A0A3Q0KDD4_SCHMA Loading...

Putative g-protein coupled receptor

AlphaFold DB , UniProt , Accession A0A3Q0KDD4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 407 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
1M37.3Very low58.2Low249 Ų249111.8 Ų111.8100%1.22761%0.61SS**  091.30-77.8168.3131.300108.4N3M1-N3 PolarHBondContact O-N 3.44Å
2S36.8Very low60.9Low121 Ų121105.1 Ų105.185%0.84658%0.575SS**  trans-72.8111.7177.315.60000108.9
3N38Very low63.3Low126 Ų126110.4 Ų110.467%0.67459%0.589SS**  trans-56.4120.2177.3-149.7-7.5000109.1M1 K5M1-N3 PolarHBondContact O-N 3.44Å; N3-K5 PolarHBondContact O-N 3.37Å
4P42.3Very low65.4Low100 Ų100104.3 Ų104.365%0.64956%0.555SS**  trans-78.573.4177.834-31.4000107.5G6P4-G6 PolarHBondContact O-N 3.06Å
5K47.4Very low67.2Low158 Ų15898.9 Ų98.969%0.68753%0.525SS*.  trans-7084.6164.1-73.1-170.5177.6-176.50106N3 I9N3-K5 PolarHBondContact O-N 3.37Å; K5-I9 HydrophobicContact CB-CD1 3.71Å
6G57.4Low68.8Low26 Ų2697.1 Ų97.127%0.26852%0.515SS..  trans-56.6161.8-178.300000112.2P4 L8 I9P4-G6 PolarHBondContact O-N 3.06Å; G6-L8 PolarHBondContact O-N 2.81Å; G6-I9 VanDerWaalsContact O-CD1 3.28Å; G6-I9 WeakPolarHBondContact O-CD1 3.39Å; G6-I9 VanDerWaalsContact O-CG1 3.22Å; G6-I9 WeakPolarHBondContact O-CG1 3.28Å
7C71.3Confident70.4Confident76 Ų7696.9 Ų96.951%0.51451%0.512SS..SBendtrans-68.610.2-168.287.30000116.3C90C7-C90 HydrophobicContact CB-CB 3.59Å; C7-C90 WeakPolarHBondContact CB-SG 3.31Å; C7-C90 PolarHBondContact N-SG 3.29Å; C7-C90 WeakPolarHBondContact SG-CB 3.38Å; C7-C90 CovalentContact SG-SG 2.01Å; C7-C90 PolarHBondContact SG-SG 2.96Å
8L74.6Confident71.8Confident51 Ų5191.6 Ų91.627%0.26748%0.484SS..  trans-121.240.4-168.8-62.4172.1000112.3G6 H10 L11 Y86G6-L8 PolarHBondContact O-N 2.81Å; L8-H10 PolarHBondContact O-N 3.24Å; L8-L11 HydrophobicContact CB-CD1 3.75Å; L8-L11 HydrophobicContact CB-CG 4.09Å; L8-L11 HydrophobicContact CD1-CD1 4.1Å; L8-L11 HydrophobicContact CD2-CD1 4.04Å; L8-L11 HydrophobicContact CD2-CD2 4.21Å; L8-L11 HydrophobicContact CD2-CG 4.32Å; L8-L11 HydrophobicContact CG-CD1 4.17Å; L8-Y86 HydrophobicContact CD1-CD2 3.53Å; L8-Y86 HydrophobicContact CD1-CE2 4.2Å; L8-Y86 HydrophobicContact CD1-CG 4.37Å
9I67.9Low72.9Confident105 Ų10589.7 Ų89.754%0.53847%0.47SS..THydrogen-bonded Turntrans-74-5.2-170.4-66.8150.6000113.7K5 G6K5-I9 HydrophobicContact CB-CD1 3.71Å; G6-I9 VanDerWaalsContact O-CD1 3.28Å; G6-I9 WeakPolarHBondContact O-CD1 3.39Å; G6-I9 VanDerWaalsContact O-CG1 3.22Å; G6-I9 WeakPolarHBondContact O-CG1 3.28Å
10H81.6Confident74.1Confident175 Ų17587.8 Ų87.881%0.8146%0.462SS*.THydrogen-bonded Turntrans-142.857.2179.4-72.8-76.6000112.7L8L8-H10 PolarHBondContact O-N 3.24Å
11L85.6Confident75.2Confident43 Ų4384.9 Ų84.923%0.22545%0.445CS..  trans-88.1137171.4-66.5174.2000111.4L8 E15 I16 Y19 Y86L8-L11 HydrophobicContact CB-CD1 3.75Å; L8-L11 HydrophobicContact CB-CG 4.09Å; L8-L11 HydrophobicContact CD1-CD1 4.1Å; L8-L11 HydrophobicContact CD2-CD1 4.04Å; L8-L11 HydrophobicContact CD2-CD2 4.21Å; L8-L11 HydrophobicContact CD2-CG 4.32Å; L8-L11 HydrophobicContact CG-CD1 4.17Å; L11-E15 HydrophobicContact CB-CB 4.2Å; L11-E15 HydrophobicContact CD2-CB 3.94Å; L11-E15 HydrophobicContact CD2-CG 4.48Å; L11-I16 HydrophobicContact CB-CD1 4.38Å; L11-I16 HydrophobicContact CB-CG1 3.79Å; L11-I16 HydrophobicContact CD1-CG1 4.3Å; L11-Y19 HydrophobicContact CD1-CD2 4.13Å; L11-Y19 HydrophobicContact CD2-CD2 4.15Å; L11-Y19 HydrophobicContact CD2-CE2 3.81Å; L11-Y86 HydrophobicContact CD1-CD2 4.28Å; L11-Y86 HydrophobicContact CD1-CE2 3.98Å
12T90.8Very high78Confident31 Ų3173.4 Ų73.419%0.1939%0.389CS..  trans-69.3160.5168.7540000111.1E14 E15 I16 K288T12-E14 WeakPolarHBondContact CB-OE2 3.13Å; T12-E14 PolarHBondContact O-N 3.46Å; T12-E15 PolarHBondContact N-OE2 3.39Å; T12-E15 PolarHBondContact O-N 3.36Å; T12-E15 WeakPolarHBondContact OG1-CB 3.34Å; T12-E15 WeakPolarHBondContact OG1-CG 3.37Å; T12-E15 PolarHBondContact OG1-N 3.36Å; T12-E15 PolarHBondContact OG1-OE2 3.41Å; T12-I16 WeakPolarHBondContact O-CG1 3.46Å; T12-I16 PolarHBondContact O-N 3.15Å; T12-K288 HydrophobicContact CG2-CD 4.19Å
13K92.3Very high80.8Confident174 Ų17467.9 Ų67.976%0.75735%0.35SS*.Hα-helixtrans-58.4-37-180-70.4-177.9179.7177.80111.5I16 M17K13-I16 PolarHBondContact O-N 2.98Å; K13-M17 PolarHBondContact O-N 3.29Å; K13-M17 VanDerWaalsContact O-N 3.08Å
14E92.6Very high83.6Confident25 Ų2568.1 Ų68.112%0.11734%0.343CS..Hα-helixtrans-69.6-41.9179.6-57.975-167.800111T12 M17 V18 Q289 Q292 Y293T12-E14 WeakPolarHBondContact CB-OE2 3.13Å; T12-E14 PolarHBondContact O-N 3.46Å; E14-M17 WeakPolarHBondContact O-CB 3.32Å; E14-M17 PolarHBondContact O-N 3.4Å; E14-V18 WeakPolarHBondContact O-CG2 3.45Å; E14-V18 PolarHBondContact O-N 2.99Å; E14-Q289 HydrophobicContact CG-CB 4.42Å; E14-Q289 HydrophobicContact CG-CG 4.11Å; E14-Q289 PolarHBondContact OE1-NE2 2.87Å; E14-Q292 HydrophobicContact CB-CB 3.73Å; E14-Q292 HydrophobicContact CB-CG 4.31Å; E14-Y293 HydrophobicContact CG-CE1 4.27Å; E14-Y293 HydrophobicContact CG-CE2 3.94Å
15E91.9Very high86.2Confident23 Ų2365.6 Ų65.611%0.10733%0.325CS..Hα-helixtrans-61.9-44.5172.6-77.5165.8153.700111.6L11 T12 M17 V18 Y19 K288 Q292L11-E15 HydrophobicContact CB-CB 4.2Å; L11-E15 HydrophobicContact CD2-CB 3.94Å; L11-E15 HydrophobicContact CD2-CG 4.48Å; T12-E15 PolarHBondContact N-OE2 3.39Å; T12-E15 PolarHBondContact O-N 3.36Å; T12-E15 WeakPolarHBondContact OG1-CB 3.34Å; T12-E15 WeakPolarHBondContact OG1-CG 3.37Å; T12-E15 PolarHBondContact OG1-N 3.36Å; T12-E15 PolarHBondContact OG1-OE2 3.41Å; E15-M17 PolarHBondContact O-N 3.36Å; E15-V18 PolarHBondContact O-N 3.07Å; E15-Y19 HydrophobicContact CB-CD2 4.21Å; E15-Y19 HydrophobicContact CB-CE2 4.21Å; E15-Y19 WeakPolarHBondContact O-CD2 3.31Å; E15-Y19 PolarHBondContact O-N 3.45Å; E15-K288 WeakPolarHBondContact OE1-CE 3.39Å; E15-K288 IonicContact OE1-NZ 3.8Å; E15-K288 PolarHBondContact OE1-NZ 3.27Å; E15-K288 VanDerWaalsContact OE1-NZ 3.12Å; E15-K288 WeakPolarHBondContact OE2-CE 3.48Å; E15-K288 IonicContact OE2-NZ 3.89Å; E15-K288 PolarHBondContact OE2-NZ 3.29Å; E15-Q292 HydrophobicContact CG-CG 3.79Å; E15-Q292 VanDerWaalsContact CG-NE2 3.32Å; E15-Q292 PolarHBondContact OE1-NE2 3.11Å
16I93.2Very high88.6Confident71 Ų7158.1 Ų58.136%0.36429%0.293SS..Hα-helixtrans-56.6-42.8176.3-68.2168.2000110.1L11 T12 K13 Y19 T20L11-I16 HydrophobicContact CB-CD1 4.38Å; L11-I16 HydrophobicContact CB-CG1 3.79Å; L11-I16 HydrophobicContact CD1-CG1 4.3Å; T12-I16 WeakPolarHBondContact O-CG1 3.46Å; T12-I16 PolarHBondContact O-N 3.15Å; K13-I16 PolarHBondContact O-N 2.98Å; I16-Y19 PolarHBondContact O-N 2.69Å; I16-T20 WeakPolarHBondContact O-CB 3.37Å; I16-T20 PolarHBondContact O-N 3.27Å; I16-T20 PolarHBondContact O-OG1 3.49Å
17M95Very high90.5Very high93 Ų9357.9 Ų57.946%0.45829%0.287SS..Hα-helixtrans-62.3-47.9178.5-165.3-178.7-59.700112K13 E14 E15 T20 F21 L296K13-M17 PolarHBondContact O-N 3.29Å; K13-M17 VanDerWaalsContact O-N 3.08Å; E14-M17 WeakPolarHBondContact O-CB 3.32Å; E14-M17 PolarHBondContact O-N 3.4Å; E15-M17 PolarHBondContact O-N 3.36Å; M17-T20 PolarHBondContact O-N 3.08Å; M17-F21 WeakPolarHBondContact O-CB 3.48Å; M17-F21 PolarHBondContact O-N 2.92Å; M17-L296 HydrophobicContact CG-CD1 4.1Å; M17-L296 HydrophobicContact CG-CD2 3.93Å; M17-L296 HydrophobicContact SD-CD2 3.29Å; M17-L296 WeakPolarHBondContact SD-CD2 3.4Å
18V95.5Very high91.8Very high1 Ų159 Ų591%0.00629%0.286CS..Hα-helixtrans-60.1-50.4177.3173.50000111.1E14 E15 F21 R22 Q292 K295 L296E14-V18 WeakPolarHBondContact O-CG2 3.45Å; E14-V18 PolarHBondContact O-N 2.99Å; E15-V18 PolarHBondContact O-N 3.07Å; V18-F21 PolarHBondContact O-N 3.42Å; V18-R22 WeakPolarHBondContact O-CB 3.43Å; V18-R22 VanDerWaalsContact O-CG 3.31Å; V18-R22 WeakPolarHBondContact O-CG 3.5Å; V18-R22 PolarHBondContact O-N 3.5Å; V18-Q292 HydrophobicContact CG2-CB 4.28Å; V18-Q292 WeakPolarHBondContact CG2-O 3.41Å; V18-K295 HydrophobicContact CG1-CB 4.26Å; V18-K295 HydrophobicContact CG2-CB 4.37Å; V18-L296 HydrophobicContact CG2-CB 3.85Å
19Y94.1Very high92.9Very high56 Ų5657 Ų5722%0.2228%0.276CS..Hα-helixtrans-67.8-37.4-178-75.6-65.5000112.4L11 E15 I16 R22 A23 R82 Y86L11-Y19 HydrophobicContact CD1-CD2 4.13Å; L11-Y19 HydrophobicContact CD2-CD2 4.15Å; L11-Y19 HydrophobicContact CD2-CE2 3.81Å; E15-Y19 HydrophobicContact CB-CD2 4.21Å; E15-Y19 HydrophobicContact CB-CE2 4.21Å; E15-Y19 WeakPolarHBondContact O-CD2 3.31Å; E15-Y19 PolarHBondContact O-N 3.45Å; I16-Y19 PolarHBondContact O-N 2.69Å; Y19-R22 PolarHBondContact O-N 3.5Å; Y19-A23 WeakPolarHBondContact O-CB 3.45Å; Y19-A23 PolarHBondContact O-N 3.17Å; Y19-R82 HydrophobicContact CD1-CB 4.34Å; Y19-R82 HydrophobicContact CE1-CB 4.02Å; Y19-Y86 HydrophobicContact CD2-CD2 4.5Å; Y19-Y86 AromaticContact CG-CD2 3.97Å; Y19-Y86 HydrophobicContact CG-CD2 3.97Å; Y19-Y86 HydrophobicContact CG-CG 4.32Å
20T95.4Very high94.3Very high51 Ų5152.6 Ų52.631%0.31325%0.254SS..Hα-helixtrans-62.8-45.5174.9-61.40000110.8I16 M17 A23 Y24 Y86I16-T20 WeakPolarHBondContact O-CB 3.37Å; I16-T20 PolarHBondContact O-N 3.27Å; I16-T20 PolarHBondContact O-OG1 3.49Å; M17-T20 PolarHBondContact O-N 3.08Å; T20-A23 PolarHBondContact O-N 3.48Å; T20-Y24 HydrophobicContact CG2-CD2 3.93Å; T20-Y24 HydrophobicContact CG2-CE2 4.42Å; T20-Y24 WeakPolarHBondContact O-CD2 3.3Å; T20-Y24 PolarHBondContact O-N 3.17Å; T20-Y86 PolarHBondContact OG1-OH 2.73Å
21F97.2Very high95.1Very high27 Ų2750.2 Ų50.212%0.11825%0.246CC..Iπ-helixtrans-59.5-50.2176.5-171.6-80.3000111.1M17 V18 A23 Y24 V25 S26 L29 L296 S299 V300 F303M17-F21 WeakPolarHBondContact O-CB 3.48Å; M17-F21 PolarHBondContact O-N 2.92Å; V18-F21 PolarHBondContact O-N 3.42Å; F21-A23 VanDerWaalsContact C-N 3.3Å; F21-A23 PolarHBondContact O-N 3.25Å; F21-Y24 PolarHBondContact O-N 2.95Å; F21-V25 HydrophobicContact CD1-CB 4.18Å; F21-V25 HydrophobicContact CD2-CB 3.94Å; F21-V25 HydrophobicContact CD2-CG1 4.17Å; F21-V25 HydrophobicContact CD2-CG2 3.92Å; F21-V25 HydrophobicContact CE1-CB 4.14Å; F21-V25 HydrophobicContact CE1-CG1 4.09Å; F21-V25 HydrophobicContact CE2-CB 3.91Å; F21-V25 HydrophobicContact CE2-CG1 3.63Å; F21-V25 HydrophobicContact CE2-CG2 4.18Å; F21-V25 HydrophobicContact CG-CB 4.07Å; F21-V25 HydrophobicContact CG-CG2 4.3Å; F21-V25 HydrophobicContact CZ-CB 4.02Å; F21-V25 HydrophobicContact CZ-CG1 3.58Å; F21-V25 WeakPolarHBondContact O-CA 3.42Å; F21-V25 WeakPolarHBondContact O-CB 3.48Å; F21-V25 PolarHBondContact O-N 2.91Å; F21-S26 PolarHBondContact O-N 2.81Å; F21-S26 VanDerWaalsContact O-N 3.08Å; F21-L29 HydrophobicContact CZ-CD1 4.39Å; F21-L296 HydrophobicContact CB-CD1 3.99Å; F21-L296 HydrophobicContact CD2-CD1 4.37Å; F21-L296 HydrophobicContact CG-CD1 4.23Å; F21-S299 WeakPolarHBondContact CE1-O 2.89Å; F21-V300 HydrophobicContact CD2-CG2 4.35Å; F21-V300 HydrophobicContact CE2-CG2 3.76Å; F21-V300 HydrophobicContact CZ-CG2 3.97Å; F21-F303 AromaticContact CE2-CE2 3.96Å; F21-F303 HydrophobicContact CE2-CE2 3.96Å; F21-F303 HydrophobicContact CZ-CD2 4.38Å; F21-F303 AromaticContact CZ-CE2 3.79Å; F21-F303 HydrophobicContact CZ-CE2 3.79Å
22R96.6Very high95.6Very high8 Ų851.3 Ų51.33%0.0325%0.251CS..Iπ-helixtrans-64.3-32.3-179.9-71.9177172-175.6-25.2113.6V18 Y19 S26 D78 S299V18-R22 WeakPolarHBondContact O-CB 3.43Å; V18-R22 VanDerWaalsContact O-CG 3.31Å; V18-R22 WeakPolarHBondContact O-CG 3.5Å; V18-R22 PolarHBondContact O-N 3.5Å; Y19-R22 PolarHBondContact O-N 3.5Å; R22-S26 WeakPolarHBondContact CA-OG 3.36Å; R22-D78 HydrophobicContact CB-CB 4.44Å; R22-D78 HydrophobicContact CG-CB 3.91Å; R22-D78 IonicContact CZ-OD1 3.12Å; R22-D78 IonicContact NE-OD1 2.98Å; R22-D78 PolarHBondContact NE-OD1 2.64Å; R22-D78 IonicContact NE-OD2 3.06Å; R22-D78 IonicContact NH2-OD1 2.78Å; R22-D78 PolarHBondContact NH2-OD1 2.74Å; R22-S299 PolarHBondContact NE-OG 3.07Å; R22-S299 VanDerWaalsContact NE-OG 3.11Å
23A95.9Very high96Very high5 Ų549.9 Ų49.94%0.04124%0.242CC..Iπ-helixtrans-76.9-36.9-18000000113.5Y19 T20 F21 P27 G83 Y86 A87Y19-A23 WeakPolarHBondContact O-CB 3.45Å; Y19-A23 PolarHBondContact O-N 3.17Å; T20-A23 PolarHBondContact O-N 3.48Å; F21-A23 VanDerWaalsContact C-N 3.3Å; F21-A23 PolarHBondContact O-N 3.25Å; A23-P27 WeakPolarHBondContact O-CG 3.42Å; A23-G83 WeakPolarHBondContact CB-O 3.46Å; A23-Y86 HydrophobicContact CB-CD1 3.77Å; A23-A87 HydrophobicContact CB-CB 4.1Å
24Y96.9Very high96.3Very high132 Ų13243.1 Ų43.152%0.51821%0.214SC..Iπ-helixtrans-119.6-35-168.9-60.1-67.1000114.3T20 F21 I28 Y86T20-Y24 HydrophobicContact CG2-CD2 3.93Å; T20-Y24 HydrophobicContact CG2-CE2 4.42Å; T20-Y24 WeakPolarHBondContact O-CD2 3.3Å; T20-Y24 PolarHBondContact O-N 3.17Å; F21-Y24 PolarHBondContact O-N 2.95Å; Y24-I28 WeakPolarHBondContact O-CD1 3.4Å; Y24-I28 WeakPolarHBondContact O-CG1 3.28Å; Y24-Y86 HydrophobicContact CE2-CE1 4.34Å
25V97.7Very high96.5Very high47 Ų4745 Ų4529%0.28523%0.229SC..Iπ-helixtrans-87.3-48.6-178.2-175.40000111F21 I28 L29 F303F21-V25 HydrophobicContact CD1-CB 4.18Å; F21-V25 HydrophobicContact CD2-CB 3.94Å; F21-V25 HydrophobicContact CD2-CG1 4.17Å; F21-V25 HydrophobicContact CD2-CG2 3.92Å; F21-V25 HydrophobicContact CE1-CB 4.14Å; F21-V25 HydrophobicContact CE1-CG1 4.09Å; F21-V25 HydrophobicContact CE2-CB 3.91Å; F21-V25 HydrophobicContact CE2-CG1 3.63Å; F21-V25 HydrophobicContact CE2-CG2 4.18Å; F21-V25 HydrophobicContact CG-CB 4.07Å; F21-V25 HydrophobicContact CG-CG2 4.3Å; F21-V25 HydrophobicContact CZ-CB 4.02Å; F21-V25 HydrophobicContact CZ-CG1 3.58Å; F21-V25 WeakPolarHBondContact O-CA 3.42Å; F21-V25 WeakPolarHBondContact O-CB 3.48Å; F21-V25 PolarHBondContact O-N 2.91Å; V25-I28 WeakPolarHBondContact O-CB 3.18Å; V25-I28 PolarHBondContact O-N 3.2Å; V25-I28 VanDerWaalsContact O-N 3.08Å; V25-L29 HydrophobicContact CG1-CD1 4.14Å; V25-L29 HydrophobicContact CG1-CG 4.26Å; V25-L29 PolarHBondContact O-N 2.88Å; V25-F303 HydrophobicContact CG1-CE2 4.34Å; V25-F303 HydrophobicContact CG1-CZ 4.02Å
26S97.4Very high96.8Very high0 Ų044.5 Ų44.50%023%0.228CC..Hα-helixtrans-52.1-47178.6-61.60000114.3F21 R22 I28 L29 V30F21-S26 PolarHBondContact O-N 2.81Å; F21-S26 VanDerWaalsContact O-N 3.08Å; R22-S26 WeakPolarHBondContact CA-OG 3.36Å; S26-I28 VanDerWaalsContact C-N 3.32Å; S26-I28 PolarHBondContact O-N 3.34Å; S26-L29 WeakPolarHBondContact O-CB 3.32Å; S26-L29 PolarHBondContact O-N 2.69Å; S26-V30 WeakPolarHBondContact O-CG2 3.27Å; S26-V30 PolarHBondContact O-N 3.41Å
27P97.2Very high97Very high22 Ų2241.1 Ų41.114%0.14321%0.21CC..Hα-helixtrans-64.6-33.7177.824.4-34.6000113.4A23 V30 I31 F79A23-P27 WeakPolarHBondContact O-CG 3.42Å; P27-V30 PolarHBondContact O-N 3.45Å; P27-I31 WeakPolarHBondContact O-CB 3.35Å; P27-I31 VanDerWaalsContact O-CG1 3.25Å; P27-I31 WeakPolarHBondContact O-CG1 3.16Å; P27-I31 PolarHBondContact O-N 3.29Å; P27-F79 HydrophobicContact CB-CD1 4.37Å; P27-F79 HydrophobicContact CB-CD2 3.83Å; P27-F79 HydrophobicContact CB-CE1 4.39Å; P27-F79 HydrophobicContact CB-CE2 3.86Å; P27-F79 HydrophobicContact CB-CG 4.09Å; P27-F79 HydrophobicContact CB-CZ 4.14Å; P27-F79 HydrophobicContact CG-CD2 3.71Å; P27-F79 HydrophobicContact CG-CE2 3.75Å; P27-F79 HydrophobicContact CG-CG 4.4Å; P27-F79 HydrophobicContact CG-CZ 4.47Å
28I97.9Very high97.2Very high99 Ų9941.2 Ų41.251%0.50821%0.212SC..Hα-helixtrans-64.6-44.7174.6-63.2171.3000109.7Y24 V25 S26 V30 I31 I32Y24-I28 WeakPolarHBondContact O-CD1 3.4Å; Y24-I28 WeakPolarHBondContact O-CG1 3.28Å; V25-I28 WeakPolarHBondContact O-CB 3.18Å; V25-I28 PolarHBondContact O-N 3.2Å; V25-I28 VanDerWaalsContact O-N 3.08Å; S26-I28 VanDerWaalsContact C-N 3.32Å; S26-I28 PolarHBondContact O-N 3.34Å; I28-V30 VanDerWaalsContact C-N 3.28Å; I28-V30 PolarHBondContact O-N 3.13Å; I28-I31 PolarHBondContact O-N 3.28Å; I28-I32 HydrophobicContact CG2-CD1 3.82Å; I28-I32 WeakPolarHBondContact O-CG1 3.26Å; I28-I32 PolarHBondContact O-N 3.25Å
29L97.8Very high97.2Very high8 Ų843.7 Ų43.74%0.04223%0.225CC..Hα-helixtrans-61.1-36.6176-67.5178.9000112.4F21 V25 S26 G33 F303 A306F21-L29 HydrophobicContact CZ-CD1 4.39Å; V25-L29 HydrophobicContact CG1-CD1 4.14Å; V25-L29 HydrophobicContact CG1-CG 4.26Å; V25-L29 PolarHBondContact O-N 2.88Å; S26-L29 WeakPolarHBondContact O-CB 3.32Å; S26-L29 PolarHBondContact O-N 2.69Å; L29-G33 VanDerWaalsContact O-CA 3.23Å; L29-G33 WeakPolarHBondContact O-CA 3.44Å; L29-G33 PolarHBondContact O-N 3.31Å; L29-F303 HydrophobicContact CD1-CD1 4.37Å; L29-F303 HydrophobicContact CD1-CD2 4.31Å; L29-F303 HydrophobicContact CD1-CE1 4.42Å; L29-F303 HydrophobicContact CD1-CE2 4.3Å; L29-F303 HydrophobicContact CD1-CG 4.35Å; L29-F303 HydrophobicContact CD1-CZ 4.36Å; L29-F303 HydrophobicContact CD2-CD1 3.62Å; L29-F303 HydrophobicContact CD2-CE1 3.59Å; L29-F303 HydrophobicContact CD2-CG 4.34Å; L29-F303 HydrophobicContact CD2-CZ 4.23Å; L29-F303 HydrophobicContact CG-CE1 4.5Å; L29-A306 HydrophobicContact CD2-CB 4.11Å
30V97.9Very high97.4Very high13 Ų1341 Ų418%0.07922%0.215CC..Hα-helixtrans-69.2-47.6176.5171.80000111.5S26 P27 I28 I32 G33 I34 T74 L75S26-V30 WeakPolarHBondContact O-CG2 3.27Å; S26-V30 PolarHBondContact O-N 3.41Å; P27-V30 PolarHBondContact O-N 3.45Å; I28-V30 VanDerWaalsContact C-N 3.28Å; I28-V30 PolarHBondContact O-N 3.13Å; V30-I32 PolarHBondContact O-N 2.95Å; V30-G33 PolarHBondContact O-N 3.4Å; V30-I34 HydrophobicContact CG1-CD1 3.62Å; V30-I34 HydrophobicContact CG1-CG1 4.25Å; V30-I34 PolarHBondContact O-N 3.19Å; V30-I34 VanDerWaalsContact O-N 3.09Å; V30-T74 HydrophobicContact CG2-CG2 3.71Å; V30-L75 HydrophobicContact CG1-CB 4.01Å; V30-L75 HydrophobicContact CG1-CD1 4.14Å; V30-L75 HydrophobicContact CG1-CD2 4.13Å; V30-L75 HydrophobicContact CG1-CG 4.31Å; V30-L75 HydrophobicContact CG2-CB 3.79Å
31I97.7Very high97.5Very high125 Ų12539.9 Ų39.964%0.64121%0.206SC*.Hα-helixtrans-61-36.4-179.1-71.1166.5000111.2P27 I28 P35P27-I31 WeakPolarHBondContact O-CB 3.35Å; P27-I31 VanDerWaalsContact O-CG1 3.25Å; P27-I31 WeakPolarHBondContact O-CG1 3.16Å; P27-I31 PolarHBondContact O-N 3.29Å; I28-I31 PolarHBondContact O-N 3.28Å; I31-P35 WeakPolarHBondContact O-CD 3.33Å; I31-P35 VanDerWaalsContact O-CG 3.23Å; I31-P35 WeakPolarHBondContact O-CG 3.3Å
32I97.6Very high97.5Very high67 Ų6742.4 Ų42.434%0.34422%0.221SC..Hα-helixtrans-83.6-51.5177.4-64.6173.5000110.4I28 V30 P35 S36 F310I28-I32 HydrophobicContact CG2-CD1 3.82Å; I28-I32 WeakPolarHBondContact O-CG1 3.26Å; I28-I32 PolarHBondContact O-N 3.25Å; V30-I32 PolarHBondContact O-N 2.95Å; I32-P35 WeakPolarHBondContact O-CD 3.48Å; I32-S36 WeakPolarHBondContact O-CB 3.23Å; I32-S36 PolarHBondContact O-N 3.22Å; I32-S36 PolarHBondContact O-OG 3.46Å; I32-S36 VanDerWaalsContact O-OG 3.04Å; I32-F310 HydrophobicContact CG2-CE2 3.59Å; I32-F310 HydrophobicContact CG2-CZ 3.58Å
33G97.9Very high97.5Very high0 Ų042 Ų420%022%0.219CC..Hα-helixtrans-66.3-43.5-168.100000114.3L29 V30 S36 N37L29-G33 VanDerWaalsContact O-CA 3.23Å; L29-G33 WeakPolarHBondContact O-CA 3.44Å; L29-G33 PolarHBondContact O-N 3.31Å; V30-G33 PolarHBondContact O-N 3.4Å; G33-S36 PolarHBondContact O-N 3.19Å; G33-N37 WeakPolarHBondContact O-CB 3.49Å; G33-N37 PolarHBondContact O-N 3.01Å; G33-N37 PolarHBondContact O-ND2 3.32Å
34I98.2Very high97.5Very high32 Ų3241.8 Ų41.816%0.16422%0.217CC..Hα-helixtrans-64.3-54.2-179.1-65.1178.3000110.8V30 S36 N37 L38 N67 L70 I71V30-I34 HydrophobicContact CG1-CD1 3.62Å; V30-I34 HydrophobicContact CG1-CG1 4.25Å; V30-I34 PolarHBondContact O-N 3.19Å; V30-I34 VanDerWaalsContact O-N 3.09Å; I34-S36 VanDerWaalsContact C-N 3.3Å; I34-S36 PolarHBondContact O-N 3.04Å; I34-N37 PolarHBondContact O-N 3.38Å; I34-L38 HydrophobicContact CG2-CD1 4.02Å; I34-L38 HydrophobicContact CG2-CG 4.47Å; I34-L38 VanDerWaalsContact O-CG 3.31Å; I34-L38 WeakPolarHBondContact O-CG 3.48Å; I34-L38 PolarHBondContact O-N 3.45Å; I34-N67 PolarHBondContact O-OD1 2.92Å; I34-L70 HydrophobicContact CG1-CB 3.99Å; I34-L70 HydrophobicContact CG1-CD1 4.38Å; I34-I71 HydrophobicContact CD1-CD1 4.45Å; I34-I71 HydrophobicContact CD1-CG1 3.58Å; I34-I71 HydrophobicContact CG1-CG1 4.31Å
35P98.1Very high97.4Very high66 Ų6639.8 Ų39.843%0.42921%0.214SC..Hα-helixtrans-58.8-40.7175.5-26.237.2000113I31 I32 L38 L39I31-P35 WeakPolarHBondContact O-CD 3.33Å; I31-P35 VanDerWaalsContact O-CG 3.23Å; I31-P35 WeakPolarHBondContact O-CG 3.3Å; I32-P35 WeakPolarHBondContact O-CD 3.48Å; P35-L38 PolarHBondContact O-N 3.23Å; P35-L39 WeakPolarHBondContact O-CG 3.48Å; P35-L39 PolarHBondContact O-N 3.08Å
36S97.7Very high97.2Very high11 Ų1138.8 Ų38.88%0.07721%0.207CC..Hα-helixtrans-59.9-47.8177.7-810000112.6I32 G33 I34 L39 V40I32-S36 WeakPolarHBondContact O-CB 3.23Å; I32-S36 PolarHBondContact O-N 3.22Å; I32-S36 PolarHBondContact O-OG 3.46Å; I32-S36 VanDerWaalsContact O-OG 3.04Å; G33-S36 PolarHBondContact O-N 3.19Å; I34-S36 VanDerWaalsContact C-N 3.3Å; I34-S36 PolarHBondContact O-N 3.04Å; S36-L39 WeakPolarHBondContact O-CB 3.49Å; S36-L39 PolarHBondContact O-N 3.48Å; S36-V40 WeakPolarHBondContact O-CG2 3.29Å; S36-V40 PolarHBondContact O-N 3.21Å
37N97.8Very high97Very high0 Ų039 Ų390%021%0.208CC..Hα-helixtrans-69.8-34178.4-76.7-39.3000112.6G33 I34 L39 V40 I41 A63 N67 L70 H305G33-N37 WeakPolarHBondContact O-CB 3.49Å; G33-N37 PolarHBondContact O-N 3.01Å; G33-N37 PolarHBondContact O-ND2 3.32Å; I34-N37 PolarHBondContact O-N 3.38Å; N37-L39 VanDerWaalsContact C-N 3.33Å; N37-V40 WeakPolarHBondContact O-CB 3.43Å; N37-V40 PolarHBondContact O-N 2.85Å; N37-I41 VanDerWaalsContact O-CG1 3.3Å; N37-I41 WeakPolarHBondContact O-CG1 3.13Å; N37-I41 PolarHBondContact O-N 2.74Å; N37-A63 HydrophobicContact CB-CB 4.43Å; N37-N67 VanDerWaalsContact CB-ND2 3.33Å; N37-N67 WeakPolarHBondContact CB-ND2 3.37Å; N37-N67 WeakPolarHBondContact CB-OD1 3.39Å; N37-L70 VanDerWaalsContact ND2-CD1 3.34Å; N37-L70 WeakPolarHBondContact ND2-CD1 3.2Å; N37-H305 PolarHBondContact ND2-O 3.08Å
38L97.9Very high96.7Very high95 Ų9538.9 Ų38.950%0.49721%0.206SC..Hα-helixtrans-62.4-40.7171.2-70174.3000111.7I34 P35 I41 L42I34-L38 HydrophobicContact CG2-CD1 4.02Å; I34-L38 HydrophobicContact CG2-CG 4.47Å; I34-L38 VanDerWaalsContact O-CG 3.31Å; I34-L38 WeakPolarHBondContact O-CG 3.48Å; I34-L38 PolarHBondContact O-N 3.45Å; P35-L38 PolarHBondContact O-N 3.23Å; L38-I41 PolarHBondContact O-N 3.45Å; L38-L42 WeakPolarHBondContact O-CB 3.42Å; L38-L42 PolarHBondContact O-N 3.33Å
39L97.1Very high96.3Very high54 Ų5441 Ų4128%0.28321%0.209SC..Hα-helixtrans-64.7-40.1173.1-74172.6000112P35 S36 N37 L42 V43 F309P35-L39 WeakPolarHBondContact O-CG 3.48Å; P35-L39 PolarHBondContact O-N 3.08Å; S36-L39 WeakPolarHBondContact O-CB 3.49Å; S36-L39 PolarHBondContact O-N 3.48Å; N37-L39 VanDerWaalsContact C-N 3.33Å; L39-L42 PolarHBondContact O-N 2.86Å; L39-V43 WeakPolarHBondContact O-CB 3.44Å; L39-V43 VanDerWaalsContact O-CG2 3.23Å; L39-V43 WeakPolarHBondContact O-CG2 3.39Å; L39-V43 PolarHBondContact O-N 2.79Å; L39-F309 HydrophobicContact CB-CD2 4.28Å; L39-F309 HydrophobicContact CB-CE2 4.14Å; L39-F309 HydrophobicContact CD1-CE2 4.27Å
40V97.7Very high95.7Very high0 Ų042.9 Ų42.90%022%0.217CC..Hα-helixtrans-57.4-49.6173.6169.30000110.7S36 N37 L42 V43 F44 A63 F309 Y312 F319S36-V40 WeakPolarHBondContact O-CG2 3.29Å; S36-V40 PolarHBondContact O-N 3.21Å; N37-V40 WeakPolarHBondContact O-CB 3.43Å; N37-V40 PolarHBondContact O-N 2.85Å; V40-L42 PolarHBondContact O-N 3.03Å; V40-V43 PolarHBondContact O-N 2.92Å; V40-F44 HydrophobicContact CG1-CD2 3.59Å; V40-F44 HydrophobicContact CG1-CE2 3.76Å; V40-F44 VanDerWaalsContact O-CD2 3.29Å; V40-F44 WeakPolarHBondContact O-CD2 3.14Å; V40-F44 PolarHBondContact O-N 2.94Å; V40-A63 HydrophobicContact CB-CB 4.28Å; V40-A63 HydrophobicContact CG1-CB 3.81Å; V40-F309 HydrophobicContact CG2-CB 3.71Å; V40-F309 HydrophobicContact CG2-CD2 3.92Å; V40-F309 HydrophobicContact CG2-CG 4.33Å; V40-Y312 HydrophobicContact CG1-CD2 4.03Å; V40-Y312 HydrophobicContact CG1-CE2 3.84Å; V40-Y312 HydrophobicContact CG2-CD2 3.96Å; V40-Y312 HydrophobicContact CG2-CE2 4.42Å; V40-F319 HydrophobicContact CG2-CE2 4.34Å; V40-F319 HydrophobicContact CG2-CZ 4.12Å
41I97.8Very high95.1Very high26 Ų2646.3 Ų46.313%0.13324%0.238CC..Hα-helixtrans-57.3-50.2177.2-67.7163.9000110.2N37 L38 V43 F44 I45 I60 A63 I64N37-I41 VanDerWaalsContact O-CG1 3.3Å; N37-I41 WeakPolarHBondContact O-CG1 3.13Å; N37-I41 PolarHBondContact O-N 2.74Å; L38-I41 PolarHBondContact O-N 3.45Å; I41-V43 PolarHBondContact O-N 2.62Å; I41-F44 PolarHBondContact O-N 3.44Å; I41-I45 HydrophobicContact CG2-CD1 3.59Å; I41-I45 HydrophobicContact CG2-CG1 4.36Å; I41-I45 WeakPolarHBondContact O-CB 3.48Å; I41-I45 WeakPolarHBondContact O-CG1 3.5Å; I41-I45 PolarHBondContact O-N 3.3Å; I41-I60 HydrophobicContact CG2-CG2 4.45Å; I41-A63 HydrophobicContact CD1-CB 4.18Å; I41-A63 HydrophobicContact CG1-CB 3.65Å; I41-I64 HydrophobicContact CD1-CG1 3.72Å; I41-I64 HydrophobicContact CG1-CG1 4.27Å
42L96.6Very high94.4Very high80 Ų8045.4 Ų45.442%0.41924%0.235SC..Hα-helixtrans-59.3-49.6-179.6-179.965.5000112.1L38 L39 V40 I45 I46 I326L38-L42 WeakPolarHBondContact O-CB 3.42Å; L38-L42 PolarHBondContact O-N 3.33Å; L39-L42 PolarHBondContact O-N 2.86Å; V40-L42 PolarHBondContact O-N 3.03Å; L42-I45 PolarHBondContact O-N 3.18Å; L42-I46 HydrophobicContact CD1-CD1 4.19Å; L42-I46 HydrophobicContact CG-CD1 4.03Å; L42-I46 WeakPolarHBondContact O-CD1 3.18Å; L42-I46 WeakPolarHBondContact O-CG1 3.34Å; L42-I46 PolarHBondContact O-N 3.17Å; L42-I46 VanDerWaalsContact O-N 3.08Å; L42-I326 HydrophobicContact CD2-CD1 4.26Å; L42-I326 HydrophobicContact CG-CD1 4.4Å
43V96.6Very high93.8Very high0 Ų042.3 Ų42.30%022%0.219CC..Hα-helixtrans-61.4-47.1-179.3171.30000110.5L39 V40 I41 I45 I46 I47 F319 T322 L323 I326L39-V43 WeakPolarHBondContact O-CB 3.44Å; L39-V43 VanDerWaalsContact O-CG2 3.23Å; L39-V43 WeakPolarHBondContact O-CG2 3.39Å; L39-V43 PolarHBondContact O-N 2.79Å; V40-V43 PolarHBondContact O-N 2.92Å; I41-V43 PolarHBondContact O-N 2.62Å; V43-I45 PolarHBondContact O-N 3.27Å; V43-I46 WeakPolarHBondContact O-CB 3.37Å; V43-I46 PolarHBondContact O-N 3.14Å; V43-I47 HydrophobicContact CG1-CD1 3.73Å; V43-I47 HydrophobicContact CG1-CG1 4.35Å; V43-I47 WeakPolarHBondContact O-CG1 3.24Å; V43-I47 PolarHBondContact O-N 3.43Å; V43-F319 HydrophobicContact CB-CD2 4.13Å; V43-F319 HydrophobicContact CB-CE2 3.66Å; V43-F319 HydrophobicContact CB-CZ 4.2Å; V43-F319 HydrophobicContact CG1-CD2 3.39Å; V43-F319 HydrophobicContact CG1-CE2 3.47Å; V43-F319 VanDerWaalsContact CG1-CE2 3.47Å; V43-F319 HydrophobicContact CG1-CG 4.07Å; V43-F319 HydrophobicContact CG1-CZ 4.21Å; V43-F319 HydrophobicContact CG2-CE2 4.14Å; V43-F319 HydrophobicContact CG2-CZ 4.18Å; V43-T322 HydrophobicContact CG1-CG2 3.99Å; V43-L323 HydrophobicContact CG2-CB 4.42Å; V43-L323 HydrophobicContact CG2-CD1 3.97Å; V43-I326 HydrophobicContact CG2-CD1 3.56Å
44F96.5Very high93.5Very high0 Ų042.9 Ų42.90%022%0.221CC..Hα-helixtrans-71-29.3-179.7-78-62.1000113.5V40 I41 I46 I47 E48 F55 N56 A59 I60 Y312 M316 F319V40-F44 HydrophobicContact CG1-CD2 3.59Å; V40-F44 HydrophobicContact CG1-CE2 3.76Å; V40-F44 VanDerWaalsContact O-CD2 3.29Å; V40-F44 WeakPolarHBondContact O-CD2 3.14Å; V40-F44 PolarHBondContact O-N 2.94Å; I41-F44 PolarHBondContact O-N 3.44Å; F44-I46 VanDerWaalsContact C-N 3.32Å; F44-I47 HydrophobicContact CD1-CD1 4.05Å; F44-I47 HydrophobicContact CE1-CD1 4.23Å; F44-I47 PolarHBondContact O-N 3.04Å; F44-E48 WeakPolarHBondContact O-CB 3.26Å; F44-E48 PolarHBondContact O-N 2.99Å; F44-F55 AromaticContact CE1-CD1 3.99Å; F44-F55 HydrophobicContact CE1-CD1 3.99Å; F44-F55 AromaticContact CE1-CE1 3.67Å; F44-F55 HydrophobicContact CE1-CE1 3.67Å; F44-F55 HydrophobicContact CZ-CD1 4.45Å; F44-F55 AromaticContact CZ-CE1 3.73Å; F44-F55 HydrophobicContact CZ-CE1 3.73Å; F44-N56 HydrophobicContact CB-CB 4.38Å; F44-N56 HydrophobicContact CD1-CB 4.01Å; F44-N56 WeakPolarHBondContact CD1-OD1 3.34Å; F44-A59 HydrophobicContact CD1-CB 4.44Å; F44-A59 HydrophobicContact CD2-CB 3.61Å; F44-A59 HydrophobicContact CE1-CB 4.4Å; F44-A59 HydrophobicContact CE2-CB 3.55Å; F44-A59 HydrophobicContact CG-CB 4.08Å; F44-A59 HydrophobicContact CZ-CB 3.98Å; F44-I60 HydrophobicContact CB-CD1 3.98Å; F44-I60 HydrophobicContact CB-CG1 3.55Å; F44-Y312 HydrophobicContact CE2-CD1 4.21Å; F44-Y312 AromaticContact CE2-CD2 3.86Å; F44-Y312 HydrophobicContact CE2-CD2 3.86Å; F44-Y312 HydrophobicContact CE2-CE1 4.22Å; F44-Y312 AromaticContact CE2-CE2 3.88Å; F44-Y312 HydrophobicContact CE2-CE2 3.88Å; F44-Y312 HydrophobicContact CE2-CG 4.05Å; F44-Y312 AromaticContact CZ-CD1 3.95Å; F44-Y312 HydrophobicContact CZ-CD1 3.95Å; F44-Y312 HydrophobicContact CZ-CD2 4.4Å; F44-Y312 HydrophobicContact CZ-CE1 4.09Å; F44-Y312 HydrophobicContact CZ-CG 4.14Å; F44-M316 HydrophobicContact CE1-CE 3.91Å; F44-M316 HydrophobicContact CE1-SD 3.92Å; F44-M316 HydrophobicContact CZ-CE 4.5Å; F44-M316 HydrophobicContact CZ-SD 3.91Å; F44-F319 HydrophobicContact CD2-CE2 4.3Å; F44-F319 HydrophobicContact CE1-CD2 4.38Å; F44-F319 AromaticContact CE2-CD2 3.89Å; F44-F319 HydrophobicContact CE2-CD2 3.89Å; F44-F319 AromaticContact CE2-CE2 3.88Å; F44-F319 HydrophobicContact CE2-CE2 3.88Å; F44-F319 AromaticContact CZ-CD2 3.81Å; F44-F319 HydrophobicContact CZ-CD2 3.81Å; F44-F319 HydrophobicContact CZ-CE2 4.29Å
45I95.1Very high93.2Very high90 Ų9041.3 Ų41.346%0.46221%0.213SC..Hα-helixtrans-61.9-43.3169.5-73.3168.5000110.4I41 L42 V43 E48 Y49 I60I41-I45 HydrophobicContact CG2-CD1 3.59Å; I41-I45 HydrophobicContact CG2-CG1 4.36Å; I41-I45 WeakPolarHBondContact O-CB 3.48Å; I41-I45 WeakPolarHBondContact O-CG1 3.5Å; I41-I45 PolarHBondContact O-N 3.3Å; L42-I45 PolarHBondContact O-N 3.18Å; V43-I45 PolarHBondContact O-N 3.27Å; I45-E48 PolarHBondContact O-N 3.44Å; I45-Y49 PolarHBondContact O-N 3.38Å; I45-I60 HydrophobicContact CG1-CD1 3.97Å; I45-I60 HydrophobicContact CG1-CG1 4.48Å
46I93.7Very high92.9Very high26 Ų2638.2 Ų38.213%0.13319%0.193CC..Hα-helixtrans-65.1-45.2177.7-67156.7000110.8L42 V43 F44 E48 Y49 Q50 T322 I326 I331L42-I46 HydrophobicContact CD1-CD1 4.19Å; L42-I46 HydrophobicContact CG-CD1 4.03Å; L42-I46 WeakPolarHBondContact O-CD1 3.18Å; L42-I46 WeakPolarHBondContact O-CG1 3.34Å; L42-I46 PolarHBondContact O-N 3.17Å; L42-I46 VanDerWaalsContact O-N 3.08Å; V43-I46 WeakPolarHBondContact O-CB 3.37Å; V43-I46 PolarHBondContact O-N 3.14Å; F44-I46 VanDerWaalsContact C-N 3.32Å; I46-E48 VanDerWaalsContact C-N 3.33Å; I46-Y49 PolarHBondContact O-N 2.99Å; I46-Q50 WeakPolarHBondContact O-CG 3.48Å; I46-Q50 PolarHBondContact O-N 2.96Å; I46-T322 HydrophobicContact CB-CG2 4.14Å; I46-T322 HydrophobicContact CG2-CG2 3.73Å; I46-I326 HydrophobicContact CD1-CD1 3.68Å; I46-I326 HydrophobicContact CD1-CG1 3.83Å; I46-I331 HydrophobicContact CD1-CD1 3.85Å; I46-I331 HydrophobicContact CG2-CD1 4.2Å; I46-I331 HydrophobicContact CG2-CG2 4.45Å
47I92.5Very high92.8Very high4 Ų438.1 Ų38.12%0.02119%0.192CC..Hα-helixtrans-63.2-41.9177.4-63.9169.5000110.2V43 F44 Y49 Q50 T51 N56 T318 T322V43-I47 HydrophobicContact CG1-CD1 3.73Å; V43-I47 HydrophobicContact CG1-CG1 4.35Å; V43-I47 WeakPolarHBondContact O-CG1 3.24Å; V43-I47 PolarHBondContact O-N 3.43Å; F44-I47 HydrophobicContact CD1-CD1 4.05Å; F44-I47 HydrophobicContact CE1-CD1 4.23Å; F44-I47 PolarHBondContact O-N 3.04Å; I47-Y49 VanDerWaalsContact C-N 3.33Å; I47-Y49 PolarHBondContact O-N 3.1Å; I47-Q50 PolarHBondContact O-N 2.85Å; I47-Q50 VanDerWaalsContact O-N 3.11Å; I47-T51 PolarHBondContact O-N 3.02Å; I47-T51 PolarHBondContact O-OG1 3.45Å; I47-N56 WeakPolarHBondContact CG2-ND2 3.34Å; I47-T318 HydrophobicContact CD1-CG2 4.14Å; I47-T318 HydrophobicContact CG1-CG2 4.44Å; I47-T318 HydrophobicContact CG2-CG2 4.48Å; I47-T322 HydrophobicContact CG1-CG2 3.99Å; I47-T322 WeakPolarHBondContact CG1-OG1 3.17Å
48E91.6Very high92.7Very high21 Ų2138.6 Ų38.610%0.09819%0.193CC..Hα-helixtrans-62.4-41.6179.1-173.763.6-17400111.4F44 I45 I46 Q50 T51 N52 C53 N56 L57F44-E48 WeakPolarHBondContact O-CB 3.26Å; F44-E48 PolarHBondContact O-N 2.99Å; I45-E48 PolarHBondContact O-N 3.44Å; I46-E48 VanDerWaalsContact C-N 3.33Å; E48-Q50 PolarHBondContact O-N 3.34Å; E48-T51 CarbonylContact O-C 3.2Å; E48-T51 VanDerWaalsContact O-C 3.29Å; E48-T51 PolarHBondContact O-N 3Å; E48-N52 PolarHBondContact O-N 3.03Å; E48-N52 PolarHBondContact O-OD1 3.49Å; E48-N52 WeakPolarHBondContact OE1-CA 3.32Å; E48-C53 PolarHBondContact OE1-N 2.88Å; E48-C53 PolarHBondContact OE2-N 3.49Å; E48-N56 HydrophobicContact CB-CB 4.23Å; E48-N56 VanDerWaalsContact OE2-CB 3.31Å; E48-N56 WeakPolarHBondContact OE2-CB 3.37Å; E48-N56 PolarHBondContact OE2-ND2 3.39Å; E48-L57 HydrophobicContact CG-CD2 4.37Å
49Y88.7Confident92.6Very high143 Ų14334 Ų3456%0.56117%0.17SC*.Hα-helixtrans-61-32.8175.4-172.3-100.5000113.1I45 I46 I47I45-Y49 PolarHBondContact O-N 3.38Å; I46-Y49 PolarHBondContact O-N 2.99Å; I47-Y49 VanDerWaalsContact C-N 3.33Å; I47-Y49 PolarHBondContact O-N 3.1Å
50Q85.4Confident92.6Very high48 Ų4832.5 Ų32.522%0.22416%0.162CC..Hα-helixtrans-79.9-43.7178.2-68177.9-0.400112I46 I47 E48I46-Q50 WeakPolarHBondContact O-CG 3.48Å; I46-Q50 PolarHBondContact O-N 2.96Å; I47-Q50 PolarHBondContact O-N 2.85Å; I47-Q50 VanDerWaalsContact O-N 3.11Å; E48-Q50 PolarHBondContact O-N 3.34Å
51T84.3Confident92.6Very high85 Ų8536.7 Ų36.752%0.52118%0.178SC..SBendtrans-143.7105.5-175.954.10000109.3I47 E48 C53 N56I47-T51 PolarHBondContact O-N 3.02Å; I47-T51 PolarHBondContact O-OG1 3.45Å; E48-T51 CarbonylContact O-C 3.2Å; E48-T51 VanDerWaalsContact O-C 3.29Å; E48-T51 PolarHBondContact O-N 3Å; T51-C53 PolarHBondContact O-N 3.29Å; T51-C53 VanDerWaalsContact O-N 3.09Å; T51-N56 PolarHBondContact O-ND2 2.94Å
52N82.9Confident92.5Very high105 Ų10535.5 Ų35.556%0.56117%0.171SC*.  trans-62.6113.5176.7-68.4-19.5000109.6E48 V145E48-N52 PolarHBondContact O-N 3.03Å; E48-N52 PolarHBondContact O-OD1 3.49Å; E48-N52 WeakPolarHBondContact OE1-CA 3.32Å; N52-V145 HydrophobicContact CB-CG1 4.34Å; N52-V145 HydrophobicContact CB-CG2 4.13Å
53C86.6Confident92.6Very high3 Ų331.7 Ų31.72%0.0215%0.151CC..  trans-140.6129.5-173.8-179.50000110.5E48 T51 F55 N56 Q141E48-C53 PolarHBondContact OE1-N 2.88Å; E48-C53 PolarHBondContact OE2-N 3.49Å; T51-C53 PolarHBondContact O-N 3.29Å; T51-C53 VanDerWaalsContact O-N 3.09Å; C53-F55 PolarHBondContact O-N 3.35Å; C53-F55 VanDerWaalsContact O-N 3.11Å; C53-F55 VanDerWaalsContact SG-CB 3.56Å; C53-N56 WeakPolarHBondContact CB-ND2 3.42Å; C53-N56 PolarHBondContact O-N 3.26Å; C53-Q141 HydrophobicContact CB-CG 4.47Å; C53-Q141 WeakPolarHBondContact SG-CG 3.48Å; C53-Q141 PolarHBondContact SG-OE1 2.95Å
54R90.5Very high92.6Very high11 Ų1134.6 Ų34.64%0.04217%0.166CC..Hα-helixtrans-54.3-35.4178.5-61.7-179.7-74149.512.5112.9N56 L57 Y58 D128 S132 V145 A148R54-N56 VanDerWaalsContact C-N 3.35Å; R54-N56 PolarHBondContact O-N 3.36Å; R54-L57 PolarHBondContact O-N 2.71Å; R54-Y58 HydrophobicContact CB-CE2 4.11Å; R54-Y58 WeakPolarHBondContact O-CD2 3.37Å; R54-Y58 WeakPolarHBondContact O-CE2 3.25Å; R54-Y58 PolarHBondContact O-N 2.95Å; R54-D128 IonicContact CZ-OD1 3Å; R54-D128 IonicContact NE-OD1 2.7Å; R54-D128 IonicContact NH1-OD1 2.84Å; R54-D128 PolarHBondContact NH1-OD1 2.95Å; R54-D128 IonicContact NH2-OD1 3.37Å; R54-D128 PolarHBondContact NH2-OD1 3.48Å; R54-S132 PolarHBondContact NH2-OG 3.45Å; R54-V145 HydrophobicContact CG-CG2 4.18Å; R54-A148 HydrophobicContact CB-CB 4.22Å; R54-A148 HydrophobicContact CG-CB 3.8Å
55F91.3Very high92.7Very high0 Ų034.8 Ų34.80%017%0.168CC..Hα-helixtrans-55.7-46.8176.9-179-79.3000112.3F44 C53 L57 Y58 A59 F125 K246 Y312 M316F44-F55 AromaticContact CE1-CD1 3.99Å; F44-F55 HydrophobicContact CE1-CD1 3.99Å; F44-F55 AromaticContact CE1-CE1 3.67Å; F44-F55 HydrophobicContact CE1-CE1 3.67Å; F44-F55 HydrophobicContact CZ-CD1 4.45Å; F44-F55 AromaticContact CZ-CE1 3.73Å; F44-F55 HydrophobicContact CZ-CE1 3.73Å; C53-F55 PolarHBondContact O-N 3.35Å; C53-F55 VanDerWaalsContact O-N 3.11Å; C53-F55 VanDerWaalsContact SG-CB 3.56Å; F55-L57 VanDerWaalsContact C-N 3.28Å; F55-L57 PolarHBondContact O-N 3.19Å; F55-Y58 PolarHBondContact O-N 3.42Å; F55-A59 PolarHBondContact O-N 3.35Å; F55-A59 VanDerWaalsContact O-N 3.1Å; F55-F125 HydrophobicContact CD1-CZ 4.49Å; F55-F125 AromaticContact CD2-CE2 3.39Å; F55-F125 HydrophobicContact CD2-CE2 3.39Å; F55-F125 AromaticContact CD2-CZ 3.34Å; F55-F125 HydrophobicContact CD2-CZ 3.34Å; F55-F125 HydrophobicContact CE1-CZ 4.4Å; F55-F125 HydrophobicContact CE2-CE1 4.4Å; F55-F125 AromaticContact CE2-CE2 3.72Å; F55-F125 HydrophobicContact CE2-CE2 3.72Å; F55-F125 AromaticContact CE2-CZ 3.25Å; F55-F125 HydrophobicContact CE2-CZ 3.25Å; F55-F125 HydrophobicContact CG-CE2 4.11Å; F55-F125 AromaticContact CG-CZ 3.98Å; F55-F125 HydrophobicContact CG-CZ 3.98Å; F55-F125 AromaticContact CZ-CZ 3.81Å; F55-F125 HydrophobicContact CZ-CZ 3.81Å; F55-K246 HydrophobicContact CB-CD 4.48Å; F55-K246 HydrophobicContact CD1-CD 4.5Å; F55-K246 HydrophobicContact CD1-CG 4.46Å; F55-K246 HydrophobicContact CD2-CB 3.79Å; F55-K246 HydrophobicContact CD2-CD 3.96Å; F55-K246 HydrophobicContact CD2-CG 3.88Å; F55-K246 HydrophobicContact CE1-CG 4.33Å; F55-K246 HydrophobicContact CE2-CB 3.45Å; F55-K246 VanDerWaalsContact CE2-CB 3.45Å; F55-K246 HydrophobicContact CE2-CD 4.31Å; F55-K246 HydrophobicContact CE2-CG 3.7Å; F55-K246 HydrophobicContact CG-CD 4.08Å; F55-K246 HydrophobicContact CG-CG 4.28Å; F55-K246 HydrophobicContact CZ-CB 4.1Å; F55-K246 HydrophobicContact CZ-CG 3.97Å; F55-Y312 HydrophobicContact CE1-CE1 4.33Å; F55-Y312 HydrophobicContact CZ-CE1 4.09Å; F55-M316 HydrophobicContact CD1-CE 4.35Å; F55-M316 HydrophobicContact CE1-CE 3.98Å; F55-M316 HydrophobicContact CE1-SD 3.67Å; F55-M316 HydrophobicContact CZ-SD 3.97Å
56N93.3Very high92.8Very high1 Ų131.2 Ų31.21%0.00515%0.149CC..Hα-helixtrans-64.7-38.1-175.6-57-23.6000110.6F44 I47 E48 T51 C53 R54 A59 I60F44-N56 HydrophobicContact CB-CB 4.38Å; F44-N56 HydrophobicContact CD1-CB 4.01Å; F44-N56 WeakPolarHBondContact CD1-OD1 3.34Å; I47-N56 WeakPolarHBondContact CG2-ND2 3.34Å; E48-N56 HydrophobicContact CB-CB 4.23Å; E48-N56 VanDerWaalsContact OE2-CB 3.31Å; E48-N56 WeakPolarHBondContact OE2-CB 3.37Å; E48-N56 PolarHBondContact OE2-ND2 3.39Å; T51-N56 PolarHBondContact O-ND2 2.94Å; C53-N56 WeakPolarHBondContact CB-ND2 3.42Å; C53-N56 PolarHBondContact O-N 3.26Å; R54-N56 VanDerWaalsContact C-N 3.35Å; R54-N56 PolarHBondContact O-N 3.36Å; N56-A59 PolarHBondContact O-N 3.27Å; N56-I60 WeakPolarHBondContact O-CD1 3.49Å; N56-I60 VanDerWaalsContact O-CG1 3.22Å; N56-I60 WeakPolarHBondContact O-CG1 3.45Å; N56-I60 PolarHBondContact O-N 3.36Å
57L94.5Very high93.1Very high8 Ų830.5 Ų30.54%0.04215%0.146CC..Hα-helixtrans-61.8-47.6177.5-60175.2000112E48 R54 F55 A59 I60 W61 V145 A148 H149 I152E48-L57 HydrophobicContact CG-CD2 4.37Å; R54-L57 PolarHBondContact O-N 2.71Å; F55-L57 VanDerWaalsContact C-N 3.28Å; F55-L57 PolarHBondContact O-N 3.19Å; L57-A59 VanDerWaalsContact C-N 3.31Å; L57-A59 PolarHBondContact O-N 3.06Å; L57-I60 PolarHBondContact O-N 2.96Å; L57-W61 VanDerWaalsContact O-CD1 3.25Å; L57-W61 PolarHBondContact O-N 3.27Å; L57-W61 VanDerWaalsContact O-N 3.07Å; L57-V145 HydrophobicContact CD1-CG1 3.84Å; L57-A148 HydrophobicContact CD1-CB 4.25Å; L57-H149 WeakPolarHBondContact CD1-CE1 3.45Å; L57-H149 WeakPolarHBondContact CD1-ND1 3.21Å; L57-H149 WeakPolarHBondContact CD2-CE1 3.35Å; L57-H149 WeakPolarHBondContact CD2-NE2 3.24Å; L57-I152 HydrophobicContact CB-CD1 3.98Å
58Y95.6Very high93.3Very high10 Ų1033.2 Ų33.24%0.03916%0.159CC..Hα-helixtrans-59.9-44176.9-62.4-58.4000111.1R54 F55 W61 M62 I121 L124 F125 D128 I152R54-Y58 HydrophobicContact CB-CE2 4.11Å; R54-Y58 WeakPolarHBondContact O-CD2 3.37Å; R54-Y58 WeakPolarHBondContact O-CE2 3.25Å; R54-Y58 PolarHBondContact O-N 2.95Å; F55-Y58 PolarHBondContact O-N 3.42Å; Y58-W61 PolarHBondContact O-N 3.41Å; Y58-M62 WeakPolarHBondContact O-CB 3.26Å; Y58-M62 PolarHBondContact O-N 3.13Å; Y58-I121 HydrophobicContact CD1-CG2 4.24Å; Y58-L124 HydrophobicContact CE1-CB 4.03Å; Y58-L124 HydrophobicContact CE1-CD1 4.46Å; Y58-F125 HydrophobicContact CD2-CB 4.45Å; Y58-F125 AromaticContact CD2-CD2 3.93Å; Y58-F125 HydrophobicContact CD2-CD2 3.93Å; Y58-F125 HydrophobicContact CD2-CE2 4.41Å; Y58-F125 HydrophobicContact CD2-CG 4.29Å; Y58-F125 HydrophobicContact CG-CB 4.26Å; Y58-F125 HydrophobicContact CG-CD2 4.38Å; Y58-F125 HydrophobicContact CG-CG 4.3Å; Y58-D128 HydrophobicContact CE2-CB 3.86Å; Y58-I152 HydrophobicContact CD1-CD1 3.57Å; Y58-I152 HydrophobicContact CD1-CG1 3.87Å; Y58-I152 HydrophobicContact CE1-CD1 3.6Å; Y58-I152 HydrophobicContact CE1-CG1 3.62Å; Y58-I152 HydrophobicContact CG-CD1 4.44Å
59A96Very high93.6Very high0 Ų032.4 Ų32.40%016%0.156CC..Hα-helixtrans-64-41.3178.900000112.9F44 F55 N56 L57 A63F44-A59 HydrophobicContact CD1-CB 4.44Å; F44-A59 HydrophobicContact CD2-CB 3.61Å; F44-A59 HydrophobicContact CE1-CB 4.4Å; F44-A59 HydrophobicContact CE2-CB 3.55Å; F44-A59 HydrophobicContact CG-CB 4.08Å; F44-A59 HydrophobicContact CZ-CB 3.98Å; F55-A59 PolarHBondContact O-N 3.35Å; F55-A59 VanDerWaalsContact O-N 3.1Å; N56-A59 PolarHBondContact O-N 3.27Å; L57-A59 VanDerWaalsContact C-N 3.31Å; L57-A59 PolarHBondContact O-N 3.06Å; A59-A63 WeakPolarHBondContact O-CB 3.31Å; A59-A63 PolarHBondContact O-N 2.81Å
60I97Very high94Very high22 Ų2225.6 Ų25.611%0.11313%0.129CC..Hα-helixtrans-61.9-52.5176.8-69.4162.2000110.4I41 F44 I45 N56 L57 M62 A63 I64I41-I60 HydrophobicContact CG2-CG2 4.45Å; F44-I60 HydrophobicContact CB-CD1 3.98Å; F44-I60 HydrophobicContact CB-CG1 3.55Å; I45-I60 HydrophobicContact CG1-CD1 3.97Å; I45-I60 HydrophobicContact CG1-CG1 4.48Å; N56-I60 WeakPolarHBondContact O-CD1 3.49Å; N56-I60 VanDerWaalsContact O-CG1 3.22Å; N56-I60 WeakPolarHBondContact O-CG1 3.45Å; N56-I60 PolarHBondContact O-N 3.36Å; L57-I60 PolarHBondContact O-N 2.96Å; I60-M62 VanDerWaalsContact C-N 3.33Å; I60-M62 PolarHBondContact O-N 3.09Å; I60-A63 PolarHBondContact O-N 2.81Å; I60-I64 HydrophobicContact CG2-CD1 3.95Å; I60-I64 WeakPolarHBondContact O-CG1 3.33Å; I60-I64 PolarHBondContact O-N 2.7Å
61W97.4Very high94.6Very high88 Ų8826.6 Ų26.633%0.33314%0.135SC..Hα-helixtrans-67-35.1-177.5-77105.3000112.7L57 Y58 I64 A65 I121 I152 I156L57-W61 VanDerWaalsContact O-CD1 3.25Å; L57-W61 PolarHBondContact O-N 3.27Å; L57-W61 VanDerWaalsContact O-N 3.07Å; Y58-W61 PolarHBondContact O-N 3.41Å; W61-I64 HydrophobicContact CE3-CD1 4.23Å; W61-I64 PolarHBondContact O-N 3.15Å; W61-A65 PolarHBondContact O-N 3.5Å; W61-I121 HydrophobicContact CB-CD1 3.62Å; W61-I152 HydrophobicContact CB-CG2 4.28Å; W61-I152 HydrophobicContact CD2-CG2 4.15Å; W61-I152 HydrophobicContact CG-CG2 3.78Å; W61-I156 HydrophobicContact CD2-CD1 3.77Å; W61-I156 HydrophobicContact CE3-CD1 3.39Å; W61-I156 HydrophobicContact CG-CD1 4.49Å; W61-I156 HydrophobicContact CH2-CD1 4.03Å; W61-I156 HydrophobicContact CZ2-CD1 4.37Å; W61-I156 HydrophobicContact CZ3-CD1 3.54Å
62M96.9Very high95.1Very high1 Ų123 Ų231%0.00511%0.113CC..Hα-helixtrans-62.8-47172.7-173177.1-6300111.4Y58 I60 I64 A65 H66 I121 L122 F125 I253Y58-M62 WeakPolarHBondContact O-CB 3.26Å; Y58-M62 PolarHBondContact O-N 3.13Å; I60-M62 VanDerWaalsContact C-N 3.33Å; I60-M62 PolarHBondContact O-N 3.09Å; M62-I64 VanDerWaalsContact C-N 3.3Å; M62-I64 PolarHBondContact O-N 2.97Å; M62-A65 PolarHBondContact O-N 3.17Å; M62-A65 VanDerWaalsContact O-N 3.15Å; M62-H66 WeakPolarHBondContact O-CB 3.39Å; M62-H66 PolarHBondContact O-N 3.46Å; M62-I121 HydrophobicContact CB-CG2 4.22Å; M62-I121 HydrophobicContact CE-CG2 3.93Å; M62-L122 HydrophobicContact CE-CB 3.83Å; M62-L122 HydrophobicContact CE-CD1 3.81Å; M62-L122 HydrophobicContact CE-CG 4.41Å; M62-F125 HydrophobicContact CE-CD1 3.98Å; M62-I253 HydrophobicContact SD-CG2 4.49Å
63A97.9Very high95.7Very high0 Ų018.8 Ų18.80%09%0.091CC..Hα-helixtrans-64.3-32.9177.500000112.9N37 V40 I41 A59 I60 N67N37-A63 HydrophobicContact CB-CB 4.43Å; V40-A63 HydrophobicContact CB-CB 4.28Å; V40-A63 HydrophobicContact CG1-CB 3.81Å; I41-A63 HydrophobicContact CD1-CB 4.18Å; I41-A63 HydrophobicContact CG1-CB 3.65Å; A59-A63 WeakPolarHBondContact O-CB 3.31Å; A59-A63 PolarHBondContact O-N 2.81Å; I60-A63 PolarHBondContact O-N 2.81Å; A63-N67 WeakPolarHBondContact O-CB 3.45Å; A63-N67 PolarHBondContact O-N 3.4Å; A63-N67 PolarHBondContact O-ND2 3.11Å
64I98Very high96.2Very high60 Ų6018.7 Ų18.731%0.3089%0.09SC..Hα-helixtrans-63.7-48.6171.5-68.6167.2000110.3I41 I60 W61 M62 H66 N67 I68I41-I64 HydrophobicContact CD1-CG1 3.72Å; I41-I64 HydrophobicContact CG1-CG1 4.27Å; I60-I64 HydrophobicContact CG2-CD1 3.95Å; I60-I64 WeakPolarHBondContact O-CG1 3.33Å; I60-I64 PolarHBondContact O-N 2.7Å; W61-I64 HydrophobicContact CE3-CD1 4.23Å; W61-I64 PolarHBondContact O-N 3.15Å; M62-I64 VanDerWaalsContact C-N 3.3Å; M62-I64 PolarHBondContact O-N 2.97Å; I64-H66 VanDerWaalsContact C-N 3.35Å; I64-H66 PolarHBondContact O-N 3.05Å; I64-N67 PolarHBondContact O-N 3.39Å; I64-I68 HydrophobicContact CG2-CD1 4.31Å; I64-I68 WeakPolarHBondContact O-CG1 3.21Å; I64-I68 PolarHBondContact O-N 3.11Å; I64-I68 VanDerWaalsContact O-N 3.1Å
65A97.9Very high96.5Very high4 Ų420.4 Ų20.43%0.03310%0.1CC..Hα-helixtrans-62.1-41.5178.100000112.1W61 M62 N67 I68 Q69 I117 A118W61-A65 PolarHBondContact O-N 3.5Å; M62-A65 PolarHBondContact O-N 3.17Å; M62-A65 VanDerWaalsContact O-N 3.15Å; A65-N67 PolarHBondContact O-N 3.31Å; A65-I68 PolarHBondContact O-N 3.47Å; A65-Q69 PolarHBondContact O-N 3.44Å; A65-I117 HydrophobicContact CB-CG2 4.18Å; A65-A118 HydrophobicContact CB-CB 4Å
66H97.9Very high96.7Very high15 Ų1521.8 Ų21.87%0.06911%0.107CC..Hα-helixtrans-64.6-36.5175.6-70.8174.4000113M62 I64 Q69 L70 H305 D308M62-H66 WeakPolarHBondContact O-CB 3.39Å; M62-H66 PolarHBondContact O-N 3.46Å; I64-H66 VanDerWaalsContact C-N 3.35Å; I64-H66 PolarHBondContact O-N 3.05Å; H66-Q69 WeakPolarHBondContact O-CB 3.44Å; H66-Q69 PolarHBondContact O-N 3.06Å; H66-L70 WeakPolarHBondContact O-CB 3.31Å; H66-L70 WeakPolarHBondContact O-CG 3.41Å; H66-L70 PolarHBondContact O-N 3.02Å; H66-H305 HydrophobicContact CB-CB 3.98Å; H66-H305 AromaticContact CD2-CE1 3.96Å; H66-H305 AromaticContact CD2-CG 3.94Å; H66-H305 AromaticContact CD2-ND1 3.1Å; H66-H305 PolarHBondContact CD2-ND1 3.16Å; H66-H305 AromaticContact CG-ND1 3.79Å; H66-H305 AromaticContact NE2-ND1 3.39Å; H66-H305 PolarHBondContact NE2-ND1 3.27Å; H66-D308 IonicContact CE1-OD2 2.69Å; H66-D308 PolarHBondContact CE1-OD2 3.14Å; H66-D308 IonicContact ND1-OD2 3.05Å; H66-D308 PolarHBondContact ND1-OD2 3.07Å
67N98.1Very high96.7Very high12 Ų1223.4 Ų23.46%0.06412%0.116CC..Hα-helixtrans-63.8-42171.9-88.1-41000112.2I34 N37 A63 I64 A65 Q69 L70 I71I34-N67 PolarHBondContact O-OD1 2.92Å; N37-N67 VanDerWaalsContact CB-ND2 3.33Å; N37-N67 WeakPolarHBondContact CB-ND2 3.37Å; N37-N67 WeakPolarHBondContact CB-OD1 3.39Å; A63-N67 WeakPolarHBondContact O-CB 3.45Å; A63-N67 PolarHBondContact O-N 3.4Å; A63-N67 PolarHBondContact O-ND2 3.11Å; I64-N67 PolarHBondContact O-N 3.39Å; A65-N67 PolarHBondContact O-N 3.31Å; N67-Q69 VanDerWaalsContact C-N 3.31Å; N67-Q69 PolarHBondContact O-N 3.41Å; N67-L70 PolarHBondContact O-N 3.4Å; N67-I71 WeakPolarHBondContact O-CB 3.24Å; N67-I71 WeakPolarHBondContact O-CD1 3.5Å; N67-I71 VanDerWaalsContact O-CG1 3.22Å; N67-I71 WeakPolarHBondContact O-CG1 3.47Å; N67-I71 PolarHBondContact O-N 2.9Å
68I97.8Very high96.7Very high60 Ų6023 Ų2331%0.30811%0.114SC..Hα-helixtrans-60.8-44.1175.8-64167.8000110I64 A65 I71 V72 L110I64-I68 HydrophobicContact CG2-CD1 4.31Å; I64-I68 WeakPolarHBondContact O-CG1 3.21Å; I64-I68 PolarHBondContact O-N 3.11Å; I64-I68 VanDerWaalsContact O-N 3.1Å; A65-I68 PolarHBondContact O-N 3.47Å; I68-I71 PolarHBondContact O-N 3.17Å; I68-V72 HydrophobicContact CG2-CG2 4.17Å; I68-V72 WeakPolarHBondContact O-CB 3.27Å; I68-V72 WeakPolarHBondContact O-CG2 3.25Å; I68-V72 PolarHBondContact O-N 3.24Å; I68-L110 HydrophobicContact CG2-CB 4.33Å
69Q97.1Very high96.7Very high4 Ų424.6 Ų24.62%0.01912%0.12CC..Hα-helixtrans-58.2-52.5174.3-80.8-65.5-23.400113A65 H66 N67 I71 V72 N73 T74 T111 S114A65-Q69 PolarHBondContact O-N 3.44Å; H66-Q69 WeakPolarHBondContact O-CB 3.44Å; H66-Q69 PolarHBondContact O-N 3.06Å; N67-Q69 VanDerWaalsContact C-N 3.31Å; N67-Q69 PolarHBondContact O-N 3.41Å; Q69-I71 PolarHBondContact O-N 3.2Å; Q69-V72 PolarHBondContact O-N 3.2Å; Q69-N73 WeakPolarHBondContact O-CA 3.27Å; Q69-N73 WeakPolarHBondContact O-CB 3.47Å; Q69-N73 PolarHBondContact O-N 3.13Å; Q69-T74 PolarHBondContact O-N 2.97Å; Q69-T111 PolarHBondContact NE2-O 2.94Å; Q69-S114 PolarHBondContact NE2-OG 3.49Å
70L97.9Very high96.6Very high0 Ų026.5 Ų26.50%013%0.13CC..Iπ-helixtrans-61.2-35.7-179-72.8169.5000112.2I34 N37 H66 N67 T74 L75 H305 A306I34-L70 HydrophobicContact CG1-CB 3.99Å; I34-L70 HydrophobicContact CG1-CD1 4.38Å; N37-L70 VanDerWaalsContact ND2-CD1 3.34Å; N37-L70 WeakPolarHBondContact ND2-CD1 3.2Å; H66-L70 WeakPolarHBondContact O-CB 3.31Å; H66-L70 WeakPolarHBondContact O-CG 3.41Å; H66-L70 PolarHBondContact O-N 3.02Å; N67-L70 PolarHBondContact O-N 3.4Å; L70-T74 WeakPolarHBondContact O-CB 3.48Å; L70-T74 PolarHBondContact O-N 3.4Å; L70-L75 WeakPolarHBondContact O-CB 3.34Å; L70-L75 PolarHBondContact O-N 3.5Å; L70-H305 HydrophobicContact CD1-CB 4.38Å; L70-H305 HydrophobicContact CD2-CB 4.07Å; L70-H305 HydrophobicContact CG-CB 3.9Å; L70-A306 HydrophobicContact CD2-CB 4.46Å
71I97.6Very high96.2Very high69 Ų6925.5 Ų25.535%0.35413%0.126SC..Iπ-helixtrans-74.2-54.3178.4-67.4166.4000110.9I34 N67 I68 Q69 L75 I76I34-I71 HydrophobicContact CD1-CD1 4.45Å; I34-I71 HydrophobicContact CD1-CG1 3.58Å; I34-I71 HydrophobicContact CG1-CG1 4.31Å; N67-I71 WeakPolarHBondContact O-CB 3.24Å; N67-I71 WeakPolarHBondContact O-CD1 3.5Å; N67-I71 VanDerWaalsContact O-CG1 3.22Å; N67-I71 WeakPolarHBondContact O-CG1 3.47Å; N67-I71 PolarHBondContact O-N 2.9Å; I68-I71 PolarHBondContact O-N 3.17Å; Q69-I71 PolarHBondContact O-N 3.2Å; I71-L75 WeakPolarHBondContact O-CB 3.5Å; I71-I76 HydrophobicContact CG2-CD1 4.14Å; I71-I76 VanDerWaalsContact O-CG1 3.27Å; I71-I76 WeakPolarHBondContact O-CG1 3.34Å; I71-I76 PolarHBondContact O-N 2.97Å
72V96Very high95.9Very high11 Ų1124.4 Ų24.47%0.06712%0.122CC..Iπ-helixtrans-79.5-46-170.3-175.60000111.4I68 Q69 I76 D77 F107 L110 T111I68-V72 HydrophobicContact CG2-CG2 4.17Å; I68-V72 WeakPolarHBondContact O-CB 3.27Å; I68-V72 WeakPolarHBondContact O-CG2 3.25Å; I68-V72 PolarHBondContact O-N 3.24Å; Q69-V72 PolarHBondContact O-N 3.2Å; V72-I76 WeakPolarHBondContact O-CB 3.32Å; V72-D77 PolarHBondContact O-N 3.5Å; V72-F107 HydrophobicContact CG1-CB 3.71Å; V72-F107 HydrophobicContact CG1-CD1 3.85Å; V72-F107 HydrophobicContact CG1-CG 3.95Å; V72-L110 HydrophobicContact CG2-CB 4.31Å; V72-L110 HydrophobicContact CG2-CD1 4.42Å; V72-T111 VanDerWaalsContact CG1-OG1 3.22Å; V72-T111 WeakPolarHBondContact CG1-OG1 3.21Å
73N94.8Very high95.7Very high16 Ų1624.4 Ų24.49%0.08612%0.121CC..Iπ-helixtrans-84.1-58.3-177.4-170.431000111.3Q69 D77 D78 T111Q69-N73 WeakPolarHBondContact O-CA 3.27Å; Q69-N73 WeakPolarHBondContact O-CB 3.47Å; Q69-N73 PolarHBondContact O-N 3.13Å; N73-D77 WeakPolarHBondContact O-CB 3.03Å; N73-D77 PolarHBondContact O-N 3.29Å; N73-D78 WeakPolarHBondContact O-CB 3.05Å; N73-D78 PolarHBondContact O-N 3.49Å; N73-T111 HydrophobicContact CB-CG2 3.95Å
74T96.6Very high95.5Very high0 Ų025.9 Ų25.90%013%0.129CC..Iπ-helixtrans-76.7-42.8-170.4-43.10000113.3V30 Q69 L70 D78 F79 S302V30-T74 HydrophobicContact CG2-CG2 3.71Å; Q69-T74 PolarHBondContact O-N 2.97Å; L70-T74 WeakPolarHBondContact O-CB 3.48Å; L70-T74 PolarHBondContact O-N 3.4Å; T74-D78 VanDerWaalsContact O-CB 3.32Å; T74-D78 WeakPolarHBondContact O-CB 3.39Å; T74-F79 PolarHBondContact O-N 2.95Å; T74-S302 WeakPolarHBondContact OG1-CB 3.43Å; T74-S302 PolarHBondContact OG1-OG 3.04Å
75L96.9Very high95.2Very high48 Ų4826 Ų2625%0.25113%0.128SC..Iπ-helixtrans-82.1-56.3-178.5173.458.8000111.7V30 L70 I71 F79 L80V30-L75 HydrophobicContact CG1-CB 4.01Å; V30-L75 HydrophobicContact CG1-CD1 4.14Å; V30-L75 HydrophobicContact CG1-CD2 4.13Å; V30-L75 HydrophobicContact CG1-CG 4.31Å; V30-L75 HydrophobicContact CG2-CB 3.79Å; L70-L75 WeakPolarHBondContact O-CB 3.34Å; L70-L75 PolarHBondContact O-N 3.5Å; I71-L75 WeakPolarHBondContact O-CB 3.5Å; L75-F79 HydrophobicContact CD1-CD1 4.11Å; L75-L80 HydrophobicContact CD1-CD1 4.45Å; L75-L80 HydrophobicContact CD1-CG 4.35Å; L75-L80 WeakPolarHBondContact O-CG 3.09Å; L75-L80 PolarHBondContact O-N 3.41Å
76I95.3Very high94.9Very high28 Ų2828.3 Ų28.314%0.14414%0.136CC..Iπ-helixtrans-75.7-54.4-173.3-65.5168.7000111.5I71 V72 L80 G81 V96 F107I71-I76 HydrophobicContact CG2-CD1 4.14Å; I71-I76 VanDerWaalsContact O-CG1 3.27Å; I71-I76 WeakPolarHBondContact O-CG1 3.34Å; I71-I76 PolarHBondContact O-N 2.97Å; V72-I76 WeakPolarHBondContact O-CB 3.32Å; I76-L80 WeakPolarHBondContact O-CB 3.49Å; I76-G81 PolarHBondContact O-N 3Å; I76-V96 HydrophobicContact CG2-CB 3.95Å; I76-V96 HydrophobicContact CG2-CG2 4.2Å; I76-F107 HydrophobicContact CD1-CE1 4.23Å; I76-F107 HydrophobicContact CD1-CE2 4.49Å; I76-F107 HydrophobicContact CD1-CZ 3.96Å; I76-F107 HydrophobicContact CG2-CD2 4.13Å; I76-F107 HydrophobicContact CG2-CE2 3.74Å; I76-F107 HydrophobicContact CG2-CZ 4.28Å
77D92.9Very high94.6Very high36 Ų3629.4 Ų29.419%0.19315%0.147CC..Iπ-helixtrans-76.8-54.6-176.3-17538.3000112.8V72 N73 G81 R82V72-D77 PolarHBondContact O-N 3.5Å; N73-D77 WeakPolarHBondContact O-CB 3.03Å; N73-D77 PolarHBondContact O-N 3.29Å; D77-G81 WeakPolarHBondContact O-CA 3.48Å; D77-G81 PolarHBondContact O-N 2.93Å; D77-R82 PolarHBondContact O-N 3.24Å; D77-R82 IonicContact OD1-CZ 2.64Å; D77-R82 IonicContact OD1-NE 3.52Å; D77-R82 IonicContact OD1-NH1 2.71Å; D77-R82 PolarHBondContact OD1-NH1 3.41Å; D77-R82 IonicContact OD1-NH2 3.45Å; D77-R82 PolarHBondContact OD1-NH2 2.94Å; D77-R82 IonicContact OD2-CZ 3.26Å; D77-R82 IonicContact OD2-NH1 3.05Å; D77-R82 PolarHBondContact OD2-NH1 3Å; D77-R82 IonicContact OD2-NH2 3.7Å; D77-R82 PolarHBondContact OD2-NH2 3.42Å
78D94.6Very high94.3Very high0 Ų030.7 Ų30.70%016%0.156CC..Iπ-helixtrans-70.4-61.1-174.8-87.1-5.1000112R22 N73 T74 R82 G83 S299R22-D78 HydrophobicContact CB-CB 4.44Å; R22-D78 HydrophobicContact CG-CB 3.91Å; R22-D78 IonicContact CZ-OD1 3.12Å; R22-D78 IonicContact NE-OD1 2.98Å; R22-D78 PolarHBondContact NE-OD1 2.64Å; R22-D78 IonicContact NE-OD2 3.06Å; R22-D78 IonicContact NH2-OD1 2.78Å; R22-D78 PolarHBondContact NH2-OD1 2.74Å; N73-D78 WeakPolarHBondContact O-CB 3.05Å; N73-D78 PolarHBondContact O-N 3.49Å; T74-D78 VanDerWaalsContact O-CB 3.32Å; T74-D78 WeakPolarHBondContact O-CB 3.39Å; D78-R82 PolarHBondContact O-N 3.45Å; D78-G83 PolarHBondContact O-N 3.26Å; D78-S299 VanDerWaalsContact CG-OG 3.26Å; D78-S299 PolarHBondContact OD1-OG 3.49Å; D78-S299 VanDerWaalsContact OD2-CB 3.28Å; D78-S299 WeakPolarHBondContact OD2-CB 3.35Å; D78-S299 PolarHBondContact OD2-OG 3.23Å
79F95.7Very high93.9Very high42 Ų4234.1 Ų34.118%0.18417%0.171CC..Iπ-helixtrans-74-64.9-176178.5-116.7000112.3P27 T74 L75 G81 G83 L84P27-F79 HydrophobicContact CB-CD1 4.37Å; P27-F79 HydrophobicContact CB-CD2 3.83Å; P27-F79 HydrophobicContact CB-CE1 4.39Å; P27-F79 HydrophobicContact CB-CE2 3.86Å; P27-F79 HydrophobicContact CB-CG 4.09Å; P27-F79 HydrophobicContact CB-CZ 4.14Å; P27-F79 HydrophobicContact CG-CD2 3.71Å; P27-F79 HydrophobicContact CG-CE2 3.75Å; P27-F79 HydrophobicContact CG-CG 4.4Å; P27-F79 HydrophobicContact CG-CZ 4.47Å; T74-F79 PolarHBondContact O-N 2.95Å; L75-F79 HydrophobicContact CD1-CD1 4.11Å; F79-G81 PolarHBondContact O-N 3.29Å; F79-G83 CarbonylContact O-C 3.58Å; F79-G83 WeakPolarHBondContact O-CA 3.47Å; F79-G83 PolarHBondContact O-N 3.27Å; F79-L84 HydrophobicContact CZ-CD1 4.23Å; F79-L84 PolarHBondContact O-N 3.37Å
80L93.9Very high93.4Very high40 Ų4035.7 Ų35.721%0.20918%0.181CC..Iπ-helixtrans-64.3-46.4-175.1-66.4177000111.7L75 I76 R82 L84 I94L75-L80 HydrophobicContact CD1-CD1 4.45Å; L75-L80 HydrophobicContact CD1-CG 4.35Å; L75-L80 WeakPolarHBondContact O-CG 3.09Å; L75-L80 PolarHBondContact O-N 3.41Å; I76-L80 WeakPolarHBondContact O-CB 3.49Å; L80-R82 PolarHBondContact O-N 3.37Å; L80-L84 HydrophobicContact CD2-CD2 4.23Å; L80-I94 CarbonylContact C-O 3.45Å
81G90.1Very high92.9Very high1 Ų143 Ų431%0.0121%0.213CC..Iπ-helixtrans-69.2-33.3-174.200000114.8I76 D77 F79 I94 Q95I76-G81 PolarHBondContact O-N 3Å; D77-G81 WeakPolarHBondContact O-CA 3.48Å; D77-G81 PolarHBondContact O-N 2.93Å; F79-G81 PolarHBondContact O-N 3.29Å; G81-I94 WeakPolarHBondContact CA-O 3.34Å; G81-I94 PolarHBondContact N-O 2.99Å; G81-Q95 WeakPolarHBondContact O-CG 3.5Å; G81-Q95 PolarHBondContact O-NE2 3.41Å
82R90.3Very high92.4Very high66 Ų6646 Ų4625%0.24922%0.221CC..Iπ-helixtrans-135.7-40.8-171.2-61.6178-168.2122.58.2113.9Y19 D77 D78 L80 Y86Y19-R82 HydrophobicContact CD1-CB 4.34Å; Y19-R82 HydrophobicContact CE1-CB 4.02Å; D77-R82 PolarHBondContact O-N 3.24Å; D77-R82 IonicContact OD1-CZ 2.64Å; D77-R82 IonicContact OD1-NE 3.52Å; D77-R82 IonicContact OD1-NH1 2.71Å; D77-R82 PolarHBondContact OD1-NH1 3.41Å; D77-R82 IonicContact OD1-NH2 3.45Å; D77-R82 PolarHBondContact OD1-NH2 2.94Å; D77-R82 IonicContact OD2-CZ 3.26Å; D77-R82 IonicContact OD2-NH1 3.05Å; D77-R82 PolarHBondContact OD2-NH1 3Å; D77-R82 IonicContact OD2-NH2 3.7Å; D77-R82 PolarHBondContact OD2-NH2 3.42Å; D78-R82 PolarHBondContact O-N 3.45Å; L80-R82 PolarHBondContact O-N 3.37Å; R82-Y86 PolarHBondContact O-N 3.31Å
83G93Very high91.9Very high0 Ų048.3 Ų48.30%024%0.238CC..Iπ-helixtrans-66.7-44.3-179.200000113.4A23 D78 F79 K85 Y86 A87A23-G83 WeakPolarHBondContact CB-O 3.46Å; D78-G83 PolarHBondContact O-N 3.26Å; F79-G83 CarbonylContact O-C 3.58Å; F79-G83 WeakPolarHBondContact O-CA 3.47Å; F79-G83 PolarHBondContact O-N 3.27Å; G83-K85 VanDerWaalsContact C-N 3.35Å; G83-K85 PolarHBondContact O-N 3.28Å; G83-Y86 WeakPolarHBondContact O-CB 3.43Å; G83-Y86 PolarHBondContact O-N 3.45Å; G83-Y86 VanDerWaalsContact O-N 3.14Å; G83-A87 WeakPolarHBondContact O-CB 3.13Å; G83-A87 PolarHBondContact O-N 2.95Å
84L93.2Very high91.6Very high32 Ų3251.7 Ų51.717%0.16826%0.255CS..Hα-helixtrans-65.6-39.7-178.6-174.466.1000111.5F79 L80 Y86 A87 T88 I94F79-L84 HydrophobicContact CZ-CD1 4.23Å; F79-L84 PolarHBondContact O-N 3.37Å; L80-L84 HydrophobicContact CD2-CD2 4.23Å; L84-Y86 VanDerWaalsContact C-N 3.28Å; L84-Y86 PolarHBondContact O-N 2.93Å; L84-A87 PolarHBondContact O-N 2.82Å; L84-T88 HydrophobicContact CD1-CG2 3.9Å; L84-T88 HydrophobicContact CG-CG2 4.33Å; L84-T88 WeakPolarHBondContact O-CB 3.46Å; L84-T88 VanDerWaalsContact O-CG2 3.32Å; L84-T88 WeakPolarHBondContact O-CG2 3.42Å; L84-T88 PolarHBondContact O-N 3.1Å; L84-T88 PolarHBondContact O-OG1 2.78Å; L84-I94 HydrophobicContact CD2-CD1 4Å; L84-I94 HydrophobicContact CD2-CG1 4.21Å
85K91.6Very high91.2Very high63 Ų6353.8 Ų53.827%0.27426%0.264SS..Hα-helixtrans-59.2-41.3173.3-174.9179.6-179.71760111.3G83 C90 Y92G83-K85 VanDerWaalsContact C-N 3.35Å; G83-K85 PolarHBondContact O-N 3.28Å; K85-C90 HydrophobicContact CG-CB 4.43Å; K85-C90 WeakPolarHBondContact O-CA 3.44Å; K85-C90 PolarHBondContact O-N 3.24Å; K85-Y92 VanDerWaalsContact CA-O 3.3Å; K85-Y92 WeakPolarHBondContact CA-O 3.26Å
86Y91.7Very high90.7Very high52 Ų5253.4 Ų53.420%0.20426%0.264CS..Hα-helixtrans-69.5-50.9175.9-177.4-97.7000112.2L8 L11 Y19 T20 A23 Y24 R82 G83 L84 T88 Q89L8-Y86 HydrophobicContact CD1-CD2 3.53Å; L8-Y86 HydrophobicContact CD1-CE2 4.2Å; L8-Y86 HydrophobicContact CD1-CG 4.37Å; L11-Y86 HydrophobicContact CD1-CD2 4.28Å; L11-Y86 HydrophobicContact CD1-CE2 3.98Å; Y19-Y86 HydrophobicContact CD2-CD2 4.5Å; Y19-Y86 AromaticContact CG-CD2 3.97Å; Y19-Y86 HydrophobicContact CG-CD2 3.97Å; Y19-Y86 HydrophobicContact CG-CG 4.32Å; T20-Y86 PolarHBondContact OG1-OH 2.73Å; A23-Y86 HydrophobicContact CB-CD1 3.77Å; Y24-Y86 HydrophobicContact CE2-CE1 4.34Å; R82-Y86 PolarHBondContact O-N 3.31Å; G83-Y86 WeakPolarHBondContact O-CB 3.43Å; G83-Y86 PolarHBondContact O-N 3.45Å; G83-Y86 VanDerWaalsContact O-N 3.14Å; L84-Y86 VanDerWaalsContact C-N 3.28Å; L84-Y86 PolarHBondContact O-N 2.93Å; Y86-T88 VanDerWaalsContact C-N 3.25Å; Y86-T88 PolarHBondContact O-N 2.96Å; Y86-Q89 PolarHBondContact O-N 3.11Å; Y86-Q89 VanDerWaalsContact O-N 3.13Å
87A92.3Very high90.2Very high38 Ų3853.2 Ų53.231%0.31426%0.263SS..Hα-helixtrans-58.9-35.2-177.600000113.2A23 G83 L84A23-A87 HydrophobicContact CB-CB 4.1Å; G83-A87 WeakPolarHBondContact O-CB 3.13Å; G83-A87 PolarHBondContact O-N 2.95Å; L84-A87 PolarHBondContact O-N 2.82Å
88T92.2Very high89.9Confident39 Ų3953.3 Ų53.324%0.23926%0.263CS..THydrogen-bonded Turntrans-94.511.4-177.165.60000113.4L84 Y86 C90 K91 Y92L84-T88 HydrophobicContact CD1-CG2 3.9Å; L84-T88 HydrophobicContact CG-CG2 4.33Å; L84-T88 WeakPolarHBondContact O-CB 3.46Å; L84-T88 VanDerWaalsContact O-CG2 3.32Å; L84-T88 WeakPolarHBondContact O-CG2 3.42Å; L84-T88 PolarHBondContact O-N 3.1Å; L84-T88 PolarHBondContact O-OG1 2.78Å; Y86-T88 VanDerWaalsContact C-N 3.25Å; Y86-T88 PolarHBondContact O-N 2.96Å; T88-C90 PolarHBondContact O-N 3.46Å; T88-K91 WeakPolarHBondContact O-CB 3.48Å; T88-K91 PolarHBondContact O-N 3.45Å; T88-Y92 HydrophobicContact CG2-CD2 3.95Å; T88-Y92 PolarHBondContact OG1-N 2.8Å; T88-Y92 VanDerWaalsContact OG1-N 3.09Å; T88-Y92 PolarHBondContact OG1-O 3.05Å
89Q88.4Confident89.7Confident132 Ų13260.3 Ų60.362%0.61730%0.296SS*.THydrogen-bonded Turntrans51.541.7-175.8-59.4-178.1-12.900112.4Y86 K91Y86-Q89 PolarHBondContact O-N 3.11Å; Y86-Q89 VanDerWaalsContact O-N 3.13Å; Q89-K91 VanDerWaalsContact C-N 3.29Å; Q89-K91 PolarHBondContact O-N 3.48Å
90C85.8Confident89.5Confident36 Ų3660.3 Ų60.324%0.24330%0.301CS..THydrogen-bonded Turntrans66.818.7-177.4-42.90000115.9C7 K85 T88C7-C90 HydrophobicContact CB-CB 3.59Å; C7-C90 WeakPolarHBondContact CB-SG 3.31Å; C7-C90 PolarHBondContact N-SG 3.29Å; C7-C90 WeakPolarHBondContact SG-CB 3.38Å; C7-C90 CovalentContact SG-SG 2.01Å; C7-C90 PolarHBondContact SG-SG 2.96Å; K85-C90 HydrophobicContact CG-CB 4.43Å; K85-C90 WeakPolarHBondContact O-CA 3.44Å; K85-C90 PolarHBondContact O-N 3.24Å; T88-C90 PolarHBondContact O-N 3.46Å
91K87.7Confident89.4Confident155 Ų15560.2 Ų60.267%0.67430%0.304SS*.SBendtrans-71.9-35.8173.6-171.5179.5177-173.60112.2T88 Q89T88-K91 WeakPolarHBondContact O-CB 3.48Å; T88-K91 PolarHBondContact O-N 3.45Å; Q89-K91 VanDerWaalsContact C-N 3.29Å; Q89-K91 PolarHBondContact O-N 3.48Å
92Y88.2Confident89.6Confident130 Ų13066.4 Ų66.451%0.5134%0.336SS..  trans-130.8131.2178.7-59.5-75.4000110.1K85 T88K85-Y92 VanDerWaalsContact CA-O 3.3Å; K85-Y92 WeakPolarHBondContact CA-O 3.26Å; T88-Y92 HydrophobicContact CG2-CD2 3.95Å; T88-Y92 PolarHBondContact OG1-N 2.8Å; T88-Y92 VanDerWaalsContact OG1-N 3.09Å; T88-Y92 PolarHBondContact OG1-O 3.05Å
93S84.8Confident89.8Confident60 Ų6065.7 Ų65.742%0.4234%0.337SS..  trans-137.4113.1176.1-175.70000107.9
94I88.9Confident89.8Confident87 Ų8765.7 Ų65.745%0.44634%0.337SS..  trans-116.394.6179.2-58175.3000106.9L80 G81 L84 V96L80-I94 CarbonylContact C-O 3.45Å; G81-I94 WeakPolarHBondContact CA-O 3.34Å; G81-I94 PolarHBondContact N-O 2.99Å; L84-I94 HydrophobicContact CD2-CD1 4Å; L84-I94 HydrophobicContact CD2-CG1 4.21Å; I94-V96 HydrophobicContact CG2-CG2 3.99Å
95Q87Confident89.9Confident44 Ų4466.3 Ų66.321%0.20634%0.338CS..  trans-104.897.6177-75.4-176.6-26.600108.2G81 D97 I98G81-Q95 WeakPolarHBondContact O-CG 3.5Å; G81-Q95 PolarHBondContact O-NE2 3.41Å; Q95-D97 VanDerWaalsContact C-N 3.3Å; Q95-I98 HydrophobicContact CB-CD1 3.74Å; Q95-I98 HydrophobicContact CB-CG1 3.6Å; Q95-I98 HydrophobicContact CB-CG2 4.32Å; Q95-I98 WeakPolarHBondContact O-CG1 3.38Å
96V87.4Confident90.1Very high40 Ų4066.6 Ų66.624%0.24234%0.343CS..SBendtrans-75.1-25.4-174.5-170.90000111.4I76 I94 I98 L103 F107I76-V96 HydrophobicContact CG2-CB 3.95Å; I76-V96 HydrophobicContact CG2-CG2 4.2Å; I94-V96 HydrophobicContact CG2-CG2 3.99Å; V96-I98 VanDerWaalsContact C-N 3.29Å; V96-I98 PolarHBondContact O-N 2.9Å; V96-L103 HydrophobicContact CG1-CD1 4.31Å; V96-F107 HydrophobicContact CB-CE2 3.97Å; V96-F107 HydrophobicContact CG1-CE2 3.7Å; V96-F107 HydrophobicContact CG1-CZ 4Å
97D84.6Confident90.2Very high24 Ų2465.7 Ų65.713%0.12834%0.34CS..THydrogen-bonded Turntrans-67.6-26.3178.164-42.2000113.1Q95 C104 F107 C183Q95-D97 VanDerWaalsContact C-N 3.3Å; D97-C104 WeakPolarHBondContact O-CB 3.15Å; D97-F107 HydrophobicContact CB-CD2 4.31Å; D97-C183 HydrophobicContact CB-CB 4.24Å; D97-C183 WeakPolarHBondContact OD2-CB 3.44Å
98I87.6Confident90.3Very high38 Ų3865.3 Ų65.320%0.19533%0.334CS..THydrogen-bonded Turntrans-89.9-9.4-177.467.9165.5000114.2Q95 V96 L172 N181Q95-I98 HydrophobicContact CB-CD1 3.74Å; Q95-I98 HydrophobicContact CB-CG1 3.6Å; Q95-I98 HydrophobicContact CB-CG2 4.32Å; Q95-I98 WeakPolarHBondContact O-CG1 3.38Å; V96-I98 VanDerWaalsContact C-N 3.29Å; V96-I98 PolarHBondContact O-N 2.9Å; I98-L172 HydrophobicContact CB-CD2 4.39Å; I98-N181 HydrophobicContact CB-CB 4.09Å; I98-N181 HydrophobicContact CG2-CB 4.48Å; I98-N181 WeakPolarHBondContact CG2-O 3.43Å
99E88.9Confident90.4Very high147 Ų14765 Ų6569%0.68733%0.328SS*.SBendtrans-68.2-34.4-176.2-70.9-65.4153.700112.3L103E99-L103 HydrophobicContact CB-CD1 4.08Å
100S92.1Very high90.8Very high42 Ų4261.2 Ų61.229%0.29431%0.312SS..  trans-153152.1175.771.40000112.8L102 L103 C104S100-L102 PolarHBondContact O-N 3Å; S100-L103 PolarHBondContact O-N 2.88Å; S100-L103 VanDerWaalsContact O-N 3.17Å; S100-L103 WeakPolarHBondContact OG-CB 3.32Å; S100-L103 VanDerWaalsContact OG-CG 3.25Å; S100-L103 WeakPolarHBondContact OG-CG 3.37Å; S100-L103 PolarHBondContact OG-N 3.48Å; S100-L103 VanDerWaalsContact OG-N 3.15Å; S100-C104 PolarHBondContact O-N 3.35Å; S100-C104 VanDerWaalsContact O-N 3.1Å
101S92.4Very high91.3Very high38 Ų3860.5 Ų60.527%0.26631%0.307SS..Hα-helixtrans-56.1-36.6173.5178.10000111.7K105 D171S101-K105 WeakPolarHBondContact O-CB 3.24Å; S101-K105 WeakPolarHBondContact O-CG 3.23Å; S101-K105 PolarHBondContact O-N 3.24Å; S101-K105 PolarHBondContact OG-NZ 2.87Å; S101-D171 VanDerWaalsContact CB-OD1 3.28Å; S101-D171 WeakPolarHBondContact CB-OD1 3.32Å; S101-D171 VanDerWaalsContact OG-CG 3.31Å; S101-D171 PolarHBondContact OG-OD1 2.96Å; S101-D171 PolarHBondContact OG-OD2 3.35Å
102L93.9Very high91.6Very high131 Ų13154.5 Ų54.569%0.68628%0.282SS*.Hα-helixtrans-64.3-44.2178.1-176.766.7000111.9S100 K105 L106S100-L102 PolarHBondContact O-N 3Å; L102-K105 PolarHBondContact O-N 2.9Å; L102-L106 VanDerWaalsContact O-CB 3.22Å; L102-L106 WeakPolarHBondContact O-CB 3.28Å; L102-L106 PolarHBondContact O-N 2.92Å
103L93.7Very high92Very high51 Ų5148.4 Ų48.427%0.26726%0.259SS..Hα-helixtrans-67.4-43.2179.1-71.9170.9000111.7V96 E99 S100 K105 L106 F107V96-L103 HydrophobicContact CG1-CD1 4.31Å; E99-L103 HydrophobicContact CB-CD1 4.08Å; S100-L103 PolarHBondContact O-N 2.88Å; S100-L103 VanDerWaalsContact O-N 3.17Å; S100-L103 WeakPolarHBondContact OG-CB 3.32Å; S100-L103 VanDerWaalsContact OG-CG 3.25Å; S100-L103 WeakPolarHBondContact OG-CG 3.37Å; S100-L103 PolarHBondContact OG-N 3.48Å; S100-L103 VanDerWaalsContact OG-N 3.15Å; L103-K105 VanDerWaalsContact C-N 3.35Å; L103-K105 PolarHBondContact O-N 2.97Å; L103-L106 PolarHBondContact O-N 3.24Å; L103-F107 HydrophobicContact CB-CE2 4.4Å; L103-F107 HydrophobicContact CD2-CE1 4.4Å; L103-F107 HydrophobicContact CD2-CE2 4.39Å; L103-F107 HydrophobicContact CD2-CZ 4Å; L103-F107 WeakPolarHBondContact O-CB 3.43Å; L103-F107 WeakPolarHBondContact O-CG 3.45Å; L103-F107 PolarHBondContact O-N 3.19Å
104C93.9Very high92.6Very high0 Ų045.7 Ų45.70%024%0.24CC..Hα-helixtrans-54.2-50.2173.1168.90000111.7D97 S100 T108 L172 C183D97-C104 WeakPolarHBondContact O-CB 3.15Å; S100-C104 PolarHBondContact O-N 3.35Å; S100-C104 VanDerWaalsContact O-N 3.1Å; C104-T108 WeakPolarHBondContact O-CB 3.49Å; C104-T108 PolarHBondContact O-N 2.95Å; C104-T108 VanDerWaalsContact O-N 3.15Å; C104-T108 PolarHBondContact O-OG1 3.23Å; C104-L172 HydrophobicContact CB-CD2 4.1Å; C104-L172 HydrophobicContact CB-CG 4.49Å; C104-C183 WeakPolarHBondContact CA-SG 3.21Å; C104-C183 HydrophobicContact CB-CB 3.79Å; C104-C183 WeakPolarHBondContact CB-SG 3.46Å; C104-C183 VanDerWaalsContact SG-CA 3.53Å; C104-C183 WeakPolarHBondContact SG-CB 3.49Å; C104-C183 CovalentContact SG-SG 2.03Å; C104-C183 PolarHBondContact SG-SG 3.24Å
105K95Very high92.9Very high45 Ų4542 Ų4220%0.19622%0.223CC..Hα-helixtrans-62.2-48.5177.7-76.2167178.2158.40111.9S101 L102 L103 Y109 L167 A170 D171S101-K105 WeakPolarHBondContact O-CB 3.24Å; S101-K105 WeakPolarHBondContact O-CG 3.23Å; S101-K105 PolarHBondContact O-N 3.24Å; S101-K105 PolarHBondContact OG-NZ 2.87Å; L102-K105 PolarHBondContact O-N 2.9Å; L103-K105 VanDerWaalsContact C-N 3.35Å; L103-K105 PolarHBondContact O-N 2.97Å; K105-Y109 WeakPolarHBondContact O-CB 3.27Å; K105-Y109 PolarHBondContact O-N 3.44Å; K105-L167 HydrophobicContact CB-CD2 4.18Å; K105-L167 WeakPolarHBondContact CD-O 3.38Å; K105-L167 WeakPolarHBondContact CE-O 3.28Å; K105-A170 WeakPolarHBondContact CE-O 3.29Å; K105-A170 WeakPolarHBondContact CG-O 3.44Å; K105-D171 WeakPolarHBondContact CE-OD2 2.99Å; K105-D171 IonicContact NZ-OD1 3.9Å; K105-D171 IonicContact NZ-OD2 2.82Å; K105-D171 PolarHBondContact NZ-OD2 2.94Å
106L95.4Very high93.4Very high70 Ų7040 Ų4037%0.36621%0.213SC..Hα-helixtrans-66.3-44.8-176-177.365.2000112.1L102 L103 Y109 L110L102-L106 VanDerWaalsContact O-CB 3.22Å; L102-L106 WeakPolarHBondContact O-CB 3.28Å; L102-L106 PolarHBondContact O-N 2.92Å; L103-L106 PolarHBondContact O-N 3.24Å; L106-Y109 PolarHBondContact O-N 2.98Å; L106-L110 HydrophobicContact CD1-CD1 3.96Å; L106-L110 HydrophobicContact CD1-CG 4.01Å; L106-L110 HydrophobicContact CD2-CD1 4.42Å; L106-L110 HydrophobicContact CG-CD1 3.83Å; L106-L110 HydrophobicContact CG-CG 4.25Å; L106-L110 WeakPolarHBondContact O-CB 3.37Å; L106-L110 VanDerWaalsContact O-CG 3.26Å; L106-L110 WeakPolarHBondContact O-CG 3.5Å; L106-L110 PolarHBondContact O-N 2.82Å
107F94.7Very high93.9Very high32 Ų3239 Ų3914%0.1421%0.206CC..Hα-helixtrans-68.1-42.7179.7-69-20.2000112.2V72 I76 V96 D97 L103 Y109 L110 T111V72-F107 HydrophobicContact CG1-CB 3.71Å; V72-F107 HydrophobicContact CG1-CD1 3.85Å; V72-F107 HydrophobicContact CG1-CG 3.95Å; I76-F107 HydrophobicContact CD1-CE1 4.23Å; I76-F107 HydrophobicContact CD1-CE2 4.49Å; I76-F107 HydrophobicContact CD1-CZ 3.96Å; I76-F107 HydrophobicContact CG2-CD2 4.13Å; I76-F107 HydrophobicContact CG2-CE2 3.74Å; I76-F107 HydrophobicContact CG2-CZ 4.28Å; V96-F107 HydrophobicContact CB-CE2 3.97Å; V96-F107 HydrophobicContact CG1-CE2 3.7Å; V96-F107 HydrophobicContact CG1-CZ 4Å; D97-F107 HydrophobicContact CB-CD2 4.31Å; L103-F107 HydrophobicContact CB-CE2 4.4Å; L103-F107 HydrophobicContact CD2-CE1 4.4Å; L103-F107 HydrophobicContact CD2-CE2 4.39Å; L103-F107 HydrophobicContact CD2-CZ 4Å; L103-F107 WeakPolarHBondContact O-CB 3.43Å; L103-F107 WeakPolarHBondContact O-CG 3.45Å; L103-F107 PolarHBondContact O-N 3.19Å; F107-Y109 VanDerWaalsContact C-N 3.31Å; F107-Y109 PolarHBondContact O-N 2.78Å; F107-L110 PolarHBondContact O-N 3.34Å; F107-T111 WeakPolarHBondContact O-CB 3.28Å; F107-T111 PolarHBondContact O-N 3Å; F107-T111 PolarHBondContact O-OG1 3.37Å; F107-T111 VanDerWaalsContact O-OG1 3.07Å
108T93.2Very high94.5Very high31 Ų3138.1 Ų38.119%0.1920%0.203CC..Hα-helixtrans-58.7-47.1174-520000110.4C104 D112 H166 A170C104-T108 WeakPolarHBondContact O-CB 3.49Å; C104-T108 PolarHBondContact O-N 2.95Å; C104-T108 VanDerWaalsContact O-N 3.15Å; C104-T108 PolarHBondContact O-OG1 3.23Å; T108-D112 PolarHBondContact O-N 3.28Å; T108-D112 VanDerWaalsContact O-N 3.11Å; T108-H166 HydrophobicContact CG2-CB 4.49Å; T108-H166 WeakPolarHBondContact CG2-ND1 3.3Å; T108-A170 HydrophobicContact CG2-CB 4.32Å
109Y95.9Very high94.9Very high31 Ų3136.5 Ų36.512%0.12219%0.194CC..Hα-helixtrans-61.8-47.8177.8174.5-94.6000113K105 L106 F107 D112 A113 L160 N163 H166 L167K105-Y109 WeakPolarHBondContact O-CB 3.27Å; K105-Y109 PolarHBondContact O-N 3.44Å; L106-Y109 PolarHBondContact O-N 2.98Å; F107-Y109 VanDerWaalsContact C-N 3.31Å; F107-Y109 PolarHBondContact O-N 2.78Å; Y109-D112 PolarHBondContact O-N 3.46Å; Y109-A113 HydrophobicContact CE1-CB 4.45Å; Y109-A113 WeakPolarHBondContact O-CB 3.22Å; Y109-A113 PolarHBondContact O-N 2.96Å; Y109-L160 HydrophobicContact CE1-CD2 4.15Å; Y109-L160 WeakPolarHBondContact OH-CA 3.47Å; Y109-L160 WeakPolarHBondContact OH-CB 3.29Å; Y109-L160 VanDerWaalsContact OH-CD2 3.32Å; Y109-L160 WeakPolarHBondContact OH-CD2 3.03Å; Y109-L160 PolarHBondContact OH-O 3.44Å; Y109-L160 VanDerWaalsContact OH-O 3.12Å; Y109-N163 HydrophobicContact CD2-CB 3.95Å; Y109-N163 VanDerWaalsContact CD2-O 3.31Å; Y109-N163 WeakPolarHBondContact CD2-O 3.23Å; Y109-N163 HydrophobicContact CE2-CB 3.73Å; Y109-H166 HydrophobicContact CD2-CB 4.39Å; Y109-L167 HydrophobicContact CD1-CD2 4.44Å; Y109-L167 HydrophobicContact CD2-CD1 4.02Å; Y109-L167 HydrophobicContact CD2-CD2 4.14Å; Y109-L167 HydrophobicContact CD2-CG 3.73Å; Y109-L167 HydrophobicContact CE2-CD1 4.15Å; Y109-L167 HydrophobicContact CE2-CG 4.35Å; Y109-L167 HydrophobicContact CG-CD1 4.34Å; Y109-L167 HydrophobicContact CG-CD2 3.82Å; Y109-L167 HydrophobicContact CG-CG 3.95Å
110L96.6Very high95.3Very high53 Ų5331.6 Ų31.628%0.27717%0.171SC..Hα-helixtrans-66.9-39.2-177.3-75.3176.6000112.2I68 V72 L106 F107 S114I68-L110 HydrophobicContact CG2-CB 4.33Å; V72-L110 HydrophobicContact CG2-CB 4.31Å; V72-L110 HydrophobicContact CG2-CD1 4.42Å; L106-L110 HydrophobicContact CD1-CD1 3.96Å; L106-L110 HydrophobicContact CD1-CG 4.01Å; L106-L110 HydrophobicContact CD2-CD1 4.42Å; L106-L110 HydrophobicContact CG-CD1 3.83Å; L106-L110 HydrophobicContact CG-CG 4.25Å; L106-L110 WeakPolarHBondContact O-CB 3.37Å; L106-L110 VanDerWaalsContact O-CG 3.26Å; L106-L110 WeakPolarHBondContact O-CG 3.5Å; L106-L110 PolarHBondContact O-N 2.82Å; F107-L110 PolarHBondContact O-N 3.34Å; L110-S114 WeakPolarHBondContact O-CB 3.41Å; L110-S114 PolarHBondContact O-N 2.87Å; L110-S114 PolarHBondContact O-OG 2.93Å
111T94.8Very high95.6Very high22 Ų2229.6 Ų29.614%0.13516%0.157CC..Hα-helixtrans-60.4-59.7173.5-63.80000109.5Q69 V72 N73 F107 A113 S114 A115Q69-T111 PolarHBondContact NE2-O 2.94Å; V72-T111 VanDerWaalsContact CG1-OG1 3.22Å; V72-T111 WeakPolarHBondContact CG1-OG1 3.21Å; N73-T111 HydrophobicContact CB-CG2 3.95Å; F107-T111 WeakPolarHBondContact O-CB 3.28Å; F107-T111 PolarHBondContact O-N 3Å; F107-T111 PolarHBondContact O-OG1 3.37Å; F107-T111 VanDerWaalsContact O-OG1 3.07Å; T111-A113 VanDerWaalsContact C-N 3.35Å; T111-A113 PolarHBondContact O-N 3.12Å; T111-S114 PolarHBondContact O-N 3.22Å; T111-S114 PolarHBondContact O-OG 3.45Å; T111-S114 VanDerWaalsContact O-OG 3.04Å; T111-A115 PolarHBondContact O-N 3.3Å; T111-A115 VanDerWaalsContact O-N 3.07Å
112D94.1Very high95.8Very high28 Ų2828.1 Ų28.115%0.1515%0.146CC..Hα-helixtrans-68.2-34.6-173.4-67.9-39.4000112.9T108 Y109 L116 H166 Y200T108-D112 PolarHBondContact O-N 3.28Å; T108-D112 VanDerWaalsContact O-N 3.11Å; Y109-D112 PolarHBondContact O-N 3.46Å; D112-L116 WeakPolarHBondContact O-CB 3.26Å; D112-L116 PolarHBondContact O-N 3.35Å; D112-L116 VanDerWaalsContact O-N 3.07Å; D112-H166 IonicContact OD2-CE1 2.7Å; D112-H166 PolarHBondContact OD2-CE1 3.41Å; D112-H166 IonicContact OD2-ND1 2.97Å; D112-H166 PolarHBondContact OD2-ND1 3.01Å; D112-H166 IonicContact OD2-NE2 3.2Å; D112-Y200 WeakPolarHBondContact OD1-CD2 3.5Å
113A97.3Very high95.9Very high2 Ų222.7 Ų22.72%0.01712%0.118CC..Hα-helixtrans-66-44174.800000113Y109 T111 L116 I117 L160 N163Y109-A113 HydrophobicContact CE1-CB 4.45Å; Y109-A113 WeakPolarHBondContact O-CB 3.22Å; Y109-A113 PolarHBondContact O-N 2.96Å; T111-A113 VanDerWaalsContact C-N 3.35Å; T111-A113 PolarHBondContact O-N 3.12Å; A113-L116 PolarHBondContact O-N 3.33Å; A113-I117 WeakPolarHBondContact O-CB 3.39Å; A113-I117 WeakPolarHBondContact O-CD1 3.23Å; A113-I117 WeakPolarHBondContact O-CG1 3.47Å; A113-I117 PolarHBondContact O-N 3.29Å; A113-L160 HydrophobicContact CB-CD2 4.2Å; A113-N163 WeakPolarHBondContact CA-ND2 3.46Å; A113-N163 HydrophobicContact CB-CB 4.05Å
114S97.4Very high96Very high4 Ų422.2 Ų22.23%0.02812%0.115CC..Hα-helixtrans-68.7-35.1179.558.80000112.3Q69 L110 T111 I117 A118Q69-S114 PolarHBondContact NE2-OG 3.49Å; L110-S114 WeakPolarHBondContact O-CB 3.41Å; L110-S114 PolarHBondContact O-N 2.87Å; L110-S114 PolarHBondContact O-OG 2.93Å; T111-S114 PolarHBondContact O-N 3.22Å; T111-S114 PolarHBondContact O-OG 3.45Å; T111-S114 VanDerWaalsContact O-OG 3.04Å; S114-I117 PolarHBondContact O-N 3.3Å; S114-A118 WeakPolarHBondContact O-CB 3.48Å; S114-A118 PolarHBondContact O-N 3.42Å
115A95.7Very high96Very high10 Ų1022.2 Ų22.28%0.08312%0.115CC..Hα-helixtrans-62.3-46.2173.100000111T111 A118 A119 V204T111-A115 PolarHBondContact O-N 3.3Å; T111-A115 VanDerWaalsContact O-N 3.07Å; A115-A118 PolarHBondContact O-N 3.07Å; A115-A119 WeakPolarHBondContact O-CB 3.25Å; A115-A119 PolarHBondContact O-N 3.42Å; A115-V204 HydrophobicContact CB-CG1 3.98Å; A115-V204 HydrophobicContact CB-CG2 4.42Å
116L96.8Very high96Very high0 Ų020 Ų200%011%0.105CC..Hα-helixtrans-63.6-42.6177.8-166.870000111.9D112 A113 A119 F120 C159 L162 N163 L199 V204D112-L116 WeakPolarHBondContact O-CB 3.26Å; D112-L116 PolarHBondContact O-N 3.35Å; D112-L116 VanDerWaalsContact O-N 3.07Å; A113-L116 PolarHBondContact O-N 3.33Å; L116-A119 PolarHBondContact O-N 2.84Å; L116-F120 HydrophobicContact CD1-CD2 3.84Å; L116-F120 HydrophobicContact CD1-CE2 3.44Å; L116-F120 VanDerWaalsContact CD1-CE2 3.44Å; L116-F120 HydrophobicContact CD1-CZ 4.45Å; L116-F120 HydrophobicContact CG-CD2 4.03Å; L116-F120 HydrophobicContact CG-CE2 3.99Å; L116-F120 WeakPolarHBondContact O-CB 3.5Å; L116-F120 VanDerWaalsContact O-CD2 3.25Å; L116-F120 WeakPolarHBondContact O-CD2 3.38Å; L116-F120 PolarHBondContact O-N 3.41Å; L116-C159 HydrophobicContact CD2-CB 3.97Å; L116-C159 HydrophobicContact CG-CB 4.24Å; L116-L162 HydrophobicContact CD2-CB 4.36Å; L116-L162 HydrophobicContact CD2-CD1 4.37Å; L116-N163 VanDerWaalsContact CD2-ND2 3.27Å; L116-N163 WeakPolarHBondContact CD2-ND2 3.49Å; L116-L199 HydrophobicContact CD2-CD1 4.47Å; L116-L199 HydrophobicContact CD2-CD2 4.45Å; L116-V204 HydrophobicContact CB-CG2 4.07Å; L116-V204 HydrophobicContact CD1-CG2 3.65Å; L116-V204 HydrophobicContact CG-CG2 4.49Å
117I97.9Very high96Very high19 Ų1919.5 Ų19.510%0.09711%0.105CC..Hα-helixtrans-59.9-49.3175.1-71.2165.1000110.7A65 A113 S114 A119 F120 I121 I156 C159 L160A65-I117 HydrophobicContact CB-CG2 4.18Å; A113-I117 WeakPolarHBondContact O-CB 3.39Å; A113-I117 WeakPolarHBondContact O-CD1 3.23Å; A113-I117 WeakPolarHBondContact O-CG1 3.47Å; A113-I117 PolarHBondContact O-N 3.29Å; S114-I117 PolarHBondContact O-N 3.3Å; I117-A119 PolarHBondContact O-N 3.09Å; I117-F120 PolarHBondContact O-N 2.87Å; I117-I121 HydrophobicContact CG2-CD1 3.55Å; I117-I121 HydrophobicContact CG2-CG1 4.28Å; I117-I121 WeakPolarHBondContact O-CB 3.48Å; I117-I121 VanDerWaalsContact O-CG1 3.25Å; I117-I121 WeakPolarHBondContact O-CG1 3.27Å; I117-I121 PolarHBondContact O-N 3.03Å; I117-I156 HydrophobicContact CD1-CG2 4.14Å; I117-I156 HydrophobicContact CG2-CG1 4.02Å; I117-C159 HydrophobicContact CD1-CB 4.45Å; I117-C159 HydrophobicContact CG1-CB 3.54Å; I117-L160 HydrophobicContact CD1-CD2 4.31Å; I117-L160 HydrophobicContact CD1-CG 4.43Å
118A97.1Very high95.9Very high7 Ų718.3 Ų18.36%0.05810%0.1CC..Hα-helixtrans-58.7-47.1179.800000111.5A65 S114 A115 F120 I121 L122A65-A118 HydrophobicContact CB-CB 4Å; S114-A118 WeakPolarHBondContact O-CB 3.48Å; S114-A118 PolarHBondContact O-N 3.42Å; A115-A118 PolarHBondContact O-N 3.07Å; A118-F120 PolarHBondContact O-N 3.03Å; A118-I121 PolarHBondContact O-N 3.24Å; A118-L122 WeakPolarHBondContact O-CB 3.13Å; A118-L122 PolarHBondContact O-N 2.98Å
119A96.4Very high95.8Very high3 Ų316.9 Ų16.93%0.0259%0.091CC..Hα-helixtrans-64.2-42.6-179.500000112.6A115 L116 I117 L122 M123 V204 P208A115-A119 WeakPolarHBondContact O-CB 3.25Å; A115-A119 PolarHBondContact O-N 3.42Å; L116-A119 PolarHBondContact O-N 2.84Å; I117-A119 PolarHBondContact O-N 3.09Å; A119-L122 PolarHBondContact O-N 2.89Å; A119-M123 WeakPolarHBondContact O-CG 3.25Å; A119-M123 PolarHBondContact O-N 3.49Å; A119-V204 HydrophobicContact CB-CG1 4.43Å; A119-P208 HydrophobicContact CB-CB 4.13Å; A119-P208 HydrophobicContact CB-CG 3.76Å
120F97.4Very high95.6Very high45 Ų4516.6 Ų16.620%0.1979%0.093CC..Hα-helixtrans-70.6-36.8177.5-85.1-113.9000112.8L116 I117 A118 L122 M123 L124 V155 G203 L207L116-F120 HydrophobicContact CD1-CD2 3.84Å; L116-F120 HydrophobicContact CD1-CE2 3.44Å; L116-F120 VanDerWaalsContact CD1-CE2 3.44Å; L116-F120 HydrophobicContact CD1-CZ 4.45Å; L116-F120 HydrophobicContact CG-CD2 4.03Å; L116-F120 HydrophobicContact CG-CE2 3.99Å; L116-F120 WeakPolarHBondContact O-CB 3.5Å; L116-F120 VanDerWaalsContact O-CD2 3.25Å; L116-F120 WeakPolarHBondContact O-CD2 3.38Å; L116-F120 PolarHBondContact O-N 3.41Å; I117-F120 PolarHBondContact O-N 2.87Å; A118-F120 PolarHBondContact O-N 3.03Å; F120-L122 VanDerWaalsContact C-N 3.31Å; F120-M123 HydrophobicContact CB-CE 4.18Å; F120-M123 HydrophobicContact CD1-CE 3.66Å; F120-M123 HydrophobicContact CD2-CE 3.64Å; F120-M123 HydrophobicContact CE1-CE 3.87Å; F120-M123 HydrophobicContact CE2-CE 3.84Å; F120-M123 HydrophobicContact CG-CE 3.55Å; F120-M123 HydrophobicContact CZ-CE 3.96Å; F120-M123 PolarHBondContact O-N 3.38Å; F120-L124 WeakPolarHBondContact O-CG 3.48Å; F120-L124 PolarHBondContact O-N 3.49Å; F120-V155 HydrophobicContact CB-CG1 3.61Å; F120-V155 HydrophobicContact CD1-CG1 4.36Å; F120-V155 HydrophobicContact CG-CG1 4.38Å; F120-G203 WeakPolarHBondContact CE2-O 3.33Å; F120-L207 HydrophobicContact CZ-CD2 4.37Å
121I97.3Very high95.3Very high0 Ų016 Ų160%09%0.092CC..Hα-helixtrans-62.9-41.2172.3-71.3174.3000110.2Y58 W61 M62 I117 A118 M123 L124 F125 I152Y58-I121 HydrophobicContact CD1-CG2 4.24Å; W61-I121 HydrophobicContact CB-CD1 3.62Å; M62-I121 HydrophobicContact CB-CG2 4.22Å; M62-I121 HydrophobicContact CE-CG2 3.93Å; I117-I121 HydrophobicContact CG2-CD1 3.55Å; I117-I121 HydrophobicContact CG2-CG1 4.28Å; I117-I121 WeakPolarHBondContact O-CB 3.48Å; I117-I121 VanDerWaalsContact O-CG1 3.25Å; I117-I121 WeakPolarHBondContact O-CG1 3.27Å; I117-I121 PolarHBondContact O-N 3.03Å; A118-I121 PolarHBondContact O-N 3.24Å; I121-M123 PolarHBondContact O-N 3.42Å; I121-L124 PolarHBondContact O-N 3.34Å; I121-F125 VanDerWaalsContact O-CB 3.26Å; I121-F125 WeakPolarHBondContact O-CB 3.25Å; I121-F125 PolarHBondContact O-N 3.1Å; I121-I152 HydrophobicContact CD1-CG2 4.49Å
122L96.5Very high95Very high7 Ų715.8 Ų15.84%0.0379%0.092CC..Hα-helixtrans-63.6-39.4176.3-175.660.6000112.2M62 A118 A119 F120 F125 S126 I212 I253 F257M62-L122 HydrophobicContact CE-CB 3.83Å; M62-L122 HydrophobicContact CE-CD1 3.81Å; M62-L122 HydrophobicContact CE-CG 4.41Å; A118-L122 WeakPolarHBondContact O-CB 3.13Å; A118-L122 PolarHBondContact O-N 2.98Å; A119-L122 PolarHBondContact O-N 2.89Å; F120-L122 VanDerWaalsContact C-N 3.31Å; L122-F125 WeakPolarHBondContact O-CB 3.33Å; L122-F125 PolarHBondContact O-N 3.32Å; L122-S126 PolarHBondContact O-N 3.38Å; L122-S126 PolarHBondContact O-OG 2.88Å; L122-I212 HydrophobicContact CB-CD1 4.37Å; L122-I212 HydrophobicContact CD2-CD1 3.48Å; L122-I212 VanDerWaalsContact CD2-CD1 3.48Å; L122-I212 HydrophobicContact CG-CD1 3.62Å; L122-I212 HydrophobicContact CG-CG1 4.42Å; L122-I253 HydrophobicContact CD1-CG2 3.93Å; L122-F257 HydrophobicContact CD2-CB 3.84Å; L122-F257 HydrophobicContact CD2-CD1 3.9Å; L122-F257 HydrophobicContact CD2-CD2 3.94Å; L122-F257 HydrophobicContact CD2-CE1 4.49Å; L122-F257 HydrophobicContact CD2-CG 3.59Å
123M96.6Very high94.7Very high17 Ų1715.9 Ų15.98%0.0849%0.092CC..Hα-helixtrans-62.2-48.6171.5-71.6-167.6-68.300112.1A119 F120 I121 F125 S126 V127 L207 P208 F211 I212A119-M123 WeakPolarHBondContact O-CG 3.25Å; A119-M123 PolarHBondContact O-N 3.49Å; F120-M123 HydrophobicContact CB-CE 4.18Å; F120-M123 HydrophobicContact CD1-CE 3.66Å; F120-M123 HydrophobicContact CD2-CE 3.64Å; F120-M123 HydrophobicContact CE1-CE 3.87Å; F120-M123 HydrophobicContact CE2-CE 3.84Å; F120-M123 HydrophobicContact CG-CE 3.55Å; F120-M123 HydrophobicContact CZ-CE 3.96Å; F120-M123 PolarHBondContact O-N 3.38Å; I121-M123 PolarHBondContact O-N 3.42Å; M123-F125 VanDerWaalsContact C-N 3.25Å; M123-F125 PolarHBondContact O-N 2.99Å; M123-S126 WeakPolarHBondContact O-CA 3.05Å; M123-S126 WeakPolarHBondContact O-CB 3.18Å; M123-S126 PolarHBondContact O-N 3Å; M123-V127 PolarHBondContact O-N 3.26Å; M123-L207 HydrophobicContact CE-CD2 4.42Å; M123-L207 HydrophobicContact SD-CG 4.26Å; M123-P208 HydrophobicContact CE-CG 4.08Å; M123-P208 HydrophobicContact CG-CB 4.02Å; M123-P208 HydrophobicContact CG-CG 4.45Å; M123-P208 HydrophobicContact SD-CB 4.1Å; M123-P208 HydrophobicContact SD-CG 4.04Å; M123-F211 HydrophobicContact CB-CD1 3.88Å; M123-F211 HydrophobicContact CB-CE1 4.13Å; M123-F211 HydrophobicContact CG-CB 4.25Å; M123-F211 HydrophobicContact CG-CD1 3.82Å; M123-F211 HydrophobicContact CG-CG 4.2Å; M123-F211 HydrophobicContact SD-CB 3.9Å; M123-F211 HydrophobicContact SD-CD1 4.2Å; M123-F211 HydrophobicContact SD-CG 3.99Å; M123-I212 HydrophobicContact CG-CG1 4.46Å
124L96.1Very high94.3Very high40 Ų4019.8 Ų19.821%0.20911%0.107CC..Hα-helixtrans-57.7-41.9176.4-75.9179.3000111.7Y58 F120 I121 S126 V127 D128 I151 V155Y58-L124 HydrophobicContact CE1-CB 4.03Å; Y58-L124 HydrophobicContact CE1-CD1 4.46Å; F120-L124 WeakPolarHBondContact O-CG 3.48Å; F120-L124 PolarHBondContact O-N 3.49Å; I121-L124 PolarHBondContact O-N 3.34Å; L124-S126 VanDerWaalsContact C-N 3.29Å; L124-S126 PolarHBondContact O-N 2.92Å; L124-V127 PolarHBondContact O-N 3.37Å; L124-D128 WeakPolarHBondContact O-CB 3.32Å; L124-D128 PolarHBondContact O-N 3.11Å; L124-I151 HydrophobicContact CD1-CG2 3.79Å; L124-I151 HydrophobicContact CD2-CG2 3.82Å; L124-I151 HydrophobicContact CG-CG2 4.47Å; L124-V155 HydrophobicContact CD1-CB 4.22Å; L124-V155 HydrophobicContact CD1-CG1 4.42Å; L124-V155 HydrophobicContact CD1-CG2 3.76Å; L124-V155 HydrophobicContact CG-CG2 4.47Å
125F94.6Very high93.7Very high0 Ų024.7 Ų24.70%013%0.128CC..Hα-helixtrans-61-42.1176.7-166.4-179000110.8F55 Y58 M62 I121 L122 M123 V127 D128 R129 H250F55-F125 HydrophobicContact CD1-CZ 4.49Å; F55-F125 AromaticContact CD2-CE2 3.39Å; F55-F125 HydrophobicContact CD2-CE2 3.39Å; F55-F125 AromaticContact CD2-CZ 3.34Å; F55-F125 HydrophobicContact CD2-CZ 3.34Å; F55-F125 HydrophobicContact CE1-CZ 4.4Å; F55-F125 HydrophobicContact CE2-CE1 4.4Å; F55-F125 AromaticContact CE2-CE2 3.72Å; F55-F125 HydrophobicContact CE2-CE2 3.72Å; F55-F125 AromaticContact CE2-CZ 3.25Å; F55-F125 HydrophobicContact CE2-CZ 3.25Å; F55-F125 HydrophobicContact CG-CE2 4.11Å; F55-F125 AromaticContact CG-CZ 3.98Å; F55-F125 HydrophobicContact CG-CZ 3.98Å; F55-F125 AromaticContact CZ-CZ 3.81Å; F55-F125 HydrophobicContact CZ-CZ 3.81Å; Y58-F125 HydrophobicContact CD2-CB 4.45Å; Y58-F125 AromaticContact CD2-CD2 3.93Å; Y58-F125 HydrophobicContact CD2-CD2 3.93Å; Y58-F125 HydrophobicContact CD2-CE2 4.41Å; Y58-F125 HydrophobicContact CD2-CG 4.29Å; Y58-F125 HydrophobicContact CG-CB 4.26Å; Y58-F125 HydrophobicContact CG-CD2 4.38Å; Y58-F125 HydrophobicContact CG-CG 4.3Å; M62-F125 HydrophobicContact CE-CD1 3.98Å; I121-F125 VanDerWaalsContact O-CB 3.26Å; I121-F125 WeakPolarHBondContact O-CB 3.25Å; I121-F125 PolarHBondContact O-N 3.1Å; L122-F125 WeakPolarHBondContact O-CB 3.33Å; L122-F125 PolarHBondContact O-N 3.32Å; M123-F125 VanDerWaalsContact C-N 3.25Å; M123-F125 PolarHBondContact O-N 2.99Å; F125-V127 PolarHBondContact O-N 3.27Å; F125-D128 WeakPolarHBondContact O-CB 3.2Å; F125-D128 PolarHBondContact O-N 3.26Å; F125-R129 HydrophobicContact CD2-CG 4.01Å; F125-R129 HydrophobicContact CE2-CG 4.1Å; F125-R129 WeakPolarHBondContact O-CG 3.43Å; F125-R129 PolarHBondContact O-N 3.1Å; F125-H250 AromaticContact CD1-ND1 3.51Å; F125-H250 AromaticContact CD2-ND1 3.88Å; F125-H250 AromaticContact CE1-ND1 3.84Å; F125-H250 AromaticContact CG-CE1 3.91Å; F125-H250 AromaticContact CG-ND1 3.55Å; F125-H250 HydrophobicContact CZ-CB 4.47Å
126S94.9Very high92.9Very high0 Ų028.7 Ų28.70%015%0.153CC..Hα-helixtrans-62.2-43.5176.4-51.70000112.4L122 M123 L124 D128 R129 V130 T215 H250L122-S126 PolarHBondContact O-N 3.38Å; L122-S126 PolarHBondContact O-OG 2.88Å; M123-S126 WeakPolarHBondContact O-CA 3.05Å; M123-S126 WeakPolarHBondContact O-CB 3.18Å; M123-S126 PolarHBondContact O-N 3Å; L124-S126 VanDerWaalsContact C-N 3.29Å; L124-S126 PolarHBondContact O-N 2.92Å; S126-D128 VanDerWaalsContact C-N 3.35Å; S126-D128 PolarHBondContact O-N 3.4Å; S126-R129 PolarHBondContact O-N 3.11Å; S126-V130 WeakPolarHBondContact O-CG2 3.34Å; S126-V130 PolarHBondContact O-N 2.96Å; S126-T215 WeakPolarHBondContact CB-OG1 3.29Å; S126-H250 WeakPolarHBondContact CA-NE2 3.38Å; S126-H250 PolarHBondContact N-CE1 2.92Å; S126-H250 PolarHBondContact OG-CE1 3.4Å; S126-H250 VanDerWaalsContact OG-CE1 3.24Å; S126-H250 PolarHBondContact OG-NE2 3.04Å
127V94Very high91.8Very high58 Ų5838.4 Ų38.435%0.35220%0.195SC..Hα-helixtrans-59.3-47.9173.4176.90000111M123 L124 F125 R129 V130 C131 F211M123-V127 PolarHBondContact O-N 3.26Å; L124-V127 PolarHBondContact O-N 3.37Å; F125-V127 PolarHBondContact O-N 3.27Å; V127-R129 VanDerWaalsContact C-N 3.27Å; V127-R129 PolarHBondContact O-N 3.45Å; V127-V130 PolarHBondContact O-N 2.83Å; V127-C131 WeakPolarHBondContact O-CB 3.44Å; V127-C131 PolarHBondContact O-N 3.41Å; V127-C131 PolarHBondContact O-SG 3.05Å; V127-C131 VanDerWaalsContact O-SG 3.38Å; V127-F211 HydrophobicContact CG2-CE1 3.54Å; V127-F211 HydrophobicContact CG2-CZ 3.32Å
128D92.6Very high90.5Very high7 Ų743.4 Ų43.44%0.03722%0.218CC..Hα-helixtrans-60-39.9-179.3-176.662.7000111.7R54 Y58 L124 F125 S126 S132R54-D128 IonicContact CZ-OD1 3Å; R54-D128 IonicContact NE-OD1 2.7Å; R54-D128 IonicContact NH1-OD1 2.84Å; R54-D128 PolarHBondContact NH1-OD1 2.95Å; R54-D128 IonicContact NH2-OD1 3.37Å; R54-D128 PolarHBondContact NH2-OD1 3.48Å; Y58-D128 HydrophobicContact CE2-CB 3.86Å; L124-D128 WeakPolarHBondContact O-CB 3.32Å; L124-D128 PolarHBondContact O-N 3.11Å; F125-D128 WeakPolarHBondContact O-CB 3.2Å; F125-D128 PolarHBondContact O-N 3.26Å; S126-D128 VanDerWaalsContact C-N 3.35Å; S126-D128 PolarHBondContact O-N 3.4Å; D128-S132 VanDerWaalsContact O-CB 3.3Å; D128-S132 WeakPolarHBondContact O-CB 3.35Å; D128-S132 PolarHBondContact O-N 2.89Å; D128-S132 PolarHBondContact O-OG 3.43Å
129R91.4Very high89Confident2 Ų245.8 Ų45.81%0.00823%0.227CC..Hα-helixtrans-65.4-45.8174.5-67.8-53.689.8178.35.9112F125 S126 V127 C131 S132 I133 I219 H250F125-R129 HydrophobicContact CD2-CG 4.01Å; F125-R129 HydrophobicContact CE2-CG 4.1Å; F125-R129 WeakPolarHBondContact O-CG 3.43Å; F125-R129 PolarHBondContact O-N 3.1Å; S126-R129 PolarHBondContact O-N 3.11Å; V127-R129 VanDerWaalsContact C-N 3.27Å; V127-R129 PolarHBondContact O-N 3.45Å; R129-C131 PolarHBondContact O-N 3.49Å; R129-S132 PolarHBondContact O-N 3.45Å; R129-I133 WeakPolarHBondContact O-CG1 3.39Å; R129-I133 PolarHBondContact O-N 3.46Å; R129-I219 HydrophobicContact CB-CD1 3.9Å; R129-H250 HydrophobicContact CG-CB 4.2Å
130V92.7Very high87.5Confident25 Ų2551.9 Ų51.915%0.15226%0.255CS..Hα-helixtrans-58.3-50.5175.4173.10000110.6S126 V127 S132 I133 Y134 T215 L218 I219S126-V130 WeakPolarHBondContact O-CG2 3.34Å; S126-V130 PolarHBondContact O-N 2.96Å; V127-V130 PolarHBondContact O-N 2.83Å; V130-S132 VanDerWaalsContact C-N 3.34Å; V130-S132 PolarHBondContact O-N 3.43Å; V130-I133 PolarHBondContact O-N 3.27Å; V130-Y134 HydrophobicContact CG1-CD2 3.91Å; V130-Y134 HydrophobicContact CG1-CE2 4.1Å; V130-Y134 VanDerWaalsContact O-CD2 3.28Å; V130-Y134 WeakPolarHBondContact O-CD2 3.18Å; V130-Y134 PolarHBondContact O-N 3.07Å; V130-T215 HydrophobicContact CG2-CG2 4.08Å; V130-L218 HydrophobicContact CG1-CD1 4.5Å; V130-L218 HydrophobicContact CG2-CB 4.37Å; V130-I219 HydrophobicContact CG2-CD1 4.18Å; V130-I219 HydrophobicContact CG2-CG1 3.79Å
131C90.6Very high85.9Confident40 Ų4051.8 Ų51.827%0.2726%0.255SS..Hα-helixtrans-58.1-44.8179.1-71.20000112.4V127 R129 I133 K135 F139V127-C131 WeakPolarHBondContact O-CB 3.44Å; V127-C131 PolarHBondContact O-N 3.41Å; V127-C131 PolarHBondContact O-SG 3.05Å; V127-C131 VanDerWaalsContact O-SG 3.38Å; R129-C131 PolarHBondContact O-N 3.49Å; C131-I133 PolarHBondContact O-N 3.34Å; C131-K135 PolarHBondContact O-N 3.47Å; C131-F139 HydrophobicContact CB-CD1 4.39Å; C131-F139 HydrophobicContact CB-CD2 4.42Å; C131-F139 HydrophobicContact CB-CE1 4.24Å; C131-F139 HydrophobicContact CB-CE2 4.27Å; C131-F139 HydrophobicContact CB-CG 4.47Å; C131-F139 HydrophobicContact CB-CZ 4.17Å
132S88Confident84.4Confident18 Ų1855.1 Ų55.113%0.12628%0.279CS..Hα-helixtrans-64.7-39.5-179.2-57.90000112.3R54 D128 R129 V130R54-S132 PolarHBondContact NH2-OG 3.45Å; D128-S132 VanDerWaalsContact O-CB 3.3Å; D128-S132 WeakPolarHBondContact O-CB 3.35Å; D128-S132 PolarHBondContact O-N 2.89Å; D128-S132 PolarHBondContact O-OG 3.43Å; R129-S132 PolarHBondContact O-N 3.45Å; V130-S132 VanDerWaalsContact C-N 3.34Å; V130-S132 PolarHBondContact O-N 3.43Å
133I87.1Confident83Confident29 Ų2958.4 Ų58.415%0.14930%0.302CS..Hα-helixtrans-76.3-36.4-178.8-60.6169.1000111.6R129 V130 C131 I219 K222 V247R129-I133 WeakPolarHBondContact O-CG1 3.39Å; R129-I133 PolarHBondContact O-N 3.46Å; V130-I133 PolarHBondContact O-N 3.27Å; C131-I133 PolarHBondContact O-N 3.34Å; I133-I219 HydrophobicContact CD1-CB 4.34Å; I133-I219 HydrophobicContact CD1-CG1 4.1Å; I133-I219 HydrophobicContact CD1-CG2 3.79Å; I133-K222 HydrophobicContact CB-CG 4.48Å; I133-K222 HydrophobicContact CG2-CB 3.92Å; I133-K222 HydrophobicContact CG2-CG 3.35Å; I133-V247 HydrophobicContact CD1-CG1 3.89Å; I133-V247 HydrophobicContact CD1-CG2 3.88Å; I133-V247 HydrophobicContact CG1-CG2 4.2Å
134Y88.3Confident82.2Confident84 Ų8460.8 Ų60.833%0.32931%0.313SS..Hα-helixtrans-77.6-30.6-179.4-83.7-101.7000113.1V130 L218 K222V130-Y134 HydrophobicContact CG1-CD2 3.91Å; V130-Y134 HydrophobicContact CG1-CE2 4.1Å; V130-Y134 VanDerWaalsContact O-CD2 3.28Å; V130-Y134 WeakPolarHBondContact O-CD2 3.18Å; V130-Y134 PolarHBondContact O-N 3.07Å; Y134-L218 HydrophobicContact CE2-CB 4.4Å; Y134-L218 PolarHBondContact OH-O 3.45Å; Y134-K222 HydrophobicContact CD1-CD 4.37Å; Y134-K222 HydrophobicContact CD2-CB 4.33Å; Y134-K222 HydrophobicContact CD2-CG 4.13Å; Y134-K222 HydrophobicContact CE1-CD 4.22Å; Y134-K222 HydrophobicContact CE2-CB 3.7Å; Y134-K222 HydrophobicContact CE2-CG 3.97Å; Y134-K222 HydrophobicContact CG-CG 4.49Å
135K85.5Confident81.8Confident108 Ų10859.7 Ų59.747%0.4731%0.308SS..  trans-132.865.1-174.7-70.6177.9163.5-158.60112.3C131 K137 Q138 F139C131-K135 PolarHBondContact O-N 3.47Å; K135-K137 VanDerWaalsContact C-N 3.26Å; K135-K137 PolarHBondContact O-N 3.26Å; K135-Q138 HydrophobicContact CB-CB 4.34Å; K135-Q138 VanDerWaalsContact NZ-OE1 3.08Å; K135-Q138 PolarHBondContact O-N 2.87Å; K135-F139 HydrophobicContact CB-CD2 3.78Å; K135-F139 HydrophobicContact CB-CE2 4.29Å; K135-F139 HydrophobicContact CD-CD2 4.34Å; K135-F139 HydrophobicContact CD-CE2 4.01Å; K135-F139 PolarHBondContact O-N 3.38Å
136P80Confident81.6Confident93 Ų9368.2 Ų68.260%0.60435%0.345SS*.THydrogen-bonded Turntrans-60.2-33.3-175.324.2-34.6000113.4
137K73.6Confident81.4Confident204 Ų20472.4 Ų72.489%0.88737%0.367SS*.THydrogen-bonded Turntrans-75-29.8-179.9-66.6-171177.7-172.70114.3K135K135-K137 VanDerWaalsContact C-N 3.26Å; K135-K137 PolarHBondContact O-N 3.26Å
138Q69.9Low81.4Confident125 Ų12569.8 Ų69.858%0.58435%0.351SS*.THydrogen-bonded Turntrans-91.4-31.2-178.1-68.9-177.7-15.900111.5K135 E140K135-Q138 HydrophobicContact CB-CB 4.34Å; K135-Q138 VanDerWaalsContact NZ-OE1 3.08Å; K135-Q138 PolarHBondContact O-N 2.87Å; Q138-E140 PolarHBondContact O-N 3.42Å
139F65.4Low81.4Confident57 Ų5773.2 Ų73.225%0.2537%0.367CS..  trans-102.359179-74.3-89.7000110.1C131 K135 Q141C131-F139 HydrophobicContact CB-CD1 4.39Å; C131-F139 HydrophobicContact CB-CD2 4.42Å; C131-F139 HydrophobicContact CB-CE1 4.24Å; C131-F139 HydrophobicContact CB-CE2 4.27Å; C131-F139 HydrophobicContact CB-CG 4.47Å; C131-F139 HydrophobicContact CB-CZ 4.17Å; K135-F139 HydrophobicContact CB-CD2 3.78Å; K135-F139 HydrophobicContact CB-CE2 4.29Å; K135-F139 HydrophobicContact CD-CD2 4.34Å; K135-F139 HydrophobicContact CD-CE2 4.01Å; K135-F139 PolarHBondContact O-N 3.38Å; F139-Q141 PolarHBondContact O-N 2.87Å
140E65.4Low81.6Confident130 Ų13077.7 Ų77.761%0.60739%0.39SS*.  trans-59.1127.8166-162.1176.6-179.500108Q138 S142 S143Q138-E140 PolarHBondContact O-N 3.42Å; E140-S142 PolarHBondContact O-N 2.85Å; E140-S143 PolarHBondContact O-N 3.17Å
141Q63.2Low81.8Confident44 Ų4479.3 Ų79.321%0.20640%0.397CS..THydrogen-bonded Turntrans-60.3-22.7-161.2-164.6168.975.400113.6C53 F139 E243C53-Q141 HydrophobicContact CB-CG 4.47Å; C53-Q141 WeakPolarHBondContact SG-CG 3.48Å; C53-Q141 PolarHBondContact SG-OE1 2.95Å; F139-Q141 PolarHBondContact O-N 2.87Å; Q141-E243 VanDerWaalsContact NE2-CD 3.32Å; Q141-E243 PolarHBondContact NE2-OE1 3.38Å; Q141-E243 VanDerWaalsContact NE2-OE1 3.13Å; Q141-E243 PolarHBondContact NE2-OE2 3.06Å; Q141-E243 PolarHBondContact OE1-OE1 3.34Å
142S66.3Low82.1Confident70 Ų7077.4 Ų77.449%0.4938%0.384SS..THydrogen-bonded Turntrans-86.2-23.4179.756.80000114.7E140 H144E140-S142 PolarHBondContact O-N 2.85Å; S142-H144 VanDerWaalsContact C-N 3.3Å; S142-H144 PolarHBondContact O-N 3.33Å
143S67.2Low82.6Confident75 Ų7579.7 Ų79.752%0.52440%0.398SS..THydrogen-bonded Turntrans-74-16-162.6-164.50000114.6E140E140-S143 PolarHBondContact O-N 3.17Å
144H80.6Confident83.1Confident68 Ų6882.5 Ų82.532%0.31541%0.412SS..THydrogen-bonded Turntrans-131.428.1-173-61.6-57.8000115.3S142 K146 L147 A148S142-H144 VanDerWaalsContact C-N 3.3Å; S142-H144 PolarHBondContact O-N 3.33Å; H144-K146 PolarHBondContact O-N 2.97Å; H144-L147 HydrophobicContact CB-CB 4.36Å; H144-L147 PolarHBondContact O-N 3.44Å; H144-A148 PolarHBondContact O-N 3.1Å
145V87.3Confident83.5Confident17 Ų1779.4 Ų79.410%0.10340%0.401CS..Hα-helixtrans-64-39.3-178.5179.80000112.6N52 R54 L57 L147 A148 H149N52-V145 HydrophobicContact CB-CG1 4.34Å; N52-V145 HydrophobicContact CB-CG2 4.13Å; R54-V145 HydrophobicContact CG-CG2 4.18Å; L57-V145 HydrophobicContact CD1-CG1 3.84Å; V145-L147 VanDerWaalsContact C-N 3.35Å; V145-A148 PolarHBondContact O-N 3.47Å; V145-H149 PolarHBondContact O-N 2.99Å; V145-H149 VanDerWaalsContact O-N 3.12Å; V145-H149 PolarHBondContact O-ND1 3.31Å
146K89.7Confident84.1Confident178 Ų17875.3 Ų75.377%0.77439%0.385SS*.Hα-helixtrans-64-40.5175.8-67.5-176.5-179.4178.70112H144 H149 I150H144-K146 PolarHBondContact O-N 2.97Å; K146-H149 WeakPolarHBondContact O-CB 3.44Å; K146-H149 PolarHBondContact O-N 2.92Å; K146-I150 WeakPolarHBondContact O-CG1 3.24Å; K146-I150 PolarHBondContact O-N 3.5Å; K146-I150 VanDerWaalsContact O-N 3.16Å
147L91.6Very high85Confident89 Ų8975 Ų7547%0.46638%0.377SS..Hα-helixtrans-65.5-41.2177-178.963.2000111H144 V145 H149 I150 I151H144-L147 HydrophobicContact CB-CB 4.36Å; H144-L147 PolarHBondContact O-N 3.44Å; V145-L147 VanDerWaalsContact C-N 3.35Å; L147-H149 VanDerWaalsContact C-N 3.35Å; L147-H149 PolarHBondContact O-N 2.89Å; L147-I150 PolarHBondContact O-N 3.4Å; L147-I151 HydrophobicContact CD1-CD1 4.18Å; L147-I151 HydrophobicContact CD1-CG1 4.34Å; L147-I151 HydrophobicContact CD2-CD1 4.47Å; L147-I151 HydrophobicContact CG-CD1 3.87Å; L147-I151 HydrophobicContact CG-CG1 4.43Å; L147-I151 WeakPolarHBondContact O-CG1 3.11Å; L147-I151 PolarHBondContact O-N 3.45Å
148A92.8Very high86.1Confident3 Ų369.2 Ų69.23%0.02536%0.355CS..Hα-helixtrans-60.3-42.7175.900000112.2R54 L57 H144 V145 I150 I151 I152R54-A148 HydrophobicContact CB-CB 4.22Å; R54-A148 HydrophobicContact CG-CB 3.8Å; L57-A148 HydrophobicContact CD1-CB 4.25Å; H144-A148 PolarHBondContact O-N 3.1Å; V145-A148 PolarHBondContact O-N 3.47Å; A148-I150 PolarHBondContact O-N 3.27Å; A148-I151 PolarHBondContact O-N 3.13Å; A148-I152 WeakPolarHBondContact O-CB 3.22Å; A148-I152 VanDerWaalsContact O-CG1 3.23Å; A148-I152 WeakPolarHBondContact O-CG1 3.2Å; A148-I152 PolarHBondContact O-N 3.44Å
149H93.6Very high87.5Confident78 Ų7863.3 Ų63.336%0.36133%0.327SS..Hα-helixtrans-56.3-50.4172.7-80.688.2000111.9L57 V145 K146 L147 I151 I152 T153L57-H149 WeakPolarHBondContact CD1-CE1 3.45Å; L57-H149 WeakPolarHBondContact CD1-ND1 3.21Å; L57-H149 WeakPolarHBondContact CD2-CE1 3.35Å; L57-H149 WeakPolarHBondContact CD2-NE2 3.24Å; V145-H149 PolarHBondContact O-N 2.99Å; V145-H149 VanDerWaalsContact O-N 3.12Å; V145-H149 PolarHBondContact O-ND1 3.31Å; K146-H149 WeakPolarHBondContact O-CB 3.44Å; K146-H149 PolarHBondContact O-N 2.92Å; L147-H149 VanDerWaalsContact C-N 3.35Å; L147-H149 PolarHBondContact O-N 2.89Å; H149-I151 VanDerWaalsContact C-N 3.35Å; H149-I151 PolarHBondContact O-N 3.36Å; H149-I152 PolarHBondContact O-N 2.86Å; H149-T153 WeakPolarHBondContact O-CB 3.44Å; H149-T153 PolarHBondContact O-N 2.92Å; H149-T153 PolarHBondContact O-OG1 2.91Å
150I96Very high89Confident96 Ų9663.4 Ų63.449%0.49233%0.33SS..Hα-helixtrans-58.7-47.1-179.7-66.6166.1000110.7K146 L147 A148 T153 I154K146-I150 WeakPolarHBondContact O-CG1 3.24Å; K146-I150 PolarHBondContact O-N 3.5Å; K146-I150 VanDerWaalsContact O-N 3.16Å; L147-I150 PolarHBondContact O-N 3.4Å; A148-I150 PolarHBondContact O-N 3.27Å; I150-T153 PolarHBondContact O-N 2.9Å; I150-I154 HydrophobicContact CG2-CD1 3.69Å; I150-I154 HydrophobicContact CG2-CG1 4.41Å; I150-I154 WeakPolarHBondContact O-CB 3.34Å; I150-I154 VanDerWaalsContact O-CG1 3.26Å; I150-I154 WeakPolarHBondContact O-CG1 3.49Å; I150-I154 PolarHBondContact O-N 3.45Å
151I96.5Very high90.5Very high60 Ų6061.9 Ų61.931%0.30833%0.325SS..Hα-helixtrans-62.1-46.5179.8-67.6169.9000111L124 L147 A148 H149 T153 I154 V155L124-I151 HydrophobicContact CD1-CG2 3.79Å; L124-I151 HydrophobicContact CD2-CG2 3.82Å; L124-I151 HydrophobicContact CG-CG2 4.47Å; L147-I151 HydrophobicContact CD1-CD1 4.18Å; L147-I151 HydrophobicContact CD1-CG1 4.34Å; L147-I151 HydrophobicContact CD2-CD1 4.47Å; L147-I151 HydrophobicContact CG-CD1 3.87Å; L147-I151 HydrophobicContact CG-CG1 4.43Å; L147-I151 WeakPolarHBondContact O-CG1 3.11Å; L147-I151 PolarHBondContact O-N 3.45Å; A148-I151 PolarHBondContact O-N 3.13Å; H149-I151 VanDerWaalsContact C-N 3.35Å; H149-I151 PolarHBondContact O-N 3.36Å; I151-T153 PolarHBondContact O-N 3.27Å; I151-I154 PolarHBondContact O-N 2.88Å; I151-V155 WeakPolarHBondContact O-CG2 3.49Å; I151-V155 PolarHBondContact O-N 3.25Å
152I96.9Very high92.1Very high0 Ų062.3 Ų62.30%033%0.329CS..Hα-helixtrans-61.4-46.1178.6-67.1165.3000110.4L57 Y58 W61 I121 A148 H149 I154 V155 I156L57-I152 HydrophobicContact CB-CD1 3.98Å; Y58-I152 HydrophobicContact CD1-CD1 3.57Å; Y58-I152 HydrophobicContact CD1-CG1 3.87Å; Y58-I152 HydrophobicContact CE1-CD1 3.6Å; Y58-I152 HydrophobicContact CE1-CG1 3.62Å; Y58-I152 HydrophobicContact CG-CD1 4.44Å; W61-I152 HydrophobicContact CB-CG2 4.28Å; W61-I152 HydrophobicContact CD2-CG2 4.15Å; W61-I152 HydrophobicContact CG-CG2 3.78Å; I121-I152 HydrophobicContact CD1-CG2 4.49Å; A148-I152 WeakPolarHBondContact O-CB 3.22Å; A148-I152 VanDerWaalsContact O-CG1 3.23Å; A148-I152 WeakPolarHBondContact O-CG1 3.2Å; A148-I152 PolarHBondContact O-N 3.44Å; H149-I152 PolarHBondContact O-N 2.86Å; I152-I154 PolarHBondContact O-N 2.95Å; I152-V155 PolarHBondContact O-N 3.49Å; I152-I156 HydrophobicContact CG2-CD1 3.73Å; I152-I156 HydrophobicContact CG2-CG1 4.37Å; I152-I156 WeakPolarHBondContact O-CG1 3.32Å; I152-I156 PolarHBondContact O-N 3.31Å
153T97.2Very high93.5Very high66 Ų6659.2 Ų59.241%0.40531%0.306SS..Hα-helixtrans-60.5-44177.8-600000111.8H149 I150 I151 V155 I156 I157H149-T153 WeakPolarHBondContact O-CB 3.44Å; H149-T153 PolarHBondContact O-N 2.92Å; H149-T153 PolarHBondContact O-OG1 2.91Å; I150-T153 PolarHBondContact O-N 2.9Å; I151-T153 PolarHBondContact O-N 3.27Å; T153-V155 PolarHBondContact O-N 3.37Å; T153-I156 PolarHBondContact O-N 2.94Å; T153-I157 HydrophobicContact CG2-CD1 3.89Å; T153-I157 VanDerWaalsContact O-CG1 3.29Å; T153-I157 WeakPolarHBondContact O-CG1 3.29Å; T153-I157 PolarHBondContact O-N 2.92Å
154I97.8Very high94.9Very high87 Ų8759.1 Ų59.145%0.44630%0.3SS..Hα-helixtrans-60.5-46.5176.2-71168.1000110.7I150 I151 I152 I156 I157 I158I150-I154 HydrophobicContact CG2-CD1 3.69Å; I150-I154 HydrophobicContact CG2-CG1 4.41Å; I150-I154 WeakPolarHBondContact O-CB 3.34Å; I150-I154 VanDerWaalsContact O-CG1 3.26Å; I150-I154 WeakPolarHBondContact O-CG1 3.49Å; I150-I154 PolarHBondContact O-N 3.45Å; I151-I154 PolarHBondContact O-N 2.88Å; I152-I154 PolarHBondContact O-N 2.95Å; I154-I156 PolarHBondContact O-N 3.5Å; I154-I157 PolarHBondContact O-N 3.42Å; I154-I158 HydrophobicContact CG2-CD1 3.65Å; I154-I158 HydrophobicContact CG2-CG1 4.36Å; I154-I158 VanDerWaalsContact O-CG1 3.3Å; I154-I158 WeakPolarHBondContact O-CG1 3.49Å; I154-I158 PolarHBondContact O-N 3.48Å
155V97.7Very high95.5Very high19 Ų1957.1 Ų57.112%0.11529%0.293CS..Hα-helixtrans-61.5-43.8178.6164.80000111.5F120 L124 I151 I152 T153 I157 I158 C159F120-V155 HydrophobicContact CB-CG1 3.61Å; F120-V155 HydrophobicContact CD1-CG1 4.36Å; F120-V155 HydrophobicContact CG-CG1 4.38Å; L124-V155 HydrophobicContact CD1-CB 4.22Å; L124-V155 HydrophobicContact CD1-CG1 4.42Å; L124-V155 HydrophobicContact CD1-CG2 3.76Å; L124-V155 HydrophobicContact CG-CG2 4.47Å; I151-V155 WeakPolarHBondContact O-CG2 3.49Å; I151-V155 PolarHBondContact O-N 3.25Å; I152-V155 PolarHBondContact O-N 3.49Å; T153-V155 PolarHBondContact O-N 3.37Å; V155-I157 PolarHBondContact O-N 3.37Å; V155-I158 PolarHBondContact O-N 3.16Å; V155-C159 WeakPolarHBondContact O-CB 3.31Å; V155-C159 PolarHBondContact O-N 3.38Å; V155-C159 PolarHBondContact O-SG 2.91Å
156I98.1Very high95.7Very high23 Ų2356.4 Ų56.412%0.11829%0.288CS..Hα-helixtrans-59.6-47.9176.4-69.6167.2000110.8W61 I117 I152 T153 I154 I158 C159 L160W61-I156 HydrophobicContact CD2-CD1 3.77Å; W61-I156 HydrophobicContact CE3-CD1 3.39Å; W61-I156 HydrophobicContact CG-CD1 4.49Å; W61-I156 HydrophobicContact CH2-CD1 4.03Å; W61-I156 HydrophobicContact CZ2-CD1 4.37Å; W61-I156 HydrophobicContact CZ3-CD1 3.54Å; I117-I156 HydrophobicContact CD1-CG2 4.14Å; I117-I156 HydrophobicContact CG2-CG1 4.02Å; I152-I156 HydrophobicContact CG2-CD1 3.73Å; I152-I156 HydrophobicContact CG2-CG1 4.37Å; I152-I156 WeakPolarHBondContact O-CG1 3.32Å; I152-I156 PolarHBondContact O-N 3.31Å; T153-I156 PolarHBondContact O-N 2.94Å; I154-I156 PolarHBondContact O-N 3.5Å; I156-I158 PolarHBondContact O-N 3.02Å; I156-C159 PolarHBondContact O-N 2.9Å; I156-L160 HydrophobicContact CG2-CD1 3.89Å; I156-L160 HydrophobicContact CG2-CG 4.38Å; I156-L160 VanDerWaalsContact O-CG 3.26Å; I156-L160 WeakPolarHBondContact O-CG 3.29Å; I156-L160 PolarHBondContact O-N 3.33Å
157I98.1Very high95.9Very high87 Ų8751.1 Ų51.145%0.44627%0.268SS..Hα-helixtrans-60-46.1178.9-68.6167.1000110.8T153 I154 V155 L160 I161T153-I157 HydrophobicContact CG2-CD1 3.89Å; T153-I157 VanDerWaalsContact O-CG1 3.29Å; T153-I157 WeakPolarHBondContact O-CG1 3.29Å; T153-I157 PolarHBondContact O-N 2.92Å; I154-I157 PolarHBondContact O-N 3.42Å; V155-I157 PolarHBondContact O-N 3.37Å; I157-L160 PolarHBondContact O-N 2.88Å; I157-I161 HydrophobicContact CG2-CD1 3.72Å; I157-I161 HydrophobicContact CG2-CG1 4.46Å; I157-I161 VanDerWaalsContact O-CG1 3.28Å; I157-I161 WeakPolarHBondContact O-CG1 3.4Å; I157-I161 PolarHBondContact O-N 2.91Å
158I97.9Very high96Very high81 Ų8152 Ų5242%0.41527%0.272SS..Hα-helixtrans-60.9-47.5177.6-69.2169.6000110.5I154 V155 I156 L160 I161 L162I154-I158 HydrophobicContact CG2-CD1 3.65Å; I154-I158 HydrophobicContact CG2-CG1 4.36Å; I154-I158 VanDerWaalsContact O-CG1 3.3Å; I154-I158 WeakPolarHBondContact O-CG1 3.49Å; I154-I158 PolarHBondContact O-N 3.48Å; V155-I158 PolarHBondContact O-N 3.16Å; I156-I158 PolarHBondContact O-N 3.02Å; I158-L160 VanDerWaalsContact C-N 3.32Å; I158-L160 PolarHBondContact O-N 3.39Å; I158-I161 PolarHBondContact O-N 2.76Å; I158-L162 HydrophobicContact CG2-CD1 3.74Å; I158-L162 HydrophobicContact CG2-CG 4.13Å; I158-L162 VanDerWaalsContact O-CG 3.28Å; I158-L162 WeakPolarHBondContact O-CG 3.45Å; I158-L162 PolarHBondContact O-N 2.83Å
159C97.8Very high96Very high1 Ų155 Ų551%0.00728%0.284CS..Hα-helixtrans-61.1-40.1179.2-69.60000112.2L116 I117 V155 I156 N163L116-C159 HydrophobicContact CD2-CB 3.97Å; L116-C159 HydrophobicContact CG-CB 4.24Å; I117-C159 HydrophobicContact CD1-CB 4.45Å; I117-C159 HydrophobicContact CG1-CB 3.54Å; V155-C159 WeakPolarHBondContact O-CB 3.31Å; V155-C159 PolarHBondContact O-N 3.38Å; V155-C159 PolarHBondContact O-SG 2.91Å; I156-C159 PolarHBondContact O-N 2.9Å; C159-N163 PolarHBondContact O-N 3.44Å; C159-N163 PolarHBondContact O-ND2 2.93Å
160L97.5Very high95.9Very high59 Ų5951.3 Ų51.331%0.30927%0.268SS..Hα-helixtrans-63-46.1174.7-69.1170.8000111.2Y109 A113 I117 I156 I157 I158 L162 N163 I164Y109-L160 HydrophobicContact CE1-CD2 4.15Å; Y109-L160 WeakPolarHBondContact OH-CA 3.47Å; Y109-L160 WeakPolarHBondContact OH-CB 3.29Å; Y109-L160 VanDerWaalsContact OH-CD2 3.32Å; Y109-L160 WeakPolarHBondContact OH-CD2 3.03Å; Y109-L160 PolarHBondContact OH-O 3.44Å; Y109-L160 VanDerWaalsContact OH-O 3.12Å; A113-L160 HydrophobicContact CB-CD2 4.2Å; I117-L160 HydrophobicContact CD1-CD2 4.31Å; I117-L160 HydrophobicContact CD1-CG 4.43Å; I156-L160 HydrophobicContact CG2-CD1 3.89Å; I156-L160 HydrophobicContact CG2-CG 4.38Å; I156-L160 VanDerWaalsContact O-CG 3.26Å; I156-L160 WeakPolarHBondContact O-CG 3.29Å; I156-L160 PolarHBondContact O-N 3.33Å; I157-L160 PolarHBondContact O-N 2.88Å; I158-L160 VanDerWaalsContact C-N 3.32Å; I158-L160 PolarHBondContact O-N 3.39Å; L160-L162 PolarHBondContact O-N 3.38Å; L160-N163 PolarHBondContact O-N 2.99Å; L160-I164 PolarHBondContact O-N 3.44Å
161I97.5Very high95.7Very high99 Ų9948.3 Ų48.351%0.50825%0.253SS..Hα-helixtrans-61.7-45178.4-68.7167.5000111.4I157 I158 N163 I164I157-I161 HydrophobicContact CG2-CD1 3.72Å; I157-I161 HydrophobicContact CG2-CG1 4.46Å; I157-I161 VanDerWaalsContact O-CG1 3.28Å; I157-I161 WeakPolarHBondContact O-CG1 3.4Å; I157-I161 PolarHBondContact O-N 2.91Å; I158-I161 PolarHBondContact O-N 2.76Å; I161-N163 PolarHBondContact O-N 3.45Å; I161-I164 HydrophobicContact CB-CD1 4.41Å; I161-I164 HydrophobicContact CG2-CD1 4.3Å; I161-I164 WeakPolarHBondContact O-CB 3.37Å; I161-I164 VanDerWaalsContact O-CG1 3.31Å; I161-I164 WeakPolarHBondContact O-CG1 3.46Å; I161-I164 PolarHBondContact O-N 3.49Å; I161-I164 VanDerWaalsContact O-N 3.15Å
162L96.9Very high95.3Very high53 Ų5347.5 Ų47.528%0.27725%0.249SC..Hα-helixtrans-61.7-27.7-179.2-70.6173.2000112.6L116 I158 L160 P165 Y195 L199L116-L162 HydrophobicContact CD2-CB 4.36Å; L116-L162 HydrophobicContact CD2-CD1 4.37Å; I158-L162 HydrophobicContact CG2-CD1 3.74Å; I158-L162 HydrophobicContact CG2-CG 4.13Å; I158-L162 VanDerWaalsContact O-CG 3.28Å; I158-L162 WeakPolarHBondContact O-CG 3.45Å; I158-L162 PolarHBondContact O-N 2.83Å; L160-L162 PolarHBondContact O-N 3.38Å; L162-P165 WeakPolarHBondContact O-CD 3.23Å; L162-Y195 WeakPolarHBondContact CD2-OH 3.21Å; L162-L199 HydrophobicContact CB-CD1 4.31Å; L162-L199 HydrophobicContact CB-CD2 3.88Å; L162-L199 HydrophobicContact CD1-CD1 4.3Å; L162-L199 VanDerWaalsContact O-CD2 3.25Å; L162-L199 WeakPolarHBondContact O-CD2 3.4Å
163N96Very high94.8Very high4 Ų451.6 Ų51.62%0.02127%0.267CS..THydrogen-bonded Turntrans-89.7-3.8179.8-77.4-76.3000114.3Y109 A113 L116 C159 L160 I161 P165 H166Y109-N163 HydrophobicContact CD2-CB 3.95Å; Y109-N163 VanDerWaalsContact CD2-O 3.31Å; Y109-N163 WeakPolarHBondContact CD2-O 3.23Å; Y109-N163 HydrophobicContact CE2-CB 3.73Å; A113-N163 WeakPolarHBondContact CA-ND2 3.46Å; A113-N163 HydrophobicContact CB-CB 4.05Å; L116-N163 VanDerWaalsContact CD2-ND2 3.27Å; L116-N163 WeakPolarHBondContact CD2-ND2 3.49Å; C159-N163 PolarHBondContact O-N 3.44Å; C159-N163 PolarHBondContact O-ND2 2.93Å; L160-N163 PolarHBondContact O-N 2.99Å; I161-N163 PolarHBondContact O-N 3.45Å; N163-P165 VanDerWaalsContact O-N 3.11Å; N163-H166 WeakPolarHBondContact O-CB 3.35Å; N163-H166 PolarHBondContact O-CD2 3.49Å; N163-H166 PolarHBondContact O-N 3.32Å; N163-H166 PolarHBondContact OD1-CD2 3.07Å; N163-H166 PolarHBondContact OD1-NE2 3.43Å
164I96Very high94.1Very high74 Ų7454 Ų5438%0.37928%0.276SS..Hα-helixtrans-48.9-38.5177.2-70.2172000113.4L160 I161 H166 L167 I168L160-I164 PolarHBondContact O-N 3.44Å; I161-I164 HydrophobicContact CB-CD1 4.41Å; I161-I164 HydrophobicContact CG2-CD1 4.3Å; I161-I164 WeakPolarHBondContact O-CB 3.37Å; I161-I164 VanDerWaalsContact O-CG1 3.31Å; I161-I164 WeakPolarHBondContact O-CG1 3.46Å; I161-I164 PolarHBondContact O-N 3.49Å; I161-I164 VanDerWaalsContact O-N 3.15Å; I164-H166 PolarHBondContact O-N 3.35Å; I164-L167 WeakPolarHBondContact O-CB 3.42Å; I164-L167 PolarHBondContact O-N 2.9Å; I164-I168 HydrophobicContact CG2-CD1 4.42Å
165P93.9Very high93.1Very high26 Ų2653.4 Ų53.417%0.16927%0.271CS..Hα-helixtrans-54.4-27177.3-31.340.3000115L162 N163 L167 I168 F169 Y195 V196L162-P165 WeakPolarHBondContact O-CD 3.23Å; N163-P165 VanDerWaalsContact O-N 3.11Å; P165-L167 VanDerWaalsContact C-N 3.28Å; P165-L167 PolarHBondContact O-N 3.46Å; P165-I168 PolarHBondContact O-N 3Å; P165-I168 VanDerWaalsContact O-N 3.1Å; P165-F169 HydrophobicContact CB-CD2 4.07Å; P165-F169 HydrophobicContact CB-CE2 4.19Å; P165-F169 WeakPolarHBondContact O-CD2 3.26Å; P165-F169 PolarHBondContact O-N 3.44Å; P165-Y195 HydrophobicContact CB-CD1 4.3Å; P165-Y195 HydrophobicContact CG-CD1 3.94Å; P165-Y195 HydrophobicContact CG-CE1 3.81Å; P165-V196 HydrophobicContact CB-CG2 3.68Å
166H91.2Very high91.9Very high2 Ų257.6 Ų57.61%0.00930%0.301CS..Hα-helixtrans-59-39173.5-74.1-84.5000112.6T108 Y109 D112 N163 I164 I168 A170 Y185 V196T108-H166 HydrophobicContact CG2-CB 4.49Å; T108-H166 WeakPolarHBondContact CG2-ND1 3.3Å; Y109-H166 HydrophobicContact CD2-CB 4.39Å; D112-H166 IonicContact OD2-CE1 2.7Å; D112-H166 PolarHBondContact OD2-CE1 3.41Å; D112-H166 IonicContact OD2-ND1 2.97Å; D112-H166 PolarHBondContact OD2-ND1 3.01Å; D112-H166 IonicContact OD2-NE2 3.2Å; N163-H166 WeakPolarHBondContact O-CB 3.35Å; N163-H166 PolarHBondContact O-CD2 3.49Å; N163-H166 PolarHBondContact O-N 3.32Å; N163-H166 PolarHBondContact OD1-CD2 3.07Å; N163-H166 PolarHBondContact OD1-NE2 3.43Å; I164-H166 PolarHBondContact O-N 3.35Å; H166-I168 PolarHBondContact O-N 2.94Å; H166-A170 VanDerWaalsContact O-CB 3.25Å; H166-A170 WeakPolarHBondContact O-CB 3.38Å; H166-A170 PolarHBondContact O-N 3.39Å; H166-A170 VanDerWaalsContact O-N 3.16Å; H166-Y185 PolarHBondContact CE1-OH 2.81Å; H166-Y185 PolarHBondContact ND1-OH 3.38Å; H166-Y185 VanDerWaalsContact ND1-OH 3.07Å; H166-V196 WeakPolarHBondContact CE1-CG1 3.45Å; H166-V196 VanDerWaalsContact NE2-CG1 3.29Å; H166-V196 WeakPolarHBondContact NE2-CG1 3.35Å
167L93.7Very high90.7Very high67 Ų6762.8 Ų62.835%0.35133%0.328SS..Hα-helixtrans-67.6-21.7179-61.7173.8000112.5K105 Y109 I164 P165K105-L167 HydrophobicContact CB-CD2 4.18Å; K105-L167 WeakPolarHBondContact CD-O 3.38Å; K105-L167 WeakPolarHBondContact CE-O 3.28Å; Y109-L167 HydrophobicContact CD1-CD2 4.44Å; Y109-L167 HydrophobicContact CD2-CD1 4.02Å; Y109-L167 HydrophobicContact CD2-CD2 4.14Å; Y109-L167 HydrophobicContact CD2-CG 3.73Å; Y109-L167 HydrophobicContact CE2-CD1 4.15Å; Y109-L167 HydrophobicContact CE2-CG 4.35Å; Y109-L167 HydrophobicContact CG-CD1 4.34Å; Y109-L167 HydrophobicContact CG-CD2 3.82Å; Y109-L167 HydrophobicContact CG-CG 3.95Å; I164-L167 WeakPolarHBondContact O-CB 3.42Å; I164-L167 PolarHBondContact O-N 2.9Å; P165-L167 VanDerWaalsContact C-N 3.28Å; P165-L167 PolarHBondContact O-N 3.46Å
168I93.7Very high89.5Confident108 Ų10863.5 Ų63.555%0.55433%0.333SS*.Hα-helixtrans-91.7-44.7-178-57175.1000111I164 P165 H166I164-I168 HydrophobicContact CG2-CD1 4.42Å; P165-I168 PolarHBondContact O-N 3Å; P165-I168 VanDerWaalsContact O-N 3.1Å; H166-I168 PolarHBondContact O-N 2.94Å
169F93.4Very high88.3Confident64 Ų6468.1 Ų68.128%0.28135%0.35SS..Hα-helixtrans-97.4-21.6-168.3-65.8-71.2000115.2P165 Y185 I186 A190 G192 V193P165-F169 HydrophobicContact CB-CD2 4.07Å; P165-F169 HydrophobicContact CB-CE2 4.19Å; P165-F169 WeakPolarHBondContact O-CD2 3.26Å; P165-F169 PolarHBondContact O-N 3.44Å; F169-Y185 HydrophobicContact CB-CD1 4.02Å; F169-I186 PolarHBondContact O-N 3.12Å; F169-A190 HydrophobicContact CD1-CB 4.48Å; F169-A190 HydrophobicContact CE1-CB 4.4Å; F169-G192 VanDerWaalsContact CE2-CA 3.46Å; F169-V193 HydrophobicContact CB-CG2 3.83Å; F169-V193 HydrophobicContact CD1-CG2 4.33Å; F169-V193 HydrophobicContact CG-CG2 4.12Å
170A90.8Very high87.4Confident2 Ų272 Ų722%0.01737%0.37CS..EExtended strand (participates in β ladder)trans-80.6131.7175.600000110K105 T108 H166 Y185K105-A170 WeakPolarHBondContact CE-O 3.29Å; K105-A170 WeakPolarHBondContact CG-O 3.44Å; T108-A170 HydrophobicContact CG2-CB 4.32Å; H166-A170 VanDerWaalsContact O-CB 3.25Å; H166-A170 WeakPolarHBondContact O-CB 3.38Å; H166-A170 PolarHBondContact O-N 3.39Å; H166-A170 VanDerWaalsContact O-N 3.16Å; A170-Y185 HydrophobicContact CB-CD1 4.4Å; A170-Y185 HydrophobicContact CB-CE1 4.23Å
171D91.2Very high86.6Confident33 Ų3371.9 Ų71.918%0.17637%0.369CS..EExtended strand (participates in β ladder)trans-156.6174.7174-141.1-35.1000111.8S101 K105 K173 Q184 I186S101-D171 VanDerWaalsContact CB-OD1 3.28Å; S101-D171 WeakPolarHBondContact CB-OD1 3.32Å; S101-D171 VanDerWaalsContact OG-CG 3.31Å; S101-D171 PolarHBondContact OG-OD1 2.96Å; S101-D171 PolarHBondContact OG-OD2 3.35Å; K105-D171 WeakPolarHBondContact CE-OD2 2.99Å; K105-D171 IonicContact NZ-OD1 3.9Å; K105-D171 IonicContact NZ-OD2 2.82Å; K105-D171 PolarHBondContact NZ-OD2 2.94Å; D171-K173 PolarHBondContact O-N 3.46Å; D171-Q184 PolarHBondContact N-O 3.05Å; D171-Q184 VanDerWaalsContact N-O 3.1Å; D171-Q184 PolarHBondContact O-N 2.97Å; D171-I186 HydrophobicContact CB-CD1 3.51Å; D171-I186 HydrophobicContact CB-CG1 3.58Å
172L88.7Confident86Confident43 Ų4371.8 Ų71.823%0.22537%0.367CS..EExtended strand (participates in β ladder)trans-75.8120.6173.9-64.3176000110.1I98 C104I98-L172 HydrophobicContact CB-CD2 4.39Å; C104-L172 HydrophobicContact CB-CD2 4.1Å; C104-L172 HydrophobicContact CB-CG 4.49Å
173K86.2Confident85.6Confident86 Ų8670.8 Ų70.837%0.37436%0.364SS..EExtended strand (participates in β ladder)trans-110.7125170.8178.2166.7165.4-167.70109.6D171 E182 Q184D171-K173 PolarHBondContact O-N 3.46Å; K173-E182 PolarHBondContact N-O 3.42Å; K173-E182 PolarHBondContact O-N 3.26Å; K173-E182 VanDerWaalsContact O-N 3.08Å; K173-Q184 HydrophobicContact CB-CG 3.62Å; K173-Q184 HydrophobicContact CD-CG 4.05Å; K173-Q184 HydrophobicContact CG-CG 4.37Å
174I82.1Confident85.2Confident116 Ų11673.6 Ų73.660%0.59538%0.377SS*.EExtended strand (participates in β ladder)trans-85.8115.8179.2-49.8-176.3000108S176 N181I174-S176 PolarHBondContact O-N 3.21Å; I174-N181 WeakPolarHBondContact CG1-OD1 3.27Å
175H77.3Confident84.7Confident75 Ų7573 Ų7335%0.34737%0.37SS..EExtended strand (participates in β ladder)trans-74.1120.5174.5-165.874.5000109.8I177 N178 K179 L180H175-I177 PolarHBondContact O-N 3.39Å; H175-N178 PolarHBondContact O-N 3.25Å; H175-K179 WeakPolarHBondContact O-CA 3.36Å; H175-K179 PolarHBondContact O-N 2.93Å; H175-L180 PolarHBondContact N-O 2.99Å
176S72.8Confident84.2Confident107 Ų10776.5 Ų76.575%0.74839%0.387SS*.THydrogen-bonded Turntrans-60.5-30.4-172.755.80000113.8I174I174-S176 PolarHBondContact O-N 3.21Å
177I72.6Confident83.9Confident131 Ų13180.5 Ų80.567%0.67241%0.408SS*.THydrogen-bonded Turntrans-77.2-40.9-173.9-53.9178.9000111.6H175H175-I177 PolarHBondContact O-N 3.39Å
178N72.2Confident83.1Confident103 Ų10381.4 Ų81.455%0.55142%0.418SS*.THydrogen-bonded Turntrans-112.4-3-171.9-67.1-18.1000113.9H175 L180H175-N178 PolarHBondContact O-N 3.25Å; N178-L180 HydrophobicContact CB-CB 4.29Å; N178-L180 HydrophobicContact CB-CD1 3.67Å; N178-L180 HydrophobicContact CB-CG 3.77Å; N178-L180 PolarHBondContact O-N 2.85Å; N178-L180 VanDerWaalsContact O-N 3.07Å
179K72.9Confident82.5Confident177 Ų17781.1 Ų81.177%0.7742%0.421SS*.THydrogen-bonded Turntrans50.626.4-168.7-62.2-177.2177.4-179.90113.1H175H175-K179 WeakPolarHBondContact O-CA 3.36Å; H175-K179 PolarHBondContact O-N 2.93Å
180L78.4Confident82.2Confident82 Ų8279.1 Ų79.143%0.42942%0.416SS..EExtended strand (participates in β ladder)trans-85.7128.8177.1-70.1170.1000108.5H175 N178H175-L180 PolarHBondContact N-O 2.99Å; N178-L180 HydrophobicContact CB-CB 4.29Å; N178-L180 HydrophobicContact CB-CD1 3.67Å; N178-L180 HydrophobicContact CB-CG 3.77Å; N178-L180 PolarHBondContact O-N 2.85Å; N178-L180 VanDerWaalsContact O-N 3.07Å
181N82.1Confident82.1Confident57 Ų5781.7 Ų81.731%0.30544%0.443SS..EExtended strand (participates in β ladder)trans-80.1130.8170.6-65.1-11.1000107.7I98 I174I98-N181 HydrophobicContact CB-CB 4.09Å; I98-N181 HydrophobicContact CG2-CB 4.48Å; I98-N181 WeakPolarHBondContact CG2-O 3.43Å; I174-N181 WeakPolarHBondContact CG1-OD1 3.27Å
182E84.7Confident82.1Confident98 Ų9880.9 Ų80.946%0.45844%0.443SS..EExtended strand (participates in β ladder)trans-129.2135.8171.2-67.1-178.116700108.7K173 Q184K173-E182 PolarHBondContact N-O 3.42Å; K173-E182 PolarHBondContact O-N 3.26Å; K173-E182 VanDerWaalsContact O-N 3.08Å; E182-Q184 PolarHBondContact O-N 3.39Å
183C88Confident82Confident32 Ų3279.4 Ų79.422%0.21644%0.436CS..EExtended strand (participates in β ladder)trans-74.5110.6171-1790000108.9D97 C104D97-C183 HydrophobicContact CB-CB 4.24Å; D97-C183 WeakPolarHBondContact OD2-CB 3.44Å; C104-C183 WeakPolarHBondContact CA-SG 3.21Å; C104-C183 HydrophobicContact CB-CB 3.79Å; C104-C183 WeakPolarHBondContact CB-SG 3.46Å; C104-C183 VanDerWaalsContact SG-CA 3.53Å; C104-C183 WeakPolarHBondContact SG-CB 3.49Å; C104-C183 CovalentContact SG-SG 2.03Å; C104-C183 PolarHBondContact SG-SG 3.24Å
184Q86.7Confident82.1Confident63 Ų6380.1 Ų80.129%0.29444%0.438SS..EExtended strand (participates in β ladder)trans-151.9165.9179.961.7-177-53.700111.5D171 K173 E182 I186D171-Q184 PolarHBondContact N-O 3.05Å; D171-Q184 VanDerWaalsContact N-O 3.1Å; D171-Q184 PolarHBondContact O-N 2.97Å; K173-Q184 HydrophobicContact CB-CG 3.62Å; K173-Q184 HydrophobicContact CD-CG 4.05Å; K173-Q184 HydrophobicContact CG-CG 4.37Å; E182-Q184 PolarHBondContact O-N 3.39Å; Q184-I186 PolarHBondContact O-N 2.71Å
185Y86.2Confident82.6Confident61 Ų6179.1 Ų79.124%0.23943%0.428CS..EExtended strand (participates in β ladder)trans-66.9122.7172.3-62-66000110.5H166 F169 A170 N187 V193 V196H166-Y185 PolarHBondContact CE1-OH 2.81Å; H166-Y185 PolarHBondContact ND1-OH 3.38Å; H166-Y185 VanDerWaalsContact ND1-OH 3.07Å; F169-Y185 HydrophobicContact CB-CD1 4.02Å; A170-Y185 HydrophobicContact CB-CD1 4.4Å; A170-Y185 HydrophobicContact CB-CE1 4.23Å; Y185-N187 PolarHBondContact O-N 2.96Å; Y185-V193 HydrophobicContact CD1-CG1 4.12Å; Y185-V193 HydrophobicContact CD1-CG2 3.79Å; Y185-V193 HydrophobicContact CD2-CG1 3.64Å; Y185-V193 HydrophobicContact CE2-CG1 4.18Å; Y185-V193 HydrophobicContact CG-CB 4.38Å; Y185-V193 HydrophobicContact CG-CG1 3.61Å; Y185-V193 HydrophobicContact CG-CG2 3.83Å; Y185-V196 HydrophobicContact CE1-CG1 4.39Å; Y185-V196 WeakPolarHBondContact OH-CG1 3.05Å
186I84.3Confident83.3Confident100 Ų10075.8 Ų75.851%0.51341%0.413SS..SBendtrans-53.2-45.8-176.8-63.2168.5000110.7F169 D171 Q184F169-I186 PolarHBondContact O-N 3.12Å; D171-I186 HydrophobicContact CB-CD1 3.51Å; D171-I186 HydrophobicContact CB-CG1 3.58Å; Q184-I186 PolarHBondContact O-N 2.71Å
187N83Confident83.9Confident86 Ų8674.2 Ų74.246%0.4640%0.396SS..  trans-126.498.9176.4-176.8-6.8000109.9Y185 V189 A190 V193Y185-N187 PolarHBondContact O-N 2.96Å; N187-V189 PolarHBondContact O-N 2.96Å; N187-V189 VanDerWaalsContact O-N 3.09Å; N187-V189 WeakPolarHBondContact OD1-CB 3.49Å; N187-V189 PolarHBondContact OD1-N 3.42Å; N187-A190 HydrophobicContact CB-CB 4.1Å; N187-A190 VanDerWaalsContact O-CB 3.29Å; N187-A190 WeakPolarHBondContact O-CB 3.5Å; N187-A190 PolarHBondContact O-N 3.41Å; N187-A190 VanDerWaalsContact O-N 3.07Å; N187-A190 PolarHBondContact OD1-N 3.46Å; N187-V193 WeakPolarHBondContact O-CG2 3.18Å
188P78.8Confident84.8Confident86 Ų8673.7 Ų73.756%0.55839%0.386SS*.THydrogen-bonded Turntrans-64.7-15.4-178.226.8-34.8000113.5
189V80.2Confident85.8Confident102 Ų10270 Ų7062%0.61837%0.366SS*.THydrogen-bonded Turntrans-90.9-11.9-180-169.60000111.7N187 K194N187-V189 PolarHBondContact O-N 2.96Å; N187-V189 VanDerWaalsContact O-N 3.09Å; N187-V189 WeakPolarHBondContact OD1-CB 3.49Å; N187-V189 PolarHBondContact OD1-N 3.42Å; V189-K194 WeakPolarHBondContact O-CE 3.49Å
190A87Confident86.7Confident21 Ų2163.6 Ų63.617%0.17434%0.337CS..SBendtrans-59140.7-179.600000111.5F169 N187 G192 V193 K194F169-A190 HydrophobicContact CD1-CB 4.48Å; F169-A190 HydrophobicContact CE1-CB 4.4Å; N187-A190 HydrophobicContact CB-CB 4.1Å; N187-A190 VanDerWaalsContact O-CB 3.29Å; N187-A190 WeakPolarHBondContact O-CB 3.5Å; N187-A190 PolarHBondContact O-N 3.41Å; N187-A190 VanDerWaalsContact O-N 3.07Å; N187-A190 PolarHBondContact OD1-N 3.46Å; A190-G192 PolarHBondContact O-N 3.49Å; A190-G192 VanDerWaalsContact O-N 3.16Å; A190-V193 HydrophobicContact CB-CG2 4.24Å; A190-V193 PolarHBondContact O-N 2.92Å; A190-K194 PolarHBondContact O-N 3.35Å; A190-K194 VanDerWaalsContact O-N 3.14Å
191G89.1Confident87.1Confident57 Ų5759.9 Ų59.959%0.58832%0.318SS*.Hα-helixtrans-56-35.1-177.900000113.3K194 Y195G191-K194 WeakPolarHBondContact O-CB 3.35Å; G191-K194 PolarHBondContact O-N 3.2Å; G191-Y195 PolarHBondContact O-N 3.08Å
192G89.9Confident87.6Confident16 Ų1661.5 Ų61.517%0.16533%0.326CS..Hα-helixtrans-68.2-34.5176.700000114.4F169 A190 Y195 V196F169-G192 VanDerWaalsContact CE2-CA 3.46Å; A190-G192 PolarHBondContact O-N 3.49Å; A190-G192 VanDerWaalsContact O-N 3.16Å; G192-Y195 WeakPolarHBondContact O-CB 3.39Å; G192-Y195 PolarHBondContact O-N 3.35Å; G192-V196 WeakPolarHBondContact O-CB 3.44Å; G192-V196 WeakPolarHBondContact O-CG2 3.46Å; G192-V196 PolarHBondContact O-N 3.44Å
193V86.7Confident88Confident12 Ų1257.2 Ų57.27%0.07331%0.308CS..Hα-helixtrans-69.1-38.6173.8-179.50000110.4F169 Y185 N187 A190 V196 L197F169-V193 HydrophobicContact CB-CG2 3.83Å; F169-V193 HydrophobicContact CD1-CG2 4.33Å; F169-V193 HydrophobicContact CG-CG2 4.12Å; Y185-V193 HydrophobicContact CD1-CG1 4.12Å; Y185-V193 HydrophobicContact CD1-CG2 3.79Å; Y185-V193 HydrophobicContact CD2-CG1 3.64Å; Y185-V193 HydrophobicContact CE2-CG1 4.18Å; Y185-V193 HydrophobicContact CG-CB 4.38Å; Y185-V193 HydrophobicContact CG-CG1 3.61Å; Y185-V193 HydrophobicContact CG-CG2 3.83Å; N187-V193 WeakPolarHBondContact O-CG2 3.18Å; A190-V193 HydrophobicContact CB-CG2 4.24Å; A190-V193 PolarHBondContact O-N 2.92Å; V193-V196 PolarHBondContact O-N 2.98Å; V193-L197 WeakPolarHBondContact O-CB 3.23Å; V193-L197 PolarHBondContact O-N 2.73Å
194K88.6Confident88.2Confident100 Ų10056.3 Ų56.344%0.43530%0.301SS..Hα-helixtrans-60.9-46.3171.9-64.6-177.1-179.1-179.60111.2V189 A190 G191 V196 L197 Y198V189-K194 WeakPolarHBondContact O-CE 3.49Å; A190-K194 PolarHBondContact O-N 3.35Å; A190-K194 VanDerWaalsContact O-N 3.14Å; G191-K194 WeakPolarHBondContact O-CB 3.35Å; G191-K194 PolarHBondContact O-N 3.2Å; K194-V196 PolarHBondContact O-N 2.92Å; K194-L197 PolarHBondContact O-N 3.21Å; K194-Y198 HydrophobicContact CB-CD2 4.33Å; K194-Y198 HydrophobicContact CB-CE2 4.16Å; K194-Y198 WeakPolarHBondContact O-CD2 3.28Å; K194-Y198 PolarHBondContact O-N 3.5Å
195Y93Very high88.3Confident95 Ų9553.5 Ų53.537%0.37329%0.289SS..Hα-helixtrans-55.9-50.4175.7168.1-90.6000111.5L162 P165 G191 G192 L197 Y198 L199L162-Y195 WeakPolarHBondContact CD2-OH 3.21Å; P165-Y195 HydrophobicContact CB-CD1 4.3Å; P165-Y195 HydrophobicContact CG-CD1 3.94Å; P165-Y195 HydrophobicContact CG-CE1 3.81Å; G191-Y195 PolarHBondContact O-N 3.08Å; G192-Y195 WeakPolarHBondContact O-CB 3.39Å; G192-Y195 PolarHBondContact O-N 3.35Å; Y195-L197 VanDerWaalsContact C-N 3.32Å; Y195-L197 PolarHBondContact O-N 3.49Å; Y195-Y198 PolarHBondContact O-N 2.88Å; Y195-L199 HydrophobicContact CE1-CB 4.42Å; Y195-L199 HydrophobicContact CE1-CD2 4.07Å; Y195-L199 WeakPolarHBondContact O-CB 3.34Å; Y195-L199 PolarHBondContact O-N 3.41Å
196V91.3Very high88.5Confident5 Ų553.1 Ų53.13%0.0329%0.29CS..Hα-helixtrans-54.9-48.4177.1155.30000111.5P165 H166 Y185 G192 V193 K194 Y198 L199 Y200P165-V196 HydrophobicContact CB-CG2 3.68Å; H166-V196 WeakPolarHBondContact CE1-CG1 3.45Å; H166-V196 VanDerWaalsContact NE2-CG1 3.29Å; H166-V196 WeakPolarHBondContact NE2-CG1 3.35Å; Y185-V196 HydrophobicContact CE1-CG1 4.39Å; Y185-V196 WeakPolarHBondContact OH-CG1 3.05Å; G192-V196 WeakPolarHBondContact O-CB 3.44Å; G192-V196 WeakPolarHBondContact O-CG2 3.46Å; G192-V196 PolarHBondContact O-N 3.44Å; V193-V196 PolarHBondContact O-N 2.98Å; K194-V196 PolarHBondContact O-N 2.92Å; V196-Y198 PolarHBondContact O-N 3.22Å; V196-L199 PolarHBondContact O-N 3.47Å; V196-Y200 PolarHBondContact O-N 3.43Å
197L87.2Confident88.9Confident75 Ų7552.2 Ų52.239%0.39329%0.286SS..Hα-helixtrans-63.2-42.9179.3-174.568000111.6V193 K194 Y195 Y200 I201 Q272V193-L197 WeakPolarHBondContact O-CB 3.23Å; V193-L197 PolarHBondContact O-N 2.73Å; K194-L197 PolarHBondContact O-N 3.21Å; Y195-L197 VanDerWaalsContact C-N 3.32Å; Y195-L197 PolarHBondContact O-N 3.49Å; L197-Y200 PolarHBondContact O-N 2.93Å; L197-I201 HydrophobicContact CD1-CD1 4.23Å; L197-I201 HydrophobicContact CG-CD1 3.89Å; L197-I201 WeakPolarHBondContact O-CD1 3.39Å; L197-I201 VanDerWaalsContact O-CG1 3.23Å; L197-I201 WeakPolarHBondContact O-CG1 3.3Å; L197-I201 PolarHBondContact O-N 3.14Å; L197-Q272 HydrophobicContact CD2-CG 4.13Å
198Y90.7Very high89.5Confident120 Ų12048.1 Ų48.147%0.47126%0.264SS..Hα-helixtrans-67.4-37.1176.2-73.6-57.8000112.6K194 Y195 V196 Y200 I201 I202K194-Y198 HydrophobicContact CB-CD2 4.33Å; K194-Y198 HydrophobicContact CB-CE2 4.16Å; K194-Y198 WeakPolarHBondContact O-CD2 3.28Å; K194-Y198 PolarHBondContact O-N 3.5Å; Y195-Y198 PolarHBondContact O-N 2.88Å; V196-Y198 PolarHBondContact O-N 3.22Å; Y198-Y200 VanDerWaalsContact C-N 3.33Å; Y198-I201 PolarHBondContact O-N 3.33Å; Y198-I202 VanDerWaalsContact O-CB 3.27Å; Y198-I202 WeakPolarHBondContact O-CB 3.42Å; Y198-I202 WeakPolarHBondContact O-CG1 3.43Å; Y198-I202 PolarHBondContact O-N 3.16Å
199L94Very high90Very high25 Ų2544.8 Ų44.813%0.13124%0.244CC..Iπ-helixtrans-62.1-43.9175.6179.568.2000110.4L116 L162 Y195 V196 G203L116-L199 HydrophobicContact CD2-CD1 4.47Å; L116-L199 HydrophobicContact CD2-CD2 4.45Å; L162-L199 HydrophobicContact CB-CD1 4.31Å; L162-L199 HydrophobicContact CB-CD2 3.88Å; L162-L199 HydrophobicContact CD1-CD1 4.3Å; L162-L199 VanDerWaalsContact O-CD2 3.25Å; L162-L199 WeakPolarHBondContact O-CD2 3.4Å; Y195-L199 HydrophobicContact CE1-CB 4.42Å; Y195-L199 HydrophobicContact CE1-CD2 4.07Å; Y195-L199 WeakPolarHBondContact O-CB 3.34Å; Y195-L199 PolarHBondContact O-N 3.41Å; V196-L199 PolarHBondContact O-N 3.47Å; L199-G203 WeakPolarHBondContact O-CA 3.44Å; L199-G203 PolarHBondContact O-N 3.21Å
200Y89.9Confident90.6Very high42 Ų4244.7 Ų44.717%0.16524%0.239CC..Iπ-helixtrans-61.8-52.3175-174.9-91.6000111.1D112 V196 L197 Y198 V204 A205 I268D112-Y200 WeakPolarHBondContact OD1-CD2 3.5Å; V196-Y200 PolarHBondContact O-N 3.43Å; L197-Y200 PolarHBondContact O-N 2.93Å; Y198-Y200 VanDerWaalsContact C-N 3.33Å; Y200-V204 HydrophobicContact CD2-CB 4.33Å; Y200-V204 HydrophobicContact CD2-CG2 3.9Å; Y200-V204 HydrophobicContact CE2-CB 4.43Å; Y200-V204 HydrophobicContact CE2-CG1 4.35Å; Y200-V204 HydrophobicContact CE2-CG2 4.28Å; Y200-V204 HydrophobicContact CG-CG2 4.4Å; Y200-V204 WeakPolarHBondContact O-CA 3.43Å; Y200-V204 WeakPolarHBondContact O-CB 3.32Å; Y200-V204 PolarHBondContact O-N 3.21Å; Y200-A205 PolarHBondContact O-N 3.04Å; Y200-I268 HydrophobicContact CD1-CD1 4.14Å; Y200-I268 HydrophobicContact CE1-CD1 3.66Å
201I88.3Confident91Very high5 Ų547 Ų473%0.02625%0.245CC..Iπ-helixtrans-63.3-50.8-176.1-68.7163.2000112.2L197 Y198 A205 I206 I268 Q272L197-I201 HydrophobicContact CD1-CD1 4.23Å; L197-I201 HydrophobicContact CG-CD1 3.89Å; L197-I201 WeakPolarHBondContact O-CD1 3.39Å; L197-I201 VanDerWaalsContact O-CG1 3.23Å; L197-I201 WeakPolarHBondContact O-CG1 3.3Å; L197-I201 PolarHBondContact O-N 3.14Å; Y198-I201 PolarHBondContact O-N 3.33Å; I201-A205 WeakPolarHBondContact O-CB 3.46Å; I201-A205 PolarHBondContact O-N 3.14Å; I201-I206 HydrophobicContact CG2-CD1 3.62Å; I201-I206 HydrophobicContact CG2-CG1 4.19Å; I201-I206 WeakPolarHBondContact O-CG1 3.37Å; I201-I206 PolarHBondContact O-N 3.46Å; I201-I268 HydrophobicContact CD1-CG2 3.32Å; I201-I268 HydrophobicContact CG1-CB 4.38Å; I201-I268 HydrophobicContact CG1-CG2 3.34Å; I201-Q272 HydrophobicContact CD1-CG 3.96Å
202I92.4Very high91.2Very high91 Ų9144.3 Ų44.347%0.46722%0.217SC..Iπ-helixtrans-76.7-49.6-176.1-61.4173.7000109Y198 L207Y198-I202 VanDerWaalsContact O-CB 3.27Å; Y198-I202 WeakPolarHBondContact O-CB 3.42Å; Y198-I202 WeakPolarHBondContact O-CG1 3.43Å; Y198-I202 PolarHBondContact O-N 3.16Å; I202-L207 WeakPolarHBondContact O-CB 3.47Å; I202-L207 PolarHBondContact O-N 3.38Å
203G93.1Very high91.3Very high7 Ų749.3 Ų49.37%0.07223%0.234CC..Iπ-helixtrans-78-39.1-170.700000114.8F120 L199 P208F120-G203 WeakPolarHBondContact CE2-O 3.33Å; L199-G203 WeakPolarHBondContact O-CA 3.44Å; L199-G203 PolarHBondContact O-N 3.21Å; G203-P208 WeakPolarHBondContact O-CD 3.34Å; G203-P208 WeakPolarHBondContact O-CG 3.39Å
204V91.9Very high91.7Very high13 Ų1353.1 Ų53.18%0.07925%0.253CS..Iπ-helixtrans-88.3-33.6-179.5-176.20000111.1A115 L116 A119 Y200 P208A115-V204 HydrophobicContact CB-CG1 3.98Å; A115-V204 HydrophobicContact CB-CG2 4.42Å; L116-V204 HydrophobicContact CB-CG2 4.07Å; L116-V204 HydrophobicContact CD1-CG2 3.65Å; L116-V204 HydrophobicContact CG-CG2 4.49Å; A119-V204 HydrophobicContact CB-CG1 4.43Å; Y200-V204 HydrophobicContact CD2-CB 4.33Å; Y200-V204 HydrophobicContact CD2-CG2 3.9Å; Y200-V204 HydrophobicContact CE2-CB 4.43Å; Y200-V204 HydrophobicContact CE2-CG1 4.35Å; Y200-V204 HydrophobicContact CE2-CG2 4.28Å; Y200-V204 HydrophobicContact CG-CG2 4.4Å; Y200-V204 WeakPolarHBondContact O-CA 3.43Å; Y200-V204 WeakPolarHBondContact O-CB 3.32Å; Y200-V204 PolarHBondContact O-N 3.21Å; V204-P208 WeakPolarHBondContact O-CG 3.41Å
205A88.5Confident92Very high4 Ų448.8 Ų48.83%0.03324%0.236CC..Iπ-helixtrans-113.2-66.4-164.900000113.3Y200 I201 A209 V265Y200-A205 PolarHBondContact O-N 3.04Å; I201-A205 WeakPolarHBondContact O-CB 3.46Å; I201-A205 PolarHBondContact O-N 3.14Å; A205-A209 WeakPolarHBondContact O-CB 3.47Å; A205-A209 PolarHBondContact O-N 3.05Å; A205-V265 HydrophobicContact CB-CG2 3.36Å
206I90.4Very high92Very high53 Ų5344.9 Ų44.927%0.27222%0.221SC..Iπ-helixtrans-67.8-52-172.3-63.6176.6000112I201 A209 I210 V265 I269I201-I206 HydrophobicContact CG2-CD1 3.62Å; I201-I206 HydrophobicContact CG2-CG1 4.19Å; I201-I206 WeakPolarHBondContact O-CG1 3.37Å; I201-I206 PolarHBondContact O-N 3.46Å; I206-A209 PolarHBondContact O-N 3.22Å; I206-I210 HydrophobicContact CG2-CD1 3.63Å; I206-I210 HydrophobicContact CG2-CG1 4.41Å; I206-I210 WeakPolarHBondContact O-CG1 3.24Å; I206-I210 PolarHBondContact O-N 3.28Å; I206-V265 HydrophobicContact CG1-CG1 3.97Å; I206-I269 HydrophobicContact CD1-CD1 4.45Å
207L94.2Very high92.2Very high82 Ų8248.8 Ų48.843%0.42924%0.241SC..Hα-helixtrans-62.5-50-177.2176.873000110.9F120 M123 I202 A209 F211F120-L207 HydrophobicContact CZ-CD2 4.37Å; M123-L207 HydrophobicContact CE-CD2 4.42Å; M123-L207 HydrophobicContact SD-CG 4.26Å; I202-L207 WeakPolarHBondContact O-CB 3.47Å; I202-L207 PolarHBondContact O-N 3.38Å; L207-A209 PolarHBondContact O-N 3.48Å; L207-F211 WeakPolarHBondContact O-CB 3.46Å; L207-F211 PolarHBondContact O-N 3.29Å
208P94.2Very high92.6Very high0 Ų048.4 Ų48.40%024%0.239CC..Hα-helixtrans-61.9-43.3176-26.239.2000113A119 M123 G203 V204 F211 I212 F257A119-P208 HydrophobicContact CB-CB 4.13Å; A119-P208 HydrophobicContact CB-CG 3.76Å; M123-P208 HydrophobicContact CE-CG 4.08Å; M123-P208 HydrophobicContact CG-CB 4.02Å; M123-P208 HydrophobicContact CG-CG 4.45Å; M123-P208 HydrophobicContact SD-CB 4.1Å; M123-P208 HydrophobicContact SD-CG 4.04Å; G203-P208 WeakPolarHBondContact O-CD 3.34Å; G203-P208 WeakPolarHBondContact O-CG 3.39Å; V204-P208 WeakPolarHBondContact O-CG 3.41Å; P208-F211 PolarHBondContact O-N 2.94Å; P208-I212 HydrophobicContact CB-CD1 4.23Å; P208-I212 WeakPolarHBondContact O-CB 3.24Å; P208-I212 WeakPolarHBondContact O-CD1 3.23Å; P208-I212 WeakPolarHBondContact O-CG1 3.45Å; P208-I212 PolarHBondContact O-N 2.88Å; P208-F257 HydrophobicContact CB-CE1 4Å; P208-F257 HydrophobicContact CB-CZ 4Å
209A90.5Very high92.7Very high16 Ų1642.7 Ų42.713%0.13222%0.217CC..Hα-helixtrans-62.3-48-179.400000112.5A205 I206 L207 F213A205-A209 WeakPolarHBondContact O-CB 3.47Å; A205-A209 PolarHBondContact O-N 3.05Å; I206-A209 PolarHBondContact O-N 3.22Å; L207-A209 PolarHBondContact O-N 3.48Å; A209-F213 WeakPolarHBondContact O-CB 3.21Å; A209-F213 PolarHBondContact O-N 2.98Å
210I92Very high92.6Very high99 Ų9945.2 Ų45.251%0.50823%0.23SC..Hα-helixtrans-63.4-45177.9-66.7172.6000110.2I206 F213 I214I206-I210 HydrophobicContact CG2-CD1 3.63Å; I206-I210 HydrophobicContact CG2-CG1 4.41Å; I206-I210 WeakPolarHBondContact O-CG1 3.24Å; I206-I210 PolarHBondContact O-N 3.28Å; I210-F213 PolarHBondContact O-N 3.44Å; I210-I214 HydrophobicContact CG2-CD1 3.88Å; I210-I214 WeakPolarHBondContact O-CG1 3.13Å; I210-I214 PolarHBondContact O-N 2.88Å
211F95.2Very high92.7Very high71 Ų7150.9 Ų50.931%0.31125%0.252SS..Hα-helixtrans-61.6-51.6-179-169.8-87.5000111.6M123 V127 L207 P208 F213 I214 T215M123-F211 HydrophobicContact CB-CD1 3.88Å; M123-F211 HydrophobicContact CB-CE1 4.13Å; M123-F211 HydrophobicContact CG-CB 4.25Å; M123-F211 HydrophobicContact CG-CD1 3.82Å; M123-F211 HydrophobicContact CG-CG 4.2Å; M123-F211 HydrophobicContact SD-CB 3.9Å; M123-F211 HydrophobicContact SD-CD1 4.2Å; M123-F211 HydrophobicContact SD-CG 3.99Å; V127-F211 HydrophobicContact CG2-CE1 3.54Å; V127-F211 HydrophobicContact CG2-CZ 3.32Å; L207-F211 WeakPolarHBondContact O-CB 3.46Å; L207-F211 PolarHBondContact O-N 3.29Å; P208-F211 PolarHBondContact O-N 2.94Å; F211-F213 VanDerWaalsContact C-N 3.31Å; F211-F213 PolarHBondContact O-N 3.29Å; F211-I214 PolarHBondContact O-N 3.45Å; F211-T215 HydrophobicContact CD1-CG2 4.02Å; F211-T215 HydrophobicContact CE1-CG2 3.65Å; F211-T215 HydrophobicContact CZ-CG2 4.17Å; F211-T215 WeakPolarHBondContact O-CG2 3.33Å; F211-T215 PolarHBondContact O-N 3.47Å; F211-T215 PolarHBondContact O-OG1 3.05Å; F211-T215 VanDerWaalsContact O-OG1 3.1Å
212I94.3Very high92.8Very high0 Ų053 Ų530%026%0.261CS..Hα-helixtrans-61.3-40.8179.2-71164.8000110.7L122 M123 P208 T215 N216 F257L122-I212 HydrophobicContact CB-CD1 4.37Å; L122-I212 HydrophobicContact CD2-CD1 3.48Å; L122-I212 VanDerWaalsContact CD2-CD1 3.48Å; L122-I212 HydrophobicContact CG-CD1 3.62Å; L122-I212 HydrophobicContact CG-CG1 4.42Å; M123-I212 HydrophobicContact CG-CG1 4.46Å; P208-I212 HydrophobicContact CB-CD1 4.23Å; P208-I212 WeakPolarHBondContact O-CB 3.24Å; P208-I212 WeakPolarHBondContact O-CD1 3.23Å; P208-I212 WeakPolarHBondContact O-CG1 3.45Å; P208-I212 PolarHBondContact O-N 2.88Å; I212-T215 VanDerWaalsContact CA-OG1 3.26Å; I212-T215 WeakPolarHBondContact CA-OG1 3.47Å; I212-T215 PolarHBondContact O-N 3.29Å; I212-T215 PolarHBondContact O-OG1 3.19Å; I212-N216 WeakPolarHBondContact CG2-ND2 3.42Å; I212-N216 VanDerWaalsContact O-CB 3.24Å; I212-N216 WeakPolarHBondContact O-CB 3.13Å; I212-N216 PolarHBondContact O-N 2.99Å; I212-N216 PolarHBondContact O-ND2 3.39Å; I212-F257 HydrophobicContact CD1-CD1 3.59Å; I212-F257 HydrophobicContact CD1-CE1 3.64Å
213F91.9Very high92.6Very high120 Ų12050.5 Ų50.553%0.52625%0.248SC..Hα-helixtrans-59.8-48.9176.6-178.8-102.7000111.8A209 I210 F211 N216 I217A209-F213 WeakPolarHBondContact O-CB 3.21Å; A209-F213 PolarHBondContact O-N 2.98Å; I210-F213 PolarHBondContact O-N 3.44Å; F211-F213 VanDerWaalsContact C-N 3.31Å; F211-F213 PolarHBondContact O-N 3.29Å; F213-N216 PolarHBondContact O-N 2.94Å; F213-I217 HydrophobicContact CD1-CD1 3.9Å; F213-I217 HydrophobicContact CE1-CD1 3.43Å; F213-I217 VanDerWaalsContact CE1-CD1 3.43Å; F213-I217 HydrophobicContact CE2-CD1 4.36Å; F213-I217 HydrophobicContact CZ-CD1 3.7Å; F213-I217 WeakPolarHBondContact O-CG1 3.46Å; F213-I217 PolarHBondContact O-N 3.24Å; F213-I217 VanDerWaalsContact O-N 3.09Å
214I94.6Very high92.5Very high92 Ų9253.8 Ų53.847%0.47227%0.27SS..Hα-helixtrans-61.7-47.8177.3-66.2167.2000110.4I210 F211 N216 I217 L218I210-I214 HydrophobicContact CG2-CD1 3.88Å; I210-I214 WeakPolarHBondContact O-CG1 3.13Å; I210-I214 PolarHBondContact O-N 2.88Å; F211-I214 PolarHBondContact O-N 3.45Å; I214-N216 VanDerWaalsContact C-N 3.33Å; I214-N216 PolarHBondContact O-N 3.32Å; I214-I217 PolarHBondContact O-N 2.92Å; I214-L218 HydrophobicContact CG2-CD1 4.32Å; I214-L218 WeakPolarHBondContact O-CG 3.25Å; I214-L218 PolarHBondContact O-N 3.47Å; I214-L218 VanDerWaalsContact O-N 3.08Å
215T95.2Very high92.3Very high10 Ų1055.2 Ų55.26%0.06128%0.279CS..Hα-helixtrans-64.5-36.8-18051.40000112.4S126 V130 F211 I212 L218 I219S126-T215 WeakPolarHBondContact CB-OG1 3.29Å; V130-T215 HydrophobicContact CG2-CG2 4.08Å; F211-T215 HydrophobicContact CD1-CG2 4.02Å; F211-T215 HydrophobicContact CE1-CG2 3.65Å; F211-T215 HydrophobicContact CZ-CG2 4.17Å; F211-T215 WeakPolarHBondContact O-CG2 3.33Å; F211-T215 PolarHBondContact O-N 3.47Å; F211-T215 PolarHBondContact O-OG1 3.05Å; F211-T215 VanDerWaalsContact O-OG1 3.1Å; I212-T215 VanDerWaalsContact CA-OG1 3.26Å; I212-T215 WeakPolarHBondContact CA-OG1 3.47Å; I212-T215 PolarHBondContact O-N 3.29Å; I212-T215 PolarHBondContact O-OG1 3.19Å; T215-L218 WeakPolarHBondContact O-CB 3.46Å; T215-L218 PolarHBondContact O-N 3.35Å; T215-I219 WeakPolarHBondContact O-CB 3.45Å; T215-I219 VanDerWaalsContact O-CG1 3.23Å; T215-I219 WeakPolarHBondContact O-CG1 3.39Å; T215-I219 PolarHBondContact O-N 2.77Å
216N93.4Very high92Very high13 Ų1357.9 Ų57.97%0.0730%0.295CS..Hα-helixtrans-64.4-40.6176.3-75.2-18.4000111.8I212 F213 I214 L218 I219 L220 L251 S254I212-N216 WeakPolarHBondContact CG2-ND2 3.42Å; I212-N216 VanDerWaalsContact O-CB 3.24Å; I212-N216 WeakPolarHBondContact O-CB 3.13Å; I212-N216 PolarHBondContact O-N 2.99Å; I212-N216 PolarHBondContact O-ND2 3.39Å; F213-N216 PolarHBondContact O-N 2.94Å; I214-N216 VanDerWaalsContact C-N 3.33Å; I214-N216 PolarHBondContact O-N 3.32Å; N216-L218 VanDerWaalsContact C-N 3.33Å; N216-L218 PolarHBondContact O-N 2.91Å; N216-I219 PolarHBondContact O-N 3.28Å; N216-L220 WeakPolarHBondContact O-CB 3.39Å; N216-L220 VanDerWaalsContact O-CG 3.27Å; N216-L220 WeakPolarHBondContact O-CG 3.46Å; N216-L220 PolarHBondContact O-N 3.19Å; N216-L251 HydrophobicContact CB-CD1 4.01Å; N216-S254 WeakPolarHBondContact ND2-CB 3.28Å
217I94Very high91.7Very high86 Ų8657.9 Ų57.944%0.44130%0.297SS..Hα-helixtrans-59.7-46172.9-68.9169.9000110.2F213 I214 I219 L220 Y221F213-I217 HydrophobicContact CD1-CD1 3.9Å; F213-I217 HydrophobicContact CE1-CD1 3.43Å; F213-I217 VanDerWaalsContact CE1-CD1 3.43Å; F213-I217 HydrophobicContact CE2-CD1 4.36Å; F213-I217 HydrophobicContact CZ-CD1 3.7Å; F213-I217 WeakPolarHBondContact O-CG1 3.46Å; F213-I217 PolarHBondContact O-N 3.24Å; F213-I217 VanDerWaalsContact O-N 3.09Å; I214-I217 PolarHBondContact O-N 2.92Å; I217-I219 VanDerWaalsContact C-N 3.35Å; I217-I219 PolarHBondContact O-N 3.39Å; I217-L220 PolarHBondContact O-N 3.46Å; I217-Y221 WeakPolarHBondContact O-CB 3.42Å; I217-Y221 PolarHBondContact O-N 2.98Å
218L95.2Very high91.2Very high68 Ų6861.9 Ų61.936%0.35631%0.308SS..Hα-helixtrans-62.7-40.2178.3-66175.7000112.5V130 Y134 I214 T215 N216 K222V130-L218 HydrophobicContact CG1-CD1 4.5Å; V130-L218 HydrophobicContact CG2-CB 4.37Å; Y134-L218 HydrophobicContact CE2-CB 4.4Å; Y134-L218 PolarHBondContact OH-O 3.45Å; I214-L218 HydrophobicContact CG2-CD1 4.32Å; I214-L218 WeakPolarHBondContact O-CG 3.25Å; I214-L218 PolarHBondContact O-N 3.47Å; I214-L218 VanDerWaalsContact O-N 3.08Å; T215-L218 WeakPolarHBondContact O-CB 3.46Å; T215-L218 PolarHBondContact O-N 3.35Å; N216-L218 VanDerWaalsContact C-N 3.33Å; N216-L218 PolarHBondContact O-N 2.91Å; L218-K222 WeakPolarHBondContact O-CB 3.37Å; L218-K222 PolarHBondContact O-N 3Å
219I92.7Very high90.7Very high0 Ų069.5 Ų69.50%034%0.337CS..Hα-helixtrans-63.7-49.5175.5-70.8166.9000109.9R129 V130 I133 T215 N216 I217 K222 L223 V247R129-I219 HydrophobicContact CB-CD1 3.9Å; V130-I219 HydrophobicContact CG2-CD1 4.18Å; V130-I219 HydrophobicContact CG2-CG1 3.79Å; I133-I219 HydrophobicContact CD1-CB 4.34Å; I133-I219 HydrophobicContact CD1-CG1 4.1Å; I133-I219 HydrophobicContact CD1-CG2 3.79Å; T215-I219 WeakPolarHBondContact O-CB 3.45Å; T215-I219 VanDerWaalsContact O-CG1 3.23Å; T215-I219 WeakPolarHBondContact O-CG1 3.39Å; T215-I219 PolarHBondContact O-N 2.77Å; N216-I219 PolarHBondContact O-N 3.28Å; I217-I219 VanDerWaalsContact C-N 3.35Å; I217-I219 PolarHBondContact O-N 3.39Å; I219-K222 PolarHBondContact O-N 3.46Å; I219-L223 WeakPolarHBondContact O-CB 3.31Å; I219-L223 PolarHBondContact O-N 2.82Å; I219-V247 HydrophobicContact CG2-CG1 3.71Å
220L92.8Very high90.1Very high77 Ų7770.6 Ų70.640%0.40334%0.343SS..Hα-helixtrans-62.8-44.7-178.7-76.1172.7000112.4N216 I217 K222 L223 S224 L251N216-L220 WeakPolarHBondContact O-CB 3.39Å; N216-L220 VanDerWaalsContact O-CG 3.27Å; N216-L220 WeakPolarHBondContact O-CG 3.46Å; N216-L220 PolarHBondContact O-N 3.19Å; I217-L220 PolarHBondContact O-N 3.46Å; L220-K222 VanDerWaalsContact C-N 3.35Å; L220-K222 PolarHBondContact O-N 2.94Å; L220-L223 PolarHBondContact O-N 2.9Å; L220-S224 WeakPolarHBondContact O-CB 3Å; L220-S224 PolarHBondContact O-N 2.96Å; L220-S224 PolarHBondContact O-OG 3.39Å; L220-L251 HydrophobicContact CD1-CD1 4.46Å; L220-L251 HydrophobicContact CD2-CD1 4.4Å; L220-L251 HydrophobicContact CD2-CD2 3.69Å; L220-L251 HydrophobicContact CG-CD1 4.26Å; L220-L251 HydrophobicContact CG-CD2 4.43Å
221Y92.9Very high89.5Confident161 Ų16173.8 Ų73.863%0.63135%0.353SS*.Hα-helixtrans-58.5-47.9177.2177.9-99.9000111.5I217 T225I217-Y221 WeakPolarHBondContact O-CB 3.42Å; I217-Y221 PolarHBondContact O-N 2.98Å; Y221-T225 PolarHBondContact O-N 3.43Å; Y221-T225 VanDerWaalsContact O-N 3.17Å; Y221-T225 PolarHBondContact O-OG1 3.07Å
222K90.3Very high88.6Confident51 Ų5176.5 Ų76.522%0.22237%0.37CS..Hα-helixtrans-72.8-39.2-178.8-172.165.3177.6-168.10112.2I133 Y134 L218 I219 L220 S224 T225 T226I133-K222 HydrophobicContact CB-CG 4.48Å; I133-K222 HydrophobicContact CG2-CB 3.92Å; I133-K222 HydrophobicContact CG2-CG 3.35Å; Y134-K222 HydrophobicContact CD1-CD 4.37Å; Y134-K222 HydrophobicContact CD2-CB 4.33Å; Y134-K222 HydrophobicContact CD2-CG 4.13Å; Y134-K222 HydrophobicContact CE1-CD 4.22Å; Y134-K222 HydrophobicContact CE2-CB 3.7Å; Y134-K222 HydrophobicContact CE2-CG 3.97Å; Y134-K222 HydrophobicContact CG-CG 4.49Å; L218-K222 WeakPolarHBondContact O-CB 3.37Å; L218-K222 PolarHBondContact O-N 3Å; I219-K222 PolarHBondContact O-N 3.46Å; L220-K222 VanDerWaalsContact C-N 3.35Å; L220-K222 PolarHBondContact O-N 2.94Å; K222-S224 VanDerWaalsContact C-N 3.33Å; K222-S224 PolarHBondContact O-N 3.19Å; K222-T225 WeakPolarHBondContact O-CB 3.29Å; K222-T225 PolarHBondContact O-N 3.07Å; K222-T226 PolarHBondContact O-N 2.92Å; K222-T226 PolarHBondContact O-OG1 3.05Å; K222-T226 VanDerWaalsContact O-OG1 3.07Å
223L88.3Confident87.6Confident38 Ų3881.7 Ų81.720%0.19940%0.397CS..Hα-helixtrans-61.5-43.3175.8-176.264.9000110.8I219 L220 T225 T226 V227 V247I219-L223 WeakPolarHBondContact O-CB 3.31Å; I219-L223 PolarHBondContact O-N 2.82Å; L220-L223 PolarHBondContact O-N 2.9Å; L223-T225 VanDerWaalsContact C-N 3.31Å; L223-T225 PolarHBondContact O-N 3.36Å; L223-T226 PolarHBondContact O-N 3.43Å; L223-V227 HydrophobicContact CD1-CG2 4.21Å; L223-V227 HydrophobicContact CG-CG2 4.29Å; L223-V227 WeakPolarHBondContact O-CB 3.37Å; L223-V227 VanDerWaalsContact O-CG2 3.31Å; L223-V227 WeakPolarHBondContact O-CG2 3.32Å; L223-V227 PolarHBondContact O-N 3.21Å; L223-V247 HydrophobicContact CD2-CG1 4.33Å
224S89.2Confident86.6Confident76 Ų7683.9 Ų83.953%0.53141%0.414SS..Hα-helixtrans-59-44.1175.6-58.80000111.4L220 K222 T226 V227 Y228L220-S224 WeakPolarHBondContact O-CB 3Å; L220-S224 PolarHBondContact O-N 2.96Å; L220-S224 PolarHBondContact O-OG 3.39Å; K222-S224 VanDerWaalsContact C-N 3.33Å; K222-S224 PolarHBondContact O-N 3.19Å; S224-T226 PolarHBondContact O-N 2.9Å; S224-V227 PolarHBondContact O-N 3.35Å; S224-Y228 VanDerWaalsContact O-CB 3.28Å; S224-Y228 WeakPolarHBondContact O-CB 3.42Å; S224-Y228 PolarHBondContact O-N 3.02Å
225T87.6Confident85Confident43 Ų4385.5 Ų85.526%0.26442%0.42SS..Hα-helixtrans-62.4-42.8175.5-55.50000112Y221 K222 L223 R229Y221-T225 PolarHBondContact O-N 3.43Å; Y221-T225 VanDerWaalsContact O-N 3.17Å; Y221-T225 PolarHBondContact O-OG1 3.07Å; K222-T225 WeakPolarHBondContact O-CB 3.29Å; K222-T225 PolarHBondContact O-N 3.07Å; L223-T225 VanDerWaalsContact C-N 3.31Å; L223-T225 PolarHBondContact O-N 3.36Å; T225-R229 WeakPolarHBondContact O-CG 3.49Å; T225-R229 PolarHBondContact O-N 3.35Å
226T83.6Confident83.5Confident60 Ų6094.5 Ų94.537%0.36846%0.458SS..Hα-helixtrans-70.9-40.2-179.6-59.60000112.2K222 L223 S224 R229 S230K222-T226 PolarHBondContact O-N 2.92Å; K222-T226 PolarHBondContact O-OG1 3.05Å; K222-T226 VanDerWaalsContact O-OG1 3.07Å; L223-T226 PolarHBondContact O-N 3.43Å; S224-T226 PolarHBondContact O-N 2.9Å; T226-R229 PolarHBondContact O-N 3.15Å; T226-S230 VanDerWaalsContact O-CB 3.3Å; T226-S230 WeakPolarHBondContact O-CB 3.47Å; T226-S230 PolarHBondContact O-N 3.41Å
227V82.9Confident82.4Confident53 Ų5397.4 Ų97.432%0.32147%0.473SS..Hα-helixtrans-65.4-42.6175.6170.70000110.2L223 S224 R229 S230 K231L223-V227 HydrophobicContact CD1-CG2 4.21Å; L223-V227 HydrophobicContact CG-CG2 4.29Å; L223-V227 WeakPolarHBondContact O-CB 3.37Å; L223-V227 VanDerWaalsContact O-CG2 3.31Å; L223-V227 WeakPolarHBondContact O-CG2 3.32Å; L223-V227 PolarHBondContact O-N 3.21Å; S224-V227 PolarHBondContact O-N 3.35Å; V227-R229 VanDerWaalsContact C-N 3.34Å; V227-R229 PolarHBondContact O-N 3.41Å; V227-S230 PolarHBondContact O-N 2.96Å; V227-K231 WeakPolarHBondContact O-CG 3.32Å; V227-K231 PolarHBondContact O-N 3.33Å
228Y85Confident81.4Confident166 Ų16699.9 Ų99.965%0.65149%0.488SS*.Hα-helixtrans-58-45.7174.4-177-98.2000111.6S224 K231 L232S224-Y228 VanDerWaalsContact O-CB 3.28Å; S224-Y228 WeakPolarHBondContact O-CB 3.42Å; S224-Y228 PolarHBondContact O-N 3.02Å; Y228-K231 PolarHBondContact O-N 3.46Å; Y228-L232 HydrophobicContact CD1-CD1 4.42Å; Y228-L232 HydrophobicContact CE1-CD1 4.18Å
229R82.6Confident80.4Confident160 Ų160104.1 Ų104.160%0.60451%0.505SS*.Hα-helixtrans-67.1-37.3175-72.1-179.3-179.2-170.7-0.8113.7T225 T226 V227 K231 L232 I233T225-R229 WeakPolarHBondContact O-CG 3.49Å; T225-R229 PolarHBondContact O-N 3.35Å; T226-R229 PolarHBondContact O-N 3.15Å; V227-R229 VanDerWaalsContact C-N 3.34Å; V227-R229 PolarHBondContact O-N 3.41Å; R229-K231 VanDerWaalsContact C-N 3.3Å; R229-K231 PolarHBondContact O-N 2.98Å; R229-L232 WeakPolarHBondContact O-CB 3.48Å; R229-L232 PolarHBondContact O-N 3.29Å; R229-L232 VanDerWaalsContact O-N 3.15Å; R229-I233 PolarHBondContact O-N 3.27Å
230S79.1Confident79.7Confident38 Ų38105.9 Ų105.927%0.26652%0.518SS..Hα-helixtrans-69.1-27.9178.1175.10000112.3T226 V227 L232 I233 R244T226-S230 VanDerWaalsContact O-CB 3.3Å; T226-S230 WeakPolarHBondContact O-CB 3.47Å; T226-S230 PolarHBondContact O-N 3.41Å; V227-S230 PolarHBondContact O-N 2.96Å; S230-L232 PolarHBondContact O-N 3.43Å; S230-I233 CarbonylContact O-C 3.57Å; S230-I233 PolarHBondContact O-N 2.89Å; S230-R244 PolarHBondContact OG-NH2 3.01Å
231K79.4Confident79.2Confident166 Ų166105.9 Ų105.972%0.72252%0.519SS*.Hα-helixtrans-66.4-25.5172-73.7-179.8178.8-175.50112.6V227 Y228 R229V227-K231 WeakPolarHBondContact O-CG 3.32Å; V227-K231 PolarHBondContact O-N 3.33Å; Y228-K231 PolarHBondContact O-N 3.46Å; R229-K231 VanDerWaalsContact C-N 3.3Å; R229-K231 PolarHBondContact O-N 2.98Å
232L76.3Confident78.7Confident128 Ų12899.9 Ų99.967%0.6750%0.497SS*.Hα-helixtrans-79.1-25.9175.3-73.7145.5000112.6Y228 R229 S230Y228-L232 HydrophobicContact CD1-CD1 4.42Å; Y228-L232 HydrophobicContact CE1-CD1 4.18Å; R229-L232 WeakPolarHBondContact O-CB 3.48Å; R229-L232 PolarHBondContact O-N 3.29Å; R229-L232 VanDerWaalsContact O-N 3.15Å; S230-L232 PolarHBondContact O-N 3.43Å
233I72.9Confident78.4Confident110 Ų110100 Ų10056%0.56450%0.499SS*.SBendtrans-114.396.4-176.2-53.7171.4000106.8R229 S230 H235R229-I233 PolarHBondContact O-N 3.27Å; S230-I233 CarbonylContact O-C 3.57Å; S230-I233 PolarHBondContact O-N 2.89Å; I233-H235 HydrophobicContact CG2-CB 4.37Å; I233-H235 PolarHBondContact O-N 3.21Å
234N69.6Low78.3Confident166 Ų166101.7 Ų101.789%0.88850%0.503SS*.  trans-62.530.5-173.6-106.6-18.2000116
235H62.9Low78.3Confident125 Ų12598.3 Ų98.358%0.57948%0.48SS*.  trans-84.2115.1-179.7-132.3-69.7000110.8I233 D237I233-H235 HydrophobicContact CG2-CB 4.37Å; I233-H235 PolarHBondContact O-N 3.21Å; H235-D237 IonicContact CE1-OD1 3.38Å; H235-D237 PolarHBondContact CE1-OD1 3.43Å; H235-D237 IonicContact CG-OD1 3.87Å; H235-D237 IonicContact CG-OD2 3.9Å; H235-D237 VanDerWaalsContact ND1-CG 3.3Å; H235-D237 IonicContact ND1-OD1 3.98Å; H235-D237 PolarHBondContact ND1-OD1 2.92Å; H235-D237 IonicContact ND1-OD2 2.78Å; H235-D237 PolarHBondContact ND1-OD2 3.1Å
236K61.8Low78.4Confident199 Ų19996.8 Ų96.887%0.86547%0.469SS*.  trans-9291169.6-75.1-177.7177.5176.40108.8
237D71.8Confident78.8Confident74 Ų7494.5 Ų94.540%0.39646%0.455SS..  trans-99.6121.9172.9-64.8-28000110.4H235 E239 S240 N241H235-D237 IonicContact CE1-OD1 3.38Å; H235-D237 PolarHBondContact CE1-OD1 3.43Å; H235-D237 IonicContact CG-OD1 3.87Å; H235-D237 IonicContact CG-OD2 3.9Å; H235-D237 VanDerWaalsContact ND1-CG 3.3Å; H235-D237 IonicContact ND1-OD1 3.98Å; H235-D237 PolarHBondContact ND1-OD1 2.92Å; H235-D237 IonicContact ND1-OD2 2.78Å; H235-D237 PolarHBondContact ND1-OD2 3.1Å; D237-E239 PolarHBondContact O-N 2.87Å; D237-S240 WeakPolarHBondContact O-CB 3.06Å; D237-S240 PolarHBondContact O-N 3.27Å; D237-S240 PolarHBondContact O-OG 2.86Å; D237-N241 PolarHBondContact O-N 3.32Å
238D72.1Confident79.3Confident138 Ų13895.4 Ų95.474%0.73846%0.458SS*.Hα-helixtrans-59.9-33.6177-76.5-26000112.4S240 N241 N242D238-S240 VanDerWaalsContact C-N 3.3Å; D238-S240 PolarHBondContact O-N 3.37Å; D238-N241 WeakPolarHBondContact O-CB 3.45Å; D238-N241 PolarHBondContact O-N 2.97Å; D238-N242 PolarHBondContact O-N 3.39Å; D238-N242 VanDerWaalsContact O-N 3.11Å
239E74.6Confident79.7Confident157 Ų15787.5 Ų87.573%0.73443%0.427SS*.Hα-helixtrans-62.2-39.4174.5-171.1172.1-173.600111.5D237 N241 N242 E243D237-E239 PolarHBondContact O-N 2.87Å; E239-N241 VanDerWaalsContact C-N 3.29Å; E239-N241 PolarHBondContact O-N 3.47Å; E239-N242 PolarHBondContact O-N 2.96Å; E239-E243 PolarHBondContact O-N 3.35Å
240S78.1Confident80.3Confident38 Ų3879.9 Ų79.927%0.26640%0.398SS..Hα-helixtrans-64.6-34.9176.182.60000112.1D237 D238 R244D237-S240 WeakPolarHBondContact O-CB 3.06Å; D237-S240 PolarHBondContact O-N 3.27Å; D237-S240 PolarHBondContact O-OG 2.86Å; D238-S240 VanDerWaalsContact C-N 3.3Å; D238-S240 PolarHBondContact O-N 3.37Å; S240-R244 WeakPolarHBondContact O-CB 3.21Å; S240-R244 WeakPolarHBondContact O-CG 3.24Å; S240-R244 PolarHBondContact O-N 3.48Å
241N81.8Confident81Confident77 Ų7779.4 Ų79.441%0.41239%0.392SS..Hα-helixtrans-69.2-38.9177.3-73.5-28.2000111.6D237 D238 E239 G245D237-N241 PolarHBondContact O-N 3.32Å; D238-N241 WeakPolarHBondContact O-CB 3.45Å; D238-N241 PolarHBondContact O-N 2.97Å; E239-N241 VanDerWaalsContact C-N 3.29Å; E239-N241 PolarHBondContact O-N 3.47Å; N241-G245 PolarHBondContact O-N 3.4Å
242N83.2Confident81.8Confident35 Ų3572.4 Ų72.419%0.18737%0.365CS..Hα-helixtrans-66.3-45.6176.3-17023.5000111.8D238 E239 R244 G245 K246 T318D238-N242 PolarHBondContact O-N 3.39Å; D238-N242 VanDerWaalsContact O-N 3.11Å; E239-N242 PolarHBondContact O-N 2.96Å; N242-R244 VanDerWaalsContact C-N 3.34Å; N242-R244 PolarHBondContact O-N 3.12Å; N242-G245 PolarHBondContact O-N 2.95Å; N242-G245 VanDerWaalsContact O-N 3.14Å; N242-K246 PolarHBondContact O-N 2.92Å; N242-T318 PolarHBondContact ND2-OG1 3.09Å; N242-T318 PolarHBondContact OD1-OG1 3.44Å
243E83.6Confident82.7Confident54 Ų5466.6 Ų66.625%0.25234%0.335SS..Hα-helixtrans-63.6-39.7176.9-71.6-54.811900112.1Q141 E239 G245 K246 V247Q141-E243 VanDerWaalsContact NE2-CD 3.32Å; Q141-E243 PolarHBondContact NE2-OE1 3.38Å; Q141-E243 VanDerWaalsContact NE2-OE1 3.13Å; Q141-E243 PolarHBondContact NE2-OE2 3.06Å; Q141-E243 PolarHBondContact OE1-OE1 3.34Å; E239-E243 PolarHBondContact O-N 3.35Å; E243-G245 VanDerWaalsContact C-N 3.34Å; E243-G245 PolarHBondContact O-N 3.38Å; E243-K246 PolarHBondContact O-N 3.36Å; E243-K246 IonicContact OE1-NZ 3.4Å; E243-K246 PolarHBondContact OE1-NZ 2.93Å; E243-V247 WeakPolarHBondContact O-CG2 3.44Å; E243-V247 PolarHBondContact O-N 3.29Å; E243-V247 VanDerWaalsContact O-N 3.11Å
244R85.9Confident83.8Confident73 Ų7361.4 Ų61.428%0.27531%0.308SS..Hα-helixtrans-59.7-44171.1-76.8172.6180178.53.4111.7S230 S240 N242 K246 V247 I248S230-R244 PolarHBondContact OG-NH2 3.01Å; S240-R244 WeakPolarHBondContact O-CB 3.21Å; S240-R244 WeakPolarHBondContact O-CG 3.24Å; S240-R244 PolarHBondContact O-N 3.48Å; N242-R244 VanDerWaalsContact C-N 3.34Å; N242-R244 PolarHBondContact O-N 3.12Å; R244-K246 VanDerWaalsContact C-N 3.33Å; R244-K246 PolarHBondContact O-N 3.18Å; R244-V247 PolarHBondContact O-N 3.24Å; R244-I248 VanDerWaalsContact O-CG1 3.29Å; R244-I248 WeakPolarHBondContact O-CG1 3.46Å; R244-I248 PolarHBondContact O-N 3.41Å
245G89.2Confident85Confident5 Ų558.1 Ų58.15%0.05229%0.289CS..Hα-helixtrans-58.2-42.7176.900000112.8N241 N242 E243 V247 I248 A249 F315N241-G245 PolarHBondContact O-N 3.4Å; N242-G245 PolarHBondContact O-N 2.95Å; N242-G245 VanDerWaalsContact O-N 3.14Å; E243-G245 VanDerWaalsContact C-N 3.34Å; E243-G245 PolarHBondContact O-N 3.38Å; G245-V247 PolarHBondContact O-N 3.37Å; G245-I248 PolarHBondContact O-N 2.88Å; G245-A249 VanDerWaalsContact O-CB 3.31Å; G245-A249 WeakPolarHBondContact O-CB 3.43Å; G245-A249 PolarHBondContact O-N 3.37Å; G245-F315 CarbonylContact C-O 3.37Å; G245-F315 WeakPolarHBondContact CA-O 3.44Å
246K90.7Very high86.5Confident10 Ų1053.9 Ų53.94%0.04327%0.271CS..Hα-helixtrans-61-43.2174.2-71.1175.7-172.81650112.5F55 N242 E243 R244 H250 M316F55-K246 HydrophobicContact CB-CD 4.48Å; F55-K246 HydrophobicContact CD1-CD 4.5Å; F55-K246 HydrophobicContact CD1-CG 4.46Å; F55-K246 HydrophobicContact CD2-CB 3.79Å; F55-K246 HydrophobicContact CD2-CD 3.96Å; F55-K246 HydrophobicContact CD2-CG 3.88Å; F55-K246 HydrophobicContact CE1-CG 4.33Å; F55-K246 HydrophobicContact CE2-CB 3.45Å; F55-K246 VanDerWaalsContact CE2-CB 3.45Å; F55-K246 HydrophobicContact CE2-CD 4.31Å; F55-K246 HydrophobicContact CE2-CG 3.7Å; F55-K246 HydrophobicContact CG-CD 4.08Å; F55-K246 HydrophobicContact CG-CG 4.28Å; F55-K246 HydrophobicContact CZ-CB 4.1Å; F55-K246 HydrophobicContact CZ-CG 3.97Å; N242-K246 PolarHBondContact O-N 2.92Å; E243-K246 PolarHBondContact O-N 3.36Å; E243-K246 IonicContact OE1-NZ 3.4Å; E243-K246 PolarHBondContact OE1-NZ 2.93Å; R244-K246 VanDerWaalsContact C-N 3.33Å; R244-K246 PolarHBondContact O-N 3.18Å; K246-H250 WeakPolarHBondContact O-CB 3.5Å; K246-H250 PolarHBondContact O-N 3.28Å; K246-M316 HydrophobicContact CD-CE 4.45Å; K246-M316 HydrophobicContact CG-CE 3.95Å; K246-M316 HydrophobicContact CG-SD 4.29Å
247V92Very high88.1Confident13 Ų1345.4 Ų45.48%0.07923%0.234CC..Hα-helixtrans-66-44.3177.9175.30000111.1I133 I219 L223 E243 R244 G245 H250 L251I133-V247 HydrophobicContact CD1-CG1 3.89Å; I133-V247 HydrophobicContact CD1-CG2 3.88Å; I133-V247 HydrophobicContact CG1-CG2 4.2Å; I219-V247 HydrophobicContact CG2-CG1 3.71Å; L223-V247 HydrophobicContact CD2-CG1 4.33Å; E243-V247 WeakPolarHBondContact O-CG2 3.44Å; E243-V247 PolarHBondContact O-N 3.29Å; E243-V247 VanDerWaalsContact O-N 3.11Å; R244-V247 PolarHBondContact O-N 3.24Å; G245-V247 PolarHBondContact O-N 3.37Å; V247-H250 PolarHBondContact O-N 2.75Å; V247-L251 WeakPolarHBondContact O-CB 3.39Å; V247-L251 PolarHBondContact O-N 3.24Å
248I92.4Very high89Confident72 Ų7242.9 Ų42.937%0.36922%0.221SC..Hα-helixtrans-64.6-43.3178.2-65166.4000110.7R244 G245 H250 L251 A252 F315R244-I248 VanDerWaalsContact O-CG1 3.29Å; R244-I248 WeakPolarHBondContact O-CG1 3.46Å; R244-I248 PolarHBondContact O-N 3.41Å; G245-I248 PolarHBondContact O-N 2.88Å; I248-H250 PolarHBondContact O-N 3.35Å; I248-L251 PolarHBondContact O-N 3.04Å; I248-A252 WeakPolarHBondContact O-CB 3.33Å; I248-A252 PolarHBondContact O-N 3.16Å; I248-F315 HydrophobicContact CB-CB 4.47Å; I248-F315 HydrophobicContact CG2-CB 4.04Å; I248-F315 HydrophobicContact CG2-CD1 3.39Å; I248-F315 HydrophobicContact CG2-CD2 4.49Å; I248-F315 HydrophobicContact CG2-CE1 3.91Å; I248-F315 HydrophobicContact CG2-CG 3.72Å
249A94.3Very high90.1Very high0 Ų039.3 Ų39.30%021%0.207CC..Hα-helixtrans-59.5-47176.500000111.5G245 L251 A252 I253 Y312 F315G245-A249 VanDerWaalsContact O-CB 3.31Å; G245-A249 WeakPolarHBondContact O-CB 3.43Å; G245-A249 PolarHBondContact O-N 3.37Å; A249-L251 PolarHBondContact O-N 3.48Å; A249-A252 PolarHBondContact O-N 2.92Å; A249-I253 WeakPolarHBondContact O-CG1 3.22Å; A249-I253 PolarHBondContact O-N 3.01Å; A249-Y312 HydrophobicContact CB-CD1 4.31Å; A249-F315 HydrophobicContact CB-CB 3.94Å
250H94Very high90.9Very high0 Ų033.4 Ų33.40%018%0.18CC..Hα-helixtrans-61.3-42.3176.8175.274.5000112.5F125 S126 R129 K246 V247 I248 A252 I253 S254F125-H250 AromaticContact CD1-ND1 3.51Å; F125-H250 AromaticContact CD2-ND1 3.88Å; F125-H250 AromaticContact CE1-ND1 3.84Å; F125-H250 AromaticContact CG-CE1 3.91Å; F125-H250 AromaticContact CG-ND1 3.55Å; F125-H250 HydrophobicContact CZ-CB 4.47Å; S126-H250 WeakPolarHBondContact CA-NE2 3.38Å; S126-H250 PolarHBondContact N-CE1 2.92Å; S126-H250 PolarHBondContact OG-CE1 3.4Å; S126-H250 VanDerWaalsContact OG-CE1 3.24Å; S126-H250 PolarHBondContact OG-NE2 3.04Å; R129-H250 HydrophobicContact CG-CB 4.2Å; K246-H250 WeakPolarHBondContact O-CB 3.5Å; K246-H250 PolarHBondContact O-N 3.28Å; V247-H250 PolarHBondContact O-N 2.75Å; I248-H250 PolarHBondContact O-N 3.35Å; H250-A252 VanDerWaalsContact C-N 3.34Å; H250-I253 PolarHBondContact O-N 2.92Å; H250-S254 VanDerWaalsContact O-CB 3.31Å; H250-S254 WeakPolarHBondContact O-CB 3.38Å; H250-S254 PolarHBondContact O-N 3.26Å; H250-S254 PolarHBondContact O-OG 3.02Å
251L94.8Very high91.5Very high27 Ų2731.9 Ų31.914%0.14117%0.17CC..Hα-helixtrans-62-43.2175.7-17671.5000111N216 L220 V247 I248 A249 S254 I255N216-L251 HydrophobicContact CB-CD1 4.01Å; L220-L251 HydrophobicContact CD1-CD1 4.46Å; L220-L251 HydrophobicContact CD2-CD1 4.4Å; L220-L251 HydrophobicContact CD2-CD2 3.69Å; L220-L251 HydrophobicContact CG-CD1 4.26Å; L220-L251 HydrophobicContact CG-CD2 4.43Å; V247-L251 WeakPolarHBondContact O-CB 3.39Å; V247-L251 PolarHBondContact O-N 3.24Å; I248-L251 PolarHBondContact O-N 3.04Å; A249-L251 PolarHBondContact O-N 3.48Å; L251-S254 PolarHBondContact O-N 2.85Å; L251-I255 HydrophobicContact CD1-CD1 4.31Å; L251-I255 HydrophobicContact CD2-CD1 4.36Å; L251-I255 HydrophobicContact CG-CD1 3.85Å; L251-I255 HydrophobicContact CG-CG1 4.47Å; L251-I255 VanDerWaalsContact O-CG1 3.26Å; L251-I255 WeakPolarHBondContact O-CG1 3.44Å; L251-I255 PolarHBondContact O-N 2.97Å
252A95.9Very high91.9Very high19 Ų1932.5 Ų32.516%0.15717%0.172CC..Hα-helixtrans-63.4-45178.800000112.2I248 A249 H250 S254 I255 L256 L311 F315I248-A252 WeakPolarHBondContact O-CB 3.33Å; I248-A252 PolarHBondContact O-N 3.16Å; A249-A252 PolarHBondContact O-N 2.92Å; H250-A252 VanDerWaalsContact C-N 3.34Å; A252-S254 VanDerWaalsContact C-N 3.29Å; A252-S254 PolarHBondContact O-N 3.03Å; A252-I255 PolarHBondContact O-N 3.45Å; A252-L256 WeakPolarHBondContact O-CB 3.45Å; A252-L256 PolarHBondContact O-N 3.21Å; A252-L311 HydrophobicContact CB-CD2 4.08Å; A252-F315 HydrophobicContact CB-CD2 3.81Å; A252-F315 HydrophobicContact CB-CE2 3.5Å; A252-F315 HydrophobicContact CB-CZ 4.33Å
253I95.8Very high92.4Very high7 Ų732.8 Ų32.84%0.03618%0.176CC..Hα-helixtrans-58.6-45174.2-67.3164.3000110.1M62 L122 A249 H250 I255 L256 F257 L311 Y312M62-I253 HydrophobicContact SD-CG2 4.49Å; L122-I253 HydrophobicContact CD1-CG2 3.93Å; A249-I253 WeakPolarHBondContact O-CG1 3.22Å; A249-I253 PolarHBondContact O-N 3.01Å; H250-I253 PolarHBondContact O-N 2.92Å; I253-I255 PolarHBondContact O-N 3.32Å; I253-L256 PolarHBondContact O-N 3.26Å; I253-F257 WeakPolarHBondContact O-CB 3.4Å; I253-F257 PolarHBondContact O-N 3.15Å; I253-L311 HydrophobicContact CB-CD1 4.27Å; I253-L311 HydrophobicContact CG1-CB 4.26Å; I253-L311 HydrophobicContact CG1-CD1 3.56Å; I253-Y312 HydrophobicContact CD1-CD1 4.47Å; I253-Y312 HydrophobicContact CD1-CE1 3.63Å; I253-Y312 HydrophobicContact CD1-CE2 4.45Å; I253-Y312 WeakPolarHBondContact CD1-OH 3.33Å
254S95.1Very high92.8Very high0 Ų030.6 Ų30.60%017%0.166CC..Hα-helixtrans-67.3-36.4-178.5-61.60000113.5N216 H250 L251 A252 T258N216-S254 WeakPolarHBondContact ND2-CB 3.28Å; H250-S254 VanDerWaalsContact O-CB 3.31Å; H250-S254 WeakPolarHBondContact O-CB 3.38Å; H250-S254 PolarHBondContact O-N 3.26Å; H250-S254 PolarHBondContact O-OG 3.02Å; L251-S254 PolarHBondContact O-N 2.85Å; A252-S254 VanDerWaalsContact C-N 3.29Å; A252-S254 PolarHBondContact O-N 3.03Å; S254-T258 WeakPolarHBondContact O-CB 3.41Å; S254-T258 PolarHBondContact O-N 3.04Å; S254-T258 PolarHBondContact O-OG1 3.14Å
255I94.5Very high92.9Very high97 Ų9728.1 Ų28.150%0.49716%0.159SC..Hα-helixtrans-68.1-43174.1-70.6167.2000110.4L251 A252 I253 T258 S259L251-I255 HydrophobicContact CD1-CD1 4.31Å; L251-I255 HydrophobicContact CD2-CD1 4.36Å; L251-I255 HydrophobicContact CG-CD1 3.85Å; L251-I255 HydrophobicContact CG-CG1 4.47Å; L251-I255 VanDerWaalsContact O-CG1 3.26Å; L251-I255 WeakPolarHBondContact O-CG1 3.44Å; L251-I255 PolarHBondContact O-N 2.97Å; A252-I255 PolarHBondContact O-N 3.45Å; I253-I255 PolarHBondContact O-N 3.32Å; I255-T258 PolarHBondContact O-N 3.12Å; I255-S259 VanDerWaalsContact O-CB 3.28Å; I255-S259 WeakPolarHBondContact O-CB 3.32Å; I255-S259 PolarHBondContact O-N 2.95Å; I255-S259 PolarHBondContact O-OG 2.9Å
256L95.5Very high93Very high36 Ų3631.4 Ų31.419%0.18818%0.178CC..Hα-helixtrans-61.1-49.8176.2-174.865.6000110.3A252 I253 T258 S259 L260 N304 F307 L311A252-L256 WeakPolarHBondContact O-CB 3.45Å; A252-L256 PolarHBondContact O-N 3.21Å; I253-L256 PolarHBondContact O-N 3.26Å; L256-T258 PolarHBondContact O-N 3.34Å; L256-S259 PolarHBondContact O-N 3.39Å; L256-S259 PolarHBondContact O-OG 3.31Å; L256-L260 HydrophobicContact CD1-CD1 3.93Å; L256-L260 HydrophobicContact CD1-CG 4.32Å; L256-L260 HydrophobicContact CG-CD1 4.18Å; L256-L260 PolarHBondContact O-N 3.34Å; L256-N304 VanDerWaalsContact C-OD1 3.22Å; L256-N304 WeakPolarHBondContact CG-OD1 3.2Å; L256-N304 PolarHBondContact O-OD1 3.48Å; L256-F307 HydrophobicContact CD2-CB 3.85Å; L256-F307 HydrophobicContact CD2-CD2 4.21Å; L256-L311 HydrophobicContact CD2-CD1 4.02Å
257F94.3Very high93.1Very high22 Ų2231.8 Ų31.810%0.09618%0.18CC..Hα-helixtrans-52.8-53.1175.7177-98.6000111.5L122 P208 I212 I253 S259 L260 S261 N304L122-F257 HydrophobicContact CD2-CB 3.84Å; L122-F257 HydrophobicContact CD2-CD1 3.9Å; L122-F257 HydrophobicContact CD2-CD2 3.94Å; L122-F257 HydrophobicContact CD2-CE1 4.49Å; L122-F257 HydrophobicContact CD2-CG 3.59Å; P208-F257 HydrophobicContact CB-CE1 4Å; P208-F257 HydrophobicContact CB-CZ 4Å; I212-F257 HydrophobicContact CD1-CD1 3.59Å; I212-F257 HydrophobicContact CD1-CE1 3.64Å; I253-F257 WeakPolarHBondContact O-CB 3.4Å; I253-F257 PolarHBondContact O-N 3.15Å; F257-S259 PolarHBondContact O-N 2.95Å; F257-L260 PolarHBondContact O-N 3.45Å; F257-S261 WeakPolarHBondContact O-CB 3.31Å; F257-S261 PolarHBondContact O-N 3.41Å; F257-S261 PolarHBondContact O-OG 3.43Å; F257-N304 VanDerWaalsContact CA-OD1 3.23Å; F257-N304 WeakPolarHBondContact CA-OD1 3.49Å; F257-N304 PolarHBondContact N-OD1 2.97Å
258T92.3Very high92.9Very high20 Ų2031.9 Ų31.912%0.12318%0.18CC..Hα-helixtrans-64.5-42.6-177.7-54.70000111.9S254 I255 L256 L260 S261 I262S254-T258 WeakPolarHBondContact O-CB 3.41Å; S254-T258 PolarHBondContact O-N 3.04Å; S254-T258 PolarHBondContact O-OG1 3.14Å; I255-T258 PolarHBondContact O-N 3.12Å; L256-T258 PolarHBondContact O-N 3.34Å; T258-L260 VanDerWaalsContact C-N 3.35Å; T258-L260 PolarHBondContact O-N 3.27Å; T258-S261 PolarHBondContact O-N 3.48Å; T258-I262 HydrophobicContact CG2-CD1 3.71Å; T258-I262 HydrophobicContact CG2-CG1 4.24Å; T258-I262 WeakPolarHBondContact O-CD1 3.38Å; T258-I262 VanDerWaalsContact O-CG1 3.24Å; T258-I262 WeakPolarHBondContact O-CG1 3.37Å; T258-I262 PolarHBondContact O-N 2.79Å
259S93.5Very high92.7Very high63 Ų6331.5 Ų31.544%0.44118%0.178SC..Hα-helixtrans-67.4-34.2-177.264.10000113I255 L256 F257 P263I255-S259 VanDerWaalsContact O-CB 3.28Å; I255-S259 WeakPolarHBondContact O-CB 3.32Å; I255-S259 PolarHBondContact O-N 2.95Å; I255-S259 PolarHBondContact O-OG 2.9Å; L256-S259 PolarHBondContact O-N 3.39Å; L256-S259 PolarHBondContact O-OG 3.31Å; F257-S259 PolarHBondContact O-N 2.95Å; S259-P263 WeakPolarHBondContact O-CD 3.3Å
260L92.8Very high92.5Very high33 Ų3333.9 Ų33.917%0.17319%0.191CC..Hα-helixtrans-84.8-32.1176.2-64.2-178.3000112.9L256 F257 T258 P263 V300 F303 N304L256-L260 HydrophobicContact CD1-CD1 3.93Å; L256-L260 HydrophobicContact CD1-CG 4.32Å; L256-L260 HydrophobicContact CG-CD1 4.18Å; L256-L260 PolarHBondContact O-N 3.34Å; F257-L260 PolarHBondContact O-N 3.45Å; T258-L260 VanDerWaalsContact C-N 3.35Å; T258-L260 PolarHBondContact O-N 3.27Å; L260-P263 WeakPolarHBondContact O-CD 3.2Å; L260-V300 HydrophobicContact CD2-CG1 3.96Å; L260-F303 HydrophobicContact CD1-CB 3.63Å; L260-N304 WeakPolarHBondContact CB-ND2 3.09Å; L260-N304 HydrophobicContact CD1-CB 4.48Å
261S90Very high92.3Very high6 Ų637.9 Ų37.94%0.04221%0.205CC..Hα-helixtrans-72.6-34.4178.7-73.50000113F257 T258 L264 V265F257-S261 WeakPolarHBondContact O-CB 3.31Å; F257-S261 PolarHBondContact O-N 3.41Å; F257-S261 PolarHBondContact O-OG 3.43Å; T258-S261 PolarHBondContact O-N 3.48Å; S261-L264 PolarHBondContact O-N 3.33Å; S261-V265 VanDerWaalsContact O-CG2 3.24Å; S261-V265 WeakPolarHBondContact O-CG2 3.28Å; S261-V265 PolarHBondContact O-N 3.31Å
262I90.6Very high91.8Very high91 Ų9138.6 Ų38.647%0.46721%0.208SC..Hα-helixtrans-57.8-53.1-178-75165.4000112.2T258 L264 V265 V266T258-I262 HydrophobicContact CG2-CD1 3.71Å; T258-I262 HydrophobicContact CG2-CG1 4.24Å; T258-I262 WeakPolarHBondContact O-CD1 3.38Å; T258-I262 VanDerWaalsContact O-CG1 3.24Å; T258-I262 WeakPolarHBondContact O-CG1 3.37Å; T258-I262 PolarHBondContact O-N 2.79Å; I262-L264 VanDerWaalsContact C-N 3.28Å; I262-L264 PolarHBondContact O-N 3.38Å; I262-V265 PolarHBondContact O-N 2.87Å; I262-V266 HydrophobicContact CG2-CG2 4.48Å; I262-V266 WeakPolarHBondContact O-CG2 3.48Å; I262-V266 PolarHBondContact O-N 2.62Å
263P93.1Very high91.5Very high41 Ų4142.1 Ų42.127%0.26622%0.221SC..Hα-helixtrans-58-40.6177.1-25.734.5000112.8S259 L260 V266 M267 F297S259-P263 WeakPolarHBondContact O-CD 3.3Å; L260-P263 WeakPolarHBondContact O-CD 3.2Å; P263-V266 PolarHBondContact O-N 3.04Å; P263-M267 WeakPolarHBondContact O-CB 3.48Å; P263-M267 VanDerWaalsContact O-CG 3.29Å; P263-M267 WeakPolarHBondContact O-CG 3.48Å; P263-M267 PolarHBondContact O-N 2.67Å; P263-F297 HydrophobicContact CB-CD1 3.51Å; P263-F297 HydrophobicContact CB-CD2 4.49Å; P263-F297 HydrophobicContact CB-CE1 3.43Å; P263-F297 VanDerWaalsContact CB-CE1 3.43Å; P263-F297 HydrophobicContact CB-CE2 4.41Å; P263-F297 HydrophobicContact CB-CG 4.06Å; P263-F297 HydrophobicContact CB-CZ 3.9Å; P263-F297 HydrophobicContact CG-CD1 4.45Å; P263-F297 HydrophobicContact CG-CE1 4.22Å
264L91.3Very high91.1Very high7 Ų741.9 Ų41.94%0.03722%0.22CC..Hα-helixtrans-62.4-47.2177.5179.958.3000111.5S261 I262 V266 M267 I268 F297 D301S261-L264 PolarHBondContact O-N 3.33Å; I262-L264 VanDerWaalsContact C-N 3.28Å; I262-L264 PolarHBondContact O-N 3.38Å; L264-V266 PolarHBondContact O-N 3.28Å; L264-M267 PolarHBondContact O-N 2.78Å; L264-I268 HydrophobicContact CD1-CD1 3.8Å; L264-I268 HydrophobicContact CD1-CG1 4.13Å; L264-I268 HydrophobicContact CG-CD1 3.78Å; L264-I268 VanDerWaalsContact O-CG1 3.24Å; L264-I268 WeakPolarHBondContact O-CG1 3.41Å; L264-I268 PolarHBondContact O-N 3.2Å; L264-F297 HydrophobicContact CB-CB 4.23Å; L264-F297 HydrophobicContact CD1-CB 4.12Å; L264-D301 HydrophobicContact CD2-CB 4.28Å
265V88Confident90.6Very high21 Ų2147.3 Ų47.313%0.12724%0.241CC..Hα-helixtrans-57-49.9176.2170.90000111A205 I206 S261 I262 M267 I268 I269A205-V265 HydrophobicContact CB-CG2 3.36Å; I206-V265 HydrophobicContact CG1-CG1 3.97Å; S261-V265 VanDerWaalsContact O-CG2 3.24Å; S261-V265 WeakPolarHBondContact O-CG2 3.28Å; S261-V265 PolarHBondContact O-N 3.31Å; I262-V265 PolarHBondContact O-N 2.87Å; V265-M267 VanDerWaalsContact C-N 3.31Å; V265-M267 PolarHBondContact O-N 3.5Å; V265-I268 PolarHBondContact O-N 3.11Å; V265-I269 HydrophobicContact CG1-CD1 3.7Å; V265-I269 HydrophobicContact CG1-CG1 4.39Å; V265-I269 WeakPolarHBondContact O-CG1 3.33Å; V265-I269 PolarHBondContact O-N 2.98Å
266V92.1Very high90.1Very high74 Ų7450.2 Ų50.245%0.44825%0.251SS..Hα-helixtrans-57.9-46.6179.51720000110.3I262 P263 L264 I268 I269 L270I262-V266 HydrophobicContact CG2-CG2 4.48Å; I262-V266 WeakPolarHBondContact O-CG2 3.48Å; I262-V266 PolarHBondContact O-N 2.62Å; P263-V266 PolarHBondContact O-N 3.04Å; L264-V266 PolarHBondContact O-N 3.28Å; V266-I268 VanDerWaalsContact C-N 3.34Å; V266-I268 PolarHBondContact O-N 2.86Å; V266-I269 PolarHBondContact O-N 3.12Å; V266-L270 HydrophobicContact CG1-CD1 4.01Å; V266-L270 HydrophobicContact CG1-CG 4.48Å; V266-L270 WeakPolarHBondContact O-CB 3.14Å; V266-L270 VanDerWaalsContact O-CG 3.31Å; V266-L270 WeakPolarHBondContact O-CG 3.23Å; V266-L270 PolarHBondContact O-N 2.87Å
267M92.9Very high89.8Confident18 Ų1854.8 Ų54.89%0.08927%0.267CS..Hα-helixtrans-64.9-36.3179.4-71.8-50.9-49.100113.4P263 L264 V265 L270 R271 I290 Y293 F297P263-M267 WeakPolarHBondContact O-CB 3.48Å; P263-M267 VanDerWaalsContact O-CG 3.29Å; P263-M267 WeakPolarHBondContact O-CG 3.48Å; P263-M267 PolarHBondContact O-N 2.67Å; L264-M267 PolarHBondContact O-N 2.78Å; V265-M267 VanDerWaalsContact C-N 3.31Å; V265-M267 PolarHBondContact O-N 3.5Å; M267-L270 HydrophobicContact SD-CD1 4.23Å; M267-R271 VanDerWaalsContact O-CB 3.28Å; M267-R271 WeakPolarHBondContact O-CB 3.41Å; M267-R271 PolarHBondContact O-N 3.34Å; M267-I290 HydrophobicContact CE-CB 4.27Å; M267-I290 HydrophobicContact CE-CD1 3.68Å; M267-I290 HydrophobicContact CE-CG2 3.93Å; M267-I290 WeakPolarHBondContact CE-O 3.37Å; M267-Y293 HydrophobicContact CE-CD2 4.44Å; M267-Y293 HydrophobicContact CE-CG 4.33Å; M267-F297 HydrophobicContact CG-CD2 3.54Å; M267-F297 HydrophobicContact CG-CE2 3.86Å; M267-F297 HydrophobicContact SD-CE2 4.43Å
268I86.8Confident89.5Confident16 Ų1660.2 Ų60.28%0.08229%0.29CS..Hα-helixtrans-71.5-40.4177.6-62.4162.1000111.1Y200 I201 L264 V265 V266 R271 Q272Y200-I268 HydrophobicContact CD1-CD1 4.14Å; Y200-I268 HydrophobicContact CE1-CD1 3.66Å; I201-I268 HydrophobicContact CD1-CG2 3.32Å; I201-I268 HydrophobicContact CG1-CB 4.38Å; I201-I268 HydrophobicContact CG1-CG2 3.34Å; L264-I268 HydrophobicContact CD1-CD1 3.8Å; L264-I268 HydrophobicContact CD1-CG1 4.13Å; L264-I268 HydrophobicContact CG-CD1 3.78Å; L264-I268 VanDerWaalsContact O-CG1 3.24Å; L264-I268 WeakPolarHBondContact O-CG1 3.41Å; L264-I268 PolarHBondContact O-N 3.2Å; V265-I268 PolarHBondContact O-N 3.11Å; V266-I268 VanDerWaalsContact C-N 3.34Å; V266-I268 PolarHBondContact O-N 2.86Å; I268-R271 WeakPolarHBondContact O-CB 3.45Å; I268-R271 PolarHBondContact O-N 3.01Å; I268-Q272 WeakPolarHBondContact O-CG 3.34Å; I268-Q272 PolarHBondContact O-N 2.88Å
269I88.5Confident89.4Confident63 Ų6363.5 Ų63.532%0.32330%0.301SS..Hα-helixtrans-60.7-46.9174.7-67.8169.4000110.2I206 V265 V266 R271 Q272 Q273I206-I269 HydrophobicContact CD1-CD1 4.45Å; V265-I269 HydrophobicContact CG1-CD1 3.7Å; V265-I269 HydrophobicContact CG1-CG1 4.39Å; V265-I269 WeakPolarHBondContact O-CG1 3.33Å; V265-I269 PolarHBondContact O-N 2.98Å; V266-I269 PolarHBondContact O-N 3.12Å; I269-R271 VanDerWaalsContact C-N 3.29Å; I269-R271 PolarHBondContact O-N 3.08Å; I269-Q272 WeakPolarHBondContact O-CB 3.36Å; I269-Q272 PolarHBondContact O-N 3.32Å; I269-Q272 VanDerWaalsContact O-N 3.12Å; I269-Q273 WeakPolarHBondContact O-CG 3.39Å; I269-Q273 PolarHBondContact O-N 3.44Å
270L91.5Very high89.1Confident51 Ų5163.7 Ų63.727%0.26730%0.297SS..Hα-helixtrans-59-42175.3-72.3173.5000111.5V266 M267 Q272 Q273 L274 I290V266-L270 HydrophobicContact CG1-CD1 4.01Å; V266-L270 HydrophobicContact CG1-CG 4.48Å; V266-L270 WeakPolarHBondContact O-CB 3.14Å; V266-L270 VanDerWaalsContact O-CG 3.31Å; V266-L270 WeakPolarHBondContact O-CG 3.23Å; V266-L270 PolarHBondContact O-N 2.87Å; M267-L270 HydrophobicContact SD-CD1 4.23Å; L270-Q272 VanDerWaalsContact C-N 3.32Å; L270-Q272 PolarHBondContact O-N 3.22Å; L270-Q273 PolarHBondContact O-N 3.49Å; L270-L274 WeakPolarHBondContact O-CB 3.46Å; L270-L274 PolarHBondContact O-N 2.98Å; L270-I290 HydrophobicContact CB-CD1 4.46Å; L270-I290 HydrophobicContact CB-CG2 4.24Å; L270-I290 HydrophobicContact CD1-CD1 4.31Å
271R88.7Confident89Confident83 Ų8368 Ų6831%0.31332%0.319SS..Hα-helixtrans-63-36175.6-175173.7178.7-168-6.7112.4M267 I268 I269 L274 Y275 I290 S294M267-R271 VanDerWaalsContact O-CB 3.28Å; M267-R271 WeakPolarHBondContact O-CB 3.41Å; M267-R271 PolarHBondContact O-N 3.34Å; I268-R271 WeakPolarHBondContact O-CB 3.45Å; I268-R271 PolarHBondContact O-N 3.01Å; I269-R271 VanDerWaalsContact C-N 3.29Å; I269-R271 PolarHBondContact O-N 3.08Å; R271-L274 WeakPolarHBondContact O-CB 3.21Å; R271-Y275 HydrophobicContact CG-CD2 4.36Å; R271-Y275 HydrophobicContact CG-CE2 3.75Å; R271-Y275 WeakPolarHBondContact O-CD2 3.41Å; R271-Y275 PolarHBondContact O-N 3.47Å; R271-I290 HydrophobicContact CB-CG2 3.88Å; R271-S294 PolarHBondContact NH1-OG 3.36Å
272Q85.4Confident89.1Confident43 Ų4372.9 Ų72.920%0.20134%0.344CS..Hα-helixtrans-69.5-44.7174.3-73.3-164.6-34.100112.3L197 I201 I268 I269 L270 L274 Y275 F276L197-Q272 HydrophobicContact CD2-CG 4.13Å; I201-Q272 HydrophobicContact CD1-CG 3.96Å; I268-Q272 WeakPolarHBondContact O-CG 3.34Å; I268-Q272 PolarHBondContact O-N 2.88Å; I269-Q272 WeakPolarHBondContact O-CB 3.36Å; I269-Q272 PolarHBondContact O-N 3.32Å; I269-Q272 VanDerWaalsContact O-N 3.12Å; L270-Q272 VanDerWaalsContact C-N 3.32Å; L270-Q272 PolarHBondContact O-N 3.22Å; Q272-L274 PolarHBondContact O-N 3.39Å; Q272-Y275 PolarHBondContact O-N 3.22Å; Q272-F276 PolarHBondContact O-N 3.27Å
273Q87.9Confident89.2Confident92 Ų9275.4 Ų75.443%0.4335%0.349SS..Hα-helixtrans-58.5-40.6177.1-72.9-179.5-1900111.2I269 L270 Y275 F276 Y277I269-Q273 WeakPolarHBondContact O-CG 3.39Å; I269-Q273 PolarHBondContact O-N 3.44Å; L270-Q273 PolarHBondContact O-N 3.49Å; Q273-Y275 PolarHBondContact O-N 3.1Å; Q273-F276 PolarHBondContact O-N 2.9Å; Q273-Y277 HydrophobicContact CB-CD2 4.27Å; Q273-Y277 HydrophobicContact CB-CE2 4.41Å; Q273-Y277 WeakPolarHBondContact O-CD2 3.34Å; Q273-Y277 PolarHBondContact O-N 2.82Å
274L89.2Confident89.2Confident3 Ų377 Ų772%0.01636%0.359CS..Hα-helixtrans-53-50.1174.9179.7177.9000112L270 R271 Q272 K278 Y279 D280 A287 I290L270-L274 WeakPolarHBondContact O-CB 3.46Å; L270-L274 PolarHBondContact O-N 2.98Å; R271-L274 WeakPolarHBondContact O-CB 3.21Å; Q272-L274 PolarHBondContact O-N 3.39Å; L274-K278 PolarHBondContact O-N 3.22Å; L274-Y279 PolarHBondContact O-N 3.41Å; L274-D280 HydrophobicContact CD2-CB 3.71Å; L274-A287 HydrophobicContact CD1-CB 3.62Å; L274-A287 HydrophobicContact CD2-CB 3.77Å; L274-A287 HydrophobicContact CG-CB 3.85Å; L274-I290 HydrophobicContact CD1-CB 3.9Å; L274-I290 HydrophobicContact CD1-CG1 4.43Å; L274-I290 HydrophobicContact CD1-CG2 3.94Å
275Y83.1Confident89.2Confident113 Ų11382.7 Ų82.744%0.44339%0.385SS..Hα-helixtrans-71.8-35.2178.4-66.4-62.3000112.9R271 Q272 Q273 K278R271-Y275 HydrophobicContact CG-CD2 4.36Å; R271-Y275 HydrophobicContact CG-CE2 3.75Å; R271-Y275 WeakPolarHBondContact O-CD2 3.41Å; R271-Y275 PolarHBondContact O-N 3.47Å; Q272-Y275 PolarHBondContact O-N 3.22Å; Q273-Y275 PolarHBondContact O-N 3.1Å; Y275-K278 PolarHBondContact O-N 3.37Å
276F85.2Confident89.4Confident159 Ų15986.4 Ų86.470%0.69740%0.398SS*.Hα-helixtrans-64.8-42.9179.9-172-95.5000112Q272 Q273 K278Q272-F276 PolarHBondContact O-N 3.27Å; Q273-F276 PolarHBondContact O-N 2.9Å; F276-K278 VanDerWaalsContact C-N 3.34Å
277Y89.2Confident89.3Confident132 Ų13283.3 Ų83.352%0.51838%0.38SS..THydrogen-bonded Turntrans-90.17.6179.5-65.4-67.4000114Q273 Y279Q273-Y277 HydrophobicContact CB-CD2 4.27Å; Q273-Y277 HydrophobicContact CB-CE2 4.41Å; Q273-Y277 WeakPolarHBondContact O-CD2 3.34Å; Q273-Y277 PolarHBondContact O-N 2.82Å; Y277-Y279 HydrophobicContact CD2-CE2 4.17Å; Y277-Y279 HydrophobicContact CG-CE2 4.17Å; Y277-Y279 PolarHBondContact O-N 3.21Å
278K88.2Confident89.3Confident136 Ų13685.7 Ų85.759%0.59139%0.389SS*.THydrogen-bonded Turntrans55.733-178.1-56.5-178.8179.6179.20113.7L274 Y275 F276 D280 I281 L282L274-K278 PolarHBondContact O-N 3.22Å; Y275-K278 PolarHBondContact O-N 3.37Å; F276-K278 VanDerWaalsContact C-N 3.34Å; K278-D280 VanDerWaalsContact CA-OD1 3.24Å; K278-D280 WeakPolarHBondContact CA-OD1 3.49Å; K278-D280 PolarHBondContact O-N 2.97Å; K278-I281 HydrophobicContact CB-CD1 4.36Å; K278-I281 HydrophobicContact CD-CD1 4.47Å; K278-I281 PolarHBondContact O-N 3.46Å; K278-I281 VanDerWaalsContact O-N 3.08Å; K278-L282 PolarHBondContact O-N 3.1Å; K278-L282 VanDerWaalsContact O-N 3.12Å
279Y89.7Confident89.6Confident89 Ų8988.4 Ų88.435%0.34940%0.402SS..Hα-helixtrans-69.3-16.1176.3-72.3-46.1000112.8L274 Y277 I281 L282 Y283L274-Y279 PolarHBondContact O-N 3.41Å; Y277-Y279 HydrophobicContact CD2-CE2 4.17Å; Y277-Y279 HydrophobicContact CG-CE2 4.17Å; Y277-Y279 PolarHBondContact O-N 3.21Å; Y279-I281 PolarHBondContact O-N 3.36Å; Y279-L282 HydrophobicContact CD1-CB 4.34Å; Y279-L282 HydrophobicContact CD1-CD1 4.08Å; Y279-L282 HydrophobicContact CE1-CD1 4.38Å; Y279-Y283 AromaticContact CD1-CD2 3.54Å; Y279-Y283 HydrophobicContact CD1-CD2 3.54Å; Y279-Y283 AromaticContact CD1-CE2 3.87Å; Y279-Y283 HydrophobicContact CD1-CE2 3.87Å; Y279-Y283 HydrophobicContact CE1-CD2 4.02Å; Y279-Y283 AromaticContact CE1-CE2 3.89Å; Y279-Y283 HydrophobicContact CE1-CE2 3.89Å; Y279-Y283 HydrophobicContact CG-CD2 4.42Å; Y279-Y283 CarbonylContact O-C 3.08Å; Y279-Y283 WeakPolarHBondContact O-CA 3.25Å; Y279-Y283 PolarHBondContact O-N 3.12Å
280D86.9Confident89.8Confident66 Ų6685.9 Ų85.935%0.35339%0.389SS..Hα-helixtrans-61.1-32.9167.259.8-38.1000112.6L274 K278 A287L274-D280 HydrophobicContact CD2-CB 3.71Å; K278-D280 VanDerWaalsContact CA-OD1 3.24Å; K278-D280 WeakPolarHBondContact CA-OD1 3.49Å; K278-D280 PolarHBondContact O-N 2.97Å; D280-A287 HydrophobicContact CB-CB 4.35Å
281I90.2Very high89.8Confident124 Ų12484.6 Ų84.664%0.63638%0.383SS*.Hα-helixtrans-86.8-44.1176.7-55.3176.5000110.6K278 Y279K278-I281 HydrophobicContact CB-CD1 4.36Å; K278-I281 HydrophobicContact CD-CD1 4.47Å; K278-I281 PolarHBondContact O-N 3.46Å; K278-I281 VanDerWaalsContact O-N 3.08Å; Y279-I281 PolarHBondContact O-N 3.36Å
282L93Very high90.1Very high108 Ų10881.3 Ų81.357%0.56537%0.371SS*.Hα-helixtrans-75.5-38.4-174.5-64.4169.4000113.2K278 Y279K278-L282 PolarHBondContact O-N 3.1Å; K278-L282 VanDerWaalsContact O-N 3.12Å; Y279-L282 HydrophobicContact CD1-CB 4.34Å; Y279-L282 HydrophobicContact CD1-CD1 4.08Å; Y279-L282 HydrophobicContact CE1-CD1 4.38Å
283Y92.7Very high90.5Very high145 Ų14582.9 Ų82.957%0.56938%0.376SS*.  trans-138.670.5-175.3-57.4-73.7000111Y279 E285 Y286 A287Y279-Y283 AromaticContact CD1-CD2 3.54Å; Y279-Y283 HydrophobicContact CD1-CD2 3.54Å; Y279-Y283 AromaticContact CD1-CE2 3.87Å; Y279-Y283 HydrophobicContact CD1-CE2 3.87Å; Y279-Y283 HydrophobicContact CE1-CD2 4.02Å; Y279-Y283 AromaticContact CE1-CE2 3.89Å; Y279-Y283 HydrophobicContact CE1-CE2 3.89Å; Y279-Y283 HydrophobicContact CG-CD2 4.42Å; Y279-Y283 CarbonylContact O-C 3.08Å; Y279-Y283 WeakPolarHBondContact O-CA 3.25Å; Y279-Y283 PolarHBondContact O-N 3.12Å; Y283-E285 VanDerWaalsContact C-N 3.28Å; Y283-E285 PolarHBondContact O-N 2.7Å; Y283-Y286 PolarHBondContact O-N 3.35Å; Y283-A287 PolarHBondContact O-N 3.29Å
284P92Very high90.8Very high74 Ų7478.8 Ų78.848%0.48136%0.357SS..Hα-helixtrans-60-34.1-172.922.9-34.3000113.7A287 K288P284-A287 PolarHBondContact O-N 3.35Å; P284-K288 WeakPolarHBondContact O-CB 3.29Å; P284-K288 PolarHBondContact O-N 3.17Å
285E91.5Very high91Very high126 Ų12682 Ų8259%0.58937%0.371SS*.Hα-helixtrans-66.6-46.8177.7-66.1-55.2136.200112.2Y283 A287 K288 Q289Y283-E285 VanDerWaalsContact C-N 3.28Å; Y283-E285 PolarHBondContact O-N 2.7Å; E285-A287 VanDerWaalsContact C-N 3.27Å; E285-A287 PolarHBondContact O-N 2.97Å; E285-K288 PolarHBondContact O-N 2.9Å; E285-Q289 WeakPolarHBondContact O-CG 3.48Å; E285-Q289 PolarHBondContact O-N 3.48Å
286Y92.2Very high91.6Very high100 Ų10077.4 Ų77.439%0.39236%0.355SS..Hα-helixtrans-60.3-42.5173.8175.2-106.5000110.6Y283 K288 Q289 I290Y283-Y286 PolarHBondContact O-N 3.35Å; Y286-K288 VanDerWaalsContact C-N 3.32Å; Y286-K288 PolarHBondContact O-N 3.26Å; Y286-Q289 WeakPolarHBondContact O-CB 3.38Å; Y286-Q289 PolarHBondContact O-N 3.36Å; Y286-I290 HydrophobicContact CD1-CG1 4.34Å; Y286-I290 HydrophobicContact CD2-CG1 4.35Å; Y286-I290 HydrophobicContact CE1-CG1 3.88Å; Y286-I290 HydrophobicContact CE2-CD1 3.93Å; Y286-I290 HydrophobicContact CE2-CG1 3.9Å; Y286-I290 WeakPolarHBondContact O-CG1 3.22Å; Y286-I290 PolarHBondContact O-N 3.22Å
287A91.5Very high92.1Very high8 Ų872.7 Ų72.77%0.06633%0.334CS..Hα-helixtrans-61.5-42.7178.400000112.7L274 D280 Y283 P284 E285 I290 V291L274-A287 HydrophobicContact CD1-CB 3.62Å; L274-A287 HydrophobicContact CD2-CB 3.77Å; L274-A287 HydrophobicContact CG-CB 3.85Å; D280-A287 HydrophobicContact CB-CB 4.35Å; Y283-A287 PolarHBondContact O-N 3.29Å; P284-A287 PolarHBondContact O-N 3.35Å; E285-A287 VanDerWaalsContact C-N 3.27Å; E285-A287 PolarHBondContact O-N 2.97Å; A287-I290 PolarHBondContact O-N 3.08Å; A287-V291 WeakPolarHBondContact O-CG2 3.21Å; A287-V291 PolarHBondContact O-N 2.94Å; A287-V291 VanDerWaalsContact O-N 3.1Å
288K91.4Very high92.3Very high68 Ų6867.9 Ų67.930%0.29632%0.319SS..Hα-helixtrans-60.5-46.3174.8-172.7176.8175.6-1780111T12 E15 P284 E285 Y286 I290 V291 Q292T12-K288 HydrophobicContact CG2-CD 4.19Å; E15-K288 WeakPolarHBondContact OE1-CE 3.39Å; E15-K288 IonicContact OE1-NZ 3.8Å; E15-K288 PolarHBondContact OE1-NZ 3.27Å; E15-K288 VanDerWaalsContact OE1-NZ 3.12Å; E15-K288 WeakPolarHBondContact OE2-CE 3.48Å; E15-K288 IonicContact OE2-NZ 3.89Å; E15-K288 PolarHBondContact OE2-NZ 3.29Å; P284-K288 WeakPolarHBondContact O-CB 3.29Å; P284-K288 PolarHBondContact O-N 3.17Å; E285-K288 PolarHBondContact O-N 2.9Å; Y286-K288 VanDerWaalsContact C-N 3.32Å; Y286-K288 PolarHBondContact O-N 3.26Å; K288-I290 PolarHBondContact O-N 2.98Å; K288-V291 PolarHBondContact O-N 3.26Å; K288-Q292 VanDerWaalsContact O-CG 3.3Å; K288-Q292 WeakPolarHBondContact O-CG 3.26Å; K288-Q292 PolarHBondContact O-N 2.89Å
289Q93.8Very high92.6Very high73 Ų7361.4 Ų61.434%0.34129%0.291SS..Hα-helixtrans-57.1-50.8177.6-71.4176-12.800112.1E14 E285 Y286 V291 Q292 Y293E14-Q289 HydrophobicContact CG-CB 4.42Å; E14-Q289 HydrophobicContact CG-CG 4.11Å; E14-Q289 PolarHBondContact OE1-NE2 2.87Å; E285-Q289 WeakPolarHBondContact O-CG 3.48Å; E285-Q289 PolarHBondContact O-N 3.48Å; Y286-Q289 WeakPolarHBondContact O-CB 3.38Å; Y286-Q289 PolarHBondContact O-N 3.36Å; Q289-V291 VanDerWaalsContact C-N 3.3Å; Q289-V291 PolarHBondContact O-N 2.88Å; Q289-Q292 PolarHBondContact O-N 3.42Å; Q289-Q292 VanDerWaalsContact O-N 3.11Å; Q289-Y293 HydrophobicContact CB-CD2 4.41Å; Q289-Y293 HydrophobicContact CB-CE2 4.3Å; Q289-Y293 WeakPolarHBondContact O-CD2 3.34Å; Q289-Y293 PolarHBondContact O-N 2.63Å
290I93.7Very high92.9Very high11 Ų1158.5 Ų58.56%0.05628%0.283CS..Hα-helixtrans-59.4-41.7179.8-66.6-59.9000111.5M267 L270 R271 L274 Y286 A287 K288 S294M267-I290 HydrophobicContact CE-CB 4.27Å; M267-I290 HydrophobicContact CE-CD1 3.68Å; M267-I290 HydrophobicContact CE-CG2 3.93Å; M267-I290 WeakPolarHBondContact CE-O 3.37Å; L270-I290 HydrophobicContact CB-CD1 4.46Å; L270-I290 HydrophobicContact CB-CG2 4.24Å; L270-I290 HydrophobicContact CD1-CD1 4.31Å; R271-I290 HydrophobicContact CB-CG2 3.88Å; L274-I290 HydrophobicContact CD1-CB 3.9Å; L274-I290 HydrophobicContact CD1-CG1 4.43Å; L274-I290 HydrophobicContact CD1-CG2 3.94Å; Y286-I290 HydrophobicContact CD1-CG1 4.34Å; Y286-I290 HydrophobicContact CD2-CG1 4.35Å; Y286-I290 HydrophobicContact CE1-CG1 3.88Å; Y286-I290 HydrophobicContact CE2-CD1 3.93Å; Y286-I290 HydrophobicContact CE2-CG1 3.9Å; Y286-I290 WeakPolarHBondContact O-CG1 3.22Å; Y286-I290 PolarHBondContact O-N 3.22Å; A287-I290 PolarHBondContact O-N 3.08Å; K288-I290 PolarHBondContact O-N 2.98Å; I290-S294 WeakPolarHBondContact O-CB 3.31Å; I290-S294 PolarHBondContact O-N 3.41Å
291V91.5Very high93.3Very high24 Ų2456.2 Ų56.215%0.14527%0.27CS..Hα-helixtrans-62.3-44.2175.8171.30000111.1A287 K288 Q289 S294 K295A287-V291 WeakPolarHBondContact O-CG2 3.21Å; A287-V291 PolarHBondContact O-N 2.94Å; A287-V291 VanDerWaalsContact O-N 3.1Å; K288-V291 PolarHBondContact O-N 3.26Å; Q289-V291 VanDerWaalsContact C-N 3.3Å; Q289-V291 PolarHBondContact O-N 2.88Å; V291-S294 PolarHBondContact O-N 3.33Å; V291-S294 PolarHBondContact O-OG 3.11Å; V291-K295 HydrophobicContact CG1-CD 4.5Å; V291-K295 WeakPolarHBondContact O-CG 3.39Å; V291-K295 PolarHBondContact O-N 3Å; V291-K295 VanDerWaalsContact O-N 3.12Å
292Q93.7Very high93.5Very high14 Ų1450.3 Ų50.37%0.06524%0.241CC..Hα-helixtrans-68.4-41.9-179.9-62.1-60.4-12.700112.3E14 E15 V18 K288 Q289 S294 K295 L296E14-Q292 HydrophobicContact CB-CB 3.73Å; E14-Q292 HydrophobicContact CB-CG 4.31Å; E15-Q292 HydrophobicContact CG-CG 3.79Å; E15-Q292 VanDerWaalsContact CG-NE2 3.32Å; E15-Q292 PolarHBondContact OE1-NE2 3.11Å; V18-Q292 HydrophobicContact CG2-CB 4.28Å; V18-Q292 WeakPolarHBondContact CG2-O 3.41Å; K288-Q292 VanDerWaalsContact O-CG 3.3Å; K288-Q292 WeakPolarHBondContact O-CG 3.26Å; K288-Q292 PolarHBondContact O-N 2.89Å; Q289-Q292 PolarHBondContact O-N 3.42Å; Q289-Q292 VanDerWaalsContact O-N 3.11Å; Q292-S294 VanDerWaalsContact C-N 3.33Å; Q292-S294 PolarHBondContact O-N 3.2Å; Q292-K295 WeakPolarHBondContact O-CB 3.41Å; Q292-K295 PolarHBondContact O-N 3.09Å; Q292-L296 PolarHBondContact O-N 2.72Å
293Y94.9Very high93.7Very high75 Ų7547.7 Ų47.729%0.29422%0.224SC..Hα-helixtrans-61.9-39.8172.9-74.6-53.2000112.1E14 M267 Q289 K295 L296 F297E14-Y293 HydrophobicContact CG-CE1 4.27Å; E14-Y293 HydrophobicContact CG-CE2 3.94Å; M267-Y293 HydrophobicContact CE-CD2 4.44Å; M267-Y293 HydrophobicContact CE-CG 4.33Å; Q289-Y293 HydrophobicContact CB-CD2 4.41Å; Q289-Y293 HydrophobicContact CB-CE2 4.3Å; Q289-Y293 WeakPolarHBondContact O-CD2 3.34Å; Q289-Y293 PolarHBondContact O-N 2.63Å; Y293-K295 VanDerWaalsContact C-N 3.28Å; Y293-K295 PolarHBondContact O-N 3.48Å; Y293-L296 HydrophobicContact CD1-CD2 4.38Å; Y293-L296 WeakPolarHBondContact O-CB 3.49Å; Y293-L296 PolarHBondContact O-N 2.96Å; Y293-L296 VanDerWaalsContact O-N 3.16Å; Y293-F297 VanDerWaalsContact O-CD2 3.24Å; Y293-F297 WeakPolarHBondContact O-CD2 3.35Å; Y293-F297 PolarHBondContact O-N 3.39Å
294S93Very high93.9Very high6 Ų641.1 Ų41.14%0.04220%0.199CC..Hα-helixtrans-60.5-38.117575.60000112.3R271 I290 V291 Q292 S298R271-S294 PolarHBondContact NH1-OG 3.36Å; I290-S294 WeakPolarHBondContact O-CB 3.31Å; I290-S294 PolarHBondContact O-N 3.41Å; V291-S294 PolarHBondContact O-N 3.33Å; V291-S294 PolarHBondContact O-OG 3.11Å; Q292-S294 VanDerWaalsContact C-N 3.33Å; Q292-S294 PolarHBondContact O-N 3.2Å; S294-S298 WeakPolarHBondContact O-CB 3.22Å; S294-S298 PolarHBondContact O-N 3.38Å; S294-S298 VanDerWaalsContact O-N 3.09Å
295K93.4Very high94.1Very high70 Ų7038 Ų3830%0.30418%0.178SC..Hα-helixtrans-67.7-41.9174.1-68.6171.4-179.1176.20111.7V18 V291 Q292 Y293 S298 S299V18-K295 HydrophobicContact CG1-CB 4.26Å; V18-K295 HydrophobicContact CG2-CB 4.37Å; V291-K295 HydrophobicContact CG1-CD 4.5Å; V291-K295 WeakPolarHBondContact O-CG 3.39Å; V291-K295 PolarHBondContact O-N 3Å; V291-K295 VanDerWaalsContact O-N 3.12Å; Q292-K295 WeakPolarHBondContact O-CB 3.41Å; Q292-K295 PolarHBondContact O-N 3.09Å; Y293-K295 VanDerWaalsContact C-N 3.28Å; Y293-K295 PolarHBondContact O-N 3.48Å; K295-S298 PolarHBondContact O-N 3.34Å; K295-S299 PolarHBondContact O-N 3.17Å; K295-S299 PolarHBondContact O-OG 3.26Å
296L95.8Very high94.3Very high18 Ų1832 Ų329%0.09415%0.15CC..Hα-helixtrans-60-52177.7-178.868.6000111.2M17 V18 F21 Q292 Y293 S298 S299 V300M17-L296 HydrophobicContact CG-CD1 4.1Å; M17-L296 HydrophobicContact CG-CD2 3.93Å; M17-L296 HydrophobicContact SD-CD2 3.29Å; M17-L296 WeakPolarHBondContact SD-CD2 3.4Å; V18-L296 HydrophobicContact CG2-CB 3.85Å; F21-L296 HydrophobicContact CB-CD1 3.99Å; F21-L296 HydrophobicContact CD2-CD1 4.37Å; F21-L296 HydrophobicContact CG-CD1 4.23Å; Q292-L296 PolarHBondContact O-N 2.72Å; Y293-L296 HydrophobicContact CD1-CD2 4.38Å; Y293-L296 WeakPolarHBondContact O-CB 3.49Å; Y293-L296 PolarHBondContact O-N 2.96Å; Y293-L296 VanDerWaalsContact O-N 3.16Å; L296-S298 VanDerWaalsContact C-N 3.26Å; L296-S298 PolarHBondContact O-N 2.96Å; L296-S299 WeakPolarHBondContact O-CB 3.5Å; L296-S299 PolarHBondContact O-N 3.25Å; L296-S299 VanDerWaalsContact O-N 3.08Å; L296-V300 HydrophobicContact CG-CG2 4.44Å; L296-V300 WeakPolarHBondContact O-CG2 3.31Å; L296-V300 PolarHBondContact O-N 3.32Å
297F95.3Very high94.5Very high59 Ų5930.6 Ų30.626%0.25915%0.146SC..Hα-helixtrans-66.6-30-179.4-75.3-68.9000112.5P263 L264 M267 Y293 V300 D301P263-F297 HydrophobicContact CB-CD1 3.51Å; P263-F297 HydrophobicContact CB-CD2 4.49Å; P263-F297 HydrophobicContact CB-CE1 3.43Å; P263-F297 VanDerWaalsContact CB-CE1 3.43Å; P263-F297 HydrophobicContact CB-CE2 4.41Å; P263-F297 HydrophobicContact CB-CG 4.06Å; P263-F297 HydrophobicContact CB-CZ 3.9Å; P263-F297 HydrophobicContact CG-CD1 4.45Å; P263-F297 HydrophobicContact CG-CE1 4.22Å; L264-F297 HydrophobicContact CB-CB 4.23Å; L264-F297 HydrophobicContact CD1-CB 4.12Å; M267-F297 HydrophobicContact CG-CD2 3.54Å; M267-F297 HydrophobicContact CG-CE2 3.86Å; M267-F297 HydrophobicContact SD-CE2 4.43Å; Y293-F297 VanDerWaalsContact O-CD2 3.24Å; Y293-F297 WeakPolarHBondContact O-CD2 3.35Å; Y293-F297 PolarHBondContact O-N 3.39Å; F297-V300 PolarHBondContact O-N 3.34Å; F297-D301 PolarHBondContact O-N 3.03Å
298S93.2Very high94.7Very high31 Ų3130.3 Ų30.322%0.21714%0.144CC..Hα-helixtrans-65.1-40.1170.4177.90000111.9S294 K295 L296 D301S294-S298 WeakPolarHBondContact O-CB 3.22Å; S294-S298 PolarHBondContact O-N 3.38Å; S294-S298 VanDerWaalsContact O-N 3.09Å; K295-S298 PolarHBondContact O-N 3.34Å; L296-S298 VanDerWaalsContact C-N 3.26Å; L296-S298 PolarHBondContact O-N 2.96Å; S298-D301 WeakPolarHBondContact O-CB 3.27Å; S298-D301 PolarHBondContact O-N 3.42Å
299S95.5Very high95Very high1 Ų128 Ų281%0.00713%0.134CC..Hα-helixtrans-67.5-38.1172-68.30000112.3F21 R22 D78 K295 L296 D301 S302F21-S299 WeakPolarHBondContact CE1-O 2.89Å; R22-S299 PolarHBondContact NE-OG 3.07Å; R22-S299 VanDerWaalsContact NE-OG 3.11Å; D78-S299 VanDerWaalsContact CG-OG 3.26Å; D78-S299 PolarHBondContact OD1-OG 3.49Å; D78-S299 VanDerWaalsContact OD2-CB 3.28Å; D78-S299 WeakPolarHBondContact OD2-CB 3.35Å; D78-S299 PolarHBondContact OD2-OG 3.23Å; K295-S299 PolarHBondContact O-N 3.17Å; K295-S299 PolarHBondContact O-OG 3.26Å; L296-S299 WeakPolarHBondContact O-CB 3.5Å; L296-S299 PolarHBondContact O-N 3.25Å; L296-S299 VanDerWaalsContact O-N 3.08Å; S299-D301 VanDerWaalsContact C-N 3.26Å; S299-D301 PolarHBondContact O-N 2.98Å; S299-S302 WeakPolarHBondContact O-CB 3.44Å; S299-S302 PolarHBondContact O-N 3.38Å; S299-S302 VanDerWaalsContact O-N 3.12Å; S299-S302 PolarHBondContact O-OG 3.35Å
300V96.3Very high95.1Very high28 Ų2828.7 Ų28.717%0.1714%0.136CC..Hα-helixtrans-63.9-31.2175.5170.10000111.6F21 L260 L296 F297 S302 F303F21-V300 HydrophobicContact CD2-CG2 4.35Å; F21-V300 HydrophobicContact CE2-CG2 3.76Å; F21-V300 HydrophobicContact CZ-CG2 3.97Å; L260-V300 HydrophobicContact CD2-CG1 3.96Å; L296-V300 HydrophobicContact CG-CG2 4.44Å; L296-V300 WeakPolarHBondContact O-CG2 3.31Å; L296-V300 PolarHBondContact O-N 3.32Å; F297-V300 PolarHBondContact O-N 3.34Å; V300-S302 PolarHBondContact O-N 2.96Å; V300-F303 HydrophobicContact CG1-CD2 4.2Å; V300-F303 WeakPolarHBondContact O-CB 3.32Å; V300-F303 VanDerWaalsContact O-CD2 3.24Å; V300-F303 WeakPolarHBondContact O-CD2 3.45Å; V300-F303 PolarHBondContact O-N 3.08Å
301D94.2Very high95.3Very high17 Ų1729.6 Ų29.69%0.09114%0.14CC..THydrogen-bonded Turntrans-59-21.2174.6-165.148000112.7L264 F297 S298 S299 F303 N304 H305L264-D301 HydrophobicContact CD2-CB 4.28Å; F297-D301 PolarHBondContact O-N 3.03Å; S298-D301 WeakPolarHBondContact O-CB 3.27Å; S298-D301 PolarHBondContact O-N 3.42Å; S299-D301 VanDerWaalsContact C-N 3.26Å; S299-D301 PolarHBondContact O-N 2.98Å; D301-F303 PolarHBondContact O-N 3.42Å; D301-N304 VanDerWaalsContact O-CB 3.29Å; D301-N304 WeakPolarHBondContact O-CB 3.37Å; D301-N304 PolarHBondContact O-N 3.08Å; D301-N304 PolarHBondContact OD1-ND2 3.42Å; D301-H305 IonicContact OD2-NE2 2.77Å
302S95.9Very high95.5Very high1 Ų128.5 Ų28.51%0.00713%0.134CC..Hα-helixtrans-56.7-21.8172.8-57.10000113.7T74 S299 V300 N304 H305 A306T74-S302 WeakPolarHBondContact OG1-CB 3.43Å; T74-S302 PolarHBondContact OG1-OG 3.04Å; S299-S302 WeakPolarHBondContact O-CB 3.44Å; S299-S302 PolarHBondContact O-N 3.38Å; S299-S302 VanDerWaalsContact O-N 3.12Å; S299-S302 PolarHBondContact O-OG 3.35Å; V300-S302 PolarHBondContact O-N 2.96Å; S302-N304 VanDerWaalsContact C-N 3.31Å; S302-N304 PolarHBondContact O-N 2.81Å; S302-H305 PolarHBondContact O-N 3.35Å; S302-A306 PolarHBondContact O-N 2.94Å
303F97.2Very high95.7Very high52 Ų5230.5 Ų30.523%0.22815%0.145CC..Hα-helixtrans-63-35.5172-80-74.9000112.5F21 V25 L29 L260 V300 D301 H305 A306 F307F21-F303 AromaticContact CE2-CE2 3.96Å; F21-F303 HydrophobicContact CE2-CE2 3.96Å; F21-F303 HydrophobicContact CZ-CD2 4.38Å; F21-F303 AromaticContact CZ-CE2 3.79Å; F21-F303 HydrophobicContact CZ-CE2 3.79Å; V25-F303 HydrophobicContact CG1-CE2 4.34Å; V25-F303 HydrophobicContact CG1-CZ 4.02Å; L29-F303 HydrophobicContact CD1-CD1 4.37Å; L29-F303 HydrophobicContact CD1-CD2 4.31Å; L29-F303 HydrophobicContact CD1-CE1 4.42Å; L29-F303 HydrophobicContact CD1-CE2 4.3Å; L29-F303 HydrophobicContact CD1-CG 4.35Å; L29-F303 HydrophobicContact CD1-CZ 4.36Å; L29-F303 HydrophobicContact CD2-CD1 3.62Å; L29-F303 HydrophobicContact CD2-CE1 3.59Å; L29-F303 HydrophobicContact CD2-CG 4.34Å; L29-F303 HydrophobicContact CD2-CZ 4.23Å; L29-F303 HydrophobicContact CG-CE1 4.5Å; L260-F303 HydrophobicContact CD1-CB 3.63Å; V300-F303 HydrophobicContact CG1-CD2 4.2Å; V300-F303 WeakPolarHBondContact O-CB 3.32Å; V300-F303 VanDerWaalsContact O-CD2 3.24Å; V300-F303 WeakPolarHBondContact O-CD2 3.45Å; V300-F303 PolarHBondContact O-N 3.08Å; D301-F303 PolarHBondContact O-N 3.42Å; F303-H305 PolarHBondContact O-N 3.01Å; F303-A306 PolarHBondContact O-N 3.06Å; F303-F307 HydrophobicContact CB-CD2 4.31Å; F303-F307 HydrophobicContact CB-CE2 4.31Å; F303-F307 HydrophobicContact CD1-CD2 4.04Å; F303-F307 HydrophobicContact CD1-CE1 4.28Å; F303-F307 AromaticContact CD1-CE2 3.29Å; F303-F307 HydrophobicContact CD1-CE2 3.29Å; F303-F307 AromaticContact CD1-CZ 3.45Å; F303-F307 HydrophobicContact CD1-CZ 3.45Å; F303-F307 VanDerWaalsContact CD1-CZ 3.45Å; F303-F307 AromaticContact CE1-CE2 3.94Å; F303-F307 HydrophobicContact CE1-CE2 3.94Å; F303-F307 AromaticContact CE1-CZ 3.73Å; F303-F307 HydrophobicContact CE1-CZ 3.73Å; F303-F307 HydrophobicContact CG-CE2 4.2Å; F303-F307 WeakPolarHBondContact O-CB 3.19Å; F303-F307 PolarHBondContact O-N 3.46Å
304N95.6Very high95.7Very high7 Ų729.6 Ų29.64%0.03715%0.153CC..Hα-helixtrans-58.6-40.7173.9-82.2-39.4000111L256 F257 L260 D301 S302L256-N304 VanDerWaalsContact C-OD1 3.22Å; L256-N304 WeakPolarHBondContact CG-OD1 3.2Å; L256-N304 PolarHBondContact O-OD1 3.48Å; F257-N304 VanDerWaalsContact CA-OD1 3.23Å; F257-N304 WeakPolarHBondContact CA-OD1 3.49Å; F257-N304 PolarHBondContact N-OD1 2.97Å; L260-N304 WeakPolarHBondContact CB-ND2 3.09Å; L260-N304 HydrophobicContact CD1-CB 4.48Å; D301-N304 VanDerWaalsContact O-CB 3.29Å; D301-N304 WeakPolarHBondContact O-CB 3.37Å; D301-N304 PolarHBondContact O-N 3.08Å; D301-N304 PolarHBondContact OD1-ND2 3.42Å; S302-N304 VanDerWaalsContact C-N 3.31Å; S302-N304 PolarHBondContact O-N 2.81Å
305H95.7Very high95.8Very high10 Ų1033.1 Ų33.15%0.04617%0.167CC..Hα-helixtrans-77.5-23.3-177.2-51.4-38.1000113.2N37 H66 L70 D301 S302 F303N37-H305 PolarHBondContact ND2-O 3.08Å; H66-H305 HydrophobicContact CB-CB 3.98Å; H66-H305 AromaticContact CD2-CE1 3.96Å; H66-H305 AromaticContact CD2-CG 3.94Å; H66-H305 AromaticContact CD2-ND1 3.1Å; H66-H305 PolarHBondContact CD2-ND1 3.16Å; H66-H305 AromaticContact CG-ND1 3.79Å; H66-H305 AromaticContact NE2-ND1 3.39Å; H66-H305 PolarHBondContact NE2-ND1 3.27Å; L70-H305 HydrophobicContact CD1-CB 4.38Å; L70-H305 HydrophobicContact CD2-CB 4.07Å; L70-H305 HydrophobicContact CG-CB 3.9Å; D301-H305 IonicContact OD2-NE2 2.77Å; S302-H305 PolarHBondContact O-N 3.35Å; F303-H305 PolarHBondContact O-N 3.01Å
306A97.1Very high95.8Very high0 Ų029.8 Ų29.80%015%0.153CC..Hα-helixtrans-91.9-23.3-176.500000114.1L29 L70 S302 F303L29-A306 HydrophobicContact CD2-CB 4.11Å; L70-A306 HydrophobicContact CD2-CB 4.46Å; S302-A306 PolarHBondContact O-N 2.94Å; F303-A306 PolarHBondContact O-N 3.06Å
307F96.3Very high95.6Very high69 Ų6930.8 Ų30.830%0.30316%0.16SC..Hα-helixtrans-98.1-5.9-165-75.6-19.4000117.3L256 F303 F309 F310 L311L256-F307 HydrophobicContact CD2-CB 3.85Å; L256-F307 HydrophobicContact CD2-CD2 4.21Å; F303-F307 HydrophobicContact CB-CD2 4.31Å; F303-F307 HydrophobicContact CB-CE2 4.31Å; F303-F307 HydrophobicContact CD1-CD2 4.04Å; F303-F307 HydrophobicContact CD1-CE1 4.28Å; F303-F307 AromaticContact CD1-CE2 3.29Å; F303-F307 HydrophobicContact CD1-CE2 3.29Å; F303-F307 AromaticContact CD1-CZ 3.45Å; F303-F307 HydrophobicContact CD1-CZ 3.45Å; F303-F307 VanDerWaalsContact CD1-CZ 3.45Å; F303-F307 AromaticContact CE1-CE2 3.94Å; F303-F307 HydrophobicContact CE1-CE2 3.94Å; F303-F307 AromaticContact CE1-CZ 3.73Å; F303-F307 HydrophobicContact CE1-CZ 3.73Å; F303-F307 HydrophobicContact CG-CE2 4.2Å; F303-F307 WeakPolarHBondContact O-CB 3.19Å; F303-F307 PolarHBondContact O-N 3.46Å; F307-F309 VanDerWaalsContact C-N 3.29Å; F307-F309 PolarHBondContact O-N 3.46Å; F307-F310 AromaticContact CD1-CD2 3.73Å; F307-F310 HydrophobicContact CD1-CD2 3.73Å; F307-F310 HydrophobicContact CD1-CE2 4.03Å; F307-F310 HydrophobicContact CE1-CD2 4.38Å; F307-F310 HydrophobicContact CE1-CE2 4.4Å; F307-F310 PolarHBondContact O-N 3.04Å; F307-L311 WeakPolarHBondContact O-CG 3.14Å; F307-L311 PolarHBondContact O-N 3.36Å; F307-L311 VanDerWaalsContact O-N 3.13Å
308D95.1Very high95.5Very high3 Ų329.3 Ų29.32%0.01616%0.156CC..Hα-helixtrans-51.6-45.4178.7-78.6-7.8000113.3H66 F310 L311 Y312H66-D308 IonicContact CE1-OD2 2.69Å; H66-D308 PolarHBondContact CE1-OD2 3.14Å; H66-D308 IonicContact ND1-OD2 3.05Å; H66-D308 PolarHBondContact ND1-OD2 3.07Å; D308-F310 VanDerWaalsContact C-N 3.31Å; D308-F310 PolarHBondContact O-N 3.09Å; D308-L311 PolarHBondContact O-N 3.02Å; D308-L311 VanDerWaalsContact O-N 3.16Å; D308-Y312 HydrophobicContact CB-CD2 4.29Å; D308-Y312 HydrophobicContact CB-CE2 3.86Å; D308-Y312 WeakPolarHBondContact O-CD2 3.1Å; D308-Y312 PolarHBondContact O-N 3.38Å
309F96.9Very high95.5Very high20 Ų2027.9 Ų27.99%0.08815%0.146CC..Hα-helixtrans-55.2-45.8178173.2-95.5000112.5L39 V40 F307 L311 Y312 L313 F319 L323L39-F309 HydrophobicContact CB-CD2 4.28Å; L39-F309 HydrophobicContact CB-CE2 4.14Å; L39-F309 HydrophobicContact CD1-CE2 4.27Å; V40-F309 HydrophobicContact CG2-CB 3.71Å; V40-F309 HydrophobicContact CG2-CD2 3.92Å; V40-F309 HydrophobicContact CG2-CG 4.33Å; F307-F309 VanDerWaalsContact C-N 3.29Å; F307-F309 PolarHBondContact O-N 3.46Å; F309-L311 VanDerWaalsContact C-N 3.33Å; F309-Y312 PolarHBondContact O-N 3.07Å; F309-L313 HydrophobicContact CE1-CD2 4.17Å; F309-L313 VanDerWaalsContact O-CB 3.27Å; F309-L313 WeakPolarHBondContact O-CB 3.36Å; F309-L313 PolarHBondContact O-N 3.01Å; F309-F319 AromaticContact CD2-CE1 4Å; F309-F319 HydrophobicContact CD2-CE1 4Å; F309-F319 AromaticContact CD2-CZ 3.78Å; F309-F319 HydrophobicContact CD2-CZ 3.78Å; F309-F319 AromaticContact CE2-CE1 3.82Å; F309-F319 HydrophobicContact CE2-CE1 3.82Å; F309-F319 AromaticContact CE2-CZ 3.9Å; F309-F319 HydrophobicContact CE2-CZ 3.9Å; F309-L323 HydrophobicContact CE2-CD2 4.11Å; F309-L323 HydrophobicContact CZ-CD2 3.92Å
310F97.2Very high95.5Very high87 Ų8732.7 Ų32.738%0.38216%0.164SC..Hα-helixtrans-68.8-35.9-178.6-60.5-74.7000111.2I32 F307 D308 L313 A314I32-F310 HydrophobicContact CG2-CE2 3.59Å; I32-F310 HydrophobicContact CG2-CZ 3.58Å; F307-F310 AromaticContact CD1-CD2 3.73Å; F307-F310 HydrophobicContact CD1-CD2 3.73Å; F307-F310 HydrophobicContact CD1-CE2 4.03Å; F307-F310 HydrophobicContact CE1-CD2 4.38Å; F307-F310 HydrophobicContact CE1-CE2 4.4Å; F307-F310 PolarHBondContact O-N 3.04Å; D308-F310 VanDerWaalsContact C-N 3.31Å; D308-F310 PolarHBondContact O-N 3.09Å; F310-L313 PolarHBondContact O-N 2.96Å; F310-A314 VanDerWaalsContact O-CB 3.25Å; F310-A314 WeakPolarHBondContact O-CB 3.37Å; F310-A314 PolarHBondContact O-N 3.38Å
311L97Very high95.4Very high29 Ų2937 Ų3715%0.15218%0.183CC..Hα-helixtrans-65.7-45174.8-62.7178000111.4A252 I253 L256 F307 D308 F309 A314 F315A252-L311 HydrophobicContact CB-CD2 4.08Å; I253-L311 HydrophobicContact CB-CD1 4.27Å; I253-L311 HydrophobicContact CG1-CB 4.26Å; I253-L311 HydrophobicContact CG1-CD1 3.56Å; L256-L311 HydrophobicContact CD2-CD1 4.02Å; F307-L311 WeakPolarHBondContact O-CG 3.14Å; F307-L311 PolarHBondContact O-N 3.36Å; F307-L311 VanDerWaalsContact O-N 3.13Å; D308-L311 PolarHBondContact O-N 3.02Å; D308-L311 VanDerWaalsContact O-N 3.16Å; F309-L311 VanDerWaalsContact C-N 3.33Å; L311-A314 PolarHBondContact O-N 2.82Å; L311-F315 HydrophobicContact CD2-CE2 4.02Å; L311-F315 VanDerWaalsContact O-CD2 3.27Å; L311-F315 WeakPolarHBondContact O-CD2 2.91Å; L311-F315 PolarHBondContact O-N 3.4Å
312Y96.5Very high95.3Very high1 Ų136.5 Ų36.50%0.00418%0.18CC..Hα-helixtrans-63.3-43174.4-65.2-52.2000111.8V40 F44 F55 A249 I253 D308 F309 A314 M316V40-Y312 HydrophobicContact CG1-CD2 4.03Å; V40-Y312 HydrophobicContact CG1-CE2 3.84Å; V40-Y312 HydrophobicContact CG2-CD2 3.96Å; V40-Y312 HydrophobicContact CG2-CE2 4.42Å; F44-Y312 HydrophobicContact CE2-CD1 4.21Å; F44-Y312 AromaticContact CE2-CD2 3.86Å; F44-Y312 HydrophobicContact CE2-CD2 3.86Å; F44-Y312 HydrophobicContact CE2-CE1 4.22Å; F44-Y312 AromaticContact CE2-CE2 3.88Å; F44-Y312 HydrophobicContact CE2-CE2 3.88Å; F44-Y312 HydrophobicContact CE2-CG 4.05Å; F44-Y312 AromaticContact CZ-CD1 3.95Å; F44-Y312 HydrophobicContact CZ-CD1 3.95Å; F44-Y312 HydrophobicContact CZ-CD2 4.4Å; F44-Y312 HydrophobicContact CZ-CE1 4.09Å; F44-Y312 HydrophobicContact CZ-CG 4.14Å; F55-Y312 HydrophobicContact CE1-CE1 4.33Å; F55-Y312 HydrophobicContact CZ-CE1 4.09Å; A249-Y312 HydrophobicContact CB-CD1 4.31Å; I253-Y312 HydrophobicContact CD1-CD1 4.47Å; I253-Y312 HydrophobicContact CD1-CE1 3.63Å; I253-Y312 HydrophobicContact CD1-CE2 4.45Å; I253-Y312 WeakPolarHBondContact CD1-OH 3.33Å; D308-Y312 HydrophobicContact CB-CD2 4.29Å; D308-Y312 HydrophobicContact CB-CE2 3.86Å; D308-Y312 WeakPolarHBondContact O-CD2 3.1Å; D308-Y312 PolarHBondContact O-N 3.38Å; F309-Y312 PolarHBondContact O-N 3.07Å; Y312-A314 VanDerWaalsContact C-N 3.34Å; Y312-A314 PolarHBondContact O-N 2.98Å; Y312-M316 WeakPolarHBondContact O-CA 3.46Å; Y312-M316 VanDerWaalsContact O-CB 3.24Å; Y312-M316 WeakPolarHBondContact O-CB 3.32Å; Y312-M316 PolarHBondContact O-N 2.97Å
313L96.9Very high95.3Very high57 Ų5737 Ų3730%0.29818%0.182SC..Hα-helixtrans-60.7-42.3176.5-17374.9000111.9F309 F310 F319 R320 L323F309-L313 HydrophobicContact CE1-CD2 4.17Å; F309-L313 VanDerWaalsContact O-CB 3.27Å; F309-L313 WeakPolarHBondContact O-CB 3.36Å; F309-L313 PolarHBondContact O-N 3.01Å; F310-L313 PolarHBondContact O-N 2.96Å; L313-F319 HydrophobicContact CB-CE1 4.46Å; L313-R320 HydrophobicContact CD1-CG 3.93Å; L313-R320 WeakPolarHBondContact O-CD 3.39Å; L313-R320 WeakPolarHBondContact O-CG 3.06Å; L313-R320 PolarHBondContact O-NH1 2.88Å; L313-L323 HydrophobicContact CD1-CD2 3.73Å
314A96.4Very high95.1Very high56 Ų5639.7 Ų39.746%0.46320%0.197SC..Hα-helixtrans-70.1-46.5-179.100000112.4F310 L311 Y312 R320F310-A314 VanDerWaalsContact O-CB 3.25Å; F310-A314 WeakPolarHBondContact O-CB 3.37Å; F310-A314 PolarHBondContact O-N 3.38Å; L311-A314 PolarHBondContact O-N 2.82Å; Y312-A314 VanDerWaalsContact C-N 3.34Å; Y312-A314 PolarHBondContact O-N 2.98Å; A314-R320 PolarHBondContact O-NH1 3.43Å
315F94.5Very high94.9Very high80 Ų8040.8 Ų40.835%0.35120%0.203SC..Hα-helixtrans-105.1-14.8-166.1-60.6-61.5000115.2G245 I248 A249 A252 L311 P317G245-F315 CarbonylContact C-O 3.37Å; G245-F315 WeakPolarHBondContact CA-O 3.44Å; I248-F315 HydrophobicContact CB-CB 4.47Å; I248-F315 HydrophobicContact CG2-CB 4.04Å; I248-F315 HydrophobicContact CG2-CD1 3.39Å; I248-F315 HydrophobicContact CG2-CD2 4.49Å; I248-F315 HydrophobicContact CG2-CE1 3.91Å; I248-F315 HydrophobicContact CG2-CG 3.72Å; A249-F315 HydrophobicContact CB-CB 3.94Å; A252-F315 HydrophobicContact CB-CD2 3.81Å; A252-F315 HydrophobicContact CB-CE2 3.5Å; A252-F315 HydrophobicContact CB-CZ 4.33Å; L311-F315 HydrophobicContact CD2-CE2 4.02Å; L311-F315 VanDerWaalsContact O-CD2 3.27Å; L311-F315 WeakPolarHBondContact O-CD2 2.91Å; L311-F315 PolarHBondContact O-N 3.4Å; F315-P317 WeakPolarHBondContact O-CD 3.11Å
316M93.8Very high94.7Very high0 Ų042.2 Ų42.20%021%0.21CC..  trans-112.7103-174.6-165.6173.4171.300112.3F44 F55 K246 Y312 T318 F319 R320F44-M316 HydrophobicContact CE1-CE 3.91Å; F44-M316 HydrophobicContact CE1-SD 3.92Å; F44-M316 HydrophobicContact CZ-CE 4.5Å; F44-M316 HydrophobicContact CZ-SD 3.91Å; F55-M316 HydrophobicContact CD1-CE 4.35Å; F55-M316 HydrophobicContact CE1-CE 3.98Å; F55-M316 HydrophobicContact CE1-SD 3.67Å; F55-M316 HydrophobicContact CZ-SD 3.97Å; K246-M316 HydrophobicContact CD-CE 4.45Å; K246-M316 HydrophobicContact CG-CE 3.95Å; K246-M316 HydrophobicContact CG-SD 4.29Å; Y312-M316 WeakPolarHBondContact O-CA 3.46Å; Y312-M316 VanDerWaalsContact O-CB 3.24Å; Y312-M316 WeakPolarHBondContact O-CB 3.32Å; Y312-M316 PolarHBondContact O-N 2.97Å; M316-T318 VanDerWaalsContact C-N 3.35Å; M316-T318 PolarHBondContact O-N 3.15Å; M316-F319 HydrophobicContact CB-CB 3.82Å; M316-F319 HydrophobicContact CG-CB 3.93Å; M316-F319 WeakPolarHBondContact O-CB 3.25Å; M316-F319 PolarHBondContact O-N 3.07Å; M316-F319 HydrophobicContact SD-CB 4.12Å; M316-R320 PolarHBondContact O-N 2.85Å
317P92Very high94.3Very high38 Ų3849 Ų4925%0.24724%0.24CC..Hα-helixtrans-59.7-40.5-179.6-2534.5000113.6F315 F319 R320 Q321F315-P317 WeakPolarHBondContact O-CD 3.11Å; P317-F319 VanDerWaalsContact C-N 3.31Å; P317-F319 PolarHBondContact O-N 3.46Å; P317-R320 WeakPolarHBondContact O-CB 3.34Å; P317-R320 PolarHBondContact O-N 3.37Å; P317-Q321 WeakPolarHBondContact O-CG 3.44Å; P317-Q321 PolarHBondContact O-N 2.84Å
318T91.8Very high94.1Very high29 Ų2951.9 Ų51.918%0.17825%0.252CS..Hα-helixtrans-62.7-38.9177.5-61.40000111.8I47 N242 M316 R320 Q321 T322I47-T318 HydrophobicContact CD1-CG2 4.14Å; I47-T318 HydrophobicContact CG1-CG2 4.44Å; I47-T318 HydrophobicContact CG2-CG2 4.48Å; N242-T318 PolarHBondContact ND2-OG1 3.09Å; N242-T318 PolarHBondContact OD1-OG1 3.44Å; M316-T318 VanDerWaalsContact C-N 3.35Å; M316-T318 PolarHBondContact O-N 3.15Å; T318-R320 PolarHBondContact O-N 2.78Å; T318-Q321 PolarHBondContact O-N 2.7Å; T318-T322 PolarHBondContact O-N 3.01Å; T318-T322 PolarHBondContact O-OG1 3.04Å; T318-T322 VanDerWaalsContact O-OG1 3.1Å
319F94.5Very high93.4Very high0 Ų056.3 Ų56.30%028%0.283CS..Hα-helixtrans-59.8-46175.2-173.9-89.1000111.2V40 V43 F44 F309 L313 M316 P317 Q321 T322 L323V40-F319 HydrophobicContact CG2-CE2 4.34Å; V40-F319 HydrophobicContact CG2-CZ 4.12Å; V43-F319 HydrophobicContact CB-CD2 4.13Å; V43-F319 HydrophobicContact CB-CE2 3.66Å; V43-F319 HydrophobicContact CB-CZ 4.2Å; V43-F319 HydrophobicContact CG1-CD2 3.39Å; V43-F319 HydrophobicContact CG1-CE2 3.47Å; V43-F319 VanDerWaalsContact CG1-CE2 3.47Å; V43-F319 HydrophobicContact CG1-CG 4.07Å; V43-F319 HydrophobicContact CG1-CZ 4.21Å; V43-F319 HydrophobicContact CG2-CE2 4.14Å; V43-F319 HydrophobicContact CG2-CZ 4.18Å; F44-F319 HydrophobicContact CD2-CE2 4.3Å; F44-F319 HydrophobicContact CE1-CD2 4.38Å; F44-F319 AromaticContact CE2-CD2 3.89Å; F44-F319 HydrophobicContact CE2-CD2 3.89Å; F44-F319 AromaticContact CE2-CE2 3.88Å; F44-F319 HydrophobicContact CE2-CE2 3.88Å; F44-F319 AromaticContact CZ-CD2 3.81Å; F44-F319 HydrophobicContact CZ-CD2 3.81Å; F44-F319 HydrophobicContact CZ-CE2 4.29Å; F309-F319 AromaticContact CD2-CE1 4Å; F309-F319 HydrophobicContact CD2-CE1 4Å; F309-F319 AromaticContact CD2-CZ 3.78Å; F309-F319 HydrophobicContact CD2-CZ 3.78Å; F309-F319 AromaticContact CE2-CE1 3.82Å; F309-F319 HydrophobicContact CE2-CE1 3.82Å; F309-F319 AromaticContact CE2-CZ 3.9Å; F309-F319 HydrophobicContact CE2-CZ 3.9Å; L313-F319 HydrophobicContact CB-CE1 4.46Å; M316-F319 HydrophobicContact CB-CB 3.82Å; M316-F319 HydrophobicContact CG-CB 3.93Å; M316-F319 WeakPolarHBondContact O-CB 3.25Å; M316-F319 PolarHBondContact O-N 3.07Å; M316-F319 HydrophobicContact SD-CB 4.12Å; P317-F319 VanDerWaalsContact C-N 3.31Å; P317-F319 PolarHBondContact O-N 3.46Å; F319-Q321 PolarHBondContact O-N 3.05Å; F319-T322 PolarHBondContact O-N 2.85Å; F319-L323 HydrophobicContact CE1-CD2 4.39Å; F319-L323 VanDerWaalsContact O-CB 3.28Å; F319-L323 WeakPolarHBondContact O-CB 3.06Å; F319-L323 PolarHBondContact O-N 2.77Å
320R95.1Very high92.2Very high102 Ų10262.1 Ų62.139%0.38530%0.304SS..Hα-helixtrans-60.7-45.2175.3-68.6-164.7-69.5-98.66112.7L313 A314 M316 P317 T318 L323 M324L313-R320 HydrophobicContact CD1-CG 3.93Å; L313-R320 WeakPolarHBondContact O-CD 3.39Å; L313-R320 WeakPolarHBondContact O-CG 3.06Å; L313-R320 PolarHBondContact O-NH1 2.88Å; A314-R320 PolarHBondContact O-NH1 3.43Å; M316-R320 PolarHBondContact O-N 2.85Å; P317-R320 WeakPolarHBondContact O-CB 3.34Å; P317-R320 PolarHBondContact O-N 3.37Å; T318-R320 PolarHBondContact O-N 2.78Å; R320-L323 PolarHBondContact O-N 2.8Å; R320-M324 WeakPolarHBondContact O-CB 3.44Å; R320-M324 VanDerWaalsContact O-CG 3.22Å; R320-M324 WeakPolarHBondContact O-CG 3.37Å; R320-M324 PolarHBondContact O-N 3.25Å
321Q92.6Very high90.6Very high120 Ų12059 Ų5956%0.56129%0.291SS*.Hα-helixtrans-61.9-48.6-179.9-72.7172.7-1.200110.9P317 T318 F319 L323 M324 D325P317-Q321 WeakPolarHBondContact O-CG 3.44Å; P317-Q321 PolarHBondContact O-N 2.84Å; T318-Q321 PolarHBondContact O-N 2.7Å; F319-Q321 PolarHBondContact O-N 3.05Å; Q321-L323 PolarHBondContact O-N 3.4Å; Q321-M324 PolarHBondContact O-N 3.37Å; Q321-D325 PolarHBondContact O-N 3.18Å
322T93.3Very high88.9Confident5 Ų566.1 Ų66.13%0.03132%0.321CS..Hα-helixtrans-62.6-43.2177.3-56.50000111.5V43 I46 I47 T318 F319 M324 D325 I326V43-T322 HydrophobicContact CG1-CG2 3.99Å; I46-T322 HydrophobicContact CB-CG2 4.14Å; I46-T322 HydrophobicContact CG2-CG2 3.73Å; I47-T322 HydrophobicContact CG1-CG2 3.99Å; I47-T322 WeakPolarHBondContact CG1-OG1 3.17Å; T318-T322 PolarHBondContact O-N 3.01Å; T318-T322 PolarHBondContact O-OG1 3.04Å; T318-T322 VanDerWaalsContact O-OG1 3.1Å; F319-T322 PolarHBondContact O-N 2.85Å; T322-M324 VanDerWaalsContact C-N 3.34Å; T322-M324 PolarHBondContact O-N 3.49Å; T322-D325 WeakPolarHBondContact O-CB 3.39Å; T322-D325 PolarHBondContact O-N 3.29Å; T322-D325 VanDerWaalsContact O-N 3.14Å; T322-I326 WeakPolarHBondContact O-CG1 3.46Å; T322-I326 PolarHBondContact O-N 3.12Å
323L94.6Very high87.2Confident11 Ų1172 Ų726%0.05835%0.352CS..Hα-helixtrans-60.4-43.1176.7-175.166.1000111.8V43 F309 L313 F319 R320 Q321 D325 I326 F327V43-L323 HydrophobicContact CG2-CB 4.42Å; V43-L323 HydrophobicContact CG2-CD1 3.97Å; F309-L323 HydrophobicContact CE2-CD2 4.11Å; F309-L323 HydrophobicContact CZ-CD2 3.92Å; L313-L323 HydrophobicContact CD1-CD2 3.73Å; F319-L323 HydrophobicContact CE1-CD2 4.39Å; F319-L323 VanDerWaalsContact O-CB 3.28Å; F319-L323 WeakPolarHBondContact O-CB 3.06Å; F319-L323 PolarHBondContact O-N 2.77Å; R320-L323 PolarHBondContact O-N 2.8Å; Q321-L323 PolarHBondContact O-N 3.4Å; L323-D325 VanDerWaalsContact C-N 3.32Å; L323-D325 PolarHBondContact O-N 2.98Å; L323-I326 HydrophobicContact CD1-CD1 4.44Å; L323-I326 WeakPolarHBondContact O-CB 3.48Å; L323-I326 PolarHBondContact O-N 2.72Å; L323-F327 HydrophobicContact CD1-CD2 4.15Å; L323-F327 HydrophobicContact CD1-CE2 3.62Å; L323-F327 HydrophobicContact CD1-CZ 4.47Å; L323-F327 HydrophobicContact CD2-CE2 4.2Å; L323-F327 HydrophobicContact CG-CD2 3.94Å; L323-F327 HydrophobicContact CG-CE2 3.67Å; L323-F327 VanDerWaalsContact O-CD2 3.23Å; L323-F327 WeakPolarHBondContact O-CD2 3.33Å; L323-F327 PolarHBondContact O-N 2.85Å
324M93.8Very high85.5Confident109 Ų10974.9 Ų74.954%0.53736%0.359SS..Hα-helixtrans-65-35.3174.9-71.4-68.9175.800112.3R320 Q321 T322 I326 F327 K328R320-M324 WeakPolarHBondContact O-CB 3.44Å; R320-M324 VanDerWaalsContact O-CG 3.22Å; R320-M324 WeakPolarHBondContact O-CG 3.37Å; R320-M324 PolarHBondContact O-N 3.25Å; Q321-M324 PolarHBondContact O-N 3.37Å; T322-M324 VanDerWaalsContact C-N 3.34Å; T322-M324 PolarHBondContact O-N 3.49Å; M324-I326 VanDerWaalsContact C-N 3.35Å; M324-F327 PolarHBondContact O-N 3.5Å; M324-K328 WeakPolarHBondContact O-CB 3.22Å; M324-K328 WeakPolarHBondContact O-CG 3.43Å; M324-K328 PolarHBondContact O-N 3.43Å
325D91.5Very high83.9Confident30 Ų3074.2 Ų74.216%0.1635%0.348CS..Hα-helixtrans-66.4-35.8173.9-74.6-16.3000111.7Q321 T322 L323 C329 R330 I331 R334Q321-D325 PolarHBondContact O-N 3.18Å; T322-D325 WeakPolarHBondContact O-CB 3.39Å; T322-D325 PolarHBondContact O-N 3.29Å; T322-D325 VanDerWaalsContact O-N 3.14Å; L323-D325 VanDerWaalsContact C-N 3.32Å; L323-D325 PolarHBondContact O-N 2.98Å; D325-C329 PolarHBondContact O-N 2.96Å; D325-R330 PolarHBondContact O-N 2.68Å; D325-I331 HydrophobicContact CB-CD1 4.39Å; D325-I331 HydrophobicContact CB-CG1 3.86Å; D325-R334 IonicContact OD2-NH1 3.34Å; D325-R334 PolarHBondContact OD2-NH1 3.3Å
326I90.7Very high82.3Confident40 Ų4075.3 Ų75.321%0.20536%0.357CS..Hα-helixtrans-60.9-55.2171.5-61.6170.5000109.4L42 V43 I46 T322 L323 M324 K328 C329 I331L42-I326 HydrophobicContact CD2-CD1 4.26Å; L42-I326 HydrophobicContact CG-CD1 4.4Å; V43-I326 HydrophobicContact CG2-CD1 3.56Å; I46-I326 HydrophobicContact CD1-CD1 3.68Å; I46-I326 HydrophobicContact CD1-CG1 3.83Å; T322-I326 WeakPolarHBondContact O-CG1 3.46Å; T322-I326 PolarHBondContact O-N 3.12Å; L323-I326 HydrophobicContact CD1-CD1 4.44Å; L323-I326 WeakPolarHBondContact O-CB 3.48Å; L323-I326 PolarHBondContact O-N 2.72Å; M324-I326 VanDerWaalsContact C-N 3.35Å; I326-K328 VanDerWaalsContact C-N 3.27Å; I326-K328 PolarHBondContact O-N 2.88Å; I326-C329 PolarHBondContact O-N 2.85Å; I326-I331 HydrophobicContact CB-CD1 3.89Å; I326-I331 HydrophobicContact CD1-CD1 4.4Å; I326-I331 HydrophobicContact CG1-CD1 3.16Å
327F90.3Very high80.7Confident143 Ų14381.8 Ų81.863%0.62739%0.387SS*.Hα-helixtrans-64-29.8-176.2-78.8-64.1000113.6L323 M324 C329L323-F327 HydrophobicContact CD1-CD2 4.15Å; L323-F327 HydrophobicContact CD1-CE2 3.62Å; L323-F327 HydrophobicContact CD1-CZ 4.47Å; L323-F327 HydrophobicContact CD2-CE2 4.2Å; L323-F327 HydrophobicContact CG-CD2 3.94Å; L323-F327 HydrophobicContact CG-CE2 3.67Å; L323-F327 VanDerWaalsContact O-CD2 3.23Å; L323-F327 WeakPolarHBondContact O-CD2 3.33Å; L323-F327 PolarHBondContact O-N 2.85Å; M324-F327 PolarHBondContact O-N 3.5Å; F327-C329 VanDerWaalsContact C-N 3.28Å
328K90.5Very high79.3Confident129 Ų12983.3 Ų83.356%0.56139%0.393SS*.THydrogen-bonded Turntrans-85.75.2174.8-67.9178.9-179.8177.80113.4M324 I326 R330M324-K328 WeakPolarHBondContact O-CB 3.22Å; M324-K328 WeakPolarHBondContact O-CG 3.43Å; M324-K328 PolarHBondContact O-N 3.43Å; I326-K328 VanDerWaalsContact C-N 3.27Å; I326-K328 PolarHBondContact O-N 2.88Å; K328-R330 HydrophobicContact CB-CG 3.93Å; K328-R330 PolarHBondContact O-N 2.85Å
329C80.7Confident77.9Confident97 Ų9788 Ų8866%0.65541%0.411SS*.THydrogen-bonded Turntrans52.724-174.4-63.50000114.2D325 I326 F327 I331D325-C329 PolarHBondContact O-N 2.96Å; I326-C329 PolarHBondContact O-N 2.85Å; F327-C329 VanDerWaalsContact C-N 3.28Å; C329-I331 VanDerWaalsContact C-N 3.31Å; C329-I331 PolarHBondContact O-N 3.1Å
330R72.2Confident76.2Confident142 Ų14293.6 Ų93.654%0.53644%0.437SS..  trans-80.4-11.9-176-73.4-176.9178.6-169.2-3.9113.6D325 K328 F332 L333 R334D325-R330 PolarHBondContact O-N 2.68Å; K328-R330 HydrophobicContact CB-CG 3.93Å; K328-R330 PolarHBondContact O-N 2.85Å; R330-F332 VanDerWaalsContact C-N 3.32Å; R330-F332 PolarHBondContact O-N 3.29Å; R330-L333 PolarHBondContact O-N 3.27Å; R330-R334 PolarHBondContact O-N 3.29Å; R330-R334 VanDerWaalsContact O-N 3.14Å
331I64.2Low74.8Confident22 Ų2295.9 Ų95.911%0.11345%0.45CS..Hα-helixtrans-64.3-37.3-174.7-67.6178.3000112.3I46 D325 I326 C329 L333 R334 N335I46-I331 HydrophobicContact CD1-CD1 3.85Å; I46-I331 HydrophobicContact CG2-CD1 4.2Å; I46-I331 HydrophobicContact CG2-CG2 4.45Å; D325-I331 HydrophobicContact CB-CD1 4.39Å; D325-I331 HydrophobicContact CB-CG1 3.86Å; I326-I331 HydrophobicContact CB-CD1 3.89Å; I326-I331 HydrophobicContact CD1-CD1 4.4Å; I326-I331 HydrophobicContact CG1-CD1 3.16Å; C329-I331 VanDerWaalsContact C-N 3.31Å; C329-I331 PolarHBondContact O-N 3.1Å; I331-L333 VanDerWaalsContact C-N 3.35Å; I331-L333 PolarHBondContact O-N 3.23Å; I331-R334 PolarHBondContact O-N 3.16Å; I331-N335 PolarHBondContact O-N 2.03Å
332F61.3Low73.3Confident177 Ų17797.2 Ų97.278%0.77645%0.454SS*.Hα-helixtrans-64.4-41177-82.7-80.9000111.7R330 R334R330-F332 VanDerWaalsContact C-N 3.32Å; R330-F332 PolarHBondContact O-N 3.29Å; F332-R334 PolarHBondContact O-N 3.4Å
333L60.2Low71.9Confident124 Ų124103.8 Ų103.865%0.64948%0.482SS*.Hα-helixtrans-67.2-33.9178.1-70.4161000112.8R330 I331R330-L333 PolarHBondContact O-N 3.27Å; I331-L333 VanDerWaalsContact C-N 3.35Å; I331-L333 PolarHBondContact O-N 3.23Å
334R62.2Low70.2Confident118 Ų118111 Ų11145%0.44551%0.509SS..Hα-helixtrans-76-33.7-178-166173.2178.8-179.9-3.3113D325 R330 I331 F332 D336 H337 L338D325-R334 IonicContact OD2-NH1 3.34Å; D325-R334 PolarHBondContact OD2-NH1 3.3Å; R330-R334 PolarHBondContact O-N 3.29Å; R330-R334 VanDerWaalsContact O-N 3.14Å; I331-R334 PolarHBondContact O-N 3.16Å; F332-R334 PolarHBondContact O-N 3.4Å; R334-D336 VanDerWaalsContact C-N 3.34Å; R334-D336 PolarHBondContact O-N 3.1Å; R334-H337 PolarHBondContact O-N 3.05Å; R334-L338 HydrophobicContact CG-CD1 4.28Å; R334-L338 PolarHBondContact O-N 2.75Å; R334-L338 VanDerWaalsContact O-N 3.1Å
335N61.4Low68.7Low42 Ų42109.5 Ų109.523%0.22551%0.507CS..Hα-helixtrans-66.9-34.1179.5-85.4-12000112.6I331 L338 K339I331-N335 PolarHBondContact O-N 2.03Å; N335-L338 PolarHBondContact O-N 2.87Å; N335-K339 WeakPolarHBondContact O-CB 3.41Å; N335-K339 WeakPolarHBondContact O-CG 3.32Å; N335-K339 PolarHBondContact O-N 3.32Å
336D60.9Low67.4Low104 Ų104114.4 Ų114.456%0.55653%0.528SS*.Hα-helixtrans-67.2-41.3176.3-76-17.8000111.9R334 K339 Q340R334-D336 VanDerWaalsContact C-N 3.34Å; R334-D336 PolarHBondContact O-N 3.1Å; D336-K339 PolarHBondContact O-N 2.87Å; D336-Q340 WeakPolarHBondContact O-CB 3.39Å; D336-Q340 PolarHBondContact O-N 3.43Å
337H60.4Low66.1Low135 Ų135116.3 Ų116.363%0.62554%0.539SS*.Hα-helixtrans-65.9-39.8175.4-87.3-66.3000113.3R334 Q340 K341R334-H337 PolarHBondContact O-N 3.05Å; H337-Q340 PolarHBondContact O-N 3.45Å; H337-K341 WeakPolarHBondContact O-CB 3.45Å; H337-K341 PolarHBondContact O-N 3.04Å
338L63.9Low64.7Low70 Ų70113.8 Ų113.837%0.36653%0.532SS..Hα-helixtrans-69.8-37.4177.5-83.4163.7000112.3R334 N335 K341 K342R334-L338 HydrophobicContact CG-CD1 4.28Å; R334-L338 PolarHBondContact O-N 2.75Å; R334-L338 VanDerWaalsContact O-N 3.1Å; N335-L338 PolarHBondContact O-N 2.87Å; L338-K341 PolarHBondContact O-N 3.41Å; L338-K342 PolarHBondContact O-N 3.02Å
339K61.3Low63.2Low129 Ų129113.1 Ų113.156%0.56153%0.531SS*.Hα-helixtrans-63.2-44.1171.9-80.2-178.6177.6177.40111.4N335 D336 K343N335-K339 WeakPolarHBondContact O-CB 3.41Å; N335-K339 WeakPolarHBondContact O-CG 3.32Å; N335-K339 PolarHBondContact O-N 3.32Å; D336-K339 PolarHBondContact O-N 2.87Å; K339-K343 WeakPolarHBondContact O-CB 3.44Å; K339-K343 PolarHBondContact O-N 3.48Å
340Q59.5Low62.2Low117 Ų117113.6 Ų113.655%0.54753%0.526SS..Hα-helixtrans-61.9-43.4174.2-82.4-176.7-6.900112.2D336 H337 K343 Y344D336-Q340 WeakPolarHBondContact O-CB 3.39Å; D336-Q340 PolarHBondContact O-N 3.43Å; H337-Q340 PolarHBondContact O-N 3.45Å; Q340-K343 PolarHBondContact O-N 3.5Å; Q340-Y344 PolarHBondContact O-N 3.4Å
341K64.5Low61.5Low150 Ų150113.2 Ų113.265%0.65253%0.53SS*.Hα-helixtrans-66.1-41.1-180-167.2175.7-178.21790112.7H337 L338 K343 Y344 T345H337-K341 WeakPolarHBondContact O-CB 3.45Å; H337-K341 PolarHBondContact O-N 3.04Å; L338-K341 PolarHBondContact O-N 3.41Å; K341-K343 VanDerWaalsContact C-N 3.32Å; K341-Y344 PolarHBondContact O-N 3.45Å; K341-T345 PolarHBondContact O-N 2.92Å; K341-T345 PolarHBondContact O-OG1 3.14Å
342K61.8Low61.2Low148 Ų148117.5 Ų117.564%0.64355%0.55SS*.Hα-helixtrans-63.1-39.6173-84.2-174.2176.7177.10111.6L338 T345 Q346L338-K342 PolarHBondContact O-N 3.02Å; K342-T345 PolarHBondContact O-N 2.73Å; K342-Q346 VanDerWaalsContact O-CB 3.32Å; K342-Q346 WeakPolarHBondContact O-CB 3.43Å; K342-Q346 PolarHBondContact O-N 3.46Å
343K63.3Low60.9Low142 Ų142115.7 Ų115.762%0.61754%0.541SS*.Hα-helixtrans-63.1-49.5176.6-156.2175.1-178-174.40111.5K339 Q340 K341 T345 Q346 D347K339-K343 WeakPolarHBondContact O-CB 3.44Å; K339-K343 PolarHBondContact O-N 3.48Å; Q340-K343 PolarHBondContact O-N 3.5Å; K341-K343 VanDerWaalsContact C-N 3.32Å; K343-T345 PolarHBondContact O-N 3.32Å; K343-Q346 PolarHBondContact O-N 2.77Å; K343-D347 WeakPolarHBondContact O-CB 3.28Å; K343-D347 PolarHBondContact O-N 2.99Å
344Y59.8Low60.6Low162 Ų162111.6 Ų111.664%0.63553%0.529SS*.Hα-helixtrans-58.4-41.6174.1-98.5-80.4000113.6Q340 K341 Q346 D347 N348Q340-Y344 PolarHBondContact O-N 3.4Å; K341-Y344 PolarHBondContact O-N 3.45Å; Y344-Q346 VanDerWaalsContact C-N 3.34Å; Y344-D347 PolarHBondContact O-N 3.4Å; Y344-N348 WeakPolarHBondContact O-CB 3.36Å; Y344-N348 PolarHBondContact O-N 2.83Å; Y344-N348 PolarHBondContact O-OD1 2.91Å
345T62.6Low60.3Low79 Ų79112.5 Ų112.549%0.48554%0.538SS..Hα-helixtrans-70.4-34.2179.9-44.40000111.3K341 K342 K343 H349K341-T345 PolarHBondContact O-N 2.92Å; K341-T345 PolarHBondContact O-OG1 3.14Å; K342-T345 PolarHBondContact O-N 2.73Å; K343-T345 PolarHBondContact O-N 3.32Å; T345-H349 WeakPolarHBondContact O-CB 3.46Å; T345-H349 PolarHBondContact O-N 3.42Å; T345-H349 VanDerWaalsContact O-N 3.13Å
346Q64Low60Low132 Ų132116.7 Ų116.762%0.61756%0.557SS**Hα-helixtrans-73.6-36.9176.8-170.4167-9.900112K342 K343 Y344 H349 I350K342-Q346 VanDerWaalsContact O-CB 3.32Å; K342-Q346 WeakPolarHBondContact O-CB 3.43Å; K342-Q346 PolarHBondContact O-N 3.46Å; K343-Q346 PolarHBondContact O-N 2.77Å; Y344-Q346 VanDerWaalsContact C-N 3.34Å; Q346-H349 PolarHBondContact O-N 3.19Å; Q346-I350 HydrophobicContact CG-CD1 4.4Å; Q346-I350 WeakPolarHBondContact O-CD1 3.21Å; Q346-I350 VanDerWaalsContact O-CG1 3.27Å; Q346-I350 WeakPolarHBondContact O-CG1 3.25Å; Q346-I350 PolarHBondContact O-N 3.24Å
347D63.7Low59.6Low81 Ų81118.7 Ų118.743%0.43356%0.563SS.*Hα-helixtrans-67.1-44175-66.2-24.2000110.7K343 Y344 H349 I350 E351K343-D347 WeakPolarHBondContact O-CB 3.28Å; K343-D347 PolarHBondContact O-N 2.99Å; Y344-D347 PolarHBondContact O-N 3.4Å; D347-H349 PolarHBondContact O-N 3.13Å; D347-I350 PolarHBondContact O-N 2.82Å; D347-E351 PolarHBondContact O-N 2.58Å
348N60.2Low59.4Low90 Ų90116.5 Ų116.548%0.48156%0.562SS.*Hα-helixtrans-64.9-35.3176.4-693000112.9Y344 I350 E351 E352Y344-N348 WeakPolarHBondContact O-CB 3.36Å; Y344-N348 PolarHBondContact O-N 2.83Å; Y344-N348 PolarHBondContact O-OD1 2.91Å; N348-I350 VanDerWaalsContact C-N 3.28Å; N348-I350 PolarHBondContact O-N 3.43Å; N348-E351 PolarHBondContact O-N 3.07Å; N348-E352 WeakPolarHBondContact O-CB 3.15Å; N348-E352 PolarHBondContact O-N 3.45Å
349H58.8Low58.8Low114 Ų114118.2 Ų118.253%0.52857%0.571SS.*Hα-helixtrans-74.3-19.1177.8-134-37.6000113.1T345 Q346 D347T345-H349 WeakPolarHBondContact O-CB 3.46Å; T345-H349 PolarHBondContact O-N 3.42Å; T345-H349 VanDerWaalsContact O-N 3.13Å; Q346-H349 PolarHBondContact O-N 3.19Å; D347-H349 PolarHBondContact O-N 3.13Å
350I59.5Low58.5Low108 Ų108117.9 Ų117.955%0.55457%0.571SS**Hα-helixtrans-81.2-39.8172.2-68.8166.1000110.1Q346 D347 N348 K353 G354Q346-I350 HydrophobicContact CG-CD1 4.4Å; Q346-I350 WeakPolarHBondContact O-CD1 3.21Å; Q346-I350 VanDerWaalsContact O-CG1 3.27Å; Q346-I350 WeakPolarHBondContact O-CG1 3.25Å; Q346-I350 PolarHBondContact O-N 3.24Å; D347-I350 PolarHBondContact O-N 2.82Å; N348-I350 VanDerWaalsContact C-N 3.28Å; N348-I350 PolarHBondContact O-N 3.43Å; I350-K353 PolarHBondContact O-N 2.96Å; I350-G354 PolarHBondContact O-N 3.15Å
351E59.1Low58.3Low134 Ų134118.8 Ų118.863%0.62658%0.575SS**Hα-helixtrans-64.5-41.5173.1-82.3-177.615800112.4D347 N348 K353 G354 E355D347-E351 PolarHBondContact O-N 2.58Å; N348-E351 PolarHBondContact O-N 3.07Å; E351-K353 VanDerWaalsContact C-N 3.29Å; E351-K353 PolarHBondContact O-N 3.1Å; E351-G354 CarbonylContact O-C 3.29Å; E351-G354 WeakPolarHBondContact O-CA 3.21Å; E351-G354 PolarHBondContact O-N 3.26Å; E351-E355 PolarHBondContact O-N 3.08Å
352E56.9Low57.8Low111 Ų111114.3 Ų114.352%0.51956%0.563SS.*Hα-helixtrans-66.6-31.4179.3-144.2176.2-159.300112.4N348 Q356N348-E352 WeakPolarHBondContact O-CB 3.15Å; N348-E352 PolarHBondContact O-N 3.45Å; E352-Q356 WeakPolarHBondContact O-CB 3.07Å; E352-Q356 WeakPolarHBondContact O-CG 2.97Å; E352-Q356 PolarHBondContact O-N 2.01Å; E352-Q356 VanDerWaalsContact O-N 3.1Å
353K56Low57.4Low139 Ų139112.7 Ų112.760%0.60456%0.557SS**Hα-helixtrans-73.4-33.3170-81-174.9175.9-177.90112.5I350 E351 Q357I350-K353 PolarHBondContact O-N 2.96Å; E351-K353 VanDerWaalsContact C-N 3.29Å; E351-K353 PolarHBondContact O-N 3.1Å; K353-Q357 VanDerWaalsContact O-CB 3.26Å; K353-Q357 WeakPolarHBondContact O-CB 3.4Å; K353-Q357 PolarHBondContact O-N 3.17Å
354G52.8Low56.9Low38 Ų38111.8 Ų111.839%0.39256%0.555SS.*Hα-helixtrans-67-41.9173.700000112.8I350 E351 Q357 C358I350-G354 PolarHBondContact O-N 3.15Å; E351-G354 CarbonylContact O-C 3.29Å; E351-G354 WeakPolarHBondContact O-CA 3.21Å; E351-G354 PolarHBondContact O-N 3.26Å; G354-Q357 PolarHBondContact O-N 3.48Å; G354-C358 PolarHBondContact O-N 2.81Å; G354-C358 VanDerWaalsContact O-N 3.14Å
355E56.4Low56.6Low137 Ų137111.9 Ų111.964%0.6456%0.562SS**Hα-helixtrans-72.5-39.1178.5-74.4-171.1151.100112.7E351 Q357 C358 L359E351-E355 PolarHBondContact O-N 3.08Å; E355-Q357 VanDerWaalsContact C-N 3.28Å; E355-Q357 PolarHBondContact O-N 3.43Å; E355-C358 PolarHBondContact O-N 2.93Å; E355-L359 PolarHBondContact O-N 3.19Å
356Q54.3Low56.1Low130 Ų130113.8 Ų113.861%0.60757%0.568SS**Hα-helixtrans-65.1-31.5173.2-80.5178.8-9.900112.6E352 H360E352-Q356 WeakPolarHBondContact O-CB 3.07Å; E352-Q356 WeakPolarHBondContact O-CG 2.97Å; E352-Q356 PolarHBondContact O-N 2.01Å; E352-Q356 VanDerWaalsContact O-N 3.1Å; Q356-H360 WeakPolarHBondContact O-CB 3.3Å; Q356-H360 PolarHBondContact O-N 3.42Å; Q356-H360 VanDerWaalsContact O-N 3.13Å
357Q53.9Low55.3Low146 Ų146113.9 Ų113.968%0.68257%0.572SS**Hα-helixtrans-77.3-27178.4-152.5159.22.500112.3K353 G354 E355K353-Q357 VanDerWaalsContact O-CB 3.26Å; K353-Q357 WeakPolarHBondContact O-CB 3.4Å; K353-Q357 PolarHBondContact O-N 3.17Å; G354-Q357 PolarHBondContact O-N 3.48Å; E355-Q357 VanDerWaalsContact C-N 3.28Å; E355-Q357 PolarHBondContact O-N 3.43Å
358C54.5Low54.6Low89 Ų89116.8 Ų116.860%0.60159%0.586SS**Hα-helixtrans-77.5-37169.8-80.50000113.5G354 E355 Q361 S362G354-C358 PolarHBondContact O-N 2.81Å; G354-C358 VanDerWaalsContact O-N 3.14Å; E355-C358 PolarHBondContact O-N 2.93Å; C358-Q361 PolarHBondContact O-N 3Å; C358-S362 PolarHBondContact O-N 2.87Å
359L52.7Low53.9Low107 Ų107117.3 Ų117.356%0.5660%0.597SS**Hα-helixtrans-69.3-37176.3-109120.5000112.4E355 Q361 S362 E363E355-L359 PolarHBondContact O-N 3.19Å; L359-Q361 VanDerWaalsContact C-N 3.3Å; L359-Q361 PolarHBondContact O-N 3.24Å; L359-S362 PolarHBondContact O-N 3.09Å; L359-S362 PolarHBondContact O-OG 2.8Å; L359-E363 PolarHBondContact O-N 3.39Å; L359-E363 VanDerWaalsContact O-N 3.08Å
360H54Low53.3Low121 Ų121117.9 Ų117.956%0.5661%0.608SS**Hα-helixtrans-70.3-25.8176.9-122-54.5000113.3Q356 Q364Q356-H360 WeakPolarHBondContact O-CB 3.3Å; Q356-H360 PolarHBondContact O-N 3.42Å; Q356-H360 VanDerWaalsContact O-N 3.13Å; H360-Q364 WeakPolarHBondContact O-CB 3.28Å; H360-Q364 WeakPolarHBondContact O-CG 3.22Å; H360-Q364 PolarHBondContact O-N 3.19Å
361Q55.8Low52.5Low136 Ų136120.8 Ų120.864%0.63662%0.622SS**Hα-helixtrans-76.2-30.4172.7-101.7-176.9-17.600112.9C358 L359 Q365C358-Q361 PolarHBondContact O-N 3Å; L359-Q361 VanDerWaalsContact C-N 3.3Å; L359-Q361 PolarHBondContact O-N 3.24Å; Q361-Q365 PolarHBondContact O-N 2.95Å
362S53.7Low51.7Low57 Ų57121.8 Ų121.840%0.39963%0.632SS.*Hα-helixtrans-79.1-35176.485.40000112.5C358 L359 Q365 I366C358-S362 PolarHBondContact O-N 2.87Å; L359-S362 PolarHBondContact O-N 3.09Å; L359-S362 PolarHBondContact O-OG 2.8Å; S362-Q365 PolarHBondContact O-N 3.07Å; S362-I366 WeakPolarHBondContact O-CG1 3.18Å; S362-I366 PolarHBondContact O-N 3.43Å
363E53.6Low51.1Low113 Ų113125.6 Ų125.653%0.52865%0.649SS.*Hα-helixtrans-73.5-27.2174.9-73.9-171.1152.300113.3L359 N367L359-E363 PolarHBondContact O-N 3.39Å; L359-E363 VanDerWaalsContact O-N 3.08Å; E363-N367 PolarHBondContact O-N 2.95Å
364Q53Low50.4Low123 Ų123128.2 Ų128.258%0.57566%0.664SS**Hα-helixtrans-77.8-19.2172.3-80.6-177.9-20.100113.8H360 I368H360-Q364 WeakPolarHBondContact O-CB 3.28Å; H360-Q364 WeakPolarHBondContact O-CG 3.22Å; H360-Q364 PolarHBondContact O-N 3.19Å; Q364-I368 WeakPolarHBondContact O-CD1 3.4Å; Q364-I368 WeakPolarHBondContact O-CG1 3.47Å
365Q53Low50Low164 Ų164132.3 Ų132.377%0.76668%0.681SS**Hα-helixtrans-87.7-19.6172.6-87.2-178.3-26.800113.8Q361 S362Q361-Q365 PolarHBondContact O-N 2.95Å; S362-Q365 PolarHBondContact O-N 3.07Å
366I51.7Low49.3Very low120 Ų120133.6 Ų133.662%0.61569%0.691SS**Hα-helixtrans-89.2-22.7-179.8-65.8169.6000112.4S362S362-I366 WeakPolarHBondContact O-CG1 3.18Å; S362-I366 PolarHBondContact O-N 3.43Å
367N48.3Very low48.8Very low133 Ų133132.1 Ų132.171%0.71170%0.695SS**THydrogen-bonded Turntrans-94.910.2-179.9-80.3-25.4000115.6E363E363-N367 PolarHBondContact O-N 2.95Å
368I49.2Very low48.1Very low142 Ų142132.2 Ų132.273%0.72870%0.699SS**THydrogen-bonded Turntrans-1030.2-178.7-65.4177.8000113.1Q364Q364-I368 WeakPolarHBondContact O-CD1 3.4Å; Q364-I368 WeakPolarHBondContact O-CG1 3.47Å
369S45Very low47.4Very low102 Ų102138.7 Ų138.771%0.71371%0.713SS**SBendtrans-114.39.2179.760.90000116.1
370V46.7Very low46.9Very low125 Ų125138.6 Ų138.676%0.75872%0.721SS**  trans-131.166177.1-168.10000109.6
371M41.4Very low46.3Very low169 Ų169139.8 Ų139.883%0.83373%0.732SS**  trans-137.874.9167.4-108.7-151.472.300107.8
372D43.2Very low45.7Very low156 Ų156143.6 Ų143.683%0.83475%0.746SS**  trans-151.3135.1156.7-98.6-29.6000107.6
373Q43.3Very low45.1Very low191 Ų191148 Ų14889%0.89377%0.765SS**SBendtrans88.8123.6-179.2-59.8175-57.700116.6
374E42.2Very low44.5Very low194 Ų194149.5 Ų149.591%0.90778%0.775SS**  trans89.555.8168.2-53.5-170.8164.300117.1
375T44.5Very low43.8Very low124 Ų124154.8 Ų154.876%0.76179%0.789SS**  trans-92143.8146.8-35.50000108.7
376I41.5Very low43.1Very low163 Ų163152.6 Ų152.684%0.83679%0.787SS**  trans88.784.5165.4-43.3164.9000115
377S44Very low42.6Very low99 Ų99155.1 Ų155.169%0.69280%0.796SS**  -163.7132.1118.258.40000111.4
378L39Very low42.1Very low149 Ų149155.5 Ų155.578%0.7880%0.798SS**  trans36115.8141.4-72.591.9000117.5
379Y40.3Very low41.8Very low224 Ų224158.3 Ų158.388%0.87881%0.805SS**  -169.295.5117.3-101.5-72.6000109.7
380S40.9Very low41.7Very low106 Ų106162.1 Ų162.174%0.74181%0.805SS**  trans-72.9123.9152.2-177.20000107.8
381N41.7Very low41.7Very low146 Ų146163 Ų16378%0.78180%0.804SS**  trans140.6104.1158.2-80.9-31.9000111.7
382K44.3Very low41.6Very low215 Ų215162.4 Ų162.494%0.93580%0.799SS**  -173.5109.1128.9-109.1172.9178.5179.80112.7
383L41.2Very low41.7Very low151 Ų151160.8 Ų160.879%0.79180%0.8SS**  trans-68.5157.7153.8-144.688.3000109.3
384I40.3Very low41.6Very low144 Ų144158 Ų15874%0.73879%0.791SS**  trans104.1108.3150.6-56.6153.6000118.9
385R38.2Very low41.7Very low233 Ų233154.2 Ų154.288%0.87979%0.786SS**  trans35.3156.8132.7-66.8-172.2-176.2-175.61.2123.5
386V39.2Very low41.5Very low118 Ų118155.6 Ų155.672%0.71579%0.788SS**  trans129.299.6138.7177.10000109.2
387E39.8Very low41.5Very low174 Ų174154.8 Ų154.881%0.81379%0.785SS**  55.7122.487.3-85.7179.5168.800114.8
388D38.9Very low41.2Very low140 Ų140156 Ų15675%0.74979%0.792SS**  trans138102.2146.9-73-20.7000114.3
389F43Very low41.2Very low201 Ų201153.9 Ų153.988%0.88279%0.79SS**  trans-166.1125.9152.3-110.1-85.8000107.7
390Y43.1Very low41.4Very low183 Ų183150 Ų15072%0.71879%0.79SS**  cis-171139.2-14.2-136.2-125000105.3
391I45.1Very low41.6Very low142 Ų142152.3 Ų152.373%0.72879%0.794SS**  trans80.4113.1146-62.9-177.7000122.7
392H40.8Very low41.5Very low157 Ų157150.8 Ų150.873%0.72779%0.792SS**  trans-46141.1151.7-111.9-68.7000116.6N394H392-N394 PolarHBondContact CE1-OD1 3.34Å; H392-N394 PolarHBondContact ND1-OD1 2.81Å
393S45.1Very low41.5Very low123 Ų123147.6 Ų147.686%0.8678%0.784SS**  trans-137.4128141.161.30000110.8
394N41Very low41.8Very low131 Ų131145.5 Ų145.570%0.70178%0.78SS**  trans-89.5138.5-179.3-75.1-32.4000111H392H392-N394 PolarHBondContact CE1-OD1 3.34Å; H392-N394 PolarHBondContact ND1-OD1 2.81Å
395S43.4Very low42.1Very low116 Ų116147.8 Ų147.881%0.81178%0.784SS**  trans175.6102.7139.249.20000109.1
396L41.3Very low42.4Very low153 Ų153143.5 Ų143.580%0.80178%0.777SS**  58.6106.882.6-91.2145.2000116.4
397N40.1Very low42.4Very low145 Ų145148.9 Ų148.978%0.77580%0.802SS**  trans61.6115.5139.4-73.6-2000122.6
398C39.4Very low42.5Very low124 Ų124147.7 Ų147.784%0.83880%0.802SS**  167.7107.2120.5-95.70000108
399S39.1Very low42.7Very low105 Ų105148.1 Ų148.173%0.73481%0.805SS**  53.999.389.2-175.80000114.2
400T43.5Very low42.7Very low143 Ų143145.1 Ų145.188%0.87780%0.8SS**  -166.9136.9127.626.50000111.2
401D44.8Very low42.7Very low154 Ų154142.9 Ų142.982%0.82481%0.805SS**  trans-67.5171.4-174.4-78.7-48.8000116.4
402P40.8Very low42.5Very low114 Ų114142.9 Ų142.974%0.7481%0.81SS**  trans-93.3158.3-170.537-31.3000113.3
403I43.7Very low42.7Very low148 Ų148142 Ų14276%0.75982%0.816SS**  trans-125.6124.6167.7-58.6175.9000109.8F405I403-F405 HydrophobicContact CG2-CD2 3.99Å; I403-F405 HydrophobicContact CG2-CE2 3.99Å
404P46.9Very low42.5Very low108 Ų108143.4 Ų143.470%0.70181%0.812SS**  trans-102.1149.9165.636.5-26.6000112.2
405F47.4Very low42.6Very low192 Ų192144.3 Ų144.384%0.84282%0.821SS**  trans-141.9114.5159.9-87.1-87.8000103.9I403I403-F405 HydrophobicContact CG2-CD2 3.99Å; I403-F405 HydrophobicContact CG2-CE2 3.99Å
406I44.1Very low42.5Very low142 Ų142146.7 Ų146.773%0.72882%0.822SS**  42.490.966-49.8-179.1000111.4
407D39.1Very low42.6Very low232 Ų232146.1 Ų146.1100%1.24182%0.824SS**  -130.9092.1-84.8-33.5000109.8

Retrieved 407 of 407 residues in 718.9 ms (Link to these results)

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