NH2
NH2
NH2
NE
NE
CD
NH2
NH2
C2'
OP2
C7
O6
O4
O3'
OP2
OP2
N6
N4
1zla 3 P62799 100.0 5e-67 X-RAY
2006-02-28 ARG D:35 B:35 79.0 0.351 H -69.9 -48.8 68.0 0.302 0.049 C:288992:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.442
9.197
9.266
9.129
9.664
5.293
2.882
5.177
8.343
3.307
CB
NE
NH2
NH2
NH2
NH2
NH2
NH1
NH2
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:235 106.0 0.471 H -65.4 -50.2 92.0 0.409 0.062 G:288992:0.062
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
5.249
2.898
4.351
7.303
8.970
8.328
8.397
9.066
8.868
4.309
NH1
NH1
NH2
NH2
NH2
CG
NE
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
2fj7 4 P62799 100.0 5e-67 X-RAY
2006-09-26 ARG D:35 B:35 86.0 0.382 H -66.6 -20.0 83.0 0.369 0.013 C:30268544:0.013
DC
DT
DG
DA
DA
DC
DC
DA
DT
DG
9.587
4.988
2.754
5.257
9.602
9.602
9.923
7.679
7.591
9.415
NH1
NH1
NH1
NH2
NH2
NE
N
N
CD
CD
O3'
O3'
OP1
OP2
N7
N4
O3'
OP1
C7
O6
ARG H:35 F:35 75.0 0.333 H -87.4 -43.4 58.0 0.258 0.075 G:30268544:0.076
DA
DG
DC
DT
DA
DA
DA
DT
DT
DA
9.584
7.238
7.532
7.507
9.685
5.943
3.417
4.902
7.338
9.227
CD
CD
NH1
NH1
NH1
NH2
NH2
NH2
NE
NH1
O3'
OP2
OP2
C7
N6
O3'
OP2
C7
C7
N6
2io5 3 P62799 100.0 5e-67 X-RAY
2007-02-27 ARG C:35 C:35 126.0 0.56 H -59.1 -38.2 126.0 0.56 0.0
2nzd 4 P62799 100.0 5e-67 X-RAY
2007-04-10 ARG D:35 B:35 91.0 0.404 H -64.1 -44.8 82.0 0.364 0.04 C:288992:0.04
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
HOH
8.535
9.540
9.283
9.304
9.923
9.289
4.723
2.353
4.431
7.984
9.818
CB
CB
NH2
NH2
NH2
NH2
NH2
NH2
NH1
NH2
NH2
OP2
OP2
C7
O6
O4
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:35 78.0 0.347 H -58.8 -40.5 67.0 0.298 0.049 G:288992:0.049
DG
DA
DA
DC
DA
DC
DA
DT
DG
DT
HOH
6.083
3.764
6.264
6.979
9.435
8.811
8.182
6.818
7.960
9.906
3.031
NH1
NH1
CD
NH2
NH2
NE
NH2
NH2
NH2
NH2
CD
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
O4
O
3b6f 4 P62799 100.0 5e-67 X-RAY
2007-12-25 ARG D:35 B:35 85.0 0.378 H -58.6 -44.9 72.0 0.32 0.058 C:P84233:0.058
DA
DT
DG
DT
DT
DG
DA
DA
8.125
8.227
9.450
9.953
5.019
3.235
5.480
8.601
N
CD
NH1
NH1
NH2
NH2
NE
NH1
OP1
C7
O6
O4
O3'
O5'
OP2
N6
ARG H:35 F:35 78.0 0.347 H -42.3 -34.8 65.0 0.289 0.058 G:P84233:0.058
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
7.563
5.267
7.495
7.845
8.868
8.511
6.225
5.519
7.254
8.632
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
3b6g 4 P62799 100.0 5e-67 X-RAY
2007-12-25 ARG D:35 B:35 79.0 0.351 H -62.3 -36.1 69.0 0.307 0.044 C:P84233:0.044
DA
DT
DG
DT
DT
DG
DA
DA
8.543
7.649
9.170
9.258
5.167
2.859
5.992
8.115
N
NH1
NH1
NH1
NH2
NH2
NE
NH1
OP1
C7
O6
O4
O3'
OP2
OP2
N6
ARG H:35 F:35 84.0 0.373 H -72.7 -58.8 70.0 0.311 0.062 G:P84233:0.062
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
7.234
5.160
7.162
6.942
7.945
9.406
6.985
5.270
6.836
7.903
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
C2'
C7
O6
O4
3c1b 2 P62799 100.0 5e-67 X-RAY
2008-10-07 ARG B:35 B:35 88.0 0.391 H -65.8 -42.6 74.0 0.329 0.062 A:P02302:0.062
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.515
9.301
9.414
9.279
9.839
4.836
2.463
4.589
8.105
3.494
N
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH1
NH1
OP1
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG F:35 F:235 78.0 0.347 H -65.3 -46.6 68.0 0.302 0.045 E:P02302:0.044
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
6.203
4.106
5.257
8.267
9.314
7.866
7.492
8.810
9.352
2.441
NH2
NH2
NH2
NH1
NH1
CG
NH1
NH1
NH1
NH1
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
3c1c 2 P62799 100.0 5e-67 X-RAY
2008-10-07 ARG B:35 B:35 85.0 0.378 H -59.5 -60.6 74.0 0.329 0.049 A:P02302:0.049
DC
DA
DT
DG
DG
DA
DA
DC
8.283
8.665
7.818
8.435
5.641
3.467
5.417
7.346
CB
NH2
NH2
NH2
NH1
NH1
NH1
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:35 F:235 94.0 0.418 H -81.8 -50.5 78.0 0.347 0.071 E:P02302:0.071
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
7.315
5.274
5.600
7.698
8.392
7.766
6.382
7.945
8.511
2.849
CD
CD
NH2
NH2
NH2
NH1
NH1
NH1
NH1
NH2
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
3c9k 4 P62801 100.0 5e-67 EM
2009-01-06 ARG D:35 D:35 92.0 0.409 H -64.3 -44.3 84.0 0.373 0.036 C:P84229:0.036
C:P84229:0.036
ARG H:35 H:35 92.0 0.409 H -64.3 -44.3 84.0 0.373 0.036 G:P84229:0.036
G:P84229:0.036
3kuy 2 P62799 100.0 5e-67 X-RAY
2010-01-05 ARG B:35 B:35 92.0 0.409 H -60.7 -44.1 80.0 0.356 0.053 A:P84233:0.053
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.649
9.353
9.305
9.455
9.447
4.830
2.480
4.496
7.889
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 71.0 0.316 H -73.2 -42.2 63.0 0.28 0.036 E:P84233:0.036
DG
DA
DA
DC
DC
DA
DT
DG
5.700
3.494
5.935
7.536
8.641
9.004
7.629
8.731
NH1
NH1
NH1
NH2
CB
NH2
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
3kxb 2 P62799 100.0 5e-67 X-RAY
2010-06-23 ARG B:35 B:35 82.0 0.364 H -62.3 -40.6 70.0 0.311 0.053 A:P84233:0.053
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.768
9.293
9.311
9.967
4.986
2.587
4.656
9.118
3.287
CB
CB
NE
NH2
NH2
NH2
NH1
NH2
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG F:35 F:35 81.0 0.36 H -61.0 -46.9 72.0 0.32 0.04 E:P84233:0.04
DT
DG
DA
DA
DA
DT
4.937
2.719
4.442
8.984
8.273
8.672
NH1
NH1
NH2
NH2
CB
CG
O3'
OP2
OP1
N6
OP2
C7
3lel 2 P62799 100.0 5e-67 X-RAY
2010-05-19 ARG B:35 B:35 88.0 0.391 H -58.9 -46.7 75.0 0.333 0.058 A:P84233:0.058
DA
DT
DT
DA
DG
DA
DA
8.004
8.652
9.858
5.014
2.827
5.983
9.187
CD
NH1
NH2
NH2
NH2
NE
NH2
OP2
C7
O4
O3'
OP2
OP2
N6
ARG F:35 F:35 89.0 0.396 H -64.5 -54.7 72.0 0.32 0.076 E:P84233:0.076
DA
DG
DA
DA
DC
DA
DA
DT
DG
DT
7.693
5.531
6.703
7.809
8.011
8.819
6.619
5.508
7.046
8.493
CD
CD
CD
NH2
NH2
NH1
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
C2'
OP2
C7
O6
O4
ARG L:35 L:35 84.0 0.373 H -56.6 -33.8 NA NA NA
ARG P:35 P:35 80.0 0.356 H -53.1 -54.8 NA NA NA
3lja 2 P62799 100.0 5e-67 X-RAY
2010-04-14 ARG B:35 B:35 74.0 0.329 H -63.5 -47.6 64.0 0.284 0.045 A:P84233:0.044
DA
DT
DG
DT
DT
DG
DA
DA
8.664
7.441
9.180
9.223
5.476
3.084
6.285
8.649
CB
NH1
NH1
NH1
NH2
NH2
NE
NH1
OP2
C7
O6
O4
O3'
OP2
OP2
N6
ARG F:35 F:35 88.0 0.391 H -58.5 -45.0 76.0 0.338 0.053 E:P84233:0.053
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
DT
7.936
5.526
6.630
7.165
8.471
8.892
6.501
6.145
7.135
7.577
9.874
NE
NE
CD
NH2
NH1
NH1
NH1
NH1
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O4
3lz0 2 P62799 100.0 5e-67 X-RAY
2010-09-15 ARG B:35 B:35 78.0 0.347 H -84.1 -65.0 65.0 0.289 0.058 A:P84233:0.058
DA
DC
DG
DC
DC
DG
DT
DG
7.677
8.856
9.684
9.339
6.274
3.806
5.543
8.861
CD
NE
NE
NH2
NH2
NH2
NH1
NH2
OP2
OP2
O6
N4
O3'
OP2
OP2
O6
ARG F:35 F:35 99.0 0.44 H -68.1 -46.0 70.0 0.311 0.129 E:P84233:0.129
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.511
5.113
5.407
7.758
9.852
9.143
6.739
9.148
9.246
9.474
CD
CD
NH2
NH2
NH2
NH1
NH1
NH1
CZ
NE
O3'
OP2
OP2
N4
O6
O3'
OP2
N7
N4
O6
3lz1 2 P62799 100.0 5e-67 X-RAY
2010-09-15 ARG B:35 B:35 70.0 0.311 H -81.8 -61.4 56.0 0.249 0.062 A:P84233:0.062
DA
DA
DC
DG
DC
DC
DG
DC
7.597
8.463
8.649
8.671
6.866
4.604
6.673
8.356
CD
NH2
NH2
NH2
NH1
NH1
NH1
NH2
OP2
OP2
N4
O6
O3'
OP2
OP2
N4
ARG F:35 F:35 99.0 0.44 H -65.1 -46.2 71.0 0.316 0.124 E:P84233:0.124
DC
DG
DT
DG
DA
DA
DC
DC
7.231
4.866
4.498
8.073
9.819
7.436
9.330
9.928
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
O3'
OP2
OP2
N7
O3'
OP2
C5
N4
3mgp 2 P62799 100.0 5e-67 X-RAY
2010-06-16 ARG B:35 B:35 73.0 0.324 H -69.0 -38.1 60.0 0.267 0.057 A:P84233:0.058
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.570
9.125
8.965
9.639
9.951
5.012
2.783
5.778
8.457
CD
NH1
NH1
NH2
NH2
NH2
NH2
NE
NH2
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 81.0 0.36 H -62.6 -40.0 68.0 0.302 0.058 E:P84233:0.058
DC
DT
DG
DA
DA
DA
DT
DG
DT
DT
8.050
5.661
6.709
7.345
8.818
8.733
6.341
6.584
6.241
7.826
NE
NE
CD
NH2
NH1
NH1
NH1
NH2
NH2
NH2
O3'
OP2
OP2
N6
N6
C2'
OP2
OP2
C7
O4
3mgq 2 P62799 100.0 5e-67 X-RAY
2010-06-16 ARG B:35 B:35 75.0 0.333 H -65.8 -38.6 62.0 0.276 0.057 A:P84233:0.058
DC
DA
DT
DG
DG
DA
DA
DC
8.312
9.105
9.090
9.351
5.084
2.899
5.766
8.000
CD
NH1
NH1
NH2
NH2
NH2
NE
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:35 F:35 87.0 0.387 H -62.3 -41.7 74.0 0.329 0.058 E:P84233:0.058
DC
DT
DG
DA
DA
DA
DT
DG
DT
DT
8.168
5.805
6.440
7.539
8.368
8.425
6.041
6.845
6.551
7.921
NE
NE
CD
NH2
NH2
NH1
NH1
NH2
NH2
NH2
O3'
OP2
OP2
N6
N6
C2'
OP2
OP2
C7
O4
3mgr 2 P62799 100.0 5e-67 X-RAY
2010-06-16 ARG B:35 B:35 77.0 0.342 H -66.7 -43.7 65.0 0.289 0.053 A:P84233:0.053
DA
DT
DG
DT
DT
DG
DA
DA
DC
8.584
7.609
9.036
9.325
5.417
3.082
6.261
8.427
9.901
CB
NH1
NH1
NH1
NH2
NH2
NE
NH1
NH1
OP2
C7
O6
O4
O3'
OP2
OP2
N6
N4
ARG F:35 F:35 84.0 0.373 H -51.2 -49.3 70.0 0.311 0.062 E:P84233:0.062
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
8.274
5.916
6.620
7.250
8.566
8.401
5.905
5.677
7.051
7.806
NE
NE
CD
NH2
NH2
NH1
NH1
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
3mgs 2 P62799 100.0 5e-67 X-RAY
2010-06-16 ARG B:35 B:35 76.0 0.338 H -64.3 -46.8 65.0 0.289 0.049 A:P84233:0.049
DA
DT
DG
DT
DC
DT
DG
DA
DA
8.517
7.884
9.119
9.340
9.845
5.403
2.986
6.178
8.559
CB
NH1
NH1
NH1
NH2
NH2
NH2
NE
NH1
OP2
C7
O6
O4
O3'
O3'
OP2
OP2
N6
ARG F:35 F:35 82.0 0.364 H -63.2 -50.6 70.0 0.311 0.053 E:P84233:0.053
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
8.299
5.855
6.611
7.284
8.438
8.319
5.840
5.676
7.006
7.760
NE
NE
CD
NH2
NH2
NH1
NH1
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
3mnn 2 P62799 100.0 5e-67 X-RAY
2011-04-06 ARG B:35 B:35 86.0 0.382 H -68.5 -38.6 75.0 0.333 0.049 A:P84233:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.623
9.352
9.668
9.898
9.506
4.568
2.421
4.302
7.883
CB
CB
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O4
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 80.0 0.356 H -61.0 -46.1 69.0 0.307 0.049 E:P84233:0.049
DG
DA
DA
DC
DC
DA
DT
DG
HOH
5.560
3.344
5.698
8.459
8.530
9.085
8.480
9.448
8.838
NH1
NH1
NH1
NH2
CB
NE
NH2
NH2
N
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
O
3mvd 2 P62799 100.0 5e-67 X-RAY
2010-08-25 ARG B:35 B:35 76.0 0.338 H -62.8 -27.6 63.0 0.28 0.058 A:P84233:0.058
DC
DC
DG
DC
DA
DA
DC
DG
5.705
3.545
4.929
8.475
7.598
8.766
9.378
9.722
NH2
NH1
NH2
NH2
CG
CD
CD
CZ
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:35 F:35 87.0 0.387 H -58.5 -48.1 71.0 0.316 0.071 E:P84233:0.071
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.123
8.676
9.445
9.422
9.691
5.119
3.046
4.619
8.273
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
3o62 2 P62799 100.0 5e-67 X-RAY
2011-01-05 ARG B:35 B:35 90.0 0.4 H -65.5 -31.8 79.0 0.351 0.049 A:P84233:0.049
DC
DT
DG
DG
DA
DA
DC
8.793
9.198
9.203
4.991
2.504
4.850
8.213
CG
NH2
NH2
NH2
NH2
NH1
NH1
OP2
C7
O6
O3'
OP2
OP2
N4
ARG F:35 F:35 90.0 0.4 H -65.4 -32.3 78.0 0.347 0.053 E:P84233:0.053
DT
DC
DA
DA
DC
DG
DA
DT
DG
DT
DT
4.544
2.586
5.146
8.330
9.288
9.858
7.517
7.955
9.056
8.677
9.946
NH2
NH2
NH1
NH1
NH1
CG
CG
NE
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O4
3reh 2 P62799 100.0 5e-67 X-RAY
2012-03-14 ARG B:35 B:35 92.0 0.409 H -60.7 -41.8 78.0 0.347 0.062 A:P84233:0.062
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
DA
HOH
8.625
9.403
8.778
8.920
9.791
9.609
4.968
2.538
4.500
7.605
9.751
9.928
CB
CB
NH2
NH2
NH2
NH2
NH2
NH2
NH1
NH2
NH1
NH2
OP2
OP2
C7
O6
O4
O3'
O3'
OP2
OP2
N4
N6
O
ARG F:35 F:35 71.0 0.316 H -59.7 -42.6 60.0 0.267 0.049 E:P84233:0.049
DG
DA
DA
DC
DA
DC
DA
DT
DG
HOH
6.328
3.956
6.291
7.235
9.422
8.732
7.813
6.991
8.125
2.894
NH1
NH1
CD
NH2
NH2
NE
NH2
NH2
NH2
CD
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
O
3rei 2 P62799 100.0 5e-67 X-RAY
2012-03-14 ARG B:35 B:35 92.0 0.409 H -63.0 -41.6 80.0 0.356 0.053 A:P84233:0.053
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
8.482
9.369
9.021
9.065
9.933
9.457
4.742
2.374
4.527
7.713
CB
CB
NH2
NH2
NH2
NH2
NH2
NH2
NH1
NH2
OP2
OP2
C7
O6
O4
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 72.0 0.32 H -62.4 -43.2 59.0 0.262 0.058 E:P84233:0.058
DG
DA
DA
DC
DA
DC
DA
DT
DG
6.178
3.834
6.291
7.113
9.398
8.724
8.052
7.269
8.249
NH1
NH1
CD
NH2
NH2
NE
NH2
NH2
NH2
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
3rej 2 P62799 100.0 5e-67 X-RAY
2012-03-14 ARG B:35 B:35 98.0 0.436 H -52.4 -45.8 86.0 0.382 0.054 A:P84233:0.053
DA
DA
DA
DC
DT
DG
DA
DA
DG
HOH
8.255
9.792
9.882
9.339
9.229
4.572
2.377
4.750
8.528
3.102
CB
CB
CD
NH2
NH2
NH2
NH2
NH1
NH1
CD
OP2
OP2
N6
N4
O3'
O3'
OP2
OP2
N7
O
ARG F:35 F:35 89.0 0.396 H -57.9 -45.2 55.0 0.244 0.152 E:P84233:0.151
DT
DG
DA
DA
DA
DA
DA
DC
HOH
8.030
5.869
6.328
9.483
8.591
6.047
9.140
9.977
5.461
CD
CD
NE
CD
NH1
NH1
NH1
NH1
NH2
O3'
OP2
OP2
N6
O3'
OP2
OP2
N4
O
3rek 2 P62799 100.0 5e-67 X-RAY
2012-03-14 ARG B:35 B:35 98.0 0.436 H -55.7 -51.6 87.0 0.387 0.049 A:P84233:0.049
DA
DA
DA
DC
DT
DG
DA
DA
DG
8.196
9.628
9.885
9.219
9.191
4.628
2.346
4.741
8.480
CB
N
NE
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
N6
N4
O3'
O3'
OP2
OP2
N7
ARG F:35 F:35 90.0 0.4 H -59.6 -45.5 56.0 0.249 0.151 E:P84233:0.151
DT
DG
DA
DA
DA
DA
DA
DC
7.944
5.788
6.438
9.183
8.634
6.128
8.829
9.457
CD
CD
NE
CD
NH1
NH1
NH1
NH1
O3'
OP2
OP2
N6
O3'
OP2
N7
N4
3rel 2 P62799 100.0 5e-67 X-RAY
2012-03-14 ARG B:35 B:35 92.0 0.409 H -68.4 -49.9 81.0 0.36 0.049 A:P84233:0.049
DA
DA
DA
DC
DT
DG
DA
DA
DG
PT
8.392
9.686
9.908
9.136
9.307
4.885
2.616
5.067
8.469
6.509
CD
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH1
OP2
OP2
N6
N4
O3'
O3'
OP2
OP2
N7
PT
ARG F:35 F:35 92.0 0.409 H -65.1 -43.7 56.0 0.249 0.16 E:P84233:0.16
DT
DG
DA
DA
DG
DA
DA
DA
DC
8.120
5.988
6.510
9.265
9.977
8.564
6.043
8.764
9.446
CD
CD
NE
NH1
NH1
NH1
NH1
NH1
NH1
O3'
OP2
OP2
N6
O6
O3'
OP2
N7
N4
3tu4 2 P62799 100.0 5e-67 X-RAY
2011-11-23 ARG B:35 B:35 84.0 0.373 H -59.6 -40.6 73.0 0.324 0.049 A:P84233:0.049
DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
9.368
5.000
2.582
5.229
8.348
8.173
9.365
9.266
9.242
9.897
NH2
NH2
NH2
NH1
NH2
CB
CB
NE
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG F:35 F:35 84.0 0.373 H -60.9 -42.1 79.0 0.351 0.022 E:P84233:0.022
DA
DC
DC
DA
DA
DC
DG
DT
DG
8.373
8.964
9.213
9.512
9.853
5.088
2.723
4.901
8.801
CB
CD
NH1
NH1
NH1
NH2
NH1
NH2
NH2
OP2
OP2
N4
N6
O3'
O3'
OP2
C7
N7
3ut9 2 P62799 100.0 5e-67 X-RAY
2012-04-11 ARG B:35 B:35 92.0 0.409 H -66.5 -46.7 62.0 0.276 0.133 A:P84233:0.133
DA
DA
DC
DC
DG
DT
DG
HOH
9.086
6.646
8.870
7.857
5.633
5.287
8.309
8.893
NH1
NH1
NH1
CD
CD
NH2
NH2
N
C2'
OP2
C5
O3'
OP2
OP2
N7
O
ARG F:35 F:35 69.0 0.307 H -62.3 -50.6 60.0 0.267 0.04 E:P84233:0.04
DC
DG
DT
DG
DA
DC
DG
DC
HOH
5.840
3.751
5.777
9.427
8.126
9.150
9.784
9.333
8.538
NH1
NH1
NH1
NH2
CB
NE
NH2
NH2
N
O3'
OP2
C7
O6
OP2
OP2
N7
N4
O
3uta 2 P62799 100.0 5e-67 X-RAY
2012-04-11 ARG B:35 B:35 79.0 0.351 H -58.9 -47.1 67.0 0.298 0.053 A:P84233:0.053
DA
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.341
9.339
9.304
9.885
9.180
5.005
2.617
5.145
8.429
9.908
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
O
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG F:35 F:35 81.0 0.36 H -58.7 -43.2 67.0 0.298 0.062 E:P84233:0.062
DG
DA
DA
DC
DA
DA
DA
DT
DG
HOH
5.954
3.633
6.195
7.591
9.919
7.961
8.629
7.607
8.774
3.094
NH1
NH1
NH1
NH2
NH2
NE
NH2
NH2
NH2
CD
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
O
3utb 2 P62799 100.0 5e-67 X-RAY
2012-04-11 ARG B:35 B:35 86.0 0.382 H -60.5 -43.5 75.0 0.333 0.049 A:P84233:0.049
DA
DA
DC
DT
DG
DA
DA
DG
MN
HOH
8.324
9.668
9.657
9.263
4.631
2.467
4.857
8.672
9.855
3.214
CD
N
NH2
NH2
NH2
NH2
NH1
NH1
NH2
CD
OP2
OP2
N4
O3'
O3'
OP2
OP2
N7
MN
O
ARG F:35 F:35 98.0 0.436 H -63.0 -42.9 62.0 0.276 0.16 E:P84233:0.16
DT
DG
DA
DA
DG
DA
DA
DA
DC
HOH
8.635
6.423
6.668
9.194
9.871
8.198
5.704
8.578
9.063
4.456
CG
CG
CD
NH1
NH1
NH1
NH1
NH1
NH1
CG
O3'
OP1
OP2
N6
O6
C2'
OP2
N7
N4
O
3x1s 2 P62805 100.0 5e-67 X-RAY
2015-09-23 ARG B:35 B:35 104.0 0.462 H -58.7 -44.7 76.0 0.338 0.124 A:P68431:0.124
DC
DA
DT
DG
DG
DA
DA
DC
DA
8.400
8.884
8.335
8.637
6.879
4.717
4.121
6.832
9.314
N
CD
NH1
NH1
NH1
NH1
NH2
NH1
NH1
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
N6
ARG F:35 F:35 87.0 0.387 H -61.3 -40.9 57.0 0.253 0.134 E:P68431:0.133
DT
DG
DA
DA
DC
DC
DA
DT
DG
7.888
5.749
6.487
9.138
8.887
8.017
5.602
6.746
9.095
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
3x1t 3 P62805 100.0 5e-67 X-RAY
2015-09-23 ARG D:35 B:35 82.0 0.364 H -58.8 -46.9 71.0 0.316 0.048 C:P68431:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.494
9.330
9.720
9.365
9.660
4.830
2.432
4.792
8.732
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
CZ
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG H:35 F:35 83.0 0.369 H -55.9 -47.5 74.0 0.329 0.04 G:P68431:0.04
DT
DG
DA
DA
DA
DT
DG
DT
HOH
4.692
2.460
5.264
8.342
8.180
8.218
9.553
9.962
2.945
NH2
NH2
NH2
NE
CB
CD
NE
NH2
NH2
O3'
OP2
OP2
N6
OP2
C7
O6
O4
O
3x1u 3 P62805 100.0 5e-67 X-RAY
2015-09-23 ARG D:35 B:35 90.0 0.4 T -142.0 68.6 6.0 0.027 0.373 C:P68431:0.373
DC
DA
DA
DA
8.846
9.350
8.020
9.886
N
N
O
O
OP1
OP2
OP1
OP2
ARG H:35 F:35 77.0 0.342 H -54.1 -55.9 63.0 0.28 0.062 G:P68431:0.062
DT
DG
DA
DA
DC
DA
DT
DG
DT
5.754
3.323
5.915
8.532
9.736
8.214
7.018
8.838
9.394
NH2
NH2
NE
NH1
NH1
CD
NH1
NH1
NH1
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
3x1v 3 P62805 100.0 5e-67 X-RAY
2015-09-23 ARG D:35 B:35 66.0 0.293 H -78.2 -36.3 56.0 0.249 0.044 C:P68431:0.044
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.632
9.428
9.524
9.949
9.662
4.901
2.575
5.087
9.205
CD
CB
NE
NH2
NH2
NH2
NH2
NH1
CZ
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG H:35 F:35 93.0 0.413 H -82.2 -38.0 82.0 0.364 0.049 G:P68431:0.049
DC
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
9.437
4.716
2.450
4.620
7.984
9.944
8.354
8.348
9.879
9.734
3.280
NH2
NH2
NH2
NH1
NH1
NH1
CB
CD
NH1
NH1
NH1
O3'
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
4h9n 2 P62805 100.0 5e-67 X-RAY
2012-10-10 ARG B:35 B:35 120.0 0.533 H -57.9 -39.8 120.0 0.533 0.0 HOH
2.770
O
O
4h9o 2 P62805 100.0 5e-67 X-RAY
2012-10-10 ARG B:35 B:35 119.0 0.529 H -58.8 -39.3 119.0 0.529 0.0 HOH
2.736
O
O
4h9p 2 P62805 100.0 5e-67 X-RAY
2012-10-17 ARG B:35 B:35 33.0 NA H -57.7 -37.5 33.0 NA NA HOH
2.787
O
O
4h9q 2 P62805 100.0 5e-67 X-RAY
2012-10-17 ARG B:35 B:35 121.0 0.538 H -56.9 -43.2 121.0 0.538 0.0 HOH
2.779
O
O
4h9r 2 P62805 100.0 5e-67 X-RAY
2012-10-17 ARG B:35 B:35 37.0 NA H -64.3 -42.1 37.0 NA NA HOH
3.286
CB
O
4j8u 2 P62799 100.0 5e-67 X-RAY
2013-04-17 ARG B:35 B:35 90.0 0.4 H -60.6 -44.4 78.0 0.347 0.053 A:P84233:0.053
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.537
9.279
9.215
9.304
9.558
4.820
2.428
4.291
7.931
CB
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 72.0 0.32 H -59.9 -41.6 60.0 0.267 0.053 E:P84233:0.053
DG
DA
DA
DC
DA
DC
DA
DT
DG
6.020
3.718
6.393
7.277
9.485
8.576
7.976
7.135
8.396
NH1
NH1
CD
NH2
NH2
NE
NH2
NH2
NH2
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
4j8v 2 P62799 100.0 5e-67 X-RAY
2013-05-08 ARG B:35 B:35 92.0 0.409 H -59.2 -45.4 81.0 0.36 0.049 A:P84233:0.049
DT
DG
DA
DA
DC
9.684
4.938
2.526
4.408
7.760
NH2
NH2
NH2
NH1
NH1
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 73.0 0.324 H -56.5 -46.0 NA NA NA
4j8w 2 P62799 100.0 5e-67 X-RAY
2013-04-17 ARG B:35 B:35 94.0 0.418 H -64.6 -40.0 80.0 0.356 0.062 A:P84233:0.062
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.635
9.313
9.008
9.202
9.541
4.844
2.439
4.255
7.866
CB
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 72.0 0.32 H -57.5 -44.9 60.0 0.267 0.053 E:P84233:0.053
DG
DA
DA
DC
DA
DC
DA
DT
DG
6.102
3.814
6.403
7.410
9.607
8.683
7.880
7.185
8.429
NH1
NH1
CD
NH2
NH2
NE
NH2
NH2
NH2
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
4j8x 2 P62799 100.0 5e-67 X-RAY
2013-05-08 ARG B:35 B:35 90.0 0.4 H -51.5 -48.0 79.0 0.351 0.049 A:P84233:0.049
DC
DA
DT
DG
8.672
9.180
9.199
9.290
CB
CB
NH2
NH2
OP2
OP2
C7
O6
ARG F:35 F:35 69.0 0.307 H -66.3 -45.5 NA NA NA
4r8p 2 P62799 100.0 5e-67 X-RAY
2014-11-05 ARG B:35 B:35 88.0 0.391 H -57.9 -46.9 62.0 0.276 0.115 A:P84233:0.116
DA
DA
DC
DG
DC
DC
DG
DT
DG
DC
9.468
6.974
8.476
9.533
9.429
7.194
4.954
4.750
8.105
9.391
NH1
NH1
NH1
NH1
NE
NE
NE
NH2
NH2
NH1
O3'
OP2
C5
O6
N4
O3'
OP2
OP2
N7
N4
ARG F:35 F:35 80.0 0.356 H -58.5 -43.4 71.0 0.316 0.04 E:P84233:0.04
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.738
5.028
2.769
4.319
7.679
8.277
8.673
9.620
9.157
NH1
NH1
NH1
NH2
NH2
CB
CD
CD
NH1
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
4wu8 4 P62799 100.0 5e-67 X-RAY
2015-09-02 ARG D:35 B:35 80.0 0.356 H -68.1 -37.1 71.0 0.316 0.04 C:P84233:0.04
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.344
9.234
9.234
9.878
9.185
4.767
2.454
4.916
8.070
9.838
CB
CB
NE
NH1
NH2
NH2
NH2
NH1
NH1
O
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:35 83.0 0.369 H -64.4 -38.3 73.0 0.324 0.045 G:P84233:0.044
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
9.997
4.745
2.520
4.832
7.836
8.610
9.368
9.320
9.778
3.353
NH2
NH2
NH2
NH1
NH1
CD
CD
NE
NH1
CG
O3'
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
O
4wu9 2 P62799 100.0 5e-67 X-RAY
2015-09-02 ARG B:35 B:35 80.0 0.356 H -60.5 -40.0 69.0 0.307 0.049 A:P84233:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.952
9.304
9.522
9.766
8.943
4.658
2.278
5.288
8.343
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 84.0 0.373 H -71.5 -41.0 70.0 0.311 0.062 E:P84233:0.062
DT
DG
DA
DA
DC
DC
DA
DT
DG
9.717
4.776
2.537
4.905
7.848
8.768
9.692
9.168
9.600
NH2
NH2
NH2
NH1
NH1
N
CB
NE
NH2
O3'
O3'
OP2
OP2
N4
OP1
OP2
C7
O6
4xuj 2 P62799 100.0 5e-67 X-RAY
2016-01-27 ARG B:35 B:35 88.0 0.391 H -70.1 -37.2 77.0 0.342 0.049 A:P84233:0.049
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
8.785
9.450
8.375
8.383
9.886
9.744
5.124
2.665
4.753
7.645
CB
N
NH2
NH2
NH2
NH2
NH2
NH2
NH1
NH2
OP2
OP2
C7
O6
O4
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 70.0 0.311 H -52.0 -52.4 56.0 0.249 0.062 E:P84233:0.062
DG
DA
DA
DC
DA
DC
DA
DT
DG
6.270
3.853
6.542
7.330
9.231
8.334
7.633
6.876
8.501
NH1
NH1
CD
NH2
NH2
NE
NH2
NH2
NH2
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
5bnv 2 P62805 100.0 5e-67 X-RAY
2015-06-17 ARG B:35 B:35 86.0 0.382 H -60.7 -43.6 44.0 0.196 0.186 F:P49736:0.187
PO4
HOH
2.894
5.304
NH2
O
O2
O
ARG D:35 E:35 91.0 0.404 H -64.6 -42.4 39.0 0.173 0.231 E:P49736:0.231
PO4
HOH
7.072
3.128
NH1
NH1
O1
O
5bnx 2 P62805 100.0 5e-67 X-RAY
2015-06-17 ARG B:35 B:35 89.0 0.396 H -63.2 -40.6 51.0 0.227 0.169 C:P49736:0.169
GOL
HOH
7.470
3.465
N
CD
O1
O
5bo0 2 P62805 100.0 5e-67 X-RAY
2015-06-17 ARG B:35 B:35 84.0 0.373 H -58.6 -41.0 43.0 0.191 0.182 C:P49736:0.182
GOL
7.782
NH2
O1
5bs7 2 P62799 100.0 5e-67 X-RAY
2015-07-08 ARG C:35 C:35 110.0 0.489 H -75.0 -52.7 40.0 0.178 0.311 E:Q68D10:0.311
HOH
3.033
NH2
O
ARG D:35 D:35 125.0 0.556 H -51.2 -44.5 125.0 0.556 0.0 HOH
9.411
CD
O
5bsa 2 P62799 100.0 5e-67 X-RAY
2015-07-08 ARG C:35 C:35 95.0 0.422 H -58.0 -43.4 20.0 0.089 0.333 E:Q68D10:0.333
ARG D:35 D:35 92.0 0.409 H -61.2 -43.1 78.0 0.347 0.062 E:Q68D10:0.062
5cp6 4 P62799 100.0 5e-67 X-RAY
2016-06-01 ARG D:35 B:35 80.0 0.356 H -57.0 -38.3 68.0 0.302 0.054 C:P84233:0.053
DC
DA
DT
DT
DG
DA
DA
DC
HOH
8.726
9.197
9.434
9.285
4.667
2.432
4.789
8.147
9.842
CB
CB
NE
NH2
NH2
NH2
NH1
NH1
O
OP2
OP2
C7
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:35 86.0 0.382 H -63.0 -41.5 74.0 0.329 0.053 G:P84233:0.053
DT
DG
DA
DA
DC
DC
DA
DT
DG
HOH
9.670
4.733
2.480
4.695
8.219
8.801
9.445
9.254
9.897
3.482
NH2
NH2
NH2
NH1
NH1
CD
CD
NE
NH2
CG
O3'
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
O
5dnm 2 P62799 100.0 5e-67 X-RAY
2016-09-14 ARG B:35 B:35 88.0 0.391 H -59.7 -41.1 77.0 0.342 0.049 A:P84233:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.674
9.285
9.686
9.903
9.548
4.512
2.391
4.252
7.874
CB
CB
CD
NH1
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O4
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 78.0 0.347 H -69.4 -42.9 71.0 0.316 0.031 E:P84233:0.031
DG
DA
DA
DC
DC
DA
DT
DG
5.482
3.311
5.337
8.358
8.736
9.192
8.848
9.617
NH1
NH2
NH1
NH1
CB
NE
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
5dnn 2 P62799 100.0 5e-67 X-RAY
2016-09-14 ARG B:35 B:35 85.0 0.378 H -61.2 -40.5 75.0 0.333 0.045 A:P84233:0.044
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.615
9.366
9.696
9.898
9.494
4.509
2.379
4.303
7.850
CB
CB
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O4
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 77.0 0.342 H -67.5 -45.0 69.0 0.307 0.035 E:P84233:0.036
DG
DA
DA
DC
DC
DA
DT
DG
5.467
3.277
5.536
8.505
8.642
9.216
8.696
9.530
NH1
NH1
NH1
NH2
CB
NE
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
5gsu 2 P62805 100.0 5e-67 X-RAY
2017-02-15 ARG C:35 B:35 87.0 0.387 H -68.6 -41.3 70.0 0.311 0.076 A:P68431:0.076
DC
DA
DT
DG
DG
DA
DA
DC
8.385
9.362
9.367
9.244
4.937
2.691
4.977
8.725
CD
CB
NE
NH2
NH2
NH2
NH1
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG D:35 F:35 79.0 0.351 H -72.0 -44.7 63.0 0.28 0.071 B:P68431:0.071
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
5.448
2.885
6.277
7.624
9.458
8.303
7.297
8.266
8.845
8.652
NH2
NH2
NE
NH1
NH1
CD
NH1
NH1
NH1
N
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
5gt0 2 P62805 100.0 5e-67 X-RAY
2017-02-15 ARG C:35 B:35 71.0 0.316 H -59.1 -42.9 62.0 0.276 0.04 A:P68431:0.04
DC
DA
DT
DG
DG
DA
DA
DC
8.633
9.037
8.650
8.938
5.559
3.361
5.718
7.802
CD
NE
NH2
NH2
NH1
NH2
NH1
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
ARG D:35 F:35 82.0 0.364 H -59.8 -48.7 72.0 0.32 0.044 B:P68431:0.044
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
6.488
4.003
6.385
6.941
8.129
7.712
6.162
6.944
7.756
5.976
NH1
NH1
NH1
NH2
NH2
NE
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
5gt3 2 P62805 100.0 5e-67 X-RAY
2017-02-15 ARG B:35 B:35 102.0 0.453 H -70.0 -40.5 87.0 0.387 0.066 A:P68431:0.067
DC
DA
DT
DG
DG
DA
DA
DC
8.653
9.435
9.618
9.052
4.728
2.387
4.226
7.894
CB
CB
NH1
NH1
NH2
NH2
NH1
NH1
OP2
OP2
O4
O6
O3'
OP2
OP2
C5
ARG F:35 F:35 91.0 0.404 H -72.2 -42.3 85.0 0.378 0.026 E:P68431:0.027
DC
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
9.647
4.788
2.529
4.979
7.686
9.596
8.499
8.867
9.177
9.053
8.187
NH2
NH2
NH2
NH1
NH1
NH1
CB
CD
NH1
NH1
N
O3'
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
5hq2 2 P62799 100.0 5e-67 X-RAY
2016-03-23 ARG B:35 B:35 49.0 NA H -45.3 -55.9 49.0 NA NA DA
DC
DC
DG
DT
8.525
9.722
9.856
7.827
9.598
CB
CB
CB
CB
CB
OP2
OP2
O3'
OP2
C7
5ja4 2 P62805 100.0 5e-67 X-RAY
2016-06-15 ARG B:35 B:35 88.0 0.391 H -57.4 -39.1 20.0 0.089 0.302 C:P49736:0.302
HOH
3.577
NH1
O
5kdm 2 P62805 100.0 5e-67 X-RAY
2016-09-07 ARG B:35 B:35 76.0 0.338 H -60.2 -22.6 76.0 0.338 0.0
5nl0 2 P62799 100.0 5e-67 X-RAY
2017-05-17 ARG B:35 B:35 77.0 0.342 H -66.1 -46.5 68.0 0.302 0.04 A:P84233:0.04
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.369
9.335
9.763
8.535
9.996
5.357
3.216
5.817
8.599
CB
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH2
OP2
OP2
N7
N4
N6
O3'
OP2
C7
O6
ARG F:35 F:35 70.0 0.311 H -65.7 -46.4 62.0 0.276 0.035 E:P84233:0.036
DC
DG
DT
DG
DA
DC
DG
DC
5.568
3.517
6.050
9.586
8.343
9.180
9.904
9.382
NH1
NH1
NH1
NH2
CB
NE
NH2
NH2
O3'
OP2
C7
O6
OP2
OP2
N7
N4
ARG L:35 L:35 73.0 0.324 H -66.5 -46.4 NA NA NA
5oxv 4 P62799 100.0 5e-67 X-RAY
2017-10-11 ARG D:35 P:35 99.0 0.44 H -68.1 -46.0 69.0 0.307 0.133 E:P84233:0.133
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
9.143
6.739
9.148
9.246
9.474
7.511
5.113
5.407
7.759
9.851
NH1
NH1
NH1
CZ
NE
CD
CD
NH2
NH2
NH2
O3'
OP2
N7
N4
O6
O3'
OP2
OP2
N4
O6
ARG H:35 L:35 77.0 0.342 H -84.1 -64.9 65.0 0.289 0.053 I:P84233:0.053
DC
DG
DT
DG
DA
DC
DG
DC
6.274
3.805
5.543
8.861
7.677
8.856
9.684
9.340
NH2
NH2
NH1
NH2
CD
NE
NE
NH2
O3'
OP2
OP2
O6
OP2
OP2
O6
N4
ARG M:35 F:35 98.0 0.436 H -68.1 -46.0 69.0 0.307 0.129 N:P84233:0.129
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
9.143
6.738
9.147
9.247
9.475
7.511
5.112
5.406
7.758
9.851
NH1
NH1
NH1
CZ
NE
CD
CD
NH2
NH2
NH2
O3'
OP2
N7
N4
O6
O3'
OP2
OP2
N4
O6
ARG Q:35 B:35 76.0 0.338 H -84.0 -65.0 64.0 0.284 0.054 R:P84233:0.053
DC
DG
DT
DG
DA
DC
DG
DC
6.273
3.806
5.544
8.863
7.678
8.856
9.684
9.340
NH2
NH2
NH1
NH2
CD
NE
NE
NH2
O3'
OP2
OP2
O6
OP2
OP2
O6
N4
5oy7 3 P62799 100.0 5e-67 X-RAY
2017-09-20 ARG C:35 N:35 99.0 0.44 H -68.1 -46.1 71.0 0.316 0.124 B:Q92133:0.124
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.513
5.112
5.405
7.758
9.851
9.145
6.740
9.148
9.246
9.473
CD
CD
NH2
NH2
NH2
NH1
NH1
NH1
CZ
NE
O3'
OP2
OP2
N4
O6
O3'
OP2
N7
N4
O6
ARG G:35 R:35 75.0 0.333 H -84.1 -64.9 63.0 0.28 0.053 F:Q92133:0.053
DA
DC
DG
DC
DC
DG
DT
DG
7.677
8.857
9.686
9.338
6.275
3.806
5.543
8.861
CD
NE
NE
NH2
NH2
NH2
NH1
NH2
OP2
OP2
O6
N4
O3'
OP2
OP2
O6
ARG I:35 J:35 75.0 0.333 H -84.0 -65.0 63.0 0.28 0.053 H:Q92133:0.053
DA
DC
DG
DC
DC
DG
DT
DG
7.678
8.857
9.684
9.338
6.272
3.804
5.544
8.862
CD
NE
NE
NH2
NH2
NH2
NH1
NH2
OP2
OP2
O6
N4
O3'
OP2
OP2
O6
ARG K:35 B:35 77.0 0.342 H -84.1 -65.0 65.0 0.289 0.053 J:Q92133:0.053
DA
DC
DG
DC
DC
DG
DT
DG
7.678
8.858
9.685
9.340
6.274
3.805
5.543
8.862
CD
NE
NE
NH2
NH2
NH2
NH1
NH2
OP2
OP2
O6
N4
O3'
OP2
OP2
O6
ARG O:35 F:35 98.0 0.436 H -68.2 -45.9 69.0 0.307 0.129 N:Q92133:0.129
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.510
5.113
5.407
7.757
9.851
9.142
6.740
9.148
9.245
9.475
CD
CD
NH2
NH2
NH2
NH1
NH1
NH1
CZ
NE
O3'
OP2
OP2
C5
O6
O3'
OP2
N7
N4
O6
ARG V:35 V:35 100.0 0.444 H -68.1 -46.1 71.0 0.316 0.128 U:Q92133:0.129
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.513
5.114
5.404
7.757
9.852
9.141
6.738
9.146
9.247
9.475
CD
CD
NH2
NH2
NH2
NH1
NH1
NH1
CZ
NE
O3'
OP2
OP2
C5
O6
O3'
OP2
N7
N4
O6
ARG Z:35 Z:35 75.0 0.333 H -84.2 -64.9 63.0 0.28 0.053 Y:Q92133:0.053
DA
DC
DG
DC
DC
DG
DT
DG
7.677
8.856
9.683
9.341
6.273
3.805
5.542
8.861
CD
NE
NE
NH2
NH2
NH2
NH1
NH2
OP2
OP2
O6
N4
O3'
OP2
OP2
O6
ARG DA:35 d:35 100.0 0.444 H -68.1 -46.0 70.0 0.311 0.133 CA:Q92133:0.133
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.512
5.113
5.407
7.759
9.851
9.144
6.739
9.148
9.246
9.475
CD
CD
NH2
NH2
NH2
NH1
NH1
NH1
CZ
NE
O3'
OP2
OP2
C5
O6
O3'
OP2
N7
N4
O6
5x0y 2 P62799 100.0 5e-67 EM
2017-04-19 ARG B:35 B:35 113.0 0.502 H -52.6 -48.7 105.0 0.467 0.035 A:P84233:0.036
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
DG
5.626
3.635
3.933
6.605
8.673
8.605
9.752
8.259
8.248
8.611
9.925
NH2
NH2
NH2
NH1
NH1
CB
CB
NH1
NH1
NH1
NH2
O3'
O5'
OP2
N4
O6
OP2
OP2
N4
O6
N4
N2
ARG F:35 F:35 87.0 0.387 H -51.5 -55.6 72.0 0.32 0.067 E:P84233:0.067
DA
DA
DC
DC
DC
DG
DT
DG
DC
9.686
7.631
7.744
9.337
7.813
5.650
4.414
8.213
9.504
NH1
NH1
CD
NE
NH2
NH2
NH2
NH2
NH2
O3'
OP1
OP2
N4
O3'
C2'
OP2
N7
N4
5xf6 2 P62799 100.0 5e-67 X-RAY
2017-10-11 ARG B:35 B:35 90.0 0.4 H -62.1 -38.7 76.0 0.338 0.062 A:P84233:0.062
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.753
9.327
9.640
9.868
9.594
4.658
2.378
4.144
7.866
CB
CB
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O4
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 80.0 0.356 H -65.9 -42.0 71.0 0.316 0.04 E:P84233:0.04
DG
DA
DA
DC
DC
DA
DT
DG
HOH
5.563
3.362
5.208
8.273
8.618
9.191
8.744
9.527
8.841
NH1
NH2
NH1
NH1
CB
NE
NH2
NH2
N
O3'
OP2
OP2
N4
OP2
OP2
C7
O6
O
5z3l 2 P62799 100.0 5e-67 EM
2019-04-03 ARG B:35 B:35 69.0 0.307 H -56.7 -62.0 69.0 0.307 0.0 DC
DC
DC
DG
DC
DA
DA
DA
DC
DG
9.032
5.264
3.049
6.496
8.710
9.635
7.376
8.615
9.636
9.873
NH2
NH2
NH1
NH1
NH1
CB
CB
CB
NH1
NH1
O3'
C3'
OP2
OP2
N4
C3'
OP2
OP2
N4
O6
ARG F:35 F:35 95.0 0.422 H -65.5 -46.8 95.0 0.422 0.0 DA
DA
DC
DC
DG
DT
DG
DC
9.297
6.978
8.813
6.924
4.616
5.220
8.607
9.610
NH2
NH2
NE
CD
CD
NH1
NH2
NH2
C2'
OP2
OP2
O3'
OP2
OP2
N7
N4
5z3o 2 P62799 100.0 5e-67 EM
2019-04-03 ARG B:35 B:35 69.0 0.307 H -55.3 -63.2 69.0 0.307 0.0 DC
DC
DC
DG
DC
DA
DA
DG
9.251
5.479
3.307
6.326
8.465
7.656
8.709
9.832
NH2
NH2
NH2
NH1
NH1
CB
CB
NH1
O3'
C3'
OP2
OP2
N4
OP2
OP2
O6
ARG F:35 F:35 98.0 0.436 H -65.4 -45.8 84.0 0.373 0.063 E:P84233:0.062
DA
DA
DC
DG
DC
DG
DT
DG
DC
9.211
6.906
8.692
9.801
7.348
5.079
5.535
8.648
9.201
NH2
NH2
NE
NH2
CD
CD
NH1
NH2
NH2
C2'
OP2
OP2
O6
O3'
OP2
OP2
N7
N4
5z3u 3 P62799 100.0 5e-67 EM
2019-05-22 ARG C:35 B:35 106.0 0.471 H -58.9 -34.3 99.0 0.44 0.031 B:P84233:0.031
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
DG
6.391
4.342
4.928
6.343
8.850
8.506
8.259
7.801
7.547
9.349
10.000
NH2
NH2
NH2
NH2
NH1
CB
NH1
NH1
NH1
NH1
NH2
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
N1
ARG G:35 F:35 97.0 0.431 H -64.9 -36.3 82.0 0.364 0.067 F:P84233:0.067
DA
DC
DG
DC
DC
DG
DT
DG
DC
7.868
8.358
9.274
9.181
6.621
4.601
4.797
8.321
9.326
NH1
CD
NH1
NH1
NH2
NE
NH2
NH1
NH1
OP2
OP2
O6
N4
O3'
OP2
OP2
O6
N4
5z3v 3 P62799 100.0 5e-67 EM
2019-05-22 ARG C:35 B:35 126.0 0.56 H -57.0 -43.5 107.0 0.476 0.084 B:P84233:0.084
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.737
4.273
3.747
6.158
8.597
8.289
8.860
7.906
7.666
9.221
NH2
NH2
NH2
NH1
NH1
CB
CB
NH1
NH1
NH1
O3'
C2'
OP2
N4
O6
OP2
OP2
N4
O6
N4
ARG G:35 F:35 128.0 0.569 H -57.0 -44.7 106.0 0.471 0.098 F:P84233:0.098
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
7.831
8.359
8.188
8.024
9.574
7.225
4.593
4.176
6.895
8.254
CD
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
C5
O6
N4
N6
O3'
C2'
OP2
O6
N4
6esf 2 P62799 100.0 5e-67 EM
2017-12-20 ARG B:35 B:35 89.0 0.396 H -61.6 -39.6 80.0 0.356 0.04 A:P84233:0.04
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
9.456
7.158
8.234
8.554
9.848
7.176
4.753
4.433
7.676
9.486
NH1
NH1
CD
NH1
NH1
NE
NE
NH2
NH2
NH1
C2'
OP2
OP2
N4
O6
O3'
OP2
OP2
C5
O6
ARG F:35 F:35 100.0 0.444 H -59.5 -43.3 81.0 0.36 0.084 E:P84233:0.084
DC
DG
DT
DG
DC
DA
DA
DC
DG
6.752
4.355
4.635
8.319
9.356
9.630
7.414
8.404
9.005
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N7
N4
C2'
OP2
OP2
O6
6esg 2 P62799 100.0 5e-67 EM
2017-12-20 ARG B:35 B:35 88.0 0.391 H -65.1 -37.2 88.0 0.391 0.0 DA
DA
DC
DG
DC
DG
DG
DC
DC
DC
DG
DC
DG
8.689
7.557
7.562
8.633
9.786
9.639
9.261
8.857
4.439
2.451
6.233
7.962
8.453
NH1
CD
NH1
NH1
NH2
NH2
NH2
NE
NH2
NH2
NH2
NH2
NH1
C2'
OP2
N4
O6
N4
N1
N2
O3'
C2'
OP2
OP2
N4
O6
ARG F:35 F:35 99.0 0.44 H -66.5 -39.9 90.0 0.4 0.04 E:P84233:0.04
DC
DG
DT
DG
DC
DA
DC
DG
DC
5.664
3.384
3.641
8.829
9.316
8.281
8.990
9.310
9.468
NH2
NE
NH2
NH1
NH1
CB
CD
NH1
CD
O3'
OP2
OP2
O6
N4
OP2
OP2
O6
N4
6esh 2 P62799 100.0 5e-67 EM
2017-12-20 ARG B:35 B:35 108.0 0.48 H -63.6 -30.0 97.0 0.431 0.049 A:P84233:0.049
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
9.234
6.748
8.514
8.454
9.164
7.065
4.631
4.984
7.601
9.244
NH1
NH1
CD
NH1
NH1
NE
NE
NH2
NH2
NH1
O3'
OP2
OP2
N4
O6
O3'
OP2
OP2
N4
O6
ARG F:35 F:35 105.0 0.467 H -61.4 -42.6 89.0 0.396 0.071 E:P84233:0.071
DC
DG
DT
DG
DC
DA
DC
DG
DC
6.770
4.266
2.494
7.222
8.954
7.884
8.687
9.137
9.658
NE
NH2
NH2
NH2
NH1
NH1
CD
NH1
NE
O3'
C3'
OP2
OP2
N4
OP2
OP2
O6
N4
6esi 2 P62799 100.0 5e-67 EM
2017-12-20 ARG B:35 B:35 47.0 0.209 H -65.8 -30.9 47.0 0.209 0.0 DA
DA
DA
DC
DC
DG
DC
8.678
6.866
8.318
6.584
4.152
2.411
8.213
N
N
CD
NE
NE
NH2
NH1
C3'
OP2
OP2
O3'
OP1
OP2
OP2
ARG F:35 F:35 114.0 0.507 H -66.8 -37.9 77.0 0.342 0.165 E:P84233:0.164
DC
DG
DT
DG
DC
DG
DA
DA
DC
DG
DC
5.375
3.365
2.732
8.153
8.659
9.790
9.453
7.172
7.958
8.563
9.671
CG
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH1
CZ
NE
O3'
O5'
OP2
OP2
N4
O6
C2'
OP2
N4
O6
N4
6fml 10 P62805 100.0 5e-67 EM
2018-04-25 ARG N:35 N:35 87.0 0.387 H -58.0 -46.8 62.0 0.276 0.111 M:Q71DI3:0.111
DC
DG
DT
DG
DC
DA
DA
DC
DG
DC
7.226
4.917
4.856
8.171
9.498
9.475
6.963
8.459
9.404
9.419
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
NE
O3'
OP2
OP2
N7
N4
O3'
OP2
OP2
O6
N4
ARG R:35 R:35 82.0 0.364 H -58.5 -43.5 73.0 0.324 0.04 Q:Q71DI3:0.04
DA
DA
DC
DG
DC
DC
DC
DG
DC
8.219
8.604
9.711
9.288
9.747
5.152
2.857
4.451
7.741
CB
CD
CD
NH1
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
O3'
O3'
OP2
OP2
N4
6iro 3 P62799 100.0 5e-67 EM
2019-04-03 ARG C:35 B:35 77.0 0.342 H -59.6 -49.6 77.0 0.342 0.0 DC
DC
DC
DG
DC
DA
DA
DC
DG
9.987
5.947
3.471
6.086
8.189
8.019
9.163
9.532
9.267
NH2
NH2
NH2
NH1
NH1
CB
CB
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG G:35 F:35 107.0 0.476 H -79.8 -36.8 104.0 0.462 0.014 F:A0A310TTQ1:0.013
DA
DA
DC
DG
DC
DC
DG
DT
DG
DC
9.687
7.425
8.232
8.621
9.877
7.127
4.741
5.193
8.198
8.592
NH2
NH2
NH2
NH2
NH2
CD
CD
NH1
NH2
NH2
C2'
OP2
C5
O6
N4
O3'
OP2
OP2
N7
N4
6jyl 2 P62799 100.0 5e-67 EM
2019-05-29 ARG B:35 B:35 103.0 0.458 H -68.2 -33.5 92.0 0.409 0.049 A:A0A310TTQ1:0.049
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.566
4.503
4.167
6.947
9.106
8.450
8.953
8.274
8.536
9.532
NH2
CZ
NH2
NH1
NH1
CB
CD
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
ARG F:35 F:35 104.0 0.462 H -70.4 -32.2 96.0 0.427 0.035 E:A0A310TTQ1:0.036
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.585
8.989
9.010
8.582
9.294
6.225
4.232
4.522
7.665
9.444
CB
CD
NH1
NH1
NH1
NH2
CZ
NH1
NH1
NH1
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
N4
6k1p 2 P62799 100.0 5e-67 EM
2019-05-29 ARG B:35 B:35 99.0 0.44 H -71.2 -30.9 92.0 0.409 0.031 A:A0A310TTQ1:0.031
DC
DC
DG
DC
DG
DA
DA
DC
DG
6.738
4.712
4.598
7.491
9.054
8.615
8.858
8.284
8.774
NH2
NH2
NH2
NH1
NH1
CB
CD
NH1
NH1
O3'
O5'
OP2
N4
O6
OP2
OP2
N4
O6
ARG F:35 F:35 100.0 0.444 H -73.0 -30.2 95.0 0.422 0.022 E:A0A310TTQ1:0.022
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.614
8.970
8.899
8.342
9.295
6.150
4.010
4.939
7.656
9.493
CB
NH1
NH1
NH1
NH1
NH2
NH2
NH1
NH1
NH1
OP2
C5
O6
N4
N6
O3'
OP2
C7
O6
N4
6kiu 2 P62799 100.0 5e-67 EM
2019-09-11 ARG B:35 B:35 91.0 0.404 H -65.6 -41.7 86.0 0.382 0.022 A:A0A310TTQ1:0.022
DA
DC
DC
DC
DG
DT
DG
8.750
9.722
9.501
6.154
3.736
6.540
9.452
CB
NE
NH2
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
OP2
C7
O6
ARG F:35 F:35 82.0 0.364 H -66.5 -37.4 78.0 0.347 0.017 E:A0A310TTQ1:0.018
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.800
5.840
3.509
6.506
9.366
8.679
9.470
9.952
9.946
NH2
NH1
NH1
NH1
NE
CB
NE
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6kiv 2 P62799 100.0 5e-67 EM
2019-09-11 ARG B:35 B:35 105.0 0.467 H -59.4 -38.5 101.0 0.449 0.018 A:A0A310TTQ1:0.018
DA
DC
DG
DC
DA
DC
DG
DT
DG
9.199
8.767
9.889
8.683
9.291
5.613
3.215
5.629
8.549
CB
NE
NH2
NH2
NH2
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
ARG F:35 F:35 85.0 0.378 H -66.8 -34.2 82.0 0.364 0.014 E:A0A310TTQ1:0.013
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.539
5.655
3.425
6.871
8.652
8.642
8.798
9.686
9.698
NH2
NH1
NH1
NH1
NH2
CB
NE
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6kiw 2 P62799 100.0 5e-67 EM
2019-09-11 ARG B:35 B:35 110.0 0.489 H -64.2 -40.5 108.0 0.48 0.009 A:A0A310TTQ1:0.009
DA
DC
DG
DC
DG
DT
DG
8.842
9.694
9.866
5.863
3.391
4.656
8.329
CB
CD
NE
NH1
NH2
NH2
NH2
OP2
OP2
O6
O3'
C5'
C7
N7
ARG F:35 F:35 87.0 0.387 H -64.9 -38.9 86.0 0.382 0.005 E:A0A310TTQ1:0.004
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.786
5.599
3.323
6.330
8.908
8.395
9.321
9.430
9.475
NH2
NH1
NH1
NH1
NH2
CB
NE
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6kix 2 P62799 100.0 5e-67 EM
2019-09-11 ARG B:35 B:35 90.0 0.4 H -65.2 -39.6 85.0 0.378 0.022 A:A0A310TTQ1:0.022
DA
DC
DC
DC
DG
DT
DG
9.104
9.495
9.560
5.329
2.978
6.422
9.477
CB
NE
NH2
NH1
NH1
NH1
NH2
OP2
OP2
N4
O3'
OP2
C7
O6
ARG F:35 F:35 84.0 0.373 H -66.0 -41.7 81.0 0.36 0.013 E:A0A310TTQ1:0.013
DC
DC
DC
DG
DC
DA
DA
DC
9.881
5.725
3.385
6.699
9.608
8.903
9.432
9.973
NH2
NH1
NH1
NH1
NE
CB
NE
NE
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
6kiz 2 P62799 100.0 5e-67 EM
2019-09-11 ARG B:35 B:35 84.0 0.373 H -62.2 -42.9 77.0 0.342 0.031 A:A0A310TTQ1:0.031
DA
DC
DC
DC
DG
DT
DG
9.447
9.477
9.222
5.932
3.793
6.590
9.564
CB
NE
NH2
NH1
NH1
NH1
NH2
OP2
OP2
N4
O3'
OP2
C7
O6
ARG F:35 F:35 93.0 0.413 H -60.2 -44.7 88.0 0.391 0.022 E:A0A310TTQ1:0.022
DC
DC
DG
DC
DA
DA
DC
DG
6.244
3.863
6.711
8.947
8.546
9.065
9.463
9.488
NH1
NH1
NH1
NH2
CD
NE
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6nj9 2 P62799 100.0 5e-67 EM
2019-02-20 ARG B:35 B:35 78.0 0.347 H -77.4 -32.9 72.0 0.32 0.027 A:P84233:0.027
DC
DC
DC
DG
DC
DA
DA
DG
9.577
5.483
3.099
5.513
8.938
8.346
9.599
9.977
NH2
NH2
NH2
NH1
NH1
CD
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
O6
ARG F:35 F:35 77.0 0.342 H -77.3 -33.0 72.0 0.32 0.022 E:P84233:0.022
DA
DC
DC
DA
DC
DG
DT
DG
8.352
9.693
9.881
9.546
5.500
3.130
5.623
9.521
CD
NE
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
N4
O3'
O3'
OP2
OP2
O6
6nn6 2 P62799 100.0 5e-67 EM
2019-02-13 ARG B:35 B:35 89.0 0.396 H -62.2 -36.6 81.0 0.36 0.036 A:P84233:0.036
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.681
8.391
9.626
8.345
9.802
5.993
3.501
6.154
8.716
CD
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH2
OP2
OP2
N7
N4
N6
O3'
OP2
C7
O6
ARG F:35 F:35 101.0 0.449 H -72.0 -22.3 90.0 0.4 0.049 E:P84233:0.049
DC
DC
DG
DC
DG
DA
DA
DC
DG
6.707
4.371
5.044
8.149
9.415
7.949
9.221
8.914
9.091
NH2
NE
NH2
NH1
NH1
NH1
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP2
N7
N4
O6
6nog 2 P62799 100.0 5e-67 EM
2019-02-20 ARG C:35 B:35 89.0 0.396 H -62.1 -41.6 86.0 0.382 0.014 A:P84233:0.013
DC
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
9.994
6.160
3.697
5.883
7.332
9.484
9.247
9.388
8.369
8.853
9.920
NH2
NH2
NH2
NH1
NH1
NH1
CB
NH1
NH1
NH2
NH2
O3'
O3'
OP2
OP2
N4
O6
OP2
N7
N4
O6
N4
ARG D:35 F:35 86.0 0.382 H -62.2 -40.6 78.0 0.347 0.035 B:P84233:0.036
DA
DG
DC
DA
DC
DG
DT
DG
9.113
9.600
8.643
9.705
5.329
3.321
5.188
8.147
CB
NH2
NH2
NH2
NH1
NH2
NH2
NH2
OP2
O6
N4
N6
O3'
OP2
C7
O6
6nqa 3 P62799 100.0 5e-67 EM
2019-02-20 ARG C:35 F:35 86.0 0.382 H -67.2 -40.6 81.0 0.36 0.022 H:P84233:0.022
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
5.394
3.041
6.573
7.243
9.713
8.516
9.233
8.018
7.801
9.452
NH1
NH1
NH1
NH2
NH2
CB
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N4
O6
OP2
N7
N4
O6
N4
ARG L:35 B:35 85.0 0.378 H -64.5 -39.5 79.0 0.351 0.027 I:P84233:0.027
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.832
9.709
9.164
8.051
9.412
5.268
3.009
5.172
7.888
9.977
CB
NH2
NH2
NH2
NH2
NH1
NH1
NH2
NH2
NH2
OP2
C5
O6
N4
N6
O3'
OP2
C7
O6
N4
6r1u 2 P62799 100.0 5e-67 EM
2019-04-24 ARG B:35 B:35 87.0 0.387 H -61.5 -39.6 78.0 0.347 0.04 A:P84233:0.04
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
9.456
7.157
8.234
8.554
9.848
7.176
4.754
4.432
7.676
9.486
NH1
NH1
CD
NH1
NH1
NE
NE
NH2
NH2
NH1
C2'
OP2
OP2
N4
O6
O3'
OP2
OP2
C5
O6
ARG F:35 F:35 103.0 0.458 H -59.4 -43.2 84.0 0.373 0.085 E:P84233:0.084
DC
DG
DT
DG
DC
DA
DA
DC
DG
6.752
4.355
4.634
8.319
9.356
9.630
7.415
8.405
9.004
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N7
N4
C2'
OP2
OP2
O6
6r25 5 ? 100.0 5e-67 EM
2019-04-24 ARG E:35 B:35 86.0 0.382 H -61.5 -39.6 76.0 0.338 0.044 D:A0A310TTQ1:0.044
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
9.456
7.158
8.234
8.554
9.848
7.176
4.754
4.432
7.676
9.486
NH1
NH1
CD
NH1
NH1
NE
NE
NH2
NH2
NH1
C2'
OP2
OP2
N4
O6
O3'
OP2
OP2
C5
O6
ARG I:35 F:35 99.0 0.44 H -59.4 -43.3 80.0 0.356 0.084 H:A0A310TTQ1:0.084
DC
DG
DT
DG
DC
DA
DA
DC
DG
6.752
4.355
4.634
8.319
9.356
9.631
7.415
8.404
9.006
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N7
N4
C2'
OP2
OP2
O6
6s01 2 P62799 100.0 5e-67 EM
2019-12-18 ARG B:35 B:35 85.0 0.378 H -68.9 -34.4 73.0 0.324 0.054 A:A0A310TTQ1:0.053
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.471
9.276
9.494
8.865
9.180
5.317
3.062
6.026
8.716
CB
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
ARG F:35 F:35 79.0 0.351 H -67.7 -34.4 67.0 0.298 0.053 E:A0A310TTQ1:0.053
DC
DC
DG
DC
DA
DA
DC
DG
5.670
3.448
6.169
8.693
8.330
9.206
9.331
8.984
NH1
NH1
NH1
NH2
CD
NE
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6t9l 2 P62799 100.0 5e-67 EM
2020-01-29 ARG B:35 B:35 89.0 0.396 H -61.4 -47.4 79.0 0.351 0.045 A:P84233:0.044
DA
DC
DG
DC
DA
DC
DG
DT
DG
7.987
8.910
9.760
9.044
9.869
6.295
3.940
5.620
8.724
CB
NE
NH2
NH2
NH2
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
ARG F:35 F:35 96.0 0.427 H -64.5 -41.1 78.0 0.347 0.08 E:P84233:0.08
DC
DC
DG
DC
DA
DA
DC
5.900
3.758
4.719
8.640
8.364
8.740
9.756
NH2
NH2
NH2
NH2
CB
CD
CD
O3'
OP2
OP2
N4
OP2
OP2
N4
6tda 2 P62799 100.0 5e-67 EM
2020-03-18 ARG B:35 B:35 109.0 0.484 H -63.8 -44.8 109.0 0.484 0.0 DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
DG
DG
5.035
2.864
3.864
6.969
9.402
8.247
9.579
8.471
8.365
9.674
9.910
9.184
NH2
NH2
NH2
NH1
NH1
CB
NH1
NH1
NH1
NH1
NH2
NH2
O3'
O5'
OP2
N4
O6
OP2
N7
N4
O6
N4
N2
N2
ARG F:35 F:35 82.0 0.364 H -65.8 -41.9 82.0 0.364 0.0 DA
DC
DA
DC
DG
DT
DG
8.296
9.037
9.498
4.983
2.712
5.336
9.457
CB
CD
NH1
NH1
NH1
NH2
NH2
OP2
OP2
O3'
O3'
OP2
OP2
N7
6ugm 2 P62799 100.0 5e-67 EM
2019-11-20 ARG B:35 B:35 78.0 0.347 H -80.6 -19.9 78.0 0.347 0.0 DC
DC
DC
DG
DC
DA
DA
DC
DG
9.694
4.849
2.542
6.108
8.294
8.114
9.408
9.630
9.251
NH2
NH2
NH2
NH2
NH1
CG
CD
NH1
NH1
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:35 F:35 100.0 0.444 H -73.3 -37.3 78.0 0.347 0.097 E:Q92133:0.098
DA
DC
DC
DG
DT
DG
8.017
9.305
5.678
3.485
4.552
8.577
CB
CD
NH1
NH1
NH2
NH2
OP2
OP2
O3'
OP2
OP2
N7
6uh5 2 P62799 100.0 5e-67 EM
2019-11-20 ARG B:35 B:35 72.0 0.32 H -78.2 -24.6 72.0 0.32 0.0 DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
9.919
4.923
2.753
5.544
8.423
7.902
8.915
9.586
9.248
9.807
NH2
NH2
NH2
NH2
NH1
CG
CD
NH1
NH1
NH1
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG F:35 F:35 74.0 0.329 H -78.4 -49.7 60.0 0.267 0.062 E:Q92133:0.062
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.238
8.914
9.780
9.417
9.430
5.542
3.399
6.142
9.137
CD
NE
NE
NH2
NH2
NH1
NH1
NH1
NH2
OP2
OP2
O6
N4
O3'
O3'
OP2
OP2
O6
6uxw 2 P62799 100.0 5e-67 EM
2020-03-18 ARG B:35 S:35 126.0 0.56 H -56.9 -43.5 108.0 0.48 0.08 A:P84233:0.08
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.738
4.272
3.747
6.158
8.597
8.289
8.859
7.906
7.665
9.221
NH2
NH2
NH2
NH1
NH1
CB
CB
NH1
NH1
NH1
O3'
C2'
OP2
N4
O6
OP2
OP2
N4
O6
N4
ARG F:35 W:35 128.0 0.569 H -57.0 -44.8 107.0 0.476 0.093 E:P84233:0.093
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
7.831
8.359
8.188
8.023
9.574
7.224
4.593
4.177
6.893
8.253
CD
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
C5
O6
N4
N6
O3'
C2'
OP2
O6
N4
6ven 2 P62799 100.0 5e-67 EM
2020-01-15 ARG B:35 B:35 89.0 0.396 H -59.4 -44.0 81.0 0.36 0.036 A:P84233:0.036
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
6.551
4.456
5.000
7.256
9.463
8.369
8.652
8.116
8.392
9.642
NH2
NH2
NH2
NH1
NH1
CB
CG
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
ARG F:35 F:35 80.0 0.356 H -60.0 -45.9 72.0 0.32 0.036 E:P84233:0.036
DA
DC
DC
DA
DA
DC
DG
DT
DG
8.262
9.155
9.153
9.761
9.577
5.394
3.395
5.861
9.075
CB
NE
NH2
NH2
NH2
NH1
NH1
NH2
NH2
OP2
OP2
N4
N6
O3'
O3'
OP2
C7
O6
6vyp 2 P62799 100.0 5e-67 X-RAY
2020-05-27 ARG B:35 B:35 113.0 0.502 H -74.0 -42.7 101.0 0.449 0.053 A:A0A310TTQ1:0.053
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
DC
8.247
9.228
9.467
8.852
9.188
9.886
5.380
2.905
4.397
8.120
9.949
CD
CB
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NE
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
N4
ARG F:35 F:35 105.0 0.467 H -74.7 -42.0 94.0 0.418 0.049 E:A0A310TTQ1:0.049
DC
DC
DG
DC
DA
DA
DC
DG
DC
5.313
2.964
5.133
7.497
8.022
9.256
9.054
8.448
9.639
NH2
NH2
NH1
NH2
CB
N
NH2
NH2
NH2
C3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG L:35 b:35 86.0 0.382 H -62.7 -42.5 NA NA NA
ARG P:35 f:35 102.0 0.453 H -73.8 -41.3 NA NA NA
6wz5 2 P62799 100.0 5e-67 EM
2020-09-16 ARG B:35 B:35 78.0 0.347 H -64.6 -39.4 70.0 0.311 0.036 A:P84233:0.036
DA
DA
DC
DG
DC
DC
DC
DG
DC
8.281
8.536
9.416
9.543
9.401
4.976
2.712
4.711
7.868
CB
CD
NE
NE
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 84.0 0.373 H -63.8 -40.7 73.0 0.324 0.049 E:P84233:0.049
DA
DC
DG
DT
DG
DA
DC
DG
DC
9.295
5.103
2.817
4.615
8.650
8.305
8.641
9.975
9.641
NH1
NH1
NH1
NH2
NH2
CB
CD
NE
CZ
O3'
O3'
OP2
OP2
N7
OP2
OP2
O6
N4
6wz9 2 P62799 100.0 5e-67 EM
2020-09-16 ARG B:35 B:35 88.0 0.391 H -64.8 -39.3 73.0 0.324 0.067 A:P84233:0.067
DA
DA
DC
DG
DC
DC
DC
DG
DC
8.342
8.520
9.425
9.731
9.399
5.015
2.739
4.940
8.156
CB
CD
NE
CZ
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 75.0 0.333 H -63.5 -40.8 69.0 0.307 0.026 E:P84233:0.027
DA
DC
DG
DT
DG
DA
DC
DG
DC
9.182
5.006
2.713
4.723
8.530
8.334
8.808
9.890
9.684
NH1
NH1
NH1
NH2
NH2
CB
CD
NE
CZ
O3'
O3'
OP2
OP2
N7
OP2
OP2
O6
N4
6x0n 2 P62799 100.0 5e-67 EM
2020-09-16 ARG B:35 B:35 79.0 0.351 H -64.8 -38.9 65.0 0.289 0.062 A:P84233:0.062
DA
DA
DC
DG
DG
DC
DC
DC
DG
DC
8.566
8.587
9.580
9.502
9.959
8.930
5.125
2.879
5.555
7.844
CB
CD
NE
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
N2
O3'
O3'
OP2
OP2
N4
ARG F:35 F:35 80.0 0.356 H -64.7 -40.3 66.0 0.293 0.063 E:P84233:0.062
DA
DC
DG
DT
DG
DA
8.849
5.257
3.062
5.776
9.385
9.049
NH1
NH2
NH2
NH2
NH2
CB
O3'
O3'
OP2
C7
O6
OP2
ARG L:35 b:35 96.0 0.427 H -65.7 -38.7 75.0 0.333 0.094 K:P84233:0.093
DA
DA
DC
DG
DC
DC
DC
DG
DC
8.422
8.806
9.843
9.641
9.419
5.293
3.209
5.228
8.043
CB
CD
NE
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
O3'
O3'
OP2
OP2
N4
ARG P:35 f:35 76.0 0.338 H -63.8 -40.6 63.0 0.28 0.058 O:P84233:0.058
DA
DC
DG
DT
DG
DC
DA
DC
DG
DC
DA
8.854
4.736
2.535
4.617
8.430
9.918
8.707
9.282
9.972
9.477
9.578
NH1
NH1
NH1
NH2
NH2
NE
CB
CD
NE
CZ
NH2
O3'
O3'
OP2
C7
O6
N4
OP2
OP2
O6
N4
N6
6x59 2 P62805 100.0 5e-67 EM
2020-09-16 ARG B:35 B:35 89.0 0.396 H -63.1 -37.5 79.0 0.351 0.045 A:Q71DI3:0.044
DA
DC
DC
DA
DC
DG
DT
DG
8.511
8.858
9.937
9.901
5.422
3.045
4.813
8.928
CD
CD
CZ
NH2
NH2
NH2
NH1
NH1
OP2
OP2
N4
O3'
O3'
OP2
OP2
N7
ARG F:35 F:35 97.0 0.431 H -64.9 -37.0 83.0 0.369 0.062 E:Q71DI3:0.062
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.901
5.259
2.879
4.519
7.726
8.369
8.969
9.375
9.387
NH1
NH1
NH1
NH2
NH2
CB
CD
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6x5a 2 P62805 100.0 5e-67 EM
2020-09-16 ARG B:35 B:35 97.0 0.431 H -63.1 -37.0 86.0 0.382 0.049 A:Q71DI3:0.049
DA
DC
DG
DC
DA
DC
DG
DT
DG
8.223
8.881
9.867
9.732
9.771
5.218
2.793
4.512
8.686
CD
CD
NE
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
O6
N4
O3'
O3'
OP2
OP2
N7
ARG F:35 F:35 97.0 0.431 H -65.4 -38.0 85.0 0.378 0.053 E:Q71DI3:0.053
DC
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
9.399
4.961
2.510
4.862
7.346
9.840
7.903
8.892
9.023
8.769
9.748
NH1
NH1
NH1
NH2
NH2
NH2
CB
CD
NE
NH2
NH2
O3'
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
6xjd 2 P62805 100.0 5e-67 EM
2020-09-16 ARG B:35 B:35 99.0 0.44 H -67.7 -46.9 99.0 0.44 0.0 DA
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
DC
9.583
7.435
7.832
9.388
8.858
9.105
8.012
4.702
2.424
4.490
8.043
9.769
N
N
CD
NE
CZ
NH1
NH2
NH2
NH2
NH1
NH1
NH1
O3'
OP2
OP2
O6
N4
N6
O3'
C2'
OP2
C7
O6
N4
ARG F:35 F:35 101.0 0.449 H -67.1 -50.2 101.0 0.449 0.0 DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
DG
8.173
4.008
2.599
5.980
8.186
8.118
7.846
8.903
9.311
9.638
9.962
NH1
NH1
NH1
NH2
NH2
CB
CD
NE
NH2
NH2
NH2
O3'
C2'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
N2
7a08 7 P62805 100.0 5e-67 EM
2020-09-23 ARG G:35 e:35 64.0 0.284 H -67.5 -37.4 64.0 0.284 0.0 DA
DC
DC
DG
DT
8.842
9.204
4.695
2.535
5.070
CB
CD
NH2
NH2
NH1
OP2
OP2
O3'
OP1
OP2
ARG K:35 i:35 98.0 0.436 H -64.8 -39.0 84.0 0.373 0.063 F:P84243:0.062
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
5.905
3.474
3.905
6.944
9.542
8.688
9.248
8.482
8.520
9.663
NH1
NH1
NH2
NH1
NH1
N
CD
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP1
OP2
N4
O6
N4
7at8 4 P62799 100.0 5e-67 EM
2020-12-09 ARG D:35 E:35 85.0 0.378 H -61.3 -47.0 85.0 0.378 0.0 DA
DA
DC
DG
DC
DA
DC
DG
DT
DG
9.720
7.388
8.458
9.554
8.887
9.868
6.018
3.706
5.773
8.671
CB
CD
NE
NH2
NH2
NH2
NH1
NH1
NH2
NH2
O3'
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
ARG H:35 I:35 96.0 0.427 H -61.3 -46.9 87.0 0.387 0.04 G:P84233:0.04
DC
DC
DG
DC
DA
DA
DC
DG
DG
5.428
3.118
5.052
7.668
8.162
8.191
9.065
9.161
9.977
NH2
NH2
NH2
NH2
CB
CD
NE
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N2
7bwd 2 P62805 100.0 5e-67 EM
2021-04-14 ARG B:35 F:35 101.0 0.449 H -63.2 -33.0 98.0 0.436 0.013 E:P68431:0.013
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.959
9.342
8.556
9.220
9.607
5.715
3.532
6.091
8.438
9.785
CB
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
OP2
O6
N4
ARG I:35 B:35 95.0 0.422 H -65.3 -39.8 94.0 0.418 0.004 F:P68431:0.004
DC
DC
DG
DC
DA
DA
DC
DG
DC
5.515
3.322
6.411
8.369
8.548
9.428
9.439
9.425
9.746
NH1
NH2
NH1
NH1
CD
CB
NE
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
7ciz 2 P62805 100.0 5e-67 X-RAY
2021-04-14 ARG B:35 B:35 83.0 0.369 H -65.6 -39.9 32.0 0.142 0.227 C:P49736:0.227
SO4
SO4
HOH
6.751
2.476
3.559
NH2
NH2
NH2
O4
O1
O
ARG E:35 F:35 89.0 0.396 H -61.1 -41.4 NA NA NA
ARG H:35 J:35 87.0 0.387 H -58.8 -43.5 NA NA NA
7cj0 2 P62805 100.0 5e-67 X-RAY
2021-04-14 ARG B:35 F:35 98.0 0.436 H -66.3 -42.4 55.0 0.244 0.192 C:P49736:0.191
HOH
2.707
NH1
O
ARG F:35 C:35 96.0 0.427 H -64.6 -41.2 NA NA NA
7cro 2 P62799 100.0 5e-67 EM
2020-10-21 ARG B:35 B:35 96.0 0.427 H -62.2 -34.6 91.0 0.404 0.023 A:Q92133:0.022
DC
DC
DG
DC
DA
DA
DC
DG
6.028
3.575
4.986
8.308
8.936
9.172
9.962
9.927
NH1
NH1
NH2
NH2
CB
CD
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:35 F:35 103.0 0.458 H -63.4 -31.6 99.0 0.44 0.018 E:Q92133:0.018
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.965
9.761
9.034
9.074
9.986
6.314
3.933
5.669
8.217
9.536
N
NH1
NH1
NH2
NH2
NH2
NH2
NH1
NH1
NH1
OP1
C5
O6
N4
N6
C2'
OP2
C7
O6
N4
7crp 2 P62799 100.0 5e-67 EM
2020-10-21 ARG B:35 B:35 84.0 0.373 H -64.8 -33.5 84.0 0.373 0.0 DC
DC
DG
DA
DA
5.999
3.638
5.470
8.916
8.961
NH1
NH1
NH2
CD
CD
O3'
OP2
OP2
OP2
OP2
ARG F:35 F:35 85.0 0.378 H -64.0 -33.9 83.0 0.369 0.009 E:Q92133:0.009
DA
DC
DC
DG
DT
DG
8.961
9.077
5.867
3.595
5.550
9.688
CD
CD
NH1
NH1
NH2
NH2
OP2
OP2
O3'
OP2
OP2
N7
7crq 2 P62799 100.0 5e-67 EM
2020-10-21 ARG B:35 B:35 85.0 0.378 H -63.7 -33.5 83.0 0.369 0.009 A:Q92133:0.009
DC
DC
DG
DC
DA
DA
6.033
3.694
5.336
9.435
8.923
9.104
NH1
NH1
NH2
NH2
CD
CD
O3'
OP2
OP2
N4
OP2
OP2
ARG F:35 F:35 82.0 0.364 H -64.6 -34.8 81.0 0.36 0.004 E:Q92133:0.004
DA
DC
DC
DG
DT
DG
9.003
9.182
5.794
3.534
5.328
9.846
CB
CD
NH1
NH1
NH2
NH2
OP2
OP2
O3'
OP2
OP2
O6
7crr 2 P62799 100.0 5e-67 EM
2020-10-21 ARG B:35 B:35 81.0 0.36 H -63.5 -35.5 77.0 0.342 0.018 A:Q92133:0.018
DC
DC
DC
DG
DA
DA
9.944
5.381
3.139
4.814
8.581
9.143
NH1
NH1
NH1
NH2
CB
CD
O3'
O3'
OP2
OP2
OP2
OP2
ARG F:35 F:35 85.0 0.378 H -60.5 -32.3 76.0 0.338 0.04 E:Q92133:0.04
DA
DC
DC
DG
DT
DG
8.731
9.136
5.344
3.031
4.705
9.448
CB
CD
NH1
NH1
NH2
NH2
OP2
OP2
O3'
OP2
OP2
N7
7e8d 2 P62805 100.0 5e-67 EM
2021-11-10 ARG B:35 B:35 83.0 0.369 H -64.7 -39.5 76.0 0.338 0.031 A:P68431:0.031
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.485
5.261
2.908
4.823
8.345
8.353
8.473
9.222
9.783
NH1
NH1
NH1
NH2
NH2
CD
CD
CD
NE
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
ARG F:35 F:35 85.0 0.378 H -65.3 -40.3 75.0 0.333 0.045 E:P68431:0.044
DA
DC
DC
DA
DC
DG
DT
DG
8.208
8.377
9.872
9.940
5.592
3.342
5.004
8.914
CD
CD
NE
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
OP2
N7
7e8i 4 P62799 100.0 5e-67 EM
2021-06-30 ARG D:35 B:35 84.0 0.373 H -62.8 -39.2 68.0 0.302 0.071 C:A0A310TTQ1:0.071
DA
DC
DG
DT
DG
DA
DC
9.941
4.963
2.792
4.496
8.761
8.005
8.421
NH1
NH1
NH1
NH2
NH2
CB
CD
O3'
O3'
OP2
OP2
N7
OP2
OP2
ARG H:35 F:35 83.0 0.369 H -65.0 -40.0 62.0 0.276 0.093 G:A0A310TTQ1:0.093
DA
DA
DC
DC
DC
DG
DC
7.860
8.296
9.444
6.257
4.110
3.986
8.487
NH1
CD
NH1
NH2
NE
NH2
NH1
OP2
OP2
N4
O3'
OP2
OP2
N4
7eg6 3 P62799 100.0 5e-67 EM
2022-01-12 ARG C:35 B:35 84.0 0.373 H -75.8 -22.0 77.0 0.342 0.031 B:P84233:0.031
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
5.123
2.777
5.533
7.560
9.864
7.836
8.869
8.527
8.549
9.725
NH2
NH2
NH2
NH1
NH1
CG
CD
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
ARG G:35 F:35 81.0 0.36 H -65.5 -40.0 72.0 0.32 0.04 F:P84233:0.04
DA
DC
DA
DC
DG
DT
DG
8.331
8.951
9.358
5.034
2.694
5.287
9.612
CB
CD
NH1
NH2
NH1
NH2
NE
OP2
OP2
O3'
O3'
OP2
OP2
O6
7egp 12 P62799 100.0 5e-67 EM
2022-01-12 ARG M:35 P:35 95.0 0.422 H -63.3 -39.5 88.0 0.391 0.031 L:P84233:0.031
DA
DC
DG
DC
DA
DG
DA
DC
DG
DT
DG
DC
7.633
8.716
7.968
7.493
8.725
9.586
8.949
4.799
2.336
3.454
6.704
8.079
CB
NH1
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
NH1
OP2
C5
O6
N4
N6
N2
O3'
O3'
OP2
C7
O6
N4
ARG Q:35 T:35 97.0 0.431 H -69.3 -15.9 83.0 0.369 0.062 P:P84233:0.062
DC
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
8.839
4.784
2.541
4.944
7.269
9.194
9.143
7.829
8.049
7.445
8.963
NH1
NH1
NH1
NH2
NE
NE
CB
CD
CD
CD
NH1
O3'
O3'
OP2
OP2
N4
O6
OP2
N7
N4
O6
N4
7enn 3 P62799 100.0 5e-67 EM
2021-07-14 ARG C:35 L:35 84.0 0.373 H -65.4 -37.8 73.0 0.324 0.049 B:P84233:0.049
DC
DC
DC
DG
DC
DA
DA
DC
9.632
5.298
2.930
4.679
8.527
8.559
8.488
9.920
NH1
NH1
NH1
NH2
NH2
CB
CD
CD
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
ARG G:35 F:35 84.0 0.373 H -64.0 -39.7 76.0 0.338 0.035 F:P84233:0.036
DA
DC
DC
DA
DC
DG
DT
DG
8.422
8.610
9.884
9.729
5.307
3.016
4.820
8.712
CB
CD
NE
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
C7
N7
7jzv 6 P62805 100.0 5e-67 EM
2021-02-17 ARG F:35 Q:35 96.0 0.427 H -57.5 -45.4 93.0 0.413 0.014 E:Q71DI3:0.013
DA
DA
DC
DG
DC
DC
DC
DG
DC
7.883
9.441
9.981
9.766
9.329
5.330
2.797
5.347
9.110
CB
NE
NH2
NH2
NH2
NH2
NH2
NH1
NH2
OP2
OP2
N4
O6
O3'
O3'
OP2
OP2
N4
ARG L:35 q:35 90.0 0.4 H -55.4 -45.0 90.0 0.4 0.0 DC
DG
DT
DG
DC
DA
DC
DG
DC
5.849
3.502
5.998
8.805
9.968
7.856
7.740
9.081
9.313
NH2
NH2
NH2
NH1
NH1
NH1
NH1
NH1
NH2
C3'
OP2
C7
O6
N4
OP2
OP2
O6
N4
7oh9 2 P62799 100.0 5e-67 EM
2021-07-28 ARG B:35 B:35 77.0 0.342 H -62.5 -41.1 68.0 0.302 0.04 A:P84233:0.04
DA
DC
DC
DA
DC
DG
DT
DG
8.200
8.402
9.684
9.487
4.979
2.653
4.585
8.988
CB
CD
CD
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
OP2
N7
ARG F:35 F:35 90.0 0.4 H -62.4 -42.1 76.0 0.338 0.062 E:P84233:0.062
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.628
4.983
2.669
4.367
8.086
8.101
8.376
9.262
9.779
NH1
NH1
NH1
NH2
NH2
CB
CD
CD
CZ
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
7oha 2 P62799 100.0 5e-67 EM
2021-07-28 ARG B:35 B:35 77.0 0.342 H -68.3 -37.5 66.0 0.293 0.049 A:P84233:0.049
DA
DC
DC
DA
DC
DG
DT
DG
8.060
8.287
9.645
9.888
5.302
2.962
4.750
8.733
CB
CD
NE
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
OP2
N7
ARG F:35 F:35 82.0 0.364 H -64.3 -39.7 73.0 0.324 0.04 E:P84233:0.04
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.297
4.711
2.709
4.326
7.970
8.039
8.417
9.247
9.823
NH1
NH1
NH1
NH2
NH2
CB
CD
NE
CZ
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
7ohb 2 P62799 100.0 5e-67 EM
2021-07-28 ARG B:35 B:35 93.0 0.413 H -67.3 -36.3 82.0 0.364 0.049 A:P84233:0.049
DA
DC
DC
DA
DA
DC
DG
DT
DG
8.136
8.760
9.118
9.773
9.881
4.913
2.487
4.082
8.502
CB
CD
NH1
NH1
NH1
NH1
NH1
NH2
NH1
OP2
OP2
N4
N6
O3'
O3'
OP2
OP2
O6
ARG F:35 F:35 87.0 0.387 H -66.8 -36.3 77.0 0.342 0.045 E:P84233:0.044
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.260
4.889
2.508
4.891
8.468
8.014
8.519
9.244
9.914
NH1
NH1
NH1
NH2
NE
CB
CD
CD
NH1
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
7ohc 2 P62799 100.0 5e-67 EM
2021-07-28 ARG B:35 B:35 77.0 0.342 H -68.8 -37.1 64.0 0.284 0.058 A:P84233:0.058
DA
DC
DC
DA
DC
DG
DT
DG
8.169
8.391
9.799
9.960
5.322
3.086
4.784
9.035
CB
CD
NE
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
OP2
N7
ARG F:35 F:35 81.0 0.36 H -64.8 -38.6 67.0 0.298 0.062 E:P84233:0.062
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.683
5.077
2.804
5.020
8.061
8.175
8.308
9.161
9.677
NH1
NH1
NH1
NH2
NH2
CB
CD
NE
NE
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
1p3p 3 P62799 99.02 7e-67 X-RAY
2004-02-24 ARG D:35 B:35 83.0 0.369 H -69.3 -41.1 73.0 0.324 0.045 C:Q7ZT64:0.044
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.686
9.154
8.365
8.846
9.480
5.509
3.278
5.191
8.024
2.741
CB
NE
NH2
NH2
NH2
NH1
NH2
NH1
NH2
NE
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:235 76.0 0.338 H -66.8 -42.7 66.0 0.293 0.045 G:Q7ZT64:0.044
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
HOH
5.954
3.748
6.466
7.941
9.835
8.375
8.248
8.824
8.323
9.831
2.520
NH1
NH1
NH1
NH2
NE
CB
NE
NH2
NH2
NH2
NE
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O4
O
6dzt 2 P84040 98.06 7e-67 EM
2019-05-22 ARG B:37 B:35 80.0 0.356 H -68.9 -34.0 75.0 0.333 0.023 A:P02299:0.022
DA
DA
DC
DG
DC
DC
DC
DG
DC
8.150
8.660
9.482
9.889
9.442
5.007
2.683
4.739
8.529
CB
CD
CD
CZ
NH1
NH1
NH1
NH2
NH2
OP2
OP2
N4
O6
O3'
O3'
OP2
OP2
N4
ARG F:37 F:35 88.0 0.391 H -69.1 -34.6 82.0 0.364 0.027 E:P02299:0.027
DA
DC
DG
DT
DG
DA
DC
DG
DC
9.544
5.094
2.770
4.632
8.540
8.159
8.611
9.932
9.615
NH1
NH1
NH1
NH2
NH2
CB
CD
NE
CZ
O3'
O3'
OP2
OP2
N7
OP2
OP2
O6
N4
5f99 2 P62799 99.03 7e-67 X-RAY
2016-02-03 ARG B:36 B:35 77.0 0.342 H -50.3 -35.3 68.0 0.302 0.04 A:P84233:0.04
DC
DG
DA
DC
DG
DA
HOH
8.657
9.233
4.733
2.439
4.612
9.113
3.170
CD
CD
NH1
NH1
NH2
NH2
CD
OP2
OP2
O3'
OP2
OP2
N7
O
ARG F:36 F:35 90.0 0.4 H -65.4 -40.7 61.0 0.271 0.129 E:P84233:0.129
DC
DT
DT
DT
DC
DC
DT
DG
DG
HOH
8.344
6.141
6.631
7.793
9.498
7.223
4.942
7.575
8.764
2.740
CD
CD
CD
CZ
NH2
NH2
NH2
NH2
NH2
CD
O3'
OP2
OP2
C7
N4
C2'
OP2
N7
O6
O
2nqb 3 P84040 98.06 7e-67 X-RAY
2007-09-11 ARG D:36 B:35 85.0 0.378 H -60.5 -43.1 71.0 0.316 0.062 C:P02299:0.062
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.669
9.435
9.235
9.716
5.016
2.678
4.661
8.561
2.480
CB
CB
NH2
NH2
NH2
NH2
NH1
NH2
NE
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG H:36 F:235 94.0 0.418 H -61.6 -46.6 83.0 0.369 0.049 G:P02299:0.049
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
4.732
2.565
4.516
7.618
9.717
8.535
8.724
9.323
9.239
3.140
NH1
NH1
NH2
NH2
NH2
CB
NE
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
2pyo 4 P84040 99.02 1e-66 X-RAY
2007-11-06 ARG D:35 B:35 79.0 0.351 H -62.7 -39.9 64.0 0.284 0.067 C:P02299:0.067
DA
DT
DG
DT
DT
DG
DA
DA
HOH
8.489
8.130
9.779
9.531
5.206
2.938
5.748
8.790
8.729
CB
NH1
NH1
NH2
NH2
NH2
NE
NH2
N
OP2
C7
O6
O4
O3'
OP2
OP2
N6
O
ARG H:35 F:35 86.0 0.382 H -59.3 -42.9 71.0 0.316 0.066 G:P02299:0.067
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
8.028
5.639
6.318
7.113
8.415
8.766
6.309
6.023
7.167
7.636
2.492
NE
NE
CD
NH2
NH2
NH1
NH1
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O
4qlc 4 P84040 99.02 1e-66 X-RAY
2015-07-22 ARG D:35 B:35 81.0 0.36 H -62.0 -30.0 62.0 0.276 0.084 C:P02299:0.084
DA
DC
DC
DG
DT
DG
8.115
9.318
5.202
3.078
4.208
8.747
N
CD
NH1
NH1
NH2
NE
OP1
OP2
O3'
OP2
OP2
O6
ARG H:35 F:35 76.0 0.338 H -59.2 -47.6 62.0 0.276 0.062 G:P02299:0.062
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.731
5.371
6.158
6.882
9.017
9.207
6.755
7.431
7.612
8.513
CD
NH1
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N4
O6
O3'
OP2
N7
N4
O6
1p3o 3 P62799 99.02 2e-66 X-RAY
2004-02-24 ARG D:35 B:35 84.0 0.373 H -64.9 -46.2 73.0 0.324 0.049 C:Q7ZT64:0.049
DC
DA
DT
DG
DT
DT
DG
DA
DA
DC
HOH
8.599
9.249
8.724
8.917
9.936
9.660
5.108
2.626
4.779
7.894
8.866
CB
CB
NH2
NH2
NH2
NH2
NH2
NH2
NH1
NH2
N
OP2
OP2
C7
O6
O4
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:235 77.0 0.342 H -70.4 -47.4 67.0 0.298 0.044 G:Q7ZT64:0.044
DC
DT
DG
DA
DA
DA
DT
DG
DT
DT
HOH
9.219
5.364
3.092
6.026
8.010
8.443
8.476
9.382
8.745
9.848
2.567
NH2
NH1
NH2
NH1
NH2
CB
NE
NH2
NH2
NH2
NE
O3'
O3'
OP2
OP2
N6
OP2
C7
O6
O4
O4
O
1p3g 3 P62799 99.02 2e-66 X-RAY
2004-02-24 ARG D:35 B:35 84.0 0.373 H -61.3 -41.3 71.0 0.316 0.057 C:Q7ZT64:0.058
DG
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
9.570
8.692
9.244
9.426
9.461
9.586
5.059
2.634
4.841
8.324
9.493
CB
CB
CB
NH2
NH2
NH2
NH2
NH2
NH1
NH2
NH2
O3'
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:235 81.0 0.36 H -63.8 -45.2 73.0 0.324 0.036 G:Q7ZT64:0.036
DC
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
HOH
9.760
5.233
2.845
6.324
7.833
9.843
8.671
8.225
8.811
8.239
9.510
2.794
NH2
NH1
NH1
NH1
NH2
NH2
CB
NE
NH2
NH2
NH2
NE
O3'
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O4
O
1p3i 3 P62799 99.02 2e-66 X-RAY
2004-02-24 ARG D:35 B:35 77.0 0.342 H -57.6 -47.6 64.0 0.284 0.058 C:Q7ZT64:0.058
DC
DA
DT
DG
DG
DA
DA
DC
DA
HOH
8.542
7.924
7.222
8.387
6.017
3.622
6.467
7.362
9.183
4.289
NE
NH2
NH2
NH2
NH1
NH1
CD
NH2
NH2
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
N6
O
ARG H:35 F:235 71.0 0.316 H -63.3 -46.3 60.0 0.267 0.049 G:Q7ZT64:0.049
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
7.019
4.423
6.320
7.501
8.626
7.582
6.136
7.559
7.994
3.034
NH1
NH1
CD
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
7v6q 3 P62805 100.0 3e-66 X-RAY
2021-12-29 ARG C:35 C:35 112.0 0.498 H -65.2 -40.2 112.0 0.498 0.0 1PE
HOH
3.449
3.028
NH1
NH2
C15
O
ARG G:35 G:35 118.0 0.524 H -64.5 -39.9 NA NA NA
1p3b 3 P62799 99.02 3e-66 X-RAY
2004-02-24 ARG D:35 B:35 81.0 0.36 H -65.9 -50.0 70.0 0.311 0.049 C:Q7ZT64:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.319
9.184
9.051
9.448
9.038
4.880
2.486
5.111
8.333
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH2
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG H:35 F:235 75.0 0.333 H -72.7 -45.0 63.0 0.28 0.053 G:Q7ZT64:0.053
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
5.707
3.512
6.665
8.157
9.884
8.504
7.858
8.756
8.253
4.068
NH1
NH1
CD
NH2
NH2
CB
NH2
NH2
NH2
NH1
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
1p3f 3 P62799 99.02 4e-66 X-RAY
2004-02-24 ARG D:35 B:35 79.0 0.351 H -61.6 -60.0 68.0 0.302 0.049 C:Q7ZT64:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.393
9.137
8.992
9.587
9.069
4.865
2.505
4.900
8.711
9.401
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
CZ
NH2
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
ARG H:35 F:235 76.0 0.338 H -81.3 -37.5 65.0 0.289 0.049 G:Q7ZT64:0.049
DT
DG
DA
DA
DC
DA
DT
DG
DT
HOH
5.761
3.477
6.256
8.352
9.990
8.451
7.594
9.073
8.550
5.889
NH1
NH1
NH1
NH2
NE
NE
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O
6muo 2 P62805 100.0 6e-62 EM
2019-07-24 ARG B:28 B:35 93.0 0.413 H -61.0 -56.9 86.0 0.382 0.031 A:P49450:0.031
DC
DA
DT
DG
DT
DG
DA
DA
DC
DA
8.610
8.682
8.134
8.354
9.654
5.902
3.738
6.620
7.383
9.233
CD
NH2
NH2
NH2
NH2
NH1
NH1
NH2
NH2
NH2
OP2
OP2
C7
O6
O4
O3'
C5'
N7
N4
N6
ARG F:28 F:35 103.0 0.458 H -60.2 -52.6 96.0 0.427 0.031 E:P49450:0.031
DA
DA
DA
DC
DT
DG
DG
DA
DG
DT
6.892
4.524
6.173
6.839
9.650
8.232
8.397
7.767
7.666
9.458
NH2
NH2
NH2
NH1
NH1
NH1
NH2
NH2
NH2
NH2
C2'
OP2
N7
N4
O4
OP2
N7
N6
O6
O4
6mup 2 P62805 100.0 6e-62 EM
2019-07-24 ARG B:28 B:35 88.0 0.391 H -62.3 -53.4 78.0 0.347 0.044 A:P49450:0.044
DC
DA
DT
DG
DG
DA
DA
DC
DA
8.304
7.646
7.802
8.636
5.833
3.348
6.364
8.305
9.811
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
C7
O6
O3'
OP2
OP2
N4
N6
ARG F:28 F:35 90.0 0.4 H -62.0 -57.3 90.0 0.4 0.0 DA
DA
DA
DC
DT
DG
DG
DA
DG
5.750
3.321
6.482
7.790
9.566
7.607
7.646
7.771
8.545
NH1
NH1
NH1
NH2
NH2
NE
NH2
NH2
NH2
O3'
OP2
OP2
N4
O4
OP2
OP2
N6
O6
7k6q 2 P62799 100.0 1e-60 EM
2021-02-10 ARG B:25 B:35 76.0 0.338 H -61.6 -44.7 64.0 0.284 0.054 A:P84233:0.053
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
8.021
9.169
9.843
9.089
9.345
9.057
5.152
2.672
5.160
8.901
CB
NE
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG F:25 F:35 88.0 0.391 H -61.6 -44.3 72.0 0.32 0.071 E:P84233:0.071
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.467
5.022
2.609
4.167
7.636
7.944
7.920
9.120
9.460
NH1
NH1
NH1
NH2
NH2
CB
CD
NE
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
7k6p 2 P62799 100.0 2e-59 EM
2021-02-10 ARG B:23 B:35 76.0 0.338 H -62.5 -43.4 63.0 0.28 0.058 A:P84233:0.058
DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
7.856
9.090
9.635
9.027
9.393
9.608
5.078
2.633
5.178
8.796
CD
NE
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
ARG F:23 F:35 90.0 0.4 H -61.2 -42.5 71.0 0.316 0.084 E:P84233:0.084
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
7.055
4.684
6.266
7.000
8.314
8.211
6.165
7.154
7.453
8.502
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N4
O6
C2'
OP2
N7
N4
O6
6iy2 2 P62799 100.0 4e-58 EM
2019-04-03 ARG B:21 B:35 73.0 0.324 H -69.7 -29.6 62.0 0.276 0.048 A:A0A310TTQ1:0.049
DC
DG
DC
DA
DC
DG
DA
8.412
8.445
9.867
5.406
3.166
4.430
9.016
CB
CD
NE
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
OP2
OP2
N7
ARG F:21 F:35 94.0 0.418 H -67.6 -32.5 71.0 0.316 0.102 E:A0A310TTQ1:0.102
DC
DT
DT
DT
DC
DC
DC
DT
DG
DG
DA
7.489
5.281
5.783
7.083
8.437
9.941
8.683
6.224
8.026
8.348
9.278
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
C7
N4
N4
O3'
OP2
N7
O6
N6
6iy3 2 P62799 100.0 4e-58 EM
2019-04-03 ARG B:21 B:35 81.0 0.36 H -67.4 -36.4 77.0 0.342 0.018 A:A0A310TTQ1:0.018
DC
DG
DC
DA
DC
DG
DA
8.663
8.814
9.682
4.793
2.526
5.017
9.066
CB
CD
CD
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
OP2
OP2
N6
ARG F:21 F:35 96.0 0.427 H -64.5 -36.2 68.0 0.302 0.125 E:A0A310TTQ1:0.124
DC
DT
DT
DT
DC
DC
DT
DG
DG
DA
7.527
5.188
5.596
7.243
9.126
8.450
5.937
8.587
9.373
9.741
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
O3'
OP2
OP2
C7
N4
C2'
OP2
N7
O6
N6
3w99 2 P62805 100.0 1e-57 X-RAY
2013-08-28 ARG B:38 B:35 84.0 0.373 H -62.6 -40.1 59.0 0.262 0.111 A:P68431:0.111
DC
DA
DT
DG
DA
DA
DC
DA
8.040
9.035
9.037
7.079
4.596
5.650
8.392
9.724
NH2
NE
NE
CD
CD
NH1
NH2
NH2
OP2
OP2
C7
O3'
OP2
OP2
C5
N6
ARG F:38 F:35 84.0 0.373 H -63.4 -45.4 64.0 0.284 0.089 E:P68431:0.089
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
7.041
5.022
6.455
8.318
8.575
9.334
6.926
6.374
8.427
9.279
CD
CD
NE
NH1
NH2
NH2
NH2
NH1
NH1
NH1
O3'
OP1
OP2
N6
N4
C2'
OP2
C7
O6
O4
1aoi 3 P62799 100.0 2e-57 X-RAY
1998-09-30 ARG D:20 B:35 82.0 0.364 H -59.2 -44.9 71.0 0.316 0.048 C:P02302:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.456
9.225
9.367
9.472
9.961
4.997
2.680
4.874
8.532
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
ARG H:20 F:35 90.0 0.4 H -63.0 -34.9 76.0 0.338 0.062 G:P02302:0.062
DT
DG
DA
DA
DC
DA
DC
DA
DT
DG
DT
HOH
7.289
5.164
6.659
7.272
7.858
9.871
9.049
6.872
5.898
7.337
8.135
8.508
CD
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NH1
N
O3'
OP2
OP2
N6
N4
N6
C2'
OP2
C7
O6
O4
O
6ipu 5 P62805 100.0 2e-57 X-RAY
2020-01-15 ARG F:20 F:35 83.0 0.369 H -58.5 -44.4 76.0 0.338 0.031 E:P68431:0.031
DG
DA
DA
DC
DC
DA
DT
HOH
5.112
2.884
4.702
8.157
8.522
8.592
8.883
3.079
NH1
NH1
NH2
NH2
CB
CD
CD
NH2
O3'
OP2
OP2
N4
OP2
OP2
C7
O
6iq4 5 P62805 100.0 2e-57 X-RAY
2019-10-30 ARG F:20 F:35 81.0 0.36 H -56.1 -48.0 67.0 0.298 0.062 E:P68431:0.062
DG
DA
DA
DC
DA
DC
DA
DT
DG
HOH
6.005
3.913
6.316
7.074
9.499
8.344
8.507
7.481
8.345
2.128
NH1
NH1
NH1
NH2
NH2
CB
NH2
NH2
NH2
NH1
O3'
OP2
OP2
N4
N6
OP2
OP2
C7
O6
O
6jm9 4 P62799 100.0 2e-57 EM
2019-05-15 ARG D:20 B:35 93.0 0.413 H -64.4 -39.7 79.0 0.351 0.062 C:P84233:0.062
DC
DA
DT
DG
DG
DA
DA
DC
8.595
9.477
9.354
9.461
4.694
2.440
4.120
8.089
CB
CB
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
C5
ARG H:20 F:35 71.0 0.316 H -60.6 -43.6 58.0 0.258 0.058 G:P84233:0.058
DT
DG
DA
DA
DC
DA
DT
DG
DT
5.895
3.632
6.434
8.027
9.714
8.277
7.786
8.692
8.360
NH1
NH1
CD
NH2
NE
CB
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
6jma 3 P62799 100.0 2e-57 EM
2019-05-15 ARG D:20 B:35 92.0 0.409 H -64.4 -39.7 78.0 0.347 0.062 C:P84233:0.062
DC
DA
DT
DG
DG
DA
DA
DC
8.595
9.478
9.354
9.461
4.694
2.440
4.121
8.089
CB
CB
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
OP2
OP2
C5
ARG H:20 F:35 72.0 0.32 H -60.6 -43.5 59.0 0.262 0.058 G:P84233:0.058
DT
DG
DA
DA
DC
DA
DT
DG
DT
5.895
3.631
6.433
8.026
9.714
8.277
7.785
8.692
8.360
NH1
NH1
CD
NH2
NE
CB
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
6jxd 6 P62805 100.0 2e-57 X-RAY
2020-01-15 ARG F:20 F:35 78.0 0.347 H -61.7 -50.5 68.0 0.302 0.045 E:P68431:0.044
DC
DC
DG
DC
DA
DA
DC
DG
5.497
3.331
5.811
8.482
8.513
9.428
9.550
9.073
NH1
NH1
NH1
NH2
CB
NE
NH2
NH2
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
6ke9 2 P62805 100.0 2e-57 X-RAY
2020-04-22 ARG B:20 B:35 85.0 0.378 H -58.2 -49.5 76.0 0.338 0.04 A:P68431:0.04
DA
DG
DG
DG
DT
DT
DA
DA
DC
8.452
8.944
8.878
8.477
9.905
5.050
2.763
5.420
7.718
CD
CD
NE
NH1
NH1
NH1
NH1
NH2
NH1
OP2
OP2
O6
O6
O4
O3'
OP2
OP2
N4
ARG F:20 F:35 89.0 0.396 H -61.3 -42.2 65.0 0.289 0.107 E:P68431:0.107
DG
DG
DT
DT
DA
DC
DC
DT
DA
7.288
4.861
4.524
7.473
9.662
7.755
8.801
9.337
9.817
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
CD
O3'
OP2
OP2
C7
N6
OP2
C5
C7
N6
6l9h 2 P62805 100.0 2e-57 X-RAY
2020-04-22 ARG B:20 B:35 84.0 0.373 H -61.0 -44.2 72.0 0.32 0.053 A:P68431:0.053
DA
DG
DG
DG
DC
DT
DA
DA
DC
8.236
8.756
8.799
8.593
9.455
4.580
2.249
5.496
8.546
CB
CD
NE
NH1
NH1
NH1
NH1
NH2
NH1
OP2
N7
O6
O6
O3'
O3'
OP2
OP2
N4
ARG F:20 F:35 83.0 0.369 H -67.6 -31.3 58.0 0.258 0.111 E:P68431:0.111
DG
DG
DT
DT
DA
DC
DC
DT
DA
6.831
4.411
4.066
7.701
9.171
8.257
9.216
9.267
9.496
NE
NE
NH2
NH2
NH1
NH1
CD
CD
CD
O3'
OP2
OP2
C7
N6
OP2
OP2
C7
N6
6le9 2 P62805 100.0 2e-57 X-RAY
2020-04-22 ARG B:20 B:35 92.0 0.409 H -55.8 -47.3 81.0 0.36 0.049 A:P68431:0.049
DC
DC
DT
DA
DA
DG
DG
DT
DT
DA
8.211
8.344
8.009
7.435
8.336
4.877
2.641
3.588
7.588
9.537
CB
NE
NH1
NH1
NH1
NH2
NH1
NH1
NH1
NH1
OP2
N4
C7
N6
N6
O3'
OP2
C7
O4
N6
ARG F:20 F:35 81.0 0.36 H -62.8 -37.4 52.0 0.231 0.129 E:P68431:0.129
DT
DA
DA
DC
DC
DT
DA
DG
DG
DG
7.888
5.395
5.310
8.964
8.824
9.353
6.876
8.791
9.762
9.736
CD
CD
NH2
NH2
NH1
NH1
NH1
NH1
NH1
CD
O3'
OP2
OP2
C5
N4
O3'
OP2
N7
O6
O6
6r1t 2 ? 100.0 2e-57 EM
2019-04-24 ARG B:20 B:35 87.0 0.387 H -61.5 -39.7 78.0 0.347 0.04 A:A0A310TTQ1:0.04
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
9.456
7.158
8.235
8.554
9.848
7.177
4.754
4.432
7.676
9.486
NH1
NH1
CD
NH1
NH1
NE
NE
NH2
NH2
NH1
C2'
OP2
OP2
N4
O6
O3'
OP2
OP2
C5
O6
ARG F:20 F:35 103.0 0.458 H -59.4 -43.3 84.0 0.373 0.085 E:A0A310TTQ1:0.084
DC
DG
DT
DG
DC
DA
DA
DC
DG
6.752
4.355
4.635
8.319
9.355
9.630
7.415
8.405
9.005
NE
NE
NH2
NH2
NH1
NH1
NH1
CD
NH1
O3'
OP2
OP2
N7
N4
C2'
OP2
OP2
O6
6fq8 2 P62799 100.0 1e-56 EM
2018-04-18 ARG B:19 B:35 85.0 0.378 H -62.0 -44.2 72.0 0.32 0.058 A:P02302:0.058
DA
DC
DG
DG
DC
DC
DC
DG
DC
DG
9.282
8.900
9.426
9.939
9.869
4.904
3.004
3.290
7.200
9.323
N
NH1
NH1
NH2
NE
NE
NE
NH2
NH1
NH1
OP2
N4
O6
N2
O3'
O3'
OP2
OP2
C5
O6
ARG F:19 F:35 104.0 0.462 H -63.1 -49.8 73.0 0.324 0.138 E:P02302:0.138
DC
DG
DT
DG
DC
DA
DC
DG
5.671
3.393
2.387
8.358
9.546
9.313
9.405
9.384
NE
NH2
NH2
NH2
NH1
N
NH1
NH1
O3'
C3'
OP2
OP2
N4
OP2
C5
O6
6fq5 5 P62799 100.0 4e-56 EM
2018-04-18 ARG F:18 F:35 97.0 0.431 H -59.2 -48.5 70.0 0.311 0.12 E:None:0.12
DC
DG
DT
DG
DA
DC
DC
6.221
3.741
3.890
7.913
7.964
8.917
9.525
NE
NE
NH2
NH2
NH1
CD
NE
O3'
OP2
OP2
N7
OP2
OP2
N4
6fq6 2 P62799 100.0 4e-56 EM
2018-04-18 ARG B:18 B:35 96.0 0.427 H -64.4 -34.8 96.0 0.427 0.0 DA
DA
DC
DG
DG
DG
DC
DC
DG
DC
DG
9.064
9.209
7.976
8.612
9.854
9.612
5.382
3.260
2.915
6.957
8.781
N
NH1
NH1
NH1
NH2
NH2
NE
NE
NH2
NH1
NH1
OP2
N7
N4
O6
N2
N2
O3'
OP2
OP2
N4
O6
ARG F:18 F:35 97.0 0.431 H -60.3 -49.8 77.0 0.342 0.089 E:None:0.089
DC
DG
DT
DG
DC
DA
DC
DG
DC
DG
5.816
3.551
2.437
7.331
8.830
8.728
9.229
8.802
9.463
9.918
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH1
NE
NH2
O3'
C3'
OP2
N7
N4
OP2
N4
O6
N4
N2
6fq5 2 P62799 100.0 2e-55 EM
2018-04-18 ARG B:18 B:35 86.0 0.382 H -63.3 -29.1 86.0 0.382 0.0 DA
DA
DC
DG
DC
DC
DG
DC
8.957
9.019
9.326
8.795
4.762
2.789
4.270
7.280
N
CD
NH1
NH1
NH2
NH2
NH2
NH1
OP2
OP2
N4
O6
O3'
O5'
OP2
N4
5mlu 2 P62799 100.0 7e-55 X-RAY
2017-05-10 ARG B:17 B:35 85.0 0.378 H -64.5 -43.3 72.0 0.32 0.058 A:P84233:0.058
DA
DA
DC
DG
DC
DC
DG
DC
HOH
8.222
9.120
8.528
8.025
5.612
3.420
5.358
7.349
3.018
CB
NE
NH2
NH2
NH1
NH1
NH1
NH2
NH1
OP2
OP2
N4
O6
O3'
OP2
OP2
N4
O
ARG F:17 F:35 81.0 0.36 H -64.5 -40.4 74.0 0.329 0.031 E:P84233:0.031
DA
DC
DG
DT
DG
DA
DC
HOH
9.702
4.999
2.598
4.726
8.775
8.508
8.750
4.493
NH1
NH1
NH1
NH2
NE
CB
CD
NH1
O3'
O3'
OP2
OP2
O6
OP2
OP2
O
2hue 3 P62799 100.0 2e-54 X-RAY
2006-11-21 ARG C:17 C:35 91.0 0.404 H -61.4 -39.1 91.0 0.404 0.0 SO4
HOH
7.162
2.920
NH2
NE
O4
O
3nqj 2 P62805 100.0 2e-54 X-RAY
2010-08-25 ARG B:17 B:35 97.0 0.431 H -52.4 -43.7 97.0 0.431 0.0 PO4
PO4
PO4
HOH
2.666
3.815
2.622
2.802
NE
NH1
NH2
O
O1
O4
O4
O
4zbj 3 P62799 100.0 2e-54 X-RAY
2015-07-15 ARG C:17 C:35 92.0 0.409 H -65.3 -38.3 92.0 0.409 0.0 CL
CL
HOH
9.118
3.309
3.195
N
NH1
O
CL
CL
O
6yn1 4 P62799 100.0 2e-54 X-RAY
2021-11-17 ARG D:17 D:35 75.0 0.333 H -59.2 -44.2 60.0 0.267 0.066 C:A0A310TTQ1:0.067
GOL
HOH
7.263
5.645
NH2
NE
O3
O
ARG I:17 I:35 90.0 0.4 H -60.7 -40.6 57.0 0.253 0.147 H:A0A310TTQ1:0.147
HOH
3.383
NH2
O
ARG N:17 N:35 101.0 0.449 H -62.7 -38.6 NA NA NA
ARG S:17 S:35 93.0 0.413 H -56.1 -44.2 NA NA NA
ARG X:17 X:35 104.0 0.462 H -53.4 -49.2 NA NA NA
ARG CA:17 c:35 78.0 0.347 H -66.0 -46.7 NA NA NA
ARG HA:17 h:35 94.0 0.418 H -55.1 -51.0 NA NA NA
ARG MA:17 m:35 85.0 0.378 H -59.7 -45.4 NA NA NA
3kwq 2 P62799 100.0 3e-54 X-RAY
2010-05-12 ARG B:16 B:35 108.0 0.48 H -59.1 -36.1 90.0 0.4 0.08 A:P84233:0.08
DC
DA
DT
DG
DG
DA
DA
DC
DA
8.037
7.300
6.647
7.876
7.572
4.914
3.984
6.272
7.999
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
N7
C7
O6
O3'
C2'
OP2
N4
N6
ARG F:16 F:35 94.0 0.418 H -63.2 -59.4 89.0 0.396 0.022 E:P84233:0.022
DC
DT
DG
DA
DA
DA
DT
DG
DT
9.901
4.968
2.633
3.813
8.409
8.047
8.256
9.698
9.669
NH1
NH1
NH1
NH2
NH2
CG
CG
NH2
NH2
O3'
O3'
OP2
OP2
N6
OP2
C7
O6
O4
4h9s 2 P62805 100.0 3e-54 X-RAY
2012-10-17 ARG C:16 C:35 155.0 0.689 H -63.4 -38.7 155.0 0.689 0.0 PO4
HOH
7.974
2.858
N
O
O3
O
ARG D:16 D:35 148.0 0.658 H -63.5 -38.4 NA NA NA
6y5e 5 P62805 100.0 3e-54 EM
2020-09-23 ARG F:16 F:36 84.0 0.373 H -64.6 -41.0 78.0 0.347 0.026 E:Q71DI3:0.027
DC
DC
DG
DC
DG
DA
DA
DC
DG
6.306
4.137
4.739
7.659
9.338
8.544
8.898
8.421
8.859
NH2
NH2
NH2
NH1
NH1
NH1
NH1
NH1
NH1
O3'
OP2
OP2
N4
O6
OP2
N7
N4
O6
6z6p 6 P62799 100.0 3e-54 EM
2021-02-17 ARG F:16 B:35 78.0 0.347 H -67.0 -40.8 78.0 0.347 0.0 DA
DA
DC
DA
DC
DG
DT
9.950
7.691
8.408
8.076
4.833
2.666
6.641
N
CB
NE
NH2
NH1
NH1
NH1
O3'
OP2
OP2
O3'
O3'
OP2
C7
6yov 2 P62805 98.84 4e-54 EM
2020-05-06 ARG B:38 B:36 83.0 0.369 H -57.5 -44.7 83.0 0.369 0.0 DA
DC
DC
DA
DC
DG
DT
DG
8.311
9.237
9.839
9.517
5.759
3.457
6.019
9.482
CD
NE
NH2
NH2
NH1
NH2
NH1
NH2
OP2
OP2
N4
O3'
O3'
OP2
OP2
O6
4z66 2 P62799 100.0 1e-53 X-RAY
2015-10-14 ARG B:15 B:35 77.0 0.342 H -72.9 -44.1 64.0 0.284 0.058 A:P84233:0.058
DA
DT
DG
DT
DT
DG
DA
DA
DC
HOH
8.347
7.205
8.512
8.413
6.180
4.009
6.339
7.638
9.113
8.823
NE
NH2
NH2
NH2
NH1
NH1
NH1
NH2
NH2
N
OP2
C7
O6
O4
O3'
OP2
OP2
N6
N4
O
ARG F:15 F:235 95.0 0.422 H -66.7 -48.8 84.0 0.373 0.049 E:P84233:0.049
DT
DG
DA
DA
DA
DT
DG
DT
HOH
4.898
2.845
4.147
7.952
8.629
8.772
9.492
9.465
3.119
NH1
NH1
NH2
NH2
CB
NE
NH2
NH2
NE
O3'
OP2
OP2
N6
OP2
C7
O6
O4
O
5wcu 2 P84040 100.0 1e-53 X-RAY
2018-10-31 ARG B:15 B:35 102.0 0.453 H -62.3 -42.4 63.0 0.28 0.173 A:P02299:0.173
DA
DC
DG
DC
DG
DT
DG
8.248
8.606
9.776
6.309
4.272
4.839
7.168
NH1
NH1
NH1
CD
CD
NE
NH1
OP2
N4
O6
O3'
OP1
OP2
O6
ARG F:15 F:35 92.0 0.409 H -62.1 -42.7 54.0 0.24 0.169 E:P02299:0.169
DC
DC
DG
DC
DG
DA
DA
DA
DC
DG
8.209
5.960
6.042
5.989
9.035
7.555
5.325
7.453
8.337
8.965
CD
CD
NE
CD
NH1
NH1
NH1
NH1
NH1
CD
O3'
OP2
OP2
N4
O6
C2'
OP2
N7
N4
O6
ARG L:15 L:35 103.0 0.458 H -62.5 -42.7 NA NA NA
ARG P:15 P:35 101.0 0.449 H -62.1 -42.4 NA NA NA
6ipu 2 P62805 100.0 1e-53 X-RAY
2020-01-15 ARG B:15 B:35 79.0 0.351 H -55.9 -44.5 69.0 0.307 0.044 A:P68431:0.044
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.454
9.329
9.321
9.949
9.376
4.870
2.613
4.716
8.308
3.212
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
O
6iq4 2 P62805 100.0 1e-53 X-RAY
2019-10-30 ARG B:15 B:35 82.0 0.364 H -64.2 -38.1 71.0 0.316 0.048 A:P68431:0.049
DC
DA
DT
DG
DT
DG
DA
DA
DC
8.707
9.320
9.380
9.912
9.477
4.768
2.525
4.579
8.030
CB
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
OP2
OP2
C7
O6
O3'
O3'
OP2
OP2
N4
6jxd 2 P62805 100.0 1e-53 X-RAY
2020-01-15 ARG B:15 B:35 86.0 0.382 H -51.6 -58.0 79.0 0.351 0.031 A:P68431:0.031
DA
DC
DG
DC
DA
DC
DG
DT
DG
HOH
8.217
9.176
9.840
9.557
9.433
3.496
2.592
5.119
8.699
9.768
CB
CD
NE
NH2
NH2
NH2
NH2
NH2
NH2
O
OP2
OP2
O6
N4
N6
O3'
OP2
C7
O6
O
4eo5 3 P62799 98.8 2e-53 X-RAY
2012-06-13 ARG C:16 C:35 94.0 0.418 H -63.0 -38.7 94.0 0.418 0.0 HOH
2.792
NH1
O
6y5e 2 P62805 100.0 6e-53 EM
2020-09-23 ARG B:14 B:36 96.0 0.427 H -63.1 -40.5 92.0 0.409 0.018 A:Q71DI3:0.018
DA
DC
DG
DC
DC
DG
DT
DG
DC
8.347
8.854
8.866
8.926
6.148
3.982
4.606
8.011
9.523
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH1
NH1
OP2
C5
O6
N4
O3'
OP2
OP2
O6
N4
6uph 2 Q6CMU6 91.86 6e-53 EM
2019-11-06 ARG B:51 B:36 83.0 0.369 H -74.6 -25.3 82.0 0.364 0.005 A:P36012:0.004
DA
DA
DC
DG
DT
8.943
9.577
4.875
2.798
4.933
CD
NH2
NH2
NH2
NH1
OP2
O3'
O3'
OP2
OP2
ARG F:51 F:36 90.0 0.4 H -70.5 -34.6 88.0 0.391 0.009 E:P36012:0.009
DC
DC
DG
DA
DA
5.281
3.023
4.646
9.082
9.583
NH1
NH1
NH2
N
CD
O3'
OP2
OP2
OP1
OP2
4xyi 2 B6JV96 89.53 6e-53 X-RAY
2016-02-03 ARG B:36 B:35 156.0 0.693 H -65.7 -23.7 105.0 0.467 0.226 A:B6K598:0.227
2yfw 2 Q6CMU6 91.86 7e-53 X-RAY
2011-05-25 ARG B:36 B:35 91.0 0.404 H -65.9 -47.0 91.0 0.404 0.0 HOH
5.474
CD
O
ARG D:36 D:35 82.0 0.364 H -60.1 -41.4 NA NA NA
ARG F:36 F:35 79.0 0.351 H -71.8 -33.6 NA NA NA
ARG H:36 H:35 96.0 0.427 H -57.4 -37.7 96.0 0.427 0.0
4kud 2 P02309 90.7 2e-52 X-RAY
2013-08-07 ARG B:36 B:35 81.0 0.36 H -58.2 -44.0 71.0 0.316 0.044 A:P61830:0.044
DC
DA
DT
DG
DT
DG
DA
DA
DC
HOH
8.111
9.197
8.561
8.595
9.932
5.316
2.928
5.470
8.191
3.078
CD
NE
NH2
NH2
NH2
NH2
NH2
NH1
NH2
CD
OP2
OP2
C7
O6
O4
C3'
OP2
OP2
N4
O
ARG F:36 F:35 86.0 0.382 H -54.3 -54.2 60.0 0.267 0.115 E:P61830:0.116
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
HOH
7.617
5.450
6.413
8.564
8.728
8.145
5.662
6.438
8.781
9.747
7.898
CD
CD
NH1
NE
NH2
NH2
NH2
NH2
NH2
NE
NH1
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O
5zba 4 P02309 90.7 2e-52 X-RAY
2018-07-25 ARG D:36 D:35 116.0 0.516 H -64.1 -38.9 74.0 0.329 0.187 C:P61830:0.187
IOD
IOD
IOD
IOD
4.629
9.407
9.283
6.162
O
N
O
NH2
I
I
I
I
5zbb 4 P02309 90.7 2e-52 X-RAY
2018-07-25 ARG D:36 D:35 104.0 0.462 H -65.4 -33.3 65.0 0.289 0.173 C:P61830:0.173
IOD
IOD
IOD
IOD
4.527
9.376
9.738
9.198
O
N
NH1
O
I
I
I
I
6gej 3 P02309 90.7 2e-52 EM
2018-10-17 ARG D:36 C:35 92.0 0.409 H -66.2 -39.6 85.0 0.378 0.031 C:P61830:0.031
DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
9.255
4.875
2.557
6.133
8.736
9.568
9.847
9.612
9.258
9.908
NH2
NH1
NH2
NH1
NH2
CB
N
NE
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG E:36 D:35 91.0 0.404 H -66.3 -39.5 82.0 0.364 0.04 B:P61830:0.04
DA
DC
DC
DA
DA
DC
DG
DT
DG
8.219
9.387
9.128
9.774
9.388
4.952
2.925
5.666
8.865
CB
NE
NH2
NH2
NH2
NH2
NH2
NH2
NH2
OP2
OP2
N4
N6
O3'
C3'
OP2
C7
O6
6gen 3 P02309 90.7 2e-52 EM
2018-10-17 ARG D:36 C:35 88.0 0.391 H -68.1 -39.0 81.0 0.36 0.031 C:P61830:0.031
DC
DC
DC
DG
DC
DA
DA
DC
DG
DC
9.371
4.973
2.661
6.039
8.607
9.399
9.646
9.444
9.364
9.899
NH2
NH1
NH2
NH1
NH2
CB
N
NE
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N4
ARG E:36 D:35 90.0 0.4 H -68.1 -39.0 81.0 0.36 0.04 B:P61830:0.04
DA
DC
DC
DA
DA
DC
DG
DT
DG
7.902
9.036
9.091
9.848
9.133
4.749
2.706
5.650
8.942
CB
NE
NH2
NH2
NH2
NH2
NH1
NH1
NH2
OP2
OP2
N4
N6
O3'
C3'
OP2
C7
O6
7k78 2 P02309 90.7 2e-52 EM
2021-03-31 ARG B:36 B:36 84.0 0.373 H -63.0 -39.4 77.0 0.342 0.031 A:None:0.031
DG
DT
DG
DT
DA
DA
DA
DC
8.526
8.451
9.951
9.735
5.022
2.635
5.598
9.736
N
CD
NH1
NH1
NH1
NH1
NH2
NH1
OP1
OP2
O6
O3'
O3'
OP2
OP2
N4
ARG F:36 F:36 81.0 0.36 H -64.4 -39.0 72.0 0.32 0.04 E:None:0.04
DA
DA
DA
DA
DA
5.328
2.997
4.848
8.600
8.096
NH1
NH1
NH2
CD
CD
O3'
OP2
OP2
OP2
OP2
7k7g 2 P02309 90.7 2e-52 EM
2021-03-31 ARG B:36 B:36 131.0 0.582 H -65.1 -35.1 131.0 0.582 0.0 DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
7.824
8.031
7.911
8.106
9.568
7.617
5.212
4.789
7.426
8.349
NH2
NH1
NH1
NH1
NH1
NH1
NH1
NH1
NH1
NH2
OP2
C5
O6
N4
N6
O3'
OP2
C7
O6
N4
ARG F:36 F:36 131.0 0.582 H -65.1 -35.1 131.0 0.582 0.0 DC
DC
DG
DC
DG
DA
DA
DC
DG
7.021
4.979
5.665
5.569
8.431
8.302
8.084
7.033
6.764
NH1
NH1
NH2
NH1
NH2
NH2
NH1
NH1
NH1
O3'
C2'
OP2
N4
O6
OP2
N7
N4
O6
1id3 3 P02309 90.7 2e-52 X-RAY
2001-09-28 ARG D:35 B:35 71.0 0.316 H -55.0 -51.6 60.0 0.267 0.049 C:P61830:0.049
DC
DA
DT
DG
DG
DA
DA
DC
HOH
8.436
9.000
8.594
9.487
5.636
3.247
6.242
8.582
3.144
CB
NE
NE
NH2
NH2
NH2
NH1
NH2
CD
OP1
OP2
C7
O6
O3'
OP2
OP2
N4
O
ARG H:35 F:35 93.0 0.413 H -53.6 -44.6 79.0 0.351 0.062 G:P61830:0.062
DT
DG
DA
DA
DC
DA
DT
DG
DT
DT
HOH
5.649
3.398
6.121
8.146
9.483
8.519
7.458
8.698
8.658
9.998
7.998
NH1
NH1
NH1
NH2
NH2
CD
NE
NH2
NH2
NH2
NH2
O3'
OP2
OP2
N6
N4
OP2
C7
O6
O4
O4
O
4jjn 2 P02309 90.7 2e-52 X-RAY
2013-05-15 ARG B:35 B:35 112.0 0.498 H -63.1 -45.8 94.0 0.418 0.08 A:P61830:0.08
DC
DC
DG
DC
DG
DA
DA
DC
DG
DC
5.600
3.329
5.047
6.263
8.722
8.210
9.345
7.896
8.361
9.425
NH2
NH2
NH1
NH1
NH1
CB
N
NH1
NH1
NH2
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
N4
ARG F:35 F:35 103.0 0.458 H -64.0 -43.3 94.0 0.418 0.04 E:P61830:0.04
DA
DC
DG
DC
DA
DG
DA
DC
DG
DT
DG
DC
8.328
9.291
8.884
8.105
8.173
9.697
9.195
4.965
2.531
3.606
7.094
9.607
CB
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH1
NH1
NH1
OP2
OP2
O6
N4
N6
N2
O3'
O3'
OP2
C7
O6
N4
7on1 2 A0A6A5Q1V3 90.7 2e-52 EM
2021-07-07 ARG B:38 b:36 90.0 0.4 H -65.0 -42.6 83.0 0.369 0.031 K:A0A6A5PV75:0.031
DA
DC
DA
DC
DG
DT
8.844
9.606
9.632
5.009
2.877
5.906
CB
CB
NH2
NH2
NH2
NH1
OP2
OP2
O3'
O3'
OP2
OP2
ARG E:38 f:36 94.0 0.418 H -66.0 -40.2 86.0 0.382 0.036 D:A0A6A5PV75:0.036
DC
DC
DC
DG
DC
DA
9.663
4.840
2.374
5.165
9.878
9.132
NH2
NH2
NH2
NH1
NH2
CB
O3'
O3'
OP2
OP2
N4
OP2
7ccq 2 ? 100.0 3e-52 EM
2020-10-07 ARG B:13 B:35 93.0 0.413 H -69.0 -35.0 76.0 0.338 0.075 A:P68431:0.076
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
8.240
6.047
7.081
7.365
8.546
7.242
4.886
6.581
7.251
8.057
NH2
NH2
NH1
NH2
NH1
CD
CD
NE
NH2
NH2
C2'
OP2
OP2
N4
O6
O3'
OP2
OP2
N4
O6
ARG F:13 F:35 98.0 0.436 H -67.8 -36.7 67.0 0.298 0.138 E:P68431:0.138
DC
DG
DT
DG
DC
DG
DA
DA
DC
DG
DC
7.519
5.307
5.630
8.310
8.768
9.817
7.898
5.404
7.695
8.703
9.554
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N7
N4
O6
C2'
OP2
C5
O6
N4
7ccr 2 ? 100.0 3e-52 EM
2020-10-07 ARG B:13 B:35 93.0 0.413 H -68.8 -34.6 85.0 0.378 0.035 A:P68431:0.036
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
8.242
5.996
7.271
7.262
8.652
7.382
4.961
6.589
7.293
7.988
NH2
NH2
NH2
NH2
NH2
CD
CD
NE
NH2
NH2
C2'
OP2
N7
N4
O6
O3'
OP2
OP2
N4
O6
ARG F:13 F:35 111.0 0.493 H -68.5 -35.6 78.0 0.347 0.146 E:P68431:0.147
DC
DG
DT
DG
DC
DG
DA
DA
DC
DG
DC
7.178
5.034
5.838
8.719
8.843
9.794
7.805
5.702
7.757
8.743
9.721
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N7
N4
O6
C2'
OP2
N4
O6
N4
ARG M:13 M:35 94.0 0.418 H -68.8 -34.6 86.0 0.382 0.036 L:P68431:0.036
DA
DA
DA
DC
DG
DC
DC
DG
DC
DG
8.242
5.995
7.271
7.261
8.652
7.382
4.961
6.589
7.293
7.988
NH2
NH2
NH2
NH2
NH2
CD
CD
NE
NH2
NH2
C2'
OP2
N7
N4
O6
O3'
OP2
OP2
N4
O6
ARG Q:13 Q:35 108.0 0.48 H -68.5 -35.6 75.0 0.333 0.147 P:P68431:0.147
DC
DG
DT
DG
DC
DG
DA
DA
DC
DG
DC
7.177
5.034
5.838
8.720
8.844
9.794
7.805
5.703
7.758
8.743
9.721
CD
CD
NH1
NH2
NH2
NH2
NH2
NH2
NH2
NH2
NE
O3'
OP2
OP2
N7
N4
O6
C2'
OP2
N4
O6
N4
4x23 4 P84040 100.0 1e-51 X-RAY
2014-12-10 ARG D:12 B:35 99.0 0.44 H -60.4 -38.7 90.0 0.4 0.04 C:P02299:0.04
DA
DC
DG
DC
DA
DG
DA
DC
DG
DT
DG
8.337
9.427
9.803
9.404
9.949
9.844
9.388
4.853
2.537
4.237
8.568
CB
CB
NE
NH1
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
N6
N2
O3'
O3'
OP2
OP2
O6
ARG H:12 F:35 99.0 0.44 H -61.1 -39.0 87.0 0.387 0.053 G:P02299:0.053
DC
DC
DC
DG
DC
DA
DA
DC
DG
DG
9.295
4.812
2.515
4.443
8.071
8.298
9.130
9.581
9.303
9.939
NH1
NH2
NH1
NH2
NH2
CB
CB
CD
CZ
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
N2
ARG P:12 L:35 98.0 0.436 H -60.5 -39.0 NA NA NA
ARG T:12 P:35 100.0 0.444 H -61.0 -39.3 NA NA NA
4xzq 2 P62799 100.0 1e-51 X-RAY
2015-10-14 ARG B:12 B:35 74.0 0.329 H -66.9 -46.2 57.0 0.253 0.076 A:P84233:0.076
DA
DT
DG
DT
DT
DG
DA
DA
DC
HOH
7.860
6.303
7.996
8.676
6.820
4.512
6.561
7.493
8.783
8.770
NE
NH2
NH2
NH2
NH1
NH1
CD
NH2
NH2
N
OP2
C7
O6
O4
O3'
OP2
OP2
N6
N4
O
ARG F:12 F:235 94.0 0.418 H -62.9 -48.8 82.0 0.364 0.054 E:P84233:0.053
DT
DG
DA
DA
DA
DT
DG
DT
HOH
4.709
2.661
4.201
8.059
8.693
8.781
9.468
9.449
3.692
NH1
NH1
NH2
NH2
CB
NE
NH2
NH2
NH1
O3'
OP2
OP2
N6
OP2
C7
O6
O4
O
4ys3 2 P62799 100.0 1e-51 X-RAY
2015-10-14 ARG B:12 B:35 77.0 0.342 H -69.1 -39.8 61.0 0.271 0.071 A:P84233:0.071
DA
DT
DG
DT
DT
DG
DA
DA
DC
HOH
8.357
7.114
8.496
8.591
6.275
4.016
6.262
8.257
9.612
9.521
NE
NH2
NH2
NH2
NH1
NH1
CD
NH2
NE
CD
OP2
C7
O6
O4
O3'
OP2
OP2
N6
N4
O
ARG F:12 F:235 92.0 0.409 H -70.9 -37.5 86.0 0.382 0.027 E:P84233:0.027
DT
DG
DA
DA
DC
DC
DA
DT
DG
DT
DT
HOH
7.752
5.493
5.735
6.589
8.340
9.986
7.765
5.601
6.661
7.539
9.659
8.934
CD
NH1
NH1
NH1
NH1
NH2
NH2
NH2
NH2
NH2
NH2
N
O3'
OP2
OP2
N6
N4
O3'
OP2
C7
O6
O4
O4
O
7ktq 2 P62799 100.0 1e-51 EM
2021-02-03 ARG B:12 B:35 101.0 0.449 H -68.4 -38.7 94.0 0.418 0.031 A:A0A310TTQ1:0.031
DA
DC
DG
DC
DA
DC
DG
DT
DG
DC
8.328
9.171
9.069
8.903
9.577
5.123
2.727
4.158
7.573
9.203
CB
CG
NH2
NH2
NH2
NH1
NH1
NH2
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
OP2
C7
N7
N4
ARG F:12 F:35 104.0 0.462 H -68.4 -38.7 95.0 0.422 0.04 E:A0A310TTQ1:0.04
DC
DC
DC
DG
DC
DG
DA
DA
DC
DG
9.994
5.135
2.789
4.289
6.603
9.308
8.439
9.021
8.856
8.033
NH1
NH1
NH1
NH2
NH2
NH2
CB
CG
NH2
NH2
O3'
O3'
OP2
OP2
N4
O6
OP2
OP2
N4
O6
7ea5 2 ? 100.0 4e-51 EM
2021-07-14 ARG B:12 B:35 74.0 0.329 H -64.0 -35.6 69.0 0.307 0.022 A:A0A310TTQ1:0.022
DA
DC
DC
DA
DC
DG
DT
DG
8.656
9.223
9.994
8.949
5.359
3.145
6.483
9.799
CB
NE
NH2
NH2
NH1
NH1
NH2
NH2
OP2
OP2
N4
O3'
O3'
OP2
C7
O6
ARG F:12 F:35 89.0 0.396 H -65.1 -40.6 80.0 0.356 0.04 E:A0A310TTQ1:0.04
DC
DC
DC
DG
DC
DA
DA
DC
DG
9.396
5.363
3.120
5.796
9.147
8.582
9.660
9.797
9.767
NH2
NH1
NH1
NH1
NH2
CB
NE
NH2
NH2
O3'
O3'
OP2
OP2
N4
OP2
OP2
N4
O6
7ea8 3 ? 100.0 4e-51 EM
2021-07-14 ARG C:12 B:35 77.0 0.342 H -63.4 -35.6 72.0 0.32 0.022 B:None:0.022
DA
DC
DA
DC
DG
DT
DG
8.650
9.507
9.377
5.267
2.773
6.091
9.718
CB
NE
NH2
NH2
NH2
NH2
NH2
OP2
OP2
O3'
O3'
OP2
C7
O6
ARG G:12 F:35 86.0 0.382 H -68.1 -35.8 79.0 0.351 0.031 F:None:0.031
DC
DC
DC
DG
DC
DA
DA
9.280
5.388
3.081
6.456
9.335
8.786
9.528
NH2
NH1
NH1
NH1
NE
CB
NE
O3'
O3'
OP2
OP2
N4
OP2
OP2
6z6p 10 P62799 100.0 1e-50 EM
2021-02-17 ARG J:11 F:35 113.0 0.502 H -75.3 -30.6 113.0 0.502 0.0 DC
DC
DG
DC
DA
DA
DC
DG
DC
5.000
2.504
6.852
7.800
8.127
8.744
8.767
8.478
9.301
NH2
NH2
NH2
NH1
N
CD
NH1
NH1
NH1
O3'
OP2
OP2
N4
OP1
OP2
N4
O6
N4
6qld 16 P02309 91.14 1e-47 EM
2019-10-02 ARG P:12 b:36 93.0 0.413 H -66.6 -42.3 93.0 0.413 0.0 DA
DC
DG
DC
DA
DA
DC
DG
DT
DG
DC
7.956
8.976
8.843
8.242
8.653
8.807
5.199
2.724
4.716
7.909
9.598
CD
NH2
NH2
NH2
NH2
NH2
NH1
NH1
NH1
NH2
NH2
OP2
OP2
O6
N4
N6
O3'
O3'
OP2
C7
O6
N4
ARG S:12 f:36 87.0 0.387 H -65.1 -45.4 87.0 0.387 0.0 DC
DC
DC
DG
DC
DA
DA
9.399
4.459
2.732
5.209
8.908
7.937
9.766
NH2
NH2
NH2
NH1
NE
CB
N
O3'
O3'
OP2
OP2
N4
OP2
OP2
2yfv 2 Q6CMU6 91.89 6e-44 X-RAY
2011-05-25 ARG B:12 B:35 104.0 0.462 H -65.8 -37.4 104.0 0.462 0.0 HOH
3.996
NH1
O
4psx 3 P02309 100.0 6e-15 X-RAY
2014-07-09 ARG C:35 C:35 143.0 0.636 H -57.0 -40.0 66.0 0.293 0.343 B:P39984:0.342
HOH
2.950
NH1
O
ARG F:35 F:35 145.0 0.644 H -57.7 -39.5 NA NA NA
6s1r 2 P09322 96.77 4e-14 X-RAY
2019-08-07 ARG B:23 B:36 113.0 0.502 H -76.1 -31.7 25.0 0.111 0.391 A:O94244:0.391
HOH
3.641
NH2
O
4psw 3 V8PGJ1 100.0 8e-12 X-RAY
2014-07-09 ARG C:29 C:37 145.0 0.644 H -57.7 -47.3 64.0 0.284 0.36 B:P39984:0.356
A:Q12341:0.004
HOH
2.780
NH2
O
3c9c 2 P84040 100.0 1e-11 X-RAY
2008-05-13 ARG B:21 B:35 193.0 0.858 H -63.0 -37.5 73.0 0.324 0.534 A:Q24572:0.533
2xyi 2 P84040 100.0 8e-06 X-RAY
2011-05-04 ARG B:10 B:35 141.0 0.627 H -64.9 -34.8 68.0 0.302 0.325 A:Q24572:0.324
HOH
3.296
O
O
3cfs 2 P62805 100.0 1.0 X-RAY
2008-06-10 ARG B:9 E:35 144.0 0.64 H -65.2 -30.5 49.0 0.218 0.422 A:Q16576:0.422
HOH
2.580
O
O
3cfv 2 P62805 100.0 1.0 X-RAY
2008-06-10 ARG B:12 E:35 166.0 0.738 H -64.6 -29.2 70.0 0.311 0.427 A:Q16576:0.427
HOH
3.190
O
O
ARG D:12 F:35 165.0 0.733 H -66.5 -27.4 NA NA NA

AlphaFold DB

Entity Residue Monomer View
ID Entity Uniprot Identity Evalue Name Label Auth ASA rASA SS φ ψ
af-p62805-f1 1 P62805 100.0 2e-68 ARG A:36 A:36 100.0 0.444 H -59.9 -44.1
af-q99525-f1 1 Q99525 85.0 1e-40 ARG A:36 A:36 124.0 0.551 H -62.1 -43.8