Variant

Genome Chromosome Position VCF ID Ref Alt mRNA Change mRNA Info
GRCh37 chr1 226253365 . C A CCDS1550.1:NM_002107.4:c.137aCt>aAt_NP_002098.1:p.46T>N Homo sapiens H3 histone family member 3A (H3F3A), 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)
4hga 2 P84243 100.0 4e-96 X-RAY
2012-11-07 THR B:46 B:45 152.0 1.0 S -98.7 -2.1 114.0 0.814 0.186 A:Q9UER7:0.271
6ltj 1 Q6PI79 100.0 4e-96 EM
2020-02-12 THR A:46 A:42 99.0 0.707 -99.9 -28.4 99.0 0.707 0.0 DC
DG
DC
DG
DG
5.577
3.444
7.198
8.322
7.917
N
N
CG2
N
N
O3'
OP1
OP1
C5'
OP1
THR E:46 E:45 100.0 0.714 -99.8 -28.4 100.0 0.714 0.0 DA
DC
DG
DT
DG
8.769
8.291
5.307
3.492
7.475
N
N
N
N
CG2
C4'
OP1
O3'
OP1
OP1
6r0c 1 P84243 100.0 4e-96 EM
2019-09-25 THR A:46 A:45 62.0 0.443 H -86.4 -40.3 60.0 0.429 0.014 G:P0C0S8:0.014
DC
DT
DG
DC
DC
DG
DT
DC
DT
DG
9.726
9.635
8.917
6.473
4.218
8.751
8.485
6.781
4.895
8.811
N
N
CG2
OG1
OG1
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
C5'
OP1
O3'
OP1
OP2
THR E:46 E:45 70.0 0.5 H -74.8 -49.1 63.0 0.45 0.05 C:P0C0S8:0.05
DT
DT
DG
DT
DC
DT
DT
DC
DT
DG
DG
9.117
8.595
5.866
3.863
8.636
8.272
8.903
6.992
4.431
3.190
9.994
O
O
N
N
C
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
C5'
OP1
OP2
6rny 1 P84243 100.0 4e-96 EM
2019-09-25 THR A:46 A:45 57.0 0.407 T -105.4 -48.0 43.0 0.307 0.1 G:P0C0S8:0.1
DC
DT
DG
DC
DC
DC
DG
DC
DT
DG
DC
DT
DG
8.477
8.668
9.547
7.276
4.495
2.758
8.883
9.304
7.959
7.757
6.086
4.604
7.528
OG1
N
CG2
CG2
CG2
OG1
CG2
CG2
O
O
N
N
CB
OP1
OP1
N2
O3'
C4'
OP1
N2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:46 E:45 58.0 0.414 T -105.4 -47.9 45.0 0.321 0.093 C:P0C0S8:0.093
DG
DT
DC
DT
DT
DA
DG
DG
DG
DG
DA
DC
5.822
4.227
7.648
8.791
8.836
9.644
8.476
9.383
7.738
4.169
2.594
9.477
N
N
CB
OG1
N
CG2
CG2
O
CG2
CG2
CG2
OG1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
C5'
O3'
C4'
OP1
OP2
3av2 1 P84243 100.0 5e-96 X-RAY
2011-06-01 THR A:49 A:45 64.0 0.457 H -55.0 -49.8 61.0 0.436 0.021 G:P04908:0.021
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.422
6.951
8.080
6.997
4.013
2.805
9.449
9.480
7.785
6.918
5.178
3.591
7.225
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 57.0 0.407 H -67.4 -47.4 55.0 0.393 0.014 C:P04908:0.014
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.645
7.552
7.637
5.315
3.574
7.160
8.464
7.042
8.283
6.633
3.771
2.699
9.245
7.318
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5b32 1 P84243 100.0 5e-96 X-RAY
2016-08-03 THR A:49 A:45 52.0 0.371 H -66.8 -49.6 52.0 0.371 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.404
6.911
8.285
6.430
3.448
2.694
8.359
9.066
8.260
7.440
5.580
3.722
7.832
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O4'
O3'
OP1
O3'
OP1
OP2
THR E:49 E:45 54.0 0.386 H -62.2 -49.9 53.0 0.379 0.007 C:P04908:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.379
8.031
7.959
5.310
3.350
7.581
8.471
7.061
8.052
6.734
4.004
2.428
9.411
4.247
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N
O2
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5b33 1 P84243 100.0 5e-96 X-RAY
2016-08-03 THR A:49 A:45 57.0 0.407 H -68.1 -48.2 57.0 0.407 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.542
6.994
8.161
7.008
3.976
3.032
9.467
9.533
7.856
6.991
5.208
3.350
7.545
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP2
THR E:49 E:45 56.0 0.4 H -76.5 -41.7 56.0 0.4 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.632
7.676
7.434
5.197
3.386
7.524
8.866
7.122
8.305
6.692
4.123
2.705
9.291
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5x7x 1 P84243 100.0 5e-96 X-RAY
2017-04-19 THR A:49 A:45 57.0 0.407 H -62.7 -46.9 53.0 0.379 0.028 G:P04908:0.029
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
9.180
7.343
8.344
6.637
3.762
2.576
8.567
9.057
7.852
7.994
5.358
3.433
7.372
4.828
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O4'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 56.0 0.4 H -61.8 -47.0 52.0 0.371 0.029 C:P04908:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.319
7.677
7.869
5.423
3.522
7.474
8.986
7.410
8.447
6.780
3.910
2.726
9.546
2.925
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
OG1
OG1
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5xm0 1 P84244 100.0 5e-96 X-RAY
2018-03-07 THR A:49 A:45 57.0 0.407 H -72.5 -51.9 55.0 0.393 0.014 G:C0HKE1:0.014
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.819
6.970
8.265
7.227
4.128
2.907
9.293
9.569
7.973
7.018
5.100
3.319
7.043
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR E:49 E:45 58.0 0.414 H -72.1 -48.7 54.0 0.386 0.028 C:C0HKE1:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.471
7.708
7.504
5.285
3.465
7.427
8.754
7.234
8.233
6.953
4.110
2.762
9.433
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6a5l 16 P84243 100.0 5e-96 EM
2018-10-03 THR P:49 a:45 65.0 0.464 H -85.6 -26.2 57.0 0.407 0.057 V:P04908:0.057
DG
DT
DG
DG
DT
7.729
5.330
8.687
5.934
6.968
N
N
C
CG2
O
O3'
OP1
OP1
C4'
OP1
THR T:49 e:45 85.0 0.607 H -76.7 -51.7 76.0 0.543 0.064 R:P04908:0.064
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.843
8.105
7.840
5.758
3.744
8.099
8.253
9.186
5.503
3.380
3.391
9.496
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
6a5o 16 P84243 100.0 5e-96 EM
2018-10-03 THR P:49 a:45 77.0 0.55 H -71.1 -37.8 77.0 0.55 0.0 DT
DA
DC
DA
DC
DG
DT
DG
DT
DG
DT
DG
9.967
8.570
8.789
8.407
7.229
8.456
8.742
7.028
7.614
5.938
3.855
7.312
N
N
N
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
C5'
OP1
O3'
C5'
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR T:49 e:45 61.0 0.436 H -61.2 -61.0 61.0 0.436 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.172
8.850
7.207
7.366
5.957
3.883
6.665
8.243
8.481
7.151
3.093
2.223
8.917
CG2
CG2
CG2
O
N
N
CG2
OG1
N
CG2
OG1
OG1
OG1
N2
O3'
C5'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
O3'
OP1
OP1
6a5p 16 P84243 100.0 5e-96 EM
2018-10-03 THR P:49 a:45 79.0 0.564 H -71.0 -37.9 78.0 0.557 0.007 V:P04908:0.007
DA
DC
DG
DT
DG
9.647
9.159
6.399
4.320
8.634
N
N
N
N
CB
OP1
OP1
O3'
OP1
OP1
THR T:49 e:45 61.0 0.436 H -61.2 -61.0 61.0 0.436 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.018
9.529
7.305
7.489
6.321
4.450
7.191
9.198
9.754
7.287
4.174
2.464
9.243
CG2
CG2
CG2
O
N
N
CB
N
N
CG2
OG1
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
6a5r 16 P84243 100.0 5e-96 EM
2018-10-03 THR P:49 a:45 81.0 0.579 H -70.9 -38.0 80.0 0.571 0.008 V:P04908:0.007
DA
DC
DG
DT
DG
9.646
9.158
6.400
4.321
8.634
N
N
N
N
CB
OP1
OP1
O3'
OP1
OP1
THR T:49 e:45 62.0 0.443 H -61.2 -61.0 62.0 0.443 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.019
9.530
7.304
7.488
6.322
4.451
7.190
9.200
9.754
7.286
4.173
2.464
9.243
CG2
CG2
CG2
O
N
N
CB
N
N
CG2
OG1
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
6a5t 16 P84243 100.0 5e-96 EM
2018-10-03 THR P:49 a:45 67.0 0.479 H -85.4 -26.4 58.0 0.414 0.065 V:P04908:0.064
DG
DT
DG
7.728
5.330
8.687
N
N
C
O3'
OP1
OP1
THR T:49 e:45 85.0 0.607 H -76.6 -51.8 75.0 0.536 0.071 R:P04908:0.071
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.842
8.106
7.841
5.758
3.745
8.101
8.252
9.186
5.502
3.379
3.389
9.495
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
6a5u 16 P84243 100.0 5e-96 EM
2018-10-03 THR P:49 a:45 67.0 0.479 H -85.6 -26.2 58.0 0.414 0.065 V:P04908:0.064
DG
DT
DG
DG
DT
7.729
5.330
8.687
5.934
6.968
N
N
C
CG2
O
O3'
OP1
OP1
C4'
OP1
THR T:49 e:45 85.0 0.607 H -76.7 -51.7 75.0 0.536 0.071 R:P04908:0.071
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.842
8.104
7.840
5.758
3.744
8.100
8.254
9.186
5.501
3.379
3.391
9.497
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
6inq 16 P84243 100.0 5e-96 EM
2019-04-03 THR P:49 a:45 66.0 0.471 H -85.6 -26.3 57.0 0.407 0.064 V:P04908:0.064
DG
DT
DG
DG
DT
7.729
5.331
8.686
5.934
6.968
N
N
C
CG2
O
O3'
OP1
OP1
C4'
OP1
THR T:49 e:45 84.0 0.6 H -76.8 -51.6 74.0 0.529 0.071 R:P04908:0.071
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.843
8.104
7.841
5.758
3.744
8.098
8.253
9.186
5.503
3.380
3.391
9.496
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
6ir9 19 P84243 100.0 5e-96 EM
2019-02-20 THR S:49 a:45 66.0 0.471 H -85.5 -26.4 58.0 0.414 0.057 Y:P04908:0.057
DG
DT
DG
7.727
5.330
8.687
N
N
C
O3'
OP1
OP1
THR W:49 e:45 84.0 0.6 H -76.7 -51.7 74.0 0.529 0.071 U:P04908:0.071
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.843
8.106
7.841
5.758
3.744
8.100
8.252
9.185
5.503
3.380
3.391
9.496
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
6j4w 19 P84243 100.0 5e-96 EM
2019-02-20 THR S:49 a:45 81.0 0.579 H -71.1 -37.9 81.0 0.579 0.0 DA
DC
DG
DT
DG
9.647
9.159
6.398
4.319
8.633
N
N
N
N
CB
OP1
OP1
O3'
OP1
OP1
THR W:49 e:45 61.0 0.436 H -61.2 -61.0 61.0 0.436 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.019
9.529
7.305
7.489
6.321
4.451
7.191
9.198
9.755
7.286
4.172
2.464
9.243
CG2
CG2
CG2
O
N
N
CB
N
N
CG2
OG1
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
6j4x 19 P84243 100.0 5e-96 EM
2019-02-20 THR S:49 a:45 65.0 0.464 H -85.6 -26.4 57.0 0.407 0.057 Y:P04908:0.057
DG
DT
DG
7.726
5.327
8.688
N
N
C
O3'
OP1
OP1
THR W:49 e:45 85.0 0.607 H -76.7 -51.6 76.0 0.543 0.064 U:P04908:0.064
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.843
8.105
7.841
5.759
3.744
8.099
8.252
9.183
5.501
3.379
3.392
9.496
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
6j4y 19 P84243 100.0 5e-96 EM
2019-02-20 THR S:49 a:45 67.0 0.479 H -85.6 -26.4 58.0 0.414 0.065 Y:P04908:0.064
DG
DT
DG
7.729
5.329
8.686
N
N
C
O3'
OP1
OP1
THR W:49 e:45 84.0 0.6 H -76.6 -51.7 74.0 0.529 0.071 U:P04908:0.071
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.844
8.104
7.841
5.758
3.744
8.100
8.252
9.184
5.502
3.380
3.391
9.497
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
6j4z 18 P84243 100.0 5e-96 EM
2019-02-20 THR R:49 a:45 66.0 0.471 H -85.5 -26.3 57.0 0.407 0.064 X:P04908:0.064
DG
DT
DG
DG
DT
7.728
5.331
8.686
5.933
6.967
N
N
C
CG2
O
O3'
OP1
OP1
C4'
OP1
THR V:49 e:45 84.0 0.6 H -76.7 -51.7 76.0 0.543 0.057 T:P04908:0.057
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.843
8.104
7.841
5.758
3.744
8.099
8.253
9.186
5.501
3.379
3.391
9.496
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
6j50 18 P84243 100.0 5e-96 EM
2019-02-20 THR R:49 a:45 65.0 0.464 H -85.5 -26.4 57.0 0.407 0.057 X:P04908:0.057
DG
DT
DG
DG
DT
7.728
5.330
8.687
5.934
6.967
N
N
C
CG2
O
O3'
OP1
OP1
C4'
OP1
THR V:49 e:45 85.0 0.607 H -76.7 -51.6 75.0 0.536 0.071 T:P04908:0.071
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.843
8.103
7.842
5.758
3.744
8.100
8.255
9.186
5.501
3.379
3.393
9.497
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
6j51 19 P84243 100.0 5e-96 EM
2019-02-20 THR S:49 a:45 65.0 0.464 H -85.5 -26.3 57.0 0.407 0.057 Y:P04908:0.057
DG
DT
DG
DG
DT
7.730
5.331
8.687
5.933
6.967
N
N
C
CG2
O
O3'
OP1
OP1
C4'
OP1
THR W:49 e:45 85.0 0.607 H -76.7 -51.7 76.0 0.543 0.064 U:P04908:0.064
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.843
8.103
7.842
5.758
3.743
8.099
8.254
9.186
5.501
3.379
3.393
9.496
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP1
3wtp 5 P84243 100.0 1e-95 X-RAY
2014-12-03 THR E:50 E:45 57.0 0.407 H -63.7 -49.8 57.0 0.407 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.061
7.665
8.304
5.478
3.651
7.381
8.739
7.289
8.239
6.491
3.906
2.288
8.888
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5kdm 1 P84243 100.0 4e-95 X-RAY
2016-09-07 THR A:45 A:45 139.0 0.993 S -85.3 -16.3 62.0 0.443 0.55 C:Q9UER7:0.55
7a08 6 P84243 100.0 4e-95 EM
2020-09-23 THR F:45 d:45 65.0 0.464 H -62.6 -43.5 60.0 0.429 0.035 D:Q93077:0.036
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.433
9.702
8.399
7.898
5.405
3.763
7.879
8.004
8.683
6.925
3.795
2.370
8.525
CG2
CG2
O
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP1
THR J:45 NA:NA DO NA DO DO DO NA NA NA
5xm1 1 ? 98.53 1e-94 X-RAY
2018-03-07 THR A:49 A:45 60.0 0.429 H -75.8 -48.7 58.0 0.414 0.015 G:C0HKE1:0.014
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.644
7.232
8.238
6.778
4.124
2.767
9.417
9.710
7.955
7.383
5.367
3.417
7.525
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 56.0 0.4 H -68.5 -46.1 54.0 0.386 0.014 C:C0HKE1:0.014
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.587
7.665
7.557
5.356
3.425
7.538
8.712
7.159
8.205
6.696
4.043
2.931
9.491
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5gxq 1 ? 97.79 2e-94 X-RAY
2017-04-19 THR A:49 A:45 62.0 0.443 H -75.8 -48.3 57.0 0.407 0.036 G:P04908:0.036
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.758
7.141
8.205
7.185
4.147
2.835
9.391
9.421
7.800
7.044
5.085
3.396
7.449
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP2
THR E:49 E:45 54.0 0.386 H -78.0 -46.2 50.0 0.357 0.029 C:P04908:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.797
7.724
7.523
5.245
3.365
7.524
8.546
7.063
8.122
6.780
4.108
2.547
9.290
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
1eqz 4 P84229 97.06 9e-94 X-RAY
2000-04-17 THR E:46 C:45 60.0 0.429 H -58.5 -38.8 55.0 0.393 0.036 G:P02263:0.036
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.481
7.017
8.085
6.846
3.744
2.750
9.370
9.563
7.702
7.312
5.061
3.356
7.575
7.812
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
O
THR I:46 G:45 57.0 0.407 H -77.2 -40.8 56.0 0.4 0.007 C:P02263:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.546
7.615
7.190
5.180
3.256
7.425
9.006
7.424
8.536
6.900
3.955
2.550
9.356
2.660
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
1hq3 3 P84229 97.06 9e-94 X-RAY
2001-01-24 THR C:46 C:45 60.0 0.429 H -63.5 -35.9 60.0 0.429 0.0 PO4
HOH
9.662
4.236
O
N
O4
O
THR G:46 G:45 17.0 0.121 H -63.6 -34.5 17.0 0.121 0.0 CL
HOH
9.954
4.310
N
N
CL
O
1tzy 3 P84229 97.06 9e-94 X-RAY
2004-08-03 THR C:46 C:45 60.0 0.429 H -62.1 -40.7 58.0 0.414 0.015 E:P02263:0.014
PO4
HOH
6.574
2.320
O
O
O1
O
THR G:46 G:45 17.0 0.121 H -69.5 -36.9 17.0 0.121 0.0 CL
HOH
9.900
2.910
N
OG1
CL
O
2aro 3 P84229 97.06 9e-94 X-RAY
2005-08-30 THR C:46 C:45 52.0 0.371 H -68.7 -43.1 52.0 0.371 0.0 PO4
HOH
9.598
4.255
O
N
O3
O
THR G:46 G:45 15.0 0.107 H -65.6 -39.1 15.0 0.107 0.0 HOH
2.695
O
O
2f8n 2 P84233 97.06 9e-94 X-RAY
2006-05-23 THR C:46 A:445 58.0 0.414 H -84.7 -44.6 58.0 0.414 0.0 DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DA
DC
HOH
8.367
7.263
8.463
6.566
3.993
2.790
8.782
7.883
7.536
4.745
2.939
7.397
3.481
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
OG1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
O
THR F:46 E:645 58.0 0.414 H -59.7 -43.1 58.0 0.414 0.0 DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
HOH
9.419
7.475
7.366
5.167
3.362
7.499
8.284
6.832
8.179
6.749
3.481
2.945
9.373
8.529
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
2hio 3 P84229 97.06 9e-94 X-RAY
2000-01-12 THR C:46 C:45 96.0 0.686 H -54.7 -45.7 96.0 0.686 0.0
4kgc 1 P84233 97.06 9e-94 X-RAY
2014-03-26 THR A:46 A:45 59.0 0.421 H -70.7 -48.0 57.0 0.407 0.014 G:Q6AZJ8:0.014
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.249
6.712
8.219
7.004
4.113
2.931
8.996
9.871
7.708
7.430
5.038
3.277
7.559
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
THR E:46 E:45 54.0 0.386 H -66.2 -47.8 54.0 0.386 0.0 DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.811
7.794
7.595
5.292
3.316
7.840
8.262
6.764
8.161
6.629
3.728
2.652
9.038
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
4ld9 1 P84233 97.06 9e-94 X-RAY
2013-08-14 THR A:46 A:45 65.0 0.464 H -89.7 -22.0 65.0 0.464 0.0 DG
DG
DG
DC
DT
DG
DA
DT
DC
DG
DC
9.096
8.351
8.663
7.201
4.186
3.254
8.025
8.018
5.133
3.141
7.800
OG1
OG1
N
CG2
CG2
OG1
O
O
N
N
C
O3'
O5'
OP1
O3'
O3'
OP1
O3'
OP1
O3'
OP1
OP2
THR E:46 E:45 94.0 0.671 H -73.3 -46.3 94.0 0.671 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DG
DA
9.881
8.647
8.378
5.079
3.023
7.187
7.845
8.428
6.640
4.026
2.871
9.350
CG2
O
O
N
N
CB
OG1
N
CG2
OG1
OG1
OG1
C2'
O3'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
O3'
OP1
OP2
4uuz 1 P02299 97.06 9e-94 X-RAY
2015-02-11 THR A:46 NA:NA DO NA DO DO DO NA NA NA
5kgf 1 P84233 97.06 9e-94 EM
2016-07-27 THR A:46 A:45 49.0 0.35 H -65.9 -35.2 49.0 0.35 0.0 DT
DA
DC
DT
DC
DG
DA
DG
DT
DG
DT
DG
9.319
7.853
7.859
8.062
4.669
3.341
9.720
8.369
8.298
4.756
2.894
7.628
OG1
N
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
O3'
C5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:46 E:45 56.0 0.4 H -65.8 -35.4 53.0 0.379 0.021 C:P0C0S8:0.021
DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DG
DA
9.933
8.294
7.599
5.125
3.149
7.375
9.998
8.049
8.004
6.747
3.916
3.167
9.745
CG2
O
O
N
N
C
N
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5x0x 1 P84233 97.06 9e-94 EM
2017-04-19 THR A:46 A:45 64.0 0.457 H -81.2 -43.8 62.0 0.443 0.014 G:Q6AZJ8:0.014
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
8.907
8.771
5.059
3.215
7.574
8.170
8.916
7.185
4.526
3.217
9.426
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C4'
OP1
OP1
THR E:46 E:45 62.0 0.443 H -81.1 -43.8 62.0 0.443 0.0 DA
DC
DC
DC
DG
DA
DT
DG
DT
DG
8.407
8.610
6.930
4.605
3.461
8.977
9.962
5.175
3.212
8.180
N
N
CG2
CG2
CG2
OG1
CG2
N
N
C
O3'
OP1
O3'
O5'
OP1
OP2
C5'
O3'
OP1
OP1
6dzt 1 P02299 97.06 9e-94 EM
2019-05-22 THR A:46 A:45 57.0 0.407 H -71.2 -52.8 57.0 0.407 0.0 DG
DG
DC
DT
DC
DG
DG
DA
DA
DT
DC
DG
DC
8.360
8.193
6.799
4.256
2.463
8.853
8.879
9.132
7.788
7.997
5.876
3.690
7.563
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
C
OP1
OP1
O3'
O3'
OP1
OP1
N2
O3'
C5'
OP1
O3'
OP1
OP2
THR E:46 E:45 58.0 0.414 H -83.0 -49.3 58.0 0.414 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DG
9.527
8.196
7.997
5.361
3.443
7.511
8.045
8.101
6.694
4.130
2.467
8.867
CG2
CG2
O
N
N
C
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
C4'
OP1
OP1
6kw3 2 P84233 97.06 9e-94 EM
2019-11-13 THR B:46 N:45 78.0 0.557 H -70.2 -47.4 59.0 0.421 0.136 F:Q6AZJ8:0.136
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
9.072
9.579
8.977
7.549
5.206
8.326
9.633
9.166
5.019
3.394
4.207
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
N2
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O5'
OP1
THR D:46 Q:45 65.0 0.464 H -69.6 -31.3 62.0 0.443 0.021 C:Q6AZJ8:0.021
DA
DC
DG
DT
DG
9.005
8.618
5.682
3.827
5.944
CG2
N
N
N
OG1
OP1
OP1
O3'
OP1
OP1
6kw4 1 P84233 97.06 9e-94 EM
2019-11-13 THR A:46 N:45 80.0 0.571 H -82.1 -40.8 64.0 0.457 0.114 F:Q6AZJ8:0.114
DG
DT
DC
DG
DC
DG
DC
DT
DC
DA
9.740
8.882
9.256
6.877
8.935
9.793
5.333
3.509
3.695
9.580
CG2
O
N
N
C
N
CG2
CG2
OG1
OG1
N2
OP1
O3'
OP1
OP2
OP1
O3'
O5'
OP1
OP2
THR D:46 Q:45 61.0 0.436 S -81.3 -34.3 55.0 0.393 0.043 C:Q6AZJ8:0.043
DA
DC
DG
DT
DG
8.472
7.964
5.635
3.568
6.747
CG2
N
N
N
OG1
OP1
OP1
O3'
OP1
OP1
6kw5 16 P84233 97.06 9e-94 EM
2020-09-09 THR Q:46 R:45 66.0 0.471 H -89.0 -44.5 63.0 0.45 0.021 U:Q6AZJ8:0.021
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DA
9.448
8.899
7.864
7.268
5.229
7.132
9.309
8.704
6.944
2.598
1.345
8.530
OG1
O
O
N
C
OG1
N
N
CG2
CG2
CG2
OG1
O3'
O3'
OP1
O3'
OP1
OP1
O3'
OP1
O3'
O3'
OP2
P
THR T:46 V:45 70.0 0.5 H -71.0 -47.0 70.0 0.5 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
9.925
9.654
6.556
4.309
3.194
9.373
9.448
7.880
7.610
6.628
4.446
7.474
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
C5'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
6o22 4 P84233 97.06 9e-94 NMR
SOLUTION SCATTERING
2019-07-31 THR E:46 NA:NA DO NA DO DO DO NA NA NA
6pwe 1 P02299 97.06 9e-94 EM
2019-08-21 THR A:46 A:45 43.0 0.307 T -104.6 -51.6 43.0 0.307 0.0 DG
DG
DC
DT
DC
DG
DG
DA
DA
DT
DC
DG
DC
8.436
9.049
7.121
3.567
2.745
8.668
9.702
9.693
8.478
8.156
5.717
3.804
7.443
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
CB
OP1
OP1
O3'
O3'
OP1
OP2
N2
N3
C5'
OP1
O3'
OP1
OP1
THR E:46 E:45 45.0 0.321 T -104.5 -51.7 45.0 0.321 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DG
9.312
8.815
8.870
5.957
3.916
7.690
8.074
9.246
7.320
4.389
2.659
8.390
CG2
CG2
O
N
N
CB
OG1
N
CG2
CG2
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
6pwf 1 P02299 97.06 9e-94 EM
2019-08-21 THR A:46 A:45 42.0 0.3 S -114.0 -56.7 42.0 0.3 0.0 DG
DG
DC
DT
DC
DG
DG
DA
DT
DC
DG
DC
8.193
8.355
7.708
4.295
3.216
9.216
9.892
8.363
8.646
5.369
3.098
7.377
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CG2
C5'
OP1
O3'
O3'
OP1
OP2
N2
C4'
OP1
O3'
OP1
OP1
THR E:46 E:45 42.0 0.3 S -114.0 -56.8 41.0 0.293 0.007 C:P84051:0.007
DG
DA
DT
DG
DG
DT
DG
DA
DC
DT
DC
DC
DG
9.915
8.602
8.027
9.207
5.743
3.846
7.555
8.230
7.657
9.555
4.781
2.877
9.239
CG2
CG2
CG2
O
N
N
CG2
N
N
CG2
OG1
OG1
OG1
N2
O3'
OP1
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
6wkr 9 P84233 97.06 9e-94 EM
2021-02-03 THR I:46 I:45 67.0 0.479 H -103.9 -24.4 67.0 0.479 0.0 DG
DA
DT
DC
DC
DA
DA
DA
DC
DC
DG
9.098
9.127
7.862
5.176
4.251
9.987
9.104
8.589
5.366
3.351
7.494
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
OP1
OP1
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP2
OP2
THR M:46 O:45 62.0 0.443 H -85.8 -27.9 62.0 0.443 0.0 DT
DA
DT
DG
DC
DT
DA
DA
DT
DC
DC
9.717
9.318
4.891
3.007
7.586
8.474
7.957
8.913
5.362
4.191
9.395
O
O
N
N
C
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
O3'
OP1
OP2
7jo9 1 Q71DI3 97.06 9e-94 EM
2020-09-16 THR A:46 A:45 62.0 0.443 S -120.7 -47.8 62.0 0.443 0.0 DG
DG
DG
DC
DT
DC
DG
DA
DT
DC
DG
DC
9.929
8.528
8.739
7.194
4.751
3.422
9.709
8.908
8.932
5.656
3.651
8.107
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
C4'
OP1
O3'
OP1
OP2
THR E:46 E:45 57.0 0.407 S -117.0 -50.4 57.0 0.407 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DG
9.846
8.494
8.931
5.481
3.648
8.001
8.947
8.807
7.505
4.847
3.397
9.900
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
7joa 1 Q71DI3 97.06 9e-94 EM
2020-09-16 THR A:46 A:45 64.0 0.457 S -112.9 -39.4 64.0 0.457 0.0 DG
DG
DG
DC
DT
DC
DG
DG
DA
DT
DC
DG
DC
9.961
8.529
8.597
7.556
4.537
3.198
9.505
9.938
8.775
9.125
5.592
3.599
8.011
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
N2
C5'
OP1
O3'
OP1
OP2
THR E:46 E:45 62.0 0.443 S -115.2 -36.3 62.0 0.443 0.0 DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DG
8.953
9.000
5.574
3.542
7.925
8.903
8.592
7.405
4.632
3.111
9.657
CG2
O
N
N
C
OG1
N
CG2
CG2
OG1
OG1
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
7kbd 1 P84233 97.06 9e-94 EM
2021-09-15 THR A:46 A:45 60.0 0.429 S -119.0 -39.2 53.0 0.379 0.05 G:Q6DKE3:0.05
DG
DG
DG
DT
DG
DA
DA
DT
DC
DG
DC
8.364
8.423
6.321
4.260
2.970
9.966
8.028
6.965
6.010
3.686
7.772
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
OG1
OP1
OP1
O3'
O5'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
THR E:46 E:45 62.0 0.443 S -119.0 -39.1 59.0 0.421 0.022 C:Q6DKE3:0.021
DA
DT
DG
DT
DG
DT
DA
DC
DG
DT
DG
DA
8.276
7.862
5.894
3.729
7.277
9.817
8.613
8.691
6.542
4.327
2.932
9.483
O
O
N
N
OG1
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
7kbe 1 P84233 97.06 9e-94 EM
2021-09-15 THR A:46 A:45 56.0 0.4 H -68.9 -35.4 56.0 0.4 0.0 DG
DG
DG
DT
DG
DA
DA
DT
DC
DG
DC
8.371
8.319
6.684
4.813
3.184
9.859
8.626
8.819
5.889
3.828
7.057
N
N
OG1
OG1
CG2
CG2
O
O
N
N
CG2
C5'
OP1
O3'
C5'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
THR E:46 E:45 62.0 0.443 H -63.1 -44.7 62.0 0.443 0.0 DA
DA
DT
DG
DT
DG
DA
DC
DG
DT
DG
9.427
7.983
8.529
6.103
3.963
7.745
8.403
9.198
6.078
3.827
3.026
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
7kbf 1 P84233 97.06 9e-94 EM
2021-09-15 THR A:46 A:45 36.0 0.257 H -62.1 -62.2 36.0 0.257 0.0 DA
DC
DG
DT
DG
DA
DA
DA
DT
DG
DT
DG
8.382
9.560
7.354
4.374
2.579
9.604
9.996
7.719
8.009
5.107
2.831
6.367
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
THR E:46 E:45 62.0 0.443 H -54.8 -47.7 62.0 0.443 0.0 DA
DT
DG
DT
DG
DA
DC
DG
DT
DG
DA
8.007
7.598
5.561
3.545
6.361
8.990
9.587
7.820
4.889
3.184
9.474
O
O
N
N
OG1
N
N
CG2
CG2
OG1
CG2
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP1
3av1 1 Q71DI3 97.06 1e-93 X-RAY
2011-06-01 THR A:49 A:45 63.0 0.45 H -61.7 -46.0 59.0 0.421 0.029 G:P04908:0.029
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.560
7.074
8.121
7.016
3.979
2.885
9.440
9.461
7.695
6.908
5.125
3.485
7.288
7.785
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 56.0 0.4 H -67.3 -47.8 52.0 0.371 0.029 C:P04908:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.619
7.505
7.901
5.257
3.434
7.248
8.565
7.149
8.180
6.853
3.939
2.645
9.369
7.486
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5b0z 1 Q71DI3 97.06 1e-93 X-RAY
2016-01-27 THR A:49 A:45 60.0 0.429 H -72.3 -39.6 58.0 0.414 0.015 G:P04908:0.014
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.526
6.877
8.314
6.496
3.753
2.647
8.604
9.609
8.088
7.779
5.244
3.272
7.436
2.737
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP2
O
THR E:49 E:45 55.0 0.393 H -70.9 -46.3 52.0 0.371 0.022 C:P04908:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.430
7.947
7.806
5.173
3.284
7.591
8.500
6.777
8.054
6.677
3.918
2.601
8.895
6.967
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
C
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
6g0l 1 Q92133 96.32 5e-93 EM
2018-08-22 THR A:46 A:45 35.0 0.25 S -97.9 -20.3 35.0 0.25 0.0 DT
DA
DC
DG
DT
DG
9.589
8.014
9.024
5.615
3.559
6.263
N
N
N
N
N
CG2
O3'
C5'
OP1
O3'
OP1
OP1
THR E:46 E:45 44.0 0.314 -103.6 -36.7 44.0 0.314 0.0 DC
DG
DC
DG
DG
DG
6.510
4.627
4.660
9.559
8.033
9.306
N
N
CG2
N
N
N
O3'
OP1
OP1
O3'
OP1
OP1
6vz4 1 Q92133 96.32 5e-93 EM
2020-12-02 THR A:46 A:46 52.0 0.371 H -63.7 -47.2 52.0 0.371 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.544
9.739
8.143
8.347
6.653
4.406
8.201
8.891
8.795
6.682
3.986
3.341
9.789
CG2
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
THR E:46 E:46 56.0 0.4 H -63.2 -47.7 56.0 0.4 0.0 DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
9.511
8.377
7.091
4.207
2.536
8.960
8.848
8.860
6.134
3.989
8.012
N
N
CG2
CG2
OG1
OG1
CG2
O
N
N
CB
C4'
OP1
O3'
O3'
OP1
OP2
C5'
OP1
O3'
OP1
OP1
5b0y 1 Q71DI3 96.32 5e-93 X-RAY
2016-01-27 THR A:46 A:45 62.0 0.443 H -67.7 -38.6 59.0 0.421 0.022 G:P04908:0.021
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.671
6.991
8.349
6.960
3.878
2.829
9.267
9.261
8.029
7.722
5.046
3.337
7.586
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP2
THR E:46 E:45 56.0 0.4 H -68.1 -43.5 53.0 0.379 0.021 C:P04908:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.679
7.797
7.732
5.280
3.425
7.552
8.633
7.218
8.180
6.811
4.016
2.755
9.378
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
7cow 3 P68431 96.32 5e-93 X-RAY
2021-08-11 THR C:48 A:45 70.0 0.5 H -66.4 -25.2 57.0 0.407 0.093 I:P04908:0.093
DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DA
9.619
9.616
8.139
7.887
4.979
3.075
7.139
9.885
7.953
8.080
6.704
3.684
3.794
CG2
CG2
O
O
N
N
C
N
N
N
CG2
CG2
CB
N2
O3'
O3'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
THR G:48 E:45 56.0 0.4 S -105.8 -53.0 56.0 0.4 0.0 DT
DA
DC
DT
DG
DA
DA
DT
DG
DT
DG
DT
DG
9.244
7.657
7.600
7.511
4.624
3.483
9.509
9.908
8.431
8.319
4.793
2.783
7.167
OG1
OG1
N
CG2
CG2
CG2
OG1
CG2
O
O
N
N
C
O3'
C5'
OP1
O3'
C4'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP2
THR K:48 K:45 65.0 0.464 H -91.5 -38.2 60.0 0.429 0.035 Q:P04908:0.036
DT
DA
DC
DG
DA
DA
DT
DG
DG
DT
DG
8.967
7.302
7.691
7.602
3.549
4.036
8.656
8.373
4.976
2.951
7.658
OG1
OG1
N
CG2
CG2
OG1
O
O
N
N
C
O3'
C5'
OP1
O3'
O3'
OP1
O3'
C5'
O3'
OP1
OP2
THR O:48 O:45 69.0 0.493 H -78.1 -49.8 65.0 0.464 0.029 M:P04908:0.029
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
9.963
8.481
8.784
5.053
3.118
7.300
9.226
7.630
7.748
7.361
3.953
3.235
9.383
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3lel 1 P84233 96.32 5e-93 X-RAY
2010-05-19 THR A:46 A:45 60.0 0.429 H -84.6 -31.5 60.0 0.429 0.0 DT
DA
DA
DT
DT
DG
DA
DA
DT
DG
DA
DA
9.649
7.999
8.881
6.828
4.622
3.030
9.363
7.620
7.236
4.802
2.812
7.379
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
OP1
OP1
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
THR E:46 E:45 61.0 0.436 S -129.9 -39.7 58.0 0.414 0.022 C:Q6AZJ8:0.021
DA
DT
DG
DA
DA
DA
DA
DT
DT
DG
DA
7.590
6.862
4.976
2.876
7.465
8.802
8.652
6.730
4.311
3.105
9.825
O
O
N
N
C
OG1
OG1
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
THR K:46 K:45 54.0 0.386 S -110.0 -35.2 NA NA NA
THR O:46 O:45 56.0 0.4 H -71.1 -53.3 NA NA NA
4zux 1 P84233 96.32 5e-93 X-RAY
2016-02-24 THR A:46 A:45 52.0 0.371 H -79.1 -39.0 52.0 0.371 0.0 DA
DC
DT
DC
DG
DA
DT
DG
DT
DG
DT
DG
8.994
8.981
8.280
4.246
2.842
8.878
9.401
8.153
8.658
5.000
3.145
7.093
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR E:46 E:45 57.0 0.407 H -92.8 -28.0 57.0 0.407 0.0 DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DG
DA
7.998
7.707
4.761
2.931
7.027
8.877
7.199
7.678
6.678
3.776
3.052
9.666
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR K:46 K:45 58.0 0.414 H -78.8 -38.6 NA NA NA
THR O:46 O:45 55.0 0.393 H -78.9 -38.9 NA NA NA
5e5a 2 P84233 96.32 5e-93 X-RAY
2016-02-03 THR C:46 A:45 57.0 0.407 H -71.4 -47.7 57.0 0.407 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.665
7.225
8.371
6.909
4.095
2.616
9.354
9.273
7.590
7.012
5.147
3.410
7.438
2.714
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR G:46 E:45 55.0 0.393 H -71.8 -47.2 52.0 0.371 0.022 E:Q6AZJ8:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.357
7.688
7.268
5.299
3.392
7.408
8.895
7.235
8.296
6.989
4.044
2.498
9.201
3.072
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5o9g 1 P84233 96.32 5e-93 EM
2017-10-11 THR A:46 A:45 56.0 0.4 H -68.8 -36.5 34.0 0.243 0.157 B:P62799:0.021
G:Q6AZJ8:0.136
DG
DT
7.015
5.390
N
N
O3'
OP1
THR E:46 E:45 50.0 0.357 H -70.6 -32.5 30.0 0.214 0.143 C:Q6AZJ8:0.143
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
8.791
7.921
6.724
4.878
9.220
8.767
8.590
7.041
5.213
4.328
O
O
N
N
C
OG1
N
CG2
CG2
OG1
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O5'
OP1
6i84 1 P84233 96.32 5e-93 EM
2019-01-02 THR A:46 M:45 49.0 0.35 H -78.7 -54.7 49.0 0.35 0.0 DC
DG
DA
DT
DG
DT
DG
DT
DG
6.431
5.547
8.566
7.991
7.923
8.558
5.554
3.182
6.901
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
C4'
C4'
OP1
O3'
OP1
OP2
THR H:46 S:45 60.0 0.429 S -70.6 -45.7 54.0 0.386 0.043 B:P06897:0.043
DG
DC
DC
DG
DC
DG
DG
DG
DG
DC
DT
DG
DA
8.761
9.587
4.471
2.729
7.980
9.928
9.747
9.099
8.768
5.514
3.322
2.308
8.387
CG2
N
N
N
CG2
N
OG1
OG1
N
O
CG2
OG1
OG1
N2
O3'
O3'
OP1
OP1
N2
C5'
C5'
OP1
O3'
O5'
OP1
P
6j99 1 A0A310TTQ1 96.32 5e-93 EM
2019-02-27 THR A:46 A:45 57.0 0.407 H -60.5 -64.6 48.0 0.343 0.064 G:Q6AZJ8:0.064
DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
8.238
9.393
5.680
3.677
4.542
9.222
9.116
8.309
6.652
6.314
8.262
N
N
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
C5'
OP1
O3'
C5'
OP1
O2
O3'
OP1
O3'
OP2
OP2
THR E:46 E:45 57.0 0.407 H -60.6 -64.5 57.0 0.407 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
8.918
9.078
8.701
7.924
6.738
4.578
7.118
8.281
9.210
6.941
4.814
2.587
8.140
CG2
CG2
CG2
O
N
N
CG2
N
N
CG2
CG2
OG1
OG1
N2
C4'
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP1
6ne3 1 P84233 96.32 5e-93 EM
2019-07-17 THR A:46 A:45 48.0 0.343 T -118.9 -47.4 48.0 0.343 0.0 DG
DC
DC
DT
DG
DT
DG
DG
DA
DT
DA
DC
DG
9.314
8.686
6.725
4.066
2.944
8.752
9.129
9.720
8.696
8.625
5.393
3.494
7.597
N
N
CG2
CG2
OG1
OG1
CG2
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP1
N2
O3'
C5'
OP1
O3'
OP1
OP1
THR E:46 E:45 50.0 0.357 S -106.7 -25.5 48.0 0.343 0.014 C:P06897:0.014
DC
DC
DC
DG
DT
DG
DG
DT
DT
DC
DT
8.321
7.827
5.478
3.497
7.044
8.486
8.289
6.723
4.748
3.324
9.720
O
O
N
N
CG2
N
N
OG1
CG2
CG2
CG2
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
6pwv 4 P84233 96.32 5e-93 EM
2019-12-18 THR D:46 G:45 41.0 0.293 H -49.7 -52.7 36.0 0.257 0.036 J:P06897:0.036
DA
DT
DC
DC
DG
DC
DG
DG
DG
DC
DT
DC
8.180
8.417
9.993
4.535
2.820
6.500
9.480
8.467
8.905
7.886
5.634
4.157
O
O
N
N
N
OG1
CG2
CG2
N
CG2
CG2
CG2
C4'
OP1
O3'
O3'
OP1
OP1
O3'
O5'
OP1
O3'
OP1
OP1
THR H:46 K:45 40.0 0.286 H -49.6 -52.7 35.0 0.25 0.036 F:P06897:0.036
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.912
9.058
8.510
4.507
3.186
9.422
9.994
8.023
8.379
4.733
2.980
5.500
CG2
N
CB
CG2
OG1
CG2
OG1
O
O
N
N
OG1
O5'
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
6pww 4 P84233 96.32 5e-93 EM
2019-12-18 THR D:46 G:45 45.0 0.321 H -52.8 -51.1 39.0 0.279 0.042 I:P06897:0.043
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
9.802
8.261
8.637
4.782
3.140
6.701
9.344
8.431
8.753
7.633
5.389
4.026
OG1
O
O
N
N
OG1
CG2
CG2
N
CB
CB
CG2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
O5'
OP1
O3'
C5'
OP1
THR H:46 K:45 46.0 0.329 H -52.8 -51.0 38.0 0.271 0.058 F:P06897:0.05
M:P62799:0.007
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.914
8.464
8.266
4.396
3.296
9.356
9.870
8.120
8.464
4.906
3.118
5.779
CG2
N
CB
CG2
OG1
CG2
OG1
O
O
N
N
OG1
O5'
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
6pwx 2 P84233 96.32 5e-93 EM
2019-12-18 THR B:46 G:45 59.0 0.421 H -62.1 -51.1 48.0 0.343 0.078 G:P06897:0.079
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
8.223
8.146
5.490
3.472
6.480
8.909
8.845
7.286
5.001
3.434
O
O
N
N
OG1
N
N
CB
CG2
CG2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
THR F:46 K:45 59.0 0.421 H -62.1 -51.0 48.0 0.343 0.078 D:P06897:0.079
DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.650
8.194
7.965
4.024
3.122
8.947
8.366
8.121
5.281
3.331
6.107
CG2
N
CB
CG2
OG1
OG1
O
O
N
N
OG1
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
6ryr 1 P84233 96.32 5e-93 EM
2020-07-15 THR A:46 A:45 34.0 0.243 H -71.7 -47.1 34.0 0.243 0.0 DT
DA
DC
DT
DC
DG
DT
DG
DT
DG
DT
DG
8.993
7.979
7.965
7.160
4.918
5.472
9.901
8.736
9.139
5.055
3.181
7.672
OG1
OG1
N
CG2
CG2
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
C5'
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR E:46 E:45 40.0 0.286 H -72.2 -45.5 40.0 0.286 0.0 DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.790
8.672
7.938
5.801
3.628
7.062
7.986
8.851
6.895
4.915
4.848
8.802
CG2
CG2
O
N
N
CG2
N
N
OG1
OG1
CG2
CG2
O3'
C5'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP2
6ryu 1 P84233 96.32 5e-93 EM
2020-07-15 THR A:46 A:45 54.0 0.386 S -128.1 -23.2 52.0 0.371 0.015 G:P06897:0.014
DT
DA
DC
DT
DC
DG
DG
DT
DG
DT
DG
9.992
7.925
8.232
7.558
5.011
3.258
8.627
6.966
5.367
3.304
7.528
OG1
OG1
N
CG2
CG2
CG2
O
O
N
N
C
O3'
C5'
OP1
O3'
O3'
OP1
O3'
OP1
O3'
OP1
OP2
THR E:46 E:45 65.0 0.464 T -88.1 -4.6 60.0 0.429 0.035 C:P06897:0.036
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.327
8.034
7.953
6.283
4.063
7.092
8.498
8.872
5.826
3.673
3.311
9.748
OG1
O
O
N
N
CG2
N
N
OG1
OG1
CG2
CG2
N2
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
OP2
6w5i 5 P84233 96.32 5e-93 EM
2021-03-31 THR E:46 G:45 41.0 0.293 H -49.7 -52.7 41.0 0.293 0.0 DA
DT
DC
DC
DG
DC
DG
DG
DG
DC
DT
DC
9.015
9.439
9.951
4.889
3.460
7.273
9.143
8.143
8.647
7.980
5.739
4.059
O
O
N
N
C
OG1
CG2
CG2
N
CB
CG2
CG2
C4'
OP1
O3'
O3'
OP1
OP1
O3'
O5'
OP1
O3'
OP1
OP1
THR I:46 K:45 42.0 0.3 H -49.7 -52.7 41.0 0.293 0.007 G:Q6AZJ8:0.007
DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.940
9.118
8.643
4.643
3.324
9.540
8.700
8.916
4.882
3.301
6.083
CG2
N
CG2
CG2
CG2
CG2
O
O
N
OG1
OG1
O5'
OP1
O3'
O3'
OP1
OP1
C5'
OP1
O3'
OP1
OP1
6w5m 5 P84233 96.32 5e-93 EM
2021-03-31 THR E:46 G:45 41.0 0.293 H -49.7 -52.6 36.0 0.257 0.036 K:P06897:0.036
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
8.848
9.069
4.961
3.563
7.301
9.533
8.409
8.607
7.746
5.504
4.272
O
O
N
N
OG1
CG2
CG2
N
CB
CG2
OG1
C4'
OP1
O3'
OP1
OP1
O3'
O5'
OP1
O3'
OP1
OP1
THR I:46 K:45 41.0 0.293 H -49.7 -52.7 40.0 0.286 0.007 G:P06897:0.007
DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.830
9.008
8.628
4.541
3.205
9.372
8.318
8.637
4.668
3.106
5.706
CG2
N
CB
CG2
OG1
CG2
O
O
N
N
OG1
O5'
OP1
O3'
O3'
OP1
OP1
C5'
OP1
O3'
OP1
OP1
6w5n 5 P84233 96.32 5e-93 EM
2021-03-31 THR E:46 G:45 40.0 0.286 H -49.7 -52.7 39.0 0.279 0.007 K:P06897:0.007
DA
DT
DC
DC
DG
DC
DG
DG
DG
DC
DT
DC
8.987
9.127
9.819
4.873
3.385
7.398
9.640
8.517
8.668
7.667
5.420
4.289
O
O
N
N
OG1
OG1
CG2
CG2
N
CB
CG2
OG1
O3'
OP1
O3'
O3'
OP1
OP1
O3'
O5'
OP1
O3'
OP1
OP1
THR I:46 K:45 40.0 0.286 H -49.6 -52.7 38.0 0.271 0.015 G:P06897:0.014
DA
DC
DT
DC
DC
DG
DG
DT
DC
DG
DT
DG
8.745
8.761
8.558
4.737
3.245
9.533
8.938
9.260
9.922
4.870
3.367
6.219
CG2
N
CB
CG2
OG1
CG2
O
O
N
N
OG1
OG1
O5'
OP1
O3'
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
7nkx 11 P84233 96.32 5e-93 EM
2021-08-25 THR K:46 NA:NA DO NA DO DO DO NA NA NA
THR O:46 e:45 40.0 0.286 H -71.6 -44.2 25.0 0.179 0.107 M:P06897:0.107
DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DG
DA
9.450
9.619
8.524
8.272
5.981
3.698
6.451
9.308
7.908
8.878
7.931
4.978
4.593
9.056
OG1
OG1
O
O
N
N
OG1
CG2
CG2
N
CB
CG2
CG2
CG2
N2
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
7nky 20 P84233 96.32 5e-93 EM
2021-07-07 THR T:46 a:45 153.0 1.0 360.0 -35.5 106.0 0.757 0.243 S:P32558:0.336
DG
DT
DG
DT
DA
DC
5.422
3.393
7.777
9.269
7.597
8.765
N
N
N
N
OG1
N
O3'
OP1
OP1
O3'
OP1
OP1
THR X:46 e:45 55.0 0.393 H -63.9 -44.4 47.0 0.336 0.057 V:P06897:0.057
DG
DG
DC
DT
DG
DA
DA
DT
DC
DG
DC
8.116
8.328
7.765
4.336
3.017
9.761
8.883
8.571
5.347
3.492
6.927
CG2
N
CB
CG2
CG2
OG1
O
O
N
N
OG1
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
3afa 1 P68431 96.32 7e-93 X-RAY
2010-05-26 THR A:49 A:45 60.0 0.429 H -64.5 -45.5 54.0 0.386 0.043 G:P04908:0.043
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.471
6.995
8.112
7.089
3.957
2.771
9.434
9.436
7.648
6.981
5.020
3.423
7.219
7.895
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 56.0 0.4 H -69.4 -48.9 52.0 0.371 0.029 C:P04908:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.769
7.486
7.683
5.150
3.357
7.218
8.409
7.023
8.120
6.721
3.856
2.570
9.289
5.579
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
3azi 1 P68431 96.32 7e-93 X-RAY
2011-09-21 THR A:49 A:45 63.0 0.45 H -90.8 -42.7 57.0 0.407 0.043 G:P04908:0.043
DA
DG
DC
DA
DT
DT
DG
DT
DC
DA
DA
DC
8.428
7.076
8.753
6.583
3.951
3.448
9.499
8.350
7.466
4.744
2.995
7.142
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
THR E:49 E:45 59.0 0.421 H -71.7 -45.5 58.0 0.414 0.007 C:P04908:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.645
7.628
7.795
5.078
3.388
6.951
8.080
6.371
8.727
6.602
3.800
2.693
9.331
7.092
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
3azj 1 P68431 96.32 7e-93 X-RAY
2011-09-21 THR A:49 A:45 57.0 0.407 H -71.4 -43.3 57.0 0.407 0.0 DA
DG
DC
DA
DT
DT
DG
DT
DC
DA
DA
DC
7.881
6.851
8.286
6.922
3.783
2.890
9.080
8.081
7.339
4.834
3.169
7.242
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 52.0 0.371 H -68.5 -43.4 52.0 0.371 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.990
7.623
7.793
5.306
3.739
7.154
8.521
7.226
8.274
6.561
3.718
2.629
9.279
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
C4'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3azk 1 P68431 96.32 7e-93 X-RAY
2011-09-21 THR A:49 A:45 62.0 0.443 H -64.5 -55.4 54.0 0.386 0.057 G:P04908:0.057
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.724
7.490
8.056
7.269
4.409
3.428
9.779
9.601
8.007
7.124
4.872
3.253
7.196
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 60.0 0.429 H -83.4 -32.8 57.0 0.407 0.022 C:P04908:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.880
7.779
7.733
5.071
3.272
7.507
8.672
7.141
8.035
6.909
3.744
3.299
9.578
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3azl 1 P68431 96.32 7e-93 X-RAY
2011-09-21 THR A:49 A:45 59.0 0.421 H -63.6 -44.0 55.0 0.393 0.028 G:P04908:0.029
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.600
7.046
8.181
7.122
4.147
2.565
9.357
9.197
7.657
6.935
5.160
3.427
7.294
7.406
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 59.0 0.421 H -67.1 -43.9 55.0 0.393 0.028 C:P04908:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.704
7.633
7.731
5.325
3.475
7.639
8.530
7.013
8.167
6.826
3.780
2.764
9.315
5.588
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
3azm 1 P68431 96.32 7e-93 X-RAY
2011-09-21 THR A:49 A:45 51.0 0.364 S -109.7 -27.5 48.0 0.343 0.021 G:P04908:0.021
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.387
7.333
8.236
6.947
3.865
3.529
9.319
9.831
7.819
7.805
4.723
3.173
7.775
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O4'
O3'
OP1
O3'
OP1
OP2
THR E:49 E:45 56.0 0.4 H -64.3 -34.4 56.0 0.4 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.113
7.395
7.768
5.303
3.597
7.687
8.373
7.204
7.917
6.814
3.763
2.772
9.495
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
OG1
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3azn 1 P68431 96.32 7e-93 X-RAY
2011-09-21 THR A:49 A:45 58.0 0.414 H -70.3 -40.1 53.0 0.379 0.035 G:P04908:0.036
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.458
7.224
8.174
7.219
4.023
2.740
9.304
9.552
7.819
6.612
4.980
3.266
7.117
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 56.0 0.4 H -67.1 -38.0 53.0 0.379 0.021 C:P04908:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.713
7.512
7.301
5.383
3.619
7.569
8.390
7.084
8.344
6.622
3.602
2.813
9.140
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3w96 1 P68431 96.32 7e-93 X-RAY
2013-08-28 THR A:49 A:45 63.0 0.45 H -67.2 -43.6 61.0 0.436 0.014 G:P04908:0.014
DA
DG
DC
DA
DT
DT
DG
DT
DC
DA
DA
DC
8.224
7.207
8.004
6.470
3.687
2.974
8.932
8.480
7.758
5.032
3.625
7.739
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 54.0 0.386 H -66.4 -36.9 53.0 0.379 0.007 C:P04908:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.769
7.925
8.336
5.116
3.622
7.513
8.245
6.853
8.057
6.795
3.904
3.121
9.553
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3w97 1 P68431 96.32 7e-93 X-RAY
2013-08-28 THR A:49 A:45 58.0 0.414 H -75.6 -26.5 57.0 0.407 0.007 G:P04908:0.007
DA
DG
DC
DA
DT
DT
DG
DT
DC
DA
DA
DC
8.417
7.195
8.276
6.594
3.922
3.072
8.874
8.361
7.649
4.776
3.156
7.683
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 60.0 0.429 H -62.7 -39.9 60.0 0.429 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.802
7.759
7.997
5.375
3.763
7.106
8.239
6.992
8.083
6.720
3.703
2.955
9.266
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3w99 1 P68431 96.32 7e-93 X-RAY
2013-08-28 THR A:49 A:45 60.0 0.429 H -78.3 -38.3 60.0 0.429 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.144
7.258
8.462
6.557
3.561
2.738
8.877
9.911
8.159
7.709
4.817
3.158
7.215
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
N3
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 60.0 0.429 H -64.1 -47.8 60.0 0.429 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.597
7.543
8.433
5.245
3.577
7.149
8.374
7.095
8.197
6.786
3.838
2.775
9.438
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3wa9 1 P68431 96.32 7e-93 X-RAY
2013-12-18 THR A:49 A:45 60.0 0.429 H -73.0 -52.7 60.0 0.429 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.638
7.016
8.210
7.065
4.223
3.009
9.577
9.435
7.701
7.020
5.128
3.214
7.380
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
THR E:49 E:45 54.0 0.386 H -82.6 -42.6 54.0 0.386 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.625
7.699
7.135
5.188
3.386
7.460
8.413
6.990
8.251
6.503
3.921
2.597
9.098
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3waa 1 P68431 96.32 7e-93 X-RAY
2013-12-18 THR A:49 A:45 57.0 0.407 H -76.8 -53.6 57.0 0.407 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.712
7.063
8.140
7.251
4.213
2.989
9.424
9.500
7.921
7.213
5.159
3.257
7.434
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
THR E:49 E:45 53.0 0.379 H -74.0 -48.4 53.0 0.379 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.929
7.836
7.302
5.401
3.515
7.474
8.493
6.995
8.082
6.681
3.803
2.856
9.153
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3wkj 1 P68431 96.32 7e-93 X-RAY
2014-04-09 THR A:49 A:45 57.0 0.407 H -70.2 -38.5 54.0 0.386 0.021 G:P04908:0.021
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.537
7.170
8.158
7.104
3.961
3.067
9.459
9.702
7.747
6.957
4.902
3.342
7.207
9.639
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
OG1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 60.0 0.429 H -74.7 -38.3 54.0 0.386 0.043 C:P04908:0.043
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.717
7.585
7.620
5.180
3.374
7.303
8.860
7.436
8.237
6.722
3.941
3.038
9.623
5.651
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
N
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
4ym5 1 P68431 96.32 7e-93 X-RAY
2015-12-02 THR A:49 A:45 52.0 0.371 H -73.4 -48.6 52.0 0.371 0.0 DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DA
DC
9.205
7.745
8.740
6.454
4.282
3.122
9.914
8.398
7.976
5.061
3.316
7.348
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
C5'
OP1
OP2
C5'
OP1
O3'
OP1
OP1
THR E:49 E:45 58.0 0.414 H -72.1 -46.6 58.0 0.414 0.0 DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.279
8.201
7.763
5.252
3.547
7.765
8.969
7.252
7.862
6.575
3.843
2.662
9.837
CG2
CG2
O
N
N
CG2
N
OG1
N
CG2
OG1
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
4ym6 1 P68431 96.32 7e-93 X-RAY
2015-12-02 THR A:49 A:45 61.0 0.436 H -82.3 -43.9 52.0 0.371 0.065 G:P04908:0.064
DA
DG
DC
DA
DT
DT
DG
DT
DC
DA
DA
DC
9.016
7.954
7.515
6.928
4.422
3.066
9.672
8.180
7.518
5.087
3.134
7.769
N
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 60.0 0.429 H -82.0 -43.3 50.0 0.357 0.072 C:P04908:0.071
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
8.500
7.579
5.569
3.783
7.935
9.107
7.814
7.742
6.689
4.111
3.490
9.857
O
O
N
N
C
N
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5av5 1 P68431 96.32 7e-93 X-RAY
2015-12-23 THR A:49 A:45 60.0 0.429 H -65.5 -48.3 57.0 0.407 0.022 G:P04908:0.021
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.643
7.106
8.098
7.282
3.991
2.641
9.172
9.598
7.723
7.186
5.215
3.446
7.442
2.741
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 61.0 0.436 H -69.9 -43.0 61.0 0.436 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.711
7.693
7.069
5.262
3.374
7.556
8.682
7.181
8.189
6.946
3.882
2.521
9.196
2.722
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5av6 1 P68431 96.32 7e-93 X-RAY
2015-12-23 THR A:49 A:45 59.0 0.421 H -66.0 -47.4 55.0 0.393 0.028 G:P04908:0.029
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.598
7.017
8.026
6.990
3.953
2.553
8.964
9.600
7.694
7.161
5.197
3.400
7.457
2.599
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 59.0 0.421 H -66.7 -45.9 59.0 0.421 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.495
7.665
7.141
5.319
3.407
7.539
8.685
7.129
8.225
7.002
3.867
2.515
9.103
2.587
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5av8 1 P68431 96.32 7e-93 X-RAY
2015-12-23 THR A:49 A:45 60.0 0.429 H -60.1 -49.2 55.0 0.393 0.036 G:P04908:0.036
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.668
7.092
8.071
7.063
4.050
2.729
9.154
9.572
7.677
7.084
5.249
3.488
7.634
2.733
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 61.0 0.436 H -66.2 -45.0 60.0 0.429 0.007 C:P04908:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.557
7.675
7.227
5.272
3.350
7.524
8.698
7.061
8.171
7.026
4.019
2.535
9.181
2.601
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5av9 1 P68431 96.32 7e-93 X-RAY
2015-12-23 THR A:49 A:45 57.0 0.407 H -63.7 -48.2 53.0 0.379 0.028 G:P04908:0.029
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.644
7.065
7.988
7.123
4.026
2.631
9.064
9.552
7.709
7.116
5.221
3.449
7.400
2.740
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 59.0 0.421 H -67.3 -45.0 59.0 0.421 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.589
7.671
7.158
5.265
3.362
7.506
8.648
7.083
8.179
6.978
3.917
2.473
9.227
2.595
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5avb 1 P68431 96.32 7e-93 X-RAY
2015-12-23 THR A:49 A:45 56.0 0.4 H -64.1 -52.2 54.0 0.386 0.014 G:P04908:0.014
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
8.657
7.145
8.054
7.154
4.162
2.706
9.311
9.508
7.676
7.204
5.213
3.504
7.554
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
THR E:49 E:45 60.0 0.429 H -67.5 -44.3 60.0 0.429 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.622
7.706
7.138
5.291
3.375
7.522
8.739
7.286
8.283
6.927
3.925
2.507
9.224
2.675
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5avc 1 P68431 96.32 7e-93 X-RAY
2015-12-23 THR A:49 A:45 59.0 0.421 H -61.2 -49.5 56.0 0.4 0.021 G:P04908:0.021
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.733
7.187
8.141
7.241
4.086
2.641
9.201
9.619
7.708
7.279
5.255
3.462
7.431
2.767
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 60.0 0.429 H -66.5 -48.8 60.0 0.429 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.456
7.569
7.226
5.218
3.399
7.438
8.817
7.276
8.212
7.140
4.033
2.546
9.320
2.728
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
OG1
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5b1m 1 P68433 96.32 7e-93 X-RAY
2017-02-15 THR A:49 A:45 64.0 0.457 H -65.2 -44.1 62.0 0.443 0.014 G:P22752:0.014
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.360
6.686
8.199
6.442
3.827
2.808
8.694
9.920
8.324
7.841
5.183
3.319
7.721
8.685
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP2
O
THR E:49 E:45 58.0 0.414 H -64.7 -44.5 57.0 0.407 0.007 C:P22752:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.449
7.908
7.928
5.249
3.383
7.680
8.467
7.006
8.089
6.533
3.964
2.618
8.639
7.492
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5b24 1 P68431 96.32 7e-93 X-RAY
2016-03-02 THR A:49 A:45 58.0 0.414 H -64.0 -55.3 58.0 0.414 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.493
7.436
8.093
6.808
4.302
2.508
9.156
9.844
8.361
8.096
5.022
3.325
7.512
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 56.0 0.4 H -73.0 -32.5 53.0 0.379 0.021 C:P04908:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.710
7.878
8.031
5.477
3.826
7.596
9.350
8.676
8.045
6.828
4.192
2.603
9.487
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5b2i 1 P68431 96.32 7e-93 X-RAY
2016-06-15 THR A:49 A:45 60.0 0.429 H -79.0 -45.5 58.0 0.414 0.015 G:P04908:0.014
DA
DC
DG
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
9.553
8.447
8.503
6.614
4.297
3.048
9.753
9.582
7.838
7.432
5.243
3.305
7.515
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O2
C4'
OP1
O3'
OP1
OP2
THR E:49 E:45 63.0 0.45 H -69.9 -47.8 63.0 0.45 0.0 DT
DA
DT
DG
DA
DA
DG
DT
DT
DT
DG
DA
9.395
7.810
7.643
5.320
3.431
7.566
8.213
8.307
6.872
4.168
2.653
9.618
CG2
CG2
O
N
N
CG2
N
N
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
5b2j 1 P68431 96.32 7e-93 X-RAY
2016-06-15 THR A:49 A:45 62.0 0.443 H -67.6 -50.6 56.0 0.4 0.043 G:P04908:0.043
DA
5CM
DG
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.787
7.378
8.274
7.023
4.325
2.600
9.453
9.595
7.699
7.334
5.282
3.487
7.455
9.678
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 60.0 0.429 H -64.6 -48.9 60.0 0.429 0.0 DT
DA
DT
DG
DA
DA
DG
DT
DT
DT
DG
DA
HOH
9.646
7.699
7.268
5.442
3.533
7.457
8.835
8.044
6.657
3.820
2.395
9.278
7.594
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP1
O
5b31 1 P68431 96.32 7e-93 X-RAY
2016-08-03 THR A:49 A:45 53.0 0.379 H -55.7 -57.2 53.0 0.379 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.396
6.795
8.079
7.243
4.192
2.515
9.233
9.214
7.656
6.862
5.270
3.486
7.087
5.047
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 60.0 0.429 H -66.4 -44.4 59.0 0.421 0.008 C:P04908:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.529
7.483
7.398
5.276
3.436
7.464
8.723
7.010
8.116
6.747
3.924
2.442
9.153
2.706
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
OG1
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5cpi 1 P68431 96.32 7e-93 X-RAY
2015-10-28 THR A:49 A:45 90.0 0.643 H -83.6 -33.2 72.0 0.514 0.129 G:P04908:0.129
DA
DA
DT
DT
DC
DT
DT
DC
DA
DT
9.475
8.263
7.506
7.016
5.044
5.518
9.955
5.345
3.698
8.917
OG1
OG1
OG1
CG2
CG2
OG1
O
N
N
C
O3'
C5'
OP1
O3'
OP1
OP2
C4'
O3'
OP1
OP2
THR E:49 E:45 57.0 0.407 H -83.5 -41.3 57.0 0.407 0.0 DA
DT
DC
DT
DC
DC
DT
DG
DT
DG
DG
DA
8.127
8.687
5.134
3.192
7.631
9.409
8.729
8.267
7.360
3.897
2.869
9.477
CG2
O
N
N
CB
OG1
OG1
N
CG2
OG1
OG1
OG1
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
5cpj 1 P68431 96.32 7e-93 X-RAY
2015-10-28 THR A:49 A:45 82.0 0.586 H -99.6 -4.5 71.0 0.507 0.079 G:P04908:0.079
DA
DT
DT
DC
DT
DT
DC
DC
DA
DT
8.534
7.333
7.767
4.607
3.689
9.064
8.583
5.217
3.299
8.396
CG2
N
OG1
OG1
OG1
O
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP1
OP1
O3'
OP1
OP2
THR E:49 E:45 59.0 0.421 H -97.3 -4.9 51.0 0.364 0.057 C:P04908:0.057
DA
DT
DC
DT
DC
DC
DT
DG
DT
DG
DG
DA
7.703
7.396
5.033
3.173
7.300
9.246
8.138
7.598
7.656
4.355
2.762
9.792
O
O
N
N
OG1
CG2
CG2
CG2
O
OG1
OG1
OG1
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
P
5cpk 1 P68431 96.32 7e-93 X-RAY
2015-10-28 THR A:49 A:45 53.0 0.379 H -77.1 -49.2 49.0 0.35 0.029 G:P04908:0.029
DG
DC
DT
DA
DT
DG
DA
DT
DT
DC
DT
DG
DT
9.097
7.661
8.125
6.593
4.192
2.928
9.531
9.640
8.468
8.525
5.494
3.393
7.976
N
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O2
C5'
OP1
O3'
OP1
OP1
THR E:49 E:45 53.0 0.379 H -76.1 -51.2 51.0 0.364 0.015 C:P04908:0.014
DG
DG
DA
DT
DT
5CM
DA
DT
DT
DA
DT
DG
DA
9.321
7.852
8.233
5.115
3.446
7.766
8.679
7.181
7.984
7.128
4.016
2.925
9.506
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
5gse 1 P68431 96.32 7e-93 X-RAY
2017-05-03 THR A:49 A:45 58.0 0.414 S -98.1 -50.4 58.0 0.414 0.0 DG
DG
DG
DT
DA
DT
DC
DC
DC
DG
DC
7.980
7.900
5.794
3.977
2.769
9.406
8.189
8.428
4.931
3.124
7.426
OG1
N
CG2
CG2
OG1
CG2
CG2
O
N
N
C
OP1
OP1
O3'
C5'
OP1
O2
C4'
OP1
O3'
OP1
OP2
THR E:49 E:45 47.0 0.336 H -77.2 -59.0 47.0 0.336 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DG
9.069
7.895
8.940
5.053
3.079
7.330
8.416
8.394
7.433
3.741
2.412
8.230
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP2
THR K:49 NA:NA DO NA DO DO DO NA NA NA
THR O:49 O:45 65.0 0.464 H -103.0 -43.3 61.0 0.436 0.028 M:P04908:0.029
DG
DG
DG
DC
DT
DC
DG
DA
DT
DC
DG
DC
9.481
8.185
8.344
7.864
4.473
2.960
8.945
8.580
8.473
5.258
3.447
7.006
CG2
CG2
N
CB
OG1
OG1
OG1
O
O
N
N
OG1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
5gtc 1 P68431 96.32 7e-93 X-RAY
2017-06-28 THR A:49 A:45 61.0 0.436 H -65.9 -43.8 61.0 0.436 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.822
7.194
8.251
6.366
3.871
2.404
8.932
9.644
7.768
7.285
5.319
3.418
7.190
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:49 E:45 58.0 0.414 H -64.2 -43.8 57.0 0.407 0.007 C:P04908:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.520
7.889
7.757
5.143
3.294
7.599
8.530
6.978
8.105
7.040
4.133
2.937
9.475
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
5jrg 1 P68431 96.32 7e-93 X-RAY
2017-03-08 THR A:49 A:45 63.0 0.45 H -73.0 -48.1 62.0 0.443 0.007 G:P04908:0.007
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.283
6.843
8.326
6.240
3.801
2.496
8.637
9.655
8.425
8.446
5.047
3.293
7.640
6.601
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
O
THR E:49 E:45 63.0 0.45 H -73.4 -46.7 60.0 0.429 0.021 C:P04908:0.021
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
HOH
9.575
7.920
7.759
5.125
3.216
7.483
8.498
6.996
8.216
6.566
4.021
2.768
9.544
4.332
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5y0c 2 P68431 96.32 7e-93 X-RAY
2018-07-18 THR C:49 A:45 59.0 0.421 H -63.7 -45.4 59.0 0.421 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.875
7.101
8.305
6.460
3.625
2.554
8.528
9.260
7.962
8.125
5.489
3.603
7.553
2.780
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
O
THR G:49 E:45 57.0 0.407 H -62.9 -44.6 57.0 0.407 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.450
7.766
7.403
5.390
3.525
7.525
8.815
7.153
8.635
6.560
3.962
2.495
9.468
3.866
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5y0d 1 P68431 96.32 7e-93 X-RAY
2018-07-18 THR A:49 A:45 57.0 0.407 H -68.4 -46.8 52.0 0.371 0.036 G:P04908:0.036
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.598
6.836
8.180
6.960
3.760
2.584
8.632
9.254
7.951
7.872
5.239
3.277
7.348
2.599
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 58.0 0.414 H -68.2 -47.3 54.0 0.386 0.028 C:P04908:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.319
7.697
7.684
5.333
3.398
7.561
8.680
7.081
8.319
6.646
3.849
2.646
9.394
4.606
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5z30 1 P68431 96.32 7e-93 X-RAY
2018-07-18 THR A:49 A:45 61.0 0.436 H -75.0 -42.8 61.0 0.436 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
9.418
7.438
8.365
6.463
3.705
2.876
8.842
9.061
7.820
7.675
5.302
3.370
7.537
8.032
N
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 55.0 0.393 H -70.1 -43.1 55.0 0.393 0.0 DA
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.987
9.241
7.617
7.389
5.324
3.402
7.606
8.664
7.185
8.415
6.606
4.089
2.546
9.474
6.055
CG2
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N
C2
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
6hkt 1 P68431 96.32 7e-93 X-RAY
2018-10-31 THR A:49 A:45 56.0 0.4 H -70.4 -51.4 56.0 0.4 0.0 DT
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
9.202
7.674
7.508
6.997
3.052
2.137
7.703
9.604
8.815
9.075
5.552
3.701
7.928
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 51.0 0.364 H -77.5 -50.5 51.0 0.364 0.0 DA
DT
DC
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
8.632
8.555
9.852
4.121
2.344
7.047
8.944
7.190
7.484
7.643
4.360
3.609
9.849
CG2
O
N
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
C5'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR K:49 a:45 50.0 0.357 H -80.4 -49.5 50.0 0.357 0.0 DT
DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
9.030
7.601
6.951
7.387
3.331
2.402
7.102
9.163
9.235
5.147
3.348
7.999
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
O3'
C5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR O:49 e:45 52.0 0.371 H -70.7 -49.6 49.0 0.35 0.021 M:P04908:0.021
DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.999
8.126
7.750
4.744
2.882
6.774
9.170
7.379
7.947
7.350
3.592
2.652
8.591
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR S:49 K:45 46.0 0.329 H -65.5 -71.6 46.0 0.329 0.0 DT
DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
9.633
8.191
7.428
7.320
4.835
3.052
7.729
9.101
9.039
6.173
4.496
8.711
OG1
N
N
CG2
CG2
OG1
OG1
CG2
O
N
N
CB
O3'
C5'
OP1
O3'
O5'
OP1
OP1
C4'
OP1
O3'
OP1
OP1
THR W:49 O:45 48.0 0.343 H -75.8 -46.3 48.0 0.343 0.0 DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
8.606
7.919
5.812
3.851
8.218
8.598
8.301
6.343
4.303
4.092
9.885
O
O
N
N
CB
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
C5'
OP1
OP2
THR AA:49 k:45 47.0 0.336 H -78.9 -53.4 38.0 0.271 0.065 GA:P04908:0.064
DT
DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
9.333
7.941
7.500
7.960
4.794
3.346
8.490
8.973
8.605
4.855
2.974
7.800
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
O3'
C5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR EA:49 o:45 57.0 0.407 H -70.4 -51.1 57.0 0.407 0.0 DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
8.653
8.338
4.414
2.635
7.065
8.924
7.155
7.612
7.739
4.228
3.212
8.518
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR IA:49 U:45 57.0 0.407 H -71.4 -49.8 48.0 0.343 0.064 OA:P04908:0.064
DT
DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
8.951
7.540
7.435
8.250
4.430
2.882
8.566
8.512
8.299
4.831
2.943
7.467
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
THR MA:49 Y:45 50.0 0.357 H -76.9 -53.3 49.0 0.35 0.007 KA:P04908:0.007
DA
DT
DC
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.309
9.016
9.487
4.109
2.511
7.518
8.858
7.308
6.957
8.243
4.386
4.170
9.526
CG2
O
N
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
C5'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR QA:49 u:45 49.0 0.35 H -78.9 -47.1 41.0 0.293 0.057 WA:P04908:0.057
DT
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
9.183
7.918
7.969
7.746
4.342
3.010
9.345
9.811
8.061
7.977
4.715
2.713
7.032
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR UA:49 y:45 55.0 0.393 H -72.8 -48.3 55.0 0.393 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.926
9.930
8.197
7.716
5.003
3.075
7.309
9.405
7.619
7.876
7.074
3.773
3.294
9.194
CG2
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
6jou 1 P68431 96.32 7e-93 X-RAY
2020-03-25 THR A:49 A:45 58.0 0.414 H -65.7 -44.8 58.0 0.414 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.784
7.075
8.213
6.951
3.633
2.751
8.752
9.205
7.897
7.925
5.186
3.309
7.739
6.993
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
O
THR E:49 E:45 53.0 0.379 H -62.6 -48.3 53.0 0.379 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.487
7.727
7.426
5.316
3.356
7.539
8.643
7.213
8.131
6.693
4.186
2.642
9.070
3.084
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
OG1
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
6jr0 1 P68431 96.32 7e-93 X-RAY
2019-10-02 THR A:49 A:45 57.0 0.407 H -63.8 -49.9 56.0 0.4 0.007 C:P04908:0.007
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
9.269
7.306
8.314
6.582
3.714
2.732
8.782
9.130
7.767
8.234
5.338
3.407
7.628
7.778
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 49.0 0.35 H -63.3 -50.3 49.0 0.35 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.307
7.689
7.766
5.546
3.714
7.516
9.075
7.475
8.706
6.702
3.986
2.495
9.500
6.627
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
OG1
OG1
OG1
C
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
6jr1 1 P68431 96.32 7e-93 X-RAY
2019-10-02 THR A:49 A:45 59.0 0.421 H -67.9 -47.2 59.0 0.421 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.917
7.043
8.325
6.698
3.682
2.659
8.675
9.252
8.025
8.195
5.311
3.371
7.550
6.692
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
O
THR E:49 E:45 56.0 0.4 H -67.6 -47.6 54.0 0.386 0.014 C:P04908:0.014
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.369
7.735
7.531
5.363
3.555
7.412
9.275
7.285
8.577
6.712
4.057
2.560
9.513
2.729
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
OG1
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
6k1i 1 P68431 96.32 7e-93 X-RAY
2020-01-15 THR A:49 A:45 58.0 0.414 H -75.0 -48.7 58.0 0.414 0.0 DT
DA
DC
DT
DA
DT
DG
DT
DA
DT
DG
DT
DG
HOH
9.991
7.948
7.919
7.127
3.482
3.204
8.954
9.795
8.010
8.093
5.077
3.239
7.501
3.343
OG1
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
CG2
O3'
C5'
OP1
O3'
O3'
OP1
OP2
C4'
C5'
OP1
O3'
OP1
OP2
O
THR E:49 E:45 59.0 0.421 H -68.9 -44.4 56.0 0.4 0.021 C:P16104:0.021
DT
DA
DT
DC
DG
DC
DT
DA
DG
DT
DA
DT
DG
HOH
9.368
8.329
7.952
5.218
3.376
7.634
9.283
7.795
7.611
7.194
3.433
3.048
9.691
7.441
CG2
O
O
N
N
C
OG1
N
N
CG2
CG2
OG1
OG1
O
O3'
O3'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
OP1
O
6k1j 1 P68431 96.32 7e-93 X-RAY
2020-01-15 THR A:49 A:45 58.0 0.414 H -76.4 -46.4 58.0 0.414 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.282
6.914
8.346
7.047
4.071
3.160
8.937
9.223
7.573
7.052
5.018
3.200
7.127
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR E:49 E:45 59.0 0.421 H -82.9 -40.7 41.0 0.293 0.128 C:P16104:0.129
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
7.795
7.227
5.012
3.110
7.451
8.522
6.956
8.118
6.834
3.849
3.196
9.467
O
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6k1k 1 P68431 96.32 7e-93 X-RAY
2020-01-15 THR A:49 A:45 57.0 0.407 H -72.7 -43.2 56.0 0.4 0.007 G:P16104:0.007
DA
DC
DG
DT
DG
DA
DA
DA
DT
DG
DT
DG
7.969
7.971
6.819
3.712
2.848
9.513
9.632
8.023
7.716
5.161
3.275
7.616
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP2
THR E:49 E:45 63.0 0.45 H -67.5 -41.6 56.0 0.4 0.05 C:P16104:0.05
DA
DA
DT
DG
DT
DG
DT
DA
DC
DG
DT
DG
DA
9.382
8.075
7.505
5.063
3.268
7.596
9.036
7.877
7.716
7.283
3.675
2.902
9.644
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6kvd 2 P68431 96.32 7e-93 X-RAY
2019-12-18 THR C:49 A:45 63.0 0.45 H -71.5 -38.8 63.0 0.45 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.965
7.141
8.292
6.658
3.806
2.709
8.643
9.279
7.953
7.941
5.150
3.278
7.661
7.720
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:49 E:45 54.0 0.386 H -72.7 -41.3 50.0 0.357 0.029 E:Q9BTM1:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.393
7.828
7.668
5.256
3.339
7.467
8.690
7.080
8.261
6.830
3.817
2.688
9.404
2.578
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
6l49 7 P68431 96.32 7e-93 EM
2019-12-04 THR K:49 K:45 52.0 0.371 H -89.9 -27.3 43.0 0.307 0.064 Q:P04908:0.064
DA
DC
DG
DA
DT
DT
DG
DT
DG
DT
DG
9.603
5.187
3.741
3.308
9.280
7.447
8.431
9.453
5.433
3.679
7.247
N
OG1
OG1
CG2
CG2
OG1
O
O
N
N
CG2
C5'
O3'
C5'
OP2
OP1
O2
C5'
OP1
O3'
OP1
OP1
THR O:49 O:45 61.0 0.436 S -98.9 -52.7 49.0 0.35 0.086 M:P04908:0.086
DG
DC
DC
DG
DC
DG
DG
DG
DC
DT
DG
9.771
9.957
4.563
2.828
7.372
9.806
8.336
9.322
5.773
3.797
3.129
CG2
N
N
N
C
OG1
OG1
N
CG2
CG2
OG1
N2
O3'
O3'
OP1
OP2
C4'
C5'
OP1
O3'
O5'
OP1
THR S:49 S:45 54.0 0.386 S -101.5 -53.8 46.0 0.329 0.057 Y:P04908:0.057
DT
DA
DC
DT
DC
DG
DA
DC
DG
DT
DG
9.679
8.289
8.034
7.579
5.013
3.604
9.985
9.602
4.520
2.639
6.825
OG1
OG1
N
CG2
CG2
OG1
OG1
N
N
N
CB
C4'
C5'
OP1
O3'
C5'
OP1
OP1
O3'
O3'
OP1
OP1
THR W:49 W:45 64.0 0.457 H -93.0 -23.6 52.0 0.371 0.086 U:P04908:0.086
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
8.362
8.205
6.414
4.638
8.152
9.341
9.638
7.052
3.065
6.341
8.187
O
O
N
N
CG2
N
N
OG1
OG1
CG2
CG2
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O4'
O5'
OP1
6l4a 1 P68431 96.32 7e-93 EM
2019-12-04 THR A:49 A:45 53.0 0.379 H -92.9 -43.5 53.0 0.379 0.0 DA
DC
DT
DC
DG
DT
DG
DT
DG
DT
DG
8.554
8.432
8.396
5.209
3.669
9.839
8.391
8.022
5.317
3.478
6.529
N
N
CG2
CG2
CG2
OG1
O
O
N
N
OG1
C5'
OP1
O3'
O3'
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 50.0 0.357 H -81.8 -39.0 40.0 0.286 0.071 C:P04908:0.071
DA
DA
DT
DC
DG
DC
DG
DG
DT
DG
DA
8.461
8.071
8.629
5.260
3.331
6.947
8.505
8.025
7.391
5.380
6.914
OG1
OG1
O
N
N
OG1
CG2
N
CG2
CG2
CG2
O3'
OP1
OP1
O3'
OP1
OP1
C5'
OP1
O3'
OP1
OP1
THR K:49 K:45 64.0 0.457 H -85.3 -43.0 63.0 0.45 0.007 Q:P04908:0.007
DT
DA
DC
DC
DG
DA
DT
DT
DG
DG
DT
DG
9.668
8.085
8.481
6.097
3.772
3.254
8.924
9.460
9.843
4.986
3.178
8.105
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
C5'
OP2
OP1
O2
C5'
O3'
OP1
OP1
THR O:49 O:45 59.0 0.421 H -82.0 -41.7 51.0 0.364 0.057 M:P04908:0.057
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.768
8.244
7.709
5.498
3.521
7.676
8.731
8.623
6.208
4.030
2.806
9.883
CG2
O
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O5'
OP1
OP2
THR S:49 S:45 61.0 0.436 H -83.3 -44.7 61.0 0.436 0.0 DT
DA
DC
DT
DC
DG
DG
DT
DG
DT
DG
9.686
7.893
8.437
7.613
5.214
3.807
8.431
8.046
4.910
3.110
7.882
OG1
N
N
CG2
CG2
OG1
O
O
N
N
CB
O3'
C5'
OP1
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP1
THR W:49 W:45 63.0 0.45 H -79.4 -41.2 55.0 0.393 0.057 U:P04908:0.057
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.870
9.832
8.918
8.706
5.302
3.340
7.702
8.641
8.704
7.047
3.763
4.718
7.730
CG2
CG2
O
O
N
N
C
OG1
N
CG2
CG2
OG1
OG1
N2
C2
O3'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
C4'
OP1
OP1
6r8y 1 P68431 96.32 7e-93 EM
2019-06-12 THR A:49 A:46 54.0 0.386 H -62.7 -47.5 54.0 0.386 0.0 DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DT
DA
DA
DC
8.434
7.372
8.445
5.559
2.821
2.528
9.147
8.782
9.590
6.765
8.210
5.388
3.699
6.888
H
H
H
HG23
HG21
HG1
HG1
HG21
HG22
HG22
O
H
H
HB
H4'
H5''
OP1
O3'
H4'
OP1
OP2
H2
H4'
H4'
OP1
O3'
OP1
OP2
THR E:49 E:46 56.0 0.4 H -65.3 -45.3 55.0 0.393 0.007 C:P04908:0.007
DA
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.136
9.819
6.469
8.060
4.975
3.149
6.781
8.588
7.235
8.686
6.051
2.844
3.601
9.784
HG21
HG22
HG22
O
H
N
HB
H
H
H
HG21
HG21
OG1
OG1
H2
O3'
H4'
OP1
O3'
OP1
OP1
H4'
H5'
OP1
O3'
H5''
OP1
OP2
6r8z 1 P68431 96.32 7e-93 EM
2019-06-12 THR A:49 A:46 53.0 0.379 S -128.0 -41.9 53.0 0.379 0.0 DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DA
DC
9.062
7.363
8.131
7.151
3.473
2.995
9.830
8.519
8.727
4.808
2.798
7.120
HG1
HG23
N
HB
HG21
HG21
HG21
HB
O
H
H
OG1
H4'
H5''
OP1
O3'
O3'
OP1
OP1
H4'
OP1
O3'
OP1
OP2
THR E:49 E:46 58.0 0.414 H -62.4 -49.8 58.0 0.414 0.0 DA
DT
DA
DT
DA
DA
DC
DA
DG
DC
DA
DT
DT
DG
DA
8.655
8.833
6.356
8.039
5.716
3.645
6.789
8.786
7.322
9.879
9.695
5.896
2.587
3.012
9.441
HG21
HG22
HG22
O
H
N
HB
H
H
H
HG21
HG21
HG21
OG1
OG1
H2
H1'
H4'
OP1
O3'
OP1
OP1
O3'
H5''
OP1
H2
H2''
H5''
OP1
OP2
6r90 1 P68431 96.32 7e-93 EM
2019-06-12 THR A:49 A:46 63.0 0.45 H -64.0 -43.1 63.0 0.45 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.773
7.582
9.792
9.772
5.619
3.040
3.273
8.883
8.737
6.248
7.809
5.587
3.846
7.046
H
H
H
HG21
HG21
HG21
OG1
HG21
HG22
HG22
O
H
N
HB
H4'
H5'
OP1
H2
O3'
H5''
OP1
H2
H4'
H4'
OP1
O3'
OP1
OP1
THR E:49 E:46 60.0 0.429 H -64.9 -50.2 60.0 0.429 0.0 DA
DT
DA
DT
DG
DA
DA
DC
DA
DG
DA
DT
DT
DG
DA
8.813
7.828
6.456
8.613
9.884
4.421
2.671
6.076
7.993
7.072
9.232
5.696
2.593
2.668
9.551
HG21
HG22
HG22
HG22
H
H
H
HB
HG1
HG1
HG21
HG23
HG21
OG1
HG1
H2
H1'
H5'
H5'
H21
O3'
OP1
OP2
O3'
H5'
H2
O3'
H4'
OP1
OP2
6r91 1 P68431 96.32 7e-93 EM
2019-06-12 THR A:49 A:46 65.0 0.464 H -62.8 -45.9 65.0 0.464 0.0 DT
DT
DC
DA
DT
DA
DT
DC
DC
DA
DA
DT
DG
8.015
7.106
9.376
8.522
4.555
3.512
7.830
8.300
6.787
7.894
5.988
3.919
7.152
H
H
H
HG23
HG21
HG21
HG1
HG22
HG22
O
H
N
HB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
H5''
OP1
O3'
OP1
OP1
THR E:49 E:46 54.0 0.386 H -61.7 -46.1 54.0 0.386 0.0 DC
DA
DA
DC
DT
DG
DT
DG
DA
DG
DA
DT
9.027
8.638
8.773
5.733
4.155
7.730
9.648
7.507
9.070
9.280
5.903
3.017
HG22
HG22
HG22
H
N
HB
H
H
H
HG22
HG23
HG21
H4'
H4'
H5'
O3'
OP1
OP1
O3'
H4'
OP1
H21
O3'
HO3'
6r92 4 P68431 96.32 7e-93 EM
2019-06-12 THR D:49 A:46 48.0 0.343 H -61.9 -46.1 48.0 0.343 0.0 DG
DC
DT
DT
DG
DA
DA
DT
DA
DG
DA
DA
8.525
7.189
8.568
6.860
3.679
4.693
8.783
7.523
7.068
5.888
4.068
6.239
HG23
HG23
H
HB
HG21
HG21
HG1
HB
O
H
N
HG1
H4'
OP1
OP1
O3'
H4'
OP2
O3'
H4'
OP1
O3'
OP1
OP1
THR H:49 E:46 48.0 0.343 H -62.0 -46.0 48.0 0.343 0.0 DA
DT
DC
DA
DC
DA
DC
DA
DG
DA
DT
DT
DG
9.163
8.105
8.308
5.875
3.825
6.318
9.541
7.858
9.822
6.318
2.860
2.542
8.933
HG1
O
O
H
H
HG1
HG23
HG23
H
HB
HG21
HG21
HG21
H4'
H4'
OP1
O3'
OP1
OP1
H4'
H5''
OP1
O3'
O3'
OP1
OP2
6r93 3 P68431 96.32 7e-93 EM
2019-06-12 THR C:49 A:46 32.0 0.229 H -63.2 -46.0 32.0 0.229 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DA
DA
DT
DA
DT
DA
DA
DC
9.181
8.056
8.641
9.707
5.270
2.379
2.632
8.897
9.711
8.505
8.887
6.502
7.600
5.818
3.824
7.480
H
H
H
HG21
HG23
HG21
HG1
HG1
HG21
HG21
HG22
HG22
O
H
N
HB
H4'
H5''
OP1
H2
O3'
H4'
OP1
OP2
H2
H2
O3'
H4'
OP1
O3'
OP1
OP1
THR G:49 E:46 56.0 0.4 H -63.0 -47.4 56.0 0.4 0.0 DA
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.237
8.938
6.551
7.994
5.400
3.452
7.205
8.428
7.662
9.296
6.146
2.470
3.007
9.477
HG21
HG22
HG22
O
H
N
HB
H
H
H
HG21
HG21
HG1
HG1
H2
H1'
H4'
OP1
O3'
OP1
OP1
H4'
H5'
OP1
O3'
H4'
OP1
OP2
6r94 3 P68431 96.32 7e-93 EM
2019-06-12 THR C:49 A:46 47.0 0.336 S -121.0 -46.0 47.0 0.336 0.0 DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DT
DA
DA
DC
8.170
7.351
8.953
6.542
2.751
2.559
8.893
9.694
9.049
7.706
7.693
4.924
2.700
6.202
HG23
HG23
N
HB
HG21
HG21
HG21
HB
HG1
O
O
H
H
HG1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
H2
H4'
H4'
OP1
O3'
OP1
OP2
THR G:49 E:46 53.0 0.379 H -62.7 -46.5 51.0 0.364 0.015 E:P04908:0.014
DA
DT
DA
DT
DA
DA
DC
DA
DG
DC
DA
DT
DT
DG
DA
8.523
8.643
6.797
7.669
5.699
4.029
7.041
9.105
7.525
8.760
9.632
5.913
2.611
2.195
8.710
HG21
HG22
HG22
O
H
N
HB
H
H
H
HG21
HG23
HG21
HG1
HG1
H2
H1'
H4'
OP1
O3'
OP1
OP1
O3'
H5''
OP1
H2
O3'
H5''
OP1
OP2
6t90 1 P68431 96.32 7e-93 EM
2020-05-06 THR A:49 A:46 60.0 0.429 H -69.6 -42.2 60.0 0.429 0.0 DA
DC
DT
DC
DT
DG
DT
DG
DT
DG
8.908
8.219
6.985
3.924
8.687
8.317
8.584
6.372
4.157
7.335
N
N
CG2
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
O3'
O3'
O3'
O5'
OP1
O3'
OP1
OP1
6t93 1 P68431 96.32 7e-93 EM
2020-05-06 THR A:49 A:46 57.0 0.407 H -78.6 -37.1 50.0 0.357 0.05 G:P04908:0.05
DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
8.890
8.358
8.791
5.313
3.025
8.388
8.918
8.654
6.092
3.932
7.036
CG2
N
CB
CG2
CG2
CG2
O
O
N
N
OG1
C5'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
THR E:49 E:46 63.0 0.45 H -70.9 -46.0 62.0 0.443 0.007 C:P04908:0.007
DG
DA
DC
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.539
9.679
8.334
8.740
5.913
3.928
7.916
8.784
8.431
6.988
4.154
2.897
8.810
CG2
CG2
CG2
O
N
N
CB
N
N
CG2
OG1
OG1
OG1
N2
O3'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
O3'
O3'
OP1
OP2
6usj 3 P68431 96.32 7e-93 EM
2020-10-14 THR C:49 A:45 62.0 0.443 H -70.0 -43.4 62.0 0.443 0.0 DG
DG
DG
DT
DC
DA
DG
DG
DA
DA
DC
DG
DC
9.654
7.524
7.643
7.412
4.004
2.660
9.327
9.801
8.658
8.999
4.972
3.130
7.758
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
C4'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
THR G:49 E:45 61.0 0.436 H -66.5 -48.8 61.0 0.436 0.0 DG
DT
DG
DT
DG
DT
DA
DC
DT
DC
DC
DA
8.971
8.850
4.983
3.120
7.943
9.218
6.917
6.975
7.457
3.844
2.668
8.873
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR M:49 K:45 63.0 0.45 H -69.2 -43.8 63.0 0.45 0.0 DG
DG
DG
DT
DC
DA
DG
DG
DA
DA
DC
DG
DC
9.609
7.506
7.640
7.298
3.976
2.668
9.417
9.814
8.671
9.010
4.983
3.136
7.753
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
C4'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
THR Q:49 O:45 60.0 0.429 H -68.3 -49.2 60.0 0.429 0.0 DG
DT
DG
DT
DG
DT
DA
DC
DT
DC
DC
DA
8.923
8.779
4.970
3.111
8.012
9.284
6.998
6.958
7.620
3.809
2.632
8.414
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6v2k 1 P68431 96.32 7e-93 X-RAY
2020-11-25 THR A:49 A:45 62.0 0.443 H -67.8 -40.6 62.0 0.443 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.679
7.018
8.391
6.522
3.822
2.760
8.755
9.503
8.197
8.009
5.328
3.411
7.697
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:49 E:45 58.0 0.414 H -67.6 -40.2 55.0 0.393 0.021 C:Q08AJ9:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.294
7.804
7.577
5.293
3.406
7.608
8.808
7.171
8.391
6.617
4.006
2.738
9.368
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6yov 1 P68431 96.32 7e-93 EM
2020-05-06 THR A:49 A:46 56.0 0.4 H -60.8 -48.3 56.0 0.4 0.0 DA
DC
DC
DC
DT
DG
DT
DG
DG
DT
DG
8.677
8.413
6.670
4.243
4.483
9.968
9.562
7.884
6.101
4.146
6.778
N
N
CG2
CG2
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
O3'
C5'
OP2
N2
O3'
OP1
O3'
OP1
OP1
7c0m 1 P68431 96.32 7e-93 EM
2020-09-16 THR A:49 A:45 58.0 0.414 H -68.6 -47.5 53.0 0.379 0.035 G:P04908:0.036
DA
DC
DT
DC
DG
DA
DT
DG
DT
DG
DT
DG
8.465
7.935
7.247
3.672
2.588
7.660
9.852
8.399
8.111
6.188
4.437
8.226
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR E:49 E:45 53.0 0.379 H -109.8 -25.9 53.0 0.379 0.0 DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
8.761
8.621
6.108
4.202
7.478
8.321
7.375
6.494
4.042
3.146
9.359
O
O
N
N
CG2
N
N
OG1
CG2
CG2
CG2
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
THR L:49 a:45 59.0 0.421 H -68.5 -47.6 53.0 0.379 0.042 R:P04908:0.043
DA
DC
DT
DC
DG
DA
DT
DG
DT
DG
DT
DG
8.466
7.936
7.247
3.672
2.589
7.660
9.852
8.400
8.112
6.188
4.437
8.226
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR P:49 e:45 52.0 0.371 H -109.7 -25.9 52.0 0.371 0.0 DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
8.760
8.621
6.109
4.204
7.477
8.321
7.374
6.495
4.041
3.145
9.359
O
O
N
N
CG2
N
N
OG1
CG2
CG2
CG2
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
7d1z 1 P68431 96.32 7e-93 EM
2021-02-10 THR A:49 A:45 58.0 0.414 H -69.2 -39.0 51.0 0.364 0.05 F:P04908:0.05
DA
DC
DT
DC
DG
DA
DG
DT
DG
DT
DG
8.736
8.764
8.068
5.520
3.371
9.493
8.893
7.912
6.043
3.909
6.775
N
N
CG2
CG2
CG2
OG1
O
O
N
N
OG1
C5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 57.0 0.407 H -68.7 -41.5 52.0 0.371 0.036 C:P04908:0.036
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
8.898
7.575
6.254
4.069
7.105
8.539
7.907
7.506
4.074
3.259
9.868
O
O
N
N
OG1
N
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
7scy 3 P68431 96.32 7e-93 EM
2022-01-12 THR C:49 A:45 59.0 0.421 H -62.5 -49.5 59.0 0.421 0.0 DG
DA
DT
DG
DT
DG
DT
DG
DG
DT
DA
DC
DA
DT
DC
DC
DG
8.772
8.912
8.868
6.724
8.196
4.559
3.058
6.796
9.749
8.506
6.565
7.572
9.859
6.522
2.626
1.675
6.720
HG21
HG21
HG22
HG22
O
H
N
HB
H
H
H
H
HG21
HG23
HG23
HG1
HG1
H21
H2
H4'
H5''
OP1
O3'
OP1
OP2
H22
H4'
H5''
OP1
H2
O3'
H5''
OP1
OP2
THR G:49 E:45 59.0 0.421 H -63.3 -43.7 57.0 0.407 0.014 E:Q08AJ9:0.014
DG
DG
DG
DC
DT
DC
DG
DA
DG
DA
DA
DT
DC
DG
DC
8.572
6.522
7.490
6.281
2.759
1.735
7.837
9.889
8.192
8.721
7.029
8.484
4.760
3.204
6.878
H
H
H
HG22
HG22
HG1
HG1
HG21
HG21
HG21
HG23
O
H
H
HB
H4'
H5''
OP1
O3'
H5''
OP1
OP2
H2
H22
H4'
H4'
OP1
O3'
OP1
OP1
7scz 3 P68431 96.32 7e-93 EM
2022-01-19 THR C:49 A:45 62.0 0.443 H -67.2 -47.2 62.0 0.443 0.0 DG
DA
DT
DG
DT
DG
DT
DG
DG
DT
DA
DC
DA
DT
DC
DC
DG
8.570
8.913
8.583
6.377
8.405
4.672
3.136
6.925
9.980
8.626
6.637
7.591
9.935
6.568
2.458
1.682
7.138
HG21
HG21
HG23
HG23
HG23
H
H
HB
H
H
H
H
HG21
HG22
HG22
HG1
HG1
H21
H2
H4'
H4'
H5'
O3'
OP1
OP2
H22
H4'
H5''
OP1
H2
O3'
H5''
OP1
OP2
THR G:49 E:45 62.0 0.443 H -63.4 -44.7 56.0 0.4 0.043 E:Q08AJ9:0.043
DG
DG
DG
DG
DC
DT
DC
DG
DG
DA
DA
DT
DC
DG
DC
9.797
8.386
6.079
7.042
5.952
2.451
1.741
8.259
7.983
8.738
6.953
8.580
4.872
3.197
6.995
H
H
H
H
HG23
HG23
HG1
HG1
HG21
HG22
HG22
HG22
H
N
HB
H22
H4'
H5''
OP1
O3'
H5''
OP1
OP2
H22
H4'
H4'
H5'
O3'
OP1
OP1
1u35 2 P68433 96.32 7e-93 X-RAY
2005-09-27 THR C:46 A:445 56.0 0.4 H -67.4 -43.2 56.0 0.4 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.595
7.114
8.312
6.965
4.064
2.849
9.369
9.546
7.804
7.375
5.017
3.290
7.568
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
THR G:46 E:645 61.0 0.436 H -68.2 -40.9 58.0 0.414 0.022 E:O75367:0.021
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
HOH
9.359
7.567
7.533
5.083
3.332
7.739
8.638
7.128
8.073
6.653
3.660
2.907
9.280
8.471
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
2cv5 2 P68431 96.32 7e-93 X-RAY
2005-06-28 THR C:46 A:45 61.0 0.436 H -56.5 -40.4 55.0 0.393 0.043 I:P28001:0.043
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.408
6.976
8.322
6.808
3.424
2.790
8.815
9.196
8.069
8.046
5.425
3.660
7.598
4.523
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O4'
O3'
OP1
O3'
OP1
OP1
O
THR G:46 E:45 57.0 0.407 H -63.6 -49.8 52.0 0.371 0.036 E:P28001:0.036
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.431
7.539
7.964
5.366
3.546
7.274
8.606
7.204
8.168
6.517
3.874
2.913
9.358
5.125
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5c3i 2 P68431 96.32 7e-93 X-RAY
2015-07-29 THR B:46 NA:NA DO NA DO DO DO NA NA NA
THR F:46 NA:NA DO NA DO DO DO NA NA NA
THR J:46 NA:NA DO NA DO DO DO NA NA NA
THR N:46 NA:NA DO NA DO DO DO NA NA NA
THR R:46 NA:NA DO NA DO DO DO NA NA NA
THR V:46 NA:NA DO NA DO DO DO NA NA NA
5xf3 1 P68431 96.32 7e-93 X-RAY
2017-10-11 THR A:46 A:45 61.0 0.436 H -72.3 -36.7 61.0 0.436 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.248
6.852
8.398
6.739
3.896
2.844
9.506
9.767
7.666
7.227
5.002
3.002
7.669
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP2
THR E:46 E:45 57.0 0.407 H -74.5 -31.7 57.0 0.407 0.0 DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
7.632
7.344
4.940
3.184
7.378
8.002
6.706
8.127
6.834
3.915
3.041
9.162
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5xf4 1 P68431 96.32 7e-93 X-RAY
2017-10-11 THR A:46 A:45 58.0 0.414 H -77.1 -36.7 58.0 0.414 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.264
6.942
8.416
6.772
4.110
2.944
9.385
9.704
7.583
7.179
4.960
3.092
7.585
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR E:46 E:45 58.0 0.414 H -82.5 -38.9 57.0 0.407 0.007 C:P04908:0.007
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
7.684
7.364
4.809
2.978
7.482
8.083
6.733
8.145
6.907
3.990
3.205
9.354
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5xf5 1 P68431 96.32 7e-93 X-RAY
2017-10-11 THR A:46 A:45 58.0 0.414 H -79.3 -46.5 56.0 0.4 0.014 G:P04908:0.014
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.309
6.786
8.297
6.935
4.045
2.714
9.482
9.465
7.705
7.129
5.078
3.275
7.521
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:46 E:45 57.0 0.407 H -71.3 -43.6 57.0 0.407 0.0 DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
7.887
7.386
5.070
3.246
7.437
8.229
6.779
8.248
6.715
3.807
2.763
9.378
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
6hts 5 P68431 96.32 7e-93 EM
2018-11-07 THR I:46 I:45 93.0 0.664 H 39.3 -120.7 93.0 0.664 0.0 DT
DG
DT
DA
DT
DG
6.863
4.573
4.787
9.372
7.907
6.091
CG2
CG2
O
O
N
OG1
O3'
C5'
OP1
OP2
OP1
OP1
THR M:46 M:45 63.0 0.45 H -68.8 -52.8 56.0 0.4 0.05 K:P04908:0.05
DG
DG
DC
DG
DC
8.117
7.917
5.487
3.662
8.080
N
N
N
N
C
C5'
OP1
O3'
OP1
OP2
6l9z 1 P68431 96.32 7e-93 X-RAY
2021-02-17 THR A:46 A:45 65.0 0.464 H -77.3 -39.0 65.0 0.464 0.0 DT
DA
DC
DT
DG
DA
DA
DT
DG
DT
DG
DT
DG
8.602
7.019
8.007
7.178
3.562
2.962
9.687
9.536
8.565
8.341
4.935
3.064
7.388
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP2
THR E:46 E:45 54.0 0.386 H -72.7 -46.6 46.0 0.329 0.057 C:P04908:0.057
DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
HOH
9.498
9.666
8.391
8.423
5.067
3.354
7.497
8.370
6.751
7.902
7.368
3.541
2.978
8.908
7.215
CG2
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
N2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
THR K:46 K:45 57.0 0.407 H -66.6 -37.9 57.0 0.407 0.0 DG
DC
DA
DC
DG
DC
DT
DA
DG
DG
DT
DT
DT
CA
9.161
8.657
8.711
5.111
3.450
7.557
8.987
7.350
7.882
6.485
3.740
2.775
9.401
5.315
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O3'
OP1
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
CA
THR O:46 O:45 62.0 0.443 H -71.0 -44.1 62.0 0.443 0.0 DT
DA
DC
DT
DG
DA
DA
DT
DG
DT
DG
DT
DG
HOH
8.713
7.236
7.825
7.318
3.497
2.843
9.183
9.553
8.229
8.458
5.116
3.288
7.563
2.632
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
O
6la2 1 P68431 96.32 7e-93 X-RAY
2021-02-17 THR A:46 e:45 61.0 0.436 H -74.8 -30.8 61.0 0.436 0.0 DG
DC
DA
DC
DG
DC
DT
DA
DG
DG
DT
DT
DT
9.412
8.756
7.884
4.858
3.575
7.533
8.230
6.864
7.202
6.335
3.571
3.164
9.169
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR E:46 i:45 65.0 0.464 H -75.7 -30.8 59.0 0.421 0.043 C:P04908:0.043
DT
DA
DC
DT
DG
DA
DA
DG
DT
DG
DT
DG
8.755
7.638
7.313
7.346
3.626
3.007
9.046
8.322
8.353
4.931
3.163
7.603
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
THR K:46 A:45 60.0 0.429 H -74.8 -31.0 56.0 0.4 0.029 Q:P04908:0.029
L:P62805:0.007
DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
9.692
9.779
8.850
7.871
4.872
3.244
7.543
8.401
7.201
7.366
6.980
4.828
3.185
8.898
CG2
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
CG2
OG1
N2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O5'
OP1
OP2
THR O:46 E:45 60.0 0.429 H -75.7 -31.1 56.0 0.4 0.029 M:P04908:0.029
DT
DA
DC
DT
DG
DA
DA
DT
DG
DT
DG
DT
DG
8.728
7.645
7.476
7.193
3.487
2.882
8.950
9.871
8.486
8.485
4.910
3.254
7.572
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
THR U:46 K:45 59.0 0.421 H -75.4 -31.4 59.0 0.421 0.0 DG
DC
DA
DC
DG
DC
DT
DA
DG
DG
DT
DT
9.129
8.492
8.498
5.078
3.287
7.482
8.588
6.854
7.304
6.525
3.612
3.115
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
N2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
THR Y:46 O:45 63.0 0.45 H -75.0 -30.5 60.0 0.429 0.021 W:P04908:0.021
DT
DA
DC
DT
DG
DA
DA
DT
DG
DT
DG
DT
DG
8.552
6.978
7.447
7.056
3.599
2.883
8.672
9.831
8.453
8.611
4.748
2.920
7.230
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
THR EA:46 U:45 63.0 0.45 H -75.3 -30.6 63.0 0.45 0.0 DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
9.132
9.580
8.211
8.504
5.079
3.337
7.575
8.613
6.923
7.421
7.128
3.161
3.340
8.633
CG2
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O4'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR IA:46 Y:45 64.0 0.457 H -75.4 -31.2 62.0 0.443 0.014 GA:P04908:0.014
DT
DA
DC
DT
DG
DA
DA
DT
DG
DT
DG
DT
DG
8.169
7.508
7.377
7.074
3.779
3.056
8.763
9.978
8.332
8.075
4.914
3.335
7.267
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP1
6la8 1 P68431 96.32 7e-93 X-RAY
2020-10-07 THR A:46 A:45 63.0 0.45 H -58.2 -37.1 63.0 0.45 0.0 DT
DA
DC
DT
DG
DA
DA
DA
DT
DG
DT
DG
DT
DG
9.043
7.084
7.822
6.724
3.387
2.853
9.257
9.858
9.211
8.356
8.174
5.319
3.402
7.401
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
C2
O3'
O3'
OP1
O3'
OP1
OP2
THR E:46 E:45 64.0 0.457 H -59.0 -37.0 63.0 0.45 0.007 C:P04908:0.007
DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
8.991
9.350
8.083
8.205
5.103
3.601
7.446
8.904
7.315
7.808
7.023
3.649
2.789
9.267
CG2
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR K:46 K:45 59.0 0.421 H -59.3 -36.3 59.0 0.421 0.0 DT
DA
DC
DT
DG
DA
DA
DG
DT
DG
DT
DG
9.083
7.711
7.482
7.235
3.615
2.918
8.980
8.341
7.747
5.074
3.335
7.338
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
C5'
OP1
O3'
OP1
OP2
THR O:46 O:45 62.0 0.443 H -58.8 -36.7 62.0 0.443 0.0 DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
9.136
9.595
7.943
7.486
5.298
3.436
7.185
9.129
7.685
7.723
7.159
4.581
2.796
8.273
CG2
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
CG2
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
C4'
OP1
OP2
6la9 1 P68431 96.32 7e-93 X-RAY
2020-10-07 THR A:46 A:45 62.0 0.443 H -64.7 -37.3 62.0 0.443 0.0 DT
DA
DC
DT
DG
DA
DA
DA
DT
DG
DT
DG
DT
DG
9.021
7.165
7.435
6.999
3.487
2.667
9.841
9.999
9.480
8.676
8.834
5.049
3.086
7.520
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
C2
O3'
C5'
OP1
O3'
OP1
OP1
THR E:46 E:45 63.0 0.45 H -62.8 -38.2 63.0 0.45 0.0 DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
9.308
9.473
8.602
8.713
5.119
3.154
7.193
9.704
7.953
7.724
6.564
3.598
2.834
8.560
CG2
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR K:46 K:45 60.0 0.429 H -63.9 -37.3 55.0 0.393 0.036 Q:P04908:0.036
DT
DA
DC
DT
DG
DA
DA
DT
DG
DT
DG
DT
DG
9.863
7.663
7.611
7.090
3.169
2.502
8.889
9.707
8.348
8.623
5.246
3.535
7.336
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
C4'
OP1
OP1
O3'
O3'
OP1
OP2
O2
C5'
OP1
O3'
OP1
OP1
THR O:46 O:45 64.0 0.457 H -64.1 -37.7 64.0 0.457 0.0 DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
9.661
9.553
8.147
7.836
5.213
3.276
7.550
9.522
7.452
7.691
7.234
3.597
2.723
8.518
CG2
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6lab 1 P68431 96.32 7e-93 X-RAY
2021-02-17 THR A:46 A:45 64.0 0.457 H -90.2 -20.5 64.0 0.457 0.0 DT
DA
DC
DG
DT
DG
DA
DA
DA
DA
DG
DT
DG
8.744
7.602
8.480
9.842
4.650
2.933
3.472
8.693
8.665
7.577
4.805
2.934
7.123
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
C5'
OP1
N2
O3'
O5'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
THR E:46 E:45 56.0 0.4 H -66.9 -41.7 56.0 0.4 0.0 DA
DA
DT
DG
DT
DG
DT
DA
DC
DG
DT
DG
DA
9.571
8.178
8.180
5.033
3.274
7.594
9.508
8.114
7.848
6.881
4.136
2.895
8.830
CG2
CG2
O
N
N
CB
OG1
N
N
CG2
CG2
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP1
O3'
C5'
OP1
O3'
O3'
OP1
OP1
THR K:46 K:45 60.0 0.429 H -90.2 -25.5 60.0 0.429 0.0 DT
DA
DC
DG
DT
DG
DA
DA
DC
DA
DA
DG
DT
DG
8.691
7.176
7.884
9.889
5.099
3.618
3.456
9.585
9.998
8.372
8.261
4.845
3.049
7.462
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
C5'
OP1
N2
O3'
O3'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP2
THR O:46 O:45 62.0 0.443 H -63.2 -26.2 62.0 0.443 0.0 DA
DA
DT
DG
DT
DG
DT
DA
DC
DG
DT
DG
DA
9.790
7.743
7.830
5.192
3.469
7.466
9.238
8.082
7.606
6.865
3.813
3.029
8.968
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
OP1
6ler 1 P68431 96.32 7e-93 X-RAY
2021-03-03 THR A:46 K:45 59.0 0.421 H -90.9 -31.2 NA NA NA
THR E:46 O:45 64.0 0.457 H -65.8 -47.9 NA NA NA
THR K:46 A:45 55.0 0.393 H -77.7 -47.0 55.0 0.393 0.0 DT
DA
DC
DT
DG
DC
DA
DT
DG
DT
DG
DT
DG
8.638
7.625
8.376
7.036
4.549
2.675
8.639
8.968
8.149
7.527
4.932
3.291
7.435
OG1
OG1
N
CG2
CG2
CG2
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
C5'
OP1
OP1
O4'
O3'
OP1
O3'
OP1
OP1
THR O:46 E:45 64.0 0.457 H -70.5 -40.2 64.0 0.457 0.0 DG
DA
DT
DC
DG
DC
DT
DA
DG
DG
DC
DT
DG
DT
9.218
8.142
7.946
5.012
3.356
7.593
9.119
7.702
7.677
9.966
6.682
3.547
2.807
8.911
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
N2
O3'
O3'
OP1
OP1
6m3v 1 P68431 96.32 7e-93 X-RAY
2020-10-07 THR A:46 A:45 65.0 0.464 H -35.5 -44.4 60.0 0.429 0.035 G:P04908:0.036
DG
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DA
DT
9.719
8.695
9.176
5.143
3.533
7.200
8.738
7.941
7.238
7.062
3.440
3.288
9.343
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR E:46 E:45 63.0 0.45 H -35.9 -44.1 59.0 0.421 0.029 C:P04908:0.029
DT
DA
DC
DT
DG
DA
DA
DT
DG
DT
DG
DT
DG
8.489
7.403
7.821
6.739
3.965
3.264
8.420
9.866
8.842
8.568
5.353
3.704
7.757
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
C5'
OP2
OP2
O2
O3'
OP1
O3'
OP1
OP1
THR K:46 K:45 55.0 0.393 H -34.4 -45.2 53.0 0.379 0.014 Q:P04908:0.007
DT
DA
DC
DT
DG
DA
DA
DT
DG
DG
DT
DG
8.553
7.215
8.656
7.315
3.853
2.607
8.722
8.705
7.778
4.986
3.374
7.756
OG1
OG1
N
CG2
CG2
CG2
OG1
CG2
O
N
N
CB
O3'
C5'
OP1
O3'
C5'
OP2
P
C4'
OP1
O3'
OP1
OP1
THR O:46 O:45 64.0 0.457 H -35.7 -44.6 63.0 0.45 0.007 P:P62805:0.007
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
8.323
8.373
5.169
3.336
8.049
9.101
7.583
7.790
7.462
4.022
2.812
8.770
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
OP2
6m44 1 P68431 96.32 7e-93 X-RAY
2020-10-07 THR A:46 A:45 63.0 0.45 H -53.1 -41.5 63.0 0.45 0.0 DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DA
DT
9.496
9.879
8.607
8.465
5.010
3.490
7.430
9.320
7.852
8.085
6.877
3.344
3.207
8.565
CG2
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR E:46 E:45 60.0 0.429 H -51.8 -42.6 60.0 0.429 0.0 DT
DA
DC
DT
DG
DA
DA
DT
DG
DT
DG
DT
DG
9.299
6.889
7.383
6.902
4.334
2.975
8.186
9.307
8.418
8.100
5.398
3.413
7.438
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
C4'
OP2
OP2
O4'
O3'
OP1
O3'
OP1
OP1
THR K:46 K:45 59.0 0.421 H -53.4 -42.8 59.0 0.421 0.0 DT
DA
DC
DT
DG
DA
DA
DA
DT
DG
DG
DT
DG
8.201
7.072
8.392
6.940
3.940
2.694
9.361
9.269
8.249
8.439
4.867
3.184
7.537
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
C4'
OP2
OP1
C2
C5'
OP1
O3'
OP1
OP2
THR O:46 O:45 62.0 0.443 H -53.6 -40.9 62.0 0.443 0.0 DG
DC
DA
DT
DC
DG
DC
DT
DA
DG
DC
DG
DT
DT
9.668
9.601
7.744
7.849
5.278
3.474
7.303
9.352
7.831
8.071
7.238
3.525
2.600
8.405
CG2
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
OP1
6m4d 1 P68431 96.32 7e-93 EM
2020-09-23 THR A:46 NA:NA DO NA DO DO DO NA NA NA
THR E:46 NA:NA DO NA DO DO DO NA NA NA
6m4g 3 P68431 96.32 7e-93 EM
2020-09-23 THR C:46 NA:NA DO NA DO DO DO NA NA NA
THR F:46 NA:NA DO NA DO DO DO NA NA NA
6m4h 3 P68431 96.32 7e-93 EM
2020-09-23 THR C:46 NA:NA DO NA DO DO DO NA NA NA
THR G:46 NA:NA DO NA DO DO DO NA NA NA
6upk 1 P68431 96.32 7e-93 EM
2019-12-11 THR A:46 NA:NA DO NA DO DO DO NA NA NA
THR E:46 E:45 53.0 0.379 H -59.4 -42.9 42.0 0.3 0.079 C:Q93077:0.079
DC
DG
DC
DG
DG
7.362
5.594
9.432
9.337
8.176
OG1
OG1
OG1
N
N
O3'
OP1
OP2
O3'
OP1
6upl 1 P68431 96.32 7e-93 EM
2019-12-11 THR A:46 A:45 101.0 0.721 H -74.5 -35.7 99.0 0.707 0.014 G:Q93077:0.014
DA
DG
DT
DG
9.744
8.080
6.504
9.727
N
N
N
C
OP1
O3'
OP1
OP1
THR E:46 E:45 63.0 0.45 H -67.8 -41.1 58.0 0.414 0.036 I:None:0.014
C:Q93077:0.029
DC
DG
DG
DG
5.855
4.615
7.908
7.047
N
N
OG1
OG1
O3'
OP1
O3'
OP1
6v92 23 P68431 96.32 7e-93 EM
2020-01-15 THR BA:46 a:45 60.0 0.429 H -56.5 -40.4 55.0 0.393 0.036 HA:P04908:0.036
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.409
6.976
8.322
6.808
3.424
2.790
8.816
9.195
8.069
8.045
5.424
3.660
7.599
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O4'
O3'
OP1
O3'
OP1
OP1
THR FA:46 e:45 56.0 0.4 H -63.6 -49.8 51.0 0.364 0.036 DA:P04908:0.036
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.430
7.540
7.965
5.366
3.547
7.274
8.607
7.204
8.168
6.517
3.875
2.913
9.358
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
7dbp 2 P68431 96.32 7e-93 EM
2020-12-23 THR B:46 A:45 59.0 0.421 H -76.7 -55.0 59.0 0.421 0.0 DT
DA
DA
DT
DC
DC
DG
DT
DA
DT
DG
DC
9.663
9.953
7.254
4.554
2.978
8.876
9.435
8.393
8.486
6.170
4.138
7.852
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
C4'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
THR F:46 E:45 59.0 0.421 H -76.7 -55.1 59.0 0.421 0.0 DG
DA
DA
DC
DC
DG
DT
DC
DC
DA
9.604
8.191
7.842
5.816
3.731
7.408
7.882
3.921
2.226
7.895
CG2
CG2
O
N
N
CB
CG2
CG2
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
7k5x 1 P68431 96.32 7e-93 EM
2020-11-25 THR A:46 A:45 50.0 0.357 S -91.5 -38.7 49.0 0.35 0.007 G:P04908:0.007
DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.600
8.431
8.364
5.439
3.417
7.830
9.775
7.704
8.011
6.957
3.982
2.689
8.811
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR E:46 E:45 63.0 0.45 H -72.2 -44.3 62.0 0.443 0.007 C:P04908:0.007
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.482
8.374
6.682
4.210
2.665
9.391
9.507
7.926
7.598
5.439
3.542
7.540
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
7k5y 1 P68431 96.32 7e-93 EM
2020-11-25 THR A:46 A:45 60.0 0.429 H -70.3 -47.7 57.0 0.407 0.022 G:P04908:0.021
DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.329
9.318
7.653
7.582
5.687
3.660
7.759
9.659
8.216
8.252
6.434
3.944
2.583
9.448
CG2
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
C5'
OP1
OP2
THR E:46 E:45 61.0 0.436 H -69.8 -48.4 61.0 0.436 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.430
8.274
6.659
4.064
2.523
9.419
9.669
7.644
8.297
5.317
3.394
7.725
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
7k60 1 P68431 96.32 7e-93 EM
2020-11-25 THR A:46 A:45 53.0 0.379 H -94.8 -39.0 50.0 0.357 0.022 G:P04908:0.021
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.877
9.966
8.153
7.540
5.330
3.279
6.776
8.370
8.363
6.603
4.457
3.455
9.457
OG1
CG2
O
O
N
N
CG2
N
N
OG1
OG1
CG2
CG2
N2
O3'
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
OP2
THR E:46 E:45 49.0 0.35 T -125.1 -38.7 40.0 0.286 0.064 C:P04908:0.064
DT
DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
9.860
7.494
7.813
7.041
4.198
3.242
9.452
8.694
8.423
4.930
2.978
7.869
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
7k61 1 P68431 96.32 7e-93 EM
2020-11-25 THR A:46 A:45 62.0 0.443 H -68.5 -49.1 58.0 0.414 0.029 G:P04908:0.029
DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
8.875
9.428
7.924
8.064
5.707
3.546
7.505
9.941
8.198
7.902
6.592
3.911
2.453
9.102
CG2
CG2
CG2
O
N
N
C
N
N
N
CG2
OG1
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
OP2
THR E:46 E:45 54.0 0.386 H -69.7 -47.2 51.0 0.364 0.022 C:P04908:0.021
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.254
7.886
6.799
3.829
2.535
9.160
9.272
7.905
8.109
5.359
3.308
7.422
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
7k63 1 P68431 96.32 7e-93 EM
2020-11-25 THR A:46 A:45 57.0 0.407 H -70.4 -48.9 57.0 0.407 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.104
9.420
7.849
7.706
5.514
3.531
7.360
8.303
8.395
6.718
3.962
2.319
9.225
CG2
CG2
CG2
O
N
N
C
OG1
N
CG2
OG1
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
O3'
OP1
OP2
THR E:46 E:45 48.0 0.343 H -71.4 -47.7 46.0 0.329 0.014 C:P04908:0.014
DA
DC
DT
DC
DC
DT
DA
DT
DG
DT
DG
DT
DG
8.308
7.988
6.825
4.198
2.497
9.107
9.954
9.589
7.946
7.333
5.150
3.369
7.669
N
N
CG2
CG2
OG1
OG1
CG2
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
C4'
OP1
OP2
C2
O3'
C4'
OP1
O3'
OP1
OP1
7nl0 1 P68431 96.32 7e-93 EM
2021-08-11 THR A:46 A:45 58.0 0.414 H -74.2 -39.9 58.0 0.414 0.0 DG
DT
DC
DT
DT
DG
DG
DC
DT
DT
DT
DT
DA
8.578
7.570
7.801
5.129
3.117
8.937
9.704
9.224
8.268
8.471
6.156
3.870
6.735
CG2
N
CB
CG2
CG2
CG2
OG1
OG1
OG1
O
N
N
OG1
O5'
OP1
O3'
O3'
OP1
OP2
N2
O3'
C5'
OP1
O3'
OP1
OP1
THR E:46 E:45 63.0 0.45 H -74.7 -43.3 55.0 0.393 0.057 C:P04908:0.057
DA
DG
DG
DA
DC
6.779
4.389
7.503
8.376
9.179
N
N
C
N
N
O3'
OP1
OP1
C5'
OP1
7v6q 2 P68431 96.32 7e-93 X-RAY
2021-12-29 THR B:46 B:45 100.0 0.714 H -64.9 -38.6 100.0 0.714 0.0 1PE
9.432
O
C24
THR F:46 F:45 91.0 0.65 H -65.2 -40.8 NA NA NA
2io5 2 P84233 97.04 8e-93 X-RAY
2007-02-27 THR B:45 NA:NA DO NA DO DO DO NA NA NA
2nqb 2 P02299 97.04 8e-93 X-RAY
2007-09-11 THR C:45 A:445 59.0 0.421 H -59.4 -45.9 59.0 0.421 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.382
6.905
8.365
6.839
3.895
2.588
9.239
9.465
7.587
7.070
5.269
3.588
7.600
8.232
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
N
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:645 59.0 0.421 H -71.9 -44.0 57.0 0.407 0.014 E:P84051:0.014
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.480
7.544
7.340
5.181
3.295
7.637
8.728
7.246
8.360
6.820
3.891
2.600
9.212
2.601
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
2pyo 3 P02299 97.04 8e-93 X-RAY
2007-11-06 THR C:45 A:45 60.0 0.429 H -59.9 -51.7 59.0 0.421 0.008 I:P84051:0.007
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.479
6.924
8.124
7.018
4.079
2.692
9.107
9.528
7.596
7.138
5.136
3.321
7.490
8.605
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:45 59.0 0.421 H -68.4 -47.1 57.0 0.407 0.014 E:P84051:0.014
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.611
7.490
7.244
5.191
3.374
7.646
8.669
7.175
8.123
6.875
4.004
2.635
9.108
7.320
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
C
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
3c9k 3 P84229 97.04 8e-93 EM
2009-01-06 THR C:45 C:45 98.0 0.7 H -54.8 -45.7 98.0 0.7 0.0
THR G:45 G:45 98.0 0.7 H -54.6 -45.7 98.0 0.7 0.0
4qlc 3 P02299 97.04 8e-93 X-RAY
2015-07-22 THR C:45 A:45 50.0 0.357 H -63.1 -53.1 50.0 0.357 0.0 DT
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
9.737
7.963
8.130
6.838
3.686
2.680
8.286
9.130
7.832
8.050
5.391
3.617
7.452
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
THR G:45 E:45 62.0 0.443 H -62.5 -48.3 62.0 0.443 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.592
9.612
8.564
8.093
5.397
3.601
7.739
9.343
7.465
8.067
7.017
3.793
2.990
8.638
CG2
CG2
O
O
N
N
C
OG1
N
N
CG2
CG2
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
OP1
5x0y 1 P84233 97.04 8e-93 EM
2017-04-19 THR A:45 A:45 56.0 0.4 H -53.5 -42.9 54.0 0.386 0.014 B:P62799:0.007
G:Q6AZJ8:0.007
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.626
8.705
8.452
5.043
3.214
7.013
8.787
9.056
6.558
4.581
2.924
9.703
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
OP1
OP1
OP2
THR E:45 E:45 56.0 0.4 H -53.5 -42.9 56.0 0.4 0.0 DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
9.243
9.587
7.923
4.154
2.740
8.221
9.496
7.970
9.312
5.384
3.698
7.100
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
6fml 9 Q71DI3 97.04 8e-93 EM
2018-04-25 THR M:45 M:45 60.0 0.429 H -68.4 -50.8 59.0 0.421 0.008 S:P0C0S9:0.007
DG
DT
DG
DA
DC
5.765
3.742
7.665
8.074
8.395
N
N
C
N
N
O3'
OP1
OP2
C5'
OP1
THR Q:45 Q:45 64.0 0.457 H -90.2 -62.1 59.0 0.421 0.036 O:P0C0S9:0.036
DG
DG
DG
DC
DT
DC
DG
DA
DT
DC
DG
DC
9.312
7.626
8.303
6.619
4.181
2.887
9.126
8.550
8.434
5.430
3.380
7.988
OG1
OG1
N
CG2
CG2
OG1
CG2
CG2
O
N
N
C
O3'
C5'
OP1
O3'
O3'
OP1
N2
C5'
OP1
O3'
OP1
OP2
7eg6 2 P84233 97.04 8e-93 EM
2022-01-12 THR B:45 A:45 58.0 0.414 H -72.1 -46.4 58.0 0.414 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.304
9.893
8.382
7.959
6.334
4.134
8.053
8.713
8.435
6.205
3.952
2.902
9.570
CG2
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP2
THR F:45 E:45 62.0 0.443 H -75.0 -47.3 62.0 0.443 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.678
8.541
6.210
3.884
2.780
9.456
9.668
8.513
8.237
5.728
3.786
7.949
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
C5'
OP1
OP2
O2
C4'
OP1
O3'
OP1
OP1
7egp 11 P84233 97.04 8e-93 EM
2022-01-12 THR L:45 O:45 65.0 0.464 S -92.4 -47.7 49.0 0.35 0.114 R:Q6AZJ8:0.114
M:P62799:0.007
DG
DT
DA
DC
DC
DC
DT
DC
DG
DT
DG
9.659
8.622
7.270
7.702
6.664
4.369
9.571
8.488
4.164
2.652
6.802
N
OG1
OG1
N
CG2
CG2
CG2
N
N
N
CB
N2
C5'
O5'
OP1
O3'
OP1
OP2
O3'
O3'
OP1
OP1
THR P:45 S:45 84.0 0.6 T -83.2 -48.0 79.0 0.564 0.036 Q:P62799:0.036
DC
DC
DG
DC
DG
DG
DG
DG
DG
DC
DT
DC
DC
8.038
4.877
3.232
7.505
8.799
9.248
8.196
7.253
7.890
9.621
5.634
3.292
7.921
N
N
N
CB
N
N
OG1
OG1
OG1
CG2
CG2
CG2
OG1
O3'
O3'
OP1
OP1
N2
N2
C5'
C5'
OP1
O3'
O3'
OP1
OP1
7enn 2 P84233 97.04 8e-93 EM
2021-07-14 THR B:45 A:45 60.0 0.429 H -78.5 -47.9 60.0 0.429 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.524
9.715
8.225
8.077
5.855
3.723
7.814
8.578
8.342
6.874
4.513
3.067
9.435
CG2
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C4'
OP1
OP1
THR F:45 E:45 60.0 0.429 H -85.0 -48.1 60.0 0.429 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.800
8.515
6.925
4.137
2.802
9.411
9.747
8.285
7.860
5.620
3.570
7.618
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
7lya 1 P68431 96.32 2e-92 EM
2021-07-28 THR A:50 A:45 57.0 0.407 H -83.6 -51.3 57.0 0.407 0.0 DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.701
8.797
6.943
4.423
2.828
9.136
9.416
8.046
8.231
5.642
3.719
7.658
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
C5'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR D:50 E:45 58.0 0.414 H -83.6 -51.4 54.0 0.386 0.028 I:P04908:0.029
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.543
8.020
8.387
5.850
3.884
7.976
8.819
8.471
6.820
4.427
2.877
9.234
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP1
7lyb 1 P68431 96.32 2e-92 EM
2021-07-28 THR A:50 A:45 56.0 0.4 H -66.3 -43.8 56.0 0.4 0.0 DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.521
8.709
6.779
4.196
3.563
9.334
8.753
8.682
5.804
3.936
7.148
N
N
OG1
OG1
CG2
CG2
OG1
O
N
N
CG2
C5'
OP1
O3'
O3'
OP1
OP1
C4'
OP1
O3'
OP1
OP1
THR D:50 E:45 56.0 0.4 H -66.4 -43.8 56.0 0.4 0.0 DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
8.512
8.530
6.021
4.062
7.282
8.307
8.518
6.908
4.745
3.201
9.474
OG1
O
N
N
CG2
N
N
OG1
OG1
CG2
CG2
C5'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
7lyc 1 P68431 96.32 2e-92 EM
2021-06-16 THR A:50 A:45 49.0 0.35 H -77.3 -40.3 48.0 0.343 0.007 L:P04908:0.007
DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.520
8.194
6.501
4.439
3.144
9.008
8.495
8.066
5.610
3.671
6.664
N
N
OG1
OG1
CG2
CG2
OG1
O
N
N
CG2
C5'
OP1
O3'
C4'
OP1
OP1
C4'
OP1
O3'
OP1
OP1
THR D:50 E:45 48.0 0.343 H -77.2 -40.3 48.0 0.343 0.0 DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.801
8.281
7.869
5.951
3.910
6.760
8.479
8.181
6.287
4.341
3.270
8.915
CG2
OG1
O
N
N
CG2
N
N
OG1
OG1
CG2
CG2
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
OP1
6t79 1 Q71DI3 96.32 2e-92 EM
2020-04-29 THR A:46 A:45 58.0 0.414 H -73.6 -51.5 58.0 0.414 0.0 DT
DC
DG
DC
DA
DC
DG
DG
DC
DA
DC
DA
8.830
7.183
8.351
7.323
3.791
2.686
8.891
8.617
8.813
5.437
3.575
7.829
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
C5'
OP1
O3'
OP1
OP2
THR E:46 E:45 64.0 0.457 H -74.5 -52.9 64.0 0.457 0.0 DC
DA
DT
DA
DT
DA
DC
DA
DA
DG
DA
DT
9.406
8.725
5.826
3.796
8.006
8.726
7.450
8.582
7.135
4.242
2.641
9.275
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
C5'
OP1
OP2
6t7a 1 Q71DI3 96.32 2e-92 EM
2020-04-29 THR A:46 A:45 62.0 0.443 H -68.6 -42.0 62.0 0.443 0.0 DT
DC
DG
DA
DC
DA
8.506
6.828
7.925
5.952
4.084
7.412
OG1
CG2
N
N
N
OG1
C5'
OP1
OP1
O3'
OP1
OP1
THR E:46 E:45 62.0 0.443 H -69.9 -42.8 62.0 0.443 0.0 DT
DA
DT
DA
DC
DA
5.881
3.857
8.161
9.582
8.343
8.420
N
N
C
OG1
OG1
N
O3'
OP1
OP2
O3'
C5'
OP1
6t7b 1 Q71DI3 96.32 2e-92 EM
2020-04-29 THR A:46 A:45 62.0 NA H -68.6 -42.0 62.0 NA NA DT
DC
DG
DA
DC
DA
9.389
7.549
7.925
5.952
4.083
8.400
N
N
N
N
N
C
C4'
OP1
OP1
O3'
OP1
OP2
THR E:46 E:45 56.0 NA H -69.9 -42.8 56.0 NA NA DT
DA
DT
DA
DC
DA
5.881
3.857
8.160
9.870
8.438
8.419
N
N
C
N
N
N
O3'
OP1
OP2
O3'
C5'
OP1
6t7c 1 Q71DI3 96.32 2e-92 EM
2020-04-29 THR A:46 A:45 61.0 0.436 H -68.1 -42.2 61.0 0.436 0.0 DT
DC
DG
DA
DC
DA
8.524
6.907
7.986
6.006
4.162
7.392
OG1
CG2
N
N
N
OG1
C5'
OP1
OP1
O3'
OP1
OP1
THR E:46 E:45 61.0 0.436 H -69.6 -42.8 61.0 0.436 0.0 DT
DA
DT
DA
DC
DA
5.898
3.864
8.159
9.646
8.392
8.457
N
N
C
OG1
OG1
N
O3'
OP1
OP2
O3'
C5'
OP1
6t7d 1 Q71DI3 96.32 2e-92 EM
2020-04-29 THR A:46 A:45 59.0 NA H -69.3 -43.3 59.0 NA NA DC
DG
DA
DC
DA
9.456
9.602
6.208
3.994
7.968
N
N
N
N
C
OP1
OP1
O3'
OP1
OP2
THR E:46 E:45 59.0 NA H -69.1 -49.8 59.0 NA NA DC
DA
DT
DA
DT
DC
DA
DA
DG
DG
8.400
7.599
6.827
4.628
7.994
9.343
9.634
7.549
5.028
5.537
O
O
N
N
C
N
N
CA
CA
N
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
3azf 1 P68431 95.59 2e-92 X-RAY
2011-09-21 THR A:49 A:45 61.0 0.436 H -64.6 -41.6 55.0 0.393 0.043 G:P04908:0.043
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.346
6.852
8.175
7.187
4.105
2.743
9.323
9.298
7.571
7.142
4.982
3.354
7.284
2.646
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 56.0 0.4 H -65.4 -49.6 52.0 0.371 0.029 C:P04908:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.410
7.562
7.997
5.177
3.323
7.632
8.560
7.137
8.208
6.727
3.812
2.758
9.360
2.481
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
3aze 1 P68431 95.59 2e-92 X-RAY
2011-09-21 THR A:49 A:45 57.0 0.407 H -75.3 -33.6 53.0 0.379 0.028 G:P04908:0.029
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.000
6.451
8.035
7.151
3.606
3.047
9.258
9.925
7.505
7.466
5.142
3.182
7.968
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
N3
O3'
OP1
O3'
OP1
OP2
THR E:49 E:45 55.0 0.393 H -49.7 -50.8 55.0 0.393 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.175
7.896
6.819
5.186
3.940
7.281
8.357
6.969
7.976
6.731
3.982
2.826
8.631
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3azh 1 P68431 95.59 2e-92 X-RAY
2011-09-21 THR A:49 A:45 55.0 0.393 H -78.9 -46.6 55.0 0.393 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.563
7.373
8.621
7.383
4.098
2.746
8.978
9.617
7.429
7.436
4.678
3.027
7.008
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 58.0 0.414 H -67.3 -33.1 58.0 0.414 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.649
7.894
7.711
5.216
3.545
7.125
8.456
6.863
8.267
6.839
3.574
2.729
9.002
CG2
O
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3azg 1 P68431 95.59 2e-92 X-RAY
2011-09-21 THR A:49 A:45 61.0 0.436 H -61.7 -47.9 58.0 0.414 0.022 G:P04908:0.021
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.397
6.960
8.242
7.040
4.107
2.541
9.172
9.476
7.631
6.921
5.128
3.454
7.246
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 58.0 0.414 H -74.9 -43.4 53.0 0.379 0.035 C:P04908:0.036
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.757
7.664
7.980
5.190
3.358
7.597
8.542
7.068
8.289
6.858
3.869
2.687
9.285
7.788
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
C
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
3ayw 1 P68431 95.59 2e-92 X-RAY
2011-09-21 THR A:49 A:45 58.0 0.414 H -57.6 -42.6 53.0 0.379 0.035 G:P04908:0.036
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.437
6.940
8.965
7.167
4.176
2.775
9.732
9.450
7.654
7.183
5.260
3.619
7.090
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:49 E:45 59.0 0.421 H -65.4 -49.3 59.0 0.421 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.409
7.435
7.451
5.260
3.387
7.218
8.793
7.361
8.301
6.798
3.883
2.969
8.976
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5b40 1 Q71DI3 96.32 2e-92 X-RAY
2016-06-22 THR A:49 A:45 56.0 0.4 H -99.0 -23.5 56.0 0.4 0.0 DA
DG
DC
DA
DT
DT
DG
DT
DC
DA
DA
DC
9.585
7.713
7.886
6.964
4.941
3.055
8.598
8.524
8.373
4.896
3.019
6.672
N
N
N
OG1
OG1
CG2
CG2
O
O
N
N
CG2
O3'
C5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:49 E:45 53.0 0.379 H -98.6 -25.2 53.0 0.379 0.0 DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
8.519
8.153
5.229
3.423
6.902
9.980
7.982
7.755
6.539
4.717
3.180
9.338
O
O
N
N
CG2
N
N
N
OG1
CG2
CG2
CG2
O3'
OP1
O3'
OP1
OP1
O3'
C5'
OP1
O3'
O3'
OP1
OP1
6nzo 1 A0A310TTQ1 95.59 4e-92 EM
2019-08-28 THR A:46 A:45 54.0 0.386 H -69.7 -33.9 49.0 0.35 0.036 G:P0CH09+Q6AZJ8:0.036
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.423
8.519
8.334
6.295
4.070
7.363
8.650
7.993
5.981
3.865
3.186
9.154
OG1
O
O
N
N
CG2
N
N
OG1
OG1
CG2
CG2
N2
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP1
THR E:46 E:45 56.0 0.4 H -65.0 -48.3 14.0 0.1 0.3 K:G0S676:0.3
DA
DC
DG
DT
DG
8.189
8.055
5.407
3.574
7.571
OG1
N
N
N
C
OP1
OP1
O3'
OP1
OP2
6px1 1 A0A310TTQ1 95.59 4e-92 EM
2019-08-28 THR A:46 A:45 60.0 0.429 H -72.4 -49.8 60.0 0.429 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
8.946
9.728
8.136
8.039
5.997
3.812
6.973
8.316
8.021
6.229
3.951
3.245
9.045
OG1
CG2
OG1
O
N
N
CG2
N
N
OG1
OG1
CG2
CG2
N2
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
OP1
THR E:46 E:45 56.0 0.4 H -84.1 -46.9 56.0 0.4 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.205
8.021
6.508
4.021
3.240
8.820
9.803
8.503
8.122
5.431
3.556
6.859
N
N
OG1
OG1
CG2
CG2
OG1
OG1
O
N
N
CG2
C5'
OP1
O3'
C5'
OP1
OP1
O2
C4'
OP1
O3'
OP1
OP1
6px3 1 A0A310TTQ1 95.59 4e-92 EM
2019-08-28 THR A:46 A:45 54.0 0.386 H -69.7 -33.9 49.0 0.35 0.036 G:P0CH09+Q6AZJ8:0.036
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.423
8.518
8.333
6.295
4.070
7.362
8.651
7.993
5.981
3.865
3.186
9.154
OG1
O
O
N
N
CG2
N
N
OG1
OG1
CG2
CG2
N2
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP1
THR E:46 E:45 57.0 0.407 H -65.0 -48.3 14.0 0.1 0.307 K:G0S676:0.307
DA
DC
DG
DT
DG
8.190
8.055
5.407
3.574
7.571
OG1
N
N
N
C
OP1
OP1
O3'
OP1
OP2
7mbm 5 A0A310TTQ1 95.59 4e-92 EM
2021-12-29 THR E:46 G:45 65.0 0.464 H -70.8 -40.4 65.0 0.464 0.0 DT
DG
DT
DG
DA
DC
DT
DC
DC
9.638
7.462
5.465
9.182
9.625
9.822
6.204
4.664
3.926
O
N
N
C
N
N
CG2
CG2
OG1
OP1
O3'
OP1
OP2
C5'
OP1
O3'
OP1
OP1
THR I:46 K:45 66.0 0.471 H -70.9 -40.5 66.0 0.471 0.0 DG
DG
DC
DT
DC
DA
DT
DC
DG
DC
9.295
9.769
6.902
5.266
3.952
9.442
8.150
6.715
4.317
8.546
N
N
CG2
CG2
OG1
O
O
N
N
C
C5'
OP1
O3'
O3'
OP1
O3'
OP1
O3'
OP1
OP2
7mbn 5 A0A310TTQ1 95.59 4e-92 EM
2021-12-29 THR E:46 G:45 41.0 0.293 H -49.7 -52.6 38.0 0.271 0.022 K:Q6AZJ8:0.021
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
9.658
7.724
8.438
4.297
2.423
5.815
9.291
8.498
9.313
7.949
5.408
3.429
9.889
OG1
O
O
N
N
OG1
CG2
CG2
N
CG2
CG2
CG2
CG2
O3'
C5'
OP1
O3'
OP1
OP1
O3'
O5'
OP1
O3'
O3'
OP1
OP2
THR I:46 K:45 41.0 0.293 H -49.5 -52.8 39.0 0.279 0.014 G:Q6AZJ8:0.014
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.651
9.004
8.684
4.209
2.726
8.885
9.974
7.909
8.581
4.493
2.702
5.153
CG2
N
CB
CG2
CG2
CG2
OG1
O
O
N
N
OG1
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
6ugm 1 Q92133 96.3 5e-92 EM
2019-11-20 THR A:45 A:45 80.0 0.571 T -120.7 34.4 71.0 0.507 0.064 G:Q6AZJ8:0.064
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
9.866
7.749
8.900
5.807
3.758
7.080
9.043
8.663
6.195
4.390
4.385
O
O
O
N
N
O
N
N
CG2
CG2
CB
O3'
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
THR E:45 E:45 56.0 0.4 T -99.1 -3.1 55.0 0.393 0.007 C:Q6AZJ8:0.007
DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.365
7.969
6.187
4.120
3.262
8.715
9.207
8.810
5.975
3.836
7.714
N
N
OG1
CG2
CG2
CG2
O
O
N
N
CG2
C5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
6uh5 1 Q92133 96.3 5e-92 EM
2019-11-20 THR A:45 A:45 67.0 0.479 T -98.3 18.9 54.0 0.386 0.093 G:Q6AZJ8:0.093
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.624
7.931
8.081
5.913
3.675
7.170
8.645
8.484
7.854
5.037
2.716
8.137
O
O
O
N
N
O
N
N
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP1
THR E:45 E:45 68.0 0.486 H -107.1 -25.1 58.0 0.414 0.072 C:Q6AZJ8:0.071
DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.320
7.860
6.411
4.365
3.452
9.464
8.970
8.408
5.741
3.651
8.015
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
1f66 2 Q7ZT64 95.59 6e-92 X-RAY
2000-11-27 THR C:46 A:445 58.0 0.414 H -78.7 -45.1 58.0 0.414 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.660
7.116
8.437
6.789
4.113
2.879
9.560
9.570
7.599
7.106
5.090
3.408
7.516
8.142
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:46 E:645 51.0 0.364 H -65.9 -43.3 51.0 0.364 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.503
7.629
7.516
5.274
3.387
7.415
8.731
7.192
8.353
6.683
3.746
2.565
9.337
4.662
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
7m1x 3 A0A310TTQ1 95.59 6e-92 EM
2021-09-29 THR C:46 A:445 68.0 0.486 S -110.8 -44.4 68.0 0.486 0.0 DG
DG
DC
DG
DC
8.838
8.542
5.897
3.822
6.473
N
N
N
N
OG1
C5'
OP1
O3'
OP1
OP1
THR G:46 E:645 63.0 0.45 H -66.8 -38.7 63.0 0.45 0.0 DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DT
8.851
7.788
5.814
3.711
6.730
8.654
8.548
8.084
4.576
3.599
9.176
O
O
N
N
OG1
N
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
C4'
OP1
O3'
O3'
OP1
OP1
1kx3 2 P84233 96.3 6e-92 X-RAY
2002-12-25 THR C:45 A:45 57.0 0.407 H -58.8 -43.8 57.0 0.407 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.343
6.853
8.191
6.843
3.896
2.612
9.151
9.520
7.591
6.935
5.279
3.464
7.451
2.626
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:45 57.0 0.407 H -63.5 -49.9 54.0 0.386 0.021 E:P06897:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.331
7.382
7.145
5.201
3.305
7.459
8.490
7.023
8.044
6.993
3.879
2.581
9.270
2.557
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
1kx4 2 P16105 96.3 6e-92 X-RAY
2002-12-25 THR C:45 A:45 64.0 0.457 H -75.6 -39.2 61.0 0.436 0.021 I:P06897:0.021
DA
DA
DC
DG
DG
DA
DG
DA
DC
DA
DA
DA
DA
DG
HOH
8.379
7.086
8.031
9.956
8.033
3.568
2.936
9.764
9.568
8.389
8.724
5.057
3.193
7.720
4.129
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
OG1
O3'
OP1
OP1
N2
O3'
O3'
OP1
OP2
O2
C5'
OP1
O3'
OP1
OP2
O
THR G:45 E:45 54.0 0.386 H -57.4 -45.5 51.0 0.364 0.022 E:P06897:0.021
DC
DA
DA
DG
DA
DA
DA
DC
DT
DG
DG
DA
DG
DA
HOH
8.881
7.979
8.485
5.212
3.656
7.012
8.615
7.143
7.787
9.672
7.862
3.835
2.942
9.615
5.047
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
O
O2
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
N2
O3'
O3'
OP1
OP2
O
1kx5 3 P16105 96.3 6e-92 X-RAY
2002-12-25 THR C:45 A:45 58.0 0.414 H -65.8 -42.8 55.0 0.393 0.021 I:P06897:0.021
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.671
7.109
8.071
6.935
3.876
2.557
8.970
9.453
7.558
6.921
5.278
3.459
7.464
2.529
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
OG1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR G:45 E:45 58.0 0.414 H -65.2 -44.2 49.0 0.35 0.064 E:P06897:0.064
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.592
7.631
6.846
5.277
3.335
7.494
8.612
7.075
8.151
7.032
3.809
2.541
9.063
2.485
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
1s32 2 30268544 96.3 6e-92 X-RAY
2004-05-11 THR C:45 A:445 52.0 0.371 H -62.5 -50.1 52.0 0.371 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.448
7.073
8.275
6.850
3.883
2.654
9.236
9.454
7.558
7.163
5.214
3.460
7.554
2.731
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:645 58.0 0.414 H -64.8 -49.8 55.0 0.393 0.021 E:30268540:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.517
7.559
7.284
5.167
3.277
7.552
8.701
7.273
8.465
6.844
3.904
2.623
9.178
2.775
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
1zbb 3 P84233 96.3 6e-92 X-RAY
2005-07-12 THR C:45 A:45 58.0 0.414 H -65.8 -42.8 54.0 0.386 0.028 I:P06897:0.029
DT
DG
DG
DA
DA
DG
DC
DT
DC
DC
DT
9.706
9.205
5.264
3.453
7.446
8.666
7.104
8.059
6.453
5.319
8.277
CG2
CG2
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
O3'
C5'
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
OP2
THR G:45 E:45 58.0 0.414 H -65.0 -44.3 55.0 0.393 0.021 E:P06897:0.021
DG
DC
DT
DC
DC
DA
DA
DG
DA
DA
8.601
7.068
8.134
6.416
5.860
8.805
9.341
5.263
3.326
7.476
OG1
OG1
N
OG1
OG1
CG2
O
N
N
C
O3'
OP1
OP1
O3'
OP1
C4'
OP1
O3'
OP1
OP2
THR K:45 a:45 61.0 0.436 H -65.8 -42.7 56.0 0.4 0.036 Q:P06897:0.036
DA
DT
DG
DG
DA
DA
DG
DC
DT
DC
DC
DT
DG
9.754
8.117
8.734
5.264
3.452
7.446
8.669
7.110
8.061
9.619
4.983
3.805
8.492
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR O:45 e:45 60.0 0.429 H -65.0 -44.4 57.0 0.407 0.022 M:P06897:0.021
DG
DC
DT
DC
DC
DA
DA
DG
DA
DA
8.598
7.064
8.132
7.891
7.427
7.971
8.133
5.264
3.328
7.477
OG1
OG1
N
OG1
OG1
CG2
O
N
N
C
O3'
OP1
OP1
O3'
OP1
O3'
OP1
O3'
OP1
OP2
2fj7 3 30268544 96.3 6e-92 X-RAY
2006-09-26 THR C:45 A:45 53.0 0.379 H -49.6 -84.9 53.0 0.379 0.0 DA
DT
DA
DT
DG
DA
DA
DA
DT
DT
DG
8.600
7.830
6.018
7.665
5.419
3.388
7.553
9.171
6.598
4.349
3.526
OG1
CG2
CG2
CG2
N
N
CB
CG2
OG1
OG1
OG1
C2
O3'
C4'
OP1
O3'
OP1
OP2
C2
O3'
C5'
OP1
THR G:45 E:45 59.0 0.421 T -101.8 19.2 49.0 0.35 0.071 E:30268540:0.071
DT
DG
DG
DT
DT
DG
DA
DT
DA
DT
DA
DT
DT
8.296
7.437
9.035
6.244
4.324
3.285
9.883
9.208
7.913
8.804
5.041
3.411
6.732
OG1
OG1
N
CG2
CG2
CG2
OG1
O
O
O
N
N
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
2nzd 3 288992 96.3 6e-92 X-RAY
2007-04-10 THR C:45 A:45 56.0 0.4 H -64.9 -43.6 56.0 0.4 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.388
6.780
8.252
7.461
4.065
2.889
9.318
9.681
7.772
7.074
5.104
3.229
7.156
8.755
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
O
THR G:45 E:45 62.0 0.443 H -78.6 -51.6 61.0 0.436 0.007 E:Q6AZJ8:0.007
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
HOH
8.014
7.492
5.029
3.148
7.829
8.261
6.633
8.284
6.570
4.017
2.560
9.378
7.680
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
3b6f 3 P84233 96.3 6e-92 X-RAY
2007-12-25 THR C:45 A:45 67.0 0.479 H -66.8 -48.8 67.0 0.479 0.0 DG
DC
DT
DT
DT
DG
DA
DA
DT
DG
DA
DA
9.198
9.074
9.140
6.736
4.192
3.269
8.923
8.325
7.439
5.151
3.199
7.669
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
C5'
OP1
OP2
C5'
OP1
O3'
OP1
OP1
THR G:45 E:45 57.0 0.407 H -84.8 -11.7 56.0 0.4 0.007 E:Q6AZJ8:0.007
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
7.981
8.154
4.807
3.081
7.866
8.405
7.334
8.109
6.845
3.734
3.096
9.120
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3b6g 3 P84233 96.3 6e-92 X-RAY
2007-12-25 THR C:45 A:45 63.0 0.45 H -77.2 -41.7 58.0 0.414 0.036 I:Q6AZJ8:0.036
DG
DC
DT
DT
DT
DG
DA
DA
DT
DG
DA
DA
9.200
8.715
8.646
6.793
4.492
3.692
9.457
7.991
7.224
4.715
2.925
7.521
OG1
OG1
N
CG2
CG2
CG2
OG1
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
THR G:45 E:45 66.0 0.471 T -98.5 29.6 54.0 0.386 0.085 E:Q6AZJ8:0.086
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.854
7.512
7.710
5.371
3.386
7.071
8.746
7.298
8.498
6.096
3.966
3.332
9.250
O
O
O
N
N
O
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
C5'
OP1
OP2
3c1b 1 P02302 96.3 6e-92 X-RAY
2008-10-07 THR A:45 A:445 51.0 0.364 H -67.1 -45.5 49.0 0.35 0.014 G:P06897:0.014
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.397
7.073
8.302
6.833
3.953
2.634
9.081
9.438
7.547
7.321
5.123
3.331
7.501
2.671
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR E:45 E:645 56.0 0.4 H -63.8 -46.3 52.0 0.371 0.029 C:P06897:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.536
7.632
7.484
5.206
3.351
7.533
8.617
7.135
8.089
6.849
3.929
2.608
9.156
2.802
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
3kuy 1 P84233 96.3 6e-92 X-RAY
2010-01-05 THR A:45 A:45 56.0 0.4 H -73.6 -44.7 56.0 0.4 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.364
7.017
8.714
7.327
4.177
2.574
8.716
9.683
7.742
7.073
4.996
3.070
7.555
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
THR E:45 E:45 59.0 0.421 H -76.8 -44.2 57.0 0.407 0.014 C:Q6AZJ8:0.014
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.722
7.914
7.189
5.170
3.245
7.706
8.472
6.917
8.344
6.648
3.926
2.802
9.457
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3lja 1 P84233 96.3 6e-92 X-RAY
2010-04-14 THR A:45 A:45 57.0 0.407 H -75.5 -42.9 56.0 0.4 0.007 G:Q6AZJ8:0.007
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
8.608
6.982
8.189
7.096
4.171
2.963
9.205
9.617
7.940
7.075
4.994
3.104
7.352
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
THR E:45 E:45 60.0 0.429 H -81.7 -40.3 60.0 0.429 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.752
7.717
7.084
5.064
3.067
7.549
8.703
7.083
8.197
7.050
4.032
2.894
9.159
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3lz0 1 P84233 96.3 6e-92 X-RAY
2010-09-15 THR A:45 A:45 56.0 0.4 H -78.1 -38.9 56.0 0.4 0.0 DT
DA
DC
DT
DC
DG
DA
DG
DT
DG
DT
DG
8.981
7.701
7.838
8.016
4.192
3.045
9.311
8.387
8.410
4.896
3.033
7.437
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 58.0 0.414 H -93.5 -26.4 57.0 0.407 0.007 C:Q6AZJ8:0.007
F:P62799:0.007
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DG
DA
8.313
7.736
4.787
2.851
7.422
9.223
7.310
7.888
6.810
3.761
3.476
9.690
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3lz1 1 P84233 96.3 6e-92 X-RAY
2010-09-15 THR A:45 A:45 57.0 0.407 H -85.7 -38.0 57.0 0.407 0.0 DG
DG
DG
DC
DT
DG
DA
DA
DT
DC
DG
DC
8.185
7.143
7.853
8.064
4.195
3.178
9.350
8.416
8.444
5.043
3.045
7.746
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 58.0 0.414 H -112.2 -22.8 52.0 0.371 0.043 C:Q6AZJ8:0.043
DG
DT
DG
DT
DG
DT
DA
DC
DT
DC
DG
DA
8.360
7.775
4.761
2.786
7.580
9.920
7.594
8.053
6.923
4.074
3.782
9.811
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3mgp 1 P84233 96.3 6e-92 X-RAY
2010-06-16 THR A:45 A:45 53.0 0.379 H -69.0 -42.7 53.0 0.379 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.678
6.845
8.358
6.977
3.842
2.876
9.315
9.843
7.669
6.836
5.190
3.252
7.418
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
THR E:45 E:45 60.0 0.429 H -79.1 -38.8 60.0 0.429 0.0 DT
DA
DT
DT
DG
DA
DC
DT
DG
DT
DT
DG
DA
CO
9.569
7.660
7.404
5.320
3.264
7.615
9.620
7.559
8.527
6.622
3.863
2.729
9.281
8.422
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
CO
3mgq 1 P84233 96.3 6e-92 X-RAY
2010-06-16 THR A:45 A:45 58.0 0.414 H -73.4 -44.4 56.0 0.4 0.014 G:Q6AZJ8:0.014
DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DA
DC
8.755
7.066
8.460
6.879
3.878
3.078
9.632
7.892
6.844
5.321
3.329
7.672
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
THR E:45 E:45 63.0 0.45 H -86.4 -39.4 60.0 0.429 0.021 C:Q6AZJ8:0.021
DT
DA
DT
DT
DG
DA
DC
DT
DG
DT
DT
DG
DA
9.905
7.742
7.283
5.152
3.205
7.658
9.311
7.483
8.488
6.802
3.874
2.966
9.517
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3mgr 1 P84233 96.3 6e-92 X-RAY
2010-06-16 THR A:45 A:45 60.0 0.429 H -66.3 -48.1 57.0 0.407 0.022 G:Q6AZJ8:0.021
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
8.778
7.019
8.049
7.226
3.984
2.812
9.258
9.437
7.769
6.944
5.099
3.206
7.131
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
THR E:45 E:45 60.0 0.429 H -75.1 -43.4 59.0 0.421 0.008 C:Q6AZJ8:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.820
7.729
7.067
5.143
3.213
7.619
8.729
7.084
8.219
7.030
3.920
2.626
8.956
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3mgs 1 P84233 96.3 6e-92 X-RAY
2010-06-16 THR A:45 A:45 56.0 0.4 H -72.4 -44.1 53.0 0.379 0.021 G:Q6AZJ8:0.021
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
8.845
7.156
8.064
7.289
4.288
2.896
9.431
9.528
7.814
7.085
5.112
3.065
7.085
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
THR E:45 E:45 59.0 0.421 H -75.5 -42.2 59.0 0.421 0.0 DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
7.743
7.080
5.180
3.220
7.436
8.754
7.180
8.372
6.952
4.065
2.614
8.905
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3mnn 1 P84233 96.3 6e-92 X-RAY
2011-04-06 THR A:45 A:45 52.0 0.371 H -62.6 -51.2 52.0 0.371 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.268
6.557
8.420
7.120
3.973
2.673
8.562
9.415
7.628
7.322
5.145
3.251
7.164
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR E:45 E:45 56.0 0.4 H -71.9 -49.9 54.0 0.386 0.014 C:Q6AZJ8:0.014
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.379
7.747
7.326
5.172
3.237
7.540
8.395
6.831
8.211
6.864
3.877
2.662
9.207
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3mvd 1 P84233 96.3 6e-92 X-RAY
2010-08-25 THR A:45 A:45 57.0 0.407 H -63.2 -53.3 50.0 0.357 0.05 G:Q6AZJ8:0.05
DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
9.495
9.414
8.246
8.105
5.285
3.408
7.317
9.045
8.511
7.941
6.978
3.740
2.695
8.806
CG2
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR E:45 E:45 63.0 0.45 H -62.6 -47.8 63.0 0.45 0.0 DT
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
9.913
7.769
7.627
7.088
3.435
2.713
8.816
9.512
8.401
8.538
5.361
3.430
7.467
OG1
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
C5'
OP1
O3'
O3'
OP1
OP2
O2
C5'
OP1
O3'
OP1
OP2
3o62 1 P84233 96.3 6e-92 X-RAY
2011-01-05 THR A:45 A:45 72.0 0.514 T -126.7 -23.3 58.0 0.414 0.1 G:P06897:0.1
DA
DC
DC
DA
DA
DC
DT
DG
DA
DA
DC
7.832
5.691
8.089
7.661
5.531
4.292
9.610
9.701
4.700
2.723
9.196
OG1
OG1
OG1
CG2
CG2
CG2
OG1
N
N
N
C
O3'
OP1
OP1
O3'
OP1
OP2
OP2
O3'
O3'
OP1
OP1
THR E:45 E:45 79.0 0.564 T -136.7 -27.4 73.0 0.521 0.043 C:P06897:0.043
DA
DT
DC
DA
DA
DG
DG
DG
DT
DT
DG
DA
8.892
9.385
4.687
2.975
7.072
7.711
5.735
7.107
7.426
4.380
3.552
9.331
O
O
N
N
C
OG1
OG1
OG1
CG2
CG2
CG2
OG1
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP2
OP2
3reh 1 P84233 96.3 6e-92 X-RAY
2012-03-14 THR A:45 A:45 53.0 0.379 H -76.3 -43.0 53.0 0.379 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.289
6.768
8.119
7.413
3.888
2.865
9.493
9.861
7.799
7.189
4.904
3.050
7.196
8.465
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
C4'
O3'
OP1
O3'
OP1
OP1
O
THR E:45 E:45 59.0 0.421 H -69.4 -53.1 59.0 0.421 0.0 DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
HOH
9.999
7.894
7.391
5.130
3.238
7.653
8.141
6.532
8.249
6.473
3.911
2.557
9.161
7.571
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O2
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
3rei 1 P84233 96.3 6e-92 X-RAY
2012-03-14 THR A:45 A:45 56.0 0.4 H -70.9 -42.6 56.0 0.4 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.143
6.603
8.155
7.145
3.976
2.764
9.384
9.955
7.818
7.257
4.996
3.150
7.513
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 57.0 0.407 H -77.1 -46.6 57.0 0.407 0.0 DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
7.765
7.333
5.063
3.153
7.641
8.346
6.736
8.429
6.534
4.083
2.617
9.225
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3rej 1 P84233 96.3 6e-92 X-RAY
2012-03-14 THR A:45 A:45 63.0 0.45 H -72.3 -48.3 63.0 0.45 0.0 DA
DA
DC
DG
DA
DG
DA
DC
DA
DA
DA
DA
DG
HOH
8.459
6.897
8.022
7.883
3.744
2.900
9.910
9.982
8.616
8.031
5.179
3.211
7.596
4.261
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
O
THR E:45 E:45 56.0 0.4 H -67.0 -41.2 56.0 0.4 0.0 DC
DA
DA
DG
DA
DA
DA
DC
DT
DG
DG
DA
DG
DA
HOH
9.870
8.428
8.298
5.319
3.452
7.395
8.418
6.783
7.871
9.675
7.286
3.658
2.936
9.302
4.965
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
O
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
N2
O3'
O3'
OP1
OP2
O
3rek 1 P84233 96.3 6e-92 X-RAY
2012-03-14 THR A:45 A:45 64.0 0.457 H -65.4 -45.7 63.0 0.45 0.007 G:P06897:0.007
DA
DA
DC
DG
DA
DG
DA
DC
DA
DA
DA
DA
DG
8.511
6.967
7.892
7.795
3.679
2.870
9.725
9.938
8.674
7.934
5.181
3.254
7.648
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O2
C5'
OP1
O3'
OP1
OP1
THR E:45 E:45 55.0 0.393 H -73.0 -43.1 54.0 0.386 0.007 C:P06897:0.007
DC
DA
DA
DG
DA
DA
DA
DC
DT
DG
DG
DA
DG
DA
9.811
8.383
8.461
5.238
3.292
7.471
8.397
6.757
7.739
9.796
7.401
3.980
3.061
9.695
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
N2
O3'
O3'
OP1
OP2
3rel 1 P84233 96.3 6e-92 X-RAY
2012-03-14 THR A:45 A:45 61.0 0.436 H -68.2 -45.8 60.0 0.429 0.007 G:P06897:0.007
DA
DA
DC
DG
DA
DG
DA
DC
DA
DA
DA
DA
DG
8.477
7.001
7.915
7.790
3.695
2.699
9.691
9.773
8.654
8.109
5.396
3.399
7.552
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O2
C5'
OP1
O3'
OP1
OP1
THR E:45 E:45 53.0 0.379 H -84.4 -46.6 53.0 0.379 0.0 DC
DA
DA
DG
DA
DA
DA
DC
DT
DG
DG
DA
DG
DA
9.614
8.333
8.161
5.197
3.162
7.332
8.532
6.990
7.953
9.556
7.509
3.971
3.201
9.774
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
O2
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
N2
O3'
O3'
OP1
OP2
3tu4 1 P84233 96.3 6e-92 X-RAY
2011-11-23 THR A:45 A:45 58.0 0.414 H -77.8 -46.3 54.0 0.386 0.028 G:Q6AZJ8:0.029
DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
9.118
9.958
8.629
8.253
5.091
3.259
7.579
8.836
7.286
7.654
7.217
3.756
2.965
8.924
CG2
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR E:45 E:45 56.0 0.4 H -77.2 -45.1 51.0 0.364 0.036 C:Q6AZJ8:0.036
DT
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
9.975
7.838
7.580
7.363
3.901
2.920
9.099
9.596
8.441
7.951
4.883
3.110
7.117
OG1
N
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
O3'
C5'
OP1
O3'
O3'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP1
3ut9 1 P84233 96.3 6e-92 X-RAY
2012-04-11 THR A:45 A:45 53.0 0.379 H -75.2 -40.0 53.0 0.379 0.0 DT
DA
DC
DG
DT
DG
DA
DA
DA
DT
DG
DT
DG
9.790
8.165
8.054
6.795
3.618
2.845
9.682
9.753
7.871
7.398
5.002
3.038
7.404
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
C5'
OP1
O3'
O3'
OP1
OP1
C2'
O3'
OP1
O3'
OP1
OP2
THR E:45 E:45 56.0 0.4 H -72.1 -47.9 56.0 0.4 0.0 DA
DA
DT
DG
DT
DG
DT
DA
DC
DG
DT
DG
HOH
9.479
7.945
7.870
5.023
3.164
7.437
8.706
7.350
7.682
7.171
3.861
2.796
6.576
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
O
3uta 1 P84233 96.3 6e-92 X-RAY
2012-04-11 THR A:45 A:45 56.0 0.4 H -70.3 -43.1 55.0 0.393 0.007 G:Q6AZJ8:0.007
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.564
6.983
8.338
6.960
3.966
2.872
8.823
9.654
7.523
7.257
5.175
3.267
7.349
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
THR E:45 E:45 56.0 0.4 H -69.1 -48.9 55.0 0.393 0.007 C:Q6AZJ8:0.007
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.824
7.884
7.181
5.231
3.302
7.558
8.316
6.848
8.121
6.739
3.806
2.677
9.286
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
3utb 1 P84233 96.3 6e-92 X-RAY
2012-04-11 THR A:45 A:45 63.0 0.45 H -65.6 -46.6 63.0 0.45 0.0 DA
DA
DC
DG
DG
DA
DG
DA
DC
DA
DA
DA
DA
DG
HOH
8.294
6.779
8.013
9.944
7.646
3.526
2.789
9.817
9.813
8.700
8.110
5.255
3.310
7.661
5.032
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
OG1
O3'
OP1
OP1
N2
O3'
O3'
OP1
OP2
O2
C5'
OP1
O3'
OP1
OP1
O
THR E:45 E:45 57.0 0.407 H -66.5 -43.7 56.0 0.4 0.007 C:Q6AZJ8:0.007
DC
DA
DA
DG
DA
DA
DA
DC
DT
DG
DG
DA
DG
DA
HOH
9.395
8.110
8.512
5.241
3.417
7.496
8.590
6.891
7.797
9.635
7.248
3.620
2.917
9.736
6.294
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
CG2
OG1
OG1
N
O2
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
N2
O3'
O3'
OP1
OP2
O
4j8u 1 P84233 96.3 6e-92 X-RAY
2013-04-17 THR A:45 A:45 55.0 0.393 H -67.8 -50.4 55.0 0.393 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.202
6.707
8.182
7.260
3.996
2.743
9.360
9.810
7.742
7.331
5.046
3.234
7.216
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
THR E:45 E:45 60.0 0.429 H -70.2 -49.7 57.0 0.407 0.022 C:P06897:0.021
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
7.941
7.471
5.204
3.360
7.619
8.297
6.714
8.169
6.646
3.777
2.633
9.297
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
4j8v 1 P84233 96.3 6e-92 X-RAY
2013-05-08 THR A:45 A:45 57.0 0.407 H -66.9 -48.9 57.0 0.407 0.0 DT
DA
DT
DA
DA
DC
9.905
7.854
7.260
5.018
3.238
7.521
CG2
CG2
O
N
N
CB
O3'
C5'
OP1
O3'
OP1
OP1
THR E:45 E:45 59.0 0.421 H -70.0 -52.8 NA NA NA
4j8w 1 P84233 96.3 6e-92 X-RAY
2013-04-17 THR A:45 A:45 56.0 0.4 H -67.7 -50.5 56.0 0.4 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.156
6.671
8.143
7.218
4.084
2.751
9.325
9.897
7.875
7.304
5.003
3.225
7.368
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:45 E:45 59.0 0.421 H -72.2 -50.7 57.0 0.407 0.014 C:Q6AZJ8:0.014
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
7.879
7.493
5.106
3.303
7.658
8.310
6.698
8.218
6.669
3.842
2.623
9.416
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
4j8x 1 P84233 96.3 6e-92 X-RAY
2013-05-08 THR A:45 A:45 51.0 0.364 H -72.6 -49.9 51.0 0.364 0.0 DA
DG
DC
DT
DT
DG
DA
7.925
6.540
8.163
7.361
3.966
2.920
9.163
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR E:45 E:45 61.0 0.436 H -78.0 -44.5 NA NA NA
4r8p 1 P84233 96.3 6e-92 X-RAY
2014-11-05 THR A:45 A:45 59.0 0.421 H -68.6 -50.8 58.0 0.414 0.007 G:Q6AZJ8:0.007
DA
DC
DA
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
7.979
8.403
9.980
6.388
3.544
2.924
9.207
8.428
8.110
7.925
5.812
3.784
7.661
N
N
CG2
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
C2
O3'
O3'
OP1
OP1
O2
C5'
OP1
O3'
OP1
OP2
THR E:45 E:45 57.0 0.407 H -90.2 -62.3 52.0 0.371 0.036 C:Q6AZJ8:0.036
DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
9.354
8.514
8.376
5.355
3.413
7.984
9.153
7.544
8.214
6.616
4.050
2.901
9.185
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
C5'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
OP2
4wu8 3 P84233 96.3 6e-92 X-RAY
2015-09-02 THR C:45 A:45 55.0 0.393 H -78.0 -44.0 55.0 0.393 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.396
7.115
8.354
7.081
4.022
2.890
9.062
9.505
7.609
7.016
4.908
3.127
7.341
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
THR G:45 E:45 59.0 0.421 H -67.8 -45.5 58.0 0.414 0.007 E:P06897:0.007
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.636
7.662
7.300
5.152
3.265
7.382
8.415
6.886
8.223
6.786
3.734
2.926
9.439
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
4wu9 1 P84233 96.3 6e-92 X-RAY
2015-09-02 THR A:45 A:45 72.0 0.514 H -57.2 -43.8 71.0 0.507 0.007 G:P06897:0.007
DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DA
DC
8.027
7.371
8.320
6.762
3.546
2.878
8.881
8.214
7.879
5.177
3.256
7.390
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
OG1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 66.0 0.471 H -74.6 -38.2 60.0 0.429 0.042 C:P06897:0.043
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.803
7.892
7.389
5.203
3.223
7.794
8.238
6.651
8.187
6.854
3.778
3.153
9.406
CG2
O
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
4xuj 1 P84233 96.3 6e-92 X-RAY
2016-01-27 THR A:45 A:45 55.0 0.393 H -75.1 -46.2 54.0 0.386 0.007 G:Q6AZJ8:0.007
DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DA
DC
8.011
6.579
8.083
7.105
4.060
3.122
9.610
7.862
7.246
5.053
3.134
7.399
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
THR E:45 E:45 64.0 0.457 H -86.9 -39.5 54.0 0.386 0.071 C:Q6AZJ8:0.071
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
7.709
7.310
5.070
3.189
7.539
8.657
7.111
8.116
6.810
3.941
3.056
9.431
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5cp6 3 P84233 96.3 6e-92 X-RAY
2016-06-01 THR C:45 A:45 57.0 0.407 H -75.0 -37.7 57.0 0.407 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.271
7.007
8.301
7.019
3.961
2.985
9.100
9.601
7.772
7.094
4.935
3.073
7.601
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR G:45 E:45 57.0 0.407 H -79.2 -40.2 56.0 0.4 0.007 E:Q6AZJ8:0.007
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.637
7.646
7.243
5.088
3.138
7.502
8.296
6.880
8.407
6.949
3.868
3.149
9.378
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5dnm 1 P84233 96.3 6e-92 X-RAY
2016-09-14 THR A:45 A:45 52.0 0.371 H -78.1 -46.9 52.0 0.371 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.200
6.672
8.564
6.977
4.043
2.956
8.899
9.674
7.870
7.297
4.994
3.127
7.290
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR E:45 E:45 58.0 0.414 H -85.1 -43.2 56.0 0.4 0.014 C:Q6AZJ8:0.014
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.818
8.006
7.336
5.079
3.072
7.554
8.346
6.824
8.263
6.671
3.770
3.005
9.448
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5dnn 1 P84233 96.3 6e-92 X-RAY
2016-09-14 THR A:45 A:45 51.0 0.364 H -68.5 -52.7 51.0 0.364 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.316
6.605
8.506
7.004
4.083
2.649
8.744
9.625
7.772
7.283
5.110
3.198
7.226
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP1
THR E:45 E:45 57.0 0.407 H -82.8 -45.2 55.0 0.393 0.014 C:Q6AZJ8:0.014
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.775
7.932
7.165
5.096
3.110
7.542
8.288
6.715
8.280
6.646
3.820
2.866
9.311
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5hq2 1 P84233 96.3 6e-92 X-RAY
2016-03-23 THR A:45 A:45 62.0 NA H -49.7 -41.9 62.0 NA NA DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
7.837
7.997
7.446
4.416
3.821
8.993
8.388
5.762
3.696
7.933
N
N
CB
CB
CB
O
O
N
N
C
C5'
OP1
O3'
O3'
OP1
C5'
OP1
O3'
OP1
OP2
5nl0 1 P84233 96.3 6e-92 X-RAY
2017-05-17 THR A:45 A:45 52.0 0.371 H -75.0 -47.1 52.0 0.371 0.0 DT
DA
DC
DG
DT
DG
DA
DA
DA
DT
DG
DT
DG
9.648
7.952
7.793
6.645
4.218
2.712
9.721
9.494
7.807
7.320
4.890
3.033
7.595
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
C5'
OP1
O3'
C5'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP2
THR E:45 E:45 54.0 0.386 H -75.7 -42.0 54.0 0.386 0.0 DA
DA
DT
DG
DT
DG
DT
DA
DC
DG
DT
DG
DA
8.830
7.345
7.454
5.053
3.279
7.803
8.418
7.118
7.443
7.445
4.536
2.684
8.200
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
C4'
OP1
OP1
THR K:45 K:45 53.0 0.379 H -75.6 -40.0 NA NA NA
5oxv 5 P84233 96.3 6e-92 X-RAY
2017-10-11 THR E:45 O:45 56.0 0.4 H -93.5 -26.4 56.0 0.4 0.0 DG
DG
DG
DC
DT
DC
DC
DG
DA
DT
DC
DG
DC
9.223
7.311
7.888
6.769
3.899
3.082
9.635
9.647
8.313
7.736
4.786
2.851
7.422
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
N2
O3'
OP1
O3'
OP1
OP2
THR I:45 K:45 56.0 0.4 H -78.1 -38.9 56.0 0.4 0.0 DT
DG
DT
DG
DT
DG
DT
DA
DC
DT
DC
DC
9.954
8.387
8.409
4.897
3.034
7.438
8.980
7.699
7.838
7.254
3.857
3.238
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
O2
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
THR N:45 E:45 57.0 0.407 H -93.5 -26.5 56.0 0.4 0.007 M:P62799:0.007
DG
DG
DG
DC
DT
DC
DA
DT
DC
DG
DC
9.223
7.311
7.889
6.983
3.609
3.248
8.312
7.736
4.787
2.851
7.422
OG1
OG1
N
CG2
CG2
OG1
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
O3'
OP1
OP2
THR R:45 A:45 55.0 0.393 H -78.1 -38.9 55.0 0.393 0.0 DG
DT
DG
DT
DG
DT
DA
DC
DT
DC
DC
DT
8.387
8.411
4.897
3.033
7.436
8.981
7.701
7.839
7.480
4.065
2.800
9.599
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
5oy7 2 Q92133 96.3 6e-92 X-RAY
2017-09-20 THR B:45 M:45 57.0 0.407 H -93.5 -26.3 56.0 0.4 0.007 C:P62799:0.007
DA
DA
DC
DG
DC
DG
DG
DG
DT
DC
DC
DA
9.337
9.467
4.787
2.851
7.421
9.223
7.310
7.888
8.009
4.132
3.568
9.246
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR F:45 Q:45 56.0 0.4 H -78.0 -38.9 56.0 0.4 0.0 DT
DA
DC
DT
DC
DC
DT
DA
DT
DG
DT
DG
DT
DG
8.980
7.701
7.837
7.406
3.289
2.231
7.863
9.913
9.444
8.319
8.694
4.897
3.033
7.437
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
C2
O3'
C5'
OP1
O3'
OP1
OP1
THR H:45 I:45 57.0 0.407 H -78.0 -38.9 57.0 0.407 0.0 DT
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.980
7.701
7.838
7.474
4.588
3.061
9.633
9.597
8.412
9.049
4.896
3.033
7.434
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O2
C4'
OP1
O3'
OP1
OP1
THR J:45 A:45 58.0 0.414 H -78.2 -38.9 58.0 0.414 0.0 DT
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.981
7.701
7.839
8.249
4.023
2.830
8.043
9.986
8.472
7.831
4.896
3.033
7.436
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR N:45 E:45 55.0 0.393 H -93.4 -26.6 55.0 0.393 0.0 DA
DA
DC
DG
DC
DG
DG
DG
DT
DC
DC
DA
8.116
7.272
4.786
2.850
7.423
9.225
7.312
7.887
6.276
3.722
3.108
9.206
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
C5'
OP1
OP1
THR U:45 U:45 57.0 0.407 H -93.5 -26.5 56.0 0.4 0.007 V:P62799:0.007
DA
DA
DC
DG
DC
DG
DG
DG
DT
DC
DC
8.532
8.140
4.786
2.850
7.423
9.224
7.310
7.889
5.556
3.957
6.851
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
OP1
THR Y:45 Y:45 57.0 0.407 H -78.3 -38.8 57.0 0.407 0.0 DT
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.981
7.702
7.839
6.830
3.473
2.369
7.933
9.859
8.517
8.971
4.896
3.032
7.439
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O2
C5'
OP1
O3'
OP1
OP1
THR CA:45 c:45 56.0 0.4 H -93.5 -26.4 55.0 0.393 0.007 DA:P62799:0.007
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
8.505
8.133
4.786
2.851
7.422
9.222
7.309
7.888
6.482
4.200
3.321
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
C5'
OP1
5xf6 1 P84233 96.3 6e-92 X-RAY
2017-10-11 THR A:45 A:45 51.0 0.364 H -81.9 -43.7 51.0 0.364 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.144
6.856
8.444
7.055
4.075
3.030
8.947
9.692
7.859
7.270
4.951
3.203
7.256
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
OP1
OP2
THR E:45 E:45 58.0 0.414 H -78.9 -41.6 56.0 0.4 0.014 C:Q6AZJ8:0.014
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.766
7.885
7.198
5.198
3.261
7.542
8.318
6.869
8.245
6.618
3.712
2.883
9.440
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5z3l 1 P84233 96.3 6e-92 EM
2019-04-03 THR A:45 A:45 70.0 0.5 H -70.0 -44.3 62.0 0.443 0.057 G:Q6AZJ8:0.057
DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
9.690
8.631
8.601
5.456
3.531
7.567
9.671
8.893
9.850
6.748
4.137
3.126
9.596
CG2
CG2
O
N
N
CB
N
OG1
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
P
THR E:45 E:45 69.0 0.493 H -70.1 -44.2 56.0 0.4 0.093 C:Q6AZJ8:0.093
DA
DC
DT
DC
DC
DT
DG
DA
DT
DG
DG
DT
DG
8.741
8.514
7.354
3.501
2.422
8.619
9.632
9.888
9.608
9.992
7.191
5.411
8.896
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
N2
N3
OP1
OP1
O3'
OP1
OP2
5z3o 1 P84233 96.3 6e-92 EM
2019-04-03 THR A:45 A:45 69.0 0.493 H -77.2 -42.4 65.0 0.464 0.029 G:Q6AZJ8:0.029
DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
9.355
9.844
8.390
8.139
6.165
3.835
7.133
9.969
9.259
9.106
6.920
4.399
3.063
CG2
CG2
CG2
O
N
N
C
N
N
N
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
THR E:45 E:45 70.0 0.5 H -77.1 -42.4 63.0 0.45 0.05 C:Q6AZJ8:0.05
DA
DC
DT
DC
DC
DT
DA
DT
DG
DG
DT
DG
8.911
8.895
7.272
4.569
2.778
9.288
8.314
8.993
9.042
6.587
4.611
8.160
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
O3'
O3'
OP1
OP2
C2
O4'
OP1
O3'
OP1
OP2
5z3u 2 P84233 96.3 6e-92 EM
2019-05-22 THR B:45 A:45 66.0 0.471 H -79.4 -41.7 66.0 0.471 0.0 DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.776
8.374
7.865
6.050
3.842
7.981
9.145
8.951
6.808
4.163
2.935
8.866
CG2
O
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
O3'
C4'
OP2
OP2
THR F:45 E:45 67.0 0.479 H -79.4 -41.7 65.0 0.464 0.015 D:Q6AZJ8:0.014
DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
9.035
8.369
7.486
3.799
2.670
8.326
8.828
8.816
5.936
3.889
7.852
N
N
CG2
OG1
OG1
OG1
O
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
5z3v 2 P84233 96.3 6e-92 EM
2019-05-22 THR B:45 A:45 65.0 0.464 H -77.9 -45.8 58.0 0.414 0.05 H:Q6AZJ8:0.05
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.930
8.463
8.591
5.783
3.564
7.576
8.658
8.615
6.704
4.258
3.145
9.771
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP2
THR F:45 E:45 68.0 0.486 H -77.8 -45.9 64.0 0.457 0.029 D:Q6AZJ8:0.029
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.861
8.905
6.934
4.306
2.928
9.379
9.820
8.569
8.262
5.651
3.651
7.897
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
O3'
C4'
OP1
OP2
O2
C4'
OP1
O3'
OP1
OP1
6esf 1 P84233 96.3 6e-92 EM
2017-12-20 THR A:45 A:45 59.0 0.421 H -76.8 -44.9 59.0 0.421 0.0 DG
DG
DC
DT
DC
DC
DG
DA
DA
DT
DC
DG
DC
9.429
8.840
7.289
4.115
2.320
8.325
9.375
9.104
7.631
7.527
6.513
4.313
7.418
N
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
N2
O3'
C4'
OP1
O3'
OP1
OP2
THR E:45 E:45 57.0 0.407 H -73.0 -46.5 57.0 0.407 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DT
9.543
7.880
7.849
6.044
4.010
7.416
9.357
8.543
7.557
4.220
2.344
7.791
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
OG1
C4'
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
6esg 1 P84233 96.3 6e-92 EM
2017-12-20 THR A:45 A:45 71.0 0.507 H -77.2 -32.4 71.0 0.507 0.0 DG
DG
DG
DC
DT
DC
DC
DA
DC
DG
DC
9.906
9.477
9.190
8.072
5.420
3.492
7.678
9.969
5.348
3.578
8.795
N
N
N
CG2
CG2
CG2
OG1
O
N
N
C
N2
C5'
OP2
O3'
O3'
OP2
OP2
O5'
O3'
OP1
OP2
THR E:45 E:45 99.0 0.707 H -69.0 -45.4 99.0 0.707 0.0 DT
DG
DT
DG
DT
DG
DA
9.321
8.587
9.347
7.233
5.140
9.192
9.604
CB
C
O
N
N
N
N
OP2
OP1
OP1
O3'
OP1
OP1
C5'
6esh 1 P84233 96.3 6e-92 EM
2017-12-20 THR A:45 A:45 66.0 0.471 H -64.8 -55.5 62.0 0.443 0.028 G:Q6AZJ8:0.029
DG
DC
DT
DC
DC
DG
DA
DA
DT
DC
DG
DC
9.408
7.214
3.924
2.381
8.219
9.226
8.909
7.392
7.584
6.034
3.822
7.608
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
C
OP1
O3'
O3'
OP1
OP2
N2
O3'
C4'
OP1
O3'
OP1
OP2
THR E:45 E:45 78.0 0.557 H -67.3 -48.2 78.0 0.557 0.0 DG
DT
DG
DA
DC
7.978
6.258
7.325
8.002
9.013
N
N
C
N
N
O3'
OP1
OP1
OP1
OP1
6esi 1 P84233 96.3 6e-92 EM
2017-12-20 THR A:45 A:45 42.0 0.3 H -67.0 -27.5 42.0 0.3 0.0 DG
DG
DG
DC
DT
DC
DC
DG
DA
DA
DT
DC
DG
DC
9.363
7.762
9.985
8.533
5.004
2.990
6.928
9.489
9.550
8.184
8.528
9.111
7.166
6.608
N
N
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
C
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
N2
O3'
C4'
OP1
O3'
C5'
OP1
THR E:45 NA:NA DO NA DO DO DO NA NA NA
6iro 2 A0A310TTQ1 96.3 6e-92 EM
2019-04-03 THR B:45 A:45 60.0 0.429 H -73.3 -44.6 58.0 0.414 0.015 H:Q6AZJ8:0.014
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.439
9.842
8.129
8.248
5.922
3.700
7.766
8.757
9.126
6.643
4.178
2.563
9.684
CG2
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
P
THR F:45 E:45 64.0 0.457 H -93.9 -47.9 64.0 0.457 0.0 DA
DC
DT
DC
DC
DG
DG
DA
DT
DG
DG
DT
DG
9.305
8.674
7.979
4.000
3.084
9.269
9.255
9.625
8.306
7.581
5.984
4.182
8.086
N
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
N2
O3'
O3'
OP1
O3'
OP1
OP2
6jyl 1 A0A310TTQ1 96.3 6e-92 EM
2019-05-29 THR A:45 A:45 67.0 0.479 H -75.9 -45.1 67.0 0.479 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.604
9.884
8.449
8.529
6.099
4.103
8.021
8.676
8.879
6.614
4.097
2.935
9.239
CG2
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP2
THR E:45 E:45 60.0 0.429 S -105.2 -51.4 60.0 0.429 0.0 DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.983
8.559
7.137
4.281
2.847
9.046
8.646
8.408
5.495
3.676
7.832
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
CB
OP1
OP1
O3'
C4'
OP1
OP1
C5'
OP1
O3'
OP1
OP1
6k1p 1 A0A310TTQ1 96.3 6e-92 EM
2019-05-29 THR A:45 A:45 62.0 0.443 S -133.2 -39.8 61.0 0.436 0.007 G:Q6AZJ8:0.007
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
8.405
8.383
6.507
4.491
8.209
9.128
9.125
6.607
4.335
3.222
9.123
CG2
O
N
N
CB
N
N
CG2
OG1
OG1
OG1
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP2
THR E:45 E:45 55.0 0.393 S -117.5 -48.1 55.0 0.393 0.0 DA
DC
DT
DC
DC
DG
DT
DG
DG
DT
DG
9.081
9.302
7.505
4.006
3.095
9.333
9.892
8.617
5.662
3.603
7.967
N
N
CG2
OG1
OG1
OG1
CG2
CG2
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C4'
O3'
OP1
OP1
6kiu 1 A0A310TTQ1 96.3 6e-92 EM
2019-09-11 THR A:45 A:45 51.0 0.364 H -71.9 -47.2 51.0 0.364 0.0 DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
9.110
9.248
6.912
4.519
3.041
9.936
9.783
8.262
8.400
6.787
4.772
8.025
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
O3'
C5'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
THR E:45 E:45 51.0 0.364 H -71.9 -47.2 51.0 0.364 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.532
9.749
8.624
7.720
6.060
3.860
8.165
9.137
9.462
6.829
4.542
2.967
9.537
CG2
CG2
O
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
OP1
6kiv 1 A0A310TTQ1 96.3 6e-92 EM
2019-09-11 THR A:45 A:45 48.0 0.343 H -64.9 -44.4 48.0 0.343 0.0 DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
9.351
7.710
4.232
3.119
9.363
9.959
9.439
8.721
6.324
3.955
8.043
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP2
OP2
THR E:45 E:45 49.0 0.35 H -64.9 -44.4 49.0 0.35 0.0 DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
9.445
9.305
8.607
7.135
5.020
8.325
9.833
9.466
7.317
4.385
3.371
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
6kiw 1 A0A310TTQ1 96.3 6e-92 EM
2019-09-11 THR A:45 A:45 64.0 0.457 H -66.9 -44.7 64.0 0.457 0.0 DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
9.519
9.420
7.098
4.127
2.755
9.549
9.762
8.293
7.919
7.175
5.043
8.001
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
OP1
THR E:45 E:45 64.0 0.457 H -66.9 -44.7 64.0 0.457 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.863
9.936
8.908
7.926
6.606
4.201
8.223
9.302
9.138
7.313
4.274
3.639
9.498
CG2
CG2
O
O
N
N
C
N
N
CG2
OG1
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
6kix 1 A0A310TTQ1 96.3 6e-92 EM
2019-09-11 THR A:45 A:45 65.0 0.464 H -70.8 -40.5 65.0 0.464 0.0 DA
DT
DC
DC
DG
DT
DG
DT
DG
9.319
6.601
4.662
3.163
9.724
9.253
6.958
4.926
8.126
N
CG2
OG1
OG1
O
O
N
N
C
C5'
O3'
O3'
OP1
O3'
OP1
O3'
OP1
OP2
THR E:45 E:45 66.0 0.471 H -70.8 -40.5 66.0 0.471 0.0 DG
DA
DT
DC
DG
DC
DG
DC
DT
DC
DG
9.822
8.758
7.530
6.897
4.447
8.205
9.363
6.491
4.640
3.376
9.859
CG2
O
O
N
N
C
N
CG2
OG1
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
C5'
O3'
O3'
OP1
OP2
6kiz 1 A0A310TTQ1 96.3 6e-92 EM
2019-09-11 THR A:45 A:45 60.0 0.429 H -67.5 -44.3 60.0 0.429 0.0 DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
9.316
9.744
7.534
5.142
3.395
9.995
8.956
8.363
6.660
4.603
8.132
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP2
OP2
THR E:45 E:45 60.0 0.429 H -67.6 -44.2 60.0 0.429 0.0 DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
8.952
7.547
6.608
4.169
8.400
9.500
9.296
6.954
4.907
3.565
9.738
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
OP1
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP1
6nn6 1 P84233 96.3 6e-92 EM
2019-02-13 THR A:45 A:45 78.0 0.557 H -74.7 -24.4 76.0 0.543 0.014 G:P06897:0.014
DA
DC
DT
DC
DG
DA
DG
DT
DG
DT
DG
8.734
9.000
7.016
3.722
3.333
9.928
8.682
8.279
5.905
3.714
8.046
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
C5'
OP1
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
THR E:45 E:45 60.0 0.429 T -91.2 -33.3 60.0 0.429 0.0 DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.609
9.239
8.745
5.204
3.353
8.055
8.621
9.396
6.511
3.708
3.232
9.347
CG2
O
O
N
N
CB
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
6nog 1 P84233 96.3 6e-92 EM
2019-02-20 THR A:45 A:45 69.0 0.493 H -75.9 -37.4 56.0 0.4 0.093 F:P06897:0.086
C:P62799:0.007
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
8.975
8.267
5.915
3.993
7.797
8.643
8.558
7.264
5.222
3.832
9.725
O
O
N
N
OG1
CG2
N
CB
CB
OG1
OG1
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
OP1
THR B:45 E:45 71.0 0.507 H -81.3 -22.7 60.0 0.429 0.078 E:P06897:0.079
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
8.744
8.669
6.489
4.657
3.830
9.079
8.420
5.992
3.963
7.683
N
N
OG1
CG2
CG2
O
O
N
N
CG2
C4'
OP1
O3'
O3'
OP1
O3'
OP1
O3'
OP1
OP1
6o96 1 P84233 96.3 6e-92 EM
2019-04-24 THR A:45 A:45 59.0 0.421 H -106.5 -20.1 55.0 0.393 0.028 G:Q6AZJ8:0.029
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
8.541
7.733
5.792
3.835
7.338
9.861
8.256
7.924
6.478
3.795
3.325
9.065
O
O
N
N
CG2
N
N
N
OG1
CG2
CG2
CG2
O3'
OP1
O3'
OP1
OP1
O3'
C5'
OP1
O3'
O3'
OP1
OP1
THR E:45 E:45 51.0 0.364 S -115.6 -19.2 51.0 0.364 0.0 DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.498
8.682
6.691
4.216
3.283
8.619
8.138
7.750
5.525
3.459
6.489
N
N
OG1
CG2
CG2
CG2
O
O
N
N
CG2
C5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
6om3 1 P84233 96.3 6e-92 X-RAY
2019-07-10 THR A:45 A:45 59.0 0.421 H -66.9 -52.6 56.0 0.4 0.021 G:Q6AZJ8:0.021
DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
8.904
9.153
8.367
8.699
5.579
3.670
7.531
9.244
7.945
8.040
6.936
3.770
2.509
9.255
CG2
CG2
CG2
O
N
N
C
N
OG1
N
CG2
OG1
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR E:45 E:45 57.0 0.407 H -69.6 -49.4 52.0 0.371 0.036 C:Q6AZJ8:0.036
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.429
8.328
6.691
4.079
2.953
9.614
8.960
8.082
7.791
5.260
3.426
6.588
N
N
CG2
OG1
OG1
OG1
CG2
O
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP1
O2
O3'
OP1
O3'
OP1
OP1
THR M:45 M:45 57.0 0.407 H -62.6 -49.4 NA NA NA
THR Q:45 Q:45 53.0 0.379 H -62.8 -51.5 NA NA NA
6pa7 1 P84233 96.3 6e-92 EM
2020-06-17 THR A:45 A:45 66.0 0.471 H -78.3 -41.3 58.0 0.414 0.057 G:P06897:0.057
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
8.468
9.439
8.079
7.878
6.936
5.310
8.194
8.547
8.442
5.993
3.651
2.909
9.079
CG2
CG2
CG2
O
N
C
C
N
N
CG2
CG2
OG1
OG1
N2
N3
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP1
THR E:45 E:45 65.0 0.464 H -78.4 -42.1 55.0 0.393 0.071 C:P06897:0.071
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.634
8.539
6.476
3.758
2.345
8.191
9.310
7.973
7.820
7.111
5.373
8.492
N
N
CG2
OG1
OG1
OG1
CG2
O
O
N
C
C
C5'
OP1
O3'
O3'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP2
6r1u 1 P84233 96.3 6e-92 EM
2019-04-24 THR A:45 A:45 56.0 0.4 H -76.9 -44.8 56.0 0.4 0.0 DG
DG
DC
DT
DC
DG
DG
DA
DA
DT
DC
DG
DC
9.429
8.840
7.289
4.115
2.321
8.325
9.374
9.105
7.630
7.526
6.512
4.313
7.418
N
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
N2
O3'
C4'
OP1
O3'
OP1
OP2
THR E:45 E:45 57.0 0.407 H -73.0 -46.5 57.0 0.407 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DG
9.543
7.880
7.849
6.043
4.010
7.416
9.359
8.543
7.557
4.220
2.344
7.791
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
OG1
C4'
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
6r25 4 A0A310TTQ1 96.3 6e-92 EM
2019-04-24 THR D:45 A:45 55.0 0.393 H -76.9 -44.8 55.0 0.393 0.0 DG
DG
DC
DT
DC
DG
DG
DA
DA
DT
DC
DG
DC
9.430
8.840
7.289
4.114
2.321
8.326
9.374
9.104
7.631
7.526
6.513
4.314
7.418
N
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
N2
O3'
C4'
OP1
O3'
OP1
OP2
THR H:45 E:45 57.0 0.407 H -73.0 -46.5 57.0 0.407 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DG
9.544
7.881
7.849
6.044
4.010
7.415
9.358
8.543
7.557
4.221
2.345
7.790
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
OG1
C4'
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
6t9l 1 P84233 96.3 6e-92 EM
2020-01-29 THR A:45 A:45 68.0 0.486 H -73.7 -48.8 68.0 0.486 0.0 DA
DT
DC
DG
DA
DT
DG
DT
DG
DT
DG
9.713
6.918
4.426
3.056
9.818
9.804
8.617
8.310
5.896
3.795
8.056
OG1
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
OP1
O3'
C5'
OP1
OP2
O2
C4'
OP1
O3'
OP1
OP1
THR E:45 E:45 70.0 0.5 H -75.7 -46.0 70.0 0.5 0.0 DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.324
8.215
8.265
6.467
4.371
8.460
9.574
8.955
6.128
4.130
2.878
9.919
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O5'
OP1
OP2
6tda 1 P84233 96.3 6e-92 EM
2020-03-18 THR A:45 A:45 51.0 0.364 H -81.9 -42.3 51.0 0.364 0.0 DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DG
9.253
8.444
7.565
6.421
4.458
7.501
9.800
8.684
8.692
5.545
3.605
4.172
OG1
O
O
N
N
CG2
N
N
N
OG1
OG1
CG2
N2
O3'
OP1
O3'
OP1
OP1
O3'
O3'
OP1
O3'
C5'
OP2
THR E:45 E:45 63.0 0.45 H -86.5 -42.1 63.0 0.45 0.0 DA
DC
DG
DT
DG
8.737
8.793
6.265
4.140
7.156
N
N
N
N
CG2
C5'
OP1
O3'
OP1
OP1
6uxw 1 P84233 96.3 6e-92 EM
2020-03-18 THR A:45 R:45 67.0 0.479 H -77.9 -45.8 61.0 0.436 0.043 G:P06897:0.043
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.930
8.463
8.590
5.784
3.564
7.575
8.659
8.615
6.705
4.258
3.145
9.773
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP2
THR E:45 V:45 67.0 0.479 H -77.8 -45.9 64.0 0.457 0.022 C:P06897:0.021
DA
DC
DT
DC
DG
DA
DT
DG
DT
DG
DT
DG
8.861
8.905
6.934
4.307
2.928
9.378
9.820
8.568
8.263
5.651
3.650
7.895
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
O3'
C4'
OP1
OP2
O2
C4'
OP1
O3'
OP1
OP1
6wz5 1 P84233 96.3 6e-92 EM
2020-09-16 THR A:45 A:45 58.0 0.414 H -61.4 -47.2 56.0 0.4 0.014 G:Q6AZJ8:0.014
DG
DG
DC
DT
DC
DC
DG
DA
DA
DT
DC
DG
DC
8.097
8.161
6.467
3.945
2.450
8.650
8.982
9.369
7.892
7.746
5.620
3.553
7.538
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
CG2
O
N
N
C
OP1
OP1
O3'
O3'
OP1
OP1
N2
O3'
C4'
OP1
O3'
OP1
OP2
THR E:45 E:45 58.0 0.414 H -66.2 -51.6 58.0 0.414 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DT
9.381
7.985
7.881
5.463
3.596
7.431
8.550
8.152
6.705
3.860
2.499
8.819
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP1
6wz9 1 P84233 96.3 6e-92 EM
2020-09-16 THR A:45 A:45 61.0 0.436 H -61.9 -46.0 61.0 0.436 0.0 DG
DG
DC
DT
DC
DC
DG
DA
DA
DT
DC
DG
DC
8.142
8.108
6.437
4.062
2.674
8.903
9.137
9.799
8.151
8.064
5.279
3.234
7.376
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
CG2
O
N
N
C
OP1
OP1
O3'
C5'
OP1
OP1
N2
O3'
C4'
OP1
O3'
OP1
OP2
THR E:45 E:45 61.0 0.436 H -66.4 -50.8 58.0 0.414 0.022 C:Q6AZJ8:0.021
DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DT
9.657
8.251
8.127
5.146
3.398
7.545
8.274
7.884
6.377
3.758
2.510
9.148
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C4'
OP1
OP2
6x0n 1 P84233 96.3 6e-92 EM
2020-09-16 THR A:45 A:45 59.0 0.421 H -61.7 -46.3 50.0 0.357 0.064 G:Q6AZJ8:0.064
DG
DG
DG
DC
DT
DC
DC
DG
DA
DA
DT
DC
DC
DG
DC
9.466
7.446
7.920
5.683
3.322
2.356
8.506
8.003
9.117
8.182
7.909
9.788
4.548
2.602
7.390
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
CG2
O
N
N
N
C
C4'
OP1
OP1
O3'
C5'
OP1
OP2
N2
N3
C4'
OP1
O3'
O3'
OP1
OP2
THR E:45 E:45 57.0 0.407 H -66.3 -51.3 51.0 0.364 0.043 C:Q6AZJ8:0.043
DA
DT
DG
DT
DC
DG
DT
DG
DT
DA
DC
DT
DC
DC
DT
9.698
9.016
7.875
7.892
9.407
4.171
2.502
7.291
9.742
7.728
7.574
5.820
3.368
2.401
8.506
CG2
CG2
CG2
O
N
N
N
CB
OG1
N
N
CG2
CG2
OG1
OG1
C2
O2
C4'
OP1
O3'
O3'
OP1
OP2
C4'
C5'
OP1
O3'
C4'
OP1
OP2
THR K:45 a:45 54.0 0.386 H -62.2 -47.7 54.0 0.386 0.0 DG
DG
DG
DC
DT
DC
DC
DG
DA
DA
DT
DC
DC
DG
DC
9.440
7.319
8.230
5.524
3.326
2.603
9.110
8.510
9.495
7.794
7.477
9.758
4.274
2.649
7.009
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
CG2
O
N
N
N
C
C4'
OP1
OP1
O3'
C5'
OP1
OP1
N2
N3
C4'
OP1
O3'
O3'
OP1
OP2
THR O:45 e:45 57.0 0.407 H -67.1 -51.2 49.0 0.35 0.057 M:Q6AZJ8:0.057
DG
DA
DT
DG
DT
DC
DG
DT
DG
DT
DA
DC
DT
DC
DC
DT
9.901
9.574
9.187
8.371
8.353
9.609
4.209
2.535
7.130
9.483
7.356
7.147
5.729
3.275
2.427
8.681
CG2
CG2
CG2
CG2
O
N
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
C2
O2
C4'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
OP1
O3'
C4'
OP1
OP2
7at8 3 P84233 96.3 6e-92 EM
2020-12-09 THR C:45 D:45 66.0 0.471 H -73.3 -48.0 66.0 0.471 0.0 DA
DC
DC
DA
DT
DC
DG
DT
DA
DT
DG
DT
DG
9.265
9.644
7.346
3.885
3.677
9.858
9.999
9.689
7.979
8.437
5.374
3.412
8.076
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
CB
OP1
OP1
O3'
O3'
OP1
OP2
N2
O3'
C4'
OP1
O3'
OP1
OP1
THR G:45 H:45 65.0 0.464 H -73.9 -48.5 65.0 0.464 0.0 DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
8.331
8.172
6.589
4.494
8.617
9.275
9.250
6.645
4.486
3.194
CG2
O
N
N
C
N
N
CG2
CG2
OG1
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O5'
OP1
7e8i 3 A0A310TTQ1 96.3 6e-92 EM
2021-06-30 THR C:45 A:45 66.0 0.471 H -69.0 -48.8 66.0 0.471 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DG
9.676
7.917
7.821
5.448
3.596
7.696
8.682
9.061
7.173
3.920
2.716
8.982
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
C4'
OP1
O3'
O3'
OP1
OP2
THR G:45 E:45 50.0 0.357 H -90.3 -27.6 50.0 0.357 0.0 DG
DG
DC
DT
DC
DG
DA
DT
DC
DG
DC
7.977
8.376
5.521
3.396
2.964
9.793
8.598
8.709
6.262
4.273
7.301
N
N
OG1
OG1
CG2
CG2
O
O
N
N
CG2
C5'
OP1
O3'
OP1
OP1
OP2
C4'
OP1
O3'
OP1
OP1
7oh9 1 P84233 96.3 6e-92 EM
2021-07-28 THR A:45 A:45 49.0 0.35 H -75.0 -50.1 45.0 0.321 0.029 G:Q6AZJ8:0.029
DA
DC
DT
DC
DG
DA
DT
DG
DG
DT
DG
8.636
8.219
9.572
4.399
3.235
8.495
8.726
8.499
5.726
3.612
6.370
N
N
CG2
CG2
CG2
OG1
O
O
N
N
OG1
C5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 58.0 0.414 H -72.2 -47.0 54.0 0.386 0.028 C:Q6AZJ8:0.029
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.066
9.477
8.114
8.477
5.582
3.626
7.657
8.119
8.318
6.623
4.228
2.593
9.461
CG2
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
O3'
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C4'
OP1
OP2
7oha 1 P84233 96.3 6e-92 EM
2021-07-28 THR A:45 A:45 60.0 0.429 H -68.6 -42.3 55.0 0.393 0.036 G:Q6AZJ8:0.036
DA
DC
DG
DT
DG
8.384
8.567
5.800
3.788
6.625
N
N
N
N
OG1
C5'
OP1
O3'
OP1
OP1
THR E:45 E:45 57.0 0.407 H -68.0 -43.6 54.0 0.386 0.021 C:Q6AZJ8:0.021
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.209
9.752
8.291
8.564
5.699
3.812
7.893
8.317
8.070
6.361
3.968
2.516
9.124
CG2
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
O3'
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP1
7ohb 1 P84233 96.3 6e-92 EM
2021-07-28 THR A:45 A:45 65.0 0.464 H -79.1 -46.4 63.0 0.45 0.014 G:Q6AZJ8:0.014
DA
DC
DT
DC
DG
DA
DT
DG
DG
DT
DG
8.811
8.670
6.564
4.041
3.669
7.940
9.903
8.924
5.873
3.792
6.863
N
N
OG1
OG1
CB
CG2
OG1
O
N
N
CG2
C5'
OP1
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 59.0 0.421 H -78.2 -51.6 51.0 0.364 0.057 C:Q6AZJ8:0.057
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
8.741
8.324
6.122
3.854
7.148
8.312
8.169
7.510
4.497
2.952
9.467
O
O
N
N
OG1
CG2
N
CB
OG1
OG1
CG2
C4'
OP1
O3'
OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
7ohc 1 P84233 96.3 6e-92 EM
2021-07-28 THR A:45 A:45 51.0 0.364 H -86.8 -33.3 47.0 0.336 0.028 G:Q6AZJ8:0.029
DA
DC
DT
DC
DG
DA
DG
DT
DG
DT
DG
8.760
8.402
6.500
4.060
3.202
8.846
8.310
7.773
5.483
3.458
7.197
N
N
OG1
OG1
CG2
CG2
O
O
N
N
CG2
C5'
OP1
O3'
C5'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 58.0 0.414 H -79.9 -50.6 55.0 0.393 0.021 C:Q6AZJ8:0.021
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
DA
9.118
9.622
8.170
8.370
5.594
3.630
7.220
8.274
8.020
6.431
3.925
2.778
9.190
CG2
CG2
CG2
O
N
N
CG2
N
N
CG2
CG2
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
OP1
3x1s 1 P68431 96.3 7e-92 X-RAY
2015-09-23 THR A:45 A:45 60.0 0.429 H -87.0 -47.2 56.0 0.4 0.029 G:P04908:0.029
DA
DG
DC
DA
DT
DT
DG
DT
DC
DA
DA
DC
8.702
7.494
8.384
6.200
4.406
2.892
9.226
8.277
7.771
5.264
3.330
7.851
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
C4'
OP1
O3'
OP1
OP2
THR E:45 E:45 52.0 0.371 H -68.6 -53.1 48.0 0.343 0.028 C:P04908:0.029
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.742
7.801
7.767
5.406
3.496
7.797
8.753
7.099
8.001
6.698
4.355
2.902
9.385
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3x1t 2 P68431 96.3 7e-92 X-RAY
2015-09-23 THR C:45 A:45 55.0 0.393 H -65.6 -58.2 54.0 0.386 0.007 I:Q8CGP4:0.007
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.615
7.011
8.286
6.904
4.155
2.791
9.229
9.511
7.698
6.707
5.297
3.360
7.075
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR G:45 E:45 59.0 0.421 H -69.5 -48.9 56.0 0.4 0.021 E:Q8CGP4:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.588
7.758
7.327
5.236
3.426
7.587
9.185
7.319
8.078
6.723
4.002
2.490
9.382
5.818
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
3x1u 2 P68431 96.3 7e-92 X-RAY
2015-09-23 THR C:45 A:45 67.0 0.479 H -80.0 -34.0 65.0 0.464 0.015 I:Q8CGP4:0.014
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
9.357
7.837
8.432
6.611
4.391
3.342
9.174
9.805
8.534
8.123
5.142
3.341
6.292
N
N
N
OG1
OG1
CG2
CG2
CG2
O
O
N
N
CG2
O3'
C5'
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR G:45 E:45 59.0 0.421 H -77.8 -41.2 52.0 0.371 0.05 E:Q8CGP4:0.05
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.872
8.262
8.150
5.108
3.330
7.282
9.129
7.427
8.185
7.217
4.302
3.023
9.650
CG2
CG2
O
N
N
CG2
N
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3x1v 2 P68431 96.3 7e-92 X-RAY
2015-09-23 THR C:45 A:45 60.0 0.429 H -77.1 -36.8 60.0 0.429 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.754
6.825
8.253
6.255
3.842
2.676
8.812
9.698
8.180
7.982
5.387
3.464
7.164
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O4'
O3'
OP1
O3'
OP1
OP1
THR G:45 E:45 57.0 0.407 H -75.7 -39.5 48.0 0.343 0.064 E:P04908:0.064
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.341
7.968
7.635
5.292
3.322
7.725
8.741
7.226
8.593
6.628
4.088
2.869
9.384
6.970
CG2
O
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5gsu 1 P68431 96.3 7e-92 X-RAY
2017-02-15 THR A:45 A:45 54.0 0.386 H -84.2 -50.1 52.0 0.371 0.015 F:Q96QV6:0.014
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.532
6.785
8.217
7.149
4.265
3.006
9.665
9.710
7.941
7.265
4.886
3.149
7.026
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
THR B:45 E:45 57.0 0.407 H -83.0 -44.1 50.0 0.357 0.05 E:Q96QV6:0.05
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.776
7.833
7.816
5.057
3.325
7.540
9.074
7.308
8.302
6.976
4.103
2.722
9.321
CG2
CG2
O
N
N
CG2
N
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
5gt0 1 P68431 96.3 7e-92 X-RAY
2017-02-15 THR A:45 A:45 63.0 0.45 H -82.9 -34.9 55.0 0.393 0.057 F:Q96QV6:0.057
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
9.252
7.433
8.448
6.640
3.946
3.318
9.574
9.403
8.258
7.988
4.905
3.078
7.604
N
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR B:45 E:45 53.0 0.379 H -80.2 -36.8 44.0 0.314 0.065 E:Q96QV6:0.064
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.729
7.999
7.895
5.073
3.381
7.694
9.139
7.452
8.190
7.009
4.142
3.211
9.842
CG2
CG2
O
N
N
C
N
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
5gt3 1 P68431 96.3 7e-92 X-RAY
2017-02-15 THR A:45 A:45 57.0 0.407 H -79.1 -47.2 53.0 0.379 0.028 G:P20671:0.029
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
9.187
7.134
8.276
7.229
4.269
2.861
9.690
9.356
7.771
7.175
5.111
3.216
6.819
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:45 E:45 56.0 0.4 H -79.5 -44.3 50.0 0.357 0.043 C:P20671:0.043
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.751
7.864
7.616
5.070
3.368
7.455
8.958
7.108
8.203
7.052
4.097
2.767
9.224
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
7bwd 5 P68431 96.3 7e-92 EM
2021-04-14 THR E:45 E:45 66.0 0.471 T -98.8 19.1 49.0 0.35 0.121 H:P04908:0.114
B:P62805:0.007
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.732
7.843
7.818
4.239
3.258
9.388
9.468
8.232
8.864
6.439
4.144
7.614
N
N
CB
OG1
OG1
OG1
O
O
O
N
N
O
O3'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
OP1
O3'
OP1
OP2
THR F:45 A:45 64.0 0.457 S -128.5 -19.4 64.0 0.457 0.0 DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
8.683
9.168
5.506
3.296
7.255
9.017
9.006
6.811
4.606
3.988
O
O
N
N
C
OG1
N
CG2
CG2
OG1
C4'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
C5'
OP2
6zhx 1 A0A310TTQ1 95.59 1e-91 EM
2020-12-23 THR A:46 A:45 55.0 0.393 H -70.8 -42.5 55.0 0.393 0.0 DG
DT
DA
DC
DT
DC
DG
DA
DG
DA
DT
DG
DT
DG
DT
DG
9.638
8.430
6.468
7.451
6.854
2.782
1.821
7.531
9.064
9.036
8.150
6.674
8.714
4.335
2.740
6.690
H
H
H
H
HG22
HG22
HG1
HG1
HG21
HG21
HG21
HG23
HG23
H
H
HB
H22
H4'
H5''
OP1
O3'
H5''
OP1
OP1
H21
H2
H4'
H4'
H5'
O3'
OP1
OP1
THR E:46 E:45 45.0 0.321 H -71.0 -43.0 43.0 0.307 0.014 C:P06897:0.014
DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DG
DC
DT
DG
DA
7.456
8.969
6.475
8.575
4.553
2.807
6.549
9.954
8.372
6.997
7.542
5.912
2.363
1.717
7.705
HG21
HG21
HG23
O
H
H
HB
H
H
H
H
HG22
HG22
HG1
HG1
H22
H4'
H4'
H5'
O3'
OP1
OP2
H21
H4'
H5''
OP1
O3'
H5''
OP1
OP1
6zhy 1 A0A310TTQ1 95.59 1e-91 EM
2020-12-23 THR A:46 A:45 45.0 0.321 T -132.8 -40.2 45.0 0.321 0.0 DG
DT
DA
DC
DC
DG
DT
DG
9.466
9.050
6.627
7.618
8.966
3.767
1.919
8.026
H
OG1
OG1
N
H
H
H
HB
H22
H4'
H5''
OP1
H2''
O3'
OP1
P
THR E:46 E:45 44.0 0.314 H -73.1 -37.6 44.0 0.314 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DG
DG
DC
DT
DG
DA
7.736
8.570
6.542
8.575
4.345
2.584
6.513
9.801
9.766
8.167
6.908
7.472
6.139
2.535
1.691
7.360
HG21
HG21
HG23
O
H
H
HB
H
H
HG1
H
H
HG22
HG22
HG1
HG1
H22
H4'
H4'
H5'
O3'
OP1
OP2
H21
H22
O3'
H5''
OP1
O3'
H5''
OP1
OP1
7otq 2 P84233 95.59 1e-91 EM
2021-09-15 THR B:46 A:45 40.0 0.286 H -59.5 -49.7 40.0 0.286 0.0 DT
DA
DC
DT
DC
DG
DA
DG
DA
DT
DG
DT
DG
DT
DG
8.513
7.725
8.663
8.284
3.162
2.608
6.614
9.534
9.734
9.067
7.305
8.776
4.293
2.962
6.822
HG1
HG1
H
HG23
HG23
HG21
OG1
HG23
HG23
HG23
HG22
O
H
H
HB
O3'
OP1
OP1
H2''
O3'
OP1
OP1
H21
H2
H4'
H4'
H5'
O3'
OP1
OP1
THR F:46 E:45 50.0 0.357 H -76.6 -52.1 50.0 0.357 0.0 DG
DA
DA
DT
DC
DC
DG
DC
DG
DG
DG
DC
DT
DG
DA
9.710
9.147
7.881
7.741
9.852
4.422
2.753
6.034
9.003
6.842
9.356
6.941
3.399
2.612
8.461
HG1
HG21
HG23
HG23
H
H
H
HG22
H
H
N
HG1
HG1
HG1
HG21
H22
H4'
H5'
OP1
H2''
O3'
OP1
OP2
H4'
H5''
H5'
O3'
O3'
OP2
OP1
6t90 5 P68431 96.27 1e-91 EM
2020-05-06 THR E:49 E:46 49.0 0.35 H -66.0 -45.4 49.0 0.35 0.0 DC
DG
DC
DG
DG
6.231
4.054
7.941
9.028
8.569
N
N
CB
OG1
N
O3'
OP1
OP1
OP1
OP1
6yov 5 P68431 96.27 1e-91 EM
2020-05-06 THR E:49 E:46 52.0 0.371 H -72.9 -48.6 52.0 0.371 0.0 DC
DG
DC
DG
DG
5.586
3.706
7.216
8.412
8.165
N
N
CB
N
N
O3'
OP1
OP2
O3'
OP1
4h9n 1 P84243 96.3 2e-91 X-RAY
2012-10-10 THR A:45 A:45 137.0 0.979 S -113.5 -9.3 66.0 0.471 0.508 C:Q9UER7:0.507
HOH
2.823
O
O
4h9q 1 P84243 96.3 2e-91 X-RAY
2012-10-17 THR A:45 A:45 134.0 0.957 S -112.7 -8.1 63.0 0.45 0.507 C:Q9UER7:0.507
HOH
2.702
O
O
3kxb 1 P84233 95.56 2e-91 X-RAY
2010-06-23 THR A:45 A:45 47.0 0.336 H -45.1 -74.1 46.0 0.329 0.007 B:P62799:0.007
DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DA
DC
HOH
7.938
6.268
8.340
7.639
4.565
3.565
9.781
8.550
8.018
6.299
4.801
8.284
7.439
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
C
CG2
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
C4'
OP1
O3'
OP1
OP2
O
THR E:45 E:45 138.0 0.986 360.0 -44.1 130.0 0.929 0.057 C:Q6AZJ8:0.014
F:P62799:0.043
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.214
7.401
7.607
7.946
6.223
7.843
8.733
7.421
8.628
6.733
3.711
2.787
9.380
6.915
CG2
CG2
O
N
C
CG2
N
OG1
N
CG2
OG1
OG1
OG1
CG2
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
6x59 1 Q71DI3 96.3 2e-91 EM
2020-09-16 THR A:45 A:45 57.0 0.407 H -87.3 -46.0 57.0 0.407 0.0 DA
DC
DT
DC
DC
DT
DG
DT
DG
DT
DG
8.588
8.505
6.811
4.070
3.147
8.978
8.602
7.941
5.600
3.529
7.735
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
OG1
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 59.0 0.421 H -87.4 -46.0 55.0 0.393 0.028 C:P0C0S8:0.029
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.676
8.452
7.584
5.822
3.679
7.827
8.659
8.774
6.767
4.001
3.109
9.520
CG2
O
O
N
N
C
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
O3'
OP1
OP2
6x5a 1 Q71DI3 96.3 2e-91 EM
2020-09-16 THR A:45 A:45 50.0 0.357 H -87.0 -45.6 50.0 0.357 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
9.211
9.786
7.766
4.172
3.287
9.574
9.589
8.248
7.619
5.911
3.652
6.569
CG2
N
CG2
CG2
CG2
CG2
OG1
O
O
N
N
OG1
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 51.0 0.364 H -86.9 -45.6 51.0 0.364 0.0 DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
8.698
8.009
5.727
3.435
6.745
9.100
9.388
7.700
4.606
3.882
O
O
N
N
OG1
CG2
N
CG2
CG2
CG2
O3'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
O3'
OP1
6xjd 1 Q71DI3 96.3 2e-91 EM
2020-09-16 THR A:45 A:45 58.0 0.414 H -45.5 -61.0 58.0 0.414 0.0 DT
DC
DC
DG
DT
DG
DT
DG
7.185
5.139
4.327
8.581
8.285
6.061
3.835
7.755
CB
CG2
CG2
O
O
OG1
OG1
OG1
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP2
THR E:45 E:45 58.0 0.414 H -45.5 -61.0 58.0 0.414 0.0 DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
8.844
8.078
6.625
4.204
8.885
9.894
9.581
8.046
5.597
3.625
C
O
OG1
OG1
OG1
CG2
N
CB
CG2
CG2
OP1
OP1
O3'
OP1
OP2
O5'
OP1
O3'
C5'
OP1
7jzv 5 Q71DI3 96.3 2e-91 EM
2021-02-17 THR E:45 NA:NA DO NA DO DO DO NA NA NA
THR K:45 p:45 159.0 1.0 360.0 -29.9 156.0 1.0 0.0 L:P62805:0.021
DG
DT
DG
DT
DG
DA
DC
DT
DC
9.692
9.613
5.925
3.876
6.490
7.559
7.747
9.699
4.886
OG1
O
N
N
OG1
N
N
CB
CG2
OP1
OP1
O3'
OP1
OP1
C4'
OP1
O3'
O3'
6r1u 9 A0A310TTQ1 95.56 3e-91 EM
2019-04-24 THR M:45 NA:NA DO NA DO DO DO NA NA NA
6r25 3 A0A310TTQ1 95.56 3e-91 EM
2019-04-24 THR C:45 NA:NA DO NA DO DO DO NA NA NA
6vyp 1 A0A310TTQ1 95.56 3e-91 X-RAY
2020-05-27 THR A:45 A:45 62.0 0.443 H -76.9 -51.3 60.0 0.429 0.014 G:P06897:0.014
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.632
8.175
6.612
3.962
2.817
9.341
9.585
8.139
7.902
5.561
3.673
7.778
N
N
CG2
OG1
OG1
OG1
CG2
O
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP1
O2
O3'
OP1
O3'
OP1
OP1
THR E:45 E:45 66.0 0.471 H -76.2 -50.4 64.0 0.457 0.014 C:P06897:0.014
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.721
9.932
8.103
8.048
5.381
3.416
7.886
8.468
7.927
6.791
4.081
2.595
9.294
CG2
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
N3
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP1
THR K:45 a:45 62.0 0.443 H -77.6 -50.1 NA NA NA
THR O:45 e:45 69.0 0.493 H -78.2 -50.6 NA NA NA
5b1l 1 ? 94.12 3e-91 X-RAY
2017-02-15 THR A:49 A:45 59.0 0.421 H -71.0 -42.6 59.0 0.421 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
7.976
6.507
8.083
6.291
3.657
2.645
8.915
9.351
8.081
8.056
5.225
3.253
7.433
2.658
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 61.0 0.436 H -69.5 -44.9 61.0 0.436 0.0 DA
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.975
9.229
7.728
7.565
5.325
3.436
7.710
8.072
6.598
8.102
6.468
3.764
2.682
9.503
2.773
CG2
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
C2
O2
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
7e8d 1 P68431 95.56 4e-91 EM
2021-11-10 THR A:45 A:45 51.0 0.364 H -88.7 -34.7 49.0 0.35 0.014 G:P0C0S8:0.014
DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.439
9.687
8.171
7.628
5.691
3.680
6.583
9.941
8.421
8.844
6.694
4.296
3.174
8.873
OG1
CG2
OG1
O
N
N
CG2
N
N
N
OG1
OG1
CG2
CG2
N2
O3'
C4'
OP1
O3'
OP1
OP1
O3'
C5'
OP1
O3'
C4'
OP1
OP1
THR E:45 E:45 55.0 0.393 H -95.7 -44.3 12.0 0.086 0.307 K:O96028:0.264
C:P0C0S8:0.057
DA
DC
DG
DT
DG
8.551
7.999
5.290
3.229
7.378
N
N
N
N
C
C5'
OP1
O3'
OP1
OP2
1zla 2 288992 95.56 6e-91 X-RAY
2006-02-28 THR C:45 A:445 54.0 0.386 H -77.7 -39.7 54.0 0.386 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.576
7.069
8.138
7.219
4.048
2.915
9.116
9.626
7.742
7.166
5.119
3.402
7.513
8.312
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
N
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:645 53.0 0.379 H -67.8 -50.5 48.0 0.343 0.036 E:30268540:0.036
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
9.554
7.427
7.553
5.263
3.535
7.683
9.059
7.554
8.471
6.725
4.075
2.369
9.443
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
3a6n 1 Q16695 93.38 7e-91 X-RAY
2010-05-26 THR A:49 A:45 59.0 0.421 H -69.4 -38.2 54.0 0.386 0.035 G:P04908:0.036
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
HOH
8.343
6.941
8.114
6.802
3.843
2.979
9.289
9.441
7.420
6.723
5.156
3.479
7.452
7.698
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
O
THR E:49 E:45 58.0 0.414 H -68.0 -44.8 51.0 0.364 0.05 C:P04908:0.05
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.356
7.322
7.525
5.256
3.532
7.435
8.812
7.303
8.178
6.667
3.866
2.857
9.377
7.226
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
3c1c 1 P02302 95.56 1e-90 X-RAY
2008-10-07 THR A:45 A:445 64.0 0.457 H -67.6 -41.5 63.0 0.45 0.007 G:P06897:0.007
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.480
6.867
8.209
7.056
4.096
3.096
9.452
9.713
7.623
7.052
4.997
3.244
7.446
8.491
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR E:45 E:645 57.0 0.407 H -57.1 -48.2 57.0 0.407 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.429
7.638
7.895
5.604
3.884
7.321
8.865
7.569
8.175
7.117
4.117
2.674
9.461
7.001
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
OG1
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5f99 1 P84233 95.56 1e-90 X-RAY
2016-02-03 THR A:45 A:45 63.0 0.45 H -75.1 -31.3 59.0 0.421 0.029 G:P06897:0.029
DC
DA
DC
DT
DT
DG
DA
DA
DC
DC
DG
DA
HOH
9.798
8.476
8.284
7.086
4.061
3.298
9.433
8.278
8.109
5.397
3.486
8.002
6.200
OG1
N
N
CG2
CG2
OG1
OG1
O
O
N
N
CB
CG2
O3'
C5'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
O
THR E:45 E:45 55.0 0.393 H -95.7 -22.7 52.0 0.371 0.022 C:P06897:0.021
DC
DA
DA
DT
DT
DT
DT
DG
DA
DC
DA
DG
DA
HOH
9.371
7.433
7.404
4.999
2.943
7.335
9.748
7.964
8.132
7.430
3.809
3.091
9.839
2.684
CG2
O
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O2
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
5omx 3 P84233 95.56 1e-90 X-RAY
2017-11-15 THR C:45 A:45 57.0 0.407 H -62.9 -40.2 56.0 0.4 0.007 I:Q6AZJ8:0.007
DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
8.405
7.000
8.111
6.922
3.762
2.786
9.157
9.878
7.673
7.234
5.203
3.622
7.652
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
THR G:45 E:45 59.0 0.421 H -67.9 -43.9 56.0 0.4 0.021 E:Q6AZJ8:0.021
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.590
7.514
7.359
5.316
3.385
7.526
8.703
7.212
8.370
6.997
3.889
2.758
9.247
2.823
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
6s01 1 A0A310TTQ1 95.56 1e-90 EM
2019-12-18 THR A:45 A:45 49.0 0.35 H -86.3 -47.2 48.0 0.343 0.007 G:Q6AZJ8:0.007
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.303
8.556
6.467
3.706
2.876
9.873
9.615
8.434
8.808
5.533
3.402
7.551
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
O3'
C5'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
THR E:45 E:45 59.0 0.421 T -108.6 -11.4 57.0 0.407 0.014 C:Q6AZJ8:0.014
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DG
9.947
8.311
7.559
5.587
3.469
7.117
8.280
8.591
6.272
4.312
3.340
CG2
O
O
N
N
CG2
N
N
OG1
OG1
CG2
O3'
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
C5'
OP1
4h9o 1 P84243 95.56 3e-90 X-RAY
2012-10-10 THR A:45 A:45 134.0 0.957 S -113.5 -8.2 60.0 0.429 0.528 C:Q9UER7:0.529
HOH
2.610
O
O
1m18 2 P02302 94.07 3e-90 X-RAY
2003-02-18 THR C:45 A:445 57.0 0.407 H -59.9 -46.3 56.0 0.4 0.007 I:P06897:0.007
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.359
6.862
8.243
6.949
3.977
2.565
9.129
9.670
7.676
7.137
5.193
3.454
7.535
7.757
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:645 57.0 0.407 H -60.2 -47.4 57.0 0.407 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.523
7.603
7.475
5.202
3.415
7.496
8.565
7.055
8.358
6.813
3.814
2.598
9.313
4.344
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
1m19 2 P02302 94.07 3e-90 X-RAY
2003-02-18 THR C:45 A:445 56.0 0.4 H -71.2 -44.1 51.0 0.364 0.036 I:P06897:0.036
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.275
6.928
8.214
7.071
4.071
2.668
9.233
9.541
7.752
7.307
5.144
3.337
7.634
5.251
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:645 56.0 0.4 H -69.0 -44.1 54.0 0.386 0.014 E:P06897:0.014
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.504
7.881
7.034
5.142
3.316
7.588
8.396
6.911
8.293
6.940
3.838
2.817
9.167
2.852
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
1m1a 2 P02302 94.07 3e-90 X-RAY
2003-02-18 THR C:45 A:445 61.0 0.436 H -67.4 -39.0 55.0 0.393 0.043 I:P06897:0.043
DG
DC
DG
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.729
7.193
8.353
6.752
3.934
3.169
9.609
9.916
8.264
8.206
5.150
3.253
7.677
9.975
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:645 57.0 0.407 H -70.2 -49.8 57.0 0.407 0.0 DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
PYB
ABU
PYB
HOH
9.513
7.746
7.677
5.042
3.234
7.147
8.328
7.034
8.309
7.883
5.822
3.851
8.387
7.202
9.151
5.612
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
OG1
OG1
CG2
CG2
CG2
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
O
CG
N
O
4h9s 1 P84243 94.81 3e-90 X-RAY
2012-10-17 THR A:45 A:45 199.0 1.0 360.0 132.2 156.0 1.0 0.0 F:Q9UER7:0.307
HOH
7.255
N
O
THR B:45 B:45 83.0 0.593 -60.7 132.1 NA NA NA
7cro 1 Q92133 94.81 4e-90 EM
2020-10-21 THR A:45 M:45 54.0 0.386 S -128.2 -38.9 22.0 0.157 0.229 K:O96028:0.229
DC
DG
DC
DG
DG
6.191
4.024
8.412
9.722
9.006
N
N
C
OG1
N
O3'
OP1
OP2
OP1
OP1
THR E:45 E:45 58.0 0.414 S -124.2 -27.3 54.0 0.386 0.028 C:Q6AZJ8:0.029
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
8.389
9.118
7.688
5.321
4.106
9.483
8.745
5.754
3.765
7.556
N
N
OG1
OG1
CG2
O
O
N
N
CG2
C5'
OP1
O3'
C5'
OP1
O3'
OP1
O3'
OP1
OP1
7crp 1 Q92133 94.81 4e-90 EM
2020-10-21 THR A:45 M:45 45.0 0.321 S -102.1 -47.6 14.0 0.1 0.221 K:Q9BZ95:0.221
DC
DG
DC
DG
DG
6.058
3.778
8.402
9.669
9.031
N
N
CB
N
N
O3'
OP1
OP1
C5'
OP1
THR E:45 E:45 63.0 0.45 H -90.9 -50.9 63.0 0.45 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
9.317
8.991
7.475
4.871
3.436
9.960
9.963
8.444
8.243
5.978
3.742
7.983
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
7crq 1 Q92133 94.81 4e-90 EM
2020-10-21 THR A:45 M:45 35.0 0.25 S -90.7 -50.5 8.0 0.057 0.193 G:Q6AZJ8:0.007
K:Q9BZ95:0.179
DC
DG
DC
DG
DG
6.350
4.128
8.270
9.651
9.091
N
N
CB
N
N
O3'
OP1
OP1
C5'
OP1
THR E:45 E:45 51.0 0.364 T -101.6 -48.2 23.0 0.164 0.2 L:Q9BZ95:0.2
DA
DC
DG
DT
DG
9.585
9.069
6.362
4.166
8.494
N
N
N
N
C
C5'
OP1
O3'
OP1
OP2
7crr 1 Q92133 94.81 4e-90 EM
2020-10-21 THR A:45 M:45 35.0 0.25 S -104.7 -51.8 6.0 0.043 0.207 K:Q9BZ95:0.207
DC
DG
DC
DG
DG
6.190
4.093
7.473
9.269
8.835
N
N
CG2
N
N
O3'
OP1
OP1
C5'
OP1
THR E:45 E:45 55.0 0.393 S -114.2 -40.8 55.0 0.393 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.892
8.784
7.180
4.693
3.330
9.956
9.969
8.531
7.907
5.624
3.683
7.838
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP2
4z5t 1 Q6NXT2 95.59 4e-90 X-RAY
2016-02-10 THR A:48 A:44 62.0 0.443 H -70.1 -46.0 58.0 0.414 0.029 G:P04908:0.029
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
9.278
7.545
8.172
6.519
3.925
2.772
9.320
9.802
8.189
7.756
5.237
3.377
7.405
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:48 E:44 56.0 0.4 H -70.3 -46.2 55.0 0.393 0.007 C:P04908:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.588
8.093
7.877
5.691
3.944
7.539
9.330
7.796
8.644
6.224
3.842
2.476
9.068
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
1p3b 2 Q7ZT64 94.81 5e-90 X-RAY
2004-02-24 THR C:45 A:445 65.0 0.464 H -65.9 -39.4 65.0 0.464 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.378
7.215
7.993
6.806
3.673
2.951
8.993
9.986
7.503
7.086
5.278
3.445
7.159
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP2
THR G:45 E:645 54.0 0.386 H -69.3 -44.0 54.0 0.386 0.0 DT
DA
DT
DG
DA
DA
DC
DG
DT
DT
DG
DA
HOH
9.594
7.673
7.233
5.199
3.428
7.552
8.429
7.904
6.856
3.756
2.621
9.018
6.553
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
O
1p3f 2 Q7ZT64 94.81 5e-90 X-RAY
2004-02-24 THR C:45 A:445 60.0 0.429 H -75.8 -37.4 55.0 0.393 0.036 I:Q7ZT66:0.036
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
9.273
7.221
8.317
6.868
4.034
3.091
9.715
9.694
7.663
6.897
5.336
3.446
7.241
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
THR G:45 E:645 56.0 0.4 H -68.2 -49.4 56.0 0.4 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.769
7.834
7.511
5.350
3.438
7.270
8.912
7.810
8.341
6.660
3.738
2.468
9.069
6.947
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
1p3g 2 Q7ZT64 94.81 5e-90 X-RAY
2004-02-24 THR C:45 A:445 63.0 0.45 H -65.3 -33.2 62.0 0.443 0.007 I:Q7ZT66:0.007
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
7.632
8.208
6.988
4.367
2.802
9.282
9.430
7.601
7.489
5.187
3.415
7.514
6.732
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:645 56.0 0.4 H -78.4 -46.3 56.0 0.4 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.617
7.848
7.380
5.108
3.225
7.538
8.768
7.317
8.604
6.820
3.904
2.597
9.064
7.297
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
1p3i 2 Q7ZT64 94.81 5e-90 X-RAY
2004-02-24 THR C:45 A:445 61.0 0.436 H -61.0 -47.9 61.0 0.436 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.514
7.151
8.122
7.012
4.011
2.747
9.526
9.481
7.559
7.151
5.239
3.489
7.513
6.056
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
N
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
O
THR G:45 E:645 54.0 0.386 H -63.1 -43.5 54.0 0.386 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.725
7.689
7.400
5.273
3.469
7.539
8.721
7.423
8.168
6.752
3.678
2.532
9.063
2.733
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
1p3o 2 Q7ZT64 94.81 5e-90 X-RAY
2004-02-24 THR C:45 A:445 59.0 0.421 H -54.8 -46.3 59.0 0.421 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
9.714
7.312
8.121
6.756
4.209
2.550
9.295
9.676
7.668
7.132
5.342
3.531
7.523
8.519
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
O
C4'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
O
THR G:45 E:645 59.0 0.421 H -76.0 -44.4 59.0 0.421 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.755
7.775
7.631
5.181
3.252
7.381
8.802
7.468
8.487
6.757
3.865
2.640
9.272
7.639
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
C
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
1p3p 2 Q7ZT64 94.81 5e-90 X-RAY
2004-02-24 THR C:45 A:445 60.0 0.429 H -64.0 -42.5 59.0 0.421 0.008 I:Q7ZT66:0.007
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
9.009
7.344
8.183
7.099
4.343
2.729
9.551
9.381
7.498
7.027
5.093
3.199
7.435
7.965
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
O
THR G:45 E:645 57.0 0.407 H -74.8 -40.7 57.0 0.407 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.523
7.648
7.487
5.118
3.361
7.591
8.945
7.497
8.595
6.470
3.987
2.517
9.195
2.730
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
6ven 1 P84233 94.81 5e-90 EM
2020-01-15 THR A:45 A:45 58.0 0.414 H -98.1 -42.5 58.0 0.414 0.0 DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
9.897
8.715
8.434
5.803
3.601
7.935
9.844
8.273
8.562
6.976
4.405
3.056
9.172
CG2
O
O
N
N
C
OG1
N
N
CG2
CG2
OG1
OG1
N2
O3'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
OP1
THR E:45 E:45 54.0 0.386 H -87.0 -17.9 53.0 0.379 0.007 C:P06897:0.007
DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.098
8.327
6.998
4.774
3.184
9.625
9.043
8.960
5.362
3.564
6.845
N
N
OG1
OG1
CG2
CG2
O
O
N
N
CG2
C5'
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
6nj9 1 P84233 94.81 5e-90 EM
2019-02-20 THR A:45 A:45 53.0 0.379 H -97.5 -37.3 51.0 0.364 0.015 G:P06897:0.014
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.905
8.573
8.312
5.810
3.734
6.618
8.671
8.502
7.902
4.535
3.334
9.647
OG1
O
O
N
N
OG1
N
N
CB
CG2
CG2
CG2
O3'
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
THR E:45 E:45 53.0 0.379 H -97.5 -37.2 51.0 0.364 0.015 C:P06897:0.014
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.645
8.648
7.832
4.501
3.289
9.678
9.874
8.585
8.124
5.671
3.643
6.731
N
N
CB
CG2
CG2
CG2
OG1
O
O
N
N
OG1
C5'
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
6nqa 8 P84233 94.81 5e-90 EM
2019-02-20 THR H:45 E:45 60.0 0.429 S -135.7 -8.5 51.0 0.364 0.065 K:P06897:0.064
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
9.234
9.042
5.844
3.849
7.656
9.819
8.099
8.310
7.147
4.814
3.505
9.848
O
O
N
N
CG2
N
N
N
OG1
CG2
CG2
CG2
O3'
OP1
O3'
OP1
OP1
O3'
C5'
OP1
O3'
O3'
OP1
OP1
THR I:45 A:45 51.0 0.364 S -132.6 -28.5 51.0 0.364 0.0 DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
8.309
8.967
6.549
3.933
3.446
9.348
9.104
8.617
5.032
3.095
7.439
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
C5'
OP1
O3'
C5'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
1p3a 2 Q7ZT64 94.07 3e-89 X-RAY
2004-02-24 THR C:45 A:445 53.0 0.379 H -75.0 -42.4 51.0 0.364 0.015 I:Q7ZT66:0.014
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.953
7.456
8.411
7.346
4.350
2.937
9.648
9.441
7.730
6.947
5.059
3.099
7.048
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR G:45 E:645 58.0 0.414 H -79.0 -42.1 58.0 0.414 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
9.810
7.653
7.030
5.098
3.282
7.540
8.928
7.592
8.466
6.644
4.111
2.597
9.416
CG2
O
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
1p3k 2 Q7ZT64 94.07 3e-89 X-RAY
2004-02-24 THR C:45 A:445 61.0 0.436 H -63.4 -46.0 61.0 0.436 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.714
7.459
8.709
7.166
4.180
2.598
9.476
9.393
7.560
7.066
5.401
3.832
7.479
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
THR G:45 E:645 57.0 0.407 H -68.6 -50.7 57.0 0.407 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.428
7.580
7.282
5.422
3.756
7.419
9.865
7.918
8.643
6.675
3.811
2.682
9.298
8.272
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
1p3m 2 Q7ZT64 94.07 4e-89 X-RAY
2004-02-24 THR C:45 A:445 63.0 0.45 H -57.7 -40.1 63.0 0.45 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
9.210
7.934
8.574
7.232
3.695
2.915
9.813
9.122
7.165
7.053
6.800
4.911
7.335
N
OG1
N
OG1
OG1
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
THR G:45 E:645 55.0 0.393 H -82.8 -35.7 55.0 0.393 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.338
7.520
7.048
5.595
4.000
7.748
9.748
8.517
8.573
6.795
3.908
2.869
9.552
6.110
CG2
O
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5ong 3 P84233 94.81 4e-89 X-RAY
2017-11-22 THR C:45 A:45 55.0 0.393 H -82.8 -56.8 52.0 0.371 0.022 I:Q6AZJ8:0.021
DG
DC
DT
DT
G47
DG
DA
DT
DA
DT
DG
DA
DA
8.704
7.488
8.051
7.195
3.749
2.947
8.779
9.912
7.855
7.254
5.420
3.348
7.352
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
O3'
OP1
O3'
OP1
OP1
THR G:45 E:45 56.0 0.4 H -65.3 -50.2 56.0 0.4 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
G47
DG
DA
9.633
7.743
7.347
5.301
3.505
7.666
9.147
8.399
8.297
7.528
3.887
3.008
8.837
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
5onw 3 P84233 94.81 4e-89 X-RAY
2017-11-22 THR C:45 A:45 63.0 0.45 H -97.6 -37.2 63.0 0.45 0.0 DG
DC
DT
DT
G47
DG
DA
DA
DT
DG
DA
DA
9.308
8.102
7.980
8.637
4.823
3.356
9.221
8.067
7.645
5.565
3.644
7.324
CG2
CG2
N
CB
OG1
CG2
OG1
O
O
N
N
OG1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP1
THR G:45 E:45 60.0 0.429 H -71.1 -33.0 54.0 0.386 0.043 E:Q6AZJ8:0.043
DA
DT
DG
DA
DA
DG
DC
DT
DT
G47
DG
DA
8.085
7.128
5.439
3.604
7.417
9.283
7.566
8.115
8.994
4.724
3.374
9.311
O
O
N
N
OG1
CG2
CG2
N
CB
CG2
CG2
CG2
O3'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
1p3l 2 Q7ZT64 94.07 6e-89 X-RAY
2004-02-24 THR C:45 A:445 54.0 0.386 H -71.5 -40.6 54.0 0.386 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.882
7.202
9.140
6.523
3.936
3.023
9.654
9.700
7.568
6.757
6.758
5.673
8.059
5.622
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
C
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
O
THR G:45 E:645 58.0 0.414 H -67.9 -42.9 57.0 0.407 0.007 E:Q7ZT66:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.187
7.369
7.493
7.667
6.367
7.785
8.813
7.426
8.861
6.732
3.728
2.852
9.380
4.983
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
OG1
OG1
OG1
N
O3'
C4'
OP1
O3'
C5'
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
1p34 2 Q7ZT64 94.07 6e-89 X-RAY
2004-02-24 THR C:45 A:445 61.0 0.436 H -72.5 -33.9 59.0 0.421 0.015 I:Q7ZT66:0.014
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
9.963
7.624
8.373
6.941
4.204
2.800
9.691
9.407
7.462
6.838
5.145
3.431
7.353
8.191
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
O
THR G:45 E:645 56.0 0.4 H -68.4 -43.1 56.0 0.4 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
9.642
7.850
7.316
4.966
3.138
7.403
8.928
7.570
8.436
6.847
3.860
2.674
9.422
2.821
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
4kud 1 P61830 90.44 4e-87 X-RAY
2013-08-07 THR A:46 A:45 66.0 0.471 H -75.9 -38.1 57.0 0.407 0.064 G:P04912:0.064
DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DA
DC
9.074
7.761
8.230
7.641
4.344
3.108
9.312
8.867
8.141
5.228
3.351
7.125
CG2
CG2
N
CB
OG1
OG1
OG1
O
O
N
N
OG1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP1
THR E:46 E:45 51.0 0.364 H -75.7 -45.8 51.0 0.364 0.0 DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
HOH
8.577
8.535
5.437
3.410
7.903
9.069
7.254
8.446
5.767
3.794
3.204
9.217
8.063
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
OP1
OP1
OP2
O
5zba 3 P61830 90.44 4e-87 X-RAY
2018-07-25 THR C:46 C:45 91.0 0.65 -61.6 129.3 47.0 0.336 0.314 D:P02309:0.314
IOD
IOD
IOD
7.384
3.994
8.062
CG2
OG1
OG1
I
I
I
5zbb 3 P61830 90.44 4e-87 X-RAY
2018-07-25 THR C:46 C:45 96.0 0.686 -67.1 121.4 49.0 0.35 0.336 D:P02309:0.336
IOD
IOD
7.364
8.199
CG2
OG1
I
I
7k7g 1 P61830 90.44 4e-87 EM
2021-03-31 THR A:46 A:46 147.0 1.0 -69.8 -46.3 147.0 1.0 0.0 DG
DT
DA
DC
DG
DT
DG
9.317
9.050
7.516
9.789
4.737
2.685
3.934
N
N
N
N
N
N
CB
N2
O3'
OP1
OP1
O3'
OP1
OP1
THR E:46 E:46 149.0 1.0 -69.7 -46.2 149.0 1.0 0.0 DC
DG
DC
DG
DG
DG
DG
DG
5.876
3.860
3.373
8.792
9.646
8.040
7.134
9.419
N
N
CB
OG1
N
OG1
N
N
O3'
OP1
OP1
N2
N2
C5'
C5'
OP1
6gej 2 P61830 89.71 2e-86 EM
2018-10-17 THR B:46 A:45 56.0 0.4 H -78.7 -42.3 56.0 0.4 0.0 DA
DC
DG
DT
DG
9.383
9.151
4.935
3.026
7.054
OG1
N
N
N
CB
OP1
OP1
O3'
OP1
OP1
THR C:46 B:45 54.0 0.386 H -78.7 -42.3 54.0 0.386 0.0 DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
8.038
9.047
5.547
3.553
8.263
9.537
8.487
8.600
8.327
4.776
3.066
8.562
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
C5'
OP1
O3'
OP1
OP1
O3'
C5'
OP1
O3'
O3'
OP1
OP2
6gen 2 P61830 89.71 2e-86 EM
2018-10-17 THR B:46 A:45 54.0 0.386 S -94.5 -46.2 54.0 0.386 0.0 DA
DC
DG
DT
DG
9.762
9.223
5.056
2.979
7.158
N
N
N
N
CB
O5'
OP1
O3'
OP1
OP1
THR C:46 B:45 54.0 0.386 S -94.6 -46.2 53.0 0.379 0.007 F:P04911:0.007
DG
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DC
9.840
8.153
8.674
5.864
3.814
8.243
8.725
8.611
6.794
4.451
2.567
9.027
CG2
CG2
O
N
N
CB
N
N
CG2
CG2
OG1
OG1
N2
C5'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O5'
OP1
OP2
4jjn 1 P61830 90.37 5e-86 X-RAY
2013-05-15 THR A:45 A:45 67.0 0.479 H -70.1 -46.1 67.0 0.479 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
8.991
9.325
8.313
8.404
5.324
3.393
7.550
9.800
8.184
7.839
6.736
3.718
2.794
8.737
CG2
CG2
O
O
N
N
C
OG1
N
N
CG2
CG2
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP2
O3'
C5'
OP1
O3'
O3'
OP1
OP2
THR E:45 E:45 44.0 0.314 T -141.6 -62.3 44.0 0.314 0.0 DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.417
8.090
6.872
3.535
2.642
8.726
8.913
7.577
7.855
5.590
3.670
6.789
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
1id3 2 P61830 89.63 3e-85 X-RAY
2001-09-28 THR C:45 A:45 57.0 0.407 H -101.4 -26.2 57.0 0.407 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
9.087
7.728
8.394
7.073
4.190
3.059
9.945
9.388
7.467
7.539
4.790
3.349
7.622
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR G:45 E:45 56.0 0.4 H -85.8 -43.6 50.0 0.357 0.043 E:P04911:0.043
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
MN
9.542
7.782
7.388
5.011
3.265
7.476
9.204
7.911
8.463
7.070
3.974
3.028
9.179
8.767
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
MN
7dbh 1 ? 91.18 3e-84 EM
2022-01-19 THR A:49 NA:NA DO NA DO DO DO NA NA NA
THR E:49 NA:NA DO NA DO DO DO NA NA NA
7vbm 1 ? 91.18 3e-84 EM
2022-01-19 THR A:49 NA:NA DO NA DO DO DO NA NA NA
THR E:49 NA:NA DO NA DO DO DO NA NA NA
4h9p 1 P84243 95.56 8e-82 X-RAY
2012-10-17 THR A:45 A:45 136.0 0.971 S -93.2 -11.8 61.0 0.436 0.535 C:Q9UER7:0.536
HOH
3.480
O
O
4h9r 1 P84243 95.56 8e-82 X-RAY
2012-10-17 THR A:45 A:45 137.0 0.979 S -86.6 -15.8 59.0 0.421 0.558 C:Q9UER7:0.557
HOH
4.468
O
O
5zbx 1 P68431,P49450 84.78 7e-79 X-RAY
2019-02-13 THR A:49 A:45 58.0 0.414 H -63.3 -47.9 51.0 0.364 0.05 G:P04908:0.05
DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
9.201
7.484
8.685
6.550
3.942
3.008
8.887
9.062
7.746
7.773
5.390
3.440
7.497
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:49 E:45 54.0 0.386 H -64.7 -49.1 49.0 0.35 0.036 C:P04908:0.036
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.519
7.808
7.811
5.398
3.580
7.433
9.239
7.477
8.736
6.570
4.232
2.565
9.262
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
OG1
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
1aoi 2 P02302 95.69 3e-78 X-RAY
1998-09-30 THR C:26 A:45 55.0 0.393 H -80.6 -52.0 54.0 0.386 0.007 I:P06897:0.007
DA
DG
DC
DT
DT
DG
DA
DA
DT
DA
DA
DC
8.328
6.799
9.021
7.110
4.340
3.202
9.703
7.953
7.127
4.876
3.065
7.401
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
THR G:26 E:45 58.0 0.414 H -66.2 -47.4 57.0 0.407 0.007 E:P06897:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.790
7.922
7.455
5.246
3.355
7.522
8.567
7.183
8.132
6.682
3.887
2.661
9.240
8.022
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
5z23 1 P68431,P49450 83.33 1e-76 X-RAY
2019-02-13 THR A:49 A:45 52.0 0.371 H -69.6 -47.2 49.0 0.35 0.021 G:P04908:0.021
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.456
7.018
8.226
6.366
3.939
2.460
8.914
9.662
8.139
8.098
5.458
3.519
7.720
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:49 E:45 57.0 0.407 H -66.3 -46.2 57.0 0.407 0.0 DT
DA
DT
DG
DA
DA
DC
DT
DT
DT
DG
DA
9.861
7.869
7.342
5.899
3.992
7.666
7.896
8.662
6.063
3.950
2.633
9.090
CG2
O
O
N
N
CB
OG1
N
CG2
CG2
OG1
OG1
O2
O3'
OP1
O3'
OP1
OP1
OP1
OP1
O3'
O3'
OP1
OP2
5ay8 1 ? 82.09 2e-76 X-RAY
2016-04-06 THR A:49 A:45 56.0 0.4 H -70.2 -53.0 51.0 0.364 0.036 G:P04908:0.036
DA
DG
DC
DA
DT
DT
DG
DT
DC
DA
DA
DC
8.485
7.040
7.924
5.990
3.807
2.868
9.461
9.919
9.439
5.242
3.248
7.581
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
OP1
OP1
OP2
C4'
OP1
O3'
OP1
OP1
THR E:49 E:45 56.0 0.4 H -67.8 -51.1 56.0 0.4 0.0 DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
CL
9.604
8.830
5.311
3.380
7.900
9.563
7.313
8.310
5.808
3.866
2.596
9.413
8.116
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
OG1
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
C5'
OP1
OP2
CL
5bs7 1 P84233 96.4 9e-76 X-RAY
2015-07-08 THR A:21 NA:NA DO NA DO DO DO NA NA NA
THR B:21 NA:NA DO NA DO DO DO NA NA NA
5bsa 1 P84233 96.36 4e-75 X-RAY
2015-07-08 THR A:20 NA:NA DO NA DO DO DO NA NA NA
THR B:20 NA:NA DO NA DO DO DO NA NA NA
3w98 1 P68431 95.37 6e-73 X-RAY
2013-08-28 THR A:22 A:45 60.0 0.429 H -75.6 -45.6 60.0 0.429 0.0 DA
DG
DC
DA
DT
DT
DG
DA
DT
DC
DA
DA
DC
8.636
7.652
8.335
6.619
3.848
2.937
9.187
9.732
8.110
7.473
4.869
3.319
7.550
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP1
THR E:22 E:45 53.0 0.379 H -64.5 -45.3 53.0 0.379 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
9.873
7.950
8.307
5.133
3.449
7.356
8.425
7.227
8.236
6.997
4.187
3.162
9.764
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O4'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
7ea8 2 ? 99.01 4e-70 EM
2021-07-14 THR B:13 A:45 64.0 0.457 H -70.3 -48.6 21.0 0.15 0.307 H:P20671:0.014
A:Q9BYW2:0.293
DA
DC
DG
DT
DG
9.556
9.353
7.192
4.996
8.600
N
N
N
N
C
C5'
OP1
O3'
OP1
OP2
THR F:13 E:45 56.0 0.4 H -70.3 -44.4 56.0 0.4 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.513
9.413
8.555
7.930
6.608
4.404
8.334
9.380
9.413
6.574
4.661
3.436
9.862
CG2
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP1
4z2m 2 P68431 96.08 9e-69 X-RAY
2016-03-09 THR B:12 NA:NA DO NA DO DO DO NA NA NA
THR D:12 NA:NA DO NA DO DO DO NA NA NA
7ea5 1 A0A310TTQ1 95.05 2e-67 EM
2021-07-14 THR A:12 A:45 68.0 0.486 H -71.1 -51.1 19.0 0.136 0.35 G:Q6AZJ8:0.036
K:A0A6V8RR65:0.321
DA
DC
DG
DT
DG
9.640
9.432
7.487
5.192
9.085
N
N
N
N
C
C5'
OP1
O3'
OP1
OP2
THR E:12 E:45 59.0 0.421 H -70.5 -46.4 58.0 0.414 0.007 C:Q6AZJ8:0.007
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
9.097
9.636
8.761
7.936
6.603
4.594
8.480
9.240
9.248
6.239
4.658
3.522
CG2
CG2
O
O
N
N
C
N
N
CG2
CG2
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O5'
OP1
6r1t 1 A0A310TTQ1 95.96 1e-66 EM
2019-04-24 THR A:9 A:45 56.0 0.4 H -76.8 -44.9 56.0 0.4 0.0 DG
DG
DC
DT
DC
DG
DG
DA
DA
DT
DC
DG
DC
9.429
8.840
7.289
4.115
2.321
8.325
9.374
9.104
7.630
7.526
6.512
4.313
7.418
N
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
N2
O3'
C4'
OP1
O3'
OP1
OP2
THR E:9 E:45 57.0 0.407 H -73.0 -46.5 57.0 0.407 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DG
9.543
7.880
7.849
6.043
4.010
7.416
9.358
8.544
7.557
4.220
2.344
7.791
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
OG1
C4'
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
7ktq 1 A0A310TTQ1 95.96 1e-66 EM
2021-02-03 THR A:9 A:45 58.0 0.414 H -77.7 -41.2 58.0 0.414 0.0 DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.802
8.750
6.248
3.996
3.055
9.514
9.137
8.217
8.061
5.908
4.098
7.694
N
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
C5'
OP1
O3'
C5'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP2
THR E:9 E:45 66.0 0.471 H -77.5 -41.2 66.0 0.471 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.233
9.787
8.153
7.990
6.054
4.315
7.697
8.597
8.686
6.610
3.909
2.743
9.114
CG2
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
OG1
N2
O3'
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
5wcu 1 P02299 96.94 1e-66 X-RAY
2018-10-31 THR A:8 A:45 73.0 0.521 H -71.2 -51.0 65.0 0.464 0.057 G:P84051:0.057
DT
DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
9.353
7.452
7.855
5.964
3.736
3.483
9.899
9.305
8.572
5.865
4.330
8.668
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
C5'
OP1
O3'
C5'
OP2
OP2
O3'
OP1
O3'
OP1
OP2
THR E:8 E:45 52.0 0.371 S -126.7 -51.0 44.0 0.314 0.057 C:P84051:0.057
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
8.758
7.237
7.672
4.759
2.789
7.263
9.135
7.750
8.787
6.637
4.185
3.068
8.866
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
OG1
OG1
OG1
O3'
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR K:8 K:45 52.0 0.371 H -71.3 -51.0 NA NA NA
THR O:8 O:45 52.0 0.371 H -71.3 -51.1 NA NA NA
6jm9 3 P84233 96.94 1e-66 EM
2019-05-15 THR C:8 A:45 59.0 0.421 H -58.8 -43.9 58.0 0.414 0.007 I:Q6AZJ8:0.007
DA
DG
DC
DA
DA
DC
8.343
6.852
8.191
5.279
3.464
7.452
OG1
OG1
N
N
N
C
O3'
OP1
OP1
O3'
OP1
OP2
THR G:8 E:45 56.0 0.4 H -63.4 -49.9 54.0 0.386 0.014 E:Q6AZJ8:0.014
DG
DA
DA
DG
DC
DT
5.200
3.304
7.459
8.490
7.023
8.044
N
N
C
OG1
OG1
N
O3'
OP1
OP2
O3'
OP1
OP1
6jma 2 P84233 96.94 1e-66 EM
2019-05-15 THR C:8 A:45 57.0 0.407 H -58.8 -43.9 57.0 0.407 0.0 DA
DG
DC
DA
DA
DC
8.343
6.853
8.191
5.279
3.464
7.451
OG1
OG1
N
N
N
C
O3'
OP1
OP1
O3'
OP1
OP2
THR G:8 E:45 58.0 0.414 H -63.5 -49.9 55.0 0.393 0.021 E:Q6AZJ8:0.021
DG
DA
DA
DG
DC
DT
5.200
3.304
7.459
8.490
7.023
8.044
N
N
C
OG1
OG1
N
O3'
OP1
OP2
O3'
OP1
OP1
6yn1 3 A0A310TTQ1 95.92 6e-66 X-RAY
2021-11-17 THR C:9 C:45 81.0 0.579 H -73.8 -36.9 81.0 0.579 0.0 HOH
3.594
N
O
THR H:9 H:45 79.0 0.564 H -57.2 -45.9 79.0 0.564 0.0 HOH
2.777
OG1
O
THR M:9 M:45 80.0 0.571 H -64.9 -45.0 NA NA NA
THR R:9 R:45 82.0 0.586 H -60.3 -39.4 NA NA NA
THR W:9 W:45 81.0 0.579 H -64.6 -41.4 NA NA NA
THR BA:9 b:45 78.0 0.557 H -63.4 -43.3 NA NA NA
THR GA:9 g:45 75.0 0.536 H -61.9 -43.9 NA NA NA
THR LA:9 l:45 84.0 0.6 H -65.5 -42.7 NA NA NA
6fq5 1 ? 95.92 6e-66 EM
2018-04-18 THR A:9 A:45 66.0 0.471 H -63.3 -53.0 64.0 0.457 0.014 G:Q6AZJ8:0.014
DG
DG
DC
DT
DC
DC
DG
DA
DT
DC
DG
DC
9.190
8.759
6.252
3.486
2.623
8.847
9.415
8.033
8.294
6.243
4.426
8.047
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
OP1
OP1
O3'
O3'
OP1
OP1
N2
C4'
OP1
O3'
OP1
OP2
THR E:9 E:45 77.0 0.55 H -63.5 -48.5 75.0 0.536 0.014 C:Q6AZJ8:0.014
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DT
8.802
8.412
5.793
4.026
7.470
8.945
8.303
6.239
3.686
3.327
9.301
O
O
N
N
C
N
N
CG2
CG2
OG1
OG1
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP2
6fq6 1 ? 95.92 6e-66 EM
2018-04-18 THR A:9 A:45 66.0 0.471 H -63.7 -55.7 66.0 0.471 0.0 DG
DG
DG
DC
DT
DC
DC
DG
DA
DT
DC
DG
DC
8.254
7.135
8.615
5.898
3.400
3.008
9.446
8.861
8.728
8.957
5.924
4.040
6.746
OG1
OG1
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP2
OP2
N2
O4'
OP1
O3'
OP1
OP1
THR E:9 E:45 71.0 0.507 H -64.2 -50.7 71.0 0.507 0.0 DG
DT
DG
DT
DG
DT
DA
DC
DT
DC
DC
DT
9.290
9.588
6.126
4.379
6.930
8.945
6.710
8.215
5.716
3.605
3.219
8.881
CG2
O
N
N
CG2
N
OG1
N
CG2
CG2
OG1
OG1
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
C5'
OP2
OP1
6fq8 1 P02302 95.92 6e-66 EM
2018-04-18 THR A:9 A:45 64.0 0.457 H -65.2 -48.2 64.0 0.457 0.0 DG
DG
DG
DC
DT
DC
DC
DG
DA
DC
DG
DC
9.406
8.559
8.856
6.243
3.394
2.502
8.182
9.091
9.580
6.325
3.981
7.326
N
N
N
CG2
CG2
OG1
OG1
CG2
CG2
N
N
C
O3'
OP1
OP1
O3'
O3'
OP2
OP2
N2
C4'
O3'
OP1
OP2
THR E:9 E:45 67.0 0.479 H -66.5 -47.6 67.0 0.479 0.0 DT
DG
DT
DG
DT
DG
DT
DA
DC
DT
DC
DC
DT
9.616
8.472
9.279
6.143
4.472
7.130
9.594
7.278
9.199
6.154
3.003
2.856
8.888
CG2
CG2
O
N
C
CB
N
N
N
CG2
OG1
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
4xzq 1 P84233 95.92 7e-66 X-RAY
2015-10-14 THR A:8 A:445 62.0 0.443 H -66.2 -44.4 62.0 0.443 0.0 DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.693
7.234
8.017
7.073
3.980
2.831
9.012
9.429
7.626
6.905
5.322
3.497
7.624
2.719
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
O
THR E:8 E:645 57.0 0.407 H -72.0 -46.4 56.0 0.4 0.007 C:Q6AZJ8:0.007
DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.535
7.578
7.282
5.229
3.383
7.506
8.713
7.329
8.206
7.066
3.969
2.634
9.125
2.568
CG2
CG2
O
N
N
CG2
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
4ys3 1 P84233 95.92 7e-66 X-RAY
2015-10-14 THR A:8 A:445 55.0 0.393 H -76.7 -41.0 55.0 0.393 0.0 DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
HOH
8.701
7.174
8.445
7.227
4.121
2.902
9.293
9.358
7.623
7.119
5.096
3.253
7.479
8.620
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CG2
O
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:8 E:645 56.0 0.4 H -69.9 -48.3 56.0 0.4 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.631
7.558
7.328
5.398
3.639
7.408
8.858
7.370
8.260
6.939
4.233
2.557
9.426
6.754
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
4z66 1 P84233 95.92 7e-66 X-RAY
2015-10-14 THR A:8 A:445 61.0 0.436 H -62.4 -47.3 61.0 0.436 0.0 DG
DC
DT
DT
DT
DG
DA
DT
DA
DT
DG
DA
DA
8.698
7.348
7.979
6.868
4.017
2.718
9.044
9.559
7.669
7.050
5.288
3.467
7.646
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP2
THR E:8 E:645 56.0 0.4 H -72.0 -45.0 56.0 0.4 0.0 DT
DA
DT
DG
DA
DA
DG
DC
DT
DT
DT
DG
DA
HOH
9.477
7.413
7.268
5.227
3.415
7.661
8.827
7.300
8.319
6.996
4.155
2.535
9.279
2.643
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
OG1
OG1
OG1
O
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
6iy2 1 A0A310TTQ1 95.0 8e-66 EM
2019-04-03 THR A:10 A:45 52.0 0.371 H -70.9 -41.0 49.0 0.35 0.021 G:Q6AZJ8:0.021
DA
DC
DT
DT
DG
DA
DA
DA
DC
DC
DG
DA
8.795
8.795
7.858
4.619
3.211
9.111
9.505
8.189
7.413
6.261
4.115
7.896
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP2
THR E:10 E:45 64.0 0.457 H -73.3 -49.0 59.0 0.421 0.036 C:Q6AZJ8:0.036
DG
DC
DA
DT
DT
DT
DG
DA
DC
DA
DG
DA
9.499
8.726
8.385
6.541
4.465
8.169
9.428
8.756
6.786
3.839
3.189
9.258
CG2
O
O
N
N
C
N
N
CG2
OG1
OG1
OG1
O4'
O3'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
6iy3 1 A0A310TTQ1 95.0 8e-66 EM
2019-04-03 THR A:10 A:45 66.0 0.471 H -70.0 -32.4 66.0 0.471 0.0 DA
DC
DT
DT
DG
DA
DA
DA
DA
DC
DG
DA
8.842
8.304
7.184
4.884
2.918
9.060
9.842
9.258
7.669
6.233
4.096
8.407
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
C
C5'
OP1
O3'
O3'
OP1
OP1
N3
C4'
OP1
O3'
OP1
OP2
THR E:10 E:45 63.0 0.45 H -73.9 -33.8 63.0 0.45 0.0 DG
DA
DA
DT
DT
DT
DG
DA
DC
DA
DG
DA
9.943
8.524
8.159
6.208
4.032
8.104
8.832
9.084
6.149
3.762
3.231
9.776
CG2
CG2
O
N
N
C
N
N
CG2
CG2
OG1
OG1
N2
C5'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
C5'
OP1
OP1
6ipu 1 P68431 95.92 1e-65 X-RAY
2020-01-15 THR A:8 A:45 59.0 0.421 H -69.5 -44.9 58.0 0.414 0.007 G:P04908:0.007
DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
HOH
8.203
6.611
8.239
6.873
3.757
2.634
8.639
9.356
7.645
7.206
5.164
3.251
7.524
8.546
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
N
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
O
THR E:8 E:45 55.0 0.393 H -69.8 -47.6 55.0 0.393 0.0 DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
HOH
9.951
7.703
7.455
5.150
3.279
7.454
8.335
6.861
8.254
6.799
3.780
2.636
9.214
5.611
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N
C4'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O
6iq4 1 P68431 95.92 1e-65 X-RAY
2019-10-30 THR A:8 A:45 58.0 0.414 H -70.4 -42.1 58.0 0.414 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.113
6.582
8.280
7.008
3.873
2.830
9.228
9.330
7.598
7.135
4.953
3.212
7.507
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
C4'
OP1
O3'
OP1
OP1
THR E:8 E:45 57.0 0.407 H -68.2 -43.4 55.0 0.393 0.014 C:P04908:0.014
DT
DA
DT
DA
DA
DC
DA
DG
DC
DT
DT
DG
DA
9.861
7.664
7.489
5.145
3.283
7.544
8.385
6.910
8.283
6.834
3.779
2.731
9.414
CG2
CG2
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
C4'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6jxd 1 P68431 95.92 1e-65 X-RAY
2020-01-15 THR A:8 A:45 58.0 0.414 H -78.1 -41.6 57.0 0.407 0.007 G:P04908:0.007
DT
DA
DC
DT
DA
DT
DG
DA
DT
DG
DT
DG
9.866
8.015
7.825
7.216
3.581
3.013
8.825
7.841
7.515
5.082
3.085
7.406
OG1
N
N
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
C5'
OP1
O3'
O3'
OP1
OP2
O3'
OP1
O3'
OP1
OP2
7ccq 1 P68431 95.92 1e-65 EM
2020-10-07 THR A:8 A:45 65.0 0.464 H -69.2 -49.8 65.0 0.464 0.0 DG
DG
DC
DT
DC
DC
DG
DA
DA
DT
DC
DG
DC
8.471
8.928
6.430
3.631
3.233
8.763
9.342
9.530
8.471
8.351
5.984
3.874
7.715
N
N
CG2
OG1
OG1
OG1
CG2
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP2
N2
N3
C4'
OP1
O3'
OP1
OP1
THR E:8 E:45 49.0 0.35 H -74.0 -45.9 49.0 0.35 0.0 DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DT
9.664
8.496
8.393
5.963
3.878
7.590
8.402
8.639
6.322
3.723
2.610
8.884
CG2
CG2
O
N
N
C
N
N
CG2
OG1
OG1
OG1
O2
C4'
OP1
O3'
OP1
OP2
C5'
OP1
O3'
O3'
OP1
OP2
7ccr 1 P68431 95.92 1e-65 EM
2020-10-07 THR A:8 A:45 61.0 0.436 H -68.5 -49.5 61.0 0.436 0.0 DG
DG
DT
DC
DT
DC
DG
DA
DA
DT
DC
DG
DC
9.686
9.775
9.896
5.524
3.631
4.590
9.339
9.527
8.395
8.059
5.857
3.806
8.084
N
N
CG2
CG2
CG2
OG1
CG2
CG2
O
O
N
N
CB
C5'
OP1
O2
O3'
C5'
OP2
N2
N3
O3'
OP1
O3'
OP1
OP1
THR E:8 E:45 50.0 0.357 H -73.6 -47.1 50.0 0.357 0.0 DA
DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DT
9.989
9.272
8.660
8.642
5.785
3.673
8.064
8.322
8.591
5.795
4.029
3.321
9.765
CG2
CG2
CG2
O
N
N
C
OG1
N
CG2
OG1
OG1
OG1
C2
C4'
C4'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
O3'
OP1
OP2
THR L:8 L:45 61.0 0.436 H -68.4 -49.5 61.0 0.436 0.0 DG
DG
DT
DC
DT
DC
DG
DA
DA
DT
DC
DG
DC
9.685
9.776
9.896
5.524
3.631
4.589
9.339
9.527
8.395
8.059
5.857
3.807
8.083
N
N
CG2
CG2
CG2
OG1
CG2
CG2
O
O
N
N
CB
C5'
OP1
O2
O3'
C5'
OP2
N2
N3
O3'
OP1
O3'
OP1
OP1
THR P:8 P:45 50.0 0.357 H -73.7 -47.1 50.0 0.357 0.0 DA
DT
DG
DT
DG
DT
DG
DA
DC
DT
DC
DC
DT
9.989
9.272
8.660
8.642
5.785
3.672
8.063
8.323
8.590
5.795
4.029
3.322
9.765
CG2
CG2
CG2
O
N
N
C
OG1
N
CG2
OG1
OG1
OG1
C2
C4'
C4'
OP1
O3'
OP1
OP2
OP1
OP1
O3'
O3'
OP1
OP2
6ftx 1 S4RAZ3 95.88 3e-65 EM
2018-08-08 THR A:8 A:45 34.0 0.243 S -98.0 -20.3 34.0 0.243 0.0 DA
DC
DT
DC
DG
DA
DT
DG
DT
DG
DT
DG
9.301
9.502
7.872
4.422
3.864
8.895
9.524
7.644
9.037
6.181
4.805
5.966
N
N
OG1
OG1
CB
CG2
OG1
O
O
N
N
CG2
C5'
OP1
O3'
O3'
OP1
OP1
O2
C4'
C5'
O3'
OP1
OP1
6z6p 5 A0A310TTQ1 95.88 3e-65 EM
2021-02-17 THR E:8 A:45 79.0 0.564 H -87.9 -42.4 58.0 0.414 0.15 K:P06897:0.15
DA
DC
DT
DC
DG
DA
DT
DG
DT
DC
DG
DT
DG
8.330
7.630
6.140
3.640
3.348
9.134
8.694
7.539
9.413
9.468
5.048
3.732
9.597
OG1
OG1
CG2
CG2
CB
OG1
O
O
O
N
N
N
C
C5'
OP1
O3'
O3'
OP1
OP1
O3'
C5'
OP1
O3'
O3'
OP1
OP2
3kwq 1 P84233 94.9 3e-65 X-RAY
2010-05-12 THR A:8 A:45 55.0 0.393 H -73.8 -26.8 55.0 0.393 0.0 DA
DG
DC
DT
DT
DG
DA
DT
DA
DT
DA
DA
DC
8.663
7.156
9.011
6.842
3.896
2.730
9.251
9.503
7.403
6.995
6.202
4.444
7.717
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP2
THR E:8 E:45 60.0 0.429 H -90.0 -26.4 55.0 0.393 0.036 C:Q6AZJ8:0.036
DT
DA
DT
DG
DA
DA
DG
DC
DG
DT
DT
DG
DA
9.607
7.479
7.397
7.003
5.260
7.846
8.816
7.336
8.376
6.829
3.670
3.060
9.469
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6jxd 5 P68431 95.88 4e-65 X-RAY
2020-01-15 THR E:8 E:45 57.0 0.407 H -80.7 -44.1 54.0 0.386 0.021 C:P04908:0.021
DT
DA
DT
DC
DG
DC
DT
DA
DG
DT
DA
DT
DG
9.790
8.200
8.114
5.170
3.262
7.449
9.710
7.989
7.573
7.470
3.677
2.937
9.650
CG2
CG2
O
N
N
CG2
OG1
N
N
CG2
CG2
OG1
OG1
O3'
C4'
OP1
O3'
OP1
OP1
O3'
C5'
OP1
O3'
O3'
OP1
OP2
7k6p 1 P84233 94.9 4e-65 EM
2021-02-10 THR A:9 A:45 53.0 0.379 H -83.4 -51.6 48.0 0.343 0.036 G:P06897:0.036
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.152
7.909
6.742
3.585
2.730
9.021
9.781
8.406
8.116
5.042
3.341
7.055
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
OP1
OP1
O3'
O3'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP1
THR E:9 E:45 57.0 0.407 H -70.6 -51.1 57.0 0.407 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
9.132
9.125
8.076
7.432
5.377
3.607
7.414
7.989
7.844
6.443
3.681
2.660
8.747
CG2
CG2
O
O
N
N
CG2
N
N
CG2
CG2
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
7k6q 1 P84233 94.9 4e-65 EM
2021-02-10 THR A:9 A:45 64.0 0.457 H -73.6 -50.4 58.0 0.414 0.043 G:P06897:0.043
DA
DC
DT
DC
DC
DG
DT
DG
DT
DG
DT
DG
8.144
7.815
6.683
3.540
2.681
9.102
9.637
8.449
8.184
5.279
3.663
7.108
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CB
OP1
OP1
O3'
O3'
OP1
OP2
O2
O3'
OP1
O3'
OP1
OP1
THR E:9 E:45 49.0 0.35 H -83.4 -54.9 46.0 0.329 0.021 C:P06897:0.021
DG
DA
DA
DT
DC
DG
DC
DG
DG
DC
DT
DC
DG
8.928
9.099
8.110
7.403
5.271
3.544
7.288
8.079
8.079
6.612
3.362
2.630
8.399
CG2
CG2
O
O
N
N
CG2
N
N
CG2
CG2
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP1
C5'
OP1
O3'
O3'
OP1
OP1
6y5d 1 Q71DI3 95.92 4e-65 EM
2020-09-23 THR A:8 A:46 59.0 0.421 H -68.7 -46.4 58.0 0.414 0.007 G:Q6FI13:0.007
DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
9.123
8.336
7.122
4.192
2.980
8.824
9.488
7.992
8.246
5.889
3.774
7.747
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
THR E:8 E:46 62.0 0.443 H -69.7 -45.1 62.0 0.443 0.0 DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.626
8.841
8.663
6.044
4.044
8.087
9.558
8.081
7.794
7.328
3.733
2.754
8.987
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
THR M:8 M:46 64.0 0.457 H -68.4 -46.5 64.0 0.457 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.845
8.010
7.493
4.683
3.416
9.145
9.840
8.297
8.571
5.466
3.432
7.894
N
N
CG2
OG1
OG1
OG1
CG2
CG2
O
N
N
CB
C4'
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
THR Q:8 Q:46 57.0 0.407 H -68.5 -46.4 57.0 0.407 0.0 DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.619
8.822
8.627
6.073
4.108
8.094
9.571
8.062
7.684
7.455
3.725
2.779
8.974
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
5mlu 1 P84233 95.88 8e-65 X-RAY
2017-05-10 THR A:7 A:45 58.0 0.414 H -77.0 -29.3 58.0 0.414 0.0 DG
DA
DT
DC
DG
HOH
8.084
7.887
7.843
5.584
3.648
6.593
N
O
O
N
N
O
OP1
O3'
OP1
O3'
OP1
O
THR E:7 E:45 58.0 0.414 H -72.0 -54.0 58.0 0.414 0.0 DT
DG
DT
DG
DT
DG
DT
DA
DC
DT
DC
DG
DA
HOH
9.562
8.479
8.510
5.315
3.392
7.699
9.350
7.676
8.431
6.900
3.655
2.470
9.256
8.500
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N
O3'
C4'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O
6z6p 9 P84233 95.88 8e-65 EM
2021-02-17 THR I:7 E:45 41.0 0.293 H -71.0 -60.6 41.0 0.293 0.0 DG
DA
DA
DT
DC
DC
DG
DC
DG
DG
DC
DT
DG
8.010
8.148
7.057
7.583
9.478
5.699
3.905
9.070
8.404
8.586
6.639
3.870
3.407
CG2
CG2
CG2
O
N
N
CB
CB
OG1
N
CG2
OG1
OG1
N2
O3'
C5'
OP1
O3'
O3'
OP1
OP2
OP1
OP1
O3'
O3'
OP1
6ftx 5 P02302 95.88 1e-64 EM
2018-08-08 THR E:20 E:45 43.0 0.307 -103.6 -36.7 43.0 0.307 0.0 DC
DG
DC
DG
DG
DG
6.940
4.582
6.720
9.861
7.588
8.512
N
N
CG2
N
N
N
O3'
OP1
OP1
O3'
OP1
OP1
6y5e 1 Q71DI3 95.83 8e-64 EM
2020-09-23 THR A:8 A:46 58.0 0.414 H -68.5 -46.3 58.0 0.414 0.0 DA
DC
DT
DC
DC
DT
DT
DG
DT
DG
DT
DG
8.842
8.138
7.075
3.945
2.733
8.447
9.686
8.295
8.474
5.983
3.947
7.820
N
N
CG2
CG2
OG1
OG1
CG2
CG2
O
N
N
CB
C5'
OP1
O3'
O3'
OP1
OP2
O3'
C5'
OP1
O3'
OP1
OP1
THR E:8 E:46 59.0 0.421 H -69.5 -45.2 59.0 0.421 0.0 DG
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DC
9.455
8.425
8.303
5.896
3.823
7.733
9.771
8.357
8.049
7.484
3.859
2.702
9.098
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
C4'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6ke9 1 P68431 95.83 2e-63 X-RAY
2020-04-22 THR A:6 A:45 59.0 0.421 H -69.1 -54.3 59.0 0.421 0.0 DG
DG
DG
DG
DT
DG
DA
DC
DC
DT
DA
DA
DC
8.190
6.344
7.916
7.100
3.824
3.003
9.342
9.177
8.344
8.308
5.178
3.303
7.773
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O2
O3'
OP1
O3'
OP1
OP2
THR E:6 E:45 56.0 0.4 H -88.2 -53.4 56.0 0.4 0.0 DA
DG
DG
DG
DT
DT
DC
DT
DA
DA
DA
DG
DA
9.782
8.642
7.787
6.232
3.789
7.122
8.474
7.320
9.886
7.159
3.641
2.693
8.940
CG2
CG2
O
N
N
CB
OG1
OG1
N
CG2
CG2
OG1
OG1
N3
C5'
OP1
O3'
OP1
OP1
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6l9h 1 P68431 95.83 2e-63 X-RAY
2020-04-22 THR A:6 A:45 61.0 0.436 H -102.3 -37.5 61.0 0.436 0.0 DG
DG
DG
DG
DT
DG
DA
DC
DC
DT
DA
DA
DC
8.424
6.742
7.889
7.475
3.735
3.231
9.330
9.324
7.877
8.043
5.093
3.152
7.746
OG1
OG1
N
CG2
CG2
CG2
OG1
CG2
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
O3'
OP1
O3'
OP1
OP2
THR E:6 E:45 56.0 0.4 S -118.1 -37.1 54.0 0.386 0.014 C:P04908:0.014
DA
DG
DG
DG
DT
DT
DC
DT
DA
DA
DA
DG
DA
9.284
8.554
7.861
5.434
3.527
7.620
8.466
7.308
9.803
7.470
3.519
3.081
8.631
CG2
O
O
N
N
C
OG1
OG1
OG1
CG2
CG2
OG1
OG1
N3
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
6le9 1 P68431 95.83 2e-63 X-RAY
2020-04-22 THR A:6 A:45 58.0 0.414 H -53.8 -35.9 58.0 0.414 0.0 DC
DT
DA
DA
DA
DG
DA
DA
DG
DG
DG
DT
DT
8.771
7.053
8.030
7.421
3.518
3.156
9.264
8.788
7.470
8.037
5.545
3.745
7.554
OG1
OG1
N
CG2
CG2
OG1
OG1
CG2
O
O
N
N
CG2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
O3'
C4'
OP1
O3'
OP1
OP1
THR E:6 E:45 61.0 0.436 S -139.0 -35.1 61.0 0.436 0.0 DC
DT
DA
DA
DC
DG
DG
DG
DG
DT
DG
DA
8.791
7.759
5.328
3.482
7.621
8.284
7.555
9.314
7.189
3.810
3.374
9.129
O
O
N
N
C
OG1
OG1
OG1
CG2
CG2
CG2
OG1
C5'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP2
4x23 3 P02299 96.77 7e-62 X-RAY
2014-12-10 THR C:6 A:45 78.0 0.557 H -75.2 -43.4 72.0 0.514 0.043 I:P84051:0.043
DT
DA
DC
DT
DC
DC
DG
DG
DT
DG
DT
DG
9.262
7.228
7.313
7.274
3.442
2.802
8.378
9.219
8.990
5.124
3.366
7.822
OG1
OG1
N
CG2
CG2
OG1
OG1
O
O
N
N
C
O3'
OP1
OP1
O3'
O3'
OP1
OP1
O3'
OP1
O3'
OP1
OP2
THR G:6 E:45 63.0 0.45 H -74.4 -43.6 63.0 0.45 0.0 DG
DA
DA
DT
DC
DG
DC
DG
DG
DG
DC
DT
DC
DG
9.436
9.486
8.752
8.539
5.002
3.091
7.380
8.432
7.457
8.145
7.232
3.590
2.684
8.137
CG2
CG2
O
O
N
N
C
OG1
OG1
N
CG2
CG2
OG1
OG1
N2
O3'
O3'
OP1
O3'
OP1
OP2
O3'
OP1
OP1
O3'
O3'
OP1
OP1
THR O:6 K:45 69.0 0.493 H -74.7 -44.0 NA NA NA
THR S:6 O:45 47.0 0.336 H -74.8 -43.5 NA NA NA
2p5b 2 P84239 95.24 2e-07 X-RAY
2007-06-12 THR C:20 NA:NA DO NA DO DO DO NA NA NA
THR D:20 NA:NA DO NA DO DO DO NA NA NA
2pxj 2 ? 95.24 2e-07 X-RAY
2007-06-12 THR C:20 NA:NA DO NA DO DO DO NA NA NA
THR D:20 NA:NA DO NA DO DO DO NA NA NA

AlphaFold DB

Entity Residue Monomer View
ID Entity Uniprot Identity Evalue Name Label Auth ASA rASA SS φ ψ
af-p84243-f1 1 P84243 100.0 2e-96 THR A:46 A:46 56.0 0.4 H -63.5 -44.0
af-q71di3-f1 1 Q71DI3 97.06 4e-94 THR A:46 A:46 57.0 0.407 H -63.1 -44.9
af-p68431-f1 1 P68431 96.32 3e-93 THR A:46 A:46 56.0 0.4 H -63.1 -44.3
af-q16695-f1 1 Q16695 93.38 3e-91 THR A:46 A:46 58.0 0.414 H -64.1 -42.3
af-q5tec6-f1 1 Q5TEC6 94.12 4e-91 THR A:46 A:46 57.0 0.407 H -65.0 -43.4
af-q6nxt2-f1 1 Q6NXT2 95.59 2e-90 THR A:45 A:45 59.0 0.421 H -62.9 -43.6
af-p0dpk5-f1 1 P0DPK5 82.35 3e-78 THR A:46 A:46 53.0 0.379 H -63.1 -44.4
af-p0dpk2-f1 1 P0DPK2 82.09 6e-77 THR A:46 A:46 61.0 0.436 H -62.5 -43.6