A0A087YLY4_POEFO Loading...

NGFI-A binding protein 1a (EGR1 binding protein 1)

AlphaFold DB , UniProt , Accession A0A087YLY4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 507 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
1M37.9Very low70.4Confident213 Ų21395.1 Ų95.1100%1.04953%0.529SS*.  0148.30-70.181.5172.200108.8
2A36.7Very low72Confident93 Ų9393.3 Ų93.377%0.76952%0.517SS*.PPolyproline II helixtrans-79.6122.3167.700000107.8V4A2-V4 PolarHBondContact O-N 3.17Å
3A47.4Very low73.4Confident70 Ų7090.5 Ų90.558%0.57950%0.498SS*.PPolyproline II helixtrans-64121.2-178.400000109.9L5A3-L5 PolarHBondContact O-N 3.26Å
4V66.1Low74.8Confident60 Ų6084.1 Ų84.136%0.36446%0.462SS..PPolyproline II helixtrans-59.1120.3171.6-178.60000108.3A2 Y27 E28A2-V4 PolarHBondContact O-N 3.17Å; V4-Y27 HydrophobicContact CB-CE1 4.32Å; V4-Y27 WeakPolarHBondContact O-CE1 3.45Å; V4-E28 HydrophobicContact CG2-CG 4.2Å
5L71.6Confident76Confident142 Ų14281.7 Ų81.774%0.74344%0.444SS*.PPolyproline II helixtrans-73.9138.2174.2-77.789.7000109.8A3 R7A3-L5 PolarHBondContact O-N 3.26Å; L5-R7 PolarHBondContact O-N 3.34Å
6P81.2Confident76.9Confident39 Ų3981.5 Ų81.525%0.25344%0.435SS..PPolyproline II helixtrans-51.8129.4173.7-30.437000113.7E11 L12 Y15 Y27P6-E11 WeakPolarHBondContact CA-OE2 3.09Å; P6-E11 HydrophobicContact CB-CB 3.92Å; P6-L12 HydrophobicContact CB-CB 3.9Å; P6-L12 HydrophobicContact CB-CD1 4.17Å; P6-L12 HydrophobicContact CG-CD1 4.11Å; P6-Y15 HydrophobicContact CG-CD1 4.44Å; P6-Y15 HydrophobicContact CG-CD2 3.89Å; P6-Y15 HydrophobicContact CG-CG 3.76Å; P6-Y27 WeakPolarHBondContact CA-OH 3.29Å
7R81.1Confident77.8Confident214 Ų21476.7 Ų76.781%0.80841%0.409SS*.  trans-104-39.5178.2-46.5-179.7174.7-160.7-2.1112.7L5 E11L5-R7 PolarHBondContact O-N 3.34Å; R7-E11 VanDerWaalsContact CB-OE1 3.29Å; R7-E11 WeakPolarHBondContact CB-OE1 3.41Å; R7-E11 VanDerWaalsContact N-CD 3.28Å; R7-E11 PolarHBondContact N-OE1 2.76Å; R7-E11 PolarHBondContact N-OE2 3.12Å
8T87.3Confident78.7Confident62 Ų6272.4 Ų72.438%0.3839%0.387SS..SBendtrans-93168.3173.777.30000112.8G10 E11 L12 D36T8-G10 PolarHBondContact OG1-N 3.41Å; T8-E11 PolarHBondContact N-OE1 2.79Å; T8-E11 VanDerWaalsContact N-OE1 3.12Å; T8-E11 WeakPolarHBondContact OG1-CB 3.42Å; T8-E11 WeakPolarHBondContact OG1-CG 3.38Å; T8-E11 PolarHBondContact OG1-N 2.75Å; T8-L12 PolarHBondContact O-N 3.35Å; T8-D36 PolarHBondContact OG1-OD2 2.93Å
9L85.2Confident79.4Confident122 Ų12271.4 Ų71.464%0.63938%0.379SS*.Hα-helixtrans-67.4-36.6170.6-179.760.5000111.7L12 Q13L9-L12 PolarHBondContact O-N 3.19Å; L9-Q13 WeakPolarHBondContact O-CG 3.43Å; L9-Q13 PolarHBondContact O-N 3.24Å
10G87.8Confident79.8Confident16 Ų1672.5 Ų72.517%0.16538%0.378CS..Hα-helixtrans-63.4-50.5175.300000111.7T8 L12 Q13 L14 D36T8-G10 PolarHBondContact OG1-N 3.41Å; G10-L12 PolarHBondContact O-N 3.23Å; G10-Q13 PolarHBondContact O-N 3.44Å; G10-L14 WeakPolarHBondContact O-CB 3.35Å; G10-L14 PolarHBondContact O-N 3.25Å; G10-D36 CarbonylContact C-O 3.13Å; G10-D36 WeakPolarHBondContact CA-O 3.27Å
11E91.8Very high80.4Confident15 Ų1569.5 Ų69.57%0.0736%0.364CS..Hα-helixtrans-49-44.8171.5-84.5-175.3-108.400111.6P6 R7 T8 Y15 Y27 I31 D36P6-E11 WeakPolarHBondContact CA-OE2 3.09Å; P6-E11 HydrophobicContact CB-CB 3.92Å; R7-E11 VanDerWaalsContact CB-OE1 3.29Å; R7-E11 WeakPolarHBondContact CB-OE1 3.41Å; R7-E11 VanDerWaalsContact N-CD 3.28Å; R7-E11 PolarHBondContact N-OE1 2.76Å; R7-E11 PolarHBondContact N-OE2 3.12Å; T8-E11 PolarHBondContact N-OE1 2.79Å; T8-E11 VanDerWaalsContact N-OE1 3.12Å; T8-E11 WeakPolarHBondContact OG1-CB 3.42Å; T8-E11 WeakPolarHBondContact OG1-CG 3.38Å; T8-E11 PolarHBondContact OG1-N 2.75Å; E11-Y15 WeakPolarHBondContact O-CB 3.46Å; E11-Y15 PolarHBondContact O-N 2.89Å; E11-Y27 WeakPolarHBondContact CB-OH 3.35Å; E11-Y27 PolarHBondContact OE2-OH 2.88Å; E11-I31 HydrophobicContact CB-CD1 4.46Å; E11-I31 HydrophobicContact CG-CD1 3.71Å; E11-I31 HydrophobicContact CG-CG1 4.25Å; E11-I31 HydrophobicContact CG-CG2 4.47Å; E11-D36 HydrophobicContact CG-CB 4.03Å
12L89.6Confident83Confident74 Ų7464 Ų6439%0.38734%0.339SS..Hα-helixtrans-70.1-39.9-179-178.161000112.5P6 T8 L9 G10 Y15 R16P6-L12 HydrophobicContact CB-CB 3.9Å; P6-L12 HydrophobicContact CB-CD1 4.17Å; P6-L12 HydrophobicContact CG-CD1 4.11Å; T8-L12 PolarHBondContact O-N 3.35Å; L9-L12 PolarHBondContact O-N 3.19Å; G10-L12 PolarHBondContact O-N 3.23Å; L12-Y15 PolarHBondContact O-N 3.02Å; L12-R16 WeakPolarHBondContact O-CG 3.26Å; L12-R16 PolarHBondContact O-N 3.26Å
13Q90.3Very high85.8Confident57 Ų5759.7 Ų59.727%0.26630%0.303SS..Hα-helixtrans-64.1-49175.4-70.6173.26.900110.8L9 G10 Y15 R16 I17 V38L9-Q13 WeakPolarHBondContact O-CG 3.43Å; L9-Q13 PolarHBondContact O-N 3.24Å; G10-Q13 PolarHBondContact O-N 3.44Å; Q13-Y15 PolarHBondContact O-N 3.36Å; Q13-R16 PolarHBondContact O-N 3.21Å; Q13-I17 WeakPolarHBondContact O-CG1 3.25Å; Q13-I17 PolarHBondContact O-N 3.38Å; Q13-V38 HydrophobicContact CB-CG2 3.79Å
14L93.1Very high88Confident0 Ų059 Ų590%029%0.289CS..Hα-helixtrans-57.9-46.7175-177.181.2000111.3G10 R16 I17 L18 Y27 F30 I31 G35 V38 L41G10-L14 WeakPolarHBondContact O-CB 3.35Å; G10-L14 PolarHBondContact O-N 3.25Å; L14-R16 VanDerWaalsContact C-N 3.31Å; L14-R16 PolarHBondContact O-N 2.89Å; L14-I17 PolarHBondContact O-N 3.27Å; L14-I17 VanDerWaalsContact O-N 3.11Å; L14-L18 HydrophobicContact CD1-CD1 4.32Å; L14-L18 HydrophobicContact CD1-CG 4.49Å; L14-L18 HydrophobicContact CD2-CD1 4.11Å; L14-L18 HydrophobicContact CG-CD1 3.88Å; L14-L18 HydrophobicContact CG-CG 4.32Å; L14-L18 WeakPolarHBondContact O-CG 3.46Å; L14-L18 PolarHBondContact O-N 2.98Å; L14-Y27 HydrophobicContact CD2-CD2 4.14Å; L14-Y27 HydrophobicContact CD2-CE2 4.27Å; L14-F30 HydrophobicContact CD2-CB 3.6Å; L14-F30 HydrophobicContact CD2-CG 4.2Å; L14-I31 HydrophobicContact CD2-CD1 3.55Å; L14-G35 WeakPolarHBondContact CD2-O 3.39Å; L14-V38 HydrophobicContact CB-CG2 3.99Å; L14-L41 HydrophobicContact CD1-CD1 3.75Å
15Y92.7Very high89.3Confident49 Ų4965.7 Ų65.719%0.19231%0.309CS..Hα-helixtrans-55.9-45.5177.2-177.5-83.4000111.2P6 E11 L12 Q13 I17 Q19 L24 Y27P6-Y15 HydrophobicContact CG-CD1 4.44Å; P6-Y15 HydrophobicContact CG-CD2 3.89Å; P6-Y15 HydrophobicContact CG-CG 3.76Å; E11-Y15 WeakPolarHBondContact O-CB 3.46Å; E11-Y15 PolarHBondContact O-N 2.89Å; L12-Y15 PolarHBondContact O-N 3.02Å; Q13-Y15 PolarHBondContact O-N 3.36Å; Y15-I17 PolarHBondContact O-N 3.02Å; Y15-Q19 WeakPolarHBondContact O-CB 3.45Å; Y15-Q19 PolarHBondContact O-N 3.06Å; Y15-L24 HydrophobicContact CD1-CD2 4.38Å; Y15-L24 HydrophobicContact CD2-CD2 3.68Å; Y15-L24 HydrophobicContact CE1-CD2 4.28Å; Y15-L24 HydrophobicContact CE2-CD2 3.58Å; Y15-L24 HydrophobicContact CG-CD2 4.08Å; Y15-Y27 HydrophobicContact CD2-CD1 4.25Å; Y15-Y27 AromaticContact CD2-CD2 4Å; Y15-Y27 HydrophobicContact CD2-CD2 4Å; Y15-Y27 HydrophobicContact CD2-CE1 4.22Å; Y15-Y27 AromaticContact CD2-CE2 3.96Å; Y15-Y27 HydrophobicContact CD2-CE2 3.96Å; Y15-Y27 HydrophobicContact CD2-CG 4.14Å; Y15-Y27 HydrophobicContact CG-CE2 4.35Å
16R90.9Very high90.4Very high78 Ų7859.4 Ų59.429%0.29428%0.276SS..Hα-helixtrans-64.5-38.2176.7-70.5-65.8-173.4-147.1-1.7112.6L12 Q13 L14 Q19 R20 F82L12-R16 WeakPolarHBondContact O-CG 3.26Å; L12-R16 PolarHBondContact O-N 3.26Å; Q13-R16 PolarHBondContact O-N 3.21Å; L14-R16 VanDerWaalsContact C-N 3.31Å; L14-R16 PolarHBondContact O-N 2.89Å; R16-Q19 PolarHBondContact O-N 3.39Å; R16-R20 WeakPolarHBondContact O-CB 3.39Å; R16-R20 PolarHBondContact O-N 3.36Å; R16-F82 HydrophobicContact CB-CB 4.17Å; R16-F82 HydrophobicContact CB-CD1 4.42Å; R16-F82 WeakPolarHBondContact CD-O 3.28Å; R16-F82 WeakPolarHBondContact CG-O 3.46Å
17I92.7Very high90.9Very high0 Ų057.9 Ų57.90%027%0.265CS..Hα-helixtrans-66.6-49.2177.8-68.8163000110.8Q13 L14 Y15 Q19 R20 A21 V38 L68 A71 L72 W75 F82Q13-I17 WeakPolarHBondContact O-CG1 3.25Å; Q13-I17 PolarHBondContact O-N 3.38Å; L14-I17 PolarHBondContact O-N 3.27Å; L14-I17 VanDerWaalsContact O-N 3.11Å; Y15-I17 PolarHBondContact O-N 3.02Å; I17-Q19 VanDerWaalsContact C-N 3.33Å; I17-Q19 PolarHBondContact O-N 2.95Å; I17-R20 PolarHBondContact O-N 3.42Å; I17-A21 VanDerWaalsContact O-CB 3.3Å; I17-A21 WeakPolarHBondContact O-CB 3.46Å; I17-A21 PolarHBondContact O-N 3.06Å; I17-V38 HydrophobicContact CD1-CB 4.32Å; I17-V38 HydrophobicContact CD1-CG1 3.32Å; I17-V38 HydrophobicContact CD1-CG2 3.98Å; I17-L68 HydrophobicContact CG2-CD1 4.28Å; I17-A71 HydrophobicContact CG2-CB 3.84Å; I17-L72 HydrophobicContact CD1-CD2 4.37Å; I17-L72 HydrophobicContact CG2-CD2 4.13Å; I17-W75 HydrophobicContact CD1-CB 4.07Å; I17-W75 HydrophobicContact CD1-CD2 4.04Å; I17-W75 HydrophobicContact CD1-CG 3.68Å; I17-W75 HydrophobicContact CG1-CB 4.23Å; I17-W75 HydrophobicContact CG1-CG 4.13Å; I17-F82 HydrophobicContact CB-CD1 4.49Å; I17-F82 HydrophobicContact CB-CE1 4.31Å; I17-F82 HydrophobicContact CG1-CD1 3.79Å; I17-F82 HydrophobicContact CG1-CE1 3.81Å; I17-F82 HydrophobicContact CG1-CG 4.46Å
18L93.4Very high91.5Very high0 Ų051.8 Ų51.80%025%0.246CC..Hα-helixtrans-65-35.7176-66.9175000112L14 A21 N22 L23 L24 Y27 F30 L68L14-L18 HydrophobicContact CD1-CD1 4.32Å; L14-L18 HydrophobicContact CD1-CG 4.49Å; L14-L18 HydrophobicContact CD2-CD1 4.11Å; L14-L18 HydrophobicContact CG-CD1 3.88Å; L14-L18 HydrophobicContact CG-CG 4.32Å; L14-L18 WeakPolarHBondContact O-CG 3.46Å; L14-L18 PolarHBondContact O-N 2.98Å; L18-A21 PolarHBondContact O-N 2.85Å; L18-N22 PolarHBondContact O-N 2.92Å; L18-N22 VanDerWaalsContact O-N 3.1Å; L18-L23 HydrophobicContact CB-CB 4.45Å; L18-L23 HydrophobicContact CD2-CB 3.74Å; L18-L23 HydrophobicContact CD2-CD1 4.47Å; L18-L23 PolarHBondContact O-N 3.25Å; L18-L24 HydrophobicContact CB-CD2 4.19Å; L18-Y27 HydrophobicContact CD1-CD2 4.19Å; L18-F30 HydrophobicContact CD1-CD2 3.81Å; L18-F30 HydrophobicContact CD1-CE2 4.26Å; L18-F30 HydrophobicContact CD2-CD2 4.34Å; L18-F30 HydrophobicContact CD2-CE2 3.95Å; L18-L68 HydrophobicContact CD2-CD1 3.93Å
19Q91.8Very high91.8Very high53 Ų5350.2 Ų50.225%0.24824%0.239CC..Hα-helixtrans-61.7-50172.7-174.5166.956.500111.5Y15 R16 I17 A21 N22 L24 L86Y15-Q19 WeakPolarHBondContact O-CB 3.45Å; Y15-Q19 PolarHBondContact O-N 3.06Å; R16-Q19 PolarHBondContact O-N 3.39Å; I17-Q19 VanDerWaalsContact C-N 3.33Å; I17-Q19 PolarHBondContact O-N 2.95Å; Q19-A21 VanDerWaalsContact C-N 3.31Å; Q19-A21 PolarHBondContact O-N 2.79Å; Q19-N22 PolarHBondContact O-N 3.46Å; Q19-N22 VanDerWaalsContact O-N 3.14Å; Q19-L24 HydrophobicContact CB-CD1 3.89Å; Q19-L24 HydrophobicContact CB-CD2 4.15Å; Q19-L24 HydrophobicContact CB-CG 4.05Å; Q19-L24 HydrophobicContact CG-CD1 3.95Å; Q19-L86 HydrophobicContact CG-CD1 3.73Å
20R87.7Confident92.2Very high92 Ų9244.5 Ų44.535%0.34721%0.209SC..Hα-helixtrans-68.4-28.6179.1-158.7178.4-174.191.43.9112.9R16 I17 N22 I81 F82R16-R20 WeakPolarHBondContact O-CB 3.39Å; R16-R20 PolarHBondContact O-N 3.36Å; I17-R20 PolarHBondContact O-N 3.42Å; R20-N22 VanDerWaalsContact C-N 3.32Å; R20-I81 PolarHBondContact NH1-O 2.76Å; R20-F82 HydrophobicContact CB-CD1 4.18Å; R20-F82 HydrophobicContact CB-CE1 3.78Å; R20-F82 HydrophobicContact CG-CE1 4.17Å
21A92.7Very high92.5Very high11 Ų1146 Ų469%0.09121%0.213CC..Hα-helixtrans-78.5-11.4173.700000114.1I17 L18 Q19 L23 R67 A71I17-A21 VanDerWaalsContact O-CB 3.3Å; I17-A21 WeakPolarHBondContact O-CB 3.46Å; I17-A21 PolarHBondContact O-N 3.06Å; L18-A21 PolarHBondContact O-N 2.85Å; Q19-A21 VanDerWaalsContact C-N 3.31Å; Q19-A21 PolarHBondContact O-N 2.79Å; A21-L23 HydrophobicContact CB-CB 4.2Å; A21-L23 HydrophobicContact CB-CD1 3.75Å; A21-L23 HydrophobicContact CB-CG 3.87Å; A21-R67 PolarHBondContact O-NH1 3.45Å; A21-A71 HydrophobicContact CB-CB 3.86Å
22N93.1Very high92.5Very high96 Ų9653.1 Ų53.151%0.51325%0.246SC..THydrogen-bonded Turntrans55.150.9-165.6-17116.5000112.8L18 Q19 R20 R67L18-N22 PolarHBondContact O-N 2.92Å; L18-N22 VanDerWaalsContact O-N 3.1Å; Q19-N22 PolarHBondContact O-N 3.46Å; Q19-N22 VanDerWaalsContact O-N 3.14Å; R20-N22 VanDerWaalsContact C-N 3.32Å; N22-R67 PolarHBondContact O-NH1 3.13Å
23L95.1Very high92.6Very high3 Ų354.7 Ų54.72%0.01625%0.251CS..  trans-127.315.3-178.1-67.3177.2000113L18 A21 Y25 Y26 M58 H64 R67 L68L18-L23 HydrophobicContact CB-CB 4.45Å; L18-L23 HydrophobicContact CD2-CB 3.74Å; L18-L23 HydrophobicContact CD2-CD1 4.47Å; L18-L23 PolarHBondContact O-N 3.25Å; A21-L23 HydrophobicContact CB-CB 4.2Å; A21-L23 HydrophobicContact CB-CD1 3.75Å; A21-L23 HydrophobicContact CB-CG 3.87Å; L23-Y25 PolarHBondContact O-N 2.91Å; L23-Y26 HydrophobicContact CB-CD2 4.33Å; L23-Y26 HydrophobicContact CD2-CD2 4.26Å; L23-Y26 HydrophobicContact CD2-CE2 4.25Å; L23-Y26 WeakPolarHBondContact O-CB 3.44Å; L23-Y26 WeakPolarHBondContact O-CD2 3.5Å; L23-Y26 PolarHBondContact O-N 3.44Å; L23-M58 HydrophobicContact CD1-CE 4.35Å; L23-M58 HydrophobicContact CD1-SD 4.35Å; L23-H64 HydrophobicContact CD2-CB 3.81Å; L23-R67 HydrophobicContact CD1-CB 4.11Å; L23-L68 HydrophobicContact CD1-CB 3.79Å
24L93Very high92.5Very high57 Ų5754.1 Ų54.130%0.29826%0.261SS..G310 helixtrans-54.4-23.1-178.3-81172.4000115.2Y15 L18 Q19 Y26 Y27Y15-L24 HydrophobicContact CD1-CD2 4.38Å; Y15-L24 HydrophobicContact CD2-CD2 3.68Å; Y15-L24 HydrophobicContact CE1-CD2 4.28Å; Y15-L24 HydrophobicContact CE2-CD2 3.58Å; Y15-L24 HydrophobicContact CG-CD2 4.08Å; L18-L24 HydrophobicContact CB-CD2 4.19Å; Q19-L24 HydrophobicContact CB-CD1 3.89Å; Q19-L24 HydrophobicContact CB-CD2 4.15Å; Q19-L24 HydrophobicContact CB-CG 4.05Å; Q19-L24 HydrophobicContact CG-CD1 3.95Å; L24-Y26 PolarHBondContact O-N 3.14Å; L24-Y26 VanDerWaalsContact O-N 3.12Å; L24-Y27 VanDerWaalsContact O-CB 3.24Å; L24-Y27 WeakPolarHBondContact O-CB 3.33Å; L24-Y27 PolarHBondContact O-N 3.35Å
25Y93.2Very high92.4Very high200 Ų20054.9 Ų54.978%0.78427%0.269SS*.G310 helixtrans-54.4-26.9171.4-177.7-95.3000113.4L23L23-Y25 PolarHBondContact O-N 2.91Å
26Y94.2Very high92.2Very high10 Ų1054.9 Ų54.94%0.03927%0.272CS..G310 helixtrans-88.6-8178.9-67.3-85.7000113.9L23 L24 E28 A29 F30 V56 M58 H64L23-Y26 HydrophobicContact CB-CD2 4.33Å; L23-Y26 HydrophobicContact CD2-CD2 4.26Å; L23-Y26 HydrophobicContact CD2-CE2 4.25Å; L23-Y26 WeakPolarHBondContact O-CB 3.44Å; L23-Y26 WeakPolarHBondContact O-CD2 3.5Å; L23-Y26 PolarHBondContact O-N 3.44Å; L24-Y26 PolarHBondContact O-N 3.14Å; L24-Y26 VanDerWaalsContact O-N 3.12Å; Y26-E28 PolarHBondContact O-N 3.06Å; Y26-A29 WeakPolarHBondContact O-CB 3.37Å; Y26-A29 PolarHBondContact O-N 3.43Å; Y26-A29 VanDerWaalsContact O-N 3.07Å; Y26-F30 VanDerWaalsContact O-CD2 3.31Å; Y26-F30 WeakPolarHBondContact O-CD2 3.43Å; Y26-F30 PolarHBondContact O-N 3.35Å; Y26-V56 VanDerWaalsContact CD1-O 3.26Å; Y26-V56 WeakPolarHBondContact CD1-O 3.32Å; Y26-V56 WeakPolarHBondContact CE1-O 3.46Å; Y26-M58 HydrophobicContact CD1-CB 4.36Å; Y26-M58 HydrophobicContact CD1-CE 3.91Å; Y26-M58 HydrophobicContact CD2-CE 3.93Å; Y26-M58 HydrophobicContact CE1-CB 3.98Å; Y26-M58 HydrophobicContact CE1-CE 4.35Å; Y26-M58 HydrophobicContact CE1-CG 4.3Å; Y26-M58 HydrophobicContact CE2-CE 4.39Å; Y26-M58 HydrophobicContact CG-CE 3.67Å; Y26-H64 AromaticContact CE2-ND1 3.32Å; Y26-H64 VanDerWaalsContact CE2-ND1 3.32Å; Y26-H64 WeakPolarHBondContact CE2-ND1 3.42Å; Y26-H64 AromaticContact CZ-ND1 3.58Å; Y26-H64 PolarHBondContact OH-ND1 2.98Å; Y26-H64 VanDerWaalsContact OH-ND1 3.11Å
27Y93.5Very high92.2Very high7 Ų755 Ų553%0.02728%0.278CS..Hα-helixtrans-55.6-53-172.7175.9-106000112V4 P6 E11 L14 Y15 L18 L24 A29 F30 I31V4-Y27 HydrophobicContact CB-CE1 4.32Å; V4-Y27 WeakPolarHBondContact O-CE1 3.45Å; P6-Y27 WeakPolarHBondContact CA-OH 3.29Å; E11-Y27 WeakPolarHBondContact CB-OH 3.35Å; E11-Y27 PolarHBondContact OE2-OH 2.88Å; L14-Y27 HydrophobicContact CD2-CD2 4.14Å; L14-Y27 HydrophobicContact CD2-CE2 4.27Å; Y15-Y27 HydrophobicContact CD2-CD1 4.25Å; Y15-Y27 AromaticContact CD2-CD2 4Å; Y15-Y27 HydrophobicContact CD2-CD2 4Å; Y15-Y27 HydrophobicContact CD2-CE1 4.22Å; Y15-Y27 AromaticContact CD2-CE2 3.96Å; Y15-Y27 HydrophobicContact CD2-CE2 3.96Å; Y15-Y27 HydrophobicContact CD2-CG 4.14Å; Y15-Y27 HydrophobicContact CG-CE2 4.35Å; L18-Y27 HydrophobicContact CD1-CD2 4.19Å; L24-Y27 VanDerWaalsContact O-CB 3.24Å; L24-Y27 WeakPolarHBondContact O-CB 3.33Å; L24-Y27 PolarHBondContact O-N 3.35Å; Y27-A29 PolarHBondContact O-N 2.89Å; Y27-F30 PolarHBondContact O-N 3.39Å; Y27-F30 VanDerWaalsContact O-N 3.13Å; Y27-I31 HydrophobicContact CD1-CG1 4.46Å; Y27-I31 HydrophobicContact CD2-CD1 4.43Å; Y27-I31 HydrophobicContact CD2-CG1 4.19Å; Y27-I31 HydrophobicContact CE1-CG1 4.03Å; Y27-I31 HydrophobicContact CE2-CD1 3.85Å; Y27-I31 HydrophobicContact CE2-CG1 3.74Å; Y27-I31 WeakPolarHBondContact O-CG1 3.43Å; Y27-I31 PolarHBondContact O-N 3.32Å
28E92.4Very high92.1Very high85 Ų8555 Ų5540%0.39728%0.279SS..Hα-helixtrans-59.6-34.5178.7-66.6173.4-171.800112.2V4 Y26 Q32V4-E28 HydrophobicContact CG2-CG 4.2Å; Y26-E28 PolarHBondContact O-N 3.06Å; E28-Q32 VanDerWaalsContact O-CB 3.26Å; E28-Q32 WeakPolarHBondContact O-CB 3.17Å; E28-Q32 PolarHBondContact O-N 3.2Å
29A93.6Very high91.9Very high30 Ų3060.3 Ų60.325%0.24830%0.303CS..Hα-helixtrans-72.2-34.4177.300000113.3Y26 Y27 Q33 V56Y26-A29 WeakPolarHBondContact O-CB 3.37Å; Y26-A29 PolarHBondContact O-N 3.43Å; Y26-A29 VanDerWaalsContact O-N 3.07Å; Y27-A29 PolarHBondContact O-N 2.89Å; A29-Q33 VanDerWaalsContact O-CG 3.25Å; A29-Q33 WeakPolarHBondContact O-CG 3.24Å; A29-Q33 PolarHBondContact O-N 2.86Å; A29-V56 HydrophobicContact CB-CB 4.24Å
30F94.2Very high91.9Very high1 Ų163.8 Ų63.80%0.00432%0.32CS..Hα-helixtrans-68.2-47.4171-81.9-78.9000111.3L14 L18 Y26 Y27 Q32 Q33 G34 G35 L41 I52 M53 V56 M58 L68L14-F30 HydrophobicContact CD2-CB 3.6Å; L14-F30 HydrophobicContact CD2-CG 4.2Å; L18-F30 HydrophobicContact CD1-CD2 3.81Å; L18-F30 HydrophobicContact CD1-CE2 4.26Å; L18-F30 HydrophobicContact CD2-CD2 4.34Å; L18-F30 HydrophobicContact CD2-CE2 3.95Å; Y26-F30 VanDerWaalsContact O-CD2 3.31Å; Y26-F30 WeakPolarHBondContact O-CD2 3.43Å; Y26-F30 PolarHBondContact O-N 3.35Å; Y27-F30 PolarHBondContact O-N 3.39Å; Y27-F30 VanDerWaalsContact O-N 3.13Å; F30-Q32 VanDerWaalsContact C-N 3.31Å; F30-Q32 PolarHBondContact O-N 2.99Å; F30-Q33 CarbonylContact O-C 3.54Å; F30-Q33 PolarHBondContact O-N 3.07Å; F30-G34 PolarHBondContact O-N 2.84Å; F30-G35 PolarHBondContact O-N 2.93Å; F30-L41 HydrophobicContact CD1-CD1 4.24Å; F30-L41 HydrophobicContact CE1-CD1 4.28Å; F30-L41 HydrophobicContact CE1-CD2 4.07Å; F30-I52 HydrophobicContact CE1-CG2 4.13Å; F30-M53 HydrophobicContact CE1-CE 4.07Å; F30-M53 HydrophobicContact CZ-CE 3.93Å; F30-V56 HydrophobicContact CD1-CG1 3.85Å; F30-V56 HydrophobicContact CD2-CG1 4.47Å; F30-V56 HydrophobicContact CE1-CG1 3.99Å; F30-V56 HydrophobicContact CE1-CG2 4.13Å; F30-V56 HydrophobicContact CE2-CG2 4.08Å; F30-V56 HydrophobicContact CG-CG1 4.09Å; F30-V56 HydrophobicContact CZ-CB 4.48Å; F30-V56 HydrophobicContact CZ-CG1 4.37Å; F30-V56 HydrophobicContact CZ-CG2 3.78Å; F30-M58 HydrophobicContact CE2-CE 3.7Å; F30-M58 HydrophobicContact CZ-CE 3.9Å; F30-L68 HydrophobicContact CE1-CD2 4.49Å; F30-L68 HydrophobicContact CE2-CD2 4.47Å; F30-L68 HydrophobicContact CZ-CD2 3.69Å
31I93.5Very high92.1Very high47 Ų4759.9 Ų59.924%0.24131%0.305CS..Hα-helixtrans-64.1-37.5-178.7-56.6-41.7000111.3E11 L14 Y27 Q33 G34 D36E11-I31 HydrophobicContact CB-CD1 4.46Å; E11-I31 HydrophobicContact CG-CD1 3.71Å; E11-I31 HydrophobicContact CG-CG1 4.25Å; E11-I31 HydrophobicContact CG-CG2 4.47Å; L14-I31 HydrophobicContact CD2-CD1 3.55Å; Y27-I31 HydrophobicContact CD1-CG1 4.46Å; Y27-I31 HydrophobicContact CD2-CD1 4.43Å; Y27-I31 HydrophobicContact CD2-CG1 4.19Å; Y27-I31 HydrophobicContact CE1-CG1 4.03Å; Y27-I31 HydrophobicContact CE2-CD1 3.85Å; Y27-I31 HydrophobicContact CE2-CG1 3.74Å; Y27-I31 WeakPolarHBondContact O-CG1 3.43Å; Y27-I31 PolarHBondContact O-N 3.32Å; I31-Q33 PolarHBondContact O-N 3.18Å; I31-G34 PolarHBondContact O-N 3.21Å; I31-G34 VanDerWaalsContact O-N 3.17Å; I31-D36 HydrophobicContact CD1-CB 3.85Å
32Q92.5Very high92Very high165 Ų16561.6 Ų61.677%0.77132%0.316SS*.Hα-helixtrans-63.1-25.8174.9-173.7171.420.400113.5E28 F30E28-Q32 VanDerWaalsContact O-CB 3.26Å; E28-Q32 WeakPolarHBondContact O-CB 3.17Å; E28-Q32 PolarHBondContact O-N 3.2Å; F30-Q32 VanDerWaalsContact C-N 3.31Å; F30-Q32 PolarHBondContact O-N 2.99Å
33Q90.7Very high91.9Very high107 Ų10763.6 Ų63.650%0.532%0.323SS..THydrogen-bonded Turntrans-98.39.6178.2-59-68-0.400113A29 F30 I31 G35 V56A29-Q33 VanDerWaalsContact O-CG 3.25Å; A29-Q33 WeakPolarHBondContact O-CG 3.24Å; A29-Q33 PolarHBondContact O-N 2.86Å; F30-Q33 CarbonylContact O-C 3.54Å; F30-Q33 PolarHBondContact O-N 3.07Å; I31-Q33 PolarHBondContact O-N 3.18Å; Q33-G35 VanDerWaalsContact C-N 3.26Å; Q33-G35 PolarHBondContact O-N 2.93Å; Q33-V56 HydrophobicContact CG-CG1 4.37Å
34G89.5Confident91.8Very high46 Ų4664.7 Ų64.747%0.47433%0.332SS..THydrogen-bonded Turntrans70.717.3-177.400000114.6F30 I31 D36F30-G34 PolarHBondContact O-N 2.84Å; I31-G34 PolarHBondContact O-N 3.21Å; I31-G34 VanDerWaalsContact O-N 3.17Å; G34-D36 PolarHBondContact O-N 3.35Å
35G89.7Confident91.7Very high15 Ų1563.6 Ų63.616%0.15534%0.335CS..THydrogen-bonded Turntrans-81.238.6-179.200000114.3L14 F30 Q33 L41L14-G35 WeakPolarHBondContact CD2-O 3.39Å; F30-G35 PolarHBondContact O-N 2.93Å; Q33-G35 VanDerWaalsContact C-N 3.26Å; Q33-G35 PolarHBondContact O-N 2.93Å; G35-L41 WeakPolarHBondContact O-CD1 3.31Å
36D89.8Confident91.5Very high50 Ų5062 Ų6227%0.26733%0.334SS..THydrogen-bonded Turntrans-88.7-14.8177.381.1-58.9000113.6T8 G10 E11 I31 G34 V38T8-D36 PolarHBondContact OG1-OD2 2.93Å; G10-D36 CarbonylContact C-O 3.13Å; G10-D36 WeakPolarHBondContact CA-O 3.27Å; E11-D36 HydrophobicContact CG-CB 4.03Å; I31-D36 HydrophobicContact CD1-CB 3.85Å; G34-D36 PolarHBondContact O-N 3.35Å; D36-V38 PolarHBondContact O-N 3.15Å
37D90.7Very high91.4Very high79 Ų7969.7 Ų69.742%0.42237%0.371SS..  trans-75.9103.7166.7-164.4-41.1000111.4Q39 Q40 L41D37-Q39 VanDerWaalsContact C-N 3.35Å; D37-Q39 WeakPolarHBondContact OD1-CA 3.46Å; D37-Q39 WeakPolarHBondContact OD1-CB 3.16Å; D37-Q39 PolarHBondContact OD1-N 3.4Å; D37-Q40 HydrophobicContact CB-CB 3.99Å; D37-Q40 PolarHBondContact OD1-N 3.25Å; D37-L41 PolarHBondContact O-N 3.06Å
38V90.1Very high91.4Very high1 Ų174.9 Ų74.91%0.00640%0.395CS..THydrogen-bonded Turntrans-70-30.2177.3176.80000112.4Q13 L14 I17 D36 L41 C42 L72 W75Q13-V38 HydrophobicContact CB-CG2 3.79Å; L14-V38 HydrophobicContact CB-CG2 3.99Å; I17-V38 HydrophobicContact CD1-CB 4.32Å; I17-V38 HydrophobicContact CD1-CG1 3.32Å; I17-V38 HydrophobicContact CD1-CG2 3.98Å; D36-V38 PolarHBondContact O-N 3.15Å; V38-L41 PolarHBondContact O-N 3.35Å; V38-C42 PolarHBondContact O-N 2.91Å; V38-C42 VanDerWaalsContact O-N 3.15Å; V38-C42 PolarHBondContact O-SG 3.39Å; V38-C42 VanDerWaalsContact O-SG 3.35Å; V38-L72 HydrophobicContact CG1-CD2 4.25Å; V38-W75 HydrophobicContact CB-CH2 4.15Å; V38-W75 HydrophobicContact CB-CZ2 4.31Å; V38-W75 HydrophobicContact CB-CZ3 4.46Å; V38-W75 HydrophobicContact CG1-CD2 3.82Å; V38-W75 HydrophobicContact CG1-CE3 3.65Å; V38-W75 HydrophobicContact CG1-CH2 3.67Å; V38-W75 HydrophobicContact CG1-CZ2 3.82Å; V38-W75 HydrophobicContact CG1-CZ3 3.59Å
39Q88.7Confident91.4Very high111 Ų11171.8 Ų71.852%0.51938%0.38SS..THydrogen-bonded Turntrans-71.5-44.5179.3-178.1173.3-18.700110.3D37 L41 C42 E43D37-Q39 VanDerWaalsContact C-N 3.35Å; D37-Q39 WeakPolarHBondContact OD1-CA 3.46Å; D37-Q39 WeakPolarHBondContact OD1-CB 3.16Å; D37-Q39 PolarHBondContact OD1-N 3.4Å; Q39-L41 VanDerWaalsContact C-N 3.28Å; Q39-L41 PolarHBondContact O-N 2.92Å; Q39-C42 CarbonylContact O-C 3.59Å; Q39-C42 WeakPolarHBondContact O-CA 3.18Å; Q39-C42 WeakPolarHBondContact O-CB 3.37Å; Q39-C42 PolarHBondContact O-N 3.13Å; Q39-E43 HydrophobicContact CG-CG 4.38Å; Q39-E43 VanDerWaalsContact CG-OE1 3.27Å; Q39-E43 WeakPolarHBondContact CG-OE1 3.23Å; Q39-E43 PolarHBondContact NE2-OE1 2.8Å; Q39-E43 PolarHBondContact O-N 3.4Å
40Q91.8Very high91.3Very high127 Ų12774.7 Ų74.759%0.59339%0.391SS*.Hα-helixtrans-57.6-42.2171.9-168.3-178.89.300111.4D37 C42 E43 A44D37-Q40 HydrophobicContact CB-CB 3.99Å; D37-Q40 PolarHBondContact OD1-N 3.25Å; Q40-C42 PolarHBondContact O-N 3Å; Q40-E43 PolarHBondContact O-N 2.97Å; Q40-A44 WeakPolarHBondContact O-CB 3.44Å; Q40-A44 PolarHBondContact O-N 3.07Å
41L91.9Very high91.3Very high9 Ų980.9 Ų80.95%0.04742%0.42CS..Hα-helixtrans-63.5-16.5173.2-92.8164.5000115L14 F30 G35 D37 V38 Q39 I52L14-L41 HydrophobicContact CD1-CD1 3.75Å; F30-L41 HydrophobicContact CD1-CD1 4.24Å; F30-L41 HydrophobicContact CE1-CD1 4.28Å; F30-L41 HydrophobicContact CE1-CD2 4.07Å; G35-L41 WeakPolarHBondContact O-CD1 3.31Å; D37-L41 PolarHBondContact O-N 3.06Å; V38-L41 PolarHBondContact O-N 3.35Å; Q39-L41 VanDerWaalsContact C-N 3.28Å; Q39-L41 PolarHBondContact O-N 2.92Å; L41-I52 HydrophobicContact CD2-CG2 4.11Å
42C91.7Very high91.3Very high47 Ų4780.9 Ų80.932%0.31842%0.42SS..Hα-helixtrans-98.1-26.1174.6-74.10000113.7V38 Q39 Q40 V76V38-C42 PolarHBondContact O-N 2.91Å; V38-C42 VanDerWaalsContact O-N 3.15Å; V38-C42 PolarHBondContact O-SG 3.39Å; V38-C42 VanDerWaalsContact O-SG 3.35Å; Q39-C42 CarbonylContact O-C 3.59Å; Q39-C42 WeakPolarHBondContact O-CA 3.18Å; Q39-C42 WeakPolarHBondContact O-CB 3.37Å; Q39-C42 PolarHBondContact O-N 3.13Å; Q40-C42 PolarHBondContact O-N 3Å; C42-V76 HydrophobicContact CB-CG2 3.98Å; C42-V76 VanDerWaalsContact SG-CG2 3.55Å
43E91.2Very high91.4Very high139 Ų13973 Ų7365%0.6538%0.384SS*.Hα-helixtrans-92.7-19.2-178.6-69.6178-171.200113.2Q39 Q40Q39-E43 HydrophobicContact CG-CG 4.38Å; Q39-E43 VanDerWaalsContact CG-OE1 3.27Å; Q39-E43 WeakPolarHBondContact CG-OE1 3.23Å; Q39-E43 PolarHBondContact NE2-OE1 2.8Å; Q39-E43 PolarHBondContact O-N 3.4Å; Q40-E43 PolarHBondContact O-N 2.97Å
44A92.2Very high91.5Very high25 Ų2570.8 Ų70.821%0.20738%0.384CS..  trans-52.9136.2177.900000113.9Q40 E48 F49 I52Q40-A44 WeakPolarHBondContact O-CB 3.44Å; Q40-A44 PolarHBondContact O-N 3.07Å; A44-E48 WeakPolarHBondContact CA-OE2 3.32Å; A44-E48 HydrophobicContact CB-CB 4.2Å; A44-F49 HydrophobicContact CB-CB 4.43Å; A44-I52 HydrophobicContact CB-CD1 4.48Å
45G90.1Very high91.7Very high35 Ų3573.3 Ų73.336%0.36139%0.385SS..  trans-67.6171.1175.300000113.4E47 E48 F49G45-E47 VanDerWaalsContact C-N 3.34Å; G45-E47 PolarHBondContact O-N 2.99Å; G45-E48 PolarHBondContact N-OE2 2.93Å; G45-E48 PolarHBondContact O-N 3.04Å; G45-F49 WeakPolarHBondContact O-CB 3.43Å; G45-F49 PolarHBondContact O-N 3.23Å
46E90.2Very high91.9Very high166 Ų16673 Ų7378%0.77638%0.38SS*.Hα-helixtrans-62.4-38.9-176.3-175.9161.5-15400112.7L50E46-L50 HydrophobicContact CG-CD1 4.13Å; E46-L50 WeakPolarHBondContact O-CB 3.42Å; E46-L50 WeakPolarHBondContact O-CD1 3.2Å; E46-L50 WeakPolarHBondContact O-CG 3.44Å; E46-L50 PolarHBondContact O-N 3Å
47E91.8Very high92Very high171 Ų17172.3 Ų72.380%0.79939%0.386SS*.Hα-helixtrans-70.2-49.1177.4-61-169.515500111.9G45 F49 L50 E51G45-E47 VanDerWaalsContact C-N 3.34Å; G45-E47 PolarHBondContact O-N 2.99Å; E47-F49 VanDerWaalsContact C-N 3.35Å; E47-F49 PolarHBondContact O-N 3.32Å; E47-L50 PolarHBondContact O-N 3.49Å; E47-L50 VanDerWaalsContact O-N 3.14Å; E47-E51 PolarHBondContact O-N 2.84Å
48E92.5Very high92.2Very high116 Ų11668.6 Ų68.654%0.54237%0.366SS..Hα-helixtrans-58.2-45.2176.6-59.9174.3141.300111.5A44 G45 L50 E51 I52A44-E48 WeakPolarHBondContact CA-OE2 3.32Å; A44-E48 HydrophobicContact CB-CB 4.2Å; G45-E48 PolarHBondContact N-OE2 2.93Å; G45-E48 PolarHBondContact O-N 3.04Å; E48-L50 VanDerWaalsContact C-N 3.33Å; E48-L50 PolarHBondContact O-N 3.49Å; E48-E51 PolarHBondContact O-N 2.92Å; E48-I52 VanDerWaalsContact O-CG1 3.28Å; E48-I52 WeakPolarHBondContact O-CG1 3.49Å; E48-I52 PolarHBondContact O-N 2.88Å
49F92.9Very high92.3Very high20 Ų2070.7 Ų70.79%0.08838%0.383CS..Hα-helixtrans-64.1-38.4177.4-176.5-94.2000111.6A44 G45 E47 M53 V65 L68 Q69 L72A44-F49 HydrophobicContact CB-CB 4.43Å; G45-F49 WeakPolarHBondContact O-CB 3.43Å; G45-F49 PolarHBondContact O-N 3.23Å; E47-F49 VanDerWaalsContact C-N 3.35Å; E47-F49 PolarHBondContact O-N 3.32Å; F49-M53 HydrophobicContact CD1-CG 4.02Å; F49-M53 HydrophobicContact CD2-CE 4.44Å; F49-M53 HydrophobicContact CE1-CE 4.47Å; F49-M53 HydrophobicContact CE1-CG 3.67Å; F49-M53 HydrophobicContact CE1-SD 4.17Å; F49-M53 HydrophobicContact CE2-CE 3.93Å; F49-M53 HydrophobicContact CZ-CE 3.94Å; F49-M53 HydrophobicContact CZ-CG 4.03Å; F49-M53 HydrophobicContact CZ-SD 3.93Å; F49-M53 WeakPolarHBondContact O-CB 3.4Å; F49-M53 VanDerWaalsContact O-CG 3.23Å; F49-M53 WeakPolarHBondContact O-CG 3.33Å; F49-M53 PolarHBondContact O-N 3.45Å; F49-V65 HydrophobicContact CE1-CG1 3.7Å; F49-V65 HydrophobicContact CZ-CG1 4.32Å; F49-L68 HydrophobicContact CZ-CD2 4.4Å; F49-Q69 HydrophobicContact CE1-CG 3.76Å; F49-Q69 HydrophobicContact CZ-CG 3.63Å; F49-L72 HydrophobicContact CE2-CD1 4.1Å
50L92.1Very high92.4Very high92 Ų9270 Ų7048%0.48239%0.391SS..Hα-helixtrans-67.4-37.2174.6-75.9169.7000112.5E46 E47 E48 M53 A54E46-L50 HydrophobicContact CG-CD1 4.13Å; E46-L50 WeakPolarHBondContact O-CB 3.42Å; E46-L50 WeakPolarHBondContact O-CD1 3.2Å; E46-L50 WeakPolarHBondContact O-CG 3.44Å; E46-L50 PolarHBondContact O-N 3Å; E47-L50 PolarHBondContact O-N 3.49Å; E47-L50 VanDerWaalsContact O-N 3.14Å; E48-L50 VanDerWaalsContact C-N 3.33Å; E48-L50 PolarHBondContact O-N 3.49Å; L50-M53 PolarHBondContact O-N 3.36Å; L50-A54 WeakPolarHBondContact O-CB 3.11Å; L50-A54 PolarHBondContact O-N 2.85Å
51E93.9Very high92.5Very high130 Ų13068.5 Ų68.561%0.60738%0.382SS*.Hα-helixtrans-63.4-49172.9-178170-159.400111.4E47 E48 M53 A54 L55E47-E51 PolarHBondContact O-N 2.84Å; E48-E51 PolarHBondContact O-N 2.92Å; E51-M53 VanDerWaalsContact C-N 3.29Å; E51-M53 PolarHBondContact O-N 3.49Å; E51-A54 WeakPolarHBondContact O-CA 3.48Å; E51-A54 WeakPolarHBondContact O-CB 3.33Å; E51-A54 PolarHBondContact O-N 3.11Å; E51-L55 HydrophobicContact CG-CD1 4.04Å; E51-L55 HydrophobicContact CG-CG 4.45Å; E51-L55 WeakPolarHBondContact O-CG 3.46Å; E51-L55 PolarHBondContact O-N 3.2Å
52I93.3Very high92.5Very high48 Ų4872.3 Ų72.325%0.24641%0.408CS..Hα-helixtrans-58.2-43.5174.9-62.5161.5000110.3F30 L41 A44 E48 A54 L55 V56F30-I52 HydrophobicContact CE1-CG2 4.13Å; L41-I52 HydrophobicContact CD2-CG2 4.11Å; A44-I52 HydrophobicContact CB-CD1 4.48Å; E48-I52 VanDerWaalsContact O-CG1 3.28Å; E48-I52 WeakPolarHBondContact O-CG1 3.49Å; E48-I52 PolarHBondContact O-N 2.88Å; I52-A54 VanDerWaalsContact C-N 3.27Å; I52-A54 PolarHBondContact O-N 3.44Å; I52-L55 PolarHBondContact O-N 3.42Å; I52-V56 WeakPolarHBondContact O-CG2 2.99Å; I52-V56 PolarHBondContact O-N 2.98Å
53M94.4Very high92.7Very high0 Ų076.5 Ų76.50%043%0.426CS..Hα-helixtrans-63.1-31.4175.4-71.8-49.494.700112.8F30 F49 L50 E51 G57 M58 A59 V65 L68F30-M53 HydrophobicContact CE1-CE 4.07Å; F30-M53 HydrophobicContact CZ-CE 3.93Å; F49-M53 HydrophobicContact CD1-CG 4.02Å; F49-M53 HydrophobicContact CD2-CE 4.44Å; F49-M53 HydrophobicContact CE1-CE 4.47Å; F49-M53 HydrophobicContact CE1-CG 3.67Å; F49-M53 HydrophobicContact CE1-SD 4.17Å; F49-M53 HydrophobicContact CE2-CE 3.93Å; F49-M53 HydrophobicContact CZ-CE 3.94Å; F49-M53 HydrophobicContact CZ-CG 4.03Å; F49-M53 HydrophobicContact CZ-SD 3.93Å; F49-M53 WeakPolarHBondContact O-CB 3.4Å; F49-M53 VanDerWaalsContact O-CG 3.23Å; F49-M53 WeakPolarHBondContact O-CG 3.33Å; F49-M53 PolarHBondContact O-N 3.45Å; L50-M53 PolarHBondContact O-N 3.36Å; E51-M53 VanDerWaalsContact C-N 3.29Å; E51-M53 PolarHBondContact O-N 3.49Å; M53-G57 PolarHBondContact O-N 2.92Å; M53-M58 CarbonylContact O-C 3.57Å; M53-M58 WeakPolarHBondContact O-CA 3.45Å; M53-M58 PolarHBondContact O-N 3.15Å; M53-M58 HydrophobicContact SD-CB 3.99Å; M53-M58 HydrophobicContact SD-CE 4.39Å; M53-M58 HydrophobicContact SD-CG 4.21Å; M53-M58 HydrophobicContact SD-SD 3.71Å; M53-A59 HydrophobicContact CB-CB 4.15Å; M53-A59 PolarHBondContact O-N 2.82Å; M53-V65 HydrophobicContact CB-CG2 4.45Å; M53-V65 HydrophobicContact CG-CG1 4.03Å; M53-V65 HydrophobicContact CG-CG2 4.06Å; M53-V65 HydrophobicContact SD-CG1 4.36Å; M53-V65 HydrophobicContact SD-CG2 4.22Å; M53-L68 HydrophobicContact CE-CD2 3.61Å; M53-L68 HydrophobicContact SD-CD2 3.75Å
54A93.6Very high92.9Very high60 Ų6072 Ų7250%0.49641%0.405SS..Hα-helixtrans-72-48.217500000111.2L50 E51 I52 V56 G57 A59L50-A54 WeakPolarHBondContact O-CB 3.11Å; L50-A54 PolarHBondContact O-N 2.85Å; E51-A54 WeakPolarHBondContact O-CA 3.48Å; E51-A54 WeakPolarHBondContact O-CB 3.33Å; E51-A54 PolarHBondContact O-N 3.11Å; I52-A54 VanDerWaalsContact C-N 3.27Å; I52-A54 PolarHBondContact O-N 3.44Å; A54-V56 PolarHBondContact O-N 3.12Å; A54-G57 PolarHBondContact O-N 2.86Å; A54-A59 HydrophobicContact CB-CB 4.24Å
55L94.2Very high93Very high98 Ų9871.5 Ų71.551%0.51340%0.399SS..Hα-helixtrans-58.9-40.8179.9-71.5169.1000113E51 I52 G57E51-L55 HydrophobicContact CG-CD1 4.04Å; E51-L55 HydrophobicContact CG-CG 4.45Å; E51-L55 WeakPolarHBondContact O-CG 3.46Å; E51-L55 PolarHBondContact O-N 3.2Å; I52-L55 PolarHBondContact O-N 3.42Å; L55-G57 VanDerWaalsContact C-N 3.27Å; L55-G57 PolarHBondContact O-N 2.87Å
56V93.6Very high93.2Very high8 Ų878.1 Ų78.15%0.04841%0.414CS..THydrogen-bonded Turntrans-84.55.8176-50.80000113.7Y26 A29 F30 Q33 I52 A54 M58Y26-V56 VanDerWaalsContact CD1-O 3.26Å; Y26-V56 WeakPolarHBondContact CD1-O 3.32Å; Y26-V56 WeakPolarHBondContact CE1-O 3.46Å; A29-V56 HydrophobicContact CB-CB 4.24Å; F30-V56 HydrophobicContact CD1-CG1 3.85Å; F30-V56 HydrophobicContact CD2-CG1 4.47Å; F30-V56 HydrophobicContact CE1-CG1 3.99Å; F30-V56 HydrophobicContact CE1-CG2 4.13Å; F30-V56 HydrophobicContact CE2-CG2 4.08Å; F30-V56 HydrophobicContact CG-CG1 4.09Å; F30-V56 HydrophobicContact CZ-CB 4.48Å; F30-V56 HydrophobicContact CZ-CG1 4.37Å; F30-V56 HydrophobicContact CZ-CG2 3.78Å; Q33-V56 HydrophobicContact CG-CG1 4.37Å; I52-V56 WeakPolarHBondContact O-CG2 2.99Å; I52-V56 PolarHBondContact O-N 2.98Å; A54-V56 PolarHBondContact O-N 3.12Å; V56-M58 VanDerWaalsContact C-N 3.34Å; V56-M58 HydrophobicContact CG2-CB 3.93Å; V56-M58 HydrophobicContact CG2-CE 4.44Å; V56-M58 PolarHBondContact O-N 2.87Å
57G92.2Very high93.5Very high37 Ų3774.2 Ų74.238%0.38139%0.392SS..THydrogen-bonded Turntrans68.626.5177.700000114.9M53 A54 L55M53-G57 PolarHBondContact O-N 2.92Å; A54-G57 PolarHBondContact O-N 2.86Å; L55-G57 VanDerWaalsContact C-N 3.27Å; L55-G57 PolarHBondContact O-N 2.87Å
58M94.3Very high93.6Very high0 Ų066.1 Ų66.10%035%0.354CS..  trans-98.2-26.3178.9-160.5179.4-5500113.6L23 Y26 F30 M53 V56 S60 K61 H64 V65 L68L23-M58 HydrophobicContact CD1-CE 4.35Å; L23-M58 HydrophobicContact CD1-SD 4.35Å; Y26-M58 HydrophobicContact CD1-CB 4.36Å; Y26-M58 HydrophobicContact CD1-CE 3.91Å; Y26-M58 HydrophobicContact CD2-CE 3.93Å; Y26-M58 HydrophobicContact CE1-CB 3.98Å; Y26-M58 HydrophobicContact CE1-CE 4.35Å; Y26-M58 HydrophobicContact CE1-CG 4.3Å; Y26-M58 HydrophobicContact CE2-CE 4.39Å; Y26-M58 HydrophobicContact CG-CE 3.67Å; F30-M58 HydrophobicContact CE2-CE 3.7Å; F30-M58 HydrophobicContact CZ-CE 3.9Å; M53-M58 CarbonylContact O-C 3.57Å; M53-M58 WeakPolarHBondContact O-CA 3.45Å; M53-M58 PolarHBondContact O-N 3.15Å; M53-M58 HydrophobicContact SD-CB 3.99Å; M53-M58 HydrophobicContact SD-CE 4.39Å; M53-M58 HydrophobicContact SD-CG 4.21Å; M53-M58 HydrophobicContact SD-SD 3.71Å; V56-M58 VanDerWaalsContact C-N 3.34Å; V56-M58 HydrophobicContact CG2-CB 3.93Å; V56-M58 HydrophobicContact CG2-CE 4.44Å; V56-M58 PolarHBondContact O-N 2.87Å; M58-S60 VanDerWaalsContact C-N 3.25Å; M58-S60 PolarHBondContact O-N 3.17Å; M58-K61 CarbonylContact O-C 3.54Å; M58-K61 WeakPolarHBondContact O-CA 3.45Å; M58-K61 PolarHBondContact O-N 3.11Å; M58-H64 HydrophobicContact CG-CB 3.5Å; M58-H64 VanDerWaalsContact SD-C 3.55Å; M58-H64 HydrophobicContact SD-CB 3.8Å; M58-V65 HydrophobicContact CB-CG2 4.45Å; M58-V65 HydrophobicContact CG-CG2 3.9Å; M58-V65 WeakPolarHBondContact O-CG2 3.3Å; M58-V65 HydrophobicContact SD-CG2 4.34Å; M58-L68 HydrophobicContact CE-CD2 4.07Å; M58-L68 HydrophobicContact SD-CB 4.17Å; M58-L68 HydrophobicContact SD-CD2 4.08Å
59A91Very high93.7Very high46 Ų4662.9 Ų62.938%0.3834%0.339SS..THydrogen-bonded Turntrans-55.7-35.8-17600000113.6M53 A54 K61M53-A59 HydrophobicContact CB-CB 4.15Å; M53-A59 PolarHBondContact O-N 2.82Å; A54-A59 HydrophobicContact CB-CB 4.24Å; A59-K61 PolarHBondContact O-N 3.15Å; A59-K61 VanDerWaalsContact O-N 3.15Å
60S91.7Very high93.7Very high97 Ų9767.1 Ų67.168%0.67836%0.357SS*.THydrogen-bonded Turntrans-68.2-6.8175.759.40000114.5M58M58-S60 VanDerWaalsContact C-N 3.25Å; M58-S60 PolarHBondContact O-N 3.17Å
61K94.6Very high93.8Very high95 Ų9563 Ų6341%0.41334%0.336SS..  trans-127.381-178.2-60.7-176-163166.10109.8M58 A59 L63 H64 V65M58-K61 CarbonylContact O-C 3.54Å; M58-K61 WeakPolarHBondContact O-CA 3.45Å; M58-K61 PolarHBondContact O-N 3.11Å; A59-K61 PolarHBondContact O-N 3.15Å; A59-K61 VanDerWaalsContact O-N 3.15Å; K61-L63 PolarHBondContact O-N 3.22Å; K61-L63 VanDerWaalsContact O-N 3.08Å; K61-H64 HydrophobicContact CB-CB 4.06Å; K61-H64 WeakPolarHBondContact O-CA 3.49Å; K61-H64 WeakPolarHBondContact O-CB 3.48Å; K61-H64 PolarHBondContact O-N 2.66Å; K61-V65 PolarHBondContact O-N 3.33Å
62P90.9Very high93.8Very high89 Ų8957.2 Ų57.258%0.57831%0.309SS*.Hα-helixtrans-58.7-29.4-173.820.7-33.1000113.9H64 V65 R66P62-H64 VanDerWaalsContact C-N 3.25Å; P62-H64 PolarHBondContact O-N 3.21Å; P62-V65 PolarHBondContact O-N 3.21Å; P62-R66 WeakPolarHBondContact O-CB 3.33Å; P62-R66 VanDerWaalsContact O-CG 3.26Å; P62-R66 WeakPolarHBondContact O-CG 3.32Å; P62-R66 PolarHBondContact O-N 3.35Å
63L95.5Very high93.7Very high134 Ų13461.7 Ų61.770%0.70232%0.323SS*.Hα-helixtrans-68.3-20.7173.4-65.1-179.7000113.8K61 R67K61-L63 PolarHBondContact O-N 3.22Å; K61-L63 VanDerWaalsContact O-N 3.08Å; L63-R67 VanDerWaalsContact O-CG 3.31Å; L63-R67 WeakPolarHBondContact O-CG 3.5Å; L63-R67 PolarHBondContact O-N 3.26Å; L63-R67 PolarHBondContact O-NE 2.89Å
64H95.1Very high93.5Very high44 Ų4464.3 Ų64.320%0.20434%0.337CS..Hα-helixtrans-80.1-47.7173.6-67.7-160.6000109.4L23 Y26 M58 K61 P62 R66 R67 L68L23-H64 HydrophobicContact CD2-CB 3.81Å; Y26-H64 AromaticContact CE2-ND1 3.32Å; Y26-H64 VanDerWaalsContact CE2-ND1 3.32Å; Y26-H64 WeakPolarHBondContact CE2-ND1 3.42Å; Y26-H64 AromaticContact CZ-ND1 3.58Å; Y26-H64 PolarHBondContact OH-ND1 2.98Å; Y26-H64 VanDerWaalsContact OH-ND1 3.11Å; M58-H64 HydrophobicContact CG-CB 3.5Å; M58-H64 VanDerWaalsContact SD-C 3.55Å; M58-H64 HydrophobicContact SD-CB 3.8Å; K61-H64 HydrophobicContact CB-CB 4.06Å; K61-H64 WeakPolarHBondContact O-CA 3.49Å; K61-H64 WeakPolarHBondContact O-CB 3.48Å; K61-H64 PolarHBondContact O-N 2.66Å; P62-H64 VanDerWaalsContact C-N 3.25Å; P62-H64 PolarHBondContact O-N 3.21Å; H64-R66 VanDerWaalsContact C-N 3.32Å; H64-R66 PolarHBondContact O-N 3.48Å; H64-R67 PolarHBondContact CD2-NH2 3.41Å; H64-R67 PolarHBondContact NE2-NH2 3.13Å; H64-R67 WeakPolarHBondContact O-CA 3.26Å; H64-R67 WeakPolarHBondContact O-CB 3.48Å; H64-R67 PolarHBondContact O-N 3.12Å; H64-L68 PolarHBondContact O-N 3.39Å
65V94.4Very high93.3Very high15 Ų1563.1 Ų63.19%0.09132%0.32CS..Hα-helixtrans-53.7-47.7173.3-1750000111.1F49 M53 M58 K61 P62 R67 L68 Q69F49-V65 HydrophobicContact CE1-CG1 3.7Å; F49-V65 HydrophobicContact CZ-CG1 4.32Å; M53-V65 HydrophobicContact CB-CG2 4.45Å; M53-V65 HydrophobicContact CG-CG1 4.03Å; M53-V65 HydrophobicContact CG-CG2 4.06Å; M53-V65 HydrophobicContact SD-CG1 4.36Å; M53-V65 HydrophobicContact SD-CG2 4.22Å; M58-V65 HydrophobicContact CB-CG2 4.45Å; M58-V65 HydrophobicContact CG-CG2 3.9Å; M58-V65 WeakPolarHBondContact O-CG2 3.3Å; M58-V65 HydrophobicContact SD-CG2 4.34Å; K61-V65 PolarHBondContact O-N 3.33Å; P62-V65 PolarHBondContact O-N 3.21Å; V65-R67 VanDerWaalsContact C-N 3.33Å; V65-R67 PolarHBondContact O-N 3.02Å; V65-L68 PolarHBondContact O-N 2.88Å; V65-Q69 HydrophobicContact CG1-CG 4.34Å; V65-Q69 WeakPolarHBondContact O-CB 3.3Å; V65-Q69 WeakPolarHBondContact O-CG 3.33Å; V65-Q69 PolarHBondContact O-N 3.2Å
66R95Very high93.1Very high175 Ų17562.8 Ų62.866%0.6632%0.322SS*.Hα-helixtrans-63.1-32.9176.6-68.7-65.9-170.9-174.63.1113.6P62 H64 K70P62-R66 WeakPolarHBondContact O-CB 3.33Å; P62-R66 VanDerWaalsContact O-CG 3.26Å; P62-R66 WeakPolarHBondContact O-CG 3.32Å; P62-R66 PolarHBondContact O-N 3.35Å; H64-R66 VanDerWaalsContact C-N 3.32Å; H64-R66 PolarHBondContact O-N 3.48Å; R66-K70 PolarHBondContact O-N 2.91Å
67R95.8Very high92.9Very high84 Ų8468.1 Ų68.132%0.31735%0.354SS..Hα-helixtrans-71.1-43.2174.4-78.8-170.9-65.8145.7-11.4111.7A21 N22 L23 L63 H64 V65 K70 A71A21-R67 PolarHBondContact O-NH1 3.45Å; N22-R67 PolarHBondContact O-NH1 3.13Å; L23-R67 HydrophobicContact CD1-CB 4.11Å; L63-R67 VanDerWaalsContact O-CG 3.31Å; L63-R67 WeakPolarHBondContact O-CG 3.5Å; L63-R67 PolarHBondContact O-N 3.26Å; L63-R67 PolarHBondContact O-NE 2.89Å; H64-R67 PolarHBondContact CD2-NH2 3.41Å; H64-R67 PolarHBondContact NE2-NH2 3.13Å; H64-R67 WeakPolarHBondContact O-CA 3.26Å; H64-R67 WeakPolarHBondContact O-CB 3.48Å; H64-R67 PolarHBondContact O-N 3.12Å; V65-R67 VanDerWaalsContact C-N 3.33Å; V65-R67 PolarHBondContact O-N 3.02Å; R67-K70 PolarHBondContact O-N 2.99Å; R67-A71 PolarHBondContact O-N 2.68Å
68L95Very high92.5Very high1 Ų170 Ų701%0.00536%0.356CS..Hα-helixtrans-62.8-51.8175.3-178.462.9000111.3I17 L18 L23 F30 F49 M53 M58 H64 V65 K70 A71 L72I17-L68 HydrophobicContact CG2-CD1 4.28Å; L18-L68 HydrophobicContact CD2-CD1 3.93Å; L23-L68 HydrophobicContact CD1-CB 3.79Å; F30-L68 HydrophobicContact CE1-CD2 4.49Å; F30-L68 HydrophobicContact CE2-CD2 4.47Å; F30-L68 HydrophobicContact CZ-CD2 3.69Å; F49-L68 HydrophobicContact CZ-CD2 4.4Å; M53-L68 HydrophobicContact CE-CD2 3.61Å; M53-L68 HydrophobicContact SD-CD2 3.75Å; M58-L68 HydrophobicContact CE-CD2 4.07Å; M58-L68 HydrophobicContact SD-CB 4.17Å; M58-L68 HydrophobicContact SD-CD2 4.08Å; H64-L68 PolarHBondContact O-N 3.39Å; V65-L68 PolarHBondContact O-N 2.88Å; L68-K70 PolarHBondContact O-N 3.1Å; L68-K70 VanDerWaalsContact O-N 3.15Å; L68-A71 PolarHBondContact O-N 2.99Å; L68-L72 HydrophobicContact CD1-CD1 4.16Å; L68-L72 HydrophobicContact CD1-CG 4.09Å; L68-L72 HydrophobicContact CD2-CD1 4.45Å; L68-L72 HydrophobicContact CG-CD1 3.86Å; L68-L72 HydrophobicContact CG-CG 4.24Å; L68-L72 WeakPolarHBondContact O-CG 3.32Å; L68-L72 PolarHBondContact O-N 2.94Å
69Q94.1Very high91.8Very high48 Ų4873.1 Ų73.122%0.22438%0.376CS..Hα-helixtrans-54.3-34.3176.1-76.3-177.7-17.700112.9F49 V65 R73F49-Q69 HydrophobicContact CE1-CG 3.76Å; F49-Q69 HydrophobicContact CZ-CG 3.63Å; V65-Q69 HydrophobicContact CG1-CG 4.34Å; V65-Q69 WeakPolarHBondContact O-CB 3.3Å; V65-Q69 WeakPolarHBondContact O-CG 3.33Å; V65-Q69 PolarHBondContact O-N 3.2Å; Q69-R73 WeakPolarHBondContact O-CG 3.48Å; Q69-R73 VanDerWaalsContact O-CZ 3.24Å; Q69-R73 PolarHBondContact O-N 2.93Å; Q69-R73 PolarHBondContact O-NH1 3.14Å
70K93.9Very high91.3Very high108 Ų10873.5 Ų73.547%0.4738%0.38SS..Hα-helixtrans-70.5-49173.1-165.1-155.9179.1-60.30111.1R66 R67 L68 L72 R73 D74R66-K70 PolarHBondContact O-N 2.91Å; R67-K70 PolarHBondContact O-N 2.99Å; L68-K70 PolarHBondContact O-N 3.1Å; L68-K70 VanDerWaalsContact O-N 3.15Å; K70-L72 VanDerWaalsContact C-N 3.33Å; K70-L72 PolarHBondContact O-N 3.13Å; K70-R73 PolarHBondContact O-N 3.31Å; K70-D74 IonicContact NZ-OD1 3.64Å; K70-D74 PolarHBondContact NZ-OD1 3.46Å; K70-D74 IonicContact NZ-OD2 3.23Å; K70-D74 PolarHBondContact NZ-OD2 3.22Å; K70-D74 WeakPolarHBondContact O-CB 3.45Å; K70-D74 PolarHBondContact O-N 3.41Å
71A93.4Very high90.5Very high6 Ų671.4 Ų71.45%0.0536%0.36CS..Hα-helixtrans-63.7-36.3-177.400000112.9I17 A21 R67 L68 D74 W75 F82I17-A71 HydrophobicContact CG2-CB 3.84Å; A21-A71 HydrophobicContact CB-CB 3.86Å; R67-A71 PolarHBondContact O-N 2.68Å; L68-A71 PolarHBondContact O-N 2.99Å; A71-D74 PolarHBondContact O-N 3.49Å; A71-W75 WeakPolarHBondContact O-CB 3.4Å; A71-W75 PolarHBondContact O-N 3.14Å; A71-F82 WeakPolarHBondContact O-CZ 3.26Å
72L93.2Very high89.6Confident8 Ų867.2 Ų67.24%0.04234%0.342CS..Hα-helixtrans-63.1-48.5172.5-69.1172000111.5I17 V38 F49 L68 K70 D74 W75 V76I17-L72 HydrophobicContact CD1-CD2 4.37Å; I17-L72 HydrophobicContact CG2-CD2 4.13Å; V38-L72 HydrophobicContact CG1-CD2 4.25Å; F49-L72 HydrophobicContact CE2-CD1 4.1Å; L68-L72 HydrophobicContact CD1-CD1 4.16Å; L68-L72 HydrophobicContact CD1-CG 4.09Å; L68-L72 HydrophobicContact CD2-CD1 4.45Å; L68-L72 HydrophobicContact CG-CD1 3.86Å; L68-L72 HydrophobicContact CG-CG 4.24Å; L68-L72 WeakPolarHBondContact O-CG 3.32Å; L68-L72 PolarHBondContact O-N 2.94Å; K70-L72 VanDerWaalsContact C-N 3.33Å; K70-L72 PolarHBondContact O-N 3.13Å; L72-D74 PolarHBondContact O-N 3.45Å; L72-W75 WeakPolarHBondContact O-CB 3.37Å; L72-W75 PolarHBondContact O-N 3.38Å; L72-W75 VanDerWaalsContact O-N 3.13Å; L72-V76 WeakPolarHBondContact O-CG2 3.48Å; L72-V76 PolarHBondContact O-N 3.36Å
73R91.6Very high88.6Confident142 Ų14269 Ų6954%0.53635%0.346SS..Hα-helixtrans-63-39174.6-73.7-169.6-57.8-86-5.7113.1Q69 K70 W75 T77Q69-R73 WeakPolarHBondContact O-CG 3.48Å; Q69-R73 VanDerWaalsContact O-CZ 3.24Å; Q69-R73 PolarHBondContact O-N 2.93Å; Q69-R73 PolarHBondContact O-NH1 3.14Å; K70-R73 PolarHBondContact O-N 3.31Å; R73-W75 VanDerWaalsContact C-N 3.26Å; R73-W75 PolarHBondContact O-N 3.39Å; R73-T77 WeakPolarHBondContact O-CB 3.3Å; R73-T77 PolarHBondContact O-N 3.02Å; R73-T77 PolarHBondContact O-OG1 2.82Å
74D90.2Very high87.2Confident55 Ų5568 Ų6829%0.29434%0.338SS..Hα-helixtrans-60.6-38.6174.1-67.3-11.9000110.7K70 A71 L72 N78 F82K70-D74 IonicContact NZ-OD1 3.64Å; K70-D74 PolarHBondContact NZ-OD1 3.46Å; K70-D74 IonicContact NZ-OD2 3.23Å; K70-D74 PolarHBondContact NZ-OD2 3.22Å; K70-D74 WeakPolarHBondContact O-CB 3.45Å; K70-D74 PolarHBondContact O-N 3.41Å; A71-D74 PolarHBondContact O-N 3.49Å; L72-D74 PolarHBondContact O-N 3.45Å; D74-N78 PolarHBondContact O-N 3.44Å; D74-F82 HydrophobicContact CB-CE2 4.26Å; D74-F82 HydrophobicContact CB-CZ 4.07Å
75W90.4Very high85.2Confident36 Ų3670 Ų7014%0.13636%0.355CS..Hα-helixtrans-69.8-47.8177.8-179.888.3000112.5I17 V38 A71 L72 R73 T77 N78 P79 F82I17-W75 HydrophobicContact CD1-CB 4.07Å; I17-W75 HydrophobicContact CD1-CD2 4.04Å; I17-W75 HydrophobicContact CD1-CG 3.68Å; I17-W75 HydrophobicContact CG1-CB 4.23Å; I17-W75 HydrophobicContact CG1-CG 4.13Å; V38-W75 HydrophobicContact CB-CH2 4.15Å; V38-W75 HydrophobicContact CB-CZ2 4.31Å; V38-W75 HydrophobicContact CB-CZ3 4.46Å; V38-W75 HydrophobicContact CG1-CD2 3.82Å; V38-W75 HydrophobicContact CG1-CE3 3.65Å; V38-W75 HydrophobicContact CG1-CH2 3.67Å; V38-W75 HydrophobicContact CG1-CZ2 3.82Å; V38-W75 HydrophobicContact CG1-CZ3 3.59Å; A71-W75 WeakPolarHBondContact O-CB 3.4Å; A71-W75 PolarHBondContact O-N 3.14Å; L72-W75 WeakPolarHBondContact O-CB 3.37Å; L72-W75 PolarHBondContact O-N 3.38Å; L72-W75 VanDerWaalsContact O-N 3.13Å; R73-W75 VanDerWaalsContact C-N 3.26Å; R73-W75 PolarHBondContact O-N 3.39Å; W75-T77 PolarHBondContact O-N 3.21Å; W75-N78 CarbonylContact O-C 3.25Å; W75-N78 VanDerWaalsContact O-C 3.23Å; W75-N78 PolarHBondContact O-N 2.94Å; W75-P79 VanDerWaalsContact O-CA 3.32Å; W75-P79 WeakPolarHBondContact O-CA 3.38Å; W75-P79 WeakPolarHBondContact O-CD 3.48Å; W75-F82 HydrophobicContact CB-CD2 3.99Å; W75-F82 HydrophobicContact CB-CE2 3.6Å; W75-F82 HydrophobicContact CB-CZ 3.92Å; W75-F82 AromaticContact CD1-CD2 3.63Å; W75-F82 AromaticContact CD1-CG 3.84Å; W75-F82 HydrophobicContact CG-CD2 4.2Å; W75-F82 HydrophobicContact CG-CE2 4.3Å
76V89Confident83.2Confident90 Ų9072.9 Ų72.955%0.54537%0.37SS..Hα-helixtrans-59.5-37.9174.5175.80000111.3C42 L72C42-V76 HydrophobicContact CB-CG2 3.98Å; C42-V76 VanDerWaalsContact SG-CG2 3.55Å; L72-V76 WeakPolarHBondContact O-CG2 3.48Å; L72-V76 PolarHBondContact O-N 3.36Å
77T88.8Confident80.6Confident120 Ų12070.6 Ų70.674%0.73638%0.375SS*.Hα-helixtrans-72.9-34.3179.6-51.90000112.4R73 W75R73-T77 WeakPolarHBondContact O-CB 3.3Å; R73-T77 PolarHBondContact O-N 3.02Å; R73-T77 PolarHBondContact O-OG1 2.82Å; W75-T77 PolarHBondContact O-N 3.21Å
78N84.6Confident77.9Confident77 Ų7771 Ų7141%0.41239%0.391SS..  trans-157.587-179.7-174.8-13.7000111.3D74 W75 A80 I81D74-N78 PolarHBondContact O-N 3.44Å; W75-N78 CarbonylContact O-C 3.25Å; W75-N78 VanDerWaalsContact O-C 3.23Å; W75-N78 PolarHBondContact O-N 2.94Å; N78-A80 PolarHBondContact O-N 2.98Å; N78-A80 PolarHBondContact OD1-N 2.85Å; N78-I81 VanDerWaalsContact O-CG2 3.3Å; N78-I81 WeakPolarHBondContact O-CG2 3.49Å; N78-I81 PolarHBondContact O-N 2.78Å; N78-I81 PolarHBondContact OD1-N 3.26Å
79P80.1Confident75Confident65 Ų6575.6 Ų75.642%0.42242%0.415SS..THydrogen-bonded Turntrans-68.9-23.8-176.425.3-33000112.4W75 I81 F82W75-P79 VanDerWaalsContact O-CA 3.32Å; W75-P79 WeakPolarHBondContact O-CA 3.38Å; W75-P79 WeakPolarHBondContact O-CD 3.48Å; P79-I81 PolarHBondContact O-N 3.1Å; P79-F82 PolarHBondContact O-N 3.35Å; P79-F82 VanDerWaalsContact O-N 3.12Å
80A79Confident72.3Confident55 Ų5579 Ų7946%0.45544%0.441SS..Hα-helixtrans-63-25.4179.700000113.3N78 F82 N83N78-A80 PolarHBondContact O-N 2.98Å; N78-A80 PolarHBondContact OD1-N 2.85Å; A80-F82 PolarHBondContact O-N 3.02Å; A80-N83 PolarHBondContact O-N 2.9Å
81I76.1Confident69.5Low53 Ų5380.6 Ų80.627%0.27246%0.46SS..Hα-helixtrans-70.5-10.6178-148.7176.5000113.5R20 N78 P79R20-I81 PolarHBondContact NH1-O 2.76Å; N78-I81 VanDerWaalsContact O-CG2 3.3Å; N78-I81 WeakPolarHBondContact O-CG2 3.49Å; N78-I81 PolarHBondContact O-N 2.78Å; N78-I81 PolarHBondContact OD1-N 3.26Å; P79-I81 PolarHBondContact O-N 3.1Å
82F76.3Confident66.5Low6 Ų684.8 Ų84.83%0.02649%0.487CS..Hα-helixtrans-98.1-15.2175.5-65.2-97.4000113.1R16 I17 R20 A71 D74 W75 P79 A80R16-F82 HydrophobicContact CB-CB 4.17Å; R16-F82 HydrophobicContact CB-CD1 4.42Å; R16-F82 WeakPolarHBondContact CD-O 3.28Å; R16-F82 WeakPolarHBondContact CG-O 3.46Å; I17-F82 HydrophobicContact CB-CD1 4.49Å; I17-F82 HydrophobicContact CB-CE1 4.31Å; I17-F82 HydrophobicContact CG1-CD1 3.79Å; I17-F82 HydrophobicContact CG1-CE1 3.81Å; I17-F82 HydrophobicContact CG1-CG 4.46Å; R20-F82 HydrophobicContact CB-CD1 4.18Å; R20-F82 HydrophobicContact CB-CE1 3.78Å; R20-F82 HydrophobicContact CG-CE1 4.17Å; A71-F82 WeakPolarHBondContact O-CZ 3.26Å; D74-F82 HydrophobicContact CB-CE2 4.26Å; D74-F82 HydrophobicContact CB-CZ 4.07Å; W75-F82 HydrophobicContact CB-CD2 3.99Å; W75-F82 HydrophobicContact CB-CE2 3.6Å; W75-F82 HydrophobicContact CB-CZ 3.92Å; W75-F82 AromaticContact CD1-CD2 3.63Å; W75-F82 AromaticContact CD1-CG 3.84Å; W75-F82 HydrophobicContact CG-CD2 4.2Å; W75-F82 HydrophobicContact CG-CE2 4.3Å; P79-F82 PolarHBondContact O-N 3.35Å; P79-F82 VanDerWaalsContact O-N 3.12Å; A80-F82 PolarHBondContact O-N 3.02Å
83N69.9Low63.7Low126 Ų12689.4 Ų89.467%0.67452%0.52SS*.Hα-helixtrans-87.4-11.2178.1-68.7-18.9000113.5A80A80-N83 PolarHBondContact O-N 2.9Å
84Q65.3Low61.1Low115 Ų11589.2 Ų89.254%0.53753%0.529SS..SBendtrans-72.3137.6176.7-66.9-178.9-9.500111.2
85P53.9Low58.9Low85 Ų8591.5 Ų91.555%0.55255%0.547SS*.  trans-63.1140.1170.127.9-33.8000110T87P85-T87 HydrophobicContact CB-CG2 4.44Å; P85-T87 PolarHBondContact O-N 3.46Å
86L52.5Low56.3Low76 Ų7695.9 Ų95.940%0.39858%0.577SS.*G310 helixtrans-74.420.2-177.2-60.4179.2000113.9Q19 S88 L89Q19-L86 HydrophobicContact CG-CD1 3.73Å; L86-S88 PolarHBondContact O-N 3.16Å; L86-L89 HydrophobicContact CD2-CD1 3.93Å
87T40.3Very low53.6Low126 Ų126102.1 Ų102.177%0.77359%0.592SS**G310 helixtrans-71.8-5.5178.247.20000113.6P85P85-T87 HydrophobicContact CB-CG2 4.44Å; P85-T87 PolarHBondContact O-N 3.46Å
88S37.4Very low51.3Low93 Ų93105.8 Ų105.865%0.6560%0.598SS**G310 helixtrans-143.972.8175.861.60000112.4L86L86-S88 PolarHBondContact O-N 3.16Å
89L36Very low48.8Very low97 Ų97109.9 Ų109.951%0.50862%0.619SS.*  trans-120.4137157.9-73.9179.5000109.6L86 V91L86-L89 HydrophobicContact CD2-CD1 3.93Å; L89-V91 PolarHBondContact O-N 3.46Å
90P36.4Very low46.6Very low119 Ų119112.9 Ų112.977%0.77364%0.638SS**  trans-65.1133.5172.628.1-33.6000109.9C92P90-C92 PolarHBondContact O-N 3.23Å
91V34.8Very low44.5Very low143 Ų143117.4 Ų117.487%0.86765%0.65SS**  trans-63.4118.8-175.1174.90000110.9L89L89-V91 PolarHBondContact O-N 3.46Å
92C31.7Very low42.2Very low93 Ų93118.5 Ų118.563%0.62868%0.675SS**  trans-143.6114.6165.3-89.70000110.6P90P90-C92 PolarHBondContact O-N 3.23Å
93S34.2Very low40Very low105 Ų105123.2 Ų123.273%0.73471%0.709SS**  trans53.392.6162.156.50000118.4
94I35.3Very low38.6Very low138 Ų138123.3 Ų123.371%0.70872%0.716SS**  trans-111.2127.2143.6-63.2174.7000107V96I94-V96 PolarHBondContact O-N 3.18Å
95P45.1Very low37Very low104 Ų104123 Ų12368%0.67572%0.722SS**  trans-73.6116.4165.930-30.9000109.1Y97P95-Y97 PolarHBondContact O-N 3.34Å
96V36.2Very low36.1Very low127 Ų127127.3 Ų127.377%0.7774%0.74SS**  trans-74.6114.1-175.91790000110.6I94I94-V96 PolarHBondContact O-N 3.18Å
97Y32Very low35.1Very low221 Ų221131.1 Ų131.187%0.86776%0.76SS**  trans-104142.7155.3-100.9-95.1000109.6P95P95-Y97 PolarHBondContact O-N 3.34Å
98K39.7Very low34.4Very low198 Ų198130.4 Ų130.486%0.86176%0.76SS**  trans-72.3145.8-165.1-61.5-179.7-180178.30112.7
99L32.4Very low34Very low163 Ų163129.7 Ų129.785%0.85376%0.76SS**  trans-134.9142.3160.8-120120.5000109.4
100P34.1Very low33.7Very low127 Ų127132.8 Ų132.883%0.82577%0.771SS**  trans-74.8165.1179.9-18.734000115
101E34.7Very low33.1Very low150 Ų150132.6 Ų132.670%0.70176%0.764SS**  trans-87.6139.1-175.8-170.5179.8150.300111.7R374E101-R374 IonicContact OE1-CZ 3.28Å; E101-R374 IonicContact OE1-NH1 3.6Å; E101-R374 PolarHBondContact OE1-NH1 3.28Å; E101-R374 IonicContact OE1-NH2 3.57Å; E101-R374 IonicContact OE2-NH1 2.81Å; E101-R374 PolarHBondContact OE2-NH1 2.91Å
102G28.8Very low32.9Very low77 Ų77136.2 Ų136.279%0.79476%0.762SS**  trans178.888.8-179.100000114.4
103S28.8Very low32.7Very low105 Ų105136.4 Ų136.473%0.73476%0.764SS**  trans-88.3170.2-179.3-36.70000111.9
104P41.3Very low32.2Very low127 Ų127137.7 Ų137.783%0.82576%0.763SS**  -138.8162.564.937.7-20.3000116.8
105T31.3Very low31.8Very low110 Ų110137.2 Ų137.268%0.67577%0.767SS**  trans-74.7154.5173.5-36.20000112.4L107T105-L107 HydrophobicContact CG2-CD2 4.35Å
106L34.6Very low31Very low175 Ų175137.3 Ų137.392%0.91678%0.776SS**  trans-125.9148.4147.9-77.6-178.2000111.2
107L32.3Very low30.5Very low156 Ų156136.5 Ų136.582%0.81778%0.776SS**  trans-96.6172.8178.6-48.7170.9000108.3T105T105-L107 HydrophobicContact CG2-CD2 4.35Å
108S25.4Very low30.4Very low111 Ų111132.5 Ų132.578%0.77677%0.774SS**  cis-155.9-165.210.9-157.90000111
109A28.5Very low29.8Very low78 Ų78132.2 Ų132.265%0.64577%0.773SS**  trans-56.5172169.400000113
110Q29.6Very low29.7Very low162 Ų162131.9 Ų131.976%0.75777%0.77SS**  cis-174.9151.547.4-178.2137.2-17.200115.1
111D24.6Very low29.6Very low114 Ų114131.9 Ų131.961%0.6177%0.771SS**  trans76.1134.2145.4-97.2-41.7000126
112R30.2Very low29.2Very low220 Ų220133.6 Ų133.683%0.8378%0.776SS**  trans66.6109.2134.4-87.4165.9169.6-134.3-8.8124.3
113S26.9Very low29Very low97 Ų97134.3 Ų134.368%0.67877%0.774SS**  117.4145.398.8-158.30000119.6
114N25Very low28.8Very low132 Ų132136.9 Ų136.971%0.70678%0.778SS**  trans72.8102.9153.8-80.11.7000123
115T26.6Very low28.1Very low128 Ų128135.4 Ų135.479%0.78578%0.777SS**  47.8116.3120.562.70000121.2
116A27.8Very low27.8Very low106 Ų106135.2 Ų135.288%0.87679%0.787SS**  trans-152.9145.6137.400000110.8
117S26.9Very low27.5Very low110 Ų110131 Ų13177%0.76978%0.777SS**  trans-118.6122.4-179.154.70000112.5
118V29.5Very low27.1Very low137 Ų137129.6 Ų129.683%0.8378%0.779SS**  trans-139.497.1171.5-172.60000106.4
119K26.1Very low27.3Very low191 Ų191129.6 Ų129.683%0.8378%0.779SS**  65.7116.785-69.4-171.9178.7-179.20114.1
120I31.1Very low27.4Very low156 Ų156132.4 Ų132.480%0.878%0.783SS**  trans-68.9149.6175.1-55.3159.7000110.1K122I120-K122 HydrophobicContact CG2-CB 4.32Å
121P30.9Very low27.6Very low128 Ų128130.5 Ų130.583%0.83179%0.785SS**  -116.9150.3129.3-8.427.7000113.5
122K27.8Very low27.7Very low185 Ų185127.2 Ų127.280%0.80478%0.778SS**  trans-127.8118.9178.4171.4-178.5175.6177.80108.9I120I120-K122 HydrophobicContact CG2-CB 4.32Å
123A24.2Very low27.6Very low93 Ų93126 Ų12677%0.76978%0.779SS**  trans-136122.716400000106.5
124I24.9Very low27.7Very low158 Ų158127.7 Ų127.781%0.8178%0.779SS**  82.7133.154.9-64.1168.8000111.1
125A26.5Very low27.7Very low96 Ų96127.8 Ų127.879%0.79378%0.78SS**  trans-70.8158.2-160.800000115.6
126A25.2Very low27.8Very low107 Ų107128.1 Ų128.188%0.88478%0.781SS**  trans-127.4151.2143.300000108.4
127A27.1Very low27.8Very low87 Ų87127 Ų12772%0.71977%0.771SS**  trans-135.6173.3177.700000109.6
128C25.4Very low27.9Very low125 Ų125132.2 Ų132.285%0.84578%0.775SS**  trans71.3154.8-177.8-49.30000113.4
129S28.1Very low27.7Very low111 Ų111131 Ų13178%0.77676%0.76SS**  cis-139.1150.715.1-56.70000113.7
130D30.6Very low27.8Very low138 Ų138129.8 Ų129.874%0.73875%0.754SS**  trans-75.5149.5154.3176.950.1000109.8G132D130-G132 PolarHBondContact OD1-N 3.37Å
131P34.4Very low27.6Very low122 Ų122128.4 Ų128.479%0.79275%0.753SS**  -145.6129.8112.334.7-18.8000112.5
132G25.5Very low27.5Very low45 Ų45126.9 Ų126.946%0.46475%0.746SS.*  cis102.8135.930.400000110.8D130D130-G132 PolarHBondContact OD1-N 3.37Å
133K29.6Very low27.5Very low195 Ų195125 Ų12585%0.84875%0.749SS**  trans87.7145.1176.5-60.1-160161.2-169.40118.4
134L28.1Very low27.6Very low132 Ų132124.1 Ų124.169%0.69175%0.75SS**  cis-156.8139.3-21.3-93.1173.9000105.3
135D25.2Very low27.7Very low134 Ų134121.7 Ų121.772%0.71775%0.747SS**  88.316663-144.7-54.3000114.1
136V28.8Very low28.3Very low134 Ų134123 Ų12381%0.81275%0.748SS**  trans80.692.3-166.7-168.40000113.1
137A28.4Very low28.6Very low82 Ų82125.7 Ų125.768%0.67875%0.746SS**  cis81.3124.333.900000116
138R28.1Very low28.8Very low221 Ų221131.3 Ų131.383%0.83476%0.757SS**  162.7125.9119-173156-163.21706.4117.1
139E25.3Very low28.8Very low111 Ų111128.5 Ų128.552%0.51975%0.749SS.*  trans30127.6146.9-65.5-173.9105.700126.2
140K29.4Very low28.6Very low165 Ų165129.4 Ų129.472%0.71776%0.756SS**  87.2120.4120.7-76.2178.1174.7156.60125.2
141V26.3Very low28.4Very low128 Ų128127 Ų12778%0.77675%0.75SS**  89.6126.1119.9169.20000122.9
142S29.2Very low28Very low96 Ų96128.9 Ų128.967%0.67175%0.748SS**  trans115137.4137.1-111.70000122
143T26.6Very low28.2Very low144 Ų144130.7 Ų130.788%0.88376%0.759SS**  trans60.4140.8158.151.40000119.6
144G26Very low28.1Very low75 Ų75131.3 Ų131.377%0.77376%0.756SS**  cis-170.1-174.2100000112.8
145S27.1Very low28Very low108 Ų108132.2 Ų132.276%0.75575%0.754SS**  trans-150.5157.6-176164.20000111.9
146P40.7Very low28.2Very low124 Ų124137.4 Ų137.481%0.80576%0.764SS**  trans-130.5177.5143.332.6-17000114.2
147L31.3Very low28.1Very low163 Ų163135.6 Ų135.685%0.85376%0.757SS**  trans-107.5155.9-156.3-76.566.7000116.8
148Q30.3Very low28Very low204 Ų204134.9 Ų134.995%0.95376%0.758SS**  trans-169155.6134.5-106.1174.76.200110.3
149G25.1Very low27.8Very low66 Ų66133 Ų13368%0.6876%0.758SS**  cis161.297.2-15.800000115.8
150S24.5Very low27.7Very low130 Ų130132.6 Ų132.691%0.90977%0.767SS**  trans65.4157.8167-79.40000118.8
151S26Very low27.6Very low88 Ų88131 Ų13162%0.61577%0.767SS**  cis-159.3152.7-21.7-167.10000111.7
152E27.3Very low27.6Very low161 Ų161131.3 Ų131.375%0.75276%0.764SS**  trans61.5170.6149.6-86.4177.5104.400123.4R154E152-R154 IonicContact OE1-NH2 2.74Å; E152-R154 PolarHBondContact OE1-NH2 3.01Å
153A28.4Very low27.8Very low83 Ų83131.5 Ų131.569%0.68677%0.765SS**  trans-146.4152.5-169.300000114
154R28.7Very low27.9Very low208 Ų208131.5 Ų131.579%0.78576%0.755SS**  trans-176.7125.3154.7-101.6152.5-77.5179.9-4.6107.1E152E152-R154 IonicContact OE1-NH2 2.74Å; E152-R154 PolarHBondContact OE1-NH2 3.01Å
155F26.2Very low28.1Very low152 Ų152134.9 Ų134.967%0.66775%0.751SS**  71.5107.977.1-168.6-79.9000113.4
156W28.9Very low28.1Very low243 Ų243135.1 Ų135.192%0.9275%0.752SS**  trans-158.8156144.5-90.4121.3000110.3
157S27.1Very low27.7Very low96 Ų96136.3 Ų136.367%0.67175%0.751SS**  trans-120.2146.2-177.6-60.40000111.7
158G24.9Very low27.5Very low67 Ų67134.1 Ų134.169%0.69175%0.75SS**  trans101.9154.6134.300000120.1
159H24.9Very low27.8Very low181 Ų181130.2 Ų130.284%0.83874%0.742SS**  trans82.4100.2154.4-55.3-70.6000121.2
160S23.5Very low28Very low102 Ų102132.2 Ų132.271%0.71375%0.746SS**  54130.4123.5-75.10000123.5
161N27.4Very low28.4Very low133 Ų133132.9 Ų132.971%0.71174%0.739SS**  trans68.8157.4146.3-78.448000117.8
162D25Very low28.5Very low133 Ų133136.5 Ų136.571%0.71175%0.751SS**  cis-138.6-172.512.8-135.9-53.2000114.8
163S32.9Very low28.6Very low100 Ų100132 Ų13270%0.69975%0.748SS**  trans-82.5-175.7-175.3-44.60000112.2
164E30.7Very low28.6Very low144 Ų144134 Ų13467%0.67376%0.756SS**  cis-145.3-164.217-112.2-13878.600108.9
165H29.8Very low29Very low146 Ų146129.6 Ų129.668%0.67676%0.755SS**  cis-144.7158.311-78.7-66.4000110.8
166S27.5Very low29.4Very low113 Ų113128.5 Ų128.579%0.7977%0.766SS**  167.372.9121.4-750000115.2
167L30.9Very low29.6Very low149 Ų149121.8 Ų121.878%0.7876%0.757SS**  trans43.7107.9138-53178.9000120.7
168S27.3Very low30Very low118 Ų118122.3 Ų122.383%0.82576%0.758SS**  155.4147.2111.9-67.90000113
169P36.2Very low30.8Very low121 Ų121130.3 Ų130.379%0.78677%0.767SS**  cis-124.3161.8-41.638.8-26.1000112.3
170S29.5Very low31.2Very low109 Ų109128.9 Ų128.976%0.76277%0.765SS**  trans-78.8171.6173.8-31.80000112.1
171D32.5Very low31.9Very low143 Ų143128.4 Ų128.477%0.76577%0.768SS**  cis-160.4-167.58.5-143-52.3000110.8
172L29.7Very low33Very low164 Ų164128.4 Ų128.486%0.85977%0.765SS**  trans95.388.4162.6-52.1179.6000119.1
173G28.4Very low34.8Very low68 Ų68129.2 Ų129.270%0.70176%0.764SS**  110.795.2118.700000120.7
174S29.2Very low36.7Very low123 Ų123128 Ų12886%0.8676%0.76SS**  trans72.4161.3152.2-50.60000118.8
175P35.8Very low39.3Very low117 Ų117122.4 Ų122.476%0.7674%0.735SS**  cis-121175.6-36.836.8-23.5000112.2S177P175-S177 PolarHBondContact O-N 3.36Å
176S35.3Very low42Very low128 Ų128118.6 Ų118.690%0.89572%0.72SS**PPolyproline II helixtrans-63123.6177.6-53.20000112.9
177S32.5Very low44.8Very low103 Ų103117.2 Ų117.272%0.7272%0.715SS**PPolyproline II helixtrans-91.9133.9172.8-172.70000111.1P175P175-S177 PolarHBondContact O-N 3.36Å
178P37.2Very low47.3Very low107 Ų107113 Ų11370%0.69570%0.702SS**PPolyproline II helixtrans-69.6132.9-173.728.2-35000112
179R39.8Very low50.1Low235 Ų235107.6 Ų107.689%0.88766%0.664SS**  trans-106.90.9-171.4-85.7-171.2161.4-136.9-3.6115.5A181R179-A181 PolarHBondContact O-N 3.34Å
180D34.1Very low52.8Low150 Ų150103.5 Ų103.580%0.80264%0.637SS**  trans-92.87.2-168.9-48.4-80.2000114.2
181A38.4Very low55.7Low92 Ų92103 Ų10376%0.7662%0.623SS**  trans-100.619-163.700000116.3R179R179-A181 PolarHBondContact O-N 3.34Å
182M51.1Low58.4Low134 Ų13496.9 Ų96.966%0.6659%0.591SS**  trans-127.724.8-174.8-144.1-174.680.500115.8
183E61.7Low61.5Low149 Ų14989.1 Ų89.170%0.69655%0.55SS**SBendtrans-90.8-16.3168.9-57.3-153.2130.700113.4H262 L268E183-H262 IonicContact OE1-ND1 2.99Å; E183-L268 WeakPolarHBondContact O-CD2 3.17Å
184A74Confident64.6Low74 Ų7487.5 Ų87.561%0.61253%0.526SS*.SBendtrans-117.7162.8179.100000112.1
185L84Confident67.5Low27 Ų2785.4 Ų85.414%0.14150%0.502CS..  trans-77.7151.2166.4-82.6144.6000110.9A189 V190 L265 L268 E272L185-A189 HydrophobicContact CD2-CB 3.7Å; L185-V190 HydrophobicContact CB-CG2 3.72Å; L185-L265 HydrophobicContact CD2-CD1 3.62Å; L185-L268 HydrophobicContact CD1-CB 4.11Å; L185-L268 HydrophobicContact CG-CB 4.11Å; L185-E272 HydrophobicContact CD1-CB 3.65Å; L185-E272 HydrophobicContact CD1-CG 4.18Å
186D86.3Confident70.2Confident67 Ų6779.9 Ų79.936%0.35847%0.466SS..  trans-68.4153.9167.977.661000111.7A188 A189 V190 Y306D186-A188 PolarHBondContact O-N 3.09Å; D186-A188 WeakPolarHBondContact OD1-CA 3.47Å; D186-A188 WeakPolarHBondContact OD1-CB 3.32Å; D186-A188 PolarHBondContact OD1-N 2.72Å; D186-A189 PolarHBondContact O-N 3.17Å; D186-A189 VanDerWaalsContact O-N 3.13Å; D186-A189 PolarHBondContact OD1-N 3.47Å; D186-V190 WeakPolarHBondContact O-CG2 3.22Å; D186-V190 PolarHBondContact O-N 2.91Å; D186-Y306 WeakPolarHBondContact OD2-CE2 3.17Å; D186-Y306 PolarHBondContact OD2-OH 3.44Å
187A87.1Confident73Confident84 Ų8473.8 Ų73.869%0.69442%0.423SS*.Hα-helixtrans-62-27.5-174.800000113.7Q191A187-Q191 VanDerWaalsContact O-CB 3.31Å; A187-Q191 WeakPolarHBondContact O-CB 3.48Å; A187-Q191 PolarHBondContact O-N 3.41Å
188A84.3Confident75.8Confident60 Ų6072.6 Ų72.650%0.49641%0.409SS..Hα-helixtrans-76.6-32.917800000111.8D186 S192D186-A188 PolarHBondContact O-N 3.09Å; D186-A188 WeakPolarHBondContact OD1-CA 3.47Å; D186-A188 WeakPolarHBondContact OD1-CB 3.32Å; D186-A188 PolarHBondContact OD1-N 2.72Å; A188-S192 WeakPolarHBondContact O-CB 3.49Å; A188-S192 PolarHBondContact O-N 3.33Å; A188-S192 PolarHBondContact O-OG 2.8Å
189A86Confident78.4Confident5 Ų573 Ų734%0.04140%0.397CS..Hα-helixtrans-69.6-42.4170.100000111.5L185 D186 S192 V193 Y306L185-A189 HydrophobicContact CD2-CB 3.7Å; D186-A189 PolarHBondContact O-N 3.17Å; D186-A189 VanDerWaalsContact O-N 3.13Å; D186-A189 PolarHBondContact OD1-N 3.47Å; A189-S192 WeakPolarHBondContact O-CB 3.47Å; A189-S192 PolarHBondContact O-N 3.08Å; A189-V193 WeakPolarHBondContact O-CG2 3.5Å; A189-V193 PolarHBondContact O-N 2.9Å; A189-Y306 HydrophobicContact CB-CD2 3.92Å; A189-Y306 HydrophobicContact CB-CE2 3.81Å
190V91.4Very high80.6Confident35 Ų3563 Ų6321%0.21236%0.36CS..Hα-helixtrans-60.7-46.1172.8177.10000111.1L185 D186 S192 V193 L194 E272L185-V190 HydrophobicContact CB-CG2 3.72Å; D186-V190 WeakPolarHBondContact O-CG2 3.22Å; D186-V190 PolarHBondContact O-N 2.91Å; V190-S192 VanDerWaalsContact C-N 3.28Å; V190-S192 PolarHBondContact O-N 3.36Å; V190-V193 WeakPolarHBondContact O-CA 3.23Å; V190-V193 WeakPolarHBondContact O-CB 3.1Å; V190-V193 PolarHBondContact O-N 3.46Å; V190-L194 HydrophobicContact CG1-CD1 4.28Å; V190-L194 PolarHBondContact O-N 2.91Å; V190-E272 HydrophobicContact CG2-CG 4.48Å
191Q90.6Very high83Confident98 Ų9857.3 Ų57.346%0.45833%0.334SS..Hα-helixtrans-60.8-37.7175-172.159.734.300112.1A187 V193 L194 E195A187-Q191 VanDerWaalsContact O-CB 3.31Å; A187-Q191 WeakPolarHBondContact O-CB 3.48Å; A187-Q191 PolarHBondContact O-N 3.41Å; Q191-V193 VanDerWaalsContact C-N 3.34Å; Q191-V193 PolarHBondContact O-N 2.77Å; Q191-L194 PolarHBondContact O-N 3.38Å; Q191-E195 PolarHBondContact O-N 2.99Å
192S90.5Very high85.1Confident15 Ų1558.3 Ų58.311%0.10533%0.333CS..Hα-helixtrans-65.7-34.2174.1-60.60000112.6A188 A189 V190 C196 V302A188-S192 WeakPolarHBondContact O-CB 3.49Å; A188-S192 PolarHBondContact O-N 3.33Å; A188-S192 PolarHBondContact O-OG 2.8Å; A189-S192 WeakPolarHBondContact O-CB 3.47Å; A189-S192 PolarHBondContact O-N 3.08Å; V190-S192 VanDerWaalsContact C-N 3.28Å; V190-S192 PolarHBondContact O-N 3.36Å; S192-C196 PolarHBondContact O-N 2.98Å; S192-C196 PolarHBondContact O-SG 3.16Å; S192-V302 WeakPolarHBondContact O-CG2 3.38Å
193V93.5Very high86.4Confident0 Ų055.3 Ų55.30%034%0.337CS..Hα-helixtrans-65.6-48.8171.4172.50000110.3A189 V190 Q191 E195 C196 V197 T269 E272 A273 Q276 I298 V302A189-V193 WeakPolarHBondContact O-CG2 3.5Å; A189-V193 PolarHBondContact O-N 2.9Å; V190-V193 WeakPolarHBondContact O-CA 3.23Å; V190-V193 WeakPolarHBondContact O-CB 3.1Å; V190-V193 PolarHBondContact O-N 3.46Å; Q191-V193 VanDerWaalsContact C-N 3.34Å; Q191-V193 PolarHBondContact O-N 2.77Å; V193-E195 PolarHBondContact O-N 3.47Å; V193-C196 WeakPolarHBondContact O-CA 3.21Å; V193-C196 WeakPolarHBondContact O-CB 3.33Å; V193-C196 PolarHBondContact O-N 3.17Å; V193-V197 HydrophobicContact CG1-CG2 4.19Å; V193-V197 WeakPolarHBondContact O-CG2 3.32Å; V193-V197 PolarHBondContact O-N 2.9Å; V193-T269 HydrophobicContact CG2-CG2 4.15Å; V193-E272 HydrophobicContact CG1-CG 4.31Å; V193-A273 HydrophobicContact CG1-CB 3.99Å; V193-Q276 HydrophobicContact CG1-CB 4.46Å; V193-Q276 HydrophobicContact CG1-CG 4.24Å; V193-I298 HydrophobicContact CG1-CG2 4.21Å; V193-V302 HydrophobicContact CB-CG2 4.45Å; V193-V302 HydrophobicContact CG2-CG1 4.13Å; V193-V302 HydrophobicContact CG2-CG2 3.93Å
194L93.3Very high87.2Confident35 Ų3549.8 Ų49.818%0.18331%0.312CS..Hα-helixtrans-55.3-51177.7-76.2165.6000111.8V190 Q191 C196 V197 D198 Q276V190-L194 HydrophobicContact CG1-CD1 4.28Å; V190-L194 PolarHBondContact O-N 2.91Å; Q191-L194 PolarHBondContact O-N 3.38Å; L194-C196 PolarHBondContact O-N 3.47Å; L194-V197 PolarHBondContact O-N 3.33Å; L194-V197 VanDerWaalsContact O-N 3.07Å; L194-D198 WeakPolarHBondContact O-CB 3.48Å; L194-D198 VanDerWaalsContact O-CG 3.25Å; L194-D198 PolarHBondContact O-N 3.34Å; L194-Q276 HydrophobicContact CD2-CG 4.27Å; L194-Q276 VanDerWaalsContact CD2-OE1 3.27Å
195E91.7Very high87.4Confident78 Ų7850.3 Ų50.336%0.36431%0.309SS..Hα-helixtrans-54.1-28.6174.3-79-177.5-159.600113.4Q191 V193 R199Q191-E195 PolarHBondContact O-N 2.99Å; V193-E195 PolarHBondContact O-N 3.47Å; E195-R199 PolarHBondContact O-NH1 3.11Å
196C91.9Very high87Confident1 Ų158.7 Ų58.71%0.00734%0.344CS..Hα-helixtrans-85.3-37.9178-62.80000112.8S192 V193 L194 R199 M200 I298 V302S192-C196 PolarHBondContact O-N 2.98Å; S192-C196 PolarHBondContact O-SG 3.16Å; V193-C196 WeakPolarHBondContact O-CA 3.21Å; V193-C196 WeakPolarHBondContact O-CB 3.33Å; V193-C196 PolarHBondContact O-N 3.17Å; L194-C196 PolarHBondContact O-N 3.47Å; C196-R199 PolarHBondContact SG-NH2 2.63Å; C196-M200 WeakPolarHBondContact O-CB 3.44Å; C196-M200 WeakPolarHBondContact O-CG 3.31Å; C196-M200 PolarHBondContact O-N 3.34Å; C196-M200 VanDerWaalsContact O-N 3.11Å; C196-I298 HydrophobicContact CB-CG1 4.31Å; C196-I298 HydrophobicContact CB-CG2 3.78Å; C196-V302 HydrophobicContact CB-CG2 4.34Å
197V93.9Very high86.8Confident0 Ų057.5 Ų57.50%034%0.339CS..Hα-helixtrans-64.6-46.1173.1173.80000110.6V193 L194 R199 M200 A201 Q276 L277 R280 I298V193-V197 HydrophobicContact CG1-CG2 4.19Å; V193-V197 WeakPolarHBondContact O-CG2 3.32Å; V193-V197 PolarHBondContact O-N 2.9Å; L194-V197 PolarHBondContact O-N 3.33Å; L194-V197 VanDerWaalsContact O-N 3.07Å; V197-R199 VanDerWaalsContact C-N 3.28Å; V197-R199 PolarHBondContact O-N 2.91Å; V197-M200 PolarHBondContact O-N 3Å; V197-A201 WeakPolarHBondContact O-CB 3.48Å; V197-A201 PolarHBondContact O-N 2.93Å; V197-Q276 HydrophobicContact CB-CB 4.44Å; V197-Q276 HydrophobicContact CG1-CB 4.33Å; V197-Q276 HydrophobicContact CG2-CB 3.75Å; V197-L277 HydrophobicContact CG1-CD2 4.43Å; V197-L277 HydrophobicContact CG2-CG 4.36Å; V197-R280 HydrophobicContact CG1-CG 4.07Å; V197-I298 HydrophobicContact CG2-CD1 3.64Å
198D92.1Very high86.7Confident78 Ų7857.6 Ų57.642%0.41733%0.328SS..Hα-helixtrans-60.6-35.7179.3-67.3-19.4000112.6L194 P202 R280L194-D198 WeakPolarHBondContact O-CB 3.48Å; L194-D198 VanDerWaalsContact O-CG 3.25Å; L194-D198 PolarHBondContact O-N 3.34Å; D198-P202 WeakPolarHBondContact O-CD 3.32Å; D198-R280 IonicContact OD1-CZ 2.74Å; D198-R280 IonicContact OD1-NH1 3.66Å; D198-R280 PolarHBondContact OD1-NH1 3.19Å; D198-R280 IonicContact OD1-NH2 3.32Å; D198-R280 PolarHBondContact OD1-NH2 3.36Å
199R91Very high86.6Confident115 Ų11559.6 Ų59.643%0.43434%0.336SS..Hα-helixtrans-75.3-29.5175.2-179.6173.960.9-84.2-11.6113.2E195 C196 V197 E301E195-R199 PolarHBondContact O-NH1 3.11Å; C196-R199 PolarHBondContact SG-NH2 2.63Å; V197-R199 VanDerWaalsContact C-N 3.28Å; V197-R199 PolarHBondContact O-N 2.91Å; R199-E301 IonicContact CZ-OE1 2.7Å; R199-E301 IonicContact CZ-OE2 2.68Å; R199-E301 IonicContact NE-OE1 3.82Å; R199-E301 IonicContact NH2-OE1 3.76Å; R199-E301 PolarHBondContact NH2-OE1 2.68Å; R199-E301 IonicContact NH2-OE2 3.52Å; R199-E301 PolarHBondContact NH2-OE2 3.49Å
200M86.8Confident86.5Confident26 Ų2662.2 Ų62.213%0.12836%0.357CS..Hα-helixtrans-90.5-35.3-177-75.2-177.855.400113.4C196 V197 P202 G203 L294 Q297 I298C196-M200 WeakPolarHBondContact O-CB 3.44Å; C196-M200 WeakPolarHBondContact O-CG 3.31Å; C196-M200 PolarHBondContact O-N 3.34Å; C196-M200 VanDerWaalsContact O-N 3.11Å; V197-M200 PolarHBondContact O-N 3Å; M200-P202 VanDerWaalsContact C-CD 3.46Å; M200-G203 PolarHBondContact O-N 3.28Å; M200-L294 HydrophobicContact CE-CD2 3.68Å; M200-Q297 HydrophobicContact CE-CG 4.33Å; M200-Q297 HydrophobicContact SD-CG 4.37Å; M200-I298 HydrophobicContact CE-CD1 4.42Å; M200-I298 HydrophobicContact CE-CG1 4.19Å; M200-I298 HydrophobicContact SD-CD1 3.95Å; M200-I298 HydrophobicContact SD-CG1 3.48Å; M200-I298 WeakPolarHBondContact SD-CG1 3.37Å
201A83.9Confident86.3Confident31 Ų3165.3 Ų65.326%0.25637%0.373SS..G310 helixtrans-55.2-38.5-175.800000114.9V197 G203 L204V197-A201 WeakPolarHBondContact O-CB 3.48Å; V197-A201 PolarHBondContact O-N 2.93Å; A201-G203 PolarHBondContact O-N 3.26Å; A201-L204 PolarHBondContact O-N 3.46Å
202P82.9Confident86.1Confident113 Ų11360.9 Ų60.973%0.73435%0.353SS*.G310 helixtrans-64.9-19.2176-23.235000114.6D198 M200D198-P202 WeakPolarHBondContact O-CD 3.32Å; M200-P202 VanDerWaalsContact C-CD 3.46Å
203G77.8Confident85.9Confident71 Ų7166.6 Ų66.673%0.73238%0.375SS*.G310 helixtrans-97.5-0.6179.100000114.7M200 A201M200-G203 PolarHBondContact O-N 3.28Å; A201-G203 PolarHBondContact O-N 3.26Å
204L78.9Confident85.7Confident33 Ų3371.9 Ų71.917%0.17340%0.4CS..SBendtrans-83.9142.9178.1-64.5179.7000111.2A201 K206 L277 L284 L294A201-L204 PolarHBondContact O-N 3.46Å; L204-K206 PolarHBondContact O-N 3.02Å; L204-L277 HydrophobicContact CD1-CD2 4.07Å; L204-L284 HydrophobicContact CD1-CD1 4.41Å; L204-L294 HydrophobicContact CD1-CD1 4.25Å; L204-L294 HydrophobicContact CD2-CD1 3.77Å; L204-L294 HydrophobicContact CD2-CD2 3.86Å; L204-L294 HydrophobicContact CD2-CG 4.49Å
205P77.6Confident85.4Confident84 Ų8473.9 Ų73.955%0.54541%0.409SS..  trans-67.3115.8173.228.5-33.1000109.6T207P205-T207 PolarHBondContact O-N 3.46Å
206K76.8Confident85.3Confident203 Ų20370.9 Ų70.988%0.88340%0.395SS*.PPolyproline II helixtrans-65.6120.8172.5-63.6-173.2178.5-172.80108.9L204L204-K206 PolarHBondContact O-N 3.02Å
207T81.9Confident85.1Confident42 Ų4277.8 Ų77.826%0.25843%0.425SS..PPolyproline II helixtrans-83.8140.2173.6-48.50000108.8P205 D211 V212 A283 R287P205-T207 PolarHBondContact O-N 3.46Å; T207-D211 HydrophobicContact CG2-CB 4.3Å; T207-V212 HydrophobicContact CG2-CG2 3.63Å; T207-A283 HydrophobicContact CG2-CB 4.22Å; T207-R287 PolarHBondContact OG1-NH2 2.87Å; T207-R287 VanDerWaalsContact OG1-NH2 3.16Å
208D84.2Confident85Confident86 Ų8683.3 Ų83.346%0.4646%0.455SS..PPolyproline II helixtrans-70.9131.7173.9-165-52.4000109.6A210 D211 V212D208-A210 PolarHBondContact O-N 3.01Å; D208-A210 VanDerWaalsContact O-N 3.12Å; D208-A210 WeakPolarHBondContact OD1-CB 3.33Å; D208-A210 PolarHBondContact OD1-N 3.15Å; D208-D211 HydrophobicContact CB-CB 4.45Å; D208-D211 WeakPolarHBondContact O-CB 3.45Å; D208-D211 PolarHBondContact O-N 3.4Å; D208-V212 PolarHBondContact O-N 3.43Å
209P81.2Confident85Confident102 Ų10283.1 Ų83.166%0.66245%0.453SS*.Hα-helixtrans-57.3-22.7173.723.7-34.8000113.5K213P209-K213 VanDerWaalsContact O-CB 3.25Å; P209-K213 WeakPolarHBondContact O-CB 3.36Å; P209-K213 PolarHBondContact O-N 3.27Å
210A84.3Confident85Confident60 Ų6085.7 Ų85.750%0.49647%0.468SS..Hα-helixtrans-65.6-46.517100000112.2D208 V212 K213 E214D208-A210 PolarHBondContact O-N 3.01Å; D208-A210 VanDerWaalsContact O-N 3.12Å; D208-A210 WeakPolarHBondContact OD1-CB 3.33Å; D208-A210 PolarHBondContact OD1-N 3.15Å; A210-V212 PolarHBondContact O-N 3.21Å; A210-K213 CarbonylContact O-C 3.53Å; A210-K213 PolarHBondContact O-N 3.09Å; A210-E214 PolarHBondContact O-N 2.98Å
211D87.6Confident85.2Confident101 Ų10192.9 Ų92.954%0.5450%0.498SS..Hα-helixtrans-61.9-44.9178.7-65.6-22.6000110.7T207 D208 K213 E214 Q215T207-D211 HydrophobicContact CG2-CB 4.3Å; D208-D211 HydrophobicContact CB-CB 4.45Å; D208-D211 WeakPolarHBondContact O-CB 3.45Å; D208-D211 PolarHBondContact O-N 3.4Å; D211-K213 VanDerWaalsContact C-N 3.31Å; D211-K213 PolarHBondContact O-N 3.41Å; D211-E214 PolarHBondContact O-N 3.1Å; D211-E214 VanDerWaalsContact O-N 3.15Å; D211-Q215 WeakPolarHBondContact O-CB 3.37Å; D211-Q215 PolarHBondContact O-N 3.02Å
212V87.4Confident85.5Confident5 Ų592.7 Ų92.73%0.0349%0.493CS..Hα-helixtrans-59.1-44.6175.1-179.30000110.5T207 D208 A210 E214 Q215 L216 F230 A283 T286T207-V212 HydrophobicContact CG2-CG2 3.63Å; D208-V212 PolarHBondContact O-N 3.43Å; A210-V212 PolarHBondContact O-N 3.21Å; V212-E214 VanDerWaalsContact C-N 3.28Å; V212-E214 PolarHBondContact O-N 2.99Å; V212-Q215 PolarHBondContact O-N 2.7Å; V212-L216 HydrophobicContact CG1-CD1 4.1Å; V212-L216 WeakPolarHBondContact O-CD1 3.4Å; V212-L216 PolarHBondContact O-N 3.06Å; V212-F230 HydrophobicContact CG1-CD1 4.02Å; V212-F230 HydrophobicContact CG1-CE1 3.61Å; V212-F230 HydrophobicContact CG1-CE2 4.31Å; V212-F230 HydrophobicContact CG1-CZ 3.77Å; V212-A283 HydrophobicContact CG2-CB 3.55Å; V212-T286 HydrophobicContact CG1-CG2 4.12Å
213K85.9Confident85.9Confident134 Ų13489 Ų8958%0.58347%0.472SS*.Hα-helixtrans-67.3-27178.6-166163.3-169.9160.40112.6P209 A210 D211 K217P209-K213 VanDerWaalsContact O-CB 3.25Å; P209-K213 WeakPolarHBondContact O-CB 3.36Å; P209-K213 PolarHBondContact O-N 3.27Å; A210-K213 CarbonylContact O-C 3.53Å; A210-K213 PolarHBondContact O-N 3.09Å; D211-K213 VanDerWaalsContact C-N 3.31Å; D211-K213 PolarHBondContact O-N 3.41Å; K213-K217 WeakPolarHBondContact O-CD 3.46Å; K213-K217 VanDerWaalsContact O-CG 3.26Å; K213-K217 WeakPolarHBondContact O-CG 3.5Å; K213-K217 PolarHBondContact O-N 3.21Å
214E89.4Confident86.6Confident112 Ų11294.7 Ų94.752%0.52348%0.477SS..Hα-helixtrans-75.5-46.1169.2-156.4-166120.200112.2A210 D211 V212 L216 K217 N218A210-E214 PolarHBondContact O-N 2.98Å; D211-E214 PolarHBondContact O-N 3.1Å; D211-E214 VanDerWaalsContact O-N 3.15Å; V212-E214 VanDerWaalsContact C-N 3.28Å; V212-E214 PolarHBondContact O-N 2.99Å; E214-L216 PolarHBondContact O-N 2.9Å; E214-K217 WeakPolarHBondContact O-CB 3.42Å; E214-K217 PolarHBondContact O-N 2.98Å; E214-N218 WeakPolarHBondContact O-CB 3.47Å; E214-N218 PolarHBondContact O-N 3.49Å; E214-N218 PolarHBondContact O-ND2 3.48Å; E214-N218 PolarHBondContact OE1-ND2 2.98Å
215Q86.9Confident87.1Confident76 Ų7696.7 Ų96.736%0.35549%0.486SS..Hα-helixtrans-54.1-39.5176.9-166.7-1731900111.8D211 V212 N219 T286D211-Q215 WeakPolarHBondContact O-CB 3.37Å; D211-Q215 PolarHBondContact O-N 3.02Å; V212-Q215 PolarHBondContact O-N 2.7Å; Q215-N219 WeakPolarHBondContact O-CB 3.49Å; Q215-N219 PolarHBondContact O-N 3.28Å; Q215-T286 PolarHBondContact OE1-OG1 3.07Å
216L88.8Confident87.8Confident16 Ų1692.9 Ų92.98%0.08446%0.461CS..Hα-helixtrans-68.6-44.3174.1-93.965.8000112.9V212 E214 N218 N219 L222 A223 F230 T286V212-L216 HydrophobicContact CG1-CD1 4.1Å; V212-L216 WeakPolarHBondContact O-CD1 3.4Å; V212-L216 PolarHBondContact O-N 3.06Å; E214-L216 PolarHBondContact O-N 2.9Å; L216-N218 VanDerWaalsContact C-N 3.27Å; L216-N218 PolarHBondContact O-N 3.12Å; L216-N219 CarbonylContact O-C 3.23Å; L216-N219 VanDerWaalsContact O-C 3.25Å; L216-N219 PolarHBondContact O-N 3.35Å; L216-L222 HydrophobicContact CD1-CD2 4.15Å; L216-L222 HydrophobicContact CD1-CG 4.44Å; L216-A223 HydrophobicContact CB-CB 4.05Å; L216-A223 HydrophobicContact CG-CB 4.18Å; L216-A223 WeakPolarHBondContact O-CB 3.44Å; L216-F230 HydrophobicContact CD1-CE2 4.43Å; L216-F230 HydrophobicContact CD2-CD2 3.72Å; L216-F230 HydrophobicContact CD2-CE2 4.13Å; L216-T286 HydrophobicContact CD1-CG2 3.75Å
217K88.3Confident88.5Confident145 Ų14583.6 Ų83.663%0.6342%0.423SS*.Hα-helixtrans-57.2-43.2174.1-71.5165.2-169.9167.90111.4K213 E214K213-K217 WeakPolarHBondContact O-CD 3.46Å; K213-K217 VanDerWaalsContact O-CG 3.26Å; K213-K217 WeakPolarHBondContact O-CG 3.5Å; K213-K217 PolarHBondContact O-N 3.21Å; E214-K217 WeakPolarHBondContact O-CB 3.42Å; E214-K217 PolarHBondContact O-N 2.98Å
218N91.6Very high89Confident117 Ų11784.7 Ų84.763%0.62643%0.425SS*.Hα-helixtrans-70-32.8-179.5-67.1-18.9000111.5E214 L216E214-N218 WeakPolarHBondContact O-CB 3.47Å; E214-N218 PolarHBondContact O-N 3.49Å; E214-N218 PolarHBondContact O-ND2 3.48Å; E214-N218 PolarHBondContact OE1-ND2 2.98Å; L216-N218 VanDerWaalsContact C-N 3.27Å; L216-N218 PolarHBondContact O-N 3.12Å
219N91.2Very high89.4Confident73 Ų7380.6 Ų80.639%0.3940%0.403SS..  trans-110.284.6177.9-169.2-18.9000113.4Q215 L216 K221 L222 A223Q215-N219 WeakPolarHBondContact O-CB 3.49Å; Q215-N219 PolarHBondContact O-N 3.28Å; L216-N219 CarbonylContact O-C 3.23Å; L216-N219 VanDerWaalsContact O-C 3.25Å; L216-N219 PolarHBondContact O-N 3.35Å; N219-K221 PolarHBondContact O-N 3.06Å; N219-K221 PolarHBondContact OD1-N 3.09Å; N219-K221 VanDerWaalsContact OD1-N 3.15Å; N219-L222 HydrophobicContact CB-CB 3.92Å; N219-L222 PolarHBondContact O-N 3.18Å; N219-L222 PolarHBondContact OD1-N 3.49Å; N219-L222 VanDerWaalsContact OD1-N 3.1Å; N219-A223 PolarHBondContact O-N 3.04Å
220K92.9Very high89.8Confident170 Ų17078.6 Ų78.674%0.73938%0.384SS*.Hα-helixtrans-56.5-16.8176.8-63.3-177.1-178.6178.40115.6K224K220-K224 WeakPolarHBondContact O-CG 3.25Å
221K90.9Very high89.9Confident176 Ų17683.4 Ų83.477%0.76540%0.396SS*.Hα-helixtrans-83.5-43.5172.9-68.7-177179.9177.10111N219 K224 M225N219-K221 PolarHBondContact O-N 3.06Å; N219-K221 PolarHBondContact OD1-N 3.09Å; N219-K221 VanDerWaalsContact OD1-N 3.15Å; K221-K224 PolarHBondContact O-N 2.89Å; K221-M225 PolarHBondContact O-N 2.92Å
222L89.3Confident89.9Confident28 Ų2880.3 Ų80.315%0.14738%0.379CS..Hα-helixtrans-67.3-44.2178.2-171.465.9000111.6L216 N219 K224 M225 I226 T286L216-L222 HydrophobicContact CD1-CD2 4.15Å; L216-L222 HydrophobicContact CD1-CG 4.44Å; N219-L222 HydrophobicContact CB-CB 3.92Å; N219-L222 PolarHBondContact O-N 3.18Å; N219-L222 PolarHBondContact OD1-N 3.49Å; N219-L222 VanDerWaalsContact OD1-N 3.1Å; L222-K224 VanDerWaalsContact C-N 3.28Å; L222-K224 PolarHBondContact O-N 3.28Å; L222-M225 WeakPolarHBondContact O-CA 3.25Å; L222-M225 WeakPolarHBondContact O-CB 3.32Å; L222-M225 PolarHBondContact O-N 3.49Å; L222-I226 HydrophobicContact CD1-CD1 3.6Å; L222-I226 HydrophobicContact CD1-CG1 3.93Å; L222-I226 HydrophobicContact CG-CD1 3.95Å; L222-I226 HydrophobicContact CG-CG1 4.07Å; L222-I226 WeakPolarHBondContact O-CG1 3.31Å; L222-I226 PolarHBondContact O-N 2.84Å; L222-T286 HydrophobicContact CD2-CG2 4.05Å
223A91.3Very high89.9Confident35 Ų3583.3 Ų83.329%0.28940%0.4SS..Hα-helixtrans-59.6-36.3175.400000113.1L216 N219 M225 G227L216-A223 HydrophobicContact CB-CB 4.05Å; L216-A223 HydrophobicContact CG-CB 4.18Å; L216-A223 WeakPolarHBondContact O-CB 3.44Å; N219-A223 PolarHBondContact O-N 3.04Å; A223-M225 PolarHBondContact O-N 3.02Å; A223-G227 VanDerWaalsContact O-CA 3.22Å; A223-G227 WeakPolarHBondContact O-CA 3.48Å; A223-G227 PolarHBondContact O-N 2.98Å
224K91.9Very high89.7Confident191 Ų19182.9 Ų82.983%0.8340%0.404SS*.Hα-helixtrans-73.1-12173.4-77.4-171.9173.9-163.90114.5K220 K221 L222K220-K224 WeakPolarHBondContact O-CG 3.25Å; K221-K224 PolarHBondContact O-N 2.89Å; L222-K224 VanDerWaalsContact C-N 3.28Å; L222-K224 PolarHBondContact O-N 3.28Å
225M90.1Very high89.4Confident75 Ų7584.9 Ų84.937%0.36942%0.418SS..Hα-helixtrans-99.7-44.3-177.3-172.4-178.8-73.500111.7K221 L222 A223 H228 Y246K221-M225 PolarHBondContact O-N 2.92Å; L222-M225 WeakPolarHBondContact O-CA 3.25Å; L222-M225 WeakPolarHBondContact O-CB 3.32Å; L222-M225 PolarHBondContact O-N 3.49Å; A223-M225 PolarHBondContact O-N 3.02Å; M225-H228 PolarHBondContact O-CE1 3.28Å; M225-Y246 HydrophobicContact CG-CD1 3.86Å; M225-Y246 HydrophobicContact CG-CE1 3.44Å; M225-Y246 VanDerWaalsContact CG-CE1 3.44Å; M225-Y246 WeakPolarHBondContact O-CE1 3.26Å; M225-Y246 PolarHBondContact O-OH 3.08Å; M225-Y246 HydrophobicContact SD-CE1 4.49Å
226I93Very high89.4Confident4 Ų482.5 Ų82.52%0.02141%0.408CS..Hα-helixtrans-130.72.9-174.258.7174000114L222 H228 I229 F230 Y246 L285 T286L222-I226 HydrophobicContact CD1-CD1 3.6Å; L222-I226 HydrophobicContact CD1-CG1 3.93Å; L222-I226 HydrophobicContact CG-CD1 3.95Å; L222-I226 HydrophobicContact CG-CG1 4.07Å; L222-I226 WeakPolarHBondContact O-CG1 3.31Å; L222-I226 PolarHBondContact O-N 2.84Å; I226-H228 PolarHBondContact O-N 3.24Å; I226-I229 HydrophobicContact CB-CD1 4Å; I226-I229 HydrophobicContact CG2-CD1 4.03Å; I226-I229 WeakPolarHBondContact O-CB 3.48Å; I226-I229 WeakPolarHBondContact O-CG1 3.47Å; I226-I229 PolarHBondContact O-N 3.05Å; I226-I229 VanDerWaalsContact O-N 3.13Å; I226-F230 HydrophobicContact CB-CE2 4.48Å; I226-F230 HydrophobicContact CD1-CE2 3.98Å; I226-F230 HydrophobicContact CG1-CE2 4.13Å; I226-F230 WeakPolarHBondContact O-CD2 3.44Å; I226-Y246 HydrophobicContact CG2-CD1 3.65Å; I226-Y246 HydrophobicContact CG2-CD2 4.33Å; I226-Y246 HydrophobicContact CG2-CE1 4.27Å; I226-Y246 HydrophobicContact CG2-CG 3.68Å; I226-L285 HydrophobicContact CD1-CB 3.73Å; I226-T286 HydrophobicContact CD1-CG2 4.07Å
227G91.3Very high89.2Confident8 Ų886.3 Ų86.38%0.08243%0.434CS..G310 helixtrans-62.5-38.6-173.100000114.2A223 I229 F230 E231A223-G227 VanDerWaalsContact O-CA 3.22Å; A223-G227 WeakPolarHBondContact O-CA 3.48Å; A223-G227 PolarHBondContact O-N 2.98Å; G227-I229 PolarHBondContact O-N 2.9Å; G227-F230 PolarHBondContact O-N 3.37Å; G227-F230 VanDerWaalsContact O-N 3.09Å; G227-E231 PolarHBondContact O-N 2.95Å
228H92.2Very high89.3Confident65 Ų6586.5 Ų86.530%0.30143%0.431SS..G310 helixtrans-60.5-28.4176.461.8-65.1000112.9M225 I226 F230 E231 M232 E242 Y246M225-H228 PolarHBondContact O-CE1 3.28Å; I226-H228 PolarHBondContact O-N 3.24Å; H228-F230 VanDerWaalsContact C-N 3.26Å; H228-F230 PolarHBondContact O-N 3.46Å; H228-E231 PolarHBondContact O-N 3.18Å; H228-M232 WeakPolarHBondContact O-CG 3.48Å; H228-M232 PolarHBondContact O-N 2.92Å; H228-E242 IonicContact CD2-OE2 2.87Å; H228-E242 IonicContact CE1-OE2 2.76Å; H228-E242 IonicContact NE2-OE2 2.76Å; H228-E242 PolarHBondContact NE2-OE2 2.66Å; H228-Y246 AromaticContact CE1-CE2 3.95Å
229I92.3Very high89.2Confident0 Ų082.1 Ų82.10%041%0.405CS..G310 helixtrans-66.3-31.5178.2-48.4179000111.1I226 G227 E231 R239 E242 I243 Y246 L285I226-I229 HydrophobicContact CB-CD1 4Å; I226-I229 HydrophobicContact CG2-CD1 4.03Å; I226-I229 WeakPolarHBondContact O-CB 3.48Å; I226-I229 WeakPolarHBondContact O-CG1 3.47Å; I226-I229 PolarHBondContact O-N 3.05Å; I226-I229 VanDerWaalsContact O-N 3.13Å; G227-I229 PolarHBondContact O-N 2.9Å; I229-E231 VanDerWaalsContact C-N 3.32Å; I229-R239 HydrophobicContact CG2-CG 4.13Å; I229-E242 HydrophobicContact CD1-CB 4.19Å; I229-E242 HydrophobicContact CG1-CB 4.16Å; I229-I243 HydrophobicContact CG2-CD1 4.36Å; I229-I243 HydrophobicContact CG2-CG1 3.72Å; I229-Y246 HydrophobicContact CD1-CD2 3.63Å; I229-Y246 HydrophobicContact CD1-CE2 4.33Å; I229-Y246 HydrophobicContact CD1-CG 4.16Å; I229-L285 HydrophobicContact CD1-CD1 4.03Å; I229-L285 HydrophobicContact CG2-CD1 4.23Å
230F89.7Confident89.2Confident60 Ų6082.7 Ų82.726%0.26341%0.406SS..G310 helixtrans-85.6-2.7174.3-59.8-83.1000113.4V212 L216 I226 G227 H228 T282 T286V212-F230 HydrophobicContact CG1-CD1 4.02Å; V212-F230 HydrophobicContact CG1-CE1 3.61Å; V212-F230 HydrophobicContact CG1-CE2 4.31Å; V212-F230 HydrophobicContact CG1-CZ 3.77Å; L216-F230 HydrophobicContact CD1-CE2 4.43Å; L216-F230 HydrophobicContact CD2-CD2 3.72Å; L216-F230 HydrophobicContact CD2-CE2 4.13Å; I226-F230 HydrophobicContact CB-CE2 4.48Å; I226-F230 HydrophobicContact CD1-CE2 3.98Å; I226-F230 HydrophobicContact CG1-CE2 4.13Å; I226-F230 WeakPolarHBondContact O-CD2 3.44Å; G227-F230 PolarHBondContact O-N 3.37Å; G227-F230 VanDerWaalsContact O-N 3.09Å; H228-F230 VanDerWaalsContact C-N 3.26Å; H228-F230 PolarHBondContact O-N 3.46Å; F230-T282 VanDerWaalsContact CZ-O 3.29Å; F230-T282 WeakPolarHBondContact CZ-O 3.48Å; F230-T286 HydrophobicContact CE2-CG2 4.49Å; F230-T286 HydrophobicContact CZ-CG2 4.21Å
231E86.8Confident89.1Confident160 Ų16080.7 Ų80.775%0.74840%0.399SS*.THydrogen-bonded Turntrans-106.7-17.7176.9-65.5177.4162.500112.3G227 H228 I229G227-E231 PolarHBondContact O-N 2.95Å; H228-E231 PolarHBondContact O-N 3.18Å; I229-E231 VanDerWaalsContact C-N 3.32Å
232M87.4Confident89.2Confident37 Ų3774 Ų7418%0.18237%0.37CS..SBendtrans-77.7143.8169.7-69.3-173-66.600112H228 R239 E242H228-M232 WeakPolarHBondContact O-CG 3.48Å; H228-M232 PolarHBondContact O-N 2.92Å; M232-R239 HydrophobicContact CB-CB 4.26Å; M232-R239 HydrophobicContact CB-CG 4.41Å; M232-R239 HydrophobicContact CE-CB 4.05Å; M232-R239 HydrophobicContact CE-CG 4.32Å; M232-R239 PolarHBondContact O-NH1 3.42Å; M232-E242 HydrophobicContact CE-CB 4.17Å; M232-E242 HydrophobicContact CE-CG 4.18Å
233S87.1Confident89.5Confident68 Ų6873 Ų7348%0.47637%0.365SS..  trans-63149.1173.446.70000112.3D235 D236 R239S233-D235 PolarHBondContact O-N 3.18Å; S233-D236 WeakPolarHBondContact O-CB 3.39Å; S233-D236 PolarHBondContact O-N 3.49Å; S233-D236 VanDerWaalsContact O-N 3.15Å; S233-R239 VanDerWaalsContact O-CD 3.27Å; S233-R239 WeakPolarHBondContact O-CD 3.4Å
234D82.1Confident89.6Confident124 Ų12475.8 Ų75.866%0.66337%0.368SS*.THydrogen-bonded Turntrans-60-30.3177.4-67.2-99.6000112.7D236 R239D234-D236 PolarHBondContact O-N 3.03Å; D234-R239 IonicContact OD1-CZ 3.99Å; D234-R239 VanDerWaalsContact OD1-CZ 3.23Å; D234-R239 IonicContact OD1-NH1 3.98Å; D234-R239 PolarHBondContact OD1-NH1 3.16Å; D234-R239 IonicContact OD1-NH2 3.53Å; D234-R239 PolarHBondContact OD1-NH2 3.29Å; D234-R239 IonicContact OD2-CZ 2.65Å; D234-R239 IonicContact OD2-NH1 3.73Å; D234-R239 PolarHBondContact OD2-NH1 2.74Å; D234-R239 IonicContact OD2-NH2 3.8Å
235D82.8Confident89.6Confident154 Ų15471 Ų7182%0.82435%0.347SS*.THydrogen-bonded Turntrans-83.42.7178.1-47.8-76.8000114.9S233 P237S233-D235 PolarHBondContact O-N 3.18Å; D235-P237 WeakPolarHBondContact O-CD 3.45Å
236D86.8Confident89.8Confident27 Ų2769 Ų6914%0.14434%0.336CS..  trans-83.9117.2178-169.2-31.3000110.6S233 D234 R238 R239S233-D236 WeakPolarHBondContact O-CB 3.39Å; S233-D236 PolarHBondContact O-N 3.49Å; S233-D236 VanDerWaalsContact O-N 3.15Å; D234-D236 PolarHBondContact O-N 3.03Å; D236-R238 PolarHBondContact O-N 2.84Å; D236-R238 VanDerWaalsContact O-N 3.09Å; D236-R238 VanDerWaalsContact OD1-CB 3.24Å; D236-R238 WeakPolarHBondContact OD1-CB 3.42Å; D236-R238 VanDerWaalsContact OD1-CG 3.32Å; D236-R238 WeakPolarHBondContact OD1-CG 3.36Å; D236-R238 IonicContact OD1-CZ 2.79Å; D236-R238 PolarHBondContact OD1-N 3.2Å; D236-R238 IonicContact OD1-NE 3.62Å; D236-R238 PolarHBondContact OD1-NE 2.9Å; D236-R238 IonicContact OD1-NH2 2.65Å; D236-R238 IonicContact OD2-CZ 3.13Å; D236-R238 IonicContact OD2-NE 3.9Å; D236-R238 PolarHBondContact OD2-NE 3.01Å; D236-R238 IonicContact OD2-NH2 2.96Å; D236-R238 PolarHBondContact OD2-NH2 3.15Å; D236-R239 HydrophobicContact CB-CB 4.42Å; D236-R239 WeakPolarHBondContact O-CB 3.48Å; D236-R239 PolarHBondContact O-N 3.26Å
237P85.1Confident89.9Confident95 Ų9568.8 Ų68.862%0.61734%0.335SS*.Hα-helixtrans-59.5-26.8-178.823.9-34.1000113D235 R239 E240 E241D235-P237 WeakPolarHBondContact O-CD 3.45Å; P237-R239 PolarHBondContact O-N 3.38Å; P237-E240 WeakPolarHBondContact O-CB 2.91Å; P237-E240 PolarHBondContact O-N 3.27Å; P237-E240 VanDerWaalsContact O-N 3.14Å; P237-E241 PolarHBondContact O-N 2.98Å
238R88.9Confident90Very high150 Ų15069.1 Ų69.157%0.56634%0.337SS*.Hα-helixtrans-68.7-22.1176.9-54.3173.7-62.3162.14.2112.3D236 E240 E241 E242D236-R238 PolarHBondContact O-N 2.84Å; D236-R238 VanDerWaalsContact O-N 3.09Å; D236-R238 VanDerWaalsContact OD1-CB 3.24Å; D236-R238 WeakPolarHBondContact OD1-CB 3.42Å; D236-R238 VanDerWaalsContact OD1-CG 3.32Å; D236-R238 WeakPolarHBondContact OD1-CG 3.36Å; D236-R238 IonicContact OD1-CZ 2.79Å; D236-R238 PolarHBondContact OD1-N 3.2Å; D236-R238 IonicContact OD1-NE 3.62Å; D236-R238 PolarHBondContact OD1-NE 2.9Å; D236-R238 IonicContact OD1-NH2 2.65Å; D236-R238 IonicContact OD2-CZ 3.13Å; D236-R238 IonicContact OD2-NE 3.9Å; D236-R238 PolarHBondContact OD2-NE 3.01Å; D236-R238 IonicContact OD2-NH2 2.96Å; D236-R238 PolarHBondContact OD2-NH2 3.15Å; R238-E240 VanDerWaalsContact C-N 3.33Å; R238-E241 PolarHBondContact O-N 3.21Å; R238-E242 WeakPolarHBondContact O-CG 3.48Å; R238-E242 PolarHBondContact O-N 2.97Å
239R90.9Very high90.1Very high25 Ų2567.2 Ų67.29%0.09433%0.328CS..Hα-helixtrans-67.3-36.2173-174171.8162.1-176-23.3110.8I229 M232 S233 D234 D236 P237 I243I229-R239 HydrophobicContact CG2-CG 4.13Å; M232-R239 HydrophobicContact CB-CB 4.26Å; M232-R239 HydrophobicContact CB-CG 4.41Å; M232-R239 HydrophobicContact CE-CB 4.05Å; M232-R239 HydrophobicContact CE-CG 4.32Å; M232-R239 PolarHBondContact O-NH1 3.42Å; S233-R239 VanDerWaalsContact O-CD 3.27Å; S233-R239 WeakPolarHBondContact O-CD 3.4Å; D234-R239 IonicContact OD1-CZ 3.99Å; D234-R239 VanDerWaalsContact OD1-CZ 3.23Å; D234-R239 IonicContact OD1-NH1 3.98Å; D234-R239 PolarHBondContact OD1-NH1 3.16Å; D234-R239 IonicContact OD1-NH2 3.53Å; D234-R239 PolarHBondContact OD1-NH2 3.29Å; D234-R239 IonicContact OD2-CZ 2.65Å; D234-R239 IonicContact OD2-NH1 3.73Å; D234-R239 PolarHBondContact OD2-NH1 2.74Å; D234-R239 IonicContact OD2-NH2 3.8Å; D236-R239 HydrophobicContact CB-CB 4.42Å; D236-R239 WeakPolarHBondContact O-CB 3.48Å; D236-R239 PolarHBondContact O-N 3.26Å; P237-R239 PolarHBondContact O-N 3.38Å; R239-I243 HydrophobicContact CG-CD1 3.93Å; R239-I243 HydrophobicContact CG-CG1 4.5Å; R239-I243 VanDerWaalsContact O-CB 3.3Å; R239-I243 WeakPolarHBondContact O-CB 3.42Å; R239-I243 WeakPolarHBondContact O-CD1 3.2Å; R239-I243 WeakPolarHBondContact O-CG1 3.48Å; R239-I243 PolarHBondContact O-N 2.96Å
240E90.5Very high90Very high85 Ų8570.1 Ų70.140%0.39734%0.34SS..Hα-helixtrans-67.3-42.1175.6-154.8-172.3129.300111.7P237 R238 I243 R244 M279P237-E240 WeakPolarHBondContact O-CB 2.91Å; P237-E240 PolarHBondContact O-N 3.27Å; P237-E240 VanDerWaalsContact O-N 3.14Å; R238-E240 VanDerWaalsContact C-N 3.33Å; E240-I243 PolarHBondContact O-N 3.19Å; E240-R244 PolarHBondContact O-N 3.21Å; E240-R244 IonicContact OE1-CZ 3.59Å; E240-R244 IonicContact OE1-NH1 2.84Å; E240-R244 PolarHBondContact OE1-NH1 3Å; E240-R244 IonicContact OE1-NH2 3.9Å; E240-R244 PolarHBondContact OE1-NH2 3.15Å; E240-M279 HydrophobicContact CG-CE 4.45Å; E240-M279 HydrophobicContact CG-CG 4.33Å; E240-M279 HydrophobicContact CG-SD 3.65Å
241E91.5Very high89.9Confident128 Ų12869.5 Ų69.560%0.59835%0.35SS*.Hα-helixtrans-60.9-50.2175.1-63.2179.4165.500112.1P237 R238 I243 R244 K245P237-E241 PolarHBondContact O-N 2.98Å; R238-E241 PolarHBondContact O-N 3.21Å; E241-I243 PolarHBondContact O-N 3Å; E241-R244 PolarHBondContact O-N 3.41Å; E241-K245 WeakPolarHBondContact O-CB 3.39Å; E241-K245 PolarHBondContact O-N 2.98Å
242E93.4Very high89.9Confident36 Ų3664.4 Ų64.417%0.16832%0.324CS..Hα-helixtrans-66.5-35.8177.8-69.9-73.6116.800111.6H228 I229 M232 R238 K245 Y246H228-E242 IonicContact CD2-OE2 2.87Å; H228-E242 IonicContact CE1-OE2 2.76Å; H228-E242 IonicContact NE2-OE2 2.76Å; H228-E242 PolarHBondContact NE2-OE2 2.66Å; I229-E242 HydrophobicContact CD1-CB 4.19Å; I229-E242 HydrophobicContact CG1-CB 4.16Å; M232-E242 HydrophobicContact CE-CB 4.17Å; M232-E242 HydrophobicContact CE-CG 4.18Å; R238-E242 WeakPolarHBondContact O-CG 3.48Å; R238-E242 PolarHBondContact O-N 2.97Å; E242-K245 PolarHBondContact O-N 3.37Å; E242-K245 VanDerWaalsContact OE1-CD 3.27Å; E242-K245 WeakPolarHBondContact OE1-CD 3.43Å; E242-K245 WeakPolarHBondContact OE1-CE 3.12Å; E242-K245 IonicContact OE1-NZ 3.13Å; E242-K245 PolarHBondContact OE1-NZ 3Å; E242-K245 IonicContact OE2-NZ 3.23Å; E242-Y246 WeakPolarHBondContact O-CD2 3.21Å; E242-Y246 PolarHBondContact O-N 2.75Å; E242-Y246 WeakPolarHBondContact OE2-CE2 3.43Å
243I93.8Very high89.7Confident6 Ų668.2 Ų68.23%0.03134%0.34CS..Hα-helixtrans-58.6-50.3171.5-76.1166.1000110.7I229 R239 E240 E241 K245 Y246 S247 C278 M279 T282 L285I229-I243 HydrophobicContact CG2-CD1 4.36Å; I229-I243 HydrophobicContact CG2-CG1 3.72Å; R239-I243 HydrophobicContact CG-CD1 3.93Å; R239-I243 HydrophobicContact CG-CG1 4.5Å; R239-I243 VanDerWaalsContact O-CB 3.3Å; R239-I243 WeakPolarHBondContact O-CB 3.42Å; R239-I243 WeakPolarHBondContact O-CD1 3.2Å; R239-I243 WeakPolarHBondContact O-CG1 3.48Å; R239-I243 PolarHBondContact O-N 2.96Å; E240-I243 PolarHBondContact O-N 3.19Å; E241-I243 PolarHBondContact O-N 3Å; I243-K245 VanDerWaalsContact C-N 3.31Å; I243-K245 PolarHBondContact O-N 2.76Å; I243-Y246 PolarHBondContact O-N 3.46Å; I243-S247 WeakPolarHBondContact O-CB 3.36Å; I243-S247 PolarHBondContact O-N 3.35Å; I243-S247 PolarHBondContact O-OG 3.2Å; I243-S247 VanDerWaalsContact O-OG 3.05Å; I243-C278 HydrophobicContact CG2-CB 3.6Å; I243-M279 HydrophobicContact CG2-CG 4.06Å; I243-T282 HydrophobicContact CD1-CG2 3.81Å; I243-T282 HydrophobicContact CG1-CG2 4.47Å; I243-L285 HydrophobicContact CG1-CD1 4.34Å
244R94Very high89.3Confident93 Ų9368 Ų6835%0.35133%0.334SS..Hα-helixtrans-58.2-42.9177.3-74.8-161.4178.881.56.8112.3E240 E241 Y246 S247 A248 A275E240-R244 PolarHBondContact O-N 3.21Å; E240-R244 IonicContact OE1-CZ 3.59Å; E240-R244 IonicContact OE1-NH1 2.84Å; E240-R244 PolarHBondContact OE1-NH1 3Å; E240-R244 IonicContact OE1-NH2 3.9Å; E240-R244 PolarHBondContact OE1-NH2 3.15Å; E241-R244 PolarHBondContact O-N 3.41Å; R244-Y246 PolarHBondContact O-N 3.1Å; R244-S247 PolarHBondContact O-OG 2.92Å; R244-A248 PolarHBondContact O-N 3Å; R244-A275 HydrophobicContact CG-CB 3.89Å
245K92.4Very high89.1Confident90 Ų9064.6 Ų64.639%0.39132%0.319SS..Hα-helixtrans-63.8-36.5-178.5177.6179.4170.4-173.60113.5E241 E242 I243 F253E241-K245 WeakPolarHBondContact O-CB 3.39Å; E241-K245 PolarHBondContact O-N 2.98Å; E242-K245 PolarHBondContact O-N 3.37Å; E242-K245 VanDerWaalsContact OE1-CD 3.27Å; E242-K245 WeakPolarHBondContact OE1-CD 3.43Å; E242-K245 WeakPolarHBondContact OE1-CE 3.12Å; E242-K245 IonicContact OE1-NZ 3.13Å; E242-K245 PolarHBondContact OE1-NZ 3Å; E242-K245 IonicContact OE2-NZ 3.23Å; I243-K245 VanDerWaalsContact C-N 3.31Å; I243-K245 PolarHBondContact O-N 2.76Å; K245-F253 HydrophobicContact CG-CD1 3.81Å; K245-F253 HydrophobicContact CG-CE1 3.75Å
246Y93.9Very high88.3Confident33 Ų3367.1 Ų67.113%0.12932%0.323CS..Hα-helixtrans-95.2-28.5-179.7-76.3-78.7000114.6M225 I226 H228 I229 E242 I243 R244 A248 F253 R288M225-Y246 HydrophobicContact CG-CD1 3.86Å; M225-Y246 HydrophobicContact CG-CE1 3.44Å; M225-Y246 VanDerWaalsContact CG-CE1 3.44Å; M225-Y246 WeakPolarHBondContact O-CE1 3.26Å; M225-Y246 PolarHBondContact O-OH 3.08Å; M225-Y246 HydrophobicContact SD-CE1 4.49Å; I226-Y246 HydrophobicContact CG2-CD1 3.65Å; I226-Y246 HydrophobicContact CG2-CD2 4.33Å; I226-Y246 HydrophobicContact CG2-CE1 4.27Å; I226-Y246 HydrophobicContact CG2-CG 3.68Å; H228-Y246 AromaticContact CE1-CE2 3.95Å; I229-Y246 HydrophobicContact CD1-CD2 3.63Å; I229-Y246 HydrophobicContact CD1-CE2 4.33Å; I229-Y246 HydrophobicContact CD1-CG 4.16Å; E242-Y246 WeakPolarHBondContact O-CD2 3.21Å; E242-Y246 PolarHBondContact O-N 2.75Å; E242-Y246 WeakPolarHBondContact OE2-CE2 3.43Å; I243-Y246 PolarHBondContact O-N 3.46Å; R244-Y246 PolarHBondContact O-N 3.1Å; Y246-A248 VanDerWaalsContact C-N 3.27Å; Y246-A248 PolarHBondContact O-N 3Å; Y246-F253 HydrophobicContact CD1-CE1 4.02Å; Y246-F253 HydrophobicContact CD1-CZ 4.14Å; Y246-F253 AromaticContact CE1-CE1 3.8Å; Y246-F253 HydrophobicContact CE1-CE1 3.8Å; Y246-F253 AromaticContact CE1-CZ 3.44Å; Y246-F253 HydrophobicContact CE1-CZ 3.44Å; Y246-F253 VanDerWaalsContact CE1-CZ 3.44Å; Y246-F253 AromaticContact CZ-CZ 3.67Å; Y246-R288 PolarHBondContact O-NH1 3.42Å
247S95.3Very high87.5Confident1 Ų176.9 Ų76.91%0.00736%0.358CS..Hα-helixtrans-68.1-27.8173.772.40000112.5I243 R244 I249 A275I243-S247 WeakPolarHBondContact O-CB 3.36Å; I243-S247 PolarHBondContact O-N 3.35Å; I243-S247 PolarHBondContact O-OG 3.2Å; I243-S247 VanDerWaalsContact O-OG 3.05Å; R244-S247 PolarHBondContact O-OG 2.92Å; S247-I249 WeakPolarHBondContact O-CG1 3.37Å; S247-I249 PolarHBondContact O-N 3.31Å; S247-A275 WeakPolarHBondContact OG-CA 3.27Å; S247-A275 PolarHBondContact OG-N 3.42Å
248A93.9Very high86.3Confident14 Ų1477.1 Ų77.112%0.11635%0.346CS..  trans-41.5127.8179.100000112.5R244 Y246 R252 R288R244-A248 PolarHBondContact O-N 3Å; Y246-A248 VanDerWaalsContact C-N 3.27Å; Y246-A248 PolarHBondContact O-N 3Å; A248-R252 WeakPolarHBondContact O-CD 3.42Å; A248-R252 WeakPolarHBondContact O-CG 3.08Å; A248-R252 PolarHBondContact O-NE 3.1Å; A248-R288 PolarHBondContact O-NH2 3.31Å
249I93.5Very high84.8Confident25 Ų2577.2 Ų77.213%0.12836%0.358CS..  trans-102.2-48.3-176.1-60.1-162.6000109.9S247 R252 V270 N271 A274 F292 A295S247-I249 WeakPolarHBondContact O-CG1 3.37Å; S247-I249 PolarHBondContact O-N 3.31Å; I249-R252 WeakPolarHBondContact O-CG 3.5Å; I249-V270 HydrophobicContact CB-CG1 4.2Å; I249-V270 HydrophobicContact CD1-CG1 3.89Å; I249-V270 HydrophobicContact CG1-CG1 4.43Å; I249-V270 HydrophobicContact CG2-CG1 4.24Å; I249-N271 PolarHBondContact N-OD1 2.84Å; I249-A274 HydrophobicContact CD1-CB 3.8Å; I249-A274 HydrophobicContact CG1-CB 3.92Å; I249-F292 HydrophobicContact CD1-CB 4.11Å; I249-F292 HydrophobicContact CD1-CD2 3.97Å; I249-F292 HydrophobicContact CG2-CD2 3.67Å; I249-F292 HydrophobicContact CG2-CE2 4.04Å; I249-A295 HydrophobicContact CD1-CB 4.08Å
250Y91Very high83.5Confident62 Ų6280 Ų8024%0.24340%0.395CS..SBendtrans-102.7151.2172.8-59.3-79.2000110.2R252 E267 V270 N271Y250-R252 VanDerWaalsContact C-N 3.3Å; Y250-R252 PolarHBondContact O-N 3.32Å; Y250-E267 HydrophobicContact CD1-CB 4.45Å; Y250-E267 HydrophobicContact CD1-CG 3.72Å; Y250-E267 HydrophobicContact CD2-CB 3.83Å; Y250-E267 HydrophobicContact CD2-CG 3.84Å; Y250-E267 HydrophobicContact CE1-CG 4.14Å; Y250-E267 HydrophobicContact CE2-CG 4.24Å; Y250-E267 HydrophobicContact CG-CB 3.78Å; Y250-E267 HydrophobicContact CG-CG 3.56Å; Y250-V270 HydrophobicContact CD2-CB 4.17Å; Y250-V270 HydrophobicContact CD2-CG1 4.18Å; Y250-V270 HydrophobicContact CE2-CB 3.84Å; Y250-V270 HydrophobicContact CE2-CG1 3.75Å; Y250-V270 HydrophobicContact CE2-CG2 4.22Å; Y250-N271 PolarHBondContact N-OD1 2.95Å; Y250-N271 PolarHBondContact O-ND2 2.9Å
251G86.9Confident82.9Confident47 Ų4783.1 Ų83.149%0.48541%0.407SS..SBendtrans6625.6179.700000115.1
252R85.8Confident82.4Confident52 Ų5283.8 Ų83.820%0.19641%0.41CS..  trans-61.6135-176.3-51-175.967.1-125.6-12.6112.4A248 I249 Y250 D254 S255 R288A248-R252 WeakPolarHBondContact O-CD 3.42Å; A248-R252 WeakPolarHBondContact O-CG 3.08Å; A248-R252 PolarHBondContact O-NE 3.1Å; I249-R252 WeakPolarHBondContact O-CG 3.5Å; Y250-R252 VanDerWaalsContact C-N 3.3Å; Y250-R252 PolarHBondContact O-N 3.32Å; R252-D254 VanDerWaalsContact CB-OD1 3.23Å; R252-D254 WeakPolarHBondContact CB-OD1 3.36Å; R252-D254 VanDerWaalsContact CZ-CG 3.42Å; R252-D254 IonicContact CZ-OD1 3.33Å; R252-D254 IonicContact CZ-OD2 3.3Å; R252-D254 IonicContact NE-OD1 2.7Å; R252-D254 IonicContact NH1-OD1 2.66Å; R252-D254 PolarHBondContact NH1-OD1 3.14Å; R252-D254 IonicContact NH1-OD2 3.45Å; R252-D254 PolarHBondContact NH1-OD2 2.94Å; R252-D254 VanDerWaalsContact NH2-CG 3.32Å; R252-D254 IonicContact NH2-OD1 2.66Å; R252-D254 PolarHBondContact NH2-OD1 3.5Å; R252-D254 IonicContact NH2-OD2 3.6Å; R252-D254 PolarHBondContact NH2-OD2 2.9Å; R252-D254 PolarHBondContact O-N 3.36Å; R252-D254 VanDerWaalsContact O-N 3.17Å; R252-S255 WeakPolarHBondContact O-CB 3.45Å; R252-S255 PolarHBondContact O-N 3.49Å; R252-R288 VanDerWaalsContact CD-NH2 3.3Å; R252-R288 VanDerWaalsContact NE-NH2 3.14Å
253F83.9Confident82.2Confident117 Ų11783.7 Ų83.751%0.51341%0.41SS..THydrogen-bonded Turntrans-63.4-19.518076.5-90.2000114.8K245 Y246K245-F253 HydrophobicContact CG-CD1 3.81Å; K245-F253 HydrophobicContact CG-CE1 3.75Å; Y246-F253 HydrophobicContact CD1-CE1 4.02Å; Y246-F253 HydrophobicContact CD1-CZ 4.14Å; Y246-F253 AromaticContact CE1-CE1 3.8Å; Y246-F253 HydrophobicContact CE1-CE1 3.8Å; Y246-F253 AromaticContact CE1-CZ 3.44Å; Y246-F253 HydrophobicContact CE1-CZ 3.44Å; Y246-F253 VanDerWaalsContact CE1-CZ 3.44Å; Y246-F253 AromaticContact CZ-CZ 3.67Å
254D78Confident82Confident64 Ų6487 Ų8734%0.34243%0.431SS..THydrogen-bonded Turntrans-91.9-0.3175.969.1-19.8000113.2R252 K256R252-D254 VanDerWaalsContact CB-OD1 3.23Å; R252-D254 WeakPolarHBondContact CB-OD1 3.36Å; R252-D254 VanDerWaalsContact CZ-CG 3.42Å; R252-D254 IonicContact CZ-OD1 3.33Å; R252-D254 IonicContact CZ-OD2 3.3Å; R252-D254 IonicContact NE-OD1 2.7Å; R252-D254 IonicContact NH1-OD1 2.66Å; R252-D254 PolarHBondContact NH1-OD1 3.14Å; R252-D254 IonicContact NH1-OD2 3.45Å; R252-D254 PolarHBondContact NH1-OD2 2.94Å; R252-D254 VanDerWaalsContact NH2-CG 3.32Å; R252-D254 IonicContact NH2-OD1 2.66Å; R252-D254 PolarHBondContact NH2-OD1 3.5Å; R252-D254 IonicContact NH2-OD2 3.6Å; R252-D254 PolarHBondContact NH2-OD2 2.9Å; R252-D254 PolarHBondContact O-N 3.36Å; R252-D254 VanDerWaalsContact O-N 3.17Å; D254-K256 PolarHBondContact O-N 3.25Å
255S77.6Confident81.7Confident52 Ų5287.5 Ų87.536%0.36444%0.44SS..  trans-85.6100.3-177.3-1730000111.8R252 R257R252-S255 WeakPolarHBondContact O-CB 3.45Å; R252-S255 PolarHBondContact O-N 3.49Å; S255-R257 PolarHBondContact O-N 2.95Å
256K68.1Low81.7Confident208 Ų20886.8 Ų86.890%0.90444%0.438SS*.THydrogen-bonded Turntrans-65.832.4176.9-56.8-166.8175.3-165.20115.5D254D254-K256 PolarHBondContact O-N 3.25Å
257R69.4Low81.6Confident232 Ų23286 Ų8688%0.87544%0.436SS*.THydrogen-bonded Turntrans-143.90.1-173.7-66.1-169.2-179.3-133.32.9115.1S255S255-R257 PolarHBondContact O-N 2.95Å
258R60.1Low81.5Confident99 Ų9987 Ų8737%0.37444%0.441SS..  trans-149.994.2177.1-86.6-154.7-174-164.722.5112.3E267R258-E267 IonicContact CZ-OE1 3.5Å; R258-E267 IonicContact NH1-OE1 2.66Å; R258-E267 IonicContact NH2-OE1 3.3Å; R258-E267 PolarHBondContact NH2-OE1 3.18Å
259D56.9Low81.4Confident152 Ų15286.6 Ų86.681%0.81344%0.437SS*.SBendtrans-107.9132.8158.4-49.3-62.5000107.1
260G63.9Low81.5Confident84 Ų8485.4 Ų85.487%0.86643%0.431SS*.SBendtrans77.521.6172.600000118.4
261K76.6Confident81.7Confident151 Ų15183.7 Ų83.766%0.65743%0.426SS*.  trans-112.3109.7166.8-76.5-168.9176.2-173.50111.2
262H81.8Confident82.1Confident142 Ų14283 Ų8366%0.65741%0.41SS*.PPolyproline II helixtrans-49.1146.3172.6-56.3-75.7000111.6E183E183-H262 IonicContact OE1-ND1 2.99Å
263L88.4Confident82.6Confident33 Ų3380.5 Ų80.517%0.17340%0.4CS..PPolyproline II helixtrans-81.5139.1177.1-63-177.8000110.2E267 L268 N271L263-E267 HydrophobicContact CB-CB 4Å; L263-E267 HydrophobicContact CD2-CB 4.15Å; L263-L268 HydrophobicContact CB-CD2 3.85Å; L263-L268 HydrophobicContact CB-CG 3.87Å; L263-L268 HydrophobicContact CD1-CD2 3.98Å; L263-L268 HydrophobicContact CG-CD2 4.5Å; L263-N271 WeakPolarHBondContact CD1-ND2 3.4Å
264T90Very high83.3Confident76 Ų7674.9 Ų74.947%0.46638%0.376SS..PPolyproline II helixtrans-68.1158.1169.258.20000110.9H266 E267 L268T264-H266 PolarHBondContact O-N 3.13Å; T264-H266 VanDerWaalsContact O-N 3.08Å; T264-E267 WeakPolarHBondContact CB-OE2 3.11Å; T264-E267 WeakPolarHBondContact CG2-OE2 3.36Å; T264-E267 PolarHBondContact N-OE2 3.24Å; T264-E267 WeakPolarHBondContact O-CA 3.25Å; T264-E267 PolarHBondContact O-N 3.01Å; T264-E267 VanDerWaalsContact OG1-CG 3.29Å; T264-E267 WeakPolarHBondContact OG1-CG 3.36Å; T264-E267 PolarHBondContact OG1-N 2.9Å; T264-E267 PolarHBondContact OG1-OE2 3.05Å; T264-L268 PolarHBondContact O-N 3.12Å
265L88.3Confident84.1Confident104 Ų10472 Ų7255%0.54536%0.361SS..Hα-helixtrans-51.2-35.6175.7-177.362.8000112.9L185 T269L185-L265 HydrophobicContact CD2-CD1 3.62Å; L265-T269 WeakPolarHBondContact O-CB 3.29Å; L265-T269 PolarHBondContact O-N 2.65Å; L265-T269 PolarHBondContact O-OG1 2.95Å
266H91.4Very high85Confident74 Ų7470.3 Ų70.334%0.34335%0.347SS..Hα-helixtrans-68.4-45.9174.3178.947.5000112.5T264 L268 T269 V270 S299T264-H266 PolarHBondContact O-N 3.13Å; T264-H266 VanDerWaalsContact O-N 3.08Å; H266-L268 VanDerWaalsContact C-N 3.32Å; H266-L268 PolarHBondContact O-N 3.46Å; H266-T269 PolarHBondContact O-N 3.22Å; H266-V270 VanDerWaalsContact CE1-CG2 3.5Å; H266-V270 WeakPolarHBondContact CE1-CG2 3.18Å; H266-V270 WeakPolarHBondContact O-CG2 3.35Å; H266-V270 PolarHBondContact O-N 2.86Å; H266-S299 PolarHBondContact CE1-OG 3.22Å; H266-S299 PolarHBondContact ND1-OG 3.05Å
267E92.8Very high86.2Confident17 Ų1760.5 Ų60.58%0.07931%0.305CS..Hα-helixtrans-61.4-40.8177.2-70.4167.4120.700111.2Y250 R258 L263 T264 N271Y250-E267 HydrophobicContact CD1-CB 4.45Å; Y250-E267 HydrophobicContact CD1-CG 3.72Å; Y250-E267 HydrophobicContact CD2-CB 3.83Å; Y250-E267 HydrophobicContact CD2-CG 3.84Å; Y250-E267 HydrophobicContact CE1-CG 4.14Å; Y250-E267 HydrophobicContact CE2-CG 4.24Å; Y250-E267 HydrophobicContact CG-CB 3.78Å; Y250-E267 HydrophobicContact CG-CG 3.56Å; R258-E267 IonicContact CZ-OE1 3.5Å; R258-E267 IonicContact NH1-OE1 2.66Å; R258-E267 IonicContact NH2-OE1 3.3Å; R258-E267 PolarHBondContact NH2-OE1 3.18Å; L263-E267 HydrophobicContact CB-CB 4Å; L263-E267 HydrophobicContact CD2-CB 4.15Å; T264-E267 WeakPolarHBondContact CB-OE2 3.11Å; T264-E267 WeakPolarHBondContact CG2-OE2 3.36Å; T264-E267 PolarHBondContact N-OE2 3.24Å; T264-E267 WeakPolarHBondContact O-CA 3.25Å; T264-E267 PolarHBondContact O-N 3.01Å; T264-E267 VanDerWaalsContact OG1-CG 3.29Å; T264-E267 WeakPolarHBondContact OG1-CG 3.36Å; T264-E267 PolarHBondContact OG1-N 2.9Å; T264-E267 PolarHBondContact OG1-OE2 3.05Å; E267-N271 WeakPolarHBondContact O-CB 3.26Å; E267-N271 PolarHBondContact O-N 3.28Å
268L92.7Very high87.4Confident22 Ų2249.5 Ų49.512%0.11526%0.263CS..Hα-helixtrans-60.6-49.2170.6-68.2173.3000111.8E183 L185 L263 T264 H266 V270 N271 E272E183-L268 WeakPolarHBondContact O-CD2 3.17Å; L185-L268 HydrophobicContact CD1-CB 4.11Å; L185-L268 HydrophobicContact CG-CB 4.11Å; L263-L268 HydrophobicContact CB-CD2 3.85Å; L263-L268 HydrophobicContact CB-CG 3.87Å; L263-L268 HydrophobicContact CD1-CD2 3.98Å; L263-L268 HydrophobicContact CG-CD2 4.5Å; T264-L268 PolarHBondContact O-N 3.12Å; H266-L268 VanDerWaalsContact C-N 3.32Å; H266-L268 PolarHBondContact O-N 3.46Å; L268-V270 VanDerWaalsContact C-N 3.3Å; L268-V270 PolarHBondContact O-N 2.79Å; L268-N271 PolarHBondContact O-N 3.47Å; L268-N271 VanDerWaalsContact O-N 3.14Å; L268-E272 PolarHBondContact O-N 3.47Å
269T93.3Very high88.9Confident5 Ų547.1 Ų47.13%0.03126%0.257CS..Hα-helixtrans-61.5-37.1-179-51.30000112.1V193 L265 H266 A273 V302V193-T269 HydrophobicContact CG2-CG2 4.15Å; L265-T269 WeakPolarHBondContact O-CB 3.29Å; L265-T269 PolarHBondContact O-N 2.65Å; L265-T269 PolarHBondContact O-OG1 2.95Å; H266-T269 PolarHBondContact O-N 3.22Å; T269-A273 VanDerWaalsContact O-CB 3.27Å; T269-A273 WeakPolarHBondContact O-CB 3.45Å; T269-A273 PolarHBondContact O-N 3.39Å; T269-V302 HydrophobicContact CG2-CB 4.23Å; T269-V302 HydrophobicContact CG2-CG1 4Å
270V95.4Very high90.5Very high0 Ų045.8 Ų45.80%024%0.24CC..Hα-helixtrans-71.7-38.9175.3174.10000111.3I249 Y250 H266 L268 A274 A295I249-V270 HydrophobicContact CB-CG1 4.2Å; I249-V270 HydrophobicContact CD1-CG1 3.89Å; I249-V270 HydrophobicContact CG1-CG1 4.43Å; I249-V270 HydrophobicContact CG2-CG1 4.24Å; Y250-V270 HydrophobicContact CD2-CB 4.17Å; Y250-V270 HydrophobicContact CD2-CG1 4.18Å; Y250-V270 HydrophobicContact CE2-CB 3.84Å; Y250-V270 HydrophobicContact CE2-CG1 3.75Å; Y250-V270 HydrophobicContact CE2-CG2 4.22Å; H266-V270 VanDerWaalsContact CE1-CG2 3.5Å; H266-V270 WeakPolarHBondContact CE1-CG2 3.18Å; H266-V270 WeakPolarHBondContact O-CG2 3.35Å; H266-V270 PolarHBondContact O-N 2.86Å; L268-V270 VanDerWaalsContact C-N 3.3Å; L268-V270 PolarHBondContact O-N 2.79Å; V270-A274 VanDerWaalsContact O-CB 3.32Å; V270-A274 WeakPolarHBondContact O-CB 3.44Å; V270-A274 PolarHBondContact O-N 3.46Å; V270-A295 HydrophobicContact CG1-CB 3.99Å
271N95.4Very high91.7Very high27 Ų2743.3 Ų43.314%0.14421%0.207CC..Hα-helixtrans-64.2-45.6176-82.11.3000112.1I249 Y250 L263 E267 L268 A274 A275I249-N271 PolarHBondContact N-OD1 2.84Å; Y250-N271 PolarHBondContact N-OD1 2.95Å; Y250-N271 PolarHBondContact O-ND2 2.9Å; L263-N271 WeakPolarHBondContact CD1-ND2 3.4Å; E267-N271 WeakPolarHBondContact O-CB 3.26Å; E267-N271 PolarHBondContact O-N 3.28Å; L268-N271 PolarHBondContact O-N 3.47Å; L268-N271 VanDerWaalsContact O-N 3.14Å; N271-A274 PolarHBondContact O-N 3.32Å; N271-A275 PolarHBondContact O-N 3.29Å
272E95.3Very high92.4Very high31 Ų3137.3 Ų37.315%0.14518%0.183CC..Hα-helixtrans-65.4-43177.6-177.256.4-157.400111.4L185 V190 V193 L268 A274 A275 Q276L185-E272 HydrophobicContact CD1-CB 3.65Å; L185-E272 HydrophobicContact CD1-CG 4.18Å; V190-E272 HydrophobicContact CG2-CG 4.48Å; V193-E272 HydrophobicContact CG1-CG 4.31Å; L268-E272 PolarHBondContact O-N 3.47Å; E272-A274 VanDerWaalsContact C-N 3.29Å; E272-A274 PolarHBondContact O-N 3.25Å; E272-A275 PolarHBondContact O-N 3.31Å; E272-Q276 HydrophobicContact CG-CG 4.39Å; E272-Q276 WeakPolarHBondContact O-CB 3.43Å; E272-Q276 VanDerWaalsContact O-CG 3.31Å; E272-Q276 WeakPolarHBondContact O-CG 3.48Å; E272-Q276 PolarHBondContact O-N 3.47Å; E272-Q276 VanDerWaalsContact OE1-CG 3.29Å; E272-Q276 WeakPolarHBondContact OE1-CG 3.45Å; E272-Q276 PolarHBondContact OE1-NE2 3.26Å
273A96.3Very high92.9Very high0 Ų030.6 Ų30.60%015%0.153CC..Hα-helixtrans-60.4-37.9173.700000112.7V193 T269 L277 A295 I298V193-A273 HydrophobicContact CG1-CB 3.99Å; T269-A273 VanDerWaalsContact O-CB 3.27Å; T269-A273 WeakPolarHBondContact O-CB 3.45Å; T269-A273 PolarHBondContact O-N 3.39Å; A273-L277 WeakPolarHBondContact O-CB 3.37Å; A273-L277 WeakPolarHBondContact O-CD1 3.41Å; A273-L277 WeakPolarHBondContact O-CG 3.47Å; A273-L277 PolarHBondContact O-N 3.02Å; A273-A295 HydrophobicContact CB-CB 4.07Å; A273-I298 HydrophobicContact CB-CB 3.96Å; A273-I298 HydrophobicContact CB-CG2 3.67Å
274A96.9Very high93.1Very high0 Ų029 Ų290%014%0.144CC..Hα-helixtrans-68.1-41.6175.500000112.3I249 V270 N271 E272 C278 L291 A295I249-A274 HydrophobicContact CD1-CB 3.8Å; I249-A274 HydrophobicContact CG1-CB 3.92Å; V270-A274 VanDerWaalsContact O-CB 3.32Å; V270-A274 WeakPolarHBondContact O-CB 3.44Å; V270-A274 PolarHBondContact O-N 3.46Å; N271-A274 PolarHBondContact O-N 3.32Å; E272-A274 VanDerWaalsContact C-N 3.29Å; E272-A274 PolarHBondContact O-N 3.25Å; A274-C278 WeakPolarHBondContact O-CB 3.4Å; A274-C278 PolarHBondContact O-N 3.4Å; A274-C278 PolarHBondContact O-SG 3.36Å; A274-L291 HydrophobicContact CB-CD1 4.02Å; A274-L291 HydrophobicContact CB-CD2 4.42Å; A274-L291 HydrophobicContact CB-CG 4.19Å; A274-A295 HydrophobicContact CB-CB 3.9Å
275A95.7Very high93.3Very high3 Ų326.2 Ų26.23%0.02513%0.126CC..Hα-helixtrans-61-50.7174.300000112.1R244 S247 N271 E272 L277 C278 M279R244-A275 HydrophobicContact CG-CB 3.89Å; S247-A275 WeakPolarHBondContact OG-CA 3.27Å; S247-A275 PolarHBondContact OG-N 3.42Å; N271-A275 PolarHBondContact O-N 3.29Å; E272-A275 PolarHBondContact O-N 3.31Å; A275-L277 VanDerWaalsContact C-N 3.32Å; A275-L277 PolarHBondContact O-N 3.26Å; A275-C278 PolarHBondContact O-N 3.22Å; A275-C278 VanDerWaalsContact O-N 3.13Å; A275-M279 HydrophobicContact CB-CE 4Å; A275-M279 WeakPolarHBondContact O-CG 3.38Å; A275-M279 PolarHBondContact O-N 2.97Å
276Q95.6Very high93.5Very high17 Ų1722.1 Ų22.18%0.07911%0.106CC..Hα-helixtrans-62.8-37.2180-67.3-66.4-12.500112.1V193 L194 V197 E272 M279 R280V193-Q276 HydrophobicContact CG1-CB 4.46Å; V193-Q276 HydrophobicContact CG1-CG 4.24Å; L194-Q276 HydrophobicContact CD2-CG 4.27Å; L194-Q276 VanDerWaalsContact CD2-OE1 3.27Å; V197-Q276 HydrophobicContact CB-CB 4.44Å; V197-Q276 HydrophobicContact CG1-CB 4.33Å; V197-Q276 HydrophobicContact CG2-CB 3.75Å; E272-Q276 HydrophobicContact CG-CG 4.39Å; E272-Q276 WeakPolarHBondContact O-CB 3.43Å; E272-Q276 VanDerWaalsContact O-CG 3.31Å; E272-Q276 WeakPolarHBondContact O-CG 3.48Å; E272-Q276 PolarHBondContact O-N 3.47Å; E272-Q276 VanDerWaalsContact OE1-CG 3.29Å; E272-Q276 WeakPolarHBondContact OE1-CG 3.45Å; E272-Q276 PolarHBondContact OE1-NE2 3.26Å; Q276-M279 HydrophobicContact CG-CE 4.31Å; Q276-M279 PolarHBondContact O-N 2.93Å; Q276-R280 WeakPolarHBondContact O-CG 3.21Å; Q276-R280 PolarHBondContact O-N 2.82Å
277L94.4Very high93.5Very high2 Ų220.9 Ų20.91%0.0110%0.098CC..Hα-helixtrans-62.3-47.7170.8-76.4167.4000112.1V197 L204 A273 A275 M279 R280 D281 L284 L291 L294 A295 I298V197-L277 HydrophobicContact CG1-CD2 4.43Å; V197-L277 HydrophobicContact CG2-CG 4.36Å; L204-L277 HydrophobicContact CD1-CD2 4.07Å; A273-L277 WeakPolarHBondContact O-CB 3.37Å; A273-L277 WeakPolarHBondContact O-CD1 3.41Å; A273-L277 WeakPolarHBondContact O-CG 3.47Å; A273-L277 PolarHBondContact O-N 3.02Å; A275-L277 VanDerWaalsContact C-N 3.32Å; A275-L277 PolarHBondContact O-N 3.26Å; L277-M279 VanDerWaalsContact C-N 3.29Å; L277-M279 PolarHBondContact O-N 2.78Å; L277-R280 PolarHBondContact O-N 3.12Å; L277-D281 PolarHBondContact O-N 3.05Å; L277-L284 HydrophobicContact CB-CD1 3.88Å; L277-L291 HydrophobicContact CB-CD1 3.97Å; L277-L291 HydrophobicContact CD1-CD1 4.17Å; L277-L294 HydrophobicContact CD1-CB 3.54Å; L277-A295 HydrophobicContact CD1-CB 4.33Å; L277-I298 HydrophobicContact CD1-CD1 4Å; L277-I298 HydrophobicContact CD2-CD1 4.11Å; L277-I298 HydrophobicContact CG-CD1 4.09Å
278C94.1Very high93.4Very high0 Ų023.9 Ų23.90%011%0.109CC..Hα-helixtrans-69.2-21.8179.8-68.60000114.4I243 A274 A275 R280 D281 T282 L285 L291I243-C278 HydrophobicContact CG2-CB 3.6Å; A274-C278 WeakPolarHBondContact O-CB 3.4Å; A274-C278 PolarHBondContact O-N 3.4Å; A274-C278 PolarHBondContact O-SG 3.36Å; A275-C278 PolarHBondContact O-N 3.22Å; A275-C278 VanDerWaalsContact O-N 3.13Å; C278-R280 VanDerWaalsContact C-N 3.29Å; C278-D281 CarbonylContact O-C 3.5Å; C278-T282 WeakPolarHBondContact O-CA 3.48Å; C278-T282 WeakPolarHBondContact O-CG2 3.34Å; C278-T282 PolarHBondContact O-N 3.24Å; C278-L285 HydrophobicContact CB-CD2 4.06Å; C278-L285 HydrophobicContact CB-CG 4.18Å; C278-L285 VanDerWaalsContact SG-CD2 3.59Å; C278-L291 VanDerWaalsContact SG-CD2 3.52Å
279M91.6Very high93.4Very high50 Ų5029.6 Ų29.625%0.24614%0.139CC..Hα-helixtrans-71.9-20.9169.5-74.7-176.3-111.600112.9E240 I243 A275 Q276 L277E240-M279 HydrophobicContact CG-CE 4.45Å; E240-M279 HydrophobicContact CG-CG 4.33Å; E240-M279 HydrophobicContact CG-SD 3.65Å; I243-M279 HydrophobicContact CG2-CG 4.06Å; A275-M279 HydrophobicContact CB-CE 4Å; A275-M279 WeakPolarHBondContact O-CG 3.38Å; A275-M279 PolarHBondContact O-N 2.97Å; Q276-M279 HydrophobicContact CG-CE 4.31Å; Q276-M279 PolarHBondContact O-N 2.93Å; L277-M279 VanDerWaalsContact C-N 3.29Å; L277-M279 PolarHBondContact O-N 2.78Å
280R89.8Confident93.4Very high123 Ų12332.7 Ų32.746%0.46415%0.154SC..Hα-helixtrans-101.2-31.9178.8-54-56.7-178.770.36.6113.4V197 D198 Q276 L277 C278V197-R280 HydrophobicContact CG1-CG 4.07Å; D198-R280 IonicContact OD1-CZ 2.74Å; D198-R280 IonicContact OD1-NH1 3.66Å; D198-R280 PolarHBondContact OD1-NH1 3.19Å; D198-R280 IonicContact OD1-NH2 3.32Å; D198-R280 PolarHBondContact OD1-NH2 3.36Å; Q276-R280 WeakPolarHBondContact O-CG 3.21Å; Q276-R280 PolarHBondContact O-N 2.82Å; L277-R280 PolarHBondContact O-N 3.12Å; C278-R280 VanDerWaalsContact C-N 3.29Å
281D90.3Very high93.4Very high32 Ų3232.8 Ų32.817%0.17115%0.154CC..  trans-136.2101.5166.7177.820.5000110.2L277 C278 A283 L284 R287L277-D281 PolarHBondContact O-N 3.05Å; C278-D281 CarbonylContact O-C 3.5Å; D281-A283 PolarHBondContact O-N 2.95Å; D281-A283 WeakPolarHBondContact OD1-CB 3.45Å; D281-A283 PolarHBondContact OD1-N 3.15Å; D281-L284 HydrophobicContact CB-CD1 4.15Å; D281-L284 HydrophobicContact CB-CG 4.17Å; D281-L284 WeakPolarHBondContact O-CB 3.43Å; D281-L284 PolarHBondContact O-N 3.07Å; D281-L284 VanDerWaalsContact O-N 3.15Å; D281-R287 IonicContact OD2-CZ 3.82Å; D281-R287 IonicContact OD2-NH2 2.77Å; D281-R287 PolarHBondContact OD2-NH2 2.75Å
282T91.4Very high93.4Very high25 Ų2534.8 Ų34.815%0.15316%0.162CC..G310 helixtrans-64.4-21.1176.948.30000112.6F230 I243 C278 L284 L285F230-T282 VanDerWaalsContact CZ-O 3.29Å; F230-T282 WeakPolarHBondContact CZ-O 3.48Å; I243-T282 HydrophobicContact CD1-CG2 3.81Å; I243-T282 HydrophobicContact CG1-CG2 4.47Å; C278-T282 WeakPolarHBondContact O-CA 3.48Å; C278-T282 WeakPolarHBondContact O-CG2 3.34Å; C278-T282 PolarHBondContact O-N 3.24Å; T282-L284 PolarHBondContact O-N 3.11Å; T282-L285 WeakPolarHBondContact O-CB 3.39Å; T282-L285 PolarHBondContact O-N 3.07Å; T282-L285 VanDerWaalsContact O-N 3.07Å
283A92.1Very high93.4Very high2 Ų235.2 Ų35.22%0.01717%0.174CC..G310 helixtrans-62.7-21.9174.900000112.5T207 V212 D281 L285 T286T207-A283 HydrophobicContact CG2-CB 4.22Å; V212-A283 HydrophobicContact CG2-CB 3.55Å; D281-A283 PolarHBondContact O-N 2.95Å; D281-A283 WeakPolarHBondContact OD1-CB 3.45Å; D281-A283 PolarHBondContact OD1-N 3.15Å; A283-L285 PolarHBondContact O-N 3.05Å; A283-T286 PolarHBondContact O-N 3.37Å; A283-T286 PolarHBondContact O-OG1 2.91Å
284L93.3Very high93.4Very high0 Ų036.3 Ų36.30%018%0.18CC..G310 helixtrans-62.3-21.5174.1-68.9172.3000113.3L204 L277 D281 T282 T286 R287 E290 L291 L294L204-L284 HydrophobicContact CD1-CD1 4.41Å; L277-L284 HydrophobicContact CB-CD1 3.88Å; D281-L284 HydrophobicContact CB-CD1 4.15Å; D281-L284 HydrophobicContact CB-CG 4.17Å; D281-L284 WeakPolarHBondContact O-CB 3.43Å; D281-L284 PolarHBondContact O-N 3.07Å; D281-L284 VanDerWaalsContact O-N 3.15Å; T282-L284 PolarHBondContact O-N 3.11Å; L284-T286 PolarHBondContact O-N 3.3Å; L284-R287 CarbonylContact O-C 3.47Å; L284-R287 PolarHBondContact O-N 3.14Å; L284-R287 VanDerWaalsContact O-N 3.1Å; L284-E290 HydrophobicContact CD2-CG 4.41Å; L284-L291 HydrophobicContact CB-CB 4.48Å; L284-L291 HydrophobicContact CB-CD1 4.21Å; L284-L291 HydrophobicContact CD1-CD1 4.46Å; L284-L294 HydrophobicContact CD1-CD1 4.44Å; L284-L294 HydrophobicContact CD2-CD1 4.11Å
285L93.1Very high93.3Very high16 Ų1636.3 Ų36.38%0.08418%0.18CC..G310 helixtrans-63.9-24.6172-66173.2000112.7I226 I229 I243 C278 T282 A283I226-L285 HydrophobicContact CD1-CB 3.73Å; I229-L285 HydrophobicContact CD1-CD1 4.03Å; I229-L285 HydrophobicContact CG2-CD1 4.23Å; I243-L285 HydrophobicContact CG1-CD1 4.34Å; C278-L285 HydrophobicContact CB-CD2 4.06Å; C278-L285 HydrophobicContact CB-CG 4.18Å; C278-L285 VanDerWaalsContact SG-CD2 3.59Å; T282-L285 WeakPolarHBondContact O-CB 3.39Å; T282-L285 PolarHBondContact O-N 3.07Å; T282-L285 VanDerWaalsContact O-N 3.07Å; A283-L285 PolarHBondContact O-N 3.05Å
286T92.1Very high93.3Very high19 Ų1942.4 Ų42.412%0.11720%0.202CC..THydrogen-bonded Turntrans-84.4-2417379.30000112.6V212 Q215 L216 L222 I226 F230 A283 L284V212-T286 HydrophobicContact CG1-CG2 4.12Å; Q215-T286 PolarHBondContact OE1-OG1 3.07Å; L216-T286 HydrophobicContact CD1-CG2 3.75Å; L222-T286 HydrophobicContact CD2-CG2 4.05Å; I226-T286 HydrophobicContact CD1-CG2 4.07Å; F230-T286 HydrophobicContact CE2-CG2 4.49Å; F230-T286 HydrophobicContact CZ-CG2 4.21Å; A283-T286 PolarHBondContact O-N 3.37Å; A283-T286 PolarHBondContact O-OG1 2.91Å; L284-T286 PolarHBondContact O-N 3.3Å
287R91.9Very high93.3Very high48 Ų4846.3 Ų46.318%0.18122%0.221CC..  trans-106.157.8-171.9-59.2-176.4-73.6147.1-7.5111.5T207 D281 L284 D289 E290 L291T207-R287 PolarHBondContact OG1-NH2 2.87Å; T207-R287 VanDerWaalsContact OG1-NH2 3.16Å; D281-R287 IonicContact OD2-CZ 3.82Å; D281-R287 IonicContact OD2-NH2 2.77Å; D281-R287 PolarHBondContact OD2-NH2 2.75Å; L284-R287 CarbonylContact O-C 3.47Å; L284-R287 PolarHBondContact O-N 3.14Å; L284-R287 VanDerWaalsContact O-N 3.1Å; R287-D289 VanDerWaalsContact C-N 3.33Å; R287-D289 PolarHBondContact O-N 3.43Å; R287-E290 HydrophobicContact CB-CB 4.16Å; R287-E290 WeakPolarHBondContact CD-OE2 3.33Å; R287-E290 IonicContact CZ-OE1 2.63Å; R287-E290 IonicContact CZ-OE2 2.76Å; R287-E290 IonicContact NE-OE2 3.76Å; R287-E290 IonicContact NH1-OE1 2.73Å; R287-E290 PolarHBondContact NH1-OE1 3.31Å; R287-E290 IonicContact NH1-OE2 2.66Å; R287-E290 PolarHBondContact NH1-OE2 2.96Å; R287-E290 WeakPolarHBondContact O-CB 3.32Å; R287-E290 PolarHBondContact O-N 3.38Å; R287-E290 VanDerWaalsContact O-N 3.09Å; R287-L291 PolarHBondContact O-N 2.76Å
288R90.9Very high93.2Very high80 Ų8046.2 Ų46.230%0.30222%0.22SC..Hα-helixtrans-54.8-39.3-167.8-169.4170.8-170.475.625.3115.2Y246 A248 R252 F292Y246-R288 PolarHBondContact O-NH1 3.42Å; A248-R288 PolarHBondContact O-NH2 3.31Å; R252-R288 VanDerWaalsContact CD-NH2 3.3Å; R252-R288 VanDerWaalsContact NE-NH2 3.14Å; R288-F292 PolarHBondContact O-N 2.91Å
289D92.6Very high93.2Very high142 Ų14246.2 Ų46.276%0.75922%0.22SC*.Hα-helixtrans-73.3-33.6-178.7-57.9-61.3000112.4R287 F292 G293R287-D289 VanDerWaalsContact C-N 3.33Å; R287-D289 PolarHBondContact O-N 3.43Å; D289-F292 PolarHBondContact O-N 2.96Å; D289-G293 PolarHBondContact O-N 3.11Å
290E93.6Very high93.3Very high70 Ų7052.1 Ų52.133%0.32724%0.239SC..Hα-helixtrans-67.4-47.9172.1-174.3-177.315800110.6L284 R287 F292 G293 L294L284-E290 HydrophobicContact CD2-CG 4.41Å; R287-E290 HydrophobicContact CB-CB 4.16Å; R287-E290 WeakPolarHBondContact CD-OE2 3.33Å; R287-E290 IonicContact CZ-OE1 2.63Å; R287-E290 IonicContact CZ-OE2 2.76Å; R287-E290 IonicContact NE-OE2 3.76Å; R287-E290 IonicContact NH1-OE1 2.73Å; R287-E290 PolarHBondContact NH1-OE1 3.31Å; R287-E290 IonicContact NH1-OE2 2.66Å; R287-E290 PolarHBondContact NH1-OE2 2.96Å; R287-E290 WeakPolarHBondContact O-CB 3.32Å; R287-E290 PolarHBondContact O-N 3.38Å; R287-E290 VanDerWaalsContact O-N 3.09Å; E290-F292 VanDerWaalsContact C-N 3.27Å; E290-F292 PolarHBondContact O-N 3.03Å; E290-G293 WeakPolarHBondContact O-CA 3.27Å; E290-G293 PolarHBondContact O-N 3.13Å; E290-L294 HydrophobicContact CG-CD1 4.08Å; E290-L294 HydrophobicContact CG-CG 4.47Å; E290-L294 WeakPolarHBondContact O-CG 3.12Å; E290-L294 PolarHBondContact O-N 2.93Å
291L94.9Very high93.2Very high1 Ų149 Ų491%0.00523%0.23CC..Hα-helixtrans-54.5-42.9173.9178.462000111.8A274 L277 C278 L284 R287 L294 A295A274-L291 HydrophobicContact CB-CD1 4.02Å; A274-L291 HydrophobicContact CB-CD2 4.42Å; A274-L291 HydrophobicContact CB-CG 4.19Å; L277-L291 HydrophobicContact CB-CD1 3.97Å; L277-L291 HydrophobicContact CD1-CD1 4.17Å; C278-L291 VanDerWaalsContact SG-CD2 3.52Å; L284-L291 HydrophobicContact CB-CB 4.48Å; L284-L291 HydrophobicContact CB-CD1 4.21Å; L284-L291 HydrophobicContact CD1-CD1 4.46Å; R287-L291 PolarHBondContact O-N 2.76Å; L291-L294 PolarHBondContact O-N 3.31Å; L291-A295 WeakPolarHBondContact O-CB 3.32Å; L291-A295 PolarHBondContact O-N 3.01Å
292F96Very high93.1Very high70 Ų7047.5 Ų47.531%0.30722%0.222SC..Hα-helixtrans-64.9-41.8175.1177.8-126.5000112.8I249 R288 D289 E290 R296I249-F292 HydrophobicContact CD1-CB 4.11Å; I249-F292 HydrophobicContact CD1-CD2 3.97Å; I249-F292 HydrophobicContact CG2-CD2 3.67Å; I249-F292 HydrophobicContact CG2-CE2 4.04Å; R288-F292 PolarHBondContact O-N 2.91Å; D289-F292 PolarHBondContact O-N 2.96Å; E290-F292 VanDerWaalsContact C-N 3.27Å; E290-F292 PolarHBondContact O-N 3.03Å; F292-R296 WeakPolarHBondContact O-CB 3.34Å; F292-R296 PolarHBondContact O-N 2.75Å
293G95.3Very high92.7Very high40 Ų4049.3 Ų49.341%0.41223%0.233SC..Hα-helixtrans-58.6-50.6174.200000112.4D289 E290 R296 Q297D289-G293 PolarHBondContact O-N 3.11Å; E290-G293 WeakPolarHBondContact O-CA 3.27Å; E290-G293 PolarHBondContact O-N 3.13Å; G293-R296 PolarHBondContact O-N 3.34Å; G293-Q297 WeakPolarHBondContact O-CB 3.41Å; G293-Q297 PolarHBondContact O-N 3.22Å
294L94.9Very high92.1Very high22 Ų2256.5 Ų56.512%0.11526%0.261CS..Hα-helixtrans-65.2-49.5-179.2-65.1172.3000112.1M200 L204 L277 L284 E290 L291 R296 Q297 I298M200-L294 HydrophobicContact CE-CD2 3.68Å; L204-L294 HydrophobicContact CD1-CD1 4.25Å; L204-L294 HydrophobicContact CD2-CD1 3.77Å; L204-L294 HydrophobicContact CD2-CD2 3.86Å; L204-L294 HydrophobicContact CD2-CG 4.49Å; L277-L294 HydrophobicContact CD1-CB 3.54Å; L284-L294 HydrophobicContact CD1-CD1 4.44Å; L284-L294 HydrophobicContact CD2-CD1 4.11Å; E290-L294 HydrophobicContact CG-CD1 4.08Å; E290-L294 HydrophobicContact CG-CG 4.47Å; E290-L294 WeakPolarHBondContact O-CG 3.12Å; E290-L294 PolarHBondContact O-N 2.93Å; L291-L294 PolarHBondContact O-N 3.31Å; L294-R296 VanDerWaalsContact C-N 3.3Å; L294-R296 PolarHBondContact O-N 3.05Å; L294-Q297 WeakPolarHBondContact O-CB 3.32Å; L294-Q297 PolarHBondContact O-N 2.91Å; L294-Q297 VanDerWaalsContact O-N 3.14Å; L294-I298 WeakPolarHBondContact O-CG1 3.47Å; L294-I298 PolarHBondContact O-N 2.84Å
295A96.5Very high91Very high0 Ų059.6 Ų59.60%028%0.275CS..Hα-helixtrans-63.2-35.9179.400000112.3I249 V270 A273 A274 L277 L291 S299I249-A295 HydrophobicContact CD1-CB 4.08Å; V270-A295 HydrophobicContact CG1-CB 3.99Å; A273-A295 HydrophobicContact CB-CB 4.07Å; A274-A295 HydrophobicContact CB-CB 3.9Å; L277-A295 HydrophobicContact CD1-CB 4.33Å; L291-A295 WeakPolarHBondContact O-CB 3.32Å; L291-A295 PolarHBondContact O-N 3.01Å; A295-S299 WeakPolarHBondContact O-CB 3.42Å; A295-S299 PolarHBondContact O-N 3.23Å
296R95.8Very high89.8Confident131 Ų13161.2 Ų61.249%0.49428%0.28SS..Hα-helixtrans-71.6-33.4174.2-169.8178.5-175.8-161.51.3112.7F292 G293 L294 R300F292-R296 WeakPolarHBondContact O-CB 3.34Å; F292-R296 PolarHBondContact O-N 2.75Å; G293-R296 PolarHBondContact O-N 3.34Å; L294-R296 VanDerWaalsContact C-N 3.3Å; L294-R296 PolarHBondContact O-N 3.05Å; R296-R300 WeakPolarHBondContact O-CG 3.23Å; R296-R300 PolarHBondContact O-N 2.93Å
297Q93.8Very high88.4Confident100 Ų10064.3 Ų64.347%0.46730%0.299SS..Hα-helixtrans-63.1-50170.8171.4171.3-37.700110.8M200 G293 L294 R300 E301M200-Q297 HydrophobicContact CE-CG 4.33Å; M200-Q297 HydrophobicContact SD-CG 4.37Å; G293-Q297 WeakPolarHBondContact O-CB 3.41Å; G293-Q297 PolarHBondContact O-N 3.22Å; L294-Q297 WeakPolarHBondContact O-CB 3.32Å; L294-Q297 PolarHBondContact O-N 2.91Å; L294-Q297 VanDerWaalsContact O-N 3.14Å; Q297-R300 PolarHBondContact O-N 3.41Å; Q297-E301 PolarHBondContact O-N 3.37Å; Q297-E301 VanDerWaalsContact O-N 3.13Å
298I93.8Very high86.5Confident0 Ų068.5 Ų68.50%032%0.316CS..Hα-helixtrans-60-49.1178.2-69.2177.1000110.6V193 C196 V197 M200 A273 L277 L294 R300 E301 V302V193-I298 HydrophobicContact CG1-CG2 4.21Å; C196-I298 HydrophobicContact CB-CG1 4.31Å; C196-I298 HydrophobicContact CB-CG2 3.78Å; V197-I298 HydrophobicContact CG2-CD1 3.64Å; M200-I298 HydrophobicContact CE-CD1 4.42Å; M200-I298 HydrophobicContact CE-CG1 4.19Å; M200-I298 HydrophobicContact SD-CD1 3.95Å; M200-I298 HydrophobicContact SD-CG1 3.48Å; M200-I298 WeakPolarHBondContact SD-CG1 3.37Å; A273-I298 HydrophobicContact CB-CB 3.96Å; A273-I298 HydrophobicContact CB-CG2 3.67Å; L277-I298 HydrophobicContact CD1-CD1 4Å; L277-I298 HydrophobicContact CD2-CD1 4.11Å; L277-I298 HydrophobicContact CG-CD1 4.09Å; L294-I298 WeakPolarHBondContact O-CG1 3.47Å; L294-I298 PolarHBondContact O-N 2.84Å; I298-R300 VanDerWaalsContact C-N 3.27Å; I298-R300 PolarHBondContact O-N 3.36Å; I298-E301 PolarHBondContact O-N 3.14Å; I298-V302 HydrophobicContact CG2-CG2 3.92Å; I298-V302 WeakPolarHBondContact O-CB 3.45Å; I298-V302 VanDerWaalsContact O-CG2 3.32Å; I298-V302 WeakPolarHBondContact O-CG2 3.23Å; I298-V302 PolarHBondContact O-N 3.47Å
299S94.3Very high84.9Confident0 Ų071.9 Ų71.90%033%0.329CS..Hα-helixtrans-57-38.9178.2174.10000112.8H266 A295 T303H266-S299 PolarHBondContact CE1-OG 3.22Å; H266-S299 PolarHBondContact ND1-OG 3.05Å; A295-S299 WeakPolarHBondContact O-CB 3.42Å; A295-S299 PolarHBondContact O-N 3.23Å; S299-T303 WeakPolarHBondContact O-CB 3.32Å; S299-T303 PolarHBondContact O-N 3.27Å; S299-T303 PolarHBondContact O-OG1 3.32Å
300R92.3Very high82.7Confident173 Ų17366.7 Ų66.765%0.65330%0.302SS*.Hα-helixtrans-64.3-41.7175.1-75.1176.864.5-107.8-3.8112.7R296 Q297 I298 Y304R296-R300 WeakPolarHBondContact O-CG 3.23Å; R296-R300 PolarHBondContact O-N 2.93Å; Q297-R300 PolarHBondContact O-N 3.41Å; I298-R300 VanDerWaalsContact C-N 3.27Å; I298-R300 PolarHBondContact O-N 3.36Å; R300-Y304 WeakPolarHBondContact O-CB 3.49Å; R300-Y304 PolarHBondContact O-N 3.25Å; R300-Y304 VanDerWaalsContact O-N 3.12Å
301E88.6Confident80.4Confident57 Ų5767.6 Ų67.627%0.26632%0.316SS..Hα-helixtrans-70.3-41.2178.7-158.8-171.3156.700111.6R199 Q297 I298 Y304 K305R199-E301 IonicContact CZ-OE1 2.7Å; R199-E301 IonicContact CZ-OE2 2.68Å; R199-E301 IonicContact NE-OE1 3.82Å; R199-E301 IonicContact NH2-OE1 3.76Å; R199-E301 PolarHBondContact NH2-OE1 2.68Å; R199-E301 IonicContact NH2-OE2 3.52Å; R199-E301 PolarHBondContact NH2-OE2 3.49Å; Q297-E301 PolarHBondContact O-N 3.37Å; Q297-E301 VanDerWaalsContact O-N 3.13Å; I298-E301 PolarHBondContact O-N 3.14Å; E301-Y304 PolarHBondContact O-N 2.83Å; E301-K305 HydrophobicContact CG-CD 4.24Å; E301-K305 WeakPolarHBondContact O-CB 3.46Å; E301-K305 WeakPolarHBondContact O-CG 3.43Å; E301-K305 PolarHBondContact O-N 3.02Å; E301-K305 WeakPolarHBondContact OE1-CE 3.43Å; E301-K305 IonicContact OE1-NZ 2.64Å; E301-K305 PolarHBondContact OE1-NZ 3.07Å
302V87.1Confident77.9Confident2 Ų274.9 Ų74.91%0.01235%0.348CS..Hα-helixtrans-62.7-50.5176171.70000110.9S192 V193 C196 T269 I298 Y304 K305 Y306S192-V302 WeakPolarHBondContact O-CG2 3.38Å; V193-V302 HydrophobicContact CB-CG2 4.45Å; V193-V302 HydrophobicContact CG2-CG1 4.13Å; V193-V302 HydrophobicContact CG2-CG2 3.93Å; C196-V302 HydrophobicContact CB-CG2 4.34Å; T269-V302 HydrophobicContact CG2-CB 4.23Å; T269-V302 HydrophobicContact CG2-CG1 4Å; I298-V302 HydrophobicContact CG2-CG2 3.92Å; I298-V302 WeakPolarHBondContact O-CB 3.45Å; I298-V302 VanDerWaalsContact O-CG2 3.32Å; I298-V302 WeakPolarHBondContact O-CG2 3.23Å; I298-V302 PolarHBondContact O-N 3.47Å; V302-Y304 VanDerWaalsContact C-N 3.31Å; V302-Y304 PolarHBondContact O-N 3.37Å; V302-K305 PolarHBondContact O-N 3.01Å; V302-Y306 WeakPolarHBondContact O-CB 3.47Å; V302-Y306 PolarHBondContact O-N 2.88Å
303T83.6Confident75.3Confident62 Ų6276 Ų7638%0.3836%0.364SS..Hα-helixtrans-60-42177.1-58.40000111.2S299 T307S299-T303 WeakPolarHBondContact O-CB 3.32Å; S299-T303 PolarHBondContact O-N 3.27Å; S299-T303 PolarHBondContact O-OG1 3.32Å; T303-T307 VanDerWaalsContact O-CB 3.24Å; T303-T307 WeakPolarHBondContact O-CB 3.39Å; T303-T307 PolarHBondContact O-N 2.89Å; T303-T307 PolarHBondContact O-OG1 3.01Å
304Y79.1Confident72.5Confident154 Ų15483.6 Ų83.660%0.60438%0.38SS*.Hα-helixtrans-61-50.1176.5-177.7-102.1000112.3R300 E301 V302 Y308R300-Y304 WeakPolarHBondContact O-CB 3.49Å; R300-Y304 PolarHBondContact O-N 3.25Å; R300-Y304 VanDerWaalsContact O-N 3.12Å; E301-Y304 PolarHBondContact O-N 2.83Å; V302-Y304 VanDerWaalsContact C-N 3.31Å; V302-Y304 PolarHBondContact O-N 3.37Å; Y304-Y308 VanDerWaalsContact O-CB 3.23Å; Y304-Y308 WeakPolarHBondContact O-CB 3.49Å; Y304-Y308 PolarHBondContact O-N 3.39Å; Y304-Y308 VanDerWaalsContact O-N 3.17Å
305K70.6Confident69.7Low64 Ų6488.8 Ų88.828%0.27842%0.417SS..Hα-helixtrans-66.5-46.9179.4-77.5175165.4173.60112.7E301 V302 Y308 R309E301-K305 HydrophobicContact CG-CD 4.24Å; E301-K305 WeakPolarHBondContact O-CB 3.46Å; E301-K305 WeakPolarHBondContact O-CG 3.43Å; E301-K305 PolarHBondContact O-N 3.02Å; E301-K305 WeakPolarHBondContact OE1-CE 3.43Å; E301-K305 IonicContact OE1-NZ 2.64Å; E301-K305 PolarHBondContact OE1-NZ 3.07Å; V302-K305 PolarHBondContact O-N 3.01Å; K305-Y308 PolarHBondContact O-N 2.76Å; K305-R309 WeakPolarHBondContact O-CB 3.39Å; K305-R309 WeakPolarHBondContact O-CG 3.24Å; K305-R309 PolarHBondContact O-N 3.3Å
306Y67.9Low67.1Low50 Ų5091.6 Ų91.620%0.19645%0.446CS..Hα-helixtrans-65-50.6-178.6179-80.2000110.8D186 A189 V302 Y308 R309 T310D186-Y306 WeakPolarHBondContact OD2-CE2 3.17Å; D186-Y306 PolarHBondContact OD2-OH 3.44Å; A189-Y306 HydrophobicContact CB-CD2 3.92Å; A189-Y306 HydrophobicContact CB-CE2 3.81Å; V302-Y306 WeakPolarHBondContact O-CB 3.47Å; V302-Y306 PolarHBondContact O-N 2.88Å; Y306-Y308 VanDerWaalsContact C-N 3.26Å; Y306-Y308 PolarHBondContact O-N 2.74Å; Y306-R309 PolarHBondContact O-N 3.17Å; Y306-T310 HydrophobicContact CE1-CG2 4.5Å; Y306-T310 WeakPolarHBondContact CE1-OG1 3.37Å; Y306-T310 WeakPolarHBondContact O-CB 3.42Å; Y306-T310 PolarHBondContact O-N 2.91Å; Y306-T310 PolarHBondContact O-OG1 2.85Å
307T62Low64.1Low85 Ų8593.8 Ų93.852%0.52147%0.468SS..Hα-helixtrans-61.8-36.8179.1-58.50000111.4T303 S311T303-T307 VanDerWaalsContact O-CB 3.24Å; T303-T307 WeakPolarHBondContact O-CB 3.39Å; T303-T307 PolarHBondContact O-N 2.89Å; T303-T307 PolarHBondContact O-OG1 3.01Å; T307-S311 WeakPolarHBondContact O-CB 3.29Å; T307-S311 PolarHBondContact O-N 3.17Å; T307-S311 VanDerWaalsContact O-N 3.16Å; T307-S311 PolarHBondContact O-OG 2.94Å
308Y53.8Low62Low136 Ų13698.3 Ų98.353%0.53348%0.481SS..Hα-helixtrans-70-38175.5-173.7-96.6000113.9Y304 K305 Y306 S311Y304-Y308 VanDerWaalsContact O-CB 3.23Å; Y304-Y308 WeakPolarHBondContact O-CB 3.49Å; Y304-Y308 PolarHBondContact O-N 3.39Å; Y304-Y308 VanDerWaalsContact O-N 3.17Å; K305-Y308 PolarHBondContact O-N 2.76Å; Y306-Y308 VanDerWaalsContact C-N 3.26Å; Y306-Y308 PolarHBondContact O-N 2.74Å; Y308-S311 PolarHBondContact O-OG 2.82Å
309R55.7Low59.4Low150 Ų150104 Ų10457%0.56651%0.511SS*.Hα-helixtrans-69.1-49.7174.5-74.4-177-170.3-95.519.8111.3K305 Y306 S311 K312 S313K305-R309 WeakPolarHBondContact O-CB 3.39Å; K305-R309 WeakPolarHBondContact O-CG 3.24Å; K305-R309 PolarHBondContact O-N 3.3Å; Y306-R309 PolarHBondContact O-N 3.17Å; R309-S311 VanDerWaalsContact C-N 3.27Å; R309-S311 PolarHBondContact O-N 3.36Å; R309-K312 WeakPolarHBondContact O-CB 3.38Å; R309-K312 PolarHBondContact O-N 3.34Å; R309-S313 PolarHBondContact O-N 2.9Å
310T47.3Very low56.3Low33 Ų33112.8 Ų112.820%0.20255%0.552CS.*Hα-helixtrans-65.7-28.5-175.9-55.90000112.5Y306 K312 S313 R314Y306-T310 HydrophobicContact CE1-CG2 4.5Å; Y306-T310 WeakPolarHBondContact CE1-OG1 3.37Å; Y306-T310 WeakPolarHBondContact O-CB 3.42Å; Y306-T310 PolarHBondContact O-N 2.91Å; Y306-T310 PolarHBondContact O-OG1 2.85Å; T310-K312 PolarHBondContact O-N 3.46Å; T310-S313 PolarHBondContact O-N 3.19Å; T310-S313 PolarHBondContact O-OG 2.92Å; T310-R314 PolarHBondContact O-N 2.86Å
311S44.4Very low53.9Low90 Ų90110 Ų11063%0.62956%0.556SS**Hα-helixtrans-72-11.6170.654.50000114.8T307 Y308 R309T307-S311 WeakPolarHBondContact O-CB 3.29Å; T307-S311 PolarHBondContact O-N 3.17Å; T307-S311 VanDerWaalsContact O-N 3.16Å; T307-S311 PolarHBondContact O-OG 2.94Å; Y308-S311 PolarHBondContact O-OG 2.82Å; R309-S311 VanDerWaalsContact C-N 3.27Å; R309-S311 PolarHBondContact O-N 3.36Å
312K43.3Very low51.1Low154 Ų154112.8 Ų112.867%0.6758%0.582SS**Hα-helixtrans-95.4-24.5169.6-71.1-163.3174-164.90113.6R309 T310R309-K312 WeakPolarHBondContact O-CB 3.38Å; R309-K312 PolarHBondContact O-N 3.34Å; T310-K312 PolarHBondContact O-N 3.46Å
313S41Very low48.9Very low92 Ų92118.4 Ų118.464%0.64362%0.619SS**Hα-helixtrans-96.7-16.7-173670000115.1R309 T310 C315R309-S313 PolarHBondContact O-N 2.9Å; T310-S313 PolarHBondContact O-N 3.19Å; T310-S313 PolarHBondContact O-OG 2.92Å; S313-C315 PolarHBondContact O-N 2.65Å
314R36.3Very low46.7Very low200 Ų200125.5 Ų125.576%0.75564%0.644SS**  trans-99.253-175.9-158.3179.8-71.1-111.43.8112.9T310T310-R314 PolarHBondContact O-N 2.86Å
315C35.9Very low44.6Very low131 Ų131129.9 Ų129.989%0.88566%0.66SS**  trans-107.765.8168.4-171.80000109.3S313S313-C315 PolarHBondContact O-N 2.65Å
316G43.5Very low43.4Very low60 Ų60134 Ų13462%0.61968%0.683SS**  trans-163.5129.5-175.900000111.6
317D32.8Very low41.9Very low177 Ų177139 Ų13995%0.94771%0.706SS**  trans66.1163.4-178.2-135-16.5000117.7
318R48.8Very low40.8Very low195 Ų195141.5 Ų141.574%0.73672%0.722SS**  trans-126.7162.5-144.9-122.7-179.4-180-81.6-2.3116.7
319D39.6Very low40Very low120 Ų120140.5 Ų140.564%0.64272%0.722SS**  trans58.491.1150.3-59.8-26.9000121
320E29.5Very low39.2Very low184 Ų184139 Ų13986%0.8672%0.721SS**  trans-146.5146.6137.3-122.4-139.279.900111.2S322E320-S322 PolarHBondContact O-N 2.93Å
321P42.3Very low39.1Very low114 Ų114144.5 Ų144.574%0.7475%0.749SS**  trans-91.290.8-162.635.1-35.4000114.9
322S28.5Very low38.9Very low116 Ų116148.4 Ų148.481%0.81176%0.755SS**  trans-82.4130.1169.2-75.20000113E320E320-S322 PolarHBondContact O-N 2.93Å
323P41.3Very low39Very low119 Ų119147 Ų14777%0.77375%0.749SS**  trans-78.3142.1-169.6-16.231.2000115.5
324K37.8Very low40.4Very low211 Ų211147.8 Ų147.892%0.91775%0.746SS**  trans55.873.6158.4-58.3179.5-177.4176.60116.1
325R34.2Very low42.2Very low247 Ų247141.5 Ų141.593%0.93273%0.727SS**  trans-129.6146.5155.3-165.7164.9173.2175.4-5.4110.6K327R325-K327 PolarHBondContact O-N 3.3Å
326I46.1Very low44.3Very low151 Ų151141.9 Ų141.977%0.77472%0.716SS**  trans-59.2131.6-174.5-67.5162.4000110.1T328I326-T328 PolarHBondContact O-N 3.02Å
327K36.8Very low46.1Very low153 Ų153144.8 Ų144.867%0.66571%0.713SS**  trans-55.6122.3169.2-82.1178.2152.3-138.20109.8R325 E329R325-K327 PolarHBondContact O-N 3.3Å; K327-E329 HydrophobicContact CB-CG 3.95Å; K327-E329 HydrophobicContact CD-CG 4.37Å; K327-E329 WeakPolarHBondContact CD-OE1 3.22Å; K327-E329 WeakPolarHBondContact CE-OE1 3.05Å; K327-E329 HydrophobicContact CG-CG 4.36Å; K327-E329 IonicContact NZ-OE1 3.18Å; K327-E329 PolarHBondContact NZ-OE1 2.94Å; K327-E329 IonicContact NZ-OE2 3.95Å; K327-E329 PolarHBondContact NZ-OE2 2.91Å
328T37.2Very low48.4Very low139 Ų139137.7 Ų137.785%0.85368%0.679SS**  trans-120.3100.9159.6-57.30000105.4I326I326-T328 PolarHBondContact O-N 3.02Å
329E36.9Very low50.1Low115 Ų115130.4 Ų130.454%0.53766%0.655SS.*  trans-93137.5-170.6-47.1-158.3114.200109.6K327K327-E329 HydrophobicContact CB-CG 3.95Å; K327-E329 HydrophobicContact CD-CG 4.37Å; K327-E329 WeakPolarHBondContact CD-OE1 3.22Å; K327-E329 WeakPolarHBondContact CE-OE1 3.05Å; K327-E329 HydrophobicContact CG-CG 4.36Å; K327-E329 IonicContact NZ-OE1 3.18Å; K327-E329 PolarHBondContact NZ-OE1 2.94Å; K327-E329 IonicContact NZ-OE2 3.95Å; K327-E329 PolarHBondContact NZ-OE2 2.91Å
330E40.5Very low52.4Low118 Ų118130.4 Ų130.455%0.55165%0.651SS**  trans57.698.1153.8-62.3170.3122.900118.5F332 F333E330-F332 HydrophobicContact CB-CB 4.48Å; E330-F332 PolarHBondContact O-N 3.16Å; E330-F333 HydrophobicContact CB-CB 4.43Å; E330-F333 HydrophobicContact CB-CD2 3.89Å; E330-F333 PolarHBondContact O-N 3.13Å; E330-F333 WeakPolarHBondContact OE2-CD2 3.46Å; E330-F333 VanDerWaalsContact OE2-CE2 3.22Å; E330-F333 WeakPolarHBondContact OE2-CE2 3.43Å
331N44.2Very low55.1Low149 Ų149124.4 Ų124.480%0.79763%0.633SS**THydrogen-bonded Turntrans-64.48.8159.2-147.3121.6000113.1
332F40.8Very low57.3Low171 Ų171119.8 Ų119.875%0.7560%0.602SS**THydrogen-bonded Turntrans-97.4-23.5172.2-151.2-94.2000111.9E330E330-F332 HydrophobicContact CB-CB 4.48Å; E330-F332 PolarHBondContact O-N 3.16Å
333F44.7Very low60.1Low125 Ų125118.9 Ų118.955%0.54858%0.584SS.*Hα-helixtrans-66.3-40.5175.8-107.3-108.7000112E330 I335 Q336 E337E330-F333 HydrophobicContact CB-CB 4.43Å; E330-F333 HydrophobicContact CB-CD2 3.89Å; E330-F333 PolarHBondContact O-N 3.13Å; E330-F333 WeakPolarHBondContact OE2-CD2 3.46Å; E330-F333 VanDerWaalsContact OE2-CE2 3.22Å; E330-F333 WeakPolarHBondContact OE2-CE2 3.43Å; F333-I335 VanDerWaalsContact C-N 3.34Å; F333-I335 PolarHBondContact O-N 3.22Å; F333-Q336 PolarHBondContact O-N 3.34Å; F333-Q336 VanDerWaalsContact O-N 3.13Å; F333-E337 WeakPolarHBondContact O-CB 3.37Å; F333-E337 PolarHBondContact O-N 2.73Å
334D70.1Confident62.4Low108 Ų108119.2 Ų119.258%0.57858%0.577SS**Hα-helixtrans-54.4-41.8-172.2-167.520.1000113.4A338D334-A338 WeakPolarHBondContact O-CB 3.22Å; D334-A338 PolarHBondContact O-N 2.83Å
335I75.8Confident64.8Low68 Ų68114.9 Ų114.935%0.34956%0.555SS.*Hα-helixtrans-70.2-43.9179.7-60.4177.4000111.3F333 L339 I382F333-I335 VanDerWaalsContact C-N 3.34Å; F333-I335 PolarHBondContact O-N 3.22Å; I335-L339 HydrophobicContact CG2-CD1 4.15Å; I335-L339 WeakPolarHBondContact O-CB 3.32Å; I335-L339 VanDerWaalsContact O-CG 3.32Å; I335-L339 WeakPolarHBondContact O-CG 3.37Å; I335-L339 PolarHBondContact O-N 2.93Å; I335-I382 HydrophobicContact CG2-CG2 4.12Å
336Q79.1Confident67.5Low139 Ų139103.6 Ų103.665%0.6551%0.513SS*.Hα-helixtrans-71.7-39.8-179-171.3168.8-5.100111.4F333 L339 Q340F333-Q336 PolarHBondContact O-N 3.34Å; F333-Q336 VanDerWaalsContact O-N 3.13Å; Q336-L339 PolarHBondContact O-N 3.08Å; Q336-Q340 WeakPolarHBondContact O-CB 3.44Å; Q336-Q340 PolarHBondContact O-N 3.02Å
337E81.3Confident69.6Low121 Ų121100.3 Ų100.357%0.56549%0.494SS*.Hα-helixtrans-64.3-43.5173.1-171.7177.3168.900111.2F333 L339 Q340 A341F333-E337 WeakPolarHBondContact O-CB 3.37Å; F333-E337 PolarHBondContact O-N 2.73Å; E337-L339 PolarHBondContact O-N 3Å; E337-Q340 PolarHBondContact O-N 2.82Å; E337-A341 VanDerWaalsContact O-CB 3.26Å; E337-A341 WeakPolarHBondContact O-CB 3.48Å; E337-A341 PolarHBondContact O-N 2.73Å
338A80.8Confident72.1Confident29 Ų2997.4 Ų97.424%0.2448%0.484CS..Hα-helixtrans-62-43.2176.400000112.4D334 A341 I342 I382D334-A338 WeakPolarHBondContact O-CB 3.22Å; D334-A338 PolarHBondContact O-N 2.83Å; A338-A341 PolarHBondContact O-N 3.39Å; A338-I342 WeakPolarHBondContact O-CB 3.32Å; A338-I342 VanDerWaalsContact O-CG1 3.25Å; A338-I342 WeakPolarHBondContact O-CG1 3.49Å; A338-I342 PolarHBondContact O-N 2.96Å; A338-I382 HydrophobicContact CB-CD1 4.39Å
339L85.4Confident74.7Confident41 Ų4191.1 Ų91.122%0.21545%0.445CS..Hα-helixtrans-65.9-39.4175.7-71.3172.1000111.9I335 Q336 E337 I342 H343 Q379 I382 L383I335-L339 HydrophobicContact CG2-CD1 4.15Å; I335-L339 WeakPolarHBondContact O-CB 3.32Å; I335-L339 VanDerWaalsContact O-CG 3.32Å; I335-L339 WeakPolarHBondContact O-CG 3.37Å; I335-L339 PolarHBondContact O-N 2.93Å; Q336-L339 PolarHBondContact O-N 3.08Å; E337-L339 PolarHBondContact O-N 3Å; L339-I342 PolarHBondContact O-N 2.65Å; L339-H343 WeakPolarHBondContact O-CB 3.34Å; L339-H343 PolarHBondContact O-N 3.29Å; L339-Q379 HydrophobicContact CD2-CG 3.94Å; L339-I382 HydrophobicContact CD2-CG2 4.17Å; L339-I382 HydrophobicContact CG-CG2 4.32Å; L339-L383 HydrophobicContact CD1-CD2 4Å; L339-L383 HydrophobicContact CD2-CD2 4.37Å; L339-L383 HydrophobicContact CD2-CG 4.32Å
340Q86.9Confident77.3Confident121 Ų12190.3 Ų90.357%0.56544%0.437SS*.Hα-helixtrans-67-41.4175.3-171.3174.112.100112.2Q336 E337 H343 M344Q336-Q340 WeakPolarHBondContact O-CB 3.44Å; Q336-Q340 PolarHBondContact O-N 3.02Å; E337-Q340 PolarHBondContact O-N 2.82Å; Q340-H343 WeakPolarHBondContact O-CB 3.41Å; Q340-H343 PolarHBondContact O-N 2.96Å; Q340-M344 WeakPolarHBondContact O-CG 3.45Å; Q340-M344 PolarHBondContact O-N 2.89Å
341A86.6Confident79.7Confident58 Ų5891.1 Ų91.148%0.47944%0.441SS..Hα-helixtrans-66.4-38.1176.400000112.2E337 A338 R345E337-A341 VanDerWaalsContact O-CB 3.26Å; E337-A341 WeakPolarHBondContact O-CB 3.48Å; E337-A341 PolarHBondContact O-N 2.73Å; A338-A341 PolarHBondContact O-N 3.39Å; A341-R345 WeakPolarHBondContact O-CB 3.16Å; A341-R345 PolarHBondContact O-N 3.3Å
342I87.3Confident81.8Confident16 Ų1688.3 Ų88.38%0.08242%0.423CS..Hα-helixtrans-62.3-47.1170.5-72.8167.1000110A338 L339 R345 Q346 L375 R378 Q379 I382A338-I342 WeakPolarHBondContact O-CB 3.32Å; A338-I342 VanDerWaalsContact O-CG1 3.25Å; A338-I342 WeakPolarHBondContact O-CG1 3.49Å; A338-I342 PolarHBondContact O-N 2.96Å; L339-I342 PolarHBondContact O-N 2.65Å; I342-R345 PolarHBondContact O-N 3.15Å; I342-Q346 VanDerWaalsContact O-CB 3.31Å; I342-Q346 WeakPolarHBondContact O-CB 3.2Å; I342-Q346 PolarHBondContact O-N 3.46Å; I342-L375 HydrophobicContact CG1-CD2 4.37Å; I342-L375 HydrophobicContact CG2-CD2 4.47Å; I342-R378 HydrophobicContact CD1-CG 4.08Å; I342-Q379 HydrophobicContact CG2-CB 4.14Å; I342-Q379 HydrophobicContact CG2-CG 4.33Å; I342-I382 HydrophobicContact CD1-CD1 3.57Å
343H88.8Confident84.2Confident97 Ų9780.9 Ų80.945%0.44939%0.391SS..Hα-helixtrans-58.7-49.8178.1-174.9-80.1000112.3L339 Q340 R345 Q346 E347L339-H343 WeakPolarHBondContact O-CB 3.34Å; L339-H343 PolarHBondContact O-N 3.29Å; Q340-H343 WeakPolarHBondContact O-CB 3.41Å; Q340-H343 PolarHBondContact O-N 2.96Å; H343-R345 VanDerWaalsContact C-N 3.32Å; H343-R345 PolarHBondContact O-N 3.06Å; H343-Q346 VanDerWaalsContact O-CB 3.32Å; H343-Q346 WeakPolarHBondContact O-CB 3.13Å; H343-Q346 PolarHBondContact O-N 3.44Å; H343-Q346 VanDerWaalsContact O-N 3.08Å; H343-E347 PolarHBondContact O-N 3.23Å
344M88.9Confident86.3Confident127 Ų12777.7 Ų77.763%0.62639%0.388SS*.Hα-helixtrans-62.2-37.4177.9-69.4-164.476.300112.7Q340 Q346 M348Q340-M344 WeakPolarHBondContact O-CG 3.45Å; Q340-M344 PolarHBondContact O-N 2.89Å; M344-Q346 VanDerWaalsContact C-N 3.33Å; M344-M348 WeakPolarHBondContact O-CB 3.32Å; M344-M348 PolarHBondContact O-N 3.13Å; M344-M348 VanDerWaalsContact O-N 3.1Å
345R88.6Confident87.1Confident120 Ų12075.9 Ų75.945%0.45338%0.383SS..Hα-helixtrans-70.6-30.7174.3-169.8175.5174.8-172.7-3.7112.4A341 I342 H343 L349 L375A341-R345 WeakPolarHBondContact O-CB 3.16Å; A341-R345 PolarHBondContact O-N 3.3Å; I342-R345 PolarHBondContact O-N 3.15Å; H343-R345 VanDerWaalsContact C-N 3.32Å; H343-R345 PolarHBondContact O-N 3.06Å; R345-L349 HydrophobicContact CG-CD1 4.16Å; R345-L349 WeakPolarHBondContact O-CB 3.43Å; R345-L349 WeakPolarHBondContact O-CG 3.36Å; R345-L349 PolarHBondContact O-N 3.38Å; R345-L375 HydrophobicContact CB-CD1 4.33Å; R345-L375 HydrophobicContact CG-CD1 3.81Å
346Q90Very high87.7Confident10 Ų1072.8 Ų72.85%0.04737%0.367CS..Hα-helixtrans-66.6-44.2176-159.7-178.372.800110.9I342 H343 M344 L349 R350 L372 L376I342-Q346 VanDerWaalsContact O-CB 3.31Å; I342-Q346 WeakPolarHBondContact O-CB 3.2Å; I342-Q346 PolarHBondContact O-N 3.46Å; H343-Q346 VanDerWaalsContact O-CB 3.32Å; H343-Q346 WeakPolarHBondContact O-CB 3.13Å; H343-Q346 PolarHBondContact O-N 3.44Å; H343-Q346 VanDerWaalsContact O-N 3.08Å; M344-Q346 VanDerWaalsContact C-N 3.33Å; Q346-L349 PolarHBondContact O-N 3.46Å; Q346-R350 WeakPolarHBondContact O-CG 3.3Å; Q346-R350 PolarHBondContact O-N 3.04Å; Q346-R350 VanDerWaalsContact OE1-CZ 3.23Å; Q346-L372 HydrophobicContact CB-CD1 4.43Å; Q346-L372 HydrophobicContact CG-CD1 3.56Å; Q346-L372 HydrophobicContact CG-CG 4.48Å; Q346-L376 VanDerWaalsContact NE2-CD2 3.26Å
347E90.6Very high88.1Confident82 Ų8272.4 Ų72.438%0.38336%0.364SS..Hα-helixtrans-63.2-49.5173.8-67.2-58.986.800111.9H343 L349 R350 E351H343-E347 PolarHBondContact O-N 3.23Å; E347-L349 PolarHBondContact O-N 3.09Å; E347-R350 WeakPolarHBondContact O-CA 3.29Å; E347-R350 WeakPolarHBondContact O-CB 3.31Å; E347-R350 PolarHBondContact O-N 3.39Å; E347-R350 VanDerWaalsContact OE1-CD 3.25Å; E347-R350 WeakPolarHBondContact OE1-CD 3.47Å; E347-R350 IonicContact OE1-CZ 3.46Å; E347-R350 IonicContact OE1-NE 3.65Å; E347-R350 IonicContact OE1-NH1 3.69Å; E347-R350 PolarHBondContact OE1-NH1 3.37Å; E347-E351 PolarHBondContact O-N 3.5Å
348M90.4Very high88.5Confident92 Ų9271.4 Ų71.445%0.45337%0.37SS..Hα-helixtrans-53.6-41.2176-176.1-144.5-63.100112.5M344 Q352M344-M348 WeakPolarHBondContact O-CB 3.32Å; M344-M348 PolarHBondContact O-N 3.13Å; M344-M348 VanDerWaalsContact O-N 3.1Å; M348-Q352 WeakPolarHBondContact O-CB 3.39Å; M348-Q352 VanDerWaalsContact O-CG 3.32Å; M348-Q352 WeakPolarHBondContact O-CG 3.49Å; M348-Q352 PolarHBondContact O-N 3.49Å; M348-Q352 PolarHBondContact SD-NE2 2.81Å
349L90.7Very high88.9Confident6 Ų677 Ų773%0.03139%0.389CS..Hα-helixtrans-74.9-29.4177.7-72.8169.2000112.9R345 Q346 E347 L353 L368 Q371 L372 L375R345-L349 HydrophobicContact CG-CD1 4.16Å; R345-L349 WeakPolarHBondContact O-CB 3.43Å; R345-L349 WeakPolarHBondContact O-CG 3.36Å; R345-L349 PolarHBondContact O-N 3.38Å; Q346-L349 PolarHBondContact O-N 3.46Å; E347-L349 PolarHBondContact O-N 3.09Å; L349-L353 WeakPolarHBondContact O-CB 3.47Å; L349-L353 PolarHBondContact O-N 2.84Å; L349-L368 HydrophobicContact CD2-CD2 3.53Å; L349-Q371 HydrophobicContact CD1-CB 4Å; L349-Q371 HydrophobicContact CD2-CB 4.47Å; L349-L372 HydrophobicContact CB-CD1 4.06Å; L349-L375 HydrophobicContact CD1-CD1 3.36Å
350R91Very high89Confident99 Ų9977.9 Ų77.937%0.37441%0.408SS..Hα-helixtrans-66.2-43.8170.3-75.7169.5176.3130.16.9111.4Q346 E347 L353 A354 L372Q346-R350 WeakPolarHBondContact O-CG 3.3Å; Q346-R350 PolarHBondContact O-N 3.04Å; Q346-R350 VanDerWaalsContact OE1-CZ 3.23Å; E347-R350 WeakPolarHBondContact O-CA 3.29Å; E347-R350 WeakPolarHBondContact O-CB 3.31Å; E347-R350 PolarHBondContact O-N 3.39Å; E347-R350 VanDerWaalsContact OE1-CD 3.25Å; E347-R350 WeakPolarHBondContact OE1-CD 3.47Å; E347-R350 IonicContact OE1-CZ 3.46Å; E347-R350 IonicContact OE1-NE 3.65Å; E347-R350 IonicContact OE1-NH1 3.69Å; E347-R350 PolarHBondContact OE1-NH1 3.37Å; R350-L353 PolarHBondContact O-N 3.04Å; R350-A354 PolarHBondContact O-N 3.4Å; R350-L372 HydrophobicContact CG-CD1 4.17Å; R350-L372 HydrophobicContact CG-CD2 4.33Å
351E91.6Very high89Confident135 Ų13575.6 Ų75.663%0.63140%0.397SS*.Hα-helixtrans-61.4-50.6174.7-69.4180161.600111.3E347 L353 A354 C355E347-E351 PolarHBondContact O-N 3.5Å; E351-L353 VanDerWaalsContact C-N 3.28Å; E351-L353 PolarHBondContact O-N 2.97Å; E351-A354 WeakPolarHBondContact O-CB 3.47Å; E351-A354 PolarHBondContact O-N 2.95Å; E351-A354 VanDerWaalsContact O-N 3.11Å; E351-C355 PolarHBondContact O-N 2.89Å; E351-C355 PolarHBondContact O-SG 3.4Å
352Q87.8Confident89Confident90 Ų9078.7 Ų78.742%0.42140%0.402SS..Hα-helixtrans-60.7-37.6176.2-72176.726.900112.1M348 C355 A356 L368M348-Q352 WeakPolarHBondContact O-CB 3.39Å; M348-Q352 VanDerWaalsContact O-CG 3.32Å; M348-Q352 WeakPolarHBondContact O-CG 3.49Å; M348-Q352 PolarHBondContact O-N 3.49Å; M348-Q352 PolarHBondContact SD-NE2 2.81Å; Q352-C355 PolarHBondContact O-N 2.68Å; Q352-A356 WeakPolarHBondContact O-CB 3.38Å; Q352-A356 PolarHBondContact O-N 3.2Å; Q352-L368 HydrophobicContact CB-CD1 3.87Å; Q352-L368 HydrophobicContact CB-CD2 4.19Å
353L90.9Very high88.9Confident14 Ų1483.4 Ų83.47%0.07343%0.431CS..Hα-helixtrans-66.9-35.8175.8-179.859000111.9L349 R350 E351 K357 G365 L368 Q369L349-L353 WeakPolarHBondContact O-CB 3.47Å; L349-L353 PolarHBondContact O-N 2.84Å; R350-L353 PolarHBondContact O-N 3.04Å; E351-L353 VanDerWaalsContact C-N 3.28Å; E351-L353 PolarHBondContact O-N 2.97Å; L353-K357 HydrophobicContact CD1-CD 4.28Å; L353-K357 HydrophobicContact CD1-CG 4.46Å; L353-K357 HydrophobicContact CG-CD 4.23Å; L353-K357 WeakPolarHBondContact O-CB 3.4Å; L353-K357 WeakPolarHBondContact O-CD 3.37Å; L353-K357 WeakPolarHBondContact O-CG 3.5Å; L353-K357 PolarHBondContact O-N 2.87Å; L353-G365 VanDerWaalsContact CD1-O 3.23Å; L353-G365 WeakPolarHBondContact CD1-O 3.49Å; L353-L368 HydrophobicContact CB-CB 4.36Å; L353-L368 HydrophobicContact CD1-CB 4.26Å; L353-Q369 HydrophobicContact CD2-CB 4.27Å
354A90.1Very high88.9Confident58 Ų5881.7 Ų81.748%0.47943%0.427SS..Hα-helixtrans-66.8-43.2172.700000111.5R350 E351 K357 S358R350-A354 PolarHBondContact O-N 3.4Å; E351-A354 WeakPolarHBondContact O-CB 3.47Å; E351-A354 PolarHBondContact O-N 2.95Å; E351-A354 VanDerWaalsContact O-N 3.11Å; A354-K357 PolarHBondContact O-N 3.36Å; A354-S358 PolarHBondContact O-N 3.38Å; A354-S358 PolarHBondContact O-OG 3.47Å
355C87.1Confident88.9Confident70 Ų7076 Ų7647%0.47340%0.401SS..Hα-helixtrans-66.2-38.4175.3-67.20000113.3E351 Q352 S358 K359E351-C355 PolarHBondContact O-N 2.89Å; E351-C355 PolarHBondContact O-SG 3.4Å; Q352-C355 PolarHBondContact O-N 2.68Å; C355-S358 PolarHBondContact O-OG 3.05Å; C355-K359 VanDerWaalsContact O-CG 3.3Å; C355-K359 WeakPolarHBondContact O-CG 3.46Å; C355-K359 PolarHBondContact O-N 3.06Å
356A88.1Confident89Confident3 Ų378.5 Ų78.53%0.02541%0.411CS..Hα-helixtrans-65.6-41174.300000111Q352 K359 G360 E361 V364 L368Q352-A356 WeakPolarHBondContact O-CB 3.38Å; Q352-A356 PolarHBondContact O-N 3.2Å; A356-K359 PolarHBondContact O-N 3.34Å; A356-G360 PolarHBondContact O-N 3.4Å; A356-G360 VanDerWaalsContact O-N 3.14Å; A356-E361 HydrophobicContact CB-CB 4.29Å; A356-E361 PolarHBondContact O-N 3.23Å; A356-V364 HydrophobicContact CB-CB 4.35Å; A356-V364 HydrophobicContact CB-CG1 4.14Å; A356-L368 HydrophobicContact CB-CD1 4.04Å
357K87.7Confident89Confident131 Ų13182.2 Ų82.257%0.5743%0.431SS*.Hα-helixtrans-64.2-43175.6-77.2171.2178.6174.90112.6L353 A354 K359 G360L353-K357 HydrophobicContact CD1-CD 4.28Å; L353-K357 HydrophobicContact CD1-CG 4.46Å; L353-K357 HydrophobicContact CG-CD 4.23Å; L353-K357 WeakPolarHBondContact O-CB 3.4Å; L353-K357 WeakPolarHBondContact O-CD 3.37Å; L353-K357 WeakPolarHBondContact O-CG 3.5Å; L353-K357 PolarHBondContact O-N 2.87Å; A354-K357 PolarHBondContact O-N 3.36Å; K357-K359 VanDerWaalsContact C-N 3.27Å; K357-K359 PolarHBondContact O-N 3.13Å; K357-G360 PolarHBondContact O-N 2.91Å
358S89.3Confident89Confident100 Ų10078.9 Ų78.970%0.69942%0.416SS*.Hα-helixtrans-70.7-20.6178.764.20000114A354 C355A354-S358 PolarHBondContact O-N 3.38Å; A354-S358 PolarHBondContact O-OG 3.47Å; C355-S358 PolarHBondContact O-OG 3.05Å
359K88.9Confident89Confident148 Ų14878.5 Ų78.564%0.64341%0.413SS*.Hα-helixtrans-90.9-7.6172.1-66.8178.2-175.9179.20114.8C355 A356 K357 E361C355-K359 VanDerWaalsContact O-CG 3.3Å; C355-K359 WeakPolarHBondContact O-CG 3.46Å; C355-K359 PolarHBondContact O-N 3.06Å; A356-K359 PolarHBondContact O-N 3.34Å; K357-K359 VanDerWaalsContact C-N 3.27Å; K357-K359 PolarHBondContact O-N 3.13Å; K359-E361 VanDerWaalsContact C-N 3.33Å; K359-E361 HydrophobicContact CB-CG 3.93Å; K359-E361 WeakPolarHBondContact CD-OE1 3.4Å; K359-E361 IonicContact NZ-OE1 3.67Å
360G86.6Confident89Confident59 Ų5982.7 Ų82.761%0.60843%0.433SS*.THydrogen-bonded Turntrans74.717.1-174.700000114.9A356 K357 E362A356-G360 PolarHBondContact O-N 3.4Å; A356-G360 VanDerWaalsContact O-N 3.14Å; K357-G360 PolarHBondContact O-N 2.91Å; G360-E362 PolarHBondContact O-N 3.46Å
361E88.2Confident88.9Confident72 Ų7280.8 Ų80.834%0.33643%0.428SS..  trans-77.666.1-178.7-64.7175.7-161.800111.3A356 K359 T363 V364 G365A356-E361 HydrophobicContact CB-CB 4.29Å; A356-E361 PolarHBondContact O-N 3.23Å; K359-E361 VanDerWaalsContact C-N 3.33Å; K359-E361 HydrophobicContact CB-CG 3.93Å; K359-E361 WeakPolarHBondContact CD-OE1 3.4Å; K359-E361 IonicContact NZ-OE1 3.67Å; E361-T363 VanDerWaalsContact C-N 3.32Å; E361-T363 PolarHBondContact O-N 2.92Å; E361-V364 HydrophobicContact CB-CB 3.96Å; E361-V364 HydrophobicContact CB-CG2 4.03Å; E361-V364 PolarHBondContact O-N 3.06Å; E361-V364 VanDerWaalsContact O-N 3.1Å; E361-G365 PolarHBondContact O-N 3.35Å
362E86.8Confident88.9Confident124 Ų12475.4 Ų75.458%0.57940%0.404SS*.Hα-helixtrans-53.7-41.2-172.5-82.5-157.9-143.900114.5G360 G365 R366G360-E362 PolarHBondContact O-N 3.46Å; E362-G365 PolarHBondContact O-N 3.2Å; E362-R366 WeakPolarHBondContact O-CB 3.45Å; E362-R366 WeakPolarHBondContact O-CG 3.5Å; E362-R366 PolarHBondContact O-N 2.9Å; E362-R366 IonicContact OE2-CZ 3.53Å; E362-R366 IonicContact OE2-NE 2.66Å; E362-R366 IonicContact OE2-NH2 3.5Å; E362-R366 PolarHBondContact OE2-NH2 3.28Å
363T85.8Confident89Confident115 Ų11576.3 Ų76.371%0.70641%0.408SS*.Hα-helixtrans-66.2-39.5-179.949.30000112E361 N367E361-T363 VanDerWaalsContact C-N 3.32Å; E361-T363 PolarHBondContact O-N 2.92Å; T363-N367 PolarHBondContact O-N 3.32Å; T363-N367 VanDerWaalsContact O-N 3.13Å
364V87.4Confident89Confident60 Ų6082 Ų8236%0.36443%0.429SS..Hα-helixtrans-68-45.4174.9-1770000109.8A356 E361 R366 N367 L368A356-V364 HydrophobicContact CB-CB 4.35Å; A356-V364 HydrophobicContact CB-CG1 4.14Å; E361-V364 HydrophobicContact CB-CB 3.96Å; E361-V364 HydrophobicContact CB-CG2 4.03Å; E361-V364 PolarHBondContact O-N 3.06Å; E361-V364 VanDerWaalsContact O-N 3.1Å; V364-R366 PolarHBondContact O-N 2.93Å; V364-N367 PolarHBondContact O-N 3.49Å; V364-N367 VanDerWaalsContact O-N 3.13Å; V364-L368 HydrophobicContact CG1-CD1 3.84Å; V364-L368 HydrophobicContact CG1-CG 4.25Å; V364-L368 WeakPolarHBondContact O-CG 3.38Å; V364-L368 PolarHBondContact O-N 2.98Å
365G89.2Confident89Confident7 Ų780.1 Ų80.17%0.07241%0.411CS..Hα-helixtrans-57.9-44.5175.900000113.1L353 E361 E362 N367 L368 Q369L353-G365 VanDerWaalsContact CD1-O 3.23Å; L353-G365 WeakPolarHBondContact CD1-O 3.49Å; E361-G365 PolarHBondContact O-N 3.35Å; E362-G365 PolarHBondContact O-N 3.2Å; G365-N367 PolarHBondContact O-N 3.47Å; G365-L368 PolarHBondContact O-N 2.88Å; G365-Q369 WeakPolarHBondContact O-CB 3.47Å; G365-Q369 PolarHBondContact O-N 3.26Å
366R90.1Very high89.1Confident173 Ų17380.3 Ų80.365%0.65341%0.406SS*.Hα-helixtrans-63-38.3174.9-68.2168.5-165.1-155.58.2112.2E362 V364 M370E362-R366 WeakPolarHBondContact O-CB 3.45Å; E362-R366 WeakPolarHBondContact O-CG 3.5Å; E362-R366 PolarHBondContact O-N 2.9Å; E362-R366 IonicContact OE2-CZ 3.53Å; E362-R366 IonicContact OE2-NE 2.66Å; E362-R366 IonicContact OE2-NH2 3.5Å; E362-R366 PolarHBondContact OE2-NH2 3.28Å; V364-R366 PolarHBondContact O-N 2.93Å; R366-M370 PolarHBondContact O-N 2.86Å; R366-M370 VanDerWaalsContact O-N 3.16Å
367N90.9Very high89.2Confident88 Ų8883.1 Ų83.147%0.47143%0.43SS..Hα-helixtrans-67.9-47.7176.3-172.4-78.9000112.2T363 V364 G365 Q369 M370 Q371T363-N367 PolarHBondContact O-N 3.32Å; T363-N367 VanDerWaalsContact O-N 3.13Å; V364-N367 PolarHBondContact O-N 3.49Å; V364-N367 VanDerWaalsContact O-N 3.13Å; G365-N367 PolarHBondContact O-N 3.47Å; N367-Q369 VanDerWaalsContact C-N 3.28Å; N367-Q369 PolarHBondContact O-N 3.45Å; N367-M370 WeakPolarHBondContact O-CB 3.36Å; N367-M370 PolarHBondContact O-N 2.85Å; N367-Q371 PolarHBondContact O-N 3.23Å; N367-Q371 PolarHBondContact OD1-NE2 3.1Å
368L90.1Very high89.1Confident13 Ų1383.2 Ų83.27%0.06843%0.426CS..Hα-helixtrans-60.3-38.7177.9-69.2170000111.7L349 Q352 L353 A356 V364 G365 Q371 L372L349-L368 HydrophobicContact CD2-CD2 3.53Å; Q352-L368 HydrophobicContact CB-CD1 3.87Å; Q352-L368 HydrophobicContact CB-CD2 4.19Å; L353-L368 HydrophobicContact CB-CB 4.36Å; L353-L368 HydrophobicContact CD1-CB 4.26Å; A356-L368 HydrophobicContact CB-CD1 4.04Å; V364-L368 HydrophobicContact CG1-CD1 3.84Å; V364-L368 HydrophobicContact CG1-CG 4.25Å; V364-L368 WeakPolarHBondContact O-CG 3.38Å; V364-L368 PolarHBondContact O-N 2.98Å; G365-L368 PolarHBondContact O-N 2.88Å; L368-Q371 PolarHBondContact O-N 2.75Å; L368-L372 PolarHBondContact O-N 2.85Å
369Q90.4Very high89.1Confident83 Ų8380.6 Ų80.639%0.38840%0.403SS..Hα-helixtrans-66.4-40.3175.7-169.9165.1-3900112.2L353 G365 N367 Q371 L372 E373L353-Q369 HydrophobicContact CD2-CB 4.27Å; G365-Q369 WeakPolarHBondContact O-CB 3.47Å; G365-Q369 PolarHBondContact O-N 3.26Å; N367-Q369 VanDerWaalsContact C-N 3.28Å; N367-Q369 PolarHBondContact O-N 3.45Å; Q369-Q371 VanDerWaalsContact C-N 3.32Å; Q369-Q371 PolarHBondContact O-N 3.21Å; Q369-L372 WeakPolarHBondContact O-CB 3.38Å; Q369-L372 PolarHBondContact O-N 3.47Å; Q369-L372 VanDerWaalsContact O-N 3.15Å; Q369-E373 WeakPolarHBondContact O-CG 3.47Å; Q369-E373 PolarHBondContact O-N 3.02Å
370M90.6Very high89Confident95 Ų9579 Ų7947%0.46840%0.399SS..Hα-helixtrans-62.9-36.5171.9-170.5-168.4-62.300112.3R366 N367 L372 E373 R374R366-M370 PolarHBondContact O-N 2.86Å; R366-M370 VanDerWaalsContact O-N 3.16Å; N367-M370 WeakPolarHBondContact O-CB 3.36Å; N367-M370 PolarHBondContact O-N 2.85Å; M370-L372 VanDerWaalsContact C-N 3.33Å; M370-E373 PolarHBondContact O-N 3.28Å; M370-R374 WeakPolarHBondContact O-CG 3.43Å; M370-R374 PolarHBondContact O-N 2.91Å
371Q89.3Confident89Confident58 Ų5880.7 Ų80.727%0.27139%0.392SS..Hα-helixtrans-65.9-36.1173.4-68.7-170.550.900112.2L349 N367 L368 Q369 R374 L375L349-Q371 HydrophobicContact CD1-CB 4Å; L349-Q371 HydrophobicContact CD2-CB 4.47Å; N367-Q371 PolarHBondContact O-N 3.23Å; N367-Q371 PolarHBondContact OD1-NE2 3.1Å; L368-Q371 PolarHBondContact O-N 2.75Å; Q369-Q371 VanDerWaalsContact C-N 3.32Å; Q369-Q371 PolarHBondContact O-N 3.21Å; Q371-R374 PolarHBondContact O-N 2.92Å; Q371-L375 PolarHBondContact O-N 3.01Å; Q371-L375 VanDerWaalsContact O-N 3.09Å
372L91.3Very high88.9Confident23 Ų2378.5 Ų78.512%0.1238%0.382CS..Hα-helixtrans-64.6-43.1175.9-161.374.2000111.6Q346 L349 R350 L368 Q369 M370 L375 L376Q346-L372 HydrophobicContact CB-CD1 4.43Å; Q346-L372 HydrophobicContact CG-CD1 3.56Å; Q346-L372 HydrophobicContact CG-CG 4.48Å; L349-L372 HydrophobicContact CB-CD1 4.06Å; R350-L372 HydrophobicContact CG-CD1 4.17Å; R350-L372 HydrophobicContact CG-CD2 4.33Å; L368-L372 PolarHBondContact O-N 2.85Å; Q369-L372 WeakPolarHBondContact O-CB 3.38Å; Q369-L372 PolarHBondContact O-N 3.47Å; Q369-L372 VanDerWaalsContact O-N 3.15Å; M370-L372 VanDerWaalsContact C-N 3.33Å; L372-L375 PolarHBondContact O-N 3.3Å; L372-L376 PolarHBondContact O-N 3.27Å
373E91Very high88.9Confident109 Ų10976.9 Ų76.951%0.50938%0.377SS..Hα-helixtrans-64-43.7175.3-71.6164.8-166.500111.9Q369 M370 L375 L376 A377Q369-E373 WeakPolarHBondContact O-CG 3.47Å; Q369-E373 PolarHBondContact O-N 3.02Å; M370-E373 PolarHBondContact O-N 3.28Å; E373-L375 VanDerWaalsContact C-N 3.29Å; E373-L375 PolarHBondContact O-N 3.4Å; E373-L376 PolarHBondContact O-N 3.27Å; E373-A377 PolarHBondContact O-N 3.4Å
374R90.1Very high88.8Confident134 Ų13477 Ų7751%0.50637%0.369SS..Hα-helixtrans-59.2-37173.3-72.6179.5-174.7-166.25.1112.5E101 M370 Q371 R378E101-R374 IonicContact OE1-CZ 3.28Å; E101-R374 IonicContact OE1-NH1 3.6Å; E101-R374 PolarHBondContact OE1-NH1 3.28Å; E101-R374 IonicContact OE1-NH2 3.57Å; E101-R374 IonicContact OE2-NH1 2.81Å; E101-R374 PolarHBondContact OE2-NH1 2.91Å; M370-R374 WeakPolarHBondContact O-CG 3.43Å; M370-R374 PolarHBondContact O-N 2.91Å; Q371-R374 PolarHBondContact O-N 2.92Å; R374-R378 PolarHBondContact O-N 3.31Å; R374-R378 VanDerWaalsContact O-N 3.12Å
375L89.9Confident88.4Confident18 Ų1879.1 Ų79.19%0.09438%0.378CS..Hα-helixtrans-73.9-37.2177.3-78164000113I342 R345 L349 Q371 L372 E373 R378 Q379I342-L375 HydrophobicContact CG1-CD2 4.37Å; I342-L375 HydrophobicContact CG2-CD2 4.47Å; R345-L375 HydrophobicContact CB-CD1 4.33Å; R345-L375 HydrophobicContact CG-CD1 3.81Å; L349-L375 HydrophobicContact CD1-CD1 3.36Å; Q371-L375 PolarHBondContact O-N 3.01Å; Q371-L375 VanDerWaalsContact O-N 3.09Å; L372-L375 PolarHBondContact O-N 3.3Å; E373-L375 VanDerWaalsContact C-N 3.29Å; E373-L375 PolarHBondContact O-N 3.4Å; L375-R378 PolarHBondContact O-N 3.21Å; L375-Q379 WeakPolarHBondContact O-CB 3.46Å; L375-Q379 PolarHBondContact O-N 3.47Å
376L90.4Very high88.1Confident73 Ų7380.4 Ų80.438%0.38239%0.388SS..Hα-helixtrans-61.7-44.3172-79.3163.4000111.4Q346 L372 E373 R378 Q379 M380Q346-L376 VanDerWaalsContact NE2-CD2 3.26Å; L372-L376 PolarHBondContact O-N 3.27Å; E373-L376 PolarHBondContact O-N 3.27Å; L376-R378 PolarHBondContact O-N 3.09Å; L376-Q379 WeakPolarHBondContact O-CB 3.4Å; L376-Q379 PolarHBondContact O-N 2.81Å; L376-M380 PolarHBondContact O-N 3.28Å
377A88.9Confident87.7Confident62 Ų6274.2 Ų74.251%0.51237%0.374SS..Hα-helixtrans-58.5-46.6174.300000111.7E373 Q379 M380 E381E373-A377 PolarHBondContact O-N 3.4Å; A377-Q379 VanDerWaalsContact C-N 3.32Å; A377-Q379 PolarHBondContact O-N 3.24Å; A377-M380 PolarHBondContact O-N 2.85Å; A377-E381 PolarHBondContact O-N 3.32Å
378R86.3Confident87.2Confident133 Ų13373.7 Ų73.750%0.50237%0.374SS..Hα-helixtrans-65.3-31.7177-178.154175.8-1111.1113.5I342 R374 L375 L376 E381 I382I342-R378 HydrophobicContact CD1-CG 4.08Å; R374-R378 PolarHBondContact O-N 3.31Å; R374-R378 VanDerWaalsContact O-N 3.12Å; L375-R378 PolarHBondContact O-N 3.21Å; L376-R378 PolarHBondContact O-N 3.09Å; R378-E381 WeakPolarHBondContact CD-OE2 3.27Å; R378-E381 IonicContact NE-OE2 2.67Å; R378-E381 IonicContact NH1-OE2 3.69Å; R378-I382 HydrophobicContact CG-CD1 4.26Å; R378-I382 WeakPolarHBondContact O-CG1 3.33Å; R378-I382 PolarHBondContact O-N 2.83Å
379Q89.2Confident86.3Confident46 Ų4678.1 Ų78.122%0.21539%0.394CS..Hα-helixtrans-65.5-43173.2-165.11781500111L339 I342 L375 L376 A377 L383L339-Q379 HydrophobicContact CD2-CG 3.94Å; I342-Q379 HydrophobicContact CG2-CB 4.14Å; I342-Q379 HydrophobicContact CG2-CG 4.33Å; L375-Q379 WeakPolarHBondContact O-CB 3.46Å; L375-Q379 PolarHBondContact O-N 3.47Å; L376-Q379 WeakPolarHBondContact O-CB 3.4Å; L376-Q379 PolarHBondContact O-N 2.81Å; A377-Q379 VanDerWaalsContact C-N 3.32Å; A377-Q379 PolarHBondContact O-N 3.24Å; Q379-L383 HydrophobicContact CG-CD1 4.44Å; Q379-L383 WeakPolarHBondContact O-CG 3.43Å; Q379-L383 PolarHBondContact O-N 3.4Å
380M86.8Confident85.8Confident114 Ų11480.7 Ų80.756%0.56241%0.406SS*.Hα-helixtrans-69.1-36.4177-68.4-173.970.400112.8L376 A377 L383 Q384L376-M380 PolarHBondContact O-N 3.28Å; A377-M380 PolarHBondContact O-N 2.85Å; M380-L383 PolarHBondContact O-N 2.66Å; M380-Q384 WeakPolarHBondContact O-CB 3.43Å; M380-Q384 VanDerWaalsContact O-CG 3.27Å; M380-Q384 WeakPolarHBondContact O-CG 3.31Å; M380-Q384 PolarHBondContact O-N 3.02Å
381E86.9Confident85.2Confident95 Ų9584.3 Ų84.344%0.44442%0.415SS..Hα-helixtrans-56-54173.4-175.2-179-167.800110.9A377 R378 L383 Q384 D385A377-E381 PolarHBondContact O-N 3.32Å; R378-E381 WeakPolarHBondContact CD-OE2 3.27Å; R378-E381 IonicContact NE-OE2 2.67Å; R378-E381 IonicContact NH1-OE2 3.69Å; E381-L383 VanDerWaalsContact C-N 3.33Å; E381-L383 PolarHBondContact O-N 2.9Å; E381-Q384 PolarHBondContact O-N 3.49Å; E381-Q384 VanDerWaalsContact O-N 3.13Å; E381-D385 PolarHBondContact O-N 3.05Å
382I86.4Confident84.2Confident26 Ų2686.3 Ų86.313%0.13343%0.427CS..Hα-helixtrans-60.6-39.8179.7-67.6165.6000112.1I335 A338 L339 I342 R378 A386I335-I382 HydrophobicContact CG2-CG2 4.12Å; A338-I382 HydrophobicContact CB-CD1 4.39Å; L339-I382 HydrophobicContact CD2-CG2 4.17Å; L339-I382 HydrophobicContact CG-CG2 4.32Å; I342-I382 HydrophobicContact CD1-CD1 3.57Å; R378-I382 HydrophobicContact CG-CD1 4.26Å; R378-I382 WeakPolarHBondContact O-CG1 3.33Å; R378-I382 PolarHBondContact O-N 2.83Å; I382-A386 WeakPolarHBondContact O-CB 3.21Å; I382-A386 PolarHBondContact O-N 2.76Å
383L86.1Confident83.1Confident90 Ų9091 Ų9147%0.47145%0.448SS..Hα-helixtrans-71.9-31.6177.9-68.6171.2000112.7L339 Q379 M380 E381 A387L339-L383 HydrophobicContact CD1-CD2 4Å; L339-L383 HydrophobicContact CD2-CD2 4.37Å; L339-L383 HydrophobicContact CD2-CG 4.32Å; Q379-L383 HydrophobicContact CG-CD1 4.44Å; Q379-L383 WeakPolarHBondContact O-CG 3.43Å; Q379-L383 PolarHBondContact O-N 3.4Å; M380-L383 PolarHBondContact O-N 2.66Å; E381-L383 VanDerWaalsContact C-N 3.33Å; E381-L383 PolarHBondContact O-N 2.9Å; L383-A387 WeakPolarHBondContact O-CB 3.43Å; L383-A387 PolarHBondContact O-N 2.73Å; L383-A387 VanDerWaalsContact O-N 3.1Å
384Q83.3Confident82.2Confident117 Ų11788.6 Ų88.655%0.54745%0.447SS..Hα-helixtrans-71.6-44.3173.8-76174.344.900111.4M380 E381 A386 A387 V388M380-Q384 WeakPolarHBondContact O-CB 3.43Å; M380-Q384 VanDerWaalsContact O-CG 3.27Å; M380-Q384 WeakPolarHBondContact O-CG 3.31Å; M380-Q384 PolarHBondContact O-N 3.02Å; E381-Q384 PolarHBondContact O-N 3.49Å; E381-Q384 VanDerWaalsContact O-N 3.13Å; Q384-A386 VanDerWaalsContact C-N 3.33Å; Q384-A386 PolarHBondContact O-N 3.5Å; Q384-A387 PolarHBondContact O-N 2.67Å; Q384-V388 WeakPolarHBondContact O-CB 3.49Å; Q384-V388 WeakPolarHBondContact O-CG2 3.27Å; Q384-V388 PolarHBondContact O-N 2.76Å
385D80.1Confident80.9Confident104 Ų10487.1 Ų87.156%0.55645%0.449SS*.Hα-helixtrans-59.3-43.9175-78.3-15.3000111.4E381 V388 Q389E381-D385 PolarHBondContact O-N 3.05Å; D385-V388 PolarHBondContact O-N 3.02Å; D385-Q389 WeakPolarHBondContact O-CB 3.36Å; D385-Q389 PolarHBondContact O-N 3.42Å
386A82.3Confident79Confident34 Ų3492.2 Ų92.228%0.28148%0.476SS..Hα-helixtrans-60.3-45.3174.700000112.5I382 Q384 V388 Q389 E390I382-A386 WeakPolarHBondContact O-CB 3.21Å; I382-A386 PolarHBondContact O-N 2.76Å; Q384-A386 VanDerWaalsContact C-N 3.33Å; Q384-A386 PolarHBondContact O-N 3.5Å; A386-V388 VanDerWaalsContact C-N 3.33Å; A386-V388 PolarHBondContact O-N 2.89Å; A386-Q389 PolarHBondContact O-N 2.99Å; A386-E390 WeakPolarHBondContact O-CB 3.32Å; A386-E390 PolarHBondContact O-N 3.14Å
387A81.6Confident76.6Confident43 Ų43100.1 Ų100.136%0.35550%0.501SS..Hα-helixtrans-69.9-27.1177.700000113.5L383 Q384 R391L383-A387 WeakPolarHBondContact O-CB 3.43Å; L383-A387 PolarHBondContact O-N 2.73Å; L383-A387 VanDerWaalsContact O-N 3.1Å; Q384-A387 PolarHBondContact O-N 2.67Å; A387-R391 WeakPolarHBondContact O-CB 3.36Å; A387-R391 PolarHBondContact O-N 3.41Å; A387-R391 VanDerWaalsContact O-N 3.12Å
388V79.8Confident74.6Confident77 Ų77106.9 Ų106.947%0.46751%0.513SS..Hα-helixtrans-72.3-41.7170.5167.70000110.3Q384 D385 A386 R391 L392Q384-V388 WeakPolarHBondContact O-CB 3.49Å; Q384-V388 WeakPolarHBondContact O-CG2 3.27Å; Q384-V388 PolarHBondContact O-N 2.76Å; D385-V388 PolarHBondContact O-N 3.02Å; A386-V388 VanDerWaalsContact C-N 3.33Å; A386-V388 PolarHBondContact O-N 2.89Å; V388-R391 PolarHBondContact O-N 3.32Å; V388-L392 HydrophobicContact CG1-CD1 4Å; V388-L392 WeakPolarHBondContact O-CG 3.39Å; V388-L392 PolarHBondContact O-N 3.02Å
389Q72.1Confident72.5Confident106 Ų106106.2 Ų106.250%0.49552%0.518SS..Hα-helixtrans-64.2-43.1175.9-174.5173.3-900112.1D385 A386 L392 Q393D385-Q389 WeakPolarHBondContact O-CB 3.36Å; D385-Q389 PolarHBondContact O-N 3.42Å; A386-Q389 PolarHBondContact O-N 2.99Å; Q389-L392 PolarHBondContact O-N 3.29Å; Q389-Q393 WeakPolarHBondContact O-CG 3.48Å; Q389-Q393 PolarHBondContact O-N 2.92Å
390E79.1Confident70.3Confident137 Ų137108.2 Ų108.264%0.6454%0.535SS*.Hα-helixtrans-58.5-46.3171.7-174.2-170.6175.300111.2A386 L392 Q393 A394A386-E390 WeakPolarHBondContact O-CB 3.32Å; A386-E390 PolarHBondContact O-N 3.14Å; E390-L392 VanDerWaalsContact C-N 3.33Å; E390-L392 PolarHBondContact O-N 3.12Å; E390-Q393 PolarHBondContact O-N 2.64Å; E390-A394 WeakPolarHBondContact O-CB 3.47Å; E390-A394 PolarHBondContact O-N 2.98Å
391R78Confident68.2Low172 Ų172108.3 Ų108.365%0.64954%0.544SS*.Hα-helixtrans-63.3-36.9178.3-171.1-179.1-58.4-176.43.1112.9A387 V388 L395A387-R391 WeakPolarHBondContact O-CB 3.36Å; A387-R391 PolarHBondContact O-N 3.41Å; A387-R391 VanDerWaalsContact O-N 3.12Å; V388-R391 PolarHBondContact O-N 3.32Å; R391-L395 HydrophobicContact CG-CD1 4.38Å; R391-L395 WeakPolarHBondContact O-CD1 3.49Å; R391-L395 WeakPolarHBondContact O-CG 3.48Å; R391-L395 PolarHBondContact O-N 3.21Å; R391-L395 VanDerWaalsContact O-N 3.14Å
392L69.1Low66.2Low99 Ų99107 Ų10752%0.51855%0.55SS..Hα-helixtrans-66.1-47.3175-74.5164.2000111V388 Q389 E390 A394 L395 D396V388-L392 HydrophobicContact CG1-CD1 4Å; V388-L392 WeakPolarHBondContact O-CG 3.39Å; V388-L392 PolarHBondContact O-N 3.02Å; Q389-L392 PolarHBondContact O-N 3.29Å; E390-L392 VanDerWaalsContact C-N 3.33Å; E390-L392 PolarHBondContact O-N 3.12Å; L392-A394 VanDerWaalsContact C-N 3.29Å; L392-A394 PolarHBondContact O-N 3.13Å; L392-L395 WeakPolarHBondContact O-CB 3.32Å; L392-L395 PolarHBondContact O-N 2.83Å; L392-D396 PolarHBondContact O-N 2.58Å
393Q67.7Low64.1Low121 Ų121109.3 Ų109.357%0.56557%0.573SS**Hα-helixtrans-59.6-39.4174.8-70.8177-9.900112.2Q389 E390 L395 D396 W397Q389-Q393 WeakPolarHBondContact O-CG 3.48Å; Q389-Q393 PolarHBondContact O-N 2.92Å; E390-Q393 PolarHBondContact O-N 2.64Å; Q393-L395 PolarHBondContact O-N 2.91Å; Q393-D396 PolarHBondContact O-N 3.39Å; Q393-W397 PolarHBondContact O-N 3.29Å
394A71.6Confident62Low59 Ų59112.2 Ų112.249%0.48859%0.588SS.*Hα-helixtrans-69.4-17.4175.700000114.1E390 L392 R398E390-A394 WeakPolarHBondContact O-CB 3.47Å; E390-A394 PolarHBondContact O-N 2.98Å; L392-A394 VanDerWaalsContact C-N 3.29Å; L392-A394 PolarHBondContact O-N 3.13Å; A394-R398 WeakPolarHBondContact O-CG 3.46Å
395L63.2Low60.1Low104 Ų104114 Ų11455%0.54559%0.594SS.*Hα-helixtrans-87.4-42.1173.2-77.9162.2000111.7R391 L392 Q393 W397 R398R391-L395 HydrophobicContact CG-CD1 4.38Å; R391-L395 WeakPolarHBondContact O-CD1 3.49Å; R391-L395 WeakPolarHBondContact O-CG 3.48Å; R391-L395 PolarHBondContact O-N 3.21Å; R391-L395 VanDerWaalsContact O-N 3.14Å; L392-L395 WeakPolarHBondContact O-CB 3.32Å; L392-L395 PolarHBondContact O-N 2.83Å; Q393-L395 PolarHBondContact O-N 2.91Å; L395-W397 PolarHBondContact O-N 3.27Å; L395-R398 WeakPolarHBondContact O-CB 3.24Å; L395-R398 PolarHBondContact O-N 3.3Å
396D50.6Low58.3Low125 Ų125119.3 Ų119.367%0.66861%0.608SS**Hα-helixtrans-60.1-33.9176.7-73.2-25.6000112L392 Q393 R398L392-D396 PolarHBondContact O-N 2.58Å; Q393-D396 PolarHBondContact O-N 3.39Å; D396-R398 PolarHBondContact O-N 3.23Å
397W40.3Very low56.2Low238 Ų238125.1 Ų125.190%0.90263%0.633SS**THydrogen-bonded Turntrans-70.5-6.2174.7-164.3-109.7000114.4Q393 L395Q393-W397 PolarHBondContact O-N 3.29Å; L395-W397 PolarHBondContact O-N 3.27Å
398R47.2Very low54Low205 Ų205129.3 Ų129.377%0.77465%0.65SS**THydrogen-bonded Turntrans-94.219.1-179.2-68.8-136-170-177.94.3115.2A394 L395 D396 P400A394-R398 WeakPolarHBondContact O-CG 3.46Å; L395-R398 WeakPolarHBondContact O-CB 3.24Å; L395-R398 PolarHBondContact O-N 3.3Å; D396-R398 PolarHBondContact O-N 3.23Å; R398-P400 VanDerWaalsContact O-CD 3.3Å; R398-P400 WeakPolarHBondContact O-CD 3.34Å
399I40.6Very low52Low119 Ų119131.9 Ų131.961%0.6166%0.661SS**  trans-10697.5170.4-53.7-179.6000109.6
400P42.6Very low50.4Low88 Ų88130.8 Ų130.857%0.57167%0.67SS**  trans-60.3135.2173.1-23.734.2000111.2R398 A402 A403R398-P400 VanDerWaalsContact O-CD 3.3Å; R398-P400 WeakPolarHBondContact O-CD 3.34Å; P400-A402 PolarHBondContact O-N 3.15Å; P400-A403 PolarHBondContact O-N 3.36Å
401P43.5Very low48.5Very low115 Ų115133.2 Ų133.275%0.74768%0.681SS**THydrogen-bonded Turntrans-57.9-9.8-179.4-28.736.1000116.2A403P401-A403 VanDerWaalsContact C-N 3.34Å
402A44.7Very low46.5Very low68 Ų68132.1 Ų132.156%0.56269%0.688SS**THydrogen-bonded Turntrans-67.8-29.5173.900000113.4P400 L404 K405P400-A402 PolarHBondContact O-N 3.15Å; A402-L404 VanDerWaalsContact C-N 3.27Å; A402-L404 PolarHBondContact O-N 2.97Å; A402-K405 PolarHBondContact O-N 3.26Å
403A42.8Very low44.9Very low75 Ų75133.6 Ų133.662%0.6270%0.702SS**THydrogen-bonded Turntrans-66.6-24.7-172.800000114P400 P401P400-A403 PolarHBondContact O-N 3.36Å; P401-A403 VanDerWaalsContact C-N 3.34Å
404L42.7Very low43.2Very low151 Ų151136.6 Ų136.679%0.79172%0.721SS**THydrogen-bonded Turntrans-83.5-11.7-178.1-100.3166000114.5A402A402-L404 VanDerWaalsContact C-N 3.27Å; A402-L404 PolarHBondContact O-N 2.97Å
405K43.6Very low41.2Very low154 Ų154137.5 Ų137.567%0.6774%0.736SS**G310 helixtrans-81.8-24.1-173-66.8-162.1173.6-168.50114.6A402 L407A402-K405 PolarHBondContact O-N 3.26Å; K405-L407 PolarHBondContact O-N 2.66Å
406Y41Very low39.7Very low215 Ų215137.3 Ų137.384%0.84375%0.75SS**G310 helixtrans-84.51.3-170.1-87.5-77.2000116.4
407L37.7Very low38.6Very low157 Ų157136.6 Ų136.682%0.82276%0.761SS**G310 helixtrans-100.6-14.7178.4-154.368.7000113.8K405K405-L407 PolarHBondContact O-N 2.66Å
408N36.5Very low38.1Very low130 Ų130128.8 Ų128.870%0.69576%0.755SS**THydrogen-bonded Turntrans-89.3-29.8-171.5-164.378.7000113.8A410N408-A410 VanDerWaalsContact C-N 3.27Å; N408-A410 PolarHBondContact O-N 2.7Å
409D37.5Very low37.2Very low131 Ų131124.1 Ų124.170%0.70176%0.76SS**THydrogen-bonded Turntrans-852.4-174.7-61.1-28.8000113.6
410A39.5Very low36.7Very low83 Ų83123.5 Ų123.569%0.68677%0.773SS**THydrogen-bonded Turntrans-87.40-174.900000115.2N408N408-A410 VanDerWaalsContact C-N 3.27Å; N408-A410 PolarHBondContact O-N 2.7Å
411Q37.3Very low36.1Very low188 Ų188126 Ų12688%0.87978%0.782SS**SBendtrans-121.54.7-174-79.9-160.3-4600116.2
412N37.4Very low35.6Very low150 Ų150127.3 Ų127.380%0.80278%0.782SS**  trans-133.345.7-167.4-151.613.4000116.5
413T35.5Very low34.8Very low130 Ų130128.8 Ų128.880%0.79879%0.788SS**  trans-139.370.6174.543.70000113.7
414N32.4Very low34.3Very low183 Ų183136.5 Ų136.598%0.97980%0.801SS**  trans-111.485.4161.4-98.4-30.1000109.3
415G29.1Very low33.6Very low78 Ų78135.3 Ų135.380%0.80480%0.795SS**  trans-167.6125.3-176.600000113
416A30.4Very low32.9Very low101 Ų101132.8 Ų132.884%0.83580%0.797SS**  trans-73.8156.4-162.200000118.3
417A29.4Very low32.4Very low109 Ų109130.7 Ų130.790%0.90180%0.795SS**  trans72143.4150.900000120
418G28.1Very low32Very low74 Ų74127.5 Ų127.576%0.76378%0.779SS**  trans-179.8-17.9176.500000123.5
419A28.7Very low31.7Very low108 Ų108129 Ų12989%0.89379%0.787SS**  trans58.7173.3169.600000120.7
420A30.5Very low31.4Very low106 Ų106132 Ų13288%0.87679%0.788SS**  trans85.3109.4163.100000121.3
421D29.5Very low31.7Very low141 Ų141132.8 Ų132.875%0.75479%0.786SS**  trans-73.2-175.3177-175.419.3000116.1
422L32.8Very low31.6Very low142 Ų142130.7 Ų130.774%0.74378%0.779SS**  trans95.279.2157.5-65.1159.3000122
423S28.9Very low31.2Very low98 Ų98129.5 Ų129.569%0.68577%0.773SS**  42.1140.3113.7-58.80000124.5
424R30.9Very low30.9Very low237 Ų237130.5 Ų130.589%0.89477%0.773SS**  trans80.4150.4156.2-68.5172.179.8-178.64118.7
425D29.1Very low30.8Very low126 Ų126132.4 Ų132.467%0.67477%0.767SS**  cis-171.3153.2-22.4-163.5-27.3000109.4
426S29.7Very low30.8Very low102 Ų102135.2 Ų135.271%0.71377%0.767SS**  trans67.7159.9163.4-64.10000118.3
427Q29.2Very low30.7Very low170 Ų170136.9 Ų136.979%0.79477%0.767SS**  cis-146.61756.9-141.8-161.2-56.800114.1
428D30.8Very low30.8Very low91 Ų91136.6 Ų136.649%0.48776%0.758SS.*  trans-35.5149.6-175.9-63.9-84.7000120.5R430D428-R430 IonicContact OD1-CZ 3.21Å; D428-R430 IonicContact OD1-NE 2.81Å; D428-R430 IonicContact OD1-NH2 2.68Å; D428-R430 PolarHBondContact OD1-NH2 3.3Å
429D29Very low30.8Very low161 Ų161142.1 Ų142.186%0.86177%0.765SS**  -145.9163.6104.6-138.6-27.6000112.4
430R32.3Very low30.7Very low194 Ų194141.6 Ų141.673%0.73275%0.754SS**  trans-146.7-170.6-168.1-114.7-172.6-76.6-150.5-6.7110.6D428D428-R430 IonicContact OD1-CZ 3.21Å; D428-R430 IonicContact OD1-NE 2.81Å; D428-R430 IonicContact OD1-NH2 2.68Å; D428-R430 PolarHBondContact OD1-NH2 3.3Å
431P44.3Very low30.5Very low99 Ų99143.9 Ų143.964%0.64375%0.749SS**  cis-140.1175.97.244.9-27.5000117.8
432I35.4Very low30.6Very low144 Ų144145.6 Ų145.674%0.73875%0.752SS**  trans66.7144.7143.7-103.774.2000118.5
433N29Very low30.6Very low126 Ų126147.9 Ų147.967%0.67476%0.759SS**  cis-144.5172.2-1.3-112.7-39.7000107.1
434L29.5Very low30.8Very low151 Ų151146.1 Ų146.179%0.79176%0.757SS**  cis-143167.616.6-168.658.8000110.7
435R30.4Very low31.1Very low223 Ų223143.1 Ų143.184%0.84276%0.758SS**  trans-72.7147.5-173.6-60.2173.3-179.4156.6-1.1114.6
436V29.2Very low31.8Very low136 Ų136143 Ų14382%0.82476%0.757SS**  trans-93.4133.9151.5175.30000108.9
437V28.7Very low32.8Very low136 Ų136142.6 Ų142.682%0.82475%0.752SS**  trans-133.2128.2157.2173.90000108.1
438S30.4Very low33.8Very low103 Ų103141.1 Ų141.172%0.7275%0.749SS**  trans-66145-166.7-40.10000115.4
439Q28.4Very low34.6Very low191 Ų191139.5 Ų139.589%0.89375%0.753SS**  trans-151102.5141.9-118.316941.400113.3
440S26.8Very low35.5Very low97 Ų97138 Ų13868%0.67874%0.739SS**  trans49128141.761.60000123.5
441M27.3Very low36.5Very low154 Ų154135 Ų13576%0.75973%0.734SS**  trans91.8122.8146.4-55.8-12967.800120.1
442Q31Very low36.7Very low176 Ų176136 Ų13682%0.82273%0.733SS**  trans64.9149160.5-66162.9-9.500115.5
443E32.1Very low37.7Very low190 Ų190132 Ų13289%0.88872%0.721SS**  cis-134.6165.17.8-161168.2-175.200110.5
444G33.1Very low38.8Very low62 Ų62130.7 Ų130.764%0.63971%0.714SS**  trans-92.9135-173.900000114.3L446G444-L446 PolarHBondContact O-N 3.31Å
445D37Very low40.3Very low174 Ų174126.8 Ų126.893%0.9369%0.692SS**  trans-55130.1179-84.6-60.5000113.9
446L43.4Very low41.4Very low124 Ų124121.6 Ų121.665%0.64968%0.68SS**  trans-126.5126.8170.1-87.1149.4000108.6G444 K450G444-L446 PolarHBondContact O-N 3.31Å; L446-K450 HydrophobicContact CD2-CD 4.04Å
447P52.6Low42.8Very low92 Ų92122.6 Ų122.660%0.59767%0.673SS**  trans-68139.2-168.825.6-34.7000112.8G449 K450P447-G449 PolarHBondContact O-N 3.36Å; P447-K450 PolarHBondContact O-N 3.2Å
448L49.5Very low44.4Very low139 Ų139123.6 Ų123.673%0.72866%0.662SS**THydrogen-bonded Turntrans-49.6-27.3-171.5-71.5104.7000115.5K450 Q451 L452L448-K450 PolarHBondContact O-N 3.28Å; L448-Q451 WeakPolarHBondContact O-CB 3.43Å; L448-Q451 PolarHBondContact O-N 2.66Å; L448-L452 PolarHBondContact O-N 3.18Å
449G46.8Very low45.4Very low57 Ų57125.1 Ų125.159%0.58866%0.658SS**Hα-helixtrans-56.1-30.4175.900000114.2P447 A453P447-G449 PolarHBondContact O-N 3.36Å; G449-A453 WeakPolarHBondContact O-CB 3.38Å; G449-A453 PolarHBondContact O-N 2.96Å
450K49.4Very low46.5Very low130 Ų130123.4 Ų123.457%0.56565%0.65SS**Hα-helixtrans-74.2-29.1174.6-72.1-176.5177.4178.50113L446 P447 L448 N454L446-K450 HydrophobicContact CD2-CD 4.04Å; P447-K450 PolarHBondContact O-N 3.2Å; L448-K450 PolarHBondContact O-N 3.28Å; K450-N454 PolarHBondContact O-N 2.9Å; K450-N454 PolarHBondContact O-ND2 3.48Å
451Q52.4Low47.5Very low131 Ų131124.6 Ų124.661%0.61265%0.648SS**Hα-helixtrans-72.6-48-179.8-152.9169.819.400110L448 A453 N454 E455L448-Q451 WeakPolarHBondContact O-CB 3.43Å; L448-Q451 PolarHBondContact O-N 2.66Å; Q451-A453 VanDerWaalsContact C-N 3.32Å; Q451-A453 PolarHBondContact O-N 3.15Å; Q451-N454 PolarHBondContact O-N 3.32Å; Q451-N454 VanDerWaalsContact O-N 3.15Å; Q451-E455 PolarHBondContact O-N 3.45Å
452L48.5Very low48.6Very low120 Ų120123.9 Ų123.963%0.62864%0.643SS**Hα-helixtrans-60.7-38.3176-17165.3000112.9L448 E455 L456L448-L452 PolarHBondContact O-N 3.18Å; L452-E455 PolarHBondContact O-N 3.01Å; L452-L456 HydrophobicContact CD1-CD1 4.48Å; L452-L456 PolarHBondContact O-N 2.99Å; L452-L456 VanDerWaalsContact O-N 3.09Å
453A55.6Low49.2Very low59 Ų59121.5 Ų121.549%0.48864%0.636SS.*Hα-helixtrans-65.2-37.1175.700000112.9G449 Q451 K457G449-A453 WeakPolarHBondContact O-CB 3.38Å; G449-A453 PolarHBondContact O-N 2.96Å; Q451-A453 VanDerWaalsContact C-N 3.32Å; Q451-A453 PolarHBondContact O-N 3.15Å; A453-K457 WeakPolarHBondContact O-CB 3.4Å; A453-K457 PolarHBondContact O-N 3.09Å
454N53.3Low49.9Very low100 Ų100119.9 Ų119.954%0.53563%0.628SS.*Hα-helixtrans-71-34.7173-80.1-33.9000111.9K450 Q451 K457 R458K450-N454 PolarHBondContact O-N 2.9Å; K450-N454 PolarHBondContact O-ND2 3.48Å; Q451-N454 PolarHBondContact O-N 3.32Å; Q451-N454 VanDerWaalsContact O-N 3.15Å; N454-K457 PolarHBondContact O-N 3.35Å; N454-R458 WeakPolarHBondContact O-CG 3.39Å; N454-R458 PolarHBondContact O-N 3.14Å
455E59.8Low50.4Low68 Ų68122.5 Ų122.532%0.31863%0.627SS.*Hα-helixtrans-62.7-47.7176.7-134.757.3-144.100112.2Q451 L452 K457 R458 H459Q451-E455 PolarHBondContact O-N 3.45Å; L452-E455 PolarHBondContact O-N 3.01Å; E455-K457 VanDerWaalsContact C-N 3.25Å; E455-K457 PolarHBondContact O-N 3.01Å; E455-R458 PolarHBondContact O-N 3.35Å; E455-R458 IonicContact OE1-CZ 2.82Å; E455-R458 IonicContact OE1-NE 3.52Å; E455-R458 PolarHBondContact OE1-NE 2.9Å; E455-R458 IonicContact OE1-NH2 3.51Å; E455-R458 PolarHBondContact OE1-NH2 3.28Å; E455-R458 IonicContact OE2-CZ 2.94Å; E455-R458 IonicContact OE2-NE 2.82Å; E455-R458 IonicContact OE2-NH2 3.52Å; E455-R458 PolarHBondContact OE2-NH2 3.3Å; E455-H459 PolarHBondContact O-N 3.48Å
456L53.9Low50.6Low114 Ų114120 Ų12060%0.59761%0.614SS**Hα-helixtrans-57.4-39.9172.8-100.973.1000112L452 H459 H460L452-L456 HydrophobicContact CD1-CD1 4.48Å; L452-L456 PolarHBondContact O-N 2.99Å; L452-L456 VanDerWaalsContact O-N 3.09Å; L456-H459 PolarHBondContact O-N 2.96Å; L456-H460 PolarHBondContact O-N 3.18Å
457K59.8Low50.4Low157 Ų157121.5 Ų121.568%0.68362%0.623SS**Hα-helixtrans-72.5-33.1-178.8-156.4167.4-174.3176.20112.4A453 N454 E455 N461A453-K457 WeakPolarHBondContact O-CB 3.4Å; A453-K457 PolarHBondContact O-N 3.09Å; N454-K457 PolarHBondContact O-N 3.35Å; E455-K457 VanDerWaalsContact C-N 3.25Å; E455-K457 PolarHBondContact O-N 3.01Å; K457-N461 WeakPolarHBondContact O-CB 3.48Å; K457-N461 PolarHBondContact O-N 2.9Å; K457-N461 VanDerWaalsContact O-N 3.15Å
458R60.8Low49.6Very low157 Ų157122.9 Ų122.959%0.59263%0.625SS**Hα-helixtrans-63.9-47.1169.9-73.9-161.9-74.3-159.32.1111.4N454 E455 H460 N461 H462N454-R458 WeakPolarHBondContact O-CG 3.39Å; N454-R458 PolarHBondContact O-N 3.14Å; E455-R458 PolarHBondContact O-N 3.35Å; E455-R458 IonicContact OE1-CZ 2.82Å; E455-R458 IonicContact OE1-NE 3.52Å; E455-R458 PolarHBondContact OE1-NE 2.9Å; E455-R458 IonicContact OE1-NH2 3.51Å; E455-R458 PolarHBondContact OE1-NH2 3.28Å; E455-R458 IonicContact OE2-CZ 2.94Å; E455-R458 IonicContact OE2-NE 2.82Å; E455-R458 IonicContact OE2-NH2 3.52Å; E455-R458 PolarHBondContact OE2-NH2 3.3Å; R458-H460 PolarHBondContact O-N 3.01Å; R458-N461 PolarHBondContact O-N 3.22Å; R458-H462 WeakPolarHBondContact O-CB 3.3Å; R458-H462 PolarHBondContact O-N 2.96Å
459H52Low48.8Very low135 Ų135124.5 Ų124.563%0.62563%0.628SS**Hα-helixtrans-61.9-41.7178-90.1-86.2000113.2E455 L456 N463E455-H459 PolarHBondContact O-N 3.48Å; L456-H459 PolarHBondContact O-N 2.96Å; H459-N463 PolarHBondContact O-N 3.29Å
460H50.7Low48.4Very low156 Ų156129.6 Ų129.672%0.72264%0.642SS**Hα-helixtrans-62.7-43.9175-106.282.4000112.6L456 R458 N463 H464L456-H460 PolarHBondContact O-N 3.18Å; R458-H460 PolarHBondContact O-N 3.01Å; H460-N463 PolarHBondContact O-N 3.35Å; H460-H464 PolarHBondContact O-N 3.06Å
461N49.4Very low47.6Very low121 Ų121128.8 Ų128.865%0.64765%0.653SS**Hα-helixtrans-73.2-33.7-176.4-150.443.2000112.6K457 R458 H464 N465K457-N461 WeakPolarHBondContact O-CB 3.48Å; K457-N461 PolarHBondContact O-N 2.9Å; K457-N461 VanDerWaalsContact O-N 3.15Å; R458-N461 PolarHBondContact O-N 3.22Å; N461-H464 PolarHBondContact O-N 2.85Å; N461-N465 PolarHBondContact O-N 3.38Å
462H49.8Very low46.4Very low139 Ų139128.4 Ų128.464%0.64467%0.665SS**Hα-helixtrans-63.9-42.4174.5-170.470.3000111.7R458 H464 N465 N466R458-H462 WeakPolarHBondContact O-CB 3.3Å; R458-H462 PolarHBondContact O-N 2.96Å; H462-H464 VanDerWaalsContact C-N 3.31Å; H462-H464 PolarHBondContact O-N 3.44Å; H462-N465 PolarHBondContact O-N 3.35Å; H462-N466 PolarHBondContact O-N 3.37Å
463N44.1Very low45.4Very low126 Ų126127.5 Ų127.567%0.67467%0.669SS**Hα-helixtrans-69-28.2179.1-157.228.2000113H459 H460H459-N463 PolarHBondContact O-N 3.29Å; H460-N463 PolarHBondContact O-N 3.35Å
464H46Very low44.1Very low157 Ų157130.6 Ų130.673%0.72768%0.681SS**Hα-helixtrans-74.8-31.3175.6-15471.1000112.8H460 N461 H462H460-H464 PolarHBondContact O-N 3.06Å; N461-H464 PolarHBondContact O-N 2.85Å; H462-H464 VanDerWaalsContact C-N 3.31Å; H462-H464 PolarHBondContact O-N 3.44Å
465N43.1Very low43Very low116 Ų116132.6 Ų132.662%0.6269%0.692SS**Hα-helixtrans-78.9-29.3-179-155.548.8000113.1N461 H462 N467 N468N461-N465 PolarHBondContact O-N 3.38Å; H462-N465 PolarHBondContact O-N 3.35Å; N465-N467 VanDerWaalsContact C-N 3.25Å; N465-N467 PolarHBondContact O-N 3.26Å; N465-N468 PolarHBondContact O-N 2.79Å
466N41.3Very low41.6Very low123 Ų123137.9 Ų137.966%0.65872%0.717SS**THydrogen-bonded Turntrans-75.6-11.1-175.3-144.838.6000114.1H462H462-N466 PolarHBondContact O-N 3.37Å
467N39.1Very low40.5Very low155 Ų155136.9 Ų136.983%0.82973%0.725SS**THydrogen-bonded Turntrans-958.2179.4-142.125.6000113.2N465N465-N467 VanDerWaalsContact C-N 3.25Å; N465-N467 PolarHBondContact O-N 3.26Å
468N35.8Very low39Very low121 Ų121138.9 Ų138.965%0.64773%0.734SS**SBendtrans-127.532.1-172.8-160.630.3000112.9N465N465-N468 PolarHBondContact O-N 2.79Å
469H34.3Very low37.5Very low172 Ų172137.2 Ų137.280%0.79674%0.741SS**  trans-137.245.6-177.1-107.742.7000112.9
470N37.1Very low37.1Very low165 Ų165136.2 Ų136.288%0.88275%0.746SS**SBendtrans-150.246.9172.4-144.39.2000114.1
471S33Very low36Very low112 Ų112132.8 Ų132.878%0.78375%0.745SS**  trans-161.365.7174.651.90000115.3
472S28.3Very low35.1Very low124 Ų124132.6 Ų132.687%0.86775%0.749SS**  trans-154.7142151.1560000108.6
473S25.8Very low34.1Very low101 Ų101133.7 Ų133.771%0.70675%0.754SS**  cis-151.4154.919.548.70000112.1
474T29.6Very low33.4Very low123 Ų123134.7 Ų134.776%0.75576%0.759SS**  -176117125.418.50000112.9
475D30.3Very low32.6Very low142 Ų142131 Ų13176%0.75976%0.764SS**  trans59.7121.3139.7-51.2-12.1000124.1
476E29.6Very low31.9Very low180 Ų180132.2 Ų132.284%0.84178%0.776SS**  59.3106.2129.4-64.3-76.683.800121.5
477A30Very low31.2Very low92 Ų92130.7 Ų130.776%0.7678%0.775SS**  165.1120.2101.500000116.5
478K29.9Very low30.8Very low200 Ų200132 Ų13287%0.8778%0.776SS**  trans47.9106.8135-127.8166.4-173.6170.40122.8
479T29.2Very low30.4Very low122 Ų122137.3 Ų137.375%0.74879%0.786SS**  trans-14.6165143.454.50000121.2
480P43.4Very low30.3Very low114 Ų114133.3 Ų133.374%0.7478%0.783SS**  cis-145.6-175.6-26.539.6-20000116.7
481A26.9Very low30.6Very low84 Ų84131.5 Ų131.569%0.69478%0.781SS**  trans96.7143.7139.100000124
482T29.8Very low30.3Very low117 Ų117129.3 Ų129.372%0.71878%0.775SS**  trans66.6112.9148.343.20000123.9
483E29.5Very low30.4Very low162 Ų162131.9 Ų131.976%0.75778%0.779SS**  69.1137.7122.4-68.1-171.2-155.700125.2
484N29.3Very low30.8Very low147 Ų147131.2 Ų131.279%0.78678%0.78SS**  trans37.1126.8136.7-58.1-43.5000121.4
485G28.7Very low31.1Very low80 Ų80134.9 Ų134.983%0.82579%0.789SS**  trans-174.9125.1160.300000114.4
486T28.3Very low31.6Very low141 Ų141137.4 Ų137.487%0.86579%0.793SS**  trans-117.5152.4179.7-430000111.5
487S28.3Very low32.2Very low91 Ų91138.9 Ų138.964%0.63680%0.797SS**  trans93.1136.7145-136.40000120.3
488Q28.8Very low32.6Very low182 Ų182140.7 Ų140.785%0.8580%0.798SS**  trans66.7146.7159.4-64.4168.623.700116.1
489R29.2Very low33.1Very low232 Ų232138.8 Ų138.888%0.87580%0.796SS**  cis-164.313847.9178.6175.4-173.21733.4112.7
490A30.7Very low33.5Very low88 Ų88141.7 Ų141.773%0.72780%0.798SS**  trans-93.8157.8159.500000109
491P43.4Very low33.2Very low128 Ų128141.1 Ų141.183%0.83180%0.796SS**  -130.3-179.954.231.5-11.1000113.2
492G27.1Very low34Very low65 Ų65145.8 Ų145.867%0.6780%0.804SS**  cis134.2149-1.800000111.9
493N30.6Very low35.4Very low178 Ų178145 Ų14595%0.95280%0.801SS**  trans-164.5159.3161.2-113.3-14.9000110.3
494A33.6Very low36.3Very low88 Ų88145.7 Ų145.773%0.72780%0.804SS**  trans-106.5154.8178.800000111.2
495E35.9Very low37Very low200 Ų200146 Ų14694%0.93581%0.805SS**  -159.1164.3122.4-114.1178.8178.800112
496K40.8Very low37.9Very low194 Ų194146.8 Ų146.884%0.84380%0.798SS**  trans-110135.9-170.5-55.6167-177.81710110.8
497K42.5Very low38.8Very low212 Ų212150.6 Ų150.692%0.92282%0.822SS**  trans-139.3146.4142.3-71-161.8176.9-179.40111.1
498V38.5Very low39.4Very low129 Ų129153.6 Ų153.678%0.78283%0.831SS**  trans-129.6171.6179.3170.60000106.5
499I40.1Very low39.9Very low161 Ų161152.1 Ų152.183%0.82683%0.83SS**  trans106.9104.9-173.5-62.4158.4000108.1
500K37.3Very low40.5Very low183 Ų183147.6 Ų147.680%0.79683%0.828SS**  cis65.9119.126.9-161.7-162.5-179.6-172.50113
501S37.6Very low41.1Very low101 Ų101151.1 Ų151.171%0.70683%0.833SS**  cis-166166.3-9.8-85.70000106.8
502E44.3Very low40.9Very low183 Ų183152.6 Ų152.686%0.85583%0.834SS**  trans-63.9158.8155.8-118.2171.8142.300110.7
503P59.7Low41.9Very low100 Ų100158.4 Ų158.465%0.64984%0.844SS**  -148.5177.271.542.5-24.1000116.9
504E47.8Very low42.7Very low177 Ų177157 Ų15783%0.82784%0.837SS**  trans37.1138.6138.2-62.7163.5149.100119.5
505D43.7Very low43.4Very low152 Ų152162.3 Ų162.381%0.81385%0.845SS**  -162.1-16155-157.3-19.4000112.1
506S47.8Very low44Very low97 Ų97159.2 Ų159.268%0.67884%0.838SS**  trans-98.1152.2-155.6-47.50000115.4
507T47.6Very low44.3Very low221 Ų221156 Ų156100%1.35684%0.837SS**  trans-158.30143.2-12.60000111.4

Retrieved 507 of 507 residues in 287.4 ms (Link to these results)

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