ID

Tyr181-188 (2B5J)

ID

Trp229-Pro236-Tyr318 (2B5J)

315

−8.09

450

−8.83

474

−7.69

244

−8.51

224

−7.62

486

−8.50

58

−7.55

201

−8.39

310

−7.52

487

−8.30

269

−7.47

546

−7.94

470

−7.44

448

−7.71

447

−7.39

10

−7.65

299

−7.38

513

−7.59

454

−7.37

506

−7.51

236

−7.35

535

−7.45

538

−7.34

312

−7.37

94

−7.27

288

−7.33

23

−7.24

542

−7.31

59

−7.22

445

−7.25

225

−7.20

267

−7.20

550

−7.19

540

−7.18

451

−7.18

199

−7.17

227

−7.17

531

−7.17

315

−7.17

499

−7.16

529

−7.15

299

−7.14

219

−7.08

485

−7.13

309

−7.04

305

−7.11

473

−6.98

539

−7.11

151

−6.94

44

−7.07

212

−6.93

52

−7.07

235

−6.89

505

−7.06

342

−6.77

507

−7.03

49

−6.68

120

−6.88

357

−6.68

287

−6.85

515

−6.65

54

−6.84

313

−6.52

42

−6.83