Variant

Genome Chromosome Position VCF ID Ref Alt mRNA Change mRNA Info
GRCh37 chr12 25378664 . C A CCDS8702.1:NM_004985.3:c.334Gtc>Ttc_NP_004976.2:p.112V>F Homo sapiens Kirsten rat sarcoma viral oncogene homolog (KRAS), transcript variant a, 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)
6mqn 1 P01116 95.86 3e-120 X-RAY
 2019-07-31 VAL A:112 A:112 0.0 0.0 E -132.5 133.9 0.0 0.0 0.0 HOH
 4.764
 HG23
 O
VAL B:112 B:112 0.0 0.0 E -131.3 132.0 NA NA NA
VAL C:112 C:112 0.0 0.0 E -133.6 135.5 NA NA NA
5xco 1 P01116 95.86 3e-119 X-RAY
 2017-05-24 VAL A:114 A:112 0.0 0.0 E -129.5 133.8 0.0 0.0 0.0 HOH
 4.988
 N
 O
6ob3 1 P01116 95.86 4e-119 X-RAY
 2019-10-16 VAL A:113 A:112 0.0 0.0 E -133.0 130.9 0.0 0.0 0.0 HOH
 5.049
 N
 O
VAL C:113 C:112 0.0 0.0 E -137.1 128.8 NA NA NA
6xgv 1 P01116 95.86 4e-119 X-RAY
 2021-01-13 VAL A:113 A:112 0.0 0.0 E -130.8 131.6 0.0 0.0 0.0 HOH
 7.439
 CG2
 O
7kfz 1 P01116 95.86 4e-119 EM
 2021-03-31 VAL A:113 A:112 0.0 0.0 E -143.4 112.1 0.0 0.0 0.0
VAL C:113 C:112 0.0 0.0 E -142.4 129.4 0.0 0.0 0.0
6gj6 1 P01116 95.86 4e-119 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -135.2 133.8 0.0 0.0 0.0 HOH
 4.932
 N
 O
6gj7 1 P01116 95.86 4e-119 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -133.7 130.7 0.0 0.0 0.0 HOH
 4.873
 N
 O
6quv 1 P01116 95.86 4e-119 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -133.7 131.2 0.0 0.0 0.0 HOH
 5.039
 N
 O
VAL B:113 B:112 0.0 0.0 E -135.1 132.4 0.0 0.0 0.0 HOH
 5.097
 N
 O
6quw 1 P01116 95.86 4e-119 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -134.6 129.2 0.0 0.0 0.0 HOH
 5.012
 N
 O
VAL B:113 B:112 0.0 0.0 E -135.1 130.5 0.0 0.0 0.0 HOH
 5.017
 N
 O
6qux 1 P01116 95.86 4e-119 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -135.0 130.0 0.0 0.0 0.0 HOH
 4.997
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -139.5 130.8 0.0 0.0 0.0 HOH
 4.877
 HG23
 O
6zli 1 P01116 95.86 4e-119 X-RAY
 2020-08-19 VAL A:113 A:112 0.0 0.0 E -132.5 130.9 0.0 0.0 0.0 HOH
 4.927
 N
 O
VAL B:113 B:112 0.0 0.0 E -132.4 130.6 NA NA NA
7aca 1 P01116 95.86 4e-119 X-RAY
 2020-11-18 VAL A:113 A:112 0.0 0.0 E -133.2 128.9 0.0 0.0 0.0 HOH
 4.918
 N
 O
VAL B:113 B:112 0.0 0.0 E -133.4 128.6 NA NA NA
VAL C:113 C:112 0.0 0.0 E -133.7 133.7 NA NA NA
VAL D:113 D:112 1.0 0.006 E -132.9 128.9 1.0 0.006 0.0 HOH
 4.874
 N
 O
7acf 1 P01116 95.86 4e-119 X-RAY
 2020-11-18 VAL A:113 A:112 0.0 0.0 E -131.6 130.6 0.0 0.0 0.0 HOH
 4.867
 N
 O
VAL B:113 B:112 0.0 0.0 E -132.1 130.6 0.0 0.0 0.0 HOH
 4.857
 N
 O
VAL C:113 C:112 0.0 0.0 E -132.6 129.8 NA NA NA
VAL D:113 D:112 0.0 0.0 E -131.6 129.9 NA NA NA
7ach 1 P01116 95.86 4e-119 X-RAY
 2020-11-18 VAL A:113 A:112 0.0 0.0 E -133.7 129.1 0.0 0.0 0.0 HOH
 5.043
 N
 O
VAL B:113 B:112 0.0 0.0 E -134.4 129.8 0.0 0.0 0.0 HOH
 5.034
 N
 O
7acq 1 P01116 95.86 4e-119 X-RAY
 2020-11-18 VAL A:113 A:112 0.0 0.0 E -134.7 131.4 0.0 0.0 0.0 HOH
 5.043
 N
 O
VAL B:113 B:112 0.0 0.0 E -134.1 133.5 0.0 0.0 0.0 HOH
 5.070
 N
 O
VAL C:113 C:112 0.0 0.0 E -132.4 134.7 0.0 0.0 0.0 HOH
 5.030
 N
 O
7ew9 1 P01116 95.86 4e-119 X-RAY
 2021-12-29 VAL A:113 A:112 0.0 0.0 E -132.9 130.4 0.0 0.0 0.0 HOH
 4.994
 N
 O
VAL B:113 B:112 0.0 0.0 E -135.5 128.5 NA NA NA
VAL C:113 C:112 0.0 0.0 E -132.2 134.7 NA NA NA
7ewa 1 P01116 95.86 4e-119 X-RAY
 2021-12-29 VAL A:113 A:112 0.0 0.0 E -130.2 135.4 0.0 0.0 0.0 HOH
 4.927
 N
 O
VAL B:113 B:112 0.0 0.0 E -135.1 131.9 NA NA NA
VAL C:113 C:112 0.0 0.0 E -135.5 132.9 NA NA NA
7ewb 1 P01116 95.86 4e-119 X-RAY
 2021-12-29 VAL A:113 A:112 0.0 0.0 E -131.3 135.5 0.0 0.0 0.0 HOH
 5.186
 N
 O
VAL B:113 B:112 0.0 0.0 E -134.5 130.6 NA NA NA
VAL C:113 C:112 0.0 0.0 E -132.5 129.4 NA NA NA
6quu 1 P01116 95.86 4e-119 X-RAY
 2019-07-31 VAL A:130 A:112 0.0 0.0 E -135.5 130.9 0.0 0.0 0.0 HOH
 5.050
 HG23
 O
VAL B:130 B:112 0.0 0.0 E -135.6 130.9 NA NA NA
6gj8 1 P01116 96.41 5e-119 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -130.3 133.0 0.0 0.0 0.0 HOH
 4.926
 N
 O
4tqa 1 P01116 96.41 5e-119 X-RAY
 2015-06-10 VAL A:113 A:112 0.0 0.0 E -131.9 134.0 0.0 0.0 0.0 HOH
 4.973
 N
 O
VAL B:113 B:112 0.0 0.0 E -130.5 134.1 NA NA NA
4ql3 1 P01116 95.86 5e-119 X-RAY
 2015-06-10 VAL A:113 A:112 0.0 0.0 E -131.7 133.1 0.0 0.0 0.0 HOH
 4.852
 HG23
 O
6cu6 1 P01116 95.86 5e-119 X-RAY
 2019-09-25 VAL A:113 A:112 0.0 0.0 E -131.0 132.6 0.0 0.0 0.0 HOH
 5.054
 N
 O
VAL B:113 B:112 0.0 0.0 E -130.2 134.0 NA NA NA
VAL C:113 C:112 0.0 0.0 E -133.3 133.8 NA NA NA
5us4 1 P01116 95.86 7e-119 X-RAY
 2017-03-22 VAL A:132 A:112 0.0 0.0 E -131.4 134.6 0.0 0.0 0.0 HOH
 4.937
 N
 O
VAL B:132 B:112 0.0 0.0 E -130.4 135.5 NA NA NA
5usj 1 P01116 95.86 7e-119 X-RAY
 2017-03-22 VAL A:132 A:112 0.0 0.0 E -134.6 135.9 0.0 0.0 0.0 HOH
 5.004
 N
 O
VAL B:132 B:112 0.0 0.0 E -131.6 136.0 NA NA NA
VAL C:132 C:112 0.0 0.0 E -130.2 134.4 NA NA NA
VAL D:132 D:112 0.0 0.0 E -132.2 136.5 NA NA NA
VAL E:132 E:112 0.0 0.0 E -134.7 136.1 NA NA NA
VAL F:132 F:112 0.0 0.0 E -132.2 131.1 NA NA NA
4l8g 1 P01116 95.86 8e-119 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -134.6 133.6 0.0 0.0 0.0 HOH
 4.990
 HG23
 O
4ldj 1 P01116 95.86 8e-119 X-RAY
 2014-06-04 VAL A:113 A:112 0.0 0.0 E -131.4 133.6 0.0 0.0 0.0 HOH
 4.902
 HG23
 O
4nmm 1 P01116 95.86 8e-119 X-RAY
 2014-06-04 VAL A:113 A:112 0.0 0.0 E -128.0 133.6 0.0 0.0 0.0 HOH
 4.742
 N
 O
7a1w 1 P01116-2 95.86 8e-119 X-RAY
 2021-10-13 VAL A:113 A:112 0.0 0.0 E -136.0 131.0 0.0 0.0 0.0 HOH
 5.219
 N
 O
7a1x 1 P01116 95.86 8e-119 X-RAY
 2021-10-13 VAL A:113 A:112 0.0 0.0 E -134.7 134.3 0.0 0.0 0.0 HOH
 4.945
 N
 O
7a1y 1 P01116 95.86 8e-119 X-RAY
 2021-10-13 VAL A:113 A:112 0.0 0.0 E -130.6 129.5 0.0 0.0 0.0 HOH
 4.932
 N
 O
7a47 1 P01116-2 95.86 8e-119 X-RAY
 2021-10-13 VAL A:113 A:112 0.0 0.0 E -131.7 135.7 0.0 0.0 0.0 HOH
 5.176
 N
 O
VAL B:113 C:112 0.0 0.0 E -132.0 134.9 NA NA NA
VAL C:113 E:112 0.0 0.0 E -132.4 135.9 NA NA NA
6gof 1 P01116 94.77 8e-119 X-RAY
 2019-02-06 VAL A:112 A:112 0.0 0.0 E -133.6 129.8 0.0 0.0 0.0 HOH
 4.923
 N
 O
7rov 1 P01116 96.41 9e-119 X-RAY
 2021-09-22 VAL A:113 A:112 0.0 0.0 E -135.2 135.9 0.0 0.0 0.0 HOH
 5.197
 N
 O
VAL B:113 B:112 0.0 0.0 E -130.4 135.1 NA NA NA
5vp7 1 P01116 95.27 9e-119 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -132.2 134.4 0.0 0.0 0.0 HOH
 4.900
 N
 O
VAL B:113 F:112 0.0 0.0 E -133.2 131.9 NA NA NA
5vpi 1 P01116 95.27 9e-119 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -128.8 135.4 0.0 0.0 0.0 HOH
 4.900
 N
 O
VAL B:113 B:112 0.0 0.0 E -127.5 135.5 NA NA NA
5vpy 1 P01116 95.27 9e-119 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -133.9 134.5 0.0 0.0 0.0 HOH
 4.977
 N
 O
VAL B:113 B:112 0.0 0.0 E -132.9 136.0 NA NA NA
5vpz 1 P01116 95.27 9e-119 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -128.6 135.9 0.0 0.0 0.0 HOH
 4.910
 N
 O
VAL B:113 B:112 0.0 0.0 E -127.9 137.2 NA NA NA
5vq0 1 P01116 95.27 9e-119 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -126.8 140.3 0.0 0.0 0.0 HOH
 4.788
 N
 O
VAL B:113 B:112 0.0 0.0 E -127.1 140.8 NA NA NA
5ufq 1 P01116 96.99 9e-119 X-RAY
 2017-08-02 VAL A:112 A:112 0.0 0.0 E -134.3 135.1 NA NA NA
VAL B:112 B:112 0.0 0.0 E -128.4 128.6 0.0 0.0 0.0 HOH
 5.464
 N
 O
6e6f 1 P01116 96.99 9e-119 X-RAY
 2019-07-31 VAL A:112 A:112 0.0 0.0 E -133.8 130.6 0.0 0.0 0.0
VAL B:112 B:112 0.0 0.0 E -137.8 107.8 NA NA NA
6e6g 1 P01116 96.99 9e-119 X-RAY
 2019-07-31 VAL A:112 A:112 0.0 0.0 E -136.6 135.8 0.0 0.0 0.0 HOH
 4.993
 N
 O
6ws4 1 P01116 95.27 1e-118 X-RAY
 2021-11-10 VAL A:113 A:112 0.0 0.0 E -128.2 135.1 0.0 0.0 0.0 HOH
 5.016
 N
 O
VAL B:113 B:112 0.0 0.0 E -130.0 135.7 NA NA NA
VAL C:113 C:112 0.0 0.0 E -130.1 137.5 NA NA NA
VAL D:113 D:112 0.0 0.0 E -128.4 138.0 NA NA NA
6mqg 1 P01116 95.81 1e-118 X-RAY
 2019-07-31 VAL A:110 A:112 0.0 0.0 E -133.0 134.7 0.0 0.0 0.0 HOH
 4.959
 HG22
 O
5kyk 1 P01116 96.41 1e-118 X-RAY
 2017-04-12 VAL A:113 A:112 0.0 0.0 E -131.1 133.7 0.0 0.0 0.0 HOH
 9.038
 CG2
 O
VAL B:113 B:112 0.0 0.0 E -132.8 134.3 NA NA NA
VAL C:113 C:112 0.0 0.0 E -133.0 133.6 NA NA NA
5v71 1 P01116 96.41 1e-118 X-RAY
 2017-08-23 VAL A:113 A:112 0.0 0.0 E -134.7 133.8 0.0 0.0 0.0 HOH
 5.129
 N
 O
VAL B:113 B:112 0.0 0.0 E -124.5 130.3 NA NA NA
VAL C:113 C:112 0.0 0.0 E -131.1 139.2 NA NA NA
VAL D:113 D:112 0.0 0.0 E -132.9 137.9 NA NA NA
VAL E:113 E:112 0.0 0.0 E -132.3 137.3 NA NA NA
VAL F:113 F:112 0.0 0.0 E -124.3 130.4 NA NA NA
5v9l 1 P01116 96.41 1e-118 X-RAY
 2017-08-23 VAL A:113 A:112 0.0 0.0 E -137.7 133.2 0.0 0.0 0.0 HOH
 4.883
 N
 O
VAL B:113 B:112 0.0 0.0 E -131.4 130.7 NA NA NA
VAL C:113 C:112 0.0 0.0 E -136.3 133.3 NA NA NA
5v9o 1 P01116 96.41 1e-118 X-RAY
 2017-08-23 VAL A:113 A:112 0.0 0.0 E -130.7 136.0 0.0 0.0 0.0 HOH
 5.000
 N
 O
7eyx 1 P01116-2 95.83 2e-118 X-RAY
 2021-06-16 VAL A:112 A:112 0.0 0.0 E -135.2 137.3 0.0 0.0 0.0 HOH
 5.016
 HG22
 O
7f0w 1 P01116-2 95.83 2e-118 X-RAY
 2021-06-23 VAL A:112 A:112 0.0 0.0 E -132.3 134.6 0.0 0.0 0.0 HOH
 4.881
 HG23
 O
4epr 1 P01116 95.27 3e-118 X-RAY
 2012-05-23 VAL A:113 A:112 0.0 0.0 E -126.6 137.2 0.0 0.0 0.0 HOH
 4.973
 N
 O
6gj5 1 P01116 95.27 3e-118 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -135.0 131.6 0.0 0.0 0.0 HOH
 5.100
 N
 O
VAL B:113 B:112 0.0 0.0 E -129.2 133.4 NA NA NA
6zl5 1 P01116 95.27 3e-118 X-RAY
 2020-08-19 VAL A:113 A:112 0.0 0.0 E -133.8 132.1 0.0 0.0 0.0 HOH
 4.952
 N
 O
6w4e 2 P01116 96.39 9e-118 NMR
 2020-04-15 VAL C:112 B:112 1.0 0.006 E -133.3 142.4 1.0 0.006 0.0
VAL D:112 C:112 0.0 0.0 E -142.4 132.0 0.0 0.0 0.0
7rsc 1 P01116 96.39 9e-118 NMR
 2021-09-22 VAL A:112 A:112 0.0 0.0 E -129.9 131.3 0.0 0.0 0.0
VAL B:112 B:112 0.0 0.0 E -134.8 135.1 0.0 0.0 0.0
7rse 1 P01116 96.39 9e-118 NMR
 2021-09-22 VAL A:112 A:112 0.0 0.0 E -136.5 131.9 0.0 0.0 0.0
VAL B:112 B:112 4.0 0.026 E -135.6 131.2 4.0 0.026 0.0
4dsn 1 P01116 96.39 1e-117 X-RAY
 2012-04-25 VAL A:113 A:112 0.0 0.0 E -133.7 130.6 0.0 0.0 0.0 HOH
 5.169
 N
 O
4dso 1 P01116 96.39 1e-117 X-RAY
 2012-04-04 VAL A:113 A:112 0.0 0.0 E -132.2 132.3 0.0 0.0 0.0 HOH
 4.935
 N
 O
4dst 1 P01116 96.39 1e-117 X-RAY
 2012-04-04 VAL A:113 A:112 0.0 0.0 E -129.3 131.7 0.0 0.0 0.0 ACT
HOH
 7.715
5.023
 N
N
 O
O
4dsu 1 P01116 96.39 1e-117 X-RAY
 2012-04-04 VAL A:113 A:112 0.0 0.0 E -132.1 133.5 0.0 0.0 0.0 HOH
 5.004
 N
 O
5ocg 1 P01116 96.39 1e-117 X-RAY
 2018-08-22 VAL A:113 A:112 0.0 0.0 E -130.6 129.3 0.0 0.0 0.0 HOH
 5.039
 N
 O
6w4f 2 P01116 96.39 2e-117 NMR
 2020-04-29 VAL C:111 B:112 11.0 0.071 E -95.5 142.7 11.0 0.071 0.0
VAL D:111 C:112 0.0 0.0 E -95.1 124.0 0.0 0.0 0.0
6wgn 1 P01116 94.08 1e-116 X-RAY
 2020-10-14 VAL A:112 A:112 0.0 0.0 E -130.1 132.2 0.0 0.0 0.0 HOH
 4.919
 N
 O
VAL B:112 B:112 0.0 0.0 E -132.3 133.7 NA NA NA
VAL C:112 C:112 0.0 0.0 E -131.8 135.0 NA NA NA
7rpz 1 P01116-2 94.08 1e-116 X-RAY
 2021-12-22 VAL A:113 A:112 0.0 0.0 E -133.6 132.8 0.0 0.0 0.0 HOH
 4.985
 N
 O
7rt1 1 P01116-2 94.08 1e-116 X-RAY
 2021-12-22 VAL A:113 A:112 0.0 0.0 E -133.4 133.1 0.0 0.0 0.0 HOH
 4.956
 N
 O
7rt2 1 P01116-2 94.08 1e-116 X-RAY
 2021-12-22 VAL A:113 A:112 0.0 0.0 E -134.1 134.8 0.0 0.0 0.0 HOH
 5.435
 N
 O
7rt3 1 P01116-2 94.08 1e-116 X-RAY
 2021-12-22 VAL A:113 A:112 0.0 0.0 E -134.1 131.7 0.0 0.0 0.0 HOH
 5.001
 N
 O
7rt4 1 P01116-2 94.08 1e-116 X-RAY
 2021-12-22 VAL A:113 A:112 0.0 0.0 E -131.5 140.9 0.0 0.0 0.0 HOH
 5.235
 N
 O
7rt5 1 P01116-2 94.08 1e-116 X-RAY
 2021-12-22 VAL A:113 A:112 0.0 0.0 E -132.8 132.9 0.0 0.0 0.0 HOH
 4.971
 N
 O
6epl 1 P01116 93.49 4e-116 X-RAY
 2019-02-06 VAL A:113 R:112 0.0 0.0 E -135.5 145.6 0.0 0.0 0.0 HOH
 4.893
 N
 O
6epm 1 P01116 93.49 4e-116 X-RAY
 2019-02-06 VAL A:113 R:112 0.0 0.0 E -137.9 144.7 0.0 0.0 0.0 HOH
 4.752
 N
 O
6epn 1 P01116 93.49 4e-116 X-RAY
 2019-02-06 VAL A:113 R:112 0.0 0.0 E -132.3 142.4 0.0 0.0 0.0 HOH
 4.963
 N
 O
6epo 1 P01116 93.49 4e-116 X-RAY
 2019-02-06 VAL A:113 R:112 0.0 0.0 E -132.1 146.0 0.0 0.0 0.0 HOH
 4.965
 N
 O
6epp 1 P01116 93.49 4e-116 X-RAY
 2019-02-06 VAL A:113 R:112 0.0 0.0 E -136.5 146.0 0.0 0.0 0.0 HOH
 4.909
 N
 O
6t5v 1 P01116 94.08 9e-116 X-RAY
 2020-02-19 VAL A:112 A:112 0.0 0.0 E -135.9 132.7 0.0 0.0 0.0 HOH
 5.010
 N
 O
6oim 1 P01116 94.08 1e-115 X-RAY
 2019-11-06 VAL A:126 A:112 0.0 0.0 E -131.7 132.2 0.0 0.0 0.0 HOH
 4.997
 N
 O
6p8w 1 P01116 94.08 1e-115 X-RAY
 2019-08-28 VAL A:126 A:112 0.0 0.0 E -134.8 128.3 0.0 0.0 0.0 HOH
 4.867
 N
 O
VAL B:126 B:112 0.0 0.0 E -134.6 128.1 NA NA NA
6p8x 1 P01116 94.08 1e-115 X-RAY
 2019-08-28 VAL A:126 A:112 0.0 0.0 E -132.8 139.5 0.0 0.0 0.0 HOH
 4.892
 N
 O
VAL B:126 B:112 0.0 0.0 E -133.7 138.0 NA NA NA
VAL C:126 C:112 0.0 0.0 E -131.5 135.0 NA NA NA
VAL D:126 D:112 0.0 0.0 E -136.5 130.8 NA NA NA
6p8y 1 P01116 94.08 1e-115 X-RAY
 2019-08-28 VAL A:126 A:112 0.0 0.0 E -131.7 131.6 0.0 0.0 0.0
VAL B:126 B:112 0.0 0.0 E -131.7 131.5 NA NA NA
6p8z 1 P01116 94.08 1e-115 X-RAY
 2019-08-28 VAL A:126 A:112 0.0 0.0 E -133.2 134.1 0.0 0.0 0.0 CA
HOH
 9.092
4.886
 N
N
 CA
O
VAL B:126 B:112 0.0 0.0 E -133.8 134.7 NA NA NA
6pgo 1 P01116 94.08 1e-115 X-RAY
 2019-12-25 VAL A:126 A:112 0.0 0.0 E -133.5 133.5 0.0 0.0 0.0 HOH
 5.071
 N
 O
VAL B:126 B:112 0.0 0.0 E -134.3 133.4 NA NA NA
6pgp 1 P01116 94.08 1e-115 X-RAY
 2019-12-25 VAL A:126 A:112 0.0 0.0 E -131.7 132.4 0.0 0.0 0.0 HOH
 4.868
 N
 O
VAL B:126 B:112 0.0 0.0 E -133.9 132.0 NA NA NA
4lrw 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -138.4 127.5 0.0 0.0 0.0 HOH
 5.188
 N
 O
VAL B:113 B:112 0.0 0.0 E -136.7 128.4 0.0 0.0 0.0 HOH
 5.109
 N
 O
4luc 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -132.2 134.3 0.0 0.0 0.0 CA
HOH
 8.523
4.827
 HA
HG23
 CA
O
VAL B:113 B:112 0.0 0.0 E -133.9 135.0 0.0 0.0 0.0 CA
HOH
 8.539
4.805
 HA
HG23
 CA
O
4lv6 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -132.5 132.6 0.0 0.0 0.0 CA
HOH
 8.591
4.903
 HA
HG23
 CA
O
VAL B:113 B:112 0.0 0.0 E -133.3 134.5 0.0 0.0 0.0 CA
HOH
 8.563
4.853
 HA
HG23
 CA
O
4lyf 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -131.7 135.6 0.0 0.0 0.0 HOH
 4.602
 HG21
 O
VAL B:113 B:112 0.0 0.0 E -128.9 133.2 0.0 0.0 0.0 HOH
 4.986
 HG23
 O
VAL C:113 C:112 0.0 0.0 E -136.2 134.9 0.0 0.0 0.0 HOH
 4.919
 HG23
 O
4lyh 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -135.5 135.4 0.0 0.0 0.0 HOH
 4.882
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -131.5 134.3 0.0 0.0 0.0 HOH
 4.932
 HG23
 O
VAL C:113 C:112 0.0 0.0 E -135.4 136.8 0.0 0.0 0.0 HOH
 4.986
 HG23
 O
4lyj 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -133.2 135.0 0.0 0.0 0.0 HOH
 5.908
 CG2
 O
4m1o 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -133.4 137.0 0.0 0.0 0.0 HOH
 4.956
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -132.2 134.5 NA NA NA
VAL C:113 C:112 0.0 0.0 E -137.5 134.0 NA NA NA
4m1s 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -133.5 135.2 0.0 0.0 0.0 HOH
 5.012
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -134.9 133.6 NA NA NA
VAL C:113 C:112 0.0 0.0 E -136.7 133.2 NA NA NA
4m1t 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -133.4 133.5 0.0 0.0 0.0 HOH
 5.003
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -133.8 133.4 NA NA NA
VAL C:113 C:112 0.0 0.0 E -135.9 134.2 NA NA NA
4m1w 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -134.4 134.4 0.0 0.0 0.0 HOH
 4.888
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -132.9 133.4 NA NA NA
VAL C:113 C:112 0.0 0.0 E -137.9 133.4 NA NA NA
4m1y 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -132.7 133.4 0.0 0.0 0.0 HOH
 4.947
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -131.4 134.0 NA NA NA
VAL C:113 C:112 0.0 0.0 E -134.7 135.3 NA NA NA
4m21 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -137.4 134.6 0.0 0.0 0.0 HOH
 4.962
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -133.5 138.1 NA NA NA
VAL C:113 C:112 0.0 0.0 E -134.1 134.9 NA NA NA
4m22 1 P01116 94.08 1e-115 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -136.8 133.6 0.0 0.0 0.0 HOH
 5.014
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -136.2 133.1 NA NA NA
VAL C:113 C:112 0.0 0.0 E -132.6 138.1 NA NA NA
5f2e 1 P01116 94.08 1e-115 X-RAY
 2016-01-13 VAL A:113 A:112 0.0 0.0 E -131.0 133.8 0.0 0.0 0.0 HOH
 4.936
 N
 O
5v6s 1 P01116 94.08 1e-115 X-RAY
 2017-06-28 VAL A:113 A:112 0.0 0.0 E -132.0 131.7 0.0 0.0 0.0 HOH
 5.057
 HG23
 O
5v6v 1 P01116 94.08 1e-115 X-RAY
 2017-06-28 VAL A:113 A:112 0.0 0.0 E -130.0 131.1 0.0 0.0 0.0 CA
HOH
 8.582
4.779
 HA
HG23
 CA
O
VAL B:113 B:112 0.0 0.0 E -128.2 135.7 0.0 0.0 0.0 CA
HOH
 8.632
5.009
 HA
N
 CA
O
5v9u 1 P01116 94.08 1e-115 X-RAY
 2018-02-07 VAL A:113 A:112 0.0 0.0 E -129.2 131.2 0.0 0.0 0.0 CA
HOH
 8.976
4.921
 N
N
 CA
O
VAL B:113 B:112 0.0 0.0 E -132.5 127.3 NA NA NA
5yxz 1 P01116 94.08 1e-115 X-RAY
 2018-04-18 VAL A:113 A:112 0.0 0.0 E -132.7 131.4 0.0 0.0 0.0 HOH
 4.968
 N
 O
5yy1 1 P01116 94.08 1e-115 X-RAY
 2018-04-18 VAL A:113 A:112 0.0 0.0 E -133.6 133.6 0.0 0.0 0.0 EDO
HOH
 7.516
5.025
 CG2
N
 C2
O
6ark 1 P01116 94.08 1e-115 X-RAY
 2018-01-31 VAL A:113 A:112 0.0 0.0 E -135.9 129.6 0.0 0.0 0.0 HOH
 4.801
 HG23
 O
6b0v 1 P01116 94.08 1e-115 X-RAY
 2018-05-16 VAL A:113 A:112 0.0 0.0 E -130.9 133.2 0.0 0.0 0.0 CA
HOH
 8.925
4.871
 N
N
 CA
O
VAL B:113 B:112 0.0 0.0 E -134.4 132.8 NA NA NA
6b0y 1 P01116 94.08 1e-115 X-RAY
 2018-05-16 VAL A:113 A:112 0.0 0.0 E -135.1 131.3 0.0 0.0 0.0 CA
HOH
 8.995
4.940
 N
N
 CA
O
VAL B:113 B:112 0.0 0.0 E -128.4 133.5 NA NA NA
6n2j 1 P01116 94.08 1e-115 X-RAY
 2018-12-12 VAL A:113 A:112 0.0 0.0 E -131.1 131.9 0.0 0.0 0.0 HOH
 5.051
 N
 O
6n2k 1 P01116 94.08 1e-115 X-RAY
 2018-12-12 VAL A:113 A:112 0.0 0.0 E -131.3 133.5 0.0 0.0 0.0 HOH
 4.980
 N
 O
6tam 1 P01116 94.08 1e-115 X-RAY
 2020-04-08 VAL A:113 A:112 0.0 0.0 E -133.5 133.0 0.0 0.0 0.0 HOH
 4.956
 N
 O
6tan 1 P01116 94.08 1e-115 X-RAY
 2020-04-08 VAL A:113 A:112 0.0 0.0 E -132.6 130.6 0.0 0.0 0.0 HOH
 4.961
 N
 O
6usx 1 P01116 94.08 1e-115 X-RAY
 2020-04-22 VAL A:113 A:112 0.0 0.0 E -135.1 133.7 0.0 0.0 0.0 HOH
 5.012
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -130.2 131.9 NA NA NA
6usz 1 P01116 94.08 1e-115 X-RAY
 2020-04-22 VAL A:113 A:112 0.0 0.0 E -134.3 135.5 0.0 0.0 0.0 HOH
 5.000
 N
 O
6ut0 1 P01116 94.08 1e-115 X-RAY
 2020-04-22 VAL A:113 A:112 0.0 0.0 E -132.1 135.7 0.0 0.0 0.0 HOH
 4.987
 HG21
 O
VAL B:113 B:112 0.0 0.0 E -129.6 133.0 NA NA NA
VAL C:113 C:112 0.0 0.0 E -130.7 131.1 NA NA NA
VAL D:113 D:112 0.0 0.0 E -132.1 128.3 NA NA NA
6t5u 1 A0A024RAV5 94.61 2e-115 X-RAY
 2020-02-19 VAL A:113 A:112 0.0 0.0 E -139.2 135.3 0.0 0.0 0.0 HOH
 5.034
 N
 O
VAL B:113 B:112 0.0 0.0 E -127.6 140.1 NA NA NA
6t5b 1 P01116 93.49 3e-115 X-RAY
 2020-02-26 VAL A:113 A:112 0.0 0.0 E -132.2 132.2 0.0 0.0 0.0 HOH
 4.962
 N
 O
6mqt 1 P01112 93.37 5e-115 X-RAY
 2020-04-15 VAL A:113 A:112 0.0 0.0 E -134.4 133.1 0.0 0.0 0.0 HOH
 4.977
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -134.4 135.6 NA NA NA
VAL C:113 C:112 0.0 0.0 E -133.5 136.4 NA NA NA
VAL D:113 D:112 0.0 0.0 E -134.6 132.6 NA NA NA
VAL E:113 E:112 0.0 0.0 E -133.8 133.1 NA NA NA
VAL F:113 F:112 0.0 0.0 E -133.7 133.3 NA NA NA
VAL G:113 G:112 0.0 0.0 E -135.9 132.3 NA NA NA
VAL H:113 H:112 0.0 0.0 E -135.4 134.8 NA NA NA
6dzh 1 P01112 93.37 2e-114 X-RAY
 2019-07-10 VAL A:112 A:112 0.0 0.0 E -132.2 129.8 0.0 0.0 0.0 HOH
 4.894
 N
 O
VAL B:112 B:112 0.0 0.0 E -135.8 139.7 NA NA NA
VAL C:112 C:112 0.0 0.0 E -132.9 137.8 NA NA NA
6e6c 1 P01112 93.37 2e-114 X-RAY
 2019-07-31 VAL A:112 A:112 0.0 0.0 E -133.4 134.5 0.0 0.0 0.0 HOH
 4.941
 N
 O
6e6p 1 P01112 93.37 2e-114 X-RAY
 2019-07-31 VAL A:112 A:112 0.0 0.0 E -131.0 141.0 0.0 0.0 0.0 GOL
HOH
 8.046
4.786
 CA
N
 O3
O
VAL B:112 B:112 0.0 0.0 E -133.7 136.6 NA NA NA
VAL C:112 C:112 0.0 0.0 E -134.6 135.6 NA NA NA
1agp 1 P01112 93.37 2e-114 X-RAY
 1994-04-30 VAL A:112 A:112 0.0 0.0 E -128.0 138.9 0.0 0.0 0.0 HOH
 8.442
 CG2
 H2
6zj0 1 P01112 93.37 2e-114 X-RAY
 2020-08-19 VAL A:113 A:112 0.0 0.0 E -132.1 133.7 0.0 0.0 0.0 HOH
 4.904
 HG23
 O
421p 1 P01112 93.37 2e-114 X-RAY
 1994-01-31 VAL A:112 A:112 0.0 0.0 E -144.8 138.4 0.0 0.0 0.0 HOH
 7.148
 N
 O
1clu 1 P01112 93.37 2e-114 X-RAY
 1999-05-28 VAL A:112 A:112 0.0 0.0 E -126.5 133.9 0.0 0.0 0.0 HOH
 4.989
 N
 O
1jai 1 P01112 93.37 2e-114 X-RAY
 1997-07-23 VAL A:112 A:112 0.0 0.0 E -125.0 138.1 0.0 0.0 0.0 HOH
 4.861
 N
 O
1plj 1 P01112 93.37 2e-114 X-RAY
 1994-07-31 VAL A:112 A:112 0.0 0.0 E -132.1 121.3 0.0 0.0 0.0
1pll 1 P01112 93.37 2e-114 X-RAY
 1994-07-31 VAL A:112 A:112 13.0 0.084 -159.4 150.6 13.0 0.084 0.0
821p 1 P01112 93.37 2e-114 X-RAY
 1994-01-31 VAL A:112 A:112 0.0 0.0 E -128.8 137.4 0.0 0.0 0.0 HOH
 4.354
 N
 H1
4l9s 1 P01112 93.37 3e-114 X-RAY
 2013-11-27 VAL A:117 A:112 0.0 0.0 E -128.5 133.7 0.0 0.0 0.0 NA
HOH
 8.630
4.922
 HA
N
 NA
O
4l9w 1 P01112 93.37 3e-114 X-RAY
 2013-11-27 VAL A:117 A:112 0.0 0.0 E -133.7 134.7 0.0 0.0 0.0 HOH
 5.030
 N
 O
7l0g 1 P01112 93.37 3e-114 X-RAY
 2021-03-24 VAL A:113 A:112 0.0 0.0 E -135.6 132.5 0.0 0.0 0.0 HOH
 4.872
 N
 O
VAL B:113 B:112 0.0 0.0 E -135.9 133.4 NA NA NA
VAL E:113 E:112 0.0 0.0 E -134.3 133.8 NA NA NA
VAL G:113 G:112 0.0 0.0 E -135.6 134.0 NA NA NA
1jah 1 P01112 93.37 7e-114 X-RAY
 1997-07-23 VAL A:112 A:112 0.0 0.0 E -125.6 136.3 0.0 0.0 0.0 HOH
 4.953
 N
 O
1plk 1 P01112 93.37 7e-114 X-RAY
 1994-07-31 VAL A:112 NA:NA DO NA DO DO DO NA NA NA
6e6h 1 P01111 93.37 7e-114 X-RAY
 2019-07-31 VAL A:112 A:112 0.0 0.0 E -129.1 134.4 0.0 0.0 0.0 HOH
 5.085
 N
 O
6ms9 1 P01116 96.45 6e-112 X-RAY
 2020-04-15 VAL A:112 C:112 0.0 0.0 E -131.0 135.9 0.0 0.0 0.0 HOH
 4.862
 HG23
 O
VAL B:112 B:112 0.0 0.0 E -132.1 134.4 NA NA NA
VAL C:112 A:112 0.0 0.0 E -131.5 132.2 NA NA NA
6v5l 1 P01116 96.45 6e-112 NMR
 2019-12-18 VAL A:112 A:112 0.0 0.0 E -132.9 125.8 0.0 0.0 0.0
7lgi 1 P01116 96.45 6e-112 NMR
 2021-07-21 VAL A:112 A:112 0.0 0.0 E -142.9 135.5 0.0 0.0 0.0
4q21 1 P01112 86.77 7e-112 X-RAY
 1992-07-15 VAL A:112 A:112 0.0 0.0 E -133.8 150.6 0.0 0.0 0.0 HOH
 4.629
 N
 O
4lpk 1 P01116 96.45 9e-112 X-RAY
 2013-11-27 VAL A:113 A:112 0.0 0.0 E -139.0 139.0 0.0 0.0 0.0 HOH
 4.758
 HG22
 O
VAL B:113 B:112 0.0 0.0 E -137.1 133.1 NA NA NA
4obe 1 P01116 96.45 9e-112 X-RAY
 2014-06-04 VAL A:113 A:112 0.0 0.0 E -130.2 133.4 0.0 0.0 0.0 HOH
 4.935
 N
 O
VAL B:113 B:112 0.0 0.0 E -129.6 133.8 NA NA NA
6mbt 1 P01116 96.45 9e-112 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -131.4 133.9 0.0 0.0 0.0 HOH
 5.089
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -130.4 132.9 NA NA NA
6mbu 1 P01116 96.45 9e-112 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -135.6 133.2 0.0 0.0 0.0 HOH
 4.933
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -132.6 136.0 NA NA NA
6ob2 1 P01116 96.45 9e-112 X-RAY
 2019-10-16 VAL A:113 A:112 0.0 0.0 E -140.6 130.5 0.0 0.0 0.0 HOH
 8.139
 CG1
 O
VAL C:113 C:112 0.0 0.0 E -140.7 132.0 NA NA NA
6v65 3 P01116 96.45 9e-112 X-RAY
 2020-07-15 VAL C:113 C:112 0.0 0.0 E -131.9 139.1 0.0 0.0 0.0
6vc8 1 P01116 96.45 9e-112 X-RAY
 2021-02-10 VAL A:113 A:112 0.0 0.0 E -134.7 130.8 0.0 0.0 0.0 HOH
 9.865
 O
 O
VAL B:113 B:112 0.0 0.0 E -135.0 129.5 NA NA NA
VAL C:113 C:112 0.0 0.0 E -135.7 130.1 NA NA NA
6vjj 1 P01116 96.45 9e-112 X-RAY
 2020-11-25 VAL A:113 A:112 0.0 0.0 E -133.2 135.2 0.0 0.0 0.0 HOH
 4.961
 N
 O
6xhb 1 P01116 96.45 9e-112 X-RAY
 2021-01-13 VAL A:113 A:112 0.0 0.0 E -139.8 119.1 0.0 0.0 0.0 HOH
 7.347
 N
 O
6yxw 1 P01116 97.01 1e-111 X-RAY
 2020-07-08 VAL A:115 A:112 0.0 0.0 E -130.5 129.2 0.0 0.0 0.0 HOH
 4.976
 N
 O
VAL C:115 C:112 0.0 0.0 E -134.2 136.3 NA NA NA
7ny8 1 P01116 97.01 1e-111 X-RAY
 2021-07-07 VAL A:115 A:112 0.0 0.0 E -127.4 130.4 0.0 0.0 0.0 HOH
 5.182
 N
 O
VAL B:115 B:112 0.0 0.0 E -125.9 135.3 NA NA NA
4tq9 1 P01116 96.41 1e-111 X-RAY
 2015-06-10 VAL A:113 A:112 0.0 0.0 E -128.4 133.8 0.0 0.0 0.0 HOH
 4.646
 HG21
 O
VAL B:113 B:112 0.0 0.0 E -128.8 131.6 NA NA NA
7q9u 1 P01116-2 97.01 1e-111 X-RAY
 2022-01-26 VAL A:112 AAA:112 0.0 0.0 E -131.2 125.8 0.0 0.0 0.0 HOH
 5.051
 N
 O
VAL B:112 BBB:112 0.0 0.0 E -130.3 125.7 NA NA NA
6god 1 P01116 95.35 2e-111 X-RAY
 2019-02-06 VAL A:112 A:112 0.0 0.0 E -130.2 130.6 0.0 0.0 0.0 HOH
 4.985
 N
 O
5ufe 1 P01116 97.59 2e-111 X-RAY
 2017-08-02 VAL A:112 A:112 0.0 0.0 E -135.9 135.4 0.0 0.0 0.0 CA
HOH
 9.002
5.042
 N
N
 CA
O
5uk9 1 P01116 97.59 2e-111 X-RAY
 2018-01-10 VAL A:112 A:112 0.0 0.0 E -132.4 136.7 0.0 0.0 0.0 HOH
 5.001
 N
 O
VAL B:112 B:112 0.0 0.0 E -131.1 132.6 NA NA NA
5wlb 1 P01116 96.99 2e-111 X-RAY
 2018-01-03 VAL A:112 A:112 0.0 0.0 E -132.7 133.7 0.0 0.0 0.0 HOH
 5.161
 N
 O
VAL D:112 D:112 0.0 0.0 E -132.2 135.3 NA NA NA
5wpm 1 P01116 96.99 2e-111 X-RAY
 2018-01-03 VAL A:112 A:112 0.0 0.0 E -138.8 121.3 0.0 0.0 0.0 MG
HOH
 9.757
8.767
 O
CG1
 MG
O
5uqw 1 P01116 95.86 2e-111 X-RAY
 2017-03-22 VAL A:132 A:112 0.0 0.0 E -133.0 139.9 0.0 0.0 0.0 HOH
 5.029
 N
 O
VAL B:132 B:112 0.0 0.0 E -128.0 136.7 NA NA NA
6pts 2 P01116 97.01 3e-111 NMR
 2020-05-13 VAL C:112 B:112 2.0 0.013 E -127.5 138.2 2.0 0.013 0.0 PCW
PCW
17F
 6.901
7.026
8.661
 CG1
CG2
CG1
 C7
C7
HN1A
6ptw 2 P01116 97.01 3e-111 NMR
 2020-05-13 VAL C:112 B:112 0.0 0.0 E -125.6 130.2 0.0 0.0 0.0
6yr8 1 P01116 97.59 3e-111 X-RAY
 2020-07-08 VAL A:115 A:112 0.0 0.0 E -142.7 133.0 0.0 0.0 0.0 HOH
 5.344
 N
 O
5mla 1 P01116 96.99 3e-111 X-RAY
 2017-12-20 VAL A:115 A:112 0.0 0.0 E -131.7 130.7 0.0 0.0 0.0 HOH
 4.664
 N
 O
5mlb 1 P01116 96.99 3e-111 X-RAY
 2017-12-20 VAL A:115 A:112 0.0 0.0 E -128.8 134.5 0.0 0.0 0.0 HOH
 7.695
 CG1
 O
VAL C:115 C:112 0.0 0.0 E -128.1 133.4 NA NA NA
VAL E:115 E:112 0.0 0.0 E -128.7 133.6 NA NA NA
VAL G:115 G:112 0.0 0.0 E -127.6 133.9 NA NA NA
5o2s 1 P01116 96.99 3e-111 X-RAY
 2017-07-26 VAL A:115 A:112 0.0 0.0 E -128.8 134.5 0.0 0.0 0.0 HOH
 7.695
 CG1
 O
VAL C:115 C:112 0.0 0.0 E -128.1 133.4 NA NA NA
VAL E:115 E:112 0.0 0.0 E -128.7 133.6 NA NA NA
VAL G:115 G:112 0.0 0.0 E -127.6 133.9 NA NA NA
5o2t 1 P01116 96.99 3e-111 X-RAY
 2017-07-26 VAL A:115 A:112 0.0 0.0 E -131.7 130.7 0.0 0.0 0.0 HOH
 4.664
 N
 O
6h46 1 P01116 96.99 3e-111 X-RAY
 2019-04-24 VAL A:115 A:112 0.0 0.0 E -133.1 138.2 0.0 0.0 0.0 HOH
 5.020
 N
 O
6h47 1 P01116 96.99 3e-111 X-RAY
 2019-04-24 VAL A:115 A:112 0.0 0.0 E -132.0 133.4 0.0 0.0 0.0 HOH
 5.087
 N
 O
6mnx 1 P01116 95.86 3e-111 X-RAY
 2020-04-15 VAL A:112 A:112 0.0 0.0 E -131.6 131.9 0.0 0.0 0.0 HOH
 4.931
 HG23
 O
VAL B:112 B:112 0.0 0.0 E -132.3 137.2 NA NA NA
VAL C:112 C:112 0.0 0.0 E -144.3 125.0 NA NA NA
VAL D:112 D:112 0.0 0.0 E -128.3 126.2 NA NA NA
VAL E:112 E:112 0.0 0.0 E -138.1 131.8 NA NA NA
VAL F:112 F:112 1.0 0.006 E -148.8 136.6 NA NA NA
6ws2 1 P01116 95.86 4e-111 X-RAY
 2021-11-10 VAL A:113 A:112 0.0 0.0 E -129.3 134.1 0.0 0.0 0.0 HOH
 4.996
 N
 O
VAL B:113 B:112 0.0 0.0 E -130.8 134.8 NA NA NA
VAL C:113 C:112 0.0 0.0 E -131.2 137.2 NA NA NA
VAL D:113 D:112 0.0 0.0 E -130.9 136.5 NA NA NA
6f76 1 P01116 95.86 4e-111 X-RAY
 2018-08-08 VAL A:116 B:112 0.0 0.0 E -135.7 139.0 0.0 0.0 0.0 HOH
 4.985
 N
 O
VAL B:116 A:112 0.0 0.0 E -137.1 136.0 0.0 0.0 0.0 HOH
 7.418
 CG2
 O
VAL C:116 C:112 0.0 0.0 E -134.5 137.2 0.0 0.0 0.0 HOH
 9.235
 CG2
 O
VAL D:116 D:112 0.0 0.0 E -135.8 137.7 0.0 0.0 0.0 HOH
 7.457
 CG2
 O
VAL E:116 E:112 0.0 0.0 E -135.7 136.7 0.0 0.0 0.0 HOH
 9.786
 CG2
 O
VAL F:116 F:112 0.0 0.0 E -136.7 139.3 0.0 0.0 0.0 HOH
 4.971
 N
 O
6fa1 1 P01116 95.86 4e-111 X-RAY
 2018-08-22 VAL A:116 B:112 0.0 0.0 E -134.9 138.2 0.0 0.0 0.0 HOH
 5.007
 N
 O
6fa1 3 P01116 95.86 4e-111 X-RAY
 2018-08-22 VAL E:116 E:112 0.0 0.0 E -132.9 137.4 0.0 0.0 0.0 HOH
 4.881
 N
 O
6fa4 1 P01116 95.86 4e-111 X-RAY
 2018-08-22 VAL A:116 B:112 0.0 0.0 E -132.6 134.8 0.0 0.0 0.0 HOH
 4.979
 N
 O
6fa4 2 P01116 95.86 4e-111 X-RAY
 2018-08-22 VAL B:116 A:112 0.0 0.0 E -132.7 131.8 NA NA NA
VAL C:116 C:112 0.0 0.0 E -130.9 135.0 NA NA NA
VAL D:116 D:112 0.0 0.0 E -131.8 133.7 NA NA NA
VAL E:116 E:112 0.0 0.0 E -132.8 135.6 NA NA NA
VAL F:116 F:112 0.0 0.0 E -133.5 136.4 NA NA NA
6goe 1 P01116 95.83 4e-111 X-RAY
 2019-02-06 VAL A:113 A:112 0.0 0.0 E -135.0 128.5 0.0 0.0 0.0 HOH
 5.045
 N
 O
6cc9 2 P01116 96.41 4e-111 NMR
 2018-09-05 VAL B:114 B:112 0.0 0.0 E -135.8 134.0 0.0 0.0 0.0
6cch 2 P01116 96.41 4e-111 NMR
 2018-08-29 VAL B:114 B:112 0.0 0.0 E -132.3 127.2 0.0 0.0 0.0
6ccx 2 P01116 96.41 4e-111 NMR
 2018-09-05 VAL B:114 B:112 0.0 0.0 E -138.8 137.3 0.0 0.0 0.0
2msc 2 P01116 97.01 4e-111 NMR
 2015-06-03 VAL C:114 B:112 2.0 0.013 E -125.2 137.9 2.0 0.013 0.0 17F
 8.474
 CG1
 O5
2msd 2 P01116 97.01 4e-111 NMR
 2015-06-03 VAL C:114 B:112 0.0 0.0 E -130.4 131.7 0.0 0.0 0.0
2mse 2 P01116 97.01 4e-111 NMR
 2015-06-03 VAL C:114 B:112 0.0 0.0 E -135.4 132.4 0.0 0.0 0.0
6bp1 1 P01116 95.86 4e-111 X-RAY
 2018-01-24 VAL A:112 A:112 0.0 0.0 E -138.5 132.7 0.0 0.0 0.0 HOH
 4.944
 HG22
 O
3gft 1 P01116 95.86 5e-111 X-RAY
 2009-03-10 VAL A:130 A:112 0.0 0.0 E -132.5 137.9 0.0 0.0 0.0 HOH
 8.684
 N
 O
VAL B:130 B:112 0.0 0.0 E -135.0 133.6 NA NA NA
VAL C:130 C:112 0.0 0.0 E -129.6 137.3 NA NA NA
VAL D:130 D:112 0.0 0.0 E -127.1 134.4 NA NA NA
VAL E:130 E:112 0.0 0.0 E -129.1 133.8 NA NA NA
VAL F:130 F:112 0.0 0.0 E -135.6 137.9 NA NA NA
5oco 1 P01116 95.86 5e-111 X-RAY
 2018-08-22 VAL A:130 B:112 0.0 0.0 E -133.0 137.1 0.0 0.0 0.0 HOH
 5.022
 N
 O
VAL B:130 A:112 0.0 0.0 E -134.5 136.3 0.0 0.0 0.0 HOH
 5.015
 N
 O
VAL C:130 C:112 0.0 0.0 E -133.7 134.5 0.0 0.0 0.0 HOH
 4.951
 N
 O
VAL D:130 D:112 0.0 0.0 E -132.8 137.1 0.0 0.0 0.0 HOH
 5.102
 N
 O
VAL E:130 E:112 0.0 0.0 E -133.2 136.0 0.0 0.0 0.0 HOH
 5.017
 N
 O
VAL F:130 F:112 0.0 0.0 E -133.8 138.8 0.0 0.0 0.0 HOH
 5.030
 N
 O
5oct 1 P01116 95.86 5e-111 X-RAY
 2018-08-22 VAL A:130 A:112 0.0 0.0 E -131.3 137.1 0.0 0.0 0.0 PEG
HOH
 8.956
4.988
 CG1
N
 O4
O
VAL B:130 B:112 0.0 0.0 E -132.2 139.4 0.0 0.0 0.0 HOH
 4.948
 N
 O
VAL C:130 C:112 0.0 0.0 E -130.0 137.4 0.0 0.0 0.0 HOH
 4.833
 N
 O
VAL D:130 D:112 0.0 0.0 E -130.8 136.5 0.0 0.0 0.0 HOH
 4.823
 N
 O
VAL E:130 E:112 0.0 0.0 E -130.0 137.3 0.0 0.0 0.0 HOH
 4.957
 N
 O
VAL F:130 F:112 0.0 0.0 E -130.6 139.1 0.0 0.0 0.0 HOH
 4.835
 N
 O
6fa2 1 P01116 96.41 5e-111 X-RAY
 2018-09-05 VAL A:112 A:112 0.0 0.0 E -135.3 133.6 0.0 0.0 0.0 HOH
 4.882
 N
 O
6asa 1 P01116 96.41 5e-111 X-RAY
 2018-01-24 VAL A:112 A:112 0.0 0.0 E -140.6 125.0 0.0 0.0 0.0
6xgu 1 P01116 95.86 5e-111 X-RAY
 2021-01-13 VAL A:113 A:112 0.0 0.0 E -135.5 129.1 0.0 0.0 0.0
7lc2 1 P01116 95.86 5e-111 X-RAY
 2021-07-28 VAL A:113 A:112 0.0 0.0 E -139.4 128.5 0.0 0.0 0.0 HOH
 8.240
 N
 O
VAL B:113 B:112 0.0 0.0 E -142.7 127.8 NA NA NA
6p0z 1 P01116 96.43 5e-111 X-RAY
 2019-07-31 VAL A:111 A:112 0.0 0.0 E -133.6 132.3 0.0 0.0 0.0 HOH
 5.205
 HG23
 O
VAL B:111 B:112 0.0 0.0 E -132.6 134.8 NA NA NA
6gog 1 P01116 95.86 6e-111 X-RAY
 2019-02-06 VAL A:116 A:112 0.0 0.0 E -135.2 133.1 0.0 0.0 0.0 HOH
 5.004
 N
 O
VAL B:116 B:112 0.0 0.0 E -134.3 136.4 0.0 0.0 0.0 HOH
 5.064
 N
 O
VAL C:116 C:112 0.0 0.0 E -133.8 133.4 0.0 0.0 0.0 HOH
 4.947
 N
 O
VAL D:116 D:112 0.0 0.0 E -133.5 133.5 0.0 0.0 0.0 HOH
 5.078
 N
 O
VAL E:116 E:112 0.0 0.0 E -133.9 134.9 0.0 0.0 0.0 HOH
 5.152
 N
 O
VAL F:116 F:112 0.0 0.0 E -133.1 136.3 0.0 0.0 0.0 HOH
 5.124
 N
 O
5vq2 1 P01116 95.86 6e-111 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -127.2 135.0 0.0 0.0 0.0 HOH
 4.898
 N
 O
VAL B:113 B:112 0.0 0.0 E -131.1 133.1 NA NA NA
5vq6 1 P01116 95.86 6e-111 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -126.9 134.2 0.0 0.0 0.0 HOH
 5.093
 N
 O
VAL B:113 B:112 0.0 0.0 E -130.5 134.3 NA NA NA
5vq8 1 P01116 95.86 6e-111 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -126.8 137.4 0.0 0.0 0.0
VAL B:113 B:112 0.0 0.0 E -127.0 136.8 NA NA NA
5w22 1 P01116 95.86 6e-111 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -130.1 134.5 0.0 0.0 0.0 HOH
 5.041
 N
 O
VAL B:113 B:112 0.0 0.0 E -130.6 134.0 NA NA NA
6ase 1 P01116 95.86 6e-111 X-RAY
 2018-01-24 VAL A:113 A:112 0.0 0.0 E -130.2 131.2 0.0 0.0 0.0 HOH
 4.978
 N
 O
5wha 1 P01116 96.99 7e-111 X-RAY
 2018-01-03 VAL A:116 A:112 0.0 0.0 E -135.9 126.8 0.0 0.0 0.0 HOH
 6.680
 CG2
 O
VAL D:116 D:112 0.0 0.0 E -135.0 128.9 NA NA NA
VAL G:116 G:112 0.0 0.0 E -136.0 127.7 NA NA NA
VAL J:116 J:112 0.0 0.0 E -131.0 128.2 NA NA NA
5whb 1 P01116 96.99 7e-111 X-RAY
 2018-01-03 VAL A:116 A:112 0.0 0.0 E -135.3 128.9 0.0 0.0 0.0 HOH
 7.824
 CG1
 O
VAL D:116 D:112 0.0 0.0 E -136.4 126.9 NA NA NA
VAL G:116 G:112 0.0 0.0 E -137.7 123.1 NA NA NA
VAL J:116 J:112 0.0 0.0 E -132.7 131.9 NA NA NA
7lc1 1 P01116 95.86 7e-111 X-RAY
 2021-08-04 VAL A:113 A:112 0.0 0.0 E -137.9 133.3 0.0 0.0 0.0 HOH
 9.846
 O
 O
VAL C:113 C:112 0.0 0.0 E -134.9 128.4 NA NA NA
4epx 1 P01116 95.27 7e-111 X-RAY
 2012-05-23 VAL A:113 A:112 0.0 0.0 E -132.7 133.9 0.0 0.0 0.0 HOH
 4.991
 N
 O
4epy 1 P01116 95.27 7e-111 X-RAY
 2012-05-23 VAL A:113 A:112 0.0 0.0 E -131.7 131.0 0.0 0.0 0.0 HOH
 4.925
 N
 O
6xha 1 P01116-2 95.27 7e-111 X-RAY
 2021-01-13 VAL A:113 A:112 0.0 0.0 E -140.9 129.1 0.0 0.0 0.0
4ept 1 P01116 95.86 7e-111 X-RAY
 2012-05-23 VAL A:113 A:112 0.0 0.0 E -138.9 139.3 0.0 0.0 0.0 HOH
 4.917
 N
 O
4epv 1 P01116 95.86 7e-111 X-RAY
 2012-05-23 VAL A:113 A:112 0.0 0.0 E -130.6 135.1 0.0 0.0 0.0 HOH
 4.950
 N
 O
4epw 1 P01116 95.86 7e-111 X-RAY
 2012-05-23 VAL A:113 A:112 0.0 0.0 E -129.3 136.7 0.0 0.0 0.0 HOH
 4.939
 N
 O
6xi7 1 P79800 95.86 7e-111 X-RAY
 2021-01-13 VAL A:113 A:112 0.0 0.0 E -131.6 133.0 0.0 0.0 0.0 HOH
 5.021
 N
 O
6fa2 2 P01116 96.41 8e-111 X-RAY
 2018-09-05 VAL B:115 B:112 0.0 0.0 E -134.6 136.4 NA NA NA
VAL D:115 D:112 0.0 0.0 E -134.6 134.6 NA NA NA
VAL E:115 E:112 0.0 0.0 E -134.7 135.1 NA NA NA
VAL F:115 F:112 0.0 0.0 E -135.1 135.7 NA NA NA
6gqx 2 P01116 96.41 8e-111 X-RAY
 2019-02-06 VAL B:115 B:112 0.0 0.0 E -133.6 137.5 NA NA NA
6fa1 2 P01116 96.41 8e-111 X-RAY
 2018-08-22 VAL B:116 A:112 0.0 0.0 E -134.0 135.8 0.0 0.0 0.0 HOH
 4.945
 N
 O
VAL C:116 C:112 0.0 0.0 E -132.4 136.2 0.0 0.0 0.0 HOH
 4.798
 N
 O
VAL D:116 D:112 0.0 0.0 E -133.0 135.9 0.0 0.0 0.0 HOH
 4.980
 N
 O
VAL F:116 F:112 0.0 0.0 E -133.7 138.3 0.0 0.0 0.0 HOH
 5.096
 N
 O
6fa3 1 P01116 96.41 8e-111 X-RAY
 2018-08-22 VAL A:116 B:112 0.0 0.0 E -132.1 136.2 0.0 0.0 0.0 HOH
 5.017
 N
 O
VAL C:116 C:112 0.0 0.0 E -133.0 134.6 NA NA NA
VAL D:116 D:112 0.0 0.0 E -132.5 135.6 NA NA NA
VAL E:116 E:112 0.0 0.0 E -131.4 136.7 NA NA NA
VAL F:116 F:112 0.0 0.0 E -132.8 137.2 NA NA NA
6fa3 2 P01116 96.41 8e-111 X-RAY
 2018-08-22 VAL B:116 A:112 0.0 0.0 E -131.2 134.2 NA NA NA
6gom 1 P01116 96.41 8e-111 X-RAY
 2019-02-06 VAL A:116 A:112 0.0 0.0 E -133.3 136.3 0.0 0.0 0.0 HOH
 5.050
 N
 O
VAL B:116 B:112 0.0 0.0 E -132.0 136.3 NA NA NA
VAL C:116 C:112 0.0 0.0 E -131.8 135.4 NA NA NA
VAL D:116 D:112 0.0 0.0 E -132.2 135.8 NA NA NA
VAL E:116 E:112 0.0 0.0 E -132.2 135.9 NA NA NA
VAL F:116 F:112 0.0 0.0 E -132.3 137.9 NA NA NA
6gqt 1 P01116 96.41 9e-111 X-RAY
 2019-02-06 VAL A:115 A:112 0.0 0.0 E -133.1 135.0 0.0 0.0 0.0 HOH
 5.031
 N
 O
VAL B:115 B:112 0.0 0.0 E -131.5 136.2 NA NA NA
VAL C:115 C:112 0.0 0.0 E -130.7 133.7 NA NA NA
VAL D:115 D:112 0.0 0.0 E -129.8 133.4 NA NA NA
VAL E:115 E:112 0.0 0.0 E -133.1 135.7 NA NA NA
VAL F:115 F:112 0.0 0.0 E -134.4 136.8 NA NA NA
7c40 1 P01116 98.17 9e-111 X-RAY
 2021-05-19 VAL A:112 A:112 0.0 0.0 E -132.0 136.6 0.0 0.0 0.0
7c41 1 P01116 98.17 9e-111 X-RAY
 2021-05-19 VAL A:112 A:112 0.0 0.0 E -134.1 124.3 0.0 0.0 0.0 HOH
 7.791
 CG2
 O
VAL C:112 J:112 0.0 0.0 E -125.2 139.2 NA NA NA
VAL D:112 M:112 0.0 0.0 E -136.8 128.6 NA NA NA
VAL E:112 G:112 0.0 0.0 E -138.8 131.8 NA NA NA
6m9w 1 P01116 96.43 1e-110 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -134.9 131.4 0.0 0.0 0.0 HOH
 4.985
 HG23
 O
4wa7 1 P01116 95.86 1e-110 X-RAY
 2015-06-10 VAL A:113 A:112 0.0 0.0 E -133.6 131.0 0.0 0.0 0.0 HOH
 5.015
 HG22
 O
6v6f 3 P01116 95.86 1e-110 X-RAY
 2020-07-15 VAL C:113 C:112 0.0 0.0 E -139.7 135.3 0.0 0.0 0.0 HOH
 8.553
 N
 O
6fa2 3 P01116 96.41 1e-110 X-RAY
 2018-09-05 VAL C:116 C:112 0.0 0.0 E -135.4 134.8 NA NA NA
6gqw 1 P01116 96.41 1e-110 X-RAY
 2019-02-06 VAL A:116 A:112 0.0 0.0 E -136.1 133.0 0.0 0.0 0.0 HOH
 9.371
 CG2
 O
VAL B:116 B:112 0.0 0.0 E -136.4 134.3 NA NA NA
VAL C:116 C:112 1.0 0.006 E -137.6 134.1 NA NA NA
VAL D:116 D:112 0.0 0.0 E -136.6 134.1 NA NA NA
VAL F:116 F:112 0.0 0.0 E -139.3 135.5 NA NA NA
6gqx 1 P01116 96.41 1e-110 X-RAY
 2019-02-06 VAL A:116 A:112 0.0 0.0 E -133.6 136.5 0.0 0.0 0.0 HOH
 4.942
 N
 O
VAL C:116 C:112 0.0 0.0 E -133.4 136.9 NA NA NA
VAL D:116 D:112 0.0 0.0 E -133.9 137.2 NA NA NA
VAL E:116 E:112 0.0 0.0 E -132.9 138.7 NA NA NA
VAL F:116 F:112 0.0 0.0 E -133.2 139.9 NA NA NA
6gqy 1 P01116 96.41 1e-110 X-RAY
 2019-02-06 VAL A:116 A:112 0.0 0.0 E -136.1 133.2 0.0 0.0 0.0 HOH
 9.713
 O
 O
VAL B:116 B:112 0.0 0.0 E -136.9 135.3 NA NA NA
VAL C:116 C:112 0.0 0.0 E -135.4 133.6 NA NA NA
VAL D:116 D:112 0.0 0.0 E -137.2 134.8 NA NA NA
VAL E:116 E:112 0.0 0.0 E -134.8 135.3 NA NA NA
VAL F:116 F:112 0.0 0.0 E -137.1 136.5 NA NA NA
6mta 1 P01116 95.86 1e-110 X-RAY
 2020-04-15 VAL A:112 A:112 0.0 0.0 E -137.6 132.2 0.0 0.0 0.0 HOH
 4.909
 N
 O
VAL B:112 B:112 0.0 0.0 E -132.6 124.4 NA NA NA
VAL C:112 C:112 0.0 0.0 E -135.3 130.6 NA NA NA
6bof 1 P01116 95.83 3e-110 X-RAY
 2019-05-22 VAL A:111 A:112 1.0 0.006 E -132.8 133.9 1.0 0.006 0.0 HOH
 4.885
 HG23
 O
VAL B:111 B:112 0.0 0.0 E -133.3 133.8 NA NA NA
6o36 1 P01116 96.41 3e-110 X-RAY
 2020-02-26 VAL A:112 A:112 0.0 0.0 E -133.0 132.8 0.0 0.0 0.0 HOH
 4.976
 N
 O
VAL B:112 B:112 0.0 0.0 E -132.3 132.9 NA NA NA
VAL C:112 C:112 0.0 0.0 E -131.0 135.2 NA NA NA
6mbq 1 P01116 97.58 3e-110 X-RAY
 2019-07-31 VAL A:113 A:112 0.0 0.0 E -134.3 135.1 0.0 0.0 0.0 HOH
 6.078
 HG13
 O
5tar 1 P01116 96.99 5e-110 X-RAY
 2016-11-02 VAL A:112 A:112 0.0 0.0 E -133.4 135.2 0.0 0.0 0.0 HOH
 7.671
 CG2
 O
5tb5 1 P01116 96.99 5e-110 X-RAY
 2016-11-02 VAL A:112 A:112 0.0 0.0 E -132.0 131.4 0.0 0.0 0.0 HOH
 5.009
 N
 O
VAL C:112 C:112 0.0 0.0 E -125.4 132.3 NA NA NA
6o46 1 P01116 96.41 5e-110 X-RAY
 2020-03-11 VAL A:113 A:112 0.0 0.0 E -134.9 136.2 0.0 0.0 0.0 HOH
 5.071
 N
 O
VAL B:113 B:112 0.0 0.0 E -132.4 134.3 NA NA NA
VAL C:113 C:112 0.0 0.0 E -132.9 139.5 NA NA NA
5vq1 1 P01116 95.27 5e-110 X-RAY
 2017-12-06 VAL A:113 A:112 0.0 0.0 E -127.5 136.0 0.0 0.0 0.0 HOH
 4.867
 N
 O
VAL B:113 B:112 0.0 0.0 E -126.6 136.1 NA NA NA
6gqw 2 P01116 95.81 6e-110 X-RAY
 2019-02-06 VAL E:116 E:112 0.0 0.0 E -136.7 135.0 NA NA NA
7kmr 1 P01116 96.41 8e-110 X-RAY
 2021-11-10 VAL A:137 A:112 0.0 0.0 E -130.2 135.4 0.0 0.0 0.0 HOH
 5.038
 N
 O
5whd 1 P01116 96.39 1e-109 X-RAY
 2018-01-03 VAL A:116 A:112 0.0 0.0 E -130.0 133.1 0.0 0.0 0.0 HOH
 5.120
 N
 O
VAL B:116 B:112 0.0 0.0 E -130.6 133.5 NA NA NA
VAL C:116 C:112 0.0 0.0 E -134.2 132.8 NA NA NA
VAL D:116 D:112 0.0 0.0 E -126.5 134.6 NA NA NA
5whe 1 P01116 96.39 1e-109 X-RAY
 2018-01-03 VAL A:116 A:112 0.0 0.0 E -131.3 133.3 0.0 0.0 0.0 HOH
 4.877
 N
 O
VAL B:116 D:112 0.0 0.0 E -129.2 134.4 NA NA NA
VAL C:116 G:112 0.0 0.0 E -130.7 133.0 NA NA NA
VAL D:116 J:112 0.0 0.0 E -128.8 134.4 NA NA NA
4q01 1 P01116 94.67 1e-109 X-RAY
 2014-09-10 VAL A:112 A:112 0.0 0.0 E -135.0 136.1 0.0 0.0 0.0 HOH
 6.808
 HG21
 O
VAL B:112 B:112 0.0 0.0 E -135.2 134.1 NA NA NA
1ioz 1 P01112 92.4 2e-109 X-RAY
 2001-10-03 VAL A:112 A:112 0.0 0.0 E -135.2 128.5 0.0 0.0 0.0 HOH
 7.135
 C
 O
1q21 1 P01112 92.4 2e-109 X-RAY
 1992-07-15 VAL A:112 A:112 0.0 0.0 E -131.5 140.6 0.0 0.0 0.0 HOH
 8.191
 N
 O
6q21 1 P01112 92.4 2e-109 X-RAY
 1992-07-28 VAL A:112 A:112 0.0 0.0 E -132.2 128.8 0.0 0.0 0.0 HOH
 5.158
 N
 O
VAL B:112 B:112 0.0 0.0 E -144.2 137.5 0.0 0.0 0.0 HOH
 4.512
 CG1
 O
VAL C:112 C:112 0.0 0.0 E -145.9 141.3 0.0 0.0 0.0 HOH
 5.453
 N
 O
VAL D:112 D:112 0.0 0.0 E -130.7 140.5 0.0 0.0 0.0 HOH
 5.969
 CG2
 O
2q21 1 P01112 91.81 2e-109 X-RAY
 1992-07-15 VAL A:112 A:112 0.0 0.0 E -141.0 139.4 0.0 0.0 0.0 HOH
 7.901
 N
 O
4pzz 1 P01116 94.67 2e-109 X-RAY
 2014-09-10 VAL A:113 A:112 0.0 0.0 E -132.7 135.0 0.0 0.0 0.0 HOH
 4.923
 N
 O
4q02 1 P01116 94.67 2e-109 X-RAY
 2014-09-10 VAL A:113 A:112 0.0 0.0 E -130.2 134.4 0.0 0.0 0.0 HOH
 4.917
 N
 O
4q03 1 P01116 94.67 2e-109 X-RAY
 2014-09-10 VAL A:113 A:112 0.0 0.0 E -133.3 134.4 0.0 0.0 0.0 HOH
 4.885
 HG23
 O
3con 1 P01111 92.44 3e-109 X-RAY
 2008-04-08 VAL A:130 A:112 0.0 0.0 E -136.8 136.2 0.0 0.0 0.0 UNX
HOH
 9.945
5.011
 O
N
 UNK
O
4pzy 1 P01116 94.67 4e-109 X-RAY
 2014-09-10 VAL A:113 A:112 0.0 0.0 E -131.7 131.0 0.0 0.0 0.0 HOH
 5.333
 N
 O
VAL B:113 B:112 0.0 0.0 E -130.5 131.3 0.0 0.0 0.0 HOH
 4.962
 N
 O
6zio 1 P01111 91.86 3e-108 X-RAY
 2020-08-19 VAL A:113 A:112 0.0 0.0 E -129.3 137.1 0.0 0.0 0.0 HOH
 4.849
 N
 O
VAL B:113 B:112 0.0 0.0 E -129.2 136.7 0.0 0.0 0.0 HOH
 4.892
 N
 O
6zir 1 P01111 91.86 3e-108 X-RAY
 2020-08-19 VAL A:113 A:112 0.0 0.0 E -130.6 132.1 0.0 0.0 0.0 HOH
 4.952
 N
 O
6amb 1 P01112 93.45 4e-108 X-RAY
 2017-11-01 VAL A:114 A:112 0.0 0.0 E -141.8 121.1 0.0 0.0 0.0
5wpl 1 P01112 93.98 5e-108 X-RAY
 2018-01-03 VAL A:112 A:112 0.0 0.0 E -137.9 140.5 0.0 0.0 0.0 HOH
 5.036
 N
 O
VAL D:112 D:112 0.0 0.0 E -132.8 134.2 NA NA NA
VAL G:112 G:112 0.0 0.0 E -129.7 133.3 NA NA NA
VAL J:112 J:112 0.0 0.0 E -134.8 136.8 NA NA NA
6pq3 1 P01116 90.5 1e-107 X-RAY
 2020-05-20 VAL A:123 A:122 0.0 0.0 E -131.4 134.5 0.0 0.0 0.0 HOH
 5.090
 N
 O
6ziz 1 P01111 91.28 1e-107 X-RAY
 2020-08-19 VAL A:113 A:112 0.0 0.0 E -131.2 135.1 0.0 0.0 0.0 HOH
 4.650
 HG23
 O
VAL B:113 B:112 0.0 0.0 E -132.0 135.1 NA NA NA
7l0f 1 P01112 93.98 3e-107 X-RAY
 2021-03-24 VAL A:113 E:112 0.0 0.0 E -130.2 132.6 0.0 0.0 0.0 HOH
 4.979
 N
 O
VAL C:113 A:112 0.0 0.0 E -127.5 133.8 NA NA NA
VAL E:113 G:112 0.0 0.0 E -131.1 135.3 NA NA NA
VAL G:113 L:112 0.0 0.0 E -130.3 136.1 NA NA NA
6axg 2 P01112 93.98 3e-107 X-RAY
 2017-10-11 VAL B:116 B:112 0.0 0.0 E -145.4 128.2 0.0 0.0 0.0
VAL D:116 D:112 0.0 0.0 E -147.7 132.4 NA NA NA
VAL F:116 F:112 0.0 0.0 E -146.7 131.6 NA NA NA
VAL H:116 H:112 0.0 0.0 E -147.4 131.1 NA NA NA
VAL J:116 J:112 0.0 0.0 E -148.1 130.5 NA NA NA
VAL L:116 L:112 0.0 0.0 E -148.2 131.2 NA NA NA
5e95 2 P01112 93.98 3e-107 X-RAY
 2016-11-02 VAL B:114 A:112 0.0 0.0 E -127.3 150.9 0.0 0.0 0.0 HOH
 4.919
 N
 O
5vbm 1 P01116 94.08 3e-107 X-RAY
 2017-10-25 VAL A:113 A:112 0.0 0.0 E -130.6 132.1 0.0 0.0 0.0 HOH
 4.950
 HG23
 O
5x9s 1 P01112 87.03 4e-107 X-RAY
 2017-08-30 VAL A:118 A:112 0.0 0.0 E -137.5 133.8 0.0 0.0 0.0 HOH
 5.425
 N
 O
1he8 2 P23175 93.37 4e-107 X-RAY
 2001-01-08 VAL B:112 B:112 0.0 0.0 E -140.7 116.2 0.0 0.0 0.0
1rvd 1 P01112 93.37 4e-107 X-RAY
 1999-05-28 VAL A:112 A:112 0.0 0.0 E -129.5 133.6 0.0 0.0 0.0 HOH
 5.001
 N
 O
2uzi 3 P01112 93.37 4e-107 X-RAY
 2007-06-26 VAL C:112 R:112 0.0 0.0 E -132.6 132.9 0.0 0.0 0.0 ZN
HOH
 8.841
4.940
 N
N
 ZN
O
2vh5 3 P01112 93.37 4e-107 X-RAY
 2008-01-22 VAL C:112 R:112 0.0 0.0 E -125.0 128.5 0.0 0.0 0.0 HOH
 8.490
 CG1
 O
3oiv 1 P01112 93.37 4e-107 X-RAY
 2010-12-08 VAL A:112 A:112 0.0 0.0 E -133.8 134.9 0.0 0.0 0.0 HOH
 5.099
 N
 O
3oiw 1 P01112 93.37 4e-107 X-RAY
 2010-12-08 VAL A:112 A:112 0.0 0.0 E -134.5 134.7 0.0 0.0 0.0 CA
ACT
HOH
 9.035
8.671
5.020
 N
N
N
 CA
O
O
121p 1 P01112 93.98 4e-107 X-RAY
 1994-01-31 VAL A:112 A:112 0.0 0.0 E -131.0 136.6 0.0 0.0 0.0 HOH
 4.968
 N
 O
1bkd 1 P01112 93.98 4e-107 X-RAY
 1999-01-13 VAL A:112 R:112 0.0 0.0 E -139.3 145.8 0.0 0.0 0.0
1ctq 1 P01112 93.98 4e-107 X-RAY
 1999-11-15 VAL A:112 A:112 0.0 0.0 E -123.9 132.2 0.0 0.0 0.0 HOH
 4.949
 N
 O
1gnp 1 P01112 93.98 4e-107 X-RAY
 1995-07-31 VAL A:112 A:112 0.0 0.0 E -133.2 126.5 0.0 0.0 0.0
1gnq 1 P01112 93.98 4e-107 X-RAY
 1995-07-31 VAL A:112 A:112 0.0 0.0 E -134.1 145.8 0.0 0.0 0.0
1gnr 1 P01112 93.98 4e-107 X-RAY
 1995-07-31 VAL A:112 A:112 0.0 0.0 E -122.8 141.2 0.0 0.0 0.0 HOH
 5.398
 N
 O
1k8r 1 P01112 93.98 4e-107 X-RAY
 2002-03-13 VAL A:112 A:112 0.0 0.0 E -109.5 147.1 0.0 0.0 0.0
1nvv 2 P01112 93.98 4e-107 X-RAY
 2003-04-01 VAL B:112 R:112 0.0 0.0 E -130.3 142.5 0.0 0.0 0.0 HOH
 7.228
 N
 O
1nvw 1 P01112 93.98 4e-107 X-RAY
 2003-04-01 VAL A:112 Q:112 0.0 0.0 E -138.9 134.8 0.0 0.0 0.0 HOH
 8.459
 CG1
 O
VAL B:112 R:112 0.0 0.0 E -130.3 142.9 0.0 0.0 0.0 HOH
 5.159
 N
 O
1p2s 1 P01112 93.98 4e-107 X-RAY
 2003-08-05 VAL A:112 A:112 0.0 0.0 E -136.9 136.7 0.0 0.0 0.0 ETF
HOH
 9.772
4.818
 N
N
 F1
O
1p2t 1 P01112 93.98 4e-107 X-RAY
 2003-08-05 VAL A:112 A:112 0.0 0.0 E -133.6 133.9 0.0 0.0 0.0 HOH
 4.936
 N
 O
1p2u 1 P01112 93.98 4e-107 X-RAY
 2003-08-05 VAL A:112 A:112 0.0 0.0 E -135.7 132.4 0.0 0.0 0.0 HOH
 4.916
 N
 O
1p2v 1 P01112 93.98 4e-107 X-RAY
 2003-08-05 VAL A:112 A:112 0.0 0.0 E -143.8 131.3 0.0 0.0 0.0 HOH
 5.080
 N
 O
1qra 1 P01112 93.98 4e-107 X-RAY
 1999-11-05 VAL A:112 A:112 0.0 0.0 E -127.1 136.8 0.0 0.0 0.0 HOH
 5.025
 N
 O
1wq1 1 P01112 93.98 4e-107 X-RAY
 1998-07-15 VAL A:112 R:112 0.0 0.0 E -137.3 140.2 0.0 0.0 0.0
1xd2 2 P01112 93.98 4e-107 X-RAY
 2004-11-02 VAL B:112 B:112 0.0 0.0 E -128.8 135.7 0.0 0.0 0.0
2rge 1 P01112 93.98 4e-107 X-RAY
 2007-12-18 VAL A:112 A:112 0.0 0.0 E -139.7 134.3 0.0 0.0 0.0 HOH
 5.108
 N
 O
3k8y 1 P01112 93.98 4e-107 X-RAY
 2010-03-02 VAL A:112 A:112 0.0 0.0 E -134.3 134.3 0.0 0.0 0.0 CA
ACT
HOH
 9.146
8.821
5.074
 N
N
N
 CA
O
O
3kud 1 P01112 93.98 4e-107 X-RAY
 2010-03-23 VAL A:112 A:112 0.0 0.0 E -138.6 143.5 0.0 0.0 0.0 HOH
 7.652
 CG2
 O
3l8y 1 P01112 93.98 4e-107 X-RAY
 2011-01-05 VAL A:112 A:112 0.0 0.0 E -135.3 132.2 0.0 0.0 0.0 HOH
 5.096
 N
 O
3l8z 1 P01112 93.98 4e-107 X-RAY
 2011-01-05 VAL A:112 A:112 0.0 0.0 E -137.2 133.3 0.0 0.0 0.0 CA
HOH
 9.042
4.973
 N
N
 CA
O
3lbh 1 P01112 93.98 4e-107 X-RAY
 2010-03-02 VAL A:112 A:112 0.0 0.0 E -138.7 131.4 0.0 0.0 0.0 CA
ACT
HOH
 9.092
8.846
5.044
 N
N
N
 CA
O
O
3lbi 1 P01112 93.98 4e-107 X-RAY
 2010-03-02 VAL A:112 A:112 0.0 0.0 E -135.8 136.1 0.0 0.0 0.0 CA
ACT
HOH
 9.207
8.947
5.150
 N
N
N
 CA
O
O
3lbn 1 P01112 93.98 4e-107 X-RAY
 2010-03-02 VAL A:112 A:112 0.0 0.0 E -134.6 132.8 0.0 0.0 0.0 MG
HOH
 9.357
5.106
 CG2
N
 MG
O
3rry 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -132.2 136.6 0.0 0.0 0.0 HOH
 5.258
 N
 O
3rrz 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -134.2 136.9 0.0 0.0 0.0 HOH
 5.176
 N
 O
3rs0 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -135.8 136.5 0.0 0.0 0.0 HOH
 5.550
 N
 O
3rs2 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -137.3 135.7 0.0 0.0 0.0 HOH
 5.213
 N
 O
3rs3 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -133.3 135.5 0.0 0.0 0.0 HOH
 5.201
 N
 O
3rs4 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -134.0 136.8 0.0 0.0 0.0 HOH
 5.163
 N
 O
3rs5 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -135.5 137.3 0.0 0.0 0.0 DMF
HOH
 8.968
5.440
 CG2
N
 O
O
3rs7 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -135.3 136.4 0.0 0.0 0.0 HOH
 5.197
 N
 O
3rsl 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -129.8 138.2 0.0 0.0 0.0 HOH
 5.185
 N
 O
3rso 1 P01112 93.98 4e-107 X-RAY
 2011-09-21 VAL A:112 A:112 0.0 0.0 E -133.1 134.9 0.0 0.0 0.0 HOH
 5.037
 N
 O
3tgp 1 P01112 93.98 4e-107 X-RAY
 2011-10-12 VAL A:112 A:112 2.0 0.013 E -124.9 145.7 2.0 0.013 0.0 HOH
 6.033
 HG22
 O
4dls 1 P01112 93.98 4e-107 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -135.9 131.6 0.0 0.0 0.0 HOH
 9.900
 CG1
 O
4dlt 1 P01112 93.98 4e-107 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -135.7 133.5 0.0 0.0 0.0 CA
ACT
HOH
 9.062
8.706
5.218
 N
N
N
 CA
O
O
4dlu 1 P01112 93.98 4e-107 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -134.7 134.6 0.0 0.0 0.0 CA
ACT
HOH
 9.178
8.840
5.033
 N
N
N
 CA
O
O
4dlw 1 P01112 93.98 4e-107 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -135.1 133.5 0.0 0.0 0.0 CA
ACT
HOH
 9.102
8.761
5.161
 N
N
N
 CA
O
O
4g0n 1 P01112 93.98 4e-107 X-RAY
 2013-07-17 VAL A:112 A:112 0.0 0.0 E -135.5 130.5 0.0 0.0 0.0 CA
ACT
HOH
 9.308
8.730
7.471
 N
N
N
 CA
O
O
4nyj 2 P01112 93.98 4e-107 X-RAY
 2014-03-12 VAL B:112 R:112 0.0 0.0 E -127.2 138.4 0.0 0.0 0.0 HOH
 5.544
 N
 O
4nym 2 P01112 93.98 4e-107 X-RAY
 2014-03-12 VAL B:112 R:112 0.0 0.0 E -140.6 133.0 0.0 0.0 0.0
4rsg 1 P01112 93.98 4e-107 NEUTRON DIFFRACTION
 2015-11-04 VAL A:112 A:112 0.0 0.0 E -133.0 126.3 0.0 0.0 0.0 DOD
DOD
DOD
DOD
DOD
DOD
DOD
DOD
DOD
DOD
DOD
DOD
DOD
DOD
 4.353
7.728
9.408
6.477
7.022
6.299
8.432
9.215
6.761
6.830
6.925
8.701
7.928
6.603
 HG21
HG21
O
N
HG13
HG13
HG11
HG11
HG23
N
HG21
HG21
HG11
HG23
 D1
D1
D2
D1
O
D2
D1
D1
O
O
D2
O
O
O
5p21 1 P01112 93.98 4e-107 X-RAY
 1992-01-15 VAL A:112 A:112 0.0 0.0 E -127.7 137.8 0.0 0.0 0.0 HOH
 5.034
 N
 O
4k81 2 P01112 93.37 4e-107 X-RAY
 2013-09-04 VAL B:117 B:112 0.0 0.0 E -129.3 128.5 0.0 0.0 0.0 HOH
 7.620
 N
 O
VAL D:117 D:112 0.0 0.0 E -135.1 138.3 NA NA NA
VAL F:117 F:112 0.0 0.0 E -128.5 130.1 NA NA NA
VAL H:117 H:112 0.0 0.0 E -132.6 147.7 NA NA NA
6kyh 2 Q61411 93.41 5e-107 X-RAY
 2019-12-04 VAL E:116 F:112 0.0 0.0 E -136.2 135.5 NA NA NA
VAL F:116 G:112 0.0 0.0 E -134.3 134.6 NA NA NA
VAL G:116 H:112 0.0 0.0 E -134.1 135.1 NA NA NA
VAL H:116 E:112 0.0 0.0 E -136.2 136.2 0.0 0.0 0.0
4nyi 2 P01112 93.98 5e-107 X-RAY
 2014-03-12 VAL B:113 R:112 0.0 0.0 E -128.0 135.1 0.0 0.0 0.0 HOH
 5.360
 N
 O
5wfo 1 P01112 93.98 5e-107 X-RAY
 2018-05-23 VAL A:113 Q:112 0.0 0.0 E -132.4 134.8 0.0 0.0 0.0 HOH
 5.284
 N
 O
VAL B:113 R:112 0.0 0.0 E -127.8 147.2 0.0 0.0 0.0 HOH
 4.949
 N
 O
5wfp 1 P01112 93.98 5e-107 X-RAY
 2018-05-23 VAL A:113 Q:112 0.0 0.0 E -131.3 133.7 0.0 0.0 0.0 HOH
 5.349
 N
 O
VAL B:113 R:112 0.0 0.0 E -125.5 145.3 0.0 0.0 0.0 HOH
 5.118
 N
 O
5wfq 1 P01112 93.98 5e-107 X-RAY
 2018-05-23 VAL A:113 Q:112 0.0 0.0 E -128.8 133.6 0.0 0.0 0.0 HOH
 5.698
 N
 O
VAL B:113 R:112 0.0 0.0 E -125.1 147.5 0.0 0.0 0.0 HOH
 5.252
 N
 O
5wfr 1 P01112 93.98 5e-107 X-RAY
 2018-05-23 VAL A:113 Q:112 0.0 0.0 E -132.2 134.7 0.0 0.0 0.0 HOH
 5.490
 N
 O
VAL B:113 R:112 0.0 0.0 E -125.3 146.9 0.0 0.0 0.0 HOH
 5.264
 N
 O
6bvi 3 P01112 93.98 5e-107 X-RAY
 2018-10-24 VAL C:113 C:112 0.0 0.0 E -131.4 147.3 0.0 0.0 0.0 HOH
 5.042
 N
 O
6bvj 1 P01112 93.98 5e-107 X-RAY
 2018-10-24 VAL A:113 A:112 0.0 0.0 E -133.4 134.6 0.0 0.0 0.0 HOH
 5.262
 N
 O
6bvj 3 P01112 93.98 5e-107 X-RAY
 2018-10-24 VAL C:113 C:112 0.0 0.0 E -131.6 146.8 0.0 0.0 0.0 HOH
 5.019
 N
 O
6bvk 3 P01112 93.98 5e-107 X-RAY
 2018-10-24 VAL C:113 C:112 0.0 0.0 E -130.9 147.2 0.0 0.0 0.0 HOH
 5.070
 N
 O
6bvl 3 P01112 93.98 5e-107 X-RAY
 2018-10-24 VAL C:113 C:112 0.0 0.0 E -130.6 146.7 0.0 0.0 0.0 HOH
 5.004
 N
 O
6bvm 3 P01112 93.98 5e-107 X-RAY
 2018-10-24 VAL C:113 C:112 0.0 0.0 E -131.3 147.9 0.0 0.0 0.0 HOH
 5.033
 N
 O
6cuo 3 P01112 93.98 5e-107 X-RAY
 2019-02-06 VAL C:113 C:112 0.0 0.0 E -130.4 148.3 0.0 0.0 0.0 HOH
 5.041
 N
 O
6cup 3 P01112 93.98 5e-107 X-RAY
 2019-02-06 VAL C:113 C:112 0.0 0.0 E -131.1 147.4 0.0 0.0 0.0 HOH
 5.010
 N
 O
6cur 3 P01112 93.98 5e-107 X-RAY
 2019-02-06 VAL C:113 C:112 0.0 0.0 E -131.0 148.5 0.0 0.0 0.0 HOH
 5.037
 N
 O
6d55 3 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL C:113 C:112 0.0 0.0 E -132.0 148.0 0.0 0.0 0.0 HOH
 5.018
 N
 O
6d56 3 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL C:113 C:112 0.0 0.0 E -130.2 147.4 0.0 0.0 0.0 HOH
 5.029
 N
 O
6d59 3 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL C:113 C:112 0.0 0.0 E -130.9 147.5 0.0 0.0 0.0 HOH
 5.049
 N
 O
6d5e 3 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL C:113 C:112 0.0 0.0 E -130.3 149.6 0.0 0.0 0.0 HOH
 4.990
 N
 O
6d5g 3 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL C:113 C:112 0.0 0.0 E -131.5 146.9 0.0 0.0 0.0 HOH
 4.938
 N
 O
6d5h 3 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL C:113 C:112 0.0 0.0 E -130.0 148.6 0.0 0.0 0.0 HOH
 5.032
 N
 O
6d5j 3 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL C:113 C:112 0.0 0.0 E -131.9 147.0 0.0 0.0 0.0 HOH
 5.000
 N
 O
6d5l 3 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL C:113 C:112 0.0 0.0 E -131.2 147.7 0.0 0.0 0.0 HOH
 5.042
 N
 O
6d5m 2 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL B:113 R:112 0.0 0.0 E -127.2 148.1 0.0 0.0 0.0 HOH
 5.043
 N
 O
6d5v 2 P01112 93.98 5e-107 X-RAY
 2018-09-19 VAL B:113 R:112 0.0 0.0 E -126.7 149.2 0.0 0.0 0.0 HOH
 5.036
 N
 O
6d5w 2 P01112 93.98 5e-107 X-RAY
 2019-03-27 VAL B:113 R:112 0.0 0.0 E -126.8 140.6 0.0 0.0 0.0 HOH
 7.260
 N
 O
6v94 3 P01112 93.98 5e-107 X-RAY
 2020-08-26 VAL C:113 C:112 0.0 0.0 E -132.6 146.8 0.0 0.0 0.0 HOH
 5.036
 N
 O
6v9f 3 P01112 93.98 5e-107 X-RAY
 2020-08-26 VAL C:113 C:112 0.0 0.0 E -130.0 148.8 0.0 0.0 0.0 HOH
 5.007
 N
 O
6v9j 3 P01112 93.98 5e-107 X-RAY
 2020-08-26 VAL C:113 C:112 0.0 0.0 E -130.9 147.3 0.0 0.0 0.0 HOH
 5.020
 N
 O
6v9l 3 P01112 93.98 5e-107 X-RAY
 2020-08-26 VAL C:113 C:112 0.0 0.0 E -131.1 146.9 0.0 0.0 0.0 HOH
 5.011
 N
 O
6v9m 3 P01112 93.98 5e-107 X-RAY
 2020-08-26 VAL C:113 C:112 0.0 0.0 E -131.9 150.9 0.0 0.0 0.0 HOH
 4.999
 N
 O
6v9n 3 P01112 93.98 5e-107 X-RAY
 2020-08-26 VAL C:113 C:112 0.0 0.0 E -129.9 147.1 0.0 0.0 0.0 HOH
 5.045
 N
 O
6v9o 3 P01112 93.98 5e-107 X-RAY
 2020-12-16 VAL C:113 C:112 0.0 0.0 E -132.6 148.1 0.0 0.0 0.0 HOH
 5.019
 N
 O
6zl3 1 P01112 93.98 5e-107 X-RAY
 2020-08-19 VAL A:113 A:112 0.0 0.0 E -135.1 129.2 0.0 0.0 0.0 HOH
 5.106
 N
 O
5wdo 1 P01112 93.98 6e-107 X-RAY
 2017-07-19 VAL A:116 A:112 0.0 0.0 E -136.4 135.3 0.0 0.0 0.0 HOH
 5.014
 HG23
 O
1xcm 1 P01112 92.81 7e-107 X-RAY
 2005-05-10 VAL A:112 A:112 0.0 0.0 E -134.1 131.4 0.0 0.0 0.0 HOH
 5.008
 N
 O
6ntc 1 P01112 93.37 7e-107 X-RAY
 2020-03-04 VAL A:117 A:112 0.0 0.0 E -140.1 127.6 0.0 0.0 0.0 HOH
 6.977
 N
 O
6ntd 1 P01112 93.37 7e-107 X-RAY
 2020-03-04 VAL A:117 A:112 0.0 0.0 E -142.0 122.4 0.0 0.0 0.0
2c5l 1 P01112 93.37 8e-107 X-RAY
 2006-02-20 VAL A:119 A:112 0.0 0.0 E -131.5 131.0 0.0 0.0 0.0 HOH
 5.141
 N
 O
VAL B:119 B:112 0.0 0.0 E -132.6 134.3 NA NA NA
4uru 1 P01112 93.98 9e-107 X-RAY
 2015-03-04 VAL A:131 R:112 0.0 0.0 E -142.9 137.2 0.0 0.0 0.0 HOH
 7.259
 N
 O
4urv 1 P01112 93.98 9e-107 X-RAY
 2015-03-04 VAL A:131 R:112 0.0 0.0 E -141.7 138.5 0.0 0.0 0.0 HOH
 4.782
 N
 O
4urw 1 P01112 93.98 9e-107 X-RAY
 2015-03-04 VAL A:131 R:112 0.0 0.0 E -140.2 144.1 0.0 0.0 0.0 HOH
 4.857
 N
 O
4urx 1 P01112 93.98 9e-107 X-RAY
 2015-03-04 VAL A:131 R:112 0.0 0.0 E -130.6 149.5 0.0 0.0 0.0 HOH
 4.949
 N
 O
4ury 1 P01112 93.98 9e-107 X-RAY
 2015-03-04 VAL A:131 R:112 0.0 0.0 E -135.2 135.6 0.0 0.0 0.0 HOH
 4.916
 N
 O
4urz 1 P01112 93.98 9e-107 X-RAY
 2015-03-04 VAL A:131 R:112 0.0 0.0 E -128.5 145.7 0.0 0.0 0.0 HOH
 4.903
 N
 O
4us0 1 P01112 93.98 9e-107 X-RAY
 2015-03-04 VAL A:131 R:112 0.0 0.0 E -136.1 139.7 0.0 0.0 0.0 HOH
 4.862
 N
 O
4us1 1 P01112 93.98 9e-107 X-RAY
 2015-03-04 VAL A:131 R:112 0.0 0.0 E -143.6 142.9 0.0 0.0 0.0 HOH
 7.944
 CG2
 O
4us2 1 P01112 93.98 9e-107 X-RAY
 2015-03-04 VAL A:131 R:112 0.0 0.0 E -138.7 148.2 0.0 0.0 0.0 HOH
 4.796
 N
 O
4efm 1 P01112 93.37 9e-107 X-RAY
 2012-05-16 VAL A:117 A:112 0.0 0.0 E -131.2 133.6 0.0 0.0 0.0 HOH
 5.143
 N
 O
4efl 1 P01112 93.98 9e-107 X-RAY
 2012-05-16 VAL A:117 A:112 0.0 0.0 E -130.8 131.3 0.0 0.0 0.0 HOH
 5.165
 N
 O
5b2z 1 P01112 93.98 9e-107 X-RAY
 2016-06-01 VAL A:117 A:112 0.0 0.0 E -133.0 133.4 0.0 0.0 0.0 HOH
 5.137
 N
 O
5b30 1 P01112 93.98 9e-107 X-RAY
 2016-06-01 VAL A:117 A:112 0.0 0.0 E -129.8 129.8 0.0 0.0 0.0 NA
HOH
 9.173
4.899
 N
N
 NA
O
1iaq 1 P01112 93.37 9e-107 X-RAY
 2001-06-06 VAL A:112 A:112 0.0 0.0 E -133.9 133.9 0.0 0.0 0.0
VAL B:112 B:112 0.0 0.0 E -134.2 133.2 NA NA NA
VAL C:112 C:112 0.0 0.0 E -134.6 133.6 NA NA NA
5zc6 1 P01112 93.37 9e-107 NMR
 2018-09-12 VAL A:112 A:112 0.0 0.0 E -147.6 126.9 0.0 0.0 0.0
1lfd 2 P01112 92.81 1e-106 X-RAY
 1999-05-04 VAL B:112 B:312 0.0 0.0 E -140.8 118.8 0.0 0.0 0.0 HOH
 5.735
 N
 O
VAL D:112 D:312 0.0 0.0 E -143.3 126.5 NA NA NA
2quz 1 P01112 93.37 1e-106 X-RAY
 2007-12-11 VAL A:112 A:112 0.0 0.0 E -133.2 133.3 0.0 0.0 0.0 HOH
 4.902
 N
 O
3k9l 1 P01112 93.37 1e-106 X-RAY
 2010-11-03 VAL A:112 A:112 0.0 0.0 E -127.7 135.8 0.0 0.0 0.0 HOH
 4.972
 N
 O
VAL B:112 B:112 0.0 0.0 E -132.1 133.5 NA NA NA
VAL C:112 C:112 0.0 0.0 E -137.0 134.6 NA NA NA
3k9n 1 P01112 93.37 1e-106 X-RAY
 2010-03-02 VAL A:112 A:112 0.0 0.0 E -135.8 132.0 0.0 0.0 0.0 HOH
 4.965
 N
 O
4xvr 1 P01112 93.37 1e-106 X-RAY
 2015-06-17 VAL A:112 A:112 0.0 0.0 E -123.4 136.5 0.0 0.0 0.0 HOH
 4.803
 N
 O
3v4f 1 P20171 93.37 1e-106 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -133.1 136.2 0.0 0.0 0.0 HOH
 4.993
 N
 O
4dlr 1 P01112 93.37 1e-106 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -135.5 136.5 0.0 0.0 0.0 MG
HOH
 7.164
5.498
 CG2
N
 MG
O
4dlv 1 P01112 93.37 1e-106 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -134.6 133.7 0.0 0.0 0.0 HOH
 4.984
 N
 O
4dlx 1 P01112 93.37 1e-106 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -134.9 134.6 0.0 0.0 0.0 HOH
 5.053
 N
 O
4dly 1 P01112 93.37 1e-106 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -131.6 134.3 0.0 0.0 0.0 CA
HOH
 8.806
4.925
 N
N
 CA
O
4dlz 1 P01112 93.37 1e-106 X-RAY
 2012-08-08 VAL A:112 A:112 0.0 0.0 E -134.3 135.8 0.0 0.0 0.0 HOH
 5.239
 N
 O
3lo5 1 P01112 93.37 1e-106 X-RAY
 2010-03-02 VAL A:112 A:112 0.0 0.0 E -124.3 139.5 0.0 0.0 0.0 HOH
 5.318
 N
 O
VAL B:112 C:112 0.0 0.0 E -122.8 139.4 NA NA NA
VAL C:112 E:112 0.0 0.0 E -130.0 137.9 NA NA NA
1xj0 1 P01112 93.37 2e-106 X-RAY
 2005-05-10 VAL A:112 A:112 0.0 0.0 E -134.2 131.6 0.0 0.0 0.0 MG
HOH
 9.289
4.877
 CG2
N
 MG
O
2rgb 1 P01112 93.37 2e-106 X-RAY
 2007-12-18 VAL A:112 A:112 0.0 0.0 E -139.4 133.1 0.0 0.0 0.0 HOH
 5.009
 N
 O
221p 1 P01112 93.37 2e-106 X-RAY
 1994-01-31 VAL A:112 A:112 0.0 0.0 E -143.2 146.4 0.0 0.0 0.0 HOH
 7.206
 N
 O
2x1v 1 P01112 93.37 2e-106 X-RAY
 2010-01-12 VAL A:112 A:112 0.0 0.0 E -129.2 135.0 0.0 0.0 0.0 HOH
 4.971
 N
 O
5wdp 1 P01112 93.37 2e-106 X-RAY
 2017-07-19 VAL A:112 A:112 0.0 0.0 E -134.7 137.0 0.0 0.0 0.0 HOH
 4.948
 HG23
 O
621p 1 P01112 93.37 2e-106 X-RAY
 1994-01-31 VAL A:112 A:112 0.0 0.0 E -154.3 127.1 0.0 0.0 0.0 HOH
 7.115
 N
 O
521p 1 P01112 92.77 2e-106 X-RAY
 1994-01-31 VAL A:112 A:112 0.0 0.0 E -149.3 133.0 0.0 0.0 0.0
5uhv 1 P01111 93.98 2e-106 X-RAY
 2017-06-28 VAL A:112 A:112 0.0 0.0 E -127.9 134.5 0.0 0.0 0.0 HOH
 5.014
 N
 O
1lf0 1 P01112 93.37 2e-106 X-RAY
 2002-11-06 VAL A:112 A:112 0.0 0.0 E -136.9 134.9 0.0 0.0 0.0 HOH
 4.985
 N
 O
1lf5 1 P01112 93.37 2e-106 X-RAY
 2002-11-06 VAL A:112 A:112 0.0 0.0 E -133.0 131.6 0.0 0.0 0.0 HOH
 4.902
 N
 O
1nvu 1 P01112 93.37 2e-106 X-RAY
 2003-04-01 VAL A:112 Q:112 0.0 0.0 E -133.4 135.3 0.0 0.0 0.0 PO4
HOH
 9.535
8.597
 CG2
N
 O4
O
VAL B:112 R:112 0.0 0.0 E -131.0 137.0 0.0 0.0 0.0 HOH
 4.973
 N
 O
1nvx 1 P01112 93.37 2e-106 X-RAY
 2003-04-01 VAL A:112 Q:112 0.0 0.0 E -126.4 147.3 0.0 0.0 0.0
VAL B:112 R:112 0.0 0.0 E -127.9 139.6 0.0 0.0 0.0
2lcf 1 P01112 93.37 3e-106 NMR
 2011-09-28 VAL A:118 A:112 0.0 0.0 E -145.2 145.9 0.0 0.0 0.0
2lwi 1 P01112 93.37 3e-106 NMR
 2013-05-22 VAL A:118 A:112 0.0 0.0 E -140.5 149.5 0.0 0.0 0.0
2n42 1 P01112 93.37 3e-106 NMR
 2015-07-01 VAL A:118 A:112 2.0 0.013 E -138.9 135.6 2.0 0.013 0.0
2n46 1 P01112 93.37 3e-106 NMR
 2015-07-01 VAL A:118 A:112 1.0 0.006 E -134.6 138.2 1.0 0.006 0.0
3kkm 1 P01112 93.37 3e-106 X-RAY
 2010-06-16 VAL A:118 A:112 0.0 0.0 E -129.4 132.6 0.0 0.0 0.0 HOH
 5.017
 N
 O
3kkn 1 P01112 93.37 3e-106 X-RAY
 2010-06-16 VAL A:118 A:112 0.0 0.0 E -130.3 130.2 0.0 0.0 0.0 HOH
 5.209
 N
 O
3i3s 1 P01112 93.37 3e-106 X-RAY
 2009-12-22 VAL A:112 R:112 0.0 0.0 E -133.6 136.2 0.0 0.0 0.0 HOH
 4.961
 N
 O
5wdq 1 P01112 93.37 3e-106 X-RAY
 2017-07-19 VAL A:116 A:112 0.0 0.0 E -133.3 135.9 0.0 0.0 0.0 MG
HOH
 9.497
5.106
 HG22
N
 MG
O
2cld 1 P01112 93.37 4e-106 X-RAY
 2006-05-31 VAL A:112 X:112 0.0 0.0 E -133.1 140.8 0.0 0.0 0.0 HOH
 4.906
 N
 O
1nvv 1 P01112 93.37 5e-106 X-RAY
 2003-04-01 VAL A:112 Q:112 0.0 0.0 E -134.5 134.1 0.0 0.0 0.0 PO4
 9.647
 CG2
 O4
1xd2 1 P01112 93.37 5e-106 X-RAY
 2004-11-02 VAL A:112 A:112 0.0 0.0 E -126.7 136.7 0.0 0.0 0.0
4nyj 1 P01112 93.37 5e-106 X-RAY
 2014-03-12 VAL A:112 Q:112 0.0 0.0 E -138.3 137.4 0.0 0.0 0.0
4nym 1 P01112 93.37 5e-106 X-RAY
 2014-03-12 VAL A:112 Q:112 0.0 0.0 E -152.3 117.9 0.0 0.0 0.0
7dph 1 P01112 93.37 5e-106 X-RAY
 2021-07-28 VAL A:117 A:112 0.0 0.0 E -126.6 131.2 0.0 0.0 0.0 NA
HOH
 9.155
4.896
 N
N
 NA
O
1zvq 1 P01112 93.37 5e-106 X-RAY
 2006-03-14 VAL A:112 A:112 0.0 0.0 E -131.6 132.2 0.0 0.0 0.0 HOH
 4.893
 N
 O
1zw6 1 P01112 93.37 5e-106 X-RAY
 2006-03-14 VAL A:112 A:112 0.0 0.0 E -134.5 136.3 0.0 0.0 0.0 HOH
 5.086
 N
 O
2rgd 1 P01112 93.37 6e-106 X-RAY
 2007-12-18 VAL A:112 A:112 0.0 0.0 E -144.6 130.9 0.0 0.0 0.0 HOH
 5.067
 N
 O
3oiu 1 P01112 93.37 6e-106 X-RAY
 2010-12-08 VAL A:112 A:112 0.0 0.0 E -134.7 136.0 0.0 0.0 0.0 CA
ACT
HOH
 9.122
8.789
5.170
 N
N
N
 CA
O
O
4g3x 1 P01112 93.37 6e-106 X-RAY
 2013-07-17 VAL A:112 A:112 1.0 0.006 -158.7 146.4 1.0 0.006 0.0 HOH
 8.194
 N
 O
721p 1 P01112 93.37 6e-106 X-RAY
 1994-01-31 VAL A:112 A:112 0.0 0.0 E -138.8 131.9 0.0 0.0 0.0 HOH
 4.974
 N
 O
2rgc 1 P01112 93.37 7e-106 X-RAY
 2007-12-18 VAL A:112 A:112 0.0 0.0 E -139.1 132.3 0.0 0.0 0.0 HOH
 4.976
 N
 O
4nyi 1 P01112 93.37 7e-106 X-RAY
 2014-03-12 VAL A:113 Q:112 0.0 0.0 E -124.6 141.9 0.0 0.0 0.0 HOH
 9.904
 O
 O
6bvi 1 P01112 93.37 7e-106 X-RAY
 2018-10-24 VAL A:113 A:112 0.0 0.0 E -132.5 134.2 0.0 0.0 0.0 HOH
 5.263
 N
 O
6bvk 1 P01112 93.37 7e-106 X-RAY
 2018-10-24 VAL A:113 A:112 0.0 0.0 E -133.9 134.0 0.0 0.0 0.0 HOH
 5.280
 N
 O
6bvl 1 P01112 93.37 7e-106 X-RAY
 2018-10-24 VAL A:113 A:112 0.0 0.0 E -134.4 134.2 0.0 0.0 0.0 HOH
 5.263
 N
 O
6bvm 1 P01112 93.37 7e-106 X-RAY
 2018-10-24 VAL A:113 A:112 0.0 0.0 E -133.7 133.9 0.0 0.0 0.0 HOH
 5.241
 N
 O
6cuo 1 P01112 93.37 7e-106 X-RAY
 2019-02-06 VAL A:113 A:112 0.0 0.0 E -133.9 133.8 0.0 0.0 0.0 HOH
 5.256
 N
 O
6cup 1 P01112 93.37 7e-106 X-RAY
 2019-02-06 VAL A:113 A:112 0.0 0.0 E -132.6 134.4 0.0 0.0 0.0 HOH
 5.276
 N
 O
6cur 1 P01112 93.37 7e-106 X-RAY
 2019-02-06 VAL A:113 A:112 0.0 0.0 E -134.1 134.3 0.0 0.0 0.0 HOH
 5.284
 N
 O
6d55 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 A:112 0.0 0.0 E -130.8 136.5 0.0 0.0 0.0 HOH
 5.172
 N
 O
6d56 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 A:112 0.0 0.0 E -132.4 134.0 0.0 0.0 0.0 HOH
 5.283
 N
 O
6d59 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 A:112 0.0 0.0 E -131.7 134.8 0.0 0.0 0.0 HOH
 5.297
 N
 O
6d5e 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 A:112 0.0 0.0 E -130.9 134.6 0.0 0.0 0.0 HOH
 5.180
 N
 O
6d5g 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 A:112 0.0 0.0 E -133.8 134.8 0.0 0.0 0.0 HOH
 5.208
 N
 O
6d5h 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 A:112 0.0 0.0 E -131.8 135.6 0.0 0.0 0.0 HOH
 5.233
 N
 O
6d5j 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 A:112 0.0 0.0 E -131.5 134.3 0.0 0.0 0.0 HOH
 5.248
 N
 O
6d5l 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 A:112 0.0 0.0 E -133.4 134.0 0.0 0.0 0.0 HOH
 5.197
 N
 O
6d5m 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 Q:112 0.0 0.0 E -132.2 134.3 0.0 0.0 0.0 HOH
 5.236
 N
 O
6d5v 1 P01112 93.37 7e-106 X-RAY
 2018-09-19 VAL A:113 Q:112 0.0 0.0 E -131.5 134.6 0.0 0.0 0.0 HOH
 5.222
 N
 O
6d5w 1 P01112 93.37 7e-106 X-RAY
 2019-03-27 VAL A:113 Q:112 0.0 0.0 E -126.7 134.4 0.0 0.0 0.0 HOH
 4.475
 N
 O
6v94 1 P01112 93.37 7e-106 X-RAY
 2020-08-26 VAL A:113 A:112 0.0 0.0 E -136.8 133.2 0.0 0.0 0.0 HOH
 5.228
 N
 O
6v9f 1 P01112 93.37 7e-106 X-RAY
 2020-08-26 VAL A:113 A:112 0.0 0.0 E -132.2 133.7 0.0 0.0 0.0 HOH
 5.232
 N
 O
6v9j 1 P01112 93.37 7e-106 X-RAY
 2020-08-26 VAL A:113 A:112 0.0 0.0 E -136.4 134.4 0.0 0.0 0.0 HOH
 5.175
 N
 O
6v9l 1 P01112 93.37 7e-106 X-RAY
 2020-08-26 VAL A:113 A:112 0.0 0.0 E -136.9 134.0 0.0 0.0 0.0 HOH
 5.188
 N
 O
6v9m 1 P01112 93.37 7e-106 X-RAY
 2020-08-26 VAL A:113 A:112 0.0 0.0 E -132.1 135.0 0.0 0.0 0.0 HOH
 5.203
 N
 O
6v9n 1 P01112 93.37 7e-106 X-RAY
 2020-08-26 VAL A:113 A:112 0.0 0.0 E -136.2 135.0 0.0 0.0 0.0 HOH
 5.296
 N
 O
6v9o 1 P01112 93.37 7e-106 X-RAY
 2020-12-16 VAL A:113 A:112 0.0 0.0 E -132.9 134.4 0.0 0.0 0.0 HOH
 5.237
 N
 O
3ddc 1 P01112 92.77 7e-106 X-RAY
 2008-07-15 VAL A:112 A:112 0.0 0.0 E -127.1 134.5 0.0 0.0 0.0 HOH
 8.450
 CG1
 O
2rga 1 P01112 93.37 8e-106 X-RAY
 2007-12-18 VAL A:112 A:112 0.0 0.0 E -141.5 131.1 0.0 0.0 0.0 HOH
 5.181
 N
 O
2rgg 1 P01112 93.37 8e-106 X-RAY
 2007-12-18 VAL A:112 A:112 0.0 0.0 E -133.9 131.6 0.0 0.0 0.0 HOH
 4.998
 N
 O
4xvq 1 P01112 93.37 9e-106 X-RAY
 2015-06-17 VAL A:112 A:112 0.0 0.0 E -123.7 129.3 0.0 0.0 0.0 HOH
 4.793
 N
 O
5vbe 1 P01112 93.37 9e-106 X-RAY
 2017-10-25 VAL A:117 A:112 0.0 0.0 E -129.6 132.5 0.0 0.0 0.0 HOH
 4.492
 HG21
 O
5vbz 1 P01112 93.37 9e-106 X-RAY
 2017-10-25 VAL A:117 A:112 0.0 0.0 E -137.7 133.8 0.0 0.0 0.0 HOH
 5.042
 HG23
 O
VAL B:117 B:112 1.0 0.006 E -129.7 139.8 NA NA NA
VAL C:117 C:112 0.0 0.0 E -135.8 132.1 NA NA NA
4efn 1 P01112 93.37 1e-105 X-RAY
 2012-05-16 VAL A:117 A:112 0.0 0.0 E -127.1 134.0 0.0 0.0 0.0 HOH
 5.433
 N
 O
7dpj 1 P01112 93.37 1e-105 X-RAY
 2021-07-28 VAL A:117 A:112 0.0 0.0 E -129.7 133.3 0.0 0.0 0.0 HOH
 4.850
 N
 O
6wgh 1 P01111 88.33 1e-105 X-RAY
 2020-05-20 VAL A:123 A:122 0.0 0.0 E -133.1 134.4 0.0 0.0 0.0 HOH
 5.076
 N
 O
VAL B:123 B:122 0.0 0.0 E -132.2 137.2 NA NA NA
7jhp 1 P01112 93.37 2e-105 X-RAY
 2020-08-05 VAL A:112 A:112 0.0 0.0 E -137.5 111.5 0.0 0.0 0.0 HOH
 8.984
 CG2
 O
2ce2 1 P01112 92.77 3e-104 X-RAY
 2006-08-23 VAL A:112 X:112 0.0 0.0 E -140.9 141.0 0.0 0.0 0.0 HOH
 4.935
 N
 O
2cl0 1 P01112 92.77 3e-104 X-RAY
 2006-05-31 VAL A:112 X:112 0.0 0.0 E -130.1 134.7 0.0 0.0 0.0 MG
HOH
 9.111
5.138
 CG2
N
 MG
O
2cl6 1 P01112 92.77 3e-104 X-RAY
 2006-05-24 VAL A:112 X:112 0.0 0.0 E -132.1 130.1 0.0 0.0 0.0 HOH
 5.038
 N
 O
2cl7 1 P01112 92.77 3e-104 X-RAY
 2006-05-24 VAL A:112 X:112 0.0 0.0 E -138.9 146.1 0.0 0.0 0.0 MG
HOH
 8.687
4.879
 N
N
 MG
O
2clc 1 P01112 92.77 3e-104 X-RAY
 2006-05-24 VAL A:112 X:112 0.0 0.0 E -141.1 147.6 0.0 0.0 0.0 MG
HOH
 8.650
4.876
 N
N
 MG
O
2evw 1 P01112 92.77 3e-104 X-RAY
 2006-05-30 VAL A:112 X:112 0.0 0.0 E -146.7 146.6 0.0 0.0 0.0 HOH
 4.915
 N
 O

AlphaFold DB

Entity Residue Monomer View
ID Entity Uniprot Identity Evalue Name Label Auth ASA rASA SS φ ψ
af-p01116-f1 1 P01116 100.0 3e-141 VAL A:112 A:112 0.0 0.0 E -133.4 130.2
af-p01111-f1 1 P01111 86.84 2e-112 VAL A:112 A:112 0.0 0.0 E -132.7 129.0
af-p01112-f1 1 P01112 86.77 3e-112 VAL A:112 A:112 0.0 0.0 E -130.8 129.3