A0A096NU49_PAPAN Loading...

Zinc transporter ZIP11

AlphaFold DB , UniProt , Accession A0A096NU49, Species PAPAN (Papio anubis, Olive baboon), Gene SLC39A11, Length 342 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
1M64.9Low83.5Confident46 Ų4666.8 Ų66.823%0.22739%0.391CS..  0118.90-56.3111.5107.500107.7F216 F227 R231 A234M1-F216 HydrophobicContact CB-CZ 4.16Å; M1-F216 HydrophobicContact CE-CE2 4.02Å; M1-F216 HydrophobicContact CE-CZ 3.72Å; M1-F216 HydrophobicContact CG-CE1 4.45Å; M1-F216 HydrophobicContact CG-CE2 4.19Å; M1-F216 HydrophobicContact CG-CZ 3.67Å; M1-F227 HydrophobicContact CB-CE2 4.41Å; M1-F227 HydrophobicContact CB-CZ 4.14Å; M1-R231 HydrophobicContact CB-CG 4.3Å; M1-R231 HydrophobicContact CE-CB 4.08Å; M1-R231 HydrophobicContact CE-CG 3.65Å; M1-R231 WeakPolarHBondContact CE-O 3.28Å; M1-R231 HydrophobicContact SD-CG 4.25Å; M1-A234 HydrophobicContact CE-CB 3.26Å
2L78.4Confident84.3Confident102 Ų10266.4 Ų66.453%0.53439%0.386SS..  trans-134.6120.5-166.4-67.4172.6000109.4H5 Q10 L13L2-H5 PolarHBondContact O-CD2 3.22Å; L2-Q10 PolarHBondContact O-NE2 3.48Å; L2-L13 HydrophobicContact CG-CD2 4.33Å
3Q73.8Confident85.1Confident145 Ų14565.5 Ų65.568%0.67838%0.378SS*.THydrogen-bonded Turntrans-55.1145.3-175.8-70.7179.1-8.700112.7F227Q3-F227 HydrophobicContact CG-CD1 3.83Å; Q3-F227 HydrophobicContact CG-CE1 3.55Å; Q3-F227 HydrophobicContact CG-CG 4.42Å; Q3-F227 HydrophobicContact CG-CZ 3.94Å
4G74.8Confident85.7Confident85 Ų8560.8 Ų60.888%0.87635%0.351SS*.THydrogen-bonded Turntrans91.7-0.2175.900000116.6
5H85.9Confident86.3Confident100 Ų10056.7 Ų56.746%0.46333%0.327SS..SBendtrans-96160.5173.9-69.7-89000113.1L2 F9L2-H5 PolarHBondContact O-CD2 3.22Å; H5-F9 HydrophobicContact CB-CB 4.48Å; H5-F9 HydrophobicContact CB-CD1 3.59Å; H5-F9 HydrophobicContact CB-CE1 4.29Å; H5-F9 HydrophobicContact CB-CG 4.42Å; H5-F9 AromaticContact CG-CD1 3.72Å; H5-F9 AromaticContact CG-CE1 3.93Å; H5-F9 AromaticContact ND1-CD1 3.79Å; H5-F9 AromaticContact ND1-CE1 3.82Å
6S88.4Confident86.9Confident79 Ų7959.1 Ų59.155%0.55233%0.333SS*.  trans-60.7148.2179.467.30000112.8V8 F9 Q10S6-V8 PolarHBondContact O-N 3.03Å; S6-F9 WeakPolarHBondContact O-CB 3.42Å; S6-F9 PolarHBondContact O-N 3.16Å; S6-F9 WeakPolarHBondContact OG-CB 3.38Å; S6-F9 PolarHBondContact OG-N 3.06Å; S6-Q10 WeakPolarHBondContact O-CG 3.24Å; S6-Q10 PolarHBondContact O-N 2.83Å
7S87.8Confident87.4Confident47 Ų4760.4 Ų60.433%0.32933%0.334SS..Hα-helixtrans-52.7-39.9-179.7-57.40000113.6Q10 A11 F216S7-Q10 PolarHBondContact O-N 3.46Å; S7-A11 WeakPolarHBondContact O-CB 3.22Å; S7-A11 PolarHBondContact O-N 2.94Å; S7-F216 VanDerWaalsContact CB-O 3.22Å; S7-F216 WeakPolarHBondContact CB-O 3.43Å; S7-F216 PolarHBondContact OG-O 3.27Å
8V88.9Confident87.8Confident41 Ų4157 Ų5725%0.24832%0.315CS..Hα-helixtrans-66.6-40.7178179.40000111.4S6 Q10 A11 L12 V278 A281 F282S6-V8 PolarHBondContact O-N 3.03Å; V8-Q10 VanDerWaalsContact C-N 3.34Å; V8-A11 PolarHBondContact O-N 3.47Å; V8-L12 WeakPolarHBondContact O-CB 3.38Å; V8-L12 PolarHBondContact O-N 2.84Å; V8-V278 HydrophobicContact CG1-CG1 4.49Å; V8-A281 HydrophobicContact CG2-CB 4.34Å; V8-F282 HydrophobicContact CB-CE2 4.39Å; V8-F282 HydrophobicContact CB-CZ 4.35Å; V8-F282 HydrophobicContact CG1-CD2 4.34Å; V8-F282 HydrophobicContact CG1-CE2 3.56Å; V8-F282 HydrophobicContact CG1-CZ 3.84Å; V8-F282 HydrophobicContact CG2-CD1 4.2Å; V8-F282 HydrophobicContact CG2-CD2 4.23Å; V8-F282 HydrophobicContact CG2-CE1 3.84Å; V8-F282 HydrophobicContact CG2-CE2 3.86Å; V8-F282 HydrophobicContact CG2-CG 4.39Å; V8-F282 HydrophobicContact CG2-CZ 3.65Å
9F91.3Very high88.2Confident86 Ų8657.4 Ų57.438%0.37731%0.312SS..Hα-helixtrans-67.3-37.3176.9-176.4-100.5000111.6H5 S6 L12 L13H5-F9 HydrophobicContact CB-CB 4.48Å; H5-F9 HydrophobicContact CB-CD1 3.59Å; H5-F9 HydrophobicContact CB-CE1 4.29Å; H5-F9 HydrophobicContact CB-CG 4.42Å; H5-F9 AromaticContact CG-CD1 3.72Å; H5-F9 AromaticContact CG-CE1 3.93Å; H5-F9 AromaticContact ND1-CD1 3.79Å; H5-F9 AromaticContact ND1-CE1 3.82Å; S6-F9 WeakPolarHBondContact O-CB 3.42Å; S6-F9 PolarHBondContact O-N 3.16Å; S6-F9 WeakPolarHBondContact OG-CB 3.38Å; S6-F9 PolarHBondContact OG-N 3.06Å; F9-L12 PolarHBondContact O-N 3.11Å; F9-L13 HydrophobicContact CE1-CD2 4.35Å; F9-L13 VanDerWaalsContact O-CB 3.32Å; F9-L13 WeakPolarHBondContact O-CB 3.19Å; F9-L13 PolarHBondContact O-N 3.06Å
10Q92.3Very high88.6Confident4 Ų456 Ų562%0.01931%0.311CS..Hα-helixtrans-66.2-44.2174.5-59.6-75.11100112.3L2 S6 S7 V8 L12 L13 G14 F216L2-Q10 PolarHBondContact O-NE2 3.48Å; S6-Q10 WeakPolarHBondContact O-CG 3.24Å; S6-Q10 PolarHBondContact O-N 2.83Å; S7-Q10 PolarHBondContact O-N 3.46Å; V8-Q10 VanDerWaalsContact C-N 3.34Å; Q10-L12 VanDerWaalsContact C-N 3.31Å; Q10-L12 PolarHBondContact O-N 3.4Å; Q10-L13 PolarHBondContact O-N 3.21Å; Q10-G14 PolarHBondContact O-N 3.37Å; Q10-F216 HydrophobicContact CB-CB 3.96Å; Q10-F216 HydrophobicContact CB-CD1 3.31Å; Q10-F216 HydrophobicContact CB-CD2 4.28Å; Q10-F216 HydrophobicContact CB-CE1 3.87Å; Q10-F216 HydrophobicContact CB-CG 3.58Å; Q10-F216 HydrophobicContact CG-CD1 4.07Å
11A92Very high88.9Confident0 Ų055.6 Ų55.60%031%0.307CS..Hα-helixtrans-59.3-45175.700000111.1S7 V8 G14 T15 F216 A281S7-A11 WeakPolarHBondContact O-CB 3.22Å; S7-A11 PolarHBondContact O-N 2.94Å; V8-A11 PolarHBondContact O-N 3.47Å; A11-G14 PolarHBondContact O-N 3.44Å; A11-T15 WeakPolarHBondContact O-CB 3.37Å; A11-T15 WeakPolarHBondContact O-CG2 3.39Å; A11-T15 PolarHBondContact O-N 2.98Å; A11-T15 PolarHBondContact O-OG1 3.24Å; A11-F216 HydrophobicContact CB-CB 4.07Å; A11-A281 HydrophobicContact CB-CB 3.49Å; A11-A281 VanDerWaalsContact CB-CB 3.49Å
12L93.6Very high90.2Very high62 Ų6253.4 Ų53.433%0.32530%0.297SS..Hα-helixtrans-60.9-49.4174.5-173.1145.1000110.8V8 F9 Q10 G14 T15 F16 V278V8-L12 WeakPolarHBondContact O-CB 3.38Å; V8-L12 PolarHBondContact O-N 2.84Å; F9-L12 PolarHBondContact O-N 3.11Å; Q10-L12 VanDerWaalsContact C-N 3.31Å; Q10-L12 PolarHBondContact O-N 3.4Å; L12-G14 VanDerWaalsContact C-N 3.34Å; L12-G14 PolarHBondContact O-N 3.18Å; L12-T15 PolarHBondContact O-N 3.42Å; L12-T15 PolarHBondContact O-OG1 2.85Å; L12-F16 HydrophobicContact CD1-CE2 4.25Å; L12-F16 HydrophobicContact CD2-CD2 3.43Å; L12-F16 VanDerWaalsContact CD2-CD2 3.43Å; L12-F16 HydrophobicContact CD2-CE2 3.61Å; L12-F16 HydrophobicContact CG-CD2 3.68Å; L12-F16 HydrophobicContact CG-CE2 3.72Å; L12-F16 WeakPolarHBondContact O-CB 3.47Å; L12-F16 VanDerWaalsContact O-CD2 3.29Å; L12-F16 WeakPolarHBondContact O-CD2 3.48Å; L12-F16 PolarHBondContact O-N 3.45Å; L12-V278 HydrophobicContact CB-CG2 4.26Å; L12-V278 HydrophobicContact CD1-CG2 4.12Å; L12-V278 HydrophobicContact CG-CG2 4.49Å
13L94.5Very high91Very high54 Ų5449.4 Ų49.428%0.28328%0.278SS..Hα-helixtrans-64.4-37.4-179.8-173.158.5000112.9L2 F9 Q10 F17L2-L13 HydrophobicContact CG-CD2 4.33Å; F9-L13 HydrophobicContact CE1-CD2 4.35Å; F9-L13 VanDerWaalsContact O-CB 3.32Å; F9-L13 WeakPolarHBondContact O-CB 3.19Å; F9-L13 PolarHBondContact O-N 3.06Å; Q10-L13 PolarHBondContact O-N 3.21Å; L13-F17 WeakPolarHBondContact O-CB 3.32Å; L13-F17 PolarHBondContact O-N 3.21Å; L13-F17 VanDerWaalsContact O-N 3.11Å
14G93.8Very high92Very high0 Ų044.4 Ų44.40%026%0.262CS..Hα-helixtrans-66-46.4175.100000111.8Q10 A11 L12 F17 T18Q10-G14 PolarHBondContact O-N 3.37Å; A11-G14 PolarHBondContact O-N 3.44Å; L12-G14 VanDerWaalsContact C-N 3.34Å; L12-G14 PolarHBondContact O-N 3.18Å; G14-F17 VanDerWaalsContact O-CB 3.32Å; G14-F17 WeakPolarHBondContact O-CB 3.46Å; G14-F17 PolarHBondContact O-N 2.99Å; G14-F17 VanDerWaalsContact O-N 3.15Å; G14-T18 WeakPolarHBondContact O-CG2 3.48Å; G14-T18 PolarHBondContact O-N 3.29Å
15T94.6Very high92.7Very high0 Ų040.4 Ų40.40%022%0.22CC..Hα-helixtrans-75.2-27.4179.8500000114.2A11 L12 F17 T18 W19 V212 E273 P274A11-T15 WeakPolarHBondContact O-CB 3.37Å; A11-T15 WeakPolarHBondContact O-CG2 3.39Å; A11-T15 PolarHBondContact O-N 2.98Å; A11-T15 PolarHBondContact O-OG1 3.24Å; L12-T15 PolarHBondContact O-N 3.42Å; L12-T15 PolarHBondContact O-OG1 2.85Å; T15-F17 VanDerWaalsContact C-N 3.29Å; T15-T18 VanDerWaalsContact CA-OG1 3.32Å; T15-T18 WeakPolarHBondContact CA-OG1 3.44Å; T15-T18 PolarHBondContact O-OG1 3.16Å; T15-W19 WeakPolarHBondContact O-CB 3.42Å; T15-W19 PolarHBondContact O-N 3.29Å; T15-V212 HydrophobicContact CG2-CB 3.79Å; T15-V212 HydrophobicContact CG2-CG1 3.67Å; T15-E273 WeakPolarHBondContact CG2-O 3.33Å; T15-P274 WeakPolarHBondContact OG1-CA 3.43Å
16F96.1Very high93Very high95 Ų9535.6 Ų35.642%0.41720%0.198SC..Hα-helixtrans-67.6-32.9166.5-94.9-79.2000112L12 W19 G20 P274L12-F16 HydrophobicContact CD1-CE2 4.25Å; L12-F16 HydrophobicContact CD2-CD2 3.43Å; L12-F16 VanDerWaalsContact CD2-CD2 3.43Å; L12-F16 HydrophobicContact CD2-CE2 3.61Å; L12-F16 HydrophobicContact CG-CD2 3.68Å; L12-F16 HydrophobicContact CG-CE2 3.72Å; L12-F16 WeakPolarHBondContact O-CB 3.47Å; L12-F16 VanDerWaalsContact O-CD2 3.29Å; L12-F16 WeakPolarHBondContact O-CD2 3.48Å; L12-F16 PolarHBondContact O-N 3.45Å; F16-W19 AromaticContact CD1-CE3 3.58Å; F16-W19 HydrophobicContact CD1-CE3 3.58Å; F16-W19 AromaticContact CD1-CZ3 3.63Å; F16-W19 HydrophobicContact CD1-CZ3 3.63Å; F16-W19 AromaticContact CE1-CE3 3.97Å; F16-W19 HydrophobicContact CE1-CE3 3.97Å; F16-W19 AromaticContact CE1-CZ3 3.72Å; F16-W19 HydrophobicContact CE1-CZ3 3.72Å; F16-G20 WeakPolarHBondContact O-CA 3.31Å; F16-G20 PolarHBondContact O-N 3.44Å; F16-P274 HydrophobicContact CD2-CB 4.49Å; F16-P274 HydrophobicContact CE2-CB 4.38Å
17F95.7Very high93.2Very high80 Ų8033.4 Ų33.435%0.35119%0.185SC..Hα-helixtrans-67-48.2173.6166.6-94.8000111L13 G14 T15 G20 M21L13-F17 WeakPolarHBondContact O-CB 3.32Å; L13-F17 PolarHBondContact O-N 3.21Å; L13-F17 VanDerWaalsContact O-N 3.11Å; G14-F17 VanDerWaalsContact O-CB 3.32Å; G14-F17 WeakPolarHBondContact O-CB 3.46Å; G14-F17 PolarHBondContact O-N 2.99Å; G14-F17 VanDerWaalsContact O-N 3.15Å; T15-F17 VanDerWaalsContact C-N 3.29Å; F17-G20 WeakPolarHBondContact O-CA 3.23Å; F17-G20 PolarHBondContact O-N 3.39Å; F17-G20 VanDerWaalsContact O-N 3.16Å; F17-M21 HydrophobicContact CE1-CG 4.23Å; F17-M21 HydrophobicContact CE2-CG 4.14Å; F17-M21 HydrophobicContact CE2-SD 4.28Å; F17-M21 HydrophobicContact CZ-CG 3.93Å; F17-M21 HydrophobicContact CZ-SD 4.29Å; F17-M21 WeakPolarHBondContact O-CG 3.44Å; F17-M21 PolarHBondContact O-N 3.36Å
18T94.3Very high93.2Very high0 Ų033.1 Ų33.10%018%0.179CC..Hα-helixtrans-62.6-47.4179.257.10000111.6G14 T15 G20 M21 T22 V212 A234 I237 E273G14-T18 WeakPolarHBondContact O-CG2 3.48Å; G14-T18 PolarHBondContact O-N 3.29Å; T15-T18 VanDerWaalsContact CA-OG1 3.32Å; T15-T18 WeakPolarHBondContact CA-OG1 3.44Å; T15-T18 PolarHBondContact O-OG1 3.16Å; T18-G20 VanDerWaalsContact C-N 3.29Å; T18-G20 PolarHBondContact O-N 2.77Å; T18-M21 WeakPolarHBondContact O-CB 3.22Å; T18-M21 PolarHBondContact O-N 3.29Å; T18-T22 PolarHBondContact O-N 2.98Å; T18-T22 VanDerWaalsContact O-N 3.1Å; T18-T22 PolarHBondContact O-OG1 3.02Å; T18-V212 HydrophobicContact CG2-CG2 4.35Å; T18-A234 HydrophobicContact CG2-CB 4.38Å; T18-A234 VanDerWaalsContact CG2-O 3.3Å; T18-A234 WeakPolarHBondContact CG2-O 3.25Å; T18-I237 HydrophobicContact CG2-CB 4.07Å; T18-I237 HydrophobicContact CG2-CG2 3.71Å; T18-E273 VanDerWaalsContact C-OE2 3.24Å; T18-E273 WeakPolarHBondContact CB-OE2 3.26Å; T18-E273 PolarHBondContact OG1-OE2 2.88Å
19W95.9Very high93.2Very high64 Ų6431.3 Ų31.324%0.24217%0.169CC..Hα-helixtrans-59.6-39.4172.216764.3000112.4T15 F16 M21 T22 A23 Q267 G270 E273 P274T15-W19 WeakPolarHBondContact O-CB 3.42Å; T15-W19 PolarHBondContact O-N 3.29Å; F16-W19 AromaticContact CD1-CE3 3.58Å; F16-W19 HydrophobicContact CD1-CE3 3.58Å; F16-W19 AromaticContact CD1-CZ3 3.63Å; F16-W19 HydrophobicContact CD1-CZ3 3.63Å; F16-W19 AromaticContact CE1-CE3 3.97Å; F16-W19 HydrophobicContact CE1-CE3 3.97Å; F16-W19 AromaticContact CE1-CZ3 3.72Å; F16-W19 HydrophobicContact CE1-CZ3 3.72Å; W19-M21 PolarHBondContact O-N 2.64Å; W19-T22 WeakPolarHBondContact O-CB 3.4Å; W19-T22 PolarHBondContact O-N 3.17Å; W19-T22 VanDerWaalsContact O-N 3.15Å; W19-A23 PolarHBondContact O-N 2.89Å; W19-Q267 VanDerWaalsContact CE2-OE1 3.3Å; W19-Q267 PolarHBondContact NE1-O 2.87Å; W19-G270 VanDerWaalsContact CD1-C 3.45Å; W19-E273 PolarHBondContact N-OE2 2.84Å; W19-E273 VanDerWaalsContact N-OE2 3.09Å; W19-P274 HydrophobicContact CB-CG 4.04Å; W19-P274 HydrophobicContact CG-CG 4.44Å
20G96.3Very high93Very high29 Ų2932.2 Ų32.230%0.29917%0.172SC..Hα-helixtrans-59.7-35.517600000112.4F16 F17 T18 A23 A24F16-G20 WeakPolarHBondContact O-CA 3.31Å; F16-G20 PolarHBondContact O-N 3.44Å; F17-G20 WeakPolarHBondContact O-CA 3.23Å; F17-G20 PolarHBondContact O-N 3.39Å; F17-G20 VanDerWaalsContact O-N 3.16Å; T18-G20 VanDerWaalsContact C-N 3.29Å; T18-G20 PolarHBondContact O-N 2.77Å; G20-A23 PolarHBondContact O-N 3.29Å; G20-A24 WeakPolarHBondContact O-CB 3.46Å; G20-A24 PolarHBondContact O-N 3.29Å
21M94.1Very high92.6Very high48 Ų4837.3 Ų37.324%0.23620%0.204CC..Hα-helixtrans-70.4-40.6173.6-66.6-66.7-7400112F17 T18 W19 A23 A24 G25 G238 N241 F242F17-M21 HydrophobicContact CE1-CG 4.23Å; F17-M21 HydrophobicContact CE2-CG 4.14Å; F17-M21 HydrophobicContact CE2-SD 4.28Å; F17-M21 HydrophobicContact CZ-CG 3.93Å; F17-M21 HydrophobicContact CZ-SD 4.29Å; F17-M21 WeakPolarHBondContact O-CG 3.44Å; F17-M21 PolarHBondContact O-N 3.36Å; T18-M21 WeakPolarHBondContact O-CB 3.22Å; T18-M21 PolarHBondContact O-N 3.29Å; W19-M21 PolarHBondContact O-N 2.64Å; M21-A23 VanDerWaalsContact C-N 3.32Å; M21-A23 PolarHBondContact O-N 3.22Å; M21-A24 PolarHBondContact O-N 2.87Å; M21-G25 PolarHBondContact O-N 3.46Å; M21-G238 WeakPolarHBondContact CB-O 3.4Å; M21-G238 WeakPolarHBondContact CE-O 3.19Å; M21-G238 VanDerWaalsContact CG-O 3.27Å; M21-G238 WeakPolarHBondContact CG-O 3.44Å; M21-N241 HydrophobicContact CB-CB 4.46Å; M21-F242 HydrophobicContact CB-CB 4.43Å; M21-F242 HydrophobicContact CE-CB 4.03Å; M21-F242 HydrophobicContact CE-CD2 4.31Å; M21-F242 WeakPolarHBondContact O-CA 3.47Å
22T92.9Very high91.7Very high0 Ų040.9 Ų40.90%022%0.219CC..Hα-helixtrans-56.1-47.2169.9-41.50000111.2T18 W19 A24 G25 A26 N241 G245 E273T18-T22 PolarHBondContact O-N 2.98Å; T18-T22 VanDerWaalsContact O-N 3.1Å; T18-T22 PolarHBondContact O-OG1 3.02Å; W19-T22 WeakPolarHBondContact O-CB 3.4Å; W19-T22 PolarHBondContact O-N 3.17Å; W19-T22 VanDerWaalsContact O-N 3.15Å; T22-A24 PolarHBondContact O-N 2.92Å; T22-G25 PolarHBondContact O-N 3.46Å; T22-A26 WeakPolarHBondContact O-CB 3.14Å; T22-A26 PolarHBondContact O-N 3.39Å; T22-N241 WeakPolarHBondContact CA-O 3.27Å; T22-N241 WeakPolarHBondContact OG1-CB 3.37Å; T22-G245 WeakPolarHBondContact O-CA 3.4Å; T22-E273 PolarHBondContact OG1-OE1 3.34Å
23A95.4Very high90.1Very high18 Ų1841.6 Ų41.615%0.14923%0.23CC..Hα-helixtrans-63.7-41.4177.700000112.1W19 G20 M21 A26 A27 Q267W19-A23 PolarHBondContact O-N 2.89Å; G20-A23 PolarHBondContact O-N 3.29Å; M21-A23 VanDerWaalsContact C-N 3.32Å; M21-A23 PolarHBondContact O-N 3.22Å; A23-A26 PolarHBondContact O-N 3.1Å; A23-A27 WeakPolarHBondContact O-CB 3.43Å; A23-A27 PolarHBondContact O-N 3.08Å; A23-Q267 HydrophobicContact CB-CB 3.82Å
24A93.8Very high88.5Confident41 Ų4142.1 Ų42.134%0.33924%0.238SC..Hα-helixtrans-63.7-41.4176.800000111.9G20 M21 T22 A27 F242G20-A24 WeakPolarHBondContact O-CB 3.46Å; G20-A24 PolarHBondContact O-N 3.29Å; M21-A24 PolarHBondContact O-N 2.87Å; T22-A24 PolarHBondContact O-N 2.92Å; A24-A27 PolarHBondContact O-N 3.35Å; A24-F242 HydrophobicContact CB-CD2 3.87Å; A24-F242 HydrophobicContact CB-CE2 3.85Å
25G89.6Confident86.9Confident0 Ų044.9 Ų44.90%027%0.267CS..Hα-helixtrans-60.2-49.2171.800000112.7M21 T22 A27 L28 F242M21-G25 PolarHBondContact O-N 3.46Å; T22-G25 PolarHBondContact O-N 3.46Å; G25-A27 VanDerWaalsContact C-N 3.25Å; G25-A27 PolarHBondContact O-N 2.75Å; G25-L28 VanDerWaalsContact O-CB 3.31Å; G25-L28 WeakPolarHBondContact O-CB 3.36Å; G25-L28 PolarHBondContact O-N 3.33Å; G25-L28 VanDerWaalsContact O-N 3.12Å; G25-F242 WeakPolarHBondContact CA-O 3.35Å
26A92.1Very high85.8Confident0 Ų050.3 Ų50.30%029%0.292CS..Hα-helixtrans-60-36176.800000112.3T22 A23 L28 V29 G245 S249 F263T22-A26 WeakPolarHBondContact O-CB 3.14Å; T22-A26 PolarHBondContact O-N 3.39Å; A23-A26 PolarHBondContact O-N 3.1Å; A26-L28 PolarHBondContact O-N 2.73Å; A26-V29 WeakPolarHBondContact O-CB 3.48Å; A26-V29 WeakPolarHBondContact O-CG1 3.47Å; A26-V29 PolarHBondContact O-N 3.07Å; A26-G245 VanDerWaalsContact CA-O 3.32Å; A26-G245 WeakPolarHBondContact CA-O 3.42Å; A26-S249 PolarHBondContact O-OG 3Å; A26-F263 HydrophobicContact CB-CD2 3.99Å; A26-F263 HydrophobicContact CB-CE2 4.42Å
27A93.5Very high84.9Confident33 Ų3352 Ų5227%0.27330%0.295SS..Hα-helixtrans-66.6-16.8178.900000113.6A23 A24 G25 V29 F30 F263A23-A27 WeakPolarHBondContact O-CB 3.43Å; A23-A27 PolarHBondContact O-N 3.08Å; A24-A27 PolarHBondContact O-N 3.35Å; G25-A27 VanDerWaalsContact C-N 3.25Å; G25-A27 PolarHBondContact O-N 2.75Å; A27-V29 PolarHBondContact O-N 3.41Å; A27-F30 HydrophobicContact CB-CD2 4.21Å; A27-F30 HydrophobicContact CB-CE2 4.49Å; A27-F30 WeakPolarHBondContact O-CB 3.4Å; A27-F30 WeakPolarHBondContact O-CD2 3.25Å; A27-F30 PolarHBondContact O-N 2.92Å; A27-F263 HydrophobicContact CB-CD2 4.13Å; A27-F263 HydrophobicContact CB-CE2 3.95Å
28L87.8Confident84.3Confident40 Ų4056.7 Ų56.721%0.20931%0.311CS..G310 helixtrans-61.3-16.9173.6-73.6-177000113.2G25 A26 F30 V31 F32 F242 L246G25-L28 VanDerWaalsContact O-CB 3.31Å; G25-L28 WeakPolarHBondContact O-CB 3.36Å; G25-L28 PolarHBondContact O-N 3.33Å; G25-L28 VanDerWaalsContact O-N 3.12Å; A26-L28 PolarHBondContact O-N 2.73Å; L28-F30 PolarHBondContact O-N 2.89Å; L28-V31 PolarHBondContact O-N 3.05Å; L28-F32 HydrophobicContact CB-CD2 3.89Å; L28-F32 HydrophobicContact CB-CE2 4.07Å; L28-F32 HydrophobicContact CD1-CE2 4.02Å; L28-F32 HydrophobicContact CD2-CE2 4.01Å; L28-F32 HydrophobicContact CG-CE2 4.28Å; L28-F32 WeakPolarHBondContact O-CD2 3.43Å; L28-F32 PolarHBondContact O-N 3.15Å; L28-F242 HydrophobicContact CD1-CE1 3.41Å; L28-F242 VanDerWaalsContact CD1-CE1 3.41Å; L28-F242 HydrophobicContact CD1-CZ 3.4Å; L28-F242 VanDerWaalsContact CD1-CZ 3.4Å; L28-F242 HydrophobicContact CD2-CZ 4.36Å; L28-F242 HydrophobicContact CG-CE1 4.34Å; L28-F242 HydrophobicContact CG-CZ 3.88Å; L28-L246 HydrophobicContact CB-CD1 3.93Å; L28-L246 HydrophobicContact CD1-CD1 3.57Å; L28-L246 HydrophobicContact CG-CD1 4.42Å
29V87.2Confident83.5Confident4 Ų460.4 Ų60.42%0.02433%0.33CS..G310 helixtrans-61.6-20.4171.176.70000113.6A26 A27 L250 R253 T259 A262 F263A26-V29 WeakPolarHBondContact O-CB 3.48Å; A26-V29 WeakPolarHBondContact O-CG1 3.47Å; A26-V29 PolarHBondContact O-N 3.07Å; A27-V29 PolarHBondContact O-N 3.41Å; V29-L250 HydrophobicContact CG2-CD2 4.36Å; V29-R253 HydrophobicContact CG2-CB 3.64Å; V29-R253 HydrophobicContact CG2-CG 3.76Å; V29-T259 HydrophobicContact CB-CG2 4.48Å; V29-T259 HydrophobicContact CG1-CG2 3.8Å; V29-T259 HydrophobicContact CG2-CG2 4.3Å; V29-T259 WeakPolarHBondContact O-CG2 3.47Å; V29-A262 HydrophobicContact CG2-CB 4.14Å; V29-F263 HydrophobicContact CG1-CB 4.09Å
30F88.4Confident82.6Confident104 Ų10458.6 Ų58.646%0.45633%0.325SS..G310 helixtrans-76.7-26.6172.3-64.4-75.1000112.7A27 L28 T259 W260 F263A27-F30 HydrophobicContact CB-CD2 4.21Å; A27-F30 HydrophobicContact CB-CE2 4.49Å; A27-F30 WeakPolarHBondContact O-CB 3.4Å; A27-F30 WeakPolarHBondContact O-CD2 3.25Å; A27-F30 PolarHBondContact O-N 2.92Å; L28-F30 PolarHBondContact O-N 2.89Å; F30-T259 HydrophobicContact CB-CG2 4.46Å; F30-T259 HydrophobicContact CD1-CG2 3.29Å; F30-T259 HydrophobicContact CE1-CG2 3.45Å; F30-T259 VanDerWaalsContact CE1-CG2 3.45Å; F30-T259 HydrophobicContact CG-CG2 3.91Å; F30-T259 HydrophobicContact CZ-CG2 4.16Å; F30-W260 AromaticContact CE1-CE3 3.89Å; F30-W260 HydrophobicContact CE1-CE3 3.89Å; F30-W260 HydrophobicContact CE1-CZ3 4.34Å; F30-W260 HydrophobicContact CE2-CZ3 4.41Å; F30-W260 AromaticContact CZ-CE3 3.44Å; F30-W260 HydrophobicContact CZ-CE3 3.44Å; F30-W260 VanDerWaalsContact CZ-CE3 3.44Å; F30-W260 AromaticContact CZ-CZ3 3.67Å; F30-W260 HydrophobicContact CZ-CZ3 3.67Å; F30-F263 HydrophobicContact CE2-CB 3.71Å; F30-F263 HydrophobicContact CE2-CD1 4.16Å; F30-F263 AromaticContact CE2-CD2 3.88Å; F30-F263 HydrophobicContact CE2-CD2 3.88Å; F30-F263 AromaticContact CE2-CG 3.63Å; F30-F263 HydrophobicContact CE2-CG 3.63Å; F30-F263 HydrophobicContact CZ-CB 3.72Å; F30-F263 HydrophobicContact CZ-CD1 4.19Å; F30-F263 AromaticContact CZ-CG 3.92Å; F30-F263 HydrophobicContact CZ-CG 3.92Å
31V84.1Confident82Confident112 Ų11257.2 Ų57.268%0.67931%0.311SS*.THydrogen-bonded Turntrans-93.4-45.6-178-1780000110.6L28L28-V31 PolarHBondContact O-N 3.05Å
32F71.6Confident81.5Confident74 Ų7455.5 Ų55.533%0.32531%0.305SS..SBendtrans-89.4114.9-179.4-62.5-66000110.9L28 I39L28-F32 HydrophobicContact CB-CD2 3.89Å; L28-F32 HydrophobicContact CB-CE2 4.07Å; L28-F32 HydrophobicContact CD1-CE2 4.02Å; L28-F32 HydrophobicContact CD2-CE2 4.01Å; L28-F32 HydrophobicContact CG-CE2 4.28Å; L28-F32 WeakPolarHBondContact O-CD2 3.43Å; L28-F32 PolarHBondContact O-N 3.15Å; F32-I39 HydrophobicContact CD1-CG2 3.64Å; F32-I39 HydrophobicContact CE1-CG2 3.82Å; F32-I39 HydrophobicContact CG-CG2 4.39Å
33S60.9Low80.8Confident77 Ų7756.7 Ų56.754%0.53831%0.314SS..  trans-79.2146.9170.399.60000110.5G35S33-G35 PolarHBondContact O-N 3.05Å; S33-G35 PolarHBondContact OG-N 2.93Å
34S60.3Low80.1Confident66 Ų6656.1 Ų56.146%0.46231%0.308SS..THydrogen-bonded Turntrans-62.2-1.7174.152.30000114.3
35G59.4Low79.8Confident58 Ų5854.3 Ų54.360%0.59829%0.293SS*.THydrogen-bonded Turntrans-74-24.7-178.800000115.4S33S33-G35 PolarHBondContact O-N 3.05Å; S33-G35 PolarHBondContact OG-N 2.93Å
36Q73.2Confident79.6Confident113 Ų11357.3 Ų57.353%0.52831%0.306SS..  trans-102.486.7178.8-90.98411.200112.1R38 I39 L40Q36-R38 PolarHBondContact O-N 3.44Å; Q36-R38 VanDerWaalsContact O-N 3.11Å; Q36-I39 HydrophobicContact CB-CB 4.07Å; Q36-I39 HydrophobicContact CB-CD1 3.69Å; Q36-I39 HydrophobicContact CB-CG1 3.85Å; Q36-I39 HydrophobicContact CG-CD1 3.95Å; Q36-I39 HydrophobicContact CG-CG1 4.4Å; Q36-I39 PolarHBondContact O-N 2.88Å; Q36-L40 PolarHBondContact O-N 3.32Å; Q36-L40 VanDerWaalsContact O-N 3.17Å
37R76.9Confident79.1Confident131 Ų13157.3 Ų57.349%0.49431%0.306SS..Hα-helixtrans-49.4-37174.1-76.1-71.6-171.8168.5-4.3113.8I39 L40 D41R37-I39 PolarHBondContact O-N 3.38Å; R37-L40 PolarHBondContact O-N 2.87Å; R37-D41 WeakPolarHBondContact O-CB 3.19Å; R37-D41 PolarHBondContact O-N 2.89Å
38R81.5Confident78.8Confident178 Ų17855.7 Ų55.767%0.67229%0.293SS*.Hα-helixtrans-61.9-39.8176.2-76.3-176177.2175.32.9113.8Q36 G42 N319 L322Q36-R38 PolarHBondContact O-N 3.44Å; Q36-R38 VanDerWaalsContact O-N 3.11Å; R38-G42 PolarHBondContact O-N 3.49Å; R38-G42 VanDerWaalsContact O-N 3.09Å; R38-N319 WeakPolarHBondContact CG-OD1 3.3Å; R38-L322 WeakPolarHBondContact O-CD2 3.42Å
39I78.5Confident78.9Confident78 Ų7853.8 Ų53.840%0.428%0.283SS..Hα-helixtrans-72.4-42.4-179.4-63.4176.3000109.1F32 Q36 R37 G42 S43F32-I39 HydrophobicContact CD1-CG2 3.64Å; F32-I39 HydrophobicContact CE1-CG2 3.82Å; F32-I39 HydrophobicContact CG-CG2 4.39Å; Q36-I39 HydrophobicContact CB-CB 4.07Å; Q36-I39 HydrophobicContact CB-CD1 3.69Å; Q36-I39 HydrophobicContact CB-CG1 3.85Å; Q36-I39 HydrophobicContact CG-CD1 3.95Å; Q36-I39 HydrophobicContact CG-CG1 4.4Å; Q36-I39 PolarHBondContact O-N 2.88Å; R37-I39 PolarHBondContact O-N 3.38Å; I39-G42 PolarHBondContact O-N 2.79Å; I39-S43 WeakPolarHBondContact O-CB 3.42Å; I39-S43 PolarHBondContact O-N 3.46Å; I39-S43 PolarHBondContact O-OG 2.96Å; I39-S43 VanDerWaalsContact O-OG 3.12Å
40L77.4Confident78.8Confident27 Ų2753.8 Ų53.814%0.14128%0.283CS..Hα-helixtrans-59.4-52.9176177.263.2000112.2Q36 R37 G42 S43 L44 L250Q36-L40 PolarHBondContact O-N 3.32Å; Q36-L40 VanDerWaalsContact O-N 3.17Å; R37-L40 PolarHBondContact O-N 2.87Å; L40-G42 VanDerWaalsContact C-N 3.27Å; L40-G42 PolarHBondContact O-N 2.81Å; L40-S43 WeakPolarHBondContact CA-OG 3.3Å; L40-S43 PolarHBondContact O-N 3.3Å; L40-S43 PolarHBondContact O-OG 3.04Å; L40-L44 HydrophobicContact CD1-CD1 4.02Å; L40-L44 HydrophobicContact CD1-CG 4.2Å; L40-L44 HydrophobicContact CG-CD1 4.04Å; L40-L44 WeakPolarHBondContact O-CB 3.1Å; L40-L44 VanDerWaalsContact O-CG 3.3Å; L40-L44 WeakPolarHBondContact O-CG 3.28Å; L40-L44 PolarHBondContact O-N 3.31Å; L40-L250 HydrophobicContact CD1-CB 3.67Å; L40-L250 HydrophobicContact CD1-CD1 3.57Å; L40-L250 HydrophobicContact CD1-CG 4.14Å
41D83.3Confident78.8Confident0 Ų049 Ų490%026%0.262CS..Hα-helixtrans-63.2-36.8-179.6-63.5-13.6000111.2R37 G45 A314 S317 N319R37-D41 WeakPolarHBondContact O-CB 3.19Å; R37-D41 PolarHBondContact O-N 2.89Å; D41-G45 PolarHBondContact O-N 3.09Å; D41-A314 WeakPolarHBondContact CB-O 3.12Å; D41-S317 PolarHBondContact OD1-OG 3.22Å; D41-S317 VanDerWaalsContact OD1-OG 3.08Å; D41-S317 WeakPolarHBondContact OD2-CB 3.41Å; D41-S317 PolarHBondContact OD2-OG 3.04Å; D41-N319 HydrophobicContact CB-CB 4.03Å; D41-N319 WeakPolarHBondContact OD2-CB 3.32Å; D41-N319 PolarHBondContact OD2-ND2 2.84Å
42G84.1Confident79.1Confident12 Ų1245.5 Ų45.512%0.12424%0.239CC..Hα-helixtrans-65.7-45173.800000113R38 I39 L40 G45 F46 A326R38-G42 PolarHBondContact O-N 3.49Å; R38-G42 VanDerWaalsContact O-N 3.09Å; I39-G42 PolarHBondContact O-N 2.79Å; L40-G42 VanDerWaalsContact C-N 3.27Å; L40-G42 PolarHBondContact O-N 2.81Å; G42-G45 PolarHBondContact O-N 2.94Å; G42-F46 WeakPolarHBondContact O-CB 3.31Å; G42-F46 PolarHBondContact O-N 2.79Å; G42-A326 WeakPolarHBondContact O-CB 3.37Å
43S77.6Confident80Confident25 Ų2542 Ų4218%0.17522%0.224CC..Hα-helixtrans-67.1-38.4178.460.50000112I39 L40 F46 A47I39-S43 WeakPolarHBondContact O-CB 3.42Å; I39-S43 PolarHBondContact O-N 3.46Å; I39-S43 PolarHBondContact O-OG 2.96Å; I39-S43 VanDerWaalsContact O-OG 3.12Å; L40-S43 WeakPolarHBondContact CA-OG 3.3Å; L40-S43 PolarHBondContact O-N 3.3Å; L40-S43 PolarHBondContact O-OG 3.04Å; S43-F46 PolarHBondContact O-N 3.33Å; S43-A47 WeakPolarHBondContact O-CB 3.35Å; S43-A47 PolarHBondContact O-N 2.79Å
44L80.6Confident81Confident6 Ų638.3 Ų38.33%0.03120%0.198CC..Hα-helixtrans-66.2-43.7174.9-70.8172.1000111.4L40 A47 A48 I310 E313 A314L40-L44 HydrophobicContact CD1-CD1 4.02Å; L40-L44 HydrophobicContact CD1-CG 4.2Å; L40-L44 HydrophobicContact CG-CD1 4.04Å; L40-L44 WeakPolarHBondContact O-CB 3.1Å; L40-L44 VanDerWaalsContact O-CG 3.3Å; L40-L44 WeakPolarHBondContact O-CG 3.28Å; L40-L44 PolarHBondContact O-N 3.31Å; L44-A47 PolarHBondContact O-N 3.21Å; L44-A48 PolarHBondContact O-N 2.74Å; L44-I310 HydrophobicContact CB-CG2 4.29Å; L44-I310 HydrophobicContact CD2-CG2 4.45Å; L44-I310 VanDerWaalsContact O-CG2 3.3Å; L44-I310 WeakPolarHBondContact O-CG2 3.42Å; L44-E313 HydrophobicContact CD1-CB 4.49Å; L44-E313 HydrophobicContact CD1-CG 3.91Å; L44-A314 HydrophobicContact CB-CB 3.76Å
45G87.6Confident82.3Confident2 Ų235.2 Ų35.22%0.02118%0.177CC..Hα-helixtrans-58.1-49173.100000111.9D41 G42 A47 A48 G49 A323 S327D41-G45 PolarHBondContact O-N 3.09Å; G42-G45 PolarHBondContact O-N 2.94Å; G45-A47 PolarHBondContact O-N 3.4Å; G45-A48 WeakPolarHBondContact O-CB 3.48Å; G45-A48 PolarHBondContact O-N 2.95Å; G45-G49 PolarHBondContact O-N 3.43Å; G45-A323 WeakPolarHBondContact CA-O 3.37Å; G45-S327 WeakPolarHBondContact O-CA 3.49Å; G45-S327 WeakPolarHBondContact O-CB 3.37Å; G45-S327 PolarHBondContact O-N 2.86Å
46F86Confident83.8Confident63 Ų6338.6 Ų38.628%0.27617%0.172SC..Hα-helixtrans-56.4-47.7175.1-179.8-92.5000112.3G42 S43 A48 G49 V50 P243 A326 L329 G330 V333G42-F46 WeakPolarHBondContact O-CB 3.31Å; G42-F46 PolarHBondContact O-N 2.79Å; S43-F46 PolarHBondContact O-N 3.33Å; F46-A48 PolarHBondContact O-N 2.86Å; F46-G49 PolarHBondContact O-N 3.06Å; F46-G49 VanDerWaalsContact O-N 3.16Å; F46-V50 HydrophobicContact CD1-CG2 4.14Å; F46-V50 HydrophobicContact CE1-CG2 3.71Å; F46-V50 HydrophobicContact CZ-CG2 3.96Å; F46-V50 WeakPolarHBondContact O-CG2 3.21Å; F46-V50 PolarHBondContact O-N 2.85Å; F46-P243 HydrophobicContact CE1-CG 4.26Å; F46-A326 VanDerWaalsContact CA-O 3.31Å; F46-A326 WeakPolarHBondContact CA-O 3.38Å; F46-A326 HydrophobicContact CB-CB 4.17Å; F46-L329 HydrophobicContact CD2-CD2 4.48Å; F46-L329 HydrophobicContact CD2-CG 4.37Å; F46-L329 HydrophobicContact CE2-CG 4.27Å; F46-G330 VanDerWaalsContact CD2-CA 3.44Å; F46-G330 VanDerWaalsContact CE2-CA 3.41Å; F46-V333 HydrophobicContact CE2-CG2 4.45Å; F46-V333 HydrophobicContact CZ-CG1 4.48Å
47A81.1Confident84.4Confident0 Ų036 Ų360%016%0.158CC..Hα-helixtrans-59.8-45.9177.200000112.2S43 L44 G45 G49 V50 M51 P243S43-A47 WeakPolarHBondContact O-CB 3.35Å; S43-A47 PolarHBondContact O-N 2.79Å; L44-A47 PolarHBondContact O-N 3.21Å; G45-A47 PolarHBondContact O-N 3.4Å; A47-G49 VanDerWaalsContact C-N 3.26Å; A47-G49 PolarHBondContact O-N 3.5Å; A47-V50 PolarHBondContact O-N 3.24Å; A47-M51 WeakPolarHBondContact O-CB 3.36Å; A47-M51 VanDerWaalsContact O-CG 3.3Å; A47-M51 WeakPolarHBondContact O-CG 3.41Å; A47-M51 PolarHBondContact O-N 3.42Å; A47-P243 HydrophobicContact CB-CB 3.8Å
48A87.1Confident84.4Confident0 Ų030 Ų300%014%0.136CC..Hα-helixtrans-56.5-41.7174.300000112.2L44 G45 F46 L52 V306 I310 I311L44-A48 PolarHBondContact O-N 2.74Å; G45-A48 WeakPolarHBondContact O-CB 3.48Å; G45-A48 PolarHBondContact O-N 2.95Å; F46-A48 PolarHBondContact O-N 2.86Å; A48-L52 WeakPolarHBondContact O-CB 3.34Å; A48-L52 VanDerWaalsContact O-CG 3.29Å; A48-L52 WeakPolarHBondContact O-CG 3.41Å; A48-L52 PolarHBondContact O-N 3.35Å; A48-V306 HydrophobicContact CB-CG1 3.71Å; A48-I310 HydrophobicContact CB-CB 4.33Å; A48-I310 HydrophobicContact CB-CG2 3.74Å; A48-I311 HydrophobicContact CB-CG1 3.86Å
49G90.7Very high84.6Confident0 Ų021.5 Ų21.50%010%0.104CC..Hα-helixtrans-59.7-50.1174.800000113.3G45 F46 A47 L52 A53 S327 F331G45-G49 PolarHBondContact O-N 3.43Å; F46-G49 PolarHBondContact O-N 3.06Å; F46-G49 VanDerWaalsContact O-N 3.16Å; A47-G49 VanDerWaalsContact C-N 3.26Å; A47-G49 PolarHBondContact O-N 3.5Å; G49-L52 PolarHBondContact O-N 3.41Å; G49-A53 PolarHBondContact O-N 3.11Å; G49-A53 VanDerWaalsContact O-N 3.15Å; G49-S327 WeakPolarHBondContact CA-O 3.46Å; G49-S327 WeakPolarHBondContact CA-OG 3.48Å; G49-S327 PolarHBondContact N-OG 2.82Å; G49-F331 VanDerWaalsContact O-CA 3.32Å; G49-F331 WeakPolarHBondContact O-CA 3.41Å
50V85.4Confident85.1Confident4 Ų419.3 Ų19.32%0.0249%0.093CC..Hα-helixtrans-59.1-50.5177.31720000110.6F46 A47 L52 A53 A54 Q240 P243 G330 M334F46-V50 HydrophobicContact CD1-CG2 4.14Å; F46-V50 HydrophobicContact CE1-CG2 3.71Å; F46-V50 HydrophobicContact CZ-CG2 3.96Å; F46-V50 WeakPolarHBondContact O-CG2 3.21Å; F46-V50 PolarHBondContact O-N 2.85Å; A47-V50 PolarHBondContact O-N 3.24Å; V50-L52 VanDerWaalsContact C-N 3.35Å; V50-L52 PolarHBondContact O-N 2.9Å; V50-A53 PolarHBondContact O-N 3.39Å; V50-A54 WeakPolarHBondContact O-CB 3.31Å; V50-A54 PolarHBondContact O-N 3.48Å; V50-Q240 HydrophobicContact CG1-CB 3.79Å; V50-P243 HydrophobicContact CB-CG 4.17Å; V50-P243 HydrophobicContact CG1-CG 3.98Å; V50-P243 HydrophobicContact CG2-CG 4.12Å; V50-G330 WeakPolarHBondContact CG2-O 3.18Å; V50-M334 HydrophobicContact CB-CB 4.31Å; V50-M334 HydrophobicContact CG1-CB 4.01Å; V50-M334 HydrophobicContact CG1-CG 4.01Å; V50-M334 HydrophobicContact CG1-SD 3.94Å; V50-M334 HydrophobicContact CG2-CB 4.35Å
51M87.6Confident85.6Confident4 Ų419.6 Ų19.62%0.0210%0.099CC..Hα-helixtrans-62-38-178.4-69.617173.100112.7A47 A54 S55 E244 M302 V306 I310A47-M51 WeakPolarHBondContact O-CB 3.36Å; A47-M51 VanDerWaalsContact O-CG 3.3Å; A47-M51 WeakPolarHBondContact O-CG 3.41Å; A47-M51 PolarHBondContact O-N 3.42Å; M51-A54 PolarHBondContact O-N 3.45Å; M51-S55 VanDerWaalsContact O-CB 3.32Å; M51-S55 WeakPolarHBondContact O-CB 3.44Å; M51-S55 PolarHBondContact O-N 3.1Å; M51-S55 PolarHBondContact O-OG 3.46Å; M51-E244 HydrophobicContact CE-CG 4.42Å; M51-E244 HydrophobicContact CG-CG 4.33Å; M51-E244 HydrophobicContact SD-CG 4.26Å; M51-M302 HydrophobicContact CB-CG 3.97Å; M51-M302 HydrophobicContact CB-SD 3.82Å; M51-M302 HydrophobicContact CE-CE 4.22Å; M51-M302 HydrophobicContact CE-CG 3.73Å; M51-M302 HydrophobicContact CE-SD 4.42Å; M51-M302 HydrophobicContact CG-CE 4.46Å; M51-M302 HydrophobicContact CG-SD 4.28Å; M51-V306 HydrophobicContact CB-CG2 3.68Å; M51-V306 HydrophobicContact CE-CG2 3.96Å; M51-V306 HydrophobicContact SD-CG2 4.19Å; M51-I310 HydrophobicContact CE-CD1 3.78Å; M51-I310 HydrophobicContact SD-CD1 3.39Å; M51-I310 WeakPolarHBondContact SD-CD1 3.38Å
52L91.3Very high85.6Confident38 Ų3821.1 Ų21.120%0.19911%0.108CC..Hα-helixtrans-67.1-41.6175.8-74.9170.2000112.9A48 G49 V50 V303 V306 M307 I311 F331A48-L52 WeakPolarHBondContact O-CB 3.34Å; A48-L52 VanDerWaalsContact O-CG 3.29Å; A48-L52 WeakPolarHBondContact O-CG 3.41Å; A48-L52 PolarHBondContact O-N 3.35Å; G49-L52 PolarHBondContact O-N 3.41Å; V50-L52 VanDerWaalsContact C-N 3.35Å; V50-L52 PolarHBondContact O-N 2.9Å; L52-V303 HydrophobicContact CD2-CG2 4.33Å; L52-V306 HydrophobicContact CD1-CG1 3.9Å; L52-V306 HydrophobicContact CD2-CB 4.27Å; L52-V306 HydrophobicContact CD2-CG1 4.01Å; L52-V306 HydrophobicContact CG-CB 4.4Å; L52-V306 HydrophobicContact CG-CG1 3.76Å; L52-M307 HydrophobicContact CD1-CE 3.98Å; L52-M307 HydrophobicContact CD2-CE 3.69Å; L52-M307 HydrophobicContact CG-CE 4.48Å; L52-I311 HydrophobicContact CD1-CD1 4.27Å; L52-F331 HydrophobicContact CB-CD2 4.16Å; L52-F331 HydrophobicContact CB-CE2 4.34Å
53A89.7Confident85.7Confident0 Ų020.5 Ų20.50%010%0.102CC..Hα-helixtrans-63.5-49174.600000110.2G49 V50 S55 Y56 W57 F331 M334G49-A53 PolarHBondContact O-N 3.11Å; G49-A53 VanDerWaalsContact O-N 3.15Å; V50-A53 PolarHBondContact O-N 3.39Å; A53-S55 VanDerWaalsContact C-N 3.32Å; A53-S55 PolarHBondContact O-N 3.31Å; A53-Y56 PolarHBondContact O-N 2.86Å; A53-W57 HydrophobicContact CB-CE3 3.86Å; A53-W57 HydrophobicContact CB-CZ3 3.82Å; A53-W57 PolarHBondContact O-N 3.3Å; A53-F331 HydrophobicContact CB-CB 4.49Å; A53-F331 HydrophobicContact CB-CD1 4.39Å; A53-F331 HydrophobicContact CB-CD2 3.66Å; A53-F331 HydrophobicContact CB-CE2 3.89Å; A53-F331 HydrophobicContact CB-CG 3.94Å; A53-F331 HydrophobicContact CB-CZ 4.36Å; A53-M334 HydrophobicContact CB-CB 3.7Å; A53-M334 HydrophobicContact CB-CG 3.74Å
54A82.7Confident86.3Confident0 Ų022.5 Ų22.50%011%0.113CC..Hα-helixtrans-63.4-37.8-177.500000113V50 M51 Y56 W57 S58 L59 Q240 M334V50-A54 WeakPolarHBondContact O-CB 3.31Å; V50-A54 PolarHBondContact O-N 3.48Å; M51-A54 PolarHBondContact O-N 3.45Å; A54-Y56 PolarHBondContact O-N 3.38Å; A54-Y56 VanDerWaalsContact O-N 3.15Å; A54-W57 PolarHBondContact O-N 2.79Å; A54-S58 WeakPolarHBondContact O-CA 3.47Å; A54-S58 WeakPolarHBondContact O-CB 3.34Å; A54-S58 PolarHBondContact O-N 2.82Å; A54-L59 PolarHBondContact O-N 3.02Å; A54-Q240 HydrophobicContact CB-CB 3.93Å; A54-Q240 HydrophobicContact CB-CG 4.16Å; A54-M334 HydrophobicContact CB-CE 3.72Å; A54-M334 HydrophobicContact CB-CG 4.02Å; A54-M334 HydrophobicContact CB-SD 4.28Å
55S87.3Confident86.6Confident1 Ų128.2 Ų28.21%0.00714%0.14CC..Iπ-helixtrans-52.7-36.2171.2-67.50000112.8M51 A53 L60 A299 M302M51-S55 VanDerWaalsContact O-CB 3.32Å; M51-S55 WeakPolarHBondContact O-CB 3.44Å; M51-S55 PolarHBondContact O-N 3.1Å; M51-S55 PolarHBondContact O-OG 3.46Å; A53-S55 VanDerWaalsContact C-N 3.32Å; A53-S55 PolarHBondContact O-N 3.31Å; S55-L60 WeakPolarHBondContact O-CB 3.41Å; S55-L60 WeakPolarHBondContact O-CG 3.39Å; S55-L60 PolarHBondContact O-N 3.34Å; S55-A299 WeakPolarHBondContact O-CB 3.47Å; S55-M302 WeakPolarHBondContact OG-CG 3.48Å; S55-M302 PolarHBondContact OG-SD 3.5Å
56Y90.4Very high86.4Confident129 Ų12931 Ų3151%0.50615%0.153SC..Iπ-helixtrans-83.9-59.9176.9-179.9-101000112.2A53 A54 L60 A61A53-Y56 PolarHBondContact O-N 2.86Å; A54-Y56 PolarHBondContact O-N 3.38Å; A54-Y56 VanDerWaalsContact O-N 3.15Å; Y56-L60 HydrophobicContact CD2-CB 4.49Å; Y56-L60 PolarHBondContact O-N 3.25Å; Y56-A61 WeakPolarHBondContact O-CB 3.21Å; Y56-A61 PolarHBondContact O-N 2.96Å
57W85.3Confident86.4Confident59 Ų5928.1 Ų28.122%0.22314%0.141CC..Iπ-helixtrans-76.9-40-169-82.5-79.6000113.8A53 A54 P62 F331 M335 D338A53-W57 HydrophobicContact CB-CE3 3.86Å; A53-W57 HydrophobicContact CB-CZ3 3.82Å; A53-W57 PolarHBondContact O-N 3.3Å; A54-W57 PolarHBondContact O-N 2.79Å; W57-P62 WeakPolarHBondContact O-CD 3.35Å; W57-F331 AromaticContact CH2-CE1 3.61Å; W57-F331 HydrophobicContact CH2-CE1 3.61Å; W57-F331 AromaticContact CH2-CZ 3.59Å; W57-F331 HydrophobicContact CH2-CZ 3.59Å; W57-F331 HydrophobicContact CZ3-CD1 4.47Å; W57-F331 AromaticContact CZ3-CE1 3.57Å; W57-F331 HydrophobicContact CZ3-CE1 3.57Å; W57-F331 HydrophobicContact CZ3-CE2 4.08Å; W57-F331 AromaticContact CZ3-CZ 3.35Å; W57-F331 HydrophobicContact CZ3-CZ 3.35Å; W57-M335 HydrophobicContact CD2-CG 4.31Å; W57-M335 HydrophobicContact CE3-CB 4.19Å; W57-M335 HydrophobicContact CE3-CG 4.25Å; W57-M335 HydrophobicContact CH2-CB 4.09Å; W57-M335 HydrophobicContact CH2-CG 3.61Å; W57-M335 HydrophobicContact CH2-SD 3.95Å; W57-M335 HydrophobicContact CZ2-CB 4.48Å; W57-M335 HydrophobicContact CZ2-CG 3.61Å; W57-M335 HydrophobicContact CZ2-SD 4.05Å; W57-M335 HydrophobicContact CZ3-CB 3.91Å; W57-M335 HydrophobicContact CZ3-CG 3.93Å; W57-D338 HydrophobicContact CB-CB 4.07Å; W57-D338 WeakPolarHBondContact CB-OD2 3.46Å
58S78Confident86.6Confident4 Ų431.9 Ų31.93%0.02816%0.164CC..Iπ-helixtrans-91.8-17.2-173.8-44.70000112.5A54 M334 D338A54-S58 WeakPolarHBondContact O-CA 3.47Å; A54-S58 WeakPolarHBondContact O-CB 3.34Å; A54-S58 PolarHBondContact O-N 2.82Å; S58-M334 VanDerWaalsContact OG-CE 3.3Å; S58-M334 WeakPolarHBondContact OG-CE 3.13Å; S58-D338 PolarHBondContact OG-OD1 3.47Å
59L84.1Confident86.3Confident0 Ų036.3 Ų36.30%020%0.195CC..Iπ-helixtrans-121.4-63.4-176.7-56.8176.7000113.3A54 A63 H204 L295 A298 A299A54-L59 PolarHBondContact O-N 3.02Å; L59-A63 VanDerWaalsContact O-CB 3.25Å; L59-A63 WeakPolarHBondContact O-CB 3.3Å; L59-A63 PolarHBondContact O-N 3.48Å; L59-H204 WeakPolarHBondContact CD1-CE1 3.26Å; L59-H204 VanDerWaalsContact CD1-NE2 3.35Å; L59-H204 WeakPolarHBondContact CD1-NE2 3.42Å; L59-L295 HydrophobicContact CD2-CD2 3.6Å; L59-A298 HydrophobicContact CD1-CB 4.06Å; L59-A299 HydrophobicContact CB-CB 3.88Å; L59-A299 HydrophobicContact CD1-CB 4.16Å
60L89.5Confident85.4Confident32 Ų3239.8 Ų39.817%0.16822%0.219CC..Iπ-helixtrans-66.9-45.2-175.3-81.7167.6000113.2S55 Y56 A63 V64 V81 F85 A296 A299S55-L60 WeakPolarHBondContact O-CB 3.41Å; S55-L60 WeakPolarHBondContact O-CG 3.39Å; S55-L60 PolarHBondContact O-N 3.34Å; Y56-L60 HydrophobicContact CD2-CB 4.49Å; Y56-L60 PolarHBondContact O-N 3.25Å; L60-A63 WeakPolarHBondContact O-CB 3.45Å; L60-A63 PolarHBondContact O-N 3.2Å; L60-V64 VanDerWaalsContact O-CG2 3.27Å; L60-V64 WeakPolarHBondContact O-CG2 3.39Å; L60-V64 PolarHBondContact O-N 3.48Å; L60-V81 HydrophobicContact CD2-CG1 3.54Å; L60-F85 HydrophobicContact CD1-CD2 4.09Å; L60-F85 HydrophobicContact CD1-CE2 3.94Å; L60-F85 HydrophobicContact CD2-CD2 3.88Å; L60-F85 HydrophobicContact CG-CD2 4.36Å; L60-A296 HydrophobicContact CD2-CB 4.41Å; L60-A299 HydrophobicContact CD1-CB 4.17Å; L60-A299 HydrophobicContact CD2-CB 4.19Å; L60-A299 HydrophobicContact CG-CB 3.63Å
61A88.3Confident84.5Confident33 Ų3342.6 Ų42.627%0.27325%0.249SC..Hα-helixtrans-61.5-49.3-178.400000111.5Y56 A63 V64 E65Y56-A61 WeakPolarHBondContact O-CB 3.21Å; Y56-A61 PolarHBondContact O-N 2.96Å; A61-A63 VanDerWaalsContact C-N 3.33Å; A61-A63 PolarHBondContact O-N 3.18Å; A61-V64 PolarHBondContact O-N 3.31Å; A61-E65 PolarHBondContact O-N 3.3Å
62P82.9Confident83.5Confident31 Ų3145.5 Ų45.520%0.20128%0.28CS..Hα-helixtrans-59.3-40171.3-27.535.1000113.2W57 V64 E65 M66 L295W57-P62 WeakPolarHBondContact O-CD 3.35Å; P62-V64 PolarHBondContact O-N 2.71Å; P62-E65 PolarHBondContact O-N 3.14Å; P62-M66 VanDerWaalsContact C-CE 3.48Å; P62-M66 HydrophobicContact CB-CE 3.76Å; P62-M66 WeakPolarHBondContact O-CB 3.39Å; P62-M66 WeakPolarHBondContact O-CE 3.3Å; P62-M66 WeakPolarHBondContact O-CG 3.21Å; P62-M66 PolarHBondContact O-N 3.4Å; P62-L295 HydrophobicContact CB-CD1 4.47Å
63A87.3Confident82.4Confident0 Ų047.1 Ų47.10%029%0.286CS..Hα-helixtrans-62-42.2177.400000112.3L59 L60 A61 A67 V81 L295 A296L59-A63 VanDerWaalsContact O-CB 3.25Å; L59-A63 WeakPolarHBondContact O-CB 3.3Å; L59-A63 PolarHBondContact O-N 3.48Å; L60-A63 WeakPolarHBondContact O-CB 3.45Å; L60-A63 PolarHBondContact O-N 3.2Å; A61-A63 VanDerWaalsContact C-N 3.33Å; A61-A63 PolarHBondContact O-N 3.18Å; A63-A67 VanDerWaalsContact O-CB 3.26Å; A63-A67 WeakPolarHBondContact O-CB 3.48Å; A63-A67 PolarHBondContact O-N 3.43Å; A63-V81 HydrophobicContact CB-CG2 4.26Å; A63-L295 HydrophobicContact CB-CB 3.92Å; A63-A296 HydrophobicContact CB-CB 4.35Å
64V89.4Confident81.7Confident67 Ų6750.1 Ų50.141%0.40632%0.316SS..Hα-helixtrans-65.9-43.8175.9172.40000110.8L60 A61 P62 M66 A67 T68 V81L60-V64 VanDerWaalsContact O-CG2 3.27Å; L60-V64 WeakPolarHBondContact O-CG2 3.39Å; L60-V64 PolarHBondContact O-N 3.48Å; A61-V64 PolarHBondContact O-N 3.31Å; P62-V64 PolarHBondContact O-N 2.71Å; V64-M66 PolarHBondContact O-N 3.04Å; V64-A67 PolarHBondContact O-N 3.17Å; V64-T68 HydrophobicContact CG1-CG2 4.38Å; V64-T68 WeakPolarHBondContact O-CB 3.22Å; V64-T68 WeakPolarHBondContact O-CG2 3.33Å; V64-T68 PolarHBondContact O-N 2.84Å; V64-T68 PolarHBondContact O-OG1 2.99Å; V64-V81 HydrophobicContact CG2-CB 4.35Å; V64-V81 HydrophobicContact CG2-CG1 3.9Å; V64-V81 HydrophobicContact CG2-CG2 3.89Å
65E86.3Confident81.4Confident126 Ų12654.6 Ų54.659%0.58935%0.353SS*.Hα-helixtrans-62.2-43.7177.6-172.1175.9179.400111.7A61 P62 T68 S69A61-E65 PolarHBondContact O-N 3.3Å; P62-E65 PolarHBondContact O-N 3.14Å; E65-T68 WeakPolarHBondContact CA-OG1 3.42Å; E65-T68 PolarHBondContact O-N 3.49Å; E65-T68 PolarHBondContact O-OG1 3.36Å; E65-S69 VanDerWaalsContact O-CB 3.22Å; E65-S69 WeakPolarHBondContact O-CB 3.42Å; E65-S69 PolarHBondContact O-N 3.44Å; E65-S69 PolarHBondContact O-OG 3.32Å
66M84.1Confident81.3Confident61 Ų6161 Ų6130%0.338%0.381SS..Hα-helixtrans-66.7-39.9175.7-72.9-179.1-9900112.4P62 V64 T68 S70 L291 P292 L295P62-M66 VanDerWaalsContact C-CE 3.48Å; P62-M66 HydrophobicContact CB-CE 3.76Å; P62-M66 WeakPolarHBondContact O-CB 3.39Å; P62-M66 WeakPolarHBondContact O-CE 3.3Å; P62-M66 WeakPolarHBondContact O-CG 3.21Å; P62-M66 PolarHBondContact O-N 3.4Å; V64-M66 PolarHBondContact O-N 3.04Å; M66-T68 VanDerWaalsContact C-N 3.33Å; M66-T68 PolarHBondContact O-N 3.19Å; M66-S70 WeakPolarHBondContact O-CB 3.33Å; M66-S70 PolarHBondContact O-N 2.91Å; M66-S70 VanDerWaalsContact O-N 3.09Å; M66-S70 PolarHBondContact O-OG 3.07Å; M66-L291 HydrophobicContact CE-CD2 4.38Å; M66-L291 HydrophobicContact SD-CB 4.34Å; M66-L291 HydrophobicContact SD-CD2 3.93Å; M66-P292 HydrophobicContact CB-CB 4.48Å; M66-P292 HydrophobicContact CB-CG 3.77Å; M66-L295 HydrophobicContact CE-CD1 3.21Å
67A86.6Confident80.9Confident1 Ų155.1 Ų55.11%0.00836%0.36CS..Hα-helixtrans-68-32.1178.100000112.9A63 V64 S70 A77 P80 V81 P292A63-A67 VanDerWaalsContact O-CB 3.26Å; A63-A67 WeakPolarHBondContact O-CB 3.48Å; A63-A67 PolarHBondContact O-N 3.43Å; V64-A67 PolarHBondContact O-N 3.17Å; A67-S70 PolarHBondContact O-OG 3.44Å; A67-A77 WeakPolarHBondContact CB-O 3.3Å; A67-P80 HydrophobicContact CB-CB 4.4Å; A67-P80 HydrophobicContact CB-CG 4.41Å; A67-V81 HydrophobicContact CB-CG2 4.01Å; A67-P292 HydrophobicContact CB-CB 4.37Å
68T85.2Confident81Confident80 Ų8058.5 Ų58.549%0.49138%0.376SS..Hα-helixtrans-78.5-39.2175.9500000112V64 E65 M66 A77V64-T68 HydrophobicContact CG1-CG2 4.38Å; V64-T68 WeakPolarHBondContact O-CB 3.22Å; V64-T68 WeakPolarHBondContact O-CG2 3.33Å; V64-T68 PolarHBondContact O-N 2.84Å; V64-T68 PolarHBondContact O-OG1 2.99Å; E65-T68 WeakPolarHBondContact CA-OG1 3.42Å; E65-T68 PolarHBondContact O-N 3.49Å; E65-T68 PolarHBondContact O-OG1 3.36Å; M66-T68 VanDerWaalsContact C-N 3.33Å; M66-T68 PolarHBondContact O-N 3.19Å; T68-A77 HydrophobicContact CG2-CB 3.51Å
69S80.2Confident81.6Confident93 Ų9363.5 Ų63.565%0.6540%0.397SS*.Hα-helixtrans-75.6-25-177.2-58.90000114E65 G71E65-S69 VanDerWaalsContact O-CB 3.22Å; E65-S69 WeakPolarHBondContact O-CB 3.42Å; E65-S69 PolarHBondContact O-N 3.44Å; E65-S69 PolarHBondContact O-OG 3.32Å; S69-G71 PolarHBondContact O-N 2.93Å; S69-G71 VanDerWaalsContact O-N 3.14Å
70S72.8Confident81.9Confident73 Ų7363.5 Ų63.551%0.5140%0.398SS..THydrogen-bonded Turntrans-69.1-6.8-179.239.80000114.3M66 A67 G72M66-S70 WeakPolarHBondContact O-CB 3.33Å; M66-S70 PolarHBondContact O-N 2.91Å; M66-S70 VanDerWaalsContact O-N 3.09Å; M66-S70 PolarHBondContact O-OG 3.07Å; A67-S70 PolarHBondContact O-OG 3.44Å; S70-G72 PolarHBondContact O-N 2.91Å
71G65.8Low82Confident63 Ų6362.5 Ų62.565%0.64939%0.393SS*.SBendtrans68.7-15.2169.900000116.2S69 F73S69-G71 PolarHBondContact O-N 2.93Å; S69-G71 VanDerWaalsContact O-N 3.14Å; G71-F73 PolarHBondContact O-N 2.99Å
72G67.4Low82.3Confident65 Ų6563 Ų6367%0.6740%0.396SS*.SBendtrans-75.6-20-175.500000115.2S70S70-G72 PolarHBondContact O-N 2.91Å
73F66.4Low82.9Confident72 Ų7263.7 Ų63.732%0.31640%0.4SS..SBendtrans-110.9-15.6-172.3-63.7-76.6000114.5G71 A75 F76 A77 P80 Y293G71-F73 PolarHBondContact O-N 2.99Å; F73-A75 PolarHBondContact O-N 3.41Å; F73-F76 WeakPolarHBondContact O-CA 3.38Å; F73-F76 WeakPolarHBondContact O-CB 3.48Å; F73-F76 PolarHBondContact O-N 3.19Å; F73-A77 HydrophobicContact CB-CB 4.42Å; F73-P80 HydrophobicContact CD1-CG 4.18Å; F73-P80 HydrophobicContact CD2-CG 3.8Å; F73-P80 HydrophobicContact CE1-CG 4.02Å; F73-P80 HydrophobicContact CE2-CG 3.63Å; F73-P80 HydrophobicContact CG-CG 4.08Å; F73-P80 HydrophobicContact CZ-CG 3.76Å; F73-Y293 WeakPolarHBondContact CZ-OH 3.45Å
74G75.8Confident83.1Confident62 Ų6263.8 Ų63.864%0.63940%0.401SS*.G310 helixtrans49.7-122.8-17800000112.3F76 A77G74-F76 PolarHBondContact O-N 3.41Å; G74-A77 PolarHBondContact O-N 2.94Å
75A76.4Confident83.4Confident94 Ų9463.6 Ų63.678%0.77740%0.395SS*.G310 helixtrans-64.8-15.2176.500000114.6F73F73-A75 PolarHBondContact O-N 3.41Å
76F84.2Confident83.9Confident135 Ų13561.9 Ų61.959%0.59239%0.394SS*.G310 helixtrans-96.417.4179.8-59.8-76.9000113.5F73 G74 F78 F79F73-F76 WeakPolarHBondContact O-CA 3.38Å; F73-F76 WeakPolarHBondContact O-CB 3.48Å; F73-F76 PolarHBondContact O-N 3.19Å; G74-F76 PolarHBondContact O-N 3.41Å; F76-F78 AromaticContact CD1-CE1 3.84Å; F76-F78 HydrophobicContact CD1-CE1 3.84Å; F76-F78 HydrophobicContact CD1-CZ 4.33Å; F76-F78 PolarHBondContact O-N 2.95Å; F76-F79 VanDerWaalsContact O-CB 3.23Å; F76-F79 WeakPolarHBondContact O-CB 3.19Å; F76-F79 PolarHBondContact O-N 3.39Å
77A82.9Confident84.4Confident7 Ų763.9 Ų63.96%0.05841%0.405CS..THydrogen-bonded Turntrans-58-18.4176.300000113.9A67 T68 F73 G74 F79 P80A67-A77 WeakPolarHBondContact CB-O 3.3Å; T68-A77 HydrophobicContact CG2-CB 3.51Å; F73-A77 HydrophobicContact CB-CB 4.42Å; G74-A77 PolarHBondContact O-N 2.94Å; A77-F79 VanDerWaalsContact C-N 3.26Å; A77-F79 PolarHBondContact O-N 3.09Å; A77-P80 WeakPolarHBondContact O-CD 3.46Å
78F88.4Confident84.5Confident129 Ų12963.9 Ų63.957%0.56641%0.405SS*.Hα-helixtrans-68.7-22.9171.379-89.8000113.2F76 V81 A82F76-F78 AromaticContact CD1-CE1 3.84Å; F76-F78 HydrophobicContact CD1-CE1 3.84Å; F76-F78 HydrophobicContact CD1-CZ 4.33Å; F76-F78 PolarHBondContact O-N 2.95Å; F78-V81 PolarHBondContact O-N 3.36Å; F78-A82 HydrophobicContact CD2-CB 4.29Å; F78-A82 VanDerWaalsContact O-CB 3.24Å; F78-A82 WeakPolarHBondContact O-CB 3.27Å; F78-A82 PolarHBondContact O-N 3.45Å
79F90.1Very high84.8Confident109 Ų10961.1 Ų61.148%0.47839%0.39SS..Hα-helixtrans-65.7-50.4-171.2178.5-94.5000113F76 A77 V81 A82 V83F76-F79 VanDerWaalsContact O-CB 3.23Å; F76-F79 WeakPolarHBondContact O-CB 3.19Å; F76-F79 PolarHBondContact O-N 3.39Å; A77-F79 VanDerWaalsContact C-N 3.26Å; A77-F79 PolarHBondContact O-N 3.09Å; F79-V81 VanDerWaalsContact C-N 3.27Å; F79-V81 PolarHBondContact O-N 2.91Å; F79-A82 PolarHBondContact O-N 2.95Å; F79-V83 HydrophobicContact CD1-CG2 4.21Å; F79-V83 HydrophobicContact CD2-CG2 4.07Å; F79-V83 HydrophobicContact CE1-CG2 3.9Å; F79-V83 HydrophobicContact CE2-CG2 3.75Å; F79-V83 HydrophobicContact CG-CG2 4.3Å; F79-V83 HydrophobicContact CZ-CG2 3.66Å; F79-V83 WeakPolarHBondContact O-CB 3.26Å; F79-V83 VanDerWaalsContact O-CG2 3.26Å; F79-V83 WeakPolarHBondContact O-CG2 3.37Å; F79-V83 PolarHBondContact O-N 3.4Å
80P89.4Confident85.4Confident1 Ų159 Ų591%0.00638%0.378CS..Hα-helixtrans-53.9-43.3174.5-28.235.7000113.5A67 F73 A77 G84 Y293A67-P80 HydrophobicContact CB-CB 4.4Å; A67-P80 HydrophobicContact CB-CG 4.41Å; F73-P80 HydrophobicContact CD1-CG 4.18Å; F73-P80 HydrophobicContact CD2-CG 3.8Å; F73-P80 HydrophobicContact CE1-CG 4.02Å; F73-P80 HydrophobicContact CE2-CG 3.63Å; F73-P80 HydrophobicContact CG-CG 4.08Å; F73-P80 HydrophobicContact CZ-CG 3.76Å; A77-P80 WeakPolarHBondContact O-CD 3.46Å; P80-G84 PolarHBondContact O-N 3.42Å; P80-Y293 VanDerWaalsContact CA-CE1 3.45Å; P80-Y293 HydrophobicContact CB-CD1 4.08Å; P80-Y293 HydrophobicContact CB-CD2 4.36Å; P80-Y293 HydrophobicContact CB-CE1 3.61Å; P80-Y293 HydrophobicContact CB-CE2 3.9Å; P80-Y293 HydrophobicContact CB-CG 4.44Å; P80-Y293 VanDerWaalsContact CB-CZ 3.5Å; P80-Y293 HydrophobicContact CG-CE1 4.29Å; P80-Y293 HydrophobicContact CG-CE2 4.44Å
81V92.4Very high86.2Confident11 Ų1159 Ų597%0.06737%0.369CS..Hα-helixtrans-69.7-47.3-178.2-177.40000110.6L60 A63 V64 A67 F78 F79 V83 G84 F85 A296L60-V81 HydrophobicContact CD2-CG1 3.54Å; A63-V81 HydrophobicContact CB-CG2 4.26Å; V64-V81 HydrophobicContact CG2-CB 4.35Å; V64-V81 HydrophobicContact CG2-CG1 3.9Å; V64-V81 HydrophobicContact CG2-CG2 3.89Å; A67-V81 HydrophobicContact CB-CG2 4.01Å; F78-V81 PolarHBondContact O-N 3.36Å; F79-V81 VanDerWaalsContact C-N 3.27Å; F79-V81 PolarHBondContact O-N 2.91Å; V81-V83 VanDerWaalsContact C-N 3.35Å; V81-V83 PolarHBondContact O-N 3.17Å; V81-G84 PolarHBondContact O-N 2.86Å; V81-F85 WeakPolarHBondContact O-CB 3.14Å; V81-F85 PolarHBondContact O-N 3.41Å; V81-A296 HydrophobicContact CB-CB 4.32Å; V81-A296 HydrophobicContact CG1-CB 3.9Å; V81-A296 VanDerWaalsContact O-CB 3.3Å; V81-A296 WeakPolarHBondContact O-CB 3.14Å
82A94.2Very high87Confident42 Ų4256.2 Ų56.235%0.34734%0.339SS..Hα-helixtrans-62.7-41.7178.700000112.1F78 F79 T86F78-A82 HydrophobicContact CD2-CB 4.29Å; F78-A82 VanDerWaalsContact O-CB 3.24Å; F78-A82 WeakPolarHBondContact O-CB 3.27Å; F78-A82 PolarHBondContact O-N 3.45Å; F79-A82 PolarHBondContact O-N 2.95Å; A82-T86 VanDerWaalsContact O-CB 3.31Å; A82-T86 WeakPolarHBondContact O-CB 3.21Å; A82-T86 PolarHBondContact O-N 3.11Å; A82-T86 PolarHBondContact O-OG1 3.11Å
83V94.8Very high87.9Confident46 Ų4659.3 Ų59.328%0.27933%0.332SS..Hα-helixtrans-64.8-51.4176.5170.50000110.3F79 V81 F85 T86 L87F79-V83 HydrophobicContact CD1-CG2 4.21Å; F79-V83 HydrophobicContact CD2-CG2 4.07Å; F79-V83 HydrophobicContact CE1-CG2 3.9Å; F79-V83 HydrophobicContact CE2-CG2 3.75Å; F79-V83 HydrophobicContact CG-CG2 4.3Å; F79-V83 HydrophobicContact CZ-CG2 3.66Å; F79-V83 WeakPolarHBondContact O-CB 3.26Å; F79-V83 VanDerWaalsContact O-CG2 3.26Å; F79-V83 WeakPolarHBondContact O-CG2 3.37Å; F79-V83 PolarHBondContact O-N 3.4Å; V81-V83 VanDerWaalsContact C-N 3.35Å; V81-V83 PolarHBondContact O-N 3.17Å; V83-F85 PolarHBondContact O-N 3.01Å; V83-T86 PolarHBondContact O-N 3.27Å; V83-L87 HydrophobicContact CG1-CD1 3.65Å; V83-L87 HydrophobicContact CG1-CG 4.25Å; V83-L87 VanDerWaalsContact O-CB 3.31Å; V83-L87 WeakPolarHBondContact O-CB 3.26Å; V83-L87 VanDerWaalsContact O-CG 3.22Å; V83-L87 WeakPolarHBondContact O-CG 3.33Å; V83-L87 PolarHBondContact O-N 2.91Å
84G93.2Very high88.8Confident3 Ų360 Ų603%0.03134%0.338CS..Hα-helixtrans-55.1-54.8177.400000111.3P80 V81 T86 L87 G88 F297P80-G84 PolarHBondContact O-N 3.42Å; V81-G84 PolarHBondContact O-N 2.86Å; G84-T86 PolarHBondContact O-N 3.38Å; G84-L87 PolarHBondContact O-N 3.49Å; G84-G88 PolarHBondContact O-N 3.05Å; G84-F297 WeakPolarHBondContact O-CA 3.22Å
85F95.3Very high89Confident62 Ų6257.8 Ų57.827%0.27231%0.314SS..Hα-helixtrans-55.8-47.9-180-172.9-88.2000113L60 V81 V83 G88 A89 A296 A299 G300 V303L60-F85 HydrophobicContact CD1-CD2 4.09Å; L60-F85 HydrophobicContact CD1-CE2 3.94Å; L60-F85 HydrophobicContact CD2-CD2 3.88Å; L60-F85 HydrophobicContact CG-CD2 4.36Å; V81-F85 WeakPolarHBondContact O-CB 3.14Å; V81-F85 PolarHBondContact O-N 3.41Å; V83-F85 PolarHBondContact O-N 3.01Å; F85-G88 PolarHBondContact O-N 3.2Å; F85-A89 PolarHBondContact O-N 2.9Å; F85-A296 WeakPolarHBondContact CA-O 3.31Å; F85-A296 HydrophobicContact CB-CB 4.44Å; F85-A296 PolarHBondContact N-O 3.43Å; F85-A299 HydrophobicContact CD2-CB 4.15Å; F85-A299 HydrophobicContact CE2-CB 4.35Å; F85-G300 VanDerWaalsContact CE2-CA 3.47Å; F85-G300 WeakPolarHBondContact O-CA 3.33Å; F85-V303 HydrophobicContact CE2-CB 4.38Å; F85-V303 HydrophobicContact CE2-CG2 4.1Å; F85-V303 HydrophobicContact CZ-CB 4.13Å; F85-V303 HydrophobicContact CZ-CG1 4.23Å; F85-V303 HydrophobicContact CZ-CG2 4.2Å
86T95.9Very high89Confident91 Ų9155.2 Ų55.256%0.55829%0.287SS*.Hα-helixtrans-67.9-39.7-179.4-50.60000111.4A82 V83 G84 G88 A89 A90A82-T86 VanDerWaalsContact O-CB 3.31Å; A82-T86 WeakPolarHBondContact O-CB 3.21Å; A82-T86 PolarHBondContact O-N 3.11Å; A82-T86 PolarHBondContact O-OG1 3.11Å; V83-T86 PolarHBondContact O-N 3.27Å; G84-T86 PolarHBondContact O-N 3.38Å; T86-G88 VanDerWaalsContact C-N 3.32Å; T86-G88 PolarHBondContact O-N 2.86Å; T86-A89 PolarHBondContact O-N 2.63Å; T86-A90 WeakPolarHBondContact O-CB 3.3Å; T86-A90 PolarHBondContact O-N 3.35Å
87L94.4Very high88.8Confident103 Ų10352.7 Ų52.754%0.53928%0.279SS..Hα-helixtrans-64.7-36.7175.5-72.8176.2000112V83 G84 F91 F297V83-L87 HydrophobicContact CG1-CD1 3.65Å; V83-L87 HydrophobicContact CG1-CG 4.25Å; V83-L87 VanDerWaalsContact O-CB 3.31Å; V83-L87 WeakPolarHBondContact O-CB 3.26Å; V83-L87 VanDerWaalsContact O-CG 3.22Å; V83-L87 WeakPolarHBondContact O-CG 3.33Å; V83-L87 PolarHBondContact O-N 2.91Å; G84-L87 PolarHBondContact O-N 3.49Å; L87-F91 WeakPolarHBondContact O-CB 3.3Å; L87-F91 PolarHBondContact O-N 3.4Å; L87-F297 HydrophobicContact CB-CD2 4.08Å; L87-F297 HydrophobicContact CB-CE2 4.48Å
88G90.1Very high88.6Confident0 Ų056.2 Ų56.20%030%0.297CS..Hα-helixtrans-62.1-50.3174.700000112.5G84 F85 T86 F91 V92 F297G84-G88 PolarHBondContact O-N 3.05Å; F85-G88 PolarHBondContact O-N 3.2Å; T86-G88 VanDerWaalsContact C-N 3.32Å; T86-G88 PolarHBondContact O-N 2.86Å; G88-F91 WeakPolarHBondContact O-CB 3.36Å; G88-F91 PolarHBondContact O-N 3.48Å; G88-V92 PolarHBondContact O-N 3.31Å; G88-F297 VanDerWaalsContact CA-CE2 3.48Å; G88-F297 WeakPolarHBondContact CA-O 3.39Å; G88-F297 VanDerWaalsContact N-CD2 3.27Å
89A90.9Very high87.7Confident23 Ų2350.7 Ų50.719%0.1927%0.273CS..Hα-helixtrans-62.9-45.3176.200000111.7F85 T86 F91 V92 Y93 Y304F85-A89 PolarHBondContact O-N 2.9Å; T86-A89 PolarHBondContact O-N 2.63Å; A89-F91 VanDerWaalsContact C-N 3.28Å; A89-F91 PolarHBondContact O-N 3.07Å; A89-V92 PolarHBondContact O-N 3.36Å; A89-Y93 WeakPolarHBondContact O-CB 3.4Å; A89-Y93 PolarHBondContact O-N 2.87Å; A89-Y304 HydrophobicContact CB-CD2 4.31Å
90A92.6Very high86.8Confident47 Ų4748.6 Ų48.639%0.38827%0.27SS..Hα-helixtrans-64-33.4177.600000112.4T86 Y93 L94T86-A90 WeakPolarHBondContact O-CB 3.3Å; T86-A90 PolarHBondContact O-N 3.35Å; A90-Y93 PolarHBondContact O-N 3.4Å; A90-L94 WeakPolarHBondContact O-CB 3.23Å; A90-L94 PolarHBondContact O-N 2.91Å
91F89.3Confident85.9Confident74 Ų7457.4 Ų57.433%0.32531%0.305SS..Hα-helixtrans-62.8-48.2176.6171.4-91.6000111.2L87 G88 A89 L94 A95 I203 F297L87-F91 WeakPolarHBondContact O-CB 3.3Å; L87-F91 PolarHBondContact O-N 3.4Å; G88-F91 WeakPolarHBondContact O-CB 3.36Å; G88-F91 PolarHBondContact O-N 3.48Å; A89-F91 VanDerWaalsContact C-N 3.28Å; A89-F91 PolarHBondContact O-N 3.07Å; F91-L94 PolarHBondContact O-N 3.13Å; F91-A95 WeakPolarHBondContact O-CB 3.24Å; F91-A95 PolarHBondContact O-N 3.01Å; F91-I203 HydrophobicContact CD1-CG2 4.41Å; F91-I203 HydrophobicContact CE1-CB 4.38Å; F91-I203 HydrophobicContact CE1-CD1 3.33Å; F91-I203 HydrophobicContact CE1-CG1 4.43Å; F91-I203 HydrophobicContact CE1-CG2 3.96Å; F91-I203 HydrophobicContact CE2-CD1 4.35Å; F91-I203 HydrophobicContact CZ-CD1 3.18Å; F91-I203 HydrophobicContact CZ-CG2 4.5Å; F91-F297 HydrophobicContact CB-CE2 3.79Å; F91-F297 HydrophobicContact CB-CZ 3.78Å; F91-F297 AromaticContact CD1-CZ 3.93Å; F91-F297 HydrophobicContact CD1-CZ 3.93Å; F91-F297 HydrophobicContact CD2-CZ 4.34Å; F91-F297 HydrophobicContact CG-CE2 4.19Å; F91-F297 AromaticContact CG-CZ 3.72Å; F91-F297 HydrophobicContact CG-CZ 3.72Å
92V82.4Confident84.6Confident4 Ų463.2 Ų63.22%0.02434%0.335CS..Hα-helixtrans-66.5-42.5177.9-176.40000110.8G88 A89 L94 A95 D96 A200 A301 Y304 V305G88-V92 PolarHBondContact O-N 3.31Å; A89-V92 PolarHBondContact O-N 3.36Å; V92-L94 VanDerWaalsContact C-N 3.34Å; V92-L94 PolarHBondContact O-N 3.41Å; V92-A95 WeakPolarHBondContact O-CB 3.39Å; V92-A95 PolarHBondContact O-N 3.29Å; V92-D96 PolarHBondContact O-N 3.29Å; V92-A200 HydrophobicContact CG1-CB 4.26Å; V92-A200 HydrophobicContact CG2-CB 4.22Å; V92-A301 HydrophobicContact CG2-CB 3.66Å; V92-Y304 HydrophobicContact CB-CD1 3.68Å; V92-Y304 HydrophobicContact CB-CE1 4.25Å; V92-Y304 HydrophobicContact CB-CG 4.19Å; V92-Y304 HydrophobicContact CG1-CD1 3.4Å; V92-Y304 HydrophobicContact CG1-CE1 3.78Å; V92-Y304 HydrophobicContact CG1-CG 4.36Å; V92-V305 HydrophobicContact CG1-CG2 3.93Å; V92-V305 HydrophobicContact CG2-CG2 4.36Å
93Y86.3Confident82.9Confident130 Ų13063.6 Ų63.651%0.5134%0.342SS..Hα-helixtrans-57.1-45.5173.8175-104.3000112.5A89 A90 D96 L97 Y304A89-Y93 WeakPolarHBondContact O-CB 3.4Å; A89-Y93 PolarHBondContact O-N 2.87Å; A90-Y93 PolarHBondContact O-N 3.4Å; Y93-D96 WeakPolarHBondContact O-CB 3.42Å; Y93-D96 PolarHBondContact O-N 2.73Å; Y93-L97 PolarHBondContact O-N 3.1Å; Y93-Y304 HydrophobicContact CD2-CE2 4.24Å; Y93-Y304 WeakPolarHBondContact CD2-OH 3.48Å; Y93-Y304 HydrophobicContact CG-CE2 4.47Å
94L85.9Confident81Confident87 Ų8763.4 Ų63.446%0.45535%0.346SS..Hα-helixtrans-69.4-37.8178.8-177.762000111.4A90 F91 V92 D96 L97 L98A90-L94 WeakPolarHBondContact O-CB 3.23Å; A90-L94 PolarHBondContact O-N 2.91Å; F91-L94 PolarHBondContact O-N 3.13Å; V92-L94 VanDerWaalsContact C-N 3.34Å; V92-L94 PolarHBondContact O-N 3.41Å; L94-D96 VanDerWaalsContact C-N 3.27Å; L94-D96 PolarHBondContact O-N 2.97Å; L94-L97 HydrophobicContact CD1-CD2 4.45Å; L94-L97 PolarHBondContact O-N 2.89Å; L94-L97 VanDerWaalsContact O-N 3.16Å; L94-L98 HydrophobicContact CD1-CD1 4.08Å; L94-L98 HydrophobicContact CD1-CD2 4.47Å; L94-L98 HydrophobicContact CD1-CG 3.95Å; L94-L98 HydrophobicContact CD2-CD1 4.28Å; L94-L98 HydrophobicContact CG-CD1 3.78Å; L94-L98 HydrophobicContact CG-CG 4.09Å; L94-L98 WeakPolarHBondContact O-CB 3.17Å; L94-L98 VanDerWaalsContact O-CG 3.28Å; L94-L98 WeakPolarHBondContact O-CG 3.3Å; L94-L98 PolarHBondContact O-N 2.86Å
95A79.9Confident78.8Confident15 Ų1564.8 Ų64.812%0.12436%0.357CS..Hα-helixtrans-59.6-41.2172.900000110.8F91 V92 L98 M99 L196 L199F91-A95 WeakPolarHBondContact O-CB 3.24Å; F91-A95 PolarHBondContact O-N 3.01Å; V92-A95 WeakPolarHBondContact O-CB 3.39Å; V92-A95 PolarHBondContact O-N 3.29Å; A95-L98 PolarHBondContact O-N 3.44Å; A95-M99 WeakPolarHBondContact O-CG 3.45Å; A95-M99 PolarHBondContact O-N 3.45Å; A95-L196 HydrophobicContact CB-CD2 3.92Å; A95-L199 HydrophobicContact CB-CD2 4.34Å
96D76.8Confident76.8Confident41 Ų4167.2 Ų67.222%0.21937%0.369CS..Hα-helixtrans-58.5-53.3171-176.258.1000110.1V92 Y93 L94 L98 M99 P100 R192 L196V92-D96 PolarHBondContact O-N 3.29Å; Y93-D96 WeakPolarHBondContact O-CB 3.42Å; Y93-D96 PolarHBondContact O-N 2.73Å; L94-D96 VanDerWaalsContact C-N 3.27Å; L94-D96 PolarHBondContact O-N 2.97Å; D96-L98 VanDerWaalsContact C-N 3.29Å; D96-L98 PolarHBondContact O-N 2.9Å; D96-M99 PolarHBondContact O-N 2.97Å; D96-P100 WeakPolarHBondContact O-CD 3.37Å; D96-R192 VanDerWaalsContact CG-NH2 3.27Å; D96-R192 PolarHBondContact O-NH2 2.95Å; D96-R192 IonicContact OD1-CZ 3.22Å; D96-R192 IonicContact OD1-NE 3.91Å; D96-R192 IonicContact OD1-NH1 3.51Å; D96-R192 IonicContact OD1-NH2 2.89Å; D96-R192 PolarHBondContact OD1-NH2 3.39Å; D96-R192 IonicContact OD2-NH2 3.17Å; D96-R192 PolarHBondContact OD2-NH2 3.26Å; D96-R192 VanDerWaalsContact OD2-NH2 3.17Å; D96-L196 HydrophobicContact CB-CD1 3.79Å; D96-L196 VanDerWaalsContact OD1-CD1 3.22Å; D96-L196 WeakPolarHBondContact OD1-CD1 3.21Å
97L80.4Confident74.9Confident82 Ų8264 Ų6443%0.42935%0.349SS..Hα-helixtrans-60-34.4-177.7-170.964000114Y93 L94 P100 Y101Y93-L97 PolarHBondContact O-N 3.1Å; L94-L97 HydrophobicContact CD1-CD2 4.45Å; L94-L97 PolarHBondContact O-N 2.89Å; L94-L97 VanDerWaalsContact O-N 3.16Å; L97-P100 WeakPolarHBondContact O-CD 3.35Å; L97-Y101 VanDerWaalsContact O-CD2 3.24Å; L97-Y101 WeakPolarHBondContact O-CD2 3.15Å; L97-Y101 VanDerWaalsContact O-CE2 3.28Å; L97-Y101 WeakPolarHBondContact O-CE2 3.46Å
98L78.4Confident72.8Confident80 Ų8061.8 Ų61.842%0.41934%0.34SS..Hα-helixtrans-82.4-28.1-174.9-73176.9000114.2L94 A95 D96 P100 Y101 L102L94-L98 HydrophobicContact CD1-CD1 4.08Å; L94-L98 HydrophobicContact CD1-CD2 4.47Å; L94-L98 HydrophobicContact CD1-CG 3.95Å; L94-L98 HydrophobicContact CD2-CD1 4.28Å; L94-L98 HydrophobicContact CG-CD1 3.78Å; L94-L98 HydrophobicContact CG-CG 4.09Å; L94-L98 WeakPolarHBondContact O-CB 3.17Å; L94-L98 VanDerWaalsContact O-CG 3.28Å; L94-L98 WeakPolarHBondContact O-CG 3.3Å; L94-L98 PolarHBondContact O-N 2.86Å; A95-L98 PolarHBondContact O-N 3.44Å; D96-L98 VanDerWaalsContact C-N 3.29Å; D96-L98 PolarHBondContact O-N 2.9Å; L98-P100 VanDerWaalsContact C-CD 3.47Å; L98-Y101 WeakPolarHBondContact O-CB 2.95Å; L98-Y101 PolarHBondContact O-N 3.33Å; L98-L102 HydrophobicContact CB-CD1 4.5Å; L98-L102 PolarHBondContact O-N 3.41Å
99M68.1Low70.9Confident13 Ų1366.3 Ų66.36%0.06436%0.361CS..THydrogen-bonded Turntrans-56.6-39.7-176.8-93.6-162.1-49.300116.4A95 D96 Y101 L102 R192 A195 L196A95-M99 WeakPolarHBondContact O-CG 3.45Å; A95-M99 PolarHBondContact O-N 3.45Å; D96-M99 PolarHBondContact O-N 2.97Å; M99-Y101 PolarHBondContact O-N 2.83Å; M99-L102 PolarHBondContact O-N 2.86Å; M99-R192 HydrophobicContact CB-CG 4.37Å; M99-R192 HydrophobicContact CE-CB 4.34Å; M99-R192 HydrophobicContact CE-CG 3.1Å; M99-R192 WeakPolarHBondContact CE-O 3.48Å; M99-R192 HydrophobicContact SD-CG 3.8Å; M99-A195 HydrophobicContact SD-CB 4.43Å; M99-L196 HydrophobicContact CE-CB 4.29Å; M99-L196 HydrophobicContact CE-CD1 3.1Å; M99-L196 HydrophobicContact CE-CD2 3.36Å; M99-L196 HydrophobicContact CE-CG 2.96Å; M99-L196 HydrophobicContact CG-CD2 4.17Å; M99-L196 HydrophobicContact SD-CD1 4.31Å; M99-L196 HydrophobicContact SD-CD2 3.66Å; M99-L196 HydrophobicContact SD-CG 3.51Å; M99-L196 VanDerWaalsContact SD-CG 3.51Å
100P71.5Confident69.1Low66 Ų6667.9 Ų67.943%0.42937%0.369SS..THydrogen-bonded Turntrans-57.8-33.5173.7-23.933.8000112.6D96 L97 L98D96-P100 WeakPolarHBondContact O-CD 3.37Å; L97-P100 WeakPolarHBondContact O-CD 3.35Å; L98-P100 VanDerWaalsContact C-CD 3.47Å
101Y71.7Confident67.2Low186 Ų18667.2 Ų67.273%0.72936%0.363SS*.THydrogen-bonded Turntrans-81-25.8-177.9-60.1-78000113.1L97 L98 M99 G103L97-Y101 VanDerWaalsContact O-CD2 3.24Å; L97-Y101 WeakPolarHBondContact O-CD2 3.15Å; L97-Y101 VanDerWaalsContact O-CE2 3.28Å; L97-Y101 WeakPolarHBondContact O-CE2 3.46Å; L98-Y101 WeakPolarHBondContact O-CB 2.95Å; L98-Y101 PolarHBondContact O-N 3.33Å; M99-Y101 PolarHBondContact O-N 2.83Å; Y101-G103 PolarHBondContact O-N 3.29Å
102L65.2Low65.4Low133 Ų13368.6 Ų68.670%0.69637%0.373SS*.THydrogen-bonded Turntrans-80.6-1.8178.3-69.1170.1000113.4L98 M99 A104L98-L102 HydrophobicContact CB-CD1 4.5Å; L98-L102 PolarHBondContact O-N 3.41Å; M99-L102 PolarHBondContact O-N 2.86Å; L102-A104 HydrophobicContact CB-CB 4.46Å; L102-A104 PolarHBondContact O-N 3.45Å; L102-A104 VanDerWaalsContact O-N 3.09Å
103G58.6Low64.1Low49 Ų4971.3 Ų71.351%0.50540%0.396SS..THydrogen-bonded Turntrans67.24.9-175.500000113.9Y101 A105 E106Y101-G103 PolarHBondContact O-N 3.29Å; G103-A105 PolarHBondContact O-N 2.95Å; G103-E106 PolarHBondContact O-N 3.19Å
104A53.2Low62.5Low43 Ų4369.7 Ų69.736%0.35540%0.396SS..THydrogen-bonded Turntrans-69.1-0178.300000113.6L102 E106 W191L102-A104 HydrophobicContact CB-CB 4.46Å; L102-A104 PolarHBondContact O-N 3.45Å; L102-A104 VanDerWaalsContact O-N 3.09Å; A104-E106 VanDerWaalsContact C-N 3.27Å; A104-W191 PolarHBondContact O-NE1 3.32Å
105A48.8Very low60.9Low32 Ų3270.6 Ų70.626%0.26440%0.401SS..THydrogen-bonded Turntrans-78-6.7173.500000113.6G103 G188G103-A105 PolarHBondContact O-N 2.95Å; A105-G188 WeakPolarHBondContact O-CA 3.47Å
106E51.6Low59.5Low112 Ų11276.1 Ų76.152%0.52342%0.423SS..SBendtrans-86123.3171.9-66-163.8161.200110.8G103 A104G103-E106 PolarHBondContact O-N 3.19Å; A104-E106 VanDerWaalsContact C-N 3.27Å
107D56.1Low58.1Low25 Ų2575.7 Ų75.713%0.13443%0.428CS..  trans-57.1135.4174.8148.956.1000110.1Q109 T110 A111 W191D107-Q109 PolarHBondContact O-N 2.89Å; D107-Q109 PolarHBondContact OD1-N 3.49Å; D107-Q109 VanDerWaalsContact OD1-N 3.11Å; D107-Q109 VanDerWaalsContact OD2-CB 3.31Å; D107-Q109 WeakPolarHBondContact OD2-CB 3.41Å; D107-Q109 PolarHBondContact OD2-N 3.32Å; D107-T110 WeakPolarHBondContact CB-OG1 3.32Å; D107-T110 CarbonylContact O-C 3.57Å; D107-T110 WeakPolarHBondContact O-CA 3.27Å; D107-T110 WeakPolarHBondContact O-CB 3.45Å; D107-T110 PolarHBondContact O-N 2.88Å; D107-T110 PolarHBondContact OD2-N 3.38Å; D107-T110 PolarHBondContact OD2-OG1 3.16Å; D107-A111 PolarHBondContact O-N 3.01Å; D107-W191 HydrophobicContact CB-CB 4.46Å; D107-W191 HydrophobicContact CB-CG 4.45Å
108P51.5Low56.8Low55 Ų5574.4 Ų74.436%0.35743%0.429SS..Hα-helixtrans-52.8-31.1178.8-2732.6000113.3L112 W191P108-L112 WeakPolarHBondContact O-CB 3.32Å; P108-L112 PolarHBondContact O-N 3.42Å; P108-W191 VanDerWaalsContact CD-CE2 3.45Å; P108-W191 HydrophobicContact CG-CH2 4.03Å; P108-W191 HydrophobicContact CG-CZ2 3.57Å
109Q49.6Very low55.5Low96 Ų9675 Ų7545%0.44944%0.436SS..Hα-helixtrans-74.7-35175.9-49.5-1743.400111.9D107 A113D107-Q109 PolarHBondContact O-N 2.89Å; D107-Q109 PolarHBondContact OD1-N 3.49Å; D107-Q109 VanDerWaalsContact OD1-N 3.11Å; D107-Q109 VanDerWaalsContact OD2-CB 3.31Å; D107-Q109 WeakPolarHBondContact OD2-CB 3.41Å; D107-Q109 PolarHBondContact OD2-N 3.32Å; Q109-A113 WeakPolarHBondContact O-CB 3.29Å; Q109-A113 PolarHBondContact O-N 3.35Å
110T53.7Low54.7Low56 Ų5680 Ų8034%0.34446%0.462SS..Hα-helixtrans-68.6-43173.9-470000111D107 A113 L114D107-T110 WeakPolarHBondContact CB-OG1 3.32Å; D107-T110 CarbonylContact O-C 3.57Å; D107-T110 WeakPolarHBondContact O-CA 3.27Å; D107-T110 WeakPolarHBondContact O-CB 3.45Å; D107-T110 PolarHBondContact O-N 2.88Å; D107-T110 PolarHBondContact OD2-N 3.38Å; D107-T110 PolarHBondContact OD2-OG1 3.16Å; T110-A113 PolarHBondContact O-N 3.02Å; T110-L114 HydrophobicContact CG2-CD1 4.28Å; T110-L114 VanDerWaalsContact O-CB 3.3Å; T110-L114 WeakPolarHBondContact O-CB 3.39Å; T110-L114 WeakPolarHBondContact O-CG 3.46Å; T110-L114 PolarHBondContact O-N 2.83Å
111A52.4Low53.6Low32 Ų3284 Ų8426%0.26448%0.477SS..Hα-helixtrans-66.2-37.8174.300000112.5D107 N115D107-A111 PolarHBondContact O-N 3.01Å; A111-N115 WeakPolarHBondContact O-CB 3.46Å; A111-N115 PolarHBondContact O-N 2.9Å; A111-N115 PolarHBondContact O-ND2 2.78Å
112L52.3Low52.4Low103 Ų10382.9 Ų82.954%0.53948%0.476SS..Hα-helixtrans-70.1-40.3173.9-153.979.7000111.1P108 N115 F116P108-L112 WeakPolarHBondContact O-CB 3.32Å; P108-L112 PolarHBondContact O-N 3.42Å; L112-N115 PolarHBondContact O-N 3.16Å; L112-F116 HydrophobicContact CD2-CD2 4.45Å; L112-F116 HydrophobicContact CD2-CE2 4.12Å; L112-F116 HydrophobicContact CG-CD2 4.03Å; L112-F116 HydrophobicContact CG-CE2 4.02Å; L112-F116 WeakPolarHBondContact O-CB 3.44Å; L112-F116 VanDerWaalsContact O-CD2 3.3Å; L112-F116 WeakPolarHBondContact O-CD2 3.29Å; L112-F116 PolarHBondContact O-N 3.23Å
113A54Low51.3Low62 Ų6284.8 Ų84.851%0.51248%0.479SS..Hα-helixtrans-67-37.3175.900000112.3Q109 T110 F116 G117Q109-A113 WeakPolarHBondContact O-CB 3.29Å; Q109-A113 PolarHBondContact O-N 3.35Å; T110-A113 PolarHBondContact O-N 3.02Å; A113-F116 PolarHBondContact O-N 3.15Å; A113-G117 PolarHBondContact O-N 3.37Å
114L52.6Low50.6Low95 Ų9591.6 Ų91.650%0.49750%0.495SS..Hα-helixtrans-65.7-40.9171.8-75169.5000111T110 G117 A118T110-L114 HydrophobicContact CG2-CD1 4.28Å; T110-L114 VanDerWaalsContact O-CB 3.3Å; T110-L114 WeakPolarHBondContact O-CB 3.39Å; T110-L114 WeakPolarHBondContact O-CG 3.46Å; T110-L114 PolarHBondContact O-N 2.83Å; L114-G117 PolarHBondContact O-N 3.45Å; L114-A118 WeakPolarHBondContact O-CB 3.46Å; L114-A118 PolarHBondContact O-N 3Å
115N52Low49.9Very low107 Ų10793.3 Ų93.357%0.57250%0.504SS*.Hα-helixtrans-66-42173.6-87.9-37.2000112.6A111 L112 T119A111-N115 WeakPolarHBondContact O-CB 3.46Å; A111-N115 PolarHBondContact O-N 2.9Å; A111-N115 PolarHBondContact O-ND2 2.78Å; L112-N115 PolarHBondContact O-N 3.16Å; N115-T119 WeakPolarHBondContact O-CB 3.32Å; N115-T119 PolarHBondContact O-N 3.31Å; N115-T119 PolarHBondContact O-OG1 3.16Å
116F52.1Low49.4Very low131 Ų13198.2 Ų98.258%0.57553%0.525SS*.Hα-helixtrans-66.9-41.6174.8-92.3-78.2000112L112 A113 T119 L120L112-F116 HydrophobicContact CD2-CD2 4.45Å; L112-F116 HydrophobicContact CD2-CE2 4.12Å; L112-F116 HydrophobicContact CG-CD2 4.03Å; L112-F116 HydrophobicContact CG-CE2 4.02Å; L112-F116 WeakPolarHBondContact O-CB 3.44Å; L112-F116 VanDerWaalsContact O-CD2 3.3Å; L112-F116 WeakPolarHBondContact O-CD2 3.29Å; L112-F116 PolarHBondContact O-N 3.23Å; A113-F116 PolarHBondContact O-N 3.15Å; F116-T119 PolarHBondContact O-N 3.31Å; F116-L120 WeakPolarHBondContact O-CB 3.16Å; F116-L120 WeakPolarHBondContact O-CG 3.32Å; F116-L120 PolarHBondContact O-N 3.02Å
117G47Very low49.1Very low31 Ų3198.6 Ų98.632%0.3254%0.538SS..Hα-helixtrans-64.1-43175.900000112.4A113 L114 L120 M121A113-G117 PolarHBondContact O-N 3.37Å; L114-G117 PolarHBondContact O-N 3.45Å; G117-L120 PolarHBondContact O-N 3.49Å; G117-M121 WeakPolarHBondContact O-CB 3.48Å; G117-M121 WeakPolarHBondContact O-CG 3.37Å; G117-M121 PolarHBondContact O-N 3.29Å
118A52.3Low48Very low56 Ų56106.7 Ų106.746%0.46358%0.575SS.*Hα-helixtrans-64.9-38.8173.600000111.9L114 M121 K122L114-A118 WeakPolarHBondContact O-CB 3.46Å; L114-A118 PolarHBondContact O-N 3Å; A118-M121 PolarHBondContact O-N 3.18Å; A118-K122 VanDerWaalsContact O-CB 3.25Å; A118-K122 WeakPolarHBondContact O-CB 3.49Å; A118-K122 PolarHBondContact O-N 2.98Å
119T51Low47Very low91 Ų91107.7 Ų107.756%0.55860%0.595SS**Hα-helixtrans-67.9-37.8176.6-52.10000111.7N115 F116 K123N115-T119 WeakPolarHBondContact O-CB 3.32Å; N115-T119 PolarHBondContact O-N 3.31Å; N115-T119 PolarHBondContact O-OG1 3.16Å; F116-T119 PolarHBondContact O-N 3.31Å; T119-K123 WeakPolarHBondContact O-CB 3.31Å; T119-K123 PolarHBondContact O-N 3.45Å
120L51.3Low46.4Very low119 Ų119109.4 Ų109.462%0.62361%0.614SS**Hα-helixtrans-70.5-38.2174.6-75.3166.9000112.5F116 G117 K123 K124F116-L120 WeakPolarHBondContact O-CB 3.16Å; F116-L120 WeakPolarHBondContact O-CG 3.32Å; F116-L120 PolarHBondContact O-N 3.02Å; G117-L120 PolarHBondContact O-N 3.49Å; L120-K123 PolarHBondContact O-N 3.32Å; L120-K124 PolarHBondContact O-N 2.89Å; L120-K124 VanDerWaalsContact O-N 3.15Å
121M48.9Very low45.8Very low150 Ų150111.2 Ų111.274%0.73964%0.635SS**Hα-helixtrans-65.6-42.3173.4-74.6-107.6179.200111.4G117 A118 K123 K124 S125G117-M121 WeakPolarHBondContact O-CB 3.48Å; G117-M121 WeakPolarHBondContact O-CG 3.37Å; G117-M121 PolarHBondContact O-N 3.29Å; A118-M121 PolarHBondContact O-N 3.18Å; M121-K123 VanDerWaalsContact C-N 3.28Å; M121-K123 PolarHBondContact O-N 2.9Å; M121-K124 PolarHBondContact O-N 2.88Å; M121-K124 VanDerWaalsContact O-N 3.11Å; M121-S125 PolarHBondContact O-N 3.44Å; M121-S125 PolarHBondContact O-OG 2.89Å
122K47.5Very low44.7Very low162 Ų162117.8 Ų117.870%0.70466%0.664SS**Hα-helixtrans-65.7-30.9176.7-159.4175.5-173.21800112.4A118 S125A118-K122 VanDerWaalsContact O-CB 3.25Å; A118-K122 WeakPolarHBondContact O-CB 3.49Å; A118-K122 PolarHBondContact O-N 2.98Å; K122-S125 PolarHBondContact O-OG 3.37Å
123K41.4Very low43.6Very low173 Ų173120.1 Ų120.175%0.75268%0.677SS**Hα-helixtrans-77.3-19.2174.2-158.1174.2-174.7178.70113.4T119 L120 M121T119-K123 WeakPolarHBondContact O-CB 3.31Å; T119-K123 PolarHBondContact O-N 3.45Å; L120-K123 PolarHBondContact O-N 3.32Å; M121-K123 VanDerWaalsContact C-N 3.28Å; M121-K123 PolarHBondContact O-N 2.9Å
124K42.8Very low42.4Very low193 Ų193126.8 Ų126.884%0.83969%0.694SS**Hα-helixtrans-89.5-13.4176.9-156.4174-175.6178.40112.8L120 M121L120-K124 PolarHBondContact O-N 2.89Å; L120-K124 VanDerWaalsContact O-N 3.15Å; M121-K124 PolarHBondContact O-N 2.88Å; M121-K124 VanDerWaalsContact O-N 3.11Å
125S39.3Very low41.5Very low78 Ų78127.9 Ų127.955%0.54571%0.708SS.*SBendtrans-95.5-0.5-177.857.60000115.5M121 K122 P127M121-S125 PolarHBondContact O-N 3.44Å; M121-S125 PolarHBondContact O-OG 2.89Å; K122-S125 PolarHBondContact O-OG 3.37Å; S125-P127 WeakPolarHBondContact O-CD 3Å
126D37.7Very low40.5Very low135 Ų135131.6 Ų131.672%0.72272%0.721SS**  trans-89.8113.2170.6-79.3-22.4000109.7
127P44.8Very low39.4Very low120 Ų120131 Ų13178%0.77973%0.733SS**  trans-103.683.2-18036-22.9000110.6S125S125-P127 WeakPolarHBondContact O-CD 3Å
128E34.9Very low38.8Very low196 Ų196137.6 Ų137.692%0.91676%0.756SS**  trans-14377.2160.7-75.2-155.715100112.2
129G29.4Very low37.9Very low75 Ų75142.2 Ų142.277%0.77377%0.772SS**  trans55173.2148.600000123.2
130P37.7Very low36.9Very low132 Ų132143.4 Ų143.486%0.85778%0.784SS**  cis-109.3164.9-24.537.1-23.5000113
131A40Very low35.9Very low94 Ų94144.1 Ų144.178%0.77779%0.787SS**  trans-51.6133.7-176.900000115.6
132L29.2Very low35.1Very low170 Ų170148.8 Ų148.889%0.8980%0.796SS**  trans-133.1113.9150.8-83.6179.9000110.1
133L30.8Very low34.4Very low152 Ų152148.5 Ų148.580%0.79680%0.801SS**  trans-60.9131.1174.5-68.6149.1000111.2
134F28.2Very low33.7Very low202 Ų202143.7 Ų143.789%0.88680%0.8SS**  trans-157.6147.9137.6-76-61000109.9
135P32.4Very low33Very low119 Ų119146.5 Ų146.577%0.77381%0.806SS**  trans-94147.7-146.80.420.3000114.4
136E32.5Very low32.3Very low184 Ų184147.5 Ų147.586%0.8682%0.819SS**  trans-58.7128.3164.3-71-93134.500111.1
137S29.2Very low31.8Very low118 Ų118144.4 Ų144.483%0.82582%0.819SS**  trans-120.888.8160.653.10000109.8
138E33.9Very low30.9Very low171 Ų171146.1 Ų146.180%0.79982%0.821SS**  trans-52.2133.6151.3-73.7-168.613300109.4
139L32.1Very low30.6Very low152 Ų152144.4 Ų144.480%0.79682%0.817SS**  trans-153.195.5146.6-137.186.1000110.8I141L139-I141 HydrophobicContact CD2-CD1 3.93Å; L139-I141 HydrophobicContact CD2-CG1 4.24Å
140S30.8Very low30.5Very low117 Ų117145.8 Ų145.882%0.81882%0.815SS**  trans-68.7129160.455.40000110.3
141I31.1Very low30Very low133 Ų133146.4 Ų146.468%0.68281%0.811SS**  trans-130.8107.1162.3-61.6-178.1000109.4L139 I143L139-I141 HydrophobicContact CD2-CD1 3.93Å; L139-I141 HydrophobicContact CD2-CG1 4.24Å; I141-I143 HydrophobicContact CG2-CD1 4.32Å; I141-I143 HydrophobicContact CG2-CG1 4.09Å
142R32Very low29.4Very low248 Ų248151 Ų15194%0.93681%0.813SS**  trans-91121157-88.9-172.2174.5-159.80.3108.1
143I31.2Very low29.3Very low157 Ų157147.5 Ų147.581%0.80580%0.803SS**  trans-142.6119.3156.3-63.2-178.5000108.1I141I141-I143 HydrophobicContact CG2-CD1 4.32Å; I141-I143 HydrophobicContact CG2-CG1 4.09Å
144G27.4Very low29.2Very low71 Ų71148.7 Ų148.773%0.73280%0.804SS**  trans-88153.7170.700000112
145R27.3Very low29.2Very low252 Ų252146.4 Ų146.495%0.95180%0.801SS**  trans-159.3144.5147.9-147.6172-170.1171.42.6111.6
146A26.5Very low29.2Very low100 Ų100144.6 Ų144.683%0.82680%0.804SS**  trans-71.3168.1-17200000116.5
147G25.7Very low29.1Very low70 Ų70144.3 Ų144.372%0.72280%0.803SS**  trans108.4140.3162.200000112.1
148L26Very low29.3Very low155 Ų155143.4 Ų143.481%0.81280%0.802SS**  cis173.1154.6-6.2-134.5152.3000103.2
149L28.1Very low29.1Very low161 Ų161146.3 Ų146.384%0.84381%0.808SS**  trans81.9136.9170.2-48.7168.5000115
150S28.5Very low29Very low103 Ų103148.2 Ų148.272%0.7281%0.813SS**  cis-171.3138.9-5.1174.30000106.6
151D26Very low28.9Very low145 Ų145153.8 Ų153.878%0.77582%0.816SS**  trans6.3131.4152.4-83.6-19.3000120
152K28.3Very low28.8Very low192 Ų192156.6 Ų156.684%0.83582%0.823SS**  167.2141.197.6-117.7169.6-177.7177.60112.6
153S26.3Very low28.6Very low95 Ų95154.6 Ų154.666%0.66482%0.821SS**  trans57.6141147.9-98.50000118.4
154E29.4Very low28.5Very low177 Ų177153.8 Ų153.883%0.82782%0.823SS**  cis-167.8143.312.2-129.6157.313400107.1
155N29.3Very low28.5Very low154 Ų154154.8 Ų154.882%0.82482%0.824SS**  trans-66.2139.7171.4-81.8-21.8000111.2
156G31Very low28.6Very low81 Ų81147.5 Ų147.584%0.83582%0.818SS**  trans-129.692.5163.800000109.8
157E31.6Very low28.7Very low178 Ų178149.7 Ų149.783%0.83282%0.822SS**  trans-68.9138.1-177.3-63.9-179.6148.700112.4
158A31.9Very low28.8Very low99 Ų99149.8 Ų149.882%0.81882%0.823SS**  trans-79.5134.4173.400000111.2Q160A158-Q160 PolarHBondContact O-N 2.88Å; A158-Q160 VanDerWaalsContact O-N 3.16Å
159Y31.3Very low29Very low232 Ų232150.7 Ų150.791%0.9183%0.827SS**  trans-49108.4176.5-113.9-108.7000113
160Q29.6Very low29.5Very low193 Ų193148.9 Ų148.990%0.90283%0.825SS**  trans-88.4125.8155.6-87.1-161.3-12.900109.9A158A158-Q160 PolarHBondContact O-N 2.88Å; A158-Q160 VanDerWaalsContact O-N 3.16Å
161R27.8Very low30.1Very low233 Ų233153.6 Ų153.688%0.87984%0.836SS**  trans-95126.5172.2-176.2-178.4-86.6-174.6-4110.1
162K29.6Very low30.6Very low192 Ų192149.8 Ų149.884%0.83583%0.831SS**  trans83.697.2156.7-109.5177.7176.4-1800119.8
163K27Very low31Very low207 Ų207147 Ų14790%0.983%0.832SS**  trans-52.6123.7155.8-163.5176.7-171.4177.30111.9
164V29.1Very low31.3Very low140 Ų140147.3 Ų147.385%0.84884%0.84SS**  trans-128.4143153.6177.90000107.8
165A28.2Very low31.6Very low91 Ų91144.6 Ų144.675%0.75284%0.836SS**  trans-43.2143.1-16100000118.9
166A28.3Very low32Very low100 Ų100142.9 Ų142.983%0.82683%0.833SS**  trans-76.6136.2166.600000111.7
167T29.2Very low32.4Very low146 Ų146145.1 Ų145.190%0.89683%0.83SS**  trans-140.4135.5152.334.80000107.2
168G28.6Very low32.4Very low72 Ų72142 Ų14274%0.74283%0.826SS**  trans-103.3-154.8-152.400000118.7
169L30.8Very low32.6Very low173 Ų173143.4 Ų143.491%0.90683%0.829SS**  trans108.5156.7173.9-60.4167.9000114.9
170P38.1Very low32.6Very low123 Ų123143.6 Ų143.680%0.79983%0.828SS**  -115.9172.4-98.816.59000114.2
171E41Very low32.6Very low203 Ų203137.3 Ų137.395%0.94982%0.815SS**  trans-53.6138.5-175.9-64.9178.4140.300115.8
172G35.2Very low32.8Very low65 Ų65134.4 Ų134.467%0.6782%0.817SS**  trans-134.215516400000110.4
173P37.1Very low32.8Very low132 Ų132132.9 Ų132.986%0.85782%0.817SS**PPolyproline II helixtrans-73.6142.6-157.328.9-33.5000113.5V175P173-V175 PolarHBondContact O-N 2.85Å
174A32.5Very low33.3Very low102 Ų102127.5 Ų127.584%0.84381%0.812SS**PPolyproline II helixtrans-63.6125.1-174.600000113.4
175V36.7Very low33.5Very low121 Ų121129.4 Ų129.473%0.73381%0.811SS**PPolyproline II helixtrans-88.2134.3165.4-178.10000108.1P173 V177P173-V175 PolarHBondContact O-N 2.85Å; V175-V177 PolarHBondContact O-N 3.12Å
176P36.3Very low33.9Very low117 Ų117129.7 Ų129.776%0.7681%0.805SS**  trans-73.5115178.48.53.7000109.8
177V39.4Very low35Very low129 Ų129128.9 Ų128.978%0.78279%0.793SS**  trans-76.5126.1171.1-178.70000108.3V175V175-V177 PolarHBondContact O-N 3.12Å
178P32.8Very low35.9Very low113 Ų113123 Ų12373%0.73476%0.763SS**  trans-70.4134.4174.527.2-29.9000109.9R180P178-R180 PolarHBondContact O-N 3.22Å
179S36.2Very low37.3Very low127 Ų127123 Ų12389%0.88875%0.751SS**  trans-54104177.4-59.30000111.1G181S179-G181 PolarHBondContact O-N 2.86Å
180R31.7Very low39.1Very low237 Ų237118 Ų11889%0.89473%0.73SS**  trans-68.699.4166.1-121.9178.2-178174.30.2107P178 N182P178-R180 PolarHBondContact O-N 3.22Å; R180-N182 PolarHBondContact O-N 2.82Å
181G28.6Very low40.7Very low61 Ų61113.9 Ų113.963%0.62970%0.699SS**  trans-53.7136.8165.800000109.3S179 L183S179-G181 PolarHBondContact O-N 2.86Å; G181-L183 PolarHBondContact O-N 3.46Å
182N31.6Very low42.2Very low172 Ų172107.1 Ų107.192%0.9267%0.665SS**  trans-54.399.1172.6-86.3-17000109.4R180 A184R180-N182 PolarHBondContact O-N 2.82Å; N182-A184 VanDerWaalsContact C-N 3.31Å; N182-A184 PolarHBondContact O-N 3.37Å
183L31.3Very low43.9Very low160 Ų160110.5 Ų110.584%0.83866%0.657SS**  trans-69.198.3158.2-73164.1000105.6G181 Q185G181-L183 PolarHBondContact O-N 3.46Å; L183-Q185 PolarHBondContact O-N 3.26Å
184A36.9Very low45.8Very low94 Ų94104.8 Ų104.878%0.77762%0.619SS**  trans-52.4114.3166.800000108.1N182N182-A184 VanDerWaalsContact C-N 3.31Å; N182-A184 PolarHBondContact O-N 3.37Å
185Q33.5Very low48Very low179 Ų179101 Ų10184%0.83659%0.589SS**  trans-56.9132171.6-72.1-93.917.500108.5L183L183-Q185 PolarHBondContact O-N 3.26Å
186P36.7Very low49.7Very low97 Ų9795.6 Ų95.663%0.6356%0.555SS**  trans-76.7154.3-169.130.6-33.4000112.3G188P186-G188 PolarHBondContact O-N 2.81Å
187S50.3Low51.5Low83 Ų8390.8 Ų90.858%0.5852%0.523SS*.THydrogen-bonded Turntrans-50.8-2.7-175.152.10000118.6S189S187-S189 PolarHBondContact O-N 3.39Å
188G48.5Very low53.6Low24 Ų2486 Ų8625%0.24749%0.493CS..Hα-helixtrans-69.8-26-177.300000114.6A105 P186 R192A105-G188 WeakPolarHBondContact O-CA 3.47Å; P186-G188 PolarHBondContact O-N 2.81Å; G188-R192 WeakPolarHBondContact O-CB 3.47Å; G188-R192 PolarHBondContact O-N 3.33Å
189S57.8Low55.9Low71 Ų7184.1 Ų84.150%0.49748%0.476SS..Hα-helixtrans-74.2-33.2-179.566.70000113.5S187 R193S187-S189 PolarHBondContact O-N 3.39Å; S189-R193 WeakPolarHBondContact O-CG 3.34Å; S189-R193 PolarHBondContact O-N 3.48Å
190S68.6Low57.8Low68 Ų6878.3 Ų78.348%0.47644%0.436SS..Hα-helixtrans-76.7-38.3-175.7-56.50000111.9R193 I194S190-R193 PolarHBondContact O-N 3.28Å; S190-I194 WeakPolarHBondContact O-CG1 3.48Å; S190-I194 PolarHBondContact O-N 2.61Å
191W73.1Confident60.2Low36 Ų3667.3 Ų67.314%0.13640%0.395CS..Hα-helixtrans-66.3-42.3174.1174.9-114.5000111.9A104 D107 P108 R193 I194 A195 L252 F257A104-W191 PolarHBondContact O-NE1 3.32Å; D107-W191 HydrophobicContact CB-CB 4.46Å; D107-W191 HydrophobicContact CB-CG 4.45Å; P108-W191 VanDerWaalsContact CD-CE2 3.45Å; P108-W191 HydrophobicContact CG-CH2 4.03Å; P108-W191 HydrophobicContact CG-CZ2 3.57Å; W191-R193 VanDerWaalsContact C-N 3.28Å; W191-R193 PolarHBondContact O-N 3.28Å; W191-I194 HydrophobicContact CE3-CB 4.35Å; W191-I194 HydrophobicContact CE3-CG2 4.26Å; W191-I194 HydrophobicContact CZ3-CG2 4.08Å; W191-I194 PolarHBondContact O-N 2.93Å; W191-I194 VanDerWaalsContact O-N 3.1Å; W191-A195 HydrophobicContact CZ2-CB 4.47Å; W191-A195 WeakPolarHBondContact O-CB 3.12Å; W191-A195 PolarHBondContact O-N 2.82Å; W191-L252 HydrophobicContact CZ3-CD2 4.13Å; W191-F257 HydrophobicContact CE3-CE2 4.25Å; W191-F257 HydrophobicContact CE3-CZ 4.03Å; W191-F257 HydrophobicContact CH2-CZ 4.39Å; W191-F257 HydrophobicContact CZ3-CE1 4.4Å; W191-F257 HydrophobicContact CZ3-CE2 4.11Å; W191-F257 AromaticContact CZ3-CZ 3.61Å; W191-F257 HydrophobicContact CZ3-CZ 3.61Å
192R71.9Confident63Low62 Ų6266 Ų6623%0.23438%0.375CS..Hα-helixtrans-52-46.9175.6-176.8174.2172.6-113.6-2111.8D96 M99 G188 A195 L196D96-R192 VanDerWaalsContact CG-NH2 3.27Å; D96-R192 PolarHBondContact O-NH2 2.95Å; D96-R192 IonicContact OD1-CZ 3.22Å; D96-R192 IonicContact OD1-NE 3.91Å; D96-R192 IonicContact OD1-NH1 3.51Å; D96-R192 IonicContact OD1-NH2 2.89Å; D96-R192 PolarHBondContact OD1-NH2 3.39Å; D96-R192 IonicContact OD2-NH2 3.17Å; D96-R192 PolarHBondContact OD2-NH2 3.26Å; D96-R192 VanDerWaalsContact OD2-NH2 3.17Å; M99-R192 HydrophobicContact CB-CG 4.37Å; M99-R192 HydrophobicContact CE-CB 4.34Å; M99-R192 HydrophobicContact CE-CG 3.1Å; M99-R192 WeakPolarHBondContact CE-O 3.48Å; M99-R192 HydrophobicContact SD-CG 3.8Å; G188-R192 WeakPolarHBondContact O-CB 3.47Å; G188-R192 PolarHBondContact O-N 3.33Å; R192-A195 PolarHBondContact O-N 3.15Å; R192-L196 PolarHBondContact O-N 3.32Å; R192-L196 VanDerWaalsContact O-N 3.11Å
193R71.6Confident65.3Low135 Ų13560 Ų6051%0.50934%0.342SS..Hα-helixtrans-63.5-44.6176.4-69.5175.4-178.9-144.3-6.2112.6S189 S190 W191 A195 L196 L197S189-R193 WeakPolarHBondContact O-CG 3.34Å; S189-R193 PolarHBondContact O-N 3.48Å; S190-R193 PolarHBondContact O-N 3.28Å; W191-R193 VanDerWaalsContact C-N 3.28Å; W191-R193 PolarHBondContact O-N 3.28Å; R193-A195 PolarHBondContact O-N 3.35Å; R193-L196 PolarHBondContact O-N 3.34Å; R193-L197 WeakPolarHBondContact O-CB 3.4Å; R193-L197 PolarHBondContact O-N 2.93Å
194I77Confident67.8Low12 Ų1252.5 Ų52.56%0.06230%0.303CS..Hα-helixtrans-65-41.1179.3-68.1167.3000111.4S190 W191 L197 I198 P251 L252 A255S190-I194 WeakPolarHBondContact O-CG1 3.48Å; S190-I194 PolarHBondContact O-N 2.61Å; W191-I194 HydrophobicContact CE3-CB 4.35Å; W191-I194 HydrophobicContact CE3-CG2 4.26Å; W191-I194 HydrophobicContact CZ3-CG2 4.08Å; W191-I194 PolarHBondContact O-N 2.93Å; W191-I194 VanDerWaalsContact O-N 3.1Å; I194-L197 PolarHBondContact O-N 3.47Å; I194-I198 HydrophobicContact CG2-CD1 3.86Å; I194-I198 VanDerWaalsContact O-CG1 3.3Å; I194-I198 WeakPolarHBondContact O-CG1 3.48Å; I194-I198 PolarHBondContact O-N 3.03Å; I194-P251 HydrophobicContact CG1-CB 4.19Å; I194-L252 HydrophobicContact CG2-CD2 3.44Å; I194-L252 VanDerWaalsContact CG2-CD2 3.44Å; I194-L252 HydrophobicContact CG2-CG 3.74Å; I194-A255 HydrophobicContact CD1-CB 3.47Å; I194-A255 VanDerWaalsContact CD1-CB 3.47Å
195A77.9Confident70.3Confident24 Ų2448 Ų4820%0.19827%0.266CS..Hα-helixtrans-64.2-4117800000111.8M99 W191 R192 R193 L199M99-A195 HydrophobicContact SD-CB 4.43Å; W191-A195 HydrophobicContact CZ2-CB 4.47Å; W191-A195 WeakPolarHBondContact O-CB 3.12Å; W191-A195 PolarHBondContact O-N 2.82Å; R192-A195 PolarHBondContact O-N 3.15Å; R193-A195 PolarHBondContact O-N 3.35Å; A195-L199 VanDerWaalsContact O-CB 3.27Å; A195-L199 WeakPolarHBondContact O-CB 3.34Å; A195-L199 PolarHBondContact O-N 2.87Å
196L71.3Confident72.8Confident6 Ų642.3 Ų42.33%0.03124%0.243CC..Hα-helixtrans-62.3-45.8171.1-78.5172.4000112.9A95 D96 M99 R192 R193 I198 L199 A200A95-L196 HydrophobicContact CB-CD2 3.92Å; D96-L196 HydrophobicContact CB-CD1 3.79Å; D96-L196 VanDerWaalsContact OD1-CD1 3.22Å; D96-L196 WeakPolarHBondContact OD1-CD1 3.21Å; M99-L196 HydrophobicContact CE-CB 4.29Å; M99-L196 HydrophobicContact CE-CD1 3.1Å; M99-L196 HydrophobicContact CE-CD2 3.36Å; M99-L196 HydrophobicContact CE-CG 2.96Å; M99-L196 HydrophobicContact CG-CD2 4.17Å; M99-L196 HydrophobicContact SD-CD1 4.31Å; M99-L196 HydrophobicContact SD-CD2 3.66Å; M99-L196 HydrophobicContact SD-CG 3.51Å; M99-L196 VanDerWaalsContact SD-CG 3.51Å; R192-L196 PolarHBondContact O-N 3.32Å; R192-L196 VanDerWaalsContact O-N 3.11Å; R193-L196 PolarHBondContact O-N 3.34Å; L196-I198 VanDerWaalsContact C-N 3.28Å; L196-I198 PolarHBondContact O-N 3.02Å; L196-L199 CarbonylContact O-C 3.58Å; L196-L199 PolarHBondContact O-N 2.86Å; L196-L199 VanDerWaalsContact O-N 3.13Å; L196-A200 WeakPolarHBondContact O-CB 3.18Å; L196-A200 PolarHBondContact O-N 3.48Å
197L74.9Confident75.1Confident16 Ų1638.1 Ų38.18%0.08422%0.216CC..Hα-helixtrans-59.1-47.2-177.6-177.763.6000109.8R193 I194 I201 A247 P251 V305R193-L197 WeakPolarHBondContact O-CB 3.4Å; R193-L197 PolarHBondContact O-N 2.93Å; I194-L197 PolarHBondContact O-N 3.47Å; L197-I201 HydrophobicContact CD1-CD1 3.66Å; L197-I201 HydrophobicContact CD1-CG1 4.34Å; L197-I201 HydrophobicContact CG-CD1 3.88Å; L197-I201 WeakPolarHBondContact O-CB 3.17Å; L197-I201 VanDerWaalsContact O-CG1 3.26Å; L197-I201 WeakPolarHBondContact O-CG1 3.39Å; L197-I201 PolarHBondContact O-N 3.19Å; L197-A247 WeakPolarHBondContact CD2-O 3.34Å; L197-P251 HydrophobicContact CD2-CG 4.07Å; L197-V305 HydrophobicContact CD1-CG1 3.73Å
198I83.4Confident76.9Confident29 Ų2934.1 Ų34.115%0.14919%0.188CC..Hα-helixtrans-59.7-48.1174.2-66.1164.4000110.6I194 L196 T202 V248 L252I194-I198 HydrophobicContact CG2-CD1 3.86Å; I194-I198 VanDerWaalsContact O-CG1 3.3Å; I194-I198 WeakPolarHBondContact O-CG1 3.48Å; I194-I198 PolarHBondContact O-N 3.03Å; L196-I198 VanDerWaalsContact C-N 3.28Å; L196-I198 PolarHBondContact O-N 3.02Å; I198-T202 VanDerWaalsContact O-CB 3.26Å; I198-T202 WeakPolarHBondContact O-CB 3.12Å; I198-T202 PolarHBondContact O-N 2.97Å; I198-T202 PolarHBondContact O-OG1 2.95Å; I198-V248 HydrophobicContact CD1-CG1 4.41Å; I198-V248 HydrophobicContact CG1-CG1 3.64Å; I198-L252 HydrophobicContact CD1-CD1 4.14Å; I198-L252 HydrophobicContact CD1-CD2 4.39Å
199L82Confident78.9Confident73 Ų7333 Ų3338%0.38218%0.176SC..Hα-helixtrans-62.7-47.2-177.9178.165.4000112.1A95 A195 L196 T202 I203A95-L199 HydrophobicContact CB-CD2 4.34Å; A195-L199 VanDerWaalsContact O-CB 3.27Å; A195-L199 WeakPolarHBondContact O-CB 3.34Å; A195-L199 PolarHBondContact O-N 2.87Å; L196-L199 CarbonylContact O-C 3.58Å; L196-L199 PolarHBondContact O-N 2.86Å; L196-L199 VanDerWaalsContact O-N 3.13Å; L199-T202 PolarHBondContact O-N 3.49Å; L199-I203 HydrophobicContact CD1-CD1 3.73Å; L199-I203 HydrophobicContact CD1-CG1 4.36Å; L199-I203 HydrophobicContact CG-CD1 4Å; L199-I203 WeakPolarHBondContact O-CB 3.43Å; L199-I203 WeakPolarHBondContact O-CG1 3.15Å; L199-I203 PolarHBondContact O-N 3.23Å
200A75.6Confident80.4Confident6 Ų631 Ų315%0.0516%0.16CC..Hα-helixtrans-65.5-45.8-177.700000111V92 L196 I203 H204 V305V92-A200 HydrophobicContact CG1-CB 4.26Å; V92-A200 HydrophobicContact CG2-CB 4.22Å; L196-A200 WeakPolarHBondContact O-CB 3.18Å; L196-A200 PolarHBondContact O-N 3.48Å; A200-I203 PolarHBondContact O-N 3.02Å; A200-H204 WeakPolarHBondContact O-CB 3.35Å; A200-H204 PolarHBondContact O-N 3.13Å; A200-V305 HydrophobicContact CB-CG2 3.52Å
201I81.6Confident81.2Confident6 Ų627.9 Ų27.93%0.03114%0.138CC..Hα-helixtrans-62.6-45.5174.4-68.8170.9000110.2L197 I203 H204 N205 V248L197-I201 HydrophobicContact CD1-CD1 3.66Å; L197-I201 HydrophobicContact CD1-CG1 4.34Å; L197-I201 HydrophobicContact CG-CD1 3.88Å; L197-I201 WeakPolarHBondContact O-CB 3.17Å; L197-I201 VanDerWaalsContact O-CG1 3.26Å; L197-I201 WeakPolarHBondContact O-CG1 3.39Å; L197-I201 PolarHBondContact O-N 3.19Å; I201-I203 VanDerWaalsContact C-N 3.26Å; I201-I203 PolarHBondContact O-N 3.35Å; I201-H204 WeakPolarHBondContact O-CB 3.36Å; I201-H204 PolarHBondContact O-N 2.82Å; I201-H204 VanDerWaalsContact O-N 3.15Å; I201-N205 PolarHBondContact O-N 3.2Å; I201-N205 PolarHBondContact O-ND2 3.47Å; I201-N205 PolarHBondContact O-OD1 3.46Å; I201-V248 HydrophobicContact CB-CG2 4.37Å; I201-V248 HydrophobicContact CD1-CG2 3.37Å; I201-V248 HydrophobicContact CG1-CG2 4.44Å; I201-V248 HydrophobicContact CG2-CG2 4.21Å
202T87.1Confident82.1Confident34 Ų3426.1 Ų26.121%0.20913%0.132CC..Hα-helixtrans-56.8-41.8176.7-55.70000111.8I198 L199 N205 V272I198-T202 VanDerWaalsContact O-CB 3.26Å; I198-T202 WeakPolarHBondContact O-CB 3.12Å; I198-T202 PolarHBondContact O-N 2.97Å; I198-T202 PolarHBondContact O-OG1 2.95Å; L199-T202 PolarHBondContact O-N 3.49Å; T202-N205 PolarHBondContact O-N 3.48Å; T202-V272 HydrophobicContact CG2-CG1 3.75Å; T202-V272 HydrophobicContact CG2-CG2 4.33Å; T202-V272 WeakPolarHBondContact O-CG2 3.16Å
203I81.4Confident83Confident44 Ų4423.2 Ų23.223%0.22612%0.12CC..Hα-helixtrans-74-33-178.8-73.5174.1000111.8F91 L199 A200 I201 N205 V206 P207 F297F91-I203 HydrophobicContact CD1-CG2 4.41Å; F91-I203 HydrophobicContact CE1-CB 4.38Å; F91-I203 HydrophobicContact CE1-CD1 3.33Å; F91-I203 HydrophobicContact CE1-CG1 4.43Å; F91-I203 HydrophobicContact CE1-CG2 3.96Å; F91-I203 HydrophobicContact CE2-CD1 4.35Å; F91-I203 HydrophobicContact CZ-CD1 3.18Å; F91-I203 HydrophobicContact CZ-CG2 4.5Å; L199-I203 HydrophobicContact CD1-CD1 3.73Å; L199-I203 HydrophobicContact CD1-CG1 4.36Å; L199-I203 HydrophobicContact CG-CD1 4Å; L199-I203 WeakPolarHBondContact O-CB 3.43Å; L199-I203 WeakPolarHBondContact O-CG1 3.15Å; L199-I203 PolarHBondContact O-N 3.23Å; A200-I203 PolarHBondContact O-N 3.02Å; I201-I203 VanDerWaalsContact C-N 3.26Å; I201-I203 PolarHBondContact O-N 3.35Å; I203-N205 VanDerWaalsContact C-N 3.32Å; I203-V206 PolarHBondContact O-N 2.99Å; I203-P207 WeakPolarHBondContact O-CD 3.46Å; I203-F297 HydrophobicContact CG2-CE1 3.86Å; I203-F297 HydrophobicContact CG2-CZ 4.35Å
204H83Confident83.8Confident4 Ų417.1 Ų17.12%0.01910%0.099CC..Hα-helixtrans-64.7-37.1174.3-171.393.8000112.7L59 A200 I201 V206 P207 E208 A298 M302L59-H204 WeakPolarHBondContact CD1-CE1 3.26Å; L59-H204 VanDerWaalsContact CD1-NE2 3.35Å; L59-H204 WeakPolarHBondContact CD1-NE2 3.42Å; A200-H204 WeakPolarHBondContact O-CB 3.35Å; A200-H204 PolarHBondContact O-N 3.13Å; I201-H204 WeakPolarHBondContact O-CB 3.36Å; I201-H204 PolarHBondContact O-N 2.82Å; I201-H204 VanDerWaalsContact O-N 3.15Å; H204-V206 PolarHBondContact O-N 3.11Å; H204-V206 VanDerWaalsContact O-N 3.15Å; H204-P207 VanDerWaalsContact O-CD 3.22Å; H204-P207 WeakPolarHBondContact O-CD 3.45Å; H204-E208 IonicContact CD2-OE1 3.12Å; H204-E208 PolarHBondContact CD2-OE1 3.2Å; H204-E208 IonicContact NE2-OE1 3.08Å; H204-E208 PolarHBondContact NE2-OE1 3.03Å; H204-E208 VanDerWaalsContact NE2-OE1 3.08Å; H204-A298 WeakPolarHBondContact CE1-CB 3.31Å; H204-A298 PolarHBondContact CE1-O 2.87Å; H204-A298 VanDerWaalsContact ND1-C 3.26Å; H204-A298 WeakPolarHBondContact ND1-CA 3.4Å; H204-A298 PolarHBondContact ND1-O 2.87Å; H204-M302 VanDerWaalsContact CD2-CE 3.46Å; H204-M302 WeakPolarHBondContact CD2-CE 3.46Å; H204-M302 WeakPolarHBondContact CE1-CE 3.46Å; H204-M302 WeakPolarHBondContact NE2-CE 3.46Å
205N88.3Confident84.4Confident0 Ų017.4 Ų17.40%010%0.104CC..Hα-helixtrans-66.8-16.2-179.6-69.7-7.7000113.4I201 T202 I203 G209 E244 S269 G270 V272 E273I201-N205 PolarHBondContact O-N 3.2Å; I201-N205 PolarHBondContact O-ND2 3.47Å; I201-N205 PolarHBondContact O-OD1 3.46Å; T202-N205 PolarHBondContact O-N 3.48Å; I203-N205 VanDerWaalsContact C-N 3.32Å; N205-G209 PolarHBondContact O-N 3.41Å; N205-E244 PolarHBondContact OD1-OE2 3.14Å; N205-S269 PolarHBondContact ND2-O 2.71Å; N205-G270 WeakPolarHBondContact ND2-CA 3.34Å; N205-V272 HydrophobicContact CB-CG2 3.46Å; N205-V272 VanDerWaalsContact CB-CG2 3.46Å; N205-E273 HydrophobicContact CB-CG 3.76Å; N205-E273 WeakPolarHBondContact O-CG 3.44Å
206V86.8Confident85Confident58 Ų5816.3 Ų16.335%0.35210%0.095SC..Hα-helixtrans-70.7-54.9177.4173.10000111.7I203 H204 E208 G209 L210 V272 A276I203-V206 PolarHBondContact O-N 2.99Å; H204-V206 PolarHBondContact O-N 3.11Å; H204-V206 VanDerWaalsContact O-N 3.15Å; V206-E208 VanDerWaalsContact C-N 3.27Å; V206-E208 PolarHBondContact O-N 3.31Å; V206-G209 PolarHBondContact O-N 2.94Å; V206-L210 HydrophobicContact CG1-CD1 4.2Å; V206-L210 WeakPolarHBondContact O-CB 3.5Å; V206-L210 WeakPolarHBondContact O-CG 3.23Å; V206-L210 PolarHBondContact O-N 3.28Å; V206-V272 HydrophobicContact CG2-CB 4.04Å; V206-V272 HydrophobicContact CG2-CG2 3.97Å; V206-A276 HydrophobicContact CG1-CB 4.35Å; V206-A276 WeakPolarHBondContact O-CB 3.42Å
207P84.6Confident85.8Confident9 Ų916.1 Ų16.16%0.05810%0.095CC..Hα-helixtrans-52.2-39170.3-32.635.8000114.9I203 H204 L210 A211 A294 A298I203-P207 WeakPolarHBondContact O-CD 3.46Å; H204-P207 VanDerWaalsContact O-CD 3.22Å; H204-P207 WeakPolarHBondContact O-CD 3.45Å; P207-L210 WeakPolarHBondContact O-CB 3.07Å; P207-L210 PolarHBondContact O-N 3.3Å; P207-A211 WeakPolarHBondContact O-CB 3.44Å; P207-A211 PolarHBondContact O-N 2.88Å; P207-A294 HydrophobicContact CB-CB 4.34Å; P207-A294 WeakPolarHBondContact CB-O 3.23Å; P207-A294 HydrophobicContact CG-CB 4.4Å; P207-A294 WeakPolarHBondContact CG-O 3.37Å; P207-A298 HydrophobicContact CB-CB 3.65Å; P207-A298 HydrophobicContact CG-CB 3.81Å
208E88.4Confident86.3Confident0 Ų015.9 Ų15.90%010%0.095CC..Hα-helixtrans-64.7-50.3177.8-67.5-174.4170.600112.2H204 V206 L210 A211 V212 I237 Q240 N241H204-E208 IonicContact CD2-OE1 3.12Å; H204-E208 PolarHBondContact CD2-OE1 3.2Å; H204-E208 IonicContact NE2-OE1 3.08Å; H204-E208 PolarHBondContact NE2-OE1 3.03Å; H204-E208 VanDerWaalsContact NE2-OE1 3.08Å; V206-E208 VanDerWaalsContact C-N 3.27Å; V206-E208 PolarHBondContact O-N 3.31Å; E208-L210 VanDerWaalsContact C-N 3.3Å; E208-L210 PolarHBondContact O-N 3.02Å; E208-A211 PolarHBondContact O-N 3.23Å; E208-A211 VanDerWaalsContact O-N 3.11Å; E208-V212 WeakPolarHBondContact O-CG2 3.26Å; E208-V212 PolarHBondContact O-N 3.32Å; E208-I237 HydrophobicContact CB-CD1 4.29Å; E208-I237 HydrophobicContact CB-CG2 3.97Å; E208-I237 HydrophobicContact CG-CG2 4.23Å; E208-I237 WeakPolarHBondContact OE2-CG2 3.48Å; E208-Q240 PolarHBondContact OE1-NE2 2.99Å; E208-N241 PolarHBondContact OE2-ND2 2.8Å; E208-N241 PolarHBondContact OE2-OD1 3.08Å; E208-N241 VanDerWaalsContact OE2-OD1 3.11Å
209G90.5Very high86.4Confident0 Ų016 Ų160%010%0.096CC..Hα-helixtrans-57.4-45.4175.100000111.3N205 V206 A211 V212 G213 E273 G277N205-G209 PolarHBondContact O-N 3.41Å; V206-G209 PolarHBondContact O-N 2.94Å; G209-A211 VanDerWaalsContact C-N 3.34Å; G209-A211 PolarHBondContact O-N 3.24Å; G209-V212 PolarHBondContact O-N 3.12Å; G209-G213 PolarHBondContact O-N 3.12Å; G209-E273 WeakPolarHBondContact CA-O 3.46Å; G209-G277 WeakPolarHBondContact O-CA 3.35Å; G209-G277 PolarHBondContact O-N 2.94Å
210L88.8Confident86.3Confident28 Ų2821.3 Ų21.315%0.14712%0.119CC..Hα-helixtrans-57-45.1174.2-79.6170.8000112.1V206 P207 E208 G213 V214 A276 F279 L291V206-L210 HydrophobicContact CG1-CD1 4.2Å; V206-L210 WeakPolarHBondContact O-CB 3.5Å; V206-L210 WeakPolarHBondContact O-CG 3.23Å; V206-L210 PolarHBondContact O-N 3.28Å; P207-L210 WeakPolarHBondContact O-CB 3.07Å; P207-L210 PolarHBondContact O-N 3.3Å; E208-L210 VanDerWaalsContact C-N 3.3Å; E208-L210 PolarHBondContact O-N 3.02Å; L210-G213 PolarHBondContact O-N 3.26Å; L210-V214 WeakPolarHBondContact O-CB 3.35Å; L210-V214 VanDerWaalsContact O-CG2 3.31Å; L210-V214 WeakPolarHBondContact O-CG2 3.46Å; L210-V214 PolarHBondContact O-N 3.03Å; L210-A276 HydrophobicContact CG-CB 4.22Å; L210-F279 HydrophobicContact CD2-CD1 3.62Å; L210-F279 HydrophobicContact CD2-CE1 4.17Å; L210-L291 HydrophobicContact CB-CD1 4.23Å
211A86.4Confident86.4Confident3 Ų327.1 Ų27.13%0.02514%0.143CC..Hα-helixtrans-64.4-44.5-178.400000112P207 E208 G209 G213 G215 L233 L295P207-A211 WeakPolarHBondContact O-CB 3.44Å; P207-A211 PolarHBondContact O-N 2.88Å; E208-A211 PolarHBondContact O-N 3.23Å; E208-A211 VanDerWaalsContact O-N 3.11Å; G209-A211 VanDerWaalsContact C-N 3.34Å; G209-A211 PolarHBondContact O-N 3.24Å; A211-G213 VanDerWaalsContact C-N 3.33Å; A211-G213 PolarHBondContact O-N 3.14Å; A211-G215 PolarHBondContact O-N 3.32Å; A211-L233 HydrophobicContact CB-CD2 4.24Å; A211-L295 HydrophobicContact CB-CD2 3.9Å
212V91.3Very high85.9Confident0 Ų030.3 Ų30.30%016%0.163CC..Hα-helixtrans-60.4-45.4172.5176.40000110.6T15 T18 E208 G209 G215 F216 A234 I237T15-V212 HydrophobicContact CG2-CB 3.79Å; T15-V212 HydrophobicContact CG2-CG1 3.67Å; T18-V212 HydrophobicContact CG2-CG2 4.35Å; E208-V212 WeakPolarHBondContact O-CG2 3.26Å; E208-V212 PolarHBondContact O-N 3.32Å; G209-V212 PolarHBondContact O-N 3.12Å; V212-G215 PolarHBondContact O-N 2.86Å; V212-F216 HydrophobicContact CG1-CD2 3.92Å; V212-F216 HydrophobicContact CG1-CE2 3.96Å; V212-F216 VanDerWaalsContact O-CD2 3.3Å; V212-F216 WeakPolarHBondContact O-CD2 3.35Å; V212-F216 PolarHBondContact O-N 3.21Å; V212-F216 VanDerWaalsContact O-N 3.1Å; V212-A234 HydrophobicContact CB-CB 4.46Å; V212-A234 HydrophobicContact CG1-CB 3.79Å; V212-A234 HydrophobicContact CG2-CB 3.84Å; V212-I237 HydrophobicContact CG2-CD1 3.61Å
213G91.3Very high84.9Confident0 Ų033.5 Ų33.50%019%0.193CC..Hα-helixtrans-60.4-50.7179.100000113.7G209 L210 A211 F216 G217 G277 A281G209-G213 PolarHBondContact O-N 3.12Å; L210-G213 PolarHBondContact O-N 3.26Å; A211-G213 VanDerWaalsContact C-N 3.33Å; A211-G213 PolarHBondContact O-N 3.14Å; G213-F216 PolarHBondContact O-N 3.04Å; G213-G217 PolarHBondContact O-N 3.19Å; G213-G277 WeakPolarHBondContact CA-O 3.05Å; G213-A281 VanDerWaalsContact O-CA 3.27Å; G213-A281 WeakPolarHBondContact O-CA 3.41Å; G213-A281 PolarHBondContact O-N 2.85Å
214V88.9Confident84.2Confident8 Ų836 Ų365%0.04821%0.214CC..Hα-helixtrans-64.5-41.9177.1172.60000110.6L210 F216 G217 A218 V284 A287 L291L210-V214 WeakPolarHBondContact O-CB 3.35Å; L210-V214 VanDerWaalsContact O-CG2 3.31Å; L210-V214 WeakPolarHBondContact O-CG2 3.46Å; L210-V214 PolarHBondContact O-N 3.03Å; V214-F216 VanDerWaalsContact C-N 3.35Å; V214-F216 PolarHBondContact O-N 3.35Å; V214-G217 CarbonylContact O-C 3.55Å; V214-G217 PolarHBondContact O-N 3.47Å; V214-G217 VanDerWaalsContact O-N 3.14Å; V214-A218 WeakPolarHBondContact O-CB 3.49Å; V214-A218 PolarHBondContact O-N 3.25Å; V214-V284 HydrophobicContact CG1-CG1 4.38Å; V214-A287 HydrophobicContact CG2-CB 3.43Å; V214-A287 VanDerWaalsContact CG2-CB 3.43Å; V214-L291 HydrophobicContact CB-CD1 4.5Å; V214-L291 HydrophobicContact CB-CD2 4.08Å; V214-L291 HydrophobicContact CG1-CD2 3.9Å; V214-L291 HydrophobicContact CG2-CD1 4.13Å; V214-L291 HydrophobicContact CG2-CD2 4.49Å
215G87.9Confident84Confident18 Ų1836.7 Ų36.719%0.18622%0.22CC..Hα-helixtrans-53.8-50176.500000112A211 V212 A230A211-G215 PolarHBondContact O-N 3.32Å; V212-G215 PolarHBondContact O-N 2.86Å; G215-A230 VanDerWaalsContact C-CB 3.48Å
216F91.1Very high83.9Confident0 Ų039.7 Ų39.70%024%0.239CC..Hα-helixtrans-73.5-32.5176.2-76.7-65.7000113.8M1 S7 Q10 A11 V212 G213 V214 A218 I219 F227 A230 R231 A234M1-F216 HydrophobicContact CB-CZ 4.16Å; M1-F216 HydrophobicContact CE-CE2 4.02Å; M1-F216 HydrophobicContact CE-CZ 3.72Å; M1-F216 HydrophobicContact CG-CE1 4.45Å; M1-F216 HydrophobicContact CG-CE2 4.19Å; M1-F216 HydrophobicContact CG-CZ 3.67Å; S7-F216 VanDerWaalsContact CB-O 3.22Å; S7-F216 WeakPolarHBondContact CB-O 3.43Å; S7-F216 PolarHBondContact OG-O 3.27Å; Q10-F216 HydrophobicContact CB-CB 3.96Å; Q10-F216 HydrophobicContact CB-CD1 3.31Å; Q10-F216 HydrophobicContact CB-CD2 4.28Å; Q10-F216 HydrophobicContact CB-CE1 3.87Å; Q10-F216 HydrophobicContact CB-CG 3.58Å; Q10-F216 HydrophobicContact CG-CD1 4.07Å; A11-F216 HydrophobicContact CB-CB 4.07Å; V212-F216 HydrophobicContact CG1-CD2 3.92Å; V212-F216 HydrophobicContact CG1-CE2 3.96Å; V212-F216 VanDerWaalsContact O-CD2 3.3Å; V212-F216 WeakPolarHBondContact O-CD2 3.35Å; V212-F216 PolarHBondContact O-N 3.21Å; V212-F216 VanDerWaalsContact O-N 3.1Å; G213-F216 PolarHBondContact O-N 3.04Å; V214-F216 VanDerWaalsContact C-N 3.35Å; V214-F216 PolarHBondContact O-N 3.35Å; F216-A218 VanDerWaalsContact C-N 3.33Å; F216-I219 HydrophobicContact CB-CD1 4.47Å; F216-I219 HydrophobicContact CD1-CD1 3.6Å; F216-I219 HydrophobicContact CE1-CD1 4.31Å; F216-I219 HydrophobicContact CG-CD1 4.48Å; F216-I219 WeakPolarHBondContact O-CG1 3.42Å; F216-F227 HydrophobicContact CE1-CD2 4.03Å; F216-F227 AromaticContact CE1-CE2 3.95Å; F216-F227 HydrophobicContact CE1-CE2 3.95Å; F216-A230 HydrophobicContact CD1-CB 3.75Å; F216-A230 HydrophobicContact CD2-CB 4.31Å; F216-A230 HydrophobicContact CE1-CB 3.73Å; F216-A230 HydrophobicContact CE2-CB 4.3Å; F216-A230 HydrophobicContact CG-CB 4.03Å; F216-A230 HydrophobicContact CZ-CB 3.99Å; F216-R231 HydrophobicContact CZ-CB 4.45Å; F216-A234 HydrophobicContact CE2-CB 4.31Å
217G87.9Confident83.9Confident3 Ų338.5 Ų38.53%0.03123%0.229CC..Hα-helixtrans-71.4-23.7176.900000114.6G213 V214 K221G213-G217 PolarHBondContact O-N 3.19Å; V214-G217 CarbonylContact O-C 3.55Å; V214-G217 PolarHBondContact O-N 3.47Å; V214-G217 VanDerWaalsContact O-N 3.14Å; G217-K221 VanDerWaalsContact O-CE 3.3Å; G217-K221 WeakPolarHBondContact O-CE 3.11Å; G217-K221 PolarHBondContact O-NZ 2.86Å
218A86.2Confident83.9Confident11 Ų1141.7 Ų41.79%0.09124%0.243CC..THydrogen-bonded Turntrans-94-4.6-178.100000113.4V214 F216 E220 K221 A225 V284V214-A218 WeakPolarHBondContact O-CB 3.49Å; V214-A218 PolarHBondContact O-N 3.25Å; F216-A218 VanDerWaalsContact C-N 3.33Å; A218-E220 PolarHBondContact O-N 2.88Å; A218-K221 VanDerWaalsContact O-CB 3.28Å; A218-K221 WeakPolarHBondContact O-CB 3.32Å; A218-K221 PolarHBondContact O-N 3.37Å; A218-A225 HydrophobicContact CB-CB 3.99Å; A218-A225 WeakPolarHBondContact O-CB 3.44Å; A218-V284 HydrophobicContact CB-CG1 4.13Å
219I85.9Confident83.6Confident30 Ų3044 Ų4415%0.15426%0.259CS..THydrogen-bonded Turntrans-49.9130.5177.8-68.1174.6000110F216 K221 A225 F227 A230F216-I219 HydrophobicContact CB-CD1 4.47Å; F216-I219 HydrophobicContact CD1-CD1 3.6Å; F216-I219 HydrophobicContact CE1-CD1 4.31Å; F216-I219 HydrophobicContact CG-CD1 4.48Å; F216-I219 WeakPolarHBondContact O-CG1 3.42Å; I219-K221 PolarHBondContact O-N 3.48Å; I219-K221 VanDerWaalsContact O-N 3.16Å; I219-A225 WeakPolarHBondContact CA-O 3.44Å; I219-F227 HydrophobicContact CD1-CB 4.13Å; I219-F227 HydrophobicContact CD1-CD2 4.09Å; I219-A230 HydrophobicContact CD1-CB 4.37Å
220E80.3Confident83.3Confident185 Ų18544 Ų4486%0.86426%0.259SS*.THydrogen-bonded Turntrans66.81.3-178.3-63.7168.9-170.400115.9A218 A225A218-E220 PolarHBondContact O-N 2.88Å; E220-A225 PolarHBondContact N-O 3.3Å; E220-A225 VanDerWaalsContact N-O 3.17Å
221K77.4Confident83.3Confident128 Ų12846 Ų4656%0.55727%0.265SS*.THydrogen-bonded Turntrans-82.9-27.5174.1-61.7-172.1-179.41540113.2G217 A218 I219 V284G217-K221 VanDerWaalsContact O-CE 3.3Å; G217-K221 WeakPolarHBondContact O-CE 3.11Å; G217-K221 PolarHBondContact O-NZ 2.86Å; A218-K221 VanDerWaalsContact O-CB 3.28Å; A218-K221 WeakPolarHBondContact O-CB 3.32Å; A218-K221 PolarHBondContact O-N 3.37Å; I219-K221 PolarHBondContact O-N 3.48Å; I219-K221 VanDerWaalsContact O-N 3.16Å; K221-V284 HydrophobicContact CD-CG1 4.45Å
222T69.9Low83.2Confident73 Ų7347.4 Ų47.445%0.44827%0.272SS..SBendtrans-139149.9179.1-51.70000109.3S224 A225T222-S224 PolarHBondContact O-N 3.42Å; T222-S224 VanDerWaalsContact O-N 3.14Å; T222-A225 PolarHBondContact O-N 3.29Å
223A66.8Low82.8Confident102 Ų10249.8 Ų49.884%0.84329%0.285SS*.THydrogen-bonded Turntrans-57.5-29.1-179.700000113.7
224S67.3Low82.7Confident96 Ų9649.8 Ų49.867%0.67129%0.285SS*.THydrogen-bonded Turntrans-83.6-18.3177.8-45.90000113.7T222 T226 S229T222-S224 PolarHBondContact O-N 3.42Å; T222-S224 VanDerWaalsContact O-N 3.14Å; S224-T226 PolarHBondContact O-N 3.06Å; S224-T226 VanDerWaalsContact O-N 3.14Å; S224-S229 PolarHBondContact O-OG 2.94Å
225A78.6Confident82.6Confident18 Ų1851.7 Ų51.715%0.14929%0.294CS..  trans-88.682.3-175.800000110.4A218 I219 E220 T222A218-A225 HydrophobicContact CB-CB 3.99Å; A218-A225 WeakPolarHBondContact O-CB 3.44Å; I219-A225 WeakPolarHBondContact CA-O 3.44Å; E220-A225 PolarHBondContact N-O 3.3Å; E220-A225 VanDerWaalsContact N-O 3.17Å; T222-A225 PolarHBondContact O-N 3.29Å
226T85.6Confident82.2Confident63 Ų6351.2 Ų51.239%0.38729%0.289SS..  trans-102.7155.9-179.967.30000111.5S224 E228 S229 A230S224-T226 PolarHBondContact O-N 3.06Å; S224-T226 VanDerWaalsContact O-N 3.14Å; T226-E228 PolarHBondContact O-N 3.36Å; T226-S229 PolarHBondContact N-OG 3.15Å; T226-S229 PolarHBondContact O-N 2.91Å; T226-S229 PolarHBondContact O-OG 3.36Å; T226-S229 WeakPolarHBondContact OG1-CB 3.4Å; T226-S229 PolarHBondContact OG1-N 2.79Å; T226-S229 PolarHBondContact OG1-OG 3Å; T226-A230 PolarHBondContact O-N 2.89Å
227F87.3Confident82Confident33 Ų3351.3 Ų51.315%0.14529%0.289CS..Hα-helixtrans-55.2-39.8171.9175.1-96000112.3M1 Q3 F216 I219 R231M1-F227 HydrophobicContact CB-CE2 4.41Å; M1-F227 HydrophobicContact CB-CZ 4.14Å; Q3-F227 HydrophobicContact CG-CD1 3.83Å; Q3-F227 HydrophobicContact CG-CE1 3.55Å; Q3-F227 HydrophobicContact CG-CG 4.42Å; Q3-F227 HydrophobicContact CG-CZ 3.94Å; F216-F227 HydrophobicContact CE1-CD2 4.03Å; F216-F227 AromaticContact CE1-CE2 3.95Å; F216-F227 HydrophobicContact CE1-CE2 3.95Å; I219-F227 HydrophobicContact CD1-CB 4.13Å; I219-F227 HydrophobicContact CD1-CD2 4.09Å; F227-R231 VanDerWaalsContact O-CB 3.27Å; F227-R231 WeakPolarHBondContact O-CB 3.38Å; F227-R231 PolarHBondContact O-N 2.86Å
228E85Confident82Confident77 Ų7751.1 Ų51.136%0.3629%0.288SS..Hα-helixtrans-64.1-45.3178.8-58.8-66.6124.700110.9T226 R231 N232T226-E228 PolarHBondContact O-N 3.36Å; E228-R231 PolarHBondContact O-N 3.41Å; E228-R231 IonicContact OE1-CZ 3.82Å; E228-R231 IonicContact OE1-NH1 2.94Å; E228-R231 PolarHBondContact OE1-NH1 2.99Å; E228-R231 IonicContact OE2-CZ 3.03Å; E228-R231 IonicContact OE2-NH1 2.78Å; E228-R231 PolarHBondContact OE2-NH1 3.21Å; E228-R231 IonicContact OE2-NH2 2.61Å; E228-R231 PolarHBondContact OE2-NH2 2.86Å; E228-N232 WeakPolarHBondContact O-CB 3.27Å; E228-N232 VanDerWaalsContact O-CG 3.23Å; E228-N232 PolarHBondContact O-N 3.47Å; E228-N232 PolarHBondContact O-OD1 3.05Å
229S80.3Confident81.8Confident48 Ų4852.4 Ų52.434%0.33629%0.293SS..Hα-helixtrans-61.9-46176.965.60000112.9S224 T226 R231 N232 L233S224-S229 PolarHBondContact O-OG 2.94Å; T226-S229 PolarHBondContact N-OG 3.15Å; T226-S229 PolarHBondContact O-N 2.91Å; T226-S229 PolarHBondContact O-OG 3.36Å; T226-S229 WeakPolarHBondContact OG1-CB 3.4Å; T226-S229 PolarHBondContact OG1-N 2.79Å; T226-S229 PolarHBondContact OG1-OG 3Å; S229-R231 PolarHBondContact O-N 2.9Å; S229-N232 PolarHBondContact O-N 3.49Å; S229-L233 WeakPolarHBondContact O-CB 3.48Å; S229-L233 PolarHBondContact O-N 3.4Å
230A85.6Confident81.6Confident1 Ų151 Ų511%0.00829%0.285CS..Hα-helixtrans-64.1-34.2176.900000111.6G215 F216 I219 T226 A234G215-A230 VanDerWaalsContact C-CB 3.48Å; F216-A230 HydrophobicContact CD1-CB 3.75Å; F216-A230 HydrophobicContact CD2-CB 4.31Å; F216-A230 HydrophobicContact CE1-CB 3.73Å; F216-A230 HydrophobicContact CE2-CB 4.3Å; F216-A230 HydrophobicContact CG-CB 4.03Å; F216-A230 HydrophobicContact CZ-CB 3.99Å; I219-A230 HydrophobicContact CD1-CB 4.37Å; T226-A230 PolarHBondContact O-N 2.89Å; A230-A234 PolarHBondContact O-N 2.88Å
231R88.7Confident81.9Confident68 Ų6842.1 Ų42.126%0.25724%0.244SC..Hα-helixtrans-70.5-47.5177.6-174.1-165.670.1-143.1-6.6112.1M1 F216 F227 E228 S229 L233 A234 I235M1-R231 HydrophobicContact CB-CG 4.3Å; M1-R231 HydrophobicContact CE-CB 4.08Å; M1-R231 HydrophobicContact CE-CG 3.65Å; M1-R231 WeakPolarHBondContact CE-O 3.28Å; M1-R231 HydrophobicContact SD-CG 4.25Å; F216-R231 HydrophobicContact CZ-CB 4.45Å; F227-R231 VanDerWaalsContact O-CB 3.27Å; F227-R231 WeakPolarHBondContact O-CB 3.38Å; F227-R231 PolarHBondContact O-N 2.86Å; E228-R231 PolarHBondContact O-N 3.41Å; E228-R231 IonicContact OE1-CZ 3.82Å; E228-R231 IonicContact OE1-NH1 2.94Å; E228-R231 PolarHBondContact OE1-NH1 2.99Å; E228-R231 IonicContact OE2-CZ 3.03Å; E228-R231 IonicContact OE2-NH1 2.78Å; E228-R231 PolarHBondContact OE2-NH1 3.21Å; E228-R231 IonicContact OE2-NH2 2.61Å; E228-R231 PolarHBondContact OE2-NH2 2.86Å; S229-R231 PolarHBondContact O-N 2.9Å; R231-L233 VanDerWaalsContact C-N 3.29Å; R231-L233 PolarHBondContact O-N 2.67Å; R231-A234 PolarHBondContact O-N 3.3Å; R231-I235 HydrophobicContact CG-CD1 4Å; R231-I235 WeakPolarHBondContact O-CG1 3.34Å; R231-I235 PolarHBondContact O-N 3.21Å
232N83.9Confident82.3Confident33 Ų3339.2 Ų39.218%0.17623%0.232CC..Hα-helixtrans-61.9-40.9179.2-67.50000110.5E228 S229 A234 I235 G236 L341 G342E228-N232 WeakPolarHBondContact O-CB 3.27Å; E228-N232 VanDerWaalsContact O-CG 3.23Å; E228-N232 PolarHBondContact O-N 3.47Å; E228-N232 PolarHBondContact O-OD1 3.05Å; S229-N232 PolarHBondContact O-N 3.49Å; N232-A234 PolarHBondContact O-N 3.04Å; N232-I235 PolarHBondContact O-N 3.31Å; N232-G236 PolarHBondContact O-N 2.88Å; N232-L341 PolarHBondContact ND2-O 2.95Å; N232-G342 PolarHBondContact ND2-OXT 3.38Å
233L82.7Confident82.6Confident51 Ų5136.2 Ų36.227%0.26721%0.213SC..Hα-helixtrans-56-51173.4178.163.4000112.6A211 S229 R231 I235 G236 I237A211-L233 HydrophobicContact CB-CD2 4.24Å; S229-L233 WeakPolarHBondContact O-CB 3.48Å; S229-L233 PolarHBondContact O-N 3.4Å; R231-L233 VanDerWaalsContact C-N 3.29Å; R231-L233 PolarHBondContact O-N 2.67Å; L233-I235 VanDerWaalsContact C-N 3.3Å; L233-I235 PolarHBondContact O-N 2.88Å; L233-G236 PolarHBondContact O-N 2.88Å; L233-I237 HydrophobicContact CD1-CD1 3.95Å; L233-I237 HydrophobicContact CD1-CG1 4.42Å; L233-I237 HydrophobicContact CG-CD1 4.04Å; L233-I237 WeakPolarHBondContact O-CG1 3.34Å; L233-I237 PolarHBondContact O-N 2.94Å
234A89.8Confident83.4Confident0 Ų031.4 Ų31.40%017%0.173CC..Hα-helixtrans-68-29.1179.300000113.2M1 T18 V212 F216 A230 R231 N232 G238M1-A234 HydrophobicContact CE-CB 3.26Å; T18-A234 HydrophobicContact CG2-CB 4.38Å; T18-A234 VanDerWaalsContact CG2-O 3.3Å; T18-A234 WeakPolarHBondContact CG2-O 3.25Å; V212-A234 HydrophobicContact CB-CB 4.46Å; V212-A234 HydrophobicContact CG1-CB 3.79Å; V212-A234 HydrophobicContact CG2-CB 3.84Å; F216-A234 HydrophobicContact CE2-CB 4.31Å; A230-A234 PolarHBondContact O-N 2.88Å; R231-A234 PolarHBondContact O-N 3.3Å; N232-A234 PolarHBondContact O-N 3.04Å; A234-G238 PolarHBondContact O-N 2.94Å
235I86.6Confident84.4Confident48 Ų4826.8 Ų26.825%0.24614%0.141CC..Hα-helixtrans-67.6-46.4172.3-70169.7000110.4R231 N232 L233 G238 I239 L341R231-I235 HydrophobicContact CG-CD1 4Å; R231-I235 WeakPolarHBondContact O-CG1 3.34Å; R231-I235 PolarHBondContact O-N 3.21Å; N232-I235 PolarHBondContact O-N 3.31Å; L233-I235 VanDerWaalsContact C-N 3.3Å; L233-I235 PolarHBondContact O-N 2.88Å; I235-G238 PolarHBondContact O-N 3.15Å; I235-I239 HydrophobicContact CG2-CD1 3.82Å; I235-I239 WeakPolarHBondContact O-CG1 3.42Å; I235-I239 PolarHBondContact O-N 3.06Å; I235-L341 HydrophobicContact CG2-CD1 4.29Å
236G80.4Confident84.6Confident8 Ų826.4 Ų26.48%0.08214%0.137CC..Hα-helixtrans-56.6-50.417700000111.9N232 L233 I239 Q240N232-G236 PolarHBondContact O-N 2.88Å; L233-G236 PolarHBondContact O-N 2.88Å; G236-I239 PolarHBondContact O-N 3.39Å; G236-Q240 PolarHBondContact O-N 3.09Å
237I85.9Confident84.2Confident1 Ų123.5 Ų23.51%0.00512%0.119CC..Hα-helixtrans-59-49.5174.5-68.2169000110.6T18 E208 V212 L233 I239 Q240 N241T18-I237 HydrophobicContact CG2-CB 4.07Å; T18-I237 HydrophobicContact CG2-CG2 3.71Å; E208-I237 HydrophobicContact CB-CD1 4.29Å; E208-I237 HydrophobicContact CB-CG2 3.97Å; E208-I237 HydrophobicContact CG-CG2 4.23Å; E208-I237 WeakPolarHBondContact OE2-CG2 3.48Å; V212-I237 HydrophobicContact CG2-CD1 3.61Å; L233-I237 HydrophobicContact CD1-CD1 3.95Å; L233-I237 HydrophobicContact CD1-CG1 4.42Å; L233-I237 HydrophobicContact CG-CD1 4.04Å; L233-I237 WeakPolarHBondContact O-CG1 3.34Å; L233-I237 PolarHBondContact O-N 2.94Å; I237-I239 PolarHBondContact O-N 3.34Å; I237-I239 VanDerWaalsContact O-N 3.11Å; I237-Q240 WeakPolarHBondContact O-CG 3.42Å; I237-Q240 PolarHBondContact O-N 3.34Å; I237-N241 VanDerWaalsContact O-CG 3.24Å; I237-N241 PolarHBondContact O-N 2.88Å; I237-N241 VanDerWaalsContact O-N 3.08Å; I237-N241 PolarHBondContact O-OD1 3.35Å
238G88.5Confident84.1Confident0 Ų022 Ų220%011%0.112CC..Hα-helixtrans-58.6-33.2-178.900000113.6M21 A234 I235 N241M21-G238 WeakPolarHBondContact CB-O 3.4Å; M21-G238 WeakPolarHBondContact CE-O 3.19Å; M21-G238 VanDerWaalsContact CG-O 3.27Å; M21-G238 WeakPolarHBondContact CG-O 3.44Å; A234-G238 PolarHBondContact O-N 2.94Å; I235-G238 PolarHBondContact O-N 3.15Å; G238-N241 PolarHBondContact O-N 3.32Å
239I81.2Confident84.2Confident37 Ų3718.3 Ų18.319%0.1910%0.095CC..Hα-helixtrans-66.6-44.3179-74.6164.9000112.1I235 G236 I237 N241 P243 M334 L337 L341I235-I239 HydrophobicContact CG2-CD1 3.82Å; I235-I239 WeakPolarHBondContact O-CG1 3.42Å; I235-I239 PolarHBondContact O-N 3.06Å; G236-I239 PolarHBondContact O-N 3.39Å; I237-I239 PolarHBondContact O-N 3.34Å; I237-I239 VanDerWaalsContact O-N 3.11Å; I239-N241 VanDerWaalsContact C-N 3.35Å; I239-P243 WeakPolarHBondContact O-CD 3.3Å; I239-M334 HydrophobicContact CG2-SD 3.95Å; I239-L337 HydrophobicContact CD1-CB 4.11Å; I239-L337 HydrophobicContact CD1-CD1 4.12Å; I239-L337 HydrophobicContact CD1-CD2 4.24Å; I239-L337 HydrophobicContact CD1-CG 4.37Å; I239-L337 HydrophobicContact CG2-CD1 3.48Å; I239-L337 VanDerWaalsContact CG2-CD1 3.48Å; I239-L341 HydrophobicContact CD1-CD1 4.06Å
240Q81.3Confident84.3Confident0 Ų016.5 Ų16.50%08%0.082CC..Hα-helixtrans-73.7-26.9178.257156.796.600112.7V50 A54 E208 G236 I237 F242 P243 E244 M334V50-Q240 HydrophobicContact CG1-CB 3.79Å; A54-Q240 HydrophobicContact CB-CB 3.93Å; A54-Q240 HydrophobicContact CB-CG 4.16Å; E208-Q240 PolarHBondContact OE1-NE2 2.99Å; G236-Q240 PolarHBondContact O-N 3.09Å; I237-Q240 WeakPolarHBondContact O-CG 3.42Å; I237-Q240 PolarHBondContact O-N 3.34Å; Q240-F242 PolarHBondContact O-N 3.48Å; Q240-P243 WeakPolarHBondContact O-CD 3.4Å; Q240-E244 PolarHBondContact NE2-OE1 2.83Å; Q240-E244 PolarHBondContact O-N 3.19Å; Q240-M334 HydrophobicContact CB-CE 4.33Å; Q240-M334 HydrophobicContact CB-SD 4.18Å
241N87.9Confident83.8Confident0 Ų018 Ų180%09%0.091CC..Hα-helixtrans-67.4-24.9-179.3-74.326.9000111.8M21 T22 E208 I237 G238 I239 E244 G245 E273M21-N241 HydrophobicContact CB-CB 4.46Å; T22-N241 WeakPolarHBondContact CA-O 3.27Å; T22-N241 WeakPolarHBondContact OG1-CB 3.37Å; E208-N241 PolarHBondContact OE2-ND2 2.8Å; E208-N241 PolarHBondContact OE2-OD1 3.08Å; E208-N241 VanDerWaalsContact OE2-OD1 3.11Å; I237-N241 VanDerWaalsContact O-CG 3.24Å; I237-N241 PolarHBondContact O-N 2.88Å; I237-N241 VanDerWaalsContact O-N 3.08Å; I237-N241 PolarHBondContact O-OD1 3.35Å; G238-N241 PolarHBondContact O-N 3.32Å; I239-N241 VanDerWaalsContact C-N 3.35Å; N241-E244 PolarHBondContact O-N 2.97Å; N241-G245 PolarHBondContact O-N 3.18Å; N241-E273 PolarHBondContact ND2-OE1 3.27Å; N241-E273 PolarHBondContact ND2-OE2 3.14Å
242F84.7Confident83.5Confident67 Ų6714.7 Ų14.729%0.2948%0.079SC..Hα-helixtrans-62.7-54.5173.9-177.5-77.4000112.7M21 A24 G25 L28 Q240 E244 G245 L246M21-F242 HydrophobicContact CB-CB 4.43Å; M21-F242 HydrophobicContact CE-CB 4.03Å; M21-F242 HydrophobicContact CE-CD2 4.31Å; M21-F242 WeakPolarHBondContact O-CA 3.47Å; A24-F242 HydrophobicContact CB-CD2 3.87Å; A24-F242 HydrophobicContact CB-CE2 3.85Å; G25-F242 WeakPolarHBondContact CA-O 3.35Å; L28-F242 HydrophobicContact CD1-CE1 3.41Å; L28-F242 VanDerWaalsContact CD1-CE1 3.41Å; L28-F242 HydrophobicContact CD1-CZ 3.4Å; L28-F242 VanDerWaalsContact CD1-CZ 3.4Å; L28-F242 HydrophobicContact CD2-CZ 4.36Å; L28-F242 HydrophobicContact CG-CE1 4.34Å; L28-F242 HydrophobicContact CG-CZ 3.88Å; Q240-F242 PolarHBondContact O-N 3.48Å; F242-E244 PolarHBondContact O-N 2.94Å; F242-G245 PolarHBondContact O-N 2.7Å; F242-L246 PolarHBondContact O-N 2.86Å
243P77.1Confident83.4Confident9 Ų916.8 Ų16.86%0.0588%0.084CC..Hα-helixtrans-54.4-35.1169.9-30.234.1000115.1F46 A47 V50 I239 Q240 L246 A247F46-P243 HydrophobicContact CE1-CG 4.26Å; A47-P243 HydrophobicContact CB-CB 3.8Å; V50-P243 HydrophobicContact CB-CG 4.17Å; V50-P243 HydrophobicContact CG1-CG 3.98Å; V50-P243 HydrophobicContact CG2-CG 4.12Å; I239-P243 WeakPolarHBondContact O-CD 3.3Å; Q240-P243 WeakPolarHBondContact O-CD 3.4Å; P243-L246 PolarHBondContact O-N 3.17Å; P243-A247 WeakPolarHBondContact O-CB 3.27Å; P243-A247 PolarHBondContact O-N 3.42Å
244E82.7Confident83Confident1 Ų117 Ų171%0.00510%0.098CC..Hα-helixtrans-66.7-44-179.8-69.9177.3-152.500113.3M51 N205 Q240 N241 F242 L246 A247 V248 M302M51-E244 HydrophobicContact CE-CG 4.42Å; M51-E244 HydrophobicContact CG-CG 4.33Å; M51-E244 HydrophobicContact SD-CG 4.26Å; N205-E244 PolarHBondContact OD1-OE2 3.14Å; Q240-E244 PolarHBondContact NE2-OE1 2.83Å; Q240-E244 PolarHBondContact O-N 3.19Å; N241-E244 PolarHBondContact O-N 2.97Å; F242-E244 PolarHBondContact O-N 2.94Å; E244-L246 PolarHBondContact O-N 3.47Å; E244-A247 WeakPolarHBondContact O-CA 3.4Å; E244-A247 WeakPolarHBondContact O-CB 3.27Å; E244-A247 PolarHBondContact O-N 2.92Å; E244-V248 PolarHBondContact O-N 3.49Å; E244-M302 WeakPolarHBondContact OE1-CE 3.34Å
245G88.1Confident82.3Confident0 Ų019.5 Ų19.50%012%0.119CC..Hα-helixtrans-58.6-36.7176.200000112.4T22 A26 N241 F242 S249T22-G245 WeakPolarHBondContact O-CA 3.4Å; A26-G245 VanDerWaalsContact CA-O 3.32Å; A26-G245 WeakPolarHBondContact CA-O 3.42Å; N241-G245 PolarHBondContact O-N 3.18Å; F242-G245 PolarHBondContact O-N 2.7Å; G245-S249 WeakPolarHBondContact O-CB 3.25Å; G245-S249 PolarHBondContact O-N 2.86Å; G245-S249 VanDerWaalsContact O-N 3.14Å; G245-S249 PolarHBondContact O-OG 2.72Å
246L83.1Confident81.9Confident10 Ų1020.1 Ų20.15%0.05214%0.137CC..Hα-helixtrans-70-40.8173.3176.5143.8000112.1L28 F242 P243 E244 V248 S249 L250L28-L246 HydrophobicContact CB-CD1 3.93Å; L28-L246 HydrophobicContact CD1-CD1 3.57Å; L28-L246 HydrophobicContact CG-CD1 4.42Å; F242-L246 PolarHBondContact O-N 2.86Å; P243-L246 PolarHBondContact O-N 3.17Å; E244-L246 PolarHBondContact O-N 3.47Å; L246-V248 PolarHBondContact O-N 3.34Å; L246-S249 PolarHBondContact O-N 3.11Å; L246-L250 HydrophobicContact CD1-CD1 3.96Å; L246-L250 HydrophobicContact CD2-CD1 3.44Å; L246-L250 VanDerWaalsContact CD2-CD1 3.44Å; L246-L250 HydrophobicContact CD2-CG 4.28Å; L246-L250 HydrophobicContact CG-CD1 3.5Å; L246-L250 VanDerWaalsContact CG-CD1 3.5Å; L246-L250 HydrophobicContact CG-CG 3.95Å; L246-L250 WeakPolarHBondContact O-CB 3.13Å; L246-L250 PolarHBondContact O-N 2.94Å
247A76.9Confident82Confident1 Ų120.4 Ų20.41%0.00814%0.136CC..Hα-helixtrans-61.8-30178.200000112.3L197 P243 E244 P251 I310L197-A247 WeakPolarHBondContact CD2-O 3.34Å; P243-A247 WeakPolarHBondContact O-CB 3.27Å; P243-A247 PolarHBondContact O-N 3.42Å; E244-A247 WeakPolarHBondContact O-CA 3.4Å; E244-A247 WeakPolarHBondContact O-CB 3.27Å; E244-A247 PolarHBondContact O-N 2.92Å; A247-P251 WeakPolarHBondContact O-CD 3.45Å; A247-P251 WeakPolarHBondContact O-CG 3.22Å; A247-I310 HydrophobicContact CB-CD1 4.47Å
248V85.2Confident82.2Confident1 Ų122.9 Ų22.91%0.00615%0.154CC..Hα-helixtrans-80-47.2172.7177.50000112.4I198 I201 E244 L246 L252I198-V248 HydrophobicContact CD1-CG1 4.41Å; I198-V248 HydrophobicContact CG1-CG1 3.64Å; I201-V248 HydrophobicContact CB-CG2 4.37Å; I201-V248 HydrophobicContact CD1-CG2 3.37Å; I201-V248 HydrophobicContact CG1-CG2 4.44Å; I201-V248 HydrophobicContact CG2-CG2 4.21Å; E244-V248 PolarHBondContact O-N 3.49Å; L246-V248 PolarHBondContact O-N 3.34Å; V248-L252 HydrophobicContact CG1-CD1 4.02Å; V248-L252 WeakPolarHBondContact O-CD1 3.22Å
249S88.5Confident82.3Confident0 Ų024.5 Ų24.50%016%0.163CC..Hα-helixtrans-74.2-33.7-169.471.50000113.2A26 G245 L246 R253 A262A26-S249 PolarHBondContact O-OG 3Å; G245-S249 WeakPolarHBondContact O-CB 3.25Å; G245-S249 PolarHBondContact O-N 2.86Å; G245-S249 VanDerWaalsContact O-N 3.14Å; G245-S249 PolarHBondContact O-OG 2.72Å; L246-S249 PolarHBondContact O-N 3.11Å; S249-R253 WeakPolarHBondContact O-CB 3.46Å; S249-R253 PolarHBondContact O-N 3.48Å; S249-A262 WeakPolarHBondContact CB-O 3.39Å; S249-A262 WeakPolarHBondContact O-CB 3.3Å
250L81.7Confident82.9Confident11 Ų1129.6 Ų29.66%0.05818%0.18CC..Hα-helixtrans-69.6-45.8-177.9-73.1-179000113.9V29 L40 L246 L252 R253 G254V29-L250 HydrophobicContact CG2-CD2 4.36Å; L40-L250 HydrophobicContact CD1-CB 3.67Å; L40-L250 HydrophobicContact CD1-CD1 3.57Å; L40-L250 HydrophobicContact CD1-CG 4.14Å; L246-L250 HydrophobicContact CD1-CD1 3.96Å; L246-L250 HydrophobicContact CD2-CD1 3.44Å; L246-L250 VanDerWaalsContact CD2-CD1 3.44Å; L246-L250 HydrophobicContact CD2-CG 4.28Å; L246-L250 HydrophobicContact CG-CD1 3.5Å; L246-L250 VanDerWaalsContact CG-CD1 3.5Å; L246-L250 HydrophobicContact CG-CG 3.95Å; L246-L250 WeakPolarHBondContact O-CB 3.13Å; L246-L250 PolarHBondContact O-N 2.94Å; L250-L252 VanDerWaalsContact C-N 3.32Å; L250-L252 PolarHBondContact O-N 3.26Å; L250-R253 WeakPolarHBondContact O-CB 3.44Å; L250-R253 PolarHBondContact O-N 2.88Å; L250-R253 VanDerWaalsContact O-N 3.16Å; L250-G254 PolarHBondContact O-N 3.25Å
251P74.4Confident83.4Confident31 Ų3135.6 Ų35.620%0.20120%0.203CC..Hα-helixtrans-60.1-39.9174-27.237.5000112.8I194 L197 A247 R253 G254 A255I194-P251 HydrophobicContact CG1-CB 4.19Å; L197-P251 HydrophobicContact CD2-CG 4.07Å; A247-P251 WeakPolarHBondContact O-CD 3.45Å; A247-P251 WeakPolarHBondContact O-CG 3.22Å; P251-R253 VanDerWaalsContact C-N 3.32Å; P251-R253 PolarHBondContact O-N 3.24Å; P251-G254 CarbonylContact O-C 3.6Å; P251-G254 PolarHBondContact O-N 3.21Å; P251-A255 WeakPolarHBondContact O-CB 3.48Å; P251-A255 PolarHBondContact O-N 3.25Å
252L82Confident83.5Confident0 Ų035.6 Ų35.60%020%0.203CC..Hα-helixtrans-59-44.5173.3-79.2166000111.7W191 I194 I198 V248 L250 G254 A255 G256 F257 A262 Y265W191-L252 HydrophobicContact CZ3-CD2 4.13Å; I194-L252 HydrophobicContact CG2-CD2 3.44Å; I194-L252 VanDerWaalsContact CG2-CD2 3.44Å; I194-L252 HydrophobicContact CG2-CG 3.74Å; I198-L252 HydrophobicContact CD1-CD1 4.14Å; I198-L252 HydrophobicContact CD1-CD2 4.39Å; V248-L252 HydrophobicContact CG1-CD1 4.02Å; V248-L252 WeakPolarHBondContact O-CD1 3.22Å; L250-L252 VanDerWaalsContact C-N 3.32Å; L250-L252 PolarHBondContact O-N 3.26Å; L252-G254 VanDerWaalsContact C-N 3.35Å; L252-A255 PolarHBondContact O-N 3.33Å; L252-G256 PolarHBondContact O-N 3.48Å; L252-F257 HydrophobicContact CD2-CD1 4.39Å; L252-F257 HydrophobicContact CD2-CD2 4.05Å; L252-F257 HydrophobicContact CD2-CE1 4.49Å; L252-F257 HydrophobicContact CD2-CE2 4.17Å; L252-F257 HydrophobicContact CD2-CG 4.19Å; L252-F257 HydrophobicContact CD2-CZ 4.39Å; L252-F257 VanDerWaalsContact O-CB 3.3Å; L252-F257 WeakPolarHBondContact O-CB 3.46Å; L252-F257 WeakPolarHBondContact O-CD2 3.49Å; L252-F257 PolarHBondContact O-N 2.9Å; L252-F257 VanDerWaalsContact O-N 3.1Å; L252-A262 HydrophobicContact CB-CB 3.9Å; L252-Y265 HydrophobicContact CD1-CD2 4.16Å; L252-Y265 HydrophobicContact CD1-CG 4.09Å; L252-Y265 HydrophobicContact CD2-CD2 4.45Å
253R82.4Confident83.9Confident77 Ų7734 Ų3429%0.29120%0.196SC..Hα-helixtrans-64.7-40.1176.1-172.857.8171.9156.92.6111.9V29 S249 L250 P251 A255 G256 F257 T259 A262V29-R253 HydrophobicContact CG2-CB 3.64Å; V29-R253 HydrophobicContact CG2-CG 3.76Å; S249-R253 WeakPolarHBondContact O-CB 3.46Å; S249-R253 PolarHBondContact O-N 3.48Å; L250-R253 WeakPolarHBondContact O-CB 3.44Å; L250-R253 PolarHBondContact O-N 2.88Å; L250-R253 VanDerWaalsContact O-N 3.16Å; P251-R253 VanDerWaalsContact C-N 3.32Å; P251-R253 PolarHBondContact O-N 3.24Å; R253-A255 VanDerWaalsContact C-N 3.3Å; R253-A255 PolarHBondContact O-N 2.92Å; R253-G256 PolarHBondContact O-N 3.43Å; R253-F257 WeakPolarHBondContact CD-O 3.38Å; R253-F257 PolarHBondContact NH1-O 3.09Å; R253-T259 PolarHBondContact NE-OG1 3.34Å; R253-T259 PolarHBondContact NH2-OG1 2.92Å; R253-T259 VanDerWaalsContact NH2-OG1 3.12Å; R253-A262 HydrophobicContact CB-CB 4.22Å
254G73.9Confident84.8Confident55 Ų5539 Ų3957%0.56721%0.214SC*.Hα-helixtrans-64.2-32.4174.900000113.4L250 P251 L252 G256L250-G254 PolarHBondContact O-N 3.25Å; P251-G254 CarbonylContact O-C 3.6Å; P251-G254 PolarHBondContact O-N 3.21Å; L252-G254 VanDerWaalsContact C-N 3.35Å; G254-G256 PolarHBondContact O-N 2.92Å
255A74.8Confident85.1Confident52 Ų5243.2 Ų43.243%0.4323%0.23SC..THydrogen-bonded Turntrans-783.6174.500000114.2I194 P251 L252 R253 F257I194-A255 HydrophobicContact CD1-CB 3.47Å; I194-A255 VanDerWaalsContact CD1-CB 3.47Å; P251-A255 WeakPolarHBondContact O-CB 3.48Å; P251-A255 PolarHBondContact O-N 3.25Å; L252-A255 PolarHBondContact O-N 3.33Å; R253-A255 VanDerWaalsContact C-N 3.3Å; R253-A255 PolarHBondContact O-N 2.92Å; A255-F257 HydrophobicContact CB-CD2 4.22Å; A255-F257 HydrophobicContact CB-CE2 4.43Å
256G78.3Confident85.3Confident61 Ų6143.2 Ų43.263%0.62923%0.23SC*.THydrogen-bonded Turntrans93.16.417500000115L252 R253 G254L252-G256 PolarHBondContact O-N 3.48Å; R253-G256 PolarHBondContact O-N 3.43Å; G254-G256 PolarHBondContact O-N 2.92Å
257F83.8Confident85.8Confident14 Ų1443.2 Ų43.26%0.06123%0.23CC..  trans-66.4149.8172.2-72.2-109.7000110.9W191 L252 R253 A255 R261 Y265W191-F257 HydrophobicContact CE3-CE2 4.25Å; W191-F257 HydrophobicContact CE3-CZ 4.03Å; W191-F257 HydrophobicContact CH2-CZ 4.39Å; W191-F257 HydrophobicContact CZ3-CE1 4.4Å; W191-F257 HydrophobicContact CZ3-CE2 4.11Å; W191-F257 AromaticContact CZ3-CZ 3.61Å; W191-F257 HydrophobicContact CZ3-CZ 3.61Å; L252-F257 HydrophobicContact CD2-CD1 4.39Å; L252-F257 HydrophobicContact CD2-CD2 4.05Å; L252-F257 HydrophobicContact CD2-CE1 4.49Å; L252-F257 HydrophobicContact CD2-CE2 4.17Å; L252-F257 HydrophobicContact CD2-CG 4.19Å; L252-F257 HydrophobicContact CD2-CZ 4.39Å; L252-F257 VanDerWaalsContact O-CB 3.3Å; L252-F257 WeakPolarHBondContact O-CB 3.46Å; L252-F257 WeakPolarHBondContact O-CD2 3.49Å; L252-F257 PolarHBondContact O-N 2.9Å; L252-F257 VanDerWaalsContact O-N 3.1Å; R253-F257 WeakPolarHBondContact CD-O 3.38Å; R253-F257 PolarHBondContact NH1-O 3.09Å; A255-F257 HydrophobicContact CB-CD2 4.22Å; A255-F257 HydrophobicContact CB-CE2 4.43Å; F257-R261 HydrophobicContact CB-CB 4.31Å; F257-R261 HydrophobicContact CD1-CB 4.14Å; F257-Y265 HydrophobicContact CE1-CE2 4.38Å
258S90.5Very high86.6Confident54 Ų5446.5 Ų46.538%0.37825%0.247SC..  trans-62.7149.2172.867.10000110.4W260 R261 A262S258-W260 PolarHBondContact O-N 3.32Å; S258-W260 VanDerWaalsContact O-N 3.13Å; S258-R261 PolarHBondContact O-N 3.5Å; S258-R261 WeakPolarHBondContact OG-CG 3.49Å; S258-R261 PolarHBondContact OG-N 2.88Å; S258-A262 PolarHBondContact O-N 2.94Å
259T90Very high86.8Confident33 Ų3346.5 Ų46.520%0.20225%0.247CC..Hα-helixtrans-51-39.7178.8-44.30000111.9V29 F30 R253 A262 F263V29-T259 HydrophobicContact CB-CG2 4.48Å; V29-T259 HydrophobicContact CG1-CG2 3.8Å; V29-T259 HydrophobicContact CG2-CG2 4.3Å; V29-T259 WeakPolarHBondContact O-CG2 3.47Å; F30-T259 HydrophobicContact CB-CG2 4.46Å; F30-T259 HydrophobicContact CD1-CG2 3.29Å; F30-T259 HydrophobicContact CE1-CG2 3.45Å; F30-T259 VanDerWaalsContact CE1-CG2 3.45Å; F30-T259 HydrophobicContact CG-CG2 3.91Å; F30-T259 HydrophobicContact CZ-CG2 4.16Å; R253-T259 PolarHBondContact NE-OG1 3.34Å; R253-T259 PolarHBondContact NH2-OG1 2.92Å; R253-T259 VanDerWaalsContact NH2-OG1 3.12Å; T259-A262 PolarHBondContact O-N 3.33Å; T259-F263 WeakPolarHBondContact O-CB 3.45Å; T259-F263 PolarHBondContact O-N 2.86Å
260W93.4Very high87Confident145 Ų14546.5 Ų46.555%0.54925%0.247SC..Hα-helixtrans-66.5-43178-161.4-123.7000112.8F30 S258 F263 W264F30-W260 AromaticContact CE1-CE3 3.89Å; F30-W260 HydrophobicContact CE1-CE3 3.89Å; F30-W260 HydrophobicContact CE1-CZ3 4.34Å; F30-W260 HydrophobicContact CE2-CZ3 4.41Å; F30-W260 AromaticContact CZ-CE3 3.44Å; F30-W260 HydrophobicContact CZ-CE3 3.44Å; F30-W260 VanDerWaalsContact CZ-CE3 3.44Å; F30-W260 AromaticContact CZ-CZ3 3.67Å; F30-W260 HydrophobicContact CZ-CZ3 3.67Å; S258-W260 PolarHBondContact O-N 3.32Å; S258-W260 VanDerWaalsContact O-N 3.13Å; W260-F263 HydrophobicContact CE3-CD1 4.1Å; W260-F263 HydrophobicContact CH2-CD1 4.1Å; W260-F263 HydrophobicContact CH2-CE1 4.01Å; W260-F263 AromaticContact CZ3-CD1 3.77Å; W260-F263 HydrophobicContact CZ3-CD1 3.77Å; W260-F263 HydrophobicContact CZ3-CE1 4.03Å; W260-F263 PolarHBondContact O-N 3.03Å; W260-W264 AromaticContact CD1-CD1 3.56Å; W260-W264 AromaticContact CD1-NE1 3.47Å; W260-W264 AromaticContact CD2-NE1 3.87Å; W260-W264 AromaticContact CE2-CD1 3.76Å; W260-W264 AromaticContact CE2-NE1 3.08Å; W260-W264 AromaticContact CG-CD1 3.94Å; W260-W264 AromaticContact CZ2-CE2 3.98Å; W260-W264 HydrophobicContact CZ2-CZ2 4.09Å; W260-W264 AromaticContact CZ2-NE1 3.44Å; W260-W264 AromaticContact NE1-CD1 3.5Å; W260-W264 AromaticContact NE1-NE1 2.89Å; W260-W264 WeakPolarHBondContact O-CB 3.35Å; W260-W264 PolarHBondContact O-N 3.27Å
261R91.3Very high87.5Confident126 Ų12650.4 Ų50.448%0.47527%0.266SS..Hα-helixtrans-65.5-43.7176.3-75.1178.9-177.7173.40.6111.3F257 S258 F263 W264 Y265F257-R261 HydrophobicContact CB-CB 4.31Å; F257-R261 HydrophobicContact CD1-CB 4.14Å; S258-R261 PolarHBondContact O-N 3.5Å; S258-R261 WeakPolarHBondContact OG-CG 3.49Å; S258-R261 PolarHBondContact OG-N 2.88Å; R261-F263 VanDerWaalsContact C-N 3.34Å; R261-F263 PolarHBondContact O-N 3.4Å; R261-W264 PolarHBondContact O-N 2.78Å; R261-Y265 WeakPolarHBondContact O-CD2 3.34Å; R261-Y265 PolarHBondContact O-N 2.92Å
262A90.4Very high88.4Confident0 Ų050.6 Ų50.60%027%0.267CS..Hα-helixtrans-58.8-45.3176.700000112V29 S249 L252 R253 S258 T259 G266V29-A262 HydrophobicContact CG2-CB 4.14Å; S249-A262 WeakPolarHBondContact CB-O 3.39Å; S249-A262 WeakPolarHBondContact O-CB 3.3Å; L252-A262 HydrophobicContact CB-CB 3.9Å; R253-A262 HydrophobicContact CB-CB 4.22Å; S258-A262 PolarHBondContact O-N 2.94Å; T259-A262 PolarHBondContact O-N 3.33Å; A262-G266 PolarHBondContact O-N 3.25Å
263F94.3Very high89Confident34 Ų3450.6 Ų50.615%0.14927%0.267CS..Hα-helixtrans-60.8-46.9173169.2-108.9000112.5A26 A27 V29 F30 T259 W260 R261 Y265 G266 Q267A26-F263 HydrophobicContact CB-CD2 3.99Å; A26-F263 HydrophobicContact CB-CE2 4.42Å; A27-F263 HydrophobicContact CB-CD2 4.13Å; A27-F263 HydrophobicContact CB-CE2 3.95Å; V29-F263 HydrophobicContact CG1-CB 4.09Å; F30-F263 HydrophobicContact CE2-CB 3.71Å; F30-F263 HydrophobicContact CE2-CD1 4.16Å; F30-F263 AromaticContact CE2-CD2 3.88Å; F30-F263 HydrophobicContact CE2-CD2 3.88Å; F30-F263 AromaticContact CE2-CG 3.63Å; F30-F263 HydrophobicContact CE2-CG 3.63Å; F30-F263 HydrophobicContact CZ-CB 3.72Å; F30-F263 HydrophobicContact CZ-CD1 4.19Å; F30-F263 AromaticContact CZ-CG 3.92Å; F30-F263 HydrophobicContact CZ-CG 3.92Å; T259-F263 WeakPolarHBondContact O-CB 3.45Å; T259-F263 PolarHBondContact O-N 2.86Å; W260-F263 HydrophobicContact CE3-CD1 4.1Å; W260-F263 HydrophobicContact CH2-CD1 4.1Å; W260-F263 HydrophobicContact CH2-CE1 4.01Å; W260-F263 AromaticContact CZ3-CD1 3.77Å; W260-F263 HydrophobicContact CZ3-CD1 3.77Å; W260-F263 HydrophobicContact CZ3-CE1 4.03Å; W260-F263 PolarHBondContact O-N 3.03Å; R261-F263 VanDerWaalsContact C-N 3.34Å; R261-F263 PolarHBondContact O-N 3.4Å; F263-Y265 PolarHBondContact O-N 2.91Å; F263-G266 PolarHBondContact O-N 3.11Å; F263-Q267 HydrophobicContact CE1-CG 4.43Å; F263-Q267 HydrophobicContact CE2-CB 4.38Å; F263-Q267 HydrophobicContact CE2-CG 4.48Å; F263-Q267 HydrophobicContact CZ-CG 4.23Å; F263-Q267 PolarHBondContact O-N 3.22Å
264W94.4Very high89.6Confident113 Ų11347.6 Ų47.643%0.42826%0.257SS..Hα-helixtrans-57.9-50.7-179.9-91.4112.4000112.4W260 R261 G266 Q267 L268W260-W264 AromaticContact CD1-CD1 3.56Å; W260-W264 AromaticContact CD1-NE1 3.47Å; W260-W264 AromaticContact CD2-NE1 3.87Å; W260-W264 AromaticContact CE2-CD1 3.76Å; W260-W264 AromaticContact CE2-NE1 3.08Å; W260-W264 AromaticContact CG-CD1 3.94Å; W260-W264 AromaticContact CZ2-CE2 3.98Å; W260-W264 HydrophobicContact CZ2-CZ2 4.09Å; W260-W264 AromaticContact CZ2-NE1 3.44Å; W260-W264 AromaticContact NE1-CD1 3.5Å; W260-W264 AromaticContact NE1-NE1 2.89Å; W260-W264 WeakPolarHBondContact O-CB 3.35Å; W260-W264 PolarHBondContact O-N 3.27Å; R261-W264 PolarHBondContact O-N 2.78Å; W264-G266 VanDerWaalsContact C-N 3.31Å; W264-G266 PolarHBondContact O-N 3.18Å; W264-Q267 HydrophobicContact CE3-CG 4.48Å; W264-Q267 VanDerWaalsContact CZ3-NE2 3.27Å; W264-L268 HydrophobicContact CE3-CD1 4.37Å; W264-L268 HydrophobicContact CE3-CG 4.26Å; W264-L268 WeakPolarHBondContact O-CB 3.44Å; W264-L268 WeakPolarHBondContact O-CG 3.36Å; W264-L268 PolarHBondContact O-N 3.3Å
265Y90.4Very high90.5Very high90 Ų9051.1 Ų51.135%0.35326%0.262SS..Hα-helixtrans-64.5-37.4177.4-75.3-67.8000112.1L252 F257 R261 F263 L268 S269L252-Y265 HydrophobicContact CD1-CD2 4.16Å; L252-Y265 HydrophobicContact CD1-CG 4.09Å; L252-Y265 HydrophobicContact CD2-CD2 4.45Å; F257-Y265 HydrophobicContact CE1-CE2 4.38Å; R261-Y265 WeakPolarHBondContact O-CD2 3.34Å; R261-Y265 PolarHBondContact O-N 2.92Å; F263-Y265 PolarHBondContact O-N 2.91Å; Y265-L268 PolarHBondContact O-N 3.08Å; Y265-S269 PolarHBondContact O-N 3.49Å
266G90.9Very high91.3Very high0 Ų049.1 Ų49.10%025%0.246CC..Hα-helixtrans-66-37.5178.700000114.6A262 F263 W264 S269A262-G266 PolarHBondContact O-N 3.25Å; F263-G266 PolarHBondContact O-N 3.11Å; W264-G266 VanDerWaalsContact C-N 3.31Å; W264-G266 PolarHBondContact O-N 3.18Å; G266-S269 PolarHBondContact O-OG 3.29Å
267Q94.8Very high92Very high9 Ų946.2 Ų46.24%0.04222%0.216CC..Hα-helixtrans-83-31.6176.175.977.729.600112W19 A23 F263 W264 S269 G270 M271W19-Q267 VanDerWaalsContact CE2-OE1 3.3Å; W19-Q267 PolarHBondContact NE1-O 2.87Å; A23-Q267 HydrophobicContact CB-CB 3.82Å; F263-Q267 HydrophobicContact CE1-CG 4.43Å; F263-Q267 HydrophobicContact CE2-CB 4.38Å; F263-Q267 HydrophobicContact CE2-CG 4.48Å; F263-Q267 HydrophobicContact CZ-CG 4.23Å; F263-Q267 PolarHBondContact O-N 3.22Å; W264-Q267 HydrophobicContact CE3-CG 4.48Å; W264-Q267 VanDerWaalsContact CZ3-NE2 3.27Å; Q267-S269 PolarHBondContact O-N 2.98Å; Q267-G270 PolarHBondContact O-N 3.46Å; Q267-G270 VanDerWaalsContact O-N 3.14Å; Q267-M271 PolarHBondContact O-N 3.12Å
268L93.1Very high92.4Very high70 Ų7047.5 Ų47.537%0.36623%0.225SC..Hα-helixtrans-64.7-29.6178.7-78.8175.1000112.1W264 Y265 G270 M271W264-L268 HydrophobicContact CE3-CD1 4.37Å; W264-L268 HydrophobicContact CE3-CG 4.26Å; W264-L268 WeakPolarHBondContact O-CB 3.44Å; W264-L268 WeakPolarHBondContact O-CG 3.36Å; W264-L268 PolarHBondContact O-N 3.3Å; Y265-L268 PolarHBondContact O-N 3.08Å; L268-G270 PolarHBondContact O-N 2.9Å; L268-M271 HydrophobicContact CD2-CE 3.55Å; L268-M271 HydrophobicContact CD2-SD 3.84Å; L268-M271 WeakPolarHBondContact O-CB 3.39Å; L268-M271 PolarHBondContact O-N 3.33Å
269S90.4Very high92.4Very high2 Ų250.1 Ų50.11%0.01423%0.23CC..THydrogen-bonded Turntrans-63.3-27.1175.458.60000112.8N205 Y265 G266 Q267N205-S269 PolarHBondContact ND2-O 2.71Å; Y265-S269 PolarHBondContact O-N 3.49Å; G266-S269 PolarHBondContact O-OG 3.29Å; Q267-S269 PolarHBondContact O-N 2.98Å
270G91.5Very high92.3Very high0 Ų048.6 Ų48.60%022%0.22CC..THydrogen-bonded Turntrans-89.2-10.617500000114.8W19 N205 Q267 L268 V272 E273W19-G270 VanDerWaalsContact CD1-C 3.45Å; N205-G270 WeakPolarHBondContact ND2-CA 3.34Å; Q267-G270 PolarHBondContact O-N 3.46Å; Q267-G270 VanDerWaalsContact O-N 3.14Å; L268-G270 PolarHBondContact O-N 2.9Å; G270-V272 PolarHBondContact O-N 3.5Å; G270-E273 WeakPolarHBondContact CA-OE1 3.43Å; G270-E273 VanDerWaalsContact O-CG 3.31Å; G270-E273 WeakPolarHBondContact O-CG 3.4Å; G270-E273 PolarHBondContact O-N 3.49Å
271M93.6Very high92.1Very high92 Ų9242.1 Ų42.145%0.45320%0.198SC..THydrogen-bonded Turntrans-69-9.4-174-165.3173.768.700113.3Q267 L268 E273 P274Q267-M271 PolarHBondContact O-N 3.12Å; L268-M271 HydrophobicContact CD2-CE 3.55Å; L268-M271 HydrophobicContact CD2-SD 3.84Å; L268-M271 WeakPolarHBondContact O-CB 3.39Å; L268-M271 PolarHBondContact O-N 3.33Å; M271-E273 VanDerWaalsContact C-N 3.32Å; M271-P274 WeakPolarHBondContact O-CD 3.43Å
272V93.2Very high91.9Very high35 Ų3543.3 Ų43.321%0.21221%0.207CC..Hα-helixtrans-73.4-23.2172.1-62.70000112.8T202 N205 V206 G270 L275 A276T202-V272 HydrophobicContact CG2-CG1 3.75Å; T202-V272 HydrophobicContact CG2-CG2 4.33Å; T202-V272 WeakPolarHBondContact O-CG2 3.16Å; N205-V272 HydrophobicContact CB-CG2 3.46Å; N205-V272 VanDerWaalsContact CB-CG2 3.46Å; V206-V272 HydrophobicContact CG2-CB 4.04Å; V206-V272 HydrophobicContact CG2-CG2 3.97Å; G270-V272 PolarHBondContact O-N 3.5Å; V272-L275 PolarHBondContact O-N 2.86Å; V272-A276 WeakPolarHBondContact O-CB 3.18Å; V272-A276 PolarHBondContact O-N 3.18Å
273E93.8Very high91.8Very high0 Ų044.3 Ų44.30%022%0.215CC..Hα-helixtrans-63.8-47.1-176.3-54162.6-142.400111.9T15 T18 W19 T22 N205 G209 N241 G270 M271 L275 A276 G277T15-E273 WeakPolarHBondContact CG2-O 3.33Å; T18-E273 VanDerWaalsContact C-OE2 3.24Å; T18-E273 WeakPolarHBondContact CB-OE2 3.26Å; T18-E273 PolarHBondContact OG1-OE2 2.88Å; W19-E273 PolarHBondContact N-OE2 2.84Å; W19-E273 VanDerWaalsContact N-OE2 3.09Å; T22-E273 PolarHBondContact OG1-OE1 3.34Å; N205-E273 HydrophobicContact CB-CG 3.76Å; N205-E273 WeakPolarHBondContact O-CG 3.44Å; G209-E273 WeakPolarHBondContact CA-O 3.46Å; N241-E273 PolarHBondContact ND2-OE1 3.27Å; N241-E273 PolarHBondContact ND2-OE2 3.14Å; G270-E273 WeakPolarHBondContact CA-OE1 3.43Å; G270-E273 VanDerWaalsContact O-CG 3.31Å; G270-E273 WeakPolarHBondContact O-CG 3.4Å; G270-E273 PolarHBondContact O-N 3.49Å; M271-E273 VanDerWaalsContact C-N 3.32Å; E273-L275 VanDerWaalsContact C-N 3.3Å; E273-L275 PolarHBondContact O-N 3.16Å; E273-A276 PolarHBondContact O-N 3.29Å; E273-G277 PolarHBondContact O-N 2.95Å
274P95.1Very high91.3Very high14 Ų1442.8 Ų42.89%0.09121%0.208CC..Hα-helixtrans-60.7-37.3176.9-2435.9000113.8T15 F16 W19 M271 V278T15-P274 WeakPolarHBondContact OG1-CA 3.43Å; F16-P274 HydrophobicContact CD2-CB 4.49Å; F16-P274 HydrophobicContact CE2-CB 4.38Å; W19-P274 HydrophobicContact CB-CG 4.04Å; W19-P274 HydrophobicContact CG-CG 4.44Å; M271-P274 WeakPolarHBondContact O-CD 3.43Å; P274-V278 VanDerWaalsContact O-CG2 3.32Å; P274-V278 WeakPolarHBondContact O-CG2 3.22Å; P274-V278 PolarHBondContact O-N 2.81Å
275L93.8Very high90.6Very high129 Ų12943.5 Ų43.568%0.67523%0.225SC*.Hα-helixtrans-67.1-47.4177.9-61.4177.5000110.8V272 E273 F279V272-L275 PolarHBondContact O-N 2.86Å; E273-L275 VanDerWaalsContact C-N 3.3Å; E273-L275 PolarHBondContact O-N 3.16Å; L275-F279 PolarHBondContact O-N 3.39Å; L275-F279 VanDerWaalsContact O-N 3.13Å
276A91.4Very high90.2Very high10 Ų1044.4 Ų44.48%0.08324%0.235CC..Hα-helixtrans-63.4-39.2177.300000112.1V206 L210 V272 E273 F279 G280V206-A276 HydrophobicContact CG1-CB 4.35Å; V206-A276 WeakPolarHBondContact O-CB 3.42Å; L210-A276 HydrophobicContact CG-CB 4.22Å; V272-A276 WeakPolarHBondContact O-CB 3.18Å; V272-A276 PolarHBondContact O-N 3.18Å; E273-A276 PolarHBondContact O-N 3.29Å; A276-F279 PolarHBondContact O-N 3.43Å; A276-G280 PolarHBondContact O-N 3.41Å
277G92.4Very high89.8Confident0 Ų044.7 Ų44.70%024%0.238CC..Hα-helixtrans-71.1-39.7179.600000114.4G209 G213 E273 F279 G280 A281G209-G277 WeakPolarHBondContact O-CA 3.35Å; G209-G277 PolarHBondContact O-N 2.94Å; G213-G277 WeakPolarHBondContact CA-O 3.05Å; E273-G277 PolarHBondContact O-N 2.95Å; G277-F279 VanDerWaalsContact C-N 3.31Å; G277-F279 PolarHBondContact O-N 3.03Å; G277-G280 PolarHBondContact O-N 2.99Å; G277-A281 WeakPolarHBondContact O-CB 3.15Å; G277-A281 PolarHBondContact O-N 3.48Å
278V92.5Very high89.2Confident42 Ų4248.8 Ų48.826%0.25526%0.257SS..Hα-helixtrans-61.5-44.9171.8172.30000110V8 L12 P274 A281 F282V8-V278 HydrophobicContact CG1-CG1 4.49Å; L12-V278 HydrophobicContact CB-CG2 4.26Å; L12-V278 HydrophobicContact CD1-CG2 4.12Å; L12-V278 HydrophobicContact CG-CG2 4.49Å; P274-V278 VanDerWaalsContact O-CG2 3.32Å; P274-V278 WeakPolarHBondContact O-CG2 3.22Å; P274-V278 PolarHBondContact O-N 2.81Å; V278-A281 PolarHBondContact O-N 3.43Å; V278-F282 HydrophobicContact CG1-CD2 3.86Å; V278-F282 HydrophobicContact CG1-CE2 3.83Å; V278-F282 VanDerWaalsContact O-CD2 3.27Å; V278-F282 WeakPolarHBondContact O-CD2 3.31Å; V278-F282 PolarHBondContact O-N 3.33Å
279F90.9Very high88.8Confident109 Ų10949.6 Ų49.648%0.47827%0.266SS..Hα-helixtrans-59.5-48.1175.2177-91.2000112L210 L275 A276 G277 A281 F282 A283 L286L210-F279 HydrophobicContact CD2-CD1 3.62Å; L210-F279 HydrophobicContact CD2-CE1 4.17Å; L275-F279 PolarHBondContact O-N 3.39Å; L275-F279 VanDerWaalsContact O-N 3.13Å; A276-F279 PolarHBondContact O-N 3.43Å; G277-F279 VanDerWaalsContact C-N 3.31Å; G277-F279 PolarHBondContact O-N 3.03Å; F279-A281 VanDerWaalsContact C-N 3.29Å; F279-A281 PolarHBondContact O-N 3.32Å; F279-F282 PolarHBondContact O-N 3.04Å; F279-A283 HydrophobicContact CD1-CB 4.31Å; F279-A283 HydrophobicContact CE1-CB 3.96Å; F279-A283 HydrophobicContact CE2-CB 4.17Å; F279-A283 HydrophobicContact CZ-CB 3.89Å; F279-A283 VanDerWaalsContact O-CB 3.27Å; F279-A283 WeakPolarHBondContact O-CB 3.47Å; F279-A283 PolarHBondContact O-N 3.11Å; F279-L286 HydrophobicContact CZ-CD2 4.16Å
280G87.4Confident88.5Confident0 Ų053.9 Ų53.90%029%0.288CS..Hα-helixtrans-58.8-38.7178.600000113A276 G277 V284A276-G280 PolarHBondContact O-N 3.41Å; G277-G280 PolarHBondContact O-N 2.99Å; G280-V284 VanDerWaalsContact O-CG2 3.29Å; G280-V284 WeakPolarHBondContact O-CG2 3.16Å; G280-V284 PolarHBondContact O-N 2.91Å
281A88.5Confident88.1Confident9 Ų954.4 Ų54.47%0.07429%0.291CS..Hα-helixtrans-67.9-34.7177.900000113.4V8 A11 G213 G277 V278 F279V8-A281 HydrophobicContact CG2-CB 4.34Å; A11-A281 HydrophobicContact CB-CB 3.49Å; A11-A281 VanDerWaalsContact CB-CB 3.49Å; G213-A281 VanDerWaalsContact O-CA 3.27Å; G213-A281 WeakPolarHBondContact O-CA 3.41Å; G213-A281 PolarHBondContact O-N 2.85Å; G277-A281 WeakPolarHBondContact O-CB 3.15Å; G277-A281 PolarHBondContact O-N 3.48Å; V278-A281 PolarHBondContact O-N 3.43Å; F279-A281 VanDerWaalsContact C-N 3.29Å; F279-A281 PolarHBondContact O-N 3.32Å
282F87.7Confident87.9Confident152 Ų15250.5 Ų50.567%0.66727%0.272SS*.Hα-helixtrans-80.4-37.2175.8-82.5-68.6000112.9V8 V278 F279V8-F282 HydrophobicContact CB-CE2 4.39Å; V8-F282 HydrophobicContact CB-CZ 4.35Å; V8-F282 HydrophobicContact CG1-CD2 4.34Å; V8-F282 HydrophobicContact CG1-CE2 3.56Å; V8-F282 HydrophobicContact CG1-CZ 3.84Å; V8-F282 HydrophobicContact CG2-CD1 4.2Å; V8-F282 HydrophobicContact CG2-CD2 4.23Å; V8-F282 HydrophobicContact CG2-CE1 3.84Å; V8-F282 HydrophobicContact CG2-CE2 3.86Å; V8-F282 HydrophobicContact CG2-CG 4.39Å; V8-F282 HydrophobicContact CG2-CZ 3.65Å; V278-F282 HydrophobicContact CG1-CD2 3.86Å; V278-F282 HydrophobicContact CG1-CE2 3.83Å; V278-F282 VanDerWaalsContact O-CD2 3.27Å; V278-F282 WeakPolarHBondContact O-CD2 3.31Å; V278-F282 PolarHBondContact O-N 3.33Å; F279-F282 PolarHBondContact O-N 3.04Å
283A86.8Confident87.8Confident20 Ų2052.3 Ų52.317%0.16528%0.276CS..  trans-105.231-16900000113.1F279 V285 L286 A287F279-A283 HydrophobicContact CD1-CB 4.31Å; F279-A283 HydrophobicContact CE1-CB 3.96Å; F279-A283 HydrophobicContact CE2-CB 4.17Å; F279-A283 HydrophobicContact CZ-CB 3.89Å; F279-A283 VanDerWaalsContact O-CB 3.27Å; F279-A283 WeakPolarHBondContact O-CB 3.47Å; F279-A283 PolarHBondContact O-N 3.11Å; A283-V285 VanDerWaalsContact C-N 3.27Å; A283-V285 PolarHBondContact O-N 2.78Å; A283-V285 VanDerWaalsContact O-N 3.15Å; A283-L286 HydrophobicContact CB-CB 4.27Å; A283-L286 CarbonylContact O-C 3.54Å; A283-L286 WeakPolarHBondContact O-CA 3.3Å; A283-L286 WeakPolarHBondContact O-CB 3.18Å; A283-L286 PolarHBondContact O-N 3.09Å; A283-A287 WeakPolarHBondContact O-CB 3.11Å; A283-A287 PolarHBondContact O-N 3.24Å
284V84.6Confident87.5Confident3 Ų353.1 Ų53.12%0.01828%0.282CS..Hα-helixtrans-48.6-46.3-175.4176.20000112.8V214 A218 K221 G280 L286 A287 E288V214-V284 HydrophobicContact CG1-CG1 4.38Å; A218-V284 HydrophobicContact CB-CG1 4.13Å; K221-V284 HydrophobicContact CD-CG1 4.45Å; G280-V284 VanDerWaalsContact O-CG2 3.29Å; G280-V284 WeakPolarHBondContact O-CG2 3.16Å; G280-V284 PolarHBondContact O-N 2.91Å; V284-L286 PolarHBondContact O-N 2.51Å; V284-A287 PolarHBondContact O-N 3Å; V284-E288 VanDerWaalsContact O-CB 3.23Å; V284-E288 WeakPolarHBondContact O-CB 3.29Å; V284-E288 PolarHBondContact O-N 2.99Å
285V79.6Confident87.2Confident128 Ų12852.6 Ų52.678%0.77628%0.279SS*.Hα-helixtrans-63-31.8-179.7179.40000112.3A283 P289A283-V285 VanDerWaalsContact C-N 3.27Å; A283-V285 PolarHBondContact O-N 2.78Å; A283-V285 VanDerWaalsContact O-N 3.15Å; V285-P289 WeakPolarHBondContact O-CD 3.37Å
286L82.3Confident87.2Confident109 Ų10946.5 Ų46.557%0.57125%0.246SC*.Hα-helixtrans-82.4-36.2176.8-178.764.5000111.6F279 A283 V284 I290F279-L286 HydrophobicContact CZ-CD2 4.16Å; A283-L286 HydrophobicContact CB-CB 4.27Å; A283-L286 CarbonylContact O-C 3.54Å; A283-L286 WeakPolarHBondContact O-CA 3.3Å; A283-L286 WeakPolarHBondContact O-CB 3.18Å; A283-L286 PolarHBondContact O-N 3.09Å; V284-L286 PolarHBondContact O-N 2.51Å; L286-I290 VanDerWaalsContact O-CD1 3.3Å; L286-I290 WeakPolarHBondContact O-CD1 3.3Å
287A81.6Confident87.2Confident6 Ų648.1 Ų48.15%0.0525%0.252CS..Hα-helixtrans-82.8-35.8-172.900000112.9V214 A283 V284 I290 L291V214-A287 HydrophobicContact CG2-CB 3.43Å; V214-A287 VanDerWaalsContact CG2-CB 3.43Å; A283-A287 WeakPolarHBondContact O-CB 3.11Å; A283-A287 PolarHBondContact O-N 3.24Å; V284-A287 PolarHBondContact O-N 3Å; A287-I290 CarbonylContact O-C 3.57Å; A287-I290 PolarHBondContact O-N 3.32Å; A287-L291 PolarHBondContact O-N 3.15Å
288E82.7Confident86.9Confident95 Ų9548.1 Ų48.144%0.44425%0.252SS..THydrogen-bonded Turntrans-57.9-44.9-175-175.6177.7-169.700113.4V284 I290 L291 P292V284-E288 VanDerWaalsContact O-CB 3.23Å; V284-E288 WeakPolarHBondContact O-CB 3.29Å; V284-E288 PolarHBondContact O-N 2.99Å; E288-I290 PolarHBondContact O-N 2.88Å; E288-L291 PolarHBondContact O-N 3.35Å; E288-P292 WeakPolarHBondContact O-CD 3.49Å
289P84.8Confident86.8Confident86 Ų8646.1 Ų46.156%0.55824%0.24SC*.THydrogen-bonded Turntrans-68.2-23.7176.2-20.234000114V285V285-P289 WeakPolarHBondContact O-CD 3.37Å
290I85.4Confident86.8Confident92 Ų9241 Ų4147%0.47222%0.217SC..THydrogen-bonded Turntrans-89.7-23.8-177-58.6175000110.6L286 A287 E288 Y293 A294L286-I290 VanDerWaalsContact O-CD1 3.3Å; L286-I290 WeakPolarHBondContact O-CD1 3.3Å; A287-I290 CarbonylContact O-C 3.57Å; A287-I290 PolarHBondContact O-N 3.32Å; E288-I290 PolarHBondContact O-N 2.88Å; I290-Y293 WeakPolarHBondContact O-CB 3.48Å; I290-Y293 PolarHBondContact O-N 3.16Å; I290-Y293 VanDerWaalsContact O-N 3.09Å; I290-A294 PolarHBondContact O-N 3.04Å
291L83Confident86.8Confident12 Ų1241 Ų416%0.06322%0.218CC..Hα-helixtrans-56.6-42.8-172-143.268.4000114.4M66 L210 V214 A287 E288 Y293 A294 L295M66-L291 HydrophobicContact CE-CD2 4.38Å; M66-L291 HydrophobicContact SD-CB 4.34Å; M66-L291 HydrophobicContact SD-CD2 3.93Å; L210-L291 HydrophobicContact CB-CD1 4.23Å; V214-L291 HydrophobicContact CB-CD1 4.5Å; V214-L291 HydrophobicContact CB-CD2 4.08Å; V214-L291 HydrophobicContact CG1-CD2 3.9Å; V214-L291 HydrophobicContact CG2-CD1 4.13Å; V214-L291 HydrophobicContact CG2-CD2 4.49Å; A287-L291 PolarHBondContact O-N 3.15Å; E288-L291 PolarHBondContact O-N 3.35Å; L291-Y293 VanDerWaalsContact C-N 3.29Å; L291-Y293 PolarHBondContact O-N 2.85Å; L291-A294 PolarHBondContact O-N 3.46Å; L291-L295 HydrophobicContact CG-CD1 4.2Å; L291-L295 HydrophobicContact CG-CG 4.45Å; L291-L295 WeakPolarHBondContact O-CB 3.49Å; L291-L295 WeakPolarHBondContact O-CG 3.23Å; L291-L295 PolarHBondContact O-N 3.44Å
292P88.7Confident86.8Confident9 Ų940.9 Ų40.96%0.05822%0.215CC..Hα-helixtrans-61.1-38.9177.6-2333.7000112.5M66 A67 E288 A296M66-P292 HydrophobicContact CB-CB 4.48Å; M66-P292 HydrophobicContact CB-CG 3.77Å; A67-P292 HydrophobicContact CB-CB 4.37Å; E288-P292 WeakPolarHBondContact O-CD 3.49Å; P292-A296 VanDerWaalsContact O-CB 3.23Å; P292-A296 WeakPolarHBondContact O-CB 3.33Å; P292-A296 PolarHBondContact O-N 2.99Å; P292-A296 VanDerWaalsContact O-N 3.11Å
293Y91.3Very high86.9Confident74 Ų7435.3 Ų35.329%0.2919%0.194SC..Hα-helixtrans-69.6-43.8176.5-61-94.6000110.9F73 P80 I290 L291 F297F73-Y293 WeakPolarHBondContact CZ-OH 3.45Å; P80-Y293 VanDerWaalsContact CA-CE1 3.45Å; P80-Y293 HydrophobicContact CB-CD1 4.08Å; P80-Y293 HydrophobicContact CB-CD2 4.36Å; P80-Y293 HydrophobicContact CB-CE1 3.61Å; P80-Y293 HydrophobicContact CB-CE2 3.9Å; P80-Y293 HydrophobicContact CB-CG 4.44Å; P80-Y293 VanDerWaalsContact CB-CZ 3.5Å; P80-Y293 HydrophobicContact CG-CE1 4.29Å; P80-Y293 HydrophobicContact CG-CE2 4.44Å; I290-Y293 WeakPolarHBondContact O-CB 3.48Å; I290-Y293 PolarHBondContact O-N 3.16Å; I290-Y293 VanDerWaalsContact O-N 3.09Å; L291-Y293 VanDerWaalsContact C-N 3.29Å; L291-Y293 PolarHBondContact O-N 2.85Å; Y293-F297 WeakPolarHBondContact O-CB 3.24Å; Y293-F297 PolarHBondContact O-N 3.1Å
294A87.6Confident87.1Confident16 Ų1636.8 Ų36.813%0.13220%0.196CC..Hα-helixtrans-65-43.8-178.800000112.2P207 I290 L291 F297 A298P207-A294 HydrophobicContact CB-CB 4.34Å; P207-A294 WeakPolarHBondContact CB-O 3.23Å; P207-A294 HydrophobicContact CG-CB 4.4Å; P207-A294 WeakPolarHBondContact CG-O 3.37Å; I290-A294 PolarHBondContact O-N 3.04Å; L291-A294 PolarHBondContact O-N 3.46Å; A294-F297 WeakPolarHBondContact O-CB 3.49Å; A294-F297 PolarHBondContact O-N 2.93Å; A294-A298 WeakPolarHBondContact O-CB 3.34Å; A294-A298 PolarHBondContact O-N 3.23Å
295L88.6Confident87Confident4 Ų436.8 Ų36.82%0.02120%0.196CC..Hα-helixtrans-67.4-43.7177-72.8172.7000112L59 P62 A63 M66 A211 L291 F297 A298 A299L59-L295 HydrophobicContact CD2-CD2 3.6Å; P62-L295 HydrophobicContact CB-CD1 4.47Å; A63-L295 HydrophobicContact CB-CB 3.92Å; M66-L295 HydrophobicContact CE-CD1 3.21Å; A211-L295 HydrophobicContact CB-CD2 3.9Å; L291-L295 HydrophobicContact CG-CD1 4.2Å; L291-L295 HydrophobicContact CG-CG 4.45Å; L291-L295 WeakPolarHBondContact O-CB 3.49Å; L291-L295 WeakPolarHBondContact O-CG 3.23Å; L291-L295 PolarHBondContact O-N 3.44Å; L295-F297 VanDerWaalsContact C-N 3.32Å; L295-F297 PolarHBondContact O-N 3.41Å; L295-A298 WeakPolarHBondContact O-CB 3.41Å; L295-A298 PolarHBondContact O-N 2.97Å; L295-A299 PolarHBondContact O-N 3.2Å
296A92.6Very high87.3Confident0 Ų030.7 Ų30.70%016%0.159CC..Hα-helixtrans-64.3-40.1175.100000111.4L60 A63 V81 F85 P292 A299 G300L60-A296 HydrophobicContact CD2-CB 4.41Å; A63-A296 HydrophobicContact CB-CB 4.35Å; V81-A296 HydrophobicContact CB-CB 4.32Å; V81-A296 HydrophobicContact CG1-CB 3.9Å; V81-A296 VanDerWaalsContact O-CB 3.3Å; V81-A296 WeakPolarHBondContact O-CB 3.14Å; F85-A296 WeakPolarHBondContact CA-O 3.31Å; F85-A296 HydrophobicContact CB-CB 4.44Å; F85-A296 PolarHBondContact N-O 3.43Å; P292-A296 VanDerWaalsContact O-CB 3.23Å; P292-A296 WeakPolarHBondContact O-CB 3.33Å; P292-A296 PolarHBondContact O-N 2.99Å; P292-A296 VanDerWaalsContact O-N 3.11Å; A296-A299 PolarHBondContact O-N 3.02Å; A296-G300 PolarHBondContact O-N 3.48Å
297F91.9Very high87.7Confident45 Ų4530.3 Ų30.320%0.19716%0.155CC..Hα-helixtrans-57.9-46.7172.3175-81.4000112G84 L87 G88 F91 I203 Y293 A294 L295 A299 G300 A301G84-F297 WeakPolarHBondContact O-CA 3.22Å; L87-F297 HydrophobicContact CB-CD2 4.08Å; L87-F297 HydrophobicContact CB-CE2 4.48Å; G88-F297 VanDerWaalsContact CA-CE2 3.48Å; G88-F297 WeakPolarHBondContact CA-O 3.39Å; G88-F297 VanDerWaalsContact N-CD2 3.27Å; F91-F297 HydrophobicContact CB-CE2 3.79Å; F91-F297 HydrophobicContact CB-CZ 3.78Å; F91-F297 AromaticContact CD1-CZ 3.93Å; F91-F297 HydrophobicContact CD1-CZ 3.93Å; F91-F297 HydrophobicContact CD2-CZ 4.34Å; F91-F297 HydrophobicContact CG-CE2 4.19Å; F91-F297 AromaticContact CG-CZ 3.72Å; F91-F297 HydrophobicContact CG-CZ 3.72Å; I203-F297 HydrophobicContact CG2-CE1 3.86Å; I203-F297 HydrophobicContact CG2-CZ 4.35Å; Y293-F297 WeakPolarHBondContact O-CB 3.24Å; Y293-F297 PolarHBondContact O-N 3.1Å; A294-F297 WeakPolarHBondContact O-CB 3.49Å; A294-F297 PolarHBondContact O-N 2.93Å; L295-F297 VanDerWaalsContact C-N 3.32Å; L295-F297 PolarHBondContact O-N 3.41Å; F297-A299 PolarHBondContact O-N 3.28Å; F297-G300 PolarHBondContact O-N 2.92Å; F297-A301 WeakPolarHBondContact O-CB 3.49Å; F297-A301 PolarHBondContact O-N 2.87Å
298A86.6Confident87.8Confident0 Ų033.8 Ų33.80%017%0.173CC..Hα-helixtrans-56.8-52.7175.200000110.3L59 H204 P207 A294 L295 G300 A301 M302L59-A298 HydrophobicContact CD1-CB 4.06Å; H204-A298 WeakPolarHBondContact CE1-CB 3.31Å; H204-A298 PolarHBondContact CE1-O 2.87Å; H204-A298 VanDerWaalsContact ND1-C 3.26Å; H204-A298 WeakPolarHBondContact ND1-CA 3.4Å; H204-A298 PolarHBondContact ND1-O 2.87Å; P207-A298 HydrophobicContact CB-CB 3.65Å; P207-A298 HydrophobicContact CG-CB 3.81Å; A294-A298 WeakPolarHBondContact O-CB 3.34Å; A294-A298 PolarHBondContact O-N 3.23Å; L295-A298 WeakPolarHBondContact O-CB 3.41Å; L295-A298 PolarHBondContact O-N 2.97Å; A298-G300 VanDerWaalsContact C-N 3.32Å; A298-G300 PolarHBondContact O-N 3.28Å; A298-A301 PolarHBondContact O-N 2.83Å; A298-M302 WeakPolarHBondContact O-CB 3.32Å; A298-M302 PolarHBondContact O-N 3.15Å
299A90.5Very high87.5Confident0 Ų030.5 Ų30.50%016%0.159CC..Hα-helixtrans-57.5-43179.200000112.7S55 L59 L60 F85 L295 A296 F297 M302 V303S55-A299 WeakPolarHBondContact O-CB 3.47Å; L59-A299 HydrophobicContact CB-CB 3.88Å; L59-A299 HydrophobicContact CD1-CB 4.16Å; L60-A299 HydrophobicContact CD1-CB 4.17Å; L60-A299 HydrophobicContact CD2-CB 4.19Å; L60-A299 HydrophobicContact CG-CB 3.63Å; F85-A299 HydrophobicContact CD2-CB 4.15Å; F85-A299 HydrophobicContact CE2-CB 4.35Å; L295-A299 PolarHBondContact O-N 3.2Å; A296-A299 PolarHBondContact O-N 3.02Å; F297-A299 PolarHBondContact O-N 3.28Å; A299-M302 PolarHBondContact O-N 2.84Å; A299-V303 WeakPolarHBondContact O-CB 3.39Å; A299-V303 VanDerWaalsContact O-CG2 3.27Å; A299-V303 WeakPolarHBondContact O-CG2 3.42Å; A299-V303 PolarHBondContact O-N 2.84Å
300G91.3Very high87.3Confident0 Ų026.7 Ų26.70%013%0.133CC..Hα-helixtrans-63.1-44.5177.100000113.1F85 A296 F297 A298 Y304F85-G300 VanDerWaalsContact CE2-CA 3.47Å; F85-G300 WeakPolarHBondContact O-CA 3.33Å; A296-G300 PolarHBondContact O-N 3.48Å; F297-G300 PolarHBondContact O-N 2.92Å; A298-G300 VanDerWaalsContact C-N 3.32Å; A298-G300 PolarHBondContact O-N 3.28Å; G300-Y304 WeakPolarHBondContact O-CB 3.43Å; G300-Y304 PolarHBondContact O-N 3.13Å
301A87.3Confident87.4Confident2 Ų224.4 Ų24.42%0.01712%0.122CC..Hα-helixtrans-61.9-44.5175.100000111.6V92 F297 A298 Y304 V305V92-A301 HydrophobicContact CG2-CB 3.66Å; F297-A301 WeakPolarHBondContact O-CB 3.49Å; F297-A301 PolarHBondContact O-N 2.87Å; A298-A301 PolarHBondContact O-N 2.83Å; A301-Y304 PolarHBondContact O-N 3.49Å; A301-V305 WeakPolarHBondContact O-CG2 2.97Å; A301-V305 PolarHBondContact O-N 2.95Å
302M87.6Confident87.5Confident5 Ų526.3 Ų26.33%0.02514%0.135CC..Hα-helixtrans-65.7-45.2179.8-177176.9-83.300112.2M51 S55 H204 E244 A298 A299 Y304 V305 V306M51-M302 HydrophobicContact CB-CG 3.97Å; M51-M302 HydrophobicContact CB-SD 3.82Å; M51-M302 HydrophobicContact CE-CE 4.22Å; M51-M302 HydrophobicContact CE-CG 3.73Å; M51-M302 HydrophobicContact CE-SD 4.42Å; M51-M302 HydrophobicContact CG-CE 4.46Å; M51-M302 HydrophobicContact CG-SD 4.28Å; S55-M302 WeakPolarHBondContact OG-CG 3.48Å; S55-M302 PolarHBondContact OG-SD 3.5Å; H204-M302 VanDerWaalsContact CD2-CE 3.46Å; H204-M302 WeakPolarHBondContact CD2-CE 3.46Å; H204-M302 WeakPolarHBondContact CE1-CE 3.46Å; H204-M302 WeakPolarHBondContact NE2-CE 3.46Å; E244-M302 WeakPolarHBondContact OE1-CE 3.34Å; A298-M302 WeakPolarHBondContact O-CB 3.32Å; A298-M302 PolarHBondContact O-N 3.15Å; A299-M302 PolarHBondContact O-N 2.84Å; M302-Y304 VanDerWaalsContact C-N 3.29Å; M302-Y304 PolarHBondContact O-N 3.38Å; M302-V305 PolarHBondContact O-N 3.34Å; M302-V306 HydrophobicContact CG-CG2 4.49Å; M302-V306 VanDerWaalsContact O-CG2 3.29Å; M302-V306 WeakPolarHBondContact O-CG2 3.47Å; M302-V306 PolarHBondContact O-N 3.06Å
303V91Very high87.1Confident36 Ų3628.8 Ų28.822%0.21815%0.146CC..Hα-helixtrans-60-41.7175.2171.30000110.7L52 F85 A299 V306 M307L52-V303 HydrophobicContact CD2-CG2 4.33Å; F85-V303 HydrophobicContact CE2-CB 4.38Å; F85-V303 HydrophobicContact CE2-CG2 4.1Å; F85-V303 HydrophobicContact CZ-CB 4.13Å; F85-V303 HydrophobicContact CZ-CG1 4.23Å; F85-V303 HydrophobicContact CZ-CG2 4.2Å; A299-V303 WeakPolarHBondContact O-CB 3.39Å; A299-V303 VanDerWaalsContact O-CG2 3.27Å; A299-V303 WeakPolarHBondContact O-CG2 3.42Å; A299-V303 PolarHBondContact O-N 2.84Å; V303-V306 PolarHBondContact O-N 3.18Å; V303-M307 HydrophobicContact CG1-CG 4.38Å; V303-M307 WeakPolarHBondContact O-CB 3.44Å; V303-M307 WeakPolarHBondContact O-CG 3.33Å; V303-M307 PolarHBondContact O-N 3.33Å
304Y89.4Confident86.7Confident50 Ų5025.3 Ų25.320%0.19613%0.132CC..Hα-helixtrans-60.5-51.6176-174.6-78000111.5A89 V92 Y93 G300 A301 M302 V306 M307 D308A89-Y304 HydrophobicContact CB-CD2 4.31Å; V92-Y304 HydrophobicContact CB-CD1 3.68Å; V92-Y304 HydrophobicContact CB-CE1 4.25Å; V92-Y304 HydrophobicContact CB-CG 4.19Å; V92-Y304 HydrophobicContact CG1-CD1 3.4Å; V92-Y304 HydrophobicContact CG1-CE1 3.78Å; V92-Y304 HydrophobicContact CG1-CG 4.36Å; Y93-Y304 HydrophobicContact CD2-CE2 4.24Å; Y93-Y304 WeakPolarHBondContact CD2-OH 3.48Å; Y93-Y304 HydrophobicContact CG-CE2 4.47Å; G300-Y304 WeakPolarHBondContact O-CB 3.43Å; G300-Y304 PolarHBondContact O-N 3.13Å; A301-Y304 PolarHBondContact O-N 3.49Å; M302-Y304 VanDerWaalsContact C-N 3.29Å; M302-Y304 PolarHBondContact O-N 3.38Å; Y304-V306 VanDerWaalsContact C-N 3.31Å; Y304-V306 PolarHBondContact O-N 3.29Å; Y304-M307 PolarHBondContact O-N 3.35Å; Y304-M307 VanDerWaalsContact O-N 3.14Å; Y304-D308 HydrophobicContact CD1-CB 4.16Å; Y304-D308 HydrophobicContact CE1-CB 3.66Å; Y304-D308 WeakPolarHBondContact CE1-OD2 3.3Å; Y304-D308 WeakPolarHBondContact O-CB 3.33Å; Y304-D308 PolarHBondContact O-N 3.37Å; Y304-D308 PolarHBondContact OH-OD2 3.43Å
305V82.4Confident86.6Confident3 Ų329.2 Ų29.22%0.01815%0.147CC..Hα-helixtrans-58.2-42.5178.41710000111.7V92 L197 A200 A301 M302 M307 D309 I310V92-V305 HydrophobicContact CG1-CG2 3.93Å; V92-V305 HydrophobicContact CG2-CG2 4.36Å; L197-V305 HydrophobicContact CD1-CG1 3.73Å; A200-V305 HydrophobicContact CB-CG2 3.52Å; A301-V305 WeakPolarHBondContact O-CG2 2.97Å; A301-V305 PolarHBondContact O-N 2.95Å; M302-V305 PolarHBondContact O-N 3.34Å; V305-M307 VanDerWaalsContact C-N 3.31Å; V305-M307 PolarHBondContact O-N 2.81Å; V305-D309 HydrophobicContact CG1-CB 4.47Å; V305-D309 WeakPolarHBondContact O-CA 3.14Å; V305-D309 WeakPolarHBondContact O-CB 3.35Å; V305-D309 PolarHBondContact O-N 2.78Å; V305-I310 HydrophobicContact CG1-CD1 4.32Å; V305-I310 HydrophobicContact CG1-CG1 4.26Å; V305-I310 PolarHBondContact O-N 3.19Å; V305-I310 VanDerWaalsContact O-N 3.17Å
306V86.7Confident86.2Confident0 Ų034 Ų340%017%0.172CC..Iπ-helixtrans-62.9-41.6178.7173.80000111.2A48 M51 L52 M302 V303 Y304 I310 I311A48-V306 HydrophobicContact CB-CG1 3.71Å; M51-V306 HydrophobicContact CB-CG2 3.68Å; M51-V306 HydrophobicContact CE-CG2 3.96Å; M51-V306 HydrophobicContact SD-CG2 4.19Å; L52-V306 HydrophobicContact CD1-CG1 3.9Å; L52-V306 HydrophobicContact CD2-CB 4.27Å; L52-V306 HydrophobicContact CD2-CG1 4.01Å; L52-V306 HydrophobicContact CG-CB 4.4Å; L52-V306 HydrophobicContact CG-CG1 3.76Å; M302-V306 HydrophobicContact CG-CG2 4.49Å; M302-V306 VanDerWaalsContact O-CG2 3.29Å; M302-V306 WeakPolarHBondContact O-CG2 3.47Å; M302-V306 PolarHBondContact O-N 3.06Å; V303-V306 PolarHBondContact O-N 3.18Å; Y304-V306 VanDerWaalsContact C-N 3.31Å; Y304-V306 PolarHBondContact O-N 3.29Å; V306-I310 HydrophobicContact CG2-CD1 4.34Å; V306-I311 HydrophobicContact CG1-CD1 3.62Å; V306-I311 HydrophobicContact CG1-CG1 3.79Å; V306-I311 WeakPolarHBondContact O-CB 3.27Å; V306-I311 WeakPolarHBondContact O-CG1 2.95Å; V306-I311 PolarHBondContact O-N 3.14Å
307M90Very high85.4Confident101 Ų10135.8 Ų35.850%0.49819%0.185SC..Iπ-helixtrans-75-39.3-177.5-68.1-66.4151.800113.3L52 V303 Y304 V305 I311 P312L52-M307 HydrophobicContact CD1-CE 3.98Å; L52-M307 HydrophobicContact CD2-CE 3.69Å; L52-M307 HydrophobicContact CG-CE 4.48Å; V303-M307 HydrophobicContact CG1-CG 4.38Å; V303-M307 WeakPolarHBondContact O-CB 3.44Å; V303-M307 WeakPolarHBondContact O-CG 3.33Å; V303-M307 PolarHBondContact O-N 3.33Å; Y304-M307 PolarHBondContact O-N 3.35Å; Y304-M307 VanDerWaalsContact O-N 3.14Å; V305-M307 VanDerWaalsContact C-N 3.31Å; V305-M307 PolarHBondContact O-N 2.81Å; M307-I311 HydrophobicContact CE-CD1 4Å; M307-I311 HydrophobicContact SD-CD1 4.11Å; M307-P312 VanDerWaalsContact O-CD 3.23Å; M307-P312 WeakPolarHBondContact O-CD 3.27Å; M307-P312 VanDerWaalsContact O-CG 3.27Å; M307-P312 WeakPolarHBondContact O-CG 3.43Å
308D83.6Confident84.9Confident79 Ų7937 Ų3742%0.42221%0.209SC..Iπ-helixtrans-91.6-28.7-173-150.839.1000112.8Y304Y304-D308 HydrophobicContact CD1-CB 4.16Å; Y304-D308 HydrophobicContact CE1-CB 3.66Å; Y304-D308 WeakPolarHBondContact CE1-OD2 3.3Å; Y304-D308 WeakPolarHBondContact O-CB 3.33Å; Y304-D308 PolarHBondContact O-N 3.37Å; Y304-D308 PolarHBondContact OH-OD2 3.43Å
309D78.3Confident84.8Confident27 Ų2738.5 Ų38.514%0.14422%0.218CC..Iπ-helixtrans-115.1-64.2-176.8-65.4-44.2000113.2V305 P312 E313V305-D309 HydrophobicContact CG1-CB 4.47Å; V305-D309 WeakPolarHBondContact O-CA 3.14Å; V305-D309 WeakPolarHBondContact O-CB 3.35Å; V305-D309 PolarHBondContact O-N 2.78Å; D309-P312 WeakPolarHBondContact O-CD 3.31Å; D309-E313 WeakPolarHBondContact O-CB 3.29Å; D309-E313 PolarHBondContact O-N 3.41Å
310I80.6Confident84.7Confident6 Ų639.3 Ų39.33%0.03123%0.226CC..Iπ-helixtrans-69.4-48-164.2-54.6-174.9000112.5L44 A48 M51 A247 V305 V306 E313 A314L44-I310 HydrophobicContact CB-CG2 4.29Å; L44-I310 HydrophobicContact CD2-CG2 4.45Å; L44-I310 VanDerWaalsContact O-CG2 3.3Å; L44-I310 WeakPolarHBondContact O-CG2 3.42Å; A48-I310 HydrophobicContact CB-CB 4.33Å; A48-I310 HydrophobicContact CB-CG2 3.74Å; M51-I310 HydrophobicContact CE-CD1 3.78Å; M51-I310 HydrophobicContact SD-CD1 3.39Å; M51-I310 WeakPolarHBondContact SD-CD1 3.38Å; A247-I310 HydrophobicContact CB-CD1 4.47Å; V305-I310 HydrophobicContact CG1-CD1 4.32Å; V305-I310 HydrophobicContact CG1-CG1 4.26Å; V305-I310 PolarHBondContact O-N 3.19Å; V305-I310 VanDerWaalsContact O-N 3.17Å; V306-I310 HydrophobicContact CG2-CD1 4.34Å; I310-E313 PolarHBondContact O-N 2.85Å; I310-A314 WeakPolarHBondContact O-CB 3.13Å; I310-A314 PolarHBondContact O-N 2.89Å
311I87.3Confident84.8Confident44 Ų4447.9 Ų47.923%0.22626%0.263CS..Hα-helixtrans-64-49.3179-70.9171.4000110.8A48 L52 V306 M307 E313 A314 Q315A48-I311 HydrophobicContact CB-CG1 3.86Å; L52-I311 HydrophobicContact CD1-CD1 4.27Å; V306-I311 HydrophobicContact CG1-CD1 3.62Å; V306-I311 HydrophobicContact CG1-CG1 3.79Å; V306-I311 WeakPolarHBondContact O-CB 3.27Å; V306-I311 WeakPolarHBondContact O-CG1 2.95Å; V306-I311 PolarHBondContact O-N 3.14Å; M307-I311 HydrophobicContact CE-CD1 4Å; M307-I311 HydrophobicContact SD-CD1 4.11Å; I311-E313 PolarHBondContact O-N 3.45Å; I311-A314 PolarHBondContact O-N 3.15Å; I311-Q315 WeakPolarHBondContact O-CG 3.32Å; I311-Q315 PolarHBondContact O-N 3.11Å
312P84.9Confident84.9Confident51 Ų5151.5 Ų51.533%0.33128%0.282SS..Hα-helixtrans-55.3-49.3174.6-29.938.5000112.4M307 D309 A314 Q315 I316M307-P312 VanDerWaalsContact O-CD 3.23Å; M307-P312 WeakPolarHBondContact O-CD 3.27Å; M307-P312 VanDerWaalsContact O-CG 3.27Å; M307-P312 WeakPolarHBondContact O-CG 3.43Å; D309-P312 WeakPolarHBondContact O-CD 3.31Å; P312-A314 PolarHBondContact O-N 3.38Å; P312-Q315 PolarHBondContact O-N 3.45Å; P312-I316 WeakPolarHBondContact O-CG1 3.4Å; P312-I316 PolarHBondContact O-N 3.1Å
313E79.7Confident85Confident62 Ų6251.4 Ų51.429%0.2928%0.282SS..Hα-helixtrans-59.6-44.1-178.4-172.764.8-151.900112.1L44 D309 I310 I311 Q315 I316L44-E313 HydrophobicContact CD1-CB 4.49Å; L44-E313 HydrophobicContact CD1-CG 3.91Å; D309-E313 WeakPolarHBondContact O-CB 3.29Å; D309-E313 PolarHBondContact O-N 3.41Å; I310-E313 PolarHBondContact O-N 2.85Å; I311-E313 PolarHBondContact O-N 3.45Å; E313-Q315 PolarHBondContact O-N 2.67Å; E313-Q315 VanDerWaalsContact O-N 3.1Å; E313-I316 PolarHBondContact O-N 3.16Å; E313-I316 VanDerWaalsContact OE2-CD1 3.31Å; E313-I316 WeakPolarHBondContact OE2-CD1 3.41Å
314A82.1Confident85.2Confident1 Ų152.2 Ų52.21%0.00829%0.289CS..Hα-helixtrans-62.9-18.4177.900000113.6D41 L44 I310 I311 P312 A323D41-A314 WeakPolarHBondContact CB-O 3.12Å; L44-A314 HydrophobicContact CB-CB 3.76Å; I310-A314 WeakPolarHBondContact O-CB 3.13Å; I310-A314 PolarHBondContact O-N 2.89Å; I311-A314 PolarHBondContact O-N 3.15Å; P312-A314 PolarHBondContact O-N 3.38Å; A314-A323 HydrophobicContact CB-CB 3.75Å; A314-A323 WeakPolarHBondContact O-CB 3Å
315Q86.5Confident85.5Confident97 Ų9758.4 Ų58.445%0.45331%0.312SS..Hα-helixtrans-99.9-11.3-178.8-66-174.2-6.500114I311 P312 E313 S317I311-Q315 WeakPolarHBondContact O-CG 3.32Å; I311-Q315 PolarHBondContact O-N 3.11Å; P312-Q315 PolarHBondContact O-N 3.45Å; E313-Q315 PolarHBondContact O-N 2.67Å; E313-Q315 VanDerWaalsContact O-N 3.1Å; Q315-S317 PolarHBondContact O-N 2.83Å
316I79.5Confident85.9Confident105 Ų10559 Ų5954%0.53832%0.317SS..Hα-helixtrans-62.1-39.4-175-71.3171.2000112.4P312 E313 G318P312-I316 WeakPolarHBondContact O-CG1 3.4Å; P312-I316 PolarHBondContact O-N 3.1Å; E313-I316 PolarHBondContact O-N 3.16Å; E313-I316 VanDerWaalsContact OE2-CD1 3.31Å; E313-I316 WeakPolarHBondContact OE2-CD1 3.41Å; I316-G318 VanDerWaalsContact C-N 3.26Å; I316-G318 PolarHBondContact O-N 3.33Å
317S76.1Confident86.1Confident38 Ų3860 Ų6027%0.26633%0.325SS..THydrogen-bonded Turntrans-86.918.2-170.4-25.30000114.8D41 Q315 N319D41-S317 PolarHBondContact OD1-OG 3.22Å; D41-S317 VanDerWaalsContact OD1-OG 3.08Å; D41-S317 WeakPolarHBondContact OD2-CB 3.41Å; D41-S317 PolarHBondContact OD2-OG 3.04Å; Q315-S317 PolarHBondContact O-N 2.83Å; S317-N319 VanDerWaalsContact C-N 3.26Å; S317-N319 PolarHBondContact O-N 3Å
318G80.8Confident86.4Confident69 Ų6959.6 Ų59.671%0.71132%0.323SS*.SBendtrans78.21178.100000115.3I316 G320I316-G318 VanDerWaalsContact C-N 3.26Å; I316-G318 PolarHBondContact O-N 3.33Å; G318-G320 VanDerWaalsContact C-N 3.33Å; G318-G320 PolarHBondContact O-N 3.29Å
319N85.7Confident86.8Confident33 Ų3360.6 Ų60.618%0.17633%0.328CS..  trans-93.924.5177.4-57.5-59.5000113.2R38 D41 S317 K321 L322 A323R38-N319 WeakPolarHBondContact CG-OD1 3.3Å; D41-N319 HydrophobicContact CB-CB 4.03Å; D41-N319 WeakPolarHBondContact OD2-CB 3.32Å; D41-N319 PolarHBondContact OD2-ND2 2.84Å; S317-N319 VanDerWaalsContact C-N 3.26Å; S317-N319 PolarHBondContact O-N 3Å; N319-K321 VanDerWaalsContact C-N 3.26Å; N319-K321 PolarHBondContact O-N 3.15Å; N319-K321 VanDerWaalsContact O-N 3.07Å; N319-L322 HydrophobicContact CB-CB 4.46Å; N319-L322 WeakPolarHBondContact O-CA 3.39Å; N319-L322 WeakPolarHBondContact O-CB 3.14Å; N319-L322 PolarHBondContact O-N 3Å; N319-A323 PolarHBondContact O-N 3.47Å
320G88.1Confident87.3Confident17 Ų1759.3 Ų59.318%0.17532%0.321CS..Hα-helixtrans-57.1-31.2-170.300000115.4G318 S324G318-G320 VanDerWaalsContact C-N 3.33Å; G318-G320 PolarHBondContact O-N 3.29Å; G320-S324 WeakPolarHBondContact O-CB 3.32Å; G320-S324 PolarHBondContact O-N 3.38Å; G320-S324 PolarHBondContact O-OG 2.93Å
321K92.4Very high87.8Confident179 Ų17962.5 Ų62.578%0.77834%0.335SS*.Hα-helixtrans-65.4-41.4173.4-72.9-173.3179.8-179.50112.4N319 S324 W325N319-K321 VanDerWaalsContact C-N 3.26Å; N319-K321 PolarHBondContact O-N 3.15Å; N319-K321 VanDerWaalsContact O-N 3.07Å; K321-S324 PolarHBondContact O-N 3Å; K321-W325 PolarHBondContact O-N 3.4Å
322L90.8Very high88.1Confident79 Ų7963.6 Ų63.641%0.41434%0.344SS..Hα-helixtrans-68.1-43.8178175.7141.5000110.1R38 N319 S324 W325 A326R38-L322 WeakPolarHBondContact O-CD2 3.42Å; N319-L322 HydrophobicContact CB-CB 4.46Å; N319-L322 WeakPolarHBondContact O-CA 3.39Å; N319-L322 WeakPolarHBondContact O-CB 3.14Å; N319-L322 PolarHBondContact O-N 3Å; L322-S324 VanDerWaalsContact C-N 3.32Å; L322-S324 PolarHBondContact O-N 3.46Å; L322-W325 PolarHBondContact O-N 3.05Å; L322-A326 VanDerWaalsContact O-CB 3.22Å; L322-A326 WeakPolarHBondContact O-CB 3.45Å; L322-A326 PolarHBondContact O-N 3.3Å
323A89.9Confident88.1Confident3 Ų363.7 Ų63.73%0.02534%0.343CS..Hα-helixtrans-58.3-42.5173.400000112.3G45 A314 N319 A326 S327G45-A323 WeakPolarHBondContact CA-O 3.37Å; A314-A323 HydrophobicContact CB-CB 3.75Å; A314-A323 WeakPolarHBondContact O-CB 3Å; N319-A323 PolarHBondContact O-N 3.47Å; A323-A326 PolarHBondContact O-N 2.87Å; A323-S327 WeakPolarHBondContact O-CB 3.38Å; A323-S327 PolarHBondContact O-N 3.14Å
324S94.2Very high88.4Confident52 Ų5260.9 Ų60.936%0.36433%0.33SS..Hα-helixtrans-65.2-45.7178.9-56.20000112.3G320 K321 L322 S327 I328G320-S324 WeakPolarHBondContact O-CB 3.32Å; G320-S324 PolarHBondContact O-N 3.38Å; G320-S324 PolarHBondContact O-OG 2.93Å; K321-S324 PolarHBondContact O-N 3Å; L322-S324 VanDerWaalsContact C-N 3.32Å; L322-S324 PolarHBondContact O-N 3.46Å; S324-S327 WeakPolarHBondContact O-CB 3.48Å; S324-S327 PolarHBondContact O-N 3.36Å; S324-I328 WeakPolarHBondContact O-CG1 3.5Å; S324-I328 PolarHBondContact O-N 3.2Å
325W95.6Very high88.7Confident180 Ų18063.9 Ų63.968%0.68235%0.345SS*.Hα-helixtrans-67.2-37.8176.2-84.8113.1000112.6K321 L322 S327 I328 L329K321-W325 PolarHBondContact O-N 3.4Å; L322-W325 PolarHBondContact O-N 3.05Å; W325-S327 VanDerWaalsContact C-N 3.28Å; W325-S327 PolarHBondContact O-N 2.88Å; W325-I328 HydrophobicContact CE3-CD1 4.06Å; W325-I328 HydrophobicContact CZ3-CD1 4.21Å; W325-I328 PolarHBondContact O-N 2.85Å; W325-L329 WeakPolarHBondContact O-CB 3.37Å; W325-L329 PolarHBondContact O-N 2.94Å
326A90.6Very high88.7Confident16 Ų1662.2 Ų62.213%0.13234%0.344CS..Hα-helixtrans-62.3-39.2173.400000111G42 F46 L322 A323 L329 G330G42-A326 WeakPolarHBondContact O-CB 3.37Å; F46-A326 VanDerWaalsContact CA-O 3.31Å; F46-A326 WeakPolarHBondContact CA-O 3.38Å; F46-A326 HydrophobicContact CB-CB 4.17Å; L322-A326 VanDerWaalsContact O-CB 3.22Å; L322-A326 WeakPolarHBondContact O-CB 3.45Å; L322-A326 PolarHBondContact O-N 3.3Å; A323-A326 PolarHBondContact O-N 2.87Å; A326-L329 WeakPolarHBondContact O-CB 3.36Å; A326-L329 PolarHBondContact O-N 2.99Å; A326-G330 PolarHBondContact O-N 3.43Å
327S92.5Very high88.5Confident22 Ų2259.7 Ų59.715%0.15433%0.331CS..Hα-helixtrans-62.9-45.4173.7-174.90000112.6G45 G49 A323 S324 W325 L329 G330 F331G45-S327 WeakPolarHBondContact O-CA 3.49Å; G45-S327 WeakPolarHBondContact O-CB 3.37Å; G45-S327 PolarHBondContact O-N 2.86Å; G49-S327 WeakPolarHBondContact CA-O 3.46Å; G49-S327 WeakPolarHBondContact CA-OG 3.48Å; G49-S327 PolarHBondContact N-OG 2.82Å; A323-S327 WeakPolarHBondContact O-CB 3.38Å; A323-S327 PolarHBondContact O-N 3.14Å; S324-S327 WeakPolarHBondContact O-CB 3.48Å; S324-S327 PolarHBondContact O-N 3.36Å; W325-S327 VanDerWaalsContact C-N 3.28Å; W325-S327 PolarHBondContact O-N 2.88Å; S327-L329 VanDerWaalsContact C-N 3.3Å; S327-L329 PolarHBondContact O-N 3.01Å; S327-G330 PolarHBondContact O-N 3.16Å; S327-F331 WeakPolarHBondContact O-CB 3.27Å; S327-F331 PolarHBondContact O-N 3.27Å
328I96Very high88.5Confident91 Ų9159.5 Ų59.547%0.46733%0.327SS..Hα-helixtrans-59.1-44.7173.8-66.3169.5000110.7S324 W325 F331 V332S324-I328 WeakPolarHBondContact O-CG1 3.5Å; S324-I328 PolarHBondContact O-N 3.2Å; W325-I328 HydrophobicContact CE3-CD1 4.06Å; W325-I328 HydrophobicContact CZ3-CD1 4.21Å; W325-I328 PolarHBondContact O-N 2.85Å; I328-F331 PolarHBondContact O-N 3.24Å; I328-V332 HydrophobicContact CG2-CG2 4.46Å; I328-V332 WeakPolarHBondContact O-CG2 3.27Å; I328-V332 PolarHBondContact O-N 3.48Å
329L92.2Very high88.4Confident101 Ų10160.6 Ų60.653%0.52932%0.32SS..Hα-helixtrans-60.9-47.5177.417864.4000111.5F46 W325 A326 S327 F331 V332 V333F46-L329 HydrophobicContact CD2-CD2 4.48Å; F46-L329 HydrophobicContact CD2-CG 4.37Å; F46-L329 HydrophobicContact CE2-CG 4.27Å; W325-L329 WeakPolarHBondContact O-CB 3.37Å; W325-L329 PolarHBondContact O-N 2.94Å; A326-L329 WeakPolarHBondContact O-CB 3.36Å; A326-L329 PolarHBondContact O-N 2.99Å; S327-L329 VanDerWaalsContact C-N 3.3Å; S327-L329 PolarHBondContact O-N 3.01Å; L329-F331 VanDerWaalsContact C-N 3.33Å; L329-F331 PolarHBondContact O-N 3.36Å; L329-V332 PolarHBondContact O-N 3.48Å; L329-V333 HydrophobicContact CD1-CG2 4.16Å; L329-V333 HydrophobicContact CG-CG2 4.42Å; L329-V333 WeakPolarHBondContact O-CB 3.35Å; L329-V333 VanDerWaalsContact O-CG2 3.25Å; L329-V333 WeakPolarHBondContact O-CG2 3.29Å; L329-V333 PolarHBondContact O-N 2.88Å
330G88Confident87.7Confident0 Ų062 Ų620%034%0.342CS..Hα-helixtrans-59.8-43.1177.400000112.4F46 V50 A326 S327 V333 M334F46-G330 VanDerWaalsContact CD2-CA 3.44Å; F46-G330 VanDerWaalsContact CE2-CA 3.41Å; V50-G330 WeakPolarHBondContact CG2-O 3.18Å; A326-G330 PolarHBondContact O-N 3.43Å; S327-G330 PolarHBondContact O-N 3.16Å; G330-V333 PolarHBondContact O-N 2.9Å; G330-M334 WeakPolarHBondContact O-CB 3.28Å; G330-M334 PolarHBondContact O-N 3Å
331F92.2Very high86.5Confident72 Ų7265.4 Ų65.432%0.31636%0.356SS..Hα-helixtrans-60.9-48.2176-171.4-79.7000111.7G49 L52 A53 W57 S327 I328 L329 M334 M335G49-F331 VanDerWaalsContact O-CA 3.32Å; G49-F331 WeakPolarHBondContact O-CA 3.41Å; L52-F331 HydrophobicContact CB-CD2 4.16Å; L52-F331 HydrophobicContact CB-CE2 4.34Å; A53-F331 HydrophobicContact CB-CB 4.49Å; A53-F331 HydrophobicContact CB-CD1 4.39Å; A53-F331 HydrophobicContact CB-CD2 3.66Å; A53-F331 HydrophobicContact CB-CE2 3.89Å; A53-F331 HydrophobicContact CB-CG 3.94Å; A53-F331 HydrophobicContact CB-CZ 4.36Å; W57-F331 AromaticContact CH2-CE1 3.61Å; W57-F331 HydrophobicContact CH2-CE1 3.61Å; W57-F331 AromaticContact CH2-CZ 3.59Å; W57-F331 HydrophobicContact CH2-CZ 3.59Å; W57-F331 HydrophobicContact CZ3-CD1 4.47Å; W57-F331 AromaticContact CZ3-CE1 3.57Å; W57-F331 HydrophobicContact CZ3-CE1 3.57Å; W57-F331 HydrophobicContact CZ3-CE2 4.08Å; W57-F331 AromaticContact CZ3-CZ 3.35Å; W57-F331 HydrophobicContact CZ3-CZ 3.35Å; S327-F331 WeakPolarHBondContact O-CB 3.27Å; S327-F331 PolarHBondContact O-N 3.27Å; I328-F331 PolarHBondContact O-N 3.24Å; L329-F331 VanDerWaalsContact C-N 3.33Å; L329-F331 PolarHBondContact O-N 3.36Å; F331-M334 PolarHBondContact O-N 2.91Å; F331-M335 VanDerWaalsContact O-CB 3.27Å; F331-M335 WeakPolarHBondContact O-CB 3.22Å; F331-M335 PolarHBondContact O-N 2.69Å
332V91.9Very high84.7Confident67 Ų6761 Ų6141%0.40636%0.362SS..Hα-helixtrans-64.1-42.6178.8170.10000111.4I328 L329 S336I328-V332 HydrophobicContact CG2-CG2 4.46Å; I328-V332 WeakPolarHBondContact O-CG2 3.27Å; I328-V332 PolarHBondContact O-N 3.48Å; L329-V332 PolarHBondContact O-N 3.48Å; V332-S336 VanDerWaalsContact O-CB 3.27Å; V332-S336 WeakPolarHBondContact O-CB 3.3Å; V332-S336 PolarHBondContact O-N 2.77Å; V332-S336 PolarHBondContact O-OG 3.25Å
333V86.1Confident84.4Confident54 Ų5460.2 Ų60.233%0.32736%0.359SS..Hα-helixtrans-60.2-50.7176.8167.40000110F46 L329 G330 S336 L337F46-V333 HydrophobicContact CE2-CG2 4.45Å; F46-V333 HydrophobicContact CZ-CG1 4.48Å; L329-V333 HydrophobicContact CD1-CG2 4.16Å; L329-V333 HydrophobicContact CG-CG2 4.42Å; L329-V333 WeakPolarHBondContact O-CB 3.35Å; L329-V333 VanDerWaalsContact O-CG2 3.25Å; L329-V333 WeakPolarHBondContact O-CG2 3.29Å; L329-V333 PolarHBondContact O-N 2.88Å; G330-V333 PolarHBondContact O-N 2.9Å; V333-S336 PolarHBondContact O-N 3.4Å; V333-L337 HydrophobicContact CG1-CD1 3.64Å; V333-L337 HydrophobicContact CG1-CG 4.46Å; V333-L337 WeakPolarHBondContact O-CB 3.32Å; V333-L337 VanDerWaalsContact O-CG 3.23Å; V333-L337 WeakPolarHBondContact O-CG 3.45Å; V333-L337 PolarHBondContact O-N 3.2Å
334M85.3Confident84.1Confident2 Ų263.2 Ų63.21%0.0138%0.377CS..Hα-helixtrans-63.5-46.8179.9-176.462.7-159.300112.1V50 A53 A54 S58 I239 Q240 G330 F331 S336 L337 D338V50-M334 HydrophobicContact CB-CB 4.31Å; V50-M334 HydrophobicContact CG1-CB 4.01Å; V50-M334 HydrophobicContact CG1-CG 4.01Å; V50-M334 HydrophobicContact CG1-SD 3.94Å; V50-M334 HydrophobicContact CG2-CB 4.35Å; A53-M334 HydrophobicContact CB-CB 3.7Å; A53-M334 HydrophobicContact CB-CG 3.74Å; A54-M334 HydrophobicContact CB-CE 3.72Å; A54-M334 HydrophobicContact CB-CG 4.02Å; A54-M334 HydrophobicContact CB-SD 4.28Å; S58-M334 VanDerWaalsContact OG-CE 3.3Å; S58-M334 WeakPolarHBondContact OG-CE 3.13Å; I239-M334 HydrophobicContact CG2-SD 3.95Å; Q240-M334 HydrophobicContact CB-CE 4.33Å; Q240-M334 HydrophobicContact CB-SD 4.18Å; G330-M334 WeakPolarHBondContact O-CB 3.28Å; G330-M334 PolarHBondContact O-N 3Å; F331-M334 PolarHBondContact O-N 2.91Å; M334-S336 VanDerWaalsContact C-N 3.29Å; M334-S336 PolarHBondContact O-N 3.14Å; M334-L337 PolarHBondContact O-N 3.17Å; M334-L337 VanDerWaalsContact O-N 3.16Å; M334-D338 HydrophobicContact CE-CB 4.4Å; M334-D338 WeakPolarHBondContact O-CB 3.37Å; M334-D338 PolarHBondContact O-N 2.78Å
335M88Confident83.6Confident64 Ų6463.8 Ų63.832%0.31538%0.377SS..Hα-helixtrans-56.2-43.9174.9-179-161.779.500111.6W57 F331 L337 D338 V339W57-M335 HydrophobicContact CD2-CG 4.31Å; W57-M335 HydrophobicContact CE3-CB 4.19Å; W57-M335 HydrophobicContact CE3-CG 4.25Å; W57-M335 HydrophobicContact CH2-CB 4.09Å; W57-M335 HydrophobicContact CH2-CG 3.61Å; W57-M335 HydrophobicContact CH2-SD 3.95Å; W57-M335 HydrophobicContact CZ2-CB 4.48Å; W57-M335 HydrophobicContact CZ2-CG 3.61Å; W57-M335 HydrophobicContact CZ2-SD 4.05Å; W57-M335 HydrophobicContact CZ3-CB 3.91Å; W57-M335 HydrophobicContact CZ3-CG 3.93Å; F331-M335 VanDerWaalsContact O-CB 3.27Å; F331-M335 WeakPolarHBondContact O-CB 3.22Å; F331-M335 PolarHBondContact O-N 2.69Å; M335-L337 VanDerWaalsContact C-N 3.32Å; M335-L337 PolarHBondContact O-N 2.61Å; M335-D338 PolarHBondContact O-N 2.94Å; M335-V339 HydrophobicContact CG-CG2 4.3Å; M335-V339 VanDerWaalsContact O-CB 3.3Å; M335-V339 WeakPolarHBondContact O-CB 3.47Å; M335-V339 VanDerWaalsContact O-CG2 3.29Å; M335-V339 WeakPolarHBondContact O-CG2 3.27Å; M335-V339 PolarHBondContact O-N 2.98Å
336S86.2Confident82.9Confident62 Ų6256.9 Ų56.943%0.43436%0.359SS..Hα-helixtrans-68-34.2-179.5-56.10000112V332 V333 M334 G340V332-S336 VanDerWaalsContact O-CB 3.27Å; V332-S336 WeakPolarHBondContact O-CB 3.3Å; V332-S336 PolarHBondContact O-N 2.77Å; V332-S336 PolarHBondContact O-OG 3.25Å; V333-S336 PolarHBondContact O-N 3.4Å; M334-S336 VanDerWaalsContact C-N 3.29Å; M334-S336 PolarHBondContact O-N 3.14Å; S336-G340 VanDerWaalsContact O-CA 3.24Å; S336-G340 WeakPolarHBondContact O-CA 3.38Å; S336-G340 PolarHBondContact O-N 3.29Å
337L77.1Confident82.4Confident53 Ų5359.5 Ų59.528%0.27737%0.374SS..Hα-helixtrans-72.6-44.2177.1-70.5166.9000110.9I239 V333 M334 M335 L341I239-L337 HydrophobicContact CD1-CB 4.11Å; I239-L337 HydrophobicContact CD1-CD1 4.12Å; I239-L337 HydrophobicContact CD1-CD2 4.24Å; I239-L337 HydrophobicContact CD1-CG 4.37Å; I239-L337 HydrophobicContact CG2-CD1 3.48Å; I239-L337 VanDerWaalsContact CG2-CD1 3.48Å; V333-L337 HydrophobicContact CG1-CD1 3.64Å; V333-L337 HydrophobicContact CG1-CG 4.46Å; V333-L337 WeakPolarHBondContact O-CB 3.32Å; V333-L337 VanDerWaalsContact O-CG 3.23Å; V333-L337 WeakPolarHBondContact O-CG 3.45Å; V333-L337 PolarHBondContact O-N 3.2Å; M334-L337 PolarHBondContact O-N 3.17Å; M334-L337 VanDerWaalsContact O-N 3.16Å; M335-L337 VanDerWaalsContact C-N 3.32Å; M335-L337 PolarHBondContact O-N 2.61Å; L337-L341 HydrophobicContact CB-CD1 4.4Å; L337-L341 HydrophobicContact CD2-CD1 3.76Å; L337-L341 WeakPolarHBondContact O-CB 3.43Å; L337-L341 WeakPolarHBondContact O-CG 3.42Å; L337-L341 PolarHBondContact O-N 2.99Å
338D74.3Confident81.7Confident33 Ų3362 Ų6218%0.17639%0.388CS..Hα-helixtrans-66.5-49.8178.1-165.7101.6000111.4W57 S58 M334 M335 G340 G342W57-D338 HydrophobicContact CB-CB 4.07Å; W57-D338 WeakPolarHBondContact CB-OD2 3.46Å; S58-D338 PolarHBondContact OG-OD1 3.47Å; M334-D338 HydrophobicContact CE-CB 4.4Å; M334-D338 WeakPolarHBondContact O-CB 3.37Å; M334-D338 PolarHBondContact O-N 2.78Å; M335-D338 PolarHBondContact O-N 2.94Å; D338-G340 PolarHBondContact O-N 3.18Å; D338-G342 WeakPolarHBondContact O-CA 3.48Å; D338-G342 PolarHBondContact O-N 2.63Å
339V78.6Confident80.7Confident93 Ų9359.9 Ų59.956%0.56438%0.383SS*.Hα-helixtrans-72.1-31.3179.3177.30000112.7M335M335-V339 HydrophobicContact CG-CG2 4.3Å; M335-V339 VanDerWaalsContact O-CB 3.3Å; M335-V339 WeakPolarHBondContact O-CB 3.47Å; M335-V339 VanDerWaalsContact O-CG2 3.29Å; M335-V339 WeakPolarHBondContact O-CG2 3.27Å; M335-V339 PolarHBondContact O-N 2.98Å
340G72.4Confident79.8Confident62 Ų6256.8 Ų56.864%0.63937%0.371SS*.Hα-helixtrans-87.4-25.6-175.700000114.5S336 D338S336-G340 VanDerWaalsContact O-CA 3.24Å; S336-G340 WeakPolarHBondContact O-CA 3.38Å; S336-G340 PolarHBondContact O-N 3.29Å; D338-G340 PolarHBondContact O-N 3.18Å
341L63.3Low79.1Confident89 Ų8961.5 Ų61.547%0.46640%0.402SS..Hα-helixtrans-110.1-15.6178.8-54.9173000113.1N232 I235 I239 L337N232-L341 PolarHBondContact ND2-O 2.95Å; I235-L341 HydrophobicContact CG2-CD1 4.29Å; I239-L341 HydrophobicContact CD1-CD1 4.06Å; L337-L341 HydrophobicContact CB-CD1 4.4Å; L337-L341 HydrophobicContact CD2-CD1 3.76Å; L337-L341 WeakPolarHBondContact O-CB 3.43Å; L337-L341 WeakPolarHBondContact O-CG 3.42Å; L337-L341 PolarHBondContact O-N 2.99Å
342G54.1Low77.9Confident87 Ų8760.5 Ų60.590%0.89741%0.41SS*.  trans-73.50179.400000113.7N232 D338N232-G342 PolarHBondContact ND2-OXT 3.38Å; D338-G342 WeakPolarHBondContact O-CA 3.48Å; D338-G342 PolarHBondContact O-N 2.63Å

Retrieved 342 of 342 residues in 114.3 ms (Link to these results)