A0A077Z937_TRITR Loading...

Xan ur permease domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z937, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 432 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
1M74.9Confident82.5Confident197 Ų197103.2 Ų103.297%0.9746%0.459SS*.  0-56.10-167.5178175.600111.7E3 R4 V5M1-E3 VanDerWaalsContact C-N 3.3Å; M1-E3 PolarHBondContact O-N 3.36Å; M1-R4 WeakPolarHBondContact O-CB 3.46Å; M1-R4 PolarHBondContact O-N 3.01Å; M1-V5 HydrophobicContact CG-CG2 4.47Å; M1-V5 PolarHBondContact O-N 3.17Å
2L78.5Confident82.9Confident78 Ų78100.9 Ų100.941%0.40849%0.486SS..Hα-helixtrans-51-45179.1-65.8173.8000113.6R4 V5 F6 L8 A15 L318L2-R4 VanDerWaalsContact C-N 3.32Å; L2-R4 PolarHBondContact O-N 3.18Å; L2-V5 PolarHBondContact O-N 3.34Å; L2-F6 HydrophobicContact CB-CD2 4.46Å; L2-F6 HydrophobicContact CD2-CD2 3.87Å; L2-F6 HydrophobicContact CD2-CE2 3.69Å; L2-F6 PolarHBondContact O-N 3.25Å; L2-L8 HydrophobicContact CB-CD1 4.27Å; L2-A15 HydrophobicContact CD1-CB 4.3Å; L2-L318 HydrophobicContact CD1-CD2 4.48Å; L2-L318 HydrophobicContact CD2-CD1 4.05Å; L2-L318 HydrophobicContact CD2-CD2 4.39Å
3E81.7Confident83.4Confident76 Ų7694.1 Ų94.136%0.35545%0.454SS..Hα-helixtrans-61.2-37.2177.4-164.160-142.200113.2M1 K7 L8 R9M1-E3 VanDerWaalsContact C-N 3.3Å; M1-E3 PolarHBondContact O-N 3.36Å; E3-K7 WeakPolarHBondContact O-CA 3.27Å; E3-K7 PolarHBondContact O-N 2.98Å; E3-L8 PolarHBondContact OE1-N 3.12Å; E3-L8 WeakPolarHBondContact OE2-CB 3.49Å; E3-R9 VanDerWaalsContact OE1-CB 3.27Å; E3-R9 WeakPolarHBondContact OE1-CB 3.46Å; E3-R9 WeakPolarHBondContact OE1-CG 3.44Å; E3-R9 PolarHBondContact OE1-N 3.18Å
4R78.5Confident84.1Confident230 Ų23092.8 Ų92.887%0.86846%0.455SS*.Hα-helixtrans-70.2-36.1178.6-90.9-174.2177.4175.6-0.7112.5M1 L2M1-R4 WeakPolarHBondContact O-CB 3.46Å; M1-R4 PolarHBondContact O-N 3.01Å; L2-R4 VanDerWaalsContact C-N 3.32Å; L2-R4 PolarHBondContact O-N 3.18Å
5V84.4Confident84.7Confident55 Ų5589.1 Ų89.133%0.33345%0.445SS..Hα-helixtrans-85-49.1-174.4178.50000110.9M1 L2 L67M1-V5 HydrophobicContact CG-CG2 4.47Å; M1-V5 PolarHBondContact O-N 3.17Å; L2-V5 PolarHBondContact O-N 3.34Å; V5-L67 HydrophobicContact CG1-CD2 4.48Å
6F88.8Confident85.3Confident10 Ų1095.8 Ų95.84%0.04446%0.464CS..Hα-helixtrans-102.4-10.8-171-57.1-69000113.7L2 L8 G66 L67 N70 T316 L318 V321L2-F6 HydrophobicContact CB-CD2 4.46Å; L2-F6 HydrophobicContact CD2-CD2 3.87Å; L2-F6 HydrophobicContact CD2-CE2 3.69Å; L2-F6 PolarHBondContact O-N 3.25Å; F6-L8 HydrophobicContact CB-CD2 3.77Å; F6-L8 HydrophobicContact CB-CG 4.36Å; F6-L8 PolarHBondContact O-N 3.2Å; F6-G66 WeakPolarHBondContact CE1-O 3.43Å; F6-L67 HydrophobicContact CE1-CD2 4.3Å; F6-L67 HydrophobicContact CZ-CD2 3.92Å; F6-N70 WeakPolarHBondContact CA-OD1 3.23Å; F6-N70 VanDerWaalsContact CD1-OD1 3.28Å; F6-N70 WeakPolarHBondContact CD1-OD1 3.46Å; F6-N70 PolarHBondContact O-ND2 2.87Å; F6-N70 PolarHBondContact O-OD1 3.41Å; F6-T316 WeakPolarHBondContact O-CG2 3.19Å; F6-L318 HydrophobicContact CD1-CB 4.31Å; F6-L318 HydrophobicContact CD2-CB 4.01Å; F6-L318 HydrophobicContact CD2-CD1 4.46Å; F6-L318 HydrophobicContact CE1-CB 4.5Å; F6-L318 HydrophobicContact CE2-CB 4.22Å; F6-L318 HydrophobicContact CE2-CD1 4.04Å; F6-L318 HydrophobicContact CG-CB 4.06Å; F6-L318 HydrophobicContact CZ-CB 4.45Å; F6-L318 HydrophobicContact CZ-CD1 4.47Å; F6-V321 HydrophobicContact CE1-CG2 4.18Å; F6-V321 HydrophobicContact CZ-CG2 3.95Å
7K86.3Confident85.9Confident85 Ų8592.6 Ų92.637%0.3745%0.451SS..  trans52.951.6177.3-65.5157.7150.6-92.10111.9E3 R9 E10 H11E3-K7 WeakPolarHBondContact O-CA 3.27Å; E3-K7 PolarHBondContact O-N 2.98Å; K7-R9 VanDerWaalsContact C-N 3.32Å; K7-R9 PolarHBondContact O-N 2.73Å; K7-E10 HydrophobicContact CB-CB 4.07Å; K7-E10 HydrophobicContact CB-CG 4.12Å; K7-E10 WeakPolarHBondContact CD-OE2 3.25Å; K7-E10 IonicContact NZ-OE1 3.97Å; K7-E10 PolarHBondContact NZ-OE1 3.04Å; K7-E10 IonicContact NZ-OE2 3.49Å; K7-E10 PolarHBondContact NZ-OE2 2.97Å; K7-E10 WeakPolarHBondContact O-CB 3.44Å; K7-E10 PolarHBondContact O-N 3.16Å; K7-E10 VanDerWaalsContact O-N 3.12Å; K7-H11 PolarHBondContact O-N 3.32Å; K7-H11 PolarHBondContact O-ND1 2.82Å
8L86.3Confident86.4Confident8 Ų887.4 Ų87.44%0.04243%0.426CS..THydrogen-bonded Turntrans-58.7-42.2-170-55.2174.8000111.9L2 E3 F6 H11 G12 T13 A15 E18 T316 L318L2-L8 HydrophobicContact CB-CD1 4.27Å; E3-L8 PolarHBondContact OE1-N 3.12Å; E3-L8 WeakPolarHBondContact OE2-CB 3.49Å; F6-L8 HydrophobicContact CB-CD2 3.77Å; F6-L8 HydrophobicContact CB-CG 4.36Å; F6-L8 PolarHBondContact O-N 3.2Å; L8-H11 CarbonylContact O-C 3.52Å; L8-H11 PolarHBondContact O-N 3.4Å; L8-G12 PolarHBondContact O-N 2.88Å; L8-G12 VanDerWaalsContact O-N 3.16Å; L8-T13 HydrophobicContact CB-CG2 4.05Å; L8-T13 HydrophobicContact CD2-CG2 4.02Å; L8-T13 WeakPolarHBondContact O-CG2 3.49Å; L8-T13 PolarHBondContact O-N 2.88Å; L8-A15 HydrophobicContact CD1-CB 4.13Å; L8-E18 HydrophobicContact CD2-CG 3.99Å; L8-T316 HydrophobicContact CD2-CG2 4.04Å; L8-T316 WeakPolarHBondContact CD2-OG1 3.36Å; L8-L318 HydrophobicContact CD2-CD2 4.3Å
9R80.9Confident86.9Confident212 Ų21285.8 Ų85.880%0.842%0.422SS*.THydrogen-bonded Turntrans-66.3-38.1177.7-69.4-178.8173.8-169.7-2.4112.5E3 K7 H11 G12E3-R9 VanDerWaalsContact OE1-CB 3.27Å; E3-R9 WeakPolarHBondContact OE1-CB 3.46Å; E3-R9 WeakPolarHBondContact OE1-CG 3.44Å; E3-R9 PolarHBondContact OE1-N 3.18Å; K7-R9 VanDerWaalsContact C-N 3.32Å; K7-R9 PolarHBondContact O-N 2.73Å; R9-H11 PolarHBondContact O-N 2.81Å; R9-G12 PolarHBondContact O-N 2.86Å
10E83.9Confident87.4Confident134 Ų13485.6 Ų85.663%0.62642%0.422SS*.THydrogen-bonded Turntrans-63.5-30.2176-63.3178.5-164.100111.7K7K7-E10 HydrophobicContact CB-CB 4.07Å; K7-E10 HydrophobicContact CB-CG 4.12Å; K7-E10 WeakPolarHBondContact CD-OE2 3.25Å; K7-E10 IonicContact NZ-OE1 3.97Å; K7-E10 PolarHBondContact NZ-OE1 3.04Å; K7-E10 IonicContact NZ-OE2 3.49Å; K7-E10 PolarHBondContact NZ-OE2 2.97Å; K7-E10 WeakPolarHBondContact O-CB 3.44Å; K7-E10 PolarHBondContact O-N 3.16Å; K7-E10 VanDerWaalsContact O-N 3.12Å
11H83.6Confident87.8Confident50 Ų5081.5 Ų81.523%0.23140%0.402CS..THydrogen-bonded Turntrans-94.37.4178.6-64.976.7000113.4K7 L8 R9 T13 R315 T316K7-H11 PolarHBondContact O-N 3.32Å; K7-H11 PolarHBondContact O-ND1 2.82Å; L8-H11 CarbonylContact O-C 3.52Å; L8-H11 PolarHBondContact O-N 3.4Å; R9-H11 PolarHBondContact O-N 2.81Å; H11-T13 VanDerWaalsContact C-N 3.29Å; H11-T13 HydrophobicContact CB-CG2 4.25Å; H11-T13 PolarHBondContact O-N 3.02Å; H11-R315 HydrophobicContact CB-CB 4.03Å; H11-T316 HydrophobicContact CB-CG2 3.6Å
12G86.8Confident88.8Confident76 Ų7672.1 Ų72.178%0.78436%0.355SS*.THydrogen-bonded Turntrans64.428.4177.500000114.6L8 R9L8-G12 PolarHBondContact O-N 2.88Å; L8-G12 VanDerWaalsContact O-N 3.16Å; R9-G12 PolarHBondContact O-N 2.86Å
13T89.2Confident89.7Confident12 Ų1273.1 Ų73.17%0.07436%0.356CS..  trans-124.4170.5-175.2-1710000112.2L8 H11 E18 R315 T316L8-T13 HydrophobicContact CB-CG2 4.05Å; L8-T13 HydrophobicContact CD2-CG2 4.02Å; L8-T13 WeakPolarHBondContact O-CG2 3.49Å; L8-T13 PolarHBondContact O-N 2.88Å; H11-T13 VanDerWaalsContact C-N 3.29Å; H11-T13 HydrophobicContact CB-CG2 4.25Å; H11-T13 PolarHBondContact O-N 3.02Å; T13-E18 WeakPolarHBondContact CB-OE1 3.46Å; T13-E18 HydrophobicContact CG2-CG 3.96Å; T13-E18 VanDerWaalsContact CG2-OE1 3.25Å; T13-E18 WeakPolarHBondContact CG2-OE1 3.24Å; T13-E18 PolarHBondContact OG1-OE1 3.33Å; T13-R315 HydrophobicContact CG2-CB 4.43Å; T13-T316 HydrophobicContact CG2-CG2 3.7Å
14T93Very high90.3Very high76 Ų7670.1 Ų70.147%0.46634%0.344SS..  trans-124.2156.4175.475.40000110.6R16 T17 E18T14-R16 PolarHBondContact O-N 2.87Å; T14-T17 WeakPolarHBondContact O-CB 3.4Å; T14-T17 PolarHBondContact O-N 3.17Å; T14-T17 PolarHBondContact OG1-N 3Å; T14-T17 VanDerWaalsContact OG1-N 3.16Å; T14-T17 PolarHBondContact OG1-OG1 2.83Å; T14-E18 WeakPolarHBondContact O-CG 3.48Å; T14-E18 PolarHBondContact O-N 3.16Å
15A93.7Very high91.1Very high37 Ų3759.2 Ų59.231%0.30630%0.303SS..Hα-helixtrans-56.5-35.3176.400000112.3L2 L8 V19 L318L2-A15 HydrophobicContact CD1-CB 4.3Å; L8-A15 HydrophobicContact CD1-CB 4.13Å; A15-V19 VanDerWaalsContact O-CG2 3.24Å; A15-V19 WeakPolarHBondContact O-CG2 3.45Å; A15-V19 PolarHBondContact O-N 3.22Å; A15-L318 HydrophobicContact CB-CD2 4.24Å
16R94.6Very high91.7Very high197 Ų19757.6 Ų57.674%0.74329%0.291SS*.Hα-helixtrans-64.3-46.3175.5-174.8-178.5-178.9-138.71111.4T14 V19 I20T14-R16 PolarHBondContact O-N 2.87Å; R16-V19 PolarHBondContact O-N 3.26Å; R16-I20 HydrophobicContact CG-CD1 3.97Å; R16-I20 VanDerWaalsContact O-CG1 3.3Å; R16-I20 WeakPolarHBondContact O-CG1 3.42Å; R16-I20 PolarHBondContact O-N 3.08Å
17T94.7Very high91.9Very high41 Ų4159.6 Ų59.625%0.25230%0.302SS..Hα-helixtrans-60.4-46177.7-51.20000111T14 V19 I20 A21T14-T17 WeakPolarHBondContact O-CB 3.4Å; T14-T17 PolarHBondContact O-N 3.17Å; T14-T17 PolarHBondContact OG1-N 3Å; T14-T17 VanDerWaalsContact OG1-N 3.16Å; T14-T17 PolarHBondContact OG1-OG1 2.83Å; T17-V19 PolarHBondContact O-N 3.48Å; T17-I20 PolarHBondContact O-N 3.31Å; T17-A21 VanDerWaalsContact O-CB 3.29Å; T17-A21 WeakPolarHBondContact O-CB 3.28Å; T17-A21 PolarHBondContact O-N 3.48Å
18E95.4Very high92.1Very high0 Ų056.4 Ų56.40%029%0.289CS..Hα-helixtrans-64.2-39.2178.8-66.8-66.7131.400113L8 T13 T14 A21 G22 R315 T316 L318 T319L8-E18 HydrophobicContact CD2-CG 3.99Å; T13-E18 WeakPolarHBondContact CB-OE1 3.46Å; T13-E18 HydrophobicContact CG2-CG 3.96Å; T13-E18 VanDerWaalsContact CG2-OE1 3.25Å; T13-E18 WeakPolarHBondContact CG2-OE1 3.24Å; T13-E18 PolarHBondContact OG1-OE1 3.33Å; T14-E18 WeakPolarHBondContact O-CG 3.48Å; T14-E18 PolarHBondContact O-N 3.16Å; E18-A21 PolarHBondContact O-N 2.91Å; E18-G22 PolarHBondContact O-N 3.21Å; E18-R315 PolarHBondContact OE1-N 3.02Å; E18-T316 PolarHBondContact OE1-N 3.21Å; E18-T316 PolarHBondContact OE2-N 3.15Å; E18-T316 VanDerWaalsContact OE2-N 3.08Å; E18-T316 VanDerWaalsContact OE2-O 3.1Å; E18-T316 PolarHBondContact OE2-OG1 3Å; E18-L318 HydrophobicContact CB-CB 3.88Å; E18-L318 HydrophobicContact CB-CD2 3.67Å; E18-L318 HydrophobicContact CB-CG 3.77Å; E18-L318 HydrophobicContact CG-CB 4.11Å; E18-L318 HydrophobicContact CG-CD2 4.16Å; E18-L318 HydrophobicContact CG-CG 4.43Å; E18-T319 PolarHBondContact O-OG1 3.4Å; E18-T319 PolarHBondContact OE2-N 3.34Å; E18-T319 PolarHBondContact OE2-OG1 3.38Å
19V96.8Very high92.5Very high57 Ų5756 Ų5635%0.34529%0.287SS..Hα-helixtrans-65.7-45.5176.1171.20000110.6A15 R16 T17 A21 G22 F23 V322A15-V19 VanDerWaalsContact O-CG2 3.24Å; A15-V19 WeakPolarHBondContact O-CG2 3.45Å; A15-V19 PolarHBondContact O-N 3.22Å; R16-V19 PolarHBondContact O-N 3.26Å; T17-V19 PolarHBondContact O-N 3.48Å; V19-A21 VanDerWaalsContact C-N 3.34Å; V19-A21 PolarHBondContact O-N 2.83Å; V19-G22 PolarHBondContact O-N 2.68Å; V19-F23 HydrophobicContact CG1-CD2 3.98Å; V19-F23 HydrophobicContact CG1-CE2 4.04Å; V19-F23 WeakPolarHBondContact O-CD2 3.29Å; V19-F23 PolarHBondContact O-N 3.12Å; V19-V322 HydrophobicContact CG2-CG2 4.03Å
20I95.9Very high93.1Very high81 Ų8146.3 Ų46.342%0.41525%0.252SS..Hα-helixtrans-61.5-45.2176.3-67.1167.8000110.3R16 T17 G22 F23 T24R16-I20 HydrophobicContact CG-CD1 3.97Å; R16-I20 VanDerWaalsContact O-CG1 3.3Å; R16-I20 WeakPolarHBondContact O-CG1 3.42Å; R16-I20 PolarHBondContact O-N 3.08Å; T17-I20 PolarHBondContact O-N 3.31Å; I20-G22 VanDerWaalsContact C-N 3.28Å; I20-G22 PolarHBondContact O-N 2.62Å; I20-F23 PolarHBondContact O-N 3.26Å; I20-T24 WeakPolarHBondContact O-CB 3.21Å; I20-T24 PolarHBondContact O-N 3.39Å; I20-T24 PolarHBondContact O-OG1 3.33Å; I20-T24 VanDerWaalsContact O-OG1 3.12Å
21A95.1Very high93.4Very high0 Ų040.1 Ų40.10%022%0.222CC..Hα-helixtrans-58.7-40.2175.100000112T17 E18 V19 T24 T25 G309 V312 G314 T319T17-A21 VanDerWaalsContact O-CB 3.29Å; T17-A21 WeakPolarHBondContact O-CB 3.28Å; T17-A21 PolarHBondContact O-N 3.48Å; E18-A21 PolarHBondContact O-N 2.91Å; V19-A21 VanDerWaalsContact C-N 3.34Å; V19-A21 PolarHBondContact O-N 2.83Å; A21-T24 PolarHBondContact O-N 2.73Å; A21-T25 PolarHBondContact O-N 3.31Å; A21-T25 PolarHBondContact O-OG1 2.84Å; A21-G309 VanDerWaalsContact CB-O 3.31Å; A21-G309 WeakPolarHBondContact CB-O 3.22Å; A21-G309 WeakPolarHBondContact O-CA 3.28Å; A21-V312 HydrophobicContact CB-CG2 4.03Å; A21-G314 VanDerWaalsContact CB-CA 3.48Å; A21-T319 HydrophobicContact CB-CG2 3.98Å
22G97.1Very high93.8Very high0 Ų037.7 Ų37.70%021%0.211CC..Hα-helixtrans-62.8-45.7175.600000112.5E18 V19 I20 T24 T25 F26 V323E18-G22 PolarHBondContact O-N 3.21Å; V19-G22 PolarHBondContact O-N 2.68Å; I20-G22 VanDerWaalsContact C-N 3.28Å; I20-G22 PolarHBondContact O-N 2.62Å; G22-T24 PolarHBondContact O-N 2.78Å; G22-T25 PolarHBondContact O-N 2.98Å; G22-F26 VanDerWaalsContact O-CB 3.27Å; G22-F26 WeakPolarHBondContact O-CB 3.49Å; G22-F26 PolarHBondContact O-N 3.46Å; G22-V323 VanDerWaalsContact O-CG2 3.22Å; G22-V323 WeakPolarHBondContact O-CG2 3.3Å
23F96.6Very high94.1Very high98 Ų9834.1 Ų34.143%0.4317%0.174SC..Hα-helixtrans-61.2-43.2173-91.1-87.4000112.1V19 I20 F26 L27 V322 L326V19-F23 HydrophobicContact CG1-CD2 3.98Å; V19-F23 HydrophobicContact CG1-CE2 4.04Å; V19-F23 WeakPolarHBondContact O-CD2 3.29Å; V19-F23 PolarHBondContact O-N 3.12Å; I20-F23 PolarHBondContact O-N 3.26Å; F23-F26 PolarHBondContact O-N 3.15Å; F23-L27 WeakPolarHBondContact O-CB 3.04Å; F23-L27 VanDerWaalsContact O-CG 3.27Å; F23-L27 WeakPolarHBondContact O-CG 3.44Å; F23-L27 PolarHBondContact O-N 2.84Å; F23-V322 HydrophobicContact CD2-CG1 4.25Å; F23-V322 HydrophobicContact CE2-CG1 4.49Å; F23-L326 HydrophobicContact CD1-CD1 3.88Å; F23-L326 HydrophobicContact CD1-CD2 4.36Å; F23-L326 HydrophobicContact CD2-CD1 4.21Å; F23-L326 HydrophobicContact CE1-CD1 4.04Å; F23-L326 HydrophobicContact CE1-CD2 3.69Å; F23-L326 HydrophobicContact CE2-CD1 4.35Å; F23-L326 HydrophobicContact CE2-CD2 4.36Å; F23-L326 HydrophobicContact CG-CD1 3.99Å; F23-L326 HydrophobicContact CZ-CD1 4.28Å; F23-L326 HydrophobicContact CZ-CD2 3.69Å
24T94.2Very high94Very high14 Ų1434.8 Ų34.89%0.08618%0.176CC..Hα-helixtrans-59.8-51.5177.4-68.20000111.4I20 A21 G22 F26 L27 T28 H191 V312I20-T24 WeakPolarHBondContact O-CB 3.21Å; I20-T24 PolarHBondContact O-N 3.39Å; I20-T24 PolarHBondContact O-OG1 3.33Å; I20-T24 VanDerWaalsContact O-OG1 3.12Å; A21-T24 PolarHBondContact O-N 2.73Å; G22-T24 PolarHBondContact O-N 2.78Å; T24-F26 VanDerWaalsContact C-N 3.34Å; T24-F26 PolarHBondContact O-N 3.22Å; T24-L27 PolarHBondContact O-N 2.81Å; T24-T28 PolarHBondContact O-N 3.04Å; T24-T28 VanDerWaalsContact O-N 3.1Å; T24-T28 PolarHBondContact O-OG1 3.34Å; T24-H191 HydrophobicContact CG2-CB 3.82Å; T24-H191 VanDerWaalsContact CG2-CD2 3.47Å; T24-H191 WeakPolarHBondContact CG2-CD2 3.49Å; T24-H191 VanDerWaalsContact CG2-CG 3.42Å; T24-V312 HydrophobicContact CG2-CG2 4.13Å
25T95.7Very high93.8Very high1 Ų131.2 Ų31.21%0.00615%0.154CC..Hα-helixtrans-58.3-47.5176.3-660000111A21 G22 L27 T28 M29 A74 G309 V323A21-T25 PolarHBondContact O-N 3.31Å; A21-T25 PolarHBondContact O-OG1 2.84Å; G22-T25 PolarHBondContact O-N 2.98Å; T25-L27 PolarHBondContact O-N 3.08Å; T25-T28 WeakPolarHBondContact CA-OG1 3.31Å; T25-T28 PolarHBondContact O-N 2.6Å; T25-T28 VanDerWaalsContact O-N 3.13Å; T25-T28 PolarHBondContact O-OG1 3.08Å; T25-M29 HydrophobicContact CG2-SD 3.94Å; T25-M29 WeakPolarHBondContact O-CG 3.42Å; T25-M29 PolarHBondContact O-N 2.96Å; T25-M29 VanDerWaalsContact O-N 3.09Å; T25-A74 HydrophobicContact CG2-CB 3.81Å; T25-G309 VanDerWaalsContact OG1-CA 3.25Å; T25-G309 WeakPolarHBondContact OG1-CA 3.14Å; T25-G309 PolarHBondContact OG1-N 3.28Å; T25-V323 HydrophobicContact CG2-CG2 3.72Å
26F96.7Very high93.7Very high21 Ų2129.4 Ų29.49%0.09214%0.14CC..Hα-helixtrans-56.7-49178.3169.5-98.3000111.6G22 F23 T24 T28 M29 V30 V323 L326 F327 V330G22-F26 VanDerWaalsContact O-CB 3.27Å; G22-F26 WeakPolarHBondContact O-CB 3.49Å; G22-F26 PolarHBondContact O-N 3.46Å; F23-F26 PolarHBondContact O-N 3.15Å; T24-F26 VanDerWaalsContact C-N 3.34Å; T24-F26 PolarHBondContact O-N 3.22Å; F26-T28 PolarHBondContact O-N 2.98Å; F26-M29 PolarHBondContact O-N 3.27Å; F26-M29 VanDerWaalsContact O-N 3.11Å; F26-V30 HydrophobicContact CD2-CB 4.46Å; F26-V30 HydrophobicContact CE1-CB 4.29Å; F26-V30 HydrophobicContact CE1-CG2 4.16Å; F26-V30 HydrophobicContact CE2-CB 4.06Å; F26-V30 HydrophobicContact CE2-CG2 3.75Å; F26-V30 HydrophobicContact CZ-CB 3.97Å; F26-V30 HydrophobicContact CZ-CG2 3.48Å; F26-V30 VanDerWaalsContact CZ-CG2 3.48Å; F26-V30 VanDerWaalsContact O-CB 3.29Å; F26-V30 WeakPolarHBondContact O-CB 3.39Å; F26-V30 PolarHBondContact O-N 2.88Å; F26-V323 HydrophobicContact CB-CG1 4.41Å; F26-V323 HydrophobicContact CB-CG2 4.36Å; F26-L326 HydrophobicContact CB-CB 4.38Å; F26-L326 HydrophobicContact CB-CD1 3.61Å; F26-L326 HydrophobicContact CD1-CB 4.15Å; F26-L326 HydrophobicContact CD1-CD1 3.83Å; F26-L326 HydrophobicContact CD1-CG 4.5Å; F26-L326 HydrophobicContact CD2-CB 3.5Å; F26-L326 VanDerWaalsContact CD2-CB 3.5Å; F26-L326 HydrophobicContact CD2-CD1 4.28Å; F26-L326 HydrophobicContact CE1-CB 4.33Å; F26-L326 HydrophobicContact CE2-CB 3.71Å; F26-L326 HydrophobicContact CG-CB 3.73Å; F26-L326 HydrophobicContact CG-CD1 3.63Å; F26-L326 HydrophobicContact CG-CG 4.3Å; F26-L326 HydrophobicContact CZ-CB 4.12Å; F26-F327 HydrophobicContact CD2-CD2 4.16Å; F26-F327 HydrophobicContact CD2-CE2 4.13Å; F26-F327 HydrophobicContact CD2-CZ 4.47Å; F26-F327 HydrophobicContact CE2-CD1 4.38Å; F26-F327 HydrophobicContact CE2-CD2 4.44Å; F26-F327 HydrophobicContact CE2-CG 4.35Å; F26-V330 HydrophobicContact CE2-CG2 3.68Å; F26-V330 HydrophobicContact CZ-CG2 3.37Å
27L93.6Very high93.5Very high51 Ų5120.5 Ų20.527%0.26711%0.107SC..Hα-helixtrans-61.8-30.5179-71.7171.1000113F23 T24 T25 A192 L195F23-L27 WeakPolarHBondContact O-CB 3.04Å; F23-L27 VanDerWaalsContact O-CG 3.27Å; F23-L27 WeakPolarHBondContact O-CG 3.44Å; F23-L27 PolarHBondContact O-N 2.84Å; T24-L27 PolarHBondContact O-N 2.81Å; T25-L27 PolarHBondContact O-N 3.08Å; L27-A192 HydrophobicContact CB-CB 4.42Å; L27-A192 HydrophobicContact CD1-CB 4.39Å; L27-L195 HydrophobicContact CD2-CD2 3.82Å
28T90.5Very high93.2Very high18 Ų1820.3 Ų20.311%0.1110%0.103CC..Hα-helixtrans-76.7-27.2175.751.50000114.2T24 T25 F26 Y31 H191 E305 S308T24-T28 PolarHBondContact O-N 3.04Å; T24-T28 VanDerWaalsContact O-N 3.1Å; T24-T28 PolarHBondContact O-OG1 3.34Å; T25-T28 WeakPolarHBondContact CA-OG1 3.31Å; T25-T28 PolarHBondContact O-N 2.6Å; T25-T28 VanDerWaalsContact O-N 3.13Å; T25-T28 PolarHBondContact O-OG1 3.08Å; F26-T28 PolarHBondContact O-N 2.98Å; T28-Y31 VanDerWaalsContact O-CD1 3.23Å; T28-Y31 WeakPolarHBondContact O-CD1 3.48Å; T28-Y31 VanDerWaalsContact O-CE1 3.29Å; T28-Y31 WeakPolarHBondContact O-CE1 3.48Å; T28-H191 HydrophobicContact CG2-CB 4Å; T28-H191 WeakPolarHBondContact CG2-O 3.48Å; T28-E305 PolarHBondContact OG1-O 3.27Å; T28-S308 VanDerWaalsContact CG2-OG 3.31Å; T28-S308 WeakPolarHBondContact CG2-OG 3.42Å; T28-S308 PolarHBondContact OG1-OG 2.97Å
29M93.8Very high92.8Very high0 Ų020.5 Ų20.50%010%0.104CC..Hα-helixtrans-111.1-10.8-17573-177.3-71.100115.1T25 F26 Y31 I32 A74 A76 Y303 E305 V323 F327T25-M29 HydrophobicContact CG2-SD 3.94Å; T25-M29 WeakPolarHBondContact O-CG 3.42Å; T25-M29 PolarHBondContact O-N 2.96Å; T25-M29 VanDerWaalsContact O-N 3.09Å; F26-M29 PolarHBondContact O-N 3.27Å; F26-M29 VanDerWaalsContact O-N 3.11Å; M29-Y31 PolarHBondContact O-N 3.31Å; M29-I32 WeakPolarHBondContact O-CB 3.48Å; M29-I32 VanDerWaalsContact O-CG2 3.26Å; M29-I32 WeakPolarHBondContact O-CG2 3.46Å; M29-I32 PolarHBondContact O-N 2.95Å; M29-A74 HydrophobicContact CE-CB 4.04Å; M29-A74 HydrophobicContact SD-CB 3.41Å; M29-A74 WeakPolarHBondContact SD-CB 3.46Å; M29-A76 HydrophobicContact CE-CB 3.46Å; M29-A76 VanDerWaalsContact CE-CB 3.46Å; M29-Y303 HydrophobicContact CB-CD1 3.81Å; M29-Y303 HydrophobicContact CB-CE1 4.32Å; M29-Y303 HydrophobicContact CE-CD1 3.55Å; M29-Y303 HydrophobicContact CE-CD2 4.32Å; M29-Y303 HydrophobicContact CE-CE1 4.06Å; M29-Y303 HydrophobicContact CE-CG 3.68Å; M29-Y303 HydrophobicContact SD-CD1 4.46Å; M29-E305 HydrophobicContact CB-CB 3.83Å; M29-E305 HydrophobicContact CB-CG 3.93Å; M29-V323 HydrophobicContact SD-CG1 3.82Å; M29-F327 HydrophobicContact CE-CE2 3.78Å; M29-F327 HydrophobicContact CE-CZ 3.97Å; M29-F327 HydrophobicContact CG-CE2 3.96Å; M29-F327 HydrophobicContact CG-CZ 3.92Å; M29-F327 HydrophobicContact SD-CE2 3.91Å; M29-F327 HydrophobicContact SD-CZ 4.35Å
30V93.1Very high92.6Very high8 Ų817.8 Ų17.85%0.0489%0.088CC..THydrogen-bonded Turntrans-57.7-20.9-176.568.30000112.5F26 I32 V33 L195 V330F26-V30 HydrophobicContact CD2-CB 4.46Å; F26-V30 HydrophobicContact CE1-CB 4.29Å; F26-V30 HydrophobicContact CE1-CG2 4.16Å; F26-V30 HydrophobicContact CE2-CB 4.06Å; F26-V30 HydrophobicContact CE2-CG2 3.75Å; F26-V30 HydrophobicContact CZ-CB 3.97Å; F26-V30 HydrophobicContact CZ-CG2 3.48Å; F26-V30 VanDerWaalsContact CZ-CG2 3.48Å; F26-V30 VanDerWaalsContact O-CB 3.29Å; F26-V30 WeakPolarHBondContact O-CB 3.39Å; F26-V30 PolarHBondContact O-N 2.88Å; V30-I32 PolarHBondContact O-N 3.05Å; V30-V33 HydrophobicContact CG2-CG1 4.43Å; V30-V33 HydrophobicContact CG2-CG2 4.39Å; V30-V33 WeakPolarHBondContact O-CG1 3.46Å; V30-V33 VanDerWaalsContact O-CG2 3.22Å; V30-V33 WeakPolarHBondContact O-CG2 3.44Å; V30-V33 PolarHBondContact O-N 3.19Å; V30-L195 HydrophobicContact CG1-CB 4.28Å; V30-L195 HydrophobicContact CG1-CD1 4Å; V30-L195 HydrophobicContact CG1-CD2 4.35Å; V30-L195 HydrophobicContact CG1-CG 4.44Å; V30-V330 HydrophobicContact CG2-CG2 4.34Å
31Y90.6Very high92.3Very high4 Ų415 Ų152%0.0168%0.079CC..THydrogen-bonded Turntrans-53.6-24.6174.673.4-99.3000113.3T28 M29 V33 F34 V35 V194 E305 A348 V352T28-Y31 VanDerWaalsContact O-CD1 3.23Å; T28-Y31 WeakPolarHBondContact O-CD1 3.48Å; T28-Y31 VanDerWaalsContact O-CE1 3.29Å; T28-Y31 WeakPolarHBondContact O-CE1 3.48Å; M29-Y31 PolarHBondContact O-N 3.31Å; Y31-V33 PolarHBondContact O-N 3.35Å; Y31-V33 VanDerWaalsContact O-N 3.16Å; Y31-F34 PolarHBondContact O-N 2.94Å; Y31-V35 HydrophobicContact CD2-CB 4.29Å; Y31-V35 HydrophobicContact CD2-CG2 3.74Å; Y31-V35 HydrophobicContact CE2-CG2 4.48Å; Y31-V35 WeakPolarHBondContact O-CG2 3.28Å; Y31-V35 PolarHBondContact O-N 2.83Å; Y31-V194 HydrophobicContact CD1-CB 4.34Å; Y31-V194 HydrophobicContact CD1-CG1 3.76Å; Y31-V194 HydrophobicContact CG-CG1 3.81Å; Y31-E305 HydrophobicContact CE1-CG 4.22Å; Y31-E305 PolarHBondContact OH-OE1 3.37Å; Y31-E305 VanDerWaalsContact OH-OE1 3.05Å; Y31-A348 HydrophobicContact CD2-CB 4.24Å; Y31-A348 HydrophobicContact CG-CB 4.29Å; Y31-V352 HydrophobicContact CE1-CG2 4.35Å; Y31-V352 HydrophobicContact CE2-CG2 4.33Å; Y31-V352 WeakPolarHBondContact OH-CG2 3.47Å
32I92.5Very high91.9Very high0 Ų017.9 Ų17.90%010%0.096CC..Hα-helixtrans-57.3-29.6178.5-167.758.2000112.8M29 V30 F34 V35 N36 T54 A76 M79 Y303 F327M29-I32 WeakPolarHBondContact O-CB 3.48Å; M29-I32 VanDerWaalsContact O-CG2 3.26Å; M29-I32 WeakPolarHBondContact O-CG2 3.46Å; M29-I32 PolarHBondContact O-N 2.95Å; V30-I32 PolarHBondContact O-N 3.05Å; I32-F34 PolarHBondContact O-N 2.96Å; I32-V35 PolarHBondContact O-N 3.32Å; I32-N36 HydrophobicContact CD1-CB 3.81Å; I32-N36 HydrophobicContact CG1-CB 4.12Å; I32-N36 VanDerWaalsContact O-CB 3.23Å; I32-N36 WeakPolarHBondContact O-CB 3.44Å; I32-N36 PolarHBondContact O-N 3.44Å; I32-T54 HydrophobicContact CG1-CG2 4.09Å; I32-T54 HydrophobicContact CG2-CG2 4.27Å; I32-A76 HydrophobicContact CG2-CB 4.43Å; I32-M79 HydrophobicContact CD1-CG 3.91Å; I32-M79 HydrophobicContact CD1-SD 3.23Å; I32-M79 WeakPolarHBondContact CD1-SD 3.37Å; I32-Y303 HydrophobicContact CB-CE1 4.38Å; I32-Y303 WeakPolarHBondContact CD1-OH 3.19Å; I32-Y303 HydrophobicContact CG1-CE1 4.49Å; I32-Y303 WeakPolarHBondContact CG1-OH 3.41Å; I32-F327 HydrophobicContact CG2-CE1 3.74Å; I32-F327 HydrophobicContact CG2-CZ 3.79Å
33V92.1Very high91.5Very high1 Ų118.3 Ų18.31%0.00610%0.1CC..Hα-helixtrans-68-21.3178.4-48.10000112.1V30 Y31 P37 F51 F327 V330V30-V33 HydrophobicContact CG2-CG1 4.43Å; V30-V33 HydrophobicContact CG2-CG2 4.39Å; V30-V33 WeakPolarHBondContact O-CG1 3.46Å; V30-V33 VanDerWaalsContact O-CG2 3.22Å; V30-V33 WeakPolarHBondContact O-CG2 3.44Å; V30-V33 PolarHBondContact O-N 3.19Å; Y31-V33 PolarHBondContact O-N 3.35Å; Y31-V33 VanDerWaalsContact O-N 3.16Å; V33-P37 VanDerWaalsContact O-CD 3.23Å; V33-P37 WeakPolarHBondContact O-CD 3.44Å; V33-P37 WeakPolarHBondContact O-CG 3.24Å; V33-F51 HydrophobicContact CB-CD2 3.87Å; V33-F51 HydrophobicContact CB-CE2 3.63Å; V33-F51 HydrophobicContact CG1-CE2 4.48Å; V33-F51 HydrophobicContact CG2-CD2 4.35Å; V33-F51 HydrophobicContact CG2-CE2 3.8Å; V33-F51 WeakPolarHBondContact O-CD2 3.22Å; V33-F327 HydrophobicContact CG1-CD1 3.99Å; V33-F327 HydrophobicContact CG1-CE1 3.59Å; V33-V330 HydrophobicContact CB-CG1 4.48Å; V33-V330 HydrophobicContact CG1-CG1 4.08Å; V33-V330 HydrophobicContact CG2-CG1 4.29Å
34F89.1Confident91.2Very high26 Ų2616.4 Ų16.411%0.11411%0.108CC..Hα-helixtrans-95-44.8174.4-50.3-67.8000110.7Y31 I32 Q38 L195 I198 A337 V340Y31-F34 PolarHBondContact O-N 2.94Å; I32-F34 PolarHBondContact O-N 2.96Å; F34-Q38 VanDerWaalsContact O-CG 3.28Å; F34-Q38 WeakPolarHBondContact O-CG 3.35Å; F34-Q38 PolarHBondContact O-N 3.11Å; F34-L195 HydrophobicContact CE2-CD1 4.28Å; F34-I198 HydrophobicContact CD2-CD1 3.87Å; F34-I198 HydrophobicContact CD2-CG2 4.23Å; F34-I198 HydrophobicContact CE2-CD1 4.46Å; F34-I198 HydrophobicContact CE2-CG2 4.37Å; F34-A337 HydrophobicContact CD1-CB 3.97Å; F34-A337 HydrophobicContact CE1-CB 4.02Å; F34-V340 HydrophobicContact CB-CB 4.35Å; F34-V340 HydrophobicContact CB-CG1 4.16Å; F34-V340 HydrophobicContact CD1-CB 3.91Å; F34-V340 HydrophobicContact CD1-CG1 4.45Å; F34-V340 HydrophobicContact CD1-CG2 3.41Å; F34-V340 VanDerWaalsContact CD1-CG2 3.41Å; F34-V340 HydrophobicContact CE1-CG2 3.64Å; F34-V340 HydrophobicContact CG-CB 4.3Å; F34-V340 HydrophobicContact CG-CG1 4.35Å; F34-V340 HydrophobicContact CG-CG2 4.01Å; F34-V340 HydrophobicContact CZ-CG2 4.42Å
35V87.7Confident91.2Very high0 Ų016.1 Ų16.10%011%0.106CC..Hα-helixtrans-73.6-40.3-171.8-179.50000112.3Y31 I32 Q38 I39 M79 A345 L349Y31-V35 HydrophobicContact CD2-CB 4.29Å; Y31-V35 HydrophobicContact CD2-CG2 3.74Å; Y31-V35 HydrophobicContact CE2-CG2 4.48Å; Y31-V35 WeakPolarHBondContact O-CG2 3.28Å; Y31-V35 PolarHBondContact O-N 2.83Å; I32-V35 PolarHBondContact O-N 3.32Å; V35-Q38 PolarHBondContact O-N 3.37Å; V35-I39 HydrophobicContact CG1-CD1 3.76Å; V35-I39 HydrophobicContact CG1-CG1 4.3Å; V35-I39 WeakPolarHBondContact O-CG1 3.43Å; V35-I39 PolarHBondContact O-N 3.21Å; V35-M79 HydrophobicContact CB-CE 4.25Å; V35-M79 HydrophobicContact CG1-CE 3.24Å; V35-M79 HydrophobicContact CG1-SD 4.01Å; V35-A345 HydrophobicContact CG2-CB 3.6Å; V35-L349 HydrophobicContact CG1-CD1 4.36Å; V35-L349 HydrophobicContact CG1-CD2 3.64Å; V35-L349 HydrophobicContact CG1-CG 4.09Å
36N91.9Very high91Very high0 Ų018.9 Ų18.90%012%0.121CC..Hα-helixtrans-64.4-48.3-178.4-17043000112.2I32 Q38 I39 L40 T54 N82I32-N36 HydrophobicContact CD1-CB 3.81Å; I32-N36 HydrophobicContact CG1-CB 4.12Å; I32-N36 VanDerWaalsContact O-CB 3.23Å; I32-N36 WeakPolarHBondContact O-CB 3.44Å; I32-N36 PolarHBondContact O-N 3.44Å; N36-Q38 VanDerWaalsContact C-N 3.29Å; N36-Q38 PolarHBondContact O-N 3.1Å; N36-I39 PolarHBondContact O-N 2.86Å; N36-L40 WeakPolarHBondContact O-CG 3.37Å; N36-L40 PolarHBondContact O-N 3.23Å; N36-T54 HydrophobicContact CB-CG2 4.22Å; N36-T54 PolarHBondContact ND2-OG1 3.41Å; N36-N82 PolarHBondContact OD1-ND2 3.41Å; N36-N82 PolarHBondContact OD1-OD1 2.95Å
37P90.7Very high90.7Very high9 Ų921 Ų216%0.05814%0.136CC..Hα-helixtrans-57-39.5172.3-28.337.9000113.9V33 G41 T47 V50 F51V33-P37 VanDerWaalsContact O-CD 3.23Å; V33-P37 WeakPolarHBondContact O-CD 3.44Å; V33-P37 WeakPolarHBondContact O-CG 3.24Å; P37-G41 WeakPolarHBondContact O-CA 3.45Å; P37-G41 PolarHBondContact O-N 3.23Å; P37-T47 WeakPolarHBondContact CB-O 3.46Å; P37-T47 WeakPolarHBondContact O-CG2 3.41Å; P37-V50 HydrophobicContact CB-CB 4.42Å; P37-V50 HydrophobicContact CB-CG1 4.23Å; P37-V50 HydrophobicContact CG-CB 4.46Å; P37-V50 HydrophobicContact CG-CG1 4.04Å; P37-F51 HydrophobicContact CG-CB 3.92Å
38Q87.5Confident90.5Very high37 Ų3721.2 Ų21.217%0.17314%0.141CC..Hα-helixtrans-64.1-42178-74.9178.7-10.800112.2F34 V35 N36 V42 V340 P341F34-Q38 VanDerWaalsContact O-CG 3.28Å; F34-Q38 WeakPolarHBondContact O-CG 3.35Å; F34-Q38 PolarHBondContact O-N 3.11Å; V35-Q38 PolarHBondContact O-N 3.37Å; N36-Q38 VanDerWaalsContact C-N 3.29Å; N36-Q38 PolarHBondContact O-N 3.1Å; Q38-V42 WeakPolarHBondContact O-CG2 3.24Å; Q38-V42 PolarHBondContact O-N 3.48Å; Q38-V340 PolarHBondContact NE2-O 3Å; Q38-P341 PolarHBondContact NE2-O 2.92Å
39I87.7Confident90.6Very high4 Ų420.3 Ų20.32%0.02114%0.136CC..Hα-helixtrans-69.9-49.3178.5-66.2172.9000110.9V35 N36 G41 V42 M79 N82 A86 F87 L349V35-I39 HydrophobicContact CG1-CD1 3.76Å; V35-I39 HydrophobicContact CG1-CG1 4.3Å; V35-I39 WeakPolarHBondContact O-CG1 3.43Å; V35-I39 PolarHBondContact O-N 3.21Å; N36-I39 PolarHBondContact O-N 2.86Å; I39-G41 VanDerWaalsContact C-N 3.29Å; I39-G41 PolarHBondContact O-N 2.84Å; I39-V42 WeakPolarHBondContact O-CB 3.48Å; I39-V42 PolarHBondContact O-N 3.17Å; I39-M79 HydrophobicContact CD1-CE 3.77Å; I39-M79 HydrophobicContact CD1-SD 4.41Å; I39-N82 HydrophobicContact CD1-CB 4.49Å; I39-N82 HydrophobicContact CG2-CB 3.96Å; I39-N82 WeakPolarHBondContact CG2-O 3.37Å; I39-A86 HydrophobicContact CG2-CB 3.72Å; I39-A86 VanDerWaalsContact O-CB 3.26Å; I39-A86 WeakPolarHBondContact O-CB 3.31Å; I39-F87 HydrophobicContact CG2-CE2 3.96Å; I39-L349 HydrophobicContact CD1-CD2 4.45Å
40L91.7Very high90.6Very high0 Ų020.3 Ų20.30%014%0.136CC..Hα-helixtrans-71.3-25.9-178.4-61.8-173.4000112.4N36 V42 A43 M45 V50 F85 M101N36-L40 WeakPolarHBondContact O-CG 3.37Å; N36-L40 PolarHBondContact O-N 3.23Å; L40-V42 VanDerWaalsContact C-N 3.26Å; L40-V42 PolarHBondContact O-N 3.47Å; L40-A43 VanDerWaalsContact O-CB 3.28Å; L40-A43 WeakPolarHBondContact O-CB 3.4Å; L40-A43 PolarHBondContact O-N 3.12Å; L40-M45 HydrophobicContact CB-CB 4.42Å; L40-M45 HydrophobicContact CB-SD 3.92Å; L40-M45 HydrophobicContact CD1-SD 4.29Å; L40-M45 HydrophobicContact CG-SD 4.47Å; L40-M45 WeakPolarHBondContact O-CB 3.48Å; L40-M45 PolarHBondContact O-N 2.89Å; L40-V50 HydrophobicContact CB-CG1 4.15Å; L40-V50 HydrophobicContact CB-CG2 4.24Å; L40-V50 HydrophobicContact CD1-CG1 3.73Å; L40-V50 HydrophobicContact CD1-CG2 4.39Å; L40-V50 HydrophobicContact CG-CG1 4.37Å; L40-F85 HydrophobicContact CD2-CD1 3.39Å; L40-F85 HydrophobicContact CD2-CE1 3.63Å; L40-M101 HydrophobicContact CD1-CE 4.02Å; L40-M101 HydrophobicContact CD2-CE 4.26Å
41G89.8Confident90.6Very high22 Ų2220.1 Ų20.123%0.22713%0.134CC..Hα-helixtrans-63-3217200000112.9P37 I39 A43 G44 M45P37-G41 WeakPolarHBondContact O-CA 3.45Å; P37-G41 PolarHBondContact O-N 3.23Å; I39-G41 VanDerWaalsContact C-N 3.29Å; I39-G41 PolarHBondContact O-N 2.84Å; G41-A43 PolarHBondContact O-N 3.38Å; G41-G44 WeakPolarHBondContact O-CA 3.47Å; G41-G44 PolarHBondContact O-N 3.3Å; G41-M45 WeakPolarHBondContact CA-O 3.46Å
42V86.3Confident90.8Very high61 Ų6120.2 Ų20.237%0.3714%0.135SC..Hα-helixtrans-65-25.3173.8174.90000112.1Q38 I39 L40 G44 F87 Q91Q38-V42 WeakPolarHBondContact O-CG2 3.24Å; Q38-V42 PolarHBondContact O-N 3.48Å; I39-V42 WeakPolarHBondContact O-CB 3.48Å; I39-V42 PolarHBondContact O-N 3.17Å; L40-V42 VanDerWaalsContact C-N 3.26Å; L40-V42 PolarHBondContact O-N 3.47Å; V42-G44 PolarHBondContact O-N 3.41Å; V42-F87 HydrophobicContact CB-CE1 4.31Å; V42-F87 HydrophobicContact CG1-CD1 4.2Å; V42-F87 HydrophobicContact CG1-CE1 3.72Å; V42-F87 HydrophobicContact CG1-CZ 4.49Å; V42-F87 HydrophobicContact CG2-CE1 4.46Å; V42-Q91 HydrophobicContact CG1-CG 4.49Å; V42-Q91 PolarHBondContact O-NE2 3.45Å
43A89.9Confident90.9Very high10 Ų1020.2 Ų20.28%0.08314%0.135CC..THydrogen-bonded Turntrans-79-2.4171.200000113.4L40 G41 F85 A86 V90 W97L40-A43 VanDerWaalsContact O-CB 3.28Å; L40-A43 WeakPolarHBondContact O-CB 3.4Å; L40-A43 PolarHBondContact O-N 3.12Å; G41-A43 PolarHBondContact O-N 3.38Å; A43-F85 HydrophobicContact CB-CD1 4.46Å; A43-F85 HydrophobicContact CB-CE1 3.75Å; A43-F85 HydrophobicContact CB-CZ 4.36Å; A43-A86 HydrophobicContact CB-CB 4.18Å; A43-V90 HydrophobicContact CB-CB 4.01Å; A43-V90 HydrophobicContact CB-CG1 3.81Å; A43-V90 HydrophobicContact CB-CG2 4.04Å; A43-W97 HydrophobicContact CB-CB 4.26Å
44G90.7Very high91Very high58 Ų5820.2 Ų20.260%0.59814%0.135SC*.THydrogen-bonded Turntrans90.313.7-177.400000114.7G41 V42G41-G44 WeakPolarHBondContact O-CA 3.47Å; G41-G44 PolarHBondContact O-N 3.3Å; V42-G44 PolarHBondContact O-N 3.41Å
45M93.4Very high91.3Very high8 Ų819 Ų194%0.03913%0.13CC..  trans-81.1148.9176.4-58.5-174.665.500111.8L40 G41 T47 V50 F85 W97 M101 V226 G296L40-M45 HydrophobicContact CB-CB 4.42Å; L40-M45 HydrophobicContact CB-SD 3.92Å; L40-M45 HydrophobicContact CD1-SD 4.29Å; L40-M45 HydrophobicContact CG-SD 4.47Å; L40-M45 WeakPolarHBondContact O-CB 3.48Å; L40-M45 PolarHBondContact O-N 2.89Å; G41-M45 WeakPolarHBondContact CA-O 3.46Å; M45-T47 PolarHBondContact O-N 3.38Å; M45-T47 VanDerWaalsContact O-N 3.15Å; M45-V50 HydrophobicContact CB-CG2 3.9Å; M45-V50 HydrophobicContact CE-CG2 3.9Å; M45-F85 HydrophobicContact SD-CE1 3.98Å; M45-F85 HydrophobicContact SD-CZ 4.21Å; M45-W97 HydrophobicContact CE-CD2 4.48Å; M45-W97 HydrophobicContact CE-CE3 3.76Å; M45-W97 HydrophobicContact CE-CH2 4.2Å; M45-W97 HydrophobicContact CE-CZ3 3.6Å; M45-W97 HydrophobicContact CG-CB 4.26Å; M45-W97 HydrophobicContact CG-CD2 3.67Å; M45-W97 HydrophobicContact CG-CE3 3.85Å; M45-W97 HydrophobicContact CG-CG 3.86Å; M45-W97 HydrophobicContact CG-CZ3 4.45Å; M45-W97 HydrophobicContact SD-CD2 4.24Å; M45-W97 HydrophobicContact SD-CE3 3.8Å; M45-W97 HydrophobicContact SD-CZ3 4.29Å; M45-M101 HydrophobicContact CE-CE 3.84Å; M45-M101 HydrophobicContact SD-CE 3.56Å; M45-M101 VanDerWaalsContact SD-CE 3.56Å; M45-V226 HydrophobicContact CE-CB 4.4Å; M45-V226 HydrophobicContact CE-CG1 3.53Å; M45-V226 HydrophobicContact CE-CG2 4.04Å; M45-G296 VanDerWaalsContact CE-O 3.29Å; M45-G296 WeakPolarHBondContact CE-O 3.49Å
46D92.2Very high91.7Very high59 Ų5922.2 Ų22.232%0.31615%0.146SC..  trans-65.9111.6173.8174.41.7000110.7S48 A49 V50 T225 V226D46-S48 VanDerWaalsContact C-N 3.26Å; D46-S48 PolarHBondContact O-N 3.08Å; D46-S48 WeakPolarHBondContact OD1-CB 3.46Å; D46-S48 PolarHBondContact OD1-N 3.06Å; D46-A49 HydrophobicContact CB-CB 4.09Å; D46-A49 PolarHBondContact O-N 3.33Å; D46-A49 PolarHBondContact OD1-N 3.48Å; D46-V50 VanDerWaalsContact O-CG2 3.29Å; D46-V50 WeakPolarHBondContact O-CG2 3.3Å; D46-V50 PolarHBondContact O-N 3.12Å; D46-T225 PolarHBondContact OD2-OG1 3.14Å; D46-V226 HydrophobicContact CB-CG2 4.36Å
47T90.2Very high91.9Very high66 Ų6622.2 Ų22.241%0.40515%0.147SC..Hα-helixtrans-62.8-31.4-176.259.10000112.9P37 M45 F51P37-T47 WeakPolarHBondContact CB-O 3.46Å; P37-T47 WeakPolarHBondContact O-CG2 3.41Å; M45-T47 PolarHBondContact O-N 3.38Å; M45-T47 VanDerWaalsContact O-N 3.15Å; T47-F51 WeakPolarHBondContact O-CB 3.4Å; T47-F51 PolarHBondContact O-N 2.86Å
48S90.1Very high92.2Very high54 Ų5421.8 Ų21.838%0.37814%0.144SC..Hα-helixtrans-72.1-42.4179.8-61.30000110.9D46 F51 V52D46-S48 VanDerWaalsContact C-N 3.26Å; D46-S48 PolarHBondContact O-N 3.08Å; D46-S48 WeakPolarHBondContact OD1-CB 3.46Å; D46-S48 PolarHBondContact OD1-N 3.06Å; S48-F51 WeakPolarHBondContact O-CB 3.32Å; S48-F51 PolarHBondContact O-N 3.32Å; S48-V52 PolarHBondContact O-N 3.21Å
49A92.1Very high92.7Very high0 Ų020.1 Ų20.10%014%0.137CC..Hα-helixtrans-66.7-43.4173.800000111.5D46 F51 V52 T53 T225 V226D46-A49 HydrophobicContact CB-CB 4.09Å; D46-A49 PolarHBondContact O-N 3.33Å; D46-A49 PolarHBondContact OD1-N 3.48Å; A49-F51 VanDerWaalsContact C-N 3.28Å; A49-F51 PolarHBondContact O-N 3.44Å; A49-V52 PolarHBondContact O-N 3.33Å; A49-V52 VanDerWaalsContact O-N 3.14Å; A49-T53 WeakPolarHBondContact O-CG2 3.36Å; A49-T53 PolarHBondContact O-N 2.71Å; A49-T53 PolarHBondContact O-OG1 2.91Å; A49-T225 WeakPolarHBondContact CB-OG1 3.25Å; A49-V226 HydrophobicContact CB-CB 4.09Å; A49-V226 HydrophobicContact CB-CG2 3.58Å
50V93.7Very high93.1Very high0 Ų023.3 Ų23.30%015%0.15CC..Hα-helixtrans-60.3-37.4176.71730000111.7P37 L40 M45 D46 V52 T53 T54 V226P37-V50 HydrophobicContact CB-CB 4.42Å; P37-V50 HydrophobicContact CB-CG1 4.23Å; P37-V50 HydrophobicContact CG-CB 4.46Å; P37-V50 HydrophobicContact CG-CG1 4.04Å; L40-V50 HydrophobicContact CB-CG1 4.15Å; L40-V50 HydrophobicContact CB-CG2 4.24Å; L40-V50 HydrophobicContact CD1-CG1 3.73Å; L40-V50 HydrophobicContact CD1-CG2 4.39Å; L40-V50 HydrophobicContact CG-CG1 4.37Å; M45-V50 HydrophobicContact CB-CG2 3.9Å; M45-V50 HydrophobicContact CE-CG2 3.9Å; D46-V50 VanDerWaalsContact O-CG2 3.29Å; D46-V50 WeakPolarHBondContact O-CG2 3.3Å; D46-V50 PolarHBondContact O-N 3.12Å; V50-V52 VanDerWaalsContact C-N 3.34Å; V50-V52 PolarHBondContact O-N 2.87Å; V50-T53 WeakPolarHBondContact CA-OG1 3.31Å; V50-T53 PolarHBondContact O-N 2.95Å; V50-T53 PolarHBondContact O-OG1 3.21Å; V50-T53 VanDerWaalsContact O-OG1 3.14Å; V50-T54 VanDerWaalsContact O-CB 3.22Å; V50-T54 WeakPolarHBondContact O-CB 3.31Å; V50-T54 PolarHBondContact O-N 2.91Å; V50-T54 PolarHBondContact O-OG1 3.16Å; V50-V226 HydrophobicContact CG2-CG2 4.18Å
51F93.2Very high93.4Very high4 Ų423.3 Ų23.32%0.01815%0.15CC..Hα-helixtrans-57.1-48.9174.6167.1-91.7000111.4V33 P37 T47 S48 A49 T54 C55 V330 S334 A337V33-F51 HydrophobicContact CB-CD2 3.87Å; V33-F51 HydrophobicContact CB-CE2 3.63Å; V33-F51 HydrophobicContact CG1-CE2 4.48Å; V33-F51 HydrophobicContact CG2-CD2 4.35Å; V33-F51 HydrophobicContact CG2-CE2 3.8Å; V33-F51 WeakPolarHBondContact O-CD2 3.22Å; P37-F51 HydrophobicContact CG-CB 3.92Å; T47-F51 WeakPolarHBondContact O-CB 3.4Å; T47-F51 PolarHBondContact O-N 2.86Å; S48-F51 WeakPolarHBondContact O-CB 3.32Å; S48-F51 PolarHBondContact O-N 3.32Å; A49-F51 VanDerWaalsContact C-N 3.28Å; A49-F51 PolarHBondContact O-N 3.44Å; F51-T54 WeakPolarHBondContact O-CB 3.24Å; F51-T54 PolarHBondContact O-N 3.03Å; F51-C55 PolarHBondContact O-N 2.82Å; F51-C55 VanDerWaalsContact O-N 3.12Å; F51-C55 PolarHBondContact O-SG 3.32Å; F51-V330 HydrophobicContact CE2-CG1 4.08Å; F51-V330 HydrophobicContact CZ-CG1 3.77Å; F51-V330 WeakPolarHBondContact CZ-O 3.19Å; F51-S334 VanDerWaalsContact CE1-CA 3.41Å; F51-S334 VanDerWaalsContact CE1-CB 3.48Å; F51-A337 HydrophobicContact CD2-CB 3.23Å; F51-A337 HydrophobicContact CE2-CB 3.33Å; F51-A337 HydrophobicContact CG-CB 4.01Å; F51-A337 HydrophobicContact CZ-CB 4.18Å
52V93.8Very high93.8Very high5 Ų522.2 Ų22.23%0.0314%0.139CC..Hα-helixtrans-66.4-46.8-179.1179.10000110.5S48 A49 V50 T54 C55 L56 P221 V223 I331S48-V52 PolarHBondContact O-N 3.21Å; A49-V52 PolarHBondContact O-N 3.33Å; A49-V52 VanDerWaalsContact O-N 3.14Å; V50-V52 VanDerWaalsContact C-N 3.34Å; V50-V52 PolarHBondContact O-N 2.87Å; V52-T54 VanDerWaalsContact C-N 3.29Å; V52-T54 PolarHBondContact O-N 3.36Å; V52-C55 PolarHBondContact O-N 3.26Å; V52-L56 HydrophobicContact CG1-CD1 3.86Å; V52-L56 HydrophobicContact CG1-CG 4.22Å; V52-L56 VanDerWaalsContact O-CG 3.32Å; V52-L56 WeakPolarHBondContact O-CG 3.15Å; V52-L56 PolarHBondContact O-N 2.88Å; V52-P221 HydrophobicContact CG2-CB 4.21Å; V52-P221 HydrophobicContact CG2-CG 4.15Å; V52-V223 HydrophobicContact CB-CG1 3.66Å; V52-V223 HydrophobicContact CG1-CG1 3.41Å; V52-V223 VanDerWaalsContact CG1-CG1 3.41Å; V52-I331 HydrophobicContact CG1-CG2 4.03Å; V52-I331 HydrophobicContact CG2-CG2 4.25Å
53T94.7Very high94.3Very high1 Ų120.9 Ų20.91%0.00613%0.13CC..Hα-helixtrans-64.4-34.9179.961.60000112A49 V50 L56 I57 V223 V226 V227 I295A49-T53 WeakPolarHBondContact O-CG2 3.36Å; A49-T53 PolarHBondContact O-N 2.71Å; A49-T53 PolarHBondContact O-OG1 2.91Å; V50-T53 WeakPolarHBondContact CA-OG1 3.31Å; V50-T53 PolarHBondContact O-N 2.95Å; V50-T53 PolarHBondContact O-OG1 3.21Å; V50-T53 VanDerWaalsContact O-OG1 3.14Å; T53-L56 PolarHBondContact O-N 3.39Å; T53-I57 WeakPolarHBondContact O-CG2 3.47Å; T53-I57 PolarHBondContact O-N 3.13Å; T53-V223 HydrophobicContact CG2-CB 4.06Å; T53-V223 HydrophobicContact CG2-CG1 3.88Å; T53-V226 HydrophobicContact CG2-CG1 4.5Å; T53-V227 HydrophobicContact CG2-CG2 3.87Å; T53-I295 WeakPolarHBondContact CG2-O 3.47Å
54T95.1Very high94.7Very high0 Ų022.6 Ų22.60%014%0.137CC..Hα-helixtrans-58.5-49.6172.1-61.20000111.3I32 N36 V50 F51 V52 A58 P77I32-T54 HydrophobicContact CG1-CG2 4.09Å; I32-T54 HydrophobicContact CG2-CG2 4.27Å; N36-T54 HydrophobicContact CB-CG2 4.22Å; N36-T54 PolarHBondContact ND2-OG1 3.41Å; V50-T54 VanDerWaalsContact O-CB 3.22Å; V50-T54 WeakPolarHBondContact O-CB 3.31Å; V50-T54 PolarHBondContact O-N 2.91Å; V50-T54 PolarHBondContact O-OG1 3.16Å; F51-T54 WeakPolarHBondContact O-CB 3.24Å; F51-T54 PolarHBondContact O-N 3.03Å; V52-T54 VanDerWaalsContact C-N 3.29Å; V52-T54 PolarHBondContact O-N 3.36Å; T54-A58 WeakPolarHBondContact O-CB 3.32Å; T54-A58 PolarHBondContact O-N 3.04Å; T54-P77 HydrophobicContact CG2-CG 4.05Å
55C95.5Very high95Very high0 Ų019.9 Ų19.90%011%0.108CC..Hα-helixtrans-65.2-43.4179.5-660000111.7F51 V52 A58 A59 I331F51-C55 PolarHBondContact O-N 2.82Å; F51-C55 VanDerWaalsContact O-N 3.12Å; F51-C55 PolarHBondContact O-SG 3.32Å; V52-C55 PolarHBondContact O-N 3.26Å; C55-A58 PolarHBondContact O-N 3.01Å; C55-A59 VanDerWaalsContact O-CB 3.27Å; C55-A59 WeakPolarHBondContact O-CB 3.13Å; C55-A59 PolarHBondContact O-N 2.69Å; C55-I331 HydrophobicContact CB-CD1 4.11Å; C55-I331 HydrophobicContact CB-CG1 3.49Å; C55-I331 VanDerWaalsContact CB-CG1 3.49Å
56L95.6Very high95.1Very high68 Ų6819.5 Ų19.536%0.35611%0.106SC..Hα-helixtrans-62-45.2179-71.8173.8000111.9V52 T53 A59 F60 L328 I331V52-L56 HydrophobicContact CG1-CD1 3.86Å; V52-L56 HydrophobicContact CG1-CG 4.22Å; V52-L56 VanDerWaalsContact O-CG 3.32Å; V52-L56 WeakPolarHBondContact O-CG 3.15Å; V52-L56 PolarHBondContact O-N 2.88Å; T53-L56 PolarHBondContact O-N 3.39Å; L56-A59 PolarHBondContact O-N 3.02Å; L56-F60 WeakPolarHBondContact O-CB 3.44Å; L56-F60 PolarHBondContact O-N 3.1Å; L56-L328 HydrophobicContact CD2-CD2 4.14Å; L56-I331 HydrophobicContact CD2-CD1 3.6Å; L56-I331 HydrophobicContact CG-CD1 3.98Å
57I96.2Very high95.3Very high1 Ų120.2 Ų20.21%0.00511%0.11CC..Hα-helixtrans-74.9-34.7-178.6-156.866.4000112.4T53 A59 F60 G61 P77 T291 I295 T297 V300T53-I57 WeakPolarHBondContact O-CG2 3.47Å; T53-I57 PolarHBondContact O-N 3.13Å; I57-A59 VanDerWaalsContact C-N 3.29Å; I57-A59 PolarHBondContact O-N 3.45Å; I57-F60 HydrophobicContact CD1-CB 4.39Å; I57-F60 HydrophobicContact CD1-CD1 3.97Å; I57-F60 PolarHBondContact O-N 3.24Å; I57-G61 PolarHBondContact O-N 3.43Å; I57-P77 HydrophobicContact CG2-CG 3.69Å; I57-T291 HydrophobicContact CD1-CG2 3.8Å; I57-I295 HydrophobicContact CB-CD1 4.16Å; I57-I295 HydrophobicContact CD1-CD1 4Å; I57-T297 HydrophobicContact CB-CG2 4.04Å; I57-T297 HydrophobicContact CG2-CG2 3.74Å; I57-V300 HydrophobicContact CB-CG2 4.19Å; I57-V300 HydrophobicContact CD1-CG2 4.41Å; I57-V300 HydrophobicContact CG1-CG2 3.29Å; I57-V300 HydrophobicContact CG2-CG2 3.8Å
58A97Very high95.5Very high0 Ų022.5 Ų22.50%012%0.115CC..Hα-helixtrans-63-41.1173.200000110.7T54 C55 S62 L75 A76 F327T54-A58 WeakPolarHBondContact O-CB 3.32Å; T54-A58 PolarHBondContact O-N 3.04Å; C55-A58 PolarHBondContact O-N 3.01Å; A58-S62 WeakPolarHBondContact O-CB 3.46Å; A58-S62 PolarHBondContact O-N 3.47Å; A58-S62 PolarHBondContact O-OG 3.23Å; A58-L75 VanDerWaalsContact CA-O 3.25Å; A58-L75 WeakPolarHBondContact CA-O 3.27Å; A58-A76 HydrophobicContact CB-CB 3.96Å; A58-F327 HydrophobicContact CB-CB 4.39Å; A58-F327 HydrophobicContact CB-CD1 4.03Å; A58-F327 HydrophobicContact CB-CD2 3.85Å; A58-F327 HydrophobicContact CB-CE1 4.22Å; A58-F327 HydrophobicContact CB-CE2 4.06Å; A58-F327 HydrophobicContact CB-CG 3.83Å; A58-F327 HydrophobicContact CB-CZ 4.24Å
59A97.3Very high95.7Very high2 Ų220 Ų202%0.01710%0.097CC..Hα-helixtrans-61.8-51.9172.600000112.1C55 L56 I57 S62 I63 G324 F327 L328C55-A59 VanDerWaalsContact O-CB 3.27Å; C55-A59 WeakPolarHBondContact O-CB 3.13Å; C55-A59 PolarHBondContact O-N 2.69Å; L56-A59 PolarHBondContact O-N 3.02Å; I57-A59 VanDerWaalsContact C-N 3.29Å; I57-A59 PolarHBondContact O-N 3.45Å; A59-S62 PolarHBondContact O-N 2.91Å; A59-I63 VanDerWaalsContact O-CB 3.27Å; A59-I63 WeakPolarHBondContact O-CB 3.28Å; A59-I63 WeakPolarHBondContact O-CD1 3.48Å; A59-I63 WeakPolarHBondContact O-CG1 3.41Å; A59-I63 PolarHBondContact O-N 2.96Å; A59-G324 WeakPolarHBondContact CB-O 3.5Å; A59-F327 HydrophobicContact CB-CB 4.28Å; A59-L328 HydrophobicContact CB-CD1 4.36Å; A59-L328 HydrophobicContact CB-CD2 3.54Å; A59-L328 HydrophobicContact CB-CG 3.58Å
60F97.2Very high95.8Very high70 Ų7020.4 Ų20.431%0.30710%0.099SC..Hα-helixtrans-56.1-56.4179175.5-99.7000111.4L56 I57 S62 I63 M64 I287 T291L56-F60 WeakPolarHBondContact O-CB 3.44Å; L56-F60 PolarHBondContact O-N 3.1Å; I57-F60 HydrophobicContact CD1-CB 4.39Å; I57-F60 HydrophobicContact CD1-CD1 3.97Å; I57-F60 PolarHBondContact O-N 3.24Å; F60-S62 PolarHBondContact O-N 3.23Å; F60-I63 PolarHBondContact O-N 3.29Å; F60-M64 HydrophobicContact CD1-CG 4.47Å; F60-M64 HydrophobicContact CD2-CG 4.15Å; F60-M64 HydrophobicContact CE1-CG 4.24Å; F60-M64 HydrophobicContact CE2-CG 3.9Å; F60-M64 HydrophobicContact CE2-SD 4.22Å; F60-M64 HydrophobicContact CG-CG 4.43Å; F60-M64 HydrophobicContact CZ-CG 3.95Å; F60-M64 HydrophobicContact CZ-SD 4.48Å; F60-M64 WeakPolarHBondContact O-CB 3.35Å; F60-M64 WeakPolarHBondContact O-CG 3.48Å; F60-M64 PolarHBondContact O-N 2.68Å; F60-I287 HydrophobicContact CE1-CG2 4.33Å; F60-I287 HydrophobicContact CZ-CG2 4.28Å; F60-T291 HydrophobicContact CE1-CG2 4.36Å
61G97Very high95.9Very high0 Ų020.6 Ų20.60%010%0.1CC..Hα-helixtrans-62.3-43.2-177.200000112.8I57 M64 M65 S288I57-G61 PolarHBondContact O-N 3.43Å; G61-M64 PolarHBondContact O-N 3.35Å; G61-M65 VanDerWaalsContact O-CB 3.32Å; G61-M65 WeakPolarHBondContact O-CB 3.5Å; G61-M65 PolarHBondContact O-N 3.21Å; G61-S288 VanDerWaalsContact CA-OG 3.3Å; G61-S288 WeakPolarHBondContact CA-OG 3.47Å
62S97.9Very high96Very high0 Ų020.4 Ų20.40%010%0.099CC..Hα-helixtrans-68.6-42-179.6-58.50000112.4A58 A59 F60 M65 G66 L75 A320A58-S62 WeakPolarHBondContact O-CB 3.46Å; A58-S62 PolarHBondContact O-N 3.47Å; A58-S62 PolarHBondContact O-OG 3.23Å; A59-S62 PolarHBondContact O-N 2.91Å; F60-S62 PolarHBondContact O-N 3.23Å; S62-M65 PolarHBondContact O-N 3.32Å; S62-G66 PolarHBondContact O-N 2.91Å; S62-L75 PolarHBondContact OG-N 3.19Å; S62-L75 PolarHBondContact OG-O 2.91Å; S62-L75 VanDerWaalsContact OG-O 3.06Å; S62-A320 WeakPolarHBondContact CB-O 3.46Å; S62-A320 WeakPolarHBondContact O-CB 3.39Å
63I97.8Very high96.1Very high33 Ų3320.2 Ų20.217%0.16910%0.098CC..Hα-helixtrans-65.3-44.4176.4-68.7166.7000110.3A59 F60 M65 G66 L67 L325 L328A59-I63 VanDerWaalsContact O-CB 3.27Å; A59-I63 WeakPolarHBondContact O-CB 3.28Å; A59-I63 WeakPolarHBondContact O-CD1 3.48Å; A59-I63 WeakPolarHBondContact O-CG1 3.41Å; A59-I63 PolarHBondContact O-N 2.96Å; F60-I63 PolarHBondContact O-N 3.29Å; I63-M65 VanDerWaalsContact C-N 3.32Å; I63-M65 PolarHBondContact O-N 2.92Å; I63-G66 PolarHBondContact O-N 3.45Å; I63-L67 HydrophobicContact CG2-CD1 3.66Å; I63-L67 HydrophobicContact CG2-CG 4.19Å; I63-L67 WeakPolarHBondContact O-CB 3.45Å; I63-L67 WeakPolarHBondContact O-CG 3.27Å; I63-L67 PolarHBondContact O-N 3.41Å; I63-L325 HydrophobicContact CD1-CD2 4.44Å; I63-L328 HydrophobicContact CD1-CD1 4.41Å
64M97.1Very high96.3Very high46 Ų4620.2 Ų20.223%0.22710%0.098CC..Hα-helixtrans-61.5-41.2176.5-67.9-6792.500111.7F60 G61 G66 L67 F68 V284F60-M64 HydrophobicContact CD1-CG 4.47Å; F60-M64 HydrophobicContact CD2-CG 4.15Å; F60-M64 HydrophobicContact CE1-CG 4.24Å; F60-M64 HydrophobicContact CE2-CG 3.9Å; F60-M64 HydrophobicContact CE2-SD 4.22Å; F60-M64 HydrophobicContact CG-CG 4.43Å; F60-M64 HydrophobicContact CZ-CG 3.95Å; F60-M64 HydrophobicContact CZ-SD 4.48Å; F60-M64 WeakPolarHBondContact O-CB 3.35Å; F60-M64 WeakPolarHBondContact O-CG 3.48Å; F60-M64 PolarHBondContact O-N 2.68Å; G61-M64 PolarHBondContact O-N 3.35Å; M64-G66 VanDerWaalsContact C-N 3.31Å; M64-G66 PolarHBondContact O-N 3.47Å; M64-L67 HydrophobicContact CE-CD1 4.18Å; M64-L67 PolarHBondContact O-N 2.89Å; M64-F68 HydrophobicContact CB-CD2 4.34Å; M64-F68 HydrophobicContact CE-CD2 4.27Å; M64-F68 HydrophobicContact CE-CE2 3.77Å; M64-F68 WeakPolarHBondContact O-CB 3.33Å; M64-F68 WeakPolarHBondContact O-CD2 3.36Å; M64-F68 PolarHBondContact O-N 3.26Å; M64-F68 HydrophobicContact SD-CD2 3.79Å; M64-F68 HydrophobicContact SD-CE2 3.41Å; M64-F68 WeakPolarHBondContact SD-CE2 3.38Å; M64-V284 HydrophobicContact CB-CG1 3.67Å; M64-V284 HydrophobicContact CB-CG2 4.17Å
65M96.9Very high96.4Very high0 Ų020.2 Ų20.20%010%0.098CC..Iπ-helixtrans-63.6-42.8177.6-174.859.875.100110.5G61 S62 I63 A69 N70 L71 V73 L75 L259 A281 V284G61-M65 VanDerWaalsContact O-CB 3.32Å; G61-M65 WeakPolarHBondContact O-CB 3.5Å; G61-M65 PolarHBondContact O-N 3.21Å; S62-M65 PolarHBondContact O-N 3.32Å; I63-M65 VanDerWaalsContact C-N 3.32Å; I63-M65 PolarHBondContact O-N 2.92Å; M65-A69 HydrophobicContact CG-CB 4.48Å; M65-A69 CarbonylContact O-C 3.55Å; M65-A69 WeakPolarHBondContact O-CA 3.5Å; M65-A69 VanDerWaalsContact O-CB 3.31Å; M65-A69 WeakPolarHBondContact O-CB 3.36Å; M65-A69 PolarHBondContact O-N 3.45Å; M65-A69 HydrophobicContact SD-CB 3.4Å; M65-A69 WeakPolarHBondContact SD-CB 3.3Å; M65-N70 PolarHBondContact O-N 2.95Å; M65-N70 VanDerWaalsContact O-N 3.1Å; M65-L71 HydrophobicContact CG-CB 4.45Å; M65-L71 HydrophobicContact SD-CB 4.34Å; M65-L71 HydrophobicContact SD-CD1 4.28Å; M65-V73 HydrophobicContact CG-CB 4.21Å; M65-V73 VanDerWaalsContact CG-O 3.23Å; M65-V73 WeakPolarHBondContact CG-O 3.31Å; M65-L75 HydrophobicContact CB-CD1 3.54Å; M65-L75 HydrophobicContact CE-CD1 3.64Å; M65-L75 HydrophobicContact CE-CD2 4.1Å; M65-L75 HydrophobicContact CE-CG 4.41Å; M65-L75 HydrophobicContact CG-CD1 3.68Å; M65-L259 HydrophobicContact CE-CD2 4.04Å; M65-A281 HydrophobicContact CE-CB 3.94Å; M65-A281 WeakPolarHBondContact CE-O 3.18Å; M65-A281 HydrophobicContact SD-CB 3.78Å; M65-V284 HydrophobicContact CB-CG1 4Å; M65-V284 HydrophobicContact CE-CB 4.19Å; M65-V284 HydrophobicContact CE-CG1 4.08Å
66G96.2Very high96.4Very high0 Ų020.2 Ų20.20%010%0.098CC..Iπ-helixtrans-62.3-49.2176.300000113.3F6 S62 I63 M64 N70 G317F6-G66 WeakPolarHBondContact CE1-O 3.43Å; S62-G66 PolarHBondContact O-N 2.91Å; I63-G66 PolarHBondContact O-N 3.45Å; M64-G66 VanDerWaalsContact C-N 3.31Å; M64-G66 PolarHBondContact O-N 3.47Å; G66-N70 VanDerWaalsContact O-CA 3.24Å; G66-N70 WeakPolarHBondContact O-CA 3.36Å; G66-N70 PolarHBondContact O-N 3.36Å; G66-G317 VanDerWaalsContact CA-CA 3.42Å; G66-G317 VanDerWaalsContact CA-O 3.24Å; G66-G317 WeakPolarHBondContact CA-O 3.32Å; G66-G317 WeakPolarHBondContact O-CA 3.35Å
67L95.7Very high96.3Very high75 Ų7517 Ų1739%0.3938%0.081SC..Iπ-helixtrans-75-43.4-175.6-64.3177000113V5 F6 I63 M64 V321V5-L67 HydrophobicContact CG1-CD2 4.48Å; F6-L67 HydrophobicContact CE1-CD2 4.3Å; F6-L67 HydrophobicContact CZ-CD2 3.92Å; I63-L67 HydrophobicContact CG2-CD1 3.66Å; I63-L67 HydrophobicContact CG2-CG 4.19Å; I63-L67 WeakPolarHBondContact O-CB 3.45Å; I63-L67 WeakPolarHBondContact O-CG 3.27Å; I63-L67 PolarHBondContact O-N 3.41Å; M64-L67 HydrophobicContact CE-CD1 4.18Å; M64-L67 PolarHBondContact O-N 2.89Å; L67-V321 HydrophobicContact CD2-CG2 4.14Å; L67-V321 HydrophobicContact CG-CG2 4.16Å
68F94.6Very high96.1Very high114 Ų11416.9 Ų16.950%0.58%0.081SC..Iπ-helixtrans-94.3-32.8-172.1-70.6-77.1000114.4M64 R277 Q280 V284M64-F68 HydrophobicContact CB-CD2 4.34Å; M64-F68 HydrophobicContact CE-CD2 4.27Å; M64-F68 HydrophobicContact CE-CE2 3.77Å; M64-F68 WeakPolarHBondContact O-CB 3.33Å; M64-F68 WeakPolarHBondContact O-CD2 3.36Å; M64-F68 PolarHBondContact O-N 3.26Å; M64-F68 HydrophobicContact SD-CD2 3.79Å; M64-F68 HydrophobicContact SD-CE2 3.41Å; M64-F68 WeakPolarHBondContact SD-CE2 3.38Å; F68-R277 PolarHBondContact O-NE 3.05Å; F68-R277 PolarHBondContact O-NH1 3.35Å; F68-R277 PolarHBondContact O-NH2 2.93Å; F68-Q280 WeakPolarHBondContact O-CB 3.22Å; F68-V284 HydrophobicContact CB-CG2 3.9Å
69A94.1Very high95.5Very high1 Ų117.5 Ų17.51%0.0088%0.084CC..Iπ-helixtrans-101.1-19.3177.500000112.6M65 L71 R277 Q280 A281M65-A69 HydrophobicContact CG-CB 4.48Å; M65-A69 CarbonylContact O-C 3.55Å; M65-A69 WeakPolarHBondContact O-CA 3.5Å; M65-A69 VanDerWaalsContact O-CB 3.31Å; M65-A69 WeakPolarHBondContact O-CB 3.36Å; M65-A69 PolarHBondContact O-N 3.45Å; M65-A69 HydrophobicContact SD-CB 3.4Å; M65-A69 WeakPolarHBondContact SD-CB 3.3Å; A69-L71 HydrophobicContact CB-CB 4.45Å; A69-L71 HydrophobicContact CB-CD1 4.07Å; A69-L71 HydrophobicContact CB-CG 4.1Å; A69-L71 PolarHBondContact O-N 2.89Å; A69-R277 WeakPolarHBondContact O-CB 3.39Å; A69-R277 VanDerWaalsContact O-CD 3.31Å; A69-R277 WeakPolarHBondContact O-CD 3.36Å; A69-Q280 HydrophobicContact CB-CB 4.25Å; A69-A281 HydrophobicContact CB-CB 3.96Å
70N95.4Very high94.7Very high8 Ų817.4 Ų17.44%0.0438%0.083CC..  trans53.340.2-173.8-169.335.3000112.6F6 M65 G66 R277 T316 G317F6-N70 WeakPolarHBondContact CA-OD1 3.23Å; F6-N70 VanDerWaalsContact CD1-OD1 3.28Å; F6-N70 WeakPolarHBondContact CD1-OD1 3.46Å; F6-N70 PolarHBondContact O-ND2 2.87Å; F6-N70 PolarHBondContact O-OD1 3.41Å; M65-N70 PolarHBondContact O-N 2.95Å; M65-N70 VanDerWaalsContact O-N 3.1Å; G66-N70 VanDerWaalsContact O-CA 3.24Å; G66-N70 WeakPolarHBondContact O-CA 3.36Å; G66-N70 PolarHBondContact O-N 3.36Å; N70-R277 VanDerWaalsContact CB-NH1 3.25Å; N70-T316 WeakPolarHBondContact OD1-CB 3.4Å; N70-G317 VanDerWaalsContact C-N 3.31Å; N70-G317 PolarHBondContact O-N 2.87Å; N70-G317 PolarHBondContact OD1-N 3.46Å
71L95.1Very high94.2Very high4 Ų414.1 Ų14.12%0.0217%0.069CC..  trans-111.3144.2179-68.1174.9000110.9M65 A69 V73 T263 L268 F275 A281 G317M65-L71 HydrophobicContact CG-CB 4.45Å; M65-L71 HydrophobicContact SD-CB 4.34Å; M65-L71 HydrophobicContact SD-CD1 4.28Å; A69-L71 HydrophobicContact CB-CB 4.45Å; A69-L71 HydrophobicContact CB-CD1 4.07Å; A69-L71 HydrophobicContact CB-CG 4.1Å; A69-L71 PolarHBondContact O-N 2.89Å; L71-V73 HydrophobicContact CB-CB 4.49Å; L71-V73 HydrophobicContact CB-CG2 4.06Å; L71-V73 PolarHBondContact O-N 3.01Å; L71-T263 HydrophobicContact CD1-CG2 4.29Å; L71-T263 HydrophobicContact CD2-CG2 4.19Å; L71-L268 HydrophobicContact CD2-CD1 3.98Å; L71-F275 HydrophobicContact CD1-CD2 3.83Å; L71-F275 HydrophobicContact CD1-CE2 3.62Å; L71-A281 HydrophobicContact CD1-CB 3.73Å; L71-G317 WeakPolarHBondContact O-CA 3.41Å
72P95.8Very high93.8Very high1 Ų114.1 Ų14.11%0.0067%0.069CC..SBendtrans-7943.317736.5-38.1000111.5V310 T316 T319P72-V310 HydrophobicContact CB-CG2 4.06Å; P72-V310 HydrophobicContact CG-CG2 3.73Å; P72-T316 VanDerWaalsContact CA-O 3.3Å; P72-T316 WeakPolarHBondContact CA-O 3.4Å; P72-T316 WeakPolarHBondContact CB-O 3.49Å; P72-T319 HydrophobicContact CB-CG2 4.1Å
73V96.4Very high93Very high0 Ų014.2 Ų14.20%07%0.07CC..  trans-113.5118.6-176.8-175.50000108.3M65 L71 L75 L259 V262 T263 A302 A320M65-V73 HydrophobicContact CG-CB 4.21Å; M65-V73 VanDerWaalsContact CG-O 3.23Å; M65-V73 WeakPolarHBondContact CG-O 3.31Å; L71-V73 HydrophobicContact CB-CB 4.49Å; L71-V73 HydrophobicContact CB-CG2 4.06Å; L71-V73 PolarHBondContact O-N 3.01Å; V73-L75 HydrophobicContact CG1-CD1 4.39Å; V73-L75 WeakPolarHBondContact O-CD1 3.32Å; V73-L259 HydrophobicContact CB-CD2 4.45Å; V73-L259 HydrophobicContact CG1-CD2 4.03Å; V73-L259 HydrophobicContact CG2-CD2 4.33Å; V73-V262 HydrophobicContact CG2-CB 4.23Å; V73-V262 HydrophobicContact CG2-CG1 3.83Å; V73-T263 HydrophobicContact CG2-CG2 4.45Å; V73-A302 HydrophobicContact CG1-CB 3.65Å; V73-A320 WeakPolarHBondContact O-CB 3.45Å
74A97.5Very high92.3Very high1 Ų113 Ų131%0.0086%0.063CC..  trans-85.7149.7171.800000110.7T25 M29 Y303 S306 V323T25-A74 HydrophobicContact CG2-CB 3.81Å; M29-A74 HydrophobicContact CE-CB 4.04Å; M29-A74 HydrophobicContact SD-CB 3.41Å; M29-A74 WeakPolarHBondContact SD-CB 3.46Å; A74-Y303 PolarHBondContact O-N 3.39Å; A74-S306 PolarHBondContact N-OG 2.96Å; A74-V323 HydrophobicContact CB-CB 4.21Å; A74-V323 HydrophobicContact CB-CG1 3.72Å; A74-V323 HydrophobicContact CB-CG2 4.29Å
75L97.1Very high92Very high0 Ų010.8 Ų10.80%05%0.052CC..EExtended strand (participates in β ladder)trans-121.5142.7180-77.772.7000109.8A58 S62 M65 V73 V284 V300 T301A58-L75 VanDerWaalsContact CA-O 3.25Å; A58-L75 WeakPolarHBondContact CA-O 3.27Å; S62-L75 PolarHBondContact OG-N 3.19Å; S62-L75 PolarHBondContact OG-O 2.91Å; S62-L75 VanDerWaalsContact OG-O 3.06Å; M65-L75 HydrophobicContact CB-CD1 3.54Å; M65-L75 HydrophobicContact CE-CD1 3.64Å; M65-L75 HydrophobicContact CE-CD2 4.1Å; M65-L75 HydrophobicContact CE-CG 4.41Å; M65-L75 HydrophobicContact CG-CD1 3.68Å; V73-L75 HydrophobicContact CG1-CD1 4.39Å; V73-L75 WeakPolarHBondContact O-CD1 3.32Å; L75-V284 HydrophobicContact CD2-CG1 4.16Å; L75-V300 HydrophobicContact CB-CG1 3.67Å; L75-V300 HydrophobicContact CD2-CG1 4.14Å; L75-V300 HydrophobicContact CG-CG1 4.38Å; L75-T301 VanDerWaalsContact CA-O 3.27Å; L75-T301 WeakPolarHBondContact CA-O 3.3Å
76A95.8Very high91.6Very high0 Ų010.8 Ų10.80%05%0.052CC..EExtended strand (participates in β ladder)trans-157.6172175.200000110.2M29 I32 A58 A78 V300 T301 Y303M29-A76 HydrophobicContact CE-CB 3.46Å; M29-A76 VanDerWaalsContact CE-CB 3.46Å; I32-A76 HydrophobicContact CG2-CB 4.43Å; A58-A76 HydrophobicContact CB-CB 3.96Å; A76-A78 PolarHBondContact O-N 3.47Å; A76-V300 WeakPolarHBondContact O-CA 3.45Å; A76-T301 PolarHBondContact N-O 3.5Å; A76-T301 VanDerWaalsContact N-O 3.14Å; A76-T301 PolarHBondContact O-N 3.48Å; A76-Y303 VanDerWaalsContact C-CE2 3.49Å; A76-Y303 HydrophobicContact CB-CD1 4.42Å; A76-Y303 HydrophobicContact CB-CD2 3.83Å; A76-Y303 HydrophobicContact CB-CE1 4.01Å; A76-Y303 HydrophobicContact CB-CE2 3.41Å; A76-Y303 VanDerWaalsContact CB-CE2 3.41Å; A76-Y303 HydrophobicContact CB-CG 4.33Å; A76-Y303 VanDerWaalsContact CB-CZ 3.49Å; A76-Y303 VanDerWaalsContact O-CE2 3.31Å; A76-Y303 WeakPolarHBondContact O-CE2 3.24Å
77P94.3Very high90.9Very high0 Ų011.3 Ų11.30%05%0.054CC..EExtended strand (participates in β ladder)trans-55.3135.2-179.9-29.339.1000112.6T54 I57 M79 T297 Y303T54-P77 HydrophobicContact CG2-CG 4.05Å; I57-P77 HydrophobicContact CG2-CG 3.69Å; P77-M79 PolarHBondContact O-N 3Å; P77-T297 VanDerWaalsContact CG-OG1 3.29Å; P77-T297 WeakPolarHBondContact CG-OG1 3.48Å; P77-Y303 WeakPolarHBondContact O-CE2 3.3Å; P77-Y303 PolarHBondContact O-OH 3.37Å
78A91.1Very high90.2Very high0 Ų08.7 Ų8.70%04%0.042CC..  trans-75.3117.1-171.400000111.8A76 G80 L81 N82 S299 T301A76-A78 PolarHBondContact O-N 3.47Å; A78-G80 PolarHBondContact O-N 3.17Å; A78-L81 HydrophobicContact CB-CB 4.07Å; A78-L81 HydrophobicContact CB-CD1 3.69Å; A78-L81 HydrophobicContact CB-CG 4.36Å; A78-L81 PolarHBondContact O-N 2.95Å; A78-L81 VanDerWaalsContact O-N 3.15Å; A78-N82 VanDerWaalsContact O-CG 3.27Å; A78-N82 PolarHBondContact O-N 3.05Å; A78-N82 PolarHBondContact O-ND2 3.03Å; A78-S299 VanDerWaalsContact CB-O 3.3Å; A78-S299 WeakPolarHBondContact CB-O 3.45Å; A78-S299 PolarHBondContact N-O 3.35Å; A78-T301 HydrophobicContact CB-CG2 3.39Å
79M84.5Confident89.8Confident12 Ų123.3 Ų3.36%0.0592%0.018CC..Hα-helixtrans-61.1-41-174.3-79.1-60.1-69.600113.9I32 V35 I39 P77 N82 A83 I143 L349I32-M79 HydrophobicContact CD1-CG 3.91Å; I32-M79 HydrophobicContact CD1-SD 3.23Å; I32-M79 WeakPolarHBondContact CD1-SD 3.37Å; V35-M79 HydrophobicContact CB-CE 4.25Å; V35-M79 HydrophobicContact CG1-CE 3.24Å; V35-M79 HydrophobicContact CG1-SD 4.01Å; I39-M79 HydrophobicContact CD1-CE 3.77Å; I39-M79 HydrophobicContact CD1-SD 4.41Å; P77-M79 PolarHBondContact O-N 3Å; M79-N82 PolarHBondContact O-N 3.22Å; M79-A83 PolarHBondContact O-N 3.04Å; M79-I143 HydrophobicContact CB-CD1 3.82Å; M79-L349 HydrophobicContact CE-CD2 3.14Å
80G80.3Confident89.6Confident1 Ų14 Ų41%0.012%0.023CC..Hα-helixtrans-63.7-42.6175.400000112.2A78 A83 F84 I387A78-G80 PolarHBondContact O-N 3.17Å; G80-A83 PolarHBondContact O-N 3.3Å; G80-F84 WeakPolarHBondContact O-CB 3.42Å; G80-F84 PolarHBondContact O-N 2.93Å; G80-I387 WeakPolarHBondContact O-CD1 3.2Å
81L87.5Confident89.1Confident0 Ų08.5 Ų8.50%04%0.043CC..Hα-helixtrans-71-34.2179.4-77.483.2000112.2A78 F84 F85 F247 V250 N251A78-L81 HydrophobicContact CB-CB 4.07Å; A78-L81 HydrophobicContact CB-CD1 3.69Å; A78-L81 HydrophobicContact CB-CG 4.36Å; A78-L81 PolarHBondContact O-N 2.95Å; A78-L81 VanDerWaalsContact O-N 3.15Å; L81-F84 PolarHBondContact O-N 3.27Å; L81-F85 VanDerWaalsContact O-CB 3.24Å; L81-F85 WeakPolarHBondContact O-CB 3.06Å; L81-F85 PolarHBondContact O-N 3.36Å; L81-F247 HydrophobicContact CB-CD1 4.32Å; L81-F247 HydrophobicContact CB-CE1 4.32Å; L81-F247 HydrophobicContact CD2-CD1 3.71Å; L81-F247 HydrophobicContact CD2-CE1 4.49Å; L81-F247 HydrophobicContact CG-CD1 4.03Å; L81-F247 HydrophobicContact CG-CE1 4.49Å; L81-V250 HydrophobicContact CD1-CB 4.24Å; L81-V250 HydrophobicContact CD1-CG1 3.57Å; L81-V250 HydrophobicContact CG-CG1 4.16Å; L81-N251 HydrophobicContact CD1-CB 4.47Å; L81-N251 HydrophobicContact CD2-CB 3.85Å
82N89.4Confident88.3Confident0 Ų012.1 Ų12.10%07%0.073CC..Hα-helixtrans-58.6-48.7173.2-74.3-35.4000111.6N36 I39 A78 M79 F85 A86 S298N36-N82 PolarHBondContact OD1-ND2 3.41Å; N36-N82 PolarHBondContact OD1-OD1 2.95Å; I39-N82 HydrophobicContact CD1-CB 4.49Å; I39-N82 HydrophobicContact CG2-CB 3.96Å; I39-N82 WeakPolarHBondContact CG2-O 3.37Å; A78-N82 VanDerWaalsContact O-CG 3.27Å; A78-N82 PolarHBondContact O-N 3.05Å; A78-N82 PolarHBondContact O-ND2 3.03Å; M79-N82 PolarHBondContact O-N 3.22Å; N82-F85 PolarHBondContact O-N 3.35Å; N82-A86 WeakPolarHBondContact O-CB 3.19Å; N82-A86 PolarHBondContact O-N 2.68Å; N82-S298 VanDerWaalsContact CG-OG 3.3Å; N82-S298 WeakPolarHBondContact OD1-CB 3.5Å; N82-S298 PolarHBondContact OD1-OG 3.27Å
83A80.9Confident87.8Confident2 Ų216.6 Ų16.62%0.01710%0.095CC..Hα-helixtrans-65.9-45179.600000111.2M79 G80 F85 A86 F87 F142 M146M79-A83 PolarHBondContact O-N 3.04Å; G80-A83 PolarHBondContact O-N 3.3Å; A83-F85 VanDerWaalsContact C-N 3.32Å; A83-F85 PolarHBondContact O-N 3.1Å; A83-A86 PolarHBondContact O-N 3.09Å; A83-F87 HydrophobicContact CB-CD2 4.09Å; A83-F87 HydrophobicContact CB-CE2 4.29Å; A83-F87 WeakPolarHBondContact O-CB 3.41Å; A83-F87 WeakPolarHBondContact O-CD2 3.48Å; A83-F87 PolarHBondContact O-N 2.88Å; A83-F142 HydrophobicContact CB-CD1 4.28Å; A83-F142 HydrophobicContact CB-CE1 3.64Å; A83-M146 HydrophobicContact CB-CG 4.44Å
84F82Confident87.3Confident8 Ų819.5 Ų19.54%0.03513%0.126CC..Iπ-helixtrans-59-44.3175.9-179.9-116.6000111.8G80 L81 V88 V89 V243 F247 I387G80-F84 WeakPolarHBondContact O-CB 3.42Å; G80-F84 PolarHBondContact O-N 2.93Å; L81-F84 PolarHBondContact O-N 3.27Å; F84-V88 HydrophobicContact CD2-CB 3.72Å; F84-V88 HydrophobicContact CD2-CG1 4.16Å; F84-V88 HydrophobicContact CD2-CG2 3.68Å; F84-V88 HydrophobicContact CE2-CB 3.81Å; F84-V88 HydrophobicContact CE2-CG1 3.73Å; F84-V88 HydrophobicContact CE2-CG2 4.11Å; F84-V88 WeakPolarHBondContact O-CA 3.35Å; F84-V88 WeakPolarHBondContact O-CB 3.32Å; F84-V88 PolarHBondContact O-N 3.42Å; F84-V89 HydrophobicContact CD1-CG2 4.36Å; F84-V89 HydrophobicContact CE1-CG2 3.98Å; F84-V89 HydrophobicContact CZ-CG2 4.19Å; F84-V89 PolarHBondContact O-N 3.44Å; F84-V89 VanDerWaalsContact O-N 3.13Å; F84-V243 HydrophobicContact CE1-CG1 4.49Å; F84-F247 AromaticContact CD1-CD1 3.87Å; F84-F247 HydrophobicContact CD1-CD1 3.87Å; F84-F247 AromaticContact CD1-CE1 3.39Å; F84-F247 HydrophobicContact CD1-CE1 3.39Å; F84-F247 HydrophobicContact CD1-CE2 4.29Å; F84-F247 AromaticContact CD1-CZ 3.61Å; F84-F247 HydrophobicContact CD1-CZ 3.61Å; F84-F247 HydrophobicContact CE1-CD1 4.26Å; F84-F247 HydrophobicContact CE1-CD2 4.4Å; F84-F247 HydrophobicContact CE1-CE1 4Å; F84-F247 HydrophobicContact CE1-CE2 4.12Å; F84-F247 HydrophobicContact CE1-CG 4.46Å; F84-F247 AromaticContact CE1-CZ 3.9Å; F84-F247 HydrophobicContact CE1-CZ 3.9Å; F84-F247 HydrophobicContact CG-CE1 4.44Å; F84-I387 HydrophobicContact CB-CD1 3.97Å
85F90.8Very high86.9Confident0 Ų021.3 Ų21.30%014%0.135CC..Iπ-helixtrans-59.7-56.6175.3167.5-101.1000112.8L40 A43 M45 L81 N82 A83 V89 V90 W97 G100 M101 I104 F247L40-F85 HydrophobicContact CD2-CD1 3.39Å; L40-F85 HydrophobicContact CD2-CE1 3.63Å; A43-F85 HydrophobicContact CB-CD1 4.46Å; A43-F85 HydrophobicContact CB-CE1 3.75Å; A43-F85 HydrophobicContact CB-CZ 4.36Å; M45-F85 HydrophobicContact SD-CE1 3.98Å; M45-F85 HydrophobicContact SD-CZ 4.21Å; L81-F85 VanDerWaalsContact O-CB 3.24Å; L81-F85 WeakPolarHBondContact O-CB 3.06Å; L81-F85 PolarHBondContact O-N 3.36Å; N82-F85 PolarHBondContact O-N 3.35Å; A83-F85 VanDerWaalsContact C-N 3.32Å; A83-F85 PolarHBondContact O-N 3.1Å; F85-V89 WeakPolarHBondContact O-CB 3.36Å; F85-V89 PolarHBondContact O-N 3.31Å; F85-V90 HydrophobicContact CD2-CG2 4.2Å; F85-V90 HydrophobicContact CE1-CG2 4.2Å; F85-V90 HydrophobicContact CE2-CG2 3.73Å; F85-V90 HydrophobicContact CZ-CG2 3.77Å; F85-V90 PolarHBondContact O-N 3.32Å; F85-W97 HydrophobicContact CZ-CB 3.87Å; F85-G100 VanDerWaalsContact CE2-C 3.47Å; F85-M101 HydrophobicContact CD1-CE 4.42Å; F85-M101 HydrophobicContact CE1-CE 3.89Å; F85-M101 HydrophobicContact CE2-CE 4.48Å; F85-M101 HydrophobicContact CE2-CG 3.98Å; F85-M101 HydrophobicContact CE2-SD 4.43Å; F85-M101 HydrophobicContact CZ-CE 3.89Å; F85-M101 HydrophobicContact CZ-CG 3.84Å; F85-M101 HydrophobicContact CZ-SD 4.34Å; F85-I104 HydrophobicContact CB-CD1 3.93Å; F85-I104 HydrophobicContact CD2-CD1 3.59Å; F85-I104 HydrophobicContact CD2-CG1 4.37Å; F85-I104 HydrophobicContact CE2-CD1 4.28Å; F85-I104 HydrophobicContact CG-CD1 3.83Å; F85-F247 HydrophobicContact CB-CE1 4.18Å; F85-F247 HydrophobicContact CB-CZ 3.88Å; F85-F247 HydrophobicContact CD2-CZ 4.44Å
86A88.7Confident86.7Confident0 Ų024.9 Ų24.90%016%0.158CC..Iπ-helixtrans-69.2-46.2-170.500000111.9I39 A43 N82 A83 Q91I39-A86 HydrophobicContact CG2-CB 3.72Å; I39-A86 VanDerWaalsContact O-CB 3.26Å; I39-A86 WeakPolarHBondContact O-CB 3.31Å; A43-A86 HydrophobicContact CB-CB 4.18Å; N82-A86 WeakPolarHBondContact O-CB 3.19Å; N82-A86 PolarHBondContact O-N 2.68Å; A83-A86 PolarHBondContact O-N 3.09Å; A86-Q91 WeakPolarHBondContact O-CG 3.37Å; A86-Q91 PolarHBondContact O-N 3.13Å; A86-Q91 VanDerWaalsContact O-N 3.15Å
87F82.1Confident86.6Confident10 Ų1026.1 Ų26.14%0.04416%0.163CC..Iπ-helixtrans-90.5-32.8-171.7-57.1-70.2000113.3I39 V42 A83 Q91 A92 M146 F385I39-F87 HydrophobicContact CG2-CE2 3.96Å; V42-F87 HydrophobicContact CB-CE1 4.31Å; V42-F87 HydrophobicContact CG1-CD1 4.2Å; V42-F87 HydrophobicContact CG1-CE1 3.72Å; V42-F87 HydrophobicContact CG1-CZ 4.49Å; V42-F87 HydrophobicContact CG2-CE1 4.46Å; A83-F87 HydrophobicContact CB-CD2 4.09Å; A83-F87 HydrophobicContact CB-CE2 4.29Å; A83-F87 WeakPolarHBondContact O-CB 3.41Å; A83-F87 WeakPolarHBondContact O-CD2 3.48Å; A83-F87 PolarHBondContact O-N 2.88Å; F87-Q91 WeakPolarHBondContact O-CB 3.22Å; F87-A92 PolarHBondContact O-N 2.92Å; F87-A92 VanDerWaalsContact O-N 3.1Å; F87-M146 HydrophobicContact CD1-CE 3.93Å; F87-M146 HydrophobicContact CD2-CE 3.46Å; F87-M146 VanDerWaalsContact CD2-CE 3.46Å; F87-M146 HydrophobicContact CD2-SD 4.03Å; F87-M146 HydrophobicContact CE1-CE 3.61Å; F87-M146 HydrophobicContact CE2-CE 3.18Å; F87-M146 HydrophobicContact CE2-SD 4.25Å; F87-M146 HydrophobicContact CG-CE 3.86Å; F87-M146 HydrophobicContact CG-SD 4.43Å; F87-M146 HydrophobicContact CZ-CE 3.25Å; F87-F385 HydrophobicContact CB-CE1 3.66Å; F87-F385 HydrophobicContact CB-CZ 3.97Å; F87-F385 HydrophobicContact CG-CZ 4.47Å
88V80.4Confident86.6Confident21 Ų2129 Ų2913%0.12718%0.176CC..Iπ-helixtrans-93.4-60.7-177.8-1710000110.5F84 A92 M93 F385F84-V88 HydrophobicContact CD2-CB 3.72Å; F84-V88 HydrophobicContact CD2-CG1 4.16Å; F84-V88 HydrophobicContact CD2-CG2 3.68Å; F84-V88 HydrophobicContact CE2-CB 3.81Å; F84-V88 HydrophobicContact CE2-CG1 3.73Å; F84-V88 HydrophobicContact CE2-CG2 4.11Å; F84-V88 WeakPolarHBondContact O-CA 3.35Å; F84-V88 WeakPolarHBondContact O-CB 3.32Å; F84-V88 PolarHBondContact O-N 3.42Å; V88-A92 WeakPolarHBondContact O-CB 3.41Å; V88-A92 PolarHBondContact O-N 2.82Å; V88-M93 WeakPolarHBondContact O-CG 3.43Å; V88-M93 PolarHBondContact O-N 3.11Å; V88-F385 HydrophobicContact CG2-CD1 3.92Å; V88-F385 HydrophobicContact CG2-CE1 4.12Å; V88-F385 WeakPolarHBondContact CG2-O 3.23Å
89V86Confident86.6Confident0 Ų029.8 Ų29.80%018%0.181CC..Iπ-helixtrans-69.8-46.4-172.6-179.20000111.6F84 F85 M93 L95 V243 F247F84-V89 HydrophobicContact CD1-CG2 4.36Å; F84-V89 HydrophobicContact CE1-CG2 3.98Å; F84-V89 HydrophobicContact CZ-CG2 4.19Å; F84-V89 PolarHBondContact O-N 3.44Å; F84-V89 VanDerWaalsContact O-N 3.13Å; F85-V89 WeakPolarHBondContact O-CB 3.36Å; F85-V89 PolarHBondContact O-N 3.31Å; V89-M93 WeakPolarHBondContact O-CB 3.25Å; V89-L95 HydrophobicContact CG1-CD1 3.83Å; V89-L95 WeakPolarHBondContact O-CB 3.32Å; V89-V243 HydrophobicContact CG1-CG1 4.17Å; V89-V243 HydrophobicContact CG2-CG1 3.61Å; V89-F247 HydrophobicContact CG2-CE2 3.97Å; V89-F247 HydrophobicContact CG2-CZ 3.92Å
90V90.3Very high87Confident17 Ų1729.2 Ų29.210%0.10318%0.179CC..Iπ-helixtrans-83.5-53.7-177.1175.20000111.4A43 F85 G94 L95 W97A43-V90 HydrophobicContact CB-CB 4.01Å; A43-V90 HydrophobicContact CB-CG1 3.81Å; A43-V90 HydrophobicContact CB-CG2 4.04Å; F85-V90 HydrophobicContact CD2-CG2 4.2Å; F85-V90 HydrophobicContact CE1-CG2 4.2Å; F85-V90 HydrophobicContact CE2-CG2 3.73Å; F85-V90 HydrophobicContact CZ-CG2 3.77Å; F85-V90 PolarHBondContact O-N 3.32Å; V90-G94 CarbonylContact O-C 3.57Å; V90-G94 VanDerWaalsContact O-CA 3.25Å; V90-G94 WeakPolarHBondContact O-CA 3.31Å; V90-G94 PolarHBondContact O-N 2.89Å; V90-L95 WeakPolarHBondContact CA-O 3.1Å; V90-L95 WeakPolarHBondContact CG1-O 3.2Å; V90-L95 PolarHBondContact O-N 3.12Å; V90-W97 HydrophobicContact CG1-CB 4.49Å; V90-W97 HydrophobicContact CG2-CB 4.04Å
91Q84.7Confident87.5Confident102 Ų10229.2 Ų29.248%0.47718%0.178SC..Iπ-helixtrans-75.9-59.5-176.7-74.4-162.5-17.200113.7V42 A86 F87 G94V42-Q91 HydrophobicContact CG1-CG 4.49Å; V42-Q91 PolarHBondContact O-NE2 3.45Å; A86-Q91 WeakPolarHBondContact O-CG 3.37Å; A86-Q91 PolarHBondContact O-N 3.13Å; A86-Q91 VanDerWaalsContact O-N 3.15Å; F87-Q91 WeakPolarHBondContact O-CB 3.22Å; Q91-G94 PolarHBondContact O-N 3.19Å
92A78.8Confident87.8Confident79 Ų7929.2 Ų29.265%0.65318%0.178SC*.Iπ-helixtrans-68.7-39.7-173.700000113.3F87 V88 G94F87-A92 PolarHBondContact O-N 2.92Å; F87-A92 VanDerWaalsContact O-N 3.1Å; V88-A92 WeakPolarHBondContact O-CB 3.41Å; V88-A92 PolarHBondContact O-N 2.82Å; A92-G94 VanDerWaalsContact C-N 3.35Å
93M84.7Confident88Confident95 Ų9529.2 Ų29.247%0.46818%0.178SC..SBendtrans-84.6-9176.7-54.2173.468.400113.3V88 V89 L95 V243V88-M93 WeakPolarHBondContact O-CG 3.43Å; V88-M93 PolarHBondContact O-N 3.11Å; V89-M93 WeakPolarHBondContact O-CB 3.25Å; M93-L95 VanDerWaalsContact C-N 3.28Å; M93-L95 HydrophobicContact CB-CD1 4.06Å; M93-L95 HydrophobicContact CB-CG 4.13Å; M93-L95 HydrophobicContact CE-CD1 3.97Å; M93-L95 PolarHBondContact O-N 3.24Å; M93-L95 HydrophobicContact SD-CD1 4.21Å; M93-V243 HydrophobicContact CE-CG2 3.84Å; M93-V243 HydrophobicContact SD-CG2 3.88Å
94G86.4Confident88.5Confident62 Ų6229.1 Ų29.164%0.63918%0.177SC*.  trans67.423.4179.700000114.6V90 Q91 A92V90-G94 CarbonylContact O-C 3.57Å; V90-G94 VanDerWaalsContact O-CA 3.25Å; V90-G94 WeakPolarHBondContact O-CA 3.31Å; V90-G94 PolarHBondContact O-N 2.89Å; Q91-G94 PolarHBondContact O-N 3.19Å; A92-G94 VanDerWaalsContact C-N 3.35Å
95L88.7Confident89.1Confident39 Ų3929.9 Ų29.920%0.20418%0.181CC..  trans-83143.3-178.9-66.4165.5000111.3V89 V90 M93 W97 L240V89-L95 HydrophobicContact CG1-CD1 3.83Å; V89-L95 WeakPolarHBondContact O-CB 3.32Å; V90-L95 WeakPolarHBondContact CA-O 3.1Å; V90-L95 WeakPolarHBondContact CG1-O 3.2Å; V90-L95 PolarHBondContact O-N 3.12Å; M93-L95 VanDerWaalsContact C-N 3.28Å; M93-L95 HydrophobicContact CB-CD1 4.06Å; M93-L95 HydrophobicContact CB-CG 4.13Å; M93-L95 HydrophobicContact CE-CD1 3.97Å; M93-L95 PolarHBondContact O-N 3.24Å; M93-L95 HydrophobicContact SD-CD1 4.21Å; L95-W97 PolarHBondContact O-N 3.33Å; L95-L240 HydrophobicContact CD1-CD2 3.5Å; L95-L240 VanDerWaalsContact CD1-CD2 3.5Å; L95-L240 HydrophobicContact CD2-CD2 4.45Å
96P92.8Very high89.3Confident74 Ų7433.4 Ų33.448%0.48119%0.194SC..  trans-57.7139.5168.6-19.830.8000111Q98 V99 G100P96-Q98 PolarHBondContact O-N 2.74Å; P96-Q98 VanDerWaalsContact O-N 3.14Å; P96-V99 HydrophobicContact CB-CG2 4.26Å; P96-V99 HydrophobicContact CG-CG2 4.29Å; P96-V99 WeakPolarHBondContact O-CB 3.44Å; P96-V99 PolarHBondContact O-N 3.2Å; P96-G100 PolarHBondContact O-N 2.87Å; P96-G100 VanDerWaalsContact O-N 3.12Å
97W93.5Very high89.4Confident27 Ų2733.5 Ų33.510%0.10220%0.195CC..Hα-helixtrans-59.4-29.7-177.973.8-103.7000112.6A43 M45 F85 V90 L95 V99 G100 M101 H229A43-W97 HydrophobicContact CB-CB 4.26Å; M45-W97 HydrophobicContact CE-CD2 4.48Å; M45-W97 HydrophobicContact CE-CE3 3.76Å; M45-W97 HydrophobicContact CE-CH2 4.2Å; M45-W97 HydrophobicContact CE-CZ3 3.6Å; M45-W97 HydrophobicContact CG-CB 4.26Å; M45-W97 HydrophobicContact CG-CD2 3.67Å; M45-W97 HydrophobicContact CG-CE3 3.85Å; M45-W97 HydrophobicContact CG-CG 3.86Å; M45-W97 HydrophobicContact CG-CZ3 4.45Å; M45-W97 HydrophobicContact SD-CD2 4.24Å; M45-W97 HydrophobicContact SD-CE3 3.8Å; M45-W97 HydrophobicContact SD-CZ3 4.29Å; F85-W97 HydrophobicContact CZ-CB 3.87Å; V90-W97 HydrophobicContact CG1-CB 4.49Å; V90-W97 HydrophobicContact CG2-CB 4.04Å; L95-W97 PolarHBondContact O-N 3.33Å; W97-V99 VanDerWaalsContact C-N 3.33Å; W97-V99 PolarHBondContact O-N 3.19Å; W97-G100 PolarHBondContact O-N 3.14Å; W97-M101 HydrophobicContact CE3-CG 3.95Å; W97-M101 HydrophobicContact CZ3-CG 4.23Å; W97-M101 WeakPolarHBondContact O-CB 3Å; W97-M101 WeakPolarHBondContact O-CG 3.3Å; W97-M101 PolarHBondContact O-N 3.32Å; W97-H229 HydrophobicContact CH2-CB 3.66Å; W97-H229 HydrophobicContact CZ2-CB 4.22Å
98Q94.3Very high90Very high59 Ų5933 Ų3328%0.27619%0.193SC..Hα-helixtrans-60.8-42.7176-62.888.9-18.500111.7P96 G102 H229 D231P96-Q98 PolarHBondContact O-N 2.74Å; P96-Q98 VanDerWaalsContact O-N 3.14Å; Q98-G102 PolarHBondContact O-N 3.41Å; Q98-G102 VanDerWaalsContact O-N 3.12Å; Q98-H229 VanDerWaalsContact CB-O 3.26Å; Q98-H229 WeakPolarHBondContact CB-O 3.48Å; Q98-H229 HydrophobicContact CG-CB 4.49Å; Q98-H229 WeakPolarHBondContact CG-O 3.22Å; Q98-D231 HydrophobicContact CB-CB 4.06Å; Q98-D231 PolarHBondContact O-N 2.93Å
99V92.4Very high90.7Very high17 Ų1733.9 Ų33.910%0.10320%0.196CC..Hα-helixtrans-71-42.8177.9179.40000110P96 W97 M101 G102 A103 D231 S235 L240P96-V99 HydrophobicContact CB-CG2 4.26Å; P96-V99 HydrophobicContact CG-CG2 4.29Å; P96-V99 WeakPolarHBondContact O-CB 3.44Å; P96-V99 PolarHBondContact O-N 3.2Å; W97-V99 VanDerWaalsContact C-N 3.33Å; W97-V99 PolarHBondContact O-N 3.19Å; V99-M101 VanDerWaalsContact C-N 3.33Å; V99-M101 PolarHBondContact O-N 3.07Å; V99-G102 PolarHBondContact O-N 3.49Å; V99-G102 VanDerWaalsContact O-N 3.15Å; V99-A103 PolarHBondContact O-N 2.88Å; V99-D231 HydrophobicContact CG2-CB 4.22Å; V99-S235 WeakPolarHBondContact O-CB 3.26Å; V99-L240 HydrophobicContact CG1-CD1 3.46Å; V99-L240 VanDerWaalsContact CG1-CD1 3.46Å
100G91.6Very high91Very high1 Ų134.7 Ų34.71%0.0120%0.204CC..Hα-helixtrans-60.9-40.1175.300000112.6F85 P96 W97 G102 A103 I104F85-G100 VanDerWaalsContact CE2-C 3.47Å; P96-G100 PolarHBondContact O-N 2.87Å; P96-G100 VanDerWaalsContact O-N 3.12Å; W97-G100 PolarHBondContact O-N 3.14Å; G100-G102 VanDerWaalsContact C-N 3.31Å; G100-G102 PolarHBondContact O-N 3.33Å; G100-A103 WeakPolarHBondContact O-CB 3.29Å; G100-A103 PolarHBondContact O-N 3.39Å; G100-A103 VanDerWaalsContact O-N 3.14Å; G100-I104 WeakPolarHBondContact O-CG1 3.44Å; G100-I104 PolarHBondContact O-N 3.07Å
101M92.5Very high91Very high0 Ų033.9 Ų33.90%020%0.199CC..Hα-helixtrans-65.2-36.6175.1-81.7-65.6179.700111.5L40 M45 F85 W97 V99 A103 I104 F105 V230L40-M101 HydrophobicContact CD1-CE 4.02Å; L40-M101 HydrophobicContact CD2-CE 4.26Å; M45-M101 HydrophobicContact CE-CE 3.84Å; M45-M101 HydrophobicContact SD-CE 3.56Å; M45-M101 VanDerWaalsContact SD-CE 3.56Å; F85-M101 HydrophobicContact CD1-CE 4.42Å; F85-M101 HydrophobicContact CE1-CE 3.89Å; F85-M101 HydrophobicContact CE2-CE 4.48Å; F85-M101 HydrophobicContact CE2-CG 3.98Å; F85-M101 HydrophobicContact CE2-SD 4.43Å; F85-M101 HydrophobicContact CZ-CE 3.89Å; F85-M101 HydrophobicContact CZ-CG 3.84Å; F85-M101 HydrophobicContact CZ-SD 4.34Å; W97-M101 HydrophobicContact CE3-CG 3.95Å; W97-M101 HydrophobicContact CZ3-CG 4.23Å; W97-M101 WeakPolarHBondContact O-CB 3Å; W97-M101 WeakPolarHBondContact O-CG 3.3Å; W97-M101 PolarHBondContact O-N 3.32Å; V99-M101 VanDerWaalsContact C-N 3.33Å; V99-M101 PolarHBondContact O-N 3.07Å; M101-A103 VanDerWaalsContact C-N 3.3Å; M101-A103 PolarHBondContact O-N 3.08Å; M101-I104 WeakPolarHBondContact O-CB 3.25Å; M101-I104 PolarHBondContact O-N 3.47Å; M101-I104 HydrophobicContact SD-CD1 3.87Å; M101-F105 PolarHBondContact O-N 3.28Å; M101-V230 HydrophobicContact CB-CG1 4.14Å; M101-V230 HydrophobicContact CB-CG2 4.2Å
102G93.5Very high91.5Very high0 Ų030.6 Ų30.60%019%0.185CC..Hα-helixtrans-61.2-39.2171.900000112.1Q98 V99 G100 I104 F105 W106 S235Q98-G102 PolarHBondContact O-N 3.41Å; Q98-G102 VanDerWaalsContact O-N 3.12Å; V99-G102 PolarHBondContact O-N 3.49Å; V99-G102 VanDerWaalsContact O-N 3.15Å; G100-G102 VanDerWaalsContact C-N 3.31Å; G100-G102 PolarHBondContact O-N 3.33Å; G102-I104 PolarHBondContact O-N 3.41Å; G102-F105 WeakPolarHBondContact O-CB 3.39Å; G102-F105 PolarHBondContact O-N 2.81Å; G102-W106 PolarHBondContact O-N 3.38Å; G102-S235 VanDerWaalsContact C-OG 3.27Å; G102-S235 VanDerWaalsContact CA-OG 3.26Å; G102-S235 WeakPolarHBondContact CA-OG 3.2Å
103A92.3Very high92.2Very high0 Ų030.6 Ų30.60%017%0.174CC..Hα-helixtrans-64.7-39.417500000112.3V99 G100 M101 F105 G107 V243 I244 F247V99-A103 PolarHBondContact O-N 2.88Å; G100-A103 WeakPolarHBondContact O-CB 3.29Å; G100-A103 PolarHBondContact O-N 3.39Å; G100-A103 VanDerWaalsContact O-N 3.14Å; M101-A103 VanDerWaalsContact C-N 3.3Å; M101-A103 PolarHBondContact O-N 3.08Å; A103-F105 VanDerWaalsContact C-N 3.34Å; A103-G107 PolarHBondContact O-N 2.87Å; A103-V243 HydrophobicContact CB-CG1 4.11Å; A103-I244 HydrophobicContact CB-CG1 3.82Å; A103-F247 HydrophobicContact CB-CD2 4.4Å; A103-F247 HydrophobicContact CB-CE2 4.39Å
104I93.1Very high92.5Very high0 Ų027.8 Ų27.80%016%0.16CC..Hα-helixtrans-61.8-44.3172.3-61.1174.4000110.3F85 G100 M101 G102 G107 A108 F247 S299F85-I104 HydrophobicContact CB-CD1 3.93Å; F85-I104 HydrophobicContact CD2-CD1 3.59Å; F85-I104 HydrophobicContact CD2-CG1 4.37Å; F85-I104 HydrophobicContact CE2-CD1 4.28Å; F85-I104 HydrophobicContact CG-CD1 3.83Å; G100-I104 WeakPolarHBondContact O-CG1 3.44Å; G100-I104 PolarHBondContact O-N 3.07Å; M101-I104 WeakPolarHBondContact O-CB 3.25Å; M101-I104 PolarHBondContact O-N 3.47Å; M101-I104 HydrophobicContact SD-CD1 3.87Å; G102-I104 PolarHBondContact O-N 3.41Å; I104-G107 PolarHBondContact O-N 3.34Å; I104-A108 WeakPolarHBondContact O-CB 3.25Å; I104-A108 PolarHBondContact O-N 2.89Å; I104-F247 HydrophobicContact CD1-CE1 4.02Å; I104-F247 HydrophobicContact CD1-CE2 4.45Å; I104-F247 HydrophobicContact CD1-CZ 3.93Å; I104-F247 HydrophobicContact CG1-CD1 3.92Å; I104-F247 HydrophobicContact CG1-CD2 3.79Å; I104-F247 HydrophobicContact CG1-CE1 3.62Å; I104-F247 HydrophobicContact CG1-CE2 3.52Å; I104-F247 HydrophobicContact CG1-CG 3.99Å; I104-F247 HydrophobicContact CG1-CZ 3.44Å; I104-F247 VanDerWaalsContact CG1-CZ 3.44Å; I104-S299 VanDerWaalsContact CG2-OG 3.24Å; I104-S299 WeakPolarHBondContact CG2-OG 3.5Å
105F94.5Very high92.6Very high25 Ų2525.2 Ų25.211%0.1113%0.132CC..Hα-helixtrans-59.4-48.9179.4177.2-90.5000112M101 G102 A103 G107 A108 I109 L232 V290 S293 F294M101-F105 PolarHBondContact O-N 3.28Å; G102-F105 WeakPolarHBondContact O-CB 3.39Å; G102-F105 PolarHBondContact O-N 2.81Å; A103-F105 VanDerWaalsContact C-N 3.34Å; F105-G107 VanDerWaalsContact C-N 3.3Å; F105-G107 PolarHBondContact O-N 3.4Å; F105-A108 WeakPolarHBondContact O-CB 3.34Å; F105-A108 PolarHBondContact O-N 2.96Å; F105-I109 HydrophobicContact CD1-CG1 4.06Å; F105-I109 HydrophobicContact CE1-CD1 4.21Å; F105-I109 HydrophobicContact CE1-CG1 3.67Å; F105-I109 HydrophobicContact CE2-CG1 4.47Å; F105-I109 HydrophobicContact CZ-CD1 3.98Å; F105-I109 HydrophobicContact CZ-CG1 3.9Å; F105-I109 WeakPolarHBondContact O-CG1 3.14Å; F105-I109 PolarHBondContact O-N 3.27Å; F105-L232 HydrophobicContact CB-CD2 4.03Å; F105-L232 HydrophobicContact CD1-CD2 3.25Å; F105-L232 HydrophobicContact CD2-CD2 4.36Å; F105-L232 HydrophobicContact CE1-CD1 4.46Å; F105-L232 HydrophobicContact CE1-CD2 3.7Å; F105-L232 HydrophobicContact CG-CD2 3.62Å; F105-L232 HydrophobicContact CZ-CD2 4.42Å; F105-V290 HydrophobicContact CD2-CG1 4.33Å; F105-V290 HydrophobicContact CE2-CG1 3.68Å; F105-V290 HydrophobicContact CZ-CG1 4.25Å; F105-S293 WeakPolarHBondContact CA-OG 3.41Å; F105-F294 HydrophobicContact CD2-CB 3.87Å; F105-F294 HydrophobicContact CD2-CD2 4.24Å; F105-F294 HydrophobicContact CE2-CB 3.84Å; F105-F294 AromaticContact CE2-CD2 3.86Å; F105-F294 HydrophobicContact CE2-CD2 3.86Å; F105-F294 HydrophobicContact CE2-CG 4.24Å; F105-F294 HydrophobicContact CZ-CD2 4.48Å
106W93.2Very high92.8Very high74 Ų7427 Ų2728%0.2814%0.141SC..Hα-helixtrans-63.5-36.6175.9-71.2119.8000112.3G102 A108 I109 G110 L232 S235 F236 I244G102-W106 PolarHBondContact O-N 3.38Å; W106-A108 VanDerWaalsContact C-N 3.34Å; W106-A108 PolarHBondContact O-N 2.62Å; W106-I109 HydrophobicContact CE3-CB 4.39Å; W106-I109 HydrophobicContact CE3-CG2 4.39Å; W106-I109 PolarHBondContact O-N 3.14Å; W106-G110 PolarHBondContact O-N 3.29Å; W106-L232 PolarHBondContact NE1-O 3.05Å; W106-S235 PolarHBondContact NE1-OG 3.44Å; W106-F236 AromaticContact CD2-CD2 3.75Å; W106-F236 HydrophobicContact CD2-CD2 3.75Å; W106-F236 HydrophobicContact CD2-CE2 4.1Å; W106-F236 AromaticContact CE2-CD2 3.52Å; W106-F236 HydrophobicContact CE3-CD2 4.29Å; W106-F236 HydrophobicContact CE3-CE2 4.19Å; W106-F236 HydrophobicContact CG-CD2 4.07Å; W106-F236 HydrophobicContact CH2-CD2 4.41Å; W106-F236 AromaticContact CZ2-CD2 3.88Å; W106-F236 HydrophobicContact CZ2-CD2 3.88Å; W106-F236 HydrophobicContact CZ2-CE2 4.42Å; W106-F236 HydrophobicContact CZ2-CG 4.45Å; W106-F236 HydrophobicContact CZ3-CE2 4.4Å; W106-F236 AromaticContact NE1-CD2 3.68Å; W106-I244 HydrophobicContact CB-CD1 3.94Å; W106-I244 HydrophobicContact CB-CG1 4.13Å; W106-I244 HydrophobicContact CB-CG2 3.82Å; W106-I244 HydrophobicContact CG-CD1 4.38Å
107G92.1Very high92.6Very high1 Ų130.4 Ų30.41%0.0115%0.148CC..Hα-helixtrans-62.8-40.8173.700000112.3A103 I104 F105 G110 L111A103-G107 PolarHBondContact O-N 2.87Å; I104-G107 PolarHBondContact O-N 3.34Å; F105-G107 VanDerWaalsContact C-N 3.3Å; F105-G107 PolarHBondContact O-N 3.4Å; G107-G110 PolarHBondContact O-N 3.11Å; G107-L111 PolarHBondContact O-N 3.03Å
108A94.3Very high92.1Very high0 Ų037.2 Ų37.20%017%0.174CC..Hα-helixtrans-68.3-38.6175.400000112.6I104 F105 W106 L111 L112 V290I104-A108 WeakPolarHBondContact O-CB 3.25Å; I104-A108 PolarHBondContact O-N 2.89Å; F105-A108 WeakPolarHBondContact O-CB 3.34Å; F105-A108 PolarHBondContact O-N 2.96Å; W106-A108 VanDerWaalsContact C-N 3.34Å; W106-A108 PolarHBondContact O-N 2.62Å; A108-L111 WeakPolarHBondContact O-CB 3.5Å; A108-L111 PolarHBondContact O-N 3.49Å; A108-L112 PolarHBondContact O-N 2.87Å; A108-V290 HydrophobicContact CB-CB 4.46Å; A108-V290 HydrophobicContact CB-CG2 3.79Å; A108-V290 WeakPolarHBondContact O-CG2 3.46Å
109I94.4Very high91.5Very high40 Ų4036.9 Ų36.921%0.20518%0.176CC..Hα-helixtrans-62.7-44.3172.2-69.9-70.5000110.2F105 W106 L111 L112 L113 V290F105-I109 HydrophobicContact CD1-CG1 4.06Å; F105-I109 HydrophobicContact CE1-CD1 4.21Å; F105-I109 HydrophobicContact CE1-CG1 3.67Å; F105-I109 HydrophobicContact CE2-CG1 4.47Å; F105-I109 HydrophobicContact CZ-CD1 3.98Å; F105-I109 HydrophobicContact CZ-CG1 3.9Å; F105-I109 WeakPolarHBondContact O-CG1 3.14Å; F105-I109 PolarHBondContact O-N 3.27Å; W106-I109 HydrophobicContact CE3-CB 4.39Å; W106-I109 HydrophobicContact CE3-CG2 4.39Å; W106-I109 PolarHBondContact O-N 3.14Å; I109-L111 VanDerWaalsContact C-N 3.3Å; I109-L111 PolarHBondContact O-N 3.28Å; I109-L112 WeakPolarHBondContact O-CB 3.47Å; I109-L112 PolarHBondContact O-N 3.24Å; I109-L112 VanDerWaalsContact O-N 3.14Å; I109-L113 HydrophobicContact CG2-CD1 4.19Å; I109-L113 HydrophobicContact CG2-CG 4.44Å; I109-L113 WeakPolarHBondContact O-CG 3.46Å; I109-L113 PolarHBondContact O-N 2.95Å; I109-V290 HydrophobicContact CD1-CB 4.4Å; I109-V290 HydrophobicContact CD1-CG1 3.62Å; I109-V290 HydrophobicContact CD1-CG2 3.78Å; I109-V290 HydrophobicContact CG1-CG1 4.35Å; I109-V290 HydrophobicContact CG1-CG2 4.17Å
110G92.7Very high90.9Very high16 Ų1636.1 Ų36.117%0.16517%0.171CC..Hα-helixtrans-55.7-45.617300000111.8W106 G107 L112 L113 L114W106-G110 PolarHBondContact O-N 3.29Å; G107-G110 PolarHBondContact O-N 3.11Å; G110-L112 PolarHBondContact O-N 3.38Å; G110-L113 WeakPolarHBondContact O-CB 3.21Å; G110-L113 PolarHBondContact O-N 3.06Å; G110-L114 WeakPolarHBondContact O-CG 3.27Å; G110-L114 PolarHBondContact O-N 3.09Å
111L91.4Very high90Very high0 Ų041.1 Ų41.10%019%0.191CC..Hα-helixtrans-63.6-39.5176-172.767.8000112.8G107 A108 I109 L114 T115 M248 N251 L252G107-L111 PolarHBondContact O-N 3.03Å; A108-L111 WeakPolarHBondContact O-CB 3.5Å; A108-L111 PolarHBondContact O-N 3.49Å; I109-L111 VanDerWaalsContact C-N 3.3Å; I109-L111 PolarHBondContact O-N 3.28Å; L111-L114 PolarHBondContact O-N 2.98Å; L111-T115 PolarHBondContact O-N 3.11Å; L111-T115 PolarHBondContact O-OG1 3Å; L111-M248 HydrophobicContact CB-CG 4.34Å; L111-N251 HydrophobicContact CD2-CB 4.11Å; L111-N251 VanDerWaalsContact CD2-ND2 3.29Å; L111-N251 WeakPolarHBondContact CD2-ND2 3.4Å; L111-L252 HydrophobicContact CD1-CB 3.72Å; L111-L252 HydrophobicContact CD1-CD1 3.72Å; L111-L252 HydrophobicContact CD1-CG 4.32Å
112L93.9Very high89.1Confident33 Ų3346.3 Ų46.317%0.17321%0.21CC..Hα-helixtrans-62.8-44.2174.8179.762.7000111.1A108 I109 G110 T115 I116 Y283 I287 V290A108-L112 PolarHBondContact O-N 2.87Å; I109-L112 WeakPolarHBondContact O-CB 3.47Å; I109-L112 PolarHBondContact O-N 3.24Å; I109-L112 VanDerWaalsContact O-N 3.14Å; G110-L112 PolarHBondContact O-N 3.38Å; L112-T115 WeakPolarHBondContact O-CA 3.4Å; L112-T115 WeakPolarHBondContact O-CB 3.11Å; L112-T115 PolarHBondContact O-N 3.43Å; L112-T115 VanDerWaalsContact O-N 3.12Å; L112-I116 HydrophobicContact CD1-CD1 4.34Å; L112-I116 HydrophobicContact CG-CD1 3.97Å; L112-I116 WeakPolarHBondContact O-CG1 3.36Å; L112-I116 PolarHBondContact O-N 3.16Å; L112-Y283 HydrophobicContact CD1-CD1 4.47Å; L112-I287 HydrophobicContact CD1-CG1 3.97Å; L112-V290 HydrophobicContact CB-CG2 4.2Å; L112-V290 HydrophobicContact CD2-CG2 4.17Å
113L93.7Very high88.4Confident80 Ų8047 Ų4742%0.41921%0.214SC..Hα-helixtrans-60.6-45.9175.2-70.1173.8000111.2I109 G110 T115 I116 F117I109-L113 HydrophobicContact CG2-CD1 4.19Å; I109-L113 HydrophobicContact CG2-CG 4.44Å; I109-L113 WeakPolarHBondContact O-CG 3.46Å; I109-L113 PolarHBondContact O-N 2.95Å; G110-L113 WeakPolarHBondContact O-CB 3.21Å; G110-L113 PolarHBondContact O-N 3.06Å; L113-T115 PolarHBondContact O-N 3.17Å; L113-I116 PolarHBondContact O-N 2.57Å; L113-I116 VanDerWaalsContact O-N 3.12Å; L113-F117 HydrophobicContact CB-CD2 4.19Å; L113-F117 HydrophobicContact CB-CE2 4.02Å; L113-F117 HydrophobicContact CD2-CE2 4.08Å; L113-F117 WeakPolarHBondContact O-CD2 3.27Å; L113-F117 WeakPolarHBondContact O-CG 3.44Å; L113-F117 PolarHBondContact O-N 2.7Å
114L90.5Very high87.4Confident35 Ų3547.7 Ų47.718%0.18322%0.217CC..Hα-helixtrans-59.5-32.1175-69.9177.8000112.7G110 L111 R118 V119 R120 M248G110-L114 WeakPolarHBondContact O-CG 3.27Å; G110-L114 PolarHBondContact O-N 3.09Å; L111-L114 PolarHBondContact O-N 2.98Å; L114-R118 PolarHBondContact O-N 3.15Å; L114-V119 HydrophobicContact CD2-CB 4Å; L114-V119 HydrophobicContact CD2-CG1 4.01Å; L114-V119 HydrophobicContact CD2-CG2 4.5Å; L114-V119 PolarHBondContact O-N 2.97Å; L114-R120 PolarHBondContact O-N 3.27Å; L114-R120 VanDerWaalsContact O-N 3.08Å; L114-M248 HydrophobicContact CD1-CE 4.07Å; L114-M248 HydrophobicContact CD1-CG 4.31Å; L114-M248 HydrophobicContact CD1-SD 3.78Å; L114-M248 HydrophobicContact CG-SD 4.47Å
115T90.1Very high86.5Confident9 Ų950.5 Ų50.56%0.05524%0.241CC..Hα-helixtrans-72.1-44.8174.8-59.30000111.4L111 L112 L113 R118 R120 L282 Y283 S286L111-T115 PolarHBondContact O-N 3.11Å; L111-T115 PolarHBondContact O-OG1 3Å; L112-T115 WeakPolarHBondContact O-CA 3.4Å; L112-T115 WeakPolarHBondContact O-CB 3.11Å; L112-T115 PolarHBondContact O-N 3.43Å; L112-T115 VanDerWaalsContact O-N 3.12Å; L113-T115 PolarHBondContact O-N 3.17Å; T115-R118 PolarHBondContact O-N 3.42Å; T115-R118 VanDerWaalsContact O-N 3.1Å; T115-R120 WeakPolarHBondContact OG1-CD 3.32Å; T115-L282 HydrophobicContact CG2-CB 3.86Å; T115-Y283 HydrophobicContact CG2-CD1 4.09Å; T115-Y283 HydrophobicContact CG2-CD2 4.25Å; T115-Y283 HydrophobicContact CG2-CE1 4.25Å; T115-Y283 HydrophobicContact CG2-CE2 4.37Å; T115-Y283 HydrophobicContact CG2-CG 4.08Å; T115-S286 PolarHBondContact OG1-OG 3.44Å; T115-S286 VanDerWaalsContact OG1-OG 3.06Å
116I91.4Very high85.9Confident76 Ų7651.7 Ų51.739%0.3925%0.248SC..Hα-helixtrans-60.6-48.4177.1-69.2164.8000110.8L112 L113 R118 Y283L112-I116 HydrophobicContact CD1-CD1 4.34Å; L112-I116 HydrophobicContact CG-CD1 3.97Å; L112-I116 WeakPolarHBondContact O-CG1 3.36Å; L112-I116 PolarHBondContact O-N 3.16Å; L113-I116 PolarHBondContact O-N 2.57Å; L113-I116 VanDerWaalsContact O-N 3.12Å; I116-R118 PolarHBondContact O-N 3.12Å; I116-R118 VanDerWaalsContact O-N 3.12Å; I116-Y283 HydrophobicContact CG1-CE1 3.8Å
117F88.7Confident85.4Confident145 Ų14548.5 Ų48.564%0.63624%0.236SC*.THydrogen-bonded Turntrans-73.43.2178-62.9-57.1000113.7L113 V119L113-F117 HydrophobicContact CB-CD2 4.19Å; L113-F117 HydrophobicContact CB-CE2 4.02Å; L113-F117 HydrophobicContact CD2-CE2 4.08Å; L113-F117 WeakPolarHBondContact O-CD2 3.27Å; L113-F117 WeakPolarHBondContact O-CG 3.44Å; L113-F117 PolarHBondContact O-N 2.7Å; F117-V119 HydrophobicContact CB-CG2 3.91Å; F117-V119 PolarHBondContact O-N 2.91Å
118R83.1Confident85.1Confident171 Ų17149.2 Ų49.265%0.64524%0.241SC*.THydrogen-bonded Turntrans58.215.8180-54.5-178.6178.3174.73114.5L114 T115 I116 R120L114-R118 PolarHBondContact O-N 3.15Å; T115-R118 PolarHBondContact O-N 3.42Å; T115-R118 VanDerWaalsContact O-N 3.1Å; I116-R118 PolarHBondContact O-N 3.12Å; I116-R118 VanDerWaalsContact O-N 3.12Å; R118-R120 VanDerWaalsContact C-N 3.33Å
119V81.8Confident84.6Confident52 Ų5252.5 Ų52.532%0.31526%0.261SS..Hα-helixtrans-70-35.6176.5-178.40000110.1L114 F117 Y121 W122 M123L114-V119 HydrophobicContact CD2-CB 4Å; L114-V119 HydrophobicContact CD2-CG1 4.01Å; L114-V119 HydrophobicContact CD2-CG2 4.5Å; L114-V119 PolarHBondContact O-N 2.97Å; F117-V119 HydrophobicContact CB-CG2 3.91Å; F117-V119 PolarHBondContact O-N 2.91Å; V119-Y121 VanDerWaalsContact C-N 3.3Å; V119-Y121 PolarHBondContact O-N 2.95Å; V119-W122 WeakPolarHBondContact O-CA 3.25Å; V119-W122 WeakPolarHBondContact O-CB 3.2Å; V119-W122 PolarHBondContact O-N 3.12Å; V119-M123 HydrophobicContact CG1-CG 4.02Å; V119-M123 HydrophobicContact CG1-SD 4.02Å; V119-M123 WeakPolarHBondContact O-CG 3.39Å; V119-M123 PolarHBondContact O-N 2.97Å
120R80.3Confident84.4Confident1 Ų150.7 Ų50.70%0.00425%0.252CS..Hα-helixtrans-53.6-44.8179.9-175.4161.3-171.7-165.92.4112.8L114 T115 R118 M123 I124 L252 S255 L282 D285 S286L114-R120 PolarHBondContact O-N 3.27Å; L114-R120 VanDerWaalsContact O-N 3.08Å; T115-R120 WeakPolarHBondContact OG1-CD 3.32Å; R118-R120 VanDerWaalsContact C-N 3.33Å; R120-M123 PolarHBondContact O-N 3.38Å; R120-I124 HydrophobicContact CG-CD1 3.89Å; R120-I124 WeakPolarHBondContact O-CD1 3.22Å; R120-I124 WeakPolarHBondContact O-CG1 3.3Å; R120-I124 PolarHBondContact O-N 2.64Å; R120-I124 VanDerWaalsContact O-N 3.08Å; R120-L252 HydrophobicContact CB-CD1 4.4Å; R120-L252 HydrophobicContact CG-CD1 3.57Å; R120-S255 PolarHBondContact NH2-OG 3.5Å; R120-L282 HydrophobicContact CG-CD1 4.15Å; R120-L282 HydrophobicContact CG-CD2 4.35Å; R120-L282 PolarHBondContact NH1-O 3.02Å; R120-D285 IonicContact CZ-OD2 3.19Å; R120-D285 IonicContact NH1-OD2 2.73Å; R120-D285 PolarHBondContact NH1-OD2 3.38Å; R120-D285 IonicContact NH2-OD2 2.73Å; R120-D285 PolarHBondContact NH2-OD2 3.19Å; R120-S286 PolarHBondContact NH1-OG 3.06Å
121Y72Confident84.3Confident106 Ų10650 Ų5042%0.41624%0.244SC..Hα-helixtrans-62.2-45.1176.6175-100.5000112V119 M123 I124 A125 M278V119-Y121 VanDerWaalsContact C-N 3.3Å; V119-Y121 PolarHBondContact O-N 2.95Å; Y121-M123 VanDerWaalsContact C-N 3.35Å; Y121-M123 PolarHBondContact O-N 2.96Å; Y121-I124 PolarHBondContact O-N 3.14Å; Y121-A125 WeakPolarHBondContact O-CB 3.32Å; Y121-A125 PolarHBondContact O-N 2.9Å; Y121-A125 VanDerWaalsContact O-N 3.08Å; Y121-M278 HydrophobicContact CD2-SD 3.61Å; Y121-M278 HydrophobicContact CE2-SD 3.81Å
122W74.1Confident83.9Confident109 Ų10952.7 Ų52.741%0.41325%0.254SS..Hα-helixtrans-63.3-42.2179.7-179.683.2000111.4V119 A125 N126 P413 C414V119-W122 WeakPolarHBondContact O-CA 3.25Å; V119-W122 WeakPolarHBondContact O-CB 3.2Å; V119-W122 PolarHBondContact O-N 3.12Å; W122-A125 PolarHBondContact O-N 3.12Å; W122-N126 PolarHBondContact NE1-ND2 2.67Å; W122-N126 WeakPolarHBondContact O-CB 3.12Å; W122-N126 PolarHBondContact O-N 3.22Å; W122-N126 PolarHBondContact O-ND2 3.42Å; W122-P413 HydrophobicContact CH2-CB 4.44Å; W122-P413 HydrophobicContact CZ2-CB 4.39Å; W122-C414 HydrophobicContact CE3-CB 4.15Å; W122-C414 VanDerWaalsContact CH2-CA 3.48Å; W122-C414 HydrophobicContact CH2-CB 3.44Å; W122-C414 VanDerWaalsContact CH2-CB 3.44Å; W122-C414 HydrophobicContact CZ2-CB 4.15Å; W122-C414 HydrophobicContact CZ3-CB 3.43Å; W122-C414 VanDerWaalsContact CZ3-CB 3.43Å
123M78Confident83.4Confident15 Ų1551.2 Ų51.27%0.07425%0.247CC..Hα-helixtrans-61.2-50.6176.3-66.8-178.575.400111.4V119 R120 Y121 A125 N126 I127 L252 V418V119-M123 HydrophobicContact CG1-CG 4.02Å; V119-M123 HydrophobicContact CG1-SD 4.02Å; V119-M123 WeakPolarHBondContact O-CG 3.39Å; V119-M123 PolarHBondContact O-N 2.97Å; R120-M123 PolarHBondContact O-N 3.38Å; Y121-M123 VanDerWaalsContact C-N 3.35Å; Y121-M123 PolarHBondContact O-N 2.96Å; M123-A125 VanDerWaalsContact C-N 3.28Å; M123-A125 PolarHBondContact O-N 3.31Å; M123-N126 PolarHBondContact O-N 3.03Å; M123-N126 VanDerWaalsContact O-N 3.07Å; M123-I127 HydrophobicContact CB-CD1 4.42Å; M123-I127 WeakPolarHBondContact O-CD1 3.49Å; M123-I127 WeakPolarHBondContact O-CG1 3.26Å; M123-I127 PolarHBondContact O-N 3.23Å; M123-I127 VanDerWaalsContact O-N 3.16Å; M123-L252 HydrophobicContact CE-CD2 3.41Å; M123-L252 VanDerWaalsContact CE-CD2 3.41Å; M123-L252 HydrophobicContact SD-CD2 3.66Å; M123-V418 HydrophobicContact CE-CG2 4.19Å
124I72Confident83.3Confident13 Ų1347.4 Ų47.47%0.06723%0.227CC..Hα-helixtrans-59.1-40.9-178-64.3162.5000111.7R120 Y121 N126 S256 I260 L282R120-I124 HydrophobicContact CG-CD1 3.89Å; R120-I124 WeakPolarHBondContact O-CD1 3.22Å; R120-I124 WeakPolarHBondContact O-CG1 3.3Å; R120-I124 PolarHBondContact O-N 2.64Å; R120-I124 VanDerWaalsContact O-N 3.08Å; Y121-I124 PolarHBondContact O-N 3.14Å; I124-N126 VanDerWaalsContact C-N 3.27Å; I124-N126 PolarHBondContact O-N 3.49Å; I124-S256 WeakPolarHBondContact CD1-OG 3.24Å; I124-S256 WeakPolarHBondContact CG1-OG 3.36Å; I124-I260 HydrophobicContact CG2-CD1 3.41Å; I124-I260 VanDerWaalsContact CG2-CD1 3.41Å; I124-L282 HydrophobicContact CD1-CD1 4.48Å; I124-L282 HydrophobicContact CD1-CD2 4.19Å
125A75Confident83Confident60 Ų6045.8 Ų45.850%0.49622%0.218SC..Hα-helixtrans-71.6-20-179.300000113.7Y121 W122 M123Y121-A125 WeakPolarHBondContact O-CB 3.32Å; Y121-A125 PolarHBondContact O-N 2.9Å; Y121-A125 VanDerWaalsContact O-N 3.08Å; W122-A125 PolarHBondContact O-N 3.12Å; M123-A125 VanDerWaalsContact C-N 3.28Å; M123-A125 PolarHBondContact O-N 3.31Å
126N81.8Confident82.6Confident49 Ų4945.9 Ų45.926%0.26222%0.219SC..Hα-helixtrans-106.3-4.4-174.7-79.8-82.1000113.9W122 M123 I124 P128 S412 C414W122-N126 PolarHBondContact NE1-ND2 2.67Å; W122-N126 WeakPolarHBondContact O-CB 3.12Å; W122-N126 PolarHBondContact O-N 3.22Å; W122-N126 PolarHBondContact O-ND2 3.42Å; M123-N126 PolarHBondContact O-N 3.03Å; M123-N126 VanDerWaalsContact O-N 3.07Å; I124-N126 VanDerWaalsContact C-N 3.27Å; I124-N126 PolarHBondContact O-N 3.49Å; N126-P128 WeakPolarHBondContact O-CD 3.36Å; N126-S412 WeakPolarHBondContact O-CB 3.29Å; N126-S412 PolarHBondContact O-OG 3.34Å; N126-C414 HydrophobicContact CB-CB 3.78Å
127I83Confident82.6Confident7 Ų742.2 Ų42.24%0.03620%0.2CC..SBendtrans-89.8124.6179.3-65.8162000109.8M123 L131 R132 F253 F395M123-I127 HydrophobicContact CB-CD1 4.42Å; M123-I127 WeakPolarHBondContact O-CD1 3.49Å; M123-I127 WeakPolarHBondContact O-CG1 3.26Å; M123-I127 PolarHBondContact O-N 3.23Å; M123-I127 VanDerWaalsContact O-N 3.16Å; I127-L131 HydrophobicContact CG2-CB 3.85Å; I127-L131 HydrophobicContact CG2-CD1 4.47Å; I127-R132 HydrophobicContact CB-CG 4.17Å; I127-R132 HydrophobicContact CG2-CG 3.66Å; I127-R132 PolarHBondContact O-NE 3.35Å; I127-F253 HydrophobicContact CD1-CD1 3.89Å; I127-F253 HydrophobicContact CD1-CE1 3.1Å; I127-F253 HydrophobicContact CD1-CZ 3.81Å; I127-F395 HydrophobicContact CD1-CZ 4.06Å; I127-F395 HydrophobicContact CG1-CE1 4.28Å; I127-F395 HydrophobicContact CG1-CZ 4.12Å; I127-F395 HydrophobicContact CG2-CZ 4.1Å
128P86Confident82.7Confident17 Ų1735.3 Ų35.311%0.1117%0.17CC..  trans-51.1146.3176.1-25.830.8000112.9N126 S130 L131 R132 Y398 V415N126-P128 WeakPolarHBondContact O-CD 3.36Å; P128-S130 WeakPolarHBondContact CB-OG 3.34Å; P128-S130 PolarHBondContact O-N 3.12Å; P128-L131 HydrophobicContact CG-CD1 4.33Å; P128-L131 PolarHBondContact O-N 3.21Å; P128-R132 PolarHBondContact O-N 3.5Å; P128-R132 VanDerWaalsContact O-N 3.09Å; P128-Y398 HydrophobicContact CB-CD2 4.29Å; P128-Y398 HydrophobicContact CB-CE2 3.58Å; P128-Y398 HydrophobicContact CG-CD1 4.18Å; P128-Y398 HydrophobicContact CG-CD2 4.11Å; P128-Y398 HydrophobicContact CG-CE1 3.53Å; P128-Y398 HydrophobicContact CG-CE2 3.48Å; P128-Y398 VanDerWaalsContact CG-CE2 3.48Å; P128-Y398 HydrophobicContact CG-CG 4.43Å; P128-Y398 VanDerWaalsContact CG-OH 3.26Å; P128-Y398 WeakPolarHBondContact CG-OH 3.27Å; P128-V415 VanDerWaalsContact CD-CG2 3.47Å; P128-V415 HydrophobicContact CG-CG2 4.16Å
129V83.7Confident82.7Confident69 Ų6927.2 Ų27.242%0.41814%0.139SC..Hα-helixtrans-57.3-41.7176.11760000110.8L131 R132 V133V129-L131 VanDerWaalsContact C-N 3.35Å; V129-L131 PolarHBondContact O-N 3.17Å; V129-R132 VanDerWaalsContact CG2-NH2 3.3Å; V129-R132 PolarHBondContact O-N 3.47Å; V129-V133 HydrophobicContact CG1-CG2 3.85Å; V129-V133 VanDerWaalsContact O-CB 3.25Å; V129-V133 WeakPolarHBondContact O-CB 3.45Å; V129-V133 VanDerWaalsContact O-CG2 3.29Å; V129-V133 WeakPolarHBondContact O-CG2 3.41Å; V129-V133 PolarHBondContact O-N 3.42Å
130S90Very high83Confident2 Ų224.8 Ų24.81%0.01412%0.124CC..Hα-helixtrans-53.1-48.3177.545.60000112.6P128 G134 E370 A374P128-S130 WeakPolarHBondContact CB-OG 3.34Å; P128-S130 PolarHBondContact O-N 3.12Å; S130-G134 PolarHBondContact O-N 3.49Å; S130-E370 VanDerWaalsContact CB-O 3.24Å; S130-E370 WeakPolarHBondContact CB-O 3.29Å; S130-E370 WeakPolarHBondContact CB-OE2 3.47Å; S130-E370 PolarHBondContact OG-OE2 2.99Å; S130-A374 WeakPolarHBondContact O-CB 3.19Å
131L89.3Confident83.6Confident0 Ų027.4 Ų27.40%014%0.139CC..Hα-helixtrans-67-49.1176.4-68-177.9000111.9I127 P128 V129 V133 G134 I135 P373 G394 F395 Y398 V415I127-L131 HydrophobicContact CG2-CB 3.85Å; I127-L131 HydrophobicContact CG2-CD1 4.47Å; P128-L131 HydrophobicContact CG-CD1 4.33Å; P128-L131 PolarHBondContact O-N 3.21Å; V129-L131 VanDerWaalsContact C-N 3.35Å; V129-L131 PolarHBondContact O-N 3.17Å; L131-V133 VanDerWaalsContact C-N 3.28Å; L131-V133 PolarHBondContact O-N 2.92Å; L131-G134 PolarHBondContact O-N 3.43Å; L131-I135 WeakPolarHBondContact O-CG1 3.26Å; L131-I135 PolarHBondContact O-N 3.18Å; L131-P373 HydrophobicContact CD2-CB 4.02Å; L131-G394 VanDerWaalsContact CD2-C 3.5Å; L131-G394 WeakPolarHBondContact CD2-O 3.35Å; L131-F395 HydrophobicContact CD1-CD1 3.85Å; L131-F395 HydrophobicContact CD1-CD2 4.21Å; L131-F395 HydrophobicContact CD1-CE1 3.9Å; L131-F395 HydrophobicContact CD1-CE2 4.28Å; L131-F395 HydrophobicContact CD1-CG 4Å; L131-F395 HydrophobicContact CD1-CZ 4.13Å; L131-Y398 HydrophobicContact CD1-CD2 4.38Å; L131-Y398 HydrophobicContact CD1-CG 4.05Å; L131-Y398 HydrophobicContact CG-CD2 4.2Å; L131-Y398 HydrophobicContact CG-CG 4.31Å; L131-V415 HydrophobicContact CD1-CG1 4.31Å
132R82.9Confident84.4Confident57 Ų5722.4 Ų22.422%0.21512%0.119CC..Hα-helixtrans-56.4-44.6179.8-69.1-173.9-67.8177.22.1112.3I127 P128 V129 T136I127-R132 HydrophobicContact CB-CG 4.17Å; I127-R132 HydrophobicContact CG2-CG 3.66Å; I127-R132 PolarHBondContact O-NE 3.35Å; P128-R132 PolarHBondContact O-N 3.5Å; P128-R132 VanDerWaalsContact O-N 3.09Å; V129-R132 VanDerWaalsContact CG2-NH2 3.3Å; V129-R132 PolarHBondContact O-N 3.47Å; R132-T136 PolarHBondContact O-N 2.91Å; R132-T136 VanDerWaalsContact O-N 3.14Å; R132-T136 PolarHBondContact O-OG1 3.42Å
133V84.4Confident84.9Confident2 Ų217.4 Ų17.41%0.01210%0.1CC..Hα-helixtrans-69.9-42.7178.7165.70000111.3V129 L131 I135 T136 S137 S359 L360 R362 V363V129-V133 HydrophobicContact CG1-CG2 3.85Å; V129-V133 VanDerWaalsContact O-CB 3.25Å; V129-V133 WeakPolarHBondContact O-CB 3.45Å; V129-V133 VanDerWaalsContact O-CG2 3.29Å; V129-V133 WeakPolarHBondContact O-CG2 3.41Å; V129-V133 PolarHBondContact O-N 3.42Å; L131-V133 VanDerWaalsContact C-N 3.28Å; L131-V133 PolarHBondContact O-N 2.92Å; V133-I135 VanDerWaalsContact C-N 3.32Å; V133-I135 PolarHBondContact O-N 3.44Å; V133-T136 PolarHBondContact O-N 2.84Å; V133-S137 VanDerWaalsContact O-CB 3.26Å; V133-S137 WeakPolarHBondContact O-CB 3.23Å; V133-S137 PolarHBondContact O-N 2.93Å; V133-S137 PolarHBondContact O-OG 3.49Å; V133-S359 WeakPolarHBondContact CG1-O 3.38Å; V133-L360 HydrophobicContact CG1-CD2 4.19Å; V133-R362 HydrophobicContact CG2-CB 4.2Å; V133-V363 HydrophobicContact CB-CG2 4.3Å; V133-V363 HydrophobicContact CG1-CG2 3.67Å
134G90.3Very high85.6Confident0 Ų017.1 Ų17.10%010%0.101CC..Hα-helixtrans-58.9-42.4175.600000112.1S130 L131 S137 G138S130-G134 PolarHBondContact O-N 3.49Å; L131-G134 PolarHBondContact O-N 3.43Å; G134-S137 PolarHBondContact O-N 2.88Å; G134-G138 PolarHBondContact O-N 3.48Å
135I86Confident86.5Confident1 Ų118.4 Ų18.41%0.00511%0.107CC..Hα-helixtrans-63.2-52.7176.7-64.4170.2000110.9L131 V133 S137 G138 I139 F253 T377 M381 I391 F395L131-I135 WeakPolarHBondContact O-CG1 3.26Å; L131-I135 PolarHBondContact O-N 3.18Å; V133-I135 VanDerWaalsContact C-N 3.32Å; V133-I135 PolarHBondContact O-N 3.44Å; I135-S137 VanDerWaalsContact C-N 3.26Å; I135-S137 PolarHBondContact O-N 3.36Å; I135-G138 PolarHBondContact O-N 3Å; I135-I139 HydrophobicContact CG2-CD1 3.83Å; I135-I139 HydrophobicContact CG2-CG1 4.49Å; I135-I139 VanDerWaalsContact O-CG1 3.31Å; I135-I139 WeakPolarHBondContact O-CG1 3.41Å; I135-I139 PolarHBondContact O-N 2.77Å; I135-F253 HydrophobicContact CD1-CB 3.93Å; I135-F253 HydrophobicContact CD1-CD1 4.4Å; I135-F253 HydrophobicContact CD1-CD2 3.53Å; I135-F253 HydrophobicContact CD1-CE2 4.12Å; I135-F253 HydrophobicContact CD1-CG 3.67Å; I135-F253 HydrophobicContact CG2-CB 3.82Å; I135-T377 HydrophobicContact CB-CG2 4.36Å; I135-T377 HydrophobicContact CG1-CG2 3.58Å; I135-M381 HydrophobicContact CB-CE 4.35Å; I135-M381 HydrophobicContact CG1-CE 4.37Å; I135-M381 HydrophobicContact CG2-CE 4.24Å; I135-I391 HydrophobicContact CD1-CG1 4.35Å; I135-I391 HydrophobicContact CD1-CG2 4.26Å; I135-I391 HydrophobicContact CG1-CG1 4.12Å; I135-I391 HydrophobicContact CG2-CD1 4.37Å; I135-I391 HydrophobicContact CG2-CG1 4.31Å; I135-F395 HydrophobicContact CD1-CE2 4.08Å
136T81.7Confident87Confident11 Ų1115.7 Ų15.77%0.0678%0.084CC..Hα-helixtrans-56.9-44.8179.1-52.40000110.5R132 V133 G140 M356R132-T136 PolarHBondContact O-N 2.91Å; R132-T136 VanDerWaalsContact O-N 3.14Å; R132-T136 PolarHBondContact O-OG1 3.42Å; V133-T136 PolarHBondContact O-N 2.84Å; T136-G140 PolarHBondContact O-N 2.94Å; T136-M356 HydrophobicContact CG2-CB 4.46Å; T136-M356 HydrophobicContact CG2-CE 3.89Å; T136-M356 WeakPolarHBondContact O-CE 3.37Å
137S89.5Confident87.3Confident0 Ų013.4 Ų13.40%07%0.072CC..Hα-helixtrans-70.4-37.6-177.7-53.30000112.4V133 G134 I135 G140 L141 L360V133-S137 VanDerWaalsContact O-CB 3.26Å; V133-S137 WeakPolarHBondContact O-CB 3.23Å; V133-S137 PolarHBondContact O-N 2.93Å; V133-S137 PolarHBondContact O-OG 3.49Å; G134-S137 PolarHBondContact O-N 2.88Å; I135-S137 VanDerWaalsContact C-N 3.26Å; I135-S137 PolarHBondContact O-N 3.36Å; S137-G140 PolarHBondContact O-N 3.46Å; S137-L141 WeakPolarHBondContact O-CG 3.29Å; S137-L141 PolarHBondContact O-N 2.9Å; S137-L360 WeakPolarHBondContact OG-CD2 3.32Å; S137-L360 WeakPolarHBondContact OG-CG 3.09Å
138G90.7Very high87.8Confident0 Ų015.4 Ų15.40%08%0.083CC..Hα-helixtrans-67.3-41.1176.400000113G134 I135 G140 L141 F142 A378G134-G138 PolarHBondContact O-N 3.48Å; I135-G138 PolarHBondContact O-N 3Å; G138-G140 VanDerWaalsContact C-N 3.28Å; G138-G140 PolarHBondContact O-N 2.66Å; G138-L141 PolarHBondContact O-N 3.36Å; G138-F142 WeakPolarHBondContact O-CB 3.49Å; G138-F142 PolarHBondContact O-N 3.06Å; G138-A378 WeakPolarHBondContact CA-O 3.12Å
139I84.1Confident87.9Confident1 Ų118.9 Ų18.91%0.00510%0.096CC..Hα-helixtrans-60-43.8171.5-66168.9000109.5I135 F142 I143 V250 D254 M356 M381 I387I135-I139 HydrophobicContact CG2-CD1 3.83Å; I135-I139 HydrophobicContact CG2-CG1 4.49Å; I135-I139 VanDerWaalsContact O-CG1 3.31Å; I135-I139 WeakPolarHBondContact O-CG1 3.41Å; I135-I139 PolarHBondContact O-N 2.77Å; I139-F142 PolarHBondContact O-N 3.01Å; I139-I143 HydrophobicContact CG2-CD1 3.71Å; I139-I143 HydrophobicContact CG2-CG1 4.37Å; I139-I143 VanDerWaalsContact O-CG1 3.24Å; I139-I143 WeakPolarHBondContact O-CG1 3.47Å; I139-I143 PolarHBondContact O-N 3.44Å; I139-V250 HydrophobicContact CD1-CG1 4.06Å; I139-D254 HydrophobicContact CD1-CB 4.14Å; I139-M356 HydrophobicContact CB-CE 4.1Å; I139-M356 HydrophobicContact CG2-CE 3.85Å; I139-M356 HydrophobicContact CG2-SD 4.47Å; I139-M381 HydrophobicContact CG1-SD 3.9Å; I139-M381 PolarHBondContact N-SD 2.94Å; I139-M381 VanDerWaalsContact N-SD 3.36Å; I139-I387 HydrophobicContact CD1-CG2 4.49Å; I139-I387 HydrophobicContact CG1-CG2 3.98Å
140G88.1Confident87.9Confident0 Ų018 Ų180%09%0.089CC..Hα-helixtrans-56.7-49.8173.600000113.7T136 S137 G138 F142 I143 G144 G353T136-G140 PolarHBondContact O-N 2.94Å; S137-G140 PolarHBondContact O-N 3.46Å; G138-G140 VanDerWaalsContact C-N 3.28Å; G138-G140 PolarHBondContact O-N 2.66Å; G140-F142 VanDerWaalsContact C-N 3.33Å; G140-F142 PolarHBondContact O-N 2.85Å; G140-I143 PolarHBondContact O-N 3.33Å; G140-G144 PolarHBondContact O-N 3.02Å; G140-G353 WeakPolarHBondContact O-CA 3.16Å
141L93Very high87.8Confident57 Ų5718 Ų1830%0.2989%0.089SC..Hα-helixtrans-62.5-40.1178.1-71170.8000111.7S137 G138 G144 M145 T357 A378 P382S137-L141 WeakPolarHBondContact O-CG 3.29Å; S137-L141 PolarHBondContact O-N 2.9Å; G138-L141 PolarHBondContact O-N 3.36Å; L141-G144 PolarHBondContact O-N 3.36Å; L141-M145 WeakPolarHBondContact O-CB 3.16Å; L141-M145 PolarHBondContact O-N 3.46Å; L141-T357 HydrophobicContact CD2-CG2 4.07Å; L141-T357 WeakPolarHBondContact CD2-OG1 3.38Å; L141-T357 HydrophobicContact CG-CG2 4.39Å; L141-A378 HydrophobicContact CD1-CB 4.2Å; L141-P382 HydrophobicContact CB-CB 4.46Å; L141-P382 HydrophobicContact CB-CG 3.9Å
142F88.6Confident87.8Confident0 Ų019 Ų190%010%0.1CC..Hα-helixtrans-62.6-47.2175.2-177.8-112.3000111.7A83 G138 I139 G140 G144 M145 M146 M381 F385 I387A83-F142 HydrophobicContact CB-CD1 4.28Å; A83-F142 HydrophobicContact CB-CE1 3.64Å; G138-F142 WeakPolarHBondContact O-CB 3.49Å; G138-F142 PolarHBondContact O-N 3.06Å; I139-F142 PolarHBondContact O-N 3.01Å; G140-F142 VanDerWaalsContact C-N 3.33Å; G140-F142 PolarHBondContact O-N 2.85Å; F142-G144 VanDerWaalsContact C-N 3.33Å; F142-G144 PolarHBondContact O-N 3.19Å; F142-M145 WeakPolarHBondContact O-CB 3.21Å; F142-M145 PolarHBondContact O-N 3.12Å; F142-M146 HydrophobicContact CE1-CG 4.49Å; F142-M146 HydrophobicContact CZ-CG 4.45Å; F142-M146 WeakPolarHBondContact O-CG 3.15Å; F142-M146 PolarHBondContact O-N 3.34Å; F142-M381 HydrophobicContact CB-CB 4.5Å; F142-F385 HydrophobicContact CE2-CD1 4.15Å; F142-F385 AromaticContact CE2-CD2 3.7Å; F142-F385 HydrophobicContact CE2-CD2 3.7Å; F142-F385 HydrophobicContact CE2-CE1 4.24Å; F142-F385 AromaticContact CE2-CE2 3.8Å; F142-F385 HydrophobicContact CE2-CE2 3.8Å; F142-F385 AromaticContact CE2-CG 3.88Å; F142-F385 HydrophobicContact CE2-CG 3.88Å; F142-F385 HydrophobicContact CE2-CZ 4.08Å; F142-F385 HydrophobicContact CZ-CD1 4.37Å; F142-F385 HydrophobicContact CZ-CE1 4.19Å; F142-F385 HydrophobicContact CZ-CE2 4.36Å; F142-F385 HydrophobicContact CZ-CZ 4.19Å; F142-I387 HydrophobicContact CD1-CD1 4.07Å; F142-I387 HydrophobicContact CD1-CG1 4.12Å; F142-I387 HydrophobicContact CE1-CD1 4.27Å; F142-I387 HydrophobicContact CE1-CG1 4.33Å
143I85.5Confident88.3Confident4 Ų417.1 Ų17.12%0.0219%0.094CC..Hα-helixtrans-61-42.8175.4-67.5167.1000110.9M79 I139 G140 M146 G147 L349 V352 M356M79-I143 HydrophobicContact CB-CD1 3.82Å; I139-I143 HydrophobicContact CG2-CD1 3.71Å; I139-I143 HydrophobicContact CG2-CG1 4.37Å; I139-I143 VanDerWaalsContact O-CG1 3.24Å; I139-I143 WeakPolarHBondContact O-CG1 3.47Å; I139-I143 PolarHBondContact O-N 3.44Å; G140-I143 PolarHBondContact O-N 3.33Å; I143-M146 WeakPolarHBondContact O-CB 3.4Å; I143-M146 PolarHBondContact O-N 3.05Å; I143-G147 PolarHBondContact O-N 3.11Å; I143-L349 HydrophobicContact CG2-CB 4.28Å; I143-L349 HydrophobicContact CG2-CD2 3.7Å; I143-V352 HydrophobicContact CD1-CG1 4.47Å; I143-V352 HydrophobicContact CG2-CB 4.43Å; I143-V352 HydrophobicContact CG2-CG1 4.21Å; I143-M356 HydrophobicContact CD1-SD 4.02Å
144G91.4Very high88.8Confident9 Ų918.7 Ų18.79%0.09310%0.102CC..Hα-helixtrans-62.5-43.1177.500000112.4G140 L141 F142 M146 G147 L148G140-G144 PolarHBondContact O-N 3.02Å; L141-G144 PolarHBondContact O-N 3.36Å; F142-G144 VanDerWaalsContact C-N 3.33Å; F142-G144 PolarHBondContact O-N 3.19Å; G144-M146 VanDerWaalsContact C-N 3.33Å; G144-M146 PolarHBondContact O-N 2.96Å; G144-G147 PolarHBondContact O-N 3.25Å; G144-G147 VanDerWaalsContact O-N 3.17Å; G144-L148 WeakPolarHBondContact O-CG 3.36Å; G144-L148 PolarHBondContact O-N 2.73Å
145M91.6Very high88.8Confident40 Ų4021.4 Ų21.420%0.19712%0.119CC..Hα-helixtrans-60.3-42.3173.2-173.7-176.4-16400111.5L141 F142 G147 L148 K149 V162 P382L141-M145 WeakPolarHBondContact O-CB 3.16Å; L141-M145 PolarHBondContact O-N 3.46Å; F142-M145 WeakPolarHBondContact O-CB 3.21Å; F142-M145 PolarHBondContact O-N 3.12Å; M145-G147 VanDerWaalsContact C-N 3.32Å; M145-G147 PolarHBondContact O-N 2.97Å; M145-L148 PolarHBondContact O-N 2.56Å; M145-K149 WeakPolarHBondContact O-CB 3.19Å; M145-K149 PolarHBondContact O-N 3.1Å; M145-V162 HydrophobicContact CE-CG1 3.78Å; M145-P382 HydrophobicContact SD-CB 3.92Å
146M85.2Confident89Confident4 Ų425.9 Ų25.92%0.0216%0.156CC..Hα-helixtrans-63.7-36.9174.7-71.9-52.6-47.300112.6A83 F87 F142 I143 G144 K149 N150 F385A83-M146 HydrophobicContact CB-CG 4.44Å; F87-M146 HydrophobicContact CD1-CE 3.93Å; F87-M146 HydrophobicContact CD2-CE 3.46Å; F87-M146 VanDerWaalsContact CD2-CE 3.46Å; F87-M146 HydrophobicContact CD2-SD 4.03Å; F87-M146 HydrophobicContact CE1-CE 3.61Å; F87-M146 HydrophobicContact CE2-CE 3.18Å; F87-M146 HydrophobicContact CE2-SD 4.25Å; F87-M146 HydrophobicContact CG-CE 3.86Å; F87-M146 HydrophobicContact CG-SD 4.43Å; F87-M146 HydrophobicContact CZ-CE 3.25Å; F142-M146 HydrophobicContact CE1-CG 4.49Å; F142-M146 HydrophobicContact CZ-CG 4.45Å; F142-M146 WeakPolarHBondContact O-CG 3.15Å; F142-M146 PolarHBondContact O-N 3.34Å; I143-M146 WeakPolarHBondContact O-CB 3.4Å; I143-M146 PolarHBondContact O-N 3.05Å; G144-M146 VanDerWaalsContact C-N 3.33Å; G144-M146 PolarHBondContact O-N 2.96Å; M146-K149 HydrophobicContact CE-CD 3.89Å; M146-K149 PolarHBondContact O-N 2.8Å; M146-K149 HydrophobicContact SD-CD 4.25Å; M146-N150 WeakPolarHBondContact O-CB 3.44Å; M146-N150 PolarHBondContact O-N 3.03Å; M146-F385 HydrophobicContact SD-CE2 3.61Å; M146-F385 HydrophobicContact SD-CZ 3.46Å; M146-F385 WeakPolarHBondContact SD-CZ 3.5Å
147G88.5Confident89.4Confident0 Ų027.8 Ų27.80%017%0.166CC..Hα-helixtrans-59.8-48.9170.700000112.3I143 G144 M145 K149 N150 A151 A346I143-G147 PolarHBondContact O-N 3.11Å; G144-G147 PolarHBondContact O-N 3.25Å; G144-G147 VanDerWaalsContact O-N 3.17Å; M145-G147 VanDerWaalsContact C-N 3.32Å; M145-G147 PolarHBondContact O-N 2.97Å; G147-K149 VanDerWaalsContact C-N 3.3Å; G147-K149 PolarHBondContact O-N 3.14Å; G147-N150 PolarHBondContact O-N 3.03Å; G147-A151 PolarHBondContact O-N 2.73Å; G147-A346 WeakPolarHBondContact O-CB 3.45Å
148L92.4Very high89.3Confident50 Ų5033.8 Ų33.826%0.26221%0.208SC..Hα-helixtrans-61.6-37.9176.3-68.1169000112.3G144 M145 G152 V153 I154 I350G144-L148 WeakPolarHBondContact O-CG 3.36Å; G144-L148 PolarHBondContact O-N 2.73Å; M145-L148 PolarHBondContact O-N 2.56Å; L148-G152 PolarHBondContact O-N 3.25Å; L148-V153 HydrophobicContact CB-CB 4.36Å; L148-V153 HydrophobicContact CD2-CB 4.1Å; L148-V153 HydrophobicContact CD2-CG1 4.05Å; L148-V153 HydrophobicContact CD2-CG2 4.34Å; L148-V153 WeakPolarHBondContact O-CB 3.38Å; L148-V153 PolarHBondContact O-N 2.97Å; L148-I154 HydrophobicContact CB-CB 4.25Å; L148-I154 HydrophobicContact CB-CD1 3.75Å; L148-I154 HydrophobicContact CB-CG1 3.89Å; L148-I154 HydrophobicContact CD1-CD1 3.6Å; L148-I154 HydrophobicContact CD1-CG1 4.39Å; L148-I154 HydrophobicContact CG-CD1 4.29Å; L148-I154 PolarHBondContact O-N 3.4Å; L148-I350 HydrophobicContact CD2-CD1 3.69Å; L148-I350 HydrophobicContact CD2-CG1 4.17Å; L148-I350 HydrophobicContact CG-CD1 4.16Å; L148-I350 HydrophobicContact CG-CG1 4.13Å
149K88.3Confident89.3Confident89 Ų8942.2 Ų42.239%0.38725%0.247SC..Hα-helixtrans-65.2-46.1174.5-172.1-171.4174.1-160.40111.7M145 M146 G147 A151 G152 I154M145-K149 WeakPolarHBondContact O-CB 3.19Å; M145-K149 PolarHBondContact O-N 3.1Å; M146-K149 HydrophobicContact CE-CD 3.89Å; M146-K149 PolarHBondContact O-N 2.8Å; M146-K149 HydrophobicContact SD-CD 4.25Å; G147-K149 VanDerWaalsContact C-N 3.3Å; G147-K149 PolarHBondContact O-N 3.14Å; K149-A151 VanDerWaalsContact C-N 3.31Å; K149-A151 PolarHBondContact O-N 3.01Å; K149-G152 PolarHBondContact O-N 3.08Å; K149-I154 WeakPolarHBondContact CA-O 3.47Å
150N83.6Confident89.7Confident51 Ų5146 Ų4627%0.27327%0.27SS..Hα-helixtrans-65.3-32.1178.8-77.71.4000112.9M146 G147 G152 A346M146-N150 WeakPolarHBondContact O-CB 3.44Å; M146-N150 PolarHBondContact O-N 3.03Å; G147-N150 PolarHBondContact O-N 3.03Å; N150-G152 PolarHBondContact O-N 2.99Å; N150-A346 HydrophobicContact CB-CB 4.27Å
151A88.8Confident89.6Confident1 Ų153 Ų531%0.00831%0.307CS..Hα-helixtrans-72.1-17.3171.500000112.9G147 K149 V153 S171 V172 A346G147-A151 PolarHBondContact O-N 2.73Å; K149-A151 VanDerWaalsContact C-N 3.31Å; K149-A151 PolarHBondContact O-N 3.01Å; A151-V153 VanDerWaalsContact C-N 3.34Å; A151-V153 HydrophobicContact CB-CG2 3.93Å; A151-S171 CarbonylContact O-C 3.26Å; A151-V172 VanDerWaalsContact O-CA 3.25Å; A151-V172 WeakPolarHBondContact O-CA 3.26Å; A151-V172 WeakPolarHBondContact O-CG2 3.46Å; A151-V172 PolarHBondContact O-N 3.37Å; A151-A346 HydrophobicContact CB-CB 3.78Å
152G89.4Confident89.6Confident22 Ų2253.3 Ų53.323%0.22731%0.311CS..THydrogen-bonded Turntrans81.610.4-172.200000114L148 K149 N150 G165 V172L148-G152 PolarHBondContact O-N 3.25Å; K149-G152 PolarHBondContact O-N 3.08Å; N150-G152 PolarHBondContact O-N 2.99Å; G152-G165 WeakPolarHBondContact O-CA 3.14Å; G152-V172 VanDerWaalsContact C-CG2 3.41Å; G152-V172 WeakPolarHBondContact O-CG2 3.47Å
153V94.1Very high89.8Confident18 Ų1855.1 Ų55.111%0.10932%0.324CS..SBendtrans-70.1-43.1177.1178.40000110.1L148 A151 I164 G165 V172 I176L148-V153 HydrophobicContact CB-CB 4.36Å; L148-V153 HydrophobicContact CD2-CB 4.1Å; L148-V153 HydrophobicContact CD2-CG1 4.05Å; L148-V153 HydrophobicContact CD2-CG2 4.34Å; L148-V153 WeakPolarHBondContact O-CB 3.38Å; L148-V153 PolarHBondContact O-N 2.97Å; A151-V153 VanDerWaalsContact C-N 3.34Å; A151-V153 HydrophobicContact CB-CG2 3.93Å; V153-I164 WeakPolarHBondContact O-CA 3.21Å; V153-G165 PolarHBondContact O-N 3.28Å; V153-V172 HydrophobicContact CG2-CG1 3.79Å; V153-I176 HydrophobicContact CG2-CD1 4.02Å; V153-I176 HydrophobicContact CG2-CG1 3.9Å
154I93.1Very high90.2Very high34 Ų3460 Ų6017%0.17435%0.349CS..EExtended strand (participates in β ladder)trans-107.3127.4175.2-67.4179.9000108.6L148 K149 V162L148-I154 HydrophobicContact CB-CB 4.25Å; L148-I154 HydrophobicContact CB-CD1 3.75Å; L148-I154 HydrophobicContact CB-CG1 3.89Å; L148-I154 HydrophobicContact CD1-CD1 3.6Å; L148-I154 HydrophobicContact CD1-CG1 4.39Å; L148-I154 HydrophobicContact CG-CD1 4.29Å; L148-I154 PolarHBondContact O-N 3.4Å; K149-I154 WeakPolarHBondContact CA-O 3.47Å; I154-V162 HydrophobicContact CG2-CB 3.92Å; I154-V162 HydrophobicContact CG2-CG1 3.82Å
155V91.8Very high90.2Very high58 Ų5860.3 Ų60.335%0.35235%0.352SS..EExtended strand (participates in β ladder)trans-125155.7174.9-61.30000110.3V162 S163V155-V162 WeakPolarHBondContact O-CA 3.43Å; V155-S163 WeakPolarHBondContact CG2-OG 3.37Å; V155-S163 PolarHBondContact N-O 3.25Å; V155-S163 PolarHBondContact O-N 2.86Å
156A89.5Confident90.2Very high95 Ų9563.1 Ų63.179%0.78537%0.368SS*.EExtended strand (participates in β ladder)trans-68.6138.6178.400000110.6
157N89.6Confident90.5Very high50 Ų5067.1 Ų67.127%0.26739%0.389SS..EExtended strand (participates in β ladder)trans-137.2126.9176.7-175.3-68000109.4E159 T160 L161N157-E159 VanDerWaalsContact C-N 3.25Å; N157-E159 PolarHBondContact O-N 3.03Å; N157-E159 WeakPolarHBondContact OD1-CA 3.31Å; N157-E159 WeakPolarHBondContact OD1-CB 3.44Å; N157-E159 PolarHBondContact OD1-N 3.05Å; N157-T160 WeakPolarHBondContact CB-OG1 3.28Å; N157-T160 PolarHBondContact OD1-N 3.08Å; N157-T160 VanDerWaalsContact OD1-N 3.08Å; N157-T160 PolarHBondContact OD1-OG1 2.96Å; N157-L161 PolarHBondContact N-O 3.43Å; N157-L161 VanDerWaalsContact N-O 3.12Å; N157-L161 CarbonylContact O-C 3.53Å; N157-L161 VanDerWaalsContact O-C 3.26Å; N157-L161 WeakPolarHBondContact O-CA 3.46Å; N157-L161 PolarHBondContact O-N 3.33Å
158S89.1Confident90.6Very high126 Ų12672.3 Ų72.388%0.88142%0.42SS*.THydrogen-bonded Turntrans-67.5-23.2-176.649.60000114
159E90.2Very high90.5Very high177 Ų17771.6 Ų71.683%0.82742%0.42SS*.THydrogen-bonded Turntrans-92.7-31.8-177.5-59.6-176.518000112.8N157N157-E159 VanDerWaalsContact C-N 3.25Å; N157-E159 PolarHBondContact O-N 3.03Å; N157-E159 WeakPolarHBondContact OD1-CA 3.31Å; N157-E159 WeakPolarHBondContact OD1-CB 3.44Å; N157-E159 PolarHBondContact OD1-N 3.05Å
160T91Very high90.5Very high81 Ų8172.7 Ų72.750%0.49743%0.426SS..THydrogen-bonded Turntrans-120.46-171.548.20000113.8N157 V162N157-T160 WeakPolarHBondContact CB-OG1 3.28Å; N157-T160 PolarHBondContact OD1-N 3.08Å; N157-T160 VanDerWaalsContact OD1-N 3.08Å; N157-T160 PolarHBondContact OD1-OG1 2.96Å; T160-V162 PolarHBondContact O-N 3.4Å; T160-V162 PolarHBondContact OG1-O 3.41Å; T160-V162 VanDerWaalsContact OG1-O 3.08Å
161L86.7Confident90.7Very high147 Ų14772.6 Ų72.677%0.7743%0.429SS*.EExtended strand (participates in β ladder)trans67.2-47.4-166.5-53.3167.6000112.8N157N157-L161 PolarHBondContact N-O 3.43Å; N157-L161 VanDerWaalsContact N-O 3.12Å; N157-L161 CarbonylContact O-C 3.53Å; N157-L161 VanDerWaalsContact O-C 3.26Å; N157-L161 WeakPolarHBondContact O-CA 3.46Å; N157-L161 PolarHBondContact O-N 3.33Å
162V92.3Very high90.9Very high64 Ų6472.6 Ų72.639%0.38843%0.429SS..EExtended strand (participates in β ladder)trans-138142-179.8-68.20000111.7M145 I154 V155 T160M145-V162 HydrophobicContact CE-CG1 3.78Å; I154-V162 HydrophobicContact CG2-CB 3.92Å; I154-V162 HydrophobicContact CG2-CG1 3.82Å; V155-V162 WeakPolarHBondContact O-CA 3.43Å; T160-V162 PolarHBondContact O-N 3.4Å; T160-V162 PolarHBondContact OG1-O 3.41Å; T160-V162 VanDerWaalsContact OG1-O 3.08Å
163S93.5Very high91.1Very high37 Ų3776 Ų7626%0.25944%0.442SS..EExtended strand (participates in β ladder)trans-130165.5170.466.50000111.6V155V155-S163 WeakPolarHBondContact CG2-OG 3.37Å; V155-S163 PolarHBondContact N-O 3.25Å; V155-S163 PolarHBondContact O-N 2.86Å
164I93.5Very high91Very high108 Ų10875.9 Ų75.955%0.55444%0.44SS*.EExtended strand (participates in β ladder)trans-71.1130.9171.1-63.4-64.2000108.9V153 L167V153-I164 WeakPolarHBondContact O-CA 3.21Å; I164-L167 HydrophobicContact CG2-CD1 4Å; I164-L167 HydrophobicContact CG2-CD2 3.74Å; I164-L167 HydrophobicContact CG2-CG 3.71Å
165G91.1Very high91Very high15 Ų1574.2 Ų74.216%0.15543%0.432CS..  trans-76.7-170.2173.700000112.5G152 V153 L167G152-G165 WeakPolarHBondContact O-CA 3.14Å; V153-G165 PolarHBondContact O-N 3.28Å; G165-L167 PolarHBondContact O-N 3.37Å
166N91.8Very high91.1Very high99 Ų9974.2 Ų74.253%0.52943%0.429SS..  trans-75.998.2179.6-174.22.1000111.4T168 S169 V172N166-T168 PolarHBondContact O-N 3.08Å; N166-T168 VanDerWaalsContact O-N 3.15Å; N166-T168 PolarHBondContact OD1-N 2.57Å; N166-T168 VanDerWaalsContact OD1-N 3.09Å; N166-T168 PolarHBondContact OD1-OG1 3.08Å; N166-S169 WeakPolarHBondContact O-CB 3.49Å; N166-S169 PolarHBondContact O-N 3.41Å; N166-S169 PolarHBondContact O-OG 2.9Å; N166-V172 WeakPolarHBondContact O-CG2 3.49Å
167L91.3Very high91.4Very high87 Ų8773 Ų7346%0.45541%0.409SS..THydrogen-bonded Turntrans-62.1-19.3-179.9-62-177000114.3I164 G165 S169 V172I164-L167 HydrophobicContact CG2-CD1 4Å; I164-L167 HydrophobicContact CG2-CD2 3.74Å; I164-L167 HydrophobicContact CG2-CG 3.71Å; G165-L167 PolarHBondContact O-N 3.37Å; L167-S169 VanDerWaalsContact C-N 3.35Å; L167-V172 HydrophobicContact CD2-CG1 3.86Å
168T90.9Very high91.6Very high109 Ų10970.7 Ų70.767%0.66940%0.397SS*.THydrogen-bonded Turntrans-88-5.4177.265.40000113N166N166-T168 PolarHBondContact O-N 3.08Å; N166-T168 VanDerWaalsContact O-N 3.15Å; N166-T168 PolarHBondContact OD1-N 2.57Å; N166-T168 VanDerWaalsContact OD1-N 3.09Å; N166-T168 PolarHBondContact OD1-OG1 3.08Å
169S90.4Very high91.9Very high35 Ų3566.7 Ų66.725%0.24536%0.364CS..SBendtrans-69.1143.9176.469.80000111.6N166 L167 S171 V172 L173N166-S169 WeakPolarHBondContact O-CB 3.49Å; N166-S169 PolarHBondContact O-N 3.41Å; N166-S169 PolarHBondContact O-OG 2.9Å; L167-S169 VanDerWaalsContact C-N 3.35Å; S169-S171 VanDerWaalsContact C-N 3.29Å; S169-S171 PolarHBondContact O-N 3.01Å; S169-V172 PolarHBondContact O-N 3.01Å; S169-V172 VanDerWaalsContact O-N 3.17Å; S169-V172 WeakPolarHBondContact OG-CB 3.19Å; S169-V172 WeakPolarHBondContact OG-CG2 3.31Å; S169-L173 PolarHBondContact O-N 2.69Å; S169-L173 VanDerWaalsContact O-N 3.07Å
170H89Confident92.2Very high112 Ų11263.5 Ų63.552%0.51935%0.347SS..Hα-helixtrans-55.8-43.4-179.9-65.797.1000112.2V172 L173 L174H170-V172 PolarHBondContact O-N 3.24Å; H170-L173 PolarHBondContact O-N 2.77Å; H170-L174 WeakPolarHBondContact O-CB 3.36Å; H170-L174 VanDerWaalsContact O-CG 3.28Å; H170-L174 WeakPolarHBondContact O-CG 3.31Å; H170-L174 PolarHBondContact O-N 3.41Å
171S88.1Confident92.4Very high50 Ų5061.3 Ų61.335%0.3533%0.332SS..Hα-helixtrans-58.4-43.5178-52.80000112.9A151 S169 G175 Y343A151-S171 CarbonylContact O-C 3.26Å; S169-S171 VanDerWaalsContact C-N 3.29Å; S169-S171 PolarHBondContact O-N 3.01Å; S171-G175 PolarHBondContact O-N 2.9Å; S171-Y343 WeakPolarHBondContact O-CB 3.14Å
172V92.4Very high92.8Very high1 Ų154.3 Ų54.31%0.00630%0.295CS..Hα-helixtrans-68-47.4179.6171.80000110.8A151 G152 V153 N166 L167 S169 H170 L174 G175 I176A151-V172 VanDerWaalsContact O-CA 3.25Å; A151-V172 WeakPolarHBondContact O-CA 3.26Å; A151-V172 WeakPolarHBondContact O-CG2 3.46Å; A151-V172 PolarHBondContact O-N 3.37Å; G152-V172 VanDerWaalsContact C-CG2 3.41Å; G152-V172 WeakPolarHBondContact O-CG2 3.47Å; V153-V172 HydrophobicContact CG2-CG1 3.79Å; N166-V172 WeakPolarHBondContact O-CG2 3.49Å; L167-V172 HydrophobicContact CD2-CG1 3.86Å; S169-V172 PolarHBondContact O-N 3.01Å; S169-V172 VanDerWaalsContact O-N 3.17Å; S169-V172 WeakPolarHBondContact OG-CB 3.19Å; S169-V172 WeakPolarHBondContact OG-CG2 3.31Å; H170-V172 PolarHBondContact O-N 3.24Å; V172-L174 VanDerWaalsContact C-N 3.35Å; V172-L174 PolarHBondContact O-N 2.87Å; V172-G175 PolarHBondContact O-N 3.16Å; V172-I176 HydrophobicContact CG1-CD1 3.6Å; V172-I176 HydrophobicContact CG1-CG1 4.27Å; V172-I176 WeakPolarHBondContact O-CB 3.46Å; V172-I176 VanDerWaalsContact O-CG1 3.31Å; V172-I176 WeakPolarHBondContact O-CG1 3.47Å; V172-I176 PolarHBondContact O-N 2.75Å
173L93.8Very high92.9Very high94 Ų9452.7 Ų52.749%0.49229%0.289SS..Hα-helixtrans-60.1-45.4179.8-71.7169.9000111.5S169 H170 L177S169-L173 PolarHBondContact O-N 2.69Å; S169-L173 VanDerWaalsContact O-N 3.07Å; H170-L173 PolarHBondContact O-N 2.77Å; L173-L177 WeakPolarHBondContact O-CB 3.32Å; L173-L177 PolarHBondContact O-N 3.14Å
174L92.5Very high93.1Very high14 Ų1455.1 Ų55.17%0.07330%0.298CS..Hα-helixtrans-68.5-37.4178.4-67.5176.3000112.3H170 V172 L177 G178 T201 L204 L208 Y343H170-L174 WeakPolarHBondContact O-CB 3.36Å; H170-L174 VanDerWaalsContact O-CG 3.28Å; H170-L174 WeakPolarHBondContact O-CG 3.31Å; H170-L174 PolarHBondContact O-N 3.41Å; V172-L174 VanDerWaalsContact C-N 3.35Å; V172-L174 PolarHBondContact O-N 2.87Å; L174-L177 HydrophobicContact CD2-CD2 4.37Å; L174-G178 PolarHBondContact O-N 3.42Å; L174-T201 WeakPolarHBondContact O-CG2 3.45Å; L174-L204 HydrophobicContact CD2-CB 3.81Å; L174-L204 HydrophobicContact CD2-CD1 4.03Å; L174-L208 HydrophobicContact CD1-CD1 3.93Å; L174-Y343 HydrophobicContact CB-CD2 3.72Å; L174-Y343 HydrophobicContact CB-CE2 3.97Å; L174-Y343 HydrophobicContact CB-CG 4.49Å; L174-Y343 HydrophobicContact CD1-CD2 4.06Å; L174-Y343 HydrophobicContact CD1-CE2 3.45Å; L174-Y343 VanDerWaalsContact CD1-CE2 3.45Å; L174-Y343 HydrophobicContact CG-CE2 4.37Å
175G91.6Very high93.2Very high0 Ų051.7 Ų51.70%028%0.281CS..Hα-helixtrans-64.8-44.9175.300000112.8S171 V172 G178 F179 Y343S171-G175 PolarHBondContact O-N 2.9Å; V172-G175 PolarHBondContact O-N 3.16Å; G175-G178 PolarHBondContact O-N 3.16Å; G175-F179 PolarHBondContact O-N 3.48Å; G175-Y343 WeakPolarHBondContact CA-O 3.47Å
176I94.4Very high93.1Very high57 Ų5751.9 Ų51.929%0.29228%0.281SS..Hα-helixtrans-64.8-45.8175.8-69.1172.5000110.6V153 V172 G178 F179 F180V153-I176 HydrophobicContact CG2-CD1 4.02Å; V153-I176 HydrophobicContact CG2-CG1 3.9Å; V172-I176 HydrophobicContact CG1-CD1 3.6Å; V172-I176 HydrophobicContact CG1-CG1 4.27Å; V172-I176 WeakPolarHBondContact O-CB 3.46Å; V172-I176 VanDerWaalsContact O-CG1 3.31Å; V172-I176 WeakPolarHBondContact O-CG1 3.47Å; V172-I176 PolarHBondContact O-N 2.75Å; I176-G178 VanDerWaalsContact C-N 3.27Å; I176-G178 PolarHBondContact O-N 3.14Å; I176-F179 PolarHBondContact O-N 3.41Å; I176-F180 HydrophobicContact CG2-CD2 3.68Å; I176-F180 HydrophobicContact CG2-CE2 3.6Å; I176-F180 WeakPolarHBondContact O-CD2 3.27Å; I176-F180 PolarHBondContact O-N 3.46Å
177L95.3Very high93.1Very high71 Ų7151.5 Ų51.537%0.37229%0.286SS..Hα-helixtrans-56.3-45.9174.8178.966.5000110.6L173 L174 F179 F180 I181 L204L173-L177 WeakPolarHBondContact O-CB 3.32Å; L173-L177 PolarHBondContact O-N 3.14Å; L174-L177 HydrophobicContact CD2-CD2 4.37Å; L177-F179 PolarHBondContact O-N 3.45Å; L177-F180 PolarHBondContact O-N 2.91Å; L177-I181 HydrophobicContact CD1-CD1 4.21Å; L177-I181 HydrophobicContact CD1-CG1 4.38Å; L177-I181 HydrophobicContact CD2-CD1 4.49Å; L177-I181 HydrophobicContact CG-CD1 3.88Å; L177-I181 HydrophobicContact CG-CG1 4.44Å; L177-I181 VanDerWaalsContact O-CG1 3.31Å; L177-I181 WeakPolarHBondContact O-CG1 3.26Å; L177-I181 PolarHBondContact O-N 3.23Å; L177-L204 HydrophobicContact CD2-CD1 3.56Å
178G94.5Very high93.2Very high0 Ų056.1 Ų56.10%030%0.297CS..Hα-helixtrans-56.1-48.9176.800000112.2L174 G175 I176 F180 I181 I182 S197L174-G178 PolarHBondContact O-N 3.42Å; G175-G178 PolarHBondContact O-N 3.16Å; I176-G178 VanDerWaalsContact C-N 3.27Å; I176-G178 PolarHBondContact O-N 3.14Å; G178-F180 PolarHBondContact O-N 3.05Å; G178-I181 PolarHBondContact O-N 3.2Å; G178-I182 VanDerWaalsContact O-CG1 3.28Å; G178-I182 WeakPolarHBondContact O-CG1 3.47Å; G178-I182 PolarHBondContact O-N 3.43Å; G178-I182 VanDerWaalsContact O-N 3.14Å; G178-S197 VanDerWaalsContact C-OG 3.24Å; G178-S197 WeakPolarHBondContact CA-OG 3.36Å; G178-S197 PolarHBondContact O-OG 2.93Å
179F95.2Very high93Very high43 Ų4357.2 Ų57.219%0.18930%0.299CS..Hα-helixtrans-57.4-48.4175.6168.6-108.1000112.4G175 I176 L177 I181 I182 A183 I350 V354G175-F179 PolarHBondContact O-N 3.48Å; I176-F179 PolarHBondContact O-N 3.41Å; L177-F179 PolarHBondContact O-N 3.45Å; F179-I181 PolarHBondContact O-N 3.01Å; F179-I182 WeakPolarHBondContact O-CB 3.49Å; F179-I182 PolarHBondContact O-N 3.41Å; F179-I182 VanDerWaalsContact O-N 3.16Å; F179-A183 HydrophobicContact CZ-CB 4.47Å; F179-A183 PolarHBondContact O-N 3.09Å; F179-I350 HydrophobicContact CB-CD1 4.34Å; F179-I350 HydrophobicContact CD2-CB 3.76Å; F179-I350 HydrophobicContact CD2-CG2 3.43Å; F179-I350 VanDerWaalsContact CD2-CG2 3.43Å; F179-I350 HydrophobicContact CE2-CB 4.27Å; F179-I350 HydrophobicContact CE2-CG2 3.54Å; F179-I350 HydrophobicContact CG-CB 4.37Å; F179-I350 HydrophobicContact CG-CG2 4Å; F179-I350 HydrophobicContact CZ-CG2 4.19Å; F179-V354 HydrophobicContact CE2-CG2 4.14Å; F179-V354 HydrophobicContact CZ-CG2 4.39Å
180F96.4Very high92.9Very high110 Ų11058.9 Ų58.948%0.48231%0.305SS..Hα-helixtrans-68-35.7-178.3-79-64.2000113.1I176 L177 G178 I182 A183 I184I176-F180 HydrophobicContact CG2-CD2 3.68Å; I176-F180 HydrophobicContact CG2-CE2 3.6Å; I176-F180 WeakPolarHBondContact O-CD2 3.27Å; I176-F180 PolarHBondContact O-N 3.46Å; L177-F180 PolarHBondContact O-N 2.91Å; G178-F180 PolarHBondContact O-N 3.05Å; F180-I182 VanDerWaalsContact C-N 3.27Å; F180-I182 PolarHBondContact O-N 3.09Å; F180-A183 PolarHBondContact O-N 2.94Å; F180-I184 WeakPolarHBondContact O-CB 3.49Å; F180-I184 WeakPolarHBondContact O-CD1 3.21Å; F180-I184 WeakPolarHBondContact O-CG1 3.26Å; F180-I184 PolarHBondContact O-N 3.41Å
181I96.6Very high92.7Very high34 Ų3456.3 Ų56.317%0.17429%0.293CS..Hα-helixtrans-57.4-45.9171.6-69.1167.9000109.7L177 G178 F179 L185 V200L177-I181 HydrophobicContact CD1-CD1 4.21Å; L177-I181 HydrophobicContact CD1-CG1 4.38Å; L177-I181 HydrophobicContact CD2-CD1 4.49Å; L177-I181 HydrophobicContact CG-CD1 3.88Å; L177-I181 HydrophobicContact CG-CG1 4.44Å; L177-I181 VanDerWaalsContact O-CG1 3.31Å; L177-I181 WeakPolarHBondContact O-CG1 3.26Å; L177-I181 PolarHBondContact O-N 3.23Å; G178-I181 PolarHBondContact O-N 3.2Å; F179-I181 PolarHBondContact O-N 3.01Å; I181-L185 HydrophobicContact CG2-CD1 3.64Å; I181-L185 HydrophobicContact CG2-CG 4.26Å; I181-L185 VanDerWaalsContact O-CB 3.31Å; I181-L185 WeakPolarHBondContact O-CB 3.33Å; I181-L185 VanDerWaalsContact O-CG 3.23Å; I181-L185 WeakPolarHBondContact O-CG 3.24Å; I181-L185 PolarHBondContact O-N 2.91Å; I181-V200 HydrophobicContact CD1-CB 4.27Å; I181-V200 HydrophobicContact CD1-CG1 3.77Å
182I94.7Very high92.8Very high0 Ų055 Ų550%029%0.285CS..Hα-helixtrans-62.4-51.7178.4-60.9171000110.3G178 F179 F180 I184 L185 A186 A193 V194 G347 A348 Y351G178-I182 VanDerWaalsContact O-CG1 3.28Å; G178-I182 WeakPolarHBondContact O-CG1 3.47Å; G178-I182 PolarHBondContact O-N 3.43Å; G178-I182 VanDerWaalsContact O-N 3.14Å; F179-I182 WeakPolarHBondContact O-CB 3.49Å; F179-I182 PolarHBondContact O-N 3.41Å; F179-I182 VanDerWaalsContact O-N 3.16Å; F180-I182 VanDerWaalsContact C-N 3.27Å; F180-I182 PolarHBondContact O-N 3.09Å; I182-I184 VanDerWaalsContact C-N 3.34Å; I182-I184 PolarHBondContact O-N 2.9Å; I182-L185 PolarHBondContact O-N 2.69Å; I182-A186 WeakPolarHBondContact O-CB 3.32Å; I182-A186 PolarHBondContact O-N 3.44Å; I182-A193 HydrophobicContact CG2-CB 4.29Å; I182-V194 HydrophobicContact CD1-CB 4.49Å; I182-V194 HydrophobicContact CD1-CG1 4.15Å; I182-V194 HydrophobicContact CG2-CG2 3.92Å; I182-G347 VanDerWaalsContact CD1-C 3.45Å; I182-A348 HydrophobicContact CD1-CB 4.26Å; I182-Y351 HydrophobicContact CB-CG 4.43Å; I182-Y351 HydrophobicContact CG2-CD1 3.49Å; I182-Y351 VanDerWaalsContact CG2-CD1 3.49Å; I182-Y351 HydrophobicContact CG2-CD2 3.76Å; I182-Y351 HydrophobicContact CG2-CE1 3.97Å; I182-Y351 HydrophobicContact CG2-CE2 4.23Å; I182-Y351 HydrophobicContact CG2-CG 3.38Å
183A94.4Very high92.7Very high31 Ų3155.1 Ų55.126%0.25629%0.286SS..Hα-helixtrans-58.9-44.5-177.900000112F179 F180 S187F179-A183 HydrophobicContact CZ-CB 4.47Å; F179-A183 PolarHBondContact O-N 3.09Å; F180-A183 PolarHBondContact O-N 2.94Å; A183-S187 VanDerWaalsContact O-CB 3.28Å; A183-S187 WeakPolarHBondContact O-CB 3.3Å; A183-S187 PolarHBondContact O-N 2.88Å; A183-S187 PolarHBondContact O-OG 3.39Å
184I97Very high92.5Very high88 Ų8851.1 Ų51.145%0.45127%0.266SS..Hα-helixtrans-66.7-50.9179.9-67.7166.5000110.4F180 I182 A186 S187 R188F180-I184 WeakPolarHBondContact O-CB 3.49Å; F180-I184 WeakPolarHBondContact O-CD1 3.21Å; F180-I184 WeakPolarHBondContact O-CG1 3.26Å; F180-I184 PolarHBondContact O-N 3.41Å; I182-I184 VanDerWaalsContact C-N 3.34Å; I182-I184 PolarHBondContact O-N 2.9Å; I184-A186 PolarHBondContact O-N 3.49Å; I184-S187 PolarHBondContact O-N 3.36Å; I184-S187 PolarHBondContact O-OG 3.14Å; I184-R188 PolarHBondContact O-N 3.18Å
185L95.7Very high92.4Very high36 Ų3652.7 Ų52.719%0.18827%0.274CS..Hα-helixtrans-64.5-41.4-179.2-68.1177.8000111.5I181 I182 R188 N189 I190 A193 V196I181-L185 HydrophobicContact CG2-CD1 3.64Å; I181-L185 HydrophobicContact CG2-CG 4.26Å; I181-L185 VanDerWaalsContact O-CB 3.31Å; I181-L185 WeakPolarHBondContact O-CB 3.33Å; I181-L185 VanDerWaalsContact O-CG 3.23Å; I181-L185 WeakPolarHBondContact O-CG 3.24Å; I181-L185 PolarHBondContact O-N 2.91Å; I182-L185 PolarHBondContact O-N 2.69Å; L185-R188 CarbonylContact O-C 3.59Å; L185-R188 WeakPolarHBondContact O-CA 3.44Å; L185-R188 WeakPolarHBondContact O-CB 3.45Å; L185-R188 PolarHBondContact O-N 3.31Å; L185-R188 VanDerWaalsContact O-N 3.1Å; L185-N189 PolarHBondContact O-N 3.28Å; L185-I190 HydrophobicContact CB-CB 4.22Å; L185-I190 HydrophobicContact CB-CD1 4.37Å; L185-I190 HydrophobicContact CD2-CD1 3.6Å; L185-I190 WeakPolarHBondContact O-CB 3.3Å; L185-I190 PolarHBondContact O-N 3.09Å; L185-A193 HydrophobicContact CB-CB 3.56Å; L185-V196 HydrophobicContact CD1-CB 3.93Å; L185-V196 HydrophobicContact CD1-CG1 3.65Å
186A90Very high92.5Very high19 Ų1955.5 Ų55.516%0.15729%0.291CS..Hα-helixtrans-67.2-36.4177.800000112.2I182 I184 R188 N189 A193 Y351I182-A186 WeakPolarHBondContact O-CB 3.32Å; I182-A186 PolarHBondContact O-N 3.44Å; I184-A186 PolarHBondContact O-N 3.49Å; A186-R188 PolarHBondContact O-N 2.84Å; A186-N189 WeakPolarHBondContact O-CA 3.39Å; A186-N189 PolarHBondContact O-N 2.88Å; A186-A193 HydrophobicContact CB-CB 4.06Å; A186-Y351 HydrophobicContact CB-CE1 4.39Å; A186-Y351 HydrophobicContact CB-CE2 4.06Å; A186-Y351 WeakPolarHBondContact CB-OH 3.49Å
187S92Very high92.5Very high91 Ų9152.8 Ų52.864%0.63628%0.277SS*.Hα-helixtrans-62.7-24.2172.876.20000112.8A183 I184 N189A183-S187 VanDerWaalsContact O-CB 3.28Å; A183-S187 WeakPolarHBondContact O-CB 3.3Å; A183-S187 PolarHBondContact O-N 2.88Å; A183-S187 PolarHBondContact O-OG 3.39Å; I184-S187 PolarHBondContact O-N 3.36Å; I184-S187 PolarHBondContact O-OG 3.14Å; S187-N189 VanDerWaalsContact C-N 3.29Å
188R93.4Very high92.3Very high184 Ų18449.5 Ų49.569%0.69426%0.26SS*.THydrogen-bonded Turntrans-89.713.7172.5-64.6-175.9178.9-169.30.8113.2I184 L185 A186 I190I184-R188 PolarHBondContact O-N 3.18Å; L185-R188 CarbonylContact O-C 3.59Å; L185-R188 WeakPolarHBondContact O-CA 3.44Å; L185-R188 WeakPolarHBondContact O-CB 3.45Å; L185-R188 PolarHBondContact O-N 3.31Å; L185-R188 VanDerWaalsContact O-N 3.1Å; A186-R188 PolarHBondContact O-N 2.84Å; R188-I190 HydrophobicContact CB-CD1 4.27Å; R188-I190 HydrophobicContact CB-CG1 4.35Å; R188-I190 PolarHBondContact O-N 3.45Å
189N85.4Confident92.2Very high131 Ų13152.9 Ų52.970%0.70128%0.28SS*.THydrogen-bonded Turntrans59.128.5-177.7-59.2-60.5000114.4L185 A186 S187 H191L185-N189 PolarHBondContact O-N 3.28Å; A186-N189 WeakPolarHBondContact O-CA 3.39Å; A186-N189 PolarHBondContact O-N 2.88Å; S187-N189 VanDerWaalsContact C-N 3.29Å; N189-H191 PolarHBondContact O-N 3.26Å
190I89.6Confident92.2Very high71 Ų7153.4 Ų53.436%0.36429%0.287SS..  trans-85.5105.1174.7-60.6169.8000108.6L185 R188 A192 A193L185-I190 HydrophobicContact CB-CB 4.22Å; L185-I190 HydrophobicContact CB-CD1 4.37Å; L185-I190 HydrophobicContact CD2-CD1 3.6Å; L185-I190 WeakPolarHBondContact O-CB 3.3Å; L185-I190 PolarHBondContact O-N 3.09Å; R188-I190 HydrophobicContact CB-CD1 4.27Å; R188-I190 HydrophobicContact CB-CG1 4.35Å; R188-I190 PolarHBondContact O-N 3.45Å; I190-A192 PolarHBondContact O-N 3.35Å; I190-A193 VanDerWaalsContact O-CB 3.25Å; I190-A193 WeakPolarHBondContact O-CB 3.44Å; I190-A193 PolarHBondContact O-N 3.45Å; I190-A193 VanDerWaalsContact O-N 3.11Å
191H84Confident92Very high57 Ų5748.1 Ų48.126%0.26426%0.264SS..THydrogen-bonded Turntrans-64.5-25.5-175.8-57.9-60.4000114.2T24 T28 N189 A193 V312T24-H191 HydrophobicContact CG2-CB 3.82Å; T24-H191 VanDerWaalsContact CG2-CD2 3.47Å; T24-H191 WeakPolarHBondContact CG2-CD2 3.49Å; T24-H191 VanDerWaalsContact CG2-CG 3.42Å; T28-H191 HydrophobicContact CG2-CB 4Å; T28-H191 WeakPolarHBondContact CG2-O 3.48Å; N189-H191 PolarHBondContact O-N 3.26Å; H191-A193 PolarHBondContact O-N 3.34Å; H191-V312 WeakPolarHBondContact NE2-CG1 3.34Å
192A89.3Confident91.7Very high24 Ų2447.2 Ų47.220%0.19826%0.259CS..THydrogen-bonded Turntrans-829.5176.500000113.8L27 I190 V194 L195 V196L27-A192 HydrophobicContact CB-CB 4.42Å; L27-A192 HydrophobicContact CD1-CB 4.39Å; I190-A192 PolarHBondContact O-N 3.35Å; A192-V194 VanDerWaalsContact C-N 3.29Å; A192-V194 PolarHBondContact O-N 3.38Å; A192-L195 PolarHBondContact O-N 3.3Å; A192-L195 VanDerWaalsContact O-N 3.12Å; A192-V196 HydrophobicContact CB-CG2 4.2Å; A192-V196 WeakPolarHBondContact O-CG2 3.34Å; A192-V196 PolarHBondContact O-N 3.08Å
193A91.2Very high91.6Very high3 Ų351.7 Ų51.73%0.02528%0.283CS..Hα-helixtrans-49.6-45.5-173.900000113.7I182 L185 A186 I190 H191 S197I182-A193 HydrophobicContact CG2-CB 4.29Å; L185-A193 HydrophobicContact CB-CB 3.56Å; A186-A193 HydrophobicContact CB-CB 4.06Å; I190-A193 VanDerWaalsContact O-CB 3.25Å; I190-A193 WeakPolarHBondContact O-CB 3.44Å; I190-A193 PolarHBondContact O-N 3.45Å; I190-A193 VanDerWaalsContact O-N 3.11Å; H191-A193 PolarHBondContact O-N 3.34Å; A193-S197 WeakPolarHBondContact O-CB 3.47Å; A193-S197 PolarHBondContact O-N 2.65Å
194V89.7Confident91.5Very high10 Ų1053.1 Ų53.16%0.06129%0.286CS..Hα-helixtrans-64.7-49-179.7-170.90000111.3Y31 I182 A192 S197 I198 A348 Y351Y31-V194 HydrophobicContact CD1-CB 4.34Å; Y31-V194 HydrophobicContact CD1-CG1 3.76Å; Y31-V194 HydrophobicContact CG-CG1 3.81Å; I182-V194 HydrophobicContact CD1-CB 4.49Å; I182-V194 HydrophobicContact CD1-CG1 4.15Å; I182-V194 HydrophobicContact CG2-CG2 3.92Å; A192-V194 VanDerWaalsContact C-N 3.29Å; A192-V194 PolarHBondContact O-N 3.38Å; V194-S197 PolarHBondContact O-N 3.43Å; V194-I198 HydrophobicContact CG1-CD1 4.18Å; V194-I198 WeakPolarHBondContact O-CG1 3.33Å; V194-I198 PolarHBondContact O-N 3.3Å; V194-A348 HydrophobicContact CG1-CB 3.45Å; V194-A348 VanDerWaalsContact CG1-CB 3.45Å; V194-Y351 HydrophobicContact CG2-CD1 4.33Å
195L90.8Very high91.2Very high46 Ų4649 Ų4924%0.24127%0.265CS..Hα-helixtrans-62-46.2178.8-178.966.1000111.8L27 V30 F34 A192 S197 I198 V199L27-L195 HydrophobicContact CD2-CD2 3.82Å; V30-L195 HydrophobicContact CG1-CB 4.28Å; V30-L195 HydrophobicContact CG1-CD1 4Å; V30-L195 HydrophobicContact CG1-CD2 4.35Å; V30-L195 HydrophobicContact CG1-CG 4.44Å; F34-L195 HydrophobicContact CE2-CD1 4.28Å; A192-L195 PolarHBondContact O-N 3.3Å; A192-L195 VanDerWaalsContact O-N 3.12Å; L195-S197 VanDerWaalsContact C-N 3.3Å; L195-S197 PolarHBondContact O-N 2.91Å; L195-I198 PolarHBondContact O-N 3.19Å; L195-V199 WeakPolarHBondContact O-CG2 3.33Å; L195-V199 PolarHBondContact O-N 3.28Å
196V93.5Very high90.8Very high59 Ų5953.8 Ų53.836%0.35828%0.28SS..Hα-helixtrans-59.4-43.7178.5172.10000110.5L185 A192 V199 V200L185-V196 HydrophobicContact CD1-CB 3.93Å; L185-V196 HydrophobicContact CD1-CG1 3.65Å; A192-V196 HydrophobicContact CB-CG2 4.2Å; A192-V196 WeakPolarHBondContact O-CG2 3.34Å; A192-V196 PolarHBondContact O-N 3.08Å; V196-V199 PolarHBondContact O-N 3.06Å; V196-V200 HydrophobicContact CG1-CG2 4.21Å; V196-V200 WeakPolarHBondContact O-CB 3.37Å; V196-V200 VanDerWaalsContact O-CG2 3.26Å; V196-V200 WeakPolarHBondContact O-CG2 3.32Å; V196-V200 PolarHBondContact O-N 3.25Å
197S94.3Very high90.7Very high0 Ų059.8 Ų59.80%031%0.307CS..Hα-helixtrans-61.6-46.1177-179.30000112.6G178 A193 V194 L195 V199 V200 T201G178-S197 VanDerWaalsContact C-OG 3.24Å; G178-S197 WeakPolarHBondContact CA-OG 3.36Å; G178-S197 PolarHBondContact O-OG 2.93Å; A193-S197 WeakPolarHBondContact O-CB 3.47Å; A193-S197 PolarHBondContact O-N 2.65Å; V194-S197 PolarHBondContact O-N 3.43Å; L195-S197 VanDerWaalsContact C-N 3.3Å; L195-S197 PolarHBondContact O-N 2.91Å; S197-V199 VanDerWaalsContact C-N 3.31Å; S197-V199 PolarHBondContact O-N 3.35Å; S197-V200 PolarHBondContact O-N 3.14Å; S197-T201 WeakPolarHBondContact O-CB 3.42Å; S197-T201 WeakPolarHBondContact O-CG2 3.38Å; S197-T201 PolarHBondContact O-N 3.27Å; S197-T201 PolarHBondContact O-OG1 2.84Å
198I91.3Very high90.6Very high2 Ų259.8 Ų59.81%0.0130%0.299CS..Hα-helixtrans-59-45176.9-69.8170.8000110.4F34 V194 L195 T201 T202 V340F34-I198 HydrophobicContact CD2-CD1 3.87Å; F34-I198 HydrophobicContact CD2-CG2 4.23Å; F34-I198 HydrophobicContact CE2-CD1 4.46Å; F34-I198 HydrophobicContact CE2-CG2 4.37Å; V194-I198 HydrophobicContact CG1-CD1 4.18Å; V194-I198 WeakPolarHBondContact O-CG1 3.33Å; V194-I198 PolarHBondContact O-N 3.3Å; L195-I198 PolarHBondContact O-N 3.19Å; I198-T201 PolarHBondContact O-OG1 3.34Å; I198-T201 VanDerWaalsContact O-OG1 3.14Å; I198-T202 WeakPolarHBondContact O-CB 3.38Å; I198-T202 PolarHBondContact O-N 2.87Å; I198-T202 PolarHBondContact O-OG1 3.41Å; I198-V340 HydrophobicContact CG2-CB 4.47Å; I198-V340 HydrophobicContact CG2-CG1 3.69Å; I198-V340 HydrophobicContact CG2-CG2 3.86Å
199V92.3Very high90.1Very high72 Ų7253.3 Ų53.344%0.43629%0.29SS..Hα-helixtrans-63.3-49.1178.31720000111.2L195 V196 S197 T202 L203L195-V199 WeakPolarHBondContact O-CG2 3.33Å; L195-V199 PolarHBondContact O-N 3.28Å; V196-V199 PolarHBondContact O-N 3.06Å; S197-V199 VanDerWaalsContact C-N 3.31Å; S197-V199 PolarHBondContact O-N 3.35Å; V199-T202 PolarHBondContact O-N 3.08Å; V199-L203 HydrophobicContact CG1-CD1 3.85Å; V199-L203 HydrophobicContact CG1-CG 4.37Å; V199-L203 WeakPolarHBondContact O-CB 3.37Å; V199-L203 VanDerWaalsContact O-CG 3.27Å; V199-L203 WeakPolarHBondContact O-CG 3.34Å; V199-L203 PolarHBondContact O-N 3.4Å
200V94.1Very high89.8Confident53 Ų5351.3 Ų51.332%0.32128%0.279SS..Hα-helixtrans-61.9-47.7-179170.70000111.2I181 V196 S197 L203 L204I181-V200 HydrophobicContact CD1-CB 4.27Å; I181-V200 HydrophobicContact CD1-CG1 3.77Å; V196-V200 HydrophobicContact CG1-CG2 4.21Å; V196-V200 WeakPolarHBondContact O-CB 3.37Å; V196-V200 VanDerWaalsContact O-CG2 3.26Å; V196-V200 WeakPolarHBondContact O-CG2 3.32Å; V196-V200 PolarHBondContact O-N 3.25Å; S197-V200 PolarHBondContact O-N 3.14Å; V200-L203 PolarHBondContact O-N 2.92Å; V200-L204 HydrophobicContact CG1-CD1 4.19Å; V200-L204 WeakPolarHBondContact O-CG 3.41Å; V200-L204 PolarHBondContact O-N 3.42Å
201T92.9Very high89.4Confident0 Ų048.4 Ų48.40%027%0.265CS..Hα-helixtrans-66.8-37179.651.20000112.4L174 S197 I198 L204 G205 A344L174-T201 WeakPolarHBondContact O-CG2 3.45Å; S197-T201 WeakPolarHBondContact O-CB 3.42Å; S197-T201 WeakPolarHBondContact O-CG2 3.38Å; S197-T201 PolarHBondContact O-N 3.27Å; S197-T201 PolarHBondContact O-OG1 2.84Å; I198-T201 PolarHBondContact O-OG1 3.34Å; I198-T201 VanDerWaalsContact O-OG1 3.14Å; T201-L204 PolarHBondContact O-N 3.49Å; T201-G205 PolarHBondContact O-N 2.93Å; T201-A344 WeakPolarHBondContact OG1-CA 3.22Å; T201-A344 WeakPolarHBondContact OG1-CB 3.33Å
202T91.1Very high89.2Confident14 Ų1452.5 Ų52.59%0.08628%0.284CS..Hα-helixtrans-67.3-40.2174.7-56.90000111.7I198 V199 G205 W206 V211 M339I198-T202 WeakPolarHBondContact O-CB 3.38Å; I198-T202 PolarHBondContact O-N 2.87Å; I198-T202 PolarHBondContact O-OG1 3.41Å; V199-T202 PolarHBondContact O-N 3.08Å; T202-G205 PolarHBondContact O-N 3.12Å; T202-W206 PolarHBondContact O-N 3.39Å; T202-V211 HydrophobicContact CG2-CG1 4.18Å; T202-V211 HydrophobicContact CG2-CG2 4.32Å; T202-M339 WeakPolarHBondContact CG2-O 3.23Å
203L91.8Very high88.8Confident95 Ų9558 Ų5850%0.49730%0.3SS..Hα-helixtrans-65.1-40.9175.5-74.8171.8000111.9V199 V200 G205 W206 M207V199-L203 HydrophobicContact CG1-CD1 3.85Å; V199-L203 HydrophobicContact CG1-CG 4.37Å; V199-L203 WeakPolarHBondContact O-CB 3.37Å; V199-L203 VanDerWaalsContact O-CG 3.27Å; V199-L203 WeakPolarHBondContact O-CG 3.34Å; V199-L203 PolarHBondContact O-N 3.4Å; V200-L203 PolarHBondContact O-N 2.92Å; L203-G205 VanDerWaalsContact C-N 3.34Å; L203-W206 WeakPolarHBondContact O-CB 3.42Å; L203-W206 PolarHBondContact O-N 2.73Å; L203-M207 WeakPolarHBondContact O-CG 3.37Å; L203-M207 PolarHBondContact O-N 3.12Å
204L92.5Very high88.2Confident61 Ų6162.6 Ų62.632%0.31933%0.325SS..Hα-helixtrans-63.2-41.9173.2-69.9172.4000111.3L174 L177 V200 T201 W206 M207 L208L174-L204 HydrophobicContact CD2-CB 3.81Å; L174-L204 HydrophobicContact CD2-CD1 4.03Å; L177-L204 HydrophobicContact CD2-CD1 3.56Å; V200-L204 HydrophobicContact CG1-CD1 4.19Å; V200-L204 WeakPolarHBondContact O-CG 3.41Å; V200-L204 PolarHBondContact O-N 3.42Å; T201-L204 PolarHBondContact O-N 3.49Å; L204-W206 VanDerWaalsContact C-N 3.31Å; L204-W206 PolarHBondContact O-N 2.88Å; L204-M207 PolarHBondContact O-N 2.98Å; L204-L208 WeakPolarHBondContact O-CG 3.45Å; L204-L208 PolarHBondContact O-N 3.28Å
205G89.3Confident87.8Confident0 Ų063 Ų630%033%0.33CS..Hα-helixtrans-59.4-40.7172.400000112.8T201 T202 L203 L208 G209 D210 Y343T201-G205 PolarHBondContact O-N 2.93Å; T202-G205 PolarHBondContact O-N 3.12Å; L203-G205 VanDerWaalsContact C-N 3.34Å; G205-L208 PolarHBondContact O-N 2.88Å; G205-G209 PolarHBondContact O-N 2.78Å; G205-D210 PolarHBondContact O-N 3.5Å; G205-Y343 WeakPolarHBondContact CA-OH 3.34Å
206W87.5Confident87.3Confident137 Ų13765 Ų6552%0.51934%0.34SS..Hα-helixtrans-62.6-42.7173.8179.773.2000112.4T202 L203 L204 L208 G209 V211T202-W206 PolarHBondContact O-N 3.39Å; L203-W206 WeakPolarHBondContact O-CB 3.42Å; L203-W206 PolarHBondContact O-N 2.73Å; L204-W206 VanDerWaalsContact C-N 3.31Å; L204-W206 PolarHBondContact O-N 2.88Å; W206-L208 VanDerWaalsContact C-N 3.26Å; W206-L208 PolarHBondContact O-N 3.06Å; W206-G209 PolarHBondContact O-N 3.27Å; W206-V211 HydrophobicContact CB-CB 3.98Å; W206-V211 HydrophobicContact CB-CG1 4.41Å
207M89.5Confident86.8Confident146 Ų14667 Ų6772%0.71935%0.353SS*.Hα-helixtrans-65.7-29176.5-67.5179.48400113.1L203 L204 G209L203-M207 WeakPolarHBondContact O-CG 3.37Å; L203-M207 PolarHBondContact O-N 3.12Å; L204-M207 PolarHBondContact O-N 2.98Å; M207-G209 VanDerWaalsContact C-N 3.28Å
208L88.3Confident86.4Confident90 Ų9069.1 Ų69.147%0.47137%0.368SS..Hα-helixtrans-80.6-9174.5-68165.5000113L174 L204 G205 W206L174-L208 HydrophobicContact CD1-CD1 3.93Å; L204-L208 WeakPolarHBondContact O-CG 3.45Å; L204-L208 PolarHBondContact O-N 3.28Å; G205-L208 PolarHBondContact O-N 2.88Å; W206-L208 VanDerWaalsContact C-N 3.26Å; W206-L208 PolarHBondContact O-N 3.06Å
209G83.7Confident86.1Confident49 Ų4972.9 Ų72.951%0.50540%0.399SS..THydrogen-bonded Turntrans89.14.5-179.100000115G205 W206 M207G205-G209 PolarHBondContact O-N 2.78Å; W206-G209 PolarHBondContact O-N 3.27Å; M207-G209 VanDerWaalsContact C-N 3.28Å
210D79.1Confident85.6Confident88 Ų8872.3 Ų72.347%0.47140%0.397SS..  trans-80.5-16.3-177.6-71.7-18.3000113.4G205 Y343G205-D210 PolarHBondContact O-N 3.5Å; D210-Y343 WeakPolarHBondContact CB-OH 3.22Å; D210-Y343 PolarHBondContact OD2-OH 3.36Å
211V81.7Confident85.2Confident10 Ų1071.6 Ų71.66%0.06139%0.393CS..  trans-118.1132.5-176.1177.10000109.7T202 W206 M339 P341T202-V211 HydrophobicContact CG2-CG1 4.18Å; T202-V211 HydrophobicContact CG2-CG2 4.32Å; W206-V211 HydrophobicContact CB-CB 3.98Å; W206-V211 HydrophobicContact CB-CG1 4.41Å; V211-M339 HydrophobicContact CG1-CB 4.03Å; V211-M339 HydrophobicContact CG1-CE 4.11Å; V211-M339 WeakPolarHBondContact CG1-O 3.44Å; V211-P341 HydrophobicContact CG2-CG 3.98Å
212H79.8Confident84.9Confident143 Ų14375.1 Ų75.166%0.66242%0.418SS*.  trans-100.2134.2172.8-65.7-63.2000110.8N214 M339H212-N214 PolarHBondContact O-N 2.96Å; H212-M339 WeakPolarHBondContact O-CG 3.49Å
213Y80.9Confident84.9Confident139 Ų13976.2 Ų76.255%0.54542%0.424SS..  trans-74.6120.3177.3177.6-99.9000110.7I216 M339Y213-I216 HydrophobicContact CE2-CG1 4.28Å; Y213-I216 WeakPolarHBondContact OH-CG1 3.46Å; Y213-M339 HydrophobicContact CD2-CE 3.83Å; Y213-M339 HydrophobicContact CD2-SD 3.92Å; Y213-M339 HydrophobicContact CE2-SD 4.49Å
214N77.3Confident84.8Confident101 Ų10178.5 Ų78.554%0.5443%0.434SS..  trans-110.49.5-176.8-74.6-25.9000113.8H212 P335 M339H212-N214 PolarHBondContact O-N 2.96Å; N214-P335 WeakPolarHBondContact O-CB 3.32Å; N214-M339 HydrophobicContact CB-CG 4.2Å
215G81.8Confident84.5Confident17 Ų1778.8 Ų78.818%0.17544%0.438CS..  trans100.7-178.7-175.100000113.3P335G215-P335 WeakPolarHBondContact O-CB 3.44Å
216I79.6Confident84.5Confident88 Ų8878.8 Ų78.845%0.45144%0.438SS..SBendtrans-115.5-47-178.3-62.5166.6000111Y213 L333 L336Y213-I216 HydrophobicContact CE2-CG1 4.28Å; Y213-I216 WeakPolarHBondContact OH-CG1 3.46Å; I216-L333 HydrophobicContact CG2-CD2 4.33Å; I216-L336 HydrophobicContact CG1-CD2 4.33Å; I216-L336 HydrophobicContact CG2-CD1 4.31Å
217V83.4Confident84.5Confident103 Ų10374.6 Ų74.662%0.62443%0.428SS*.  trans-122.6131.8-176.8-177.40000109.3F332 L333V217-F332 VanDerWaalsContact CA-O 3.32Å; V217-F332 WeakPolarHBondContact CA-O 3.31Å; V217-F332 HydrophobicContact CG1-CB 4.46Å; V217-L333 HydrophobicContact CG2-CD2 4.3Å
218S85.5Confident84.2Confident44 Ų4470.4 Ų70.431%0.30842%0.423SS..  trans-139.8165.816969.80000110.8F332 S334 P335S218-F332 PolarHBondContact N-O 2.86Å; S218-F332 VanDerWaalsContact N-O 3.14Å; S218-S334 PolarHBondContact OG-OG 3.32Å; S218-P335 WeakPolarHBondContact OG-CD 3.22Å; S218-P335 VanDerWaalsContact OG-CG 3.3Å; S218-P335 WeakPolarHBondContact OG-CG 3.2Å
219A85.4Confident84.3Confident80 Ų8070.7 Ų70.766%0.66142%0.421SS*.PPolyproline II helixtrans-59147.2162.400000109.4
220P82.7Confident84.5Confident61 Ų6169.1 Ų69.140%0.39640%0.402SS..PPolyproline II helixtrans-54.1129.5176.4-2533.2000111.2I331 F332P220-I331 HydrophobicContact CB-CG2 3.52Å; P220-I331 HydrophobicContact CG-CG2 3.6Å; P220-F332 HydrophobicContact CG-CE1 4.32Å
221P84.5Confident85Confident37 Ų3767.8 Ų67.824%0.2440%0.395CS..PPolyproline II helixtrans-54.8152.6170.7-26.232.6000112V52 V223 S334V52-P221 HydrophobicContact CG2-CB 4.21Å; V52-P221 HydrophobicContact CG2-CG 4.15Å; P221-V223 PolarHBondContact O-N 3Å; P221-S334 VanDerWaalsContact CD-OG 3.3Å; P221-S334 WeakPolarHBondContact CD-OG 3.3Å
222S88.5Confident85.4Confident74 Ų7469.8 Ų69.852%0.51741%0.405SS..PPolyproline II helixtrans-64.3133.7174.8-178.30000110.4M224S222-M224 VanDerWaalsContact C-N 3.34Å; S222-M224 WeakPolarHBondContact OG-CB 3.37Å; S222-M224 WeakPolarHBondContact OG-CG 3.17Å; S222-M224 PolarHBondContact OG-N 3.06Å
223V90.3Very high85.7Confident38 Ų3867 Ų6723%0.2341%0.406CS..  trans-89.4-2.3174.9-64.20000112.9V52 T53 P221 T225 V226 V227V52-V223 HydrophobicContact CB-CG1 3.66Å; V52-V223 HydrophobicContact CG1-CG1 3.41Å; V52-V223 VanDerWaalsContact CG1-CG1 3.41Å; T53-V223 HydrophobicContact CG2-CB 4.06Å; T53-V223 HydrophobicContact CG2-CG1 3.88Å; P221-V223 PolarHBondContact O-N 3Å; V223-T225 PolarHBondContact O-N 2.95Å; V223-V226 PolarHBondContact O-N 2.86Å; V223-V226 VanDerWaalsContact O-N 3.08Å; V223-V227 HydrophobicContact CB-CG2 3.73Å; V223-V227 HydrophobicContact CG2-CB 4.4Å; V223-V227 HydrophobicContact CG2-CG2 3.78Å; V223-V227 WeakPolarHBondContact O-CB 3.5Å; V223-V227 WeakPolarHBondContact O-CG2 3.44Å; V223-V227 PolarHBondContact O-N 3.27Å
224M88.7Confident85.8Confident143 Ų14362 Ų6270%0.70440%0.397SS*.THydrogen-bonded Turntrans-65.2-20.9-172.4-68.1-172.56900113.7S222 V226 H229S222-M224 VanDerWaalsContact C-N 3.34Å; S222-M224 WeakPolarHBondContact OG-CB 3.37Å; S222-M224 WeakPolarHBondContact OG-CG 3.17Å; S222-M224 PolarHBondContact OG-N 3.06Å; M224-V226 PolarHBondContact O-N 2.87Å; M224-H229 PolarHBondContact O-CE1 3.12Å; M224-H229 PolarHBondContact O-ND1 2.88Å; M224-H229 VanDerWaalsContact O-ND1 3.14Å
225T86.5Confident86Confident66 Ų6657.2 Ų57.241%0.40537%0.371SS..THydrogen-bonded Turntrans-70.9-16.5176.450.80000112.9D46 A49 V223D46-T225 PolarHBondContact OD2-OG1 3.14Å; A49-T225 WeakPolarHBondContact CB-OG1 3.25Å; V223-T225 PolarHBondContact O-N 2.95Å
226V89Confident85.9Confident0 Ų063.2 Ų63.20%039%0.393CS..THydrogen-bonded Turntrans-122.4-47-174.5170.30000111.3M45 D46 A49 V50 T53 V223 M224 G228 H229 G296M45-V226 HydrophobicContact CE-CB 4.4Å; M45-V226 HydrophobicContact CE-CG1 3.53Å; M45-V226 HydrophobicContact CE-CG2 4.04Å; D46-V226 HydrophobicContact CB-CG2 4.36Å; A49-V226 HydrophobicContact CB-CB 4.09Å; A49-V226 HydrophobicContact CB-CG2 3.58Å; V50-V226 HydrophobicContact CG2-CG2 4.18Å; T53-V226 HydrophobicContact CG2-CG1 4.5Å; V223-V226 PolarHBondContact O-N 2.86Å; V223-V226 VanDerWaalsContact O-N 3.08Å; M224-V226 PolarHBondContact O-N 2.87Å; V226-G228 PolarHBondContact O-N 3.46Å; V226-H229 PolarHBondContact O-N 2.86Å; V226-G296 WeakPolarHBondContact CG1-O 3.02Å
227V89.1Confident86Confident49 Ų4963.7 Ų63.730%0.29740%0.397SS..THydrogen-bonded Turntrans-67.2132.3179.7178.80000109.9T53 V223 H229 I295T53-V227 HydrophobicContact CG2-CG2 3.87Å; V223-V227 HydrophobicContact CB-CG2 3.73Å; V223-V227 HydrophobicContact CG2-CB 4.4Å; V223-V227 HydrophobicContact CG2-CG2 3.78Å; V223-V227 WeakPolarHBondContact O-CB 3.5Å; V223-V227 WeakPolarHBondContact O-CG2 3.44Å; V223-V227 PolarHBondContact O-N 3.27Å; V227-H229 VanDerWaalsContact C-N 3.26Å; V227-H229 PolarHBondContact O-N 3.12Å; V227-H229 PolarHBondContact O-ND1 3.23Å; V227-I295 HydrophobicContact CG2-CB 4.14Å; V227-I295 WeakPolarHBondContact CG2-O 3.35Å
228G83.1Confident85.6Confident59 Ų5966.4 Ų66.461%0.60841%0.407SS*.THydrogen-bonded Turntrans80.5-1.3177.200000115.3V226 V230V226-G228 PolarHBondContact O-N 3.46Å; G228-V230 VanDerWaalsContact C-N 3.34Å
229H89Confident85.2Confident95 Ų9567.2 Ų67.244%0.4442%0.422SS..  trans-925.3177.1-73.876.7000113.3W97 Q98 M224 V226 V227 D231W97-H229 HydrophobicContact CH2-CB 3.66Å; W97-H229 HydrophobicContact CZ2-CB 4.22Å; Q98-H229 VanDerWaalsContact CB-O 3.26Å; Q98-H229 WeakPolarHBondContact CB-O 3.48Å; Q98-H229 HydrophobicContact CG-CB 4.49Å; Q98-H229 WeakPolarHBondContact CG-O 3.22Å; M224-H229 PolarHBondContact O-CE1 3.12Å; M224-H229 PolarHBondContact O-ND1 2.88Å; M224-H229 VanDerWaalsContact O-ND1 3.14Å; V226-H229 PolarHBondContact O-N 2.86Å; V227-H229 VanDerWaalsContact C-N 3.26Å; V227-H229 PolarHBondContact O-N 3.12Å; V227-H229 PolarHBondContact O-ND1 3.23Å; H229-D231 PolarHBondContact O-N 3.38Å
230V89.3Confident85.1Confident17 Ų1764 Ų6410%0.10339%0.394CS..  trans-69.2122.5179.3-177.80000109.8M101 G228 L232 S293 F294M101-V230 HydrophobicContact CB-CG1 4.14Å; M101-V230 HydrophobicContact CB-CG2 4.2Å; G228-V230 VanDerWaalsContact C-N 3.34Å; V230-L232 HydrophobicContact CG1-CD2 3.78Å; V230-L232 HydrophobicContact CG1-CG 4.31Å; V230-L232 PolarHBondContact O-N 3.01Å; V230-L232 VanDerWaalsContact O-N 3.16Å; V230-S293 WeakPolarHBondContact CG2-O 3.22Å; V230-F294 WeakPolarHBondContact CG2-O 3.36Å
231D89.5Confident85.1Confident60 Ų6063.4 Ų63.432%0.32139%0.393SS..  trans-86.987.5178-173.33.2000110.8Q98 V99 H229 A233 G234 S235Q98-D231 HydrophobicContact CB-CB 4.06Å; Q98-D231 PolarHBondContact O-N 2.93Å; V99-D231 HydrophobicContact CG2-CB 4.22Å; H229-D231 PolarHBondContact O-N 3.38Å; D231-A233 VanDerWaalsContact C-N 3.35Å; D231-A233 PolarHBondContact OD1-N 3.16Å; D231-G234 PolarHBondContact OD1-N 3.28Å; D231-G234 WeakPolarHBondContact OD2-CA 3.23Å; D231-S235 VanDerWaalsContact O-CB 3.22Å; D231-S235 WeakPolarHBondContact O-CB 3.48Å; D231-S235 PolarHBondContact O-N 3.46Å; D231-S235 PolarHBondContact O-OG 2.8Å
232L89.4Confident84.9Confident52 Ų5262.4 Ų62.427%0.27239%0.39SS..Hα-helixtrans-69.3-32.6179-62.6179.3000112.9F105 W106 V230 S235 F294F105-L232 HydrophobicContact CB-CD2 4.03Å; F105-L232 HydrophobicContact CD1-CD2 3.25Å; F105-L232 HydrophobicContact CD2-CD2 4.36Å; F105-L232 HydrophobicContact CE1-CD1 4.46Å; F105-L232 HydrophobicContact CE1-CD2 3.7Å; F105-L232 HydrophobicContact CG-CD2 3.62Å; F105-L232 HydrophobicContact CZ-CD2 4.42Å; W106-L232 PolarHBondContact NE1-O 3.05Å; V230-L232 HydrophobicContact CG1-CD2 3.78Å; V230-L232 HydrophobicContact CG1-CG 4.31Å; V230-L232 PolarHBondContact O-N 3.01Å; V230-L232 VanDerWaalsContact O-N 3.16Å; L232-S235 WeakPolarHBondContact CA-OG 3.38Å; L232-S235 PolarHBondContact O-OG 3.3Å; L232-S235 VanDerWaalsContact O-OG 3.06Å; L232-F294 HydrophobicContact CD1-CE2 4.33Å
233A86.2Confident84.7Confident84 Ų8459.4 Ų59.469%0.69437%0.369SS*.Hα-helixtrans-80.9-47.3-176.100000110.9D231 S235 F236D231-A233 VanDerWaalsContact C-N 3.35Å; D231-A233 PolarHBondContact OD1-N 3.16Å; A233-S235 PolarHBondContact O-N 2.92Å; A233-F236 PolarHBondContact O-N 2.56Å
234G82.6Confident84.6Confident34 Ų3459 Ų5935%0.35137%0.365SS..Hα-helixtrans-66.5-27177.800000113.2D231D231-G234 PolarHBondContact OD1-N 3.28Å; D231-G234 WeakPolarHBondContact OD2-CA 3.23Å
235S82.1Confident84.4Confident0 Ų055.2 Ų55.20%035%0.345CS..Hα-helixtrans-76.2-20.5174.556.70000114.2V99 G102 W106 D231 L232 A233 N237V99-S235 WeakPolarHBondContact O-CB 3.26Å; G102-S235 VanDerWaalsContact C-OG 3.27Å; G102-S235 VanDerWaalsContact CA-OG 3.26Å; G102-S235 WeakPolarHBondContact CA-OG 3.2Å; W106-S235 PolarHBondContact NE1-OG 3.44Å; D231-S235 VanDerWaalsContact O-CB 3.22Å; D231-S235 WeakPolarHBondContact O-CB 3.48Å; D231-S235 PolarHBondContact O-N 3.46Å; D231-S235 PolarHBondContact O-OG 2.8Å; L232-S235 WeakPolarHBondContact CA-OG 3.38Å; L232-S235 PolarHBondContact O-OG 3.3Å; L232-S235 VanDerWaalsContact O-OG 3.06Å; A233-S235 PolarHBondContact O-N 2.92Å; S235-N237 PolarHBondContact O-N 2.97Å
236F80.7Confident84.2Confident143 Ų14352.4 Ų52.463%0.62733%0.328SS*.  trans-85.554.2-179.4-153.1-101.8000112.2W106 A233W106-F236 AromaticContact CD2-CD2 3.75Å; W106-F236 HydrophobicContact CD2-CD2 3.75Å; W106-F236 HydrophobicContact CD2-CE2 4.1Å; W106-F236 AromaticContact CE2-CD2 3.52Å; W106-F236 HydrophobicContact CE3-CD2 4.29Å; W106-F236 HydrophobicContact CE3-CE2 4.19Å; W106-F236 HydrophobicContact CG-CD2 4.07Å; W106-F236 HydrophobicContact CH2-CD2 4.41Å; W106-F236 AromaticContact CZ2-CD2 3.88Å; W106-F236 HydrophobicContact CZ2-CD2 3.88Å; W106-F236 HydrophobicContact CZ2-CE2 4.42Å; W106-F236 HydrophobicContact CZ2-CG 4.45Å; W106-F236 HydrophobicContact CZ3-CE2 4.4Å; W106-F236 AromaticContact NE1-CD2 3.68Å; A233-F236 PolarHBondContact O-N 2.56Å
237N80.7Confident84.1Confident99 Ų9952.5 Ų52.553%0.52933%0.328SS..SBendtrans-112.7143176-172.1-26000110.2S235 G239 L240 A241S235-N237 PolarHBondContact O-N 2.97Å; N237-G239 PolarHBondContact O-N 2.92Å; N237-G239 VanDerWaalsContact O-N 3.17Å; N237-G239 PolarHBondContact OD1-N 2.93Å; N237-G239 VanDerWaalsContact OD1-N 3.12Å; N237-L240 PolarHBondContact O-N 2.74Å; N237-A241 PolarHBondContact O-N 3.3Å
238L75.1Confident84.1Confident160 Ų16051.5 Ų51.584%0.83832%0.32SS*.G310 helixtrans-49.9-36.1173.1-88.6146.2000113L240 A241L238-L240 PolarHBondContact O-N 2.89Å; L238-A241 VanDerWaalsContact O-CB 3.26Å; L238-A241 WeakPolarHBondContact O-CB 3.31Å; L238-A241 PolarHBondContact O-N 3.35Å; L238-A241 VanDerWaalsContact O-N 3.15Å
239G77.3Confident84Confident60 Ų6048.9 Ų48.962%0.61929%0.293SS*.G310 helixtrans-64-23.3176.700000114.3N237N237-G239 PolarHBondContact O-N 2.92Å; N237-G239 VanDerWaalsContact O-N 3.17Å; N237-G239 PolarHBondContact OD1-N 2.93Å; N237-G239 VanDerWaalsContact OD1-N 3.12Å
240L83.6Confident83.6Confident14 Ų1444.4 Ų44.47%0.07327%0.272CS..G310 helixtrans-100.7-2.1177.7-63.2175.1000112.9L95 V99 N237 L238 G242 V243 I244L95-L240 HydrophobicContact CD1-CD2 3.5Å; L95-L240 VanDerWaalsContact CD1-CD2 3.5Å; L95-L240 HydrophobicContact CD2-CD2 4.45Å; V99-L240 HydrophobicContact CG1-CD1 3.46Å; V99-L240 VanDerWaalsContact CG1-CD1 3.46Å; N237-L240 PolarHBondContact O-N 2.74Å; L238-L240 PolarHBondContact O-N 2.89Å; L240-G242 PolarHBondContact O-N 3.38Å; L240-V243 HydrophobicContact CD2-CG2 4.33Å; L240-V243 PolarHBondContact O-N 2.89Å; L240-I244 WeakPolarHBondContact O-CG1 3.43Å; L240-I244 PolarHBondContact O-N 3.33Å
241A83Confident83.5Confident47 Ų4743.6 Ų43.639%0.38827%0.267SS..Hα-helixtrans-56.4-38.2178.800000111.6N237 L238 I244 F245N237-A241 PolarHBondContact O-N 3.3Å; L238-A241 VanDerWaalsContact O-CB 3.26Å; L238-A241 WeakPolarHBondContact O-CB 3.31Å; L238-A241 PolarHBondContact O-N 3.35Å; L238-A241 VanDerWaalsContact O-N 3.15Å; A241-I244 PolarHBondContact O-N 2.65Å; A241-F245 VanDerWaalsContact O-CB 3.23Å; A241-F245 WeakPolarHBondContact O-CB 3.37Å; A241-F245 PolarHBondContact O-N 2.91Å
242G79.7Confident83.4Confident17 Ų1740.8 Ų40.818%0.17525%0.252CS..Hα-helixtrans-58.6-49.9172.700000112.2L240 F245 S246L240-G242 PolarHBondContact O-N 3.38Å; G242-F245 PolarHBondContact O-N 3.14Å; G242-S246 WeakPolarHBondContact O-CB 3.43Å; G242-S246 PolarHBondContact O-N 2.99Å; G242-S246 PolarHBondContact O-OG 3.32Å
243V83.6Confident82.9Confident11 Ų1138.9 Ų38.97%0.06724%0.242CC..Hα-helixtrans-64.2-42.6179.7179.10000111.9F84 V89 M93 A103 L240 F245 S246 F247F84-V243 HydrophobicContact CE1-CG1 4.49Å; V89-V243 HydrophobicContact CG1-CG1 4.17Å; V89-V243 HydrophobicContact CG2-CG1 3.61Å; M93-V243 HydrophobicContact CE-CG2 3.84Å; M93-V243 HydrophobicContact SD-CG2 3.88Å; A103-V243 HydrophobicContact CB-CG1 4.11Å; L240-V243 HydrophobicContact CD2-CG2 4.33Å; L240-V243 PolarHBondContact O-N 2.89Å; V243-F245 VanDerWaalsContact C-N 3.34Å; V243-S246 WeakPolarHBondContact O-CB 3.29Å; V243-S246 PolarHBondContact O-N 3.4Å; V243-F247 HydrophobicContact CG1-CD2 3.79Å; V243-F247 HydrophobicContact CG1-CE2 3.51Å; V243-F247 VanDerWaalsContact O-CD2 3.25Å; V243-F247 WeakPolarHBondContact O-CD2 3.47Å; V243-F247 PolarHBondContact O-N 3.35Å
244I89.4Confident82.5Confident29 Ų2935.3 Ų35.315%0.14921%0.211CC..Hα-helixtrans-59.5-48.1175.7-69.8169.1000110.1A103 W106 L240 A241 S246 F247 M248A103-I244 HydrophobicContact CB-CG1 3.82Å; W106-I244 HydrophobicContact CB-CD1 3.94Å; W106-I244 HydrophobicContact CB-CG1 4.13Å; W106-I244 HydrophobicContact CB-CG2 3.82Å; W106-I244 HydrophobicContact CG-CD1 4.38Å; L240-I244 WeakPolarHBondContact O-CG1 3.43Å; L240-I244 PolarHBondContact O-N 3.33Å; A241-I244 PolarHBondContact O-N 2.65Å; I244-S246 VanDerWaalsContact C-N 3.32Å; I244-S246 PolarHBondContact O-N 3.38Å; I244-F247 PolarHBondContact O-N 3.27Å; I244-M248 PolarHBondContact O-N 3.06Å
245F83.3Confident82.7Confident64 Ų6433.7 Ų33.728%0.28119%0.194SC..Hα-helixtrans-63-40.5179-176.2-106.1000111.7A241 G242 V243 M248 L249 F422A241-F245 VanDerWaalsContact O-CB 3.23Å; A241-F245 WeakPolarHBondContact O-CB 3.37Å; A241-F245 PolarHBondContact O-N 2.91Å; G242-F245 PolarHBondContact O-N 3.14Å; V243-F245 VanDerWaalsContact C-N 3.34Å; F245-M248 HydrophobicContact CD2-CE 3.59Å; F245-M248 HydrophobicContact CE2-CE 3.65Å; F245-M248 WeakPolarHBondContact O-CB 2.98Å; F245-M248 PolarHBondContact O-N 3.46Å; F245-L249 HydrophobicContact CD1-CD1 3.92Å; F245-L249 HydrophobicContact CD1-CG 4.37Å; F245-L249 HydrophobicContact CE1-CD1 3.24Å; F245-L249 HydrophobicContact CE1-CG 3.98Å; F245-L249 HydrophobicContact CE2-CD1 4.28Å; F245-L249 HydrophobicContact CE2-CG 4.26Å; F245-L249 HydrophobicContact CZ-CD1 3.46Å; F245-L249 VanDerWaalsContact CZ-CD1 3.46Å; F245-L249 HydrophobicContact CZ-CD2 4.35Å; F245-L249 HydrophobicContact CZ-CG 3.92Å; F245-L249 PolarHBondContact O-N 2.91Å; F245-F422 HydrophobicContact CE1-CE1 4.17Å; F245-F422 HydrophobicContact CE1-CZ 4.48Å
246S82.3Confident82.8Confident7 Ų734 Ų345%0.04920%0.196CC..Hα-helixtrans-56.6-54172.6-65.90000112G242 V243 I244 M248 L249 V250 T388G242-S246 WeakPolarHBondContact O-CB 3.43Å; G242-S246 PolarHBondContact O-N 2.99Å; G242-S246 PolarHBondContact O-OG 3.32Å; V243-S246 WeakPolarHBondContact O-CB 3.29Å; V243-S246 PolarHBondContact O-N 3.4Å; I244-S246 VanDerWaalsContact C-N 3.32Å; I244-S246 PolarHBondContact O-N 3.38Å; S246-M248 VanDerWaalsContact C-N 3.28Å; S246-M248 PolarHBondContact O-N 3.27Å; S246-L249 PolarHBondContact O-N 2.9Å; S246-V250 WeakPolarHBondContact O-CB 3.27Å; S246-V250 VanDerWaalsContact O-CG2 3.22Å; S246-V250 WeakPolarHBondContact O-CG2 3.41Å; S246-V250 PolarHBondContact O-N 2.98Å; S246-T388 WeakPolarHBondContact CB-OG1 3.49Å; S246-T388 WeakPolarHBondContact OG-CB 3.41Å; S246-T388 WeakPolarHBondContact OG-CG2 3.17Å; S246-T388 PolarHBondContact OG-OG1 3.15Å
247F88.2Confident82.6Confident1 Ų127.9 Ų27.90%0.00417%0.173CC..Hα-helixtrans-58.5-41.9178.1-79.5-60.4000112L81 F84 F85 V89 A103 I104 V243 I244 N251L81-F247 HydrophobicContact CB-CD1 4.32Å; L81-F247 HydrophobicContact CB-CE1 4.32Å; L81-F247 HydrophobicContact CD2-CD1 3.71Å; L81-F247 HydrophobicContact CD2-CE1 4.49Å; L81-F247 HydrophobicContact CG-CD1 4.03Å; L81-F247 HydrophobicContact CG-CE1 4.49Å; F84-F247 AromaticContact CD1-CD1 3.87Å; F84-F247 HydrophobicContact CD1-CD1 3.87Å; F84-F247 AromaticContact CD1-CE1 3.39Å; F84-F247 HydrophobicContact CD1-CE1 3.39Å; F84-F247 HydrophobicContact CD1-CE2 4.29Å; F84-F247 AromaticContact CD1-CZ 3.61Å; F84-F247 HydrophobicContact CD1-CZ 3.61Å; F84-F247 HydrophobicContact CE1-CD1 4.26Å; F84-F247 HydrophobicContact CE1-CD2 4.4Å; F84-F247 HydrophobicContact CE1-CE1 4Å; F84-F247 HydrophobicContact CE1-CE2 4.12Å; F84-F247 HydrophobicContact CE1-CG 4.46Å; F84-F247 AromaticContact CE1-CZ 3.9Å; F84-F247 HydrophobicContact CE1-CZ 3.9Å; F84-F247 HydrophobicContact CG-CE1 4.44Å; F85-F247 HydrophobicContact CB-CE1 4.18Å; F85-F247 HydrophobicContact CB-CZ 3.88Å; F85-F247 HydrophobicContact CD2-CZ 4.44Å; V89-F247 HydrophobicContact CG2-CE2 3.97Å; V89-F247 HydrophobicContact CG2-CZ 3.92Å; A103-F247 HydrophobicContact CB-CD2 4.4Å; A103-F247 HydrophobicContact CB-CE2 4.39Å; I104-F247 HydrophobicContact CD1-CE1 4.02Å; I104-F247 HydrophobicContact CD1-CE2 4.45Å; I104-F247 HydrophobicContact CD1-CZ 3.93Å; I104-F247 HydrophobicContact CG1-CD1 3.92Å; I104-F247 HydrophobicContact CG1-CD2 3.79Å; I104-F247 HydrophobicContact CG1-CE1 3.62Å; I104-F247 HydrophobicContact CG1-CE2 3.52Å; I104-F247 HydrophobicContact CG1-CG 3.99Å; I104-F247 HydrophobicContact CG1-CZ 3.44Å; I104-F247 VanDerWaalsContact CG1-CZ 3.44Å; V243-F247 HydrophobicContact CG1-CD2 3.79Å; V243-F247 HydrophobicContact CG1-CE2 3.51Å; V243-F247 VanDerWaalsContact O-CD2 3.25Å; V243-F247 WeakPolarHBondContact O-CD2 3.47Å; V243-F247 PolarHBondContact O-N 3.35Å; I244-F247 PolarHBondContact O-N 3.27Å; F247-N251 WeakPolarHBondContact O-CB 3.11Å; F247-N251 PolarHBondContact O-N 3.46Å
248M89.1Confident82.7Confident28 Ų2823.4 Ų23.414%0.13815%0.15CC..Hα-helixtrans-59.3-48.3176.7-174.8-173.671.700111.6L111 L114 I244 F245 S246 L252L111-M248 HydrophobicContact CB-CG 4.34Å; L114-M248 HydrophobicContact CD1-CE 4.07Å; L114-M248 HydrophobicContact CD1-CG 4.31Å; L114-M248 HydrophobicContact CD1-SD 3.78Å; L114-M248 HydrophobicContact CG-SD 4.47Å; I244-M248 PolarHBondContact O-N 3.06Å; F245-M248 HydrophobicContact CD2-CE 3.59Å; F245-M248 HydrophobicContact CE2-CE 3.65Å; F245-M248 WeakPolarHBondContact O-CB 2.98Å; F245-M248 PolarHBondContact O-N 3.46Å; S246-M248 VanDerWaalsContact C-N 3.28Å; S246-M248 PolarHBondContact O-N 3.27Å; M248-L252 VanDerWaalsContact O-CB 3.27Å; M248-L252 WeakPolarHBondContact O-CB 3.35Å; M248-L252 PolarHBondContact O-N 2.71Å
249L81Confident83.4Confident5 Ų515.8 Ų15.83%0.02611%0.11CC..Hα-helixtrans-71.3-43.7-178-76.6-171.3000113.3F245 S246 N251 L252 F253 F422F245-L249 HydrophobicContact CD1-CD1 3.92Å; F245-L249 HydrophobicContact CD1-CG 4.37Å; F245-L249 HydrophobicContact CE1-CD1 3.24Å; F245-L249 HydrophobicContact CE1-CG 3.98Å; F245-L249 HydrophobicContact CE2-CD1 4.28Å; F245-L249 HydrophobicContact CE2-CG 4.26Å; F245-L249 HydrophobicContact CZ-CD1 3.46Å; F245-L249 VanDerWaalsContact CZ-CD1 3.46Å; F245-L249 HydrophobicContact CZ-CD2 4.35Å; F245-L249 HydrophobicContact CZ-CG 3.92Å; F245-L249 PolarHBondContact O-N 2.91Å; S246-L249 PolarHBondContact O-N 2.9Å; L249-N251 VanDerWaalsContact C-N 3.3Å; L249-N251 PolarHBondContact O-N 3.45Å; L249-L252 HydrophobicContact CD2-CD2 4.19Å; L249-L252 WeakPolarHBondContact O-CB 3.23Å; L249-L252 PolarHBondContact O-N 2.87Å; L249-F253 HydrophobicContact CB-CE2 4.29Å; L249-F253 HydrophobicContact CD2-CE2 4.22Å; L249-F253 HydrophobicContact CD2-CZ 4.31Å; L249-F253 WeakPolarHBondContact O-CD2 3.28Å; L249-F253 PolarHBondContact O-N 3.19Å; L249-F422 HydrophobicContact CD1-CE1 3.92Å; L249-F422 HydrophobicContact CD1-CE2 3.84Å; L249-F422 HydrophobicContact CD1-CZ 3.22Å
250V79.8Confident83.7Confident1 Ų113.9 Ų13.91%0.0069%0.085CC..Hα-helixtrans-60-46.9177.1-1800000109.3L81 I139 S246 L252 F253 D254 I387 I391L81-V250 HydrophobicContact CD1-CB 4.24Å; L81-V250 HydrophobicContact CD1-CG1 3.57Å; L81-V250 HydrophobicContact CG-CG1 4.16Å; I139-V250 HydrophobicContact CD1-CG1 4.06Å; S246-V250 WeakPolarHBondContact O-CB 3.27Å; S246-V250 VanDerWaalsContact O-CG2 3.22Å; S246-V250 WeakPolarHBondContact O-CG2 3.41Å; S246-V250 PolarHBondContact O-N 2.98Å; V250-L252 PolarHBondContact O-N 3.3Å; V250-F253 PolarHBondContact O-N 3.21Å; V250-D254 VanDerWaalsContact O-CB 3.28Å; V250-D254 WeakPolarHBondContact O-CB 3.21Å; V250-D254 PolarHBondContact O-N 3.13Å; V250-I387 HydrophobicContact CB-CG2 4.34Å; V250-I387 HydrophobicContact CG1-CD1 4.37Å; V250-I387 HydrophobicContact CG1-CG2 3.81Å; V250-I387 HydrophobicContact CG2-CB 4.05Å; V250-I387 HydrophobicContact CG2-CG2 3.48Å; V250-I387 VanDerWaalsContact CG2-CG2 3.48Å; V250-I391 HydrophobicContact CB-CD1 4.41Å; V250-I391 HydrophobicContact CG2-CD1 3.67Å
251N88Confident83.5Confident0 Ų013.8 Ų13.80%09%0.088CC..Hα-helixtrans-64-41178.4-164.114.7000112L81 L111 F247 L249 F253 S255 S289 S299L81-N251 HydrophobicContact CD1-CB 4.47Å; L81-N251 HydrophobicContact CD2-CB 3.85Å; L111-N251 HydrophobicContact CD2-CB 4.11Å; L111-N251 VanDerWaalsContact CD2-ND2 3.29Å; L111-N251 WeakPolarHBondContact CD2-ND2 3.4Å; F247-N251 WeakPolarHBondContact O-CB 3.11Å; F247-N251 PolarHBondContact O-N 3.46Å; L249-N251 VanDerWaalsContact C-N 3.3Å; L249-N251 PolarHBondContact O-N 3.45Å; N251-F253 VanDerWaalsContact C-N 3.3Å; N251-F253 PolarHBondContact O-N 3.43Å; N251-S255 VanDerWaalsContact O-CB 3.26Å; N251-S255 WeakPolarHBondContact O-CB 3.39Å; N251-S255 PolarHBondContact O-N 2.99Å; N251-S255 VanDerWaalsContact O-N 3.08Å; N251-S289 PolarHBondContact ND2-OG 3.14Å; N251-S299 WeakPolarHBondContact ND2-CB 3.27Å
252L85.9Confident83.7Confident1 Ų111.5 Ų11.51%0.0057%0.069CC..Hα-helixtrans-53.3-49175174.266.1000111.1L111 R120 M123 M248 L249 V250 S256L111-L252 HydrophobicContact CD1-CB 3.72Å; L111-L252 HydrophobicContact CD1-CD1 3.72Å; L111-L252 HydrophobicContact CD1-CG 4.32Å; R120-L252 HydrophobicContact CB-CD1 4.4Å; R120-L252 HydrophobicContact CG-CD1 3.57Å; M123-L252 HydrophobicContact CE-CD2 3.41Å; M123-L252 VanDerWaalsContact CE-CD2 3.41Å; M123-L252 HydrophobicContact SD-CD2 3.66Å; M248-L252 VanDerWaalsContact O-CB 3.27Å; M248-L252 WeakPolarHBondContact O-CB 3.35Å; M248-L252 PolarHBondContact O-N 2.71Å; L249-L252 HydrophobicContact CD2-CD2 4.19Å; L249-L252 WeakPolarHBondContact O-CB 3.23Å; L249-L252 PolarHBondContact O-N 2.87Å; V250-L252 PolarHBondContact O-N 3.3Å; L252-S256 WeakPolarHBondContact O-CB 3.4Å; L252-S256 PolarHBondContact O-N 2.97Å; L252-S256 PolarHBondContact O-OG 3.43Å
253F78.7Confident84.2Confident12 Ų1210.8 Ų10.85%0.0536%0.061CC..Hα-helixtrans-81.1-38.8-174.1-61.5-43.5000113.8I127 I135 L249 V250 N251 G257 I391 F395I127-F253 HydrophobicContact CD1-CD1 3.89Å; I127-F253 HydrophobicContact CD1-CE1 3.1Å; I127-F253 HydrophobicContact CD1-CZ 3.81Å; I135-F253 HydrophobicContact CD1-CB 3.93Å; I135-F253 HydrophobicContact CD1-CD1 4.4Å; I135-F253 HydrophobicContact CD1-CD2 3.53Å; I135-F253 HydrophobicContact CD1-CE2 4.12Å; I135-F253 HydrophobicContact CD1-CG 3.67Å; I135-F253 HydrophobicContact CG2-CB 3.82Å; L249-F253 HydrophobicContact CB-CE2 4.29Å; L249-F253 HydrophobicContact CD2-CE2 4.22Å; L249-F253 HydrophobicContact CD2-CZ 4.31Å; L249-F253 WeakPolarHBondContact O-CD2 3.28Å; L249-F253 PolarHBondContact O-N 3.19Å; V250-F253 PolarHBondContact O-N 3.21Å; N251-F253 VanDerWaalsContact C-N 3.3Å; N251-F253 PolarHBondContact O-N 3.43Å; F253-G257 PolarHBondContact O-N 3.49Å; F253-I391 HydrophobicContact CD2-CD1 4.18Å; F253-I391 HydrophobicContact CD2-CG2 4.23Å; F253-I391 HydrophobicContact CE2-CG2 3.94Å; F253-F395 HydrophobicContact CE1-CZ 4.39Å; F253-F395 AromaticContact CE2-CE2 3.89Å; F253-F395 HydrophobicContact CE2-CE2 3.89Å; F253-F395 HydrophobicContact CE2-CZ 4.17Å; F253-F395 AromaticContact CZ-CE2 3.96Å; F253-F395 HydrophobicContact CZ-CE2 3.96Å; F253-F395 AromaticContact CZ-CZ 3.74Å; F253-F395 HydrophobicContact CZ-CZ 3.74Å
254D79.3Confident84.2Confident8 Ų814.4 Ų14.44%0.0438%0.08CC..Hα-helixtrans-63.1-53.5178.3-177.233.8000111.3I139 V250 S256 G257 T258 T301I139-D254 HydrophobicContact CD1-CB 4.14Å; V250-D254 VanDerWaalsContact O-CB 3.28Å; V250-D254 WeakPolarHBondContact O-CB 3.21Å; V250-D254 PolarHBondContact O-N 3.13Å; D254-S256 PolarHBondContact O-N 3.31Å; D254-G257 PolarHBondContact O-N 3.35Å; D254-T258 WeakPolarHBondContact O-CB 3.31Å; D254-T258 PolarHBondContact O-N 2.83Å; D254-T258 PolarHBondContact O-OG1 2.87Å; D254-T258 VanDerWaalsContact O-OG1 3.08Å; D254-T301 PolarHBondContact OD2-OG1 3.38Å
255S86.5Confident83.9Confident0 Ų018.8 Ų18.80%010%0.098CC..Hα-helixtrans-62-45179.3167.70000112R120 N251 T258 L259 D285 T301R120-S255 PolarHBondContact NH2-OG 3.5Å; N251-S255 VanDerWaalsContact O-CB 3.26Å; N251-S255 WeakPolarHBondContact O-CB 3.39Å; N251-S255 PolarHBondContact O-N 2.99Å; N251-S255 VanDerWaalsContact O-N 3.08Å; S255-T258 PolarHBondContact O-N 3.4Å; S255-L259 VanDerWaalsContact O-CB 3.32Å; S255-L259 WeakPolarHBondContact O-CB 3.25Å; S255-L259 WeakPolarHBondContact O-CG 3.46Å; S255-L259 PolarHBondContact O-N 3.03Å; S255-D285 VanDerWaalsContact CB-OD1 3.29Å; S255-D285 WeakPolarHBondContact CB-OD1 3.48Å; S255-D285 PolarHBondContact OG-OD1 3.46Å; S255-D285 PolarHBondContact OG-OD2 3.01Å; S255-T301 WeakPolarHBondContact CA-OG1 3.46Å; S255-T301 WeakPolarHBondContact CB-OG1 3.46Å; S255-T301 PolarHBondContact N-OG1 3.41Å
256S82.6Confident84Confident6 Ų616 Ų164%0.0429%0.086CC..Hα-helixtrans-68.3-41.5-178.3-53.70000111.9I124 L252 D254 T258 I260I124-S256 WeakPolarHBondContact CD1-OG 3.24Å; I124-S256 WeakPolarHBondContact CG1-OG 3.36Å; L252-S256 WeakPolarHBondContact O-CB 3.4Å; L252-S256 PolarHBondContact O-N 2.97Å; L252-S256 PolarHBondContact O-OG 3.43Å; D254-S256 PolarHBondContact O-N 3.31Å; S256-T258 VanDerWaalsContact C-N 3.34Å; S256-I260 WeakPolarHBondContact O-CB 3.47Å; S256-I260 WeakPolarHBondContact O-CD1 3.43Å; S256-I260 WeakPolarHBondContact O-CG1 3.23Å; S256-I260 PolarHBondContact O-N 3.23Å; S256-I260 VanDerWaalsContact O-N 3.07Å
257G77.3Confident84.2Confident15 Ų1518.9 Ų18.916%0.15512%0.117CC..Hα-helixtrans-61.1-44.2176.800000111.7F253 D254 G261F253-G257 PolarHBondContact O-N 3.49Å; D254-G257 PolarHBondContact O-N 3.35Å; G257-G261 PolarHBondContact O-N 2.91Å
258T83.9Confident84.2Confident6 Ų620.3 Ų20.34%0.03713%0.125CC..Hα-helixtrans-72.6-41.7-179.8-590000112.7D254 S255 S256 I260 G261 V262 A302 Y303 I304D254-T258 WeakPolarHBondContact O-CB 3.31Å; D254-T258 PolarHBondContact O-N 2.83Å; D254-T258 PolarHBondContact O-OG1 2.87Å; D254-T258 VanDerWaalsContact O-OG1 3.08Å; S255-T258 PolarHBondContact O-N 3.4Å; S256-T258 VanDerWaalsContact C-N 3.34Å; T258-I260 VanDerWaalsContact C-N 3.31Å; T258-I260 PolarHBondContact O-N 3.32Å; T258-G261 PolarHBondContact O-N 3.03Å; T258-V262 HydrophobicContact CG2-CG2 4.11Å; T258-V262 WeakPolarHBondContact O-CG2 3.17Å; T258-V262 PolarHBondContact O-N 3.5Å; T258-A302 WeakPolarHBondContact CB-O 3.23Å; T258-A302 HydrophobicContact CG2-CB 4Å; T258-A302 WeakPolarHBondContact CG2-O 3.2Å; T258-Y303 VanDerWaalsContact CG2-C 3.47Å; T258-I304 HydrophobicContact CG2-CB 4Å; T258-I304 HydrophobicContact CG2-CD1 4.23Å; T258-I304 VanDerWaalsContact CG2-N 3.34Å
259L88.6Confident83.9Confident0 Ų019.9 Ų19.90%013%0.126CC..Hα-helixtrans-56.3-47.4173.6-82.8168000111.3M65 V73 S255 T263 F275 A281 L282 A302M65-L259 HydrophobicContact CE-CD2 4.04Å; V73-L259 HydrophobicContact CB-CD2 4.45Å; V73-L259 HydrophobicContact CG1-CD2 4.03Å; V73-L259 HydrophobicContact CG2-CD2 4.33Å; S255-L259 VanDerWaalsContact O-CB 3.32Å; S255-L259 WeakPolarHBondContact O-CB 3.25Å; S255-L259 WeakPolarHBondContact O-CG 3.46Å; S255-L259 PolarHBondContact O-N 3.03Å; L259-T263 WeakPolarHBondContact O-CB 3.31Å; L259-T263 VanDerWaalsContact O-CG2 3.22Å; L259-T263 WeakPolarHBondContact O-CG2 3.46Å; L259-T263 PolarHBondContact O-N 3.07Å; L259-T263 PolarHBondContact O-OG1 3.37Å; L259-F275 HydrophobicContact CB-CE1 4.16Å; L259-F275 HydrophobicContact CB-CZ 3.93Å; L259-F275 HydrophobicContact CD1-CZ 4.49Å; L259-F275 HydrophobicContact CD2-CZ 4.44Å; L259-A281 HydrophobicContact CD2-CB 4.35Å; L259-L282 HydrophobicContact CD1-CD2 4.06Å; L259-A302 HydrophobicContact CD2-CB 4.01Å; L259-A302 HydrophobicContact CG-CB 3.76Å
260I83.2Confident84Confident19 Ų1923.1 Ų23.110%0.09714%0.143CC..Hα-helixtrans-64.1-47.1177-65.4165.9000110.1I124 S256 T258 V262 T263 D264 F275I124-I260 HydrophobicContact CG2-CD1 3.41Å; I124-I260 VanDerWaalsContact CG2-CD1 3.41Å; S256-I260 WeakPolarHBondContact O-CB 3.47Å; S256-I260 WeakPolarHBondContact O-CD1 3.43Å; S256-I260 WeakPolarHBondContact O-CG1 3.23Å; S256-I260 PolarHBondContact O-N 3.23Å; S256-I260 VanDerWaalsContact O-N 3.07Å; T258-I260 VanDerWaalsContact C-N 3.31Å; T258-I260 PolarHBondContact O-N 3.32Å; I260-V262 PolarHBondContact O-N 3.47Å; I260-T263 WeakPolarHBondContact CA-OG1 3.19Å; I260-T263 PolarHBondContact O-N 3.17Å; I260-T263 PolarHBondContact O-OG1 2.84Å; I260-T263 VanDerWaalsContact O-OG1 3.13Å; I260-D264 WeakPolarHBondContact O-CB 3.47Å; I260-D264 PolarHBondContact O-N 3.28Å; I260-F275 HydrophobicContact CG1-CE1 4.13Å
261G79.4Confident83.6Confident12 Ų1233 Ų3312%0.12419%0.19CC..Hα-helixtrans-59.9-42.7-178.400000113.8G257 T258 K265G257-G261 PolarHBondContact O-N 2.91Å; T258-G261 PolarHBondContact O-N 3.03Å; G261-K265 WeakPolarHBondContact O-CB 3.44Å; G261-K265 PolarHBondContact O-N 2.86Å; G261-K265 VanDerWaalsContact O-N 3.16Å
262V87.5Confident82.7Confident0 Ų041.7 Ų41.70%023%0.227CC..Hα-helixtrans-73.2-41178.3178.90000111.2V73 T258 I260 K265 A266 I304 V310V73-V262 HydrophobicContact CG2-CB 4.23Å; V73-V262 HydrophobicContact CG2-CG1 3.83Å; T258-V262 HydrophobicContact CG2-CG2 4.11Å; T258-V262 WeakPolarHBondContact O-CG2 3.17Å; T258-V262 PolarHBondContact O-N 3.5Å; I260-V262 PolarHBondContact O-N 3.47Å; V262-K265 PolarHBondContact O-N 3.31Å; V262-A266 WeakPolarHBondContact O-CB 3.21Å; V262-A266 PolarHBondContact O-N 3.45Å; V262-I304 HydrophobicContact CG2-CD1 4.09Å; V262-V310 HydrophobicContact CG1-CG2 3.93Å
263T90Very high82.1Confident1 Ų142 Ų421%0.00623%0.231CC..Hα-helixtrans-70.6-35.7-179.854.20000112.5L71 V73 L259 I260 A266 G267 L268 A269 F275L71-T263 HydrophobicContact CD1-CG2 4.29Å; L71-T263 HydrophobicContact CD2-CG2 4.19Å; V73-T263 HydrophobicContact CG2-CG2 4.45Å; L259-T263 WeakPolarHBondContact O-CB 3.31Å; L259-T263 VanDerWaalsContact O-CG2 3.22Å; L259-T263 WeakPolarHBondContact O-CG2 3.46Å; L259-T263 PolarHBondContact O-N 3.07Å; L259-T263 PolarHBondContact O-OG1 3.37Å; I260-T263 WeakPolarHBondContact CA-OG1 3.19Å; I260-T263 PolarHBondContact O-N 3.17Å; I260-T263 PolarHBondContact O-OG1 2.84Å; I260-T263 VanDerWaalsContact O-OG1 3.13Å; T263-A266 WeakPolarHBondContact O-CB 3.35Å; T263-A266 PolarHBondContact O-N 3.45Å; T263-G267 PolarHBondContact O-N 3.02Å; T263-L268 WeakPolarHBondContact O-CA 3.42Å; T263-L268 WeakPolarHBondContact O-CB 3.27Å; T263-L268 PolarHBondContact O-N 3.04Å; T263-A269 PolarHBondContact O-N 3.44Å; T263-F275 HydrophobicContact CG2-CB 4.17Å; T263-F275 HydrophobicContact CG2-CD1 4.11Å; T263-F275 HydrophobicContact CG2-CD2 3.92Å; T263-F275 HydrophobicContact CG2-CE1 4.48Å; T263-F275 HydrophobicContact CG2-CE2 4.29Å; T263-F275 HydrophobicContact CG2-CG 3.82Å; T263-F275 VanDerWaalsContact OG1-CD1 3.24Å; T263-F275 WeakPolarHBondContact OG1-CD1 2.98Å
264D84.4Confident82.3Confident87 Ų8746.7 Ų46.747%0.46525%0.251SS..Hα-helixtrans-60.8-49.5170.8-177.551000111I260 A266 G267 A269I260-D264 WeakPolarHBondContact O-CB 3.47Å; I260-D264 PolarHBondContact O-N 3.28Å; D264-A266 PolarHBondContact O-N 3.28Å; D264-A266 VanDerWaalsContact O-N 3.15Å; D264-G267 WeakPolarHBondContact O-CA 3.5Å; D264-G267 PolarHBondContact O-N 2.91Å; D264-A269 HydrophobicContact CB-CB 4.05Å
265K82.5Confident82.7Confident122 Ų12246.8 Ų46.853%0.5325%0.251SS..Hα-helixtrans-64-21.6175.7-170.8151.8166.4-168.40113.6G261 V262 G267G261-K265 WeakPolarHBondContact O-CB 3.44Å; G261-K265 PolarHBondContact O-N 2.86Å; G261-K265 VanDerWaalsContact O-N 3.16Å; V262-K265 PolarHBondContact O-N 3.31Å; K265-G267 VanDerWaalsContact C-N 3.31Å
266A87Confident82.7Confident4 Ų450 Ų503%0.03327%0.272CS..THydrogen-bonded Turntrans-81.8-7171.800000113.9V262 T263 D264 L268 V310 R315V262-A266 WeakPolarHBondContact O-CB 3.21Å; V262-A266 PolarHBondContact O-N 3.45Å; T263-A266 WeakPolarHBondContact O-CB 3.35Å; T263-A266 PolarHBondContact O-N 3.45Å; D264-A266 PolarHBondContact O-N 3.28Å; D264-A266 VanDerWaalsContact O-N 3.15Å; A266-L268 VanDerWaalsContact C-N 3.27Å; A266-L268 HydrophobicContact CB-CB 4.42Å; A266-L268 HydrophobicContact CB-CD1 3.79Å; A266-L268 HydrophobicContact CB-CG 3.79Å; A266-V310 HydrophobicContact CB-CB 4.47Å; A266-V310 HydrophobicContact CB-CG1 3.44Å; A266-V310 VanDerWaalsContact CB-CG1 3.44Å; A266-V310 HydrophobicContact CB-CG2 4.12Å; A266-R315 WeakPolarHBondContact O-CD 3.4Å; A266-R315 PolarHBondContact O-NE 2.88Å
267G85.2Confident83.1Confident68 Ų6854.4 Ų54.470%0.70129%0.288SS*.THydrogen-bonded Turntrans69.625.5-171.600000112.9T263 D264 K265T263-G267 PolarHBondContact O-N 3.02Å; D264-G267 WeakPolarHBondContact O-CA 3.5Å; D264-G267 PolarHBondContact O-N 2.91Å; K265-G267 VanDerWaalsContact C-N 3.31Å
268L88.1Confident83.7Confident32 Ų3254.4 Ų54.417%0.16828%0.284CS..  trans-103.5-22.6-178.5-61.9175.7000112.9L71 T263 A266 P276L71-L268 HydrophobicContact CD2-CD1 3.98Å; T263-L268 WeakPolarHBondContact O-CA 3.42Å; T263-L268 WeakPolarHBondContact O-CB 3.27Å; T263-L268 PolarHBondContact O-N 3.04Å; A266-L268 VanDerWaalsContact C-N 3.27Å; A266-L268 HydrophobicContact CB-CB 4.42Å; A266-L268 HydrophobicContact CB-CD1 3.79Å; A266-L268 HydrophobicContact CB-CG 3.79Å; L268-P276 WeakPolarHBondContact O-CD 3.48Å
269A83.9Confident84Confident18 Ų1859.9 Ų59.915%0.14931%0.307CS..SBendtrans-88.7147.6177.400000111.6T263 D264 K274 F275T263-A269 PolarHBondContact O-N 3.44Å; D264-A269 HydrophobicContact CB-CB 4.05Å; A269-K274 CarbonylContact C-O 3.48Å; A269-K274 WeakPolarHBondContact CA-O 3.45Å; A269-F275 HydrophobicContact CB-CB 4.27Å
270D81.6Confident84.2Confident74 Ų7463.5 Ų63.540%0.39632%0.324SS..  trans-85.1174.4167.269.518.4000111.9K272 G273 K274D270-K272 PolarHBondContact O-N 2.96Å; D270-K272 WeakPolarHBondContact OD1-CA 3.12Å; D270-K272 WeakPolarHBondContact OD1-CB 3.36Å; D270-K272 PolarHBondContact OD1-N 2.9Å; D270-G273 WeakPolarHBondContact O-CA 3.39Å; D270-G273 PolarHBondContact O-N 3.36Å; D270-G273 PolarHBondContact OD1-N 3.26Å; D270-G273 VanDerWaalsContact OD1-N 3.08Å; D270-K274 PolarHBondContact N-O 3.32Å; D270-K274 WeakPolarHBondContact OD1-CB 3.32Å; D270-K274 PolarHBondContact OD1-N 2.82Å; D270-K274 WeakPolarHBondContact OD2-CB 3.49Å
271E71.7Confident84.7Confident209 Ų20962.6 Ų62.698%0.97732%0.319SS*.THydrogen-bonded Turntrans-58.4-21.7179-63-176.917100113.8G273E271-G273 VanDerWaalsContact C-N 3.3Å
272K70.6Confident85.3Confident181 Ų18162.4 Ų62.479%0.78732%0.316SS*.THydrogen-bonded Turntrans-89.71.7176.8-63-174.6178.2-178.80112.2D270 K274D270-K272 PolarHBondContact O-N 2.96Å; D270-K272 WeakPolarHBondContact OD1-CA 3.12Å; D270-K272 WeakPolarHBondContact OD1-CB 3.36Å; D270-K272 PolarHBondContact OD1-N 2.9Å; K272-K274 VanDerWaalsContact C-N 3.32Å
273G72.6Confident85.6Confident8 Ų866.6 Ų66.68%0.08233%0.332CS..SBendtrans76.715.7-178.500000113.8D270 E271 M278D270-G273 WeakPolarHBondContact O-CA 3.39Å; D270-G273 PolarHBondContact O-N 3.36Å; D270-G273 PolarHBondContact OD1-N 3.26Å; D270-G273 VanDerWaalsContact OD1-N 3.08Å; E271-G273 VanDerWaalsContact C-N 3.3Å; G273-M278 WeakPolarHBondContact O-CE 3.34Å
274K83Confident85.9Confident110 Ų11067 Ų6748%0.47833%0.334SS..  trans-87.2132175.8-175-175.9177.2-173.20109.5A269 D270 K272A269-K274 CarbonylContact C-O 3.48Å; A269-K274 WeakPolarHBondContact CA-O 3.45Å; D270-K274 PolarHBondContact N-O 3.32Å; D270-K274 WeakPolarHBondContact OD1-CB 3.32Å; D270-K274 PolarHBondContact OD1-N 2.82Å; D270-K274 WeakPolarHBondContact OD2-CB 3.49Å; K272-K274 VanDerWaalsContact C-N 3.32Å
275F87.3Confident86.4Confident10 Ų1062.9 Ų62.94%0.04431%0.312CS..  trans-128.6159.6-179.553.6-97.1000111.9L71 L259 I260 T263 A269 R277 M278 A281L71-F275 HydrophobicContact CD1-CD2 3.83Å; L71-F275 HydrophobicContact CD1-CE2 3.62Å; L259-F275 HydrophobicContact CB-CE1 4.16Å; L259-F275 HydrophobicContact CB-CZ 3.93Å; L259-F275 HydrophobicContact CD1-CZ 4.49Å; L259-F275 HydrophobicContact CD2-CZ 4.44Å; I260-F275 HydrophobicContact CG1-CE1 4.13Å; T263-F275 HydrophobicContact CG2-CB 4.17Å; T263-F275 HydrophobicContact CG2-CD1 4.11Å; T263-F275 HydrophobicContact CG2-CD2 3.92Å; T263-F275 HydrophobicContact CG2-CE1 4.48Å; T263-F275 HydrophobicContact CG2-CE2 4.29Å; T263-F275 HydrophobicContact CG2-CG 3.82Å; T263-F275 VanDerWaalsContact OG1-CD1 3.24Å; T263-F275 WeakPolarHBondContact OG1-CD1 2.98Å; A269-F275 HydrophobicContact CB-CB 4.27Å; F275-R277 PolarHBondContact O-N 2.93Å; F275-M278 HydrophobicContact CD1-CE 3.42Å; F275-M278 VanDerWaalsContact CD1-CE 3.42Å; F275-M278 HydrophobicContact CD2-CB 3.84Å; F275-M278 HydrophobicContact CD2-CG 4.45Å; F275-M278 HydrophobicContact CE1-CB 4.48Å; F275-M278 HydrophobicContact CE1-CE 3.22Å; F275-M278 HydrophobicContact CE1-CG 4.11Å; F275-M278 VanDerWaalsContact CE2-CA 3.44Å; F275-M278 HydrophobicContact CE2-CB 3.65Å; F275-M278 HydrophobicContact CE2-CG 3.92Å; F275-M278 HydrophobicContact CG-CB 4.33Å; F275-M278 HydrophobicContact CG-CE 4.18Å; F275-M278 HydrophobicContact CZ-CB 3.98Å; F275-M278 HydrophobicContact CZ-CE 3.85Å; F275-M278 HydrophobicContact CZ-CG 3.71Å; F275-M278 WeakPolarHBondContact O-CB 3.34Å; F275-M278 PolarHBondContact O-N 2.88Å; F275-A281 HydrophobicContact CE2-CB 3.9Å; F275-A281 HydrophobicContact CZ-CB 4.42Å
276P86.9Confident87Confident67 Ų6757 Ų5744%0.43529%0.287SS..THydrogen-bonded Turntrans-52.8137.8176.5-2833.7000112.6L268 M278L268-P276 WeakPolarHBondContact O-CD 3.48Å; P276-M278 PolarHBondContact O-N 2.89Å; P276-M278 VanDerWaalsContact O-N 3.08Å
277R89.9Confident87.4Confident100 Ų10060.3 Ų60.338%0.37730%0.303SS..THydrogen-bonded Turntrans54.828.5176.6-53.9-17677.7-166.513.1114.2F68 A69 N70 F275 K279 Q280 A281F68-R277 PolarHBondContact O-NE 3.05Å; F68-R277 PolarHBondContact O-NH1 3.35Å; F68-R277 PolarHBondContact O-NH2 2.93Å; A69-R277 WeakPolarHBondContact O-CB 3.39Å; A69-R277 VanDerWaalsContact O-CD 3.31Å; A69-R277 WeakPolarHBondContact O-CD 3.36Å; N70-R277 VanDerWaalsContact CB-NH1 3.25Å; F275-R277 PolarHBondContact O-N 2.93Å; R277-K279 VanDerWaalsContact C-N 3.27Å; R277-K279 PolarHBondContact O-N 3.04Å; R277-Q280 VanDerWaalsContact C-OE1 3.23Å; R277-Q280 HydrophobicContact CB-CB 4.4Å; R277-Q280 WeakPolarHBondContact O-CB 3.18Å; R277-Q280 PolarHBondContact O-N 3.32Å; R277-Q280 PolarHBondContact O-OE1 3.01Å; R277-Q280 VanDerWaalsContact O-OE1 3.06Å; R277-A281 PolarHBondContact O-N 2.6Å
278M89.9Confident87.9Confident14 Ų1457.1 Ų57.17%0.06927%0.27CS..Hα-helixtrans-52.1-42.4177.2176.3-174.7-92.800113Y121 G273 F275 P276 Q280 A281 L282Y121-M278 HydrophobicContact CD2-SD 3.61Å; Y121-M278 HydrophobicContact CE2-SD 3.81Å; G273-M278 WeakPolarHBondContact O-CE 3.34Å; F275-M278 HydrophobicContact CD1-CE 3.42Å; F275-M278 VanDerWaalsContact CD1-CE 3.42Å; F275-M278 HydrophobicContact CD2-CB 3.84Å; F275-M278 HydrophobicContact CD2-CG 4.45Å; F275-M278 HydrophobicContact CE1-CB 4.48Å; F275-M278 HydrophobicContact CE1-CE 3.22Å; F275-M278 HydrophobicContact CE1-CG 4.11Å; F275-M278 VanDerWaalsContact CE2-CA 3.44Å; F275-M278 HydrophobicContact CE2-CB 3.65Å; F275-M278 HydrophobicContact CE2-CG 3.92Å; F275-M278 HydrophobicContact CG-CB 4.33Å; F275-M278 HydrophobicContact CG-CE 4.18Å; F275-M278 HydrophobicContact CZ-CB 3.98Å; F275-M278 HydrophobicContact CZ-CE 3.85Å; F275-M278 HydrophobicContact CZ-CG 3.71Å; F275-M278 WeakPolarHBondContact O-CB 3.34Å; F275-M278 PolarHBondContact O-N 2.88Å; P276-M278 PolarHBondContact O-N 2.89Å; P276-M278 VanDerWaalsContact O-N 3.08Å; M278-Q280 VanDerWaalsContact C-N 3.31Å; M278-Q280 PolarHBondContact O-N 3.28Å; M278-A281 WeakPolarHBondContact O-CB 3.37Å; M278-A281 PolarHBondContact O-N 3.48Å; M278-L282 HydrophobicContact CG-CD1 4.06Å; M278-L282 HydrophobicContact CG-CG 4.26Å; M278-L282 VanDerWaalsContact O-CG 3.3Å; M278-L282 WeakPolarHBondContact O-CG 3.23Å; M278-L282 PolarHBondContact O-N 3.1Å
279K90Very high88.3Confident121 Ų12155.6 Ų55.653%0.52626%0.262SS..Hα-helixtrans-57.1-46.7178-69-179.2-179.2174.80111.4R277 A281 L282 Y283R277-K279 VanDerWaalsContact C-N 3.27Å; R277-K279 PolarHBondContact O-N 3.04Å; K279-A281 VanDerWaalsContact C-N 3.34Å; K279-L282 PolarHBondContact O-N 3.2Å; K279-Y283 WeakPolarHBondContact O-CD2 3.3Å; K279-Y283 PolarHBondContact O-N 2.77Å
280Q93.7Very high88.8Confident76 Ų7655.8 Ų55.836%0.35526%0.261SS..Hα-helixtrans-63.4-42.1178.7-63.886.5-23.500111.1F68 A69 R277 M278 L282 Y283 V284F68-Q280 WeakPolarHBondContact O-CB 3.22Å; A69-Q280 HydrophobicContact CB-CB 4.25Å; R277-Q280 VanDerWaalsContact C-OE1 3.23Å; R277-Q280 HydrophobicContact CB-CB 4.4Å; R277-Q280 WeakPolarHBondContact O-CB 3.18Å; R277-Q280 PolarHBondContact O-N 3.32Å; R277-Q280 PolarHBondContact O-OE1 3.01Å; R277-Q280 VanDerWaalsContact O-OE1 3.06Å; M278-Q280 VanDerWaalsContact C-N 3.31Å; M278-Q280 PolarHBondContact O-N 3.28Å; Q280-L282 PolarHBondContact O-N 3.42Å; Q280-Y283 PolarHBondContact O-N 3.38Å; Q280-V284 WeakPolarHBondContact O-CG2 3.48Å; Q280-V284 PolarHBondContact O-N 3.45Å
281A93.9Very high89.4Confident0 Ų054.3 Ų54.30%026%0.255CS..Hα-helixtrans-59.4-45.7176.200000111.9M65 A69 L71 L259 F275 R277 M278 K279 Y283 V284 D285M65-A281 HydrophobicContact CE-CB 3.94Å; M65-A281 WeakPolarHBondContact CE-O 3.18Å; M65-A281 HydrophobicContact SD-CB 3.78Å; A69-A281 HydrophobicContact CB-CB 3.96Å; L71-A281 HydrophobicContact CD1-CB 3.73Å; L259-A281 HydrophobicContact CD2-CB 4.35Å; F275-A281 HydrophobicContact CE2-CB 3.9Å; F275-A281 HydrophobicContact CZ-CB 4.42Å; R277-A281 PolarHBondContact O-N 2.6Å; M278-A281 WeakPolarHBondContact O-CB 3.37Å; M278-A281 PolarHBondContact O-N 3.48Å; K279-A281 VanDerWaalsContact C-N 3.34Å; A281-Y283 VanDerWaalsContact C-N 3.35Å; A281-Y283 PolarHBondContact O-N 3.47Å; A281-V284 PolarHBondContact O-N 2.87Å; A281-D285 VanDerWaalsContact O-CB 3.32Å; A281-D285 WeakPolarHBondContact O-CB 3.3Å; A281-D285 PolarHBondContact O-N 2.85Å
282L92.4Very high90.5Very high9 Ų944.4 Ų44.45%0.04721%0.209CC..Hα-helixtrans-64.8-37.4178-61.9175.7000112.2T115 R120 I124 L259 M278 K279 Q280 S286T115-L282 HydrophobicContact CG2-CB 3.86Å; R120-L282 HydrophobicContact CG-CD1 4.15Å; R120-L282 HydrophobicContact CG-CD2 4.35Å; R120-L282 PolarHBondContact NH1-O 3.02Å; I124-L282 HydrophobicContact CD1-CD1 4.48Å; I124-L282 HydrophobicContact CD1-CD2 4.19Å; L259-L282 HydrophobicContact CD1-CD2 4.06Å; M278-L282 HydrophobicContact CG-CD1 4.06Å; M278-L282 HydrophobicContact CG-CG 4.26Å; M278-L282 VanDerWaalsContact O-CG 3.3Å; M278-L282 WeakPolarHBondContact O-CG 3.23Å; M278-L282 PolarHBondContact O-N 3.1Å; K279-L282 PolarHBondContact O-N 3.2Å; Q280-L282 PolarHBondContact O-N 3.42Å; L282-S286 PolarHBondContact O-N 3.37Å; L282-S286 PolarHBondContact O-OG 3.38Å
283Y94Very high91.5Very high88 Ų8835.8 Ų35.835%0.34517%0.171SC..Hα-helixtrans-64.5-47.5173.9-88.8-71.1000112L112 T115 I116 K279 Q280 A281 D285 S286 I287L112-Y283 HydrophobicContact CD1-CD1 4.47Å; T115-Y283 HydrophobicContact CG2-CD1 4.09Å; T115-Y283 HydrophobicContact CG2-CD2 4.25Å; T115-Y283 HydrophobicContact CG2-CE1 4.25Å; T115-Y283 HydrophobicContact CG2-CE2 4.37Å; T115-Y283 HydrophobicContact CG2-CG 4.08Å; I116-Y283 HydrophobicContact CG1-CE1 3.8Å; K279-Y283 WeakPolarHBondContact O-CD2 3.3Å; K279-Y283 PolarHBondContact O-N 2.77Å; Q280-Y283 PolarHBondContact O-N 3.38Å; A281-Y283 VanDerWaalsContact C-N 3.35Å; A281-Y283 PolarHBondContact O-N 3.47Å; Y283-D285 VanDerWaalsContact C-N 3.3Å; Y283-D285 PolarHBondContact O-N 3.33Å; Y283-S286 PolarHBondContact O-N 2.97Å; Y283-I287 WeakPolarHBondContact O-CB 3.32Å; Y283-I287 VanDerWaalsContact O-CG1 3.22Å; Y283-I287 WeakPolarHBondContact O-CG1 3.45Å; Y283-I287 PolarHBondContact O-N 3.35Å
284V95.6Very high92.4Very high9 Ų939.9 Ų39.96%0.05519%0.187CC..Hα-helixtrans-58.4-46.9177.8168.30000110.4M64 M65 F68 L75 Q280 A281 I287 S288M64-V284 HydrophobicContact CB-CG1 3.67Å; M64-V284 HydrophobicContact CB-CG2 4.17Å; M65-V284 HydrophobicContact CB-CG1 4Å; M65-V284 HydrophobicContact CE-CB 4.19Å; M65-V284 HydrophobicContact CE-CG1 4.08Å; F68-V284 HydrophobicContact CB-CG2 3.9Å; L75-V284 HydrophobicContact CD2-CG1 4.16Å; Q280-V284 WeakPolarHBondContact O-CG2 3.48Å; Q280-V284 PolarHBondContact O-N 3.45Å; A281-V284 PolarHBondContact O-N 2.87Å; V284-I287 PolarHBondContact O-N 3.44Å; V284-S288 VanDerWaalsContact O-CB 3.22Å; V284-S288 WeakPolarHBondContact O-CB 3.32Å; V284-S288 PolarHBondContact O-N 3.37Å; V284-S288 PolarHBondContact O-OG 2.84Å
285D94.5Very high92.8Very high0 Ų036.2 Ų36.20%017%0.172CC..Hα-helixtrans-57.8-50.6178.3171.785.3000112.2R120 S255 A281 Y283 S288 S289R120-D285 IonicContact CZ-OD2 3.19Å; R120-D285 IonicContact NH1-OD2 2.73Å; R120-D285 PolarHBondContact NH1-OD2 3.38Å; R120-D285 IonicContact NH2-OD2 2.73Å; R120-D285 PolarHBondContact NH2-OD2 3.19Å; S255-D285 VanDerWaalsContact CB-OD1 3.29Å; S255-D285 WeakPolarHBondContact CB-OD1 3.48Å; S255-D285 PolarHBondContact OG-OD1 3.46Å; S255-D285 PolarHBondContact OG-OD2 3.01Å; A281-D285 VanDerWaalsContact O-CB 3.32Å; A281-D285 WeakPolarHBondContact O-CB 3.3Å; A281-D285 PolarHBondContact O-N 2.85Å; Y283-D285 VanDerWaalsContact C-N 3.3Å; Y283-D285 PolarHBondContact O-N 3.33Å; D285-S288 PolarHBondContact O-N 3.34Å; D285-S289 WeakPolarHBondContact O-CB 3.45Å; D285-S289 PolarHBondContact O-N 3.1Å; D285-S289 PolarHBondContact O-OG 2.95Å
286S94.2Very high92.6Very high0 Ų035.8 Ų35.80%017%0.17CC..Hα-helixtrans-66.4-41.6179.4-640000113.1T115 R120 L282 Y283 S288 S289 V290T115-S286 PolarHBondContact OG1-OG 3.44Å; T115-S286 VanDerWaalsContact OG1-OG 3.06Å; R120-S286 PolarHBondContact NH1-OG 3.06Å; L282-S286 PolarHBondContact O-N 3.37Å; L282-S286 PolarHBondContact O-OG 3.38Å; Y283-S286 PolarHBondContact O-N 2.97Å; S286-S288 VanDerWaalsContact C-N 3.33Å; S286-S288 PolarHBondContact O-N 3.39Å; S286-S289 WeakPolarHBondContact O-CB 3.37Å; S286-S289 PolarHBondContact O-N 3.4Å; S286-V290 WeakPolarHBondContact O-CG2 3.39Å; S286-V290 PolarHBondContact O-N 3.31Å
287I96Very high92.5Very high73 Ų7332.6 Ų32.637%0.37415%0.149SC..Hα-helixtrans-65.5-40.3177.5-67.7167.1000110.4F60 L112 Y283 V284 S289 V290 T291F60-I287 HydrophobicContact CE1-CG2 4.33Å; F60-I287 HydrophobicContact CZ-CG2 4.28Å; L112-I287 HydrophobicContact CD1-CG1 3.97Å; Y283-I287 WeakPolarHBondContact O-CB 3.32Å; Y283-I287 VanDerWaalsContact O-CG1 3.22Å; Y283-I287 WeakPolarHBondContact O-CG1 3.45Å; Y283-I287 PolarHBondContact O-N 3.35Å; V284-I287 PolarHBondContact O-N 3.44Å; I287-S289 VanDerWaalsContact C-N 3.33Å; I287-V290 PolarHBondContact O-N 2.93Å; I287-T291 WeakPolarHBondContact O-CB 3.42Å; I287-T291 PolarHBondContact O-N 3.3Å; I287-T291 PolarHBondContact O-OG1 3.49Å
288S96.5Very high92.3Very high1 Ų127.8 Ų27.81%0.00713%0.131CC..Hα-helixtrans-65-39.3176-55.30000111.1G61 V284 D285 S286 T291 G292G61-S288 VanDerWaalsContact CA-OG 3.3Å; G61-S288 WeakPolarHBondContact CA-OG 3.47Å; V284-S288 VanDerWaalsContact O-CB 3.22Å; V284-S288 WeakPolarHBondContact O-CB 3.32Å; V284-S288 PolarHBondContact O-N 3.37Å; V284-S288 PolarHBondContact O-OG 2.84Å; D285-S288 PolarHBondContact O-N 3.34Å; S286-S288 VanDerWaalsContact C-N 3.33Å; S286-S288 PolarHBondContact O-N 3.39Å; S288-T291 PolarHBondContact O-N 3.46Å; S288-G292 PolarHBondContact O-N 3.45Å
289S95.3Very high92.3Very high0 Ų027.2 Ų27.20%013%0.129CC..Hα-helixtrans-61.2-47.1173.5-79.80000113N251 D285 S286 I287 T291 G292 S293 V300N251-S289 PolarHBondContact ND2-OG 3.14Å; D285-S289 WeakPolarHBondContact O-CB 3.45Å; D285-S289 PolarHBondContact O-N 3.1Å; D285-S289 PolarHBondContact O-OG 2.95Å; S286-S289 WeakPolarHBondContact O-CB 3.37Å; S286-S289 PolarHBondContact O-N 3.4Å; I287-S289 VanDerWaalsContact C-N 3.33Å; S289-T291 VanDerWaalsContact C-N 3.35Å; S289-G292 PolarHBondContact O-N 2.63Å; S289-S293 WeakPolarHBondContact O-CB 3.45Å; S289-S293 PolarHBondContact O-N 3.38Å; S289-S293 PolarHBondContact O-OG 3.25Å; S289-V300 PolarHBondContact OG-N 3.42Å; S289-V300 PolarHBondContact OG-O 2.86Å
290V95.3Very high92.4Very high21 Ų2121.4 Ų21.413%0.12710%0.103CC..Hα-helixtrans-63.6-44.1177.5172.10000110.6F105 A108 I109 L112 S286 I287 S293 F294F105-V290 HydrophobicContact CD2-CG1 4.33Å; F105-V290 HydrophobicContact CE2-CG1 3.68Å; F105-V290 HydrophobicContact CZ-CG1 4.25Å; A108-V290 HydrophobicContact CB-CB 4.46Å; A108-V290 HydrophobicContact CB-CG2 3.79Å; A108-V290 WeakPolarHBondContact O-CG2 3.46Å; I109-V290 HydrophobicContact CD1-CB 4.4Å; I109-V290 HydrophobicContact CD1-CG1 3.62Å; I109-V290 HydrophobicContact CD1-CG2 3.78Å; I109-V290 HydrophobicContact CG1-CG1 4.35Å; I109-V290 HydrophobicContact CG1-CG2 4.17Å; L112-V290 HydrophobicContact CB-CG2 4.2Å; L112-V290 HydrophobicContact CD2-CG2 4.17Å; S286-V290 WeakPolarHBondContact O-CG2 3.39Å; S286-V290 PolarHBondContact O-N 3.31Å; I287-V290 PolarHBondContact O-N 2.93Å; V290-S293 WeakPolarHBondContact CA-OG 3.29Å; V290-S293 PolarHBondContact O-OG 3.46Å; V290-F294 WeakPolarHBondContact O-CB 3.48Å; V290-F294 PolarHBondContact O-N 3.44Å
291T95Very high92.4Very high44 Ų4418 Ų1827%0.279%0.087SC..Hα-helixtrans-65.8-43.2179.5-52.50000110.7I57 F60 I287 S288 S289 F294 I295I57-T291 HydrophobicContact CD1-CG2 3.8Å; F60-T291 HydrophobicContact CE1-CG2 4.36Å; I287-T291 WeakPolarHBondContact O-CB 3.42Å; I287-T291 PolarHBondContact O-N 3.3Å; I287-T291 PolarHBondContact O-OG1 3.49Å; S288-T291 PolarHBondContact O-N 3.46Å; S289-T291 VanDerWaalsContact C-N 3.35Å; T291-F294 PolarHBondContact O-N 2.96Å; T291-I295 WeakPolarHBondContact O-CG1 3.45Å; T291-I295 WeakPolarHBondContact O-CG2 3.48Å; T291-I295 PolarHBondContact O-N 3.35Å
292G93.4Very high92.4Very high0 Ų018 Ų180%09%0.088CC..Hα-helixtrans-60.9-53.6179.100000112.4S288 S289 F294 I295 G296 T297S288-G292 PolarHBondContact O-N 3.45Å; S289-G292 PolarHBondContact O-N 2.63Å; G292-F294 PolarHBondContact O-N 2.8Å; G292-I295 WeakPolarHBondContact O-CG1 3.41Å; G292-I295 PolarHBondContact O-N 2.76Å; G292-G296 PolarHBondContact O-N 2.87Å; G292-T297 CarbonylContact C-O 3.49Å; G292-T297 CarbonylContact O-C 3.59Å; G292-T297 WeakPolarHBondContact O-CG2 3.35Å; G292-T297 PolarHBondContact O-N 3.14Å
293S92.4Very high92.3Very high0 Ų018 Ų180%09%0.087CC..Hα-helixtrans-56.3-37.1175.253.10000113.3F105 V230 S289 V290 G296 T297F105-S293 WeakPolarHBondContact CA-OG 3.41Å; V230-S293 WeakPolarHBondContact CG2-O 3.22Å; S289-S293 WeakPolarHBondContact O-CB 3.45Å; S289-S293 PolarHBondContact O-N 3.38Å; S289-S293 PolarHBondContact O-OG 3.25Å; V290-S293 WeakPolarHBondContact CA-OG 3.29Å; V290-S293 PolarHBondContact O-OG 3.46Å; S293-G296 PolarHBondContact O-N 2.99Å; S293-T297 WeakPolarHBondContact CA-O 3.46Å; S293-T297 PolarHBondContact N-O 2.93Å
294F91.1Very high91.9Very high95 Ų9516.1 Ų16.142%0.4178%0.083SC..Hα-helixtrans-70.9-39.3177.3-172.6-103.7000113.8F105 V230 L232 V290 T291 G292 G296F105-F294 HydrophobicContact CD2-CB 3.87Å; F105-F294 HydrophobicContact CD2-CD2 4.24Å; F105-F294 HydrophobicContact CE2-CB 3.84Å; F105-F294 AromaticContact CE2-CD2 3.86Å; F105-F294 HydrophobicContact CE2-CD2 3.86Å; F105-F294 HydrophobicContact CE2-CG 4.24Å; F105-F294 HydrophobicContact CZ-CD2 4.48Å; V230-F294 WeakPolarHBondContact CG2-O 3.36Å; L232-F294 HydrophobicContact CD1-CE2 4.33Å; V290-F294 WeakPolarHBondContact O-CB 3.48Å; V290-F294 PolarHBondContact O-N 3.44Å; T291-F294 PolarHBondContact O-N 2.96Å; G292-F294 PolarHBondContact O-N 2.8Å; F294-G296 PolarHBondContact O-N 3.28Å
295I91.2Very high91.6Very high33 Ų3316.4 Ų16.417%0.1698%0.084CC..THydrogen-bonded Turntrans-84.712.4179.272.6175.8000112.9T53 I57 V227 T291 G292 T297T53-I295 WeakPolarHBondContact CG2-O 3.47Å; I57-I295 HydrophobicContact CB-CD1 4.16Å; I57-I295 HydrophobicContact CD1-CD1 4Å; V227-I295 HydrophobicContact CG2-CB 4.14Å; V227-I295 WeakPolarHBondContact CG2-O 3.35Å; T291-I295 WeakPolarHBondContact O-CG1 3.45Å; T291-I295 WeakPolarHBondContact O-CG2 3.48Å; T291-I295 PolarHBondContact O-N 3.35Å; G292-I295 WeakPolarHBondContact O-CG1 3.41Å; G292-I295 PolarHBondContact O-N 2.76Å; I295-T297 HydrophobicContact CD1-CG2 4.13Å; I295-T297 HydrophobicContact CG1-CG2 3.65Å
296G83.4Confident91.5Very high0 Ų016.4 Ų16.40%08%0.084CC..THydrogen-bonded Turntrans7534.4174.300000114.2M45 V226 G292 S293 F294M45-G296 VanDerWaalsContact CE-O 3.29Å; M45-G296 WeakPolarHBondContact CE-O 3.49Å; V226-G296 WeakPolarHBondContact CG1-O 3.02Å; G292-G296 PolarHBondContact O-N 2.87Å; S293-G296 PolarHBondContact O-N 2.99Å; F294-G296 PolarHBondContact O-N 3.28Å
297T85.5Confident91.2Very high0 Ų017.3 Ų17.30%09%0.09CC..SBendtrans-111.4162159135.20000107.6I57 P77 G292 S293 I295I57-T297 HydrophobicContact CB-CG2 4.04Å; I57-T297 HydrophobicContact CG2-CG2 3.74Å; P77-T297 VanDerWaalsContact CG-OG1 3.29Å; P77-T297 WeakPolarHBondContact CG-OG1 3.48Å; G292-T297 CarbonylContact C-O 3.49Å; G292-T297 CarbonylContact O-C 3.59Å; G292-T297 WeakPolarHBondContact O-CG2 3.35Å; G292-T297 PolarHBondContact O-N 3.14Å; S293-T297 WeakPolarHBondContact CA-O 3.46Å; S293-T297 PolarHBondContact N-O 2.93Å; I295-T297 HydrophobicContact CD1-CG2 4.13Å; I295-T297 HydrophobicContact CG1-CG2 3.65Å
298S84Confident90.9Very high0 Ų014.4 Ų14.40%08%0.076CC..  trans-64.3175169.667.70000112N82N82-S298 VanDerWaalsContact CG-OG 3.3Å; N82-S298 WeakPolarHBondContact OD1-CB 3.5Å; N82-S298 PolarHBondContact OD1-OG 3.27Å
299S90.1Very high90.6Very high1 Ų114.4 Ų14.41%0.0078%0.076CC..  trans-51.4142.4169.4-75.20000111.6A78 I104 N251A78-S299 VanDerWaalsContact CB-O 3.3Å; A78-S299 WeakPolarHBondContact CB-O 3.45Å; A78-S299 PolarHBondContact N-O 3.35Å; I104-S299 VanDerWaalsContact CG2-OG 3.24Å; I104-S299 WeakPolarHBondContact CG2-OG 3.5Å; N251-S299 WeakPolarHBondContact ND2-CB 3.27Å
300V93.9Very high90.5Very high0 Ų014.4 Ų14.40%08%0.076CC..EExtended strand (participates in β ladder)trans-96.9134.2-178173.20000109.3I57 L75 A76 S289I57-V300 HydrophobicContact CB-CG2 4.19Å; I57-V300 HydrophobicContact CD1-CG2 4.41Å; I57-V300 HydrophobicContact CG1-CG2 3.29Å; I57-V300 HydrophobicContact CG2-CG2 3.8Å; L75-V300 HydrophobicContact CB-CG1 3.67Å; L75-V300 HydrophobicContact CD2-CG1 4.14Å; L75-V300 HydrophobicContact CG-CG1 4.38Å; A76-V300 WeakPolarHBondContact O-CA 3.45Å; S289-V300 PolarHBondContact OG-N 3.42Å; S289-V300 PolarHBondContact OG-O 2.86Å
301T92.9Very high90.2Very high3 Ų316.9 Ų16.92%0.0189%0.094CC..EExtended strand (participates in β ladder)trans-127.2165.4-178.3-168.90000110.6L75 A76 A78 D254 S255 Y303L75-T301 VanDerWaalsContact CA-O 3.27Å; L75-T301 WeakPolarHBondContact CA-O 3.3Å; A76-T301 PolarHBondContact N-O 3.5Å; A76-T301 VanDerWaalsContact N-O 3.14Å; A76-T301 PolarHBondContact O-N 3.48Å; A78-T301 HydrophobicContact CB-CG2 3.39Å; D254-T301 PolarHBondContact OD2-OG1 3.38Å; S255-T301 WeakPolarHBondContact CA-OG1 3.46Å; S255-T301 WeakPolarHBondContact CB-OG1 3.46Å; S255-T301 PolarHBondContact N-OG1 3.41Å; T301-Y303 HydrophobicContact CG2-CD2 4.14Å; T301-Y303 HydrophobicContact CG2-CE2 3.99Å
302A92.7Very high90Very high2 Ų217.3 Ų17.32%0.01710%0.097CC..EExtended strand (participates in β ladder)trans-69139.4168.200000110.6V73 T258 L259V73-A302 HydrophobicContact CG1-CB 3.65Å; T258-A302 WeakPolarHBondContact CB-O 3.23Å; T258-A302 HydrophobicContact CG2-CB 4Å; T258-A302 WeakPolarHBondContact CG2-O 3.2Å; L259-A302 HydrophobicContact CD2-CB 4.01Å; L259-A302 HydrophobicContact CG-CB 3.76Å
303Y91.4Very high89.9Confident7 Ų718.4 Ų18.43%0.02711%0.108CC..  trans-100.7131.1-177.6-94.8-127.1000112.4M29 I32 A74 A76 P77 T258 T301 E305 S306M29-Y303 HydrophobicContact CB-CD1 3.81Å; M29-Y303 HydrophobicContact CB-CE1 4.32Å; M29-Y303 HydrophobicContact CE-CD1 3.55Å; M29-Y303 HydrophobicContact CE-CD2 4.32Å; M29-Y303 HydrophobicContact CE-CE1 4.06Å; M29-Y303 HydrophobicContact CE-CG 3.68Å; M29-Y303 HydrophobicContact SD-CD1 4.46Å; I32-Y303 HydrophobicContact CB-CE1 4.38Å; I32-Y303 WeakPolarHBondContact CD1-OH 3.19Å; I32-Y303 HydrophobicContact CG1-CE1 4.49Å; I32-Y303 WeakPolarHBondContact CG1-OH 3.41Å; A74-Y303 PolarHBondContact O-N 3.39Å; A76-Y303 VanDerWaalsContact C-CE2 3.49Å; A76-Y303 HydrophobicContact CB-CD1 4.42Å; A76-Y303 HydrophobicContact CB-CD2 3.83Å; A76-Y303 HydrophobicContact CB-CE1 4.01Å; A76-Y303 HydrophobicContact CB-CE2 3.41Å; A76-Y303 VanDerWaalsContact CB-CE2 3.41Å; A76-Y303 HydrophobicContact CB-CG 4.33Å; A76-Y303 VanDerWaalsContact CB-CZ 3.49Å; A76-Y303 VanDerWaalsContact O-CE2 3.31Å; A76-Y303 WeakPolarHBondContact O-CE2 3.24Å; P77-Y303 WeakPolarHBondContact O-CE2 3.3Å; P77-Y303 PolarHBondContact O-OH 3.37Å; T258-Y303 VanDerWaalsContact CG2-C 3.47Å; T301-Y303 HydrophobicContact CG2-CD2 4.14Å; T301-Y303 HydrophobicContact CG2-CE2 3.99Å; Y303-E305 WeakPolarHBondContact CB-OE2 2.93Å; Y303-E305 HydrophobicContact CD1-CG 4.44Å; Y303-E305 WeakPolarHBondContact CD1-OE2 3.43Å; Y303-E305 PolarHBondContact O-N 2.86Å; Y303-S306 WeakPolarHBondContact O-CB 3.25Å; Y303-S306 PolarHBondContact O-N 3.25Å; Y303-S306 VanDerWaalsContact O-N 3.14Å; Y303-S306 PolarHBondContact O-OG 2.79Å
304I85.3Confident89.9Confident50 Ų5018.4 Ų18.426%0.25611%0.108SC..THydrogen-bonded Turntrans-69.3-22.8-178.3-165.862.5000111.8T258 V262 S306 S307T258-I304 HydrophobicContact CG2-CB 4Å; T258-I304 HydrophobicContact CG2-CD1 4.23Å; T258-I304 VanDerWaalsContact CG2-N 3.34Å; V262-I304 HydrophobicContact CG2-CD1 4.09Å; I304-S306 PolarHBondContact O-N 3.28Å; I304-S307 WeakPolarHBondContact O-CB 3.49Å; I304-S307 PolarHBondContact O-N 3.02Å; I304-S307 PolarHBondContact O-OG 3.34Å
305E89.2Confident90.1Very high14 Ų1417.2 Ų17.27%0.06510%0.101CC..THydrogen-bonded Turntrans-55.8-28.1172.1-69.972.1-157.400111.7T28 M29 Y31 Y303 S307 S308T28-E305 PolarHBondContact OG1-O 3.27Å; M29-E305 HydrophobicContact CB-CB 3.83Å; M29-E305 HydrophobicContact CB-CG 3.93Å; Y31-E305 HydrophobicContact CE1-CG 4.22Å; Y31-E305 PolarHBondContact OH-OE1 3.37Å; Y31-E305 VanDerWaalsContact OH-OE1 3.05Å; Y303-E305 WeakPolarHBondContact CB-OE2 2.93Å; Y303-E305 HydrophobicContact CD1-CG 4.44Å; Y303-E305 WeakPolarHBondContact CD1-OE2 3.43Å; Y303-E305 PolarHBondContact O-N 2.86Å; E305-S307 PolarHBondContact O-N 2.5Å; E305-S308 VanDerWaalsContact O-CB 3.31Å; E305-S308 WeakPolarHBondContact O-CB 3.43Å; E305-S308 PolarHBondContact O-N 2.84Å; E305-S308 PolarHBondContact O-OG 3.06Å
306S93.3Very high90.2Very high0 Ų015.6 Ų15.60%09%0.093CC..Hα-helixtrans-55.7-24172.1-53.70000112.6A74 Y303 I304 S308 G309 V310A74-S306 PolarHBondContact N-OG 2.96Å; Y303-S306 WeakPolarHBondContact O-CB 3.25Å; Y303-S306 PolarHBondContact O-N 3.25Å; Y303-S306 VanDerWaalsContact O-N 3.14Å; Y303-S306 PolarHBondContact O-OG 2.79Å; I304-S306 PolarHBondContact O-N 3.28Å; S306-S308 PolarHBondContact O-N 3.5Å; S306-G309 PolarHBondContact O-N 3.37Å; S306-V310 WeakPolarHBondContact O-CG2 3.5Å; S306-V310 PolarHBondContact O-N 3.25Å
307S87.4Confident90.8Very high19 Ų1915.6 Ų15.613%0.1339%0.093CC..Hα-helixtrans-61.7-22.6174.171.50000113.8I304 E305 S311I304-S307 WeakPolarHBondContact O-CB 3.49Å; I304-S307 PolarHBondContact O-N 3.02Å; I304-S307 PolarHBondContact O-OG 3.34Å; E305-S307 PolarHBondContact O-N 2.5Å; S307-S311 WeakPolarHBondContact O-CB 3.49Å; S307-S311 PolarHBondContact O-N 3.04Å
308S88.8Confident91.3Very high13 Ų1316.3 Ų16.39%0.09110%0.096CC..Hα-helixtrans-72.1-47175.171.20000111.4T28 E305 S306 V310 S311 V312T28-S308 VanDerWaalsContact CG2-OG 3.31Å; T28-S308 WeakPolarHBondContact CG2-OG 3.42Å; T28-S308 PolarHBondContact OG1-OG 2.97Å; E305-S308 VanDerWaalsContact O-CB 3.31Å; E305-S308 WeakPolarHBondContact O-CB 3.43Å; E305-S308 PolarHBondContact O-N 2.84Å; E305-S308 PolarHBondContact O-OG 3.06Å; S306-S308 PolarHBondContact O-N 3.5Å; S308-V310 VanDerWaalsContact C-N 3.3Å; S308-V310 PolarHBondContact O-N 3.28Å; S308-S311 WeakPolarHBondContact O-CB 3.34Å; S308-S311 PolarHBondContact O-N 3.07Å; S308-S311 VanDerWaalsContact O-N 3.08Å; S308-S311 PolarHBondContact O-OG 3.26Å; S308-V312 PolarHBondContact O-N 2.84Å
309G91Very high91.9Very high0 Ų016.3 Ų16.30%010%0.096CC..Hα-helixtrans-63.7-39.4174.400000111.6A21 T25 S306 S311 V312 G313 G314A21-G309 VanDerWaalsContact CB-O 3.31Å; A21-G309 WeakPolarHBondContact CB-O 3.22Å; A21-G309 WeakPolarHBondContact O-CA 3.28Å; T25-G309 VanDerWaalsContact OG1-CA 3.25Å; T25-G309 WeakPolarHBondContact OG1-CA 3.14Å; T25-G309 PolarHBondContact OG1-N 3.28Å; S306-G309 PolarHBondContact O-N 3.37Å; G309-S311 VanDerWaalsContact C-N 3.28Å; G309-S311 PolarHBondContact O-N 2.84Å; G309-V312 WeakPolarHBondContact O-CG2 3.36Å; G309-V312 PolarHBondContact O-N 3.45Å; G309-G313 PolarHBondContact O-N 3Å; G309-G314 PolarHBondContact O-N 3.17Å
310V93Very high92.3Very high0 Ų016.3 Ų16.30%010%0.096CC..Hα-helixtrans-60.2-38.8172.4170.40000111.5P72 V262 A266 S306 S308 V312 G313 G314 R315P72-V310 HydrophobicContact CB-CG2 4.06Å; P72-V310 HydrophobicContact CG-CG2 3.73Å; V262-V310 HydrophobicContact CG1-CG2 3.93Å; A266-V310 HydrophobicContact CB-CB 4.47Å; A266-V310 HydrophobicContact CB-CG1 3.44Å; A266-V310 VanDerWaalsContact CB-CG1 3.44Å; A266-V310 HydrophobicContact CB-CG2 4.12Å; S306-V310 WeakPolarHBondContact O-CG2 3.5Å; S306-V310 PolarHBondContact O-N 3.25Å; S308-V310 VanDerWaalsContact C-N 3.3Å; S308-V310 PolarHBondContact O-N 3.28Å; V310-V312 VanDerWaalsContact C-N 3.26Å; V310-V312 PolarHBondContact O-N 3.28Å; V310-G313 PolarHBondContact O-N 3.32Å; V310-G313 VanDerWaalsContact O-N 3.12Å; V310-G314 WeakPolarHBondContact CA-O 3.41Å; V310-R315 PolarHBondContact O-NH1 3.37Å
311S89Confident92.5Very high73 Ų7317.3 Ų17.351%0.5110%0.102SC..Hα-helixtrans-65.8-26.5180750000113.9S307 S308 G309 G313S307-S311 WeakPolarHBondContact O-CB 3.49Å; S307-S311 PolarHBondContact O-N 3.04Å; S308-S311 WeakPolarHBondContact O-CB 3.34Å; S308-S311 PolarHBondContact O-N 3.07Å; S308-S311 VanDerWaalsContact O-N 3.08Å; S308-S311 PolarHBondContact O-OG 3.26Å; G309-S311 VanDerWaalsContact C-N 3.28Å; G309-S311 PolarHBondContact O-N 2.84Å; S311-G313 VanDerWaalsContact C-N 3.35Å
312V90.7Very high92.7Very high54 Ų5418 Ų1833%0.32711%0.106SC..THydrogen-bonded Turntrans-94.612.5176-59.30000113.4A21 T24 H191 S308 G309 V310A21-V312 HydrophobicContact CB-CG2 4.03Å; T24-V312 HydrophobicContact CG2-CG2 4.13Å; H191-V312 WeakPolarHBondContact NE2-CG1 3.34Å; S308-V312 PolarHBondContact O-N 2.84Å; G309-V312 WeakPolarHBondContact O-CG2 3.36Å; G309-V312 PolarHBondContact O-N 3.45Å; V310-V312 VanDerWaalsContact C-N 3.26Å; V310-V312 PolarHBondContact O-N 3.28Å
313G91.3Very high92.9Very high22 Ų2217.9 Ų17.923%0.22711%0.105CC..THydrogen-bonded Turntrans106.15.7171.800000115.8G309 V310 S311 R315G309-G313 PolarHBondContact O-N 3Å; V310-G313 PolarHBondContact O-N 3.32Å; V310-G313 VanDerWaalsContact O-N 3.12Å; S311-G313 VanDerWaalsContact C-N 3.35Å; G313-R315 PolarHBondContact O-N 3.46Å
314G93.4Very high93.2Very high0 Ų017.5 Ų17.50%010%0.104CC..  trans-62.7124.7172.300000111.4A21 G309 V310A21-G314 VanDerWaalsContact CB-CA 3.48Å; G309-G314 PolarHBondContact O-N 3.17Å; V310-G314 WeakPolarHBondContact CA-O 3.41Å
315R94Very high93.8Very high70 Ų7019.4 Ų19.426%0.26411%0.114SC..  trans-133.9-12.6-176.8-68.6-65.6178.9-85.24.4113.9H11 T13 E18 A266 V310 G313H11-R315 HydrophobicContact CB-CB 4.03Å; T13-R315 HydrophobicContact CG2-CB 4.43Å; E18-R315 PolarHBondContact OE1-N 3.02Å; A266-R315 WeakPolarHBondContact O-CD 3.4Å; A266-R315 PolarHBondContact O-NE 2.88Å; V310-R315 PolarHBondContact O-NH1 3.37Å; G313-R315 PolarHBondContact O-N 3.46Å
316T94.8Very high94.2Very high0 Ų019.6 Ų19.60%012%0.116CC..SBendtrans-125.9173.8-173.173.90000112.6F6 L8 H11 T13 E18 N70 P72 L318 T319F6-T316 WeakPolarHBondContact O-CG2 3.19Å; L8-T316 HydrophobicContact CD2-CG2 4.04Å; L8-T316 WeakPolarHBondContact CD2-OG1 3.36Å; H11-T316 HydrophobicContact CB-CG2 3.6Å; T13-T316 HydrophobicContact CG2-CG2 3.7Å; E18-T316 PolarHBondContact OE1-N 3.21Å; E18-T316 PolarHBondContact OE2-N 3.15Å; E18-T316 VanDerWaalsContact OE2-N 3.08Å; E18-T316 VanDerWaalsContact OE2-O 3.1Å; E18-T316 PolarHBondContact OE2-OG1 3Å; N70-T316 WeakPolarHBondContact OD1-CB 3.4Å; P72-T316 VanDerWaalsContact CA-O 3.3Å; P72-T316 WeakPolarHBondContact CA-O 3.4Å; P72-T316 WeakPolarHBondContact CB-O 3.49Å; T316-L318 PolarHBondContact O-N 3.2Å; T316-L318 PolarHBondContact OG1-N 2.93Å; T316-T319 WeakPolarHBondContact O-CB 3.39Å; T316-T319 PolarHBondContact O-N 2.95Å
317G94.9Very high94.4Very high0 Ų019.6 Ų19.60%012%0.116CC..Hα-helixtrans-63.5-16.9175.400000114.8G66 N70 L71 T319 A320 V321G66-G317 VanDerWaalsContact CA-CA 3.42Å; G66-G317 VanDerWaalsContact CA-O 3.24Å; G66-G317 WeakPolarHBondContact CA-O 3.32Å; G66-G317 WeakPolarHBondContact O-CA 3.35Å; N70-G317 VanDerWaalsContact C-N 3.31Å; N70-G317 PolarHBondContact O-N 2.87Å; N70-G317 PolarHBondContact OD1-N 3.46Å; L71-G317 WeakPolarHBondContact O-CA 3.41Å; G317-T319 PolarHBondContact O-N 3.33Å; G317-A320 PolarHBondContact O-N 3.32Å; G317-A320 VanDerWaalsContact O-N 3.11Å; G317-V321 WeakPolarHBondContact O-CG2 3.28Å; G317-V321 PolarHBondContact O-N 2.99Å
318L96.3Very high94.8Very high14 Ų1421.8 Ų21.87%0.07313%0.126CC..Hα-helixtrans-61-38.3176.5-178.757.5000111L2 F6 L8 A15 E18 T316 A320 V321 V322L2-L318 HydrophobicContact CD1-CD2 4.48Å; L2-L318 HydrophobicContact CD2-CD1 4.05Å; L2-L318 HydrophobicContact CD2-CD2 4.39Å; F6-L318 HydrophobicContact CD1-CB 4.31Å; F6-L318 HydrophobicContact CD2-CB 4.01Å; F6-L318 HydrophobicContact CD2-CD1 4.46Å; F6-L318 HydrophobicContact CE1-CB 4.5Å; F6-L318 HydrophobicContact CE2-CB 4.22Å; F6-L318 HydrophobicContact CE2-CD1 4.04Å; F6-L318 HydrophobicContact CG-CB 4.06Å; F6-L318 HydrophobicContact CZ-CB 4.45Å; F6-L318 HydrophobicContact CZ-CD1 4.47Å; L8-L318 HydrophobicContact CD2-CD2 4.3Å; A15-L318 HydrophobicContact CB-CD2 4.24Å; E18-L318 HydrophobicContact CB-CB 3.88Å; E18-L318 HydrophobicContact CB-CD2 3.67Å; E18-L318 HydrophobicContact CB-CG 3.77Å; E18-L318 HydrophobicContact CG-CB 4.11Å; E18-L318 HydrophobicContact CG-CD2 4.16Å; E18-L318 HydrophobicContact CG-CG 4.43Å; T316-L318 PolarHBondContact O-N 3.2Å; T316-L318 PolarHBondContact OG1-N 2.93Å; L318-A320 VanDerWaalsContact C-N 3.35Å; L318-A320 PolarHBondContact O-N 3.27Å; L318-V321 PolarHBondContact O-N 3.04Å; L318-V322 HydrophobicContact CD1-CG2 4.31Å; L318-V322 VanDerWaalsContact O-CG2 3.28Å; L318-V322 WeakPolarHBondContact O-CG2 3.38Å; L318-V322 PolarHBondContact O-N 3.22Å
319T96.9Very high95Very high1 Ų126.4 Ų26.41%0.00615%0.148CC..Hα-helixtrans-53.3-50.7171.4-64.20000111.2E18 A21 P72 T316 G317 V322 V323E18-T319 PolarHBondContact O-OG1 3.4Å; E18-T319 PolarHBondContact OE2-N 3.34Å; E18-T319 PolarHBondContact OE2-OG1 3.38Å; A21-T319 HydrophobicContact CB-CG2 3.98Å; P72-T319 HydrophobicContact CB-CG2 4.1Å; T316-T319 WeakPolarHBondContact O-CB 3.39Å; T316-T319 PolarHBondContact O-N 2.95Å; G317-T319 PolarHBondContact O-N 3.33Å; T319-V322 PolarHBondContact O-N 3.33Å; T319-V323 WeakPolarHBondContact O-CG2 3.38Å; T319-V323 PolarHBondContact O-N 2.93Å; T319-V323 VanDerWaalsContact O-N 3.12Å
320A97.3Very high95.1Very high1 Ų127 Ų271%0.00815%0.152CC..Hα-helixtrans-68.4-36.7-178.700000112.9S62 V73 G317 L318 V323 G324S62-A320 WeakPolarHBondContact CB-O 3.46Å; S62-A320 WeakPolarHBondContact O-CB 3.39Å; V73-A320 WeakPolarHBondContact O-CB 3.45Å; G317-A320 PolarHBondContact O-N 3.32Å; G317-A320 VanDerWaalsContact O-N 3.11Å; L318-A320 VanDerWaalsContact C-N 3.35Å; L318-A320 PolarHBondContact O-N 3.27Å; A320-V323 PolarHBondContact O-N 3.02Å; A320-G324 PolarHBondContact O-N 3.46Å
321V97.8Very high95.1Very high20 Ų2027.6 Ų27.612%0.12116%0.155CC..Hα-helixtrans-62.7-43.8174173.70000111F6 L67 G317 L318 V323 G324 L325F6-V321 HydrophobicContact CE1-CG2 4.18Å; F6-V321 HydrophobicContact CZ-CG2 3.95Å; L67-V321 HydrophobicContact CD2-CG2 4.14Å; L67-V321 HydrophobicContact CG-CG2 4.16Å; G317-V321 WeakPolarHBondContact O-CG2 3.28Å; G317-V321 PolarHBondContact O-N 2.99Å; L318-V321 PolarHBondContact O-N 3.04Å; V321-V323 VanDerWaalsContact C-N 3.34Å; V321-V323 PolarHBondContact O-N 3.16Å; V321-G324 PolarHBondContact O-N 3.5Å; V321-L325 HydrophobicContact CG1-CD1 4.09Å; V321-L325 HydrophobicContact CG1-CG 4.34Å; V321-L325 WeakPolarHBondContact O-CG 3.42Å; V321-L325 PolarHBondContact O-N 3.31Å
322V97.8Very high95.2Very high17 Ų1729.3 Ų29.310%0.10315%0.154CC..Hα-helixtrans-60.4-45.2177.5170.70000110.6V19 F23 L318 T319 G324 L325 L326V19-V322 HydrophobicContact CG2-CG2 4.03Å; F23-V322 HydrophobicContact CD2-CG1 4.25Å; F23-V322 HydrophobicContact CE2-CG1 4.49Å; L318-V322 HydrophobicContact CD1-CG2 4.31Å; L318-V322 VanDerWaalsContact O-CG2 3.28Å; L318-V322 WeakPolarHBondContact O-CG2 3.38Å; L318-V322 PolarHBondContact O-N 3.22Å; T319-V322 PolarHBondContact O-N 3.33Å; V322-G324 VanDerWaalsContact C-N 3.32Å; V322-G324 PolarHBondContact O-N 3.4Å; V322-L325 PolarHBondContact O-N 2.94Å; V322-L326 HydrophobicContact CG1-CD1 4.01Å; V322-L326 HydrophobicContact CG1-CG 4.46Å; V322-L326 VanDerWaalsContact O-CG 3.3Å; V322-L326 WeakPolarHBondContact O-CG 3.47Å; V322-L326 PolarHBondContact O-N 3.44Å
323V98Very high95.1Very high0 Ų029.9 Ų29.90%015%0.154CC..Hα-helixtrans-56.8-47.5175.1175.70000111G22 T25 F26 M29 A74 T319 A320 V321 L325 L326 F327G22-V323 VanDerWaalsContact O-CG2 3.22Å; G22-V323 WeakPolarHBondContact O-CG2 3.3Å; T25-V323 HydrophobicContact CG2-CG2 3.72Å; F26-V323 HydrophobicContact CB-CG1 4.41Å; F26-V323 HydrophobicContact CB-CG2 4.36Å; M29-V323 HydrophobicContact SD-CG1 3.82Å; A74-V323 HydrophobicContact CB-CB 4.21Å; A74-V323 HydrophobicContact CB-CG1 3.72Å; A74-V323 HydrophobicContact CB-CG2 4.29Å; T319-V323 WeakPolarHBondContact O-CG2 3.38Å; T319-V323 PolarHBondContact O-N 2.93Å; T319-V323 VanDerWaalsContact O-N 3.12Å; A320-V323 PolarHBondContact O-N 3.02Å; V321-V323 VanDerWaalsContact C-N 3.34Å; V321-V323 PolarHBondContact O-N 3.16Å; V323-L325 PolarHBondContact O-N 3.28Å; V323-L326 PolarHBondContact O-N 3.39Å; V323-F327 HydrophobicContact CG1-CD2 3.79Å; V323-F327 HydrophobicContact CG1-CE2 3.69Å; V323-F327 WeakPolarHBondContact O-CD2 3.49Å; V323-F327 PolarHBondContact O-N 3.35Å
324G97.7Very high94.8Very high0 Ų029.3 Ų29.30%015%0.147CC..Hα-helixtrans-65.6-37.1-179.100000113.6A59 A320 V321 V322 F327 L328A59-G324 WeakPolarHBondContact CB-O 3.5Å; A320-G324 PolarHBondContact O-N 3.46Å; V321-G324 PolarHBondContact O-N 3.5Å; V322-G324 VanDerWaalsContact C-N 3.32Å; V322-G324 PolarHBondContact O-N 3.4Å; G324-F327 PolarHBondContact O-N 2.91Å; G324-L328 PolarHBondContact O-N 3.25Å
325L97.7Very high94.2Very high90 Ų9030 Ų3047%0.47115%0.152SC..Hα-helixtrans-64-40172.4-69.2174.1000111.9I63 V321 V322 V323 F327 L328 L329I63-L325 HydrophobicContact CD1-CD2 4.44Å; V321-L325 HydrophobicContact CG1-CD1 4.09Å; V321-L325 HydrophobicContact CG1-CG 4.34Å; V321-L325 WeakPolarHBondContact O-CG 3.42Å; V321-L325 PolarHBondContact O-N 3.31Å; V322-L325 PolarHBondContact O-N 2.94Å; V323-L325 PolarHBondContact O-N 3.28Å; L325-F327 VanDerWaalsContact C-N 3.35Å; L325-F327 PolarHBondContact O-N 2.92Å; L325-L328 HydrophobicContact CD2-CD1 4.44Å; L325-L328 WeakPolarHBondContact O-CB 3.37Å; L325-L328 PolarHBondContact O-N 2.96Å; L325-L329 WeakPolarHBondContact O-CG 3.36Å; L325-L329 PolarHBondContact O-N 3.25Å
326L97.3Very high93.7Very high18 Ų1829.6 Ų29.69%0.09416%0.155CC..Hα-helixtrans-63.7-39.5176-68.8169.9000111.6F23 F26 V322 V323 L328 L329 V330F23-L326 HydrophobicContact CD1-CD1 3.88Å; F23-L326 HydrophobicContact CD1-CD2 4.36Å; F23-L326 HydrophobicContact CD2-CD1 4.21Å; F23-L326 HydrophobicContact CE1-CD1 4.04Å; F23-L326 HydrophobicContact CE1-CD2 3.69Å; F23-L326 HydrophobicContact CE2-CD1 4.35Å; F23-L326 HydrophobicContact CE2-CD2 4.36Å; F23-L326 HydrophobicContact CG-CD1 3.99Å; F23-L326 HydrophobicContact CZ-CD1 4.28Å; F23-L326 HydrophobicContact CZ-CD2 3.69Å; F26-L326 HydrophobicContact CB-CB 4.38Å; F26-L326 HydrophobicContact CB-CD1 3.61Å; F26-L326 HydrophobicContact CD1-CB 4.15Å; F26-L326 HydrophobicContact CD1-CD1 3.83Å; F26-L326 HydrophobicContact CD1-CG 4.5Å; F26-L326 HydrophobicContact CD2-CB 3.5Å; F26-L326 VanDerWaalsContact CD2-CB 3.5Å; F26-L326 HydrophobicContact CD2-CD1 4.28Å; F26-L326 HydrophobicContact CE1-CB 4.33Å; F26-L326 HydrophobicContact CE2-CB 3.71Å; F26-L326 HydrophobicContact CG-CB 3.73Å; F26-L326 HydrophobicContact CG-CD1 3.63Å; F26-L326 HydrophobicContact CG-CG 4.3Å; F26-L326 HydrophobicContact CZ-CB 4.12Å; V322-L326 HydrophobicContact CG1-CD1 4.01Å; V322-L326 HydrophobicContact CG1-CG 4.46Å; V322-L326 VanDerWaalsContact O-CG 3.3Å; V322-L326 WeakPolarHBondContact O-CG 3.47Å; V322-L326 PolarHBondContact O-N 3.44Å; V323-L326 PolarHBondContact O-N 3.39Å; L326-L328 VanDerWaalsContact C-N 3.32Å; L326-L328 PolarHBondContact O-N 2.97Å; L326-L329 HydrophobicContact CD2-CD1 4.32Å; L326-L329 WeakPolarHBondContact O-CB 3.48Å; L326-L329 PolarHBondContact O-N 3.39Å; L326-L329 VanDerWaalsContact O-N 3.12Å; L326-V330 WeakPolarHBondContact O-CG2 3.45Å; L326-V330 PolarHBondContact O-N 2.86Å
327F96.6Very high93Very high0 Ų030.4 Ų30.40%016%0.161CC..Hα-helixtrans-62.4-35.5173.2-87.3-70.7000113.3F26 M29 I32 V33 A58 A59 V323 G324 L325 L329 V330F26-F327 HydrophobicContact CD2-CD2 4.16Å; F26-F327 HydrophobicContact CD2-CE2 4.13Å; F26-F327 HydrophobicContact CD2-CZ 4.47Å; F26-F327 HydrophobicContact CE2-CD1 4.38Å; F26-F327 HydrophobicContact CE2-CD2 4.44Å; F26-F327 HydrophobicContact CE2-CG 4.35Å; M29-F327 HydrophobicContact CE-CE2 3.78Å; M29-F327 HydrophobicContact CE-CZ 3.97Å; M29-F327 HydrophobicContact CG-CE2 3.96Å; M29-F327 HydrophobicContact CG-CZ 3.92Å; M29-F327 HydrophobicContact SD-CE2 3.91Å; M29-F327 HydrophobicContact SD-CZ 4.35Å; I32-F327 HydrophobicContact CG2-CE1 3.74Å; I32-F327 HydrophobicContact CG2-CZ 3.79Å; V33-F327 HydrophobicContact CG1-CD1 3.99Å; V33-F327 HydrophobicContact CG1-CE1 3.59Å; A58-F327 HydrophobicContact CB-CB 4.39Å; A58-F327 HydrophobicContact CB-CD1 4.03Å; A58-F327 HydrophobicContact CB-CD2 3.85Å; A58-F327 HydrophobicContact CB-CE1 4.22Å; A58-F327 HydrophobicContact CB-CE2 4.06Å; A58-F327 HydrophobicContact CB-CG 3.83Å; A58-F327 HydrophobicContact CB-CZ 4.24Å; A59-F327 HydrophobicContact CB-CB 4.28Å; V323-F327 HydrophobicContact CG1-CD2 3.79Å; V323-F327 HydrophobicContact CG1-CE2 3.69Å; V323-F327 WeakPolarHBondContact O-CD2 3.49Å; V323-F327 PolarHBondContact O-N 3.35Å; G324-F327 PolarHBondContact O-N 2.91Å; L325-F327 VanDerWaalsContact C-N 3.35Å; L325-F327 PolarHBondContact O-N 2.92Å; F327-L329 VanDerWaalsContact C-N 3.31Å; F327-L329 PolarHBondContact O-N 3.47Å; F327-V330 PolarHBondContact O-N 3.36Å
328L95.6Very high92.2Very high65 Ų6533 Ų3334%0.3419%0.188SC..Hα-helixtrans-63.7-37.6172.6-67.2176000112L56 A59 I63 G324 L325 L326 V330 I331L56-L328 HydrophobicContact CD2-CD2 4.14Å; A59-L328 HydrophobicContact CB-CD1 4.36Å; A59-L328 HydrophobicContact CB-CD2 3.54Å; A59-L328 HydrophobicContact CB-CG 3.58Å; I63-L328 HydrophobicContact CD1-CD1 4.41Å; G324-L328 PolarHBondContact O-N 3.25Å; L325-L328 HydrophobicContact CD2-CD1 4.44Å; L325-L328 WeakPolarHBondContact O-CB 3.37Å; L325-L328 PolarHBondContact O-N 2.96Å; L326-L328 VanDerWaalsContact C-N 3.32Å; L326-L328 PolarHBondContact O-N 2.97Å; L328-V330 VanDerWaalsContact C-N 3.34Å; L328-I331 HydrophobicContact CD2-CD1 4.11Å; L328-I331 WeakPolarHBondContact O-CB 3.33Å; L328-I331 WeakPolarHBondContact O-CG1 3.41Å; L328-I331 PolarHBondContact O-N 3.47Å
329L93.8Very high91.6Very high109 Ų10933.6 Ų33.657%0.57119%0.19SC*.Hα-helixtrans-68.6-33.6177.1-64.9174.4000112.2L325 L326 F327 I331 F332L325-L329 WeakPolarHBondContact O-CG 3.36Å; L325-L329 PolarHBondContact O-N 3.25Å; L326-L329 HydrophobicContact CD2-CD1 4.32Å; L326-L329 WeakPolarHBondContact O-CB 3.48Å; L326-L329 PolarHBondContact O-N 3.39Å; L326-L329 VanDerWaalsContact O-N 3.12Å; F327-L329 VanDerWaalsContact C-N 3.31Å; F327-L329 PolarHBondContact O-N 3.47Å; L329-I331 PolarHBondContact O-N 3.17Å; L329-F332 PolarHBondContact O-N 2.89Å
330V93.1Very high91.2Very high13 Ų1334.3 Ų34.38%0.07920%0.195CC..Hα-helixtrans-62.7-24.6177.7172.40000112.6F26 V30 V33 F51 L326 F327 L328 F332 L333F26-V330 HydrophobicContact CE2-CG2 3.68Å; F26-V330 HydrophobicContact CZ-CG2 3.37Å; V30-V330 HydrophobicContact CG2-CG2 4.34Å; V33-V330 HydrophobicContact CB-CG1 4.48Å; V33-V330 HydrophobicContact CG1-CG1 4.08Å; V33-V330 HydrophobicContact CG2-CG1 4.29Å; F51-V330 HydrophobicContact CE2-CG1 4.08Å; F51-V330 HydrophobicContact CZ-CG1 3.77Å; F51-V330 WeakPolarHBondContact CZ-O 3.19Å; L326-V330 WeakPolarHBondContact O-CG2 3.45Å; L326-V330 PolarHBondContact O-N 2.86Å; F327-V330 PolarHBondContact O-N 3.36Å; L328-V330 VanDerWaalsContact C-N 3.34Å; V330-F332 PolarHBondContact O-N 2.96Å; V330-F332 VanDerWaalsContact O-N 3.12Å; V330-L333 WeakPolarHBondContact O-CA 3.5Å; V330-L333 WeakPolarHBondContact O-CB 3.22Å; V330-L333 PolarHBondContact O-N 3.31Å
331I92.3Very high90.7Very high12 Ų1235.3 Ų35.36%0.06220%0.201CC..G310 helixtrans-55.9-35.2-179.9-57.7176.5000111.6V52 C55 L56 P220 L328 L329 L333 S334V52-I331 HydrophobicContact CG1-CG2 4.03Å; V52-I331 HydrophobicContact CG2-CG2 4.25Å; C55-I331 HydrophobicContact CB-CD1 4.11Å; C55-I331 HydrophobicContact CB-CG1 3.49Å; C55-I331 VanDerWaalsContact CB-CG1 3.49Å; L56-I331 HydrophobicContact CD2-CD1 3.6Å; L56-I331 HydrophobicContact CG-CD1 3.98Å; P220-I331 HydrophobicContact CB-CG2 3.52Å; P220-I331 HydrophobicContact CG-CG2 3.6Å; L328-I331 HydrophobicContact CD2-CD1 4.11Å; L328-I331 WeakPolarHBondContact O-CB 3.33Å; L328-I331 WeakPolarHBondContact O-CG1 3.41Å; L328-I331 PolarHBondContact O-N 3.47Å; L329-I331 PolarHBondContact O-N 3.17Å; I331-L333 PolarHBondContact O-N 2.89Å; I331-S334 PolarHBondContact O-N 3.22Å
332F91.1Very high90Very high110 Ų11035.9 Ų35.948%0.48221%0.211SC..G310 helixtrans-72.3-10.8178.4-61.8-78.3000113.8V217 S218 P220 L329 V330V217-F332 VanDerWaalsContact CA-O 3.32Å; V217-F332 WeakPolarHBondContact CA-O 3.31Å; V217-F332 HydrophobicContact CG1-CB 4.46Å; S218-F332 PolarHBondContact N-O 2.86Å; S218-F332 VanDerWaalsContact N-O 3.14Å; P220-F332 HydrophobicContact CG-CE1 4.32Å; L329-F332 PolarHBondContact O-N 2.89Å; V330-F332 PolarHBondContact O-N 2.96Å; V330-F332 VanDerWaalsContact O-N 3.12Å
333L88.9Confident89.5Confident65 Ų6535.9 Ų35.934%0.3421%0.21SC..G310 helixtrans-97.819.3176.8-59.4174.2000112.2I216 V217 V330 I331 P335 L336I216-L333 HydrophobicContact CG2-CD2 4.33Å; V217-L333 HydrophobicContact CG2-CD2 4.3Å; V330-L333 WeakPolarHBondContact O-CA 3.5Å; V330-L333 WeakPolarHBondContact O-CB 3.22Å; V330-L333 PolarHBondContact O-N 3.31Å; I331-L333 PolarHBondContact O-N 2.89Å; L333-P335 VanDerWaalsContact C-N 3.3Å; L333-L336 HydrophobicContact CB-CD1 4.24Å; L333-L336 HydrophobicContact CD2-CD1 4.15Å; L333-L336 WeakPolarHBondContact O-CB 3.18Å; L333-L336 PolarHBondContact O-N 2.98Å
334S84.5Confident89Confident11 Ų1135.9 Ų35.98%0.07721%0.21CC..Hα-helixtrans-50.8-35.9179.752.10000115.7F51 S218 P221 I331 L336 A337 G338F51-S334 VanDerWaalsContact CE1-CA 3.41Å; F51-S334 VanDerWaalsContact CE1-CB 3.48Å; S218-S334 PolarHBondContact OG-OG 3.32Å; P221-S334 VanDerWaalsContact CD-OG 3.3Å; P221-S334 WeakPolarHBondContact CD-OG 3.3Å; I331-S334 PolarHBondContact O-N 3.22Å; S334-L336 PolarHBondContact O-N 2.85Å; S334-A337 PolarHBondContact O-N 3.21Å; S334-A337 VanDerWaalsContact O-N 3.1Å; S334-G338 PolarHBondContact O-N 3.3Å
335P82.5Confident88.5Confident15 Ų1535.9 Ų35.910%0.09721%0.21CC..Hα-helixtrans-62.1-34.2178.8-23.236.4000113N214 G215 S218 L333 A337 G338 M339N214-P335 WeakPolarHBondContact O-CB 3.32Å; G215-P335 WeakPolarHBondContact O-CB 3.44Å; S218-P335 WeakPolarHBondContact OG-CD 3.22Å; S218-P335 VanDerWaalsContact OG-CG 3.3Å; S218-P335 WeakPolarHBondContact OG-CG 3.2Å; L333-P335 VanDerWaalsContact C-N 3.3Å; P335-A337 VanDerWaalsContact C-N 3.26Å; P335-A337 PolarHBondContact O-N 3.25Å; P335-G338 PolarHBondContact O-N 3.43Å; P335-M339 WeakPolarHBondContact O-CG 3.32Å; P335-M339 PolarHBondContact O-N 3.46Å
336L83.3Confident88.1Confident61 Ų6131.6 Ų31.632%0.31919%0.187SC..Hα-helixtrans-65.4-32.7177.8-63.5179.8000111.6I216 L333 S334 M339I216-L336 HydrophobicContact CG1-CD2 4.33Å; I216-L336 HydrophobicContact CG2-CD1 4.31Å; L333-L336 HydrophobicContact CB-CD1 4.24Å; L333-L336 HydrophobicContact CD2-CD1 4.15Å; L333-L336 WeakPolarHBondContact O-CB 3.18Å; L333-L336 PolarHBondContact O-N 2.98Å; S334-L336 PolarHBondContact O-N 2.85Å; L336-M339 HydrophobicContact CD2-SD 4.32Å; L336-M339 WeakPolarHBondContact O-CB 3.4Å; L336-M339 PolarHBondContact O-N 3.39Å
337A79Confident87.9Confident16 Ų1630.8 Ų30.813%0.13218%0.183CC..Hα-helixtrans-69.1-36.617900000113F34 F51 S334 P335 M339 V340F34-A337 HydrophobicContact CD1-CB 3.97Å; F34-A337 HydrophobicContact CE1-CB 4.02Å; F51-A337 HydrophobicContact CD2-CB 3.23Å; F51-A337 HydrophobicContact CE2-CB 3.33Å; F51-A337 HydrophobicContact CG-CB 4.01Å; F51-A337 HydrophobicContact CZ-CB 4.18Å; S334-A337 PolarHBondContact O-N 3.21Å; S334-A337 VanDerWaalsContact O-N 3.1Å; P335-A337 VanDerWaalsContact C-N 3.26Å; P335-A337 PolarHBondContact O-N 3.25Å; A337-M339 PolarHBondContact O-N 3.18Å; A337-V340 PolarHBondContact O-N 3.49Å
338G78.6Confident87.5Confident55 Ų5530.8 Ų30.857%0.56718%0.183SC*.Hα-helixtrans-68.1-15.2174.300000114.1S334 P335S334-G338 PolarHBondContact O-N 3.3Å; P335-G338 PolarHBondContact O-N 3.43Å
339M84.9Confident87.2Confident26 Ų2627.9 Ų27.913%0.12817%0.168CC..THydrogen-bonded Turntrans-85.5-16.6178.7-67179.95300113.7T202 V211 H212 Y213 N214 P335 L336 A337 P341T202-M339 WeakPolarHBondContact CG2-O 3.23Å; V211-M339 HydrophobicContact CG1-CB 4.03Å; V211-M339 HydrophobicContact CG1-CE 4.11Å; V211-M339 WeakPolarHBondContact CG1-O 3.44Å; H212-M339 WeakPolarHBondContact O-CG 3.49Å; Y213-M339 HydrophobicContact CD2-CE 3.83Å; Y213-M339 HydrophobicContact CD2-SD 3.92Å; Y213-M339 HydrophobicContact CE2-SD 4.49Å; N214-M339 HydrophobicContact CB-CG 4.2Å; P335-M339 WeakPolarHBondContact O-CG 3.32Å; P335-M339 PolarHBondContact O-N 3.46Å; L336-M339 HydrophobicContact CD2-SD 4.32Å; L336-M339 WeakPolarHBondContact O-CB 3.4Å; L336-M339 PolarHBondContact O-N 3.39Å; A337-M339 PolarHBondContact O-N 3.18Å; M339-P341 VanDerWaalsContact O-CD 3.25Å; M339-P341 WeakPolarHBondContact O-CD 3.33Å
340V86.6Confident87.1Confident16 Ų1623.7 Ų23.710%0.09715%0.146CC..  trans-81.8116.1-172.3178.70000110.4F34 Q38 I198 A337 A344F34-V340 HydrophobicContact CB-CB 4.35Å; F34-V340 HydrophobicContact CB-CG1 4.16Å; F34-V340 HydrophobicContact CD1-CB 3.91Å; F34-V340 HydrophobicContact CD1-CG1 4.45Å; F34-V340 HydrophobicContact CD1-CG2 3.41Å; F34-V340 VanDerWaalsContact CD1-CG2 3.41Å; F34-V340 HydrophobicContact CE1-CG2 3.64Å; F34-V340 HydrophobicContact CG-CB 4.3Å; F34-V340 HydrophobicContact CG-CG1 4.35Å; F34-V340 HydrophobicContact CG-CG2 4.01Å; F34-V340 HydrophobicContact CZ-CG2 4.42Å; Q38-V340 PolarHBondContact NE2-O 3Å; I198-V340 HydrophobicContact CG2-CB 4.47Å; I198-V340 HydrophobicContact CG2-CG1 3.69Å; I198-V340 HydrophobicContact CG2-CG2 3.86Å; A337-V340 PolarHBondContact O-N 3.49Å; V340-A344 HydrophobicContact CG1-CB 3.9Å
341P86.7Confident87Confident22 Ų2225.3 Ų25.314%0.14315%0.151CC..  trans-74.3158.6178.230.7-34.3000111.7Q38 V211 M339 Y343 A344Q38-P341 PolarHBondContact NE2-O 2.92Å; V211-P341 HydrophobicContact CG2-CG 3.98Å; M339-P341 VanDerWaalsContact O-CD 3.25Å; M339-P341 WeakPolarHBondContact O-CD 3.33Å; P341-Y343 VanDerWaalsContact C-N 3.29Å; P341-Y343 HydrophobicContact CB-CD1 4.03Å; P341-Y343 HydrophobicContact CB-CD2 4.34Å; P341-Y343 HydrophobicContact CB-CE1 3.61Å; P341-Y343 HydrophobicContact CB-CE2 3.92Å; P341-Y343 HydrophobicContact CB-CG 4.39Å; P341-Y343 HydrophobicContact CG-CD1 4.43Å; P341-Y343 HydrophobicContact CG-CD2 3.9Å; P341-Y343 HydrophobicContact CG-CE1 3.93Å; P341-Y343 HydrophobicContact CG-CE2 3.27Å; P341-Y343 HydrophobicContact CG-CG 4.43Å; P341-Y343 PolarHBondContact O-N 3.28Å; P341-A344 HydrophobicContact CG-CB 3.86Å; P341-A344 WeakPolarHBondContact O-CB 3.28Å; P341-A344 PolarHBondContact O-N 3.39Å; P341-A344 VanDerWaalsContact O-N 3.07Å
342G84.5Confident86.6Confident32 Ų3225 Ų2533%0.3315%0.149SC..Hα-helixtrans-56.9-38.6-177.300000114A344 A345 A346G342-A344 VanDerWaalsContact C-N 3.31Å; G342-A344 PolarHBondContact O-N 3.03Å; G342-A345 PolarHBondContact O-N 3.33Å; G342-A346 PolarHBondContact O-N 3.07Å; G342-A346 VanDerWaalsContact O-N 3.16Å
343Y87Confident86.6Confident18 Ų1820 Ų207%0.07113%0.129CC..Hα-helixtrans-67.9-27.5178.755.6-108.6000113.4S171 L174 G175 G205 D210 P341 A345 A346S171-Y343 WeakPolarHBondContact O-CB 3.14Å; L174-Y343 HydrophobicContact CB-CD2 3.72Å; L174-Y343 HydrophobicContact CB-CE2 3.97Å; L174-Y343 HydrophobicContact CB-CG 4.49Å; L174-Y343 HydrophobicContact CD1-CD2 4.06Å; L174-Y343 HydrophobicContact CD1-CE2 3.45Å; L174-Y343 VanDerWaalsContact CD1-CE2 3.45Å; L174-Y343 HydrophobicContact CG-CE2 4.37Å; G175-Y343 WeakPolarHBondContact CA-O 3.47Å; G205-Y343 WeakPolarHBondContact CA-OH 3.34Å; D210-Y343 WeakPolarHBondContact CB-OH 3.22Å; D210-Y343 PolarHBondContact OD2-OH 3.36Å; P341-Y343 VanDerWaalsContact C-N 3.29Å; P341-Y343 HydrophobicContact CB-CD1 4.03Å; P341-Y343 HydrophobicContact CB-CD2 4.34Å; P341-Y343 HydrophobicContact CB-CE1 3.61Å; P341-Y343 HydrophobicContact CB-CE2 3.92Å; P341-Y343 HydrophobicContact CB-CG 4.39Å; P341-Y343 HydrophobicContact CG-CD1 4.43Å; P341-Y343 HydrophobicContact CG-CD2 3.9Å; P341-Y343 HydrophobicContact CG-CE1 3.93Å; P341-Y343 HydrophobicContact CG-CE2 3.27Å; P341-Y343 HydrophobicContact CG-CG 4.43Å; P341-Y343 PolarHBondContact O-N 3.28Å; Y343-A345 VanDerWaalsContact C-N 3.31Å; Y343-A345 PolarHBondContact O-N 3.49Å; Y343-A346 WeakPolarHBondContact O-CB 3.47Å; Y343-A346 PolarHBondContact O-N 3.32Å
344A88.5Confident86.7Confident0 Ų020.5 Ų20.50%014%0.135CC..Hα-helixtrans-69.9-32.8178.100000111.5T201 V340 P341 G342T201-A344 WeakPolarHBondContact OG1-CA 3.22Å; T201-A344 WeakPolarHBondContact OG1-CB 3.33Å; V340-A344 HydrophobicContact CG1-CB 3.9Å; P341-A344 HydrophobicContact CG-CB 3.86Å; P341-A344 WeakPolarHBondContact O-CB 3.28Å; P341-A344 PolarHBondContact O-N 3.39Å; P341-A344 VanDerWaalsContact O-N 3.07Å; G342-A344 VanDerWaalsContact C-N 3.31Å; G342-A344 PolarHBondContact O-N 3.03Å
345A86Confident86.7Confident0 Ų022.8 Ų22.80%015%0.145CC..Hα-helixtrans-86.1-17.7178.100000112.9V35 G342 Y343 G347 A348 L349V35-A345 HydrophobicContact CG2-CB 3.6Å; G342-A345 PolarHBondContact O-N 3.33Å; Y343-A345 VanDerWaalsContact C-N 3.31Å; Y343-A345 PolarHBondContact O-N 3.49Å; A345-G347 VanDerWaalsContact C-N 3.31Å; A345-G347 PolarHBondContact O-N 2.9Å; A345-A348 WeakPolarHBondContact O-CB 3.46Å; A345-A348 PolarHBondContact O-N 3.05Å; A345-A348 VanDerWaalsContact O-N 3.13Å; A345-L349 PolarHBondContact O-N 2.88Å
346A89.9Confident86.8Confident0 Ų022.7 Ų22.70%014%0.144CC..Hα-helixtrans-58.2-40.2178.200000113G147 N150 A151 G342 Y343 A348 L349 I350G147-A346 WeakPolarHBondContact O-CB 3.45Å; N150-A346 HydrophobicContact CB-CB 4.27Å; A151-A346 HydrophobicContact CB-CB 3.78Å; G342-A346 PolarHBondContact O-N 3.07Å; G342-A346 VanDerWaalsContact O-N 3.16Å; Y343-A346 WeakPolarHBondContact O-CB 3.47Å; Y343-A346 PolarHBondContact O-N 3.32Å; A346-A348 VanDerWaalsContact C-N 3.26Å; A346-A348 PolarHBondContact O-N 3.12Å; A346-L349 WeakPolarHBondContact O-CB 3.39Å; A346-L349 PolarHBondContact O-N 2.95Å; A346-I350 VanDerWaalsContact O-CG1 3.31Å; A346-I350 WeakPolarHBondContact O-CG1 3.36Å; A346-I350 PolarHBondContact O-N 2.98Å
347G91.9Very high87.1Confident0 Ų021.5 Ų21.50%014%0.139CC..Hα-helixtrans-59.2-37.217700000113I182 A345 I350 Y351I182-G347 VanDerWaalsContact CD1-C 3.45Å; A345-G347 VanDerWaalsContact C-N 3.31Å; A345-G347 PolarHBondContact O-N 2.9Å; G347-I350 PolarHBondContact O-N 2.91Å; G347-Y351 WeakPolarHBondContact O-CB 3.44Å; G347-Y351 PolarHBondContact O-N 3.44Å
348A89Confident87.5Confident1 Ų124.5 Ų24.51%0.00816%0.159CC..Hα-helixtrans-65.6-4517700000111.4Y31 I182 V194 A345 A346 I350 Y351 V352Y31-A348 HydrophobicContact CD2-CB 4.24Å; Y31-A348 HydrophobicContact CG-CB 4.29Å; I182-A348 HydrophobicContact CD1-CB 4.26Å; V194-A348 HydrophobicContact CG1-CB 3.45Å; V194-A348 VanDerWaalsContact CG1-CB 3.45Å; A345-A348 WeakPolarHBondContact O-CB 3.46Å; A345-A348 PolarHBondContact O-N 3.05Å; A345-A348 VanDerWaalsContact O-N 3.13Å; A346-A348 VanDerWaalsContact C-N 3.26Å; A346-A348 PolarHBondContact O-N 3.12Å; A348-I350 VanDerWaalsContact C-N 3.34Å; A348-I350 PolarHBondContact O-N 3.03Å; A348-Y351 PolarHBondContact O-N 3.35Å; A348-V352 VanDerWaalsContact O-CG2 3.31Å; A348-V352 WeakPolarHBondContact O-CG2 3.29Å; A348-V352 PolarHBondContact O-N 2.87Å
349L88.5Confident87.7Confident3 Ų322.7 Ų22.72%0.01614%0.138CC..Hα-helixtrans-58-45.2176.2-68.9172.6000112.1V35 I39 M79 I143 A345 A346 Y351 V352 G353V35-L349 HydrophobicContact CG1-CD1 4.36Å; V35-L349 HydrophobicContact CG1-CD2 3.64Å; V35-L349 HydrophobicContact CG1-CG 4.09Å; I39-L349 HydrophobicContact CD1-CD2 4.45Å; M79-L349 HydrophobicContact CE-CD2 3.14Å; I143-L349 HydrophobicContact CG2-CB 4.28Å; I143-L349 HydrophobicContact CG2-CD2 3.7Å; A345-L349 PolarHBondContact O-N 2.88Å; A346-L349 WeakPolarHBondContact O-CB 3.39Å; A346-L349 PolarHBondContact O-N 2.95Å; L349-Y351 VanDerWaalsContact C-N 3.35Å; L349-Y351 PolarHBondContact O-N 3.08Å; L349-V352 PolarHBondContact O-N 3.19Å; L349-G353 PolarHBondContact O-N 3.41Å
350I92.9Very high88Confident21 Ų2122.9 Ų22.911%0.10814%0.139CC..Hα-helixtrans-62.9-44.3177.9-59.5164.6000110.2L148 F179 A346 G347 A348 G353 V354L148-I350 HydrophobicContact CD2-CD1 3.69Å; L148-I350 HydrophobicContact CD2-CG1 4.17Å; L148-I350 HydrophobicContact CG-CD1 4.16Å; L148-I350 HydrophobicContact CG-CG1 4.13Å; F179-I350 HydrophobicContact CB-CD1 4.34Å; F179-I350 HydrophobicContact CD2-CB 3.76Å; F179-I350 HydrophobicContact CD2-CG2 3.43Å; F179-I350 VanDerWaalsContact CD2-CG2 3.43Å; F179-I350 HydrophobicContact CE2-CB 4.27Å; F179-I350 HydrophobicContact CE2-CG2 3.54Å; F179-I350 HydrophobicContact CG-CB 4.37Å; F179-I350 HydrophobicContact CG-CG2 4Å; F179-I350 HydrophobicContact CZ-CG2 4.19Å; A346-I350 VanDerWaalsContact O-CG1 3.31Å; A346-I350 WeakPolarHBondContact O-CG1 3.36Å; A346-I350 PolarHBondContact O-N 2.98Å; G347-I350 PolarHBondContact O-N 2.91Å; A348-I350 VanDerWaalsContact C-N 3.34Å; A348-I350 PolarHBondContact O-N 3.03Å; I350-G353 WeakPolarHBondContact O-CA 3.12Å; I350-G353 PolarHBondContact O-N 2.91Å; I350-G353 VanDerWaalsContact O-N 3.17Å; I350-V354 PolarHBondContact O-N 3.46Å; I350-V354 VanDerWaalsContact O-N 3.09Å
351Y91.4Very high88.2Confident47 Ų4726.4 Ų26.418%0.18417%0.17CC..Hα-helixtrans-65.9-39.1179-176.1-108.2000113.2I182 A186 V194 G347 A348 L349 G353 V354 L355I182-Y351 HydrophobicContact CB-CG 4.43Å; I182-Y351 HydrophobicContact CG2-CD1 3.49Å; I182-Y351 VanDerWaalsContact CG2-CD1 3.49Å; I182-Y351 HydrophobicContact CG2-CD2 3.76Å; I182-Y351 HydrophobicContact CG2-CE1 3.97Å; I182-Y351 HydrophobicContact CG2-CE2 4.23Å; I182-Y351 HydrophobicContact CG2-CG 3.38Å; A186-Y351 HydrophobicContact CB-CE1 4.39Å; A186-Y351 HydrophobicContact CB-CE2 4.06Å; A186-Y351 WeakPolarHBondContact CB-OH 3.49Å; V194-Y351 HydrophobicContact CG2-CD1 4.33Å; G347-Y351 WeakPolarHBondContact O-CB 3.44Å; G347-Y351 PolarHBondContact O-N 3.44Å; A348-Y351 PolarHBondContact O-N 3.35Å; L349-Y351 VanDerWaalsContact C-N 3.35Å; L349-Y351 PolarHBondContact O-N 3.08Å; Y351-G353 VanDerWaalsContact C-N 3.25Å; Y351-G353 PolarHBondContact O-N 3.18Å; Y351-V354 WeakPolarHBondContact O-CB 3.45Å; Y351-V354 PolarHBondContact O-N 3.29Å; Y351-V354 VanDerWaalsContact O-N 3.09Å; Y351-L355 HydrophobicContact CD1-CD1 4.1Å; Y351-L355 HydrophobicContact CD1-CG 4.31Å; Y351-L355 HydrophobicContact CE1-CD1 3.63Å; Y351-L355 HydrophobicContact CE1-CD2 4.19Å; Y351-L355 HydrophobicContact CE1-CG 3.88Å; Y351-L355 PolarHBondContact O-N 3.48Å
352V84Confident88.1Confident6 Ų631.2 Ų31.24%0.03619%0.185CC..Hα-helixtrans-59.1-41.2171.6170.50000110.4Y31 I143 A348 L349 V354 L355 M356Y31-V352 HydrophobicContact CE1-CG2 4.35Å; Y31-V352 HydrophobicContact CE2-CG2 4.33Å; Y31-V352 WeakPolarHBondContact OH-CG2 3.47Å; I143-V352 HydrophobicContact CD1-CG1 4.47Å; I143-V352 HydrophobicContact CG2-CB 4.43Å; I143-V352 HydrophobicContact CG2-CG1 4.21Å; A348-V352 VanDerWaalsContact O-CG2 3.31Å; A348-V352 WeakPolarHBondContact O-CG2 3.29Å; A348-V352 PolarHBondContact O-N 2.87Å; L349-V352 PolarHBondContact O-N 3.19Å; V352-V354 VanDerWaalsContact C-N 3.33Å; V352-V354 PolarHBondContact O-N 2.94Å; V352-L355 PolarHBondContact O-N 3.45Å; V352-M356 HydrophobicContact CG1-CG 4.27Å; V352-M356 HydrophobicContact CG1-SD 3.88Å; V352-M356 WeakPolarHBondContact O-CG 3.48Å; V352-M356 PolarHBondContact O-N 3.31Å
353G89.4Confident88.4Confident5 Ų530.1 Ų30.15%0.05217%0.172CC..Hα-helixtrans-54.4-47.4171.700000112.4G140 L349 I350 Y351 L355 M356 T357G140-G353 WeakPolarHBondContact O-CA 3.16Å; L349-G353 PolarHBondContact O-N 3.41Å; I350-G353 WeakPolarHBondContact O-CA 3.12Å; I350-G353 PolarHBondContact O-N 2.91Å; I350-G353 VanDerWaalsContact O-N 3.17Å; Y351-G353 VanDerWaalsContact C-N 3.25Å; Y351-G353 PolarHBondContact O-N 3.18Å; G353-L355 PolarHBondContact O-N 3.23Å; G353-M356 PolarHBondContact O-N 2.89Å; G353-T357 VanDerWaalsContact O-CB 3.31Å; G353-T357 WeakPolarHBondContact O-CB 3.29Å; G353-T357 PolarHBondContact O-N 3.4Å; G353-T357 PolarHBondContact O-OG1 3.29Å
354V91.2Very high88.7Confident76 Ų7633.5 Ų33.546%0.46119%0.191SC..Hα-helixtrans-57.7-47.7175.71770000111.8F179 I350 Y351 V352 M356 S358F179-V354 HydrophobicContact CE2-CG2 4.14Å; F179-V354 HydrophobicContact CZ-CG2 4.39Å; I350-V354 PolarHBondContact O-N 3.46Å; I350-V354 VanDerWaalsContact O-N 3.09Å; Y351-V354 WeakPolarHBondContact O-CB 3.45Å; Y351-V354 PolarHBondContact O-N 3.29Å; Y351-V354 VanDerWaalsContact O-N 3.09Å; V352-V354 VanDerWaalsContact C-N 3.33Å; V352-V354 PolarHBondContact O-N 2.94Å; V354-M356 PolarHBondContact O-N 2.96Å; V354-S358 PolarHBondContact O-N 3.18Å; V354-S358 VanDerWaalsContact O-N 3.14Å
355L84.3Confident89.1Confident58 Ų5839.4 Ų39.430%0.30421%0.214SC..Hα-helixtrans-61.7-45.3-179.6-68.9-178.9000112Y351 V352 G353 S358Y351-L355 HydrophobicContact CD1-CD1 4.1Å; Y351-L355 HydrophobicContact CD1-CG 4.31Å; Y351-L355 HydrophobicContact CE1-CD1 3.63Å; Y351-L355 HydrophobicContact CE1-CD2 4.19Å; Y351-L355 HydrophobicContact CE1-CG 3.88Å; Y351-L355 PolarHBondContact O-N 3.48Å; V352-L355 PolarHBondContact O-N 3.45Å; G353-L355 PolarHBondContact O-N 3.23Å; L355-S358 WeakPolarHBondContact O-CB 3.5Å; L355-S358 PolarHBondContact O-N 3.19Å; L355-S358 PolarHBondContact O-OG 3.42Å
356M84.8Confident89.6Confident14 Ų1448.4 Ų48.47%0.06926%0.256CS..Hα-helixtrans-71.9-42.7-177.7-69.5-175.886.200111.9T136 I139 I143 V352 G353 V354 S358 S359T136-M356 HydrophobicContact CG2-CB 4.46Å; T136-M356 HydrophobicContact CG2-CE 3.89Å; T136-M356 WeakPolarHBondContact O-CE 3.37Å; I139-M356 HydrophobicContact CB-CE 4.1Å; I139-M356 HydrophobicContact CG2-CE 3.85Å; I139-M356 HydrophobicContact CG2-SD 4.47Å; I143-M356 HydrophobicContact CD1-SD 4.02Å; V352-M356 HydrophobicContact CG1-CG 4.27Å; V352-M356 HydrophobicContact CG1-SD 3.88Å; V352-M356 WeakPolarHBondContact O-CG 3.48Å; V352-M356 PolarHBondContact O-N 3.31Å; G353-M356 PolarHBondContact O-N 2.89Å; V354-M356 PolarHBondContact O-N 2.96Å; M356-S358 PolarHBondContact O-N 2.78Å; M356-S359 VanDerWaalsContact O-CB 3.26Å; M356-S359 WeakPolarHBondContact O-CB 3.47Å; M356-S359 PolarHBondContact O-N 2.92Å; M356-S359 VanDerWaalsContact O-N 3.11Å; M356-S359 PolarHBondContact O-OG 3.34Å
357T90.8Very high89.8Confident35 Ų3549.8 Ų49.822%0.21526%0.263CS..Hα-helixtrans-63.8-26.3177.4-56.60000112.6L141 G353 S359 L360L141-T357 HydrophobicContact CD2-CG2 4.07Å; L141-T357 WeakPolarHBondContact CD2-OG1 3.38Å; L141-T357 HydrophobicContact CG-CG2 4.39Å; G353-T357 VanDerWaalsContact O-CB 3.31Å; G353-T357 WeakPolarHBondContact O-CB 3.29Å; G353-T357 PolarHBondContact O-N 3.4Å; G353-T357 PolarHBondContact O-OG1 3.29Å; T357-S359 PolarHBondContact O-N 3.23Å; T357-L360 HydrophobicContact CG2-CD1 3.92Å; T357-L360 WeakPolarHBondContact O-CB 3.45Å; T357-L360 WeakPolarHBondContact O-CG 3.47Å; T357-L360 PolarHBondContact O-N 3.18Å
358S87.2Confident90Very high79 Ų7955.2 Ų55.255%0.55229%0.291SS*.G310 helixtrans-56.4-23.217479.20000113.4V354 L355 M356 L360 A361V354-S358 PolarHBondContact O-N 3.18Å; V354-S358 VanDerWaalsContact O-N 3.14Å; L355-S358 WeakPolarHBondContact O-CB 3.5Å; L355-S358 PolarHBondContact O-N 3.19Å; L355-S358 PolarHBondContact O-OG 3.42Å; M356-S358 PolarHBondContact O-N 2.78Å; S358-L360 PolarHBondContact O-N 2.98Å; S358-A361 VanDerWaalsContact O-CB 3.3Å; S358-A361 WeakPolarHBondContact O-CB 3.39Å; S358-A361 PolarHBondContact O-N 3.21Å; S358-A361 VanDerWaalsContact O-N 3.09Å
359S82.3Confident90.3Very high17 Ų1755.3 Ų55.312%0.11929%0.292CS..G310 helixtrans-57.5-30175.1-70.70000112.7V133 M356 T357 A361 R362V133-S359 WeakPolarHBondContact CG1-O 3.38Å; M356-S359 VanDerWaalsContact O-CB 3.26Å; M356-S359 WeakPolarHBondContact O-CB 3.47Å; M356-S359 PolarHBondContact O-N 2.92Å; M356-S359 VanDerWaalsContact O-N 3.11Å; M356-S359 PolarHBondContact O-OG 3.34Å; T357-S359 PolarHBondContact O-N 3.23Å; S359-A361 PolarHBondContact O-N 2.94Å; S359-R362 WeakPolarHBondContact O-CB 3.4Å; S359-R362 PolarHBondContact O-N 3.42Å; S359-R362 PolarHBondContact OG-NH2 3.42Å
360L90.7Very high90.7Very high31 Ų3156.9 Ų56.916%0.16230%0.299CS..G310 helixtrans-55.8-22.2177.1-72.5-177.7000113.3V133 S137 T357 S358 R362 V363 W365 A378V133-L360 HydrophobicContact CG1-CD2 4.19Å; S137-L360 WeakPolarHBondContact OG-CD2 3.32Å; S137-L360 WeakPolarHBondContact OG-CG 3.09Å; T357-L360 HydrophobicContact CG2-CD1 3.92Å; T357-L360 WeakPolarHBondContact O-CB 3.45Å; T357-L360 WeakPolarHBondContact O-CG 3.47Å; T357-L360 PolarHBondContact O-N 3.18Å; S358-L360 PolarHBondContact O-N 2.98Å; L360-R362 PolarHBondContact O-N 3.44Å; L360-R362 VanDerWaalsContact O-N 3.16Å; L360-V363 HydrophobicContact CD2-CG2 4.39Å; L360-V363 WeakPolarHBondContact O-CB 3.42Å; L360-V363 PolarHBondContact O-N 3.06Å; L360-V363 VanDerWaalsContact O-N 3.11Å; L360-W365 HydrophobicContact CB-CZ2 4.22Å; L360-W365 PolarHBondContact O-NE1 3.49Å; L360-A378 HydrophobicContact CD2-CB 4.33Å
361A90.5Very high90.9Very high89 Ų8956.2 Ų56.274%0.73630%0.296SS*.G310 helixtrans-61.9-19.5174.200000113.2S358 S359 V363S358-A361 VanDerWaalsContact O-CB 3.3Å; S358-A361 WeakPolarHBondContact O-CB 3.39Å; S358-A361 PolarHBondContact O-N 3.21Å; S358-A361 VanDerWaalsContact O-N 3.09Å; S359-A361 PolarHBondContact O-N 2.94Å; A361-V363 VanDerWaalsContact C-N 3.35Å
362R85.6Confident91.2Very high123 Ų12356.1 Ų56.146%0.46430%0.301SS..G310 helixtrans-83.3-8.5177.3-62.9-174.1-69.7-171.6-4.7113.9V133 S359 L360V133-R362 HydrophobicContact CG2-CB 4.2Å; S359-R362 WeakPolarHBondContact O-CB 3.4Å; S359-R362 PolarHBondContact O-N 3.42Å; S359-R362 PolarHBondContact OG-NH2 3.42Å; L360-R362 PolarHBondContact O-N 3.44Å; L360-R362 VanDerWaalsContact O-N 3.16Å
363V91.5Very high91.8Very high9 Ų955.9 Ų55.96%0.05530%0.299CS..SBendtrans-75.3136.2178.2179.40000109V133 L360 A361 W365 A374V133-V363 HydrophobicContact CB-CG2 4.3Å; V133-V363 HydrophobicContact CG1-CG2 3.67Å; L360-V363 HydrophobicContact CD2-CG2 4.39Å; L360-V363 WeakPolarHBondContact O-CB 3.42Å; L360-V363 PolarHBondContact O-N 3.06Å; L360-V363 VanDerWaalsContact O-N 3.11Å; A361-V363 VanDerWaalsContact C-N 3.35Å; V363-W365 VanDerWaalsContact C-N 3.34Å; V363-W365 HydrophobicContact CB-CZ2 4.38Å; V363-W365 HydrophobicContact CG1-CD2 4.46Å; V363-W365 PolarHBondContact O-N 2.96Å; V363-A374 HydrophobicContact CB-CB 4.48Å; V363-A374 HydrophobicContact CG1-CB 3.92Å; V363-A374 HydrophobicContact CG2-CB 3.7Å
364N93.5Very high92Very high89 Ų8955.6 Ų55.648%0.47630%0.297SS..  trans-74.390170.3-176.72.8000109.8Q366 D367N364-Q366 PolarHBondContact O-N 2.86Å; N364-Q366 PolarHBondContact OD1-N 3.46Å; N364-D367 PolarHBondContact O-N 3.41Å; N364-D367 VanDerWaalsContact O-N 3.12Å
365W95.4Very high92.3Very high125 Ų12557.2 Ų57.247%0.47330%0.298SS..THydrogen-bonded Turntrans-65.8-17.9-177.8-70.497000114.5L360 V363 D367L360-W365 HydrophobicContact CB-CZ2 4.22Å; L360-W365 PolarHBondContact O-NE1 3.49Å; V363-W365 VanDerWaalsContact C-N 3.34Å; V363-W365 HydrophobicContact CB-CZ2 4.38Å; V363-W365 HydrophobicContact CG1-CD2 4.46Å; V363-W365 PolarHBondContact O-N 2.96Å; W365-D367 VanDerWaalsContact C-N 3.32Å
366Q96.2Very high93Very high189 Ų18956.7 Ų56.788%0.88330%0.295SS*.THydrogen-bonded Turntrans-77.7-18.9175.2-62.9-165.4-9.600113N364N364-Q366 PolarHBondContact O-N 2.86Å; N364-Q366 PolarHBondContact OD1-N 3.46Å
367D95.5Very high93.4Very high28 Ų2856 Ų5615%0.1529%0.292CS..  trans-102.6105.5176.7-168.3-21.4000110.6N364 W365 T369 E370 S371 R407N364-D367 PolarHBondContact O-N 3.41Å; N364-D367 VanDerWaalsContact O-N 3.12Å; W365-D367 VanDerWaalsContact C-N 3.32Å; D367-T369 VanDerWaalsContact CG-OG1 3.27Å; D367-T369 PolarHBondContact O-N 3.34Å; D367-T369 VanDerWaalsContact O-N 3.14Å; D367-T369 WeakPolarHBondContact OD1-CB 3.26Å; D367-T369 PolarHBondContact OD1-N 3.29Å; D367-T369 PolarHBondContact OD1-OG1 2.95Å; D367-T369 PolarHBondContact OD2-OG1 3.18Å; D367-E370 HydrophobicContact CB-CB 4.44Å; D367-E370 HydrophobicContact CB-CG 4.31Å; D367-E370 PolarHBondContact O-N 3.31Å; D367-S371 PolarHBondContact O-N 3.47Å; D367-S371 PolarHBondContact O-OG 2.86Å; D367-R407 IonicContact OD1-CZ 2.81Å; D367-R407 IonicContact OD1-NH1 2.91Å; D367-R407 IonicContact OD1-NH2 3.77Å; D367-R407 IonicContact OD2-CZ 2.73Å; D367-R407 IonicContact OD2-NH1 2.7Å; D367-R407 PolarHBondContact OD2-NH1 3.47Å; D367-R407 IonicContact OD2-NH2 3.49Å; D367-R407 PolarHBondContact OD2-NH2 2.93Å
368L95.8Very high93.6Very high114 Ų11454.5 Ų54.560%0.59728%0.282SS*.Hα-helixtrans-58.8-26.3178.1-70.1177.3000113E370 S371 V372 M401L368-E370 PolarHBondContact O-N 3.45Å; L368-S371 WeakPolarHBondContact CA-OG 3.4Å; L368-V372 HydrophobicContact CB-CG2 4.35Å; L368-V372 HydrophobicContact CD2-CG2 4.2Å; L368-V372 WeakPolarHBondContact O-CB 3.45Å; L368-V372 WeakPolarHBondContact O-CG2 3.24Å; L368-V372 PolarHBondContact O-N 3.03Å; L368-M401 HydrophobicContact CB-CE 4.23Å; L368-M401 WeakPolarHBondContact O-CE 3.25Å
369T96Very high94Very high4 Ų451.9 Ų51.93%0.02526%0.263CS..Hα-helixtrans-69.7-16.4177.171.10000113.1D367 P373 K402 T405 R407D367-T369 VanDerWaalsContact CG-OG1 3.27Å; D367-T369 PolarHBondContact O-N 3.34Å; D367-T369 VanDerWaalsContact O-N 3.14Å; D367-T369 WeakPolarHBondContact OD1-CB 3.26Å; D367-T369 PolarHBondContact OD1-N 3.29Å; D367-T369 PolarHBondContact OD1-OG1 2.95Å; D367-T369 PolarHBondContact OD2-OG1 3.18Å; T369-P373 WeakPolarHBondContact O-CG 3.21Å; T369-K402 PolarHBondContact OG1-NZ 2.86Å; T369-T405 HydrophobicContact CG2-CG2 3.76Å; T369-T405 WeakPolarHBondContact CG2-OG1 3.33Å; T369-R407 PolarHBondContact OG1-NH1 2.95Å
370E95.2Very high94.6Very high35 Ų3553.8 Ų53.816%0.16427%0.271CS..Hα-helixtrans-106.5-39.9176.2-62.8-60.4150.700112.2S130 D367 L368 P373 A374 K402S130-E370 VanDerWaalsContact CB-O 3.24Å; S130-E370 WeakPolarHBondContact CB-O 3.29Å; S130-E370 WeakPolarHBondContact CB-OE2 3.47Å; S130-E370 PolarHBondContact OG-OE2 2.99Å; D367-E370 HydrophobicContact CB-CB 4.44Å; D367-E370 HydrophobicContact CB-CG 4.31Å; D367-E370 PolarHBondContact O-N 3.31Å; L368-E370 PolarHBondContact O-N 3.45Å; E370-P373 WeakPolarHBondContact O-CD 3.49Å; E370-A374 WeakPolarHBondContact O-CB 3.41Å; E370-A374 PolarHBondContact O-N 3.41Å; E370-K402 VanDerWaalsContact OE1-CE 3.25Å; E370-K402 WeakPolarHBondContact OE1-CE 3.23Å; E370-K402 IonicContact OE1-NZ 2.67Å; E370-K402 PolarHBondContact OE1-NZ 2.93Å
371S96.8Very high94.6Very high7 Ų752.3 Ų52.35%0.04926%0.263CS..Hα-helixtrans-76.2-36.6-175.263.40000114D367 L368 A374 F375D367-S371 PolarHBondContact O-N 3.47Å; D367-S371 PolarHBondContact O-OG 2.86Å; L368-S371 WeakPolarHBondContact CA-OG 3.4Å; S371-A374 PolarHBondContact O-N 3.17Å; S371-F375 VanDerWaalsContact O-CB 3.3Å; S371-F375 WeakPolarHBondContact O-CB 3.47Å; S371-F375 PolarHBondContact O-N 3.13Å
372V97.6Very high94.6Very high46 Ų4648.5 Ų48.528%0.27923%0.231SC..Hα-helixtrans-61.6-50.6177.2171.60000111.4L368 A374 F375 I376 M401L368-V372 HydrophobicContact CB-CG2 4.35Å; L368-V372 HydrophobicContact CD2-CG2 4.2Å; L368-V372 WeakPolarHBondContact O-CB 3.45Å; L368-V372 WeakPolarHBondContact O-CG2 3.24Å; L368-V372 PolarHBondContact O-N 3.03Å; V372-A374 PolarHBondContact O-N 3.33Å; V372-F375 PolarHBondContact O-N 3.32Å; V372-I376 HydrophobicContact CG1-CD1 3.68Å; V372-I376 HydrophobicContact CG1-CG1 4.42Å; V372-I376 WeakPolarHBondContact O-CG1 3.42Å; V372-I376 PolarHBondContact O-N 3.47Å; V372-M401 HydrophobicContact CB-CE 4.36Å; V372-M401 HydrophobicContact CB-CG 4.33Å; V372-M401 HydrophobicContact CB-SD 4.45Å; V372-M401 HydrophobicContact CG1-CG 4.21Å; V372-M401 HydrophobicContact CG1-SD 4.24Å; V372-M401 HydrophobicContact CG2-CE 4.26Å
373P96.6Very high94.9Very high0 Ų050.1 Ų50.10%024%0.241CC..Hα-helixtrans-63.6-40.8177.8-23.135.3000113.1L131 T369 E370 F375 I376 T377 S397 Y398 M401L131-P373 HydrophobicContact CD2-CB 4.02Å; T369-P373 WeakPolarHBondContact O-CG 3.21Å; E370-P373 WeakPolarHBondContact O-CD 3.49Å; P373-F375 VanDerWaalsContact C-N 3.35Å; P373-F375 PolarHBondContact O-N 2.68Å; P373-I376 PolarHBondContact O-N 2.91Å; P373-T377 VanDerWaalsContact O-CB 3.32Å; P373-T377 WeakPolarHBondContact O-CB 3.11Å; P373-T377 PolarHBondContact O-N 3.28Å; P373-T377 PolarHBondContact O-OG1 3.41Å; P373-S397 WeakPolarHBondContact CA-OG 3.46Å; P373-Y398 HydrophobicContact CB-CD2 4.09Å; P373-Y398 HydrophobicContact CB-CG 4.48Å; P373-Y398 VanDerWaalsContact CG-CA 3.5Å; P373-Y398 HydrophobicContact CG-CD2 3.95Å; P373-Y398 HydrophobicContact CG-CG 4.38Å; P373-M401 HydrophobicContact CG-CB 4.48Å; P373-M401 HydrophobicContact CG-CG 4.25Å
374A95.6Very high94.8Very high0 Ų051.9 Ų51.90%025%0.254CS..Hα-helixtrans-61.4-44177.600000111.8S130 V363 E370 S371 V372 A378S130-A374 WeakPolarHBondContact O-CB 3.19Å; V363-A374 HydrophobicContact CB-CB 4.48Å; V363-A374 HydrophobicContact CG1-CB 3.92Å; V363-A374 HydrophobicContact CG2-CB 3.7Å; E370-A374 WeakPolarHBondContact O-CB 3.41Å; E370-A374 PolarHBondContact O-N 3.41Å; S371-A374 PolarHBondContact O-N 3.17Å; V372-A374 PolarHBondContact O-N 3.33Å; A374-A378 WeakPolarHBondContact O-CB 3.25Å; A374-A378 PolarHBondContact O-N 3.19Å
375F97.4Very high94.3Very high109 Ų10950.7 Ų50.748%0.47825%0.245SC..Hα-helixtrans-63.1-52.5177.2176.4-97.3000111.6S371 V372 P373 T377 A378 V379S371-F375 VanDerWaalsContact O-CB 3.3Å; S371-F375 WeakPolarHBondContact O-CB 3.47Å; S371-F375 PolarHBondContact O-N 3.13Å; V372-F375 PolarHBondContact O-N 3.32Å; P373-F375 VanDerWaalsContact C-N 3.35Å; P373-F375 PolarHBondContact O-N 2.68Å; F375-T377 VanDerWaalsContact C-N 3.29Å; F375-T377 PolarHBondContact O-N 2.96Å; F375-A378 PolarHBondContact O-N 3.14Å; F375-V379 HydrophobicContact CD1-CG2 4.16Å; F375-V379 HydrophobicContact CD2-CG1 3.93Å; F375-V379 HydrophobicContact CE1-CG1 4.2Å; F375-V379 HydrophobicContact CE1-CG2 3.8Å; F375-V379 HydrophobicContact CE2-CG1 3.51Å; F375-V379 HydrophobicContact CG-CG1 4.44Å; F375-V379 HydrophobicContact CZ-CB 4.44Å; F375-V379 HydrophobicContact CZ-CG1 3.66Å; F375-V379 HydrophobicContact CZ-CG2 4.06Å; F375-V379 WeakPolarHBondContact O-CG2 3.05Å; F375-V379 PolarHBondContact O-N 3.15Å
376I97.4Very high93.7Very high48 Ų4845 Ų4525%0.24622%0.224CC..Hα-helixtrans-55.8-47.8179-71171.1000110.1V372 P373 A378 M380 L393V372-I376 HydrophobicContact CG1-CD1 3.68Å; V372-I376 HydrophobicContact CG1-CG1 4.42Å; V372-I376 WeakPolarHBondContact O-CG1 3.42Å; V372-I376 PolarHBondContact O-N 3.47Å; P373-I376 PolarHBondContact O-N 2.91Å; I376-A378 VanDerWaalsContact C-N 3.27Å; I376-A378 PolarHBondContact O-N 3.33Å; I376-M380 HydrophobicContact CG2-CG 3.98Å; I376-M380 WeakPolarHBondContact O-CB 3.2Å; I376-M380 WeakPolarHBondContact O-CG 3.3Å; I376-M380 PolarHBondContact O-N 3.01Å; I376-L393 HydrophobicContact CG2-CB 3.78Å
377T93.8Very high93Very high0 Ų036 Ų360%018%0.182CC..Hα-helixtrans-56.9-43.7178-50.60000111.5I135 P373 F375 M381 G390 G394I135-T377 HydrophobicContact CB-CG2 4.36Å; I135-T377 HydrophobicContact CG1-CG2 3.58Å; P373-T377 VanDerWaalsContact O-CB 3.32Å; P373-T377 WeakPolarHBondContact O-CB 3.11Å; P373-T377 PolarHBondContact O-N 3.28Å; P373-T377 PolarHBondContact O-OG1 3.41Å; F375-T377 VanDerWaalsContact C-N 3.29Å; F375-T377 PolarHBondContact O-N 2.96Å; T377-M381 HydrophobicContact CG2-CE 3.85Å; T377-M381 WeakPolarHBondContact O-CE 3.21Å; T377-M381 WeakPolarHBondContact O-CG 3.48Å; T377-G390 WeakPolarHBondContact CA-O 3.03Å; T377-G394 WeakPolarHBondContact OG1-CA 3.39Å
378A94.5Very high92.3Very high2 Ų234.9 Ų34.92%0.01718%0.176CC..Hα-helixtrans-72.9-44.8-175.400000113.2G138 L141 L360 A374 F375 I376 P382G138-A378 WeakPolarHBondContact CA-O 3.12Å; L141-A378 HydrophobicContact CD1-CB 4.2Å; L360-A378 HydrophobicContact CD2-CB 4.33Å; A374-A378 WeakPolarHBondContact O-CB 3.25Å; A374-A378 PolarHBondContact O-N 3.19Å; F375-A378 PolarHBondContact O-N 3.14Å; I376-A378 VanDerWaalsContact C-N 3.27Å; I376-A378 PolarHBondContact O-N 3.33Å; A378-P382 WeakPolarHBondContact O-CD 3.44Å
379V96.1Very high91.8Very high24 Ų2432.3 Ų32.315%0.14516%0.161CC..Hα-helixtrans-82.7-29.5-173.9-57.80000113.4F375 M381 P382 F383F375-V379 HydrophobicContact CD1-CG2 4.16Å; F375-V379 HydrophobicContact CD2-CG1 3.93Å; F375-V379 HydrophobicContact CE1-CG1 4.2Å; F375-V379 HydrophobicContact CE1-CG2 3.8Å; F375-V379 HydrophobicContact CE2-CG1 3.51Å; F375-V379 HydrophobicContact CG-CG1 4.44Å; F375-V379 HydrophobicContact CZ-CB 4.44Å; F375-V379 HydrophobicContact CZ-CG1 3.66Å; F375-V379 HydrophobicContact CZ-CG2 4.06Å; F375-V379 WeakPolarHBondContact O-CG2 3.05Å; F375-V379 PolarHBondContact O-N 3.15Å; V379-M381 PolarHBondContact O-N 3.48Å; V379-P382 VanDerWaalsContact O-CD 3.22Å; V379-P382 WeakPolarHBondContact O-CD 3.41Å; V379-P382 VanDerWaalsContact O-CG 3.3Å; V379-P382 WeakPolarHBondContact O-CG 3.33Å; V379-F383 HydrophobicContact CB-CD2 4.13Å; V379-F383 HydrophobicContact CB-CE2 4.11Å; V379-F383 WeakPolarHBondContact O-CB 3.46Å; V379-F383 WeakPolarHBondContact O-CG 3.39Å; V379-F383 PolarHBondContact O-N 3.46Å; V379-F383 VanDerWaalsContact O-N 3.12Å
380M94.8Very high91.6Very high58 Ų5832.1 Ų32.129%0.28616%0.16SC..Hα-helixtrans-66.2-29-179.2-74.8-54.1-59.200112I376 S384 L393I376-M380 HydrophobicContact CG2-CG 3.98Å; I376-M380 WeakPolarHBondContact O-CB 3.2Å; I376-M380 WeakPolarHBondContact O-CG 3.3Å; I376-M380 PolarHBondContact O-N 3.01Å; M380-S384 WeakPolarHBondContact O-CB 3.37Å; M380-S384 PolarHBondContact O-N 3.36Å; M380-S384 PolarHBondContact O-OG 3.31Å; M380-L393 HydrophobicContact CB-CD1 4.29Å; M380-L393 HydrophobicContact CE-CD1 3.42Å; M380-L393 VanDerWaalsContact CE-CD1 3.42Å; M380-L393 HydrophobicContact CG-CB 4.44Å; M380-L393 HydrophobicContact CG-CD1 3.74Å; M380-L393 HydrophobicContact SD-CD1 4.11Å
381M90.6Very high91.2Very high0 Ų030.5 Ų30.50%015%0.152CC..Hα-helixtrans-62.4-56.9177.7-59.2-175-171.200113.5I135 I139 F142 T377 V379 F385 S386 I387 I391I135-M381 HydrophobicContact CB-CE 4.35Å; I135-M381 HydrophobicContact CG1-CE 4.37Å; I135-M381 HydrophobicContact CG2-CE 4.24Å; I139-M381 HydrophobicContact CG1-SD 3.9Å; I139-M381 PolarHBondContact N-SD 2.94Å; I139-M381 VanDerWaalsContact N-SD 3.36Å; F142-M381 HydrophobicContact CB-CB 4.5Å; T377-M381 HydrophobicContact CG2-CE 3.85Å; T377-M381 WeakPolarHBondContact O-CE 3.21Å; T377-M381 WeakPolarHBondContact O-CG 3.48Å; V379-M381 PolarHBondContact O-N 3.48Å; M381-F385 WeakPolarHBondContact O-CA 3.4Å; M381-F385 PolarHBondContact O-N 3.49Å; M381-F385 VanDerWaalsContact O-N 3.15Å; M381-S386 WeakPolarHBondContact CA-O 3.28Å; M381-S386 PolarHBondContact O-N 3.2Å; M381-I387 HydrophobicContact CE-CG2 4.21Å; M381-I387 HydrophobicContact SD-CB 4.47Å; M381-I387 HydrophobicContact SD-CG2 3.76Å; M381-I391 HydrophobicContact CE-CG1 3.59Å
382P90.8Very high90.8Very high9 Ų930.1 Ų30.16%0.05815%0.15CC..Hα-helixtrans-65.6-39.9175.427.1-35.9000112.7L141 M145 A378 V379 F385L141-P382 HydrophobicContact CB-CB 4.46Å; L141-P382 HydrophobicContact CB-CG 3.9Å; M145-P382 HydrophobicContact SD-CB 3.92Å; A378-P382 WeakPolarHBondContact O-CD 3.44Å; V379-P382 VanDerWaalsContact O-CD 3.22Å; V379-P382 WeakPolarHBondContact O-CD 3.41Å; V379-P382 VanDerWaalsContact O-CG 3.3Å; V379-P382 WeakPolarHBondContact O-CG 3.33Å; P382-F385 PolarHBondContact O-N 2.56Å
383F92.5Very high90.7Very high157 Ų15730.6 Ų30.669%0.68915%0.151SC*.Hα-helixtrans-79-29.3-171.4-65.9-8.7000114.2V379V379-F383 HydrophobicContact CB-CD2 4.13Å; V379-F383 HydrophobicContact CB-CE2 4.11Å; V379-F383 WeakPolarHBondContact O-CB 3.46Å; V379-F383 WeakPolarHBondContact O-CG 3.39Å; V379-F383 PolarHBondContact O-N 3.46Å; V379-F383 VanDerWaalsContact O-N 3.12Å
384S88.6Confident90.6Very high46 Ų4630.6 Ų30.632%0.32215%0.151SC..Hα-helixtrans-90.7-4.3170.570.70000112.9M380 S386M380-S384 WeakPolarHBondContact O-CB 3.37Å; M380-S384 PolarHBondContact O-N 3.36Å; M380-S384 PolarHBondContact O-OG 3.31Å; S384-S386 PolarHBondContact O-N 2.91Å; S384-S386 VanDerWaalsContact O-N 3.14Å; S384-S386 PolarHBondContact OG-N 3.25Å; S384-S386 PolarHBondContact OG-O 3.47Å
385F83.6Confident90.4Very high63 Ų6330.6 Ų30.628%0.27615%0.151SC..THydrogen-bonded Turntrans5427.2-171.1-148.4-98000113F87 V88 F142 M146 M381 P382F87-F385 HydrophobicContact CB-CE1 3.66Å; F87-F385 HydrophobicContact CB-CZ 3.97Å; F87-F385 HydrophobicContact CG-CZ 4.47Å; V88-F385 HydrophobicContact CG2-CD1 3.92Å; V88-F385 HydrophobicContact CG2-CE1 4.12Å; V88-F385 WeakPolarHBondContact CG2-O 3.23Å; F142-F385 HydrophobicContact CE2-CD1 4.15Å; F142-F385 AromaticContact CE2-CD2 3.7Å; F142-F385 HydrophobicContact CE2-CD2 3.7Å; F142-F385 HydrophobicContact CE2-CE1 4.24Å; F142-F385 AromaticContact CE2-CE2 3.8Å; F142-F385 HydrophobicContact CE2-CE2 3.8Å; F142-F385 AromaticContact CE2-CG 3.88Å; F142-F385 HydrophobicContact CE2-CG 3.88Å; F142-F385 HydrophobicContact CE2-CZ 4.08Å; F142-F385 HydrophobicContact CZ-CD1 4.37Å; F142-F385 HydrophobicContact CZ-CE1 4.19Å; F142-F385 HydrophobicContact CZ-CE2 4.36Å; F142-F385 HydrophobicContact CZ-CZ 4.19Å; M146-F385 HydrophobicContact SD-CE2 3.61Å; M146-F385 HydrophobicContact SD-CZ 3.46Å; M146-F385 WeakPolarHBondContact SD-CZ 3.5Å; M381-F385 WeakPolarHBondContact O-CA 3.4Å; M381-F385 PolarHBondContact O-N 3.49Å; M381-F385 VanDerWaalsContact O-N 3.15Å; P382-F385 PolarHBondContact O-N 2.56Å
386S82.6Confident90.3Very high6 Ų626.9 Ų26.94%0.04214%0.135CC..  trans-139117-178.5178.10000111.8M381 S384 T388 E389 G390M381-S386 WeakPolarHBondContact CA-O 3.28Å; M381-S386 PolarHBondContact O-N 3.2Å; S384-S386 PolarHBondContact O-N 2.91Å; S384-S386 VanDerWaalsContact O-N 3.14Å; S384-S386 PolarHBondContact OG-N 3.25Å; S384-S386 PolarHBondContact OG-O 3.47Å; S386-T388 VanDerWaalsContact C-N 3.29Å; S386-T388 PolarHBondContact O-N 2.77Å; S386-T388 PolarHBondContact OG-N 3.03Å; S386-E389 WeakPolarHBondContact CB-OE1 3.22Å; S386-E389 PolarHBondContact OG-N 2.91Å; S386-E389 PolarHBondContact OG-OE1 3.37Å; S386-E389 PolarHBondContact OG-OE2 2.92Å; S386-G390 PolarHBondContact O-N 3.32Å
387I81.3Confident90.3Very high0 Ų025.3 Ų25.30%013%0.128CC..Hα-helixtrans-64.8-40.2175.9-53.8-177.7000110G80 F84 I139 F142 V250 M381 E389 G390 I391G80-I387 WeakPolarHBondContact O-CD1 3.2Å; F84-I387 HydrophobicContact CB-CD1 3.97Å; I139-I387 HydrophobicContact CD1-CG2 4.49Å; I139-I387 HydrophobicContact CG1-CG2 3.98Å; F142-I387 HydrophobicContact CD1-CD1 4.07Å; F142-I387 HydrophobicContact CD1-CG1 4.12Å; F142-I387 HydrophobicContact CE1-CD1 4.27Å; F142-I387 HydrophobicContact CE1-CG1 4.33Å; V250-I387 HydrophobicContact CB-CG2 4.34Å; V250-I387 HydrophobicContact CG1-CD1 4.37Å; V250-I387 HydrophobicContact CG1-CG2 3.81Å; V250-I387 HydrophobicContact CG2-CB 4.05Å; V250-I387 HydrophobicContact CG2-CG2 3.48Å; V250-I387 VanDerWaalsContact CG2-CG2 3.48Å; M381-I387 HydrophobicContact CE-CG2 4.21Å; M381-I387 HydrophobicContact SD-CB 4.47Å; M381-I387 HydrophobicContact SD-CG2 3.76Å; I387-E389 PolarHBondContact O-N 2.89Å; I387-G390 PolarHBondContact O-N 2.89Å; I387-I391 HydrophobicContact CG2-CD1 4.08Å; I387-I391 HydrophobicContact CG2-CG1 4.47Å; I387-I391 WeakPolarHBondContact O-CG1 3.26Å; I387-I391 PolarHBondContact O-N 3.09Å
388T80.5Confident90.4Very high5 Ų525.6 Ų25.63%0.03113%0.13CC..Hα-helixtrans-58.5-48.8-179.5-48.60000111.5S246 S386 G390 I391 A392 F422S246-T388 WeakPolarHBondContact CB-OG1 3.49Å; S246-T388 WeakPolarHBondContact OG-CB 3.41Å; S246-T388 WeakPolarHBondContact OG-CG2 3.17Å; S246-T388 PolarHBondContact OG-OG1 3.15Å; S386-T388 VanDerWaalsContact C-N 3.29Å; S386-T388 PolarHBondContact O-N 2.77Å; S386-T388 PolarHBondContact OG-N 3.03Å; T388-G390 VanDerWaalsContact C-N 3.29Å; T388-G390 PolarHBondContact O-N 2.56Å; T388-I391 PolarHBondContact O-N 3.01Å; T388-A392 WeakPolarHBondContact O-CB 3.47Å; T388-A392 PolarHBondContact O-N 2.77Å; T388-F422 HydrophobicContact CG2-CE1 4.21Å
389E86.2Confident90.5Very high59 Ų5926.1 Ų26.128%0.27613%0.133SC..Hα-helixtrans-68.3-36-176.1-80.760.2103.500109.8S386 I387 A392 L393 K425S386-E389 WeakPolarHBondContact CB-OE1 3.22Å; S386-E389 PolarHBondContact OG-N 2.91Å; S386-E389 PolarHBondContact OG-OE1 3.37Å; S386-E389 PolarHBondContact OG-OE2 2.92Å; I387-E389 PolarHBondContact O-N 2.89Å; E389-A392 PolarHBondContact O-N 3.37Å; E389-L393 WeakPolarHBondContact O-CB 3.28Å; E389-L393 VanDerWaalsContact O-CG 3.28Å; E389-L393 WeakPolarHBondContact O-CG 3.48Å; E389-L393 PolarHBondContact O-N 3.14Å; E389-K425 IonicContact OE2-NZ 3.01Å; E389-K425 PolarHBondContact OE2-NZ 3.23Å
390G90.3Very high90.5Very high0 Ų029.3 Ų29.30%015%0.152CC..Hα-helixtrans-62.1-44.9172.100000113.5T377 S386 I387 T388 G394T377-G390 WeakPolarHBondContact CA-O 3.03Å; S386-G390 PolarHBondContact O-N 3.32Å; I387-G390 PolarHBondContact O-N 2.89Å; T388-G390 VanDerWaalsContact C-N 3.29Å; T388-G390 PolarHBondContact O-N 2.56Å; G390-G394 PolarHBondContact O-N 2.81Å
391I87.3Confident90.6Very high1 Ų128.7 Ų28.71%0.00515%0.149CC..Hα-helixtrans-63.2-46.8174.8-63.1171.3000110.2I135 V250 F253 M381 I387 T388 L393 G394 F395 F422I135-I391 HydrophobicContact CD1-CG1 4.35Å; I135-I391 HydrophobicContact CD1-CG2 4.26Å; I135-I391 HydrophobicContact CG1-CG1 4.12Å; I135-I391 HydrophobicContact CG2-CD1 4.37Å; I135-I391 HydrophobicContact CG2-CG1 4.31Å; V250-I391 HydrophobicContact CB-CD1 4.41Å; V250-I391 HydrophobicContact CG2-CD1 3.67Å; F253-I391 HydrophobicContact CD2-CD1 4.18Å; F253-I391 HydrophobicContact CD2-CG2 4.23Å; F253-I391 HydrophobicContact CE2-CG2 3.94Å; M381-I391 HydrophobicContact CE-CG1 3.59Å; I387-I391 HydrophobicContact CG2-CD1 4.08Å; I387-I391 HydrophobicContact CG2-CG1 4.47Å; I387-I391 WeakPolarHBondContact O-CG1 3.26Å; I387-I391 PolarHBondContact O-N 3.09Å; T388-I391 PolarHBondContact O-N 3.01Å; I391-L393 PolarHBondContact O-N 2.9Å; I391-G394 WeakPolarHBondContact O-CA 3.45Å; I391-G394 PolarHBondContact O-N 3.08Å; I391-F395 HydrophobicContact CG2-CD2 3.79Å; I391-F395 HydrophobicContact CG2-CE2 3.84Å; I391-F395 WeakPolarHBondContact O-CD2 3.38Å; I391-F395 PolarHBondContact O-N 3.28Å; I391-F422 HydrophobicContact CB-CZ 4.31Å; I391-F422 HydrophobicContact CG2-CE2 3.83Å; I391-F422 HydrophobicContact CG2-CZ 3.77Å
392A89.3Confident90.8Very high0 Ų028.7 Ų28.70%015%0.149CC..Hα-helixtrans-56.3-54.5-178.200000111.8T388 E389 G394 F395 I396 F422 I426T388-A392 WeakPolarHBondContact O-CB 3.47Å; T388-A392 PolarHBondContact O-N 2.77Å; E389-A392 PolarHBondContact O-N 3.37Å; A392-G394 PolarHBondContact O-N 3.38Å; A392-F395 PolarHBondContact O-N 3.15Å; A392-I396 WeakPolarHBondContact O-CB 3.47Å; A392-I396 VanDerWaalsContact O-CG1 3.23Å; A392-I396 WeakPolarHBondContact O-CG1 3.39Å; A392-I396 PolarHBondContact O-N 2.94Å; A392-F422 HydrophobicContact CB-CB 3.84Å; A392-F422 HydrophobicContact CB-CD1 3.42Å; A392-F422 VanDerWaalsContact CB-CD1 3.42Å; A392-F422 HydrophobicContact CB-CD2 4.14Å; A392-F422 HydrophobicContact CB-CE1 3.86Å; A392-F422 HydrophobicContact CB-CE2 4.5Å; A392-F422 HydrophobicContact CB-CG 3.56Å; A392-F422 HydrophobicContact CB-CZ 4.35Å; A392-I426 HydrophobicContact CB-CD1 4.39Å
393L94.2Very high91Very high56 Ų5633.1 Ų33.129%0.29317%0.171SC..Hα-helixtrans-66-29.9179.6-65.8172.9000112I376 M380 E389 I391 S397I376-L393 HydrophobicContact CG2-CB 3.78Å; M380-L393 HydrophobicContact CB-CD1 4.29Å; M380-L393 HydrophobicContact CE-CD1 3.42Å; M380-L393 VanDerWaalsContact CE-CD1 3.42Å; M380-L393 HydrophobicContact CG-CB 4.44Å; M380-L393 HydrophobicContact CG-CD1 3.74Å; M380-L393 HydrophobicContact SD-CD1 4.11Å; E389-L393 WeakPolarHBondContact O-CB 3.28Å; E389-L393 VanDerWaalsContact O-CG 3.28Å; E389-L393 WeakPolarHBondContact O-CG 3.48Å; E389-L393 PolarHBondContact O-N 3.14Å; I391-L393 PolarHBondContact O-N 2.9Å; L393-S397 WeakPolarHBondContact O-CB 3.5Å; L393-S397 PolarHBondContact O-N 3.31Å; L393-S397 PolarHBondContact O-OG 3.12Å
394G94.2Very high91.2Very high0 Ų029 Ų290%017%0.173CC..Hα-helixtrans-57.9-57.6169.500000113.3L131 T377 G390 I391 A392 I396 S397 Y398L131-G394 VanDerWaalsContact CD2-C 3.5Å; L131-G394 WeakPolarHBondContact CD2-O 3.35Å; T377-G394 WeakPolarHBondContact OG1-CA 3.39Å; G390-G394 PolarHBondContact O-N 2.81Å; I391-G394 WeakPolarHBondContact O-CA 3.45Å; I391-G394 PolarHBondContact O-N 3.08Å; A392-G394 PolarHBondContact O-N 3.38Å; G394-I396 PolarHBondContact O-N 3.42Å; G394-S397 PolarHBondContact O-N 3.46Å; G394-S397 PolarHBondContact O-OG 3.47Å; G394-Y398 PolarHBondContact O-N 3.16Å
395F92.6Very high91.5Very high0 Ų030.2 Ų30.20%018%0.179CC..Hα-helixtrans-62.2-42.6179.5-86.6-97.2000112.3I127 L131 I135 F253 I391 A392 Y398 C399 V415 V418 A419 F422I127-F395 HydrophobicContact CD1-CZ 4.06Å; I127-F395 HydrophobicContact CG1-CE1 4.28Å; I127-F395 HydrophobicContact CG1-CZ 4.12Å; I127-F395 HydrophobicContact CG2-CZ 4.1Å; L131-F395 HydrophobicContact CD1-CD1 3.85Å; L131-F395 HydrophobicContact CD1-CD2 4.21Å; L131-F395 HydrophobicContact CD1-CE1 3.9Å; L131-F395 HydrophobicContact CD1-CE2 4.28Å; L131-F395 HydrophobicContact CD1-CG 4Å; L131-F395 HydrophobicContact CD1-CZ 4.13Å; I135-F395 HydrophobicContact CD1-CE2 4.08Å; F253-F395 HydrophobicContact CE1-CZ 4.39Å; F253-F395 AromaticContact CE2-CE2 3.89Å; F253-F395 HydrophobicContact CE2-CE2 3.89Å; F253-F395 HydrophobicContact CE2-CZ 4.17Å; F253-F395 AromaticContact CZ-CE2 3.96Å; F253-F395 HydrophobicContact CZ-CE2 3.96Å; F253-F395 AromaticContact CZ-CZ 3.74Å; F253-F395 HydrophobicContact CZ-CZ 3.74Å; I391-F395 HydrophobicContact CG2-CD2 3.79Å; I391-F395 HydrophobicContact CG2-CE2 3.84Å; I391-F395 WeakPolarHBondContact O-CD2 3.38Å; I391-F395 PolarHBondContact O-N 3.28Å; A392-F395 PolarHBondContact O-N 3.15Å; F395-Y398 PolarHBondContact O-N 3.15Å; F395-C399 PolarHBondContact O-N 3Å; F395-C399 VanDerWaalsContact O-N 3.1Å; F395-V415 HydrophobicContact CD1-CB 4.43Å; F395-V415 HydrophobicContact CD1-CG1 3.96Å; F395-V415 HydrophobicContact CE1-CG1 4.42Å; F395-V415 HydrophobicContact CE1-CG2 4.21Å; F395-V418 HydrophobicContact CB-CG1 4.39Å; F395-V418 HydrophobicContact CD1-CB 3.79Å; F395-V418 HydrophobicContact CD1-CG1 3.54Å; F395-V418 HydrophobicContact CD2-CG1 4.11Å; F395-V418 HydrophobicContact CE1-CB 3.94Å; F395-V418 HydrophobicContact CE1-CG1 3.73Å; F395-V418 HydrophobicContact CE1-CG2 4.45Å; F395-V418 HydrophobicContact CE2-CG1 4.26Å; F395-V418 HydrophobicContact CG-CB 4.45Å; F395-V418 HydrophobicContact CG-CG1 3.75Å; F395-V418 HydrophobicContact CZ-CG1 4.09Å; F395-A419 HydrophobicContact CB-CB 4.24Å; F395-F422 HydrophobicContact CB-CD2 4.43Å; F395-F422 HydrophobicContact CD2-CE2 4.41Å
396I95.1Very high91.9Very high31 Ų3130 Ų3016%0.15920%0.195CC..Hα-helixtrans-62-48.9178-66.7167.4000110.4A392 G394 Y398 C399 V400 A419 F422 I423 I426A392-I396 WeakPolarHBondContact O-CB 3.47Å; A392-I396 VanDerWaalsContact O-CG1 3.23Å; A392-I396 WeakPolarHBondContact O-CG1 3.39Å; A392-I396 PolarHBondContact O-N 2.94Å; G394-I396 PolarHBondContact O-N 3.42Å; I396-Y398 VanDerWaalsContact C-N 3.31Å; I396-Y398 PolarHBondContact O-N 3.06Å; I396-C399 PolarHBondContact O-N 3.49Å; I396-V400 HydrophobicContact CG2-CG2 4.29Å; I396-V400 WeakPolarHBondContact O-CG2 3.42Å; I396-V400 PolarHBondContact O-N 3.03Å; I396-A419 HydrophobicContact CG1-CB 4.44Å; I396-F422 HydrophobicContact CD1-CB 4.22Å; I396-I423 HydrophobicContact CD1-CG1 3.66Å; I396-I423 HydrophobicContact CG1-CD1 4.29Å; I396-I423 HydrophobicContact CG1-CG1 3.81Å; I396-I426 HydrophobicContact CD1-CD1 3.87Å
397S96.6Very high92.4Very high14 Ų1434.6 Ų34.610%0.09821%0.211CC..Hα-helixtrans-63.1-36.1179.560.40000112.4P373 L393 G394 V400 M401P373-S397 WeakPolarHBondContact CA-OG 3.46Å; L393-S397 WeakPolarHBondContact O-CB 3.5Å; L393-S397 PolarHBondContact O-N 3.31Å; L393-S397 PolarHBondContact O-OG 3.12Å; G394-S397 PolarHBondContact O-N 3.46Å; G394-S397 PolarHBondContact O-OG 3.47Å; S397-V400 PolarHBondContact O-N 3.37Å; S397-M401 WeakPolarHBondContact O-CB 3.44Å; S397-M401 VanDerWaalsContact O-CG 3.23Å; S397-M401 WeakPolarHBondContact O-CG 3.38Å; S397-M401 PolarHBondContact O-N 3.31Å
398Y96.1Very high92.7Very high7 Ų739.7 Ų39.73%0.02724%0.238CC..Hα-helixtrans-61.4-47.3173.4-171.4-86.6000112P128 L131 P373 G394 F395 I396 M401 K402 L411 V415P128-Y398 HydrophobicContact CB-CD2 4.29Å; P128-Y398 HydrophobicContact CB-CE2 3.58Å; P128-Y398 HydrophobicContact CG-CD1 4.18Å; P128-Y398 HydrophobicContact CG-CD2 4.11Å; P128-Y398 HydrophobicContact CG-CE1 3.53Å; P128-Y398 HydrophobicContact CG-CE2 3.48Å; P128-Y398 VanDerWaalsContact CG-CE2 3.48Å; P128-Y398 HydrophobicContact CG-CG 4.43Å; P128-Y398 VanDerWaalsContact CG-OH 3.26Å; P128-Y398 WeakPolarHBondContact CG-OH 3.27Å; L131-Y398 HydrophobicContact CD1-CD2 4.38Å; L131-Y398 HydrophobicContact CD1-CG 4.05Å; L131-Y398 HydrophobicContact CG-CD2 4.2Å; L131-Y398 HydrophobicContact CG-CG 4.31Å; P373-Y398 HydrophobicContact CB-CD2 4.09Å; P373-Y398 HydrophobicContact CB-CG 4.48Å; P373-Y398 VanDerWaalsContact CG-CA 3.5Å; P373-Y398 HydrophobicContact CG-CD2 3.95Å; P373-Y398 HydrophobicContact CG-CG 4.38Å; G394-Y398 PolarHBondContact O-N 3.16Å; F395-Y398 PolarHBondContact O-N 3.15Å; I396-Y398 VanDerWaalsContact C-N 3.31Å; I396-Y398 PolarHBondContact O-N 3.06Å; Y398-M401 PolarHBondContact O-N 2.69Å; Y398-K402 HydrophobicContact CD1-CG 4.05Å; Y398-K402 HydrophobicContact CE1-CG 3.67Å; Y398-K402 HydrophobicContact CE2-CG 4.42Å; Y398-K402 VanDerWaalsContact CZ-CE 3.44Å; Y398-K402 WeakPolarHBondContact O-CG 3.21Å; Y398-K402 PolarHBondContact O-N 3.34Å; Y398-K402 VanDerWaalsContact OH-CE 3.3Å; Y398-K402 WeakPolarHBondContact OH-CE 3.29Å; Y398-L411 HydrophobicContact CD1-CD2 3.83Å; Y398-L411 HydrophobicContact CE1-CD2 3.79Å; Y398-V415 HydrophobicContact CD1-CG1 3.67Å; Y398-V415 HydrophobicContact CE1-CG1 4.25Å; Y398-V415 HydrophobicContact CG-CG1 4.48Å
399C96.1Very high93Very high13 Ų1351.2 Ų51.29%0.08828%0.281CS..Hα-helixtrans-58.8-48.7174.8-77.50000111.8F395 I396 M401 K402 I403 A419F395-C399 PolarHBondContact O-N 3Å; F395-C399 VanDerWaalsContact O-N 3.1Å; I396-C399 PolarHBondContact O-N 3.49Å; C399-M401 PolarHBondContact O-N 3.46Å; C399-K402 PolarHBondContact O-N 3.07Å; C399-I403 WeakPolarHBondContact O-CB 3.39Å; C399-I403 WeakPolarHBondContact O-CD1 3.1Å; C399-I403 WeakPolarHBondContact O-CG1 3.26Å; C399-I403 PolarHBondContact O-N 3.33Å; C399-A419 HydrophobicContact CB-CB 4.29Å; C399-A419 VanDerWaalsContact SG-CB 3.54Å
400V96.4Very high93Very high91 Ų9152 Ų5255%0.55229%0.286SS*.Hα-helixtrans-59.3-46.4179.6171.40000111.2I396 S397 G404I396-V400 HydrophobicContact CG2-CG2 4.29Å; I396-V400 WeakPolarHBondContact O-CG2 3.42Å; I396-V400 PolarHBondContact O-N 3.03Å; S397-V400 PolarHBondContact O-N 3.37Å; V400-G404 PolarHBondContact O-N 3.12Å
401M96.5Very high92.9Very high45 Ų4552.9 Ų52.922%0.22229%0.291CS..Hα-helixtrans-64.7-45.2-179.2-72.9-58.4-67.600112.1L368 V372 P373 S397 Y398 C399 T405L368-M401 HydrophobicContact CB-CE 4.23Å; L368-M401 WeakPolarHBondContact O-CE 3.25Å; V372-M401 HydrophobicContact CB-CE 4.36Å; V372-M401 HydrophobicContact CB-CG 4.33Å; V372-M401 HydrophobicContact CB-SD 4.45Å; V372-M401 HydrophobicContact CG1-CG 4.21Å; V372-M401 HydrophobicContact CG1-SD 4.24Å; V372-M401 HydrophobicContact CG2-CE 4.26Å; P373-M401 HydrophobicContact CG-CB 4.48Å; P373-M401 HydrophobicContact CG-CG 4.25Å; S397-M401 WeakPolarHBondContact O-CB 3.44Å; S397-M401 VanDerWaalsContact O-CG 3.23Å; S397-M401 WeakPolarHBondContact O-CG 3.38Å; S397-M401 PolarHBondContact O-N 3.31Å; Y398-M401 PolarHBondContact O-N 2.69Å; C399-M401 PolarHBondContact O-N 3.46Å; M401-T405 WeakPolarHBondContact O-CB 3.36Å; M401-T405 WeakPolarHBondContact O-CG2 3.47Å; M401-T405 PolarHBondContact O-N 2.9Å; M401-T405 PolarHBondContact O-OG1 3Å
402K96.1Very high93Very high0 Ų053.6 Ų53.60%030%0.296CS..Hα-helixtrans-70.7-38.2-179.4-66.4-62-175.4174.60112.6T369 E370 Y398 C399 G406 R407 D410 L411T369-K402 PolarHBondContact OG1-NZ 2.86Å; E370-K402 VanDerWaalsContact OE1-CE 3.25Å; E370-K402 WeakPolarHBondContact OE1-CE 3.23Å; E370-K402 IonicContact OE1-NZ 2.67Å; E370-K402 PolarHBondContact OE1-NZ 2.93Å; Y398-K402 HydrophobicContact CD1-CG 4.05Å; Y398-K402 HydrophobicContact CE1-CG 3.67Å; Y398-K402 HydrophobicContact CE2-CG 4.42Å; Y398-K402 VanDerWaalsContact CZ-CE 3.44Å; Y398-K402 WeakPolarHBondContact O-CG 3.21Å; Y398-K402 PolarHBondContact O-N 3.34Å; Y398-K402 VanDerWaalsContact OH-CE 3.3Å; Y398-K402 WeakPolarHBondContact OH-CE 3.29Å; C399-K402 PolarHBondContact O-N 3.07Å; K402-G406 PolarHBondContact O-N 3.39Å; K402-R407 HydrophobicContact CD-CB 3.93Å; K402-R407 CarbonylContact O-C 3.19Å; K402-R407 PolarHBondContact O-N 3.47Å; K402-D410 HydrophobicContact CD-CB 3.95Å; K402-D410 IonicContact NZ-OD2 3.68Å; K402-D410 PolarHBondContact NZ-OD2 2.99Å; K402-L411 HydrophobicContact CB-CD1 3.88Å; K402-L411 HydrophobicContact CB-CD2 3.88Å; K402-L411 HydrophobicContact CB-CG 3.72Å; K402-L411 HydrophobicContact CG-CD2 4.19Å; K402-L411 HydrophobicContact CG-CG 4.32Å
403I95.7Very high92.9Very high101 Ų10157.2 Ų57.252%0.51832%0.32SS..Hα-helixtrans-66.1-51.2174.4-65.8168.2000109.9C399 T405 G406 L408 L411C399-I403 WeakPolarHBondContact O-CB 3.39Å; C399-I403 WeakPolarHBondContact O-CD1 3.1Å; C399-I403 WeakPolarHBondContact O-CG1 3.26Å; C399-I403 PolarHBondContact O-N 3.33Å; I403-T405 VanDerWaalsContact C-N 3.25Å; I403-T405 PolarHBondContact O-N 3.42Å; I403-G406 PolarHBondContact O-N 3.14Å; I403-G406 VanDerWaalsContact O-N 3.08Å; I403-L408 HydrophobicContact CB-CD2 4.26Å; I403-L408 HydrophobicContact CG1-CD2 3.8Å; I403-L408 HydrophobicContact CG2-CD2 4.43Å; I403-L411 HydrophobicContact CD1-CD1 4.41Å; I403-L411 HydrophobicContact CG1-CD1 3.69Å
404G95.8Very high92.4Very high71 Ų7154.7 Ų54.773%0.73231%0.307SS*.Hα-helixtrans-64.9-24.8-176.100000114.4V400V400-G404 PolarHBondContact O-N 3.12Å
405T95.5Very high92.1Very high71 Ų7154.7 Ų54.744%0.43631%0.307SS..THydrogen-bonded Turntrans-97.54.817658.60000114T369 M401 I403 R407T369-T405 HydrophobicContact CG2-CG2 3.76Å; T369-T405 WeakPolarHBondContact CG2-OG1 3.33Å; M401-T405 WeakPolarHBondContact O-CB 3.36Å; M401-T405 WeakPolarHBondContact O-CG2 3.47Å; M401-T405 PolarHBondContact O-N 2.9Å; M401-T405 PolarHBondContact O-OG1 3Å; I403-T405 VanDerWaalsContact C-N 3.25Å; I403-T405 PolarHBondContact O-N 3.42Å; T405-R407 VanDerWaalsContact C-N 3.26Å; T405-R407 PolarHBondContact O-N 3.3Å
406G92.5Very high92.1Very high59 Ų5958 Ų5861%0.60832%0.324SS*.THydrogen-bonded Turntrans749.6179.100000115.1K402 I403 L408K402-G406 PolarHBondContact O-N 3.39Å; I403-G406 PolarHBondContact O-N 3.14Å; I403-G406 VanDerWaalsContact O-N 3.08Å; G406-L408 PolarHBondContact O-N 2.99Å; G406-L408 VanDerWaalsContact O-N 3.12Å
407R91.4Very high91.7Very high102 Ų10260.8 Ų60.839%0.38534%0.338SS..  trans-87.949.6179.6-62.1-166.9-174.2-176.911.3112.7D367 T369 K402 T405 R409 D410D367-R407 IonicContact OD1-CZ 2.81Å; D367-R407 IonicContact OD1-NH1 2.91Å; D367-R407 IonicContact OD1-NH2 3.77Å; D367-R407 IonicContact OD2-CZ 2.73Å; D367-R407 IonicContact OD2-NH1 2.7Å; D367-R407 PolarHBondContact OD2-NH1 3.47Å; D367-R407 IonicContact OD2-NH2 3.49Å; D367-R407 PolarHBondContact OD2-NH2 2.93Å; T369-R407 PolarHBondContact OG1-NH1 2.95Å; K402-R407 HydrophobicContact CD-CB 3.93Å; K402-R407 CarbonylContact O-C 3.19Å; K402-R407 PolarHBondContact O-N 3.47Å; T405-R407 VanDerWaalsContact C-N 3.26Å; T405-R407 PolarHBondContact O-N 3.3Å; R407-R409 PolarHBondContact O-N 3.15Å; R407-R409 VanDerWaalsContact O-N 3.12Å; R407-D410 PolarHBondContact O-N 3.32Å; R407-D410 VanDerWaalsContact O-N 3.15Å
408L88.4Confident91.2Very high107 Ų10760.7 Ų60.756%0.5634%0.337SS*.G310 helixtrans-61.7-23.2-177.1-64.2171.9000113.6I403 G406 D410 L411I403-L408 HydrophobicContact CB-CD2 4.26Å; I403-L408 HydrophobicContact CG1-CD2 3.8Å; I403-L408 HydrophobicContact CG2-CD2 4.43Å; G406-L408 PolarHBondContact O-N 2.99Å; G406-L408 VanDerWaalsContact O-N 3.12Å; L408-D410 VanDerWaalsContact C-N 3.27Å; L408-D410 PolarHBondContact O-N 3.5Å; L408-L411 HydrophobicContact CD2-CD1 4.14Å; L408-L411 PolarHBondContact O-N 3.22Å
409R87.2Confident90.9Very high248 Ų24860.5 Ų60.594%0.93634%0.337SS*.G310 helixtrans-70.3-22.7179.5-64.2-178.2177.6-178.3-0.8113.5R407 L411R407-R409 PolarHBondContact O-N 3.15Å; R407-R409 VanDerWaalsContact O-N 3.12Å; R409-L411 VanDerWaalsContact C-N 3.26Å
410D85.8Confident90.7Very high74 Ų7464.3 Ų64.340%0.39636%0.356SS..G310 helixtrans-81.9-9178.6-61.3-11.5000111.9K402 R407 L408 S412K402-D410 HydrophobicContact CD-CB 3.95Å; K402-D410 IonicContact NZ-OD2 3.68Å; K402-D410 PolarHBondContact NZ-OD2 2.99Å; R407-D410 PolarHBondContact O-N 3.32Å; R407-D410 VanDerWaalsContact O-N 3.15Å; L408-D410 VanDerWaalsContact C-N 3.27Å; L408-D410 PolarHBondContact O-N 3.5Å; D410-S412 PolarHBondContact O-N 2.87Å
411L89.1Confident90.1Very high19 Ų1963.9 Ų63.910%0.09935%0.35CS..  trans-86.4109.3-179.3-72166.6000110.4Y398 K402 I403 L408 R409 V415 I416Y398-L411 HydrophobicContact CD1-CD2 3.83Å; Y398-L411 HydrophobicContact CE1-CD2 3.79Å; K402-L411 HydrophobicContact CB-CD1 3.88Å; K402-L411 HydrophobicContact CB-CD2 3.88Å; K402-L411 HydrophobicContact CB-CG 3.72Å; K402-L411 HydrophobicContact CG-CD2 4.19Å; K402-L411 HydrophobicContact CG-CG 4.32Å; I403-L411 HydrophobicContact CD1-CD1 4.41Å; I403-L411 HydrophobicContact CG1-CD1 3.69Å; L408-L411 HydrophobicContact CD2-CD1 4.14Å; L408-L411 PolarHBondContact O-N 3.22Å; R409-L411 VanDerWaalsContact C-N 3.26Å; L411-V415 HydrophobicContact CD2-CG1 4.44Å; L411-I416 HydrophobicContact CB-CD1 3.96Å; L411-I416 HydrophobicContact CB-CG1 4.18Å; L411-I416 HydrophobicContact CD2-CG1 4.47Å
412S87.8Confident89.7Confident16 Ų1661.8 Ų61.811%0.11234%0.34CS..  trans-72.7147.116871.80000110.3N126 D410 C414 V415 I416N126-S412 WeakPolarHBondContact O-CB 3.29Å; N126-S412 PolarHBondContact O-OG 3.34Å; D410-S412 PolarHBondContact O-N 2.87Å; S412-C414 PolarHBondContact O-N 2.87Å; S412-C414 VanDerWaalsContact O-N 3.14Å; S412-V415 PolarHBondContact O-N 3.15Å; S412-V415 VanDerWaalsContact O-N 3.08Å; S412-V415 VanDerWaalsContact OG-CG2 3.27Å; S412-V415 WeakPolarHBondContact OG-CG2 3.36Å; S412-V415 PolarHBondContact OG-N 2.97Å; S412-I416 PolarHBondContact O-N 3.1Å
413P86.8Confident89.3Confident77 Ų7765.3 Ų65.350%0.536%0.358SS..Hα-helixtrans-54.8-32.7173.9-26.534.4000112.6W122 V415 I416 I417W122-P413 HydrophobicContact CH2-CB 4.44Å; W122-P413 HydrophobicContact CZ2-CB 4.39Å; P413-V415 PolarHBondContact O-N 3.21Å; P413-I416 PolarHBondContact O-N 2.69Å; P413-I417 WeakPolarHBondContact O-CB 3.32Å; P413-I417 WeakPolarHBondContact O-CD1 3.26Å; P413-I417 VanDerWaalsContact O-CG1 3.23Å; P413-I417 WeakPolarHBondContact O-CG1 3.36Å; P413-I417 PolarHBondContact O-N 2.87Å
414C84.5Confident88.8Confident3 Ų364.3 Ų64.32%0.0235%0.353CS..Hα-helixtrans-58.5-48.7176.7-173.60000111.9W122 N126 S412 I416 I417 V418W122-C414 HydrophobicContact CE3-CB 4.15Å; W122-C414 VanDerWaalsContact CH2-CA 3.48Å; W122-C414 HydrophobicContact CH2-CB 3.44Å; W122-C414 VanDerWaalsContact CH2-CB 3.44Å; W122-C414 HydrophobicContact CZ2-CB 4.15Å; W122-C414 HydrophobicContact CZ3-CB 3.43Å; W122-C414 VanDerWaalsContact CZ3-CB 3.43Å; N126-C414 HydrophobicContact CB-CB 3.78Å; S412-C414 PolarHBondContact O-N 2.87Å; S412-C414 VanDerWaalsContact O-N 3.14Å; C414-I416 VanDerWaalsContact C-N 3.34Å; C414-I416 PolarHBondContact O-N 3.48Å; C414-I417 PolarHBondContact O-N 2.89Å; C414-V418 WeakPolarHBondContact O-CB 3.33Å; C414-V418 VanDerWaalsContact O-CG2 3.25Å; C414-V418 WeakPolarHBondContact O-CG2 3.4Å; C414-V418 PolarHBondContact O-N 3.41Å
415V88.9Confident88.1Confident0 Ų062.2 Ų62.20%032%0.324CS..Hα-helixtrans-66.4-40.8-176.71750000110.4P128 L131 F395 Y398 L411 S412 P413 V418 A419P128-V415 VanDerWaalsContact CD-CG2 3.47Å; P128-V415 HydrophobicContact CG-CG2 4.16Å; L131-V415 HydrophobicContact CD1-CG1 4.31Å; F395-V415 HydrophobicContact CD1-CB 4.43Å; F395-V415 HydrophobicContact CD1-CG1 3.96Å; F395-V415 HydrophobicContact CE1-CG1 4.42Å; F395-V415 HydrophobicContact CE1-CG2 4.21Å; Y398-V415 HydrophobicContact CD1-CG1 3.67Å; Y398-V415 HydrophobicContact CE1-CG1 4.25Å; Y398-V415 HydrophobicContact CG-CG1 4.48Å; L411-V415 HydrophobicContact CD2-CG1 4.44Å; S412-V415 PolarHBondContact O-N 3.15Å; S412-V415 VanDerWaalsContact O-N 3.08Å; S412-V415 VanDerWaalsContact OG-CG2 3.27Å; S412-V415 WeakPolarHBondContact OG-CG2 3.36Å; S412-V415 PolarHBondContact OG-N 2.97Å; P413-V415 PolarHBondContact O-N 3.21Å; V415-V418 PolarHBondContact O-N 3.14Å; V415-A419 VanDerWaalsContact O-CB 3.27Å; V415-A419 WeakPolarHBondContact O-CB 3.39Å; V415-A419 PolarHBondContact O-N 3.37Å
416I91.3Very high87.5Confident68 Ų6861.6 Ų61.635%0.34932%0.317SS..Hα-helixtrans-62.5-47.8177.1-63.6170.7000111.1L411 S412 P413 C414 A419 L420L411-I416 HydrophobicContact CB-CD1 3.96Å; L411-I416 HydrophobicContact CB-CG1 4.18Å; L411-I416 HydrophobicContact CD2-CG1 4.47Å; S412-I416 PolarHBondContact O-N 3.1Å; P413-I416 PolarHBondContact O-N 2.69Å; C414-I416 VanDerWaalsContact C-N 3.34Å; C414-I416 PolarHBondContact O-N 3.48Å; I416-A419 PolarHBondContact O-N 2.87Å; I416-L420 HydrophobicContact CG2-CD1 3.91Å; I416-L420 WeakPolarHBondContact O-CB 3.36Å; I416-L420 PolarHBondContact O-N 2.94Å
417I88Confident87Confident91 Ų9162.5 Ų62.547%0.46731%0.311SS..Hα-helixtrans-62-46.7179.9-69.3165.5000110.4P413 C414 L420 L421P413-I417 WeakPolarHBondContact O-CB 3.32Å; P413-I417 WeakPolarHBondContact O-CD1 3.26Å; P413-I417 VanDerWaalsContact O-CG1 3.23Å; P413-I417 WeakPolarHBondContact O-CG1 3.36Å; P413-I417 PolarHBondContact O-N 2.87Å; C414-I417 PolarHBondContact O-N 2.89Å; I417-L420 PolarHBondContact O-N 3.28Å; I417-L421 HydrophobicContact CG2-CD1 4.03Å; I417-L421 HydrophobicContact CG2-CG 4.42Å; I417-L421 VanDerWaalsContact O-CG 3.32Å; I417-L421 WeakPolarHBondContact O-CG 3.42Å; I417-L421 PolarHBondContact O-N 3.49Å
418V84.7Confident86.3Confident11 Ų1164.3 Ų64.37%0.06732%0.322CS..Hα-helixtrans-63.7-43.4179.8173.50000110.9M123 F395 C414 V415 L420 L421 F422M123-V418 HydrophobicContact CE-CG2 4.19Å; F395-V418 HydrophobicContact CB-CG1 4.39Å; F395-V418 HydrophobicContact CD1-CB 3.79Å; F395-V418 HydrophobicContact CD1-CG1 3.54Å; F395-V418 HydrophobicContact CD2-CG1 4.11Å; F395-V418 HydrophobicContact CE1-CB 3.94Å; F395-V418 HydrophobicContact CE1-CG1 3.73Å; F395-V418 HydrophobicContact CE1-CG2 4.45Å; F395-V418 HydrophobicContact CE2-CG1 4.26Å; F395-V418 HydrophobicContact CG-CB 4.45Å; F395-V418 HydrophobicContact CG-CG1 3.75Å; F395-V418 HydrophobicContact CZ-CG1 4.09Å; C414-V418 WeakPolarHBondContact O-CB 3.33Å; C414-V418 VanDerWaalsContact O-CG2 3.25Å; C414-V418 WeakPolarHBondContact O-CG2 3.4Å; C414-V418 PolarHBondContact O-N 3.41Å; V415-V418 PolarHBondContact O-N 3.14Å; V418-L420 PolarHBondContact O-N 2.88Å; V418-L421 PolarHBondContact O-N 3.46Å; V418-F422 HydrophobicContact CG1-CD2 3.69Å; V418-F422 HydrophobicContact CG1-CE2 3.49Å; V418-F422 VanDerWaalsContact CG1-CE2 3.49Å; V418-F422 WeakPolarHBondContact O-CD2 3.46Å; V418-F422 PolarHBondContact O-N 2.89Å
419A90.9Very high85.4Confident3 Ų363.7 Ų63.73%0.02532%0.318CS..Hα-helixtrans-61.2-44175.700000112F395 I396 C399 V415 I416 F422 I423F395-A419 HydrophobicContact CB-CB 4.24Å; I396-A419 HydrophobicContact CG1-CB 4.44Å; C399-A419 HydrophobicContact CB-CB 4.29Å; C399-A419 VanDerWaalsContact SG-CB 3.54Å; V415-A419 VanDerWaalsContact O-CB 3.27Å; V415-A419 WeakPolarHBondContact O-CB 3.39Å; V415-A419 PolarHBondContact O-N 3.37Å; I416-A419 PolarHBondContact O-N 2.87Å; A419-F422 PolarHBondContact O-N 3.12Å; A419-I423 WeakPolarHBondContact O-CG1 3.13Å; A419-I423 PolarHBondContact O-N 3.31Å
420L90.3Very high84.6Confident94 Ų9455.4 Ų55.449%0.49229%0.292SS..Hα-helixtrans-60.9-45.5175.5-90.6160.7000112.1I416 I417 V418 F422 I423 L424I416-L420 HydrophobicContact CG2-CD1 3.91Å; I416-L420 WeakPolarHBondContact O-CB 3.36Å; I416-L420 PolarHBondContact O-N 2.94Å; I417-L420 PolarHBondContact O-N 3.28Å; V418-L420 PolarHBondContact O-N 2.88Å; L420-F422 VanDerWaalsContact C-N 3.28Å; L420-F422 PolarHBondContact O-N 2.85Å; L420-I423 PolarHBondContact O-N 3.26Å; L420-L424 VanDerWaalsContact O-CG 3.28Å; L420-L424 WeakPolarHBondContact O-CG 3.22Å; L420-L424 PolarHBondContact O-N 3.17Å
421L85.8Confident83.4Confident81 Ų8155.1 Ų55.142%0.42430%0.3SS..Hα-helixtrans-59.8-39.7177.1-72.4172.5000111.8I417 V418 L424 K425I417-L421 HydrophobicContact CG2-CD1 4.03Å; I417-L421 HydrophobicContact CG2-CG 4.42Å; I417-L421 VanDerWaalsContact O-CG 3.32Å; I417-L421 WeakPolarHBondContact O-CG 3.42Å; I417-L421 PolarHBondContact O-N 3.49Å; V418-L421 PolarHBondContact O-N 3.46Å; L421-L424 PolarHBondContact O-N 3.01Å; L421-K425 PolarHBondContact O-N 3.08Å
422F86.8Confident81.2Confident2 Ų264.5 Ų64.51%0.00934%0.343CS..Hα-helixtrans-69.1-38.9175.3-80-57.4000113.3F245 L249 T388 I391 A392 F395 I396 V418 A419 L420 L424 K425 I426F245-F422 HydrophobicContact CE1-CE1 4.17Å; F245-F422 HydrophobicContact CE1-CZ 4.48Å; L249-F422 HydrophobicContact CD1-CE1 3.92Å; L249-F422 HydrophobicContact CD1-CE2 3.84Å; L249-F422 HydrophobicContact CD1-CZ 3.22Å; T388-F422 HydrophobicContact CG2-CE1 4.21Å; I391-F422 HydrophobicContact CB-CZ 4.31Å; I391-F422 HydrophobicContact CG2-CE2 3.83Å; I391-F422 HydrophobicContact CG2-CZ 3.77Å; A392-F422 HydrophobicContact CB-CB 3.84Å; A392-F422 HydrophobicContact CB-CD1 3.42Å; A392-F422 VanDerWaalsContact CB-CD1 3.42Å; A392-F422 HydrophobicContact CB-CD2 4.14Å; A392-F422 HydrophobicContact CB-CE1 3.86Å; A392-F422 HydrophobicContact CB-CE2 4.5Å; A392-F422 HydrophobicContact CB-CG 3.56Å; A392-F422 HydrophobicContact CB-CZ 4.35Å; F395-F422 HydrophobicContact CB-CD2 4.43Å; F395-F422 HydrophobicContact CD2-CE2 4.41Å; I396-F422 HydrophobicContact CD1-CB 4.22Å; V418-F422 HydrophobicContact CG1-CD2 3.69Å; V418-F422 HydrophobicContact CG1-CE2 3.49Å; V418-F422 VanDerWaalsContact CG1-CE2 3.49Å; V418-F422 WeakPolarHBondContact O-CD2 3.46Å; V418-F422 PolarHBondContact O-N 2.89Å; A419-F422 PolarHBondContact O-N 3.12Å; L420-F422 VanDerWaalsContact C-N 3.28Å; L420-F422 PolarHBondContact O-N 2.85Å; F422-L424 VanDerWaalsContact C-N 3.3Å; F422-L424 PolarHBondContact O-N 3.24Å; F422-K425 PolarHBondContact O-N 3.36Å; F422-I426 VanDerWaalsContact O-CG1 3.3Å; F422-I426 WeakPolarHBondContact O-CG1 3.49Å; F422-I426 PolarHBondContact O-N 2.8Å
423I88.9Confident80.9Confident73 Ų7366.9 Ų66.937%0.37435%0.354SS..Hα-helixtrans-59.9-45.7172.9-69.2166.5000109.7I396 A419 L420 K425 I426 V427I396-I423 HydrophobicContact CD1-CG1 3.66Å; I396-I423 HydrophobicContact CG1-CD1 4.29Å; I396-I423 HydrophobicContact CG1-CG1 3.81Å; A419-I423 WeakPolarHBondContact O-CG1 3.13Å; A419-I423 PolarHBondContact O-N 3.31Å; L420-I423 PolarHBondContact O-N 3.26Å; I423-K425 VanDerWaalsContact C-N 3.35Å; I423-K425 PolarHBondContact O-N 3.14Å; I423-I426 PolarHBondContact O-N 2.91Å; I423-V427 HydrophobicContact CG2-CG2 4.18Å; I423-V427 WeakPolarHBondContact O-CB 3.14Å; I423-V427 VanDerWaalsContact O-CG2 3.26Å; I423-V427 WeakPolarHBondContact O-CG2 3.26Å; I423-V427 PolarHBondContact O-N 3.17Å
424L85Confident80.6Confident81 Ų8166.4 Ų66.442%0.42435%0.347SS..Hα-helixtrans-61-43.1176.7-67.3171.9000111.4L420 L421 F422 I426 V427 F428L420-L424 VanDerWaalsContact O-CG 3.28Å; L420-L424 WeakPolarHBondContact O-CG 3.22Å; L420-L424 PolarHBondContact O-N 3.17Å; L421-L424 PolarHBondContact O-N 3.01Å; F422-L424 VanDerWaalsContact C-N 3.3Å; F422-L424 PolarHBondContact O-N 3.24Å; L424-I426 PolarHBondContact O-N 3.17Å; L424-V427 PolarHBondContact O-N 3.31Å; L424-F428 HydrophobicContact CB-CD2 4.28Å; L424-F428 HydrophobicContact CD2-CD2 3.85Å; L424-F428 HydrophobicContact CD2-CE2 3.5Å; L424-F428 WeakPolarHBondContact O-CB 3.42Å; L424-F428 WeakPolarHBondContact O-CD2 3.47Å; L424-F428 PolarHBondContact O-N 3.25Å
425K80.2Confident80.4Confident26 Ų2669.9 Ų69.911%0.11337%0.365CS..Hα-helixtrans-57.9-49174.5179.7-99.9178.6-1710111.4E389 L421 F422 I423 V427 I429 D430E389-K425 IonicContact OE2-NZ 3.01Å; E389-K425 PolarHBondContact OE2-NZ 3.23Å; L421-K425 PolarHBondContact O-N 3.08Å; F422-K425 PolarHBondContact O-N 3.36Å; I423-K425 VanDerWaalsContact C-N 3.35Å; I423-K425 PolarHBondContact O-N 3.14Å; K425-V427 PolarHBondContact O-N 3.37Å; K425-I429 HydrophobicContact CB-CD1 4.48Å; K425-I429 HydrophobicContact CG-CB 4.46Å; K425-I429 HydrophobicContact CG-CD1 4.13Å; K425-I429 WeakPolarHBondContact O-CA 3.45Å; K425-I429 WeakPolarHBondContact O-CB 3.25Å; K425-I429 PolarHBondContact O-N 3.48Å; K425-D430 WeakPolarHBondContact CD-OD2 3.39Å; K425-D430 WeakPolarHBondContact CE-OD1 3.43Å; K425-D430 VanDerWaalsContact CE-OD2 3.29Å; K425-D430 WeakPolarHBondContact CE-OD2 3.21Å; K425-D430 IonicContact NZ-OD1 2.87Å; K425-D430 PolarHBondContact NZ-OD1 3.48Å; K425-D430 IonicContact NZ-OD2 2.69Å; K425-D430 PolarHBondContact NZ-OD2 3.12Å; K425-D430 PolarHBondContact O-N 3.02Å; K425-D430 VanDerWaalsContact O-N 3.14Å
426I82.4Confident79.9Confident59 Ų5974 Ų7430%0.30339%0.386SS..Hα-helixtrans-64.3-43.8-178.7-67.2165.3000111A392 I396 F422 I423 L424 A431A392-I426 HydrophobicContact CB-CD1 4.39Å; I396-I426 HydrophobicContact CD1-CD1 3.87Å; F422-I426 VanDerWaalsContact O-CG1 3.3Å; F422-I426 WeakPolarHBondContact O-CG1 3.49Å; F422-I426 PolarHBondContact O-N 2.8Å; I423-I426 PolarHBondContact O-N 2.91Å; L424-I426 PolarHBondContact O-N 3.17Å; I426-A431 PolarHBondContact O-N 3.3Å
427V82.5Confident79.1Confident78 Ų7874.4 Ų74.447%0.47339%0.388SS..Hα-helixtrans-74.4-39.4-175.9172.80000112.7I423 L424 K425 A431I423-V427 HydrophobicContact CG2-CG2 4.18Å; I423-V427 WeakPolarHBondContact O-CB 3.14Å; I423-V427 VanDerWaalsContact O-CG2 3.26Å; I423-V427 WeakPolarHBondContact O-CG2 3.26Å; I423-V427 PolarHBondContact O-N 3.17Å; L424-V427 PolarHBondContact O-N 3.31Å; K425-V427 PolarHBondContact O-N 3.37Å; V427-A431 WeakPolarHBondContact O-CB 3.44Å
428F76.6Confident78.6Confident140 Ų14073.3 Ų73.361%0.61438%0.383SS*.Hα-helixtrans-102.3-24.1-171.7-70-73.8000114.5L424L424-F428 HydrophobicContact CB-CD2 4.28Å; L424-F428 HydrophobicContact CD2-CD2 3.85Å; L424-F428 HydrophobicContact CD2-CE2 3.5Å; L424-F428 WeakPolarHBondContact O-CB 3.42Å; L424-F428 WeakPolarHBondContact O-CD2 3.47Å; L424-F428 PolarHBondContact O-N 3.25Å
429I70.8Confident78.1Confident93 Ų9377.7 Ų77.748%0.47741%0.406SS..THydrogen-bonded Turntrans-106.7-50.3-176.5-54.6177.8000110.3K425 A431 H432K425-I429 HydrophobicContact CB-CD1 4.48Å; K425-I429 HydrophobicContact CG-CB 4.46Å; K425-I429 HydrophobicContact CG-CD1 4.13Å; K425-I429 WeakPolarHBondContact O-CA 3.45Å; K425-I429 WeakPolarHBondContact O-CB 3.25Å; K425-I429 PolarHBondContact O-N 3.48Å; I429-A431 VanDerWaalsContact C-N 3.34Å; I429-A431 PolarHBondContact O-N 3.35Å; I429-H432 PolarHBondContact O-N 3.41Å
430D69.5Low77.1Confident75 Ų7583.5 Ų83.540%0.40144%0.435SS..THydrogen-bonded Turntrans-79.4-17.5-175.3-57.7-28.3000113.4K425 H432K425-D430 WeakPolarHBondContact CD-OD2 3.39Å; K425-D430 WeakPolarHBondContact CE-OD1 3.43Å; K425-D430 VanDerWaalsContact CE-OD2 3.29Å; K425-D430 WeakPolarHBondContact CE-OD2 3.21Å; K425-D430 IonicContact NZ-OD1 2.87Å; K425-D430 PolarHBondContact NZ-OD1 3.48Å; K425-D430 IonicContact NZ-OD2 2.69Å; K425-D430 PolarHBondContact NZ-OD2 3.12Å; K425-D430 PolarHBondContact O-N 3.02Å; K425-D430 VanDerWaalsContact O-N 3.14Å; D430-H432 PolarHBondContact O-N 3.5Å
431A59.9Low76Confident67 Ų6782.6 Ų82.655%0.55443%0.43SS*.THydrogen-bonded Turntrans-78.3-2.6176.800000113.5I426 V427 I429I426-A431 PolarHBondContact O-N 3.3Å; V427-A431 WeakPolarHBondContact O-CB 3.44Å; I429-A431 VanDerWaalsContact C-N 3.34Å; I429-A431 PolarHBondContact O-N 3.35Å
432H44Very low75.1Confident216 Ų21682.7 Ų82.7100%143%0.431SS*.  trans-130.70-178.4-69.7-34.3000110.4I429 D430I429-H432 PolarHBondContact O-N 3.41Å; D430-H432 PolarHBondContact O-N 3.5Å

Retrieved 432 of 432 residues in 87.3 ms (Link to these results)

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