A0A087YL87_POEFO Loading...

Solute carrier family 23 member 1

AlphaFold DB , UniProt , Accession A0A087YL87, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 575 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M71.4Confident85.9Confident95 Ų9574.3 Ų74.347%0.46837%0.371SS..  0146.10-75-64.1-78.800108.3Y3 T4 L315 L359 K363M1-Y3 WeakPolarHBondContact CE-O 3.49Å; M1-T4 HydrophobicContact CB-CG2 4.15Å; M1-L315 WeakPolarHBondContact CE-O 3.46Å; M1-L359 HydrophobicContact CE-CD1 4.28Å; M1-K363 WeakPolarHBondContact CE-O 3.45Å; M1-K363 HydrophobicContact SD-CB 3.82Å; M1-K363 HydrophobicContact SD-CD 3.77Å; M1-K363 HydrophobicContact SD-CG 4.4Å
2I79.6Confident86.1Confident110 Ų11079.1 Ų79.156%0.56438%0.383SS*.  trans-81.2-45.7174-62.3176.2000109.6T362 K363I2-T362 WeakPolarHBondContact CD1-O 3.33Å; I2-K363 HydrophobicContact CG1-CB 4.17Å; I2-K363 PolarHBondContact N-O 3.27Å
3Y84Confident86.2Confident57 Ų5776.5 Ų76.522%0.22437%0.372CS..BIsolated β-bridgetrans-130.6131.7169.9-66.5-68.7000108.8M1 D7 P9 L17 K363 V364 G365M1-Y3 WeakPolarHBondContact CE-O 3.49Å; Y3-D7 WeakPolarHBondContact CA-OD2 3.47Å; Y3-D7 HydrophobicContact CD1-CB 4Å; Y3-P9 HydrophobicContact CD1-CB 4.35Å; Y3-P9 HydrophobicContact CD1-CG 3.7Å; Y3-P9 HydrophobicContact CD2-CG 3.92Å; Y3-P9 HydrophobicContact CE1-CB 3.9Å; Y3-P9 HydrophobicContact CE1-CG 3.78Å; Y3-P9 HydrophobicContact CE2-CB 4.1Å; Y3-P9 HydrophobicContact CE2-CG 4Å; Y3-P9 HydrophobicContact CG-CG 3.77Å; Y3-L17 HydrophobicContact CD2-CD1 4.42Å; Y3-L17 HydrophobicContact CE2-CD1 4.24Å; Y3-K363 PolarHBondContact N-O 3.42Å; Y3-V364 HydrophobicContact CD2-CG1 4.16Å; Y3-V364 HydrophobicContact CD2-CG2 4.24Å; Y3-G365 WeakPolarHBondContact O-CA 3.35Å; Y3-G365 PolarHBondContact O-N 3.21Å
4T86.6Confident86.5Confident56 Ų5671.1 Ų71.134%0.34435%0.346SS..  trans-89.2175.8174.767.80000110.9M1 E6 D7 S366M1-T4 HydrophobicContact CB-CG2 4.15Å; T4-E6 VanDerWaalsContact C-N 3.33Å; T4-E6 PolarHBondContact O-N 3.45Å; T4-D7 WeakPolarHBondContact CB-OD2 3.35Å; T4-D7 PolarHBondContact N-OD2 2.83Å; T4-D7 PolarHBondContact O-N 3.17Å; T4-D7 PolarHBondContact OG1-OD1 3.07Å; T4-D7 PolarHBondContact OG1-OD2 2.97Å; T4-S366 VanDerWaalsContact O-CA 3.31Å; T4-S366 WeakPolarHBondContact O-CA 3.43Å; T4-S366 PolarHBondContact O-N 3.3Å
5I87.1Confident86.7Confident9 Ų971 Ų715%0.04635%0.346CS..THydrogen-bonded Turntrans-59.7-35.4-173.2-169.5170.3000115.1L74 A318 G365 R367I5-L74 HydrophobicContact CD1-CD2 3.78Å; I5-A318 HydrophobicContact CD1-CB 3.82Å; I5-A318 HydrophobicContact CG2-CB 4.23Å; I5-G365 VanDerWaalsContact CA-O 3.26Å; I5-G365 WeakPolarHBondContact CA-O 3.22Å; I5-R367 HydrophobicContact CD1-CG 4.48Å; I5-R367 HydrophobicContact CG1-CG 3.69Å; I5-R367 WeakPolarHBondContact O-CG 3.2Å; I5-R367 PolarHBondContact O-NE 3.26Å
6E85.1Confident86.8Confident90 Ų9071.8 Ų71.842%0.42135%0.352SS..THydrogen-bonded Turntrans-93.1-10.2-178.6-57.1-160147.200113.1T4 T515 S516T4-E6 VanDerWaalsContact C-N 3.33Å; T4-E6 PolarHBondContact O-N 3.45Å; E6-T515 PolarHBondContact OE1-OG1 3.42Å; E6-S516 PolarHBondContact OE1-N 3.1Å; E6-S516 PolarHBondContact OE1-OG 2.96Å
7D87.6Confident86.8Confident62 Ų6268.7 Ų68.733%0.33234%0.337SS..  trans-65.1143.5-179-69.6-28.6000111.8Y3 T4 P9 S366Y3-D7 WeakPolarHBondContact CA-OD2 3.47Å; Y3-D7 HydrophobicContact CD1-CB 4Å; T4-D7 WeakPolarHBondContact CB-OD2 3.35Å; T4-D7 PolarHBondContact N-OD2 2.83Å; T4-D7 PolarHBondContact O-N 3.17Å; T4-D7 PolarHBondContact OG1-OD1 3.07Å; T4-D7 PolarHBondContact OG1-OD2 2.97Å; D7-P9 WeakPolarHBondContact O-CD 3.25Å; D7-S366 WeakPolarHBondContact O-CB 3.45Å; D7-S366 PolarHBondContact O-OG 2.95Å
8V90.2Very high87Confident105 Ų10564.9 Ų64.964%0.63632%0.319SS*.  trans-117.191.9176.8-175.70000108.6R368V8-R368 HydrophobicContact CB-CG 4.43Å; V8-R368 HydrophobicContact CG1-CG 4.17Å; V8-R368 HydrophobicContact CG2-CG 3.98Å
9P90.7Very high87Confident5 Ų564.5 Ų64.53%0.03232%0.318CS..  trans-62.3158.6174.5-18.830.4000111.4Y3 D7 L13 C14 S366 V369Y3-P9 HydrophobicContact CD1-CB 4.35Å; Y3-P9 HydrophobicContact CD1-CG 3.7Å; Y3-P9 HydrophobicContact CD2-CG 3.92Å; Y3-P9 HydrophobicContact CE1-CB 3.9Å; Y3-P9 HydrophobicContact CE1-CG 3.78Å; Y3-P9 HydrophobicContact CE2-CB 4.1Å; Y3-P9 HydrophobicContact CE2-CG 4Å; Y3-P9 HydrophobicContact CG-CG 3.77Å; D7-P9 WeakPolarHBondContact O-CD 3.25Å; P9-L13 HydrophobicContact CB-CB 4.29Å; P9-C14 PolarHBondContact O-SG 3.43Å; P9-C14 VanDerWaalsContact O-SG 3.35Å; P9-S366 WeakPolarHBondContact CD-OG 3.08Å; P9-V369 HydrophobicContact CG-CG2 3.81Å
10P92.7Very high87Confident54 Ų5461.5 Ų61.535%0.35130%0.303SS..  trans-51.4142.6169.7-25.632.8000112.2Y12 L13 C14P10-Y12 HydrophobicContact CB-CD1 3.82Å; P10-Y12 HydrophobicContact CB-CE1 3.29Å; P10-Y12 HydrophobicContact CB-CE2 4.41Å; P10-Y12 HydrophobicContact CG-CE1 4.2Å; P10-Y12 PolarHBondContact O-N 3.3Å; P10-Y12 VanDerWaalsContact O-N 3.08Å; P10-L13 HydrophobicContact CB-CD1 4.5Å; P10-L13 HydrophobicContact CG-CD1 4.13Å; P10-L13 WeakPolarHBondContact O-CB 3.19Å; P10-L13 PolarHBondContact O-N 3.37Å; P10-C14 PolarHBondContact O-N 3.34Å
11W90.5Very high86.9Confident174 Ų17458.7 Ų58.766%0.65929%0.289SS*.Hα-helixtrans-53.3-36.9-172.566.8-92.9000113.9C14 I15 F372W11-C14 WeakPolarHBondContact O-CB 3.41Å; W11-C14 PolarHBondContact O-N 3.48Å; W11-I15 HydrophobicContact CE3-CD1 3.6Å; W11-I15 HydrophobicContact CZ3-CD1 3.69Å; W11-I15 WeakPolarHBondContact O-CG1 3.19Å; W11-I15 PolarHBondContact O-N 3.5Å; W11-F372 HydrophobicContact CB-CE1 4.49Å; W11-F372 HydrophobicContact CB-CZ 4.4Å
12Y87.7Confident87.6Confident132 Ų13254.2 Ų54.252%0.51827%0.267SS..Hα-helixtrans-70-32.917960.9-92.9000112.7P10 L16P10-Y12 HydrophobicContact CB-CD1 3.82Å; P10-Y12 HydrophobicContact CB-CE1 3.29Å; P10-Y12 HydrophobicContact CB-CE2 4.41Å; P10-Y12 HydrophobicContact CG-CE1 4.2Å; P10-Y12 PolarHBondContact O-N 3.3Å; P10-Y12 VanDerWaalsContact O-N 3.08Å; Y12-L16 PolarHBondContact O-N 3.11Å; Y12-L16 VanDerWaalsContact O-N 3.17Å
13L87Confident87.8Confident46 Ų4650.3 Ų50.324%0.24125%0.247CC..Hα-helixtrans-72.7-37.4172.4-76.8168.3000110.9P9 P10 I15 L16 L17P9-L13 HydrophobicContact CB-CB 4.29Å; P10-L13 HydrophobicContact CB-CD1 4.5Å; P10-L13 HydrophobicContact CG-CD1 4.13Å; P10-L13 WeakPolarHBondContact O-CB 3.19Å; P10-L13 PolarHBondContact O-N 3.37Å; L13-I15 VanDerWaalsContact C-N 3.27Å; L13-I15 PolarHBondContact O-N 3.07Å; L13-L16 PolarHBondContact O-N 3.01Å; L13-L17 HydrophobicContact CB-CD1 4.39Å; L13-L17 VanDerWaalsContact O-CB 3.29Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 VanDerWaalsContact O-CG 3.27Å; L13-L17 WeakPolarHBondContact O-CG 3.39Å; L13-L17 PolarHBondContact O-N 2.92Å
14C90.4Very high87.7Confident1 Ų148.5 Ų48.51%0.00724%0.242CC..Hα-helixtrans-59.7-38.5173-69.70000112.1P9 P10 W11 G18 F372P9-C14 PolarHBondContact O-SG 3.43Å; P9-C14 VanDerWaalsContact O-SG 3.35Å; P10-C14 PolarHBondContact O-N 3.34Å; W11-C14 WeakPolarHBondContact O-CB 3.41Å; W11-C14 PolarHBondContact O-N 3.48Å; C14-G18 VanDerWaalsContact O-CA 3.28Å; C14-G18 WeakPolarHBondContact O-CA 3.34Å; C14-G18 PolarHBondContact O-N 3.27Å; C14-F372 HydrophobicContact CB-CB 4.01Å; C14-F372 HydrophobicContact CB-CD1 4.07Å; C14-F372 HydrophobicContact CB-CD2 3.78Å; C14-F372 HydrophobicContact CB-CE1 4.49Å; C14-F372 HydrophobicContact CB-CE2 4.21Å; C14-F372 HydrophobicContact CB-CG 3.68Å
15I90.5Very high87.4Confident69 Ų6946 Ų4635%0.35423%0.227SC..Hα-helixtrans-64.2-51173.9-68.9170.3000110.8W11 L13 G18 L19 F372 I376W11-I15 HydrophobicContact CE3-CD1 3.6Å; W11-I15 HydrophobicContact CZ3-CD1 3.69Å; W11-I15 WeakPolarHBondContact O-CG1 3.19Å; W11-I15 PolarHBondContact O-N 3.5Å; L13-I15 VanDerWaalsContact C-N 3.27Å; L13-I15 PolarHBondContact O-N 3.07Å; I15-G18 PolarHBondContact O-N 3.36Å; I15-L19 VanDerWaalsContact O-CB 3.28Å; I15-L19 WeakPolarHBondContact O-CB 3.42Å; I15-L19 PolarHBondContact O-N 3.14Å; I15-F372 HydrophobicContact CG1-CD1 3.91Å; I15-F372 HydrophobicContact CG1-CE1 4.35Å; I15-I376 HydrophobicContact CG2-CD1 4.09Å
16L87.1Confident87.3Confident83 Ų8345.6 Ų45.644%0.43523%0.225SC..Hα-helixtrans-61.9-50-177.4-17488000112.2Y12 L13 L19 Q20 M224Y12-L16 PolarHBondContact O-N 3.11Å; Y12-L16 VanDerWaalsContact O-N 3.17Å; L13-L16 PolarHBondContact O-N 3.01Å; L16-L19 PolarHBondContact O-N 2.94Å; L16-Q20 PolarHBondContact O-N 2.93Å; L16-Q20 VanDerWaalsContact O-N 3.09Å; L16-M224 HydrophobicContact CD2-CE 3.88Å; L16-M224 HydrophobicContact CG-CE 3.97Å
17L87.6Confident87.1Confident20 Ų2041.5 Ų41.511%0.10521%0.206CC..Hα-helixtrans-72.9-35.1-178.5-62.2169.5000110.8Y3 L13 L19 Q20 H21 V364 V369Y3-L17 HydrophobicContact CD2-CD1 4.42Å; Y3-L17 HydrophobicContact CE2-CD1 4.24Å; L13-L17 HydrophobicContact CB-CD1 4.39Å; L13-L17 VanDerWaalsContact O-CB 3.29Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 VanDerWaalsContact O-CG 3.27Å; L13-L17 WeakPolarHBondContact O-CG 3.39Å; L13-L17 PolarHBondContact O-N 2.92Å; L17-L19 VanDerWaalsContact C-N 3.34Å; L17-Q20 WeakPolarHBondContact O-CB 3.23Å; L17-Q20 PolarHBondContact O-N 2.99Å; L17-H21 PolarHBondContact O-CD2 2.73Å; L17-H21 PolarHBondContact O-N 3.22Å; L17-V364 HydrophobicContact CD1-CG1 3.94Å; L17-V364 HydrophobicContact CD1-CG2 4.2Å; L17-V364 HydrophobicContact CD2-CG2 4.33Å; L17-V369 HydrophobicContact CB-CG1 3.43Å; L17-V369 VanDerWaalsContact CB-CG1 3.43Å; L17-V369 HydrophobicContact CB-CG2 4.34Å; L17-V369 HydrophobicContact CD1-CG2 4.38Å
18G89.6Confident86.8Confident0 Ų039 Ų390%020%0.195CC..Hα-helixtrans-64.2-41.1174.500000111.5C14 I15 Q20 H21 Y22 V369 G373C14-G18 VanDerWaalsContact O-CA 3.28Å; C14-G18 WeakPolarHBondContact O-CA 3.34Å; C14-G18 PolarHBondContact O-N 3.27Å; I15-G18 PolarHBondContact O-N 3.36Å; G18-Q20 VanDerWaalsContact C-N 3.33Å; G18-Q20 PolarHBondContact O-N 3.29Å; G18-H21 PolarHBondContact O-N 3.32Å; G18-Y22 PolarHBondContact O-N 2.87Å; G18-V369 WeakPolarHBondContact CA-O 3.49Å; G18-G373 WeakPolarHBondContact O-CA 3.28Å
19L88.1Confident86.7Confident57 Ų5734 Ų3430%0.29817%0.165SC..Hα-helixtrans-60.9-42.3171.8-172.973.6000111I15 L16 L17 H21 Y22 L23 I376I15-L19 VanDerWaalsContact O-CB 3.28Å; I15-L19 WeakPolarHBondContact O-CB 3.42Å; I15-L19 PolarHBondContact O-N 3.14Å; L16-L19 PolarHBondContact O-N 2.94Å; L17-L19 VanDerWaalsContact C-N 3.34Å; L19-H21 PolarHBondContact O-N 2.86Å; L19-Y22 HydrophobicContact CD1-CD1 3.84Å; L19-Y22 HydrophobicContact CD1-CE1 4.39Å; L19-Y22 WeakPolarHBondContact O-CB 3.48Å; L19-Y22 PolarHBondContact O-N 2.93Å; L19-L23 HydrophobicContact CD1-CD1 4.41Å; L19-L23 HydrophobicContact CD1-CG 4.38Å; L19-L23 HydrophobicContact CD2-CD1 4.25Å; L19-L23 HydrophobicContact CG-CD1 3.83Å; L19-L23 HydrophobicContact CG-CG 4.18Å; L19-L23 WeakPolarHBondContact O-CB 3.18Å; L19-L23 WeakPolarHBondContact O-CG 3.14Å; L19-L23 PolarHBondContact O-N 3.27Å; L19-I376 HydrophobicContact CB-CD1 4.49Å; L19-I376 HydrophobicContact CD1-CG2 4.07Å
20Q86.2Confident86.6Confident5 Ų533.8 Ų33.82%0.02316%0.163CC..Hα-helixtrans-58-46.3175.4-179.9-176.8-0.300112.8L16 L17 G18 L23 T24 M224 F225L16-Q20 PolarHBondContact O-N 2.93Å; L16-Q20 VanDerWaalsContact O-N 3.09Å; L17-Q20 WeakPolarHBondContact O-CB 3.23Å; L17-Q20 PolarHBondContact O-N 2.99Å; G18-Q20 VanDerWaalsContact C-N 3.33Å; G18-Q20 PolarHBondContact O-N 3.29Å; Q20-L23 PolarHBondContact O-N 2.88Å; Q20-T24 PolarHBondContact O-N 2.72Å; Q20-T24 VanDerWaalsContact O-N 3.14Å; Q20-T24 PolarHBondContact O-OG1 3.03Å; Q20-M224 HydrophobicContact CB-CE 4.36Å; Q20-M224 HydrophobicContact CG-CB 4.24Å; Q20-M224 WeakPolarHBondContact CG-O 3.46Å; Q20-F225 HydrophobicContact CB-CE1 4.06Å; Q20-F225 HydrophobicContact CG-CE1 4.45Å
21H85.1Confident86.4Confident2 Ų231.2 Ų31.21%0.00915%0.147CC..Hα-helixtrans-64.2-43.7176.7-77.4-76.6000111.9L17 G18 L19 L23 T24 C25 F77 N355L17-H21 PolarHBondContact O-CD2 2.73Å; L17-H21 PolarHBondContact O-N 3.22Å; G18-H21 PolarHBondContact O-N 3.32Å; L19-H21 PolarHBondContact O-N 2.86Å; H21-L23 PolarHBondContact O-N 2.85Å; H21-T24 WeakPolarHBondContact O-CB 3.22Å; H21-T24 PolarHBondContact O-N 2.88Å; H21-C25 PolarHBondContact O-N 2.85Å; H21-F77 HydrophobicContact CB-CD2 3.82Å; H21-F77 HydrophobicContact CB-CE2 3.29Å; H21-F77 HydrophobicContact CB-CZ 3.99Å; H21-N355 WeakPolarHBondContact CB-OD1 3.34Å; H21-N355 PolarHBondContact ND1-OD1 3.43Å
22Y86.8Confident86.4Confident1 Ų123 Ų230%0.00412%0.115CC..Hα-helixtrans-54.8-52.3173.2157.9-112.2000112G18 L19 T24 C25 F26 M377 L380 F386G18-Y22 PolarHBondContact O-N 2.87Å; L19-Y22 HydrophobicContact CD1-CD1 3.84Å; L19-Y22 HydrophobicContact CD1-CE1 4.39Å; L19-Y22 WeakPolarHBondContact O-CB 3.48Å; L19-Y22 PolarHBondContact O-N 2.93Å; Y22-T24 PolarHBondContact O-N 3.42Å; Y22-T24 VanDerWaalsContact O-N 3.16Å; Y22-C25 PolarHBondContact O-N 3.4Å; Y22-F26 PolarHBondContact O-N 2.94Å; Y22-M377 HydrophobicContact CD2-CB 3.9Å; Y22-M377 HydrophobicContact CD2-CE 4.25Å; Y22-M377 HydrophobicContact CD2-CG 3.66Å; Y22-M377 HydrophobicContact CD2-SD 3.68Å; Y22-M377 HydrophobicContact CE2-CB 4.29Å; Y22-M377 HydrophobicContact CE2-CE 4.15Å; Y22-M377 HydrophobicContact CE2-CG 3.73Å; Y22-M377 HydrophobicContact CE2-SD 4.08Å; Y22-L380 HydrophobicContact CE1-CD1 4.14Å; Y22-F386 HydrophobicContact CE1-CZ 4.38Å; Y22-F386 VanDerWaalsContact OH-CE1 3.3Å; Y22-F386 WeakPolarHBondContact OH-CE1 3.2Å; Y22-F386 VanDerWaalsContact OH-CZ 3.32Å; Y22-F386 WeakPolarHBondContact OH-CZ 3.39Å
23L83.9Confident86.6Confident28 Ų2816.8 Ų16.815%0.1479%0.091CC..Hα-helixtrans-65.8-18.7-177.6-67.6176.7000113.2L19 Q20 H21 F26 F225 I228L19-L23 HydrophobicContact CD1-CD1 4.41Å; L19-L23 HydrophobicContact CD1-CG 4.38Å; L19-L23 HydrophobicContact CD2-CD1 4.25Å; L19-L23 HydrophobicContact CG-CD1 3.83Å; L19-L23 HydrophobicContact CG-CG 4.18Å; L19-L23 WeakPolarHBondContact O-CB 3.18Å; L19-L23 WeakPolarHBondContact O-CG 3.14Å; L19-L23 PolarHBondContact O-N 3.27Å; Q20-L23 PolarHBondContact O-N 2.88Å; H21-L23 PolarHBondContact O-N 2.85Å; L23-F26 WeakPolarHBondContact O-CB 3.21Å; L23-F225 HydrophobicContact CB-CD1 4.38Å; L23-F225 HydrophobicContact CD1-CD1 3.37Å; L23-F225 HydrophobicContact CD1-CE1 3.51Å; L23-F225 HydrophobicContact CD1-CG 4.37Å; L23-I228 HydrophobicContact CB-CD1 3.44Å; L23-I228 VanDerWaalsContact CB-CD1 3.44Å; L23-I228 HydrophobicContact CB-CG1 4.5Å; L23-I228 HydrophobicContact CD1-CD1 3.95Å; L23-I228 HydrophobicContact CD2-CD1 3.08Å; L23-I228 HydrophobicContact CG-CD1 3.56Å
24T80.4Confident86.7Confident20 Ų2014.7 Ų14.712%0.1238%0.08CC..Hα-helixtrans-76.2-42.2172.3-580000111.3Q20 H21 Y22 F26 P354 V358Q20-T24 PolarHBondContact O-N 2.72Å; Q20-T24 VanDerWaalsContact O-N 3.14Å; Q20-T24 PolarHBondContact O-OG1 3.03Å; H21-T24 WeakPolarHBondContact O-CB 3.22Å; H21-T24 PolarHBondContact O-N 2.88Å; Y22-T24 PolarHBondContact O-N 3.42Å; Y22-T24 VanDerWaalsContact O-N 3.16Å; T24-F26 VanDerWaalsContact C-N 3.27Å; T24-P354 HydrophobicContact CG2-CB 4.4Å; T24-V358 HydrophobicContact CG2-CB 4.06Å; T24-V358 HydrophobicContact CG2-CG2 3.34Å
25C81.3Confident86.6Confident3 Ų314.6 Ų14.62%0.028%0.08CC..Hα-helixtrans-77.6-16.5179.7-165.60000112.9H21 Y22 S27 G28 T29 A79 S352H21-C25 PolarHBondContact O-N 2.85Å; Y22-C25 PolarHBondContact O-N 3.4Å; C25-S27 PolarHBondContact O-N 2.99Å; C25-G28 PolarHBondContact O-N 3.12Å; C25-T29 PolarHBondContact O-N 3.49Å; C25-T29 VanDerWaalsContact O-N 3.08Å; C25-T29 PolarHBondContact O-OG1 3.03Å; C25-A79 WeakPolarHBondContact SG-CB 3.34Å; C25-S352 PolarHBondContact SG-OG 3.48Å; C25-S352 VanDerWaalsContact SG-OG 3.36Å
26F84.6Confident86.6Confident1 Ų111.4 Ų11.40%0.0046%0.063CC..Hα-helixtrans-50.3-49.9-178.1166.8-95.1000113.6Y22 L23 T24 G28 T29 V30 F57 I228 I231 F390 M401Y22-F26 PolarHBondContact O-N 2.94Å; L23-F26 WeakPolarHBondContact O-CB 3.21Å; T24-F26 VanDerWaalsContact C-N 3.27Å; F26-G28 VanDerWaalsContact C-N 3.34Å; F26-G28 PolarHBondContact O-N 3.43Å; F26-T29 PolarHBondContact O-N 3Å; F26-V30 HydrophobicContact CD2-CG2 3.84Å; F26-V30 HydrophobicContact CE1-CG2 4.45Å; F26-V30 HydrophobicContact CE2-CB 4.36Å; F26-V30 HydrophobicContact CE2-CG2 3.32Å; F26-V30 HydrophobicContact CZ-CB 4.23Å; F26-V30 HydrophobicContact CZ-CG1 4.46Å; F26-V30 HydrophobicContact CZ-CG2 3.64Å; F26-V30 WeakPolarHBondContact O-CG2 3.35Å; F26-V30 PolarHBondContact O-N 3.14Å; F26-F57 AromaticContact CD2-CZ 3.8Å; F26-F57 HydrophobicContact CD2-CZ 3.8Å; F26-F57 AromaticContact CE2-CZ 3.86Å; F26-F57 HydrophobicContact CE2-CZ 3.86Å; F26-I228 HydrophobicContact CD1-CD1 4.33Å; F26-I228 HydrophobicContact CD1-CG1 4.38Å; F26-I228 HydrophobicContact CG-CD1 4.48Å; F26-I231 HydrophobicContact CE1-CD1 4.15Å; F26-F390 HydrophobicContact CD2-CE1 4.23Å; F26-F390 HydrophobicContact CD2-CZ 4.24Å; F26-F390 HydrophobicContact CE1-CD1 4.28Å; F26-F390 HydrophobicContact CE1-CE1 4.17Å; F26-F390 HydrophobicContact CE2-CB 4.47Å; F26-F390 AromaticContact CE2-CD1 3.29Å; F26-F390 HydrophobicContact CE2-CD1 3.29Å; F26-F390 AromaticContact CE2-CD2 3.87Å; F26-F390 HydrophobicContact CE2-CD2 3.87Å; F26-F390 AromaticContact CE2-CE1 3.2Å; F26-F390 HydrophobicContact CE2-CE1 3.2Å; F26-F390 AromaticContact CE2-CE2 3.84Å; F26-F390 HydrophobicContact CE2-CE2 3.84Å; F26-F390 AromaticContact CE2-CG 3.59Å; F26-F390 HydrophobicContact CE2-CG 3.59Å; F26-F390 AromaticContact CE2-CZ 3.49Å; F26-F390 HydrophobicContact CE2-CZ 3.49Å; F26-F390 VanDerWaalsContact CE2-CZ 3.49Å; F26-F390 HydrophobicContact CZ-CB 4.48Å; F26-F390 AromaticContact CZ-CD1 3.1Å; F26-F390 HydrophobicContact CZ-CD1 3.1Å; F26-F390 HydrophobicContact CZ-CD2 4.49Å; F26-F390 AromaticContact CZ-CE1 3.21Å; F26-F390 HydrophobicContact CZ-CE1 3.21Å; F26-F390 AromaticContact CZ-CG 3.78Å; F26-F390 HydrophobicContact CZ-CG 3.78Å; F26-F390 HydrophobicContact CZ-CZ 4.01Å; F26-M401 HydrophobicContact CE1-SD 4.48Å
27S81.4Confident86.6Confident4 Ų47.5 Ų7.53%0.0284%0.043CC..Hα-helixtrans-62.1-41.9-174.652.80000112.3C25 A31 M401C25-S27 PolarHBondContact O-N 2.99Å; S27-A31 WeakPolarHBondContact O-CB 3.14Å; S27-A31 PolarHBondContact O-N 3.19Å; S27-M401 WeakPolarHBondContact CB-SD 3.05Å
28G82.1Confident86.5Confident10 Ų1010.2 Ų10.210%0.1036%0.055CC..Hα-helixtrans-67.3-42.7176.300000112.5C25 F26 V30 A31 F82C25-G28 PolarHBondContact O-N 3.12Å; F26-G28 VanDerWaalsContact C-N 3.34Å; F26-G28 PolarHBondContact O-N 3.43Å; G28-V30 PolarHBondContact O-N 2.9Å; G28-A31 PolarHBondContact O-N 2.61Å; G28-F82 VanDerWaalsContact O-CZ 3.23Å; G28-F82 WeakPolarHBondContact O-CZ 3.26Å
29T86.8Confident86.3Confident0 Ų011.3 Ų11.30%06%0.064CC..Hα-helixtrans-68.3-35.3-177.2-52.50000112.6C25 F26 P33 I56 F57 V60 M377C25-T29 PolarHBondContact O-N 3.49Å; C25-T29 VanDerWaalsContact O-N 3.08Å; C25-T29 PolarHBondContact O-OG1 3.03Å; F26-T29 PolarHBondContact O-N 3Å; T29-P33 WeakPolarHBondContact O-CD 3.49Å; T29-I56 HydrophobicContact CG2-CG2 3.23Å; T29-F57 HydrophobicContact CG2-CD1 3.62Å; T29-F57 HydrophobicContact CG2-CE1 3.63Å; T29-V60 HydrophobicContact CG2-CG2 4.15Å; T29-M377 HydrophobicContact CG2-CE 3.81Å
30V88.6Confident86.3Confident0 Ų08.6 Ų8.60%05%0.05CC..Hα-helixtrans-79.3-23.9177.4170.90000113F26 G28 V32 P33 F34 I53 F57F26-V30 HydrophobicContact CD2-CG2 3.84Å; F26-V30 HydrophobicContact CE1-CG2 4.45Å; F26-V30 HydrophobicContact CE2-CB 4.36Å; F26-V30 HydrophobicContact CE2-CG2 3.32Å; F26-V30 HydrophobicContact CZ-CB 4.23Å; F26-V30 HydrophobicContact CZ-CG1 4.46Å; F26-V30 HydrophobicContact CZ-CG2 3.64Å; F26-V30 WeakPolarHBondContact O-CG2 3.35Å; F26-V30 PolarHBondContact O-N 3.14Å; G28-V30 PolarHBondContact O-N 2.9Å; V30-V32 PolarHBondContact O-N 2.96Å; V30-P33 WeakPolarHBondContact O-CD 3.31Å; V30-P33 VanDerWaalsContact O-CG 3.29Å; V30-P33 WeakPolarHBondContact O-CG 3.38Å; V30-F34 HydrophobicContact CG1-CD2 3.77Å; V30-F34 HydrophobicContact CG1-CE2 3.43Å; V30-F34 VanDerWaalsContact CG1-CE2 3.43Å; V30-F34 WeakPolarHBondContact O-CD2 2.94Å; V30-I53 HydrophobicContact CG1-CD1 4.46Å; V30-F57 HydrophobicContact CG2-CE1 3.74Å; V30-F57 HydrophobicContact CG2-CZ 3.39Å
31A88.5Confident86.2Confident0 Ų08.9 Ų8.90%05%0.052CC..Hα-helixtrans-62.1-44.6178.300000112.3S27 G28 F34 L35 F82 F402S27-A31 WeakPolarHBondContact O-CB 3.14Å; S27-A31 PolarHBondContact O-N 3.19Å; G28-A31 PolarHBondContact O-N 2.61Å; A31-F34 PolarHBondContact O-N 3.06Å; A31-F34 VanDerWaalsContact O-N 3.16Å; A31-L35 HydrophobicContact CB-CD1 4.26Å; A31-L35 VanDerWaalsContact O-CG 3.28Å; A31-L35 WeakPolarHBondContact O-CG 3.39Å; A31-L35 PolarHBondContact O-N 3Å; A31-F82 HydrophobicContact CB-CE1 3.71Å; A31-F82 HydrophobicContact CB-CZ 3.68Å; A31-F402 VanDerWaalsContact CA-CE1 3.45Å; A31-F402 HydrophobicContact CB-CD1 3.87Å; A31-F402 HydrophobicContact CB-CE1 3.23Å; A31-F402 HydrophobicContact CB-CZ 3.76Å
32V90.4Very high86.1Confident1 Ų18.8 Ų8.81%0.0065%0.052CC..Hα-helixtrans-56.5-50.6-175.1-178.60000114.1V30 F34 L35 L36 F82 N347V30-V32 PolarHBondContact O-N 2.96Å; V32-F34 VanDerWaalsContact C-N 3.27Å; V32-F34 PolarHBondContact O-N 2.75Å; V32-L35 PolarHBondContact O-N 2.79Å; V32-L36 VanDerWaalsContact O-CB 3.23Å; V32-L36 WeakPolarHBondContact O-CB 3.47Å; V32-L36 PolarHBondContact O-N 2.82Å; V32-F82 HydrophobicContact CG2-CD1 3.91Å; V32-F82 HydrophobicContact CG2-CE1 3.73Å; V32-F82 HydrophobicContact CG2-CZ 4.26Å; V32-N347 HydrophobicContact CG1-CB 3.88Å; V32-N347 WeakPolarHBondContact CG1-ND2 3.4Å
33P91.4Very high85.5Confident1 Ų19.8 Ų9.81%0.0066%0.062CC..Hα-helixtrans-64-30.9179.322.8-32.3000113T29 V30 A37 L52 I53 I56T29-P33 WeakPolarHBondContact O-CD 3.49Å; V30-P33 WeakPolarHBondContact O-CD 3.31Å; V30-P33 VanDerWaalsContact O-CG 3.29Å; V30-P33 WeakPolarHBondContact O-CG 3.38Å; P33-A37 WeakPolarHBondContact O-CB 3.49Å; P33-A37 PolarHBondContact O-N 3.14Å; P33-L52 HydrophobicContact CB-CB 3.89Å; P33-I53 HydrophobicContact CB-CG1 4.06Å; P33-I53 HydrophobicContact CG-CD1 4.49Å; P33-I53 HydrophobicContact CG-CG1 3.5Å; P33-I53 VanDerWaalsContact CG-CG1 3.5Å; P33-I56 HydrophobicContact CB-CD1 3.95Å; P33-I56 HydrophobicContact CG-CD1 3.86Å
34F89.6Confident85.1Confident2 Ų213.6 Ų13.61%0.0098%0.079CC..Hα-helixtrans-68.5-44.2174.8-78.2-58.1000112.5V30 A31 V32 V49 I53 F390 L398 F402V30-F34 HydrophobicContact CG1-CD2 3.77Å; V30-F34 HydrophobicContact CG1-CE2 3.43Å; V30-F34 VanDerWaalsContact CG1-CE2 3.43Å; V30-F34 WeakPolarHBondContact O-CD2 2.94Å; A31-F34 PolarHBondContact O-N 3.06Å; A31-F34 VanDerWaalsContact O-N 3.16Å; V32-F34 VanDerWaalsContact C-N 3.27Å; V32-F34 PolarHBondContact O-N 2.75Å; F34-V49 HydrophobicContact CD1-CG1 3.77Å; F34-V49 HydrophobicContact CE1-CG1 3.53Å; F34-V49 HydrophobicContact CG-CG1 4.5Å; F34-V49 HydrophobicContact CZ-CG1 4.17Å; F34-I53 HydrophobicContact CE2-CD1 4.43Å; F34-I53 HydrophobicContact CZ-CD1 4.38Å; F34-F390 WeakPolarHBondContact CZ-O 3.42Å; F34-L398 HydrophobicContact CD1-CD1 4.03Å; F34-L398 HydrophobicContact CD2-CD1 3.74Å; F34-L398 HydrophobicContact CD2-CD2 3.88Å; F34-L398 HydrophobicContact CD2-CG 4.46Å; F34-L398 HydrophobicContact CE1-CD1 3.99Å; F34-L398 HydrophobicContact CE2-CD1 3.64Å; F34-L398 HydrophobicContact CE2-CD2 3.6Å; F34-L398 HydrophobicContact CE2-CG 4.29Å; F34-L398 HydrophobicContact CG-CD1 3.93Å; F34-L398 HydrophobicContact CZ-CD1 3.77Å; F34-L398 HydrophobicContact CZ-CD2 4.37Å; F34-F402 HydrophobicContact CB-CZ 4.34Å
35L88.4Confident85.2Confident0 Ų012.9 Ų12.90%08%0.075CC..Hα-helixtrans-70.6-37.9179.8-61.4166.1000111.4A31 V32 F82 L85 V169 T172 F402 F406A31-L35 HydrophobicContact CB-CD1 4.26Å; A31-L35 VanDerWaalsContact O-CG 3.28Å; A31-L35 WeakPolarHBondContact O-CG 3.39Å; A31-L35 PolarHBondContact O-N 3Å; V32-L35 PolarHBondContact O-N 2.79Å; L35-F82 HydrophobicContact CD1-CE1 4.29Å; L35-L85 HydrophobicContact CB-CD1 3.85Å; L35-L85 HydrophobicContact CB-CD2 3.63Å; L35-L85 HydrophobicContact CB-CG 4.36Å; L35-L85 HydrophobicContact CD1-CD2 3.4Å; L35-L85 VanDerWaalsContact CD1-CD2 3.4Å; L35-L85 HydrophobicContact CG-CD2 4.1Å; L35-V169 HydrophobicContact CD1-CG1 3.9Å; L35-V169 HydrophobicContact CD2-CG1 4.16Å; L35-T172 HydrophobicContact CD2-CG2 3.22Å; L35-F402 HydrophobicContact CD2-CE2 4.08Å; L35-F402 HydrophobicContact CG-CE2 4.38Å; L35-F406 HydrophobicContact CD1-CZ 4.08Å
36L90.2Very high85.3Confident1 Ų113.6 Ų13.61%0.0058%0.078CC..Hα-helixtrans-72.3-34.7178-170.765.3000112.3V32 E38 A39 M40 L85 A88 L92 I123 I126V32-L36 VanDerWaalsContact O-CB 3.23Å; V32-L36 WeakPolarHBondContact O-CB 3.47Å; V32-L36 PolarHBondContact O-N 2.82Å; L36-E38 VanDerWaalsContact C-N 3.27Å; L36-E38 PolarHBondContact O-N 3.06Å; L36-A39 PolarHBondContact O-N 3.44Å; L36-M40 HydrophobicContact CD2-CE 4.12Å; L36-M40 HydrophobicContact CD2-SD 4.4Å; L36-M40 HydrophobicContact CG-CE 3.87Å; L36-M40 HydrophobicContact CG-CG 4.34Å; L36-M40 HydrophobicContact CG-SD 4.21Å; L36-M40 WeakPolarHBondContact O-CG 3.42Å; L36-M40 PolarHBondContact O-N 2.59Å; L36-L85 HydrophobicContact CB-CD1 4.27Å; L36-L85 HydrophobicContact CD1-CD1 4.49Å; L36-A88 HydrophobicContact CD1-CB 4Å; L36-L92 HydrophobicContact CD1-CD1 4.37Å; L36-I123 HydrophobicContact CD2-CD1 4.03Å; L36-I126 HydrophobicContact CD1-CD1 3.92Å
37A88.4Confident85.4Confident1 Ų115 Ų151%0.0089%0.085CC..Hα-helixtrans-62.6-34.317900000112.8P33 M40 C41 V42 G43 V49P33-A37 WeakPolarHBondContact O-CB 3.49Å; P33-A37 PolarHBondContact O-N 3.14Å; A37-M40 PolarHBondContact O-N 3.23Å; A37-C41 PolarHBondContact O-N 3.03Å; A37-V42 HydrophobicContact CB-CG2 4.34Å; A37-V42 CarbonylContact O-C 3.4Å; A37-V42 PolarHBondContact O-N 3.05Å; A37-G43 PolarHBondContact O-N 2.74Å; A37-V49 HydrophobicContact CB-CG2 3.69Å
38E84.1Confident85.7Confident78 Ų7815 Ų1536%0.3649%0.086SC..Hα-helixtrans-62.8-49.6172-70.2178.2-178.300111L36 M40 C41 R176L36-E38 VanDerWaalsContact C-N 3.27Å; L36-E38 PolarHBondContact O-N 3.06Å; E38-M40 PolarHBondContact O-N 3.3Å; E38-C41 PolarHBondContact O-N 3.3Å; E38-R176 IonicContact OE1-CZ 2.78Å; E38-R176 IonicContact OE1-NE 2.79Å; E38-R176 PolarHBondContact OE1-NE 3.45Å; E38-R176 IonicContact OE1-NH2 3.01Å; E38-R176 PolarHBondContact OE1-NH2 3.17Å
39A85.2Confident86Confident22 Ų2214.6 Ų14.618%0.1828%0.081CC..Hα-helixtrans-62.9-28.4178.400000113.1L36 C41 Q89 L92L36-A39 PolarHBondContact O-N 3.44Å; A39-C41 VanDerWaalsContact C-N 3.29Å; A39-C41 PolarHBondContact O-N 3.19Å; A39-Q89 HydrophobicContact CB-CG 4.01Å; A39-L92 HydrophobicContact CB-CB 4.46Å; A39-L92 HydrophobicContact CB-CD1 3.78Å
40M88.2Confident86.3Confident0 Ų014.8 Ų14.80%08%0.082CC..THydrogen-bonded Turntrans-854.6176.2-69.4-171.6-59.700114.3L36 A37 E38 V42 L52 L92 W119 R122 I123L36-M40 HydrophobicContact CD2-CE 4.12Å; L36-M40 HydrophobicContact CD2-SD 4.4Å; L36-M40 HydrophobicContact CG-CE 3.87Å; L36-M40 HydrophobicContact CG-CG 4.34Å; L36-M40 HydrophobicContact CG-SD 4.21Å; L36-M40 WeakPolarHBondContact O-CG 3.42Å; L36-M40 PolarHBondContact O-N 2.59Å; A37-M40 PolarHBondContact O-N 3.23Å; E38-M40 PolarHBondContact O-N 3.3Å; M40-V42 VanDerWaalsContact C-N 3.27Å; M40-V42 HydrophobicContact CB-CG2 3.87Å; M40-V42 HydrophobicContact CE-CG2 4.36Å; M40-V42 PolarHBondContact O-N 3.38Å; M40-L52 HydrophobicContact CE-CD1 3.61Å; M40-L92 HydrophobicContact CG-CD1 3.7Å; M40-W119 HydrophobicContact CB-CB 4.34Å; M40-R122 HydrophobicContact CG-CB 4.33Å; M40-I123 HydrophobicContact CE-CD1 4.49Å; M40-I123 HydrophobicContact SD-CB 3.97Å; M40-I123 HydrophobicContact SD-CD1 3.75Å; M40-I123 HydrophobicContact SD-CG1 4.38Å
41C84.3Confident86.5Confident11 Ų1116.2 Ų16.27%0.0749%0.089CC..THydrogen-bonded Turntrans6425.3-177.8-35.50000114.2A37 E38 A39 C99 I105 V118A37-C41 PolarHBondContact O-N 3.03Å; E38-C41 PolarHBondContact O-N 3.3Å; A39-C41 VanDerWaalsContact C-N 3.29Å; A39-C41 PolarHBondContact O-N 3.19Å; C41-C99 HydrophobicContact CB-CB 3.84Å; C41-C99 WeakPolarHBondContact CB-SG 3.3Å; C41-C99 WeakPolarHBondContact SG-CA 3.41Å; C41-C99 WeakPolarHBondContact SG-CB 3.3Å; C41-C99 CovalentContact SG-SG 2.03Å; C41-C99 PolarHBondContact SG-SG 2.76Å; C41-I105 HydrophobicContact CB-CD1 4Å; C41-V118 HydrophobicContact CB-CG1 4.14Å
42V82.6Confident86.7Confident0 Ų016.2 Ų16.20%09%0.089CC..  trans-12724.5-176.7-66.70000113.1A37 M40 Q44 D45 T48 T115 W119A37-V42 HydrophobicContact CB-CG2 4.34Å; A37-V42 CarbonylContact O-C 3.4Å; A37-V42 PolarHBondContact O-N 3.05Å; M40-V42 VanDerWaalsContact C-N 3.27Å; M40-V42 HydrophobicContact CB-CG2 3.87Å; M40-V42 HydrophobicContact CE-CG2 4.36Å; M40-V42 PolarHBondContact O-N 3.38Å; V42-Q44 PolarHBondContact O-N 3.45Å; V42-D45 HydrophobicContact CB-CB 4.36Å; V42-D45 PolarHBondContact O-N 3.49Å; V42-T48 HydrophobicContact CG2-CG2 4.3Å; V42-T115 HydrophobicContact CG1-CG2 4.36Å; V42-T115 WeakPolarHBondContact CG1-OG1 3.27Å; V42-W119 HydrophobicContact CG1-CB 3.73Å; V42-W119 HydrophobicContact CG1-CG 4.13Å; V42-W119 HydrophobicContact CG2-CB 4.1Å; V42-W119 HydrophobicContact CG2-CG 4.49Å
43G74.3Confident86.8Confident22 Ų2216.2 Ų16.223%0.2279%0.089CC..THydrogen-bonded Turntrans-57-22.6-178.900000114.9A37 Q46A37-G43 PolarHBondContact O-N 2.74Å; G43-Q46 PolarHBondContact O-NE2 3.09Å
44Q76Confident87Confident108 Ų10816.4 Ų16.451%0.5059%0.091SC..THydrogen-bonded Turntrans-90-18.7176.2-57.4-165-3.900113.9V42 Q46 Y106V42-Q44 PolarHBondContact O-N 3.45Å; Q44-Q46 PolarHBondContact O-N 3.06Å; Q44-Y106 HydrophobicContact CB-CE1 3.94Å; Q44-Y106 HydrophobicContact CG-CE2 4.49Å
45D82.3Confident87.3Confident6 Ų616.4 Ų16.43%0.0329%0.091CC..  trans-8382.4178.2-177-3000110.8V42 N47 T48 V49 T115V42-D45 HydrophobicContact CB-CB 4.36Å; V42-D45 PolarHBondContact O-N 3.49Å; D45-N47 PolarHBondContact O-N 3.44Å; D45-N47 WeakPolarHBondContact OD1-CB 3.37Å; D45-N47 PolarHBondContact OD1-N 3.3Å; D45-T48 VanDerWaalsContact CG-OG1 3.24Å; D45-T48 WeakPolarHBondContact O-CB 3.22Å; D45-T48 PolarHBondContact O-N 3.39Å; D45-T48 VanDerWaalsContact O-N 3.12Å; D45-T48 PolarHBondContact OD1-N 3.26Å; D45-T48 VanDerWaalsContact OD1-N 3.11Å; D45-T48 WeakPolarHBondContact OD2-CB 3.24Å; D45-T48 PolarHBondContact OD2-OG1 3.4Å; D45-V49 PolarHBondContact O-N 2.89Å; D45-V49 VanDerWaalsContact O-N 3.12Å; D45-T115 HydrophobicContact CB-CG2 4.18Å; D45-T115 PolarHBondContact OD2-OG1 2.87Å
46Q83.8Confident87.6Confident18 Ų1816.4 Ų16.48%0.0849%0.091CC..Hα-helixtrans-67.6-19.1-177.9-56-52.2-35.900113.7G43 Q44 S50 R263 I266 A391G43-Q46 PolarHBondContact O-NE2 3.09Å; Q44-Q46 PolarHBondContact O-N 3.06Å; Q46-S50 WeakPolarHBondContact O-CB 3.48Å; Q46-S50 PolarHBondContact O-N 3.36Å; Q46-R263 VanDerWaalsContact CD-NH1 3.35Å; Q46-R263 HydrophobicContact CG-CB 4.07Å; Q46-R263 HydrophobicContact CG-CG 4.13Å; Q46-I266 HydrophobicContact CB-CD1 3.27Å; Q46-I266 HydrophobicContact CB-CG1 3.77Å; Q46-I266 HydrophobicContact CG-CD1 3.83Å; Q46-A391 PolarHBondContact OE1-O 3.1Å
47N86Confident87.8Confident29 Ų2916.3 Ų16.316%0.1559%0.091CC..Hα-helixtrans-68-45.7172.2-174.48.2000109.6D45 V49 S50 Q51D45-N47 PolarHBondContact O-N 3.44Å; D45-N47 WeakPolarHBondContact OD1-CB 3.37Å; D45-N47 PolarHBondContact OD1-N 3.3Å; N47-V49 VanDerWaalsContact C-N 3.35Å; N47-V49 PolarHBondContact O-N 2.9Å; N47-S50 WeakPolarHBondContact O-CB 3.48Å; N47-S50 PolarHBondContact O-N 3.46Å; N47-Q51 VanDerWaalsContact O-CG 3.26Å; N47-Q51 WeakPolarHBondContact O-CG 3.27Å; N47-Q51 PolarHBondContact O-N 2.87Å; N47-Q51 PolarHBondContact OD1-NE2 3.31Å
48T87.6Confident88.1Confident6 Ų616.3 Ų16.34%0.0379%0.09CC..Hα-helixtrans-59.9-44.3173.4-67.40000111.5V42 D45 S50 Q51 L52 W119V42-T48 HydrophobicContact CG2-CG2 4.3Å; D45-T48 VanDerWaalsContact CG-OG1 3.24Å; D45-T48 WeakPolarHBondContact O-CB 3.22Å; D45-T48 PolarHBondContact O-N 3.39Å; D45-T48 VanDerWaalsContact O-N 3.12Å; D45-T48 PolarHBondContact OD1-N 3.26Å; D45-T48 VanDerWaalsContact OD1-N 3.11Å; D45-T48 WeakPolarHBondContact OD2-CB 3.24Å; D45-T48 PolarHBondContact OD2-OG1 3.4Å; T48-S50 VanDerWaalsContact C-N 3.35Å; T48-S50 PolarHBondContact O-N 2.86Å; T48-Q51 WeakPolarHBondContact O-CB 3.49Å; T48-Q51 PolarHBondContact O-N 2.85Å; T48-Q51 VanDerWaalsContact O-N 3.16Å; T48-L52 HydrophobicContact CG2-CD1 4.25Å; T48-L52 WeakPolarHBondContact O-CG 3.4Å; T48-L52 PolarHBondContact O-N 3.3Å; T48-W119 HydrophobicContact CG2-CD2 4.01Å; T48-W119 HydrophobicContact CG2-CG 4.39Å; T48-W119 HydrophobicContact CG2-CH2 4.17Å; T48-W119 HydrophobicContact CG2-CZ2 3.68Å; T48-W119 PolarHBondContact OG1-NE1 3.24Å
49V90.4Very high88.7Confident1 Ų112.8 Ų12.81%0.0067%0.074CC..Hα-helixtrans-59.6-44.4175.6-179.40000111.7F34 A37 D45 N47 Q51 L52 I53F34-V49 HydrophobicContact CD1-CG1 3.77Å; F34-V49 HydrophobicContact CE1-CG1 3.53Å; F34-V49 HydrophobicContact CG-CG1 4.5Å; F34-V49 HydrophobicContact CZ-CG1 4.17Å; A37-V49 HydrophobicContact CB-CG2 3.69Å; D45-V49 PolarHBondContact O-N 2.89Å; D45-V49 VanDerWaalsContact O-N 3.12Å; N47-V49 VanDerWaalsContact C-N 3.35Å; N47-V49 PolarHBondContact O-N 2.9Å; V49-Q51 VanDerWaalsContact C-N 3.32Å; V49-Q51 PolarHBondContact O-N 3.22Å; V49-L52 PolarHBondContact O-N 3.2Å; V49-I53 HydrophobicContact CG1-CD1 3.99Å; V49-I53 HydrophobicContact CG1-CG1 4.45Å; V49-I53 WeakPolarHBondContact O-CG1 3.33Å; V49-I53 PolarHBondContact O-N 3.21Å
50S91.9Very high89.2Confident3 Ų311.9 Ų11.92%0.0217%0.067CC..Hα-helixtrans-58.5-42.3175.1177.70000112.2Q46 N47 T48 L52 I53 G54 T387 A388Q46-S50 WeakPolarHBondContact O-CB 3.48Å; Q46-S50 PolarHBondContact O-N 3.36Å; N47-S50 WeakPolarHBondContact O-CB 3.48Å; N47-S50 PolarHBondContact O-N 3.46Å; T48-S50 VanDerWaalsContact C-N 3.35Å; T48-S50 PolarHBondContact O-N 2.86Å; S50-L52 PolarHBondContact O-N 2.9Å; S50-I53 PolarHBondContact O-N 3.42Å; S50-G54 PolarHBondContact O-N 2.85Å; S50-T387 WeakPolarHBondContact O-CB 3.31Å; S50-T387 PolarHBondContact O-OG1 3.43Å; S50-T387 VanDerWaalsContact OG-C 3.31Å; S50-T387 PolarHBondContact OG-OG1 3.34Å; S50-A388 WeakPolarHBondContact OG-CA 3.24Å; S50-A388 PolarHBondContact OG-N 2.94Å
51Q92.1Very high89.5Confident30 Ų3011.9 Ų11.914%0.147%0.067CC..Hα-helixtrans-65.8-37.9178-66171.83700112.4N47 T48 V49 G54 T55 R274 W281N47-Q51 VanDerWaalsContact O-CG 3.26Å; N47-Q51 WeakPolarHBondContact O-CG 3.27Å; N47-Q51 PolarHBondContact O-N 2.87Å; N47-Q51 PolarHBondContact OD1-NE2 3.31Å; T48-Q51 WeakPolarHBondContact O-CB 3.49Å; T48-Q51 PolarHBondContact O-N 2.85Å; T48-Q51 VanDerWaalsContact O-N 3.16Å; V49-Q51 VanDerWaalsContact C-N 3.32Å; V49-Q51 PolarHBondContact O-N 3.22Å; Q51-G54 PolarHBondContact O-N 3.38Å; Q51-T55 WeakPolarHBondContact O-CB 3.5Å; Q51-T55 PolarHBondContact O-N 3.18Å; Q51-T55 PolarHBondContact O-OG1 3.11Å; Q51-R274 VanDerWaalsContact CG-NH1 3.32Å; Q51-R274 VanDerWaalsContact OE1-CZ 3.29Å; Q51-W281 HydrophobicContact CB-CH2 4.04Å
52L93.2Very high90.1Very high1 Ų113.4 Ų13.41%0.0057%0.073CC..Hα-helixtrans-66.8-44.3174.4-70.5168.4000111.2P33 M40 T48 V49 S50 G54 T55 I56 W281P33-L52 HydrophobicContact CB-CB 3.89Å; M40-L52 HydrophobicContact CE-CD1 3.61Å; T48-L52 HydrophobicContact CG2-CD1 4.25Å; T48-L52 WeakPolarHBondContact O-CG 3.4Å; T48-L52 PolarHBondContact O-N 3.3Å; V49-L52 PolarHBondContact O-N 3.2Å; S50-L52 PolarHBondContact O-N 2.9Å; L52-G54 VanDerWaalsContact C-N 3.33Å; L52-G54 PolarHBondContact O-N 3.38Å; L52-T55 PolarHBondContact O-N 3.27Å; L52-I56 WeakPolarHBondContact O-CB 3.36Å; L52-I56 VanDerWaalsContact O-CG1 3.27Å; L52-I56 WeakPolarHBondContact O-CG1 3.38Å; L52-I56 PolarHBondContact O-N 2.88Å; L52-W281 HydrophobicContact CD2-CZ2 4.4Å
53I93.6Very high90.7Very high1 Ų113.4 Ų13.41%0.0057%0.073CC..Hα-helixtrans-55.5-48.3174.3-69.7166.9000110.5V30 P33 F34 V49 S50 T55 I56 F57 T387 F390 A391V30-I53 HydrophobicContact CG1-CD1 4.46Å; P33-I53 HydrophobicContact CB-CG1 4.06Å; P33-I53 HydrophobicContact CG-CD1 4.49Å; P33-I53 HydrophobicContact CG-CG1 3.5Å; P33-I53 VanDerWaalsContact CG-CG1 3.5Å; F34-I53 HydrophobicContact CE2-CD1 4.43Å; F34-I53 HydrophobicContact CZ-CD1 4.38Å; V49-I53 HydrophobicContact CG1-CD1 3.99Å; V49-I53 HydrophobicContact CG1-CG1 4.45Å; V49-I53 WeakPolarHBondContact O-CG1 3.33Å; V49-I53 PolarHBondContact O-N 3.21Å; S50-I53 PolarHBondContact O-N 3.42Å; I53-T55 PolarHBondContact O-N 3.3Å; I53-I56 PolarHBondContact O-N 2.69Å; I53-F57 HydrophobicContact CG2-CD2 3.93Å; I53-F57 HydrophobicContact CG2-CE1 4.27Å; I53-F57 HydrophobicContact CG2-CE2 3.59Å; I53-F57 HydrophobicContact CG2-CG 4.41Å; I53-F57 HydrophobicContact CG2-CZ 3.79Å; I53-F57 WeakPolarHBondContact O-CB 3.36Å; I53-F57 WeakPolarHBondContact O-CG 3.45Å; I53-F57 PolarHBondContact O-N 3.19Å; I53-T387 HydrophobicContact CG2-CG2 4.33Å; I53-F390 HydrophobicContact CD1-CB 4.27Å; I53-A391 HydrophobicContact CD1-CB 4.14Å
54G94.3Very high91.8Very high5 Ų512.3 Ų12.35%0.0526%0.062CC..Hα-helixtrans-62.3-41.2177.500000113.7S50 Q51 L52 F57 T58 G381S50-G54 PolarHBondContact O-N 2.85Å; Q51-G54 PolarHBondContact O-N 3.38Å; L52-G54 VanDerWaalsContact C-N 3.33Å; L52-G54 PolarHBondContact O-N 3.38Å; G54-F57 PolarHBondContact O-N 3.43Å; G54-T58 WeakPolarHBondContact O-CB 3.46Å; G54-T58 PolarHBondContact O-N 3.23Å; G54-T58 PolarHBondContact O-OG1 2.91Å; G54-G381 CarbonylContact C-O 3.53Å; G54-G381 VanDerWaalsContact CA-O 3.22Å; G54-G381 WeakPolarHBondContact CA-O 3.39Å
55T95.4Very high92.8Very high1 Ų110.1 Ų10.11%0.0065%0.054CC..Hα-helixtrans-61.8-45.6176-60.30000111.5Q51 L52 I53 T59 P276 Q280 L343 T345Q51-T55 WeakPolarHBondContact O-CB 3.5Å; Q51-T55 PolarHBondContact O-N 3.18Å; Q51-T55 PolarHBondContact O-OG1 3.11Å; L52-T55 PolarHBondContact O-N 3.27Å; I53-T55 PolarHBondContact O-N 3.3Å; T55-T59 WeakPolarHBondContact O-CB 3.38Å; T55-T59 PolarHBondContact O-N 2.98Å; T55-T59 PolarHBondContact O-OG1 2.85Å; T55-P276 HydrophobicContact CG2-CB 4.17Å; T55-P276 HydrophobicContact CG2-CG 4.42Å; T55-Q280 VanDerWaalsContact CG2-NE2 3.32Å; T55-Q280 PolarHBondContact OG1-NE2 3.41Å; T55-Q280 VanDerWaalsContact OG1-NE2 3.07Å; T55-L343 HydrophobicContact CG2-CB 4.33Å; T55-L343 WeakPolarHBondContact CG2-O 3.31Å; T55-T345 HydrophobicContact CG2-CG2 4.12Å
56I95.1Very high93.5Very high0 Ų011.8 Ų11.80%06%0.062CC..Hα-helixtrans-64.9-49.3178.3-69.6169.6000110.7T29 P33 L52 I53 T58 T59 V60 S80 T345 N347T29-I56 HydrophobicContact CG2-CG2 3.23Å; P33-I56 HydrophobicContact CB-CD1 3.95Å; P33-I56 HydrophobicContact CG-CD1 3.86Å; L52-I56 WeakPolarHBondContact O-CB 3.36Å; L52-I56 VanDerWaalsContact O-CG1 3.27Å; L52-I56 WeakPolarHBondContact O-CG1 3.38Å; L52-I56 PolarHBondContact O-N 2.88Å; I53-I56 PolarHBondContact O-N 2.69Å; I56-T58 VanDerWaalsContact C-N 3.33Å; I56-T58 PolarHBondContact O-N 2.97Å; I56-T59 PolarHBondContact O-N 3.49Å; I56-T59 VanDerWaalsContact O-N 3.14Å; I56-V60 HydrophobicContact CG2-CG2 4.12Å; I56-V60 WeakPolarHBondContact O-CB 3.47Å; I56-V60 VanDerWaalsContact O-CG2 3.32Å; I56-V60 WeakPolarHBondContact O-CG2 3.32Å; I56-V60 PolarHBondContact O-N 3.5Å; I56-S80 WeakPolarHBondContact CG2-OG 3.39Å; I56-T345 HydrophobicContact CG1-CG2 4.04Å; I56-N347 WeakPolarHBondContact CD1-ND2 3.48Å
57F94.8Very high94Very high0 Ų011 Ų110%06%0.059CC..Hα-helixtrans-59.6-44179.3-73.9-6000112.7F26 T29 V30 I53 G54 T59 V60 G61 M377 F386 F390F26-F57 AromaticContact CD2-CZ 3.8Å; F26-F57 HydrophobicContact CD2-CZ 3.8Å; F26-F57 AromaticContact CE2-CZ 3.86Å; F26-F57 HydrophobicContact CE2-CZ 3.86Å; T29-F57 HydrophobicContact CG2-CD1 3.62Å; T29-F57 HydrophobicContact CG2-CE1 3.63Å; V30-F57 HydrophobicContact CG2-CE1 3.74Å; V30-F57 HydrophobicContact CG2-CZ 3.39Å; I53-F57 HydrophobicContact CG2-CD2 3.93Å; I53-F57 HydrophobicContact CG2-CE1 4.27Å; I53-F57 HydrophobicContact CG2-CE2 3.59Å; I53-F57 HydrophobicContact CG2-CG 4.41Å; I53-F57 HydrophobicContact CG2-CZ 3.79Å; I53-F57 WeakPolarHBondContact O-CB 3.36Å; I53-F57 WeakPolarHBondContact O-CG 3.45Å; I53-F57 PolarHBondContact O-N 3.19Å; G54-F57 PolarHBondContact O-N 3.43Å; F57-T59 VanDerWaalsContact C-N 3.32Å; F57-T59 PolarHBondContact O-N 3Å; F57-V60 PolarHBondContact O-N 2.82Å; F57-G61 PolarHBondContact O-N 3.29Å; F57-M377 HydrophobicContact CB-CE 4.47Å; F57-M377 HydrophobicContact CB-CG 4.28Å; F57-M377 HydrophobicContact CD1-CE 3.59Å; F57-M377 HydrophobicContact CE1-CE 4.17Å; F57-M377 HydrophobicContact CG-CE 4.27Å; F57-M377 WeakPolarHBondContact O-CG 3.38Å; F57-F386 HydrophobicContact CD2-CE1 4.25Å; F57-F386 HydrophobicContact CE2-CE1 4.03Å; F57-F390 HydrophobicContact CE2-CD2 4.06Å; F57-F390 HydrophobicContact CE2-CE2 4.27Å
58T95.4Very high94.4Very high0 Ų09.7 Ų9.70%05%0.052CC..Hα-helixtrans-60.9-45.6176.1-52.60000110.7G54 I56 G61 I62 M275 P276 F378 G381 T382G54-T58 WeakPolarHBondContact O-CB 3.46Å; G54-T58 PolarHBondContact O-N 3.23Å; G54-T58 PolarHBondContact O-OG1 2.91Å; I56-T58 VanDerWaalsContact C-N 3.33Å; I56-T58 PolarHBondContact O-N 2.97Å; T58-G61 PolarHBondContact O-N 2.91Å; T58-I62 HydrophobicContact CG2-CD1 4.24Å; T58-I62 WeakPolarHBondContact O-CG1 3.33Å; T58-I62 PolarHBondContact O-N 3.42Å; T58-I62 VanDerWaalsContact O-N 3.13Å; T58-M275 HydrophobicContact CG2-CE 4.38Å; T58-M275 HydrophobicContact CG2-SD 4.3Å; T58-P276 HydrophobicContact CG2-CG 4.1Å; T58-F378 HydrophobicContact CG2-CD2 3.58Å; T58-F378 HydrophobicContact CG2-CE2 3.59Å; T58-G381 VanDerWaalsContact OG1-C 3.32Å; T58-T382 HydrophobicContact CG2-CG2 4.15Å
59T95.9Very high94.7Very high4 Ų411.5 Ų11.53%0.0256%0.063CC..Hα-helixtrans-64.2-47.6-179.7-56.90000111.5T55 I56 F57 G61 I62 T63 A340 L343 T345T55-T59 WeakPolarHBondContact O-CB 3.38Å; T55-T59 PolarHBondContact O-N 2.98Å; T55-T59 PolarHBondContact O-OG1 2.85Å; I56-T59 PolarHBondContact O-N 3.49Å; I56-T59 VanDerWaalsContact O-N 3.14Å; F57-T59 VanDerWaalsContact C-N 3.32Å; F57-T59 PolarHBondContact O-N 3Å; T59-G61 VanDerWaalsContact C-N 3.27Å; T59-G61 PolarHBondContact O-N 3.36Å; T59-I62 CarbonylContact O-C 3.57Å; T59-I62 WeakPolarHBondContact O-CA 3.34Å; T59-I62 WeakPolarHBondContact O-CB 3.41Å; T59-I62 PolarHBondContact O-N 2.98Å; T59-T63 HydrophobicContact CG2-CG2 3.98Å; T59-T63 WeakPolarHBondContact O-CG2 3.28Å; T59-T63 PolarHBondContact O-N 3.17Å; T59-T63 PolarHBondContact O-OG1 3.35Å; T59-A340 HydrophobicContact CG2-CB 3.79Å; T59-L343 HydrophobicContact CG2-CD1 4.3Å; T59-L343 VanDerWaalsContact OG1-CD1 3.3Å; T59-L343 WeakPolarHBondContact OG1-CD1 3.37Å; T59-T345 HydrophobicContact CG2-CG2 3.78Å; T59-T345 VanDerWaalsContact OG1-CG2 3.28Å; T59-T345 WeakPolarHBondContact OG1-CG2 3.29Å
60V95.1Very high94.7Very high4 Ų415.6 Ų15.62%0.0248%0.084CC..Hα-helixtrans-60.7-37.3178.7172.80000111.6T29 I56 F57 T63 T64 Q78 M377T29-V60 HydrophobicContact CG2-CG2 4.15Å; I56-V60 HydrophobicContact CG2-CG2 4.12Å; I56-V60 WeakPolarHBondContact O-CB 3.47Å; I56-V60 VanDerWaalsContact O-CG2 3.32Å; I56-V60 WeakPolarHBondContact O-CG2 3.32Å; I56-V60 PolarHBondContact O-N 3.5Å; F57-V60 PolarHBondContact O-N 2.82Å; V60-T63 WeakPolarHBondContact CA-OG1 3.48Å; V60-T63 PolarHBondContact O-OG1 3.28Å; V60-T64 WeakPolarHBondContact O-CB 3.38Å; V60-T64 PolarHBondContact O-N 2.85Å; V60-T64 PolarHBondContact O-OG1 3.01Å; V60-Q78 WeakPolarHBondContact CG1-O 3.37Å; V60-M377 HydrophobicContact CB-CE 3.58Å; V60-M377 HydrophobicContact CB-SD 3.88Å; V60-M377 HydrophobicContact CG1-CE 3.46Å; V60-M377 VanDerWaalsContact CG1-CE 3.46Å; V60-M377 HydrophobicContact CG1-SD 3.4Å; V60-M377 WeakPolarHBondContact CG1-SD 3.34Å; V60-M377 HydrophobicContact CG2-CE 4.15Å
61G95.8Very high94.8Very high0 Ų015.4 Ų15.40%08%0.083CC..Hα-helixtrans-59.5-45.7171.900000112.1F57 T58 T59 L65 A374F57-G61 PolarHBondContact O-N 3.29Å; T58-G61 PolarHBondContact O-N 2.91Å; T59-G61 VanDerWaalsContact C-N 3.27Å; T59-G61 PolarHBondContact O-N 3.36Å; G61-L65 VanDerWaalsContact O-CG 3.26Å; G61-L65 WeakPolarHBondContact O-CG 3.48Å; G61-L65 PolarHBondContact O-N 3.3Å; G61-L65 VanDerWaalsContact O-N 3.16Å; G61-A374 WeakPolarHBondContact CA-O 2.93Å
62I96.4Very high94.8Very high42 Ų4214 Ų1422%0.2158%0.076CC..Hα-helixtrans-63.9-52.2176.8-65.1164.3000110.9T58 T59 T64 L65 I66 L343 F378T58-I62 HydrophobicContact CG2-CD1 4.24Å; T58-I62 WeakPolarHBondContact O-CG1 3.33Å; T58-I62 PolarHBondContact O-N 3.42Å; T58-I62 VanDerWaalsContact O-N 3.13Å; T59-I62 CarbonylContact O-C 3.57Å; T59-I62 WeakPolarHBondContact O-CA 3.34Å; T59-I62 WeakPolarHBondContact O-CB 3.41Å; T59-I62 PolarHBondContact O-N 2.98Å; I62-T64 VanDerWaalsContact C-N 3.35Å; I62-T64 PolarHBondContact O-N 3.28Å; I62-L65 WeakPolarHBondContact O-CB 3.22Å; I62-L65 PolarHBondContact O-N 3.42Å; I62-I66 HydrophobicContact CG2-CD1 3.71Å; I62-I66 HydrophobicContact CG2-CG1 4.4Å; I62-I66 WeakPolarHBondContact O-CG1 3.4Å; I62-I66 PolarHBondContact O-N 3.45Å; I62-L343 HydrophobicContact CD1-CD1 4.19Å; I62-F378 HydrophobicContact CD1-CD2 4.28Å; I62-F378 HydrophobicContact CD1-CE2 4.11Å; I62-F378 HydrophobicContact CG1-CD2 3.86Å; I62-F378 HydrophobicContact CG1-CE2 4.06Å
63T96.4Very high94.7Very high0 Ų015.3 Ų15.30%08%0.081CC..Hα-helixtrans-65.5-38.5-175.161.70000111.6T59 V60 L65 I66 Q67 Q78 C336 S349T59-T63 HydrophobicContact CG2-CG2 3.98Å; T59-T63 WeakPolarHBondContact O-CG2 3.28Å; T59-T63 PolarHBondContact O-N 3.17Å; T59-T63 PolarHBondContact O-OG1 3.35Å; V60-T63 WeakPolarHBondContact CA-OG1 3.48Å; V60-T63 PolarHBondContact O-OG1 3.28Å; T63-L65 PolarHBondContact O-N 3.18Å; T63-I66 PolarHBondContact O-N 3.22Å; T63-Q67 WeakPolarHBondContact O-CB 3.41Å; T63-Q67 PolarHBondContact O-N 3.04Å; T63-Q78 WeakPolarHBondContact OG1-CB 3.34Å; T63-C336 VanDerWaalsContact CB-SG 3.59Å; T63-C336 HydrophobicContact CG2-CB 3.44Å; T63-C336 VanDerWaalsContact CG2-CB 3.44Å; T63-S349 WeakPolarHBondContact CB-OG 3.37Å; T63-S349 PolarHBondContact OG1-OG 3.46Å
64T96.3Very high94.7Very high0 Ų015.2 Ų15.20%08%0.08CC..Hα-helixtrans-62.9-42.1173.8-58.90000111.7V60 I62 Q67 T68 F77 Q78 V370 A374V60-T64 WeakPolarHBondContact O-CB 3.38Å; V60-T64 PolarHBondContact O-N 2.85Å; V60-T64 PolarHBondContact O-OG1 3.01Å; I62-T64 VanDerWaalsContact C-N 3.35Å; I62-T64 PolarHBondContact O-N 3.28Å; T64-Q67 PolarHBondContact O-N 3.1Å; T64-T68 HydrophobicContact CG2-CG2 4.06Å; T64-T68 WeakPolarHBondContact O-CB 3.5Å; T64-T68 WeakPolarHBondContact O-CG2 3.47Å; T64-T68 PolarHBondContact O-N 3.34Å; T64-T68 PolarHBondContact O-OG1 3.23Å; T64-F77 HydrophobicContact CG2-CD1 4.12Å; T64-F77 HydrophobicContact CG2-CE1 4.43Å; T64-F77 HydrophobicContact CG2-CG 4.28Å; T64-Q78 WeakPolarHBondContact OG1-CB 3.5Å; T64-Q78 PolarHBondContact OG1-N 3.45Å; T64-V370 HydrophobicContact CG2-CG1 3.72Å; T64-A374 HydrophobicContact CG2-CB 3.64Å
65L96.7Very high94.6Very high61 Ų6115.1 Ų15.132%0.3198%0.079SC..Hα-helixtrans-61.8-44.8175.4-74.2170.4000111.1G61 I62 T63 T68 T69 Q371 A374G61-L65 VanDerWaalsContact O-CG 3.26Å; G61-L65 WeakPolarHBondContact O-CG 3.48Å; G61-L65 PolarHBondContact O-N 3.3Å; G61-L65 VanDerWaalsContact O-N 3.16Å; I62-L65 WeakPolarHBondContact O-CB 3.22Å; I62-L65 PolarHBondContact O-N 3.42Å; T63-L65 PolarHBondContact O-N 3.18Å; L65-T68 PolarHBondContact O-OG1 3.47Å; L65-T69 VanDerWaalsContact O-CB 3.26Å; L65-T69 WeakPolarHBondContact O-CB 3.38Å; L65-T69 WeakPolarHBondContact O-CG2 3.26Å; L65-T69 PolarHBondContact O-N 3.34Å; L65-T69 VanDerWaalsContact O-N 3.1Å; L65-T69 PolarHBondContact O-OG1 2.97Å; L65-Q371 HydrophobicContact CD2-CB 4.07Å; L65-Q371 HydrophobicContact CD2-CG 4.26Å; L65-A374 HydrophobicContact CD2-CB 4.05Å; L65-A374 HydrophobicContact CG-CB 3.84Å
66I96.4Very high94.3Very high42 Ų4215.1 Ų15.122%0.2158%0.079CC..Hα-helixtrans-63.2-48.1178.6-63.4170000110.5I62 T63 T68 T69 I70 G71 T332 I339I62-I66 HydrophobicContact CG2-CD1 3.71Å; I62-I66 HydrophobicContact CG2-CG1 4.4Å; I62-I66 WeakPolarHBondContact O-CG1 3.4Å; I62-I66 PolarHBondContact O-N 3.45Å; T63-I66 PolarHBondContact O-N 3.22Å; I66-T68 PolarHBondContact O-N 3.18Å; I66-T69 PolarHBondContact O-N 3.16Å; I66-T69 PolarHBondContact O-OG1 2.92Å; I66-I70 PolarHBondContact O-N 3.26Å; I66-G71 PolarHBondContact O-N 2.69Å; I66-T332 HydrophobicContact CG2-CG2 3.41Å; I66-T332 VanDerWaalsContact CG2-CG2 3.41Å; I66-I339 HydrophobicContact CD1-CD1 3.66Å
67Q95.6Very high94.1Very high1 Ų115.1 Ų15.11%0.0058%0.079CC..Hα-helixtrans-66.7-38.4-175.7-166.467.5-8.600113T63 T64 G71 V72 R73 Q78 Y309 G329T63-Q67 WeakPolarHBondContact O-CB 3.41Å; T63-Q67 PolarHBondContact O-N 3.04Å; T64-Q67 PolarHBondContact O-N 3.1Å; Q67-G71 CarbonylContact O-C 3.47Å; Q67-G71 WeakPolarHBondContact O-CA 3.31Å; Q67-G71 PolarHBondContact O-N 3.31Å; Q67-V72 HydrophobicContact CG-CG1 4.29Å; Q67-V72 PolarHBondContact O-N 2.74Å; Q67-R73 PolarHBondContact O-N 2.99Å; Q67-Q78 HydrophobicContact CB-CG 3.88Å; Q67-Q78 HydrophobicContact CG-CG 4.2Å; Q67-Y309 PolarHBondContact NE2-OH 3.17Å; Q67-G329 PolarHBondContact NE2-O 2.95Å; Q67-G329 PolarHBondContact OE1-O 3.35Å
68T94.4Very high94.1Very high1 Ų115.1 Ų15.11%0.0068%0.079CC..Hα-helixtrans-79.5-21.2179.760.10000113.2T64 L65 I66 L76 V370 Q371T64-T68 HydrophobicContact CG2-CG2 4.06Å; T64-T68 WeakPolarHBondContact O-CB 3.5Å; T64-T68 WeakPolarHBondContact O-CG2 3.47Å; T64-T68 PolarHBondContact O-N 3.34Å; T64-T68 PolarHBondContact O-OG1 3.23Å; L65-T68 PolarHBondContact O-OG1 3.47Å; I66-T68 PolarHBondContact O-N 3.18Å; T68-L76 VanDerWaalsContact CG2-O 3.29Å; T68-L76 WeakPolarHBondContact CG2-O 3.43Å; T68-V370 HydrophobicContact CG2-CG1 3.68Å; T68-Q371 WeakPolarHBondContact OG1-CG 3.47Å
69T92.6Very high93.7Very high44 Ų4415.5 Ų15.527%0.278%0.082SC..Hα-helixtrans-93.6-49.8179.7550000112.9L65 I66 R73L65-T69 VanDerWaalsContact O-CB 3.26Å; L65-T69 WeakPolarHBondContact O-CB 3.38Å; L65-T69 WeakPolarHBondContact O-CG2 3.26Å; L65-T69 PolarHBondContact O-N 3.34Å; L65-T69 VanDerWaalsContact O-N 3.1Å; L65-T69 PolarHBondContact O-OG1 2.97Å; I66-T69 PolarHBondContact O-N 3.16Å; I66-T69 PolarHBondContact O-OG1 2.92Å; T69-R73 PolarHBondContact O-NE 2.65Å
70I91.8Very high93.4Very high87 Ų8715.6 Ų15.645%0.4468%0.083SC..THydrogen-bonded Turntrans-113.4-36.5-171.5-60.2172.1000111.9I66 R328 F519I66-I70 PolarHBondContact O-N 3.26Å; I70-R328 WeakPolarHBondContact O-CD 3.3Å; I70-R328 PolarHBondContact O-NE 3.41Å; I70-F519 HydrophobicContact CG2-CE1 4.5Å
71G93.1Very high93.1Very high0 Ų015.4 Ų15.40%08%0.081CC..SBendtrans-67.8-128.7-176.200000113.9I66 Q67 R73 R328 T332I66-G71 PolarHBondContact O-N 2.69Å; Q67-G71 CarbonylContact O-C 3.47Å; Q67-G71 WeakPolarHBondContact O-CA 3.31Å; Q67-G71 PolarHBondContact O-N 3.31Å; G71-R73 PolarHBondContact O-N 3.42Å; G71-R328 PolarHBondContact O-NE 3.27Å; G71-R328 PolarHBondContact O-NH2 3.09Å; G71-T332 WeakPolarHBondContact CA-OG1 3.39Å
72V91.8Very high92.7Very high0 Ų016.4 Ų16.40%09%0.086CC..SBendtrans-66.1-19.9-179.970.60000112.7Q67 L74 L76 Y309 Y517Q67-V72 HydrophobicContact CG-CG1 4.29Å; Q67-V72 PolarHBondContact O-N 2.74Å; V72-L74 HydrophobicContact CG1-CB 4Å; V72-L74 HydrophobicContact CG1-CD1 4.33Å; V72-L74 HydrophobicContact CG1-CG 4.27Å; V72-L74 HydrophobicContact CG2-CD1 3.79Å; V72-L74 HydrophobicContact CG2-CG 4.05Å; V72-L74 PolarHBondContact O-N 2.95Å; V72-L76 HydrophobicContact CG1-CD1 3.95Å; V72-Y309 HydrophobicContact CB-CD1 4.42Å; V72-Y309 HydrophobicContact CB-CD2 4.47Å; V72-Y309 HydrophobicContact CB-CE1 4.26Å; V72-Y309 HydrophobicContact CB-CE2 4.3Å; V72-Y309 HydrophobicContact CG1-CD1 4.04Å; V72-Y309 HydrophobicContact CG1-CE1 3.86Å; V72-Y309 HydrophobicContact CG2-CD1 4.21Å; V72-Y309 HydrophobicContact CG2-CD2 3.93Å; V72-Y309 HydrophobicContact CG2-CE2 4.22Å; V72-Y309 HydrophobicContact CG2-CG 3.93Å; V72-Y517 WeakPolarHBondContact O-CD1 3.34Å
73R92.8Very high92.1Very high28 Ų2814.4 Ų14.411%0.1068%0.076CC..  trans59.827.1-178.4-55.7-171.873.5-141.40.6114.6Q67 T69 G71 R367 T515 S516 D518Q67-R73 PolarHBondContact O-N 2.99Å; T69-R73 PolarHBondContact O-NE 2.65Å; G71-R73 PolarHBondContact O-N 3.42Å; R73-R367 WeakPolarHBondContact O-CD 3.33Å; R73-R367 PolarHBondContact O-NH1 3.36Å; R73-T515 PolarHBondContact NH1-O 3.25Å; R73-S516 PolarHBondContact NH1-O 3.29Å; R73-D518 WeakPolarHBondContact CD-O 3.36Å; R73-D518 PolarHBondContact NE-O 3.36Å; R73-D518 PolarHBondContact NH1-O 2.85Å
74L92.3Very high91.8Very high0 Ų014.5 Ų14.50%08%0.076CC..SBendtrans-90.7159.7168.5-72172.5000110.6I5 V72 L76 Y309 C312 A313 A318 Y517I5-L74 HydrophobicContact CD1-CD2 3.78Å; V72-L74 HydrophobicContact CG1-CB 4Å; V72-L74 HydrophobicContact CG1-CD1 4.33Å; V72-L74 HydrophobicContact CG1-CG 4.27Å; V72-L74 HydrophobicContact CG2-CD1 3.79Å; V72-L74 HydrophobicContact CG2-CG 4.05Å; V72-L74 PolarHBondContact O-N 2.95Å; L74-L76 HydrophobicContact CB-CD1 3.74Å; L74-L76 HydrophobicContact CB-CG 3.9Å; L74-L76 HydrophobicContact CD1-CD1 4.07Å; L74-L76 PolarHBondContact O-N 3.23Å; L74-Y309 VanDerWaalsContact CD1-O 3.29Å; L74-Y309 WeakPolarHBondContact CD1-O 3.23Å; L74-C312 HydrophobicContact CD1-CB 4.36Å; L74-A313 HydrophobicContact CD1-CB 4.44Å; L74-A313 HydrophobicContact CD2-CB 4.19Å; L74-A318 HydrophobicContact CD2-CB 4.32Å; L74-Y517 HydrophobicContact CD2-CE1 3.88Å; L74-Y517 WeakPolarHBondContact CD2-OH 3.39Å; L74-Y517 HydrophobicContact CG-CE1 4.04Å
75P92Very high91.5Very high2 Ų214.5 Ų14.51%0.0138%0.076CC..SBendtrans-75.161.5175.135.8-39.2000111L359 G365 R367 V370P75-L359 HydrophobicContact CG-CD2 4.36Å; P75-G365 VanDerWaalsContact CB-O 3.29Å; P75-G365 WeakPolarHBondContact CB-O 3.21Å; P75-G365 VanDerWaalsContact CG-O 3.23Å; P75-G365 WeakPolarHBondContact CG-O 3.29Å; P75-R367 HydrophobicContact CB-CG 4.25Å; P75-V370 HydrophobicContact CB-CG2 3.85Å
76L90.3Very high90.8Very high1 Ų112.2 Ų12.21%0.0056%0.064CC..  trans-107.8131.3-178.4-72.3168.4000110.1T68 V72 L74 Y309 C312 I356T68-L76 VanDerWaalsContact CG2-O 3.29Å; T68-L76 WeakPolarHBondContact CG2-O 3.43Å; V72-L76 HydrophobicContact CG1-CD1 3.95Å; L74-L76 HydrophobicContact CB-CD1 3.74Å; L74-L76 HydrophobicContact CB-CG 3.9Å; L74-L76 HydrophobicContact CD1-CD1 4.07Å; L74-L76 PolarHBondContact O-N 3.23Å; L76-Y309 HydrophobicContact CD1-CD1 3.46Å; L76-Y309 VanDerWaalsContact CD1-CD1 3.46Å; L76-Y309 HydrophobicContact CD1-CE1 3.88Å; L76-C312 HydrophobicContact CD1-CB 4.25Å; L76-C312 HydrophobicContact CD2-CB 3.43Å; L76-C312 VanDerWaalsContact CD2-CB 3.43Å; L76-C312 VanDerWaalsContact CD2-SG 3.52Å; L76-C312 HydrophobicContact CG-CB 3.9Å; L76-I356 HydrophobicContact CD2-CD1 3.6Å; L76-I356 HydrophobicContact CD2-CG1 3.53Å
77F91.4Very high90.3Very high0 Ų010.2 Ų10.20%05%0.054CC..  trans-78.1136.7162-95.7-98.3000108.7H21 T64 S352 N355 V370H21-F77 HydrophobicContact CB-CD2 3.82Å; H21-F77 HydrophobicContact CB-CE2 3.29Å; H21-F77 HydrophobicContact CB-CZ 3.99Å; T64-F77 HydrophobicContact CG2-CD1 4.12Å; T64-F77 HydrophobicContact CG2-CE1 4.43Å; T64-F77 HydrophobicContact CG2-CG 4.28Å; F77-S352 WeakPolarHBondContact O-CB 3.39Å; F77-S352 PolarHBondContact O-N 3.32Å; F77-N355 HydrophobicContact CB-CB 4.16Å; F77-N355 WeakPolarHBondContact CD2-ND2 3.2Å; F77-V370 HydrophobicContact CD2-CB 4.37Å; F77-V370 HydrophobicContact CD2-CG1 3.61Å; F77-V370 HydrophobicContact CD2-CG2 4.28Å; F77-V370 HydrophobicContact CE2-CB 4.06Å; F77-V370 HydrophobicContact CE2-CG1 3.62Å; F77-V370 HydrophobicContact CE2-CG2 4.16Å; F77-V370 HydrophobicContact CG-CG1 4.37Å; F77-V370 HydrophobicContact CZ-CG1 4.41Å
78Q92.9Very high90.1Very high0 Ų010.1 Ų10.10%05%0.053CC..EExtended strand (participates in β ladder)trans-78.5154.4160-69.5-72.3-6400108.6V60 T63 T64 Q67 S349 T350 S351V60-Q78 WeakPolarHBondContact CG1-O 3.37Å; T63-Q78 WeakPolarHBondContact OG1-CB 3.34Å; T64-Q78 WeakPolarHBondContact OG1-CB 3.5Å; T64-Q78 PolarHBondContact OG1-N 3.45Å; Q67-Q78 HydrophobicContact CB-CG 3.88Å; Q67-Q78 HydrophobicContact CG-CG 4.2Å; Q78-S349 WeakPolarHBondContact CB-OG 3.44Å; Q78-S349 PolarHBondContact OE1-OG 3.24Å; Q78-T350 CarbonylContact C-O 3.58Å; Q78-T350 VanDerWaalsContact CA-O 3.25Å; Q78-T350 WeakPolarHBondContact CA-O 3.2Å; Q78-T350 PolarHBondContact OE1-O 2.62Å; Q78-S351 PolarHBondContact NE2-OG 3.35Å
79A88.6Confident89.7Confident9 Ų912.7 Ų12.77%0.0747%0.065CC..EExtended strand (participates in β ladder)trans-143.1165.2178.200000110.1C25 A81 S349 T350C25-A79 WeakPolarHBondContact SG-CB 3.34Å; A79-A81 PolarHBondContact O-N 3.24Å; A79-S349 WeakPolarHBondContact O-CA 3.23Å; A79-T350 PolarHBondContact N-O 3.42Å; A79-T350 PolarHBondContact O-N 2.89Å
80S89.4Confident89.2Confident5 Ų511.5 Ų11.54%0.0356%0.06CC..EExtended strand (participates in β ladder)trans-62.4124.4166.7-730000110.4I56 F82 N347I56-S80 WeakPolarHBondContact CG2-OG 3.39Å; S80-F82 PolarHBondContact O-N 3.46Å; S80-N347 WeakPolarHBondContact CA-OD1 3.21Å; S80-N347 WeakPolarHBondContact CB-OD1 3.11Å; S80-N347 PolarHBondContact OG-OD1 3.12Å
81A88.6Confident89Confident0 Ų07.5 Ų7.50%04%0.039CC..  trans-78.9110.4-177.500000110.6A79 A83 F84 G348 T350A79-A81 PolarHBondContact O-N 3.24Å; A81-A83 HydrophobicContact CB-CB 4.49Å; A81-A83 PolarHBondContact O-N 3.32Å; A81-F84 HydrophobicContact CB-CD2 3.41Å; A81-F84 VanDerWaalsContact CB-CD2 3.41Å; A81-F84 HydrophobicContact CB-CE2 3.79Å; A81-F84 HydrophobicContact CB-CG 4.48Å; A81-F84 PolarHBondContact O-N 2.81Å; A81-F84 VanDerWaalsContact O-N 3.07Å; A81-G348 WeakPolarHBondContact CB-O 3.06Å; A81-G348 PolarHBondContact N-O 3.25Å; A81-T350 HydrophobicContact CB-CG2 3.44Å; A81-T350 VanDerWaalsContact CB-CG2 3.44Å
82F85.9Confident88.7Confident21 Ų217.9 Ų7.99%0.0924%0.041CC..G310 helixtrans-59.4-26.8172.3-74.6-72.7000112.5G28 A31 V32 L35 S80 F84 L85 I165 L405 F406 I409G28-F82 VanDerWaalsContact O-CZ 3.23Å; G28-F82 WeakPolarHBondContact O-CZ 3.26Å; A31-F82 HydrophobicContact CB-CE1 3.71Å; A31-F82 HydrophobicContact CB-CZ 3.68Å; V32-F82 HydrophobicContact CG2-CD1 3.91Å; V32-F82 HydrophobicContact CG2-CE1 3.73Å; V32-F82 HydrophobicContact CG2-CZ 4.26Å; L35-F82 HydrophobicContact CD1-CE1 4.29Å; S80-F82 PolarHBondContact O-N 3.46Å; F82-F84 PolarHBondContact O-N 3.36Å; F82-L85 HydrophobicContact CD1-CD2 4.47Å; F82-L85 VanDerWaalsContact O-CB 3.29Å; F82-L85 WeakPolarHBondContact O-CB 3.2Å; F82-L85 PolarHBondContact O-N 3.08Å; F82-I165 HydrophobicContact CB-CG2 3.54Å; F82-L405 HydrophobicContact CE2-CD2 4.15Å; F82-L405 HydrophobicContact CZ-CD2 3.82Å; F82-F406 HydrophobicContact CD1-CE1 4.32Å; F82-F406 AromaticContact CE1-CE1 3.83Å; F82-F406 HydrophobicContact CE1-CE1 3.83Å; F82-F406 HydrophobicContact CE1-CZ 4.38Å; F82-F406 HydrophobicContact CZ-CE1 4.02Å; F82-I409 HydrophobicContact CD2-CD1 3.96Å; F82-I409 HydrophobicContact CE2-CD1 3.94Å
83A85.5Confident88.3Confident0 Ų010.8 Ų10.80%07%0.072CC..G310 helixtrans-48.5-32.217100000114A81 P87 I165 A297 M471A81-A83 HydrophobicContact CB-CB 4.49Å; A81-A83 PolarHBondContact O-N 3.32Å; A83-P87 WeakPolarHBondContact O-CD 3.48Å; A83-I165 HydrophobicContact CB-CD1 4.38Å; A83-A297 HydrophobicContact CB-CB 4.44Å; A83-A297 VanDerWaalsContact O-CB 3.23Å; A83-A297 WeakPolarHBondContact O-CB 3.36Å; A83-M471 VanDerWaalsContact CA-SD 3.59Å; A83-M471 HydrophobicContact CB-CE 3.58Å; A83-M471 HydrophobicContact CB-SD 4.05Å
84F90.1Very high87.7Confident2 Ų210.9 Ų10.91%0.0097%0.074CC..G310 helixtrans-86.1-15.8-178.9-72.6-107.2000113.1A81 F82 A88 I130 M294 A297 T298 N347A81-F84 HydrophobicContact CB-CD2 3.41Å; A81-F84 VanDerWaalsContact CB-CD2 3.41Å; A81-F84 HydrophobicContact CB-CE2 3.79Å; A81-F84 HydrophobicContact CB-CG 4.48Å; A81-F84 PolarHBondContact O-N 2.81Å; A81-F84 VanDerWaalsContact O-N 3.07Å; F82-F84 PolarHBondContact O-N 3.36Å; F84-A88 WeakPolarHBondContact O-CB 3.49Å; F84-A88 PolarHBondContact O-N 3.09Å; F84-A88 VanDerWaalsContact O-N 3.09Å; F84-I130 HydrophobicContact CD1-CD1 4.32Å; F84-I130 HydrophobicContact CD1-CG1 3.88Å; F84-I130 HydrophobicContact CE1-CG1 4.19Å; F84-I130 HydrophobicContact CE1-CG2 4.27Å; F84-M294 HydrophobicContact CB-SD 4.4Å; F84-M294 HydrophobicContact CD1-SD 3.69Å; F84-M294 HydrophobicContact CG-SD 4.46Å; F84-A297 HydrophobicContact CB-CB 4.33Å; F84-A297 HydrophobicContact CD1-CB 3.87Å; F84-A297 HydrophobicContact CD2-CB 3.84Å; F84-A297 HydrophobicContact CE1-CB 4.15Å; F84-A297 HydrophobicContact CE2-CB 4.11Å; F84-A297 HydrophobicContact CG-CB 3.75Å; F84-A297 HydrophobicContact CZ-CB 4.27Å; F84-T298 HydrophobicContact CE1-CG2 3.85Å; F84-T298 HydrophobicContact CZ-CG2 3.53Å; F84-N347 HydrophobicContact CB-CB 4.31Å
85L88.3Confident87.1Confident1 Ų116.6 Ų16.61%0.00510%0.104CC..Hα-helixtrans-69.3-45.2-176.9-177.669.1000111.3L35 L36 F82 A88 Q89L35-L85 HydrophobicContact CB-CD1 3.85Å; L35-L85 HydrophobicContact CB-CD2 3.63Å; L35-L85 HydrophobicContact CB-CG 4.36Å; L35-L85 HydrophobicContact CD1-CD2 3.4Å; L35-L85 VanDerWaalsContact CD1-CD2 3.4Å; L35-L85 HydrophobicContact CG-CD2 4.1Å; L36-L85 HydrophobicContact CB-CD1 4.27Å; L36-L85 HydrophobicContact CD1-CD1 4.49Å; F82-L85 HydrophobicContact CD1-CD2 4.47Å; F82-L85 VanDerWaalsContact O-CB 3.29Å; F82-L85 WeakPolarHBondContact O-CB 3.2Å; F82-L85 PolarHBondContact O-N 3.08Å; L85-A88 WeakPolarHBondContact O-CB 3.45Å; L85-A88 PolarHBondContact O-N 3.46Å; L85-Q89 WeakPolarHBondContact O-CG 3.47Å; L85-Q89 PolarHBondContact O-N 3.37Å
86I83.1Confident86.6Confident12 Ų1224.4 Ų24.46%0.06213%0.134CC..Hα-helixtrans-63.4-50.5-177.4-56.5-56.3000111A88 Q89 A90 V169 T469 E470I86-A88 VanDerWaalsContact C-N 3.29Å; I86-A88 PolarHBondContact O-N 3.35Å; I86-Q89 PolarHBondContact O-N 3.42Å; I86-A90 PolarHBondContact O-N 3.03Å; I86-V169 HydrophobicContact CD1-CG2 4.31Å; I86-T469 HydrophobicContact CG2-CG2 4.11Å; I86-E470 VanDerWaalsContact CG2-OE2 3.27Å; I86-E470 WeakPolarHBondContact CG2-OE2 3.32Å
87P86.1Confident86.3Confident0 Ų025.6 Ų25.60%014%0.138CC..Hα-helixtrans-64.1-32.6174.3-26.439.9000113.1A83 A90 I91 G293 M294 A297 T469A83-P87 WeakPolarHBondContact O-CD 3.48Å; P87-A90 PolarHBondContact O-N 2.92Å; P87-I91 WeakPolarHBondContact O-CB 3.36Å; P87-I91 WeakPolarHBondContact O-CD1 3.49Å; P87-I91 WeakPolarHBondContact O-CG1 3.49Å; P87-I91 PolarHBondContact O-N 2.95Å; P87-G293 WeakPolarHBondContact CB-O 3.45Å; P87-M294 HydrophobicContact CB-SD 4.21Å; P87-A297 HydrophobicContact CG-CB 4.12Å; P87-T469 HydrophobicContact CG-CG2 4.03Å
88A90.3Very high85.9Confident0 Ų028.8 Ų28.80%016%0.164CC..Hα-helixtrans-61.3-45.5173.400000111.6L36 F84 L85 I86 I91 L92 I126 M294L36-A88 HydrophobicContact CD1-CB 4Å; F84-A88 WeakPolarHBondContact O-CB 3.49Å; F84-A88 PolarHBondContact O-N 3.09Å; F84-A88 VanDerWaalsContact O-N 3.09Å; L85-A88 WeakPolarHBondContact O-CB 3.45Å; L85-A88 PolarHBondContact O-N 3.46Å; I86-A88 VanDerWaalsContact C-N 3.29Å; I86-A88 PolarHBondContact O-N 3.35Å; A88-I91 PolarHBondContact O-N 3.09Å; A88-L92 WeakPolarHBondContact O-CB 3.41Å; A88-L92 VanDerWaalsContact O-CG 3.29Å; A88-L92 WeakPolarHBondContact O-CG 3.5Å; A88-L92 PolarHBondContact O-N 3Å; A88-I126 HydrophobicContact CB-CD1 3.97Å; A88-I126 HydrophobicContact CB-CG1 4.27Å; A88-M294 HydrophobicContact CB-CE 3.68Å
89Q86.3Confident85.4Confident55 Ų5532.4 Ų32.426%0.25719%0.189SC..Hα-helixtrans-63-43.8176.1-73.5176-39.500111.3A39 L85 I86 I91 L92 G93A39-Q89 HydrophobicContact CB-CG 4.01Å; L85-Q89 WeakPolarHBondContact O-CG 3.47Å; L85-Q89 PolarHBondContact O-N 3.37Å; I86-Q89 PolarHBondContact O-N 3.42Å; Q89-I91 PolarHBondContact O-N 2.76Å; Q89-L92 CarbonylContact O-C 3.11Å; Q89-L92 PolarHBondContact O-N 3.44Å; Q89-G93 PolarHBondContact O-N 3.22Å
90A82.9Confident85.1Confident19 Ų1934.2 Ų34.216%0.15720%0.2CC..Hα-helixtrans-61.7-42.3176.300000112.4I86 P87 G93 V465I86-A90 PolarHBondContact O-N 3.03Å; P87-A90 PolarHBondContact O-N 2.92Å; A90-G93 PolarHBondContact O-N 3.45Å; A90-V465 HydrophobicContact CB-CG1 4.23Å
91I86.4Confident84.7Confident2 Ų237.4 Ų37.41%0.0122%0.222CC..Hα-helixtrans-63.3-45.7175.5-69.2161.6000110.6P87 A88 Q89 G93 L94 W97 E125 M294 V465P87-I91 WeakPolarHBondContact O-CB 3.36Å; P87-I91 WeakPolarHBondContact O-CD1 3.49Å; P87-I91 WeakPolarHBondContact O-CG1 3.49Å; P87-I91 PolarHBondContact O-N 2.95Å; A88-I91 PolarHBondContact O-N 3.09Å; Q89-I91 PolarHBondContact O-N 2.76Å; I91-G93 VanDerWaalsContact C-N 3.26Å; I91-G93 PolarHBondContact O-N 3.46Å; I91-L94 WeakPolarHBondContact O-CB 3.46Å; I91-L94 WeakPolarHBondContact O-CG 2.93Å; I91-L94 PolarHBondContact O-N 3.33Å; I91-W97 VanDerWaalsContact O-CD1 3.28Å; I91-E125 HydrophobicContact CG2-CG 4.06Å; I91-M294 HydrophobicContact CD1-CE 3.92Å; I91-M294 HydrophobicContact CD1-CG 4.12Å; I91-V465 HydrophobicContact CG1-CG1 4.31Å; I91-V465 HydrophobicContact CG1-CG2 4.35Å
92L87.8Confident84Confident8 Ų843.7 Ų43.74%0.04225%0.252CS..Hα-helixtrans-73.4-16.8179.5-66.1-177.7000113.5L36 A39 M40 A88 Q89 L94 W97 R122 I126L36-L92 HydrophobicContact CD1-CD1 4.37Å; A39-L92 HydrophobicContact CB-CB 4.46Å; A39-L92 HydrophobicContact CB-CD1 3.78Å; M40-L92 HydrophobicContact CG-CD1 3.7Å; A88-L92 WeakPolarHBondContact O-CB 3.41Å; A88-L92 VanDerWaalsContact O-CG 3.29Å; A88-L92 WeakPolarHBondContact O-CG 3.5Å; A88-L92 PolarHBondContact O-N 3Å; Q89-L92 CarbonylContact O-C 3.11Å; Q89-L92 PolarHBondContact O-N 3.44Å; L92-L94 VanDerWaalsContact C-N 3.33Å; L92-W97 HydrophobicContact CD2-CG 4.37Å; L92-W97 VanDerWaalsContact O-CB 3.27Å; L92-W97 WeakPolarHBondContact O-CB 3.45Å; L92-R122 HydrophobicContact CD2-CB 3.66Å; L92-R122 HydrophobicContact CD2-CG 3.9Å; L92-I126 HydrophobicContact CD1-CD1 3.55Å; L92-I126 HydrophobicContact CD2-CD1 4.11Å; L92-I126 HydrophobicContact CG-CD1 3.84Å
93G82.9Confident83.3Confident62 Ų6249 Ų4964%0.63928%0.281SS*.THydrogen-bonded Turntrans-80.1-8.8173.600000114.5Q89 A90 I91Q89-G93 PolarHBondContact O-N 3.22Å; A90-G93 PolarHBondContact O-N 3.45Å; I91-G93 VanDerWaalsContact C-N 3.26Å; I91-G93 PolarHBondContact O-N 3.46Å
94L81.4Confident82.8Confident30 Ų3053.2 Ų53.216%0.15731%0.307CS..SBendtrans-62.3147.5175.4-65.7173.2000111.1I91 L92 R96 W97 A98 Q461I91-L94 WeakPolarHBondContact O-CB 3.46Å; I91-L94 WeakPolarHBondContact O-CG 2.93Å; I91-L94 PolarHBondContact O-N 3.33Å; L92-L94 VanDerWaalsContact C-N 3.33Å; L94-R96 PolarHBondContact O-N 2.9Å; L94-W97 PolarHBondContact O-N 3.16Å; L94-A98 PolarHBondContact O-N 2.86Å; L94-Q461 HydrophobicContact CD2-CG 4.25Å
95D79Confident81.8Confident119 Ų11953.9 Ų53.964%0.63631%0.31SS*.G310 helixtrans-49.8-32.4-179.3-79.5-14.4000113.2W97 K450D95-W97 VanDerWaalsContact C-N 3.25Å; D95-W97 PolarHBondContact O-N 3.05Å; D95-K450 IonicContact OD1-NZ 3.97Å; D95-K450 PolarHBondContact OD1-NZ 3.2Å; D95-K450 WeakPolarHBondContact OD2-CE 3.34Å; D95-K450 IonicContact OD2-NZ 2.75Å; D95-K450 PolarHBondContact OD2-NZ 3.46Å
96R80.8Confident81Confident166 Ų16654.7 Ų54.763%0.62631%0.313SS*.G310 helixtrans-61.8-30.1176.9177.7175.9172.4-179.4-5.4113.5L94L94-R96 PolarHBondContact O-N 2.9Å
97W84.8Confident79.8Confident26 Ų2656.4 Ų56.410%0.09833%0.334CS..G310 helixtrans-109.87.7-172.9-63.5120.4000113.7I91 L92 L94 D95 C99 P121 R122 E125I91-W97 VanDerWaalsContact O-CD1 3.28Å; L92-W97 HydrophobicContact CD2-CG 4.37Å; L92-W97 VanDerWaalsContact O-CB 3.27Å; L92-W97 WeakPolarHBondContact O-CB 3.45Å; L94-W97 PolarHBondContact O-N 3.16Å; D95-W97 VanDerWaalsContact C-N 3.25Å; D95-W97 PolarHBondContact O-N 3.05Å; W97-C99 PolarHBondContact O-N 3.42Å; W97-P121 HydrophobicContact CH2-CB 4.01Å; W97-P121 WeakPolarHBondContact CH2-O 3.4Å; W97-P121 HydrophobicContact CZ3-CB 3.76Å; W97-R122 HydrophobicContact CD2-CG 4.25Å; W97-R122 HydrophobicContact CE3-CG 3.59Å; W97-R122 HydrophobicContact CZ3-CG 3.98Å; W97-R122 PolarHBondContact O-NE 2.99Å; W97-R122 PolarHBondContact O-NH2 3.13Å; W97-E125 HydrophobicContact CH2-CB 4.46Å; W97-E125 HydrophobicContact CZ2-CB 3.77Å; W97-E125 HydrophobicContact CZ2-CG 3.83Å
98A82.5Confident78.6Confident67 Ų6763.1 Ų63.155%0.55437%0.37SS*.  trans-45.9133.5175.400000111.7L94 R122L94-A98 PolarHBondContact O-N 2.86Å; A98-R122 PolarHBondContact O-NH2 3.02Å
99C82.9Confident77Confident77 Ų7773.1 Ų73.152%0.5241%0.408SS..PPolyproline II helixtrans-64.6130.7-178.2-66.90000110.4C41 W97C41-C99 HydrophobicContact CB-CB 3.84Å; C41-C99 WeakPolarHBondContact CB-SG 3.3Å; C41-C99 WeakPolarHBondContact SG-CA 3.41Å; C41-C99 WeakPolarHBondContact SG-CB 3.3Å; C41-C99 CovalentContact SG-SG 2.03Å; C41-C99 PolarHBondContact SG-SG 2.76Å; W97-C99 PolarHBondContact O-N 3.42Å
100P83.1Confident75.6Confident47 Ų4773.7 Ų73.731%0.30542%0.418SS..PPolyproline II helixtrans-67.4165.9170.227.4-29.4000110.4V104 I105P100-V104 HydrophobicContact CB-CB 4.25Å; P100-V104 HydrophobicContact CB-CG1 4.17Å; P100-I105 HydrophobicContact CG-CD1 4.04Å; P100-I105 HydrophobicContact CG-CG1 3.71Å; P100-I105 VanDerWaalsContact O-CD1 3.32Å; P100-I105 WeakPolarHBondContact O-CD1 3.37Å
101S80.6Confident74.4Confident71 Ų7180.4 Ų80.450%0.49745%0.45SS..PPolyproline II helixtrans-60.7151.6178.556.10000111.8D103 V104 I105S101-D103 PolarHBondContact O-N 3.41Å; S101-D103 VanDerWaalsContact O-N 3.16Å; S101-V104 WeakPolarHBondContact O-CB 3.23Å; S101-V104 PolarHBondContact O-N 3.5Å; S101-I105 PolarHBondContact O-N 3.47Å
102E74.5Confident73.3Confident132 Ų13284 Ų8462%0.61747%0.474SS*.Hα-helixtrans-56.7-33.6-177.9-67.9-168.7158.900112.6V104 I105 Y106E102-V104 VanDerWaalsContact C-N 3.26Å; E102-V104 PolarHBondContact O-N 2.92Å; E102-I105 PolarHBondContact O-N 3.2Å; E102-Y106 HydrophobicContact CB-CD2 4.22Å; E102-Y106 PolarHBondContact O-N 2.9Å
103D71.1Confident72.2Confident133 Ų13385.5 Ų85.571%0.71148%0.481SS*.Hα-helixtrans-61.5-32175.2-57.6-47.1000113S101 G107S101-D103 PolarHBondContact O-N 3.41Å; S101-D103 VanDerWaalsContact O-N 3.16Å; D103-G107 WeakPolarHBondContact O-CA 3.37Å; D103-G107 PolarHBondContact O-N 3.27Å
104V73.4Confident71.7Confident89 Ų8988 Ų8854%0.53948%0.48SS..Hα-helixtrans-80.5-32.5177.81760000110.9P100 S101 E102P100-V104 HydrophobicContact CB-CB 4.25Å; P100-V104 HydrophobicContact CB-CG1 4.17Å; S101-V104 WeakPolarHBondContact O-CB 3.23Å; S101-V104 PolarHBondContact O-N 3.5Å; E102-V104 VanDerWaalsContact C-N 3.26Å; E102-V104 PolarHBondContact O-N 2.92Å
105I69.5Low71.6Confident15 Ų1586.7 Ų86.78%0.07747%0.473CS..Hα-helixtrans-76.7-44.3-179.2-58.5173.4000111C41 P100 S101 E102 T115 V118C41-I105 HydrophobicContact CB-CD1 4Å; P100-I105 HydrophobicContact CG-CD1 4.04Å; P100-I105 HydrophobicContact CG-CG1 3.71Å; P100-I105 VanDerWaalsContact O-CD1 3.32Å; P100-I105 WeakPolarHBondContact O-CD1 3.37Å; S101-I105 PolarHBondContact O-N 3.47Å; E102-I105 PolarHBondContact O-N 3.2Å; I105-T115 HydrophobicContact CG2-CG2 4.16Å; I105-V118 HydrophobicContact CG1-CG2 4.45Å
106Y72.1Confident71.8Confident19 Ų1982.8 Ų82.88%0.07546%0.455CS..Hα-helixtrans-118.1-1.2-169-53.5-68.1000114Q44 E102 N108 L113 T115Q44-Y106 HydrophobicContact CB-CE1 3.94Å; Q44-Y106 HydrophobicContact CG-CE2 4.49Å; E102-Y106 HydrophobicContact CB-CD2 4.22Å; E102-Y106 PolarHBondContact O-N 2.9Å; Y106-N108 CarbonylContact O-C 3.21Å; Y106-N108 PolarHBondContact O-N 3.48Å; Y106-L113 HydrophobicContact CD1-CD1 4.07Å; Y106-L113 HydrophobicContact CD1-CD2 3.83Å; Y106-L113 HydrophobicContact CE1-CD1 4.33Å; Y106-T115 HydrophobicContact CD1-CG2 4.38Å; Y106-T115 HydrophobicContact CE1-CG2 4.14Å
107G58Low71.8Confident48 Ų4880.2 Ų80.250%0.49545%0.45SS..  trans-59.8-19-167.200000117.1D103D103-G107 WeakPolarHBondContact O-CA 3.37Å; D103-G107 PolarHBondContact O-N 3.27Å
108N60.2Low71.9Confident141 Ų14179.2 Ų79.275%0.75445%0.447SS*.SBendtrans-98.590.3166.4-132.5-9.1000107.4Y106 S110Y106-N108 CarbonylContact O-C 3.21Å; Y106-N108 PolarHBondContact O-N 3.48Å; N108-S110 PolarHBondContact O-N 2.95Å
109W56.4Low72.1Confident210 Ų21076.2 Ų76.280%0.79542%0.421SS*.  trans-68.241.4-176.3-71.485.7000113.8
110S56.8Low72.5Confident67 Ų6774.9 Ų74.947%0.46941%0.407SS..PPolyproline II helixtrans-85.9123.1172.759.30000109.9N108 P112 L113N108-S110 PolarHBondContact O-N 2.95Å; S110-P112 CarbonylContact O-C 3.51Å; S110-L113 PolarHBondContact O-N 3.32Å
111L59.1Low72.9Confident159 Ų15975 Ų7583%0.83241%0.408SS*.SBendtrans-85.7130169.4-79.9153000109.5
112P61.9Low73.5Confident79 Ų7972.5 Ų72.551%0.51339%0.388SS..SBendcis-75.2142.5-130.8-33.7000112.7S110 N114S110-P112 CarbonylContact O-C 3.51Å; P112-N114 PolarHBondContact O-N 3.37Å
113L66.4Low74.4Confident38 Ų3866.2 Ų66.220%0.19936%0.358CS..PPolyproline II helixtrans-56.5130.9173.9-79.5161000110.2Y106 S110 T115Y106-L113 HydrophobicContact CD1-CD1 4.07Å; Y106-L113 HydrophobicContact CD1-CD2 3.83Å; Y106-L113 HydrophobicContact CE1-CD1 4.33Å; S110-L113 PolarHBondContact O-N 3.32Å; L113-T115 HydrophobicContact CB-CG2 4.43Å
114N71Confident75.5Confident116 Ų11663.6 Ų63.662%0.6234%0.338SS*.  trans-110.279.3175.7-171.40.1000110.6P112 S116P112-N114 PolarHBondContact O-N 3.37Å; N114-S116 VanDerWaalsContact C-N 3.27Å; N114-S116 PolarHBondContact O-N 3.24Å; N114-S116 WeakPolarHBondContact OD1-CB 3.5Å; N114-S116 PolarHBondContact OD1-N 2.96Å; N114-S116 PolarHBondContact OD1-OG 3.3Å
115T80.6Confident76.4Confident1 Ų159.4 Ų59.41%0.00631%0.313CS..  trans-87.68.8179.963.10000113.3V42 D45 I105 Y106 L113 H117 V118 W119V42-T115 HydrophobicContact CG1-CG2 4.36Å; V42-T115 WeakPolarHBondContact CG1-OG1 3.27Å; D45-T115 HydrophobicContact CB-CG2 4.18Å; D45-T115 PolarHBondContact OD2-OG1 2.87Å; I105-T115 HydrophobicContact CG2-CG2 4.16Å; Y106-T115 HydrophobicContact CD1-CG2 4.38Å; Y106-T115 HydrophobicContact CE1-CG2 4.14Å; L113-T115 HydrophobicContact CB-CG2 4.43Å; T115-H117 PolarHBondContact O-N 2.84Å; T115-H117 VanDerWaalsContact O-N 3.09Å; T115-V118 WeakPolarHBondContact O-CB 3.48Å; T115-V118 PolarHBondContact O-N 3.49Å; T115-W119 VanDerWaalsContact C-CD1 3.42Å; T115-W119 PolarHBondContact O-N 3.24Å
116S81.8Confident77.5Confident37 Ų3758.7 Ų58.726%0.25931%0.31SS..Hα-helixtrans-50.6-39.7-173.356.10000114N114 V118 W119 H120N114-S116 VanDerWaalsContact C-N 3.27Å; N114-S116 PolarHBondContact O-N 3.24Å; N114-S116 WeakPolarHBondContact OD1-CB 3.5Å; N114-S116 PolarHBondContact OD1-N 2.96Å; N114-S116 PolarHBondContact OD1-OG 3.3Å; S116-V118 PolarHBondContact O-N 2.93Å; S116-W119 PolarHBondContact O-N 3.11Å; S116-H120 WeakPolarHBondContact O-CB 3.38Å; S116-H120 VanDerWaalsContact O-CG 3.28Å; S116-H120 PolarHBondContact O-N 3.45Å; S116-H120 PolarHBondContact O-ND1 3.42Å; S116-H120 VanDerWaalsContact O-ND1 3.17Å
117H81.8Confident78.6Confident113 Ų11357.8 Ų57.852%0.52331%0.306SS..Hα-helixtrans-63.1-26.2178.871.1-81000113.9T115 P121T115-H117 PolarHBondContact O-N 2.84Å; T115-H117 VanDerWaalsContact O-N 3.09Å; H117-P121 WeakPolarHBondContact O-CD 3.25Å
118V86.3Confident80.4Confident4 Ų455.6 Ų55.62%0.02428%0.283CS..Hα-helixtrans-84.4-49.2178.9-176.50000110.4C41 I105 T115 S116 R122C41-V118 HydrophobicContact CB-CG1 4.14Å; I105-V118 HydrophobicContact CG1-CG2 4.45Å; T115-V118 WeakPolarHBondContact O-CB 3.48Å; T115-V118 PolarHBondContact O-N 3.49Å; S116-V118 PolarHBondContact O-N 2.93Å; V118-R122 VanDerWaalsContact CG1-NH1 3.3Å; V118-R122 PolarHBondContact O-NH1 3.34Å
119W87.4Confident82Confident4 Ų448.9 Ų48.92%0.01525%0.247CC..Hα-helixtrans-93.4-26.5-168.673.4-98.9000114.4M40 V42 T48 T115 S116 R122 I123 W281M40-W119 HydrophobicContact CB-CB 4.34Å; V42-W119 HydrophobicContact CG1-CB 3.73Å; V42-W119 HydrophobicContact CG1-CG 4.13Å; V42-W119 HydrophobicContact CG2-CB 4.1Å; V42-W119 HydrophobicContact CG2-CG 4.49Å; T48-W119 HydrophobicContact CG2-CD2 4.01Å; T48-W119 HydrophobicContact CG2-CG 4.39Å; T48-W119 HydrophobicContact CG2-CH2 4.17Å; T48-W119 HydrophobicContact CG2-CZ2 3.68Å; T48-W119 PolarHBondContact OG1-NE1 3.24Å; T115-W119 VanDerWaalsContact C-CD1 3.42Å; T115-W119 PolarHBondContact O-N 3.24Å; S116-W119 PolarHBondContact O-N 3.11Å; W119-R122 PolarHBondContact O-N 2.73Å; W119-R122 VanDerWaalsContact O-N 3.16Å; W119-I123 HydrophobicContact CE3-CB 4.02Å; W119-I123 HydrophobicContact CE3-CG2 3.68Å; W119-I123 HydrophobicContact CZ3-CB 4.17Å; W119-I123 HydrophobicContact CZ3-CG1 4.42Å; W119-I123 HydrophobicContact CZ3-CG2 3.69Å; W119-I123 PolarHBondContact O-N 3.37Å; W119-W281 AromaticContact CH2-CD2 3.36Å; W119-W281 HydrophobicContact CH2-CD2 3.36Å; W119-W281 AromaticContact CH2-CE2 3.65Å; W119-W281 AromaticContact CH2-CE3 3.19Å; W119-W281 HydrophobicContact CH2-CE3 3.19Å; W119-W281 HydrophobicContact CH2-CG 4.07Å; W119-W281 AromaticContact CH2-CH2 3.55Å; W119-W281 HydrophobicContact CH2-CH2 3.55Å; W119-W281 AromaticContact CH2-CZ2 3.76Å; W119-W281 HydrophobicContact CH2-CZ2 3.76Å; W119-W281 AromaticContact CH2-CZ3 3.29Å; W119-W281 HydrophobicContact CH2-CZ3 3.29Å; W119-W281 HydrophobicContact CZ2-CD2 4.45Å; W119-W281 AromaticContact CZ2-CE3 3.9Å; W119-W281 HydrophobicContact CZ2-CE3 3.9Å; W119-W281 HydrophobicContact CZ2-CH2 4.2Å; W119-W281 AromaticContact CZ2-CZ3 3.76Å; W119-W281 HydrophobicContact CZ2-CZ3 3.76Å; W119-W281 HydrophobicContact CZ3-CB 4.43Å; W119-W281 AromaticContact CZ3-CD2 3.67Å; W119-W281 HydrophobicContact CZ3-CD2 3.67Å; W119-W281 AromaticContact CZ3-CE2 3.95Å; W119-W281 AromaticContact CZ3-CE3 3.95Å; W119-W281 HydrophobicContact CZ3-CE3 3.95Å; W119-W281 AromaticContact CZ3-CG 3.9Å; W119-W281 HydrophobicContact CZ3-CG 3.9Å; W119-W281 HydrophobicContact CZ3-CZ2 4.4Å; W119-W281 HydrophobicContact CZ3-CZ3 4.39Å
120H91.4Very high83.9Confident49 Ų4938.9 Ų38.923%0.22721%0.209CC..Hα-helixtrans-59-45.1178-76.136.9000112.4S116 R122 I123 R124 W281S116-H120 WeakPolarHBondContact O-CB 3.38Å; S116-H120 VanDerWaalsContact O-CG 3.28Å; S116-H120 PolarHBondContact O-N 3.45Å; S116-H120 PolarHBondContact O-ND1 3.42Å; S116-H120 VanDerWaalsContact O-ND1 3.17Å; H120-R122 VanDerWaalsContact C-N 3.3Å; H120-R122 PolarHBondContact O-N 2.92Å; H120-I123 WeakPolarHBondContact O-CG2 3.41Å; H120-R124 VanDerWaalsContact O-CB 3.31Å; H120-R124 WeakPolarHBondContact O-CB 3.46Å; H120-R124 WeakPolarHBondContact O-CD 3.44Å; H120-R124 WeakPolarHBondContact O-CG 3.33Å; H120-R124 PolarHBondContact O-N 3.09Å; H120-W281 PolarHBondContact CD2-O 3.16Å; H120-W281 VanDerWaalsContact CD2-O 3.29Å; H120-W281 AromaticContact CE1-CE3 3.94Å; H120-W281 AromaticContact NE2-CE3 3.95Å
121P91.3Very high85.8Confident49 Ų4936.7 Ų36.732%0.31819%0.192SC..Hα-helixtrans-60.3-39.2175.5-25.636.8000113.2W97 H117 E125W97-P121 HydrophobicContact CH2-CB 4.01Å; W97-P121 WeakPolarHBondContact CH2-O 3.4Å; W97-P121 HydrophobicContact CZ3-CB 3.76Å; H117-P121 WeakPolarHBondContact O-CD 3.25Å; P121-E125 PolarHBondContact O-N 2.97Å
122R92.3Very high87.6Confident20 Ų2032.7 Ų32.78%0.07517%0.17CC..Hα-helixtrans-69-47.3-178.6-71.6178.3172.278.9-2112.3M40 L92 W97 A98 V118 W119 H120 R124 E125 I126M40-R122 HydrophobicContact CG-CB 4.33Å; L92-R122 HydrophobicContact CD2-CB 3.66Å; L92-R122 HydrophobicContact CD2-CG 3.9Å; W97-R122 HydrophobicContact CD2-CG 4.25Å; W97-R122 HydrophobicContact CE3-CG 3.59Å; W97-R122 HydrophobicContact CZ3-CG 3.98Å; W97-R122 PolarHBondContact O-NE 2.99Å; W97-R122 PolarHBondContact O-NH2 3.13Å; A98-R122 PolarHBondContact O-NH2 3.02Å; V118-R122 VanDerWaalsContact CG1-NH1 3.3Å; V118-R122 PolarHBondContact O-NH1 3.34Å; W119-R122 PolarHBondContact O-N 2.73Å; W119-R122 VanDerWaalsContact O-N 3.16Å; H120-R122 VanDerWaalsContact C-N 3.3Å; H120-R122 PolarHBondContact O-N 2.92Å; R122-R124 VanDerWaalsContact C-N 3.31Å; R122-R124 PolarHBondContact O-N 2.85Å; R122-E125 WeakPolarHBondContact O-CB 3.26Å; R122-E125 PolarHBondContact O-N 3.05Å; R122-I126 PolarHBondContact O-N 3.3Å
123I92.7Very high89.2Confident0 Ų029 Ų290%015%0.146CC..Hα-helixtrans-65.6-36.5177.2-163.868.1000110.9L36 M40 W119 H120 E125 I126 Q127 W281L36-I123 HydrophobicContact CD2-CD1 4.03Å; M40-I123 HydrophobicContact CE-CD1 4.49Å; M40-I123 HydrophobicContact SD-CB 3.97Å; M40-I123 HydrophobicContact SD-CD1 3.75Å; M40-I123 HydrophobicContact SD-CG1 4.38Å; W119-I123 HydrophobicContact CE3-CB 4.02Å; W119-I123 HydrophobicContact CE3-CG2 3.68Å; W119-I123 HydrophobicContact CZ3-CB 4.17Å; W119-I123 HydrophobicContact CZ3-CG1 4.42Å; W119-I123 HydrophobicContact CZ3-CG2 3.69Å; W119-I123 PolarHBondContact O-N 3.37Å; H120-I123 WeakPolarHBondContact O-CG2 3.41Å; I123-E125 VanDerWaalsContact C-N 3.29Å; I123-E125 PolarHBondContact O-N 3.32Å; I123-I126 PolarHBondContact O-N 3.33Å; I123-Q127 HydrophobicContact CG1-CG 4.33Å; I123-Q127 WeakPolarHBondContact O-CB 3.2Å; I123-Q127 WeakPolarHBondContact O-CG 3.34Å; I123-Q127 PolarHBondContact O-N 2.81Å; I123-W281 HydrophobicContact CG2-CB 3.65Å; I123-W281 HydrophobicContact CG2-CG 3.98Å
124R94.3Very high90.6Very high77 Ų7727.1 Ų27.129%0.29114%0.136SC..Hα-helixtrans-64.1-33.9179.3-73.7166.567.8-176.5-0.7113H120 R122 G128 W281 L283 V285H120-R124 VanDerWaalsContact O-CB 3.31Å; H120-R124 WeakPolarHBondContact O-CB 3.46Å; H120-R124 WeakPolarHBondContact O-CD 3.44Å; H120-R124 WeakPolarHBondContact O-CG 3.33Å; H120-R124 PolarHBondContact O-N 3.09Å; R122-R124 VanDerWaalsContact C-N 3.31Å; R122-R124 PolarHBondContact O-N 2.85Å; R124-G128 PolarHBondContact O-N 3.16Å; R124-G128 VanDerWaalsContact O-N 3.09Å; R124-W281 VanDerWaalsContact CD-O 3.31Å; R124-W281 WeakPolarHBondContact CD-O 3.38Å; R124-L283 VanDerWaalsContact CZ-O 3.23Å; R124-L283 PolarHBondContact NE-O 3.35Å; R124-L283 PolarHBondContact NH2-O 3.39Å; R124-V285 HydrophobicContact CB-CG2 4.38Å; R124-V285 PolarHBondContact O-N 3.23Å
125E92.8Very high91.8Very high2 Ų225.3 Ų25.31%0.00913%0.126CC..Hα-helixtrans-64.1-49.8172.9-173.662.9-143.300110.7I91 W97 P121 R122 I123 Q127 G128 A129 V285 T287I91-E125 HydrophobicContact CG2-CG 4.06Å; W97-E125 HydrophobicContact CH2-CB 4.46Å; W97-E125 HydrophobicContact CZ2-CB 3.77Å; W97-E125 HydrophobicContact CZ2-CG 3.83Å; P121-E125 PolarHBondContact O-N 2.97Å; R122-E125 WeakPolarHBondContact O-CB 3.26Å; R122-E125 PolarHBondContact O-N 3.05Å; I123-E125 VanDerWaalsContact C-N 3.29Å; I123-E125 PolarHBondContact O-N 3.32Å; E125-Q127 VanDerWaalsContact C-N 3.34Å; E125-Q127 PolarHBondContact O-N 2.91Å; E125-G128 PolarHBondContact O-N 2.76Å; E125-A129 WeakPolarHBondContact O-CB 3.31Å; E125-A129 PolarHBondContact O-N 3.48Å; E125-V285 WeakPolarHBondContact OE2-CG1 3.42Å; E125-T287 VanDerWaalsContact OE1-CB 3.23Å; E125-T287 WeakPolarHBondContact OE1-CB 3.37Å; E125-T287 WeakPolarHBondContact OE1-CG2 3.22Å; E125-T287 PolarHBondContact OE1-OG1 2.79Å
126I93.8Very high92.5Very high0 Ų028.1 Ų28.10%014%0.143CC..Hα-helixtrans-61-43.1176-69.8164.2000111.1L36 A88 L92 R122 I123 G128 A129 I130 M294L36-I126 HydrophobicContact CD1-CD1 3.92Å; A88-I126 HydrophobicContact CB-CD1 3.97Å; A88-I126 HydrophobicContact CB-CG1 4.27Å; L92-I126 HydrophobicContact CD1-CD1 3.55Å; L92-I126 HydrophobicContact CD2-CD1 4.11Å; L92-I126 HydrophobicContact CG-CD1 3.84Å; R122-I126 PolarHBondContact O-N 3.3Å; I123-I126 PolarHBondContact O-N 3.33Å; I126-G128 PolarHBondContact O-N 3.32Å; I126-A129 PolarHBondContact O-N 2.72Å; I126-I130 HydrophobicContact CG2-CD1 3.51Å; I126-I130 HydrophobicContact CG2-CG1 4.2Å; I126-I130 WeakPolarHBondContact O-CB 3.29Å; I126-I130 VanDerWaalsContact O-CG1 3.23Å; I126-I130 WeakPolarHBondContact O-CG1 3.49Å; I126-I130 PolarHBondContact O-N 2.69Å; I126-M294 HydrophobicContact CB-CE 4.49Å; I126-M294 HydrophobicContact CG1-CE 4.37Å; I126-M294 HydrophobicContact CG2-CE 3.81Å
127Q95.2Very high93.1Very high0 Ų026.5 Ų26.50%013%0.132CC..Hα-helixtrans-59.4-47.6179-75.2178.2-81.800112.1I123 E125 I130 I131 P284 G341I123-Q127 HydrophobicContact CG1-CG 4.33Å; I123-Q127 WeakPolarHBondContact O-CB 3.2Å; I123-Q127 WeakPolarHBondContact O-CG 3.34Å; I123-Q127 PolarHBondContact O-N 2.81Å; E125-Q127 VanDerWaalsContact C-N 3.34Å; E125-Q127 PolarHBondContact O-N 2.91Å; Q127-I130 PolarHBondContact O-N 2.87Å; Q127-I131 WeakPolarHBondContact O-CB 3.28Å; Q127-I131 WeakPolarHBondContact O-CD1 3.45Å; Q127-I131 WeakPolarHBondContact O-CG1 3.22Å; Q127-I131 PolarHBondContact O-N 2.73Å; Q127-P284 HydrophobicContact CB-CB 4.4Å; Q127-G341 VanDerWaalsContact CG-O 3.29Å; Q127-G341 WeakPolarHBondContact CG-O 3.45Å; Q127-G341 PolarHBondContact NE2-O 3.38Å
128G95.1Very high93.8Very high1 Ų122.3 Ų22.31%0.0111%0.114CC..Hα-helixtrans-68.3-38.2-179.600000112.1R124 E125 I126 I131 M132 V285R124-G128 PolarHBondContact O-N 3.16Å; R124-G128 VanDerWaalsContact O-N 3.09Å; E125-G128 PolarHBondContact O-N 2.76Å; I126-G128 PolarHBondContact O-N 3.32Å; G128-I131 PolarHBondContact O-N 3.41Å; G128-M132 WeakPolarHBondContact O-CG 3.32Å; G128-M132 PolarHBondContact O-N 2.96Å; G128-M132 VanDerWaalsContact O-N 3.09Å; G128-V285 VanDerWaalsContact CA-O 3.3Å; G128-V285 WeakPolarHBondContact CA-O 3.4Å
129A94.7Very high94.2Very high0 Ų026.6 Ų26.60%014%0.14CC..Hα-helixtrans-59.5-48.2173.200000112.3E125 I126 M132 S133 G290 M294E125-A129 WeakPolarHBondContact O-CB 3.31Å; E125-A129 PolarHBondContact O-N 3.48Å; I126-A129 PolarHBondContact O-N 2.72Å; A129-M132 PolarHBondContact O-N 2.69Å; A129-S133 WeakPolarHBondContact O-CB 3.03Å; A129-S133 PolarHBondContact O-N 3.46Å; A129-S133 PolarHBondContact O-OG 3.08Å; A129-G290 VanDerWaalsContact CB-C 3.48Å; A129-G290 WeakPolarHBondContact CB-O 3.47Å; A129-M294 HydrophobicContact CB-CB 4.18Å; A129-M294 HydrophobicContact CB-CG 3.56Å
130I95.8Very high94.3Very high0 Ų027.9 Ų27.90%015%0.146CC..Hα-helixtrans-62-47.5177.1-68.6169.2000111.2F84 I126 Q127 M132 S133 S134 M294F84-I130 HydrophobicContact CD1-CD1 4.32Å; F84-I130 HydrophobicContact CD1-CG1 3.88Å; F84-I130 HydrophobicContact CE1-CG1 4.19Å; F84-I130 HydrophobicContact CE1-CG2 4.27Å; I126-I130 HydrophobicContact CG2-CD1 3.51Å; I126-I130 HydrophobicContact CG2-CG1 4.2Å; I126-I130 WeakPolarHBondContact O-CB 3.29Å; I126-I130 VanDerWaalsContact O-CG1 3.23Å; I126-I130 WeakPolarHBondContact O-CG1 3.49Å; I126-I130 PolarHBondContact O-N 2.69Å; Q127-I130 PolarHBondContact O-N 2.87Å; I130-M132 VanDerWaalsContact C-N 3.3Å; I130-M132 PolarHBondContact O-N 3.27Å; I130-S133 PolarHBondContact O-N 2.89Å; I130-S133 PolarHBondContact O-OG 3.47Å; I130-S134 WeakPolarHBondContact O-CB 3.17Å; I130-S134 PolarHBondContact O-N 2.97Å; I130-S134 PolarHBondContact O-OG 3.11Å; I130-M294 HydrophobicContact CG1-CE 4.23Å; I130-M294 HydrophobicContact CG1-CG 4.22Å; I130-M294 HydrophobicContact CG1-SD 3.96Å
131I96.8Very high94.3Very high22 Ų2225.5 Ų25.511%0.11314%0.136CC..Hα-helixtrans-57.7-47.8-178.6-71.2163.7000110.2Q127 G128 L135 P284 V338 L342Q127-I131 WeakPolarHBondContact O-CB 3.28Å; Q127-I131 WeakPolarHBondContact O-CD1 3.45Å; Q127-I131 WeakPolarHBondContact O-CG1 3.22Å; Q127-I131 PolarHBondContact O-N 2.73Å; G128-I131 PolarHBondContact O-N 3.41Å; I131-L135 HydrophobicContact CG2-CD1 4.4Å; I131-L135 VanDerWaalsContact O-CG 3.31Å; I131-L135 WeakPolarHBondContact O-CG 3.46Å; I131-L135 PolarHBondContact O-N 2.95Å; I131-P284 HydrophobicContact CD1-CB 4.02Å; I131-P284 HydrophobicContact CD1-CG 3.64Å; I131-V338 HydrophobicContact CG2-CG1 4.45Å; I131-L342 HydrophobicContact CD1-CD2 3.94Å; I131-L342 HydrophobicContact CD1-CG 4.17Å
132M96.6Very high94.2Very high75 Ų7527.7 Ų27.737%0.36914%0.14SC..Hα-helixtrans-72-40.6-176.6-68.8-56.5-58.200112.8G128 A129 I130 S134 L135 V136 V286 V291G128-M132 WeakPolarHBondContact O-CG 3.32Å; G128-M132 PolarHBondContact O-N 2.96Å; G128-M132 VanDerWaalsContact O-N 3.09Å; A129-M132 PolarHBondContact O-N 2.69Å; I130-M132 VanDerWaalsContact C-N 3.3Å; I130-M132 PolarHBondContact O-N 3.27Å; M132-S134 VanDerWaalsContact C-N 3.33Å; M132-L135 PolarHBondContact O-N 3.05Å; M132-L135 HydrophobicContact SD-CD1 3.97Å; M132-V136 PolarHBondContact O-N 3.4Å; M132-V286 HydrophobicContact CG-CB 4.47Å; M132-V286 HydrophobicContact CG-CG1 3.76Å; M132-V286 HydrophobicContact CG-CG2 3.79Å; M132-V291 HydrophobicContact CB-CB 4.47Å; M132-V291 HydrophobicContact CB-CG1 4Å; M132-V291 HydrophobicContact CB-CG2 3.59Å; M132-V291 HydrophobicContact CG-CG2 4.16Å
133S94.7Very high94Very high0 Ų029 Ų290%015%0.152CC..Hα-helixtrans-64.8-40.2175.565.50000111.4A129 I130 L135 V136 E137 M294 T298A129-S133 WeakPolarHBondContact O-CB 3.03Å; A129-S133 PolarHBondContact O-N 3.46Å; A129-S133 PolarHBondContact O-OG 3.08Å; I130-S133 PolarHBondContact O-N 2.89Å; I130-S133 PolarHBondContact O-OG 3.47Å; S133-L135 VanDerWaalsContact C-N 3.34Å; S133-L135 PolarHBondContact O-N 3.4Å; S133-V136 WeakPolarHBondContact O-CA 3.29Å; S133-V136 VanDerWaalsContact O-CB 3.26Å; S133-V136 WeakPolarHBondContact O-CB 3.18Å; S133-V136 PolarHBondContact O-N 3.39Å; S133-E137 PolarHBondContact O-N 3.1Å; S133-E137 VanDerWaalsContact O-N 3.16Å; S133-M294 WeakPolarHBondContact OG-CB 3.32Å; S133-M294 PolarHBondContact OG-O 3.23Å; S133-T298 WeakPolarHBondContact OG-CG2 3.42Å
134S96.2Very high93.5Very high0 Ų029 Ų290%015%0.152CC..Hα-helixtrans-71.9-25.2178.3-62.20000113.6I130 M132 V136 E137 V138 C337I130-S134 WeakPolarHBondContact O-CB 3.17Å; I130-S134 PolarHBondContact O-N 2.97Å; I130-S134 PolarHBondContact O-OG 3.11Å; M132-S134 VanDerWaalsContact C-N 3.33Å; S134-V136 PolarHBondContact O-N 3.32Å; S134-E137 WeakPolarHBondContact O-CB 3.31Å; S134-E137 PolarHBondContact O-N 2.83Å; S134-V138 WeakPolarHBondContact O-CG2 3.45Å; S134-V138 PolarHBondContact O-N 2.93Å; S134-C337 WeakPolarHBondContact OG-CB 3.34Å
135L96.8Very high93Very high78 Ų7829 Ų2941%0.40816%0.157SC..Hα-helixtrans-62.8-35167.3-76.1172.2000111.6I131 M132 S133 V138 V139 V338I131-L135 HydrophobicContact CG2-CD1 4.4Å; I131-L135 VanDerWaalsContact O-CG 3.31Å; I131-L135 WeakPolarHBondContact O-CG 3.46Å; I131-L135 PolarHBondContact O-N 2.95Å; M132-L135 PolarHBondContact O-N 3.05Å; M132-L135 HydrophobicContact SD-CD1 3.97Å; S133-L135 VanDerWaalsContact C-N 3.34Å; S133-L135 PolarHBondContact O-N 3.4Å; L135-V138 WeakPolarHBondContact O-CB 3.35Å; L135-V138 PolarHBondContact O-N 3.28Å; L135-V139 WeakPolarHBondContact O-CG2 3.5Å; L135-V139 PolarHBondContact O-N 3.23Å; L135-V139 VanDerWaalsContact O-N 3.09Å; L135-V338 HydrophobicContact CD2-CG2 4.18Å; L135-V338 HydrophobicContact CG-CG2 4.19Å
136V94.6Very high92.3Very high60 Ų6029 Ų2936%0.36416%0.158SC..Hα-helixtrans-65.5-43.4172.6-176.60000110.2M132 S133 S134 V138 V139 I140 L295M132-V136 PolarHBondContact O-N 3.4Å; S133-V136 WeakPolarHBondContact O-CA 3.29Å; S133-V136 VanDerWaalsContact O-CB 3.26Å; S133-V136 WeakPolarHBondContact O-CB 3.18Å; S133-V136 PolarHBondContact O-N 3.39Å; S134-V136 PolarHBondContact O-N 3.32Å; V136-V138 VanDerWaalsContact C-N 3.33Å; V136-V138 PolarHBondContact O-N 3.46Å; V136-V139 WeakPolarHBondContact O-CB 3.33Å; V136-V139 PolarHBondContact O-N 3Å; V136-V139 VanDerWaalsContact O-N 3.1Å; V136-I140 HydrophobicContact CG1-CD1 3.96Å; V136-I140 HydrophobicContact CG1-CG1 4.39Å; V136-I140 WeakPolarHBondContact O-CG1 3.29Å; V136-I140 PolarHBondContact O-N 3.3Å; V136-L295 HydrophobicContact CB-CD1 3.86Å; V136-L295 HydrophobicContact CG1-CD1 3.8Å; V136-L295 HydrophobicContact CG2-CD1 4.26Å
137E94.5Very high91.1Very high3 Ų329.6 Ų29.61%0.01416%0.164CC..Hα-helixtrans-58.4-41.2174177.4176.7-169.200112.7S133 S134 V139 I140 G141 I302 I330S133-E137 PolarHBondContact O-N 3.1Å; S133-E137 VanDerWaalsContact O-N 3.16Å; S134-E137 WeakPolarHBondContact O-CB 3.31Å; S134-E137 PolarHBondContact O-N 2.83Å; E137-V139 VanDerWaalsContact C-N 3.33Å; E137-V139 PolarHBondContact O-N 3.46Å; E137-I140 WeakPolarHBondContact O-CB 3.36Å; E137-I140 PolarHBondContact O-N 2.68Å; E137-G141 PolarHBondContact O-N 2.82Å; E137-I302 HydrophobicContact CB-CD1 4.48Å; E137-I302 HydrophobicContact CG-CD1 3.99Å; E137-I302 HydrophobicContact CG-CG1 4.05Å; E137-I330 HydrophobicContact CG-CG2 4.11Å
138V95.8Very high89.9Confident24 Ų2433.2 Ų33.215%0.14518%0.183CC..Hα-helixtrans-58.7-45.5173.1171.10000110.8S134 L135 V136 G141 F142 F331 G334 I335S134-V138 WeakPolarHBondContact O-CG2 3.45Å; S134-V138 PolarHBondContact O-N 2.93Å; L135-V138 WeakPolarHBondContact O-CB 3.35Å; L135-V138 PolarHBondContact O-N 3.28Å; V136-V138 VanDerWaalsContact C-N 3.33Å; V136-V138 PolarHBondContact O-N 3.46Å; V138-G141 PolarHBondContact O-N 3.37Å; V138-F142 VanDerWaalsContact O-CB 3.22Å; V138-F142 WeakPolarHBondContact O-CB 3.47Å; V138-F142 PolarHBondContact O-N 2.85Å; V138-F331 HydrophobicContact CG1-CD2 3.76Å; V138-F331 HydrophobicContact CG1-CE2 3.54Å; V138-F331 WeakPolarHBondContact O-CD2 3.25Å; V138-G334 VanDerWaalsContact CG2-C 3.43Å; V138-I335 HydrophobicContact CG2-CG1 3.89Å
139V94.8Very high88.8Confident95 Ų9536.6 Ų36.658%0.57620%0.201SC*.Hα-helixtrans-64.4-40.9177.3173.40000111.1L135 V136 E137 F142 S143L135-V139 WeakPolarHBondContact O-CG2 3.5Å; L135-V139 PolarHBondContact O-N 3.23Å; L135-V139 VanDerWaalsContact O-N 3.09Å; V136-V139 WeakPolarHBondContact O-CB 3.33Å; V136-V139 PolarHBondContact O-N 3Å; V136-V139 VanDerWaalsContact O-N 3.1Å; E137-V139 VanDerWaalsContact C-N 3.33Å; E137-V139 PolarHBondContact O-N 3.46Å; V139-F142 PolarHBondContact O-N 3.38Å; V139-S143 VanDerWaalsContact O-CB 3.3Å; V139-S143 WeakPolarHBondContact O-CB 3.23Å; V139-S143 PolarHBondContact O-N 3.44Å; V139-S143 PolarHBondContact O-OG 3.45Å
140I90.9Very high87.5Confident30 Ų3037.7 Ų37.715%0.15421%0.206CC..Hα-helixtrans-60.4-51.5175.9-71.8168.9000110.5V136 E137 F142 S143 G144 L145 P146 I302V136-I140 HydrophobicContact CG1-CD1 3.96Å; V136-I140 HydrophobicContact CG1-CG1 4.39Å; V136-I140 WeakPolarHBondContact O-CG1 3.29Å; V136-I140 PolarHBondContact O-N 3.3Å; E137-I140 WeakPolarHBondContact O-CB 3.36Å; E137-I140 PolarHBondContact O-N 2.68Å; I140-F142 VanDerWaalsContact C-N 3.34Å; I140-F142 PolarHBondContact O-N 3.42Å; I140-S143 PolarHBondContact O-N 2.94Å; I140-S143 PolarHBondContact O-OG 3.15Å; I140-G144 PolarHBondContact O-N 3.4Å; I140-L145 HydrophobicContact CG1-CD1 4.32Å; I140-L145 HydrophobicContact CG2-CB 4.11Å; I140-L145 PolarHBondContact O-N 3.15Å; I140-P146 HydrophobicContact CG2-CG 3.68Å; I140-P146 VanDerWaalsContact O-CD 3.24Å; I140-P146 WeakPolarHBondContact O-CD 3.28Å; I140-I302 HydrophobicContact CD1-CD1 4.29Å; I140-I302 HydrophobicContact CG2-CD1 4.12Å
141G90.1Very high86.3Confident0 Ų042.5 Ų42.50%023%0.229CC..Hα-helixtrans-61.7-40.8177.200000112.8E137 V138 G144E137-G141 PolarHBondContact O-N 2.82Å; V138-G141 PolarHBondContact O-N 3.37Å; G141-G144 PolarHBondContact O-N 3.03Å
142F90Very high85.3Confident95 Ų9547.7 Ų47.742%0.41725%0.248SC..Hα-helixtrans-66.2-41.9179-178.2-99.2000113.2V138 V139 I140 G144 F331 F535 I537V138-F142 VanDerWaalsContact O-CB 3.22Å; V138-F142 WeakPolarHBondContact O-CB 3.47Å; V138-F142 PolarHBondContact O-N 2.85Å; V139-F142 PolarHBondContact O-N 3.38Å; I140-F142 VanDerWaalsContact C-N 3.34Å; I140-F142 PolarHBondContact O-N 3.42Å; F142-G144 PolarHBondContact O-N 3.31Å; F142-F331 HydrophobicContact CB-CD2 3.91Å; F142-F331 HydrophobicContact CB-CE2 4.23Å; F142-F331 HydrophobicContact CD2-CE2 4.22Å; F142-F535 AromaticContact CE2-CD1 3.96Å; F142-F535 HydrophobicContact CE2-CD1 3.96Å; F142-F535 HydrophobicContact CE2-CE1 4.04Å; F142-F535 AromaticContact CZ-CD1 3.92Å; F142-F535 HydrophobicContact CZ-CD1 3.92Å; F142-F535 AromaticContact CZ-CE1 3.66Å; F142-F535 HydrophobicContact CZ-CE1 3.66Å; F142-I537 HydrophobicContact CD2-CD1 4.11Å; F142-I537 HydrophobicContact CE2-CD1 4.4Å
143S88.6Confident84.6Confident46 Ų4645.4 Ų45.432%0.32224%0.237SC..Hα-helixtrans-71.7-16.6178.958.50000113.6V139 I140 L145V139-S143 VanDerWaalsContact O-CB 3.3Å; V139-S143 WeakPolarHBondContact O-CB 3.23Å; V139-S143 PolarHBondContact O-N 3.44Å; V139-S143 PolarHBondContact O-OG 3.45Å; I140-S143 PolarHBondContact O-N 2.94Å; I140-S143 PolarHBondContact O-OG 3.15Å; S143-L145 VanDerWaalsContact C-N 3.31Å; S143-L145 WeakPolarHBondContact OG-CD1 3.26Å; S143-L145 WeakPolarHBondContact OG-CG 3.29Å
144G82.1Confident84.1Confident0 Ų045.4 Ų45.40%024%0.237CC..THydrogen-bonded Turntrans7814.6-179.600000114.6I140 G141 F142 G147 N327I140-G144 PolarHBondContact O-N 3.4Å; G141-G144 PolarHBondContact O-N 3.03Å; F142-G144 PolarHBondContact O-N 3.31Å; G144-G147 PolarHBondContact O-N 3.17Å; G144-N327 VanDerWaalsContact CA-CG 3.5Å; G144-N327 VanDerWaalsContact CA-ND2 3.33Å; G144-N327 WeakPolarHBondContact CA-ND2 3.21Å
145L82.6Confident83.7Confident77 Ų7745.4 Ų45.440%0.40324%0.237SC..Hα-helixtrans-53.9-39.7174.5-79.8168.8000114I140 S143 G147 L148 L149I140-L145 HydrophobicContact CG1-CD1 4.32Å; I140-L145 HydrophobicContact CG2-CB 4.11Å; I140-L145 PolarHBondContact O-N 3.15Å; S143-L145 VanDerWaalsContact C-N 3.31Å; S143-L145 WeakPolarHBondContact OG-CD1 3.26Å; S143-L145 WeakPolarHBondContact OG-CG 3.29Å; L145-G147 PolarHBondContact O-N 3.3Å; L145-L148 HydrophobicContact CD2-CD1 4.47Å; L145-L148 WeakPolarHBondContact O-CB 3.44Å; L145-L148 PolarHBondContact O-N 3.27Å; L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 2.81Å
146P78.7Confident83.3Confident2 Ų241.7 Ų41.71%0.01322%0.217CC..Hα-helixtrans-55.5-42.1177-27.836.6000112.1I140 L148 L149 L150 I306 I330I140-P146 HydrophobicContact CG2-CG 3.68Å; I140-P146 VanDerWaalsContact O-CD 3.24Å; I140-P146 WeakPolarHBondContact O-CD 3.28Å; P146-L148 VanDerWaalsContact C-N 3.26Å; P146-L148 PolarHBondContact O-N 3.24Å; P146-L149 PolarHBondContact O-N 2.79Å; P146-L150 WeakPolarHBondContact O-CG 3.42Å; P146-L150 PolarHBondContact O-N 2.7Å; P146-L150 VanDerWaalsContact O-N 3.11Å; P146-I306 HydrophobicContact CB-CD1 4.34Å; P146-I330 HydrophobicContact CB-CG1 4.39Å; P146-I330 HydrophobicContact CG-CB 4.29Å; P146-I330 HydrophobicContact CG-CG1 4.26Å; P146-I330 HydrophobicContact CG-CG2 4.08Å
147G69.4Low83.1Confident13 Ų1339.1 Ų39.113%0.13420%0.202CC..Hα-helixtrans-59.1-32.7175.600000114.5G144 L145 N327G144-G147 PolarHBondContact O-N 3.17Å; L145-G147 PolarHBondContact O-N 3.3Å; G147-N327 PolarHBondContact N-OD1 3.42Å
148L70.1Confident82.7Confident77 Ų7739 Ų3940%0.40320%0.201SC..Hα-helixtrans-81.2-36.8177.1-66.2170000111.9L145 P146 L150 F544L145-L148 HydrophobicContact CD2-CD1 4.47Å; L145-L148 WeakPolarHBondContact O-CB 3.44Å; L145-L148 PolarHBondContact O-N 3.27Å; P146-L148 VanDerWaalsContact C-N 3.26Å; P146-L148 PolarHBondContact O-N 3.24Å; L148-L150 VanDerWaalsContact C-N 3.28Å; L148-L150 PolarHBondContact O-N 2.83Å; L148-F544 HydrophobicContact CD1-CD2 4.35Å; L148-F544 HydrophobicContact CD1-CE2 4.12Å; L148-F544 HydrophobicContact CD1-CZ 4.34Å; L148-F544 HydrophobicContact CD2-CB 4.32Å; L148-F544 HydrophobicContact CD2-CD2 3.62Å; L148-F544 HydrophobicContact CD2-CE2 4.14Å; L148-F544 HydrophobicContact CD2-CG 4.04Å; L148-F544 HydrophobicContact CG-CD2 3.88Å; L148-F544 HydrophobicContact CG-CE2 3.86Å
149L70.8Confident82.5Confident72 Ų7237.9 Ų37.938%0.37720%0.195SC..Hα-helixtrans-73.6-18-178.9-70.3170.1000113.2L145 P146 E151 Y152 I153L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 2.81Å; P146-L149 PolarHBondContact O-N 2.79Å; L149-E151 PolarHBondContact O-N 2.94Å; L149-E151 VanDerWaalsContact O-N 3.09Å; L149-Y152 PolarHBondContact O-N 3.27Å; L149-I153 HydrophobicContact CB-CD1 3.88Å; L149-I153 HydrophobicContact CB-CG1 4.43Å; L149-I153 WeakPolarHBondContact O-CG1 3.46Å; L149-I153 PolarHBondContact O-N 2.96Å
150L68.8Low82.4Confident23 Ų2333.4 Ų33.412%0.1217%0.167CC..THydrogen-bonded Turntrans-54.3-24.8174.3-80.6172.8000113.8P146 L148 I306 Y310 I326P146-L150 WeakPolarHBondContact O-CG 3.42Å; P146-L150 PolarHBondContact O-N 2.7Å; P146-L150 VanDerWaalsContact O-N 3.11Å; L148-L150 VanDerWaalsContact C-N 3.28Å; L148-L150 PolarHBondContact O-N 2.83Å; L150-I306 HydrophobicContact CD2-CD1 4.36Å; L150-I306 HydrophobicContact CD2-CG2 3.49Å; L150-I306 VanDerWaalsContact CD2-CG2 3.49Å; L150-Y310 HydrophobicContact CD2-CE2 4.31Å; L150-I326 HydrophobicContact CD1-CD1 3.92Å
151E69Low82.2Confident101 Ų10132.5 Ų32.547%0.47216%0.163SC..THydrogen-bonded Turntrans-77.5-23.3177.8-65.1-168.9-164.400113.6L149 R489L149-E151 PolarHBondContact O-N 2.94Å; L149-E151 VanDerWaalsContact O-N 3.09Å; E151-R489 IonicContact OE2-NH2 3.61Å
152Y77.4Confident82.1Confident131 Ų13132.8 Ų32.851%0.51417%0.165SC..THydrogen-bonded Turntrans-106.2-23.1-177.4-61.1-78.4000113L149 G154 N483L149-Y152 PolarHBondContact O-N 3.27Å; Y152-G154 PolarHBondContact O-N 3.48Å; Y152-N483 PolarHBondContact O-ND2 3.45Å
153I80.3Confident82.1Confident26 Ų2628.2 Ų28.213%0.13315%0.145CC..  trans-93.593.3178-58.8176.4000108.3L149 T157 I158 V303 F479L149-I153 HydrophobicContact CB-CD1 3.88Å; L149-I153 HydrophobicContact CB-CG1 4.43Å; L149-I153 WeakPolarHBondContact O-CG1 3.46Å; L149-I153 PolarHBondContact O-N 2.96Å; I153-T157 HydrophobicContact CG2-CG2 4.47Å; I153-I158 HydrophobicContact CG2-CD1 4.26Å; I153-I158 HydrophobicContact CG2-CG1 3.87Å; I153-V303 HydrophobicContact CD1-CG2 4.12Å; I153-V303 HydrophobicContact CG2-CG1 4.1Å; I153-V303 HydrophobicContact CG2-CG2 4.38Å; I153-F479 HydrophobicContact CG1-CD2 4.45Å; I153-F479 HydrophobicContact CG1-CE2 4.29Å
154G84.9Confident82.3Confident0 Ų026 Ų260%013%0.13CC..  trans-93.2170.2176.400000114.1Y152 L156 T157 I158 L494Y152-G154 PolarHBondContact O-N 3.48Å; G154-L156 PolarHBondContact O-N 2.73Å; G154-L156 VanDerWaalsContact O-N 3.1Å; G154-T157 WeakPolarHBondContact O-CB 3.47Å; G154-T157 PolarHBondContact O-N 3.01Å; G154-I158 WeakPolarHBondContact O-CG1 3.27Å; G154-I158 PolarHBondContact O-N 3.38Å; G154-I158 VanDerWaalsContact O-N 3.12Å; G154-L494 VanDerWaalsContact CA-CD2 3.46Å
155P86.7Confident82.5Confident0 Ų026.3 Ų26.30%013%0.131CC..Hα-helixtrans-54.8-30176.5-23.932.9000113.9T157 I158 T159 N416 L419 V420 W497P155-T157 VanDerWaalsContact C-N 3.33Å; P155-I158 PolarHBondContact O-N 3.48Å; P155-T159 WeakPolarHBondContact O-CB 3.48Å; P155-T159 PolarHBondContact O-N 3.04Å; P155-T159 PolarHBondContact O-OG1 2.88Å; P155-N416 HydrophobicContact CB-CB 4.3Å; P155-N416 WeakPolarHBondContact CB-O 3.19Å; P155-L419 HydrophobicContact CB-CB 4.3Å; P155-L419 HydrophobicContact CB-CD1 4.47Å; P155-L419 HydrophobicContact CG-CB 3.97Å; P155-L419 HydrophobicContact CG-CD1 3.88Å; P155-V420 HydrophobicContact CB-CG2 3.74Å; P155-V420 HydrophobicContact CG-CG2 4.49Å; P155-W497 HydrophobicContact CG-CB 4.27Å; P155-W497 HydrophobicContact CG-CD2 4.31Å; P155-W497 HydrophobicContact CG-CE3 4.06Å; P155-W497 HydrophobicContact CG-CG 4.43Å
156L90.3Very high82.7Confident0 Ų022.7 Ų22.70%011%0.112CC..Hα-helixtrans-68.3-28.9176.3-170.460.4000113.1G154 P160 V420 N427 V430 L431 D482G154-L156 PolarHBondContact O-N 2.73Å; G154-L156 VanDerWaalsContact O-N 3.1Å; L156-P160 WeakPolarHBondContact O-CD 3.29Å; L156-V420 HydrophobicContact CB-CG2 4.42Å; L156-V420 HydrophobicContact CD1-CG1 4.37Å; L156-N427 HydrophobicContact CD2-CB 4.26Å; L156-N427 WeakPolarHBondContact CD2-OD1 3.15Å; L156-V430 HydrophobicContact CD1-CG1 4.37Å; L156-V430 HydrophobicContact CD2-CB 3.92Å; L156-V430 HydrophobicContact CD2-CG1 3.74Å; L156-V430 HydrophobicContact CD2-CG2 4.36Å; L156-V430 HydrophobicContact CG-CB 4.35Å; L156-V430 HydrophobicContact CG-CG1 3.81Å; L156-L431 HydrophobicContact CD1-CB 3.97Å; L156-D482 HydrophobicContact CD2-CB 4.31Å
157T88.6Confident83.3Confident6 Ų625.3 Ų25.34%0.03713%0.126CC..Hα-helixtrans-81.9-39.8173.8-62.30000111.8I153 G154 P155 T159 T161 F479I153-T157 HydrophobicContact CG2-CG2 4.47Å; G154-T157 WeakPolarHBondContact O-CB 3.47Å; G154-T157 PolarHBondContact O-N 3.01Å; P155-T157 VanDerWaalsContact C-N 3.33Å; T157-T159 VanDerWaalsContact C-N 3.32Å; T157-T159 PolarHBondContact O-N 3.09Å; T157-T161 PolarHBondContact O-OG1 2.95Å; T157-F479 HydrophobicContact CG2-CB 3.63Å; T157-F479 HydrophobicContact CG2-CD2 4.13Å; T157-F479 HydrophobicContact CG2-CG 4.39Å; T157-F479 WeakPolarHBondContact OG1-CA 3.49Å
158I86.9Confident84.2Confident2 Ų225.2 Ų25.21%0.0112%0.123CC..Hα-helixtrans-65.7-39.5-178.6-59.8177.9000110.6I153 G154 P155 T161 V162 V303 W497I153-I158 HydrophobicContact CG2-CD1 4.26Å; I153-I158 HydrophobicContact CG2-CG1 3.87Å; G154-I158 WeakPolarHBondContact O-CG1 3.27Å; G154-I158 PolarHBondContact O-N 3.38Å; G154-I158 VanDerWaalsContact O-N 3.12Å; P155-I158 PolarHBondContact O-N 3.48Å; I158-T161 PolarHBondContact O-N 3.39Å; I158-V162 HydrophobicContact CG2-CG2 3.78Å; I158-V162 WeakPolarHBondContact O-CG2 3.2Å; I158-V162 PolarHBondContact O-N 3.44Å; I158-V303 HydrophobicContact CB-CG1 4.24Å; I158-V303 HydrophobicContact CD1-CG1 4.41Å; I158-V303 HydrophobicContact CG1-CG1 3.64Å; I158-V303 HydrophobicContact CG2-CG1 4.21Å; I158-W497 HydrophobicContact CD1-CH2 3.75Å; I158-W497 HydrophobicContact CD1-CZ2 3.89Å; I158-W497 HydrophobicContact CD1-CZ3 4.48Å
159T91Very high84.9Confident0 Ų021.7 Ų21.70%011%0.105CC..Hα-helixtrans-57.5-54-172.6-63.70000112.9P155 T157 T161 S163 G413 L414 L417 L431P155-T159 WeakPolarHBondContact O-CB 3.48Å; P155-T159 PolarHBondContact O-N 3.04Å; P155-T159 PolarHBondContact O-OG1 2.88Å; T157-T159 VanDerWaalsContact C-N 3.32Å; T157-T159 PolarHBondContact O-N 3.09Å; T159-T161 PolarHBondContact O-N 2.86Å; T159-S163 WeakPolarHBondContact O-CB 3.45Å; T159-S163 PolarHBondContact O-N 2.89Å; T159-S163 PolarHBondContact O-OG 3.37Å; T159-G413 PolarHBondContact OG1-O 3.04Å; T159-L414 HydrophobicContact CG2-CD2 3.88Å; T159-L417 HydrophobicContact CG2-CD1 4.02Å; T159-L417 HydrophobicContact CG2-CD2 3.81Å; T159-L417 HydrophobicContact CG2-CG 3.75Å; T159-L431 HydrophobicContact CG2-CD1 3.78Å
160P93.2Very high85.8Confident0 Ų024.8 Ų24.80%012%0.115CC..Hα-helixtrans-62.3-42.2177.6-27.439.4000112.8L156 V162 S163 L164 L431 M435 A478L156-P160 WeakPolarHBondContact O-CD 3.29Å; P160-V162 PolarHBondContact O-N 3.16Å; P160-S163 PolarHBondContact O-N 3.26Å; P160-L164 HydrophobicContact CB-CD1 4.48Å; P160-L164 VanDerWaalsContact O-CB 3.25Å; P160-L164 WeakPolarHBondContact O-CB 3.31Å; P160-L164 WeakPolarHBondContact O-CD1 3.3Å; P160-L164 WeakPolarHBondContact O-CG 3.03Å; P160-L164 PolarHBondContact O-N 3.45Å; P160-L431 HydrophobicContact CG-CD1 4.07Å; P160-M435 HydrophobicContact CB-CG 4.19Å; P160-M435 HydrophobicContact CB-SD 4.07Å; P160-M435 HydrophobicContact CG-CG 4.25Å; P160-A478 HydrophobicContact CB-CB 4.15Å; P160-A478 HydrophobicContact CG-CB 3.71Å
161T87.9Confident86.8Confident11 Ų1127 Ų277%0.06713%0.13CC..Hα-helixtrans-55.4-52.9179.7-490000111.5T157 I158 T159 I165 A300 G475T157-T161 PolarHBondContact O-OG1 2.95Å; I158-T161 PolarHBondContact O-N 3.39Å; T159-T161 PolarHBondContact O-N 2.86Å; T161-I165 WeakPolarHBondContact O-CG1 3.45Å; T161-A300 HydrophobicContact CG2-CB 3.8Å; T161-G475 WeakPolarHBondContact OG1-CA 3.4Å
162V86.1Confident87.6Confident6 Ų623 Ų234%0.03611%0.112CC..Hα-helixtrans-75.5-38.6-176.31790000111.8I158 P160 L164 I165 E304I158-V162 HydrophobicContact CG2-CG2 3.78Å; I158-V162 WeakPolarHBondContact O-CG2 3.2Å; I158-V162 PolarHBondContact O-N 3.44Å; P160-V162 PolarHBondContact O-N 3.16Å; V162-L164 VanDerWaalsContact C-N 3.33Å; V162-L164 PolarHBondContact O-N 3.29Å; V162-I165 WeakPolarHBondContact O-CB 3.34Å; V162-I165 PolarHBondContact O-N 3.26Å; V162-E304 HydrophobicContact CG2-CB 4.41Å
163S91.6Very high88.2Confident0 Ų016.9 Ų16.90%09%0.089CC..Hα-helixtrans-67.3-35.8-178.1-53.60000111.9T159 P160 I165 G166 L167 L414T159-S163 WeakPolarHBondContact O-CB 3.45Å; T159-S163 PolarHBondContact O-N 2.89Å; T159-S163 PolarHBondContact O-OG 3.37Å; P160-S163 PolarHBondContact O-N 3.26Å; S163-I165 VanDerWaalsContact C-N 3.32Å; S163-I165 PolarHBondContact O-N 3.43Å; S163-G166 PolarHBondContact O-N 2.9Å; S163-L167 PolarHBondContact O-N 3.42Å; S163-L414 PolarHBondContact OG-N 2.95Å
164L91.9Very high88.8Confident0 Ų016.9 Ų16.90%010%0.095CC..Hα-helixtrans-72.3-22.5178.5-69.3170.9000113.4P160 V162 G166 L167 S168 M435 L439 E470 M471P160-L164 HydrophobicContact CB-CD1 4.48Å; P160-L164 VanDerWaalsContact O-CB 3.25Å; P160-L164 WeakPolarHBondContact O-CB 3.31Å; P160-L164 WeakPolarHBondContact O-CD1 3.3Å; P160-L164 WeakPolarHBondContact O-CG 3.03Å; P160-L164 PolarHBondContact O-N 3.45Å; V162-L164 VanDerWaalsContact C-N 3.33Å; V162-L164 PolarHBondContact O-N 3.29Å; L164-G166 VanDerWaalsContact C-N 3.29Å; L164-G166 PolarHBondContact O-N 3.15Å; L164-L167 HydrophobicContact CD2-CD1 4.36Å; L164-L167 PolarHBondContact O-N 2.99Å; L164-S168 VanDerWaalsContact O-CB 3.25Å; L164-S168 WeakPolarHBondContact O-CB 3.43Å; L164-S168 PolarHBondContact O-N 2.91Å; L164-S168 PolarHBondContact O-OG 3.47Å; L164-M435 HydrophobicContact CD2-SD 4.22Å; L164-M435 HydrophobicContact CG-SD 3.98Å; L164-L439 HydrophobicContact CD2-CD1 4.21Å; L164-L439 HydrophobicContact CD2-CD2 3.57Å; L164-L439 HydrophobicContact CD2-CG 3.56Å; L164-E470 HydrophobicContact CB-CB 4.36Å; L164-E470 WeakPolarHBondContact CD1-O 3.09Å; L164-M471 HydrophobicContact CB-CB 4.41Å
165I86.9Confident89.2Confident5 Ų522.7 Ų22.73%0.02613%0.126CC..Hα-helixtrans-59.8-44169.3-64.1169.1000110.1F82 A83 T161 V162 S163 S168 I409 M471F82-I165 HydrophobicContact CB-CG2 3.54Å; A83-I165 HydrophobicContact CB-CD1 4.38Å; T161-I165 WeakPolarHBondContact O-CG1 3.45Å; V162-I165 WeakPolarHBondContact O-CB 3.34Å; V162-I165 PolarHBondContact O-N 3.26Å; S163-I165 VanDerWaalsContact C-N 3.32Å; S163-I165 PolarHBondContact O-N 3.43Å; I165-S168 PolarHBondContact O-OG 2.7Å; I165-S168 VanDerWaalsContact O-OG 3.08Å; I165-I409 HydrophobicContact CG2-CG2 4.48Å; I165-M471 HydrophobicContact CD1-CE 3.81Å; I165-M471 HydrophobicContact CD1-SD 4.44Å; I165-M471 HydrophobicContact CG1-CB 4.03Å; I165-M471 HydrophobicContact CG1-CE 3.75Å; I165-M471 HydrophobicContact CG1-SD 3.78Å
166G87Confident89.4Confident1 Ų123.5 Ų23.51%0.0113%0.129CC..Hα-helixtrans-71.7-44.2176.600000112.5S163 L164S163-G166 PolarHBondContact O-N 2.9Å; L164-G166 VanDerWaalsContact C-N 3.29Å; L164-G166 PolarHBondContact O-N 3.15Å
167L91.1Very high89.6Confident58 Ų5823.5 Ų23.530%0.30413%0.129SC..Hα-helixtrans-70.4-30.5-176.1-72170.8000113.8S163 L164 V169 F170 T410 M435 L439S163-L167 PolarHBondContact O-N 3.42Å; L164-L167 HydrophobicContact CD2-CD1 4.36Å; L164-L167 PolarHBondContact O-N 2.99Å; L167-V169 VanDerWaalsContact C-N 3.28Å; L167-V169 PolarHBondContact O-N 3.47Å; L167-F170 WeakPolarHBondContact O-CD1 3.29Å; L167-F170 PolarHBondContact O-N 3.23Å; L167-T410 HydrophobicContact CD1-CG2 4.06Å; L167-T410 HydrophobicContact CD2-CG2 3.99Å; L167-T410 HydrophobicContact CG-CG2 3.73Å; L167-M435 HydrophobicContact CD1-CE 3.57Å; L167-L439 HydrophobicContact CB-CD2 4.27Å; L167-L439 HydrophobicContact CD1-CD1 4.5Å
168S88Confident89.9Confident10 Ų1024.3 Ų24.37%0.0714%0.138CC..Hα-helixtrans-64-28.9-177.848.80000113.7L164 I165 F170 E470L164-S168 VanDerWaalsContact O-CB 3.25Å; L164-S168 WeakPolarHBondContact O-CB 3.43Å; L164-S168 PolarHBondContact O-N 2.91Å; L164-S168 PolarHBondContact O-OG 3.47Å; I165-S168 PolarHBondContact O-OG 2.7Å; I165-S168 VanDerWaalsContact O-OG 3.08Å; S168-F170 VanDerWaalsContact C-N 3.33Å; S168-F170 PolarHBondContact O-N 3.33Å; S168-E470 WeakPolarHBondContact CB-OE2 3.45Å
169V85.5Confident90.1Very high3 Ų324.9 Ų24.92%0.01814%0.144CC..THydrogen-bonded Turntrans-94.214.2-174.1-156.10000112.9L35 I86 L167 T171 A173 F406L35-V169 HydrophobicContact CD1-CG1 3.9Å; L35-V169 HydrophobicContact CD2-CG1 4.16Å; I86-V169 HydrophobicContact CD1-CG2 4.31Å; L167-V169 VanDerWaalsContact C-N 3.28Å; L167-V169 PolarHBondContact O-N 3.47Å; V169-T171 PolarHBondContact O-N 3.03Å; V169-A173 PolarHBondContact O-N 3.07Å; V169-F406 HydrophobicContact CB-CD2 3.88Å; V169-F406 HydrophobicContact CB-CE1 4.23Å; V169-F406 HydrophobicContact CB-CE2 3.51Å; V169-F406 HydrophobicContact CB-CG 4.4Å; V169-F406 HydrophobicContact CB-CZ 3.72Å; V169-F406 HydrophobicContact CG1-CD2 4.24Å; V169-F406 HydrophobicContact CG1-CE1 4.35Å; V169-F406 HydrophobicContact CG1-CE2 3.38Å; V169-F406 HydrophobicContact CG1-CZ 3.46Å; V169-F406 VanDerWaalsContact CG1-CZ 3.46Å; V169-F406 HydrophobicContact CG2-CE1 4.49Å; V169-F406 HydrophobicContact CG2-CZ 4.35Å
170F88.6Confident90.3Very high137 Ų13726.8 Ų26.860%0.60115%0.153SC*.Hα-helixtrans-66.9-35-174.882.2-78.8000113.6L167 S168 A173 G174L167-F170 WeakPolarHBondContact O-CD1 3.29Å; L167-F170 PolarHBondContact O-N 3.23Å; S168-F170 VanDerWaalsContact C-N 3.33Å; S168-F170 PolarHBondContact O-N 3.33Å; F170-A173 PolarHBondContact O-N 3.1Å; F170-G174 PolarHBondContact O-N 2.72Å
171T89.1Confident90.4Very high70 Ų7033.9 Ų33.943%0.42918%0.179SC..Hα-helixtrans-64.3-49.4179.3490000110.5V169 A173 G174 D175V169-T171 PolarHBondContact O-N 3.03Å; T171-A173 VanDerWaalsContact C-N 3.32Å; T171-A173 PolarHBondContact O-N 3.41Å; T171-G174 CarbonylContact O-C 3.32Å; T171-G174 WeakPolarHBondContact O-CA 3.21Å; T171-G174 PolarHBondContact O-N 3.14Å; T171-D175 PolarHBondContact O-N 2.87Å
172T86.9Confident90.9Very high17 Ų1735.5 Ų35.510%0.10420%0.198CC..Hα-helixtrans-64.3-37179.4-390000112.3L35 G174 D175 R176L35-T172 HydrophobicContact CD2-CG2 3.22Å; T172-G174 VanDerWaalsContact C-N 3.32Å; T172-D175 PolarHBondContact O-N 3.42Å; T172-R176 WeakPolarHBondContact O-CG 3.44Å; T172-R176 PolarHBondContact O-N 2.77Å; T172-R176 VanDerWaalsContact O-N 3.11Å
173A90.3Very high91.4Very high2 Ų235.5 Ų35.52%0.01720%0.198CC..Hα-helixtrans-62.2-41.917200000111.5V169 F170 T171 A177 F402 F406V169-A173 PolarHBondContact O-N 3.07Å; F170-A173 PolarHBondContact O-N 3.1Å; T171-A173 VanDerWaalsContact C-N 3.32Å; T171-A173 PolarHBondContact O-N 3.41Å; A173-A177 WeakPolarHBondContact O-CB 3.39Å; A173-A177 PolarHBondContact O-N 3.39Å; A173-F402 HydrophobicContact CB-CB 3.81Å; A173-F406 HydrophobicContact CB-CD2 3.87Å; A173-F406 HydrophobicContact CB-CE2 3.97Å
174G93.1Very high91.6Very high26 Ų2635.5 Ų35.527%0.26820%0.198SC..Hα-helixtrans-61.6-46174.900000113.2F170 T171 T172 A177 G178F170-G174 PolarHBondContact O-N 2.72Å; T171-G174 CarbonylContact O-C 3.32Å; T171-G174 WeakPolarHBondContact O-CA 3.21Å; T171-G174 PolarHBondContact O-N 3.14Å; T172-G174 VanDerWaalsContact C-N 3.32Å; G174-A177 PolarHBondContact O-N 3.38Å; G174-G178 PolarHBondContact O-N 2.83Å
175D91.6Very high91.9Very high122 Ų12238 Ų3865%0.65222%0.218SC*.Hα-helixtrans-64-43.4-179.7-68.3-28.1000111.9T171 T172 G178 A179T171-D175 PolarHBondContact O-N 2.87Å; T172-D175 PolarHBondContact O-N 3.42Å; D175-G178 PolarHBondContact O-N 3.11Å; D175-A179 PolarHBondContact O-N 3.19Å
176R91.4Very high92.4Very high18 Ų1840.6 Ų40.67%0.06823%0.232CC..Hα-helixtrans-68.3-40.8175.4-66.7-66.2-169.1143.810111.9E38 T172 G178 A179 D395E38-R176 IonicContact OE1-CZ 2.78Å; E38-R176 IonicContact OE1-NE 2.79Å; E38-R176 PolarHBondContact OE1-NE 3.45Å; E38-R176 IonicContact OE1-NH2 3.01Å; E38-R176 PolarHBondContact OE1-NH2 3.17Å; T172-R176 WeakPolarHBondContact O-CG 3.44Å; T172-R176 PolarHBondContact O-N 2.77Å; T172-R176 VanDerWaalsContact O-N 3.11Å; R176-G178 VanDerWaalsContact C-N 3.26Å; R176-G178 PolarHBondContact O-N 3.39Å; R176-A179 WeakPolarHBondContact O-CB 3.32Å; R176-A179 PolarHBondContact O-N 3.24Å; R176-D395 WeakPolarHBondContact CD-OD2 3.23Å; R176-D395 IonicContact CZ-OD2 3.46Å; R176-D395 IonicContact NE-OD2 3.1Å; R176-D395 IonicContact NH1-OD1 2.62Å; R176-D395 PolarHBondContact NH1-OD1 2.92Å; R176-D395 VanDerWaalsContact NH1-OD1 3.1Å; R176-D395 IonicContact NH1-OD2 3.66Å; R176-D395 PolarHBondContact NH1-OD2 3.19Å
177A94.8Very high92.8Very high0 Ų040.6 Ų40.60%023%0.232CC..Hα-helixtrans-64.3-36175.600000111.5A173 G174 A179 H180 W181 S184 M188A173-A177 WeakPolarHBondContact O-CB 3.39Å; A173-A177 PolarHBondContact O-N 3.39Å; G174-A177 PolarHBondContact O-N 3.38Å; A177-A179 PolarHBondContact O-N 3.47Å; A177-H180 CarbonylContact O-C 3.46Å; A177-H180 VanDerWaalsContact O-C 3.32Å; A177-H180 PolarHBondContact O-N 2.94Å; A177-W181 HydrophobicContact CB-CE3 4.49Å; A177-W181 HydrophobicContact CB-CH2 4.33Å; A177-W181 HydrophobicContact CB-CZ3 4.07Å; A177-W181 PolarHBondContact O-N 3.43Å; A177-S184 WeakPolarHBondContact CA-OG 3.48Å; A177-S184 PolarHBondContact O-OG 2.98Å; A177-M188 HydrophobicContact CB-CE 4.23Å
178G94Very high93Very high22 Ų2240 Ų4023%0.22723%0.228CC..Hα-helixtrans-68.1-13.4177.100000114.4G174 D175 R176 H180 Y254G174-G178 PolarHBondContact O-N 2.83Å; D175-G178 PolarHBondContact O-N 3.11Å; R176-G178 VanDerWaalsContact C-N 3.26Å; R176-G178 PolarHBondContact O-N 3.39Å; G178-H180 PolarHBondContact O-N 3.18Å; G178-Y254 VanDerWaalsContact O-CE2 3.32Å; G178-Y254 WeakPolarHBondContact O-CE2 3.42Å
179A92.4Very high93.5Very high14 Ų1444.5 Ų44.512%0.11625%0.25CS..THydrogen-bonded Turntrans-56.9-36.4170.700000112.2D175 R176 A177 G255 K257 D395 P396D175-A179 PolarHBondContact O-N 3.19Å; R176-A179 WeakPolarHBondContact O-CB 3.32Å; R176-A179 PolarHBondContact O-N 3.24Å; A177-A179 PolarHBondContact O-N 3.47Å; A179-G255 PolarHBondContact O-N 3.43Å; A179-K257 HydrophobicContact CB-CB 4.1Å; A179-K257 HydrophobicContact CB-CD 4.41Å; A179-D395 HydrophobicContact CB-CB 3.76Å; A179-P396 HydrophobicContact CB-CG 4.14Å
180H95.8Very high93.9Very high41 Ų4145.5 Ų45.519%0.1926%0.256CS..  trans-162.294.9167.2-169.3-60.5000111.6A177 G178 G182 L183 S184 Y254 P396A177-H180 CarbonylContact O-C 3.46Å; A177-H180 VanDerWaalsContact O-C 3.32Å; A177-H180 PolarHBondContact O-N 2.94Å; G178-H180 PolarHBondContact O-N 3.18Å; H180-G182 VanDerWaalsContact C-N 3.29Å; H180-G182 PolarHBondContact ND1-N 2.7Å; H180-G182 PolarHBondContact O-N 2.97Å; H180-G182 VanDerWaalsContact O-N 3.11Å; H180-L183 HydrophobicContact CB-CB 4.45Å; H180-L183 HydrophobicContact CB-CD1 4.21Å; H180-L183 PolarHBondContact ND1-N 2.85Å; H180-L183 PolarHBondContact O-N 3.47Å; H180-L183 VanDerWaalsContact O-N 3.17Å; H180-S184 PolarHBondContact O-N 2.97Å; H180-S184 VanDerWaalsContact O-N 3.1Å; H180-S184 PolarHBondContact O-OG 2.94Å; H180-S184 VanDerWaalsContact O-OG 3.07Å; H180-Y254 WeakPolarHBondContact CA-OH 3.49Å; H180-P396 HydrophobicContact CB-CB 4.12Å; H180-P396 HydrophobicContact CB-CG 3.56Å
181W95.5Very high94.1Very high149 Ų14939.4 Ų39.456%0.56423%0.229SC*.Hα-helixtrans-52-39.6-176.6-78.3108.9000114.8A177 S184 A185 Y254A177-W181 HydrophobicContact CB-CE3 4.49Å; A177-W181 HydrophobicContact CB-CH2 4.33Å; A177-W181 HydrophobicContact CB-CZ3 4.07Å; A177-W181 PolarHBondContact O-N 3.43Å; W181-S184 PolarHBondContact O-N 2.96Å; W181-A185 WeakPolarHBondContact O-CB 3.37Å; W181-A185 PolarHBondContact O-N 3.3Å; W181-Y254 PolarHBondContact N-OH 3.33Å
182G96.4Very high94.3Very high44 Ų4439 Ų3945%0.45423%0.227SC..Hα-helixtrans-62.2-44-179.500000114.1H180 L186H180-G182 VanDerWaalsContact C-N 3.29Å; H180-G182 PolarHBondContact ND1-N 2.7Å; H180-G182 PolarHBondContact O-N 2.97Å; H180-G182 VanDerWaalsContact O-N 3.11Å; G182-L186 WeakPolarHBondContact O-CB 3.45Å; G182-L186 PolarHBondContact O-N 3.22Å
183L96.6Very high94.6Very high7 Ų741 Ų414%0.03724%0.236CC..Hα-helixtrans-72.5-39.9177.7-68.9171.3000111H180 L186 C187 V234 V237 L241 P396H180-L183 HydrophobicContact CB-CB 4.45Å; H180-L183 HydrophobicContact CB-CD1 4.21Å; H180-L183 PolarHBondContact ND1-N 2.85Å; H180-L183 PolarHBondContact O-N 3.47Å; H180-L183 VanDerWaalsContact O-N 3.17Å; L183-L186 PolarHBondContact O-N 2.59Å; L183-C187 WeakPolarHBondContact O-CB 3.39Å; L183-C187 PolarHBondContact O-N 3.31Å; L183-V234 HydrophobicContact CD2-CG1 4.48Å; L183-V237 HydrophobicContact CD2-CG1 3.98Å; L183-L241 HydrophobicContact CD2-CD1 4Å; L183-P396 HydrophobicContact CB-CB 3.75Å; L183-P396 HydrophobicContact CB-CG 4.47Å; L183-P396 HydrophobicContact CD1-CG 4.43Å
184S96.9Very high94.6Very high0 Ų041.4 Ų41.40%024%0.238CC..Hα-helixtrans-61.1-47174.7-53.30000111.5A177 H180 W181 C187 M188 P396A177-S184 WeakPolarHBondContact CA-OG 3.48Å; A177-S184 PolarHBondContact O-OG 2.98Å; H180-S184 PolarHBondContact O-N 2.97Å; H180-S184 VanDerWaalsContact O-N 3.1Å; H180-S184 PolarHBondContact O-OG 2.94Å; H180-S184 VanDerWaalsContact O-OG 3.07Å; W181-S184 PolarHBondContact O-N 2.96Å; S184-C187 WeakPolarHBondContact O-CB 3.44Å; S184-C187 PolarHBondContact O-N 2.85Å; S184-M188 WeakPolarHBondContact O-CG 3.34Å; S184-M188 PolarHBondContact O-N 3.17Å; S184-P396 WeakPolarHBondContact CA-O 3.19Å; S184-P396 VanDerWaalsContact OG-CA 3.32Å; S184-P396 WeakPolarHBondContact OG-CA 3.43Å; S184-P396 WeakPolarHBondContact OG-CB 3.34Å; S184-P396 PolarHBondContact OG-O 2.94Å
185A97.2Very high94.3Very high52 Ų5241.1 Ų41.143%0.4323%0.233SC..Hα-helixtrans-64.2-40.6177.300000111.9W181 C187 M188 L189W181-A185 WeakPolarHBondContact O-CB 3.37Å; W181-A185 PolarHBondContact O-N 3.3Å; A185-C187 VanDerWaalsContact C-N 3.31Å; A185-C187 PolarHBondContact O-N 3.34Å; A185-M188 PolarHBondContact O-N 3.46Å; A185-L189 VanDerWaalsContact O-CB 3.29Å; A185-L189 WeakPolarHBondContact O-CB 3.45Å; A185-L189 PolarHBondContact O-N 3.48Å
186L97.6Very high94.1Very high60 Ų6041 Ų4131%0.31423%0.229SC..Hα-helixtrans-59.3-43.7172.417964.7000111.1G182 L183 L189 L190 V234 V237G182-L186 WeakPolarHBondContact O-CB 3.45Å; G182-L186 PolarHBondContact O-N 3.22Å; L183-L186 PolarHBondContact O-N 2.59Å; L186-L189 PolarHBondContact O-N 3.43Å; L186-L190 HydrophobicContact CD1-CD1 4.19Å; L186-L190 HydrophobicContact CD1-CG 4.2Å; L186-L190 HydrophobicContact CG-CD1 4.15Å; L186-L190 WeakPolarHBondContact O-CB 3.29Å; L186-L190 VanDerWaalsContact O-CG 3.3Å; L186-L190 WeakPolarHBondContact O-CG 3.48Å; L186-L190 PolarHBondContact O-N 2.94Å; L186-V234 HydrophobicContact CD2-CG2 4.25Å; L186-V234 HydrophobicContact CG-CG2 4.09Å; L186-V237 HydrophobicContact CD2-CG1 4.41Å; L186-V237 HydrophobicContact CD2-CG2 4.38Å
187C96.6Very high94Very high0 Ų048.5 Ų48.50%026%0.258CS..Hα-helixtrans-60.6-50176.4-169.60000111.6L183 S184 A185 L189 L190 I191 V234L183-C187 WeakPolarHBondContact O-CB 3.39Å; L183-C187 PolarHBondContact O-N 3.31Å; S184-C187 WeakPolarHBondContact O-CB 3.44Å; S184-C187 PolarHBondContact O-N 2.85Å; A185-C187 VanDerWaalsContact C-N 3.31Å; A185-C187 PolarHBondContact O-N 3.34Å; C187-L189 PolarHBondContact O-N 2.84Å; C187-L190 PolarHBondContact O-N 3.04Å; C187-I191 VanDerWaalsContact O-CG1 3.27Å; C187-I191 WeakPolarHBondContact O-CG1 3.48Å; C187-I191 PolarHBondContact O-N 3.37Å; C187-V234 HydrophobicContact CB-CG1 4.41Å; C187-V234 HydrophobicContact CB-CG2 3.91Å
188M95.8Very high93.8Very high45 Ų4551 Ų5122%0.22227%0.271CS..Hα-helixtrans-58.8-45.7176.9-64.8175.8-158.900111.7A177 S184 A185 L190 I191 V192 C403 T404A177-M188 HydrophobicContact CB-CE 4.23Å; S184-M188 WeakPolarHBondContact O-CG 3.34Å; S184-M188 PolarHBondContact O-N 3.17Å; A185-M188 PolarHBondContact O-N 3.46Å; M188-L190 PolarHBondContact O-N 3.41Å; M188-I191 PolarHBondContact O-N 2.83Å; M188-V192 WeakPolarHBondContact O-CG2 3.42Å; M188-V192 PolarHBondContact O-N 3.43Å; M188-C403 HydrophobicContact CE-CB 3.59Å; M188-C403 WeakPolarHBondContact CE-SG 3.16Å; M188-C403 HydrophobicContact SD-CB 4.12Å; M188-T404 HydrophobicContact CB-CG2 4.38Å; M188-T404 HydrophobicContact CG-CG2 4.25Å
189L96.8Very high93.2Very high105 Ų10553.6 Ų53.655%0.5527%0.274SS..Hα-helixtrans-60.1-47.8178.5-173.1161.6000110.8A185 L186 C187 V192 L193A185-L189 VanDerWaalsContact O-CB 3.29Å; A185-L189 WeakPolarHBondContact O-CB 3.45Å; A185-L189 PolarHBondContact O-N 3.48Å; L186-L189 PolarHBondContact O-N 3.43Å; C187-L189 PolarHBondContact O-N 2.84Å; L189-V192 PolarHBondContact O-N 3.36Å; L189-L193 HydrophobicContact CD2-CB 4.43Å; L189-L193 HydrophobicContact CD2-CD2 4.47Å; L189-L193 WeakPolarHBondContact O-CB 3.42Å; L189-L193 PolarHBondContact O-N 3.08Å
190L95.7Very high92.7Very high24 Ų2458.3 Ų58.313%0.12630%0.301CS..Hα-helixtrans-65.1-39.8178.7-71.1178.5000112.1L186 C187 M188 L193 F194 A230 L233 V234L186-L190 HydrophobicContact CD1-CD1 4.19Å; L186-L190 HydrophobicContact CD1-CG 4.2Å; L186-L190 HydrophobicContact CG-CD1 4.15Å; L186-L190 WeakPolarHBondContact O-CB 3.29Å; L186-L190 VanDerWaalsContact O-CG 3.3Å; L186-L190 WeakPolarHBondContact O-CG 3.48Å; L186-L190 PolarHBondContact O-N 2.94Å; C187-L190 PolarHBondContact O-N 3.04Å; M188-L190 PolarHBondContact O-N 3.41Å; L190-L193 HydrophobicContact CD2-CD2 4.23Å; L190-L193 PolarHBondContact O-N 3.36Å; L190-F194 HydrophobicContact CB-CD2 4.47Å; L190-F194 HydrophobicContact CB-CE2 4.1Å; L190-F194 HydrophobicContact CB-CZ 4.44Å; L190-F194 HydrophobicContact CD2-CE1 4.32Å; L190-F194 HydrophobicContact CD2-CE2 4.35Å; L190-F194 HydrophobicContact CD2-CZ 3.86Å; L190-F194 WeakPolarHBondContact O-CB 3.28Å; L190-F194 VanDerWaalsContact O-CD2 3.27Å; L190-F194 WeakPolarHBondContact O-CD2 3.49Å; L190-F194 WeakPolarHBondContact O-CG 3.32Å; L190-F194 PolarHBondContact O-N 3.48Å; L190-A230 HydrophobicContact CB-CB 3.73Å; L190-L233 HydrophobicContact CD1-CB 4.09Å; L190-L233 HydrophobicContact CD1-CD1 4.49Å; L190-V234 HydrophobicContact CD1-CG2 3.76Å
191I92.1Very high92.2Very high10 Ų1059.1 Ų59.15%0.05131%0.31CS..Hα-helixtrans-59-49.6174.2-70169.5000110C187 M188 F194 A195 I227 A230 T404C187-I191 VanDerWaalsContact O-CG1 3.27Å; C187-I191 WeakPolarHBondContact O-CG1 3.48Å; C187-I191 PolarHBondContact O-N 3.37Å; M188-I191 PolarHBondContact O-N 2.83Å; I191-F194 PolarHBondContact O-N 3.48Å; I191-A195 WeakPolarHBondContact O-CB 3.5Å; I191-A195 PolarHBondContact O-N 3.46Å; I191-I227 HydrophobicContact CG2-CG1 4.32Å; I191-A230 HydrophobicContact CB-CB 4.45Å; I191-A230 HydrophobicContact CG1-CB 3.56Å; I191-T404 HydrophobicContact CB-CG2 4.28Å; I191-T404 HydrophobicContact CD1-CG2 4.17Å; I191-T404 HydrophobicContact CG2-CG2 3.98Å
192V92.1Very high91.6Very high62 Ų6254.2 Ų54.238%0.37630%0.298SS..Hα-helixtrans-63.9-45.5179.3170.60000111.2M188 L189 F194 Q196 Y197M188-V192 WeakPolarHBondContact O-CG2 3.42Å; M188-V192 PolarHBondContact O-N 3.43Å; L189-V192 PolarHBondContact O-N 3.36Å; V192-F194 PolarHBondContact O-N 2.81Å; V192-Q196 HydrophobicContact CG1-CG 4.49Å; V192-Q196 VanDerWaalsContact O-CB 3.31Å; V192-Q196 WeakPolarHBondContact O-CB 3.44Å; V192-Q196 PolarHBondContact O-N 3.14Å; V192-Y197 HydrophobicContact CG1-CD2 4.13Å; V192-Y197 HydrophobicContact CG1-CE2 3.77Å
193L93.8Very high90.9Very high57 Ų5755 Ų5530%0.29829%0.291SS..Iπ-helixtrans-57.5-47.8178-179.566.6000111.1L189 L190 Y197 L198L189-L193 HydrophobicContact CD2-CB 4.43Å; L189-L193 HydrophobicContact CD2-CD2 4.47Å; L189-L193 WeakPolarHBondContact O-CB 3.42Å; L189-L193 PolarHBondContact O-N 3.08Å; L190-L193 HydrophobicContact CD2-CD2 4.23Å; L190-L193 PolarHBondContact O-N 3.36Å; L193-Y197 PolarHBondContact O-N 2.74Å; L193-L198 HydrophobicContact CD1-CD1 4.21Å; L193-L198 HydrophobicContact CD1-CG 4.15Å; L193-L198 HydrophobicContact CD2-CD1 4.25Å; L193-L198 HydrophobicContact CG-CD1 3.89Å; L193-L198 HydrophobicContact CG-CG 4.2Å; L193-L198 PolarHBondContact O-N 2.97Å
194F91.5Very high90.2Very high11 Ų1158.5 Ų58.55%0.04831%0.314CS..Iπ-helixtrans-75.2-43.2-178.3-61.5-20.3000112.8L190 I191 V192 L198 F222 P226 L229 A230 L233L190-F194 HydrophobicContact CB-CD2 4.47Å; L190-F194 HydrophobicContact CB-CE2 4.1Å; L190-F194 HydrophobicContact CB-CZ 4.44Å; L190-F194 HydrophobicContact CD2-CE1 4.32Å; L190-F194 HydrophobicContact CD2-CE2 4.35Å; L190-F194 HydrophobicContact CD2-CZ 3.86Å; L190-F194 WeakPolarHBondContact O-CB 3.28Å; L190-F194 VanDerWaalsContact O-CD2 3.27Å; L190-F194 WeakPolarHBondContact O-CD2 3.49Å; L190-F194 WeakPolarHBondContact O-CG 3.32Å; L190-F194 PolarHBondContact O-N 3.48Å; I191-F194 PolarHBondContact O-N 3.48Å; V192-F194 PolarHBondContact O-N 2.81Å; F194-L198 HydrophobicContact CD1-CD1 4.05Å; F194-L198 HydrophobicContact CE1-CD1 4.24Å; F194-F222 HydrophobicContact CB-CD1 3.85Å; F194-F222 AromaticContact CD1-CD1 3.48Å; F194-F222 HydrophobicContact CD1-CD1 3.48Å; F194-F222 VanDerWaalsContact CD1-CD1 3.48Å; F194-F222 AromaticContact CD1-CE1 3.34Å; F194-F222 HydrophobicContact CD1-CE1 3.34Å; F194-F222 HydrophobicContact CD1-CZ 4.36Å; F194-F222 HydrophobicContact CD2-CD1 4.45Å; F194-F222 HydrophobicContact CE1-CD1 4.14Å; F194-F222 AromaticContact CE1-CE1 3.51Å; F194-F222 HydrophobicContact CE1-CE1 3.51Å; F194-F222 HydrophobicContact CE1-CZ 4.36Å; F194-F222 AromaticContact CG-CD1 3.67Å; F194-F222 HydrophobicContact CG-CD1 3.67Å; F194-F222 AromaticContact CG-CE1 3.92Å; F194-F222 HydrophobicContact CG-CE1 3.92Å; F194-F222 HydrophobicContact CZ-CE1 4.19Å; F194-P226 HydrophobicContact CB-CB 3.78Å; F194-L229 HydrophobicContact CD1-CD2 4.47Å; F194-L229 HydrophobicContact CD2-CB 4.03Å; F194-L229 HydrophobicContact CD2-CD2 3.75Å; F194-L229 HydrophobicContact CD2-CG 4.14Å; F194-L229 HydrophobicContact CE1-CD2 4.36Å; F194-L229 HydrophobicContact CE2-CB 4.1Å; F194-L229 HydrophobicContact CE2-CD2 3.61Å; F194-L229 HydrophobicContact CE2-CG 3.81Å; F194-L229 HydrophobicContact CG-CD2 4.19Å; F194-L229 HydrophobicContact CZ-CD2 3.93Å; F194-L229 HydrophobicContact CZ-CG 4.44Å; F194-A230 HydrophobicContact CD2-CB 3.97Å; F194-A230 HydrophobicContact CE2-CB 4.14Å; F194-L233 HydrophobicContact CE2-CD1 3.69Å; F194-L233 HydrophobicContact CZ-CD1 3.48Å; F194-L233 VanDerWaalsContact CZ-CD1 3.48Å
195A85.6Confident89.4Confident21 Ų2160.7 Ų60.717%0.17433%0.327CS..Iπ-helixtrans-75-34.7-175.400000113.2I191 R199 P226I191-A195 WeakPolarHBondContact O-CB 3.5Å; I191-A195 PolarHBondContact O-N 3.46Å; A195-R199 WeakPolarHBondContact O-CD 3.44Å; A195-P226 HydrophobicContact CB-CB 3.87Å; A195-P226 HydrophobicContact CB-CG 4.16Å
196Q88.1Confident88.5Confident119 Ų11962.3 Ų62.356%0.55633%0.334SS*.Iπ-helixtrans-108.2-52.4-172.2-53-55.9-27.100112.7V192V192-Q196 HydrophobicContact CG1-CG 4.49Å; V192-Q196 VanDerWaalsContact O-CB 3.31Å; V192-Q196 WeakPolarHBondContact O-CB 3.44Å; V192-Q196 PolarHBondContact O-N 3.14Å
197Y89.4Confident87.4Confident176 Ų17662.5 Ų62.569%0.6934%0.337SS*.Iπ-helixtrans-85.8-46.2-170.1-67.9-84.5000113.6V192 L193 R199V192-Y197 HydrophobicContact CG1-CD2 4.13Å; V192-Y197 HydrophobicContact CG1-CE2 3.77Å; L193-Y197 PolarHBondContact O-N 2.74Å; Y197-R199 VanDerWaalsContact C-N 3.33Å
198L89.7Confident86.4Confident51 Ų5170.4 Ų70.427%0.26737%0.368SS..SBendtrans-91.56.6-177-65.4-179.1000113.6L193 F194 T200 T201 F222L193-L198 HydrophobicContact CD1-CD1 4.21Å; L193-L198 HydrophobicContact CD1-CG 4.15Å; L193-L198 HydrophobicContact CD2-CD1 4.25Å; L193-L198 HydrophobicContact CG-CD1 3.89Å; L193-L198 HydrophobicContact CG-CG 4.2Å; L193-L198 PolarHBondContact O-N 2.97Å; F194-L198 HydrophobicContact CD1-CD1 4.05Å; F194-L198 HydrophobicContact CE1-CD1 4.24Å; L198-T200 VanDerWaalsContact C-N 3.31Å; L198-T200 PolarHBondContact O-N 3.38Å; L198-T201 VanDerWaalsContact O-CB 3.28Å; L198-T201 WeakPolarHBondContact O-CB 3.32Å; L198-T201 PolarHBondContact O-N 2.89Å; L198-T201 PolarHBondContact O-OG1 2.79Å; L198-F222 HydrophobicContact CB-CB 4.4Å; L198-F222 HydrophobicContact CB-CD1 4.39Å; L198-F222 HydrophobicContact CB-CD2 3.8Å; L198-F222 HydrophobicContact CB-CE2 4.08Å; L198-F222 HydrophobicContact CB-CG 3.96Å; L198-F222 HydrophobicContact CD1-CE1 4.26Å; L198-F222 HydrophobicContact CD1-CE2 4.18Å; L198-F222 HydrophobicContact CD1-CZ 3.96Å; L198-F222 WeakPolarHBondContact O-CB 3.3Å; L198-F222 WeakPolarHBondContact O-CD2 3.43Å
199R81.8Confident85.3Confident78 Ų7870.6 Ų70.629%0.29437%0.374SS..THydrogen-bonded Turntrans-58.3-37.4-174.1176.9174.3157.3-165.8-13114A195 Y197 K223 I361A195-R199 WeakPolarHBondContact O-CD 3.44Å; Y197-R199 VanDerWaalsContact C-N 3.33Å; R199-K223 HydrophobicContact CG-CB 4.22Å; R199-K223 HydrophobicContact CG-CG 4.27Å; R199-I361 VanDerWaalsContact CZ-CG2 3.42Å; R199-I361 VanDerWaalsContact NH2-CG1 3.32Å
200T82.6Confident84.1Confident112 Ų11277 Ų7769%0.68739%0.391SS*.THydrogen-bonded Turntrans-87.7-11.7-18051.90000112.9L198 S202L198-T200 VanDerWaalsContact C-N 3.31Å; L198-T200 PolarHBondContact O-N 3.38Å; T200-S202 PolarHBondContact O-N 3Å
201T84.9Confident83Confident59 Ų5987.4 Ų87.436%0.36243%0.428SS..PPolyproline II helixtrans-67.9118.6-178.9-53.20000110.6L198L198-T201 VanDerWaalsContact O-CB 3.28Å; L198-T201 WeakPolarHBondContact O-CB 3.32Å; L198-T201 PolarHBondContact O-N 2.89Å; L198-T201 PolarHBondContact O-OG1 2.79Å
202S82Confident81.9Confident46 Ų4694.9 Ų94.932%0.32246%0.46SS..PPolyproline II helixtrans-92.4122.5175.466.90000110.7T200T200-S202 PolarHBondContact O-N 3Å
203I82.6Confident81.4Confident61 Ų6193.4 Ų93.431%0.31346%0.458SS..EExtended strand (participates in β ladder)trans-91.6134.1174.2-61.1176.1000108.8V205 V219 F222I203-V205 PolarHBondContact O-N 2.9Å; I203-V219 PolarHBondContact N-O 3.31Å; I203-V219 PolarHBondContact O-N 3.01Å; I203-F222 HydrophobicContact CD1-CD2 4.29Å; I203-F222 HydrophobicContact CD1-CE2 3.48Å; I203-F222 VanDerWaalsContact CD1-CE2 3.48Å; I203-F222 HydrophobicContact CD1-CZ 3.81Å; I203-F222 HydrophobicContact CG1-CE2 4.06Å
204P81.1Confident80.5Confident80 Ų8096.9 Ų96.952%0.51948%0.476SS..EExtended strand (participates in β ladder)trans-69.4111.1169.327.2-30.9000109.9S216P204-S216 VanDerWaalsContact CB-OG 3.24Å; P204-S216 WeakPolarHBondContact CB-OG 3.42Å
205V79.6Confident79.8Confident45 Ų4598.5 Ų98.527%0.27349%0.487SS..EExtended strand (participates in β ladder)trans-103.8127.7175.8-171.50000108.7I203 V207 T217 V219 I221I203-V205 PolarHBondContact O-N 2.9Å; V205-V207 PolarHBondContact O-N 3.21Å; V205-T217 PolarHBondContact N-O 3.37Å; V205-T217 PolarHBondContact O-N 3.17Å; V205-V219 HydrophobicContact CB-CG2 4.34Å; V205-V219 HydrophobicContact CG2-CB 4.01Å; V205-V219 HydrophobicContact CG2-CG2 4.09Å; V205-I221 HydrophobicContact CG2-CD1 3.83Å
206P78.6Confident79.3Confident87 Ų87101.4 Ų101.457%0.56551%0.506SS*.EExtended strand (participates in β ladder)trans-69.1117.8175.227.7-32000109.7L214P206-L214 HydrophobicContact CB-CD1 4.19Å; P206-L214 HydrophobicContact CB-CD2 4.28Å; P206-L214 HydrophobicContact CB-CG 4.16Å
207V74.8Confident78.8Confident63 Ų6398.9 Ų98.938%0.38250%0.498SS..EExtended strand (participates in β ladder)trans-111.6122.2175.9-178.80000108.7V205 T215V205-V207 PolarHBondContact O-N 3.21Å; V207-T215 PolarHBondContact N-O 2.87Å; V207-T215 PolarHBondContact O-N 3.48Å; V207-T215 VanDerWaalsContact O-O 3.05Å; V207-T215 PolarHBondContact O-OG1 3.11Å
208Y75.6Confident78.2Confident167 Ų167100 Ų10066%0.65550%0.502SS*.EExtended strand (participates in β ladder)trans-84.4121.6174.9-178.1-99.4000110.4R210 L214Y208-R210 HydrophobicContact CE1-CG 4.42Å; Y208-L214 HydrophobicContact CD2-CD1 4.5Å
209S72.6Confident77.7Confident49 Ų4999.9 Ų99.934%0.34350%0.503SS..EExtended strand (participates in β ladder)trans-119.7128172.3-176.50000110.1R211 K212 G213S209-R211 PolarHBondContact O-N 3.29Å; S209-K212 PolarHBondContact O-N 3.46Å; S209-G213 PolarHBondContact N-O 2.99Å; S209-G213 PolarHBondContact O-N 3.28Å
210R71Confident77.7Confident239 Ų23999.8 Ų99.890%0.90251%0.506SS*.THydrogen-bonded Turntrans-52.3-23.3178-86.5-173.9170-174.5-2.5114.2Y208Y208-R210 HydrophobicContact CE1-CG 4.42Å
211R72.8Confident77.6Confident242 Ų24296.7 Ų96.791%0.91349%0.485SS*.THydrogen-bonded Turntrans-96.2-23.4178.5-69.8-171.9-179.2-170.40.8114.8S209S209-R211 PolarHBondContact O-N 3.29Å
212K70.8Confident77.6Confident167 Ų16795 Ų9573%0.72647%0.472SS*.THydrogen-bonded Turntrans-123.70.1-171.4-66.7-172.3176.9-176.30114.3S209 T215S209-K212 PolarHBondContact O-N 3.46Å; K212-T215 HydrophobicContact CB-CG2 3.78Å
213G80.7Confident77.4Confident31 Ų3195.3 Ų95.332%0.3247%0.468SS..EExtended strand (participates in β ladder)trans73.4-150.8-175.500000112.6S209 T215S209-G213 PolarHBondContact N-O 2.99Å; S209-G213 PolarHBondContact O-N 3.28Å; G213-T215 PolarHBondContact O-N 3.47Å
214L75.6Confident76.9Confident130 Ų13093.6 Ų93.668%0.68146%0.458SS*.EExtended strand (participates in β ladder)trans-81.9102.1176.3-16280.9000109.4P206 Y208P206-L214 HydrophobicContact CB-CD1 4.19Å; P206-L214 HydrophobicContact CB-CD2 4.28Å; P206-L214 HydrophobicContact CB-CG 4.16Å; Y208-L214 HydrophobicContact CD2-CD1 4.5Å
215T76.3Confident77Confident45 Ų4592 Ų9228%0.27644%0.443SS..EExtended strand (participates in β ladder)trans-110.8130179.9510000110.7V207 K212 G213 T217V207-T215 PolarHBondContact N-O 2.87Å; V207-T215 PolarHBondContact O-N 3.48Å; V207-T215 VanDerWaalsContact O-O 3.05Å; V207-T215 PolarHBondContact O-OG1 3.11Å; K212-T215 HydrophobicContact CB-CG2 3.78Å; G213-T215 PolarHBondContact O-N 3.47Å; T215-T217 PolarHBondContact O-N 2.97Å
216S74.9Confident77.2Confident83 Ų8391 Ų9158%0.5844%0.438SS*.EExtended strand (participates in β ladder)trans-77.8119.2176.8-172.40000110.6P204P204-S216 VanDerWaalsContact CB-OG 3.24Å; P204-S216 WeakPolarHBondContact CB-OG 3.42Å
217T77.2Confident77.6Confident65 Ų6588.8 Ų88.840%0.39942%0.421SS..EExtended strand (participates in β ladder)trans-111.5135176.5-55.10000109.4V205 T215 V219V205-T217 PolarHBondContact N-O 3.37Å; V205-T217 PolarHBondContact O-N 3.17Å; T215-T217 PolarHBondContact O-N 2.97Å; T217-V219 HydrophobicContact CG2-CG2 4.48Å; T217-V219 PolarHBondContact O-N 3.3Å
218R78.1Confident78.2Confident201 Ų20187.3 Ų87.376%0.75841%0.411SS*.EExtended strand (participates in β ladder)trans-79.4116.8177.9-69.4-173.4-177.7-1791110.1
219V77.6Confident78.9Confident48 Ų4881.9 Ų81.929%0.29139%0.393SS..EExtended strand (participates in β ladder)trans-120.8138-179.9-174.10000110.1I203 V205 T217 I221 M224I203-V219 PolarHBondContact N-O 3.31Å; I203-V219 PolarHBondContact O-N 3.01Å; V205-V219 HydrophobicContact CB-CG2 4.34Å; V205-V219 HydrophobicContact CG2-CB 4.01Å; V205-V219 HydrophobicContact CG2-CG2 4.09Å; T217-V219 HydrophobicContact CG2-CG2 4.48Å; T217-V219 PolarHBondContact O-N 3.3Å; V219-I221 HydrophobicContact CB-CG1 4.36Å; V219-I221 HydrophobicContact CG1-CG1 4.12Å; V219-I221 PolarHBondContact O-N 3.44Å; V219-M224 HydrophobicContact CG1-SD 4.46Å
220Q81.7Confident79.8Confident76 Ų7679.6 Ų79.636%0.35538%0.377SS..  trans-89.468.5178.1-67.1179.4-25.900110.8F222 K223 M224Q220-F222 VanDerWaalsContact C-N 3.31Å; Q220-F222 PolarHBondContact O-N 2.99Å; Q220-K223 HydrophobicContact CB-CB 3.97Å; Q220-K223 WeakPolarHBondContact O-CB 3.45Å; Q220-K223 PolarHBondContact O-N 3.49Å; Q220-K223 VanDerWaalsContact O-N 3.13Å; Q220-M224 PolarHBondContact O-N 2.78Å
221I81.4Confident80.9Confident47 Ų4768.5 Ų68.524%0.24134%0.335CS..Hα-helixtrans-58.1-42.3-174.8-60.9176.3000111.6V205 V219 K223 M224 F225V205-I221 HydrophobicContact CG2-CD1 3.83Å; V219-I221 HydrophobicContact CB-CG1 4.36Å; V219-I221 HydrophobicContact CG1-CG1 4.12Å; V219-I221 PolarHBondContact O-N 3.44Å; I221-K223 VanDerWaalsContact C-N 3.26Å; I221-K223 PolarHBondContact O-N 2.79Å; I221-M224 PolarHBondContact O-N 3.5Å; I221-F225 HydrophobicContact CG2-CD2 4.26Å; I221-F225 PolarHBondContact O-N 3.43Å
222F83.9Confident81.8Confident22 Ų2262 Ų6210%0.09632%0.317CS..Hα-helixtrans-64.4-28.7179.9-60.2-66.6000113.6F194 L198 I203 Q220 M224 P226 L229F194-F222 HydrophobicContact CB-CD1 3.85Å; F194-F222 AromaticContact CD1-CD1 3.48Å; F194-F222 HydrophobicContact CD1-CD1 3.48Å; F194-F222 VanDerWaalsContact CD1-CD1 3.48Å; F194-F222 AromaticContact CD1-CE1 3.34Å; F194-F222 HydrophobicContact CD1-CE1 3.34Å; F194-F222 HydrophobicContact CD1-CZ 4.36Å; F194-F222 HydrophobicContact CD2-CD1 4.45Å; F194-F222 HydrophobicContact CE1-CD1 4.14Å; F194-F222 AromaticContact CE1-CE1 3.51Å; F194-F222 HydrophobicContact CE1-CE1 3.51Å; F194-F222 HydrophobicContact CE1-CZ 4.36Å; F194-F222 AromaticContact CG-CD1 3.67Å; F194-F222 HydrophobicContact CG-CD1 3.67Å; F194-F222 AromaticContact CG-CE1 3.92Å; F194-F222 HydrophobicContact CG-CE1 3.92Å; F194-F222 HydrophobicContact CZ-CE1 4.19Å; L198-F222 HydrophobicContact CB-CB 4.4Å; L198-F222 HydrophobicContact CB-CD1 4.39Å; L198-F222 HydrophobicContact CB-CD2 3.8Å; L198-F222 HydrophobicContact CB-CE2 4.08Å; L198-F222 HydrophobicContact CB-CG 3.96Å; L198-F222 HydrophobicContact CD1-CE1 4.26Å; L198-F222 HydrophobicContact CD1-CE2 4.18Å; L198-F222 HydrophobicContact CD1-CZ 3.96Å; L198-F222 WeakPolarHBondContact O-CB 3.3Å; L198-F222 WeakPolarHBondContact O-CD2 3.43Å; I203-F222 HydrophobicContact CD1-CD2 4.29Å; I203-F222 HydrophobicContact CD1-CE2 3.48Å; I203-F222 VanDerWaalsContact CD1-CE2 3.48Å; I203-F222 HydrophobicContact CD1-CZ 3.81Å; I203-F222 HydrophobicContact CG1-CE2 4.06Å; Q220-F222 VanDerWaalsContact C-N 3.31Å; Q220-F222 PolarHBondContact O-N 2.99Å; F222-M224 VanDerWaalsContact C-N 3.29Å; F222-P226 VanDerWaalsContact O-CB 3.31Å; F222-P226 WeakPolarHBondContact O-CB 3.28Å; F222-P226 VanDerWaalsContact O-CD 3.24Å; F222-P226 WeakPolarHBondContact O-CD 3.38Å; F222-P226 WeakPolarHBondContact O-CG 3.22Å; F222-L229 HydrophobicContact CD1-CD2 3.55Å; F222-L229 HydrophobicContact CE1-CD2 3.3Å; F222-L229 HydrophobicContact CZ-CD2 4.39Å
223K77.9Confident83Confident54 Ų5457.5 Ų57.524%0.23530%0.3CS..Hα-helixtrans-70.6-30172.7-173.7-179.6176.3-1780111.8R199 Q220 I221 I361R199-K223 HydrophobicContact CG-CB 4.22Å; R199-K223 HydrophobicContact CG-CG 4.27Å; Q220-K223 HydrophobicContact CB-CB 3.97Å; Q220-K223 WeakPolarHBondContact O-CB 3.45Å; Q220-K223 PolarHBondContact O-N 3.49Å; Q220-K223 VanDerWaalsContact O-N 3.13Å; I221-K223 VanDerWaalsContact C-N 3.26Å; I221-K223 PolarHBondContact O-N 2.79Å; K223-I361 HydrophobicContact CD-CG2 4.46Å; K223-I361 WeakPolarHBondContact CE-O 3.07Å; K223-I361 HydrophobicContact CG-CG2 4.19Å; K223-I361 PolarHBondContact NZ-O 3.07Å
224M71.9Confident83.7Confident24 Ų2456 Ų5612%0.11829%0.285CS..Hα-helixtrans-89.4-42.7-173.9-61.8-177.176.200112.5L16 Q20 V219 Q220 I221 F222L16-M224 HydrophobicContact CD2-CE 3.88Å; L16-M224 HydrophobicContact CG-CE 3.97Å; Q20-M224 HydrophobicContact CB-CE 4.36Å; Q20-M224 HydrophobicContact CG-CB 4.24Å; Q20-M224 WeakPolarHBondContact CG-O 3.46Å; V219-M224 HydrophobicContact CG1-SD 4.46Å; Q220-M224 PolarHBondContact O-N 2.78Å; I221-M224 PolarHBondContact O-N 3.5Å; F222-M224 VanDerWaalsContact C-N 3.29Å
225F83Confident84.7Confident46 Ų4653 Ų5320%0.20226%0.264CS..  trans-135.145.4-169-45-62.5000114.1Q20 L23 I221 I227 L229Q20-F225 HydrophobicContact CB-CE1 4.06Å; Q20-F225 HydrophobicContact CG-CE1 4.45Å; L23-F225 HydrophobicContact CB-CD1 4.38Å; L23-F225 HydrophobicContact CD1-CD1 3.37Å; L23-F225 HydrophobicContact CD1-CE1 3.51Å; L23-F225 HydrophobicContact CD1-CG 4.37Å; I221-F225 HydrophobicContact CG2-CD2 4.26Å; I221-F225 PolarHBondContact O-N 3.43Å; F225-I227 PolarHBondContact O-N 3.06Å; F225-L229 VanDerWaalsContact O-CB 3.22Å; F225-L229 WeakPolarHBondContact O-CB 3.34Å; F225-L229 PolarHBondContact O-N 3.14Å
226P84.3Confident85.6Confident26 Ų2654.8 Ų54.817%0.16927%0.272CS..Hα-helixtrans-62.9-45.5-171.323.9-30.5000112.9F194 A195 F222 A230F194-P226 HydrophobicContact CB-CB 3.78Å; A195-P226 HydrophobicContact CB-CB 3.87Å; A195-P226 HydrophobicContact CB-CG 4.16Å; F222-P226 VanDerWaalsContact O-CB 3.31Å; F222-P226 WeakPolarHBondContact O-CB 3.28Å; F222-P226 VanDerWaalsContact O-CD 3.24Å; F222-P226 WeakPolarHBondContact O-CD 3.38Å; F222-P226 WeakPolarHBondContact O-CG 3.22Å; P226-A230 PolarHBondContact O-N 2.85Å; P226-A230 VanDerWaalsContact O-N 3.17Å
227I86.8Confident86.6Confident39 Ų3953.4 Ų53.420%0.226%0.26CS..Hα-helixtrans-67.8-47.1-176.4-61.5170.7000110.7I191 F225 L229 A230 I231I191-I227 HydrophobicContact CG2-CG1 4.32Å; F225-I227 PolarHBondContact O-N 3.06Å; I227-L229 PolarHBondContact O-N 3.38Å; I227-A230 WeakPolarHBondContact O-CB 3.5Å; I227-A230 PolarHBondContact O-N 2.88Å; I227-I231 HydrophobicContact CG2-CD1 3.86Å; I227-I231 HydrophobicContact CG2-CG1 4.49Å; I227-I231 WeakPolarHBondContact O-CG1 3.32Å; I227-I231 PolarHBondContact O-N 3.42Å
228I87.8Confident87.5Confident32 Ų3250.3 Ų50.316%0.16424%0.241CC..Hα-helixtrans-68.8-37.7-177.6-65.1-172.9000111.6L23 F26 A230 I231 M232L23-I228 HydrophobicContact CB-CD1 3.44Å; L23-I228 VanDerWaalsContact CB-CD1 3.44Å; L23-I228 HydrophobicContact CB-CG1 4.5Å; L23-I228 HydrophobicContact CD1-CD1 3.95Å; L23-I228 HydrophobicContact CD2-CD1 3.08Å; L23-I228 HydrophobicContact CG-CD1 3.56Å; F26-I228 HydrophobicContact CD1-CD1 4.33Å; F26-I228 HydrophobicContact CD1-CG1 4.38Å; F26-I228 HydrophobicContact CG-CD1 4.48Å; I228-A230 VanDerWaalsContact C-N 3.28Å; I228-A230 PolarHBondContact O-N 2.87Å; I228-I231 PolarHBondContact O-N 3.46Å; I228-M232 HydrophobicContact CG2-CG 4.15Å; I228-M232 WeakPolarHBondContact O-CB 3.5Å; I228-M232 VanDerWaalsContact O-CG 3.26Å; I228-M232 WeakPolarHBondContact O-CG 3.4Å; I228-M232 PolarHBondContact O-N 3.1Å
229L90.2Very high88.2Confident54 Ų5445.3 Ų45.328%0.28322%0.223SC..Hα-helixtrans-60.4-41.6174.2-168.578.2000111.1F194 F222 F225 I227 M232 L233F194-L229 HydrophobicContact CD1-CD2 4.47Å; F194-L229 HydrophobicContact CD2-CB 4.03Å; F194-L229 HydrophobicContact CD2-CD2 3.75Å; F194-L229 HydrophobicContact CD2-CG 4.14Å; F194-L229 HydrophobicContact CE1-CD2 4.36Å; F194-L229 HydrophobicContact CE2-CB 4.1Å; F194-L229 HydrophobicContact CE2-CD2 3.61Å; F194-L229 HydrophobicContact CE2-CG 3.81Å; F194-L229 HydrophobicContact CG-CD2 4.19Å; F194-L229 HydrophobicContact CZ-CD2 3.93Å; F194-L229 HydrophobicContact CZ-CG 4.44Å; F222-L229 HydrophobicContact CD1-CD2 3.55Å; F222-L229 HydrophobicContact CE1-CD2 3.3Å; F222-L229 HydrophobicContact CZ-CD2 4.39Å; F225-L229 VanDerWaalsContact O-CB 3.22Å; F225-L229 WeakPolarHBondContact O-CB 3.34Å; F225-L229 PolarHBondContact O-N 3.14Å; I227-L229 PolarHBondContact O-N 3.38Å; L229-M232 PolarHBondContact O-N 2.95Å; L229-L233 HydrophobicContact CG-CD1 4.44Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 2.91Å
230A93.1Very high89.1Confident0 Ų047.3 Ų47.30%023%0.231CC..Hα-helixtrans-63.2-47.4174.900000111.8L190 I191 F194 P226 I227 I228 M232 L233 V234L190-A230 HydrophobicContact CB-CB 3.73Å; I191-A230 HydrophobicContact CB-CB 4.45Å; I191-A230 HydrophobicContact CG1-CB 3.56Å; F194-A230 HydrophobicContact CD2-CB 3.97Å; F194-A230 HydrophobicContact CE2-CB 4.14Å; P226-A230 PolarHBondContact O-N 2.85Å; P226-A230 VanDerWaalsContact O-N 3.17Å; I227-A230 WeakPolarHBondContact O-CB 3.5Å; I227-A230 PolarHBondContact O-N 2.88Å; I228-A230 VanDerWaalsContact C-N 3.28Å; I228-A230 PolarHBondContact O-N 2.87Å; A230-M232 VanDerWaalsContact C-N 3.35Å; A230-M232 PolarHBondContact O-N 3.3Å; A230-L233 PolarHBondContact O-N 3.32Å; A230-V234 WeakPolarHBondContact O-CG2 3.47Å; A230-V234 PolarHBondContact O-N 3.04Å
231I92.4Very high89.7Confident7 Ų745.6 Ų45.64%0.03622%0.224CC..Hα-helixtrans-56.1-48.5176.2-70.7168.6000111F26 I227 I228 L233 V234 W235 L393 I397 M401F26-I231 HydrophobicContact CE1-CD1 4.15Å; I227-I231 HydrophobicContact CG2-CD1 3.86Å; I227-I231 HydrophobicContact CG2-CG1 4.49Å; I227-I231 WeakPolarHBondContact O-CG1 3.32Å; I227-I231 PolarHBondContact O-N 3.42Å; I228-I231 PolarHBondContact O-N 3.46Å; I231-L233 PolarHBondContact O-N 3.05Å; I231-V234 PolarHBondContact O-N 2.72Å; I231-W235 WeakPolarHBondContact O-CB 3.11Å; I231-W235 PolarHBondContact O-N 3Å; I231-L393 HydrophobicContact CG2-CD2 3.77Å; I231-I397 HydrophobicContact CB-CG2 4.24Å; I231-I397 HydrophobicContact CG1-CG2 3.91Å; I231-I397 HydrophobicContact CG2-CG2 3.99Å; I231-M401 HydrophobicContact CD1-SD 3.74Å
232M92.8Very high90.3Very high106 Ų10643.7 Ų43.752%0.52221%0.214SC..Hα-helixtrans-63.6-40.2-178.8-70.7-61.1-62.500112.4I228 L229 A230 L236I228-M232 HydrophobicContact CG2-CG 4.15Å; I228-M232 WeakPolarHBondContact O-CB 3.5Å; I228-M232 VanDerWaalsContact O-CG 3.26Å; I228-M232 WeakPolarHBondContact O-CG 3.4Å; I228-M232 PolarHBondContact O-N 3.1Å; L229-M232 PolarHBondContact O-N 2.95Å; A230-M232 VanDerWaalsContact C-N 3.35Å; A230-M232 PolarHBondContact O-N 3.3Å; M232-L236 WeakPolarHBondContact O-CB 3.4Å; M232-L236 PolarHBondContact O-N 3.19Å
233L95.3Very high90.7Very high71 Ų7148 Ų4837%0.37224%0.238SC..Hα-helixtrans-69.1-44.3177.7-73.3175000112L190 F194 L229 A230 I231 W235 L236 V237L190-L233 HydrophobicContact CD1-CB 4.09Å; L190-L233 HydrophobicContact CD1-CD1 4.49Å; F194-L233 HydrophobicContact CE2-CD1 3.69Å; F194-L233 HydrophobicContact CZ-CD1 3.48Å; F194-L233 VanDerWaalsContact CZ-CD1 3.48Å; L229-L233 HydrophobicContact CG-CD1 4.44Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 2.91Å; A230-L233 PolarHBondContact O-N 3.32Å; I231-L233 PolarHBondContact O-N 3.05Å; L233-W235 VanDerWaalsContact C-N 3.33Å; L233-L236 WeakPolarHBondContact O-CB 3.41Å; L233-L236 PolarHBondContact O-N 3.09Å; L233-V237 WeakPolarHBondContact O-CG2 3.02Å; L233-V237 PolarHBondContact O-N 3.45Å
234V96.4Very high91.5Very high0 Ų049.1 Ų49.10%025%0.249CC..Hα-helixtrans-68.2-36.8176.8-177.70000110.9L183 L186 C187 L190 A230 I231 L236 V237 C238 I397L183-V234 HydrophobicContact CD2-CG1 4.48Å; L186-V234 HydrophobicContact CD2-CG2 4.25Å; L186-V234 HydrophobicContact CG-CG2 4.09Å; C187-V234 HydrophobicContact CB-CG1 4.41Å; C187-V234 HydrophobicContact CB-CG2 3.91Å; L190-V234 HydrophobicContact CD1-CG2 3.76Å; A230-V234 WeakPolarHBondContact O-CG2 3.47Å; A230-V234 PolarHBondContact O-N 3.04Å; I231-V234 PolarHBondContact O-N 2.72Å; V234-L236 VanDerWaalsContact C-N 3.32Å; V234-L236 PolarHBondContact O-N 3.49Å; V234-V237 WeakPolarHBondContact O-CB 3.25Å; V234-V237 PolarHBondContact O-N 2.73Å; V234-C238 PolarHBondContact O-N 2.85Å; V234-C238 PolarHBondContact O-SG 2.93Å; V234-I397 HydrophobicContact CB-CD1 4.2Å; V234-I397 HydrophobicContact CB-CG1 4.33Å; V234-I397 HydrophobicContact CG1-CD1 4.01Å; V234-I397 HydrophobicContact CG1-CG1 3.79Å
235W95.3Very high92.4Very high66 Ų6652.8 Ų52.825%0.2527%0.269CS..Hα-helixtrans-60.6-42.8173.2-176.693.2000111.2I231 L233 V237 C238 Y239 T260 I397I231-W235 WeakPolarHBondContact O-CB 3.11Å; I231-W235 PolarHBondContact O-N 3Å; L233-W235 VanDerWaalsContact C-N 3.33Å; W235-V237 VanDerWaalsContact C-N 3.32Å; W235-V237 PolarHBondContact O-N 3.46Å; W235-C238 WeakPolarHBondContact O-CB 3.49Å; W235-C238 PolarHBondContact O-N 2.88Å; W235-Y239 HydrophobicContact CH2-CD2 4.08Å; W235-Y239 HydrophobicContact CH2-CG 4.16Å; W235-Y239 HydrophobicContact CZ2-CD2 4.48Å; W235-Y239 HydrophobicContact CZ3-CG 4.25Å; W235-Y239 WeakPolarHBondContact O-CB 3.49Å; W235-Y239 PolarHBondContact O-N 3.47Å; W235-T260 HydrophobicContact CZ2-CG2 4.4Å; W235-I397 HydrophobicContact CB-CD1 3.8Å
236L95.5Very high92.8Very high84 Ų8456.6 Ų56.644%0.4429%0.291SS..Hα-helixtrans-61.4-41.3174.4-179.366.2000111.7M232 L233 V234 Y239 I240M232-L236 WeakPolarHBondContact O-CB 3.4Å; M232-L236 PolarHBondContact O-N 3.19Å; L233-L236 WeakPolarHBondContact O-CB 3.41Å; L233-L236 PolarHBondContact O-N 3.09Å; V234-L236 VanDerWaalsContact C-N 3.32Å; V234-L236 PolarHBondContact O-N 3.49Å; L236-Y239 WeakPolarHBondContact O-CB 3.36Å; L236-Y239 PolarHBondContact O-N 3.45Å; L236-I240 HydrophobicContact CD1-CD1 4.44Å; L236-I240 HydrophobicContact CG-CD1 4.15Å; L236-I240 VanDerWaalsContact O-CG1 3.3Å; L236-I240 WeakPolarHBondContact O-CG1 3.38Å; L236-I240 PolarHBondContact O-N 2.89Å
237V96.4Very high93.1Very high53 Ų5355.7 Ų55.732%0.32129%0.285SS..Hα-helixtrans-61.7-47.4173.5172.50000110.5L183 L186 L233 V234 W235 Y239 I240 L241L183-V237 HydrophobicContact CD2-CG1 3.98Å; L186-V237 HydrophobicContact CD2-CG1 4.41Å; L186-V237 HydrophobicContact CD2-CG2 4.38Å; L233-V237 WeakPolarHBondContact O-CG2 3.02Å; L233-V237 PolarHBondContact O-N 3.45Å; V234-V237 WeakPolarHBondContact O-CB 3.25Å; V234-V237 PolarHBondContact O-N 2.73Å; W235-V237 VanDerWaalsContact C-N 3.32Å; W235-V237 PolarHBondContact O-N 3.46Å; V237-Y239 VanDerWaalsContact C-N 3.28Å; V237-Y239 PolarHBondContact O-N 2.78Å; V237-I240 PolarHBondContact O-N 3.48Å; V237-L241 HydrophobicContact CG1-CD1 3.97Å; V237-L241 HydrophobicContact CG1-CG 4.28Å; V237-L241 WeakPolarHBondContact O-CB 3.2Å; V237-L241 VanDerWaalsContact O-CG 3.27Å; V237-L241 WeakPolarHBondContact O-CG 3.36Å; V237-L241 PolarHBondContact O-N 3.18Å
238C94.8Very high93.3Very high0 Ų055.3 Ų55.30%029%0.285CS..Hα-helixtrans-58.4-42.4176.4-63.20000111.2V234 W235 L241 T242 G258 T260 P394V234-C238 PolarHBondContact O-N 2.85Å; V234-C238 PolarHBondContact O-SG 2.93Å; W235-C238 WeakPolarHBondContact O-CB 3.49Å; W235-C238 PolarHBondContact O-N 2.88Å; C238-L241 PolarHBondContact O-N 3.41Å; C238-T242 WeakPolarHBondContact O-CB 3.31Å; C238-T242 PolarHBondContact O-N 3.36Å; C238-T242 PolarHBondContact O-OG1 3.16Å; C238-G258 WeakPolarHBondContact CB-O 3.3Å; C238-T260 HydrophobicContact CB-CG2 3.85Å; C238-P394 HydrophobicContact CB-CG 4.37Å
239Y94.3Very high93.4Very high97 Ų9758.3 Ų58.338%0.3830%0.301SS..Hα-helixtrans-61.8-47.4177.7-179.1-108.1000111.6W235 L236 V237 L241 T242 L243W235-Y239 HydrophobicContact CH2-CD2 4.08Å; W235-Y239 HydrophobicContact CH2-CG 4.16Å; W235-Y239 HydrophobicContact CZ2-CD2 4.48Å; W235-Y239 HydrophobicContact CZ3-CG 4.25Å; W235-Y239 WeakPolarHBondContact O-CB 3.49Å; W235-Y239 PolarHBondContact O-N 3.47Å; L236-Y239 WeakPolarHBondContact O-CB 3.36Å; L236-Y239 PolarHBondContact O-N 3.45Å; V237-Y239 VanDerWaalsContact C-N 3.28Å; V237-Y239 PolarHBondContact O-N 2.78Å; Y239-L241 PolarHBondContact O-N 3.19Å; Y239-T242 WeakPolarHBondContact O-CB 3.49Å; Y239-T242 PolarHBondContact O-N 3.49Å; Y239-L243 HydrophobicContact CD1-CD1 4.01Å; Y239-L243 HydrophobicContact CE1-CD1 3.43Å; Y239-L243 VanDerWaalsContact CE1-CD1 3.43Å; Y239-L243 HydrophobicContact CE1-CG 4.23Å; Y239-L243 HydrophobicContact CE2-CD1 4.37Å; Y239-L243 HydrophobicContact CE2-CG 4.37Å; Y239-L243 WeakPolarHBondContact O-CG 3.49Å; Y239-L243 PolarHBondContact O-N 2.53Å
240I95.7Very high93.2Very high89 Ų8959.5 Ų59.546%0.45631%0.308SS..Hα-helixtrans-60.5-47.5175.8-67.4165.2000110.5L236 V237 T242 L243 T244L236-I240 HydrophobicContact CD1-CD1 4.44Å; L236-I240 HydrophobicContact CG-CD1 4.15Å; L236-I240 VanDerWaalsContact O-CG1 3.3Å; L236-I240 WeakPolarHBondContact O-CG1 3.38Å; L236-I240 PolarHBondContact O-N 2.89Å; V237-I240 PolarHBondContact O-N 3.48Å; I240-T242 VanDerWaalsContact C-N 3.26Å; I240-T242 PolarHBondContact O-N 3.01Å; I240-L243 PolarHBondContact O-N 3.18Å; I240-L243 VanDerWaalsContact O-N 3.17Å; I240-T244 HydrophobicContact CG2-CG2 4.44Å; I240-T244 WeakPolarHBondContact O-CG2 3.22Å; I240-T244 PolarHBondContact O-N 3.46Å; I240-T244 PolarHBondContact O-OG1 3.26Å; I240-T244 VanDerWaalsContact O-OG1 3.05Å
241L94.9Very high92.8Very high41 Ų4163.7 Ų63.722%0.21534%0.335CS..Hα-helixtrans-63.2-32.9179.1-66.5177.9000112.9L183 V237 C238 Y239 T244 D245 L246 L247L183-L241 HydrophobicContact CD2-CD1 4Å; V237-L241 HydrophobicContact CG1-CD1 3.97Å; V237-L241 HydrophobicContact CG1-CG 4.28Å; V237-L241 WeakPolarHBondContact O-CB 3.2Å; V237-L241 VanDerWaalsContact O-CG 3.27Å; V237-L241 WeakPolarHBondContact O-CG 3.36Å; V237-L241 PolarHBondContact O-N 3.18Å; C238-L241 PolarHBondContact O-N 3.41Å; Y239-L241 PolarHBondContact O-N 3.19Å; L241-T244 WeakPolarHBondContact CA-OG1 3.35Å; L241-T244 PolarHBondContact O-OG1 3.36Å; L241-D245 PolarHBondContact O-N 3.38Å; L241-L246 HydrophobicContact CB-CB 4.46Å; L241-L246 HydrophobicContact CD2-CB 3.98Å; L241-L246 HydrophobicContact CD2-CD1 3.52Å; L241-L246 HydrophobicContact CD2-CG 4.41Å; L241-L246 PolarHBondContact O-N 2.85Å; L241-L247 HydrophobicContact CB-CD1 3.83Å; L241-L247 HydrophobicContact CB-CG 3.91Å
242T93.3Very high92.4Very high7 Ų771.1 Ų71.14%0.04338%0.375CS..Hα-helixtrans-65.7-48.2173.6-54.20000110.1C238 Y239 I240 T244 D245 R259 T260 D261C238-T242 WeakPolarHBondContact O-CB 3.31Å; C238-T242 PolarHBondContact O-N 3.36Å; C238-T242 PolarHBondContact O-OG1 3.16Å; Y239-T242 WeakPolarHBondContact O-CB 3.49Å; Y239-T242 PolarHBondContact O-N 3.49Å; I240-T242 VanDerWaalsContact C-N 3.26Å; I240-T242 PolarHBondContact O-N 3.01Å; T242-T244 VanDerWaalsContact C-N 3.31Å; T242-T244 PolarHBondContact O-N 2.97Å; T242-D245 PolarHBondContact O-N 3.06Å; T242-R259 HydrophobicContact CG2-CB 4.18Å; T242-R259 HydrophobicContact CG2-CG 4.5Å; T242-R259 WeakPolarHBondContact OG1-CA 3.41Å; T242-T260 PolarHBondContact OG1-N 2.79Å; T242-T260 PolarHBondContact OG1-OG1 3.02Å; T242-D261 HydrophobicContact CG2-CB 4.37Å; T242-D261 WeakPolarHBondContact CG2-OD1 3.28Å
243L93Very high92.4Very high113 Ų11373.8 Ų73.859%0.59238%0.379SS*.Hα-helixtrans-66.2-30.4179.5-71.2-179.9000113.7Y239 I240 D245Y239-L243 HydrophobicContact CD1-CD1 4.01Å; Y239-L243 HydrophobicContact CE1-CD1 3.43Å; Y239-L243 VanDerWaalsContact CE1-CD1 3.43Å; Y239-L243 HydrophobicContact CE1-CG 4.23Å; Y239-L243 HydrophobicContact CE2-CD1 4.37Å; Y239-L243 HydrophobicContact CE2-CG 4.37Å; Y239-L243 WeakPolarHBondContact O-CG 3.49Å; Y239-L243 PolarHBondContact O-N 2.53Å; I240-L243 PolarHBondContact O-N 3.18Å; I240-L243 VanDerWaalsContact O-N 3.17Å; L243-D245 VanDerWaalsContact C-N 3.3Å
244T93.9Very high92.2Very high77 Ų7776.8 Ų76.847%0.47239%0.387SS..THydrogen-bonded Turntrans-884.4177.7570000113.4I240 L241 T242 L246I240-T244 HydrophobicContact CG2-CG2 4.44Å; I240-T244 WeakPolarHBondContact O-CG2 3.22Å; I240-T244 PolarHBondContact O-N 3.46Å; I240-T244 PolarHBondContact O-OG1 3.26Å; I240-T244 VanDerWaalsContact O-OG1 3.05Å; L241-T244 WeakPolarHBondContact CA-OG1 3.35Å; L241-T244 PolarHBondContact O-OG1 3.36Å; T242-T244 VanDerWaalsContact C-N 3.31Å; T242-T244 PolarHBondContact O-N 2.97Å; T244-L246 PolarHBondContact O-N 3.3Å; T244-L246 VanDerWaalsContact O-N 3.07Å; T244-L246 WeakPolarHBondContact OG1-CD1 3.38Å
245D90.4Very high91.8Very high101 Ų10177 Ų7754%0.5439%0.388SS..THydrogen-bonded Turntrans5130.6-175.8-71.4-51000114.3L241 T242 L243 L247 R259L241-D245 PolarHBondContact O-N 3.38Å; T242-D245 PolarHBondContact O-N 3.06Å; L243-D245 VanDerWaalsContact C-N 3.3Å; D245-L247 VanDerWaalsContact C-N 3.28Å; D245-R259 IonicContact OD1-NH1 3.85Å; D245-R259 PolarHBondContact OD1-NH1 3.17Å; D245-R259 IonicContact OD1-NH2 2.81Å
246L91.5Very high91.6Very high126 Ų12675.1 Ų75.166%0.6638%0.382SS*.  trans-76.9-20.3174.1-80.2169.2000111.7L241 T244L241-L246 HydrophobicContact CB-CB 4.46Å; L241-L246 HydrophobicContact CD2-CB 3.98Å; L241-L246 HydrophobicContact CD2-CD1 3.52Å; L241-L246 HydrophobicContact CD2-CG 4.41Å; L241-L246 PolarHBondContact O-N 2.85Å; T244-L246 PolarHBondContact O-N 3.3Å; T244-L246 VanDerWaalsContact O-N 3.07Å; T244-L246 WeakPolarHBondContact OG1-CD1 3.38Å
247L92.3Very high91.3Very high6 Ų676.7 Ų76.73%0.03139%0.386CS..SBendtrans-98.2134.4172.9-66170.7000109.8L241 D245 R259L241-L247 HydrophobicContact CB-CD1 3.83Å; L241-L247 HydrophobicContact CB-CG 3.91Å; D245-L247 VanDerWaalsContact C-N 3.28Å; L247-R259 HydrophobicContact CB-CG 3.44Å; L247-R259 VanDerWaalsContact CB-CG 3.44Å; L247-R259 HydrophobicContact CD1-CB 4.45Å; L247-R259 HydrophobicContact CD1-CG 3.87Å; L247-R259 HydrophobicContact CG-CG 4.3Å; L247-R259 PolarHBondContact O-NH1 2.79Å
248P90.9Very high91Very high32 Ų3274.2 Ų74.221%0.20837%0.37CS..  trans-65.9142.2-172.625.9-33000112.7R253 Y254 H256 R259P248-R253 HydrophobicContact CB-CB 3.82Å; P248-R253 HydrophobicContact CG-CB 3.78Å; P248-Y254 VanDerWaalsContact CG-O 3.24Å; P248-Y254 WeakPolarHBondContact CG-O 3.43Å; P248-H256 HydrophobicContact CG-CB 4.42Å; P248-H256 PolarHBondContact O-ND1 3.44Å; P248-R259 VanDerWaalsContact O-CD 3.27Å; P248-R259 WeakPolarHBondContact O-CD 3.12Å
249N88.3Confident90.9Very high95 Ų9574.8 Ų74.851%0.50837%0.373SS..SBendtrans-78.2-23.2176-68.9-36.7000113P251 H256 R259N249-P251 WeakPolarHBondContact O-CD 3.36Å; N249-H256 PolarHBondContact O-CE1 3.2Å; N249-H256 PolarHBondContact O-ND1 3.31Å; N249-R259 PolarHBondContact OD1-NH1 2.89Å; N249-R259 PolarHBondContact OD1-NH2 3.41Å
250D87.7Confident90.6Very high78 Ų7871.4 Ų71.442%0.41736%0.362SS..SBendtrans-70.4123.4179-61.9-34.9000110.9D252 R253 H256D250-D252 PolarHBondContact O-N 3.38Å; D250-R253 HydrophobicContact CB-CB 4.19Å; D250-R253 HydrophobicContact CB-CG 3.88Å; D250-R253 PolarHBondContact O-N 3.44Å; D250-R253 VanDerWaalsContact O-N 3.13Å; D250-R253 WeakPolarHBondContact OD2-CD 3.35Å; D250-R253 IonicContact OD2-CZ 3.27Å; D250-R253 VanDerWaalsContact OD2-CZ 3.27Å; D250-R253 IonicContact OD2-NE 3.13Å; D250-R253 PolarHBondContact OD2-NE 3.36Å; D250-R253 VanDerWaalsContact OD2-NE 3.13Å; D250-R253 IonicContact OD2-NH1 3.74Å; D250-R253 IonicContact OD2-NH2 3.68Å; D250-H256 VanDerWaalsContact O-CB 3.31Å; D250-H256 WeakPolarHBondContact O-CB 3.48Å
251P83.7Confident90.2Very high88 Ų8871.1 Ų71.157%0.57136%0.361SS*.THydrogen-bonded Turntrans-56.6-33-177.8-28.336.2000115.1N249N249-P251 WeakPolarHBondContact O-CD 3.36Å
252D84.6Confident89.6Confident164 Ų16471 Ų7188%0.87737%0.366SS*.THydrogen-bonded Turntrans-85.4-8-175.6-58-46.3000113.5D250D250-D252 PolarHBondContact O-N 3.38Å
253R91.3Very high88.9Confident162 Ų16272.1 Ų72.161%0.61137%0.37SS*.SBendtrans-85141.2-179.9-77.3-170.4-178.6178.46.9111.9P248 D250 G255 H256P248-R253 HydrophobicContact CB-CB 3.82Å; P248-R253 HydrophobicContact CG-CB 3.78Å; D250-R253 HydrophobicContact CB-CB 4.19Å; D250-R253 HydrophobicContact CB-CG 3.88Å; D250-R253 PolarHBondContact O-N 3.44Å; D250-R253 VanDerWaalsContact O-N 3.13Å; D250-R253 WeakPolarHBondContact OD2-CD 3.35Å; D250-R253 IonicContact OD2-CZ 3.27Å; D250-R253 VanDerWaalsContact OD2-CZ 3.27Å; D250-R253 IonicContact OD2-NE 3.13Å; D250-R253 PolarHBondContact OD2-NE 3.36Å; D250-R253 VanDerWaalsContact OD2-NE 3.13Å; D250-R253 IonicContact OD2-NH1 3.74Å; D250-R253 IonicContact OD2-NH2 3.68Å; R253-G255 PolarHBondContact O-N 2.91Å; R253-H256 WeakPolarHBondContact O-CB 3.48Å; R253-H256 PolarHBondContact O-N 3.37Å; R253-H256 VanDerWaalsContact O-N 3.11Å
254Y91.4Very high88Confident134 Ų13469.2 Ų69.253%0.52537%0.367SS..THydrogen-bonded Turntrans-52.2129.5172.7174.4-97.5000111.3G178 H180 W181 P248G178-Y254 VanDerWaalsContact O-CE2 3.32Å; G178-Y254 WeakPolarHBondContact O-CE2 3.42Å; H180-Y254 WeakPolarHBondContact CA-OH 3.49Å; W181-Y254 PolarHBondContact N-OH 3.33Å; P248-Y254 VanDerWaalsContact CG-O 3.24Å; P248-Y254 WeakPolarHBondContact CG-O 3.43Å
255G89.6Confident87.2Confident3 Ų371 Ų713%0.03137%0.374CS..THydrogen-bonded Turntrans93.7-13.2-178.300000115.8A179 R253 K257 G258A179-G255 PolarHBondContact O-N 3.43Å; R253-G255 PolarHBondContact O-N 2.91Å; G255-K257 VanDerWaalsContact C-N 3.32Å; G255-K257 PolarHBondContact O-N 3.34Å; G255-G258 PolarHBondContact O-N 3.36Å
256H90.9Very high86.9Confident28 Ų2866.6 Ų66.613%0.1335%0.35CS..G310 helixtrans-57.7-44.5177.7178.879.2000112.4P248 N249 D250 R253 G258 R259P248-H256 HydrophobicContact CG-CB 4.42Å; P248-H256 PolarHBondContact O-ND1 3.44Å; N249-H256 PolarHBondContact O-CE1 3.2Å; N249-H256 PolarHBondContact O-ND1 3.31Å; D250-H256 VanDerWaalsContact O-CB 3.31Å; D250-H256 WeakPolarHBondContact O-CB 3.48Å; R253-H256 WeakPolarHBondContact O-CB 3.48Å; R253-H256 PolarHBondContact O-N 3.37Å; R253-H256 VanDerWaalsContact O-N 3.11Å; H256-G258 PolarHBondContact O-N 2.93Å; H256-R259 WeakPolarHBondContact O-CB 3.35Å; H256-R259 WeakPolarHBondContact O-CG 3.49Å; H256-R259 PolarHBondContact O-N 3.48Å
257K88.9Confident86.5Confident117 Ų11764.3 Ų64.351%0.50934%0.337SS..G310 helixtrans-64.6-7.3177.1-61.7-173.9-174.8-177.20114.3A179 G255 D395 P396A179-K257 HydrophobicContact CB-CB 4.1Å; A179-K257 HydrophobicContact CB-CD 4.41Å; G255-K257 VanDerWaalsContact C-N 3.32Å; G255-K257 PolarHBondContact O-N 3.34Å; K257-D395 HydrophobicContact CB-CB 4.13Å; K257-D395 PolarHBondContact O-N 2.93Å; K257-P396 WeakPolarHBondContact O-CD 3.35Å
258G89.9Confident86.2Confident0 Ų067 Ų670%036%0.36CS..G310 helixtrans-83-12.4170.500000113.8C238 G255 H256C238-G258 WeakPolarHBondContact CB-O 3.3Å; G255-G258 PolarHBondContact O-N 3.36Å; H256-G258 PolarHBondContact O-N 2.93Å
259R91.8Very high85.8Confident13 Ų1368.3 Ų68.35%0.04937%0.37CS..  trans-72.2146.7179.9-63.718061.598.9-3111.4T242 D245 L247 P248 N249 H256 D261 A262T242-R259 HydrophobicContact CG2-CB 4.18Å; T242-R259 HydrophobicContact CG2-CG 4.5Å; T242-R259 WeakPolarHBondContact OG1-CA 3.41Å; D245-R259 IonicContact OD1-NH1 3.85Å; D245-R259 PolarHBondContact OD1-NH1 3.17Å; D245-R259 IonicContact OD1-NH2 2.81Å; L247-R259 HydrophobicContact CB-CG 3.44Å; L247-R259 VanDerWaalsContact CB-CG 3.44Å; L247-R259 HydrophobicContact CD1-CB 4.45Å; L247-R259 HydrophobicContact CD1-CG 3.87Å; L247-R259 HydrophobicContact CG-CG 4.3Å; L247-R259 PolarHBondContact O-NH1 2.79Å; P248-R259 VanDerWaalsContact O-CD 3.27Å; P248-R259 WeakPolarHBondContact O-CD 3.12Å; N249-R259 PolarHBondContact OD1-NH1 2.89Å; N249-R259 PolarHBondContact OD1-NH2 3.41Å; H256-R259 WeakPolarHBondContact O-CB 3.35Å; H256-R259 WeakPolarHBondContact O-CG 3.49Å; H256-R259 PolarHBondContact O-N 3.48Å; R259-D261 WeakPolarHBondContact CB-OD1 3.33Å; R259-D261 IonicContact CZ-OD1 2.84Å; R259-D261 IonicContact CZ-OD2 3.63Å; R259-D261 IonicContact NE-OD1 3.3Å; R259-D261 PolarHBondContact NE-OD1 3.36Å; R259-D261 IonicContact NE-OD2 3.45Å; R259-D261 IonicContact NH2-OD1 3.76Å; R259-D261 PolarHBondContact NH2-OD1 2.84Å; R259-D261 IonicContact NH2-OD2 3.55Å; R259-D261 PolarHBondContact NH2-OD2 3.23Å; R259-A262 HydrophobicContact CB-CB 4.05Å
260T89.6Confident85.8Confident26 Ų2663.9 Ų63.916%0.1635%0.347CS..SBendtrans-79.4-19.3178.752.60000113.4W235 C238 T242 P394W235-T260 HydrophobicContact CZ2-CG2 4.4Å; C238-T260 HydrophobicContact CB-CG2 3.85Å; T242-T260 PolarHBondContact OG1-N 2.79Å; T242-T260 PolarHBondContact OG1-OG1 3.02Å; T260-P394 HydrophobicContact CG2-CG 4.24Å
261D86.6Confident85.9Confident82 Ų8263 Ų6344%0.43935%0.345SS..SBendtrans-96.9-8.8177.162.4-8.9000113.6T242 R259 R263 G264T242-D261 HydrophobicContact CG2-CB 4.37Å; T242-D261 WeakPolarHBondContact CG2-OD1 3.28Å; R259-D261 WeakPolarHBondContact CB-OD1 3.33Å; R259-D261 IonicContact CZ-OD1 2.84Å; R259-D261 IonicContact CZ-OD2 3.63Å; R259-D261 IonicContact NE-OD1 3.3Å; R259-D261 PolarHBondContact NE-OD1 3.36Å; R259-D261 IonicContact NE-OD2 3.45Å; R259-D261 IonicContact NH2-OD1 3.76Å; R259-D261 PolarHBondContact NH2-OD1 2.84Å; R259-D261 IonicContact NH2-OD2 3.55Å; R259-D261 PolarHBondContact NH2-OD2 3.23Å; D261-R263 PolarHBondContact O-N 3.32Å; D261-G264 PolarHBondContact O-N 3.17Å
262A82.4Confident86.3Confident39 Ų3967 Ų6732%0.32235%0.349SS..THydrogen-bonded Turntrans-56.2-21.6-179.700000113.9R259R259-A262 HydrophobicContact CB-CB 4.05Å
263R78.9Confident86.7Confident30 Ų3066.8 Ų66.811%0.11334%0.341CS..THydrogen-bonded Turntrans-98.55.6-176.5-70.9-174.1174.3-135.31.5113.6Q46 D261 I266 A391 L393 D395Q46-R263 VanDerWaalsContact CD-NH1 3.35Å; Q46-R263 HydrophobicContact CG-CB 4.07Å; Q46-R263 HydrophobicContact CG-CG 4.13Å; D261-R263 PolarHBondContact O-N 3.32Å; R263-I266 HydrophobicContact CB-CD1 3.76Å; R263-I266 VanDerWaalsContact O-CD1 3.25Å; R263-I266 WeakPolarHBondContact O-CD1 3.03Å; R263-I266 WeakPolarHBondContact O-CG1 3.29Å; R263-A391 WeakPolarHBondContact CD-O 3.33Å; R263-A391 PolarHBondContact NH1-O 3.38Å; R263-L393 PolarHBondContact NE-O 2.72Å; R263-L393 PolarHBondContact NH2-O 3.4Å; R263-D395 IonicContact CZ-OD1 3.82Å; R263-D395 IonicContact NE-OD1 2.77Å; R263-D395 IonicContact NH2-OD1 3.62Å; R263-D395 PolarHBondContact NH2-OD1 3.25Å
264G74.4Confident86.8Confident52 Ų5262.2 Ų62.254%0.53632%0.324SS..  trans71-172.7176.900000114.3D261 I266D261-G264 PolarHBondContact O-N 3.17Å; G264-I266 PolarHBondContact O-N 2.95Å
265D76.6Confident86.9Confident115 Ų11560.8 Ų60.862%0.61532%0.323SS*.SBendtrans-85.559.4-176.3-158.8-3.8000112.9M267 A268 S269D265-M267 PolarHBondContact O-N 3.36Å; D265-A268 HydrophobicContact CB-CB 4.35Å; D265-A268 PolarHBondContact O-N 3.43Å; D265-A268 VanDerWaalsContact OD1-CB 3.25Å; D265-A268 WeakPolarHBondContact OD1-CB 3.47Å; D265-A268 PolarHBondContact OD1-N 3.41Å; D265-A268 WeakPolarHBondContact OD2-CB 3.37Å; D265-S269 PolarHBondContact O-N 3.05Å; D265-S269 PolarHBondContact O-OG 3.06Å; D265-S269 VanDerWaalsContact O-OG 3.07Å
266I82.8Confident87.1Confident9 Ų961 Ų615%0.04632%0.323CS..Hα-helixtrans-61.6-33.6175-50.8156.4000109.7Q46 R263 G264 S269 A270 A388Q46-I266 HydrophobicContact CB-CD1 3.27Å; Q46-I266 HydrophobicContact CB-CG1 3.77Å; Q46-I266 HydrophobicContact CG-CD1 3.83Å; R263-I266 HydrophobicContact CB-CD1 3.76Å; R263-I266 VanDerWaalsContact O-CD1 3.25Å; R263-I266 WeakPolarHBondContact O-CD1 3.03Å; R263-I266 WeakPolarHBondContact O-CG1 3.29Å; G264-I266 PolarHBondContact O-N 2.95Å; I266-S269 WeakPolarHBondContact CA-OG 3.5Å; I266-S269 PolarHBondContact O-N 3.41Å; I266-S269 PolarHBondContact O-OG 3.07Å; I266-A270 VanDerWaalsContact O-CB 3.28Å; I266-A270 WeakPolarHBondContact O-CB 3.35Å; I266-A270 PolarHBondContact O-N 2.87Å; I266-A388 HydrophobicContact CG2-CB 3.85Å
267M84.7Confident87.2Confident77 Ų7766.1 Ų66.138%0.37934%0.343SS..Hα-helixtrans-66.5-38.9-178.1-166.859.865.700111.4D265 K385 A388 L389D265-M267 PolarHBondContact O-N 3.36Å; M267-K385 WeakPolarHBondContact O-CD 3.16Å; M267-K385 WeakPolarHBondContact O-CE 3.4Å; M267-K385 PolarHBondContact O-NZ 3.28Å; M267-K385 HydrophobicContact SD-CB 4.1Å; M267-K385 HydrophobicContact SD-CD 4.08Å; M267-A388 HydrophobicContact CE-CB 4.41Å; M267-A388 HydrophobicContact SD-CB 4.44Å; M267-L389 HydrophobicContact CE-CB 3.97Å; M267-L389 HydrophobicContact CE-CD1 4.16Å
268A85.1Confident87.4Confident62 Ų6264.5 Ų64.551%0.51234%0.344SS..Hα-helixtrans-70.1-44.5173.900000112.4D265 K385D265-A268 HydrophobicContact CB-CB 4.35Å; D265-A268 PolarHBondContact O-N 3.43Å; D265-A268 VanDerWaalsContact OD1-CB 3.25Å; D265-A268 WeakPolarHBondContact OD1-CB 3.47Å; D265-A268 PolarHBondContact OD1-N 3.41Å; D265-A268 WeakPolarHBondContact OD2-CB 3.37Å; A268-K385 PolarHBondContact O-NZ 2.94Å; A268-K385 VanDerWaalsContact O-NZ 3.08Å
269S83.4Confident87.6Confident60 Ų6066.3 Ų66.342%0.4236%0.356SS..Hα-helixtrans-73.7-25.6-173.556.50000114.9D265 I266D265-S269 PolarHBondContact O-N 3.05Å; D265-S269 PolarHBondContact O-OG 3.06Å; D265-S269 VanDerWaalsContact O-OG 3.07Å; I266-S269 WeakPolarHBondContact CA-OG 3.5Å; I266-S269 PolarHBondContact O-N 3.41Å; I266-S269 PolarHBondContact O-OG 3.07Å
270A87.3Confident87.6Confident3 Ų366.3 Ų66.33%0.02536%0.357CS..SBendtrans-68.7136.3-178.700000112.6I266 K385 A388I266-A270 VanDerWaalsContact O-CB 3.28Å; I266-A270 WeakPolarHBondContact O-CB 3.35Å; I266-A270 PolarHBondContact O-N 2.87Å; A270-K385 HydrophobicContact CB-CD 4.32Å; A270-K385 WeakPolarHBondContact O-CE 3Å; A270-K385 PolarHBondContact O-NZ 3.37Å; A270-A388 HydrophobicContact CB-CB 3.65Å
271P90.3Very high87.6Confident59 Ų5965.5 Ų65.538%0.38335%0.351SS..  trans-66.1151.9174.728.4-34.6000111.2R274 G384 K385P271-R274 HydrophobicContact CG-CB 4.22Å; P271-G384 CarbonylContact O-C 3.57Å; P271-G384 WeakPolarHBondContact O-CA 3.23Å; P271-G384 PolarHBondContact O-N 2.86Å; P271-K385 PolarHBondContact O-N 2.97Å
272W91.6Very high87.9Confident172 Ų17262.9 Ų62.965%0.65234%0.343SS*.SBendtrans-65.6-43.4175.3-84.797.3000112.4V383 G384 K385W272-V383 CarbonylContact O-C 3.56Å; W272-V383 WeakPolarHBondContact O-CA 3.48Å; W272-G384 PolarHBondContact O-N 2.75Å; W272-K385 HydrophobicContact CD2-CG 3.84Å; W272-K385 HydrophobicContact CE3-CG 3.81Å; W272-K385 HydrophobicContact CG-CG 4.35Å; W272-K385 HydrophobicContact CH2-CG 4.42Å; W272-K385 HydrophobicContact CZ2-CG 4.44Å; W272-K385 HydrophobicContact CZ3-CG 4.11Å
273F94.4Very high88.4Confident159 Ų15967 Ų6770%0.69736%0.359SS*.BIsolated β-bridgetrans-129131.3-180-61.4-78000110T382 V383F273-T382 CarbonylContact C-O 3.57Å; F273-T382 WeakPolarHBondContact CA-O 3.31Å; F273-V383 HydrophobicContact CE1-CG2 4.29Å
274R92.2Very high89.1Confident67 Ų6767.4 Ų67.425%0.25337%0.365SS..  trans-141.8116.5174.1179.8-174.7176.41200.5108.6Q51 P271 P276 T382Q51-R274 VanDerWaalsContact CG-NH1 3.32Å; Q51-R274 VanDerWaalsContact OE1-CZ 3.29Å; P271-R274 HydrophobicContact CG-CB 4.22Å; R274-P276 WeakPolarHBondContact O-CD 3.33Å; R274-T382 PolarHBondContact N-O 3.33Å; R274-T382 VanDerWaalsContact O-CA 3.28Å; R274-T382 WeakPolarHBondContact O-CA 3.18Å
275M93.9Very high89.9Confident104 Ų10467.3 Ų67.351%0.51235%0.354SS..  trans-97.1118.6173.7-175.863.7-175.500109.5T58 F378 T382T58-M275 HydrophobicContact CG2-CE 4.38Å; T58-M275 HydrophobicContact CG2-SD 4.3Å; M275-F378 HydrophobicContact CE-CE2 3.85Å; M275-F378 HydrophobicContact CE-CZ 3.9Å; M275-F378 HydrophobicContact SD-CE2 4.37Å; M275-F378 HydrophobicContact SD-CZ 4.22Å; M275-T382 HydrophobicContact SD-CG2 3.61Å
276P92.9Very high90.7Very high6 Ų665.6 Ų65.64%0.03935%0.348CS..  trans-59139.4168.6-22.834.1000111.1T55 T58 R274 L343T55-P276 HydrophobicContact CG2-CB 4.17Å; T55-P276 HydrophobicContact CG2-CG 4.42Å; T58-P276 HydrophobicContact CG2-CG 4.1Å; R274-P276 WeakPolarHBondContact O-CD 3.33Å; P276-L343 HydrophobicContact CB-CD2 4.43Å
277Y93.3Very high91Very high136 Ų13666.8 Ų66.853%0.53336%0.356SS..  trans-132.2156.2176.760-88.2000110.7C279 Q280Y277-C279 PolarHBondContact O-N 2.77Å; Y277-Q280 HydrophobicContact CD1-CB 4.04Å; Y277-Q280 HydrophobicContact CD2-CB 3.93Å; Y277-Q280 HydrophobicContact CE1-CB 3.75Å; Y277-Q280 VanDerWaalsContact CE2-CA 3.46Å; Y277-Q280 HydrophobicContact CE2-CB 3.65Å; Y277-Q280 HydrophobicContact CG-CB 4.12Å; Y277-Q280 WeakPolarHBondContact O-CB 3.45Å; Y277-Q280 PolarHBondContact O-N 2.97Å
278P94.6Very high91Very high83 Ų8367.2 Ų67.254%0.53936%0.362SS..THydrogen-bonded Turntrans-57.6137.5-179-2635.4000112.4Q280 L342 L343P278-Q280 VanDerWaalsContact C-N 3.25Å; P278-Q280 PolarHBondContact O-N 3.25Å; P278-L342 CarbonylContact C-O 3.57Å; P278-L342 WeakPolarHBondContact CA-O 3.17Å; P278-L342 HydrophobicContact CB-CB 4.45Å; P278-L343 HydrophobicContact CG-CD2 4.29Å
279C92.3Very high90.8Very high38 Ų3864.3 Ų64.326%0.25734%0.338SS..THydrogen-bonded Turntrans58.130-178.7-55.20000114.2Y277 W281 G282 L342Y277-C279 PolarHBondContact O-N 2.77Å; C279-W281 PolarHBondContact O-N 2.75Å; C279-W281 VanDerWaalsContact O-N 3.09Å; C279-G282 PolarHBondContact O-N 3.01Å; C279-L342 PolarHBondContact N-O 3.46Å
280Q91.6Very high90.9Very high14 Ų1461.5 Ų61.57%0.06532%0.319CS..THydrogen-bonded Turntrans-58.7-22.5-179.359.5170.6-35.700114.8T55 Y277 P278 L343T55-Q280 VanDerWaalsContact CG2-NE2 3.32Å; T55-Q280 PolarHBondContact OG1-NE2 3.41Å; T55-Q280 VanDerWaalsContact OG1-NE2 3.07Å; Y277-Q280 HydrophobicContact CD1-CB 4.04Å; Y277-Q280 HydrophobicContact CD2-CB 3.93Å; Y277-Q280 HydrophobicContact CE1-CB 3.75Å; Y277-Q280 VanDerWaalsContact CE2-CA 3.46Å; Y277-Q280 HydrophobicContact CE2-CB 3.65Å; Y277-Q280 HydrophobicContact CG-CB 4.12Å; Y277-Q280 WeakPolarHBondContact O-CB 3.45Å; Y277-Q280 PolarHBondContact O-N 2.97Å; P278-Q280 VanDerWaalsContact C-N 3.25Å; P278-Q280 PolarHBondContact O-N 3.25Å; Q280-L343 PolarHBondContact NE2-O 2.93Å
281W91.6Very high91.1Very high9 Ų962.6 Ų62.63%0.03433%0.325CS..THydrogen-bonded Turntrans-98.14.3177.8-45.2130.9000113.4Q51 L52 W119 H120 I123 R124 C279 G344Q51-W281 HydrophobicContact CB-CH2 4.04Å; L52-W281 HydrophobicContact CD2-CZ2 4.4Å; W119-W281 AromaticContact CH2-CD2 3.36Å; W119-W281 HydrophobicContact CH2-CD2 3.36Å; W119-W281 AromaticContact CH2-CE2 3.65Å; W119-W281 AromaticContact CH2-CE3 3.19Å; W119-W281 HydrophobicContact CH2-CE3 3.19Å; W119-W281 HydrophobicContact CH2-CG 4.07Å; W119-W281 AromaticContact CH2-CH2 3.55Å; W119-W281 HydrophobicContact CH2-CH2 3.55Å; W119-W281 AromaticContact CH2-CZ2 3.76Å; W119-W281 HydrophobicContact CH2-CZ2 3.76Å; W119-W281 AromaticContact CH2-CZ3 3.29Å; W119-W281 HydrophobicContact CH2-CZ3 3.29Å; W119-W281 HydrophobicContact CZ2-CD2 4.45Å; W119-W281 AromaticContact CZ2-CE3 3.9Å; W119-W281 HydrophobicContact CZ2-CE3 3.9Å; W119-W281 HydrophobicContact CZ2-CH2 4.2Å; W119-W281 AromaticContact CZ2-CZ3 3.76Å; W119-W281 HydrophobicContact CZ2-CZ3 3.76Å; W119-W281 HydrophobicContact CZ3-CB 4.43Å; W119-W281 AromaticContact CZ3-CD2 3.67Å; W119-W281 HydrophobicContact CZ3-CD2 3.67Å; W119-W281 AromaticContact CZ3-CE2 3.95Å; W119-W281 AromaticContact CZ3-CE3 3.95Å; W119-W281 HydrophobicContact CZ3-CE3 3.95Å; W119-W281 AromaticContact CZ3-CG 3.9Å; W119-W281 HydrophobicContact CZ3-CG 3.9Å; W119-W281 HydrophobicContact CZ3-CZ2 4.4Å; W119-W281 HydrophobicContact CZ3-CZ3 4.39Å; H120-W281 PolarHBondContact CD2-O 3.16Å; H120-W281 VanDerWaalsContact CD2-O 3.29Å; H120-W281 AromaticContact CE1-CE3 3.94Å; H120-W281 AromaticContact NE2-CE3 3.95Å; I123-W281 HydrophobicContact CG2-CB 3.65Å; I123-W281 HydrophobicContact CG2-CG 3.98Å; R124-W281 VanDerWaalsContact CD-O 3.31Å; R124-W281 WeakPolarHBondContact CD-O 3.38Å; C279-W281 PolarHBondContact O-N 2.75Å; C279-W281 VanDerWaalsContact O-N 3.09Å; W281-G344 PolarHBondContact NE1-O 2.91Å
282G91.7Very high90.9Very high26 Ų2662.7 Ų62.727%0.26832%0.322SS..  trans110.5177.7-173.100000113.1C279C279-G282 PolarHBondContact O-N 3.01Å
283L93.3Very high90.5Very high125 Ų12554.6 Ų54.665%0.65429%0.292SS*.SBendtrans-71.4130.9-178.3-70.1173.9000111.5R124R124-L283 VanDerWaalsContact CZ-O 3.23Å; R124-L283 PolarHBondContact NE-O 3.35Å; R124-L283 PolarHBondContact NH2-O 3.39Å
284P93.4Very high90.4Very high39 Ų3947 Ų4725%0.25326%0.259SS..  trans-54.7142.5178.1-24.332.6000112.5Q127 I131Q127-P284 HydrophobicContact CB-CB 4.4Å; I131-P284 HydrophobicContact CD1-CB 4.02Å; I131-P284 HydrophobicContact CD1-CG 3.64Å
285V92.1Very high90.3Very high50 Ų5045.6 Ų45.630%0.30326%0.256SS..  trans-111.7135.7175.3179.80000108.1R124 E125 G128R124-V285 HydrophobicContact CB-CG2 4.38Å; R124-V285 PolarHBondContact O-N 3.23Å; E125-V285 WeakPolarHBondContact OE2-CG1 3.42Å; G128-V285 VanDerWaalsContact CA-O 3.3Å; G128-V285 WeakPolarHBondContact CA-O 3.4Å
286V92.4Very high89.8Confident80 Ų8040.9 Ų40.949%0.48523%0.233SC..  trans-116.6122-175.1-179.50000109.2M132 V291M132-V286 HydrophobicContact CG-CB 4.47Å; M132-V286 HydrophobicContact CG-CG1 3.76Å; M132-V286 HydrophobicContact CG-CG2 3.79Å; V286-V291 HydrophobicContact CG1-CG2 3.63Å
287T88.1Confident89.6Confident33 Ų3340.6 Ų40.620%0.20223%0.231CC..  trans-119.7149.3167.964.80000110.5E125 A289 G290 V291E125-T287 VanDerWaalsContact OE1-CB 3.23Å; E125-T287 WeakPolarHBondContact OE1-CB 3.37Å; E125-T287 WeakPolarHBondContact OE1-CG2 3.22Å; E125-T287 PolarHBondContact OE1-OG1 2.79Å; T287-A289 PolarHBondContact O-N 2.99Å; T287-G290 PolarHBondContact O-N 3.5Å; T287-G290 PolarHBondContact OG1-N 3.32Å; T287-V291 VanDerWaalsContact O-CG2 3.29Å; T287-V291 WeakPolarHBondContact O-CG2 3.5Å; T287-V291 PolarHBondContact O-N 3.5Å
288V86.6Confident89.4Confident86 Ų8634.2 Ų34.252%0.52121%0.206SC..Hα-helixtrans-62.6-45.2-177.91790000110.9G290 V291 L292 I462V288-G290 VanDerWaalsContact C-N 3.35Å; V288-G290 PolarHBondContact O-N 3.12Å; V288-V291 PolarHBondContact O-N 3.22Å; V288-L292 HydrophobicContact CG1-CD1 3.95Å; V288-L292 HydrophobicContact CG1-CG 4.49Å; V288-L292 WeakPolarHBondContact O-CG 3.18Å; V288-L292 PolarHBondContact O-N 3.46Å; V288-I462 HydrophobicContact CG1-CD1 4.29Å
289A79.7Confident89Confident1 Ų135.1 Ų35.11%0.00821%0.205CC..Hα-helixtrans-58.6-44.8175.700000112.1T287 L292 G293 Q461T287-A289 PolarHBondContact O-N 2.99Å; A289-L292 PolarHBondContact O-N 3.5Å; A289-G293 PolarHBondContact O-N 2.94Å; A289-Q461 HydrophobicContact CB-CB 3.66Å
290G85.6Confident88.6Confident1 Ų133.6 Ų33.61%0.0120%0.195CC..Hα-helixtrans-61.2-46.3176.600000112.5A129 T287 V288 G293 M294A129-G290 VanDerWaalsContact CB-C 3.48Å; A129-G290 WeakPolarHBondContact CB-O 3.47Å; T287-G290 PolarHBondContact O-N 3.5Å; T287-G290 PolarHBondContact OG1-N 3.32Å; V288-G290 VanDerWaalsContact C-N 3.35Å; V288-G290 PolarHBondContact O-N 3.12Å; G290-G293 PolarHBondContact O-N 3.42Å; G290-M294 WeakPolarHBondContact O-CG 3.49Å; G290-M294 PolarHBondContact O-N 3.26Å
291V91.3Very high88.4Confident26 Ų2633 Ų3316%0.15819%0.193CC..Hα-helixtrans-62.4-46179.2175.10000111.7M132 V286 T287 V288 G293 M294 L295M132-V291 HydrophobicContact CB-CB 4.47Å; M132-V291 HydrophobicContact CB-CG1 4Å; M132-V291 HydrophobicContact CB-CG2 3.59Å; M132-V291 HydrophobicContact CG-CG2 4.16Å; V286-V291 HydrophobicContact CG1-CG2 3.63Å; T287-V291 VanDerWaalsContact O-CG2 3.29Å; T287-V291 WeakPolarHBondContact O-CG2 3.5Å; T287-V291 PolarHBondContact O-N 3.5Å; V288-V291 PolarHBondContact O-N 3.22Å; V291-G293 VanDerWaalsContact C-N 3.34Å; V291-M294 PolarHBondContact O-N 2.92Å; V291-L295 WeakPolarHBondContact O-CB 3.23Å; V291-L295 PolarHBondContact O-N 3.1Å
292L85.5Confident88.2Confident62 Ų6233.3 Ų33.333%0.32520%0.195SC..Hα-helixtrans-68.7-35.3179.7-70.3174.9000112.1V288 A289 L295 S296 I462V288-L292 HydrophobicContact CG1-CD1 3.95Å; V288-L292 HydrophobicContact CG1-CG 4.49Å; V288-L292 WeakPolarHBondContact O-CG 3.18Å; V288-L292 PolarHBondContact O-N 3.46Å; A289-L292 PolarHBondContact O-N 3.5Å; L292-L295 HydrophobicContact CD2-CD2 4.23Å; L292-L295 WeakPolarHBondContact O-CB 3.47Å; L292-L295 PolarHBondContact O-N 3.43Å; L292-S296 PolarHBondContact O-N 3.29Å; L292-I462 HydrophobicContact CD1-CB 4.47Å; L292-I462 HydrophobicContact CD1-CD1 3.47Å; L292-I462 VanDerWaalsContact CD1-CD1 3.47Å; L292-I462 HydrophobicContact CD1-CG1 3.66Å; L292-I462 HydrophobicContact CD1-CG2 3.94Å
293G84.1Confident87.7Confident1 Ų133 Ų331%0.0119%0.188CC..Hα-helixtrans-60.9-49.9170.700000113P87 A289 G290 V291 L295 S296P87-G293 WeakPolarHBondContact CB-O 3.45Å; A289-G293 PolarHBondContact O-N 2.94Å; G290-G293 PolarHBondContact O-N 3.42Å; V291-G293 VanDerWaalsContact C-N 3.34Å; G293-L295 PolarHBondContact O-N 3.43Å; G293-S296 PolarHBondContact O-N 2.7Å; G293-S296 PolarHBondContact O-OG 2.9Å
294M92Very high87.3Confident0 Ų028 Ų280%016%0.161CC..Hα-helixtrans-72.1-18.1177.8-69.5-65.6-178.800113.2F84 P87 A88 I91 I126 A129 I130 S133 G290 V291 A297 T298F84-M294 HydrophobicContact CB-SD 4.4Å; F84-M294 HydrophobicContact CD1-SD 3.69Å; F84-M294 HydrophobicContact CG-SD 4.46Å; P87-M294 HydrophobicContact CB-SD 4.21Å; A88-M294 HydrophobicContact CB-CE 3.68Å; I91-M294 HydrophobicContact CD1-CE 3.92Å; I91-M294 HydrophobicContact CD1-CG 4.12Å; I126-M294 HydrophobicContact CB-CE 4.49Å; I126-M294 HydrophobicContact CG1-CE 4.37Å; I126-M294 HydrophobicContact CG2-CE 3.81Å; A129-M294 HydrophobicContact CB-CB 4.18Å; A129-M294 HydrophobicContact CB-CG 3.56Å; I130-M294 HydrophobicContact CG1-CE 4.23Å; I130-M294 HydrophobicContact CG1-CG 4.22Å; I130-M294 HydrophobicContact CG1-SD 3.96Å; S133-M294 WeakPolarHBondContact OG-CB 3.32Å; S133-M294 PolarHBondContact OG-O 3.23Å; G290-M294 WeakPolarHBondContact O-CG 3.49Å; G290-M294 PolarHBondContact O-N 3.26Å; V291-M294 PolarHBondContact O-N 2.92Å; M294-A297 WeakPolarHBondContact O-CB 3.49Å; M294-A297 PolarHBondContact O-N 2.87Å; M294-T298 WeakPolarHBondContact O-CG2 3.48Å; M294-T298 PolarHBondContact O-N 2.91Å; M294-T298 PolarHBondContact O-OG1 3.38Å
295L89.8Confident87.1Confident38 Ų3826.2 Ų26.220%0.19915%0.149CC..Hα-helixtrans-66-39.2173.1-173.167.2000111V136 V291 L292 G293 A297 T298 M299V136-L295 HydrophobicContact CB-CD1 3.86Å; V136-L295 HydrophobicContact CG1-CD1 3.8Å; V136-L295 HydrophobicContact CG2-CD1 4.26Å; V291-L295 WeakPolarHBondContact O-CB 3.23Å; V291-L295 PolarHBondContact O-N 3.1Å; L292-L295 HydrophobicContact CD2-CD2 4.23Å; L292-L295 WeakPolarHBondContact O-CB 3.47Å; L292-L295 PolarHBondContact O-N 3.43Å; G293-L295 PolarHBondContact O-N 3.43Å; L295-A297 VanDerWaalsContact C-N 3.31Å; L295-A297 PolarHBondContact O-N 3.46Å; L295-T298 VanDerWaalsContact CA-OG1 3.32Å; L295-T298 WeakPolarHBondContact CA-OG1 3.41Å; L295-T298 PolarHBondContact O-N 3.43Å; L295-T298 PolarHBondContact O-OG1 2.96Å; L295-M299 WeakPolarHBondContact O-CG 3.5Å; L295-M299 PolarHBondContact O-N 2.65Å
296S83.5Confident86.8Confident5 Ų524.1 Ų24.14%0.03514%0.136CC..Hα-helixtrans-61.4-41.5175.5750000111.5L292 G293 M299 A300L292-S296 PolarHBondContact O-N 3.29Å; G293-S296 PolarHBondContact O-N 2.7Å; G293-S296 PolarHBondContact O-OG 2.9Å; S296-M299 PolarHBondContact O-N 3.18Å; S296-A300 PolarHBondContact O-N 2.91Å
297A88.4Confident86.1Confident0 Ų020.8 Ų20.80%012%0.119CC..Hα-helixtrans-60.5-46.6173.700000112.2A83 F84 P87 M294 L295 M299 A300 G301A83-A297 HydrophobicContact CB-CB 4.44Å; A83-A297 VanDerWaalsContact O-CB 3.23Å; A83-A297 WeakPolarHBondContact O-CB 3.36Å; F84-A297 HydrophobicContact CB-CB 4.33Å; F84-A297 HydrophobicContact CD1-CB 3.87Å; F84-A297 HydrophobicContact CD2-CB 3.84Å; F84-A297 HydrophobicContact CE1-CB 4.15Å; F84-A297 HydrophobicContact CE2-CB 4.11Å; F84-A297 HydrophobicContact CG-CB 3.75Å; F84-A297 HydrophobicContact CZ-CB 4.27Å; P87-A297 HydrophobicContact CG-CB 4.12Å; M294-A297 WeakPolarHBondContact O-CB 3.49Å; M294-A297 PolarHBondContact O-N 2.87Å; L295-A297 VanDerWaalsContact C-N 3.31Å; L295-A297 PolarHBondContact O-N 3.46Å; A297-M299 PolarHBondContact O-N 2.95Å; A297-A300 PolarHBondContact O-N 3.32Å; A297-G301 PolarHBondContact O-N 2.97Å
298T90.8Very high86Confident1 Ų119.7 Ų19.71%0.00611%0.111CC..Hα-helixtrans-62.4-41.4177.154.50000111.9F84 S133 M294 L295 A300 G301 I302F84-T298 HydrophobicContact CE1-CG2 3.85Å; F84-T298 HydrophobicContact CZ-CG2 3.53Å; S133-T298 WeakPolarHBondContact OG-CG2 3.42Å; M294-T298 WeakPolarHBondContact O-CG2 3.48Å; M294-T298 PolarHBondContact O-N 2.91Å; M294-T298 PolarHBondContact O-OG1 3.38Å; L295-T298 VanDerWaalsContact CA-OG1 3.32Å; L295-T298 WeakPolarHBondContact CA-OG1 3.41Å; L295-T298 PolarHBondContact O-N 3.43Å; L295-T298 PolarHBondContact O-OG1 2.96Å; T298-A300 PolarHBondContact O-N 2.99Å; T298-G301 PolarHBondContact O-N 2.88Å; T298-I302 VanDerWaalsContact O-CG1 3.29Å; T298-I302 WeakPolarHBondContact O-CG1 3.48Å; T298-I302 PolarHBondContact O-N 2.8Å
299M85.4Confident86.1Confident102 Ų10215.6 Ų15.650%0.5029%0.087SC..Hα-helixtrans-63.1-43178.5-72.2-175.574.900111.8L295 S296 A297 I302 V303L295-M299 WeakPolarHBondContact O-CG 3.5Å; L295-M299 PolarHBondContact O-N 2.65Å; S296-M299 PolarHBondContact O-N 3.18Å; A297-M299 PolarHBondContact O-N 2.95Å; M299-I302 WeakPolarHBondContact O-CB 2.85Å; M299-I302 PolarHBondContact O-N 3.06Å; M299-V303 WeakPolarHBondContact O-CG2 3.44Å; M299-V303 PolarHBondContact O-N 3.36Å
300A82.9Confident86.3Confident7 Ų716.6 Ų16.66%0.0589%0.09CC..Hα-helixtrans-68.6-36.6175.700000112.7T161 S296 A297 T298 I302 V303 E304 M471T161-A300 HydrophobicContact CG2-CB 3.8Å; S296-A300 PolarHBondContact O-N 2.91Å; A297-A300 PolarHBondContact O-N 3.32Å; T298-A300 PolarHBondContact O-N 2.99Å; A300-I302 VanDerWaalsContact C-N 3.33Å; A300-I302 PolarHBondContact O-N 3.25Å; A300-V303 PolarHBondContact O-N 3.09Å; A300-E304 WeakPolarHBondContact O-CB 3.41Å; A300-E304 PolarHBondContact O-N 3.21Å; A300-M471 HydrophobicContact CB-CE 2.95Å
301G87.6Confident86.1Confident2 Ų217.7 Ų17.72%0.02110%0.099CC..Hα-helixtrans-57.9-43.6171.800000112.1A297 T298 V303 E304 S305A297-G301 PolarHBondContact O-N 2.97Å; T298-G301 PolarHBondContact O-N 2.88Å; G301-V303 VanDerWaalsContact C-N 3.33Å; G301-V303 PolarHBondContact O-N 3.3Å; G301-E304 PolarHBondContact O-N 3.33Å; G301-S305 VanDerWaalsContact O-CB 3.3Å; G301-S305 WeakPolarHBondContact O-CB 3.26Å; G301-S305 PolarHBondContact O-N 3.34Å; G301-S305 PolarHBondContact O-OG 3.11Å
302I88.3Confident85.9Confident15 Ų1516.4 Ų16.48%0.0779%0.092CC..Hα-helixtrans-57.1-47.5173.7-66.5166.1000110.9E137 I140 T298 M299 A300 S305 I306 I330E137-I302 HydrophobicContact CB-CD1 4.48Å; E137-I302 HydrophobicContact CG-CD1 3.99Å; E137-I302 HydrophobicContact CG-CG1 4.05Å; I140-I302 HydrophobicContact CD1-CD1 4.29Å; I140-I302 HydrophobicContact CG2-CD1 4.12Å; T298-I302 VanDerWaalsContact O-CG1 3.29Å; T298-I302 WeakPolarHBondContact O-CG1 3.48Å; T298-I302 PolarHBondContact O-N 2.8Å; M299-I302 WeakPolarHBondContact O-CB 2.85Å; M299-I302 PolarHBondContact O-N 3.06Å; A300-I302 VanDerWaalsContact C-N 3.33Å; A300-I302 PolarHBondContact O-N 3.25Å; I302-S305 PolarHBondContact O-N 3.1Å; I302-I306 HydrophobicContact CG2-CD1 3.98Å; I302-I306 VanDerWaalsContact O-CG1 3.25Å; I302-I306 WeakPolarHBondContact O-CG1 3.27Å; I302-I306 PolarHBondContact O-N 3.14Å; I302-I330 HydrophobicContact CB-CD1 4.32Å; I302-I330 HydrophobicContact CD1-CG2 4.22Å; I302-I330 HydrophobicContact CG1-CD1 4.42Å; I302-I330 HydrophobicContact CG1-CG2 3.83Å; I302-I330 HydrophobicContact CG2-CD1 3.98Å; I302-I330 HydrophobicContact CG2-CG1 4.24Å; I302-I330 HydrophobicContact CG2-CG2 4.29Å
303V81.8Confident85.9Confident19 Ų1913.6 Ų13.612%0.1158%0.077CC..Hα-helixtrans-64.9-44.1-178.5175.10000111.6I153 I158 M299 A300 G301 G307I153-V303 HydrophobicContact CD1-CG2 4.12Å; I153-V303 HydrophobicContact CG2-CG1 4.1Å; I153-V303 HydrophobicContact CG2-CG2 4.38Å; I158-V303 HydrophobicContact CB-CG1 4.24Å; I158-V303 HydrophobicContact CD1-CG1 4.41Å; I158-V303 HydrophobicContact CG1-CG1 3.64Å; I158-V303 HydrophobicContact CG2-CG1 4.21Å; M299-V303 WeakPolarHBondContact O-CG2 3.44Å; M299-V303 PolarHBondContact O-N 3.36Å; A300-V303 PolarHBondContact O-N 3.09Å; G301-V303 VanDerWaalsContact C-N 3.33Å; G301-V303 PolarHBondContact O-N 3.3Å; V303-G307 PolarHBondContact O-N 3.26Å
304E84.2Confident85.9Confident21 Ų2121.7 Ų21.710%0.09811%0.107CC..Hα-helixtrans-60.1-50.3175-177177.3-157.500111.1V162 A300 G301 I306 G307 D308V162-E304 HydrophobicContact CG2-CB 4.41Å; A300-E304 WeakPolarHBondContact O-CB 3.41Å; A300-E304 PolarHBondContact O-N 3.21Å; G301-E304 PolarHBondContact O-N 3.33Å; E304-I306 PolarHBondContact O-N 3.46Å; E304-G307 PolarHBondContact O-N 2.87Å; E304-G307 VanDerWaalsContact O-N 3.11Å; E304-D308 PolarHBondContact O-N 3.28Å
305S88.7Confident85.4Confident0 Ų023.8 Ų23.80%012%0.118CC..Hα-helixtrans-63.6-35.9-178.1-83.20000113.5G301 I302 G307 D308 Y309 E333 T350 S351G301-S305 VanDerWaalsContact O-CB 3.3Å; G301-S305 WeakPolarHBondContact O-CB 3.26Å; G301-S305 PolarHBondContact O-N 3.34Å; G301-S305 PolarHBondContact O-OG 3.11Å; I302-S305 PolarHBondContact O-N 3.1Å; S305-G307 VanDerWaalsContact C-N 3.35Å; S305-G307 PolarHBondContact O-N 2.87Å; S305-D308 WeakPolarHBondContact O-CB 3.47Å; S305-D308 PolarHBondContact O-N 3.34Å; S305-Y309 WeakPolarHBondContact O-CD1 3.49Å; S305-Y309 WeakPolarHBondContact O-CE1 3.42Å; S305-Y309 PolarHBondContact O-N 3.27Å; S305-E333 VanDerWaalsContact CB-OE1 3.32Å; S305-E333 WeakPolarHBondContact CB-OE1 3.48Å; S305-E333 VanDerWaalsContact CB-OE2 3.27Å; S305-E333 WeakPolarHBondContact CB-OE2 3.48Å; S305-E333 PolarHBondContact OG-OE1 3.47Å; S305-E333 PolarHBondContact OG-OE2 3.32Å; S305-T350 PolarHBondContact OG-OG1 3.12Å; S305-S351 WeakPolarHBondContact OG-CB 3.5Å; S305-S351 PolarHBondContact OG-N 3.16Å; S305-S351 PolarHBondContact OG-OG 3.2Å
306I85.6Confident85.1Confident6 Ų622 Ų223%0.03111%0.109CC..Hα-helixtrans-59-47.1172.7-72.3167.7000110.8P146 L150 I302 E304 D308 Y309 Y310 I326 I330 W497P146-I306 HydrophobicContact CB-CD1 4.34Å; L150-I306 HydrophobicContact CD2-CD1 4.36Å; L150-I306 HydrophobicContact CD2-CG2 3.49Å; L150-I306 VanDerWaalsContact CD2-CG2 3.49Å; I302-I306 HydrophobicContact CG2-CD1 3.98Å; I302-I306 VanDerWaalsContact O-CG1 3.25Å; I302-I306 WeakPolarHBondContact O-CG1 3.27Å; I302-I306 PolarHBondContact O-N 3.14Å; E304-I306 PolarHBondContact O-N 3.46Å; I306-D308 VanDerWaalsContact C-N 3.32Å; I306-D308 PolarHBondContact O-N 3.16Å; I306-Y309 PolarHBondContact O-N 2.99Å; I306-Y310 HydrophobicContact CG2-CD2 4.16Å; I306-Y310 HydrophobicContact CG2-CE2 3.99Å; I306-Y310 VanDerWaalsContact O-CD2 3.28Å; I306-Y310 WeakPolarHBondContact O-CD2 3.41Å; I306-Y310 PolarHBondContact O-N 3.44Å; I306-I326 HydrophobicContact CG1-CG2 4.06Å; I306-I330 HydrophobicContact CG1-CD1 4.43Å; I306-W497 HydrophobicContact CG2-CZ2 4.09Å
307G79.3Confident84.9Confident11 Ų1124.6 Ų24.611%0.11314%0.136CC..Hα-helixtrans-60.9-42.7176.900000112.3V303 E304 S305 Y309 Y310 A311V303-G307 PolarHBondContact O-N 3.26Å; E304-G307 PolarHBondContact O-N 2.87Å; E304-G307 VanDerWaalsContact O-N 3.11Å; S305-G307 VanDerWaalsContact C-N 3.35Å; S305-G307 PolarHBondContact O-N 2.87Å; G307-Y309 PolarHBondContact O-N 2.79Å; G307-Y310 PolarHBondContact O-N 3.49Å; G307-A311 WeakPolarHBondContact O-CB 3.44Å; G307-A311 PolarHBondContact O-N 2.91Å
308D85.9Confident84.6Confident10 Ų1025.2 Ų25.25%0.05314%0.142CC..Hα-helixtrans-62.6-38.5176.4-89.48.6000112.8E304 S305 I306 A311 C312 S351 S353 I356E304-D308 PolarHBondContact O-N 3.28Å; S305-D308 WeakPolarHBondContact O-CB 3.47Å; S305-D308 PolarHBondContact O-N 3.34Å; I306-D308 VanDerWaalsContact C-N 3.32Å; I306-D308 PolarHBondContact O-N 3.16Å; D308-A311 PolarHBondContact O-N 3.48Å; D308-C312 WeakPolarHBondContact O-CB 3.16Å; D308-C312 PolarHBondContact O-N 3.23Å; D308-S351 WeakPolarHBondContact OD2-CB 3.28Å; D308-S353 WeakPolarHBondContact OD1-CB 3.13Å; D308-S353 PolarHBondContact OD1-OG 2.96Å; D308-S353 PolarHBondContact OD2-N 3.23Å; D308-S353 PolarHBondContact OD2-OG 3.19Å; D308-I356 HydrophobicContact CB-CD1 3.46Å; D308-I356 VanDerWaalsContact CB-CD1 3.46Å; D308-I356 WeakPolarHBondContact O-CD1 3.23Å; D308-I356 WeakPolarHBondContact OD1-CD1 3.41Å
309Y88.8Confident84.3Confident0 Ų028.5 Ų28.50%016%0.162CC..Hα-helixtrans-62.8-45.8177.7-62.6-10.5000111.2Q67 V72 L74 L76 S305 I306 G307 A313 I326 G329 I330 E333 S351Q67-Y309 PolarHBondContact NE2-OH 3.17Å; V72-Y309 HydrophobicContact CB-CD1 4.42Å; V72-Y309 HydrophobicContact CB-CD2 4.47Å; V72-Y309 HydrophobicContact CB-CE1 4.26Å; V72-Y309 HydrophobicContact CB-CE2 4.3Å; V72-Y309 HydrophobicContact CG1-CD1 4.04Å; V72-Y309 HydrophobicContact CG1-CE1 3.86Å; V72-Y309 HydrophobicContact CG2-CD1 4.21Å; V72-Y309 HydrophobicContact CG2-CD2 3.93Å; V72-Y309 HydrophobicContact CG2-CE2 4.22Å; V72-Y309 HydrophobicContact CG2-CG 3.93Å; L74-Y309 VanDerWaalsContact CD1-O 3.29Å; L74-Y309 WeakPolarHBondContact CD1-O 3.23Å; L76-Y309 HydrophobicContact CD1-CD1 3.46Å; L76-Y309 VanDerWaalsContact CD1-CD1 3.46Å; L76-Y309 HydrophobicContact CD1-CE1 3.88Å; S305-Y309 WeakPolarHBondContact O-CD1 3.49Å; S305-Y309 WeakPolarHBondContact O-CE1 3.42Å; S305-Y309 PolarHBondContact O-N 3.27Å; I306-Y309 PolarHBondContact O-N 2.99Å; G307-Y309 PolarHBondContact O-N 2.79Å; Y309-A313 WeakPolarHBondContact O-CB 3.08Å; Y309-A313 PolarHBondContact O-N 3.44Å; Y309-I326 HydrophobicContact CD2-CG1 4.49Å; Y309-I326 HydrophobicContact CD2-CG2 4.43Å; Y309-G329 VanDerWaalsContact OH-C 3.25Å; Y309-G329 PolarHBondContact OH-O 3.42Å; Y309-I330 HydrophobicContact CE2-CD1 4.06Å; Y309-I330 HydrophobicContact CE2-CG1 4.4Å; Y309-E333 PolarHBondContact OH-OE2 2.93Å; Y309-S351 VanDerWaalsContact CE1-OG 3.31Å; Y309-S351 WeakPolarHBondContact CE1-OG 3.21Å
310Y83Confident84.1Confident21 Ų2126.1 Ų26.18%0.08215%0.154CC..Hα-helixtrans-66.2-45.7176.8-76.8-64.7000112.4L150 I306 G307 C312 A313 R314 P321 I326 W497 S501L150-Y310 HydrophobicContact CD2-CE2 4.31Å; I306-Y310 HydrophobicContact CG2-CD2 4.16Å; I306-Y310 HydrophobicContact CG2-CE2 3.99Å; I306-Y310 VanDerWaalsContact O-CD2 3.28Å; I306-Y310 WeakPolarHBondContact O-CD2 3.41Å; I306-Y310 PolarHBondContact O-N 3.44Å; G307-Y310 PolarHBondContact O-N 3.49Å; Y310-C312 VanDerWaalsContact C-N 3.32Å; Y310-C312 PolarHBondContact O-N 3.25Å; Y310-A313 PolarHBondContact O-N 2.84Å; Y310-R314 WeakPolarHBondContact O-CB 3.4Å; Y310-R314 PolarHBondContact O-N 3.47Å; Y310-P321 HydrophobicContact CD1-CG 3.89Å; Y310-P321 HydrophobicContact CE1-CG 3.76Å; Y310-P321 HydrophobicContact CG-CG 4.45Å; Y310-I326 HydrophobicContact CE2-CD1 4.09Å; Y310-I326 VanDerWaalsContact OH-CD1 3.29Å; Y310-I326 WeakPolarHBondContact OH-CD1 3.45Å; Y310-W497 HydrophobicContact CD2-CH2 4.06Å; Y310-W497 HydrophobicContact CD2-CZ2 4.01Å; Y310-W497 HydrophobicContact CE2-CZ2 4.17Å; Y310-S501 WeakPolarHBondContact CE1-OG 3.14Å; Y310-S501 WeakPolarHBondContact OH-CB 3.48Å; Y310-S501 PolarHBondContact OH-OG 3.31Å; Y310-S501 VanDerWaalsContact OH-OG 3.08Å
311A81.8Confident84.1Confident24 Ų2425.8 Ų25.820%0.19815%0.151CC..Hα-helixtrans-61-43.1178.600000111.5G307 D308 L315 I356G307-A311 WeakPolarHBondContact O-CB 3.44Å; G307-A311 PolarHBondContact O-N 2.91Å; D308-A311 PolarHBondContact O-N 3.48Å; A311-L315 WeakPolarHBondContact O-CB 3.42Å; A311-L315 VanDerWaalsContact O-CG 3.3Å; A311-L315 WeakPolarHBondContact O-CG 3.25Å; A311-L315 PolarHBondContact O-N 2.85Å; A311-I356 HydrophobicContact CB-CG2 3.95Å
312C87Confident83.9Confident0 Ų027.8 Ų27.80%016%0.164CC..Hα-helixtrans-68.8-42.9178.4-174.80000112.7L74 L76 D308 Y310 R314 L315 S316 I356L74-C312 HydrophobicContact CD1-CB 4.36Å; L76-C312 HydrophobicContact CD1-CB 4.25Å; L76-C312 HydrophobicContact CD2-CB 3.43Å; L76-C312 VanDerWaalsContact CD2-CB 3.43Å; L76-C312 VanDerWaalsContact CD2-SG 3.52Å; L76-C312 HydrophobicContact CG-CB 3.9Å; D308-C312 WeakPolarHBondContact O-CB 3.16Å; D308-C312 PolarHBondContact O-N 3.23Å; Y310-C312 VanDerWaalsContact C-N 3.32Å; Y310-C312 PolarHBondContact O-N 3.25Å; C312-R314 VanDerWaalsContact C-N 3.33Å; C312-R314 PolarHBondContact O-N 2.81Å; C312-L315 PolarHBondContact O-N 2.89Å; C312-S316 WeakPolarHBondContact O-CB 3.39Å; C312-S316 PolarHBondContact O-N 3.05Å; C312-S316 PolarHBondContact O-OG 3.47Å; C312-I356 HydrophobicContact CB-CD1 4.22Å; C312-I356 HydrophobicContact CB-CG1 4.21Å
313A86.3Confident83.7Confident2 Ų229.5 Ų29.52%0.01718%0.175CC..Hα-helixtrans-57.7-48.3175.900000111L74 Y309 Y310 L315 S316 G317 A318L74-A313 HydrophobicContact CD1-CB 4.44Å; L74-A313 HydrophobicContact CD2-CB 4.19Å; Y309-A313 WeakPolarHBondContact O-CB 3.08Å; Y309-A313 PolarHBondContact O-N 3.44Å; Y310-A313 PolarHBondContact O-N 2.84Å; A313-L315 PolarHBondContact O-N 3.44Å; A313-S316 PolarHBondContact O-N 3.24Å; A313-S316 PolarHBondContact O-OG 2.56Å; A313-G317 PolarHBondContact O-N 2.86Å; A313-G317 VanDerWaalsContact O-N 3.15Å; A313-A318 HydrophobicContact CB-CB 4.39Å; A313-A318 PolarHBondContact O-N 3.03Å
314R82.4Confident83.8Confident172 Ų17229.5 Ų29.565%0.64917%0.174SC*.Hα-helixtrans-58.7-47.7176.6-176-179.966.9-178.7-0.3112.5Y310 C312 G317Y310-R314 WeakPolarHBondContact O-CB 3.4Å; Y310-R314 PolarHBondContact O-N 3.47Å; C312-R314 VanDerWaalsContact C-N 3.33Å; C312-R314 PolarHBondContact O-N 2.81Å; R314-G317 PolarHBondContact O-N 2.96Å
315L82.3Confident84Confident44 Ų4428.5 Ų28.523%0.2317%0.169CC..Hα-helixtrans-76.9-25.9-176.4-69.1174.7000113.8M1 A311 C312 A313 G317 I356 L359M1-L315 WeakPolarHBondContact CE-O 3.46Å; A311-L315 WeakPolarHBondContact O-CB 3.42Å; A311-L315 VanDerWaalsContact O-CG 3.3Å; A311-L315 WeakPolarHBondContact O-CG 3.25Å; A311-L315 PolarHBondContact O-N 2.85Å; C312-L315 PolarHBondContact O-N 2.89Å; A313-L315 PolarHBondContact O-N 3.44Å; L315-G317 VanDerWaalsContact C-N 3.33Å; L315-I356 HydrophobicContact CD1-CG2 3.58Å; L315-I356 WeakPolarHBondContact CD1-O 3.48Å; L315-L359 HydrophobicContact CB-CD2 4.06Å; L315-L359 HydrophobicContact CB-CG 4.16Å
316S83.8Confident84.1Confident0 Ų028.5 Ų28.50%017%0.169CC..Hα-helixtrans-82.9-9.9175.360.70000113.4C312 A313 A318C312-S316 WeakPolarHBondContact O-CB 3.39Å; C312-S316 PolarHBondContact O-N 3.05Å; C312-S316 PolarHBondContact O-OG 3.47Å; A313-S316 PolarHBondContact O-N 3.24Å; A313-S316 PolarHBondContact O-OG 2.56Å; S316-A318 VanDerWaalsContact C-N 3.29Å
317G78.2Confident84.3Confident59 Ų5928.2 Ų28.261%0.60817%0.167SC*.THydrogen-bonded Turntrans74.619.3-174.600000113.3A313 R314 L315A313-G317 PolarHBondContact O-N 2.86Å; A313-G317 VanDerWaalsContact O-N 3.15Å; R314-G317 PolarHBondContact O-N 2.96Å; L315-G317 VanDerWaalsContact C-N 3.33Å
318A83.1Confident85Confident14 Ų1427.9 Ų27.912%0.11616%0.163CC..PPolyproline II helixtrans-81.2157.9172.800000110.6I5 L74 A313 S316I5-A318 HydrophobicContact CD1-CB 3.82Å; I5-A318 HydrophobicContact CG2-CB 4.23Å; L74-A318 HydrophobicContact CD2-CB 4.32Å; A313-A318 HydrophobicContact CB-CB 4.39Å; A313-A318 PolarHBondContact O-N 3.03Å; S316-A318 VanDerWaalsContact C-N 3.29Å
319T83.6Confident85.3Confident70 Ų7027.4 Ų27.443%0.42916%0.16SC..PPolyproline II helixtrans-63.2150.9168.757.40000109.8S514 Y517T319-S514 WeakPolarHBondContact OG1-CB 3.32Å; T319-S514 PolarHBondContact OG1-OG 2.92Å; T319-S514 VanDerWaalsContact OG1-OG 3.06Å; T319-Y517 WeakPolarHBondContact O-CE2 3.44Å; T319-Y517 PolarHBondContact O-OH 3.49Å
320P81.3Confident85.6Confident51 Ų5127.4 Ų27.433%0.33116%0.16SC..PPolyproline II helixtrans-46.9137.8172.4-30.937.2000112.1P322 S500P320-P322 WeakPolarHBondContact O-CD 3.49Å; P320-S500 VanDerWaalsContact CB-O 3.22Å; P320-S500 WeakPolarHBondContact CB-O 3.4Å; P320-S500 VanDerWaalsContact CG-O 3.25Å; P320-S500 WeakPolarHBondContact CG-O 3.21Å
321P83.9Confident86.2Confident0 Ų028.5 Ų28.50%017%0.165CC..PPolyproline II helixtrans-66.2121.8-177.927.1-33.2000109.2Y310 A325 I326 Y517Y310-P321 HydrophobicContact CD1-CG 3.89Å; Y310-P321 HydrophobicContact CE1-CG 3.76Å; Y310-P321 HydrophobicContact CG-CG 4.45Å; P321-A325 HydrophobicContact CB-CB 4.47Å; P321-I326 HydrophobicContact CB-CG1 4.08Å; P321-I326 HydrophobicContact CG-CD1 4.35Å; P321-I326 HydrophobicContact CG-CG1 4.21Å; P321-Y517 HydrophobicContact CB-CE1 4.05Å
322P84.1Confident86.9Confident44 Ų4427.6 Ų27.629%0.28616%0.157SC..PPolyproline II helixtrans-66.8158.4175.528.5-35.5000110.7P320 H324 A325 I326 Y517P320-P322 WeakPolarHBondContact O-CD 3.49Å; P322-H324 WeakPolarHBondContact CG-CE1 3.36Å; P322-H324 PolarHBondContact O-N 3.41Å; P322-A325 HydrophobicContact CG-CB 3.94Å; P322-A325 WeakPolarHBondContact O-CA 3.46Å; P322-A325 WeakPolarHBondContact O-CB 3.5Å; P322-A325 PolarHBondContact O-N 3.3Å; P322-I326 PolarHBondContact O-N 2.99Å; P322-I326 VanDerWaalsContact O-N 3.16Å; P322-Y517 HydrophobicContact CG-CD2 4.32Å; P322-Y517 HydrophobicContact CG-CG 4.42Å
323V82.9Confident87.3Confident51 Ų5127.6 Ų27.631%0.30916%0.157SC..Hα-helixtrans-49.3-39.1-178.2175.70000112.8A325 I326 N327 F541V323-A325 VanDerWaalsContact C-N 3.33Å; V323-A325 PolarHBondContact O-N 3.48Å; V323-I326 PolarHBondContact O-N 3.41Å; V323-N327 WeakPolarHBondContact CG1-ND2 3.29Å; V323-N327 WeakPolarHBondContact O-CB 3.33Å; V323-N327 VanDerWaalsContact O-CG 3.25Å; V323-N327 PolarHBondContact O-N 3.42Å; V323-N327 PolarHBondContact O-ND2 2.96Å; V323-F541 HydrophobicContact CG1-CE1 4.39Å
324H84.8Confident87.7Confident20 Ų2027.5 Ų27.59%0.09316%0.157CC..Hα-helixtrans-67-32.8178.971.5-98.3000113.9P322 R328 P536 C538 P539 F541P322-H324 WeakPolarHBondContact CG-CE1 3.36Å; P322-H324 PolarHBondContact O-N 3.41Å; H324-R328 WeakPolarHBondContact O-CB 3.48Å; H324-R328 PolarHBondContact O-N 2.9Å; H324-P536 WeakPolarHBondContact CA-O 3.36Å; H324-P536 WeakPolarHBondContact CB-O 3.27Å; H324-C538 WeakPolarHBondContact CB-O 3.42Å; H324-P539 VanDerWaalsContact CD2-CA 3.46Å; H324-P539 WeakPolarHBondContact CD2-CA 3.45Å; H324-F541 HydrophobicContact CB-CB 4.08Å; H324-F541 HydrophobicContact CB-CD1 4.28Å
325A88.3Confident88.4Confident0 Ų022.1 Ų22.10%014%0.14CC..Hα-helixtrans-73.3-35.7177.100000110.6P321 P322 V323 G329 Y517P321-A325 HydrophobicContact CB-CB 4.47Å; P322-A325 HydrophobicContact CG-CB 3.94Å; P322-A325 WeakPolarHBondContact O-CA 3.46Å; P322-A325 WeakPolarHBondContact O-CB 3.5Å; P322-A325 PolarHBondContact O-N 3.3Å; V323-A325 VanDerWaalsContact C-N 3.33Å; V323-A325 PolarHBondContact O-N 3.48Å; A325-G329 PolarHBondContact O-N 2.75Å; A325-Y517 HydrophobicContact CB-CD1 3.64Å; A325-Y517 HydrophobicContact CB-CE1 4.27Å; A325-Y517 HydrophobicContact CB-CG 4.07Å
326I89.1Confident89.1Confident0 Ų020 Ų200%013%0.129CC..Hα-helixtrans-65-54.3173.9-60.6174.5000110.1L150 I306 Y309 Y310 P321 P322 V323 R328 G329 I330L150-I326 HydrophobicContact CD1-CD1 3.92Å; I306-I326 HydrophobicContact CG1-CG2 4.06Å; Y309-I326 HydrophobicContact CD2-CG1 4.49Å; Y309-I326 HydrophobicContact CD2-CG2 4.43Å; Y310-I326 HydrophobicContact CE2-CD1 4.09Å; Y310-I326 VanDerWaalsContact OH-CD1 3.29Å; Y310-I326 WeakPolarHBondContact OH-CD1 3.45Å; P321-I326 HydrophobicContact CB-CG1 4.08Å; P321-I326 HydrophobicContact CG-CD1 4.35Å; P321-I326 HydrophobicContact CG-CG1 4.21Å; P322-I326 PolarHBondContact O-N 2.99Å; P322-I326 VanDerWaalsContact O-N 3.16Å; V323-I326 PolarHBondContact O-N 3.41Å; I326-R328 VanDerWaalsContact C-N 3.27Å; I326-R328 PolarHBondContact O-N 3Å; I326-G329 WeakPolarHBondContact O-CA 3.32Å; I326-G329 PolarHBondContact O-N 3.28Å; I326-I330 WeakPolarHBondContact O-CG1 2.89Å; I326-I330 PolarHBondContact O-N 3.39Å
327N90.9Very high89.8Confident0 Ų020.1 Ų20.10%013%0.129CC..Hα-helixtrans-56.6-42.5178.4-70.2-21.7000111.8G144 G147 V323 F331 P536 I537G144-N327 VanDerWaalsContact CA-CG 3.5Å; G144-N327 VanDerWaalsContact CA-ND2 3.33Å; G144-N327 WeakPolarHBondContact CA-ND2 3.21Å; G147-N327 PolarHBondContact N-OD1 3.42Å; V323-N327 WeakPolarHBondContact CG1-ND2 3.29Å; V323-N327 WeakPolarHBondContact O-CB 3.33Å; V323-N327 VanDerWaalsContact O-CG 3.25Å; V323-N327 PolarHBondContact O-N 3.42Å; V323-N327 PolarHBondContact O-ND2 2.96Å; N327-F331 VanDerWaalsContact O-CB 3.22Å; N327-F331 WeakPolarHBondContact O-CB 3.19Å; N327-F331 PolarHBondContact O-N 2.74Å; N327-P536 PolarHBondContact ND2-O 2.92Å; N327-I537 HydrophobicContact CB-CG2 4.36Å
328R92.9Very high90.7Very high4 Ų418.5 Ų18.52%0.01511%0.108CC..Hα-helixtrans-67.5-37.7175.3-171.6177.168.6-142.6-0.2112.5I70 G71 H324 I326 T332 Y517 I537I70-R328 WeakPolarHBondContact O-CD 3.3Å; I70-R328 PolarHBondContact O-NE 3.41Å; G71-R328 PolarHBondContact O-NE 3.27Å; G71-R328 PolarHBondContact O-NH2 3.09Å; H324-R328 WeakPolarHBondContact O-CB 3.48Å; H324-R328 PolarHBondContact O-N 2.9Å; I326-R328 VanDerWaalsContact C-N 3.27Å; I326-R328 PolarHBondContact O-N 3Å; R328-T332 VanDerWaalsContact O-CB 3.27Å; R328-T332 WeakPolarHBondContact O-CB 3.39Å; R328-T332 PolarHBondContact O-N 3.28Å; R328-T332 PolarHBondContact O-OG1 3.46Å; R328-Y517 PolarHBondContact NH1-O 2.88Å; R328-Y517 PolarHBondContact NH2-O 3.16Å; R328-I537 HydrophobicContact CB-CB 4.12Å; R328-I537 WeakPolarHBondContact CD-O 3.32Å; R328-I537 HydrophobicContact CG-CB 4.45Å
329G93.7Very high91.3Very high0 Ų019.8 Ų19.80%011%0.112CC..Hα-helixtrans-56.8-55.7173.400000111.2Q67 Y309 A325 I326 T332 E333Q67-G329 PolarHBondContact NE2-O 2.95Å; Q67-G329 PolarHBondContact OE1-O 3.35Å; Y309-G329 VanDerWaalsContact OH-C 3.25Å; Y309-G329 PolarHBondContact OH-O 3.42Å; A325-G329 PolarHBondContact O-N 2.75Å; I326-G329 WeakPolarHBondContact O-CA 3.32Å; I326-G329 PolarHBondContact O-N 3.28Å; G329-T332 PolarHBondContact O-N 2.67Å; G329-E333 WeakPolarHBondContact O-CB 3.35Å; G329-E333 PolarHBondContact O-N 3.46Å
330I94.5Very high91.9Very high0 Ų016.6 Ų16.60%09%0.093CC..Hα-helixtrans-63.7-42.4179-61.7-54.3000112.1E137 P146 I302 I306 Y309 I326 T332 E333 G334E137-I330 HydrophobicContact CG-CG2 4.11Å; P146-I330 HydrophobicContact CB-CG1 4.39Å; P146-I330 HydrophobicContact CG-CB 4.29Å; P146-I330 HydrophobicContact CG-CG1 4.26Å; P146-I330 HydrophobicContact CG-CG2 4.08Å; I302-I330 HydrophobicContact CB-CD1 4.32Å; I302-I330 HydrophobicContact CD1-CG2 4.22Å; I302-I330 HydrophobicContact CG1-CD1 4.42Å; I302-I330 HydrophobicContact CG1-CG2 3.83Å; I302-I330 HydrophobicContact CG2-CD1 3.98Å; I302-I330 HydrophobicContact CG2-CG1 4.24Å; I302-I330 HydrophobicContact CG2-CG2 4.29Å; I306-I330 HydrophobicContact CG1-CD1 4.43Å; Y309-I330 HydrophobicContact CE2-CD1 4.06Å; Y309-I330 HydrophobicContact CE2-CG1 4.4Å; I326-I330 WeakPolarHBondContact O-CG1 2.89Å; I326-I330 PolarHBondContact O-N 3.39Å; I330-T332 VanDerWaalsContact C-N 3.27Å; I330-T332 PolarHBondContact O-N 2.89Å; I330-E333 WeakPolarHBondContact O-CB 3.36Å; I330-E333 PolarHBondContact O-N 3.48Å; I330-G334 PolarHBondContact O-N 2.87Å
331F95.5Very high92.6Very high44 Ų4414.1 Ų14.119%0.1938%0.077CC..Hα-helixtrans-56.2-44.6174168.4-97.8000111.9V138 F142 N327 I335 I537V138-F331 HydrophobicContact CG1-CD2 3.76Å; V138-F331 HydrophobicContact CG1-CE2 3.54Å; V138-F331 WeakPolarHBondContact O-CD2 3.25Å; F142-F331 HydrophobicContact CB-CD2 3.91Å; F142-F331 HydrophobicContact CB-CE2 4.23Å; F142-F331 HydrophobicContact CD2-CE2 4.22Å; N327-F331 VanDerWaalsContact O-CB 3.22Å; N327-F331 WeakPolarHBondContact O-CB 3.19Å; N327-F331 PolarHBondContact O-N 2.74Å; F331-I335 HydrophobicContact CD1-CD1 4.02Å; F331-I335 HydrophobicContact CE1-CD1 3.39Å; F331-I335 HydrophobicContact CE2-CD1 4.28Å; F331-I335 HydrophobicContact CZ-CD1 3.55Å; F331-I335 WeakPolarHBondContact O-CG1 3.13Å; F331-I335 PolarHBondContact O-N 3.34Å; F331-I537 HydrophobicContact CB-CG2 4.13Å; F331-I537 HydrophobicContact CG-CG2 4.35Å
332T95.7Very high93.1Very high4 Ų417 Ų173%0.0259%0.092CC..Hα-helixtrans-74.2-32.4-178.4-54.70000111.4I66 G71 R328 G329 I330 I335 C336I66-T332 HydrophobicContact CG2-CG2 3.41Å; I66-T332 VanDerWaalsContact CG2-CG2 3.41Å; G71-T332 WeakPolarHBondContact CA-OG1 3.39Å; R328-T332 VanDerWaalsContact O-CB 3.27Å; R328-T332 WeakPolarHBondContact O-CB 3.39Å; R328-T332 PolarHBondContact O-N 3.28Å; R328-T332 PolarHBondContact O-OG1 3.46Å; G329-T332 PolarHBondContact O-N 2.67Å; I330-T332 VanDerWaalsContact C-N 3.27Å; I330-T332 PolarHBondContact O-N 2.89Å; T332-I335 WeakPolarHBondContact O-CB 3.31Å; T332-I335 PolarHBondContact O-N 3.21Å; T332-C336 PolarHBondContact O-N 3.47Å; T332-C336 PolarHBondContact O-SG 3.45Å
333E95.6Very high93.7Very high1 Ų115.6 Ų15.61%0.0058%0.082CC..Hα-helixtrans-62.9-46.9172.7-165.2163.3140.500111.5S305 Y309 G329 I330 I335 C336 C337 S349 T350S305-E333 VanDerWaalsContact CB-OE1 3.32Å; S305-E333 WeakPolarHBondContact CB-OE1 3.48Å; S305-E333 VanDerWaalsContact CB-OE2 3.27Å; S305-E333 WeakPolarHBondContact CB-OE2 3.48Å; S305-E333 PolarHBondContact OG-OE1 3.47Å; S305-E333 PolarHBondContact OG-OE2 3.32Å; Y309-E333 PolarHBondContact OH-OE2 2.93Å; G329-E333 WeakPolarHBondContact O-CB 3.35Å; G329-E333 PolarHBondContact O-N 3.46Å; I330-E333 WeakPolarHBondContact O-CB 3.36Å; I330-E333 PolarHBondContact O-N 3.48Å; E333-I335 VanDerWaalsContact C-N 3.31Å; E333-I335 PolarHBondContact O-N 3.09Å; E333-C336 CarbonylContact O-C 3.58Å; E333-C336 WeakPolarHBondContact O-CA 3.35Å; E333-C336 VanDerWaalsContact O-CB 3.23Å; E333-C336 WeakPolarHBondContact O-CB 3.42Å; E333-C336 PolarHBondContact O-N 2.93Å; E333-C337 PolarHBondContact O-N 3.33Å; E333-C337 PolarHBondContact O-SG 3.45Å; E333-C337 VanDerWaalsContact O-SG 3.39Å; E333-S349 WeakPolarHBondContact CG-O 3.3Å; E333-T350 PolarHBondContact OE1-OG1 3.27Å
334G96.3Very high94.2Very high0 Ų013.1 Ų13.10%07%0.067CC..Hα-helixtrans-56.9-41.3171.700000112.9V138 I330 C336 C337 V338V138-G334 VanDerWaalsContact CG2-C 3.43Å; I330-G334 PolarHBondContact O-N 2.87Å; G334-C336 VanDerWaalsContact C-N 3.34Å; G334-C336 PolarHBondContact O-N 3.18Å; G334-C337 PolarHBondContact O-N 3.02Å; G334-V338 WeakPolarHBondContact O-CG2 3.3Å; G334-V338 PolarHBondContact O-N 3.1Å
335I97.1Very high94.5Very high59 Ų5912.3 Ų12.330%0.3036%0.064SC..Hα-helixtrans-62.4-43173-67.9172.2000110.9V138 F331 T332 E333 C337 V338 I339V138-I335 HydrophobicContact CG2-CG1 3.89Å; F331-I335 HydrophobicContact CD1-CD1 4.02Å; F331-I335 HydrophobicContact CE1-CD1 3.39Å; F331-I335 HydrophobicContact CE2-CD1 4.28Å; F331-I335 HydrophobicContact CZ-CD1 3.55Å; F331-I335 WeakPolarHBondContact O-CG1 3.13Å; F331-I335 PolarHBondContact O-N 3.34Å; T332-I335 WeakPolarHBondContact O-CB 3.31Å; T332-I335 PolarHBondContact O-N 3.21Å; E333-I335 VanDerWaalsContact C-N 3.31Å; E333-I335 PolarHBondContact O-N 3.09Å; I335-C337 VanDerWaalsContact C-N 3.31Å; I335-C337 PolarHBondContact O-N 3.38Å; I335-V338 PolarHBondContact O-N 3.03Å; I335-I339 HydrophobicContact CG2-CD1 4.03Å; I335-I339 WeakPolarHBondContact O-CG1 3.22Å; I335-I339 PolarHBondContact O-N 3.35Å
336C96.9Very high94.6Very high0 Ų012.4 Ų12.40%07%0.065CC..Hα-helixtrans-60.1-41.1176.7-70.10000111.6T63 T332 E333 G334 I339 A340T63-C336 VanDerWaalsContact CB-SG 3.59Å; T63-C336 HydrophobicContact CG2-CB 3.44Å; T63-C336 VanDerWaalsContact CG2-CB 3.44Å; T332-C336 PolarHBondContact O-N 3.47Å; T332-C336 PolarHBondContact O-SG 3.45Å; E333-C336 CarbonylContact O-C 3.58Å; E333-C336 WeakPolarHBondContact O-CA 3.35Å; E333-C336 VanDerWaalsContact O-CB 3.23Å; E333-C336 WeakPolarHBondContact O-CB 3.42Å; E333-C336 PolarHBondContact O-N 2.93Å; G334-C336 VanDerWaalsContact C-N 3.34Å; G334-C336 PolarHBondContact O-N 3.18Å; C336-I339 WeakPolarHBondContact O-CB 3.16Å; C336-I339 PolarHBondContact O-N 2.88Å; C336-A340 WeakPolarHBondContact O-CB 3.37Å; C336-A340 PolarHBondContact O-N 3.34Å
337C96.8Very high94.6Very high1 Ų112.6 Ų12.61%0.0077%0.065CC..Hα-helixtrans-67.2-38175-65.20000112.7S134 E333 G334 I335 I339 A340 G341 S349S134-C337 WeakPolarHBondContact OG-CB 3.34Å; E333-C337 PolarHBondContact O-N 3.33Å; E333-C337 PolarHBondContact O-SG 3.45Å; E333-C337 VanDerWaalsContact O-SG 3.39Å; G334-C337 PolarHBondContact O-N 3.02Å; I335-C337 VanDerWaalsContact C-N 3.31Å; I335-C337 PolarHBondContact O-N 3.38Å; C337-I339 VanDerWaalsContact C-N 3.33Å; C337-I339 PolarHBondContact O-N 3.44Å; C337-A340 WeakPolarHBondContact O-CB 3.41Å; C337-A340 PolarHBondContact O-N 2.9Å; C337-G341 PolarHBondContact O-N 3.49Å; C337-S349 PolarHBondContact SG-N 2.81Å; C337-S349 PolarHBondContact SG-O 3.36Å
338V97.3Very high94.6Very high25 Ų2512.6 Ų12.615%0.1527%0.065CC..Hα-helixtrans-60.6-44171.7171.60000110.7I131 L135 G334 I335 A340 G341 L342I131-V338 HydrophobicContact CG2-CG1 4.45Å; L135-V338 HydrophobicContact CD2-CG2 4.18Å; L135-V338 HydrophobicContact CG-CG2 4.19Å; G334-V338 WeakPolarHBondContact O-CG2 3.3Å; G334-V338 PolarHBondContact O-N 3.1Å; I335-V338 PolarHBondContact O-N 3.03Å; V338-A340 VanDerWaalsContact C-N 3.32Å; V338-A340 PolarHBondContact O-N 3.13Å; V338-G341 PolarHBondContact O-N 2.86Å; V338-L342 HydrophobicContact CG1-CD1 4.11Å; V338-L342 HydrophobicContact CG1-CG 4.5Å; V338-L342 WeakPolarHBondContact O-CB 3.39Å; V338-L342 WeakPolarHBondContact O-CG 3.43Å; V338-L342 PolarHBondContact O-N 2.65Å
339I96.7Very high94.6Very high42 Ų4212.6 Ų12.622%0.2157%0.066CC..Hα-helixtrans-61-42.9174.9-67.4166.7000110.5I66 I335 C336 C337 L342 L343I66-I339 HydrophobicContact CD1-CD1 3.66Å; I335-I339 HydrophobicContact CG2-CD1 4.03Å; I335-I339 WeakPolarHBondContact O-CG1 3.22Å; I335-I339 PolarHBondContact O-N 3.35Å; C336-I339 WeakPolarHBondContact O-CB 3.16Å; C336-I339 PolarHBondContact O-N 2.88Å; C337-I339 VanDerWaalsContact C-N 3.33Å; C337-I339 PolarHBondContact O-N 3.44Å; I339-L342 PolarHBondContact O-N 2.97Å; I339-L343 HydrophobicContact CG2-CD1 3.93Å; I339-L343 HydrophobicContact CG2-CG 4.3Å; I339-L343 WeakPolarHBondContact O-CB 3.35Å; I339-L343 WeakPolarHBondContact O-CG 3.5Å; I339-L343 PolarHBondContact O-N 2.68Å
340A96Very high94.5Very high2 Ų212.8 Ų12.82%0.0177%0.067CC..Hα-helixtrans-62.3-44.6178.200000112.2T59 C336 C337 V338 L342 L343 G344 T345T59-A340 HydrophobicContact CG2-CB 3.79Å; C336-A340 WeakPolarHBondContact O-CB 3.37Å; C336-A340 PolarHBondContact O-N 3.34Å; C337-A340 WeakPolarHBondContact O-CB 3.41Å; C337-A340 PolarHBondContact O-N 2.9Å; V338-A340 VanDerWaalsContact C-N 3.32Å; V338-A340 PolarHBondContact O-N 3.13Å; A340-L342 PolarHBondContact O-N 2.93Å; A340-L343 PolarHBondContact O-N 2.92Å; A340-G344 PolarHBondContact O-N 2.95Å; A340-T345 HydrophobicContact CB-CG2 4.16Å; A340-T345 WeakPolarHBondContact CB-OG1 3.41Å; A340-T345 PolarHBondContact O-N 3.47Å; A340-T345 VanDerWaalsContact O-N 3.14Å; A340-T345 PolarHBondContact O-OG1 2.87Å; A340-T345 VanDerWaalsContact O-OG1 3.1Å
341G95.5Very high94.3Very high0 Ų012.9 Ų12.90%07%0.068CC..Hα-helixtrans-61.3-42.3172.900000112.8Q127 C337 V338 G344Q127-G341 VanDerWaalsContact CG-O 3.29Å; Q127-G341 WeakPolarHBondContact CG-O 3.45Å; Q127-G341 PolarHBondContact NE2-O 3.38Å; C337-G341 PolarHBondContact O-N 3.49Å; V338-G341 PolarHBondContact O-N 2.86Å; G341-G344 PolarHBondContact O-N 2.95Å
342L95.7Very high93.9Very high59 Ų5911 Ų1131%0.3096%0.061SC..Hα-helixtrans-64.2-45.5176.1-74.5171.5000112.4I131 P278 C279 V338 I339 A340 G344I131-L342 HydrophobicContact CD1-CD2 3.94Å; I131-L342 HydrophobicContact CD1-CG 4.17Å; P278-L342 CarbonylContact C-O 3.57Å; P278-L342 WeakPolarHBondContact CA-O 3.17Å; P278-L342 HydrophobicContact CB-CB 4.45Å; C279-L342 PolarHBondContact N-O 3.46Å; V338-L342 HydrophobicContact CG1-CD1 4.11Å; V338-L342 HydrophobicContact CG1-CG 4.5Å; V338-L342 WeakPolarHBondContact O-CB 3.39Å; V338-L342 WeakPolarHBondContact O-CG 3.43Å; V338-L342 PolarHBondContact O-N 2.65Å; I339-L342 PolarHBondContact O-N 2.97Å; A340-L342 PolarHBondContact O-N 2.93Å; L342-G344 PolarHBondContact O-N 3.06Å
343L95.5Very high93.3Very high15 Ų1511.6 Ų11.68%0.0796%0.064CC..Hα-helixtrans-72.1-18.4177-66.7-179.8000112.5T55 T59 I62 P276 P278 Q280 I339 A340T55-L343 HydrophobicContact CG2-CB 4.33Å; T55-L343 WeakPolarHBondContact CG2-O 3.31Å; T59-L343 HydrophobicContact CG2-CD1 4.3Å; T59-L343 VanDerWaalsContact OG1-CD1 3.3Å; T59-L343 WeakPolarHBondContact OG1-CD1 3.37Å; I62-L343 HydrophobicContact CD1-CD1 4.19Å; P276-L343 HydrophobicContact CB-CD2 4.43Å; P278-L343 HydrophobicContact CG-CD2 4.29Å; Q280-L343 PolarHBondContact NE2-O 2.93Å; I339-L343 HydrophobicContact CG2-CD1 3.93Å; I339-L343 HydrophobicContact CG2-CG 4.3Å; I339-L343 WeakPolarHBondContact O-CB 3.35Å; I339-L343 WeakPolarHBondContact O-CG 3.5Å; I339-L343 PolarHBondContact O-N 2.68Å; A340-L343 PolarHBondContact O-N 2.92Å
344G93.2Very high92.4Very high0 Ų013.9 Ų13.90%08%0.079CC..THydrogen-bonded Turntrans80.145.6174.700000113.9W281 A340 G341 L342 G346W281-G344 PolarHBondContact NE1-O 2.91Å; A340-G344 PolarHBondContact O-N 2.95Å; G341-G344 PolarHBondContact O-N 2.95Å; L342-G344 PolarHBondContact O-N 3.06Å; G344-G346 VanDerWaalsContact C-N 3.26Å
345T92.2Very high91.8Very high3 Ų313.9 Ų13.92%0.0188%0.079CC..  trans-68.8-23.2172.352.10000113.3T55 I56 T59 A340 N347T55-T345 HydrophobicContact CG2-CG2 4.12Å; I56-T345 HydrophobicContact CG1-CG2 4.04Å; T59-T345 HydrophobicContact CG2-CG2 3.78Å; T59-T345 VanDerWaalsContact OG1-CG2 3.28Å; T59-T345 WeakPolarHBondContact OG1-CG2 3.29Å; A340-T345 HydrophobicContact CB-CG2 4.16Å; A340-T345 WeakPolarHBondContact CB-OG1 3.41Å; A340-T345 PolarHBondContact O-N 3.47Å; A340-T345 VanDerWaalsContact O-N 3.14Å; A340-T345 PolarHBondContact O-OG1 2.87Å; A340-T345 VanDerWaalsContact O-OG1 3.1Å; T345-N347 PolarHBondContact O-N 3.26Å; T345-N347 PolarHBondContact O-ND2 3.47Å; T345-N347 PolarHBondContact OG1-N 3.23Å; T345-N347 PolarHBondContact OG1-O 2.75Å
346G88.9Confident91.1Very high2 Ų211.5 Ų11.52%0.0217%0.067CC..SBendtrans756-173.100000114.6G344G344-G346 VanDerWaalsContact C-N 3.26Å
347N90.4Very high90.1Very high3 Ų313.2 Ų13.22%0.0169%0.085CC..SBendtrans-149.4157.7177.458.182000111V32 I56 S80 F84 T345V32-N347 HydrophobicContact CG1-CB 3.88Å; V32-N347 WeakPolarHBondContact CG1-ND2 3.4Å; I56-N347 WeakPolarHBondContact CD1-ND2 3.48Å; S80-N347 WeakPolarHBondContact CA-OD1 3.21Å; S80-N347 WeakPolarHBondContact CB-OD1 3.11Å; S80-N347 PolarHBondContact OG-OD1 3.12Å; F84-N347 HydrophobicContact CB-CB 4.31Å; T345-N347 PolarHBondContact O-N 3.26Å; T345-N347 PolarHBondContact O-ND2 3.47Å; T345-N347 PolarHBondContact OG1-N 3.23Å; T345-N347 PolarHBondContact OG1-O 2.75Å
348G91Very high89.1Confident0 Ų014.3 Ų14.30%09%0.092CC..  trans-76.4171.9170.500000113.1A81A81-G348 WeakPolarHBondContact CB-O 3.06Å; A81-G348 PolarHBondContact N-O 3.25Å
349S91.9Very high88.4Confident4 Ų413.1 Ų13.13%0.0289%0.085CC..EExtended strand (participates in β ladder)trans-104.5130.2175.5-175.60000109.2T63 Q78 A79 E333 C337T63-S349 WeakPolarHBondContact CB-OG 3.37Å; T63-S349 PolarHBondContact OG1-OG 3.46Å; Q78-S349 WeakPolarHBondContact CB-OG 3.44Å; Q78-S349 PolarHBondContact OE1-OG 3.24Å; A79-S349 WeakPolarHBondContact O-CA 3.23Å; E333-S349 WeakPolarHBondContact CG-O 3.3Å; C337-S349 PolarHBondContact SG-N 2.81Å; C337-S349 PolarHBondContact SG-O 3.36Å
350T91.6Very high87.4Confident5 Ų511.8 Ų11.83%0.0318%0.081CC..EExtended strand (participates in β ladder)trans-134.9171.5174.4-171.10000110.6Q78 A79 A81 S305 E333Q78-T350 CarbonylContact C-O 3.58Å; Q78-T350 VanDerWaalsContact CA-O 3.25Å; Q78-T350 WeakPolarHBondContact CA-O 3.2Å; Q78-T350 PolarHBondContact OE1-O 2.62Å; A79-T350 PolarHBondContact N-O 3.42Å; A79-T350 PolarHBondContact O-N 2.89Å; A81-T350 HydrophobicContact CB-CG2 3.44Å; A81-T350 VanDerWaalsContact CB-CG2 3.44Å; S305-T350 PolarHBondContact OG-OG1 3.12Å; E333-T350 PolarHBondContact OE1-OG1 3.27Å
351S90.4Very high86.3Confident2 Ų214.3 Ų14.31%0.0149%0.094CC..EExtended strand (participates in β ladder)trans-66.6143.5173.5-58.30000112Q78 S305 D308 Y309Q78-S351 PolarHBondContact NE2-OG 3.35Å; S305-S351 WeakPolarHBondContact OG-CB 3.5Å; S305-S351 PolarHBondContact OG-N 3.16Å; S305-S351 PolarHBondContact OG-OG 3.2Å; D308-S351 WeakPolarHBondContact OD2-CB 3.28Å; Y309-S351 VanDerWaalsContact CE1-OG 3.31Å; Y309-S351 WeakPolarHBondContact CE1-OG 3.21Å
352S88.3Confident85.6Confident5 Ų514.7 Ų14.74%0.03510%0.096CC..  trans-95.697.7-176.4-169.70000112.6C25 F77 N355 I356C25-S352 PolarHBondContact SG-OG 3.48Å; C25-S352 VanDerWaalsContact SG-OG 3.36Å; F77-S352 WeakPolarHBondContact O-CB 3.39Å; F77-S352 PolarHBondContact O-N 3.32Å; S352-N355 WeakPolarHBondContact O-CB 3.3Å; S352-N355 PolarHBondContact O-N 3.44Å; S352-N355 VanDerWaalsContact O-N 3.1Å; S352-I356 PolarHBondContact O-N 2.98Å
353S81.8Confident85Confident15 Ų1516.2 Ų16.211%0.10510%0.1CC..Hα-helixtrans-59.1-38.1175.3-38.50000114.7D308 N355 I356 G357D308-S353 WeakPolarHBondContact OD1-CB 3.13Å; D308-S353 PolarHBondContact OD1-OG 2.96Å; D308-S353 PolarHBondContact OD2-N 3.23Å; D308-S353 PolarHBondContact OD2-OG 3.19Å; S353-N355 PolarHBondContact O-N 3.31Å; S353-I356 WeakPolarHBondContact O-CB 3.48Å; S353-I356 PolarHBondContact O-N 3Å; S353-I356 VanDerWaalsContact O-N 3.09Å; S353-G357 PolarHBondContact O-N 3.47Å; S353-G357 VanDerWaalsContact O-N 3.11Å
354P77.5Confident84.6Confident49 Ų4915.9 Ų15.932%0.31810%0.099SC..Hα-helixtrans-58.1-36.3173.8-26.835.6000113T24 I356 G357 V358T24-P354 HydrophobicContact CG2-CB 4.4Å; P354-I356 VanDerWaalsContact C-N 3.34Å; P354-G357 PolarHBondContact O-N 3.03Å; P354-V358 PolarHBondContact O-N 2.82Å; P354-V358 VanDerWaalsContact O-N 3.16Å
355N83.5Confident84.4Confident0 Ų015.9 Ų15.90%010%0.099CC..Hα-helixtrans-69.3-33.3178.2-170.463.8000112.3H21 F77 S352 S353 G357 V358 L359H21-N355 WeakPolarHBondContact CB-OD1 3.34Å; H21-N355 PolarHBondContact ND1-OD1 3.43Å; F77-N355 HydrophobicContact CB-CB 4.16Å; F77-N355 WeakPolarHBondContact CD2-ND2 3.2Å; S352-N355 WeakPolarHBondContact O-CB 3.3Å; S352-N355 PolarHBondContact O-N 3.44Å; S352-N355 VanDerWaalsContact O-N 3.1Å; S353-N355 PolarHBondContact O-N 3.31Å; N355-G357 VanDerWaalsContact C-N 3.34Å; N355-V358 PolarHBondContact O-N 3.06Å; N355-L359 WeakPolarHBondContact O-CB 3.46Å; N355-L359 PolarHBondContact O-N 3.41Å
356I82.3Confident84.4Confident9 Ų915.8 Ų15.85%0.04610%0.098CC..Hα-helixtrans-64.3-40.2172.4-61.6173.6000110.9L76 D308 A311 C312 L315 S352 S353 P354 V358 L359 G360L76-I356 HydrophobicContact CD2-CD1 3.6Å; L76-I356 HydrophobicContact CD2-CG1 3.53Å; D308-I356 HydrophobicContact CB-CD1 3.46Å; D308-I356 VanDerWaalsContact CB-CD1 3.46Å; D308-I356 WeakPolarHBondContact O-CD1 3.23Å; D308-I356 WeakPolarHBondContact OD1-CD1 3.41Å; A311-I356 HydrophobicContact CB-CG2 3.95Å; C312-I356 HydrophobicContact CB-CD1 4.22Å; C312-I356 HydrophobicContact CB-CG1 4.21Å; L315-I356 HydrophobicContact CD1-CG2 3.58Å; L315-I356 WeakPolarHBondContact CD1-O 3.48Å; S352-I356 PolarHBondContact O-N 2.98Å; S353-I356 WeakPolarHBondContact O-CB 3.48Å; S353-I356 PolarHBondContact O-N 3Å; S353-I356 VanDerWaalsContact O-N 3.09Å; P354-I356 VanDerWaalsContact C-N 3.34Å; I356-V358 PolarHBondContact O-N 3.3Å; I356-L359 WeakPolarHBondContact O-CB 3.06Å; I356-L359 PolarHBondContact O-N 3.08Å; I356-G360 PolarHBondContact O-N 2.68Å
357G75.6Confident84.6Confident37 Ų3717 Ų1738%0.38110%0.102SC..Hα-helixtrans-57.3-47.9172.700000112.2S353 P354 N355 L359 G360 I361S353-G357 PolarHBondContact O-N 3.47Å; S353-G357 VanDerWaalsContact O-N 3.11Å; P354-G357 PolarHBondContact O-N 3.03Å; N355-G357 VanDerWaalsContact C-N 3.34Å; G357-L359 PolarHBondContact O-N 2.96Å; G357-G360 PolarHBondContact O-N 2.75Å; G357-I361 VanDerWaalsContact O-CG1 3.3Å; G357-I361 WeakPolarHBondContact O-CG1 3.29Å; G357-I361 PolarHBondContact O-N 2.85Å
358V75.3Confident84.7Confident23 Ų2322.7 Ų22.714%0.13912%0.124CC..Hα-helixtrans-66.4-36.3177.3169.30000112.4T24 P354 N355 I356 G360 I361 T362T24-V358 HydrophobicContact CG2-CB 4.06Å; T24-V358 HydrophobicContact CG2-CG2 3.34Å; P354-V358 PolarHBondContact O-N 2.82Å; P354-V358 VanDerWaalsContact O-N 3.16Å; N355-V358 PolarHBondContact O-N 3.06Å; I356-V358 PolarHBondContact O-N 3.3Å; V358-G360 VanDerWaalsContact C-N 3.34Å; V358-G360 PolarHBondContact O-N 2.86Å; V358-I361 PolarHBondContact O-N 3.24Å; V358-T362 HydrophobicContact CG1-CG2 3.68Å; V358-T362 WeakPolarHBondContact O-CB 3.23Å; V358-T362 VanDerWaalsContact O-CG2 3.31Å; V358-T362 WeakPolarHBondContact O-CG2 3.24Å; V358-T362 PolarHBondContact O-N 3.07Å; V358-T362 PolarHBondContact O-OG1 3.49Å
359L82.6Confident84.8Confident1 Ų122.7 Ų22.71%0.00512%0.124CC..Hα-helixtrans-55.6-48.2170165.866.5000111.4M1 P75 L315 N355 I356 G357 I361 T362 K363 V364M1-L359 HydrophobicContact CE-CD1 4.28Å; P75-L359 HydrophobicContact CG-CD2 4.36Å; L315-L359 HydrophobicContact CB-CD2 4.06Å; L315-L359 HydrophobicContact CB-CG 4.16Å; N355-L359 WeakPolarHBondContact O-CB 3.46Å; N355-L359 PolarHBondContact O-N 3.41Å; I356-L359 WeakPolarHBondContact O-CB 3.06Å; I356-L359 PolarHBondContact O-N 3.08Å; G357-L359 PolarHBondContact O-N 2.96Å; L359-I361 PolarHBondContact O-N 3.23Å; L359-T362 PolarHBondContact O-OG1 3.03Å; L359-K363 WeakPolarHBondContact O-CA 3.42Å; L359-K363 PolarHBondContact O-N 3.26Å; L359-V364 VanDerWaalsContact CD1-C 3.44Å; L359-V364 WeakPolarHBondContact CD1-O 3.33Å
360G75.7Confident84.9Confident14 Ų1422.6 Ų22.614%0.14412%0.123CC..Hα-helixtrans-60.6-27.5178.600000113.9I356 G357 V358 K363I356-G360 PolarHBondContact O-N 2.68Å; G357-G360 PolarHBondContact O-N 2.75Å; V358-G360 VanDerWaalsContact C-N 3.34Å; V358-G360 PolarHBondContact O-N 2.86Å; G360-K363 WeakPolarHBondContact O-CD 3.43Å; G360-K363 WeakPolarHBondContact O-CE 3.28Å; G360-K363 PolarHBondContact O-NZ 3.23Å
361I74.5Confident85.1Confident55 Ų5523.7 Ų23.728%0.28213%0.128SC..Hα-helixtrans-88.8-47.2-178.6-68.7171.2000112.7R199 K223 G357 V358 L359 K363R199-I361 VanDerWaalsContact CZ-CG2 3.42Å; R199-I361 VanDerWaalsContact NH2-CG1 3.32Å; K223-I361 HydrophobicContact CD-CG2 4.46Å; K223-I361 WeakPolarHBondContact CE-O 3.07Å; K223-I361 HydrophobicContact CG-CG2 4.19Å; K223-I361 PolarHBondContact NZ-O 3.07Å; G357-I361 VanDerWaalsContact O-CG1 3.3Å; G357-I361 WeakPolarHBondContact O-CG1 3.29Å; G357-I361 PolarHBondContact O-N 2.85Å; V358-I361 PolarHBondContact O-N 3.24Å; L359-I361 PolarHBondContact O-N 3.23Å; I361-K363 VanDerWaalsContact C-N 3.3Å
362T80.3Confident85.3Confident8 Ų827.6 Ų27.65%0.04914%0.144CC..Hα-helixtrans-75-26.2-177.755.30000111.5I2 V358 L359 V364I2-T362 WeakPolarHBondContact CD1-O 3.33Å; V358-T362 HydrophobicContact CG1-CG2 3.68Å; V358-T362 WeakPolarHBondContact O-CB 3.23Å; V358-T362 VanDerWaalsContact O-CG2 3.31Å; V358-T362 WeakPolarHBondContact O-CG2 3.24Å; V358-T362 PolarHBondContact O-N 3.07Å; V358-T362 PolarHBondContact O-OG1 3.49Å; L359-T362 PolarHBondContact O-OG1 3.03Å; T362-V364 PolarHBondContact O-N 3.46Å; T362-V364 PolarHBondContact OG1-N 3.33Å
363K83.4Confident85.6Confident91 Ų9127.4 Ų27.440%0.39614%0.143SC..  trans5928.9-172.4-53.8-60.3-172.2-167.10112.1M1 I2 Y3 L359 G360 I361M1-K363 WeakPolarHBondContact CE-O 3.45Å; M1-K363 HydrophobicContact SD-CB 3.82Å; M1-K363 HydrophobicContact SD-CD 3.77Å; M1-K363 HydrophobicContact SD-CG 4.4Å; I2-K363 HydrophobicContact CG1-CB 4.17Å; I2-K363 PolarHBondContact N-O 3.27Å; Y3-K363 PolarHBondContact N-O 3.42Å; L359-K363 WeakPolarHBondContact O-CA 3.42Å; L359-K363 PolarHBondContact O-N 3.26Å; G360-K363 WeakPolarHBondContact O-CD 3.43Å; G360-K363 WeakPolarHBondContact O-CE 3.28Å; G360-K363 PolarHBondContact O-NZ 3.23Å; I361-K363 VanDerWaalsContact C-N 3.3Å
364V86.3Confident86.2Confident8 Ų826.7 Ų26.75%0.04814%0.138CC..BIsolated β-bridgetrans-108.692.4176.5178.30000108.8Y3 L17 L359 T362 V369Y3-V364 HydrophobicContact CD2-CG1 4.16Å; Y3-V364 HydrophobicContact CD2-CG2 4.24Å; L17-V364 HydrophobicContact CD1-CG1 3.94Å; L17-V364 HydrophobicContact CD1-CG2 4.2Å; L17-V364 HydrophobicContact CD2-CG2 4.33Å; L359-V364 VanDerWaalsContact CD1-C 3.44Å; L359-V364 WeakPolarHBondContact CD1-O 3.33Å; T362-V364 PolarHBondContact O-N 3.46Å; T362-V364 PolarHBondContact OG1-N 3.33Å; V364-V369 HydrophobicContact CG1-CB 4.36Å; V364-V369 HydrophobicContact CG1-CG1 4.22Å; V364-V369 HydrophobicContact CG1-CG2 3.95Å
365G88.4Confident87.1Confident0 Ų025.4 Ų25.40%013%0.133CC..  trans-96.112.3-179.700000115.3Y3 I5 P75 R367Y3-G365 WeakPolarHBondContact O-CA 3.35Å; Y3-G365 PolarHBondContact O-N 3.21Å; I5-G365 VanDerWaalsContact CA-O 3.26Å; I5-G365 WeakPolarHBondContact CA-O 3.22Å; P75-G365 VanDerWaalsContact CB-O 3.29Å; P75-G365 WeakPolarHBondContact CB-O 3.21Å; P75-G365 VanDerWaalsContact CG-O 3.23Å; P75-G365 WeakPolarHBondContact CG-O 3.29Å; G365-R367 PolarHBondContact O-N 3.22Å
366S92.3Very high87.6Confident1 Ų126.9 Ų26.91%0.00714%0.141CC..  trans-71129-176.9171.70000112.2T4 D7 P9 R368 V369T4-S366 VanDerWaalsContact O-CA 3.31Å; T4-S366 WeakPolarHBondContact O-CA 3.43Å; T4-S366 PolarHBondContact O-N 3.3Å; D7-S366 WeakPolarHBondContact O-CB 3.45Å; D7-S366 PolarHBondContact O-OG 2.95Å; P9-S366 WeakPolarHBondContact CD-OG 3.08Å; S366-R368 VanDerWaalsContact C-N 3.25Å; S366-R368 PolarHBondContact O-N 3.4Å; S366-R368 PolarHBondContact OG-N 3.22Å; S366-V369 WeakPolarHBondContact O-CB 3.45Å; S366-V369 PolarHBondContact O-N 3.45Å
367R92.6Very high88.1Confident26 Ų2626.4 Ų26.410%0.09814%0.139CC..Hα-helixtrans-63.5-32.3174.3-63.2179.5-64.9-171.4-8.1112.8I5 R73 P75 G365 V369 V370 Q371 S516I5-R367 HydrophobicContact CD1-CG 4.48Å; I5-R367 HydrophobicContact CG1-CG 3.69Å; I5-R367 WeakPolarHBondContact O-CG 3.2Å; I5-R367 PolarHBondContact O-NE 3.26Å; R73-R367 WeakPolarHBondContact O-CD 3.33Å; R73-R367 PolarHBondContact O-NH1 3.36Å; P75-R367 HydrophobicContact CB-CG 4.25Å; G365-R367 PolarHBondContact O-N 3.22Å; R367-V369 VanDerWaalsContact C-N 3.32Å; R367-V370 PolarHBondContact O-N 3.08Å; R367-Q371 WeakPolarHBondContact O-CG 3.44Å; R367-Q371 PolarHBondContact O-N 3.02Å; R367-S516 PolarHBondContact NH1-O 3.17Å
368R93.3Very high89.1Confident124 Ų12427.8 Ų27.847%0.46813%0.134SC..Hα-helixtrans-65.1-39.9179.4-65.1-58.3-167.2176.55.2111V8 S366 V370 Q371 F372V8-R368 HydrophobicContact CB-CG 4.43Å; V8-R368 HydrophobicContact CG1-CG 4.17Å; V8-R368 HydrophobicContact CG2-CG 3.98Å; S366-R368 VanDerWaalsContact C-N 3.25Å; S366-R368 PolarHBondContact O-N 3.4Å; S366-R368 PolarHBondContact OG-N 3.22Å; R368-V370 VanDerWaalsContact C-N 3.31Å; R368-V370 PolarHBondContact O-N 3.19Å; R368-Q371 PolarHBondContact O-N 3.44Å; R368-F372 VanDerWaalsContact O-CD2 3.28Å; R368-F372 WeakPolarHBondContact O-CD2 3.41Å; R368-F372 PolarHBondContact O-N 3.06Å
369V94.1Very high90Very high0 Ų031.5 Ų31.50%015%0.153CC..Hα-helixtrans-57.8-46.8175.2173.70000110.7P9 L17 G18 V364 S366 R367 F372 G373P9-V369 HydrophobicContact CG-CG2 3.81Å; L17-V369 HydrophobicContact CB-CG1 3.43Å; L17-V369 VanDerWaalsContact CB-CG1 3.43Å; L17-V369 HydrophobicContact CB-CG2 4.34Å; L17-V369 HydrophobicContact CD1-CG2 4.38Å; G18-V369 WeakPolarHBondContact CA-O 3.49Å; V364-V369 HydrophobicContact CG1-CB 4.36Å; V364-V369 HydrophobicContact CG1-CG1 4.22Å; V364-V369 HydrophobicContact CG1-CG2 3.95Å; S366-V369 WeakPolarHBondContact O-CB 3.45Å; S366-V369 PolarHBondContact O-N 3.45Å; R367-V369 VanDerWaalsContact C-N 3.32Å; V369-F372 PolarHBondContact O-N 3.44Å; V369-G373 PolarHBondContact O-N 3.44Å
370V93.9Very high90.5Very high2 Ų233.4 Ų33.41%0.01216%0.163CC..Hα-helixtrans-63.3-43.7177.71760000111.8T64 T68 P75 F77 R367 R368 F372 G373 A374T64-V370 HydrophobicContact CG2-CG1 3.72Å; T68-V370 HydrophobicContact CG2-CG1 3.68Å; P75-V370 HydrophobicContact CB-CG2 3.85Å; F77-V370 HydrophobicContact CD2-CB 4.37Å; F77-V370 HydrophobicContact CD2-CG1 3.61Å; F77-V370 HydrophobicContact CD2-CG2 4.28Å; F77-V370 HydrophobicContact CE2-CB 4.06Å; F77-V370 HydrophobicContact CE2-CG1 3.62Å; F77-V370 HydrophobicContact CE2-CG2 4.16Å; F77-V370 HydrophobicContact CG-CG1 4.37Å; F77-V370 HydrophobicContact CZ-CG1 4.41Å; R367-V370 PolarHBondContact O-N 3.08Å; R368-V370 VanDerWaalsContact C-N 3.31Å; R368-V370 PolarHBondContact O-N 3.19Å; V370-F372 PolarHBondContact O-N 3.43Å; V370-G373 PolarHBondContact O-N 3.33Å; V370-A374 WeakPolarHBondContact O-CB 3.39Å; V370-A374 PolarHBondContact O-N 2.65Å
371Q95.5Very high91.3Very high28 Ų2832.9 Ų32.913%0.13116%0.157CC..Hα-helixtrans-62.1-41176.8-73171.7-6.900112.9L65 T68 R367 R368 A374 G375L65-Q371 HydrophobicContact CD2-CB 4.07Å; L65-Q371 HydrophobicContact CD2-CG 4.26Å; T68-Q371 WeakPolarHBondContact OG1-CG 3.47Å; R367-Q371 WeakPolarHBondContact O-CG 3.44Å; R367-Q371 PolarHBondContact O-N 3.02Å; R368-Q371 PolarHBondContact O-N 3.44Å; Q371-A374 PolarHBondContact O-N 3.12Å; Q371-G375 PolarHBondContact O-N 3.01Å
372F95.1Very high92.3Very high84 Ų8431.3 Ų31.337%0.36815%0.15SC..Hα-helixtrans-64.5-43.4174.3-91.1-102.9000111.3W11 C14 I15 R368 V369 V370 A374 G375 I376W11-F372 HydrophobicContact CB-CE1 4.49Å; W11-F372 HydrophobicContact CB-CZ 4.4Å; C14-F372 HydrophobicContact CB-CB 4.01Å; C14-F372 HydrophobicContact CB-CD1 4.07Å; C14-F372 HydrophobicContact CB-CD2 3.78Å; C14-F372 HydrophobicContact CB-CE1 4.49Å; C14-F372 HydrophobicContact CB-CE2 4.21Å; C14-F372 HydrophobicContact CB-CG 3.68Å; I15-F372 HydrophobicContact CG1-CD1 3.91Å; I15-F372 HydrophobicContact CG1-CE1 4.35Å; R368-F372 VanDerWaalsContact O-CD2 3.28Å; R368-F372 WeakPolarHBondContact O-CD2 3.41Å; R368-F372 PolarHBondContact O-N 3.06Å; V369-F372 PolarHBondContact O-N 3.44Å; V370-F372 PolarHBondContact O-N 3.43Å; F372-A374 VanDerWaalsContact C-N 3.32Å; F372-A374 PolarHBondContact O-N 3.06Å; F372-G375 PolarHBondContact O-N 3.25Å; F372-I376 WeakPolarHBondContact O-CG1 3.2Å; F372-I376 PolarHBondContact O-N 3.19Å
373G93.9Very high93Very high0 Ų032.3 Ų32.30%016%0.156CC..Hα-helixtrans-62.2-38.117500000112.9G18 V369 V370 I376 M377G18-G373 WeakPolarHBondContact O-CA 3.28Å; V369-G373 PolarHBondContact O-N 3.44Å; V370-G373 PolarHBondContact O-N 3.33Å; G373-I376 WeakPolarHBondContact O-CB 3.32Å; G373-I376 PolarHBondContact O-N 3.17Å; G373-M377 WeakPolarHBondContact O-CB 3.23Å; G373-M377 PolarHBondContact O-N 3.16Å
374A95.1Very high93.4Very high0 Ų028.2 Ų28.20%014%0.14CC..Hα-helixtrans-64.3-40.2173.200000112.5G61 T64 L65 V370 Q371 F372 M377 F378G61-A374 WeakPolarHBondContact CA-O 2.93Å; T64-A374 HydrophobicContact CG2-CB 3.64Å; L65-A374 HydrophobicContact CD2-CB 4.05Å; L65-A374 HydrophobicContact CG-CB 3.84Å; V370-A374 WeakPolarHBondContact O-CB 3.39Å; V370-A374 PolarHBondContact O-N 2.65Å; Q371-A374 PolarHBondContact O-N 3.12Å; F372-A374 VanDerWaalsContact C-N 3.32Å; F372-A374 PolarHBondContact O-N 3.06Å; A374-M377 PolarHBondContact O-N 3.1Å; A374-F378 WeakPolarHBondContact O-CB 3.5Å; A374-F378 PolarHBondContact O-N 3.47Å
375G95.8Very high93.7Very high22 Ų2229.7 Ų29.723%0.22715%0.145CC..Hα-helixtrans-62.9-40172.400000112.9Q371 F372 F378 I379Q371-G375 PolarHBondContact O-N 3.01Å; F372-G375 PolarHBondContact O-N 3.25Å; G375-F378 PolarHBondContact O-N 2.95Å; G375-I379 VanDerWaalsContact O-CG1 3.31Å; G375-I379 WeakPolarHBondContact O-CG1 3.43Å; G375-I379 PolarHBondContact O-N 3.35Å
376I94Very high93.9Very high31 Ų3131.8 Ų31.816%0.15915%0.154CC..Hα-helixtrans-62.2-46.5173.7-68.3164.8000110.3I15 L19 F372 G373 F378 I379 L380I15-I376 HydrophobicContact CG2-CD1 4.09Å; L19-I376 HydrophobicContact CB-CD1 4.49Å; L19-I376 HydrophobicContact CD1-CG2 4.07Å; F372-I376 WeakPolarHBondContact O-CG1 3.2Å; F372-I376 PolarHBondContact O-N 3.19Å; G373-I376 WeakPolarHBondContact O-CB 3.32Å; G373-I376 PolarHBondContact O-N 3.17Å; I376-F378 VanDerWaalsContact C-N 3.35Å; I376-F378 PolarHBondContact O-N 3.07Å; I376-I379 PolarHBondContact O-N 3.38Å; I376-L380 HydrophobicContact CG2-CD1 3.57Å; I376-L380 HydrophobicContact CG2-CG 4.13Å; I376-L380 WeakPolarHBondContact O-CB 3.31Å; I376-L380 VanDerWaalsContact O-CG 3.31Å; I376-L380 WeakPolarHBondContact O-CG 3.5Å; I376-L380 PolarHBondContact O-N 2.94Å
377M92.9Very high93.9Very high0 Ų031.9 Ų31.90%016%0.155CC..Hα-helixtrans-63.5-40179.7-167.3170.8-174.400112.2Y22 T29 F57 V60 G373 A374 G381Y22-M377 HydrophobicContact CD2-CB 3.9Å; Y22-M377 HydrophobicContact CD2-CE 4.25Å; Y22-M377 HydrophobicContact CD2-CG 3.66Å; Y22-M377 HydrophobicContact CD2-SD 3.68Å; Y22-M377 HydrophobicContact CE2-CB 4.29Å; Y22-M377 HydrophobicContact CE2-CE 4.15Å; Y22-M377 HydrophobicContact CE2-CG 3.73Å; Y22-M377 HydrophobicContact CE2-SD 4.08Å; T29-M377 HydrophobicContact CG2-CE 3.81Å; F57-M377 HydrophobicContact CB-CE 4.47Å; F57-M377 HydrophobicContact CB-CG 4.28Å; F57-M377 HydrophobicContact CD1-CE 3.59Å; F57-M377 HydrophobicContact CE1-CE 4.17Å; F57-M377 HydrophobicContact CG-CE 4.27Å; F57-M377 WeakPolarHBondContact O-CG 3.38Å; V60-M377 HydrophobicContact CB-CE 3.58Å; V60-M377 HydrophobicContact CB-SD 3.88Å; V60-M377 HydrophobicContact CG1-CE 3.46Å; V60-M377 VanDerWaalsContact CG1-CE 3.46Å; V60-M377 HydrophobicContact CG1-SD 3.4Å; V60-M377 WeakPolarHBondContact CG1-SD 3.34Å; V60-M377 HydrophobicContact CG2-CE 4.15Å; G373-M377 WeakPolarHBondContact O-CB 3.23Å; G373-M377 PolarHBondContact O-N 3.16Å; A374-M377 PolarHBondContact O-N 3.1Å; M377-G381 PolarHBondContact O-N 2.98Å
378F95.2Very high93.8Very high65 Ų6530.7 Ų30.729%0.28515%0.151SC..Hα-helixtrans-57.5-52.7172172.5-98.8000111.5T58 I62 M275 A374 G375 I376 G381 T382T58-F378 HydrophobicContact CG2-CD2 3.58Å; T58-F378 HydrophobicContact CG2-CE2 3.59Å; I62-F378 HydrophobicContact CD1-CD2 4.28Å; I62-F378 HydrophobicContact CD1-CE2 4.11Å; I62-F378 HydrophobicContact CG1-CD2 3.86Å; I62-F378 HydrophobicContact CG1-CE2 4.06Å; M275-F378 HydrophobicContact CE-CE2 3.85Å; M275-F378 HydrophobicContact CE-CZ 3.9Å; M275-F378 HydrophobicContact SD-CE2 4.37Å; M275-F378 HydrophobicContact SD-CZ 4.22Å; A374-F378 WeakPolarHBondContact O-CB 3.5Å; A374-F378 PolarHBondContact O-N 3.47Å; G375-F378 PolarHBondContact O-N 2.95Å; I376-F378 VanDerWaalsContact C-N 3.35Å; I376-F378 PolarHBondContact O-N 3.07Å; F378-G381 PolarHBondContact O-N 3.43Å; F378-T382 WeakPolarHBondContact O-CG2 3.25Å; F378-T382 PolarHBondContact O-N 3.43Å
379I94.9Very high93.6Very high102 Ų10228.4 Ų28.452%0.52315%0.148SC..Hα-helixtrans-61.8-50.4-179-67166.3000110.3G375 I376 G381 T382G375-I379 VanDerWaalsContact O-CG1 3.31Å; G375-I379 WeakPolarHBondContact O-CG1 3.43Å; G375-I379 PolarHBondContact O-N 3.35Å; I376-I379 PolarHBondContact O-N 3.38Å; I379-G381 VanDerWaalsContact C-N 3.3Å; I379-G381 PolarHBondContact O-N 3.14Å; I379-T382 PolarHBondContact O-N 3Å; I379-T382 VanDerWaalsContact O-N 3.08Å; I379-T382 PolarHBondContact O-OG1 3.31Å
380L92.8Very high93.3Very high41 Ų4129.6 Ų29.622%0.21515%0.153CC..Hα-helixtrans-65.3-32.8-177.3-70.8179.8000112.8Y22 I376 T382 V383 F386Y22-L380 HydrophobicContact CE1-CD1 4.14Å; I376-L380 HydrophobicContact CG2-CD1 3.57Å; I376-L380 HydrophobicContact CG2-CG 4.13Å; I376-L380 WeakPolarHBondContact O-CB 3.31Å; I376-L380 VanDerWaalsContact O-CG 3.31Å; I376-L380 WeakPolarHBondContact O-CG 3.5Å; I376-L380 PolarHBondContact O-N 2.94Å; L380-T382 PolarHBondContact O-N 2.91Å; L380-V383 PolarHBondContact O-N 3.38Å; L380-V383 VanDerWaalsContact O-N 3.14Å; L380-F386 HydrophobicContact CB-CD1 3.72Å; L380-F386 HydrophobicContact CB-CE1 3.53Å; L380-F386 HydrophobicContact CB-CG 4.44Å; L380-F386 HydrophobicContact CB-CZ 4.12Å; L380-F386 HydrophobicContact CD1-CE1 3.94Å; L380-F386 HydrophobicContact CD1-CE2 4.23Å; L380-F386 HydrophobicContact CD1-CZ 3.65Å; L380-F386 HydrophobicContact CD2-CD1 4.42Å; L380-F386 HydrophobicContact CD2-CD2 4.31Å; L380-F386 HydrophobicContact CD2-CE1 4.42Å; L380-F386 HydrophobicContact CD2-CE2 4.33Å; L380-F386 HydrophobicContact CD2-CG 4.34Å; L380-F386 HydrophobicContact CD2-CZ 4.35Å; L380-F386 HydrophobicContact CG-CD1 4.5Å; L380-F386 HydrophobicContact CG-CE1 4.17Å; L380-F386 HydrophobicContact CG-CZ 4.26Å; L380-F386 WeakPolarHBondContact O-CD1 3.26Å
381G92.9Very high93.1Very high3 Ų329.5 Ų29.53%0.03115%0.152CC..Hα-helixtrans-62.8-29.117300000113.6G54 T58 M377 F378 I379 V383G54-G381 CarbonylContact C-O 3.53Å; G54-G381 VanDerWaalsContact CA-O 3.22Å; G54-G381 WeakPolarHBondContact CA-O 3.39Å; T58-G381 VanDerWaalsContact OG1-C 3.32Å; M377-G381 PolarHBondContact O-N 2.98Å; F378-G381 PolarHBondContact O-N 3.43Å; I379-G381 VanDerWaalsContact C-N 3.3Å; I379-G381 PolarHBondContact O-N 3.14Å; G381-V383 VanDerWaalsContact C-N 3.33Å
382T94.6Very high92.8Very high22 Ų2229.3 Ų29.314%0.13515%0.154CC..THydrogen-bonded Turntrans-81-10.8175.968.10000114T58 F273 R274 M275 F378 I379 L380 G384T58-T382 HydrophobicContact CG2-CG2 4.15Å; F273-T382 CarbonylContact C-O 3.57Å; F273-T382 WeakPolarHBondContact CA-O 3.31Å; R274-T382 PolarHBondContact N-O 3.33Å; R274-T382 VanDerWaalsContact O-CA 3.28Å; R274-T382 WeakPolarHBondContact O-CA 3.18Å; M275-T382 HydrophobicContact SD-CG2 3.61Å; F378-T382 WeakPolarHBondContact O-CG2 3.25Å; F378-T382 PolarHBondContact O-N 3.43Å; I379-T382 PolarHBondContact O-N 3Å; I379-T382 VanDerWaalsContact O-N 3.08Å; I379-T382 PolarHBondContact O-OG1 3.31Å; L380-T382 PolarHBondContact O-N 2.91Å; T382-G384 PolarHBondContact O-N 2.97Å
383V95.9Very high92.7Very high29 Ų2925.7 Ų25.718%0.17614%0.138CC..BIsolated β-bridgetrans-90.699.8180-178.90000109.4W272 F273 L380 G381 K385 F386 T387W272-V383 CarbonylContact O-C 3.56Å; W272-V383 WeakPolarHBondContact O-CA 3.48Å; F273-V383 HydrophobicContact CE1-CG2 4.29Å; L380-V383 PolarHBondContact O-N 3.38Å; L380-V383 VanDerWaalsContact O-N 3.14Å; G381-V383 VanDerWaalsContact C-N 3.33Å; V383-K385 VanDerWaalsContact C-N 3.28Å; V383-K385 PolarHBondContact O-N 2.95Å; V383-F386 HydrophobicContact CB-CB 3.98Å; V383-F386 HydrophobicContact CG1-CB 3.93Å; V383-F386 WeakPolarHBondContact O-CA 3.44Å; V383-F386 VanDerWaalsContact O-CB 3.29Å; V383-F386 WeakPolarHBondContact O-CB 3.36Å; V383-F386 PolarHBondContact O-N 3.25Å; V383-T387 PolarHBondContact O-N 2.94Å
384G92.6Very high92.6Very high5 Ų525.7 Ų25.75%0.05214%0.138CC..Hα-helixtrans-64.9-26.9-172.400000114.6P271 W272 T382 F386 T387 A388P271-G384 CarbonylContact O-C 3.57Å; P271-G384 WeakPolarHBondContact O-CA 3.23Å; P271-G384 PolarHBondContact O-N 2.86Å; W272-G384 PolarHBondContact O-N 2.75Å; T382-G384 PolarHBondContact O-N 2.97Å; G384-F386 VanDerWaalsContact C-N 3.33Å; G384-T387 WeakPolarHBondContact CA-OG1 3.22Å; G384-T387 PolarHBondContact O-N 3.13Å; G384-T387 PolarHBondContact O-OG1 2.81Å; G384-A388 VanDerWaalsContact O-CB 3.25Å; G384-A388 WeakPolarHBondContact O-CB 3.39Å; G384-A388 PolarHBondContact O-N 3.21Å
385K92.2Very high92.4Very high38 Ų3826.3 Ų26.317%0.16514%0.141CC..Hα-helixtrans-66.5-35.9171.4-59.8-58.4-169.7-172.30112.1M267 A268 A270 P271 W272 V383 A388 L389M267-K385 WeakPolarHBondContact O-CD 3.16Å; M267-K385 WeakPolarHBondContact O-CE 3.4Å; M267-K385 PolarHBondContact O-NZ 3.28Å; M267-K385 HydrophobicContact SD-CB 4.1Å; M267-K385 HydrophobicContact SD-CD 4.08Å; A268-K385 PolarHBondContact O-NZ 2.94Å; A268-K385 VanDerWaalsContact O-NZ 3.08Å; A270-K385 HydrophobicContact CB-CD 4.32Å; A270-K385 WeakPolarHBondContact O-CE 3Å; A270-K385 PolarHBondContact O-NZ 3.37Å; P271-K385 PolarHBondContact O-N 2.97Å; W272-K385 HydrophobicContact CD2-CG 3.84Å; W272-K385 HydrophobicContact CE3-CG 3.81Å; W272-K385 HydrophobicContact CG-CG 4.35Å; W272-K385 HydrophobicContact CH2-CG 4.42Å; W272-K385 HydrophobicContact CZ2-CG 4.44Å; W272-K385 HydrophobicContact CZ3-CG 4.11Å; V383-K385 VanDerWaalsContact C-N 3.28Å; V383-K385 PolarHBondContact O-N 2.95Å; K385-A388 PolarHBondContact O-N 2.97Å; K385-L389 PolarHBondContact O-N 2.89Å; K385-L389 VanDerWaalsContact O-N 3.07Å
386F91.9Very high92.4Very high44 Ų4425.2 Ų25.219%0.19313%0.131CC..Hα-helixtrans-68.9-39.2176.9-179.2-103000111Y22 F57 L380 V383 G384 L389 F390Y22-F386 HydrophobicContact CE1-CZ 4.38Å; Y22-F386 VanDerWaalsContact OH-CE1 3.3Å; Y22-F386 WeakPolarHBondContact OH-CE1 3.2Å; Y22-F386 VanDerWaalsContact OH-CZ 3.32Å; Y22-F386 WeakPolarHBondContact OH-CZ 3.39Å; F57-F386 HydrophobicContact CD2-CE1 4.25Å; F57-F386 HydrophobicContact CE2-CE1 4.03Å; L380-F386 HydrophobicContact CB-CD1 3.72Å; L380-F386 HydrophobicContact CB-CE1 3.53Å; L380-F386 HydrophobicContact CB-CG 4.44Å; L380-F386 HydrophobicContact CB-CZ 4.12Å; L380-F386 HydrophobicContact CD1-CE1 3.94Å; L380-F386 HydrophobicContact CD1-CE2 4.23Å; L380-F386 HydrophobicContact CD1-CZ 3.65Å; L380-F386 HydrophobicContact CD2-CD1 4.42Å; L380-F386 HydrophobicContact CD2-CD2 4.31Å; L380-F386 HydrophobicContact CD2-CE1 4.42Å; L380-F386 HydrophobicContact CD2-CE2 4.33Å; L380-F386 HydrophobicContact CD2-CG 4.34Å; L380-F386 HydrophobicContact CD2-CZ 4.35Å; L380-F386 HydrophobicContact CG-CD1 4.5Å; L380-F386 HydrophobicContact CG-CE1 4.17Å; L380-F386 HydrophobicContact CG-CZ 4.26Å; L380-F386 WeakPolarHBondContact O-CD1 3.26Å; V383-F386 HydrophobicContact CB-CB 3.98Å; V383-F386 HydrophobicContact CG1-CB 3.93Å; V383-F386 WeakPolarHBondContact O-CA 3.44Å; V383-F386 VanDerWaalsContact O-CB 3.29Å; V383-F386 WeakPolarHBondContact O-CB 3.36Å; V383-F386 PolarHBondContact O-N 3.25Å; G384-F386 VanDerWaalsContact C-N 3.33Å; F386-L389 WeakPolarHBondContact O-CB 3.45Å; F386-L389 PolarHBondContact O-N 3.07Å; F386-F390 HydrophobicContact CD1-CD2 4.41Å; F386-F390 AromaticContact CD1-CE2 3.86Å; F386-F390 HydrophobicContact CD1-CE2 3.86Å; F386-F390 HydrophobicContact CD2-CE2 4.08Å; F386-F390 HydrophobicContact CE1-CD2 4.27Å; F386-F390 AromaticContact CE1-CE2 3.43Å; F386-F390 HydrophobicContact CE1-CE2 3.43Å; F386-F390 VanDerWaalsContact CE1-CE2 3.43Å; F386-F390 HydrophobicContact CE1-CZ 4.3Å; F386-F390 AromaticContact CE2-CE2 3.66Å; F386-F390 HydrophobicContact CE2-CE2 3.66Å; F386-F390 AromaticContact CE2-CZ 3.97Å; F386-F390 HydrophobicContact CE2-CZ 3.97Å; F386-F390 HydrophobicContact CG-CE2 4.19Å; F386-F390 AromaticContact CZ-CE2 3.34Å; F386-F390 HydrophobicContact CZ-CE2 3.34Å; F386-F390 AromaticContact CZ-CZ 3.77Å; F386-F390 HydrophobicContact CZ-CZ 3.77Å; F386-F390 WeakPolarHBondContact O-CD2 3.23Å
387T91.6Very high92.4Very high4 Ų423.8 Ų23.83%0.02512%0.123CC..Hα-helixtrans-72-35.217765.90000111.5S50 I53 V383 G384 L389 F390 A391S50-T387 WeakPolarHBondContact O-CB 3.31Å; S50-T387 PolarHBondContact O-OG1 3.43Å; S50-T387 VanDerWaalsContact OG-C 3.31Å; S50-T387 PolarHBondContact OG-OG1 3.34Å; I53-T387 HydrophobicContact CG2-CG2 4.33Å; V383-T387 PolarHBondContact O-N 2.94Å; G384-T387 WeakPolarHBondContact CA-OG1 3.22Å; G384-T387 PolarHBondContact O-N 3.13Å; G384-T387 PolarHBondContact O-OG1 2.81Å; T387-L389 VanDerWaalsContact C-N 3.32Å; T387-L389 PolarHBondContact O-N 3.46Å; T387-F390 PolarHBondContact O-N 2.74Å; T387-A391 PolarHBondContact O-N 3.28Å
388A90.9Very high92.4Very high0 Ų023.8 Ų23.80%012%0.123CC..Hα-helixtrans-62.8-37.3173.900000112.5S50 I266 M267 A270 G384 K385 F390 A391 S392S50-A388 WeakPolarHBondContact OG-CA 3.24Å; S50-A388 PolarHBondContact OG-N 2.94Å; I266-A388 HydrophobicContact CG2-CB 3.85Å; M267-A388 HydrophobicContact CE-CB 4.41Å; M267-A388 HydrophobicContact SD-CB 4.44Å; A270-A388 HydrophobicContact CB-CB 3.65Å; G384-A388 VanDerWaalsContact O-CB 3.25Å; G384-A388 WeakPolarHBondContact O-CB 3.39Å; G384-A388 PolarHBondContact O-N 3.21Å; K385-A388 PolarHBondContact O-N 2.97Å; A388-F390 VanDerWaalsContact C-N 3.27Å; A388-F390 PolarHBondContact O-N 2.85Å; A388-A391 PolarHBondContact O-N 2.03Å; A388-S392 PolarHBondContact O-N 3.32Å
389L90.1Very high92.3Very high77 Ų7720.7 Ų20.740%0.40311%0.11SC..Hα-helixtrans-55.2-44.7174.5-177.666.4000111.1M267 K385 F386 T387 S392M267-L389 HydrophobicContact CE-CB 3.97Å; M267-L389 HydrophobicContact CE-CD1 4.16Å; K385-L389 PolarHBondContact O-N 2.89Å; K385-L389 VanDerWaalsContact O-N 3.07Å; F386-L389 WeakPolarHBondContact O-CB 3.45Å; F386-L389 PolarHBondContact O-N 3.07Å; T387-L389 VanDerWaalsContact C-N 3.32Å; T387-L389 PolarHBondContact O-N 3.46Å; L389-S392 PolarHBondContact O-N 2.81Å; L389-S392 PolarHBondContact O-OG 2.92Å
390F88.1Confident92.2Very high25 Ų2515.9 Ų15.911%0.119%0.085CC..Hα-helixtrans-76.9-33.8179.4-62.6-62.6000113.5F26 F34 I53 F57 F386 T387 A388 S392 L393F26-F390 HydrophobicContact CD2-CE1 4.23Å; F26-F390 HydrophobicContact CD2-CZ 4.24Å; F26-F390 HydrophobicContact CE1-CD1 4.28Å; F26-F390 HydrophobicContact CE1-CE1 4.17Å; F26-F390 HydrophobicContact CE2-CB 4.47Å; F26-F390 AromaticContact CE2-CD1 3.29Å; F26-F390 HydrophobicContact CE2-CD1 3.29Å; F26-F390 AromaticContact CE2-CD2 3.87Å; F26-F390 HydrophobicContact CE2-CD2 3.87Å; F26-F390 AromaticContact CE2-CE1 3.2Å; F26-F390 HydrophobicContact CE2-CE1 3.2Å; F26-F390 AromaticContact CE2-CE2 3.84Å; F26-F390 HydrophobicContact CE2-CE2 3.84Å; F26-F390 AromaticContact CE2-CG 3.59Å; F26-F390 HydrophobicContact CE2-CG 3.59Å; F26-F390 AromaticContact CE2-CZ 3.49Å; F26-F390 HydrophobicContact CE2-CZ 3.49Å; F26-F390 VanDerWaalsContact CE2-CZ 3.49Å; F26-F390 HydrophobicContact CZ-CB 4.48Å; F26-F390 AromaticContact CZ-CD1 3.1Å; F26-F390 HydrophobicContact CZ-CD1 3.1Å; F26-F390 HydrophobicContact CZ-CD2 4.49Å; F26-F390 AromaticContact CZ-CE1 3.21Å; F26-F390 HydrophobicContact CZ-CE1 3.21Å; F26-F390 AromaticContact CZ-CG 3.78Å; F26-F390 HydrophobicContact CZ-CG 3.78Å; F26-F390 HydrophobicContact CZ-CZ 4.01Å; F34-F390 WeakPolarHBondContact CZ-O 3.42Å; I53-F390 HydrophobicContact CD1-CB 4.27Å; F57-F390 HydrophobicContact CE2-CD2 4.06Å; F57-F390 HydrophobicContact CE2-CE2 4.27Å; F386-F390 HydrophobicContact CD1-CD2 4.41Å; F386-F390 AromaticContact CD1-CE2 3.86Å; F386-F390 HydrophobicContact CD1-CE2 3.86Å; F386-F390 HydrophobicContact CD2-CE2 4.08Å; F386-F390 HydrophobicContact CE1-CD2 4.27Å; F386-F390 AromaticContact CE1-CE2 3.43Å; F386-F390 HydrophobicContact CE1-CE2 3.43Å; F386-F390 VanDerWaalsContact CE1-CE2 3.43Å; F386-F390 HydrophobicContact CE1-CZ 4.3Å; F386-F390 AromaticContact CE2-CE2 3.66Å; F386-F390 HydrophobicContact CE2-CE2 3.66Å; F386-F390 AromaticContact CE2-CZ 3.97Å; F386-F390 HydrophobicContact CE2-CZ 3.97Å; F386-F390 HydrophobicContact CG-CE2 4.19Å; F386-F390 AromaticContact CZ-CE2 3.34Å; F386-F390 HydrophobicContact CZ-CE2 3.34Å; F386-F390 AromaticContact CZ-CZ 3.77Å; F386-F390 HydrophobicContact CZ-CZ 3.77Å; F386-F390 WeakPolarHBondContact O-CD2 3.23Å; T387-F390 PolarHBondContact O-N 2.74Å; A388-F390 VanDerWaalsContact C-N 3.27Å; A388-F390 PolarHBondContact O-N 2.85Å; F390-S392 PolarHBondContact O-N 3.12Å; F390-L393 HydrophobicContact CD1-CD1 4.21Å; F390-L393 WeakPolarHBondContact O-CB 3.24Å; F390-L393 WeakPolarHBondContact O-CG 3.49Å; F390-L393 PolarHBondContact O-N 2.81Å; F390-L393 VanDerWaalsContact O-N 3.15Å
391A89.3Confident92.1Very high0 Ų014 Ų140%08%0.075CC..Hα-helixtrans-61.7-21.7170.900000112.5Q46 I53 R263 T387 A388 L393Q46-A391 PolarHBondContact OE1-O 3.1Å; I53-A391 HydrophobicContact CD1-CB 4.14Å; R263-A391 WeakPolarHBondContact CD-O 3.33Å; R263-A391 PolarHBondContact NH1-O 3.38Å; T387-A391 PolarHBondContact O-N 3.28Å; A388-A391 PolarHBondContact O-N 2.03Å; A391-L393 VanDerWaalsContact C-N 3.34Å
392S89.6Confident92Very high23 Ų2313.9 Ų13.916%0.1617%0.074CC..THydrogen-bonded Turntrans-84.6-1177.578.60000114.6A388 L389 F390 P394A388-S392 PolarHBondContact O-N 3.32Å; L389-S392 PolarHBondContact O-N 2.81Å; L389-S392 PolarHBondContact O-OG 2.92Å; F390-S392 PolarHBondContact O-N 3.12Å; S392-P394 WeakPolarHBondContact O-CD 3.34Å
393L91.4Very high91.9Very high8 Ų815 Ų154%0.0428%0.082CC..  trans-62.2127.1-179.8-74.6175.8000111.3I231 R263 F390 A391 L398I231-L393 HydrophobicContact CG2-CD2 3.77Å; R263-L393 PolarHBondContact NE-O 2.72Å; R263-L393 PolarHBondContact NH2-O 3.4Å; F390-L393 HydrophobicContact CD1-CD1 4.21Å; F390-L393 WeakPolarHBondContact O-CB 3.24Å; F390-L393 WeakPolarHBondContact O-CG 3.49Å; F390-L393 PolarHBondContact O-N 2.81Å; F390-L393 VanDerWaalsContact O-N 3.15Å; A391-L393 VanDerWaalsContact C-N 3.34Å; L393-L398 HydrophobicContact CB-CD2 4Å; L393-L398 HydrophobicContact CB-CG 4.21Å; L393-L398 HydrophobicContact CD1-CD2 4Å
394P92.8Very high91.5Very high1 Ų115.1 Ų15.11%0.0068%0.083CC..  trans-59.8147.1174.4-24.833.1000113.3C238 T260 S392 P396 I397 L398C238-P394 HydrophobicContact CB-CG 4.37Å; T260-P394 HydrophobicContact CG2-CG 4.24Å; S392-P394 WeakPolarHBondContact O-CD 3.34Å; P394-P396 VanDerWaalsContact C-CD 3.45Å; P394-I397 HydrophobicContact CB-CG1 4.38Å; P394-I397 HydrophobicContact CG-CD1 4.22Å; P394-I397 WeakPolarHBondContact O-CB 3.17Å; P394-I397 PolarHBondContact O-N 3.43Å; P394-I397 VanDerWaalsContact O-N 3.09Å; P394-L398 PolarHBondContact O-N 2.86Å
395D91.4Very high91.3Very high12 Ų1215.4 Ų15.46%0.0648%0.083CC..Hα-helixtrans-55.5-42-178.5-7429.3000114.1R176 A179 K257 R263 I397 L398 G399R176-D395 WeakPolarHBondContact CD-OD2 3.23Å; R176-D395 IonicContact CZ-OD2 3.46Å; R176-D395 IonicContact NE-OD2 3.1Å; R176-D395 IonicContact NH1-OD1 2.62Å; R176-D395 PolarHBondContact NH1-OD1 2.92Å; R176-D395 VanDerWaalsContact NH1-OD1 3.1Å; R176-D395 IonicContact NH1-OD2 3.66Å; R176-D395 PolarHBondContact NH1-OD2 3.19Å; A179-D395 HydrophobicContact CB-CB 3.76Å; K257-D395 HydrophobicContact CB-CB 4.13Å; K257-D395 PolarHBondContact O-N 2.93Å; R263-D395 IonicContact CZ-OD1 3.82Å; R263-D395 IonicContact NE-OD1 2.77Å; R263-D395 IonicContact NH2-OD1 3.62Å; R263-D395 PolarHBondContact NH2-OD1 3.25Å; D395-I397 PolarHBondContact O-N 3.39Å; D395-L398 WeakPolarHBondContact O-CB 3.44Å; D395-L398 PolarHBondContact O-N 3.49Å; D395-L398 VanDerWaalsContact O-N 3.13Å; D395-G399 PolarHBondContact O-N 3.03Å
396P94.5Very high91Very high0 Ų014 Ų140%08%0.077CC..Hα-helixtrans-60.7-32.8178.5-24.835.4000113.4A179 H180 L183 S184 K257 P394 G400A179-P396 HydrophobicContact CB-CG 4.14Å; H180-P396 HydrophobicContact CB-CB 4.12Å; H180-P396 HydrophobicContact CB-CG 3.56Å; L183-P396 HydrophobicContact CB-CB 3.75Å; L183-P396 HydrophobicContact CB-CG 4.47Å; L183-P396 HydrophobicContact CD1-CG 4.43Å; S184-P396 WeakPolarHBondContact CA-O 3.19Å; S184-P396 VanDerWaalsContact OG-CA 3.32Å; S184-P396 WeakPolarHBondContact OG-CA 3.43Å; S184-P396 WeakPolarHBondContact OG-CB 3.34Å; S184-P396 PolarHBondContact OG-O 2.94Å; K257-P396 WeakPolarHBondContact O-CD 3.35Å; P394-P396 VanDerWaalsContact C-CD 3.45Å; P396-G400 PolarHBondContact O-N 3.2Å
397I95.1Very high90.9Very high1 Ų113.9 Ų13.91%0.0059%0.088CC..Hα-helixtrans-70.4-44.1176.8-55.8-171.2000110I231 V234 W235 P394 D395 G400 M401I231-I397 HydrophobicContact CB-CG2 4.24Å; I231-I397 HydrophobicContact CG1-CG2 3.91Å; I231-I397 HydrophobicContact CG2-CG2 3.99Å; V234-I397 HydrophobicContact CB-CD1 4.2Å; V234-I397 HydrophobicContact CB-CG1 4.33Å; V234-I397 HydrophobicContact CG1-CD1 4.01Å; V234-I397 HydrophobicContact CG1-CG1 3.79Å; W235-I397 HydrophobicContact CB-CD1 3.8Å; P394-I397 HydrophobicContact CB-CG1 4.38Å; P394-I397 HydrophobicContact CG-CD1 4.22Å; P394-I397 WeakPolarHBondContact O-CB 3.17Å; P394-I397 PolarHBondContact O-N 3.43Å; P394-I397 VanDerWaalsContact O-N 3.09Å; D395-I397 PolarHBondContact O-N 3.39Å; I397-G400 PolarHBondContact O-N 3.05Å; I397-M401 WeakPolarHBondContact O-CB 3.03Å; I397-M401 PolarHBondContact O-N 3.19Å
398L92.3Very high90.5Very high0 Ų018.9 Ų18.90%011%0.113CC..Hα-helixtrans-61.2-44.4175.7-63.1175.2000111F34 L393 P394 D395 M401 F402F34-L398 HydrophobicContact CD1-CD1 4.03Å; F34-L398 HydrophobicContact CD2-CD1 3.74Å; F34-L398 HydrophobicContact CD2-CD2 3.88Å; F34-L398 HydrophobicContact CD2-CG 4.46Å; F34-L398 HydrophobicContact CE1-CD1 3.99Å; F34-L398 HydrophobicContact CE2-CD1 3.64Å; F34-L398 HydrophobicContact CE2-CD2 3.6Å; F34-L398 HydrophobicContact CE2-CG 4.29Å; F34-L398 HydrophobicContact CG-CD1 3.93Å; F34-L398 HydrophobicContact CZ-CD1 3.77Å; F34-L398 HydrophobicContact CZ-CD2 4.37Å; L393-L398 HydrophobicContact CB-CD2 4Å; L393-L398 HydrophobicContact CB-CG 4.21Å; L393-L398 HydrophobicContact CD1-CD2 4Å; P394-L398 PolarHBondContact O-N 2.86Å; D395-L398 WeakPolarHBondContact O-CB 3.44Å; D395-L398 PolarHBondContact O-N 3.49Å; D395-L398 VanDerWaalsContact O-N 3.13Å; L398-M401 HydrophobicContact CD2-CE 3.8Å; L398-M401 PolarHBondContact O-N 3.33Å; L398-F402 HydrophobicContact CB-CE2 4.31Å; L398-F402 HydrophobicContact CB-CZ 4.21Å; L398-F402 WeakPolarHBondContact O-CB 3.38Å; L398-F402 WeakPolarHBondContact O-CD1 3.43Å; L398-F402 WeakPolarHBondContact O-CG 3.27Å; L398-F402 PolarHBondContact O-N 3.4Å
399G92.6Very high90.1Very high0 Ų019.8 Ų19.80%012%0.117CC..Hα-helixtrans-59.9-48.5175.700000112.8D395 M401 F402 C403D395-G399 PolarHBondContact O-N 3.03Å; G399-M401 VanDerWaalsContact C-N 3.32Å; G399-M401 PolarHBondContact O-N 3.31Å; G399-F402 PolarHBondContact O-N 3.11Å; G399-C403 PolarHBondContact O-N 3.23Å; G399-C403 PolarHBondContact O-SG 2.98Å
400G93.3Very high90.1Very high0 Ų016.9 Ų16.90%010%0.103CC..Hα-helixtrans-57-44.1174.700000113.1P396 I397 T404P396-G400 PolarHBondContact O-N 3.2Å; I397-G400 PolarHBondContact O-N 3.05Å; G400-T404 PolarHBondContact O-N 3.08Å; G400-T404 PolarHBondContact O-OG1 2.83Å
401M91.4Very high90Very high2 Ų218.2 Ų18.21%0.0112%0.118CC..Hα-helixtrans-64-47.1175.7-178.917870.600112F26 S27 I231 I397 L398 G399 T404 L405F26-M401 HydrophobicContact CE1-SD 4.48Å; S27-M401 WeakPolarHBondContact CB-SD 3.05Å; I231-M401 HydrophobicContact CD1-SD 3.74Å; I397-M401 WeakPolarHBondContact O-CB 3.03Å; I397-M401 PolarHBondContact O-N 3.19Å; L398-M401 HydrophobicContact CD2-CE 3.8Å; L398-M401 PolarHBondContact O-N 3.33Å; G399-M401 VanDerWaalsContact C-N 3.32Å; G399-M401 PolarHBondContact O-N 3.31Å; M401-T404 PolarHBondContact O-N 3.37Å; M401-T404 PolarHBondContact O-OG1 3.01Å; M401-L405 WeakPolarHBondContact O-CB 3.46Å; M401-L405 PolarHBondContact O-N 2.64Å
402F90.6Very high89.5Confident0 Ų020.4 Ų20.40%013%0.132CC..Hα-helixtrans-62.8-44.1-178.6-69.1-6.8000112.2A31 F34 L35 A173 L398 G399 T404 L405 F406A31-F402 VanDerWaalsContact CA-CE1 3.45Å; A31-F402 HydrophobicContact CB-CD1 3.87Å; A31-F402 HydrophobicContact CB-CE1 3.23Å; A31-F402 HydrophobicContact CB-CZ 3.76Å; F34-F402 HydrophobicContact CB-CZ 4.34Å; L35-F402 HydrophobicContact CD2-CE2 4.08Å; L35-F402 HydrophobicContact CG-CE2 4.38Å; A173-F402 HydrophobicContact CB-CB 3.81Å; L398-F402 HydrophobicContact CB-CE2 4.31Å; L398-F402 HydrophobicContact CB-CZ 4.21Å; L398-F402 WeakPolarHBondContact O-CB 3.38Å; L398-F402 WeakPolarHBondContact O-CD1 3.43Å; L398-F402 WeakPolarHBondContact O-CG 3.27Å; L398-F402 PolarHBondContact O-N 3.4Å; G399-F402 PolarHBondContact O-N 3.11Å; F402-T404 VanDerWaalsContact C-N 3.32Å; F402-T404 PolarHBondContact O-N 2.97Å; F402-L405 PolarHBondContact O-N 2.84Å; F402-F406 HydrophobicContact CB-CD2 4.09Å; F402-F406 HydrophobicContact CB-CE2 3.66Å; F402-F406 HydrophobicContact CB-CZ 4.18Å; F402-F406 HydrophobicContact CD2-CE2 4.43Å; F402-F406 HydrophobicContact CG-CE2 4.1Å; F402-F406 HydrophobicContact CG-CZ 4.21Å; F402-F406 WeakPolarHBondContact O-CB 3.41Å; F402-F406 VanDerWaalsContact O-CD2 3.31Å; F402-F406 WeakPolarHBondContact O-CD2 3.47Å; F402-F406 VanDerWaalsContact O-CG 3.28Å; F402-F406 WeakPolarHBondContact O-CG 3.27Å; F402-F406 PolarHBondContact O-N 3.15Å
403C91.9Very high89.3Confident46 Ų4619.3 Ų19.331%0.31112%0.124SC..Hα-helixtrans-58.4-43.7176.7-67.20000112.1M188 G399 G407M188-C403 HydrophobicContact CE-CB 3.59Å; M188-C403 WeakPolarHBondContact CE-SG 3.16Å; M188-C403 HydrophobicContact SD-CB 4.12Å; G399-C403 PolarHBondContact O-N 3.23Å; G399-C403 PolarHBondContact O-SG 2.98Å; C403-G407 PolarHBondContact O-N 2.93Å
404T89.1Confident89.2Confident31 Ų3122.3 Ų22.319%0.1914%0.14CC..Hα-helixtrans-70.6-38177.962.20000112.7M188 I191 G400 M401 F402 M408M188-T404 HydrophobicContact CB-CG2 4.38Å; M188-T404 HydrophobicContact CG-CG2 4.25Å; I191-T404 HydrophobicContact CB-CG2 4.28Å; I191-T404 HydrophobicContact CD1-CG2 4.17Å; I191-T404 HydrophobicContact CG2-CG2 3.98Å; G400-T404 PolarHBondContact O-N 3.08Å; G400-T404 PolarHBondContact O-OG1 2.83Å; M401-T404 PolarHBondContact O-N 3.37Å; M401-T404 PolarHBondContact O-OG1 3.01Å; F402-T404 VanDerWaalsContact C-N 3.32Å; F402-T404 PolarHBondContact O-N 2.97Å; T404-M408 WeakPolarHBondContact O-CG 3.43Å; T404-M408 PolarHBondContact O-N 2.93Å; T404-M408 VanDerWaalsContact O-N 3.14Å
405L86.4Confident88.8Confident11 Ų1124.5 Ų24.56%0.05816%0.155CC..Hα-helixtrans-67.1-52.4179.7176.468000111.8F82 M401 F402 G407 M408 I409F82-L405 HydrophobicContact CE2-CD2 4.15Å; F82-L405 HydrophobicContact CZ-CD2 3.82Å; M401-L405 WeakPolarHBondContact O-CB 3.46Å; M401-L405 PolarHBondContact O-N 2.64Å; F402-L405 PolarHBondContact O-N 2.84Å; L405-G407 VanDerWaalsContact C-N 3.31Å; L405-G407 PolarHBondContact O-N 3.41Å; L405-M408 WeakPolarHBondContact O-CB 3.39Å; L405-M408 PolarHBondContact O-N 3.48Å; L405-M408 VanDerWaalsContact O-N 3.13Å; L405-I409 HydrophobicContact CD1-CD1 4.21Å; L405-I409 HydrophobicContact CG-CD1 4.04Å; L405-I409 WeakPolarHBondContact O-CG1 3.2Å; L405-I409 PolarHBondContact O-N 3.41Å
406F87.1Confident88.4Confident8 Ų825.5 Ų25.54%0.03516%0.16CC..Hα-helixtrans-66.6-34.7-177.8-61.3-29.1000112L35 F82 V169 A173 F402 I409 T410L35-F406 HydrophobicContact CD1-CZ 4.08Å; F82-F406 HydrophobicContact CD1-CE1 4.32Å; F82-F406 AromaticContact CE1-CE1 3.83Å; F82-F406 HydrophobicContact CE1-CE1 3.83Å; F82-F406 HydrophobicContact CE1-CZ 4.38Å; F82-F406 HydrophobicContact CZ-CE1 4.02Å; V169-F406 HydrophobicContact CB-CD2 3.88Å; V169-F406 HydrophobicContact CB-CE1 4.23Å; V169-F406 HydrophobicContact CB-CE2 3.51Å; V169-F406 HydrophobicContact CB-CG 4.4Å; V169-F406 HydrophobicContact CB-CZ 3.72Å; V169-F406 HydrophobicContact CG1-CD2 4.24Å; V169-F406 HydrophobicContact CG1-CE1 4.35Å; V169-F406 HydrophobicContact CG1-CE2 3.38Å; V169-F406 HydrophobicContact CG1-CZ 3.46Å; V169-F406 VanDerWaalsContact CG1-CZ 3.46Å; V169-F406 HydrophobicContact CG2-CE1 4.49Å; V169-F406 HydrophobicContact CG2-CZ 4.35Å; A173-F406 HydrophobicContact CB-CD2 3.87Å; A173-F406 HydrophobicContact CB-CE2 3.97Å; F402-F406 HydrophobicContact CB-CD2 4.09Å; F402-F406 HydrophobicContact CB-CE2 3.66Å; F402-F406 HydrophobicContact CB-CZ 4.18Å; F402-F406 HydrophobicContact CD2-CE2 4.43Å; F402-F406 HydrophobicContact CG-CE2 4.1Å; F402-F406 HydrophobicContact CG-CZ 4.21Å; F402-F406 WeakPolarHBondContact O-CB 3.41Å; F402-F406 VanDerWaalsContact O-CD2 3.31Å; F402-F406 WeakPolarHBondContact O-CD2 3.47Å; F402-F406 VanDerWaalsContact O-CG 3.28Å; F402-F406 WeakPolarHBondContact O-CG 3.27Å; F402-F406 PolarHBondContact O-N 3.15Å; F406-I409 HydrophobicContact CD1-CD1 4.3Å; F406-I409 PolarHBondContact O-N 2.89Å; F406-T410 WeakPolarHBondContact O-CB 3.39Å; F406-T410 PolarHBondContact O-N 2.88Å; F406-T410 PolarHBondContact O-OG1 3.41Å
407G88.8Confident88.1Confident42 Ų4226.5 Ų26.543%0.43317%0.166SC..Hα-helixtrans-60.5-43.817000000112.6C403 L405 T410 A411C403-G407 PolarHBondContact O-N 2.93Å; L405-G407 VanDerWaalsContact C-N 3.31Å; L405-G407 PolarHBondContact O-N 3.41Å; G407-T410 PolarHBondContact O-N 2.98Å; G407-A411 WeakPolarHBondContact O-CB 3.17Å; G407-A411 PolarHBondContact O-N 3.27Å
408M83.1Confident87.7Confident110 Ų11033.7 Ų33.754%0.54220%0.199SC..Hα-helixtrans-66-41.9175.9-76.9-66-58.700112.8T404 L405 T410 A411 V412T404-M408 WeakPolarHBondContact O-CG 3.43Å; T404-M408 PolarHBondContact O-N 2.93Å; T404-M408 VanDerWaalsContact O-N 3.14Å; L405-M408 WeakPolarHBondContact O-CB 3.39Å; L405-M408 PolarHBondContact O-N 3.48Å; L405-M408 VanDerWaalsContact O-N 3.13Å; M408-T410 VanDerWaalsContact C-N 3.34Å; M408-A411 PolarHBondContact O-N 3.03Å; M408-V412 WeakPolarHBondContact O-CG2 3.49Å; M408-V412 PolarHBondContact O-N 3.43Å
409I82.8Confident87.3Confident19 Ų1935.1 Ų35.110%0.09721%0.207CC..Hα-helixtrans-60-46.9176.1-68.2170.9000110.2F82 I165 L405 F406 A411 V412 G413F82-I409 HydrophobicContact CD2-CD1 3.96Å; F82-I409 HydrophobicContact CE2-CD1 3.94Å; I165-I409 HydrophobicContact CG2-CG2 4.48Å; L405-I409 HydrophobicContact CD1-CD1 4.21Å; L405-I409 HydrophobicContact CG-CD1 4.04Å; L405-I409 WeakPolarHBondContact O-CG1 3.2Å; L405-I409 PolarHBondContact O-N 3.41Å; F406-I409 HydrophobicContact CD1-CD1 4.3Å; F406-I409 PolarHBondContact O-N 2.89Å; I409-A411 VanDerWaalsContact C-N 3.34Å; I409-A411 PolarHBondContact O-N 3.18Å; I409-V412 PolarHBondContact O-N 3.45Å; I409-G413 PolarHBondContact O-N 2.91Å
410T89.9Confident87.3Confident16 Ų1635.8 Ų35.810%0.09821%0.211CC..Hα-helixtrans-57.2-47175.8-54.60000111.3L167 F406 G407 M408 V412 G413 L414L167-T410 HydrophobicContact CD1-CG2 4.06Å; L167-T410 HydrophobicContact CD2-CG2 3.99Å; L167-T410 HydrophobicContact CG-CG2 3.73Å; F406-T410 WeakPolarHBondContact O-CB 3.39Å; F406-T410 PolarHBondContact O-N 2.88Å; F406-T410 PolarHBondContact O-OG1 3.41Å; G407-T410 PolarHBondContact O-N 2.98Å; M408-T410 VanDerWaalsContact C-N 3.34Å; T410-V412 PolarHBondContact O-N 3.47Å; T410-G413 PolarHBondContact O-N 3.44Å; T410-L414 HydrophobicContact CG2-CD1 4.32Å; T410-L414 WeakPolarHBondContact O-CG 3.27Å; T410-L414 PolarHBondContact O-N 3.25Å
411A86.8Confident87.2Confident52 Ų5238.9 Ų38.943%0.4323%0.227SC..Hα-helixtrans-64.5-36.1179.400000113.2G407 M408 I409 L414 S415G407-A411 WeakPolarHBondContact O-CB 3.17Å; G407-A411 PolarHBondContact O-N 3.27Å; M408-A411 PolarHBondContact O-N 3.03Å; I409-A411 VanDerWaalsContact C-N 3.34Å; I409-A411 PolarHBondContact O-N 3.18Å; A411-L414 PolarHBondContact O-N 3.48Å; A411-S415 PolarHBondContact O-N 3.14Å
412V79.3Confident87.3Confident47 Ų4742 Ų4229%0.28524%0.244SC..Hα-helixtrans-65.3-43.3174.61700000110.7M408 I409 T410 L414 S415M408-V412 WeakPolarHBondContact O-CG2 3.49Å; M408-V412 PolarHBondContact O-N 3.43Å; I409-V412 PolarHBondContact O-N 3.45Å; T410-V412 PolarHBondContact O-N 3.47Å; V412-L414 VanDerWaalsContact C-N 3.34Å; V412-L414 PolarHBondContact O-N 3.28Å; V412-S415 WeakPolarHBondContact O-CB 3.26Å; V412-S415 PolarHBondContact O-N 3.04Å; V412-S415 VanDerWaalsContact O-N 3.12Å; V412-S415 PolarHBondContact O-OG 3.16Å
413G84.1Confident87.5Confident0 Ų049.2 Ų49.20%028%0.282CS..Hα-helixtrans-55.7-48.7173.500000112.2T159 I409 T410 S415 N416T159-G413 PolarHBondContact OG1-O 3.04Å; I409-G413 PolarHBondContact O-N 2.91Å; T410-G413 PolarHBondContact O-N 3.44Å; G413-S415 VanDerWaalsContact C-N 3.27Å; G413-S415 PolarHBondContact O-N 3.47Å; G413-N416 PolarHBondContact O-N 3.42Å; G413-N416 PolarHBondContact O-ND2 3Å
414L90.2Very high87.6Confident70 Ų7047.9 Ų47.937%0.36627%0.273SS..Hα-helixtrans-65.3-24.4177.1-66.8174.8000113.9T159 S163 T410 A411 V412 N416 L417 M435T159-L414 HydrophobicContact CG2-CD2 3.88Å; S163-L414 PolarHBondContact OG-N 2.95Å; T410-L414 HydrophobicContact CG2-CD1 4.32Å; T410-L414 WeakPolarHBondContact O-CG 3.27Å; T410-L414 PolarHBondContact O-N 3.25Å; A411-L414 PolarHBondContact O-N 3.48Å; V412-L414 VanDerWaalsContact C-N 3.34Å; V412-L414 PolarHBondContact O-N 3.28Å; L414-N416 PolarHBondContact O-N 3.35Å; L414-L417 HydrophobicContact CD2-CD1 4.04Å; L414-L417 VanDerWaalsContact O-CB 3.26Å; L414-L417 WeakPolarHBondContact O-CB 3.45Å; L414-L417 VanDerWaalsContact O-CG 3.31Å; L414-L417 WeakPolarHBondContact O-CG 3.46Å; L414-L417 PolarHBondContact O-N 3.11Å; L414-M435 HydrophobicContact CD2-CE 4.45Å
415S83.7Confident87.9Confident48 Ų4851.1 Ų51.134%0.33630%0.297SS..Hα-helixtrans-64.3-22.2-178.877.40000113.4A411 V412 G413 L417 Q418A411-S415 PolarHBondContact O-N 3.14Å; V412-S415 WeakPolarHBondContact O-CB 3.26Å; V412-S415 PolarHBondContact O-N 3.04Å; V412-S415 VanDerWaalsContact O-N 3.12Å; V412-S415 PolarHBondContact O-OG 3.16Å; G413-S415 VanDerWaalsContact C-N 3.27Å; G413-S415 PolarHBondContact O-N 3.47Å; S415-L417 PolarHBondContact O-N 3.32Å; S415-Q418 VanDerWaalsContact O-CB 3.31Å; S415-Q418 WeakPolarHBondContact O-CB 3.14Å; S415-Q418 WeakPolarHBondContact O-CG 3.43Å; S415-Q418 PolarHBondContact O-N 3.15Å; S415-Q418 VanDerWaalsContact O-N 3.14Å
416N82.6Confident88.3Confident32 Ų3251.6 Ų51.617%0.17130%0.298CS..G310 helixtrans-65.3-20.1174.8-69.7-47000112.9P155 G413 L414 Q418 L419P155-N416 HydrophobicContact CB-CB 4.3Å; P155-N416 WeakPolarHBondContact CB-O 3.19Å; G413-N416 PolarHBondContact O-N 3.42Å; G413-N416 PolarHBondContact O-ND2 3Å; L414-N416 PolarHBondContact O-N 3.35Å; N416-Q418 PolarHBondContact O-N 2.98Å; N416-Q418 VanDerWaalsContact O-N 3.17Å; N416-L419 PolarHBondContact O-N 3.37Å
417L89.1Confident88.7Confident21 Ų2151.2 Ų51.211%0.1130%0.297CS..G310 helixtrans-64.9-14.7173.9-61175.8000113.2T159 L414 S415 L419 V420 L422 L431T159-L417 HydrophobicContact CG2-CD1 4.02Å; T159-L417 HydrophobicContact CG2-CD2 3.81Å; T159-L417 HydrophobicContact CG2-CG 3.75Å; L414-L417 HydrophobicContact CD2-CD1 4.04Å; L414-L417 VanDerWaalsContact O-CB 3.26Å; L414-L417 WeakPolarHBondContact O-CB 3.45Å; L414-L417 VanDerWaalsContact O-CG 3.31Å; L414-L417 WeakPolarHBondContact O-CG 3.46Å; L414-L417 PolarHBondContact O-N 3.11Å; S415-L417 PolarHBondContact O-N 3.32Å; L417-L419 PolarHBondContact O-N 3.21Å; L417-L419 VanDerWaalsContact O-N 3.1Å; L417-V420 HydrophobicContact CD2-CG2 4.46Å; L417-V420 PolarHBondContact O-N 2.74Å; L417-L422 HydrophobicContact CB-CD1 4.28Å; L417-L422 HydrophobicContact CB-CD2 4.49Å; L417-L422 HydrophobicContact CD2-CD2 4.34Å; L417-L431 HydrophobicContact CD1-CD1 4.37Å; L417-L431 HydrophobicContact CD1-CD2 3.58Å; L417-L431 HydrophobicContact CD2-CD1 4.1Å; L417-L431 HydrophobicContact CD2-CD2 3.87Å; L417-L431 HydrophobicContact CG-CD2 4.38Å
418Q86.9Confident89Confident153 Ų15353.4 Ų53.472%0.71530%0.298SS*.G310 helixtrans-59.9-18.5172.7-69.1176.9-2.200113.3S415 N416S415-Q418 VanDerWaalsContact O-CB 3.31Å; S415-Q418 WeakPolarHBondContact O-CB 3.14Å; S415-Q418 WeakPolarHBondContact O-CG 3.43Å; S415-Q418 PolarHBondContact O-N 3.15Å; S415-Q418 VanDerWaalsContact O-N 3.14Å; N416-Q418 PolarHBondContact O-N 2.98Å; N416-Q418 VanDerWaalsContact O-N 3.17Å
419L84.4Confident89.6Confident30 Ų3053.7 Ų53.716%0.15730%0.296CS..G310 helixtrans-93.9-11.7177.6-56.3177.9000112.8P155 N416 L417 G493 Q496 W497P155-L419 HydrophobicContact CB-CB 4.3Å; P155-L419 HydrophobicContact CB-CD1 4.47Å; P155-L419 HydrophobicContact CG-CB 3.97Å; P155-L419 HydrophobicContact CG-CD1 3.88Å; N416-L419 PolarHBondContact O-N 3.37Å; L417-L419 PolarHBondContact O-N 3.21Å; L417-L419 VanDerWaalsContact O-N 3.1Å; L419-G493 WeakPolarHBondContact O-CA 3.4Å; L419-Q496 HydrophobicContact CD2-CB 4.22Å; L419-Q496 VanDerWaalsContact CD2-CD 3.49Å; L419-Q496 HydrophobicContact CD2-CG 3.78Å; L419-W497 HydrophobicContact CD1-CE3 3.67Å; L419-W497 HydrophobicContact CD1-CZ3 4.29Å
420V90.9Very high90.3Very high13 Ų1352.8 Ų52.88%0.07929%0.292CS..SBendtrans-104.5142.6-171-176.70000110P155 L156 L417 L422 N427P155-V420 HydrophobicContact CB-CG2 3.74Å; P155-V420 HydrophobicContact CG-CG2 4.49Å; L156-V420 HydrophobicContact CB-CG2 4.42Å; L156-V420 HydrophobicContact CD1-CG1 4.37Å; L417-V420 HydrophobicContact CD2-CG2 4.46Å; L417-V420 PolarHBondContact O-N 2.74Å; V420-L422 PolarHBondContact O-N 2.86Å; V420-L422 VanDerWaalsContact O-N 3.16Å; V420-N427 HydrophobicContact CG1-CB 4.12Å; V420-N427 WeakPolarHBondContact CG1-ND2 3.4Å
421D93Very high90.6Very high65 Ų6553 Ų5335%0.34829%0.292SS..  trans-75.9103.7171.4-176.614.3000110.9N423 N427 E491D421-N423 VanDerWaalsContact C-N 3.27Å; D421-N423 PolarHBondContact O-N 3.41Å; D421-N423 WeakPolarHBondContact OD1-CB 3.25Å; D421-N423 PolarHBondContact OD1-N 3.44Å; D421-N423 PolarHBondContact OD1-ND2 2.93Å; D421-N427 PolarHBondContact O-ND2 3Å; D421-E491 HydrophobicContact CB-CB 4.31Å; D421-E491 PolarHBondContact N-O 3.45Å
422L93.4Very high91.1Very high69 Ų6952.4 Ų52.436%0.36129%0.291SS..THydrogen-bonded Turntrans-80.8-1178.1-66.2177.2000113.7L417 V420 S424 L428 L431L417-L422 HydrophobicContact CB-CD1 4.28Å; L417-L422 HydrophobicContact CB-CD2 4.49Å; L417-L422 HydrophobicContact CD2-CD2 4.34Å; V420-L422 PolarHBondContact O-N 2.86Å; V420-L422 VanDerWaalsContact O-N 3.16Å; L422-S424 VanDerWaalsContact C-N 3.33Å; L422-L428 HydrophobicContact CB-CD2 4.48Å; L422-L428 HydrophobicContact CD2-CD2 4.27Å; L422-L428 WeakPolarHBondContact O-CD1 3.3Å; L422-L428 WeakPolarHBondContact O-CG 3.25Å; L422-L431 HydrophobicContact CD2-CD2 4.27Å
423N94.1Very high92Very high150 Ų15054.1 Ų54.180%0.80230%0.295SS*.THydrogen-bonded Turntrans-81.3-18.2171-57.5-66.5000112.1D421 S425D421-N423 VanDerWaalsContact C-N 3.27Å; D421-N423 PolarHBondContact O-N 3.41Å; D421-N423 WeakPolarHBondContact OD1-CB 3.25Å; D421-N423 PolarHBondContact OD1-N 3.44Å; D421-N423 PolarHBondContact OD1-ND2 2.93Å; N423-S425 PolarHBondContact O-N 3.22Å
424S94.3Very high92.6Very high18 Ų1854.1 Ų54.113%0.12630%0.295CS..  trans-73.2120.2177.2-1770000110.6L422 R426 N427 L428 E491L422-S424 VanDerWaalsContact C-N 3.33Å; S424-R426 PolarHBondContact O-N 2.8Å; S424-N427 PolarHBondContact O-N 3.27Å; S424-N427 VanDerWaalsContact O-N 3.14Å; S424-L428 PolarHBondContact O-N 3.44Å; S424-L428 VanDerWaalsContact O-N 3.11Å; S424-E491 PolarHBondContact OG-OE2 3.42Å
425S94.8Very high92.9Very high99 Ų9952.3 Ų52.369%0.69229%0.285SS*.Hα-helixtrans-60.3-31176.758.80000112.3N423 F429N423-S425 PolarHBondContact O-N 3.22Å; S425-F429 WeakPolarHBondContact O-CB 3.17Å; S425-F429 PolarHBondContact O-N 3.47Å
426R95.1Very high93.5Very high22 Ų2257.2 Ų57.28%0.08330%0.3CS..Hα-helixtrans-56.2-55.9171.3172.6-172.8178.3-125.9-10.3110.9S424 L428 F429 V430 D482 I485 P486 G487 E491S424-R426 PolarHBondContact O-N 2.8Å; R426-L428 PolarHBondContact O-N 2.97Å; R426-F429 WeakPolarHBondContact O-CB 3.39Å; R426-F429 PolarHBondContact O-N 2.97Å; R426-V430 WeakPolarHBondContact O-CG2 3.33Å; R426-V430 PolarHBondContact O-N 2.92Å; R426-D482 PolarHBondContact NH2-O 3.45Å; R426-D482 IonicContact NH2-OD1 2.66Å; R426-D482 PolarHBondContact NH2-OD1 2.8Å; R426-I485 HydrophobicContact CG-CB 4.43Å; R426-I485 HydrophobicContact CG-CG2 3.74Å; R426-I485 VanDerWaalsContact CZ-O 3.26Å; R426-I485 PolarHBondContact NE-O 3.32Å; R426-I485 PolarHBondContact NH2-O 3.49Å; R426-P486 VanDerWaalsContact CD-O 3.24Å; R426-P486 WeakPolarHBondContact CD-O 3.18Å; R426-P486 PolarHBondContact NE-O 2.94Å; R426-G487 VanDerWaalsContact NH1-CA 3.34Å; R426-E491 IonicContact CZ-OE1 2.77Å; R426-E491 IonicContact NE-OE1 3.72Å; R426-E491 IonicContact NH1-OE1 3.46Å; R426-E491 PolarHBondContact NH1-OE1 3.13Å
427N95.1Very high94.2Very high0 Ų059.1 Ų59.10%031%0.307CS..Hα-helixtrans-65.6-40.9-175.2-69.8-15.3000111.5L156 V420 D421 S424 F429 V430 L431 E491L156-N427 HydrophobicContact CD2-CB 4.26Å; L156-N427 WeakPolarHBondContact CD2-OD1 3.15Å; V420-N427 HydrophobicContact CG1-CB 4.12Å; V420-N427 WeakPolarHBondContact CG1-ND2 3.4Å; D421-N427 PolarHBondContact O-ND2 3Å; S424-N427 PolarHBondContact O-N 3.27Å; S424-N427 VanDerWaalsContact O-N 3.14Å; N427-F429 VanDerWaalsContact C-N 3.31Å; N427-F429 PolarHBondContact O-N 2.98Å; N427-V430 PolarHBondContact O-N 2.88Å; N427-L431 VanDerWaalsContact O-CB 3.24Å; N427-L431 WeakPolarHBondContact O-CB 3.5Å; N427-L431 PolarHBondContact O-N 3.47Å; N427-E491 PolarHBondContact ND2-O 2.89Å
428L95.4Very high94.4Very high88 Ų8858.1 Ų58.146%0.46130%0.302SS..Hα-helixtrans-60.3-40.9174.1-70.2176.9000111.9L422 S424 R426 G432L422-L428 HydrophobicContact CB-CD2 4.48Å; L422-L428 HydrophobicContact CD2-CD2 4.27Å; L422-L428 WeakPolarHBondContact O-CD1 3.3Å; L422-L428 WeakPolarHBondContact O-CG 3.25Å; S424-L428 PolarHBondContact O-N 3.44Å; S424-L428 VanDerWaalsContact O-N 3.11Å; R426-L428 PolarHBondContact O-N 2.97Å; L428-G432 PolarHBondContact O-N 3.14Å
429F96.4Very high94.7Very high116 Ų11653.5 Ų53.551%0.50928%0.282SS..Hα-helixtrans-65.8-50176.5-179.1-95.5000112S425 R426 N427 L431 G432 F433 I485S425-F429 WeakPolarHBondContact O-CB 3.17Å; S425-F429 PolarHBondContact O-N 3.47Å; R426-F429 WeakPolarHBondContact O-CB 3.39Å; R426-F429 PolarHBondContact O-N 2.97Å; N427-F429 VanDerWaalsContact C-N 3.31Å; N427-F429 PolarHBondContact O-N 2.98Å; F429-L431 VanDerWaalsContact C-N 3.33Å; F429-L431 PolarHBondContact O-N 3.31Å; F429-G432 PolarHBondContact O-N 3.42Å; F429-F433 HydrophobicContact CE1-CB 4.47Å; F429-F433 HydrophobicContact CZ-CB 4.39Å; F429-F433 HydrophobicContact CZ-CG 4.46Å; F429-F433 WeakPolarHBondContact O-CB 3.24Å; F429-F433 PolarHBondContact O-N 2.63Å; F429-I485 HydrophobicContact CD1-CD1 4.24Å
430V96.7Very high95.3Very high0 Ų054.9 Ų54.90%029%0.292CS..Hα-helixtrans-55.5-50.1178173.30000110.4L156 R426 N427 S434 L481 D482 I485L156-V430 HydrophobicContact CD1-CG1 4.37Å; L156-V430 HydrophobicContact CD2-CB 3.92Å; L156-V430 HydrophobicContact CD2-CG1 3.74Å; L156-V430 HydrophobicContact CD2-CG2 4.36Å; L156-V430 HydrophobicContact CG-CB 4.35Å; L156-V430 HydrophobicContact CG-CG1 3.81Å; R426-V430 WeakPolarHBondContact O-CG2 3.33Å; R426-V430 PolarHBondContact O-N 2.92Å; N427-V430 PolarHBondContact O-N 2.88Å; V430-S434 WeakPolarHBondContact O-CB 3.25Å; V430-S434 PolarHBondContact O-N 3.27Å; V430-S434 VanDerWaalsContact O-N 3.15Å; V430-S434 PolarHBondContact O-OG 3.22Å; V430-L481 HydrophobicContact CB-CB 4.5Å; V430-L481 HydrophobicContact CG1-CB 4.09Å; V430-L481 HydrophobicContact CG2-CB 4Å; V430-D482 HydrophobicContact CG1-CB 4.26Å; V430-I485 HydrophobicContact CG2-CD1 3.87Å
431L96.4Very high95.4Very high21 Ų2156 Ų5611%0.1130%0.297CS..Hα-helixtrans-62.3-54179.8176.163.1000111.7L156 T159 P160 L417 L422 N427 F429 S434 M435L156-L431 HydrophobicContact CD1-CB 3.97Å; T159-L431 HydrophobicContact CG2-CD1 3.78Å; P160-L431 HydrophobicContact CG-CD1 4.07Å; L417-L431 HydrophobicContact CD1-CD1 4.37Å; L417-L431 HydrophobicContact CD1-CD2 3.58Å; L417-L431 HydrophobicContact CD2-CD1 4.1Å; L417-L431 HydrophobicContact CD2-CD2 3.87Å; L417-L431 HydrophobicContact CG-CD2 4.38Å; L422-L431 HydrophobicContact CD2-CD2 4.27Å; N427-L431 VanDerWaalsContact O-CB 3.24Å; N427-L431 WeakPolarHBondContact O-CB 3.5Å; N427-L431 PolarHBondContact O-N 3.47Å; F429-L431 VanDerWaalsContact C-N 3.33Å; F429-L431 PolarHBondContact O-N 3.31Å; L431-S434 PolarHBondContact O-N 2.94Å; L431-M435 HydrophobicContact CD1-CG 4.12Å; L431-M435 WeakPolarHBondContact O-CB 3.37Å; L431-M435 WeakPolarHBondContact O-CG 3.28Å; L431-M435 PolarHBondContact O-N 3.49Å
432G96.5Very high95.3Very high39 Ų3952.9 Ų52.940%0.40228%0.28SS..Hα-helixtrans-64.6-46.5-173.800000112.6L428 F429 F436L428-G432 PolarHBondContact O-N 3.14Å; F429-G432 PolarHBondContact O-N 3.42Å; G432-F436 VanDerWaalsContact O-CB 3.29Å; G432-F436 WeakPolarHBondContact O-CB 3.21Å; G432-F436 PolarHBondContact O-N 3.05Å
433F97.8Very high95.2Very high83 Ų8352.3 Ų52.336%0.36429%0.285SS..Hα-helixtrans-63.3-46.3178.2-178.6-97.9000111.5F429 M435 F436 F437 L477 L481F429-F433 HydrophobicContact CE1-CB 4.47Å; F429-F433 HydrophobicContact CZ-CB 4.39Å; F429-F433 HydrophobicContact CZ-CG 4.46Å; F429-F433 WeakPolarHBondContact O-CB 3.24Å; F429-F433 PolarHBondContact O-N 2.63Å; F433-M435 PolarHBondContact O-N 3.48Å; F433-F436 PolarHBondContact O-N 2.86Å; F433-F437 HydrophobicContact CE1-CB 4.38Å; F433-F437 HydrophobicContact CE2-CB 4.5Å; F433-F437 HydrophobicContact CZ-CB 4.3Å; F433-F437 HydrophobicContact CZ-CD2 4.27Å; F433-F437 HydrophobicContact CZ-CG 4.23Å; F433-F437 WeakPolarHBondContact O-CB 3.36Å; F433-F437 PolarHBondContact O-N 3.42Å; F433-L477 HydrophobicContact CE1-CD1 4.06Å; F433-L477 HydrophobicContact CE1-CD2 4.4Å; F433-L481 HydrophobicContact CD1-CD1 3.58Å; F433-L481 HydrophobicContact CE1-CD1 4.2Å; F433-L481 HydrophobicContact CG-CD1 4.45Å
434S97.3Very high95.2Very high0 Ų050.6 Ų50.60%027%0.269CS..Hα-helixtrans-65.8-41.1-177.6-55.80000112.5V430 L431 G438 G474 A478V430-S434 WeakPolarHBondContact O-CB 3.25Å; V430-S434 PolarHBondContact O-N 3.27Å; V430-S434 VanDerWaalsContact O-N 3.15Å; V430-S434 PolarHBondContact O-OG 3.22Å; L431-S434 PolarHBondContact O-N 2.94Å; S434-G438 WeakPolarHBondContact O-CA 3.5Å; S434-G438 PolarHBondContact O-N 2.84Å; S434-G474 WeakPolarHBondContact CB-O 3.06Å; S434-G474 VanDerWaalsContact O-CA 3.3Å; S434-G474 WeakPolarHBondContact O-CA 3.37Å; S434-A478 VanDerWaalsContact OG-CA 3.23Å; S434-A478 WeakPolarHBondContact OG-CA 3.39Å; S434-A478 PolarHBondContact OG-N 2.98Å; S434-A478 VanDerWaalsContact OG-N 3.13Å
435M95.9Very high95Very high32 Ų3250.7 Ų50.716%0.15827%0.268CS..Hα-helixtrans-64.4-49.9174.8-76.6-75.2-75.800111.9P160 L164 L167 L414 L431 F433 L439P160-M435 HydrophobicContact CB-CG 4.19Å; P160-M435 HydrophobicContact CB-SD 4.07Å; P160-M435 HydrophobicContact CG-CG 4.25Å; L164-M435 HydrophobicContact CD2-SD 4.22Å; L164-M435 HydrophobicContact CG-SD 3.98Å; L167-M435 HydrophobicContact CD1-CE 3.57Å; L414-M435 HydrophobicContact CD2-CE 4.45Å; L431-M435 HydrophobicContact CD1-CG 4.12Å; L431-M435 WeakPolarHBondContact O-CB 3.37Å; L431-M435 WeakPolarHBondContact O-CG 3.28Å; L431-M435 PolarHBondContact O-N 3.49Å; F433-M435 PolarHBondContact O-N 3.48Å; M435-L439 PolarHBondContact O-N 2.92Å
436F96.7Very high94.6Very high151 Ų15151 Ų5166%0.66226%0.262SS*.Hα-helixtrans-69.3-46.6-175-173.2-100.1000112G432 F433 G438 L439 T440G432-F436 VanDerWaalsContact O-CB 3.29Å; G432-F436 WeakPolarHBondContact O-CB 3.21Å; G432-F436 PolarHBondContact O-N 3.05Å; F433-F436 PolarHBondContact O-N 2.86Å; F436-G438 VanDerWaalsContact C-N 3.32Å; F436-L439 PolarHBondContact O-N 3.43Å; F436-T440 WeakPolarHBondContact CE1-OG1 3.28Å; F436-T440 WeakPolarHBondContact O-CB 3.31Å; F436-T440 PolarHBondContact O-N 3.06Å; F436-T440 PolarHBondContact O-OG1 2.78Å
437F97Very high94.3Very high71 Ų7153.2 Ų53.231%0.31129%0.285SS..Hα-helixtrans-70-32.3179-165.3-92.6000112.1F433 L439 T440 L441 V473 L477F433-F437 HydrophobicContact CE1-CB 4.38Å; F433-F437 HydrophobicContact CE2-CB 4.5Å; F433-F437 HydrophobicContact CZ-CB 4.3Å; F433-F437 HydrophobicContact CZ-CD2 4.27Å; F433-F437 HydrophobicContact CZ-CG 4.23Å; F433-F437 WeakPolarHBondContact O-CB 3.36Å; F433-F437 PolarHBondContact O-N 3.42Å; F437-L439 PolarHBondContact O-N 3.17Å; F437-T440 PolarHBondContact O-N 3.25Å; F437-T440 VanDerWaalsContact O-N 3.15Å; F437-L441 HydrophobicContact CD1-CB 4.17Å; F437-L441 HydrophobicContact CE1-CB 3.77Å; F437-L441 HydrophobicContact CE1-CD2 3.79Å; F437-L441 HydrophobicContact CE1-CG 4.32Å; F437-L441 HydrophobicContact CZ-CB 4.03Å; F437-L441 HydrophobicContact CZ-CD2 4.27Å; F437-L441 PolarHBondContact O-N 3.46Å; F437-V473 HydrophobicContact CD1-CG1 3.85Å; F437-V473 HydrophobicContact CE1-CG1 4.17Å; F437-L477 HydrophobicContact CB-CD1 4.11Å; F437-L477 HydrophobicContact CD1-CD1 3.27Å; F437-L477 HydrophobicContact CE1-CD1 3.97Å; F437-L477 HydrophobicContact CG-CD1 4.02Å
438G94.4Very high94.1Very high0 Ų057.4 Ų57.40%030%0.304CS..Hα-helixtrans-56.9-30.7171.800000113.6S434 F436 P442 E470S434-G438 WeakPolarHBondContact O-CA 3.5Å; S434-G438 PolarHBondContact O-N 2.84Å; F436-G438 VanDerWaalsContact C-N 3.32Å; G438-P442 WeakPolarHBondContact O-CD 3.37Å; G438-P442 VanDerWaalsContact O-CG 3.27Å; G438-P442 WeakPolarHBondContact O-CG 3.41Å; G438-E470 WeakPolarHBondContact O-CA 3.32Å; G438-E470 VanDerWaalsContact O-CB 3.26Å; G438-E470 WeakPolarHBondContact O-CB 3.4Å; G438-E470 WeakPolarHBondContact O-CG 3.32Å
439L93.6Very high93.4Very high57 Ų5757.9 Ų57.930%0.29831%0.312SS..Hα-helixtrans-88.5-37.2171.4-63.7173.1000112.5L164 L167 M435 F436 F437 A443 E470L164-L439 HydrophobicContact CD2-CD1 4.21Å; L164-L439 HydrophobicContact CD2-CD2 3.57Å; L164-L439 HydrophobicContact CD2-CG 3.56Å; L167-L439 HydrophobicContact CB-CD2 4.27Å; L167-L439 HydrophobicContact CD1-CD1 4.5Å; M435-L439 PolarHBondContact O-N 2.92Å; F436-L439 PolarHBondContact O-N 3.43Å; F437-L439 PolarHBondContact O-N 3.17Å; L439-A443 VanDerWaalsContact O-CB 3.26Å; L439-A443 WeakPolarHBondContact O-CB 3.1Å; L439-A443 PolarHBondContact O-N 3.31Å; L439-E470 HydrophobicContact CD2-CB 4.48Å; L439-E470 HydrophobicContact CD2-CG 4.06Å
440T95.4Very high92.7Very high59 Ų5958.7 Ų58.736%0.36232%0.316SS..Hα-helixtrans-67.3-45.8-171.9-58.80000112.5F436 F437 Y444F436-T440 WeakPolarHBondContact CE1-OG1 3.28Å; F436-T440 WeakPolarHBondContact O-CB 3.31Å; F436-T440 PolarHBondContact O-N 3.06Å; F436-T440 PolarHBondContact O-OG1 2.78Å; F437-T440 PolarHBondContact O-N 3.25Å; F437-T440 VanDerWaalsContact O-N 3.15Å; T440-Y444 WeakPolarHBondContact O-CB 3.48Å; T440-Y444 PolarHBondContact O-N 2.91Å
441L94.4Very high92.3Very high35 Ų3562.2 Ų62.218%0.18334%0.337CS..Hα-helixtrans-67.2-49.6-175.7174.466.3000112.2F437 A443 Y444 L445 L467 V473F437-L441 HydrophobicContact CD1-CB 4.17Å; F437-L441 HydrophobicContact CE1-CB 3.77Å; F437-L441 HydrophobicContact CE1-CD2 3.79Å; F437-L441 HydrophobicContact CE1-CG 4.32Å; F437-L441 HydrophobicContact CZ-CB 4.03Å; F437-L441 HydrophobicContact CZ-CD2 4.27Å; F437-L441 PolarHBondContact O-N 3.46Å; L441-A443 PolarHBondContact O-N 3.25Å; L441-Y444 WeakPolarHBondContact O-CB 3.45Å; L441-Y444 PolarHBondContact O-N 3.49Å; L441-L445 HydrophobicContact CD1-CD1 4.3Å; L441-L445 HydrophobicContact CD1-CG 4.3Å; L441-L445 HydrophobicContact CG-CD1 4.31Å; L441-L445 WeakPolarHBondContact O-CG 3.42Å; L441-L445 PolarHBondContact O-N 2.95Å; L441-L467 HydrophobicContact CD2-CB 4.11Å; L441-L467 HydrophobicContact CD2-CD2 3.97Å; L441-L467 HydrophobicContact CD2-CG 4.46Å; L441-V473 HydrophobicContact CB-CG1 4.4Å; L441-V473 HydrophobicContact CD2-CG1 4.06Å; L441-V473 HydrophobicContact CD2-CG2 4.16Å
442P90.7Very high91.8Very high0 Ų062.7 Ų62.70%034%0.339CS..Hα-helixtrans-55.8-48173-29.638.2000113G438 Y444 L445 D446 L467 E470G438-P442 WeakPolarHBondContact O-CD 3.37Å; G438-P442 VanDerWaalsContact O-CG 3.27Å; G438-P442 WeakPolarHBondContact O-CG 3.41Å; P442-Y444 VanDerWaalsContact C-N 3.26Å; P442-Y444 PolarHBondContact O-N 3.48Å; P442-L445 PolarHBondContact O-N 3.24Å; P442-D446 PolarHBondContact O-N 3.16Å; P442-L467 WeakPolarHBondContact CG-O 3.1Å; P442-E470 HydrophobicContact CB-CG 3.97Å; P442-E470 HydrophobicContact CG-CB 4.26Å; P442-E470 HydrophobicContact CG-CG 3.82Å
443A91.8Very high91.3Very high57 Ų5768.7 Ų68.747%0.47135%0.354SS..Hα-helixtrans-59.5-36178.400000112.9L439 L441 A447L439-A443 VanDerWaalsContact O-CB 3.26Å; L439-A443 WeakPolarHBondContact O-CB 3.1Å; L439-A443 PolarHBondContact O-N 3.31Å; L441-A443 PolarHBondContact O-N 3.25Å; A443-A447 WeakPolarHBondContact O-CB 3.35Å; A443-A447 PolarHBondContact O-N 3.28Å; A443-A447 VanDerWaalsContact O-N 3.12Å
444Y93.3Very high90.8Very high114 Ų11467.9 Ų67.945%0.44736%0.356SS..Hα-helixtrans-66.5-42.7174.6175.6-96.6000112.3T440 L441 P442 A447 H448 V451T440-Y444 WeakPolarHBondContact O-CB 3.48Å; T440-Y444 PolarHBondContact O-N 2.91Å; L441-Y444 WeakPolarHBondContact O-CB 3.45Å; L441-Y444 PolarHBondContact O-N 3.49Å; P442-Y444 VanDerWaalsContact C-N 3.26Å; P442-Y444 PolarHBondContact O-N 3.48Å; Y444-A447 PolarHBondContact O-N 3.04Å; Y444-H448 AromaticContact CD2-CE1 3.84Å; Y444-H448 AromaticContact CD2-ND1 3.61Å; Y444-H448 AromaticContact CE2-CE1 3.59Å; Y444-H448 AromaticContact CE2-ND1 3.49Å; Y444-H448 WeakPolarHBondContact CE2-ND1 3.35Å; Y444-H448 AromaticContact CZ-ND1 3.97Å; Y444-H448 PolarHBondContact O-N 3.05Å; Y444-H448 PolarHBondContact O-ND1 3.23Å; Y444-V451 HydrophobicContact CE1-CG1 4.41Å
445L90.3Very high90.1Very high20 Ų2071.4 Ų71.411%0.10539%0.392CS..Hα-helixtrans-67.6-37.6178.9-69.2175.3000112.1L441 P442 H448 I452 L467L441-L445 HydrophobicContact CD1-CD1 4.3Å; L441-L445 HydrophobicContact CD1-CG 4.3Å; L441-L445 HydrophobicContact CG-CD1 4.31Å; L441-L445 WeakPolarHBondContact O-CG 3.42Å; L441-L445 PolarHBondContact O-N 2.95Å; P442-L445 PolarHBondContact O-N 3.24Å; L445-H448 CarbonylContact O-C 3.55Å; L445-H448 PolarHBondContact O-N 3.17Å; L445-I452 HydrophobicContact CD1-CD1 4.32Å; L445-I452 HydrophobicContact CD2-CD1 3.97Å; L445-I452 HydrophobicContact CD2-CG1 4.14Å; L445-L467 HydrophobicContact CD1-CB 3.49Å; L445-L467 VanDerWaalsContact CD1-CB 3.49Å
446D85.8Confident89.8Confident107 Ų10773.8 Ų73.857%0.57241%0.409SS*.Hα-helixtrans-65.4-40.5175.1-71.7-10.2000111.7P442 H448P442-D446 PolarHBondContact O-N 3.16Å; D446-H448 VanDerWaalsContact C-N 3.3Å; D446-H448 PolarHBondContact O-N 2.89Å
447A89.8Confident89Confident68 Ų6871.2 Ų71.256%0.56241%0.405SS*.Hα-helixtrans-71.1-24.2176.200000113.4A443 Y444 P449A443-A447 WeakPolarHBondContact O-CB 3.35Å; A443-A447 PolarHBondContact O-N 3.28Å; A443-A447 VanDerWaalsContact O-N 3.12Å; Y444-A447 PolarHBondContact O-N 3.04Å; A447-P449 WeakPolarHBondContact O-CD 3.32Å
448H89.4Confident88.3Confident88 Ų8872.4 Ų72.441%0.40741%0.412SS..SBendtrans-126.974.6-177.5-55.784.2000111.2Y444 L445 D446 V451Y444-H448 AromaticContact CD2-CE1 3.84Å; Y444-H448 AromaticContact CD2-ND1 3.61Å; Y444-H448 AromaticContact CE2-CE1 3.59Å; Y444-H448 AromaticContact CE2-ND1 3.49Å; Y444-H448 WeakPolarHBondContact CE2-ND1 3.35Å; Y444-H448 AromaticContact CZ-ND1 3.97Å; Y444-H448 PolarHBondContact O-N 3.05Å; Y444-H448 PolarHBondContact O-ND1 3.23Å; L445-H448 CarbonylContact O-C 3.55Å; L445-H448 PolarHBondContact O-N 3.17Å; D446-H448 VanDerWaalsContact C-N 3.3Å; D446-H448 PolarHBondContact O-N 2.89Å; H448-V451 HydrophobicContact CB-CG2 3.42Å; H448-V451 VanDerWaalsContact CB-CG2 3.42Å; H448-V451 VanDerWaalsContact O-CG2 3.24Å; H448-V451 WeakPolarHBondContact O-CG2 3.46Å; H448-V451 PolarHBondContact O-N 2.74Å
449P81.3Confident87.8Confident98 Ų9876 Ų7664%0.63643%0.431SS*.THydrogen-bonded Turntrans-60.8143.6178.225.4-33.8000110.5A447 V451A447-P449 WeakPolarHBondContact O-CD 3.32Å; P449-V451 PolarHBondContact O-N 2.98Å
450K81.7Confident87.3Confident132 Ų13274.7 Ų74.757%0.57442%0.424SS*.THydrogen-bonded Turntrans69.621.3177.5-49176.9179.2-170.70115.3D95 K453D95-K450 IonicContact OD1-NZ 3.97Å; D95-K450 PolarHBondContact OD1-NZ 3.2Å; D95-K450 WeakPolarHBondContact OD2-CE 3.34Å; D95-K450 IonicContact OD2-NZ 2.75Å; D95-K450 PolarHBondContact OD2-NZ 3.46Å; K450-K453 WeakPolarHBondContact O-CE 3.37Å
451V88.8Confident86.6Confident74 Ų7474.5 Ų74.545%0.44842%0.419SS..  trans-68.3-35.6172165.50000112.4Y444 H448 P449 K453Y444-V451 HydrophobicContact CE1-CG1 4.41Å; H448-V451 HydrophobicContact CB-CG2 3.42Å; H448-V451 VanDerWaalsContact CB-CG2 3.42Å; H448-V451 VanDerWaalsContact O-CG2 3.24Å; H448-V451 WeakPolarHBondContact O-CG2 3.46Å; H448-V451 PolarHBondContact O-N 2.74Å; P449-V451 PolarHBondContact O-N 2.98Å; V451-K453 PolarHBondContact O-N 2.84Å
452I86.3Confident86Confident31 Ų3174.1 Ų74.116%0.15942%0.417CS..  trans-76.8110.8178.5-58.5172.6000108.6L445 T454 D460 L463 L467L445-I452 HydrophobicContact CD1-CD1 4.32Å; L445-I452 HydrophobicContact CD2-CD1 3.97Å; L445-I452 HydrophobicContact CD2-CG1 4.14Å; I452-T454 HydrophobicContact CG2-CG2 4.43Å; I452-D460 HydrophobicContact CG2-CB 4.38Å; I452-L463 HydrophobicContact CD1-CB 4.13Å; I452-L463 HydrophobicContact CG2-CB 4Å; I452-L463 HydrophobicContact CG2-CD1 4.03Å; I452-L467 HydrophobicContact CD1-CD1 4.19Å
453K86.7Confident85.8Confident165 Ų16576.8 Ų76.872%0.71743%0.43SS*.  trans-138.284.4178-65.8-177.7-177.7173.80110.1K450 V451 G455K450-K453 WeakPolarHBondContact O-CE 3.37Å; V451-K453 PolarHBondContact O-N 2.84Å; K453-G455 VanDerWaalsContact C-N 3.34Å
454T85.6Confident85.5Confident67 Ų6776.2 Ų76.241%0.41142%0.421SS..  trans-84.3-13.7175.665.10000112.4I452 V456 L459 D460 L463I452-T454 HydrophobicContact CG2-CG2 4.43Å; T454-V456 VanDerWaalsContact C-N 3.33Å; T454-V456 PolarHBondContact OG1-N 3.15Å; T454-L459 HydrophobicContact CG2-CD2 4.05Å; T454-L459 HydrophobicContact CG2-CG 4.35Å; T454-D460 WeakPolarHBondContact CA-OD1 3.45Å; T454-D460 VanDerWaalsContact CB-OD1 3.23Å; T454-D460 WeakPolarHBondContact CB-OD1 3.26Å; T454-D460 WeakPolarHBondContact CG2-OD1 3.13Å; T454-D460 PolarHBondContact N-OD1 3.2Å; T454-D460 PolarHBondContact N-OD2 3.02Å; T454-D460 PolarHBondContact OG1-OD1 2.95Å; T454-L463 HydrophobicContact CG2-CD1 3.82Å
455G83.6Confident84.9Confident73 Ų7370.8 Ų70.875%0.75340%0.4SS*.SBendtrans90.3-5.6-175.700000113.7K453K453-G455 VanDerWaalsContact C-N 3.34Å
456V88.4Confident84.7Confident83 Ų8371.6 Ų71.650%0.50340%0.404SS..  trans-115.5112.1173.5-178.80000108.7T454 E458 L459 D460T454-V456 VanDerWaalsContact C-N 3.33Å; T454-V456 PolarHBondContact OG1-N 3.15Å; V456-E458 VanDerWaalsContact C-N 3.28Å; V456-E458 HydrophobicContact CG1-CB 4.43Å; V456-E458 PolarHBondContact O-N 2.98Å; V456-L459 HydrophobicContact CB-CB 3.97Å; V456-L459 HydrophobicContact CG1-CB 4.11Å; V456-L459 PolarHBondContact O-N 3.26Å; V456-D460 PolarHBondContact O-N 2.86Å
457V81.8Confident84.8Confident97 Ų9769.1 Ų69.159%0.58839%0.391SS*.Hα-helixtrans-55.9-42.3-174.6-179.70000112.3D460 Q461V457-D460 PolarHBondContact O-N 3.43Å; V457-Q461 WeakPolarHBondContact O-CG 3.11Å; V457-Q461 PolarHBondContact O-N 3.4Å
458E80.8Confident84.7Confident96 Ų9666.4 Ų66.445%0.44937%0.368SS..Hα-helixtrans-63.8-41.8178.7-62.2-61.3150.100111.8V456 Q461 I462V456-E458 VanDerWaalsContact C-N 3.28Å; V456-E458 HydrophobicContact CG1-CB 4.43Å; V456-E458 PolarHBondContact O-N 2.98Å; E458-Q461 PolarHBondContact O-N 3.01Å; E458-I462 WeakPolarHBondContact O-CD1 3.4Å; E458-I462 WeakPolarHBondContact O-CG1 3.45Å; E458-I462 PolarHBondContact O-N 3.5Å
459L84.1Confident84.5Confident76 Ų7662.2 Ų62.240%0.39835%0.348SS..Hα-helixtrans-69.1-39.9179.6-175.261.4000111.1T454 V456 Q461 I462 L463T454-L459 HydrophobicContact CG2-CD2 4.05Å; T454-L459 HydrophobicContact CG2-CG 4.35Å; V456-L459 HydrophobicContact CB-CB 3.97Å; V456-L459 HydrophobicContact CG1-CB 4.11Å; V456-L459 PolarHBondContact O-N 3.26Å; L459-Q461 VanDerWaalsContact C-N 3.33Å; L459-Q461 PolarHBondContact O-N 2.81Å; L459-I462 PolarHBondContact O-N 3.42Å; L459-L463 HydrophobicContact CD1-CD1 4.33Å; L459-L463 HydrophobicContact CD1-CG 4.25Å; L459-L463 HydrophobicContact CG-CD1 4.02Å; L459-L463 HydrophobicContact CG-CG 4.37Å; L459-L463 WeakPolarHBondContact O-CB 3.34Å; L459-L463 VanDerWaalsContact O-CG 3.3Å; L459-L463 WeakPolarHBondContact O-CG 3.27Å; L459-L463 PolarHBondContact O-N 3.25Å
460D84.3Confident85Confident29 Ų2958.7 Ų58.716%0.15532%0.323CS..Hα-helixtrans-59.4-46.1175.4-69.6-14.5000110.5I452 T454 V456 V457 L463 T464I452-D460 HydrophobicContact CG2-CB 4.38Å; T454-D460 WeakPolarHBondContact CA-OD1 3.45Å; T454-D460 VanDerWaalsContact CB-OD1 3.23Å; T454-D460 WeakPolarHBondContact CB-OD1 3.26Å; T454-D460 WeakPolarHBondContact CG2-OD1 3.13Å; T454-D460 PolarHBondContact N-OD1 3.2Å; T454-D460 PolarHBondContact N-OD2 3.02Å; T454-D460 PolarHBondContact OG1-OD1 2.95Å; V456-D460 PolarHBondContact O-N 2.86Å; V457-D460 PolarHBondContact O-N 3.43Å; D460-L463 PolarHBondContact O-N 3.11Å; D460-T464 WeakPolarHBondContact O-CB 3.13Å; D460-T464 PolarHBondContact O-N 3.2Å; D460-T464 PolarHBondContact O-OG1 3.36Å
461Q79.4Confident85.3Confident54 Ų5452.4 Ų52.425%0.25230%0.296SS..Hα-helixtrans-62.7-43.9176.4-70.8176.7000112.5L94 A289 V457 E458 L459 T464 V465L94-Q461 HydrophobicContact CD2-CG 4.25Å; A289-Q461 HydrophobicContact CB-CB 3.66Å; V457-Q461 WeakPolarHBondContact O-CG 3.11Å; V457-Q461 PolarHBondContact O-N 3.4Å; E458-Q461 PolarHBondContact O-N 3.01Å; L459-Q461 VanDerWaalsContact C-N 3.33Å; L459-Q461 PolarHBondContact O-N 2.81Å; Q461-T464 PolarHBondContact O-N 2.62Å; Q461-V465 VanDerWaalsContact O-CG2 3.22Å; Q461-V465 WeakPolarHBondContact O-CG2 3.31Å; Q461-V465 PolarHBondContact O-N 2.79Å
462I82.2Confident85.3Confident28 Ų2851.4 Ų51.414%0.14429%0.286CS..Hα-helixtrans-60.5-48.8178-68.7162.8000110.6V288 L292 E458 L459 V465 L466V288-I462 HydrophobicContact CG1-CD1 4.29Å; L292-I462 HydrophobicContact CD1-CB 4.47Å; L292-I462 HydrophobicContact CD1-CD1 3.47Å; L292-I462 VanDerWaalsContact CD1-CD1 3.47Å; L292-I462 HydrophobicContact CD1-CG1 3.66Å; L292-I462 HydrophobicContact CD1-CG2 3.94Å; E458-I462 WeakPolarHBondContact O-CD1 3.4Å; E458-I462 WeakPolarHBondContact O-CG1 3.45Å; E458-I462 PolarHBondContact O-N 3.5Å; L459-I462 PolarHBondContact O-N 3.42Å; I462-V465 PolarHBondContact O-N 3.1Å; I462-L466 HydrophobicContact CG2-CD1 3.86Å; I462-L466 HydrophobicContact CG2-CG 4.48Å; I462-L466 WeakPolarHBondContact O-CB 3.33Å; I462-L466 WeakPolarHBondContact O-CG 3.37Å; I462-L466 PolarHBondContact O-N 2.81Å
463L86.2Confident85.6Confident55 Ų5550.3 Ų50.329%0.28828%0.28SS..Hα-helixtrans-65.1-42.5180-70.8174.9000111.3I452 T454 L459 D460 L467I452-L463 HydrophobicContact CD1-CB 4.13Å; I452-L463 HydrophobicContact CG2-CB 4Å; I452-L463 HydrophobicContact CG2-CD1 4.03Å; T454-L463 HydrophobicContact CG2-CD1 3.82Å; L459-L463 HydrophobicContact CD1-CD1 4.33Å; L459-L463 HydrophobicContact CD1-CG 4.25Å; L459-L463 HydrophobicContact CG-CD1 4.02Å; L459-L463 HydrophobicContact CG-CG 4.37Å; L459-L463 WeakPolarHBondContact O-CB 3.34Å; L459-L463 VanDerWaalsContact O-CG 3.3Å; L459-L463 WeakPolarHBondContact O-CG 3.27Å; L459-L463 PolarHBondContact O-N 3.25Å; D460-L463 PolarHBondContact O-N 3.11Å; L463-L467 HydrophobicContact CB-CD1 4.45Å; L463-L467 WeakPolarHBondContact O-CB 3.45Å; L463-L467 WeakPolarHBondContact O-CG 3.28Å; L463-L467 PolarHBondContact O-N 3.46Å
464T85.1Confident85.9Confident46 Ų4642.4 Ų42.428%0.28225%0.246SC..Hα-helixtrans-57.8-50.7175.1-660000110.9D460 Q461 L466 S468D460-T464 WeakPolarHBondContact O-CB 3.13Å; D460-T464 PolarHBondContact O-N 3.2Å; D460-T464 PolarHBondContact O-OG1 3.36Å; Q461-T464 PolarHBondContact O-N 2.62Å; T464-L466 PolarHBondContact O-N 3.44Å; T464-S468 WeakPolarHBondContact O-CB 3.49Å; T464-S468 PolarHBondContact O-N 3.33Å; T464-S468 PolarHBondContact O-OG 3.01Å; T464-S468 VanDerWaalsContact O-OG 3.12Å
465V81.7Confident86.2Confident0 Ų039.6 Ų39.60%023%0.23CC..Hα-helixtrans-65.9-43.9-176.21790000111.6A90 I91 Q461 I462 T469A90-V465 HydrophobicContact CB-CG1 4.23Å; I91-V465 HydrophobicContact CG1-CG1 4.31Å; I91-V465 HydrophobicContact CG1-CG2 4.35Å; Q461-V465 VanDerWaalsContact O-CG2 3.22Å; Q461-V465 WeakPolarHBondContact O-CG2 3.31Å; Q461-V465 PolarHBondContact O-N 2.79Å; I462-V465 PolarHBondContact O-N 3.1Å; V465-T469 PolarHBondContact O-OG1 3.47Å
466L84.9Confident86.5Confident36 Ų3641.3 Ų41.319%0.18822%0.217CC..Hα-helixtrans-67.8-44.6179.6-70.1177.2000112.5I462 T464 T469 F472I462-L466 HydrophobicContact CG2-CD1 3.86Å; I462-L466 HydrophobicContact CG2-CG 4.48Å; I462-L466 WeakPolarHBondContact O-CB 3.33Å; I462-L466 WeakPolarHBondContact O-CG 3.37Å; I462-L466 PolarHBondContact O-N 2.81Å; T464-L466 PolarHBondContact O-N 3.44Å; L466-T469 PolarHBondContact O-N 3.45Å; L466-F472 HydrophobicContact CB-CD1 4.13Å; L466-F472 HydrophobicContact CB-CE1 3.95Å; L466-F472 HydrophobicContact CD2-CD1 4.32Å; L466-F472 HydrophobicContact CD2-CE1 4.14Å; L466-F472 HydrophobicContact CD2-CE2 4.41Å; L466-F472 HydrophobicContact CD2-CZ 4.18Å; L466-F472 HydrophobicContact CG-CE1 4.43Å; L466-F472 WeakPolarHBondContact O-CD1 3.19Å
467L89.5Confident86.9Confident55 Ų5539 Ų3929%0.28820%0.202SC..Hα-helixtrans-80.7-20.1-175.3-60.1179.1000113.5L441 P442 L445 I452 L463 T469 V473L441-L467 HydrophobicContact CD2-CB 4.11Å; L441-L467 HydrophobicContact CD2-CD2 3.97Å; L441-L467 HydrophobicContact CD2-CG 4.46Å; P442-L467 WeakPolarHBondContact CG-O 3.1Å; L445-L467 HydrophobicContact CD1-CB 3.49Å; L445-L467 VanDerWaalsContact CD1-CB 3.49Å; I452-L467 HydrophobicContact CD1-CD1 4.19Å; L463-L467 HydrophobicContact CB-CD1 4.45Å; L463-L467 WeakPolarHBondContact O-CB 3.45Å; L463-L467 WeakPolarHBondContact O-CG 3.28Å; L463-L467 PolarHBondContact O-N 3.46Å; L467-T469 VanDerWaalsContact C-N 3.26Å; L467-V473 WeakPolarHBondContact O-CG2 3.01Å
468S86.8Confident87.5Confident12 Ų1234.4 Ų34.48%0.08417%0.174CC..THydrogen-bonded Turntrans-82.1-0.4168.3-67.90000113.1T464T464-S468 WeakPolarHBondContact O-CB 3.49Å; T464-S468 PolarHBondContact O-N 3.33Å; T464-S468 PolarHBondContact O-OG 3.01Å; T464-S468 VanDerWaalsContact O-OG 3.12Å
469T85.9Confident88Confident0 Ų033.1 Ų33.10%017%0.167CC..  trans-97104.6177.7-59.50000110.3I86 P87 V465 L466 L467 M471 F472 V473I86-T469 HydrophobicContact CG2-CG2 4.11Å; P87-T469 HydrophobicContact CG-CG2 4.03Å; V465-T469 PolarHBondContact O-OG1 3.47Å; L466-T469 PolarHBondContact O-N 3.45Å; L467-T469 VanDerWaalsContact C-N 3.26Å; T469-M471 HydrophobicContact CG2-CG 3.5Å; T469-M471 VanDerWaalsContact CG2-CG 3.5Å; T469-M471 HydrophobicContact CG2-SD 4.3Å; T469-M471 PolarHBondContact O-N 2.97Å; T469-F472 HydrophobicContact CG2-CB 3.76Å; T469-F472 PolarHBondContact O-N 3.39Å; T469-F472 VanDerWaalsContact O-N 3.1Å; T469-V473 WeakPolarHBondContact O-CG2 3.41Å; T469-V473 PolarHBondContact O-N 3.26Å
470E90.9Very high88.5Confident23 Ų2331.4 Ų31.411%0.10716%0.161CC..Hα-helixtrans-56.6-48.7-173.2-60.975.2177.800112.6I86 L164 S168 G438 L439 P442 F472 V473 G474I86-E470 VanDerWaalsContact CG2-OE2 3.27Å; I86-E470 WeakPolarHBondContact CG2-OE2 3.32Å; L164-E470 HydrophobicContact CB-CB 4.36Å; L164-E470 WeakPolarHBondContact CD1-O 3.09Å; S168-E470 WeakPolarHBondContact CB-OE2 3.45Å; G438-E470 WeakPolarHBondContact O-CA 3.32Å; G438-E470 VanDerWaalsContact O-CB 3.26Å; G438-E470 WeakPolarHBondContact O-CB 3.4Å; G438-E470 WeakPolarHBondContact O-CG 3.32Å; L439-E470 HydrophobicContact CD2-CB 4.48Å; L439-E470 HydrophobicContact CD2-CG 4.06Å; P442-E470 HydrophobicContact CB-CG 3.97Å; P442-E470 HydrophobicContact CG-CB 4.26Å; P442-E470 HydrophobicContact CG-CG 3.82Å; E470-F472 VanDerWaalsContact C-N 3.28Å; E470-F472 PolarHBondContact O-N 3.21Å; E470-V473 PolarHBondContact O-N 3.39Å; E470-G474 PolarHBondContact O-N 2.66Å
471M89.1Confident89Confident1 Ų131.7 Ų31.71%0.00516%0.162CC..Hα-helixtrans-62.2-34.3-179.856.7-177.7-66.800113A83 L164 I165 A300 T469 G475A83-M471 VanDerWaalsContact CA-SD 3.59Å; A83-M471 HydrophobicContact CB-CE 3.58Å; A83-M471 HydrophobicContact CB-SD 4.05Å; L164-M471 HydrophobicContact CB-CB 4.41Å; I165-M471 HydrophobicContact CD1-CE 3.81Å; I165-M471 HydrophobicContact CD1-SD 4.44Å; I165-M471 HydrophobicContact CG1-CB 4.03Å; I165-M471 HydrophobicContact CG1-CE 3.75Å; I165-M471 HydrophobicContact CG1-SD 3.78Å; A300-M471 HydrophobicContact CB-CE 2.95Å; T469-M471 HydrophobicContact CG2-CG 3.5Å; T469-M471 VanDerWaalsContact CG2-CG 3.5Å; T469-M471 HydrophobicContact CG2-SD 4.3Å; T469-M471 PolarHBondContact O-N 2.97Å; M471-G475 WeakPolarHBondContact O-CA 3.48Å; M471-G475 PolarHBondContact O-N 3.32Å
472F88Confident89.7Confident53 Ų5329.1 Ų29.123%0.23215%0.15CC..Hα-helixtrans-72.5-49.3176.9176.2-99.7000109.9L466 T469 E470 G474 G475 F476L466-F472 HydrophobicContact CB-CD1 4.13Å; L466-F472 HydrophobicContact CB-CE1 3.95Å; L466-F472 HydrophobicContact CD2-CD1 4.32Å; L466-F472 HydrophobicContact CD2-CE1 4.14Å; L466-F472 HydrophobicContact CD2-CE2 4.41Å; L466-F472 HydrophobicContact CD2-CZ 4.18Å; L466-F472 HydrophobicContact CG-CE1 4.43Å; L466-F472 WeakPolarHBondContact O-CD1 3.19Å; T469-F472 HydrophobicContact CG2-CB 3.76Å; T469-F472 PolarHBondContact O-N 3.39Å; T469-F472 VanDerWaalsContact O-N 3.1Å; E470-F472 VanDerWaalsContact C-N 3.28Å; E470-F472 PolarHBondContact O-N 3.21Å; F472-G474 PolarHBondContact O-N 3.13Å; F472-G475 PolarHBondContact O-N 3.25Å; F472-F476 WeakPolarHBondContact O-CB 3.26Å; F472-F476 PolarHBondContact O-N 2.83Å
473V92.3Very high90.1Very high7 Ų730.2 Ų30.24%0.04216%0.156CC..Hα-helixtrans-59.2-50.9179.3175.90000110.6F437 L441 L467 T469 E470 L477F437-V473 HydrophobicContact CD1-CG1 3.85Å; F437-V473 HydrophobicContact CE1-CG1 4.17Å; L441-V473 HydrophobicContact CB-CG1 4.4Å; L441-V473 HydrophobicContact CD2-CG1 4.06Å; L441-V473 HydrophobicContact CD2-CG2 4.16Å; L467-V473 WeakPolarHBondContact O-CG2 3.01Å; T469-V473 WeakPolarHBondContact O-CG2 3.41Å; T469-V473 PolarHBondContact O-N 3.26Å; E470-V473 PolarHBondContact O-N 3.39Å; V473-L477 HydrophobicContact CG1-CD1 3.97Å; V473-L477 WeakPolarHBondContact O-CB 3.21Å; V473-L477 VanDerWaalsContact O-CG 3.23Å; V473-L477 WeakPolarHBondContact O-CG 3.29Å; V473-L477 PolarHBondContact O-N 3.31Å
474G94.1Very high90.5Very high0 Ų032.5 Ų32.50%017%0.173CC..Hα-helixtrans-67.3-42.9-18000000113S434 E470 F472 A478S434-G474 WeakPolarHBondContact CB-O 3.06Å; S434-G474 VanDerWaalsContact O-CA 3.3Å; S434-G474 WeakPolarHBondContact O-CA 3.37Å; E470-G474 PolarHBondContact O-N 2.66Å; F472-G474 PolarHBondContact O-N 3.13Å; G474-A478 VanDerWaalsContact O-CB 3.28Å; G474-A478 WeakPolarHBondContact O-CB 3.41Å; G474-A478 PolarHBondContact O-N 2.8Å
475G91.3Very high90.9Very high7 Ų732.6 Ų32.67%0.07217%0.171CC..Hα-helixtrans-65.3-43.6177.800000113.5T161 M471 F472 A478 F479T161-G475 WeakPolarHBondContact OG1-CA 3.4Å; M471-G475 WeakPolarHBondContact O-CA 3.48Å; M471-G475 PolarHBondContact O-N 3.32Å; F472-G475 PolarHBondContact O-N 3.25Å; G475-A478 PolarHBondContact O-N 3.29Å; G475-F479 WeakPolarHBondContact O-CB 3.38Å; G475-F479 PolarHBondContact O-N 3.22Å
476F90.8Very high91.3Very high109 Ų10938.1 Ų38.148%0.47821%0.207SC..Hα-helixtrans-64.5-44.5177.6179.8-100.9000111.7F472 F479 C480F472-F476 WeakPolarHBondContact O-CB 3.26Å; F472-F476 PolarHBondContact O-N 2.83Å; F476-F479 WeakPolarHBondContact O-CB 3.45Å; F476-F479 PolarHBondContact O-N 3.26Å; F476-C480 VanDerWaalsContact CZ-SG 3.53Å; F476-C480 WeakPolarHBondContact O-CB 3.27Å; F476-C480 PolarHBondContact O-N 3.41Å; F476-C480 PolarHBondContact O-SG 3.4Å; F476-C480 VanDerWaalsContact O-SG 3.36Å
477L95.3Very high91.4Very high36 Ų3638.6 Ų38.619%0.18822%0.22CC..Hα-helixtrans-63.8-42.7175.6-72.5173.2000111.8F433 F437 V473 F479 C480 L481F433-L477 HydrophobicContact CE1-CD1 4.06Å; F433-L477 HydrophobicContact CE1-CD2 4.4Å; F437-L477 HydrophobicContact CB-CD1 4.11Å; F437-L477 HydrophobicContact CD1-CD1 3.27Å; F437-L477 HydrophobicContact CE1-CD1 3.97Å; F437-L477 HydrophobicContact CG-CD1 4.02Å; V473-L477 HydrophobicContact CG1-CD1 3.97Å; V473-L477 WeakPolarHBondContact O-CB 3.21Å; V473-L477 VanDerWaalsContact O-CG 3.23Å; V473-L477 WeakPolarHBondContact O-CG 3.29Å; V473-L477 PolarHBondContact O-N 3.31Å; L477-F479 VanDerWaalsContact C-N 3.32Å; L477-F479 PolarHBondContact O-N 3.09Å; L477-C480 PolarHBondContact O-N 2.98Å; L477-L481 VanDerWaalsContact O-CB 3.28Å; L477-L481 WeakPolarHBondContact O-CB 3.5Å; L477-L481 WeakPolarHBondContact O-CG 3.36Å; L477-L481 PolarHBondContact O-N 3.22Å
478A94.8Very high91.4Very high0 Ų039.6 Ų39.60%023%0.229CC..Hα-helixtrans-59.9-45.6176.400000111P160 S434 G474 G475 D482P160-A478 HydrophobicContact CB-CB 4.15Å; P160-A478 HydrophobicContact CG-CB 3.71Å; S434-A478 VanDerWaalsContact OG-CA 3.23Å; S434-A478 WeakPolarHBondContact OG-CA 3.39Å; S434-A478 PolarHBondContact OG-N 2.98Å; S434-A478 VanDerWaalsContact OG-N 3.13Å; G474-A478 VanDerWaalsContact O-CB 3.28Å; G474-A478 WeakPolarHBondContact O-CB 3.41Å; G474-A478 PolarHBondContact O-N 2.8Å; G475-A478 PolarHBondContact O-N 3.29Å; A478-D482 WeakPolarHBondContact O-CB 3.45Å; A478-D482 PolarHBondContact O-N 3.35Å
479F91.9Very high91.3Very high69 Ų6945.6 Ų45.630%0.30325%0.25SC..Hα-helixtrans-60-50.4176.3177.2-101.3000112.4I153 T157 G475 F476 L477 N483I153-F479 HydrophobicContact CG1-CD2 4.45Å; I153-F479 HydrophobicContact CG1-CE2 4.29Å; T157-F479 HydrophobicContact CG2-CB 3.63Å; T157-F479 HydrophobicContact CG2-CD2 4.13Å; T157-F479 HydrophobicContact CG2-CG 4.39Å; T157-F479 WeakPolarHBondContact OG1-CA 3.49Å; G475-F479 WeakPolarHBondContact O-CB 3.38Å; G475-F479 PolarHBondContact O-N 3.22Å; F476-F479 WeakPolarHBondContact O-CB 3.45Å; F476-F479 PolarHBondContact O-N 3.26Å; L477-F479 VanDerWaalsContact C-N 3.32Å; L477-F479 PolarHBondContact O-N 3.09Å; F479-N483 WeakPolarHBondContact CD2-ND2 3.41Å; F479-N483 WeakPolarHBondContact CE2-ND2 3.39Å; F479-N483 WeakPolarHBondContact O-CB 3.17Å; F479-N483 PolarHBondContact O-N 2.95Å; F479-N483 PolarHBondContact O-ND2 3.3Å
480C93.7Very high91.3Very high40 Ų4051.4 Ų51.427%0.2728%0.277SS..Hα-helixtrans-62.8-47.9-179.5-73.50000111.3F476 L477 N483 T484F476-C480 VanDerWaalsContact CZ-SG 3.53Å; F476-C480 WeakPolarHBondContact O-CB 3.27Å; F476-C480 PolarHBondContact O-N 3.41Å; F476-C480 PolarHBondContact O-SG 3.4Å; F476-C480 VanDerWaalsContact O-SG 3.36Å; L477-C480 PolarHBondContact O-N 2.98Å; C480-N483 PolarHBondContact O-N 2.8Å; C480-T484 VanDerWaalsContact O-CB 3.31Å; C480-T484 WeakPolarHBondContact O-CB 3.47Å; C480-T484 VanDerWaalsContact O-CG2 3.22Å; C480-T484 WeakPolarHBondContact O-CG2 3.4Å; C480-T484 PolarHBondContact O-N 3.43Å; C480-T484 PolarHBondContact O-OG1 2.93Å
481L95.3Very high91.2Very high34 Ų3452 Ų5218%0.17828%0.279CS..Hα-helixtrans-70-40.1-176.9-65.8176.7000112.1V430 F433 L477 N483 T484 I485V430-L481 HydrophobicContact CB-CB 4.5Å; V430-L481 HydrophobicContact CG1-CB 4.09Å; V430-L481 HydrophobicContact CG2-CB 4Å; F433-L481 HydrophobicContact CD1-CD1 3.58Å; F433-L481 HydrophobicContact CE1-CD1 4.2Å; F433-L481 HydrophobicContact CG-CD1 4.45Å; L477-L481 VanDerWaalsContact O-CB 3.28Å; L477-L481 WeakPolarHBondContact O-CB 3.5Å; L477-L481 WeakPolarHBondContact O-CG 3.36Å; L477-L481 PolarHBondContact O-N 3.22Å; L481-N483 VanDerWaalsContact C-N 3.27Å; L481-N483 PolarHBondContact O-N 3.41Å; L481-T484 PolarHBondContact O-N 2.9Å; L481-I485 HydrophobicContact CB-CD1 4.14Å; L481-I485 HydrophobicContact CD2-CD1 4.24Å; L481-I485 WeakPolarHBondContact O-CB 3.45Å; L481-I485 VanDerWaalsContact O-CG1 3.3Å; L481-I485 WeakPolarHBondContact O-CG1 3.35Å; L481-I485 PolarHBondContact O-N 3.2Å
482D94Very high91.1Very high0 Ų053.2 Ų53.20%028%0.284CS..Hα-helixtrans-63.1-33.4176.7-175.434.8000112.1L156 R426 V430 A478 R492L156-D482 HydrophobicContact CD2-CB 4.31Å; R426-D482 PolarHBondContact NH2-O 3.45Å; R426-D482 IonicContact NH2-OD1 2.66Å; R426-D482 PolarHBondContact NH2-OD1 2.8Å; V430-D482 HydrophobicContact CG1-CB 4.26Å; A478-D482 WeakPolarHBondContact O-CB 3.45Å; A478-D482 PolarHBondContact O-N 3.35Å; D482-R492 VanDerWaalsContact CG-NE 3.29Å; D482-R492 IonicContact OD1-CZ 3.41Å; D482-R492 IonicContact OD1-NE 3.25Å; D482-R492 PolarHBondContact OD1-NE 3.21Å; D482-R492 IonicContact OD1-NH2 2.75Å; D482-R492 IonicContact OD2-CZ 3.65Å; D482-R492 IonicContact OD2-NE 3.54Å; D482-R492 PolarHBondContact OD2-NE 2.99Å; D482-R492 IonicContact OD2-NH2 3.48Å; D482-R492 PolarHBondContact OD2-NH2 3.47Å
483N91.2Very high90.9Very high52 Ų5250.8 Ų50.828%0.27827%0.274SS..Hα-helixtrans-90.5-21179.7-71.8-71.4000114.4Y152 F479 C480 L481 R492Y152-N483 PolarHBondContact O-ND2 3.45Å; F479-N483 WeakPolarHBondContact CD2-ND2 3.41Å; F479-N483 WeakPolarHBondContact CE2-ND2 3.39Å; F479-N483 WeakPolarHBondContact O-CB 3.17Å; F479-N483 PolarHBondContact O-N 2.95Å; F479-N483 PolarHBondContact O-ND2 3.3Å; C480-N483 PolarHBondContact O-N 2.8Å; L481-N483 VanDerWaalsContact C-N 3.27Å; L481-N483 PolarHBondContact O-N 3.41Å; N483-R492 PolarHBondContact OD1-NH2 3.04Å
484T93.1Very high90.5Very high102 Ų10250.9 Ų50.963%0.62627%0.274SS*.Hα-helixtrans-97.9-31.5-178.355.10000113.7C480 L481C480-T484 VanDerWaalsContact O-CB 3.31Å; C480-T484 WeakPolarHBondContact O-CB 3.47Å; C480-T484 VanDerWaalsContact O-CG2 3.22Å; C480-T484 WeakPolarHBondContact O-CG2 3.4Å; C480-T484 PolarHBondContact O-N 3.43Å; C480-T484 PolarHBondContact O-OG1 2.93Å; L481-T484 PolarHBondContact O-N 2.9Å
485I93.6Very high89.7Confident48 Ų4853.8 Ų53.825%0.24629%0.292CS..SBendtrans-77.8126.1177.5-58.6174.8000108.7R426 F429 V430 L481R426-I485 HydrophobicContact CG-CB 4.43Å; R426-I485 HydrophobicContact CG-CG2 3.74Å; R426-I485 VanDerWaalsContact CZ-O 3.26Å; R426-I485 PolarHBondContact NE-O 3.32Å; R426-I485 PolarHBondContact NH2-O 3.49Å; F429-I485 HydrophobicContact CD1-CD1 4.24Å; V430-I485 HydrophobicContact CG2-CD1 3.87Å; L481-I485 HydrophobicContact CB-CD1 4.14Å; L481-I485 HydrophobicContact CD2-CD1 4.24Å; L481-I485 WeakPolarHBondContact O-CB 3.45Å; L481-I485 VanDerWaalsContact O-CG1 3.3Å; L481-I485 WeakPolarHBondContact O-CG1 3.35Å; L481-I485 PolarHBondContact O-N 3.2Å
486P90.9Very high88.8Confident117 Ų11758.4 Ų58.476%0.7631%0.312SS*.  trans-57.8137.3-177.8-24.833.4000113R426R426-P486 VanDerWaalsContact CD-O 3.24Å; R426-P486 WeakPolarHBondContact CD-O 3.18Å; R426-P486 PolarHBondContact NE-O 2.94Å
487G86.8Confident87.9Confident45 Ų4553.9 Ų53.946%0.46429%0.291SS..  trans173.1169.2175.300000116R426 E491R426-G487 VanDerWaalsContact NH1-CA 3.34Å; G487-E491 VanDerWaalsContact C-OE1 3.23Å; G487-E491 WeakPolarHBondContact CA-OE1 3.31Å
488T89.1Confident86.4Confident77 Ų7754.7 Ų54.747%0.47230%0.3SS..  trans-83.9160.8-169.7690000113E490 E491 R492T488-E490 VanDerWaalsContact C-N 3.31Å; T488-E490 WeakPolarHBondContact CB-OE2 3.49Å; T488-E491 PolarHBondContact N-OE1 3.29Å; T488-E491 WeakPolarHBondContact O-CG 3.48Å; T488-E491 WeakPolarHBondContact OG1-CG 3.24Å; T488-E491 PolarHBondContact OG1-N 2.94Å; T488-R492 WeakPolarHBondContact O-CD 3.4Å; T488-R492 WeakPolarHBondContact O-CG 3.41Å; T488-R492 PolarHBondContact O-N 2.79Å
489R85.8Confident84.7Confident137 Ų13758 Ų5852%0.51732%0.323SS..THydrogen-bonded Turntrans-71.1-31.8177.6-79.6-173.3149.2-174.8-5.4111.6E151 G493 L494 V495E151-R489 IonicContact OE2-NH2 3.61Å; R489-G493 PolarHBondContact O-N 2.99Å; R489-L494 HydrophobicContact CB-CB 4.3Å; R489-L494 HydrophobicContact CG-CD1 4.21Å; R489-L494 WeakPolarHBondContact O-CB 3.42Å; R489-L494 PolarHBondContact O-N 3.29Å; R489-V495 HydrophobicContact CB-CG2 4.11Å
490E85.6Confident82.9Confident123 Ų12357.2 Ų57.258%0.57533%0.326SS*.THydrogen-bonded Turntrans-67-49.7178.2-63.170.2-154.100110.7T488 R492 G493 V495T488-E490 VanDerWaalsContact C-N 3.31Å; T488-E490 WeakPolarHBondContact CB-OE2 3.49Å; E490-R492 PolarHBondContact O-N 3.32Å; E490-G493 PolarHBondContact O-N 3.41Å; E490-V495 HydrophobicContact CG-CG2 3.84Å; E490-V495 WeakPolarHBondContact OE1-CG2 3.36Å
491E88.9Confident80.7Confident34 Ų3456.5 Ų56.516%0.15932%0.322CS..THydrogen-bonded Turntrans-64.3-33-178.375.3175.6164.400111.8D421 S424 R426 N427 G487 T488 G493D421-E491 HydrophobicContact CB-CB 4.31Å; D421-E491 PolarHBondContact N-O 3.45Å; S424-E491 PolarHBondContact OG-OE2 3.42Å; R426-E491 IonicContact CZ-OE1 2.77Å; R426-E491 IonicContact NE-OE1 3.72Å; R426-E491 IonicContact NH1-OE1 3.46Å; R426-E491 PolarHBondContact NH1-OE1 3.13Å; N427-E491 PolarHBondContact ND2-O 2.89Å; G487-E491 VanDerWaalsContact C-OE1 3.23Å; G487-E491 WeakPolarHBondContact CA-OE1 3.31Å; T488-E491 PolarHBondContact N-OE1 3.29Å; T488-E491 WeakPolarHBondContact O-CG 3.48Å; T488-E491 WeakPolarHBondContact OG1-CG 3.24Å; T488-E491 PolarHBondContact OG1-N 2.94Å; E491-G493 PolarHBondContact O-N 3.43Å
492R86.9Confident78.1Confident27 Ų2759.3 Ų59.310%0.10234%0.34CS..THydrogen-bonded Turntrans-71.6-10.8176-66.2172.974.7-175.3-3.4113.1D482 N483 T488 E490 L494D482-R492 VanDerWaalsContact CG-NE 3.29Å; D482-R492 IonicContact OD1-CZ 3.41Å; D482-R492 IonicContact OD1-NE 3.25Å; D482-R492 PolarHBondContact OD1-NE 3.21Å; D482-R492 IonicContact OD1-NH2 2.75Å; D482-R492 IonicContact OD2-CZ 3.65Å; D482-R492 IonicContact OD2-NE 3.54Å; D482-R492 PolarHBondContact OD2-NE 2.99Å; D482-R492 IonicContact OD2-NH2 3.48Å; D482-R492 PolarHBondContact OD2-NH2 3.47Å; N483-R492 PolarHBondContact OD1-NH2 3.04Å; T488-R492 WeakPolarHBondContact O-CD 3.4Å; T488-R492 WeakPolarHBondContact O-CG 3.41Å; T488-R492 PolarHBondContact O-N 2.79Å; E490-R492 PolarHBondContact O-N 3.32Å; R492-L494 VanDerWaalsContact C-N 3.3Å; R492-L494 HydrophobicContact CB-CD1 4.15Å; R492-L494 HydrophobicContact CB-CG 3.91Å; R492-L494 PolarHBondContact O-N 2.83Å
493G84.1Confident75.2Confident2 Ų262.6 Ų62.62%0.02137%0.367CS..THydrogen-bonded Turntrans77.910-174.700000115L419 R489 E490 E491 V495 Q496 W497L419-G493 WeakPolarHBondContact O-CA 3.4Å; R489-G493 PolarHBondContact O-N 2.99Å; E490-G493 PolarHBondContact O-N 3.41Å; E491-G493 PolarHBondContact O-N 3.43Å; G493-V495 VanDerWaalsContact C-N 3.32Å; G493-V495 PolarHBondContact O-N 3.12Å; G493-Q496 PolarHBondContact O-N 2.74Å; G493-W497 WeakPolarHBondContact O-CB 3.34Å; G493-W497 PolarHBondContact O-N 3.36Å
494L82.4Confident72.4Confident10 Ų1065.3 Ų65.35%0.05239%0.388CS..Hα-helixtrans-70.2-28.1-176.9-65.5175.8000112.4G154 R489 R492 S498G154-L494 VanDerWaalsContact CA-CD2 3.46Å; R489-L494 HydrophobicContact CB-CB 4.3Å; R489-L494 HydrophobicContact CG-CD1 4.21Å; R489-L494 WeakPolarHBondContact O-CB 3.42Å; R489-L494 PolarHBondContact O-N 3.29Å; R492-L494 VanDerWaalsContact C-N 3.3Å; R492-L494 HydrophobicContact CB-CD1 4.15Å; R492-L494 HydrophobicContact CB-CG 3.91Å; R492-L494 PolarHBondContact O-N 2.83Å; L494-S498 WeakPolarHBondContact O-CB 3.2Å; L494-S498 PolarHBondContact O-N 2.97Å; L494-S498 PolarHBondContact O-OG 2.98Å
495V78.1Confident69.6Low61 Ų6167.4 Ų67.437%0.3740%0.401SS..Hα-helixtrans-71.1-44.8176.9178.60000111.4R489 E490 G493 W497 S498 S499R489-V495 HydrophobicContact CB-CG2 4.11Å; E490-V495 HydrophobicContact CG-CG2 3.84Å; E490-V495 WeakPolarHBondContact OE1-CG2 3.36Å; G493-V495 VanDerWaalsContact C-N 3.32Å; G493-V495 PolarHBondContact O-N 3.12Å; V495-W497 VanDerWaalsContact C-N 3.31Å; V495-W497 PolarHBondContact O-N 3.33Å; V495-S498 WeakPolarHBondContact CA-OG 3.18Å; V495-S498 PolarHBondContact O-N 2.91Å; V495-S498 PolarHBondContact O-OG 3.36Å; V495-S498 VanDerWaalsContact O-OG 3.11Å; V495-S499 WeakPolarHBondContact O-CB 3.37Å; V495-S499 PolarHBondContact O-N 3.24Å; V495-S499 PolarHBondContact O-OG 2.97Å
496Q72.8Confident66.5Low104 Ų10470.2 Ų70.249%0.48643%0.425SS..Hα-helixtrans-69.7-33.5176.5-159.1175.31.600111.5L419 G493 S499 S500L419-Q496 HydrophobicContact CD2-CB 4.22Å; L419-Q496 VanDerWaalsContact CD2-CD 3.49Å; L419-Q496 HydrophobicContact CD2-CG 3.78Å; G493-Q496 PolarHBondContact O-N 2.74Å; Q496-S499 WeakPolarHBondContact CA-OG 3.33Å; Q496-S499 PolarHBondContact O-OG 3.43Å; Q496-S499 VanDerWaalsContact O-OG 3.1Å; Q496-S500 WeakPolarHBondContact O-CB 3.44Å; Q496-S500 PolarHBondContact O-N 2.78Å; Q496-S500 VanDerWaalsContact O-N 3.1Å; Q496-S500 PolarHBondContact O-OG 3.39Å
497W70.9Confident63.4Low14 Ų1467.1 Ų67.15%0.05341%0.414CS..Hα-helixtrans-65.8-47.9172-178-106.3000112.4P155 I158 I306 Y310 L419 G493 V495 S500 S501P155-W497 HydrophobicContact CG-CB 4.27Å; P155-W497 HydrophobicContact CG-CD2 4.31Å; P155-W497 HydrophobicContact CG-CE3 4.06Å; P155-W497 HydrophobicContact CG-CG 4.43Å; I158-W497 HydrophobicContact CD1-CH2 3.75Å; I158-W497 HydrophobicContact CD1-CZ2 3.89Å; I158-W497 HydrophobicContact CD1-CZ3 4.48Å; I306-W497 HydrophobicContact CG2-CZ2 4.09Å; Y310-W497 HydrophobicContact CD2-CH2 4.06Å; Y310-W497 HydrophobicContact CD2-CZ2 4.01Å; Y310-W497 HydrophobicContact CE2-CZ2 4.17Å; L419-W497 HydrophobicContact CD1-CE3 3.67Å; L419-W497 HydrophobicContact CD1-CZ3 4.29Å; G493-W497 WeakPolarHBondContact O-CB 3.34Å; G493-W497 PolarHBondContact O-N 3.36Å; V495-W497 VanDerWaalsContact C-N 3.31Å; V495-W497 PolarHBondContact O-N 3.33Å; W497-S500 CarbonylContact O-C 3.36Å; W497-S500 WeakPolarHBondContact O-CB 3.45Å; W497-S500 PolarHBondContact O-N 2.85Å; W497-S501 WeakPolarHBondContact O-CB 3.46Å; W497-S501 PolarHBondContact O-N 3Å; W497-S501 PolarHBondContact O-OG 3.3Å
498S65.4Low60.7Low53 Ų5372 Ų7237%0.37144%0.438SS..Hα-helixtrans-72.2-34.1-179.758.50000113.1L494 V495 S500 S501 T502L494-S498 WeakPolarHBondContact O-CB 3.2Å; L494-S498 PolarHBondContact O-N 2.97Å; L494-S498 PolarHBondContact O-OG 2.98Å; V495-S498 WeakPolarHBondContact CA-OG 3.18Å; V495-S498 PolarHBondContact O-N 2.91Å; V495-S498 PolarHBondContact O-OG 3.36Å; V495-S498 VanDerWaalsContact O-OG 3.11Å; S498-S500 VanDerWaalsContact C-N 3.33Å; S498-S501 CarbonylContact O-C 3.42Å; S498-S501 VanDerWaalsContact O-CA 3.32Å; S498-S501 WeakPolarHBondContact O-CA 3.38Å; S498-S501 WeakPolarHBondContact O-CB 3.46Å; S498-S501 PolarHBondContact O-N 3.01Å; S498-T502 WeakPolarHBondContact O-CB 3.41Å; S498-T502 PolarHBondContact O-N 3.32Å; S498-T502 PolarHBondContact O-OG1 2.9Å
499S59.3Low57.7Low68 Ų6872.3 Ų72.348%0.47645%0.448SS..Hα-helixtrans-68.6-32.5170.853.30000112.5V495 Q496 S501V495-S499 WeakPolarHBondContact O-CB 3.37Å; V495-S499 PolarHBondContact O-N 3.24Å; V495-S499 PolarHBondContact O-OG 2.97Å; Q496-S499 WeakPolarHBondContact CA-OG 3.33Å; Q496-S499 PolarHBondContact O-OG 3.43Å; Q496-S499 VanDerWaalsContact O-OG 3.1Å; S499-S501 PolarHBondContact O-N 2.74Å
500S52.6Low55.2Low53 Ų5377.7 Ų77.737%0.37147%0.468SS..Hα-helixtrans-67.7-20.5166.7-56.60000112.4P320 Q496 W497 S498P320-S500 VanDerWaalsContact CB-O 3.22Å; P320-S500 WeakPolarHBondContact CB-O 3.4Å; P320-S500 VanDerWaalsContact CG-O 3.25Å; P320-S500 WeakPolarHBondContact CG-O 3.21Å; Q496-S500 WeakPolarHBondContact O-CB 3.44Å; Q496-S500 PolarHBondContact O-N 2.78Å; Q496-S500 VanDerWaalsContact O-N 3.1Å; Q496-S500 PolarHBondContact O-OG 3.39Å; W497-S500 CarbonylContact O-C 3.36Å; W497-S500 WeakPolarHBondContact O-CB 3.45Å; W497-S500 PolarHBondContact O-N 2.85Å; S498-S500 VanDerWaalsContact C-N 3.33Å
501S47.8Very low52.6Low26 Ų2676.6 Ų76.618%0.18247%0.474CS..Hα-helixtrans-95.4-25.1-179.8-53.70000114.6Y310 W497 S498 S499Y310-S501 WeakPolarHBondContact CE1-OG 3.14Å; Y310-S501 WeakPolarHBondContact OH-CB 3.48Å; Y310-S501 PolarHBondContact OH-OG 3.31Å; Y310-S501 VanDerWaalsContact OH-OG 3.08Å; W497-S501 WeakPolarHBondContact O-CB 3.46Å; W497-S501 PolarHBondContact O-N 3Å; W497-S501 PolarHBondContact O-OG 3.3Å; S498-S501 CarbonylContact O-C 3.42Å; S498-S501 VanDerWaalsContact O-CA 3.32Å; S498-S501 WeakPolarHBondContact O-CA 3.38Å; S498-S501 WeakPolarHBondContact O-CB 3.46Å; S498-S501 PolarHBondContact O-N 3.01Å; S499-S501 PolarHBondContact O-N 2.74Å
502T41.1Very low50.1Low92 Ų9281.1 Ų81.156%0.56451%0.506SS*.  trans-136.5100.2-168.6-17.30000108.7S498S498-T502 WeakPolarHBondContact O-CB 3.41Å; S498-T502 PolarHBondContact O-N 3.32Å; S498-T502 PolarHBondContact O-OG1 2.9Å
503A32.2Very low48Very low69 Ų6982.7 Ų82.757%0.5753%0.531SS*.  trans-78.9144.9158.200000108.4T505A503-T505 PolarHBondContact O-N 3.45Å
504P33.4Very low46.6Very low109 Ų10984.6 Ų84.671%0.70854%0.544SS*.  trans-67.3127.1-163.525.4-32.5000112.3S506P504-S506 PolarHBondContact O-N 2.77Å
505T33Very low45.9Very low147 Ų14787.5 Ų87.590%0.90256%0.562SS**  trans-80.49.1166.333.20000113.4A503A503-T505 PolarHBondContact O-N 3.45Å
506S29.5Very low46Very low107 Ų10785 Ų8575%0.74855%0.548SS*.  trans-10582.317747.80000111P504P504-S506 PolarHBondContact O-N 2.77Å
507G25.8Very low46.6Very low52 Ų5280.3 Ų80.354%0.53653%0.525SS..SBendtrans-167133.8167.200000110.3A509G507-A509 PolarHBondContact O-N 2.84Å
508P29Very low47.3Very low147 Ų14780.8 Ų80.896%0.95553%0.529SS*.SBendtrans-78.868178.833.8-32.6000109.8
509A27.6Very low48.2Very low83 Ų8380.6 Ų80.669%0.68652%0.521SS*.SBendtrans-160.3111.8165.200000108.8G507 S511G507-A509 PolarHBondContact O-N 2.84Å; A509-S511 PolarHBondContact O-N 3.06Å
510R32.4Very low49.2Very low251 Ų25181 Ų8195%0.94752%0.523SS*.  trans-54.599.5161.5-82.1172.2163.9162.9-3.9108.4
511S31.6Very low50.6Low99 Ų9984.6 Ų84.669%0.69254%0.542SS*.  trans-62.7134.6152.354.20000106.8A509 G513A509-S511 PolarHBondContact O-N 3.06Å; S511-G513 PolarHBondContact O-N 2.81Å
512P35.4Very low52.1Low129 Ų12985.1 Ų85.184%0.83855%0.552SS**  trans-58.6113.3-177.522.6-29.9000107.9S514P512-S514 PolarHBondContact O-N 3.16Å
513G43.7Very low54.1Low60 Ų6082 Ų8262%0.61953%0.531SS*.  trans-51.8127.8-171.100000111.3S511 T515S511-G513 PolarHBondContact O-N 2.81Å; G513-T515 PolarHBondContact O-N 3.18Å
514S53.9Low56.3Low42 Ų4281.7 Ų81.729%0.29454%0.535SS..  trans-48.3100.6177.2172.70000111T319 P512 S516T319-S514 WeakPolarHBondContact OG1-CB 3.32Å; T319-S514 PolarHBondContact OG1-OG 2.92Å; T319-S514 VanDerWaalsContact OG1-OG 3.06Å; P512-S514 PolarHBondContact O-N 3.16Å; S514-S516 PolarHBondContact O-N 3.07Å; S514-S516 WeakPolarHBondContact OG-CB 3.35Å; S514-S516 PolarHBondContact OG-OG 2.63Å
515T67.5Low58.5Low71 Ų7181.2 Ų81.244%0.43653%0.53SS..G310 helixtrans-63-8.3174.244.30000112.7E6 R73 G513 Y517 D518E6-T515 PolarHBondContact OE1-OG1 3.42Å; R73-T515 PolarHBondContact NH1-O 3.25Å; G513-T515 PolarHBondContact O-N 3.18Å; T515-Y517 PolarHBondContact O-N 3.25Å; T515-D518 PolarHBondContact O-N 3.33Å
516S80.3Confident60.8Low10 Ų1075.1 Ų75.17%0.0749%0.492CS..G310 helixtrans-56.5-34.3-178.1-57.40000112.4E6 R73 R367 S514E6-S516 PolarHBondContact OE1-N 3.1Å; E6-S516 PolarHBondContact OE1-OG 2.96Å; R73-S516 PolarHBondContact NH1-O 3.29Å; R367-S516 PolarHBondContact NH1-O 3.17Å; S514-S516 PolarHBondContact O-N 3.07Å; S514-S516 WeakPolarHBondContact OG-CB 3.35Å; S514-S516 PolarHBondContact OG-OG 2.63Å
517Y85.7Confident63.3Low5 Ų576.8 Ų76.82%0.0248%0.482CS..G310 helixtrans-105.6-0.8-175.5-60.3-74.4000115V72 L74 T319 P321 P322 A325 R328 T515V72-Y517 WeakPolarHBondContact O-CD1 3.34Å; L74-Y517 HydrophobicContact CD2-CE1 3.88Å; L74-Y517 WeakPolarHBondContact CD2-OH 3.39Å; L74-Y517 HydrophobicContact CG-CE1 4.04Å; T319-Y517 WeakPolarHBondContact O-CE2 3.44Å; T319-Y517 PolarHBondContact O-OH 3.49Å; P321-Y517 HydrophobicContact CB-CE1 4.05Å; P322-Y517 HydrophobicContact CG-CD2 4.32Å; P322-Y517 HydrophobicContact CG-CG 4.42Å; A325-Y517 HydrophobicContact CB-CD1 3.64Å; A325-Y517 HydrophobicContact CB-CE1 4.27Å; A325-Y517 HydrophobicContact CB-CG 4.07Å; R328-Y517 PolarHBondContact NH1-O 2.88Å; R328-Y517 PolarHBondContact NH2-O 3.16Å; T515-Y517 PolarHBondContact O-N 3.25Å
518D85.3Confident66Low24 Ų2485 Ų8513%0.12850%0.497CS..SBendtrans-67.1168.4177.3-88.3-9.9000111.8R73 T515 M523 R527R73-D518 WeakPolarHBondContact CD-O 3.36Å; R73-D518 PolarHBondContact NE-O 3.36Å; R73-D518 PolarHBondContact NH1-O 2.85Å; T515-D518 PolarHBondContact O-N 3.33Å; D518-M523 HydrophobicContact CB-CE 3.94Å; D518-M523 HydrophobicContact CB-CG 3.94Å; D518-M523 HydrophobicContact CB-SD 3.91Å; D518-M523 WeakPolarHBondContact OD1-CE 3.5Å; D518-M523 WeakPolarHBondContact OD2-CE 3.46Å; D518-R527 IonicContact OD2-CZ 3.79Å; D518-R527 IonicContact OD2-NH2 2.73Å; D518-R527 PolarHBondContact OD2-NH2 2.91Å
519F84.1Confident68.5Low48 Ų4880.7 Ų80.721%0.21147%0.468CS..  trans-72.6146170.9-70-60.6000111.3I70 V521 M523 V526 P539I70-F519 HydrophobicContact CG2-CE1 4.5Å; F519-V521 PolarHBondContact O-N 3.36Å; F519-M523 HydrophobicContact CB-CG 4.06Å; F519-M523 HydrophobicContact CB-SD 3.83Å; F519-M523 HydrophobicContact CD2-SD 3.94Å; F519-M523 HydrophobicContact CG-SD 4.3Å; F519-M523 PolarHBondContact N-SD 2.81Å; F519-M523 VanDerWaalsContact O-CG 3.25Å; F519-M523 WeakPolarHBondContact O-CG 3.27Å; F519-V526 HydrophobicContact CD2-CG2 4.18Å; F519-P539 HydrophobicContact CD2-CG 3.67Å; F519-P539 HydrophobicContact CE2-CG 3.71Å; F519-P539 HydrophobicContact CG-CG 4.28Å; F519-P539 HydrophobicContact CZ-CG 4.32Å
520P81.7Confident70.9Confident78 Ų7887 Ų8751%0.50647%0.474SS..SBendtrans-65.6-28.2179.726.5-34.4000112.9
521V81.6Confident73.2Confident127 Ų12782.5 Ų82.577%0.7746%0.457SS*.SBendtrans-138.9147.9-179.4-174.20000108.9F519F519-V521 PolarHBondContact O-N 3.36Å
522G78.8Confident75.5Confident38 Ų3879.9 Ų79.939%0.39244%0.435SS..  trans85.94170.500000116G524 V525 V526G522-G524 PolarHBondContact O-N 3.12Å; G522-G524 VanDerWaalsContact O-N 3.14Å; G522-V525 PolarHBondContact O-N 2.91Å; G522-V526 WeakPolarHBondContact O-CG2 3.3Å; G522-V526 PolarHBondContact O-N 3.46Å
523M84.4Confident77.4Confident25 Ų2580.6 Ų80.612%0.12342%0.421CS..Hα-helixtrans-57.1-30.9179.5-79.6-60.3-59.400114.3D518 F519 V525 V526 R527 P539D518-M523 HydrophobicContact CB-CE 3.94Å; D518-M523 HydrophobicContact CB-CG 3.94Å; D518-M523 HydrophobicContact CB-SD 3.91Å; D518-M523 WeakPolarHBondContact OD1-CE 3.5Å; D518-M523 WeakPolarHBondContact OD2-CE 3.46Å; F519-M523 HydrophobicContact CB-CG 4.06Å; F519-M523 HydrophobicContact CB-SD 3.83Å; F519-M523 HydrophobicContact CD2-SD 3.94Å; F519-M523 HydrophobicContact CG-SD 4.3Å; F519-M523 PolarHBondContact N-SD 2.81Å; F519-M523 VanDerWaalsContact O-CG 3.25Å; F519-M523 WeakPolarHBondContact O-CG 3.27Å; M523-V525 VanDerWaalsContact C-N 3.32Å; M523-V525 PolarHBondContact O-N 3.26Å; M523-V526 PolarHBondContact O-N 3.36Å; M523-V526 HydrophobicContact SD-CB 4.44Å; M523-R527 HydrophobicContact CE-CG 4.05Å; M523-R527 WeakPolarHBondContact O-CB 3.43Å; M523-R527 WeakPolarHBondContact O-CG 3.38Å; M523-R527 PolarHBondContact O-N 3.46Å; M523-P539 HydrophobicContact CE-CB 4.04Å; M523-P539 HydrophobicContact CE-CG 4.39Å; M523-P539 HydrophobicContact SD-CB 4.29Å; M523-P539 HydrophobicContact SD-CG 3.99Å
524G77Confident79Confident63 Ų6386.7 Ų86.765%0.64943%0.425SS*.Hα-helixtrans-60.9-39.6174.100000112.9G522 R528G522-G524 PolarHBondContact O-N 3.12Å; G522-G524 VanDerWaalsContact O-N 3.14Å; G524-R528 WeakPolarHBondContact O-CB 3.29Å; G524-R528 PolarHBondContact O-N 2.91Å
525V80.9Confident80.4Confident99 Ų9986.8 Ų86.860%0.642%0.421SS*.Hα-helixtrans-74.3-41.3176.6-179.50000110.5G522 M523 R527 R528 T529G522-V525 PolarHBondContact O-N 2.91Å; M523-V525 VanDerWaalsContact C-N 3.32Å; M523-V525 PolarHBondContact O-N 3.26Å; V525-R527 PolarHBondContact O-N 3.18Å; V525-R528 PolarHBondContact O-N 3.41Å; V525-R528 VanDerWaalsContact O-N 3.17Å; V525-T529 PolarHBondContact O-N 3.01Å; V525-T529 VanDerWaalsContact O-N 3.07Å; V525-T529 PolarHBondContact O-OG1 2.94Å
526V81.1Confident81.1Confident19 Ų1984 Ų8412%0.11540%0.404CS..Hα-helixtrans-61.4-46.2179.8175.70000111.2F519 G522 M523 R528 T529 L532 T540F519-V526 HydrophobicContact CD2-CG2 4.18Å; G522-V526 WeakPolarHBondContact O-CG2 3.3Å; G522-V526 PolarHBondContact O-N 3.46Å; M523-V526 PolarHBondContact O-N 3.36Å; M523-V526 HydrophobicContact SD-CB 4.44Å; V526-R528 VanDerWaalsContact C-N 3.26Å; V526-R528 PolarHBondContact O-N 3.37Å; V526-T529 PolarHBondContact O-N 2.86Å; V526-L532 HydrophobicContact CB-CD1 4.29Å; V526-L532 HydrophobicContact CG1-CD1 4.1Å; V526-L532 HydrophobicContact CG2-CD1 4.23Å; V526-T540 HydrophobicContact CG1-CG2 3.98Å
527R81.7Confident81.3Confident142 Ų14284.8 Ų84.854%0.53641%0.407SS..Hα-helixtrans-66.1-27.4177.5-70.1178.6-178.3-173.23113D518 M523 V525 T540D518-R527 IonicContact OD2-CZ 3.79Å; D518-R527 IonicContact OD2-NH2 2.73Å; D518-R527 PolarHBondContact OD2-NH2 2.91Å; M523-R527 HydrophobicContact CE-CG 4.05Å; M523-R527 WeakPolarHBondContact O-CB 3.43Å; M523-R527 WeakPolarHBondContact O-CG 3.38Å; M523-R527 PolarHBondContact O-N 3.46Å; V525-R527 PolarHBondContact O-N 3.18Å; R527-T540 HydrophobicContact CG-CG2 4.19Å
528R81.9Confident81.2Confident224 Ų22485.1 Ų85.185%0.84541%0.41SS*.Hα-helixtrans-77.8-28.5178.1-158.8176.3-157.4171.65.8112.8G524 V525 V526 R530G524-R528 WeakPolarHBondContact O-CB 3.29Å; G524-R528 PolarHBondContact O-N 2.91Å; V525-R528 PolarHBondContact O-N 3.41Å; V525-R528 VanDerWaalsContact O-N 3.17Å; V526-R528 VanDerWaalsContact C-N 3.26Å; V526-R528 PolarHBondContact O-N 3.37Å; R528-R530 PolarHBondContact O-N 3.18Å
529T82.7Confident81Confident57 Ų5784.8 Ų84.835%0.3541%0.409SS..  trans-89.4104.3-172.7-510000111.2V525 V526 W531 L532V525-T529 PolarHBondContact O-N 3.01Å; V525-T529 VanDerWaalsContact O-N 3.07Å; V525-T529 PolarHBondContact O-OG1 2.94Å; V526-T529 PolarHBondContact O-N 2.86Å; T529-W531 VanDerWaalsContact C-N 3.32Å; T529-W531 PolarHBondContact O-N 3.25Å; T529-L532 HydrophobicContact CG2-CD1 4.11Å; T529-L532 HydrophobicContact CG2-CG 3.92Å; T529-L532 PolarHBondContact O-N 3.32Å
530R76.6Confident80.8Confident217 Ų21783.6 Ų83.682%0.81941%0.406SS*.G310 helixtrans-63-30.2-173.1-70.2-175.1-179.9-176.30.2114.7R528 L532 R533R528-R530 PolarHBondContact O-N 3.18Å; R530-L532 VanDerWaalsContact C-N 3.34Å; R530-R533 WeakPolarHBondContact O-CB 3.3Å; R530-R533 PolarHBondContact O-N 3.18Å
531W81.7Confident80.7Confident156 Ų15680.8 Ų80.859%0.59139%0.386SS*.G310 helixtrans-71.8-27.7-178.5-174.139.5000113.1T529 R533 R534 F535T529-W531 VanDerWaalsContact C-N 3.32Å; T529-W531 PolarHBondContact O-N 3.25Å; W531-R533 PolarHBondContact O-N 2.91Å; W531-R533 VanDerWaalsContact O-N 3.11Å; W531-R534 PolarHBondContact O-N 3.11Å; W531-F535 AromaticContact CD2-CE2 3.89Å; W531-F535 HydrophobicContact CD2-CE2 3.89Å; W531-F535 AromaticContact CE2-CE2 3.71Å; W531-F535 HydrophobicContact CE3-CE2 4.13Å; W531-F535 HydrophobicContact CG-CE2 4.46Å; W531-F535 HydrophobicContact CH2-CE2 4.07Å; W531-F535 AromaticContact CH2-CZ 3.87Å; W531-F535 HydrophobicContact CH2-CZ 3.87Å; W531-F535 AromaticContact CZ2-CE2 3.82Å; W531-F535 HydrophobicContact CZ2-CE2 3.82Å; W531-F535 AromaticContact CZ2-CZ 3.77Å; W531-F535 HydrophobicContact CZ2-CZ 3.77Å; W531-F535 HydrophobicContact CZ3-CE2 4.21Å; W531-F535 HydrophobicContact CZ3-CZ 4.33Å
532L79.9Confident80Confident44 Ų4481.3 Ų81.323%0.2339%0.389CS..G310 helixtrans-63.9-17.1177.1-66.2179000113.4V526 T529 R530 R534 F535 C538V526-L532 HydrophobicContact CB-CD1 4.29Å; V526-L532 HydrophobicContact CG1-CD1 4.1Å; V526-L532 HydrophobicContact CG2-CD1 4.23Å; T529-L532 HydrophobicContact CG2-CD1 4.11Å; T529-L532 HydrophobicContact CG2-CG 3.92Å; T529-L532 PolarHBondContact O-N 3.32Å; R530-L532 VanDerWaalsContact C-N 3.34Å; L532-R534 PolarHBondContact O-N 3.31Å; L532-F535 HydrophobicContact CD2-CD2 4.2Å; L532-F535 PolarHBondContact O-N 3.28Å; L532-C538 VanDerWaalsContact O-CB 3.23Å; L532-C538 WeakPolarHBondContact O-CB 3.44Å
533R75.8Confident79.4Confident144 Ų14480.8 Ų80.854%0.54338%0.384SS..G310 helixtrans-66-17.8172.2-64.1-174.1180-167.7-1.1113.7R530 W531 T540 F541R530-R533 WeakPolarHBondContact O-CB 3.3Å; R530-R533 PolarHBondContact O-N 3.18Å; W531-R533 PolarHBondContact O-N 2.91Å; W531-R533 VanDerWaalsContact O-N 3.11Å; R533-T540 PolarHBondContact N-OG1 3.25Å; R533-F541 WeakPolarHBondContact O-CD2 3.43Å
534R76.7Confident78.5Confident187 Ų18783.7 Ų83.771%0.70640%0.396SS*.G310 helixtrans-89.6-13.5178.6-57.9-172.8-156.8156.84.6113.2W531 L532 P536W531-R534 PolarHBondContact O-N 3.11Å; L532-R534 PolarHBondContact O-N 3.31Å; R534-P536 WeakPolarHBondContact O-CD 3.46Å
535F83.3Confident77.3Confident45 Ų4592.7 Ų92.720%0.19741%0.41CS..  trans-84.7118.9-177.9-79.2-89.5000110.3F142 W531 L532 I537 C538 F541F142-F535 AromaticContact CE2-CD1 3.96Å; F142-F535 HydrophobicContact CE2-CD1 3.96Å; F142-F535 HydrophobicContact CE2-CE1 4.04Å; F142-F535 AromaticContact CZ-CD1 3.92Å; F142-F535 HydrophobicContact CZ-CD1 3.92Å; F142-F535 AromaticContact CZ-CE1 3.66Å; F142-F535 HydrophobicContact CZ-CE1 3.66Å; W531-F535 AromaticContact CD2-CE2 3.89Å; W531-F535 HydrophobicContact CD2-CE2 3.89Å; W531-F535 AromaticContact CE2-CE2 3.71Å; W531-F535 HydrophobicContact CE3-CE2 4.13Å; W531-F535 HydrophobicContact CG-CE2 4.46Å; W531-F535 HydrophobicContact CH2-CE2 4.07Å; W531-F535 AromaticContact CH2-CZ 3.87Å; W531-F535 HydrophobicContact CH2-CZ 3.87Å; W531-F535 AromaticContact CZ2-CE2 3.82Å; W531-F535 HydrophobicContact CZ2-CE2 3.82Å; W531-F535 AromaticContact CZ2-CZ 3.77Å; W531-F535 HydrophobicContact CZ2-CZ 3.77Å; W531-F535 HydrophobicContact CZ3-CE2 4.21Å; W531-F535 HydrophobicContact CZ3-CZ 4.33Å; L532-F535 HydrophobicContact CD2-CD2 4.2Å; L532-F535 PolarHBondContact O-N 3.28Å; F535-I537 HydrophobicContact CB-CG1 4.47Å; F535-I537 PolarHBondContact O-N 3.28Å; F535-C538 HydrophobicContact CB-CB 4.22Å; F535-C538 WeakPolarHBondContact O-CB 3.19Å; F535-C538 PolarHBondContact O-N 3.3Å; F535-F541 WeakPolarHBondContact O-CB 3.31Å
536P81.9Confident75.6Confident13 Ų1392.6 Ų92.68%0.08441%0.41CS..THydrogen-bonded Turntrans-59.5-21.6-174.7-26.435.6000114.9H324 N327 R534 F541 F544H324-P536 WeakPolarHBondContact CA-O 3.36Å; H324-P536 WeakPolarHBondContact CB-O 3.27Å; N327-P536 PolarHBondContact ND2-O 2.92Å; R534-P536 WeakPolarHBondContact O-CD 3.46Å; P536-F541 HydrophobicContact CB-CE1 4.28Å; P536-F541 HydrophobicContact CB-CE2 4.47Å; P536-F541 HydrophobicContact CB-CZ 4.24Å; P536-F541 HydrophobicContact CG-CE2 4.34Å; P536-F541 HydrophobicContact CG-CZ 4.36Å; P536-F544 HydrophobicContact CG-CZ 4.12Å
537I85.2Confident73.4Confident26 Ų26100 Ų10013%0.13344%0.435CS..THydrogen-bonded Turntrans-87-11.8179.161.8171.2000113.9F142 N327 R328 F331 F535F142-I537 HydrophobicContact CD2-CD1 4.11Å; F142-I537 HydrophobicContact CE2-CD1 4.4Å; N327-I537 HydrophobicContact CB-CG2 4.36Å; R328-I537 HydrophobicContact CB-CB 4.12Å; R328-I537 WeakPolarHBondContact CD-O 3.32Å; R328-I537 HydrophobicContact CG-CB 4.45Å; F331-I537 HydrophobicContact CB-CG2 4.13Å; F331-I537 HydrophobicContact CG-CG2 4.35Å; F535-I537 HydrophobicContact CB-CG1 4.47Å; F535-I537 PolarHBondContact O-N 3.28Å
538C83.9Confident71.2Confident12 Ų12101.4 Ų101.48%0.08145%0.448CS..SBendtrans-84.8140.8-173.9-80.70000111.9H324 L532 F535 T540 F541H324-C538 WeakPolarHBondContact CB-O 3.42Å; L532-C538 VanDerWaalsContact O-CB 3.23Å; L532-C538 WeakPolarHBondContact O-CB 3.44Å; F535-C538 HydrophobicContact CB-CB 4.22Å; F535-C538 WeakPolarHBondContact O-CB 3.19Å; F535-C538 PolarHBondContact O-N 3.3Å; C538-T540 PolarHBondContact O-N 2.89Å; C538-F541 WeakPolarHBondContact O-CB 3.35Å; C538-F541 PolarHBondContact O-N 3.22Å
539P80.3Confident69.2Low17 Ų1797.5 Ų97.511%0.1144%0.439CS..THydrogen-bonded Turntrans-54.8-20.6175.5-26.232.4000116H324 F519 M523 F541H324-P539 VanDerWaalsContact CD2-CA 3.46Å; H324-P539 WeakPolarHBondContact CD2-CA 3.45Å; F519-P539 HydrophobicContact CD2-CG 3.67Å; F519-P539 HydrophobicContact CE2-CG 3.71Å; F519-P539 HydrophobicContact CG-CG 4.28Å; F519-P539 HydrophobicContact CZ-CG 4.32Å; M523-P539 HydrophobicContact CE-CB 4.04Å; M523-P539 HydrophobicContact CE-CG 4.39Å; M523-P539 HydrophobicContact SD-CB 4.29Å; M523-P539 HydrophobicContact SD-CG 3.99Å; P539-F541 VanDerWaalsContact C-N 3.34Å
540T79.1Confident67.1Low23 Ų23100.9 Ų100.914%0.14146%0.455CS..THydrogen-bonded Turntrans-90.21.5-179.964.20000113.6V526 R527 R533 C538V526-T540 HydrophobicContact CG1-CG2 3.98Å; R527-T540 HydrophobicContact CG-CG2 4.19Å; R533-T540 PolarHBondContact N-OG1 3.25Å; C538-T540 PolarHBondContact O-N 2.89Å
541F79.6Confident65Low19 Ų1996 Ų968%0.08345%0.445CS..  trans-75126176.5-178.1-107.1000110.7V323 H324 R533 F535 P536 C538 P539 G543 F544V323-F541 HydrophobicContact CG1-CE1 4.39Å; H324-F541 HydrophobicContact CB-CB 4.08Å; H324-F541 HydrophobicContact CB-CD1 4.28Å; R533-F541 WeakPolarHBondContact O-CD2 3.43Å; F535-F541 WeakPolarHBondContact O-CB 3.31Å; P536-F541 HydrophobicContact CB-CE1 4.28Å; P536-F541 HydrophobicContact CB-CE2 4.47Å; P536-F541 HydrophobicContact CB-CZ 4.24Å; P536-F541 HydrophobicContact CG-CE2 4.34Å; P536-F541 HydrophobicContact CG-CZ 4.36Å; C538-F541 WeakPolarHBondContact O-CB 3.35Å; C538-F541 PolarHBondContact O-N 3.22Å; P539-F541 VanDerWaalsContact C-N 3.34Å; F541-G543 VanDerWaalsContact CZ-C 3.45Å; F541-F544 HydrophobicContact CE1-CD2 4.5Å; F541-F544 HydrophobicContact CE1-CE2 4.4Å; F541-F544 HydrophobicContact CZ-CD1 4.3Å; F541-F544 HydrophobicContact CZ-CD2 4.07Å; F541-F544 HydrophobicContact CZ-CE1 4.23Å; F541-F544 HydrophobicContact CZ-CE2 4.01Å; F541-F544 HydrophobicContact CZ-CG 4.22Å; F541-F544 HydrophobicContact CZ-CZ 4.09Å
542T66.8Low62.8Low137 Ų13793.6 Ų93.684%0.8445%0.449SS*.  trans-10215.5-174.854.70000113.4
543G66.5Low60.7Low27 Ų2797.5 Ų97.528%0.27848%0.477SS..  trans94.6166.7-176.800000113.6F541F541-G543 VanDerWaalsContact CZ-C 3.45Å
544F66.2Low58.8Low87 Ų8799.7 Ų99.738%0.38249%0.494SS..  trans-72.6133.3168.3-63.3-80000108L148 P536 F541 V546L148-F544 HydrophobicContact CD1-CD2 4.35Å; L148-F544 HydrophobicContact CD1-CE2 4.12Å; L148-F544 HydrophobicContact CD1-CZ 4.34Å; L148-F544 HydrophobicContact CD2-CB 4.32Å; L148-F544 HydrophobicContact CD2-CD2 3.62Å; L148-F544 HydrophobicContact CD2-CE2 4.14Å; L148-F544 HydrophobicContact CD2-CG 4.04Å; L148-F544 HydrophobicContact CG-CD2 3.88Å; L148-F544 HydrophobicContact CG-CE2 3.86Å; P536-F544 HydrophobicContact CG-CZ 4.12Å; F541-F544 HydrophobicContact CE1-CD2 4.5Å; F541-F544 HydrophobicContact CE1-CE2 4.4Å; F541-F544 HydrophobicContact CZ-CD1 4.3Å; F541-F544 HydrophobicContact CZ-CD2 4.07Å; F541-F544 HydrophobicContact CZ-CE1 4.23Å; F541-F544 HydrophobicContact CZ-CE2 4.01Å; F541-F544 HydrophobicContact CZ-CG 4.22Å; F541-F544 HydrophobicContact CZ-CZ 4.09Å; F544-V546 PolarHBondContact O-N 3.17Å
545R52.2Low56.6Low252 Ų25294.2 Ų94.295%0.95150%0.496SS*.  trans-61.5109.4176.3-85-179170.5178.1-6.6108.4
546V45.4Very low54.1Low97 Ų97101 Ų10159%0.58853%0.528SS*.  trans-68.3135.9167.2-176.30000107.4F544 D550F544-V546 PolarHBondContact O-N 3.17Å; V546-D550 HydrophobicContact CG1-CB 4.02Å
547R33.8Very low51.7Low173 Ų173109.3 Ų109.365%0.65357%0.566SS**  trans-67.6137.8173.1-114.6166.195.11625.7107.7E549 D550R547-E549 IonicContact CZ-OE2 3.14Å; R547-E549 IonicContact NE-OE2 2.85Å; R547-E549 PolarHBondContact NE-OE2 3.2Å; R547-E549 IonicContact NH2-OE1 3.78Å; R547-E549 IonicContact NH2-OE2 2.72Å; R547-E549 PolarHBondContact NH2-OE2 3.34Å; R547-E549 PolarHBondContact O-N 3.11Å; R547-D550 PolarHBondContact O-N 2.91Å; R547-D550 VanDerWaalsContact O-N 3.12Å
548E36Very low49Very low173 Ų173117.5 Ų117.581%0.80861%0.606SS**G310 helixtrans-55-16.9179.2-91.9169.8156.200114.1D550 L551E548-D550 VanDerWaalsContact C-N 3.31Å; E548-D550 PolarHBondContact O-N 3.4Å; E548-L551 HydrophobicContact CG-CD1 4.41Å
549E40.6Very low46.4Very low141 Ų141121.6 Ų121.666%0.65964%0.641SS**G310 helixtrans-72.7-15.9178.8-69169.1148.900114.2R547R547-E549 IonicContact CZ-OE2 3.14Å; R547-E549 IonicContact NE-OE2 2.85Å; R547-E549 PolarHBondContact NE-OE2 3.2Å; R547-E549 IonicContact NH2-OE1 3.78Å; R547-E549 IonicContact NH2-OE2 2.72Å; R547-E549 PolarHBondContact NH2-OE2 3.34Å; R547-E549 PolarHBondContact O-N 3.11Å
550D37.4Very low44.2Very low128 Ų128123.9 Ų123.968%0.68467%0.668SS**G310 helixtrans-100.62.6-178.8-65.6-44.9000113.7V546 R547 E548V546-D550 HydrophobicContact CG1-CB 4.02Å; R547-D550 PolarHBondContact O-N 2.91Å; R547-D550 VanDerWaalsContact O-N 3.12Å; E548-D550 VanDerWaalsContact C-N 3.31Å; E548-D550 PolarHBondContact O-N 3.4Å
551L33.5Very low41.7Very low114 Ų114131.7 Ų131.760%0.59770%0.702SS**SBendtrans-80136.8174.5-75158.9000109.6E548E548-L551 HydrophobicContact CG-CD1 4.41Å
552P35.1Very low39.5Very low106 Ų106134.7 Ų134.769%0.68874%0.739SS**PPolyproline II helixtrans-57.8139.8168.325-30.6000108.5E554P552-E554 PolarHBondContact O-N 2.97Å; P552-E554 VanDerWaalsContact O-N 3.14Å
553P35.7Very low37.7Very low126 Ų126136.6 Ų136.682%0.81874%0.738SS**PPolyproline II helixtrans-55.6125.7178.621.8-30.7000108.5G555P553-G555 PolarHBondContact O-N 3.04Å
554E35.5Very low36Very low190 Ų190144.6 Ų144.689%0.88877%0.769SS**PPolyproline II helixtrans-54.1116.9171.2-72.9-172.9152.200107P552 E556P552-E554 PolarHBondContact O-N 2.97Å; P552-E554 VanDerWaalsContact O-N 3.14Å; E554-E556 PolarHBondContact O-N 3.34Å
555G31.3Very low34.1Very low73 Ų73148.6 Ų148.675%0.75379%0.793SS**PPolyproline II helixtrans-56.8118176.700000108.3P553 E557P553-G555 PolarHBondContact O-N 3.04Å; G555-E557 PolarHBondContact O-N 3.25Å; G555-E557 VanDerWaalsContact O-N 3.14Å
556E29.7Very low33.1Very low187 Ų187142 Ų14287%0.87478%0.783SS**PPolyproline II helixtrans-47.4122.7167.3-73.8179.1149.400108E554 M558E554-E556 PolarHBondContact O-N 3.34Å; E556-M558 PolarHBondContact O-N 3.05Å
557E31.8Very low32.5Very low188 Ų188145.8 Ų145.888%0.87980%0.8SS**  trans-47.5112.5163.8-71.2177.9142.400107.5G555 A559G555-E557 PolarHBondContact O-N 3.25Å; G555-E557 VanDerWaalsContact O-N 3.14Å; E557-A559 PolarHBondContact O-N 3.13Å
558M28Very low32.4Very low198 Ų198142.1 Ų142.198%0.97581%0.807SS**  trans-65.780.7163.7-84.9-158.7-159.400108.1E556 G560E556-M558 PolarHBondContact O-N 3.05Å; M558-G560 PolarHBondContact O-N 3.13Å
559A30.6Very low32Very low98 Ų98139.3 Ų139.381%0.8181%0.806SS**  trans-73.9107.4159.200000107.8E557E557-A559 PolarHBondContact O-N 3.13Å
560G32.4Very low31.7Very low65 Ų65140.8 Ų140.867%0.6782%0.818SS**  trans104.493.815600000115.8M558M558-G560 PolarHBondContact O-N 3.13Å
561Q28Very low31.5Very low186 Ų186140.4 Ų140.487%0.86982%0.822SS**  -160.4101.2129.4-105.2165.523.900107.7
562G33.4Very low31.4Very low83 Ų83140 Ų14086%0.85683%0.829SS**  trans-76.7116.8161.100000107.7
563E29.6Very low31.2Very low177 Ų177141.1 Ų141.183%0.82783%0.834SS**  trans-130.3133.1158.1-82.9-170152.600108.9
564E29.1Very low31Very low195 Ų195144.2 Ų144.291%0.91183%0.834SS**PPolyproline II helixtrans-60.7133.2-174.6-63.8169141.300111.5P566E564-P566 WeakPolarHBondContact O-CD 3.24Å
565L28.1Very low31.1Very low170 Ų170145.4 Ų145.489%0.8985%0.854SS**PPolyproline II helixtrans-76.1127.1163.8-83.2112.3000109.6
566P29.5Very low31.1Very low115 Ų115149.1 Ų149.175%0.74786%0.859SS**PPolyproline II helixtrans-86.4134.8159.113.43.2000110.6E564 A568E564-P566 WeakPolarHBondContact O-CD 3.24Å; P566-A568 PolarHBondContact O-N 3.07Å
567D33.8Very low31.1Very low175 Ų175147.1 Ų147.194%0.93686%0.859SS**  trans-45.4130165.7-91.9-41000112.2
568A30.9Very low31.1Very low97 Ų97144.8 Ų144.880%0.80286%0.857SS**  trans-140.3104.2163.700000111P566P566-A568 PolarHBondContact O-N 3.07Å
569S28.2Very low31.3Very low113 Ų113141.6 Ų141.679%0.7985%0.851SS**  trans-38.2132.6167.650.70000116.1
570L34.5Very low31.3Very low173 Ų173144.4 Ų144.491%0.90685%0.853SS**PPolyproline II helixtrans-64.2135.2160.7-79144000111.6
571P32.3Very low31.2Very low119 Ų119149.7 Ų149.777%0.77387%0.865SS**PPolyproline II helixtrans-99.4132.1157.520.1-3.3000111.7
572S31.2Very low31.5Very low107 Ų107147.1 Ų147.175%0.74887%0.865SS**PPolyproline II helixtrans-71.9137166.3132.30000111.2
573T31.7Very low31.3Very low128 Ų128152 Ų15279%0.78587%0.866SS**  trans-173.3113145.45.70000107.6
574K31.1Very low31.5Very low191 Ų191149.9 Ų149.983%0.8387%0.869SS**  37.7100.983.1-74.2-168.3-179.7-177.60113.3
575V37.2Very low31.7Very low216 Ų216145.8 Ų145.8100%1.30987%0.865SS**  -152.8099.2167.20000107.8

Retrieved 575 of 575 residues in 1336 ms (Link to these results)

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