A0A5K4FD37_SCHMA Loading...

CSN12-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FD37, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 405 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
1M46.7Very low83.7Confident240 Ų24071.8 Ų71.8100%1.18240%0.396SS*.  0134.90-72169.6110.200107.5
2A55.8Low84.7Confident84 Ų8470.4 Ų70.469%0.69439%0.387SS*.PPolyproline II helixtrans-55.3142.3171.700000108.8V4A2-V4 PolarHBondContact O-N 2.9Å
3P66Low85.7Confident70 Ų7065 Ų6546%0.45536%0.357SS..PPolyproline II helixtrans-57.3139.8179-6.39.9000109.6N38 R40P3-N38 VanDerWaalsContact CB-OD1 3.31Å; P3-N38 WeakPolarHBondContact CB-OD1 3.49Å; P3-R40 VanDerWaalsContact C-NH2 3.34Å; P3-R40 PolarHBondContact O-NH1 3.39Å; P3-R40 PolarHBondContact O-NH2 3.08Å
4V85Confident86.6Confident56 Ų5661.7 Ų61.734%0.33934%0.34SS..PPolyproline II helixtrans-73138.5-178.7-177.80000108A2 M8 N38A2-V4 PolarHBondContact O-N 2.9Å; V4-M8 HydrophobicContact CG1-CB 3.47Å; V4-M8 VanDerWaalsContact CG1-CB 3.47Å; V4-N38 PolarHBondContact N-ND2 3.2Å; V4-N38 PolarHBondContact O-ND2 3.48Å
5T92.8Very high87.3Confident40 Ų4062.7 Ų62.725%0.24535%0.345CS..PPolyproline II helixtrans-70.5157.7172.860.70000109.9Q7 M8 Y9 R40T5-Q7 PolarHBondContact O-N 3.27Å; T5-M8 PolarHBondContact O-N 2.96Å; T5-M8 WeakPolarHBondContact OG1-CB 3.46Å; T5-M8 VanDerWaalsContact OG1-CG 3.25Å; T5-M8 WeakPolarHBondContact OG1-CG 3.37Å; T5-M8 PolarHBondContact OG1-N 2.87Å; T5-M8 VanDerWaalsContact OG1-N 3.15Å; T5-Y9 PolarHBondContact O-N 2.9Å; T5-R40 VanDerWaalsContact CG2-NH1 3.29Å
6L93.8Very high88Confident13 Ų1359.6 Ų59.67%0.06833%0.329CS..Hα-helixtrans-58.1-38.4174.5-179.556.7000111.1M8 Y9 L10 L41 V43 I49 V66L6-M8 PolarHBondContact O-N 3.32Å; L6-Y9 HydrophobicContact CD1-CD1 4.15Å; L6-Y9 PolarHBondContact O-N 2.92Å; L6-L10 HydrophobicContact CD1-CD1 4.25Å; L6-L10 HydrophobicContact CD1-CG 4.08Å; L6-L10 HydrophobicContact CG-CD1 4.01Å; L6-L10 HydrophobicContact CG-CG 4.31Å; L6-L10 WeakPolarHBondContact O-CB 3.41Å; L6-L10 VanDerWaalsContact O-CG 3.24Å; L6-L10 WeakPolarHBondContact O-CG 3.42Å; L6-L10 PolarHBondContact O-N 2.89Å; L6-L41 HydrophobicContact CB-CD2 4.32Å; L6-L41 HydrophobicContact CD1-CD2 3.74Å; L6-V43 HydrophobicContact CD2-CB 4.44Å; L6-V43 HydrophobicContact CD2-CG2 3.7Å; L6-I49 HydrophobicContact CD2-CD1 4.03Å; L6-I49 HydrophobicContact CD2-CG2 3.73Å; L6-I49 HydrophobicContact CG-CD1 4.3Å; L6-V66 HydrophobicContact CD1-CG1 4.46Å; L6-V66 HydrophobicContact CD1-CG2 4.23Å
7Q94.6Very high88.5Confident87 Ų8757.4 Ų57.441%0.40732%0.316SS..Hα-helixtrans-61.6-44.2176.6-63.585.1-600112.7T5 L10 Q11 I49 Y53T5-Q7 PolarHBondContact O-N 3.27Å; Q7-L10 PolarHBondContact O-N 2.8Å; Q7-Q11 WeakPolarHBondContact O-CB 3.36Å; Q7-Q11 PolarHBondContact O-N 2.79Å; Q7-I49 HydrophobicContact CG-CD1 4.39Å; Q7-Y53 WeakPolarHBondContact CB-OH 3.31Å; Q7-Y53 HydrophobicContact CG-CE2 4.45Å; Q7-Y53 VanDerWaalsContact CG-OH 3.3Å; Q7-Y53 WeakPolarHBondContact CG-OH 3.45Å
8M95Very high89Confident109 Ų10961.1 Ų61.154%0.53734%0.335SS..Hα-helixtrans-65.7-42.5176.9-73.4173.175.500111.1V4 T5 L6 L10 Q11 D12V4-M8 HydrophobicContact CG1-CB 3.47Å; V4-M8 VanDerWaalsContact CG1-CB 3.47Å; T5-M8 PolarHBondContact O-N 2.96Å; T5-M8 WeakPolarHBondContact OG1-CB 3.46Å; T5-M8 VanDerWaalsContact OG1-CG 3.25Å; T5-M8 WeakPolarHBondContact OG1-CG 3.37Å; T5-M8 PolarHBondContact OG1-N 2.87Å; T5-M8 VanDerWaalsContact OG1-N 3.15Å; L6-M8 PolarHBondContact O-N 3.32Å; M8-L10 PolarHBondContact O-N 3.4Å; M8-Q11 PolarHBondContact O-N 2.88Å; M8-D12 PolarHBondContact O-N 3.26Å
9Y96.7Very high89.4Confident4 Ų461.9 Ų61.92%0.01635%0.346CS..Hα-helixtrans-59-46.6174.8169.3-87.2000111.4T5 L6 Q11 D12 V13 Y28 H35 L41 V62 H65 V66T5-Y9 PolarHBondContact O-N 2.9Å; L6-Y9 HydrophobicContact CD1-CD1 4.15Å; L6-Y9 PolarHBondContact O-N 2.92Å; Y9-Q11 VanDerWaalsContact C-N 3.34Å; Y9-Q11 PolarHBondContact O-N 3.17Å; Y9-D12 PolarHBondContact O-N 3.36Å; Y9-V13 HydrophobicContact CD1-CG2 4.29Å; Y9-V13 HydrophobicContact CE1-CG2 3.87Å; Y9-V13 HydrophobicContact CE2-CG2 4.29Å; Y9-V13 WeakPolarHBondContact O-CB 3.25Å; Y9-V13 VanDerWaalsContact O-CG2 3.29Å; Y9-V13 WeakPolarHBondContact O-CG2 3.4Å; Y9-V13 PolarHBondContact O-N 3.15Å; Y9-Y28 AromaticContact CD2-CD1 3.77Å; Y9-Y28 HydrophobicContact CD2-CD1 3.77Å; Y9-Y28 HydrophobicContact CD2-CE1 4.29Å; Y9-Y28 AromaticContact CE2-CD1 3.58Å; Y9-Y28 HydrophobicContact CE2-CD1 3.58Å; Y9-Y28 HydrophobicContact CE2-CG 4.28Å; Y9-Y28 PolarHBondContact OH-O 2.8Å; Y9-H35 AromaticContact CE2-CD2 3.88Å; Y9-L41 HydrophobicContact CD1-CD2 4.02Å; Y9-L41 HydrophobicContact CD2-CD1 3.62Å; Y9-L41 HydrophobicContact CD2-CD2 4.13Å; Y9-L41 HydrophobicContact CE2-CD1 3.96Å; Y9-L41 HydrophobicContact CG-CD1 4.05Å; Y9-L41 HydrophobicContact CG-CD2 3.66Å; Y9-V62 HydrophobicContact CE1-CG1 4.09Å; Y9-H65 PolarHBondContact OH-CD2 3.27Å; Y9-H65 VanDerWaalsContact OH-CD2 3.26Å; Y9-V66 HydrophobicContact CE1-CG2 4.23Å
10L97.7Very high89.7Confident3 Ų366.2 Ų66.22%0.01636%0.356CS..Hα-helixtrans-62.4-41.7177.2-70.2173.1000111.3L6 Q7 M8 D12 V13 T14 I49 Y53 L54 V62L6-L10 HydrophobicContact CD1-CD1 4.25Å; L6-L10 HydrophobicContact CD1-CG 4.08Å; L6-L10 HydrophobicContact CG-CD1 4.01Å; L6-L10 HydrophobicContact CG-CG 4.31Å; L6-L10 WeakPolarHBondContact O-CB 3.41Å; L6-L10 VanDerWaalsContact O-CG 3.24Å; L6-L10 WeakPolarHBondContact O-CG 3.42Å; L6-L10 PolarHBondContact O-N 2.89Å; Q7-L10 PolarHBondContact O-N 2.8Å; M8-L10 PolarHBondContact O-N 3.4Å; L10-D12 PolarHBondContact O-N 3.21Å; L10-V13 PolarHBondContact O-N 3.37Å; L10-T14 WeakPolarHBondContact O-CB 3.27Å; L10-T14 PolarHBondContact O-N 3.31Å; L10-T14 PolarHBondContact O-OG1 3.04Å; L10-I49 HydrophobicContact CD1-CD1 4.41Å; L10-I49 HydrophobicContact CD1-CG1 3.9Å; L10-I49 HydrophobicContact CD1-CG2 4.34Å; L10-Y53 HydrophobicContact CB-CD1 4.18Å; L10-Y53 HydrophobicContact CB-CD2 4.11Å; L10-Y53 HydrophobicContact CB-CG 3.83Å; L10-Y53 HydrophobicContact CD1-CD2 3.65Å; L10-Y53 HydrophobicContact CD1-CE2 4.12Å; L10-Y53 HydrophobicContact CD1-CG 4.21Å; L10-L54 HydrophobicContact CD2-CD1 3.99Å; L10-V62 HydrophobicContact CD2-CG1 3.61Å
11Q96.2Very high90Very high84 Ų8466.5 Ų66.539%0.39336%0.358SS..Hα-helixtrans-61.6-43.3175.7-172.662.453.600112.3Q7 M8 Y9 V13 T14 N15Q7-Q11 WeakPolarHBondContact O-CB 3.36Å; Q7-Q11 PolarHBondContact O-N 2.79Å; M8-Q11 PolarHBondContact O-N 2.88Å; Y9-Q11 VanDerWaalsContact C-N 3.34Å; Y9-Q11 PolarHBondContact O-N 3.17Å; Q11-V13 VanDerWaalsContact C-N 3.34Å; Q11-T14 PolarHBondContact O-N 3.29Å; Q11-N15 PolarHBondContact NE2-OD1 3.01Å; Q11-N15 WeakPolarHBondContact O-CB 3.42Å; Q11-N15 PolarHBondContact O-N 2.87Å; Q11-N15 PolarHBondContact O-ND2 2.93Å; Q11-N15 PolarHBondContact O-OD1 3.15Å
12D96.4Very high92.4Very high55 Ų5555.2 Ų55.229%0.29430%0.304SS..Hα-helixtrans-66.3-37.4178.1-71-27.1000112M8 Y9 L10 N15 C16 Y28M8-D12 PolarHBondContact O-N 3.26Å; Y9-D12 PolarHBondContact O-N 3.36Å; L10-D12 PolarHBondContact O-N 3.21Å; D12-N15 PolarHBondContact O-N 3.07Å; D12-C16 PolarHBondContact O-N 2.78Å; D12-C16 PolarHBondContact O-SG 2.82Å; D12-Y28 HydrophobicContact CB-CE1 4.18Å; D12-Y28 HydrophobicContact CB-CE2 4.3Å
13V97.9Very high94.4Very high0 Ų060.4 Ų60.40%031%0.305CS..Hα-helixtrans-63.9-48172.51690000110.9Y9 L10 Q11 N15 C16 I17 L25 Y28 L54 V62Y9-V13 HydrophobicContact CD1-CG2 4.29Å; Y9-V13 HydrophobicContact CE1-CG2 3.87Å; Y9-V13 HydrophobicContact CE2-CG2 4.29Å; Y9-V13 WeakPolarHBondContact O-CB 3.25Å; Y9-V13 VanDerWaalsContact O-CG2 3.29Å; Y9-V13 WeakPolarHBondContact O-CG2 3.4Å; Y9-V13 PolarHBondContact O-N 3.15Å; L10-V13 PolarHBondContact O-N 3.37Å; Q11-V13 VanDerWaalsContact C-N 3.34Å; V13-N15 VanDerWaalsContact C-N 3.28Å; V13-N15 PolarHBondContact O-N 2.85Å; V13-C16 WeakPolarHBondContact O-CB 3.41Å; V13-C16 PolarHBondContact O-N 3.48Å; V13-C16 VanDerWaalsContact O-N 3.1Å; V13-I17 HydrophobicContact CG1-CD1 3.83Å; V13-I17 WeakPolarHBondContact O-CG1 3.49Å; V13-I17 PolarHBondContact O-N 3.43Å; V13-L25 HydrophobicContact CG1-CD1 3.75Å; V13-Y28 HydrophobicContact CG2-CD1 4.26Å; V13-Y28 HydrophobicContact CG2-CD2 4.4Å; V13-Y28 HydrophobicContact CG2-CG 3.89Å; V13-L54 HydrophobicContact CG1-CD1 4.39Å; V13-L54 HydrophobicContact CG1-CD2 4.16Å; V13-V62 HydrophobicContact CG1-CG2 3.75Å
14T97.8Very high95.9Very high19 Ų1957.9 Ų57.912%0.11729%0.292CS..Hα-helixtrans-57.2-42.2174.9-60.50000111.1L10 Q11 C16 I17 N18 Y53 L54L10-T14 WeakPolarHBondContact O-CB 3.27Å; L10-T14 PolarHBondContact O-N 3.31Å; L10-T14 PolarHBondContact O-OG1 3.04Å; Q11-T14 PolarHBondContact O-N 3.29Å; T14-C16 PolarHBondContact O-N 2.87Å; T14-I17 PolarHBondContact O-N 3.36Å; T14-N18 WeakPolarHBondContact O-CB 3.42Å; T14-N18 VanDerWaalsContact O-CG 3.27Å; T14-N18 PolarHBondContact O-N 3.4Å; T14-N18 PolarHBondContact O-ND2 3.04Å; T14-Y53 PolarHBondContact OG1-O 3.38Å; T14-L54 WeakPolarHBondContact OG1-CD2 3.33Å
15N97.7Very high96.5Very high76 Ų7655.2 Ų55.241%0.40628%0.276SS..Hα-helixtrans-62.2-41.6176-67.5-20.9000111.9Q11 D12 V13 S19Q11-N15 PolarHBondContact NE2-OD1 3.01Å; Q11-N15 WeakPolarHBondContact O-CB 3.42Å; Q11-N15 PolarHBondContact O-N 2.87Å; Q11-N15 PolarHBondContact O-ND2 2.93Å; Q11-N15 PolarHBondContact O-OD1 3.15Å; D12-N15 PolarHBondContact O-N 3.07Å; V13-N15 VanDerWaalsContact C-N 3.28Å; V13-N15 PolarHBondContact O-N 2.85Å; N15-S19 WeakPolarHBondContact O-CB 3.36Å; N15-S19 PolarHBondContact O-N 3.39Å; N15-S19 PolarHBondContact O-OG 3.29Å
16C98.1Very high96.8Very high13 Ų1353.6 Ų53.69%0.08827%0.266CS..Hα-helixtrans-64.7-38.2176-67.60000112.3D12 V13 T14 S19 R20 N21 L25D12-C16 PolarHBondContact O-N 2.78Å; D12-C16 PolarHBondContact O-SG 2.82Å; V13-C16 WeakPolarHBondContact O-CB 3.41Å; V13-C16 PolarHBondContact O-N 3.48Å; V13-C16 VanDerWaalsContact O-N 3.1Å; T14-C16 PolarHBondContact O-N 2.87Å; C16-S19 PolarHBondContact O-OG 3.2Å; C16-R20 PolarHBondContact O-N 3.28Å; C16-N21 PolarHBondContact O-N 2.95Å; C16-L25 HydrophobicContact CB-CB 3.93Å; C16-L25 HydrophobicContact CB-CD1 4.35Å
17I97.1Very high97Very high22 Ų2257.1 Ų57.111%0.11328%0.282CS..Hα-helixtrans-68-49.5177.6-67159.6000110.5V13 T14 S19 R20 L25 L54 W58 W103V13-I17 HydrophobicContact CG1-CD1 3.83Å; V13-I17 WeakPolarHBondContact O-CG1 3.49Å; V13-I17 PolarHBondContact O-N 3.43Å; T14-I17 PolarHBondContact O-N 3.36Å; I17-S19 VanDerWaalsContact C-N 3.28Å; I17-S19 PolarHBondContact O-N 3.49Å; I17-R20 PolarHBondContact O-N 3.11Å; I17-L25 HydrophobicContact CG1-CD1 4.19Å; I17-L25 HydrophobicContact CG1-CD2 3.66Å; I17-L54 HydrophobicContact CD1-CD2 3.51Å; I17-W58 HydrophobicContact CD1-CB 3.75Å; I17-W58 HydrophobicContact CD1-CD2 3.76Å; I17-W58 HydrophobicContact CD1-CE3 4.04Å; I17-W58 HydrophobicContact CD1-CG 3.64Å; I17-W58 HydrophobicContact CG1-CD2 4Å; I17-W58 HydrophobicContact CG1-CE3 4.24Å; I17-W58 HydrophobicContact CG1-CG 4.27Å; I17-W58 HydrophobicContact CG2-CD2 4.35Å; I17-W58 HydrophobicContact CG2-CG 4.25Å; I17-W103 HydrophobicContact CG2-CH2 4.49Å
18N96.4Very high97.1Very high124 Ų12456.2 Ų56.266%0.66328%0.276SS*.Hα-helixtrans-62.5-36-178.9-71.2-15.3000112.3T14 R20T14-N18 WeakPolarHBondContact O-CB 3.42Å; T14-N18 VanDerWaalsContact O-CG 3.27Å; T14-N18 PolarHBondContact O-N 3.4Å; T14-N18 PolarHBondContact O-ND2 3.04Å; N18-R20 VanDerWaalsContact C-N 3.29Å
19S96.7Very high97.3Very high78 Ų7851.1 Ų51.155%0.54525%0.25SS..THydrogen-bonded Turntrans-84.12.2175.460.10000114.1N15 C16 I17 N21N15-S19 WeakPolarHBondContact O-CB 3.36Å; N15-S19 PolarHBondContact O-N 3.39Å; N15-S19 PolarHBondContact O-OG 3.29Å; C16-S19 PolarHBondContact O-OG 3.2Å; I17-S19 VanDerWaalsContact C-N 3.28Å; I17-S19 PolarHBondContact O-N 3.49Å; S19-N21 PolarHBondContact O-N 3.39Å; S19-N21 VanDerWaalsContact O-N 3.13Å
20R95.4Very high97.3Very high146 Ų14653 Ų5355%0.55126%0.26SS*.THydrogen-bonded Turntrans51.531.8-174.1-59.8-173.7-179.7-167.93.7113.2C16 I17 N18 G22 D101 W103C16-R20 PolarHBondContact O-N 3.28Å; I17-R20 PolarHBondContact O-N 3.11Å; N18-R20 VanDerWaalsContact C-N 3.29Å; R20-G22 PolarHBondContact O-N 3.48Å; R20-D101 IonicContact CZ-OD2 3.72Å; R20-D101 IonicContact NH1-OD2 3.3Å; R20-D101 PolarHBondContact NH1-OD2 3.49Å; R20-W103 HydrophobicContact CB-CB 4.23Å; R20-W103 HydrophobicContact CB-CD2 3.81Å; R20-W103 HydrophobicContact CB-CE3 4.31Å; R20-W103 HydrophobicContact CB-CG 3.77Å; R20-W103 HydrophobicContact CG-CD2 4.31Å; R20-W103 HydrophobicContact CG-CG 4.34Å; R20-W103 WeakPolarHBondContact O-CB 3.24Å
21N97.2Very high97.3Very high73 Ų7353.5 Ų53.539%0.3926%0.264SS..  trans-84.578.2179.4-178.13.7000110.9C16 S19 R23 G24 L25C16-N21 PolarHBondContact O-N 2.95Å; S19-N21 PolarHBondContact O-N 3.39Å; S19-N21 VanDerWaalsContact O-N 3.13Å; N21-R23 VanDerWaalsContact C-N 3.27Å; N21-R23 PolarHBondContact O-N 3.04Å; N21-G24 PolarHBondContact O-N 3.25Å; N21-G24 PolarHBondContact OD1-N 2.95Å; N21-L25 WeakPolarHBondContact O-CB 3.39Å; N21-L25 PolarHBondContact O-N 2.92Å
22G97.3Very high97.2Very high4 Ų452.3 Ų52.34%0.04127%0.265CS..Hα-helixtrans-64.6-30-176.900000114.2R20 S26 W103R20-G22 PolarHBondContact O-N 3.48Å; G22-S26 WeakPolarHBondContact O-CB 3.44Å; G22-S26 PolarHBondContact O-N 2.95Å; G22-S26 PolarHBondContact O-OG 3.47Å; G22-W103 VanDerWaalsContact CA-O 3.28Å; G22-W103 WeakPolarHBondContact CA-O 3.41Å
23R96.6Very high97.2Very high192 Ų19251.2 Ų51.273%0.72526%0.259SS*.Hα-helixtrans-68.2-45.2176.4-173.1175.3-178.8177-1111N21 S26 H27N21-R23 VanDerWaalsContact C-N 3.27Å; N21-R23 PolarHBondContact O-N 3.04Å; R23-S26 PolarHBondContact O-N 3.02Å; R23-S26 PolarHBondContact O-OG 3.17Å; R23-H27 PolarHBondContact O-ND1 3.1Å
24G97.4Very high97Very high18 Ų1855.8 Ų55.819%0.18629%0.289CS..Hα-helixtrans-59.9-51.3172.700000111.2N21 S26 H27 Y28N21-G24 PolarHBondContact O-N 3.25Å; N21-G24 PolarHBondContact OD1-N 2.95Å; G24-S26 VanDerWaalsContact C-N 3.27Å; G24-S26 PolarHBondContact O-N 3.3Å; G24-H27 PolarHBondContact O-N 3.45Å; G24-Y28 WeakPolarHBondContact O-CD2 3.36Å
25L98.4Very high96.8Very high0 Ų056.2 Ų56.20%029%0.289CS..Hα-helixtrans-57.3-38.3179-17455.1000112.8V13 C16 I17 N21 H27 Y28 L29 W58 W103 V107V13-L25 HydrophobicContact CG1-CD1 3.75Å; C16-L25 HydrophobicContact CB-CB 3.93Å; C16-L25 HydrophobicContact CB-CD1 4.35Å; I17-L25 HydrophobicContact CG1-CD1 4.19Å; I17-L25 HydrophobicContact CG1-CD2 3.66Å; N21-L25 WeakPolarHBondContact O-CB 3.39Å; N21-L25 PolarHBondContact O-N 2.92Å; L25-H27 VanDerWaalsContact C-N 3.25Å; L25-H27 PolarHBondContact O-N 2.84Å; L25-Y28 PolarHBondContact O-N 2.81Å; L25-L29 HydrophobicContact CD1-CD1 4.09Å; L25-L29 HydrophobicContact CD1-CG 4.36Å; L25-L29 HydrophobicContact CG-CD1 4Å; L25-L29 PolarHBondContact O-N 3.28Å; L25-L29 VanDerWaalsContact O-N 3.16Å; L25-W58 HydrophobicContact CD2-CE3 4.17Å; L25-W58 HydrophobicContact CD2-CH2 3.79Å; L25-W58 HydrophobicContact CD2-CZ3 3.55Å; L25-W103 HydrophobicContact CD2-CH2 4.02Å; L25-W103 HydrophobicContact CD2-CZ3 3.77Å; L25-V107 HydrophobicContact CB-CG2 4Å; L25-V107 HydrophobicContact CD2-CG2 3.89Å; L25-V107 HydrophobicContact CG-CG2 3.77Å
26S98.3Very high96.6Very high6 Ų653.1 Ų53.14%0.04227%0.273CS..Hα-helixtrans-63.6-27.4178.3730000113.7G22 R23 G24 L29 M30G22-S26 WeakPolarHBondContact O-CB 3.44Å; G22-S26 PolarHBondContact O-N 2.95Å; G22-S26 PolarHBondContact O-OG 3.47Å; R23-S26 PolarHBondContact O-N 3.02Å; R23-S26 PolarHBondContact O-OG 3.17Å; G24-S26 VanDerWaalsContact C-N 3.27Å; G24-S26 PolarHBondContact O-N 3.3Å; S26-L29 PolarHBondContact O-N 2.99Å; S26-M30 VanDerWaalsContact O-CB 3.26Å; S26-M30 WeakPolarHBondContact O-CB 3.29Å; S26-M30 PolarHBondContact O-N 2.95Å; S26-M30 VanDerWaalsContact O-N 3.1Å
27H97.3Very high96.3Very high86 Ų8661 Ų6140%0.39830%0.302SS..Hα-helixtrans-72.9-39175.7-71.965.9000110.7R23 G24 L25 L29 M30 D33 H35R23-H27 PolarHBondContact O-ND1 3.1Å; G24-H27 PolarHBondContact O-N 3.45Å; L25-H27 VanDerWaalsContact C-N 3.25Å; L25-H27 PolarHBondContact O-N 2.84Å; H27-L29 PolarHBondContact O-N 3.07Å; H27-M30 PolarHBondContact O-N 3.29Å; H27-D33 IonicContact CD2-OD2 3.16Å; H27-D33 VanDerWaalsContact O-CB 3.31Å; H27-D33 WeakPolarHBondContact O-CB 3.44Å; H27-H35 PolarHBondContact O-CE1 3.31Å; H27-H35 PolarHBondContact O-ND1 3.04Å
28Y97.5Very high96.2Very high68 Ų6861 Ų6127%0.26730%0.302SS..Hα-helixtrans-67.3-21.4175.6-70.8-70.4000113.6Y9 D12 V13 G24 L25 H35 H65Y9-Y28 AromaticContact CD2-CD1 3.77Å; Y9-Y28 HydrophobicContact CD2-CD1 3.77Å; Y9-Y28 HydrophobicContact CD2-CE1 4.29Å; Y9-Y28 AromaticContact CE2-CD1 3.58Å; Y9-Y28 HydrophobicContact CE2-CD1 3.58Å; Y9-Y28 HydrophobicContact CE2-CG 4.28Å; Y9-Y28 PolarHBondContact OH-O 2.8Å; D12-Y28 HydrophobicContact CB-CE1 4.18Å; D12-Y28 HydrophobicContact CB-CE2 4.3Å; V13-Y28 HydrophobicContact CG2-CD1 4.26Å; V13-Y28 HydrophobicContact CG2-CD2 4.4Å; V13-Y28 HydrophobicContact CG2-CG 3.89Å; G24-Y28 WeakPolarHBondContact O-CD2 3.36Å; L25-Y28 PolarHBondContact O-N 2.81Å; Y28-H35 PolarHBondContact O-CE1 3.16Å; Y28-H35 PolarHBondContact O-NE2 2.91Å; Y28-H35 VanDerWaalsContact O-NE2 3.13Å; Y28-H65 PolarHBondContact O-CD2 2.93Å; Y28-H65 PolarHBondContact O-NE2 2.93Å
29L98.3Very high96Very high2 Ų258.4 Ų58.41%0.0129%0.294CS..THydrogen-bonded Turntrans-106.5-0.2-179.9-65.2175.4000114.1L25 S26 H27 I61 V62 H65 V107L25-L29 HydrophobicContact CD1-CD1 4.09Å; L25-L29 HydrophobicContact CD1-CG 4.36Å; L25-L29 HydrophobicContact CG-CD1 4Å; L25-L29 PolarHBondContact O-N 3.28Å; L25-L29 VanDerWaalsContact O-N 3.16Å; S26-L29 PolarHBondContact O-N 2.99Å; H27-L29 PolarHBondContact O-N 3.07Å; L29-I61 HydrophobicContact CD1-CG2 3.84Å; L29-I61 HydrophobicContact CD2-CG2 4.14Å; L29-V62 HydrophobicContact CD2-CG2 4.17Å; L29-H65 VanDerWaalsContact C-CE1 3.4Å; L29-H65 HydrophobicContact CD2-CB 3.89Å; L29-H65 PolarHBondContact O-CE1 3.23Å; L29-H65 VanDerWaalsContact O-CE1 3.26Å; L29-H65 PolarHBondContact O-ND1 3.38Å; L29-V107 HydrophobicContact CD1-CG1 3.65Å; L29-V107 HydrophobicContact CD1-CG2 4.4Å
30M97.9Very high95.8Very high45 Ų4559.5 Ų59.522%0.22229%0.286CS..  trans-86123-178.6-176.7-169-59.100110.6S26 H27 S32 D33 H35 V110 D114S26-M30 VanDerWaalsContact O-CB 3.26Å; S26-M30 WeakPolarHBondContact O-CB 3.29Å; S26-M30 PolarHBondContact O-N 2.95Å; S26-M30 VanDerWaalsContact O-N 3.1Å; H27-M30 PolarHBondContact O-N 3.29Å; M30-S32 WeakPolarHBondContact CG-OG 3.44Å; M30-S32 PolarHBondContact O-N 3.13Å; M30-S32 VanDerWaalsContact O-N 3.11Å; M30-S32 PolarHBondContact SD-OG 2.89Å; M30-D33 HydrophobicContact CB-CB 4.15Å; M30-D33 WeakPolarHBondContact O-CB 3.31Å; M30-D33 PolarHBondContact O-N 3.05Å; M30-H35 PolarHBondContact O-CE1 3.46Å; M30-V110 HydrophobicContact CB-CB 4.32Å; M30-V110 HydrophobicContact CB-CG1 4.44Å; M30-V110 HydrophobicContact CE-CB 4.41Å; M30-V110 HydrophobicContact CE-CG1 3.49Å; M30-V110 VanDerWaalsContact CE-CG1 3.49Å; M30-V110 HydrophobicContact CG-CB 4.47Å; M30-D114 WeakPolarHBondContact CA-OD2 3.26Å
31C97.4Very high95.8Very high13 Ų1352.6 Ų52.69%0.08826%0.26CS..THydrogen-bonded Turntrans-69-9.7-178.8-70.20000114M72 D114 F118C31-M72 HydrophobicContact CB-SD 4.3Å; C31-D114 HydrophobicContact CB-CB 4.24Å; C31-D114 PolarHBondContact N-OD2 3.38Å; C31-F118 HydrophobicContact CB-CE2 4.35Å; C31-F118 HydrophobicContact CB-CZ 4.24Å
32S94.4Very high95.7Very high59 Ų5950 Ų5041%0.41325%0.249SC..THydrogen-bonded Turntrans-101.20.4173.158.20000114.5M30 R117M30-S32 WeakPolarHBondContact CG-OG 3.44Å; M30-S32 PolarHBondContact O-N 3.13Å; M30-S32 VanDerWaalsContact O-N 3.11Å; M30-S32 PolarHBondContact SD-OG 2.89Å; S32-R117 PolarHBondContact OG-NH1 3.47Å
33D96Very high95.6Very high32 Ų3251.7 Ų51.717%0.17126%0.258CS..SBendtrans-76.5147.7177.2-178.1-85.2000111.2H27 M30 H35 V36H27-D33 IonicContact CD2-OD2 3.16Å; H27-D33 VanDerWaalsContact O-CB 3.31Å; H27-D33 WeakPolarHBondContact O-CB 3.44Å; M30-D33 HydrophobicContact CB-CB 4.15Å; M30-D33 WeakPolarHBondContact O-CB 3.31Å; M30-D33 PolarHBondContact O-N 3.05Å; D33-H35 WeakPolarHBondContact CB-ND1 3.32Å; D33-H35 PolarHBondContact O-N 3.14Å; D33-H35 IonicContact OD1-CE1 3.84Å; D33-H35 IonicContact OD1-CG 3.6Å; D33-H35 PolarHBondContact OD1-N 2.97Å; D33-H35 IonicContact OD1-ND1 2.96Å; D33-H35 PolarHBondContact OD1-ND1 2.91Å; D33-V36 VanDerWaalsContact O-CG2 3.26Å; D33-V36 WeakPolarHBondContact O-CG2 3.47Å; D33-V36 PolarHBondContact O-N 3.29Å
34P93.6Very high95.6Very high96 Ų9644.8 Ų44.862%0.62324%0.238SC*.G310 helixtrans-55.5-23.1-178-2937.3000116.3V36 Y37P34-V36 PolarHBondContact O-N 3.23Å; P34-Y37 WeakPolarHBondContact O-CD2 2.99Å; P34-Y37 PolarHBondContact O-N 2.96Å
35H94.3Very high95.6Very high27 Ų2748.7 Ų48.713%0.12526%0.255CS..G310 helixtrans-61.1-26.5179.975.8-88.3000113.1Y9 H27 Y28 M30 D33 Y37 N38 L41 H65Y9-H35 AromaticContact CE2-CD2 3.88Å; H27-H35 PolarHBondContact O-CE1 3.31Å; H27-H35 PolarHBondContact O-ND1 3.04Å; Y28-H35 PolarHBondContact O-CE1 3.16Å; Y28-H35 PolarHBondContact O-NE2 2.91Å; Y28-H35 VanDerWaalsContact O-NE2 3.13Å; M30-H35 PolarHBondContact O-CE1 3.46Å; D33-H35 WeakPolarHBondContact CB-ND1 3.32Å; D33-H35 PolarHBondContact O-N 3.14Å; D33-H35 IonicContact OD1-CE1 3.84Å; D33-H35 IonicContact OD1-CG 3.6Å; D33-H35 PolarHBondContact OD1-N 2.97Å; D33-H35 IonicContact OD1-ND1 2.96Å; D33-H35 PolarHBondContact OD1-ND1 2.91Å; H35-Y37 PolarHBondContact O-N 3.37Å; H35-Y37 VanDerWaalsContact O-N 3.1Å; H35-N38 WeakPolarHBondContact O-CB 3.36Å; H35-N38 PolarHBondContact O-N 3.13Å; H35-L41 HydrophobicContact CB-CD1 4.18Å; H35-H65 AromaticContact CE1-NE2 3.7Å; H35-H65 AromaticContact NE2-CD2 3.97Å; H35-H65 AromaticContact NE2-CE1 3.78Å; H35-H65 AromaticContact NE2-NE2 2.92Å; H35-H65 PolarHBondContact NE2-NE2 3.35Å
36V94.1Very high95.5Very high11 Ų1148.8 Ų48.87%0.06726%0.256CS..G310 helixtrans-63.1-19.1-179-53.80000113.2D33 P34 N38 I69D33-V36 VanDerWaalsContact O-CG2 3.26Å; D33-V36 WeakPolarHBondContact O-CG2 3.47Å; D33-V36 PolarHBondContact O-N 3.29Å; P34-V36 PolarHBondContact O-N 3.23Å; V36-N38 VanDerWaalsContact C-N 3.29Å; V36-I69 HydrophobicContact CB-CG1 4.31Å; V36-I69 HydrophobicContact CG1-CD1 4.32Å; V36-I69 HydrophobicContact CG1-CG1 4.18Å
37Y91.8Very high95.4Very high180 Ų18052.3 Ų52.371%0.70627%0.271SS*.G310 helixtrans-79.1-12.6175.7-61.5-67.4000113.2P34 H35 S39 R73P34-Y37 WeakPolarHBondContact O-CD2 2.99Å; P34-Y37 PolarHBondContact O-N 2.96Å; H35-Y37 PolarHBondContact O-N 3.37Å; H35-Y37 VanDerWaalsContact O-N 3.1Å; Y37-S39 PolarHBondContact O-N 2.78Å; Y37-R73 PolarHBondContact O-NH1 3.31Å
38N93.3Very high95.2Very high20 Ų2055.1 Ų55.111%0.10729%0.289CS..  trans-72.4109.7176.8-176.13.7000110.6P3 V4 H35 V36 R40 L41P3-N38 VanDerWaalsContact CB-OD1 3.31Å; P3-N38 WeakPolarHBondContact CB-OD1 3.49Å; V4-N38 PolarHBondContact N-ND2 3.2Å; V4-N38 PolarHBondContact O-ND2 3.48Å; H35-N38 WeakPolarHBondContact O-CB 3.36Å; H35-N38 PolarHBondContact O-N 3.13Å; V36-N38 VanDerWaalsContact C-N 3.29Å; N38-R40 PolarHBondContact O-N 3.25Å; N38-R40 VanDerWaalsContact O-N 3.1Å; N38-R40 WeakPolarHBondContact OD1-CB 3.49Å; N38-R40 PolarHBondContact OD1-N 3.09Å; N38-R40 VanDerWaalsContact OD1-N 3.13Å; N38-L41 HydrophobicContact CB-CD1 4.23Å; N38-L41 HydrophobicContact CB-CG 4.17Å; N38-L41 PolarHBondContact O-N 2.94Å
39S92.3Very high95.1Very high71 Ų7154.1 Ų54.150%0.49729%0.288SS..G310 helixtrans-59.8-22.7179.754.50000113.8Y37 L41 A42Y37-S39 PolarHBondContact O-N 2.78Å; S39-L41 PolarHBondContact O-N 3.36Å; S39-A42 WeakPolarHBondContact O-CB 3.36Å; S39-A42 PolarHBondContact O-N 3.5Å
40R94.1Very high95Very high100 Ų10054.1 Ų54.138%0.37729%0.288SS..G310 helixtrans-72-13.9176.8-64.2-170.3-119168.1-2.7113.9P3 T5 N38P3-R40 VanDerWaalsContact C-NH2 3.34Å; P3-R40 PolarHBondContact O-NH1 3.39Å; P3-R40 PolarHBondContact O-NH2 3.08Å; T5-R40 VanDerWaalsContact CG2-NH1 3.29Å; N38-R40 PolarHBondContact O-N 3.25Å; N38-R40 VanDerWaalsContact O-N 3.1Å; N38-R40 WeakPolarHBondContact OD1-CB 3.49Å; N38-R40 PolarHBondContact OD1-N 3.09Å; N38-R40 VanDerWaalsContact OD1-N 3.13Å
41L94.5Very high94.9Very high1 Ų156.1 Ų56.11%0.00530%0.303CS..G310 helixtrans-96.44174.6-56-177.2000112.5L6 Y9 H35 N38 S39 V43 V66 I69L6-L41 HydrophobicContact CB-CD2 4.32Å; L6-L41 HydrophobicContact CD1-CD2 3.74Å; Y9-L41 HydrophobicContact CD1-CD2 4.02Å; Y9-L41 HydrophobicContact CD2-CD1 3.62Å; Y9-L41 HydrophobicContact CD2-CD2 4.13Å; Y9-L41 HydrophobicContact CE2-CD1 3.96Å; Y9-L41 HydrophobicContact CG-CD1 4.05Å; Y9-L41 HydrophobicContact CG-CD2 3.66Å; H35-L41 HydrophobicContact CB-CD1 4.18Å; N38-L41 HydrophobicContact CB-CD1 4.23Å; N38-L41 HydrophobicContact CB-CG 4.17Å; N38-L41 PolarHBondContact O-N 2.94Å; S39-L41 PolarHBondContact O-N 3.36Å; L41-V43 PolarHBondContact O-N 2.83Å; L41-V66 WeakPolarHBondContact O-CG1 3.32Å; L41-I69 HydrophobicContact CB-CD1 4.11Å
42A94.6Very high94.8Very high19 Ų1959.3 Ų59.316%0.15733%0.326CS..  trans-96.975.717900000110.2S39 I69 W70 R73S39-A42 WeakPolarHBondContact O-CB 3.36Å; S39-A42 PolarHBondContact O-N 3.5Å; A42-I69 HydrophobicContact CB-CG2 4.16Å; A42-W70 HydrophobicContact CB-CB 4.25Å; A42-R73 HydrophobicContact CB-CG 4.46Å
43V96.5Very high95Very high40 Ų4060.3 Ų60.324%0.24232%0.321CS..  trans-108.3128.3-178.7179.20000109.8L6 L41 P46 V66L6-V43 HydrophobicContact CD2-CB 4.44Å; L6-V43 HydrophobicContact CD2-CG2 3.7Å; L41-V43 PolarHBondContact O-N 2.83Å; V43-P46 HydrophobicContact CB-CB 4.28Å; V43-P46 HydrophobicContact CG1-CB 4.17Å; V43-V66 HydrophobicContact CB-CG1 3.85Å; V43-V66 HydrophobicContact CG2-CG1 4.43Å
44P95.8Very high95Very high46 Ų4659.2 Ų59.230%0.29932%0.315SS..SBendtrans-67.1-44.4-178.223.5-31.2000112.6P46 R67 W70P44-P46 VanDerWaalsContact C-CD 3.41Å; P44-P46 VanDerWaalsContact O-CD 3.23Å; P44-P46 WeakPolarHBondContact O-CD 3.45Å; P44-R67 WeakPolarHBondContact O-CD 3.42Å; P44-R67 WeakPolarHBondContact O-CG 3.31Å; P44-R67 PolarHBondContact O-NH1 3.47Å; P44-W70 HydrophobicContact CB-CD2 3.92Å; P44-W70 HydrophobicContact CB-CE3 4.45Å; P44-W70 HydrophobicContact CB-CG 4.26Å; P44-W70 HydrophobicContact CB-CZ2 4Å
45D96.6Very high95.1Very high101 Ų10160.2 Ų60.254%0.5432%0.319SS..  trans-122.372.6-175.2-49.1-62.4000109.9E47 R67D45-E47 VanDerWaalsContact C-N 3.29Å; D45-E47 WeakPolarHBondContact CA-OE2 3.44Å; D45-E47 PolarHBondContact O-N 3.45Å; D45-R67 IonicContact OD1-NH1 3.03Å; D45-R67 PolarHBondContact OD1-NH1 3.39Å
46P96Very high95.1Very high2 Ų262 Ų621%0.01334%0.335CS..  trans-81.4-0.2-173.834.7-37.1000114.3V43 P44 N48 I49 A50 S63 V66 R67V43-P46 HydrophobicContact CB-CB 4.28Å; V43-P46 HydrophobicContact CG1-CB 4.17Å; P44-P46 VanDerWaalsContact C-CD 3.41Å; P44-P46 VanDerWaalsContact O-CD 3.23Å; P44-P46 WeakPolarHBondContact O-CD 3.45Å; P46-N48 PolarHBondContact O-N 3.17Å; P46-I49 VanDerWaalsContact O-CG2 3.28Å; P46-I49 WeakPolarHBondContact O-CG2 3.5Å; P46-I49 PolarHBondContact O-N 3.23Å; P46-A50 WeakPolarHBondContact O-CB 3.34Å; P46-A50 PolarHBondContact O-N 2.92Å; P46-S63 WeakPolarHBondContact CG-O 3.35Å; P46-V66 HydrophobicContact CB-CB 3.93Å; P46-V66 HydrophobicContact CB-CG1 3.49Å; P46-V66 VanDerWaalsContact CB-CG1 3.49Å; P46-V66 HydrophobicContact CG-CB 3.98Å; P46-V66 HydrophobicContact CG-CG1 3.89Å; P46-R67 HydrophobicContact CG-CB 4.25Å
47E96.4Very high95.2Very high80 Ų8062.3 Ų62.337%0.37434%0.337SS..Hα-helixtrans-58-50.4-172.7-63.976.8-168.700111.7D45 I49 A50 V51 S63D45-E47 VanDerWaalsContact C-N 3.29Å; D45-E47 WeakPolarHBondContact CA-OE2 3.44Å; D45-E47 PolarHBondContact O-N 3.45Å; E47-I49 VanDerWaalsContact C-N 3.3Å; E47-I49 PolarHBondContact O-N 3.26Å; E47-A50 PolarHBondContact O-N 3.49Å; E47-V51 VanDerWaalsContact O-CG2 3.25Å; E47-V51 WeakPolarHBondContact O-CG2 3.47Å; E47-V51 PolarHBondContact O-N 3.46Å; E47-S63 WeakPolarHBondContact CA-OG 3.36Å
48N94.5Very high95.5Very high145 Ų14555.2 Ų55.278%0.77531%0.309SS*.Hα-helixtrans-61.5-38.2-176.1-68.8-35.5000112.6P46P46-N48 PolarHBondContact O-N 3.17Å
49I94.8Very high95.7Very high46 Ų4655.3 Ų55.324%0.23631%0.309CS..Hα-helixtrans-82.1-32.1178.6-164.8170.4000111.7L6 Q7 L10 P46 E47 S52 Y53L6-I49 HydrophobicContact CD2-CD1 4.03Å; L6-I49 HydrophobicContact CD2-CG2 3.73Å; L6-I49 HydrophobicContact CG-CD1 4.3Å; Q7-I49 HydrophobicContact CG-CD1 4.39Å; L10-I49 HydrophobicContact CD1-CD1 4.41Å; L10-I49 HydrophobicContact CD1-CG1 3.9Å; L10-I49 HydrophobicContact CD1-CG2 4.34Å; P46-I49 VanDerWaalsContact O-CG2 3.28Å; P46-I49 WeakPolarHBondContact O-CG2 3.5Å; P46-I49 PolarHBondContact O-N 3.23Å; E47-I49 VanDerWaalsContact C-N 3.3Å; E47-I49 PolarHBondContact O-N 3.26Å; I49-S52 PolarHBondContact O-N 3.25Å; I49-S52 PolarHBondContact O-OG 2.8Å; I49-Y53 HydrophobicContact CG1-CD2 4.48Å; I49-Y53 HydrophobicContact CG1-CE2 4.16Å; I49-Y53 VanDerWaalsContact O-CD2 3.29Å; I49-Y53 WeakPolarHBondContact O-CD2 3.38Å
50A95.8Very high96Very high2 Ų256 Ų562%0.01730%0.304CS..Hα-helixtrans-64.9-44.3176.500000111.5P46 E47 S52 Y53 L54 D59 S63P46-A50 WeakPolarHBondContact O-CB 3.34Å; P46-A50 PolarHBondContact O-N 2.92Å; E47-A50 PolarHBondContact O-N 3.49Å; A50-S52 PolarHBondContact O-N 3.03Å; A50-Y53 PolarHBondContact O-N 2.79Å; A50-L54 WeakPolarHBondContact O-CB 3.33Å; A50-L54 PolarHBondContact O-N 2.9Å; A50-D59 HydrophobicContact CB-CB 4.43Å; A50-S63 WeakPolarHBondContact CB-OG 3.35Å
51V96.2Very high96.2Very high87 Ų8751.2 Ų51.253%0.52729%0.286SS..Hα-helixtrans-62.1-26.1-179.8174.80000112.3E47 Y53 D59E47-V51 VanDerWaalsContact O-CG2 3.25Å; E47-V51 WeakPolarHBondContact O-CG2 3.47Å; E47-V51 PolarHBondContact O-N 3.46Å; V51-Y53 VanDerWaalsContact C-N 3.26Å; V51-Y53 PolarHBondContact O-N 3.49Å; V51-D59 HydrophobicContact CG2-CB 4.07Å
52S96Very high96.4Very high81 Ų8151.1 Ų51.157%0.56629%0.286SS*.THydrogen-bonded Turntrans-74.5-14.2176.171.30000114I49 A50I49-S52 PolarHBondContact O-N 3.25Å; I49-S52 PolarHBondContact O-OG 2.8Å; A50-S52 PolarHBondContact O-N 3.03Å
53Y96.9Very high96.6Very high79 Ų7950.5 Ų50.531%0.3128%0.281SS..THydrogen-bonded Turntrans-118.8-21.6-179.4-70.6-93.8000113.7Q7 L10 T14 I49 A50 V51Q7-Y53 WeakPolarHBondContact CB-OH 3.31Å; Q7-Y53 HydrophobicContact CG-CE2 4.45Å; Q7-Y53 VanDerWaalsContact CG-OH 3.3Å; Q7-Y53 WeakPolarHBondContact CG-OH 3.45Å; L10-Y53 HydrophobicContact CB-CD1 4.18Å; L10-Y53 HydrophobicContact CB-CD2 4.11Å; L10-Y53 HydrophobicContact CB-CG 3.83Å; L10-Y53 HydrophobicContact CD1-CD2 3.65Å; L10-Y53 HydrophobicContact CD1-CE2 4.12Å; L10-Y53 HydrophobicContact CD1-CG 4.21Å; T14-Y53 PolarHBondContact OG1-O 3.38Å; I49-Y53 HydrophobicContact CG1-CD2 4.48Å; I49-Y53 HydrophobicContact CG1-CE2 4.16Å; I49-Y53 VanDerWaalsContact O-CD2 3.29Å; I49-Y53 WeakPolarHBondContact O-CD2 3.38Å; A50-Y53 PolarHBondContact O-N 2.79Å; V51-Y53 VanDerWaalsContact C-N 3.26Å; V51-Y53 PolarHBondContact O-N 3.49Å
54L97.2Very high96.7Very high10 Ų1049 Ų495%0.05227%0.273CS..  trans-132.6149.4-168.8-62.7165.8000110.5L10 V13 T14 I17 A50 W58 D59 V62L10-L54 HydrophobicContact CD2-CD1 3.99Å; V13-L54 HydrophobicContact CG1-CD1 4.39Å; V13-L54 HydrophobicContact CG1-CD2 4.16Å; T14-L54 WeakPolarHBondContact OG1-CD2 3.33Å; I17-L54 HydrophobicContact CD1-CD2 3.51Å; A50-L54 WeakPolarHBondContact O-CB 3.33Å; A50-L54 PolarHBondContact O-N 2.9Å; L54-W58 HydrophobicContact CB-CB 4.39Å; L54-W58 HydrophobicContact CD2-CB 4.36Å; L54-D59 HydrophobicContact CB-CB 4.02Å; L54-V62 HydrophobicContact CD1-CB 3.59Å; L54-V62 HydrophobicContact CD1-CG1 3.83Å; L54-V62 HydrophobicContact CD1-CG2 3.58Å
55V94.9Very high96.9Very high116 Ų11646.9 Ų46.970%0.70326%0.258SS*.  trans-107.6147.4177.5-171.70000109.1W58V55-W58 WeakPolarHBondContact O-CB 3.4Å; V55-W58 PolarHBondContact O-N 3.33Å
56S95.5Very high96.9Very high66 Ų6642.1 Ų42.146%0.46223%0.233SC..THydrogen-bonded Turntrans-47.3132.9170.6161.60000112.7D59S56-D59 WeakPolarHBondContact CA-OD1 3.38Å; S56-D59 PolarHBondContact N-OD1 2.93Å
57P96.3Very high97.1Very high16 Ų1645 Ų4510%0.10424%0.244CC..THydrogen-bonded Turncis-93.68.5837.1-36.1000114.9I61 T90 A94P57-I61 WeakPolarHBondContact O-CG1 3.35Å; P57-I61 PolarHBondContact O-N 3.23Å; P57-T90 HydrophobicContact CB-CG2 3.66Å; P57-A94 HydrophobicContact CG-CB 3.71Å
58W97.5Very high97.2Very high32 Ų3241.2 Ų41.212%0.12123%0.226CC..Hα-helixtrans-77.7-31.5-171.7-64.5108.9000114.1I17 L25 L54 V55 I61 V62 W103 I104I17-W58 HydrophobicContact CD1-CB 3.75Å; I17-W58 HydrophobicContact CD1-CD2 3.76Å; I17-W58 HydrophobicContact CD1-CE3 4.04Å; I17-W58 HydrophobicContact CD1-CG 3.64Å; I17-W58 HydrophobicContact CG1-CD2 4Å; I17-W58 HydrophobicContact CG1-CE3 4.24Å; I17-W58 HydrophobicContact CG1-CG 4.27Å; I17-W58 HydrophobicContact CG2-CD2 4.35Å; I17-W58 HydrophobicContact CG2-CG 4.25Å; L25-W58 HydrophobicContact CD2-CE3 4.17Å; L25-W58 HydrophobicContact CD2-CH2 3.79Å; L25-W58 HydrophobicContact CD2-CZ3 3.55Å; L54-W58 HydrophobicContact CB-CB 4.39Å; L54-W58 HydrophobicContact CD2-CB 4.36Å; V55-W58 WeakPolarHBondContact O-CB 3.4Å; V55-W58 PolarHBondContact O-N 3.33Å; W58-I61 HydrophobicContact CD2-CD1 4.46Å; W58-I61 HydrophobicContact CE3-CD1 3.76Å; W58-I61 HydrophobicContact CE3-CG2 4.5Å; W58-I61 HydrophobicContact CZ3-CD1 3.94Å; W58-I61 PolarHBondContact O-N 3.4Å; W58-V62 WeakPolarHBondContact O-CB 3.43Å; W58-V62 VanDerWaalsContact O-CG2 3.25Å; W58-V62 WeakPolarHBondContact O-CG2 3.38Å; W58-V62 PolarHBondContact O-N 3.22Å; W58-W103 AromaticContact CH2-CH2 3.61Å; W58-W103 HydrophobicContact CH2-CH2 3.61Å; W58-W103 HydrophobicContact CH2-CZ2 4.19Å; W58-W103 HydrophobicContact CH2-CZ3 4.31Å; W58-W103 AromaticContact CZ2-CH2 3.37Å; W58-W103 HydrophobicContact CZ2-CH2 3.37Å; W58-W103 AromaticContact CZ2-CZ2 3.61Å; W58-W103 HydrophobicContact CZ2-CZ2 3.61Å; W58-W103 HydrophobicContact CZ2-CZ3 4.46Å; W58-I104 HydrophobicContact CH2-CD1 3.57Å; W58-I104 HydrophobicContact CH2-CG1 3.95Å; W58-I104 HydrophobicContact CZ2-CD1 4.09Å; W58-I104 HydrophobicContact CZ3-CD1 4.46Å
59D97.9Very high97.3Very high21 Ų2134.3 Ų34.311%0.11219%0.189CC..Hα-helixtrans-55.6-51.2169.556.4-14.3000110.7A50 V51 L54 S56 I61 V62 S63A50-D59 HydrophobicContact CB-CB 4.43Å; V51-D59 HydrophobicContact CG2-CB 4.07Å; L54-D59 HydrophobicContact CB-CB 4.02Å; S56-D59 WeakPolarHBondContact CA-OD1 3.38Å; S56-D59 PolarHBondContact N-OD1 2.93Å; D59-I61 PolarHBondContact O-N 2.94Å; D59-V62 PolarHBondContact O-N 3.31Å; D59-S63 VanDerWaalsContact O-CB 3.26Å; D59-S63 WeakPolarHBondContact O-CB 3.41Å; D59-S63 PolarHBondContact O-N 2.77Å; D59-S63 PolarHBondContact O-OG 3.37Å
60E98.3Very high97.5Very high85 Ų8535.7 Ų35.740%0.39719%0.192SC..Hα-helixtrans-60.2-45177.4-69.7-179.5-164.600112.4V62 A64 T90E60-V62 PolarHBondContact O-N 3.46Å; E60-A64 VanDerWaalsContact O-CB 3.3Å; E60-A64 WeakPolarHBondContact O-CB 3.11Å; E60-A64 PolarHBondContact O-N 2.98Å; E60-T90 HydrophobicContact CB-CG2 4.02Å; E60-T90 WeakPolarHBondContact OE2-CG2 3.36Å; E60-T90 PolarHBondContact OE2-OG1 3.35Å
61I98.7Very high97.6Very high0 Ų035.6 Ų35.60%019%0.191CC..Hα-helixtrans-60.2-47.1179-71.9167.2000110.6L29 P57 W58 D59 H65 L87 T90 V91L29-I61 HydrophobicContact CD1-CG2 3.84Å; L29-I61 HydrophobicContact CD2-CG2 4.14Å; P57-I61 WeakPolarHBondContact O-CG1 3.35Å; P57-I61 PolarHBondContact O-N 3.23Å; W58-I61 HydrophobicContact CD2-CD1 4.46Å; W58-I61 HydrophobicContact CE3-CD1 3.76Å; W58-I61 HydrophobicContact CE3-CG2 4.5Å; W58-I61 HydrophobicContact CZ3-CD1 3.94Å; W58-I61 PolarHBondContact O-N 3.4Å; D59-I61 PolarHBondContact O-N 2.94Å; I61-H65 PolarHBondContact O-N 2.84Å; I61-H65 VanDerWaalsContact O-N 3.08Å; I61-L87 HydrophobicContact CG2-CD1 4.46Å; I61-L87 HydrophobicContact CG2-CG 4.14Å; I61-T90 HydrophobicContact CD1-CG2 4.09Å; I61-T90 HydrophobicContact CG1-CG2 3.61Å; I61-V91 HydrophobicContact CD1-CG2 3.76Å; I61-V91 HydrophobicContact CG1-CG2 4.06Å; I61-V91 HydrophobicContact CG2-CG2 4.34Å
62V98.5Very high97.7Very high0 Ų033.9 Ų33.90%018%0.177CC..Hα-helixtrans-75.6-37.7-176.1175.40000111Y9 L10 V13 L29 L54 W58 D59 E60 H65 V66Y9-V62 HydrophobicContact CE1-CG1 4.09Å; L10-V62 HydrophobicContact CD2-CG1 3.61Å; V13-V62 HydrophobicContact CG1-CG2 3.75Å; L29-V62 HydrophobicContact CD2-CG2 4.17Å; L54-V62 HydrophobicContact CD1-CB 3.59Å; L54-V62 HydrophobicContact CD1-CG1 3.83Å; L54-V62 HydrophobicContact CD1-CG2 3.58Å; W58-V62 WeakPolarHBondContact O-CB 3.43Å; W58-V62 VanDerWaalsContact O-CG2 3.25Å; W58-V62 WeakPolarHBondContact O-CG2 3.38Å; W58-V62 PolarHBondContact O-N 3.22Å; D59-V62 PolarHBondContact O-N 3.31Å; E60-V62 PolarHBondContact O-N 3.46Å; V62-H65 PolarHBondContact O-N 3.13Å; V62-V66 HydrophobicContact CG1-CG2 4.19Å; V62-V66 WeakPolarHBondContact O-CB 3.46Å; V62-V66 VanDerWaalsContact O-CG2 3.3Å; V62-V66 WeakPolarHBondContact O-CG2 3.42Å; V62-V66 PolarHBondContact O-N 2.88Å
63S98.6Very high97.7Very high6 Ų636.2 Ų36.24%0.04217%0.174CC..Hα-helixtrans-58.6-47.6171.6-71.40000111.5P46 E47 A50 D59 H65 V66 R67P46-S63 WeakPolarHBondContact CG-O 3.35Å; E47-S63 WeakPolarHBondContact CA-OG 3.36Å; A50-S63 WeakPolarHBondContact CB-OG 3.35Å; D59-S63 VanDerWaalsContact O-CB 3.26Å; D59-S63 WeakPolarHBondContact O-CB 3.41Å; D59-S63 PolarHBondContact O-N 2.77Å; D59-S63 PolarHBondContact O-OG 3.37Å; S63-H65 VanDerWaalsContact C-N 3.3Å; S63-H65 PolarHBondContact O-N 3.44Å; S63-V66 PolarHBondContact O-N 3.21Å; S63-R67 WeakPolarHBondContact O-CB 3.45Å; S63-R67 PolarHBondContact O-N 2.93Å
64A98.7Very high97.6Very high9 Ų936.9 Ų36.97%0.07418%0.183CC..Hα-helixtrans-59.5-41.1175.700000111.9E60 C68 C83 V86 L87E60-A64 VanDerWaalsContact O-CB 3.3Å; E60-A64 WeakPolarHBondContact O-CB 3.11Å; E60-A64 PolarHBondContact O-N 2.98Å; A64-C68 WeakPolarHBondContact O-CB 3.03Å; A64-C68 PolarHBondContact O-N 3.07Å; A64-C83 WeakPolarHBondContact O-CB 3.48Å; A64-V86 HydrophobicContact CB-CB 4.35Å; A64-V86 HydrophobicContact CB-CG1 4.2Å; A64-L87 HydrophobicContact CB-CB 4.04Å
65H98.6Very high97.5Very high0 Ų046.2 Ų46.20%022%0.217CC..Hα-helixtrans-65.9-46.1177-175.365.2000113.1Y9 Y28 L29 H35 I61 V62 S63 R67 C68 I69 L87Y9-H65 PolarHBondContact OH-CD2 3.27Å; Y9-H65 VanDerWaalsContact OH-CD2 3.26Å; Y28-H65 PolarHBondContact O-CD2 2.93Å; Y28-H65 PolarHBondContact O-NE2 2.93Å; L29-H65 VanDerWaalsContact C-CE1 3.4Å; L29-H65 HydrophobicContact CD2-CB 3.89Å; L29-H65 PolarHBondContact O-CE1 3.23Å; L29-H65 VanDerWaalsContact O-CE1 3.26Å; L29-H65 PolarHBondContact O-ND1 3.38Å; H35-H65 AromaticContact CE1-NE2 3.7Å; H35-H65 AromaticContact NE2-CD2 3.97Å; H35-H65 AromaticContact NE2-CE1 3.78Å; H35-H65 AromaticContact NE2-NE2 2.92Å; H35-H65 PolarHBondContact NE2-NE2 3.35Å; I61-H65 PolarHBondContact O-N 2.84Å; I61-H65 VanDerWaalsContact O-N 3.08Å; V62-H65 PolarHBondContact O-N 3.13Å; S63-H65 VanDerWaalsContact C-N 3.3Å; S63-H65 PolarHBondContact O-N 3.44Å; H65-R67 PolarHBondContact O-N 2.91Å; H65-C68 WeakPolarHBondContact O-CA 3.42Å; H65-C68 VanDerWaalsContact O-CB 3.27Å; H65-C68 WeakPolarHBondContact O-CB 3.28Å; H65-C68 PolarHBondContact O-N 2.63Å; H65-C68 VanDerWaalsContact O-N 3.16Å; H65-I69 WeakPolarHBondContact O-CG1 3.31Å; H65-I69 PolarHBondContact O-N 2.91Å; H65-L87 HydrophobicContact CB-CD1 3.84Å
66V98.4Very high97.6Very high2 Ų244.2 Ų44.21%0.01220%0.203CC..Hα-helixtrans-64.2-41.3179.2169.70000111L6 Y9 L41 V43 P46 V62 S63 C68 I69 W70L6-V66 HydrophobicContact CD1-CG1 4.46Å; L6-V66 HydrophobicContact CD1-CG2 4.23Å; Y9-V66 HydrophobicContact CE1-CG2 4.23Å; L41-V66 WeakPolarHBondContact O-CG1 3.32Å; V43-V66 HydrophobicContact CB-CG1 3.85Å; V43-V66 HydrophobicContact CG2-CG1 4.43Å; P46-V66 HydrophobicContact CB-CB 3.93Å; P46-V66 HydrophobicContact CB-CG1 3.49Å; P46-V66 VanDerWaalsContact CB-CG1 3.49Å; P46-V66 HydrophobicContact CG-CB 3.98Å; P46-V66 HydrophobicContact CG-CG1 3.89Å; V62-V66 HydrophobicContact CG1-CG2 4.19Å; V62-V66 WeakPolarHBondContact O-CB 3.46Å; V62-V66 VanDerWaalsContact O-CG2 3.3Å; V62-V66 WeakPolarHBondContact O-CG2 3.42Å; V62-V66 PolarHBondContact O-N 2.88Å; S63-V66 PolarHBondContact O-N 3.21Å; V66-C68 VanDerWaalsContact C-N 3.35Å; V66-I69 WeakPolarHBondContact O-CB 3.39Å; V66-I69 PolarHBondContact O-N 3.45Å; V66-W70 PolarHBondContact O-N 2.83Å; V66-W70 VanDerWaalsContact O-N 3.12Å
67R98.5Very high97.6Very high62 Ų6244.5 Ų44.523%0.23420%0.196CC..Hα-helixtrans-65.9-37.3172.9-172.5175.7176.2104.5-2.6111.9P44 D45 P46 S63 H65 I69 W70 A71 E79P44-R67 WeakPolarHBondContact O-CD 3.42Å; P44-R67 WeakPolarHBondContact O-CG 3.31Å; P44-R67 PolarHBondContact O-NH1 3.47Å; D45-R67 IonicContact OD1-NH1 3.03Å; D45-R67 PolarHBondContact OD1-NH1 3.39Å; P46-R67 HydrophobicContact CG-CB 4.25Å; S63-R67 WeakPolarHBondContact O-CB 3.45Å; S63-R67 PolarHBondContact O-N 2.93Å; H65-R67 PolarHBondContact O-N 2.91Å; R67-I69 VanDerWaalsContact C-N 3.34Å; R67-I69 PolarHBondContact O-N 2.74Å; R67-W70 WeakPolarHBondContact O-CB 3.35Å; R67-W70 PolarHBondContact O-N 3Å; R67-A71 WeakPolarHBondContact O-CB 3.47Å; R67-A71 PolarHBondContact O-N 3.37Å; R67-E79 IonicContact CZ-OE1 3.03Å; R67-E79 VanDerWaalsContact CZ-OE1 3.28Å; R67-E79 IonicContact NE-OE1 2.71Å; R67-E79 PolarHBondContact NE-OE1 3Å; R67-E79 IonicContact NH2-OE1 3.3Å; R67-E79 PolarHBondContact NH2-OE1 3.13Å
68C98.6Very high97.6Very high0 Ų047.5 Ų47.50%021%0.208CC..Hα-helixtrans-59.2-43.5172.3-177.10000111.5A64 H65 V66 W70 A71 M72 A80 C83 F118A64-C68 WeakPolarHBondContact O-CB 3.03Å; A64-C68 PolarHBondContact O-N 3.07Å; H65-C68 WeakPolarHBondContact O-CA 3.42Å; H65-C68 VanDerWaalsContact O-CB 3.27Å; H65-C68 WeakPolarHBondContact O-CB 3.28Å; H65-C68 PolarHBondContact O-N 2.63Å; H65-C68 VanDerWaalsContact O-N 3.16Å; V66-C68 VanDerWaalsContact C-N 3.35Å; C68-W70 VanDerWaalsContact C-N 3.34Å; C68-W70 PolarHBondContact O-N 3.26Å; C68-A71 PolarHBondContact O-N 2.89Å; C68-M72 WeakPolarHBondContact O-CB 3.48Å; C68-M72 VanDerWaalsContact O-CG 3.23Å; C68-M72 WeakPolarHBondContact O-CG 3.34Å; C68-M72 PolarHBondContact O-N 3.37Å; C68-A80 PolarHBondContact SG-O 2.81Å; C68-C83 HydrophobicContact CB-CB 3.72Å; C68-F118 VanDerWaalsContact SG-CZ 3.53Å
69I98.2Very high97.6Very high1 Ų148.2 Ų48.21%0.00521%0.213CC..Hα-helixtrans-59.9-44.4175-65.6168.4000110.8V36 L41 A42 H65 V66 R67 M72 R73V36-I69 HydrophobicContact CB-CG1 4.31Å; V36-I69 HydrophobicContact CG1-CD1 4.32Å; V36-I69 HydrophobicContact CG1-CG1 4.18Å; L41-I69 HydrophobicContact CB-CD1 4.11Å; A42-I69 HydrophobicContact CB-CG2 4.16Å; H65-I69 WeakPolarHBondContact O-CG1 3.31Å; H65-I69 PolarHBondContact O-N 2.91Å; V66-I69 WeakPolarHBondContact O-CB 3.39Å; V66-I69 PolarHBondContact O-N 3.45Å; R67-I69 VanDerWaalsContact C-N 3.34Å; R67-I69 PolarHBondContact O-N 2.74Å; I69-M72 PolarHBondContact O-N 3.42Å; I69-R73 WeakPolarHBondContact O-CG 3.45Å; I69-R73 PolarHBondContact O-N 3.27Å; I69-R73 VanDerWaalsContact O-N 3.13Å
70W98.4Very high97.6Very high75 Ų7547.2 Ų47.228%0.28421%0.208SC..Hα-helixtrans-59-49.2175.3175.287.8000112.2A42 P44 V66 R67 C68 M72 R73 N74A42-W70 HydrophobicContact CB-CB 4.25Å; P44-W70 HydrophobicContact CB-CD2 3.92Å; P44-W70 HydrophobicContact CB-CE3 4.45Å; P44-W70 HydrophobicContact CB-CG 4.26Å; P44-W70 HydrophobicContact CB-CZ2 4Å; V66-W70 PolarHBondContact O-N 2.83Å; V66-W70 VanDerWaalsContact O-N 3.12Å; R67-W70 WeakPolarHBondContact O-CB 3.35Å; R67-W70 PolarHBondContact O-N 3Å; C68-W70 VanDerWaalsContact C-N 3.34Å; C68-W70 PolarHBondContact O-N 3.26Å; W70-M72 PolarHBondContact O-N 3.08Å; W70-R73 PolarHBondContact O-N 3.06Å; W70-N74 WeakPolarHBondContact CZ2-ND2 3.41Å; W70-N74 PolarHBondContact NE1-ND2 2.78Å; W70-N74 PolarHBondContact O-N 2.98Å; W70-N74 VanDerWaalsContact O-N 3.12Å
71A98.4Very high97.6Very high0 Ų043.8 Ų43.80%019%0.191CC..Hα-helixtrans-60.8-44.2179.200000112.1R67 C68 R73 N74 R75 D76 E79 A80R67-A71 WeakPolarHBondContact O-CB 3.47Å; R67-A71 PolarHBondContact O-N 3.37Å; C68-A71 PolarHBondContact O-N 2.89Å; A71-R73 VanDerWaalsContact C-N 3.31Å; A71-R73 PolarHBondContact O-N 2.93Å; A71-N74 CarbonylContact O-C 3.53Å; A71-N74 PolarHBondContact O-N 2.85Å; A71-R75 PolarHBondContact O-N 2.67Å; A71-R75 VanDerWaalsContact O-N 3.12Å; A71-D76 PolarHBondContact O-N 2.86Å; A71-E79 HydrophobicContact CB-CB 3.88Å; A71-E79 HydrophobicContact CB-CG 3.78Å; A71-A80 HydrophobicContact CB-CB 3.97Å
72M97.3Very high97.6Very high50 Ų5045.7 Ų45.725%0.24621%0.207CC..Hα-helixtrans-57.5-41.7175.3-73.7171.966.500112.4C31 C68 I69 W70 R75 A80 F118C31-M72 HydrophobicContact CB-SD 4.3Å; C68-M72 WeakPolarHBondContact O-CB 3.48Å; C68-M72 VanDerWaalsContact O-CG 3.23Å; C68-M72 WeakPolarHBondContact O-CG 3.34Å; C68-M72 PolarHBondContact O-N 3.37Å; I69-M72 PolarHBondContact O-N 3.42Å; W70-M72 PolarHBondContact O-N 3.08Å; M72-R75 PolarHBondContact O-N 2.82Å; M72-R75 VanDerWaalsContact O-N 3.14Å; M72-A80 HydrophobicContact CG-CB 3.86Å; M72-F118 HydrophobicContact CG-CE1 4.04Å; M72-F118 HydrophobicContact CG-CZ 4.11Å; M72-F118 HydrophobicContact SD-CE1 4.14Å; M72-F118 HydrophobicContact SD-CZ 3.71Å
73R95.3Very high97.6Very high130 Ų13046 Ų4649%0.49121%0.21SC..Hα-helixtrans-67.4-36.7178.5-73.6-17870.684.34.7112.6Y37 A42 I69 W70 A71 R75Y37-R73 PolarHBondContact O-NH1 3.31Å; A42-R73 HydrophobicContact CB-CG 4.46Å; I69-R73 WeakPolarHBondContact O-CG 3.45Å; I69-R73 PolarHBondContact O-N 3.27Å; I69-R73 VanDerWaalsContact O-N 3.13Å; W70-R73 PolarHBondContact O-N 3.06Å; A71-R73 VanDerWaalsContact C-N 3.31Å; A71-R73 PolarHBondContact O-N 2.93Å; R73-R75 PolarHBondContact O-N 3.35Å
74N96.3Very high97.6Very high94 Ų9445.8 Ų45.850%0.50321%0.208SC..THydrogen-bonded Turntrans-78.52.7175-65.7-25.3000113.1W70 A71 D76W70-N74 WeakPolarHBondContact CZ2-ND2 3.41Å; W70-N74 PolarHBondContact NE1-ND2 2.78Å; W70-N74 PolarHBondContact O-N 2.98Å; W70-N74 VanDerWaalsContact O-N 3.12Å; A71-N74 CarbonylContact O-C 3.53Å; A71-N74 PolarHBondContact O-N 2.85Å; N74-D76 PolarHBondContact O-N 3.41Å
75R95.2Very high97.6Very high205 Ų20546.4 Ų46.477%0.77421%0.21SC*.THydrogen-bonded Turntrans6019.8-175.9-54.5-178.4172.8-168.7-1.6113.4A71 M72 R73 F77A71-R75 PolarHBondContact O-N 2.67Å; A71-R75 VanDerWaalsContact O-N 3.12Å; M72-R75 PolarHBondContact O-N 2.82Å; M72-R75 VanDerWaalsContact O-N 3.14Å; R73-R75 PolarHBondContact O-N 3.35Å; R75-F77 VanDerWaalsContact C-N 3.35Å; R75-F77 HydrophobicContact CB-CE2 4.05Å; R75-F77 VanDerWaalsContact O-CD2 3.24Å; R75-F77 WeakPolarHBondContact O-CD2 3.43Å; R75-F77 PolarHBondContact O-N 3.11Å; R75-F77 VanDerWaalsContact O-N 3.15Å
76D96.5Very high97.6Very high74 Ų7450 Ų5040%0.39623%0.231SC..  trans-85.681.1171.3-166.5-18.9000109.3A71 N74 E78 E79 A80A71-D76 PolarHBondContact O-N 2.86Å; N74-D76 PolarHBondContact O-N 3.41Å; D76-E78 VanDerWaalsContact C-N 3.27Å; D76-E78 PolarHBondContact O-N 2.95Å; D76-E78 PolarHBondContact OD1-N 2.94Å; D76-E79 HydrophobicContact CB-CB 4.17Å; D76-E79 VanDerWaalsContact CG-CB 3.5Å; D76-E79 PolarHBondContact O-N 3.11Å; D76-E79 PolarHBondContact OD1-N 2.66Å; D76-A80 PolarHBondContact O-N 3.43Å
77F95.5Very high97.6Very high72 Ų7250 Ų5032%0.31623%0.231SC..Hα-helixtrans-74.1-19-177.6-63.6-73.9000113R75 Y81 L122 K125R75-F77 VanDerWaalsContact C-N 3.35Å; R75-F77 HydrophobicContact CB-CE2 4.05Å; R75-F77 VanDerWaalsContact O-CD2 3.24Å; R75-F77 WeakPolarHBondContact O-CD2 3.43Å; R75-F77 PolarHBondContact O-N 3.11Å; R75-F77 VanDerWaalsContact O-N 3.15Å; F77-Y81 VanDerWaalsContact O-CB 3.32Å; F77-Y81 WeakPolarHBondContact O-CB 3.44Å; F77-Y81 PolarHBondContact O-N 3.32Å; F77-L122 HydrophobicContact CB-CD2 3.67Å; F77-L122 HydrophobicContact CB-CG 4.47Å; F77-K125 VanDerWaalsContact CD2-NZ 3.3Å
78E95.2Very high97.6Very high79 Ų7947.1 Ų47.137%0.36922%0.22SC..Hα-helixtrans-71.1-45.5173.1-67.9-65.1163.800109.9D76 Y81 A82 L122 R139D76-E78 VanDerWaalsContact C-N 3.27Å; D76-E78 PolarHBondContact O-N 2.95Å; D76-E78 PolarHBondContact OD1-N 2.94Å; E78-Y81 WeakPolarHBondContact O-CB 3.19Å; E78-Y81 PolarHBondContact O-N 3.32Å; E78-A82 WeakPolarHBondContact O-CB 3.47Å; E78-A82 PolarHBondContact O-N 3.2Å; E78-L122 HydrophobicContact CG-CD2 4.36Å; E78-L122 WeakPolarHBondContact OE1-CD2 3.42Å; E78-R139 IonicContact OE1-CZ 2.61Å; E78-R139 IonicContact OE1-NE 2.66Å; E78-R139 PolarHBondContact OE1-NE 3.16Å; E78-R139 IonicContact OE1-NH2 2.84Å; E78-R139 PolarHBondContact OE1-NH2 3.28Å; E78-R139 IonicContact OE2-CZ 2.6Å; E78-R139 IonicContact OE2-NE 3.49Å; E78-R139 PolarHBondContact OE2-NE 3.33Å; E78-R139 IonicContact OE2-NH2 2.59Å; E78-R139 PolarHBondContact OE2-NH2 2.99Å; E78-R139 VanDerWaalsContact OE2-NH2 3.14Å
79E97.9Very high97.6Very high48 Ų4852.8 Ų52.822%0.22425%0.245CC..Hα-helixtrans-64.8-40.5175-178.164.5-177.300111.5R67 A71 D76 Y81 A82 C83R67-E79 IonicContact CZ-OE1 3.03Å; R67-E79 VanDerWaalsContact CZ-OE1 3.28Å; R67-E79 IonicContact NE-OE1 2.71Å; R67-E79 PolarHBondContact NE-OE1 3Å; R67-E79 IonicContact NH2-OE1 3.3Å; R67-E79 PolarHBondContact NH2-OE1 3.13Å; A71-E79 HydrophobicContact CB-CB 3.88Å; A71-E79 HydrophobicContact CB-CG 3.78Å; D76-E79 HydrophobicContact CB-CB 4.17Å; D76-E79 VanDerWaalsContact CG-CB 3.5Å; D76-E79 PolarHBondContact O-N 3.11Å; D76-E79 PolarHBondContact OD1-N 2.66Å; E79-Y81 VanDerWaalsContact C-N 3.3Å; E79-Y81 PolarHBondContact O-N 2.72Å; E79-A82 PolarHBondContact O-N 2.97Å; E79-C83 WeakPolarHBondContact O-CB 3.4Å; E79-C83 PolarHBondContact O-N 3.28Å; E79-C83 PolarHBondContact O-SG 3.28Å
80A98.3Very high97.7Very high0 Ų053.3 Ų53.30%025%0.249CC..Hα-helixtrans-59.4-41.9174.100000111.9C68 A71 M72 D76 C83 Q84 F118C68-A80 PolarHBondContact SG-O 2.81Å; A71-A80 HydrophobicContact CB-CB 3.97Å; M72-A80 HydrophobicContact CG-CB 3.86Å; D76-A80 PolarHBondContact O-N 3.43Å; A80-C83 PolarHBondContact O-N 3.39Å; A80-Q84 WeakPolarHBondContact O-CB 3.33Å; A80-Q84 PolarHBondContact O-N 3.24Å; A80-F118 HydrophobicContact CB-CD1 4.31Å; A80-F118 HydrophobicContact CB-CE1 3.79Å; A80-F118 HydrophobicContact CB-CZ 4.12Å
81Y98.2Very high97.7Very high12 Ų1249.8 Ų49.85%0.04724%0.235CC..Hα-helixtrans-66.1-41.5175175.2-116.8000112.5F77 E78 E79 Q84 I85 L115 F118 A119 L122 R139 N142F77-Y81 VanDerWaalsContact O-CB 3.32Å; F77-Y81 WeakPolarHBondContact O-CB 3.44Å; F77-Y81 PolarHBondContact O-N 3.32Å; E78-Y81 WeakPolarHBondContact O-CB 3.19Å; E78-Y81 PolarHBondContact O-N 3.32Å; E79-Y81 VanDerWaalsContact C-N 3.3Å; E79-Y81 PolarHBondContact O-N 2.72Å; Y81-Q84 PolarHBondContact O-N 3.07Å; Y81-I85 HydrophobicContact CD1-CD1 3.88Å; Y81-I85 HydrophobicContact CD2-CD1 4.48Å; Y81-I85 HydrophobicContact CE1-CD1 3.41Å; Y81-I85 VanDerWaalsContact CE1-CD1 3.41Å; Y81-I85 HydrophobicContact CE1-CG1 4.36Å; Y81-I85 HydrophobicContact CE2-CD1 4.11Å; Y81-I85 HydrophobicContact CE2-CG1 4.18Å; Y81-I85 HydrophobicContact CG-CD1 4.39Å; Y81-I85 WeakPolarHBondContact O-CG1 3.28Å; Y81-I85 PolarHBondContact O-N 2.93Å; Y81-L115 HydrophobicContact CD2-CD1 4.04Å; Y81-L115 HydrophobicContact CE2-CD1 3.6Å; Y81-F118 HydrophobicContact CD2-CB 3.73Å; Y81-F118 HydrophobicContact CG-CB 4.35Å; Y81-A119 HydrophobicContact CE2-CB 3.89Å; Y81-L122 VanDerWaalsContact CB-CD1 3.47Å; Y81-L122 HydrophobicContact CD1-CD1 3.92Å; Y81-L122 HydrophobicContact CD2-CD1 4.48Å; Y81-L122 HydrophobicContact CG-CD1 3.72Å; Y81-R139 HydrophobicContact CD1-CG 4.44Å; Y81-R139 HydrophobicContact CE1-CB 4Å; Y81-R139 HydrophobicContact CE1-CG 3.79Å; Y81-R139 PolarHBondContact OH-O 3.23Å; Y81-N142 PolarHBondContact OH-ND2 3.05Å
82A98.5Very high97.7Very high41 Ų4150.2 Ų50.234%0.33924%0.239SC..Hα-helixtrans-61.5-44.6175.700000111.5E78 E79 Q84 I85 V86E78-A82 WeakPolarHBondContact O-CB 3.47Å; E78-A82 PolarHBondContact O-N 3.2Å; E79-A82 PolarHBondContact O-N 2.97Å; A82-Q84 VanDerWaalsContact C-N 3.34Å; A82-Q84 PolarHBondContact O-N 2.73Å; A82-I85 WeakPolarHBondContact O-CB 3.43Å; A82-I85 PolarHBondContact O-N 3.22Å; A82-V86 PolarHBondContact O-N 3.17Å; A82-V86 VanDerWaalsContact O-N 3.09Å
83C98.7Very high97.7Very high7 Ų752.6 Ų52.65%0.04725%0.248CC..Hα-helixtrans-58.6-45.4173.1-680000111.4A64 C68 E79 A80 I85 V86 L87A64-C83 WeakPolarHBondContact O-CB 3.48Å; C68-C83 HydrophobicContact CB-CB 3.72Å; E79-C83 WeakPolarHBondContact O-CB 3.4Å; E79-C83 PolarHBondContact O-N 3.28Å; E79-C83 PolarHBondContact O-SG 3.28Å; A80-C83 PolarHBondContact O-N 3.39Å; C83-I85 VanDerWaalsContact C-N 3.3Å; C83-I85 PolarHBondContact O-N 2.99Å; C83-V86 WeakPolarHBondContact O-CB 3.38Å; C83-V86 PolarHBondContact O-N 3.19Å; C83-V86 VanDerWaalsContact O-N 3.16Å; C83-L87 PolarHBondContact O-N 2.96Å
84Q98.7Very high97.8Very high0 Ų046.8 Ų46.80%023%0.228CC..Hα-helixtrans-65.7-31.7177.9-167.864.616.400112.9A80 Y81 A82 L87 V88 A111 L115 F118A80-Q84 WeakPolarHBondContact O-CB 3.33Å; A80-Q84 PolarHBondContact O-N 3.24Å; Y81-Q84 PolarHBondContact O-N 3.07Å; A82-Q84 VanDerWaalsContact C-N 3.34Å; A82-Q84 PolarHBondContact O-N 2.73Å; Q84-L87 PolarHBondContact O-N 2.91Å; Q84-V88 WeakPolarHBondContact O-CB 3.42Å; Q84-V88 WeakPolarHBondContact O-CG2 3.4Å; Q84-V88 PolarHBondContact O-N 2.99Å; Q84-A111 PolarHBondContact NE2-O 3.19Å; Q84-A111 VanDerWaalsContact NE2-O 3.07Å; Q84-L115 HydrophobicContact CB-CD1 4.47Å; Q84-L115 HydrophobicContact CG-CB 3.9Å; Q84-L115 HydrophobicContact CG-CD1 4.18Å; Q84-F118 HydrophobicContact CB-CD2 3.8Å; Q84-F118 HydrophobicContact CB-CE2 4.02Å; Q84-F118 HydrophobicContact CG-CD2 3.89Å; Q84-F118 HydrophobicContact CG-CE2 4.15Å
85I98.8Very high97.8Very high23 Ų2342.3 Ų42.312%0.11820%0.204CC..Hα-helixtrans-62.5-46.7171.8-74.2164.7000110.5Y81 A82 C83 V88 K89 L115 L146Y81-I85 HydrophobicContact CD1-CD1 3.88Å; Y81-I85 HydrophobicContact CD2-CD1 4.48Å; Y81-I85 HydrophobicContact CE1-CD1 3.41Å; Y81-I85 VanDerWaalsContact CE1-CD1 3.41Å; Y81-I85 HydrophobicContact CE1-CG1 4.36Å; Y81-I85 HydrophobicContact CE2-CD1 4.11Å; Y81-I85 HydrophobicContact CE2-CG1 4.18Å; Y81-I85 HydrophobicContact CG-CD1 4.39Å; Y81-I85 WeakPolarHBondContact O-CG1 3.28Å; Y81-I85 PolarHBondContact O-N 2.93Å; A82-I85 WeakPolarHBondContact O-CB 3.43Å; A82-I85 PolarHBondContact O-N 3.22Å; C83-I85 VanDerWaalsContact C-N 3.3Å; C83-I85 PolarHBondContact O-N 2.99Å; I85-V88 PolarHBondContact O-N 3.27Å; I85-K89 HydrophobicContact CG2-CD 4.01Å; I85-K89 HydrophobicContact CG2-CG 4.46Å; I85-K89 WeakPolarHBondContact O-CB 3.36Å; I85-K89 WeakPolarHBondContact O-CG 3.27Å; I85-K89 PolarHBondContact O-N 2.95Å; I85-L115 HydrophobicContact CG1-CD1 3.83Å; I85-L146 HydrophobicContact CB-CD1 4.32Å; I85-L146 HydrophobicContact CG1-CD1 3.97Å; I85-L146 HydrophobicContact CG2-CD1 3.92Å
86V98.7Very high97.7Very high75 Ų7535.2 Ų35.246%0.45519%0.186SC..Hα-helixtrans-58.4-51.3176.7174.80000109.4A64 A82 C83 V88 K89 T90A64-V86 HydrophobicContact CB-CB 4.35Å; A64-V86 HydrophobicContact CB-CG1 4.2Å; A82-V86 PolarHBondContact O-N 3.17Å; A82-V86 VanDerWaalsContact O-N 3.09Å; C83-V86 WeakPolarHBondContact O-CB 3.38Å; C83-V86 PolarHBondContact O-N 3.19Å; C83-V86 VanDerWaalsContact O-N 3.16Å; V86-V88 PolarHBondContact O-N 3.17Å; V86-K89 PolarHBondContact O-N 3.16Å; V86-K89 VanDerWaalsContact O-N 3.16Å; V86-T90 PolarHBondContact O-N 2.93Å; V86-T90 PolarHBondContact O-OG1 3.28Å
87L98.8Very high97.6Very high2 Ų237 Ų371%0.0119%0.191CC..Hα-helixtrans-53.1-50.9177.7-171.8157.2000111.9I61 A64 H65 C83 Q84 K89 T90 V91 A111I61-L87 HydrophobicContact CG2-CD1 4.46Å; I61-L87 HydrophobicContact CG2-CG 4.14Å; A64-L87 HydrophobicContact CB-CB 4.04Å; H65-L87 HydrophobicContact CB-CD1 3.84Å; C83-L87 PolarHBondContact O-N 2.96Å; Q84-L87 PolarHBondContact O-N 2.91Å; L87-K89 PolarHBondContact O-N 3.41Å; L87-T90 PolarHBondContact O-N 3.12Å; L87-V91 HydrophobicContact CD2-CG2 3.84Å; L87-V91 WeakPolarHBondContact O-CB 2.91Å; L87-V91 VanDerWaalsContact O-CG2 3.28Å; L87-V91 WeakPolarHBondContact O-CG2 3.32Å; L87-V91 PolarHBondContact O-N 3.42Å; L87-A111 HydrophobicContact CD2-CB 3.6Å
88V98.9Very high97.4Very high1 Ų135.2 Ų35.21%0.00619%0.185CC..Hα-helixtrans-65-39.1-179167.60000112.2Q84 I85 V86 A92 A111 L115 L146 L150Q84-V88 WeakPolarHBondContact O-CB 3.42Å; Q84-V88 WeakPolarHBondContact O-CG2 3.4Å; Q84-V88 PolarHBondContact O-N 2.99Å; I85-V88 PolarHBondContact O-N 3.27Å; V86-V88 PolarHBondContact O-N 3.17Å; V88-A92 WeakPolarHBondContact O-CB 3.48Å; V88-A92 PolarHBondContact O-N 3.26Å; V88-A111 HydrophobicContact CG2-CB 3.86Å; V88-A111 WeakPolarHBondContact CG2-O 3.4Å; V88-L115 HydrophobicContact CB-CD2 4.12Å; V88-L115 HydrophobicContact CG1-CD2 3.94Å; V88-L115 HydrophobicContact CG2-CB 3.96Å; V88-L115 HydrophobicContact CG2-CD2 3.89Å; V88-L115 HydrophobicContact CG2-CG 4.42Å; V88-L146 HydrophobicContact CG1-CB 4Å; V88-L150 HydrophobicContact CG1-CD1 3.96Å
89K98.8Very high96.9Very high120 Ų12039.5 Ų39.552%0.52220%0.202SC..Hα-helixtrans-63.7-44.4176-76.2177.6175.6-179.50111.3I85 V86 L87 A92 K93 L146I85-K89 HydrophobicContact CG2-CD 4.01Å; I85-K89 HydrophobicContact CG2-CG 4.46Å; I85-K89 WeakPolarHBondContact O-CB 3.36Å; I85-K89 WeakPolarHBondContact O-CG 3.27Å; I85-K89 PolarHBondContact O-N 2.95Å; V86-K89 PolarHBondContact O-N 3.16Å; V86-K89 VanDerWaalsContact O-N 3.16Å; L87-K89 PolarHBondContact O-N 3.41Å; K89-A92 WeakPolarHBondContact O-CB 3.35Å; K89-A92 PolarHBondContact O-N 3.39Å; K89-K93 PolarHBondContact O-N 2.97Å; K89-L146 HydrophobicContact CD-CD2 4.49Å; K89-L146 HydrophobicContact CG-CD2 3.85Å
90T98.7Very high96.1Very high12 Ų1243.2 Ų43.27%0.07422%0.224CC..Hα-helixtrans-69.4-39.1179-56.30000111.5P57 E60 I61 V86 L87 A92 K93 A94P57-T90 HydrophobicContact CB-CG2 3.66Å; E60-T90 HydrophobicContact CB-CG2 4.02Å; E60-T90 WeakPolarHBondContact OE2-CG2 3.36Å; E60-T90 PolarHBondContact OE2-OG1 3.35Å; I61-T90 HydrophobicContact CD1-CG2 4.09Å; I61-T90 HydrophobicContact CG1-CG2 3.61Å; V86-T90 PolarHBondContact O-N 2.93Å; V86-T90 PolarHBondContact O-OG1 3.28Å; L87-T90 PolarHBondContact O-N 3.12Å; T90-A92 VanDerWaalsContact C-N 3.31Å; T90-A92 PolarHBondContact O-N 2.96Å; T90-K93 WeakPolarHBondContact O-CB 3.32Å; T90-K93 PolarHBondContact O-N 3Å; T90-A94 PolarHBondContact O-N 3.48Å
91V98.6Very high95.5Very high0 Ų044.5 Ų44.50%023%0.231CC..Hα-helixtrans-60.6-39.2170.3167.50000111.5I61 L87 K93 A94 L95 V107 V108 L150I61-V91 HydrophobicContact CD1-CG2 3.76Å; I61-V91 HydrophobicContact CG1-CG2 4.06Å; I61-V91 HydrophobicContact CG2-CG2 4.34Å; L87-V91 HydrophobicContact CD2-CG2 3.84Å; L87-V91 WeakPolarHBondContact O-CB 2.91Å; L87-V91 VanDerWaalsContact O-CG2 3.28Å; L87-V91 WeakPolarHBondContact O-CG2 3.32Å; L87-V91 PolarHBondContact O-N 3.42Å; V91-K93 VanDerWaalsContact C-N 3.33Å; V91-K93 PolarHBondContact O-N 2.91Å; V91-A94 PolarHBondContact O-N 3.09Å; V91-L95 VanDerWaalsContact O-CB 3.22Å; V91-L95 WeakPolarHBondContact O-CB 3.34Å; V91-L95 PolarHBondContact O-N 3.37Å; V91-V107 HydrophobicContact CG2-CG1 4.16Å; V91-V108 HydrophobicContact CG1-CB 4.43Å; V91-V108 HydrophobicContact CG1-CG2 3.75Å; V91-L150 HydrophobicContact CG1-CD2 4.5Å
92A98.5Very high95.3Very high10 Ų1045.1 Ų45.18%0.08324%0.235CC..Hα-helixtrans-64.6-37.9176.100000112.2V88 K89 T90 S96 L150 I153V88-A92 WeakPolarHBondContact O-CB 3.48Å; V88-A92 PolarHBondContact O-N 3.26Å; K89-A92 WeakPolarHBondContact O-CB 3.35Å; K89-A92 PolarHBondContact O-N 3.39Å; T90-A92 VanDerWaalsContact C-N 3.31Å; T90-A92 PolarHBondContact O-N 2.96Å; A92-S96 WeakPolarHBondContact O-CB 3.36Å; A92-S96 PolarHBondContact O-N 3.14Å; A92-S96 PolarHBondContact O-OG 3.24Å; A92-L150 HydrophobicContact CB-CD2 3.58Å; A92-L150 HydrophobicContact CB-CG 4.43Å; A92-I153 HydrophobicContact CB-CD1 3.99Å; A92-I153 WeakPolarHBondContact O-CD1 3.22Å
93K97.6Very high95.2Very high100 Ų10044.6 Ų44.644%0.43522%0.224SC..Hα-helixtrans-62.8-53.4172.4-178.2-176.1173.9-170.60110.7K89 T90 V91 L95 S96 E97K89-K93 PolarHBondContact O-N 2.97Å; T90-K93 WeakPolarHBondContact O-CB 3.32Å; T90-K93 PolarHBondContact O-N 3Å; V91-K93 VanDerWaalsContact C-N 3.33Å; V91-K93 PolarHBondContact O-N 2.91Å; K93-L95 VanDerWaalsContact C-N 3.31Å; K93-L95 PolarHBondContact O-N 3.03Å; K93-S96 WeakPolarHBondContact O-CB 3.28Å; K93-S96 PolarHBondContact O-N 3.07Å; K93-E97 WeakPolarHBondContact CE-OE1 3.2Å; K93-E97 WeakPolarHBondContact CG-OE1 2.92Å; K93-E97 PolarHBondContact O-N 3.42Å
94A96.7Very high95.1Very high8 Ų844.4 Ų44.47%0.06622%0.222CC..Hα-helixtrans-56.5-43.617800000112.4P57 T90 V91 S96 E97 L98 I104P57-A94 HydrophobicContact CG-CB 3.71Å; T90-A94 PolarHBondContact O-N 3.48Å; V91-A94 PolarHBondContact O-N 3.09Å; A94-S96 VanDerWaalsContact C-N 3.32Å; A94-S96 PolarHBondContact O-N 2.95Å; A94-E97 PolarHBondContact O-N 2.94Å; A94-L98 WeakPolarHBondContact O-CB 3.46Å; A94-L98 PolarHBondContact O-N 3.39Å; A94-I104 HydrophobicContact CB-CD1 3.97Å
95L96.7Very high95Very high0 Ų045.3 Ų45.30%023%0.227CC..Hα-helixtrans-62.9-36.9176178.666.4000112.2V91 K93 I104 L105 V108 L150 I153 K166V91-L95 VanDerWaalsContact O-CB 3.22Å; V91-L95 WeakPolarHBondContact O-CB 3.34Å; V91-L95 PolarHBondContact O-N 3.37Å; K93-L95 VanDerWaalsContact C-N 3.31Å; K93-L95 PolarHBondContact O-N 3.03Å; L95-I104 HydrophobicContact CD1-CG2 3.57Å; L95-L105 HydrophobicContact CD1-CD2 4.4Å; L95-V108 HydrophobicContact CB-CG2 4.4Å; L95-V108 HydrophobicContact CD1-CG2 4.09Å; L95-V108 HydrophobicContact CD2-CG1 4.28Å; L95-V108 HydrophobicContact CD2-CG2 3.9Å; L95-V108 HydrophobicContact CG-CG2 4.35Å; L95-L150 HydrophobicContact CD2-CD2 4.06Å; L95-I153 HydrophobicContact CD2-CB 4.21Å; L95-I153 HydrophobicContact CD2-CG2 3.85Å; L95-I153 HydrophobicContact CG-CG2 3.78Å; L95-K166 HydrophobicContact CD1-CD 3.79Å; L95-K166 HydrophobicContact CD1-CG 3.95Å; L95-K166 HydrophobicContact CG-CD 4.34Å; L95-K166 VanDerWaalsContact O-CE 3.25Å; L95-K166 WeakPolarHBondContact O-CE 3.29Å; L95-K166 PolarHBondContact O-NZ 3.27Å
96S94.4Very high95Very high56 Ų5646.3 Ų46.339%0.39224%0.235SC..Hα-helixtrans-70.9-39178.8-58.20000111.6A92 K93 A94 I153A92-S96 WeakPolarHBondContact O-CB 3.36Å; A92-S96 PolarHBondContact O-N 3.14Å; A92-S96 PolarHBondContact O-OG 3.24Å; K93-S96 WeakPolarHBondContact O-CB 3.28Å; K93-S96 PolarHBondContact O-N 3.07Å; A94-S96 VanDerWaalsContact C-N 3.32Å; A94-S96 PolarHBondContact O-N 2.95Å; S96-I153 WeakPolarHBondContact OG-CD1 2.9Å
97E93.3Very high95Very high110 Ų11042.8 Ų42.851%0.51421%0.214SC..Hα-helixtrans-76.8-28.7-178.8-69.9171.1-177.200113.1K93 A94 K99K93-E97 WeakPolarHBondContact CE-OE1 3.2Å; K93-E97 WeakPolarHBondContact CG-OE1 2.92Å; K93-E97 PolarHBondContact O-N 3.42Å; A94-E97 PolarHBondContact O-N 2.94Å; E97-K99 PolarHBondContact O-N 3.23Å
98L91.3Very high95Very high35 Ų3542.7 Ų42.718%0.18321%0.214CC..  trans-64.9107.2179-175.466.8000111.2A94 D101 I104 R159 K166A94-L98 WeakPolarHBondContact O-CB 3.46Å; A94-L98 PolarHBondContact O-N 3.39Å; L98-D101 HydrophobicContact CD1-CB 4.34Å; L98-D101 HydrophobicContact CD2-CB 4.36Å; L98-D101 HydrophobicContact CG-CB 4.32Å; L98-I104 HydrophobicContact CD2-CB 4.12Å; L98-I104 HydrophobicContact CD2-CG2 3.59Å; L98-R159 PolarHBondContact O-NH2 2.96Å; L98-K166 VanDerWaalsContact O-CE 3.24Å; L98-K166 WeakPolarHBondContact O-CE 3.28Å; L98-K166 PolarHBondContact O-NZ 3.36Å
99K84.7Confident95Very high169 Ų16945.1 Ų45.174%0.73523%0.225SC*.  trans-91149.4175.4-62-177.7-176.1178.60111.1E97 D101E97-K99 PolarHBondContact O-N 3.23Å; K99-D101 PolarHBondContact O-N 3.23Å
100D80.2Confident95Very high126 Ų12639.8 Ų39.867%0.67420%0.202SC*.SBendtrans50.227.1171.8-49.6-38.6000118.1R159D100-R159 VanDerWaalsContact CA-NE 3.28Å; D100-R159 IonicContact OD1-NE 2.83Å
101D87.5Confident95Very high27 Ų2739.3 Ų39.314%0.14420%0.2CC..  trans-154.3158.9176.1-154.7-35.6000110.4R20 L98 K99 W103 R159R20-D101 IonicContact CZ-OD2 3.72Å; R20-D101 IonicContact NH1-OD2 3.3Å; R20-D101 PolarHBondContact NH1-OD2 3.49Å; L98-D101 HydrophobicContact CD1-CB 4.34Å; L98-D101 HydrophobicContact CD2-CB 4.36Å; L98-D101 HydrophobicContact CG-CB 4.32Å; K99-D101 PolarHBondContact O-N 3.23Å; D101-W103 VanDerWaalsContact CG-CD1 3.47Å; D101-W103 PolarHBondContact OD1-N 3.11Å; D101-R159 PolarHBondContact O-NH1 3.4Å; D101-R159 PolarHBondContact O-NH2 3.26Å
102N93.3Very high95Very high25 Ų2539.3 Ų39.313%0.13420%0.2CC..  trans-131.79.4178.372.612.9000113.7I104 L105 E163 D164 S165 K166N102-I104 PolarHBondContact O-N 2.95Å; N102-L105 HydrophobicContact CB-CD1 3.78Å; N102-L105 HydrophobicContact CB-CG 4.01Å; N102-L105 WeakPolarHBondContact O-CB 3.46Å; N102-L105 WeakPolarHBondContact O-CG 3.16Å; N102-L105 PolarHBondContact O-N 3.38Å; N102-E163 PolarHBondContact ND2-O 2.81Å; N102-D164 WeakPolarHBondContact ND2-CA 3.29Å; N102-S165 PolarHBondContact ND2-N 2.76Å; N102-S165 PolarHBondContact ND2-O 2.98Å; N102-K166 HydrophobicContact CB-CG 4.48Å
103W95.8Very high95Very high31 Ų3140.2 Ų40.212%0.11720%0.202CC..THydrogen-bonded Turntrans-52.6-28.2-176.674.3-93.1000114I17 R20 G22 L25 W58 D101 L105 P106I17-W103 HydrophobicContact CG2-CH2 4.49Å; R20-W103 HydrophobicContact CB-CB 4.23Å; R20-W103 HydrophobicContact CB-CD2 3.81Å; R20-W103 HydrophobicContact CB-CE3 4.31Å; R20-W103 HydrophobicContact CB-CG 3.77Å; R20-W103 HydrophobicContact CG-CD2 4.31Å; R20-W103 HydrophobicContact CG-CG 4.34Å; R20-W103 WeakPolarHBondContact O-CB 3.24Å; G22-W103 VanDerWaalsContact CA-O 3.28Å; G22-W103 WeakPolarHBondContact CA-O 3.41Å; L25-W103 HydrophobicContact CD2-CH2 4.02Å; L25-W103 HydrophobicContact CD2-CZ3 3.77Å; W58-W103 AromaticContact CH2-CH2 3.61Å; W58-W103 HydrophobicContact CH2-CH2 3.61Å; W58-W103 HydrophobicContact CH2-CZ2 4.19Å; W58-W103 HydrophobicContact CH2-CZ3 4.31Å; W58-W103 AromaticContact CZ2-CH2 3.37Å; W58-W103 HydrophobicContact CZ2-CH2 3.37Å; W58-W103 AromaticContact CZ2-CZ2 3.61Å; W58-W103 HydrophobicContact CZ2-CZ2 3.61Å; W58-W103 HydrophobicContact CZ2-CZ3 4.46Å; D101-W103 VanDerWaalsContact CG-CD1 3.47Å; D101-W103 PolarHBondContact OD1-N 3.11Å; W103-L105 VanDerWaalsContact C-N 3.28Å; W103-L105 PolarHBondContact O-N 3.32Å; W103-P106 WeakPolarHBondContact O-CD 3.01Å
104I96.8Very high95Very high2 Ų235.5 Ų35.51%0.0118%0.182CC..THydrogen-bonded Turntrans-70.5-14178.7-164.9169.5000114.2W58 A94 L95 L98 N102 P106 V107 V108W58-I104 HydrophobicContact CH2-CD1 3.57Å; W58-I104 HydrophobicContact CH2-CG1 3.95Å; W58-I104 HydrophobicContact CZ2-CD1 4.09Å; W58-I104 HydrophobicContact CZ3-CD1 4.46Å; A94-I104 HydrophobicContact CB-CD1 3.97Å; L95-I104 HydrophobicContact CD1-CG2 3.57Å; L98-I104 HydrophobicContact CD2-CB 4.12Å; L98-I104 HydrophobicContact CD2-CG2 3.59Å; N102-I104 PolarHBondContact O-N 2.95Å; I104-P106 VanDerWaalsContact C-CD 3.41Å; I104-P106 VanDerWaalsContact C-N 3.35Å; I104-V107 HydrophobicContact CG1-CB 4.13Å; I104-V107 WeakPolarHBondContact O-CA 3.37Å; I104-V107 VanDerWaalsContact O-CB 3.32Å; I104-V107 WeakPolarHBondContact O-CB 3.46Å; I104-V107 PolarHBondContact O-N 3.06Å; I104-V108 HydrophobicContact CG1-CG2 4.38Å; I104-V108 HydrophobicContact CG2-CG2 4.36Å; I104-V108 PolarHBondContact O-N 3.36Å; I104-V108 VanDerWaalsContact O-N 3.07Å
105L97.7Very high95.1Very high19 Ų1935.1 Ų35.110%0.09918%0.179CC..Hα-helixtrans-53.5-37.9-174.7-75.3-177.9000115.3L95 N102 W103 V107 V108 H109 K166 L168L95-L105 HydrophobicContact CD1-CD2 4.4Å; N102-L105 HydrophobicContact CB-CD1 3.78Å; N102-L105 HydrophobicContact CB-CG 4.01Å; N102-L105 WeakPolarHBondContact O-CB 3.46Å; N102-L105 WeakPolarHBondContact O-CG 3.16Å; N102-L105 PolarHBondContact O-N 3.38Å; W103-L105 VanDerWaalsContact C-N 3.28Å; W103-L105 PolarHBondContact O-N 3.32Å; L105-V107 VanDerWaalsContact C-N 3.31Å; L105-V107 PolarHBondContact O-N 2.83Å; L105-V108 WeakPolarHBondContact O-CB 3.44Å; L105-V108 PolarHBondContact O-N 3.12Å; L105-H109 PolarHBondContact O-N 3Å; L105-K166 HydrophobicContact CD2-CB 4.45Å; L105-L168 HydrophobicContact CD1-CB 3.78Å
106P98Very high95.2Very high44 Ų4436.5 Ų36.529%0.28618%0.184SC..Hα-helixtrans-61.5-38173.4-23.335.9000112.7W103 I104 H109 V110W103-P106 WeakPolarHBondContact O-CD 3.01Å; I104-P106 VanDerWaalsContact C-CD 3.41Å; I104-P106 VanDerWaalsContact C-N 3.35Å; P106-H109 WeakPolarHBondContact O-CB 3.19Å; P106-H109 PolarHBondContact O-N 3.06Å; P106-V110 PolarHBondContact O-N 3.07Å; P106-V110 VanDerWaalsContact O-N 3.09Å
107V98.6Very high95.4Very high1 Ų139.3 Ų39.31%0.00619%0.186CC..Hα-helixtrans-64.4-45.9174.8178.70000110.5L25 L29 V91 I104 L105 H109 V110 A111L25-V107 HydrophobicContact CB-CG2 4Å; L25-V107 HydrophobicContact CD2-CG2 3.89Å; L25-V107 HydrophobicContact CG-CG2 3.77Å; L29-V107 HydrophobicContact CD1-CG1 3.65Å; L29-V107 HydrophobicContact CD1-CG2 4.4Å; V91-V107 HydrophobicContact CG2-CG1 4.16Å; I104-V107 HydrophobicContact CG1-CB 4.13Å; I104-V107 WeakPolarHBondContact O-CA 3.37Å; I104-V107 VanDerWaalsContact O-CB 3.32Å; I104-V107 WeakPolarHBondContact O-CB 3.46Å; I104-V107 PolarHBondContact O-N 3.06Å; L105-V107 VanDerWaalsContact C-N 3.31Å; L105-V107 PolarHBondContact O-N 2.83Å; V107-H109 PolarHBondContact O-N 2.88Å; V107-V110 VanDerWaalsContact O-CG2 3.26Å; V107-V110 WeakPolarHBondContact O-CG2 3.47Å; V107-V110 PolarHBondContact O-N 3.1Å; V107-A111 VanDerWaalsContact O-CB 3.26Å; V107-A111 WeakPolarHBondContact O-CB 3.42Å; V107-A111 PolarHBondContact O-N 2.79Å
108V98.8Very high95.6Very high1 Ų135 Ų351%0.00617%0.166CC..Hα-helixtrans-55.1-42.2174.7174.40000111.1V91 L95 I104 L105 A112 L150 L173V91-V108 HydrophobicContact CG1-CB 4.43Å; V91-V108 HydrophobicContact CG1-CG2 3.75Å; L95-V108 HydrophobicContact CB-CG2 4.4Å; L95-V108 HydrophobicContact CD1-CG2 4.09Å; L95-V108 HydrophobicContact CD2-CG1 4.28Å; L95-V108 HydrophobicContact CD2-CG2 3.9Å; L95-V108 HydrophobicContact CG-CG2 4.35Å; I104-V108 HydrophobicContact CG1-CG2 4.38Å; I104-V108 HydrophobicContact CG2-CG2 4.36Å; I104-V108 PolarHBondContact O-N 3.36Å; I104-V108 VanDerWaalsContact O-N 3.07Å; L105-V108 WeakPolarHBondContact O-CB 3.44Å; L105-V108 PolarHBondContact O-N 3.12Å; V108-A112 WeakPolarHBondContact O-CB 3.44Å; V108-A112 PolarHBondContact O-N 3.19Å; V108-A112 VanDerWaalsContact O-N 3.13Å; V108-L150 HydrophobicContact CG1-CB 4.3Å; V108-L150 HydrophobicContact CG1-CD1 4.02Å; V108-L150 HydrophobicContact CG1-CD2 4.06Å; V108-L150 HydrophobicContact CG1-CG 4.36Å; V108-L173 HydrophobicContact CG1-CD1 4.13Å; V108-L173 HydrophobicContact CG1-CD2 4.09Å
109H98.6Very high95.8Very high51 Ų5133.4 Ų33.424%0.23616%0.157CC..Hα-helixtrans-66.7-47.4-178.9-167.565.7000112.9L105 P106 V107 A112 I113 G172L105-H109 PolarHBondContact O-N 3Å; P106-H109 WeakPolarHBondContact O-CB 3.19Å; P106-H109 PolarHBondContact O-N 3.06Å; V107-H109 PolarHBondContact O-N 2.88Å; H109-A112 PolarHBondContact O-N 3.19Å; H109-I113 WeakPolarHBondContact NE2-CD1 3.45Å; H109-I113 WeakPolarHBondContact O-CG1 3.49Å; H109-I113 PolarHBondContact O-N 3.43Å; H109-G172 VanDerWaalsContact CE1-CA 3.48Å; H109-G172 WeakPolarHBondContact CE1-CA 3.38Å
110V98.5Very high96.3Very high9 Ų929.2 Ų29.26%0.05514%0.14CC..Hα-helixtrans-68-39.1179.4-58.70000111.4M30 P106 V107 A112 I113 D114M30-V110 HydrophobicContact CB-CB 4.32Å; M30-V110 HydrophobicContact CB-CG1 4.44Å; M30-V110 HydrophobicContact CE-CB 4.41Å; M30-V110 HydrophobicContact CE-CG1 3.49Å; M30-V110 VanDerWaalsContact CE-CG1 3.49Å; M30-V110 HydrophobicContact CG-CB 4.47Å; P106-V110 PolarHBondContact O-N 3.07Å; P106-V110 VanDerWaalsContact O-N 3.09Å; V107-V110 VanDerWaalsContact O-CG2 3.26Å; V107-V110 WeakPolarHBondContact O-CG2 3.47Å; V107-V110 PolarHBondContact O-N 3.1Å; V110-A112 VanDerWaalsContact C-N 3.31Å; V110-A112 PolarHBondContact O-N 2.97Å; V110-I113 PolarHBondContact O-N 2.64Å; V110-I113 VanDerWaalsContact O-N 3.11Å; V110-D114 PolarHBondContact O-N 2.97Å
111A98.8Very high97Very high2 Ų224.7 Ų24.72%0.01712%0.123CC..Hα-helixtrans-59.3-43177.300000111.6Q84 L87 V88 V107 L115Q84-A111 PolarHBondContact NE2-O 3.19Å; Q84-A111 VanDerWaalsContact NE2-O 3.07Å; L87-A111 HydrophobicContact CD2-CB 3.6Å; V88-A111 HydrophobicContact CG2-CB 3.86Å; V88-A111 WeakPolarHBondContact CG2-O 3.4Å; V107-A111 VanDerWaalsContact O-CB 3.26Å; V107-A111 WeakPolarHBondContact O-CB 3.42Å; V107-A111 PolarHBondContact O-N 2.79Å; A111-L115 VanDerWaalsContact O-CB 3.3Å; A111-L115 WeakPolarHBondContact O-CB 3.44Å; A111-L115 PolarHBondContact O-N 2.61Å
112A98.9Very high97.2Very high0 Ų023.8 Ų23.80%012%0.119CC..Hα-helixtrans-67.9-38.2174.900000113.3V108 H109 V110 R116 I147 L150 L173 Q176V108-A112 WeakPolarHBondContact O-CB 3.44Å; V108-A112 PolarHBondContact O-N 3.19Å; V108-A112 VanDerWaalsContact O-N 3.13Å; H109-A112 PolarHBondContact O-N 3.19Å; V110-A112 VanDerWaalsContact C-N 3.31Å; V110-A112 PolarHBondContact O-N 2.97Å; A112-R116 WeakPolarHBondContact O-CB 3.48Å; A112-R116 PolarHBondContact O-N 3.13Å; A112-R116 VanDerWaalsContact O-N 3.14Å; A112-I147 HydrophobicContact CB-CD1 4.22Å; A112-I147 HydrophobicContact CB-CG1 3.95Å; A112-I147 HydrophobicContact CB-CG2 4.36Å; A112-I147 WeakPolarHBondContact O-CD1 3.46Å; A112-L150 HydrophobicContact CB-CD1 4.32Å; A112-L173 HydrophobicContact CB-CD2 3.63Å; A112-Q176 HydrophobicContact CB-CG 4.37Å
113I98.8Very high97.1Very high28 Ų2822.9 Ų22.914%0.14411%0.114CC..Hα-helixtrans-62.2-48.3176.3-76.4168.3000110.7H109 V110 R116 R117 Q176H109-I113 WeakPolarHBondContact NE2-CD1 3.45Å; H109-I113 WeakPolarHBondContact O-CG1 3.49Å; H109-I113 PolarHBondContact O-N 3.43Å; V110-I113 PolarHBondContact O-N 2.64Å; V110-I113 VanDerWaalsContact O-N 3.11Å; I113-R116 PolarHBondContact O-N 3.24Å; I113-R117 HydrophobicContact CG2-CG 4.48Å; I113-R117 WeakPolarHBondContact O-CG 3.16Å; I113-R117 PolarHBondContact O-N 3.22Å; I113-Q176 HydrophobicContact CG1-CG 4.27Å
114D98.8Very high96.5Very high2 Ų224.7 Ų24.71%0.01113%0.131CC..Hα-helixtrans-72.6-39.7-174.6-69.9-25000111.1M30 C31 V110 R116 R117 F118M30-D114 WeakPolarHBondContact CA-OD2 3.26Å; C31-D114 HydrophobicContact CB-CB 4.24Å; C31-D114 PolarHBondContact N-OD2 3.38Å; V110-D114 PolarHBondContact O-N 2.97Å; D114-R116 VanDerWaalsContact C-N 3.31Å; D114-R116 PolarHBondContact O-N 3.18Å; D114-R117 WeakPolarHBondContact O-CB 3.32Å; D114-R117 PolarHBondContact O-N 2.99Å; D114-R117 IonicContact OD1-NH1 3.14Å; D114-R117 PolarHBondContact OD1-NH1 3.42Å; D114-R117 VanDerWaalsContact OD1-NH1 3.16Å; D114-F118 HydrophobicContact CB-CE2 4.44Å; D114-F118 WeakPolarHBondContact O-CD2 3.46Å; D114-F118 PolarHBondContact O-N 2.94Å
115L98.8Very high95.5Very high0 Ų030.8 Ų30.80%016%0.157CC..Hα-helixtrans-55.5-46.4171.3-179.865.4000111.9Y81 Q84 I85 V88 A111 R117 A119 A143 L146 I147Y81-L115 HydrophobicContact CD2-CD1 4.04Å; Y81-L115 HydrophobicContact CE2-CD1 3.6Å; Q84-L115 HydrophobicContact CB-CD1 4.47Å; Q84-L115 HydrophobicContact CG-CB 3.9Å; Q84-L115 HydrophobicContact CG-CD1 4.18Å; I85-L115 HydrophobicContact CG1-CD1 3.83Å; V88-L115 HydrophobicContact CB-CD2 4.12Å; V88-L115 HydrophobicContact CG1-CD2 3.94Å; V88-L115 HydrophobicContact CG2-CB 3.96Å; V88-L115 HydrophobicContact CG2-CD2 3.89Å; V88-L115 HydrophobicContact CG2-CG 4.42Å; A111-L115 VanDerWaalsContact O-CB 3.3Å; A111-L115 WeakPolarHBondContact O-CB 3.44Å; A111-L115 PolarHBondContact O-N 2.61Å; L115-R117 PolarHBondContact O-N 3.33Å; L115-A119 WeakPolarHBondContact O-CB 3.49Å; L115-A119 PolarHBondContact O-N 2.95Å; L115-A143 HydrophobicContact CD2-CB 4.17Å; L115-A143 HydrophobicContact CG-CB 3.9Å; L115-L146 HydrophobicContact CD2-CB 3.82Å; L115-L146 HydrophobicContact CD2-CD1 3.9Å; L115-I147 HydrophobicContact CD2-CG1 4.25Å
116R98.4Very high93.9Very high29 Ų2931.9 Ų31.911%0.10916%0.162CC..Hα-helixtrans-63.4-40.5175.8-175.3-143.461.1-153.2-15.9111.5A112 I113 D114 H120 M140 I147 I180A112-R116 WeakPolarHBondContact O-CB 3.48Å; A112-R116 PolarHBondContact O-N 3.13Å; A112-R116 VanDerWaalsContact O-N 3.14Å; I113-R116 PolarHBondContact O-N 3.24Å; D114-R116 VanDerWaalsContact C-N 3.31Å; D114-R116 PolarHBondContact O-N 3.18Å; R116-H120 VanDerWaalsContact O-CB 3.23Å; R116-H120 WeakPolarHBondContact O-CB 3.47Å; R116-H120 PolarHBondContact O-N 3.36Å; R116-M140 HydrophobicContact CG-SD 4.44Å; R116-I147 HydrophobicContact CB-CD1 4.24Å; R116-I180 HydrophobicContact CB-CD1 4.49Å; R116-I180 HydrophobicContact CG-CD1 4.04Å; R116-I180 HydrophobicContact CG-CG1 3.73Å
117R98Very high91.9Very high114 Ų11434.1 Ų34.143%0.4317%0.174SC..Hα-helixtrans-64.3-45179.5-76.9169.6168.9169.4-9.1111.7S32 I113 D114 L115 H120 G121S32-R117 PolarHBondContact OG-NH1 3.47Å; I113-R117 HydrophobicContact CG2-CG 4.48Å; I113-R117 WeakPolarHBondContact O-CG 3.16Å; I113-R117 PolarHBondContact O-N 3.22Å; D114-R117 WeakPolarHBondContact O-CB 3.32Å; D114-R117 PolarHBondContact O-N 2.99Å; D114-R117 IonicContact OD1-NH1 3.14Å; D114-R117 PolarHBondContact OD1-NH1 3.42Å; D114-R117 VanDerWaalsContact OD1-NH1 3.16Å; L115-R117 PolarHBondContact O-N 3.33Å; R117-H120 PolarHBondContact O-N 2.92Å; R117-G121 PolarHBondContact O-N 3.28Å
118F97.4Very high89.9Confident21 Ų2139 Ų399%0.09221%0.206CC..Hα-helixtrans-61.8-48.8175.2-74.1-59.2000111.6C31 C68 M72 A80 Y81 Q84 D114 H120 G121 L122C31-F118 HydrophobicContact CB-CE2 4.35Å; C31-F118 HydrophobicContact CB-CZ 4.24Å; C68-F118 VanDerWaalsContact SG-CZ 3.53Å; M72-F118 HydrophobicContact CG-CE1 4.04Å; M72-F118 HydrophobicContact CG-CZ 4.11Å; M72-F118 HydrophobicContact SD-CE1 4.14Å; M72-F118 HydrophobicContact SD-CZ 3.71Å; A80-F118 HydrophobicContact CB-CD1 4.31Å; A80-F118 HydrophobicContact CB-CE1 3.79Å; A80-F118 HydrophobicContact CB-CZ 4.12Å; Y81-F118 HydrophobicContact CD2-CB 3.73Å; Y81-F118 HydrophobicContact CG-CB 4.35Å; Q84-F118 HydrophobicContact CB-CD2 3.8Å; Q84-F118 HydrophobicContact CB-CE2 4.02Å; Q84-F118 HydrophobicContact CG-CD2 3.89Å; Q84-F118 HydrophobicContact CG-CE2 4.15Å; D114-F118 HydrophobicContact CB-CE2 4.44Å; D114-F118 WeakPolarHBondContact O-CD2 3.46Å; D114-F118 PolarHBondContact O-N 2.94Å; F118-H120 VanDerWaalsContact C-N 3.33Å; F118-H120 PolarHBondContact O-N 3.03Å; F118-G121 PolarHBondContact O-N 2.85Å; F118-L122 WeakPolarHBondContact O-CG 3.42Å; F118-L122 PolarHBondContact O-N 3.42Å
119A96.6Very high87.9Confident0 Ų048 Ų480%025%0.248CC..Hα-helixtrans-56.9-46.5176.700000112.2Y81 L115 L122 D123 R139 M140 A143Y81-A119 HydrophobicContact CE2-CB 3.89Å; L115-A119 WeakPolarHBondContact O-CB 3.49Å; L115-A119 PolarHBondContact O-N 2.95Å; A119-L122 PolarHBondContact O-N 2.98Å; A119-D123 WeakPolarHBondContact O-CB 3.37Å; A119-D123 PolarHBondContact O-N 2.91Å; A119-R139 HydrophobicContact CB-CB 4.06Å; A119-M140 HydrophobicContact CB-CG 4.1Å; A119-M140 HydrophobicContact CB-SD 3.66Å; A119-A143 HydrophobicContact CB-CB 3.76Å
120H94.9Very high85.7Confident81 Ų8147.5 Ų47.538%0.37525%0.251SS..Hα-helixtrans-60.9-47.8176.817485.8000111.5R116 R117 F118 L122 D123 S124 M140 Q183R116-H120 VanDerWaalsContact O-CB 3.23Å; R116-H120 WeakPolarHBondContact O-CB 3.47Å; R116-H120 PolarHBondContact O-N 3.36Å; R117-H120 PolarHBondContact O-N 2.92Å; F118-H120 VanDerWaalsContact C-N 3.33Å; F118-H120 PolarHBondContact O-N 3.03Å; H120-L122 VanDerWaalsContact C-N 3.33Å; H120-L122 PolarHBondContact O-N 3.44Å; H120-D123 PolarHBondContact O-N 2.92Å; H120-S124 VanDerWaalsContact O-CB 3.29Å; H120-S124 WeakPolarHBondContact O-CB 3.38Å; H120-S124 PolarHBondContact O-N 3.36Å; H120-S124 PolarHBondContact O-OG 3.39Å; H120-M140 HydrophobicContact CB-CE 4.44Å; H120-M140 HydrophobicContact CB-SD 3.93Å; H120-M140 PolarHBondContact N-SD 2.89Å; H120-M140 VanDerWaalsContact N-SD 3.39Å; H120-Q183 VanDerWaalsContact ND1-CD 3.3Å; H120-Q183 PolarHBondContact ND1-NE2 3.24Å; H120-Q183 PolarHBondContact ND1-OE1 2.92Å
121G93.4Very high83.4Confident31 Ų3154.4 Ų54.432%0.3229%0.287SS..Hα-helixtrans-63.5-36.9-178.200000113.2R117 F118 K125R117-G121 PolarHBondContact O-N 3.28Å; F118-G121 PolarHBondContact O-N 2.85Å; G121-K125 WeakPolarHBondContact O-CG 3.46Å
122L92.6Very high81.2Confident9 Ų956.1 Ų56.15%0.04730%0.299CS..Hα-helixtrans-73.8-42.8176.2-70.1172.7000112F77 E78 Y81 F118 A119 H120 S124 K125 F126 R139F77-L122 HydrophobicContact CB-CD2 3.67Å; F77-L122 HydrophobicContact CB-CG 4.47Å; E78-L122 HydrophobicContact CG-CD2 4.36Å; E78-L122 WeakPolarHBondContact OE1-CD2 3.42Å; Y81-L122 VanDerWaalsContact CB-CD1 3.47Å; Y81-L122 HydrophobicContact CD1-CD1 3.92Å; Y81-L122 HydrophobicContact CD2-CD1 4.48Å; Y81-L122 HydrophobicContact CG-CD1 3.72Å; F118-L122 WeakPolarHBondContact O-CG 3.42Å; F118-L122 PolarHBondContact O-N 3.42Å; A119-L122 PolarHBondContact O-N 2.98Å; H120-L122 VanDerWaalsContact C-N 3.33Å; H120-L122 PolarHBondContact O-N 3.44Å; L122-S124 VanDerWaalsContact C-N 3.31Å; L122-S124 PolarHBondContact O-N 2.96Å; L122-K125 PolarHBondContact O-N 3.18Å; L122-F126 VanDerWaalsContact O-CE2 3.26Å; L122-F126 WeakPolarHBondContact O-CE2 3.35Å; L122-R139 VanDerWaalsContact CD1-CD 3.47Å
123D90.1Very high78.9Confident6 Ų661.6 Ų61.63%0.03232%0.323CS..Hα-helixtrans-72.1-23.4179.5-73.4-11.6000113A119 H120 G137 R139 M140A119-D123 WeakPolarHBondContact O-CB 3.37Å; A119-D123 PolarHBondContact O-N 2.91Å; H120-D123 PolarHBondContact O-N 2.92Å; D123-G137 WeakPolarHBondContact OD2-CA 3.29Å; D123-G137 PolarHBondContact OD2-N 3.29Å; D123-R139 WeakPolarHBondContact OD1-CB 3.36Å; D123-R139 IonicContact OD1-NH1 2.74Å; D123-R139 PolarHBondContact OD1-NH1 3.25Å; D123-R139 PolarHBondContact OD2-N 3.05Å; D123-M140 HydrophobicContact CB-CG 4.32Å; D123-M140 WeakPolarHBondContact OD2-CB 3.37Å; D123-M140 WeakPolarHBondContact OD2-CG 3.32Å; D123-M140 PolarHBondContact OD2-N 3.03Å
124S84.7Confident76.8Confident68 Ų6871.3 Ų71.348%0.47636%0.358SS..THydrogen-bonded Turntrans-80.7-13.6179.3-55.20000114H120 L122 F126H120-S124 VanDerWaalsContact O-CB 3.29Å; H120-S124 WeakPolarHBondContact O-CB 3.38Å; H120-S124 PolarHBondContact O-N 3.36Å; H120-S124 PolarHBondContact O-OG 3.39Å; L122-S124 VanDerWaalsContact C-N 3.31Å; L122-S124 PolarHBondContact O-N 2.96Å; S124-F126 VanDerWaalsContact C-N 3.3Å
125K74.6Confident74.9Confident130 Ų13074.2 Ų74.257%0.56537%0.374SS*.THydrogen-bonded Turntrans-78.9-11.1-180-77.4177.8-177.4-179.70113.6F77 G121 L122 T127F77-K125 VanDerWaalsContact CD2-NZ 3.3Å; G121-K125 WeakPolarHBondContact O-CG 3.46Å; L122-K125 PolarHBondContact O-N 3.18Å; K125-T127 PolarHBondContact O-N 3.19Å
126F64.4Low73.4Confident43 Ų4379.2 Ų79.219%0.18940%0.397CS..  trans-79.9118-177.2-63-62.6000111.5L122 S124L122-F126 VanDerWaalsContact O-CE2 3.26Å; L122-F126 WeakPolarHBondContact O-CE2 3.35Å; S124-F126 VanDerWaalsContact C-N 3.3Å
127T56.1Low72.6Confident90 Ų9078.3 Ų78.355%0.55240%0.396SS*.  trans-78148.1166.629.60000110.4K125 Q129 S130K125-T127 PolarHBondContact O-N 3.19Å; T127-Q129 PolarHBondContact O-N 2.97Å; T127-S130 PolarHBondContact O-N 3.27Å; T127-S130 PolarHBondContact O-OG 2.99Å
128P57.7Low72.2Confident105 Ų10581.3 Ų81.368%0.68241%0.408SS*.THydrogen-bonded Turntrans-56-22.3-178-1518.5000114.6
129Q55.2Low72Confident190 Ų19082.5 Ų82.589%0.88841%0.411SS*.THydrogen-bonded Turntrans-85-8.4-174.9-69.5171.3-6.200114.3T127T127-Q129 PolarHBondContact O-N 2.97Å
130S52.2Low71.9Confident40 Ų4082.5 Ų82.528%0.2841%0.411SS..SBendtrans-90.5145.7177.975.80000111.2T127 S132 F133T127-S130 PolarHBondContact O-N 3.27Å; T127-S130 PolarHBondContact O-OG 2.99Å; S130-S132 PolarHBondContact O-N 3.45Å; S130-S132 WeakPolarHBondContact OG-CB 3.22Å; S130-S132 PolarHBondContact OG-N 2.89Å; S130-F133 WeakPolarHBondContact O-CB 3.11Å; S130-F133 PolarHBondContact O-N 3.05Å
131D51.9Low71.9Confident154 Ų15482 Ų8282%0.82441%0.409SS*.G310 helixtrans-51-18.6167.4-86.9-38.5000112.9F133 R134D131-F133 PolarHBondContact O-N 2.96Å; D131-R134 PolarHBondContact O-N 3.05Å
132S51.2Low72.1Confident38 Ų3883 Ų8327%0.26641%0.408SS..G310 helixtrans-74.3-2.6174.7-560000114.5S130 R134 N135 Q136S130-S132 PolarHBondContact O-N 3.45Å; S130-S132 WeakPolarHBondContact OG-CB 3.22Å; S130-S132 PolarHBondContact OG-N 2.89Å; S132-R134 PolarHBondContact O-N 2.9Å; S132-N135 CarbonylContact O-C 3.57Å; S132-N135 WeakPolarHBondContact O-CA 3.45Å; S132-N135 WeakPolarHBondContact O-CB 3.44Å; S132-N135 PolarHBondContact O-N 3.5Å; S132-Q136 PolarHBondContact O-N 3.33Å
133F52Low72.3Confident115 Ų11582.6 Ų82.650%0.50441%0.405SS..G310 helixtrans-57.4-36166-173.8-97.7000111.1S130 D131 N135 Q136S130-F133 WeakPolarHBondContact O-CB 3.11Å; S130-F133 PolarHBondContact O-N 3.05Å; D131-F133 PolarHBondContact O-N 2.96Å; F133-N135 PolarHBondContact O-N 3.14Å; F133-Q136 WeakPolarHBondContact O-CB 3.12Å; F133-Q136 PolarHBondContact O-N 3.35Å
134R54.8Low72.7Confident231 Ų23182.5 Ų82.587%0.87241%0.405SS*.G310 helixtrans-62.1-24.3172.1-71.6-173.8177.8-174.91.2113.3D131 S132D131-R134 PolarHBondContact O-N 3.05Å; S132-R134 PolarHBondContact O-N 2.9Å
135N58Low73.4Confident64 Ų6485.4 Ų85.434%0.34241%0.411SS..G310 helixtrans-90.7-3.4177.7-67.5-40.4000112.9S132 F133 G137 R138S132-N135 CarbonylContact O-C 3.57Å; S132-N135 WeakPolarHBondContact O-CA 3.45Å; S132-N135 WeakPolarHBondContact O-CB 3.44Å; S132-N135 PolarHBondContact O-N 3.5Å; F133-N135 PolarHBondContact O-N 3.14Å; N135-G137 PolarHBondContact O-N 3.25Å; N135-R138 WeakPolarHBondContact O-CB 3.39Å; N135-R138 PolarHBondContact O-N 3.42Å; N135-R138 VanDerWaalsContact O-N 3.15Å
136Q67.1Low74.5Confident105 Ų10580.3 Ų80.349%0.49139%0.39SS..THydrogen-bonded Turntrans-62122.8-179.8-169.8177.78.700110.1S132 F133S132-Q136 PolarHBondContact O-N 3.33Å; F133-Q136 WeakPolarHBondContact O-CB 3.12Å; F133-Q136 PolarHBondContact O-N 3.35Å
137G82.1Confident76.2Confident9 Ų978.2 Ų78.29%0.09338%0.381CS..THydrogen-bonded Turntrans90.6-10.8179.500000114.9D123 N135 R139 M140 E141D123-G137 WeakPolarHBondContact OD2-CA 3.29Å; D123-G137 PolarHBondContact OD2-N 3.29Å; N135-G137 PolarHBondContact O-N 3.25Å; G137-R139 VanDerWaalsContact C-N 3.32Å; G137-R139 PolarHBondContact O-N 3.48Å; G137-M140 PolarHBondContact O-N 2.6Å; G137-E141 WeakPolarHBondContact O-CG 3.41Å; G137-E141 PolarHBondContact O-N 3.46Å
138R88.9Confident78.2Confident178 Ų17876 Ų7667%0.67237%0.365SS*.Hα-helixtrans-61.6-38.9-177.8-170.9-175.8-179-150.40.5112.1N135 E141 N142N135-R138 WeakPolarHBondContact O-CB 3.39Å; N135-R138 PolarHBondContact O-N 3.42Å; N135-R138 VanDerWaalsContact O-N 3.15Å; R138-E141 PolarHBondContact O-N 3.19Å; R138-N142 PolarHBondContact O-N 2.93Å
139R93.9Very high80.1Confident46 Ų4677.5 Ų77.517%0.17436%0.357CS..Hα-helixtrans-73-38178.5-64176.9-177.472.40.9110.9E78 Y81 A119 L122 D123 G137 E141 N142 A143E78-R139 IonicContact OE1-CZ 2.61Å; E78-R139 IonicContact OE1-NE 2.66Å; E78-R139 PolarHBondContact OE1-NE 3.16Å; E78-R139 IonicContact OE1-NH2 2.84Å; E78-R139 PolarHBondContact OE1-NH2 3.28Å; E78-R139 IonicContact OE2-CZ 2.6Å; E78-R139 IonicContact OE2-NE 3.49Å; E78-R139 PolarHBondContact OE2-NE 3.33Å; E78-R139 IonicContact OE2-NH2 2.59Å; E78-R139 PolarHBondContact OE2-NH2 2.99Å; E78-R139 VanDerWaalsContact OE2-NH2 3.14Å; Y81-R139 HydrophobicContact CD1-CG 4.44Å; Y81-R139 HydrophobicContact CE1-CB 4Å; Y81-R139 HydrophobicContact CE1-CG 3.79Å; Y81-R139 PolarHBondContact OH-O 3.23Å; A119-R139 HydrophobicContact CB-CB 4.06Å; L122-R139 VanDerWaalsContact CD1-CD 3.47Å; D123-R139 WeakPolarHBondContact OD1-CB 3.36Å; D123-R139 IonicContact OD1-NH1 2.74Å; D123-R139 PolarHBondContact OD1-NH1 3.25Å; D123-R139 PolarHBondContact OD2-N 3.05Å; G137-R139 VanDerWaalsContact C-N 3.32Å; G137-R139 PolarHBondContact O-N 3.48Å; R139-E141 VanDerWaalsContact C-N 3.34Å; R139-N142 PolarHBondContact O-N 3.08Å; R139-A143 VanDerWaalsContact O-CB 3.31Å; R139-A143 WeakPolarHBondContact O-CB 3.3Å; R139-A143 PolarHBondContact O-N 2.84Å
140M94.6Very high82.2Confident0 Ų068.4 Ų68.40%032%0.315CS..Hα-helixtrans-62.7-40.1173-74.1-71.1-80.200111.8R116 A119 H120 D123 G137 A143 A144 I180 Q183 I184R116-M140 HydrophobicContact CG-SD 4.44Å; A119-M140 HydrophobicContact CB-CG 4.1Å; A119-M140 HydrophobicContact CB-SD 3.66Å; H120-M140 HydrophobicContact CB-CE 4.44Å; H120-M140 HydrophobicContact CB-SD 3.93Å; H120-M140 PolarHBondContact N-SD 2.89Å; H120-M140 VanDerWaalsContact N-SD 3.39Å; D123-M140 HydrophobicContact CB-CG 4.32Å; D123-M140 WeakPolarHBondContact OD2-CB 3.37Å; D123-M140 WeakPolarHBondContact OD2-CG 3.32Å; D123-M140 PolarHBondContact OD2-N 3.03Å; G137-M140 PolarHBondContact O-N 2.6Å; M140-A143 PolarHBondContact O-N 3.29Å; M140-A144 WeakPolarHBondContact O-CB 3.31Å; M140-A144 PolarHBondContact O-N 3.19Å; M140-I180 HydrophobicContact CB-CG2 4.1Å; M140-I180 HydrophobicContact CE-CB 3.97Å; M140-I180 HydrophobicContact CE-CG1 3.63Å; M140-I180 HydrophobicContact CE-CG2 3.98Å; M140-I180 WeakPolarHBondContact O-CG2 3.35Å; M140-I180 HydrophobicContact SD-CG1 4.22Å; M140-Q183 HydrophobicContact CE-CB 4.33Å; M140-Q183 HydrophobicContact CE-CG 4.44Å; M140-Q183 VanDerWaalsContact CE-OE1 3.25Å; M140-I184 HydrophobicContact CB-CG2 3.9Å
141E94.8Very high84.4Confident69 Ų6967 Ų6732%0.32230%0.304SS..Hα-helixtrans-63.4-46.2173.8-74.2-178.3170.200112.4G137 R138 R139 A143 A144 Q145 I184 K186G137-E141 WeakPolarHBondContact O-CG 3.41Å; G137-E141 PolarHBondContact O-N 3.46Å; R138-E141 PolarHBondContact O-N 3.19Å; R139-E141 VanDerWaalsContact C-N 3.34Å; E141-A143 PolarHBondContact O-N 2.59Å; E141-A144 WeakPolarHBondContact O-CB 3.34Å; E141-A144 PolarHBondContact O-N 3.21Å; E141-Q145 WeakPolarHBondContact O-CG 3.13Å; E141-Q145 PolarHBondContact O-N 3.48Å; E141-I184 HydrophobicContact CG-CD1 3.82Å; E141-K186 VanDerWaalsContact OE1-CE 3.27Å; E141-K186 WeakPolarHBondContact OE1-CE 3.37Å; E141-K186 IonicContact OE1-NZ 2.73Å; E141-K186 PolarHBondContact OE1-NZ 3.35Å
142N97Very high86.5Confident54 Ų5464.1 Ų64.129%0.28929%0.285SS..Hα-helixtrans-61.1-44.7174.8-176.710.9000111.2Y81 R138 R139 A144 Q145 L146Y81-N142 PolarHBondContact OH-ND2 3.05Å; R138-N142 PolarHBondContact O-N 2.93Å; R139-N142 PolarHBondContact O-N 3.08Å; N142-A144 VanDerWaalsContact C-N 3.3Å; N142-A144 PolarHBondContact O-N 2.89Å; N142-Q145 WeakPolarHBondContact O-CB 3.39Å; N142-Q145 PolarHBondContact O-N 3.31Å; N142-Q145 VanDerWaalsContact O-N 3.15Å; N142-L146 WeakPolarHBondContact O-CG 3.45Å; N142-L146 PolarHBondContact O-N 2.87Å; N142-L146 VanDerWaalsContact O-N 3.08Å
143A98.3Very high88.7Confident0 Ų062.9 Ų62.90%028%0.276CS..Hα-helixtrans-59.3-41.2174.700000111.9L115 A119 R139 M140 E141 Q145 L146 I147 I180L115-A143 HydrophobicContact CD2-CB 4.17Å; L115-A143 HydrophobicContact CG-CB 3.9Å; A119-A143 HydrophobicContact CB-CB 3.76Å; R139-A143 VanDerWaalsContact O-CB 3.31Å; R139-A143 WeakPolarHBondContact O-CB 3.3Å; R139-A143 PolarHBondContact O-N 2.84Å; M140-A143 PolarHBondContact O-N 3.29Å; E141-A143 PolarHBondContact O-N 2.59Å; A143-Q145 PolarHBondContact O-N 3.09Å; A143-L146 PolarHBondContact O-N 3.18Å; A143-I147 WeakPolarHBondContact O-CB 3.14Å; A143-I147 WeakPolarHBondContact O-CG1 3.37Å; A143-I147 PolarHBondContact O-N 3.08Å; A143-I180 HydrophobicContact CB-CD1 4.27Å
144A98.2Very high90.8Very high3 Ų357.4 Ų57.43%0.02525%0.251CS..Hα-helixtrans-62-41.7175.700000112M140 E141 N142 L146 I147 L148 L177 I180 Y181M140-A144 WeakPolarHBondContact O-CB 3.31Å; M140-A144 PolarHBondContact O-N 3.19Å; E141-A144 WeakPolarHBondContact O-CB 3.34Å; E141-A144 PolarHBondContact O-N 3.21Å; N142-A144 VanDerWaalsContact C-N 3.3Å; N142-A144 PolarHBondContact O-N 2.89Å; A144-L146 PolarHBondContact O-N 3.14Å; A144-I147 PolarHBondContact O-N 3.5Å; A144-L148 WeakPolarHBondContact O-CB 3.33Å; A144-L148 PolarHBondContact O-N 2.9Å; A144-L177 HydrophobicContact CB-CD2 4.25Å; A144-L177 WeakPolarHBondContact O-CD2 3.3Å; A144-I180 HydrophobicContact CB-CB 4.48Å; A144-I180 HydrophobicContact CB-CD1 3.99Å; A144-I180 HydrophobicContact CB-CG2 3.87Å; A144-Y181 HydrophobicContact CB-CE1 3.72Å
145Q98.1Very high92.6Very high129 Ų12948.1 Ų48.160%0.60323%0.225SC*.Hα-helixtrans-61.3-44.6177-69.2173.713.800111.8E141 N142 A143 L148 R149E141-Q145 WeakPolarHBondContact O-CG 3.13Å; E141-Q145 PolarHBondContact O-N 3.48Å; N142-Q145 WeakPolarHBondContact O-CB 3.39Å; N142-Q145 PolarHBondContact O-N 3.31Å; N142-Q145 VanDerWaalsContact O-N 3.15Å; A143-Q145 PolarHBondContact O-N 3.09Å; Q145-L148 PolarHBondContact O-N 2.83Å; Q145-R149 PolarHBondContact O-N 2.9Å
146L98.8Very high94.3Very high23 Ų2349.3 Ų49.312%0.1224%0.238CC..Hα-helixtrans-68.4-41.9178.9-64.8174.8000112.4I85 V88 K89 L115 N142 A143 A144 L148 R149 L150I85-L146 HydrophobicContact CB-CD1 4.32Å; I85-L146 HydrophobicContact CG1-CD1 3.97Å; I85-L146 HydrophobicContact CG2-CD1 3.92Å; V88-L146 HydrophobicContact CG1-CB 4Å; K89-L146 HydrophobicContact CD-CD2 4.49Å; K89-L146 HydrophobicContact CG-CD2 3.85Å; L115-L146 HydrophobicContact CD2-CB 3.82Å; L115-L146 HydrophobicContact CD2-CD1 3.9Å; N142-L146 WeakPolarHBondContact O-CG 3.45Å; N142-L146 PolarHBondContact O-N 2.87Å; N142-L146 VanDerWaalsContact O-N 3.08Å; A143-L146 PolarHBondContact O-N 3.18Å; A144-L146 PolarHBondContact O-N 3.14Å; L146-L148 VanDerWaalsContact C-N 3.33Å; L146-R149 WeakPolarHBondContact O-CB 3.29Å; L146-R149 PolarHBondContact O-N 3.03Å; L146-L150 PolarHBondContact O-N 2.81Å
147I98.8Very high95.4Very high0 Ų045 Ų450%022%0.218CC..Hα-helixtrans-67.9-36.6175.6-64.4169.9000110.7A112 L115 R116 A143 A144 R149 L150 F151 L173 Q176 L177 I180A112-I147 HydrophobicContact CB-CD1 4.22Å; A112-I147 HydrophobicContact CB-CG1 3.95Å; A112-I147 HydrophobicContact CB-CG2 4.36Å; A112-I147 WeakPolarHBondContact O-CD1 3.46Å; L115-I147 HydrophobicContact CD2-CG1 4.25Å; R116-I147 HydrophobicContact CB-CD1 4.24Å; A143-I147 WeakPolarHBondContact O-CB 3.14Å; A143-I147 WeakPolarHBondContact O-CG1 3.37Å; A143-I147 PolarHBondContact O-N 3.08Å; A144-I147 PolarHBondContact O-N 3.5Å; I147-R149 VanDerWaalsContact C-N 3.28Å; I147-R149 PolarHBondContact O-N 3.32Å; I147-L150 WeakPolarHBondContact O-CB 3.38Å; I147-L150 PolarHBondContact O-N 2.66Å; I147-F151 PolarHBondContact O-N 2.94Å; I147-L173 HydrophobicContact CG2-CB 4.38Å; I147-L173 HydrophobicContact CG2-CD2 4.01Å; I147-Q176 HydrophobicContact CD1-CB 4.16Å; I147-Q176 HydrophobicContact CG2-CB 4.35Å; I147-L177 HydrophobicContact CB-CD2 3.86Å; I147-L177 HydrophobicContact CB-CG 4.42Å; I147-L177 HydrophobicContact CG2-CD1 4.41Å; I147-L177 HydrophobicContact CG2-CD2 3.72Å; I147-L177 HydrophobicContact CG2-CG 3.71Å; I147-I180 HydrophobicContact CD1-CD1 3.87Å
148L98.4Very high95.4Very high44 Ų4450 Ų5023%0.2325%0.252CS..Hα-helixtrans-64.2-36.4175.2-177.263.3000110.9A144 Q145 L146 F151 Q152 L177 M193A144-L148 WeakPolarHBondContact O-CB 3.33Å; A144-L148 PolarHBondContact O-N 2.9Å; Q145-L148 PolarHBondContact O-N 2.83Å; L146-L148 VanDerWaalsContact C-N 3.33Å; L148-F151 HydrophobicContact CD1-CD1 4.32Å; L148-F151 WeakPolarHBondContact O-CB 3.49Å; L148-F151 PolarHBondContact O-N 3.49Å; L148-Q152 WeakPolarHBondContact O-CB 3.28Å; L148-Q152 VanDerWaalsContact O-CG 3.28Å; L148-Q152 WeakPolarHBondContact O-CG 3.5Å; L148-Q152 PolarHBondContact O-N 3.14Å; L148-L177 HydrophobicContact CB-CD1 4.47Å; L148-L177 HydrophobicContact CB-CD2 4.26Å; L148-L177 HydrophobicContact CD1-CD1 4.03Å; L148-M193 HydrophobicContact CD1-SD 4.42Å
149R98.6Very high94.9Very high135 Ų13543.3 Ų43.351%0.50923%0.226SC..Hα-helixtrans-61.5-45.8173-179.757.9179.8171.92.1111.9Q145 L146 I147 F151 Q152 I153Q145-R149 PolarHBondContact O-N 2.9Å; L146-R149 WeakPolarHBondContact O-CB 3.29Å; L146-R149 PolarHBondContact O-N 3.03Å; I147-R149 VanDerWaalsContact C-N 3.28Å; I147-R149 PolarHBondContact O-N 3.32Å; R149-F151 VanDerWaalsContact C-N 3.3Å; R149-F151 PolarHBondContact O-N 3.38Å; R149-Q152 PolarHBondContact O-N 3.34Å; R149-I153 HydrophobicContact CG-CD1 4.15Å; R149-I153 WeakPolarHBondContact O-CD1 3.45Å; R149-I153 VanDerWaalsContact O-CG1 3.31Å; R149-I153 WeakPolarHBondContact O-CG1 3.49Å; R149-I153 PolarHBondContact O-N 3.11Å
150L98.7Very high93.7Very high0 Ų046 Ų460%026%0.259CS..Hα-helixtrans-57.8-44.7173.1-67.9171.3000111.4V88 V91 A92 L95 V108 A112 L146 I147 Q152 I153 C154 L173V88-L150 HydrophobicContact CG1-CD1 3.96Å; V91-L150 HydrophobicContact CG1-CD2 4.5Å; A92-L150 HydrophobicContact CB-CD2 3.58Å; A92-L150 HydrophobicContact CB-CG 4.43Å; L95-L150 HydrophobicContact CD2-CD2 4.06Å; V108-L150 HydrophobicContact CG1-CB 4.3Å; V108-L150 HydrophobicContact CG1-CD1 4.02Å; V108-L150 HydrophobicContact CG1-CD2 4.06Å; V108-L150 HydrophobicContact CG1-CG 4.36Å; A112-L150 HydrophobicContact CB-CD1 4.32Å; L146-L150 PolarHBondContact O-N 2.81Å; I147-L150 WeakPolarHBondContact O-CB 3.38Å; I147-L150 PolarHBondContact O-N 2.66Å; L150-Q152 VanDerWaalsContact C-N 3.34Å; L150-Q152 PolarHBondContact O-N 3.39Å; L150-I153 PolarHBondContact O-N 2.88Å; L150-C154 PolarHBondContact O-N 3.39Å; L150-C154 VanDerWaalsContact O-N 3.07Å; L150-L173 HydrophobicContact CB-CD1 3.87Å; L150-L173 HydrophobicContact CB-CD2 4.01Å; L150-L173 HydrophobicContact CD1-CD2 4.09Å
151F98.1Very high93Very high10 Ų1052 Ų524%0.04429%0.287CS..Hα-helixtrans-61-43.1178.5179-89000111.8I147 L148 R149 C154 A155 M170 L173 A174 L177 M193 A196 I197I147-F151 PolarHBondContact O-N 2.94Å; L148-F151 HydrophobicContact CD1-CD1 4.32Å; L148-F151 WeakPolarHBondContact O-CB 3.49Å; L148-F151 PolarHBondContact O-N 3.49Å; R149-F151 VanDerWaalsContact C-N 3.3Å; R149-F151 PolarHBondContact O-N 3.38Å; F151-C154 PolarHBondContact O-N 3.23Å; F151-A155 WeakPolarHBondContact O-CB 3.46Å; F151-A155 PolarHBondContact O-N 3.13Å; F151-M170 HydrophobicContact CD2-CB 4.15Å; F151-M170 HydrophobicContact CD2-CG 4.36Å; F151-M170 HydrophobicContact CE1-CE 3.94Å; F151-M170 HydrophobicContact CE2-CB 3.77Å; F151-M170 HydrophobicContact CE2-CE 3.75Å; F151-M170 HydrophobicContact CE2-CG 4.17Å; F151-M170 HydrophobicContact CZ-CE 3.37Å; F151-L173 HydrophobicContact CB-CB 4.27Å; F151-L173 HydrophobicContact CB-CD1 4.39Å; F151-L173 HydrophobicContact CD2-CB 4.17Å; F151-A174 HydrophobicContact CD2-CB 4.36Å; F151-A174 HydrophobicContact CE2-CB 3.97Å; F151-L177 HydrophobicContact CB-CD1 4.28Å; F151-L177 HydrophobicContact CG-CD1 4.41Å; F151-M193 HydrophobicContact CD1-CG 4.32Å; F151-M193 HydrophobicContact CE1-CB 4.28Å; F151-M193 HydrophobicContact CE1-CG 3.91Å; F151-M193 HydrophobicContact CE2-CB 4.42Å; F151-M193 HydrophobicContact CE2-CG 4.48Å; F151-M193 HydrophobicContact CZ-CB 3.91Å; F151-M193 HydrophobicContact CZ-CG 3.99Å; F151-A196 HydrophobicContact CE1-CB 4.17Å; F151-A196 HydrophobicContact CZ-CB 4.02Å; F151-I197 HydrophobicContact CE2-CD1 4.13Å; F151-I197 HydrophobicContact CE2-CG1 4.23Å; F151-I197 HydrophobicContact CZ-CG1 4.33Å
152Q97.3Very high92.4Very high94 Ų9450.5 Ų50.544%0.43928%0.282SS..Hα-helixtrans-64-41.2177.7-74.3170.9-13.300112.2L148 R149 L150 C154 A155 S156L148-Q152 WeakPolarHBondContact O-CB 3.28Å; L148-Q152 VanDerWaalsContact O-CG 3.28Å; L148-Q152 WeakPolarHBondContact O-CG 3.5Å; L148-Q152 PolarHBondContact O-N 3.14Å; R149-Q152 PolarHBondContact O-N 3.34Å; L150-Q152 VanDerWaalsContact C-N 3.34Å; L150-Q152 PolarHBondContact O-N 3.39Å; Q152-C154 VanDerWaalsContact C-N 3.35Å; Q152-A155 PolarHBondContact O-N 3.32Å; Q152-S156 WeakPolarHBondContact O-CB 3.47Å; Q152-S156 PolarHBondContact O-N 3.28Å; Q152-S156 PolarHBondContact O-OG 3.35Å; Q152-S156 VanDerWaalsContact O-OG 3.12Å
153I96.6Very high91.9Very high11 Ų1153.2 Ų53.26%0.05629%0.293CS..Hα-helixtrans-60.1-47.1175.5-65.4157.9000110.1A92 L95 S96 R149 L150 A155 S156A92-I153 HydrophobicContact CB-CD1 3.99Å; A92-I153 WeakPolarHBondContact O-CD1 3.22Å; L95-I153 HydrophobicContact CD2-CB 4.21Å; L95-I153 HydrophobicContact CD2-CG2 3.85Å; L95-I153 HydrophobicContact CG-CG2 3.78Å; S96-I153 WeakPolarHBondContact OG-CD1 2.9Å; R149-I153 HydrophobicContact CG-CD1 4.15Å; R149-I153 WeakPolarHBondContact O-CD1 3.45Å; R149-I153 VanDerWaalsContact O-CG1 3.31Å; R149-I153 WeakPolarHBondContact O-CG1 3.49Å; R149-I153 PolarHBondContact O-N 3.11Å; L150-I153 PolarHBondContact O-N 2.88Å; I153-A155 VanDerWaalsContact C-N 3.34Å; I153-A155 PolarHBondContact O-N 3.04Å; I153-S156 PolarHBondContact O-N 3.22Å; I153-S156 PolarHBondContact O-OG 2.86Å
154C95.4Very high91.3Very high0 Ų056.4 Ų56.40%031%0.31CS..Hα-helixtrans-60.9-40.9174.5-73.10000112.8L150 F151 Q152 D157 K166 K167 M170L150-C154 PolarHBondContact O-N 3.39Å; L150-C154 VanDerWaalsContact O-N 3.07Å; F151-C154 PolarHBondContact O-N 3.23Å; Q152-C154 VanDerWaalsContact C-N 3.35Å; C154-D157 WeakPolarHBondContact O-CB 3.48Å; C154-D157 PolarHBondContact O-N 3.1Å; C154-K166 HydrophobicContact CB-CB 4.33Å; C154-K166 VanDerWaalsContact CB-O 3.28Å; C154-K166 WeakPolarHBondContact CB-O 3.35Å; C154-K166 PolarHBondContact SG-O 3.42Å; C154-K167 WeakPolarHBondContact O-CG 3.08Å; C154-M170 HydrophobicContact CB-CG 3.64Å
155A93.5Very high91Very high37 Ų3756.4 Ų56.431%0.30631%0.31SS..Hα-helixtrans-68.7-34.1-178.700000113F151 Q152 I153 D157 M170F151-A155 WeakPolarHBondContact O-CB 3.46Å; F151-A155 PolarHBondContact O-N 3.13Å; Q152-A155 PolarHBondContact O-N 3.32Å; I153-A155 VanDerWaalsContact C-N 3.34Å; I153-A155 PolarHBondContact O-N 3.04Å; A155-D157 PolarHBondContact O-N 3.15Å; A155-M170 VanDerWaalsContact CA-SD 3.55Å; A155-M170 HydrophobicContact CB-CE 3.63Å; A155-M170 HydrophobicContact CB-SD 3.92Å
156S92.3Very high90.8Very high89 Ų8950.9 Ų50.962%0.62228%0.284SS*.THydrogen-bonded Turntrans-75.2-3.417858.40000114.3Q152 I153 S158Q152-S156 WeakPolarHBondContact O-CB 3.47Å; Q152-S156 PolarHBondContact O-N 3.28Å; Q152-S156 PolarHBondContact O-OG 3.35Å; Q152-S156 VanDerWaalsContact O-OG 3.12Å; I153-S156 PolarHBondContact O-N 3.22Å; I153-S156 PolarHBondContact O-OG 2.86Å; S156-S158 PolarHBondContact O-N 2.92Å
157D90.5Very high90.6Very high14 Ų1452.3 Ų52.38%0.07529%0.289CS..  trans-67.9116.9-177.4-165.951.8000111.4C154 A155 R159 S165 K166 K167C154-D157 WeakPolarHBondContact O-CB 3.48Å; C154-D157 PolarHBondContact O-N 3.1Å; A155-D157 PolarHBondContact O-N 3.15Å; D157-R159 VanDerWaalsContact CG-NH1 3.32Å; D157-R159 IonicContact OD1-CZ 2.75Å; D157-R159 VanDerWaalsContact OD1-CZ 3.3Å; D157-R159 IonicContact OD1-NE 3.81Å; D157-R159 IonicContact OD1-NH1 3.55Å; D157-R159 PolarHBondContact OD1-NH1 2.94Å; D157-R159 IonicContact OD2-CZ 3.73Å; D157-R159 IonicContact OD2-NH1 3.85Å; D157-R159 PolarHBondContact OD2-NH1 3.38Å; D157-S165 WeakPolarHBondContact OD2-CA 3.43Å; D157-S165 WeakPolarHBondContact OD2-CB 3.42Å; D157-S165 PolarHBondContact OD2-OG 3.33Å; D157-K166 HydrophobicContact CB-CB 3.98Å; D157-K166 PolarHBondContact OD2-N 3.17Å; D157-K167 HydrophobicContact CB-CG 4.48Å; D157-K167 WeakPolarHBondContact O-CE 3.36Å; D157-K167 PolarHBondContact O-NZ 2.81Å
158S83Confident90.4Very high115 Ų11554.1 Ų54.180%0.80430%0.299SS*.  trans-94.79.5-172.960.90000114S156S156-S158 PolarHBondContact O-N 2.92Å
159R78.4Confident90.3Very high36 Ų3652.5 Ų52.514%0.13629%0.293CS..  trans-63.6143.3-178.5-62.1-172.9-167.1117.5-13.5111.6L98 D100 D101 D157 D164 K166L98-R159 PolarHBondContact O-NH2 2.96Å; D100-R159 VanDerWaalsContact CA-NE 3.28Å; D100-R159 IonicContact OD1-NE 2.83Å; D101-R159 PolarHBondContact O-NH1 3.4Å; D101-R159 PolarHBondContact O-NH2 3.26Å; D157-R159 VanDerWaalsContact CG-NH1 3.32Å; D157-R159 IonicContact OD1-CZ 2.75Å; D157-R159 VanDerWaalsContact OD1-CZ 3.3Å; D157-R159 IonicContact OD1-NE 3.81Å; D157-R159 IonicContact OD1-NH1 3.55Å; D157-R159 PolarHBondContact OD1-NH1 2.94Å; D157-R159 IonicContact OD2-CZ 3.73Å; D157-R159 IonicContact OD2-NH1 3.85Å; D157-R159 PolarHBondContact OD2-NH1 3.38Å; R159-D164 PolarHBondContact NH1-O 2.93Å; R159-K166 VanDerWaalsContact NH2-CE 3.31Å
160A68.7Low90.2Very high103 Ų10346.1 Ų46.185%0.85127%0.269SS*.SBendtrans-78.5-40.8-17700000112.5
161Q79.9Confident90.1Very high125 Ų12546.2 Ų46.258%0.58427%0.269SS*.  trans-81.5130.9176.7-70-175.4-41.500110.2E163 S165Q161-E163 VanDerWaalsContact C-N 3.32Å; Q161-S165 PolarHBondContact O-N 3.21Å
162V82.7Confident90.1Very high39 Ų3945.7 Ų45.724%0.23627%0.267CS..SBendtrans-73-33.9-175.8174.50000110.1D164 S165 L168 I202V162-D164 VanDerWaalsContact C-N 3.31Å; V162-D164 PolarHBondContact O-N 3.15Å; V162-S165 WeakPolarHBondContact O-CB 3.48Å; V162-S165 PolarHBondContact O-N 3.29Å; V162-S165 VanDerWaalsContact O-N 3.1Å; V162-L168 HydrophobicContact CG1-CD2 4.03Å; V162-L168 WeakPolarHBondContact O-CD1 3.27Å; V162-L168 WeakPolarHBondContact O-CG 3.22Å; V162-I202 HydrophobicContact CB-CG2 4.48Å; V162-I202 HydrophobicContact CG1-CB 4.09Å; V162-I202 HydrophobicContact CG1-CD1 3.84Å; V162-I202 HydrophobicContact CG1-CG2 3.78Å; V162-I202 HydrophobicContact CG2-CG2 3.82Å
163E84.8Confident90.2Very high111 Ų11141.3 Ų41.352%0.51925%0.246SC..THydrogen-bonded Turntrans-61.1-37.4-176.1-63.874.1-163.200112.2N102 Q161 H205N102-E163 PolarHBondContact ND2-O 2.81Å; Q161-E163 VanDerWaalsContact C-N 3.32Å; E163-H205 IonicContact OE1-NE2 3.23Å
164D86.1Confident90.2Very high67 Ų6740.8 Ų40.836%0.35824%0.244SC..THydrogen-bonded Turntrans-98.33.1179-57.5-42.1000112.7N102 R159 V162N102-D164 WeakPolarHBondContact ND2-CA 3.29Å; R159-D164 PolarHBondContact NH1-O 2.93Å; V162-D164 VanDerWaalsContact C-N 3.31Å; V162-D164 PolarHBondContact O-N 3.15Å
165S92.3Very high90.4Very high2 Ų241 Ų411%0.01425%0.245CC..  trans-80.1140.2-177-174.50000112N102 D157 Q161 V162 K167 L168N102-S165 PolarHBondContact ND2-N 2.76Å; N102-S165 PolarHBondContact ND2-O 2.98Å; D157-S165 WeakPolarHBondContact OD2-CA 3.43Å; D157-S165 WeakPolarHBondContact OD2-CB 3.42Å; D157-S165 PolarHBondContact OD2-OG 3.33Å; Q161-S165 PolarHBondContact O-N 3.21Å; V162-S165 WeakPolarHBondContact O-CB 3.48Å; V162-S165 PolarHBondContact O-N 3.29Å; V162-S165 VanDerWaalsContact O-N 3.1Å; S165-K167 PolarHBondContact O-N 3.39Å; S165-K167 WeakPolarHBondContact OG-CB 3.48Å; S165-K167 WeakPolarHBondContact OG-CG 2.86Å; S165-K167 PolarHBondContact OG-N 3.1Å; S165-K167 VanDerWaalsContact OG-N 3.1Å; S165-L168 PolarHBondContact O-N 3.3Å
166K94.6Very high90.6Very high13 Ų1339.6 Ų39.66%0.05723%0.232CC..G310 helixtrans-67-14.3168.6-68.5164.4-167.91710112.2L95 L98 N102 L105 C154 D157 R159 L168 G169L95-K166 HydrophobicContact CD1-CD 3.79Å; L95-K166 HydrophobicContact CD1-CG 3.95Å; L95-K166 HydrophobicContact CG-CD 4.34Å; L95-K166 VanDerWaalsContact O-CE 3.25Å; L95-K166 WeakPolarHBondContact O-CE 3.29Å; L95-K166 PolarHBondContact O-NZ 3.27Å; L98-K166 VanDerWaalsContact O-CE 3.24Å; L98-K166 WeakPolarHBondContact O-CE 3.28Å; L98-K166 PolarHBondContact O-NZ 3.36Å; N102-K166 HydrophobicContact CB-CG 4.48Å; L105-K166 HydrophobicContact CD2-CB 4.45Å; C154-K166 HydrophobicContact CB-CB 4.33Å; C154-K166 VanDerWaalsContact CB-O 3.28Å; C154-K166 WeakPolarHBondContact CB-O 3.35Å; C154-K166 PolarHBondContact SG-O 3.42Å; D157-K166 HydrophobicContact CB-CB 3.98Å; D157-K166 PolarHBondContact OD2-N 3.17Å; R159-K166 VanDerWaalsContact NH2-CE 3.31Å; K166-L168 PolarHBondContact O-N 3.12Å; K166-L168 VanDerWaalsContact O-N 3.14Å; K166-G169 PolarHBondContact O-N 3.31Å
167K94.7Very high90.9Very high54 Ų5435.3 Ų35.324%0.23520%0.202CC..G310 helixtrans-56.6-26.3174.7-73.9166.7167.5161.60112.4C154 D157 S165 G169 M170 L200 I202C154-K167 WeakPolarHBondContact O-CG 3.08Å; D157-K167 HydrophobicContact CB-CG 4.48Å; D157-K167 WeakPolarHBondContact O-CE 3.36Å; D157-K167 PolarHBondContact O-NZ 2.81Å; S165-K167 PolarHBondContact O-N 3.39Å; S165-K167 WeakPolarHBondContact OG-CB 3.48Å; S165-K167 WeakPolarHBondContact OG-CG 2.86Å; S165-K167 PolarHBondContact OG-N 3.1Å; S165-K167 VanDerWaalsContact OG-N 3.1Å; K167-G169 PolarHBondContact O-N 3.31Å; K167-G169 VanDerWaalsContact O-N 3.15Å; K167-M170 HydrophobicContact CB-SD 4.13Å; K167-M170 HydrophobicContact CG-SD 3.95Å; K167-M170 VanDerWaalsContact O-CB 3.29Å; K167-M170 WeakPolarHBondContact O-CB 3.38Å; K167-M170 WeakPolarHBondContact O-CG 3.2Å; K167-M170 PolarHBondContact O-N 2.89Å; K167-L200 HydrophobicContact CB-CD1 4.48Å; K167-L200 HydrophobicContact CB-CD2 4.48Å; K167-L200 HydrophobicContact CD-CD2 3.85Å; K167-L200 HydrophobicContact CG-CD2 4.12Å; K167-I202 HydrophobicContact CB-CD1 4.17Å
168L94.3Very high91.3Very high37 Ų3734.7 Ų34.719%0.19420%0.199CC..G310 helixtrans-60.7-20.3172.9-62.7-177.1000113.7L105 V162 S165 K166 I202 H205 F206L105-L168 HydrophobicContact CD1-CB 3.78Å; V162-L168 HydrophobicContact CG1-CD2 4.03Å; V162-L168 WeakPolarHBondContact O-CD1 3.27Å; V162-L168 WeakPolarHBondContact O-CG 3.22Å; S165-L168 PolarHBondContact O-N 3.3Å; K166-L168 PolarHBondContact O-N 3.12Å; K166-L168 VanDerWaalsContact O-N 3.14Å; L168-I202 HydrophobicContact CD2-CD1 4.26Å; L168-H205 HydrophobicContact CD2-CB 3.55Å; L168-F206 WeakPolarHBondContact O-CE1 3.44Å
169G95.3Very high92Very high11 Ų1132.5 Ų32.511%0.11318%0.175CC..G310 helixtrans-79-19.3174.100000114.6K166 K167 M171 G172 L173K166-G169 PolarHBondContact O-N 3.31Å; K167-G169 PolarHBondContact O-N 3.31Å; K167-G169 VanDerWaalsContact O-N 3.15Å; G169-M171 PolarHBondContact O-N 3.05Å; G169-G172 PolarHBondContact O-N 3.28Å; G169-L173 WeakPolarHBondContact O-CG 3.49Å; G169-L173 PolarHBondContact O-N 3.45Å
170M97Very high92.9Very high1 Ų130.8 Ų30.81%0.00517%0.168CC..Hα-helixtrans-63.2-46.1-166-71.8178.764.800113.2F151 C154 A155 K167 G172 L173 A174 A196 I197 L200F151-M170 HydrophobicContact CD2-CB 4.15Å; F151-M170 HydrophobicContact CD2-CG 4.36Å; F151-M170 HydrophobicContact CE1-CE 3.94Å; F151-M170 HydrophobicContact CE2-CB 3.77Å; F151-M170 HydrophobicContact CE2-CE 3.75Å; F151-M170 HydrophobicContact CE2-CG 4.17Å; F151-M170 HydrophobicContact CZ-CE 3.37Å; C154-M170 HydrophobicContact CB-CG 3.64Å; A155-M170 VanDerWaalsContact CA-SD 3.55Å; A155-M170 HydrophobicContact CB-CE 3.63Å; A155-M170 HydrophobicContact CB-SD 3.92Å; K167-M170 HydrophobicContact CB-SD 4.13Å; K167-M170 HydrophobicContact CG-SD 3.95Å; K167-M170 VanDerWaalsContact O-CB 3.29Å; K167-M170 WeakPolarHBondContact O-CB 3.38Å; K167-M170 WeakPolarHBondContact O-CG 3.2Å; K167-M170 PolarHBondContact O-N 2.89Å; M170-G172 VanDerWaalsContact C-N 3.33Å; M170-G172 PolarHBondContact O-N 2.89Å; M170-L173 PolarHBondContact O-N 2.9Å; M170-A174 WeakPolarHBondContact O-CB 3.36Å; M170-A174 PolarHBondContact O-N 3.41Å; M170-A196 HydrophobicContact CE-CB 4.14Å; M170-I197 HydrophobicContact CB-CG1 4.45Å; M170-I197 HydrophobicContact CE-CG1 4.44Å; M170-L200 HydrophobicContact CB-CD1 4.47Å; M170-L200 HydrophobicContact CE-CD1 4.04Å; M170-L200 HydrophobicContact SD-CD1 3.65Å; M170-L200 HydrophobicContact SD-CD2 4.18Å; M170-L200 HydrophobicContact SD-CG 4.44Å
171M96.8Very high94.2Very high1 Ų126.4 Ų26.41%0.00513%0.13CC..Hα-helixtrans-65.2-38.8-178-171.1176.3-7600111.8G169 L173 A174 N175 I197 F206 Q210 R211 Y214G169-M171 PolarHBondContact O-N 3.05Å; M171-L173 VanDerWaalsContact C-N 3.32Å; M171-L173 PolarHBondContact O-N 2.96Å; M171-A174 PolarHBondContact O-N 3.05Å; M171-N175 WeakPolarHBondContact O-CB 3.49Å; M171-N175 PolarHBondContact O-N 3.41Å; M171-N175 PolarHBondContact O-ND2 3.27Å; M171-I197 HydrophobicContact CE-CG2 4.07Å; M171-F206 HydrophobicContact CB-CD1 3.45Å; M171-F206 VanDerWaalsContact CB-CD1 3.45Å; M171-F206 HydrophobicContact CB-CD2 4.22Å; M171-F206 HydrophobicContact CB-CE1 3.53Å; M171-F206 HydrophobicContact CB-CE2 4.3Å; M171-F206 HydrophobicContact CB-CG 3.81Å; M171-F206 HydrophobicContact CB-CZ 3.98Å; M171-F206 HydrophobicContact CE-CB 4.15Å; M171-F206 HydrophobicContact CE-CD2 3.4Å; M171-F206 VanDerWaalsContact CE-CD2 3.4Å; M171-F206 HydrophobicContact CE-CE2 3.88Å; M171-F206 HydrophobicContact CE-CG 3.83Å; M171-F206 HydrophobicContact CG-CD1 4.44Å; M171-F206 HydrophobicContact CG-CG 4.38Å; M171-F206 HydrophobicContact SD-CB 3.6Å; M171-F206 HydrophobicContact SD-CD1 4.31Å; M171-F206 HydrophobicContact SD-CD2 3.96Å; M171-F206 HydrophobicContact SD-CG 3.7Å; M171-Q210 HydrophobicContact CG-CB 4.02Å; M171-Q210 VanDerWaalsContact SD-C 3.56Å; M171-Q210 HydrophobicContact SD-CB 3.78Å; M171-R211 HydrophobicContact CE-CG 4.27Å; M171-R211 HydrophobicContact SD-CB 4.36Å; M171-R211 HydrophobicContact SD-CG 3.84Å; M171-Y214 HydrophobicContact CE-CD1 4.19Å; M171-Y214 HydrophobicContact CE-CG 4.13Å; M171-Y214 HydrophobicContact CG-CD2 4.3Å; M171-Y214 HydrophobicContact CG-CG 4.3Å; M171-Y214 HydrophobicContact SD-CG 4.41Å
172G97.5Very high94.9Very high0 Ų022 Ų220%011%0.109CC..Hα-helixtrans-60.5-41.717600000112.6H109 G169 M170 Q176H109-G172 VanDerWaalsContact CE1-CA 3.48Å; H109-G172 WeakPolarHBondContact CE1-CA 3.38Å; G169-G172 PolarHBondContact O-N 3.28Å; M170-G172 VanDerWaalsContact C-N 3.33Å; M170-G172 PolarHBondContact O-N 2.89Å; G172-Q176 WeakPolarHBondContact O-CG 3.49Å; G172-Q176 PolarHBondContact O-N 3.38Å; G172-Q176 PolarHBondContact O-NE2 3.25Å
173L98.7Very high95.3Very high1 Ų124.5 Ų24.51%0.00512%0.118CC..Hα-helixtrans-72.8-45.1177.7-68.2167.5000112.1V108 A112 I147 L150 F151 G169 M170 M171 N175 Q176 L177V108-L173 HydrophobicContact CG1-CD1 4.13Å; V108-L173 HydrophobicContact CG1-CD2 4.09Å; A112-L173 HydrophobicContact CB-CD2 3.63Å; I147-L173 HydrophobicContact CG2-CB 4.38Å; I147-L173 HydrophobicContact CG2-CD2 4.01Å; L150-L173 HydrophobicContact CB-CD1 3.87Å; L150-L173 HydrophobicContact CB-CD2 4.01Å; L150-L173 HydrophobicContact CD1-CD2 4.09Å; F151-L173 HydrophobicContact CB-CB 4.27Å; F151-L173 HydrophobicContact CB-CD1 4.39Å; F151-L173 HydrophobicContact CD2-CB 4.17Å; G169-L173 WeakPolarHBondContact O-CG 3.49Å; G169-L173 PolarHBondContact O-N 3.45Å; M170-L173 PolarHBondContact O-N 2.9Å; M171-L173 VanDerWaalsContact C-N 3.32Å; M171-L173 PolarHBondContact O-N 2.96Å; L173-N175 VanDerWaalsContact C-N 3.26Å; L173-N175 PolarHBondContact O-N 3.37Å; L173-Q176 WeakPolarHBondContact O-CA 3.43Å; L173-Q176 WeakPolarHBondContact O-CB 3.48Å; L173-Q176 PolarHBondContact O-N 2.9Å; L173-L177 PolarHBondContact O-N 3.21Å
174A98.4Very high95.7Very high0 Ų020.8 Ų20.80%010%0.102CC..Hα-helixtrans-57.8-39.4174.900000111.9F151 M170 M171 Q176 L177 F178 I197F151-A174 HydrophobicContact CD2-CB 4.36Å; F151-A174 HydrophobicContact CE2-CB 3.97Å; M170-A174 WeakPolarHBondContact O-CB 3.36Å; M170-A174 PolarHBondContact O-N 3.41Å; M171-A174 PolarHBondContact O-N 3.05Å; A174-Q176 VanDerWaalsContact C-N 3.27Å; A174-Q176 PolarHBondContact O-N 3.17Å; A174-L177 CarbonylContact O-C 3.6Å; A174-L177 WeakPolarHBondContact O-CB 3.34Å; A174-L177 PolarHBondContact O-N 3.35Å; A174-L177 VanDerWaalsContact O-N 3.15Å; A174-F178 HydrophobicContact CB-CE2 4.41Å; A174-F178 HydrophobicContact CB-CZ 4.45Å; A174-F178 WeakPolarHBondContact O-CD2 3.31Å; A174-F178 VanDerWaalsContact O-CG 3.23Å; A174-F178 WeakPolarHBondContact O-CG 3.27Å; A174-F178 PolarHBondContact O-N 3.35Å; A174-I197 HydrophobicContact CB-CD1 3.32Å
175N98.6Very high95.9Very high5 Ų523.6 Ų23.63%0.02712%0.117CC..Hα-helixtrans-62.4-31.3174.3-76.8-27.2000113.4M171 L173 K179 Q210 T213 Y214M171-N175 WeakPolarHBondContact O-CB 3.49Å; M171-N175 PolarHBondContact O-N 3.41Å; M171-N175 PolarHBondContact O-ND2 3.27Å; L173-N175 VanDerWaalsContact C-N 3.26Å; L173-N175 PolarHBondContact O-N 3.37Å; N175-K179 WeakPolarHBondContact O-CD 3.11Å; N175-K179 WeakPolarHBondContact O-CG 3.34Å; N175-K179 PolarHBondContact O-N 3.4Å; N175-Q210 PolarHBondContact ND2-O 2.96Å; N175-T213 HydrophobicContact CB-CG2 3.97Å; N175-Y214 WeakPolarHBondContact OD1-CA 3.33Å; N175-Y214 PolarHBondContact OD1-N 3.31Å; N175-Y214 VanDerWaalsContact OD1-N 3.11Å
176Q98.6Very high95.9Very high7 Ų727.2 Ų27.23%0.03313%0.132CC..Hα-helixtrans-74.7-41.3172.3-51.6-41.4-52.700111A112 I113 I147 G172 L173 A174 F178 K179 I180A112-Q176 HydrophobicContact CB-CG 4.37Å; I113-Q176 HydrophobicContact CG1-CG 4.27Å; I147-Q176 HydrophobicContact CD1-CB 4.16Å; I147-Q176 HydrophobicContact CG2-CB 4.35Å; G172-Q176 WeakPolarHBondContact O-CG 3.49Å; G172-Q176 PolarHBondContact O-N 3.38Å; G172-Q176 PolarHBondContact O-NE2 3.25Å; L173-Q176 WeakPolarHBondContact O-CA 3.43Å; L173-Q176 WeakPolarHBondContact O-CB 3.48Å; L173-Q176 PolarHBondContact O-N 2.9Å; A174-Q176 VanDerWaalsContact C-N 3.27Å; A174-Q176 PolarHBondContact O-N 3.17Å; Q176-F178 PolarHBondContact O-N 2.87Å; Q176-K179 WeakPolarHBondContact O-CB 3.47Å; Q176-K179 PolarHBondContact O-N 3.15Å; Q176-I180 WeakPolarHBondContact O-CG1 3.25Å; Q176-I180 PolarHBondContact O-N 3.23Å; Q176-I180 VanDerWaalsContact O-N 3.12Å
177L98.6Very high95.8Very high0 Ų027.3 Ų27.30%013%0.133CC..Hα-helixtrans-59.9-44.4175.6-69.7173000111.9A144 I147 L148 F151 L173 A174 K179 I180 Y181 M193A144-L177 HydrophobicContact CB-CD2 4.25Å; A144-L177 WeakPolarHBondContact O-CD2 3.3Å; I147-L177 HydrophobicContact CB-CD2 3.86Å; I147-L177 HydrophobicContact CB-CG 4.42Å; I147-L177 HydrophobicContact CG2-CD1 4.41Å; I147-L177 HydrophobicContact CG2-CD2 3.72Å; I147-L177 HydrophobicContact CG2-CG 3.71Å; L148-L177 HydrophobicContact CB-CD1 4.47Å; L148-L177 HydrophobicContact CB-CD2 4.26Å; L148-L177 HydrophobicContact CD1-CD1 4.03Å; F151-L177 HydrophobicContact CB-CD1 4.28Å; F151-L177 HydrophobicContact CG-CD1 4.41Å; L173-L177 PolarHBondContact O-N 3.21Å; A174-L177 CarbonylContact O-C 3.6Å; A174-L177 WeakPolarHBondContact O-CB 3.34Å; A174-L177 PolarHBondContact O-N 3.35Å; A174-L177 VanDerWaalsContact O-N 3.15Å; L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 3.31Å; L177-I180 WeakPolarHBondContact O-CB 3.39Å; L177-I180 PolarHBondContact O-N 2.91Å; L177-I180 VanDerWaalsContact O-N 3.09Å; L177-Y181 HydrophobicContact CB-CD2 4.14Å; L177-Y181 HydrophobicContact CB-CE2 3.8Å; L177-Y181 HydrophobicContact CD2-CE2 4.17Å; L177-Y181 HydrophobicContact CG-CE2 4.43Å; L177-Y181 VanDerWaalsContact O-CD2 3.27Å; L177-Y181 WeakPolarHBondContact O-CD2 3.48Å; L177-Y181 PolarHBondContact O-N 2.73Å; L177-M193 HydrophobicContact CB-CE 4.41Å; L177-M193 HydrophobicContact CD1-CG 4.13Å
178F98.5Very high95.7Very high0 Ų030.4 Ų30.40%015%0.152CC..Hα-helixtrans-59.9-43.3175.9-64.7-29000111.9A174 Q176 I180 Y181 F182 C190 M193 I194 Y214 Y217 V218A174-F178 HydrophobicContact CB-CE2 4.41Å; A174-F178 HydrophobicContact CB-CZ 4.45Å; A174-F178 WeakPolarHBondContact O-CD2 3.31Å; A174-F178 VanDerWaalsContact O-CG 3.23Å; A174-F178 WeakPolarHBondContact O-CG 3.27Å; A174-F178 PolarHBondContact O-N 3.35Å; Q176-F178 PolarHBondContact O-N 2.87Å; F178-I180 PolarHBondContact O-N 2.93Å; F178-Y181 PolarHBondContact O-N 3.49Å; F178-F182 HydrophobicContact CB-CD2 4.36Å; F178-F182 WeakPolarHBondContact O-CB 3.11Å; F178-F182 VanDerWaalsContact O-CD2 3.27Å; F178-F182 WeakPolarHBondContact O-CD2 3.36Å; F178-F182 PolarHBondContact O-N 3.03Å; F178-C190 HydrophobicContact CD1-CB 4.1Å; F178-C190 HydrophobicContact CE1-CB 3.86Å; F178-M193 HydrophobicContact CD1-CE 4.42Å; F178-M193 HydrophobicContact CE1-CE 4.13Å; F178-I194 HydrophobicContact CE1-CG1 4.06Å; F178-I194 HydrophobicContact CZ-CD1 4.39Å; F178-I194 HydrophobicContact CZ-CG1 3.68Å; F178-Y214 AromaticContact CE2-CD2 3.57Å; F178-Y214 HydrophobicContact CE2-CD2 3.57Å; F178-Y214 AromaticContact CE2-CE2 3.79Å; F178-Y214 HydrophobicContact CE2-CE2 3.79Å; F178-Y214 HydrophobicContact CZ-CD2 4.22Å; F178-Y214 AromaticContact CZ-CE2 3.96Å; F178-Y214 HydrophobicContact CZ-CE2 3.96Å; F178-Y217 HydrophobicContact CB-CD1 3.84Å; F178-Y217 HydrophobicContact CB-CD2 3.64Å; F178-Y217 HydrophobicContact CB-CE1 4.34Å; F178-Y217 HydrophobicContact CB-CE2 4.2Å; F178-Y217 HydrophobicContact CB-CG 3.47Å; F178-Y217 VanDerWaalsContact CB-CG 3.47Å; F178-Y217 VanDerWaalsContact CD2-CB 3.43Å; F178-Y217 AromaticContact CD2-CD2 3.95Å; F178-Y217 HydrophobicContact CD2-CD2 3.95Å; F178-Y217 AromaticContact CD2-CG 3.9Å; F178-Y217 HydrophobicContact CD2-CG 3.9Å; F178-Y217 HydrophobicContact CG-CD2 4.27Å; F178-Y217 HydrophobicContact CG-CG 4Å; F178-V218 HydrophobicContact CE2-CG2 4.45Å
179K97.9Very high95.7Very high69 Ų6932.1 Ų32.130%0.316%0.161SC..Hα-helixtrans-58.3-37.6175.3-73.8170.9-174.9-174.20112.1N175 Q176 L177 Q183 Y217N175-K179 WeakPolarHBondContact O-CD 3.11Å; N175-K179 WeakPolarHBondContact O-CG 3.34Å; N175-K179 PolarHBondContact O-N 3.4Å; Q176-K179 WeakPolarHBondContact O-CB 3.47Å; Q176-K179 PolarHBondContact O-N 3.15Å; L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 3.31Å; K179-Q183 WeakPolarHBondContact O-CB 3.27Å; K179-Q183 PolarHBondContact O-N 2.97Å; K179-Y217 HydrophobicContact CG-CE2 3.84Å; K179-Y217 WeakPolarHBondContact CG-OH 3.41Å
180I97Very high95.7Very high0 Ų031.6 Ų31.60%016%0.156CC..Hα-helixtrans-69.7-56174.7-61.9168.7000110.7R116 M140 A143 A144 I147 Q176 L177 F178 F182 Q183 I184R116-I180 HydrophobicContact CB-CD1 4.49Å; R116-I180 HydrophobicContact CG-CD1 4.04Å; R116-I180 HydrophobicContact CG-CG1 3.73Å; M140-I180 HydrophobicContact CB-CG2 4.1Å; M140-I180 HydrophobicContact CE-CB 3.97Å; M140-I180 HydrophobicContact CE-CG1 3.63Å; M140-I180 HydrophobicContact CE-CG2 3.98Å; M140-I180 WeakPolarHBondContact O-CG2 3.35Å; M140-I180 HydrophobicContact SD-CG1 4.22Å; A143-I180 HydrophobicContact CB-CD1 4.27Å; A144-I180 HydrophobicContact CB-CB 4.48Å; A144-I180 HydrophobicContact CB-CD1 3.99Å; A144-I180 HydrophobicContact CB-CG2 3.87Å; I147-I180 HydrophobicContact CD1-CD1 3.87Å; Q176-I180 WeakPolarHBondContact O-CG1 3.25Å; Q176-I180 PolarHBondContact O-N 3.23Å; Q176-I180 VanDerWaalsContact O-N 3.12Å; L177-I180 WeakPolarHBondContact O-CB 3.39Å; L177-I180 PolarHBondContact O-N 2.91Å; L177-I180 VanDerWaalsContact O-N 3.09Å; F178-I180 PolarHBondContact O-N 2.93Å; I180-F182 VanDerWaalsContact C-N 3.32Å; I180-F182 PolarHBondContact O-N 2.79Å; I180-Q183 WeakPolarHBondContact O-CA 3.49Å; I180-Q183 WeakPolarHBondContact O-CB 3.36Å; I180-Q183 PolarHBondContact O-N 3.31Å; I180-I184 HydrophobicContact CG2-CD1 4.07Å; I180-I184 HydrophobicContact CG2-CG1 4.34Å; I180-I184 HydrophobicContact CG2-CG2 4.46Å; I180-I184 WeakPolarHBondContact O-CG1 3.22Å; I180-I184 PolarHBondContact O-N 3.49Å
181Y96Very high95.5Very high12 Ų1239 Ų395%0.04719%0.188CC..Hα-helixtrans-64.4-33-172.6-63.9-35000114A144 L177 F178 I184 N185 K186 L189 M193A144-Y181 HydrophobicContact CB-CE1 3.72Å; L177-Y181 HydrophobicContact CB-CD2 4.14Å; L177-Y181 HydrophobicContact CB-CE2 3.8Å; L177-Y181 HydrophobicContact CD2-CE2 4.17Å; L177-Y181 HydrophobicContact CG-CE2 4.43Å; L177-Y181 VanDerWaalsContact O-CD2 3.27Å; L177-Y181 WeakPolarHBondContact O-CD2 3.48Å; L177-Y181 PolarHBondContact O-N 2.73Å; F178-Y181 PolarHBondContact O-N 3.49Å; Y181-I184 HydrophobicContact CD1-CD1 4.18Å; Y181-N185 PolarHBondContact O-N 2.85Å; Y181-N185 VanDerWaalsContact O-N 3.14Å; Y181-K186 PolarHBondContact O-N 3.11Å; Y181-L189 HydrophobicContact CD1-CB 4.26Å; Y181-L189 HydrophobicContact CD1-CD1 3.82Å; Y181-L189 HydrophobicContact CD2-CB 4.01Å; Y181-L189 HydrophobicContact CE1-CB 4.2Å; Y181-L189 HydrophobicContact CE1-CD1 3.49Å; Y181-L189 VanDerWaalsContact CE1-CD1 3.49Å; Y181-L189 HydrophobicContact CE1-CG 4.5Å; Y181-L189 HydrophobicContact CE2-CB 3.94Å; Y181-L189 HydrophobicContact CG-CB 4.18Å; Y181-M193 HydrophobicContact CD2-CE 3.66Å; Y181-M193 HydrophobicContact CE2-CE 3.34Å; Y181-M193 HydrophobicContact CE2-SD 4.29Å
182F94.3Very high95.3Very high33 Ų3341.8 Ų41.815%0.14521%0.207CC..Hα-helixtrans-70.1-33.6170.6-85-96.8000112.4F178 I180 L187 Y217 R220 K221F178-F182 HydrophobicContact CB-CD2 4.36Å; F178-F182 WeakPolarHBondContact O-CB 3.11Å; F178-F182 VanDerWaalsContact O-CD2 3.27Å; F178-F182 WeakPolarHBondContact O-CD2 3.36Å; F178-F182 PolarHBondContact O-N 3.03Å; I180-F182 VanDerWaalsContact C-N 3.32Å; I180-F182 PolarHBondContact O-N 2.79Å; F182-L187 HydrophobicContact CB-CD2 4.21Å; F182-L187 HydrophobicContact CD1-CD2 3.44Å; F182-L187 VanDerWaalsContact CD1-CD2 3.44Å; F182-L187 HydrophobicContact CD2-CD2 3.73Å; F182-L187 HydrophobicContact CE1-CD1 4.46Å; F182-L187 HydrophobicContact CE1-CD2 3.61Å; F182-L187 HydrophobicContact CE2-CD2 3.9Å; F182-L187 HydrophobicContact CG-CD2 3.53Å; F182-L187 HydrophobicContact CZ-CD2 3.85Å; F182-Y217 HydrophobicContact CB-CE1 4.24Å; F182-Y217 HydrophobicContact CD1-CD1 4.39Å; F182-Y217 AromaticContact CD2-CD1 3.41Å; F182-Y217 HydrophobicContact CD2-CD1 3.41Å; F182-Y217 VanDerWaalsContact CD2-CD1 3.41Å; F182-Y217 AromaticContact CD2-CE1 3.88Å; F182-Y217 HydrophobicContact CD2-CE1 3.88Å; F182-Y217 HydrophobicContact CD2-CG 4.39Å; F182-Y217 HydrophobicContact CE1-CD1 4.45Å; F182-Y217 AromaticContact CE2-CD1 3.48Å; F182-Y217 HydrophobicContact CE2-CD1 3.48Å; F182-Y217 VanDerWaalsContact CE2-CD1 3.48Å; F182-Y217 HydrophobicContact CE2-CE1 4.38Å; F182-Y217 HydrophobicContact CE2-CG 4.21Å; F182-Y217 AromaticContact CG-CD1 3.88Å; F182-Y217 HydrophobicContact CG-CD1 3.88Å; F182-Y217 AromaticContact CG-CE1 3.98Å; F182-Y217 HydrophobicContact CG-CE1 3.98Å; F182-Y217 HydrophobicContact CZ-CD1 4.02Å; F182-Y217 WeakPolarHBondContact CZ-O 3.43Å; F182-R220 VanDerWaalsContact CD1-CZ 3.44Å; F182-R220 HydrophobicContact CE1-CB 3.63Å; F182-R220 HydrophobicContact CZ-CB 3.77Å; F182-K221 HydrophobicContact CZ-CB 4.27Å
183Q92.2Very high95Very high90 Ų9042 Ų4242%0.42121%0.208SC..Hα-helixtrans-73.6-40.4178-177.3175.3-16.800112.3H120 M140 K179 I180 N185H120-Q183 VanDerWaalsContact ND1-CD 3.3Å; H120-Q183 PolarHBondContact ND1-NE2 3.24Å; H120-Q183 PolarHBondContact ND1-OE1 2.92Å; M140-Q183 HydrophobicContact CE-CB 4.33Å; M140-Q183 HydrophobicContact CE-CG 4.44Å; M140-Q183 VanDerWaalsContact CE-OE1 3.25Å; K179-Q183 WeakPolarHBondContact O-CB 3.27Å; K179-Q183 PolarHBondContact O-N 2.97Å; I180-Q183 WeakPolarHBondContact O-CA 3.49Å; I180-Q183 WeakPolarHBondContact O-CB 3.36Å; I180-Q183 PolarHBondContact O-N 3.31Å; Q183-N185 VanDerWaalsContact C-N 3.28Å; Q183-N185 PolarHBondContact O-N 3.23Å
184I91.5Very high94.9Very high34 Ų3443 Ų4317%0.17421%0.214CC..THydrogen-bonded Turntrans-89.810.8178.669.4172.1000113.2M140 E141 I180 Y181 K186M140-I184 HydrophobicContact CB-CG2 3.9Å; E141-I184 HydrophobicContact CG-CD1 3.82Å; I180-I184 HydrophobicContact CG2-CD1 4.07Å; I180-I184 HydrophobicContact CG2-CG1 4.34Å; I180-I184 HydrophobicContact CG2-CG2 4.46Å; I180-I184 WeakPolarHBondContact O-CG1 3.22Å; I180-I184 PolarHBondContact O-N 3.49Å; Y181-I184 HydrophobicContact CD1-CD1 4.18Å; I184-K186 VanDerWaalsContact C-N 3.26Å; I184-K186 HydrophobicContact CD1-CB 4.31Å; I184-K186 HydrophobicContact CD1-CD 3.88Å; I184-K186 HydrophobicContact CD1-CG 4.08Å; I184-K186 HydrophobicContact CG1-CB 4.13Å; I184-K186 HydrophobicContact CG1-CD 4.39Å; I184-K186 HydrophobicContact CG1-CG 4.02Å; I184-K186 PolarHBondContact O-N 3.45Å
185N90.7Very high94.7Very high126 Ų12650.9 Ų50.967%0.67424%0.244SC*.THydrogen-bonded Turntrans53.333.5179.8-160.829.9000115.4Y181 Q183Y181-N185 PolarHBondContact O-N 2.85Å; Y181-N185 VanDerWaalsContact O-N 3.14Å; Q183-N185 VanDerWaalsContact C-N 3.28Å; Q183-N185 PolarHBondContact O-N 3.23Å
186K92.3Very high94.4Very high77 Ų7752.1 Ų52.134%0.33525%0.254SS..  trans-104.855.6175.5-64.5-167.8-173.8-178.40111.5E141 Y181 I184 N188 L189E141-K186 VanDerWaalsContact OE1-CE 3.27Å; E141-K186 WeakPolarHBondContact OE1-CE 3.37Å; E141-K186 IonicContact OE1-NZ 2.73Å; E141-K186 PolarHBondContact OE1-NZ 3.35Å; Y181-K186 PolarHBondContact O-N 3.11Å; I184-K186 VanDerWaalsContact C-N 3.26Å; I184-K186 HydrophobicContact CD1-CB 4.31Å; I184-K186 HydrophobicContact CD1-CD 3.88Å; I184-K186 HydrophobicContact CD1-CG 4.08Å; I184-K186 HydrophobicContact CG1-CB 4.13Å; I184-K186 HydrophobicContact CG1-CD 4.39Å; I184-K186 HydrophobicContact CG1-CG 4.02Å; I184-K186 PolarHBondContact O-N 3.45Å; K186-N188 VanDerWaalsContact C-N 3.25Å; K186-N188 VanDerWaalsContact C-OD1 3.24Å; K186-N188 PolarHBondContact O-N 3.46Å; K186-N188 PolarHBondContact O-OD1 3.38Å; K186-L189 HydrophobicContact CB-CD1 3.82Å; K186-L189 HydrophobicContact CB-CG 4.2Å; K186-L189 HydrophobicContact CD-CD1 4.07Å; K186-L189 WeakPolarHBondContact O-CB 3.5Å; K186-L189 PolarHBondContact O-N 3.1Å; K186-L189 VanDerWaalsContact O-N 3.16Å
187L92.7Very high94.2Very high15 Ų1551.8 Ų51.88%0.07925%0.253CS..G310 helixtrans-63.2-29.4-173.3-59.5-174.7000113.5F182 L189 C190 K221 F224F182-L187 HydrophobicContact CB-CD2 4.21Å; F182-L187 HydrophobicContact CD1-CD2 3.44Å; F182-L187 VanDerWaalsContact CD1-CD2 3.44Å; F182-L187 HydrophobicContact CD2-CD2 3.73Å; F182-L187 HydrophobicContact CE1-CD1 4.46Å; F182-L187 HydrophobicContact CE1-CD2 3.61Å; F182-L187 HydrophobicContact CE2-CD2 3.9Å; F182-L187 HydrophobicContact CG-CD2 3.53Å; F182-L187 HydrophobicContact CZ-CD2 3.85Å; L187-L189 PolarHBondContact O-N 3.28Å; L187-C190 WeakPolarHBondContact O-CB 3.43Å; L187-C190 PolarHBondContact O-N 3.16Å; L187-K221 HydrophobicContact CB-CD 4.02Å; L187-K221 WeakPolarHBondContact O-CE 3.38Å; L187-F224 HydrophobicContact CD1-CB 4.28Å; L187-F224 HydrophobicContact CD1-CD1 4.03Å; L187-F224 HydrophobicContact CD1-CD2 3.89Å; L187-F224 HydrophobicContact CD1-CE1 4.34Å; L187-F224 HydrophobicContact CD1-CE2 4.22Å; L187-F224 HydrophobicContact CD1-CG 3.78Å; L187-F224 HydrophobicContact CD1-CZ 4.43Å
188N92.4Very high93.9Very high120 Ų12055.4 Ų55.464%0.64227%0.272SS*.G310 helixtrans-54.9-32.4174.851.3-10.2000113K186 C190 K191K186-N188 VanDerWaalsContact C-N 3.25Å; K186-N188 VanDerWaalsContact C-OD1 3.24Å; K186-N188 PolarHBondContact O-N 3.46Å; K186-N188 PolarHBondContact O-OD1 3.38Å; N188-C190 PolarHBondContact O-N 3.42Å; N188-K191 PolarHBondContact O-N 3.42Å
189L94.1Very high93.5Very high72 Ų7261.1 Ų61.138%0.37730%0.303SS..G310 helixtrans-66.7-22.1176.6-60.9178.4000112.8Y181 K186 L187 K191 S192 M193Y181-L189 HydrophobicContact CD1-CB 4.26Å; Y181-L189 HydrophobicContact CD1-CD1 3.82Å; Y181-L189 HydrophobicContact CD2-CB 4.01Å; Y181-L189 HydrophobicContact CE1-CB 4.2Å; Y181-L189 HydrophobicContact CE1-CD1 3.49Å; Y181-L189 VanDerWaalsContact CE1-CD1 3.49Å; Y181-L189 HydrophobicContact CE1-CG 4.5Å; Y181-L189 HydrophobicContact CE2-CB 3.94Å; Y181-L189 HydrophobicContact CG-CB 4.18Å; K186-L189 HydrophobicContact CB-CD1 3.82Å; K186-L189 HydrophobicContact CB-CG 4.2Å; K186-L189 HydrophobicContact CD-CD1 4.07Å; K186-L189 WeakPolarHBondContact O-CB 3.5Å; K186-L189 PolarHBondContact O-N 3.1Å; K186-L189 VanDerWaalsContact O-N 3.16Å; L187-L189 PolarHBondContact O-N 3.28Å; L189-K191 VanDerWaalsContact C-N 3.26Å; L189-K191 PolarHBondContact O-N 3.5Å; L189-S192 PolarHBondContact O-OG 3.31Å; L189-M193 WeakPolarHBondContact O-CE 3.44Å
190C95.4Very high93Very high0 Ų059.5 Ų59.50%030%0.297CS..Hα-helixtrans-62.2-31-179.5-64.30000113.6F178 L187 N188 S192 M193 I194 K221F178-C190 HydrophobicContact CD1-CB 4.1Å; F178-C190 HydrophobicContact CE1-CB 3.86Å; L187-C190 WeakPolarHBondContact O-CB 3.43Å; L187-C190 PolarHBondContact O-N 3.16Å; N188-C190 PolarHBondContact O-N 3.42Å; C190-S192 PolarHBondContact O-N 3.45Å; C190-M193 VanDerWaalsContact CA-CE 3.46Å; C190-M193 PolarHBondContact O-N 3.28Å; C190-I194 HydrophobicContact CB-CD1 4.21Å; C190-I194 VanDerWaalsContact O-CG1 3.31Å; C190-I194 WeakPolarHBondContact O-CG1 3.37Å; C190-I194 PolarHBondContact O-N 3.29Å; C190-I194 VanDerWaalsContact O-N 3.08Å; C190-K221 HydrophobicContact CB-CD 4.43Å; C190-K221 HydrophobicContact CB-CG 4.43Å
191K93.5Very high92.4Very high156 Ų15664.4 Ų64.468%0.67833%0.331SS*.Hα-helixtrans-60.4-40.6-167.9-171.6174.2-176.71740113.3N188 L189 R195N188-K191 PolarHBondContact O-N 3.42Å; L189-K191 VanDerWaalsContact C-N 3.26Å; L189-K191 PolarHBondContact O-N 3.5Å; K191-R195 WeakPolarHBondContact O-CB 3.41Å; K191-R195 PolarHBondContact O-N 2.97Å; K191-R195 VanDerWaalsContact O-N 3.12Å
192S91.7Very high91.8Very high60 Ų6064.8 Ų64.842%0.4233%0.334SS..Hα-helixtrans-68.9-39.3-177.8570000112.2L189 C190 A196L189-S192 PolarHBondContact O-OG 3.31Å; C190-S192 PolarHBondContact O-N 3.45Å; S192-A196 WeakPolarHBondContact O-CB 3.42Å; S192-A196 PolarHBondContact O-N 2.72Å
193M92.8Very high91.2Very high4 Ų466.1 Ų66.12%0.0234%0.343CS..Hα-helixtrans-72.5-37177.2-59.482.165.400112.6L148 F151 L177 F178 Y181 L189 C190 A196 I197L148-M193 HydrophobicContact CD1-SD 4.42Å; F151-M193 HydrophobicContact CD1-CG 4.32Å; F151-M193 HydrophobicContact CE1-CB 4.28Å; F151-M193 HydrophobicContact CE1-CG 3.91Å; F151-M193 HydrophobicContact CE2-CB 4.42Å; F151-M193 HydrophobicContact CE2-CG 4.48Å; F151-M193 HydrophobicContact CZ-CB 3.91Å; F151-M193 HydrophobicContact CZ-CG 3.99Å; L177-M193 HydrophobicContact CB-CE 4.41Å; L177-M193 HydrophobicContact CD1-CG 4.13Å; F178-M193 HydrophobicContact CD1-CE 4.42Å; F178-M193 HydrophobicContact CE1-CE 4.13Å; Y181-M193 HydrophobicContact CD2-CE 3.66Å; Y181-M193 HydrophobicContact CE2-CE 3.34Å; Y181-M193 HydrophobicContact CE2-SD 4.29Å; L189-M193 WeakPolarHBondContact O-CE 3.44Å; C190-M193 VanDerWaalsContact CA-CE 3.46Å; C190-M193 PolarHBondContact O-N 3.28Å; M193-A196 PolarHBondContact O-N 2.89Å; M193-I197 PolarHBondContact O-N 2.99Å
194I95.5Very high90.9Very high24 Ų2467.8 Ų67.812%0.12335%0.354CS..Hα-helixtrans-57.7-53.8174.2-67.5172.4000109.1F178 C190 A196 I197 D198 Y214 V218 K221F178-I194 HydrophobicContact CE1-CG1 4.06Å; F178-I194 HydrophobicContact CZ-CD1 4.39Å; F178-I194 HydrophobicContact CZ-CG1 3.68Å; C190-I194 HydrophobicContact CB-CD1 4.21Å; C190-I194 VanDerWaalsContact O-CG1 3.31Å; C190-I194 WeakPolarHBondContact O-CG1 3.37Å; C190-I194 PolarHBondContact O-N 3.29Å; C190-I194 VanDerWaalsContact O-N 3.08Å; I194-A196 VanDerWaalsContact C-N 3.29Å; I194-A196 PolarHBondContact O-N 3.16Å; I194-I197 PolarHBondContact O-N 3.36Å; I194-I197 VanDerWaalsContact O-N 3.16Å; I194-D198 WeakPolarHBondContact CG2-OD2 3.1Å; I194-D198 WeakPolarHBondContact O-CB 3.4Å; I194-D198 VanDerWaalsContact O-CG 3.26Å; I194-D198 PolarHBondContact O-N 2.79Å; I194-Y214 PolarHBondContact O-OH 3.08Å; I194-V218 HydrophobicContact CD1-CG2 4.06Å; I194-V218 HydrophobicContact CG1-CG2 3.96Å; I194-V218 HydrophobicContact CG2-CG2 4.44Å; I194-K221 HydrophobicContact CD1-CB 4.38Å; I194-K221 HydrophobicContact CD1-CG 4.18Å
195R94.3Very high90.9Very high165 Ų16570.7 Ų70.762%0.62337%0.367SS*.Hα-helixtrans-56.8-42.8176.9-176.6179.162.3-176.3-0.1112.4K191 I197 N199K191-R195 WeakPolarHBondContact O-CB 3.41Å; K191-R195 PolarHBondContact O-N 2.97Å; K191-R195 VanDerWaalsContact O-N 3.12Å; R195-I197 PolarHBondContact O-N 3.29Å; R195-N199 WeakPolarHBondContact O-CB 3.2Å; R195-N199 PolarHBondContact O-N 3.5Å; R195-N199 VanDerWaalsContact O-N 3.1Å; R195-N199 PolarHBondContact O-ND2 3.4Å; R195-N199 PolarHBondContact O-OD1 3.39Å
196A93.7Very high91Very high30 Ų3065 Ų6525%0.24834%0.336CS..Hα-helixtrans-63.7-39.6179.800000112.5F151 M170 S192 M193 I194 L200F151-A196 HydrophobicContact CE1-CB 4.17Å; F151-A196 HydrophobicContact CZ-CB 4.02Å; M170-A196 HydrophobicContact CE-CB 4.14Å; S192-A196 WeakPolarHBondContact O-CB 3.42Å; S192-A196 PolarHBondContact O-N 2.72Å; M193-A196 PolarHBondContact O-N 2.89Å; I194-A196 VanDerWaalsContact C-N 3.29Å; I194-A196 PolarHBondContact O-N 3.16Å; A196-L200 WeakPolarHBondContact O-CG 3.42Å
197I93.6Very high91.1Very high0 Ų064.1 Ų64.10%034%0.34CS..Hα-helixtrans-73.7-45.3178.3-73.1170.7000111.3F151 M170 M171 A174 M193 I194 R195 N199 L200 Y214F151-I197 HydrophobicContact CE2-CD1 4.13Å; F151-I197 HydrophobicContact CE2-CG1 4.23Å; F151-I197 HydrophobicContact CZ-CG1 4.33Å; M170-I197 HydrophobicContact CB-CG1 4.45Å; M170-I197 HydrophobicContact CE-CG1 4.44Å; M171-I197 HydrophobicContact CE-CG2 4.07Å; A174-I197 HydrophobicContact CB-CD1 3.32Å; M193-I197 PolarHBondContact O-N 2.99Å; I194-I197 PolarHBondContact O-N 3.36Å; I194-I197 VanDerWaalsContact O-N 3.16Å; R195-I197 PolarHBondContact O-N 3.29Å; I197-N199 PolarHBondContact O-N 2.83Å; I197-L200 WeakPolarHBondContact O-CB 3.42Å; I197-L200 PolarHBondContact O-N 3.03Å; I197-Y214 HydrophobicContact CB-CE2 4.08Å; I197-Y214 HydrophobicContact CD1-CD2 4.03Å; I197-Y214 HydrophobicContact CD1-CE2 3.57Å; I197-Y214 HydrophobicContact CG1-CE2 4.42Å; I197-Y214 HydrophobicContact CG2-CE1 4.22Å; I197-Y214 HydrophobicContact CG2-CE2 3.88Å
198D91.2Very high91.2Very high76 Ų7667.3 Ų67.341%0.40636%0.356SS..Hα-helixtrans-61.7-34.5-178.5-67.1-11.8000111.1I194 L200 S201 Y214I194-D198 WeakPolarHBondContact CG2-OD2 3.1Å; I194-D198 WeakPolarHBondContact O-CB 3.4Å; I194-D198 VanDerWaalsContact O-CG 3.26Å; I194-D198 PolarHBondContact O-N 2.79Å; D198-L200 PolarHBondContact O-N 3.49Å; D198-S201 PolarHBondContact O-N 3.46Å; D198-Y214 PolarHBondContact OD1-OH 3.34Å
199N90.3Very high91.4Very high121 Ų12164.9 Ų64.965%0.64735%0.353SS*.THydrogen-bonded Turntrans-68.5-16.7175.2-73.4-5.7000114.4R195 I197R195-N199 WeakPolarHBondContact O-CB 3.2Å; R195-N199 PolarHBondContact O-N 3.5Å; R195-N199 VanDerWaalsContact O-N 3.1Å; R195-N199 PolarHBondContact O-ND2 3.4Å; R195-N199 PolarHBondContact O-OD1 3.39Å; I197-N199 PolarHBondContact O-N 2.83Å
200L88.2Confident91.6Very high35 Ų3563.3 Ų63.318%0.18334%0.344CS..THydrogen-bonded Turntrans-73.5-30.2179.2-58.9173.8000112K167 M170 A196 I197 D198 I202 F206K167-L200 HydrophobicContact CB-CD1 4.48Å; K167-L200 HydrophobicContact CB-CD2 4.48Å; K167-L200 HydrophobicContact CD-CD2 3.85Å; K167-L200 HydrophobicContact CG-CD2 4.12Å; M170-L200 HydrophobicContact CB-CD1 4.47Å; M170-L200 HydrophobicContact CE-CD1 4.04Å; M170-L200 HydrophobicContact SD-CD1 3.65Å; M170-L200 HydrophobicContact SD-CD2 4.18Å; M170-L200 HydrophobicContact SD-CG 4.44Å; A196-L200 WeakPolarHBondContact O-CG 3.42Å; I197-L200 WeakPolarHBondContact O-CB 3.42Å; I197-L200 PolarHBondContact O-N 3.03Å; D198-L200 PolarHBondContact O-N 3.49Å; L200-I202 HydrophobicContact CB-CD1 4.2Å; L200-I202 HydrophobicContact CB-CG1 3.81Å; L200-I202 HydrophobicContact CD1-CD1 4.23Å; L200-I202 HydrophobicContact CD1-CG1 4.37Å; L200-I202 WeakPolarHBondContact O-CG2 3.42Å; L200-I202 PolarHBondContact O-N 2.99Å; L200-F206 HydrophobicContact CD1-CZ 4.25Å
201S83.3Confident91.7Very high102 Ų10265.8 Ų65.871%0.71335%0.353SS*.  trans54.317.8-175.5-59.40000115.8D198D198-S201 PolarHBondContact O-N 3.46Å
202I83.7Confident91.9Very high21 Ų2159.1 Ų59.111%0.10833%0.326CS..  trans-10230-179.763.9-179.1000113.3V162 K167 L168 L200 D204 H205 F206V162-I202 HydrophobicContact CB-CG2 4.48Å; V162-I202 HydrophobicContact CG1-CB 4.09Å; V162-I202 HydrophobicContact CG1-CD1 3.84Å; V162-I202 HydrophobicContact CG1-CG2 3.78Å; V162-I202 HydrophobicContact CG2-CG2 3.82Å; K167-I202 HydrophobicContact CB-CD1 4.17Å; L168-I202 HydrophobicContact CD2-CD1 4.26Å; L200-I202 HydrophobicContact CB-CD1 4.2Å; L200-I202 HydrophobicContact CB-CG1 3.81Å; L200-I202 HydrophobicContact CD1-CD1 4.23Å; L200-I202 HydrophobicContact CD1-CG1 4.37Å; L200-I202 WeakPolarHBondContact O-CG2 3.42Å; L200-I202 PolarHBondContact O-N 2.99Å; I202-D204 PolarHBondContact O-N 3.21Å; I202-H205 WeakPolarHBondContact O-CB 3.34Å; I202-H205 PolarHBondContact O-N 3.47Å; I202-H205 PolarHBondContact O-ND1 3.15Å; I202-F206 HydrophobicContact CD1-CE2 4.36Å; I202-F206 HydrophobicContact CD1-CZ 4.17Å; I202-F206 HydrophobicContact CG1-CE2 3.79Å; I202-F206 HydrophobicContact CG1-CZ 4.1Å
203N82.6Confident92.2Very high61 Ų6158.3 Ų58.333%0.32632%0.318SS..G310 helixtrans-53.2-31.9-170.2-78.7-35.9000114.5H205 F206 R211N203-H205 VanDerWaalsContact C-N 3.3Å; N203-H205 PolarHBondContact O-N 2.83Å; N203-F206 PolarHBondContact O-N 3.48Å; N203-R211 VanDerWaalsContact O-CD 3.28Å; N203-R211 WeakPolarHBondContact O-CD 3.4Å
204D86.2Confident92.5Very high125 Ų12558.6 Ų58.667%0.66832%0.319SS*.G310 helixtrans-76.7-12-177.8-63.4-43.9000114.6I202 R211I202-D204 PolarHBondContact O-N 3.21Å; D204-R211 IonicContact OD1-CZ 3.18Å; D204-R211 VanDerWaalsContact OD1-CZ 3.3Å; D204-R211 IonicContact OD1-NH1 2.65Å; D204-R211 PolarHBondContact OD1-NH1 3.49Å; D204-R211 IonicContact OD1-NH2 3.53Å; D204-R211 PolarHBondContact OD1-NH2 3.38Å
205H90.9Very high92.6Very high95 Ų9558.5 Ų58.544%0.4432%0.32SS..G310 helixtrans-82.2-18.3173.9-6179.6000112.7E163 L168 I202 N203E163-H205 IonicContact OE1-NE2 3.23Å; L168-H205 HydrophobicContact CD2-CB 3.55Å; I202-H205 WeakPolarHBondContact O-CB 3.34Å; I202-H205 PolarHBondContact O-N 3.47Å; I202-H205 PolarHBondContact O-ND1 3.15Å; N203-H205 VanDerWaalsContact C-N 3.3Å; N203-H205 PolarHBondContact O-N 2.83Å
206F93.2Very high92.8Very high6 Ų651.5 Ų51.53%0.02629%0.294CS..SBendtrans-82.7145.4175-58.9-72000110.9L168 M171 L200 I202 N203 R211L168-F206 WeakPolarHBondContact O-CE1 3.44Å; M171-F206 HydrophobicContact CB-CD1 3.45Å; M171-F206 VanDerWaalsContact CB-CD1 3.45Å; M171-F206 HydrophobicContact CB-CD2 4.22Å; M171-F206 HydrophobicContact CB-CE1 3.53Å; M171-F206 HydrophobicContact CB-CE2 4.3Å; M171-F206 HydrophobicContact CB-CG 3.81Å; M171-F206 HydrophobicContact CB-CZ 3.98Å; M171-F206 HydrophobicContact CE-CB 4.15Å; M171-F206 HydrophobicContact CE-CD2 3.4Å; M171-F206 VanDerWaalsContact CE-CD2 3.4Å; M171-F206 HydrophobicContact CE-CE2 3.88Å; M171-F206 HydrophobicContact CE-CG 3.83Å; M171-F206 HydrophobicContact CG-CD1 4.44Å; M171-F206 HydrophobicContact CG-CG 4.38Å; M171-F206 HydrophobicContact SD-CB 3.6Å; M171-F206 HydrophobicContact SD-CD1 4.31Å; M171-F206 HydrophobicContact SD-CD2 3.96Å; M171-F206 HydrophobicContact SD-CG 3.7Å; L200-F206 HydrophobicContact CD1-CZ 4.25Å; I202-F206 HydrophobicContact CD1-CE2 4.36Å; I202-F206 HydrophobicContact CD1-CZ 4.17Å; I202-F206 HydrophobicContact CG1-CE2 3.79Å; I202-F206 HydrophobicContact CG1-CZ 4.1Å; N203-F206 PolarHBondContact O-N 3.48Å; F206-R211 HydrophobicContact CB-CG 4.04Å; F206-R211 WeakPolarHBondContact O-CD 3.41Å
207S94Very high93.1Very high59 Ų5951.4 Ų51.441%0.41329%0.288SS..  trans-59.4148.4176.267.50000111.6A209 Q210 R211S207-A209 PolarHBondContact O-N 2.84Å; S207-Q210 WeakPolarHBondContact O-CB 3.42Å; S207-Q210 PolarHBondContact O-N 3.36Å; S207-Q210 WeakPolarHBondContact OG-CB 3.49Å; S207-Q210 VanDerWaalsContact OG-CD 3.27Å; S207-Q210 WeakPolarHBondContact OG-CG 3.28Å; S207-Q210 PolarHBondContact OG-N 3.09Å; S207-Q210 PolarHBondContact OG-OE1 3.15Å; S207-R211 WeakPolarHBondContact O-CG 3.26Å; S207-R211 PolarHBondContact O-N 3.12Å
208L95.7Very high93.3Very high81 Ų8152.3 Ų52.342%0.42429%0.293SS..Hα-helixtrans-55.2-38177.3-170.962.8000112.3Q210 R211 V212 R241L208-Q210 PolarHBondContact O-N 3.41Å; L208-R211 PolarHBondContact O-N 3.24Å; L208-V212 HydrophobicContact CG-CG2 4.39Å; L208-V212 WeakPolarHBondContact O-CB 3.14Å; L208-V212 VanDerWaalsContact O-CG2 3.28Å; L208-V212 WeakPolarHBondContact O-CG2 3.45Å; L208-V212 PolarHBondContact O-N 2.79Å; L208-R241 HydrophobicContact CD1-CB 3.95Å; L208-R241 HydrophobicContact CD1-CG 4.45Å
209A96.1Very high93.6Very high70 Ų7048.7 Ų48.758%0.57927%0.274SS*.Hα-helixtrans-63-40.217800000112.6S207 T213S207-A209 PolarHBondContact O-N 2.84Å; A209-T213 PolarHBondContact O-N 3.33Å; A209-T213 VanDerWaalsContact O-N 3.17Å; A209-T213 PolarHBondContact O-OG1 2.96Å
210Q97.2Very high94Very high39 Ų3945 Ų4518%0.18225%0.251CS..Hα-helixtrans-66.8-44.8174.9-74.3167.1-30.200111M171 N175 S207 L208 T213 Y214M171-Q210 HydrophobicContact CG-CB 4.02Å; M171-Q210 VanDerWaalsContact SD-C 3.56Å; M171-Q210 HydrophobicContact SD-CB 3.78Å; N175-Q210 PolarHBondContact ND2-O 2.96Å; S207-Q210 WeakPolarHBondContact O-CB 3.42Å; S207-Q210 PolarHBondContact O-N 3.36Å; S207-Q210 WeakPolarHBondContact OG-CB 3.49Å; S207-Q210 VanDerWaalsContact OG-CD 3.27Å; S207-Q210 WeakPolarHBondContact OG-CG 3.28Å; S207-Q210 PolarHBondContact OG-N 3.09Å; S207-Q210 PolarHBondContact OG-OE1 3.15Å; L208-Q210 PolarHBondContact O-N 3.41Å; Q210-T213 PolarHBondContact O-N 3.47Å; Q210-Y214 WeakPolarHBondContact O-CB 3.38Å; Q210-Y214 PolarHBondContact O-N 3.11Å
211R97.6Very high94.4Very high51 Ų5144.1 Ų44.119%0.19225%0.245CC..Hα-helixtrans-61.8-44.5179-65.6167.166167.27.8112.2M171 N203 D204 F206 S207 L208 T213 Y214 C215 F237M171-R211 HydrophobicContact CE-CG 4.27Å; M171-R211 HydrophobicContact SD-CB 4.36Å; M171-R211 HydrophobicContact SD-CG 3.84Å; N203-R211 VanDerWaalsContact O-CD 3.28Å; N203-R211 WeakPolarHBondContact O-CD 3.4Å; D204-R211 IonicContact OD1-CZ 3.18Å; D204-R211 VanDerWaalsContact OD1-CZ 3.3Å; D204-R211 IonicContact OD1-NH1 2.65Å; D204-R211 PolarHBondContact OD1-NH1 3.49Å; D204-R211 IonicContact OD1-NH2 3.53Å; D204-R211 PolarHBondContact OD1-NH2 3.38Å; F206-R211 HydrophobicContact CB-CG 4.04Å; F206-R211 WeakPolarHBondContact O-CD 3.41Å; S207-R211 WeakPolarHBondContact O-CG 3.26Å; S207-R211 PolarHBondContact O-N 3.12Å; L208-R211 PolarHBondContact O-N 3.24Å; R211-T213 VanDerWaalsContact C-N 3.35Å; R211-T213 PolarHBondContact O-N 2.96Å; R211-Y214 PolarHBondContact O-N 2.85Å; R211-C215 WeakPolarHBondContact O-CB 3.46Å; R211-C215 PolarHBondContact O-N 2.9Å; R211-C215 PolarHBondContact O-SG 3.47Å; R211-C215 VanDerWaalsContact O-SG 3.34Å; R211-F237 HydrophobicContact CB-CE1 4.03Å; R211-F237 HydrophobicContact CB-CZ 4.37Å
212V98.3Very high95.1Very high17 Ų1739.8 Ų39.810%0.10322%0.216CC..Hα-helixtrans-60.6-44.8176.2168.20000111.1L208 Y216 A238 R241 C242L208-V212 HydrophobicContact CG-CG2 4.39Å; L208-V212 WeakPolarHBondContact O-CB 3.14Å; L208-V212 VanDerWaalsContact O-CG2 3.28Å; L208-V212 WeakPolarHBondContact O-CG2 3.45Å; L208-V212 PolarHBondContact O-N 2.79Å; V212-Y216 WeakPolarHBondContact O-CB 3.27Å; V212-Y216 PolarHBondContact O-N 3.17Å; V212-A238 HydrophobicContact CG1-CB 4.45Å; V212-R241 HydrophobicContact CG2-CB 3.75Å; V212-C242 HydrophobicContact CG1-CB 4.02Å
213T98.4Very high95.7Very high42 Ų4239.3 Ų39.326%0.25821%0.213SC..Hα-helixtrans-65-41.8178-54.90000111.2N175 A209 Q210 R211 Y216 Y217N175-T213 HydrophobicContact CB-CG2 3.97Å; A209-T213 PolarHBondContact O-N 3.33Å; A209-T213 VanDerWaalsContact O-N 3.17Å; A209-T213 PolarHBondContact O-OG1 2.96Å; Q210-T213 PolarHBondContact O-N 3.47Å; R211-T213 VanDerWaalsContact C-N 3.35Å; R211-T213 PolarHBondContact O-N 2.96Å; T213-Y216 PolarHBondContact O-N 3.27Å; T213-Y217 HydrophobicContact CG2-CD2 4.02Å; T213-Y217 HydrophobicContact CG2-CE2 3.79Å; T213-Y217 VanDerWaalsContact O-CD2 3.22Å; T213-Y217 WeakPolarHBondContact O-CD2 3.1Å; T213-Y217 PolarHBondContact O-N 2.9Å
214Y98.2Very high96.2Very high10 Ų1042.7 Ų42.74%0.03923%0.225CC..Hα-helixtrans-60.4-55.5178177.3-100.5000110.6M171 N175 F178 I194 I197 D198 Q210 R211 Y216 Y217 V218M171-Y214 HydrophobicContact CE-CD1 4.19Å; M171-Y214 HydrophobicContact CE-CG 4.13Å; M171-Y214 HydrophobicContact CG-CD2 4.3Å; M171-Y214 HydrophobicContact CG-CG 4.3Å; M171-Y214 HydrophobicContact SD-CG 4.41Å; N175-Y214 WeakPolarHBondContact OD1-CA 3.33Å; N175-Y214 PolarHBondContact OD1-N 3.31Å; N175-Y214 VanDerWaalsContact OD1-N 3.11Å; F178-Y214 AromaticContact CE2-CD2 3.57Å; F178-Y214 HydrophobicContact CE2-CD2 3.57Å; F178-Y214 AromaticContact CE2-CE2 3.79Å; F178-Y214 HydrophobicContact CE2-CE2 3.79Å; F178-Y214 HydrophobicContact CZ-CD2 4.22Å; F178-Y214 AromaticContact CZ-CE2 3.96Å; F178-Y214 HydrophobicContact CZ-CE2 3.96Å; I194-Y214 PolarHBondContact O-OH 3.08Å; I197-Y214 HydrophobicContact CB-CE2 4.08Å; I197-Y214 HydrophobicContact CD1-CD2 4.03Å; I197-Y214 HydrophobicContact CD1-CE2 3.57Å; I197-Y214 HydrophobicContact CG1-CE2 4.42Å; I197-Y214 HydrophobicContact CG2-CE1 4.22Å; I197-Y214 HydrophobicContact CG2-CE2 3.88Å; D198-Y214 PolarHBondContact OD1-OH 3.34Å; Q210-Y214 WeakPolarHBondContact O-CB 3.38Å; Q210-Y214 PolarHBondContact O-N 3.11Å; R211-Y214 PolarHBondContact O-N 2.85Å; Y214-Y216 VanDerWaalsContact C-N 3.26Å; Y214-Y216 PolarHBondContact O-N 3.29Å; Y214-Y217 PolarHBondContact O-N 2.93Å; Y214-V218 HydrophobicContact CD1-CG2 3.98Å; Y214-V218 HydrophobicContact CD2-CG2 4.21Å; Y214-V218 HydrophobicContact CE1-CG2 3.64Å; Y214-V218 HydrophobicContact CE2-CG2 3.83Å; Y214-V218 HydrophobicContact CG-CG2 4.26Å; Y214-V218 WeakPolarHBondContact O-CG2 3.37Å; Y214-V218 PolarHBondContact O-N 3.46Å
215C98.4Very high96.6Very high22 Ų2241.2 Ų41.215%0.14922%0.217CC..Hα-helixtrans-62-31.4-179.5-67.80000113.1R211 G219 S234 F237 A238R211-C215 WeakPolarHBondContact O-CB 3.46Å; R211-C215 PolarHBondContact O-N 2.9Å; R211-C215 PolarHBondContact O-SG 3.47Å; R211-C215 VanDerWaalsContact O-SG 3.34Å; C215-G219 PolarHBondContact O-N 3.39Å; C215-S234 WeakPolarHBondContact CB-O 3.36Å; C215-S234 WeakPolarHBondContact O-CB 3.42Å; C215-F237 HydrophobicContact CB-CD1 3.85Å; C215-F237 WeakPolarHBondContact SG-CD1 3.41Å; C215-A238 HydrophobicContact CB-CB 4.11Å
216Y98.8Very high96.7Very high18 Ų1838.3 Ų38.37%0.07121%0.213CC..Hα-helixtrans-60.3-48.1171.9166.8-102.9000112V212 T213 Y214 R220 L235 L252 I253 Y256V212-Y216 WeakPolarHBondContact O-CB 3.27Å; V212-Y216 PolarHBondContact O-N 3.17Å; T213-Y216 PolarHBondContact O-N 3.27Å; Y214-Y216 VanDerWaalsContact C-N 3.26Å; Y214-Y216 PolarHBondContact O-N 3.29Å; Y216-R220 HydrophobicContact CE2-CG 4.31Å; Y216-R220 WeakPolarHBondContact O-CG 3.45Å; Y216-R220 PolarHBondContact O-N 2.99Å; Y216-R220 VanDerWaalsContact O-N 3.09Å; Y216-R220 WeakPolarHBondContact OH-CD 3.45Å; Y216-R220 PolarHBondContact OH-NH1 3.14Å; Y216-L235 HydrophobicContact CD2-CD2 4.36Å; Y216-L252 HydrophobicContact CE1-CD2 4.44Å; Y216-L252 HydrophobicContact CE2-CD2 4.35Å; Y216-L252 HydrophobicContact CE2-CG 3.95Å; Y216-L252 WeakPolarHBondContact OH-CG 3.49Å; Y216-I253 HydrophobicContact CD2-CB 4.46Å; Y216-I253 HydrophobicContact CD2-CG1 3.74Å; Y216-I253 HydrophobicContact CE2-CG1 4.4Å; Y216-I253 HydrophobicContact CG-CG1 4.49Å; Y216-Y256 AromaticContact CE2-CD2 3.85Å; Y216-Y256 HydrophobicContact CE2-CD2 3.85Å; Y216-Y256 AromaticContact CE2-CE2 3.99Å; Y216-Y256 HydrophobicContact CE2-CE2 3.99Å; Y216-Y256 WeakPolarHBondContact OH-CE2 3.48Å
217Y98.5Very high96.8Very high29 Ų2941.4 Ų41.411%0.11423%0.23CC..Hα-helixtrans-73.7-40.5179.9-75.6-66.5000113.2F178 K179 F182 T213 Y214 G219 R220 K221F178-Y217 HydrophobicContact CB-CD1 3.84Å; F178-Y217 HydrophobicContact CB-CD2 3.64Å; F178-Y217 HydrophobicContact CB-CE1 4.34Å; F178-Y217 HydrophobicContact CB-CE2 4.2Å; F178-Y217 HydrophobicContact CB-CG 3.47Å; F178-Y217 VanDerWaalsContact CB-CG 3.47Å; F178-Y217 VanDerWaalsContact CD2-CB 3.43Å; F178-Y217 AromaticContact CD2-CD2 3.95Å; F178-Y217 HydrophobicContact CD2-CD2 3.95Å; F178-Y217 AromaticContact CD2-CG 3.9Å; F178-Y217 HydrophobicContact CD2-CG 3.9Å; F178-Y217 HydrophobicContact CG-CD2 4.27Å; F178-Y217 HydrophobicContact CG-CG 4Å; K179-Y217 HydrophobicContact CG-CE2 3.84Å; K179-Y217 WeakPolarHBondContact CG-OH 3.41Å; F182-Y217 HydrophobicContact CB-CE1 4.24Å; F182-Y217 HydrophobicContact CD1-CD1 4.39Å; F182-Y217 AromaticContact CD2-CD1 3.41Å; F182-Y217 HydrophobicContact CD2-CD1 3.41Å; F182-Y217 VanDerWaalsContact CD2-CD1 3.41Å; F182-Y217 AromaticContact CD2-CE1 3.88Å; F182-Y217 HydrophobicContact CD2-CE1 3.88Å; F182-Y217 HydrophobicContact CD2-CG 4.39Å; F182-Y217 HydrophobicContact CE1-CD1 4.45Å; F182-Y217 AromaticContact CE2-CD1 3.48Å; F182-Y217 HydrophobicContact CE2-CD1 3.48Å; F182-Y217 VanDerWaalsContact CE2-CD1 3.48Å; F182-Y217 HydrophobicContact CE2-CE1 4.38Å; F182-Y217 HydrophobicContact CE2-CG 4.21Å; F182-Y217 AromaticContact CG-CD1 3.88Å; F182-Y217 HydrophobicContact CG-CD1 3.88Å; F182-Y217 AromaticContact CG-CE1 3.98Å; F182-Y217 HydrophobicContact CG-CE1 3.98Å; F182-Y217 HydrophobicContact CZ-CD1 4.02Å; F182-Y217 WeakPolarHBondContact CZ-O 3.43Å; T213-Y217 HydrophobicContact CG2-CD2 4.02Å; T213-Y217 HydrophobicContact CG2-CE2 3.79Å; T213-Y217 VanDerWaalsContact O-CD2 3.22Å; T213-Y217 WeakPolarHBondContact O-CD2 3.1Å; T213-Y217 PolarHBondContact O-N 2.9Å; Y214-Y217 PolarHBondContact O-N 2.93Å; Y217-G219 VanDerWaalsContact C-N 3.29Å; Y217-G219 PolarHBondContact O-N 2.86Å; Y217-R220 PolarHBondContact O-N 2.65Å; Y217-K221 WeakPolarHBondContact O-CB 3.43Å; Y217-K221 PolarHBondContact O-N 3.03Å
218V98.2Very high96.9Very high19 Ų1940.6 Ų40.612%0.11522%0.219CC..Hα-helixtrans-58.9-44.8173.9174.90000110.4F178 I194 Y214 R220 K221 A222F178-V218 HydrophobicContact CE2-CG2 4.45Å; I194-V218 HydrophobicContact CD1-CG2 4.06Å; I194-V218 HydrophobicContact CG1-CG2 3.96Å; I194-V218 HydrophobicContact CG2-CG2 4.44Å; Y214-V218 HydrophobicContact CD1-CG2 3.98Å; Y214-V218 HydrophobicContact CD2-CG2 4.21Å; Y214-V218 HydrophobicContact CE1-CG2 3.64Å; Y214-V218 HydrophobicContact CE2-CG2 3.83Å; Y214-V218 HydrophobicContact CG-CG2 4.26Å; Y214-V218 WeakPolarHBondContact O-CG2 3.37Å; Y214-V218 PolarHBondContact O-N 3.46Å; V218-R220 PolarHBondContact O-N 3.4Å; V218-K221 PolarHBondContact O-N 2.93Å; V218-A222 WeakPolarHBondContact O-CB 3.48Å; V218-A222 PolarHBondContact O-N 2.97Å
219G98.5Very high96.9Very high0 Ų039 Ų390%021%0.213CC..Hα-helixtrans-63-41.8177.900000113.5C215 Y217 A222 M223 A231C215-G219 PolarHBondContact O-N 3.39Å; Y217-G219 VanDerWaalsContact C-N 3.29Å; Y217-G219 PolarHBondContact O-N 2.86Å; G219-A222 PolarHBondContact O-N 3.21Å; G219-M223 WeakPolarHBondContact O-CB 3.49Å; G219-M223 PolarHBondContact O-N 2.67Å; G219-A231 WeakPolarHBondContact O-CB 3.18Å
220R97.8Very high96.9Very high44 Ų4437.7 Ų37.717%0.16620%0.199CC..Hα-helixtrans-64.8-38.7173.3-72.7178.368-155.63.6112.7F182 Y216 Y217 V218 M223 F224 Y256F182-R220 VanDerWaalsContact CD1-CZ 3.44Å; F182-R220 HydrophobicContact CE1-CB 3.63Å; F182-R220 HydrophobicContact CZ-CB 3.77Å; Y216-R220 HydrophobicContact CE2-CG 4.31Å; Y216-R220 WeakPolarHBondContact O-CG 3.45Å; Y216-R220 PolarHBondContact O-N 2.99Å; Y216-R220 VanDerWaalsContact O-N 3.09Å; Y216-R220 WeakPolarHBondContact OH-CD 3.45Å; Y216-R220 PolarHBondContact OH-NH1 3.14Å; Y217-R220 PolarHBondContact O-N 2.65Å; V218-R220 PolarHBondContact O-N 3.4Å; R220-M223 PolarHBondContact O-N 2.93Å; R220-F224 PolarHBondContact O-N 3.38Å; R220-Y256 HydrophobicContact CG-CD1 3.91Å; R220-Y256 HydrophobicContact CG-CD2 4.04Å; R220-Y256 HydrophobicContact CG-CE1 4.21Å; R220-Y256 HydrophobicContact CG-CE2 4.38Å; R220-Y256 HydrophobicContact CG-CG 3.8Å; R220-Y256 VanDerWaalsContact CZ-OH 3.31Å; R220-Y256 PolarHBondContact NE-OH 2.95Å; R220-Y256 PolarHBondContact NH2-OH 3.23Å
221K97.3Very high97Very high16 Ų1635.9 Ų35.97%0.0719%0.191CC..Hα-helixtrans-64.6-46.1176.6-179.859.4172.376.90111F182 L187 C190 I194 Y217 V218 M223 F224 D225F182-K221 HydrophobicContact CZ-CB 4.27Å; L187-K221 HydrophobicContact CB-CD 4.02Å; L187-K221 WeakPolarHBondContact O-CE 3.38Å; C190-K221 HydrophobicContact CB-CD 4.43Å; C190-K221 HydrophobicContact CB-CG 4.43Å; I194-K221 HydrophobicContact CD1-CB 4.38Å; I194-K221 HydrophobicContact CD1-CG 4.18Å; Y217-K221 WeakPolarHBondContact O-CB 3.43Å; Y217-K221 PolarHBondContact O-N 3.03Å; V218-K221 PolarHBondContact O-N 2.93Å; K221-M223 VanDerWaalsContact C-N 3.32Å; K221-M223 PolarHBondContact O-N 3.43Å; K221-F224 WeakPolarHBondContact O-CB 3.48Å; K221-F224 PolarHBondContact O-N 3.39Å; K221-D225 IonicContact NZ-OD1 3.98Å; K221-D225 PolarHBondContact NZ-OD1 3.33Å; K221-D225 IonicContact NZ-OD2 3.28Å; K221-D225 PolarHBondContact NZ-OD2 3.45Å; K221-D225 PolarHBondContact O-N 3.43Å
222A97.3Very high97Very high11 Ų1134.8 Ų34.89%0.09119%0.189CC..Hα-helixtrans-61.8-40.5176.300000111.9V218 G219 F224 D225 G226 D227 A231V218-A222 WeakPolarHBondContact O-CB 3.48Å; V218-A222 PolarHBondContact O-N 2.97Å; G219-A222 PolarHBondContact O-N 3.21Å; A222-F224 VanDerWaalsContact C-N 3.32Å; A222-F224 PolarHBondContact O-N 2.89Å; A222-D225 CarbonylContact O-C 3.57Å; A222-D225 PolarHBondContact O-N 3.47Å; A222-G226 PolarHBondContact O-N 3.02Å; A222-G226 VanDerWaalsContact O-N 3.13Å; A222-D227 HydrophobicContact CB-CB 4.43Å; A222-D227 PolarHBondContact O-N 3.26Å; A222-A231 HydrophobicContact CB-CB 3.91Å
223M96.2Very high97Very high11 Ų1140.9 Ų40.95%0.05421%0.214CC..Hα-helixtrans-59.6-42.6174-177-166.174.400111.8G219 R220 K221 D225 G226 A231 Y256 V260 I315G219-M223 WeakPolarHBondContact O-CB 3.49Å; G219-M223 PolarHBondContact O-N 2.67Å; R220-M223 PolarHBondContact O-N 2.93Å; K221-M223 VanDerWaalsContact C-N 3.32Å; K221-M223 PolarHBondContact O-N 3.43Å; M223-D225 VanDerWaalsContact C-N 3.34Å; M223-G226 PolarHBondContact O-N 3.25Å; M223-A231 HydrophobicContact CB-CB 4.01Å; M223-Y256 HydrophobicContact CE-CD1 3.59Å; M223-Y256 HydrophobicContact CE-CE1 4.19Å; M223-Y256 HydrophobicContact SD-CD1 3.98Å; M223-V260 HydrophobicContact CB-CG2 4.1Å; M223-V260 HydrophobicContact CG-CG2 3.67Å; M223-V260 HydrophobicContact SD-CG2 3.99Å; M223-I315 HydrophobicContact CE-CD1 4.47Å; M223-I315 HydrophobicContact CE-CG1 3.87Å; M223-I315 HydrophobicContact CG-CD1 4.13Å; M223-I315 HydrophobicContact CG-CG1 4.13Å; M223-I315 HydrophobicContact CG-CG2 4.18Å; M223-I315 HydrophobicContact SD-CG1 4.03Å; M223-I315 HydrophobicContact SD-CG2 4.17Å
224F93.1Very high96.9Very high131 Ų13139.9 Ų39.958%0.57521%0.208SC*.Hα-helixtrans-65.8-36.2176.5-176.9-91.8000112.4L187 R220 K221 A222 G226L187-F224 HydrophobicContact CD1-CB 4.28Å; L187-F224 HydrophobicContact CD1-CD1 4.03Å; L187-F224 HydrophobicContact CD1-CD2 3.89Å; L187-F224 HydrophobicContact CD1-CE1 4.34Å; L187-F224 HydrophobicContact CD1-CE2 4.22Å; L187-F224 HydrophobicContact CD1-CG 3.78Å; L187-F224 HydrophobicContact CD1-CZ 4.43Å; R220-F224 PolarHBondContact O-N 3.38Å; K221-F224 WeakPolarHBondContact O-CB 3.48Å; K221-F224 PolarHBondContact O-N 3.39Å; A222-F224 VanDerWaalsContact C-N 3.32Å; A222-F224 PolarHBondContact O-N 2.89Å; F224-G226 PolarHBondContact O-N 2.88Å
225D94.6Very high97Very high94 Ų9439.4 Ų39.450%0.50321%0.207SC..THydrogen-bonded Turntrans-76.4-3.8176.7-66.4-16.4000113.4K221 A222 M223 D227K221-D225 IonicContact NZ-OD1 3.98Å; K221-D225 PolarHBondContact NZ-OD1 3.33Å; K221-D225 IonicContact NZ-OD2 3.28Å; K221-D225 PolarHBondContact NZ-OD2 3.45Å; K221-D225 PolarHBondContact O-N 3.43Å; A222-D225 CarbonylContact O-C 3.57Å; A222-D225 PolarHBondContact O-N 3.47Å; M223-D225 VanDerWaalsContact C-N 3.34Å; D225-D227 VanDerWaalsContact C-N 3.26Å; D225-D227 PolarHBondContact O-N 2.95Å
226G93.3Very high97Very high34 Ų3439.5 Ų39.535%0.35121%0.207SC..THydrogen-bonded Turntrans783.1-175.900000114.7A222 M223 F224 F228A222-G226 PolarHBondContact O-N 3.02Å; A222-G226 VanDerWaalsContact O-N 3.13Å; M223-G226 PolarHBondContact O-N 3.25Å; F224-G226 PolarHBondContact O-N 2.88Å; G226-F228 VanDerWaalsContact C-N 3.31Å; G226-F228 VanDerWaalsContact O-CD2 3.32Å; G226-F228 WeakPolarHBondContact O-CD2 3.49Å; G226-F228 WeakPolarHBondContact O-CE2 3.32Å; G226-F228 PolarHBondContact O-N 3Å
227D95.6Very high97Very high71 Ų7141 Ų4138%0.3821%0.214SC..  trans-81.179172.5-176.7-6.7000110.2A222 D225 V229 S230 A231A222-D227 HydrophobicContact CB-CB 4.43Å; A222-D227 PolarHBondContact O-N 3.26Å; D225-D227 VanDerWaalsContact C-N 3.26Å; D225-D227 PolarHBondContact O-N 2.95Å; D227-V229 VanDerWaalsContact C-N 3.27Å; D227-V229 PolarHBondContact O-N 3.43Å; D227-V229 PolarHBondContact OD1-N 3.01Å; D227-S230 VanDerWaalsContact CG-CB 3.42Å; D227-S230 VanDerWaalsContact CG-OG 3.23Å; D227-S230 WeakPolarHBondContact OD1-CB 3.46Å; D227-S230 PolarHBondContact OD1-N 3.45Å; D227-S230 PolarHBondContact OD1-OG 3.28Å; D227-S230 WeakPolarHBondContact OD2-CB 3.49Å; D227-S230 PolarHBondContact OD2-OG 2.86Å; D227-A231 VanDerWaalsContact O-CB 3.29Å; D227-A231 WeakPolarHBondContact O-CB 3.43Å; D227-A231 PolarHBondContact O-N 2.98Å
228F95.6Very high97Very high42 Ų4239.7 Ų39.718%0.18421%0.208CC..Hα-helixtrans-68.9-23.4-176.3-55.2-55.7000113.4G226 D232 V260 L263 L264 K318G226-F228 VanDerWaalsContact C-N 3.31Å; G226-F228 VanDerWaalsContact O-CD2 3.32Å; G226-F228 WeakPolarHBondContact O-CD2 3.49Å; G226-F228 WeakPolarHBondContact O-CE2 3.32Å; G226-F228 PolarHBondContact O-N 3Å; F228-D232 VanDerWaalsContact O-CB 3.3Å; F228-D232 WeakPolarHBondContact O-CB 3.41Å; F228-D232 PolarHBondContact O-N 2.86Å; F228-V260 HydrophobicContact CB-CG1 4.43Å; F228-V260 WeakPolarHBondContact O-CG1 3.23Å; F228-L263 HydrophobicContact CD1-CD1 3.75Å; F228-L263 HydrophobicContact CD2-CD1 4.28Å; F228-L263 HydrophobicContact CE1-CD1 3.54Å; F228-L263 HydrophobicContact CE2-CD1 4.09Å; F228-L263 HydrophobicContact CG-CD1 4.13Å; F228-L263 HydrophobicContact CZ-CD1 3.72Å; F228-L264 HydrophobicContact CB-CD2 3.99Å; F228-L264 HydrophobicContact CB-CG 4.41Å; F228-K318 HydrophobicContact CZ-CD 3.99Å
229V95.5Very high97Very high48 Ų4840.6 Ų40.629%0.29121%0.211SC..Hα-helixtrans-71.4-49.7177.2178.50000110.5D227 A231 D232 K233 M401D227-V229 VanDerWaalsContact C-N 3.27Å; D227-V229 PolarHBondContact O-N 3.43Å; D227-V229 PolarHBondContact OD1-N 3.01Å; V229-A231 VanDerWaalsContact C-N 3.3Å; V229-D232 PolarHBondContact O-N 3.45Å; V229-K233 WeakPolarHBondContact O-CG 3.31Å; V229-K233 PolarHBondContact O-N 3.08Å; V229-M401 HydrophobicContact CG2-CE 3.81Å; V229-M401 HydrophobicContact CG2-CG 4.49Å; V229-M401 HydrophobicContact CG2-SD 3.16Å; V229-M401 WeakPolarHBondContact CG2-SD 3.3Å
230S96.7Very high97Very high43 Ų4346.6 Ų46.630%0.30124%0.239SC..Hα-helixtrans-67.6-35.3177.1-60.40000111.3D227 D232 S234D227-S230 VanDerWaalsContact CG-CB 3.42Å; D227-S230 VanDerWaalsContact CG-OG 3.23Å; D227-S230 WeakPolarHBondContact OD1-CB 3.46Å; D227-S230 PolarHBondContact OD1-N 3.45Å; D227-S230 PolarHBondContact OD1-OG 3.28Å; D227-S230 WeakPolarHBondContact OD2-CB 3.49Å; D227-S230 PolarHBondContact OD2-OG 2.86Å; S230-D232 VanDerWaalsContact C-N 3.35Å; S230-S234 WeakPolarHBondContact O-CB 3.34Å; S230-S234 PolarHBondContact O-N 3.35Å; S230-S234 VanDerWaalsContact O-N 3.08Å; S230-S234 PolarHBondContact O-OG 3.27Å
231A98.2Very high97Very high0 Ų051.1 Ų51.10%026%0.256CS..Hα-helixtrans-58.3-47.7171.900000111.3G219 A222 M223 D227 V229 S234 L235 V260G219-A231 WeakPolarHBondContact O-CB 3.18Å; A222-A231 HydrophobicContact CB-CB 3.91Å; M223-A231 HydrophobicContact CB-CB 4.01Å; D227-A231 VanDerWaalsContact O-CB 3.29Å; D227-A231 WeakPolarHBondContact O-CB 3.43Å; D227-A231 PolarHBondContact O-N 2.98Å; V229-A231 VanDerWaalsContact C-N 3.3Å; A231-S234 PolarHBondContact O-N 3.26Å; A231-L235 VanDerWaalsContact O-CB 3.28Å; A231-L235 WeakPolarHBondContact O-CB 3.14Å; A231-L235 VanDerWaalsContact O-CG 3.29Å; A231-L235 WeakPolarHBondContact O-CG 3.29Å; A231-L235 PolarHBondContact O-N 2.98Å; A231-V260 HydrophobicContact CB-CG1 4Å; A231-V260 HydrophobicContact CB-CG2 4.05Å
232D98Very high97Very high28 Ų2850.8 Ų50.815%0.1526%0.256CS..Hα-helixtrans-62.3-48.7-179.9-175.148.3000112.5F228 V229 S230 S234 L235 T236 V260 K261 L264F228-D232 VanDerWaalsContact O-CB 3.3Å; F228-D232 WeakPolarHBondContact O-CB 3.41Å; F228-D232 PolarHBondContact O-N 2.86Å; V229-D232 PolarHBondContact O-N 3.45Å; S230-D232 VanDerWaalsContact C-N 3.35Å; D232-S234 VanDerWaalsContact C-N 3.3Å; D232-S234 PolarHBondContact O-N 2.82Å; D232-L235 PolarHBondContact O-N 3.24Å; D232-T236 WeakPolarHBondContact O-CB 3.23Å; D232-T236 PolarHBondContact O-N 3.4Å; D232-T236 PolarHBondContact O-OG1 3.43Å; D232-T236 PolarHBondContact OD1-OG1 3.03Å; D232-V260 HydrophobicContact CB-CG1 3.81Å; D232-K261 WeakPolarHBondContact OD1-CD 3.34Å; D232-K261 WeakPolarHBondContact OD1-CE 3.3Å; D232-K261 IonicContact OD1-NZ 3.05Å; D232-K261 PolarHBondContact OD1-NZ 3.19Å; D232-K261 IonicContact OD2-NZ 2.9Å; D232-K261 PolarHBondContact OD2-NZ 3.36Å; D232-L264 HydrophobicContact CB-CD1 3.49Å; D232-L264 VanDerWaalsContact CB-CD1 3.49Å
233K97.9Very high97Very high145 Ų14555.1 Ų55.163%0.6328%0.277SS*.Hα-helixtrans-55.1-48.3177.7-72.6176.1-178.7176.70111V229 F237V229-K233 WeakPolarHBondContact O-CG 3.31Å; V229-K233 PolarHBondContact O-N 3.08Å; K233-F237 WeakPolarHBondContact O-CB 3.21Å; K233-F237 PolarHBondContact O-N 2.93Å; K233-F237 VanDerWaalsContact O-N 3.1Å
234S98.3Very high96.8Very high21 Ų2160.5 Ų60.515%0.14731%0.31CS..Hα-helixtrans-71.2-46.7-176.3-55.80000112.2C215 S230 A231 D232 F237 A238C215-S234 WeakPolarHBondContact CB-O 3.36Å; C215-S234 WeakPolarHBondContact O-CB 3.42Å; S230-S234 WeakPolarHBondContact O-CB 3.34Å; S230-S234 PolarHBondContact O-N 3.35Å; S230-S234 VanDerWaalsContact O-N 3.08Å; S230-S234 PolarHBondContact O-OG 3.27Å; A231-S234 PolarHBondContact O-N 3.26Å; D232-S234 VanDerWaalsContact C-N 3.3Å; D232-S234 PolarHBondContact O-N 2.82Å; S234-F237 PolarHBondContact O-N 3.48Å; S234-A238 WeakPolarHBondContact O-CB 3.41Å; S234-A238 PolarHBondContact O-N 3.43Å
235L98.8Very high96.9Very high0 Ų059.6 Ų59.60%032%0.316CS..Hα-helixtrans-69.8-35.1-179.3-69.4170.7000112Y216 A231 D232 A238 F239 I253 L257 V260Y216-L235 HydrophobicContact CD2-CD2 4.36Å; A231-L235 VanDerWaalsContact O-CB 3.28Å; A231-L235 WeakPolarHBondContact O-CB 3.14Å; A231-L235 VanDerWaalsContact O-CG 3.29Å; A231-L235 WeakPolarHBondContact O-CG 3.29Å; A231-L235 PolarHBondContact O-N 2.98Å; D232-L235 PolarHBondContact O-N 3.24Å; L235-A238 PolarHBondContact O-N 3.24Å; L235-F239 WeakPolarHBondContact O-CB 3.46Å; L235-F239 PolarHBondContact O-N 3.25Å; L235-I253 HydrophobicContact CD2-CG2 4.34Å; L235-I253 WeakPolarHBondContact O-CG2 3.41Å; L235-L257 HydrophobicContact CB-CB 4.12Å; L235-L257 HydrophobicContact CB-CD1 3.65Å; L235-L257 HydrophobicContact CB-CG 4.37Å; L235-V260 HydrophobicContact CD1-CG2 4.11Å
236T98.7Very high97.1Very high24 Ų2460.3 Ų60.315%0.14731%0.314CS..Hα-helixtrans-63.2-48.9173.5-64.50000110.1D232 A238 F239 E240 K261D232-T236 WeakPolarHBondContact O-CB 3.23Å; D232-T236 PolarHBondContact O-N 3.4Å; D232-T236 PolarHBondContact O-OG1 3.43Å; D232-T236 PolarHBondContact OD1-OG1 3.03Å; T236-A238 VanDerWaalsContact C-N 3.32Å; T236-A238 PolarHBondContact O-N 3.19Å; T236-F239 PolarHBondContact O-N 3.42Å; T236-F239 VanDerWaalsContact O-N 3.17Å; T236-E240 HydrophobicContact CG2-CG 4.2Å; T236-E240 WeakPolarHBondContact CG2-OE1 3.44Å; T236-E240 WeakPolarHBondContact O-CB 3.36Å; T236-E240 WeakPolarHBondContact O-CG 3.02Å; T236-E240 PolarHBondContact O-N 3.39Å; T236-K261 WeakPolarHBondContact OG1-CE 3.44Å; T236-K261 PolarHBondContact OG1-NZ 2.83Å; T236-K261 VanDerWaalsContact OG1-NZ 3.08Å
237F98.2Very high97.3Very high51 Ų5163.2 Ų63.222%0.22432%0.315CS..Hα-helixtrans-55.9-48.3174.6179.2-84.7000111.4R211 C215 K233 S234 F239 E240 R241R211-F237 HydrophobicContact CB-CE1 4.03Å; R211-F237 HydrophobicContact CB-CZ 4.37Å; C215-F237 HydrophobicContact CB-CD1 3.85Å; C215-F237 WeakPolarHBondContact SG-CD1 3.41Å; K233-F237 WeakPolarHBondContact O-CB 3.21Å; K233-F237 PolarHBondContact O-N 2.93Å; K233-F237 VanDerWaalsContact O-N 3.1Å; S234-F237 PolarHBondContact O-N 3.48Å; F237-F239 VanDerWaalsContact C-N 3.33Å; F237-F239 PolarHBondContact O-N 3.49Å; F237-E240 PolarHBondContact O-N 2.92Å; F237-R241 HydrophobicContact CD1-CB 4.47Å; F237-R241 HydrophobicContact CD1-CG 4.21Å; F237-R241 HydrophobicContact CD2-CG 3.93Å; F237-R241 HydrophobicContact CE1-CB 4.18Å; F237-R241 HydrophobicContact CE1-CG 3.99Å; F237-R241 HydrophobicContact CE2-CG 3.71Å; F237-R241 HydrophobicContact CG-CG 4.18Å; F237-R241 HydrophobicContact CZ-CB 4.32Å; F237-R241 HydrophobicContact CZ-CG 3.74Å; F237-R241 WeakPolarHBondContact O-CB 3.28Å; F237-R241 VanDerWaalsContact O-CG 3.3Å; F237-R241 WeakPolarHBondContact O-CG 3.49Å; F237-R241 PolarHBondContact O-N 3.44Å
238A98.6Very high97.4Very high0 Ų065.4 Ų65.40%033%0.327CS..Hα-helixtrans-58.7-44.8178.600000111.4V212 C215 S234 L235 T236 C242 I253V212-A238 HydrophobicContact CG1-CB 4.45Å; C215-A238 HydrophobicContact CB-CB 4.11Å; S234-A238 WeakPolarHBondContact O-CB 3.41Å; S234-A238 PolarHBondContact O-N 3.43Å; L235-A238 PolarHBondContact O-N 3.24Å; T236-A238 VanDerWaalsContact C-N 3.32Å; T236-A238 PolarHBondContact O-N 3.19Å; A238-C242 WeakPolarHBondContact O-CB 3.33Å; A238-C242 PolarHBondContact O-N 3.31Å; A238-I253 HydrophobicContact CB-CD1 4Å; A238-I253 HydrophobicContact CB-CG1 4.32Å; A238-I253 HydrophobicContact CB-CG2 4.25Å; A238-I253 WeakPolarHBondContact O-CD1 3.48Å
239F98.6Very high97.5Very high38 Ų3867.5 Ų67.517%0.16734%0.34CS..Hα-helixtrans-65.7-48.1-179.1177.8-105.9000112.2L235 T236 F237 K250 I253 L254 L257 L272 Y276L235-F239 WeakPolarHBondContact O-CB 3.46Å; L235-F239 PolarHBondContact O-N 3.25Å; T236-F239 PolarHBondContact O-N 3.42Å; T236-F239 VanDerWaalsContact O-N 3.17Å; F237-F239 VanDerWaalsContact C-N 3.33Å; F237-F239 PolarHBondContact O-N 3.49Å; F239-K250 HydrophobicContact CD2-CB 4.14Å; F239-K250 HydrophobicContact CD2-CG 4.17Å; F239-K250 HydrophobicContact CE2-CB 3.9Å; F239-K250 HydrophobicContact CE2-CD 4.13Å; F239-K250 HydrophobicContact CE2-CG 4.12Å; F239-K250 PolarHBondContact O-NZ 2.95Å; F239-I253 HydrophobicContact CB-CG2 3.77Å; F239-L254 HydrophobicContact CD2-CD1 4.29Å; F239-L254 HydrophobicContact CD2-CD2 3.95Å; F239-L254 HydrophobicContact CD2-CG 3.75Å; F239-L254 HydrophobicContact CE2-CD1 3.53Å; F239-L254 HydrophobicContact CE2-CD2 3.74Å; F239-L254 HydrophobicContact CE2-CG 3.49Å; F239-L254 VanDerWaalsContact CE2-CG 3.49Å; F239-L254 HydrophobicContact CG-CD2 4.49Å; F239-L254 HydrophobicContact CZ-CD1 4.13Å; F239-L254 HydrophobicContact CZ-CD2 4.1Å; F239-L254 HydrophobicContact CZ-CG 4.28Å; F239-L257 HydrophobicContact CB-CD2 3.89Å; F239-L257 HydrophobicContact CD1-CD2 4.46Å; F239-L257 HydrophobicContact CG-CD2 4.18Å; F239-L272 HydrophobicContact CZ-CD1 4.28Å; F239-Y276 HydrophobicContact CE2-CE2 4.2Å; F239-Y276 HydrophobicContact CZ-CE2 4.17Å
240E98.3Very high97.7Very high126 Ų12665.9 Ų65.959%0.58933%0.329SS*.Hα-helixtrans-68.7-41.8-176.7-70.9179.7171.400111.8T236 F237T236-E240 HydrophobicContact CG2-CG 4.2Å; T236-E240 WeakPolarHBondContact CG2-OE1 3.44Å; T236-E240 WeakPolarHBondContact O-CB 3.36Å; T236-E240 WeakPolarHBondContact O-CG 3.02Å; T236-E240 PolarHBondContact O-N 3.39Å; F237-E240 PolarHBondContact O-N 2.92Å
241R97.8Very high97.8Very high139 Ų13966.4 Ų66.453%0.52532%0.324SS..Hα-helixtrans-85.7-11.3-177.5-59.4-59.1-179.1164.8-0.6114L208 V212 F237L208-R241 HydrophobicContact CD1-CB 3.95Å; L208-R241 HydrophobicContact CD1-CG 4.45Å; V212-R241 HydrophobicContact CG2-CB 3.75Å; F237-R241 HydrophobicContact CD1-CB 4.47Å; F237-R241 HydrophobicContact CD1-CG 4.21Å; F237-R241 HydrophobicContact CD2-CG 3.93Å; F237-R241 HydrophobicContact CE1-CB 4.18Å; F237-R241 HydrophobicContact CE1-CG 3.99Å; F237-R241 HydrophobicContact CE2-CG 3.71Å; F237-R241 HydrophobicContact CG-CG 4.18Å; F237-R241 HydrophobicContact CZ-CB 4.32Å; F237-R241 HydrophobicContact CZ-CG 3.74Å; F237-R241 WeakPolarHBondContact O-CB 3.28Å; F237-R241 VanDerWaalsContact O-CG 3.3Å; F237-R241 WeakPolarHBondContact O-CG 3.49Å; F237-R241 PolarHBondContact O-N 3.44Å
242C97.9Very high97.8Very high9 Ų969.9 Ų69.96%0.06134%0.342CS..SBendtrans-65137.9169.5-171.30000110.5V212 A238 T244 K250 I253V212-C242 HydrophobicContact CG1-CB 4.02Å; A238-C242 WeakPolarHBondContact O-CB 3.33Å; A238-C242 PolarHBondContact O-N 3.31Å; C242-T244 PolarHBondContact O-N 3.32Å; C242-K250 HydrophobicContact CB-CG 3.94Å; C242-K250 WeakPolarHBondContact O-CE 3.29Å; C242-K250 PolarHBondContact O-NZ 3.03Å; C242-I253 HydrophobicContact CB-CD1 4.1Å
243L96.4Very high97.8Very high103 Ų10368.8 Ų68.854%0.53934%0.336SS..  trans-54136.3177.9-65.9176.4000111.5T245 K246 K250L243-T245 PolarHBondContact O-N 3.47Å; L243-K246 HydrophobicContact CB-CB 4.4Å; L243-K246 HydrophobicContact CB-CG 3.94Å; L243-K246 HydrophobicContact CD1-CG 4.35Å; L243-K246 PolarHBondContact O-N 3.03Å; L243-K250 WeakPolarHBondContact O-CE 3.34Å
244T93.1Very high97.8Very high123 Ų12362 Ų6276%0.75531%0.307SS*.THydrogen-bonded Turntrans-60.1-30.8178.4500000113C242 K246C242-T244 PolarHBondContact O-N 3.32Å; T244-K246 VanDerWaalsContact C-N 3.29Å; T244-K246 PolarHBondContact O-N 3.17Å
245T95.8Very high97.9Very high112 Ų11261.3 Ų61.369%0.68730%0.302SS*.THydrogen-bonded Turntrans-73.2-15.4176.556.70000113.8L243 W247L243-T245 PolarHBondContact O-N 3.47Å; T245-W247 PolarHBondContact O-N 3.4Å
246K97.2Very high97.9Very high109 Ų10962.1 Ų62.147%0.47431%0.305SS..  trans-96.266.3-178.3-60.2-58.9-178.5-173.80111L243 T244 N248 N249 K250L243-K246 HydrophobicContact CB-CB 4.4Å; L243-K246 HydrophobicContact CB-CG 3.94Å; L243-K246 HydrophobicContact CD1-CG 4.35Å; L243-K246 PolarHBondContact O-N 3.03Å; T244-K246 VanDerWaalsContact C-N 3.29Å; T244-K246 PolarHBondContact O-N 3.17Å; K246-N248 VanDerWaalsContact C-N 3.34Å; K246-N248 PolarHBondContact O-N 3.33Å; K246-N249 HydrophobicContact CB-CB 4.15Å; K246-N249 PolarHBondContact O-N 3.14Å; K246-N249 VanDerWaalsContact O-N 3.16Å; K246-K250 PolarHBondContact O-N 3.49Å; K246-K250 VanDerWaalsContact O-N 3.11Å
247W97.9Very high97.9Very high96 Ų9661.4 Ų61.436%0.36430%0.3SS..Hα-helixtrans-53.7-46.2-178.5-176.296.4000113T245 N249 K250 R251 K275 Y276 N277T245-W247 PolarHBondContact O-N 3.4Å; W247-N249 VanDerWaalsContact C-N 3.32Å; W247-N249 PolarHBondContact O-N 3.01Å; W247-K250 PolarHBondContact O-N 2.96Å; W247-R251 HydrophobicContact CE3-CB 4.46Å; W247-R251 VanDerWaalsContact CH2-CD 3.42Å; W247-R251 HydrophobicContact CZ3-CB 4.38Å; W247-R251 WeakPolarHBondContact O-CB 3.43Å; W247-R251 PolarHBondContact O-N 2.85Å; W247-K275 PolarHBondContact NE1-O 3.16Å; W247-Y276 AromaticContact CD1-CD1 3.79Å; W247-Y276 AromaticContact CD1-CE1 3.66Å; W247-Y276 HydrophobicContact CD2-CD1 4.27Å; W247-Y276 AromaticContact CE2-CD1 3.85Å; W247-Y276 HydrophobicContact CG-CD1 4.25Å; W247-Y276 HydrophobicContact CG-CE1 4.18Å; W247-Y276 VanDerWaalsContact CZ2-C 3.47Å; W247-Y276 HydrophobicContact CZ2-CD1 4.47Å; W247-Y276 AromaticContact NE1-CD1 3.49Å; W247-Y276 AromaticContact NE1-CE1 3.84Å; W247-N277 HydrophobicContact CH2-CB 4.25Å; W247-N277 HydrophobicContact CZ2-CB 4.32Å
248N98.1Very high97.9Very high117 Ų11759.3 Ų59.363%0.62629%0.291SS*.Hα-helixtrans-59.3-40.4179.3-72.2-33.2000112.7K246 R251 L252K246-N248 VanDerWaalsContact C-N 3.34Å; K246-N248 PolarHBondContact O-N 3.33Å; N248-R251 PolarHBondContact O-N 3.24Å; N248-L252 WeakPolarHBondContact O-CB 3.28Å; N248-L252 PolarHBondContact O-N 3.35Å
249N98.2Very high97.8Very high86 Ų8659.3 Ų59.346%0.4629%0.291SS..Hα-helixtrans-69.8-42.8179-68.3-2.1000111K246 W247 R251 L252 I253K246-N249 HydrophobicContact CB-CB 4.15Å; K246-N249 PolarHBondContact O-N 3.14Å; K246-N249 VanDerWaalsContact O-N 3.16Å; W247-N249 VanDerWaalsContact C-N 3.32Å; W247-N249 PolarHBondContact O-N 3.01Å; N249-R251 VanDerWaalsContact C-N 3.34Å; N249-R251 PolarHBondContact O-N 3.01Å; N249-L252 PolarHBondContact O-N 3.46Å; N249-I253 WeakPolarHBondContact O-CD1 3.5Å; N249-I253 VanDerWaalsContact O-CG1 3.28Å; N249-I253 WeakPolarHBondContact O-CG1 3.4Å; N249-I253 PolarHBondContact O-N 3.15Å
250K98.5Very high97.8Very high13 Ų1357.5 Ų57.56%0.05728%0.283CS..Hα-helixtrans-61.7-42174.6-78.2-171.4-176.9-96.10111.7F239 C242 L243 K246 W247 I253 L254 Y276F239-K250 HydrophobicContact CD2-CB 4.14Å; F239-K250 HydrophobicContact CD2-CG 4.17Å; F239-K250 HydrophobicContact CE2-CB 3.9Å; F239-K250 HydrophobicContact CE2-CD 4.13Å; F239-K250 HydrophobicContact CE2-CG 4.12Å; F239-K250 PolarHBondContact O-NZ 2.95Å; C242-K250 HydrophobicContact CB-CG 3.94Å; C242-K250 WeakPolarHBondContact O-CE 3.29Å; C242-K250 PolarHBondContact O-NZ 3.03Å; L243-K250 WeakPolarHBondContact O-CE 3.34Å; K246-K250 PolarHBondContact O-N 3.49Å; K246-K250 VanDerWaalsContact O-N 3.11Å; W247-K250 PolarHBondContact O-N 2.96Å; K250-I253 PolarHBondContact O-N 3.37Å; K250-L254 WeakPolarHBondContact O-CB 3.22Å; K250-L254 WeakPolarHBondContact O-CG 3.49Å; K250-L254 PolarHBondContact O-N 2.86Å; K250-Y276 HydrophobicContact CB-CD1 4.37Å; K250-Y276 HydrophobicContact CB-CE1 3.55Å; K250-Y276 HydrophobicContact CD-CE1 4.41Å; K250-Y276 VanDerWaalsContact CD-OH 3.27Å; K250-Y276 WeakPolarHBondContact CD-OH 3.38Å
251R98.4Very high97.8Very high55 Ų5554 Ų5421%0.20827%0.266CS..Hα-helixtrans-58.5-47.2173-177.7176.7-173-85.3-2.9111.5W247 N248 N249 I253 L254 I255 Y276 N277 L278W247-R251 HydrophobicContact CE3-CB 4.46Å; W247-R251 VanDerWaalsContact CH2-CD 3.42Å; W247-R251 HydrophobicContact CZ3-CB 4.38Å; W247-R251 WeakPolarHBondContact O-CB 3.43Å; W247-R251 PolarHBondContact O-N 2.85Å; N248-R251 PolarHBondContact O-N 3.24Å; N249-R251 VanDerWaalsContact C-N 3.34Å; N249-R251 PolarHBondContact O-N 3.01Å; R251-I253 VanDerWaalsContact C-N 3.29Å; R251-I253 PolarHBondContact O-N 2.89Å; R251-L254 PolarHBondContact O-N 3.12Å; R251-L254 VanDerWaalsContact O-N 3.15Å; R251-I255 WeakPolarHBondContact O-CG1 3.49Å; R251-I255 PolarHBondContact O-N 3.22Å; R251-I255 VanDerWaalsContact O-N 3.1Å; R251-Y276 HydrophobicContact CB-CD1 4.07Å; R251-Y276 WeakPolarHBondContact CD-O 3.45Å; R251-Y276 WeakPolarHBondContact CG-O 3.44Å; R251-Y276 PolarHBondContact NE-O 3.03Å; R251-N277 PolarHBondContact NE-O 3.24Å; R251-N277 PolarHBondContact NH2-O 2.97Å; R251-L278 HydrophobicContact CG-CD1 4.41Å; R251-L278 HydrophobicContact CG-CD2 4.2Å; R251-L278 HydrophobicContact CG-CG 4.37Å
252L98.2Very high97.7Very high72 Ų7247.4 Ų47.438%0.37724%0.241SC..Hα-helixtrans-60.4-39.1178.9-176.863.7000112.2Y216 N248 N249 Y256Y216-L252 HydrophobicContact CE1-CD2 4.44Å; Y216-L252 HydrophobicContact CE2-CD2 4.35Å; Y216-L252 HydrophobicContact CE2-CG 3.95Å; Y216-L252 WeakPolarHBondContact OH-CG 3.49Å; N248-L252 WeakPolarHBondContact O-CB 3.28Å; N248-L252 PolarHBondContact O-N 3.35Å; N249-L252 PolarHBondContact O-N 3.46Å; L252-Y256 HydrophobicContact CD1-CE2 4.29Å; L252-Y256 WeakPolarHBondContact O-CD2 3.36Å
253I98.8Very high97.6Very high5 Ų548.1 Ų48.13%0.02624%0.244CC..Hα-helixtrans-67-43.6175-63.5157.1000110.6Y216 L235 A238 F239 C242 N249 K250 R251 I255 Y256 L257Y216-I253 HydrophobicContact CD2-CB 4.46Å; Y216-I253 HydrophobicContact CD2-CG1 3.74Å; Y216-I253 HydrophobicContact CE2-CG1 4.4Å; Y216-I253 HydrophobicContact CG-CG1 4.49Å; L235-I253 HydrophobicContact CD2-CG2 4.34Å; L235-I253 WeakPolarHBondContact O-CG2 3.41Å; A238-I253 HydrophobicContact CB-CD1 4Å; A238-I253 HydrophobicContact CB-CG1 4.32Å; A238-I253 HydrophobicContact CB-CG2 4.25Å; A238-I253 WeakPolarHBondContact O-CD1 3.48Å; F239-I253 HydrophobicContact CB-CG2 3.77Å; C242-I253 HydrophobicContact CB-CD1 4.1Å; N249-I253 WeakPolarHBondContact O-CD1 3.5Å; N249-I253 VanDerWaalsContact O-CG1 3.28Å; N249-I253 WeakPolarHBondContact O-CG1 3.4Å; N249-I253 PolarHBondContact O-N 3.15Å; K250-I253 PolarHBondContact O-N 3.37Å; R251-I253 VanDerWaalsContact C-N 3.29Å; R251-I253 PolarHBondContact O-N 2.89Å; I253-I255 VanDerWaalsContact C-N 3.31Å; I253-I255 PolarHBondContact O-N 3.33Å; I253-Y256 PolarHBondContact O-N 3.43Å; I253-Y256 VanDerWaalsContact O-N 3.13Å; I253-L257 PolarHBondContact O-N 3.04Å
254L98.7Very high97.4Very high3 Ų344 Ų442%0.01622%0.222CC..Hα-helixtrans-62-34.1-178.3-78.9171.8000114F239 K250 R251 Y256 L257 I258 L272 Y276 L278F239-L254 HydrophobicContact CD2-CD1 4.29Å; F239-L254 HydrophobicContact CD2-CD2 3.95Å; F239-L254 HydrophobicContact CD2-CG 3.75Å; F239-L254 HydrophobicContact CE2-CD1 3.53Å; F239-L254 HydrophobicContact CE2-CD2 3.74Å; F239-L254 HydrophobicContact CE2-CG 3.49Å; F239-L254 VanDerWaalsContact CE2-CG 3.49Å; F239-L254 HydrophobicContact CG-CD2 4.49Å; F239-L254 HydrophobicContact CZ-CD1 4.13Å; F239-L254 HydrophobicContact CZ-CD2 4.1Å; F239-L254 HydrophobicContact CZ-CG 4.28Å; K250-L254 WeakPolarHBondContact O-CB 3.22Å; K250-L254 WeakPolarHBondContact O-CG 3.49Å; K250-L254 PolarHBondContact O-N 2.86Å; R251-L254 PolarHBondContact O-N 3.12Å; R251-L254 VanDerWaalsContact O-N 3.15Å; L254-Y256 PolarHBondContact O-N 2.92Å; L254-Y256 VanDerWaalsContact O-N 3.14Å; L254-L257 HydrophobicContact CD2-CD2 4.31Å; L254-L257 PolarHBondContact O-N 3.46Å; L254-I258 HydrophobicContact CB-CD1 4.07Å; L254-I258 HydrophobicContact CB-CG1 4.48Å; L254-I258 HydrophobicContact CD2-CD1 4.41Å; L254-I258 HydrophobicContact CD2-CG1 4.25Å; L254-I258 WeakPolarHBondContact O-CB 3.21Å; L254-I258 WeakPolarHBondContact O-CD1 3.46Å; L254-I258 VanDerWaalsContact O-CG1 3.29Å; L254-I258 WeakPolarHBondContact O-CG1 3.44Å; L254-I258 PolarHBondContact O-N 3.21Å; L254-L272 HydrophobicContact CD1-CD1 4.24Å; L254-L272 HydrophobicContact CD1-CG 4.41Å; L254-L272 HydrophobicContact CD2-CD2 4.06Å; L254-Y276 HydrophobicContact CD1-CD1 4.05Å; L254-Y276 HydrophobicContact CD1-CD2 3.14Å; L254-Y276 HydrophobicContact CD1-CE1 4.43Å; L254-Y276 HydrophobicContact CD1-CE2 3.6Å; L254-Y276 HydrophobicContact CD1-CG 3.39Å; L254-L278 HydrophobicContact CB-CD1 3.6Å; L254-L278 HydrophobicContact CD1-CD1 4.36Å
255I98.8Very high97.4Very high7 Ų739.8 Ų39.84%0.03620%0.204CC..Hα-helixtrans-52-36.2175.2-75.1168000111.4R251 I253 P259 L278 C310 V312R251-I255 WeakPolarHBondContact O-CG1 3.49Å; R251-I255 PolarHBondContact O-N 3.22Å; R251-I255 VanDerWaalsContact O-N 3.1Å; I253-I255 VanDerWaalsContact C-N 3.31Å; I253-I255 PolarHBondContact O-N 3.33Å; I255-P259 WeakPolarHBondContact O-CD 3.48Å; I255-P259 WeakPolarHBondContact O-CG 3.45Å; I255-L278 HydrophobicContact CD1-CD2 4.35Å; I255-L278 HydrophobicContact CG1-CD1 4.47Å; I255-L278 HydrophobicContact CG1-CD2 3.72Å; I255-C310 HydrophobicContact CG2-CB 3.7Å; I255-V312 HydrophobicContact CG2-CG1 3.86Å
256Y98.7Very high97.4Very high16 Ų1637.9 Ų37.96%0.06319%0.192CC..Hα-helixtrans-94.9-35.2178.1-57.3-81.9000112.6Y216 R220 M223 L252 I253 L254 P259 V260 C310 V312Y216-Y256 AromaticContact CE2-CD2 3.85Å; Y216-Y256 HydrophobicContact CE2-CD2 3.85Å; Y216-Y256 AromaticContact CE2-CE2 3.99Å; Y216-Y256 HydrophobicContact CE2-CE2 3.99Å; Y216-Y256 WeakPolarHBondContact OH-CE2 3.48Å; R220-Y256 HydrophobicContact CG-CD1 3.91Å; R220-Y256 HydrophobicContact CG-CD2 4.04Å; R220-Y256 HydrophobicContact CG-CE1 4.21Å; R220-Y256 HydrophobicContact CG-CE2 4.38Å; R220-Y256 HydrophobicContact CG-CG 3.8Å; R220-Y256 VanDerWaalsContact CZ-OH 3.31Å; R220-Y256 PolarHBondContact NE-OH 2.95Å; R220-Y256 PolarHBondContact NH2-OH 3.23Å; M223-Y256 HydrophobicContact CE-CD1 3.59Å; M223-Y256 HydrophobicContact CE-CE1 4.19Å; M223-Y256 HydrophobicContact SD-CD1 3.98Å; L252-Y256 HydrophobicContact CD1-CE2 4.29Å; L252-Y256 WeakPolarHBondContact O-CD2 3.36Å; I253-Y256 PolarHBondContact O-N 3.43Å; I253-Y256 VanDerWaalsContact O-N 3.13Å; L254-Y256 PolarHBondContact O-N 2.92Å; L254-Y256 VanDerWaalsContact O-N 3.14Å; Y256-P259 WeakPolarHBondContact O-CD 3.28Å; Y256-V260 VanDerWaalsContact O-CG2 3.31Å; Y256-V260 WeakPolarHBondContact O-CG2 3.47Å; Y256-V260 PolarHBondContact O-N 3.07Å; Y256-C310 PolarHBondContact OH-O 3.44Å; Y256-C310 VanDerWaalsContact OH-O 3.11Å; Y256-V312 HydrophobicContact CD1-CG1 3.78Å; Y256-V312 HydrophobicContact CE1-CG1 3.88Å
257L98.7Very high97.3Very high10 Ų1035.7 Ų35.75%0.05219%0.185CC..Hα-helixtrans-67.3-37.4-178.5-177.458.6000112.3L235 F239 I253 L254 V260 K261L235-L257 HydrophobicContact CB-CB 4.12Å; L235-L257 HydrophobicContact CB-CD1 3.65Å; L235-L257 HydrophobicContact CB-CG 4.37Å; F239-L257 HydrophobicContact CB-CD2 3.89Å; F239-L257 HydrophobicContact CD1-CD2 4.46Å; F239-L257 HydrophobicContact CG-CD2 4.18Å; I253-L257 PolarHBondContact O-N 3.04Å; L254-L257 HydrophobicContact CD2-CD2 4.31Å; L254-L257 PolarHBondContact O-N 3.46Å; L257-V260 PolarHBondContact O-N 3.31Å; L257-K261 HydrophobicContact CD1-CD 4.43Å; L257-K261 HydrophobicContact CD1-CG 3.89Å; L257-K261 HydrophobicContact CG-CG 4.07Å; L257-K261 WeakPolarHBondContact O-CB 3.41Å; L257-K261 VanDerWaalsContact O-CG 3.3Å; L257-K261 WeakPolarHBondContact O-CG 3.43Å; L257-K261 PolarHBondContact O-N 3.26Å
258I98.6Very high97.3Very high6 Ų632.5 Ų32.53%0.03118%0.176CC..Hα-helixtrans-62.6-53.2-177.8-70.7164000111.7L254 V260 K261 M262 P268 L273 L278 F281L254-I258 HydrophobicContact CB-CD1 4.07Å; L254-I258 HydrophobicContact CB-CG1 4.48Å; L254-I258 HydrophobicContact CD2-CD1 4.41Å; L254-I258 HydrophobicContact CD2-CG1 4.25Å; L254-I258 WeakPolarHBondContact O-CB 3.21Å; L254-I258 WeakPolarHBondContact O-CD1 3.46Å; L254-I258 VanDerWaalsContact O-CG1 3.29Å; L254-I258 WeakPolarHBondContact O-CG1 3.44Å; L254-I258 PolarHBondContact O-N 3.21Å; I258-V260 VanDerWaalsContact C-N 3.31Å; I258-V260 PolarHBondContact O-N 3.1Å; I258-K261 PolarHBondContact O-N 2.92Å; I258-M262 HydrophobicContact CG2-CE 3.78Å; I258-M262 HydrophobicContact CG2-SD 4.38Å; I258-M262 WeakPolarHBondContact O-CG 3.32Å; I258-M262 PolarHBondContact O-N 3.41Å; I258-P268 HydrophobicContact CG2-CB 4.31Å; I258-P268 HydrophobicContact CG2-CG 4.05Å; I258-L273 HydrophobicContact CD1-CD2 3.69Å; I258-L278 HydrophobicContact CD1-CD1 3.74Å; I258-F281 HydrophobicContact CD1-CD2 4.47Å; I258-F281 HydrophobicContact CG2-CB 4.1Å; I258-F281 HydrophobicContact CG2-CD1 3.72Å; I258-F281 HydrophobicContact CG2-CE1 4.29Å; I258-F281 HydrophobicContact CG2-CG 3.91Å
259P97.9Very high97.2Very high0 Ų034.4 Ų34.40%018%0.179CC..Hα-helixtrans-53.8-46173.6-25.931.1000113.2I255 Y256 M262 L263 F281 V312 I315 L316I255-P259 WeakPolarHBondContact O-CD 3.48Å; I255-P259 WeakPolarHBondContact O-CG 3.45Å; Y256-P259 WeakPolarHBondContact O-CD 3.28Å; P259-M262 PolarHBondContact O-N 3.02Å; P259-L263 WeakPolarHBondContact O-CG 3.19Å; P259-L263 PolarHBondContact O-N 2.99Å; P259-F281 HydrophobicContact CG-CE1 3.81Å; P259-F281 HydrophobicContact CG-CZ 4.47Å; P259-V312 HydrophobicContact CG-CB 4.41Å; P259-I315 HydrophobicContact CB-CG2 3.76Å; P259-L316 HydrophobicContact CB-CD2 3.97Å; P259-L316 HydrophobicContact CG-CD2 3.87Å; P259-L316 HydrophobicContact CG-CG 4.41Å
260V97.9Very high97.1Very high0 Ų035.9 Ų35.90%018%0.183CC..Hα-helixtrans-60.7-48.4179.5171.30000110.9M223 F228 A231 D232 L235 Y256 L257 I258 M262 L263 L264M223-V260 HydrophobicContact CB-CG2 4.1Å; M223-V260 HydrophobicContact CG-CG2 3.67Å; M223-V260 HydrophobicContact SD-CG2 3.99Å; F228-V260 HydrophobicContact CB-CG1 4.43Å; F228-V260 WeakPolarHBondContact O-CG1 3.23Å; A231-V260 HydrophobicContact CB-CG1 4Å; A231-V260 HydrophobicContact CB-CG2 4.05Å; D232-V260 HydrophobicContact CB-CG1 3.81Å; L235-V260 HydrophobicContact CD1-CG2 4.11Å; Y256-V260 VanDerWaalsContact O-CG2 3.31Å; Y256-V260 WeakPolarHBondContact O-CG2 3.47Å; Y256-V260 PolarHBondContact O-N 3.07Å; L257-V260 PolarHBondContact O-N 3.31Å; I258-V260 VanDerWaalsContact C-N 3.31Å; I258-V260 PolarHBondContact O-N 3.1Å; V260-M262 VanDerWaalsContact C-N 3.32Å; V260-M262 PolarHBondContact O-N 3.15Å; V260-L263 PolarHBondContact O-N 3.18Å; V260-L264 HydrophobicContact CG1-CD1 4.41Å; V260-L264 WeakPolarHBondContact O-CG 3.24Å; V260-L264 PolarHBondContact O-N 2.98Å; V260-L264 VanDerWaalsContact O-N 3.07Å
261K97.4Very high97Very high54 Ų5439.4 Ų39.424%0.23521%0.209CC..Hα-helixtrans-59.6-41.7176.4-74.7-69.6-168-158.20111.7D232 T236 L257 I258 L264 G265 V266D232-K261 WeakPolarHBondContact OD1-CD 3.34Å; D232-K261 WeakPolarHBondContact OD1-CE 3.3Å; D232-K261 IonicContact OD1-NZ 3.05Å; D232-K261 PolarHBondContact OD1-NZ 3.19Å; D232-K261 IonicContact OD2-NZ 2.9Å; D232-K261 PolarHBondContact OD2-NZ 3.36Å; T236-K261 WeakPolarHBondContact OG1-CE 3.44Å; T236-K261 PolarHBondContact OG1-NZ 2.83Å; T236-K261 VanDerWaalsContact OG1-NZ 3.08Å; L257-K261 HydrophobicContact CD1-CD 4.43Å; L257-K261 HydrophobicContact CD1-CG 3.89Å; L257-K261 HydrophobicContact CG-CG 4.07Å; L257-K261 WeakPolarHBondContact O-CB 3.41Å; L257-K261 VanDerWaalsContact O-CG 3.3Å; L257-K261 WeakPolarHBondContact O-CG 3.43Å; L257-K261 PolarHBondContact O-N 3.26Å; I258-K261 PolarHBondContact O-N 2.92Å; K261-L264 CarbonylContact O-C 3.57Å; K261-L264 WeakPolarHBondContact O-CA 3.49Å; K261-L264 PolarHBondContact O-N 3.46Å; K261-L264 VanDerWaalsContact O-N 3.14Å; K261-G265 PolarHBondContact O-N 3.21Å; K261-G265 VanDerWaalsContact O-N 3.11Å; K261-V266 CarbonylContact C-O 3.58Å; K261-V266 HydrophobicContact CB-CB 4.18Å; K261-V266 HydrophobicContact CD-CB 4.3Å; K261-V266 HydrophobicContact CD-CG1 4.42Å; K261-V266 WeakPolarHBondContact O-CA 3.3Å; K261-V266 PolarHBondContact O-N 3.14Å; K261-V266 VanDerWaalsContact O-O 3.12Å
262M96.9Very high97Very high0 Ų039.1 Ų39.10%021%0.212CC..Hα-helixtrans-65.1-39.1178.1-70.2-168.5-65.300112.4I258 P259 V260 L264 G265 V266 L267 P268 F281 I284 A285 L316 L319I258-M262 HydrophobicContact CG2-CE 3.78Å; I258-M262 HydrophobicContact CG2-SD 4.38Å; I258-M262 WeakPolarHBondContact O-CG 3.32Å; I258-M262 PolarHBondContact O-N 3.41Å; P259-M262 PolarHBondContact O-N 3.02Å; V260-M262 VanDerWaalsContact C-N 3.32Å; V260-M262 PolarHBondContact O-N 3.15Å; M262-L264 PolarHBondContact O-N 3.16Å; M262-G265 WeakPolarHBondContact O-CA 3.49Å; M262-G265 PolarHBondContact O-N 2.98Å; M262-V266 WeakPolarHBondContact CA-O 3.48Å; M262-V266 PolarHBondContact N-O 3.37Å; M262-L267 HydrophobicContact CG-CD2 4.06Å; M262-L267 HydrophobicContact SD-CD2 4.36Å; M262-P268 HydrophobicContact SD-CG 4.41Å; M262-F281 HydrophobicContact CE-CD1 4.16Å; M262-I284 HydrophobicContact CE-CG2 4.04Å; M262-I284 HydrophobicContact SD-CG2 4.48Å; M262-A285 HydrophobicContact SD-CB 3.88Å; M262-L316 HydrophobicContact CE-CD2 3.89Å; M262-L319 HydrophobicContact CB-CD1 4.12Å; M262-L319 HydrophobicContact CB-CD2 3.63Å; M262-L319 HydrophobicContact CE-CD1 3.65Å; M262-L319 HydrophobicContact SD-CD1 4.44Å
263L94.6Very high97Very high24 Ų2435.9 Ų35.913%0.12620%0.195CC..Hα-helixtrans-62.2-34173.6-74.5164.7000111.4F228 P259 V260 G265 I315 K318 L319F228-L263 HydrophobicContact CD1-CD1 3.75Å; F228-L263 HydrophobicContact CD2-CD1 4.28Å; F228-L263 HydrophobicContact CE1-CD1 3.54Å; F228-L263 HydrophobicContact CE2-CD1 4.09Å; F228-L263 HydrophobicContact CG-CD1 4.13Å; F228-L263 HydrophobicContact CZ-CD1 3.72Å; P259-L263 WeakPolarHBondContact O-CG 3.19Å; P259-L263 PolarHBondContact O-N 2.99Å; V260-L263 PolarHBondContact O-N 3.18Å; L263-G265 PolarHBondContact O-N 3.32Å; L263-I315 HydrophobicContact CD1-CG2 3.81Å; L263-K318 HydrophobicContact CD2-CB 3.98Å; L263-L319 HydrophobicContact CB-CD2 4.34Å; L263-L319 HydrophobicContact CD2-CD2 3.66Å; L263-L319 HydrophobicContact CD2-CG 4.02Å; L263-L319 HydrophobicContact CG-CD2 3.68Å; L263-L319 HydrophobicContact CG-CG 4.2Å
264L93.7Very high97Very high15 Ų1538 Ų388%0.07921%0.209CC..THydrogen-bonded Turntrans-82.35.2173.2-59.7-176.1000113.8F228 D232 V260 K261 M262 T398 M401F228-L264 HydrophobicContact CB-CD2 3.99Å; F228-L264 HydrophobicContact CB-CG 4.41Å; D232-L264 HydrophobicContact CB-CD1 3.49Å; D232-L264 VanDerWaalsContact CB-CD1 3.49Å; V260-L264 HydrophobicContact CG1-CD1 4.41Å; V260-L264 WeakPolarHBondContact O-CG 3.24Å; V260-L264 PolarHBondContact O-N 2.98Å; V260-L264 VanDerWaalsContact O-N 3.07Å; K261-L264 CarbonylContact O-C 3.57Å; K261-L264 WeakPolarHBondContact O-CA 3.49Å; K261-L264 PolarHBondContact O-N 3.46Å; K261-L264 VanDerWaalsContact O-N 3.14Å; M262-L264 PolarHBondContact O-N 3.16Å; L264-T398 VanDerWaalsContact O-CG2 3.26Å; L264-T398 WeakPolarHBondContact O-CG2 3.47Å; L264-M401 HydrophobicContact CD2-CE 3.58Å; L264-M401 HydrophobicContact CD2-SD 3.65Å
265G92.1Very high96.9Very high35 Ų3544.1 Ų44.136%0.36124%0.236SC..THydrogen-bonded Turntrans82.313176.600000116K261 M262 L263K261-G265 PolarHBondContact O-N 3.21Å; K261-G265 VanDerWaalsContact O-N 3.11Å; M262-G265 WeakPolarHBondContact O-CA 3.49Å; M262-G265 PolarHBondContact O-N 2.98Å; L263-G265 PolarHBondContact O-N 3.32Å
266V95.4Very high96.9Very high73 Ų7344.2 Ų44.244%0.44224%0.236SC..  trans-104.2114.3175.4-1790000109.4K261 M262K261-V266 CarbonylContact C-O 3.58Å; K261-V266 HydrophobicContact CB-CB 4.18Å; K261-V266 HydrophobicContact CD-CB 4.3Å; K261-V266 HydrophobicContact CD-CG1 4.42Å; K261-V266 WeakPolarHBondContact O-CA 3.3Å; K261-V266 PolarHBondContact O-N 3.14Å; K261-V266 VanDerWaalsContact O-O 3.12Å; M262-V266 WeakPolarHBondContact CA-O 3.48Å; M262-V266 PolarHBondContact N-O 3.37Å
267L95.8Very high96.9Very high63 Ų6348 Ų4833%0.3326%0.257SS..PPolyproline II helixtrans-86.5145.1-179.5-60.6177.5000111.9M262 A285 V288 K289M262-L267 HydrophobicContact CG-CD2 4.06Å; M262-L267 HydrophobicContact SD-CD2 4.36Å; L267-A285 HydrophobicContact CD2-CB 4.39Å; L267-V288 HydrophobicContact CD2-CB 4.09Å; L267-V288 HydrophobicContact CD2-CG1 3.83Å; L267-K289 HydrophobicContact CD1-CB 3.65Å; L267-K289 HydrophobicContact CD1-CD 4.22Å; L267-K289 HydrophobicContact CD1-CG 3.99Å
268P96.9Very high96.9Very high28 Ų2847.5 Ų47.518%0.18226%0.255CS..PPolyproline II helixtrans-68148.117629.6-35.8000111.7I258 M262 L273 A285I258-P268 HydrophobicContact CG2-CB 4.31Å; I258-P268 HydrophobicContact CG2-CG 4.05Å; M262-P268 HydrophobicContact SD-CG 4.41Å; P268-L273 HydrophobicContact CB-CD1 4.4Å; P268-L273 HydrophobicContact CB-CD2 3.79Å; P268-L273 HydrophobicContact CB-CG 4.12Å; P268-L273 HydrophobicContact CG-CD1 4.17Å; P268-L273 HydrophobicContact CG-CD2 4.14Å; P268-L273 HydrophobicContact CG-CG 4.41Å; P268-A285 HydrophobicContact CG-CB 3.83Å
269K96.5Very high96.8Very high158 Ų15854.2 Ų54.269%0.68728%0.28SS*.PPolyproline II helixtrans-79.1140.6169.3-65.6-175.9179.6-178.20109.9S271 L272 L273K269-S271 VanDerWaalsContact C-N 3.27Å; K269-S271 PolarHBondContact O-N 3.4Å; K269-L272 HydrophobicContact CB-CB 4.39Å; K269-L272 WeakPolarHBondContact O-CA 3.49Å; K269-L272 VanDerWaalsContact O-CB 3.28Å; K269-L272 WeakPolarHBondContact O-CB 3.06Å; K269-L272 PolarHBondContact O-N 3.33Å; K269-L273 PolarHBondContact O-N 2.93Å
270E96.1Very high96.8Very high116 Ų11656.1 Ų56.154%0.54229%0.288SS..Hα-helixtrans-56.5-40.5177-174.3173.1-164.500112.5L272 L273 C274 Q282E270-L272 PolarHBondContact O-N 2.95Å; E270-L273 PolarHBondContact O-N 3.29Å; E270-L273 VanDerWaalsContact O-N 3.14Å; E270-C274 WeakPolarHBondContact O-CB 3.46Å; E270-C274 PolarHBondContact O-N 3.01Å; E270-C274 PolarHBondContact O-SG 3.28Å; E270-C274 VanDerWaalsContact O-SG 3.42Å; E270-Q282 PolarHBondContact OE1-NE2 2.86Å
271S97.6Very high96.8Very high87 Ų8756.1 Ų56.161%0.60829%0.288SS*.Hα-helixtrans-60.7-31.8175.859.80000113.5K269 K275K269-S271 VanDerWaalsContact C-N 3.27Å; K269-S271 PolarHBondContact O-N 3.4Å; S271-K275 VanDerWaalsContact O-CB 3.25Å; S271-K275 WeakPolarHBondContact O-CB 3.19Å; S271-K275 PolarHBondContact O-N 3.18Å
272L97.6Very high96.8Very high49 Ų4955.9 Ų55.926%0.25729%0.288SS..Hα-helixtrans-70.6-45.3175-175.572.4000110.9F239 L254 K269 E270 C274 K275 Y276F239-L272 HydrophobicContact CZ-CD1 4.28Å; L254-L272 HydrophobicContact CD1-CD1 4.24Å; L254-L272 HydrophobicContact CD1-CG 4.41Å; L254-L272 HydrophobicContact CD2-CD2 4.06Å; K269-L272 HydrophobicContact CB-CB 4.39Å; K269-L272 WeakPolarHBondContact O-CA 3.49Å; K269-L272 VanDerWaalsContact O-CB 3.28Å; K269-L272 WeakPolarHBondContact O-CB 3.06Å; K269-L272 PolarHBondContact O-N 3.33Å; E270-L272 PolarHBondContact O-N 2.95Å; L272-C274 VanDerWaalsContact C-N 3.34Å; L272-C274 PolarHBondContact O-N 3.09Å; L272-K275 PolarHBondContact O-N 3.46Å; L272-Y276 HydrophobicContact CD1-CD2 3.8Å; L272-Y276 HydrophobicContact CD1-CE2 3.69Å; L272-Y276 HydrophobicContact CG-CD2 4.36Å; L272-Y276 WeakPolarHBondContact O-CD2 3.5Å; L272-Y276 PolarHBondContact O-N 2.91Å; L272-Y276 VanDerWaalsContact O-N 3.15Å
273L98.4Very high96.9Very high4 Ų458.6 Ų58.62%0.02130%0.303CS..Hα-helixtrans-62.1-43178.1-60.1-174.6000111.3I258 P268 K269 E270 N277 L278 F281 Q282I258-L273 HydrophobicContact CD1-CD2 3.69Å; P268-L273 HydrophobicContact CB-CD1 4.4Å; P268-L273 HydrophobicContact CB-CD2 3.79Å; P268-L273 HydrophobicContact CB-CG 4.12Å; P268-L273 HydrophobicContact CG-CD1 4.17Å; P268-L273 HydrophobicContact CG-CD2 4.14Å; P268-L273 HydrophobicContact CG-CG 4.41Å; K269-L273 PolarHBondContact O-N 2.93Å; E270-L273 PolarHBondContact O-N 3.29Å; E270-L273 VanDerWaalsContact O-N 3.14Å; L273-N277 PolarHBondContact O-N 3.13Å; L273-L278 HydrophobicContact CD2-CB 4.18Å; L273-L278 PolarHBondContact O-N 3.02Å; L273-F281 HydrophobicContact CD1-CB 4.34Å; L273-F281 HydrophobicContact CD2-CB 4.12Å; L273-Q282 HydrophobicContact CD1-CB 3.96Å
274C98.2Very high97Very high49 Ų4957.5 Ų57.533%0.33130%0.297SS..Hα-helixtrans-60.9-49.5173.2-72.80000111.8E270 L272 Y276 N277 R279E270-C274 WeakPolarHBondContact O-CB 3.46Å; E270-C274 PolarHBondContact O-N 3.01Å; E270-C274 PolarHBondContact O-SG 3.28Å; E270-C274 VanDerWaalsContact O-SG 3.42Å; L272-C274 VanDerWaalsContact C-N 3.34Å; L272-C274 PolarHBondContact O-N 3.09Å; C274-Y276 PolarHBondContact O-N 3.37Å; C274-N277 PolarHBondContact O-N 3.5Å; C274-R279 VanDerWaalsContact SG-CZ 3.58Å; C274-R279 PolarHBondContact SG-NE 3.07Å; C274-R279 VanDerWaalsContact SG-NE 3.35Å; C274-R279 PolarHBondContact SG-NH2 2.92Å
275K97.9Very high97.2Very high133 Ų13357.1 Ų57.158%0.57830%0.296SS*.Hα-helixtrans-57.2-36.4-178.1178.7174.2179.2174.40112.8W247 S271 L272W247-K275 PolarHBondContact NE1-O 3.16Å; S271-K275 VanDerWaalsContact O-CB 3.25Å; S271-K275 WeakPolarHBondContact O-CB 3.19Å; S271-K275 PolarHBondContact O-N 3.18Å; L272-K275 PolarHBondContact O-N 3.46Å
276Y98Very high97.5Very high9 Ų958.2 Ų58.24%0.03529%0.294CS..THydrogen-bonded Turntrans-106.210-175.9-68.7-76000114.4F239 W247 K250 R251 L254 L272 C274F239-Y276 HydrophobicContact CE2-CE2 4.2Å; F239-Y276 HydrophobicContact CZ-CE2 4.17Å; W247-Y276 AromaticContact CD1-CD1 3.79Å; W247-Y276 AromaticContact CD1-CE1 3.66Å; W247-Y276 HydrophobicContact CD2-CD1 4.27Å; W247-Y276 AromaticContact CE2-CD1 3.85Å; W247-Y276 HydrophobicContact CG-CD1 4.25Å; W247-Y276 HydrophobicContact CG-CE1 4.18Å; W247-Y276 VanDerWaalsContact CZ2-C 3.47Å; W247-Y276 HydrophobicContact CZ2-CD1 4.47Å; W247-Y276 AromaticContact NE1-CD1 3.49Å; W247-Y276 AromaticContact NE1-CE1 3.84Å; K250-Y276 HydrophobicContact CB-CD1 4.37Å; K250-Y276 HydrophobicContact CB-CE1 3.55Å; K250-Y276 HydrophobicContact CD-CE1 4.41Å; K250-Y276 VanDerWaalsContact CD-OH 3.27Å; K250-Y276 WeakPolarHBondContact CD-OH 3.38Å; R251-Y276 HydrophobicContact CB-CD1 4.07Å; R251-Y276 WeakPolarHBondContact CD-O 3.45Å; R251-Y276 WeakPolarHBondContact CG-O 3.44Å; R251-Y276 PolarHBondContact NE-O 3.03Å; L254-Y276 HydrophobicContact CD1-CD1 4.05Å; L254-Y276 HydrophobicContact CD1-CD2 3.14Å; L254-Y276 HydrophobicContact CD1-CE1 4.43Å; L254-Y276 HydrophobicContact CD1-CE2 3.6Å; L254-Y276 HydrophobicContact CD1-CG 3.39Å; L272-Y276 HydrophobicContact CD1-CD2 3.8Å; L272-Y276 HydrophobicContact CD1-CE2 3.69Å; L272-Y276 HydrophobicContact CG-CD2 4.36Å; L272-Y276 WeakPolarHBondContact O-CD2 3.5Å; L272-Y276 PolarHBondContact O-N 2.91Å; L272-Y276 VanDerWaalsContact O-N 3.15Å; C274-Y276 PolarHBondContact O-N 3.37Å
277N98.1Very high97.6Very high95 Ų9554.7 Ų54.751%0.50827%0.273SS..THydrogen-bonded Turntrans50.457.9-177-167.228.8000112.3W247 R251 L273 C274W247-N277 HydrophobicContact CH2-CB 4.25Å; W247-N277 HydrophobicContact CZ2-CB 4.32Å; R251-N277 PolarHBondContact NE-O 3.24Å; R251-N277 PolarHBondContact NH2-O 2.97Å; L273-N277 PolarHBondContact O-N 3.13Å; C274-N277 PolarHBondContact O-N 3.5Å
278L98.3Very high97.6Very high0 Ų052 Ų520%026%0.259CS..  trans-128.434.8-178.9-65.5178.3000110.8R251 L254 I255 I258 L273 Q280 F281 F306R251-L278 HydrophobicContact CG-CD1 4.41Å; R251-L278 HydrophobicContact CG-CD2 4.2Å; R251-L278 HydrophobicContact CG-CG 4.37Å; L254-L278 HydrophobicContact CB-CD1 3.6Å; L254-L278 HydrophobicContact CD1-CD1 4.36Å; I255-L278 HydrophobicContact CD1-CD2 4.35Å; I255-L278 HydrophobicContact CG1-CD1 4.47Å; I255-L278 HydrophobicContact CG1-CD2 3.72Å; I258-L278 HydrophobicContact CD1-CD1 3.74Å; L273-L278 HydrophobicContact CD2-CB 4.18Å; L273-L278 PolarHBondContact O-N 3.02Å; L278-Q280 VanDerWaalsContact C-OE1 3.29Å; L278-Q280 PolarHBondContact O-N 3.11Å; L278-F281 HydrophobicContact CB-CD2 3.96Å; L278-F281 HydrophobicContact CB-CE2 4.36Å; L278-F281 HydrophobicContact CD2-CE2 4.13Å; L278-F281 PolarHBondContact O-N 3.04Å; L278-F306 HydrophobicContact CD2-CZ 4Å
279R97.9Very high97.5Very high147 Ų14757.8 Ų57.856%0.55528%0.281SS*.THydrogen-bonded Turntrans-63.4-20-178.5-67.7-168.9-178.1-161.30.9113.3C274 F281 Q282C274-R279 VanDerWaalsContact SG-CZ 3.58Å; C274-R279 PolarHBondContact SG-NE 3.07Å; C274-R279 VanDerWaalsContact SG-NE 3.35Å; C274-R279 PolarHBondContact SG-NH2 2.92Å; R279-F281 PolarHBondContact O-N 3.34Å; R279-F281 VanDerWaalsContact O-N 3.07Å; R279-Q282 WeakPolarHBondContact O-CB 3.42Å; R279-Q282 PolarHBondContact O-N 3.45Å
280Q97.5Very high97.5Very high39 Ų3952.8 Ų52.818%0.18226%0.264CS..THydrogen-bonded Turntrans-54.9-27.4173.8-59.487.7-17.400112.6L278 Q282 H303 F306 F307L278-Q280 VanDerWaalsContact C-OE1 3.29Å; L278-Q280 PolarHBondContact O-N 3.11Å; Q280-Q282 VanDerWaalsContact C-N 3.32Å; Q280-H303 VanDerWaalsContact CA-CD2 3.49Å; Q280-H303 WeakPolarHBondContact CA-CD2 3.48Å; Q280-H303 HydrophobicContact CB-CB 4.24Å; Q280-H303 HydrophobicContact CG-CB 4.33Å; Q280-F306 HydrophobicContact CB-CD1 3.7Å; Q280-F306 HydrophobicContact CB-CE1 3.78Å; Q280-F306 HydrophobicContact CG-CD1 3.63Å; Q280-F306 HydrophobicContact CG-CE1 3.93Å; Q280-F306 HydrophobicContact CG-CG 4.05Å; Q280-F307 HydrophobicContact CB-CE1 4.06Å; Q280-F307 HydrophobicContact CB-CZ 3.97Å; Q280-F307 WeakPolarHBondContact O-CZ 3.46Å
281F98.3Very high97.5Very high0 Ų047.3 Ų47.30%024%0.238CC..Hα-helixtrans-80.4-7.7177-67.6-86.1000114I258 P259 M262 L273 L278 R279 A285 F306 F307 V312 L316I258-F281 HydrophobicContact CD1-CD2 4.47Å; I258-F281 HydrophobicContact CG2-CB 4.1Å; I258-F281 HydrophobicContact CG2-CD1 3.72Å; I258-F281 HydrophobicContact CG2-CE1 4.29Å; I258-F281 HydrophobicContact CG2-CG 3.91Å; P259-F281 HydrophobicContact CG-CE1 3.81Å; P259-F281 HydrophobicContact CG-CZ 4.47Å; M262-F281 HydrophobicContact CE-CD1 4.16Å; L273-F281 HydrophobicContact CD1-CB 4.34Å; L273-F281 HydrophobicContact CD2-CB 4.12Å; L278-F281 HydrophobicContact CB-CD2 3.96Å; L278-F281 HydrophobicContact CB-CE2 4.36Å; L278-F281 HydrophobicContact CD2-CE2 4.13Å; L278-F281 PolarHBondContact O-N 3.04Å; R279-F281 PolarHBondContact O-N 3.34Å; R279-F281 VanDerWaalsContact O-N 3.07Å; F281-A285 WeakPolarHBondContact O-CB 3.31Å; F281-A285 PolarHBondContact O-N 3.38Å; F281-F306 AromaticContact CE2-CE1 3.86Å; F281-F306 HydrophobicContact CE2-CE1 3.86Å; F281-F306 HydrophobicContact CE2-CZ 4.28Å; F281-F306 HydrophobicContact CZ-CE1 4.39Å; F281-F307 HydrophobicContact CD1-CE1 4.14Å; F281-F307 HydrophobicContact CD2-CE1 4.45Å; F281-F307 HydrophobicContact CE1-CD1 4.43Å; F281-F307 AromaticContact CE1-CE1 3.89Å; F281-F307 HydrophobicContact CE1-CE1 3.89Å; F281-F307 HydrophobicContact CE2-CE1 4.24Å; F281-F307 HydrophobicContact CG-CE1 4.43Å; F281-F307 HydrophobicContact CZ-CD1 4.34Å; F281-F307 AromaticContact CZ-CE1 3.97Å; F281-F307 HydrophobicContact CZ-CE1 3.97Å; F281-V312 HydrophobicContact CZ-CG2 4.35Å; F281-L316 HydrophobicContact CD1-CD2 4.16Å; F281-L316 HydrophobicContact CE1-CD1 4.01Å; F281-L316 HydrophobicContact CE1-CD2 3.97Å; F281-L316 HydrophobicContact CE1-CG 4.47Å
282Q97.8Very high97.4Very high49 Ų4945.5 Ų45.523%0.22922%0.221CC..Hα-helixtrans-66.3-51.7-173.7-177161.51.400111.4E270 L273 R279 Q280 I284 A285 D286E270-Q282 PolarHBondContact OE1-NE2 2.86Å; L273-Q282 HydrophobicContact CD1-CB 3.96Å; R279-Q282 WeakPolarHBondContact O-CB 3.42Å; R279-Q282 PolarHBondContact O-N 3.45Å; Q280-Q282 VanDerWaalsContact C-N 3.32Å; Q282-I284 VanDerWaalsContact C-N 3.3Å; Q282-I284 PolarHBondContact O-N 3.2Å; Q282-A285 PolarHBondContact O-N 3.47Å; Q282-A285 VanDerWaalsContact O-N 3.17Å; Q282-D286 PolarHBondContact O-N 3.09Å
283D97.3Very high97.3Very high58 Ų5843.2 Ų43.231%0.3121%0.209SC..Hα-helixtrans-69.1-30.3-178.9-71-39.1000112.6S287 K295 A299D283-S287 WeakPolarHBondContact O-CB 3.41Å; D283-S287 PolarHBondContact O-N 3.49Å; D283-S287 PolarHBondContact O-OG 3.5Å; D283-K295 VanDerWaalsContact CB-CE 3.49Å; D283-K295 VanDerWaalsContact CG-CE 3.48Å; D283-K295 WeakPolarHBondContact OD1-CE 3.49Å; D283-K295 IonicContact OD1-NZ 2.97Å; D283-K295 PolarHBondContact OD1-NZ 2.76Å; D283-A299 HydrophobicContact CB-CB 3.63Å
284I98.2Very high97.2Very high0 Ų050.7 Ų50.70%024%0.238CC..Hα-helixtrans-63.6-49.3169.9-57.7-66.1000110.7M262 Q282 D286 S287 V288 M296 A299 L300 F307 L316 L319M262-I284 HydrophobicContact CE-CG2 4.04Å; M262-I284 HydrophobicContact SD-CG2 4.48Å; Q282-I284 VanDerWaalsContact C-N 3.3Å; Q282-I284 PolarHBondContact O-N 3.2Å; I284-D286 VanDerWaalsContact C-N 3.32Å; I284-D286 PolarHBondContact O-N 3.06Å; I284-S287 WeakPolarHBondContact O-CB 3.28Å; I284-S287 PolarHBondContact O-N 3.17Å; I284-S287 VanDerWaalsContact O-N 3.16Å; I284-V288 WeakPolarHBondContact O-CG2 3.38Å; I284-V288 PolarHBondContact O-N 3.16Å; I284-M296 HydrophobicContact CD1-CG 4.18Å; I284-A299 HydrophobicContact CD1-CB 3.64Å; I284-A299 HydrophobicContact CG1-CB 4.17Å; I284-L300 HydrophobicContact CD1-CD2 3.85Å; I284-L300 HydrophobicContact CD1-CG 3.79Å; I284-F307 HydrophobicContact CG1-CE2 4.34Å; I284-F307 HydrophobicContact CG1-CZ 4.13Å; I284-L316 HydrophobicContact CG2-CD2 4.24Å; I284-L319 HydrophobicContact CG2-CD1 3.97Å
285A97.8Very high97.1Very high7 Ų751.3 Ų51.36%0.05823%0.234CC..Hα-helixtrans-61.4-40.8179.500000112.1M262 L267 P268 F281 Q282 S287 V288 K289M262-A285 HydrophobicContact SD-CB 3.88Å; L267-A285 HydrophobicContact CD2-CB 4.39Å; P268-A285 HydrophobicContact CG-CB 3.83Å; F281-A285 WeakPolarHBondContact O-CB 3.31Å; F281-A285 PolarHBondContact O-N 3.38Å; Q282-A285 PolarHBondContact O-N 3.47Å; Q282-A285 VanDerWaalsContact O-N 3.17Å; A285-S287 VanDerWaalsContact C-N 3.34Å; A285-V288 PolarHBondContact O-N 2.96Å; A285-K289 WeakPolarHBondContact O-CB 3.43Å; A285-K289 PolarHBondContact O-N 2.79Å
286D97.4Very high97Very high58 Ų5845 Ų4531%0.3121%0.207SC..Hα-helixtrans-63.4-40174.8-77.4-14.1000112.1Q282 I284 K289 T290 K295Q282-D286 PolarHBondContact O-N 3.09Å; I284-D286 VanDerWaalsContact C-N 3.32Å; I284-D286 PolarHBondContact O-N 3.06Å; D286-K289 WeakPolarHBondContact O-CB 3.43Å; D286-K289 PolarHBondContact O-N 3.47Å; D286-T290 WeakPolarHBondContact O-CB 3.33Å; D286-T290 WeakPolarHBondContact O-CG2 3.47Å; D286-T290 PolarHBondContact O-N 2.9Å; D286-T290 PolarHBondContact O-OG1 2.94Å; D286-K295 HydrophobicContact CB-CD 4.44Å; D286-K295 IonicContact OD2-NZ 2.67Å; D286-K295 PolarHBondContact OD2-NZ 3.01Å
287S97.7Very high96.9Very high0 Ų046.8 Ų46.80%022%0.217CC..Hα-helixtrans-65.5-43177.8-57.60000111.5D283 I284 A285 K289 T290 G291 N292 K295 M296D283-S287 WeakPolarHBondContact O-CB 3.41Å; D283-S287 PolarHBondContact O-N 3.49Å; D283-S287 PolarHBondContact O-OG 3.5Å; I284-S287 WeakPolarHBondContact O-CB 3.28Å; I284-S287 PolarHBondContact O-N 3.17Å; I284-S287 VanDerWaalsContact O-N 3.16Å; A285-S287 VanDerWaalsContact C-N 3.34Å; S287-K289 VanDerWaalsContact C-N 3.31Å; S287-K289 PolarHBondContact O-N 3.02Å; S287-T290 PolarHBondContact O-N 3.45Å; S287-G291 WeakPolarHBondContact O-CA 3.44Å; S287-G291 PolarHBondContact O-N 3.3Å; S287-N292 WeakPolarHBondContact CB-O 3.48Å; S287-N292 PolarHBondContact O-N 3.12Å; S287-K295 VanDerWaalsContact OG-C 3.3Å; S287-K295 WeakPolarHBondContact OG-CB 3.35Å; S287-K295 VanDerWaalsContact OG-CG 3.27Å; S287-K295 WeakPolarHBondContact OG-CG 3.5Å; S287-M296 PolarHBondContact OG-N 3.43Å; S287-M296 VanDerWaalsContact OG-N 3.11Å
288V96.4Very high96.8Very high6 Ų644.5 Ų44.54%0.03621%0.209CC..Hα-helixtrans-59-41.4172.11760000111.8L267 I284 A285 L319 T322 V323 S326L267-V288 HydrophobicContact CD2-CB 4.09Å; L267-V288 HydrophobicContact CD2-CG1 3.83Å; I284-V288 WeakPolarHBondContact O-CG2 3.38Å; I284-V288 PolarHBondContact O-N 3.16Å; A285-V288 PolarHBondContact O-N 2.96Å; V288-L319 HydrophobicContact CG2-CB 4.01Å; V288-L319 HydrophobicContact CG2-CD1 4.37Å; V288-L319 HydrophobicContact CG2-CD2 4.28Å; V288-L319 HydrophobicContact CG2-CG 4.47Å; V288-T322 HydrophobicContact CG1-CG2 3.78Å; V288-V323 HydrophobicContact CG2-CG2 4.02Å; V288-S326 WeakPolarHBondContact O-CB 3.45Å; V288-S326 PolarHBondContact O-OG 3.12Å
289K95.1Very high96.8Very high150 Ų15044.6 Ų44.665%0.65221%0.21SC*.Hα-helixtrans-67.6-44.2178-171-179.4175.1-174.40112.8L267 A285 D286 S287L267-K289 HydrophobicContact CD1-CB 3.65Å; L267-K289 HydrophobicContact CD1-CD 4.22Å; L267-K289 HydrophobicContact CD1-CG 3.99Å; A285-K289 WeakPolarHBondContact O-CB 3.43Å; A285-K289 PolarHBondContact O-N 2.79Å; D286-K289 WeakPolarHBondContact O-CB 3.43Å; D286-K289 PolarHBondContact O-N 3.47Å; S287-K289 VanDerWaalsContact C-N 3.31Å; S287-K289 PolarHBondContact O-N 3.02Å
290T95.4Very high96.8Very high53 Ų5337.7 Ų37.733%0.32518%0.184SC..Hα-helixtrans-93.4-15.6-169.6580000113.5D286 S287 N292 R330D286-T290 WeakPolarHBondContact O-CB 3.33Å; D286-T290 WeakPolarHBondContact O-CG2 3.47Å; D286-T290 PolarHBondContact O-N 2.9Å; D286-T290 PolarHBondContact O-OG1 2.94Å; S287-T290 PolarHBondContact O-N 3.45Å; T290-N292 VanDerWaalsContact C-N 3.33Å; T290-N292 WeakPolarHBondContact OG1-CB 3.39Å; T290-R330 WeakPolarHBondContact O-CD 3.35Å; T290-R330 PolarHBondContact O-NH1 3.21Å
291G95.7Very high96.8Very high0 Ų042 Ų420%020%0.204CC..THydrogen-bonded Turntrans7227.1-17200000112.9S287 L293 V323 L327S287-G291 WeakPolarHBondContact O-CA 3.44Å; S287-G291 PolarHBondContact O-N 3.3Å; G291-L293 PolarHBondContact O-N 3.14Å; G291-V323 VanDerWaalsContact C-CG1 3.45Å; G291-V323 WeakPolarHBondContact CA-O 3.11Å; G291-L327 WeakPolarHBondContact O-CB 3.33Å
292N96.7Very high96.8Very high49 Ų4947.7 Ų47.726%0.26223%0.234SC..  trans-91.796.1-179.9-171.7-22.8000109.9S287 T290 R294 K295 M296S287-N292 WeakPolarHBondContact CB-O 3.48Å; S287-N292 PolarHBondContact O-N 3.12Å; T290-N292 VanDerWaalsContact C-N 3.33Å; T290-N292 WeakPolarHBondContact OG1-CB 3.39Å; N292-R294 PolarHBondContact OD1-N 3.19Å; N292-K295 HydrophobicContact CB-CB 3.95Å; N292-K295 VanDerWaalsContact CG-CB 3.42Å; N292-K295 PolarHBondContact OD1-N 3.48Å; N292-M296 PolarHBondContact O-N 3.04Å
293L95.3Very high96.7Very high1 Ų148 Ų481%0.00524%0.236CC..Hα-helixtrans-65.3-44.9-179.5-69.2158.7000111.3G291 K295 M296 D297 V323 Y324 L327 L349 M352 V354G291-L293 PolarHBondContact O-N 3.14Å; L293-K295 VanDerWaalsContact C-N 3.31Å; L293-K295 PolarHBondContact O-N 3.18Å; L293-M296 WeakPolarHBondContact O-CA 3.44Å; L293-M296 VanDerWaalsContact O-CB 3.28Å; L293-M296 WeakPolarHBondContact O-CB 3.5Å; L293-M296 PolarHBondContact O-N 3.12Å; L293-D297 PolarHBondContact O-N 3.35Å; L293-V323 HydrophobicContact CB-CG1 4.39Å; L293-V323 HydrophobicContact CD2-CB 3.72Å; L293-V323 HydrophobicContact CD2-CG1 3.53Å; L293-V323 HydrophobicContact CG-CB 4.4Å; L293-V323 HydrophobicContact CG-CG1 3.69Å; L293-Y324 HydrophobicContact CD1-CD1 3.54Å; L293-Y324 HydrophobicContact CD1-CE1 3.28Å; L293-Y324 HydrophobicContact CD1-CG 4.3Å; L293-Y324 HydrophobicContact CD2-CD1 4.27Å; L293-Y324 HydrophobicContact CD2-CD2 4.16Å; L293-Y324 HydrophobicContact CD2-CE1 4.17Å; L293-Y324 HydrophobicContact CD2-CE2 4.04Å; L293-Y324 HydrophobicContact CD2-CG 4.24Å; L293-Y324 HydrophobicContact CG-CD1 4.48Å; L293-Y324 HydrophobicContact CG-CE1 4.37Å; L293-L327 HydrophobicContact CD1-CD2 4.01Å; L293-L349 HydrophobicContact CD1-CD2 3.83Å; L293-M352 HydrophobicContact CB-CB 4.05Å; L293-M352 HydrophobicContact CD1-CB 4.31Å; L293-V354 HydrophobicContact CD1-CG2 4.23Å
294R95.5Very high96.7Very high162 Ų16249.8 Ų49.861%0.61124%0.242SC*.Hα-helixtrans-53-46.7176.3-163.8173.7176.4167.11.9112.9N292 M296 D297 S298 M352N292-R294 PolarHBondContact OD1-N 3.19Å; R294-M296 VanDerWaalsContact C-N 3.29Å; R294-M296 PolarHBondContact O-N 2.8Å; R294-D297 PolarHBondContact O-N 2.73Å; R294-S298 PolarHBondContact O-N 2.96Å; R294-S298 PolarHBondContact O-OG 3Å; R294-S298 VanDerWaalsContact O-OG 3.13Å; R294-M352 WeakPolarHBondContact CB-O 3.43Å
295K96.2Very high96.7Very high61 Ų6153.6 Ų53.627%0.26527%0.274SS..Hα-helixtrans-64.4-35.1177.1-174.5-179.4174.51710111.4D283 D286 S287 N292 L293 A299D283-K295 VanDerWaalsContact CB-CE 3.49Å; D283-K295 VanDerWaalsContact CG-CE 3.48Å; D283-K295 WeakPolarHBondContact OD1-CE 3.49Å; D283-K295 IonicContact OD1-NZ 2.97Å; D283-K295 PolarHBondContact OD1-NZ 2.76Å; D286-K295 HydrophobicContact CB-CD 4.44Å; D286-K295 IonicContact OD2-NZ 2.67Å; D286-K295 PolarHBondContact OD2-NZ 3.01Å; S287-K295 VanDerWaalsContact OG-C 3.3Å; S287-K295 WeakPolarHBondContact OG-CB 3.35Å; S287-K295 VanDerWaalsContact OG-CG 3.27Å; S287-K295 WeakPolarHBondContact OG-CG 3.5Å; N292-K295 HydrophobicContact CB-CB 3.95Å; N292-K295 VanDerWaalsContact CG-CB 3.42Å; N292-K295 PolarHBondContact OD1-N 3.48Å; L293-K295 VanDerWaalsContact C-N 3.31Å; L293-K295 PolarHBondContact O-N 3.18Å; K295-A299 WeakPolarHBondContact O-CB 3.4Å; K295-A299 PolarHBondContact O-N 3.1Å
296M96.4Very high96.7Very high0 Ų055 Ų550%028%0.278CS..Hα-helixtrans-66.3-46.9176.1-173.5173.9174.200111.4I284 S287 N292 L293 R294 A299 L300 L316 L319 K320 V323I284-M296 HydrophobicContact CD1-CG 4.18Å; S287-M296 PolarHBondContact OG-N 3.43Å; S287-M296 VanDerWaalsContact OG-N 3.11Å; N292-M296 PolarHBondContact O-N 3.04Å; L293-M296 WeakPolarHBondContact O-CA 3.44Å; L293-M296 VanDerWaalsContact O-CB 3.28Å; L293-M296 WeakPolarHBondContact O-CB 3.5Å; L293-M296 PolarHBondContact O-N 3.12Å; R294-M296 VanDerWaalsContact C-N 3.29Å; R294-M296 PolarHBondContact O-N 2.8Å; M296-A299 PolarHBondContact O-N 3Å; M296-L300 HydrophobicContact CE-CD1 4.07Å; M296-L300 HydrophobicContact CG-CD1 4.32Å; M296-L300 WeakPolarHBondContact O-CG 3.35Å; M296-L300 PolarHBondContact O-N 3.32Å; M296-L316 WeakPolarHBondContact CE-O 3.41Å; M296-L319 HydrophobicContact CE-CB 3.69Å; M296-K320 HydrophobicContact CE-CB 4.46Å; M296-K320 HydrophobicContact CE-CG 3.65Å; M296-K320 HydrophobicContact SD-CB 4.35Å; M296-K320 HydrophobicContact SD-CG 3.65Å; M296-V323 HydrophobicContact CB-CG2 4.49Å; M296-V323 HydrophobicContact CG-CG2 4.48Å; M296-V323 HydrophobicContact SD-CB 4.29Å; M296-V323 HydrophobicContact SD-CG2 3.32Å; M296-V323 WeakPolarHBondContact SD-CG2 3.4Å
297D96.1Very high96.7Very high47 Ų4752.2 Ų52.225%0.25126%0.264SS..Hα-helixtrans-63.2-48.8-179.9-69.4-40.8000110.8L293 R294 A299 L300 E301 K320L293-D297 PolarHBondContact O-N 3.35Å; R294-D297 PolarHBondContact O-N 2.73Å; D297-A299 VanDerWaalsContact C-N 3.32Å; D297-A299 PolarHBondContact O-N 2.71Å; D297-L300 PolarHBondContact O-N 2.7Å; D297-L300 VanDerWaalsContact O-N 3.11Å; D297-E301 WeakPolarHBondContact O-CG 3.44Å; D297-E301 PolarHBondContact O-N 3.05Å; D297-K320 WeakPolarHBondContact OD1-CE 3.26Å; D297-K320 IonicContact OD1-NZ 2.63Å; D297-K320 PolarHBondContact OD1-NZ 3.37Å
298S96.7Very high96.7Very high48 Ų4856.6 Ų56.634%0.33629%0.287SS..Hα-helixtrans-58.2-42.1174.3-57.70000112.5R294 L300 E301 D302R294-S298 PolarHBondContact O-N 2.96Å; R294-S298 PolarHBondContact O-OG 3Å; R294-S298 VanDerWaalsContact O-OG 3.13Å; S298-L300 VanDerWaalsContact C-N 3.33Å; S298-L300 PolarHBondContact O-N 3.38Å; S298-E301 PolarHBondContact O-N 3.45Å; S298-D302 VanDerWaalsContact O-CB 3.28Å; S298-D302 WeakPolarHBondContact O-CB 3.49Å; S298-D302 PolarHBondContact O-N 3.03Å
299A97.4Very high96.6Very high2 Ų261 Ų612%0.01732%0.318CS..Hα-helixtrans-68.5-30.3178.400000113.4D283 I284 K295 M296 D297 H303D283-A299 HydrophobicContact CB-CB 3.63Å; I284-A299 HydrophobicContact CD1-CB 3.64Å; I284-A299 HydrophobicContact CG1-CB 4.17Å; K295-A299 WeakPolarHBondContact O-CB 3.4Å; K295-A299 PolarHBondContact O-N 3.1Å; M296-A299 PolarHBondContact O-N 3Å; D297-A299 VanDerWaalsContact C-N 3.32Å; D297-A299 PolarHBondContact O-N 2.71Å; A299-H303 PolarHBondContact O-N 3.37Å
300L97.6Very high96.6Very high1 Ų154.8 Ų54.81%0.00529%0.293CS..Hα-helixtrans-70.9-40172.8-76.5175000111.3I284 M296 D297 S298 H303 E304 F307 Y313 L316 E317I284-L300 HydrophobicContact CD1-CD2 3.85Å; I284-L300 HydrophobicContact CD1-CG 3.79Å; M296-L300 HydrophobicContact CE-CD1 4.07Å; M296-L300 HydrophobicContact CG-CD1 4.32Å; M296-L300 WeakPolarHBondContact O-CG 3.35Å; M296-L300 PolarHBondContact O-N 3.32Å; D297-L300 PolarHBondContact O-N 2.7Å; D297-L300 VanDerWaalsContact O-N 3.11Å; S298-L300 VanDerWaalsContact C-N 3.33Å; S298-L300 PolarHBondContact O-N 3.38Å; L300-H303 CarbonylContact O-C 3.11Å; L300-E304 WeakPolarHBondContact O-CA 3.23Å; L300-E304 WeakPolarHBondContact O-CB 3.46Å; L300-E304 PolarHBondContact O-N 2.91Å; L300-F307 HydrophobicContact CD2-CD2 4.1Å; L300-F307 HydrophobicContact CD2-CE2 4.2Å; L300-Y313 HydrophobicContact CB-CE2 4.23Å; L300-Y313 HydrophobicContact CD2-CE2 4.37Å; L300-L316 HydrophobicContact CD2-CB 3.84Å; L300-L316 HydrophobicContact CD2-CD1 4.29Å; L300-E317 HydrophobicContact CD1-CG 4.15Å
301E97.1Very high96.5Very high129 Ų12954.8 Ų54.860%0.60330%0.304SS*.Hα-helixtrans-67.7-52.6176.6-71.1171.6-176.200111.6D297 S298 H303 E304D297-E301 WeakPolarHBondContact O-CG 3.44Å; D297-E301 PolarHBondContact O-N 3.05Å; S298-E301 PolarHBondContact O-N 3.45Å; E301-H303 PolarHBondContact O-N 2.74Å; E301-E304 WeakPolarHBondContact O-CB 3.46Å; E301-E304 PolarHBondContact O-N 3.19Å; E301-E304 VanDerWaalsContact O-N 3.12Å
302D98Very high96.5Very high121 Ų12154.8 Ų54.865%0.64730%0.304SS*.Hα-helixtrans-57.2-25-179.3-73.2-22.6000113S298S298-D302 VanDerWaalsContact O-CB 3.28Å; S298-D302 WeakPolarHBondContact O-CB 3.49Å; S298-D302 PolarHBondContact O-N 3.03Å
303H97.4Very high96.6Very high55 Ų5554.4 Ų54.426%0.25530%0.299SS..THydrogen-bonded Turntrans-123.920.1-177-61.1-29.6000113.4Q280 A299 L300 E301 A305 F306 F307Q280-H303 VanDerWaalsContact CA-CD2 3.49Å; Q280-H303 WeakPolarHBondContact CA-CD2 3.48Å; Q280-H303 HydrophobicContact CB-CB 4.24Å; Q280-H303 HydrophobicContact CG-CB 4.33Å; A299-H303 PolarHBondContact O-N 3.37Å; L300-H303 CarbonylContact O-C 3.11Å; E301-H303 PolarHBondContact O-N 2.74Å; H303-A305 PolarHBondContact O-N 3.24Å; H303-F306 WeakPolarHBondContact O-CB 3.32Å; H303-F306 PolarHBondContact O-N 3.49Å; H303-F307 HydrophobicContact CB-CD2 3.89Å; H303-F307 HydrophobicContact CB-CE2 3.49Å; H303-F307 VanDerWaalsContact CB-CE2 3.49Å; H303-F307 HydrophobicContact CB-CZ 3.97Å; H303-F307 WeakPolarHBondContact O-CD2 3.44Å; H303-F307 PolarHBondContact O-N 2.9Å
304E97.4Very high96.6Very high95 Ų9560.3 Ų60.344%0.44433%0.33SS..Hα-helixtrans-54.4-53-175.1-175.8-174.5179.600111.5L300 E301 F306 F307 L308 Y313L300-E304 WeakPolarHBondContact O-CA 3.23Å; L300-E304 WeakPolarHBondContact O-CB 3.46Å; L300-E304 PolarHBondContact O-N 2.91Å; E301-E304 WeakPolarHBondContact O-CB 3.46Å; E301-E304 PolarHBondContact O-N 3.19Å; E301-E304 VanDerWaalsContact O-N 3.12Å; E304-F306 PolarHBondContact O-N 3.41Å; E304-F307 PolarHBondContact O-N 3.05Å; E304-F307 VanDerWaalsContact O-N 3.12Å; E304-L308 HydrophobicContact CG-CD1 3.64Å; E304-L308 HydrophobicContact CG-CG 4.07Å; E304-L308 WeakPolarHBondContact O-CB 3.25Å; E304-L308 WeakPolarHBondContact O-CG 3.24Å; E304-L308 PolarHBondContact O-N 2.92Å; E304-Y313 HydrophobicContact CB-CE2 4.37Å; E304-Y313 HydrophobicContact CG-CD2 4.27Å; E304-Y313 HydrophobicContact CG-CE2 3.87Å
305A97.5Very high96.6Very high80 Ų8053.3 Ų53.366%0.66130%0.304SS*.Hα-helixtrans-57.7-35.9179.900000112.8H303 S309H303-A305 PolarHBondContact O-N 3.24Å; A305-S309 VanDerWaalsContact O-CB 3.22Å; A305-S309 WeakPolarHBondContact O-CB 3.18Å; A305-S309 PolarHBondContact O-N 3.35Å; A305-S309 PolarHBondContact O-OG 2.83Å
306F97.7Very high96.7Very high36 Ų3650.4 Ų50.416%0.15829%0.292CS..Hα-helixtrans-69.9-47.1176.9171.5-102.8000111.4L278 Q280 F281 H303 E304 S309 C310L278-F306 HydrophobicContact CD2-CZ 4Å; Q280-F306 HydrophobicContact CB-CD1 3.7Å; Q280-F306 HydrophobicContact CB-CE1 3.78Å; Q280-F306 HydrophobicContact CG-CD1 3.63Å; Q280-F306 HydrophobicContact CG-CE1 3.93Å; Q280-F306 HydrophobicContact CG-CG 4.05Å; F281-F306 AromaticContact CE2-CE1 3.86Å; F281-F306 HydrophobicContact CE2-CE1 3.86Å; F281-F306 HydrophobicContact CE2-CZ 4.28Å; F281-F306 HydrophobicContact CZ-CE1 4.39Å; H303-F306 WeakPolarHBondContact O-CB 3.32Å; H303-F306 PolarHBondContact O-N 3.49Å; E304-F306 PolarHBondContact O-N 3.41Å; F306-S309 PolarHBondContact O-OG 3.17Å; F306-C310 WeakPolarHBondContact O-CB 3.49Å; F306-C310 PolarHBondContact O-N 3.33Å; F306-C310 PolarHBondContact O-SG 2.91Å
307F98.2Very high96.6Very high0 Ų053.6 Ų53.60%031%0.306CS..Hα-helixtrans-71.1-34.7-178.9-63.7-44.4000113.2Q280 F281 I284 L300 H303 E304 G311 V312 Y313 L316Q280-F307 HydrophobicContact CB-CE1 4.06Å; Q280-F307 HydrophobicContact CB-CZ 3.97Å; Q280-F307 WeakPolarHBondContact O-CZ 3.46Å; F281-F307 HydrophobicContact CD1-CE1 4.14Å; F281-F307 HydrophobicContact CD2-CE1 4.45Å; F281-F307 HydrophobicContact CE1-CD1 4.43Å; F281-F307 AromaticContact CE1-CE1 3.89Å; F281-F307 HydrophobicContact CE1-CE1 3.89Å; F281-F307 HydrophobicContact CE2-CE1 4.24Å; F281-F307 HydrophobicContact CG-CE1 4.43Å; F281-F307 HydrophobicContact CZ-CD1 4.34Å; F281-F307 AromaticContact CZ-CE1 3.97Å; F281-F307 HydrophobicContact CZ-CE1 3.97Å; I284-F307 HydrophobicContact CG1-CE2 4.34Å; I284-F307 HydrophobicContact CG1-CZ 4.13Å; L300-F307 HydrophobicContact CD2-CD2 4.1Å; L300-F307 HydrophobicContact CD2-CE2 4.2Å; H303-F307 HydrophobicContact CB-CD2 3.89Å; H303-F307 HydrophobicContact CB-CE2 3.49Å; H303-F307 VanDerWaalsContact CB-CE2 3.49Å; H303-F307 HydrophobicContact CB-CZ 3.97Å; H303-F307 WeakPolarHBondContact O-CD2 3.44Å; H303-F307 PolarHBondContact O-N 2.9Å; E304-F307 PolarHBondContact O-N 3.05Å; E304-F307 VanDerWaalsContact O-N 3.12Å; F307-G311 PolarHBondContact O-N 3.4Å; F307-G311 VanDerWaalsContact O-N 3.1Å; F307-V312 HydrophobicContact CB-CG2 4.24Å; F307-V312 HydrophobicContact CD1-CG2 3.98Å; F307-V312 PolarHBondContact O-N 3.07Å; F307-Y313 HydrophobicContact CB-CD2 4.01Å; F307-Y313 PolarHBondContact O-N 3.31Å; F307-L316 HydrophobicContact CB-CD1 4.23Å; F307-L316 HydrophobicContact CD1-CD1 3.35Å; F307-L316 HydrophobicContact CD2-CD1 3.87Å; F307-L316 HydrophobicContact CE1-CD1 3.49Å; F307-L316 VanDerWaalsContact CE1-CD1 3.49Å; F307-L316 HydrophobicContact CE2-CD1 3.97Å; F307-L316 HydrophobicContact CG-CD1 3.56Å; F307-L316 HydrophobicContact CZ-CD1 3.79Å
308L96.3Very high96.5Very high93 Ų9356.6 Ų56.649%0.48732%0.317SS..Hα-helixtrans-66.8-49.1172.8-72.2178.5000111.3E304 C310 G311 Y313E304-L308 HydrophobicContact CG-CD1 3.64Å; E304-L308 HydrophobicContact CG-CG 4.07Å; E304-L308 WeakPolarHBondContact O-CB 3.25Å; E304-L308 WeakPolarHBondContact O-CG 3.24Å; E304-L308 PolarHBondContact O-N 2.92Å; L308-C310 PolarHBondContact O-N 3.33Å; L308-G311 PolarHBondContact O-N 2.83Å; L308-Y313 HydrophobicContact CD2-CD1 4.44Å; L308-Y313 HydrophobicContact CD2-CD2 4.34Å; L308-Y313 HydrophobicContact CD2-CG 3.94Å; L308-Y313 HydrophobicContact CG-CD2 4.33Å; L308-Y313 HydrophobicContact CG-CG 4.4Å
309S94.9Very high96.5Very high99 Ų9954.3 Ų54.369%0.69230%0.301SS*.Hα-helixtrans-62.5-29.317860.80000113A305 F306A305-S309 VanDerWaalsContact O-CB 3.22Å; A305-S309 WeakPolarHBondContact O-CB 3.18Å; A305-S309 PolarHBondContact O-N 3.35Å; A305-S309 PolarHBondContact O-OG 2.83Å; F306-S309 PolarHBondContact O-OG 3.17Å
310C94.8Very high96.4Very high19 Ų1956.7 Ų56.713%0.12831%0.311CS..THydrogen-bonded Turntrans-80.6-13.7173.1-700000114.1I255 Y256 F306 L308 V312I255-C310 HydrophobicContact CG2-CB 3.7Å; Y256-C310 PolarHBondContact OH-O 3.44Å; Y256-C310 VanDerWaalsContact OH-O 3.11Å; F306-C310 WeakPolarHBondContact O-CB 3.49Å; F306-C310 PolarHBondContact O-N 3.33Å; F306-C310 PolarHBondContact O-SG 2.91Å; L308-C310 PolarHBondContact O-N 3.33Å; C310-V312 HydrophobicContact CB-CG2 3.95Å
311G93.4Very high96.1Very high53 Ų5359.2 Ų59.255%0.54633%0.325SS..THydrogen-bonded Turntrans69.431.5-176.500000114.2F307 L308F307-G311 PolarHBondContact O-N 3.4Å; F307-G311 VanDerWaalsContact O-N 3.1Å; L308-G311 PolarHBondContact O-N 2.83Å
312V96.9Very high96Very high0 Ų053.2 Ų53.20%030%0.296CS..  trans-119.3-5.8-177.3-61.90000114.4I255 Y256 P259 F281 F307 C310 L314 I315 L316I255-V312 HydrophobicContact CG2-CG1 3.86Å; Y256-V312 HydrophobicContact CD1-CG1 3.78Å; Y256-V312 HydrophobicContact CE1-CG1 3.88Å; P259-V312 HydrophobicContact CG-CB 4.41Å; F281-V312 HydrophobicContact CZ-CG2 4.35Å; F307-V312 HydrophobicContact CB-CG2 4.24Å; F307-V312 HydrophobicContact CD1-CG2 3.98Å; F307-V312 PolarHBondContact O-N 3.07Å; C310-V312 HydrophobicContact CB-CG2 3.95Å; V312-L314 PolarHBondContact O-N 2.9Å; V312-I315 PolarHBondContact O-N 3.44Å; V312-L316 HydrophobicContact CG2-CD1 4.14Å; V312-L316 WeakPolarHBondContact O-CG 3.37Å; V312-L316 PolarHBondContact O-N 2.93Å
313Y97.2Very high95.9Very high40 Ų4047.4 Ų47.416%0.15727%0.266CS..Hα-helixtrans-51-54.8-178.3-171.7-84.1000112.8L300 E304 F307 L308 I315 L316 E317L300-Y313 HydrophobicContact CB-CE2 4.23Å; L300-Y313 HydrophobicContact CD2-CE2 4.37Å; E304-Y313 HydrophobicContact CB-CE2 4.37Å; E304-Y313 HydrophobicContact CG-CD2 4.27Å; E304-Y313 HydrophobicContact CG-CE2 3.87Å; F307-Y313 HydrophobicContact CB-CD2 4.01Å; F307-Y313 PolarHBondContact O-N 3.31Å; L308-Y313 HydrophobicContact CD2-CD1 4.44Å; L308-Y313 HydrophobicContact CD2-CD2 4.34Å; L308-Y313 HydrophobicContact CD2-CG 3.94Å; L308-Y313 HydrophobicContact CG-CD2 4.33Å; L308-Y313 HydrophobicContact CG-CG 4.4Å; Y313-I315 PolarHBondContact O-N 2.95Å; Y313-L316 WeakPolarHBondContact O-CA 3.45Å; Y313-L316 WeakPolarHBondContact O-CB 3.44Å; Y313-L316 PolarHBondContact O-N 3.33Å; Y313-E317 HydrophobicContact CD1-CG 4.02Å; Y313-E317 HydrophobicContact CE1-CG 3.72Å; Y313-E317 PolarHBondContact O-N 2.71Å
314L94.8Very high95.8Very high126 Ų12646.8 Ų46.866%0.6626%0.261SS*.Hα-helixtrans-61.4-30.2-180-61.6177.7000113.4V312V312-L314 PolarHBondContact O-N 2.9Å
315I96.1Very high95.8Very high15 Ų1543.1 Ų43.18%0.07724%0.243CC..Hα-helixtrans-75.1-36.1176.4-57.3-59.1000110.4M223 P259 L263 V312 Y313 K318M223-I315 HydrophobicContact CE-CD1 4.47Å; M223-I315 HydrophobicContact CE-CG1 3.87Å; M223-I315 HydrophobicContact CG-CD1 4.13Å; M223-I315 HydrophobicContact CG-CG1 4.13Å; M223-I315 HydrophobicContact CG-CG2 4.18Å; M223-I315 HydrophobicContact SD-CG1 4.03Å; M223-I315 HydrophobicContact SD-CG2 4.17Å; P259-I315 HydrophobicContact CB-CG2 3.76Å; L263-I315 HydrophobicContact CD1-CG2 3.81Å; V312-I315 PolarHBondContact O-N 3.44Å; Y313-I315 PolarHBondContact O-N 2.95Å; I315-K318 WeakPolarHBondContact O-CB 3.35Å; I315-K318 PolarHBondContact O-N 3.49Å
316L97.7Very high95.7Very high0 Ų040 Ų400%022%0.217CC..Hα-helixtrans-67.9-38.4174.7-68.8174.1000111.7P259 M262 F281 I284 M296 L300 F307 V312 Y313 K318 L319P259-L316 HydrophobicContact CB-CD2 3.97Å; P259-L316 HydrophobicContact CG-CD2 3.87Å; P259-L316 HydrophobicContact CG-CG 4.41Å; M262-L316 HydrophobicContact CE-CD2 3.89Å; F281-L316 HydrophobicContact CD1-CD2 4.16Å; F281-L316 HydrophobicContact CE1-CD1 4.01Å; F281-L316 HydrophobicContact CE1-CD2 3.97Å; F281-L316 HydrophobicContact CE1-CG 4.47Å; I284-L316 HydrophobicContact CG2-CD2 4.24Å; M296-L316 WeakPolarHBondContact CE-O 3.41Å; L300-L316 HydrophobicContact CD2-CB 3.84Å; L300-L316 HydrophobicContact CD2-CD1 4.29Å; F307-L316 HydrophobicContact CB-CD1 4.23Å; F307-L316 HydrophobicContact CD1-CD1 3.35Å; F307-L316 HydrophobicContact CD2-CD1 3.87Å; F307-L316 HydrophobicContact CE1-CD1 3.49Å; F307-L316 VanDerWaalsContact CE1-CD1 3.49Å; F307-L316 HydrophobicContact CE2-CD1 3.97Å; F307-L316 HydrophobicContact CG-CD1 3.56Å; F307-L316 HydrophobicContact CZ-CD1 3.79Å; V312-L316 HydrophobicContact CG2-CD1 4.14Å; V312-L316 WeakPolarHBondContact O-CG 3.37Å; V312-L316 PolarHBondContact O-N 2.93Å; Y313-L316 WeakPolarHBondContact O-CA 3.45Å; Y313-L316 WeakPolarHBondContact O-CB 3.44Å; Y313-L316 PolarHBondContact O-N 3.33Å; L316-K318 PolarHBondContact O-N 2.9Å; L316-L319 HydrophobicContact CD2-CD1 3.68Å; L316-L319 WeakPolarHBondContact O-CB 3.28Å; L316-L319 PolarHBondContact O-N 3.05Å
317E95.6Very high95.7Very high66 Ų6638.8 Ų38.831%0.30821%0.212SC..Hα-helixtrans-58.3-34174.6-72.4-157.6121.600113.1L300 Y313 L319 K320L300-E317 HydrophobicContact CD1-CG 4.15Å; Y313-E317 HydrophobicContact CD1-CG 4.02Å; Y313-E317 HydrophobicContact CE1-CG 3.72Å; Y313-E317 PolarHBondContact O-N 2.71Å; E317-L319 PolarHBondContact O-N 2.77Å; E317-K320 VanDerWaalsContact O-CB 3.24Å; E317-K320 WeakPolarHBondContact O-CB 3.22Å; E317-K320 VanDerWaalsContact O-CG 3.29Å; E317-K320 WeakPolarHBondContact O-CG 3.22Å; E317-K320 PolarHBondContact O-N 2.74Å
318K94.8Very high95.6Very high110 Ų11038.8 Ų38.848%0.47821%0.212SC..THydrogen-bonded Turntrans-59.9-20.3174.3-67.9179.6179.5-68.60113.1F228 L263 I315 L316 K320F228-K318 HydrophobicContact CZ-CD 3.99Å; L263-K318 HydrophobicContact CD2-CB 3.98Å; I315-K318 WeakPolarHBondContact O-CB 3.35Å; I315-K318 PolarHBondContact O-N 3.49Å; L316-K318 PolarHBondContact O-N 2.9Å; K318-K320 PolarHBondContact O-N 3.16Å
319L96Very high95.6Very high0 Ų039.3 Ų39.30%021%0.21CC..THydrogen-bonded Turntrans-69.8-16.1173.4-64.2162.1000112.9M262 L263 I284 V288 M296 L316 E317 L321 T322 V323M262-L319 HydrophobicContact CB-CD1 4.12Å; M262-L319 HydrophobicContact CB-CD2 3.63Å; M262-L319 HydrophobicContact CE-CD1 3.65Å; M262-L319 HydrophobicContact SD-CD1 4.44Å; L263-L319 HydrophobicContact CB-CD2 4.34Å; L263-L319 HydrophobicContact CD2-CD2 3.66Å; L263-L319 HydrophobicContact CD2-CG 4.02Å; L263-L319 HydrophobicContact CG-CD2 3.68Å; L263-L319 HydrophobicContact CG-CG 4.2Å; I284-L319 HydrophobicContact CG2-CD1 3.97Å; V288-L319 HydrophobicContact CG2-CB 4.01Å; V288-L319 HydrophobicContact CG2-CD1 4.37Å; V288-L319 HydrophobicContact CG2-CD2 4.28Å; V288-L319 HydrophobicContact CG2-CG 4.47Å; M296-L319 HydrophobicContact CE-CB 3.69Å; L316-L319 HydrophobicContact CD2-CD1 3.68Å; L316-L319 WeakPolarHBondContact O-CB 3.28Å; L316-L319 PolarHBondContact O-N 3.05Å; E317-L319 PolarHBondContact O-N 2.77Å; L319-L321 PolarHBondContact O-N 3.21Å; L319-T322 CarbonylContact O-C 3.36Å; L319-T322 WeakPolarHBondContact O-CA 3.32Å; L319-T322 VanDerWaalsContact O-CB 3.28Å; L319-T322 WeakPolarHBondContact O-CB 3.39Å; L319-T322 PolarHBondContact O-N 3.26Å; L319-V323 PolarHBondContact O-N 3.05Å
320K94.7Very high95.6Very high53 Ų5340.7 Ų40.723%0.2320%0.2CC..Hα-helixtrans-54.8-42.1176.8-73.5-176.6174.6-170.20111M296 D297 E317 K318 T322 V323 Y324M296-K320 HydrophobicContact CE-CB 4.46Å; M296-K320 HydrophobicContact CE-CG 3.65Å; M296-K320 HydrophobicContact SD-CB 4.35Å; M296-K320 HydrophobicContact SD-CG 3.65Å; D297-K320 WeakPolarHBondContact OD1-CE 3.26Å; D297-K320 IonicContact OD1-NZ 2.63Å; D297-K320 PolarHBondContact OD1-NZ 3.37Å; E317-K320 VanDerWaalsContact O-CB 3.24Å; E317-K320 WeakPolarHBondContact O-CB 3.22Å; E317-K320 VanDerWaalsContact O-CG 3.29Å; E317-K320 WeakPolarHBondContact O-CG 3.22Å; E317-K320 PolarHBondContact O-N 2.74Å; K318-K320 PolarHBondContact O-N 3.16Å; K320-T322 PolarHBondContact O-N 2.88Å; K320-V323 CarbonylContact O-C 3.44Å; K320-V323 WeakPolarHBondContact O-CA 3.43Å; K320-V323 WeakPolarHBondContact O-CB 3.26Å; K320-V323 PolarHBondContact O-N 3.49Å; K320-Y324 HydrophobicContact CB-CE2 4.32Å; K320-Y324 WeakPolarHBondContact O-CD2 3.3Å; K320-Y324 PolarHBondContact O-N 2.95Å
321L92.3Very high95.6Very high54 Ų5440.3 Ų40.328%0.28320%0.197SC..Hα-helixtrans-57-38173.3-70.1173.5000112.7L319 R325 L369L319-L321 PolarHBondContact O-N 3.21Å; L321-R325 PolarHBondContact O-N 3.19Å; L321-R325 VanDerWaalsContact O-N 3.08Å; L321-L369 WeakPolarHBondContact O-CD2 3.42Å
322T93.7Very high95.7Very high2 Ų238.4 Ų38.41%0.01218%0.176CC..Hα-helixtrans-71.4-35.1175.5-53.80000111.7V288 L319 K320 R325 S326 L397V288-T322 HydrophobicContact CG1-CG2 3.78Å; L319-T322 CarbonylContact O-C 3.36Å; L319-T322 WeakPolarHBondContact O-CA 3.32Å; L319-T322 VanDerWaalsContact O-CB 3.28Å; L319-T322 WeakPolarHBondContact O-CB 3.39Å; L319-T322 PolarHBondContact O-N 3.26Å; K320-T322 PolarHBondContact O-N 2.88Å; T322-R325 WeakPolarHBondContact O-CB 3.44Å; T322-R325 PolarHBondContact O-N 3.3Å; T322-S326 PolarHBondContact O-N 3.36Å; T322-S326 PolarHBondContact O-OG 3.36Å; T322-L397 HydrophobicContact CG2-CD1 3.41Å; T322-L397 VanDerWaalsContact CG2-CD1 3.41Å; T322-L397 HydrophobicContact CG2-CD2 4.29Å; T322-L397 HydrophobicContact CG2-CG 4.49Å
323V96.9Very high95.5Very high0 Ų045.5 Ų45.50%021%0.208CC..Hα-helixtrans-65.1-46.4173.1-175.50000111V288 G291 L293 M296 L319 K320 R325 S326 L327V288-V323 HydrophobicContact CG2-CG2 4.02Å; G291-V323 VanDerWaalsContact C-CG1 3.45Å; G291-V323 WeakPolarHBondContact CA-O 3.11Å; L293-V323 HydrophobicContact CB-CG1 4.39Å; L293-V323 HydrophobicContact CD2-CB 3.72Å; L293-V323 HydrophobicContact CD2-CG1 3.53Å; L293-V323 HydrophobicContact CG-CB 4.4Å; L293-V323 HydrophobicContact CG-CG1 3.69Å; M296-V323 HydrophobicContact CB-CG2 4.49Å; M296-V323 HydrophobicContact CG-CG2 4.48Å; M296-V323 HydrophobicContact SD-CB 4.29Å; M296-V323 HydrophobicContact SD-CG2 3.32Å; M296-V323 WeakPolarHBondContact SD-CG2 3.4Å; L319-V323 PolarHBondContact O-N 3.05Å; K320-V323 CarbonylContact O-C 3.44Å; K320-V323 WeakPolarHBondContact O-CA 3.43Å; K320-V323 WeakPolarHBondContact O-CB 3.26Å; K320-V323 PolarHBondContact O-N 3.49Å; V323-R325 VanDerWaalsContact C-N 3.31Å; V323-R325 PolarHBondContact O-N 2.9Å; V323-S326 PolarHBondContact O-N 3.11Å; V323-L327 PolarHBondContact O-N 3.13Å
324Y96Very high95.3Very high42 Ų4249.3 Ų49.317%0.16523%0.23CC..Hα-helixtrans-53.4-48.5172.8-77.2-68.8000111.3L293 K320 S326 L327 F328 L349 I365L293-Y324 HydrophobicContact CD1-CD1 3.54Å; L293-Y324 HydrophobicContact CD1-CE1 3.28Å; L293-Y324 HydrophobicContact CD1-CG 4.3Å; L293-Y324 HydrophobicContact CD2-CD1 4.27Å; L293-Y324 HydrophobicContact CD2-CD2 4.16Å; L293-Y324 HydrophobicContact CD2-CE1 4.17Å; L293-Y324 HydrophobicContact CD2-CE2 4.04Å; L293-Y324 HydrophobicContact CD2-CG 4.24Å; L293-Y324 HydrophobicContact CG-CD1 4.48Å; L293-Y324 HydrophobicContact CG-CE1 4.37Å; K320-Y324 HydrophobicContact CB-CE2 4.32Å; K320-Y324 WeakPolarHBondContact O-CD2 3.3Å; K320-Y324 PolarHBondContact O-N 2.95Å; Y324-S326 VanDerWaalsContact C-N 3.34Å; Y324-S326 PolarHBondContact O-N 3.1Å; Y324-L327 WeakPolarHBondContact O-CB 3.47Å; Y324-L327 PolarHBondContact O-N 3.43Å; Y324-F328 HydrophobicContact CD1-CZ 4.22Å; Y324-F328 VanDerWaalsContact O-CG 3.31Å; Y324-F328 WeakPolarHBondContact O-CG 3.22Å; Y324-F328 PolarHBondContact O-N 3.48Å; Y324-L349 HydrophobicContact CD1-CD2 3.72Å; Y324-L349 HydrophobicContact CE1-CD2 3.49Å; Y324-L349 VanDerWaalsContact CE1-CD2 3.49Å; Y324-I365 HydrophobicContact CD1-CG2 3.95Å; Y324-I365 HydrophobicContact CD2-CG2 4.41Å; Y324-I365 HydrophobicContact CE1-CD1 3.93Å; Y324-I365 HydrophobicContact CE1-CG2 4.36Å; Y324-I365 HydrophobicContact CG-CG2 4Å
325R95.4Very high95.3Very high18 Ų1846.9 Ų46.97%0.06822%0.216CC..Hα-helixtrans-56.9-45.8175.2-178.5-162.1161.1-89.34.9112L321 T322 V323 K329 L369 K374 F394 P395L321-R325 PolarHBondContact O-N 3.19Å; L321-R325 VanDerWaalsContact O-N 3.08Å; T322-R325 WeakPolarHBondContact O-CB 3.44Å; T322-R325 PolarHBondContact O-N 3.3Å; V323-R325 VanDerWaalsContact C-N 3.31Å; V323-R325 PolarHBondContact O-N 2.9Å; R325-K329 VanDerWaalsContact O-CB 3.31Å; R325-K329 WeakPolarHBondContact O-CB 3.33Å; R325-K329 PolarHBondContact O-N 3.23Å; R325-L369 HydrophobicContact CB-CD2 4.23Å; R325-K374 HydrophobicContact CG-CB 4.14Å; R325-K374 PolarHBondContact NE-O 3.21Å; R325-F394 HydrophobicContact CG-CD1 4.04Å; R325-P395 PolarHBondContact NH2-O 3.46Å
326S96.1Very high94.9Very high15 Ų1555 Ų5511%0.10525%0.251CS..Hα-helixtrans-65.6-38.3179.1-71.80000112.3V288 T322 V323 Y324 R330V288-S326 WeakPolarHBondContact O-CB 3.45Å; V288-S326 PolarHBondContact O-OG 3.12Å; T322-S326 PolarHBondContact O-N 3.36Å; T322-S326 PolarHBondContact O-OG 3.36Å; V323-S326 PolarHBondContact O-N 3.11Å; Y324-S326 VanDerWaalsContact C-N 3.34Å; Y324-S326 PolarHBondContact O-N 3.1Å; S326-R330 WeakPolarHBondContact O-CG 3.38Å; S326-R330 PolarHBondContact O-N 3.2Å
327L97.2Very high94.6Very high9 Ų957.4 Ų57.45%0.04727%0.266CS..Hα-helixtrans-62.1-53.4174.5178.762000110.7G291 L293 V323 Y324 K329 R330 V331 A348 L349 M352G291-L327 WeakPolarHBondContact O-CB 3.33Å; L293-L327 HydrophobicContact CD1-CD2 4.01Å; V323-L327 PolarHBondContact O-N 3.13Å; Y324-L327 WeakPolarHBondContact O-CB 3.47Å; Y324-L327 PolarHBondContact O-N 3.43Å; L327-K329 VanDerWaalsContact C-N 3.27Å; L327-K329 PolarHBondContact O-N 3.04Å; L327-R330 WeakPolarHBondContact O-CA 3.42Å; L327-R330 WeakPolarHBondContact O-CB 3.27Å; L327-R330 PolarHBondContact O-N 3.46Å; L327-V331 PolarHBondContact O-N 3.1Å; L327-A348 HydrophobicContact CD1-CB 4.43Å; L327-A348 HydrophobicContact CG-CB 4.49Å; L327-L349 HydrophobicContact CD2-CD2 3.73Å; L327-M352 HydrophobicContact CD1-CG 3.94Å; L327-M352 HydrophobicContact CD1-SD 4.22Å; L327-M352 HydrophobicContact CD2-CG 3.73Å; L327-M352 HydrophobicContact CG-CG 4.48Å
328F96.9Very high94.4Very high0 Ų058.1 Ų58.10%027%0.269CS..Hα-helixtrans-66.4-31.1-177.9-62.8-13.6000112.2Y324 R330 V331 C332 F345 L349 I365 L366 L369 I375 F394Y324-F328 HydrophobicContact CD1-CZ 4.22Å; Y324-F328 VanDerWaalsContact O-CG 3.31Å; Y324-F328 WeakPolarHBondContact O-CG 3.22Å; Y324-F328 PolarHBondContact O-N 3.48Å; F328-R330 VanDerWaalsContact C-N 3.28Å; F328-R330 PolarHBondContact O-N 3.26Å; F328-V331 PolarHBondContact O-N 3.24Å; F328-C332 PolarHBondContact O-N 2.96Å; F328-C332 PolarHBondContact O-SG 3.24Å; F328-F345 HydrophobicContact CB-CD1 3.97Å; F328-F345 HydrophobicContact CB-CE1 3.92Å; F328-F345 HydrophobicContact CD1-CB 4.35Å; F328-F345 AromaticContact CD1-CD1 3.56Å; F328-F345 HydrophobicContact CD1-CD1 3.56Å; F328-F345 HydrophobicContact CD1-CE1 4.38Å; F328-F345 HydrophobicContact CD1-CG 4.4Å; F328-F345 HydrophobicContact CD2-CD1 4.39Å; F328-F345 HydrophobicContact CE1-CB 4.03Å; F328-F345 HydrophobicContact CE1-CD1 4.1Å; F328-F345 AromaticContact CG-CD1 3.73Å; F328-F345 HydrophobicContact CG-CD1 3.73Å; F328-F345 HydrophobicContact CG-CE1 4.17Å; F328-F345 HydrophobicContact CZ-CB 4.41Å; F328-L349 HydrophobicContact CE1-CD1 4.22Å; F328-L349 HydrophobicContact CE1-CD2 3.8Å; F328-L349 HydrophobicContact CE1-CG 3.98Å; F328-L349 HydrophobicContact CZ-CD1 3.98Å; F328-L349 HydrophobicContact CZ-CD2 4.04Å; F328-L349 HydrophobicContact CZ-CG 4.22Å; F328-I365 HydrophobicContact CE2-CG2 3.86Å; F328-I365 HydrophobicContact CZ-CG2 4.16Å; F328-L366 HydrophobicContact CD2-CD2 3.38Å; F328-L366 HydrophobicContact CD2-CG 4.32Å; F328-L366 HydrophobicContact CE2-CD2 3.5Å; F328-L366 HydrophobicContact CE2-CG 3.94Å; F328-L366 HydrophobicContact CG-CD2 4.24Å; F328-L366 HydrophobicContact CZ-CD2 4.45Å; F328-L369 HydrophobicContact CD2-CD1 3.56Å; F328-L369 HydrophobicContact CE2-CD1 3.74Å; F328-I375 HydrophobicContact CD2-CD1 4.29Å; F328-F394 HydrophobicContact CB-CE1 4.3Å; F328-F394 HydrophobicContact CB-CZ 4.49Å
329K95.5Very high94.3Very high105 Ų10556.4 Ų56.446%0.45727%0.265SS..Hα-helixtrans-58.4-40.7168.8-176.4179.9177-1740112R325 L327 H333 F394R325-K329 VanDerWaalsContact O-CB 3.31Å; R325-K329 WeakPolarHBondContact O-CB 3.33Å; R325-K329 PolarHBondContact O-N 3.23Å; L327-K329 VanDerWaalsContact C-N 3.27Å; L327-K329 PolarHBondContact O-N 3.04Å; K329-H333 WeakPolarHBondContact O-CB 3.49Å; K329-H333 PolarHBondContact O-N 2.91Å; K329-F394 VanDerWaalsContact CA-CZ 3.42Å; K329-F394 HydrophobicContact CB-CD1 3.77Å; K329-F394 HydrophobicContact CB-CD2 3.99Å; K329-F394 HydrophobicContact CB-CE1 3.87Å; K329-F394 HydrophobicContact CB-CE2 4.13Å; K329-F394 HydrophobicContact CB-CG 3.84Å; K329-F394 HydrophobicContact CB-CZ 4.07Å; K329-F394 HydrophobicContact CD-CB 4.08Å; K329-F394 HydrophobicContact CD-CG 4.22Å; K329-F394 HydrophobicContact CG-CB 4.23Å; K329-F394 HydrophobicContact CG-CD1 4.31Å; K329-F394 HydrophobicContact CG-CD2 3.78Å; K329-F394 HydrophobicContact CG-CE2 4.25Å; K329-F394 HydrophobicContact CG-CG 3.84Å
330R95.3Very high94.3Very high127 Ų12756.4 Ų56.448%0.47927%0.265SS..Hα-helixtrans-69.6-42.8176.5-68.3173.964.4-164.8-3.6111.5T290 S326 L327 F328 C332 H333 I334T290-R330 WeakPolarHBondContact O-CD 3.35Å; T290-R330 PolarHBondContact O-NH1 3.21Å; S326-R330 WeakPolarHBondContact O-CG 3.38Å; S326-R330 PolarHBondContact O-N 3.2Å; L327-R330 WeakPolarHBondContact O-CA 3.42Å; L327-R330 WeakPolarHBondContact O-CB 3.27Å; L327-R330 PolarHBondContact O-N 3.46Å; F328-R330 VanDerWaalsContact C-N 3.28Å; F328-R330 PolarHBondContact O-N 3.26Å; R330-C332 VanDerWaalsContact C-N 3.35Å; R330-C332 PolarHBondContact O-N 3.07Å; R330-H333 WeakPolarHBondContact O-CB 3.43Å; R330-H333 PolarHBondContact O-N 2.98Å; R330-H333 VanDerWaalsContact O-N 3.13Å; R330-I334 VanDerWaalsContact O-CG1 3.31Å; R330-I334 WeakPolarHBondContact O-CG1 3.39Å; R330-I334 PolarHBondContact O-N 3.26Å
331V95.6Very high94.3Very high12 Ų1255.9 Ų55.97%0.07327%0.267CS..Hα-helixtrans-55.5-51.2174.2175.20000110.3L327 F328 H333 I334 M335 V344 F345 A348L327-V331 PolarHBondContact O-N 3.1Å; F328-V331 PolarHBondContact O-N 3.24Å; V331-H333 VanDerWaalsContact C-N 3.27Å; V331-H333 PolarHBondContact O-N 2.94Å; V331-I334 PolarHBondContact O-N 3.45Å; V331-I334 VanDerWaalsContact O-N 3.14Å; V331-M335 HydrophobicContact CG1-CG 4.27Å; V331-M335 VanDerWaalsContact O-CG 3.31Å; V331-M335 WeakPolarHBondContact O-CG 3.37Å; V331-M335 PolarHBondContact O-N 3.25Å; V331-V344 HydrophobicContact CG1-CB 4.43Å; V331-V344 HydrophobicContact CG1-CG1 3.57Å; V331-F345 HydrophobicContact CB-CD1 4.06Å; V331-F345 HydrophobicContact CB-CE1 3.95Å; V331-F345 HydrophobicContact CG1-CD1 3.8Å; V331-F345 HydrophobicContact CG1-CE1 3.7Å; V331-F345 HydrophobicContact CG1-CG 4.48Å; V331-F345 HydrophobicContact CG1-CZ 4.31Å; V331-F345 HydrophobicContact CG2-CD1 4.41Å; V331-A348 HydrophobicContact CG2-CB 3.52Å
332C94.2Very high94.5Very high13 Ų1353.4 Ų53.49%0.08825%0.254CS..Hα-helixtrans-59.7-37.7177.1-67.80000113F328 R330 K336 L340 F394F328-C332 PolarHBondContact O-N 2.96Å; F328-C332 PolarHBondContact O-SG 3.24Å; R330-C332 VanDerWaalsContact C-N 3.35Å; R330-C332 PolarHBondContact O-N 3.07Å; C332-K336 PolarHBondContact O-N 3.36Å; C332-K336 VanDerWaalsContact O-N 3.16Å; C332-L340 HydrophobicContact CB-CD2 4.25Å; C332-F394 HydrophobicContact CB-CE2 3.76Å; C332-F394 HydrophobicContact CB-CZ 4.11Å
333H93Very high94.6Very high149 Ų14960 Ų6069%0.6928%0.284SS*.Hα-helixtrans-66.8-38.6177.1-174.467.9000112.7K329 R330 V331 K336K329-H333 WeakPolarHBondContact O-CB 3.49Å; K329-H333 PolarHBondContact O-N 2.91Å; R330-H333 WeakPolarHBondContact O-CB 3.43Å; R330-H333 PolarHBondContact O-N 2.98Å; R330-H333 VanDerWaalsContact O-N 3.13Å; V331-H333 VanDerWaalsContact C-N 3.27Å; V331-H333 PolarHBondContact O-N 2.94Å; H333-K336 WeakPolarHBondContact O-CG 3.26Å
334I94.4Very high94.6Very high120 Ų12061.9 Ų61.962%0.61530%0.296SS*.Hα-helixtrans-68.2-45.4177.2-68.4164.3000110.4R330 V331 K336R330-I334 VanDerWaalsContact O-CG1 3.31Å; R330-I334 WeakPolarHBondContact O-CG1 3.39Å; R330-I334 PolarHBondContact O-N 3.26Å; V331-I334 PolarHBondContact O-N 3.45Å; V331-I334 VanDerWaalsContact O-N 3.14Å; I334-K336 VanDerWaalsContact C-N 3.32Å; I334-K336 PolarHBondContact O-N 2.99Å
335M93.4Very high94.6Very high74 Ų7459.9 Ų59.937%0.36529%0.288SS..Hα-helixtrans-70.9-24.7-175.7-67.2-58.9-65.900113.6V331 T337 L340 V344V331-M335 HydrophobicContact CG1-CG 4.27Å; V331-M335 VanDerWaalsContact O-CG 3.31Å; V331-M335 WeakPolarHBondContact O-CG 3.37Å; V331-M335 PolarHBondContact O-N 3.25Å; M335-T337 HydrophobicContact CB-CG2 4.06Å; M335-T337 PolarHBondContact O-N 2.94Å; M335-L340 HydrophobicContact CB-CD2 3.64Å; M335-L340 HydrophobicContact CG-CD2 3.88Å; M335-V344 HydrophobicContact CE-CG1 4.44Å; M335-V344 HydrophobicContact CE-CG2 4.06Å; M335-V344 HydrophobicContact CG-CG1 3.94Å; M335-V344 HydrophobicContact SD-CG1 3.79Å; M335-V344 HydrophobicContact SD-CG2 4.43Å
336K89.3Confident94.6Very high185 Ų18559.4 Ų59.480%0.80429%0.287SS*.  trans52.726177.8-60.2-179.7-177.9176.60114.7C332 H333 I334C332-K336 PolarHBondContact O-N 3.36Å; C332-K336 VanDerWaalsContact O-N 3.16Å; H333-K336 WeakPolarHBondContact O-CG 3.26Å; I334-K336 VanDerWaalsContact C-N 3.32Å; I334-K336 PolarHBondContact O-N 2.99Å
337T91.2Very high94.6Very high52 Ų5261.1 Ų61.132%0.31930%0.302SS..  trans-128.1156.8175.9176.70000110.2M335 L339 L340M335-T337 HydrophobicContact CB-CG2 4.06Å; M335-T337 PolarHBondContact O-N 2.94Å; T337-L339 VanDerWaalsContact CG2-O 3.27Å; T337-L339 WeakPolarHBondContact CG2-O 3.43Å; T337-L339 PolarHBondContact OG1-N 2.81Å; T337-L339 PolarHBondContact OG1-O 3.49Å; T337-L340 HydrophobicContact CG2-CG 4.31Å
338H90Very high94.5Very high80 Ų8061.2 Ų61.237%0.3731%0.305SS..SBendtrans-92.1-11175.946.4-76.2000112.7V387 V388H338-V387 WeakPolarHBondContact O-CA 3.47Å; H338-V388 HydrophobicContact CB-CG2 4.28Å; H338-V388 PolarHBondContact O-N 3.47Å
339L93.5Very high94.5Very high74 Ų7461.2 Ų61.239%0.38731%0.305SS..EExtended strand (participates in β ladder)trans-111.7105175.7-59.7174.3000108.1T337 V387T337-L339 VanDerWaalsContact CG2-O 3.27Å; T337-L339 WeakPolarHBondContact CG2-O 3.43Å; T337-L339 PolarHBondContact OG1-N 2.81Å; T337-L339 PolarHBondContact OG1-O 3.49Å; L339-V387 HydrophobicContact CD2-CB 4.15Å; L339-V387 HydrophobicContact CD2-CG1 3.77Å; L339-V387 HydrophobicContact CD2-CG2 3.56Å
340L95.3Very high94.5Very high0 Ų060.9 Ų60.90%030%0.304CS..EExtended strand (participates in β ladder)trans-116.1120.8-171.7-61.6112.2000110.5C332 M335 T337 F345 K385 L386 V388C332-L340 HydrophobicContact CB-CD2 4.25Å; M335-L340 HydrophobicContact CB-CD2 3.64Å; M335-L340 HydrophobicContact CG-CD2 3.88Å; T337-L340 HydrophobicContact CG2-CG 4.31Å; L340-F345 HydrophobicContact CB-CE2 3.51Å; L340-F345 HydrophobicContact CB-CZ 3.72Å; L340-F345 HydrophobicContact CD1-CZ 4.33Å; L340-F345 HydrophobicContact CD2-CE2 4.48Å; L340-F345 HydrophobicContact CD2-CZ 3.93Å; L340-F345 HydrophobicContact CG-CE2 4.46Å; L340-F345 HydrophobicContact CG-CZ 4.19Å; L340-K385 CarbonylContact O-C 3.55Å; L340-K385 VanDerWaalsContact O-CA 3.25Å; L340-K385 WeakPolarHBondContact O-CA 3.34Å; L340-L386 PolarHBondContact N-O 3.41Å; L340-L386 PolarHBondContact O-N 3.48Å; L340-V388 HydrophobicContact CD1-CB 4.49Å; L340-V388 HydrophobicContact CD1-CG1 3.95Å; L340-V388 HydrophobicContact CD1-CG2 3.76Å
341P96.2Very high94.4Very high43 Ų4361.4 Ų61.428%0.27932%0.316SS..EExtended strand (participates in β ladder)trans-59.1138.3172-1930.8000111.1E343 V344P341-E343 PolarHBondContact O-N 3.16Å; P341-V344 HydrophobicContact CB-CG2 4.19Å; P341-V344 HydrophobicContact CG-CG2 4.28Å; P341-V344 PolarHBondContact O-N 3.33Å; P341-V344 VanDerWaalsContact O-N 3.15Å
342I95.9Very high94.3Very high1 Ų162.6 Ų62.61%0.00532%0.321CS..Hα-helixtrans-58.9-37.6179.9-68.8170.5000110.8V344 F345 T346 P359 T362 E363 L379 H384I342-V344 PolarHBondContact O-N 2.97Å; I342-F345 WeakPolarHBondContact O-CA 3.44Å; I342-F345 WeakPolarHBondContact O-CB 3.47Å; I342-F345 PolarHBondContact O-N 3.08Å; I342-T346 PolarHBondContact O-N 3.44Å; I342-T346 PolarHBondContact O-OG1 3.43Å; I342-P359 HydrophobicContact CG2-CB 4.16Å; I342-P359 WeakPolarHBondContact CG2-O 3.43Å; I342-T362 HydrophobicContact CG2-CG2 3.91Å; I342-E363 HydrophobicContact CD1-CB 4.02Å; I342-E363 HydrophobicContact CD1-CG 3.88Å; I342-E363 WeakPolarHBondContact CD1-OE2 3.17Å; I342-L379 HydrophobicContact CD1-CD2 4.42Å; I342-H384 HydrophobicContact CD1-CB 4.23Å; I342-H384 WeakPolarHBondContact CG1-O 3.42Å; I342-H384 PolarHBondContact N-O 3.26Å
343E95.4Very high94Very high140 Ų14064 Ų6465%0.65434%0.338SS*.Hα-helixtrans-52.7-31.7177.2-64.3175.5178.200113.9P341 F345 T346 A347P341-E343 PolarHBondContact O-N 3.16Å; E343-F345 VanDerWaalsContact C-N 3.31Å; E343-F345 PolarHBondContact O-N 3.17Å; E343-T346 PolarHBondContact O-N 3.24Å; E343-A347 VanDerWaalsContact O-CB 3.29Å; E343-A347 WeakPolarHBondContact O-CB 3.26Å; E343-A347 PolarHBondContact O-N 2.93Å
344V96.3Very high93.8Very high41 Ų4158.4 Ų58.425%0.24832%0.315CS..Hα-helixtrans-68-36.1177.7-175.50000110.7V331 M335 P341 I342 A348V331-V344 HydrophobicContact CG1-CB 4.43Å; V331-V344 HydrophobicContact CG1-CG1 3.57Å; M335-V344 HydrophobicContact CE-CG1 4.44Å; M335-V344 HydrophobicContact CE-CG2 4.06Å; M335-V344 HydrophobicContact CG-CG1 3.94Å; M335-V344 HydrophobicContact SD-CG1 3.79Å; M335-V344 HydrophobicContact SD-CG2 4.43Å; P341-V344 HydrophobicContact CB-CG2 4.19Å; P341-V344 HydrophobicContact CG-CG2 4.28Å; P341-V344 PolarHBondContact O-N 3.33Å; P341-V344 VanDerWaalsContact O-N 3.15Å; I342-V344 PolarHBondContact O-N 2.97Å; V344-A348 PolarHBondContact O-N 3.28Å; V344-A348 VanDerWaalsContact O-N 3.11Å
345F96.6Very high93.5Very high0 Ų060.4 Ų60.40%032%0.321CS..Hα-helixtrans-72.5-41.9174.1-58.4-80.3000110.6F328 V331 L340 I342 E343 A347 A348 L349 T362 L366 L386F328-F345 HydrophobicContact CB-CD1 3.97Å; F328-F345 HydrophobicContact CB-CE1 3.92Å; F328-F345 HydrophobicContact CD1-CB 4.35Å; F328-F345 AromaticContact CD1-CD1 3.56Å; F328-F345 HydrophobicContact CD1-CD1 3.56Å; F328-F345 HydrophobicContact CD1-CE1 4.38Å; F328-F345 HydrophobicContact CD1-CG 4.4Å; F328-F345 HydrophobicContact CD2-CD1 4.39Å; F328-F345 HydrophobicContact CE1-CB 4.03Å; F328-F345 HydrophobicContact CE1-CD1 4.1Å; F328-F345 AromaticContact CG-CD1 3.73Å; F328-F345 HydrophobicContact CG-CD1 3.73Å; F328-F345 HydrophobicContact CG-CE1 4.17Å; F328-F345 HydrophobicContact CZ-CB 4.41Å; V331-F345 HydrophobicContact CB-CD1 4.06Å; V331-F345 HydrophobicContact CB-CE1 3.95Å; V331-F345 HydrophobicContact CG1-CD1 3.8Å; V331-F345 HydrophobicContact CG1-CE1 3.7Å; V331-F345 HydrophobicContact CG1-CG 4.48Å; V331-F345 HydrophobicContact CG1-CZ 4.31Å; V331-F345 HydrophobicContact CG2-CD1 4.41Å; L340-F345 HydrophobicContact CB-CE2 3.51Å; L340-F345 HydrophobicContact CB-CZ 3.72Å; L340-F345 HydrophobicContact CD1-CZ 4.33Å; L340-F345 HydrophobicContact CD2-CE2 4.48Å; L340-F345 HydrophobicContact CD2-CZ 3.93Å; L340-F345 HydrophobicContact CG-CE2 4.46Å; L340-F345 HydrophobicContact CG-CZ 4.19Å; I342-F345 WeakPolarHBondContact O-CA 3.44Å; I342-F345 WeakPolarHBondContact O-CB 3.47Å; I342-F345 PolarHBondContact O-N 3.08Å; E343-F345 VanDerWaalsContact C-N 3.31Å; E343-F345 PolarHBondContact O-N 3.17Å; F345-A347 VanDerWaalsContact C-N 3.33Å; F345-A347 PolarHBondContact O-N 3.26Å; F345-A348 CarbonylContact O-C 3.45Å; F345-A348 WeakPolarHBondContact O-CA 3.45Å; F345-A348 WeakPolarHBondContact O-CB 3.11Å; F345-A348 PolarHBondContact O-N 3.44Å; F345-L349 WeakPolarHBondContact O-CG 3.38Å; F345-L349 PolarHBondContact O-N 2.87Å; F345-T362 HydrophobicContact CB-CG2 3.68Å; F345-L366 HydrophobicContact CB-CD1 4.46Å; F345-L366 HydrophobicContact CD1-CD2 4.47Å; F345-L366 HydrophobicContact CD2-CD1 3.93Å; F345-L366 HydrophobicContact CE2-CD1 4.38Å; F345-L366 HydrophobicContact CG-CD1 4.19Å; F345-L386 HydrophobicContact CE1-CD2 4.27Å; F345-L386 HydrophobicContact CE2-CB 3.92Å; F345-L386 HydrophobicContact CE2-CD2 3.85Å; F345-L386 HydrophobicContact CZ-CB 4.4Å; F345-L386 HydrophobicContact CZ-CD2 3.51Å
346T96.4Very high93.2Very high8 Ų864.1 Ų64.15%0.04934%0.343CS..Hα-helixtrans-58.3-45.6175.3-48.90000111.1I342 E343 A348 L349 H350 I357 T362I342-T346 PolarHBondContact O-N 3.44Å; I342-T346 PolarHBondContact O-OG1 3.43Å; E343-T346 PolarHBondContact O-N 3.24Å; T346-A348 VanDerWaalsContact C-N 3.32Å; T346-A348 PolarHBondContact O-N 2.91Å; T346-L349 WeakPolarHBondContact O-CB 3.37Å; T346-L349 PolarHBondContact O-N 2.92Å; T346-L349 VanDerWaalsContact O-N 3.1Å; T346-H350 PolarHBondContact O-N 2.62Å; T346-H350 PolarHBondContact O-ND1 3.21Å; T346-I357 HydrophobicContact CG2-CG2 4.47Å; T346-I357 WeakPolarHBondContact CG2-O 3.33Å; T346-T362 WeakPolarHBondContact OG1-CB 3.23Å; T346-T362 WeakPolarHBondContact OG1-CG2 3.31Å; T346-T362 PolarHBondContact OG1-OG1 3.23Å
347A95.4Very high93.3Very high50 Ų5055.8 Ų55.841%0.41331%0.307SS..Hα-helixtrans-60.3-39.8174.100000112.2E343 F345 L349 H350 L351E343-A347 VanDerWaalsContact O-CB 3.29Å; E343-A347 WeakPolarHBondContact O-CB 3.26Å; E343-A347 PolarHBondContact O-N 2.93Å; F345-A347 VanDerWaalsContact C-N 3.33Å; F345-A347 PolarHBondContact O-N 3.26Å; A347-L349 VanDerWaalsContact C-N 3.32Å; A347-L349 PolarHBondContact O-N 2.85Å; A347-H350 PolarHBondContact O-N 3.32Å; A347-L351 WeakPolarHBondContact O-CG 3.01Å; A347-L351 PolarHBondContact O-N 3.29Å
348A96Very high93.4Very high12 Ų1256.6 Ų56.610%0.09931%0.309CS..Hα-helixtrans-65.3-34.8174.600000112.6L327 V331 V344 F345 T346 L351 M352L327-A348 HydrophobicContact CD1-CB 4.43Å; L327-A348 HydrophobicContact CG-CB 4.49Å; V331-A348 HydrophobicContact CG2-CB 3.52Å; V344-A348 PolarHBondContact O-N 3.28Å; V344-A348 VanDerWaalsContact O-N 3.11Å; F345-A348 CarbonylContact O-C 3.45Å; F345-A348 WeakPolarHBondContact O-CA 3.45Å; F345-A348 WeakPolarHBondContact O-CB 3.11Å; F345-A348 PolarHBondContact O-N 3.44Å; T346-A348 VanDerWaalsContact C-N 3.32Å; T346-A348 PolarHBondContact O-N 2.91Å; A348-L351 PolarHBondContact O-N 3.34Å; A348-M352 WeakPolarHBondContact O-CG 3.42Å; A348-M352 PolarHBondContact O-N 2.87Å
349L96.3Very high93.5Very high0 Ų055.3 Ų55.30%031%0.308CS..Hα-helixtrans-69.3-44.3176.1-66.5175.9000111.9L293 Y324 L327 F328 F345 T346 A347 L351 M352 G353 V354 I357 T362 I365L293-L349 HydrophobicContact CD1-CD2 3.83Å; Y324-L349 HydrophobicContact CD1-CD2 3.72Å; Y324-L349 HydrophobicContact CE1-CD2 3.49Å; Y324-L349 VanDerWaalsContact CE1-CD2 3.49Å; L327-L349 HydrophobicContact CD2-CD2 3.73Å; F328-L349 HydrophobicContact CE1-CD1 4.22Å; F328-L349 HydrophobicContact CE1-CD2 3.8Å; F328-L349 HydrophobicContact CE1-CG 3.98Å; F328-L349 HydrophobicContact CZ-CD1 3.98Å; F328-L349 HydrophobicContact CZ-CD2 4.04Å; F328-L349 HydrophobicContact CZ-CG 4.22Å; F345-L349 WeakPolarHBondContact O-CG 3.38Å; F345-L349 PolarHBondContact O-N 2.87Å; T346-L349 WeakPolarHBondContact O-CB 3.37Å; T346-L349 PolarHBondContact O-N 2.92Å; T346-L349 VanDerWaalsContact O-N 3.1Å; A347-L349 VanDerWaalsContact C-N 3.32Å; A347-L349 PolarHBondContact O-N 2.85Å; L349-L351 VanDerWaalsContact C-N 3.3Å; L349-L351 PolarHBondContact O-N 2.92Å; L349-M352 CarbonylContact O-C 3.59Å; L349-M352 WeakPolarHBondContact O-CA 3.33Å; L349-M352 PolarHBondContact O-N 3.04Å; L349-G353 PolarHBondContact O-N 3.26Å; L349-V354 HydrophobicContact CB-CB 4.24Å; L349-V354 HydrophobicContact CB-CG2 4.32Å; L349-V354 HydrophobicContact CD2-CG2 4.4Å; L349-V354 PolarHBondContact O-N 3.38Å; L349-V354 VanDerWaalsContact O-N 3.13Å; L349-I357 HydrophobicContact CB-CD1 4.31Å; L349-I357 HydrophobicContact CB-CG2 4.03Å; L349-I357 HydrophobicContact CD1-CD1 3.34Å; L349-I357 HydrophobicContact CD1-CG1 4.31Å; L349-I357 HydrophobicContact CG-CD1 4.38Å; L349-T362 HydrophobicContact CD1-CG2 3.95Å; L349-I365 HydrophobicContact CD1-CD1 4.14Å
350H95Very high93.5Very high97 Ų9756.4 Ų56.445%0.44931%0.314SS..Hα-helixtrans-56.7-43.1171.6-72.6134.7000112.1T346 A347 M352 G353 V354 I357T346-H350 PolarHBondContact O-N 2.62Å; T346-H350 PolarHBondContact O-ND1 3.21Å; A347-H350 PolarHBondContact O-N 3.32Å; H350-M352 PolarHBondContact O-N 3.13Å; H350-G353 PolarHBondContact O-N 3.21Å; H350-V354 PolarHBondContact CD2-O 3.36Å; H350-I357 PolarHBondContact CE1-O 3.19Å; H350-I357 VanDerWaalsContact CE1-O 3.28Å; H350-I357 PolarHBondContact NE2-O 2.75Å
351L92.6Very high93.4Very high138 Ų13861.3 Ų61.372%0.72334%0.337SS*.Hα-helixtrans-62.6-27.7175.5-72.6174.6000113A347 A348 L349 G353A347-L351 WeakPolarHBondContact O-CG 3.01Å; A347-L351 PolarHBondContact O-N 3.29Å; A348-L351 PolarHBondContact O-N 3.34Å; L349-L351 VanDerWaalsContact C-N 3.3Å; L349-L351 PolarHBondContact O-N 2.92Å; L351-G353 VanDerWaalsContact C-N 3.28Å
352M93.3Very high93.4Very high37 Ų3759.2 Ų59.218%0.18232%0.323CS..THydrogen-bonded Turntrans-86.67.3174.3-62.2-61.492.800113.4L293 R294 L327 A348 L349 H350L293-M352 HydrophobicContact CB-CB 4.05Å; L293-M352 HydrophobicContact CD1-CB 4.31Å; R294-M352 WeakPolarHBondContact CB-O 3.43Å; L327-M352 HydrophobicContact CD1-CG 3.94Å; L327-M352 HydrophobicContact CD1-SD 4.22Å; L327-M352 HydrophobicContact CD2-CG 3.73Å; L327-M352 HydrophobicContact CG-CG 4.48Å; A348-M352 WeakPolarHBondContact O-CG 3.42Å; A348-M352 PolarHBondContact O-N 2.87Å; L349-M352 CarbonylContact O-C 3.59Å; L349-M352 WeakPolarHBondContact O-CA 3.33Å; L349-M352 PolarHBondContact O-N 3.04Å; H350-M352 PolarHBondContact O-N 3.13Å
353G89.2Confident93.3Very high44 Ų4460 Ų6045%0.45433%0.327SS..THydrogen-bonded Turntrans79.417.917600000114.8L349 H350 L351 E355L349-G353 PolarHBondContact O-N 3.26Å; H350-G353 PolarHBondContact O-N 3.21Å; L351-G353 VanDerWaalsContact C-N 3.28Å; G353-E355 PolarHBondContact O-N 3.02Å
354V89.4Confident93.3Very high31 Ų3156.7 Ų56.719%0.18832%0.318CS..  trans-76.9103.8167.4-171.70000107.1L293 L349 H350 I357L293-V354 HydrophobicContact CD1-CG2 4.23Å; L349-V354 HydrophobicContact CB-CB 4.24Å; L349-V354 HydrophobicContact CB-CG2 4.32Å; L349-V354 HydrophobicContact CD2-CG2 4.4Å; L349-V354 PolarHBondContact O-N 3.38Å; L349-V354 VanDerWaalsContact O-N 3.13Å; H350-V354 PolarHBondContact CD2-O 3.36Å; V354-I357 HydrophobicContact CB-CG2 4.15Å; V354-I357 HydrophobicContact CG1-CB 3.9Å; V354-I357 HydrophobicContact CG1-CD1 3.91Å; V354-I357 HydrophobicContact CG1-CG2 3.98Å; V354-I357 WeakPolarHBondContact O-CG2 3.28Å
355E86.8Confident93.2Very high162 Ų16256 Ų5676%0.75731%0.313SS*.THydrogen-bonded Turntrans-77.6156.8177.3-62.7-178.1175.100110.6G353 I357G353-E355 PolarHBondContact O-N 3.02Å; E355-I357 PolarHBondContact O-N 3.38Å
356D86.7Confident93.2Very high152 Ų15256 Ų5681%0.81331%0.313SS*.THydrogen-bonded Turntrans56.618.5175.9-58.4-32.3000116.6
357I91.2Very high93.2Very high9 Ų957.5 Ų57.55%0.04633%0.326CS..  trans-86.3121.5179.9-169.8155.2000112.7T346 L349 H350 V354 E355 E361 I365T346-I357 HydrophobicContact CG2-CG2 4.47Å; T346-I357 WeakPolarHBondContact CG2-O 3.33Å; L349-I357 HydrophobicContact CB-CD1 4.31Å; L349-I357 HydrophobicContact CB-CG2 4.03Å; L349-I357 HydrophobicContact CD1-CD1 3.34Å; L349-I357 HydrophobicContact CD1-CG1 4.31Å; L349-I357 HydrophobicContact CG-CD1 4.38Å; H350-I357 PolarHBondContact CE1-O 3.19Å; H350-I357 VanDerWaalsContact CE1-O 3.28Å; H350-I357 PolarHBondContact NE2-O 2.75Å; V354-I357 HydrophobicContact CB-CG2 4.15Å; V354-I357 HydrophobicContact CG1-CB 3.9Å; V354-I357 HydrophobicContact CG1-CD1 3.91Å; V354-I357 HydrophobicContact CG1-CG2 3.98Å; V354-I357 WeakPolarHBondContact O-CG2 3.28Å; E355-I357 PolarHBondContact O-N 3.38Å; I357-E361 HydrophobicContact CD1-CB 4.44Å; I357-E361 HydrophobicContact CG1-CB 3.98Å; I357-I365 HydrophobicContact CD1-CD1 3.76Å
358D93.4Very high93.2Very high70 Ų7058.8 Ų58.837%0.37433%0.326SS..  trans-97.6173.4176.673.224.5000112.1D360 E361 T362D358-D360 VanDerWaalsContact C-N 3.25Å; D358-D360 PolarHBondContact O-N 3.02Å; D358-D360 WeakPolarHBondContact OD1-CA 3.26Å; D358-D360 WeakPolarHBondContact OD1-CB 3.16Å; D358-D360 PolarHBondContact OD1-N 3.03Å; D358-E361 PolarHBondContact OD1-N 2.94Å; D358-T362 WeakPolarHBondContact O-CB 3.21Å; D358-T362 PolarHBondContact O-N 2.71Å; D358-T362 PolarHBondContact O-OG1 2.86Å
359P92.3Very high93.1Very high52 Ų5258.2 Ų58.234%0.33832%0.321SS..Hα-helixtrans-60.5-30.1175.8-26.637.4000114.2I342 T362 E363I342-P359 HydrophobicContact CG2-CB 4.16Å; I342-P359 WeakPolarHBondContact CG2-O 3.43Å; P359-T362 WeakPolarHBondContact O-CB 3.3Å; P359-T362 PolarHBondContact O-N 3.24Å; P359-E363 WeakPolarHBondContact O-CB 3.39Å; P359-E363 PolarHBondContact O-N 3.35Å
360D92.8Very high93.1Very high97 Ų9760.1 Ų60.152%0.51933%0.331SS..Hα-helixtrans-75.1-42.2-177-67.6-22.4000110.9D358 T362 E363 C364D358-D360 VanDerWaalsContact C-N 3.25Å; D358-D360 PolarHBondContact O-N 3.02Å; D358-D360 WeakPolarHBondContact OD1-CA 3.26Å; D358-D360 WeakPolarHBondContact OD1-CB 3.16Å; D358-D360 PolarHBondContact OD1-N 3.03Å; D360-T362 VanDerWaalsContact C-N 3.34Å; D360-E363 WeakPolarHBondContact O-CB 3.34Å; D360-E363 PolarHBondContact O-N 3.21Å; D360-C364 PolarHBondContact O-N 3.1Å
361E93.6Very high93Very high103 Ų10363.5 Ų63.548%0.48135%0.347SS..Hα-helixtrans-63.9-40.8170.8-70.6-167.8151.600111.6I357 D358 E363 C364 I365I357-E361 HydrophobicContact CD1-CB 4.44Å; I357-E361 HydrophobicContact CG1-CB 3.98Å; D358-E361 PolarHBondContact OD1-N 2.94Å; E361-E363 VanDerWaalsContact C-N 3.3Å; E361-E363 PolarHBondContact O-N 3.26Å; E361-C364 WeakPolarHBondContact O-CB 3.04Å; E361-C364 PolarHBondContact O-N 2.83Å; E361-I365 WeakPolarHBondContact O-CG1 3.42Å; E361-I365 PolarHBondContact O-N 3.02Å
362T96.2Very high92.9Very high0 Ų060.9 Ų60.90%033%0.331CS..Hα-helixtrans-60.1-43.5173.5-57.70000110.9I342 F345 T346 L349 D358 P359 D360 C364 I365 L366I342-T362 HydrophobicContact CG2-CG2 3.91Å; F345-T362 HydrophobicContact CB-CG2 3.68Å; T346-T362 WeakPolarHBondContact OG1-CB 3.23Å; T346-T362 WeakPolarHBondContact OG1-CG2 3.31Å; T346-T362 PolarHBondContact OG1-OG1 3.23Å; L349-T362 HydrophobicContact CD1-CG2 3.95Å; D358-T362 WeakPolarHBondContact O-CB 3.21Å; D358-T362 PolarHBondContact O-N 2.71Å; D358-T362 PolarHBondContact O-OG1 2.86Å; P359-T362 WeakPolarHBondContact O-CB 3.3Å; P359-T362 PolarHBondContact O-N 3.24Å; D360-T362 VanDerWaalsContact C-N 3.34Å; T362-C364 VanDerWaalsContact C-N 3.31Å; T362-C364 PolarHBondContact O-N 3.13Å; T362-I365 PolarHBondContact O-N 3.03Å; T362-L366 HydrophobicContact CG2-CD1 4.35Å; T362-L366 WeakPolarHBondContact O-CG 3.45Å; T362-L366 PolarHBondContact O-N 3.29Å
363E95.2Very high92.8Very high18 Ų1860.5 Ų60.58%0.08434%0.337CS..Hα-helixtrans-60.5-41.2175.3-169.4166176.900111.3I342 P359 D360 E361 L366 A367 L379 H381I342-E363 HydrophobicContact CD1-CB 4.02Å; I342-E363 HydrophobicContact CD1-CG 3.88Å; I342-E363 WeakPolarHBondContact CD1-OE2 3.17Å; P359-E363 WeakPolarHBondContact O-CB 3.39Å; P359-E363 PolarHBondContact O-N 3.35Å; D360-E363 WeakPolarHBondContact O-CB 3.34Å; D360-E363 PolarHBondContact O-N 3.21Å; E361-E363 VanDerWaalsContact C-N 3.3Å; E361-E363 PolarHBondContact O-N 3.26Å; E363-L366 WeakPolarHBondContact O-CB 3.46Å; E363-L366 PolarHBondContact O-N 2.99Å; E363-A367 WeakPolarHBondContact O-CB 3.41Å; E363-A367 PolarHBondContact O-N 3.06Å; E363-L379 HydrophobicContact CG-CD1 3.59Å; E363-L379 HydrophobicContact CG-CD2 4.04Å; E363-L379 HydrophobicContact CG-CG 4.28Å; E363-H381 IonicContact OE1-CG 3.56Å; E363-H381 IonicContact OE1-ND1 2.92Å; E363-H381 PolarHBondContact OE1-ND1 3.41Å; E363-H381 IonicContact OE2-CE1 3.57Å; E363-H381 IonicContact OE2-ND1 2.9Å; E363-H381 PolarHBondContact OE2-ND1 2.89Å
364C94.4Very high92.9Very high69 Ų6959.8 Ų59.847%0.46632%0.321SS..Hα-helixtrans-61.2-44.5175.1-174.40000112.5D360 E361 T362 L366 A367 N368D360-C364 PolarHBondContact O-N 3.1Å; E361-C364 WeakPolarHBondContact O-CB 3.04Å; E361-C364 PolarHBondContact O-N 2.83Å; T362-C364 VanDerWaalsContact C-N 3.31Å; T362-C364 PolarHBondContact O-N 3.13Å; C364-L366 VanDerWaalsContact C-N 3.34Å; C364-L366 PolarHBondContact O-N 3.19Å; C364-A367 WeakPolarHBondContact O-CB 3.12Å; C364-A367 PolarHBondContact O-N 3.21Å; C364-N368 PolarHBondContact O-N 3.45Å; C364-N368 PolarHBondContact O-ND2 3.32Å; C364-N368 VanDerWaalsContact O-ND2 3.17Å
365I95.1Very high93.2Very high28 Ų2858.4 Ų58.414%0.14431%0.313CS..Hα-helixtrans-61.1-45175.5-63.1169.9000110.4Y324 F328 L349 I357 E361 T362 A367 N368 L369Y324-I365 HydrophobicContact CD1-CG2 3.95Å; Y324-I365 HydrophobicContact CD2-CG2 4.41Å; Y324-I365 HydrophobicContact CE1-CD1 3.93Å; Y324-I365 HydrophobicContact CE1-CG2 4.36Å; Y324-I365 HydrophobicContact CG-CG2 4Å; F328-I365 HydrophobicContact CE2-CG2 3.86Å; F328-I365 HydrophobicContact CZ-CG2 4.16Å; L349-I365 HydrophobicContact CD1-CD1 4.14Å; I357-I365 HydrophobicContact CD1-CD1 3.76Å; E361-I365 WeakPolarHBondContact O-CG1 3.42Å; E361-I365 PolarHBondContact O-N 3.02Å; T362-I365 PolarHBondContact O-N 3.03Å; I365-A367 VanDerWaalsContact C-N 3.35Å; I365-A367 PolarHBondContact O-N 3.1Å; I365-N368 PolarHBondContact O-N 3.44Å; I365-L369 HydrophobicContact CG2-CD1 4.29Å; I365-L369 WeakPolarHBondContact O-CG 3.4Å; I365-L369 PolarHBondContact O-N 2.94Å
366L96.7Very high93.5Very high0 Ų055.4 Ų55.40%030%0.297CS..Hα-helixtrans-61.3-43176.3-74.4170000111.8F328 F345 T362 E363 C364 N368 L369 I370 I375 L379 L386F328-L366 HydrophobicContact CD2-CD2 3.38Å; F328-L366 HydrophobicContact CD2-CG 4.32Å; F328-L366 HydrophobicContact CE2-CD2 3.5Å; F328-L366 HydrophobicContact CE2-CG 3.94Å; F328-L366 HydrophobicContact CG-CD2 4.24Å; F328-L366 HydrophobicContact CZ-CD2 4.45Å; F345-L366 HydrophobicContact CB-CD1 4.46Å; F345-L366 HydrophobicContact CD1-CD2 4.47Å; F345-L366 HydrophobicContact CD2-CD1 3.93Å; F345-L366 HydrophobicContact CE2-CD1 4.38Å; F345-L366 HydrophobicContact CG-CD1 4.19Å; T362-L366 HydrophobicContact CG2-CD1 4.35Å; T362-L366 WeakPolarHBondContact O-CG 3.45Å; T362-L366 PolarHBondContact O-N 3.29Å; E363-L366 WeakPolarHBondContact O-CB 3.46Å; E363-L366 PolarHBondContact O-N 2.99Å; C364-L366 VanDerWaalsContact C-N 3.34Å; C364-L366 PolarHBondContact O-N 3.19Å; L366-N368 PolarHBondContact O-N 3.38Å; L366-L369 PolarHBondContact O-N 3.31Å; L366-I370 WeakPolarHBondContact O-CG1 3.33Å; L366-I370 PolarHBondContact O-N 2.76Å; L366-I375 HydrophobicContact CD2-CD1 4.05Å; L366-L379 HydrophobicContact CB-CD1 4.41Å; L366-L379 HydrophobicContact CB-CD2 4.11Å; L366-L379 HydrophobicContact CD1-CD2 4.19Å; L366-L386 HydrophobicContact CD1-CB 4.43Å; L366-L386 HydrophobicContact CD2-CD2 3.84Å
367A95.5Very high93.9Very high39 Ų3949.4 Ų49.432%0.32227%0.271SS..Hα-helixtrans-60.1-45.5177.300000111.2E363 C364 I365 L369 I370 H371 L379E363-A367 WeakPolarHBondContact O-CB 3.41Å; E363-A367 PolarHBondContact O-N 3.06Å; C364-A367 WeakPolarHBondContact O-CB 3.12Å; C364-A367 PolarHBondContact O-N 3.21Å; I365-A367 VanDerWaalsContact C-N 3.35Å; I365-A367 PolarHBondContact O-N 3.1Å; A367-L369 PolarHBondContact O-N 3.36Å; A367-I370 PolarHBondContact O-N 3.25Å; A367-H371 WeakPolarHBondContact O-CB 3.48Å; A367-H371 PolarHBondContact O-N 2.89Å; A367-L379 HydrophobicContact CB-CD1 3.73Å
368N94.5Very high94.1Very high77 Ų7756 Ų5641%0.41230%0.296SS..Hα-helixtrans-61.6-41.6176.1-73-37.6000111.9C364 I365 L366 I370 H371 E372C364-N368 PolarHBondContact O-N 3.45Å; C364-N368 PolarHBondContact O-ND2 3.32Å; C364-N368 VanDerWaalsContact O-ND2 3.17Å; I365-N368 PolarHBondContact O-N 3.44Å; L366-N368 PolarHBondContact O-N 3.38Å; N368-I370 PolarHBondContact O-N 3.27Å; N368-H371 PolarHBondContact O-N 3.47Å; N368-E372 WeakPolarHBondContact O-CB 3.25Å; N368-E372 WeakPolarHBondContact O-CG 3.28Å; N368-E372 PolarHBondContact O-N 3.29Å
369L95.2Very high94.2Very high0 Ų054.5 Ų54.50%029%0.288CS..Hα-helixtrans-67.7-33.6176.4-68.7174.8000113.1L321 R325 F328 I365 L366 A367 G373 K374 I375L321-L369 WeakPolarHBondContact O-CD2 3.42Å; R325-L369 HydrophobicContact CB-CD2 4.23Å; F328-L369 HydrophobicContact CD2-CD1 3.56Å; F328-L369 HydrophobicContact CE2-CD1 3.74Å; I365-L369 HydrophobicContact CG2-CD1 4.29Å; I365-L369 WeakPolarHBondContact O-CG 3.4Å; I365-L369 PolarHBondContact O-N 2.94Å; L366-L369 PolarHBondContact O-N 3.31Å; A367-L369 PolarHBondContact O-N 3.36Å; L369-G373 PolarHBondContact O-N 3.34Å; L369-K374 HydrophobicContact CB-CB 4.36Å; L369-K374 HydrophobicContact CD2-CB 4.09Å; L369-K374 HydrophobicContact CD2-CD 3.67Å; L369-K374 WeakPolarHBondContact O-CA 3.39Å; L369-K374 WeakPolarHBondContact O-CB 3.25Å; L369-K374 PolarHBondContact O-N 3.02Å; L369-I375 HydrophobicContact CB-CD1 3.74Å; L369-I375 HydrophobicContact CB-CG1 3.97Å; L369-I375 HydrophobicContact CD1-CD1 3.82Å; L369-I375 HydrophobicContact CG-CD1 4.45Å; L369-I375 PolarHBondContact O-N 3.13Å; L369-I375 VanDerWaalsContact O-N 3.13Å
370I95.4Very high94.3Very high40 Ų4053 Ų5321%0.20528%0.28CS..Hα-helixtrans-68.7-46.9172.5-69.7162.4000110L366 A367 N368 E372 G373 I375 G377 L379 L386L366-I370 WeakPolarHBondContact O-CG1 3.33Å; L366-I370 PolarHBondContact O-N 2.76Å; A367-I370 PolarHBondContact O-N 3.25Å; N368-I370 PolarHBondContact O-N 3.27Å; I370-E372 VanDerWaalsContact C-N 3.32Å; I370-E372 PolarHBondContact O-N 2.9Å; I370-G373 WeakPolarHBondContact O-CA 3.29Å; I370-G373 PolarHBondContact O-N 2.66Å; I370-I375 HydrophobicContact CG1-CB 4.04Å; I370-I375 HydrophobicContact CG1-CG2 4.15Å; I370-G377 WeakPolarHBondContact CG2-O 3.22Å; I370-L379 HydrophobicContact CD1-CD1 4.39Å; I370-L379 HydrophobicContact CD1-CG 4.02Å; I370-L386 HydrophobicContact CD1-CD1 3.61Å
371H93.4Very high94.1Very high167 Ų16753.5 Ų53.577%0.77328%0.279SS*.Hα-helixtrans-58.7-42.3179.6-177.469.2000112.1A367 N368 G373A367-H371 WeakPolarHBondContact O-CB 3.48Å; A367-H371 PolarHBondContact O-N 2.89Å; N368-H371 PolarHBondContact O-N 3.47Å; H371-G373 PolarHBondContact O-N 3.36Å
372E89.8Confident93.9Very high83 Ų8357.7 Ų57.739%0.38830%0.299SS..THydrogen-bonded Turntrans-75.83.4174.9-68.4-173171.700114N368 I370 K374N368-E372 WeakPolarHBondContact O-CB 3.25Å; N368-E372 WeakPolarHBondContact O-CG 3.28Å; N368-E372 PolarHBondContact O-N 3.29Å; I370-E372 VanDerWaalsContact C-N 3.32Å; I370-E372 PolarHBondContact O-N 2.9Å; E372-K374 HydrophobicContact CB-CD 4.35Å; E372-K374 HydrophobicContact CB-CG 4.35Å; E372-K374 PolarHBondContact O-N 3.4Å; E372-K374 WeakPolarHBondContact OE2-CD 3.24Å; E372-K374 WeakPolarHBondContact OE2-CE 3.49Å; E372-K374 IonicContact OE2-NZ 3Å; E372-K374 PolarHBondContact OE2-NZ 2.98Å
373G91.1Very high93.6Very high30 Ų3063.5 Ų63.531%0.30933%0.326SS..THydrogen-bonded Turntrans68.714.3179.900000114.6L369 I370 H371L369-G373 PolarHBondContact O-N 3.34Å; I370-G373 WeakPolarHBondContact O-CA 3.29Å; I370-G373 PolarHBondContact O-N 2.66Å; H371-G373 PolarHBondContact O-N 3.36Å
374K91.9Very high93.5Very high29 Ų2967 Ų6713%0.12634%0.342CS..SBendtrans-76.3-25.4177.6-76.5175.8179.9162.30112.3R325 L369 E372 L397R325-K374 HydrophobicContact CG-CB 4.14Å; R325-K374 PolarHBondContact NE-O 3.21Å; L369-K374 HydrophobicContact CB-CB 4.36Å; L369-K374 HydrophobicContact CD2-CB 4.09Å; L369-K374 HydrophobicContact CD2-CD 3.67Å; L369-K374 WeakPolarHBondContact O-CA 3.39Å; L369-K374 WeakPolarHBondContact O-CB 3.25Å; L369-K374 PolarHBondContact O-N 3.02Å; E372-K374 HydrophobicContact CB-CD 4.35Å; E372-K374 HydrophobicContact CB-CG 4.35Å; E372-K374 PolarHBondContact O-N 3.4Å; E372-K374 WeakPolarHBondContact OE2-CD 3.24Å; E372-K374 WeakPolarHBondContact OE2-CE 3.49Å; E372-K374 IonicContact OE2-NZ 3Å; E372-K374 PolarHBondContact OE2-NZ 2.98Å; K374-L397 HydrophobicContact CG-CD2 4.27Å
375I95Very high93.6Very high2 Ų267.2 Ų67.21%0.0134%0.335CS..SBendtrans-126.5129.8172.8-59.2179.3000108.6F328 L366 L369 I370 V388 P393 F394F328-I375 HydrophobicContact CD2-CD1 4.29Å; L366-I375 HydrophobicContact CD2-CD1 4.05Å; L369-I375 HydrophobicContact CB-CD1 3.74Å; L369-I375 HydrophobicContact CB-CG1 3.97Å; L369-I375 HydrophobicContact CD1-CD1 3.82Å; L369-I375 HydrophobicContact CG-CD1 4.45Å; L369-I375 PolarHBondContact O-N 3.13Å; L369-I375 VanDerWaalsContact O-N 3.13Å; I370-I375 HydrophobicContact CG1-CB 4.04Å; I370-I375 HydrophobicContact CG1-CG2 4.15Å; I375-V388 HydrophobicContact CG2-CG1 4.29Å; I375-P393 CarbonylContact C-O 3.55Å; I375-P393 WeakPolarHBondContact CA-O 3.47Å; I375-F394 HydrophobicContact CD1-CE1 3.86Å; I375-F394 HydrophobicContact CG1-CD1 3.93Å; I375-F394 HydrophobicContact CG1-CE1 3.63Å; I375-F394 HydrophobicContact CG1-CZ 4.5Å
376K95Very high93.6Very high98 Ų9865.9 Ų65.943%0.42633%0.328SS..  trans-91.1107.1168.8-76.1-179.8176.5174.60108.7S389 P393 P395K376-S389 WeakPolarHBondContact O-CB 3.43Å; K376-S389 PolarHBondContact O-N 2.92Å; K376-P393 PolarHBondContact N-O 3.4Å; K376-P395 HydrophobicContact CD-CG 3.72Å; K376-P395 HydrophobicContact CG-CG 3.63Å
377G94.4Very high93.6Very high26 Ų2666.6 Ų66.627%0.26833%0.332SS..EExtended strand (participates in β ladder)trans175.3-173-178.800000111.8I370 V387I370-G377 WeakPolarHBondContact CG2-O 3.22Å; G377-V387 CarbonylContact C-O 3.5Å; G377-V387 WeakPolarHBondContact CA-O 3.29Å
378Y95.6Very high93.6Very high147 Ų14765.3 Ų65.358%0.57632%0.32SS*.EExtended strand (participates in β ladder)trans-142.3159.717263.8-90.6000110.1A380 V387Y378-A380 HydrophobicContact CE2-CB 4.39Å; Y378-V387 HydrophobicContact CD1-CB 4.14Å; Y378-V387 HydrophobicContact CD1-CG1 4.4Å; Y378-V387 HydrophobicContact CD2-CB 4.23Å; Y378-V387 HydrophobicContact CD2-CG2 4.29Å; Y378-V387 HydrophobicContact CE1-CB 3.76Å; Y378-V387 HydrophobicContact CE1-CG1 3.66Å; Y378-V387 HydrophobicContact CE1-CG2 4.42Å; Y378-V387 HydrophobicContact CE2-CB 3.85Å; Y378-V387 HydrophobicContact CE2-CG1 4.42Å; Y378-V387 HydrophobicContact CE2-CG2 3.67Å; Y378-V387 PolarHBondContact N-O 2.85Å; Y378-V387 HydrophobicContact CG-CB 4.36Å; Y378-V387 PolarHBondContact O-N 2.88Å
379L95.4Very high93.6Very high40 Ų4063.7 Ų63.721%0.20932%0.315CS..EExtended strand (participates in β ladder)trans-94.6118.2175.5-69.7162.4000109.2I342 E363 L366 A367 I370 H381 L386I342-L379 HydrophobicContact CD1-CD2 4.42Å; E363-L379 HydrophobicContact CG-CD1 3.59Å; E363-L379 HydrophobicContact CG-CD2 4.04Å; E363-L379 HydrophobicContact CG-CG 4.28Å; L366-L379 HydrophobicContact CB-CD1 4.41Å; L366-L379 HydrophobicContact CB-CD2 4.11Å; L366-L379 HydrophobicContact CD1-CD2 4.19Å; A367-L379 HydrophobicContact CB-CD1 3.73Å; I370-L379 HydrophobicContact CD1-CD1 4.39Å; I370-L379 HydrophobicContact CD1-CG 4.02Å; L379-H381 VanDerWaalsContact C-N 3.25Å; L379-H381 PolarHBondContact O-N 3.46Å; L379-L386 HydrophobicContact CD2-CB 4.19Å; L379-L386 HydrophobicContact CD2-CD1 3.77Å; L379-L386 HydrophobicContact CG-CD1 4.31Å
380A93.5Very high93.2Very high19 Ų1971.7 Ų71.716%0.15735%0.35CS..EExtended strand (participates in β ladder)trans-8475.1167.300000108.2Y378 Q382 Q383 H384 K385 V387Y378-A380 HydrophobicContact CE2-CB 4.39Å; A380-Q382 VanDerWaalsContact C-N 3.34Å; A380-Q382 PolarHBondContact O-N 3.34Å; A380-Q383 HydrophobicContact CB-CB 4.27Å; A380-Q383 CarbonylContact O-C 3.54Å; A380-Q383 WeakPolarHBondContact O-CA 3.31Å; A380-Q383 PolarHBondContact O-N 2.85Å; A380-H384 PolarHBondContact O-N 2.92Å; A380-H384 VanDerWaalsContact O-N 3.15Å; A380-K385 HydrophobicContact CB-CB 4.49Å; A380-K385 PolarHBondContact N-O 3.01Å; A380-K385 PolarHBondContact O-N 3Å; A380-V387 HydrophobicContact CB-CG2 4.17Å
381H88.8Confident92.9Very high109 Ų10976.6 Ų76.651%0.50538%0.376SS..G310 helixtrans-50.5-47.8-171.2-177.662.2000113.1E363 L379 Q383 H384E363-H381 IonicContact OE1-CG 3.56Å; E363-H381 IonicContact OE1-ND1 2.92Å; E363-H381 PolarHBondContact OE1-ND1 3.41Å; E363-H381 IonicContact OE2-CE1 3.57Å; E363-H381 IonicContact OE2-ND1 2.9Å; E363-H381 PolarHBondContact OE2-ND1 2.89Å; L379-H381 VanDerWaalsContact C-N 3.25Å; L379-H381 PolarHBondContact O-N 3.46Å; H381-Q383 PolarHBondContact O-N 2.88Å; H381-Q383 VanDerWaalsContact O-N 3.08Å; H381-H384 PolarHBondContact O-N 3.01Å
382Q89.1Confident92.6Very high190 Ų19073.8 Ų73.889%0.88836%0.363SS*.G310 helixtrans-60-23.7177.7-68.1-178.9-8.300114.4A380A380-Q382 VanDerWaalsContact C-N 3.34Å; A380-Q382 PolarHBondContact O-N 3.34Å
383Q91.5Very high92.7Very high122 Ų12271.5 Ų71.557%0.5736%0.356SS*.G310 helixtrans-101.70.3179.4-61.3-178.2-3.500112.3A380 H381 K385A380-Q383 HydrophobicContact CB-CB 4.27Å; A380-Q383 CarbonylContact O-C 3.54Å; A380-Q383 WeakPolarHBondContact O-CA 3.31Å; A380-Q383 PolarHBondContact O-N 2.85Å; H381-Q383 PolarHBondContact O-N 2.88Å; H381-Q383 VanDerWaalsContact O-N 3.08Å; Q383-K385 PolarHBondContact O-N 2.92Å; Q383-K385 WeakPolarHBondContact O-CG 3.49Å; Q383-K385 HydrophobicContact CB-CD 4.23Å; Q383-K385 HydrophobicContact CB-CB 4.41Å; Q383-K385 VanDerWaalsContact C-N 3.27Å; Q383-K385 HydrophobicContact CB-CG 4.47Å
384H93.1Very high92.9Very high91 Ų9170.9 Ų70.942%0.42135%0.345SS..THydrogen-bonded Turntrans46.548.8-170.8-61.8-79.9000112.7I342 A380 H381I342-H384 HydrophobicContact CD1-CB 4.23Å; I342-H384 WeakPolarHBondContact CG1-O 3.42Å; I342-H384 PolarHBondContact N-O 3.26Å; A380-H384 PolarHBondContact O-N 2.92Å; A380-H384 VanDerWaalsContact O-N 3.15Å; H381-H384 PolarHBondContact O-N 3.01Å
385K95.4Very high92.8Very high74 Ų7470.1 Ų70.132%0.32234%0.342SS..EExtended strand (participates in β ladder)trans-132.1137.4-176.5-77.2170.7-170.2177.60113L340 A380 Q383L340-K385 CarbonylContact O-C 3.55Å; L340-K385 VanDerWaalsContact O-CA 3.25Å; L340-K385 WeakPolarHBondContact O-CA 3.34Å; A380-K385 HydrophobicContact CB-CB 4.49Å; A380-K385 PolarHBondContact N-O 3.01Å; A380-K385 PolarHBondContact O-N 3Å; Q383-K385 PolarHBondContact O-N 2.92Å; Q383-K385 WeakPolarHBondContact O-CG 3.49Å; Q383-K385 HydrophobicContact CB-CD 4.23Å; Q383-K385 HydrophobicContact CB-CB 4.41Å; Q383-K385 VanDerWaalsContact C-N 3.27Å; Q383-K385 HydrophobicContact CB-CG 4.47Å
386L96.3Very high92.4Very high0 Ų073 Ų730%036%0.361CS..EExtended strand (participates in β ladder)trans-84.2124.3162.3-179.872000109.6L340 F345 L366 I370 L379 V388L340-L386 PolarHBondContact N-O 3.41Å; L340-L386 PolarHBondContact O-N 3.48Å; F345-L386 HydrophobicContact CE1-CD2 4.27Å; F345-L386 HydrophobicContact CE2-CB 3.92Å; F345-L386 HydrophobicContact CE2-CD2 3.85Å; F345-L386 HydrophobicContact CZ-CB 4.4Å; F345-L386 HydrophobicContact CZ-CD2 3.51Å; L366-L386 HydrophobicContact CD1-CB 4.43Å; L366-L386 HydrophobicContact CD2-CD2 3.84Å; I370-L386 HydrophobicContact CD1-CD1 3.61Å; L379-L386 HydrophobicContact CD2-CB 4.19Å; L379-L386 HydrophobicContact CD2-CD1 3.77Å; L379-L386 HydrophobicContact CG-CD1 4.31Å; L386-V388 HydrophobicContact CD2-CG1 3.54Å; L386-V388 HydrophobicContact CG-CG1 3.76Å
387V95.6Very high91.7Very high15 Ų1569.5 Ų69.59%0.09135%0.347CS..EExtended strand (participates in β ladder)trans-103.2107.5172.2-174.10000108.9H338 L339 G377 Y378 A380H338-V387 WeakPolarHBondContact O-CA 3.47Å; L339-V387 HydrophobicContact CD2-CB 4.15Å; L339-V387 HydrophobicContact CD2-CG1 3.77Å; L339-V387 HydrophobicContact CD2-CG2 3.56Å; G377-V387 CarbonylContact C-O 3.5Å; G377-V387 WeakPolarHBondContact CA-O 3.29Å; Y378-V387 HydrophobicContact CD1-CB 4.14Å; Y378-V387 HydrophobicContact CD1-CG1 4.4Å; Y378-V387 HydrophobicContact CD2-CB 4.23Å; Y378-V387 HydrophobicContact CD2-CG2 4.29Å; Y378-V387 HydrophobicContact CE1-CB 3.76Å; Y378-V387 HydrophobicContact CE1-CG1 3.66Å; Y378-V387 HydrophobicContact CE1-CG2 4.42Å; Y378-V387 HydrophobicContact CE2-CB 3.85Å; Y378-V387 HydrophobicContact CE2-CG1 4.42Å; Y378-V387 HydrophobicContact CE2-CG2 3.67Å; Y378-V387 PolarHBondContact N-O 2.85Å; Y378-V387 HydrophobicContact CG-CB 4.36Å; Y378-V387 PolarHBondContact O-N 2.88Å; A380-V387 HydrophobicContact CB-CG2 4.17Å
388V95.6Very high90.4Very high12 Ų1272.2 Ų72.27%0.07336%0.358CS..EExtended strand (participates in β ladder)trans-93.5148.4-179.6-59.80000112H338 L340 I375 L386 P393H338-V388 HydrophobicContact CB-CG2 4.28Å; H338-V388 PolarHBondContact O-N 3.47Å; L340-V388 HydrophobicContact CD1-CB 4.49Å; L340-V388 HydrophobicContact CD1-CG1 3.95Å; L340-V388 HydrophobicContact CD1-CG2 3.76Å; I375-V388 HydrophobicContact CG2-CG1 4.29Å; L386-V388 HydrophobicContact CD2-CG1 3.54Å; L386-V388 HydrophobicContact CG-CG1 3.76Å; V388-P393 HydrophobicContact CB-CB 3.83Å; V388-P393 HydrophobicContact CG2-CB 4.12Å
389S93.7Very high88.2Confident43 Ų4367.3 Ų67.330%0.30135%0.353SS..  trans-59.3136.2175.3174.70000111.2K376 L391 P393K376-S389 WeakPolarHBondContact O-CB 3.43Å; K376-S389 PolarHBondContact O-N 2.92Å; S389-L391 PolarHBondContact O-N 2.99Å; S389-L391 PolarHBondContact OG-N 3.25Å; S389-L391 VanDerWaalsContact OG-N 3.09Å; S389-L391 PolarHBondContact OG-O 3.32Å; S389-P393 WeakPolarHBondContact O-CD 3.25Å; S389-P393 WeakPolarHBondContact O-CB 3.45Å
390K88.2Confident85.8Confident168 Ų16867.5 Ų67.573%0.7336%0.357SS*.SBendtrans-66.8-26.9171.7-63.2-177.8-179.3179.30112
391L88.3Confident83.5Confident144 Ų14469.7 Ų69.775%0.75437%0.365SS*.SBendtrans-100.5109.6176.6-63.7176000109.6S389S389-L391 PolarHBondContact O-N 2.99Å; S389-L391 PolarHBondContact OG-N 3.25Å; S389-L391 VanDerWaalsContact OG-N 3.09Å; S389-L391 PolarHBondContact OG-O 3.32Å
392Q88.2Confident80.8Confident107 Ų10769 Ų6950%0.538%0.378SS..  trans47.265.9174.2-162178.129.800113.5F394 P396Q392-F394 PolarHBondContact O-N 3.49Å; Q392-P396 VanDerWaalsContact NE2-CD 3.33Å
393P91.7Very high77.9Confident36 Ų3664.8 Ų64.823%0.23437%0.37CS..SBendtrans-59.1-24-176.420.4-30.9000113.8I375 K376 V388 S389I375-P393 CarbonylContact C-O 3.55Å; I375-P393 WeakPolarHBondContact CA-O 3.47Å; K376-P393 PolarHBondContact N-O 3.4Å; V388-P393 HydrophobicContact CB-CB 3.83Å; V388-P393 HydrophobicContact CG2-CB 4.12Å; S389-P393 WeakPolarHBondContact O-CD 3.25Å; S389-P393 WeakPolarHBondContact O-CB 3.45Å
394F93.6Very high74.9Confident17 Ų1766.6 Ų66.68%0.07538%0.383CS..SBendtrans-122.291.1176.5-62.5-92000109.2R325 F328 K329 C332 I375 Q392R325-F394 HydrophobicContact CG-CD1 4.04Å; F328-F394 HydrophobicContact CB-CE1 4.3Å; F328-F394 HydrophobicContact CB-CZ 4.49Å; K329-F394 VanDerWaalsContact CA-CZ 3.42Å; K329-F394 HydrophobicContact CB-CD1 3.77Å; K329-F394 HydrophobicContact CB-CD2 3.99Å; K329-F394 HydrophobicContact CB-CE1 3.87Å; K329-F394 HydrophobicContact CB-CE2 4.13Å; K329-F394 HydrophobicContact CB-CG 3.84Å; K329-F394 HydrophobicContact CB-CZ 4.07Å; K329-F394 HydrophobicContact CD-CB 4.08Å; K329-F394 HydrophobicContact CD-CG 4.22Å; K329-F394 HydrophobicContact CG-CB 4.23Å; K329-F394 HydrophobicContact CG-CD1 4.31Å; K329-F394 HydrophobicContact CG-CD2 3.78Å; K329-F394 HydrophobicContact CG-CE2 4.25Å; K329-F394 HydrophobicContact CG-CG 3.84Å; C332-F394 HydrophobicContact CB-CE2 3.76Å; C332-F394 HydrophobicContact CB-CZ 4.11Å; I375-F394 HydrophobicContact CD1-CE1 3.86Å; I375-F394 HydrophobicContact CG1-CD1 3.93Å; I375-F394 HydrophobicContact CG1-CE1 3.63Å; I375-F394 HydrophobicContact CG1-CZ 4.5Å; Q392-F394 PolarHBondContact O-N 3.49Å
395P91.1Very high71.8Confident12 Ų1275.2 Ų75.28%0.07842%0.419CS..  trans-58.5156.5178.9-24.535.6000112.3R325 K376R325-P395 PolarHBondContact NH2-O 3.46Å; K376-P395 HydrophobicContact CD-CG 3.72Å; K376-P395 HydrophobicContact CG-CG 3.63Å
396P86.3Confident70.6Confident62 Ų6275.3 Ų75.340%0.40342%0.424SS..  trans-61.8138.7172-15.732.4000108.9Q392 T398 G399Q392-P396 VanDerWaalsContact NE2-CD 3.33Å; P396-T398 PolarHBondContact O-N 3.21Å; P396-G399 PolarHBondContact O-N 3.15Å
397L79.7Confident69.2Low25 Ų2579.2 Ų79.213%0.13145%0.446CS..G310 helixtrans-61-34.8-177.7-68.3164000111.9T322 K374 G399 S400T322-L397 HydrophobicContact CG2-CD1 3.41Å; T322-L397 VanDerWaalsContact CG2-CD1 3.41Å; T322-L397 HydrophobicContact CG2-CD2 4.29Å; T322-L397 HydrophobicContact CG2-CG 4.49Å; K374-L397 HydrophobicContact CG-CD2 4.27Å; L397-G399 PolarHBondContact O-N 3.31Å; L397-S400 PolarHBondContact O-OG 2.96Å
398T66.7Low67.8Low83 Ų8382.8 Ų82.851%0.50947%0.466SS..G310 helixtrans-57.9-30.9171.7360000113.5L264 P396 M401L264-T398 VanDerWaalsContact O-CG2 3.26Å; L264-T398 WeakPolarHBondContact O-CG2 3.47Å; P396-T398 PolarHBondContact O-N 3.21Å; T398-M401 WeakPolarHBondContact O-CE 3.48Å
399G50.3Low66.2Low44 Ų4486.9 Ų86.945%0.45449%0.489SS..G310 helixtrans-86.1-16.3-171.500000115.4P396 L397 M401P396-G399 PolarHBondContact O-N 3.15Å; L397-G399 PolarHBondContact O-N 3.31Å; G399-M401 PolarHBondContact O-N 2.69Å; G399-M401 VanDerWaalsContact O-N 3.09Å
400S44.2Very low64.4Low44 Ų4489.7 Ų89.731%0.30850%0.501SS..G310 helixtrans-66.1-9.2179.267.40000113.8L397 S403L397-S400 PolarHBondContact O-OG 2.96Å; S400-S403 PolarHBondContact O-OG 3.23Å
401M45.9Very low62.8Low65 Ų6584.5 Ų84.532%0.3249%0.485SS..G310 helixtrans-98.5-5.4-170.6-59.9-177.1-68.800114.4V229 L264 T398 G399 S403V229-M401 HydrophobicContact CG2-CE 3.81Å; V229-M401 HydrophobicContact CG2-CG 4.49Å; V229-M401 HydrophobicContact CG2-SD 3.16Å; V229-M401 WeakPolarHBondContact CG2-SD 3.3Å; L264-M401 HydrophobicContact CD2-CE 3.58Å; L264-M401 HydrophobicContact CD2-SD 3.65Å; T398-M401 WeakPolarHBondContact O-CE 3.48Å; G399-M401 PolarHBondContact O-N 2.69Å; G399-M401 VanDerWaalsContact O-N 3.09Å; M401-S403 PolarHBondContact O-N 3.48Å
402A32.6Very low61Low95 Ų9580.2 Ų80.279%0.78547%0.466SS*.G310 helixtrans-71.6-9.6175.200000113.4
403S28.4Very low58.9Low102 Ų10278.2 Ų78.271%0.71346%0.463SS*.G310 helixtrans-100.70-176.245.40000115.6S400 M401 K405S400-S403 PolarHBondContact O-OG 3.23Å; M401-S403 PolarHBondContact O-N 3.48Å; S403-K405 PolarHBondContact O-N 3.4Å
404L27.6Very low56.2Low159 Ų15981.7 Ų81.783%0.83248%0.483SS*.  trans-92.283.5168.5-72.2163.6000108.7
405K28Very low52.8Low272 Ų27287.5 Ų87.5100%1.18352%0.52SS*.  trans-101.90162.7-97.2-171.8177.1-178.40109.7S403S403-K405 PolarHBondContact O-N 3.4Å

Retrieved 405 of 405 residues in 175.4 ms (Link to these results)

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