Variant

Genome Chromosome Position VCF ID Ref Alt mRNA Change mRNA Info
GRCh37 chr11 2182077 . A C CCDS41598.1:NM_001042376.2:c.125gTg>gGg_NP_001035835.1:p.42V>G Homo sapiens INS-IGF2 readthrough (INS-IGF2), transcript variant 2, 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)
6b3q 2 P01308 88.73 1e-32 EM
 2017-11-22 VAL C:42 NA:NA DO NA DO DO DO NA NA NA
VAL D:42 NA:NA DO NA DO DO DO NA NA NA
6b70 4 P01308 88.73 1e-32 EM
 2017-12-27 VAL G:42 NA:NA DO NA DO DO DO NA NA NA
VAL H:42 NA:NA DO NA DO DO DO NA NA NA
6bfc 2 P01308 88.73 1e-32 EM
 2017-12-27 VAL C:42 a:18 122.0 0.787 -117.8 -10.7 122.0 0.787 0.0
VAL D:42 b:18 145.0 0.935 -124.8 80.3 104.0 0.671 0.264 B:P14735:0.265
6jk8 2 P01308 88.73 1e-32 EM
 2020-03-04 VAL C:42 NA:NA DO NA DO DO DO NA NA NA
VAL D:42 D:18 136.0 0.877 S -99.0 -61.4 54.0 0.348 0.529 C:P01308:0.49
A:P08069:0.116
6tc2 1 P01308 88.73 1e-32 X-RAY
 2020-11-11 VAL A:42 NA:NA DO NA DO DO DO NA NA NA
VAL B:42 B:18 117.0 0.755 H -68.2 -40.3 17.0 0.11 0.645 A:P01308:0.555
G:P01308:0.174
 HC4
HOH
 6.319
2.644
 N
O
 H2
O
VAL C:42 NA:NA DO NA DO DO DO NA NA NA
VAL D:42 D:18 119.0 0.768 H -73.7 -40.6 4.0 0.026 0.742 C:P01308:0.587
J:P01308:0.265
 HC4
HOH
 6.807
2.988
 HG21
O
 H2'
O
VAL E:42 NA:NA DO NA DO DO DO NA NA NA
VAL F:42 F:18 102.0 0.658 H -71.4 -44.9 8.0 0.052 0.606 K:P01308:0.187
E:P01308:0.49
 HC4
HC4
HOH
 9.956
6.443
3.038
 C
N
O
 O1
H3
O
VAL G:42 NA:NA DO NA DO DO DO NA NA NA
VAL H:42 H:18 98.0 0.632 H -72.1 -43.8 4.0 0.026 0.606 A:P01308:0.11
G:P01308:0.445
B:P01308:0.161
 HC4
HOH
 7.523
5.500
 HG21
N
 H6'
O
VAL I:42 NA:NA DO NA DO DO DO NA NA NA
VAL J:42 J:18 69.0 0.445 H -74.3 -28.7 9.0 0.058 0.387 C:P01308:0.129
I:P01308:0.297
 HC4
HOH
 6.458
3.429
 N
O
 H3
O
VAL K:42 NA:NA DO NA DO DO DO NA NA NA
VAL L:42 L:18 123.0 0.794 H -70.6 -38.1 23.0 0.148 0.646 K:P01308:0.535
F:P01308:0.097
E:P01308:0.129
 HC4
HOH
 6.989
2.947
 HG21
O
 H2'
O
6zi8 1 P01317 83.33 2e-21 X-RAY
 2021-01-20 VAL A:42 NA:NA DO NA DO DO DO NA NA NA
VAL B:42 B:18 108.0 0.697 H -68.2 -49.4 21.0 0.135 0.562 A:P01317:0.465
C:P01317:0.123
D:P01317:0.052
 HOH
 5.839
 CG1
 O
VAL C:42 NA:NA DO NA DO DO DO NA NA NA
VAL D:42 D:18 118.0 0.761 H -67.3 -44.4 0.0 0.0 0.761 B:P01317:0.361
C:P01317:0.548
A:P01317:0.103
 HOH
 2.865
 O
 O
6k59 2 ? 100.0 6e-19 NMR
 2020-05-06 VAL B:18 B:18 79.0 0.51 H -105.2 -54.3 65.0 0.419 0.091 A:None:0.09
2kxk 2 P01308 96.88 2e-18 NMR
 2011-06-01 VAL B:18 B:18 95.0 0.613 H -78.9 -30.6 25.0 0.161 0.452 A:P01308:0.452
5mwq 2 P01308 96.88 2e-18 NMR
 2018-02-14 VAL B:18 B:18 126.0 0.813 H -68.8 -47.3 NA NA NA
2lgb 2 P01308 100.0 4e-18 NMR
 2012-04-11 VAL B:18 B:118 135.0 0.871 H -67.1 -32.3 50.0 0.323 0.548 A:P01308:0.548
1ben 2 P01308 100.0 3e-17 X-RAY
 1996-07-11 VAL B:18 B:18 74.0 NA H -68.2 -39.9 29.0 NA NA A:P01308:NA
 HOH
 3.345
 O
 O
VAL D:18 D:18 114.0 0.735 H -71.0 -44.5 NA NA NA
1ev3 2 P01308 100.0 3e-17 X-RAY
 2000-12-04 VAL B:18 B:18 99.0 0.639 H -65.0 -42.5 20.0 0.129 0.51 A:P01308:0.413
C:P01308:0.116
 CRS
HOH
 8.048
3.193
 N
O
 C7
O
VAL D:18 D:18 121.0 0.781 H -72.0 -42.4 17.0 0.11 0.671 C:P01308:0.568
B:P01308:0.006
A:P01308:0.123
 CRS
CRS
CRS
HOH
 7.215
3.667
8.314
3.277
 CG2
CG1
N
O
 C7
O1
C7
O
1ev6 2 P01308 100.0 3e-17 X-RAY
 2000-12-04 VAL B:18 B:18 93.0 0.6 H -71.1 -41.7 16.0 0.103 0.497 A:P01308:0.419
G:P01308:0.135
 CRS
CRS
CRS
HOH
 7.215
7.998
4.980
4.577
 CG1
N
CG1
O
 C7
C7
C4
O
VAL D:18 D:18 119.0 0.768 H -71.3 -38.3 23.0 0.148 0.62 C:P01308:0.529
I:P01308:0.103
 CRS
CRS
HOH
 7.172
8.265
2.611
 CG2
N
O
 C7
C7
O
VAL F:18 F:18 114.0 0.735 H -63.4 -45.6 22.0 0.142 0.593 K:P01308:0.123
L:P01308:0.065
E:P01308:0.445
 CRS
CRS
HOH
 6.987
7.901
3.210
 CG2
N
O
 C7
C7
O
VAL H:18 H:18 102.0 0.658 H -70.6 -40.2 17.0 0.11 0.548 A:P01308:0.103
G:P01308:0.484
 CRS
CRS
CRS
HOH
 8.094
7.295
4.342
3.500
 N
CG2
CG1
O
 C7
C7
O1
O
VAL J:18 J:18 105.0 0.677 H -67.0 -40.0 10.0 0.065 0.612 C:P01308:0.135
I:P01308:0.497
 CRS
CRS
HOH
 7.934
7.217
3.775
 N
CG2
O
 C7
C7
O
VAL L:18 L:18 93.0 0.6 H -63.9 -36.8 32.0 0.206 0.394 K:P01308:0.394
 CRS
CRS
HOH
 8.075
7.229
3.402
 N
CG1
O
 C7
C7
O
1evr 2 P01308 100.0 3e-17 X-RAY
 2000-12-04 VAL B:18 B:18 103.0 0.665 H -71.7 -37.0 18.0 0.116 0.549 A:P01308:0.465
G:P01308:0.142
 RCO
RCO
RCO
HOH
 7.482
4.971
8.056
4.840
 CG1
CB
N
N
 O3
O1
O3
O
VAL D:18 D:18 124.0 0.8 H -64.6 -42.8 32.0 0.206 0.594 C:P01308:0.497
I:P01308:0.135
 RCO
RCO
HOH
 7.141
8.084
3.301
 CG2
N
O
 O3
O3
O
VAL F:18 F:18 121.0 0.781 H -72.7 -43.7 27.0 0.174 0.607 K:P01308:0.116
L:P01308:0.077
E:P01308:0.503
 RCO
RCO
HOH
 7.119
8.001
4.962
 CG2
N
N
 O3
O3
O
VAL H:18 H:18 121.0 0.781 H -75.2 -40.9 27.0 0.174 0.607 A:P01308:0.11
G:P01308:0.542
 RCO
RCO
RCO
HOH
 8.191
4.969
7.493
4.244
 N
CG1
CG2
O
 O3
O3
O3
O
VAL J:18 J:18 106.0 0.684 H -64.8 -45.6 13.0 0.084 0.6 C:P01308:0.123
I:P01308:0.516
 RCO
RCO
HOH
 7.918
7.442
4.416
 N
CG2
CG1
 O3
O3
O
VAL L:18 L:18 90.0 0.581 H -76.0 -36.1 9.0 0.058 0.523 K:P01308:0.445
E:P01308:0.11
 RCO
RCO
HOH
 7.861
7.550
5.065
 N
CG1
N
 O3
O3
O
1fu2 2 P01308 100.0 3e-17 POWDER DIFFRACTION
 2000-10-16 VAL B:18 B:18 92.0 0.594 H -111.3 -24.0 40.0 0.258 0.336 A:P01308:0.335
VAL D:18 D:18 129.0 0.832 H -52.9 -28.2 65.0 0.419 0.413 C:P01308:0.413
VAL F:18 F:18 96.0 0.619 H -106.1 -33.8 50.0 0.323 0.296 E:P01308:0.297
VAL H:18 H:18 111.0 0.716 H -57.4 -40.4 40.0 0.258 0.458 G:P01308:0.458
1fub 2 P01308 100.0 3e-17 POWDER DIFFRACTION
 2000-10-16 VAL B:18 B:18 93.0 0.6 H -87.5 -55.9 35.0 0.226 0.374 A:P01308:0.374
VAL D:18 D:18 109.0 0.703 H -59.5 -54.1 24.0 0.155 0.548 C:P01308:0.548
1g7a 2 P01308 100.0 3e-17 X-RAY
 2001-08-03 VAL B:18 B:18 76.0 0.49 H -64.0 -39.2 6.0 0.039 0.451 A:P01308:0.368
C:P01308:0.135
 ZN
CL
CL
HOH
 7.911
8.763
5.820
2.929
 N
N
N
O
 ZN
CL
CL
O
VAL D:18 D:18 100.0 0.645 H -68.3 -41.6 6.0 0.039 0.606 B:P01308:0.252
C:P01308:0.445
 ZN
CL
CL
HOH
 7.987
6.982
7.086
2.611
 HG21
HG22
HG21
HG13
 ZN
CL
CL
O
VAL F:18 F:18 76.0 0.49 H -71.6 -41.0 NA NA NA
VAL H:18 H:18 100.0 0.645 H -74.5 -48.0 NA NA NA
1g7b 2 P01308 100.0 3e-17 X-RAY
 2001-08-03 VAL B:18 B:18 77.0 0.497 H -64.3 -38.5 5.0 0.032 0.465 C:P01308:0.142
A:P01308:0.374
 ZN
CL
CL
HOH
 7.931
8.781
5.832
2.897
 N
N
N
O
 ZN
CL
CL
O
VAL D:18 D:18 99.0 0.639 H -68.6 -43.1 6.0 0.039 0.6 B:P01308:0.252
C:P01308:0.452
 ZN
CL
CL
HOH
 7.999
6.847
7.086
2.679
 HG23
HG23
HG22
HG13
 ZN
CL
CL
O
VAL F:18 F:18 75.0 0.484 H -73.2 -39.7 NA NA NA
VAL H:18 H:18 99.0 0.639 H -74.1 -47.0 NA NA NA
1guj 2 P01308 100.0 3e-17 X-RAY
 2002-03-08 VAL B:18 B:18 110.0 0.71 H -74.5 -31.6 38.0 0.245 0.465 A:P01308:0.465
 HOH
 2.821
 O
 O
VAL D:18 D:18 108.0 0.697 H -74.9 -20.2 NA NA NA
1j73 2 P01308 100.0 3e-17 X-RAY
 2001-05-30 VAL B:18 B:18 81.0 0.523 H -55.0 -45.2 11.0 0.071 0.452 C:P01308:0.11
A:P01308:0.374
 HOH
 4.161
 O
 O
VAL D:18 D:18 108.0 0.697 H -70.8 -50.1 5.0 0.032 0.665 B:P01308:0.187
C:P01308:0.535
 HOH
 2.850
 O
 O
1jca 2 P01308 100.0 3e-17 X-RAY
 2001-06-20 VAL B:18 B:18 81.0 0.523 H -58.2 -37.2 22.0 0.142 0.381 A:P01308:0.381
 HOH
 2.996
 O
 O
VAL D:18 D:18 118.0 0.761 H -64.2 -40.9 NA NA NA
1mso 2 P01308 100.0 3e-17 X-RAY
 2003-03-04 VAL B:18 B:18 102.0 0.658 H -64.8 -41.8 16.0 0.103 0.555 D:P01308:0.065
A:P01308:0.465
C:P01308:0.123
 HOH
 2.378
 HG12
 O
VAL D:18 D:18 116.0 0.748 H -74.0 -34.1 0.0 0.0 0.748 C:P01308:0.542
B:P01308:0.368
A:P01308:0.09
 HOH
 5.339
 N
 O
1os3 2 P01308 100.0 3e-17 X-RAY
 2003-07-29 VAL B:18 B:18 122.0 0.787 H -76.4 -40.7 1.0 0.006 0.781 C:P01308:0.116
D:P01308:0.439
A:P01308:0.516
 HOH
 3.392
 O
 O
VAL D:18 D:18 117.0 0.755 H -71.1 -41.5 0.0 0.0 0.755 B:P01308:0.355
C:P01308:0.568
A:P01308:0.084
 HOH
 2.925
 O
 O
1os4 2 P01308 100.0 3e-17 X-RAY
 2003-07-29 VAL B:18 B:18 121.0 0.781 H -76.0 -44.9 1.0 0.006 0.775 L:P01308:0.4
A:P01308:0.49
K:P01308:0.116
VAL D:18 D:18 114.0 0.735 H -68.7 -46.7 1.0 0.006 0.729 C:P01308:0.49
E:P01308:0.084
F:P01308:0.342
 HOH
 9.736
 N
 O
VAL F:18 F:18 128.0 0.826 H -74.9 -43.4 2.0 0.013 0.813 D:P01308:0.394
C:P01308:0.129
E:P01308:0.561
VAL H:18 H:18 111.0 0.716 H -67.4 -46.3 0.0 0.0 0.716 J:P01308:0.31
I:P01308:0.097
G:P01308:0.516
VAL J:18 J:18 126.0 0.813 H -66.1 -30.3 0.0 0.0 0.813 G:P01308:0.142
I:P01308:0.561
H:P01308:0.342
 HOH
 3.636
 O
 O
VAL L:18 L:18 112.0 0.723 H -75.7 -40.4 1.0 0.006 0.717 B:P01308:0.342
A:P01308:0.09
K:P01308:0.51
1q4v 2 AAA59172 100.0 3e-17 X-RAY
 2003-08-19 VAL B:18 B:18 87.0 0.561 H -68.3 -35.7 21.0 0.135 0.426 A:AAA59172:0.426
 HOH
 3.930
 O
 O
VAL D:18 D:18 101.0 0.652 H -73.1 -53.6 NA NA NA
1rwe 2 P01308 100.0 3e-17 X-RAY
 2005-02-15 VAL B:18 B:18 78.0 0.503 H -62.8 -44.3 23.0 0.148 0.355 A:P01308:0.355
 HOH
 4.956
 N
 O
VAL D:18 D:18 93.0 0.6 H -67.2 -46.0 NA NA NA
1trz 2 P01308 100.0 3e-17 X-RAY
 1994-01-31 VAL B:18 B:18 79.0 0.51 H -68.8 -36.1 24.0 0.155 0.355 A:P01308:0.355
 HOH
 3.544
 O
 O
VAL D:18 D:18 112.0 0.723 H -75.3 -43.4 NA NA NA
1tyl 2 P01308 100.0 3e-17 X-RAY
 1994-09-30 VAL B:18 B:18 80.0 0.516 H -65.9 -39.1 23.0 0.148 0.368 A:P01308:0.368
 HOH
 2.771
 O
 O
VAL D:18 D:18 123.0 0.794 H -71.7 -46.1 NA NA NA
1tym 2 P01308 100.0 3e-17 X-RAY
 1994-09-30 VAL B:18 B:18 82.0 0.529 H -63.7 -38.6 22.0 0.142 0.387 A:P01308:0.387
 HOH
 2.600
 O
 O
VAL D:18 D:18 121.0 0.781 H -73.9 -42.1 NA NA NA
1xw7 2 P01308 100.0 3e-17 X-RAY
 2005-04-12 VAL B:18 B:18 102.0 0.658 H -73.0 -39.9 32.0 0.206 0.452 A:P01308:0.452
 IPH
HOH
 7.759
3.038
 CG2
O
 C5
O
VAL D:18 D:18 97.0 0.626 H -65.0 -47.8 NA NA NA
1znj 2 P01308 100.0 3e-17 X-RAY
 1998-01-28 VAL B:18 B:18 110.0 0.71 H -69.4 -42.4 12.0 0.077 0.633 A:P01308:0.523
G:P01308:0.174
 IPH
IPH
HOH
 8.325
9.110
3.248
 CG2
N
O
 C5
C5
O
VAL D:18 D:18 121.0 0.781 H -61.1 -46.8 24.0 0.155 0.626 C:P01308:0.497
I:P01308:0.155
 IPH
IPH
HOH
 8.043
9.193
3.458
 CG2
N
O
 C5
C5
O
VAL F:18 F:18 123.0 0.794 H -66.6 -45.6 24.0 0.155 0.639 K:P01308:0.148
L:P01308:0.077
E:P01308:0.516
 IPH
IPH
HOH
 7.817
8.893
5.238
 CG2
N
N
 C5
C5
O
VAL H:18 H:18 124.0 0.8 H -69.4 -44.3 30.0 0.194 0.606 B:P01308:0.006
A:P01308:0.116
G:P01308:0.542
 IPH
IPH
HOH
 9.290
8.181
3.850
 N
CG2
CG1
 C5
C5
O
VAL J:18 J:18 116.0 0.748 H -59.0 -48.8 21.0 0.135 0.613 C:P01308:0.135
I:P01308:0.516
 IPH
IPH
HOH
 8.884
8.058
3.347
 N
CG2
O
 C5
C5
O
VAL L:18 L:18 99.0 0.639 H -64.3 -44.3 6.0 0.039 0.6 K:P01308:0.497
E:P01308:0.123
 IPH
IPH
HOH
 9.014
8.108
2.415
 N
CG2
O
 C5
C5
O
2g54 2 P01308 100.0 3e-17 X-RAY
 2006-10-24 VAL C:18 C:18 100.0 0.645 S -155.1 141.2 28.0 0.181 0.464 A:Q5T5N2:0.465
 ZN
HOH
 5.433
5.489
 N
CG1
 ZN
O
VAL D:18 D:18 106.0 0.684 -149.3 155.1 NA NA NA
2g56 2 P01308 100.0 3e-17 X-RAY
 2006-10-24 VAL C:18 C:18 83.0 NA -142.7 161.8 22.0 NA NA A:Q5T5N2:NA
 HOH
 3.554
 CA
 O
VAL D:18 D:18 83.0 NA S -134.8 162.2 NA NA NA
2hiu 2 P01308 100.0 3e-17 NMR
 1997-04-01 VAL B:18 B:18 95.0 0.613 H -90.6 -26.7 29.0 0.187 0.426 A:P01308:0.426
2mvc 2 P01308 100.0 3e-17 NMR
 2014-12-10 VAL B:18 B:18 85.0 0.548 H -73.1 -40.9 20.0 0.129 0.419 A:P01308:0.419
2oly 2 P01308 100.0 3e-17 X-RAY
 2007-12-04 VAL B:18 B:18 100.0 0.645 H -73.3 -29.4 14.0 0.09 0.555 A:P01308:0.465
G:P01308:0.123
 RCO
RCO
RCO
URE
HOH
 8.505
6.607
8.012
9.420
2.720
 CG1
N
N
CG2
O
 O1
O3
O3
N2
O
VAL D:18 D:18 103.0 0.665 H -65.7 -44.8 13.0 0.084 0.581 C:P01308:0.503
K:P01308:0.142
 RCO
RCO
HOH
 7.356
7.721
3.117
 CG2
N
O
 O3
O3
O
VAL F:18 F:18 105.0 0.677 H -70.8 -42.9 21.0 0.135 0.542 J:P01308:0.071
I:P01308:0.11
E:P01308:0.465
 RCO
RCO
HOH
 6.978
8.092
2.832
 CG2
N
O
 O3
O1
O
VAL H:18 H:18 105.0 0.677 H -75.2 -39.1 18.0 0.116 0.561 B:P01308:0.084
A:P01308:0.116
G:P01308:0.484
 RCO
RCO
RCO
URE
HOH
 8.190
7.466
7.006
5.575
4.267
 N
CG2
CG2
O
O
 O1
C5
O3
N2
O
VAL J:18 J:18 118.0 0.761 H -69.1 -39.0 25.0 0.161 0.6 I:P01308:0.497
E:P01308:0.148
 RCO
RCO
HOH
 7.768
7.454
2.915
 N
O
O
 O3
O1
O
VAL L:18 L:18 105.0 0.677 H -67.0 -41.7 14.0 0.09 0.587 C:P01308:0.142
K:P01308:0.503
 RCO
URE
RCO
HOH
 7.944
9.258
7.180
2.664
 N
C
CG2
O
 O3
N1
O3
O
2olz 2 P01308 100.0 3e-17 X-RAY
 2007-12-04 VAL B:18 B:18 101.0 0.652 H -76.3 -28.5 11.0 0.071 0.581 A:P01308:0.471
G:P01308:0.142
 RCO
RCO
HOH
 8.384
7.749
3.066
 CG1
N
O
 O3
O3
O
VAL D:18 D:18 103.0 0.665 H -66.8 -45.4 16.0 0.103 0.562 C:P01308:0.471
K:P01308:0.123
L:P01308:0.09
 RCO
RCO
HOH
 7.024
7.668
2.655
 CG2
N
O
 O1
O3
O
VAL F:18 F:18 103.0 0.665 H -65.7 -42.5 17.0 0.11 0.555 J:P01308:0.084
I:P01308:0.129
E:P01308:0.477
 RCO
RCO
HOH
 7.068
7.981
4.747
 CG2
N
O
 O3
O3
O
VAL H:18 H:18 102.0 0.658 H -65.3 -46.6 16.0 0.103 0.555 B:P01308:0.09
A:P01308:0.116
G:P01308:0.465
 RCO
RCO
HOH
 7.984
7.018
2.614
 N
CG2
O
 O3
O3
O
VAL J:18 J:18 110.0 0.71 H -75.7 -45.2 21.0 0.135 0.575 I:P01308:0.49
E:P01308:0.123
 RCO
RCO
HOH
 7.904
7.531
2.503
 N
CG2
O
 O3
O3
O
VAL L:18 L:18 94.0 0.606 H -74.4 -34.4 4.0 0.026 0.58 C:P01308:0.168
K:P01308:0.445
 RCO
RCO
HOH
 7.638
8.120
4.822
 N
CG1
N
 O1
O3
O
2om0 2 P01308 100.0 3e-17 X-RAY
 2007-12-04 VAL B:18 B:18 119.0 0.768 H -67.0 -43.8 23.0 0.148 0.62 A:P01308:0.51
G:P01308:0.161
 RCO
RCO
HOH
 7.246
7.581
2.998
 CG2
N
O
 O3
O1
O
VAL D:18 D:18 100.0 0.645 H -75.2 -37.7 19.0 0.123 0.522 C:P01308:0.445
J:P01308:0.045
I:P01308:0.116
 RCO
RCO
HOH
 8.110
8.047
3.688
 CB
N
O
 O1
O3
O
VAL F:18 F:18 102.0 0.658 H -73.0 -34.1 19.0 0.123 0.535 K:P01308:0.116
L:P01308:0.039
E:P01308:0.465
 RCO
RCO
HOH
 7.998
7.975
4.797
 CB
N
O
 O3
O3
O
VAL H:18 H:18 106.0 0.684 H -71.1 -42.1 17.0 0.11 0.574 A:P01308:0.135
G:P01308:0.484
 RCO
RCO
HOH
 7.867
7.443
2.647
 N
CG2
O
 O3
O1
O
VAL J:18 J:18 98.0 0.632 H -74.8 -32.2 20.0 0.129 0.503 C:P01308:0.123
I:P01308:0.406
 RCO
RCO
HOH
 7.851
8.327
2.782
 N
CG1
O
 O1
O3
O
VAL L:18 L:18 99.0 0.639 H -74.9 -30.6 11.0 0.071 0.568 K:P01308:0.465
E:P01308:0.135
 RCO
RCO
HOH
 7.908
8.491
3.004
 N
CG1
O
 O3
O3
O
VAL N:18 R:18 101.0 0.652 H -74.4 -31.0 NA NA NA
VAL P:18 T:18 103.0 0.665 H -69.0 -48.6 NA NA NA
VAL R:18 V:18 100.0 0.645 H -76.7 -29.9 NA NA NA
VAL T:18 Y:18 95.0 0.613 H -75.2 -36.8 NA NA NA
VAL V:18 2:18 104.0 0.671 H -64.2 -43.5 NA NA NA
VAL X:18 4:18 103.0 0.665 H -75.0 -31.7 NA NA NA
VAL Z:18 b:18 105.0 0.677 H -60.4 -41.6 NA NA NA
VAL BA:18 d:18 105.0 0.677 H -65.9 -41.5 NA NA NA
VAL DA:18 f:18 101.0 0.652 H -84.2 -30.0 NA NA NA
VAL FA:18 h:18 103.0 0.665 H -67.0 -45.3 NA NA NA
VAL HA:18 j:18 98.0 0.632 H -80.6 -30.0 NA NA NA
VAL JA:18 l:18 94.0 0.606 H -71.0 -40.8 NA NA NA
2om1 2 P01308 100.0 3e-17 X-RAY
 2007-12-04 VAL B:18 B:18 125.0 0.806 H -70.5 -43.9 25.0 0.161 0.645 A:P01308:0.581
G:P01308:0.129
 RCO
RCO
HOH
 7.193
7.832
2.719
 CG2
N
O
 O3
O3
O
VAL D:18 D:18 99.0 0.639 H -77.8 -35.8 18.0 0.116 0.523 C:P01308:0.445
J:P01308:0.045
I:P01308:0.103
 RCO
HOH
 8.089
2.642
 N
O
 O3
O
VAL F:18 F:18 100.0 0.645 H -75.9 -32.2 19.0 0.123 0.522 K:P01308:0.116
L:P01308:0.045
E:P01308:0.452
 RCO
RCO
HOH
 7.750
7.871
2.649
 CG1
N
O
 O3
O3
O
VAL H:18 H:18 102.0 0.658 H -70.2 -41.9 14.0 0.09 0.568 A:P01308:0.135
G:P01308:0.497
 RCO
RCO
HOH
 7.712
7.474
3.637
 N
CG2
O
 O3
O3
O
VAL J:18 J:18 101.0 0.652 H -76.7 -33.9 13.0 0.084 0.568 C:P01308:0.135
I:P01308:0.471
 RCO
RCO
HOH
 7.831
8.462
2.726
 N
CG1
O
 O3
O3
O
VAL L:18 L:18 98.0 0.632 H -79.9 -28.8 11.0 0.071 0.561 K:P01308:0.471
E:P01308:0.129
 RCO
RCO
HOH
 7.718
8.399
2.819
 N
CG1
O
 O3
O3
O
VAL N:18 R:18 102.0 0.658 H -75.6 -28.5 NA NA NA
VAL P:18 T:18 102.0 0.658 H -69.8 -43.4 NA NA NA
VAL R:18 V:18 97.0 0.626 H -81.3 -30.0 NA NA NA
VAL T:18 Y:18 96.0 0.619 H -78.5 -34.2 NA NA NA
VAL V:18 2:18 104.0 0.671 H -67.4 -43.1 NA NA NA
VAL X:18 4:18 98.0 0.632 H -75.5 -30.8 NA NA NA
VAL Z:18 b:18 103.0 0.665 H -64.1 -44.9 NA NA NA
VAL BA:18 d:18 106.0 0.684 H -66.1 -44.6 NA NA NA
VAL DA:18 f:18 103.0 0.665 H -77.9 -30.8 NA NA NA
VAL FA:18 h:18 105.0 0.677 H -70.2 -42.8 NA NA NA
VAL HA:18 j:18 99.0 0.639 H -77.4 -33.7 NA NA NA
VAL JA:18 l:18 97.0 0.626 H -76.2 -38.2 NA NA NA
2omg 2 P01308 100.0 3e-17 X-RAY
 2007-03-27 VAL B:18 B:18 100.0 0.645 H -65.7 -38.9 18.0 0.116 0.529 B:P01308:0.065
A:P01308:0.406
A:P01308:0.09
 NA
CRS
CRS
HOH
 9.940
7.372
8.299
2.868
 CG1
CG2
N
O
 NA
C7
C7
O
VAL D:18 D:18 124.0 0.8 H -69.7 -39.0 24.0 0.155 0.645 C:P01308:0.561
F:P01308:0.077
E:P01308:0.11
 CRS
CRS
HOH
 7.164
8.283
2.893
 CG2
N
O
 C7
C7
O
VAL F:18 F:18 92.0 0.594 H -79.0 -30.5 9.0 0.058 0.536 C:P01308:0.129
E:P01308:0.432
 CRS
CRS
HOH
 8.382
7.863
3.095
 CG1
N
O
 C7
C7
O
2omh 2 P01308 100.0 3e-17 X-RAY
 2007-03-27 VAL B:18 B:18 99.0 0.639 H -64.0 -40.7 7.0 0.045 0.594 B:P01308:0.071
A:P01308:0.129
A:P01308:0.465
 NA
RCO
RCO
HOH
 9.722
7.080
7.917
2.875
 CG1
CG2
N
O
 NA
O3
O3
O
VAL D:18 D:18 103.0 0.665 H -65.9 -43.4 18.0 0.116 0.549 F:P01308:0.084
C:P01308:0.471
E:P01308:0.116
 RCO
RCO
URE
HOH
 6.987
8.203
9.985
2.728
 CG2
N
CG2
O
 O3
O3
N1
O
VAL F:18 F:18 90.0 0.581 H -83.2 -24.9 7.0 0.045 0.536 E:P01308:0.439
C:P01308:0.148
 RCO
URE
RCO
HOH
 7.874
5.015
7.942
2.709
 CG1
N
N
O
 O3
N1
O3
O
2omi 2 P01308 100.0 3e-17 X-RAY
 2007-03-27 VAL B:18 B:18 101.0 0.652 H -61.7 -48.3 15.0 0.097 0.555 A:P01308:0.439
G:P01308:0.142
 RCO
RCO
HOH
 6.802
8.058
5.142
 CG2
N
N
 O1
O1
O
VAL D:18 D:18 107.0 0.69 H -69.8 -35.9 24.0 0.155 0.535 C:P01308:0.477
K:P01308:0.11
 RCO
RCO
HOH
 8.304
7.285
3.493
 N
CG2
O
 O3
O1
O
VAL F:18 F:18 96.0 0.619 H -81.2 -34.4 11.0 0.071 0.548 I:P01308:0.129
E:P01308:0.458
 RCO
RCO
HOH
 7.584
8.060
4.756
 CG1
N
N
 O1
O1
O
VAL H:18 H:18 103.0 0.665 H -78.1 -41.3 34.0 0.219 0.446 B:P01308:0.097
G:P01308:0.413
 RCO
RCO
HOH
 8.054
7.084
4.456
 N
CG2
N
 O1
O1
O
VAL J:18 J:18 107.0 0.69 H -78.4 -38.8 15.0 0.097 0.593 I:P01308:0.529
E:P01308:0.11
 RCO
RCO
HOH
 8.531
7.521
5.215
 N
CG2
N
 O1
O1
O
VAL L:18 L:18 97.0 0.626 H -64.5 -45.7 8.0 0.052 0.574 C:P01308:0.103
K:P01308:0.51
 RCO
RCO
HOH
 7.241
8.091
5.123
 CG2
N
N
 O3
O1
O
2qiu 2 P01308 100.0 3e-17 X-RAY
 2008-02-26 VAL B:18 B:18 97.0 0.626 H -68.8 -44.6 0.0 0.0 0.626 D:P01308:0.265
A:P01308:0.51
 HOH
 3.566
 O
 O
VAL D:18 D:18 83.0 0.535 H -57.0 -47.7 13.0 0.084 0.451 C:P01308:0.361
A:P01308:0.09
 HOH
 4.510
 O
 O
2r34 2 P01308 100.0 3e-17 X-RAY
 2008-09-02 VAL B:18 B:18 111.0 0.716 H -79.8 -42.0 0.0 0.0 0.716 A:P01308:0.568
D:P01308:0.277
 HOH
 6.040
 C
 O
VAL D:18 D:18 83.0 0.535 H -80.8 -47.9 16.0 0.103 0.432 C:P01308:0.381
A:P01308:0.071
 HOH
 3.675
 O
 O
2r35 2 P01308 100.0 3e-17 X-RAY
 2008-09-02 VAL B:18 B:18 119.0 0.768 H -74.9 -51.2 5.0 0.032 0.736 D:P01308:0.284
A:P01308:0.548
 HOH
 6.132
 CG2
 O
VAL D:18 D:18 98.0 0.632 H -56.5 -49.8 10.0 0.065 0.567 C:P01308:0.477
A:P01308:0.142
 HOH
 4.474
 O
 O
2r36 2 P01308 100.0 3e-17 X-RAY
 2008-09-02 VAL B:18 B:18 117.0 0.755 H -63.6 -38.4 17.0 0.11 0.645 C:P01308:0.026
A:P01308:0.477
D:P01308:0.232
 HOH
 3.856
 O
 O
VAL D:18 D:18 118.0 0.761 H -90.5 -36.3 19.0 0.123 0.638 B:P01308:0.187
C:P01308:0.452
 HOH
 6.109
 N
 O
2vjz 2 P01308 100.0 3e-17 X-RAY
 2008-09-16 VAL B:18 B:18 60.0 0.387 H -67.6 -36.8 10.0 0.065 0.322 C:P01308:0.077
A:P01308:0.265
 CL
ZN
CL
CL
HOH
 9.857
8.153
8.771
6.000
2.707
 N
N
N
N
O
 CL
ZN
CL
CL
O
VAL D:18 D:18 117.0 0.755 H -67.0 -46.0 1.0 0.006 0.749 C:P01308:0.587
B:P01308:0.316
 ZN
CL
CL
CL
HOH
 8.343
7.252
7.554
9.001
2.810
 CG2
CG2
CG2
CG2
O
 ZN
CL
CL
CL
O
2vk0 2 P01308 100.0 3e-17 X-RAY
 2008-09-16 VAL B:18 B:18 109.0 0.703 H -75.8 -38.1 25.0 0.161 0.542 D:P01308:0.058
A:P01308:0.445
C:P01308:0.116
 MPB
HOH
 3.682
3.561
 O
O
 O4
O
VAL D:18 D:18 97.0 0.626 H -63.8 -41.4 5.0 0.032 0.594 C:P01308:0.465
B:P01308:0.058
A:P01308:0.123
 MPB
HOH
 3.337
4.155
 CG1
O
 CM
O
2wc0 3 P01308 100.0 3e-17 X-RAY
 2009-03-24 VAL D:18 D:18 119.0 0.768 T -80.3 -19.0 50.0 0.323 0.445 C:P01308:0.445
 HOH
 6.968
 CG2
 O
VAL F:18 F:18 120.0 0.774 H -67.1 -28.4 NA NA NA
2ws6 2 P01308 100.0 3e-17 X-RAY
 2010-02-09 VAL B:18 B:18 106.0 0.684 H -66.1 -46.2 12.0 0.077 0.607 A:P01308:0.484
G:P01308:0.181
 IPH
IPH
HOH
 7.745
8.698
2.598
 CG2
N
O
 C3
C3
O
VAL D:18 D:18 118.0 0.761 H -60.5 -38.9 26.0 0.168 0.593 C:P01308:0.465
J:P01308:0.071
I:P01308:0.129
 IPH
IPH
HOH
 8.054
8.815
4.365
 CG2
N
O
 C3
C3
O
3exx 2 P01308 100.0 3e-17 X-RAY
 2009-05-19 VAL B:18 B:18 104.0 0.671 H -62.0 -45.5 30.0 0.194 0.477 A:P01308:0.477
 NA
HOH
 7.656
2.752
 CG2
O
 NA
O
VAL D:18 D:18 106.0 0.684 H -81.9 -30.6 NA NA NA
3fq9 2 P01308 100.0 3e-17 X-RAY
 2009-08-04 VAL B:18 B:18 122.0 0.787 H -71.8 -38.5 38.0 0.245 0.542 A:P01308:0.542
 HOH
 3.081
 O
 O
VAL D:18 D:18 115.0 0.742 H -78.0 -35.7 NA NA NA
3ilg 2 P01308 100.0 3e-17 X-RAY
 2010-08-11 VAL B:18 B:18 102.0 0.658 H -70.3 -36.3 18.0 0.116 0.542 D:P01308:0.058
A:P01308:0.452
C:P01308:0.123
 HOH
 5.731
 C
 O
VAL D:18 D:18 119.0 0.768 H -70.6 -39.8 0.0 0.0 0.768 C:P01308:0.561
B:P01308:0.368
A:P01308:0.103
 HOH
 2.890
 O
 O
3inc 2 P01308 100.0 3e-17 X-RAY
 2010-08-18 VAL B:18 B:18 100.0 0.645 H -65.9 -40.8 17.0 0.11 0.535 D:P01308:0.065
A:P01308:0.452
C:P01308:0.11
 HOH
 5.700
 N
 O
VAL D:18 D:18 118.0 0.761 H -70.1 -38.6 0.0 0.0 0.761 C:P01308:0.555
B:P01308:0.374
A:P01308:0.097
 HOH
 2.405
 CB
 O
3ir0 2 P01308 100.0 3e-17 X-RAY
 2010-09-01 VAL B:18 B:18 114.0 0.735 H -77.0 -36.8 21.0 0.135 0.6 C:P01308:0.116
A:P01308:0.516
D:P01308:0.045
 HOH
 3.260
 CG1
 O
VAL D:18 D:18 121.0 0.781 H -70.9 -34.2 3.0 0.019 0.762 C:P01308:0.561
B:P01308:0.348
A:P01308:0.142
 HOH
 5.884
 O
 O
VAL F:18 F:18 121.0 0.781 H -77.1 -34.1 NA NA NA
VAL H:18 H:18 117.0 0.755 H -72.8 -36.9 NA NA NA
VAL J:18 J:18 108.0 0.697 H -76.9 -38.3 NA NA NA
VAL L:18 L:18 117.0 0.755 H -65.3 -32.2 NA NA NA
VAL N:18 N:18 110.0 0.71 H -77.3 -38.1 NA NA NA
VAL P:18 P:18 118.0 0.761 H -63.5 -34.9 NA NA NA
VAL R:18 S:18 119.0 0.768 H -73.9 -34.1 NA NA NA
VAL T:18 U:18 107.0 0.69 H -73.5 -26.0 NA NA NA
VAL V:18 W:18 121.0 0.781 H -74.1 -36.6 NA NA NA
VAL X:18 Y:18 114.0 0.735 H -72.6 -23.0 NA NA NA
3kq6 2 P01308 100.0 3e-17 X-RAY
 2010-02-23 VAL B:18 B:18 76.0 0.49 H -54.0 -41.7 10.0 0.065 0.425 A:P01308:0.329
C:P01308:0.135
 IPH
HOH
 9.080
2.970
 N
O
 C5
O
VAL D:18 D:18 98.0 0.632 H -68.8 -45.8 2.0 0.013 0.619 C:P01308:0.497
B:P01308:0.245
 IPH
HOH
 7.694
2.953
 CG2
O
 C5
O
3p33 2 P01308 100.0 3e-17 X-RAY
 2011-11-23 VAL B:18 B:18 118.0 0.761 H -46.9 -59.0 38.0 0.245 0.516 A:P01308:0.516
 IPH
HOH
 7.924
4.304
 CG2
O
 C5
O
VAL D:18 D:18 115.0 0.742 H -62.3 -45.2 NA NA NA
VAL F:18 F:18 120.0 0.774 H -69.8 -42.7 NA NA NA
VAL H:18 H:18 115.0 0.742 H -66.1 -52.8 NA NA NA
3q6e 2 P01308 100.0 3e-17 X-RAY
 2011-04-20 VAL B:18 B:18 80.0 0.516 H -60.9 -47.9 23.0 0.148 0.368 A:P01308:0.368
 HOH
 2.721
 O
 O
VAL D:18 D:18 109.0 0.703 H -66.8 -37.7 NA NA NA
3tt8 2 P01308 100.0 3e-17 X-RAY
 2011-10-19 VAL B:18 B:18 104.0 0.671 H -63.3 -43.6 32.0 0.206 0.465 A:P01308:0.465
 HOH
 2.762
 O
 O
VAL D:18 D:18 114.0 0.735 H -76.4 -37.3 NA NA NA
3v19 2 P01308 100.0 3e-17 X-RAY
 2012-12-12 VAL B:18 B:18 76.0 0.49 H -54.9 -40.5 9.0 0.058 0.432 A:P01308:0.348
C:P01308:0.135
 IPH
HOH
 8.737
3.808
 N
O
 C5
O
VAL D:18 D:18 109.0 0.703 H -66.4 -46.3 2.0 0.013 0.69 C:P01308:0.516
B:P01308:0.303
 IPH
HOH
 7.493
2.625
 CG2
O
 C5
O
3v1g 2 P01308 100.0 3e-17 X-RAY
 2012-12-12 VAL B:18 B:18 88.0 0.568 H -64.4 -51.9 13.0 0.084 0.484 A:P01308:0.4
C:P01308:0.123
 IPH
HOH
 9.022
2.577
 N
O
 C5
O
VAL D:18 D:18 100.0 0.645 H -64.4 -48.3 0.0 0.0 0.645 C:P01308:0.497
B:P01308:0.284
 IPH
HOH
 7.538
3.990
 CG2
O
 C5
O
3w11 2 P01308 100.0 3e-17 X-RAY
 2013-01-09 VAL B:18 B:18 124.0 0.8 H -57.6 -45.9 36.0 0.232 0.568 A:P01308:0.568
3w7y 2 P01308 100.0 3e-17 X-RAY
 2013-07-03 VAL B:18 B:18 120.0 0.774 H -64.0 -41.9 39.0 0.252 0.522 A:P01308:0.523
 HOH
 3.002
 O
 O
VAL D:18 D:18 114.0 0.735 H -76.3 -34.7 NA NA NA
3w7z 2 P01308 100.0 3e-17 X-RAY
 2013-07-03 VAL B:18 B:18 121.0 0.781 H -68.2 -42.7 42.0 0.271 0.51 A:P01308:0.51
 HOH
 3.005
 O
 O
VAL D:18 D:18 114.0 0.735 H -75.6 -40.0 NA NA NA
3w80 2 P01308 100.0 3e-17 X-RAY
 2013-07-03 VAL B:18 B:18 122.0 0.787 H -69.3 -42.2 29.0 0.187 0.6 C:P01308:0.103
A:P01308:0.516
D:P01308:0.065
 HOH
 2.851
 O
 O
VAL D:18 D:18 113.0 0.729 H -77.3 -40.8 0.0 0.0 0.729 B:P01308:0.342
C:P01308:0.535
A:P01308:0.077
 HOH
 2.911
 O
 O
VAL F:18 F:18 123.0 0.794 H -65.7 -44.0 NA NA NA
VAL H:18 H:18 114.0 0.735 H -77.3 -39.5 NA NA NA
3zqr 2 P01308 100.0 3e-17 X-RAY
 2011-08-24 VAL B:18 B:18 111.0 0.716 H -61.3 -49.0 19.0 0.123 0.593 A:P01308:0.477
H:P01308:0.084
G:P01308:0.129
 IPH
IPH
HOH
 7.846
9.168
2.675
 CG2
N
O
 C5
C5
O
VAL D:18 D:18 112.0 0.723 H -52.3 -42.8 12.0 0.077 0.646 C:P01308:0.477
J:P01308:0.052
I:P01308:0.174
 IPH
IPH
HOH
 7.839
8.795
4.324
 CG2
N
O
 C5
C5
O
VAL F:18 F:18 115.0 0.742 H -67.2 -43.0 9.0 0.058 0.684 K:P01308:0.187
L:P01308:0.071
E:P01308:0.484
 IPH
IPH
HOH
 8.140
8.782
6.650
 CG2
N
N
 C5
C5
O
VAL H:18 H:18 111.0 0.716 H -59.3 -43.7 14.0 0.09 0.626 A:P01308:0.161
G:P01308:0.503
 IPH
IPH
HOH
 8.622
7.974
3.562
 N
CG2
CG1
 C5
C5
O
VAL J:18 J:18 109.0 0.703 H -63.8 -42.5 8.0 0.052 0.651 C:P01308:0.161
D:P01308:0.071
I:P01308:0.497
 IPH
IPH
HOH
 8.655
8.089
3.268
 N
CG2
O
 C5
C5
O
VAL L:18 L:18 109.0 0.703 H -71.8 -35.8 22.0 0.142 0.561 F:P01308:0.039
K:P01308:0.503
E:P01308:0.045
 IPH
IPH
HOH
 8.922
7.639
5.491
 N
CG2
N
 C5
C5
O
3zu1 2 P01308 100.0 3e-17 X-RAY
 2011-08-03 VAL B:18 B:18 99.0 0.639 H -72.1 -33.2 21.0 0.135 0.504 D:P01308:0.006
A:P01308:0.426
C:P01308:0.135
 RCO
HOH
 7.869
4.630
 N
O
 H1
H2
VAL D:18 D:18 116.0 0.748 H -71.5 -41.2 21.0 0.135 0.613 C:P01308:0.529
A:P01308:0.129
 RCO
RCO
HOH
 6.591
7.858
2.053
 HG21
N
HG11
 H1
H1
H1
4eww 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 102.0 0.658 H -59.3 -47.6 0.0 0.0 0.658 C:P01308:0.116
A:P01308:0.452
D:P01308:0.323
 HOH
 5.166
 N
 O
VAL D:18 D:18 102.0 0.658 H -65.0 -38.3 0.0 0.0 0.658 B:P01308:0.31
C:P01308:0.458
A:P01308:0.155
 HOH
 2.570
 O
 O
4ewx 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 88.0 0.568 H -71.2 -43.6 0.0 0.0 0.568 D:P01308:0.277
A:P01308:0.413
C:P01308:0.065
 HOH
 5.200
 N
 O
VAL D:18 D:18 102.0 0.658 H -70.1 -33.4 0.0 0.0 0.658 C:P01308:0.452
B:P01308:0.329
A:P01308:0.142
 HOH
 3.406
 O
 O
4ewz 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 101.0 0.652 H -70.5 -47.1 0.0 0.0 0.652 D:P01308:0.297
A:P01308:0.471
C:P01308:0.103
 HOH
 5.787
 N
 O
VAL D:18 D:18 103.0 0.665 H -70.9 -36.4 0.0 0.0 0.665 C:P01308:0.458
B:P01308:0.335
A:P01308:0.148
 HOH
 2.950
 O
 O
4ex0 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 95.0 0.613 H -76.0 -40.6 0.0 0.0 0.613 D:P01308:0.265
A:P01308:0.458
C:P01308:0.097
 HOH
 4.959
 N
 O
VAL D:18 D:18 100.0 0.645 H -67.0 -37.1 0.0 0.0 0.645 C:P01308:0.458
B:P01308:0.329
A:P01308:0.129
 HOH
 2.741
 O
 O
4ex1 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 95.0 0.613 H -77.0 -29.6 0.0 0.0 0.613 D:P01308:0.258
A:P01308:0.471
C:P01308:0.097
 HOH
 4.924
 O
 O
VAL D:18 D:18 99.0 0.639 H -68.6 -40.4 0.0 0.0 0.639 C:P01308:0.458
B:P01308:0.323
A:P01308:0.135
 HOH
 2.960
 O
 O
4exx 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 103.0 0.665 H -70.3 -39.9 1.0 0.006 0.659 C:P01308:0.116
A:P01308:0.497
D:P01308:0.29
 HOH
 5.137
 N
 O
VAL D:18 D:18 102.0 0.658 H -65.4 -36.6 0.0 0.0 0.658 B:P01308:0.316
C:P01308:0.458
A:P01308:0.135
 HOH
 3.057
 O
 O
4ey1 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 96.0 0.619 H -73.6 -37.5 1.0 0.006 0.613 D:P01308:0.245
A:P01308:0.465
C:P01308:0.097
 HOH
 5.070
 N
 O
VAL D:18 D:18 101.0 0.652 H -71.8 -36.4 0.0 0.0 0.652 C:P01308:0.445
B:P01308:0.316
A:P01308:0.135
 HOH
 3.215
 O
 O
4ey9 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 100.0 0.645 H -86.4 -37.1 1.0 0.006 0.639 C:P01308:0.103
A:P01308:0.484
D:P01308:0.277
 HOH
 5.185
 N
 O
VAL D:18 D:18 100.0 0.645 H -72.7 -35.4 0.0 0.0 0.645 B:P01308:0.303
C:P01308:0.439
A:P01308:0.135
 HOH
 2.920
 O
 O
4eyd 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 99.0 0.639 H -81.2 -37.3 2.0 0.013 0.626 D:P01308:0.271
A:P01308:0.471
C:P01308:0.103
 HOH
 5.062
 N
 O
VAL D:18 D:18 101.0 0.652 H -71.0 -34.0 0.0 0.0 0.652 C:P01308:0.452
B:P01308:0.316
A:P01308:0.142
 HOH
 3.126
 O
 O
4eyn 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 98.0 0.632 H -73.3 -37.6 0.0 0.0 0.632 C:P01308:0.09
A:P01308:0.477
D:P01308:0.258
 HOH
 5.088
 N
 O
VAL D:18 D:18 101.0 0.652 H -69.4 -36.2 0.0 0.0 0.652 B:P01308:0.329
C:P01308:0.445
A:P01308:0.123
 HOH
 3.159
 O
 O
4eyp 2 P01308 100.0 3e-17 X-RAY
 2013-05-01 VAL B:18 B:18 96.0 0.619 H -72.7 -36.2 0.0 0.0 0.619 C:P01308:0.09
A:P01308:0.465
D:P01308:0.252
 HOH
 5.122
 N
 O
VAL D:18 D:18 99.0 0.639 H -70.5 -37.2 0.0 0.0 0.639 B:P01308:0.31
C:P01308:0.445
A:P01308:0.116
 HOH
 3.081
 O
 O
4f0n 2 P01308 100.0 3e-17 X-RAY
 2013-05-08 VAL B:18 B:18 93.0 0.6 H -79.6 -37.6 1.0 0.006 0.594 C:P01308:0.103
A:P01308:0.419
D:P01308:0.271
 HOH
 5.102
 N
 O
VAL D:18 D:18 104.0 0.671 H -75.4 -35.5 0.0 0.0 0.671 B:P01308:0.323
C:P01308:0.458
A:P01308:0.116
 HOH
 3.011
 O
 O
4f0o 2 P01308 100.0 3e-17 X-RAY
 2013-05-08 VAL B:18 B:18 95.0 0.613 H -76.0 -32.6 1.0 0.006 0.607 D:P01308:0.252
A:P01308:0.471
C:P01308:0.077
 HOH
 5.024
 N
 O
VAL D:18 D:18 101.0 0.652 H -65.8 -39.7 0.0 0.0 0.652 C:P01308:0.445
B:P01308:0.329
A:P01308:0.123
 HOH
 2.872
 O
 O
4f1a 2 P01308 100.0 3e-17 X-RAY
 2013-05-08 VAL B:18 B:18 96.0 0.619 H -76.4 -37.5 0.0 0.0 0.619 D:P01308:0.271
A:P01308:0.458
C:P01308:0.097
 HOH
 6.105
 N
 O
VAL D:18 D:18 102.0 0.658 H -67.4 -36.4 0.0 0.0 0.658 C:P01308:0.458
B:P01308:0.323
A:P01308:0.123
 HOH
 2.863
 O
 O
4f1b 2 P01308 100.0 3e-17 X-RAY
 2013-05-08 VAL B:18 B:18 99.0 0.639 H -78.6 -40.0 1.0 0.006 0.633 D:P01308:0.265
A:P01308:0.484
C:P01308:0.097
 HOH
 4.979
 N
 O
VAL D:18 D:18 102.0 0.658 H -67.6 -45.4 0.0 0.0 0.658 C:P01308:0.458
B:P01308:0.316
A:P01308:0.123
 HOH
 2.821
 O
 O
4f1c 2 P01308 100.0 3e-17 X-RAY
 2013-05-08 VAL B:18 B:18 96.0 0.619 H -76.9 -41.9 1.0 0.006 0.613 C:P01308:0.084
A:P01308:0.471
D:P01308:0.258
 HOH
 4.796
 N
 O
VAL D:18 D:18 103.0 0.665 H -65.7 -39.1 0.0 0.0 0.665 B:P01308:0.329
C:P01308:0.465
A:P01308:0.135
 HOH
 3.116
 O
 O
4f1d 2 P01308 100.0 3e-17 X-RAY
 2013-05-08 VAL B:18 B:18 96.0 0.619 H -73.2 -41.0 1.0 0.006 0.613 D:P01308:0.245
A:P01308:0.458
C:P01308:0.097
 HOH
 5.143
 N
 O
VAL D:18 D:18 99.0 0.639 H -64.4 -43.0 1.0 0.006 0.633 C:P01308:0.452
B:P01308:0.303
A:P01308:0.129
 HOH
 3.133
 O
 O
4f1f 2 P01308 100.0 3e-17 X-RAY
 2013-05-08 VAL B:18 B:18 98.0 0.632 H -71.1 -33.3 1.0 0.006 0.626 D:P01308:0.258
A:P01308:0.465
C:P01308:0.097
 HOH
 4.928
 O
 O
VAL D:18 D:18 103.0 0.665 H -65.5 -42.6 0.0 0.0 0.665 C:P01308:0.465
B:P01308:0.323
A:P01308:0.142
 HOH
 2.812
 O
 O
4f1g 2 P01308 100.0 3e-17 X-RAY
 2013-05-08 VAL B:18 B:18 98.0 0.632 H -69.2 -42.8 1.0 0.006 0.626 C:P01308:0.084
A:P01308:0.471
D:P01308:0.258
 HOH
 5.172
 N
 O
VAL D:18 D:18 104.0 0.671 H -67.9 -39.6 1.0 0.006 0.665 B:P01308:0.323
C:P01308:0.465
A:P01308:0.129
 HOH
 3.092
 O
 O
4f4t 2 P01308 100.0 3e-17 X-RAY
 2013-05-15 VAL B:18 B:18 96.0 0.619 H -73.5 -37.7 1.0 0.006 0.613 C:P01308:0.077
A:P01308:0.471
D:P01308:0.245
 HOH
 5.100
 N
 O
VAL D:18 D:18 101.0 0.652 H -67.2 -40.8 0.0 0.0 0.652 B:P01308:0.31
C:P01308:0.445
A:P01308:0.123
 HOH
 2.953
 O
 O
4f4v 2 P01308 100.0 3e-17 X-RAY
 2013-05-15 VAL B:18 B:18 97.0 0.626 H -71.2 -42.3 0.0 0.0 0.626 C:P01308:0.084
A:P01308:0.458
D:P01308:0.258
 HOH
 4.790
 N
 O
VAL D:18 D:18 102.0 0.658 H -64.5 -41.7 1.0 0.006 0.652 B:P01308:0.31
C:P01308:0.465
A:P01308:0.071
 HOH
 3.197
 O
 O
4f51 2 P01308 100.0 3e-17 X-RAY
 2013-05-15 VAL B:18 B:18 98.0 0.632 H -71.8 -43.3 1.0 0.006 0.626 D:P01308:0.258
A:P01308:0.477
C:P01308:0.077
 HOH
 5.026
 N
 O
VAL D:18 D:18 102.0 0.658 H -66.9 -39.8 0.0 0.0 0.658 C:P01308:0.465
B:P01308:0.316
A:P01308:0.129
 HOH
 3.088
 O
 O
4f8f 2 P01308 100.0 3e-17 X-RAY
 2013-05-22 VAL B:18 B:18 98.0 0.632 H -76.7 -35.8 1.0 0.006 0.626 C:P01308:0.09
A:P01308:0.471
D:P01308:0.258
 HOH
 5.051
 N
 O
VAL D:18 D:18 103.0 0.665 H -69.4 -41.1 0.0 0.0 0.665 B:P01308:0.303
C:P01308:0.458
A:P01308:0.123
 HOH
 2.970
 O
 O
4fg3 2 P01308 100.0 3e-17 X-RAY
 2013-06-12 VAL B:18 B:18 117.0 0.755 H -71.4 -41.7 1.0 0.006 0.749 C:P01308:0.116
A:P01308:0.529
D:P01308:0.374
 GOL
HOH
 5.141
3.012
 N
O
 O1
O
VAL D:18 D:18 105.0 0.677 H -72.8 -46.2 0.0 0.0 0.677 B:P01308:0.303
C:P01308:0.465
A:P01308:0.129
 HOH
 3.719
 O
 O
4fka 2 P01308 100.0 3e-17 X-RAY
 2013-02-13 VAL B:18 B:18 103.0 0.665 H -62.2 -44.2 32.0 0.206 0.459 A:P01308:0.458
 NA
HOH
 7.684
2.852
 CG2
O
 NA
O
VAL D:18 D:18 107.0 0.69 H -80.1 -30.5 NA NA NA
4oga 2 P01308 100.0 3e-17 X-RAY
 2014-08-27 VAL B:18 B:18 111.0 0.716 H -67.1 -61.6 39.0 0.252 0.464 A:P01308:0.465
4rxw 2 P01308 100.0 3e-17 X-RAY
 2015-01-21 VAL B:18 B:18 102.0 0.658 H -60.5 -45.4 32.0 0.206 0.452 A:P01308:0.452
 HOH
 5.834
 C
 O
VAL D:18 D:18 106.0 0.684 H -79.3 -35.7 NA NA NA
4xc4 2 P01308 100.0 3e-17 X-RAY
 2015-02-11 VAL B:18 B:18 98.0 0.632 H -65.8 -48.5 0.0 0.0 0.632 C:P01308:0.09
A:P01308:0.465
D:P01308:0.265
 HOH
 3.424
 O
 O
VAL D:18 D:18 125.0 0.806 H -72.9 -37.8 1.0 0.006 0.8 B:P01308:0.387
C:P01308:0.555
A:P01308:0.11
 HOH
 2.850
 O
 O
5bts 2 P01308 100.0 3e-17 X-RAY
 2016-03-09 VAL B:18 B:18 89.0 0.574 H -72.6 -44.3 28.0 0.181 0.393 A:P01308:0.394
 HOH
 2.702
 HG13
 O
5cny 2 P01308 100.0 3e-17 X-RAY
 2015-08-26 VAL B:18 B:18 96.0 0.619 H -85.0 -31.8 0.0 0.0 0.619 D:P01308:0.271
A:P01308:0.465
C:P01308:0.097
 HOH
 4.914
 N
 O
VAL D:18 D:18 101.0 0.652 H -67.9 -40.7 0.0 0.0 0.652 C:P01308:0.445
B:P01308:0.335
A:P01308:0.135
 HOH
 2.813
 O
 O
5co2 2 P01308 100.0 3e-17 X-RAY
 2015-08-26 VAL B:18 B:18 97.0 0.626 H -82.2 -32.0 0.0 0.0 0.626 D:P01308:0.277
A:P01308:0.471
C:P01308:0.097
 HOH
 5.001
 O
 O
VAL D:18 D:18 100.0 0.645 H -67.6 -40.4 0.0 0.0 0.645 C:P01308:0.439
B:P01308:0.335
A:P01308:0.135
 HOH
 3.015
 O
 O
5co6 2 P01308 100.0 3e-17 X-RAY
 2015-08-26 VAL B:18 B:18 95.0 0.613 H -63.1 -46.9 1.0 0.006 0.607 C:P01308:0.097
A:P01308:0.445
D:P01308:0.258
 HOH
 6.202
 O
 O
VAL D:18 D:18 114.0 0.735 H -73.9 -35.8 0.0 0.0 0.735 B:P01308:0.394
C:P01308:0.484
A:P01308:0.097
 HOH
 3.470
 O
 O
5co9 2 P01308 100.0 3e-17 X-RAY
 2015-08-26 VAL B:18 B:18 95.0 0.613 H -69.9 -45.5 0.0 0.0 0.613 C:P01308:0.09
A:P01308:0.458
D:P01308:0.252
 HOH
 6.142
 O
 O
VAL D:18 D:18 104.0 0.671 H -77.8 -34.3 0.0 0.0 0.671 B:P01308:0.329
C:P01308:0.458
A:P01308:0.103
 HOH
 3.386
 O
 O
5e7w 2 P01308 100.0 3e-17 X-RAY
 2016-10-12 VAL B:18 B:18 103.0 0.665 H -61.4 -45.0 18.0 0.116 0.549 D:P01308:0.071
A:P01308:0.465
C:P01308:0.116
 HOH
 2.735
 O
 O
VAL D:18 D:18 107.0 0.69 H -83.2 -28.9 0.0 0.0 0.69 C:P01308:0.49
B:P01308:0.348
A:P01308:0.09
 HOH
 2.796
 O
 O
5en9 2 P01308 100.0 3e-17 X-RAY
 2016-01-13 VAL B:18 B:18 76.0 0.49 H -68.7 -44.0 25.0 0.161 0.329 A:P01308:0.329
 HOH
 2.899
 O
 O
5ena 2 P01308 100.0 3e-17 X-RAY
 2016-01-13 VAL B:18 B:18 74.0 0.477 H -71.4 -41.8 22.0 0.142 0.335 A:P01308:0.335
 HOH
 2.909
 O
 O
5hpr 2 P01308 100.0 3e-17 X-RAY
 2017-01-25 VAL B:18 B:18 92.0 0.594 H -70.8 -43.0 30.0 0.194 0.4 A:P01308:0.4
 GOL
HOH
 9.431
2.716
 CG2
O
 O3
O
5hpu 2 P01308 100.0 3e-17 X-RAY
 2017-01-25 VAL B:18 B:18 104.0 0.671 H -71.3 -23.8 16.0 0.103 0.568 D:P01308:0.071
A:P01308:0.445
C:P01308:0.155
 IPH
IPH
HOH
 7.405
9.039
4.308
 CG1
N
CA
 C5
C5
O
VAL D:18 D:18 91.0 0.587 H -77.0 -47.6 3.0 0.019 0.568 C:P01308:0.471
A:P01308:0.142
 IPH
IPH
HOH
 8.004
8.505
4.845
 CG2
N
N
 C5
C5
O
5hqi 2 P01308 100.0 3e-17 X-RAY
 2017-01-25 VAL B:18 B:18 73.0 0.471 H -72.2 -42.6 22.0 0.142 0.329 A:P01308:0.329
 HOH
 2.791
 O
 O
5hrq 2 P01308 100.0 3e-17 X-RAY
 2017-01-25 VAL B:18 B:18 104.0 0.671 H -69.8 -41.9 19.0 0.123 0.548 A:P01308:0.465
H:P01308:0.071
G:P01308:0.123
 IPH
IPH
HOH
 7.942
9.288
4.656
 CG2
N
O
 C3
C5
O
VAL D:18 D:18 119.0 0.768 H -68.3 -37.1 22.0 0.142 0.626 C:P01308:0.477
J:P01308:0.052
I:P01308:0.168
 IPH
IPH
HOH
 7.908
8.924
4.839
 CG2
N
N
 C5
C3
O
VAL F:18 F:18 114.0 0.735 H -64.3 -43.2 26.0 0.168 0.567 K:P01308:0.129
L:P01308:0.084
E:P01308:0.452
 IPH
IPH
HOH
 7.839
8.949
4.845
 CG2
N
N
 C5
C3
O
VAL H:18 H:18 96.0 0.619 H -72.5 -40.5 9.0 0.058 0.561 A:P01308:0.135
G:P01308:0.465
 IPH
HOH
 9.111
5.557
 N
N
 C3
O
VAL J:18 J:18 101.0 0.652 H -66.9 -39.2 7.0 0.045 0.607 C:P01308:0.181
D:P01308:0.058
I:P01308:0.458
 IPH
IPH
HOH
 8.732
7.999
3.314
 N
CG2
O
 C5
C3
O
VAL L:18 L:18 111.0 0.716 H -81.4 -30.9 12.0 0.077 0.639 K:P01308:0.529
E:P01308:0.148
 IPH
IPH
HOH
 9.028
8.553
4.803
 N
CG1
N
 C5
C3
O
5mam 2 P01308 100.0 3e-17 X-RAY
 2017-04-05 VAL B:18 B:18 126.0 0.813 H -85.3 -47.1 18.0 0.116 0.697 A:P01308:0.6
C:P01308:0.123
 SRO
HOH
 6.018
5.194
 N
O
 CB
O
VAL D:18 D:18 100.0 0.645 H -67.9 -40.4 16.0 0.103 0.542 C:P01308:0.426
B:P01308:0.103
A:P01308:0.103
 SRO
HOH
 6.924
5.305
 CG2
CG1
 CB
O
VAL F:18 F:18 96.0 0.619 H -84.7 -40.4 NA NA NA
VAL H:18 H:18 102.0 0.658 H -70.5 -39.8 NA NA NA
VAL J:18 J:18 101.0 0.652 H -61.2 -40.1 NA NA NA
VAL L:18 L:18 96.0 0.619 H -84.3 -41.4 NA NA NA
VAL N:18 N:18 96.0 0.619 H -79.3 -41.0 NA NA NA
VAL P:18 P:18 101.0 0.652 H -65.0 -50.2 NA NA NA
VAL R:18 R:18 103.0 0.665 H -64.9 -45.4 NA NA NA
VAL T:18 T:18 99.0 0.639 H -86.8 -44.9 NA NA NA
VAL V:18 V:18 97.0 0.626 H -70.7 -56.2 NA NA NA
VAL X:18 X:18 101.0 0.652 H -66.0 -51.9 NA NA NA
VAL Z:18 Z:18 96.0 0.619 H -77.7 -41.2 NA NA NA
VAL BA:18 1:18 106.0 0.684 H -73.5 -44.6 NA NA NA
VAL DA:18 3:18 96.0 0.619 H -95.9 -35.6 NA NA NA
VAL FA:18 5:18 101.0 0.652 H -67.0 -46.9 NA NA NA
5mt3 2 P01308 100.0 3e-17 X-RAY
 2017-04-05 VAL B:18 B:18 114.0 0.735 H -78.6 -57.0 13.0 0.084 0.651 C:P01308:0.123
A:P01308:0.542
 SRO
HOH
 5.019
5.823
 O
O
 NZ
O
VAL D:18 D:18 105.0 0.677 H -67.6 -46.1 18.0 0.116 0.561 C:P01308:0.432
B:P01308:0.123
A:P01308:0.116
 SRO
ARG
HOH
 6.755
8.040
4.900
 CG2
N
CG1
 CB
NE
O
VAL F:18 F:18 111.0 0.716 H -76.0 -46.0 NA NA NA
VAL H:18 H:18 107.0 0.69 H -58.1 -43.0 NA NA NA
VAL J:18 J:18 105.0 0.677 H -59.3 -40.4 NA NA NA
VAL L:18 L:18 118.0 0.761 H -78.9 -50.5 NA NA NA
VAL N:18 N:18 95.0 0.613 H -76.1 -47.3 NA NA NA
VAL P:18 P:18 107.0 0.69 H -61.7 -44.8 NA NA NA
VAL R:18 R:18 99.0 0.639 H -73.9 -43.9 NA NA NA
VAL T:18 T:18 102.0 0.658 H -54.1 -46.1 NA NA NA
VAL V:18 V:18 101.0 0.652 H -74.0 -54.6 NA NA NA
VAL X:18 X:18 104.0 0.671 H -66.1 -47.2 NA NA NA
VAL Z:18 Z:18 105.0 0.677 H -87.4 -46.3 NA NA NA
VAL BA:18 b:18 104.0 0.671 H -63.0 -48.1 NA NA NA
VAL DA:18 d:18 96.0 0.619 H -91.3 -43.7 NA NA NA
VAL FA:18 f:18 104.0 0.671 H -68.5 -43.7 NA NA NA
5mt9 2 P01308 100.0 3e-17 X-RAY
 2017-04-05 VAL B:18 B:18 115.0 0.742 H -73.5 -42.7 19.0 0.123 0.619 A:P01308:0.523
C:P01308:0.116
 ARG
SRO
HOH
 9.670
5.913
2.793
 CG2
N
O
 NH1
CB
O
VAL D:18 D:18 116.0 0.748 H -52.8 -42.5 24.0 0.155 0.593 C:P01308:0.49
B:P01308:0.11
A:P01308:0.071
 SRO
ARG
HOH
 7.071
8.170
8.386
 CG2
N
CG2
 CB
NH2
O
VAL F:18 F:18 93.0 0.6 H -82.7 -41.6 NA NA NA
VAL H:18 H:18 102.0 0.658 H -57.1 -45.5 NA NA NA
VAL J:18 J:18 99.0 0.639 H -56.3 -38.6 NA NA NA
VAL L:18 L:18 105.0 0.677 H -78.7 -45.5 NA NA NA
VAL N:18 N:18 121.0 0.781 H -76.2 -39.0 NA NA NA
VAL P:18 P:18 102.0 0.658 H -60.2 -43.1 NA NA NA
VAL R:18 R:18 99.0 0.639 H -79.5 -36.7 NA NA NA
VAL T:18 T:18 105.0 0.677 H -55.5 -41.2 NA NA NA
VAL V:18 V:18 104.0 0.671 H -81.8 -49.4 NA NA NA
VAL X:18 X:18 104.0 0.671 H -63.1 -45.7 NA NA NA
VAL Z:18 Z:18 99.0 0.639 H -84.9 -41.1 NA NA NA
VAL BA:18 b:18 102.0 0.658 H -68.5 -44.4 NA NA NA
VAL DA:18 d:18 96.0 0.619 H -82.8 -39.3 NA NA NA
VAL FA:18 f:18 105.0 0.677 H -68.7 -40.2 NA NA NA
5t7r 2 P01308 100.0 3e-17 X-RAY
 2017-12-06 VAL B:18 B:18 96.0 0.619 H -70.0 -41.1 32.0 0.206 0.413 A:P01308:0.413
 HOH
 3.379
 O
 O
VAL D:18 D:18 78.0 0.503 H -70.7 -40.8 NA NA NA
5uoz 2 P01308 100.0 3e-17 X-RAY
 2018-02-07 VAL B:18 B:18 75.0 0.484 H -73.8 -41.6 22.0 0.142 0.342 A:P01308:0.342
 HOH
 2.850
 O
 O
5uqa 2 P01308 100.0 3e-17 X-RAY
 2018-02-21 VAL B:18 B:18 109.0 0.703 H -74.7 -37.0 26.0 0.168 0.535 A:P01308:0.465
G:P01308:0.129
 IPH
HOH
 9.269
3.197
 N
O
 C5
O
VAL D:18 D:18 117.0 0.755 H -67.5 -39.4 19.0 0.123 0.632 C:P01308:0.484
J:P01308:0.052
I:P01308:0.168
 IPH
IPH
HOH
 7.977
8.877
3.840
 CG2
N
O
 C3
C3
O
VAL F:18 F:18 119.0 0.768 H -62.0 -41.1 20.0 0.129 0.639 K:P01308:0.168
L:P01308:0.084
E:P01308:0.458
 IPH
NA
IPH
HOH
 7.773
9.515
8.930
4.819
 CG2
CG1
N
N
 C5
NA
C5
O
VAL H:18 H:18 102.0 0.658 H -67.6 -39.5 12.0 0.077 0.581 A:P01308:0.148
G:P01308:0.49
 IPH
IPH
HOH
 8.933
8.163
4.860
 N
CG2
N
 C3
C5
O
VAL J:18 J:18 101.0 0.652 H -69.2 -38.8 6.0 0.039 0.613 C:P01308:0.2
D:P01308:0.065
I:P01308:0.452
 IPH
IPH
HOH
 8.690
7.985
3.553
 N
CG2
O
 C3
C3
O
VAL L:18 L:18 91.0 0.587 H -80.1 -31.7 9.0 0.058 0.529 K:P01308:0.4
E:P01308:0.148
 IPH
IPH
HOH
 8.977
8.327
2.800
 N
CG1
O
 C5
C5
O
5uu2 2 P01308 100.0 3e-17 X-RAY
 2018-02-21 VAL B:18 B:18 72.0 0.465 H -71.9 -45.0 23.0 0.148 0.317 A:P01308:0.316
 HOH
 2.663
 O
 O
5uu4 2 P01308 100.0 3e-17 X-RAY
 2018-02-21 VAL B:18 B:18 118.0 0.761 H -69.2 -43.0 33.0 0.213 0.548 C:P01308:0.013
D:P01308:0.026
A:P01308:0.497
 IPH
IPH
 7.839
8.432
 CG2
N
 C5
C3
VAL D:18 D:18 100.0 0.645 H -70.9 -45.9 36.0 0.232 0.413 C:P01308:0.394
A:P01308:0.019
 IPH
IPH
 7.752
8.972
 CG2
N
 C3
C5
6gnq 2 P01308 100.0 3e-17 X-RAY
 2019-06-12 VAL B:18 B:18 104.0 0.671 H -73.3 -34.7 10.0 0.065 0.606 A:P01308:0.503
E:P01308:0.135
 CRS
EDO
CRS
HOH
 7.421
3.697
7.772
4.823
 CG2
CG1
N
N
 C7
O1
C7
O
VAL D:18 D:18 98.0 0.632 H -61.3 -47.2 11.0 0.071 0.561 C:P01308:0.452
K:P01308:0.142
L:P01308:0.058
 CRS
CRS
HOH
 7.341
7.186
5.122
 CG2
N
O
 C5
C7
O
VAL F:18 F:18 115.0 0.742 H -62.5 -42.7 16.0 0.103 0.639 B:P01308:0.065
A:P01308:0.155
E:P01308:0.51
 CRS
EDO
CRS
HOH
 7.600
4.715
6.867
5.323
 N
CG1
CG2
C
 C7
O2
C7
O
VAL H:18 H:18 102.0 0.658 H -68.1 -40.3 13.0 0.084 0.574 G:P01308:0.471
J:P01308:0.019
I:P01308:0.123
 CRS
EDO
EDO
CRS
HOH
 7.247
4.962
9.626
7.436
5.617
 CG2
N
CG2
N
C
 C7
O1
C2
C7
O
VAL J:18 J:18 108.0 0.697 H -67.7 -39.5 18.0 0.116 0.581 G:P01308:0.116
I:P01308:0.465
H:P01308:0.065
 CRS
EDO
EDO
CRS
HOH
 7.935
7.630
8.667
6.525
5.386
 N
CG2
N
CG2
N
 C7
C2
O2
C7
O
VAL L:18 L:18 107.0 0.69 H -62.5 -47.8 16.0 0.103 0.587 C:P01308:0.116
D:P01308:0.065
K:P01308:0.497
 CRS
CRS
HOH
 8.510
7.240
3.559
 N
CG2
CG1
 C5
C7
O
VAL N:18 N:18 104.0 0.671 H -75.9 -39.7 NA NA NA
VAL P:18 P:18 113.0 0.729 H -63.0 -54.0 NA NA NA
VAL R:18 R:18 107.0 0.69 H -69.4 -43.4 NA NA NA
VAL T:18 T:18 123.0 0.794 H -57.8 -41.6 NA NA NA
VAL V:18 V:18 107.0 0.69 H -72.8 -41.2 NA NA NA
VAL X:18 X:18 106.0 0.684 H -61.5 -44.7 NA NA NA
6h3m 2 P01308 100.0 3e-17 X-RAY
 2019-08-14 VAL B:18 B:18 105.0 0.677 H -69.1 -43.0 NA NA NA
VAL D:18 D:18 102.0 0.658 H -64.1 -48.3 NA NA NA
VAL E:18 F:18 100.0 0.645 H -65.0 -49.3 NA NA NA
VAL F:18 H:18 122.0 0.787 H -68.3 -42.8 NA NA NA
VAL G:18 J:18 121.0 0.781 H -71.3 -43.8 43.0 0.277 0.504 A:P01308:0.503
 HOH
 5.625
 C
 O
VAL H:18 L:18 122.0 0.787 H -70.6 -40.9 NA NA NA
VAL N:18 P:18 109.0 0.703 H -72.5 -39.8 NA NA NA
VAL O:18 Q:18 112.0 0.723 H -71.0 -44.4 NA NA NA
6hn5 2 P01308 100.0 3e-17 EM
 2018-11-21 VAL B:18 B:18 111.0 0.716 T -93.6 -32.3 37.0 0.239 0.477 A:P01308:0.477
6p4z 2 P01308 100.0 3e-17 X-RAY
 2019-06-12 VAL B:18 B:18 109.0 0.703 H -67.1 -40.9 20.0 0.129 0.574 C:P01308:0.123
A:P01308:0.477
D:P01308:0.065
 HOH
 5.710
 C
 O
VAL D:18 D:18 108.0 0.697 H -81.1 -30.4 0.0 0.0 0.697 B:P01308:0.355
C:P01308:0.497
A:P01308:0.11
 HOH
 2.828
 O
 O
6s34 2 P01308 100.0 3e-17 X-RAY
 2019-07-03 VAL B:18 B:18 74.0 0.477 H -69.7 -45.2 24.0 0.155 0.322 A:P01308:0.323
 HOH
 2.415
 HG11
 O
6sof 4 P01308 100.0 3e-17 EM
 2019-11-13 VAL F:18 H:18 87.0 0.561 H -105.3 -19.1 46.0 0.297 0.264 E:P01308:0.265
VAL H:18 F:18 90.0 0.581 H -77.2 -62.7 61.0 0.394 0.187 G:P01308:0.187
VAL J:18 L:18 98.0 0.632 H -85.0 -61.8 28.0 0.181 0.451 I:P01308:0.168
C:P06213:0.31
VAL L:18 J:18 123.0 0.794 H -60.3 -31.1 22.0 0.142 0.652 A:P06213:0.284
K:P01308:0.368
6vep 2 P01308 100.0 3e-17 X-RAY
 2020-06-03 VAL B:18 B:18 115.0 0.742 H -54.0 -45.5 49.0 0.316 0.426 A:P01308:0.426
VAL H:18 H:18 113.0 0.729 H -59.8 -30.6 NA NA NA
VAL N:18 N:18 112.0 0.723 H -64.9 -49.8 NA NA NA
VAL T:18 T:18 119.0 0.768 H -64.6 -34.8 NA NA NA
6z7w 4 P01308 100.0 3e-17 X-RAY
 2020-12-30 VAL J:18 J:18 125.0 0.806 H -74.3 -36.4 15.0 0.097 0.709 I:P01308:0.581
A:None:0.277
 HOH
 3.141
 O
 O
VAL L:18 L:18 115.0 0.742 H -75.2 -34.6 NA NA NA
VAL N:18 N:18 126.0 0.813 H -71.2 -36.1 NA NA NA
VAL P:18 P:18 112.0 0.723 H -73.0 -34.4 NA NA NA
6z7y 4 P01308 100.0 3e-17 X-RAY
 2020-12-30 VAL F:18 F:18 107.0 0.69 H -74.5 -39.9 NA NA NA
VAL H:18 H:18 112.0 0.723 H -77.8 -41.2 36.0 0.232 0.491 G:P01308:0.49
 HOH
 7.502
 CG2
 O
7pg0 3 P01308 100.0 3e-17 EM
 2022-02-02 VAL D:18 D:18 109.0 0.703 H -63.5 -42.9 38.0 0.245 0.458 C:P01308:0.458
VAL F:18 F:18 107.0 0.69 H -64.5 -49.0 20.0 0.129 0.561 A:P06213:0.394
E:P01308:0.181
VAL H:18 J:18 81.0 0.523 H -82.7 -58.9 5.0 0.032 0.491 G:P01308:0.361
B:P06213:0.206
7pg2 3 P01308 100.0 3e-17 EM
 2022-02-02 VAL D:18 D:18 115.0 0.742 T -60.0 -52.1 40.0 0.258 0.484 C:P01308:0.484
VAL F:18 F:18 114.0 0.735 H -64.8 -41.5 0.0 0.0 0.735 A:P06213:0.561
E:P01308:0.355
VAL H:18 J:18 109.0 0.703 H -66.4 -48.1 2.0 0.013 0.69 G:P01308:0.452
B:P06213:0.368
7pg3 3 P01308 100.0 3e-17 EM
 2022-02-02 VAL D:18 D:18 102.0 0.658 T -67.0 -44.2 33.0 0.213 0.445 C:P01308:0.445
VAL F:18 F:18 93.0 0.6 H -77.0 -32.2 6.0 0.039 0.561 A:P06213:0.31
E:P01308:0.329
VAL H:18 J:18 106.0 0.684 H -94.3 -37.9 22.0 0.142 0.542 B:P06213:0.232
G:P01308:0.419
7pg4 3 P01308 100.0 3e-17 EM
 2022-02-02 VAL D:18 D:18 116.0 0.748 T -99.0 -54.3 48.0 0.31 0.438 C:P01308:0.439
VAL F:18 J:18 104.0 0.671 H -61.3 -30.9 4.0 0.026 0.645 E:P01308:0.432
B:P06213:0.4
7qid 4 P01308 100.0 3e-17 EM
 2022-02-02 VAL F:18 F:18 105.0 0.677 H -67.9 -49.9 59.0 0.381 0.296 E:P01308:0.297
VAL H:18 L:18 103.0 0.665 H -91.8 -40.9 28.0 0.181 0.484 G:P01308:0.426
C:P06213:0.103
VAL J:18 J:18 111.0 0.716 T -95.2 15.8 49.0 0.316 0.4 I:P01308:0.329
A:P06213:0.077
7s4y 2 P01308 100.0 3e-17 X-RAY
 2021-10-27 VAL B:18 B:18 96.0 0.619 H -59.4 -50.6 24.0 0.155 0.464 A:P01308:0.465
 HOH
 7.760
 N
 O
VAL D:18 D:18 103.0 0.665 H -59.5 -50.5 NA NA NA
5mhd 2 P01308 96.77 4e-17 NMR
 2017-08-09 VAL B:18 B:18 90.0 0.581 H -66.7 -36.4 5.0 0.032 0.549 A:P01308:0.548
1iza 2 P01315 96.67 1e-16 X-RAY
 1993-10-31 VAL B:18 B:18 104.0 0.671 H -59.5 -47.9 28.0 0.181 0.49 A:P01315:0.49
 HOH
 5.223
 CG1
 O
VAL D:18 D:18 83.0 0.535 H -51.9 -41.5 NA NA NA
1izb 2 P01315 96.67 1e-16 X-RAY
 1993-10-31 VAL B:18 B:18 100.0 0.645 H -76.2 -38.6 36.0 0.232 0.413 A:P01315:0.413
VAL D:18 D:18 107.0 0.69 H -68.5 -41.4 NA NA NA
4une 2 P01308 96.67 1e-16 X-RAY
 2014-10-15 VAL B:18 B:18 112.0 0.723 H -71.2 -35.3 38.0 0.245 0.478 A:P01308:0.477
 HOH
 2.855
 O
 O
VAL D:18 D:18 110.0 0.71 H -74.6 -28.7 NA NA NA
1b9e 2 P01308 96.67 1e-16 X-RAY
 1999-11-17 VAL B:18 B:18 117.0 0.755 H -70.1 -43.7 41.0 0.265 0.49 A:P01308:0.49
 HOH
 3.557
 O
 O
VAL D:18 D:18 122.0 0.787 H -62.7 -40.8 45.0 0.29 0.497 C:P01308:0.497
 HOH
 6.015
 N
 O
1mhi 2 P01308 96.67 2e-16 NMR
 1995-10-15 VAL B:18 B:18 85.0 0.548 H -74.5 -64.7 20.0 0.129 0.419 A:P01308:0.419
2mvd 2 P01308 96.67 2e-16 NMR
 2014-12-10 VAL B:18 B:48 110.0 0.71 H -81.2 -31.2 66.0 0.426 0.284 A:P01308:0.284
1uz9 2 P01308 100.0 2e-16 X-RAY
 2005-03-03 VAL B:18 B:18 104.0 0.671 H -64.4 -42.0 23.0 0.148 0.523 A:P01308:0.471
B:P01308:0.006
A:P01308:0.045
 CRS
CRS
HOH
 7.021
8.843
2.865
 CG2
N
O
 C7
C7
O
1xda 2 P01308 100.0 2e-16 X-RAY
 1997-07-07 VAL B:18 B:18 98.0 0.632 H -61.9 -41.4 24.0 0.155 0.477 A:P01308:0.477
 HOH
 2.677
 O
 O
VAL D:18 D:18 104.0 0.671 H -68.7 -42.7 NA NA NA
VAL F:18 F:18 103.0 0.665 H -62.5 -44.4 NA NA NA
VAL H:18 H:18 96.0 0.619 H -76.2 -35.6 NA NA NA
2c8q 2 P01308 100.0 2e-16 X-RAY
 2006-03-08 VAL B:18 B:18 75.0 0.484 H -71.7 -45.9 23.0 0.148 0.336 A:P01308:0.335
 HOH
 5.631
 N
 O
2c8r 2 P01308 100.0 2e-16 X-RAY
 2006-03-08 VAL B:18 B:18 74.0 0.477 H -71.6 -45.3 22.0 0.142 0.335 A:P01308:0.335
 HOH
 2.890
 O
 O
2w44 2 A6XGL2 100.0 2e-16 X-RAY
 2009-12-22 VAL B:18 B:18 100.0 0.645 H -68.6 -45.0 8.0 0.052 0.593 A:A6XGL2:0.523
E:A6XGL2:0.11
 RCO
RCO
HOH
 7.509
7.368
3.567
 CG2
N
O
 O3
O3
O
VAL D:18 D:18 105.0 0.677 H -59.6 -43.0 30.0 0.194 0.483 C:A6XGL2:0.445
D:A6XGL2:0.052
 RCO
RCO
HOH
 7.078
8.199
3.179
 CG2
N
O
 O1
O1
O
VAL F:18 F:18 112.0 0.723 H -72.7 -40.2 19.0 0.123 0.6 B:A6XGL2:0.077
A:A6XGL2:0.097
E:A6XGL2:0.523
 RCO
RCO
HOH
 7.000
8.384
5.067
 CG2
N
N
 O3
O3
O
3e7y 2 P01308 100.0 2e-16 X-RAY
 2009-02-24 VAL B:18 B:18 97.0 0.626 H -72.1 -43.7 25.0 0.161 0.465 A:P01308:0.465
 HOH
 7.653
 CG2
 O
VAL D:18 D:18 107.0 0.69 H -74.4 -36.2 NA NA NA
3e7z 2 P01308 100.0 2e-16 X-RAY
 2009-02-24 VAL B:18 B:18 105.0 0.677 H -70.3 -43.7 31.0 0.2 0.477 A:P01308:0.477
 HOH
 6.659
 CG1
 O
VAL D:18 D:18 96.0 0.619 H -75.4 -36.9 NA NA NA
4ajx 2 P01308 100.0 2e-16 X-RAY
 2013-01-09 VAL B:18 B:18 96.0 0.619 H -70.1 -38.7 5.0 0.032 0.587 A:P01308:0.471
I:P01308:0.155
 RCO
RCO
HOH
 6.853
7.909
2.837
 HG22
N
HG11
 O3
O1
O
VAL D:18 D:18 118.0 0.761 H -70.5 -39.0 27.0 0.174 0.587 C:P01308:0.523
E:P01308:0.103
 RCO
RCO
HOH
 6.838
8.125
4.960
 HG22
N
N
 O1
O3
O
VAL F:18 F:18 122.0 0.787 H -79.0 -41.4 31.0 0.2 0.587 C:P01308:0.116
E:P01308:0.51
 RCO
HOH
 8.354
2.977
 N
O
 O1
O
VAL H:18 H:18 124.0 0.8 H -69.5 -43.2 24.0 0.155 0.645 K:P01308:0.116
G:P01308:0.574
L:P01308:0.077
 RCO
NA
RCO
HOH
 6.595
6.977
8.176
2.865
 HG22
H
N
O
 O3
NA
O1
O
VAL J:18 J:18 121.0 0.781 H -74.0 -39.8 26.0 0.168 0.613 B:P01308:0.077
A:P01308:0.103
I:P01308:0.529
 RCO
RCO
HOH
 8.214
6.751
2.806
 N
HG22
O
 O3
O1
O
VAL L:18 L:18 96.0 0.619 H -72.7 -33.8 10.0 0.065 0.554 K:P01308:0.439
G:P01308:0.155
 RCO
IMD
RCO
HOH
 7.675
9.397
8.302
2.660
 N
HG12
HG13
O
 O3
H4
O1
O
4ajz 2 P01308 100.0 2e-16 X-RAY
 2013-01-09 VAL B:18 B:18 74.0 0.477 H -64.3 -44.3 19.0 0.123 0.354 A:P01308:0.355
 HOH
 5.478
 N
 O
VAL D:18 D:18 121.0 0.781 H -68.5 -42.1 NA NA NA
4ak0 2 P01308 100.0 2e-16 X-RAY
 2013-01-09 VAL B:18 B:18 77.0 0.497 H -79.8 -41.7 24.0 0.155 0.342 A:P01308:0.342
 HOH
 2.766
 O
 O
4akj 2 P01308 100.0 2e-16 X-RAY
 2013-01-09 VAL B:18 B:18 115.0 0.742 H -57.0 -51.7 40.0 0.258 0.484 A:P01308:0.484
 IPH
HOH
 7.824
5.555
 CG2
N
 C5
O
VAL D:18 D:18 114.0 0.735 H -59.9 -48.3 NA NA NA
4iyd 2 P01308 100.0 2e-16 X-RAY
 2014-02-12 VAL B:18 B:18 95.0 0.613 H -70.8 -45.7 30.0 0.194 0.419 A:P01308:0.419
 HOH
 2.609
 HG13
 O
4iyf 2 P01308 100.0 2e-16 X-RAY
 2014-02-12 VAL B:18 B:18 92.0 0.594 H -72.7 -44.3 30.0 0.194 0.4 A:P01308:0.4
 HOH
 5.779
 C
 O
5viz 2 P01308 100.0 2e-16 X-RAY
 2017-10-18 VAL B:18 B:18 72.0 0.465 H -77.6 -45.3 25.0 0.161 0.304 A:P01308:0.303
 HOH
 3.436
 O
 O
6o17 2 P01308 100.0 2e-16 X-RAY
 2020-02-26 VAL B:18 B:18 76.0 0.49 H -70.3 -44.9 23.0 0.148 0.342 A:P01308:0.342
 HOH
 2.808
 O
 O
6or0 2 P01317 100.0 2e-16 X-RAY
 2019-12-11 VAL B:18 B:18 72.0 0.465 H -72.2 -42.0 23.0 0.148 0.317 A:P01317:0.316
 HOH
 5.798
 C
 O
7nhu 2 P01308 100.0 2e-16 X-RAY
 2021-06-16 VAL B:18 B:18 75.0 0.484 H -72.3 -43.3 25.0 0.161 0.323 A:P01308:0.323
 HOH
 2.998
 O
 O
1aph 2 P01317 100.0 2e-16 X-RAY
 1993-01-15 VAL B:18 B:18 78.0 0.503 H -75.8 -40.1 30.0 0.194 0.309 A:P01317:0.31
 DCE
HOH
 9.392
2.868
 N
O
 CL2
O
1b17 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 78.0 0.503 H -72.4 -48.4 26.0 0.168 0.335 A:P01315:0.335
 HOH
 2.761
 O
 O
1b18 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 76.0 0.49 H -73.7 -46.0 24.0 0.155 0.335 A:P01315:0.335
 HOH
 2.964
 O
 O
1b19 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 82.0 0.529 H -72.9 -48.5 28.0 0.181 0.348 A:P01315:0.348
 HOH
 2.658
 O
 O
1b2a 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 82.0 0.529 H -74.6 -46.7 28.0 0.181 0.348 A:P01315:0.348
 HOH
 2.795
 O
 O
1b2b 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 81.0 0.523 H -72.9 -49.8 29.0 0.187 0.336 A:P01315:0.335
 HOH
 3.001
 O
 O
1b2c 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 79.0 0.51 H -72.2 -48.1 26.0 0.168 0.342 A:P01315:0.342
 HOH
 3.042
 O
 O
1b2d 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 80.0 0.516 H -73.2 -46.8 28.0 0.181 0.335 A:P01315:0.335
 HOH
 2.731
 O
 O
1b2e 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 79.0 0.51 H -72.9 -46.7 26.0 0.168 0.342 A:P01315:0.342
 HOH
 2.771
 O
 O
1b2f 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 78.0 0.503 H -72.7 -48.5 25.0 0.161 0.342 A:P01315:0.342
 HOH
 3.076
 O
 O
1b2g 2 P01315 100.0 2e-16 X-RAY
 2003-04-08 VAL B:18 B:18 76.0 0.49 H -75.2 -44.5 27.0 0.174 0.316 A:P01315:0.316
 HOH
 4.326
 N
 O
1bph 2 P01317 100.0 2e-16 X-RAY
 1993-01-15 VAL B:18 B:18 94.0 0.606 H -76.0 -37.8 36.0 0.232 0.374 A:P01317:0.374
 DCE
HOH
 9.421
2.982
 N
O
 CL2
O
1cph 2 P01317 100.0 2e-16 X-RAY
 1993-01-15 VAL B:18 B:18 80.0 0.516 H -71.8 -38.4 30.0 0.194 0.322 A:P01317:0.323
 DCE
HOH
 9.411
3.316
 N
O
 CL2
O
1dph 2 P01317 100.0 2e-16 X-RAY
 1993-01-15 VAL B:18 B:18 74.0 0.477 H -74.7 -44.7 29.0 0.187 0.29 A:P01317:0.29
 DCE
HOH
 9.408
2.548
 N
O
 CL2
O
1m5a 2 P01315 100.0 2e-16 X-RAY
 2002-08-14 VAL B:18 B:18 121.0 0.781 H -69.2 -43.7 26.0 0.168 0.613 D:P01315:0.032
A:P01315:0.535
C:P01315:0.097
 HOH
 2.554
 O
 O
VAL D:18 D:18 110.0 0.71 H -63.2 -46.1 0.0 0.0 0.71 C:P01315:0.516
B:P01315:0.342
A:P01315:0.097
 HOH
 2.732
 O
 O
1mpj 2 P01315 100.0 2e-16 X-RAY
 1996-01-29 VAL B:18 B:18 110.0 0.71 H -73.7 -46.8 33.0 0.213 0.497 A:P01315:0.497
 IPH
HOH
 7.670
3.035
 CG2
O
 C5
O
VAL D:18 D:18 88.0 0.568 H -68.9 -25.2 NA NA NA
1wav 2 P01315 100.0 2e-16 X-RAY
 1997-02-28 VAL B:18 B:18 108.0 0.697 H -78.9 -45.1 27.0 0.174 0.523 A:P01315:0.523
 IPH
HOH
 7.314
8.749
 CG1
O
 C5
O
VAL D:18 D:18 108.0 0.697 H -80.1 -53.3 NA NA NA
VAL F:18 F:18 110.0 0.71 H -61.1 -35.4 NA NA NA
VAL H:18 H:18 117.0 0.755 H -74.1 -42.5 NA NA NA
VAL J:18 J:18 118.0 0.761 H -97.0 -1.9 NA NA NA
VAL L:18 L:18 109.0 0.703 H -70.6 -22.5 NA NA NA
1zni 2 P01315 100.0 2e-16 X-RAY
 1998-01-28 VAL B:18 B:18 118.0 0.761 H -77.1 -37.4 29.0 0.187 0.574 A:P01315:0.574
 ZN
CL
CL
HOH
 8.556
7.579
7.665
3.176
 CG2
CG2
CG2
O
 ZN
CL
CL
O
VAL D:18 D:18 88.0 0.568 H -73.1 -34.0 NA NA NA
2a3g 2 P01317 100.0 2e-16 X-RAY
 2005-10-25 VAL B:18 B:18 123.0 0.794 H -75.1 -39.7 0.0 0.0 0.794 D:P01317:0.387
A:P01317:0.548
C:P01317:0.129
 HOH
 2.918
 O
 O
VAL D:18 D:18 118.0 0.761 H -66.3 -45.3 1.0 0.006 0.755 C:P01317:0.535
B:P01317:0.361
A:P01317:0.11
 HOH
 3.008
 O
 O
2bn1 2 P01317 100.0 2e-16 X-RAY
 2005-09-07 VAL B:18 B:18 73.0 0.471 H -70.0 -43.7 24.0 0.155 0.316 A:P01317:0.316
 HOH
 2.802
 O
 O
2bn3 2 P01317 100.0 2e-16 X-RAY
 2005-09-07 VAL B:18 B:18 73.0 0.471 H -70.3 -44.6 24.0 0.155 0.316 A:P01317:0.316
 HOH
 2.772
 O
 O
2efa 2 P01315 100.0 2e-16 NEUTRON DIFFRACTION
 2008-01-22 VAL B:18 B:18 73.0 0.471 H -77.5 -46.4 26.0 0.168 0.303 A:P01315:0.303
2g4m 2 P01315 100.0 2e-16 X-RAY
 2007-02-20 VAL B:18 B:18 74.0 0.477 H -72.2 -42.9 25.0 0.161 0.316 A:P01315:0.316
 HOH
 2.657
 O
 O
2tci 2 P01315 100.0 2e-16 X-RAY
 1996-01-29 VAL B:18 B:18 113.0 0.729 H -71.9 -48.8 32.0 0.206 0.523 A:P01315:0.523
 HOH
 3.333
 O
 O
VAL D:18 D:18 81.0 0.523 H -64.2 -44.6 NA NA NA
2zp6 2 P01317 100.0 2e-16 X-RAY
 2008-07-22 VAL B:18 B:18 121.0 0.781 H -71.6 -28.3 34.0 0.219 0.562 A:P01317:0.561
 HOH
 3.588
 O
 O
VAL D:18 D:18 128.0 0.826 H -62.1 -43.2 NA NA NA
2zpp 2 P01315 100.0 2e-16 NEUTRON DIFFRACTION
 2008-10-28 VAL B:18 B:18 75.0 0.484 H -73.0 -52.9 26.0 0.168 0.316 A:P01315:0.316
3fhp 2 P01315 100.0 2e-16 NEUTRON DIFFRACTION
 2009-10-20 VAL B:18 B:18 123.0 0.794 H -83.8 -44.3 1.0 0.006 0.788 C:P01315:0.116
D:P01315:0.387
A:P01315:0.535
VAL D:18 D:18 110.0 0.71 H -76.9 -45.8 0.0 0.0 0.71 C:P01315:0.51
B:P01315:0.329
A:P01315:0.09
3gky 2 P01315 100.0 2e-16 X-RAY
 2009-03-24 VAL B:18 B:18 80.0 0.516 H -66.2 -45.0 14.0 0.09 0.426 A:P01315:0.355
D:P01315:0.019
C:P01315:0.103
 IPH
HOH
 8.923
2.316
 N
O
 C5
O
VAL D:18 D:18 117.0 0.755 H -82.2 -37.3 4.0 0.026 0.729 B:P01315:0.187
C:P01315:0.542
A:P01315:0.039
 IPH
HOH
 8.015
2.975
 CG2
O
 C5
O
3i3z 2 P01308 100.0 2e-16 X-RAY
 2010-01-05 VAL B:18 B:18 77.0 0.497 H -68.9 -43.5 23.0 0.148 0.349 A:P01308:0.348
 HOH
 2.772
 O
 O
3i40 2 P01308 100.0 2e-16 X-RAY
 2010-01-05 VAL B:18 B:18 75.0 0.484 H -71.8 -42.4 20.0 0.129 0.355 A:P01308:0.355
 HOH
 2.696
 O
 O
3ins 2 P01315 100.0 2e-16 NEUTRON DIFFRACTION
X-RAY
 1989-01-09 VAL B:18 B:18 118.0 0.761 H -65.3 -48.4 36.0 0.232 0.529 A:P01315:0.529
VAL D:18 D:18 119.0 0.768 H -69.3 -36.8 NA NA NA
3mth 2 P01315 100.0 2e-16 X-RAY
 1996-01-29 VAL B:18 B:18 116.0 0.748 H -69.6 -53.7 35.0 0.226 0.522 A:P01315:0.523
 MPB
HOH
 7.690
3.244
 CG2
O
 C6
O
VAL D:18 D:18 90.0 0.581 H -75.9 -34.3 NA NA NA
3rto 2 P01315 100.0 2e-16 X-RAY
 2011-05-18 VAL B:18 B:18 126.0 0.813 H -66.0 -41.4 2.0 0.013 0.8 C:P01315:0.129
D:P01315:0.361
A:P01315:0.548
 HOH
 3.058
 O
 O
VAL D:18 D:18 103.0 0.665 H -73.1 -41.1 2.0 0.013 0.652 C:P01315:0.465
B:P01315:0.258
A:P01315:0.116
 HOH
 6.282
 O
 O
3t2a 2 P01315 100.0 2e-16 X-RAY
 2011-12-28 VAL B:18 B:18 79.0 0.51 H -68.2 -45.9 27.0 0.174 0.336 A:P01315:0.335
 TMO
HOH
 5.208
2.914
 CA
O
 CAA
O
4a7e 2 P01315 100.0 2e-16 X-RAY
 2011-11-30 VAL B:18 B:18 73.0 0.471 H -76.4 -42.1 23.0 0.148 0.323 A:P01315:0.323
 HOH
 2.816
 HG13
 O
4bs3 2 P01317 100.0 2e-16 X-RAY
 2013-07-17 VAL B:18 B:18 81.0 0.523 H -73.6 -44.8 30.0 0.194 0.329 A:P01317:0.329
 HOH
 2.930
 O
 O
4e7t 2 P01317 100.0 2e-16 X-RAY
 2012-04-04 VAL B:18 B:18 105.0 0.677 H -67.6 -40.8 30.0 0.194 0.483 A:P01317:0.484
 HOH
 3.100
 HA
 O
VAL D:18 D:18 114.0 0.735 H -75.1 -38.1 NA NA NA
4e7u 2 P01317 100.0 2e-16 X-RAY
 2012-04-04 VAL B:18 B:18 72.0 0.465 H -69.1 -38.5 19.0 0.123 0.342 A:P01317:0.342
 HOH
 3.434
 O
 O
VAL D:18 D:18 100.0 0.645 H -71.1 -42.5 NA NA NA
4e7v 2 P01317 100.0 2e-16 X-RAY
 2012-04-04 VAL B:18 B:18 94.0 0.606 H -70.5 -36.6 NA NA NA
VAL D:18 D:18 112.0 0.723 H -73.0 -35.9 NA NA NA
VAL F:18 F:18 104.0 0.671 H -65.6 -42.0 NA NA NA
VAL H:18 H:18 112.0 0.723 H -79.2 -32.8 NA NA NA
VAL J:18 J:18 100.0 0.645 H -66.7 -44.8 NA NA NA
VAL L:18 L:18 113.0 0.729 H -71.4 -41.3 NA NA NA
VAL N:18 N:18 107.0 0.69 H -66.0 -36.7 NA NA NA
VAL P:18 P:18 113.0 0.729 H -73.9 -36.8 NA NA NA
VAL R:18 R:18 105.0 0.677 H -65.3 -39.9 NA NA NA
VAL T:18 T:18 123.0 0.794 H -71.4 -40.9 NA NA NA
VAL V:18 V:18 105.0 0.677 H -66.0 -44.2 NA NA NA
VAL X:18 X:18 123.0 0.794 H -75.5 -35.1 NA NA NA
VAL Z:18 Z:18 108.0 0.697 H -66.8 -41.3 NA NA NA
VAL BA:18 2:18 119.0 0.768 H -72.9 -41.2 36.0 0.232 0.536 AA:P01317:0.535
 CRS
HOH
 7.161
5.018
 CG2
N
 C7
O
VAL DA:18 4:18 94.0 0.606 H -72.5 -39.6 NA NA NA
VAL FA:18 6:18 112.0 0.723 H -69.1 -35.3 NA NA NA
4i5y 2 P01317 100.0 2e-16 X-RAY
 2013-11-20 VAL B:18 B:18 73.0 0.471 H -75.8 -38.6 25.0 0.161 0.31 A:P01317:0.31
 HOH
 2.714
 O
 O
4i5z 2 P01317 100.0 2e-16 X-RAY
 2013-11-20 VAL B:18 B:18 74.0 0.477 H -73.9 -39.4 25.0 0.161 0.316 A:P01317:0.316
 HOH
 2.690
 O
 O
4idw 2 P01317 100.0 2e-16 POWDER DIFFRACTION
 2013-06-05 VAL B:18 B:18 122.0 0.787 H -60.6 -68.6 38.0 0.245 0.542 A:P01317:0.542
 HOH
 2.568
 O
 O
VAL D:18 D:18 121.0 0.781 H -65.6 -43.6 NA NA NA
4ihn 2 P01317 100.0 2e-16 X-RAY
 2013-12-25 VAL B:18 B:18 71.0 0.458 H -70.1 -43.4 22.0 0.142 0.316 A:P01317:0.316
 HOH
 2.899
 O
 O
4ins 2 P01315 100.0 2e-16 X-RAY
 1990-04-15 VAL B:18 B:18 123.0 0.794 H -67.2 -47.6 40.0 0.258 0.536 A:P01315:0.535
 HOH
 2.774
 O
 O
VAL D:18 D:18 121.0 0.781 H -73.6 -41.8 NA NA NA
4m4f 2 P01317 100.0 2e-16 X-RAY
 2014-01-15 VAL B:18 B:18 117.0 0.755 H -70.2 -42.6 34.0 0.219 0.536 A:P01317:0.535
 HOH
 3.233
 O
 O
VAL D:18 D:18 118.0 0.761 H -71.9 -42.1 NA NA NA
4m4h 2 P01317 100.0 2e-16 X-RAY
 2014-01-15 VAL B:18 B:18 119.0 0.768 H -67.3 -39.4 36.0 0.232 0.536 A:P01317:0.535
 HOH
 3.110
 O
 O
VAL D:18 D:18 118.0 0.761 H -72.0 -39.8 NA NA NA
4m4i 2 P01317 100.0 2e-16 X-RAY
 2014-01-15 VAL B:18 B:18 119.0 0.768 H -69.2 -41.0 37.0 0.239 0.529 A:P01317:0.529
 HOH
 3.090
 O
 O
VAL D:18 D:18 116.0 0.748 H -72.9 -39.6 NA NA NA
4m4j 2 P01317 100.0 2e-16 X-RAY
 2014-01-15 VAL B:18 B:18 120.0 0.774 H -70.2 -39.0 38.0 0.245 0.529 A:P01317:0.529
 HOH
 3.126
 O
 O
VAL D:18 D:18 106.0 0.684 H -68.3 -41.3 NA NA NA
4m4l 2 P01317 100.0 2e-16 X-RAY
 2014-01-15 VAL B:18 B:18 118.0 0.761 H -67.8 -41.1 36.0 0.232 0.529 A:P01317:0.529
 HOH
 2.812
 O
 O
VAL D:18 D:18 114.0 0.735 H -74.7 -39.0 NA NA NA
4m4m 2 P01317 100.0 2e-16 X-RAY
 2014-01-15 VAL B:18 B:18 124.0 0.8 H -68.2 -38.1 38.0 0.245 0.555 A:P01317:0.555
 HOH
 3.021
 O
 O
VAL D:18 D:18 114.0 0.735 H -74.7 -35.8 NA NA NA
5d52 2 P01315 100.0 2e-16 X-RAY
 2016-01-13 VAL B:18 B:18 92.0 0.594 H -67.9 -45.8 33.0 0.213 0.381 A:P01315:0.381
 PO4
HOH
 9.925
2.859
 CG2
O
 O1
O
5d53 2 P01315 100.0 2e-16 X-RAY
 2016-01-13 VAL B:18 B:18 91.0 0.587 H -71.6 -42.5 27.0 0.174 0.413 A:P01315:0.413
 PO4
PE5
HOH
 9.086
3.901
2.789
 HG23
O
O
 O1
O3
O
5d54 2 P01315 100.0 2e-16 X-RAY
 2016-01-13 VAL B:18 B:18 93.0 0.6 H -72.7 -42.9 28.0 0.181 0.419 A:P01315:0.419
 PO4
PO4
PE5
HOH
 9.538
9.928
3.039
2.814
 HG23
HG23
O
HG13
 O1
O1
H51
O
5d5e 2 P01315 100.0 2e-16 X-RAY
 2016-01-13 VAL B:18 B:18 93.0 0.6 H -77.8 -44.9 28.0 0.181 0.419 A:P01315:0.419
 PO4
PE5
HOH
 9.977
3.770
2.853
 CG2
O
O
 O4
O3
O
5fb6 2 P01315 100.0 2e-16 X-RAY
 2016-06-15 VAL B:18 B:18 79.0 0.51 H -75.1 -42.8 27.0 0.174 0.336 A:P01315:0.335
 HOH
 5.777
 N
 O
5kqv 2 P01317 100.0 2e-16 X-RAY
 2017-07-19 VAL B:18 B:18 129.0 0.832 H -72.7 -41.2 67.0 0.432 0.4 A:P01317:0.4
VAL H:18 J:18 128.0 0.826 H -72.2 -54.4 60.0 0.387 0.439 G:P01317:0.439
5lis 2 P01315 100.0 2e-16 X-RAY
 2016-08-03 VAL B:18 B:18 82.0 0.529 H -71.7 -47.4 33.0 0.213 0.316 A:P01315:0.316
 HOH
 4.476
 CG2
 O
5miz 2 P01317 100.0 2e-16 NMR
 2017-01-25 VAL B:18 B:18 115.0 0.742 T -92.1 -28.3 115.0 0.742 0.0
6ce7 3 P01318 100.0 2e-16 EM
 2018-03-14 VAL D:18 O:18 104.0 0.671 H -75.2 -46.8 30.0 0.194 0.477 C:P01308:0.477
6ce9 4 P01318 100.0 2e-16 EM
 2018-03-14 VAL E:18 L:18 108.0 0.697 H -74.2 -46.4 27.0 0.174 0.523 D:P01308:0.523
VAL G:18 O:18 108.0 0.697 H -74.2 -46.4 32.0 0.206 0.491 F:P01308:0.49
6ceb 4 P01318 100.0 2e-16 EM
 2018-03-14 VAL E:18 L:18 115.0 0.742 H -69.7 -47.1 32.0 0.206 0.536 D:P01308:0.535
VAL G:18 O:18 114.0 0.735 H -69.7 -47.1 34.0 0.219 0.516 F:P01308:0.516
6kh8 2 P01317 100.0 2e-16 NMR
 2020-10-07 VAL B:18 B:18 122.0 0.787 T -122.6 -59.1 50.0 0.323 0.464 A:P01317:0.465
6kh9 2 P01317 100.0 2e-16 NMR
 2020-08-12 VAL B:18 B:18 96.0 0.619 H -63.4 -36.5 91.0 0.587 0.032 A:P01317:0.032
6kha 2 P01317 100.0 2e-16 NMR
 2020-08-12 VAL B:18 B:18 102.0 0.658 H -99.4 -67.6 29.0 0.187 0.471 A:P01317:0.471
6q8q 2 P01317 100.0 2e-16 X-RAY
 2020-01-15 VAL B:18 B:18 73.0 0.471 H -68.4 -45.3 26.0 0.168 0.303 A:P01317:0.303
 AR
HOH
 9.361
2.626
 N
O
 AR
O
6qq7 2 P01317 100.0 2e-16 X-RAY
 2019-02-27 VAL B:18 B:18 75.0 0.484 H -73.6 -44.0 27.0 0.174 0.31 A:P01317:0.31
 HOH
 4.845
 N
 O
6qqg 2 P01317 100.0 2e-16 X-RAY
 2019-03-06 VAL B:18 B:18 93.0 0.6 H -67.7 -46.2 35.0 0.226 0.374 A:P01317:0.374
 HOH
 3.188
 O
 O
6qrh 2 P01317 100.0 2e-16 X-RAY
 2019-02-27 VAL B:18 B:18 75.0 0.484 H -74.8 -41.7 28.0 0.181 0.303 A:P01317:0.303
 HOH
 2.834
 O
 O
6qrk 2 P01317 100.0 2e-16 X-RAY
 2019-03-06 VAL B:18 B:18 74.0 0.477 H -70.0 -48.3 25.0 0.161 0.316 A:P01317:0.316
 HOH
 2.789
 O
 O
6z7z 4 P01315 100.0 2e-16 X-RAY
 2020-12-30 VAL F:18 F:18 106.0 0.684 H -75.6 -30.8 NA NA NA
VAL H:18 H:18 107.0 0.69 H -78.3 -32.7 24.0 0.155 0.535 G:P01315:0.535
 HOH
 4.143
 O
 O
6zhb 2 P01317 100.0 2e-16 ELECTRON CRYSTALLOGRAPHY
 2021-01-27 VAL B:18 B:18 110.0 0.71 H -70.3 -72.4 11.0 0.071 0.639 C:P01317:0.116
D:P01317:0.148
A:P01317:0.394
VAL D:18 D:18 111.0 0.716 H -58.3 -61.0 4.0 0.026 0.69 B:P01317:0.271
C:P01317:0.413
A:P01317:0.116
7ac4 2 P01315 100.0 2e-16 X-RAY
 2021-09-01 VAL B:18 B:18 76.0 0.49 H -72.8 -43.6 25.0 0.161 0.329 A:P01315:0.329
 NA
HOH
 6.004
2.623
 N
O
 NA
O
7elj 2 P01317 100.0 2e-16 NMR
 2021-04-28 VAL B:18 B:18 118.0 0.761 H -98.3 -47.6 29.0 0.187 0.574 A:P01317:0.574
7ins 2 P01315 100.0 2e-16 X-RAY
 1994-01-31 VAL B:18 B:18 105.0 0.677 H -73.6 -51.2 28.0 0.181 0.496 A:P01315:0.497
 CRS
HOH
 6.667
3.064
 CG2
O
 C7
O
VAL D:18 D:18 118.0 0.761 H -62.5 -41.9 NA NA NA
VAL F:18 F:18 108.0 0.697 H -65.4 -39.9 NA NA NA
9ins 2 P01315 100.0 2e-16 X-RAY
 1991-11-07 VAL B:18 B:18 75.0 0.484 H -72.8 -49.5 24.0 0.155 0.329 A:P01315:0.329
 HOH
 3.033
 O
 O
1hls 2 P01308 96.67 2e-16 NMR
 1995-09-15 VAL B:18 B:18 117.0 0.755 H -75.6 -26.2 35.0 0.226 0.529 A:P01308:0.529
3jsd 2 P01308 96.67 2e-16 X-RAY
 2010-09-15 VAL B:18 B:18 91.0 0.587 H -67.3 -57.1 14.0 0.09 0.497 C:P01308:0.123
A:P01308:0.387
 IPH
HOH
 8.823
5.756
 N
C
 C5
O
VAL D:18 D:18 116.0 0.748 H -73.2 -43.8 12.0 0.077 0.671 B:P01308:0.219
C:P01308:0.49
 IPH
HOH
 7.653
8.065
 CG2
O
 C5
O
3p2x 2 P01308 96.67 2e-16 X-RAY
 2011-11-23 VAL B:18 B:18 69.0 0.445 H -53.9 -39.7 18.0 0.116 0.329 A:P01308:0.329
 HOH
 5.587
 N
 O
VAL D:18 D:18 105.0 0.677 H -65.3 -43.9 NA NA NA
4cxn 2 P01308 96.67 2e-16 X-RAY
 2014-05-28 VAL B:18 B:18 72.0 0.465 H -69.5 -43.6 22.0 0.142 0.323 A:P01308:0.323
 HOH
 2.732
 O
 O
4cy7 2 P01308 96.67 2e-16 X-RAY
 2014-05-28 VAL B:18 B:18 114.0 0.735 H -75.3 -33.5 40.0 0.258 0.477 A:P01308:0.477
 HOH
 2.772
 O
 O
VAL D:18 D:18 112.0 0.723 H -74.0 -23.4 NA NA NA
6ins 1 P01315 100.0 3e-16 X-RAY
 1994-01-31 VAL A:18 E:18 35.0 0.226 H -64.9 -59.2 35.0 0.226 0.0 HOH
 3.394
 O
 O
VAL B:18 F:18 29.0 0.187 H -66.1 -49.4 29.0 0.187 0.0 HOH
 3.045
 O
 O
1qiy 2 P01308 96.67 3e-16 X-RAY
 1999-06-22 VAL B:18 B:18 112.0 0.723 H -85.6 -37.0 16.0 0.103 0.62 A:P01308:0.51
H:P01308:0.052
G:P01308:0.142
 IPH
IPH
HOH
 7.591
8.909
2.481
 CG1
N
O
 C5
C5
O
VAL D:18 D:18 116.0 0.748 H -59.3 -54.7 23.0 0.148 0.6 C:P01308:0.497
I:P01308:0.148
 IPH
IPH
HOH
 7.886
8.939
3.837
 CG2
N
O
 C5
C5
O
VAL F:18 F:18 114.0 0.735 H -75.1 -49.3 12.0 0.077 0.658 K:P01308:0.155
L:P01308:0.097
E:P01308:0.529
 IPH
IPH
HOH
 7.740
8.636
6.643
 CG2
N
O
 C5
C5
O
VAL H:18 H:18 109.0 0.703 H -76.5 -44.4 14.0 0.09 0.613 A:P01308:0.142
G:P01308:0.497
 IPH
IPH
HOH
 9.009
8.202
2.836
 N
CG2
O
 C5
C5
O
VAL J:18 J:18 107.0 0.69 H -61.1 -50.2 19.0 0.123 0.567 C:P01308:0.129
D:P01308:0.084
I:P01308:0.477
 IPH
IPH
HOH
 8.612
7.708
4.852
 N
CG2
N
 C5
C5
O
VAL L:18 L:18 107.0 0.69 H -73.0 -43.6 12.0 0.077 0.613 K:P01308:0.516
E:P01308:0.116
 IPH
IPH
HOH
 9.173
7.716
7.057
 N
CG2
N
 C5
C5
O
1qiz 2 P01308 96.67 3e-16 X-RAY
 1999-06-22 VAL B:18 B:18 110.0 0.71 H -74.8 -40.5 16.0 0.103 0.607 A:P01308:0.503
H:P01308:0.045
G:P01308:0.148
 RCO
RCO
HOH
 7.521
8.244
3.090
 CG1
N
O
 O1
O1
O
VAL D:18 D:18 119.0 0.768 H -65.7 -45.4 26.0 0.168 0.6 C:P01308:0.497
I:P01308:0.142
 RCO
RCO
HOH
 7.322
8.176
5.755
 CG2
N
O
 O1
O1
O
VAL F:18 F:18 123.0 0.794 H -62.3 -46.2 18.0 0.116 0.678 K:P01308:0.129
L:P01308:0.097
E:P01308:0.594
 RCO
RCO
HOH
 6.817
8.265
5.056
 CG2
N
CG1
 O1
O1
O
VAL H:18 H:18 114.0 0.735 H -64.5 -49.4 21.0 0.135 0.6 A:P01308:0.097
G:P01308:0.523
 RCO
RCO
HOH
 8.205
7.250
3.026
 N
CG2
O
 O1
O1
O
VAL J:18 J:18 116.0 0.748 H -65.1 -45.5 20.0 0.129 0.619 C:P01308:0.129
I:P01308:0.529
 RCO
RCO
HOH
 7.741
7.326
3.062
 N
CG2
O
 O1
O1
O
VAL L:18 L:18 103.0 0.665 H -73.2 -39.3 8.0 0.052 0.613 K:P01308:0.503
E:P01308:0.142
 RCO
RCO
HOH
 7.765
7.596
5.189
 N
CG2
N
 O1
O1
O
1qj0 2 P01308 96.67 3e-16 X-RAY
 1999-06-22 VAL B:18 B:18 106.0 0.684 H -77.2 -31.2 5.0 0.032 0.652 D:P01308:0.316
A:P01308:0.445
 HOH
 3.053
 O
 O
VAL D:18 D:18 73.0 0.471 H -76.8 -19.7 9.0 0.058 0.413 C:P01308:0.342
A:P01308:0.11
 HOH
 3.802
 O
 O
1w8p 2 P01308 93.33 4e-16 X-RAY
 2005-02-03 VAL B:18 B:18 116.0 0.748 H -68.2 -43.3 14.0 0.09 0.658 A:P01308:0.561
G:P01308:0.161
 IPH
IPH
HOH
 8.039
8.825
4.183
 CG2
N
O
 C3
C3
O
VAL D:18 D:18 119.0 0.768 H -66.3 -41.8 33.0 0.213 0.555 C:P01308:0.452
J:P01308:0.058
I:P01308:0.142
 IPH
IPH
HOH
 7.987
9.051
5.607
 CG2
N
N
 C3
C3
O
VAL F:18 F:18 111.0 0.716 H -71.1 -40.7 20.0 0.129 0.587 E:P01308:0.503
K:P01308:0.142
 IPH
IPH
HOH
 7.799
8.858
3.479
 CG2
N
O
 C3
C3
O
VAL H:18 H:18 117.0 0.755 H -63.2 -45.6 19.0 0.123 0.632 B:P01308:0.071
A:P01308:0.155
G:P01308:0.523
 IPH
IPH
HOH
 8.910
7.956
5.915
 N
CG2
C
 C3
C3
O
VAL J:18 J:18 103.0 0.665 H -70.0 -41.9 7.0 0.045 0.62 C:P01308:0.181
I:P01308:0.49
 IPH
IPH
HOH
 8.683
8.293
5.423
 N
CG2
O
 C3
C3
O
VAL L:18 L:18 99.0 0.639 H -76.5 -35.2 7.0 0.045 0.594 K:P01308:0.471
E:P01308:0.187
 IPH
IPH
HOH
 8.822
8.405
4.991
 N
CG1
N
 C3
C3
O
2m2m 2 P01308 96.67 5e-16 NMR
 2013-03-06 VAL B:18 B:18 82.0 0.529 I -73.0 -40.6 12.0 0.077 0.452 A:P01308:0.452
2m2n 2 P01308 96.67 5e-16 NMR
 2013-03-06 VAL B:18 B:18 112.0 0.723 H -73.6 -56.5 37.0 0.239 0.484 A:P01308:0.484
2m2o 2 P01308 96.67 5e-16 NMR
 2013-03-06 VAL B:18 B:18 125.0 0.806 H -71.5 -34.5 52.0 0.335 0.471 A:P01308:0.471
2m2p 2 P01308 96.67 5e-16 NMR
 2013-03-06 VAL B:18 B:18 90.0 0.581 H -87.2 -36.3 27.0 0.174 0.407 A:P01308:0.406
3zi3 2 P01308 96.67 5e-16 X-RAY
 2013-03-06 VAL B:18 B:18 112.0 0.723 H -78.3 -22.2 40.0 0.258 0.465 A:P01308:0.465
 HOH
 5.891
 N
 O
2ws1 2 P01308 96.67 5e-16 X-RAY
 2010-02-09 VAL B:18 B:18 91.0 0.587 H -94.8 -14.6 3.0 0.019 0.568 B:P01308:0.155
A:P01308:0.168
A:P01308:0.413
 HOH
 4.820
 N
 O
2ws6 3 P01308 96.67 5e-16 X-RAY
 2010-02-09 VAL F:18 F:18 119.0 0.768 H -65.5 -40.2 28.0 0.181 0.587 K:P01308:0.135
L:P01308:0.077
E:P01308:0.477
 IPH
IPH
HOH
 7.754
9.046
3.549
 CG2
N
O
 C3
C3
O
VAL H:18 H:18 121.0 0.781 H -66.2 -43.0 26.0 0.168 0.613 B:P01308:0.071
A:P01308:0.135
G:P01308:0.523
 IPH
IPH
HOH
 8.991
7.718
4.841
 N
CG2
N
 C3
C3
O
VAL J:18 J:18 106.0 0.684 H -65.9 -34.3 5.0 0.032 0.652 C:P01308:0.181
D:P01308:0.09
I:P01308:0.516
 IPH
IPH
HOH
 8.628
8.117
2.662
 N
CG2
O
 C3
C3
O
VAL L:18 L:18 96.0 0.619 H -74.7 -34.1 8.0 0.052 0.567 K:P01308:0.432
E:P01308:0.161
 IPH
IPH
HOH
 8.722
8.977
2.909
 N
CG1
O
 C3
C3
O
5wdm 1 A6XGL2 96.67 6e-16 X-RAY
 2017-11-15 VAL A:18 A:18 26.0 0.168 H -82.7 -13.0 6.0 0.039 0.129 F:A6XGL2:0.129
VAL B:18 B:18 42.0 0.271 H -81.7 -12.4 21.0 0.135 0.136 C:A6XGL2:0.135
VAL C:18 C:18 43.0 0.277 H -83.0 -16.5 34.0 0.219 0.058 B:A6XGL2:0.058
VAL D:18 D:18 36.0 0.232 H -81.8 -15.5 26.0 0.168 0.064 E:A6XGL2:0.065
VAL E:18 E:18 38.0 0.245 H -80.9 -15.1 32.0 0.206 0.039 D:A6XGL2:0.039
VAL F:18 F:18 26.0 0.168 H -82.8 -16.6 2.0 0.013 0.155 A:A6XGL2:0.155
3bxq 2 P01308 96.67 6e-16 X-RAY
 2008-05-20 VAL B:18 B:18 101.0 0.652 H -71.3 -41.7 0.0 0.0 0.652 D:P01308:0.297
A:P01308:0.452
C:P01308:0.11
 HOH
 5.587
 C
 O
VAL D:18 D:18 114.0 0.735 H -73.9 -40.9 0.0 0.0 0.735 C:P01308:0.535
B:P01308:0.368
A:P01308:0.09
 HOH
 2.785
 O
 O
2wrx 2 P01308 96.67 7e-16 X-RAY
 2010-02-09 VAL B:18 B:18 112.0 0.723 H -87.2 -33.3 33.0 0.213 0.51 A:P01308:0.51
 HOH
 3.277
 O
 O
VAL D:18 D:18 105.0 0.677 H -77.9 -37.4 30.0 0.194 0.483 C:P01308:0.484
 HOH
 2.590
 O
 O
2ws0 2 P01308 96.67 7e-16 X-RAY
 2010-02-09 VAL B:18 B:18 111.0 0.716 H -94.6 -21.6 12.0 0.077 0.639 B:P01308:0.148
A:P01308:0.161
A:P01308:0.471
 HOH
 3.571
 O
 O
1hiq 2 P01308 96.67 8e-16 NMR
 1994-01-31 VAL B:18 B:18 117.0 0.755 T -103.3 -78.9 67.0 0.432 0.323 A:P01308:0.323
4ung 2 P01308 96.67 8e-16 X-RAY
 2014-10-15 VAL B:18 B:18 114.0 0.735 H -79.3 -30.2 37.0 0.239 0.496 A:P01308:0.497
 HOH
 2.792
 O
 O
VAL D:18 D:18 115.0 0.742 H -77.4 -25.3 NA NA NA
1zeg 2 P01308 96.67 9e-16 X-RAY
 1998-07-15 VAL B:18 B:18 95.0 0.613 H -73.7 -36.7 28.0 0.181 0.432 A:P01308:0.432
 IPH
IPH
HOH
 9.157
6.584
3.413
 CG1
N
O
 C5
C5
O
VAL D:18 D:18 105.0 0.677 H -60.8 -42.8 NA NA NA
1zeh 2 P01308 96.67 9e-16 X-RAY
 1998-12-09 VAL B:18 B:18 95.0 0.613 H -73.1 -34.2 29.0 0.187 0.426 A:P01308:0.426
 CRS
HOH
 8.709
5.099
 CG1
N
 C7
O
VAL D:18 D:18 105.0 0.677 H -65.0 -43.2 NA NA NA
4gbc 2 P01308 96.67 9e-16 X-RAY
 2013-06-12 VAL B:18 B:18 89.0 0.574 H -72.6 -41.3 5.0 0.032 0.542 D:P01308:0.155
A:P01308:0.413
 CRS
HOH
 7.699
3.622
 CG1
O
 C7
O
VAL D:18 D:18 79.0 0.51 H -65.6 -41.7 9.0 0.058 0.452 C:P01308:0.361
A:P01308:0.11
 CRS
CRS
HOH
 9.665
7.783
5.611
 C
N
C
 O1
C7
O
4gbi 2 P01308 96.67 9e-16 X-RAY
 2013-06-12 VAL B:18 B:18 88.0 0.568 H -70.8 -42.0 3.0 0.019 0.549 D:P01308:0.135
A:P01308:0.439
 CRS
HOH
 7.927
6.412
 CG1
O
 C7
O
VAL D:18 D:18 83.0 0.535 H -61.3 -43.3 13.0 0.084 0.451 C:P01308:0.342
A:P01308:0.129
 CRS
CRS
HOH
 9.446
7.950
8.572
 C
N
CG2
 O1
C7
O
4gbk 2 P01308 96.67 9e-16 X-RAY
 2013-06-12 VAL B:18 B:18 85.0 0.548 H -60.8 -57.6 4.0 0.026 0.522 D:P01308:0.161
A:P01308:0.374
 CRS
 7.496
 CG1
 C7
VAL D:18 D:18 77.0 0.497 H -71.5 -24.2 6.0 0.039 0.458 C:P01308:0.381
A:P01308:0.116
 CRS
CRS
 9.866
7.444
 C
N
 O1
C7
4gbl 2 P01308 96.67 9e-16 X-RAY
 2013-06-12 VAL B:18 B:18 89.0 0.574 H -69.8 -37.4 5.0 0.032 0.542 D:P01308:0.142
A:P01308:0.426
 CRS
 8.752
 CG1
 C7
VAL D:18 D:18 80.0 0.516 H -71.0 -24.9 8.0 0.052 0.464 C:P01308:0.387
A:P01308:0.11
 CRS
CRS
 9.810
7.969
 C
N
 O1
C7
4gbn 2 P01308 96.67 9e-16 X-RAY
 2013-06-12 VAL B:18 B:18 92.0 0.594 H -74.9 -44.8 5.0 0.032 0.562 A:P01308:0.458
D:P01308:0.142
 CRS
HOH
 7.977
3.685
 CG1
O
 C7
O
VAL D:18 D:18 77.0 0.497 H -62.5 -37.5 11.0 0.071 0.426 C:P01308:0.335
A:P01308:0.11
 CRS
CRS
HOH
 9.727
7.579
4.110
 C
N
O
 O1
C7
O
6tyh 2 P01308 96.67 9e-16 X-RAY
 2019-11-13 VAL B:18 B:18 120.0 0.774 H -69.0 -39.6 22.0 0.142 0.632 A:P01308:0.51
J:P01308:0.065
I:P01308:0.123
 IPH
ACN
IPH
HOH
 7.805
3.520
8.836
4.109
 CG2
CG2
N
O
 C5
C2
C5
O
VAL D:18 D:18 109.0 0.703 H -77.6 -30.9 33.0 0.213 0.49 C:P01308:0.484
F:P01308:0.058
 IPH
IPH
HOH
 3.772
8.970
2.576
 CA
N
O
 C3
C3
O
VAL F:18 F:18 117.0 0.755 H -65.5 -41.2 24.0 0.155 0.6 D:P01308:0.058
C:P01308:0.142
E:P01308:0.465
 IPH
IPH
IPH
HOH
 9.082
3.858
7.675
3.456
 N
CG2
CG2
O
 C5
C5
C3
O
VAL H:18 H:18 118.0 0.761 H -65.0 -43.6 18.0 0.116 0.645 K:P01308:0.155
G:P01308:0.516
L:P01308:0.045
 IPH
HOH
 9.132
3.594
 N
O
 C3
O
VAL J:18 J:18 116.0 0.748 H -69.5 -47.0 36.0 0.232 0.516 I:P01308:0.516
 IPH
IPH
HOH
 8.939
7.873
2.746
 N
CG2
O
 C5
C5
O
VAL L:18 L:18 117.0 0.755 H -68.7 -40.5 14.0 0.09 0.665 K:P01308:0.529
H:P01308:0.065
G:P01308:0.174
 IPH
IPH
HOH
 9.047
7.970
3.980
 N
CG2
O
 C3
C3
O
6u46 1 ? 96.67 1e-15 NMR
 2020-08-26 VAL A:18 A:18 37.0 0.239 H -50.2 -54.2 37.0 0.239 0.0
1hit 2 P01308 96.67 1e-15 NMR
 1994-01-31 VAL B:18 B:18 131.0 0.845 H -55.5 -41.1 82.0 0.529 0.316 A:P01308:0.316
6gv0 2 P01308 93.33 1e-15 X-RAY
 2019-07-03 VAL B:18 B:18 113.0 0.729 H -78.0 -37.5 0.0 0.0 0.729 D:P01308:0.361
A:P01308:0.529
C:P01308:0.084
 FMT
HOH
 7.483
2.849
 O
O
 O1
O
VAL D:18 D:18 117.0 0.755 H -77.8 -42.3 0.0 0.0 0.755 C:P01308:0.49
B:P01308:0.4
A:P01308:0.116
 FMT
HOH
 9.083
3.061
 HG22
O
 O1
O
5urt 2 P01308 96.67 1e-15 X-RAY
 2018-02-14 VAL B:18 B:18 72.0 0.465 H -75.3 -39.6 24.0 0.155 0.31 A:P01308:0.31
 NA
HOH
 6.128
2.814
 N
O
 NA
O
5uru 2 P01308 96.67 1e-15 X-RAY
 2018-02-21 VAL B:18 B:18 104.0 0.671 H -59.0 -43.5 9.0 0.058 0.613 C:P01308:0.174
D:P01308:0.071
A:P01308:0.458
 IPH
IPH
 7.947
8.695
 CG2
N
 C3
C5
VAL D:18 D:18 104.0 0.671 H -67.4 -37.8 10.0 0.065 0.606 C:P01308:0.477
B:P01308:0.058
A:P01308:0.148
 IPH
IPH
HOH
 7.979
9.129
7.974
 CG2
N
CG1
 C5
C3
O
VAL F:18 F:18 107.0 0.69 H -65.2 -35.0 NA NA NA
VAL H:18 H:18 119.0 0.768 H -62.5 -44.7 NA NA NA
5usp 2 P01308 96.67 1e-15 X-RAY
 2018-02-21 VAL B:18 B:18 72.0 0.465 H -71.7 -42.5 22.0 0.142 0.323 A:P01308:0.323
 NA
HOH
 6.142
2.828
 N
O
 NA
O
5uss 2 P01308 96.67 1e-15 X-RAY
 2018-02-21 VAL B:18 B:18 105.0 0.677 H -65.6 -43.7 13.0 0.084 0.593 A:P01308:0.445
C:P01308:0.161
 IPH
IPH
 7.732
9.077
 CG2
N
 C5
C5
VAL D:18 D:18 103.0 0.665 H -66.5 -44.6 8.0 0.052 0.613 B:P01308:0.006
C:P01308:0.477
A:P01308:0.142
 IPH
IPH
 7.726
9.056
 CG2
N
 C5
C5
5usv 2 P01308 96.67 1e-15 X-RAY
 2018-02-21 VAL B:18 B:18 72.0 0.465 H -75.3 -42.9 23.0 0.148 0.317 A:P01308:0.316
 NA
HOH
 6.065
2.694
 N
O
 NA
O
5uu3 2 P01308 96.67 1e-15 X-RAY
 2018-02-21 VAL B:18 B:18 125.0 0.806 H -69.5 -42.1 38.0 0.245 0.561 G:P01308:0.045
A:P01308:0.445
H:P01308:0.071
 IPH
IPH
 7.801
8.745
 CG2
N
 C5
C5
VAL D:18 D:18 107.0 0.69 H -71.2 -42.9 39.0 0.252 0.438 C:P01308:0.439
 IPH
IPH
 7.616
8.896
 CG1
N
 H3
C5
VAL F:18 F:18 111.0 0.716 H -69.1 -41.8 21.0 0.135 0.581 L:P01308:0.084
E:P01308:0.445
K:P01308:0.181
 IPH
IPH
 8.276
8.919
 CG2
N
 C5
C3
VAL H:18 H:18 115.0 0.742 H -71.2 -42.8 43.0 0.277 0.465 G:P01308:0.458
B:P01308:0.006
 IPH
IPH
 8.684
7.844
 N
CG2
 C5
C5
VAL J:18 J:18 113.0 0.729 H -69.6 -41.9 37.0 0.239 0.49 I:P01308:0.361
C:P01308:0.052
D:P01308:0.084
 IPH
IPH
 7.790
7.936
 N
CG2
 H3
C5
VAL L:18 L:18 113.0 0.729 H -71.0 -42.6 13.0 0.084 0.645 K:P01308:0.535
E:P01308:0.142
F:P01308:0.006
 IPH
IPH
 9.147
7.986
 N
CG2
 C5
C3
VAL N:18 N:18 109.0 0.703 H -69.4 -41.3 NA NA NA
VAL P:18 P:18 86.0 NA H -71.1 -41.9 NA NA NA
VAL R:18 R:18 114.0 0.735 H -69.4 -42.2 NA NA NA
VAL T:18 T:18 116.0 0.748 H -70.8 -41.5 NA NA NA
VAL V:18 V:18 112.0 0.723 H -69.4 -42.6 NA NA NA
VAL X:18 X:18 117.0 0.755 H -71.8 -42.0 NA NA NA
4unh 2 P01308 96.67 1e-15 X-RAY
 2014-10-15 VAL B:18 B:18 112.0 0.723 H -78.5 -30.7 36.0 0.232 0.491 A:P01308:0.49
 HOH
 4.313
 O
 O
4cxl 2 P01308 96.67 2e-15 X-RAY
 2014-05-28 VAL B:18 B:18 96.0 0.619 H -68.0 -41.9 28.0 0.181 0.438 A:P01308:0.439
 CL
HOH
 6.193
2.834
 N
O
 CL
O
5bpo 2 P01308 93.33 2e-15 X-RAY
 2016-02-03 VAL B:18 B:18 109.0 0.703 H -68.9 -31.6 4.0 0.026 0.677 D:P01308:0.277
C:P01308:0.103
A:P01308:0.49
 HOH
 2.879
 O
 O
VAL D:18 D:18 115.0 0.742 H -75.1 -22.6 9.0 0.058 0.684 B:P01308:0.29
C:P01308:0.465
A:P01308:0.11
 HOH
 2.880
 O
 O
2ins 2 P01317 100.0 2e-15 X-RAY
 1982-08-05 VAL B:17 B:18 121.0 0.781 H -60.9 -34.1 11.0 0.071 0.71 D:P01317:0.142
A:P01317:0.548
C:P01317:0.116
 HOH
 7.405
 CG1
 O
VAL D:17 D:18 123.0 0.794 H -61.0 -62.8 7.0 0.045 0.749 C:P01317:0.574
B:P01317:0.135
A:P01317:0.097
 HOH
 6.536
 O
 O
4nib 2 P01308 93.33 2e-15 X-RAY
 2014-08-27 VAL B:18 B:18 72.0 0.465 H -73.9 -42.2 22.0 0.142 0.323 A:P01308:0.323
 HOH
 2.666
 HG13
 O
6s4i 2 P01308 96.55 3e-15 X-RAY
 2020-07-15 VAL B:18 B:18 109.0 0.703 H -69.7 -39.8 46.0 0.297 0.406 A:P01308:0.406
 NO3
HOH
 3.226
3.073
 O
O
 O2
O
3u4n 2 P01308 96.55 4e-15 X-RAY
 2012-04-11 VAL B:18 B:18 76.0 0.49 H -75.4 -43.3 25.0 0.161 0.329 A:P01308:0.329
 HOH
 2.810
 O
 O
5ems 2 P01308 96.67 5e-15 X-RAY
 2016-11-16 VAL B:18 B:18 101.0 0.652 H -67.4 -40.7 13.0 0.084 0.568 A:P01308:0.426
H:P01308:0.052
G:P01308:0.187
 IPH
IPH
HOH
 8.033
8.691
4.084
 CG2
N
O
 C5
C3
O
VAL D:18 D:18 105.0 0.677 H -65.4 -37.5 9.0 0.058 0.619 C:P01308:0.432
J:P01308:0.065
I:P01308:0.194
 IPH
IPH
HOH
 7.766
8.839
5.550
 CG2
N
C
 C5
C5
O
VAL F:18 F:18 119.0 0.768 H -65.3 -38.5 25.0 0.161 0.607 K:P01308:0.135
L:P01308:0.09
E:P01308:0.484
 IPH
IPH
HOH
 7.805
8.998
3.465
 CG2
N
O
 C3
C5
O
VAL H:18 H:18 112.0 0.723 H -67.1 -42.2 13.0 0.084 0.639 B:P01308:0.052
A:P01308:0.148
G:P01308:0.529
 IPH
IPH
HOH
 9.195
7.821
6.434
 N
CG2
N
 C5
C3
O
VAL J:18 J:18 96.0 0.619 H -68.5 -38.3 5.0 0.032 0.587 C:P01308:0.155
D:P01308:0.058
I:P01308:0.432
 IPH
IPH
HOH
 8.827
8.017
2.788
 N
CG2
O
 C5
C5
O
VAL L:18 L:18 117.0 0.755 H -67.4 -37.7 12.0 0.077 0.678 F:P01308:0.026
K:P01308:0.568
E:P01308:0.135
 IPH
IPH
HOH
 8.918
8.333
5.684
 N
CG2
C
 C3
C5
O
5azz 2 P01317 96.55 5e-15 X-RAY
 2017-05-03 VAL B:18 B:18 73.0 0.471 H -73.8 -42.6 25.0 0.161 0.31 A:P01317:0.31
 HOH
 2.833
 O
 O
5bqq 2 P01308 96.43 5e-15 X-RAY
 2016-02-03 VAL B:18 B:18 94.0 0.606 H -67.1 -39.7 12.0 0.077 0.529 A:P01308:0.452
H:P01308:0.052
G:P01308:0.123
 IPH
IPH
HOH
 7.602
8.577
3.082
 CG2
N
O
 C5
C5
O
VAL D:18 D:18 95.0 0.613 H -67.6 -40.4 11.0 0.071 0.542 C:P01308:0.465
J:P01308:0.058
I:P01308:0.129
 IPH
IPH
HOH
 7.640
8.611
3.127
 CG2
N
O
 C5
C5
O
VAL F:18 F:18 120.0 0.774 H -66.7 -41.8 11.0 0.071 0.703 K:P01308:0.174
L:P01308:0.065
E:P01308:0.555
 IPH
IPH
IPH
IPH
IPH
IPH
HOH
 7.916
6.671
5.665
8.972
8.931
8.834
3.788
 CG2
N
N
CG2
CG2
N
CG1
 C5
C5
O1
C5
O1
C5
O
VAL H:18 H:18 118.0 0.761 H -68.4 -44.1 20.0 0.129 0.632 B:P01308:0.052
A:P01308:0.168
G:P01308:0.523
 IPH
IPH
HOH
 8.652
7.854
2.919
 N
CG2
O
 C5
C5
O
VAL J:18 J:18 116.0 0.748 H -68.1 -44.8 21.0 0.135 0.613 C:P01308:0.168
D:P01308:0.052
I:P01308:0.503
 IPH
IPH
HOH
 8.656
7.910
3.105
 N
CG2
O
 C5
C5
O
VAL L:18 L:18 120.0 0.774 H -65.6 -40.7 10.0 0.065 0.709 F:P01308:0.065
K:P01308:0.548
E:P01308:0.174
 IPH
IPH
IPH
IPH
IPH
IPH
HOH
 8.857
8.964
8.866
6.668
5.729
7.817
4.048
 N
CG2
CG2
N
N
CG2
O
 C5
C5
O1
C5
O1
C5
O
1lph 2 P01308 93.33 6e-15 X-RAY
 1996-06-20 VAL B:18 B:18 81.0 0.523 H -58.5 -31.5 21.0 0.135 0.388 A:P01308:0.387
 HOH
 3.753
 O
 O
VAL D:18 D:18 97.0 0.626 H -59.0 -62.5 NA NA NA
2m1d 2 P01308 93.33 6e-15 NMR
 2013-02-27 VAL B:18 B:18 77.0 0.497 H -75.5 -41.0 15.0 0.097 0.4 A:P01308:0.4
2m1e 2 P01308 93.33 6e-15 NMR
 2013-02-27 VAL B:18 B:18 84.0 0.542 H -78.4 -46.8 25.0 0.161 0.381 A:P01308:0.381
5udp 2 P01308 93.33 6e-15 X-RAY
 2017-01-11 VAL B:18 B:18 99.0 0.639 H -67.2 -40.4 NA NA NA
VAL D:18 D:18 101.0 0.652 H -66.8 -39.8 72.0 0.465 0.187 A:P01308:0.187
 IPH
HOH
 8.766
4.273
 N
O
 C3
O
VAL F:18 F:18 107.0 0.69 H -76.8 -31.8 82.0 0.529 0.161 G:P01308:0.161
 IPH
HOH
 8.947
2.755
 N
O
 C5
O
VAL H:18 H:18 103.0 0.665 H -64.3 -41.0 NA NA NA
VAL J:18 J:18 94.0 0.606 H -68.9 -42.9 NA NA NA
VAL L:18 L:18 117.0 0.755 H -72.5 -40.8 93.0 0.6 0.155 I:P01308:0.155
 IPH
HOH
 8.915
4.807
 N
N
 C5
O
6nwv 2 P01308 93.33 6e-15 X-RAY
 2020-02-12 VAL B:18 B:18 105.0 0.677 H -63.1 -41.7 19.0 0.123 0.554 A:P01308:0.445
F:P01308:0.077
E:P01308:0.11
 CRS
CRS
GOL
HOH
 6.966
8.396
7.719
3.752
 CG2
N
CG2
CG1
 O1
O1
C1
O
VAL D:18 D:18 98.0 0.632 H -71.1 -36.7 3.0 0.019 0.613 C:P01308:0.477
I:P01308:0.155
 CRS
CRS
HOH
 7.488
7.682
4.891
 CG2
N
N
 O1
O1
O
VAL F:18 F:18 112.0 0.723 H -77.0 -28.3 23.0 0.148 0.575 A:P01308:0.148
E:P01308:0.445
 CRS
CRS
GOL
HOH
 7.976
8.778
4.798
5.631
 N
CG1
N
C
 O1
O1
C3
O
VAL H:18 H:18 92.0 0.594 H -83.4 -35.2 8.0 0.052 0.542 K:P01308:0.142
G:P01308:0.439
 CRS
CRS
CRS
HOH
 7.888
4.383
7.736
4.861
 CG1
CG2
N
N
 O1
C7
O1
O
VAL J:18 J:18 113.0 0.729 H -69.1 -39.9 24.0 0.155 0.574 C:P01308:0.135
D:P01308:0.077
I:P01308:0.452
 CRS
CRS
HOH
 8.196
6.886
4.692
 N
CG2
O
 O1
O1
O
VAL L:18 L:18 104.0 0.671 H -70.7 -39.9 20.0 0.129 0.542 K:P01308:0.471
H:P01308:0.071
G:P01308:0.11
 CRS
CRS
CRS
HOH
 7.656
4.249
7.111
4.189
 N
CG1
CG2
O
 O1
C6
O1
O
1zei 1 P01315 87.5 6e-15 X-RAY
 1999-02-16 VAL A:18 A:18 32.0 0.206 H -66.9 -54.2 11.0 0.071 0.135 D:P01315:0.135
 CRS
CRS
HOH
 8.430
7.157
3.080
 N
CG2
O
 C5
C7
O
VAL B:18 B:18 36.0 0.232 H -77.5 -38.3 19.0 0.123 0.109 E:P01315:0.11
 CRS
CRS
HOH
 7.409
7.871
3.155
 CG2
N
O
 C5
C7
O
VAL C:18 C:18 30.0 0.194 H -69.3 -33.4 17.0 0.11 0.084 F:P01315:0.084
 CRS
CRS
HOH
 7.301
8.124
4.110
 CG2
N
O
 C7
C7
O
VAL D:18 D:18 29.0 0.187 H -62.5 -47.9 9.0 0.058 0.129 A:P01315:0.129
 CRS
CRS
HOH
 7.592
7.723
3.576
 CG2
N
O
 C5
C7
O
VAL E:18 E:18 24.0 0.155 H -65.8 -46.5 10.0 0.065 0.09 B:P01315:0.09
 CRS
CRS
CRS
HOH
 7.782
7.175
7.516
3.187
 N
CG2
C
O
 C5
C7
O1
O
VAL F:18 F:18 32.0 0.206 H -79.1 -51.6 18.0 0.116 0.09 C:P01315:0.09
 CRS
CRS
CRS
HOH
 8.081
7.209
5.736
3.258
 N
CG2
C
O
 C7
C7
O1
O
1htv 2 P01308 100.0 1e-14 X-RAY
 2001-05-23 VAL B:18 B:218 116.0 0.748 H -63.2 -42.7 4.0 0.026 0.722 H:P01308:0.413
A:P01308:0.413
 HOH
 6.762
 N
 O
VAL D:18 D:418 91.0 0.587 H -70.3 -48.1 11.0 0.071 0.516 I:P01308:0.006
C:P01308:0.413
J:P01308:0.097
 HOH
 6.283
 N
 O
VAL F:18 F:618 105.0 0.677 H -77.4 -39.2 4.0 0.026 0.651 E:P01308:0.413
L:P01308:0.303
K:P01308:0.116
 HOH
 4.581
 O
 O
VAL H:18 H:818 91.0 0.587 H -82.1 -44.1 0.0 0.0 0.587 B:P01308:0.239
G:P01308:0.394
 HOH
 3.161
 O
 O
VAL J:18 J:1018 111.0 0.716 H -69.0 -33.0 1.0 0.006 0.71 I:P01308:0.413
D:P01308:0.426
 HOH
 5.682
 N
 O
VAL L:18 L:1218 95.0 0.613 H -76.9 -46.3 13.0 0.084 0.529 F:P01308:0.026
E:P01308:0.103
K:P01308:0.413
 HOH
 3.580
 O
 O
5wbt 1 P01308 93.33 2e-14 NMR
 2017-11-15 VAL A:18 A:18 33.0 0.213 H -65.4 -36.7 33.0 0.213 0.0
7kd6 1 ? 93.33 2e-14 X-RAY
 2021-10-13 VAL A:18 B:18 23.0 0.148 H -57.7 -45.4 23.0 0.148 0.0 HOH
 9.413
 C
 O
VAL F:18 H:18 23.0 0.148 H -62.2 -40.8 NA NA NA
VAL K:18 N:18 23.0 0.148 H -59.8 -41.8 NA NA NA
VAL P:18 T:18 21.0 0.135 H -59.5 -43.0 NA NA NA
1mhj 2 P01308 96.67 2e-14 NMR
 1995-10-15 VAL B:18 B:18 128.0 0.826 I -71.6 -34.4 89.0 0.574 0.252 A:P01308:0.252
4efx 2 P01308 96.43 2e-14 X-RAY
 2013-03-06 VAL B:18 B:18 122.0 0.787 H -60.3 -45.2 NA NA NA
VAL D:18 D:18 97.0 0.626 H -81.9 -45.2 NA NA NA
7jp3 1 P01308 100.0 2e-14 X-RAY
 2021-10-27 VAL A:18 A:18 25.0 0.161 H -72.2 -44.6 12.0 0.077 0.084 D:P01308:0.084
 IPH
IPH
HOH
 7.551
9.428
5.354
 CG2
N
N
 O1
C5
O
VAL B:18 B:18 25.0 0.161 H -76.2 -44.4 9.0 0.058 0.103 E:P01308:0.103
 IPH
IPH
HOH
 8.490
7.707
5.550
 CG2
N
O
 C5
O1
O
VAL C:18 C:18 31.0 0.2 H -72.4 -44.4 12.0 0.077 0.123 F:P01308:0.123
 IPH
IPH
HOH
 8.084
8.858
5.405
 CG2
N
C
 C5
C5
O
VAL D:18 D:18 19.0 0.123 H -74.5 -44.9 8.0 0.052 0.071 A:P01308:0.071
 IPH
IPH
HOH
 8.603
8.569
7.363
 N
CG2
O
 O1
C5
O
VAL E:18 E:18 41.0 0.265 H -71.2 -43.1 25.0 0.161 0.104 B:P01308:0.103
 IPH
IPH
HOH
 9.120
7.043
5.746
 N
CG2
C
 C5
O1
O
VAL F:18 F:18 50.0 0.323 H -74.8 -46.6 35.0 0.226 0.097 C:P01308:0.097
 IPH
IPH
HOH
 8.615
8.129
4.719
 N
CG2
CG1
 C5
C5
O
6ck2 2 P01308 93.33 4e-14 X-RAY
 2018-06-13 VAL B:18 B:18 77.0 0.497 H -70.7 -36.2 7.0 0.045 0.452 C:P01308:0.148
A:P01308:0.355
 IPH
HOH
 6.894
3.955
 N
O
 H3
O
VAL D:18 D:18 108.0 0.697 H -65.6 -45.3 1.0 0.006 0.691 B:P01308:0.297
C:P01308:0.484
 IPH
HOH
 6.415
3.554
 CG2
O
 H3
O
2mpg 2 P01308 90.0 4e-14 NMR
 2014-06-11 VAL B:18 B:18 122.0 0.787 H -78.3 -32.0 46.0 0.297 0.49 A:P01308:0.49
2n2v 2 P01308 93.33 6e-14 NMR
 2016-02-03 VAL B:18 B:18 100.0 0.645 H -82.5 -30.3 30.0 0.194 0.451 A:P01308:0.452
2n2w 2 P01308 93.33 6e-14 NMR
 2016-02-03 VAL B:18 B:18 98.0 0.632 H -99.8 -47.2 43.0 0.277 0.355 A:P01308:0.355
3zs2 2 P01308 86.67 7e-14 X-RAY
 2011-08-31 VAL B:18 B:18 116.0 0.748 H -60.0 -31.1 10.0 0.065 0.683 A:P01308:0.51
H:P01308:0.071
G:P01308:0.239
 IPH
IPH
HOH
 8.892
7.299
3.327
 CG2
N
O
 C3
C3
O
VAL D:18 D:18 107.0 0.69 H -86.7 -35.3 12.0 0.077 0.613 C:P01308:0.465
J:P01308:0.142
I:P01308:0.142
 IPH
IPH
HOH
 6.876
9.132
4.381
 CG2
N
O
 C3
C3
O
VAL F:18 F:18 103.0 0.665 H -87.0 -35.7 15.0 0.097 0.568 K:P01308:0.123
L:P01308:0.084
E:P01308:0.445
 IPH
IPH
HOH
 6.289
9.188
3.810
 CG2
N
O
 C3
C3
O
VAL H:18 H:18 125.0 0.806 H -58.4 -27.7 8.0 0.052 0.754 B:P01308:0.135
A:P01308:0.258
G:P01308:0.542
 IPH
IPH
HOH
 8.270
7.911
4.413
 N
CG2
N
 C3
C3
O
VAL J:18 J:18 110.0 0.71 H -80.8 -37.5 11.0 0.071 0.639 C:P01308:0.181
I:P01308:0.523
 IPH
HOH
 8.498
3.080
 CG2
O
 C3
O
VAL L:18 L:18 96.0 0.619 H -76.8 -35.7 21.0 0.135 0.484 K:P01308:0.387
E:P01308:0.116
 IPH
HOH
 9.534
4.298
 N
N
 C3
O
4p65 2 P01308 93.33 8e-14 X-RAY
 2014-10-22 VAL B:18 B:18 93.0 0.6 H -75.7 -45.3 5.0 0.032 0.568 A:P01308:0.445
H:P01308:0.039
G:P01308:0.155
 IPH
IPH
HOH
 6.542
8.052
3.502
 HG21
N
HA
 H3
H3
O
VAL D:18 D:18 108.0 0.697 H -67.1 -41.2 14.0 0.09 0.607 C:P01308:0.452
J:P01308:0.058
I:P01308:0.181
 IPH
IPH
HOH
 6.555
7.717
4.913
 HG21
N
N
 H5
H3
O
VAL F:18 F:18 95.0 0.613 H -66.2 -45.0 11.0 0.071 0.542 K:P01308:0.155
L:P01308:0.071
E:P01308:0.419
 IPH
IPH
HOH
 6.798
7.839
5.006
 HG21
N
C
 H3
H3
O
VAL H:18 H:18 110.0 0.71 H -70.0 -49.3 11.0 0.071 0.639 B:P01308:0.09
A:P01308:0.148
G:P01308:0.503
 IPH
IPH
HOH
 7.914
5.838
5.056
 N
HG22
N
 H3
H3
O
VAL J:18 J:18 96.0 0.619 H -69.1 -38.7 8.0 0.052 0.567 C:P01308:0.181
D:P01308:0.058
I:P01308:0.419
 IPH
IPH
HOH
 7.703
6.744
2.656
 N
HG21
HG13
 H5
H3
O
VAL L:18 L:18 111.0 0.716 H -70.3 -37.3 14.0 0.09 0.626 F:P01308:0.065
K:P01308:0.503
E:P01308:0.148
 IPH
IPH
HOH
 7.776
6.675
5.038
 N
HG21
N
 H3
H3
O
5boq 2 P01308 93.33 9e-14 X-RAY
 2016-02-03 VAL B:18 B:18 115.0 0.742 H -81.0 -35.1 11.0 0.071 0.671 A:P01308:0.516
E:P01308:0.181
F:P01308:0.148
 HOH
 2.682
 O
 O
VAL D:18 D:18 113.0 0.729 H -79.9 -18.7 NA NA NA
VAL F:18 F:18 106.0 0.684 H -71.5 -41.1 2.0 0.013 0.671 B:P01308:0.142
A:P01308:0.187
E:P01308:0.516
 HOH
 2.753
 O
 O
VAL H:18 H:18 116.0 0.748 H -68.2 -44.8 NA NA NA
2l1z 2 P01308 90.0 1e-13 NMR
 2011-08-31 VAL B:18 B:18 105.0 0.677 H -54.8 -47.7 51.0 0.329 0.348 A:P01308:0.348
2mli 2 P01308 90.0 1e-13 NMR
 2014-08-20 VAL B:18 B:39 72.0 0.465 H -74.2 -61.1 13.0 0.084 0.381 A:P01308:0.381
4iuz 2 P01308 90.0 1e-13 X-RAY
 2013-02-13 VAL B:18 B:18 128.0 0.826 H -74.9 -43.0 51.0 0.329 0.497 A:P01308:0.497
 PEG
HOH
 3.465
4.394
 O
O
 C4
O
2lwz 1 P01308 90.0 3e-13 NMR
 2013-08-28 VAL A:18 A:18 19.0 0.123 H -50.7 -58.8 19.0 0.123 0.0
2l1y 2 P01308 86.67 3e-13 NMR
 2011-08-31 VAL B:18 B:18 113.0 0.729 H -45.0 -47.3 38.0 0.245 0.484 A:P01308:0.484
3rov 2 P01308 86.67 3e-13 X-RAY
 2012-05-02 VAL B:18 B:18 108.0 0.697 H -97.0 -27.3 15.0 0.097 0.6 A:P01308:0.503
H:P01308:0.019
G:P01308:0.2
 IPH
IPH
HOH
 8.028
8.312
3.047
 CG1
N
O
 C5
C5
O
VAL D:18 D:18 100.0 0.645 H -88.3 -33.3 11.0 0.071 0.574 C:P01308:0.387
J:P01308:0.11
I:P01308:0.2
 IPH
IPH
HOH
 8.061
8.728
2.997
 CG1
N
O
 C5
C5
O
VAL F:18 F:18 112.0 0.723 H -65.9 -55.1 18.0 0.116 0.607 K:P01308:0.142
L:P01308:0.123
E:P01308:0.445
 IPH
IPH
HOH
 7.918
8.014
2.427
 CG2
N
O
 C5
C5
O
VAL H:18 H:18 101.0 0.652 H -67.1 -56.4 15.0 0.097 0.555 B:P01308:0.071
A:P01308:0.142
G:P01308:0.445
 IPH
IPH
HOH
 8.879
7.269
4.235
 N
CG2
O
 C5
C5
O
VAL J:18 J:18 107.0 0.69 H -68.2 -39.1 3.0 0.019 0.671 C:P01308:0.2
D:P01308:0.232
I:P01308:0.394
 IPH
IPH
HOH
 7.559
7.935
3.343
 N
CG2
O
 C5
C5
O
VAL L:18 L:18 97.0 0.626 H -91.1 -46.9 8.0 0.052 0.574 K:P01308:0.49
E:P01308:0.194
 IPH
IPH
HOH
 9.249
8.752
2.742
 N
CG2
O
 C5
C5
O
6x4x 2 P01308 86.67 4e-13 NMR
 2020-08-05 VAL B:18 B:39 95.0 0.613 H -53.5 -56.7 33.0 0.213 0.4 A:P01308:0.4
2wrv 2 P01308 96.15 5e-13 X-RAY
 2010-02-09 VAL B:18 B:18 95.0 0.613 H -81.4 -25.7 31.0 0.2 0.413 A:P01308:0.413
 HOH
 3.371
 O
 O
1t1q 2 P01308 86.67 6e-13 NMR
 2004-08-10 VAL B:18 B:18 104.0 0.671 H -82.7 -49.5 43.0 0.277 0.394 A:P01308:0.394
2n2x 2 P01308 90.0 7e-13 NMR
 2016-02-03 VAL B:18 B:18 78.0 0.503 H -77.3 -38.5 16.0 0.103 0.4 A:P01308:0.4
6s4j 2 P01308 93.1 8e-13 X-RAY
 2020-07-15 VAL B:18 B:18 100.0 0.645 H -65.2 -42.2 30.0 0.194 0.451 A:P01308:0.452
 IMD
HOH
 3.319
4.025
 HG23
O
 H4
O
1pid 2 P01317 100.0 9e-13 X-RAY
 1996-12-07 VAL B:18 B:18 99.0 0.639 H -74.3 -37.7 45.0 0.29 0.349 A:P01317:0.348
 HOH
 5.104
 N
 O
VAL D:18 D:18 106.0 0.684 H -65.7 -43.2 NA NA NA
2ceu 2 P01308 100.0 9e-13 X-RAY
 2006-03-03 VAL B:18 B:18 119.0 0.768 H -70.7 -42.7 10.0 0.065 0.703 D:P01308:0.129
C:P01308:0.168
A:P01308:0.542
 HOH
 4.913
 N
 O
VAL D:18 D:18 118.0 0.761 H -71.8 -40.9 11.0 0.071 0.69 B:P01308:0.123
A:P01308:0.161
C:P01308:0.529
 HOH
 4.902
 N
 O
1bzv 2 P30410 100.0 9e-13 NMR
 1999-05-18 VAL B:18 B:18 130.0 0.839 H -58.6 -45.5 42.0 0.271 0.568 A:P01312:0.568
2wru 2 P01308 100.0 9e-13 X-RAY
 2010-02-09 VAL B:18 B:18 100.0 0.645 H -89.2 -23.3 5.0 0.032 0.613 B:P01308:0.148
A:P01308:0.465
A:P01308:0.181
 HOH
 6.514
 O
 O
2kqq 2 P01308 86.67 1e-12 NMR
 2010-11-24 VAL B:18 B:18 97.0 0.626 H -66.0 -43.8 15.0 0.097 0.529 A:P01308:0.529
2mpi 2 P01308 86.67 4e-12 NMR
 2014-12-24 VAL B:18 B:39 86.0 0.555 H -66.3 -37.7 7.0 0.045 0.51 A:P01308:0.51
2wrw 2 P01308 100.0 1e-11 X-RAY
 2010-02-09 VAL B:18 B:18 101.0 0.652 H -84.3 -20.4 6.0 0.039 0.613 B:P01308:0.155
A:P01308:0.194
A:P01308:0.452
 HOH
 3.632
 O
 O
2ws4 2 P01308 100.0 1e-11 X-RAY
 2010-02-09 VAL B:18 B:18 112.0 0.723 H -70.9 -33.2 10.0 0.065 0.658 B:P01308:0.161
A:P01308:0.187
A:P01308:0.49
 HOH
 2.477
 O
 O
2ws7 2 P01308 100.0 1e-11 X-RAY
 2010-02-09 VAL B:18 B:18 124.0 0.8 H -83.0 -16.0 16.0 0.103 0.697 A:P01308:0.542
H:P01308:0.077
G:P01308:0.194
 IPH
IPH
HOH
 8.405
8.733
5.997
 CG2
N
O
 C5
C5
O
VAL D:18 D:18 123.0 0.794 H -70.0 -55.0 21.0 0.135 0.659 C:P01308:0.555
J:P01308:0.065
I:P01308:0.168
 IPH
IPH
HOH
 8.081
8.832
3.623
 CG2
N
O
 C5
C5
O
VAL F:18 F:18 120.0 0.774 H -69.7 -44.7 23.0 0.148 0.626 K:P01308:0.103
L:P01308:0.026
E:P01308:0.548
 IPH
IPH
HOH
 8.516
9.187
4.429
 CG2
N
O
 C5
C5
O
VAL H:18 H:18 110.0 0.71 H -71.7 -29.0 13.0 0.084 0.626 B:P01308:0.026
A:P01308:0.213
G:P01308:0.465
 IPH
IPH
HOH
 8.858
8.658
5.520
 N
CG2
O
 C5
C5
O
VAL J:18 J:18 119.0 0.768 H -96.3 -39.0 22.0 0.142 0.626 C:P01308:0.116
I:P01308:0.574
 IPH
IPH
HOH
 8.243
8.175
7.562
 N
CG2
CG2
 C5
C5
O
VAL L:18 L:18 116.0 0.748 H -75.8 -35.3 21.0 0.135 0.613 F:P01308:0.039
K:P01308:0.535
E:P01308:0.097
 IPH
IPH
HOH
 8.724
7.834
7.744
 N
CG2
CG2
 C5
C5
O
3w12 5 P01308 100.0 1e-11 X-RAY
 2013-01-09 VAL E:18 B:18 116.0 0.748 H -62.2 -37.0 52.0 0.335 0.413 D:P01308:0.413
3w13 5 P01308 100.0 1e-11 X-RAY
 2013-01-09 VAL E:18 B:18 116.0 0.748 H -59.7 -39.8 51.0 0.329 0.419 D:P01308:0.419
1hui 2 P01308 89.29 1e-11 NMR
 1997-03-12 VAL B:18 B:18 123.0 0.794 H -53.0 -57.5 48.0 0.31 0.484 A:P01308:0.484
1iog 2 P01308 89.29 1e-11 NMR
 1999-01-13 VAL B:18 B:18 97.0 0.626 H -51.8 -73.6 8.0 0.052 0.574 A:P01308:0.574
1ioh 2 P01308 89.29 1e-11 NMR
 1999-01-13 VAL B:18 B:18 121.0 0.781 H -94.8 -23.4 38.0 0.245 0.536 A:P01308:0.535
1sdb 2 P01315 100.0 3e-11 X-RAY
 1997-02-12 VAL B:16 B:18 107.0 0.69 H -70.5 -45.7 42.0 0.271 0.419 A:P01315:0.419
 HOH
 4.030
 CG1
 O
1dei 2 P01315 100.0 7e-11 X-RAY
 1997-06-16 VAL B:18 B:18 118.0 0.761 H -72.8 -40.6 40.0 0.258 0.503 A:P01315:0.503
 HOH
 2.821
 O
 O
VAL D:18 D:18 115.0 0.742 H -69.9 -43.4 NA NA NA
6ves 2 P01308 95.45 8e-09 X-RAY
 2020-11-11 VAL B:18 B:18 110.0 0.71 H -75.1 -35.4 33.0 0.213 0.497 A:P01308:0.497
 HOH
 4.019
 O
 O
2wby 3 P01308 100.0 2e-07 X-RAY
 2009-03-24 VAL D:18 D:18 152.0 0.981 -83.3 360.0 55.0 0.355 0.626 C:P01308:0.626
 HOH
 5.965
 CG2
 O
VAL F:18 F:18 121.0 0.781 H -69.2 -32.3 NA NA NA
6ver 2 P01308 90.91 2e-07 X-RAY
 2020-11-11 VAL B:18 B:18 115.0 0.742 H -69.6 -35.2 29.0 0.187 0.555 A:P01308:0.555
 HOH
 2.820
 O
 O
6vet 2 P01308 90.91 2e-07 X-RAY
 2020-06-03 VAL B:18 B:18 123.0 0.794 H -67.1 -39.0 34.0 0.219 0.575 A:P01308:0.574
 HOH
 4.318
 HG21
 O
VAL D:18 D:18 122.0 0.787 H -62.3 -38.8 NA NA NA
VAL F:18 F:18 112.0 0.723 H -75.7 -32.2 NA NA NA

AlphaFold DB

Entity Residue Monomer View
ID Entity Uniprot Identity Evalue Name Label Auth ASA rASA SS φ ψ
af-f8wcm5-f1 1 F8WCM5 100.0 1e-144 VAL A:42 A:42 108.0 0.697 H -78.4 -41.5
af-p01308-f1 1 P01308 88.73 5e-33 VAL A:42 A:42 127.0 0.819 H -92.1 -15.4