A0A061IMY6_CRIGR Loading...

Ceramide synthase 1

AlphaFold DB , UniProt , Accession A0A061IMY6, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Cers1, Length 350 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
1M33.6Very low36.4Very low243 Ų243132.3 Ų132.3100%1.19785%0.847SS**  0120.50-81.517169.400108.3
2A33.4Very low38.3Very low103 Ų103128.4 Ų128.485%0.85184%0.836SS**  trans34.1100.4165.200000119
3A30.7Very low40.3Very low102 Ų102125.1 Ų125.184%0.84381%0.814SS**  trans-74.1124.9153.900000108.6A5A3-A5 PolarHBondContact O-N 3.05Å
4A33.1Very low42.4Very low97 Ų97123.5 Ų123.580%0.80279%0.79SS**  trans-66.4111.9176.300000109.9T6A4-T6 PolarHBondContact O-N 3.12Å
5A33.7Very low44.6Very low92 Ų92123.2 Ų123.276%0.7679%0.789SS**  trans-72.3109.4165.700000108.2A3 T7A3-A5 PolarHBondContact O-N 3.05Å; A5-T7 PolarHBondContact O-N 3.32Å; A5-T7 VanDerWaalsContact O-N 3.09Å
6T31.6Very low46.8Very low130 Ų130120.9 Ų120.980%0.79877%0.766SS**  trans-70.499.7169.3-36.10000107.7A4 T8A4-T6 PolarHBondContact O-N 3.12Å; T6-T8 PolarHBondContact O-N 2.82Å
7T34.7Very low49.1Very low129 Ų129114.3 Ų114.379%0.79173%0.725SS**  trans-65.597.4164.345.90000107.9A5 G9A5-T7 PolarHBondContact O-N 3.32Å; A5-T7 VanDerWaalsContact O-N 3.09Å; T7-G9 PolarHBondContact O-N 3.07Å; T7-G9 VanDerWaalsContact O-N 3.15Å
8T39.2Very low51.4Low126 Ų126111.1 Ų111.177%0.77371%0.706SS**  trans-60.1113.416344.40000107.4T6 L10T6-T8 PolarHBondContact O-N 2.82Å; T8-L10 PolarHBondContact O-N 3.11Å
9G35.3Very low53.4Low67 Ų67109.7 Ų109.769%0.69169%0.687SS**  trans-56.7132.2177.700000110.5T7 E11T7-G9 PolarHBondContact O-N 3.07Å; T7-G9 VanDerWaalsContact O-N 3.15Å; G9-E11 VanDerWaalsContact C-N 3.27Å; G9-E11 PolarHBondContact O-N 3.07Å
10L40.7Very low55.2Low181 Ų181107.6 Ų107.695%0.94868%0.68SS**  trans-61.795.2159-85134.7000106.8T8 A12T8-L10 PolarHBondContact O-N 3.11Å; L10-A12 PolarHBondContact O-N 2.96Å
11E54.2Low56.8Low185 Ų185106.6 Ų106.686%0.86467%0.667SS**PPolyproline II helixtrans-55132.1163.7-78-173.8149.900107.7G9G9-E11 VanDerWaalsContact C-N 3.27Å; G9-E11 PolarHBondContact O-N 3.07Å
12A59.9Low59.6Low86 Ų8695.5 Ų95.571%0.71161%0.613SS**PPolyproline II helixtrans-57.614317600000109.1L10 E14L10-A12 PolarHBondContact O-N 2.96Å; A12-E14 PolarHBondContact O-N 3.41Å
13P64.3Low62.4Low85 Ų8595.9 Ų95.955%0.55260%0.6SS**PPolyproline II helixtrans-52.2128.9179.9-22.630.6000110.2D130P13-D130 HydrophobicContact CB-CB 4.35Å
14E68.6Low65.3Low103 Ų10397.9 Ų97.948%0.48159%0.592SS.*PPolyproline II helixtrans-57.6133.3175.4-82.8-159.3153.400108.9A12 M16 Y265A12-E14 PolarHBondContact O-N 3.41Å; E14-M16 PolarHBondContact O-N 3.41Å; E14-Y265 PolarHBondContact OE2-OH 2.69Å
15P76.3Confident68.1Low119 Ų11997.7 Ų97.777%0.77357%0.57SS**PPolyproline II helixtrans-59.6139.7176.225.2-33000109.7
16M79.3Confident70.7Confident86 Ų8694 Ų9442%0.42454%0.539SS..PPolyproline II helixtrans-55.2133.5179.7-79.4-163.2-58.400110.5E14 K262E14-M16 PolarHBondContact O-N 3.41Å; M16-K262 HydrophobicContact SD-CG 4.06Å
17P86Confident73.5Confident9 Ų996.1 Ų96.16%0.05853%0.532CS..PPolyproline II helixtrans-68.8155.9-17829.8-36.3000111.1Q21 M22 L261 Y265P17-Q21 HydrophobicContact CB-CB 4Å; P17-M22 HydrophobicContact CG-CB 4.3Å; P17-L261 WeakPolarHBondContact O-CD2 3.22Å; P17-Y265 HydrophobicContact CB-CD2 4.5Å; P17-Y265 HydrophobicContact CB-CE2 4.28Å; P17-Y265 HydrophobicContact CG-CD1 3.91Å; P17-Y265 HydrophobicContact CG-CD2 3.71Å; P17-Y265 HydrophobicContact CG-CE1 4.06Å; P17-Y265 HydrophobicContact CG-CE2 3.86Å; P17-Y265 HydrophobicContact CG-CG 3.72Å
18S90.7Very high76.2Confident57 Ų5792.6 Ų92.640%0.39952%0.516SS..PPolyproline II helixtrans-69.9161.8163.375.90000110.9A20 Q21 M22S18-A20 VanDerWaalsContact C-N 3.26Å; S18-A20 PolarHBondContact O-N 2.87Å; S18-Q21 PolarHBondContact O-N 3.1Å; S18-Q21 VanDerWaalsContact O-N 3.14Å; S18-Q21 WeakPolarHBondContact OG-CG 3.21Å; S18-Q21 PolarHBondContact OG-N 3.46Å; S18-Q21 PolarHBondContact OG-OE1 2.98Å; S18-M22 WeakPolarHBondContact O-CB 3.41Å; S18-M22 PolarHBondContact O-N 2.78Å
19Y88.5Confident78.6Confident84 Ų8487.4 Ų87.433%0.32949%0.486SS..Hα-helixtrans-54.3-42.7175.2-94.2-92.2000113.1M22 L23 L256 Y257 P260 L261Y19-M22 HydrophobicContact CD1-CE 4.2Å; Y19-M22 HydrophobicContact CE1-CE 4.36Å; Y19-M22 PolarHBondContact O-N 3.22Å; Y19-L23 WeakPolarHBondContact O-CB 3.26Å; Y19-L23 WeakPolarHBondContact O-CG 3.37Å; Y19-L23 PolarHBondContact O-N 3.42Å; Y19-L256 PolarHBondContact OH-O 3.37Å; Y19-Y257 AromaticContact CE2-CD2 3.64Å; Y19-Y257 HydrophobicContact CE2-CD2 3.64Å; Y19-Y257 AromaticContact CE2-CE2 3.9Å; Y19-Y257 HydrophobicContact CE2-CE2 3.9Å; Y19-Y257 WeakPolarHBondContact OH-CA 3.18Å; Y19-Y257 PolarHBondContact OH-O 3.36Å; Y19-P260 HydrophobicContact CE1-CB 4.05Å; Y19-P260 HydrophobicContact CE1-CG 4.38Å; Y19-L261 HydrophobicContact CD2-CD1 4.39Å; Y19-L261 HydrophobicContact CD2-CD2 4.05Å; Y19-L261 HydrophobicContact CD2-CG 4.42Å; Y19-L261 HydrophobicContact CE2-CD1 3.83Å; Y19-L261 HydrophobicContact CE2-CD2 3.91Å; Y19-L261 HydrophobicContact CE2-CG 3.81Å; Y19-L261 HydrophobicContact CG-CD2 4.48Å
20A89.6Confident81.1Confident68 Ų6885.5 Ų85.556%0.56246%0.463SS*.Hα-helixtrans-63.5-44.9178.700000111.2S18 L23 Q24S18-A20 VanDerWaalsContact C-N 3.26Å; S18-A20 PolarHBondContact O-N 2.87Å; A20-L23 PolarHBondContact O-N 3.28Å; A20-Q24 VanDerWaalsContact O-CB 3.28Å; A20-Q24 WeakPolarHBondContact O-CB 3.4Å; A20-Q24 PolarHBondContact O-N 2.74Å
21Q90Very high83.5Confident87 Ų8779.6 Ų79.641%0.40743%0.432SS..Hα-helixtrans-63.8-43.9176.7-72.7170.9-24.800111.7P17 S18 Q24 R25P17-Q21 HydrophobicContact CB-CB 4Å; S18-Q21 PolarHBondContact O-N 3.1Å; S18-Q21 VanDerWaalsContact O-N 3.14Å; S18-Q21 WeakPolarHBondContact OG-CG 3.21Å; S18-Q21 PolarHBondContact OG-N 3.46Å; S18-Q21 PolarHBondContact OG-OE1 2.98Å; Q21-Q24 PolarHBondContact O-N 3.23Å; Q21-R25 VanDerWaalsContact O-CB 3.23Å; Q21-R25 WeakPolarHBondContact O-CB 3.49Å; Q21-R25 VanDerWaalsContact O-CG 3.22Å; Q21-R25 WeakPolarHBondContact O-CG 3.46Å; Q21-R25 PolarHBondContact O-N 3.15Å
22M92.4Very high85.1Confident10 Ų1073.8 Ų73.85%0.04942%0.415CS..Hα-helixtrans-57.7-53176179.8-15974.700110.4P17 S18 Y19 Q24 R25 S26 P260 L261 Y265P17-M22 HydrophobicContact CG-CB 4.3Å; S18-M22 WeakPolarHBondContact O-CB 3.41Å; S18-M22 PolarHBondContact O-N 2.78Å; Y19-M22 HydrophobicContact CD1-CE 4.2Å; Y19-M22 HydrophobicContact CE1-CE 4.36Å; Y19-M22 PolarHBondContact O-N 3.22Å; M22-Q24 PolarHBondContact O-N 3.02Å; M22-R25 PolarHBondContact O-N 2.73Å; M22-S26 WeakPolarHBondContact O-CB 3.41Å; M22-S26 PolarHBondContact O-N 3.4Å; M22-S26 PolarHBondContact O-OG 3.49Å; M22-P260 HydrophobicContact CE-CB 4.07Å; M22-P260 HydrophobicContact SD-CB 3.77Å; M22-L261 HydrophobicContact CB-CD2 4.3Å; M22-L261 HydrophobicContact SD-CD2 4.06Å; M22-Y265 HydrophobicContact CB-CD2 4.43Å; M22-Y265 HydrophobicContact CG-CD2 4.15Å
23L90.9Very high86.3Confident111 Ų11171 Ų7158%0.58139%0.393SS*.Hα-helixtrans-60.7-46.9-179.2-71.9172.8000111.7Y19 A20 W27Y19-L23 WeakPolarHBondContact O-CB 3.26Å; Y19-L23 WeakPolarHBondContact O-CG 3.37Å; Y19-L23 PolarHBondContact O-N 3.42Å; A20-L23 PolarHBondContact O-N 3.28Å; L23-W27 WeakPolarHBondContact O-CB 3.48Å; L23-W27 PolarHBondContact O-N 3.34Å
24Q92.8Very high87.3Confident144 Ų14469.5 Ų69.567%0.67339%0.387SS*.Hα-helixtrans-62.2-47.4180-175.3-177.8-0.600112A20 Q21 M22 A28A20-Q24 VanDerWaalsContact O-CB 3.28Å; A20-Q24 WeakPolarHBondContact O-CB 3.4Å; A20-Q24 PolarHBondContact O-N 2.74Å; Q21-Q24 PolarHBondContact O-N 3.23Å; M22-Q24 PolarHBondContact O-N 3.02Å; Q24-A28 WeakPolarHBondContact O-CB 3.35Å; Q24-A28 PolarHBondContact O-N 3.18Å
25R90.8Very high88.1Confident92 Ų9274.5 Ų74.535%0.34740%0.402SS..Hα-helixtrans-68.1-46.7-179-72.1178.4180-167.9-0.5111.7Q21 M22 W27 A28 S29 Y265Q21-R25 VanDerWaalsContact O-CB 3.23Å; Q21-R25 WeakPolarHBondContact O-CB 3.49Å; Q21-R25 VanDerWaalsContact O-CG 3.22Å; Q21-R25 WeakPolarHBondContact O-CG 3.46Å; Q21-R25 PolarHBondContact O-N 3.15Å; M22-R25 PolarHBondContact O-N 2.73Å; R25-W27 VanDerWaalsContact C-N 3.33Å; R25-W27 PolarHBondContact O-N 3.17Å; R25-A28 PolarHBondContact O-N 2.88Å; R25-S29 WeakPolarHBondContact O-CB 3.43Å; R25-S29 PolarHBondContact O-N 3.14Å; R25-S29 PolarHBondContact O-OG 3.05Å; R25-Y265 HydrophobicContact CB-CE2 4.49Å; R25-Y265 PolarHBondContact NH1-OH 3.37Å
26S89.5Confident88.2Confident16 Ų1672 Ų7211%0.11240%0.397CS..Hα-helixtrans-61.4-41.8177.3-66.80000111.6M22 A30 C268M22-S26 WeakPolarHBondContact O-CB 3.41Å; M22-S26 PolarHBondContact O-N 3.4Å; M22-S26 PolarHBondContact O-OG 3.49Å; S26-A30 VanDerWaalsContact O-CB 3.31Å; S26-A30 WeakPolarHBondContact O-CB 3.39Å; S26-A30 PolarHBondContact O-N 3.27Å; S26-C268 WeakPolarHBondContact OG-CB 3.45Å
27W89.9Confident88Confident173 Ų17370.9 Ų70.966%0.65540%0.397SS*.Hα-helixtrans-64.5-46176.1-178.9-110.2000112.3L23 R25 S29 A30 L31L23-W27 WeakPolarHBondContact O-CB 3.48Å; L23-W27 PolarHBondContact O-N 3.34Å; R25-W27 VanDerWaalsContact C-N 3.33Å; R25-W27 PolarHBondContact O-N 3.17Å; W27-S29 PolarHBondContact O-N 2.82Å; W27-A30 PolarHBondContact O-N 2.73Å; W27-L31 HydrophobicContact CD2-CD1 4.33Å; W27-L31 HydrophobicContact CD2-CG 4.33Å; W27-L31 HydrophobicContact CG-CD1 4.4Å; W27-L31 HydrophobicContact CZ2-CD1 4.06Å; W27-L31 HydrophobicContact CZ2-CD2 4.06Å; W27-L31 HydrophobicContact CZ2-CG 4.15Å; W27-L31 WeakPolarHBondContact O-CB 3.19Å; W27-L31 WeakPolarHBondContact O-CG 3.4Å; W27-L31 PolarHBondContact O-N 3.12Å
28A91.1Very high87.1Confident55 Ų5573.8 Ų73.846%0.45543%0.429SS..Hα-helixtrans-61.3-44.3177.300000112Q24 R25 L31 A32Q24-A28 WeakPolarHBondContact O-CB 3.35Å; Q24-A28 PolarHBondContact O-N 3.18Å; R25-A28 PolarHBondContact O-N 2.88Å; A28-L31 PolarHBondContact O-N 2.64Å; A28-A32 WeakPolarHBondContact O-CB 3.43Å; A28-A32 PolarHBondContact O-N 3.19Å
29S89.5Confident86Confident18 Ų1877.7 Ų77.713%0.12645%0.445CS..Hα-helixtrans-61.7-46.8175.8-73.80000112.2R25 W27 L31 A32 A33 C268 H269R25-S29 WeakPolarHBondContact O-CB 3.43Å; R25-S29 PolarHBondContact O-N 3.14Å; R25-S29 PolarHBondContact O-OG 3.05Å; W27-S29 PolarHBondContact O-N 2.82Å; S29-L31 PolarHBondContact O-N 3.1Å; S29-A32 PolarHBondContact O-N 2.85Å; S29-A33 WeakPolarHBondContact O-CB 3.45Å; S29-A33 PolarHBondContact O-N 3.26Å; S29-C268 WeakPolarHBondContact CB-O 3.47Å; S29-H269 PolarHBondContact OG-ND1 3.16Å
30A88.9Confident85Confident26 Ų2678.9 Ų78.922%0.21547%0.465CS..Hα-helixtrans-63-41.717800000112.1S26 W27 A33 A34S26-A30 VanDerWaalsContact O-CB 3.31Å; S26-A30 WeakPolarHBondContact O-CB 3.39Å; S26-A30 PolarHBondContact O-N 3.27Å; W27-A30 PolarHBondContact O-N 2.73Å; A30-A33 PolarHBondContact O-N 3.25Å; A30-A34 VanDerWaalsContact O-CB 3.3Å; A30-A34 WeakPolarHBondContact O-CB 3.28Å; A30-A34 PolarHBondContact O-N 3.12Å
31L89.5Confident84.3Confident58 Ų5877.8 Ų77.830%0.30446%0.46SS..Hα-helixtrans-65.1-41.3175.6-78.3179.6000112.5W27 A28 S29 A34 R35W27-L31 HydrophobicContact CD2-CD1 4.33Å; W27-L31 HydrophobicContact CD2-CG 4.33Å; W27-L31 HydrophobicContact CG-CD1 4.4Å; W27-L31 HydrophobicContact CZ2-CD1 4.06Å; W27-L31 HydrophobicContact CZ2-CD2 4.06Å; W27-L31 HydrophobicContact CZ2-CG 4.15Å; W27-L31 WeakPolarHBondContact O-CB 3.19Å; W27-L31 WeakPolarHBondContact O-CG 3.4Å; W27-L31 PolarHBondContact O-N 3.12Å; A28-L31 PolarHBondContact O-N 2.64Å; S29-L31 PolarHBondContact O-N 3.1Å; L31-A34 PolarHBondContact O-N 2.98Å; L31-R35 WeakPolarHBondContact O-CB 3.32Å; L31-R35 VanDerWaalsContact O-CG 3.31Å; L31-R35 WeakPolarHBondContact O-CG 3.38Å; L31-R35 PolarHBondContact O-N 3.33Å
32A87.8Confident83.4Confident62 Ų6284.2 Ų84.251%0.51248%0.481SS..Hα-helixtrans-62.9-47176.800000111A28 S29 A34 R35 G36A28-A32 WeakPolarHBondContact O-CB 3.43Å; A28-A32 PolarHBondContact O-N 3.19Å; S29-A32 PolarHBondContact O-N 2.85Å; A32-A34 VanDerWaalsContact C-N 3.31Å; A32-A34 PolarHBondContact O-N 3.14Å; A32-R35 PolarHBondContact O-N 3.42Å; A32-G36 PolarHBondContact O-N 3.36Å
33A85.4Confident82.7Confident28 Ų2885.8 Ų85.823%0.23150%0.5CS..Hα-helixtrans-60.9-39.6175.200000112.1S29 A30 G36 C37 L272 Y281 F282S29-A33 WeakPolarHBondContact O-CB 3.45Å; S29-A33 PolarHBondContact O-N 3.26Å; A30-A33 PolarHBondContact O-N 3.25Å; A33-G36 PolarHBondContact O-N 2.86Å; A33-C37 PolarHBondContact O-N 3.39Å; A33-L272 HydrophobicContact CB-CD1 3.95Å; A33-Y281 HydrophobicContact CB-CE1 4.45Å; A33-F282 HydrophobicContact CB-CE2 4.26Å; A33-F282 HydrophobicContact CB-CZ 3.78Å
34A85.4Confident82.1Confident53 Ų5384.7 Ų84.744%0.43849%0.494SS..Hα-helixtrans-67.2-39.9178.900000111.8A30 L31 A32 C37 F282A30-A34 VanDerWaalsContact O-CB 3.3Å; A30-A34 WeakPolarHBondContact O-CB 3.28Å; A30-A34 PolarHBondContact O-N 3.12Å; L31-A34 PolarHBondContact O-N 2.98Å; A32-A34 VanDerWaalsContact C-N 3.31Å; A32-A34 PolarHBondContact O-N 3.14Å; A34-C37 WeakPolarHBondContact O-CB 3.37Å; A34-C37 PolarHBondContact O-N 2.83Å; A34-F282 HydrophobicContact CB-CE1 4.48Å; A34-F282 HydrophobicContact CB-CZ 4Å
35R86.2Confident81.5Confident209 Ų20979.7 Ų79.779%0.78948%0.477SS*.Hα-helixtrans-70.1-30.3176.8-72.7174.3-177.8167.50.9113.1L31 A32 C37L31-R35 WeakPolarHBondContact O-CB 3.32Å; L31-R35 VanDerWaalsContact O-CG 3.31Å; L31-R35 WeakPolarHBondContact O-CG 3.38Å; L31-R35 PolarHBondContact O-N 3.33Å; A32-R35 PolarHBondContact O-N 3.42Å; R35-C37 VanDerWaalsContact C-N 3.28Å
36G77.9Confident81.1Confident65 Ų6584.3 Ų84.367%0.6750%0.495SS*.THydrogen-bonded Turntrans-77.5-8.917600000114.4A32 A33 G38A32-G36 PolarHBondContact O-N 3.36Å; A33-G36 PolarHBondContact O-N 2.86Å; G36-G38 PolarHBondContact O-N 3.34Å
37C75.4Confident80.7Confident63 Ų6391 Ų9143%0.42652%0.518SS..  trans-80.889.2-176.4-162.30000111.1A33 A34 R35A33-C37 PolarHBondContact O-N 3.39Å; A34-C37 WeakPolarHBondContact O-CB 3.37Å; A34-C37 PolarHBondContact O-N 2.83Å; R35-C37 VanDerWaalsContact C-N 3.28Å
38G67.1Low80.3Confident71 Ų7183.4 Ų83.473%0.73249%0.492SS*.  trans-79.8-32.9177.200000114.4G36G36-G38 PolarHBondContact O-N 3.34Å
39D66.9Low79.9Confident138 Ų13885 Ų8574%0.73849%0.493SS*.  trans-119.990.4-178.3-72.8-34.5000110.3L44D39-L44 HydrophobicContact CB-CD2 4.49Å; D39-L44 WeakPolarHBondContact O-CD2 3.4Å
40C67.4Low79.5Confident110 Ų11088.1 Ų88.174%0.74352%0.52SS*.  trans-110129.5173.354.50000110.5
41G74.8Confident79.1Confident44 Ų4492.7 Ų92.745%0.45454%0.537SS..SBendtrans175.5163.3178.900000115.1G43 L44 A45G41-G43 VanDerWaalsContact C-N 3.29Å; G41-G43 PolarHBondContact O-N 3.34Å; G41-L44 PolarHBondContact O-N 3.08Å; G41-A45 PolarHBondContact O-N 2.91Å; G41-A45 VanDerWaalsContact O-N 3.08Å
42W72.2Confident78.8Confident222 Ų22292.1 Ų92.184%0.84153%0.533SS*.Hα-helixtrans-59.3-36.4-178.3-177.1-110.6000113.5A45 R46W42-A45 PolarHBondContact O-N 2.97Å; W42-R46 WeakPolarHBondContact O-CB 3.33Å; W42-R46 PolarHBondContact O-N 3.13Å
43G76.8Confident78.7Confident44 Ų4490.8 Ų90.845%0.45452%0.521SS..Hα-helixtrans-67.4-36.617800000113.6G41 R47G41-G43 VanDerWaalsContact C-N 3.29Å; G41-G43 PolarHBondContact O-N 3.34Å; G43-R47 WeakPolarHBondContact O-CG 3.45Å; G43-R47 PolarHBondContact O-N 2.9Å; G43-R47 PolarHBondContact O-NE 3.36Å
44L79.1Confident78.7Confident87 Ų8792.4 Ų92.446%0.45552%0.524SS..Hα-helixtrans-70.2-44.9174-175.966.9000110.8D39 G41 R46 R47 G48D39-L44 HydrophobicContact CB-CD2 4.49Å; D39-L44 WeakPolarHBondContact O-CD2 3.4Å; G41-L44 PolarHBondContact O-N 3.08Å; L44-R46 VanDerWaalsContact C-N 3.34Å; L44-R46 PolarHBondContact O-N 2.92Å; L44-R47 PolarHBondContact O-N 3.48Å; L44-G48 PolarHBondContact O-N 3.31Å
45A79.9Confident78.6Confident39 Ų3993.1 Ų93.132%0.32252%0.52SS..Hα-helixtrans-56-49174.900000110.9G41 W42 R47 G48 L49 Y280G41-A45 PolarHBondContact O-N 2.91Å; G41-A45 VanDerWaalsContact O-N 3.08Å; W42-A45 PolarHBondContact O-N 2.97Å; A45-R47 VanDerWaalsContact C-N 3.35Å; A45-R47 PolarHBondContact O-N 2.77Å; A45-G48 PolarHBondContact O-N 3.12Å; A45-L49 PolarHBondContact O-N 2.96Å; A45-Y280 PolarHBondContact O-OH 3.29Å
46R82Confident78.6Confident190 Ų19085.3 Ų85.372%0.71750%0.5SS*.Hα-helixtrans-60.2-41.3178.9-176.8177.9160.6-172.3-5.5113.1W42 L44 L49 A50W42-R46 WeakPolarHBondContact O-CB 3.33Å; W42-R46 PolarHBondContact O-N 3.13Å; L44-R46 VanDerWaalsContact C-N 3.34Å; L44-R46 PolarHBondContact O-N 2.92Å; R46-L49 PolarHBondContact O-N 3.45Å; R46-A50 PolarHBondContact O-N 3.47Å
47R81.8Confident79.1Confident157 Ų15785.8 Ų85.859%0.59250%0.498SS*.Hα-helixtrans-66.4-48.1176.2-74.6-175.2-68.6-171.14111.7G43 L44 A45 L49 A50 E51G43-R47 WeakPolarHBondContact O-CG 3.45Å; G43-R47 PolarHBondContact O-N 2.9Å; G43-R47 PolarHBondContact O-NE 3.36Å; L44-R47 PolarHBondContact O-N 3.48Å; A45-R47 VanDerWaalsContact C-N 3.35Å; A45-R47 PolarHBondContact O-N 2.77Å; R47-L49 PolarHBondContact O-N 3.21Å; R47-A50 WeakPolarHBondContact O-CB 3.38Å; R47-A50 PolarHBondContact O-N 3.19Å; R47-E51 WeakPolarHBondContact O-CG 3.45Å; R47-E51 PolarHBondContact O-N 2.94Å
48G80.6Confident79.8Confident12 Ų1287.2 Ų87.212%0.12451%0.507CS..Hα-helixtrans-60.3-30.2175.700000112.8L44 A45 H52L44-G48 PolarHBondContact O-N 3.31Å; A45-G48 PolarHBondContact O-N 3.12Å; G48-H52 VanDerWaalsContact O-CB 3.29Å; G48-H52 WeakPolarHBondContact O-CB 3.32Å; G48-H52 PolarHBondContact O-CD2 2.96Å; G48-H52 VanDerWaalsContact O-CD2 3.29Å; G48-H52 PolarHBondContact O-N 3.46Å
49L82.9Confident80.9Confident88 Ų8887.1 Ų87.146%0.46149%0.487SS..Hα-helixtrans-67.1-46.4173.4-162.370.4000110.5A45 R46 R47 E51 A53 F196 Y280A45-L49 PolarHBondContact O-N 2.96Å; R46-L49 PolarHBondContact O-N 3.45Å; R47-L49 PolarHBondContact O-N 3.21Å; L49-E51 VanDerWaalsContact C-N 3.27Å; L49-E51 PolarHBondContact O-N 3.43Å; L49-A53 HydrophobicContact CD1-CB 3.87Å; L49-A53 HydrophobicContact CG-CB 4.02Å; L49-A53 WeakPolarHBondContact O-CA 2.76Å; L49-A53 WeakPolarHBondContact O-CB 3.28Å; L49-A53 PolarHBondContact O-N 3.32Å; L49-F196 HydrophobicContact CD1-CE1 4.02Å; L49-F196 HydrophobicContact CD1-CZ 4Å; L49-Y280 WeakPolarHBondContact CA-OH 3.46Å; L49-Y280 WeakPolarHBondContact CB-OH 3.44Å; L49-Y280 HydrophobicContact CD1-CE2 4.46Å; L49-Y280 PolarHBondContact N-OH 2.92Å
50A80.7Confident82Confident85 Ų8585.2 Ų85.270%0.70248%0.476SS*.Hα-helixtrans-64.4-33.3178.300000112.6R46 R47R46-A50 PolarHBondContact O-N 3.47Å; R47-A50 WeakPolarHBondContact O-CB 3.38Å; R47-A50 PolarHBondContact O-N 3.19Å
51E82.1Confident83.3Confident122 Ų12285.2 Ų85.257%0.5747%0.468SS*.Hα-helixtrans-81-38.3-178.6-72170.3-167.300113.3R47 L49 H54R47-E51 WeakPolarHBondContact O-CG 3.45Å; R47-E51 PolarHBondContact O-N 2.94Å; L49-E51 VanDerWaalsContact C-N 3.27Å; L49-E51 PolarHBondContact O-N 3.43Å; E51-H54 PolarHBondContact O-NE2 2.92Å
52H82.6Confident84.2Confident46 Ų4687.1 Ų87.121%0.21347%0.468CS..Hα-helixtrans-109.8-17.7-171.4-61.8-64.9000114.9G48 H54 S140 F196 P279G48-H52 VanDerWaalsContact O-CB 3.29Å; G48-H52 WeakPolarHBondContact O-CB 3.32Å; G48-H52 PolarHBondContact O-CD2 2.96Å; G48-H52 VanDerWaalsContact O-CD2 3.29Å; G48-H52 PolarHBondContact O-N 3.46Å; H52-H54 PolarHBondContact O-CD2 3.47Å; H52-H54 PolarHBondContact O-N 3.36Å; H52-S140 PolarHBondContact ND1-OG 3.44Å; H52-F196 HydrophobicContact CB-CD1 4.24Å; H52-P279 HydrophobicContact CB-CB 4.27Å; H52-P279 HydrophobicContact CB-CG 4.27Å
53A85.9Confident85.3Confident33 Ų3377.6 Ų77.627%0.27344%0.436SS..  trans-84102.5179.300000110.3L49 A195 F196L49-A53 HydrophobicContact CD1-CB 3.87Å; L49-A53 HydrophobicContact CG-CB 4.02Å; L49-A53 WeakPolarHBondContact O-CA 2.76Å; L49-A53 WeakPolarHBondContact O-CB 3.28Å; L49-A53 PolarHBondContact O-N 3.32Å; A53-A195 HydrophobicContact CB-CB 4.18Å; A53-F196 HydrophobicContact CB-CE1 4.11Å
54H85.1Confident86.1Confident62 Ų6278 Ų7829%0.28744%0.435SS..  trans-103.891.2177.1-57.9-77.2000109.9E51 H52 S140 G141 A195 R197E51-H54 PolarHBondContact O-NE2 2.92Å; H52-H54 PolarHBondContact O-CD2 3.47Å; H52-H54 PolarHBondContact O-N 3.36Å; H54-S140 PolarHBondContact NE2-OG 3.04Å; H54-G141 WeakPolarHBondContact CD2-CA 3.4Å; H54-G141 PolarHBondContact CD2-N 3.31Å; H54-G141 VanDerWaalsContact CD2-N 3.32Å; H54-G141 WeakPolarHBondContact NE2-CA 3.41Å; H54-G141 PolarHBondContact NE2-N 2.88Å; H54-G141 VanDerWaalsContact NE2-N 3.18Å; H54-A195 PolarHBondContact N-O 3.07Å; H54-R197 VanDerWaalsContact CB-NH2 3.28Å; H54-R197 PolarHBondContact O-NH1 3.11Å; H54-R197 PolarHBondContact O-NH2 3.3Å
55L84.3Confident87Confident68 Ų6878.6 Ų78.636%0.35644%0.438SS..  trans-132.7115177.2-152.269.2000109.2L60 Y194L55-L60 HydrophobicContact CD2-CD1 4.14Å; L55-L60 HydrophobicContact CD2-CD2 3.54Å; L55-L60 HydrophobicContact CD2-CG 3.94Å; L55-L60 HydrophobicContact CG-CD2 4.22Å; L55-L60 HydrophobicContact CG-CG 4.22Å; L55-Y194 HydrophobicContact CD1-CD1 3.46Å; L55-Y194 VanDerWaalsContact CD1-CD1 3.46Å; L55-Y194 HydrophobicContact CD1-CE1 4.05Å; L55-Y194 HydrophobicContact CD1-CG 4.47Å
56A85.9Confident87.8Confident45 Ų4578.6 Ų78.637%0.37244%0.435SS..  trans-83.4139.4-177.200000110.5P58 E59 L60A56-P58 VanDerWaalsContact C-CD 3.4Å; A56-P58 VanDerWaalsContact C-N 3.3Å; A56-E59 HydrophobicContact CB-CG 4.01Å; A56-E59 WeakPolarHBondContact CB-OE2 3.35Å; A56-E59 PolarHBondContact N-OE2 3.24Å; A56-E59 WeakPolarHBondContact O-CB 3.45Å; A56-E59 PolarHBondContact O-N 3.16Å; A56-L60 PolarHBondContact O-N 2.9Å
57A87.5Confident88.5Confident76 Ų7670 Ų7063%0.62841%0.406SS*.Hα-helixtrans-54.7-37.617700000113.9E59 L60 L61A57-E59 VanDerWaalsContact C-N 3.3Å; A57-E59 PolarHBondContact O-N 3.16Å; A57-L60 PolarHBondContact O-N 3.44Å; A57-L61 PolarHBondContact O-N 2.84Å
58P91Very high89.2Confident93 Ų9368.3 Ų68.360%0.60441%0.407SS*.Hα-helixtrans-61-34.3172.9-24.835.7000113.9A56 L61 L62A56-P58 VanDerWaalsContact C-CD 3.4Å; A56-P58 VanDerWaalsContact C-N 3.3Å; P58-L61 PolarHBondContact O-N 2.76Å; P58-L62 VanDerWaalsContact O-CB 3.28Å; P58-L62 WeakPolarHBondContact O-CB 3.39Å; P58-L62 PolarHBondContact O-N 3.47Å
59E89.9Confident90Very high68 Ų6869.5 Ų69.532%0.31842%0.42SS..Hα-helixtrans-68.3-41177.9-62.3172.5138.600110.8A56 A57 L62 A63 Y194A56-E59 HydrophobicContact CB-CG 4.01Å; A56-E59 WeakPolarHBondContact CB-OE2 3.35Å; A56-E59 PolarHBondContact N-OE2 3.24Å; A56-E59 WeakPolarHBondContact O-CB 3.45Å; A56-E59 PolarHBondContact O-N 3.16Å; A57-E59 VanDerWaalsContact C-N 3.3Å; A57-E59 PolarHBondContact O-N 3.16Å; E59-L62 PolarHBondContact O-N 3.04Å; E59-A63 WeakPolarHBondContact O-CB 3.48Å; E59-A63 PolarHBondContact O-N 2.98Å; E59-Y194 PolarHBondContact OE1-OH 3Å; E59-Y194 VanDerWaalsContact OE1-OH 3.11Å
60L90.1Very high90.7Very high98 Ų9867.7 Ų67.751%0.51341%0.407SS..Hα-helixtrans-63.9-44.4174.2-73176.8000112.1L55 A56 A57 L62 A63 A64L55-L60 HydrophobicContact CD2-CD1 4.14Å; L55-L60 HydrophobicContact CD2-CD2 3.54Å; L55-L60 HydrophobicContact CD2-CG 3.94Å; L55-L60 HydrophobicContact CG-CD2 4.22Å; L55-L60 HydrophobicContact CG-CG 4.22Å; A56-L60 PolarHBondContact O-N 2.9Å; A57-L60 PolarHBondContact O-N 3.44Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L60-A63 PolarHBondContact O-N 2.99Å; L60-A64 WeakPolarHBondContact O-CB 3.37Å; L60-A64 PolarHBondContact O-N 3.32Å
61L93.6Very high91.4Very high110 Ų11065 Ų6558%0.57638%0.382SS*.Hα-helixtrans-61.2-45.5175.817861.5000110.7A57 P58 A63 A64 L65A57-L61 PolarHBondContact O-N 2.84Å; P58-L61 PolarHBondContact O-N 2.76Å; L61-A63 PolarHBondContact O-N 3.34Å; L61-A64 PolarHBondContact O-N 3.15Å; L61-L65 HydrophobicContact CD1-CD1 4.34Å; L61-L65 HydrophobicContact CD1-CG 4.29Å; L61-L65 HydrophobicContact CG-CD1 4.14Å; L61-L65 HydrophobicContact CG-CG 4.5Å; L61-L65 VanDerWaalsContact O-CG 3.32Å; L61-L65 WeakPolarHBondContact O-CG 3.5Å; L61-L65 PolarHBondContact O-N 3.05Å
62L94.8Very high92.1Very high85 Ų8562.2 Ų62.245%0.44538%0.38SS..Hα-helixtrans-60.5-45.1177.1-177.261000111.3P58 E59 L60 A64 L65 C66 L153P58-L62 VanDerWaalsContact O-CB 3.28Å; P58-L62 WeakPolarHBondContact O-CB 3.39Å; P58-L62 PolarHBondContact O-N 3.47Å; E59-L62 PolarHBondContact O-N 3.04Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L62-A64 VanDerWaalsContact C-N 3.33Å; L62-A64 PolarHBondContact O-N 3.29Å; L62-L65 PolarHBondContact O-N 3.39Å; L62-C66 WeakPolarHBondContact O-CB 3.38Å; L62-C66 PolarHBondContact O-N 3.32Å; L62-C66 PolarHBondContact O-SG 3.11Å; L62-L153 HydrophobicContact CD2-CD1 4.36Å; L62-L153 HydrophobicContact CD2-CD2 3.62Å; L62-L153 HydrophobicContact CG-CD1 4.07Å; L62-L153 HydrophobicContact CG-CD2 3.92Å
63A94.3Very high92.8Very high22 Ų2264.3 Ų64.318%0.18239%0.392CS..Hα-helixtrans-60.5-40.9176.400000112.4E59 L60 L61 C66 A67 L153 S157E59-A63 WeakPolarHBondContact O-CB 3.48Å; E59-A63 PolarHBondContact O-N 2.98Å; L60-A63 PolarHBondContact O-N 2.99Å; L61-A63 PolarHBondContact O-N 3.34Å; A63-C66 PolarHBondContact O-N 3.02Å; A63-A67 WeakPolarHBondContact O-CB 3.36Å; A63-A67 PolarHBondContact O-N 3.34Å; A63-L153 HydrophobicContact CB-CD1 3.9Å; A63-S157 VanDerWaalsContact O-CB 3.26Å; A63-S157 WeakPolarHBondContact O-CB 3.4Å
64A94.4Very high93.3Very high52 Ų5263.4 Ų63.443%0.4338%0.382SS..Hα-helixtrans-65.7-44.6176.100000112.1L60 L61 L62 C66 A67 L68L60-A64 WeakPolarHBondContact O-CB 3.37Å; L60-A64 PolarHBondContact O-N 3.32Å; L61-A64 PolarHBondContact O-N 3.15Å; L62-A64 VanDerWaalsContact C-N 3.33Å; L62-A64 PolarHBondContact O-N 3.29Å; A64-C66 VanDerWaalsContact C-N 3.34Å; A64-C66 PolarHBondContact O-N 3.37Å; A64-A67 WeakPolarHBondContact O-CB 3.41Å; A64-A67 PolarHBondContact O-N 3.1Å; A64-L68 PolarHBondContact O-N 3.39Å; A64-L68 VanDerWaalsContact O-N 3.08Å
65L96.9Very high93.8Very high100 Ų10063.9 Ų63.952%0.52439%0.392SS..Hα-helixtrans-62.1-42.1175.4-69.2174.1000111.5L61 L62 A67 L68 G69L61-L65 HydrophobicContact CD1-CD1 4.34Å; L61-L65 HydrophobicContact CD1-CG 4.29Å; L61-L65 HydrophobicContact CG-CD1 4.14Å; L61-L65 HydrophobicContact CG-CG 4.5Å; L61-L65 VanDerWaalsContact O-CG 3.32Å; L61-L65 WeakPolarHBondContact O-CG 3.5Å; L61-L65 PolarHBondContact O-N 3.05Å; L62-L65 PolarHBondContact O-N 3.39Å; L65-A67 VanDerWaalsContact C-N 3.34Å; L65-A67 PolarHBondContact O-N 2.88Å; L65-L68 PolarHBondContact O-N 3.04Å; L65-G69 PolarHBondContact O-N 2.87Å
66C97.1Very high94.4Very high38 Ų3862.4 Ų62.426%0.25739%0.389SS..Hα-helixtrans-61.5-40.2173.6-72.90000111.8L62 A63 A64 L68 G69 W70 S157L62-C66 WeakPolarHBondContact O-CB 3.38Å; L62-C66 PolarHBondContact O-N 3.32Å; L62-C66 PolarHBondContact O-SG 3.11Å; A63-C66 PolarHBondContact O-N 3.02Å; A64-C66 VanDerWaalsContact C-N 3.34Å; A64-C66 PolarHBondContact O-N 3.37Å; C66-L68 PolarHBondContact O-N 2.96Å; C66-G69 CarbonylContact O-C 3.49Å; C66-G69 WeakPolarHBondContact O-CA 3.19Å; C66-G69 PolarHBondContact O-N 2.85Å; C66-G69 VanDerWaalsContact O-N 3.13Å; C66-W70 PolarHBondContact O-N 2.87Å; C66-S157 VanDerWaalsContact CB-CB 3.46Å
67A96.6Very high94.9Very high11 Ų1161.1 Ų61.19%0.09138%0.379CS..Hα-helixtrans-62.8-41.1177.300000112.6A63 A64 L65 G69 W70 T71 S157 C160A63-A67 WeakPolarHBondContact O-CB 3.36Å; A63-A67 PolarHBondContact O-N 3.34Å; A64-A67 WeakPolarHBondContact O-CB 3.41Å; A64-A67 PolarHBondContact O-N 3.1Å; L65-A67 VanDerWaalsContact C-N 3.34Å; L65-A67 PolarHBondContact O-N 2.88Å; A67-G69 VanDerWaalsContact C-N 3.35Å; A67-W70 PolarHBondContact O-N 3.4Å; A67-T71 PolarHBondContact O-N 3.37Å; A67-T71 PolarHBondContact O-OG1 3.2Å; A67-S157 WeakPolarHBondContact CA-O 3.46Å; A67-S157 VanDerWaalsContact CB-O 3.3Å; A67-S157 WeakPolarHBondContact CB-O 3.48Å; A67-C160 HydrophobicContact CB-CB 3.74Å
68L96.7Very high95.3Very high120 Ų12058.4 Ų58.463%0.62836%0.355SS*.Hα-helixtrans-64.6-41.9171.6-64.5177.1000111.1A64 L65 C66 W70 T71 A72A64-L68 PolarHBondContact O-N 3.39Å; A64-L68 VanDerWaalsContact O-N 3.08Å; L65-L68 PolarHBondContact O-N 3.04Å; C66-L68 PolarHBondContact O-N 2.96Å; L68-W70 PolarHBondContact O-N 3.5Å; L68-T71 WeakPolarHBondContact O-CB 3.38Å; L68-T71 PolarHBondContact O-N 2.81Å; L68-T71 VanDerWaalsContact O-N 3.15Å; L68-A72 PolarHBondContact O-N 3.49Å
69G97.3Very high95.5Very high38 Ų3856.8 Ų56.839%0.39235%0.349SS..Hα-helixtrans-55.9-45.9174.100000112.8L65 C66 A67 T71 A72 L73L65-G69 PolarHBondContact O-N 2.87Å; C66-G69 CarbonylContact O-C 3.49Å; C66-G69 WeakPolarHBondContact O-CA 3.19Å; C66-G69 PolarHBondContact O-N 2.85Å; C66-G69 VanDerWaalsContact O-N 3.13Å; A67-G69 VanDerWaalsContact C-N 3.35Å; G69-T71 VanDerWaalsContact C-N 3.32Å; G69-T71 PolarHBondContact O-N 3.26Å; G69-A72 PolarHBondContact O-N 3.33Å; G69-L73 VanDerWaalsContact O-CB 3.27Å; G69-L73 WeakPolarHBondContact O-CB 3.38Å; G69-L73 PolarHBondContact O-N 3.34Å
70W97.4Very high95.8Very high49 Ų4963.8 Ų63.819%0.18637%0.372CS..Hα-helixtrans-60.9-40.7175.2-67129.1000112.4C66 A67 L68 L73 R74 W104 F108 L154 S157 F158 H161C66-W70 PolarHBondContact O-N 2.87Å; A67-W70 PolarHBondContact O-N 3.4Å; L68-W70 PolarHBondContact O-N 3.5Å; W70-L73 HydrophobicContact CE3-CD2 4.13Å; W70-L73 HydrophobicContact CZ3-CD2 3.97Å; W70-L73 PolarHBondContact O-N 3.28Å; W70-R74 VanDerWaalsContact O-CB 3.26Å; W70-R74 WeakPolarHBondContact O-CB 3.5Å; W70-R74 PolarHBondContact O-N 2.84Å; W70-W104 HydrophobicContact CE3-CH2 4.08Å; W70-W104 AromaticContact CE3-CZ2 3.97Å; W70-W104 HydrophobicContact CE3-CZ2 3.97Å; W70-W104 WeakPolarHBondContact O-CZ2 3.43Å; W70-F108 HydrophobicContact CH2-CE2 4.49Å; W70-F108 HydrophobicContact CZ2-CE2 4.2Å; W70-L154 HydrophobicContact CH2-CD2 4.14Å; W70-L154 HydrophobicContact CZ2-CD2 3.66Å; W70-S157 PolarHBondContact NE1-OG 3.28Å; W70-F158 HydrophobicContact CD2-CD2 4.47Å; W70-F158 HydrophobicContact CG-CD2 4.33Å; W70-H161 HydrophobicContact CB-CB 3.92Å
71T96.3Very high96Very high30 Ų3063.7 Ų63.718%0.18437%0.372CS..Hα-helixtrans-63.2-46177.5-51.80000111.4A67 L68 G69 S75 H161 Y164 M169A67-T71 PolarHBondContact O-N 3.37Å; A67-T71 PolarHBondContact O-OG1 3.2Å; L68-T71 WeakPolarHBondContact O-CB 3.38Å; L68-T71 PolarHBondContact O-N 2.81Å; L68-T71 VanDerWaalsContact O-N 3.15Å; G69-T71 VanDerWaalsContact C-N 3.32Å; G69-T71 PolarHBondContact O-N 3.26Å; T71-S75 PolarHBondContact O-N 3.23Å; T71-S75 VanDerWaalsContact O-N 3.09Å; T71-H161 WeakPolarHBondContact CA-ND1 3.46Å; T71-H161 PolarHBondContact OG1-ND1 3.23Å; T71-Y164 HydrophobicContact CG2-CD1 4.01Å; T71-Y164 HydrophobicContact CG2-CE1 3.69Å; T71-M169 HydrophobicContact CG2-SD 4.25Å
72A96.9Very high96.1Very high63 Ų6358.9 Ų58.952%0.52135%0.346SS..Hα-helixtrans-64-44.8176.300000111.7L68 G69 S75 A76L68-A72 PolarHBondContact O-N 3.49Å; G69-A72 PolarHBondContact O-N 3.33Å; A72-S75 WeakPolarHBondContact O-CB 3.46Å; A72-S75 PolarHBondContact O-N 3.14Å; A72-A76 WeakPolarHBondContact O-CB 3.42Å; A72-A76 PolarHBondContact O-N 3.5Å
73L96.9Very high96.1Very high90 Ų9062 Ų6247%0.47135%0.352SS..Hα-helixtrans-65.6-40.8-179.6-173.858.4000111.5G69 W70 S75 A76 A77 W104G69-L73 VanDerWaalsContact O-CB 3.27Å; G69-L73 WeakPolarHBondContact O-CB 3.38Å; G69-L73 PolarHBondContact O-N 3.34Å; W70-L73 HydrophobicContact CE3-CD2 4.13Å; W70-L73 HydrophobicContact CZ3-CD2 3.97Å; W70-L73 PolarHBondContact O-N 3.28Å; L73-S75 VanDerWaalsContact C-N 3.35Å; L73-S75 PolarHBondContact O-N 2.78Å; L73-A76 PolarHBondContact O-N 2.82Å; L73-A77 VanDerWaalsContact O-CB 3.28Å; L73-A77 WeakPolarHBondContact O-CB 3.45Å; L73-A77 PolarHBondContact O-N 3.26Å; L73-W104 HydrophobicContact CB-CH2 3.74Å; L73-W104 HydrophobicContact CB-CZ3 4.4Å; L73-W104 HydrophobicContact CD2-CH2 3.73Å; L73-W104 HydrophobicContact CD2-CZ3 4.28Å; L73-W104 HydrophobicContact CG-CH2 3.5Å; L73-W104 VanDerWaalsContact CG-CH2 3.5Å; L73-W104 HydrophobicContact CG-CZ3 3.83Å
74R96.7Very high96.1Very high14 Ų1463.9 Ų63.95%0.05336%0.362CS..Hα-helixtrans-58.3-47172.6-176.7176.1175.6177.4-7.6111.6W70 A77 T78 W104 H161 M169 D170W70-R74 VanDerWaalsContact O-CB 3.26Å; W70-R74 WeakPolarHBondContact O-CB 3.5Å; W70-R74 PolarHBondContact O-N 2.84Å; R74-A77 PolarHBondContact O-N 3.39Å; R74-T78 VanDerWaalsContact O-CB 3.27Å; R74-T78 WeakPolarHBondContact O-CB 3.29Å; R74-T78 PolarHBondContact O-N 3.05Å; R74-T78 PolarHBondContact O-OG1 3.39Å; R74-W104 HydrophobicContact CB-CD2 3.75Å; R74-W104 VanDerWaalsContact CB-CE2 3.47Å; R74-W104 HydrophobicContact CB-CE3 4.23Å; R74-W104 HydrophobicContact CB-CG 4.19Å; R74-W104 HydrophobicContact CB-CH2 4.27Å; R74-W104 HydrophobicContact CB-CZ2 3.75Å; R74-W104 HydrophobicContact CB-CZ3 4.48Å; R74-W104 VanDerWaalsContact CD-CD1 3.43Å; R74-W104 HydrophobicContact CG-CB 4.33Å; R74-W104 HydrophobicContact CG-CD2 3.73Å; R74-W104 HydrophobicContact CG-CE3 4.42Å; R74-W104 HydrophobicContact CG-CG 3.64Å; R74-H161 WeakPolarHBondContact CD-NE2 3.35Å; R74-M169 HydrophobicContact CG-CE 4.24Å; R74-D170 IonicContact CZ-OD1 2.81Å; R74-D170 VanDerWaalsContact CZ-OD1 3.24Å; R74-D170 IonicContact NH1-OD1 3.67Å; R74-D170 PolarHBondContact NH1-OD1 2.89Å; R74-D170 IonicContact NH2-OD1 2.83Å; R74-D170 PolarHBondContact NH2-OD1 2.88Å
75S95.1Very high96Very high72 Ų7264.7 Ų64.750%0.50336%0.359SS..Hα-helixtrans-62.1-46.6179-174.90000111.3T71 A72 L73 T78 A79T71-S75 PolarHBondContact O-N 3.23Å; T71-S75 VanDerWaalsContact O-N 3.09Å; A72-S75 WeakPolarHBondContact O-CB 3.46Å; A72-S75 PolarHBondContact O-N 3.14Å; L73-S75 VanDerWaalsContact C-N 3.35Å; L73-S75 PolarHBondContact O-N 2.78Å; S75-T78 WeakPolarHBondContact O-CB 3.35Å; S75-T78 PolarHBondContact O-N 3.41Å; S75-A79 PolarHBondContact O-N 3.26Å
76A96.6Very high95.9Very high36 Ų3660.2 Ų60.230%0.29834%0.336SS..Hα-helixtrans-62.5-46.9177.100000112.3A72 L73 T78 A79 R80A72-A76 WeakPolarHBondContact O-CB 3.42Å; A72-A76 PolarHBondContact O-N 3.5Å; L73-A76 PolarHBondContact O-N 2.82Å; A76-T78 VanDerWaalsContact C-N 3.32Å; A76-T78 PolarHBondContact O-N 3.49Å; A76-A79 PolarHBondContact O-N 2.73Å; A76-R80 VanDerWaalsContact O-CB 3.29Å; A76-R80 WeakPolarHBondContact O-CB 3.42Å; A76-R80 WeakPolarHBondContact O-CG 3.4Å; A76-R80 PolarHBondContact O-N 2.89Å
77A96.5Very high95.6Very high18 Ų1866.3 Ų66.315%0.14936%0.358CS..Hα-helixtrans-62.1-39.9176.900000111.6L73 R74 L81 F82 W104L73-A77 VanDerWaalsContact O-CB 3.28Å; L73-A77 WeakPolarHBondContact O-CB 3.45Å; L73-A77 PolarHBondContact O-N 3.26Å; R74-A77 PolarHBondContact O-N 3.39Å; A77-L81 WeakPolarHBondContact O-CA 3.38Å; A77-L81 WeakPolarHBondContact O-CB 3.31Å; A77-L81 PolarHBondContact O-N 3.38Å; A77-F82 HydrophobicContact CB-CD2 4.24Å; A77-F82 HydrophobicContact CB-CE2 3.67Å; A77-F82 HydrophobicContact CB-CZ 4.04Å; A77-F82 PolarHBondContact O-N 3.2Å; A77-W104 HydrophobicContact CB-CE3 4.13Å; A77-W104 HydrophobicContact CB-CZ3 4.13Å
78T95.6Very high95.4Very high20 Ų2076.4 Ų76.412%0.12339%0.394CS..Iπ-helixtrans-60.8-48.1175.2-63.40000111.7R74 S75 A76 R83 P100R74-T78 VanDerWaalsContact O-CB 3.27Å; R74-T78 WeakPolarHBondContact O-CB 3.29Å; R74-T78 PolarHBondContact O-N 3.05Å; R74-T78 PolarHBondContact O-OG1 3.39Å; S75-T78 WeakPolarHBondContact O-CB 3.35Å; S75-T78 PolarHBondContact O-N 3.41Å; A76-T78 VanDerWaalsContact C-N 3.32Å; A76-T78 PolarHBondContact O-N 3.49Å; T78-R83 HydrophobicContact CG2-CG 4.18Å; T78-R83 WeakPolarHBondContact O-CB 3.3Å; T78-R83 VanDerWaalsContact O-CG 3.29Å; T78-R83 WeakPolarHBondContact O-CG 3.5Å; T78-R83 PolarHBondContact O-N 2.92Å; T78-P100 HydrophobicContact CG2-CB 3.73Å; T78-P100 HydrophobicContact CG2-CG 4.11Å
79A95Very high95.1Very high58 Ų5871.3 Ų71.348%0.47937%0.368SS..Iπ-helixtrans-71.3-42.7-177.900000112.9S75 A76 P84S75-A79 PolarHBondContact O-N 3.26Å; A76-A79 PolarHBondContact O-N 2.73Å; A79-P84 WeakPolarHBondContact O-CD 3.38Å
80R95.9Very high94.8Very high215 Ų21578.9 Ų78.981%0.81139%0.385SS*.Iπ-helixtrans-94.7-27.6-169-61.4-177.2-178-173.70.9114.4A76A76-R80 VanDerWaalsContact O-CB 3.29Å; A76-R80 WeakPolarHBondContact O-CB 3.42Å; A76-R80 WeakPolarHBondContact O-CG 3.4Å; A76-R80 PolarHBondContact O-N 2.89Å
81L96.2Very high94.5Very high97 Ų9777.4 Ų77.451%0.50838%0.381SS..Iπ-helixtrans-117.2-59-174.2-178.761.7000112A77 P84 L85A77-L81 WeakPolarHBondContact O-CA 3.38Å; A77-L81 WeakPolarHBondContact O-CB 3.31Å; A77-L81 PolarHBondContact O-N 3.38Å; L81-P84 WeakPolarHBondContact O-CD 3.3Å; L81-L85 WeakPolarHBondContact O-CB 3.36Å; L81-L85 PolarHBondContact O-N 2.8Å
82F95.4Very high94.1Very high8 Ų880.9 Ų80.94%0.03540%0.395CS..Iπ-helixtrans-72.4-46.4-167.7-55.7-37.1000113.5A77 L85 A86 L99 P100 A103 W104 L107A77-F82 HydrophobicContact CB-CD2 4.24Å; A77-F82 HydrophobicContact CB-CE2 3.67Å; A77-F82 HydrophobicContact CB-CZ 4.04Å; A77-F82 PolarHBondContact O-N 3.2Å; F82-L85 PolarHBondContact O-N 2.92Å; F82-A86 PolarHBondContact O-N 3.37Å; F82-L99 HydrophobicContact CB-CD2 3.95Å; F82-L99 WeakPolarHBondContact O-CD2 3.41Å; F82-P100 HydrophobicContact CB-CB 3.97Å; F82-P100 HydrophobicContact CB-CG 4.01Å; F82-P100 HydrophobicContact CD2-CB 4.06Å; F82-P100 HydrophobicContact CG-CB 4.45Å; F82-A103 HydrophobicContact CD1-CB 3.71Å; F82-A103 HydrophobicContact CD2-CB 4.34Å; F82-A103 HydrophobicContact CE1-CB 3.56Å; F82-A103 HydrophobicContact CE2-CB 4.21Å; F82-A103 HydrophobicContact CG-CB 4.12Å; F82-A103 HydrophobicContact CZ-CB 3.83Å; F82-W104 HydrophobicContact CE2-CB 4.03Å; F82-W104 HydrophobicContact CE2-CE3 4.29Å; F82-L107 HydrophobicContact CE1-CD1 4.12Å; F82-L107 HydrophobicContact CZ-CD1 3.77Å
83R93.7Very high93.7Very high152 Ų15283.4 Ų83.457%0.57441%0.406SS*.Hα-helixtrans-64.5-45177-73.1176.9178.7-171.61112.5T78 L85 A86 K87 P100T78-R83 HydrophobicContact CG2-CG 4.18Å; T78-R83 WeakPolarHBondContact O-CB 3.3Å; T78-R83 VanDerWaalsContact O-CG 3.29Å; T78-R83 WeakPolarHBondContact O-CG 3.5Å; T78-R83 PolarHBondContact O-N 2.92Å; R83-L85 VanDerWaalsContact C-N 3.34Å; R83-L85 PolarHBondContact O-N 2.67Å; R83-A86 PolarHBondContact O-N 3.36Å; R83-K87 WeakPolarHBondContact O-CG 3.45Å; R83-K87 PolarHBondContact O-N 3.12Å; R83-K87 VanDerWaalsContact O-N 3.09Å; R83-P100 HydrophobicContact CG-CG 4.39Å
84P94.7Very high93.2Very high60 Ų6084 Ų8439%0.3940%0.402SS..Hα-helixtrans-60.4-40.6173-2838.1000113.1A79 L81 K87 R88A79-P84 WeakPolarHBondContact O-CD 3.38Å; L81-P84 WeakPolarHBondContact O-CD 3.3Å; P84-K87 PolarHBondContact O-N 3.48Å; P84-R88 WeakPolarHBondContact O-CB 3.42Å; P84-R88 PolarHBondContact O-N 3.37Å
85L93.3Very high92.8Very high70 Ų7084.2 Ų84.237%0.36640%0.404SS..Hα-helixtrans-60.9-45.8176.3-178.864.6000111.6L81 F82 R83 K87 R88 C89 F225L81-L85 WeakPolarHBondContact O-CB 3.36Å; L81-L85 PolarHBondContact O-N 2.8Å; F82-L85 PolarHBondContact O-N 2.92Å; R83-L85 VanDerWaalsContact C-N 3.34Å; R83-L85 PolarHBondContact O-N 2.67Å; L85-K87 VanDerWaalsContact C-N 3.33Å; L85-K87 PolarHBondContact O-N 3.09Å; L85-R88 PolarHBondContact O-N 3.3Å; L85-C89 WeakPolarHBondContact O-CB 3.03Å; L85-C89 PolarHBondContact O-N 3.42Å; L85-C89 PolarHBondContact O-SG 2.84Å; L85-F225 HydrophobicContact CD2-CZ 4.23Å; L85-F225 HydrophobicContact CG-CZ 4.46Å
86A92.9Very high92.6Very high5 Ų582.1 Ų82.14%0.04139%0.391CS..Hα-helixtrans-58.9-43.3176.700000112.2F82 R83 C89 R90 L91 A96 L99F82-A86 PolarHBondContact O-N 3.37Å; R83-A86 PolarHBondContact O-N 3.36Å; A86-C89 CarbonylContact O-C 3.53Å; A86-C89 PolarHBondContact O-N 2.95Å; A86-R90 PolarHBondContact O-N 2.61Å; A86-L91 HydrophobicContact CB-CD1 3.99Å; A86-L91 PolarHBondContact O-N 3.37Å; A86-L91 VanDerWaalsContact O-N 3.16Å; A86-A96 HydrophobicContact CB-CB 4.01Å; A86-L99 HydrophobicContact CB-CD2 4.26Å
87K92.2Very high92.3Very high167 Ų16784.2 Ų84.273%0.72641%0.409SS*.Hα-helixtrans-66.5-46.8177-71.3-179.5-179.4-175.20112.4R83 P84 L85 C89 R90R83-K87 WeakPolarHBondContact O-CG 3.45Å; R83-K87 PolarHBondContact O-N 3.12Å; R83-K87 VanDerWaalsContact O-N 3.09Å; P84-K87 PolarHBondContact O-N 3.48Å; L85-K87 VanDerWaalsContact C-N 3.33Å; L85-K87 PolarHBondContact O-N 3.09Å; K87-C89 PolarHBondContact O-N 3.34Å; K87-R90 PolarHBondContact O-N 2.85Å
88R91.4Very high91.9Very high222 Ų22285.7 Ų85.784%0.83841%0.41SS*.Hα-helixtrans-59.2-37.3177-175.9176.2180178.30.6111.1P84 L85 R90P84-R88 WeakPolarHBondContact O-CB 3.42Å; P84-R88 PolarHBondContact O-N 3.37Å; L85-R88 PolarHBondContact O-N 3.3Å; R88-R90 VanDerWaalsContact C-N 3.33Å
89C90.3Very high91.9Very high13 Ų1384.9 Ų84.99%0.08841%0.405CS..Hα-helixtrans-76.1-17.1175.4-73.10000113L85 A86 K87 L91 F225 R228L85-C89 WeakPolarHBondContact O-CB 3.03Å; L85-C89 PolarHBondContact O-N 3.42Å; L85-C89 PolarHBondContact O-SG 2.84Å; A86-C89 CarbonylContact O-C 3.53Å; A86-C89 PolarHBondContact O-N 2.95Å; K87-C89 PolarHBondContact O-N 3.34Å; C89-L91 VanDerWaalsContact C-N 3.3Å; C89-L91 HydrophobicContact CB-CD2 4.18Å; C89-L91 HydrophobicContact CB-CG 3.92Å; C89-L91 PolarHBondContact O-N 2.84Å; C89-F225 HydrophobicContact CB-CE1 4.04Å; C89-R228 HydrophobicContact CB-CG 3.9Å; C89-R228 VanDerWaalsContact O-CD 3.32Å; C89-R228 WeakPolarHBondContact O-CD 3.43Å; C89-R228 WeakPolarHBondContact O-CG 3.12Å; C89-R228 PolarHBondContact SG-NH1 2.79Å; C89-R228 VanDerWaalsContact SG-NH1 3.43Å
90R91Very high91.9Very high198 Ų19882.6 Ų82.675%0.74739%0.386SS*.THydrogen-bonded Turntrans53.948.7-172.7-53.8-179-176.9-159.10.2111.4A86 K87 R88 G229A86-R90 PolarHBondContact O-N 2.61Å; K87-R90 PolarHBondContact O-N 2.85Å; R88-R90 VanDerWaalsContact C-N 3.33Å; R90-G229 PolarHBondContact O-N 3.28Å
91L91.3Very high91.7Very high17 Ų1773 Ų739%0.08935%0.35CS..  trans-66.5154.6173.1-64.2-179.6000110.7A86 C89 A96 L99 Y224 F225 R228A86-L91 HydrophobicContact CB-CD1 3.99Å; A86-L91 PolarHBondContact O-N 3.37Å; A86-L91 VanDerWaalsContact O-N 3.16Å; C89-L91 VanDerWaalsContact C-N 3.3Å; C89-L91 HydrophobicContact CB-CD2 4.18Å; C89-L91 HydrophobicContact CB-CG 3.92Å; C89-L91 PolarHBondContact O-N 2.84Å; L91-A96 HydrophobicContact CB-CB 4.17Å; L91-L99 HydrophobicContact CD1-CD1 3.7Å; L91-Y224 WeakPolarHBondContact CD2-O 3.49Å; L91-F225 HydrophobicContact CD1-CD1 4.49Å; L91-F225 HydrophobicContact CD1-CE1 4.03Å; L91-F225 HydrophobicContact CD1-CZ 4.32Å; L91-F225 HydrophobicContact CD2-CD1 3.82Å; L91-F225 HydrophobicContact CD2-CE1 4.08Å; L91-F225 HydrophobicContact CG-CE1 4.43Å; L91-R228 HydrophobicContact CD2-CB 4.1Å; L91-R228 HydrophobicContact CD2-CG 3.99Å
92Q88.4Confident91.6Very high103 Ų10368.4 Ų68.448%0.48133%0.326SS..  trans-60.3148173.1-62.8-168.913.800110.5R94 D95 A96Q92-R94 VanDerWaalsContact C-N 3.26Å; Q92-R94 PolarHBondContact O-N 2.91Å; Q92-D95 PolarHBondContact O-N 3.02Å; Q92-D95 VanDerWaalsContact O-N 3.1Å; Q92-A96 WeakPolarHBondContact O-CB 3.19Å; Q92-A96 PolarHBondContact O-N 3.26Å
93P87.7Confident91.7Very high116 Ų11668.5 Ų68.575%0.75333%0.328SS*.Hα-helixtrans-54.9-38.5-177.2-27.735.2000114.1A97P93-A97 PolarHBondContact O-N 3.43Å
94R86.8Confident91.8Very high102 Ų10262 Ų6239%0.38530%0.304SS..Hα-helixtrans-60.3-50.1176.2-178.1-177.8177-172.61111.5Q92 A97 R98 E318 E322Q92-R94 VanDerWaalsContact C-N 3.26Å; Q92-R94 PolarHBondContact O-N 2.91Å; R94-A97 PolarHBondContact O-N 3.44Å; R94-R98 VanDerWaalsContact NE-NH1 3.16Å; R94-E318 IonicContact CZ-OE1 2.76Å; R94-E318 IonicContact NH1-OE1 2.8Å; R94-E318 PolarHBondContact NH1-OE1 2.6Å; R94-E318 IonicContact NH2-OE1 3.7Å; R94-E318 PolarHBondContact NH2-OE1 3.39Å; R94-E322 IonicContact CZ-OE2 2.92Å; R94-E322 IonicContact NH2-OE2 3.24Å; R94-E322 PolarHBondContact NH2-OE2 3.5Å
95D89.3Confident91.9Very high20 Ų2060.6 Ų60.611%0.10729%0.292CS..Hα-helixtrans-72-38.4-178-63.9-31.1000112Q92 A97 R98 L99 Y224Q92-D95 PolarHBondContact O-N 3.02Å; Q92-D95 VanDerWaalsContact O-N 3.1Å; D95-A97 PolarHBondContact O-N 3.45Å; D95-R98 PolarHBondContact O-N 3.22Å; D95-R98 VanDerWaalsContact O-N 3.11Å; D95-L99 WeakPolarHBondContact O-CB 3.21Å; D95-L99 PolarHBondContact O-N 3.36Å; D95-Y224 HydrophobicContact CB-CD1 4Å; D95-Y224 HydrophobicContact CB-CG 4.07Å; D95-Y224 WeakPolarHBondContact OD1-CD1 3.5Å
96A89.9Confident92.1Very high28 Ų2858.3 Ų58.323%0.23128%0.28CS..Hα-helixtrans-61-32.2176.900000112.6A86 L91 Q92 P100A86-A96 HydrophobicContact CB-CB 4.01Å; L91-A96 HydrophobicContact CB-CB 4.17Å; Q92-A96 WeakPolarHBondContact O-CB 3.19Å; Q92-A96 PolarHBondContact O-N 3.26Å; A96-P100 WeakPolarHBondContact O-CD 3.4Å
97A89.9Confident92.3Very high80 Ų8062.8 Ų62.866%0.66130%0.302SS*.Hα-helixtrans-72.6-31.5176.100000112.9P93 R94 D95P93-A97 PolarHBondContact O-N 3.43Å; R94-A97 PolarHBondContact O-N 3.44Å; D95-A97 PolarHBondContact O-N 3.45Å
98R90.1Very high92.5Very high49 Ų4955.5 Ų55.519%0.18527%0.27CS..Hα-helixtrans-90.8-28-175.7-65.5171.8179.3-171-8.8113.3R94 D95 P100 E101 S102 Y224 E322R94-R98 VanDerWaalsContact NE-NH1 3.16Å; D95-R98 PolarHBondContact O-N 3.22Å; D95-R98 VanDerWaalsContact O-N 3.11Å; R98-P100 VanDerWaalsContact C-CD 3.48Å; R98-E101 PolarHBondContact O-N 3.38Å; R98-E101 VanDerWaalsContact O-N 3.12Å; R98-S102 PolarHBondContact O-N 3.43Å; R98-Y224 HydrophobicContact CB-CE2 4.14Å; R98-E322 IonicContact CZ-OE1 3.37Å; R98-E322 IonicContact CZ-OE2 2.78Å; R98-E322 VanDerWaalsContact NH1-CD 3.29Å; R98-E322 IonicContact NH1-OE1 3.15Å; R98-E322 PolarHBondContact NH1-OE1 3.01Å; R98-E322 IonicContact NH1-OE2 3.35Å; R98-E322 PolarHBondContact NH1-OE2 3.18Å; R98-E322 VanDerWaalsContact NH1-OE2 3.12Å; R98-E322 IonicContact NH2-OE1 2.73Å; R98-E322 PolarHBondContact NH2-OE1 3.39Å; R98-E322 IonicContact NH2-OE2 3.02Å; R98-E322 PolarHBondContact NH2-OE2 2.81Å
99L93.9Very high92.8Very high2 Ų245.6 Ų45.61%0.0123%0.233CC..Hα-helixtrans-51.2-44.3-178.4177.8127000113.9F82 A86 L91 D95 E101 S102 A103 L221 Y224 F225F82-L99 HydrophobicContact CB-CD2 3.95Å; F82-L99 WeakPolarHBondContact O-CD2 3.41Å; A86-L99 HydrophobicContact CB-CD2 4.26Å; L91-L99 HydrophobicContact CD1-CD1 3.7Å; D95-L99 WeakPolarHBondContact O-CB 3.21Å; D95-L99 PolarHBondContact O-N 3.36Å; L99-E101 VanDerWaalsContact C-N 3.33Å; L99-E101 PolarHBondContact O-N 2.95Å; L99-S102 PolarHBondContact O-N 3.05Å; L99-A103 WeakPolarHBondContact O-CB 3.41Å; L99-A103 PolarHBondContact O-N 3.29Å; L99-L221 HydrophobicContact CD1-CD2 3.91Å; L99-L221 HydrophobicContact CG-CD2 4.02Å; L99-Y224 HydrophobicContact CB-CD2 4.23Å; L99-F225 HydrophobicContact CD1-CD2 4.48Å; L99-F225 HydrophobicContact CD1-CE1 4.39Å; L99-F225 HydrophobicContact CD1-CE2 3.5Å; L99-F225 HydrophobicContact CD1-CZ 3.44Å; L99-F225 VanDerWaalsContact CD1-CZ 3.44Å
100P94.9Very high93.2Very high11 Ų1148.6 Ų48.67%0.07125%0.248CC..Hα-helixtrans-62.2-35.8179.9-24.335.1000114.5T78 F82 R83 A96 R98 W104T78-P100 HydrophobicContact CG2-CB 3.73Å; T78-P100 HydrophobicContact CG2-CG 4.11Å; F82-P100 HydrophobicContact CB-CB 3.97Å; F82-P100 HydrophobicContact CB-CG 4.01Å; F82-P100 HydrophobicContact CD2-CB 4.06Å; F82-P100 HydrophobicContact CG-CB 4.45Å; R83-P100 HydrophobicContact CG-CG 4.39Å; A96-P100 WeakPolarHBondContact O-CD 3.4Å; R98-P100 VanDerWaalsContact C-CD 3.48Å; P100-W104 VanDerWaalsContact O-CB 3.23Å; P100-W104 WeakPolarHBondContact O-CB 3.09Å; P100-W104 PolarHBondContact O-N 3Å
101E92.8Very high93.5Very high13 Ų1341.2 Ų41.26%0.06123%0.234CC..Hα-helixtrans-64.7-53.6176-176.6-167.1147.200109.9R98 L99 W104 K105 R173R98-E101 PolarHBondContact O-N 3.38Å; R98-E101 VanDerWaalsContact O-N 3.12Å; L99-E101 VanDerWaalsContact C-N 3.33Å; L99-E101 PolarHBondContact O-N 2.95Å; E101-W104 PolarHBondContact O-N 3.4Å; E101-K105 HydrophobicContact CG-CD 4.21Å; E101-K105 WeakPolarHBondContact O-CG 3.43Å; E101-K105 PolarHBondContact O-N 3.45Å; E101-K105 VanDerWaalsContact O-N 3.08Å; E101-K105 IonicContact OE1-NZ 3.72Å; E101-K105 PolarHBondContact OE1-NZ 2.93Å; E101-R173 IonicContact OE1-CZ 2.73Å; E101-R173 IonicContact OE1-NH1 3.12Å; E101-R173 PolarHBondContact OE1-NH1 2.93Å; E101-R173 VanDerWaalsContact OE1-NH1 3.16Å; E101-R173 IonicContact OE1-NH2 3.25Å; E101-R173 PolarHBondContact OE1-NH2 3.37Å; E101-R173 IonicContact OE2-NH2 2.67Å; E101-R173 PolarHBondContact OE2-NH2 3.43Å
102S94.8Very high93.7Very high1 Ų140.9 Ų40.91%0.00723%0.232CC..Hα-helixtrans-66.3-40.6-177.4-74.70000113.6R98 L99 W104 K105 L106 E217R98-S102 PolarHBondContact O-N 3.43Å; L99-S102 PolarHBondContact O-N 3.05Å; S102-W104 PolarHBondContact O-N 3.36Å; S102-K105 PolarHBondContact O-N 3.37Å; S102-L106 WeakPolarHBondContact O-CB 3.44Å; S102-L106 PolarHBondContact O-N 3.03Å; S102-E217 WeakPolarHBondContact CA-OE2 3.46Å; S102-E217 WeakPolarHBondContact CB-OE2 3.5Å; S102-E217 PolarHBondContact OG-OE2 2.89Å
103A96.7Very high94.2Very high10 Ų1039 Ų398%0.08322%0.221CC..Hα-helixtrans-65.2-40.2177.900000111.7F82 L99 L107 L221F82-A103 HydrophobicContact CD1-CB 3.71Å; F82-A103 HydrophobicContact CD2-CB 4.34Å; F82-A103 HydrophobicContact CE1-CB 3.56Å; F82-A103 HydrophobicContact CE2-CB 4.21Å; F82-A103 HydrophobicContact CG-CB 4.12Å; F82-A103 HydrophobicContact CZ-CB 3.83Å; L99-A103 WeakPolarHBondContact O-CB 3.41Å; L99-A103 PolarHBondContact O-N 3.29Å; A103-L107 WeakPolarHBondContact O-CG 3.42Å; A103-L107 PolarHBondContact O-N 3.11Å; A103-L221 HydrophobicContact CB-CD1 4.36Å; A103-L221 HydrophobicContact CB-CD2 4.17Å
104W96.7Very high94.7Very high15 Ų1536.1 Ų36.16%0.05720%0.203CC..Hα-helixtrans-62.8-49.2176.2179.6-108.5000112.1W70 L73 R74 A77 F82 P100 E101 S102 L106 L107 F108 F158 H161W70-W104 HydrophobicContact CE3-CH2 4.08Å; W70-W104 AromaticContact CE3-CZ2 3.97Å; W70-W104 HydrophobicContact CE3-CZ2 3.97Å; W70-W104 WeakPolarHBondContact O-CZ2 3.43Å; L73-W104 HydrophobicContact CB-CH2 3.74Å; L73-W104 HydrophobicContact CB-CZ3 4.4Å; L73-W104 HydrophobicContact CD2-CH2 3.73Å; L73-W104 HydrophobicContact CD2-CZ3 4.28Å; L73-W104 HydrophobicContact CG-CH2 3.5Å; L73-W104 VanDerWaalsContact CG-CH2 3.5Å; L73-W104 HydrophobicContact CG-CZ3 3.83Å; R74-W104 HydrophobicContact CB-CD2 3.75Å; R74-W104 VanDerWaalsContact CB-CE2 3.47Å; R74-W104 HydrophobicContact CB-CE3 4.23Å; R74-W104 HydrophobicContact CB-CG 4.19Å; R74-W104 HydrophobicContact CB-CH2 4.27Å; R74-W104 HydrophobicContact CB-CZ2 3.75Å; R74-W104 HydrophobicContact CB-CZ3 4.48Å; R74-W104 VanDerWaalsContact CD-CD1 3.43Å; R74-W104 HydrophobicContact CG-CB 4.33Å; R74-W104 HydrophobicContact CG-CD2 3.73Å; R74-W104 HydrophobicContact CG-CE3 4.42Å; R74-W104 HydrophobicContact CG-CG 3.64Å; A77-W104 HydrophobicContact CB-CE3 4.13Å; A77-W104 HydrophobicContact CB-CZ3 4.13Å; F82-W104 HydrophobicContact CE2-CB 4.03Å; F82-W104 HydrophobicContact CE2-CE3 4.29Å; P100-W104 VanDerWaalsContact O-CB 3.23Å; P100-W104 WeakPolarHBondContact O-CB 3.09Å; P100-W104 PolarHBondContact O-N 3Å; E101-W104 PolarHBondContact O-N 3.4Å; S102-W104 PolarHBondContact O-N 3.36Å; W104-L106 PolarHBondContact O-N 3.09Å; W104-L107 PolarHBondContact O-N 2.97Å; W104-F108 PolarHBondContact O-N 3.04Å; W104-F108 VanDerWaalsContact O-N 3.14Å; W104-F158 AromaticContact NE1-CE2 3.53Å; W104-H161 AromaticContact NE1-NE2 3.61Å
105K95.8Very high95.2Very high31 Ų3134.5 Ų34.514%0.13520%0.198CC..Hα-helixtrans-61.1-43.8177.8-72176.1-178.8172.90111.2E101 S102 L107 F108 Y109 D170 E217E101-K105 HydrophobicContact CG-CD 4.21Å; E101-K105 WeakPolarHBondContact O-CG 3.43Å; E101-K105 PolarHBondContact O-N 3.45Å; E101-K105 VanDerWaalsContact O-N 3.08Å; E101-K105 IonicContact OE1-NZ 3.72Å; E101-K105 PolarHBondContact OE1-NZ 2.93Å; S102-K105 PolarHBondContact O-N 3.37Å; K105-L107 PolarHBondContact O-N 3.49Å; K105-F108 PolarHBondContact O-N 3.05Å; K105-Y109 HydrophobicContact CB-CD2 4.1Å; K105-Y109 HydrophobicContact CB-CE2 3.92Å; K105-Y109 HydrophobicContact CG-CE2 4.35Å; K105-Y109 WeakPolarHBondContact O-CB 3.38Å; K105-Y109 WeakPolarHBondContact O-CD2 3.35Å; K105-Y109 PolarHBondContact O-N 3.17Å; K105-D170 WeakPolarHBondContact CE-OD2 3.35Å; K105-D170 IonicContact NZ-OD2 2.79Å; K105-D170 PolarHBondContact NZ-OD2 3.08Å; K105-E217 HydrophobicContact CB-CG 3.82Å
106L97.6Very high95.5Very high22 Ų2233.6 Ų33.612%0.11519%0.193CC..Hα-helixtrans-58.4-49.5176.7178.262.2000112.2S102 W104 F108 L110 V214 E217 F218 L221S102-L106 WeakPolarHBondContact O-CB 3.44Å; S102-L106 PolarHBondContact O-N 3.03Å; W104-L106 PolarHBondContact O-N 3.09Å; L106-F108 VanDerWaalsContact C-N 3.3Å; L106-F108 PolarHBondContact O-N 2.74Å; L106-L110 WeakPolarHBondContact O-CB 3.43Å; L106-L110 PolarHBondContact O-N 3.28Å; L106-V214 HydrophobicContact CD1-CG1 3.91Å; L106-V214 WeakPolarHBondContact CD1-O 3.31Å; L106-E217 HydrophobicContact CB-CB 3.87Å; L106-E217 HydrophobicContact CD1-CB 4.47Å; L106-F218 HydrophobicContact CD1-CB 3.97Å; L106-F218 HydrophobicContact CD2-CB 4.32Å; L106-F218 HydrophobicContact CD2-CD2 4.21Å; L106-L221 HydrophobicContact CB-CD1 4.4Å; L106-L221 HydrophobicContact CD2-CD1 3.44Å; L106-L221 VanDerWaalsContact CD2-CD1 3.44Å
107L96.9Very high95.9Very high98 Ų9832.9 Ų32.951%0.51319%0.187SC..Hα-helixtrans-60.4-43.2-178.9-72.3178.4000111.5F82 A103 W104 K105 G111F82-L107 HydrophobicContact CE1-CD1 4.12Å; F82-L107 HydrophobicContact CZ-CD1 3.77Å; A103-L107 WeakPolarHBondContact O-CG 3.42Å; A103-L107 PolarHBondContact O-N 3.11Å; W104-L107 PolarHBondContact O-N 2.97Å; K105-L107 PolarHBondContact O-N 3.49Å; L107-G111 PolarHBondContact O-N 3.16Å; L107-G111 VanDerWaalsContact O-N 3.16Å
108F97.1Very high96.2Very high14 Ų1435.9 Ų35.96%0.06118%0.182CC..Hα-helixtrans-65.6-55.3179.1177.9-93.7000112W70 W104 K105 L106 L110 G111 C112 F158W70-F108 HydrophobicContact CH2-CE2 4.49Å; W70-F108 HydrophobicContact CZ2-CE2 4.2Å; W104-F108 PolarHBondContact O-N 3.04Å; W104-F108 VanDerWaalsContact O-N 3.14Å; K105-F108 PolarHBondContact O-N 3.05Å; L106-F108 VanDerWaalsContact C-N 3.3Å; L106-F108 PolarHBondContact O-N 2.74Å; F108-L110 VanDerWaalsContact C-N 3.3Å; F108-L110 PolarHBondContact O-N 3.49Å; F108-G111 PolarHBondContact O-N 2.96Å; F108-C112 HydrophobicContact CE1-CB 4.37Å; F108-C112 WeakPolarHBondContact CE2-SG 3.47Å; F108-C112 HydrophobicContact CZ-CB 4.4Å; F108-C112 WeakPolarHBondContact CZ-SG 3.47Å; F108-C112 PolarHBondContact O-N 3.48Å; F108-F158 HydrophobicContact CB-CD2 4.25Å; F108-F158 HydrophobicContact CB-CE2 3.66Å; F108-F158 HydrophobicContact CB-CZ 3.83Å; F108-F158 HydrophobicContact CD1-CB 4.42Å; F108-F158 AromaticContact CD1-CD1 3.4Å; F108-F158 HydrophobicContact CD1-CD1 3.4Å; F108-F158 AromaticContact CD1-CD2 3.76Å; F108-F158 HydrophobicContact CD1-CD2 3.76Å; F108-F158 AromaticContact CD1-CE1 3.35Å; F108-F158 HydrophobicContact CD1-CE1 3.35Å; F108-F158 AromaticContact CD1-CE2 3.7Å; F108-F158 HydrophobicContact CD1-CE2 3.7Å; F108-F158 AromaticContact CD1-CG 3.6Å; F108-F158 HydrophobicContact CD1-CG 3.6Å; F108-F158 AromaticContact CD1-CZ 3.5Å; F108-F158 HydrophobicContact CD1-CZ 3.5Å; F108-F158 HydrophobicContact CD2-CB 4.15Å; F108-F158 HydrophobicContact CD2-CD1 4.36Å; F108-F158 AromaticContact CD2-CD2 3.27Å; F108-F158 HydrophobicContact CD2-CD2 3.27Å; F108-F158 AromaticContact CD2-CE2 3.6Å; F108-F158 HydrophobicContact CD2-CE2 3.6Å; F108-F158 AromaticContact CD2-CG 3.69Å; F108-F158 HydrophobicContact CD2-CG 3.69Å; F108-F158 HydrophobicContact CD2-CZ 4.29Å; F108-F158 HydrophobicContact CE1-CB 3.71Å; F108-F158 AromaticContact CE1-CD1 3.17Å; F108-F158 HydrophobicContact CE1-CD1 3.17Å; F108-F158 AromaticContact CE1-CD2 3.92Å; F108-F158 HydrophobicContact CE1-CD2 3.92Å; F108-F158 AromaticContact CE1-CE1 3.65Å; F108-F158 HydrophobicContact CE1-CE1 3.65Å; F108-F158 HydrophobicContact CE1-CE2 4.3Å; F108-F158 AromaticContact CE1-CG 3.31Å; F108-F158 HydrophobicContact CE1-CG 3.31Å; F108-F158 HydrophobicContact CE1-CZ 4.19Å; F108-F158 HydrophobicContact CE2-CB 3.35Å; F108-F158 HydrophobicContact CE2-CD1 4.17Å; F108-F158 AromaticContact CE2-CD2 3.43Å; F108-F158 HydrophobicContact CE2-CD2 3.43Å; F108-F158 VanDerWaalsContact CE2-CD2 3.43Å; F108-F158 HydrophobicContact CE2-CE2 4.21Å; F108-F158 AromaticContact CE2-CG 3.39Å; F108-F158 HydrophobicContact CE2-CG 3.39Å; F108-F158 HydrophobicContact CG-CD1 4.01Å; F108-F158 AromaticContact CG-CD2 3.45Å; F108-F158 HydrophobicContact CG-CD2 3.45Å; F108-F158 VanDerWaalsContact CG-CD2 3.45Å; F108-F158 AromaticContact CG-CE1 3.92Å; F108-F158 HydrophobicContact CG-CE1 3.92Å; F108-F158 AromaticContact CG-CE2 3.32Å; F108-F158 HydrophobicContact CG-CE2 3.32Å; F108-F158 AromaticContact CG-CG 3.78Å; F108-F158 HydrophobicContact CG-CG 3.78Å; F108-F158 AromaticContact CG-CZ 3.57Å; F108-F158 HydrophobicContact CG-CZ 3.57Å; F108-F158 HydrophobicContact CZ-CB 3.1Å; F108-F158 AromaticContact CZ-CD1 3.6Å; F108-F158 HydrophobicContact CZ-CD1 3.6Å; F108-F158 AromaticContact CZ-CD2 3.76Å; F108-F158 HydrophobicContact CZ-CD2 3.76Å; F108-F158 HydrophobicContact CZ-CE1 4.41Å; F108-F158 AromaticContact CZ-CG 3.2Å; F108-F158 HydrophobicContact CZ-CG 3.2Å
109Y97.2Very high96.4Very high15 Ų1533.6 Ų33.66%0.05917%0.174CC..Hα-helixtrans-64-37.2-177.3-67.6-51.6000111.7K105 G111 W113 F158 D213 V214K105-Y109 HydrophobicContact CB-CD2 4.1Å; K105-Y109 HydrophobicContact CB-CE2 3.92Å; K105-Y109 HydrophobicContact CG-CE2 4.35Å; K105-Y109 WeakPolarHBondContact O-CB 3.38Å; K105-Y109 WeakPolarHBondContact O-CD2 3.35Å; K105-Y109 PolarHBondContact O-N 3.17Å; Y109-G111 PolarHBondContact O-N 3.14Å; Y109-W113 WeakPolarHBondContact O-CB 3.47Å; Y109-W113 PolarHBondContact O-N 3.48Å; Y109-F158 HydrophobicContact CE1-CE1 4.25Å; Y109-D213 HydrophobicContact CD1-CB 4.39Å; Y109-D213 HydrophobicContact CD2-CB 3.64Å; Y109-D213 HydrophobicContact CE2-CB 3.8Å; Y109-D213 HydrophobicContact CG-CB 3.97Å; Y109-V214 VanDerWaalsContact C-CG2 3.45Å
110L97.8Very high96.4Very high76 Ų7633.6 Ų33.640%0.39817%0.174SC..Hα-helixtrans-63.4-44177-179.863.1000110.9L106 F108 S114 V214L106-L110 WeakPolarHBondContact O-CB 3.43Å; L106-L110 PolarHBondContact O-N 3.28Å; F108-L110 VanDerWaalsContact C-N 3.3Å; F108-L110 PolarHBondContact O-N 3.49Å; L110-S114 WeakPolarHBondContact O-CB 3.46Å; L110-S114 PolarHBondContact O-N 2.93Å; L110-S114 PolarHBondContact O-OG 2.81Å; L110-V214 HydrophobicContact CB-CG1 4.38Å; L110-V214 HydrophobicContact CB-CG2 4.35Å; L110-V214 HydrophobicContact CD1-CG1 3.94Å
111G97.7Very high96.4Very high43 Ų4337.6 Ų37.644%0.44319%0.194SC..Hα-helixtrans-63.5-51.9177.200000112.3L107 F108 Y109 S114 Y115L107-G111 PolarHBondContact O-N 3.16Å; L107-G111 VanDerWaalsContact O-N 3.16Å; F108-G111 PolarHBondContact O-N 2.96Å; Y109-G111 PolarHBondContact O-N 3.14Å; G111-S114 PolarHBondContact O-N 2.9Å; G111-Y115 WeakPolarHBondContact O-CB 3.35Å; G111-Y115 PolarHBondContact O-N 3.19Å
112C96.7Very high96.2Very high9 Ų939.5 Ų39.56%0.06122%0.217CC..Hα-helixtrans-65.5-42.7-178.5-70.10000112.4F108 Y115 C116F108-C112 HydrophobicContact CE1-CB 4.37Å; F108-C112 WeakPolarHBondContact CE2-SG 3.47Å; F108-C112 HydrophobicContact CZ-CB 4.4Å; F108-C112 WeakPolarHBondContact CZ-SG 3.47Å; F108-C112 PolarHBondContact O-N 3.48Å; C112-Y115 PolarHBondContact O-N 3.17Å; C112-C116 PolarHBondContact O-N 3.47Å; C112-C116 PolarHBondContact O-SG 3.32Å
113W97.6Very high96Very high64 Ų6441.6 Ų41.624%0.24223%0.23CC..Hα-helixtrans-63.7-44176.1-17877.4000111.5Y109 Y115 C116 A117 F207 D210 V211 V214Y109-W113 WeakPolarHBondContact O-CB 3.47Å; Y109-W113 PolarHBondContact O-N 3.48Å; W113-Y115 VanDerWaalsContact C-N 3.28Å; W113-Y115 PolarHBondContact O-N 3.24Å; W113-C116 PolarHBondContact O-N 3.31Å; W113-A117 HydrophobicContact CH2-CB 4.46Å; W113-A117 HydrophobicContact CZ2-CB 4.41Å; W113-A117 VanDerWaalsContact O-CB 3.27Å; W113-A117 WeakPolarHBondContact O-CB 3.3Å; W113-A117 PolarHBondContact O-N 3.32Å; W113-F207 VanDerWaalsContact CD1-O 3.32Å; W113-F207 AromaticContact CE2-CE2 3.72Å; W113-F207 AromaticContact CZ2-CE2 3.71Å; W113-F207 HydrophobicContact CZ2-CE2 3.71Å; W113-F207 HydrophobicContact CZ2-CZ 4.22Å; W113-F207 AromaticContact NE1-CD2 3.39Å; W113-F207 AromaticContact NE1-CE2 3.44Å; W113-F207 PolarHBondContact NE1-O 3.48Å; W113-F207 VanDerWaalsContact NE1-O 3.16Å; W113-D210 HydrophobicContact CB-CB 3.99Å; W113-D210 HydrophobicContact CG-CB 4.43Å; W113-V211 HydrophobicContact CD2-CB 4.45Å; W113-V211 HydrophobicContact CG-CB 4.42Å; W113-V211 HydrophobicContact CZ2-CB 4.34Å; W113-V211 HydrophobicContact CZ2-CG2 3.97Å; W113-V214 HydrophobicContact CB-CG2 4.31Å
114S97.9Very high95.5Very high55 Ų5552.9 Ų52.939%0.38527%0.27SS..Hα-helixtrans-61.7-38.7177-58.70000111.7L110 G111 A117 Y118L110-S114 WeakPolarHBondContact O-CB 3.46Å; L110-S114 PolarHBondContact O-N 2.93Å; L110-S114 PolarHBondContact O-OG 2.81Å; G111-S114 PolarHBondContact O-N 2.9Å; S114-A117 PolarHBondContact O-N 2.95Å; S114-Y118 WeakPolarHBondContact O-CB 3.22Å; S114-Y118 PolarHBondContact O-N 3.47Å
115Y97.5Very high95.2Very high68 Ų6854.6 Ų54.627%0.26728%0.277SS..Hα-helixtrans-65.4-46.5175.2-174.6-121.8000111.9G111 C112 W113 A117 Y118 L119 D147 A150 A151G111-Y115 WeakPolarHBondContact O-CB 3.35Å; G111-Y115 PolarHBondContact O-N 3.19Å; C112-Y115 PolarHBondContact O-N 3.17Å; W113-Y115 VanDerWaalsContact C-N 3.28Å; W113-Y115 PolarHBondContact O-N 3.24Å; Y115-A117 VanDerWaalsContact C-N 3.34Å; Y115-A117 PolarHBondContact O-N 3.22Å; Y115-Y118 WeakPolarHBondContact O-CB 3.49Å; Y115-Y118 PolarHBondContact O-N 3.43Å; Y115-L119 HydrophobicContact CD1-CD1 4.34Å; Y115-L119 HydrophobicContact CE1-CD1 3.9Å; Y115-L119 HydrophobicContact CE2-CD2 4.45Å; Y115-L119 HydrophobicContact CE2-CG 4.5Å; Y115-L119 WeakPolarHBondContact O-CG 3.48Å; Y115-L119 PolarHBondContact O-N 3.48Å; Y115-D147 WeakPolarHBondContact CE1-O 3.44Å; Y115-D147 VanDerWaalsContact OH-CA 3.31Å; Y115-D147 WeakPolarHBondContact OH-CA 3.22Å; Y115-D147 PolarHBondContact OH-O 3.04Å; Y115-A150 HydrophobicContact CE1-CB 4.39Å; Y115-A151 HydrophobicContact CD1-CB 3.97Å; Y115-A151 HydrophobicContact CE1-CB 3.8Å
116C96.9Very high94.9Very high1 Ų156.4 Ų56.41%0.00729%0.292CS..Hα-helixtrans-62.8-40.6175.8-63.90000111.9C112 W113 L119 L120 L203 F207C112-C116 PolarHBondContact O-N 3.47Å; C112-C116 PolarHBondContact O-SG 3.32Å; W113-C116 PolarHBondContact O-N 3.31Å; C116-L119 PolarHBondContact O-N 3.42Å; C116-L120 WeakPolarHBondContact O-CB 3.24Å; C116-L120 WeakPolarHBondContact O-CG 3.42Å; C116-L120 PolarHBondContact O-N 2.78Å; C116-L203 HydrophobicContact CB-CD1 4.15Å; C116-F207 HydrophobicContact CB-CB 4.22Å
117A96.8Very high94.5Very high13 Ų1355.5 Ų55.511%0.10729%0.287CS..Hα-helixtrans-61.9-42.9175.800000111.5W113 S114 Y115 L120 L121 F207W113-A117 HydrophobicContact CH2-CB 4.46Å; W113-A117 HydrophobicContact CZ2-CB 4.41Å; W113-A117 VanDerWaalsContact O-CB 3.27Å; W113-A117 WeakPolarHBondContact O-CB 3.3Å; W113-A117 PolarHBondContact O-N 3.32Å; S114-A117 PolarHBondContact O-N 2.95Å; Y115-A117 VanDerWaalsContact C-N 3.34Å; Y115-A117 PolarHBondContact O-N 3.22Å; A117-L120 PolarHBondContact O-N 3.08Å; A117-L121 VanDerWaalsContact O-CB 3.29Å; A117-L121 WeakPolarHBondContact O-CB 3.32Å; A117-L121 PolarHBondContact O-N 3.41Å; A117-F207 HydrophobicContact CB-CD2 4.05Å; A117-F207 HydrophobicContact CB-CE2 3.67Å
118Y96.6Very high94.1Very high143 Ų14351.7 Ų51.756%0.56127%0.267SS*.Iπ-helixtrans-59.8-46173.5167.8-103.3000111.7S114 Y115 G122 T123S114-Y118 WeakPolarHBondContact O-CB 3.22Å; S114-Y118 PolarHBondContact O-N 3.47Å; Y115-Y118 WeakPolarHBondContact O-CB 3.49Å; Y115-Y118 PolarHBondContact O-N 3.43Å; Y118-G122 CarbonylContact O-C 3.59Å; Y118-G122 WeakPolarHBondContact O-CA 3.45Å; Y118-G122 PolarHBondContact O-N 2.88Å; Y118-T123 HydrophobicContact CE1-CG2 4.05Å; Y118-T123 PolarHBondContact O-N 3.42Å
119L95.3Very high93.7Very high2 Ų257.4 Ų57.41%0.0129%0.293CS..Iπ-helixtrans-62-47.2177.1-65-179.5000111.6Y115 C116 T123 Y125 D147 L203Y115-L119 HydrophobicContact CD1-CD1 4.34Å; Y115-L119 HydrophobicContact CE1-CD1 3.9Å; Y115-L119 HydrophobicContact CE2-CD2 4.45Å; Y115-L119 HydrophobicContact CE2-CG 4.5Å; Y115-L119 WeakPolarHBondContact O-CG 3.48Å; Y115-L119 PolarHBondContact O-N 3.48Å; C116-L119 PolarHBondContact O-N 3.42Å; L119-T123 HydrophobicContact CD2-CG2 4.32Å; L119-T123 WeakPolarHBondContact O-CB 3.41Å; L119-T123 PolarHBondContact O-OG1 2.88Å; L119-Y125 HydrophobicContact CB-CD2 4.5Å; L119-D147 HydrophobicContact CD2-CB 3.9Å; L119-L203 HydrophobicContact CB-CD2 4.01Å; L119-L203 HydrophobicContact CD1-CD1 4.13Å; L119-L203 HydrophobicContact CD1-CD2 4.17Å
120L93.9Very high93.3Very high2 Ų257.9 Ų57.91%0.0130%0.296CS..Iπ-helixtrans-75.5-35.7-174.7-68.2176.6000114.7C116 A117 F127 F128 L203 L204 F207C116-L120 WeakPolarHBondContact O-CB 3.24Å; C116-L120 WeakPolarHBondContact O-CG 3.42Å; C116-L120 PolarHBondContact O-N 2.78Å; A117-L120 PolarHBondContact O-N 3.08Å; L120-F127 HydrophobicContact CD2-CD2 3.71Å; L120-F127 HydrophobicContact CD2-CE2 3.17Å; L120-F127 HydrophobicContact CD2-CZ 4.01Å; L120-F128 HydrophobicContact CB-CB 4.28Å; L120-F128 HydrophobicContact CD1-CD2 4.27Å; L120-F128 HydrophobicContact CD2-CB 4.34Å; L120-L203 HydrophobicContact CD2-CD2 3.86Å; L120-L203 HydrophobicContact CD2-CG 4.14Å; L120-L203 HydrophobicContact CG-CD2 4.26Å; L120-L203 HydrophobicContact CG-CG 4.35Å; L120-L204 HydrophobicContact CD1-CD2 4.22Å; L120-L204 HydrophobicContact CD2-CD2 4Å; L120-F207 HydrophobicContact CD1-CB 3.31Å; L120-F207 HydrophobicContact CD1-CD1 3.8Å; L120-F207 HydrophobicContact CD1-CD2 3.92Å; L120-F207 HydrophobicContact CD1-CG 3.39Å
121L93.4Very high92.8Very high95 Ų9554.6 Ų54.650%0.49728%0.28SS..Iπ-helixtrans-111-24.4-171-53.4178.2000112.9A117 F128 F207A117-L121 VanDerWaalsContact O-CB 3.29Å; A117-L121 WeakPolarHBondContact O-CB 3.32Å; A117-L121 PolarHBondContact O-N 3.41Å; L121-F128 HydrophobicContact CD2-CD1 3.59Å; L121-F128 HydrophobicContact CD2-CE1 3.77Å; L121-F128 HydrophobicContact CD2-CG 4.16Å; L121-F128 HydrophobicContact CD2-CZ 4.48Å; L121-F207 HydrophobicContact CD1-CZ 4.35Å
122G89.1Confident92.4Very high52 Ų5253.1 Ų53.154%0.53626%0.262SS..Iπ-helixtrans-100.2-12.6-177.300000114.3Y118Y118-G122 CarbonylContact O-C 3.59Å; Y118-G122 WeakPolarHBondContact O-CA 3.45Å; Y118-G122 PolarHBondContact O-N 2.88Å
123T91.4Very high92.1Very high45 Ų4553 Ų5328%0.27626%0.262SS..SBendtrans-115.1-176.2176.783.80000111.6Y118 L119 Y125Y118-T123 HydrophobicContact CE1-CG2 4.05Å; Y118-T123 PolarHBondContact O-N 3.42Å; L119-T123 HydrophobicContact CD2-CG2 4.32Å; L119-T123 WeakPolarHBondContact O-CB 3.41Å; L119-T123 PolarHBondContact O-OG1 2.88Å; T123-Y125 VanDerWaalsContact C-N 3.3Å; T123-Y125 PolarHBondContact O-N 3.19Å; T123-Y125 WeakPolarHBondContact OG1-CD2 3.5Å
124R86.6Confident91.7Very high247 Ų24750.2 Ų50.293%0.93225%0.252SS*.SBendtrans-88.614.3-173.7-62.2-175.8179.8-176.6-0.2114.1P126R124-P126 WeakPolarHBondContact O-CD 3.48Å
125Y90.3Very high91.4Very high52 Ų5247.8 Ų47.820%0.20423%0.234CC..  trans-69.1120.1177.7-73-52.7000111L119 T123 F127 D147 I148L119-Y125 HydrophobicContact CB-CD2 4.5Å; T123-Y125 VanDerWaalsContact C-N 3.3Å; T123-Y125 PolarHBondContact O-N 3.19Å; T123-Y125 WeakPolarHBondContact OG1-CD2 3.5Å; Y125-F127 VanDerWaalsContact CB-CE1 3.44Å; Y125-F127 HydrophobicContact CD1-CD1 4.4Å; Y125-F127 AromaticContact CD1-CE1 3.5Å; Y125-F127 HydrophobicContact CD1-CE1 3.5Å; Y125-F127 VanDerWaalsContact CD1-CE1 3.5Å; Y125-F127 HydrophobicContact CD1-CZ 4.13Å; Y125-F127 HydrophobicContact CD2-CE1 4.43Å; Y125-F127 HydrophobicContact CD2-CZ 4.29Å; Y125-F127 HydrophobicContact CE1-CE1 4.39Å; Y125-F127 HydrophobicContact CG-CD1 4.47Å; Y125-F127 AromaticContact CG-CE1 3.54Å; Y125-F127 HydrophobicContact CG-CE1 3.54Å; Y125-F127 AromaticContact CG-CZ 3.8Å; Y125-F127 HydrophobicContact CG-CZ 3.8Å; Y125-F127 PolarHBondContact O-N 2.88Å; Y125-D147 WeakPolarHBondContact CE2-OD2 3.24Å; Y125-D147 PolarHBondContact OH-OD1 3.15Å; Y125-D147 PolarHBondContact OH-OD2 2.96Å; Y125-I148 HydrophobicContact CE1-CD1 4.15Å; Y125-I148 HydrophobicContact CE2-CD1 4.23Å; Y125-I148 HydrophobicContact CE2-CG1 4.36Å
126P88.4Confident91Very high69 Ų6950.1 Ų50.145%0.44824%0.243SC..G310 helixtrans-79.2-20.3-172.230.2-34.5000113.3R124 F128 H129 D130R124-P126 WeakPolarHBondContact O-CD 3.48Å; P126-F128 VanDerWaalsContact C-N 3.27Å; P126-F128 PolarHBondContact O-N 3.41Å; P126-F128 VanDerWaalsContact O-N 3.1Å; P126-H129 PolarHBondContact O-N 3.28Å; P126-D130 PolarHBondContact O-N 2.99Å
127F89.3Confident90.6Very high3 Ų356.5 Ų56.51%0.01328%0.278CS..G310 helixtrans-71.4-11.2-161.749.1-100.5000116.6L120 Y125 D130 P131 S133 V134 N200 L203 L204L120-F127 HydrophobicContact CD2-CD2 3.71Å; L120-F127 HydrophobicContact CD2-CE2 3.17Å; L120-F127 HydrophobicContact CD2-CZ 4.01Å; Y125-F127 VanDerWaalsContact CB-CE1 3.44Å; Y125-F127 HydrophobicContact CD1-CD1 4.4Å; Y125-F127 AromaticContact CD1-CE1 3.5Å; Y125-F127 HydrophobicContact CD1-CE1 3.5Å; Y125-F127 VanDerWaalsContact CD1-CE1 3.5Å; Y125-F127 HydrophobicContact CD1-CZ 4.13Å; Y125-F127 HydrophobicContact CD2-CE1 4.43Å; Y125-F127 HydrophobicContact CD2-CZ 4.29Å; Y125-F127 HydrophobicContact CE1-CE1 4.39Å; Y125-F127 HydrophobicContact CG-CD1 4.47Å; Y125-F127 AromaticContact CG-CE1 3.54Å; Y125-F127 HydrophobicContact CG-CE1 3.54Å; Y125-F127 AromaticContact CG-CZ 3.8Å; Y125-F127 HydrophobicContact CG-CZ 3.8Å; Y125-F127 PolarHBondContact O-N 2.88Å; F127-D130 WeakPolarHBondContact CA-O 3.41Å; F127-P131 WeakPolarHBondContact O-CA 3.26Å; F127-S133 WeakPolarHBondContact CA-OG 3.38Å; F127-S133 WeakPolarHBondContact CB-OG 3.47Å; F127-S133 PolarHBondContact N-OG 2.91Å; F127-V134 HydrophobicContact CB-CB 4.45Å; F127-V134 HydrophobicContact CB-CG1 3.46Å; F127-V134 VanDerWaalsContact CB-CG1 3.46Å; F127-V134 HydrophobicContact CD2-CG1 4.22Å; F127-V134 HydrophobicContact CG-CG1 3.99Å; F127-N200 HydrophobicContact CD1-CB 4.18Å; F127-N200 HydrophobicContact CE1-CB 4.05Å; F127-N200 HydrophobicContact CE2-CB 4.39Å; F127-N200 HydrophobicContact CG-CB 4.43Å; F127-N200 HydrophobicContact CZ-CB 4.18Å; F127-L203 HydrophobicContact CE2-CB 4.35Å; F127-L203 HydrophobicContact CE2-CD2 3.94Å; F127-L203 HydrophobicContact CZ-CD2 3.84Å; F127-L204 HydrophobicContact CD2-CD1 4.31Å; F127-L204 HydrophobicContact CD2-CD2 3.92Å; F127-L204 HydrophobicContact CD2-CG 3.9Å; F127-L204 HydrophobicContact CE2-CD2 4.48Å; F127-L204 HydrophobicContact CE2-CG 4.42Å
128F89.3Confident90.4Very high18 Ų1857.5 Ų57.58%0.07928%0.279CS..G310 helixtrans-72.3-39.6166.7-174.5-102000111.8L120 L121 P126 L204 F207 W258 K262L120-F128 HydrophobicContact CB-CB 4.28Å; L120-F128 HydrophobicContact CD1-CD2 4.27Å; L120-F128 HydrophobicContact CD2-CB 4.34Å; L121-F128 HydrophobicContact CD2-CD1 3.59Å; L121-F128 HydrophobicContact CD2-CE1 3.77Å; L121-F128 HydrophobicContact CD2-CG 4.16Å; L121-F128 HydrophobicContact CD2-CZ 4.48Å; P126-F128 VanDerWaalsContact C-N 3.27Å; P126-F128 PolarHBondContact O-N 3.41Å; P126-F128 VanDerWaalsContact O-N 3.1Å; F128-L204 HydrophobicContact CB-CD2 4.33Å; F128-L204 HydrophobicContact CD2-CD2 4.02Å; F128-F207 HydrophobicContact CD2-CD1 4.33Å; F128-F207 HydrophobicContact CD2-CE1 4.24Å; F128-F207 AromaticContact CE2-CD1 3.87Å; F128-F207 HydrophobicContact CE2-CD1 3.87Å; F128-F207 AromaticContact CE2-CE1 3.47Å; F128-F207 HydrophobicContact CE2-CE1 3.47Å; F128-F207 VanDerWaalsContact CE2-CE1 3.47Å; F128-F207 HydrophobicContact CE2-CZ 4.41Å; F128-F207 AromaticContact CZ-CE1 3.97Å; F128-F207 HydrophobicContact CZ-CE1 3.97Å; F128-W258 HydrophobicContact CE2-CZ3 4.37Å; F128-W258 HydrophobicContact CZ-CE3 4.31Å; F128-W258 HydrophobicContact CZ-CH2 4.12Å; F128-W258 AromaticContact CZ-CZ3 3.8Å; F128-W258 HydrophobicContact CZ-CZ3 3.8Å; F128-K262 PolarHBondContact O-NZ 2.95Å
129H89Confident90Very high134 Ų13459 Ų5962%0.6228%0.283SS*.THydrogen-bonded Turntrans-88.5-33.4-177.9-65.3-74.2000112.5P126 P131P126-H129 PolarHBondContact O-N 3.28Å; H129-P131 WeakPolarHBondContact O-CD 3.35Å
130D88.6Confident89.6Confident24 Ų2461.3 Ų61.313%0.12830%0.3CS..SBendtrans-120.880.1174.7-178.533.6000110.4P13 P126 F127 P132 S133 Y136P13-D130 HydrophobicContact CB-CB 4.35Å; P126-D130 PolarHBondContact O-N 2.99Å; F127-D130 WeakPolarHBondContact CA-O 3.41Å; D130-P132 VanDerWaalsContact C-CD 3.4Å; D130-P132 VanDerWaalsContact C-N 3.34Å; D130-P132 WeakPolarHBondContact OD1-CD 3.42Å; D130-S133 WeakPolarHBondContact O-CB 3.38Å; D130-S133 PolarHBondContact O-N 3.35Å; D130-S133 PolarHBondContact O-OG 3.22Å; D130-S133 WeakPolarHBondContact OD2-CB 3.29Å; D130-Y136 WeakPolarHBondContact OD2-CE2 3.49Å; D130-Y136 PolarHBondContact OD2-OH 3.47Å
131P87.6Confident89.2Confident7 Ų762.8 Ų62.85%0.04532%0.315CS..G310 helixtrans-53.4-36.9-175-23.932.6000116F127 H129 S133 V134 K262 A266F127-P131 WeakPolarHBondContact O-CA 3.26Å; H129-P131 WeakPolarHBondContact O-CD 3.35Å; P131-S133 PolarHBondContact O-N 2.81Å; P131-S133 VanDerWaalsContact O-N 3.15Å; P131-V134 WeakPolarHBondContact O-CG1 3.27Å; P131-V134 VanDerWaalsContact O-CG2 3.24Å; P131-V134 WeakPolarHBondContact O-CG2 3.29Å; P131-V134 PolarHBondContact O-N 3.09Å; P131-K262 HydrophobicContact CB-CB 4.16Å; P131-K262 WeakPolarHBondContact CB-O 3.45Å; P131-K262 HydrophobicContact CG-CB 3.98Å; P131-K262 HydrophobicContact CG-CD 4.4Å; P131-K262 HydrophobicContact CG-CG 3.8Å; P131-A266 HydrophobicContact CB-CB 4.47Å
132P88.2Confident89.1Confident12 Ų1261.1 Ų61.18%0.07831%0.305CS..G310 helixtrans-54.3-28.9173.1-29.537.2000114.5D130 V134 F135 Y136D130-P132 VanDerWaalsContact C-CD 3.4Å; D130-P132 VanDerWaalsContact C-N 3.34Å; D130-P132 WeakPolarHBondContact OD1-CD 3.42Å; P132-V134 PolarHBondContact O-N 3.4Å; P132-F135 PolarHBondContact O-N 3.45Å; P132-Y136 HydrophobicContact CB-CE1 4.19Å; P132-Y136 WeakPolarHBondContact O-CE1 3.43Å
133S89.4Confident89.2Confident8 Ų862.7 Ų62.76%0.05631%0.314CS..G310 helixtrans-64.6-10.9-178.968.60000115.5F127 D130 P131 F135 Y136F127-S133 WeakPolarHBondContact CA-OG 3.38Å; F127-S133 WeakPolarHBondContact CB-OG 3.47Å; F127-S133 PolarHBondContact N-OG 2.91Å; D130-S133 WeakPolarHBondContact O-CB 3.38Å; D130-S133 PolarHBondContact O-N 3.35Å; D130-S133 PolarHBondContact O-OG 3.22Å; D130-S133 WeakPolarHBondContact OD2-CB 3.29Å; P131-S133 PolarHBondContact O-N 2.81Å; P131-S133 VanDerWaalsContact O-N 3.15Å; S133-F135 PolarHBondContact O-N 3.02Å; S133-F135 VanDerWaalsContact O-N 3.1Å; S133-Y136 VanDerWaalsContact CA-CD2 3.41Å; S133-Y136 VanDerWaalsContact CA-CE2 3.5Å; S133-Y136 VanDerWaalsContact CB-CE2 3.44Å; S133-Y136 PolarHBondContact O-N 3.12Å; S133-Y136 VanDerWaalsContact O-N 3.15Å
134V91.2Very high89.3Confident5 Ų561.5 Ų61.53%0.0331%0.306CS..G310 helixtrans-57.8-23.9173.8-64.30000113.6F127 P131 P132 N200 V201 L204 A266F127-V134 HydrophobicContact CB-CB 4.45Å; F127-V134 HydrophobicContact CB-CG1 3.46Å; F127-V134 VanDerWaalsContact CB-CG1 3.46Å; F127-V134 HydrophobicContact CD2-CG1 4.22Å; F127-V134 HydrophobicContact CG-CG1 3.99Å; P131-V134 WeakPolarHBondContact O-CG1 3.27Å; P131-V134 VanDerWaalsContact O-CG2 3.24Å; P131-V134 WeakPolarHBondContact O-CG2 3.29Å; P131-V134 PolarHBondContact O-N 3.09Å; P132-V134 PolarHBondContact O-N 3.4Å; V134-N200 HydrophobicContact CB-CB 3.99Å; V134-N200 HydrophobicContact CG1-CB 4.09Å; V134-N200 PolarHBondContact O-ND2 3.45Å; V134-V201 HydrophobicContact CB-CG2 3.85Å; V134-V201 HydrophobicContact CG1-CG2 4.34Å; V134-V201 HydrophobicContact CG2-CG2 3.67Å; V134-L204 HydrophobicContact CG1-CD1 3.64Å; V134-A266 HydrophobicContact CG2-CB 3.9Å
135F91.5Very high89.7Confident4 Ų451.9 Ų51.92%0.01828%0.275CS..G310 helixtrans-109.60.6179.1-67.3-68.6000114.1P132 S133 D137 W138 Y198 V201 A266 T267 S271 I278P132-F135 PolarHBondContact O-N 3.45Å; S133-F135 PolarHBondContact O-N 3.02Å; S133-F135 VanDerWaalsContact O-N 3.1Å; F135-D137 PolarHBondContact O-N 3.42Å; F135-W138 WeakPolarHBondContact O-CB 3.24Å; F135-W138 PolarHBondContact O-N 2.75Å; F135-Y198 HydrophobicContact CD1-CD1 4.39Å; F135-Y198 AromaticContact CE1-CD1 3.65Å; F135-Y198 HydrophobicContact CE1-CD1 3.65Å; F135-Y198 AromaticContact CE1-CE1 3.96Å; F135-Y198 HydrophobicContact CE1-CE1 3.96Å; F135-Y198 HydrophobicContact CE1-CG 4.19Å; F135-V201 HydrophobicContact CE1-CG2 4.3Å; F135-V201 HydrophobicContact CE2-CG2 4Å; F135-V201 HydrophobicContact CZ-CG2 3.69Å; F135-A266 WeakPolarHBondContact CE2-O 3.18Å; F135-T267 HydrophobicContact CE2-CG2 4.11Å; F135-T267 HydrophobicContact CZ-CG2 4.07Å; F135-S271 VanDerWaalsContact CE2-CB 3.46Å; F135-I278 HydrophobicContact CD1-CD1 3.58Å; F135-I278 HydrophobicContact CE1-CD1 3.36Å; F135-I278 HydrophobicContact CG-CD1 4.47Å; F135-I278 HydrophobicContact CZ-CD1 4.12Å
136Y89.2Confident89.8Confident116 Ų11660.3 Ų60.346%0.45531%0.307SS..THydrogen-bonded Turntrans-64.2136176.4-65.2-6.8000109.8D130 P132 S133 W138D130-Y136 WeakPolarHBondContact OD2-CE2 3.49Å; D130-Y136 PolarHBondContact OD2-OH 3.47Å; P132-Y136 HydrophobicContact CB-CE1 4.19Å; P132-Y136 WeakPolarHBondContact O-CE1 3.43Å; S133-Y136 VanDerWaalsContact CA-CD2 3.41Å; S133-Y136 VanDerWaalsContact CA-CE2 3.5Å; S133-Y136 VanDerWaalsContact CB-CE2 3.44Å; S133-Y136 PolarHBondContact O-N 3.12Å; S133-Y136 VanDerWaalsContact O-N 3.15Å; Y136-W138 PolarHBondContact O-N 3.3Å
137D86.8Confident90.2Very high135 Ų13559.2 Ų59.272%0.72230%0.298SS*.THydrogen-bonded Turntrans54.720.9-176.8-60.2-52.4000115.3F135 R139F135-D137 PolarHBondContact O-N 3.42Å; D137-R139 PolarHBondContact O-N 2.97Å
138W92.5Very high90.5Very high34 Ų3459.1 Ų59.113%0.12930%0.297CS..  trans-60.1131.7176.617891.4000110.4F135 Y136 F196 Y198 V275 P279F135-W138 WeakPolarHBondContact O-CB 3.24Å; F135-W138 PolarHBondContact O-N 2.75Å; Y136-W138 PolarHBondContact O-N 3.3Å; W138-F196 WeakPolarHBondContact CZ2-O 3.38Å; W138-F196 PolarHBondContact NE1-O 3.22Å; W138-Y198 AromaticContact CE2-CE1 3.68Å; W138-Y198 AromaticContact CZ2-CE1 3.97Å; W138-Y198 HydrophobicContact CZ2-CE1 3.97Å; W138-Y198 AromaticContact NE1-CD1 3.54Å; W138-Y198 AromaticContact NE1-CE1 3.35Å; W138-Y198 VanDerWaalsContact NE1-CE1 3.35Å; W138-V275 HydrophobicContact CB-CG2 4.14Å; W138-V275 HydrophobicContact CE3-CB 4.49Å; W138-V275 HydrophobicContact CE3-CG1 3.76Å; W138-V275 HydrophobicContact CE3-CG2 4.04Å; W138-V275 HydrophobicContact CZ3-CG1 3.93Å; W138-P279 HydrophobicContact CH2-CG 3.48Å; W138-P279 VanDerWaalsContact CH2-CG 3.48Å; W138-P279 HydrophobicContact CZ2-CG 3.76Å
139R89.1Confident90.8Very high176 Ų17658.9 Ų58.966%0.66430%0.299SS*.  trans-137.8141175.5-62.3178.6-170.3-144.50.2109.5D137 G141 M142D137-R139 PolarHBondContact O-N 2.97Å; R139-G141 PolarHBondContact O-N 3.32Å; R139-M142 HydrophobicContact CB-CB 4.45Å; R139-M142 WeakPolarHBondContact O-CB 3.37Å; R139-M142 WeakPolarHBondContact O-CG 3.38Å; R139-M142 PolarHBondContact O-N 2.89Å; R139-M142 VanDerWaalsContact O-N 3.15Å
140S87.7Confident91.1Very high50 Ų5054.3 Ų54.335%0.3528%0.284SS..THydrogen-bonded Turntrans-55.7133171.4-163.20000110H52 H54 M142H52-S140 PolarHBondContact ND1-OG 3.44Å; H54-S140 PolarHBondContact NE2-OG 3.04Å; S140-M142 PolarHBondContact O-N 2.77Å
141G85.4Confident91.5Very high32 Ų3253.2 Ų53.233%0.3328%0.278SS..THydrogen-bonded Turntrans73.66.417800000115.9H54 R139H54-G141 WeakPolarHBondContact CD2-CA 3.4Å; H54-G141 PolarHBondContact CD2-N 3.31Å; H54-G141 VanDerWaalsContact CD2-N 3.32Å; H54-G141 WeakPolarHBondContact NE2-CA 3.41Å; H54-G141 PolarHBondContact NE2-N 2.88Å; H54-G141 VanDerWaalsContact NE2-N 3.18Å; R139-G141 PolarHBondContact O-N 3.32Å
142M91.3Very high92Very high60 Ų6053.3 Ų53.330%0.29628%0.278SS..PPolyproline II helixtrans-54.3143.7174.368.9-174.7-66.100111.3R139 S140 V144 R197R139-M142 HydrophobicContact CB-CB 4.45Å; R139-M142 WeakPolarHBondContact O-CB 3.37Å; R139-M142 WeakPolarHBondContact O-CG 3.38Å; R139-M142 PolarHBondContact O-N 2.89Å; R139-M142 VanDerWaalsContact O-N 3.15Å; S140-M142 PolarHBondContact O-N 2.77Å; M142-V144 PolarHBondContact O-N 2.97Å; M142-R197 HydrophobicContact CG-CB 3.77Å; M142-R197 HydrophobicContact CG-CG 3.95Å; M142-R197 WeakPolarHBondContact O-CD 3.35Å; M142-R197 PolarHBondContact O-NE 3.12Å; M142-R197 HydrophobicContact SD-CB 4.35Å
143A91.1Very high92.4Very high86 Ų8655.1 Ų55.171%0.71129%0.286SS*.PPolyproline II helixtrans-63.8137.1177.300000109.9
144V93.1Very high92.7Very high19 Ų1957.6 Ų57.612%0.11530%0.299CS..PPolyproline II helixtrans-85.3126.8171.7-176.60000107.7M142 W146 I148 A149 Y194 H199M142-V144 PolarHBondContact O-N 2.97Å; V144-W146 PolarHBondContact O-N 3.49Å; V144-I148 HydrophobicContact CG1-CB 4.13Å; V144-I148 HydrophobicContact CG1-CG2 4.11Å; V144-A149 HydrophobicContact CG1-CB 4.15Å; V144-Y194 HydrophobicContact CB-CE2 4.1Å; V144-Y194 HydrophobicContact CG1-CE2 3.86Å; V144-Y194 HydrophobicContact CG2-CD2 4.43Å; V144-Y194 HydrophobicContact CG2-CE2 3.96Å; V144-H199 HydrophobicContact CG1-CB 4.06Å; V144-H199 HydrophobicContact CG2-CB 4.48Å
145P94.3Very high93Very high45 Ų4557.4 Ų57.429%0.29230%0.298SS..PPolyproline II helixtrans-52.1137.8172.7-2937.8000111.8D147 I148 A149P145-D147 VanDerWaalsContact C-N 3.26Å; P145-D147 VanDerWaalsContact C-OD1 3.32Å; P145-D147 WeakPolarHBondContact CB-OD1 3.23Å; P145-D147 PolarHBondContact O-N 2.91Å; P145-I148 HydrophobicContact CB-CB 4.49Å; P145-I148 HydrophobicContact CB-CD1 4.3Å; P145-I148 HydrophobicContact CB-CG1 4.28Å; P145-I148 HydrophobicContact CG-CD1 4.16Å; P145-I148 PolarHBondContact O-N 2.86Å; P145-I148 VanDerWaalsContact O-N 3.08Å; P145-A149 PolarHBondContact O-N 3.3Å
146W93.6Very high93.3Very high230 Ų23057.6 Ų57.687%0.87130%0.301SS*.Hα-helixtrans-60.5-34.2-172.7-85.7109.7000113.8V144 A149 A150V144-W146 PolarHBondContact O-N 3.49Å; W146-A149 PolarHBondContact O-N 3.45Å; W146-A150 WeakPolarHBondContact O-CB 2.95Å; W146-A150 PolarHBondContact O-N 3.3Å
147D95.4Very high93.6Very high46 Ų4652.1 Ų52.125%0.24628%0.28CS..Hα-helixtrans-62.8-46.2173.456.3-27000112Y115 L119 Y125 P145 A150 A151Y115-D147 WeakPolarHBondContact CE1-O 3.44Å; Y115-D147 VanDerWaalsContact OH-CA 3.31Å; Y115-D147 WeakPolarHBondContact OH-CA 3.22Å; Y115-D147 PolarHBondContact OH-O 3.04Å; L119-D147 HydrophobicContact CD2-CB 3.9Å; Y125-D147 WeakPolarHBondContact CE2-OD2 3.24Å; Y125-D147 PolarHBondContact OH-OD1 3.15Å; Y125-D147 PolarHBondContact OH-OD2 2.96Å; P145-D147 VanDerWaalsContact C-N 3.26Å; P145-D147 VanDerWaalsContact C-OD1 3.32Å; P145-D147 WeakPolarHBondContact CB-OD1 3.23Å; P145-D147 PolarHBondContact O-N 2.91Å; D147-A150 PolarHBondContact O-N 3.14Å; D147-A151 PolarHBondContact O-N 2.79Å
148I95.9Very high94.1Very high0 Ų045.8 Ų45.80%025%0.246CC..Hα-helixtrans-68-41.5174.9-58.8179.9000110.2Y125 V144 P145 A150 A151 Y152 H199 L203Y125-I148 HydrophobicContact CE1-CD1 4.15Å; Y125-I148 HydrophobicContact CE2-CD1 4.23Å; Y125-I148 HydrophobicContact CE2-CG1 4.36Å; V144-I148 HydrophobicContact CG1-CB 4.13Å; V144-I148 HydrophobicContact CG1-CG2 4.11Å; P145-I148 HydrophobicContact CB-CB 4.49Å; P145-I148 HydrophobicContact CB-CD1 4.3Å; P145-I148 HydrophobicContact CB-CG1 4.28Å; P145-I148 HydrophobicContact CG-CD1 4.16Å; P145-I148 PolarHBondContact O-N 2.86Å; P145-I148 VanDerWaalsContact O-N 3.08Å; I148-A150 VanDerWaalsContact C-N 3.28Å; I148-A150 PolarHBondContact O-N 2.99Å; I148-A151 WeakPolarHBondContact O-CB 3.32Å; I148-A151 PolarHBondContact O-N 3.17Å; I148-A151 VanDerWaalsContact O-N 3.13Å; I148-Y152 HydrophobicContact CG2-CD2 3.79Å; I148-Y152 HydrophobicContact CG2-CE2 3.82Å; I148-Y152 WeakPolarHBondContact O-CD2 3.35Å; I148-Y152 PolarHBondContact O-N 2.98Å; I148-H199 HydrophobicContact CG2-CB 3.92Å; I148-L203 HydrophobicContact CG1-CD2 4.39Å
149A95.8Very high94.2Very high14 Ų1444.7 Ų44.712%0.11624%0.241CC..Hα-helixtrans-59.5-38.1176.600000112.2V144 P145 W146 Y152 L153 Y194V144-A149 HydrophobicContact CG1-CB 4.15Å; P145-A149 PolarHBondContact O-N 3.3Å; W146-A149 PolarHBondContact O-N 3.45Å; A149-Y152 WeakPolarHBondContact O-CB 3.45Å; A149-Y152 PolarHBondContact O-N 2.66Å; A149-L153 WeakPolarHBondContact O-CB 3.36Å; A149-L153 PolarHBondContact O-N 3.49Å; A149-Y194 HydrophobicContact CB-CE2 4.18Å
150A96.3Very high94.5Very high37 Ų3738.6 Ų38.631%0.30623%0.225SC..Hα-helixtrans-63.2-43.8173.900000112Y115 W146 D147 I148 Y152 L153 L154Y115-A150 HydrophobicContact CE1-CB 4.39Å; W146-A150 WeakPolarHBondContact O-CB 2.95Å; W146-A150 PolarHBondContact O-N 3.3Å; D147-A150 PolarHBondContact O-N 3.14Å; I148-A150 VanDerWaalsContact C-N 3.28Å; I148-A150 PolarHBondContact O-N 2.99Å; A150-Y152 VanDerWaalsContact C-N 3.29Å; A150-Y152 PolarHBondContact O-N 2.81Å; A150-L153 PolarHBondContact O-N 3.47Å; A150-L154 WeakPolarHBondContact O-CB 3.43Å; A150-L154 VanDerWaalsContact O-CG 3.28Å; A150-L154 WeakPolarHBondContact O-CG 3.32Å; A150-L154 PolarHBondContact O-N 3.08Å
151A97.1Very high94.9Very high2 Ų236.4 Ų36.42%0.01721%0.209CC..Hα-helixtrans-59.2-42.8175.200000111.5Y115 D147 I148 L154 Q155 L203Y115-A151 HydrophobicContact CD1-CB 3.97Å; Y115-A151 HydrophobicContact CE1-CB 3.8Å; D147-A151 PolarHBondContact O-N 2.79Å; I148-A151 WeakPolarHBondContact O-CB 3.32Å; I148-A151 PolarHBondContact O-N 3.17Å; I148-A151 VanDerWaalsContact O-N 3.13Å; A151-L154 PolarHBondContact O-N 3.5Å; A151-Q155 WeakPolarHBondContact O-CB 3.43Å; A151-Q155 VanDerWaalsContact O-CG 3.28Å; A151-Q155 WeakPolarHBondContact O-CG 3.08Å; A151-Q155 PolarHBondContact O-N 3.39Å; A151-L203 HydrophobicContact CB-CD1 4.17Å
152Y97.1Very high95.4Very high8 Ų835.2 Ų35.23%0.03120%0.196CC..Hα-helixtrans-64-43.4176.5-93.3-99.1000113.1I148 A149 A150 G156 I190 S193 Y194 H199 G202 F206I148-Y152 HydrophobicContact CG2-CD2 3.79Å; I148-Y152 HydrophobicContact CG2-CE2 3.82Å; I148-Y152 WeakPolarHBondContact O-CD2 3.35Å; I148-Y152 PolarHBondContact O-N 2.98Å; A149-Y152 WeakPolarHBondContact O-CB 3.45Å; A149-Y152 PolarHBondContact O-N 2.66Å; A150-Y152 VanDerWaalsContact C-N 3.29Å; A150-Y152 PolarHBondContact O-N 2.81Å; Y152-G156 WeakPolarHBondContact O-CA 3.38Å; Y152-G156 PolarHBondContact O-N 3.03Å; Y152-I190 HydrophobicContact CD1-CG2 3.75Å; Y152-I190 HydrophobicContact CE1-CG2 4.1Å; Y152-I190 WeakPolarHBondContact CE1-O 3.31Å; Y152-S193 WeakPolarHBondContact CE1-OG 3.3Å; Y152-S193 PolarHBondContact OH-OG 3.14Å; Y152-Y194 AromaticContact CD1-CD2 3.6Å; Y152-Y194 HydrophobicContact CD1-CD2 3.6Å; Y152-Y194 HydrophobicContact CD1-CG 4.11Å; Y152-Y194 HydrophobicContact CD2-CD2 4.35Å; Y152-Y194 HydrophobicContact CE1-CD2 4.22Å; Y152-Y194 AromaticContact CG-CD2 3.67Å; Y152-Y194 HydrophobicContact CG-CD2 3.67Å; Y152-Y194 HydrophobicContact CG-CE2 4.35Å; Y152-H199 HydrophobicContact CE2-CB 3.94Å; Y152-H199 WeakPolarHBondContact CE2-O 3.31Å; Y152-H199 VanDerWaalsContact OH-CA 3.23Å; Y152-H199 WeakPolarHBondContact OH-CA 3.43Å; Y152-H199 PolarHBondContact OH-O 3.48Å; Y152-G202 WeakPolarHBondContact OH-CA 3.33Å; Y152-G202 PolarHBondContact OH-N 2.9Å; Y152-F206 HydrophobicContact CD1-CE2 4.47Å; Y152-F206 HydrophobicContact CD1-CZ 4.36Å; Y152-F206 AromaticContact CD2-CE2 3.9Å; Y152-F206 HydrophobicContact CD2-CE2 3.9Å; Y152-F206 HydrophobicContact CE1-CE2 4.41Å; Y152-F206 HydrophobicContact CE1-CZ 4.24Å; Y152-F206 AromaticContact CE2-CE2 3.85Å; Y152-F206 HydrophobicContact CE2-CE2 3.85Å; Y152-F206 HydrophobicContact CE2-CZ 4.46Å; Y152-F206 HydrophobicContact CG-CE2 4.22Å
153L96.7Very high95.5Very high50 Ų5034.4 Ų34.426%0.26219%0.192SC..Hα-helixtrans-63.2-46.3177.4179.664.4000111L62 A63 A149 A150 S157L62-L153 HydrophobicContact CD2-CD1 4.36Å; L62-L153 HydrophobicContact CD2-CD2 3.62Å; L62-L153 HydrophobicContact CG-CD1 4.07Å; L62-L153 HydrophobicContact CG-CD2 3.92Å; A63-L153 HydrophobicContact CB-CD1 3.9Å; A149-L153 WeakPolarHBondContact O-CB 3.36Å; A149-L153 PolarHBondContact O-N 3.49Å; A150-L153 PolarHBondContact O-N 3.47Å; L153-S157 WeakPolarHBondContact O-CB 3.4Å; L153-S157 PolarHBondContact O-N 3.15Å; L153-S157 PolarHBondContact O-OG 2.92Å
154L96.7Very high95.7Very high61 Ų6135.6 Ų35.632%0.31918%0.179SC..Hα-helixtrans-60.1-51.3178.5-69.9173.4000111.2W70 A150 A151 S157 F158W70-L154 HydrophobicContact CH2-CD2 4.14Å; W70-L154 HydrophobicContact CZ2-CD2 3.66Å; A150-L154 WeakPolarHBondContact O-CB 3.43Å; A150-L154 VanDerWaalsContact O-CG 3.28Å; A150-L154 WeakPolarHBondContact O-CG 3.32Å; A150-L154 PolarHBondContact O-N 3.08Å; A151-L154 PolarHBondContact O-N 3.5Å; L154-S157 PolarHBondContact O-OG 3.05Å; L154-F158 VanDerWaalsContact O-CB 3.31Å; L154-F158 WeakPolarHBondContact O-CB 3.38Å; L154-F158 PolarHBondContact O-N 2.92Å; L154-F158 VanDerWaalsContact O-N 3.14Å
155Q96.9Very high95.8Very high1 Ų134.8 Ų34.81%0.00517%0.174CC..Hα-helixtrans-66-54-179.9-70.1-79.745.400111.9A151 S157 F158 Y159 I190 F206 D210A151-Q155 WeakPolarHBondContact O-CB 3.43Å; A151-Q155 VanDerWaalsContact O-CG 3.28Å; A151-Q155 WeakPolarHBondContact O-CG 3.08Å; A151-Q155 PolarHBondContact O-N 3.39Å; Q155-S157 PolarHBondContact O-N 3.43Å; Q155-F158 PolarHBondContact O-N 3.27Å; Q155-F158 VanDerWaalsContact O-N 3.14Å; Q155-Y159 VanDerWaalsContact O-CD2 3.31Å; Q155-Y159 WeakPolarHBondContact O-CD2 3.19Å; Q155-Y159 PolarHBondContact O-N 2.98Å; Q155-I190 HydrophobicContact CB-CD1 4.36Å; Q155-F206 HydrophobicContact CB-CD1 4.44Å; Q155-F206 HydrophobicContact CB-CE1 3.96Å; Q155-F206 HydrophobicContact CB-CE2 4.19Å; Q155-F206 HydrophobicContact CB-CZ 3.82Å; Q155-F206 HydrophobicContact CG-CD1 4.06Å; Q155-F206 HydrophobicContact CG-CD2 4Å; Q155-F206 HydrophobicContact CG-CE1 4.07Å; Q155-F206 HydrophobicContact CG-CE2 4.01Å; Q155-F206 HydrophobicContact CG-CG 4.04Å; Q155-F206 HydrophobicContact CG-CZ 4.05Å; Q155-D210 PolarHBondContact NE2-OD2 3.06Å
156G96.7Very high95.7Very high8 Ų833 Ų338%0.08216%0.163CC..Hα-helixtrans-57.6-47-177.200000112.5Y152 F158 Y159 C160Y152-G156 WeakPolarHBondContact O-CA 3.38Å; Y152-G156 PolarHBondContact O-N 3.03Å; G156-F158 VanDerWaalsContact C-N 3.35Å; G156-F158 PolarHBondContact O-N 3.37Å; G156-Y159 PolarHBondContact O-N 2.92Å; G156-C160 PolarHBondContact O-N 2.94Å; G156-C160 PolarHBondContact O-SG 2.96Å; G156-C160 VanDerWaalsContact O-SG 3.41Å
157S97.3Very high95.6Very high1 Ų124.5 Ų24.51%0.00714%0.136CC..Hα-helixtrans-66.6-34.5178.3630000113.1A63 C66 A67 W70 L153 L154 Q155 C160 H161A63-S157 VanDerWaalsContact O-CB 3.26Å; A63-S157 WeakPolarHBondContact O-CB 3.4Å; C66-S157 VanDerWaalsContact CB-CB 3.46Å; A67-S157 WeakPolarHBondContact CA-O 3.46Å; A67-S157 VanDerWaalsContact CB-O 3.3Å; A67-S157 WeakPolarHBondContact CB-O 3.48Å; W70-S157 PolarHBondContact NE1-OG 3.28Å; L153-S157 WeakPolarHBondContact O-CB 3.4Å; L153-S157 PolarHBondContact O-N 3.15Å; L153-S157 PolarHBondContact O-OG 2.92Å; L154-S157 PolarHBondContact O-OG 3.05Å; Q155-S157 PolarHBondContact O-N 3.43Å; S157-C160 WeakPolarHBondContact O-CB 3.31Å; S157-C160 PolarHBondContact O-N 3.49Å; S157-H161 PolarHBondContact O-N 3.18Å
158F96.6Very high95.5Very high2 Ų230.3 Ų30.31%0.00916%0.156CC..Hα-helixtrans-71.6-35175.1-174.7-95.2000112.8W70 W104 F108 Y109 L154 Q155 G156 H161 S162W70-F158 HydrophobicContact CD2-CD2 4.47Å; W70-F158 HydrophobicContact CG-CD2 4.33Å; W104-F158 AromaticContact NE1-CE2 3.53Å; F108-F158 HydrophobicContact CB-CD2 4.25Å; F108-F158 HydrophobicContact CB-CE2 3.66Å; F108-F158 HydrophobicContact CB-CZ 3.83Å; F108-F158 HydrophobicContact CD1-CB 4.42Å; F108-F158 AromaticContact CD1-CD1 3.4Å; F108-F158 HydrophobicContact CD1-CD1 3.4Å; F108-F158 AromaticContact CD1-CD2 3.76Å; F108-F158 HydrophobicContact CD1-CD2 3.76Å; F108-F158 AromaticContact CD1-CE1 3.35Å; F108-F158 HydrophobicContact CD1-CE1 3.35Å; F108-F158 AromaticContact CD1-CE2 3.7Å; F108-F158 HydrophobicContact CD1-CE2 3.7Å; F108-F158 AromaticContact CD1-CG 3.6Å; F108-F158 HydrophobicContact CD1-CG 3.6Å; F108-F158 AromaticContact CD1-CZ 3.5Å; F108-F158 HydrophobicContact CD1-CZ 3.5Å; F108-F158 HydrophobicContact CD2-CB 4.15Å; F108-F158 HydrophobicContact CD2-CD1 4.36Å; F108-F158 AromaticContact CD2-CD2 3.27Å; F108-F158 HydrophobicContact CD2-CD2 3.27Å; F108-F158 AromaticContact CD2-CE2 3.6Å; F108-F158 HydrophobicContact CD2-CE2 3.6Å; F108-F158 AromaticContact CD2-CG 3.69Å; F108-F158 HydrophobicContact CD2-CG 3.69Å; F108-F158 HydrophobicContact CD2-CZ 4.29Å; F108-F158 HydrophobicContact CE1-CB 3.71Å; F108-F158 AromaticContact CE1-CD1 3.17Å; F108-F158 HydrophobicContact CE1-CD1 3.17Å; F108-F158 AromaticContact CE1-CD2 3.92Å; F108-F158 HydrophobicContact CE1-CD2 3.92Å; F108-F158 AromaticContact CE1-CE1 3.65Å; F108-F158 HydrophobicContact CE1-CE1 3.65Å; F108-F158 HydrophobicContact CE1-CE2 4.3Å; F108-F158 AromaticContact CE1-CG 3.31Å; F108-F158 HydrophobicContact CE1-CG 3.31Å; F108-F158 HydrophobicContact CE1-CZ 4.19Å; F108-F158 HydrophobicContact CE2-CB 3.35Å; F108-F158 HydrophobicContact CE2-CD1 4.17Å; F108-F158 AromaticContact CE2-CD2 3.43Å; F108-F158 HydrophobicContact CE2-CD2 3.43Å; F108-F158 VanDerWaalsContact CE2-CD2 3.43Å; F108-F158 HydrophobicContact CE2-CE2 4.21Å; F108-F158 AromaticContact CE2-CG 3.39Å; F108-F158 HydrophobicContact CE2-CG 3.39Å; F108-F158 HydrophobicContact CG-CD1 4.01Å; F108-F158 AromaticContact CG-CD2 3.45Å; F108-F158 HydrophobicContact CG-CD2 3.45Å; F108-F158 VanDerWaalsContact CG-CD2 3.45Å; F108-F158 AromaticContact CG-CE1 3.92Å; F108-F158 HydrophobicContact CG-CE1 3.92Å; F108-F158 AromaticContact CG-CE2 3.32Å; F108-F158 HydrophobicContact CG-CE2 3.32Å; F108-F158 AromaticContact CG-CG 3.78Å; F108-F158 HydrophobicContact CG-CG 3.78Å; F108-F158 AromaticContact CG-CZ 3.57Å; F108-F158 HydrophobicContact CG-CZ 3.57Å; F108-F158 HydrophobicContact CZ-CB 3.1Å; F108-F158 AromaticContact CZ-CD1 3.6Å; F108-F158 HydrophobicContact CZ-CD1 3.6Å; F108-F158 AromaticContact CZ-CD2 3.76Å; F108-F158 HydrophobicContact CZ-CD2 3.76Å; F108-F158 HydrophobicContact CZ-CE1 4.41Å; F108-F158 AromaticContact CZ-CG 3.2Å; F108-F158 HydrophobicContact CZ-CG 3.2Å; Y109-F158 HydrophobicContact CE1-CE1 4.25Å; L154-F158 VanDerWaalsContact O-CB 3.31Å; L154-F158 WeakPolarHBondContact O-CB 3.38Å; L154-F158 PolarHBondContact O-N 2.92Å; L154-F158 VanDerWaalsContact O-N 3.14Å; Q155-F158 PolarHBondContact O-N 3.27Å; Q155-F158 VanDerWaalsContact O-N 3.14Å; G156-F158 VanDerWaalsContact C-N 3.35Å; G156-F158 PolarHBondContact O-N 3.37Å; F158-H161 CarbonylContact O-C 3.54Å; F158-H161 WeakPolarHBondContact O-CB 3.47Å; F158-H161 PolarHBondContact O-N 2.98Å; F158-S162 WeakPolarHBondContact CD1-OG 3.49Å; F158-S162 VanDerWaalsContact CE1-OG 3.24Å; F158-S162 WeakPolarHBondContact CE1-OG 3.34Å; F158-S162 WeakPolarHBondContact O-CB 3.37Å; F158-S162 PolarHBondContact O-N 3.45Å; F158-S162 PolarHBondContact O-OG 3.01Å
159Y94.9Very high95.1Very high11 Ų1133.7 Ų33.74%0.04317%0.173CC..Hα-helixtrans-66.7-37.4173.6-89-100000111.6Q155 G156 H161 S162 I163 H183 T186 I190Q155-Y159 VanDerWaalsContact O-CD2 3.31Å; Q155-Y159 WeakPolarHBondContact O-CD2 3.19Å; Q155-Y159 PolarHBondContact O-N 2.98Å; G156-Y159 PolarHBondContact O-N 2.92Å; Y159-H161 PolarHBondContact O-N 2.83Å; Y159-S162 PolarHBondContact O-N 2.84Å; Y159-S162 VanDerWaalsContact O-N 3.12Å; Y159-I163 PolarHBondContact O-N 3.48Å; Y159-H183 HydrophobicContact CD1-CB 4.47Å; Y159-H183 AromaticContact CD1-ND1 3.61Å; Y159-H183 AromaticContact CE1-ND1 3.63Å; Y159-T186 WeakPolarHBondContact CD1-OG1 3.37Å; Y159-T186 HydrophobicContact CE1-CG2 4.08Å; Y159-T186 WeakPolarHBondContact CE1-OG1 3.43Å; Y159-I190 HydrophobicContact CD2-CD1 4.17Å; Y159-I190 HydrophobicContact CG-CD1 4.35Å
160C96Very high94.8Very high48 Ų4833.9 Ų33.932%0.32417%0.172SC..Hα-helixtrans-57.7-47.4168.2-69.10000111.8A67 G156 S157 S162 I163 Y164A67-C160 HydrophobicContact CB-CB 3.74Å; G156-C160 PolarHBondContact O-N 2.94Å; G156-C160 PolarHBondContact O-SG 2.96Å; G156-C160 VanDerWaalsContact O-SG 3.41Å; S157-C160 WeakPolarHBondContact O-CB 3.31Å; S157-C160 PolarHBondContact O-N 3.49Å; C160-S162 VanDerWaalsContact C-N 3.29Å; C160-S162 PolarHBondContact O-N 3.14Å; C160-I163 PolarHBondContact O-N 3.36Å; C160-Y164 PolarHBondContact O-N 3Å
161H95.8Very high94.3Very high3 Ų336 Ų361%0.01418%0.181CC..Hα-helixtrans-59.3-39.9172.7166.868000112W70 T71 R74 W104 S157 F158 Y159 I163 Y164 A165W70-H161 HydrophobicContact CB-CB 3.92Å; T71-H161 WeakPolarHBondContact CA-ND1 3.46Å; T71-H161 PolarHBondContact OG1-ND1 3.23Å; R74-H161 WeakPolarHBondContact CD-NE2 3.35Å; W104-H161 AromaticContact NE1-NE2 3.61Å; S157-H161 PolarHBondContact O-N 3.18Å; F158-H161 CarbonylContact O-C 3.54Å; F158-H161 WeakPolarHBondContact O-CB 3.47Å; F158-H161 PolarHBondContact O-N 2.98Å; Y159-H161 PolarHBondContact O-N 2.83Å; H161-I163 VanDerWaalsContact C-N 3.35Å; H161-I163 PolarHBondContact O-N 3.49Å; H161-Y164 PolarHBondContact O-N 3Å; H161-A165 VanDerWaalsContact O-CB 3.31Å; H161-A165 WeakPolarHBondContact O-CB 3.33Å; H161-A165 PolarHBondContact O-N 2.97Å
162S94.3Very high93.9Very high7 Ų741.4 Ų41.45%0.04920%0.201CC..Hα-helixtrans-67.7-33.4-176.2-62.30000112.5F158 Y159 C160 A165 T166F158-S162 WeakPolarHBondContact CD1-OG 3.49Å; F158-S162 VanDerWaalsContact CE1-OG 3.24Å; F158-S162 WeakPolarHBondContact CE1-OG 3.34Å; F158-S162 WeakPolarHBondContact O-CB 3.37Å; F158-S162 PolarHBondContact O-N 3.45Å; F158-S162 PolarHBondContact O-OG 3.01Å; Y159-S162 PolarHBondContact O-N 2.84Å; Y159-S162 VanDerWaalsContact O-N 3.12Å; C160-S162 VanDerWaalsContact C-N 3.29Å; C160-S162 PolarHBondContact O-N 3.14Å; S162-A165 PolarHBondContact O-N 3.49Å; S162-T166 VanDerWaalsContact O-CB 3.3Å; S162-T166 WeakPolarHBondContact O-CB 3.48Å; S162-T166 PolarHBondContact O-N 3.48Å; S162-T166 PolarHBondContact O-OG1 2.93Å
163I95.2Very high93.4Very high43 Ų4342.3 Ų42.322%0.22120%0.204CC..Hα-helixtrans-60.8-53.7170-68.5172.5000109.9Y159 C160 H161 A165 T166 V167 L180 H183 V184 L187Y159-I163 PolarHBondContact O-N 3.48Å; C160-I163 PolarHBondContact O-N 3.36Å; H161-I163 VanDerWaalsContact C-N 3.35Å; H161-I163 PolarHBondContact O-N 3.49Å; I163-A165 VanDerWaalsContact C-N 3.32Å; I163-A165 PolarHBondContact O-N 3.42Å; I163-T166 PolarHBondContact O-N 2.82Å; I163-V167 WeakPolarHBondContact O-CG2 3.33Å; I163-V167 PolarHBondContact O-N 3.37Å; I163-V167 VanDerWaalsContact O-N 3.14Å; I163-L180 HydrophobicContact CG2-CD1 3.95Å; I163-H183 HydrophobicContact CD1-CB 4.27Å; I163-H183 HydrophobicContact CG1-CB 3.59Å; I163-V184 HydrophobicContact CD1-CG2 4.26Å; I163-L187 HydrophobicContact CD1-CD2 4Å
164Y95.4Very high92.9Very high112 Ų11244.3 Ų44.344%0.43921%0.211SC..Hα-helixtrans-58.3-45.4177.9173-95.1000111.7T71 C160 H161 V167 Y168 M169T71-Y164 HydrophobicContact CG2-CD1 4.01Å; T71-Y164 HydrophobicContact CG2-CE1 3.69Å; C160-Y164 PolarHBondContact O-N 3Å; H161-Y164 PolarHBondContact O-N 3Å; Y164-V167 PolarHBondContact O-N 3.19Å; Y164-Y168 AromaticContact CD2-CD2 3.48Å; Y164-Y168 HydrophobicContact CD2-CD2 3.48Å; Y164-Y168 VanDerWaalsContact CD2-CD2 3.48Å; Y164-Y168 AromaticContact CD2-CE2 3.97Å; Y164-Y168 HydrophobicContact CD2-CE2 3.97Å; Y164-Y168 HydrophobicContact CD2-CG 4.48Å; Y164-Y168 AromaticContact CE2-CD2 3.51Å; Y164-Y168 HydrophobicContact CE2-CD2 3.51Å; Y164-Y168 HydrophobicContact CE2-CE2 4.1Å; Y164-Y168 HydrophobicContact CE2-CG 4.15Å; Y164-Y168 HydrophobicContact CG-CD2 4.24Å; Y164-Y168 WeakPolarHBondContact O-CD2 3.44Å; Y164-Y168 PolarHBondContact O-N 2.83Å; Y164-M169 HydrophobicContact CD1-CG 4.46Å; Y164-M169 HydrophobicContact CD1-SD 4.04Å; Y164-M169 HydrophobicContact CE1-CG 4.03Å; Y164-M169 HydrophobicContact CE1-SD 3.76Å
165A93.4Very high92.5Very high1 Ų141.7 Ų41.71%0.00820%0.197CC..Hα-helixtrans-61.3-45.3178.200000112.3H161 S162 I163 V167 Y168 M169 D170H161-A165 VanDerWaalsContact O-CB 3.31Å; H161-A165 WeakPolarHBondContact O-CB 3.33Å; H161-A165 PolarHBondContact O-N 2.97Å; S162-A165 PolarHBondContact O-N 3.49Å; I163-A165 VanDerWaalsContact C-N 3.32Å; I163-A165 PolarHBondContact O-N 3.42Å; A165-V167 VanDerWaalsContact C-N 3.27Å; A165-V167 PolarHBondContact O-N 2.93Å; A165-Y168 PolarHBondContact O-N 2.53Å; A165-M169 HydrophobicContact CB-CB 4.33Å; A165-M169 HydrophobicContact CB-SD 4.27Å; A165-M169 CarbonylContact O-C 3.56Å; A165-M169 WeakPolarHBondContact O-CA 3.35Å; A165-M169 WeakPolarHBondContact O-CB 3.31Å; A165-M169 PolarHBondContact O-N 3.05Å; A165-D170 PolarHBondContact O-N 3.45Å
166T92.2Very high92.2Very high9 Ų942.1 Ų42.16%0.05520%0.2CC..Hα-helixtrans-60.8-38.3179.2-59.80000111.6S162 I163 W172S162-T166 VanDerWaalsContact O-CB 3.3Å; S162-T166 WeakPolarHBondContact O-CB 3.48Å; S162-T166 PolarHBondContact O-N 3.48Å; S162-T166 PolarHBondContact O-OG1 2.93Å; I163-T166 PolarHBondContact O-N 2.82Å; T166-W172 PolarHBondContact O-NE1 3.34Å; T166-W172 VanDerWaalsContact O-NE1 3.12Å
167V92.9Very high92.1Very high51 Ų5146 Ų4631%0.30922%0.222SC..Hα-helixtrans-76.6-43.2-178.61780000112I163 Y164 A165 L180I163-V167 WeakPolarHBondContact O-CG2 3.33Å; I163-V167 PolarHBondContact O-N 3.37Å; I163-V167 VanDerWaalsContact O-N 3.14Å; Y164-V167 PolarHBondContact O-N 3.19Å; A165-V167 VanDerWaalsContact C-N 3.27Å; A165-V167 PolarHBondContact O-N 2.93Å; V167-L180 HydrophobicContact CG2-CD1 4.15Å; V167-L180 HydrophobicContact CG2-CD2 4.5Å
168Y91.8Very high92Very high168 Ų16848 Ų4866%0.65923%0.234SC*.Hα-helixtrans-117.4-21-165.7-61.3-72.2000115.9Y164 A165Y164-Y168 AromaticContact CD2-CD2 3.48Å; Y164-Y168 HydrophobicContact CD2-CD2 3.48Å; Y164-Y168 VanDerWaalsContact CD2-CD2 3.48Å; Y164-Y168 AromaticContact CD2-CE2 3.97Å; Y164-Y168 HydrophobicContact CD2-CE2 3.97Å; Y164-Y168 HydrophobicContact CD2-CG 4.48Å; Y164-Y168 AromaticContact CE2-CD2 3.51Å; Y164-Y168 HydrophobicContact CE2-CD2 3.51Å; Y164-Y168 HydrophobicContact CE2-CE2 4.1Å; Y164-Y168 HydrophobicContact CE2-CG 4.15Å; Y164-Y168 HydrophobicContact CG-CD2 4.24Å; Y164-Y168 WeakPolarHBondContact O-CD2 3.44Å; Y164-Y168 PolarHBondContact O-N 2.83Å; A165-Y168 PolarHBondContact O-N 2.53Å
169M89.3Confident91.8Very high71 Ų7150.1 Ų50.135%0.3524%0.244SC..THydrogen-bonded Turntrans-113.3-37.9-172.2-58.9-179.366.300113.5T71 R74 Y164 A165T71-M169 HydrophobicContact CG2-SD 4.25Å; R74-M169 HydrophobicContact CG-CE 4.24Å; Y164-M169 HydrophobicContact CD1-CG 4.46Å; Y164-M169 HydrophobicContact CD1-SD 4.04Å; Y164-M169 HydrophobicContact CE1-CG 4.03Å; Y164-M169 HydrophobicContact CE1-SD 3.76Å; A165-M169 HydrophobicContact CB-CB 4.33Å; A165-M169 HydrophobicContact CB-SD 4.27Å; A165-M169 CarbonylContact O-C 3.56Å; A165-M169 WeakPolarHBondContact O-CA 3.35Å; A165-M169 WeakPolarHBondContact O-CB 3.31Å; A165-M169 PolarHBondContact O-N 3.05Å
170D88.9Confident91.8Very high18 Ų1851.8 Ų51.810%0.09625%0.254CS..SBendtrans-87.4149.5-173.6-69.37.8000110.6R74 K105 A165 W172R74-D170 IonicContact CZ-OD1 2.81Å; R74-D170 VanDerWaalsContact CZ-OD1 3.24Å; R74-D170 IonicContact NH1-OD1 3.67Å; R74-D170 PolarHBondContact NH1-OD1 2.89Å; R74-D170 IonicContact NH2-OD1 2.83Å; R74-D170 PolarHBondContact NH2-OD1 2.88Å; K105-D170 WeakPolarHBondContact CE-OD2 3.35Å; K105-D170 IonicContact NZ-OD2 2.79Å; K105-D170 PolarHBondContact NZ-OD2 3.08Å; A165-D170 PolarHBondContact O-N 3.45Å; D170-W172 PolarHBondContact O-N 3.38Å
171T86.4Confident91.8Very high81 Ų8152.9 Ų52.950%0.49726%0.259SS..PPolyproline II helixtrans-71.5128.217454.10000110.2R173T171-R173 PolarHBondContact OG1-NH2 3.49Å
172W86.7Confident91.9Very high115 Ų11553.2 Ų53.244%0.43626%0.261SS..PPolyproline II helixtrans-68.2140.3176.5-79.958.8000111.8T166 D170 S176 V177 Y323T166-W172 PolarHBondContact O-NE1 3.34Å; T166-W172 VanDerWaalsContact O-NE1 3.12Å; D170-W172 PolarHBondContact O-N 3.38Å; W172-S176 WeakPolarHBondContact CA-OG 3.43Å; W172-V177 HydrophobicContact CZ3-CG2 3.92Å; W172-Y323 WeakPolarHBondContact O-CD2 3.4Å; W172-Y323 WeakPolarHBondContact O-CE2 3.4Å
173R87.2Confident92Very high28 Ų2853.3 Ų53.311%0.10626%0.26CS..  trans-129.6171-178.8-63.3-179.9-169.6116.610.8109.1E101 T171 D175 S176 R321 Y323E101-R173 IonicContact OE1-CZ 2.73Å; E101-R173 IonicContact OE1-NH1 3.12Å; E101-R173 PolarHBondContact OE1-NH1 2.93Å; E101-R173 VanDerWaalsContact OE1-NH1 3.16Å; E101-R173 IonicContact OE1-NH2 3.25Å; E101-R173 PolarHBondContact OE1-NH2 3.37Å; E101-R173 IonicContact OE2-NH2 2.67Å; E101-R173 PolarHBondContact OE2-NH2 3.43Å; T171-R173 PolarHBondContact OG1-NH2 3.49Å; R173-D175 WeakPolarHBondContact CB-OD1 3.49Å; R173-D175 PolarHBondContact O-N 3.1Å; R173-D175 VanDerWaalsContact O-N 3.14Å; R173-S176 PolarHBondContact N-OG 3.48Å; R173-S176 WeakPolarHBondContact O-CB 3.17Å; R173-S176 PolarHBondContact O-N 2.9Å; R173-S176 PolarHBondContact O-OG 2.88Å; R173-R321 WeakPolarHBondContact CB-O 3.49Å; R173-Y323 VanDerWaalsContact CA-CE2 3.47Å; R173-Y323 PolarHBondContact O-OH 3.15Å
174K86.9Confident92Very high92 Ų9254.7 Ų54.740%0.427%0.271SS..THydrogen-bonded Turntrans-58-27.1-179.1-68.4174.2179163.70112.6R321 E322 Y323 D324K174-R321 WeakPolarHBondContact CB-O 3.11Å; K174-R321 WeakPolarHBondContact CG-O 3.42Å; K174-R321 PolarHBondContact N-O 3.27Å; K174-E322 WeakPolarHBondContact CE-O 3.36Å; K174-E322 PolarHBondContact NZ-O 2.8Å; K174-Y323 HydrophobicContact CG-CD1 3.94Å; K174-Y323 HydrophobicContact CG-CE1 3.85Å; K174-Y323 HydrophobicContact CG-CG 4.49Å; K174-D324 IonicContact NZ-OD2 2.84Å; K174-D324 PolarHBondContact NZ-OD2 3.33Å
175D88.9Confident92.1Very high6 Ų650.1 Ų50.13%0.03225%0.254CS..THydrogen-bonded Turntrans-99.14.417969.5-37.2000114.5R173 V177 V178 M179 R321R173-D175 WeakPolarHBondContact CB-OD1 3.49Å; R173-D175 PolarHBondContact O-N 3.1Å; R173-D175 VanDerWaalsContact O-N 3.14Å; D175-V177 VanDerWaalsContact C-N 3.28Å; D175-V177 PolarHBondContact O-N 2.84Å; D175-V178 PolarHBondContact O-N 3.45Å; D175-M179 PolarHBondContact O-N 3.31Å; D175-R321 VanDerWaalsContact OD2-CD 3.28Å; D175-R321 WeakPolarHBondContact OD2-CD 3.34Å; D175-R321 IonicContact OD2-CZ 2.64Å; D175-R321 IonicContact OD2-NE 3.7Å; D175-R321 IonicContact OD2-NH1 3.07Å; D175-R321 PolarHBondContact OD2-NH1 2.94Å
176S90.4Very high92.3Very high9 Ų950.6 Ų50.66%0.06326%0.257CS..Hα-helixtrans-57.9-36.7-175.2-77.20000114W172 R173 M179 L180W172-S176 WeakPolarHBondContact CA-OG 3.43Å; R173-S176 PolarHBondContact N-OG 3.48Å; R173-S176 WeakPolarHBondContact O-CB 3.17Å; R173-S176 PolarHBondContact O-N 2.9Å; R173-S176 PolarHBondContact O-OG 2.88Å; S176-M179 PolarHBondContact O-N 3.45Å; S176-L180 PolarHBondContact O-N 3.02Å
177V93.3Very high92.5Very high91 Ų9152.3 Ų52.355%0.55227%0.266SS*.Hα-helixtrans-65.9-44.9176.2178.50000110.6W172 D175 M179 L180 V181W172-V177 HydrophobicContact CZ3-CG2 3.92Å; D175-V177 VanDerWaalsContact C-N 3.28Å; D175-V177 PolarHBondContact O-N 2.84Å; V177-M179 VanDerWaalsContact C-N 3.31Å; V177-M179 PolarHBondContact O-N 2.88Å; V177-L180 PolarHBondContact O-N 3.13Å; V177-V181 WeakPolarHBondContact O-CG2 3.29Å; V177-V181 PolarHBondContact O-N 3.15Å
178V94.6Very high92.7Very high41 Ų4152.5 Ų52.525%0.24827%0.267CS..Hα-helixtrans-63.9-40.1177.9-176.70000110.5D175 L180 V181 H182 Y297 W298D175-V178 PolarHBondContact O-N 3.45Å; V178-L180 PolarHBondContact O-N 3.08Å; V178-V181 PolarHBondContact O-N 3.39Å; V178-H182 VanDerWaalsContact O-CB 3.3Å; V178-H182 WeakPolarHBondContact O-CB 3.3Å; V178-H182 PolarHBondContact O-N 3.42Å; V178-Y297 HydrophobicContact CB-CE1 4.47Å; V178-Y297 HydrophobicContact CG1-CD1 4.27Å; V178-Y297 HydrophobicContact CG1-CE1 4.13Å; V178-Y297 HydrophobicContact CG2-CE1 4.28Å; V178-W298 HydrophobicContact CG1-CH2 4.47Å; V178-W298 HydrophobicContact CG1-CZ2 3.77Å
179M93.9Very high92.9Very high47 Ų4745.1 Ų45.123%0.23224%0.239CC..Hα-helixtrans-61.4-40.2173.4-74.9-59.8-53.500112.7D175 S176 V177 H182 H183 W298D175-M179 PolarHBondContact O-N 3.31Å; S176-M179 PolarHBondContact O-N 3.45Å; V177-M179 VanDerWaalsContact C-N 3.31Å; V177-M179 PolarHBondContact O-N 2.88Å; M179-H182 WeakPolarHBondContact O-CB 3.47Å; M179-H182 PolarHBondContact O-N 2.96Å; M179-H183 PolarHBondContact O-CD2 3.47Å; M179-H183 VanDerWaalsContact O-CD2 3.26Å; M179-H183 VanDerWaalsContact O-CG 3.31Å; M179-H183 PolarHBondContact O-N 3.35Å; M179-W298 HydrophobicContact CG-CZ2 4.35Å; M179-W298 HydrophobicContact SD-CH2 4.11Å; M179-W298 HydrophobicContact SD-CZ2 3.45Å; M179-W298 WeakPolarHBondContact SD-CZ2 3.46Å
180L95.1Very high93.3Very high46 Ų4642.3 Ų42.324%0.24123%0.225CC..Hα-helixtrans-66-46.2176-176.465.2000111.6I163 V167 S176 V177 V178 H182 H183 V184I163-L180 HydrophobicContact CG2-CD1 3.95Å; V167-L180 HydrophobicContact CG2-CD1 4.15Å; V167-L180 HydrophobicContact CG2-CD2 4.5Å; S176-L180 PolarHBondContact O-N 3.02Å; V177-L180 PolarHBondContact O-N 3.13Å; V178-L180 PolarHBondContact O-N 3.08Å; L180-H182 VanDerWaalsContact C-N 3.27Å; L180-H182 PolarHBondContact O-N 3.19Å; L180-H183 PolarHBondContact O-N 3.44Å; L180-V184 WeakPolarHBondContact O-CG2 3.5Å; L180-V184 PolarHBondContact O-N 2.82Å
181V96.1Very high93.6Very high72 Ų7243.5 Ų43.544%0.43624%0.237SC..Hα-helixtrans-59.4-42.7175.2176.90000110.1V177 V178 V184 V185 M294V177-V181 WeakPolarHBondContact O-CG2 3.29Å; V177-V181 PolarHBondContact O-N 3.15Å; V178-V181 PolarHBondContact O-N 3.39Å; V181-V184 PolarHBondContact O-N 3.25Å; V181-V185 HydrophobicContact CG1-CG2 4.33Å; V181-V185 WeakPolarHBondContact O-CG2 3.48Å; V181-V185 PolarHBondContact O-N 3.3Å; V181-M294 HydrophobicContact CB-CE 4.31Å; V181-M294 HydrophobicContact CG1-CE 3.58Å
182H96.3Very high94Very high10 Ų1040.1 Ų40.15%0.04622%0.217CC..Hα-helixtrans-57.7-49.2174.2167.480.6000112.2V178 M179 L180 V184 V185 T186 M294 W298V178-H182 VanDerWaalsContact O-CB 3.3Å; V178-H182 WeakPolarHBondContact O-CB 3.3Å; V178-H182 PolarHBondContact O-N 3.42Å; M179-H182 WeakPolarHBondContact O-CB 3.47Å; M179-H182 PolarHBondContact O-N 2.96Å; L180-H182 VanDerWaalsContact C-N 3.27Å; L180-H182 PolarHBondContact O-N 3.19Å; H182-V184 VanDerWaalsContact C-N 3.26Å; H182-V184 PolarHBondContact O-N 2.92Å; H182-V185 PolarHBondContact O-N 3.32Å; H182-V185 VanDerWaalsContact O-N 3.15Å; H182-T186 WeakPolarHBondContact CE1-CG2 3.25Å; H182-T186 WeakPolarHBondContact O-CG2 3.28Å; H182-T186 PolarHBondContact O-N 3.45Å; H182-T186 PolarHBondContact O-OG1 3.05Å; H182-M294 HydrophobicContact CB-SD 3.82Å; H182-W298 HydrophobicContact CB-CH2 3.65Å; H182-W298 HydrophobicContact CB-CZ2 4.35Å; H182-W298 AromaticContact CG-CH2 3.61Å; H182-W298 AromaticContact ND1-CH2 3.72Å; H182-W298 AromaticContact ND1-CZ3 3.96Å
183H96.3Very high94.4Very high8 Ų834.8 Ų34.84%0.03720%0.197CC..Hα-helixtrans-60.2-35.6178.1-68.8-36.9000113Y159 I163 M179 L180 T186 L187Y159-H183 HydrophobicContact CD1-CB 4.47Å; Y159-H183 AromaticContact CD1-ND1 3.61Å; Y159-H183 AromaticContact CE1-ND1 3.63Å; I163-H183 HydrophobicContact CD1-CB 4.27Å; I163-H183 HydrophobicContact CG1-CB 3.59Å; M179-H183 PolarHBondContact O-CD2 3.47Å; M179-H183 VanDerWaalsContact O-CD2 3.26Å; M179-H183 VanDerWaalsContact O-CG 3.31Å; M179-H183 PolarHBondContact O-N 3.35Å; L180-H183 PolarHBondContact O-N 3.44Å; H183-T186 WeakPolarHBondContact CA-OG1 3.45Å; H183-T186 PolarHBondContact O-OG1 3.31Å; H183-L187 WeakPolarHBondContact O-CB 3.27Å; H183-L187 PolarHBondContact O-N 3.45Å
184V96.4Very high94.8Very high73 Ų7334.7 Ų34.744%0.44220%0.197SC..Hα-helixtrans-67.4-49.1173.6174.30000110.7I163 L180 V181 H182 T186 L187 V188I163-V184 HydrophobicContact CD1-CG2 4.26Å; L180-V184 WeakPolarHBondContact O-CG2 3.5Å; L180-V184 PolarHBondContact O-N 2.82Å; V181-V184 PolarHBondContact O-N 3.25Å; H182-V184 VanDerWaalsContact C-N 3.26Å; H182-V184 PolarHBondContact O-N 2.92Å; V184-T186 PolarHBondContact O-N 3.08Å; V184-L187 PolarHBondContact O-N 3.21Å; V184-V188 VanDerWaalsContact O-CG2 3.29Å; V184-V188 WeakPolarHBondContact O-CG2 3.46Å; V184-V188 PolarHBondContact O-N 3.41Å
185V97.4Very high95.1Very high16 Ų1630.7 Ų30.710%0.09718%0.181CC..Hα-helixtrans-59.8-45.5179.2168.40000111.3V181 H182 V188 L189 L287 I290 M294V181-V185 HydrophobicContact CG1-CG2 4.33Å; V181-V185 WeakPolarHBondContact O-CG2 3.48Å; V181-V185 PolarHBondContact O-N 3.3Å; H182-V185 PolarHBondContact O-N 3.32Å; H182-V185 VanDerWaalsContact O-N 3.15Å; V185-V188 PolarHBondContact O-N 3.48Å; V185-L189 HydrophobicContact CG1-CD1 4.14Å; V185-L189 WeakPolarHBondContact O-CG 2.97Å; V185-L189 PolarHBondContact O-N 2.89Å; V185-L287 HydrophobicContact CG1-CD2 4.3Å; V185-I290 HydrophobicContact CG1-CG2 4.25Å; V185-I290 HydrophobicContact CG2-CG2 4.16Å; V185-M294 HydrophobicContact CG2-CE 4.22Å
186T96.9Very high95.3Very high11 Ų1130.7 Ų30.77%0.06718%0.181CC..Hα-helixtrans-68.1-39.4178.455.60000111.9Y159 H182 H183 V184 V188 L189 I190 L291Y159-T186 WeakPolarHBondContact CD1-OG1 3.37Å; Y159-T186 HydrophobicContact CE1-CG2 4.08Å; Y159-T186 WeakPolarHBondContact CE1-OG1 3.43Å; H182-T186 WeakPolarHBondContact CE1-CG2 3.25Å; H182-T186 WeakPolarHBondContact O-CG2 3.28Å; H182-T186 PolarHBondContact O-N 3.45Å; H182-T186 PolarHBondContact O-OG1 3.05Å; H183-T186 WeakPolarHBondContact CA-OG1 3.45Å; H183-T186 PolarHBondContact O-OG1 3.31Å; V184-T186 PolarHBondContact O-N 3.08Å; T186-V188 VanDerWaalsContact C-N 3.3Å; T186-V188 PolarHBondContact O-N 2.83Å; T186-L189 WeakPolarHBondContact O-CB 3.4Å; T186-L189 PolarHBondContact O-N 3.47Å; T186-I190 WeakPolarHBondContact O-CG1 3.45Å; T186-I190 PolarHBondContact O-N 3.07Å; T186-L291 HydrophobicContact CG2-CD1 4.08Å
187L96.4Very high95.5Very high45 Ų4531.6 Ų31.624%0.23618%0.183CC..Hα-helixtrans-62.9-39.5175.7-174.264.3000111.5I163 H183 V184 I190 A191I163-L187 HydrophobicContact CD1-CD2 4Å; H183-L187 WeakPolarHBondContact O-CB 3.27Å; H183-L187 PolarHBondContact O-N 3.45Å; V184-L187 PolarHBondContact O-N 3.21Å; L187-I190 PolarHBondContact O-N 3.23Å; L187-A191 WeakPolarHBondContact O-CB 3.25Å; L187-A191 PolarHBondContact O-N 3.5Å
188V96.6Very high95.6Very high55 Ų5527.5 Ų27.533%0.33316%0.158SC..Hα-helixtrans-65.6-41.3173.4175.80000111V184 V185 T186 A191 S192 F283 L287V184-V188 VanDerWaalsContact O-CG2 3.29Å; V184-V188 WeakPolarHBondContact O-CG2 3.46Å; V184-V188 PolarHBondContact O-N 3.41Å; V185-V188 PolarHBondContact O-N 3.48Å; T186-V188 VanDerWaalsContact C-N 3.3Å; T186-V188 PolarHBondContact O-N 2.83Å; V188-A191 PolarHBondContact O-N 2.83Å; V188-S192 VanDerWaalsContact O-CB 3.25Å; V188-S192 WeakPolarHBondContact O-CB 3.19Å; V188-S192 PolarHBondContact O-N 2.82Å; V188-S192 PolarHBondContact O-OG 3.18Å; V188-F283 HydrophobicContact CG1-CE1 4.44Å; V188-F283 HydrophobicContact CG1-CZ 3.72Å; V188-L287 HydrophobicContact CB-CD1 4.47Å; V188-L287 HydrophobicContact CG1-CD1 3.65Å
189L97.6Very high95.6Very high12 Ų1225.7 Ų25.76%0.06315%0.146CC..Hα-helixtrans-59.5-46.5173.7-82.8166.2000111.7V185 T186 S192 S193 F284 L287 L288 L291V185-L189 HydrophobicContact CG1-CD1 4.14Å; V185-L189 WeakPolarHBondContact O-CG 2.97Å; V185-L189 PolarHBondContact O-N 2.89Å; T186-L189 WeakPolarHBondContact O-CB 3.4Å; T186-L189 PolarHBondContact O-N 3.47Å; L189-S192 PolarHBondContact O-OG 2.9Å; L189-S193 VanDerWaalsContact O-CB 3.25Å; L189-S193 WeakPolarHBondContact O-CB 3.49Å; L189-S193 PolarHBondContact O-N 3.14Å; L189-S193 PolarHBondContact O-OG 2.98Å; L189-F284 HydrophobicContact CD2-CD2 3.96Å; L189-F284 HydrophobicContact CD2-CE2 3.63Å; L189-F284 HydrophobicContact CD2-CZ 4.17Å; L189-L287 HydrophobicContact CD1-CB 4.24Å; L189-L287 HydrophobicContact CD2-CB 3.49Å; L189-L287 VanDerWaalsContact CD2-CB 3.49Å; L189-L287 HydrophobicContact CD2-CD1 4.16Å; L189-L287 HydrophobicContact CG-CB 3.74Å; L189-L287 HydrophobicContact CG-CD1 4.25Å; L189-L288 HydrophobicContact CD1-CD2 4.23Å; L189-L288 HydrophobicContact CD2-CD2 3.85Å; L189-L288 HydrophobicContact CD2-CG 3.98Å; L189-L291 HydrophobicContact CD1-CB 4.43Å; L189-L291 HydrophobicContact CD1-CD2 4.04Å
190I96.9Very high95.7Very high13 Ų1324.7 Ų24.77%0.06714%0.142CC..Hα-helixtrans-62.4-49.2178.6-66.8169.4000110.6Y152 Q155 Y159 T186 L187 S193 Y194 F206Y152-I190 HydrophobicContact CD1-CG2 3.75Å; Y152-I190 HydrophobicContact CE1-CG2 4.1Å; Y152-I190 WeakPolarHBondContact CE1-O 3.31Å; Q155-I190 HydrophobicContact CB-CD1 4.36Å; Y159-I190 HydrophobicContact CD2-CD1 4.17Å; Y159-I190 HydrophobicContact CG-CD1 4.35Å; T186-I190 WeakPolarHBondContact O-CG1 3.45Å; T186-I190 PolarHBondContact O-N 3.07Å; L187-I190 PolarHBondContact O-N 3.23Å; I190-S193 PolarHBondContact O-OG 2.68Å; I190-Y194 WeakPolarHBondContact O-CB 3.31Å; I190-Y194 PolarHBondContact O-N 2.87Å; I190-F206 HydrophobicContact CD1-CE1 3.77Å; I190-F206 HydrophobicContact CD1-CZ 4.12Å; I190-F206 HydrophobicContact CG1-CE1 3.61Å; I190-F206 HydrophobicContact CG1-CZ 3.76Å; I190-F206 HydrophobicContact CG2-CZ 4.34Å
191A95.1Very high95.8Very high43 Ų4322.6 Ų22.636%0.35513%0.131SC..Hα-helixtrans-64.4-45.9-178.700000111.5L187 V188 Y194 A195L187-A191 WeakPolarHBondContact O-CB 3.25Å; L187-A191 PolarHBondContact O-N 3.5Å; V188-A191 PolarHBondContact O-N 2.83Å; A191-Y194 PolarHBondContact O-N 3.43Å; A191-A195 VanDerWaalsContact O-CB 3.23Å; A191-A195 WeakPolarHBondContact O-CB 3.48Å; A191-A195 PolarHBondContact O-N 3.38Å
192S94.6Very high95.8Very high10 Ų1019.4 Ų19.47%0.0711%0.112CC..Hα-helixtrans-70.7-39.7-179.759.80000112.9V188 L189 Y194 A195 F196V188-S192 VanDerWaalsContact O-CB 3.25Å; V188-S192 WeakPolarHBondContact O-CB 3.19Å; V188-S192 PolarHBondContact O-N 2.82Å; V188-S192 PolarHBondContact O-OG 3.18Å; L189-S192 PolarHBondContact O-OG 2.9Å; S192-Y194 VanDerWaalsContact C-N 3.3Å; S192-Y194 PolarHBondContact O-N 2.91Å; S192-A195 PolarHBondContact O-N 3.41Å; S192-F196 WeakPolarHBondContact O-CB 3.48Å; S192-F196 WeakPolarHBondContact O-CD2 3.47Å; S192-F196 WeakPolarHBondContact O-CG 3.09Å; S192-F196 PolarHBondContact O-N 2.84Å
193S96.2Very high95.8Very high3 Ų318.9 Ų18.92%0.02111%0.11CC..Hα-helixtrans-66-34.8175.367.20000111.8Y152 L189 I190 R197 Y198Y152-S193 WeakPolarHBondContact CE1-OG 3.3Å; Y152-S193 PolarHBondContact OH-OG 3.14Å; L189-S193 VanDerWaalsContact O-CB 3.25Å; L189-S193 WeakPolarHBondContact O-CB 3.49Å; L189-S193 PolarHBondContact O-N 3.14Å; L189-S193 PolarHBondContact O-OG 2.98Å; I190-S193 PolarHBondContact O-OG 2.68Å; S193-R197 CarbonylContact O-C 3.41Å; S193-R197 PolarHBondContact O-N 3.16Å; S193-Y198 CarbonylContact O-C 3.55Å; S193-Y198 WeakPolarHBondContact O-CA 3.5Å; S193-Y198 PolarHBondContact O-N 3.44Å
194Y95.2Very high95.9Very high26 Ų2618.6 Ų18.610%0.10211%0.109CC..Hα-helixtrans-70-45.2173.8-166.1-91.6000112.1L55 E59 V144 A149 Y152 I190 A191 S192 R197L55-Y194 HydrophobicContact CD1-CD1 3.46Å; L55-Y194 VanDerWaalsContact CD1-CD1 3.46Å; L55-Y194 HydrophobicContact CD1-CE1 4.05Å; L55-Y194 HydrophobicContact CD1-CG 4.47Å; E59-Y194 PolarHBondContact OE1-OH 3Å; E59-Y194 VanDerWaalsContact OE1-OH 3.11Å; V144-Y194 HydrophobicContact CB-CE2 4.1Å; V144-Y194 HydrophobicContact CG1-CE2 3.86Å; V144-Y194 HydrophobicContact CG2-CD2 4.43Å; V144-Y194 HydrophobicContact CG2-CE2 3.96Å; A149-Y194 HydrophobicContact CB-CE2 4.18Å; Y152-Y194 AromaticContact CD1-CD2 3.6Å; Y152-Y194 HydrophobicContact CD1-CD2 3.6Å; Y152-Y194 HydrophobicContact CD1-CG 4.11Å; Y152-Y194 HydrophobicContact CD2-CD2 4.35Å; Y152-Y194 HydrophobicContact CE1-CD2 4.22Å; Y152-Y194 AromaticContact CG-CD2 3.67Å; Y152-Y194 HydrophobicContact CG-CD2 3.67Å; Y152-Y194 HydrophobicContact CG-CE2 4.35Å; I190-Y194 WeakPolarHBondContact O-CB 3.31Å; I190-Y194 PolarHBondContact O-N 2.87Å; A191-Y194 PolarHBondContact O-N 3.43Å; S192-Y194 VanDerWaalsContact C-N 3.3Å; S192-Y194 PolarHBondContact O-N 2.91Å; Y194-R197 WeakPolarHBondContact O-CD 3.29Å; Y194-R197 PolarHBondContact O-N 2.95Å; Y194-R197 PolarHBondContact O-NH1 3.39Å
195A93.2Very high95.9Very high7 Ų716 Ų166%0.0589%0.093CC..Hα-helixtrans-63.7-45.4-178.300000112.2A53 H54 A191 S192 R197A53-A195 HydrophobicContact CB-CB 4.18Å; H54-A195 PolarHBondContact N-O 3.07Å; A191-A195 VanDerWaalsContact O-CB 3.23Å; A191-A195 WeakPolarHBondContact O-CB 3.48Å; A191-A195 PolarHBondContact O-N 3.38Å; S192-A195 PolarHBondContact O-N 3.41Å; A195-R197 VanDerWaalsContact C-N 3.28Å; A195-R197 PolarHBondContact O-N 3.29Å
196F93.4Very high95.9Very high7 Ų715.8 Ų15.83%0.0319%0.091CC..THydrogen-bonded Turntrans-86.55.7179.3-52.1-38.3000113.7L49 H52 A53 W138 S192 Y198 Y280 F283L49-F196 HydrophobicContact CD1-CE1 4.02Å; L49-F196 HydrophobicContact CD1-CZ 4Å; H52-F196 HydrophobicContact CB-CD1 4.24Å; A53-F196 HydrophobicContact CB-CE1 4.11Å; W138-F196 WeakPolarHBondContact CZ2-O 3.38Å; W138-F196 PolarHBondContact NE1-O 3.22Å; S192-F196 WeakPolarHBondContact O-CB 3.48Å; S192-F196 WeakPolarHBondContact O-CD2 3.47Å; S192-F196 WeakPolarHBondContact O-CG 3.09Å; S192-F196 PolarHBondContact O-N 2.84Å; F196-Y198 VanDerWaalsContact C-N 3.32Å; F196-Y198 HydrophobicContact CB-CD2 4.1Å; F196-Y198 HydrophobicContact CB-CE1 4.3Å; F196-Y198 HydrophobicContact CB-CE2 3.77Å; F196-Y198 HydrophobicContact CB-CG 4.47Å; F196-Y198 HydrophobicContact CD2-CE2 4.19Å; F196-Y198 HydrophobicContact CG-CE2 4.43Å; F196-Y198 WeakPolarHBondContact O-CE1 3.41Å; F196-Y198 PolarHBondContact O-N 2.92Å; F196-Y280 AromaticContact CD1-CD2 3.91Å; F196-Y280 HydrophobicContact CD1-CD2 3.91Å; F196-Y280 HydrophobicContact CD1-CE2 4.28Å; F196-Y280 HydrophobicContact CD2-CD2 4.14Å; F196-Y280 HydrophobicContact CD2-CG 4.28Å; F196-Y280 AromaticContact CE1-CD2 3.36Å; F196-Y280 HydrophobicContact CE1-CD2 3.36Å; F196-Y280 AromaticContact CE1-CE2 3.45Å; F196-Y280 HydrophobicContact CE1-CE2 3.45Å; F196-Y280 VanDerWaalsContact CE1-CE2 3.45Å; F196-Y280 HydrophobicContact CE1-CG 4.17Å; F196-Y280 HydrophobicContact CE2-CD1 4.29Å; F196-Y280 AromaticContact CE2-CD2 3.62Å; F196-Y280 HydrophobicContact CE2-CD2 3.62Å; F196-Y280 HydrophobicContact CE2-CE2 4.35Å; F196-Y280 AromaticContact CE2-CG 3.58Å; F196-Y280 HydrophobicContact CE2-CG 3.58Å; F196-Y280 HydrophobicContact CG-CD2 4.28Å; F196-Y280 HydrophobicContact CZ-CD1 4.08Å; F196-Y280 AromaticContact CZ-CD2 3.2Å; F196-Y280 HydrophobicContact CZ-CD2 3.2Å; F196-Y280 HydrophobicContact CZ-CE1 4.3Å; F196-Y280 AromaticContact CZ-CE2 3.5Å; F196-Y280 HydrophobicContact CZ-CE2 3.5Å; F196-Y280 VanDerWaalsContact CZ-CE2 3.5Å; F196-Y280 AromaticContact CZ-CG 3.52Å; F196-Y280 HydrophobicContact CZ-CG 3.52Å; F196-F283 HydrophobicContact CE2-CD1 4.35Å; F196-F283 HydrophobicContact CE2-CE1 4.43Å
197R94.6Very high96Very high27 Ų2715.6 Ų15.610%0.1029%0.089CC..THydrogen-bonded Turntrans62.430179.8-49.7-58.2-174.7-153.57.7114.7H54 M142 S193 Y194 A195 H199H54-R197 VanDerWaalsContact CB-NH2 3.28Å; H54-R197 PolarHBondContact O-NH1 3.11Å; H54-R197 PolarHBondContact O-NH2 3.3Å; M142-R197 HydrophobicContact CG-CB 3.77Å; M142-R197 HydrophobicContact CG-CG 3.95Å; M142-R197 WeakPolarHBondContact O-CD 3.35Å; M142-R197 PolarHBondContact O-NE 3.12Å; M142-R197 HydrophobicContact SD-CB 4.35Å; S193-R197 CarbonylContact O-C 3.41Å; S193-R197 PolarHBondContact O-N 3.16Å; Y194-R197 WeakPolarHBondContact O-CD 3.29Å; Y194-R197 PolarHBondContact O-N 2.95Å; Y194-R197 PolarHBondContact O-NH1 3.39Å; A195-R197 VanDerWaalsContact C-N 3.28Å; A195-R197 PolarHBondContact O-N 3.29Å; R197-H199 PolarHBondContact O-N 3.16Å; R197-H199 VanDerWaalsContact O-N 3.16Å; R197-H199 PolarHBondContact O-ND1 3.49Å
198Y95.4Very high96Very high6 Ų613.4 Ų13.42%0.0248%0.078CC..  trans-83.434.5165.5-51.5-27.5000112.5F135 W138 S193 F196 N200 V201 G202 I278 P279 F284F135-Y198 HydrophobicContact CD1-CD1 4.39Å; F135-Y198 AromaticContact CE1-CD1 3.65Å; F135-Y198 HydrophobicContact CE1-CD1 3.65Å; F135-Y198 AromaticContact CE1-CE1 3.96Å; F135-Y198 HydrophobicContact CE1-CE1 3.96Å; F135-Y198 HydrophobicContact CE1-CG 4.19Å; W138-Y198 AromaticContact CE2-CE1 3.68Å; W138-Y198 AromaticContact CZ2-CE1 3.97Å; W138-Y198 HydrophobicContact CZ2-CE1 3.97Å; W138-Y198 AromaticContact NE1-CD1 3.54Å; W138-Y198 AromaticContact NE1-CE1 3.35Å; W138-Y198 VanDerWaalsContact NE1-CE1 3.35Å; S193-Y198 CarbonylContact O-C 3.55Å; S193-Y198 WeakPolarHBondContact O-CA 3.5Å; S193-Y198 PolarHBondContact O-N 3.44Å; F196-Y198 VanDerWaalsContact C-N 3.32Å; F196-Y198 HydrophobicContact CB-CD2 4.1Å; F196-Y198 HydrophobicContact CB-CE1 4.3Å; F196-Y198 HydrophobicContact CB-CE2 3.77Å; F196-Y198 HydrophobicContact CB-CG 4.47Å; F196-Y198 HydrophobicContact CD2-CE2 4.19Å; F196-Y198 HydrophobicContact CG-CE2 4.43Å; F196-Y198 WeakPolarHBondContact O-CE1 3.41Å; F196-Y198 PolarHBondContact O-N 2.92Å; Y198-N200 VanDerWaalsContact C-N 3.29Å; Y198-N200 PolarHBondContact O-N 3.41Å; Y198-V201 WeakPolarHBondContact O-CB 3.31Å; Y198-V201 PolarHBondContact O-N 3.36Å; Y198-V201 VanDerWaalsContact O-N 3.11Å; Y198-G202 PolarHBondContact O-N 3.14Å; Y198-I278 HydrophobicContact CE1-CD1 3.69Å; Y198-I278 HydrophobicContact CE1-CG1 3.92Å; Y198-I278 VanDerWaalsContact OH-CG1 3.22Å; Y198-I278 WeakPolarHBondContact OH-CG1 3.48Å; Y198-P279 WeakPolarHBondContact OH-CD 3.22Å; Y198-P279 WeakPolarHBondContact OH-CG 3.37Å; Y198-P279 PolarHBondContact OH-O 3.22Å; Y198-F284 HydrophobicContact CD2-CD1 4.01Å; Y198-F284 HydrophobicContact CD2-CD2 4.21Å; Y198-F284 HydrophobicContact CD2-CE1 4.15Å; Y198-F284 HydrophobicContact CD2-CE2 4.38Å; Y198-F284 HydrophobicContact CD2-CG 4.03Å; Y198-F284 HydrophobicContact CD2-CZ 4.34Å; Y198-F284 HydrophobicContact CE2-CG 4.36Å
199H94.9Very high96Very high3 Ų311.1 Ų11.11%0.0146%0.064CC..Hα-helixtrans-62.7-38.1-17052.8-84.5000111.9V144 I148 Y152 R197 V201 G202 L203V144-H199 HydrophobicContact CG1-CB 4.06Å; V144-H199 HydrophobicContact CG2-CB 4.48Å; I148-H199 HydrophobicContact CG2-CB 3.92Å; Y152-H199 HydrophobicContact CE2-CB 3.94Å; Y152-H199 WeakPolarHBondContact CE2-O 3.31Å; Y152-H199 VanDerWaalsContact OH-CA 3.23Å; Y152-H199 WeakPolarHBondContact OH-CA 3.43Å; Y152-H199 PolarHBondContact OH-O 3.48Å; R197-H199 PolarHBondContact O-N 3.16Å; R197-H199 VanDerWaalsContact O-N 3.16Å; R197-H199 PolarHBondContact O-ND1 3.49Å; H199-V201 VanDerWaalsContact C-N 3.35Å; H199-V201 PolarHBondContact O-N 3.37Å; H199-G202 PolarHBondContact O-N 2.9Å; H199-L203 PolarHBondContact O-N 3.3Å
200N95.5Very high96Very high25 Ų2510.6 Ų10.613%0.1346%0.061CC..Hα-helixtrans-59-42.4175-63.6-23.9000112.6F127 V134 Y198 L203 L204F127-N200 HydrophobicContact CD1-CB 4.18Å; F127-N200 HydrophobicContact CE1-CB 4.05Å; F127-N200 HydrophobicContact CE2-CB 4.39Å; F127-N200 HydrophobicContact CG-CB 4.43Å; F127-N200 HydrophobicContact CZ-CB 4.18Å; V134-N200 HydrophobicContact CB-CB 3.99Å; V134-N200 HydrophobicContact CG1-CB 4.09Å; V134-N200 PolarHBondContact O-ND2 3.45Å; Y198-N200 VanDerWaalsContact C-N 3.29Å; Y198-N200 PolarHBondContact O-N 3.41Å; N200-L203 PolarHBondContact O-N 2.96Å; N200-L204 PolarHBondContact O-N 3.37Å
201V96.4Very high96Very high2 Ų210.5 Ų10.51%0.0126%0.061CC..Hα-helixtrans-62.4-49.4176.3178.30000110.2V134 F135 Y198 H199 L203 L204 V205 V263 T267 F284V134-V201 HydrophobicContact CB-CG2 3.85Å; V134-V201 HydrophobicContact CG1-CG2 4.34Å; V134-V201 HydrophobicContact CG2-CG2 3.67Å; F135-V201 HydrophobicContact CE1-CG2 4.3Å; F135-V201 HydrophobicContact CE2-CG2 4Å; F135-V201 HydrophobicContact CZ-CG2 3.69Å; Y198-V201 WeakPolarHBondContact O-CB 3.31Å; Y198-V201 PolarHBondContact O-N 3.36Å; Y198-V201 VanDerWaalsContact O-N 3.11Å; H199-V201 VanDerWaalsContact C-N 3.35Å; H199-V201 PolarHBondContact O-N 3.37Å; V201-L203 VanDerWaalsContact C-N 3.25Å; V201-L203 PolarHBondContact O-N 3.31Å; V201-L204 WeakPolarHBondContact O-CB 3.35Å; V201-L204 PolarHBondContact O-N 3.06Å; V201-L204 VanDerWaalsContact O-N 3.09Å; V201-V205 HydrophobicContact CG1-CG2 4.46Å; V201-V205 WeakPolarHBondContact O-CG2 3.4Å; V201-V205 PolarHBondContact O-N 2.98Å; V201-V263 HydrophobicContact CG1-CG1 3.79Å; V201-T267 HydrophobicContact CB-CG2 4.48Å; V201-T267 HydrophobicContact CG1-CG2 3.61Å; V201-T267 HydrophobicContact CG2-CG2 4.04Å; V201-F284 HydrophobicContact CG1-CE1 4.04Å; V201-F284 HydrophobicContact CG1-CZ 4.3Å
202G96.5Very high96.1Very high5 Ų58.5 Ų8.55%0.0524%0.044CC..Hα-helixtrans-65.2-28.3-179.100000113.3Y152 Y198 H199 V205 F206Y152-G202 WeakPolarHBondContact OH-CA 3.33Å; Y152-G202 PolarHBondContact OH-N 2.9Å; Y198-G202 PolarHBondContact O-N 3.14Å; H199-G202 PolarHBondContact O-N 2.9Å; G202-V205 WeakPolarHBondContact O-CB 3.28Å; G202-V205 PolarHBondContact O-N 3.37Å; G202-V205 VanDerWaalsContact O-N 3.16Å; G202-F206 WeakPolarHBondContact O-CD2 3.4Å; G202-F206 WeakPolarHBondContact O-CG 3.32Å; G202-F206 PolarHBondContact O-N 3.36Å
203L96.8Very high96.1Very high0 Ų09.1 Ų9.10%05%0.046CC..Hα-helixtrans-63.9-40.2172-16966.7000112.1C116 L119 L120 F127 I148 A151 H199 N200 V201 V205 F206 F207C116-L203 HydrophobicContact CB-CD1 4.15Å; L119-L203 HydrophobicContact CB-CD2 4.01Å; L119-L203 HydrophobicContact CD1-CD1 4.13Å; L119-L203 HydrophobicContact CD1-CD2 4.17Å; L120-L203 HydrophobicContact CD2-CD2 3.86Å; L120-L203 HydrophobicContact CD2-CG 4.14Å; L120-L203 HydrophobicContact CG-CD2 4.26Å; L120-L203 HydrophobicContact CG-CG 4.35Å; F127-L203 HydrophobicContact CE2-CB 4.35Å; F127-L203 HydrophobicContact CE2-CD2 3.94Å; F127-L203 HydrophobicContact CZ-CD2 3.84Å; I148-L203 HydrophobicContact CG1-CD2 4.39Å; A151-L203 HydrophobicContact CB-CD1 4.17Å; H199-L203 PolarHBondContact O-N 3.3Å; N200-L203 PolarHBondContact O-N 2.96Å; V201-L203 VanDerWaalsContact C-N 3.25Å; V201-L203 PolarHBondContact O-N 3.31Å; L203-V205 VanDerWaalsContact C-N 3.34Å; L203-F206 HydrophobicContact CD1-CD2 4.41Å; L203-F206 PolarHBondContact O-N 3.26Å; L203-F207 PolarHBondContact O-N 2.83Å; L203-F207 VanDerWaalsContact O-N 3.1Å
204L97Very high96.2Very high1 Ų19.9 Ų9.91%0.0055%0.051CC..Hα-helixtrans-61.9-42.6170.7-68.2177.3000111.3L120 F127 F128 V134 N200 V201 F207 L208 V263L120-L204 HydrophobicContact CD1-CD2 4.22Å; L120-L204 HydrophobicContact CD2-CD2 4Å; F127-L204 HydrophobicContact CD2-CD1 4.31Å; F127-L204 HydrophobicContact CD2-CD2 3.92Å; F127-L204 HydrophobicContact CD2-CG 3.9Å; F127-L204 HydrophobicContact CE2-CD2 4.48Å; F127-L204 HydrophobicContact CE2-CG 4.42Å; F128-L204 HydrophobicContact CB-CD2 4.33Å; F128-L204 HydrophobicContact CD2-CD2 4.02Å; V134-L204 HydrophobicContact CG1-CD1 3.64Å; N200-L204 PolarHBondContact O-N 3.37Å; V201-L204 WeakPolarHBondContact O-CB 3.35Å; V201-L204 PolarHBondContact O-N 3.06Å; V201-L204 VanDerWaalsContact O-N 3.09Å; L204-F207 PolarHBondContact O-N 3.2Å; L204-L208 WeakPolarHBondContact O-CB 3.24Å; L204-L208 WeakPolarHBondContact O-CG 3.35Å; L204-L208 PolarHBondContact O-N 3.44Å; L204-V263 HydrophobicContact CB-CG2 3.83Å; L204-V263 HydrophobicContact CD1-CG2 4.42Å
205V97.7Very high96.2Very high19 Ų1910.8 Ų10.812%0.1156%0.056CC..Hα-helixtrans-59.7-48.3177.7-1800000111V201 G202 L203 F207 L208 H209 F259 V263 L288 L291V201-V205 HydrophobicContact CG1-CG2 4.46Å; V201-V205 WeakPolarHBondContact O-CG2 3.4Å; V201-V205 PolarHBondContact O-N 2.98Å; G202-V205 WeakPolarHBondContact O-CB 3.28Å; G202-V205 PolarHBondContact O-N 3.37Å; G202-V205 VanDerWaalsContact O-N 3.16Å; L203-V205 VanDerWaalsContact C-N 3.34Å; V205-F207 PolarHBondContact O-N 3.02Å; V205-L208 PolarHBondContact O-N 3.49Å; V205-H209 WeakPolarHBondContact O-CB 3.16Å; V205-H209 PolarHBondContact O-N 3.01Å; V205-H209 PolarHBondContact O-ND1 2.87Å; V205-F259 HydrophobicContact CG2-CE2 4.04Å; V205-V263 HydrophobicContact CG2-CG1 3.93Å; V205-V263 HydrophobicContact CG2-CG2 4.25Å; V205-L288 HydrophobicContact CG2-CD2 4.25Å; V205-L291 HydrophobicContact CG1-CD2 4.17Å
206F97.6Very high96.3Very high11 Ų1111.8 Ų11.85%0.0486%0.06CC..Hα-helixtrans-56.5-51.6177.4-62.6-28.6000111.9Y152 Q155 I190 G202 L203 L208 H209 D210Y152-F206 HydrophobicContact CD1-CE2 4.47Å; Y152-F206 HydrophobicContact CD1-CZ 4.36Å; Y152-F206 AromaticContact CD2-CE2 3.9Å; Y152-F206 HydrophobicContact CD2-CE2 3.9Å; Y152-F206 HydrophobicContact CE1-CE2 4.41Å; Y152-F206 HydrophobicContact CE1-CZ 4.24Å; Y152-F206 AromaticContact CE2-CE2 3.85Å; Y152-F206 HydrophobicContact CE2-CE2 3.85Å; Y152-F206 HydrophobicContact CE2-CZ 4.46Å; Y152-F206 HydrophobicContact CG-CE2 4.22Å; Q155-F206 HydrophobicContact CB-CD1 4.44Å; Q155-F206 HydrophobicContact CB-CE1 3.96Å; Q155-F206 HydrophobicContact CB-CE2 4.19Å; Q155-F206 HydrophobicContact CB-CZ 3.82Å; Q155-F206 HydrophobicContact CG-CD1 4.06Å; Q155-F206 HydrophobicContact CG-CD2 4Å; Q155-F206 HydrophobicContact CG-CE1 4.07Å; Q155-F206 HydrophobicContact CG-CE2 4.01Å; Q155-F206 HydrophobicContact CG-CG 4.04Å; Q155-F206 HydrophobicContact CG-CZ 4.05Å; I190-F206 HydrophobicContact CD1-CE1 3.77Å; I190-F206 HydrophobicContact CD1-CZ 4.12Å; I190-F206 HydrophobicContact CG1-CE1 3.61Å; I190-F206 HydrophobicContact CG1-CZ 3.76Å; I190-F206 HydrophobicContact CG2-CZ 4.34Å; G202-F206 WeakPolarHBondContact O-CD2 3.4Å; G202-F206 WeakPolarHBondContact O-CG 3.32Å; G202-F206 PolarHBondContact O-N 3.36Å; L203-F206 HydrophobicContact CD1-CD2 4.41Å; L203-F206 PolarHBondContact O-N 3.26Å; F206-L208 VanDerWaalsContact C-N 3.34Å; F206-L208 PolarHBondContact O-N 3.41Å; F206-H209 PolarHBondContact O-N 2.74Å; F206-D210 WeakPolarHBondContact O-CB 3.36Å; F206-D210 VanDerWaalsContact O-CG 3.31Å; F206-D210 PolarHBondContact O-N 2.98Å
207F97.6Very high96.4Very high7 Ų711.9 Ų11.93%0.0316%0.061CC..Hα-helixtrans-60.6-42.4-178.8175.3-100.6000113W113 C116 A117 L120 L121 F128 L203 L204 V205 F254W113-F207 VanDerWaalsContact CD1-O 3.32Å; W113-F207 AromaticContact CE2-CE2 3.72Å; W113-F207 AromaticContact CZ2-CE2 3.71Å; W113-F207 HydrophobicContact CZ2-CE2 3.71Å; W113-F207 HydrophobicContact CZ2-CZ 4.22Å; W113-F207 AromaticContact NE1-CD2 3.39Å; W113-F207 AromaticContact NE1-CE2 3.44Å; W113-F207 PolarHBondContact NE1-O 3.48Å; W113-F207 VanDerWaalsContact NE1-O 3.16Å; C116-F207 HydrophobicContact CB-CB 4.22Å; A117-F207 HydrophobicContact CB-CD2 4.05Å; A117-F207 HydrophobicContact CB-CE2 3.67Å; L120-F207 HydrophobicContact CD1-CB 3.31Å; L120-F207 HydrophobicContact CD1-CD1 3.8Å; L120-F207 HydrophobicContact CD1-CD2 3.92Å; L120-F207 HydrophobicContact CD1-CG 3.39Å; L121-F207 HydrophobicContact CD1-CZ 4.35Å; F128-F207 HydrophobicContact CD2-CD1 4.33Å; F128-F207 HydrophobicContact CD2-CE1 4.24Å; F128-F207 AromaticContact CE2-CD1 3.87Å; F128-F207 HydrophobicContact CE2-CD1 3.87Å; F128-F207 AromaticContact CE2-CE1 3.47Å; F128-F207 HydrophobicContact CE2-CE1 3.47Å; F128-F207 VanDerWaalsContact CE2-CE1 3.47Å; F128-F207 HydrophobicContact CE2-CZ 4.41Å; F128-F207 AromaticContact CZ-CE1 3.97Å; F128-F207 HydrophobicContact CZ-CE1 3.97Å; L203-F207 PolarHBondContact O-N 2.83Å; L203-F207 VanDerWaalsContact O-N 3.1Å; L204-F207 PolarHBondContact O-N 3.2Å; V205-F207 PolarHBondContact O-N 3.02Å; F207-F254 HydrophobicContact CE1-CE1 4.02Å; F207-F254 HydrophobicContact CZ-CE1 4.35Å
208L97.4Very high96.5Very high0 Ų015.2 Ų15.20%08%0.077CC..Hα-helixtrans-73.6-31.2-177.5-65.9175.9000112.8L204 V205 F206 F254 W258 F259 V263L204-L208 WeakPolarHBondContact O-CB 3.24Å; L204-L208 WeakPolarHBondContact O-CG 3.35Å; L204-L208 PolarHBondContact O-N 3.44Å; V205-L208 PolarHBondContact O-N 3.49Å; F206-L208 VanDerWaalsContact C-N 3.34Å; F206-L208 PolarHBondContact O-N 3.41Å; L208-F254 HydrophobicContact CD2-CD1 3.8Å; L208-F254 VanDerWaalsContact O-CB 3.24Å; L208-F254 WeakPolarHBondContact O-CB 3.11Å; L208-W258 HydrophobicContact CD1-CB 4.49Å; L208-W258 HydrophobicContact CD2-CB 3.84Å; L208-W258 HydrophobicContact CD2-CD2 4.5Å; L208-W258 HydrophobicContact CD2-CE3 3.78Å; L208-F259 HydrophobicContact CD1-CB 4.05Å; L208-F259 HydrophobicContact CD1-CD2 4.45Å; L208-V263 HydrophobicContact CD1-CG2 3.96Å
209H97.3Very high96.5Very high7 Ų715.4 Ų15.43%0.0328%0.078CC..Hα-helixtrans-87.3-45.9-177.3-7174.9000112.3V205 F206 V211 S212 R255 F259 N295V205-H209 WeakPolarHBondContact O-CB 3.16Å; V205-H209 PolarHBondContact O-N 3.01Å; V205-H209 PolarHBondContact O-ND1 2.87Å; F206-H209 PolarHBondContact O-N 2.74Å; H209-V211 VanDerWaalsContact C-N 3.32Å; H209-V211 PolarHBondContact O-N 2.92Å; H209-S212 PolarHBondContact O-N 3.49Å; H209-S212 PolarHBondContact O-OG 2.92Å; H209-R255 PolarHBondContact O-NE 3.35Å; H209-R255 PolarHBondContact O-NH2 3.02Å; H209-F259 AromaticContact CE1-CD2 3.53Å; H209-F259 AromaticContact CE1-CE2 3.68Å; H209-F259 AromaticContact CE1-CG 3.79Å; H209-N295 PolarHBondContact NE2-ND2 3.24Å
210D96.8Very high96.4Very high1 Ų116.3 Ų16.31%0.0058%0.082CC..Hα-helixtrans-66.7-29.8-168.4-72.112.4000113.6W113 Q155 F206 S212 D213 V214W113-D210 HydrophobicContact CB-CB 3.99Å; W113-D210 HydrophobicContact CG-CB 4.43Å; Q155-D210 PolarHBondContact NE2-OD2 3.06Å; F206-D210 WeakPolarHBondContact O-CB 3.36Å; F206-D210 VanDerWaalsContact O-CG 3.31Å; F206-D210 PolarHBondContact O-N 2.98Å; D210-S212 PolarHBondContact O-N 3.33Å; D210-D213 PolarHBondContact O-N 3.48Å; D210-V214 WeakPolarHBondContact O-CG2 3.38Å; D210-V214 PolarHBondContact O-N 2.87Å
211V97.1Very high96.4Very high11 Ų1116 Ų167%0.0678%0.081CC..Hα-helixtrans-56-39.3-179.160.70000112.5W113 H209 D213 V214 Q215 F254W113-V211 HydrophobicContact CD2-CB 4.45Å; W113-V211 HydrophobicContact CG-CB 4.42Å; W113-V211 HydrophobicContact CZ2-CB 4.34Å; W113-V211 HydrophobicContact CZ2-CG2 3.97Å; H209-V211 VanDerWaalsContact C-N 3.32Å; H209-V211 PolarHBondContact O-N 2.92Å; V211-D213 VanDerWaalsContact C-N 3.34Å; V211-V214 PolarHBondContact O-N 3.47Å; V211-Q215 WeakPolarHBondContact O-CG 3.48Å; V211-Q215 PolarHBondContact O-N 2.96Å; V211-F254 HydrophobicContact CG1-CB 3.98Å; V211-F254 HydrophobicContact CG1-CD1 3.64Å; V211-F254 HydrophobicContact CG1-CD2 3.94Å; V211-F254 HydrophobicContact CG1-CE1 4.03Å; V211-F254 HydrophobicContact CG1-CE2 4.31Å; V211-F254 HydrophobicContact CG1-CG 3.59Å; V211-F254 HydrophobicContact CG1-CZ 4.36Å
212S96.3Very high96.3Very high0 Ų016.6 Ų16.60%08%0.083CC..Hα-helixtrans-71.2-31.5179.557.50000112.2H209 D210 Q215 L216 F247 R255H209-S212 PolarHBondContact O-N 3.49Å; H209-S212 PolarHBondContact O-OG 2.92Å; D210-S212 PolarHBondContact O-N 3.33Å; S212-Q215 PolarHBondContact O-N 3.45Å; S212-L216 WeakPolarHBondContact O-CB 3.36Å; S212-L216 PolarHBondContact O-N 3.38Å; S212-F247 WeakPolarHBondContact O-CD2 3.37Å; S212-F247 WeakPolarHBondContact O-CE2 3.44Å; S212-R255 PolarHBondContact OG-NE 3.29Å; S212-R255 PolarHBondContact OG-NH2 3.46Å; S212-R255 VanDerWaalsContact OG-NH2 3.14Å
213D95.6Very high96Very high23 Ų2317.6 Ų17.612%0.1239%0.087CC..Hα-helixtrans-73.8-35.7177.3-64.2-43000111.3Y109 D210 V211 Q215 L216 E217 R255Y109-D213 HydrophobicContact CD1-CB 4.39Å; Y109-D213 HydrophobicContact CD2-CB 3.64Å; Y109-D213 HydrophobicContact CE2-CB 3.8Å; Y109-D213 HydrophobicContact CG-CB 3.97Å; D210-D213 PolarHBondContact O-N 3.48Å; V211-D213 VanDerWaalsContact C-N 3.34Å; D213-Q215 VanDerWaalsContact C-N 3.34Å; D213-Q215 PolarHBondContact O-N 2.92Å; D213-L216 PolarHBondContact O-N 3.46Å; D213-E217 WeakPolarHBondContact O-CG 3.17Å; D213-E217 PolarHBondContact O-N 2.98Å; D213-R255 IonicContact OD1-NH2 3.32Å; D213-R255 PolarHBondContact OD1-NH2 2.88Å; D213-R255 IonicContact OD2-NH2 3.91Å; D213-R255 PolarHBondContact OD2-NH2 3.16Å
214V97.2Very high95.7Very high20 Ų2018.4 Ų18.412%0.1219%0.09CC..Hα-helixtrans-56.5-50168.8176.30000110.4L106 Y109 L110 W113 D210 V211 L216 F218L106-V214 HydrophobicContact CD1-CG1 3.91Å; L106-V214 WeakPolarHBondContact CD1-O 3.31Å; Y109-V214 VanDerWaalsContact C-CG2 3.45Å; L110-V214 HydrophobicContact CB-CG1 4.38Å; L110-V214 HydrophobicContact CB-CG2 4.35Å; L110-V214 HydrophobicContact CD1-CG1 3.94Å; W113-V214 HydrophobicContact CB-CG2 4.31Å; D210-V214 WeakPolarHBondContact O-CG2 3.38Å; D210-V214 PolarHBondContact O-N 2.87Å; V211-V214 PolarHBondContact O-N 3.47Å; V214-L216 PolarHBondContact O-N 3.45Å; V214-F218 WeakPolarHBondContact O-CB 3.28Å; V214-F218 PolarHBondContact O-N 2.93Å
215Q96.5Very high95.5Very high44 Ų4419.6 Ų19.621%0.20610%0.096CC..Hα-helixtrans-64.9-40-179.6-68.1-171.919.600112.2V211 S212 D213 T219 S246 F247 C250V211-Q215 WeakPolarHBondContact O-CG 3.48Å; V211-Q215 PolarHBondContact O-N 2.96Å; S212-Q215 PolarHBondContact O-N 3.45Å; D213-Q215 VanDerWaalsContact C-N 3.34Å; D213-Q215 PolarHBondContact O-N 2.92Å; Q215-T219 VanDerWaalsContact O-CB 3.3Å; Q215-T219 WeakPolarHBondContact O-CB 3.41Å; Q215-T219 PolarHBondContact O-N 3.47Å; Q215-T219 PolarHBondContact O-OG1 3.44Å; Q215-S246 PolarHBondContact OE1-O 2.86Å; Q215-S246 PolarHBondContact OE1-OG 3.44Å; Q215-F247 HydrophobicContact CB-CB 4.37Å; Q215-F247 HydrophobicContact CB-CD2 4.43Å; Q215-C250 PolarHBondContact NE2-SG 3.36Å; Q215-C250 VanDerWaalsContact OE1-CB 3.25Å
216L94.8Very high95Very high28 Ų2820 Ų2015%0.14710%0.096CC..Hα-helixtrans-60.7-52.8178.4-178.962.5000111.5S212 D213 V214 T219 K220 F247S212-L216 WeakPolarHBondContact O-CB 3.36Å; S212-L216 PolarHBondContact O-N 3.38Å; D213-L216 PolarHBondContact O-N 3.46Å; V214-L216 PolarHBondContact O-N 3.45Å; L216-T219 PolarHBondContact O-N 2.98Å; L216-K220 WeakPolarHBondContact O-CG 3.33Å; L216-K220 PolarHBondContact O-N 3.01Å; L216-F247 HydrophobicContact CB-CD2 3.94Å; L216-F247 HydrophobicContact CB-CE2 3.71Å; L216-F247 HydrophobicContact CB-CZ 4.29Å; L216-F247 HydrophobicContact CD1-CD1 4.38Å; L216-F247 HydrophobicContact CD1-CD2 4.46Å; L216-F247 HydrophobicContact CD1-CE1 3.96Å; L216-F247 HydrophobicContact CD1-CE2 4.08Å; L216-F247 HydrophobicContact CD1-CZ 3.81Å; L216-F247 HydrophobicContact CD2-CE2 4.43Å; L216-F247 HydrophobicContact CD2-CZ 4.37Å; L216-F247 HydrophobicContact CG-CE2 4.28Å; L216-F247 HydrophobicContact CG-CZ 4.37Å
217E96.3Very high94.2Very high9 Ų920.7 Ų20.74%0.04210%0.104CC..Hα-helixtrans-71.6-34.6-176.5-62.4-56146.300111.8S102 K105 L106 D213 T219 K220 L221S102-E217 WeakPolarHBondContact CA-OE2 3.46Å; S102-E217 WeakPolarHBondContact CB-OE2 3.5Å; S102-E217 PolarHBondContact OG-OE2 2.89Å; K105-E217 HydrophobicContact CB-CG 3.82Å; L106-E217 HydrophobicContact CB-CB 3.87Å; L106-E217 HydrophobicContact CD1-CB 4.47Å; D213-E217 WeakPolarHBondContact O-CG 3.17Å; D213-E217 PolarHBondContact O-N 2.98Å; E217-T219 PolarHBondContact O-N 2.85Å; E217-K220 PolarHBondContact O-N 3.48Å; E217-K220 IonicContact OE1-NZ 2.99Å; E217-K220 PolarHBondContact OE1-NZ 3.26Å; E217-K220 WeakPolarHBondContact OE2-CD 3.26Å; E217-K220 IonicContact OE2-NZ 3.45Å; E217-L221 WeakPolarHBondContact O-CG 3.32Å; E217-L221 PolarHBondContact O-N 3.14Å
218F96.2Very high93.6Very high98 Ų9824.1 Ų24.143%0.4312%0.116SC..Hα-helixtrans-61.3-43.3170.9-178.4-103.5000112.2L106 V214 L221 N222 V239L106-F218 HydrophobicContact CD1-CB 3.97Å; L106-F218 HydrophobicContact CD2-CB 4.32Å; L106-F218 HydrophobicContact CD2-CD2 4.21Å; V214-F218 WeakPolarHBondContact O-CB 3.28Å; V214-F218 PolarHBondContact O-N 2.93Å; F218-L221 PolarHBondContact O-N 3.28Å; F218-N222 VanDerWaalsContact CE1-ND2 3.33Å; F218-N222 WeakPolarHBondContact CE1-ND2 3.03Å; F218-N222 VanDerWaalsContact CZ-ND2 3.34Å; F218-N222 WeakPolarHBondContact CZ-ND2 3.18Å; F218-N222 PolarHBondContact O-N 2.96Å; F218-N222 VanDerWaalsContact O-N 3.14Å; F218-N222 PolarHBondContact O-ND2 3.19Å; F218-V239 HydrophobicContact CE1-CG1 3.62Å; F218-V239 HydrophobicContact CZ-CG1 4.05Å
219T94.9Very high92.7Very high10 Ų1026 Ų266%0.06114%0.136CC..Hα-helixtrans-64.2-45.1178.1-59.90000111.1Q215 L216 E217 L221 N222 I223 A240 G243Q215-T219 VanDerWaalsContact O-CB 3.3Å; Q215-T219 WeakPolarHBondContact O-CB 3.41Å; Q215-T219 PolarHBondContact O-N 3.47Å; Q215-T219 PolarHBondContact O-OG1 3.44Å; L216-T219 PolarHBondContact O-N 2.98Å; E217-T219 PolarHBondContact O-N 2.85Å; T219-L221 PolarHBondContact O-N 3.48Å; T219-N222 PolarHBondContact O-N 3.34Å; T219-N222 VanDerWaalsContact O-N 3.17Å; T219-I223 HydrophobicContact CG2-CD1 4.2Å; T219-I223 WeakPolarHBondContact O-CG1 3.36Å; T219-I223 PolarHBondContact O-N 2.94Å; T219-A240 WeakPolarHBondContact CG2-O 3.41Å; T219-G243 VanDerWaalsContact OG1-C 3.3Å; T219-G243 WeakPolarHBondContact OG1-CA 3.13Å; T219-G243 PolarHBondContact OG1-O 2.93Å
220K93.1Very high91.8Very high21 Ų2129.9 Ų29.99%0.09118%0.177CC..Hα-helixtrans-57.7-45.7176.1-75.7174.5-178.4171.80112.4L216 E217 N222 I223 Y224L216-K220 WeakPolarHBondContact O-CG 3.33Å; L216-K220 PolarHBondContact O-N 3.01Å; E217-K220 PolarHBondContact O-N 3.48Å; E217-K220 IonicContact OE1-NZ 2.99Å; E217-K220 PolarHBondContact OE1-NZ 3.26Å; E217-K220 WeakPolarHBondContact OE2-CD 3.26Å; E217-K220 IonicContact OE2-NZ 3.45Å; K220-N222 VanDerWaalsContact C-N 3.32Å; K220-N222 PolarHBondContact O-N 3.4Å; K220-I223 WeakPolarHBondContact O-CB 3.17Å; K220-I223 PolarHBondContact O-N 2.83Å; K220-I223 VanDerWaalsContact O-N 3.11Å; K220-Y224 HydrophobicContact CB-CE2 4.17Å; K220-Y224 WeakPolarHBondContact O-CD1 3.45Å; K220-Y224 WeakPolarHBondContact O-CD2 3.5Å; K220-Y224 PolarHBondContact O-N 3.49Å
221L94.6Very high91.1Very high20 Ų2034.1 Ų34.111%0.10520%0.204CC..Hα-helixtrans-60-43.2176.8-69.2177.9000111.5L99 A103 L106 E217 F218 T219 I223 Y224 F225L99-L221 HydrophobicContact CD1-CD2 3.91Å; L99-L221 HydrophobicContact CG-CD2 4.02Å; A103-L221 HydrophobicContact CB-CD1 4.36Å; A103-L221 HydrophobicContact CB-CD2 4.17Å; L106-L221 HydrophobicContact CB-CD1 4.4Å; L106-L221 HydrophobicContact CD2-CD1 3.44Å; L106-L221 VanDerWaalsContact CD2-CD1 3.44Å; E217-L221 WeakPolarHBondContact O-CG 3.32Å; E217-L221 PolarHBondContact O-N 3.14Å; F218-L221 PolarHBondContact O-N 3.28Å; T219-L221 PolarHBondContact O-N 3.48Å; L221-I223 VanDerWaalsContact C-N 3.28Å; L221-I223 PolarHBondContact O-N 3.43Å; L221-Y224 HydrophobicContact CD2-CD2 4.04Å; L221-Y224 HydrophobicContact CD2-CE2 4.38Å; L221-Y224 WeakPolarHBondContact O-CB 3.45Å; L221-Y224 PolarHBondContact O-N 3.45Å; L221-Y224 VanDerWaalsContact O-N 3.11Å; L221-F225 HydrophobicContact CB-CD2 4.48Å; L221-F225 WeakPolarHBondContact O-CD2 3.21Å; L221-F225 PolarHBondContact O-N 3.2Å
222N94.4Very high90.5Very high13 Ų1340 Ų407%0.0723%0.225CC..Hα-helixtrans-63-35.1176-78.6-78.3000112.4F218 T219 K220 F225 K226 H236 V239 A240F218-N222 VanDerWaalsContact CE1-ND2 3.33Å; F218-N222 WeakPolarHBondContact CE1-ND2 3.03Å; F218-N222 VanDerWaalsContact CZ-ND2 3.34Å; F218-N222 WeakPolarHBondContact CZ-ND2 3.18Å; F218-N222 PolarHBondContact O-N 2.96Å; F218-N222 VanDerWaalsContact O-N 3.14Å; F218-N222 PolarHBondContact O-ND2 3.19Å; T219-N222 PolarHBondContact O-N 3.34Å; T219-N222 VanDerWaalsContact O-N 3.17Å; K220-N222 VanDerWaalsContact C-N 3.32Å; K220-N222 PolarHBondContact O-N 3.4Å; N222-F225 PolarHBondContact O-N 2.86Å; N222-K226 PolarHBondContact O-N 2.91Å; N222-H236 PolarHBondContact OD1-ND1 2.84Å; N222-V239 HydrophobicContact CB-CG1 4.23Å; N222-V239 VanDerWaalsContact CG-CG1 3.48Å; N222-V239 WeakPolarHBondContact OD1-CG1 3.33Å; N222-A240 HydrophobicContact CB-CB 4.19Å
223I91.6Very high90.2Very high27 Ų2742.7 Ų42.714%0.13824%0.238CC..Hα-helixtrans-61.9-44.3172-67.4168.1000110.7T219 K220 L221 F225 K226 A240 L317T219-I223 HydrophobicContact CG2-CD1 4.2Å; T219-I223 WeakPolarHBondContact O-CG1 3.36Å; T219-I223 PolarHBondContact O-N 2.94Å; K220-I223 WeakPolarHBondContact O-CB 3.17Å; K220-I223 PolarHBondContact O-N 2.83Å; K220-I223 VanDerWaalsContact O-N 3.11Å; L221-I223 VanDerWaalsContact C-N 3.28Å; L221-I223 PolarHBondContact O-N 3.43Å; I223-F225 VanDerWaalsContact C-N 3.34Å; I223-F225 PolarHBondContact O-N 3.29Å; I223-K226 HydrophobicContact CG2-CD 4.48Å; I223-K226 WeakPolarHBondContact O-CD 3.23Å; I223-K226 WeakPolarHBondContact O-CG 3.41Å; I223-K226 PolarHBondContact O-N 3.47Å; I223-A240 HydrophobicContact CG1-CB 3.69Å; I223-L317 HydrophobicContact CD1-CB 3.83Å; I223-L317 HydrophobicContact CD1-CD1 4.43Å; I223-L317 HydrophobicContact CG1-CD1 4.47Å
224Y90.9Very high89.8Confident16 Ų1651.7 Ų51.76%0.06327%0.27CS..Hα-helixtrans-63.6-39.7177.9-55.5-22.4000111.8L91 D95 R98 L99 K220 L221L91-Y224 WeakPolarHBondContact CD2-O 3.49Å; D95-Y224 HydrophobicContact CB-CD1 4Å; D95-Y224 HydrophobicContact CB-CG 4.07Å; D95-Y224 WeakPolarHBondContact OD1-CD1 3.5Å; R98-Y224 HydrophobicContact CB-CE2 4.14Å; L99-Y224 HydrophobicContact CB-CD2 4.23Å; K220-Y224 HydrophobicContact CB-CE2 4.17Å; K220-Y224 WeakPolarHBondContact O-CD1 3.45Å; K220-Y224 WeakPolarHBondContact O-CD2 3.5Å; K220-Y224 PolarHBondContact O-N 3.49Å; L221-Y224 HydrophobicContact CD2-CD2 4.04Å; L221-Y224 HydrophobicContact CD2-CE2 4.38Å; L221-Y224 WeakPolarHBondContact O-CB 3.45Å; L221-Y224 PolarHBondContact O-N 3.45Å; L221-Y224 VanDerWaalsContact O-N 3.11Å
225F91.1Very high89.4Confident26 Ų2656.6 Ų56.611%0.11430%0.295CS..Hα-helixtrans-80.5-11.2-178.3-75.3-68.8000114.6L85 C89 L91 L99 L221 N222 I223 A227 R228L85-F225 HydrophobicContact CD2-CZ 4.23Å; L85-F225 HydrophobicContact CG-CZ 4.46Å; C89-F225 HydrophobicContact CB-CE1 4.04Å; L91-F225 HydrophobicContact CD1-CD1 4.49Å; L91-F225 HydrophobicContact CD1-CE1 4.03Å; L91-F225 HydrophobicContact CD1-CZ 4.32Å; L91-F225 HydrophobicContact CD2-CD1 3.82Å; L91-F225 HydrophobicContact CD2-CE1 4.08Å; L91-F225 HydrophobicContact CG-CE1 4.43Å; L99-F225 HydrophobicContact CD1-CD2 4.48Å; L99-F225 HydrophobicContact CD1-CE1 4.39Å; L99-F225 HydrophobicContact CD1-CE2 3.5Å; L99-F225 HydrophobicContact CD1-CZ 3.44Å; L99-F225 VanDerWaalsContact CD1-CZ 3.44Å; L221-F225 HydrophobicContact CB-CD2 4.48Å; L221-F225 WeakPolarHBondContact O-CD2 3.21Å; L221-F225 PolarHBondContact O-N 3.2Å; N222-F225 PolarHBondContact O-N 2.86Å; I223-F225 VanDerWaalsContact C-N 3.34Å; I223-F225 PolarHBondContact O-N 3.29Å; F225-A227 VanDerWaalsContact C-N 3.3Å; F225-A227 PolarHBondContact O-N 3.42Å; F225-R228 WeakPolarHBondContact O-CB 3.2Å
226K87.4Confident89.1Confident28 Ų2856.8 Ų56.812%0.12230%0.296CS..Hα-helixtrans-64.8-33.5-179.986.3-168.3172.31750112.6N222 I223 Y232 H233 H236N222-K226 PolarHBondContact O-N 2.91Å; I223-K226 HydrophobicContact CG2-CD 4.48Å; I223-K226 WeakPolarHBondContact O-CD 3.23Å; I223-K226 WeakPolarHBondContact O-CG 3.41Å; I223-K226 PolarHBondContact O-N 3.47Å; K226-Y232 HydrophobicContact CB-CE2 4.17Å; K226-Y232 HydrophobicContact CD-CE2 4.13Å; K226-Y232 HydrophobicContact CG-CD2 4.43Å; K226-Y232 HydrophobicContact CG-CE2 3.87Å; K226-Y232 CarbonylContact O-C 3.44Å; K226-Y232 WeakPolarHBondContact O-CA 3.25Å; K226-H233 PolarHBondContact O-N 3.41Å; K226-H236 HydrophobicContact CB-CB 4.11Å
227A82.4Confident88.8Confident25 Ų2555.6 Ų55.621%0.20729%0.29CS..EExtended strand (participates in β ladder)trans-115.164.5-177.300000110.8F225F225-A227 VanDerWaalsContact C-N 3.3Å; F225-A227 PolarHBondContact O-N 3.42Å
228R84.4Confident88.4Confident80 Ų8059.7 Ų59.730%0.30231%0.312SS..EExtended strand (participates in β ladder)trans-103130.4-172.8-177.6-17963.91760.9111.9C89 L91 F225 G230 T231 H233C89-R228 HydrophobicContact CB-CG 3.9Å; C89-R228 VanDerWaalsContact O-CD 3.32Å; C89-R228 WeakPolarHBondContact O-CD 3.43Å; C89-R228 WeakPolarHBondContact O-CG 3.12Å; C89-R228 PolarHBondContact SG-NH1 2.79Å; C89-R228 VanDerWaalsContact SG-NH1 3.43Å; L91-R228 HydrophobicContact CD2-CB 4.1Å; L91-R228 HydrophobicContact CD2-CG 3.99Å; F225-R228 WeakPolarHBondContact O-CB 3.2Å; R228-G230 VanDerWaalsContact C-N 3.27Å; R228-G230 PolarHBondContact O-N 3.24Å; R228-T231 PolarHBondContact N-O 3.25Å; R228-T231 PolarHBondContact O-N 3.48Å; R228-T231 VanDerWaalsContact O-N 3.15Å; R228-T231 VanDerWaalsContact O-O 3.06Å; R228-H233 PolarHBondContact NH2-NE2 3.3Å; R228-H233 PolarHBondContact O-CE1 2.88Å
229G78.4Confident88.3Confident40 Ų4056.9 Ų56.941%0.41230%0.303SS..THydrogen-bonded Turntrans65.926.3172.600000114.9R90 T231R90-G229 PolarHBondContact O-N 3.28Å; G229-T231 PolarHBondContact O-N 2.84Å
230G77.3Confident88.2Confident87 Ų8756.4 Ų56.490%0.89730%0.3SS*.THydrogen-bonded Turntrans79.7-1.1-175.700000114.4R228R228-G230 VanDerWaalsContact C-N 3.27Å; R228-G230 PolarHBondContact O-N 3.24Å
231T83.1Confident88Confident91 Ų9159.4 Ų59.456%0.55832%0.317SS*.EExtended strand (participates in β ladder)trans-116.6135.9-177.8-51.50000111.4R228 G229 H233R228-T231 PolarHBondContact N-O 3.25Å; R228-T231 PolarHBondContact O-N 3.48Å; R228-T231 VanDerWaalsContact O-N 3.15Å; R228-T231 VanDerWaalsContact O-O 3.06Å; G229-T231 PolarHBondContact O-N 2.84Å; T231-H233 PolarHBondContact O-N 3.48Å; T231-H233 PolarHBondContact O-ND1 3.33Å
232Y84.9Confident87.9Confident134 Ų13463.3 Ų63.353%0.52534%0.337SS..EExtended strand (participates in β ladder)trans-80.1119175-171.5-98.2000111.5K226 R234K226-Y232 HydrophobicContact CB-CE2 4.17Å; K226-Y232 HydrophobicContact CD-CE2 4.13Å; K226-Y232 HydrophobicContact CG-CD2 4.43Å; K226-Y232 HydrophobicContact CG-CE2 3.87Å; K226-Y232 CarbonylContact O-C 3.44Å; K226-Y232 WeakPolarHBondContact O-CA 3.25Å; Y232-R234 HydrophobicContact CD1-CG 4.21Å; Y232-R234 HydrophobicContact CE1-CG 4.3Å
233H88.4Confident87.8Confident57 Ų5763.2 Ų63.226%0.26434%0.339SS..  trans-95.4102.6179.7-66.167.5000109.9K226 R228 T231 L235 H236 G237K226-H233 PolarHBondContact O-N 3.41Å; R228-H233 PolarHBondContact NH2-NE2 3.3Å; R228-H233 PolarHBondContact O-CE1 2.88Å; T231-H233 PolarHBondContact O-N 3.48Å; T231-H233 PolarHBondContact O-ND1 3.33Å; H233-L235 VanDerWaalsContact C-N 3.28Å; H233-L235 PolarHBondContact O-N 3.17Å; H233-H236 HydrophobicContact CB-CB 4.5Å; H233-H236 PolarHBondContact O-N 2.68Å; H233-G237 PolarHBondContact O-N 2.83Å
234R87.6Confident87.8Confident211 Ų21162.8 Ų62.880%0.79634%0.339SS*.Hα-helixtrans-57.8-35.9-174.8-66.7-175179.8-174.3-0113.9Y232 G237 L238Y232-R234 HydrophobicContact CD1-CG 4.21Å; Y232-R234 HydrophobicContact CE1-CG 4.3Å; R234-G237 PolarHBondContact O-N 3.29Å; R234-L238 PolarHBondContact O-N 2.62Å
235L90.3Very high87.9Confident124 Ų12467.7 Ų67.765%0.64937%0.365SS*.Hα-helixtrans-61.2-49178.8-179.463.5000111.6H233 G237 L238 V239H233-L235 VanDerWaalsContact C-N 3.28Å; H233-L235 PolarHBondContact O-N 3.17Å; L235-G237 VanDerWaalsContact C-N 3.29Å; L235-G237 PolarHBondContact O-N 3.24Å; L235-L238 PolarHBondContact O-N 2.87Å; L235-V239 HydrophobicContact CD1-CG2 4.31Å; L235-V239 HydrophobicContact CG-CG2 4.5Å; L235-V239 VanDerWaalsContact O-CG2 3.32Å; L235-V239 WeakPolarHBondContact O-CG2 3.34Å; L235-V239 PolarHBondContact O-N 3.04Å
236H89.9Confident88Confident47 Ų4769 Ų6922%0.21838%0.377CS..Hα-helixtrans-64.2-35.2176.9-75.7-60.5000112.1N222 K226 H233 A240N222-H236 PolarHBondContact OD1-ND1 2.84Å; K226-H236 HydrophobicContact CB-CB 4.11Å; H233-H236 HydrophobicContact CB-CB 4.5Å; H233-H236 PolarHBondContact O-N 2.68Å; H236-A240 VanDerWaalsContact O-CB 3.24Å; H236-A240 WeakPolarHBondContact O-CB 3.5Å; H236-A240 PolarHBondContact O-N 3.35Å
237G87.3Confident88.4Confident3 Ų368.7 Ų68.73%0.03138%0.376CS..Hα-helixtrans-62-45.1171.400000113H233 R234 L235 A240 N241H233-G237 PolarHBondContact O-N 2.83Å; R234-G237 PolarHBondContact O-N 3.29Å; L235-G237 VanDerWaalsContact C-N 3.29Å; L235-G237 PolarHBondContact O-N 3.24Å; G237-A240 PolarHBondContact O-N 2.84Å; G237-N241 PolarHBondContact O-N 2.9Å; G237-N241 VanDerWaalsContact O-N 3.08Å
238L89.3Confident89Confident96 Ų9669 Ų6950%0.50338%0.376SS..Hα-helixtrans-63.8-47.4176.2177.762.4000111.6R234 L235 A240 N241 L242R234-L238 PolarHBondContact O-N 2.62Å; L235-L238 PolarHBondContact O-N 2.87Å; L238-A240 VanDerWaalsContact C-N 3.3Å; L238-A240 PolarHBondContact O-N 3.26Å; L238-N241 PolarHBondContact O-N 3.35Å; L238-L242 HydrophobicContact CD1-CD1 4.15Å; L238-L242 HydrophobicContact CD1-CG 4.2Å; L238-L242 HydrophobicContact CG-CD1 4.1Å; L238-L242 WeakPolarHBondContact O-CG 3.2Å; L238-L242 PolarHBondContact O-N 3.44Å
239V93.6Very high89.5Confident38 Ų3871.1 Ų71.123%0.2339%0.388CS..Hα-helixtrans-62.3-38.1178.2174.70000111.1F218 N222 L235 G243F218-V239 HydrophobicContact CE1-CG1 3.62Å; F218-V239 HydrophobicContact CZ-CG1 4.05Å; N222-V239 HydrophobicContact CB-CG1 4.23Å; N222-V239 VanDerWaalsContact CG-CG1 3.48Å; N222-V239 WeakPolarHBondContact OD1-CG1 3.33Å; L235-V239 HydrophobicContact CD1-CG2 4.31Å; L235-V239 HydrophobicContact CG-CG2 4.5Å; L235-V239 VanDerWaalsContact O-CG2 3.32Å; L235-V239 WeakPolarHBondContact O-CG2 3.34Å; L235-V239 PolarHBondContact O-N 3.04Å; V239-G243 WeakPolarHBondContact O-CA 3.45Å; V239-G243 PolarHBondContact O-N 3.46Å
240A91.5Very high90.4Very high0 Ų069.2 Ų69.20%037%0.369CS..Hα-helixtrans-63.7-42.917500000112.3T219 N222 I223 H236 G237 L238 G243 C244T219-A240 WeakPolarHBondContact CG2-O 3.41Å; N222-A240 HydrophobicContact CB-CB 4.19Å; I223-A240 HydrophobicContact CG1-CB 3.69Å; H236-A240 VanDerWaalsContact O-CB 3.24Å; H236-A240 WeakPolarHBondContact O-CB 3.5Å; H236-A240 PolarHBondContact O-N 3.35Å; G237-A240 PolarHBondContact O-N 2.84Å; L238-A240 VanDerWaalsContact C-N 3.3Å; L238-A240 PolarHBondContact O-N 3.26Å; A240-G243 PolarHBondContact O-N 2.91Å; A240-C244 WeakPolarHBondContact O-CB 3.16Å; A240-C244 PolarHBondContact O-N 2.99Å
241N89.8Confident91.4Very high85 Ų8565.7 Ų65.746%0.45533%0.328SS..Hα-helixtrans-64.7-48177.3-71.1-13.5000111.7G237 L238 G243 C244 L245 L317G237-N241 PolarHBondContact O-N 2.9Å; G237-N241 VanDerWaalsContact O-N 3.08Å; L238-N241 PolarHBondContact O-N 3.35Å; N241-G243 VanDerWaalsContact C-N 3.32Å; N241-G243 PolarHBondContact O-N 3.04Å; N241-C244 WeakPolarHBondContact O-CB 3.2Å; N241-C244 PolarHBondContact O-N 3.48Å; N241-L245 PolarHBondContact O-N 3.27Å; N241-L317 WeakPolarHBondContact OD1-CD1 3.45Å
242L92.1Very high92Very high101 Ų10165.8 Ų65.853%0.52932%0.321SS..Hα-helixtrans-63.2-40.2176.3-66.9177.3000111.4L238 C244 L245 S246L238-L242 HydrophobicContact CD1-CD1 4.15Å; L238-L242 HydrophobicContact CD1-CG 4.2Å; L238-L242 HydrophobicContact CG-CD1 4.1Å; L238-L242 WeakPolarHBondContact O-CG 3.2Å; L238-L242 PolarHBondContact O-N 3.44Å; L242-C244 VanDerWaalsContact C-N 3.34Å; L242-C244 PolarHBondContact O-N 2.96Å; L242-L245 PolarHBondContact O-N 2.96Å; L242-S246 VanDerWaalsContact O-CB 3.29Å; L242-S246 WeakPolarHBondContact O-CB 3.24Å; L242-S246 PolarHBondContact O-N 2.98Å
243G92.9Very high92.6Very high11 Ų1163.3 Ų63.311%0.11331%0.311CS..Hα-helixtrans-60.8-41176.200000112.4T219 V239 A240 N241 S246 F247T219-G243 VanDerWaalsContact OG1-C 3.3Å; T219-G243 WeakPolarHBondContact OG1-CA 3.13Å; T219-G243 PolarHBondContact OG1-O 2.93Å; V239-G243 WeakPolarHBondContact O-CA 3.45Å; V239-G243 PolarHBondContact O-N 3.46Å; A240-G243 PolarHBondContact O-N 2.91Å; N241-G243 VanDerWaalsContact C-N 3.32Å; N241-G243 PolarHBondContact O-N 3.04Å; G243-S246 PolarHBondContact O-N 3.23Å; G243-F247 VanDerWaalsContact O-CB 3.22Å; G243-F247 WeakPolarHBondContact O-CB 3.2Å; G243-F247 PolarHBondContact O-N 2.8Å
244C91.4Very high93Very high18 Ų1862.1 Ų62.112%0.12231%0.305CS..Hα-helixtrans-61.7-45.5175.2-178.60000112.6A240 N241 L242 F247 C248 F305 L317A240-C244 WeakPolarHBondContact O-CB 3.16Å; A240-C244 PolarHBondContact O-N 2.99Å; N241-C244 WeakPolarHBondContact O-CB 3.2Å; N241-C244 PolarHBondContact O-N 3.48Å; L242-C244 VanDerWaalsContact C-N 3.34Å; L242-C244 PolarHBondContact O-N 2.96Å; C244-F247 PolarHBondContact O-N 3.06Å; C244-C248 PolarHBondContact O-N 2.93Å; C244-F305 VanDerWaalsContact SG-CE1 3.52Å; C244-L317 HydrophobicContact CB-CD2 3.96Å
245L92Very high93.5Very high120 Ų12052.3 Ų52.363%0.62827%0.268SS*.Hα-helixtrans-65.8-45.5177.7-64.5176.7000111N241 L242 F247 C248 F249N241-L245 PolarHBondContact O-N 3.27Å; L242-L245 PolarHBondContact O-N 2.96Å; L245-F247 VanDerWaalsContact C-N 3.33Å; L245-F247 PolarHBondContact O-N 2.67Å; L245-C248 PolarHBondContact O-N 2.97Å; L245-F249 PolarHBondContact O-N 3.49Å; L245-F249 VanDerWaalsContact O-N 3.1Å
246S94.2Very high93.8Very high52 Ų5247.6 Ų47.636%0.36424%0.243SC..Hα-helixtrans-58.1-45.1176.2-176.80000111.5Q215 L242 G243 C248 F249 C250Q215-S246 PolarHBondContact OE1-O 2.86Å; Q215-S246 PolarHBondContact OE1-OG 3.44Å; L242-S246 VanDerWaalsContact O-CB 3.29Å; L242-S246 WeakPolarHBondContact O-CB 3.24Å; L242-S246 PolarHBondContact O-N 2.98Å; G243-S246 PolarHBondContact O-N 3.23Å; S246-C248 PolarHBondContact O-N 3.36Å; S246-F249 PolarHBondContact O-N 3.34Å; S246-C250 WeakPolarHBondContact O-CB 3.46Å; S246-C250 PolarHBondContact O-N 3.01Å
247F95.2Very high94.1Very high22 Ų2249 Ų4910%0.09625%0.247CC..Hα-helixtrans-60.4-45.1179168.8-111.4000112S212 Q215 L216 G243 C244 L245 C250 W251 I302S212-F247 WeakPolarHBondContact O-CD2 3.37Å; S212-F247 WeakPolarHBondContact O-CE2 3.44Å; Q215-F247 HydrophobicContact CB-CB 4.37Å; Q215-F247 HydrophobicContact CB-CD2 4.43Å; L216-F247 HydrophobicContact CB-CD2 3.94Å; L216-F247 HydrophobicContact CB-CE2 3.71Å; L216-F247 HydrophobicContact CB-CZ 4.29Å; L216-F247 HydrophobicContact CD1-CD1 4.38Å; L216-F247 HydrophobicContact CD1-CD2 4.46Å; L216-F247 HydrophobicContact CD1-CE1 3.96Å; L216-F247 HydrophobicContact CD1-CE2 4.08Å; L216-F247 HydrophobicContact CD1-CZ 3.81Å; L216-F247 HydrophobicContact CD2-CE2 4.43Å; L216-F247 HydrophobicContact CD2-CZ 4.37Å; L216-F247 HydrophobicContact CG-CE2 4.28Å; L216-F247 HydrophobicContact CG-CZ 4.37Å; G243-F247 VanDerWaalsContact O-CB 3.22Å; G243-F247 WeakPolarHBondContact O-CB 3.2Å; G243-F247 PolarHBondContact O-N 2.8Å; C244-F247 PolarHBondContact O-N 3.06Å; L245-F247 VanDerWaalsContact C-N 3.33Å; L245-F247 PolarHBondContact O-N 2.67Å; F247-C250 PolarHBondContact O-N 3.39Å; F247-W251 AromaticContact CE2-CE3 3.68Å; F247-W251 HydrophobicContact CE2-CE3 3.68Å; F247-W251 HydrophobicContact CE2-CZ3 4.2Å; F247-W251 AromaticContact CZ-CE3 3.7Å; F247-W251 HydrophobicContact CZ-CE3 3.7Å; F247-W251 HydrophobicContact CZ-CZ3 4.12Å; F247-W251 WeakPolarHBondContact O-CB 3.22Å; F247-W251 PolarHBondContact O-N 2.9Å; F247-I302 HydrophobicContact CD1-CG2 4.45Å; F247-I302 HydrophobicContact CE1-CD1 3.52Å; F247-I302 HydrophobicContact CE1-CG1 3.74Å; F247-I302 HydrophobicContact CE1-CG2 4.21Å; F247-I302 HydrophobicContact CZ-CD1 3.52Å; F247-I302 HydrophobicContact CZ-CG1 4.16Å
248C94.9Very high94.5Very high31 Ų3151.3 Ų51.321%0.20926%0.255CS..Hα-helixtrans-60.2-47.9176.8-176.40000111.7C244 L245 S246 W251 F252 I302C244-C248 PolarHBondContact O-N 2.93Å; L245-C248 PolarHBondContact O-N 2.97Å; S246-C248 PolarHBondContact O-N 3.36Å; C248-W251 PolarHBondContact O-N 3.38Å; C248-F252 PolarHBondContact O-N 3.21Å; C248-I302 HydrophobicContact CB-CG2 3.88Å
249F95.6Very high94.8Very high125 Ų12546.7 Ų46.755%0.54823%0.231SC..Hα-helixtrans-62.3-45.9176.9174.8-99.1000112.1L245 S246 W251 F252 W253L245-F249 PolarHBondContact O-N 3.49Å; L245-F249 VanDerWaalsContact O-N 3.1Å; S246-F249 PolarHBondContact O-N 3.34Å; F249-W251 PolarHBondContact O-N 3.28Å; F249-F252 PolarHBondContact O-N 2.71Å; F249-W253 HydrophobicContact CE1-CB 4.38Å; F249-W253 HydrophobicContact CE2-CE3 4.22Å; F249-W253 HydrophobicContact CZ-CB 4.37Å; F249-W253 HydrophobicContact CZ-CD2 4.2Å; F249-W253 HydrophobicContact CZ-CE3 4.08Å; F249-W253 HydrophobicContact CZ-CG 4.34Å; F249-W253 WeakPolarHBondContact O-CB 3.38Å; F249-W253 PolarHBondContact O-N 2.82Å
250C96.9Very high95Very high1 Ų145.3 Ų45.31%0.00722%0.223CC..Hα-helixtrans-61.6-43.7180-178.10000111.8Q215 S246 F247 F252 W253 F254Q215-C250 PolarHBondContact NE2-SG 3.36Å; Q215-C250 VanDerWaalsContact OE1-CB 3.25Å; S246-C250 WeakPolarHBondContact O-CB 3.46Å; S246-C250 PolarHBondContact O-N 3.01Å; F247-C250 PolarHBondContact O-N 3.39Å; C250-F252 PolarHBondContact O-N 2.91Å; C250-W253 PolarHBondContact O-N 3.09Å; C250-F254 WeakPolarHBondContact O-CB 3.27Å; C250-F254 WeakPolarHBondContact O-CD2 3.08Å; C250-F254 PolarHBondContact O-N 3.42Å
251W97.6Very high95.1Very high12 Ų1245.4 Ų45.45%0.04522%0.223CC..Iπ-helixtrans-58.7-49.9176.2-169.1-74.8000111.7F247 C248 F249 R255 L256 N295 W298 F299 I302F247-W251 AromaticContact CE2-CE3 3.68Å; F247-W251 HydrophobicContact CE2-CE3 3.68Å; F247-W251 HydrophobicContact CE2-CZ3 4.2Å; F247-W251 AromaticContact CZ-CE3 3.7Å; F247-W251 HydrophobicContact CZ-CE3 3.7Å; F247-W251 HydrophobicContact CZ-CZ3 4.12Å; F247-W251 WeakPolarHBondContact O-CB 3.22Å; F247-W251 PolarHBondContact O-N 2.9Å; C248-W251 PolarHBondContact O-N 3.38Å; F249-W251 PolarHBondContact O-N 3.28Å; W251-R255 WeakPolarHBondContact O-CB 3.4Å; W251-R255 PolarHBondContact O-N 3.19Å; W251-R255 VanDerWaalsContact O-N 3.08Å; W251-L256 PolarHBondContact O-N 3.1Å; W251-N295 PolarHBondContact NE1-O 3.05Å; W251-W298 HydrophobicContact CH2-CB 3.87Å; W251-W298 HydrophobicContact CH2-CD2 4.35Å; W251-W298 HydrophobicContact CH2-CE3 4.02Å; W251-W298 HydrophobicContact CH2-CG 4.34Å; W251-W298 HydrophobicContact CZ2-CB 3.5Å; W251-W298 VanDerWaalsContact CZ2-CB 3.5Å; W251-W298 HydrophobicContact CZ2-CD2 4.41Å; W251-W298 AromaticContact CZ2-CE3 3.96Å; W251-W298 HydrophobicContact CZ2-CE3 3.96Å; W251-W298 HydrophobicContact CZ2-CG 4.29Å; W251-F299 HydrophobicContact CB-CD2 4.47Å; W251-F299 AromaticContact CD1-CD2 3.42Å; W251-F299 VanDerWaalsContact CD1-CD2 3.42Å; W251-F299 AromaticContact CD1-CG 3.96Å; W251-F299 HydrophobicContact CG-CD2 4.15Å; W251-I302 HydrophobicContact CB-CD1 3.98Å; W251-I302 HydrophobicContact CD2-CD1 3.38Å; W251-I302 HydrophobicContact CE3-CD1 3.65Å; W251-I302 HydrophobicContact CG-CD1 3.54Å; W251-I302 HydrophobicContact CZ3-CD1 4.33Å
252F97Very high95.3Very high93 Ų9342 Ų4241%0.40820%0.204SC..Iπ-helixtrans-59.1-52.2177.2176.1-97.1000111.1C248 F249 C250 L256 Y257 F299C248-F252 PolarHBondContact O-N 3.21Å; F249-F252 PolarHBondContact O-N 2.71Å; C250-F252 PolarHBondContact O-N 2.91Å; F252-L256 HydrophobicContact CD2-CB 4.3Å; F252-L256 HydrophobicContact CD2-CD1 4.23Å; F252-L256 CarbonylContact O-C 3.46Å; F252-L256 WeakPolarHBondContact O-CA 3.33Å; F252-L256 VanDerWaalsContact O-CB 3.31Å; F252-L256 WeakPolarHBondContact O-CB 3.11Å; F252-L256 PolarHBondContact O-N 3.42Å; F252-Y257 PolarHBondContact O-N 2.93Å; F252-F299 HydrophobicContact CB-CE2 3.86Å; F252-F299 HydrophobicContact CB-CZ 4.02Å; F252-F299 HydrophobicContact CD2-CE1 4.24Å; F252-F299 HydrophobicContact CD2-CE2 4.48Å; F252-F299 AromaticContact CD2-CZ 3.86Å; F252-F299 HydrophobicContact CD2-CZ 3.86Å; F252-F299 HydrophobicContact CG-CZ 4.37Å
253W97.3Very high95.5Very high83 Ų8337.2 Ų37.231%0.31418%0.179SC..Iπ-helixtrans-66.8-46.8-172.3-166.7-94.2000113.1F249 C250 Y257 W258F249-W253 HydrophobicContact CE1-CB 4.38Å; F249-W253 HydrophobicContact CE2-CE3 4.22Å; F249-W253 HydrophobicContact CZ-CB 4.37Å; F249-W253 HydrophobicContact CZ-CD2 4.2Å; F249-W253 HydrophobicContact CZ-CE3 4.08Å; F249-W253 HydrophobicContact CZ-CG 4.34Å; F249-W253 WeakPolarHBondContact O-CB 3.38Å; F249-W253 PolarHBondContact O-N 2.82Å; C250-W253 PolarHBondContact O-N 3.09Å; W253-Y257 HydrophobicContact CD2-CD1 4.25Å; W253-Y257 HydrophobicContact CE3-CD1 4.29Å; W253-Y257 HydrophobicContact CH2-CD1 4.26Å; W253-Y257 HydrophobicContact CH2-CE1 4.1Å; W253-Y257 HydrophobicContact CZ2-CD1 4.21Å; W253-Y257 HydrophobicContact CZ2-CE1 4.18Å; W253-Y257 HydrophobicContact CZ3-CD1 4.29Å; W253-Y257 HydrophobicContact CZ3-CE1 4.46Å; W253-Y257 VanDerWaalsContact O-CB 3.31Å; W253-Y257 WeakPolarHBondContact O-CB 3.38Å; W253-W258 AromaticContact CD1-CD2 3.87Å; W253-W258 AromaticContact CD1-CE2 3.84Å; W253-W258 AromaticContact CE2-CE2 3.92Å; W253-W258 AromaticContact CE2-NE1 3.79Å; W253-W258 HydrophobicContact CZ2-CZ2 4.41Å; W253-W258 AromaticContact CZ2-NE1 3.95Å; W253-W258 AromaticContact NE1-CD2 3.6Å; W253-W258 AromaticContact NE1-CE2 3.08Å; W253-W258 AromaticContact NE1-CH2 3.72Å; W253-W258 AromaticContact NE1-CZ2 3.16Å; W253-W258 AromaticContact NE1-NE1 3.39Å; W253-W258 PolarHBondContact O-N 2.99Å
254F97.3Very high95.6Very high32 Ų3237.3 Ų37.314%0.1418%0.177CC..Iπ-helixtrans-84.5-43.3-173.9-72.8-101.2000112.6F207 L208 V211 C250 W258 F259F207-F254 HydrophobicContact CE1-CE1 4.02Å; F207-F254 HydrophobicContact CZ-CE1 4.35Å; L208-F254 HydrophobicContact CD2-CD1 3.8Å; L208-F254 VanDerWaalsContact O-CB 3.24Å; L208-F254 WeakPolarHBondContact O-CB 3.11Å; V211-F254 HydrophobicContact CG1-CB 3.98Å; V211-F254 HydrophobicContact CG1-CD1 3.64Å; V211-F254 HydrophobicContact CG1-CD2 3.94Å; V211-F254 HydrophobicContact CG1-CE1 4.03Å; V211-F254 HydrophobicContact CG1-CE2 4.31Å; V211-F254 HydrophobicContact CG1-CG 3.59Å; V211-F254 HydrophobicContact CG1-CZ 4.36Å; C250-F254 WeakPolarHBondContact O-CB 3.27Å; C250-F254 WeakPolarHBondContact O-CD2 3.08Å; C250-F254 PolarHBondContact O-N 3.42Å; F254-W258 AromaticContact CD1-CE3 3.74Å; F254-W258 HydrophobicContact CD1-CE3 3.74Å; F254-W258 AromaticContact CD1-CZ3 3.98Å; F254-W258 HydrophobicContact CD1-CZ3 3.98Å; F254-W258 AromaticContact CE1-CE3 3.73Å; F254-W258 HydrophobicContact CE1-CE3 3.73Å; F254-W258 AromaticContact CE1-CZ3 3.45Å; F254-W258 HydrophobicContact CE1-CZ3 3.45Å; F254-W258 VanDerWaalsContact CE1-CZ3 3.45Å; F254-W258 HydrophobicContact CG-CE3 4.39Å; F254-W258 HydrophobicContact CZ-CE3 4.35Å; F254-W258 AromaticContact CZ-CZ3 3.84Å; F254-W258 HydrophobicContact CZ-CZ3 3.84Å; F254-F259 WeakPolarHBondContact O-CB 3.21Å; F254-F259 PolarHBondContact O-N 2.79Å
255R97.7Very high95.7Very high4 Ų436.7 Ų36.72%0.01517%0.172CC..Iπ-helixtrans-92.3-31-174.2-61.2-177174.9-137.84.9114H209 S212 D213 W251 F259 N295H209-R255 PolarHBondContact O-NE 3.35Å; H209-R255 PolarHBondContact O-NH2 3.02Å; S212-R255 PolarHBondContact OG-NE 3.29Å; S212-R255 PolarHBondContact OG-NH2 3.46Å; S212-R255 VanDerWaalsContact OG-NH2 3.14Å; D213-R255 IonicContact OD1-NH2 3.32Å; D213-R255 PolarHBondContact OD1-NH2 2.88Å; D213-R255 IonicContact OD2-NH2 3.91Å; D213-R255 PolarHBondContact OD2-NH2 3.16Å; W251-R255 WeakPolarHBondContact O-CB 3.4Å; W251-R255 PolarHBondContact O-N 3.19Å; W251-R255 VanDerWaalsContact O-N 3.08Å; R255-F259 WeakPolarHBondContact O-CB 3.44Å; R255-N295 HydrophobicContact CB-CB 4.39Å; R255-N295 WeakPolarHBondContact CD-OD1 3.43Å; R255-N295 PolarHBondContact NH1-OD1 3.47Å
256L96.6Very high95.7Very high26 Ų2631 Ų3114%0.13614%0.143CC..Iπ-helixtrans-101.5-27.3-179.6-60.2-175000113.7Y19 W251 F252 P260 N295 I296 F299Y19-L256 PolarHBondContact OH-O 3.37Å; W251-L256 PolarHBondContact O-N 3.1Å; F252-L256 HydrophobicContact CD2-CB 4.3Å; F252-L256 HydrophobicContact CD2-CD1 4.23Å; F252-L256 CarbonylContact O-C 3.46Å; F252-L256 WeakPolarHBondContact O-CA 3.33Å; F252-L256 VanDerWaalsContact O-CB 3.31Å; F252-L256 WeakPolarHBondContact O-CB 3.11Å; F252-L256 PolarHBondContact O-N 3.42Å; L256-P260 WeakPolarHBondContact O-CD 3.16Å; L256-P260 WeakPolarHBondContact O-CG 3.43Å; L256-N295 HydrophobicContact CD2-CB 4.21Å; L256-I296 HydrophobicContact CD2-CG1 3.79Å; L256-F299 HydrophobicContact CD1-CB 3.76Å; L256-F299 HydrophobicContact CD1-CD1 3.33Å; L256-F299 HydrophobicContact CD1-CD2 3.97Å; L256-F299 HydrophobicContact CD1-CE1 3.83Å; L256-F299 HydrophobicContact CD1-CE2 4.4Å; L256-F299 HydrophobicContact CD1-CG 3.4Å; L256-F299 VanDerWaalsContact CD1-CG 3.4Å; L256-F299 HydrophobicContact CD1-CZ 4.33Å
257Y95.3Very high95.7Very high76 Ų7628.6 Ų28.630%0.29813%0.126SC..Iπ-helixtrans-98.7-64.7179.2-172.8-108.1000113.2Y19 F252 W253 L261Y19-Y257 AromaticContact CE2-CD2 3.64Å; Y19-Y257 HydrophobicContact CE2-CD2 3.64Å; Y19-Y257 AromaticContact CE2-CE2 3.9Å; Y19-Y257 HydrophobicContact CE2-CE2 3.9Å; Y19-Y257 WeakPolarHBondContact OH-CA 3.18Å; Y19-Y257 PolarHBondContact OH-O 3.36Å; F252-Y257 PolarHBondContact O-N 2.93Å; W253-Y257 HydrophobicContact CD2-CD1 4.25Å; W253-Y257 HydrophobicContact CE3-CD1 4.29Å; W253-Y257 HydrophobicContact CH2-CD1 4.26Å; W253-Y257 HydrophobicContact CH2-CE1 4.1Å; W253-Y257 HydrophobicContact CZ2-CD1 4.21Å; W253-Y257 HydrophobicContact CZ2-CE1 4.18Å; W253-Y257 HydrophobicContact CZ3-CD1 4.29Å; W253-Y257 HydrophobicContact CZ3-CE1 4.46Å; W253-Y257 VanDerWaalsContact O-CB 3.31Å; W253-Y257 WeakPolarHBondContact O-CB 3.38Å; Y257-L261 HydrophobicContact CD2-CD1 4.08Å; Y257-L261 HydrophobicContact CE1-CD1 4.19Å; Y257-L261 HydrophobicContact CE2-CD1 3.64Å; Y257-L261 WeakPolarHBondContact O-CG 3.39Å; Y257-L261 PolarHBondContact O-N 3.31Å
258W96Very high95.6Very high51 Ų5128.1 Ų28.119%0.19313%0.125CC..Iπ-helixtrans-71.3-38.3-176.9-80.2-3.3000114.2F128 L208 W253 F254 L261 K262F128-W258 HydrophobicContact CE2-CZ3 4.37Å; F128-W258 HydrophobicContact CZ-CE3 4.31Å; F128-W258 HydrophobicContact CZ-CH2 4.12Å; F128-W258 AromaticContact CZ-CZ3 3.8Å; F128-W258 HydrophobicContact CZ-CZ3 3.8Å; L208-W258 HydrophobicContact CD1-CB 4.49Å; L208-W258 HydrophobicContact CD2-CB 3.84Å; L208-W258 HydrophobicContact CD2-CD2 4.5Å; L208-W258 HydrophobicContact CD2-CE3 3.78Å; W253-W258 AromaticContact CD1-CD2 3.87Å; W253-W258 AromaticContact CD1-CE2 3.84Å; W253-W258 AromaticContact CE2-CE2 3.92Å; W253-W258 AromaticContact CE2-NE1 3.79Å; W253-W258 HydrophobicContact CZ2-CZ2 4.41Å; W253-W258 AromaticContact CZ2-NE1 3.95Å; W253-W258 AromaticContact NE1-CD2 3.6Å; W253-W258 AromaticContact NE1-CE2 3.08Å; W253-W258 AromaticContact NE1-CH2 3.72Å; W253-W258 AromaticContact NE1-CZ2 3.16Å; W253-W258 AromaticContact NE1-NE1 3.39Å; W253-W258 PolarHBondContact O-N 2.99Å; F254-W258 AromaticContact CD1-CE3 3.74Å; F254-W258 HydrophobicContact CD1-CE3 3.74Å; F254-W258 AromaticContact CD1-CZ3 3.98Å; F254-W258 HydrophobicContact CD1-CZ3 3.98Å; F254-W258 AromaticContact CE1-CE3 3.73Å; F254-W258 HydrophobicContact CE1-CE3 3.73Å; F254-W258 AromaticContact CE1-CZ3 3.45Å; F254-W258 HydrophobicContact CE1-CZ3 3.45Å; F254-W258 VanDerWaalsContact CE1-CZ3 3.45Å; F254-W258 HydrophobicContact CG-CE3 4.39Å; F254-W258 HydrophobicContact CZ-CE3 4.35Å; F254-W258 AromaticContact CZ-CZ3 3.84Å; F254-W258 HydrophobicContact CZ-CZ3 3.84Å; W258-L261 PolarHBondContact O-N 3.22Å; W258-K262 HydrophobicContact CB-CD 4.41Å; W258-K262 HydrophobicContact CG-CD 4.49Å; W258-K262 VanDerWaalsContact O-CB 3.26Å; W258-K262 WeakPolarHBondContact O-CB 3.23Å; W258-K262 WeakPolarHBondContact O-CG 3.35Å; W258-K262 PolarHBondContact O-N 2.65Å
259F96.9Very high95.4Very high0 Ų027.8 Ų27.80%012%0.12CC..Iπ-helixtrans-60.5-49.3-178.9170-112.1000113.1V205 L208 H209 F254 R255 V263 L264 L288 L291 T292V205-F259 HydrophobicContact CG2-CE2 4.04Å; L208-F259 HydrophobicContact CD1-CB 4.05Å; L208-F259 HydrophobicContact CD1-CD2 4.45Å; H209-F259 AromaticContact CE1-CD2 3.53Å; H209-F259 AromaticContact CE1-CE2 3.68Å; H209-F259 AromaticContact CE1-CG 3.79Å; F254-F259 WeakPolarHBondContact O-CB 3.21Å; F254-F259 PolarHBondContact O-N 2.79Å; R255-F259 WeakPolarHBondContact O-CB 3.44Å; F259-V263 HydrophobicContact CD2-CB 3.66Å; F259-V263 HydrophobicContact CD2-CG1 4.13Å; F259-V263 HydrophobicContact CD2-CG2 3.79Å; F259-V263 HydrophobicContact CE2-CB 3.74Å; F259-V263 HydrophobicContact CE2-CG1 3.68Å; F259-V263 HydrophobicContact CE2-CG2 4.16Å; F259-V263 WeakPolarHBondContact O-CA 3.5Å; F259-V263 VanDerWaalsContact O-CB 3.28Å; F259-V263 WeakPolarHBondContact O-CB 3.26Å; F259-V263 PolarHBondContact O-N 3.25Å; F259-L264 PolarHBondContact O-N 3.38Å; F259-L288 HydrophobicContact CE2-CD2 4.26Å; F259-L288 HydrophobicContact CZ-CD2 4.12Å; F259-L291 HydrophobicContact CZ-CD2 4.17Å; F259-T292 VanDerWaalsContact CE1-OG1 3.31Å; F259-T292 WeakPolarHBondContact CE1-OG1 3.48Å
260P95.8Very high95.1Very high8 Ų822.2 Ų22.25%0.05210%0.097CC..Iπ-helixtrans-61.1-48.3173.9-27.137.9000112.9Y19 M22 L256 K262 L264 Y265Y19-P260 HydrophobicContact CE1-CB 4.05Å; Y19-P260 HydrophobicContact CE1-CG 4.38Å; M22-P260 HydrophobicContact CE-CB 4.07Å; M22-P260 HydrophobicContact SD-CB 3.77Å; L256-P260 WeakPolarHBondContact O-CD 3.16Å; L256-P260 WeakPolarHBondContact O-CG 3.43Å; P260-K262 PolarHBondContact O-N 2.83Å; P260-L264 HydrophobicContact CB-CD1 4.1Å; P260-L264 HydrophobicContact CG-CD1 4.46Å; P260-L264 WeakPolarHBondContact O-CB 3.4Å; P260-L264 PolarHBondContact O-N 2.93Å; P260-Y265 PolarHBondContact O-N 2.92Å
261L93.6Very high94.8Very high3 Ų322.2 Ų22.22%0.01610%0.097CC..Iπ-helixtrans-70.8-31.6-173.2-65.1-178.2000114.2P17 Y19 M22 Y257 W258 Y265P17-L261 WeakPolarHBondContact O-CD2 3.22Å; Y19-L261 HydrophobicContact CD2-CD1 4.39Å; Y19-L261 HydrophobicContact CD2-CD2 4.05Å; Y19-L261 HydrophobicContact CD2-CG 4.42Å; Y19-L261 HydrophobicContact CE2-CD1 3.83Å; Y19-L261 HydrophobicContact CE2-CD2 3.91Å; Y19-L261 HydrophobicContact CE2-CG 3.81Å; Y19-L261 HydrophobicContact CG-CD2 4.48Å; M22-L261 HydrophobicContact CB-CD2 4.3Å; M22-L261 HydrophobicContact SD-CD2 4.06Å; Y257-L261 HydrophobicContact CD2-CD1 4.08Å; Y257-L261 HydrophobicContact CE1-CD1 4.19Å; Y257-L261 HydrophobicContact CE2-CD1 3.64Å; Y257-L261 WeakPolarHBondContact O-CG 3.39Å; Y257-L261 PolarHBondContact O-N 3.31Å; W258-L261 PolarHBondContact O-N 3.22Å; L261-Y265 WeakPolarHBondContact O-CB 3.28Å
262K94.3Very high94.5Very high13 Ų1323.1 Ų23.16%0.05710%0.102CC..Iπ-helixtrans-94.5-48.8179.4-64.8-175.4171.3-72.90111.9M16 F128 P131 W258 P260 A266M16-K262 HydrophobicContact SD-CG 4.06Å; F128-K262 PolarHBondContact O-NZ 2.95Å; P131-K262 HydrophobicContact CB-CB 4.16Å; P131-K262 WeakPolarHBondContact CB-O 3.45Å; P131-K262 HydrophobicContact CG-CB 3.98Å; P131-K262 HydrophobicContact CG-CD 4.4Å; P131-K262 HydrophobicContact CG-CG 3.8Å; W258-K262 HydrophobicContact CB-CD 4.41Å; W258-K262 HydrophobicContact CG-CD 4.49Å; W258-K262 VanDerWaalsContact O-CB 3.26Å; W258-K262 WeakPolarHBondContact O-CB 3.23Å; W258-K262 WeakPolarHBondContact O-CG 3.35Å; W258-K262 PolarHBondContact O-N 2.65Å; P260-K262 PolarHBondContact O-N 2.83Å; K262-A266 WeakPolarHBondContact O-CB 3.48Å
263V96.4Very high94.1Very high1 Ų127.6 Ų27.61%0.00612%0.117CC..Iπ-helixtrans-87.6-58.5-173.5178.20000111.2V201 L204 V205 L208 F259 Y265 A266 T267 L288V201-V263 HydrophobicContact CG1-CG1 3.79Å; L204-V263 HydrophobicContact CB-CG2 3.83Å; L204-V263 HydrophobicContact CD1-CG2 4.42Å; V205-V263 HydrophobicContact CG2-CG1 3.93Å; V205-V263 HydrophobicContact CG2-CG2 4.25Å; L208-V263 HydrophobicContact CD1-CG2 3.96Å; F259-V263 HydrophobicContact CD2-CB 3.66Å; F259-V263 HydrophobicContact CD2-CG1 4.13Å; F259-V263 HydrophobicContact CD2-CG2 3.79Å; F259-V263 HydrophobicContact CE2-CB 3.74Å; F259-V263 HydrophobicContact CE2-CG1 3.68Å; F259-V263 HydrophobicContact CE2-CG2 4.16Å; F259-V263 WeakPolarHBondContact O-CA 3.5Å; F259-V263 VanDerWaalsContact O-CB 3.28Å; F259-V263 WeakPolarHBondContact O-CB 3.26Å; F259-V263 PolarHBondContact O-N 3.25Å; V263-Y265 VanDerWaalsContact C-N 3.31Å; V263-Y265 PolarHBondContact O-N 3.31Å; V263-A266 PolarHBondContact O-N 2.96Å; V263-A266 VanDerWaalsContact O-N 3.13Å; V263-T267 HydrophobicContact CG1-CG2 4.24Å; V263-T267 WeakPolarHBondContact O-CG2 3.29Å; V263-T267 PolarHBondContact O-N 2.85Å; V263-T267 PolarHBondContact O-OG1 2.9Å; V263-T267 VanDerWaalsContact O-OG1 3.13Å; V263-L288 HydrophobicContact CG1-CD1 4.12Å; V263-L288 HydrophobicContact CG1-CD2 4.41Å
264L95.3Very high93.6Very high12 Ų1226 Ų266%0.06312%0.118CC..Iπ-helixtrans-63.3-37.9-176.9-67.8179.2000112.1F259 P260 T267 C268 L288 L289F259-L264 PolarHBondContact O-N 3.38Å; P260-L264 HydrophobicContact CB-CD1 4.1Å; P260-L264 HydrophobicContact CG-CD1 4.46Å; P260-L264 WeakPolarHBondContact O-CB 3.4Å; P260-L264 PolarHBondContact O-N 2.93Å; L264-T267 PolarHBondContact O-N 3.45Å; L264-T267 PolarHBondContact O-OG1 3.44Å; L264-C268 WeakPolarHBondContact O-CB 2.98Å; L264-C268 PolarHBondContact O-N 3.13Å; L264-C268 PolarHBondContact O-SG 3.19Å; L264-C268 VanDerWaalsContact O-SG 3.35Å; L264-L288 HydrophobicContact CD2-CB 3.68Å; L264-L288 HydrophobicContact CD2-CD1 4.44Å; L264-L289 HydrophobicContact CD1-CD2 4.14Å; L264-L289 HydrophobicContact CD2-CD2 4.29Å
265Y93.4Very high93.2Very high6 Ų625.7 Ų25.72%0.02412%0.119CC..Hα-helixtrans-60.8-47.9173.9-178.3-113.3000111.7E14 P17 M22 R25 P260 L261 V263 T267 H269 S270E14-Y265 PolarHBondContact OE2-OH 2.69Å; P17-Y265 HydrophobicContact CB-CD2 4.5Å; P17-Y265 HydrophobicContact CB-CE2 4.28Å; P17-Y265 HydrophobicContact CG-CD1 3.91Å; P17-Y265 HydrophobicContact CG-CD2 3.71Å; P17-Y265 HydrophobicContact CG-CE1 4.06Å; P17-Y265 HydrophobicContact CG-CE2 3.86Å; P17-Y265 HydrophobicContact CG-CG 3.72Å; M22-Y265 HydrophobicContact CB-CD2 4.43Å; M22-Y265 HydrophobicContact CG-CD2 4.15Å; R25-Y265 HydrophobicContact CB-CE2 4.49Å; R25-Y265 PolarHBondContact NH1-OH 3.37Å; P260-Y265 PolarHBondContact O-N 2.92Å; L261-Y265 WeakPolarHBondContact O-CB 3.28Å; V263-Y265 VanDerWaalsContact C-N 3.31Å; V263-Y265 PolarHBondContact O-N 3.31Å; Y265-T267 VanDerWaalsContact C-N 3.35Å; Y265-T267 PolarHBondContact O-N 3.13Å; Y265-H269 HydrophobicContact CD2-CB 4.09Å; Y265-H269 HydrophobicContact CE2-CB 3.98Å; Y265-H269 AromaticContact CE2-CD2 3.62Å; Y265-H269 AromaticContact CZ-CD2 3.68Å; Y265-H269 WeakPolarHBondContact O-CB 3.43Å; Y265-H269 PolarHBondContact O-N 3.34Å; Y265-H269 PolarHBondContact OH-CD2 3.02Å; Y265-S270 PolarHBondContact O-N 2.86Å
266A93.1Very high92.7Very high1 Ų129.8 Ų29.81%0.00815%0.146CC..Iπ-helixtrans-63-41.7-179.700000111.6P131 V134 F135 K262 V263 S270 S271P131-A266 HydrophobicContact CB-CB 4.47Å; V134-A266 HydrophobicContact CG2-CB 3.9Å; F135-A266 WeakPolarHBondContact CE2-O 3.18Å; K262-A266 WeakPolarHBondContact O-CB 3.48Å; V263-A266 PolarHBondContact O-N 2.96Å; V263-A266 VanDerWaalsContact O-N 3.13Å; A266-S270 CarbonylContact O-C 3.44Å; A266-S270 WeakPolarHBondContact O-CB 3.49Å; A266-S270 PolarHBondContact O-N 3.24Å; A266-S271 PolarHBondContact O-N 3.24Å
267T94.1Very high92.1Very high1 Ų136 Ų361%0.00618%0.179CC..Iπ-helixtrans-83.5-27.6-176.162.70000114.5F135 V201 V263 L264 Y265 S271 Y281 F284 N285 L288F135-T267 HydrophobicContact CE2-CG2 4.11Å; F135-T267 HydrophobicContact CZ-CG2 4.07Å; V201-T267 HydrophobicContact CB-CG2 4.48Å; V201-T267 HydrophobicContact CG1-CG2 3.61Å; V201-T267 HydrophobicContact CG2-CG2 4.04Å; V263-T267 HydrophobicContact CG1-CG2 4.24Å; V263-T267 WeakPolarHBondContact O-CG2 3.29Å; V263-T267 PolarHBondContact O-N 2.85Å; V263-T267 PolarHBondContact O-OG1 2.9Å; V263-T267 VanDerWaalsContact O-OG1 3.13Å; L264-T267 PolarHBondContact O-N 3.45Å; L264-T267 PolarHBondContact O-OG1 3.44Å; Y265-T267 VanDerWaalsContact C-N 3.35Å; Y265-T267 PolarHBondContact O-N 3.13Å; T267-S271 PolarHBondContact O-OG 3.5Å; T267-Y281 WeakPolarHBondContact O-CE2 3.42Å; T267-F284 HydrophobicContact CG2-CE1 4.16Å; T267-N285 VanDerWaalsContact C-OD1 3.29Å; T267-N285 WeakPolarHBondContact CB-OD1 3.45Å; T267-N285 PolarHBondContact O-ND2 3.4Å; T267-N285 PolarHBondContact O-OD1 3Å; T267-N285 PolarHBondContact OG1-OD1 3.21Å; T267-L288 HydrophobicContact CG2-CD1 3.85Å
268C92.6Very high91.7Very high12 Ų1233 Ų338%0.08117%0.168CC..Iπ-helixtrans-90.5-34.6179.3-68.10000112.3S26 S29 L264 Y281 N285S26-C268 WeakPolarHBondContact OG-CB 3.45Å; S29-C268 WeakPolarHBondContact CB-O 3.47Å; L264-C268 WeakPolarHBondContact O-CB 2.98Å; L264-C268 PolarHBondContact O-N 3.13Å; L264-C268 PolarHBondContact O-SG 3.19Å; L264-C268 VanDerWaalsContact O-SG 3.35Å; C268-Y281 PolarHBondContact O-OH 2.88Å; C268-N285 PolarHBondContact SG-OD1 3.13Å
269H90.2Very high91.4Very high24 Ų2431.3 Ų31.311%0.11116%0.164CC..Iπ-helixtrans-112.9-59.5-174.1-176.566000112.7S29 Y265 S271 L272 R273S29-H269 PolarHBondContact OG-ND1 3.16Å; Y265-H269 HydrophobicContact CD2-CB 4.09Å; Y265-H269 HydrophobicContact CE2-CB 3.98Å; Y265-H269 AromaticContact CE2-CD2 3.62Å; Y265-H269 AromaticContact CZ-CD2 3.68Å; Y265-H269 WeakPolarHBondContact O-CB 3.43Å; Y265-H269 PolarHBondContact O-N 3.34Å; Y265-H269 PolarHBondContact OH-CD2 3.02Å; H269-S271 VanDerWaalsContact C-N 3.29Å; H269-S271 PolarHBondContact O-N 2.96Å; H269-L272 PolarHBondContact O-N 3.31Å; H269-R273 WeakPolarHBondContact O-CG 3.48Å; H269-R273 PolarHBondContact O-N 3.39Å
270S89.6Confident91Very high7 Ų733.9 Ų33.95%0.04917%0.174CC..Iπ-helixtrans-64.7-33.7-173.6-530000112.5Y265 A266 L272 R273 S274Y265-S270 PolarHBondContact O-N 2.86Å; A266-S270 CarbonylContact O-C 3.44Å; A266-S270 WeakPolarHBondContact O-CB 3.49Å; A266-S270 PolarHBondContact O-N 3.24Å; S270-L272 VanDerWaalsContact C-N 3.33Å; S270-L272 PolarHBondContact O-N 3.39Å; S270-R273 WeakPolarHBondContact O-CB 3.5Å; S270-R273 PolarHBondContact O-N 2.88Å; S270-S274 PolarHBondContact O-N 2.92Å; S270-S274 PolarHBondContact O-OG 2.82Å
271S91.8Very high90.8Very high1 Ų134.3 Ų34.31%0.00718%0.175CC..Hα-helixtrans-56.4-45.1179.571.40000112.6F135 A266 T267 H269 R273 S274 V275F135-S271 VanDerWaalsContact CE2-CB 3.46Å; A266-S271 PolarHBondContact O-N 3.24Å; T267-S271 PolarHBondContact O-OG 3.5Å; H269-S271 VanDerWaalsContact C-N 3.29Å; H269-S271 PolarHBondContact O-N 2.96Å; S271-R273 VanDerWaalsContact C-N 3.29Å; S271-R273 PolarHBondContact O-N 2.85Å; S271-S274 PolarHBondContact O-N 3.46Å; S271-V275 CarbonylContact O-C 3.52Å; S271-V275 WeakPolarHBondContact O-CA 3.28Å; S271-V275 PolarHBondContact O-N 2.97Å
272L89.8Confident90.7Very high32 Ų3238.5 Ų38.517%0.16819%0.193CC..Hα-helixtrans-75.8-19.5-179.6-68.5172.2000112.4A33 H269 S270 P276 I278 Y281A33-L272 HydrophobicContact CB-CD1 3.95Å; H269-L272 PolarHBondContact O-N 3.31Å; S270-L272 VanDerWaalsContact C-N 3.33Å; S270-L272 PolarHBondContact O-N 3.39Å; L272-P276 WeakPolarHBondContact CD2-O 3.39Å; L272-P276 WeakPolarHBondContact O-CA 3.28Å; L272-I278 HydrophobicContact CD2-CG2 3.93Å; L272-Y281 HydrophobicContact CD1-CD2 4.17Å; L272-Y281 HydrophobicContact CD1-CE1 4.09Å; L272-Y281 HydrophobicContact CD1-CE2 3.57Å; L272-Y281 HydrophobicContact CD2-CD2 4.02Å; L272-Y281 HydrophobicContact CD2-CE2 4.24Å; L272-Y281 HydrophobicContact CD2-CG 4.31Å; L272-Y281 HydrophobicContact CG-CD2 3.94Å; L272-Y281 HydrophobicContact CG-CE2 3.68Å
273R89.1Confident90.7Very high187 Ų18742.2 Ų42.271%0.70621%0.209SC*.Hα-helixtrans-80.1-40.1174.6-65.6-84.3-99.5140.60.7110.7H269 S270 S271H269-R273 WeakPolarHBondContact O-CG 3.48Å; H269-R273 PolarHBondContact O-N 3.39Å; S270-R273 WeakPolarHBondContact O-CB 3.5Å; S270-R273 PolarHBondContact O-N 2.88Å; S271-R273 VanDerWaalsContact C-N 3.29Å; S271-R273 PolarHBondContact O-N 2.85Å
274S87.9Confident90.6Very high50 Ų5042.4 Ų42.435%0.3521%0.21SC..Hα-helixtrans-80.2-38.2177.9-58.10000112.5S270 S271S270-S274 PolarHBondContact O-N 2.92Å; S270-S274 PolarHBondContact O-OG 2.82Å; S271-S274 PolarHBondContact O-N 3.46Å
275V88.9Confident90.7Very high24 Ų2442.3 Ų42.315%0.14521%0.209CC..  trans-138.790.9-176.9-172.70000108.8W138 S271 D277 I278W138-V275 HydrophobicContact CB-CG2 4.14Å; W138-V275 HydrophobicContact CE3-CB 4.49Å; W138-V275 HydrophobicContact CE3-CG1 3.76Å; W138-V275 HydrophobicContact CE3-CG2 4.04Å; W138-V275 HydrophobicContact CZ3-CG1 3.93Å; S271-V275 CarbonylContact O-C 3.52Å; S271-V275 WeakPolarHBondContact O-CA 3.28Å; S271-V275 PolarHBondContact O-N 2.97Å; V275-D277 VanDerWaalsContact C-N 3.32Å; V275-D277 PolarHBondContact O-N 2.94Å; V275-I278 HydrophobicContact CB-CB 4.08Å; V275-I278 HydrophobicContact CB-CG1 4.44Å; V275-I278 HydrophobicContact CG1-CB 3.92Å; V275-I278 HydrophobicContact CG1-CG1 4.32Å; V275-I278 WeakPolarHBondContact O-CB 3.39Å; V275-I278 PolarHBondContact O-N 3.4Å
276P85.1Confident90.8Very high91 Ų9145.6 Ų45.659%0.59123%0.23SC*.THydrogen-bonded Turntrans-55.7-40.7-175-29.636.8000114.6L272L272-P276 WeakPolarHBondContact CD2-O 3.39Å; L272-P276 WeakPolarHBondContact O-CA 3.28Å
277D84.1Confident91Very high157 Ų15746.5 Ų46.584%0.8424%0.235SC*.THydrogen-bonded Turntrans-102.944.3-179.3-60.1-50000112V275V275-D277 VanDerWaalsContact C-N 3.32Å; V275-D277 PolarHBondContact O-N 2.94Å
278I88.6Confident91.2Very high13 Ų1346.5 Ų46.57%0.06724%0.235CC..  trans-63.8127.7-178.9-165.1173.3000111.1F135 Y198 L272 V275 Y281F135-I278 HydrophobicContact CD1-CD1 3.58Å; F135-I278 HydrophobicContact CE1-CD1 3.36Å; F135-I278 HydrophobicContact CG-CD1 4.47Å; F135-I278 HydrophobicContact CZ-CD1 4.12Å; Y198-I278 HydrophobicContact CE1-CD1 3.69Å; Y198-I278 HydrophobicContact CE1-CG1 3.92Å; Y198-I278 VanDerWaalsContact OH-CG1 3.22Å; Y198-I278 WeakPolarHBondContact OH-CG1 3.48Å; L272-I278 HydrophobicContact CD2-CG2 3.93Å; V275-I278 HydrophobicContact CB-CB 4.08Å; V275-I278 HydrophobicContact CB-CG1 4.44Å; V275-I278 HydrophobicContact CG1-CB 3.92Å; V275-I278 HydrophobicContact CG1-CG1 4.32Å; V275-I278 WeakPolarHBondContact O-CB 3.39Å; V275-I278 PolarHBondContact O-N 3.4Å; I278-Y281 HydrophobicContact CG2-CD2 4Å; I278-Y281 HydrophobicContact CG2-CG 4.35Å
279P88.7Confident91.4Very high14 Ų1450.1 Ų50.19%0.09125%0.253CS..THydrogen-bonded Turntrans-67.5148-172.825.8-33.6000111.7H52 W138 Y198 Y281H52-P279 HydrophobicContact CB-CB 4.27Å; H52-P279 HydrophobicContact CB-CG 4.27Å; W138-P279 HydrophobicContact CH2-CG 3.48Å; W138-P279 VanDerWaalsContact CH2-CG 3.48Å; W138-P279 HydrophobicContact CZ2-CG 3.76Å; Y198-P279 WeakPolarHBondContact OH-CD 3.22Å; Y198-P279 WeakPolarHBondContact OH-CG 3.37Å; Y198-P279 PolarHBondContact OH-O 3.22Å; P279-Y281 PolarHBondContact O-N 3.02Å
280Y89.5Confident91.7Very high54 Ų5452.2 Ų52.221%0.21226%0.264CS..THydrogen-bonded Turntrans54.624.2174.4-64.9-80.3000116.8A45 L49 F196 F282 F283 F284A45-Y280 PolarHBondContact O-OH 3.29Å; L49-Y280 WeakPolarHBondContact CA-OH 3.46Å; L49-Y280 WeakPolarHBondContact CB-OH 3.44Å; L49-Y280 HydrophobicContact CD1-CE2 4.46Å; L49-Y280 PolarHBondContact N-OH 2.92Å; F196-Y280 AromaticContact CD1-CD2 3.91Å; F196-Y280 HydrophobicContact CD1-CD2 3.91Å; F196-Y280 HydrophobicContact CD1-CE2 4.28Å; F196-Y280 HydrophobicContact CD2-CD2 4.14Å; F196-Y280 HydrophobicContact CD2-CG 4.28Å; F196-Y280 AromaticContact CE1-CD2 3.36Å; F196-Y280 HydrophobicContact CE1-CD2 3.36Å; F196-Y280 AromaticContact CE1-CE2 3.45Å; F196-Y280 HydrophobicContact CE1-CE2 3.45Å; F196-Y280 VanDerWaalsContact CE1-CE2 3.45Å; F196-Y280 HydrophobicContact CE1-CG 4.17Å; F196-Y280 HydrophobicContact CE2-CD1 4.29Å; F196-Y280 AromaticContact CE2-CD2 3.62Å; F196-Y280 HydrophobicContact CE2-CD2 3.62Å; F196-Y280 HydrophobicContact CE2-CE2 4.35Å; F196-Y280 AromaticContact CE2-CG 3.58Å; F196-Y280 HydrophobicContact CE2-CG 3.58Å; F196-Y280 HydrophobicContact CG-CD2 4.28Å; F196-Y280 HydrophobicContact CZ-CD1 4.08Å; F196-Y280 AromaticContact CZ-CD2 3.2Å; F196-Y280 HydrophobicContact CZ-CD2 3.2Å; F196-Y280 HydrophobicContact CZ-CE1 4.3Å; F196-Y280 AromaticContact CZ-CE2 3.5Å; F196-Y280 HydrophobicContact CZ-CE2 3.5Å; F196-Y280 VanDerWaalsContact CZ-CE2 3.5Å; F196-Y280 AromaticContact CZ-CG 3.52Å; F196-Y280 HydrophobicContact CZ-CG 3.52Å; Y280-F282 PolarHBondContact O-N 3.42Å; Y280-F283 HydrophobicContact CD1-CB 4.26Å; Y280-F283 PolarHBondContact O-N 3.05Å; Y280-F283 VanDerWaalsContact O-N 3.16Å; Y280-F284 PolarHBondContact O-N 3.19Å
281Y91.4Very high92.1Very high18 Ų1852 Ų527%0.07126%0.262CS..Hα-helixtrans-45.8-54.4178.7171.9-98.5000113.4A33 T267 C268 L272 I278 P279 N285A33-Y281 HydrophobicContact CB-CE1 4.45Å; T267-Y281 WeakPolarHBondContact O-CE2 3.42Å; C268-Y281 PolarHBondContact O-OH 2.88Å; L272-Y281 HydrophobicContact CD1-CD2 4.17Å; L272-Y281 HydrophobicContact CD1-CE1 4.09Å; L272-Y281 HydrophobicContact CD1-CE2 3.57Å; L272-Y281 HydrophobicContact CD2-CD2 4.02Å; L272-Y281 HydrophobicContact CD2-CE2 4.24Å; L272-Y281 HydrophobicContact CD2-CG 4.31Å; L272-Y281 HydrophobicContact CG-CD2 3.94Å; L272-Y281 HydrophobicContact CG-CE2 3.68Å; I278-Y281 HydrophobicContact CG2-CD2 4Å; I278-Y281 HydrophobicContact CG2-CG 4.35Å; P279-Y281 PolarHBondContact O-N 3.02Å; Y281-N285 WeakPolarHBondContact CD2-ND2 3.17Å; Y281-N285 WeakPolarHBondContact CE2-ND2 3.34Å; Y281-N285 WeakPolarHBondContact O-CB 3.23Å; Y281-N285 PolarHBondContact O-N 3.28Å; Y281-N285 PolarHBondContact O-ND2 3.33Å
282F92.1Very high92.4Very high91 Ų9152.8 Ų52.840%0.39927%0.267SS..Hα-helixtrans-67.7-39.7-176.9-70.7-70.1000112.5A33 A34 Y280 T286A33-F282 HydrophobicContact CB-CE2 4.26Å; A33-F282 HydrophobicContact CB-CZ 3.78Å; A34-F282 HydrophobicContact CB-CE1 4.48Å; A34-F282 HydrophobicContact CB-CZ 4Å; Y280-F282 PolarHBondContact O-N 3.42Å; F282-T286 VanDerWaalsContact O-CB 3.24Å; F282-T286 WeakPolarHBondContact O-CB 3.49Å; F282-T286 PolarHBondContact O-N 3.29Å; F282-T286 PolarHBondContact O-OG1 3.38Å
283F93.3Very high92.7Very high90 Ų9055.9 Ų55.940%0.39529%0.287SS..Hα-helixtrans-61.5-51.3178.7169.2-99.5000110.8V188 F196 Y280 T286 L287V188-F283 HydrophobicContact CG1-CE1 4.44Å; V188-F283 HydrophobicContact CG1-CZ 3.72Å; F196-F283 HydrophobicContact CE2-CD1 4.35Å; F196-F283 HydrophobicContact CE2-CE1 4.43Å; Y280-F283 HydrophobicContact CD1-CB 4.26Å; Y280-F283 PolarHBondContact O-N 3.05Å; Y280-F283 VanDerWaalsContact O-N 3.16Å; F283-T286 PolarHBondContact O-N 3.27Å; F283-L287 HydrophobicContact CD1-CD1 4.28Å; F283-L287 HydrophobicContact CE1-CD1 3.68Å; F283-L287 HydrophobicContact CE2-CD1 4.04Å; F283-L287 HydrophobicContact CZ-CD1 3.56Å; F283-L287 WeakPolarHBondContact O-CG 3.36Å; F283-L287 PolarHBondContact O-N 3.46Å
284F94.9Very high93.1Very high5 Ų547.9 Ų47.92%0.02226%0.258CS..Hα-helixtrans-66.2-45.4-177.1-168.4-107.4000112.1L189 Y198 V201 T267 Y280 T286 L287 L288L189-F284 HydrophobicContact CD2-CD2 3.96Å; L189-F284 HydrophobicContact CD2-CE2 3.63Å; L189-F284 HydrophobicContact CD2-CZ 4.17Å; Y198-F284 HydrophobicContact CD2-CD1 4.01Å; Y198-F284 HydrophobicContact CD2-CD2 4.21Å; Y198-F284 HydrophobicContact CD2-CE1 4.15Å; Y198-F284 HydrophobicContact CD2-CE2 4.38Å; Y198-F284 HydrophobicContact CD2-CG 4.03Å; Y198-F284 HydrophobicContact CD2-CZ 4.34Å; Y198-F284 HydrophobicContact CE2-CG 4.36Å; V201-F284 HydrophobicContact CG1-CE1 4.04Å; V201-F284 HydrophobicContact CG1-CZ 4.3Å; T267-F284 HydrophobicContact CG2-CE1 4.16Å; Y280-F284 PolarHBondContact O-N 3.19Å; F284-T286 VanDerWaalsContact C-N 3.34Å; F284-T286 PolarHBondContact O-N 3.29Å; F284-L287 PolarHBondContact O-N 2.72Å; F284-L288 HydrophobicContact CD1-CD1 3.89Å; F284-L288 HydrophobicContact CD1-CG 4.5Å; F284-L288 HydrophobicContact CE1-CD1 3.61Å; F284-L288 HydrophobicContact CE1-CG 4.26Å; F284-L288 HydrophobicContact CZ-CD1 4.33Å; F284-L288 PolarHBondContact O-N 2.98Å; F284-L288 VanDerWaalsContact O-N 3.12Å
285N95.8Very high93.5Very high10 Ų1045.5 Ų45.55%0.05324%0.242CC..Hα-helixtrans-66.3-34.1177.8-77.1-63.5000112.9T267 C268 Y281 L287 L288 L289T267-N285 VanDerWaalsContact C-OD1 3.29Å; T267-N285 WeakPolarHBondContact CB-OD1 3.45Å; T267-N285 PolarHBondContact O-ND2 3.4Å; T267-N285 PolarHBondContact O-OD1 3Å; T267-N285 PolarHBondContact OG1-OD1 3.21Å; C268-N285 PolarHBondContact SG-OD1 3.13Å; Y281-N285 WeakPolarHBondContact CD2-ND2 3.17Å; Y281-N285 WeakPolarHBondContact CE2-ND2 3.34Å; Y281-N285 WeakPolarHBondContact O-CB 3.23Å; Y281-N285 PolarHBondContact O-N 3.28Å; Y281-N285 PolarHBondContact O-ND2 3.33Å; N285-L287 VanDerWaalsContact C-N 3.35Å; N285-L287 PolarHBondContact O-N 3.02Å; N285-L288 PolarHBondContact O-N 2.89Å; N285-L289 VanDerWaalsContact O-CG 3.29Å; N285-L289 WeakPolarHBondContact O-CG 3.45Å; N285-L289 PolarHBondContact O-N 3.16Å
286T96.1Very high93.9Very high76 Ų7648.2 Ų48.247%0.46625%0.254SS..Hα-helixtrans-62.3-43.5174.9-61.30000111.2F282 F283 F284 L288 L289 I290F282-T286 VanDerWaalsContact O-CB 3.24Å; F282-T286 WeakPolarHBondContact O-CB 3.49Å; F282-T286 PolarHBondContact O-N 3.29Å; F282-T286 PolarHBondContact O-OG1 3.38Å; F283-T286 PolarHBondContact O-N 3.27Å; F284-T286 VanDerWaalsContact C-N 3.34Å; F284-T286 PolarHBondContact O-N 3.29Å; T286-L288 PolarHBondContact O-N 2.65Å; T286-L289 PolarHBondContact O-N 3.2Å; T286-I290 HydrophobicContact CG2-CD1 4.11Å; T286-I290 WeakPolarHBondContact O-CG1 3.34Å; T286-I290 PolarHBondContact O-N 3.26Å
287L97.4Very high94.4Very high20 Ų2047.5 Ų47.511%0.10524%0.24CC..Hα-helixtrans-63.9-40.1176.7-67.3172.9000112.3V185 V188 L189 F283 F284 N285 I290 L291V185-L287 HydrophobicContact CG1-CD2 4.3Å; V188-L287 HydrophobicContact CB-CD1 4.47Å; V188-L287 HydrophobicContact CG1-CD1 3.65Å; L189-L287 HydrophobicContact CD1-CB 4.24Å; L189-L287 HydrophobicContact CD2-CB 3.49Å; L189-L287 VanDerWaalsContact CD2-CB 3.49Å; L189-L287 HydrophobicContact CD2-CD1 4.16Å; L189-L287 HydrophobicContact CG-CB 3.74Å; L189-L287 HydrophobicContact CG-CD1 4.25Å; F283-L287 HydrophobicContact CD1-CD1 4.28Å; F283-L287 HydrophobicContact CE1-CD1 3.68Å; F283-L287 HydrophobicContact CE2-CD1 4.04Å; F283-L287 HydrophobicContact CZ-CD1 3.56Å; F283-L287 WeakPolarHBondContact O-CG 3.36Å; F283-L287 PolarHBondContact O-N 3.46Å; F284-L287 PolarHBondContact O-N 2.72Å; N285-L287 VanDerWaalsContact C-N 3.35Å; N285-L287 PolarHBondContact O-N 3.02Å; L287-I290 PolarHBondContact O-N 3.27Å; L287-L291 PolarHBondContact O-N 2.99Å
288L97.7Very high94.9Very high1 Ų140.6 Ų40.61%0.00520%0.203CC..Hα-helixtrans-64.6-38.8174.7-68.9174.3000112.2L189 V205 F259 V263 L264 T267 F284 N285 T286 L291 T292L189-L288 HydrophobicContact CD1-CD2 4.23Å; L189-L288 HydrophobicContact CD2-CD2 3.85Å; L189-L288 HydrophobicContact CD2-CG 3.98Å; V205-L288 HydrophobicContact CG2-CD2 4.25Å; F259-L288 HydrophobicContact CE2-CD2 4.26Å; F259-L288 HydrophobicContact CZ-CD2 4.12Å; V263-L288 HydrophobicContact CG1-CD1 4.12Å; V263-L288 HydrophobicContact CG1-CD2 4.41Å; L264-L288 HydrophobicContact CD2-CB 3.68Å; L264-L288 HydrophobicContact CD2-CD1 4.44Å; T267-L288 HydrophobicContact CG2-CD1 3.85Å; F284-L288 HydrophobicContact CD1-CD1 3.89Å; F284-L288 HydrophobicContact CD1-CG 4.5Å; F284-L288 HydrophobicContact CE1-CD1 3.61Å; F284-L288 HydrophobicContact CE1-CG 4.26Å; F284-L288 HydrophobicContact CZ-CD1 4.33Å; F284-L288 PolarHBondContact O-N 2.98Å; F284-L288 VanDerWaalsContact O-N 3.12Å; N285-L288 PolarHBondContact O-N 2.89Å; T286-L288 PolarHBondContact O-N 2.65Å; L288-L291 WeakPolarHBondContact O-CB 3.39Å; L288-L291 PolarHBondContact O-N 3.25Å; L288-T292 PolarHBondContact O-N 3.44Å; L288-T292 PolarHBondContact O-OG1 3.03Å; L288-T292 VanDerWaalsContact O-OG1 3.05Å
289L96.9Very high95.3Very high88 Ų8841.8 Ų41.846%0.46121%0.207SC..Hα-helixtrans-66.5-40.4174.8-71.4171.7000112L264 N285 T286 L291 T292 V293L264-L289 HydrophobicContact CD1-CD2 4.14Å; L264-L289 HydrophobicContact CD2-CD2 4.29Å; N285-L289 VanDerWaalsContact O-CG 3.29Å; N285-L289 WeakPolarHBondContact O-CG 3.45Å; N285-L289 PolarHBondContact O-N 3.16Å; T286-L289 PolarHBondContact O-N 3.2Å; L289-L291 VanDerWaalsContact C-N 3.28Å; L289-L291 PolarHBondContact O-N 3.11Å; L289-T292 WeakPolarHBondContact O-CB 3.41Å; L289-T292 PolarHBondContact O-N 3.31Å; L289-T292 VanDerWaalsContact O-N 3.15Å; L289-V293 WeakPolarHBondContact O-CG2 3.4Å; L289-V293 PolarHBondContact O-N 3.48Å
290I97.6Very high95.5Very high67 Ų6746.4 Ų46.434%0.34423%0.231SC..Hα-helixtrans-57.9-44.7172-70.2166.5000109.9V185 T286 L287 T292 V293 M294V185-I290 HydrophobicContact CG1-CG2 4.25Å; V185-I290 HydrophobicContact CG2-CG2 4.16Å; T286-I290 HydrophobicContact CG2-CD1 4.11Å; T286-I290 WeakPolarHBondContact O-CG1 3.34Å; T286-I290 PolarHBondContact O-N 3.26Å; L287-I290 PolarHBondContact O-N 3.27Å; I290-T292 VanDerWaalsContact C-N 3.34Å; I290-T292 PolarHBondContact O-N 3.47Å; I290-V293 PolarHBondContact O-N 2.78Å; I290-M294 HydrophobicContact CG2-CE 3.61Å; I290-M294 HydrophobicContact CG2-SD 4.32Å; I290-M294 WeakPolarHBondContact O-CG 3.46Å; I290-M294 PolarHBondContact O-N 3.36Å
291L97.4Very high95.6Very high2 Ų248.2 Ų48.21%0.0124%0.238CC..Hα-helixtrans-60.7-41175.6-175.563.4000111.8T186 L189 V205 F259 L287 L288 L289 M294 N295T186-L291 HydrophobicContact CG2-CD1 4.08Å; L189-L291 HydrophobicContact CD1-CB 4.43Å; L189-L291 HydrophobicContact CD1-CD2 4.04Å; V205-L291 HydrophobicContact CG1-CD2 4.17Å; F259-L291 HydrophobicContact CZ-CD2 4.17Å; L287-L291 PolarHBondContact O-N 2.99Å; L288-L291 WeakPolarHBondContact O-CB 3.39Å; L288-L291 PolarHBondContact O-N 3.25Å; L289-L291 VanDerWaalsContact C-N 3.28Å; L289-L291 PolarHBondContact O-N 3.11Å; L291-M294 PolarHBondContact O-N 3.26Å; L291-N295 PolarHBondContact O-N 3.47Å; L291-N295 PolarHBondContact O-ND2 3.29Å
292T97.3Very high95.6Very high18 Ų1848.2 Ų48.211%0.1124%0.239CC..Hα-helixtrans-59.6-45.9173.2-52.60000112.2F259 L288 L289 I290 M294 N295 I296F259-T292 VanDerWaalsContact CE1-OG1 3.31Å; F259-T292 WeakPolarHBondContact CE1-OG1 3.48Å; L288-T292 PolarHBondContact O-N 3.44Å; L288-T292 PolarHBondContact O-OG1 3.03Å; L288-T292 VanDerWaalsContact O-OG1 3.05Å; L289-T292 WeakPolarHBondContact O-CB 3.41Å; L289-T292 PolarHBondContact O-N 3.31Å; L289-T292 VanDerWaalsContact O-N 3.15Å; I290-T292 VanDerWaalsContact C-N 3.34Å; I290-T292 PolarHBondContact O-N 3.47Å; T292-M294 VanDerWaalsContact C-N 3.32Å; T292-M294 PolarHBondContact O-N 2.91Å; T292-N295 WeakPolarHBondContact O-CB 3.34Å; T292-N295 PolarHBondContact O-N 3Å; T292-N295 VanDerWaalsContact O-N 3.16Å; T292-I296 HydrophobicContact CG2-CD1 4.21Å; T292-I296 WeakPolarHBondContact O-CG1 3.49Å; T292-I296 PolarHBondContact O-N 3.33Å
293V97.4Very high95.6Very high97 Ų9747 Ų4759%0.58824%0.239SC*.Hα-helixtrans-61.5-42.6179.3171.90000110.8L289 I290 N295 I296 Y297L289-V293 WeakPolarHBondContact O-CG2 3.4Å; L289-V293 PolarHBondContact O-N 3.48Å; I290-V293 PolarHBondContact O-N 2.78Å; V293-N295 PolarHBondContact O-N 2.92Å; V293-I296 PolarHBondContact O-N 3.38Å; V293-Y297 PolarHBondContact O-N 3.28Å
294M96.4Very high95.4Very high20 Ų2044.8 Ų44.810%0.09924%0.237CC..Hα-helixtrans-62.2-41.8174.3-66.5174.1178.300111.9V181 H182 V185 I290 L291 T292 I296 Y297 W298V181-M294 HydrophobicContact CB-CE 4.31Å; V181-M294 HydrophobicContact CG1-CE 3.58Å; H182-M294 HydrophobicContact CB-SD 3.82Å; V185-M294 HydrophobicContact CG2-CE 4.22Å; I290-M294 HydrophobicContact CG2-CE 3.61Å; I290-M294 HydrophobicContact CG2-SD 4.32Å; I290-M294 WeakPolarHBondContact O-CG 3.46Å; I290-M294 PolarHBondContact O-N 3.36Å; L291-M294 PolarHBondContact O-N 3.26Å; T292-M294 VanDerWaalsContact C-N 3.32Å; T292-M294 PolarHBondContact O-N 2.91Å; M294-I296 VanDerWaalsContact C-N 3.3Å; M294-I296 PolarHBondContact O-N 3.45Å; M294-Y297 WeakPolarHBondContact O-CB 3.24Å; M294-Y297 PolarHBondContact O-N 3.48Å; M294-W298 VanDerWaalsContact C-CE3 3.5Å; M294-W298 HydrophobicContact CB-CE3 4.09Å; M294-W298 HydrophobicContact CB-CH2 3.97Å; M294-W298 HydrophobicContact CB-CZ3 3.56Å; M294-W298 PolarHBondContact O-N 3.26Å; M294-W298 HydrophobicContact SD-CH2 4.49Å
295N96.9Very high95.1Very high0 Ų046.3 Ų46.30%024%0.244CC..Hα-helixtrans-62-36.9176.5-75.2-38.4000112.7H209 W251 R255 L256 L291 T292 V293 F299H209-N295 PolarHBondContact NE2-ND2 3.24Å; W251-N295 PolarHBondContact NE1-O 3.05Å; R255-N295 HydrophobicContact CB-CB 4.39Å; R255-N295 WeakPolarHBondContact CD-OD1 3.43Å; R255-N295 PolarHBondContact NH1-OD1 3.47Å; L256-N295 HydrophobicContact CD2-CB 4.21Å; L291-N295 PolarHBondContact O-N 3.47Å; L291-N295 PolarHBondContact O-ND2 3.29Å; T292-N295 WeakPolarHBondContact O-CB 3.34Å; T292-N295 PolarHBondContact O-N 3Å; T292-N295 VanDerWaalsContact O-N 3.16Å; V293-N295 PolarHBondContact O-N 2.92Å; N295-F299 WeakPolarHBondContact O-CB 3.45Å; N295-F299 PolarHBondContact O-N 3.15Å
296I96.8Very high94.6Very high81 Ų8147 Ų4742%0.41525%0.251SS..Hα-helixtrans-66.7-47.3172.9-66.4166.5000110L256 T292 V293 M294 W298 F299 L300L256-I296 HydrophobicContact CD2-CG1 3.79Å; T292-I296 HydrophobicContact CG2-CD1 4.21Å; T292-I296 WeakPolarHBondContact O-CG1 3.49Å; T292-I296 PolarHBondContact O-N 3.33Å; V293-I296 PolarHBondContact O-N 3.38Å; M294-I296 VanDerWaalsContact C-N 3.3Å; M294-I296 PolarHBondContact O-N 3.45Å; I296-W298 PolarHBondContact O-N 3.33Å; I296-F299 WeakPolarHBondContact O-CB 3.45Å; I296-F299 PolarHBondContact O-N 3.33Å; I296-F299 VanDerWaalsContact O-N 3.09Å; I296-L300 WeakPolarHBondContact O-CG 3.45Å; I296-L300 PolarHBondContact O-N 2.8Å
297Y95.6Very high94.2Very high75 Ų7545.7 Ų45.729%0.29425%0.248SC..Hα-helixtrans-51.8-52177.8167.9-93.6000111.7V178 V293 M294 L300 Y301V178-Y297 HydrophobicContact CB-CE1 4.47Å; V178-Y297 HydrophobicContact CG1-CD1 4.27Å; V178-Y297 HydrophobicContact CG1-CE1 4.13Å; V178-Y297 HydrophobicContact CG2-CE1 4.28Å; V293-Y297 PolarHBondContact O-N 3.28Å; M294-Y297 WeakPolarHBondContact O-CB 3.24Å; M294-Y297 PolarHBondContact O-N 3.48Å; Y297-L300 WeakPolarHBondContact O-CB 3.44Å; Y297-L300 PolarHBondContact O-N 2.91Å; Y297-Y301 HydrophobicContact CD1-CE2 4.32Å; Y297-Y301 HydrophobicContact CD2-CE2 4.22Å; Y297-Y301 HydrophobicContact CE1-CD2 4.18Å; Y297-Y301 AromaticContact CE1-CE2 3.72Å; Y297-Y301 HydrophobicContact CE1-CE2 3.72Å; Y297-Y301 AromaticContact CE2-CE2 3.63Å; Y297-Y301 HydrophobicContact CE2-CE2 3.63Å; Y297-Y301 AromaticContact CZ-CE2 3.34Å; Y297-Y301 WeakPolarHBondContact O-CD2 3.24Å; Y297-Y301 WeakPolarHBondContact OH-CE2 3.35Å; Y297-Y301 PolarHBondContact OH-OH 3.43Å
298W95.6Very high93.5Very high13 Ų1348.5 Ų48.55%0.04926%0.259CS..Hα-helixtrans-69.2-33.8177.8-69.3-58.6000113.2V178 M179 H182 W251 M294 I296 L300 Y301 I302V178-W298 HydrophobicContact CG1-CH2 4.47Å; V178-W298 HydrophobicContact CG1-CZ2 3.77Å; M179-W298 HydrophobicContact CG-CZ2 4.35Å; M179-W298 HydrophobicContact SD-CH2 4.11Å; M179-W298 HydrophobicContact SD-CZ2 3.45Å; M179-W298 WeakPolarHBondContact SD-CZ2 3.46Å; H182-W298 HydrophobicContact CB-CH2 3.65Å; H182-W298 HydrophobicContact CB-CZ2 4.35Å; H182-W298 AromaticContact CG-CH2 3.61Å; H182-W298 AromaticContact ND1-CH2 3.72Å; H182-W298 AromaticContact ND1-CZ3 3.96Å; W251-W298 HydrophobicContact CH2-CB 3.87Å; W251-W298 HydrophobicContact CH2-CD2 4.35Å; W251-W298 HydrophobicContact CH2-CE3 4.02Å; W251-W298 HydrophobicContact CH2-CG 4.34Å; W251-W298 HydrophobicContact CZ2-CB 3.5Å; W251-W298 VanDerWaalsContact CZ2-CB 3.5Å; W251-W298 HydrophobicContact CZ2-CD2 4.41Å; W251-W298 AromaticContact CZ2-CE3 3.96Å; W251-W298 HydrophobicContact CZ2-CE3 3.96Å; W251-W298 HydrophobicContact CZ2-CG 4.29Å; M294-W298 VanDerWaalsContact C-CE3 3.5Å; M294-W298 HydrophobicContact CB-CE3 4.09Å; M294-W298 HydrophobicContact CB-CH2 3.97Å; M294-W298 HydrophobicContact CB-CZ3 3.56Å; M294-W298 PolarHBondContact O-N 3.26Å; M294-W298 HydrophobicContact SD-CH2 4.49Å; I296-W298 PolarHBondContact O-N 3.33Å; W298-L300 PolarHBondContact O-N 3.25Å; W298-Y301 WeakPolarHBondContact O-CB 3.29Å; W298-Y301 PolarHBondContact O-N 3.47Å; W298-I302 WeakPolarHBondContact O-CG1 3.42Å; W298-I302 PolarHBondContact O-N 3.26Å
299F95.9Very high92.8Very high38 Ų3851.1 Ų51.117%0.16728%0.275CS..Hα-helixtrans-60.2-36.6175.5-173.2-116000112.2W251 F252 L256 N295 I296 Y301 I302 V303W251-F299 HydrophobicContact CB-CD2 4.47Å; W251-F299 AromaticContact CD1-CD2 3.42Å; W251-F299 VanDerWaalsContact CD1-CD2 3.42Å; W251-F299 AromaticContact CD1-CG 3.96Å; W251-F299 HydrophobicContact CG-CD2 4.15Å; F252-F299 HydrophobicContact CB-CE2 3.86Å; F252-F299 HydrophobicContact CB-CZ 4.02Å; F252-F299 HydrophobicContact CD2-CE1 4.24Å; F252-F299 HydrophobicContact CD2-CE2 4.48Å; F252-F299 AromaticContact CD2-CZ 3.86Å; F252-F299 HydrophobicContact CD2-CZ 3.86Å; F252-F299 HydrophobicContact CG-CZ 4.37Å; L256-F299 HydrophobicContact CD1-CB 3.76Å; L256-F299 HydrophobicContact CD1-CD1 3.33Å; L256-F299 HydrophobicContact CD1-CD2 3.97Å; L256-F299 HydrophobicContact CD1-CE1 3.83Å; L256-F299 HydrophobicContact CD1-CE2 4.4Å; L256-F299 HydrophobicContact CD1-CG 3.4Å; L256-F299 VanDerWaalsContact CD1-CG 3.4Å; L256-F299 HydrophobicContact CD1-CZ 4.33Å; N295-F299 WeakPolarHBondContact O-CB 3.45Å; N295-F299 PolarHBondContact O-N 3.15Å; I296-F299 WeakPolarHBondContact O-CB 3.45Å; I296-F299 PolarHBondContact O-N 3.33Å; I296-F299 VanDerWaalsContact O-N 3.09Å; F299-Y301 VanDerWaalsContact C-N 3.29Å; F299-Y301 PolarHBondContact O-N 2.74Å; F299-I302 WeakPolarHBondContact O-CB 3.49Å; F299-I302 PolarHBondContact O-N 3.38Å; F299-I302 VanDerWaalsContact O-N 3.1Å; F299-V303 HydrophobicContact CD1-CG2 4.03Å; F299-V303 HydrophobicContact CD2-CG2 4.45Å; F299-V303 HydrophobicContact CE1-CG2 3.62Å; F299-V303 HydrophobicContact CE2-CG2 4.09Å; F299-V303 HydrophobicContact CG-CG2 4.44Å; F299-V303 HydrophobicContact CZ-CG2 3.66Å; F299-V303 WeakPolarHBondContact O-CG2 3.33Å; F299-V303 PolarHBondContact O-N 2.86Å
300L94Very high92Very high111 Ų11153.9 Ų53.958%0.58129%0.289SS*.Hα-helixtrans-60.5-38.5174.3-63.6174.2000111.9I296 Y297 W298 V303 A304I296-L300 WeakPolarHBondContact O-CG 3.45Å; I296-L300 PolarHBondContact O-N 2.8Å; Y297-L300 WeakPolarHBondContact O-CB 3.44Å; Y297-L300 PolarHBondContact O-N 2.91Å; W298-L300 PolarHBondContact O-N 3.25Å; L300-V303 PolarHBondContact O-N 3.41Å; L300-A304 VanDerWaalsContact O-CB 3.32Å; L300-A304 WeakPolarHBondContact O-CB 3.43Å; L300-A304 PolarHBondContact O-N 3.14Å
301Y91.1Very high91.2Very high92 Ų9255 Ų5536%0.36130%0.3SS..Hα-helixtrans-65.7-39.5172.5-77.7-86.3000112.5Y297 W298 F299 A304 F305Y297-Y301 HydrophobicContact CD1-CE2 4.32Å; Y297-Y301 HydrophobicContact CD2-CE2 4.22Å; Y297-Y301 HydrophobicContact CE1-CD2 4.18Å; Y297-Y301 AromaticContact CE1-CE2 3.72Å; Y297-Y301 HydrophobicContact CE1-CE2 3.72Å; Y297-Y301 AromaticContact CE2-CE2 3.63Å; Y297-Y301 HydrophobicContact CE2-CE2 3.63Å; Y297-Y301 AromaticContact CZ-CE2 3.34Å; Y297-Y301 WeakPolarHBondContact O-CD2 3.24Å; Y297-Y301 WeakPolarHBondContact OH-CE2 3.35Å; Y297-Y301 PolarHBondContact OH-OH 3.43Å; W298-Y301 WeakPolarHBondContact O-CB 3.29Å; W298-Y301 PolarHBondContact O-N 3.47Å; F299-Y301 VanDerWaalsContact C-N 3.29Å; F299-Y301 PolarHBondContact O-N 2.74Å; Y301-A304 PolarHBondContact O-N 2.91Å; Y301-F305 WeakPolarHBondContact O-CB 3.43Å; Y301-F305 PolarHBondContact O-N 3.46Å
302I92.1Very high90.1Very high18 Ų1857.8 Ų57.89%0.09233%0.329CS..Hα-helixtrans-63.7-44.5177.7-62.5170.9000110.3F247 C248 W251 W298 F299 F305 A306F247-I302 HydrophobicContact CD1-CG2 4.45Å; F247-I302 HydrophobicContact CE1-CD1 3.52Å; F247-I302 HydrophobicContact CE1-CG1 3.74Å; F247-I302 HydrophobicContact CE1-CG2 4.21Å; F247-I302 HydrophobicContact CZ-CD1 3.52Å; F247-I302 HydrophobicContact CZ-CG1 4.16Å; C248-I302 HydrophobicContact CB-CG2 3.88Å; W251-I302 HydrophobicContact CB-CD1 3.98Å; W251-I302 HydrophobicContact CD2-CD1 3.38Å; W251-I302 HydrophobicContact CE3-CD1 3.65Å; W251-I302 HydrophobicContact CG-CD1 3.54Å; W251-I302 HydrophobicContact CZ3-CD1 4.33Å; W298-I302 WeakPolarHBondContact O-CG1 3.42Å; W298-I302 PolarHBondContact O-N 3.26Å; F299-I302 WeakPolarHBondContact O-CB 3.49Å; F299-I302 PolarHBondContact O-N 3.38Å; F299-I302 VanDerWaalsContact O-N 3.1Å; I302-F305 WeakPolarHBondContact O-CB 3.28Å; I302-F305 PolarHBondContact O-N 2.85Å; I302-A306 WeakPolarHBondContact O-CB 3.22Å; I302-A306 PolarHBondContact O-N 3.38Å
303V91.4Very high88.5Confident66 Ų6664 Ų6440%0.436%0.357SS..Hα-helixtrans-65.5-43.7176.5172.50000111F299 L300 F305 A306 A307F299-V303 HydrophobicContact CD1-CG2 4.03Å; F299-V303 HydrophobicContact CD2-CG2 4.45Å; F299-V303 HydrophobicContact CE1-CG2 3.62Å; F299-V303 HydrophobicContact CE2-CG2 4.09Å; F299-V303 HydrophobicContact CG-CG2 4.44Å; F299-V303 HydrophobicContact CZ-CG2 3.66Å; F299-V303 WeakPolarHBondContact O-CG2 3.33Å; F299-V303 PolarHBondContact O-N 2.86Å; L300-V303 PolarHBondContact O-N 3.41Å; V303-F305 VanDerWaalsContact C-N 3.28Å; V303-F305 PolarHBondContact O-N 2.98Å; V303-A306 PolarHBondContact O-N 3.18Å; V303-A307 WeakPolarHBondContact O-CB 3.44Å; V303-A307 PolarHBondContact O-N 3.32Å
304A89.6Confident86.8Confident43 Ų4361.9 Ų61.936%0.35534%0.341SS..Hα-helixtrans-60.3-39.6175.900000111.9L300 Y301 K308 L320L300-A304 VanDerWaalsContact O-CB 3.32Å; L300-A304 WeakPolarHBondContact O-CB 3.43Å; L300-A304 PolarHBondContact O-N 3.14Å; Y301-A304 PolarHBondContact O-N 2.91Å; A304-K308 WeakPolarHBondContact O-CG 3.38Å; A304-K308 PolarHBondContact O-N 3.11Å; A304-K308 VanDerWaalsContact O-N 3.08Å; A304-L320 HydrophobicContact CB-CD1 4.32Å
305F87.1Confident84.8Confident36 Ų3672.9 Ų72.916%0.15838%0.382CS..Hα-helixtrans-64.7-49.6173.6178.5-115.4000112C244 Y301 I302 V303 A307 K308 V309 M314 L317 E318 L320C244-F305 VanDerWaalsContact SG-CE1 3.52Å; Y301-F305 WeakPolarHBondContact O-CB 3.43Å; Y301-F305 PolarHBondContact O-N 3.46Å; I302-F305 WeakPolarHBondContact O-CB 3.28Å; I302-F305 PolarHBondContact O-N 2.85Å; V303-F305 VanDerWaalsContact C-N 3.28Å; V303-F305 PolarHBondContact O-N 2.98Å; F305-A307 VanDerWaalsContact C-N 3.29Å; F305-A307 PolarHBondContact O-N 3.32Å; F305-K308 PolarHBondContact O-N 2.84Å; F305-K308 VanDerWaalsContact O-N 3.13Å; F305-V309 HydrophobicContact CD2-CG2 4.33Å; F305-V309 HydrophobicContact CE1-CG2 4.22Å; F305-V309 HydrophobicContact CE2-CG2 4Å; F305-V309 HydrophobicContact CZ-CG2 3.97Å; F305-V309 WeakPolarHBondContact O-CG2 3.08Å; F305-V309 PolarHBondContact O-N 3.45Å; F305-M314 HydrophobicContact CD2-SD 4.25Å; F305-M314 HydrophobicContact CE2-SD 4.12Å; F305-L317 HydrophobicContact CE1-CD2 3.92Å; F305-L317 HydrophobicContact CZ-CB 4.11Å; F305-L317 HydrophobicContact CZ-CD2 3.64Å; F305-L317 HydrophobicContact CZ-CG 4.29Å; F305-E318 WeakPolarHBondContact CE2-O 3.32Å; F305-L320 HydrophobicContact CB-CD1 3.64Å; F305-L320 HydrophobicContact CB-CG 4.12Å; F305-L320 HydrophobicContact CD2-CD1 4.31Å; F305-L320 HydrophobicContact CD2-CD2 4.46Å; F305-L320 HydrophobicContact CD2-CG 3.93Å; F305-L320 HydrophobicContact CG-CD1 4.48Å; F305-L320 HydrophobicContact CG-CG 4.48Å
306A87.3Confident83.1Confident26 Ų2678.7 Ų78.722%0.21541%0.409CS..Hα-helixtrans-58.2-41.9177.700000111.7I302 V303 V309 L310I302-A306 WeakPolarHBondContact O-CB 3.22Å; I302-A306 PolarHBondContact O-N 3.38Å; V303-A306 PolarHBondContact O-N 3.18Å; A306-V309 PolarHBondContact O-N 3.08Å; A306-L310 WeakPolarHBondContact O-CB 3.5Å; A306-L310 VanDerWaalsContact O-CG 3.28Å; A306-L310 WeakPolarHBondContact O-CG 3.31Å; A306-L310 PolarHBondContact O-N 2.91Å
307A86.1Confident81.4Confident48 Ų4876.2 Ų76.240%0.39740%0.396SS..Hα-helixtrans-62.5-42.5175.600000112.3V303 F305 V309 L310 T311V303-A307 WeakPolarHBondContact O-CB 3.44Å; V303-A307 PolarHBondContact O-N 3.32Å; F305-A307 VanDerWaalsContact C-N 3.29Å; F305-A307 PolarHBondContact O-N 3.32Å; A307-V309 VanDerWaalsContact C-N 3.34Å; A307-V309 PolarHBondContact O-N 3.26Å; A307-L310 PolarHBondContact O-N 3.39Å; A307-T311 WeakPolarHBondContact O-CB 3.37Å; A307-T311 VanDerWaalsContact O-CG2 3.26Å; A307-T311 WeakPolarHBondContact O-CG2 3.18Å; A307-T311 PolarHBondContact O-N 3.34Å; A307-T311 PolarHBondContact O-OG1 2.99Å
308K83.6Confident79.9Confident79 Ų7976.3 Ų76.334%0.34340%0.399SS..Hα-helixtrans-64.3-36.5175.7-77.4-179.7174.9-1740113.1A304 F305 T311 G312 Q313 M314 L320A304-K308 WeakPolarHBondContact O-CG 3.38Å; A304-K308 PolarHBondContact O-N 3.11Å; A304-K308 VanDerWaalsContact O-N 3.08Å; F305-K308 PolarHBondContact O-N 2.84Å; F305-K308 VanDerWaalsContact O-N 3.13Å; K308-T311 WeakPolarHBondContact CA-OG1 3.39Å; K308-T311 PolarHBondContact O-OG1 3.26Å; K308-G312 PolarHBondContact O-N 3.43Å; K308-Q313 PolarHBondContact O-N 3.1Å; K308-Q313 VanDerWaalsContact O-N 3.15Å; K308-M314 HydrophobicContact CB-CG 4.37Å; K308-M314 HydrophobicContact CB-SD 4.33Å; K308-M314 HydrophobicContact CD-CE 4.49Å; K308-M314 HydrophobicContact CD-SD 4.4Å; K308-M314 PolarHBondContact O-N 3.32Å; K308-L320 HydrophobicContact CD-CD1 4.42Å; K308-L320 HydrophobicContact CD-CD2 3.9Å
309V82.2Confident78.4Confident55 Ų5577.7 Ų77.733%0.33341%0.408SS..Hα-helixtrans-68.6-45.1175.1174.70000110.6F305 A306 A307 G312F305-V309 HydrophobicContact CD2-CG2 4.33Å; F305-V309 HydrophobicContact CE1-CG2 4.22Å; F305-V309 HydrophobicContact CE2-CG2 4Å; F305-V309 HydrophobicContact CZ-CG2 3.97Å; F305-V309 WeakPolarHBondContact O-CG2 3.08Å; F305-V309 PolarHBondContact O-N 3.45Å; A306-V309 PolarHBondContact O-N 3.08Å; A307-V309 VanDerWaalsContact C-N 3.34Å; A307-V309 PolarHBondContact O-N 3.26Å; V309-G312 PolarHBondContact O-N 3.45Å
310L80.6Confident77.2Confident146 Ų14677.5 Ų77.576%0.76441%0.408SS*.Hα-helixtrans-68.7-34.8-179.6-70.9172.3000113.4A306 A307 G312A306-L310 WeakPolarHBondContact O-CB 3.5Å; A306-L310 VanDerWaalsContact O-CG 3.28Å; A306-L310 WeakPolarHBondContact O-CG 3.31Å; A306-L310 PolarHBondContact O-N 2.91Å; A307-L310 PolarHBondContact O-N 3.39Å; L310-G312 PolarHBondContact O-N 3.15Å
311T81.4Confident76Confident91 Ų9174.1 Ų74.156%0.55839%0.388SS*.THydrogen-bonded Turntrans-77.9-0.4176.852.70000113.3A307 K308 Q313A307-T311 WeakPolarHBondContact O-CB 3.37Å; A307-T311 VanDerWaalsContact O-CG2 3.26Å; A307-T311 WeakPolarHBondContact O-CG2 3.18Å; A307-T311 PolarHBondContact O-N 3.34Å; A307-T311 PolarHBondContact O-OG1 2.99Å; K308-T311 WeakPolarHBondContact CA-OG1 3.39Å; K308-T311 PolarHBondContact O-OG1 3.26Å; T311-Q313 PolarHBondContact O-N 3.06Å
312G72.7Confident75.2Confident61 Ų6171.2 Ų71.263%0.62938%0.377SS*.THydrogen-bonded Turntrans70.69.1179.300000114.4K308 V309 L310 M314K308-G312 PolarHBondContact O-N 3.43Å; V309-G312 PolarHBondContact O-N 3.45Å; L310-G312 PolarHBondContact O-N 3.15Å; G312-M314 PolarHBondContact O-N 3.05Å
313Q65.6Low73.7Confident148 Ų14876 Ų7669%0.69240%0.395SS*.  trans-71.6-19.4178.8-69.5-173.8-26.100112.7K308 T311K308-Q313 PolarHBondContact O-N 3.1Å; K308-Q313 VanDerWaalsContact O-N 3.15Å; T311-Q313 PolarHBondContact O-N 3.06Å
314M60.6Low72Confident52 Ų5277.2 Ų77.226%0.25640%0.399SS..  trans-119113.6174.4-79.6-172156.900111.2F305 K308 G312 L320F305-M314 HydrophobicContact CD2-SD 4.25Å; F305-M314 HydrophobicContact CE2-SD 4.12Å; K308-M314 HydrophobicContact CB-CG 4.37Å; K308-M314 HydrophobicContact CB-SD 4.33Å; K308-M314 HydrophobicContact CD-CE 4.49Å; K308-M314 HydrophobicContact CD-SD 4.4Å; K308-M314 PolarHBondContact O-N 3.32Å; G312-M314 PolarHBondContact O-N 3.05Å; M314-L320 HydrophobicContact CE-CD2 3.53Å; M314-L320 HydrophobicContact SD-CD2 4.13Å
315R54Low70.1Confident252 Ų25280.7 Ų80.795%0.95142%0.416SS*.SBendtrans-82.5-17.3174.6-134.9174.979.3171.93.6112.8
316E62Low67.9Low122 Ų12285.9 Ų85.957%0.5745%0.445SS*.SBendtrans-127.6138.1174.5-61.7-161.1147.800110.4E318E316-E318 VanDerWaalsContact C-N 3.26Å; E316-E318 HydrophobicContact CB-CG 4.46Å; E316-E318 PolarHBondContact O-N 2.96Å
317L61.3Low65.6Low28 Ų2890.7 Ų90.715%0.14746%0.463CS..  trans-68.881.9174.5-68.5128.2000109.7I223 N241 C244 F305I223-L317 HydrophobicContact CD1-CB 3.83Å; I223-L317 HydrophobicContact CD1-CD1 4.43Å; I223-L317 HydrophobicContact CG1-CD1 4.47Å; N241-L317 WeakPolarHBondContact OD1-CD1 3.45Å; C244-L317 HydrophobicContact CB-CD2 3.96Å; F305-L317 HydrophobicContact CE1-CD2 3.92Å; F305-L317 HydrophobicContact CZ-CB 4.11Å; F305-L317 HydrophobicContact CZ-CD2 3.64Å; F305-L317 HydrophobicContact CZ-CG 4.29Å
318E62.9Low63.4Low78 Ų7892.2 Ų92.236%0.36448%0.475SS..  trans-95.2141171.3-67.5-162.712600111.1R94 F305 E316 L320R94-E318 IonicContact CZ-OE1 2.76Å; R94-E318 IonicContact NH1-OE1 2.8Å; R94-E318 PolarHBondContact NH1-OE1 2.6Å; R94-E318 IonicContact NH2-OE1 3.7Å; R94-E318 PolarHBondContact NH2-OE1 3.39Å; F305-E318 WeakPolarHBondContact CE2-O 3.32Å; E316-E318 VanDerWaalsContact C-N 3.26Å; E316-E318 HydrophobicContact CB-CG 4.46Å; E316-E318 PolarHBondContact O-N 2.96Å; E318-L320 PolarHBondContact O-N 3.1Å
319D64.8Low61Low42 Ų4296.5 Ų96.523%0.22550%0.497CS..  trans-72.5117.7-179.3-171.8-22.4000110.4R321 E322D319-R321 PolarHBondContact O-N 3.49Å; D319-R321 WeakPolarHBondContact OD1-CB 3.42Å; D319-R321 WeakPolarHBondContact OD1-CG 2.95Å; D319-R321 IonicContact OD1-CZ 2.83Å; D319-R321 PolarHBondContact OD1-N 2.83Å; D319-R321 VanDerWaalsContact OD1-N 3.12Å; D319-R321 IonicContact OD1-NE 3.16Å; D319-R321 PolarHBondContact OD1-NE 3.44Å; D319-R321 IonicContact OD1-NH2 3.44Å; D319-R321 IonicContact OD2-CZ 3.82Å; D319-R321 IonicContact OD2-NE 3.24Å; D319-R321 PolarHBondContact OD2-NE 2.84Å; D319-R321 IonicContact OD2-NH2 3.83Å; D319-R321 PolarHBondContact OD2-NH2 3.22Å; D319-E322 HydrophobicContact CB-CG 4.17Å; D319-E322 PolarHBondContact O-N 3.28Å; D319-E322 VanDerWaalsContact O-N 3.14Å
320L70.6Confident58.7Low34 Ų3499.1 Ų99.118%0.17851%0.513CS..THydrogen-bonded Turntrans-59.8-13.8-177.7-69.3-174.2000114.9A304 F305 K308 M314 E318A304-L320 HydrophobicContact CB-CD1 4.32Å; F305-L320 HydrophobicContact CB-CD1 3.64Å; F305-L320 HydrophobicContact CB-CG 4.12Å; F305-L320 HydrophobicContact CD2-CD1 4.31Å; F305-L320 HydrophobicContact CD2-CD2 4.46Å; F305-L320 HydrophobicContact CD2-CG 3.93Å; F305-L320 HydrophobicContact CG-CD1 4.48Å; F305-L320 HydrophobicContact CG-CG 4.48Å; K308-L320 HydrophobicContact CD-CD1 4.42Å; K308-L320 HydrophobicContact CD-CD2 3.9Å; M314-L320 HydrophobicContact CE-CD2 3.53Å; M314-L320 HydrophobicContact SD-CD2 4.13Å; E318-L320 PolarHBondContact O-N 3.1Å
321R70.3Confident56.6Low40 Ų4097.8 Ų97.815%0.15151%0.511CS..THydrogen-bonded Turntrans-90.6-9.4-175.9-54.9172.5-64170.9-8.5112.4R173 K174 D175 D319R173-R321 WeakPolarHBondContact CB-O 3.49Å; K174-R321 WeakPolarHBondContact CB-O 3.11Å; K174-R321 WeakPolarHBondContact CG-O 3.42Å; K174-R321 PolarHBondContact N-O 3.27Å; D175-R321 VanDerWaalsContact OD2-CD 3.28Å; D175-R321 WeakPolarHBondContact OD2-CD 3.34Å; D175-R321 IonicContact OD2-CZ 2.64Å; D175-R321 IonicContact OD2-NE 3.7Å; D175-R321 IonicContact OD2-NH1 3.07Å; D175-R321 PolarHBondContact OD2-NH1 2.94Å; D319-R321 PolarHBondContact O-N 3.49Å; D319-R321 WeakPolarHBondContact OD1-CB 3.42Å; D319-R321 WeakPolarHBondContact OD1-CG 2.95Å; D319-R321 IonicContact OD1-CZ 2.83Å; D319-R321 PolarHBondContact OD1-N 2.83Å; D319-R321 VanDerWaalsContact OD1-N 3.12Å; D319-R321 IonicContact OD1-NE 3.16Å; D319-R321 PolarHBondContact OD1-NE 3.44Å; D319-R321 IonicContact OD1-NH2 3.44Å; D319-R321 IonicContact OD2-CZ 3.82Å; D319-R321 IonicContact OD2-NE 3.24Å; D319-R321 PolarHBondContact OD2-NE 2.84Å; D319-R321 IonicContact OD2-NH2 3.83Å; D319-R321 PolarHBondContact OD2-NH2 3.22Å
322E72.3Confident54.2Low31 Ų31102.6 Ų102.615%0.14552%0.524CS..SBendtrans-64.7144.5175.2-68.4-178.1-16800110.6R94 R98 K174 D319 D324R94-E322 IonicContact CZ-OE2 2.92Å; R94-E322 IonicContact NH2-OE2 3.24Å; R94-E322 PolarHBondContact NH2-OE2 3.5Å; R98-E322 IonicContact CZ-OE1 3.37Å; R98-E322 IonicContact CZ-OE2 2.78Å; R98-E322 VanDerWaalsContact NH1-CD 3.29Å; R98-E322 IonicContact NH1-OE1 3.15Å; R98-E322 PolarHBondContact NH1-OE1 3.01Å; R98-E322 IonicContact NH1-OE2 3.35Å; R98-E322 PolarHBondContact NH1-OE2 3.18Å; R98-E322 VanDerWaalsContact NH1-OE2 3.12Å; R98-E322 IonicContact NH2-OE1 2.73Å; R98-E322 PolarHBondContact NH2-OE1 3.39Å; R98-E322 IonicContact NH2-OE2 3.02Å; R98-E322 PolarHBondContact NH2-OE2 2.81Å; K174-E322 WeakPolarHBondContact CE-O 3.36Å; K174-E322 PolarHBondContact NZ-O 2.8Å; D319-E322 HydrophobicContact CB-CG 4.17Å; D319-E322 PolarHBondContact O-N 3.28Å; D319-E322 VanDerWaalsContact O-N 3.14Å; E322-D324 PolarHBondContact O-N 3.46Å
323Y61.9Low52.2Low118 Ų118105.1 Ų105.146%0.46353%0.529SS..PPolyproline II helixtrans-65.9129.8166.4-68.6-76.3000108W172 R173 K174 T325W172-Y323 WeakPolarHBondContact O-CD2 3.4Å; W172-Y323 WeakPolarHBondContact O-CE2 3.4Å; R173-Y323 VanDerWaalsContact CA-CE2 3.47Å; R173-Y323 PolarHBondContact O-OH 3.15Å; K174-Y323 HydrophobicContact CG-CD1 3.94Å; K174-Y323 HydrophobicContact CG-CE1 3.85Å; K174-Y323 HydrophobicContact CG-CG 4.49Å; Y323-T325 PolarHBondContact O-N 2.81Å; Y323-T325 VanDerWaalsContact O-N 3.1Å
324D56.2Low50.6Low91 Ų91103.8 Ų103.849%0.48754%0.535SS..PPolyproline II helixtrans-59.3119.3175.9-61.1-67.1000107.2K174 E322 L326 E327K174-D324 IonicContact NZ-OD2 2.84Å; K174-D324 PolarHBondContact NZ-OD2 3.33Å; E322-D324 PolarHBondContact O-N 3.46Å; D324-L326 PolarHBondContact O-N 3.26Å; D324-E327 PolarHBondContact O-N 3.04Å
325T48.6Very low49.3Very low117 Ų117111 Ų11172%0.71857%0.565SS**THydrogen-bonded Turntrans-59.4-9.8-174.538.90000113.5Y323Y323-T325 PolarHBondContact O-N 2.81Å; Y323-T325 VanDerWaalsContact O-N 3.1Å
326L42Very low48.4Very low144 Ų144103.3 Ų103.375%0.75456%0.555SS**THydrogen-bonded Turntrans-79.9-26.6175.1-64.5171.6000113.8D324D324-L326 PolarHBondContact O-N 3.26Å
327E37.9Very low47.1Very low128 Ų128106.5 Ų106.560%0.59857%0.57SS**THydrogen-bonded Turntrans-86.9-21.2-179.9-68.9-171161.400113D324 Q329 T330D324-E327 PolarHBondContact O-N 3.04Å; E327-Q329 VanDerWaalsContact C-N 3.29Å; E327-Q329 PolarHBondContact O-N 2.58Å; E327-T330 PolarHBondContact O-N 3.41Å; E327-T330 PolarHBondContact O-OG1 3.38Å
328A39.8Very low45.7Very low79 Ų79114.2 Ų114.265%0.65360%0.602SS**THydrogen-bonded Turntrans-75.8-14.8177.900000113.7
329Q34.3Very low44.1Very low170 Ų170116.5 Ų116.579%0.79462%0.624SS**THydrogen-bonded Turntrans-90.1-12.3174.3-72.3-169.61.700113.5E327E327-Q329 VanDerWaalsContact C-N 3.29Å; E327-Q329 PolarHBondContact O-N 2.58Å
330T33.8Very low42.7Very low109 Ų109123.1 Ų123.167%0.66966%0.658SS**SBendtrans-92.9-7.2-176.738.30000114.5E327E327-T330 PolarHBondContact O-N 3.41Å; E327-T330 PolarHBondContact O-OG1 3.38Å
331T35.1Very low40.9Very low118 Ų118132.3 Ų132.372%0.72469%0.691SS**SBendtrans-106.633178.311.50000115.6
332K31.7Very low39.1Very low192 Ų192137.9 Ų137.984%0.83572%0.724SS**  trans-130.690.1153.3-77.6-172.2179.3178.80110.5C334K332-C334 PolarHBondContact O-N 2.94Å
333P30.5Very low37.3Very low115 Ų115139.9 Ų139.975%0.74775%0.753SS**  trans-68.5108.3158.626-22.7000106.9K335P333-K335 PolarHBondContact O-N 3.03Å; P333-K335 VanDerWaalsContact O-N 3.11Å
334C32.9Very low35.9Very low119 Ų119142.5 Ų142.580%0.80477%0.774SS**  trans-48.6117.3160.4-171.40000106.9K332 A336K332-C334 PolarHBondContact O-N 2.94Å; C334-A336 VanDerWaalsContact C-N 3.26Å; C334-A336 PolarHBondContact O-N 3.41Å
335K32.4Very low35Very low204 Ų204143.9 Ų143.989%0.88779%0.785SS**  trans-63.196.9170.7-74.5-175.1179.1-179.90106.6P333 E337P333-K335 PolarHBondContact O-N 3.03Å; P333-K335 VanDerWaalsContact O-N 3.11Å; K335-E337 PolarHBondContact O-N 3.15Å
336A35.6Very low34.2Very low90 Ų90147.9 Ų147.974%0.74479%0.793SS**  trans-64.4104.2164.100000106.9C334 K338C334-A336 VanDerWaalsContact C-N 3.26Å; C334-A336 PolarHBondContact O-N 3.41Å; A336-K338 PolarHBondContact O-N 3.09Å
337E34.6Very low33.9Very low189 Ų189147.7 Ų147.788%0.88379%0.792SS**  trans-57124.7163.3-103.2176.2158.500108.4K335K335-E337 PolarHBondContact O-N 3.15Å
338K32.4Very low33.6Very low190 Ų190151.1 Ų151.183%0.82681%0.805SS**  trans-63.2139.2174.8-72.9176.3176.21780109.2A336 L340A336-K338 PolarHBondContact O-N 3.09Å; K338-L340 PolarHBondContact O-N 3.28Å; K338-L340 VanDerWaalsContact O-N 3.12Å
339P29.8Very low33.4Very low127 Ų127154 Ų15483%0.82581%0.809SS**  trans-71.9110.6172.329.2-29.7000108.6R341P339-R341 PolarHBondContact O-N 3.22Å
340L34.2Very low33.5Very low180 Ų180158.7 Ų158.794%0.94283%0.827SS**  trans-68.999.7166-93156.2000108.2K338K338-L340 PolarHBondContact O-N 3.28Å; K338-L340 VanDerWaalsContact O-N 3.12Å
341R32.7Very low33.4Very low227 Ų227161.2 Ų161.286%0.85784%0.835SS**  trans-81.2111.2162.4-163.2-178-172.6-167.71.9106.9P339P339-R341 PolarHBondContact O-N 3.22Å
342N33Very low33.4Very low158 Ų158163.4 Ų163.485%0.84584%0.841SS**  trans-168.1123.7140-91.1-13.2000108.9
343G34Very low33.5Very low73 Ų73161.8 Ų161.875%0.75384%0.841SS**  trans-73149.3-178.600000112.4
344L31.7Very low33.6Very low173 Ų173164.6 Ų164.691%0.90685%0.847SS**  trans-158.9111.5140.5-108157.3000107.4
345V38.6Very low33.7Very low119 Ų119167.4 Ų167.472%0.72185%0.849SS**  trans-53.6131.3166.4172.50000108.7
346K31.2Very low33.7Very low202 Ų202165 Ų16588%0.87885%0.847SS**  trans-154.6116.3142.1-111.1172.7-172.4-179.60110.1
347D36.1Very low33.6Very low140 Ų140170.4 Ų170.475%0.74985%0.854SS**  trans-47.5145.9166-55-63.5000112.1
348K31.9Very low33.5Very low199 Ų199168.9 Ų168.987%0.86585%0.852SS**  -173.5131.9117.2-99.1175.9-172.4-167.20111.7
349L34.3Very low33.6Very low139 Ų139167.2 Ų167.273%0.72885%0.854SS**  trans-32.4137.7153.7-84.777.4000112.1
350F36.3Very low34Very low269 Ų269170.8 Ų170.8100%1.1886%0.857SS**  -166.4088.1-93.8-76.2000110.3

Retrieved 350 of 350 residues in 445.8 ms (Link to these results)