Screening Results : Docking based on all models from entry : AURKB_HUMAN
Display Selection :
Study :
All_Studies
RUN0
RUN1
RUN2
Show results:
All Complexes
Atome Selection
Best pKd per Ligand
Best Position per Ligand (LPE)
Selection of Expert
Values:
Resume
Details
Color code: [
Good
|
Correct
|
Uncertain
|
Dubius
] - pKd: [
‹nMol
|
‹μMol
|
‹mMol
| ›mMol]
pKd
LE
LPE < 1.5
LPE < 2.5
All LPE
LPE Spec
ALL_Candidates
103904189
103904190
103904191
103904192
103904193
103904195
103904196
103904198
103904199
103904200
103904202
103904203
103904204
103904206
103904209
103904210
103904211
103904212
103904214
103904215
103904216
103904269
103904270
103904271
103904272
103904273
103904274
103904275
103904278
103904279
103904282
103904285
103904287
103904288
103904289
103904294
103904295
103904297
103904300
103904302
103904303
103904304
103904319
103904321
103904324
103904325
103904327
103904328
103904329
103904330
103904332
103904333
103904334
103904335
103904337
103904339
103904340
103904342
103904346
103904347
103904348
103904349
103904350
103904351
103904356
103904357
103904358
103904359
103904360
103904361
103904362
103904363
103904364
103904365
103904366
103904367
103904368
103904369
103904370
103904371
103904377
103904379
103904381
103904386
103904387
103904388
103904389
103904393
103904398
103904399
103904400
103904401
103904403
103904404
103904405
103904406
103904408
103904411
103904414
103904417
103904418
103904419
103904420
103904422
103904427
103904430
103904431
103904434
103904441
103904442
103904443
103904444
103904448
103904449
103904450
103904455
103904456
103904457
103904458
103904459
103904462
103904463
103904464
103904465
103904466
103904468
103904469
103904470
103904471
103904472
103904474
103904475
103904477
103904479
103904480
103904482
103904483
103904484
103904485
103904487
103904489
103904502
103904504
103904505
103904506
103904508
103904511
103904512
103904513
103904514
103904515
103904516
103904517
103904518
103904519
103904525
103904526
103904527
103904529
103904543
103904545
103904551
103904556
103904560
103904562
103904564
103904567
103904574
103904590
103904592
103904593
103904594
103904595
103904596
103904598
103904601
103904602
103904603
103904610
103904618
103904622
103904623
103904624
103904633
103904634
103904636
103904639
103904640
103904642
103904644
103904645
103904646
103904647
103904648
103904649
103904650
103904651
103904652
103904653
103904654
103904657
103904658
103904659
103904662
103904671
103904677
103904678
103904684
103904685
103904686
103904687
103904688
103904689
103904690
103904691
103904692
103904693
103904694
103904695
103904696
103904697
103904698
103904699
103904700
103904701
103904702
103904704
103904706
103904708
103904711
103904712
103904713
103904714
103904725
103904726
103904729
103904735
103904736
103904738
103904740
103904741
103904742
103904743
103904744
103904746
103904748
103904750
103904751
103904752
103904753
103904754
103904768
103904783
103904784
103904785
103904786
103904788
103904789
103904790
103904791
103904792
103904796
103904798
103904801
103904803
103904809
103904810
103904811
103904812
103904813
103904814
103904815
103904816
103904817
103904818
103904819
103904820
103904822
103904823
103904836
103904855
103904856
103904857
103904859
103904860
103904861
103904862
103904863
103904864
103904865
103904867
103904872
103904873
103904882
103904883
103904884
103904886
103904887
103904889
103904890
103904891
103904898
103904903
103904904
103904905
103904906
103904908
103904916
103904919
103904921
103904922
103904925
103904926
103904935
103904937
103904938
103904940
103904947
103904950
103904951
103904952
103904953
103904955
103904956
103904957
103904961
103904962
103904963
103904964
103904965
103904976
103904984
103904985
103904987
103904988
103904990
103904991
103904992
103904993
103904995
103904996
103904997
103904998
103904999
103905000
103905001
103905004
103905006
103905007
103905008
103905009
103905010
103905011
103905012
103905013
103905014
103905015
103905016
103905017
103905018
103905019
103905020
103905021
103905022
103905026
103905028
103905031
103905032
103905033
103905034
103905036
103905039
103905040
103905041
103905042
103905043
103905044
103905047
103905049
103905050
103905052
103905061
103905066
103905075
103905076
103905077
103905078
103905079
103905082
103905084
103905085
103905087
103905088
103905089
103905091
103905092
103905093
103905094
103905095
103905096
103905097
103905105
103905108
103905109
103905110
103905111
103905112
103905113
103905114
103905115
103905116
103905117
103905119
103905122
103905123
103905136
103905137
103905144
103905145
103905146
103905151
103905166
103905168
103905170
103905172
103905173
103905174
103905175
103905177
103905178
103905179
103905183
103905190
103905192
103905203
103905204
103905205
103905206
103905208
103905209
103905212
103905213
103905214
103905215
103905216
103905218
103905219
103905221
103905226
103905229
103905231
103905233
103905234
103905237
103905238
103905245
103905246
103905247
103905248
103905250
103905251
103905252
103905259
103905260
103905263
103905264
103905265
103905267
103905269
103905270
103905271
103905272
103905273
103905276
103905280
103905281
103905282
103905284
103905286
103905287
103905291
103905295
103905296
103905297
103905298
103905300
103905301
103905302
103905303
103905308
103905310
103905313
103905315
103905316
103905317
103905318
103905319
103905320
103905323
103905324
103905327
103905330
103905338
103905339
103905340
103905341
103905346
103905353
103905354
103905366
103905368
103905371
103905375
103905380
103905389
103905392
103905393
103905395
103905396
103905397
103905398
103905401
103905405
103905406
103905407
103905408
103905409
103905412
103905413
103905414
103905420
103905425
103905428
103905430
103905437
103905443
103905446
103905447
103905449
103905453
103905460
103905462
103905463
103905464
103905472
103905481
103905485
103905487
103905488
103905489
103905490
103905496
103905499
103905501
103905503
103905504
103905506
103905508
103905509
103905515
103905519
103905520
103905521
103905522
103905525
103905528
103905531
103905532
103905535
103905536
103905537
103905539
103905541
103905543
103905550
103905551
103905552
103905557
103905558
103905559
103905560
103905567
103905570
103905572
103905573
103905574
103905575
103905576
103905577
103905578
103905579
103905581
103905585
103905587
103905590
103905591
103905594
103905598
103905599
103905601
103905602
103905603
103905604
103905605
103905608
103905610
103905611
103905614
103905616
103905617
103905618
103905620
103905622
103905629
103905631
103905632
103905636
103905639
103905641
103905642
103905645
103905648
103905649
103905650
103905665
103905667
103905668
103905670
103905673
103905674
103905675
103905676
103905680
103905684
Complex support
[Template
(Ident)
+ Anchor]
Model Quality
(QMean)
Position of Lig.
Study
Measure
1
9.4
0.3
103905341
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(4 Cplx.)
RUN2
pKi= 7.1
2
6.9
0.6
103904618
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(17 Cplx.)
RUN2
pKi= 8.3
3
7.2
0.6
103904633
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(15 Cplx.)
RUN2
pKi= 8.7
4
7.0
0.6
103904649
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(7 Cplx.)
RUN0
pKi= 7.3
5
9.1
0.6
103905587
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN1
pKi= 6
6
8.9
0.6
103905341
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(3 Cplx.)
RUN1
pKi= 7.1
7
7.5
0.6
103904590
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(9 Cplx.)
RUN0
pKi= 6.8
8
6.7
0.7
103904649
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(10 Cplx.)
RUN2
pKi= 7.3
9
7.4
0.7
103904590
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(17 Cplx.)
RUN2
pKi= 6.8
10
8.2
0.7
103904652
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(4 Cplx.)
RUN2
pKi= 6.3
11
6.4
0.7
103904405
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(5 Cplx.)
RUN2
pKi= 7.5
12
6.5
0.7
103904624
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(11 Cplx.)
RUN2
pKi= 8.9
13
8.4
0.7
103905213
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(10 Cplx.)
RUN2
pKi= 6.1
14
8.3
0.7
103904652
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(5 Cplx.)
RUN1
pKi= 6.3
15
7.1
0.8
103904594
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(15 Cplx.)
RUN2
pKi= 8
16
6.8
0.8
103904593
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(16 Cplx.)
RUN2
pKi= 8.4
17
7.5
0.8
103905532
1XJD
(32%)
+
STU_B_2
QMean=0.539
P1
:
(6 Cplx.)
RUN1
pKi= 7.9
18
7.3
0.8
103904622
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(16 Cplx.)
RUN2
pKi= 8.3
19
7.1
0.8
103904633
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P2
:
(4 Cplx.)
RUN0
pKi= 8.7
20
6.9
0.8
103905281
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(11 Cplx.)
RUN2
pKi= 5.7
21
7.1
0.8
103904906
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(10 Cplx.)
RUN1
pKi= 7.2
22
6.9
0.8
103905599
3MYG
(72%)
+
EML_A_3
QMean=0.513
P2
:
(4 Cplx.)
RUN2
pKi= 5.6
23
7.1
0.8
103904904
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(11 Cplx.)
RUN1
pKi= 7.2
24
6.6
0.8
103904404
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(4 Cplx.)
RUN2
pKi= 7.6
25
5.5
0.8
103904646
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P2
:
(3 Cplx.)
RUN2
pKi= 4.8
26
8.1
0.8
103904652
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P2
:
(3 Cplx.)
RUN0
pKi= 6.3
27
8.6
0.8
103905250
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(17 Cplx.)
RUN1
pKi= 8.6
28
6.7
0.9
103905004
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(17 Cplx.)
RUN2
pKi= 6.9
29
6.5
0.9
103904403
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P2
:
(4 Cplx.)
RUN2
pKi= 8.6
30
6.2
0.9
103904687
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN1
pKi= 5.4
31
8.2
0.9
103904744
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(6 Cplx.)
RUN1
pKi= 5.4
32
7.3
0.9
103904618
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(8 Cplx.)
RUN0
pKi= 8.3
33
8.6
0.9
103904371
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN1
pKi= 5.8
34
6.6
0.9
103904610
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(18 Cplx.)
RUN2
pKi= 8
35
6.5
0.9
103904405
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P1
:
(5 Cplx.)
RUN1
pKi= 7.5
36
6.7
0.9
103904639
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(16 Cplx.)
RUN2
pKi= 6.5
37
8.1
0.9
103905642
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(5 Cplx.)
RUN2
pKi= 5.9
38
7.5
0.9
103904622
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(8 Cplx.)
RUN0
pKi= 8.3
39
7.4
0.9
103904623
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(13 Cplx.)
RUN2
pKi= 8.7
40
5.6
0.9
103905123
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P3
:
(3 Cplx.)
RUN1
pKi= 4.6
41
6.0
0.9
103904814
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P3
:
(3 Cplx.)
RUN2
pKi= 6
42
8.0
0.9
103904801
3H10
(72%)
+
97B_A_4
QMean=0.516
P3
:
(3 Cplx.)
RUN0
pKi= 6.1
43
8.7
0.9
103905250
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(18 Cplx.)
RUN2
pKi= 8.6
44
6.4
0.9
103904633
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(13 Cplx.)
RUN1
pKi= 8.7
45
6.9
0.9
103905338
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(11 Cplx.)
RUN1
pKi= 5.6
46
6.8
0.9
103905460
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P1
:
(17 Cplx.)
RUN2
pKi= 6.5
47
8.7
0.9
103905531
1XJD
(32%)
+
STU_B_2
QMean=0.539
P1
:
(5 Cplx.)
RUN2
pKi= 8.7
48
7.2
0.9
103904639
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(9 Cplx.)
RUN0
pKi= 6.5
49
6.4
0.9
103904403
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(5 Cplx.)
RUN0
pKi= 8.6
50
8.8
1.0
103905251
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P2
:
(3 Cplx.)
RUN2
pKi= 7.8
51
6.5
1.0
103905460
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P1
:
(16 Cplx.)
RUN1
pKi= 6.5
52
5.1
1.0
103904386
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(15 Cplx.)
RUN2
pKi= 4.1
53
6.8
1.0
103904610
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(14 Cplx.)
RUN0
pKi= 8
54
8.2
1.0
103904644
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(10 Cplx.)
RUN2
pKi= 5.5
55
7.5
1.0
103904801
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(10 Cplx.)
RUN1
pKi= 6.1
56
6.4
1.0
103904590
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(10 Cplx.)
RUN1
pKi= 6.8
57
6.1
1.0
103905238
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(4 Cplx.)
RUN2
pKi= 6.9
58
7.6
1.0
103905215
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(5 Cplx.)
RUN2
pKi= 5.9
59
5.0
1.0
103905501
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P2
:
(6 Cplx.)
RUN1
pKi= 4.2
60
6.2
1.0
103904694
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(4 Cplx.)
RUN1
pKi= 5.4
61
6.6
1.1
103904404
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(3 Cplx.)
RUN0
pKi= 7.6
62
7.8
1.1
103905213
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(12 Cplx.)
RUN1
pKi= 6.1
63
7.8
1.1
103905286
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(9 Cplx.)
RUN1
pKi= 5.9
64
6.7
1.1
103904815
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(5 Cplx.)
RUN2
pKi= 6.3
65
6.8
1.1
103904406
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(9 Cplx.)
RUN2
pKi= 6.8
66
6.1
1.1
103904695
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(5 Cplx.)
RUN1
pKi= 5.9
67
5.0
1.1
103905501
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(6 Cplx.)
RUN2
pKi= 4.2
68
7.0
1.1
103905215
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(4 Cplx.)
RUN1
pKi= 5.9
69
7.3
1.1
103904594
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(8 Cplx.)
RUN0
pKi= 8
70
6.0
1.1
103905487
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN1
pKi= 5.2
71
6.5
1.1
103904815
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(6 Cplx.)
RUN1
pKi= 6.3
72
6.4
1.1
103905515
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(7 Cplx.)
RUN1
pKi= 6.5
73
6.5
1.1
103905558
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(6 Cplx.)
RUN2
pKi= 7.3
74
6.9
1.1
103905525
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(8 Cplx.)
RUN1
pKi= 7.1
75
6.4
1.1
103904212
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(6 Cplx.)
RUN2
pKi= 6
76
5.6
1.1
103904861
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(4 Cplx.)
RUN1
pKi= 6.2
77
5.9
1.1
103904862
3MYG
(72%)
+
EML_A_3
QMean=0.513
P1
:
(6 Cplx.)
RUN2
pKi= 6.6
78
5.8
1.1
103905443
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(9 Cplx.)
RUN2
pKi= 6.2
79
5.7
1.1
103905375
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P2
:
(5 Cplx.)
RUN2
pKi= 5.7
80
6.4
1.1
103905536
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P1
:
(16 Cplx.)
RUN2
pKi= 5.8
81
6.4
1.1
103904593
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(13 Cplx.)
RUN1
pKi= 8.4
82
6.5
1.1
103905599
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(14 Cplx.)
RUN1
pKi= 5.6
83
6.3
1.1
103905515
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(5 Cplx.)
RUN2
pKi= 6.5
84
7.3
1.1
103904810
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(4 Cplx.)
RUN2
pKi= 6.4
85
9.1
1.1
103905250
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(4 Cplx.)
RUN0
pKi= 8.6
86
7.1
1.2
103904810
3COH
(72%)
+
83H_A_3
QMean=0.518
P3
:
(3 Cplx.)
RUN1
pKi= 6.4
87
5.7
1.2
103904651
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P2
:
(3 Cplx.)
RUN2
pKi= 7.4
88
6.9
1.2
103905520
3H10
(72%)
+
97B_A_4
QMean=0.516
P2
:
(4 Cplx.)
RUN2
pKi= 7.1
89
6.8
1.2
103905313
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P3
:
(3 Cplx.)
RUN1
pKi= 5.6
90
6.8
1.2
103904624
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(5 Cplx.)
RUN0
pKi= 8.9
91
8.4
1.2
103904644
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(6 Cplx.)
RUN0
pKi= 5.5
92
6.0
1.2
103904861
3MYG
(72%)
+
EML_A_3
QMean=0.513
P3
:
(3 Cplx.)
RUN2
pKi= 6.2
93
7.1
1.2
103905010
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(9 Cplx.)
RUN2
pKi= 5.8
94
7.2
1.2
103905216
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(17 Cplx.)
RUN2
pKi= 6.5
95
7.0
1.2
103904468
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(3 Cplx.)
RUN2
pKi= 6.3
96
4.4
1.2
103905401
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P3
:
(3 Cplx.)
RUN2
pKi= 4.3
97
5.1
1.2
103904714
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P1
:
(16 Cplx.)
RUN1
pKi= 5.7
98
5.9
1.2
103904482
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(4 Cplx.)
RUN1
pKi= 5.8
99
6.8
1.2
103904203
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(6 Cplx.)
RUN2
pKi= 5.7
100
7.9
1.2
103904801
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(7 Cplx.)
RUN2
pKi= 6.1
101
5.7
1.2
103905238
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P3
:
(3 Cplx.)
RUN1
pKi= 6.9
102
8.7
1.2
103904742
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(5 Cplx.)
RUN1
pKi= 8.5
103
5.4
1.2
103904646
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P4
:
(4 Cplx.)
RUN1
pKi= 4.8
104
7.2
1.2
103905214
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P3
:
(3 Cplx.)
RUN2
pKi= 5.6
105
6.4
1.2
103904512
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P2
:
(4 Cplx.)
RUN1
pKi= 6.7
106
6.5
1.2
103904863
3NRM
(70%)
+
NRM_A_2
QMean=0.448
P1
:
(7 Cplx.)
RUN2
pKi= 6.5
107
5.6
1.2
103904862
3MYG
(72%)
+
EML_A_3
QMean=0.513
P2
:
(4 Cplx.)
RUN1
pKi= 6.6
108
6.4
1.2
103904517
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(6 Cplx.)
RUN2
pKi= 5.3
109
6.2
1.2
103905238
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(6 Cplx.)
RUN0
pKi= 6.9
110
6.0
1.2
103904921
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P2
:
(3 Cplx.)
RUN2
pKi= 5.4
111
6.7
1.2
103904649
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(5 Cplx.)
RUN1
pKi= 7.3
112
5.5
1.2
103905248
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(8 Cplx.)
RUN1
pKi= 7.5
113
8.5
1.2
103904748
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN1
pKi= 8.6
114
5.4
1.2
103905112
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(6 Cplx.)
RUN2
pKi= 7.4
115
6.9
1.2
103904812
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(3 Cplx.)
RUN2
pKi= 5.8
116
7.6
1.3
103904937
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P2
:
(5 Cplx.)
RUN2
pKi= 7.7
117
5.9
1.3
103904886
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(9 Cplx.)
RUN1
pKi= 5.6
118
6.2
1.3
103904202
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P3
:
(3 Cplx.)
RUN1
pKi= 5.9
119
5.6
1.3
103904543
2W1D
(72%)
+
L0D_A_2
QMean=0.515
P1
:
(7 Cplx.)
RUN2
pKi= 5.6
120
5.7
1.3
103904651
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(3 Cplx.)
RUN1
pKi= 7.4
121
6.9
1.3
103905525
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(7 Cplx.)
RUN2
pKi= 7.1
122
6.4
1.3
103905296
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN1
pKi= 6.1
123
7.2
1.3
103904414
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN1
pKi= 6
124
6.6
1.3
103904502
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(7 Cplx.)
RUN2
pKi= 6.2
125
6.5
1.3
103904483
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(6 Cplx.)
RUN2
pKi= 6.6
126
7.6
1.3
103905340
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P2
:
(4 Cplx.)
RUN1
pKi= 5.9
127
7.1
1.3
103905004
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(7 Cplx.)
RUN0
pKi= 6.9
128
5.6
1.3
103904891
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(7 Cplx.)
RUN2
pKi= 7.9
129
6.2
1.3
103904648
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(3 Cplx.)
RUN1
pKi= 6.2
130
5.6
1.3
103904198
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(6 Cplx.)
RUN2
pKi= 5.2
131
8.0
1.3
103904596
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P2
:
(3 Cplx.)
RUN1
pKi= 7.7
132
7.0
1.3
103905259
3TXO
(34%)
+
07U_A_2
QMean=0.548
P1
:
(7 Cplx.)
RUN2
pKi= 7.8
133
7.9
1.3
103904937
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P1
:
(9 Cplx.)
RUN1
pKi= 7.7
134
6.4
1.3
103905214
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P2
:
(5 Cplx.)
RUN1
pKi= 5.6
135
5.4
1.3
103905327
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(5 Cplx.)
RUN2
pKi= 4.5
136
7.1
1.3
103905113
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(7 Cplx.)
RUN1
pKi= 7.7
137
7.0
1.3
103905113
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(8 Cplx.)
RUN2
pKi= 7.7
138
6.5
1.3
103904783
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(9 Cplx.)
RUN1
pKi= 5.9
139
5.2
1.3
103904386
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(16 Cplx.)
RUN0
pKi= 4.1
140
5.4
1.3
103904864
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P3
:
(4 Cplx.)
RUN1
pKi= 7.1
141
6.5
1.3
103904471
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(8 Cplx.)
RUN2
pKi= 6.6
142
9.0
1.3
103904367
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(5 Cplx.)
RUN1
pKi= 7.2
143
5.9
1.3
103904328
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN2
pKi= 6.5
144
6.7
1.3
103905259
3TXO
(34%)
+
07U_A_2
QMean=0.548
P2
:
(6 Cplx.)
RUN1
pKi= 7.8
145
6.2
1.3
103904516
1XJD
(32%)
+
STU_B_2
QMean=0.539
P2
:
(3 Cplx.)
RUN1
pKi= 6.1
146
7.7
1.3
103904812
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(4 Cplx.)
RUN1
pKi= 5.8
147
7.5
1.3
103904422
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(4 Cplx.)
RUN2
pKi= 7.4
148
6.3
1.3
103905036
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(3 Cplx.)
RUN1
pKi= 5.4
149
6.0
1.3
103904337
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(3 Cplx.)
RUN1
pKi= 7.4
150
6.5
1.3
103904594
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(14 Cplx.)
RUN1
pKi= 8
151
7.5
1.3
103904822
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(6 Cplx.)
RUN2
pKi= 7.6
152
7.0
1.3
103904593
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(7 Cplx.)
RUN0
pKi= 8.4
153
6.3
1.3
103904610
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(15 Cplx.)
RUN1
pKi= 8
154
6.9
1.3
103905460
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(13 Cplx.)
RUN0
pKi= 6.5
155
5.7
1.3
103904198
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(11 Cplx.)
RUN1
pKi= 5.2
156
6.0
1.3
103904504
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(16 Cplx.)
RUN1
pKi= 6.5
157
5.4
1.4
103904403
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(5 Cplx.)
RUN1
pKi= 8.6
158
8.8
1.4
103905251
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(8 Cplx.)
RUN0
pKi= 7.8
159
6.8
1.4
103904622
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(10 Cplx.)
RUN1
pKi= 8.3
160
6.1
1.4
103904887
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(10 Cplx.)
RUN2
pKi= 5.3
161
8.7
1.4
103904287
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(5 Cplx.)
RUN2
pKi= 8.4
162
6.4
1.4
103904551
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P3
:
(3 Cplx.)
RUN1
pKi= 5.5
163
6.6
1.4
103904648
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(3 Cplx.)
RUN2
pKi= 6.2
164
7.6
1.4
103904644
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(10 Cplx.)
RUN1
pKi= 5.5
165
6.1
1.4
103904459
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(8 Cplx.)
RUN1
pKi= 5.8
166
5.8
1.4
103904202
3H10
(72%)
+
97B_A_4
QMean=0.516
P2
:
(4 Cplx.)
RUN2
pKi= 5.9
167
6.4
1.4
103905248
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P2
:
(3 Cplx.)
RUN2
pKi= 7.5
168
7.0
1.4
103904790
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(3 Cplx.)
RUN1
pKi= 8.5
169
6.8
1.4
103905259
3TXO
(34%)
+
07U_A_2
QMean=0.548
P2
:
(4 Cplx.)
RUN0
pKi= 7.8
170
6.0
1.4
103905109
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(6 Cplx.)
RUN2
pKi= 7.1
171
5.3
1.4
103905620
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(7 Cplx.)
RUN2
pKi= 5.5
172
6.2
1.4
103905536
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(11 Cplx.)
RUN1
pKi= 5.8
173
6.3
1.4
103904695
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P2
:
(3 Cplx.)
RUN2
pKi= 5.9
174
8.7
1.4
103905136
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P2
:
(4 Cplx.)
RUN0
pKi= 5.2
175
6.6
1.4
103904422
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(5 Cplx.)
RUN1
pKi= 7.4
176
4.7
1.4
103905114
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(3 Cplx.)
RUN1
pKi= 5.9
177
6.6
1.4
103905323
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(17 Cplx.)
RUN1
pKi= 5.7
178
6.8
1.4
103904618
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(13 Cplx.)
RUN1
pKi= 8.3
179
6.8
1.4
103904212
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(15 Cplx.)
RUN1
pKi= 6
180
7.5
1.4
103904768
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P2
:
(3 Cplx.)
RUN2
pKi= 6
181
7.8
1.4
103904813
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN2
pKi= 6.3
182
6.4
1.4
103904696
4B0G
(71%)
+
VEK_A_2
QMean=0.528
P1
:
(3 Cplx.)
RUN1
pKi= 7.7
183
8.1
1.4
103905642
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(6 Cplx.)
RUN1
pKi= 5.9
184
7.1
1.4
103905520
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(7 Cplx.)
RUN0
pKi= 7.1
185
6.9
1.4
103904406
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(4 Cplx.)
RUN1
pKi= 6.8
186
7.7
1.4
103905298
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(3 Cplx.)
RUN1
pKi= 6.3
187
6.8
1.4
103905680
3NRM
(70%)
+
NRM_A_2
QMean=0.448
P2
:
(5 Cplx.)
RUN2
pKi= 6
188
8.0
1.4
103904598
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(5 Cplx.)
RUN2
pKi= 6.8
189
6.7
1.4
103904922
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(8 Cplx.)
RUN1
pKi= 5.2
190
6.1
1.4
103904504
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(10 Cplx.)
RUN0
pKi= 6.5
191
5.8
1.4
103905398
3H10
(72%)
+
97B_A_4
QMean=0.516
P2
:
(6 Cplx.)
RUN2
pKi= 6.9
192
6.6
1.4
103904475
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(3 Cplx.)
RUN2
pKi= 5.6
193
6.1
1.4
103905406
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(4 Cplx.)
RUN1
pKi= 7.7
194
6.7
1.4
103904502
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(8 Cplx.)
RUN1
pKi= 6.2
195
5.5
1.4
103904458
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P2
:
(3 Cplx.)
RUN1
pKi= 5.5
196
5.3
1.4
103905168
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(15 Cplx.)
RUN1
pKi= 5.6
197
4.8
1.4
103904506
2W1D
(72%)
+
L0D_A_2
QMean=0.515
P1
:
(6 Cplx.)
RUN1
pKi= 4.7
198
9.2
1.4
103905213
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(6 Cplx.)
RUN0
pKi= 6.1
199
5.4
1.4
103905645
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(10 Cplx.)
RUN2
pKi= 7.3
200
7.3
1.4
103905216
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(8 Cplx.)
RUN0
pKi= 6.5
201
5.6
1.4
103905117
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(6 Cplx.)
RUN0
pKi= 6.6
202
6.8
1.4
103905303
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(7 Cplx.)
RUN0
pKi= 5.2
203
6.6
1.4
103905684
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(3 Cplx.)
RUN2
pKi= 7.2
204
5.9
1.4
103905401
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(9 Cplx.)
RUN1
pKi= 4.3
205
6.7
1.4
103904624
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(13 Cplx.)
RUN1
pKi= 8.9
206
5.9
1.4
103905122
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(9 Cplx.)
RUN2
pKi= 4.8
207
5.5
1.4
103904389
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P1
:
(10 Cplx.)
RUN2
pKi= 6.7
208
6.2
1.4
103904508
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(7 Cplx.)
RUN2
pKi= 6.2
209
6.7
1.4
103904595
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P2
:
(7 Cplx.)
RUN1
pKi= 8.2
210
8.3
1.4
103904304
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN2
pKi= 8.6
211
7.0
1.4
103904212
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(12 Cplx.)
RUN0
pKi= 6
212
8.5
1.4
103905251
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(14 Cplx.)
RUN1
pKi= 7.8
213
7.3
1.4
103905010
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(7 Cplx.)
RUN0
pKi= 5.8
214
6.4
1.4
103904214
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(12 Cplx.)
RUN2
pKi= 6.4
215
6.3
1.4
103904526
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(10 Cplx.)
RUN2
pKi= 6.4
216
5.8
1.4
103904328
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN1
pKi= 6.5
217
5.4
1.4
103905645
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(11 Cplx.)
RUN1
pKi= 7.3
218
6.8
1.4
103905231
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(7 Cplx.)
RUN2
pKi= 6.6
219
6.6
1.4
103905323
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(17 Cplx.)
RUN2
pKi= 5.7
220
8.3
1.4
103904304
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN0
pKi= 8.6
221
7.4
1.4
103905011
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(17 Cplx.)
RUN2
pKi= 6.1
222
8.3
1.4
103904269
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(5 Cplx.)
RUN2
pKi= 8.1
223
6.9
1.4
103904922
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(4 Cplx.)
RUN2
pKi= 5.2
224
6.3
1.4
103905536
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(10 Cplx.)
RUN0
pKi= 5.8
225
7.2
1.4
103905011
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P2
:
(5 Cplx.)
RUN0
pKi= 6.1
226
5.8
1.4
103905680
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(5 Cplx.)
RUN1
pKi= 6
227
6.0
1.5
103905111
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P2
:
(5 Cplx.)
RUN2
pKi= 7.7
228
7.3
1.5
103904464
2VRX
(77%)
+
447_B_6
QMean=0.387
P1
:
(4 Cplx.)
RUN2
pKi= 7.1
229
6.3
1.5
103904360
3EFW
(71%)
+
AK8_A_3
QMean=0.562
P1
:
(3 Cplx.)
RUN1
pKi= 6.9
230
6.9
1.5
103905004
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(17 Cplx.)
RUN1
pKi= 6.9
231
7.0
1.5
103904905
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P2
:
(3 Cplx.)
RUN2
pKi= 6.7
232
6.1
1.5
103905617
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(5 Cplx.)
RUN1
pKi= 6.7
233
5.9
1.5
103904203
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN1
pKi= 5.7
234
6.8
1.5
103905323
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(15 Cplx.)
RUN0
pKi= 5.7
235
6.8
1.5
103904526
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(6 Cplx.)
RUN1
pKi= 6.4
236
7.4
1.5
103904485
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(4 Cplx.)
RUN1
pKi= 5.8
237
8.5
1.5
103904596
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(11 Cplx.)
RUN2
pKi= 7.7
238
6.1
1.5
103904525
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN2
pKi= 5.7
239
6.8
1.5
103904623
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(14 Cplx.)
RUN1
pKi= 8.7
240
6.6
1.5
103904525
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(5 Cplx.)
RUN0
pKi= 5.7
241
7.3
1.5
103904938
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(5 Cplx.)
RUN2
pKi= 7.3
242
7.3
1.5
103904623
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(10 Cplx.)
RUN0
pKi= 8.7
243
5.4
1.5
103905168
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(15 Cplx.)
RUN2
pKi= 5.6
244
6.4
1.5
103904350
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(3 Cplx.)
RUN2
pKi= 6.3
245
7.3
1.5
103904905
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(7 Cplx.)
RUN1
pKi= 6.7
246
7.2
1.5
103904937
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(4 Cplx.)
RUN0
pKi= 7.7
247
6.0
1.5
103905449
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(5 Cplx.)
RUN2
pKi= 5.5
248
6.8
1.5
103905281
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(18 Cplx.)
RUN1
pKi= 5.7
249
8.1
1.5
103904592
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(7 Cplx.)
RUN1
pKi= 8.5
250
5.0
1.5
103904329
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P3
:
(3 Cplx.)
RUN1
pKi= 8
251
4.4
1.5
103904867
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(16 Cplx.)
RUN1
pKi= 5.3
252
6.2
1.5
103904890
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(9 Cplx.)
RUN2
pKi= 5.7
253
5.9
1.5
103904699
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN1
pKi= 7.3
254
8.2
1.5
103904300
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(6 Cplx.)
RUN1
pKi= 8.6
255
4.2
1.5
103905485
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(7 Cplx.)
RUN2
pKi= 4.3
256
8.0
1.5
103904640
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(11 Cplx.)
RUN2
pKi= 6
257
7.5
1.5
103904640
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(14 Cplx.)
RUN1
pKi= 6
258
7.9
1.5
103904751
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(3 Cplx.)
RUN2
pKi= 5.7
259
5.0
1.5
103904365
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(6 Cplx.)
RUN1
pKi= 5.9
260
5.6
1.5
103905111
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(5 Cplx.)
RUN1
pKi= 7.7
261
7.4
1.5
103905010
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(11 Cplx.)
RUN1
pKi= 5.8
262
5.4
1.5
103905675
2VRX
(77%)
+
447_B_6
QMean=0.387
P3
:
(3 Cplx.)
RUN2
pKi= 8
263
8.1
1.5
103905219
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(4 Cplx.)
RUN1
pKi= 8.4
264
5.8
1.5
103905409
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(3 Cplx.)
RUN1
pKi= 6.1
265
6.4
1.5
103904508
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(7 Cplx.)
RUN1
pKi= 6.2
266
8.0
1.5
103904640
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(11 Cplx.)
RUN0
pKi= 6
267
6.1
1.5
103904693
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(5 Cplx.)
RUN1
pKi= 5.5
268
7.3
1.5
103905231
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(6 Cplx.)
RUN1
pKi= 6.6
269
4.9
1.5
103904867
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(16 Cplx.)
RUN2
pKi= 5.3
270
7.3
1.5
103904639
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(19 Cplx.)
RUN1
pKi= 6.5
271
7.1
1.5
103905113
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(8 Cplx.)
RUN0
pKi= 7.7
272
5.3
1.5
103904990
4B8L
(77%)
+
A0P_A_3
QMean=0.495
P2
:
(5 Cplx.)
RUN2
pKi= 5.7
273
6.5
1.5
103905676
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(9 Cplx.)
RUN2
pKi= 7.4
274
7.1
1.5
103904455
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(4 Cplx.)
RUN2
pKi= 6.2
275
7.0
1.5
103905204
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN2
pKi= 5.7
276
6.6
1.5
103905252
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(12 Cplx.)
RUN2
pKi= 5.7
277
5.2
1.5
103905668
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(5 Cplx.)
RUN1
pKi= 6.6
278
8.0
1.5
103904519
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(3 Cplx.)
RUN2
pKi= 5.6
279
6.8
1.5
103905216
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(8 Cplx.)
RUN1
pKi= 6.5
280
7.1
1.5
103904904
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(18 Cplx.)
RUN2
pKi= 7.2
281
8.2
1.5
103905146
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P2
:
(4 Cplx.)
RUN1
pKi= 5.7
282
7.1
1.5
103904906
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(17 Cplx.)
RUN2
pKi= 7.2
283
5.7
1.5
103904389
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P1
:
(8 Cplx.)
RUN1
pKi= 6.7
284
4.2
1.5
103905297
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(11 Cplx.)
RUN1
pKi= 4.6
285
4.9
1.5
103905508
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(7 Cplx.)
RUN1
pKi= 5.8
286
5.6
1.5
103904455
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(4 Cplx.)
RUN1
pKi= 6.2
287
8.0
1.5
103904744
3D14
(73%)
+
AK1_A_2
QMean=0.523
P2
:
(4 Cplx.)
RUN2
pKi= 5.4
288
6.6
1.5
103905676
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(7 Cplx.)
RUN0
pKi= 7.4
289
8.7
1.5
103904366
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(3 Cplx.)
RUN1
pKi= 7.1
290
5.2
1.5
103905123
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P2
:
(5 Cplx.)
RUN2
pKi= 4.6
291
8.4
1.6
103904596
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(7 Cplx.)
RUN0
pKi= 7.7
292
6.7
1.6
103904465
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(7 Cplx.)
RUN2
pKi= 7.3
293
8.1
1.6
103905233
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(11 Cplx.)
RUN1
pKi= 7.5
294
6.0
1.6
103905109
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(5 Cplx.)
RUN1
pKi= 7.1
295
6.0
1.6
103904404
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P2
:
(3 Cplx.)
RUN1
pKi= 7.6
296
9.7
1.6
103904420
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(3 Cplx.)
RUN2
pKi= 7.3
297
8.0
1.6
103904811
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(4 Cplx.)
RUN1
pKi= 5.9
298
6.1
1.6
103904736
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(8 Cplx.)
RUN2
pKi= 6
299
8.1
1.6
103905272
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(15 Cplx.)
RUN2
pKi= 6.9
300
5.9
1.6
103904464
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(3 Cplx.)
RUN1
pKi= 7.1
301
5.5
1.6
103905084
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(12 Cplx.)
RUN1
pKi= 5.9
302
6.3
1.6
103904516
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P2
:
(3 Cplx.)
RUN0
pKi= 6.1
303
6.6
1.6
103904708
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P1
:
(4 Cplx.)
RUN1
pKi= 5.5
304
5.6
1.6
103905031
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(9 Cplx.)
RUN2
pKi= 4.1
305
5.9
1.6
103905409
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(3 Cplx.)
RUN2
pKi= 6.1
306
5.3
1.6
103905295
3COH
(72%)
+
83H_A_3
QMean=0.518
P3
:
(3 Cplx.)
RUN1
pKi= 4.5
307
7.8
1.6
103905313
3R22
(72%)
+
D37_A_2
QMean=0.500
P3
:
(3 Cplx.)
RUN2
pKi= 5.6
308
7.4
1.6
103904388
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(3 Cplx.)
RUN2
pKi= 7.9
309
5.8
1.6
103905446
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(3 Cplx.)
RUN1
pKi= 6.1
310
7.2
1.6
103905286
2VRX
(77%)
+
447_B_6
QMean=0.387
P3
:
(3 Cplx.)
RUN2
pKi= 5.9
311
5.7
1.6
103905420
2VRX
(77%)
+
447_B_6
QMean=0.387
P1
:
(6 Cplx.)
RUN1
pKi= 5.7
312
5.6
1.6
103904697
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P2
:
(6 Cplx.)
RUN2
pKi= 5.6
313
4.0
1.6
103905282
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(16 Cplx.)
RUN2
pKi= 4.7
314
5.6
1.6
103905085
3D15
(73%)
+
AK2_A_2
QMean=0.466
P2
:
(3 Cplx.)
RUN2
pKi= 6.2
315
6.4
1.6
103904601
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(11 Cplx.)
RUN2
pKi= 7.8
316
8.0
1.6
103905272
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(8 Cplx.)
RUN0
pKi= 6.9
317
7.6
1.6
103904466
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(7 Cplx.)
RUN2
pKi= 7
318
6.5
1.6
103904645
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P2
:
(3 Cplx.)
RUN2
pKi= 6
319
6.0
1.6
103904819
3COH
(72%)
+
83H_A_3
QMean=0.518
P3
:
(3 Cplx.)
RUN1
pKi= 7.3
320
4.9
1.6
103904704
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(3 Cplx.)
RUN2
pKi= 6
321
4.9
1.6
103904704
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(6 Cplx.)
RUN1
pKi= 6
322
5.9
1.6
103905509
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(9 Cplx.)
RUN2
pKi= 6
323
5.2
1.6
103905668
3COH
(72%)
+
83H_A_3
QMean=0.518
P4
:
(4 Cplx.)
RUN2
pKi= 6.6
324
7.7
1.6
103904748
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN2
pKi= 8.6
325
6.5
1.6
103905095
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P3
:
(3 Cplx.)
RUN2
pKi= 7.1
326
4.8
1.6
103905414
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(7 Cplx.)
RUN2
pKi= 5.8
327
8.4
1.6
103904784
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(3 Cplx.)
RUN1
pKi= 8.4
328
6.5
1.6
103904517
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(6 Cplx.)
RUN1
pKi= 5.3
329
7.3
1.6
103905575
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(5 Cplx.)
RUN0
pKi= 5.8
330
6.2
1.6
103904741
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(3 Cplx.)
RUN1
pKi= 6.9
331
7.6
1.6
103904300
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P2
:
(4 Cplx.)
RUN2
pKi= 8.6
332
6.3
1.6
103905405
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P2
:
(3 Cplx.)
RUN2
pKi= 8.2
333
6.2
1.6
103904935
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(12 Cplx.)
RUN1
pKi= 5.8
334
7.6
1.6
103905430
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P2
:
(3 Cplx.)
RUN2
pKi= 5.5
335
7.5
1.6
103904817
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(5 Cplx.)
RUN1
pKi= 7
336
6.9
1.6
103904484
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN1
pKi= 6.2
337
5.2
1.6
103905581
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P2
:
(5 Cplx.)
RUN1
pKi= 6.6
338
7.2
1.6
103904906
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(13 Cplx.)
RUN0
pKi= 7.2
339
7.6
1.6
103904335
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN0
pKi= 6.5
340
6.9
1.6
103905017
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P3
:
(3 Cplx.)
RUN2
pKi= 8.2
341
6.8
1.6
103905303
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(5 Cplx.)
RUN2
pKi= 5.2
342
8.1
1.6
103904466
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(6 Cplx.)
RUN0
pKi= 7
343
5.7
1.6
103905420
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(9 Cplx.)
RUN2
pKi= 5.7
344
8.6
1.6
103905464
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(4 Cplx.)
RUN1
pKi= 5.6
345
8.3
1.6
103905136
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P2
:
(3 Cplx.)
RUN2
pKi= 5.2
346
9.7
1.6
103904319
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN1
pKi= 8
347
4.1
1.6
103905282
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(15 Cplx.)
RUN1
pKi= 4.7
348
4.6
1.6
103905413
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(10 Cplx.)
RUN2
pKi= 6
349
9.9
1.6
103904270
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN2
pKi= 6
350
5.0
1.6
103904275
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P3
:
(3 Cplx.)
RUN1
pKi= 7.7
351
7.2
1.6
103904698
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(4 Cplx.)
RUN1
pKi= 7.4
352
7.0
1.6
103905602
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(12 Cplx.)
RUN2
pKi= 6.3
353
7.1
1.6
103904273
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(3 Cplx.)
RUN2
pKi= 9
354
5.7
1.6
103905039
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P2
:
(3 Cplx.)
RUN1
pKi= 5.5
355
5.0
1.6
103904714
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(13 Cplx.)
RUN2
pKi= 5.7
356
9.4
1.6
103904289
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(3 Cplx.)
RUN2
pKi= 6.9
357
8.6
1.6
103905616
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(17 Cplx.)
RUN2
pKi= 7.4
358
5.1
1.6
103905447
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(17 Cplx.)
RUN0
pKi= 5.9
359
5.9
1.6
103904735
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(6 Cplx.)
RUN0
pKi= 5
360
9.1
1.6
103904271
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(5 Cplx.)
RUN1
pKi= 7.3
361
6.2
1.6
103905091
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P3
:
(3 Cplx.)
RUN2
pKi= 6.2
362
6.3
1.6
103904736
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P3
:
(3 Cplx.)
RUN1
pKi= 6
363
6.1
1.6
103904689
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(10 Cplx.)
RUN2
pKi= 5.3
364
5.4
1.6
103904976
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(8 Cplx.)
RUN1
pKi= 4.8
365
8.5
1.6
103904742
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN2
pKi= 8.5
366
6.0
1.6
103904990
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(16 Cplx.)
RUN1
pKi= 5.7
367
7.7
1.6
103905012
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P2
:
(3 Cplx.)
RUN1
pKi= 7.2
368
7.0
1.6
103904477
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(3 Cplx.)
RUN2
pKi= 5.2
369
6.4
1.6
103904693
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN2
pKi= 5.5
370
7.2
1.6
103904904
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(15 Cplx.)
RUN0
pKi= 7.2
371
5.6
1.6
103905168
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P2
:
(4 Cplx.)
RUN0
pKi= 5.6
372
8.0
1.6
103904603
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(4 Cplx.)
RUN1
pKi= 7.1
373
6.3
1.6
103905324
3NRM
(70%)
+
NRM_A_2
QMean=0.448
P1
:
(13 Cplx.)
RUN0
pKi= 6.1
374
7.1
1.6
103904278
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN0
pKi= 6.7
375
7.3
1.6
103905463
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(5 Cplx.)
RUN2
pKi= 6.2
376
6.0
1.6
103905617
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P2
:
(3 Cplx.)
RUN2
pKi= 6.7
377
7.2
1.6
103904483
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(4 Cplx.)
RUN0
pKi= 6.6
378
7.1
1.6
103904662
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P2
:
(3 Cplx.)
RUN1
pKi= 5.2
379
6.6
1.6
103904882
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(5 Cplx.)
RUN2
pKi= 5.3
380
5.6
1.6
103905420
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(4 Cplx.)
RUN0
pKi= 5.7
381
5.7
1.6
103904215
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(8 Cplx.)
RUN1
pKi= 6.8
382
7.0
1.6
103904366
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(3 Cplx.)
RUN2
pKi= 7.1
383
8.7
1.6
103904297
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN1
pKi= 8.1
384
7.6
1.6
103905286
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(4 Cplx.)
RUN0
pKi= 5.9
385
6.3
1.6
103905122
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(8 Cplx.)
RUN1
pKi= 4.8
386
5.2
1.6
103905413
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P2
:
(5 Cplx.)
RUN1
pKi= 6
387
5.9
1.6
103905676
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(13 Cplx.)
RUN1
pKi= 7.4
388
6.3
1.7
103904921
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(5 Cplx.)
RUN1
pKi= 5.4
389
6.4
1.7
103904819
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN2
pKi= 7.3
390
9.2
1.7
103904272
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN1
pKi= 9.1
391
7.0
1.7
103905231
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(5 Cplx.)
RUN0
pKi= 6.6
392
6.5
1.7
103905260
4B0G
(71%)
+
VEK_A_2
QMean=0.528
P3
:
(3 Cplx.)
RUN2
pKi= 6.2
393
6.9
1.7
103904823
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(4 Cplx.)
RUN1
pKi= 7.5
394
4.2
1.7
103905282
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(18 Cplx.)
RUN0
pKi= 4.7
395
7.2
1.7
103904595
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(9 Cplx.)
RUN2
pKi= 8.2
396
6.9
1.7
103905233
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(5 Cplx.)
RUN0
pKi= 7.5
397
8.6
1.7
103905616
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(16 Cplx.)
RUN0
pKi= 7.4
398
6.1
1.7
103905504
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P3
:
(4 Cplx.)
RUN1
pKi= 6.1
399
5.3
1.7
103905375
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P2
:
(3 Cplx.)
RUN1
pKi= 5.7
400
6.2
1.7
103905110
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(5 Cplx.)
RUN2
pKi= 5.9
401
5.4
1.7
103905449
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(9 Cplx.)
RUN1
pKi= 5.5
402
8.6
1.7
103905541
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(4 Cplx.)
RUN1
pKi= 6
403
5.5
1.7
103905032
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(7 Cplx.)
RUN2
pKi= 5.9
404
5.2
1.7
103904365
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(5 Cplx.)
RUN2
pKi= 5.9
405
6.6
1.7
103904278
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(6 Cplx.)
RUN2
pKi= 6.7
406
6.2
1.7
103905324
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(13 Cplx.)
RUN2
pKi= 6.1
407
9.1
1.7
103904993
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P2
:
(3 Cplx.)
RUN0
pKi= 5.3
408
5.3
1.7
103905050
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(4 Cplx.)
RUN2
pKi= 5.8
409
7.2
1.7
103905111
3D14
(73%)
+
AK1_A_2
QMean=0.523
P2
:
(3 Cplx.)
RUN0
pKi= 7.7
410
4.8
1.7
103904441
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(9 Cplx.)
RUN1
pKi= 7.3
411
7.2
1.7
103905096
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P2
:
(3 Cplx.)
RUN2
pKi= 7.1
412
6.1
1.7
103904543
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(10 Cplx.)
RUN1
pKi= 5.6
413
6.5
1.7
103904512
2VRX
(77%)
+
447_B_6
QMean=0.387
P2
:
(3 Cplx.)
RUN2
pKi= 6.7
414
5.2
1.7
103905380
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P1
:
(5 Cplx.)
RUN2
pKi= 6.1
415
6.1
1.7
103905543
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(3 Cplx.)
RUN1
pKi= 5.9
416
6.3
1.7
103905190
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P2
:
(3 Cplx.)
RUN0
pKi= 5.7
417
5.2
1.7
103904798
3EFW
(71%)
+
AK8_A_3
QMean=0.562
P3
:
(3 Cplx.)
RUN1
pKi= 5.3
418
6.9
1.7
103904196
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN2
pKi= 5.7
419
8.5
1.7
103904592
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P2
:
(4 Cplx.)
RUN0
pKi= 8.5
420
7.3
1.7
103904636
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(12 Cplx.)
RUN2
pKi= 6.7
421
4.9
1.7
103904456
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P3
:
(3 Cplx.)
RUN1
pKi= 6.2
422
7.4
1.7
103904636
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(11 Cplx.)
RUN1
pKi= 6.7
423
5.4
1.7
103904347
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(3 Cplx.)
RUN1
pKi= 8.1
424
5.1
1.7
103904216
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(3 Cplx.)
RUN2
pKi= 6.5
425
5.5
1.7
103904191
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(3 Cplx.)
RUN1
pKi= 6.3
426
7.4
1.7
103904658
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(3 Cplx.)
RUN1
pKi= 6.7
427
5.4
1.7
103905112
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(6 Cplx.)
RUN1
pKi= 7.4
428
5.6
1.7
103904210
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(4 Cplx.)
RUN1
pKi= 5.4
429
6.0
1.7
103904516
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(4 Cplx.)
RUN2
pKi= 6.1
430
6.1
1.7
103904783
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(7 Cplx.)
RUN2
pKi= 5.9
431
5.3
1.7
103904798
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(3 Cplx.)
RUN2
pKi= 5.3
432
7.3
1.7
103905680
3NRM
(70%)
+
NRM_A_2
QMean=0.448
P2
:
(4 Cplx.)
RUN0
pKi= 6
433
6.6
1.7
103904456
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN0
pKi= 6.2
434
4.8
1.7
103905552
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P2
:
(3 Cplx.)
RUN2
pKi= 6.3
435
5.9
1.7
103904694
2VRX
(77%)
+
447_B_6
QMean=0.387
P1
:
(3 Cplx.)
RUN2
pKi= 5.4
436
5.7
1.7
103904602
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(4 Cplx.)
RUN1
pKi= 7.2
437
7.7
1.7
103904477
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN0
pKi= 5.2
438
5.7
1.7
103905116
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(7 Cplx.)
RUN1
pKi= 7.6
439
8.3
1.7
103904371
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN0
pKi= 5.8
440
4.7
1.7
103904506
2W1D
(72%)
+
L0D_A_2
QMean=0.515
P3
:
(4 Cplx.)
RUN2
pKi= 4.7
441
7.2
1.7
103905166
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(6 Cplx.)
RUN2
pKi= 5.6
442
8.5
1.7
103904598
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(5 Cplx.)
RUN0
pKi= 6.8
443
6.2
1.7
103905324
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(13 Cplx.)
RUN1
pKi= 6.1
444
6.0
1.7
103905598
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN1
pKi= 5.8
445
5.8
1.7
103904362
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(3 Cplx.)
RUN1
pKi= 7.9
446
7.4
1.7
103905575
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(4 Cplx.)
RUN2
pKi= 5.8
447
5.2
1.7
103904714
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P1
:
(8 Cplx.)
RUN0
pKi= 5.7
448
7.8
1.7
103904334
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(3 Cplx.)
RUN1
pKi= 7.2
449
6.2
1.7
103905084
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(7 Cplx.)
RUN0
pKi= 5.9
450
6.6
1.7
103904214
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(8 Cplx.)
RUN1
pKi= 6.4
451
5.9
1.7
103904735
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(7 Cplx.)
RUN1
pKi= 5
452
5.2
1.7
103905414
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P3
:
(4 Cplx.)
RUN1
pKi= 5.8
453
7.2
1.7
103905215
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(3 Cplx.)
RUN0
pKi= 5.9
454
7.4
1.7
103904485
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P2
:
(3 Cplx.)
RUN2
pKi= 5.8
455
7.2
1.7
103904995
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(4 Cplx.)
RUN1
pKi= 5.6
456
7.1
1.7
103905302
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(6 Cplx.)
RUN2
pKi= 5.3
457
5.6
1.7
103904295
3TXO
(34%)
+
07U_A_2
QMean=0.548
P2
:
(3 Cplx.)
RUN1
pKi= 7.9
458
6.5
1.7
103904297
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(4 Cplx.)
RUN2
pKi= 8.1
459
5.9
1.7
103904653
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(16 Cplx.)
RUN2
pKi= 7.4
460
8.7
1.7
103904742
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN0
pKi= 8.5
461
6.7
1.7
103905303
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(9 Cplx.)
RUN1
pKi= 5.2
462
7.2
1.7
103905011
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(10 Cplx.)
RUN1
pKi= 6.1
463
7.7
1.7
103905260
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P2
:
(4 Cplx.)
RUN0
pKi= 6.2
464
9.8
1.7
103904289
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN1
pKi= 6.9
465
6.0
1.7
103904684
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(4 Cplx.)
RUN2
pKi= 7.1
466
5.1
1.7
103904363
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P3
:
(3 Cplx.)
RUN2
pKi= 6.7
467
5.7
1.7
103905031
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(10 Cplx.)
RUN1
pKi= 4.1
468
5.6
1.7
103904889
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN1
pKi= 6.6
469
6.6
1.7
103905684
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(5 Cplx.)
RUN1
pKi= 7.2
470
6.3
1.7
103904998
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(6 Cplx.)
RUN2
pKi= 6.3
471
5.8
1.7
103905590
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P2
:
(3 Cplx.)
RUN2
pKi= 7.2
472
5.7
1.7
103905190
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(6 Cplx.)
RUN2
pKi= 5.7
473
8.6
1.8
103904287
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN1
pKi= 8.4
474
5.8
1.8
103904872
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(3 Cplx.)
RUN2
pKi= 6.8
475
4.9
1.8
103904867
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(18 Cplx.)
RUN0
pKi= 5.3
476
5.2
1.8
103904377
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(3 Cplx.)
RUN2
pKi= 7.8
477
5.9
1.8
103905089
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P2
:
(3 Cplx.)
RUN0
pKi= 4.7
478
7.4
1.8
103904485
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(4 Cplx.)
RUN0
pKi= 5.8
479
5.0
1.8
103905447
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(13 Cplx.)
RUN2
pKi= 5.9
480
6.7
1.8
103904466
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(3 Cplx.)
RUN1
pKi= 7
481
6.0
1.8
103905317
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(4 Cplx.)
RUN1
pKi= 5.5
482
7.7
1.8
103904818
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(7 Cplx.)
RUN2
pKi= 6.8
483
6.5
1.8
103905047
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(5 Cplx.)
RUN2
pKi= 6.4
484
7.0
1.8
103905557
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN0
pKi= 6.3
485
7.4
1.8
103904405
3NRM
(70%)
+
NRM_A_2
QMean=0.448
P1
:
(7 Cplx.)
RUN0
pKi= 7.5
486
5.8
1.8
103904215
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(8 Cplx.)
RUN0
pKi= 6.8
487
8.5
1.8
103904400
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(3 Cplx.)
RUN1
pKi= 8.5
488
7.9
1.8
103904455
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P2
:
(3 Cplx.)
RUN0
pKi= 6.2
489
6.7
1.8
103904517
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(5 Cplx.)
RUN0
pKi= 5.3
490
8.0
1.8
103904484
1XJD
(32%)
+
STU_B_2
QMean=0.539
P1
:
(4 Cplx.)
RUN0
pKi= 6.2
491
6.2
1.8
103904368
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(6 Cplx.)
RUN1
pKi= 7.8
492
5.7
1.8
103905487
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(7 Cplx.)
RUN2
pKi= 5.2
493
7.4
1.8
103904601
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(6 Cplx.)
RUN0
pKi= 7.8
494
7.5
1.8
103905430
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P2
:
(3 Cplx.)
RUN1
pKi= 5.5
495
5.6
1.8
103905508
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(9 Cplx.)
RUN0
pKi= 5.8
496
5.7
1.8
103904518
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(4 Cplx.)
RUN2
pKi= 6.3
497
7.7
1.8
103905219
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P2
:
(3 Cplx.)
RUN0
pKi= 8.4
498
7.5
1.8
103904768
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN1
pKi= 6
499
6.2
1.8
103904919
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(3 Cplx.)
RUN1
pKi= 6.4
500
6.0
1.8
103904339
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(4 Cplx.)
RUN2
pKi= 6.5
501
6.8
1.8
103905047
1XJD
(32%)
+
STU_B_2
QMean=0.539
P1
:
(4 Cplx.)
RUN1
pKi= 6.4
502
5.9
1.8
103905449
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P2
:
(3 Cplx.)
RUN0
pKi= 5.5
503
4.9
1.8
103905380
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(5 Cplx.)
RUN1
pKi= 6.1
504
5.4
1.8
103905675
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P2
:
(4 Cplx.)
RUN0
pKi= 8
505
5.3
1.8
103904688
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(15 Cplx.)
RUN2
pKi= 5.7
506
6.7
1.8
103905047
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(6 Cplx.)
RUN0
pKi= 6.4
507
5.9
1.8
103904692
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(8 Cplx.)
RUN2
pKi= 5.7
508
5.7
1.8
103905212
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P2
:
(3 Cplx.)
RUN1
pKi= 6.9
509
5.8
1.8
103904699
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P2
:
(4 Cplx.)
RUN2
pKi= 7.3
510
5.9
1.8
103905675
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(10 Cplx.)
RUN1
pKi= 8
511
7.9
1.8
103905267
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(4 Cplx.)
RUN0
pKi= 5.3
512
5.9
1.8
103904685
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(6 Cplx.)
RUN2
pKi= 6
513
5.0
1.8
103905447
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(12 Cplx.)
RUN1
pKi= 5.9
514
6.6
1.8
103905670
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(3 Cplx.)
RUN2
pKi= 6.2
515
5.5
1.8
103904935
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(8 Cplx.)
RUN2
pKi= 5.8
516
5.5
1.8
103905006
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(4 Cplx.)
RUN2
pKi= 6.2
517
5.7
1.8
103905629
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P2
:
(4 Cplx.)
RUN1
pKi= 7
518
6.9
1.8
103905252
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(9 Cplx.)
RUN0
pKi= 5.7
519
6.6
1.8
103904294
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P2
:
(3 Cplx.)
RUN2
pKi= 8.2
520
4.0
1.8
103905297
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P3
:
(4 Cplx.)
RUN2
pKi= 4.6
521
6.6
1.8
103905110
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(5 Cplx.)
RUN0
pKi= 5.9
522
5.9
1.8
103905269
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P1
:
(5 Cplx.)
RUN2
pKi= 6
523
6.4
1.8
103905252
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(11 Cplx.)
RUN1
pKi= 5.7
524
5.8
1.8
103905089
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(10 Cplx.)
RUN1
pKi= 4.7
525
6.7
1.8
103905338
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P4
:
(3 Cplx.)
RUN2
pKi= 5.6
526
5.4
1.8
103905614
3R22
(72%)
+
D37_A_2
QMean=0.500
P1
:
(5 Cplx.)
RUN2
pKi= 6
527
8.1
1.8
103904785
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN1
pKi= 7.8
528
4.8
1.8
103905581
3COH
(72%)
+
83H_A_3
QMean=0.518
P3
:
(3 Cplx.)
RUN2
pKi= 6.6
529
5.6
1.8
103904450
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(4 Cplx.)
RUN1
pKi= 6.5
530
8.8
1.8
103904269
3D14
(73%)
+
AK1_A_2
QMean=0.523
P3
:
(3 Cplx.)
RUN1
pKi= 8.1
531
5.4
1.8
103904688
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(14 Cplx.)
RUN1
pKi= 5.7
532
8.1
1.8
103904992
4B8L
(77%)
+
A0P_A_3
QMean=0.495
P1
:
(6 Cplx.)
RUN1
pKi= 6
533
7.4
1.8
103905272
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(5 Cplx.)
RUN1
pKi= 6.9
534
7.9
1.8
103904818
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(6 Cplx.)
RUN0
pKi= 6.8
535
6.9
1.8
103904471
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(4 Cplx.)
RUN0
pKi= 6.6
536
7.2
1.8
103904654
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(9 Cplx.)
RUN0
pKi= 7.8
537
6.5
1.8
103905504
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(9 Cplx.)
RUN2
pKi= 6.1
538
6.9
1.8
103904502
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(7 Cplx.)
RUN0
pKi= 6.2
539
6.8
1.8
103904371
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(4 Cplx.)
RUN2
pKi= 5.8
540
6.6
1.8
103904965
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(9 Cplx.)
RUN2
pKi= 5.2
541
5.3
1.8
103904857
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(6 Cplx.)
RUN2
pKi= 8.1
542
6.1
1.8
103905300
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN2
pKi= 5.2
543
7.0
1.8
103905464
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(3 Cplx.)
RUN2
pKi= 5.6
544
6.1
1.8
103904210
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(3 Cplx.)
RUN2
pKi= 5.4
545
8.7
1.8
103904288
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(4 Cplx.)
RUN2
pKi= 7.8
546
6.6
1.8
103904508
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(5 Cplx.)
RUN0
pKi= 6.2
547
7.1
1.8
103904862
3NRM
(70%)
+
NRM_A_2
QMean=0.448
P2
:
(3 Cplx.)
RUN0
pKi= 6.6
548
6.3
1.8
103905084
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(16 Cplx.)
RUN2
pKi= 5.9
549
5.8
1.8
103904504
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P2
:
(6 Cplx.)
RUN2
pKi= 6.5
550
6.8
1.8
103904651
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(4 Cplx.)
RUN0
pKi= 7.4
551
5.5
1.8
103904389
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(8 Cplx.)
RUN0
pKi= 6.7
552
6.2
1.8
103904783
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(8 Cplx.)
RUN0
pKi= 5.9
553
6.0
1.8
103905122
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P2
:
(3 Cplx.)
RUN0
pKi= 4.8
554
8.4
1.8
103905541
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(4 Cplx.)
RUN0
pKi= 6
555
8.5
1.8
103904303
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN1
pKi= 8.5
556
7.6
1.8
103904816
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(3 Cplx.)
RUN1
pKi= 7.3
557
8.1
1.8
103905137
3DJ5
(73%)
+
AK5_A_2
QMean=0.566
P2
:
(3 Cplx.)
RUN2
pKi= 5.6
558
5.4
1.8
103904820
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P3
:
(3 Cplx.)
RUN1
pKi= 5.9
559
5.9
1.8
103905031
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(15 Cplx.)
RUN0
pKi= 4.1
560
6.1
1.8
103905375
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(5 Cplx.)
RUN0
pKi= 5.7
561
5.7
1.8
103905300
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(4 Cplx.)
RUN1
pKi= 5.2
562
5.0
1.8
103905206
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN2
pKi= 5.8
563
6.4
1.8
103904356
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(6 Cplx.)
RUN1
pKi= 7.4
564
4.4
1.8
103905115
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(6 Cplx.)
RUN1
pKi= 7.5
565
6.0
1.8
103905645
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(6 Cplx.)
RUN0
pKi= 7.3
566
6.1
1.8
103905270
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P1
:
(8 Cplx.)
RUN2
pKi= 6.1
567
6.9
1.8
103905105
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(3 Cplx.)
RUN2
pKi= 5.8
568
5.3
1.8
103905318
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(4 Cplx.)
RUN1
pKi= 5.5
569
6.2
1.8
103904333
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(3 Cplx.)
RUN1
pKi= 7.2
570
5.7
1.8
103904789
4B8L
(77%)
+
A0P_A_3
QMean=0.495
P2
:
(5 Cplx.)
RUN1
pKi= 5.9
571
6.4
1.8
103905300
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(7 Cplx.)
RUN0
pKi= 5.2
572
6.9
1.8
103905233
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(8 Cplx.)
RUN2
pKi= 7.5
573
7.0
1.8
103905515
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(3 Cplx.)
RUN0
pKi= 6.5
574
7.3
1.8
103905428
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(3 Cplx.)
RUN0
pKi= 6.9
575
8.4
1.8
103905616
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(17 Cplx.)
RUN1
pKi= 7.4
576
6.8
1.8
103904414
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(5 Cplx.)
RUN2
pKi= 6
577
6.1
1.8
103904482
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(4 Cplx.)
RUN0
pKi= 5.8
578
6.2
1.8
103905504
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P3
:
(3 Cplx.)
RUN0
pKi= 6.1
579
6.7
1.8
103905237
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(3 Cplx.)
RUN0
pKi= 5.2
580
7.9
1.8
103904961
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN1
pKi= 6.1
581
5.5
1.8
103904199
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P2
:
(3 Cplx.)
RUN1
pKi= 6.1
582
4.6
1.8
103905203
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P3
:
(3 Cplx.)
RUN2
pKi= 4.8
583
7.9
1.8
103904388
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN1
pKi= 7.9
584
5.9
1.8
103904887
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P2
:
(4 Cplx.)
RUN0
pKi= 5.3
585
4.6
1.8
103905117
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(6 Cplx.)
RUN1
pKi= 6.6
586
6.7
1.8
103904898
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P2
:
(3 Cplx.)
RUN0
pKi= 5.7
587
7.2
1.8
103905248
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(8 Cplx.)
RUN0
pKi= 7.5
588
7.3
1.8
103904953
3R22
(72%)
+
D37_A_2
QMean=0.500
P2
:
(3 Cplx.)
RUN1
pKi= 8.4
589
7.6
1.8
103904484
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(3 Cplx.)
RUN2
pKi= 6.2
590
6.0
1.8
103905270
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P2
:
(3 Cplx.)
RUN1
pKi= 6.1
591
6.1
1.8
103905110
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(6 Cplx.)
RUN1
pKi= 5.9
592
5.5
1.8
103904657
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(5 Cplx.)
RUN1
pKi= 7
593
6.9
1.9
103904388
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P1
:
(3 Cplx.)
RUN0
pKi= 7.9
594
8.2
1.9
103905488
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P2
:
(3 Cplx.)
RUN2
pKi= 7.3
595
6.1
1.9
103904370
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P2
:
(3 Cplx.)
RUN2
pKi= 7.3
596
6.4
1.9
103904990
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(13 Cplx.)
RUN0
pKi= 5.7
597
5.6
1.9
103904688
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(11 Cplx.)
RUN0
pKi= 5.7
598
3.7
1.9
103905412
2VRX
(77%)
+
447_B_6
QMean=0.387
P2
:
(7 Cplx.)
RUN1
pKi= 4.5
599
5.6
1.9
103905116
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(7 Cplx.)
RUN0
pKi= 7.6
600
4.6
1.9
103904916
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P4
:
(3 Cplx.)
RUN1
pKi= 6.8
601
5.8
1.9
103905144
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P2
:
(3 Cplx.)
RUN0
pKi= 5.9
602
5.7
1.9
103904215
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(9 Cplx.)
RUN2
pKi= 6.8
603
4.5
1.9
103904386
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(11 Cplx.)
RUN1
pKi= 4.1
604
6.4
1.9
103904209
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(9 Cplx.)
RUN1
pKi= 5.4
605
6.1
1.9
103905405
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(9 Cplx.)
RUN1
pKi= 8.2
606
5.6
1.9
103905401
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(8 Cplx.)
RUN0
pKi= 4.3
607
5.9
1.9
103904935
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN0
pKi= 5.8
608
6.8
1.9
103904997
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN2
pKi= 7.3
609
7.7
1.9
103905012
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(3 Cplx.)
RUN2
pKi= 7.2
610
7.9
1.9
103905007
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(3 Cplx.)
RUN2
pKi= 5.3
611
5.3
1.9
103904364
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(7 Cplx.)
RUN2
pKi= 5.8
612
7.1
1.9
103904861
3NRM
(70%)
+
NRM_A_2
QMean=0.448
P2
:
(6 Cplx.)
RUN0
pKi= 6.2
613
6.1
1.9
103905389
1XJD
(32%)
+
STU_B_2
QMean=0.539
P2
:
(5 Cplx.)
RUN2
pKi= 5.6
614
7.1
1.9
103904512
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P2
:
(3 Cplx.)
RUN0
pKi= 6.7
615
6.5
1.9
103905604
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(6 Cplx.)
RUN1
pKi= 6.1
616
6.7
1.9
103904654
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(11 Cplx.)
RUN1
pKi= 7.8
617
7.8
1.9
103904751
3D14
(73%)
+
AK1_A_2
QMean=0.523
P2
:
(3 Cplx.)
RUN1
pKi= 5.7
618
6.0
1.9
103904697
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(9 Cplx.)
RUN1
pKi= 5.6
619
5.1
1.9
103904857
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(3 Cplx.)
RUN1
pKi= 8.1
620
5.6
1.9
103904364
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P2
:
(5 Cplx.)
RUN0
pKi= 5.8
621
6.9
1.9
103904647
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(3 Cplx.)
RUN1
pKi= 7
622
7.3
1.9
103904992
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(3 Cplx.)
RUN2
pKi= 6
623
6.1
1.9
103904337
3TXO
(34%)
+
07U_A_2
QMean=0.548
P1
:
(3 Cplx.)
RUN2
pKi= 7.4
624
5.9
1.9
103904339
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(3 Cplx.)
RUN1
pKi= 6.5
625
6.7
1.9
103904750
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(4 Cplx.)
RUN2
pKi= 5.4
626
6.7
1.9
103904886
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(5 Cplx.)
RUN2
pKi= 5.6
627
5.8
1.9
103904735
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(6 Cplx.)
RUN2
pKi= 5
628
6.6
1.9
103905340
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(3 Cplx.)
RUN2
pKi= 5.9
629
7.9
1.9
103905007
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P2
:
(3 Cplx.)
RUN0
pKi= 5.3
630
6.1
1.9
103905013
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P3
:
(3 Cplx.)
RUN1
pKi= 7.4
631
9.4
1.9
103904304
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(4 Cplx.)
RUN1
pKi= 8.6
632
4.2
1.9
103904442
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P2
:
(4 Cplx.)
RUN1
pKi= 4.7
633
6.9
1.9
103905281
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(11 Cplx.)
RUN0
pKi= 5.7
634
4.9
1.9
103905284
3D2I
(73%)
+
AK3_A_2
QMean=0.483
P2
:
(5 Cplx.)
RUN2
pKi= 6.5
635
5.1
1.9
103905284
3D2I
(73%)
+
AK3_A_2
QMean=0.483
P2
:
(5 Cplx.)
RUN1
pKi= 6.5
636
7.2
1.9
103904325
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(3 Cplx.)
RUN2
pKi= 7.3
637
7.3
1.9
103904817
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P2
:
(4 Cplx.)
RUN2
pKi= 7
638
4.4
1.9
103905508
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P2
:
(5 Cplx.)
RUN2
pKi= 5.8
639
8.0
1.9
103904748
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P3
:
(3 Cplx.)
RUN0
pKi= 8.6
640
7.4
1.9
103904414
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P1
:
(5 Cplx.)
RUN0
pKi= 6
641
5.9
1.9
103904564
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(3 Cplx.)
RUN2
pKi= 5.7
642
8.3
1.9
103905137
3DJ5
(73%)
+
AK5_A_2
QMean=0.566
P2
:
(4 Cplx.)
RUN0
pKi= 5.6
643
4.6
1.9
103904955
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(5 Cplx.)
RUN2
pKi= 5.5
644
4.8
1.9
103904364
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(6 Cplx.)
RUN1
pKi= 5.8
645
5.8
1.9
103904198
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(15 Cplx.)
RUN0
pKi= 5.2
646
5.6
1.9
103905032
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(7 Cplx.)
RUN1
pKi= 5.9
647
5.7
1.9
103905501
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(7 Cplx.)
RUN0
pKi= 4.2
648
5.3
1.9
103904450
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(6 Cplx.)
RUN2
pKi= 6.5
649
6.9
1.9
103905463
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(3 Cplx.)
RUN1
pKi= 6.2
650
5.8
1.9
103905089
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(6 Cplx.)
RUN2
pKi= 4.7
651
9.0
1.9
103904288
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(4 Cplx.)
RUN1
pKi= 7.8
652
7.4
1.9
103905097
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P2
:
(3 Cplx.)
RUN0
pKi= 7.2
653
7.6
1.9
103905214
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN0
pKi= 5.6
654
5.2
1.9
103905576
2W1D
(72%)
+
L0D_A_2
QMean=0.515
P1
:
(5 Cplx.)
RUN1
pKi= 5.7
655
5.4
1.9
103905049
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P3
:
(3 Cplx.)
RUN1
pKi= 5.7
656
6.7
1.9
103904654
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(14 Cplx.)
RUN2
pKi= 7.8
657
6.1
1.9
103904330
3H10
(72%)
+
97B_A_4
QMean=0.516
P2
:
(3 Cplx.)
RUN1
pKi= 7.5
658
6.4
1.9
103904890
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P2
:
(4 Cplx.)
RUN0
pKi= 5.7
659
5.6
1.9
103905425
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P2
:
(4 Cplx.)
RUN2
pKi= 5.7
660
5.1
1.9
103905052
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P2
:
(3 Cplx.)
RUN2
pKi= 5.4
661
4.7
1.9
103905327
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P3
:
(3 Cplx.)
RUN1
pKi= 4.5
662
7.0
1.9
103904348
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(7 Cplx.)
RUN2
pKi= 7.5
663
9.6
1.9
103905567
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN2
pKi= 5.7
664
5.5
1.9
103905368
4DED
(71%)
+
NHU_A_2
QMean=0.467
P2
:
(3 Cplx.)
RUN0
pKi= 6.2
665
7.0
1.9
103904938
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(8 Cplx.)
RUN1
pKi= 7.3
666
7.2
1.9
103905276
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(6 Cplx.)
RUN2
pKi= 5.8
667
5.6
1.9
103904200
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P1
:
(4 Cplx.)
RUN2
pKi= 6.6
668
4.6
1.9
103905008
4B0G
(71%)
+
VEK_A_2
QMean=0.528
P3
:
(3 Cplx.)
RUN2
pKi= 5.2
669
7.1
1.9
103904294
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P2
:
(3 Cplx.)
RUN1
pKi= 8.2
670
6.3
1.9
103905296
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(4 Cplx.)
RUN0
pKi= 6.1
671
5.9
1.9
103904689
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P1
:
(13 Cplx.)
RUN1
pKi= 5.3
672
7.1
1.9
103905558
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(6 Cplx.)
RUN1
pKi= 7.3
673
9.1
1.9
103904272
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(5 Cplx.)
RUN0
pKi= 9.1
674
7.1
1.9
103905022
3R22
(72%)
+
D37_A_2
QMean=0.500
P1
:
(4 Cplx.)
RUN2
pKi= 8.4
675
7.5
1.9
103905219
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(4 Cplx.)
RUN2
pKi= 8.4
676
5.5
1.9
103904346
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(3 Cplx.)
RUN2
pKi= 7.8
677
5.8
1.9
103904191
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P3
:
(3 Cplx.)
RUN2
pKi= 6.3
678
6.4
1.9
103904513
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(3 Cplx.)
RUN1
pKi= 6.6
679
6.8
1.9
103904814
3NRM
(70%)
+
NRM_A_2
QMean=0.448
P1
:
(5 Cplx.)
RUN1
pKi= 6
680
5.9
1.9
103904441
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(9 Cplx.)
RUN2
pKi= 7.3
681
6.3
1.9
103904740
3H10
(72%)
+
97B_A_4
QMean=0.516
P2
:
(3 Cplx.)
RUN0
pKi= 6
682
6.4
1.9
103904863
4B0G
(71%)
+
VEK_A_2
QMean=0.528
P1
:
(6 Cplx.)
RUN0
pKi= 6.5
683
6.0
1.9
103905269
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P3
:
(3 Cplx.)
RUN0
pKi= 6
684
5.3
1.9
103904700
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(4 Cplx.)
RUN1
pKi= 7.1
685
6.0
1.9
103904489
3R21
(72%)
+
D36_A_2
QMean=0.473
P2
:
(3 Cplx.)
RUN2
pKi= 5.7
686
6.8
1.9
103904898
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(5 Cplx.)
RUN2
pKi= 5.7
687
8.7
1.9
103904321
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(4 Cplx.)
RUN2
pKi= 6
688
6.2
1.9
103904369
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(4 Cplx.)
RUN2
pKi= 6.5
689
9.0
1.9
103905175
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(3 Cplx.)
RUN2
pKi= 5.4
690
6.6
1.9
103905014
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P2
:
(4 Cplx.)
RUN2
pKi= 7.5
691
7.2
1.9
103904465
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(7 Cplx.)
RUN0
pKi= 7.3
692
7.7
1.9
103904811
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN2
pKi= 5.9
693
6.9
1.9
103904278
3TXO
(34%)
+
07U_A_2
QMean=0.548
P1
:
(4 Cplx.)
RUN1
pKi= 6.7
694
6.8
1.9
103904965
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(9 Cplx.)
RUN0
pKi= 5.2
695
5.9
1.9
103904697
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(6 Cplx.)
RUN0
pKi= 5.6
696
5.4
1.9
103905425
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P2
:
(4 Cplx.)
RUN0
pKi= 5.7
697
7.6
1.9
103905539
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(3 Cplx.)
RUN1
pKi= 8.1
698
8.9
1.9
103904302
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(4 Cplx.)
RUN1
pKi= 7.8
699
6.1
1.9
103905079
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(5 Cplx.)
RUN2
pKi= 5.3
700
5.1
1.9
103904363
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P2
:
(4 Cplx.)
RUN1
pKi= 6.7
701
5.2
1.9
103905050
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(5 Cplx.)
RUN1
pKi= 5.8
702
6.8
1.9
103904938
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(7 Cplx.)
RUN0
pKi= 7.3
703
8.1
1.9
103904592
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(10 Cplx.)
RUN2
pKi= 8.5
704
7.4
1.9
103904464
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(5 Cplx.)
RUN0
pKi= 7.1
705
7.0
1.9
103904330
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN2
pKi= 7.5
706
7.3
1.9
103904282
3EFW
(71%)
+
AK8_A_3
QMean=0.562
P1
:
(3 Cplx.)
RUN2
pKi= 8
707
7.4
1.9
103905574
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(5 Cplx.)
RUN2
pKi= 6.1
708
8.0
1.9
103904357
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN1
pKi= 6.7
709
7.2
1.9
103905578
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(6 Cplx.)
RUN2
pKi= 5.6
710
7.0
1.9
103905260
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(8 Cplx.)
RUN1
pKi= 6.2
711
8.0
1.9
103905097
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN2
pKi= 7.2
712
6.8
1.9
103904903
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(4 Cplx.)
RUN1
pKi= 6.8
713
7.2
1.9
103904993
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P1
:
(3 Cplx.)
RUN2
pKi= 5.3
714
6.2
1.9
103904642
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(4 Cplx.)
RUN0
pKi= 6.1
715
6.5
1.9
103904525
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(5 Cplx.)
RUN1
pKi= 5.7
716
7.6
1.9
103905096
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P2
:
(3 Cplx.)
RUN0
pKi= 7.1
717
4.9
1.9
103905117
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(4 Cplx.)
RUN2
pKi= 6.6
718
8.1
1.9
103904996
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P1
:
(3 Cplx.)
RUN2
pKi= 5.9
719
6.6
1.9
103905608
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(3 Cplx.)
RUN2
pKi= 7.8
720
6.9
2.0
103905572
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P1
:
(4 Cplx.)
RUN2
pKi= 7.6
721
6.1
2.0
103904206
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P2
:
(3 Cplx.)
RUN2
pKi= 6.1
722
4.7
2.0
103905528
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(11 Cplx.)
RUN0
pKi= 5.8
723
7.7
2.0
103904505
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(3 Cplx.)
RUN1
pKi= 6.7
724
7.3
2.0
103904356
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(5 Cplx.)
RUN0
pKi= 7.4
725
8.5
2.0
103904303
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(7 Cplx.)
RUN2
pKi= 8.5
726
5.9
2.0
103905405
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P2
:
(4 Cplx.)
RUN0
pKi= 8.2
727
5.2
2.0
103904456
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(5 Cplx.)
RUN2
pKi= 6.2
728
5.3
2.0
103905114
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(5 Cplx.)
RUN2
pKi= 5.9
729
5.8
2.0
103905052
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(5 Cplx.)
RUN0
pKi= 5.4
730
4.7
2.0
103905115
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(5 Cplx.)
RUN2
pKi= 7.5
731
6.1
2.0
103904884
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P3
:
(3 Cplx.)
RUN0
pKi= 5.8
732
5.7
2.0
103905039
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(4 Cplx.)
RUN2
pKi= 5.5
733
7.3
2.0
103904387
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN1
pKi= 7.8
734
7.7
2.0
103904377
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(4 Cplx.)
RUN1
pKi= 7.8
735
6.7
2.0
103905590
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(8 Cplx.)
RUN1
pKi= 7.2
736
6.8
2.0
103904883
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(5 Cplx.)
RUN2
pKi= 5.3
737
7.5
2.0
103905670
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN0
pKi= 6.2
738
6.4
2.0
103905602
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(12 Cplx.)
RUN1
pKi= 6.3
739
6.3
2.0
103904873
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(5 Cplx.)
RUN2
pKi= 6.6
740
7.3
2.0
103904823
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(4 Cplx.)
RUN2
pKi= 7.5
741
5.8
2.0
103904527
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P3
:
(3 Cplx.)
RUN2
pKi= 5.8
742
7.7
2.0
103905247
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(3 Cplx.)
RUN0
pKi= 7.3
743
6.8
2.0
103904398
3D2I
(73%)
+
AK3_A_2
QMean=0.483
P1
:
(3 Cplx.)
RUN1
pKi= 8.8
744
7.4
2.0
103904195
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(8 Cplx.)
RUN1
pKi= 6.5
745
5.8
2.0
103905620
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(6 Cplx.)
RUN0
pKi= 5.5
746
9.3
2.0
103904321
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(8 Cplx.)
RUN1
pKi= 6
747
6.5
2.0
103904469
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(4 Cplx.)
RUN0
pKi= 5.4
748
6.4
2.0
103904947
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(13 Cplx.)
RUN1
pKi= 6.5
749
4.5
2.0
103905579
3EFW
(71%)
+
AK8_A_3
QMean=0.562
P3
:
(3 Cplx.)
RUN1
pKi= 5.4
750
7.8
2.0
103904712
1XJD
(32%)
+
STU_B_2
QMean=0.539
P2
:
(3 Cplx.)
RUN1
pKi= 5.5
751
7.8
2.0
103904367
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(4 Cplx.)
RUN2
pKi= 7.2
752
6.1
2.0
103905296
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN2
pKi= 6.1
753
7.8
2.0
103904678
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(4 Cplx.)
RUN1
pKi= 5.7
754
7.8
2.0
103905146
1XJD
(32%)
+
STU_B_2
QMean=0.539
P2
:
(4 Cplx.)
RUN2
pKi= 5.7
755
9.1
2.0
103905088
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(7 Cplx.)
RUN0
pKi= 9.1
756
5.3
2.0
103905209
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(5 Cplx.)
RUN1
pKi= 5.5
757
9.1
2.0
103905088
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(9 Cplx.)
RUN1
pKi= 9.1
758
6.4
2.0
103904342
3O51
(72%)
+
LJF_A_2
QMean=0.528
P1
:
(3 Cplx.)
RUN0
pKi= 6.4
759
6.1
2.0
103905032
3DJ5
(73%)
+
AK5_A_2
QMean=0.566
P1
:
(8 Cplx.)
RUN0
pKi= 5.9
760
5.4
2.0
103905552
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P2
:
(4 Cplx.)
RUN1
pKi= 6.3
761
8.0
2.0
103904752
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(5 Cplx.)
RUN1
pKi= 6.1
762
6.3
2.0
103904475
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN1
pKi= 5.6
763
8.0
2.0
103905541
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(5 Cplx.)
RUN2
pKi= 6
764
7.1
2.0
103905267
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN2
pKi= 5.3
765
8.2
2.0
103904511
3DJ5
(73%)
+
AK5_A_2
QMean=0.566
P1
:
(3 Cplx.)
RUN1
pKi= 7
766
6.5
2.0
103904514
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(3 Cplx.)
RUN2
pKi= 6.5
767
8.1
2.0
103904361
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(5 Cplx.)
RUN2
pKi= 7.3
768
6.1
2.0
103904653
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(17 Cplx.)
RUN1
pKi= 7.4
769
7.5
2.0
103904477
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(3 Cplx.)
RUN1
pKi= 5.2
770
7.3
2.0
103905246
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(4 Cplx.)
RUN1
pKi= 6.5
771
5.5
2.0
103905112
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P2
:
(4 Cplx.)
RUN0
pKi= 7.4
772
4.9
2.0
103905408
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(4 Cplx.)
RUN1
pKi= 7.8
773
7.2
2.0
103904513
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(4 Cplx.)
RUN2
pKi= 6.6
774
8.6
2.0
103904379
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(7 Cplx.)
RUN1
pKi= 6
775
4.0
2.0
103905521
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN2
pKi= 5.8
776
5.5
2.0
103904889
4JAJ
(71%)
+
XU1_A_2
QMean=0.500
P1
:
(9 Cplx.)
RUN0
pKi= 6.6
777
5.7
2.0
103904450
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(4 Cplx.)
RUN0
pKi= 6.5
778
6.1
2.0
103905522
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(7 Cplx.)
RUN1
pKi= 7.1
779
5.8
2.0
103904459
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(4 Cplx.)
RUN2
pKi= 5.8
780
6.0
2.0
103904545
3D15
(73%)
+
AK2_A_2
QMean=0.466
P2
:
(4 Cplx.)
RUN1
pKi= 5.4
781
6.1
2.0
103905105
2VRX
(77%)
+
447_B_6
QMean=0.387
P2
:
(3 Cplx.)
RUN1
pKi= 5.8
782
5.6
2.0
103905123
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(6 Cplx.)
RUN0
pKi= 4.6
783
5.6
2.0
103904469
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(3 Cplx.)
RUN2
pKi= 5.4
784
5.4
2.0
103905648
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(3 Cplx.)
RUN2
pKi= 8.3
785
6.7
2.0
103905095
3D14
(73%)
+
AK1_A_2
QMean=0.523
P2
:
(6 Cplx.)
RUN1
pKi= 7.1
786
5.7
2.0
103904820
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(11 Cplx.)
RUN2
pKi= 5.9
787
6.1
2.0
103904295
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(3 Cplx.)
RUN0
pKi= 7.9
788
8.3
2.0
103905061
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(8 Cplx.)
RUN1
pKi= 5.2
789
7.2
2.0
103904443
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(3 Cplx.)
RUN1
pKi= 8.5
790
7.3
2.0
103905531
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(4 Cplx.)
RUN1
pKi= 8.7
791
6.9
2.0
103904351
3EFW
(71%)
+
AK8_A_3
QMean=0.562
P1
:
(4 Cplx.)
RUN2
pKi= 8.4
792
5.7
2.0
103905108
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(7 Cplx.)
RUN2
pKi= 6.2
793
8.3
2.0
103905267
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(6 Cplx.)
RUN1
pKi= 5.3
794
7.4
2.0
103905019
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(4 Cplx.)
RUN0
pKi= 7.8
795
6.3
2.0
103905629
3H10
(72%)
+
97B_A_4
QMean=0.516
P2
:
(5 Cplx.)
RUN0
pKi= 7
796
6.5
2.0
103904700
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(4 Cplx.)
RUN0
pKi= 7.1
797
7.1
2.0
103904472
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P3
:
(3 Cplx.)
RUN0
pKi= 6.5
798
6.6
2.0
103905001
3EFW
(71%)
+
AK8_A_3
QMean=0.562
P1
:
(3 Cplx.)
RUN1
pKi= 6.2
799
5.9
2.0
103905271
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P1
:
(9 Cplx.)
RUN1
pKi= 6
800
7.4
2.0
103904701
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(4 Cplx.)
RUN2
pKi= 7.7
801
7.2
2.0
103905599
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(9 Cplx.)
RUN0
pKi= 5.6
802
5.5
2.0
103904950
4JAJ
(71%)
+
XU1_A_2
QMean=0.500
P1
:
(5 Cplx.)
RUN1
pKi= 6.8
803
7.6
2.0
103904359
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(5 Cplx.)
RUN1
pKi= 7.9
804
8.3
2.0
103905146
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(3 Cplx.)
RUN0
pKi= 5.7
805
6.6
2.0
103904339
3O51
(72%)
+
LJF_A_2
QMean=0.528
P2
:
(3 Cplx.)
RUN0
pKi= 6.5
806
6.3
2.0
103905389
1XJD
(32%)
+
STU_B_2
QMean=0.539
P2
:
(6 Cplx.)
RUN0
pKi= 5.6
807
6.9
2.0
103904551
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(4 Cplx.)
RUN2
pKi= 5.5
808
5.6
2.0
103904789
3R22
(72%)
+
D37_A_2
QMean=0.500
P2
:
(5 Cplx.)
RUN2
pKi= 5.9
809
6.1
2.0
103905271
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(8 Cplx.)
RUN2
pKi= 6
810
5.3
2.0
103905044
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P2
:
(5 Cplx.)
RUN2
pKi= 5.7
811
6.1
2.0
103904469
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P2
:
(3 Cplx.)
RUN1
pKi= 5.4
812
8.4
2.0
103904810
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(4 Cplx.)
RUN0
pKi= 6.4
813
6.2
2.0
103905574
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(5 Cplx.)
RUN1
pKi= 6.1
814
6.1
2.0
103905397
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(5 Cplx.)
RUN2
pKi= 6.3
815
6.5
2.0
103905273
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(5 Cplx.)
RUN1
pKi= 6.1
816
5.6
2.0
103904449
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(4 Cplx.)
RUN2
pKi= 6.3
817
7.2
2.0
103905560
3TXO
(34%)
+
07U_A_2
QMean=0.548
P1
:
(3 Cplx.)
RUN1
pKi= 6
818
5.6
2.0
103905221
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P2
:
(3 Cplx.)
RUN2
pKi= 5.2
819
6.5
2.0
103904864
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN0
pKi= 7.1
820
6.4
2.0
103904886
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(4 Cplx.)
RUN0
pKi= 5.6
821
7.9
2.0
103904361
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(3 Cplx.)
RUN0
pKi= 7.3
822
6.2
2.0
103904346
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P2
:
(4 Cplx.)
RUN1
pKi= 7.8
823
8.3
2.0
103904696
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(3 Cplx.)
RUN2
pKi= 7.7
824
6.2
2.0
103904671
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P3
:
(3 Cplx.)
RUN1
pKi= 5.5
825
6.2
2.0
103904370
3O51
(72%)
+
LJF_A_2
QMean=0.528
P1
:
(3 Cplx.)
RUN0
pKi= 7.3
826
6.4
2.0
103905339
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(4 Cplx.)
RUN2
pKi= 6.1
827
6.1
2.0
103904863
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(5 Cplx.)
RUN1
pKi= 6.5
828
5.5
2.0
103904357
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(5 Cplx.)
RUN2
pKi= 6.7
829
7.5
2.0
103905684
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(5 Cplx.)
RUN0
pKi= 7.2
830
6.6
2.0
103905472
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(4 Cplx.)
RUN1
pKi= 5.6
831
6.8
2.0
103905066
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(3 Cplx.)
RUN1
pKi= 5.5
832
6.4
2.0
103904204
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P2
:
(4 Cplx.)
RUN0
pKi= 6
833
7.9
2.0
103904358
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN0
pKi= 6
834
5.3
2.0
103905192
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(9 Cplx.)
RUN0
pKi= 5.2
835
6.9
2.0
103905591
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(3 Cplx.)
RUN1
pKi= 6.8
836
7.2
2.0
103905276
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(3 Cplx.)
RUN0
pKi= 5.8
837
6.9
2.0
103905570
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(4 Cplx.)
RUN1
pKi= 6.4
838
7.6
2.0
103905674
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(3 Cplx.)
RUN2
pKi= 6.1
839
8.5
2.0
103904287
3D14
(73%)
+
AK1_A_2
QMean=0.523
P3
:
(3 Cplx.)
RUN0
pKi= 8.4
840
7.3
2.0
103905247
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(4 Cplx.)
RUN1
pKi= 7.3
841
7.2
2.0
103904206
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(3 Cplx.)
RUN1
pKi= 6.1
842
5.5
2.0
103904987
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN1
pKi= 5.4
843
7.0
2.0
103904489
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(4 Cplx.)
RUN0
pKi= 5.7
844
6.8
2.0
103904818
3R22
(72%)
+
D37_A_2
QMean=0.500
P1
:
(3 Cplx.)
RUN1
pKi= 6.8
845
5.6
2.0
103905317
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN2
pKi= 5.5
846
6.6
2.0
103905539
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P2
:
(3 Cplx.)
RUN2
pKi= 8.1
847
7.2
2.0
103904822
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(4 Cplx.)
RUN1
pKi= 7.6
848
6.3
2.0
103904925
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(13 Cplx.)
RUN1
pKi= 5.6
849
7.0
2.0
103905007
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(3 Cplx.)
RUN1
pKi= 5.3
850
5.8
2.0
103905006
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(5 Cplx.)
RUN1
pKi= 6.2
851
6.5
2.0
103905009
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(7 Cplx.)
RUN1
pKi= 6.5
852
6.3
2.0
103905077
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(3 Cplx.)
RUN2
pKi= 6.7
853
6.0
2.0
103905489
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(6 Cplx.)
RUN1
pKi= 7.3
854
7.3
2.0
103904822
1XJD
(32%)
+
STU_B_2
QMean=0.539
P1
:
(6 Cplx.)
RUN0
pKi= 7.6
855
9.1
2.0
103904302
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(5 Cplx.)
RUN2
pKi= 7.8
856
9.1
2.0
103905204
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(4 Cplx.)
RUN1
pKi= 5.7
857
6.6
2.0
103904526
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(6 Cplx.)
RUN0
pKi= 6.4
858
6.2
2.1
103904564
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN1
pKi= 5.7
859
6.5
2.1
103904947
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(15 Cplx.)
RUN0
pKi= 6.5
860
9.0
2.1
103905088
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(6 Cplx.)
RUN2
pKi= 9.1
861
6.5
2.1
103904214
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(10 Cplx.)
RUN0
pKi= 6.4
862
5.9
2.1
103904543
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(7 Cplx.)
RUN0
pKi= 5.6
863
8.2
2.1
103904462
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(3 Cplx.)
RUN0
pKi= 7.4
864
6.7
2.1
103905077
2VRX
(77%)
+
447_B_6
QMean=0.387
P1
:
(5 Cplx.)
RUN0
pKi= 6.7
865
7.2
2.1
103904349
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(6 Cplx.)
RUN2
pKi= 7.7
866
8.3
2.1
103904698
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(3 Cplx.)
RUN0
pKi= 7.4
867
5.4
2.1
103905503
3R22
(72%)
+
D37_A_2
QMean=0.500
P2
:
(3 Cplx.)
RUN1
pKi= 5.9
868
8.8
2.1
103905061
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(5 Cplx.)
RUN2
pKi= 5.2
869
6.4
2.1
103905014
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P2
:
(5 Cplx.)
RUN1
pKi= 7.5
870
6.1
2.1
103905522
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(7 Cplx.)
RUN2
pKi= 7.1
871
7.5
2.1
103905603
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P2
:
(3 Cplx.)
RUN2
pKi= 7.6
872
5.3
2.1
103905041
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(5 Cplx.)
RUN1
pKi= 5.8
873
7.5
2.1
103904856
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P2
:
(3 Cplx.)
RUN1
pKi= 7.1
874
5.8
2.1
103905443
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(8 Cplx.)
RUN1
pKi= 6.2
875
5.8
2.1
103905079
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(4 Cplx.)
RUN1
pKi= 5.3
876
8.1
2.1
103905346
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(3 Cplx.)
RUN2
pKi= 8.3
877
6.3
2.1
103905488
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P2
:
(4 Cplx.)
RUN1
pKi= 7.3
878
10.7
2.1
103904270
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN1
pKi= 6
879
6.6
2.1
103905668
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN0
pKi= 6.6
880
5.5
2.1
103905116
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(6 Cplx.)
RUN2
pKi= 7.6
881
5.8
2.1
103904963
2VRX
(77%)
+
447_B_6
QMean=0.387
P1
:
(8 Cplx.)
RUN1
pKi= 5.8
882
9.1
2.1
103904282
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(3 Cplx.)
RUN1
pKi= 8
883
6.4
2.1
103905237
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(4 Cplx.)
RUN1
pKi= 5.2
884
6.3
2.1
103904359
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(3 Cplx.)
RUN0
pKi= 7.9
885
5.3
2.1
103905041
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(5 Cplx.)
RUN2
pKi= 5.8
886
6.2
2.1
103905522
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(3 Cplx.)
RUN0
pKi= 7.1
887
6.0
2.1
103905077
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(6 Cplx.)
RUN1
pKi= 6.7
888
9.8
2.1
103904289
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN0
pKi= 6.9
889
6.1
2.1
103904926
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(4 Cplx.)
RUN1
pKi= 6
890
7.2
2.1
103904738
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(5 Cplx.)
RUN1
pKi= 6.7
891
6.7
2.1
103905026
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(3 Cplx.)
RUN2
pKi= 6.2
892
7.9
2.1
103904991
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(5 Cplx.)
RUN2
pKi= 6.4
893
6.6
2.1
103905618
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(7 Cplx.)
RUN1
pKi= 6.7
894
8.2
2.1
103904791
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P1
:
(5 Cplx.)
RUN1
pKi= 8
895
5.9
2.1
103905078
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P2
:
(3 Cplx.)
RUN1
pKi= 6.2
896
6.0
2.1
103905614
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(7 Cplx.)
RUN0
pKi= 6
897
7.3
2.1
103905339
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(9 Cplx.)
RUN1
pKi= 6.1
898
6.6
2.1
103905276
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(5 Cplx.)
RUN1
pKi= 5.8
899
5.9
2.1
103905543
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(3 Cplx.)
RUN2
pKi= 5.9
900
5.7
2.1
103904957
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P2
:
(3 Cplx.)
RUN1
pKi= 5.2
901
7.0
2.1
103904813
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN1
pKi= 6.3
902
7.5
2.1
103904741
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(3 Cplx.)
RUN2
pKi= 6.9
903
5.8
2.1
103904964
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(3 Cplx.)
RUN2
pKi= 7.1
904
5.3
2.1
103905049
2VRX
(77%)
+
447_B_6
QMean=0.387
P2
:
(3 Cplx.)
RUN2
pKi= 5.7
905
8.3
2.1
103904443
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(4 Cplx.)
RUN2
pKi= 8.5
906
6.8
2.1
103905019
3R22
(72%)
+
D37_A_2
QMean=0.500
P2
:
(3 Cplx.)
RUN2
pKi= 7.8
907
6.6
2.1
103905525
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(3 Cplx.)
RUN0
pKi= 7.1
908
5.3
2.1
103905425
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(8 Cplx.)
RUN1
pKi= 5.7
909
6.3
2.1
103904820
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(8 Cplx.)
RUN0
pKi= 5.9
910
6.2
2.1
103905021
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(4 Cplx.)
RUN1
pKi= 7.7
911
5.4
2.1
103905008
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(6 Cplx.)
RUN1
pKi= 5.2
912
5.8
2.1
103905269
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(6 Cplx.)
RUN1
pKi= 6
913
7.4
2.1
103905496
3O51
(72%)
+
LJF_A_2
QMean=0.528
P2
:
(4 Cplx.)
RUN2
pKi= 5.3
914
6.1
2.1
103904204
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(6 Cplx.)
RUN1
pKi= 6
915
6.4
2.1
103904487
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P2
:
(5 Cplx.)
RUN2
pKi= 5.9
916
4.2
2.1
103905040
4JAJ
(71%)
+
XU1_A_2
QMean=0.500
P2
:
(5 Cplx.)
RUN2
pKi= 4.5
917
8.8
2.1
103904272
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(6 Cplx.)
RUN2
pKi= 9.1
918
7.0
2.1
103905020
3R21
(72%)
+
D36_A_2
QMean=0.473
P2
:
(3 Cplx.)
RUN0
pKi= 7.6
919
4.3
2.1
103905203
2W1D
(72%)
+
L0D_A_2
QMean=0.515
P2
:
(7 Cplx.)
RUN1
pKi= 4.8
920
8.5
2.1
103904603
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(11 Cplx.)
RUN2
pKi= 7.1
921
5.5
2.1
103904908
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN2
pKi= 5.5
922
8.4
2.1
103904324
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(4 Cplx.)
RUN1
pKi= 8.6
923
6.2
2.1
103904642
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(6 Cplx.)
RUN2
pKi= 6.1
924
5.9
2.1
103904449
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(5 Cplx.)
RUN0
pKi= 6.3
925
7.0
2.1
103904551
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(5 Cplx.)
RUN0
pKi= 5.5
926
4.5
2.1
103904956
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN2
pKi= 5.2
927
5.6
2.1
103904889
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(9 Cplx.)
RUN2
pKi= 6.6
928
6.2
2.1
103905587
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(4 Cplx.)
RUN2
pKi= 6
929
5.5
2.1
103905407
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(9 Cplx.)
RUN2
pKi= 6.2
930
7.3
2.1
103905092
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(6 Cplx.)
RUN1
pKi= 7.3
931
8.0
2.1
103905183
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(5 Cplx.)
RUN2
pKi= 5.6
932
5.4
2.1
103905371
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P2
:
(3 Cplx.)
RUN1
pKi= 5.6
933
5.9
2.1
103904950
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(3 Cplx.)
RUN0
pKi= 6.8
934
6.9
2.1
103904518
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(4 Cplx.)
RUN0
pKi= 6.3
935
7.0
2.1
103905558
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P1
:
(3 Cplx.)
RUN0
pKi= 7.3
936
5.2
2.1
103904211
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P2
:
(4 Cplx.)
RUN2
pKi= 5.3
937
5.0
2.1
103905605
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P3
:
(4 Cplx.)
RUN2
pKi= 6.3
938
5.0
2.1
103905284
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(10 Cplx.)
RUN0
pKi= 6.5
939
7.1
2.1
103904189
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(3 Cplx.)
RUN1
pKi= 6.3
940
6.7
2.1
103904275
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P1
:
(3 Cplx.)
RUN2
pKi= 7.7
941
7.7
2.1
103904195
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(14 Cplx.)
RUN0
pKi= 6.5
942
6.0
2.1
103904884
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(5 Cplx.)
RUN2
pKi= 5.8
943
6.8
2.1
103905604
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P2
:
(4 Cplx.)
RUN2
pKi= 6.1
944
8.9
2.1
103904269
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(6 Cplx.)
RUN0
pKi= 8.1
945
6.7
2.1
103905001
4DED
(71%)
+
NHU_A_2
QMean=0.467
P2
:
(3 Cplx.)
RUN2
pKi= 6.2
946
6.8
2.1
103905246
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(3 Cplx.)
RUN0
pKi= 6.5
947
6.1
2.1
103904702
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN2
pKi= 8
948
4.9
2.1
103905203
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(10 Cplx.)
RUN0
pKi= 4.8
949
7.8
2.1
103904330
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN0
pKi= 7.5
950
5.1
2.1
103904482
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P3
:
(3 Cplx.)
RUN2
pKi= 5.8
951
8.9
2.1
103904321
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(5 Cplx.)
RUN0
pKi= 6
952
5.5
2.1
103904518
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(3 Cplx.)
RUN1
pKi= 6.3
953
6.5
2.1
103905490
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P1
:
(3 Cplx.)
RUN0
pKi= 7
954
7.0
2.1
103904690
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(3 Cplx.)
RUN1
pKi= 6.4
955
6.5
2.1
103904999
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(3 Cplx.)
RUN2
pKi= 7.4
956
4.9
2.1
103905208
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(4 Cplx.)
RUN1
pKi= 5.4
957
6.0
2.1
103905590
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(6 Cplx.)
RUN0
pKi= 7.2
958
7.8
2.1
103904479
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN2
pKi= 6.7
959
6.0
2.1
103905085
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P2
:
(6 Cplx.)
RUN1
pKi= 6.2
960
6.0
2.1
103905234
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(5 Cplx.)
RUN1
pKi= 5.8
961
8.0
2.1
103904992
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(3 Cplx.)
RUN0
pKi= 6
962
5.8
2.1
103904859
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(3 Cplx.)
RUN2
pKi= 6.6
963
6.8
2.1
103904275
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P2
:
(3 Cplx.)
RUN0
pKi= 7.7
964
7.3
2.2
103905076
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P2
:
(3 Cplx.)
RUN2
pKi= 6.7
965
6.5
2.2
103905395
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(4 Cplx.)
RUN2
pKi= 6.8
966
4.8
2.2
103905115
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(3 Cplx.)
RUN0
pKi= 7.5
967
6.5
2.2
103904567
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(3 Cplx.)
RUN2
pKi= 6.8
968
8.8
2.2
103904603
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(4 Cplx.)
RUN0
pKi= 7.1
969
5.8
2.2
103905443
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN0
pKi= 6.2
970
7.1
2.2
103904465
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(6 Cplx.)
RUN1
pKi= 7.3
971
7.1
2.2
103905001
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(3 Cplx.)
RUN0
pKi= 6.2
972
6.3
2.2
103905535
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(14 Cplx.)
RUN1
pKi= 6.6
973
7.6
2.2
103905066
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(6 Cplx.)
RUN0
pKi= 5.5
974
7.0
2.2
103904815
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P2
:
(4 Cplx.)
RUN0
pKi= 6.3
975
5.6
2.2
103904798
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P2
:
(4 Cplx.)
RUN0
pKi= 5.3
976
6.4
2.2
103905604
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P3
:
(3 Cplx.)
RUN0
pKi= 6.1
977
4.3
2.2
103905519
3D2I
(73%)
+
AK3_A_2
QMean=0.483
P2
:
(5 Cplx.)
RUN0
pKi= 4.1
978
5.1
2.2
103905192
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(11 Cplx.)
RUN2
pKi= 5.2
979
5.6
2.2
103905119
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(3 Cplx.)
RUN1
pKi= 7.5
980
6.9
2.2
103905273
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(4 Cplx.)
RUN2
pKi= 6.1
981
5.2
2.2
103904957
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(7 Cplx.)
RUN2
pKi= 5.2
982
7.1
2.2
103904514
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(3 Cplx.)
RUN1
pKi= 6.5
983
6.7
2.2
103904342
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(5 Cplx.)
RUN2
pKi= 6.4
984
6.8
2.2
103905520
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN1
pKi= 7.1
985
5.8
2.2
103905407
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(8 Cplx.)
RUN1
pKi= 6.2
986
6.9
2.2
103905392
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(9 Cplx.)
RUN1
pKi= 5.8
987
6.0
2.2
103905108
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(7 Cplx.)
RUN1
pKi= 6.2
988
5.7
2.2
103905576
3R21
(72%)
+
D36_A_2
QMean=0.473
P3
:
(3 Cplx.)
RUN0
pKi= 5.7
989
6.9
2.2
103904216
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(4 Cplx.)
RUN1
pKi= 6.5
990
7.5
2.2
103904953
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(5 Cplx.)
RUN2
pKi= 8.4
991
7.6
2.2
103904744
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P2
:
(3 Cplx.)
RUN0
pKi= 5.4
992
5.7
2.2
103905087
3TXO
(34%)
+
07U_A_2
QMean=0.548
P3
:
(3 Cplx.)
RUN1
pKi= 5.6
993
4.9
2.2
103905608
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(3 Cplx.)
RUN1
pKi= 7.8
994
5.5
2.2
103904458
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(8 Cplx.)
RUN2
pKi= 5.5
995
6.0
2.2
103904987
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(4 Cplx.)
RUN0
pKi= 5.4
996
5.2
2.2
103905605
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P2
:
(6 Cplx.)
RUN1
pKi= 6.3
997
6.4
2.2
103904204
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P1
:
(4 Cplx.)
RUN2
pKi= 6
998
5.5
2.2
103904642
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(4 Cplx.)
RUN1
pKi= 6.1
999
7.6
2.2
103904367
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN0
pKi= 7.2
1000
5.3
2.2
103905396
2VRX
(77%)
+
447_B_6
QMean=0.387
P3
:
(3 Cplx.)
RUN2
pKi= 6.9
1001
6.0
2.2
103904329
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P2
:
(5 Cplx.)
RUN2
pKi= 8
1002
6.1
2.2
103905641
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P2
:
(4 Cplx.)
RUN1
pKi= 5.9
1003
9.2
2.2
103904319
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN2
pKi= 8
1004
6.2
2.2
103905368
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(10 Cplx.)
RUN2
pKi= 6.2
1005
6.1
2.2
103905317
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(3 Cplx.)
RUN0
pKi= 5.5
1006
4.3
2.2
103905519
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(11 Cplx.)
RUN1
pKi= 4.1
1007
5.9
2.2
103904891
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN1
pKi= 7.9
1008
6.4
2.2
103904925
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(12 Cplx.)
RUN2
pKi= 5.6
1009
6.8
2.2
103904855
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(3 Cplx.)
RUN1
pKi= 6.9
1010
6.5
2.2
103905490
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(4 Cplx.)
RUN2
pKi= 7
1011
6.6
2.2
103905009
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(5 Cplx.)
RUN2
pKi= 6.5
1012
6.2
2.2
103904398
4DED
(71%)
+
NHU_A_2
QMean=0.467
P2
:
(4 Cplx.)
RUN2
pKi= 8.8
1013
7.0
2.2
103904701
3H10
(72%)
+
97B_A_4
QMean=0.516
P1
:
(5 Cplx.)
RUN1
pKi= 7.7
1014
7.7
2.2
103904726
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(5 Cplx.)
RUN1
pKi= 5.8
1015
5.0
2.2
103905636
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(6 Cplx.)
RUN1
pKi= 6
1016
7.0
2.2
103905577
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P2
:
(3 Cplx.)
RUN0
pKi= 5.3
1017
6.4
2.2
103904864
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(7 Cplx.)
RUN2
pKi= 7.1
1018
7.3
2.2
103904689
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(4 Cplx.)
RUN0
pKi= 5.3
1019
7.4
2.2
103905033
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(3 Cplx.)
RUN1
pKi= 6.8
1020
7.4
2.2
103904270
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN0
pKi= 6
1021
6.4
2.2
103904472
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(3 Cplx.)
RUN2
pKi= 6.5
1022
6.2
2.2
103904736
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(10 Cplx.)
RUN0
pKi= 6
1023
5.8
2.2
103905263
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(3 Cplx.)
RUN2
pKi= 6
1024
6.8
2.2
103905263
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN1
pKi= 6
1025
8.2
2.2
103904300
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P2
:
(3 Cplx.)
RUN0
pKi= 8.6
1026
6.1
2.2
103905229
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P2
:
(6 Cplx.)
RUN2
pKi= 4.6
1027
7.3
2.2
103905092
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(7 Cplx.)
RUN2
pKi= 7.3
1028
7.6
2.2
103905488
3O51
(72%)
+
LJF_A_2
QMean=0.528
P2
:
(3 Cplx.)
RUN0
pKi= 7.3
1029
6.1
2.2
103905229
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(7 Cplx.)
RUN1
pKi= 4.6
1030
6.3
2.2
103905301
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN2
pKi= 5.5
1031
6.9
2.2
103904823
3R22
(72%)
+
D37_A_2
QMean=0.500
P1
:
(3 Cplx.)
RUN0
pKi= 7.5
1032
6.8
2.2
103904653
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(11 Cplx.)
RUN0
pKi= 7.4
1033
8.6
2.2
103904443
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P2
:
(3 Cplx.)
RUN0
pKi= 8.5
1034
8.6
2.2
103904285
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(6 Cplx.)
RUN1
pKi= 8.3
1035
6.4
2.2
103904947
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(12 Cplx.)
RUN2
pKi= 6.5
1036
6.9
2.2
103904997
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(3 Cplx.)
RUN0
pKi= 7.3
1037
5.8
2.2
103904809
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P2
:
(6 Cplx.)
RUN1
pKi= 6.3
1038
7.1
2.2
103905247
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(3 Cplx.)
RUN2
pKi= 7.3
1039
6.8
2.2
103904560
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN2
pKi= 5.8
1040
7.2
2.2
103904740
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(4 Cplx.)
RUN2
pKi= 6
1041
6.9
2.2
103905302
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(6 Cplx.)
RUN1
pKi= 5.3
1042
6.6
2.2
103905641
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(7 Cplx.)
RUN2
pKi= 5.9
1043
5.4
2.2
103904987
3COH
(72%)
+
83H_A_3
QMean=0.518
P3
:
(3 Cplx.)
RUN2
pKi= 5.4
1044
6.5
2.2
103905301
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN1
pKi= 5.5
1045
7.4
2.2
103904708
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(5 Cplx.)
RUN0
pKi= 5.5
1046
6.9
2.2
103905000
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(3 Cplx.)
RUN1
pKi= 5.7
1047
5.5
2.2
103904964
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(3 Cplx.)
RUN1
pKi= 7.1
1048
5.5
2.2
103904211
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(3 Cplx.)
RUN0
pKi= 5.3
1049
6.8
2.2
103904686
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(3 Cplx.)
RUN0
pKi= 6.6
1050
6.0
2.2
103905085
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(9 Cplx.)
RUN0
pKi= 6.2
1051
7.7
2.2
103905245
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(3 Cplx.)
RUN0
pKi= 7.4
1052
5.8
2.2
103904908
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(3 Cplx.)
RUN1
pKi= 5.5
1053
4.6
2.2
103905667
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(5 Cplx.)
RUN2
pKi= 6.3
1054
5.4
2.2
103905221
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P3
:
(3 Cplx.)
RUN1
pKi= 5.2
1055
7.7
2.2
103904713
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(6 Cplx.)
RUN0
pKi= 5.9
1056
6.2
2.2
103905087
2VRX
(77%)
+
447_B_6
QMean=0.387
P2
:
(4 Cplx.)
RUN2
pKi= 5.6
1057
6.1
2.2
103905618
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P3
:
(3 Cplx.)
RUN2
pKi= 6.7
1058
7.4
2.2
103905339
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(7 Cplx.)
RUN0
pKi= 6.1
1059
5.7
2.2
103905042
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN2
pKi= 5.7
1060
7.0
2.2
103904836
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(3 Cplx.)
RUN1
pKi= 6.1
1061
5.6
2.2
103904634
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(9 Cplx.)
RUN2
pKi= 5.2
1062
7.3
2.2
103905095
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(11 Cplx.)
RUN0
pKi= 7.1
1063
8.0
2.2
103904991
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(3 Cplx.)
RUN0
pKi= 6.4
1064
7.2
2.2
103905092
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(8 Cplx.)
RUN0
pKi= 7.3
1065
6.0
2.2
103905487
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(5 Cplx.)
RUN0
pKi= 5.2
1066
5.7
2.2
103904950
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P2
:
(3 Cplx.)
RUN2
pKi= 6.8
1067
7.9
2.2
103904444
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(3 Cplx.)
RUN1
pKi= 6.7
1068
6.2
2.2
103904814
3D15
(73%)
+
AK2_A_2
QMean=0.466
P2
:
(3 Cplx.)
RUN0
pKi= 6
1069
7.4
2.2
103904369
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P2
:
(3 Cplx.)
RUN0
pKi= 6.5
1070
6.7
2.2
103904699
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P2
:
(3 Cplx.)
RUN0
pKi= 7.3
1071
5.7
2.2
103904211
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(7 Cplx.)
RUN1
pKi= 5.3
1072
6.3
2.2
103904348
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(4 Cplx.)
RUN1
pKi= 7.5
1073
8.6
2.2
103904792
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(4 Cplx.)
RUN1
pKi= 8.1
1074
3.8
2.2
103905412
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P2
:
(6 Cplx.)
RUN2
pKi= 4.5
1075
4.9
2.2
103905667
3D2I
(73%)
+
AK3_A_2
QMean=0.483
P1
:
(4 Cplx.)
RUN0
pKi= 6.3
1076
5.6
2.2
103904686
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(4 Cplx.)
RUN1
pKi= 6.6
1077
7.3
2.2
103905649
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN2
pKi= 6.7
1078
6.3
2.2
103904857
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN0
pKi= 8.1
1079
6.1
2.2
103904926
3UP7
(71%)
+
0C9_A_2
QMean=0.451
P1
:
(4 Cplx.)
RUN2
pKi= 6
1080
6.9
2.2
103905338
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(4 Cplx.)
RUN0
pKi= 5.6
1081
6.2
2.2
103905079
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P2
:
(3 Cplx.)
RUN0
pKi= 5.3
1082
6.5
2.2
103904361
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(6 Cplx.)
RUN1
pKi= 7.3
1083
6.8
2.3
103905577
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P2
:
(3 Cplx.)
RUN2
pKi= 5.3
1084
7.0
2.3
103904560
3D14
(73%)
+
AK1_A_2
QMean=0.523
P2
:
(5 Cplx.)
RUN0
pKi= 5.8
1085
5.7
2.3
103905446
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(4 Cplx.)
RUN0
pKi= 6.1
1086
4.9
2.3
103904884
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P3
:
(3 Cplx.)
RUN1
pKi= 5.8
1087
6.1
2.3
103905229
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(8 Cplx.)
RUN0
pKi= 4.6
1088
3.8
2.3
103904442
2W1D
(72%)
+
L0D_A_2
QMean=0.515
P1
:
(6 Cplx.)
RUN2
pKi= 4.7
1089
5.9
2.3
103905190
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(7 Cplx.)
RUN1
pKi= 5.7
1090
5.9
2.3
103904691
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(5 Cplx.)
RUN1
pKi= 5.5
1091
6.2
2.3
103905000
3H10
(72%)
+
97B_A_4
QMean=0.516
P3
:
(3 Cplx.)
RUN2
pKi= 5.7
1092
7.2
2.3
103905496
3O51
(72%)
+
LJF_A_2
QMean=0.528
P1
:
(4 Cplx.)
RUN1
pKi= 5.3
1093
6.8
2.3
103904788
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(3 Cplx.)
RUN2
pKi= 8
1094
8.0
2.3
103904474
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(3 Cplx.)
RUN0
pKi= 5.2
1095
5.9
2.3
103905509
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(5 Cplx.)
RUN0
pKi= 6
1096
7.5
2.3
103904401
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(4 Cplx.)
RUN0
pKi= 8.9
1097
7.8
2.3
103905245
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(6 Cplx.)
RUN2
pKi= 7.4
1098
4.3
2.3
103905040
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(9 Cplx.)
RUN1
pKi= 4.5
1099
7.4
2.3
103904726
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P2
:
(3 Cplx.)
RUN2
pKi= 5.8
1100
5.9
2.3
103904963
2VRX
(77%)
+
447_B_6
QMean=0.387
P1
:
(9 Cplx.)
RUN2
pKi= 5.8
1101
8.2
2.3
103904400
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(3 Cplx.)
RUN2
pKi= 8.5
1102
5.7
2.3
103904449
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(4 Cplx.)
RUN1
pKi= 6.3
1103
8.1
2.3
103904817
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(6 Cplx.)
RUN0
pKi= 7
1104
6.3
2.3
103904998
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(4 Cplx.)
RUN1
pKi= 6.3
1105
4.7
2.3
103905291
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P2
:
(5 Cplx.)
RUN1
pKi= 5.2
1106
5.4
2.3
103904659
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P1
:
(3 Cplx.)
RUN2
pKi= 5.8
1107
7.7
2.3
103905464
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(3 Cplx.)
RUN0
pKi= 5.6
1108
5.8
2.3
103904963
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(9 Cplx.)
RUN0
pKi= 5.8
1109
7.4
2.3
103904295
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN2
pKi= 7.9
1110
5.5
2.3
103905581
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(5 Cplx.)
RUN0
pKi= 6.6
1111
7.8
2.3
103904274
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(3 Cplx.)
RUN2
pKi= 8.6
1112
5.4
2.3
103905354
2VRX
(77%)
+
447_B_6
QMean=0.387
P1
:
(4 Cplx.)
RUN1
pKi= 5.5
1113
8.2
2.3
103904792
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(3 Cplx.)
RUN2
pKi= 8.1
1114
5.5
2.3
103905573
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(6 Cplx.)
RUN1
pKi= 6.3
1115
7.3
2.3
103905034
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P2
:
(3 Cplx.)
RUN0
pKi= 6.9
1116
6.6
2.3
103904999
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(3 Cplx.)
RUN1
pKi= 7.4
1117
7.2
2.3
103905578
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P2
:
(4 Cplx.)
RUN0
pKi= 5.6
1118
5.9
2.3
103905108
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(3 Cplx.)
RUN0
pKi= 6.2
1119
6.1
2.3
103905016
3TXO
(34%)
+
07U_A_2
QMean=0.548
P3
:
(3 Cplx.)
RUN1
pKi= 8
1120
6.4
2.3
103905397
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(11 Cplx.)
RUN1
pKi= 6.3
1121
6.3
2.3
103904702
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(3 Cplx.)
RUN1
pKi= 8
1122
7.6
2.3
103904706
1XJD
(32%)
+
STU_B_2
QMean=0.539
P1
:
(4 Cplx.)
RUN1
pKi= 5.6
1123
7.5
2.3
103904297
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(5 Cplx.)
RUN0
pKi= 8.1
1124
5.6
2.3
103905265
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(3 Cplx.)
RUN1
pKi= 5.4
1125
7.5
2.3
103904602
3UO6
(71%)
+
0BY_A_3
QMean=0.516
P1
:
(3 Cplx.)
RUN2
pKi= 7.2
1126
6.9
2.3
103904346
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN0
pKi= 7.8
1127
6.4
2.3
103905535
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(10 Cplx.)
RUN2
pKi= 6.6
1128
8.1
2.3
103904740
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(5 Cplx.)
RUN1
pKi= 6
1129
6.3
2.3
103905151
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(3 Cplx.)
RUN2
pKi= 5.7
1130
7.6
2.3
103905018
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(3 Cplx.)
RUN2
pKi= 8.2
1131
6.9
2.3
103905015
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(7 Cplx.)
RUN2
pKi= 8
1132
6.2
2.3
103904692
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(4 Cplx.)
RUN0
pKi= 5.7
1133
7.2
2.3
103904645
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(4 Cplx.)
RUN0
pKi= 6
1134
5.4
2.3
103904379
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P2
:
(4 Cplx.)
RUN2
pKi= 6
1135
8.1
2.3
103904393
3O50
(72%)
+
LJE_B_4
QMean=0.515
P1
:
(4 Cplx.)
RUN0
pKi= 8
1136
4.6
2.3
103905519
3DJ6
(73%)
+
AK6_A_2
QMean=0.551
P1
:
(12 Cplx.)
RUN2
pKi= 4.1
1137
7.3
2.3
103905017
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(5 Cplx.)
RUN1
pKi= 8.2
1138
6.3
2.3
103904952
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(3 Cplx.)
RUN1
pKi= 5.9
1139
7.1
2.3
103904370
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(4 Cplx.)
RUN1
pKi= 7.3
1140
6.1
2.3
103904545
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(5 Cplx.)
RUN2
pKi= 5.4
1141
5.2
2.3
103905209
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN2
pKi= 5.5
1142
6.6
2.3
103905603
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(3 Cplx.)
RUN1
pKi= 7.6
1143
8.8
2.3
103905567
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(4 Cplx.)
RUN1
pKi= 5.7
1144
6.2
2.3
103904192
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(3 Cplx.)
RUN2
pKi= 6.5
1145
5.9
2.3
103904692
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(7 Cplx.)
RUN1
pKi= 5.7
1146
5.1
2.3
103905620
3O51
(72%)
+
LJF_A_2
QMean=0.528
P1
:
(5 Cplx.)
RUN1
pKi= 5.5
1147
7.5
2.3
103904360
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(3 Cplx.)
RUN0
pKi= 6.9
1148
5.9
2.3
103905295
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(7 Cplx.)
RUN0
pKi= 4.5
1149
5.8
2.3
103904691
2W1D
(72%)
+
L0D_A_2
QMean=0.515
P1
:
(4 Cplx.)
RUN2
pKi= 5.5
1150
7.8
2.3
103904279
3O50
(72%)
+
LJE_B_4
QMean=0.515
P2
:
(3 Cplx.)
RUN1
pKi= 7.9
1151
7.6
2.3
103905022
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(4 Cplx.)
RUN1
pKi= 8.4
1152
5.6
2.3
103905052
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(7 Cplx.)
RUN1
pKi= 5.4
1153
6.1
2.3
103904988
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(4 Cplx.)
RUN2
pKi= 5.4
1154
4.8
2.3
103905528
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(19 Cplx.)
RUN2
pKi= 5.8
1155
6.7
2.3
103904922
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(5 Cplx.)
RUN0
pKi= 5.2
1156
6.1
2.3
103905109
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(7 Cplx.)
RUN0
pKi= 7.1
1157
6.2
2.3
103904677
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(4 Cplx.)
RUN1
pKi= 6.1
1158
6.9
2.3
103905575
2WTW
(71%)
+
ZZL_A_2
QMean=0.499
P1
:
(6 Cplx.)
RUN1
pKi= 5.8
1159
7.2
2.3
103905489
2X6E
(70%)
+
YM4_A_2
QMean=0.475
P1
:
(5 Cplx.)
RUN2
pKi= 7.3
1160
6.1
2.3
103905617
3H10
(72%)
+
97B_A_4
QMean=0.516
P2
:
(3 Cplx.)
RUN0
pKi= 6.7
1161
4.9
2.3
103905353
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(4 Cplx.)
RUN0
pKi= 4.2
1162
7.1
2.3
103904713
3DJ5
(73%)
+
AK5_A_2
QMean=0.566
P1
:
(6 Cplx.)
RUN2
pKi= 5.9
1163
7.2
2.3
103905574
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(4 Cplx.)
RUN0
pKi= 6.1
1164
7.6
2.3
103905076
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(5 Cplx.)
RUN0
pKi= 6.7
1165
6.1
2.3
103904882
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN0
pKi= 5.3
1166
6.3
2.3
103905618
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(3 Cplx.)
RUN0
pKi= 6.7
1167
5.5
2.3
103905042
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P3
:
(3 Cplx.)
RUN1
pKi= 5.7
1168
8.4
2.4
103904273
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(4 Cplx.)
RUN1
pKi= 9
1169
5.1
2.4
103904809
3COH
(72%)
+
83H_A_3
QMean=0.518
P2
:
(4 Cplx.)
RUN2
pKi= 6.3
1170
7.7
2.4
103904387
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(3 Cplx.)
RUN0
pKi= 7.8
1171
7.1
2.4
103905016
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P3
:
(4 Cplx.)
RUN0
pKi= 8
1172
6.9
2.4
103904515
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P1
:
(3 Cplx.)
RUN1
pKi= 6.9
1173
6.4
2.4
103904337
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN0
pKi= 7.4
1174
5.8
2.4
103904685
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P1
:
(8 Cplx.)
RUN1
pKi= 6
1175
7.2
2.4
103905393
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(9 Cplx.)
RUN0
pKi= 5.9
1176
8.2
2.4
103905642
3QBN
(71%)
+
E9Z_A_2
QMean=0.475
P1
:
(3 Cplx.)
RUN0
pKi= 5.9
1177
6.8
2.4
103905096
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(5 Cplx.)
RUN1
pKi= 7.1
1178
6.2
2.4
103904951
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(3 Cplx.)
RUN1
pKi= 5.2
1179
8.3
2.4
103904796
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P1
:
(7 Cplx.)
RUN1
pKi= 7.4
1180
5.3
2.4
103905319
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P2
:
(3 Cplx.)
RUN0
pKi= 6.6
1181
5.8
2.4
103904562
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(5 Cplx.)
RUN2
pKi= 5.7
1182
5.7
2.4
103904562
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN0
pKi= 5.7
1183
6.9
2.4
103905598
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(12 Cplx.)
RUN0
pKi= 5.8
1184
8.0
2.4
103904470
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN0
pKi= 6.9
1185
7.7
2.4
103904468
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN0
pKi= 6.3
1186
6.7
2.4
103904786
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(12 Cplx.)
RUN1
pKi= 6.3
1187
7.7
2.4
103904381
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN1
pKi= 5.7
1188
6.7
2.4
103904819
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P2
:
(3 Cplx.)
RUN0
pKi= 7.3
1189
7.8
2.4
103905018
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P2
:
(3 Cplx.)
RUN0
pKi= 8.2
1190
6.7
2.4
103905009
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P2
:
(4 Cplx.)
RUN0
pKi= 6.5
1191
6.7
2.4
103904351
3D2I
(73%)
+
AK3_A_2
QMean=0.483
P2
:
(3 Cplx.)
RUN1
pKi= 8.4
1192
6.5
2.4
103904650
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(4 Cplx.)
RUN2
pKi= 6
1193
6.1
2.4
103905049
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(7 Cplx.)
RUN0
pKi= 5.7
1194
7.3
2.4
103904708
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(7 Cplx.)
RUN2
pKi= 5.5
1195
6.4
2.4
103905270
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P1
:
(4 Cplx.)
RUN0
pKi= 6.1
1196
6.3
2.4
103904925
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(8 Cplx.)
RUN0
pKi= 5.6
1197
6.0
2.4
103905472
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(3 Cplx.)
RUN2
pKi= 5.6
1198
4.7
2.4
103905559
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(4 Cplx.)
RUN1
pKi= 5.8
1199
7.3
2.4
103905014
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(8 Cplx.)
RUN0
pKi= 7.5
1200
6.4
2.4
103904340
2VRX
(77%)
+
447_B_6
QMean=0.387
P1
:
(4 Cplx.)
RUN1
pKi= 7.1
1201
6.2
2.4
103904401
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P2
:
(3 Cplx.)
RUN1
pKi= 8.9
1202
6.4
2.4
103904203
2VGO
(80%)
+
AD5_A_5
QMean=0.527
P1
:
(4 Cplx.)
RUN0
pKi= 5.7
1203
6.2
2.4
103904545
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(6 Cplx.)
RUN0
pKi= 5.4
1204
8.4
2.4
103905316
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN2
pKi= 6.8
1205
5.9
2.4
103905490
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(5 Cplx.)
RUN1
pKi= 7
1206
6.2
2.4
103905280
3K5U
(71%)
+
PFQ_A_2
QMean=0.513
P1
:
(8 Cplx.)
RUN1
pKi= 7.4
1207
8.5
2.4
103905532
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(7 Cplx.)
RUN0
pKi= 7.9
1208
9.4
2.4
103904302
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(5 Cplx.)
RUN0
pKi= 7.8
1209
6.5
2.4
103904786
3O51
(72%)
+
LJF_A_2
QMean=0.528
P1
:
(9 Cplx.)
RUN2
pKi= 6.3
1210
7.7
2.4
103905022
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(4 Cplx.)
RUN0
pKi= 8.4
1211
5.4
2.4
103905208
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(6 Cplx.)
RUN2
pKi= 5.4
1212
6.7
2.4
103904329
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P1
:
(3 Cplx.)
RUN0
pKi= 8
1213
5.9
2.4
103904687
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(3 Cplx.)
RUN2
pKi= 5.4
1214
7.3
2.4
103905145
3R21
(72%)
+
D36_A_2
QMean=0.473
P1
:
(3 Cplx.)
RUN1
pKi= 5.3
1215
8.4
2.4
103905532
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(6 Cplx.)
RUN2
pKi= 7.9
1216
6.3
2.4
103905013
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(8 Cplx.)
RUN2
pKi= 7.4
1217
7.3
2.4
103904349
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(10 Cplx.)
RUN0
pKi= 7.7
1218
6.0
2.4
103904368
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(4 Cplx.)
RUN2
pKi= 7.8
1219
6.3
2.4
103904698
2W1D
(72%)
+
L0D_A_2
QMean=0.515
P1
:
(5 Cplx.)
RUN2
pKi= 7.4
1220
6.7
2.4
103904786
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(14 Cplx.)
RUN0
pKi= 6.3
1221
7.8
2.4
103905137
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P2
:
(4 Cplx.)
RUN1
pKi= 5.6
1222
5.9
2.4
103905319
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(12 Cplx.)
RUN1
pKi= 6.6
1223
4.8
2.4
103905528
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(20 Cplx.)
RUN1
pKi= 5.8
1224
5.5
2.4
103905178
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P1
:
(5 Cplx.)
RUN2
pKi= 6.6
1225
5.8
2.4
103905166
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(4 Cplx.)
RUN1
pKi= 5.6
1226
7.3
2.4
103904859
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P2
:
(3 Cplx.)
RUN0
pKi= 6.6
1227
8.0
2.4
103904285
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(8 Cplx.)
RUN2
pKi= 8.3
1228
7.2
2.4
103905641
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P2
:
(4 Cplx.)
RUN0
pKi= 5.9
1229
6.9
2.4
103904691
3TXO
(34%)
+
07U_A_2
QMean=0.548
P1
:
(4 Cplx.)
RUN0
pKi= 5.5
1230
5.2
2.4
103905234
2VRX
(77%)
+
447_B_6
QMean=0.387
P2
:
(3 Cplx.)
RUN2
pKi= 5.8
1231
6.2
2.4
103905271
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(7 Cplx.)
RUN0
pKi= 6
1232
4.8
2.4
103905559
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(4 Cplx.)
RUN0
pKi= 5.8
1233
6.1
2.4
103904601
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(7 Cplx.)
RUN1
pKi= 7.8
1234
6.4
2.4
103905354
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(5 Cplx.)
RUN2
pKi= 5.5
1235
5.2
2.4
103905521
3O51
(72%)
+
LJF_A_2
QMean=0.528
P2
:
(3 Cplx.)
RUN1
pKi= 5.8
1236
6.4
2.4
103905393
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(8 Cplx.)
RUN1
pKi= 5.9
1237
4.9
2.4
103905579
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(4 Cplx.)
RUN2
pKi= 5.4
1238
7.7
2.4
103904636
4GV1
(33%)
+
0XZ_A_2
QMean=0.527
P1
:
(9 Cplx.)
RUN0
pKi= 6.7
1239
7.4
2.4
103904444
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(5 Cplx.)
RUN2
pKi= 6.7
1240
6.8
2.4
103904856
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(5 Cplx.)
RUN2
pKi= 7.1
1241
5.6
2.4
103905327
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(8 Cplx.)
RUN0
pKi= 4.5
1242
6.9
2.4
103904363
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(5 Cplx.)
RUN0
pKi= 6.7
1243
7.2
2.4
103904855
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P1
:
(3 Cplx.)
RUN2
pKi= 6.9
1244
6.7
2.4
103904387
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P2
:
(3 Cplx.)
RUN2
pKi= 7.8
1245
6.6
2.4
103904210
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN0
pKi= 5.4
1246
6.4
2.4
103905506
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(7 Cplx.)
RUN1
pKi= 7.4
1247
6.4
2.4
103905043
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(7 Cplx.)
RUN2
pKi= 5.2
1248
7.0
2.4
103905136
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(5 Cplx.)
RUN1
pKi= 5.2
1249
6.9
2.4
103904362
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(3 Cplx.)
RUN0
pKi= 7.9
1250
6.4
2.4
103904340
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(4 Cplx.)
RUN2
pKi= 7.1
1251
6.7
2.4
103904750
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN1
pKi= 5.4
1252
6.3
2.4
103905397
2VGP
(80%)
+
AD6_B_6
QMean=0.415
P1
:
(14 Cplx.)
RUN0
pKi= 6.3
1253
7.1
2.4
103905018
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(3 Cplx.)
RUN1
pKi= 8.2
1254
7.4
2.4
103905610
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P1
:
(12 Cplx.)
RUN1
pKi= 7.3
1255
6.3
2.4
103904340
3UO4
(71%)
+
0C0_A_2
QMean=0.499
P2
:
(3 Cplx.)
RUN0
pKi= 7.1
1256
6.0
2.4
103904646
3UOJ
(71%)
+
0C5_B_4
QMean=0.478
P1
:
(7 Cplx.)
RUN0
pKi= 4.8
1257
6.8
2.4
103905585
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P3
:
(3 Cplx.)
RUN0
pKi= 5.9
1258
5.5
2.4
103905389
2X6D
(70%)
+
X6D_A_4
QMean=0.485
P1
:
(7 Cplx.)
RUN1
pKi= 5.6
1259
7.2
2.4
103905034
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(4 Cplx.)
RUN2
pKi= 6.9
1260
5.1
2.4
103905636
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(6 Cplx.)
RUN2
pKi= 6
1261
4.4
2.4
103905040
4DED
(71%)
+
NHU_A_2
QMean=0.467
P1
:
(5 Cplx.)
RUN0
pKi= 4.5
1262
6.0
2.4
103904556
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(3 Cplx.)
RUN2
pKi= 5.2
1263
7.5
2.4
103905610
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P1
:
(12 Cplx.)
RUN2
pKi= 7.3
1264
4.9
2.4
103905177
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P2
:
(3 Cplx.)
RUN1
pKi= 5.7
1265
8.4
2.4
103904479
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(4 Cplx.)
RUN0
pKi= 6.7
1266
7.6
2.4
103904647
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(3 Cplx.)
RUN2
pKi= 7
1267
6.0
2.4
103904809
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P2
:
(3 Cplx.)
RUN0
pKi= 6.3
1268
3.5
2.4
103905601
3D15
(73%)
+
AK2_A_2
QMean=0.466
P2
:
(3 Cplx.)
RUN1
pKi= 4.2
1269
6.3
2.5
103905631
3COH
(72%)
+
83H_A_3
QMean=0.518
P3
:
(3 Cplx.)
RUN2
pKi= 6
1270
5.8
2.5
103905226
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(6 Cplx.)
RUN1
pKi= 6.1
1271
6.0
2.5
103905042
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(6 Cplx.)
RUN0
pKi= 5.7
1272
5.7
2.5
103904562
4JAJ
(71%)
+
XU1_A_2
QMean=0.500
P1
:
(3 Cplx.)
RUN1
pKi= 5.7
1273
6.6
2.5
103905506
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(11 Cplx.)
RUN2
pKi= 7.4
1274
4.9
2.5
103905206
3UP2
(71%)
+
0C8_A_2
QMean=0.483
P1
:
(4 Cplx.)
RUN1
pKi= 5.8
1275
7.2
2.5
103905315
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(3 Cplx.)
RUN1
pKi= 6.4
1276
5.6
2.5
103904729
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN1
pKi= 5.7
1277
5.4
2.5
103904940
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN1
pKi= 6.2
1278
7.8
2.5
103904856
3UOH
(71%)
+
0C4_A_3
QMean=0.508
P1
:
(3 Cplx.)
RUN0
pKi= 7.1
1279
7.7
2.5
103904991
3R22
(72%)
+
D37_A_2
QMean=0.500
P1
:
(5 Cplx.)
RUN1
pKi= 6.4
1280
7.3
2.5
103904753
2BFY
(79%)
+
H1N_A_5
QMean=0.511
P1
:
(3 Cplx.)
RUN2
pKi= 5.2
1281
8.1
2.5
103905280
3DJ5
(73%)
+
AK5_A_2
QMean=0.566
P2
:
(6 Cplx.)
RUN0
pKi= 7.4
1282
4.3
2.5
103905650
2C6E
(71%)
+
HPM_A_3
QMean=0.500
P2
:
(3 Cplx.)
RUN2
pKi= 5.3
1283
7.6
2.5
103905610
3UOD
(71%)
+
0C3_A_2
QMean=0.538
P1
:
(14 Cplx.)
RUN0
pKi= 7.3
1284
7.1
2.5
103905393
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(4 Cplx.)
RUN2
pKi= 5.9
1285
6.1
2.5
103904564
4DEA
(71%)
+
NHI_A_5
QMean=0.467
P1
:
(6 Cplx.)
RUN0
pKi= 5.7
1286
7.0
2.5
103904191
3UOL
(71%)
+
0C7_B_9
QMean=0.504
P1
:
(7 Cplx.)
RUN0
pKi= 6.3
1287
6.6
2.5
103904193
3H0Y
(72%)
+
48B_A_2
QMean=0.543
P1
:
(3 Cplx.)
RUN1
pKi= 6.3
1288
6.4
2.5
103904369
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(5 Cplx.)
RUN1
pKi= 6.5
1289
6.3
2.5
103904657
3UOK
(71%)
+
0C6_A_3
QMean=0.477
P1
:
(4 Cplx.)
RUN2
pKi= 7
1290
6.1
2.5
103905264
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(3 Cplx.)
RUN2
pKi= 6.4
1291
5.9
2.5
103904916
3P9J
(72%)
+
P9J_A_2
QMean=0.532
P1
:
(3 Cplx.)
RUN0
pKi= 6.8
1292
6.1
2.5
103904349
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P2
:
(4 Cplx.)
RUN1
pKi= 7.7
1293
8.4
2.5
103905316
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(3 Cplx.)
RUN0
pKi= 6.8
1294
8.5
2.5
103904303
4JAI
(71%)
+
XU2_A_2
QMean=0.481
P1
:
(6 Cplx.)
RUN0
pKi= 8.5
1295
7.9
2.5
103904962
3LAU
(70%)
+
OFI_A_2
QMean=0.496
P1
:
(4 Cplx.)
RUN1
pKi= 5.4
1296
6.0
2.5
103905151
2XNE
(72%)
+
ASH_A_2
QMean=0.512
P2
:
(3 Cplx.)
RUN1
pKi= 5.7
1297
8.6
2.5
103905082
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(3 Cplx.)
RUN0
pKi= 6.1
1298
5.9
2.5
103905246
2VRX
(77%)
+
447_B_6
QMean=0.387
P1
:
(3 Cplx.)
RUN2
pKi= 6.5
1299
5.7
2.5
103905287
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(5 Cplx.)
RUN2
pKi= 5.2
1300
5.4
2.5
103905044
3D15
(73%)
+
AK2_A_2
QMean=0.466
P1
:
(4 Cplx.)
RUN1
pKi= 5.7
1301
8.0
2.5
103904366
3DJ7
(73%)
+
AK7_A_2
QMean=0.519
P1
:
(3 Cplx.)
RUN0
pKi= 7.1
1302
5.0
2.5
103904952
3H0Z
(72%)
+
45B_B_5
QMean=0.504
P2
:
(3 Cplx.)
RUN0
pKi= 5.9
1303
7.3
2.5
103905066
3COH
(72%)
+
83H_A_3
QMean=0.518
P1
:
(6 Cplx.)
RUN2
pKi= 5.5
1304
8.4
2.5
103904725
3QBN
(71%)
+
E9Z_A_2
QMean=0.475
P1
:
(3 Cplx.)
RUN2
pKi= 5.4
1305
5.7
2.5
103905050
4DEB
(71%)
+
NHJ_A_2
QMean=0.463
P1
:
(6 Cplx.)
RUN0
pKi= 5.8
1306
5.7
2.5
103905614
3UO5
(71%)
+
0BX_A_2
QMean=0.491
P1
:
(4 Cplx.)
RUN1
pKi= 6
1307
7.2
2.5
103904444
3FDN
(71%)
+
MMH_A_2
QMean=0.512
P1
:
(3 Cplx.)
RUN0
pKi= 6.7
1308
6.1
2.5
103905629
2W1E
(72%)
+
L0E_A_2
QMean=0.526
P1
:
(9 Cplx.)
RUN2
pKi= 7
1309
6.3
2.5
103904662
4B8M
(77%)
+
VX6_A_5
QMean=0.497
P1
:
(5 Cplx.)
RUN2
pKi= 5.2
1310
7.5
2.5
103905392
4DHF
(72%)
+
0K6_A_3
QMean=0.526
P1
:
(10 Cplx.)
RUN0
pKi= 5.8
1311
5.2
2.5
103905192
2NP8
(72%)
+
CC3_E_5
QMean=0.541
P1
:
(15 Cplx.)
RUN1
pKi= 5.2
1312
7.5
2.5
103904332
4JBO
(71%)
+
WPH_A_2
QMean=0.479
P1
:
(3 Cplx.)
RUN2
pKi= 5.4
1313
6.9
2.5
103904472
3UNZ
(71%)
+
0BZ_B_6
QMean=0.521
P2
:
(3 Cplx.)
RUN1
pKi= 6.5
1314
7.4
2.5
103904406
3QBN
(71%)
+
E9Z_A_2
QMean=0.475
P3
:
(3 Cplx.)
RUN0
pKi= 6.8
1315
5.7
2.5
103905287
3ZTX
(80%)
+
ZTX_A_5
QMean=0.499
P1
:
(7 Cplx.)
RUN1
pKi= 5.2
1316
6.4
2.5
103904206
3D14
(73%)
+
AK1_A_2
QMean=0.523
P1
:
(5 Cplx.)
RUN0
pKi= 6.1
Correlation coefficient (Pearson) between mesured and calculated pKd: R=0.41
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