A0A087YMN8_POEFO Loading...

Histamine H2 receptor

AlphaFold DB , UniProt , Accession A0A087YMN8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 365 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
1M65.6Low89.4Confident187 Ų18799.9 Ų99.992%0.92151%0.513SS*.  0131.90-76.2172.969.900108.6T5 V6M1-T5 HydrophobicContact CE-CG2 4.25Å; M1-V6 HydrophobicContact CB-CG2 4.48Å; M1-V6 HydrophobicContact CE-CG2 3.95Å
2T89.3Confident90Very high86 Ų8692.3 Ų92.353%0.52848%0.475SS..  trans-79.3157.3176.8660000110.3A4 T5 V6T2-A4 PolarHBondContact O-N 2.99Å; T2-T5 WeakPolarHBondContact O-CB 3.36Å; T2-T5 PolarHBondContact O-N 3.46Å; T2-T5 VanDerWaalsContact O-N 3.07Å; T2-T5 PolarHBondContact OG1-N 3.42Å; T2-T5 PolarHBondContact OG1-OG1 3.48Å; T2-V6 PolarHBondContact O-N 3.34Å
3V90Very high90.5Very high116 Ų11690.1 Ų90.170%0.70346%0.462SS*.Hα-helixtrans-54.8-38.6174.1174.40000111T5 V6 L7V3-T5 PolarHBondContact O-N 3.24Å; V3-V6 PolarHBondContact O-N 3.18Å; V3-L7 HydrophobicContact CG1-CD1 4.05Å; V3-L7 HydrophobicContact CG1-CG 4.33Å; V3-L7 WeakPolarHBondContact O-CG 3.12Å; V3-L7 PolarHBondContact O-N 3.2Å
4A87.5Confident90.9Very high50 Ų5087.2 Ų87.241%0.41345%0.454SS..Hα-helixtrans-61-42.1176.400000112.7T2 L7 R8T2-A4 PolarHBondContact O-N 2.99Å; A4-L7 PolarHBondContact O-N 3.23Å; A4-R8 WeakPolarHBondContact O-CG 3.38Å; A4-R8 PolarHBondContact O-N 3.4Å
5T88.6Confident91.3Very high47 Ų4781.7 Ų81.729%0.28843%0.425SS..Hα-helixtrans-63.5-40.9176.1-53.50000111.7M1 T2 V3 R8 W9 L67M1-T5 HydrophobicContact CE-CG2 4.25Å; T2-T5 WeakPolarHBondContact O-CB 3.36Å; T2-T5 PolarHBondContact O-N 3.46Å; T2-T5 VanDerWaalsContact O-N 3.07Å; T2-T5 PolarHBondContact OG1-N 3.42Å; T2-T5 PolarHBondContact OG1-OG1 3.48Å; V3-T5 PolarHBondContact O-N 3.24Å; T5-R8 PolarHBondContact O-N 3.1Å; T5-W9 WeakPolarHBondContact O-CB 3.41Å; T5-W9 PolarHBondContact O-N 2.99Å; T5-L67 HydrophobicContact CG2-CD2 4.46Å
6V92.5Very high91.8Very high58 Ų5877.3 Ų77.335%0.35240%0.402SS..Hα-helixtrans-64.6-45.9177.5176.30000110.9M1 T2 V3 R8 W9 L10M1-V6 HydrophobicContact CB-CG2 4.48Å; M1-V6 HydrophobicContact CE-CG2 3.95Å; T2-V6 PolarHBondContact O-N 3.34Å; V3-V6 PolarHBondContact O-N 3.18Å; V6-R8 PolarHBondContact O-N 3.3Å; V6-W9 PolarHBondContact O-N 3.2Å; V6-L10 HydrophobicContact CG1-CD1 4.01Å; V6-L10 HydrophobicContact CG1-CG 4.38Å; V6-L10 WeakPolarHBondContact O-CG 3.44Å; V6-L10 PolarHBondContact O-N 2.88Å
7L92.5Very high92.1Very high108 Ų10879.5 Ų79.557%0.56541%0.414SS*.Hα-helixtrans-62.3-42.1177.9-70.1175.7000112.1V3 A4 L10 F11V3-L7 HydrophobicContact CG1-CD1 4.05Å; V3-L7 HydrophobicContact CG1-CG 4.33Å; V3-L7 WeakPolarHBondContact O-CG 3.12Å; V3-L7 PolarHBondContact O-N 3.2Å; A4-L7 PolarHBondContact O-N 3.23Å; L7-L10 PolarHBondContact O-N 2.76Å; L7-F11 WeakPolarHBondContact O-CB 3.39Å; L7-F11 PolarHBondContact O-N 2.68Å
8R92.2Very high92.4Very high140 Ų14080.7 Ų80.753%0.52842%0.421SS..Hα-helixtrans-58.7-52.8172.7-74.1178.4-171.4171.72.7110.4A4 T5 V6 L10 F11 L12A4-R8 WeakPolarHBondContact O-CG 3.38Å; A4-R8 PolarHBondContact O-N 3.4Å; T5-R8 PolarHBondContact O-N 3.1Å; V6-R8 PolarHBondContact O-N 3.3Å; R8-L10 VanDerWaalsContact C-N 3.34Å; R8-L10 PolarHBondContact O-N 2.8Å; R8-F11 WeakPolarHBondContact O-CB 3.45Å; R8-F11 PolarHBondContact O-N 2.64Å; R8-F11 VanDerWaalsContact O-N 3.14Å; R8-L12 WeakPolarHBondContact O-CG 3.48Å; R8-L12 PolarHBondContact O-N 3.26Å
9W94.8Very high92.7Very high121 Ų12176.5 Ų76.546%0.45840%0.399SS..Hα-helixtrans-55.3-47.6179.3-178.287.9000112.5T5 V6 F11 L12 M13 L67T5-W9 WeakPolarHBondContact O-CB 3.41Å; T5-W9 PolarHBondContact O-N 2.99Å; V6-W9 PolarHBondContact O-N 3.2Å; W9-F11 VanDerWaalsContact C-N 3.35Å; W9-F11 PolarHBondContact O-N 3.4Å; W9-L12 PolarHBondContact O-N 3.47Å; W9-M13 HydrophobicContact CD2-CG 3.91Å; W9-M13 HydrophobicContact CE3-CG 4.4Å; W9-M13 HydrophobicContact CG-CG 4.36Å; W9-M13 HydrophobicContact CH2-CG 4.26Å; W9-M13 HydrophobicContact CZ2-CG 3.74Å; W9-M13 WeakPolarHBondContact O-CB 3.16Å; W9-M13 VanDerWaalsContact O-CG 3.29Å; W9-M13 WeakPolarHBondContact O-CG 3.47Å; W9-M13 PolarHBondContact O-N 2.97Å; W9-L67 HydrophobicContact CB-CD2 4.31Å
10L95.5Very high93Very high89 Ų8975.1 Ų75.147%0.46639%0.391SS..Hα-helixtrans-59-45.3177.5-73.2171.6000111.8V6 L7 R8 S14V6-L10 HydrophobicContact CG1-CD1 4.01Å; V6-L10 HydrophobicContact CG1-CG 4.38Å; V6-L10 WeakPolarHBondContact O-CG 3.44Å; V6-L10 PolarHBondContact O-N 2.88Å; L7-L10 PolarHBondContact O-N 2.76Å; R8-L10 VanDerWaalsContact C-N 3.34Å; R8-L10 PolarHBondContact O-N 2.8Å; L10-S14 VanDerWaalsContact O-CB 3.29Å; L10-S14 WeakPolarHBondContact O-CB 3.01Å; L10-S14 PolarHBondContact O-N 3.32Å; L10-S14 PolarHBondContact O-OG 2.9Å
11F94.9Very high93.2Very high97 Ų9773.5 Ų73.543%0.42539%0.393SS..Hα-helixtrans-60.1-53.6176.7172.5-101000111.4L7 R8 W9 M13 S14 V15 W277L7-F11 WeakPolarHBondContact O-CB 3.39Å; L7-F11 PolarHBondContact O-N 2.68Å; R8-F11 WeakPolarHBondContact O-CB 3.45Å; R8-F11 PolarHBondContact O-N 2.64Å; R8-F11 VanDerWaalsContact O-N 3.14Å; W9-F11 VanDerWaalsContact C-N 3.35Å; W9-F11 PolarHBondContact O-N 3.4Å; F11-M13 PolarHBondContact O-N 2.73Å; F11-S14 PolarHBondContact O-N 3.37Å; F11-S14 VanDerWaalsContact O-N 3.14Å; F11-S14 PolarHBondContact O-OG 3.43Å; F11-V15 HydrophobicContact CD2-CG2 4.43Å; F11-V15 HydrophobicContact CE1-CG2 4.21Å; F11-V15 HydrophobicContact CE2-CG2 4Å; F11-V15 HydrophobicContact CZ-CG2 3.88Å; F11-V15 WeakPolarHBondContact O-CG2 3.47Å; F11-V15 PolarHBondContact O-N 3.42Å; F11-W277 HydrophobicContact CE1-CE3 4.3Å
12L96.3Very high94.7Very high9 Ų965.2 Ų65.25%0.04736%0.356CS..Hα-helixtrans-59.9-45.8-177.5-58.1169.2000111.3R8 W9 S14 V15 I16 A63 E66 L67 W277R8-L12 WeakPolarHBondContact O-CG 3.48Å; R8-L12 PolarHBondContact O-N 3.26Å; W9-L12 PolarHBondContact O-N 3.47Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 3.19Å; L12-V15 PolarHBondContact O-N 3.46Å; L12-I16 WeakPolarHBondContact O-CG1 3.47Å; L12-I16 PolarHBondContact O-N 3.22Å; L12-A63 HydrophobicContact CB-CB 4.13Å; L12-A63 HydrophobicContact CD1-CB 4.19Å; L12-E66 HydrophobicContact CD1-CB 4.03Å; L12-L67 HydrophobicContact CD1-CD1 4.38Å; L12-L67 HydrophobicContact CD1-CD2 4.13Å; L12-L67 HydrophobicContact CD1-CG 4Å; L12-W277 HydrophobicContact CB-CH2 4.09Å; L12-W277 HydrophobicContact CB-CZ3 4.36Å; L12-W277 HydrophobicContact CD2-CD2 3.57Å; L12-W277 HydrophobicContact CD2-CE3 3.69Å; L12-W277 HydrophobicContact CD2-CG 4.42Å; L12-W277 HydrophobicContact CD2-CH2 3.4Å; L12-W277 VanDerWaalsContact CD2-CH2 3.4Å; L12-W277 HydrophobicContact CD2-CZ2 3.28Å; L12-W277 HydrophobicContact CD2-CZ3 3.6Å; L12-W277 HydrophobicContact CG-CH2 4.27Å; L12-W277 HydrophobicContact CG-CZ2 4.37Å
13M96.7Very high95.1Very high63 Ų6361.1 Ų61.131%0.3133%0.331SS..Hα-helixtrans-64.9-37.6177.8-68.3-52.3-59.700112.2W9 F11 V15 I16 L17W9-M13 HydrophobicContact CD2-CG 3.91Å; W9-M13 HydrophobicContact CE3-CG 4.4Å; W9-M13 HydrophobicContact CG-CG 4.36Å; W9-M13 HydrophobicContact CH2-CG 4.26Å; W9-M13 HydrophobicContact CZ2-CG 3.74Å; W9-M13 WeakPolarHBondContact O-CB 3.16Å; W9-M13 VanDerWaalsContact O-CG 3.29Å; W9-M13 WeakPolarHBondContact O-CG 3.47Å; W9-M13 PolarHBondContact O-N 2.97Å; F11-M13 PolarHBondContact O-N 2.73Å; M13-V15 VanDerWaalsContact C-N 3.35Å; M13-V15 PolarHBondContact O-N 3.36Å; M13-I16 PolarHBondContact O-N 3.31Å; M13-I16 HydrophobicContact SD-CD1 4.08Å; M13-L17 WeakPolarHBondContact O-CB 3.33Å; M13-L17 VanDerWaalsContact O-CG 3.29Å; M13-L17 WeakPolarHBondContact O-CG 3.47Å; M13-L17 PolarHBondContact O-N 2.72Å
14S96.7Very high95.4Very high50 Ų5058.5 Ų58.535%0.3532%0.315SS..Hα-helixtrans-62.2-42.6175.377.40000111.8L10 F11 L12 L17 L18L10-S14 VanDerWaalsContact O-CB 3.29Å; L10-S14 WeakPolarHBondContact O-CB 3.01Å; L10-S14 PolarHBondContact O-N 3.32Å; L10-S14 PolarHBondContact O-OG 2.9Å; F11-S14 PolarHBondContact O-N 3.37Å; F11-S14 VanDerWaalsContact O-N 3.14Å; F11-S14 PolarHBondContact O-OG 3.43Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 3.19Å; S14-L17 PolarHBondContact O-N 3.19Å; S14-L18 VanDerWaalsContact O-CB 3.28Å; S14-L18 WeakPolarHBondContact O-CB 3.49Å; S14-L18 WeakPolarHBondContact O-CG 3.46Å; S14-L18 PolarHBondContact O-N 2.68Å
15V96.8Very high95.8Very high4 Ų457.5 Ų57.52%0.02430%0.302CS..Hα-helixtrans-63.8-44.5177.6173.30000110.7F11 L12 M13 T19 L59 W277 L281F11-V15 HydrophobicContact CD2-CG2 4.43Å; F11-V15 HydrophobicContact CE1-CG2 4.21Å; F11-V15 HydrophobicContact CE2-CG2 4Å; F11-V15 HydrophobicContact CZ-CG2 3.88Å; F11-V15 WeakPolarHBondContact O-CG2 3.47Å; F11-V15 PolarHBondContact O-N 3.42Å; L12-V15 PolarHBondContact O-N 3.46Å; M13-V15 VanDerWaalsContact C-N 3.35Å; M13-V15 PolarHBondContact O-N 3.36Å; V15-T19 VanDerWaalsContact O-CB 3.24Å; V15-T19 WeakPolarHBondContact O-CB 3.45Å; V15-T19 PolarHBondContact O-N 3.33Å; V15-T19 PolarHBondContact O-OG1 3.14Å; V15-L59 HydrophobicContact CG1-CD1 4.4Å; V15-W277 HydrophobicContact CB-CE3 4.48Å; V15-W277 HydrophobicContact CB-CZ3 4.1Å; V15-W277 HydrophobicContact CG1-CE3 4.2Å; V15-W277 HydrophobicContact CG1-CZ3 3.94Å; V15-L281 HydrophobicContact CG1-CD2 4.22Å; V15-L281 HydrophobicContact CG2-CD2 3.78Å
16I98.3Very high96.1Very high11 Ų1155.2 Ų55.26%0.05629%0.288CS..Hα-helixtrans-59.4-52.9177.2-68.2164.2000110.6L12 M13 L18 T19 I20 L59 A63L12-I16 WeakPolarHBondContact O-CG1 3.47Å; L12-I16 PolarHBondContact O-N 3.22Å; M13-I16 PolarHBondContact O-N 3.31Å; M13-I16 HydrophobicContact SD-CD1 4.08Å; I16-L18 PolarHBondContact O-N 3.48Å; I16-T19 PolarHBondContact O-N 2.72Å; I16-I20 HydrophobicContact CG2-CD1 3.77Å; I16-I20 WeakPolarHBondContact O-CG1 3.18Å; I16-I20 PolarHBondContact O-N 3.47Å; I16-L59 HydrophobicContact CD1-CB 4.38Å; I16-L59 HydrophobicContact CG1-CB 3.67Å; I16-L59 HydrophobicContact CG1-CD1 4.3Å; I16-A63 HydrophobicContact CD1-CB 3.99Å
17L97.9Very high96.3Very high116 Ų11654.1 Ų54.161%0.60728%0.283SS*.Hα-helixtrans-64-42-176.8-69.5174.2000112.3M13 S14 G21M13-L17 WeakPolarHBondContact O-CB 3.33Å; M13-L17 VanDerWaalsContact O-CG 3.29Å; M13-L17 WeakPolarHBondContact O-CG 3.47Å; M13-L17 PolarHBondContact O-N 2.72Å; S14-L17 PolarHBondContact O-N 3.19Å; L17-G21 PolarHBondContact O-N 3Å
18L97.4Very high96.2Very high101 Ų10152.9 Ų52.953%0.52928%0.276SS..Hα-helixtrans-66.6-38.7177-71172.2000111.8S14 I16 G22 T284S14-L18 VanDerWaalsContact O-CB 3.28Å; S14-L18 WeakPolarHBondContact O-CB 3.49Å; S14-L18 WeakPolarHBondContact O-CG 3.46Å; S14-L18 PolarHBondContact O-N 2.68Å; I16-L18 PolarHBondContact O-N 3.48Å; L18-G22 WeakPolarHBondContact O-CA 3.35Å; L18-G22 PolarHBondContact O-N 3.49Å; L18-T284 HydrophobicContact CB-CG2 3.54Å; L18-T284 HydrophobicContact CD1-CG2 4.36Å
19T97.9Very high96.2Very high0 Ų046.2 Ų46.20%025%0.251CS..Hα-helixtrans-65.7-49177.8-58.40000111V15 I16 N23 L59 T284V15-T19 VanDerWaalsContact O-CB 3.24Å; V15-T19 WeakPolarHBondContact O-CB 3.45Å; V15-T19 PolarHBondContact O-N 3.33Å; V15-T19 PolarHBondContact O-OG1 3.14Å; I16-T19 PolarHBondContact O-N 2.72Å; T19-N23 WeakPolarHBondContact O-CB 3.44Å; T19-N23 PolarHBondContact O-N 2.6Å; T19-N23 VanDerWaalsContact O-N 3.12Å; T19-N23 PolarHBondContact O-ND2 3.41Å; T19-L59 HydrophobicContact CG2-CD1 4.15Å; T19-T284 PolarHBondContact OG1-OG1 2.75Å
20I98.4Very high96Very high49 Ų4940.9 Ų40.925%0.25123%0.232SC..Hα-helixtrans-64.9-57.1178.6-63.4170.8000110I16 G22 N23 V24 L52 V56I16-I20 HydrophobicContact CG2-CD1 3.77Å; I16-I20 WeakPolarHBondContact O-CG1 3.18Å; I16-I20 PolarHBondContact O-N 3.47Å; I20-G22 VanDerWaalsContact C-N 3.34Å; I20-G22 PolarHBondContact O-N 2.75Å; I20-N23 PolarHBondContact O-N 3.34Å; I20-V24 HydrophobicContact CG2-CG2 4.42Å; I20-V24 WeakPolarHBondContact O-CG2 3.25Å; I20-V24 PolarHBondContact O-N 2.98Å; I20-L52 HydrophobicContact CG2-CD2 4.29Å; I20-L52 VanDerWaalsContact O-CD2 3.25Å; I20-L52 WeakPolarHBondContact O-CD2 3.22Å; I20-V56 HydrophobicContact CD1-CG2 4Å; I20-V56 HydrophobicContact CG1-CG2 4.1Å
21G97.5Very high95.6Very high41 Ų4138.4 Ų38.442%0.42323%0.228SC..Hα-helixtrans-61.2-42.1-175.900000112.8L17 L25L17-G21 PolarHBondContact O-N 3Å; G21-L25 WeakPolarHBondContact O-CB 3.25Å; G21-L25 PolarHBondContact O-N 3.44Å
22G96.9Very high95.2Very high14 Ų1437.2 Ų37.214%0.14423%0.226CC..Hα-helixtrans-62.6-47.9178.100000112.4L18 I20 L25 V26 P287L18-G22 WeakPolarHBondContact O-CA 3.35Å; L18-G22 PolarHBondContact O-N 3.49Å; I20-G22 VanDerWaalsContact C-N 3.34Å; I20-G22 PolarHBondContact O-N 2.75Å; G22-L25 WeakPolarHBondContact O-CB 3.48Å; G22-L25 PolarHBondContact O-N 3.25Å; G22-V26 WeakPolarHBondContact O-CG2 3.33Å; G22-V26 PolarHBondContact O-N 3.1Å; G22-P287 WeakPolarHBondContact O-CB 3.06Å
23N97.6Very high94.7Very high0 Ų037.3 Ų37.30%023%0.227CC..Hα-helixtrans-75.9-27.3-178.2-70.9-70.1000112.8T19 I20 L25 V26 C27 A48 D51 L52 S283 P287T19-N23 WeakPolarHBondContact O-CB 3.44Å; T19-N23 PolarHBondContact O-N 2.6Å; T19-N23 VanDerWaalsContact O-N 3.12Å; T19-N23 PolarHBondContact O-ND2 3.41Å; I20-N23 PolarHBondContact O-N 3.34Å; N23-L25 VanDerWaalsContact C-N 3.3Å; N23-L25 PolarHBondContact O-N 3.44Å; N23-V26 PolarHBondContact O-N 3.38Å; N23-C27 PolarHBondContact O-N 3.18Å; N23-C27 VanDerWaalsContact O-N 3.09Å; N23-C27 PolarHBondContact O-SG 2.87Å; N23-A48 HydrophobicContact CB-CB 4.27Å; N23-D51 HydrophobicContact CB-CB 4.47Å; N23-L52 HydrophobicContact CB-CD1 4.39Å; N23-L52 HydrophobicContact CB-CD2 3.79Å; N23-L52 HydrophobicContact CB-CG 3.59Å; N23-S283 PolarHBondContact ND2-O 3.23Å; N23-P287 HydrophobicContact CB-CG 4.43Å; N23-P287 WeakPolarHBondContact OD1-CG 3.36Å
24V97.1Very high94Very high61 Ų6141.3 Ų41.337%0.3724%0.239SC..Hα-helixtrans-59.8-45.3165.9168.20000109.5I20 V26 C27 L28 L52I20-V24 HydrophobicContact CG2-CG2 4.42Å; I20-V24 WeakPolarHBondContact O-CG2 3.25Å; I20-V24 PolarHBondContact O-N 2.98Å; V24-V26 VanDerWaalsContact C-N 3.33Å; V24-V26 PolarHBondContact O-N 2.74Å; V24-C27 PolarHBondContact O-N 3.25Å; V24-L28 HydrophobicContact CG1-CD1 3.83Å; V24-L28 HydrophobicContact CG1-CG 4.19Å; V24-L28 WeakPolarHBondContact O-CG 3.3Å; V24-L28 PolarHBondContact O-N 2.8Å; V24-L52 HydrophobicContact CB-CD2 4.49Å; V24-L52 HydrophobicContact CG2-CD1 4.33Å; V24-L52 HydrophobicContact CG2-CD2 3.62Å
25L95.8Very high93.4Very high28 Ų2844.3 Ų44.315%0.14724%0.242CC..Hα-helixtrans-62.8-37.6178.6-174.462.8000112.3G21 G22 N23 L28 A29 Y301 L304 L305G21-L25 WeakPolarHBondContact O-CB 3.25Å; G21-L25 PolarHBondContact O-N 3.44Å; G22-L25 WeakPolarHBondContact O-CB 3.48Å; G22-L25 PolarHBondContact O-N 3.25Å; N23-L25 VanDerWaalsContact C-N 3.3Å; N23-L25 PolarHBondContact O-N 3.44Å; L25-L28 PolarHBondContact O-N 3.48Å; L25-A29 WeakPolarHBondContact O-CB 3.32Å; L25-A29 PolarHBondContact O-N 2.86Å; L25-Y301 HydrophobicContact CD2-CD1 4.33Å; L25-Y301 HydrophobicContact CD2-CD2 3.45Å; L25-Y301 VanDerWaalsContact CD2-CD2 3.45Å; L25-Y301 HydrophobicContact CD2-CE1 4.33Å; L25-Y301 HydrophobicContact CD2-CE2 3.45Å; L25-Y301 VanDerWaalsContact CD2-CE2 3.45Å; L25-Y301 HydrophobicContact CD2-CG 3.91Å; L25-Y301 HydrophobicContact CG-CD1 4.08Å; L25-Y301 HydrophobicContact CG-CD2 4.07Å; L25-Y301 HydrophobicContact CG-CE1 3.89Å; L25-Y301 HydrophobicContact CG-CE2 3.89Å; L25-Y301 HydrophobicContact CG-CG 4.16Å; L25-L304 HydrophobicContact CD1-CB 4.02Å; L25-L304 HydrophobicContact CD1-CD1 3.71Å; L25-L305 HydrophobicContact CD2-CD1 4.22Å; L25-L305 HydrophobicContact CD2-CD2 4.3Å; L25-L305 HydrophobicContact CD2-CG 4.38Å
26V95.6Very high92.9Very high0 Ų044.2 Ų44.20%024%0.242CC..Hα-helixtrans-58.1-51.7172.2178.40000110.6G22 N23 V24 L28 A29 V30 V44 A48 P287 Y290 F297 Y301G22-V26 WeakPolarHBondContact O-CG2 3.33Å; G22-V26 PolarHBondContact O-N 3.1Å; N23-V26 PolarHBondContact O-N 3.38Å; V24-V26 VanDerWaalsContact C-N 3.33Å; V24-V26 PolarHBondContact O-N 2.74Å; V26-L28 PolarHBondContact O-N 2.92Å; V26-A29 PolarHBondContact O-N 2.73Å; V26-V30 PolarHBondContact O-N 3.42Å; V26-V44 HydrophobicContact CG1-CG1 3.88Å; V26-A48 HydrophobicContact CB-CB 3.87Å; V26-A48 HydrophobicContact CG1-CB 3.7Å; V26-P287 HydrophobicContact CG2-CB 3.95Å; V26-P287 HydrophobicContact CG2-CG 3.92Å; V26-Y290 HydrophobicContact CG1-CD2 4.29Å; V26-Y290 HydrophobicContact CG1-CE2 4.14Å; V26-Y290 HydrophobicContact CG2-CD2 3.9Å; V26-Y290 HydrophobicContact CG2-CE2 4.01Å; V26-F297 HydrophobicContact CG1-CE1 4.28Å; V26-Y301 WeakPolarHBondContact CG2-OH 3.44Å
27C94.9Very high92.4Very high35 Ų3546.9 Ų46.924%0.23625%0.251CS..Hα-helixtrans-59.6-45.8180-73.10000111.8N23 V24 G31N23-C27 PolarHBondContact O-N 3.18Å; N23-C27 VanDerWaalsContact O-N 3.09Å; N23-C27 PolarHBondContact O-SG 2.87Å; V24-C27 PolarHBondContact O-N 3.25Å; C27-G31 PolarHBondContact O-N 2.97Å
28L91.8Very high91.8Very high81 Ų8148.3 Ų48.342%0.42425%0.248SC..Hα-helixtrans-63.6-43.2176.2-69.9176.7000111.9V24 L25 V26 V30 G31 L32 L304V24-L28 HydrophobicContact CG1-CD1 3.83Å; V24-L28 HydrophobicContact CG1-CG 4.19Å; V24-L28 WeakPolarHBondContact O-CG 3.3Å; V24-L28 PolarHBondContact O-N 2.8Å; L25-L28 PolarHBondContact O-N 3.48Å; V26-L28 PolarHBondContact O-N 2.92Å; L28-V30 PolarHBondContact O-N 3.29Å; L28-G31 PolarHBondContact O-N 3.34Å; L28-L32 HydrophobicContact CB-CD1 4.29Å; L28-L32 HydrophobicContact CD2-CD1 4.24Å; L28-L32 WeakPolarHBondContact O-CB 3.44Å; L28-L32 VanDerWaalsContact O-CG 3.22Å; L28-L32 WeakPolarHBondContact O-CG 3.44Å; L28-L32 PolarHBondContact O-N 2.88Å; L28-L304 HydrophobicContact CB-CD1 3.99Å
29A92.1Very high91.2Very high0 Ų045.5 Ų45.50%024%0.235CC..Hα-helixtrans-59.1-47.8179.100000111.6L25 V26 S33 L36 F297 A300 Y301 L304L25-A29 WeakPolarHBondContact O-CB 3.32Å; L25-A29 PolarHBondContact O-N 2.86Å; V26-A29 PolarHBondContact O-N 2.73Å; A29-S33 WeakPolarHBondContact O-CB 3.38Å; A29-S33 PolarHBondContact O-N 3.39Å; A29-L36 HydrophobicContact CB-CD1 4.17Å; A29-F297 HydrophobicContact CB-CD1 4.47Å; A29-A300 HydrophobicContact CB-CB 3.89Å; A29-Y301 HydrophobicContact CB-CD1 3.74Å; A29-Y301 HydrophobicContact CB-CE1 3.59Å; A29-L304 HydrophobicContact CB-CD1 4.08Å
30V91Very high90.6Very high10 Ų1045.9 Ų45.96%0.06124%0.239CC..Hα-helixtrans-70.1-41.5178.2-178.20000111.4V26 L28 L32 L36 W37 N41 V45 F297V26-V30 PolarHBondContact O-N 3.42Å; L28-V30 PolarHBondContact O-N 3.29Å; V30-L32 PolarHBondContact O-N 3.43Å; V30-L36 HydrophobicContact CG1-CB 4.45Å; V30-L36 HydrophobicContact CG2-CB 4.38Å; V30-L36 HydrophobicContact CG2-CD1 4.27Å; V30-W37 PolarHBondContact O-NE1 3.18Å; V30-N41 HydrophobicContact CG1-CB 4.42Å; V30-V45 HydrophobicContact CB-CG2 3.78Å; V30-V45 HydrophobicContact CG1-CG2 3.61Å; V30-V45 HydrophobicContact CG2-CG2 4.03Å; V30-F297 HydrophobicContact CG2-CE1 3.82Å; V30-F297 HydrophobicContact CG2-CZ 3.78Å
31G87.1Confident90.3Very high37 Ų3744.1 Ų44.138%0.38123%0.23SC..Hα-helixtrans-67.1-33.2-179.100000113.8C27 L28C27-G31 PolarHBondContact O-N 2.97Å; L28-G31 PolarHBondContact O-N 3.34Å
32L86.2Confident90Very high72 Ų7242.9 Ų42.938%0.37721%0.214SC..Hα-helixtrans-99-30.4-173.5-59.1175.7000113.2L28 V30 L304 R325L28-L32 HydrophobicContact CB-CD1 4.29Å; L28-L32 HydrophobicContact CD2-CD1 4.24Å; L28-L32 WeakPolarHBondContact O-CB 3.44Å; L28-L32 VanDerWaalsContact O-CG 3.22Å; L28-L32 WeakPolarHBondContact O-CG 3.44Å; L28-L32 PolarHBondContact O-N 2.88Å; V30-L32 PolarHBondContact O-N 3.43Å; L32-L304 HydrophobicContact CD1-CD2 3.66Å; L32-R325 PolarHBondContact O-NH2 3.05Å
33S85.8Confident89.9Confident11 Ų1142.8 Ų42.88%0.07721%0.21CC..  trans-93.5112.3-177.6-172.10000112.8A29 R35 L36A29-S33 WeakPolarHBondContact O-CB 3.38Å; A29-S33 PolarHBondContact O-N 3.39Å; S33-R35 PolarHBondContact O-N 3.01Å; S33-L36 PolarHBondContact O-N 2.88Å
34R81.1Confident89.8Confident147 Ų14743.4 Ų43.456%0.55521%0.214SC*.G310 helixtrans-57.7-23.8175.3-61.3-169.7-177.5172.82.3113.6L36 W37 T321R34-L36 PolarHBondContact O-N 2.92Å; R34-W37 HydrophobicContact CB-CD2 4.35Å; R34-W37 HydrophobicContact CB-CE3 4.2Å; R34-W37 HydrophobicContact CB-CZ3 4.45Å; R34-W37 HydrophobicContact CG-CD2 4.3Å; R34-W37 HydrophobicContact CG-CE3 3.95Å; R34-W37 HydrophobicContact CG-CH2 3.8Å; R34-W37 HydrophobicContact CG-CZ2 4.13Å; R34-W37 HydrophobicContact CG-CZ3 3.7Å; R34-W37 PolarHBondContact O-N 3.45Å; R34-T321 PolarHBondContact NH2-OG1 2.99Å; R34-T321 VanDerWaalsContact NH2-OG1 3.14Å
35R84.8Confident89.7Confident113 Ų11342.7 Ų42.743%0.42621%0.209SC..G310 helixtrans-65.9-26.6178.4-59.8176.1-176.3-123.1-6.5112.3S33 R299S33-R35 PolarHBondContact O-N 3.01Å; R35-R299 VanDerWaalsContact CZ-CZ 3.43Å
36L85.9Confident89.8Confident2 Ų241.8 Ų41.81%0.0121%0.205CC..G310 helixtrans-97.33.5-178.8-64.9174.1000112.7A29 V30 S33 R34 R38 N41 D296 F297 A300A29-L36 HydrophobicContact CB-CD1 4.17Å; V30-L36 HydrophobicContact CG1-CB 4.45Å; V30-L36 HydrophobicContact CG2-CB 4.38Å; V30-L36 HydrophobicContact CG2-CD1 4.27Å; S33-L36 PolarHBondContact O-N 2.88Å; R34-L36 PolarHBondContact O-N 2.92Å; L36-R38 PolarHBondContact O-N 3.29Å; L36-N41 WeakPolarHBondContact O-CB 3.32Å; L36-N41 PolarHBondContact O-ND2 3.47Å; L36-D296 HydrophobicContact CD2-CB 3.7Å; L36-D296 HydrophobicContact CG-CB 4.46Å; L36-F297 HydrophobicContact CD1-CD1 3.93Å; L36-F297 HydrophobicContact CD1-CE1 3.92Å; L36-F297 HydrophobicContact CD1-CG 4.23Å; L36-F297 HydrophobicContact CD1-CZ 4.23Å; L36-F297 HydrophobicContact CD2-CD2 3.75Å; L36-F297 HydrophobicContact CD2-CE2 3.74Å; L36-F297 HydrophobicContact CD2-CG 4.2Å; L36-F297 HydrophobicContact CD2-CZ 4.17Å; L36-A300 HydrophobicContact CD1-CB 3.82Å
37W87.6Confident89.8Confident67 Ų6741.8 Ų41.825%0.25421%0.205SC..  trans-79.267.2177.2-66.4-5.4000111.9V30 R34 R325V30-W37 PolarHBondContact O-NE1 3.18Å; R34-W37 HydrophobicContact CB-CD2 4.35Å; R34-W37 HydrophobicContact CB-CE3 4.2Å; R34-W37 HydrophobicContact CB-CZ3 4.45Å; R34-W37 HydrophobicContact CG-CD2 4.3Å; R34-W37 HydrophobicContact CG-CE3 3.95Å; R34-W37 HydrophobicContact CG-CH2 3.8Å; R34-W37 HydrophobicContact CG-CZ2 4.13Å; R34-W37 HydrophobicContact CG-CZ3 3.7Å; R34-W37 PolarHBondContact O-N 3.45Å; W37-R325 HydrophobicContact CH2-CG 3.69Å; W37-R325 HydrophobicContact CZ2-CG 3.68Å
38R85.8Confident89.9Confident145 Ų14540.1 Ų40.155%0.54719%0.194SC..  trans-112.9141.1171.3-58.2-173.7-169.7-171.46.4108.4L36 A40 N41 D296L36-R38 PolarHBondContact O-N 3.29Å; R38-A40 PolarHBondContact O-N 2.93Å; R38-A40 VanDerWaalsContact O-N 3.13Å; R38-N41 WeakPolarHBondContact O-CB 3.3Å; R38-N41 PolarHBondContact O-N 3.1Å; R38-D296 IonicContact NH2-OD2 2.77Å
39T85Confident90.3Very high42 Ų4238.9 Ų38.926%0.25819%0.19SC..THydrogen-bonded Turntrans-53-38.1178.8-42.30000112.3N41 C42 P120 V123T39-N41 PolarHBondContact O-N 3.28Å; T39-C42 VanDerWaalsContact O-CB 3.28Å; T39-C42 WeakPolarHBondContact O-CB 3.34Å; T39-C42 PolarHBondContact O-N 2.84Å; T39-C42 VanDerWaalsContact O-N 3.12Å; T39-C42 PolarHBondContact O-SG 2.73Å; T39-P120 HydrophobicContact CG2-CB 4.26Å; T39-P120 HydrophobicContact CG2-CG 4.05Å; T39-V123 HydrophobicContact CG2-CB 4.17Å; T39-V123 HydrophobicContact CG2-CG2 3.86Å
40A85.4Confident90.5Very high9 Ų938.9 Ų38.97%0.07419%0.19CC..THydrogen-bonded Turntrans-62.4-25.8176.500000114.2R38 C42 F43 N103R38-A40 PolarHBondContact O-N 2.93Å; R38-A40 VanDerWaalsContact O-N 3.13Å; A40-C42 PolarHBondContact O-N 3.22Å; A40-F43 PolarHBondContact O-N 2.99Å; A40-N103 WeakPolarHBondContact CB-ND2 3.37Å
41N90.7Very high90.9Very high12 Ų1238.4 Ų38.46%0.06419%0.187CC..Hα-helixtrans-76.6-7.6178.7-67-9.9000112.1V30 L36 R38 T39 F43 V44 V45V30-N41 HydrophobicContact CG1-CB 4.42Å; L36-N41 WeakPolarHBondContact O-CB 3.32Å; L36-N41 PolarHBondContact O-ND2 3.47Å; R38-N41 WeakPolarHBondContact O-CB 3.3Å; R38-N41 PolarHBondContact O-N 3.1Å; T39-N41 PolarHBondContact O-N 3.28Å; N41-F43 VanDerWaalsContact C-N 3.27Å; N41-F43 PolarHBondContact O-N 3.45Å; N41-V44 WeakPolarHBondContact O-CB 3.47Å; N41-V44 PolarHBondContact O-N 3.35Å; N41-V44 VanDerWaalsContact O-N 3.16Å; N41-V45 PolarHBondContact O-N 2.88Å
42C92.4Very high91.4Very high14 Ų1438.1 Ų38.110%0.09518%0.177CC..Hα-helixtrans-61.4-35.5168.7-64.50000112T39 A40 V44 V45 S46 V123 I127 F328T39-C42 VanDerWaalsContact O-CB 3.28Å; T39-C42 WeakPolarHBondContact O-CB 3.34Å; T39-C42 PolarHBondContact O-N 2.84Å; T39-C42 VanDerWaalsContact O-N 3.12Å; T39-C42 PolarHBondContact O-SG 2.73Å; A40-C42 PolarHBondContact O-N 3.22Å; C42-V44 VanDerWaalsContact C-N 3.31Å; C42-V44 PolarHBondContact O-N 3.25Å; C42-V45 PolarHBondContact O-N 2.89Å; C42-S46 WeakPolarHBondContact O-CB 3.28Å; C42-S46 PolarHBondContact O-N 3.16Å; C42-V123 HydrophobicContact CB-CG1 3.76Å; C42-I127 HydrophobicContact CB-CD1 3.9Å; C42-F328 VanDerWaalsContact SG-CZ 3.6Å
43F94.9Very high92Very high13 Ų1337.7 Ų37.76%0.05717%0.174CC..Hα-helixtrans-65.1-37.4174.1-67.5-63.1000111.6A40 N41 V45 S46 L47 T96 A99 I100 V123 A126 I127A40-F43 PolarHBondContact O-N 2.99Å; N41-F43 VanDerWaalsContact C-N 3.27Å; N41-F43 PolarHBondContact O-N 3.45Å; F43-V45 VanDerWaalsContact C-N 3.34Å; F43-S46 PolarHBondContact O-N 3.44Å; F43-L47 WeakPolarHBondContact O-CB 3.41Å; F43-L47 PolarHBondContact O-N 3.03Å; F43-T96 HydrophobicContact CB-CG2 4.19Å; F43-T96 WeakPolarHBondContact O-CG2 3.36Å; F43-A99 HydrophobicContact CD1-CB 3.87Å; F43-A99 HydrophobicContact CE1-CB 3.74Å; F43-A99 HydrophobicContact CG-CB 4.39Å; F43-A99 HydrophobicContact CZ-CB 4.15Å; F43-I100 HydrophobicContact CB-CD1 4.29Å; F43-I100 HydrophobicContact CB-CG1 3.59Å; F43-V123 HydrophobicContact CD2-CG1 4.4Å; F43-V123 HydrophobicContact CE1-CG1 4.31Å; F43-V123 HydrophobicContact CE2-CG1 3.99Å; F43-V123 HydrophobicContact CE2-CG2 3.97Å; F43-V123 HydrophobicContact CZ-CB 4.37Å; F43-V123 HydrophobicContact CZ-CG1 3.95Å; F43-V123 HydrophobicContact CZ-CG2 4.18Å; F43-A126 HydrophobicContact CE1-CB 4.09Å; F43-A126 HydrophobicContact CZ-CB 4.08Å; F43-I127 HydrophobicContact CD1-CD1 4.2Å; F43-I127 HydrophobicContact CD1-CG1 3.74Å; F43-I127 HydrophobicContact CE1-CD1 4.43Å; F43-I127 HydrophobicContact CE1-CG1 3.74Å
44V94.2Very high92.6Very high12 Ų1237.1 Ų37.17%0.07317%0.171CC..Hα-helixtrans-65.1-39.8175.6-179.30000111.1V26 N41 C42 L47 A48 I100 Y290 F297V26-V44 HydrophobicContact CG1-CG1 3.88Å; N41-V44 WeakPolarHBondContact O-CB 3.47Å; N41-V44 PolarHBondContact O-N 3.35Å; N41-V44 VanDerWaalsContact O-N 3.16Å; C42-V44 VanDerWaalsContact C-N 3.31Å; C42-V44 PolarHBondContact O-N 3.25Å; V44-L47 PolarHBondContact O-N 2.86Å; V44-A48 WeakPolarHBondContact O-CB 3.43Å; V44-A48 PolarHBondContact O-N 3.45Å; V44-I100 HydrophobicContact CG2-CD1 4.26Å; V44-Y290 HydrophobicContact CG1-CD2 4.18Å; V44-Y290 HydrophobicContact CG1-CE2 3.63Å; V44-F297 HydrophobicContact CG1-CZ 3.84Å
45V95.5Very high93.4Very high46 Ų4630.1 Ų30.128%0.27914%0.144SC..Hα-helixtrans-66.8-43.2173.7175.60000111.2V30 N41 C42 F43 L47 A48 V49V30-V45 HydrophobicContact CB-CG2 3.78Å; V30-V45 HydrophobicContact CG1-CG2 3.61Å; V30-V45 HydrophobicContact CG2-CG2 4.03Å; N41-V45 PolarHBondContact O-N 2.88Å; C42-V45 PolarHBondContact O-N 2.89Å; F43-V45 VanDerWaalsContact C-N 3.34Å; V45-L47 VanDerWaalsContact C-N 3.29Å; V45-L47 PolarHBondContact O-N 3Å; V45-A48 PolarHBondContact O-N 3.05Å; V45-V49 HydrophobicContact CG1-CG2 4.36Å; V45-V49 WeakPolarHBondContact O-CG2 3.2Å; V45-V49 PolarHBondContact O-N 2.84Å
46S97.3Very high94Very high9 Ų928.7 Ų28.76%0.06315%0.147CC..Hα-helixtrans-58-43.5176-173.10000111.6C42 F43 V49 A50 W131C42-S46 WeakPolarHBondContact O-CB 3.28Å; C42-S46 PolarHBondContact O-N 3.16Å; F43-S46 PolarHBondContact O-N 3.44Å; S46-V49 PolarHBondContact O-N 3.13Å; S46-A50 PolarHBondContact O-N 3.32Å; S46-W131 PolarHBondContact OG-NE1 3.2Å
47L96.8Very high94.6Very high0 Ų032.3 Ų32.30%017%0.166CC..Hα-helixtrans-62.7-47.6175.7-178.656.5000111.3F43 V44 V45 V49 A50 D51 S93 T96 L97 I100 Y290F43-L47 WeakPolarHBondContact O-CB 3.41Å; F43-L47 PolarHBondContact O-N 3.03Å; V44-L47 PolarHBondContact O-N 2.86Å; V45-L47 VanDerWaalsContact C-N 3.29Å; V45-L47 PolarHBondContact O-N 3Å; L47-V49 VanDerWaalsContact C-N 3.28Å; L47-V49 PolarHBondContact O-N 2.74Å; L47-A50 PolarHBondContact O-N 3.49Å; L47-D51 WeakPolarHBondContact O-CB 3.22Å; L47-D51 PolarHBondContact O-N 3.37Å; L47-S93 WeakPolarHBondContact CD1-OG 3.44Å; L47-T96 HydrophobicContact CB-CG2 3.76Å; L47-L97 HydrophobicContact CD1-CG 4.39Å; L47-L97 HydrophobicContact CD2-CD2 3.58Å; L47-L97 HydrophobicContact CD2-CG 3.93Å; L47-I100 HydrophobicContact CD2-CD1 3.83Å; L47-Y290 WeakPolarHBondContact CD2-OH 3.33Å
48A97.5Very high95.1Very high0 Ų029.1 Ų29.10%015%0.154CC..Hα-helixtrans-61.2-35.3176.700000112.6N23 V26 V44 V45 L52N23-A48 HydrophobicContact CB-CB 4.27Å; V26-A48 HydrophobicContact CB-CB 3.87Å; V26-A48 HydrophobicContact CG1-CB 3.7Å; V44-A48 WeakPolarHBondContact O-CB 3.43Å; V44-A48 PolarHBondContact O-N 3.45Å; V45-A48 PolarHBondContact O-N 3.05Å; A48-L52 VanDerWaalsContact O-CB 3.31Å; A48-L52 WeakPolarHBondContact O-CB 3.46Å; A48-L52 WeakPolarHBondContact O-CG 3.37Å; A48-L52 PolarHBondContact O-N 3.26Å
49V98.2Very high95.6Very high56 Ų5622.2 Ų22.234%0.33913%0.128SC..Hα-helixtrans-68.5-43.5174.8171.10000111.2V45 S46 L47 L52 L53 W131V45-V49 HydrophobicContact CG1-CG2 4.36Å; V45-V49 WeakPolarHBondContact O-CG2 3.2Å; V45-V49 PolarHBondContact O-N 2.84Å; S46-V49 PolarHBondContact O-N 3.13Å; L47-V49 VanDerWaalsContact C-N 3.28Å; L47-V49 PolarHBondContact O-N 2.74Å; V49-L52 PolarHBondContact O-N 3Å; V49-L53 HydrophobicContact CG1-CD1 4.39Å; V49-L53 WeakPolarHBondContact O-CG 3.48Å; V49-L53 PolarHBondContact O-N 3.37Å; V49-W131 HydrophobicContact CG1-CH2 4.15Å; V49-W131 HydrophobicContact CG1-CZ2 4.06Å
50A98.3Very high96.2Very high0 Ų022.6 Ų22.60%013%0.131CC..Hα-helixtrans-60.6-46.4174.800000111.4S46 L47 L52 L53 L54 C92 W131S46-A50 PolarHBondContact O-N 3.32Å; L47-A50 PolarHBondContact O-N 3.49Å; A50-L52 VanDerWaalsContact C-N 3.34Å; A50-L52 PolarHBondContact O-N 3.45Å; A50-L53 PolarHBondContact O-N 2.99Å; A50-L54 WeakPolarHBondContact O-CB 3.08Å; A50-L54 PolarHBondContact O-N 3.4Å; A50-C92 HydrophobicContact CB-CB 4.36Å; A50-W131 HydrophobicContact CB-CH2 4.14Å; A50-W131 HydrophobicContact CB-CZ2 4.16Å
51D98.1Very high96.7Very high0 Ų024.7 Ų24.70%014%0.141CC..Hα-helixtrans-66.5-32.1178-70-18.5000112.6N23 L47 L54 G55 S93 S283 N286N23-D51 HydrophobicContact CB-CB 4.47Å; L47-D51 WeakPolarHBondContact O-CB 3.22Å; L47-D51 PolarHBondContact O-N 3.37Å; D51-L54 PolarHBondContact O-N 3.1Å; D51-G55 PolarHBondContact O-N 2.94Å; D51-S93 PolarHBondContact OD1-OG 3.2Å; D51-S283 VanDerWaalsContact CG-CB 3.43Å; D51-S283 VanDerWaalsContact CG-OG 3.25Å; D51-S283 WeakPolarHBondContact OD1-CB 3.48Å; D51-S283 PolarHBondContact OD1-OG 3.16Å; D51-N286 PolarHBondContact OD2-ND2 3.12Å
52L98.2Very high96.9Very high31 Ų3124.2 Ų24.216%0.16214%0.139CC..Hα-helixtrans-66.5-47.4171.6-82.2171.4000112.2I20 N23 V24 A48 V49 A50 L54 G55 V56I20-L52 HydrophobicContact CG2-CD2 4.29Å; I20-L52 VanDerWaalsContact O-CD2 3.25Å; I20-L52 WeakPolarHBondContact O-CD2 3.22Å; N23-L52 HydrophobicContact CB-CD1 4.39Å; N23-L52 HydrophobicContact CB-CD2 3.79Å; N23-L52 HydrophobicContact CB-CG 3.59Å; V24-L52 HydrophobicContact CB-CD2 4.49Å; V24-L52 HydrophobicContact CG2-CD1 4.33Å; V24-L52 HydrophobicContact CG2-CD2 3.62Å; A48-L52 VanDerWaalsContact O-CB 3.31Å; A48-L52 WeakPolarHBondContact O-CB 3.46Å; A48-L52 WeakPolarHBondContact O-CG 3.37Å; A48-L52 PolarHBondContact O-N 3.26Å; V49-L52 PolarHBondContact O-N 3Å; A50-L52 VanDerWaalsContact C-N 3.34Å; A50-L52 PolarHBondContact O-N 3.45Å; L52-L54 PolarHBondContact O-N 3.31Å; L52-G55 PolarHBondContact O-N 3.39Å; L52-V56 WeakPolarHBondContact O-CG2 3.28Å; L52-V56 PolarHBondContact O-N 2.86Å
53L98.4Very high97Very high62 Ų6223.8 Ų23.833%0.32514%0.136SC..Hα-helixtrans-62.4-37.3176.5-69.2179.1000110.4V49 A50 V56 L57 L89 W131V49-L53 HydrophobicContact CG1-CD1 4.39Å; V49-L53 WeakPolarHBondContact O-CG 3.48Å; V49-L53 PolarHBondContact O-N 3.37Å; A50-L53 PolarHBondContact O-N 2.99Å; L53-V56 PolarHBondContact O-N 3.33Å; L53-L57 HydrophobicContact CB-CD1 4.32Å; L53-L57 HydrophobicContact CD2-CD1 4.08Å; L53-L57 WeakPolarHBondContact O-CB 3.42Å; L53-L57 WeakPolarHBondContact O-CG 3.41Å; L53-L57 PolarHBondContact O-N 3.25Å; L53-L89 HydrophobicContact CB-CD1 3.92Å; L53-L89 HydrophobicContact CB-CD2 3.65Å; L53-L89 HydrophobicContact CB-CG 4.46Å; L53-L89 HydrophobicContact CD1-CD2 4.06Å; L53-W131 HydrophobicContact CD1-CH2 3.8Å; L53-W131 HydrophobicContact CD1-CZ3 4.04Å
54L98.4Very high96.9Very high0 Ų025.4 Ų25.40%015%0.147CC..Iπ-helixtrans-61-49.3173.4-17477.6000110.2A50 D51 L52 V56 V58 L59 L89 Y280 S283A50-L54 WeakPolarHBondContact O-CB 3.08Å; A50-L54 PolarHBondContact O-N 3.4Å; D51-L54 PolarHBondContact O-N 3.1Å; L52-L54 PolarHBondContact O-N 3.31Å; L54-V56 VanDerWaalsContact C-N 3.31Å; L54-V56 PolarHBondContact O-N 3.18Å; L54-V58 HydrophobicContact CD1-CB 3.76Å; L54-V58 HydrophobicContact CD1-CG1 3.85Å; L54-V58 HydrophobicContact CD1-CG2 4.01Å; L54-V58 HydrophobicContact CG-CB 4.38Å; L54-V58 WeakPolarHBondContact O-CA 3.48Å; L54-V58 WeakPolarHBondContact O-CB 3.25Å; L54-V58 PolarHBondContact O-N 3.06Å; L54-L59 HydrophobicContact CG-CD2 4.35Å; L54-L59 HydrophobicContact CG-CG 4.41Å; L54-L59 PolarHBondContact O-N 2.9Å; L54-L89 HydrophobicContact CB-CB 4.31Å; L54-L89 HydrophobicContact CB-CD1 4.36Å; L54-L89 HydrophobicContact CD1-CB 4.05Å; L54-Y280 HydrophobicContact CD1-CE1 4.33Å; L54-Y280 HydrophobicContact CD2-CD1 4.12Å; L54-S283 WeakPolarHBondContact CD2-OG 3.42Å
55G98.1Very high96.7Very high0 Ų025.4 Ų25.40%015%0.147CC..Iπ-helixtrans-61.2-33.8179.300000114.6D51 L52 P60D51-G55 PolarHBondContact O-N 2.94Å; L52-G55 PolarHBondContact O-N 3.39Å; G55-P60 WeakPolarHBondContact O-CD 3.33Å
56V98.2Very high96.5Very high82 Ų8225 Ų2550%0.49714%0.142SC..Iπ-helixtrans-90.8-40.4-177.4174.60000112.5I20 L52 L53 L54 P60I20-V56 HydrophobicContact CD1-CG2 4Å; I20-V56 HydrophobicContact CG1-CG2 4.1Å; L52-V56 WeakPolarHBondContact O-CG2 3.28Å; L52-V56 PolarHBondContact O-N 2.86Å; L53-V56 PolarHBondContact O-N 3.33Å; L54-V56 VanDerWaalsContact C-N 3.31Å; L54-V56 PolarHBondContact O-N 3.18Å; V56-P60 WeakPolarHBondContact O-CG 3.46Å
57L97.1Very high96.2Very high78 Ų7827.7 Ų27.741%0.40816%0.155SC..Iπ-helixtrans-99.2-31.3-170.1-56.2178.1000113.3L53 L61L53-L57 HydrophobicContact CB-CD1 4.32Å; L53-L57 HydrophobicContact CD2-CD1 4.08Å; L53-L57 WeakPolarHBondContact O-CB 3.42Å; L53-L57 WeakPolarHBondContact O-CG 3.41Å; L53-L57 PolarHBondContact O-N 3.25Å; L57-L61 WeakPolarHBondContact O-CD1 3.23Å
58V97.9Very high95.8Very high0 Ų033.9 Ų33.90%018%0.178CC..Iπ-helixtrans-107.5-52.4-170.5177.20000111.3L54 P60 L61 S62 Y82 M85 D86 L89L54-V58 HydrophobicContact CD1-CB 3.76Å; L54-V58 HydrophobicContact CD1-CG1 3.85Å; L54-V58 HydrophobicContact CD1-CG2 4.01Å; L54-V58 HydrophobicContact CG-CB 4.38Å; L54-V58 WeakPolarHBondContact O-CA 3.48Å; L54-V58 WeakPolarHBondContact O-CB 3.25Å; L54-V58 PolarHBondContact O-N 3.06Å; V58-P60 VanDerWaalsContact C-CD 3.49Å; V58-L61 PolarHBondContact O-N 3.12Å; V58-L61 VanDerWaalsContact O-N 3.09Å; V58-S62 PolarHBondContact O-N 3.39Å; V58-Y82 HydrophobicContact CG1-CD2 4.42Å; V58-Y82 HydrophobicContact CG1-CE2 3.81Å; V58-M85 HydrophobicContact CG2-CB 3.99Å; V58-D86 HydrophobicContact CG1-CB 3.68Å; V58-D86 HydrophobicContact CG2-CB 4.36Å; V58-L89 HydrophobicContact CG2-CD1 3.87Å
59L97.6Very high95.2Very high0 Ų039.5 Ų39.50%021%0.208CC..Hα-helixtrans-59.2-37.2-174.3-60.7-171.2000114.3V15 I16 T19 L54 S62 A63 Y280V15-L59 HydrophobicContact CG1-CD1 4.4Å; I16-L59 HydrophobicContact CD1-CB 4.38Å; I16-L59 HydrophobicContact CG1-CB 3.67Å; I16-L59 HydrophobicContact CG1-CD1 4.3Å; T19-L59 HydrophobicContact CG2-CD1 4.15Å; L54-L59 HydrophobicContact CG-CD2 4.35Å; L54-L59 HydrophobicContact CG-CG 4.41Å; L54-L59 PolarHBondContact O-N 2.9Å; L59-S62 PolarHBondContact O-N 3.18Å; L59-A63 VanDerWaalsContact O-CB 3.31Å; L59-A63 WeakPolarHBondContact O-CB 3.31Å; L59-A63 PolarHBondContact O-N 3.24Å; L59-Y280 HydrophobicContact CD2-CD1 3.85Å; L59-Y280 HydrophobicContact CD2-CD2 3.43Å; L59-Y280 VanDerWaalsContact CD2-CD2 3.43Å; L59-Y280 HydrophobicContact CD2-CE1 4.22Å; L59-Y280 HydrophobicContact CD2-CE2 3.83Å; L59-Y280 HydrophobicContact CD2-CG 3.43Å; L59-Y280 VanDerWaalsContact CD2-CG 3.43Å
60P96.7Very high94.6Very high50 Ų5037.7 Ų37.733%0.32520%0.199SC..Hα-helixtrans-64.9-41.8175.7-23.936.9000112.1G55 V56 V58 A63 T64G55-P60 WeakPolarHBondContact O-CD 3.33Å; V56-P60 WeakPolarHBondContact O-CG 3.46Å; V58-P60 VanDerWaalsContact C-CD 3.49Å; P60-A63 PolarHBondContact O-N 3.48Å; P60-T64 WeakPolarHBondContact O-CG2 3.37Å; P60-T64 PolarHBondContact O-N 3.16Å
61L95.6Very high94Very high54 Ų5441.7 Ų41.728%0.28322%0.216SC..Hα-helixtrans-67-42.7177.2-64.5177000110.9L57 V58 A63 T64 L65 W72 F74 Y82L57-L61 WeakPolarHBondContact O-CD1 3.23Å; V58-L61 PolarHBondContact O-N 3.12Å; V58-L61 VanDerWaalsContact O-N 3.09Å; L61-A63 PolarHBondContact O-N 3.15Å; L61-T64 PolarHBondContact O-N 3.26Å; L61-T64 VanDerWaalsContact O-N 3.16Å; L61-T64 PolarHBondContact O-OG1 3.09Å; L61-L65 PolarHBondContact O-N 2.9Å; L61-W72 HydrophobicContact CB-CH2 4.45Å; L61-W72 HydrophobicContact CB-CZ3 4.32Å; L61-W72 HydrophobicContact CD1-CH2 4.23Å; L61-W72 HydrophobicContact CD2-CH2 4.21Å; L61-W72 HydrophobicContact CD2-CZ3 4.49Å; L61-F74 HydrophobicContact CD2-CE2 4.29Å; L61-Y82 HydrophobicContact CB-CD2 3.58Å; L61-Y82 HydrophobicContact CB-CE2 3.73Å; L61-Y82 HydrophobicContact CB-CG 4.37Å; L61-Y82 HydrophobicContact CD1-CD2 3.79Å; L61-Y82 HydrophobicContact CD1-CG 4.27Å; L61-Y82 HydrophobicContact CG-CD2 4.33Å
62S95.3Very high93.6Very high1 Ų142.1 Ų42.11%0.00722%0.218CC..Hα-helixtrans-60.2-43.3173.7-168.80000111.9V58 L59 T64 L65 E66 Y82 Y280V58-S62 PolarHBondContact O-N 3.39Å; L59-S62 PolarHBondContact O-N 3.18Å; S62-T64 VanDerWaalsContact C-N 3.32Å; S62-T64 PolarHBondContact O-N 2.87Å; S62-L65 WeakPolarHBondContact O-CB 3.34Å; S62-L65 PolarHBondContact O-N 3.46Å; S62-L65 VanDerWaalsContact O-N 3.16Å; S62-E66 WeakPolarHBondContact O-CG 3.36Å; S62-E66 PolarHBondContact O-N 2.95Å; S62-Y82 WeakPolarHBondContact CA-OH 3.32Å; S62-Y82 WeakPolarHBondContact CB-OH 3.44Å; S62-Y82 PolarHBondContact OG-OH 2.66Å; S62-Y280 WeakPolarHBondContact OG-CE2 3.33Å
63A95.3Very high93Very high5 Ų541.7 Ų41.74%0.04122%0.216CC..Hα-helixtrans-63.3-36.8175.100000112.4L12 I16 L59 P60 L61 L65 E66 L67 W277L12-A63 HydrophobicContact CB-CB 4.13Å; L12-A63 HydrophobicContact CD1-CB 4.19Å; I16-A63 HydrophobicContact CD1-CB 3.99Å; L59-A63 VanDerWaalsContact O-CB 3.31Å; L59-A63 WeakPolarHBondContact O-CB 3.31Å; L59-A63 PolarHBondContact O-N 3.24Å; P60-A63 PolarHBondContact O-N 3.48Å; L61-A63 PolarHBondContact O-N 3.15Å; A63-L65 VanDerWaalsContact C-N 3.33Å; A63-E66 PolarHBondContact O-N 3Å; A63-L67 WeakPolarHBondContact O-CB 3.45Å; A63-L67 VanDerWaalsContact O-CG 3.25Å; A63-L67 WeakPolarHBondContact O-CG 3.48Å; A63-L67 PolarHBondContact O-N 3.37Å; A63-L67 VanDerWaalsContact O-N 3.09Å; A63-W277 HydrophobicContact CB-CH2 4.13Å; A63-W277 HydrophobicContact CB-CZ2 4.26Å
64T92.1Very high92.5Very high47 Ų4741.8 Ų41.829%0.28822%0.215SC..Hα-helixtrans-64.7-38.3173.860.60000112.4P60 L61 S62 L67 R68P60-T64 WeakPolarHBondContact O-CG2 3.37Å; P60-T64 PolarHBondContact O-N 3.16Å; L61-T64 PolarHBondContact O-N 3.26Å; L61-T64 VanDerWaalsContact O-N 3.16Å; L61-T64 PolarHBondContact O-OG1 3.09Å; S62-T64 VanDerWaalsContact C-N 3.32Å; S62-T64 PolarHBondContact O-N 2.87Å; T64-L67 PolarHBondContact O-N 2.84Å; T64-R68 WeakPolarHBondContact O-CB 3.39Å; T64-R68 WeakPolarHBondContact O-CG 3.46Å; T64-R68 PolarHBondContact O-N 3.45Å; T64-R68 VanDerWaalsContact O-N 3.08Å
65L90.6Very high92.1Very high12 Ų1242.2 Ų42.26%0.06322%0.218CC..Hα-helixtrans-63.8-45.5174.9-76.5168.9000111.2L61 S62 A63 L67 R68 D69 S70 W72 Y82 C171L61-L65 PolarHBondContact O-N 2.9Å; S62-L65 WeakPolarHBondContact O-CB 3.34Å; S62-L65 PolarHBondContact O-N 3.46Å; S62-L65 VanDerWaalsContact O-N 3.16Å; A63-L65 VanDerWaalsContact C-N 3.33Å; L65-L67 VanDerWaalsContact C-N 3.29Å; L65-L67 PolarHBondContact O-N 3.26Å; L65-R68 PolarHBondContact O-N 3.35Å; L65-D69 PolarHBondContact O-N 3.47Å; L65-S70 WeakPolarHBondContact CD2-O 3.36Å; L65-S70 WeakPolarHBondContact O-CA 3.46Å; L65-S70 PolarHBondContact O-N 3.17Å; L65-W72 HydrophobicContact CD1-CE3 4.1Å; L65-W72 HydrophobicContact CD1-CZ3 4.14Å; L65-W72 HydrophobicContact CD2-CB 4.29Å; L65-W72 HydrophobicContact CD2-CE3 3.74Å; L65-W72 HydrophobicContact CG-CE3 3.95Å; L65-W72 HydrophobicContact CG-CZ3 4.25Å; L65-Y82 HydrophobicContact CD1-CD1 4.3Å; L65-Y82 HydrophobicContact CD1-CE1 3.52Å; L65-C171 HydrophobicContact CD1-CB 4.46Å; L65-C171 HydrophobicContact CD2-CB 4.18Å
66E91.8Very high91.8Very high39 Ų3942.3 Ų42.318%0.18222%0.219CC..Hα-helixtrans-61.7-35177.4-70-63.1162.600113.6L12 S62 A63 S273 W277L12-E66 HydrophobicContact CD1-CB 4.03Å; S62-E66 WeakPolarHBondContact O-CG 3.36Å; S62-E66 PolarHBondContact O-N 2.95Å; A63-E66 PolarHBondContact O-N 3Å; E66-S273 VanDerWaalsContact CD-OG 3.28Å; E66-S273 VanDerWaalsContact OE1-CB 3.24Å; E66-S273 WeakPolarHBondContact OE1-CB 3.21Å; E66-S273 PolarHBondContact OE1-OG 3.21Å; E66-S273 WeakPolarHBondContact OE2-CB 3.42Å; E66-S273 PolarHBondContact OE2-OG 3.42Å; E66-W277 HydrophobicContact CG-CZ2 4.18Å; E66-W277 PolarHBondContact OE1-NE1 3.05Å
67L90.8Very high91.5Very high64 Ų6443.3 Ų43.334%0.33523%0.226SC..Hα-helixtrans-84.1-16.6-178.5-66.9170.3000113.4T5 W9 L12 A63 T64 L65T5-L67 HydrophobicContact CG2-CD2 4.46Å; W9-L67 HydrophobicContact CB-CD2 4.31Å; L12-L67 HydrophobicContact CD1-CD1 4.38Å; L12-L67 HydrophobicContact CD1-CD2 4.13Å; L12-L67 HydrophobicContact CD1-CG 4Å; A63-L67 WeakPolarHBondContact O-CB 3.45Å; A63-L67 VanDerWaalsContact O-CG 3.25Å; A63-L67 WeakPolarHBondContact O-CG 3.48Å; A63-L67 PolarHBondContact O-N 3.37Å; A63-L67 VanDerWaalsContact O-N 3.09Å; T64-L67 PolarHBondContact O-N 2.84Å; L65-L67 VanDerWaalsContact C-N 3.29Å; L65-L67 PolarHBondContact O-N 3.26Å
68R88.2Confident91.3Very high130 Ų13043.7 Ų43.749%0.49123%0.228SC..THydrogen-bonded Turntrans-110.424.7-179.8-67.3-173.8174.5-121.91.4112.8T64 L65 S70 K71T64-R68 WeakPolarHBondContact O-CB 3.39Å; T64-R68 WeakPolarHBondContact O-CG 3.46Å; T64-R68 PolarHBondContact O-N 3.45Å; T64-R68 VanDerWaalsContact O-N 3.08Å; L65-R68 PolarHBondContact O-N 3.35Å; R68-S70 PolarHBondContact O-N 2.95Å; R68-K71 HydrophobicContact CB-CB 4.42Å; R68-K71 VanDerWaalsContact O-CB 3.29Å; R68-K71 WeakPolarHBondContact O-CB 3.41Å; R68-K71 WeakPolarHBondContact O-CG 3.31Å; R68-K71 PolarHBondContact O-N 3.29Å
69D84.6Confident91.1Very high118 Ų11843.7 Ų43.763%0.63123%0.228SC*.THydrogen-bonded Turntrans51.843.9-178.9-59.3-49.9000112.3L65 K71 Y170L65-D69 PolarHBondContact O-N 3.47Å; D69-K71 PolarHBondContact O-N 3.48Å; D69-Y170 WeakPolarHBondContact O-CE1 3.34Å
70S84.4Confident91Very high19 Ų1944 Ų4413%0.13323%0.23CC..THydrogen-bonded Turntrans65.98.5-177.1-580000116.4L65 R68 Y170L65-S70 WeakPolarHBondContact CD2-O 3.36Å; L65-S70 WeakPolarHBondContact O-CA 3.46Å; L65-S70 PolarHBondContact O-N 3.17Å; R68-S70 PolarHBondContact O-N 2.95Å; S70-Y170 WeakPolarHBondContact O-CA 3.24Å
71K86.7Confident91Very high84 Ų8444.5 Ų44.537%0.36523%0.229SC..BIsolated β-bridgetrans-73.2134.2176.9-63.3179-179.7-175.10112.1R68 D69 R169 Y170R68-K71 HydrophobicContact CB-CB 4.42Å; R68-K71 VanDerWaalsContact O-CB 3.29Å; R68-K71 WeakPolarHBondContact O-CB 3.41Å; R68-K71 WeakPolarHBondContact O-CG 3.31Å; R68-K71 PolarHBondContact O-N 3.29Å; D69-K71 PolarHBondContact O-N 3.48Å; K71-R169 WeakPolarHBondContact CA-O 3.14Å; K71-Y170 HydrophobicContact CG-CE1 4.11Å
72W88.9Confident91Very high9 Ų942.7 Ų42.73%0.03422%0.219CC..  trans-114.6112.1-175-177.4-97.6000113.1L61 L65 F74 G75 L78 C79 Y82 W158 R169 C171L61-W72 HydrophobicContact CB-CH2 4.45Å; L61-W72 HydrophobicContact CB-CZ3 4.32Å; L61-W72 HydrophobicContact CD1-CH2 4.23Å; L61-W72 HydrophobicContact CD2-CH2 4.21Å; L61-W72 HydrophobicContact CD2-CZ3 4.49Å; L65-W72 HydrophobicContact CD1-CE3 4.1Å; L65-W72 HydrophobicContact CD1-CZ3 4.14Å; L65-W72 HydrophobicContact CD2-CB 4.29Å; L65-W72 HydrophobicContact CD2-CE3 3.74Å; L65-W72 HydrophobicContact CG-CE3 3.95Å; L65-W72 HydrophobicContact CG-CZ3 4.25Å; W72-F74 HydrophobicContact CD2-CD2 4.02Å; W72-F74 AromaticContact CE2-CD2 3.88Å; W72-F74 AromaticContact CE3-CD2 3.98Å; W72-F74 HydrophobicContact CE3-CD2 3.98Å; W72-F74 AromaticContact CH2-CD2 3.84Å; W72-F74 HydrophobicContact CH2-CD2 3.84Å; W72-F74 HydrophobicContact CZ2-CB 3.76Å; W72-F74 AromaticContact CZ2-CD2 3.79Å; W72-F74 HydrophobicContact CZ2-CD2 3.79Å; W72-F74 HydrophobicContact CZ2-CG 4.25Å; W72-F74 AromaticContact CZ3-CD2 3.92Å; W72-F74 HydrophobicContact CZ3-CD2 3.92Å; W72-F74 HydrophobicContact CZ3-CE2 4.44Å; W72-G75 PolarHBondContact NE1-O 3.09Å; W72-L78 VanDerWaalsContact CZ2-C 3.48Å; W72-L78 HydrophobicContact CZ2-CB 3.86Å; W72-C79 HydrophobicContact CD2-CB 4.33Å; W72-C79 HydrophobicContact CG-CB 4.38Å; W72-C79 HydrophobicContact CZ2-CB 4.23Å; W72-Y82 HydrophobicContact CH2-CD1 4.36Å; W72-Y82 HydrophobicContact CH2-CG 4.11Å; W72-Y82 HydrophobicContact CZ3-CD1 4.3Å; W72-Y82 HydrophobicContact CZ3-CG 4.37Å; W72-W158 HydrophobicContact CB-CZ3 4.43Å; W72-R169 PolarHBondContact N-O 3.48Å; W72-C171 HydrophobicContact CB-CB 3.53Å; W72-C171 HydrophobicContact CD2-CB 3.67Å; W72-C171 HydrophobicContact CE3-CB 3.85Å; W72-C171 HydrophobicContact CG-CB 3.57Å
73P86Confident91Very high21 Ų2143 Ų4314%0.13622%0.22CC..  trans-92-8.9-176.634.8-35.3000114.5G75 G161P73-G75 PolarHBondContact O-N 3.06Å; P73-G161 PolarHBondContact O-N 2.92Å
74F89.1Confident91.1Very high65 Ų6542.8 Ų42.829%0.28522%0.218SC..SBendtrans-92.514.1-164.7-50.5-70.3000114.7L61 W72 L78 F160L61-F74 HydrophobicContact CD2-CE2 4.29Å; W72-F74 HydrophobicContact CD2-CD2 4.02Å; W72-F74 AromaticContact CE2-CD2 3.88Å; W72-F74 AromaticContact CE3-CD2 3.98Å; W72-F74 HydrophobicContact CE3-CD2 3.98Å; W72-F74 AromaticContact CH2-CD2 3.84Å; W72-F74 HydrophobicContact CH2-CD2 3.84Å; W72-F74 HydrophobicContact CZ2-CB 3.76Å; W72-F74 AromaticContact CZ2-CD2 3.79Å; W72-F74 HydrophobicContact CZ2-CD2 3.79Å; W72-F74 HydrophobicContact CZ2-CG 4.25Å; W72-F74 AromaticContact CZ3-CD2 3.92Å; W72-F74 HydrophobicContact CZ3-CD2 3.92Å; W72-F74 HydrophobicContact CZ3-CE2 4.44Å; F74-L78 HydrophobicContact CB-CB 4.18Å; F74-L78 HydrophobicContact CB-CD1 3.87Å; F74-L78 WeakPolarHBondContact O-CD1 3.48Å; F74-F160 HydrophobicContact CB-CE2 4.45Å; F74-F160 HydrophobicContact CD1-CE2 4.23Å
75G89.9Confident91.4Very high8 Ų843 Ų438%0.08222%0.216CC..Hα-helixtrans74.5165.6-178.700000114.3W72 P73 C79W72-G75 PolarHBondContact NE1-O 3.09Å; P73-G75 PolarHBondContact O-N 3.06Å; G75-C79 PolarHBondContact O-N 3.48Å
76G91.1Very high91.7Very high2 Ų243.3 Ų43.32%0.02122%0.218CC..Hα-helixtrans-69.1-38.9-168.700000115.3L78 C79 N80 N155 W158G76-L78 VanDerWaalsContact C-N 3.34Å; G76-L78 PolarHBondContact O-N 2.92Å; G76-C79 WeakPolarHBondContact O-CB 3.38Å; G76-C79 PolarHBondContact O-N 3.34Å; G76-C79 VanDerWaalsContact O-N 3.12Å; G76-N80 PolarHBondContact O-N 3.31Å; G76-N155 VanDerWaalsContact CA-O 3.24Å; G76-N155 WeakPolarHBondContact CA-O 3.43Å; G76-W158 PolarHBondContact N-O 2.91Å; G76-W158 VanDerWaalsContact N-O 3.09Å
77T92.2Very high91.9Very high104 Ų10442.3 Ų42.364%0.63822%0.215SC*.Hα-helixtrans-58.7-45.8178.5-51.60000111.6C79 N80 I81T77-C79 VanDerWaalsContact C-N 3.34Å; T77-N80 PolarHBondContact O-N 3.48Å; T77-I81 HydrophobicContact CG2-CD1 3.96Å; T77-I81 VanDerWaalsContact O-CG1 3.28Å; T77-I81 WeakPolarHBondContact O-CG1 3.43Å; T77-I81 PolarHBondContact O-N 3.34Å
78L93Very high92.3Very high86 Ų8640 Ų4045%0.4520%0.202SC..Hα-helixtrans-70-31.8177.8-74177.1000112W72 F74 G76 I81 Y82W72-L78 VanDerWaalsContact CZ2-C 3.48Å; W72-L78 HydrophobicContact CZ2-CB 3.86Å; F74-L78 HydrophobicContact CB-CB 4.18Å; F74-L78 HydrophobicContact CB-CD1 3.87Å; F74-L78 WeakPolarHBondContact O-CD1 3.48Å; G76-L78 VanDerWaalsContact C-N 3.34Å; G76-L78 PolarHBondContact O-N 2.92Å; L78-I81 HydrophobicContact CD2-CD1 4.41Å; L78-I81 PolarHBondContact O-N 3.23Å; L78-Y82 VanDerWaalsContact O-CB 3.25Å; L78-Y82 WeakPolarHBondContact O-CB 3.42Å; L78-Y82 PolarHBondContact O-N 3.49Å
79C93.8Very high92.7Very high0 Ų033.8 Ų33.80%018%0.179CC..Hα-helixtrans-61.2-48.4172.9175.30000110.9W72 G75 G76 T77 I81 Y82 I83 N155 W158 C171W72-C79 HydrophobicContact CD2-CB 4.33Å; W72-C79 HydrophobicContact CG-CB 4.38Å; W72-C79 HydrophobicContact CZ2-CB 4.23Å; G75-C79 PolarHBondContact O-N 3.48Å; G76-C79 WeakPolarHBondContact O-CB 3.38Å; G76-C79 PolarHBondContact O-N 3.34Å; G76-C79 VanDerWaalsContact O-N 3.12Å; T77-C79 VanDerWaalsContact C-N 3.34Å; C79-I81 PolarHBondContact O-N 3.4Å; C79-Y82 WeakPolarHBondContact O-CB 3.19Å; C79-Y82 PolarHBondContact O-N 3.25Å; C79-I83 WeakPolarHBondContact O-CB 3.39Å; C79-I83 VanDerWaalsContact O-CG1 3.3Å; C79-I83 WeakPolarHBondContact O-CG1 3.27Å; C79-I83 PolarHBondContact O-N 2.9Å; C79-I83 VanDerWaalsContact SG-CD1 3.59Å; C79-N155 PolarHBondContact SG-ND2 3.33Å; C79-N155 VanDerWaalsContact SG-ND2 3.41Å; C79-W158 HydrophobicContact CB-CZ3 4.37Å; C79-C171 WeakPolarHBondContact CA-SG 3.35Å; C79-C171 HydrophobicContact CB-CB 3.93Å; C79-C171 WeakPolarHBondContact CB-SG 3.44Å; C79-C171 WeakPolarHBondContact SG-CA 3.44Å; C79-C171 WeakPolarHBondContact SG-CB 3.13Å; C79-C171 CovalentContact SG-SG 2.03Å; C79-C171 PolarHBondContact SG-SG 2.87Å
80N95.1Very high93.3Very high6 Ų628.5 Ų28.53%0.03215%0.151CC..Hα-helixtrans-65.2-38.5179.1-70.6-15.7000112.7G76 T77 S84 V142 Q154 N155G76-N80 PolarHBondContact O-N 3.31Å; T77-N80 PolarHBondContact O-N 3.48Å; N80-S84 VanDerWaalsContact O-CB 3.3Å; N80-S84 WeakPolarHBondContact O-CB 3.5Å; N80-S84 PolarHBondContact O-N 3.3Å; N80-S84 PolarHBondContact O-OG 3.46Å; N80-V142 HydrophobicContact CB-CG1 3.82Å; N80-Q154 PolarHBondContact ND2-O 2.92Å; N80-Q154 WeakPolarHBondContact OD1-CG 3.41Å; N80-Q154 PolarHBondContact OD1-NE2 2.84Å; N80-Q154 VanDerWaalsContact OD1-NE2 3.11Å; N80-N155 PolarHBondContact OD1-ND2 2.6Å
81I96.3Very high93.8Very high60 Ų6027.6 Ų27.631%0.30815%0.145SC..Hα-helixtrans-64.1-46173.4-69.2166.8000110.4T77 L78 C79 S84 M85T77-I81 HydrophobicContact CG2-CD1 3.96Å; T77-I81 VanDerWaalsContact O-CG1 3.28Å; T77-I81 WeakPolarHBondContact O-CG1 3.43Å; T77-I81 PolarHBondContact O-N 3.34Å; L78-I81 HydrophobicContact CD2-CD1 4.41Å; L78-I81 PolarHBondContact O-N 3.23Å; C79-I81 PolarHBondContact O-N 3.4Å; I81-S84 PolarHBondContact O-N 3.31Å; I81-M85 HydrophobicContact CG2-CG 4.19Å; I81-M85 WeakPolarHBondContact O-CB 3.37Å; I81-M85 VanDerWaalsContact O-CG 3.23Å; I81-M85 WeakPolarHBondContact O-CG 3.21Å; I81-M85 PolarHBondContact O-N 2.97Å
82Y96.7Very high94.4Very high17 Ų1723.6 Ų23.67%0.06713%0.128CC..Hα-helixtrans-57.8-51.5177.7158.6-105.7000111.5V58 L61 S62 L65 W72 L78 C79 S84 M85 D86V58-Y82 HydrophobicContact CG1-CD2 4.42Å; V58-Y82 HydrophobicContact CG1-CE2 3.81Å; L61-Y82 HydrophobicContact CB-CD2 3.58Å; L61-Y82 HydrophobicContact CB-CE2 3.73Å; L61-Y82 HydrophobicContact CB-CG 4.37Å; L61-Y82 HydrophobicContact CD1-CD2 3.79Å; L61-Y82 HydrophobicContact CD1-CG 4.27Å; L61-Y82 HydrophobicContact CG-CD2 4.33Å; S62-Y82 WeakPolarHBondContact CA-OH 3.32Å; S62-Y82 WeakPolarHBondContact CB-OH 3.44Å; S62-Y82 PolarHBondContact OG-OH 2.66Å; L65-Y82 HydrophobicContact CD1-CD1 4.3Å; L65-Y82 HydrophobicContact CD1-CE1 3.52Å; W72-Y82 HydrophobicContact CH2-CD1 4.36Å; W72-Y82 HydrophobicContact CH2-CG 4.11Å; W72-Y82 HydrophobicContact CZ3-CD1 4.3Å; W72-Y82 HydrophobicContact CZ3-CG 4.37Å; L78-Y82 VanDerWaalsContact O-CB 3.25Å; L78-Y82 WeakPolarHBondContact O-CB 3.42Å; L78-Y82 PolarHBondContact O-N 3.49Å; C79-Y82 WeakPolarHBondContact O-CB 3.19Å; C79-Y82 PolarHBondContact O-N 3.25Å; Y82-S84 VanDerWaalsContact C-N 3.33Å; Y82-S84 PolarHBondContact O-N 3.05Å; Y82-M85 PolarHBondContact O-N 2.95Å; Y82-D86 PolarHBondContact O-N 2.82Å
83I95.3Very high94.7Very high8 Ų823.2 Ų23.24%0.04113%0.126CC..Hα-helixtrans-57.8-47.3178.2-71170.4000110.5C79 M85 D86 V87 V142 Q172 F173C79-I83 WeakPolarHBondContact O-CB 3.39Å; C79-I83 VanDerWaalsContact O-CG1 3.3Å; C79-I83 WeakPolarHBondContact O-CG1 3.27Å; C79-I83 PolarHBondContact O-N 2.9Å; C79-I83 VanDerWaalsContact SG-CD1 3.59Å; I83-M85 PolarHBondContact O-N 3.01Å; I83-D86 PolarHBondContact O-N 2.97Å; I83-V87 WeakPolarHBondContact O-CG2 3.5Å; I83-V87 PolarHBondContact O-N 2.93Å; I83-V142 HydrophobicContact CG2-CG2 4.06Å; I83-Q172 WeakPolarHBondContact CD1-O 3.4Å; I83-F173 HydrophobicContact CG2-CB 4.46Å; I83-F173 HydrophobicContact CG2-CD2 3.5Å; I83-F173 VanDerWaalsContact CG2-CD2 3.5Å; I83-F173 HydrophobicContact CG2-CE2 4.22Å; I83-F173 HydrophobicContact CG2-CG 4.46Å
84S97.5Very high95.2Very high0 Ų022.2 Ų22.20%012%0.12CC..Hα-helixtrans-64.5-39.5179.5-57.60000111.9N80 I81 Y82 M88 A138 V142 H143N80-S84 VanDerWaalsContact O-CB 3.3Å; N80-S84 WeakPolarHBondContact O-CB 3.5Å; N80-S84 PolarHBondContact O-N 3.3Å; N80-S84 PolarHBondContact O-OG 3.46Å; I81-S84 PolarHBondContact O-N 3.31Å; Y82-S84 VanDerWaalsContact C-N 3.33Å; Y82-S84 PolarHBondContact O-N 3.05Å; S84-M88 WeakPolarHBondContact O-CB 3.27Å; S84-M88 PolarHBondContact O-N 3.13Å; S84-A138 VanDerWaalsContact O-CB 3.28Å; S84-A138 WeakPolarHBondContact O-CB 3.48Å; S84-V142 WeakPolarHBondContact OG-CB 3.27Å; S84-H143 PolarHBondContact OG-NE2 3.41Å
85M97.9Very high95.5Very high50 Ų5020.2 Ų20.225%0.24611%0.112CC..Hα-helixtrans-65.8-41.6176.8-74.1-63.1179.900112V58 I81 Y82 I83 M88 L89 F139V58-M85 HydrophobicContact CG2-CB 3.99Å; I81-M85 HydrophobicContact CG2-CG 4.19Å; I81-M85 WeakPolarHBondContact O-CB 3.37Å; I81-M85 VanDerWaalsContact O-CG 3.23Å; I81-M85 WeakPolarHBondContact O-CG 3.21Å; I81-M85 PolarHBondContact O-N 2.97Å; Y82-M85 PolarHBondContact O-N 2.95Å; I83-M85 PolarHBondContact O-N 3.01Å; M85-M88 PolarHBondContact O-N 3.27Å; M85-M88 HydrophobicContact SD-CE 3.51Å; M85-M88 VanDerWaalsContact SD-CE 3.51Å; M85-L89 WeakPolarHBondContact O-CB 3.49Å; M85-L89 WeakPolarHBondContact O-CD1 3.38Å; M85-L89 WeakPolarHBondContact O-CG 3.17Å; M85-L89 PolarHBondContact O-N 2.94Å; M85-F139 HydrophobicContact CE-CE2 4.36Å; M85-F139 HydrophobicContact CE-CZ 3.68Å; M85-F139 HydrophobicContact CG-CZ 4.37Å; M85-F139 HydrophobicContact SD-CE2 4.22Å; M85-F139 HydrophobicContact SD-CZ 4.01Å
86D97.2Very high95.8Very high19 Ų1919.8 Ų19.810%0.10211%0.108CC..Hα-helixtrans-58.6-54.8175.7-171.911.9000111V58 Y82 I83 M88 L89 C90 Y280V58-D86 HydrophobicContact CG1-CB 3.68Å; V58-D86 HydrophobicContact CG2-CB 4.36Å; Y82-D86 PolarHBondContact O-N 2.82Å; I83-D86 PolarHBondContact O-N 2.97Å; D86-M88 VanDerWaalsContact C-N 3.33Å; D86-M88 PolarHBondContact O-N 3.06Å; D86-L89 PolarHBondContact O-N 2.89Å; D86-C90 VanDerWaalsContact O-CB 3.27Å; D86-C90 WeakPolarHBondContact O-CB 3.38Å; D86-C90 PolarHBondContact O-N 2.69Å; D86-C90 PolarHBondContact O-SG 3.46Å; D86-C90 PolarHBondContact OD1-SG 3.39Å; D86-Y280 VanDerWaalsContact CG-OH 3.31Å; D86-Y280 WeakPolarHBondContact OD1-CE1 3.29Å; D86-Y280 PolarHBondContact OD1-OH 2.66Å; D86-Y280 PolarHBondContact OD2-OH 3.26Å
87V95.8Very high95.9Very high19 Ų1920.1 Ų20.112%0.11511%0.109CC..Hα-helixtrans-58.4-44.5178.4174.60000111.3I83 T91 A138 F173 Y183I83-V87 WeakPolarHBondContact O-CG2 3.5Å; I83-V87 PolarHBondContact O-N 2.93Å; V87-T91 VanDerWaalsContact O-CB 3.25Å; V87-T91 WeakPolarHBondContact O-CB 3.35Å; V87-T91 PolarHBondContact O-N 3.41Å; V87-T91 PolarHBondContact O-OG1 2.95Å; V87-A138 HydrophobicContact CB-CB 3.89Å; V87-A138 HydrophobicContact CG1-CB 3.67Å; V87-F173 HydrophobicContact CG2-CD2 4.43Å; V87-F173 HydrophobicContact CG2-CE2 4.42Å; V87-Y183 HydrophobicContact CG1-CE2 3.77Å; V87-Y183 WeakPolarHBondContact CG1-OH 3.36Å
88M97.8Very high96Very high15 Ų1516.7 Ų16.77%0.0749%0.086CC..Hα-helixtrans-61.5-52-179.8-179.4-174.574.400111.5S84 M85 D86 T91 C92 S134 L135 A138 F139S84-M88 WeakPolarHBondContact O-CB 3.27Å; S84-M88 PolarHBondContact O-N 3.13Å; M85-M88 PolarHBondContact O-N 3.27Å; M85-M88 HydrophobicContact SD-CE 3.51Å; M85-M88 VanDerWaalsContact SD-CE 3.51Å; D86-M88 VanDerWaalsContact C-N 3.33Å; D86-M88 PolarHBondContact O-N 3.06Å; M88-T91 PolarHBondContact O-N 2.91Å; M88-C92 VanDerWaalsContact O-CB 3.28Å; M88-C92 WeakPolarHBondContact O-CB 3.33Å; M88-C92 PolarHBondContact O-N 3.44Å; M88-S134 WeakPolarHBondContact O-CB 3.23Å; M88-L135 HydrophobicContact SD-CB 4.08Å; M88-L135 HydrophobicContact SD-CD1 3.49Å; M88-L135 WeakPolarHBondContact SD-CD1 3.48Å; M88-L135 HydrophobicContact SD-CG 4.42Å; M88-A138 HydrophobicContact CB-CB 3.61Å; M88-F139 HydrophobicContact CB-CE2 4.49Å; M88-F139 HydrophobicContact SD-CE2 4Å
89L98.1Very high96Very high0 Ų013.3 Ų13.30%07%0.071CC..Hα-helixtrans-70.4-38.6-172.7-67.9167000110.9L53 L54 V58 M85 D86 C92 S93 W131L53-L89 HydrophobicContact CB-CD1 3.92Å; L53-L89 HydrophobicContact CB-CD2 3.65Å; L53-L89 HydrophobicContact CB-CG 4.46Å; L53-L89 HydrophobicContact CD1-CD2 4.06Å; L54-L89 HydrophobicContact CB-CB 4.31Å; L54-L89 HydrophobicContact CB-CD1 4.36Å; L54-L89 HydrophobicContact CD1-CB 4.05Å; V58-L89 HydrophobicContact CG2-CD1 3.87Å; M85-L89 WeakPolarHBondContact O-CB 3.49Å; M85-L89 WeakPolarHBondContact O-CD1 3.38Å; M85-L89 WeakPolarHBondContact O-CG 3.17Å; M85-L89 PolarHBondContact O-N 2.94Å; D86-L89 PolarHBondContact O-N 2.89Å; L89-C92 PolarHBondContact O-N 3.38Å; L89-S93 PolarHBondContact O-N 3.5Å; L89-S93 PolarHBondContact O-OG 3.31Å; L89-W131 HydrophobicContact CD2-CH2 4.37Å; L89-W131 HydrophobicContact CD2-CZ3 4.22Å
90C95.9Very high95.9Very high6 Ų614.4 Ų14.44%0.0418%0.077CC..Hα-helixtrans-64.4-45173.5-66.50000111.8D86 C92 S93 I94 W249D86-C90 VanDerWaalsContact O-CB 3.27Å; D86-C90 WeakPolarHBondContact O-CB 3.38Å; D86-C90 PolarHBondContact O-N 2.69Å; D86-C90 PolarHBondContact O-SG 3.46Å; D86-C90 PolarHBondContact OD1-SG 3.39Å; C90-C92 VanDerWaalsContact C-N 3.34Å; C90-C92 PolarHBondContact O-N 3.21Å; C90-S93 PolarHBondContact O-N 2.93Å; C90-I94 VanDerWaalsContact O-CG1 3.31Å; C90-I94 WeakPolarHBondContact O-CG1 3.34Å; C90-I94 PolarHBondContact O-N 3.21Å; C90-W249 HydrophobicContact CB-CH2 3.55Å; C90-W249 HydrophobicContact CB-CZ2 3.97Å; C90-W249 HydrophobicContact CB-CZ3 4.43Å; C90-W249 WeakPolarHBondContact SG-CH2 3.14Å
91T96.6Very high95.7Very high1 Ų114.3 Ų14.31%0.0068%0.077CC..Hα-helixtrans-59.9-45.1174.4-590000111.2V87 M88 S93 I94 L95 S134 Y183 T187V87-T91 VanDerWaalsContact O-CB 3.25Å; V87-T91 WeakPolarHBondContact O-CB 3.35Å; V87-T91 PolarHBondContact O-N 3.41Å; V87-T91 PolarHBondContact O-OG1 2.95Å; M88-T91 PolarHBondContact O-N 2.91Å; T91-S93 VanDerWaalsContact C-N 3.31Å; T91-S93 PolarHBondContact O-N 3.33Å; T91-I94 PolarHBondContact O-N 2.89Å; T91-L95 HydrophobicContact CG2-CD1 3.98Å; T91-L95 HydrophobicContact CG2-CG 4.27Å; T91-L95 WeakPolarHBondContact O-CB 3.37Å; T91-L95 WeakPolarHBondContact O-CG 3.35Å; T91-L95 PolarHBondContact O-N 3.45Å; T91-S134 WeakPolarHBondContact CG2-OG 3.45Å; T91-Y183 PolarHBondContact OG1-OH 3.46Å; T91-T187 HydrophobicContact CG2-CG2 4.02Å
92C97.9Very high95.4Very high0 Ų014 Ų140%08%0.078CC..Hα-helixtrans-61-42.4179.3-178.30000110.9A50 M88 L89 C90 T96 W131 S134A50-C92 HydrophobicContact CB-CB 4.36Å; M88-C92 VanDerWaalsContact O-CB 3.28Å; M88-C92 WeakPolarHBondContact O-CB 3.33Å; M88-C92 PolarHBondContact O-N 3.44Å; L89-C92 PolarHBondContact O-N 3.38Å; C90-C92 VanDerWaalsContact C-N 3.34Å; C90-C92 PolarHBondContact O-N 3.21Å; C92-T96 VanDerWaalsContact O-CB 3.23Å; C92-T96 WeakPolarHBondContact O-CB 3.25Å; C92-T96 PolarHBondContact O-N 2.96Å; C92-T96 PolarHBondContact O-OG1 3.33Å; C92-W131 VanDerWaalsContact SG-CE2 3.59Å; C92-S134 VanDerWaalsContact CA-OG 3.23Å; C92-S134 WeakPolarHBondContact CA-OG 3.25Å; C92-S134 PolarHBondContact N-OG 3.29Å; C92-S134 VanDerWaalsContact N-OG 3.14Å
93S95.9Very high95.1Very high1 Ų113.5 Ų13.51%0.0078%0.076CC..Hα-helixtrans-64.6-44.3176.6-72.40000112.4L47 D51 L89 C90 T91 T96 L97L47-S93 WeakPolarHBondContact CD1-OG 3.44Å; D51-S93 PolarHBondContact OD1-OG 3.2Å; L89-S93 PolarHBondContact O-N 3.5Å; L89-S93 PolarHBondContact O-OG 3.31Å; C90-S93 PolarHBondContact O-N 2.93Å; T91-S93 VanDerWaalsContact C-N 3.31Å; T91-S93 PolarHBondContact O-N 3.33Å; S93-T96 PolarHBondContact O-N 2.81Å; S93-L97 WeakPolarHBondContact O-CG 3.18Å; S93-L97 PolarHBondContact O-N 3.22Å
94I95.2Very high94.6Very high0 Ų016.2 Ų16.20%09%0.086CC..Hα-helixtrans-62.3-49.5177.6-63.4159.4000111.3C90 T91 T96 L97 L98 T187 P191 F245 F253C90-I94 VanDerWaalsContact O-CG1 3.31Å; C90-I94 WeakPolarHBondContact O-CG1 3.34Å; C90-I94 PolarHBondContact O-N 3.21Å; T91-I94 PolarHBondContact O-N 2.89Å; I94-T96 VanDerWaalsContact C-N 3.29Å; I94-T96 PolarHBondContact O-N 3.19Å; I94-L97 WeakPolarHBondContact O-CB 3.35Å; I94-L97 PolarHBondContact O-N 3.31Å; I94-L98 PolarHBondContact O-N 3.18Å; I94-T187 WeakPolarHBondContact CG2-O 3.23Å; I94-P191 HydrophobicContact CG2-CB 4.16Å; I94-F245 HydrophobicContact CB-CE2 4.37Å; I94-F245 HydrophobicContact CB-CZ 4.4Å; I94-F245 HydrophobicContact CG1-CE2 3.79Å; I94-F245 HydrophobicContact CG1-CZ 4Å; I94-F245 HydrophobicContact CG2-CE2 4.26Å; I94-F245 HydrophobicContact CG2-CZ 3.83Å; I94-F253 HydrophobicContact CD1-CE2 3.67Å; I94-F253 HydrophobicContact CD1-CZ 3.64Å
95L96.6Very high94.1Very high22 Ų2219.9 Ų19.912%0.11510%0.1CC..Hα-helixtrans-65.7-33.8179.8-68.4-176.9000112.1T91 L98 A99 I130 L133 P191T91-L95 HydrophobicContact CG2-CD1 3.98Å; T91-L95 HydrophobicContact CG2-CG 4.27Å; T91-L95 WeakPolarHBondContact O-CB 3.37Å; T91-L95 WeakPolarHBondContact O-CG 3.35Å; T91-L95 PolarHBondContact O-N 3.45Å; L95-L98 WeakPolarHBondContact O-CB 3.44Å; L95-L98 PolarHBondContact O-N 3.27Å; L95-A99 PolarHBondContact O-N 2.95Å; L95-I130 HydrophobicContact CB-CG1 4.17Å; L95-I130 HydrophobicContact CB-CG2 3.71Å; L95-I130 HydrophobicContact CD1-CG2 4.36Å; L95-L133 HydrophobicContact CD1-CD2 3.94Å; L95-L133 HydrophobicContact CD1-CG 4.44Å; L95-P191 HydrophobicContact CD2-CG 4.28Å
96T96.4Very high93.5Very high0 Ų019.1 Ų19.10%010%0.097CC..Hα-helixtrans-68.7-39.2174-57.10000111.5F43 L47 C92 S93 I94 L98 A99 I100F43-T96 HydrophobicContact CB-CG2 4.19Å; F43-T96 WeakPolarHBondContact O-CG2 3.36Å; L47-T96 HydrophobicContact CB-CG2 3.76Å; C92-T96 VanDerWaalsContact O-CB 3.23Å; C92-T96 WeakPolarHBondContact O-CB 3.25Å; C92-T96 PolarHBondContact O-N 2.96Å; C92-T96 PolarHBondContact O-OG1 3.33Å; S93-T96 PolarHBondContact O-N 2.81Å; I94-T96 VanDerWaalsContact C-N 3.29Å; I94-T96 PolarHBondContact O-N 3.19Å; T96-L98 VanDerWaalsContact C-N 3.35Å; T96-A99 PolarHBondContact O-N 2.85Å; T96-I100 HydrophobicContact CG2-CD1 4.37Å; T96-I100 VanDerWaalsContact O-CG1 3.31Å; T96-I100 WeakPolarHBondContact O-CG1 3.47Å; T96-I100 PolarHBondContact O-N 2.87Å
97L92.3Very high92.9Very high8 Ų819.5 Ų19.54%0.04210%0.102CC..Hα-helixtrans-61.2-42.8172.6-77169.9000111.7L47 S93 I94 A99 I100 S101 M195 V241 F245L47-L97 HydrophobicContact CD1-CG 4.39Å; L47-L97 HydrophobicContact CD2-CD2 3.58Å; L47-L97 HydrophobicContact CD2-CG 3.93Å; S93-L97 WeakPolarHBondContact O-CG 3.18Å; S93-L97 PolarHBondContact O-N 3.22Å; I94-L97 WeakPolarHBondContact O-CB 3.35Å; I94-L97 PolarHBondContact O-N 3.31Å; L97-A99 VanDerWaalsContact C-N 3.35Å; L97-A99 PolarHBondContact O-N 2.85Å; L97-I100 WeakPolarHBondContact O-CB 3.47Å; L97-I100 PolarHBondContact O-N 3.5Å; L97-S101 PolarHBondContact O-N 2.91Å; L97-S101 PolarHBondContact O-OG 3.32Å; L97-M195 HydrophobicContact CB-SD 4.43Å; L97-V241 HydrophobicContact CD2-CG1 4.31Å; L97-F245 HydrophobicContact CD1-CD2 3.35Å; L97-F245 HydrophobicContact CD1-CE2 3.81Å; L97-F245 HydrophobicContact CD1-CG 4.16Å
98L94.5Very high92Very high32 Ų3221.2 Ų21.217%0.16811%0.11CC..Hα-helixtrans-57.7-47.3172.3173.464.6000111.2I94 L95 T96 I100 S101 V102 P191 V194 M195 M198I94-L98 PolarHBondContact O-N 3.18Å; L95-L98 WeakPolarHBondContact O-CB 3.44Å; L95-L98 PolarHBondContact O-N 3.27Å; T96-L98 VanDerWaalsContact C-N 3.35Å; L98-I100 VanDerWaalsContact C-N 3.31Å; L98-I100 PolarHBondContact O-N 2.81Å; L98-S101 WeakPolarHBondContact O-CB 3.31Å; L98-S101 PolarHBondContact O-N 3Å; L98-S101 VanDerWaalsContact O-N 3.1Å; L98-V102 HydrophobicContact CD1-CG2 4.34Å; L98-V102 WeakPolarHBondContact O-CG2 3.3Å; L98-V102 PolarHBondContact O-N 3.35Å; L98-P191 HydrophobicContact CD2-CB 4.06Å; L98-P191 HydrophobicContact CD2-CG 4.35Å; L98-V194 HydrophobicContact CD1-CB 4.01Å; L98-V194 HydrophobicContact CD1-CG1 3.74Å; L98-M195 HydrophobicContact CB-CG 4.34Å; L98-M195 HydrophobicContact CB-SD 4.4Å; L98-M195 HydrophobicContact CD1-CG 3.67Å; L98-M198 HydrophobicContact CD1-CE 3.8Å
99A94.3Very high91.1Very high16 Ų1621.8 Ų21.813%0.13212%0.116CC..Hα-helixtrans-61.7-37.9177.800000112.5F43 L95 T96 L97 V102 N103 I130F43-A99 HydrophobicContact CD1-CB 3.87Å; F43-A99 HydrophobicContact CE1-CB 3.74Å; F43-A99 HydrophobicContact CG-CB 4.39Å; F43-A99 HydrophobicContact CZ-CB 4.15Å; L95-A99 PolarHBondContact O-N 2.95Å; T96-A99 PolarHBondContact O-N 2.85Å; L97-A99 VanDerWaalsContact C-N 3.35Å; L97-A99 PolarHBondContact O-N 2.85Å; A99-V102 PolarHBondContact O-N 2.94Å; A99-N103 WeakPolarHBondContact O-CB 3.41Å; A99-N103 PolarHBondContact O-N 3.24Å; A99-I130 HydrophobicContact CB-CD1 3.95Å
100I91.6Very high90.1Very high22 Ų2223.8 Ų23.811%0.11313%0.13CC..Hα-helixtrans-60.3-48172.1-68.8166.9000109.7F43 V44 L47 T96 L97 L98 N103 R104F43-I100 HydrophobicContact CB-CD1 4.29Å; F43-I100 HydrophobicContact CB-CG1 3.59Å; V44-I100 HydrophobicContact CG2-CD1 4.26Å; L47-I100 HydrophobicContact CD2-CD1 3.83Å; T96-I100 HydrophobicContact CG2-CD1 4.37Å; T96-I100 VanDerWaalsContact O-CG1 3.31Å; T96-I100 WeakPolarHBondContact O-CG1 3.47Å; T96-I100 PolarHBondContact O-N 2.87Å; L97-I100 WeakPolarHBondContact O-CB 3.47Å; L97-I100 PolarHBondContact O-N 3.5Å; L98-I100 VanDerWaalsContact C-N 3.31Å; L98-I100 PolarHBondContact O-N 2.81Å; I100-N103 PolarHBondContact O-N 3.09Å; I100-R104 HydrophobicContact CG2-CG 4.43Å; I100-R104 VanDerWaalsContact O-CG 3.27Å; I100-R104 WeakPolarHBondContact O-CG 2.95Å; I100-R104 PolarHBondContact O-N 3.04Å
101S89.6Confident89.1Confident5 Ų527.8 Ų27.84%0.03516%0.156CC..Hα-helixtrans-61.4-43.7177.9-69.40000112.8L97 L98 N103 R104 Y105 Y199L97-S101 PolarHBondContact O-N 2.91Å; L97-S101 PolarHBondContact O-OG 3.32Å; L98-S101 WeakPolarHBondContact O-CB 3.31Å; L98-S101 PolarHBondContact O-N 3Å; L98-S101 VanDerWaalsContact O-N 3.1Å; S101-N103 PolarHBondContact O-N 3.41Å; S101-R104 PolarHBondContact O-N 3.35Å; S101-Y105 PolarHBondContact O-N 3.39Å; S101-Y199 VanDerWaalsContact OG-CE2 3.27Å; S101-Y199 WeakPolarHBondContact OG-CE2 3.02Å; S101-Y199 PolarHBondContact OG-OH 2.85Å; S101-Y199 VanDerWaalsContact OG-OH 3.07Å
102V90.6Very high88Confident54 Ų5435.2 Ų35.233%0.32720%0.195SC..Hα-helixtrans-58.8-49.4174.3172.80000110.6L98 A99 R104 Y105 L106 M198L98-V102 HydrophobicContact CD1-CG2 4.34Å; L98-V102 WeakPolarHBondContact O-CG2 3.3Å; L98-V102 PolarHBondContact O-N 3.35Å; A99-V102 PolarHBondContact O-N 2.94Å; V102-R104 VanDerWaalsContact C-N 3.27Å; V102-R104 PolarHBondContact O-N 3.47Å; V102-Y105 WeakPolarHBondContact O-CB 3.49Å; V102-Y105 PolarHBondContact O-N 3.37Å; V102-L106 HydrophobicContact CG1-CD1 4.04Å; V102-L106 HydrophobicContact CG1-CG 4.41Å; V102-L106 WeakPolarHBondContact O-CG 3.37Å; V102-L106 PolarHBondContact O-N 3.13Å; V102-M198 VanDerWaalsContact CA-SD 3.6Å; V102-M198 HydrophobicContact CB-CE 4.49Å; V102-M198 HydrophobicContact CB-SD 4.11Å; V102-M198 HydrophobicContact CG2-CE 3.72Å; V102-M198 HydrophobicContact CG2-SD 3.54Å; V102-M198 VanDerWaalsContact CG2-SD 3.54Å
103N89.4Confident87.1Confident6 Ų637.1 Ų37.13%0.03221%0.208CC..Hα-helixtrans-60.7-38.1178.7164.280.2000111.8A40 A99 I100 S101 A107 H114A40-N103 WeakPolarHBondContact CB-ND2 3.37Å; A99-N103 WeakPolarHBondContact O-CB 3.41Å; A99-N103 PolarHBondContact O-N 3.24Å; I100-N103 PolarHBondContact O-N 3.09Å; S101-N103 PolarHBondContact O-N 3.41Å; N103-A107 WeakPolarHBondContact O-CB 3.26Å; N103-A107 PolarHBondContact O-N 3.16Å; N103-H114 PolarHBondContact OD1-NE2 3.49Å
104R86.3Confident86.3Confident65 Ų6539 Ų3925%0.24522%0.216CC..Hα-helixtrans-68.1-42.8176.9-68.8-64.8133.4-154.8-1.4112I100 S101 V102 A107 I108 L238I100-R104 HydrophobicContact CG2-CG 4.43Å; I100-R104 VanDerWaalsContact O-CG 3.27Å; I100-R104 WeakPolarHBondContact O-CG 2.95Å; I100-R104 PolarHBondContact O-N 3.04Å; S101-R104 PolarHBondContact O-N 3.35Å; V102-R104 VanDerWaalsContact C-N 3.27Å; V102-R104 PolarHBondContact O-N 3.47Å; R104-A107 PolarHBondContact O-N 3.2Å; R104-I108 WeakPolarHBondContact O-CG1 3.49Å; R104-I108 PolarHBondContact O-N 3.47Å; R104-L238 HydrophobicContact CB-CD1 3.84Å; R104-L238 HydrophobicContact CG-CD1 3.86Å; R104-L238 HydrophobicContact CG-CD2 3.83Å
105Y85.3Confident85.3Confident77 Ų7743.7 Ų43.730%0.30225%0.249SC..Hα-helixtrans-55.5-53.9173.6169.9-105.1000110.4S101 V102 A107 I108 S109 M198 C201 I202S101-Y105 PolarHBondContact O-N 3.39Å; V102-Y105 WeakPolarHBondContact O-CB 3.49Å; V102-Y105 PolarHBondContact O-N 3.37Å; Y105-A107 VanDerWaalsContact C-N 3.27Å; Y105-A107 PolarHBondContact O-N 2.95Å; Y105-I108 PolarHBondContact O-N 3.02Å; Y105-I108 VanDerWaalsContact O-N 3.09Å; Y105-S109 WeakPolarHBondContact O-CB 3.41Å; Y105-S109 PolarHBondContact O-N 3.16Å; Y105-S109 PolarHBondContact O-OG 3.36Å; Y105-M198 HydrophobicContact CG-CB 4.43Å; Y105-M198 HydrophobicContact CG-CG 4.34Å; Y105-C201 HydrophobicContact CD2-CB 4.26Å; Y105-C201 HydrophobicContact CE2-CB 3.73Å; Y105-I202 HydrophobicContact CD2-CG1 3.96Å
106L85.9Confident84.3Confident33 Ų3349.6 Ų49.617%0.17328%0.276CS..Hα-helixtrans-57.8-37.6179.5-68.4174.1000113V102 I108 S110V102-L106 HydrophobicContact CG1-CD1 4.04Å; V102-L106 HydrophobicContact CG1-CG 4.41Å; V102-L106 WeakPolarHBondContact O-CG 3.37Å; V102-L106 PolarHBondContact O-N 3.13Å; L106-I108 VanDerWaalsContact C-N 3.32Å; L106-I108 PolarHBondContact O-N 3.27Å; L106-S110 CarbonylContact O-C 3.57Å; L106-S110 PolarHBondContact O-N 3.04Å
107A84.1Confident83.6Confident27 Ų2755.5 Ų55.522%0.22330%0.299CS..Hα-helixtrans-66.7-33.2179.500000113N103 R104 Y105 H114N103-A107 WeakPolarHBondContact O-CB 3.26Å; N103-A107 PolarHBondContact O-N 3.16Å; R104-A107 PolarHBondContact O-N 3.2Å; Y105-A107 VanDerWaalsContact C-N 3.27Å; Y105-A107 PolarHBondContact O-N 2.95Å; A107-H114 WeakPolarHBondContact CA-CD2 3.2Å; A107-H114 PolarHBondContact N-CD2 3.02Å; A107-H114 VanDerWaalsContact N-CD2 3.25Å
108I78.6Confident83.3Confident55 Ų5556.2 Ų56.228%0.28230%0.303SS..Hα-helixtrans-92-40.8-176.7-63.3169000110.9R104 Y105 L106 I202 L238R104-I108 WeakPolarHBondContact O-CG1 3.49Å; R104-I108 PolarHBondContact O-N 3.47Å; Y105-I108 PolarHBondContact O-N 3.02Å; Y105-I108 VanDerWaalsContact O-N 3.09Å; L106-I108 VanDerWaalsContact C-N 3.32Å; L106-I108 PolarHBondContact O-N 3.27Å; I108-I202 HydrophobicContact CD1-CD1 4.47Å; I108-I202 HydrophobicContact CD1-CG1 4.41Å; I108-I202 HydrophobicContact CD1-CG2 3.63Å; I108-I202 HydrophobicContact CG2-CG2 4.33Å; I108-L238 HydrophobicContact CD1-CD1 4.46Å
109S77.8Confident83Confident28 Ų2856.9 Ų56.920%0.19631%0.309CS..Hα-helixtrans-79.7-26.6-175.366.20000113.8Y105Y105-S109 WeakPolarHBondContact O-CB 3.41Å; Y105-S109 PolarHBondContact O-N 3.16Å; Y105-S109 PolarHBondContact O-OG 3.36Å
110S77.7Confident82.6Confident41 Ų4159.2 Ų59.229%0.28732%0.323SS..  trans-148.468.9-176.3-60.40000111.5L106 L112 S113 H114L106-S110 CarbonylContact O-C 3.57Å; L106-S110 PolarHBondContact O-N 3.04Å; S110-L112 VanDerWaalsContact C-N 3.32Å; S110-L112 PolarHBondContact O-N 2.77Å; S110-S113 PolarHBondContact O-N 2.98Å; S110-H114 WeakPolarHBondContact O-CB 3.45Å; S110-H114 PolarHBondContact O-N 3.13Å
111P75.3Confident82.5Confident91 Ų9164.9 Ų64.959%0.59134%0.343SS*.Hα-helixtrans-59.8-36.4-171.822.1-33.3000113.9H114P111-H114 PolarHBondContact O-N 2.83Å
112L73Confident82.6Confident157 Ų15771.7 Ų71.782%0.82237%0.367SS*.Hα-helixtrans-69.7-41.6179.1-65173.1000112.2S110S110-L112 VanDerWaalsContact C-N 3.32Å; S110-L112 PolarHBondContact O-N 2.77Å
113S78Confident82.6Confident39 Ų3969.4 Ų69.427%0.27335%0.354SS..Hα-helixtrans-79.5-19.4176.4-52.30000113S110 S115 Q116 R117S110-S113 PolarHBondContact O-N 2.98Å; S113-S115 PolarHBondContact O-N 3.19Å; S113-Q116 PolarHBondContact O-N 2.92Å; S113-R117 WeakPolarHBondContact O-CB 3.26Å; S113-R117 VanDerWaalsContact O-CG 3.28Å; S113-R117 WeakPolarHBondContact O-CG 3.17Å; S113-R117 PolarHBondContact O-N 2.83Å
114H81.1Confident82.7Confident40 Ų4071.3 Ų71.319%0.18536%0.364CS..Hα-helixtrans-58.4-47.2-179.5178.5-94.4000111.9N103 A107 S110 P111 Q116 R117 V118N103-H114 PolarHBondContact OD1-NE2 3.49Å; A107-H114 WeakPolarHBondContact CA-CD2 3.2Å; A107-H114 PolarHBondContact N-CD2 3.02Å; A107-H114 VanDerWaalsContact N-CD2 3.25Å; S110-H114 WeakPolarHBondContact O-CB 3.45Å; S110-H114 PolarHBondContact O-N 3.13Å; P111-H114 PolarHBondContact O-N 2.83Å; H114-Q116 PolarHBondContact O-N 3.37Å; H114-R117 PolarHBondContact O-N 2.94Å; H114-R117 VanDerWaalsContact O-N 3.1Å; H114-V118 WeakPolarHBondContact NE2-CG2 3.36Å; H114-V118 PolarHBondContact O-N 3.34Å
115S73Confident83.1Confident99 Ų9974 Ų7469%0.69238%0.382SS*.Hα-helixtrans-59.6-35178.2-171.40000112.4S113S113-S115 PolarHBondContact O-N 3.19Å
116Q76.4Confident83.6Confident146 Ų14672 Ų7268%0.68238%0.382SS*.Hα-helixtrans-78.7-31.4177-64.1175.6-22.200112.8S113 H114S113-Q116 PolarHBondContact O-N 2.92Å; H114-Q116 PolarHBondContact O-N 3.37Å
117R81.3Confident84.2Confident124 Ų12471.5 Ų71.547%0.46838%0.379SS..Hα-helixtrans-82.9-38.2-176.3-72.9179.1-173.8-170.14.4113.1S113 H114 T119 R122S113-R117 WeakPolarHBondContact O-CB 3.26Å; S113-R117 VanDerWaalsContact O-CG 3.28Å; S113-R117 WeakPolarHBondContact O-CG 3.17Å; S113-R117 PolarHBondContact O-N 2.83Å; H114-R117 PolarHBondContact O-N 2.94Å; H114-R117 VanDerWaalsContact O-N 3.1Å; R117-T119 PolarHBondContact O-N 3.43Å; R117-R122 WeakPolarHBondContact O-CD 3.46Å; R117-R122 PolarHBondContact O-NH1 3.31Å
118V85Confident84.8Confident24 Ų2472.6 Ų72.615%0.14539%0.385CS..  trans-94.579.2-174.5-174.90000110.8H114 V123H114-V118 WeakPolarHBondContact NE2-CG2 3.36Å; H114-V118 PolarHBondContact O-N 3.34Å; V118-V123 HydrophobicContact CG1-CG2 3.87Å
119T88.3Confident85.7Confident45 Ų4576.2 Ų76.228%0.27640%0.399SS..  trans-98.1153.3177.869.20000111.7R117 R121 R122 V123R117-T119 PolarHBondContact O-N 3.43Å; T119-R121 VanDerWaalsContact C-N 3.26Å; T119-R121 PolarHBondContact O-N 3.28Å; T119-R122 PolarHBondContact O-N 3.2Å; T119-R122 WeakPolarHBondContact OG1-CG 3.49Å; T119-R122 PolarHBondContact OG1-N 2.95Å; T119-V123 WeakPolarHBondContact O-CG2 3.24Å; T119-V123 PolarHBondContact O-N 3.12Å
120P87Confident86.7Confident66 Ų6675.5 Ų75.543%0.42939%0.393SS..Hα-helixtrans-55.8-39.3178.7-26.734.6000113.6T39 V123 L124T39-P120 HydrophobicContact CG2-CB 4.26Å; T39-P120 HydrophobicContact CG2-CG 4.05Å; P120-V123 PolarHBondContact O-N 3.02Å; P120-L124 WeakPolarHBondContact O-CB 3.42Å; P120-L124 PolarHBondContact O-N 3.4Å
121R88.5Confident87.7Confident140 Ų14076.4 Ų76.453%0.52839%0.39SS..Hα-helixtrans-61.8-48177.9-65.3-171.3175.4165.2-1.4111.7T119 L124 L125 S335T119-R121 VanDerWaalsContact C-N 3.26Å; T119-R121 PolarHBondContact O-N 3.28Å; R121-L124 PolarHBondContact O-N 2.8Å; R121-L125 VanDerWaalsContact O-CG 3.3Å; R121-L125 WeakPolarHBondContact O-CG 3.43Å; R121-L125 PolarHBondContact O-N 2.97Å; R121-S335 WeakPolarHBondContact CG-OG 3.33Å; R121-S335 PolarHBondContact NE-OG 2.92Å
122R91.3Very high88.8Confident148 Ų14877.6 Ų77.656%0.55839%0.391SS*.Hα-helixtrans-66-39.8179.8-72.7179.1177.2176.4-0.9111.9R117 T119 L125 A126R117-R122 WeakPolarHBondContact O-CD 3.46Å; R117-R122 PolarHBondContact O-NH1 3.31Å; T119-R122 PolarHBondContact O-N 3.2Å; T119-R122 WeakPolarHBondContact OG1-CG 3.49Å; T119-R122 PolarHBondContact OG1-N 2.95Å; R122-L125 PolarHBondContact O-N 3.43Å; R122-A126 VanDerWaalsContact O-CB 3.32Å; R122-A126 WeakPolarHBondContact O-CB 3.22Å; R122-A126 PolarHBondContact O-N 3.43Å
123V91.8Very high90Very high6 Ų673.2 Ų73.24%0.03637%0.368CS..Hα-helixtrans-64.6-43.2176.1172.10000111.3T39 C42 F43 V118 T119 P120 A126 I127T39-V123 HydrophobicContact CG2-CB 4.17Å; T39-V123 HydrophobicContact CG2-CG2 3.86Å; C42-V123 HydrophobicContact CB-CG1 3.76Å; F43-V123 HydrophobicContact CD2-CG1 4.4Å; F43-V123 HydrophobicContact CE1-CG1 4.31Å; F43-V123 HydrophobicContact CE2-CG1 3.99Å; F43-V123 HydrophobicContact CE2-CG2 3.97Å; F43-V123 HydrophobicContact CZ-CB 4.37Å; F43-V123 HydrophobicContact CZ-CG1 3.95Å; F43-V123 HydrophobicContact CZ-CG2 4.18Å; V118-V123 HydrophobicContact CG1-CG2 3.87Å; T119-V123 WeakPolarHBondContact O-CG2 3.24Å; T119-V123 PolarHBondContact O-N 3.12Å; P120-V123 PolarHBondContact O-N 3.02Å; V123-A126 PolarHBondContact O-N 3.33Å; V123-I127 HydrophobicContact CG1-CD1 3.86Å; V123-I127 HydrophobicContact CG1-CG1 4.48Å; V123-I127 WeakPolarHBondContact O-CG1 3.29Å; V123-I127 PolarHBondContact O-N 2.89Å
124L91.4Very high90.9Very high47 Ų4771.3 Ų71.325%0.24636%0.355CS..Hα-helixtrans-62.3-44.7175.5177.355.1000112.2P120 R121 A126 I127 S128 F332P120-L124 WeakPolarHBondContact O-CB 3.42Å; P120-L124 PolarHBondContact O-N 3.4Å; R121-L124 PolarHBondContact O-N 2.8Å; L124-A126 VanDerWaalsContact C-N 3.34Å; L124-I127 PolarHBondContact O-N 2.95Å; L124-S128 WeakPolarHBondContact O-CB 3.47Å; L124-S128 PolarHBondContact O-N 3.28Å; L124-S128 PolarHBondContact O-OG 3.28Å; L124-F332 HydrophobicContact CD1-CD1 3.64Å; L124-F332 HydrophobicContact CD1-CE1 3.46Å; L124-F332 VanDerWaalsContact CD1-CE1 3.46Å; L124-F332 HydrophobicContact CD2-CD1 3.75Å; L124-F332 HydrophobicContact CD2-CE1 4.25Å; L124-F332 HydrophobicContact CD2-CG 4.34Å; L124-F332 HydrophobicContact CG-CD1 4.24Å; L124-F332 HydrophobicContact CG-CE1 4.28Å
125L94.6Very high91.7Very high120 Ų12073 Ų7363%0.62837%0.365SS*.Hα-helixtrans-61.9-43.3175.8-71173.3000111.4R121 R122 S128 F129R121-L125 VanDerWaalsContact O-CG 3.3Å; R121-L125 WeakPolarHBondContact O-CG 3.43Å; R121-L125 PolarHBondContact O-N 2.97Å; R122-L125 PolarHBondContact O-N 3.43Å; L125-S128 PolarHBondContact O-N 3.18Å; L125-F129 VanDerWaalsContact O-CB 3.31Å; L125-F129 WeakPolarHBondContact O-CB 3.4Å; L125-F129 PolarHBondContact O-N 3.36Å
126A96.1Very high92.8Very high36 Ų3669.7 Ų69.730%0.29834%0.344SS..Hα-helixtrans-62.5-46.1177.300000112F43 R122 V123 L124 F129 I130F43-A126 HydrophobicContact CE1-CB 4.09Å; F43-A126 HydrophobicContact CZ-CB 4.08Å; R122-A126 VanDerWaalsContact O-CB 3.32Å; R122-A126 WeakPolarHBondContact O-CB 3.22Å; R122-A126 PolarHBondContact O-N 3.43Å; V123-A126 PolarHBondContact O-N 3.33Å; L124-A126 VanDerWaalsContact C-N 3.34Å; A126-F129 PolarHBondContact O-N 2.94Å; A126-I130 VanDerWaalsContact O-CG1 3.25Å; A126-I130 WeakPolarHBondContact O-CG1 3.36Å; A126-I130 PolarHBondContact O-N 2.88Å
127I97.4Very high93.7Very high22 Ų2264.7 Ų64.711%0.11332%0.323CS..Hα-helixtrans-60.1-50.3175.2-70169000109.8C42 F43 V123 L124 F129 I130 W131C42-I127 HydrophobicContact CB-CD1 3.9Å; F43-I127 HydrophobicContact CD1-CD1 4.2Å; F43-I127 HydrophobicContact CD1-CG1 3.74Å; F43-I127 HydrophobicContact CE1-CD1 4.43Å; F43-I127 HydrophobicContact CE1-CG1 3.74Å; V123-I127 HydrophobicContact CG1-CD1 3.86Å; V123-I127 HydrophobicContact CG1-CG1 4.48Å; V123-I127 WeakPolarHBondContact O-CG1 3.29Å; V123-I127 PolarHBondContact O-N 2.89Å; L124-I127 PolarHBondContact O-N 2.95Å; I127-F129 VanDerWaalsContact C-N 3.28Å; I127-F129 PolarHBondContact O-N 3.31Å; I127-I130 WeakPolarHBondContact O-CB 3.25Å; I127-I130 PolarHBondContact O-N 2.89Å; I127-I130 VanDerWaalsContact O-N 3.1Å; I127-W131 VanDerWaalsContact O-CD1 3.23Å; I127-W131 PolarHBondContact O-N 2.99Å
128S97.5Very high94.3Very high50 Ų5058.8 Ų58.835%0.3530%0.3SS..Hα-helixtrans-58.3-42.7-179.5-52.70000111.6L124 L125 W131 L132L124-S128 WeakPolarHBondContact O-CB 3.47Å; L124-S128 PolarHBondContact O-N 3.28Å; L124-S128 PolarHBondContact O-OG 3.28Å; L125-S128 PolarHBondContact O-N 3.18Å; S128-W131 PolarHBondContact O-N 3.43Å; S128-L132 WeakPolarHBondContact O-CB 3.42Å; S128-L132 VanDerWaalsContact O-CG 3.23Å; S128-L132 WeakPolarHBondContact O-CG 3.24Å; S128-L132 PolarHBondContact O-N 2.75Å
129F97.9Very high94.9Very high132 Ų13259.6 Ų59.658%0.57930%0.302SS*.Hα-helixtrans-61.6-45.2175.3175.9-101.2000112.1L125 A126 I127 W131 L132 L133L125-F129 VanDerWaalsContact O-CB 3.31Å; L125-F129 WeakPolarHBondContact O-CB 3.4Å; L125-F129 PolarHBondContact O-N 3.36Å; A126-F129 PolarHBondContact O-N 2.94Å; I127-F129 VanDerWaalsContact C-N 3.28Å; I127-F129 PolarHBondContact O-N 3.31Å; F129-W131 PolarHBondContact O-N 2.8Å; F129-L132 PolarHBondContact O-N 3.44Å; F129-L133 HydrophobicContact CE1-CD2 3.86Å; F129-L133 HydrophobicContact CZ-CD2 3.92Å; F129-L133 WeakPolarHBondContact O-CB 3.42Å; F129-L133 PolarHBondContact O-N 3.15Å
130I98.3Very high95.2Very high13 Ų1363 Ų637%0.06731%0.313CS..Hα-helixtrans-57.7-51.5177-71.3163.8000110.5L95 A99 A126 I127 L132 L133 S134L95-I130 HydrophobicContact CB-CG1 4.17Å; L95-I130 HydrophobicContact CB-CG2 3.71Å; L95-I130 HydrophobicContact CD1-CG2 4.36Å; A99-I130 HydrophobicContact CB-CD1 3.95Å; A126-I130 VanDerWaalsContact O-CG1 3.25Å; A126-I130 WeakPolarHBondContact O-CG1 3.36Å; A126-I130 PolarHBondContact O-N 2.88Å; I127-I130 WeakPolarHBondContact O-CB 3.25Å; I127-I130 PolarHBondContact O-N 2.89Å; I127-I130 VanDerWaalsContact O-N 3.1Å; I130-L132 PolarHBondContact O-N 3Å; I130-L133 PolarHBondContact O-N 2.83Å; I130-S134 WeakPolarHBondContact O-CB 3.28Å; I130-S134 PolarHBondContact O-N 2.94Å; I130-S134 PolarHBondContact O-OG 3.36Å
131W98.6Very high95.5Very high60 Ų6060 Ų6023%0.22729%0.294CS..Hα-helixtrans-60.8-45.6-179.9-80.589.3000112.6S46 V49 A50 L53 L89 C92 I127 S128 F129 S134 L135S46-W131 PolarHBondContact OG-NE1 3.2Å; V49-W131 HydrophobicContact CG1-CH2 4.15Å; V49-W131 HydrophobicContact CG1-CZ2 4.06Å; A50-W131 HydrophobicContact CB-CH2 4.14Å; A50-W131 HydrophobicContact CB-CZ2 4.16Å; L53-W131 HydrophobicContact CD1-CH2 3.8Å; L53-W131 HydrophobicContact CD1-CZ3 4.04Å; L89-W131 HydrophobicContact CD2-CH2 4.37Å; L89-W131 HydrophobicContact CD2-CZ3 4.22Å; C92-W131 VanDerWaalsContact SG-CE2 3.59Å; I127-W131 VanDerWaalsContact O-CD1 3.23Å; I127-W131 PolarHBondContact O-N 2.99Å; S128-W131 PolarHBondContact O-N 3.43Å; F129-W131 PolarHBondContact O-N 2.8Å; W131-S134 PolarHBondContact O-N 3.44Å; W131-L135 WeakPolarHBondContact O-CB 3.28Å; W131-L135 PolarHBondContact O-N 3.44Å
132L98.3Very high95.7Very high115 Ų11553.4 Ų53.460%0.60227%0.269SS*.Hα-helixtrans-67-40.8179.9-69.6172.8000112.1S128 F129 I130 L135 A136S128-L132 WeakPolarHBondContact O-CB 3.42Å; S128-L132 VanDerWaalsContact O-CG 3.23Å; S128-L132 WeakPolarHBondContact O-CG 3.24Å; S128-L132 PolarHBondContact O-N 2.75Å; F129-L132 PolarHBondContact O-N 3.44Å; I130-L132 PolarHBondContact O-N 3Å; L132-L135 PolarHBondContact O-N 3.1Å; L132-A136 WeakPolarHBondContact O-CB 3.17Å; L132-A136 PolarHBondContact O-N 3.25Å
133L97.4Very high95.9Very high65 Ų6549.9 Ų49.934%0.3426%0.259SS..Hα-helixtrans-64.3-45.2176.1-179.961.8000110.8L95 F129 I130 L135 A136 V137L95-L133 HydrophobicContact CD1-CD2 3.94Å; L95-L133 HydrophobicContact CD1-CG 4.44Å; F129-L133 HydrophobicContact CE1-CD2 3.86Å; F129-L133 HydrophobicContact CZ-CD2 3.92Å; F129-L133 WeakPolarHBondContact O-CB 3.42Å; F129-L133 PolarHBondContact O-N 3.15Å; I130-L133 PolarHBondContact O-N 2.83Å; L133-L135 VanDerWaalsContact C-N 3.34Å; L133-L135 PolarHBondContact O-N 3.26Å; L133-A136 PolarHBondContact O-N 2.87Å; L133-V137 HydrophobicContact CD1-CG2 3.94Å; L133-V137 HydrophobicContact CG-CG2 4.35Å; L133-V137 WeakPolarHBondContact O-CB 3.23Å; L133-V137 VanDerWaalsContact O-CG2 3.27Å; L133-V137 WeakPolarHBondContact O-CG2 3.4Å; L133-V137 PolarHBondContact O-N 3.23Å
134S98.1Very high96Very high0 Ų053.9 Ų53.90%028%0.28CS..Hα-helixtrans-62.2-40.7176.6-60.80000112.4M88 T91 C92 I130 W131 A138M88-S134 WeakPolarHBondContact O-CB 3.23Å; T91-S134 WeakPolarHBondContact CG2-OG 3.45Å; C92-S134 VanDerWaalsContact CA-OG 3.23Å; C92-S134 WeakPolarHBondContact CA-OG 3.25Å; C92-S134 PolarHBondContact N-OG 3.29Å; C92-S134 VanDerWaalsContact N-OG 3.14Å; I130-S134 WeakPolarHBondContact O-CB 3.28Å; I130-S134 PolarHBondContact O-N 2.94Å; I130-S134 PolarHBondContact O-OG 3.36Å; W131-S134 PolarHBondContact O-N 3.44Å; S134-A138 VanDerWaalsContact O-CB 3.24Å; S134-A138 WeakPolarHBondContact O-CB 3.38Å; S134-A138 PolarHBondContact O-N 3.44Å; S134-A138 VanDerWaalsContact O-N 3.09Å
135L97.7Very high96.1Very high75 Ų7551.7 Ų51.739%0.39327%0.268SS..Hα-helixtrans-60.6-50.2174.6-17975.9000110.8M88 W131 L132 L133 A138 F139M88-L135 HydrophobicContact SD-CB 4.08Å; M88-L135 HydrophobicContact SD-CD1 3.49Å; M88-L135 WeakPolarHBondContact SD-CD1 3.48Å; M88-L135 HydrophobicContact SD-CG 4.42Å; W131-L135 WeakPolarHBondContact O-CB 3.28Å; W131-L135 PolarHBondContact O-N 3.44Å; L132-L135 PolarHBondContact O-N 3.1Å; L133-L135 VanDerWaalsContact C-N 3.34Å; L133-L135 PolarHBondContact O-N 3.26Å; L135-A138 PolarHBondContact O-N 3.37Å; L135-F139 HydrophobicContact CD1-CD2 3.49Å; L135-F139 VanDerWaalsContact CD1-CD2 3.49Å; L135-F139 HydrophobicContact CD1-CE2 3.64Å; L135-F139 HydrophobicContact CD1-CG 4.21Å; L135-F139 HydrophobicContact CD1-CZ 4.46Å; L135-F139 HydrophobicContact CG-CD2 4.27Å; L135-F139 WeakPolarHBondContact O-CB 3.49Å; L135-F139 PolarHBondContact O-N 3.46Å
136A96.4Very high95.9Very high30 Ų3052.1 Ų52.125%0.24826%0.262CS..Hα-helixtrans-62.9-46.7-17800000112.1L132 L133 A138 F140L132-A136 WeakPolarHBondContact O-CB 3.17Å; L132-A136 PolarHBondContact O-N 3.25Å; L133-A136 PolarHBondContact O-N 2.87Å; A136-A138 PolarHBondContact O-N 3.15Å; A136-F140 HydrophobicContact CB-CD2 4.29Å; A136-F140 HydrophobicContact CB-CE2 4.18Å; A136-F140 VanDerWaalsContact O-CB 3.31Å; A136-F140 WeakPolarHBondContact O-CB 3.46Å; A136-F140 WeakPolarHBondContact O-CG 3.27Å; A136-F140 PolarHBondContact O-N 3.29Å; A136-F140 VanDerWaalsContact O-N 3.14Å
137V94.2Very high95.7Very high40 Ų4050.4 Ų50.424%0.24225%0.247CC..Hα-helixtrans-66-25.9179.8173.10000112L133 P141 Y179 Y183 T187L133-V137 HydrophobicContact CD1-CG2 3.94Å; L133-V137 HydrophobicContact CG-CG2 4.35Å; L133-V137 WeakPolarHBondContact O-CB 3.23Å; L133-V137 VanDerWaalsContact O-CG2 3.27Å; L133-V137 WeakPolarHBondContact O-CG2 3.4Å; L133-V137 PolarHBondContact O-N 3.23Å; V137-P141 WeakPolarHBondContact O-CD 3.16Å; V137-P141 WeakPolarHBondContact O-CG 3.48Å; V137-Y179 PolarHBondContact O-OH 3.28Å; V137-Y179 VanDerWaalsContact O-OH 3.1Å; V137-Y183 HydrophobicContact CG1-CD2 3.5Å; V137-Y183 VanDerWaalsContact CG1-CD2 3.5Å; V137-Y183 HydrophobicContact CG1-CE2 3.62Å; V137-T187 HydrophobicContact CG1-CG2 4.12Å
138A95.1Very high95.4Very high0 Ų049.4 Ų49.40%024%0.242CC..Hα-helixtrans-90.3-47.7179.300000113.5S84 V87 M88 S134 L135 A136S84-A138 VanDerWaalsContact O-CB 3.28Å; S84-A138 WeakPolarHBondContact O-CB 3.48Å; V87-A138 HydrophobicContact CB-CB 3.89Å; V87-A138 HydrophobicContact CG1-CB 3.67Å; M88-A138 HydrophobicContact CB-CB 3.61Å; S134-A138 VanDerWaalsContact O-CB 3.24Å; S134-A138 WeakPolarHBondContact O-CB 3.38Å; S134-A138 PolarHBondContact O-N 3.44Å; S134-A138 VanDerWaalsContact O-N 3.09Å; L135-A138 PolarHBondContact O-N 3.37Å; A136-A138 PolarHBondContact O-N 3.15Å
139F96.1Very high94.9Very high41 Ų4150.8 Ų50.818%0.1826%0.256CS..Hα-helixtrans-80.7-41.4-172.7-83.4-101.2000112.8M85 M88 L135 V142 H143M85-F139 HydrophobicContact CE-CE2 4.36Å; M85-F139 HydrophobicContact CE-CZ 3.68Å; M85-F139 HydrophobicContact CG-CZ 4.37Å; M85-F139 HydrophobicContact SD-CE2 4.22Å; M85-F139 HydrophobicContact SD-CZ 4.01Å; M88-F139 HydrophobicContact CB-CE2 4.49Å; M88-F139 HydrophobicContact SD-CE2 4Å; L135-F139 HydrophobicContact CD1-CD2 3.49Å; L135-F139 VanDerWaalsContact CD1-CD2 3.49Å; L135-F139 HydrophobicContact CD1-CE2 3.64Å; L135-F139 HydrophobicContact CD1-CG 4.21Å; L135-F139 HydrophobicContact CD1-CZ 4.46Å; L135-F139 HydrophobicContact CG-CD2 4.27Å; L135-F139 WeakPolarHBondContact O-CB 3.49Å; L135-F139 PolarHBondContact O-N 3.46Å; F139-V142 PolarHBondContact O-N 3.3Å; F139-H143 AromaticContact CD1-CD2 3.65Å; F139-H143 AromaticContact CD1-NE2 3.63Å; F139-H143 AromaticContact CE1-NE2 3.93Å; F139-H143 VanDerWaalsContact O-CB 3.29Å; F139-H143 WeakPolarHBondContact O-CB 3.4Å; F139-H143 PolarHBondContact O-CD2 2.85Å; F139-H143 VanDerWaalsContact O-CD2 3.3Å; F139-H143 PolarHBondContact O-N 2.88Å
140F94.9Very high94.5Very high116 Ų11649 Ų4951%0.50925%0.253SS..Hα-helixtrans-62-45.2-176.4-66.9-6.9000112.2A136 V142 L144 W146A136-F140 HydrophobicContact CB-CD2 4.29Å; A136-F140 HydrophobicContact CB-CE2 4.18Å; A136-F140 VanDerWaalsContact O-CB 3.31Å; A136-F140 WeakPolarHBondContact O-CB 3.46Å; A136-F140 WeakPolarHBondContact O-CG 3.27Å; A136-F140 PolarHBondContact O-N 3.29Å; A136-F140 VanDerWaalsContact O-N 3.14Å; F140-V142 PolarHBondContact O-N 3.47Å; F140-L144 HydrophobicContact CB-CD1 4.18Å; F140-L144 WeakPolarHBondContact O-CB 3.27Å; F140-L144 WeakPolarHBondContact O-CG 3.27Å; F140-L144 PolarHBondContact O-N 3.42Å; F140-W146 HydrophobicContact CB-CZ3 4.48Å
141P93.4Very high94.1Very high5 Ų555 Ų553%0.03228%0.276CS..Hα-helixtrans-64.5-40.1-178.2-26.940.1000113.5V137 G145 W146 N147 Y179V137-P141 WeakPolarHBondContact O-CD 3.16Å; V137-P141 WeakPolarHBondContact O-CG 3.48Å; P141-G145 CarbonylContact O-C 3.59Å; P141-G145 WeakPolarHBondContact O-CA 3.34Å; P141-G145 PolarHBondContact O-N 2.92Å; P141-G145 VanDerWaalsContact O-N 3.13Å; P141-W146 HydrophobicContact CB-CB 4.28Å; P141-W146 PolarHBondContact O-N 3.14Å; P141-N147 HydrophobicContact CB-CB 4.26Å; P141-N147 PolarHBondContact O-N 3.09Å; P141-N147 PolarHBondContact O-OD1 3.38Å; P141-N147 VanDerWaalsContact O-OD1 3.08Å; P141-Y179 HydrophobicContact CB-CD2 4Å; P141-Y179 HydrophobicContact CB-CE1 4.33Å; P141-Y179 HydrophobicContact CB-CE2 3.39Å; P141-Y179 HydrophobicContact CG-CD2 4.14Å; P141-Y179 HydrophobicContact CG-CE2 3.22Å; P141-Y179 WeakPolarHBondContact CG-OH 3.21Å
142V94.1Very high93.8Very high1 Ų160.7 Ų60.71%0.00630%0.297CS..Hα-helixtrans-73.5-45.3-179.6178.50000111.6N80 I83 S84 F139 F140 N147 Q154 F173N80-V142 HydrophobicContact CB-CG1 3.82Å; I83-V142 HydrophobicContact CG2-CG2 4.06Å; S84-V142 WeakPolarHBondContact OG-CB 3.27Å; F139-V142 PolarHBondContact O-N 3.3Å; F140-V142 PolarHBondContact O-N 3.47Å; V142-N147 WeakPolarHBondContact CA-OD1 3.31Å; V142-Q154 HydrophobicContact CG1-CG 4.5Å; V142-F173 HydrophobicContact CG2-CE2 4.1Å
143H94.8Very high93.5Very high73 Ų7357.5 Ų57.534%0.33828%0.282SS..Hα-helixtrans-85.9-12.2-173.7-70.2-90.3000114.2S84 F139 V153S84-H143 PolarHBondContact OG-NE2 3.41Å; F139-H143 AromaticContact CD1-CD2 3.65Å; F139-H143 AromaticContact CD1-NE2 3.63Å; F139-H143 AromaticContact CE1-NE2 3.93Å; F139-H143 VanDerWaalsContact O-CB 3.29Å; F139-H143 WeakPolarHBondContact O-CB 3.4Å; F139-H143 PolarHBondContact O-CD2 2.85Å; F139-H143 VanDerWaalsContact O-CD2 3.3Å; F139-H143 PolarHBondContact O-N 2.88Å; H143-V153 VanDerWaalsContact O-CG2 3.29Å; H143-V153 WeakPolarHBondContact O-CG2 3.32Å
144L94.4Very high93.2Very high91 Ų9154.7 Ų54.748%0.47627%0.267SS..THydrogen-bonded Turntrans-108.12.3170.6-55177.3000112.8F140 W146F140-L144 HydrophobicContact CB-CD1 4.18Å; F140-L144 WeakPolarHBondContact O-CB 3.27Å; F140-L144 WeakPolarHBondContact O-CG 3.27Å; F140-L144 PolarHBondContact O-N 3.42Å; L144-W146 VanDerWaalsContact C-N 3.33Å; L144-W146 HydrophobicContact CB-CG 4.47Å; L144-W146 HydrophobicContact CD1-CH2 4.36Å; L144-W146 HydrophobicContact CD1-CZ2 3.77Å; L144-W146 PolarHBondContact O-N 3.28Å
145G92.3Very high92.8Very high0 Ų055.4 Ų55.40%027%0.271CS..THydrogen-bonded Turntrans77.25.8177.300000115.6P141 N147 T148 Y151 R152P141-G145 CarbonylContact O-C 3.59Å; P141-G145 WeakPolarHBondContact O-CA 3.34Å; P141-G145 PolarHBondContact O-N 2.92Å; P141-G145 VanDerWaalsContact O-N 3.13Å; G145-N147 PolarHBondContact O-N 3.45Å; G145-N147 VanDerWaalsContact O-N 3.11Å; G145-T148 PolarHBondContact O-N 3.29Å; G145-T148 PolarHBondContact O-OG1 3.37Å; G145-T148 VanDerWaalsContact O-OG1 3.1Å; G145-Y151 CarbonylContact O-C 3.53Å; G145-Y151 VanDerWaalsContact O-CA 3.29Å; G145-Y151 WeakPolarHBondContact O-CA 3.25Å; G145-R152 VanDerWaalsContact CA-O 3.28Å; G145-R152 WeakPolarHBondContact CA-O 3.22Å
146W92Very high92.3Very high130 Ų13058.6 Ų58.649%0.49229%0.288SS..THydrogen-bonded Turntrans-65.2-17-178.8-53.3-11.1000113.7F140 P141 L144F140-W146 HydrophobicContact CB-CZ3 4.48Å; P141-W146 HydrophobicContact CB-CB 4.28Å; P141-W146 PolarHBondContact O-N 3.14Å; L144-W146 VanDerWaalsContact C-N 3.33Å; L144-W146 HydrophobicContact CB-CG 4.47Å; L144-W146 HydrophobicContact CD1-CH2 4.36Å; L144-W146 HydrophobicContact CD1-CZ2 3.77Å; L144-W146 PolarHBondContact O-N 3.28Å
147N91.1Very high91.7Very high0 Ų062.8 Ų62.80%031%0.306CS..THydrogen-bonded Turntrans-81.6-1417579.2-69.7000113.5P141 V142 G145 Q154 F173 E174 W175 N176 Y179P141-N147 HydrophobicContact CB-CB 4.26Å; P141-N147 PolarHBondContact O-N 3.09Å; P141-N147 PolarHBondContact O-OD1 3.38Å; P141-N147 VanDerWaalsContact O-OD1 3.08Å; V142-N147 WeakPolarHBondContact CA-OD1 3.31Å; G145-N147 PolarHBondContact O-N 3.45Å; G145-N147 VanDerWaalsContact O-N 3.11Å; N147-Q154 PolarHBondContact ND2-OE1 2.77Å; N147-F173 HydrophobicContact CB-CE1 4.12Å; N147-F173 HydrophobicContact CB-CE2 4.11Å; N147-F173 HydrophobicContact CB-CZ 3.5Å; N147-E174 PolarHBondContact ND2-O 3.2Å; N147-E174 VanDerWaalsContact ND2-O 3.16Å; N147-E174 CarbonylContact O-C 3.43Å; N147-W175 CarbonylContact O-C 3.5Å; N147-N176 VanDerWaalsContact O-CB 3.22Å; N147-N176 WeakPolarHBondContact O-CB 3.36Å; N147-N176 PolarHBondContact O-N 2.96Å; N147-Y179 HydrophobicContact CB-CD1 4.16Å; N147-Y179 HydrophobicContact CB-CE1 4.38Å
148T90.4Very high91.3Very high1 Ų162.9 Ų62.91%0.00630%0.302CS..SBendtrans-93.8157.8179.875.90000111.2G145 D150 Y151 R152 Q154 E174 N176G145-T148 PolarHBondContact O-N 3.29Å; G145-T148 PolarHBondContact O-OG1 3.37Å; G145-T148 VanDerWaalsContact O-OG1 3.1Å; T148-D150 VanDerWaalsContact C-N 3.28Å; T148-D150 WeakPolarHBondContact CB-OD1 3.44Å; T148-D150 PolarHBondContact O-N 2.92Å; T148-D150 PolarHBondContact OG1-OD1 3.42Å; T148-Y151 PolarHBondContact OG1-N 2.97Å; T148-Y151 VanDerWaalsContact OG1-N 3.12Å; T148-R152 WeakPolarHBondContact CG2-O 3.47Å; T148-R152 PolarHBondContact OG1-N 2.93Å; T148-R152 VanDerWaalsContact OG1-N 3.1Å; T148-R152 PolarHBondContact OG1-O 3.07Å; T148-Q154 HydrophobicContact CG2-CB 3.88Å; T148-Q154 HydrophobicContact CG2-CG 4.38Å; T148-E174 HydrophobicContact CG2-CB 4.13Å; T148-N176 WeakPolarHBondContact O-CB 3.26Å; T148-N176 PolarHBondContact O-ND2 3.4Å
149A87.3Confident90.5Very high78 Ų7869.9 Ų69.965%0.64534%0.335SS*.THydrogen-bonded Turntrans-68.9-28.8-179.800000112.9
150D89.7Confident89.8Confident96 Ų9675.4 Ų75.451%0.51336%0.359SS..THydrogen-bonded Turntrans-97.32.4-178.270-18.2000113.8T148 R152T148-D150 VanDerWaalsContact C-N 3.28Å; T148-D150 WeakPolarHBondContact CB-OD1 3.44Å; T148-D150 PolarHBondContact O-N 2.92Å; T148-D150 PolarHBondContact OG1-OD1 3.42Å; D150-R152 HydrophobicContact CB-CG 4.44Å; D150-R152 PolarHBondContact O-N 3.1Å; D150-R152 PolarHBondContact OD1-N 3.38Å; D150-R152 VanDerWaalsContact OD1-N 3.15Å; D150-R152 WeakPolarHBondContact OD2-CB 3.47Å; D150-R152 WeakPolarHBondContact OD2-CD 3.44Å; D150-R152 WeakPolarHBondContact OD2-CG 3.42Å
151Y90.3Very high88.6Confident137 Ų13772.3 Ų72.354%0.53736%0.36SS..SBendtrans59.623.3-177.3-57.7-86.2000114.6G145 T148G145-Y151 CarbonylContact O-C 3.53Å; G145-Y151 VanDerWaalsContact O-CA 3.29Å; G145-Y151 WeakPolarHBondContact O-CA 3.25Å; T148-Y151 PolarHBondContact OG1-N 2.97Å; T148-Y151 VanDerWaalsContact OG1-N 3.12Å
152R92.1Very high87.3Confident180 Ų18075.2 Ų75.268%0.67938%0.375SS*.SBendtrans-98.7151.4174.6-60.5-174.868.8152.1-2.2110.6G145 T148 D150 Q154G145-R152 VanDerWaalsContact CA-O 3.28Å; G145-R152 WeakPolarHBondContact CA-O 3.22Å; T148-R152 WeakPolarHBondContact CG2-O 3.47Å; T148-R152 PolarHBondContact OG1-N 2.93Å; T148-R152 VanDerWaalsContact OG1-N 3.1Å; T148-R152 PolarHBondContact OG1-O 3.07Å; D150-R152 HydrophobicContact CB-CG 4.44Å; D150-R152 PolarHBondContact O-N 3.1Å; D150-R152 PolarHBondContact OD1-N 3.38Å; D150-R152 VanDerWaalsContact OD1-N 3.15Å; D150-R152 WeakPolarHBondContact OD2-CB 3.47Å; D150-R152 WeakPolarHBondContact OD2-CD 3.44Å; D150-R152 WeakPolarHBondContact OD2-CG 3.42Å; R152-Q154 PolarHBondContact O-N 3.3Å
153V92.3Very high85.8Confident48 Ų4880 Ų8029%0.29140%0.397SS..PPolyproline II helixtrans-67.1118.4175-178.90000109H143 L156H143-V153 VanDerWaalsContact O-CG2 3.29Å; H143-V153 WeakPolarHBondContact O-CG2 3.32Å; V153-L156 HydrophobicContact CB-CD1 4.34Å; V153-L156 HydrophobicContact CG1-CD1 4.03Å
154Q90.8Very high84.2Confident6 Ų678 Ų783%0.02840%0.397CS..THydrogen-bonded Turntrans-61.5152.6176.655.5172.940.400111.7N80 V142 N147 T148 R152 L156N80-Q154 PolarHBondContact ND2-O 2.92Å; N80-Q154 WeakPolarHBondContact OD1-CG 3.41Å; N80-Q154 PolarHBondContact OD1-NE2 2.84Å; N80-Q154 VanDerWaalsContact OD1-NE2 3.11Å; V142-Q154 HydrophobicContact CG1-CG 4.5Å; N147-Q154 PolarHBondContact ND2-OE1 2.77Å; T148-Q154 HydrophobicContact CG2-CB 3.88Å; T148-Q154 HydrophobicContact CG2-CG 4.38Å; R152-Q154 PolarHBondContact O-N 3.3Å; Q154-L156 VanDerWaalsContact C-N 3.26Å; Q154-L156 PolarHBondContact O-N 2.9Å; Q154-L156 VanDerWaalsContact O-N 3.15Å
155N89.3Confident82.4Confident15 Ų1580.6 Ų80.68%0.0842%0.417CS..THydrogen-bonded Turntrans5921.8172.3-44.7-48.9000116.1G76 C79 N80 D157 W158G76-N155 VanDerWaalsContact CA-O 3.24Å; G76-N155 WeakPolarHBondContact CA-O 3.43Å; C79-N155 PolarHBondContact SG-ND2 3.33Å; C79-N155 VanDerWaalsContact SG-ND2 3.41Å; N80-N155 PolarHBondContact OD1-ND2 2.6Å; N155-D157 VanDerWaalsContact C-N 3.3Å; N155-D157 PolarHBondContact O-N 3.41Å; N155-W158 HydrophobicContact CB-CD2 3.79Å; N155-W158 HydrophobicContact CB-CE3 3.99Å; N155-W158 HydrophobicContact CB-CG 4.16Å; N155-W158 HydrophobicContact CB-CZ2 4.4Å; N155-W158 HydrophobicContact CB-CZ3 4.35Å; N155-W158 VanDerWaalsContact OD1-CE2 3.31Å; N155-W158 WeakPolarHBondContact OD1-CH2 3.35Å; N155-W158 WeakPolarHBondContact OD1-CZ2 3.4Å
156L86.5Confident80.7Confident142 Ų14288.8 Ų88.874%0.74346%0.461SS*.THydrogen-bonded Turntrans-69.7-28.8-175.4-157.879.4000113.1V153 Q154 W158V153-L156 HydrophobicContact CB-CD1 4.34Å; V153-L156 HydrophobicContact CG1-CD1 4.03Å; Q154-L156 VanDerWaalsContact C-N 3.26Å; Q154-L156 PolarHBondContact O-N 2.9Å; Q154-L156 VanDerWaalsContact O-N 3.15Å; L156-W158 VanDerWaalsContact C-N 3.32Å
157D84.1Confident79.1Confident118 Ų11890.7 Ų90.763%0.63147%0.472SS*.THydrogen-bonded Turntrans-88.25.7-175.461.9-43.9000113.7N155 R169N155-D157 VanDerWaalsContact C-N 3.3Å; N155-D157 PolarHBondContact O-N 3.41Å; D157-R169 PolarHBondContact O-NH2 2.9Å
158W85.4Confident77.9Confident43 Ų4391.6 Ų91.616%0.16348%0.482CS..  trans-91.9110.1-173-6715.1000113.1W72 G76 C79 N155 L156 R169 Y170 C171W72-W158 HydrophobicContact CB-CZ3 4.43Å; G76-W158 PolarHBondContact N-O 2.91Å; G76-W158 VanDerWaalsContact N-O 3.09Å; C79-W158 HydrophobicContact CB-CZ3 4.37Å; N155-W158 HydrophobicContact CB-CD2 3.79Å; N155-W158 HydrophobicContact CB-CE3 3.99Å; N155-W158 HydrophobicContact CB-CG 4.16Å; N155-W158 HydrophobicContact CB-CZ2 4.4Å; N155-W158 HydrophobicContact CB-CZ3 4.35Å; N155-W158 VanDerWaalsContact OD1-CE2 3.31Å; N155-W158 WeakPolarHBondContact OD1-CH2 3.35Å; N155-W158 WeakPolarHBondContact OD1-CZ2 3.4Å; L156-W158 VanDerWaalsContact C-N 3.32Å; W158-R169 VanDerWaalsContact CD1-NE 3.3Å; W158-R169 HydrophobicContact CD2-CB 4.18Å; W158-R169 VanDerWaalsContact CD2-CD 3.45Å; W158-R169 HydrophobicContact CD2-CG 4.04Å; W158-R169 HydrophobicContact CE3-CB 4.03Å; W158-R169 HydrophobicContact CE3-CG 4.39Å; W158-R169 HydrophobicContact CG-CG 4.48Å; W158-R169 HydrophobicContact CH2-CB 3.85Å; W158-R169 HydrophobicContact CH2-CG 4.47Å; W158-R169 HydrophobicContact CZ2-CB 3.96Å; W158-R169 HydrophobicContact CZ2-CG 4.08Å; W158-R169 HydrophobicContact CZ3-CB 3.88Å; W158-Y170 WeakPolarHBondContact CH2-O 3.26Å; W158-C171 HydrophobicContact CZ3-CB 4.49Å
159E80.3Confident77.4Confident147 Ų14793.4 Ų93.469%0.68749%0.489SS*.  trans-78.5160.6171.2-63-167.2168.500113.3D162E159-D162 HydrophobicContact CB-CB 4.23Å
160F80.5Confident77.3Confident157 Ų15794.5 Ų94.569%0.68948%0.477SS*.THydrogen-bonded Turntrans-73.4132.5178.8-173.9-88.2000111F74 D162F74-F160 HydrophobicContact CB-CE2 4.45Å; F74-F160 HydrophobicContact CD1-CE2 4.23Å; F160-D162 PolarHBondContact O-N 3.14Å
161G68.8Low77.2Confident51 Ų5190.2 Ų90.253%0.52646%0.455SS..THydrogen-bonded Turntrans74.6-5179.600000115.4P73 E163P73-G161 PolarHBondContact O-N 2.92Å; G161-E163 PolarHBondContact O-N 3.46Å
162D66Low77.1Confident65 Ų6587.4 Ų87.435%0.34845%0.446SS..  trans-8199.6171.6175.220.7000109.2E159 F160 G164 R169E159-D162 HydrophobicContact CB-CB 4.23Å; F160-D162 PolarHBondContact O-N 3.14Å; D162-G164 PolarHBondContact O-N 3.32Å; D162-G164 WeakPolarHBondContact OD1-CA 3.49Å; D162-G164 PolarHBondContact OD1-N 2.9Å; D162-R169 VanDerWaalsContact CB-NH1 3.34Å; D162-R169 PolarHBondContact O-NH1 2.92Å; D162-R169 IonicContact OD2-CZ 3.04Å; D162-R169 IonicContact OD2-NH1 2.78Å; D162-R169 PolarHBondContact OD2-NH1 3.17Å; D162-R169 IonicContact OD2-NH2 3.27Å; D162-R169 PolarHBondContact OD2-NH2 3.46Å
163E62.8Low76.8Confident101 Ų10180 Ų8047%0.47242%0.419SS..  trans-75.4-0.7176.2-64.1-164165.400112.5G161 G168 R169G161-E163 PolarHBondContact O-N 3.46Å; E163-G168 CarbonylContact O-C 3.59Å; E163-G168 WeakPolarHBondContact O-CA 3.33Å; E163-G168 PolarHBondContact O-N 3.39Å; E163-R169 PolarHBondContact O-N 2.8Å
164G62.3Low76.6Confident32 Ų3281.7 Ų81.733%0.3342%0.424SS..  trans71.6151.7-178.500000113.1D162 D166D162-G164 PolarHBondContact O-N 3.32Å; D162-G164 WeakPolarHBondContact OD1-CA 3.49Å; D162-G164 PolarHBondContact OD1-N 2.9Å; G164-D166 PolarHBondContact O-N 3.28Å
165T57Low76.2Confident145 Ų14584.6 Ų84.689%0.8943%0.434SS*.SBendtrans-72.2124178.845.10000111.4K167T165-K167 PolarHBondContact O-N 3.28Å; T165-K167 VanDerWaalsContact O-N 3.15Å
166D55.5Low76.1Confident173 Ų17384.3 Ų84.393%0.92543%0.433SS*.SBendtrans67.5-19.3172.1-89.7-13.3000121.1G164G164-D166 PolarHBondContact O-N 3.28Å
167K58.6Low76.1Confident169 Ų16980.2 Ų80.274%0.73541%0.412SS*.SBendtrans-127.6-6.1-177.1-71.2-171.2-178.21770118.3T165 Y170T165-K167 PolarHBondContact O-N 3.28Å; T165-K167 VanDerWaalsContact O-N 3.15Å; K167-Y170 WeakPolarHBondContact O-CE2 3.34Å; K167-Y170 PolarHBondContact O-OH 3.44Å
168G65.5Low76.3Confident20 Ų2079.4 Ų79.421%0.20641%0.408CS..  trans77.3145.7-174.700000112.3E163 Y170E163-G168 CarbonylContact O-C 3.59Å; E163-G168 WeakPolarHBondContact O-CA 3.33Å; E163-G168 PolarHBondContact O-N 3.39Å; G168-Y170 WeakPolarHBondContact O-CD2 3.44Å; G168-Y170 VanDerWaalsContact O-CE2 3.28Å; G168-Y170 WeakPolarHBondContact O-CE2 3.37Å
169R81.3Confident76.4Confident39 Ų3978.6 Ų78.615%0.14741%0.405CS..  trans-87.9127.5167.3-75.6175.1168.9149.57.1110.6K71 W72 D157 W158 D162 E163K71-R169 WeakPolarHBondContact CA-O 3.14Å; W72-R169 PolarHBondContact N-O 3.48Å; D157-R169 PolarHBondContact O-NH2 2.9Å; W158-R169 VanDerWaalsContact CD1-NE 3.3Å; W158-R169 HydrophobicContact CD2-CB 4.18Å; W158-R169 VanDerWaalsContact CD2-CD 3.45Å; W158-R169 HydrophobicContact CD2-CG 4.04Å; W158-R169 HydrophobicContact CE3-CB 4.03Å; W158-R169 HydrophobicContact CE3-CG 4.39Å; W158-R169 HydrophobicContact CG-CG 4.48Å; W158-R169 HydrophobicContact CH2-CB 3.85Å; W158-R169 HydrophobicContact CH2-CG 4.47Å; W158-R169 HydrophobicContact CZ2-CB 3.96Å; W158-R169 HydrophobicContact CZ2-CG 4.08Å; W158-R169 HydrophobicContact CZ3-CB 3.88Å; D162-R169 VanDerWaalsContact CB-NH1 3.34Å; D162-R169 PolarHBondContact O-NH1 2.92Å; D162-R169 IonicContact OD2-CZ 3.04Å; D162-R169 IonicContact OD2-NH1 2.78Å; D162-R169 PolarHBondContact OD2-NH1 3.17Å; D162-R169 IonicContact OD2-NH2 3.27Å; D162-R169 PolarHBondContact OD2-NH2 3.46Å; E163-R169 PolarHBondContact O-N 2.8Å
170Y84.4Confident76.9Confident100 Ų10071.6 Ų71.639%0.39237%0.372SS..BIsolated β-bridgetrans-109.2111.5-176-59.2-83.7000111.3D69 S70 K71 W158 K167 G168 Q172D69-Y170 WeakPolarHBondContact O-CE1 3.34Å; S70-Y170 WeakPolarHBondContact O-CA 3.24Å; K71-Y170 HydrophobicContact CG-CE1 4.11Å; W158-Y170 WeakPolarHBondContact CH2-O 3.26Å; K167-Y170 WeakPolarHBondContact O-CE2 3.34Å; K167-Y170 PolarHBondContact O-OH 3.44Å; G168-Y170 WeakPolarHBondContact O-CD2 3.44Å; G168-Y170 VanDerWaalsContact O-CE2 3.28Å; G168-Y170 WeakPolarHBondContact O-CE2 3.37Å; Y170-Q172 PolarHBondContact O-N 3.03Å
171C88.4Confident77.4Confident7 Ų767 Ų675%0.04735%0.354CS..  trans-77.299.2179.9-177.20000110.7L65 W72 C79 W158L65-C171 HydrophobicContact CD1-CB 4.46Å; L65-C171 HydrophobicContact CD2-CB 4.18Å; W72-C171 HydrophobicContact CB-CB 3.53Å; W72-C171 HydrophobicContact CD2-CB 3.67Å; W72-C171 HydrophobicContact CE3-CB 3.85Å; W72-C171 HydrophobicContact CG-CB 3.57Å; C79-C171 WeakPolarHBondContact CA-SG 3.35Å; C79-C171 HydrophobicContact CB-CB 3.93Å; C79-C171 WeakPolarHBondContact CB-SG 3.44Å; C79-C171 WeakPolarHBondContact SG-CA 3.44Å; C79-C171 WeakPolarHBondContact SG-CB 3.13Å; C79-C171 CovalentContact SG-SG 2.03Å; C79-C171 PolarHBondContact SG-SG 2.87Å; W158-C171 HydrophobicContact CZ3-CB 4.49Å
172Q86.8Confident78.5Confident78 Ų7870.6 Ų70.636%0.36436%0.36SS..  trans-136.2154.7-178.4-64.2-174.2-14.500110.7I83 Y170 E174I83-Q172 WeakPolarHBondContact CD1-O 3.4Å; Y170-Q172 PolarHBondContact O-N 3.03Å; Q172-E174 PolarHBondContact O-N 2.92Å
173F87.3Confident79.7Confident24 Ų2468.1 Ų68.111%0.10535%0.346CS..  trans-71.5121.6173.4-171.1-89.5000109.2I83 V87 V142 N147 W175 Y179 F256I83-F173 HydrophobicContact CG2-CB 4.46Å; I83-F173 HydrophobicContact CG2-CD2 3.5Å; I83-F173 VanDerWaalsContact CG2-CD2 3.5Å; I83-F173 HydrophobicContact CG2-CE2 4.22Å; I83-F173 HydrophobicContact CG2-CG 4.46Å; V87-F173 HydrophobicContact CG2-CD2 4.43Å; V87-F173 HydrophobicContact CG2-CE2 4.42Å; V142-F173 HydrophobicContact CG2-CE2 4.1Å; N147-F173 HydrophobicContact CB-CE1 4.12Å; N147-F173 HydrophobicContact CB-CE2 4.11Å; N147-F173 HydrophobicContact CB-CZ 3.5Å; F173-W175 HydrophobicContact CD1-CD2 4.42Å; F173-W175 HydrophobicContact CD1-CE3 4.42Å; F173-W175 PolarHBondContact O-NE1 3.34Å; F173-Y179 HydrophobicContact CE1-CD1 4.25Å; F173-Y179 HydrophobicContact CE1-CE1 4.1Å; F173-Y179 HydrophobicContact CE2-CE1 4.45Å; F173-Y179 AromaticContact CZ-CD1 3.95Å; F173-Y179 HydrophobicContact CZ-CD1 3.95Å; F173-Y179 AromaticContact CZ-CE1 3.45Å; F173-Y179 HydrophobicContact CZ-CE1 3.45Å; F173-Y179 VanDerWaalsContact CZ-CE1 3.45Å; F173-F256 HydrophobicContact CD1-CE2 4.09Å; F173-F256 HydrophobicContact CD1-CZ 4.43Å; F173-F256 HydrophobicContact CE1-CE2 4.21Å; F173-F256 HydrophobicContact CE1-CZ 4.1Å
174E86.1Confident81.2Confident83 Ų8363.3 Ų63.339%0.38832%0.324SS..  trans-77.5147.2171.1-72.9-165.2-157.100112.2N147 T148 Q172N147-E174 PolarHBondContact ND2-O 3.2Å; N147-E174 VanDerWaalsContact ND2-O 3.16Å; N147-E174 CarbonylContact O-C 3.43Å; T148-E174 HydrophobicContact CG2-CB 4.13Å; Q172-E174 PolarHBondContact O-N 2.92Å
175W83.7Confident82.7Confident67 Ų6767.3 Ų67.325%0.25433%0.332SS..  trans-109107.3-167.9-48.987.5000110.9N147 F173 V180 F256 M259N147-W175 CarbonylContact O-C 3.5Å; F173-W175 HydrophobicContact CD1-CD2 4.42Å; F173-W175 HydrophobicContact CD1-CE3 4.42Å; F173-W175 PolarHBondContact O-NE1 3.34Å; W175-V180 HydrophobicContact CB-CG2 4.32Å; W175-V180 HydrophobicContact CE3-CG2 3.7Å; W175-V180 HydrophobicContact CZ3-CG2 4.47Å; W175-F256 HydrophobicContact CE3-CD2 4.17Å; W175-F256 AromaticContact CE3-CE2 3.99Å; W175-F256 HydrophobicContact CE3-CE2 3.99Å; W175-F256 HydrophobicContact CE3-CZ 4.32Å; W175-F256 HydrophobicContact CH2-CB 4.33Å; W175-F256 AromaticContact CH2-CD2 3.28Å; W175-F256 HydrophobicContact CH2-CD2 3.28Å; W175-F256 AromaticContact CH2-CE2 3.66Å; W175-F256 HydrophobicContact CH2-CE2 3.66Å; W175-F256 HydrophobicContact CH2-CG 4Å; W175-F256 HydrophobicContact CZ3-CB 4.03Å; W175-F256 HydrophobicContact CZ3-CD1 4.1Å; W175-F256 AromaticContact CZ3-CD2 3.02Å; W175-F256 HydrophobicContact CZ3-CD2 3.02Å; W175-F256 HydrophobicContact CZ3-CE1 4.29Å; W175-F256 AromaticContact CZ3-CE2 3.19Å; W175-F256 HydrophobicContact CZ3-CE2 3.19Å; W175-F256 AromaticContact CZ3-CG 3.46Å; W175-F256 HydrophobicContact CZ3-CG 3.46Å; W175-F256 VanDerWaalsContact CZ3-CG 3.46Å; W175-F256 AromaticContact CZ3-CZ 3.85Å; W175-F256 HydrophobicContact CZ3-CZ 3.85Å; W175-F256 WeakPolarHBondContact CZ3-O 3.36Å; W175-M259 HydrophobicContact CD2-CB 4.42Å; W175-M259 HydrophobicContact CE3-CB 4.29Å; W175-M259 HydrophobicContact CZ3-CB 4.29Å
176N87.1Confident84.4Confident9 Ų962.3 Ų62.35%0.04831%0.309CS..  trans-95.4120.7160.9179.2-52.6000108.8N147 T148 N178 Y179 V180N147-N176 VanDerWaalsContact O-CB 3.22Å; N147-N176 WeakPolarHBondContact O-CB 3.36Å; N147-N176 PolarHBondContact O-N 2.96Å; T148-N176 WeakPolarHBondContact O-CB 3.26Å; T148-N176 PolarHBondContact O-ND2 3.4Å; N176-N178 VanDerWaalsContact C-N 3.27Å; N176-N178 PolarHBondContact O-N 3.47Å; N176-N178 WeakPolarHBondContact OD1-CB 3.47Å; N176-N178 PolarHBondContact OD1-N 3.11Å; N176-Y179 PolarHBondContact O-N 3.46Å; N176-Y179 VanDerWaalsContact O-N 3.11Å; N176-Y179 PolarHBondContact OD1-N 3.22Å; N176-V180 WeakPolarHBondContact O-CB 3.46Å; N176-V180 VanDerWaalsContact O-CG2 3.28Å; N176-V180 WeakPolarHBondContact O-CG2 3.48Å; N176-V180 PolarHBondContact O-N 2.91Å
177N86.7Confident86.1Confident56 Ų5654.6 Ų54.630%0.29927%0.268SS..Hα-helixtrans-54.5-42.2-172.7-59.60.2000112.8L181 G260N177-L181 VanDerWaalsContact O-CG 3.31Å; N177-L181 WeakPolarHBondContact O-CG 3.32Å; N177-L181 PolarHBondContact O-N 3.48Å; N177-L181 VanDerWaalsContact O-N 3.16Å; N177-G260 WeakPolarHBondContact CA-O 3.47Å; N177-G260 WeakPolarHBondContact CB-O 3.29Å; N177-G260 PolarHBondContact OD1-O 3.25Å
178N87.1Confident87.7Confident102 Ų10246.5 Ų46.555%0.54523%0.233SC..Hα-helixtrans-68.2-46.3-179.8-65.1-35.9000111.1N176 L181 I182N176-N178 VanDerWaalsContact C-N 3.27Å; N176-N178 PolarHBondContact O-N 3.47Å; N176-N178 WeakPolarHBondContact OD1-CB 3.47Å; N176-N178 PolarHBondContact OD1-N 3.11Å; N178-L181 PolarHBondContact O-N 3.45Å; N178-I182 VanDerWaalsContact O-CG1 3.28Å; N178-I182 WeakPolarHBondContact O-CG1 3.49Å; N178-I182 PolarHBondContact O-N 3.36Å
179Y87.9Confident89.2Confident26 Ų2648 Ų4810%0.10223%0.233CC..Hα-helixtrans-61.8-45.6178.3175.3-96.6000111.5V137 P141 N147 F173 N176 L181 I182 Y183V137-Y179 PolarHBondContact O-OH 3.28Å; V137-Y179 VanDerWaalsContact O-OH 3.1Å; P141-Y179 HydrophobicContact CB-CD2 4Å; P141-Y179 HydrophobicContact CB-CE1 4.33Å; P141-Y179 HydrophobicContact CB-CE2 3.39Å; P141-Y179 HydrophobicContact CG-CD2 4.14Å; P141-Y179 HydrophobicContact CG-CE2 3.22Å; P141-Y179 WeakPolarHBondContact CG-OH 3.21Å; N147-Y179 HydrophobicContact CB-CD1 4.16Å; N147-Y179 HydrophobicContact CB-CE1 4.38Å; F173-Y179 HydrophobicContact CE1-CD1 4.25Å; F173-Y179 HydrophobicContact CE1-CE1 4.1Å; F173-Y179 HydrophobicContact CE2-CE1 4.45Å; F173-Y179 AromaticContact CZ-CD1 3.95Å; F173-Y179 HydrophobicContact CZ-CD1 3.95Å; F173-Y179 AromaticContact CZ-CE1 3.45Å; F173-Y179 HydrophobicContact CZ-CE1 3.45Å; F173-Y179 VanDerWaalsContact CZ-CE1 3.45Å; N176-Y179 PolarHBondContact O-N 3.46Å; N176-Y179 VanDerWaalsContact O-N 3.11Å; N176-Y179 PolarHBondContact OD1-N 3.22Å; Y179-L181 VanDerWaalsContact C-N 3.33Å; Y179-L181 PolarHBondContact O-N 3.28Å; Y179-I182 PolarHBondContact O-N 3.11Å; Y179-Y183 HydrophobicContact CE1-CG 4.34Å; Y179-Y183 VanDerWaalsContact O-CB 3.25Å; Y179-Y183 WeakPolarHBondContact O-CB 3.36Å; Y179-Y183 PolarHBondContact O-N 3.31Å
180V90.2Very high89.8Confident0 Ų050.6 Ų50.60%025%0.249CC..Hα-helixtrans-58.4-45.5-179.4164.30000111W175 N176 A184 F256W175-V180 HydrophobicContact CB-CG2 4.32Å; W175-V180 HydrophobicContact CE3-CG2 3.7Å; W175-V180 HydrophobicContact CZ3-CG2 4.47Å; N176-V180 WeakPolarHBondContact O-CB 3.46Å; N176-V180 VanDerWaalsContact O-CG2 3.28Å; N176-V180 WeakPolarHBondContact O-CG2 3.48Å; N176-V180 PolarHBondContact O-N 2.91Å; V180-A184 VanDerWaalsContact O-CB 3.23Å; V180-A184 WeakPolarHBondContact O-CB 3.4Å; V180-A184 PolarHBondContact O-N 2.95Å; V180-F256 HydrophobicContact CB-CE1 3.93Å; V180-F256 HydrophobicContact CB-CZ 4.41Å; V180-F256 HydrophobicContact CG1-CD1 3.67Å; V180-F256 HydrophobicContact CG1-CE1 3.47Å; V180-F256 VanDerWaalsContact CG1-CE1 3.47Å; V180-F256 HydrophobicContact CG1-CZ 4.28Å; V180-F256 WeakPolarHBondContact CG1-O 3.35Å; V180-F256 HydrophobicContact CG2-CE1 3.96Å; V180-F256 HydrophobicContact CG2-CZ 3.95Å
181L91.8Very high90.3Very high61 Ų6146 Ų4632%0.31923%0.232SC..Hα-helixtrans-64.1-49.9177.2-70.4172.9000111.5N177 N178 Y179 Y183 A184 F185 T257 V261N177-L181 VanDerWaalsContact O-CG 3.31Å; N177-L181 WeakPolarHBondContact O-CG 3.32Å; N177-L181 PolarHBondContact O-N 3.48Å; N177-L181 VanDerWaalsContact O-N 3.16Å; N178-L181 PolarHBondContact O-N 3.45Å; Y179-L181 VanDerWaalsContact C-N 3.33Å; Y179-L181 PolarHBondContact O-N 3.28Å; L181-Y183 VanDerWaalsContact C-N 3.29Å; L181-Y183 PolarHBondContact O-N 2.88Å; L181-A184 PolarHBondContact O-N 2.95Å; L181-F185 HydrophobicContact CD2-CD2 4.49Å; L181-F185 HydrophobicContact CD2-CE2 4.05Å; L181-F185 WeakPolarHBondContact O-CB 3.43Å; L181-F185 VanDerWaalsContact O-CD2 3.27Å; L181-F185 WeakPolarHBondContact O-CD2 3.37Å; L181-F185 PolarHBondContact O-N 2.85Å; L181-T257 HydrophobicContact CD2-CG2 4.02Å; L181-V261 HydrophobicContact CD1-CG2 4.45Å; L181-V261 HydrophobicContact CD2-CG2 3.78Å; L181-V261 HydrophobicContact CG-CG2 4.33Å
182I91.2Very high90.6Very high125 Ų12546.6 Ų46.664%0.64123%0.234SC*.Hα-helixtrans-58.1-46.1179.2-68.6166.3000110.5N178 Y179 G186N178-I182 VanDerWaalsContact O-CG1 3.28Å; N178-I182 WeakPolarHBondContact O-CG1 3.49Å; N178-I182 PolarHBondContact O-N 3.36Å; Y179-I182 PolarHBondContact O-N 3.11Å; I182-G186 PolarHBondContact O-N 2.95Å
183Y92.1Very high91Very high14 Ų1448.9 Ų48.96%0.05525%0.247CC..Hα-helixtrans-63.8-57.1179.4178.2-100.1000111.3V87 T91 V137 Y179 L181 F185 G186 T187 F253 F256V87-Y183 HydrophobicContact CG1-CE2 3.77Å; V87-Y183 WeakPolarHBondContact CG1-OH 3.36Å; T91-Y183 PolarHBondContact OG1-OH 3.46Å; V137-Y183 HydrophobicContact CG1-CD2 3.5Å; V137-Y183 VanDerWaalsContact CG1-CD2 3.5Å; V137-Y183 HydrophobicContact CG1-CE2 3.62Å; Y179-Y183 HydrophobicContact CE1-CG 4.34Å; Y179-Y183 VanDerWaalsContact O-CB 3.25Å; Y179-Y183 WeakPolarHBondContact O-CB 3.36Å; Y179-Y183 PolarHBondContact O-N 3.31Å; L181-Y183 VanDerWaalsContact C-N 3.29Å; L181-Y183 PolarHBondContact O-N 2.88Å; Y183-F185 VanDerWaalsContact C-N 3.32Å; Y183-F185 PolarHBondContact O-N 3.29Å; Y183-G186 PolarHBondContact O-N 3.34Å; Y183-T187 HydrophobicContact CD2-CG2 3.69Å; Y183-T187 HydrophobicContact CE2-CG2 3.59Å; Y183-T187 HydrophobicContact CG-CG2 4.45Å; Y183-T187 WeakPolarHBondContact O-CB 3.28Å; Y183-T187 PolarHBondContact O-N 3.41Å; Y183-T187 PolarHBondContact O-OG1 2.94Å; Y183-F253 HydrophobicContact CD1-CE1 4.47Å; Y183-F253 AromaticContact CE1-CE1 3.88Å; Y183-F253 HydrophobicContact CE1-CE1 3.88Å; Y183-F256 AromaticContact CD1-CE1 3.68Å; Y183-F256 HydrophobicContact CD1-CE1 3.68Å; Y183-F256 AromaticContact CD1-CZ 3.84Å; Y183-F256 HydrophobicContact CD1-CZ 3.84Å; Y183-F256 HydrophobicContact CE1-CE1 4.37Å; Y183-F256 HydrophobicContact CE1-CZ 4.32Å
184A94.2Very high91.3Very high0 Ų050.4 Ų50.40%026%0.258CS..Hα-helixtrans-59.4-41.5-175.700000112.5V180 L181 F188 Y189 F253 F256 T257V180-A184 VanDerWaalsContact O-CB 3.23Å; V180-A184 WeakPolarHBondContact O-CB 3.4Å; V180-A184 PolarHBondContact O-N 2.95Å; L181-A184 PolarHBondContact O-N 2.95Å; A184-F188 WeakPolarHBondContact O-CB 3.34Å; A184-F188 PolarHBondContact O-N 2.85Å; A184-F188 VanDerWaalsContact O-N 3.1Å; A184-Y189 HydrophobicContact CB-CD2 4.27Å; A184-Y189 HydrophobicContact CB-CE2 4Å; A184-Y189 WeakPolarHBondContact O-CD2 3.41Å; A184-Y189 PolarHBondContact O-N 2.86Å; A184-F253 HydrophobicContact CB-CD1 4.29Å; A184-F256 HydrophobicContact CB-CD1 4.13Å; A184-F256 HydrophobicContact CB-CE1 4.41Å; A184-T257 WeakPolarHBondContact CB-OG1 3.3Å
185F93.8Very high91.5Very high115 Ų11546.6 Ų46.650%0.50424%0.24SC..Iπ-helixtrans-71.7-43.5177.2-80.3-94.1000112.4L181 Y183 Y189 L190L181-F185 HydrophobicContact CD2-CD2 4.49Å; L181-F185 HydrophobicContact CD2-CE2 4.05Å; L181-F185 WeakPolarHBondContact O-CB 3.43Å; L181-F185 VanDerWaalsContact O-CD2 3.27Å; L181-F185 WeakPolarHBondContact O-CD2 3.37Å; L181-F185 PolarHBondContact O-N 2.85Å; Y183-F185 VanDerWaalsContact C-N 3.32Å; Y183-F185 PolarHBondContact O-N 3.29Å; F185-Y189 HydrophobicContact CD1-CD2 4.18Å; F185-Y189 HydrophobicContact CD1-CG 4.49Å; F185-Y189 HydrophobicContact CD2-CD2 4.15Å; F185-Y189 HydrophobicContact CE1-CD2 4.35Å; F185-Y189 HydrophobicContact CE2-CD2 4.34Å; F185-Y189 HydrophobicContact CG-CD2 4.09Å; F185-Y189 HydrophobicContact CZ-CD2 4.44Å; F185-L190 WeakPolarHBondContact O-CB 3.26Å; F185-L190 PolarHBondContact O-N 2.82Å
186G92.1Very high91.9Very high40 Ų4045.4 Ų45.441%0.41224%0.241SC..Iπ-helixtrans-69.2-40.2-178.100000113.7I182 Y183 P191I182-G186 PolarHBondContact O-N 2.95Å; Y183-G186 PolarHBondContact O-N 3.34Å; G186-P191 WeakPolarHBondContact O-CD 3.36Å
187T91.1Very high92.1Very high11 Ų1146.5 Ų46.57%0.06725%0.254CS..Iπ-helixtrans-100-19.7-171.966.20000114.1T91 I94 V137 Y183 P191T91-T187 HydrophobicContact CG2-CG2 4.02Å; I94-T187 WeakPolarHBondContact CG2-O 3.23Å; V137-T187 HydrophobicContact CG1-CG2 4.12Å; Y183-T187 HydrophobicContact CD2-CG2 3.69Å; Y183-T187 HydrophobicContact CE2-CG2 3.59Å; Y183-T187 HydrophobicContact CG-CG2 4.45Å; Y183-T187 WeakPolarHBondContact O-CB 3.28Å; Y183-T187 PolarHBondContact O-N 3.41Å; Y183-T187 PolarHBondContact O-OG1 2.94Å; T187-P191 WeakPolarHBondContact O-CG 3.38Å
188F93.8Very high92.1Very high0 Ų045 Ų450%025%0.246CC..Iπ-helixtrans-123.3-62.5179.4178.2-104.2000114.4A184 L190 P191 L192 F245 W249 F250 F253A184-F188 WeakPolarHBondContact O-CB 3.34Å; A184-F188 PolarHBondContact O-N 2.85Å; A184-F188 VanDerWaalsContact O-N 3.1Å; F188-L190 PolarHBondContact O-N 2.99Å; F188-P191 WeakPolarHBondContact O-CD 3.27Å; F188-L192 HydrophobicContact CE1-CD2 3.93Å; F188-L192 HydrophobicContact CZ-CD2 3.78Å; F188-L192 WeakPolarHBondContact O-CB 3.46Å; F188-L192 PolarHBondContact O-N 2.7Å; F188-F245 HydrophobicContact CD2-CE1 4.27Å; F188-F245 AromaticContact CD2-CZ 3.94Å; F188-F245 HydrophobicContact CD2-CZ 3.94Å; F188-F245 AromaticContact CE2-CE1 3.73Å; F188-F245 HydrophobicContact CE2-CE1 3.73Å; F188-F245 AromaticContact CE2-CZ 3.75Å; F188-F245 HydrophobicContact CE2-CZ 3.75Å; F188-W249 HydrophobicContact CD2-CB 4.18Å; F188-W249 HydrophobicContact CE2-CB 3.52Å; F188-W249 HydrophobicContact CZ-CB 4.22Å; F188-F250 AromaticContact CE1-CD2 3.98Å; F188-F250 HydrophobicContact CE1-CD2 3.98Å; F188-F250 HydrophobicContact CZ-CB 4Å; F188-F250 HydrophobicContact CZ-CD2 4.14Å; F188-F253 HydrophobicContact CB-CB 4.37Å; F188-F253 HydrophobicContact CB-CD1 3.52Å; F188-F253 HydrophobicContact CB-CD2 3.64Å; F188-F253 HydrophobicContact CB-CE1 3.54Å; F188-F253 HydrophobicContact CB-CE2 3.65Å; F188-F253 HydrophobicContact CB-CG 3.57Å; F188-F253 HydrophobicContact CB-CZ 3.62Å; F188-F253 HydrophobicContact CD1-CB 3.39Å; F188-F253 HydrophobicContact CD1-CD1 4.19Å; F188-F253 AromaticContact CD1-CD2 3.7Å; F188-F253 HydrophobicContact CD1-CD2 3.7Å; F188-F253 AromaticContact CD1-CG 3.5Å; F188-F253 HydrophobicContact CD1-CG 3.5Å; F188-F253 VanDerWaalsContact CD1-CG 3.5Å; F188-F253 AromaticContact CD2-CD2 3.26Å; F188-F253 HydrophobicContact CD2-CD2 3.26Å; F188-F253 AromaticContact CD2-CE2 3.46Å; F188-F253 HydrophobicContact CD2-CE2 3.46Å; F188-F253 VanDerWaalsContact CD2-CE2 3.46Å; F188-F253 AromaticContact CD2-CG 3.94Å; F188-F253 HydrophobicContact CD2-CG 3.94Å; F188-F253 HydrophobicContact CD2-CZ 4.28Å; F188-F253 HydrophobicContact CE1-CB 3.72Å; F188-F253 HydrophobicContact CE1-CD2 4.14Å; F188-F253 HydrophobicContact CE1-CG 4.14Å; F188-F253 AromaticContact CE2-CD2 3.77Å; F188-F253 HydrophobicContact CE2-CD2 3.77Å; F188-F253 HydrophobicContact CE2-CE2 4.24Å; F188-F253 HydrophobicContact CG-CB 3.85Å; F188-F253 AromaticContact CG-CD1 3.9Å; F188-F253 HydrophobicContact CG-CD1 3.9Å; F188-F253 AromaticContact CG-CD2 3.21Å; F188-F253 HydrophobicContact CG-CD2 3.21Å; F188-F253 HydrophobicContact CG-CE1 4.25Å; F188-F253 AromaticContact CG-CE2 3.62Å; F188-F253 HydrophobicContact CG-CE2 3.62Å; F188-F253 AromaticContact CG-CG 3.37Å; F188-F253 HydrophobicContact CG-CG 3.37Å; F188-F253 HydrophobicContact CG-CZ 4.13Å; F188-F253 HydrophobicContact CZ-CB 4.42Å; F188-F253 HydrophobicContact CZ-CD2 4.17Å
189Y95.9Very high91.9Very high51 Ų5141.2 Ų41.220%0.222%0.224CC..Iπ-helixtrans-66-41.2-169.6-65.7-68.7000112.9A184 F185 L192 M193 F250 F253 S254 T257A184-Y189 HydrophobicContact CB-CD2 4.27Å; A184-Y189 HydrophobicContact CB-CE2 4Å; A184-Y189 WeakPolarHBondContact O-CD2 3.41Å; A184-Y189 PolarHBondContact O-N 2.86Å; F185-Y189 HydrophobicContact CD1-CD2 4.18Å; F185-Y189 HydrophobicContact CD1-CG 4.49Å; F185-Y189 HydrophobicContact CD2-CD2 4.15Å; F185-Y189 HydrophobicContact CE1-CD2 4.35Å; F185-Y189 HydrophobicContact CE2-CD2 4.34Å; F185-Y189 HydrophobicContact CG-CD2 4.09Å; F185-Y189 HydrophobicContact CZ-CD2 4.44Å; Y189-L192 PolarHBondContact O-N 3.39Å; Y189-M193 WeakPolarHBondContact O-CB 3.48Å; Y189-M193 PolarHBondContact O-N 3.17Å; Y189-F250 HydrophobicContact CE1-CE2 4.19Å; Y189-F253 PolarHBondContact OH-O 2.92Å; Y189-S254 WeakPolarHBondContact OH-CA 3.44Å; Y189-S254 PolarHBondContact OH-N 3.15Å; Y189-T257 WeakPolarHBondContact CE2-OG1 3.34Å; Y189-T257 PolarHBondContact OH-OG1 3.18Å
190L95.3Very high91.8Very high94 Ų9445 Ų4549%0.49225%0.245SC..Hα-helixtrans-65.2-52.5175.1173.367.9000111.5F185 F188 L192 M193 V194F185-L190 WeakPolarHBondContact O-CB 3.26Å; F185-L190 PolarHBondContact O-N 2.82Å; F188-L190 PolarHBondContact O-N 2.99Å; L190-L192 VanDerWaalsContact C-N 3.27Å; L190-L192 PolarHBondContact O-N 3.18Å; L190-M193 HydrophobicContact CD1-CE 3.84Å; L190-M193 PolarHBondContact O-N 2.92Å; L190-V194 HydrophobicContact CD1-CG2 4.19Å; L190-V194 WeakPolarHBondContact O-CG2 3.5Å; L190-V194 PolarHBondContact O-N 3.46Å
191P94Very high91.6Very high4 Ų447.3 Ų47.33%0.02626%0.261CS..Hα-helixtrans-52.2-43.1171.6-33.439.6000113.7I94 L95 L98 G186 T187 F188 V194 M195I94-P191 HydrophobicContact CG2-CB 4.16Å; L95-P191 HydrophobicContact CD2-CG 4.28Å; L98-P191 HydrophobicContact CD2-CB 4.06Å; L98-P191 HydrophobicContact CD2-CG 4.35Å; G186-P191 WeakPolarHBondContact O-CD 3.36Å; T187-P191 WeakPolarHBondContact O-CG 3.38Å; F188-P191 WeakPolarHBondContact O-CD 3.27Å; P191-V194 PolarHBondContact O-N 3.19Å; P191-M195 WeakPolarHBondContact O-CB 3.48Å; P191-M195 VanDerWaalsContact O-CG 3.27Å; P191-M195 WeakPolarHBondContact O-CG 3.3Å; P191-M195 PolarHBondContact O-N 2.97Å
192L94.4Very high91.1Very high19 Ų1944.5 Ų44.510%0.09925%0.246CC..Hα-helixtrans-61.5-47.7177.6175.760.6000111.7F188 Y189 L190 V194 M195 C196 F245 I246 F250F188-L192 HydrophobicContact CE1-CD2 3.93Å; F188-L192 HydrophobicContact CZ-CD2 3.78Å; F188-L192 WeakPolarHBondContact O-CB 3.46Å; F188-L192 PolarHBondContact O-N 2.7Å; Y189-L192 PolarHBondContact O-N 3.39Å; L190-L192 VanDerWaalsContact C-N 3.27Å; L190-L192 PolarHBondContact O-N 3.18Å; L192-V194 VanDerWaalsContact C-N 3.34Å; L192-V194 PolarHBondContact O-N 2.93Å; L192-M195 PolarHBondContact O-N 3.5Å; L192-C196 WeakPolarHBondContact O-CB 3.24Å; L192-C196 PolarHBondContact O-N 3.44Å; L192-C196 PolarHBondContact O-SG 2.83Å; L192-C196 VanDerWaalsContact O-SG 3.36Å; L192-F245 HydrophobicContact CD1-CD1 4.5Å; L192-F245 HydrophobicContact CD1-CE1 4.33Å; L192-I246 HydrophobicContact CD1-CD1 3.82Å; L192-I246 HydrophobicContact CD1-CG1 3.51Å; L192-F250 HydrophobicContact CD2-CD2 4.18Å
193M94.9Very high90.6Very high126 Ų12642.5 Ų42.562%0.62123%0.233SC*.Hα-helixtrans-59.7-45.3177.4-176.2-178.26900111.3Y189 L190 C196 G197Y189-M193 WeakPolarHBondContact O-CB 3.48Å; Y189-M193 PolarHBondContact O-N 3.17Å; L190-M193 HydrophobicContact CD1-CE 3.84Å; L190-M193 PolarHBondContact O-N 2.92Å; M193-C196 PolarHBondContact O-N 3.26Å; M193-G197 PolarHBondContact O-N 2.97Å
194V93.8Very high90.1Very high56 Ų5650.2 Ų50.234%0.33926%0.262SS..Hα-helixtrans-63.5-44.3177.9177.40000110.6L98 L190 P191 L192 G197 M198L98-V194 HydrophobicContact CD1-CB 4.01Å; L98-V194 HydrophobicContact CD1-CG1 3.74Å; L190-V194 HydrophobicContact CD1-CG2 4.19Å; L190-V194 WeakPolarHBondContact O-CG2 3.5Å; L190-V194 PolarHBondContact O-N 3.46Å; P191-V194 PolarHBondContact O-N 3.19Å; L192-V194 VanDerWaalsContact C-N 3.34Å; L192-V194 PolarHBondContact O-N 2.93Å; V194-G197 PolarHBondContact O-N 2.93Å; V194-M198 HydrophobicContact CG1-CE 3.91Å; V194-M198 HydrophobicContact CG1-CG 4.43Å; V194-M198 HydrophobicContact CG1-SD 4.21Å; V194-M198 WeakPolarHBondContact O-CB 3.46Å; V194-M198 VanDerWaalsContact O-CG 3.26Å; V194-M198 WeakPolarHBondContact O-CG 3.4Å; V194-M198 PolarHBondContact O-N 3.28Å
195M91.2Very high89.5Confident3 Ų351.9 Ų51.92%0.01527%0.273CS..Hα-helixtrans-58.4-53.8174.8-74.8-171.5-70.800111.3L97 L98 P191 L192 G197 M198 Y199 L242 F245L97-M195 HydrophobicContact CB-SD 4.43Å; L98-M195 HydrophobicContact CB-CG 4.34Å; L98-M195 HydrophobicContact CB-SD 4.4Å; L98-M195 HydrophobicContact CD1-CG 3.67Å; P191-M195 WeakPolarHBondContact O-CB 3.48Å; P191-M195 VanDerWaalsContact O-CG 3.27Å; P191-M195 WeakPolarHBondContact O-CG 3.3Å; P191-M195 PolarHBondContact O-N 2.97Å; L192-M195 PolarHBondContact O-N 3.5Å; M195-G197 PolarHBondContact O-N 2.66Å; M195-M198 HydrophobicContact CG-CE 4.39Å; M195-M198 PolarHBondContact O-N 3.43Å; M195-Y199 HydrophobicContact CB-CD2 4.45Å; M195-Y199 HydrophobicContact CB-CE2 4.47Å; M195-Y199 WeakPolarHBondContact O-CD2 3.29Å; M195-Y199 PolarHBondContact O-N 3.39Å; M195-L242 HydrophobicContact CB-CD1 3.85Å; M195-L242 HydrophobicContact SD-CD1 4.27Å; M195-F245 HydrophobicContact CE-CD1 3.8Å; M195-F245 HydrophobicContact CE-CE1 3.35Å; M195-F245 HydrophobicContact CE-CZ 3.91Å
196C91.6Very high88.5Confident42 Ų4247.2 Ų47.228%0.28426%0.255SS..Hα-helixtrans-56.3-47.8178.2-72.90000111.9L192 M193 M198 Y199 L200L192-C196 WeakPolarHBondContact O-CB 3.24Å; L192-C196 PolarHBondContact O-N 3.44Å; L192-C196 PolarHBondContact O-SG 2.83Å; L192-C196 VanDerWaalsContact O-SG 3.36Å; M193-C196 PolarHBondContact O-N 3.26Å; C196-M198 PolarHBondContact O-N 2.89Å; C196-Y199 PolarHBondContact O-N 3.39Å; C196-L200 WeakPolarHBondContact O-CG 3.33Å; C196-L200 PolarHBondContact O-N 3.17Å
197G90.4Very high87.8Confident31 Ų3152.3 Ų52.332%0.3226%0.262SS..Hα-helixtrans-59.1-47.1177.100000112.5M193 V194 M195 Y199 L200 C201M193-G197 PolarHBondContact O-N 2.97Å; V194-G197 PolarHBondContact O-N 2.93Å; M195-G197 PolarHBondContact O-N 2.66Å; G197-Y199 VanDerWaalsContact C-N 3.3Å; G197-Y199 PolarHBondContact O-N 2.99Å; G197-L200 PolarHBondContact O-N 3.19Å; G197-C201 PolarHBondContact O-N 3.34Å; G197-C201 PolarHBondContact O-SG 2.83Å
198M87.3Confident87.3Confident24 Ų2456.1 Ų56.112%0.11828%0.279CS..Hα-helixtrans-60.5-39.9175.2-73.2-174.1-56.200112L98 V102 Y105 V194 M195 C196 C201 I202L98-M198 HydrophobicContact CD1-CE 3.8Å; V102-M198 VanDerWaalsContact CA-SD 3.6Å; V102-M198 HydrophobicContact CB-CE 4.49Å; V102-M198 HydrophobicContact CB-SD 4.11Å; V102-M198 HydrophobicContact CG2-CE 3.72Å; V102-M198 HydrophobicContact CG2-SD 3.54Å; V102-M198 VanDerWaalsContact CG2-SD 3.54Å; Y105-M198 HydrophobicContact CG-CB 4.43Å; Y105-M198 HydrophobicContact CG-CG 4.34Å; V194-M198 HydrophobicContact CG1-CE 3.91Å; V194-M198 HydrophobicContact CG1-CG 4.43Å; V194-M198 HydrophobicContact CG1-SD 4.21Å; V194-M198 WeakPolarHBondContact O-CB 3.46Å; V194-M198 VanDerWaalsContact O-CG 3.26Å; V194-M198 WeakPolarHBondContact O-CG 3.4Å; V194-M198 PolarHBondContact O-N 3.28Å; M195-M198 HydrophobicContact CG-CE 4.39Å; M195-M198 PolarHBondContact O-N 3.43Å; C196-M198 PolarHBondContact O-N 2.89Å; M198-C201 WeakPolarHBondContact O-CB 3.31Å; M198-C201 PolarHBondContact O-N 3.24Å; M198-I202 VanDerWaalsContact O-CG1 3.25Å; M198-I202 WeakPolarHBondContact O-CG1 3.47Å; M198-I202 PolarHBondContact O-N 3.46Å
199Y83.4Confident86.3Confident24 Ų2460.8 Ų60.89%0.09430%0.301CS..Hα-helixtrans-67.3-40177.7-81.9-62.2000113.3S101 M195 C196 G197 C201 I202 F203 L238 L242S101-Y199 VanDerWaalsContact OG-CE2 3.27Å; S101-Y199 WeakPolarHBondContact OG-CE2 3.02Å; S101-Y199 PolarHBondContact OG-OH 2.85Å; S101-Y199 VanDerWaalsContact OG-OH 3.07Å; M195-Y199 HydrophobicContact CB-CD2 4.45Å; M195-Y199 HydrophobicContact CB-CE2 4.47Å; M195-Y199 WeakPolarHBondContact O-CD2 3.29Å; M195-Y199 PolarHBondContact O-N 3.39Å; C196-Y199 PolarHBondContact O-N 3.39Å; G197-Y199 VanDerWaalsContact C-N 3.3Å; G197-Y199 PolarHBondContact O-N 2.99Å; Y199-C201 VanDerWaalsContact C-N 3.3Å; Y199-C201 PolarHBondContact O-N 3.24Å; Y199-I202 HydrophobicContact CD1-CD1 3.92Å; Y199-I202 HydrophobicContact CE1-CD1 4.11Å; Y199-I202 PolarHBondContact O-N 3.48Å; Y199-F203 PolarHBondContact O-N 3.22Å; Y199-L238 HydrophobicContact CD1-CB 4.42Å; Y199-L238 HydrophobicContact CE1-CB 3.42Å; Y199-L238 VanDerWaalsContact CE1-CB 3.42Å; Y199-L238 HydrophobicContact CE1-CD1 4.32Å; Y199-L238 HydrophobicContact CE1-CG 4.45Å; Y199-L242 HydrophobicContact CD2-CB 4.11Å; Y199-L242 HydrophobicContact CD2-CD1 4.09Å; Y199-L242 HydrophobicContact CD2-CD2 3.29Å; Y199-L242 HydrophobicContact CD2-CG 4Å; Y199-L242 HydrophobicContact CE2-CB 3.74Å; Y199-L242 HydrophobicContact CE2-CD1 3.92Å; Y199-L242 HydrophobicContact CE2-CD2 3.81Å; Y199-L242 HydrophobicContact CE2-CG 4.01Å; Y199-L242 HydrophobicContact CG-CD2 3.93Å
200L85.3Confident85.1Confident104 Ų10459.3 Ų59.355%0.54530%0.297SS..Hα-helixtrans-61.2-42.5171.9-67.5175.3000110.8C196 G197 F203 R204C196-L200 WeakPolarHBondContact O-CG 3.33Å; C196-L200 PolarHBondContact O-N 3.17Å; G197-L200 PolarHBondContact O-N 3.19Å; L200-F203 PolarHBondContact O-N 3.47Å; L200-R204 VanDerWaalsContact O-CG 3.3Å; L200-R204 WeakPolarHBondContact O-CG 3.39Å; L200-R204 PolarHBondContact O-N 3.35Å
201C85.4Confident84.2Confident49 Ų4963.4 Ų63.433%0.33131%0.306SS..Hα-helixtrans-63.7-42.7174.5-68.40000112.3Y105 G197 M198 Y199 F203 R204 V205Y105-C201 HydrophobicContact CD2-CB 4.26Å; Y105-C201 HydrophobicContact CE2-CB 3.73Å; G197-C201 PolarHBondContact O-N 3.34Å; G197-C201 PolarHBondContact O-SG 2.83Å; M198-C201 WeakPolarHBondContact O-CB 3.31Å; M198-C201 PolarHBondContact O-N 3.24Å; Y199-C201 VanDerWaalsContact C-N 3.3Å; Y199-C201 PolarHBondContact O-N 3.24Å; C201-F203 VanDerWaalsContact C-N 3.32Å; C201-F203 PolarHBondContact O-N 3.41Å; C201-R204 PolarHBondContact O-N 3.19Å; C201-V205 WeakPolarHBondContact O-CB 3.2Å; C201-V205 WeakPolarHBondContact O-CG2 3.44Å; C201-V205 PolarHBondContact O-N 3.43Å
202I82Confident83.4Confident2 Ų270.4 Ų70.41%0.0133%0.332CS..Hα-helixtrans-56.8-48.6174.2-72.1166.9000109.9Y105 I108 M198 Y199 R204 V205 A206 T235Y105-I202 HydrophobicContact CD2-CG1 3.96Å; I108-I202 HydrophobicContact CD1-CD1 4.47Å; I108-I202 HydrophobicContact CD1-CG1 4.41Å; I108-I202 HydrophobicContact CD1-CG2 3.63Å; I108-I202 HydrophobicContact CG2-CG2 4.33Å; M198-I202 VanDerWaalsContact O-CG1 3.25Å; M198-I202 WeakPolarHBondContact O-CG1 3.47Å; M198-I202 PolarHBondContact O-N 3.46Å; Y199-I202 HydrophobicContact CD1-CD1 3.92Å; Y199-I202 HydrophobicContact CE1-CD1 4.11Å; Y199-I202 PolarHBondContact O-N 3.48Å; I202-R204 VanDerWaalsContact C-N 3.34Å; I202-R204 PolarHBondContact O-N 2.93Å; I202-V205 PolarHBondContact O-N 3.35Å; I202-A206 VanDerWaalsContact O-CB 3.22Å; I202-A206 WeakPolarHBondContact O-CB 3.18Å; I202-A206 PolarHBondContact O-N 3.03Å; I202-T235 HydrophobicContact CG2-CG2 4.23Å
203F80.3Confident82.4Confident84 Ų8472.9 Ų72.937%0.36834%0.344SS..Hα-helixtrans-62.9-41.2-179.5-177.2-103.2000112.2Y199 L200 C201 R207Y199-F203 PolarHBondContact O-N 3.22Å; L200-F203 PolarHBondContact O-N 3.47Å; C201-F203 VanDerWaalsContact C-N 3.32Å; C201-F203 PolarHBondContact O-N 3.41Å; F203-R207 HydrophobicContact CE1-CG 4.38Å; F203-R207 HydrophobicContact CZ-CG 4.31Å; F203-R207 WeakPolarHBondContact O-CB 3.47Å; F203-R207 WeakPolarHBondContact O-CG 3.19Å; F203-R207 PolarHBondContact O-N 3Å
204R82.8Confident81.1Confident175 Ų17573.5 Ų73.566%0.6634%0.34SS*.Hα-helixtrans-63.7-52.5176.2-73.4176.3-177.8-179.11.3111.8L200 C201 I202 A206 R207 E208L200-R204 VanDerWaalsContact O-CG 3.3Å; L200-R204 WeakPolarHBondContact O-CG 3.39Å; L200-R204 PolarHBondContact O-N 3.35Å; C201-R204 PolarHBondContact O-N 3.19Å; I202-R204 VanDerWaalsContact C-N 3.34Å; I202-R204 PolarHBondContact O-N 2.93Å; R204-A206 PolarHBondContact O-N 3.5Å; R204-R207 PolarHBondContact O-N 3.21Å; R204-E208 PolarHBondContact O-N 3.4Å
205V80.4Confident80.3Confident36 Ų3674.8 Ų74.822%0.21836%0.356CS..Hα-helixtrans-60.5-46.5-179.9172.10000110.6C201 I202 R207 E208 Q209C201-V205 WeakPolarHBondContact O-CB 3.2Å; C201-V205 WeakPolarHBondContact O-CG2 3.44Å; C201-V205 PolarHBondContact O-N 3.43Å; I202-V205 PolarHBondContact O-N 3.35Å; V205-R207 VanDerWaalsContact C-N 3.35Å; V205-R207 PolarHBondContact O-N 3.25Å; V205-E208 PolarHBondContact O-N 3.22Å; V205-E208 VanDerWaalsContact O-N 3.16Å; V205-Q209 HydrophobicContact CG1-CG 4.43Å; V205-Q209 WeakPolarHBondContact O-CG 3.2Å; V205-Q209 PolarHBondContact O-N 3.12Å
206A73.4Confident79.4Confident16 Ų1680.1 Ų80.113%0.13239%0.389CS..Hα-helixtrans-58-47.3177.100000111.1I202 R204 E208 Q209 V210I202-A206 VanDerWaalsContact O-CB 3.22Å; I202-A206 WeakPolarHBondContact O-CB 3.18Å; I202-A206 PolarHBondContact O-N 3.03Å; R204-A206 PolarHBondContact O-N 3.5Å; A206-E208 VanDerWaalsContact C-N 3.3Å; A206-E208 PolarHBondContact O-N 3.32Å; A206-Q209 PolarHBondContact O-N 3.35Å; A206-V210 WeakPolarHBondContact O-CG2 3.47Å; A206-V210 PolarHBondContact O-N 3.24Å
207R76.9Confident78.4Confident147 Ų14780.7 Ų80.756%0.55539%0.392SS*.Hα-helixtrans-62-36177-83.6-168148.1-167.8-5.5113.4F203 R204 V205 V210 R211F203-R207 HydrophobicContact CE1-CG 4.38Å; F203-R207 HydrophobicContact CZ-CG 4.31Å; F203-R207 WeakPolarHBondContact O-CB 3.47Å; F203-R207 WeakPolarHBondContact O-CG 3.19Å; F203-R207 PolarHBondContact O-N 3Å; R204-R207 PolarHBondContact O-N 3.21Å; V205-R207 VanDerWaalsContact C-N 3.35Å; V205-R207 PolarHBondContact O-N 3.25Å; R207-V210 PolarHBondContact O-N 3.46Å; R207-R211 WeakPolarHBondContact O-CG 3.4Å; R207-R211 PolarHBondContact O-N 2.92Å; R207-R211 VanDerWaalsContact O-N 3.11Å
208E80.6Confident77.2Confident92 Ų9284 Ų8443%0.4341%0.407SS..Hα-helixtrans-69.6-41.7178.8-164.2178.8161.800112R204 V205 A206 V210 R211 R212R204-E208 PolarHBondContact O-N 3.4Å; V205-E208 PolarHBondContact O-N 3.22Å; V205-E208 VanDerWaalsContact O-N 3.16Å; A206-E208 VanDerWaalsContact C-N 3.3Å; A206-E208 PolarHBondContact O-N 3.32Å; E208-V210 VanDerWaalsContact C-N 3.28Å; E208-V210 PolarHBondContact O-N 2.75Å; E208-R211 PolarHBondContact O-N 2.96Å; E208-R211 VanDerWaalsContact O-N 3.11Å; E208-R212 WeakPolarHBondContact O-CG 3.03Å; E208-R212 PolarHBondContact O-N 2.88Å; E208-R212 IonicContact OE1-CZ 3.81Å; E208-R212 IonicContact OE1-NE 3.45Å; E208-R212 PolarHBondContact OE1-NE 3.06Å; E208-R212 IonicContact OE1-NH2 3.09Å; E208-R212 PolarHBondContact OE1-NH2 2.71Å
209Q73.8Confident76.2Confident97 Ų9788 Ų8845%0.45344%0.438SS..Hα-helixtrans-56.4-43.4173.6-67.4-64.9-33.300111.3V205 A206 R211 R212 I213V205-Q209 HydrophobicContact CG1-CG 4.43Å; V205-Q209 WeakPolarHBondContact O-CG 3.2Å; V205-Q209 PolarHBondContact O-N 3.12Å; A206-Q209 PolarHBondContact O-N 3.35Å; Q209-R211 PolarHBondContact O-N 3.46Å; Q209-R212 PolarHBondContact O-N 2.88Å; Q209-I213 WeakPolarHBondContact O-CD1 3.36Å; Q209-I213 VanDerWaalsContact O-CG1 3.27Å; Q209-I213 WeakPolarHBondContact O-CG1 3.25Å; Q209-I213 PolarHBondContact O-N 3Å
210V70.5Confident75.2Confident21 Ų2193.1 Ų93.113%0.12746%0.461CS..Hα-helixtrans-59.8-45.6174.7172.80000112.3A206 R207 E208 R214 V228A206-V210 WeakPolarHBondContact O-CG2 3.47Å; A206-V210 PolarHBondContact O-N 3.24Å; R207-V210 PolarHBondContact O-N 3.46Å; E208-V210 VanDerWaalsContact C-N 3.28Å; E208-V210 PolarHBondContact O-N 2.75Å; V210-R214 WeakPolarHBondContact O-CG 3.41Å; V210-R214 PolarHBondContact O-N 2.94Å; V210-R214 VanDerWaalsContact O-N 3.13Å; V210-V228 HydrophobicContact CB-CG1 4.4Å; V210-V228 HydrophobicContact CB-CG2 4.03Å; V210-V228 HydrophobicContact CG1-CG1 4.05Å; V210-V228 HydrophobicContact CG1-CG2 3.75Å; V210-V228 HydrophobicContact CG2-CB 4Å; V210-V228 HydrophobicContact CG2-CG1 3.46Å; V210-V228 VanDerWaalsContact CG2-CG1 3.46Å; V210-V228 HydrophobicContact CG2-CG2 3.41Å; V210-V228 VanDerWaalsContact CG2-CG2 3.41Å
211R75.9Confident74Confident179 Ų17990.2 Ų90.268%0.67545%0.451SS*.Hα-helixtrans-62.9-44.7179.9-75.5177.9176.9177.2-2.6111.2R207 E208 Q209 R214 A215R207-R211 WeakPolarHBondContact O-CG 3.4Å; R207-R211 PolarHBondContact O-N 2.92Å; R207-R211 VanDerWaalsContact O-N 3.11Å; E208-R211 PolarHBondContact O-N 2.96Å; E208-R211 VanDerWaalsContact O-N 3.11Å; Q209-R211 PolarHBondContact O-N 3.46Å; R211-R214 PolarHBondContact O-N 2.99Å; R211-A215 PolarHBondContact O-N 3.45Å
212R77.8Confident72.9Confident151 Ų15199 Ų9957%0.5748%0.477SS*.Hα-helixtrans-63.4-45178.8-69.1-176.6-175.5-1403.7112.1E208 Q209 R214 A215 T216E208-R212 WeakPolarHBondContact O-CG 3.03Å; E208-R212 PolarHBondContact O-N 2.88Å; E208-R212 IonicContact OE1-CZ 3.81Å; E208-R212 IonicContact OE1-NE 3.45Å; E208-R212 PolarHBondContact OE1-NE 3.06Å; E208-R212 IonicContact OE1-NH2 3.09Å; E208-R212 PolarHBondContact OE1-NH2 2.71Å; Q209-R212 PolarHBondContact O-N 2.88Å; R212-R214 VanDerWaalsContact C-N 3.31Å; R212-R214 PolarHBondContact O-N 2.96Å; R212-A215 PolarHBondContact O-N 2.94Å; R212-A215 VanDerWaalsContact O-N 3.16Å; R212-T216 PolarHBondContact O-N 3.13Å; R212-T216 PolarHBondContact O-OG1 3.08Å; R212-T216 VanDerWaalsContact O-OG1 3.12Å
213I71.9Confident71.9Confident71 Ų71102.2 Ų102.236%0.36450%0.5SS..Hα-helixtrans-61-41.2177.9-66165.2000111.4Q209 A215 T217 A224Q209-I213 WeakPolarHBondContact O-CD1 3.36Å; Q209-I213 VanDerWaalsContact O-CG1 3.27Å; Q209-I213 WeakPolarHBondContact O-CG1 3.25Å; Q209-I213 PolarHBondContact O-N 3Å; I213-A215 VanDerWaalsContact C-N 3.35Å; I213-T217 PolarHBondContact O-N 3.2Å; I213-T217 VanDerWaalsContact O-N 3.16Å; I213-A224 HydrophobicContact CG2-CB 3.54Å
214R68.9Low71Confident140 Ų14098.7 Ų98.753%0.52849%0.487SS..Hα-helixtrans-65.8-35.5176.4-74.5179.2177.3-173.8-2113V210 R211 R212V210-R214 WeakPolarHBondContact O-CG 3.41Å; V210-R214 PolarHBondContact O-N 2.94Å; V210-R214 VanDerWaalsContact O-N 3.13Å; R211-R214 PolarHBondContact O-N 2.99Å; R212-R214 VanDerWaalsContact C-N 3.31Å; R212-R214 PolarHBondContact O-N 2.96Å
215A75.9Confident70Confident83 Ų8393.4 Ų93.469%0.68647%0.474SS*.Hα-helixtrans-73.5-37.8179.600000112.8R211 R212 I213R211-A215 PolarHBondContact O-N 3.45Å; R212-A215 PolarHBondContact O-N 2.94Å; R212-A215 VanDerWaalsContact O-N 3.16Å; I213-A215 VanDerWaalsContact C-N 3.35Å
216T73.6Confident69.1Low115 Ų11593.9 Ų93.971%0.70648%0.482SS*.Hα-helixtrans-88.7-25.8-173.9-46.70000113.7R212R212-T216 PolarHBondContact O-N 3.13Å; R212-T216 PolarHBondContact O-OG1 3.08Å; R212-T216 VanDerWaalsContact O-OG1 3.12Å
217T70.4Confident68.5Low54 Ų5495.2 Ų95.233%0.33149%0.493SS..  trans-139.677.4-175.2-29.60000113.2I213 S219 F220I213-T217 PolarHBondContact O-N 3.2Å; I213-T217 VanDerWaalsContact O-N 3.16Å; T217-S219 VanDerWaalsContact C-N 3.29Å; T217-S219 PolarHBondContact O-N 2.84Å; T217-F220 HydrophobicContact CG2-CB 4.03Å; T217-F220 HydrophobicContact CG2-CD2 3.83Å; T217-F220 HydrophobicContact CG2-CG 4.34Å; T217-F220 PolarHBondContact O-N 3.1Å
218P65.3Low67.7Low100 Ų10089.6 Ų89.665%0.64948%0.475SS*.G310 helixtrans-63.6-29.7-178.122.1-31.3000113.7F220 A221P218-F220 VanDerWaalsContact C-N 3.27Å; P218-F220 PolarHBondContact O-N 3.1Å; P218-A221 WeakPolarHBondContact O-CB 3.18Å; P218-A221 PolarHBondContact O-N 2.8Å
219S65.7Low66.7Low108 Ų10888 Ų8876%0.75548%0.478SS*.G310 helixtrans-67.3-23177.756.20000113.9T217T217-S219 VanDerWaalsContact C-N 3.29Å; T217-S219 PolarHBondContact O-N 2.84Å
220F62.3Low66.1Low132 Ų13291.8 Ų91.858%0.57949%0.488SS*.G310 helixtrans-95.17.8176.2-91.1-93.2000113.5T217 P218 R222 S223 A224T217-F220 HydrophobicContact CG2-CB 4.03Å; T217-F220 HydrophobicContact CG2-CD2 3.83Å; T217-F220 HydrophobicContact CG2-CG 4.34Å; T217-F220 PolarHBondContact O-N 3.1Å; P218-F220 VanDerWaalsContact C-N 3.27Å; P218-F220 PolarHBondContact O-N 3.1Å; F220-R222 PolarHBondContact O-N 2.81Å; F220-S223 PolarHBondContact O-N 3.43Å; F220-A224 WeakPolarHBondContact O-CB 3.43Å; F220-A224 PolarHBondContact O-N 3.37Å
221A60.2Low65.8Low42 Ų4295.3 Ų95.335%0.34750%0.503SS..Hα-helixtrans-51-38.3-173.300000113.9P218 T225P218-A221 WeakPolarHBondContact O-CB 3.18Å; P218-A221 PolarHBondContact O-N 2.8Å; A221-T225 VanDerWaalsContact O-CB 3.25Å; A221-T225 WeakPolarHBondContact O-CB 3.35Å; A221-T225 PolarHBondContact O-N 3.42Å; A221-T225 PolarHBondContact O-OG1 2.85Å
222R62Low65.2Low233 Ų23392.2 Ų92.288%0.87950%0.496SS*.Hα-helixtrans-67.3-44.4176.2-106.6174.478.2159.81.1113.3F220 T225 A226F220-R222 PolarHBondContact O-N 2.81Å; R222-T225 PolarHBondContact O-N 3.3Å; R222-A226 PolarHBondContact O-N 3.41Å; R222-A226 VanDerWaalsContact O-N 3.15Å
223S62Low64.6Low70 Ų7091.1 Ų91.149%0.4950%0.495SS..Hα-helixtrans-73.8-38.4-180-160.90000111.7F220 A226 A227F220-S223 PolarHBondContact O-N 3.43Å; S223-A226 PolarHBondContact O-N 3.43Å; S223-A227 PolarHBondContact O-N 3.48Å
224A60.6Low64.1Low11 Ų1190.2 Ų90.29%0.09150%0.498CS..Hα-helixtrans-57.6-50.1169.400000110.4I213 F220 A226 A227 V228I213-A224 HydrophobicContact CG2-CB 3.54Å; F220-A224 WeakPolarHBondContact O-CB 3.43Å; F220-A224 PolarHBondContact O-N 3.37Å; A224-A226 VanDerWaalsContact C-N 3.26Å; A224-A226 PolarHBondContact O-N 3.25Å; A224-A227 CarbonylContact O-C 3.48Å; A224-A227 WeakPolarHBondContact O-CA 3.3Å; A224-A227 WeakPolarHBondContact O-CB 3.28Å; A224-A227 PolarHBondContact O-N 3.41Å; A224-V228 WeakPolarHBondContact O-CG2 3.41Å; A224-V228 PolarHBondContact O-N 2.84Å
225T62.2Low64Low63 Ų6384.6 Ų84.639%0.38748%0.48SS..Hα-helixtrans-59.5-34.5178.5-560000112.6A221 R222 A229A221-T225 VanDerWaalsContact O-CB 3.25Å; A221-T225 WeakPolarHBondContact O-CB 3.35Å; A221-T225 PolarHBondContact O-N 3.42Å; A221-T225 PolarHBondContact O-OG1 2.85Å; R222-T225 PolarHBondContact O-N 3.3Å; T225-A229 WeakPolarHBondContact O-CB 3.46Å; T225-A229 PolarHBondContact O-N 2.82Å
226A61.8Low63.7Low47 Ų4783.7 Ų83.739%0.38847%0.466SS..Hα-helixtrans-73.8-31.9173.700000113.8R222 S223 A224 R230R222-A226 PolarHBondContact O-N 3.41Å; R222-A226 VanDerWaalsContact O-N 3.15Å; S223-A226 PolarHBondContact O-N 3.43Å; A224-A226 VanDerWaalsContact C-N 3.26Å; A224-A226 PolarHBondContact O-N 3.25Å; A226-R230 PolarHBondContact O-N 3.22Å; A226-R230 PolarHBondContact O-NE 3.3Å
227A60.4Low63.5Low44 Ų4479.1 Ų79.136%0.36444%0.438SS..Hα-helixtrans-68.1-43.7169.600000110.9S223 A224 A229 R230 E231S223-A227 PolarHBondContact O-N 3.48Å; A224-A227 CarbonylContact O-C 3.48Å; A224-A227 WeakPolarHBondContact O-CA 3.3Å; A224-A227 WeakPolarHBondContact O-CB 3.28Å; A224-A227 PolarHBondContact O-N 3.41Å; A227-A229 PolarHBondContact O-N 2.81Å; A227-R230 WeakPolarHBondContact O-CB 3.18Å; A227-R230 PolarHBondContact O-N 3.36Å; A227-R230 VanDerWaalsContact O-N 3.13Å; A227-E231 PolarHBondContact O-N 2.92Å
228V59.9Low63.6Low28 Ų2877.7 Ų77.717%0.1743%0.427CS..Hα-helixtrans-59.2-44.5173.4175.50000111.9V210 A224 R230 E231 H232V210-V228 HydrophobicContact CB-CG1 4.4Å; V210-V228 HydrophobicContact CB-CG2 4.03Å; V210-V228 HydrophobicContact CG1-CG1 4.05Å; V210-V228 HydrophobicContact CG1-CG2 3.75Å; V210-V228 HydrophobicContact CG2-CB 4Å; V210-V228 HydrophobicContact CG2-CG1 3.46Å; V210-V228 VanDerWaalsContact CG2-CG1 3.46Å; V210-V228 HydrophobicContact CG2-CG2 3.41Å; V210-V228 VanDerWaalsContact CG2-CG2 3.41Å; A224-V228 WeakPolarHBondContact O-CG2 3.41Å; A224-V228 PolarHBondContact O-N 2.84Å; V228-R230 VanDerWaalsContact C-N 3.26Å; V228-R230 PolarHBondContact O-N 2.93Å; V228-E231 PolarHBondContact O-N 2.97Å; V228-H232 VanDerWaalsContact O-CB 3.27Å; V228-H232 WeakPolarHBondContact O-CB 3.29Å; V228-H232 PolarHBondContact O-N 3.19Å
229A60.5Low64.1Low60 Ų6075.4 Ų75.450%0.49642%0.417SS..Hα-helixtrans-63.1-34.3177.400000112T225 A227 K233T225-A229 WeakPolarHBondContact O-CB 3.46Å; T225-A229 PolarHBondContact O-N 2.82Å; A227-A229 PolarHBondContact O-N 2.81Å; A229-K233 WeakPolarHBondContact O-CB 3.28Å; A229-K233 PolarHBondContact O-N 2.86Å; A229-K233 VanDerWaalsContact O-N 3.1Å
230R60.6Low64.9Low175 Ų17571.8 Ų71.866%0.6639%0.394SS*.Hα-helixtrans-70.3-41.2174-80.6-178.9-79.1-164.7-0.8112.3A226 A227 V228 K233 A234A226-R230 PolarHBondContact O-N 3.22Å; A226-R230 PolarHBondContact O-NE 3.3Å; A227-R230 WeakPolarHBondContact O-CB 3.18Å; A227-R230 PolarHBondContact O-N 3.36Å; A227-R230 VanDerWaalsContact O-N 3.13Å; V228-R230 VanDerWaalsContact C-N 3.26Å; V228-R230 PolarHBondContact O-N 2.93Å; R230-K233 PolarHBondContact O-N 2.91Å; R230-A234 PolarHBondContact O-N 3.49Å
231E63Low65.8Low95 Ų9566.5 Ų66.544%0.44437%0.372SS..Hα-helixtrans-67.2-43.5173.9-80.1-169.7150.400112.4A227 V228 K233 A234 T235A227-E231 PolarHBondContact O-N 2.92Å; V228-E231 PolarHBondContact O-N 2.97Å; E231-K233 PolarHBondContact O-N 2.97Å; E231-A234 WeakPolarHBondContact O-CA 3.39Å; E231-A234 WeakPolarHBondContact O-CB 3.31Å; E231-A234 PolarHBondContact O-N 3.38Å; E231-T235 PolarHBondContact O-N 2.98Å; E231-T235 PolarHBondContact O-OG1 3.37Å
232H63.6Low67.1Low114 Ų11465.4 Ų65.453%0.52836%0.361SS..Hα-helixtrans-56.5-41.3174.4-172.6-92.4000111V228 A234 T235 V236V228-H232 VanDerWaalsContact O-CB 3.27Å; V228-H232 WeakPolarHBondContact O-CB 3.29Å; V228-H232 PolarHBondContact O-N 3.19Å; H232-A234 VanDerWaalsContact C-N 3.33Å; H232-A234 PolarHBondContact O-N 2.93Å; H232-T235 PolarHBondContact O-N 2.9Å; H232-V236 WeakPolarHBondContact O-CB 3.34Å; H232-V236 VanDerWaalsContact O-CG2 3.24Å; H232-V236 WeakPolarHBondContact O-CG2 3.42Å; H232-V236 PolarHBondContact O-N 3.45Å
233K64.9Low68.4Low129 Ų12955.6 Ų55.656%0.56133%0.332SS*.Hα-helixtrans-63.3-37.3175.4-168.3169.5-173.9164.30112.8A229 R230 E231 T237A229-K233 WeakPolarHBondContact O-CB 3.28Å; A229-K233 PolarHBondContact O-N 2.86Å; A229-K233 VanDerWaalsContact O-N 3.1Å; R230-K233 PolarHBondContact O-N 2.91Å; E231-K233 PolarHBondContact O-N 2.97Å; K233-T237 PolarHBondContact O-N 3.45Å; K233-T237 VanDerWaalsContact O-N 3.15Å; K233-T237 PolarHBondContact O-OG1 2.67Å
234A62.7Low69.8Low52 Ų5253 Ų5343%0.4331%0.314SS..Hα-helixtrans-69.7-36.2174.600000112.3R230 E231 H232 T237 L238R230-A234 PolarHBondContact O-N 3.49Å; E231-A234 WeakPolarHBondContact O-CA 3.39Å; E231-A234 WeakPolarHBondContact O-CB 3.31Å; E231-A234 PolarHBondContact O-N 3.38Å; H232-A234 VanDerWaalsContact C-N 3.33Å; H232-A234 PolarHBondContact O-N 2.93Å; A234-T237 VanDerWaalsContact O-CB 3.24Å; A234-T237 WeakPolarHBondContact O-CB 3.26Å; A234-T237 PolarHBondContact O-N 3.46Å; A234-L238 PolarHBondContact O-N 3.09Å
235T66.6Low71.2Confident22 Ų2252.6 Ų52.614%0.13531%0.311CS..Hα-helixtrans-69.7-40.2174.4-55.80000112I202 E231 H232 T237 L238 A239I202-T235 HydrophobicContact CG2-CG2 4.23Å; E231-T235 PolarHBondContact O-N 2.98Å; E231-T235 PolarHBondContact O-OG1 3.37Å; H232-T235 PolarHBondContact O-N 2.9Å; T235-T237 VanDerWaalsContact C-N 3.26Å; T235-T237 PolarHBondContact O-N 3.46Å; T235-L238 PolarHBondContact O-N 2.75Å; T235-L238 VanDerWaalsContact O-N 3.12Å; T235-A239 PolarHBondContact O-N 3.02Å
236V70.3Confident72.7Confident64 Ų6452 Ų5239%0.38831%0.305SS..Hα-helixtrans-59.2-38.7174.4168.60000111.4H232 L238 A239 A240H232-V236 WeakPolarHBondContact O-CB 3.34Å; H232-V236 VanDerWaalsContact O-CG2 3.24Å; H232-V236 WeakPolarHBondContact O-CG2 3.42Å; H232-V236 PolarHBondContact O-N 3.45Å; V236-L238 VanDerWaalsContact C-N 3.31Å; V236-L238 PolarHBondContact O-N 3.27Å; V236-A239 PolarHBondContact O-N 2.85Å; V236-A240 WeakPolarHBondContact O-CB 3.41Å; V236-A240 PolarHBondContact O-N 2.92Å
237T69.3Low74.3Confident19 Ų1955.1 Ų55.112%0.11731%0.314CS..Hα-helixtrans-54.3-48.5174.1-550000111.7K233 A234 T235 V241 F293K233-T237 PolarHBondContact O-N 3.45Å; K233-T237 VanDerWaalsContact O-N 3.15Å; K233-T237 PolarHBondContact O-OG1 2.67Å; A234-T237 VanDerWaalsContact O-CB 3.24Å; A234-T237 WeakPolarHBondContact O-CB 3.26Å; A234-T237 PolarHBondContact O-N 3.46Å; T235-T237 VanDerWaalsContact C-N 3.26Å; T235-T237 PolarHBondContact O-N 3.46Å; T237-V241 WeakPolarHBondContact O-CG2 3.39Å; T237-V241 PolarHBondContact O-N 2.79Å; T237-F293 HydrophobicContact CG2-CB 3.15Å; T237-F293 HydrophobicContact CG2-CG 4.15Å; T237-F293 WeakPolarHBondContact OG1-CB 3.29Å; T237-F293 PolarHBondContact OG1-O 3.39Å
238L71.2Confident76Confident23 Ų2353.1 Ų53.112%0.1230%0.297CS..Hα-helixtrans-78.6-34.6-174.1-57.2172.1000112.2R104 I108 Y199 A234 T235 V236 A240 V241 L242R104-L238 HydrophobicContact CB-CD1 3.84Å; R104-L238 HydrophobicContact CG-CD1 3.86Å; R104-L238 HydrophobicContact CG-CD2 3.83Å; I108-L238 HydrophobicContact CD1-CD1 4.46Å; Y199-L238 HydrophobicContact CD1-CB 4.42Å; Y199-L238 HydrophobicContact CE1-CB 3.42Å; Y199-L238 VanDerWaalsContact CE1-CB 3.42Å; Y199-L238 HydrophobicContact CE1-CD1 4.32Å; Y199-L238 HydrophobicContact CE1-CG 4.45Å; A234-L238 PolarHBondContact O-N 3.09Å; T235-L238 PolarHBondContact O-N 2.75Å; T235-L238 VanDerWaalsContact O-N 3.12Å; V236-L238 VanDerWaalsContact C-N 3.31Å; V236-L238 PolarHBondContact O-N 3.27Å; L238-A240 VanDerWaalsContact C-N 3.31Å; L238-V241 PolarHBondContact O-N 2.86Å; L238-L242 PolarHBondContact O-N 3.04Å
239A77.6Confident77.7Confident53 Ų5352 Ų5244%0.43829%0.29SS..Hα-helixtrans-63.1-37.8171.700000111.7T235 V236 L242 G243T235-A239 PolarHBondContact O-N 3.02Å; V236-A239 PolarHBondContact O-N 2.85Å; A239-L242 PolarHBondContact O-N 2.87Å; A239-G243 PolarHBondContact O-N 3.41Å
240A80.9Confident79.4Confident32 Ų3253.7 Ų53.726%0.26429%0.286SS..Hα-helixtrans-65-41.9174.600000112.1V236 L238 G243 A244 F293V236-A240 WeakPolarHBondContact O-CB 3.41Å; V236-A240 PolarHBondContact O-N 2.92Å; L238-A240 VanDerWaalsContact C-N 3.31Å; A240-G243 PolarHBondContact O-N 3.39Å; A240-A244 WeakPolarHBondContact O-CB 2.99Å; A240-A244 PolarHBondContact O-N 3.02Å; A240-F293 HydrophobicContact CB-CD2 4.25Å; A240-F293 HydrophobicContact CB-CE1 4.43Å; A240-F293 HydrophobicContact CB-CE2 3.68Å; A240-F293 HydrophobicContact CB-CZ 3.79Å
241V82.4Confident81.1Confident20 Ų2047.4 Ų47.412%0.12127%0.268CS..Hα-helixtrans-63.9-43.7175.6174.30000111.4L97 T237 L238 A244 F245 L289L97-V241 HydrophobicContact CD2-CG1 4.31Å; T237-V241 WeakPolarHBondContact O-CG2 3.39Å; T237-V241 PolarHBondContact O-N 2.79Å; L238-V241 PolarHBondContact O-N 2.86Å; V241-A244 PolarHBondContact O-N 3.08Å; V241-F245 WeakPolarHBondContact O-CB 3.49Å; V241-F245 PolarHBondContact O-N 3.34Å; V241-L289 HydrophobicContact CG2-CB 4.11Å; V241-L289 HydrophobicContact CG2-CD1 4.29Å
242L85.9Confident82.6Confident20 Ų2044.1 Ų44.111%0.10525%0.252CS..Hα-helixtrans-62.9-43.8174.2-179.468.8000111.9M195 Y199 L238 A239 F245 I246M195-L242 HydrophobicContact CB-CD1 3.85Å; M195-L242 HydrophobicContact SD-CD1 4.27Å; Y199-L242 HydrophobicContact CD2-CB 4.11Å; Y199-L242 HydrophobicContact CD2-CD1 4.09Å; Y199-L242 HydrophobicContact CD2-CD2 3.29Å; Y199-L242 HydrophobicContact CD2-CG 4Å; Y199-L242 HydrophobicContact CE2-CB 3.74Å; Y199-L242 HydrophobicContact CE2-CD1 3.92Å; Y199-L242 HydrophobicContact CE2-CD2 3.81Å; Y199-L242 HydrophobicContact CE2-CG 4.01Å; Y199-L242 HydrophobicContact CG-CD2 3.93Å; L238-L242 PolarHBondContact O-N 3.04Å; A239-L242 PolarHBondContact O-N 2.87Å; L242-F245 WeakPolarHBondContact O-CB 3.43Å; L242-F245 PolarHBondContact O-N 3.25Å; L242-I246 HydrophobicContact CD1-CD1 4.28Å; L242-I246 HydrophobicContact CD1-CG1 4.48Å; L242-I246 HydrophobicContact CD2-CD1 4.35Å; L242-I246 HydrophobicContact CG-CD1 3.92Å; L242-I246 HydrophobicContact CG-CG1 4.48Å; L242-I246 WeakPolarHBondContact O-CG1 3.04Å; L242-I246 PolarHBondContact O-N 2.03Å
243G89.4Confident84.1Confident27 Ų2738.8 Ų38.828%0.27823%0.227SC..Hα-helixtrans-60.9-45.6178.900000111.8A239 A240 F245 I246 I247A239-G243 PolarHBondContact O-N 3.41Å; A240-G243 PolarHBondContact O-N 3.39Å; G243-F245 VanDerWaalsContact C-N 3.34Å; G243-F245 PolarHBondContact O-N 2.96Å; G243-I246 PolarHBondContact O-N 3.41Å; G243-I247 WeakPolarHBondContact O-CB 3.24Å; G243-I247 WeakPolarHBondContact O-CD1 3.25Å; G243-I247 VanDerWaalsContact O-CG1 3.26Å; G243-I247 WeakPolarHBondContact O-CG1 3.49Å; G243-I247 PolarHBondContact O-N 3.32Å
244A91.5Very high85.5Confident14 Ų1434.1 Ų34.112%0.11621%0.211CC..Hα-helixtrans-59.2-45174.300000111.6A240 V241 I246 I247 C248 L285 L289A240-A244 WeakPolarHBondContact O-CB 2.99Å; A240-A244 PolarHBondContact O-N 3.02Å; V241-A244 PolarHBondContact O-N 3.08Å; A244-I246 PolarHBondContact O-N 3.1Å; A244-I247 PolarHBondContact O-N 3.09Å; A244-C248 WeakPolarHBondContact O-CB 3.48Å; A244-C248 PolarHBondContact O-N 3.12Å; A244-C248 PolarHBondContact O-SG 3.43Å; A244-L285 HydrophobicContact CB-CD1 4.32Å; A244-L289 HydrophobicContact CB-CD1 3.65Å
245F91.4Very high86.8Confident3 Ų333 Ų331%0.01320%0.195CC..Hα-helixtrans-57-48.1175.6173.2-98.9000112.6I94 L97 F188 L192 M195 V241 L242 G243 C248 W249I94-F245 HydrophobicContact CB-CE2 4.37Å; I94-F245 HydrophobicContact CB-CZ 4.4Å; I94-F245 HydrophobicContact CG1-CE2 3.79Å; I94-F245 HydrophobicContact CG1-CZ 4Å; I94-F245 HydrophobicContact CG2-CE2 4.26Å; I94-F245 HydrophobicContact CG2-CZ 3.83Å; L97-F245 HydrophobicContact CD1-CD2 3.35Å; L97-F245 HydrophobicContact CD1-CE2 3.81Å; L97-F245 HydrophobicContact CD1-CG 4.16Å; F188-F245 HydrophobicContact CD2-CE1 4.27Å; F188-F245 AromaticContact CD2-CZ 3.94Å; F188-F245 HydrophobicContact CD2-CZ 3.94Å; F188-F245 AromaticContact CE2-CE1 3.73Å; F188-F245 HydrophobicContact CE2-CE1 3.73Å; F188-F245 AromaticContact CE2-CZ 3.75Å; F188-F245 HydrophobicContact CE2-CZ 3.75Å; L192-F245 HydrophobicContact CD1-CD1 4.5Å; L192-F245 HydrophobicContact CD1-CE1 4.33Å; M195-F245 HydrophobicContact CE-CD1 3.8Å; M195-F245 HydrophobicContact CE-CE1 3.35Å; M195-F245 HydrophobicContact CE-CZ 3.91Å; V241-F245 WeakPolarHBondContact O-CB 3.49Å; V241-F245 PolarHBondContact O-N 3.34Å; L242-F245 WeakPolarHBondContact O-CB 3.43Å; L242-F245 PolarHBondContact O-N 3.25Å; G243-F245 VanDerWaalsContact C-N 3.34Å; G243-F245 PolarHBondContact O-N 2.96Å; F245-C248 PolarHBondContact O-N 2.9Å; F245-W249 AromaticContact CD2-CD1 3.48Å; F245-W249 VanDerWaalsContact CD2-CD1 3.48Å; F245-W249 HydrophobicContact CD2-CG 4.34Å; F245-W249 HydrophobicContact CE2-CB 4.28Å; F245-W249 AromaticContact CE2-CD1 3.36Å; F245-W249 AromaticContact CE2-CG 3.92Å; F245-W249 HydrophobicContact CE2-CG 3.92Å; F245-W249 HydrophobicContact CZ-CB 4.33Å; F245-W249 HydrophobicContact CZ-CG 4.39Å; F245-W249 WeakPolarHBondContact O-CB 3.36Å; F245-W249 PolarHBondContact O-N 3.02Å
246I94.1Very high88Confident52 Ų5232.1 Ų32.127%0.26719%0.19SC..Hα-helixtrans-62.2-48.2179.1-68.4169.2000110.7L192 L242 G243 A244 C248 W249 F250L192-I246 HydrophobicContact CD1-CD1 3.82Å; L192-I246 HydrophobicContact CD1-CG1 3.51Å; L242-I246 HydrophobicContact CD1-CD1 4.28Å; L242-I246 HydrophobicContact CD1-CG1 4.48Å; L242-I246 HydrophobicContact CD2-CD1 4.35Å; L242-I246 HydrophobicContact CG-CD1 3.92Å; L242-I246 HydrophobicContact CG-CG1 4.48Å; L242-I246 WeakPolarHBondContact O-CG1 3.04Å; L242-I246 PolarHBondContact O-N 2.03Å; G243-I246 PolarHBondContact O-N 3.41Å; A244-I246 PolarHBondContact O-N 3.1Å; I246-C248 PolarHBondContact O-N 2.72Å; I246-W249 PolarHBondContact O-N 3.08Å; I246-F250 HydrophobicContact CG2-CB 4.12Å; I246-F250 WeakPolarHBondContact O-CB 3.3Å; I246-F250 PolarHBondContact O-N 2.97Å
247I95.2Very high89Confident112 Ų11230 Ų3057%0.57418%0.177SC*.Hα-helixtrans-59.9-38.6-179.5-70165.6000110.9G243 A244 P251G243-I247 WeakPolarHBondContact O-CB 3.24Å; G243-I247 WeakPolarHBondContact O-CD1 3.25Å; G243-I247 VanDerWaalsContact O-CG1 3.26Å; G243-I247 WeakPolarHBondContact O-CG1 3.49Å; G243-I247 PolarHBondContact O-N 3.32Å; A244-I247 PolarHBondContact O-N 3.09Å; I247-P251 WeakPolarHBondContact O-CD 3.11Å; I247-P251 WeakPolarHBondContact O-CG 3.38Å
248C95.6Very high89.9Confident2 Ų232.5 Ų32.51%0.01419%0.194CC..Hα-helixtrans-75.1-47.1-178.8-64.30000112.6A244 F245 I246 L278 G279 N282A244-C248 WeakPolarHBondContact O-CB 3.48Å; A244-C248 PolarHBondContact O-N 3.12Å; A244-C248 PolarHBondContact O-SG 3.43Å; F245-C248 PolarHBondContact O-N 2.9Å; I246-C248 PolarHBondContact O-N 2.72Å; C248-L278 VanDerWaalsContact CB-O 3.25Å; C248-L278 WeakPolarHBondContact CB-O 3.4Å; C248-L278 CarbonylContact O-C 3.42Å; C248-G279 WeakPolarHBondContact O-CA 3.27Å; C248-G279 PolarHBondContact O-N 3.44Å; C248-N282 HydrophobicContact CB-CB 3.68Å
249W95.6Very high90.5Very high5 Ų532.8 Ų32.82%0.01920%0.196CC..Hα-helixtrans-97.8-31.7-167.4-79.5105.3000115.1C90 F188 F245 I246 P251 Y252 F253 N282C90-W249 HydrophobicContact CB-CH2 3.55Å; C90-W249 HydrophobicContact CB-CZ2 3.97Å; C90-W249 HydrophobicContact CB-CZ3 4.43Å; C90-W249 WeakPolarHBondContact SG-CH2 3.14Å; F188-W249 HydrophobicContact CD2-CB 4.18Å; F188-W249 HydrophobicContact CE2-CB 3.52Å; F188-W249 HydrophobicContact CZ-CB 4.22Å; F245-W249 AromaticContact CD2-CD1 3.48Å; F245-W249 VanDerWaalsContact CD2-CD1 3.48Å; F245-W249 HydrophobicContact CD2-CG 4.34Å; F245-W249 HydrophobicContact CE2-CB 4.28Å; F245-W249 AromaticContact CE2-CD1 3.36Å; F245-W249 AromaticContact CE2-CG 3.92Å; F245-W249 HydrophobicContact CE2-CG 3.92Å; F245-W249 HydrophobicContact CZ-CB 4.33Å; F245-W249 HydrophobicContact CZ-CG 4.39Å; F245-W249 WeakPolarHBondContact O-CB 3.36Å; F245-W249 PolarHBondContact O-N 3.02Å; I246-W249 PolarHBondContact O-N 3.08Å; W249-P251 VanDerWaalsContact C-CD 3.5Å; W249-Y252 HydrophobicContact CE3-CD1 4.09Å; W249-Y252 AromaticContact CZ3-CD1 3.85Å; W249-Y252 HydrophobicContact CZ3-CD1 3.85Å; W249-Y252 HydrophobicContact CZ3-CE1 4.34Å; W249-Y252 HydrophobicContact CZ3-CG 4.43Å; W249-Y252 PolarHBondContact O-N 3.36Å; W249-F253 HydrophobicContact CB-CD2 4.15Å; W249-F253 HydrophobicContact CB-CE2 4.32Å; W249-F253 AromaticContact CD2-CE2 3.98Å; W249-F253 HydrophobicContact CD2-CE2 3.98Å; W249-F253 AromaticContact CE3-CD2 3.79Å; W249-F253 HydrophobicContact CE3-CD2 3.79Å; W249-F253 AromaticContact CE3-CE2 3.28Å; W249-F253 HydrophobicContact CE3-CE2 3.28Å; W249-F253 HydrophobicContact CE3-CZ 4.24Å; W249-F253 HydrophobicContact CG-CE2 4.45Å; W249-F253 AromaticContact CZ3-CE2 3.89Å; W249-F253 HydrophobicContact CZ3-CE2 3.89Å; W249-F253 HydrophobicContact CZ3-CZ 4.44Å; W249-F253 WeakPolarHBondContact O-CD2 3.38Å; W249-F253 PolarHBondContact O-N 3.1Å; W249-N282 PolarHBondContact NE1-ND2 3.34Å
250F95.8Very high90.8Very high94 Ų9430.2 Ų30.241%0.41218%0.175SC..Hα-helixtrans-58.1-41.1-177.4-174.3-91000113.4F188 Y189 L192 I246 S254F188-F250 AromaticContact CE1-CD2 3.98Å; F188-F250 HydrophobicContact CE1-CD2 3.98Å; F188-F250 HydrophobicContact CZ-CB 4Å; F188-F250 HydrophobicContact CZ-CD2 4.14Å; Y189-F250 HydrophobicContact CE1-CE2 4.19Å; L192-F250 HydrophobicContact CD2-CD2 4.18Å; I246-F250 HydrophobicContact CG2-CB 4.12Å; I246-F250 WeakPolarHBondContact O-CB 3.3Å; I246-F250 PolarHBondContact O-N 2.97Å; F250-S254 WeakPolarHBondContact CE1-OG 3.38Å; F250-S254 VanDerWaalsContact O-CB 3.3Å; F250-S254 WeakPolarHBondContact O-CB 3.42Å; F250-S254 PolarHBondContact O-N 2.94Å; F250-S254 PolarHBondContact O-OG 3.47Å
251P96.4Very high91Very high44 Ų4432.8 Ų32.829%0.28619%0.187SC..Hα-helixtrans-61.6-44.6176.1-24.837.1000112.7I247 W249 S254 Y255 V275 L278I247-P251 WeakPolarHBondContact O-CD 3.11Å; I247-P251 WeakPolarHBondContact O-CG 3.38Å; W249-P251 VanDerWaalsContact C-CD 3.5Å; P251-S254 PolarHBondContact O-N 2.76Å; P251-Y255 WeakPolarHBondContact O-CB 3.46Å; P251-Y255 PolarHBondContact O-N 2.94Å; P251-V275 HydrophobicContact CB-CB 4.38Å; P251-V275 HydrophobicContact CB-CG1 3.96Å; P251-L278 HydrophobicContact CB-CD2 4.31Å; P251-L278 HydrophobicContact CG-CD2 3.89Å
252Y94.7Very high90.8Very high26 Ų2638 Ų3810%0.10221%0.208CC..Hα-helixtrans-63.2-50.3179.2178.1-97.6000111.7W249 S254 Y255 F256 V275 L276W249-Y252 HydrophobicContact CE3-CD1 4.09Å; W249-Y252 AromaticContact CZ3-CD1 3.85Å; W249-Y252 HydrophobicContact CZ3-CD1 3.85Å; W249-Y252 HydrophobicContact CZ3-CE1 4.34Å; W249-Y252 HydrophobicContact CZ3-CG 4.43Å; W249-Y252 PolarHBondContact O-N 3.36Å; Y252-S254 VanDerWaalsContact C-N 3.3Å; Y252-S254 PolarHBondContact O-N 3.11Å; Y252-Y255 WeakPolarHBondContact O-CB 3.25Å; Y252-Y255 PolarHBondContact O-N 3.46Å; Y252-Y255 VanDerWaalsContact O-N 3.16Å; Y252-F256 HydrophobicContact CE1-CB 4.35Å; Y252-F256 HydrophobicContact CE1-CD2 4.12Å; Y252-F256 HydrophobicContact CE1-CG 4.48Å; Y252-F256 VanDerWaalsContact O-CB 3.29Å; Y252-F256 WeakPolarHBondContact O-CB 3.5Å; Y252-F256 PolarHBondContact O-N 3.46Å; Y252-V275 HydrophobicContact CD2-CG2 3.99Å; Y252-L276 HydrophobicContact CD2-CB 4.26Å; Y252-L276 HydrophobicContact CD2-CD1 4.11Å; Y252-L276 HydrophobicContact CE2-CB 4.29Å; Y252-L276 HydrophobicContact CE2-CD1 3.61Å
253F94.8Very high89.6Confident1 Ų144.2 Ų44.20%0.00424%0.236CC..Hα-helixtrans-67.1-31-179.4-81-77.8000113.2I94 Y183 A184 F188 Y189 W249 T257I94-F253 HydrophobicContact CD1-CE2 3.67Å; I94-F253 HydrophobicContact CD1-CZ 3.64Å; Y183-F253 HydrophobicContact CD1-CE1 4.47Å; Y183-F253 AromaticContact CE1-CE1 3.88Å; Y183-F253 HydrophobicContact CE1-CE1 3.88Å; A184-F253 HydrophobicContact CB-CD1 4.29Å; F188-F253 HydrophobicContact CB-CB 4.37Å; F188-F253 HydrophobicContact CB-CD1 3.52Å; F188-F253 HydrophobicContact CB-CD2 3.64Å; F188-F253 HydrophobicContact CB-CE1 3.54Å; F188-F253 HydrophobicContact CB-CE2 3.65Å; F188-F253 HydrophobicContact CB-CG 3.57Å; F188-F253 HydrophobicContact CB-CZ 3.62Å; F188-F253 HydrophobicContact CD1-CB 3.39Å; F188-F253 HydrophobicContact CD1-CD1 4.19Å; F188-F253 AromaticContact CD1-CD2 3.7Å; F188-F253 HydrophobicContact CD1-CD2 3.7Å; F188-F253 AromaticContact CD1-CG 3.5Å; F188-F253 HydrophobicContact CD1-CG 3.5Å; F188-F253 VanDerWaalsContact CD1-CG 3.5Å; F188-F253 AromaticContact CD2-CD2 3.26Å; F188-F253 HydrophobicContact CD2-CD2 3.26Å; F188-F253 AromaticContact CD2-CE2 3.46Å; F188-F253 HydrophobicContact CD2-CE2 3.46Å; F188-F253 VanDerWaalsContact CD2-CE2 3.46Å; F188-F253 AromaticContact CD2-CG 3.94Å; F188-F253 HydrophobicContact CD2-CG 3.94Å; F188-F253 HydrophobicContact CD2-CZ 4.28Å; F188-F253 HydrophobicContact CE1-CB 3.72Å; F188-F253 HydrophobicContact CE1-CD2 4.14Å; F188-F253 HydrophobicContact CE1-CG 4.14Å; F188-F253 AromaticContact CE2-CD2 3.77Å; F188-F253 HydrophobicContact CE2-CD2 3.77Å; F188-F253 HydrophobicContact CE2-CE2 4.24Å; F188-F253 HydrophobicContact CG-CB 3.85Å; F188-F253 AromaticContact CG-CD1 3.9Å; F188-F253 HydrophobicContact CG-CD1 3.9Å; F188-F253 AromaticContact CG-CD2 3.21Å; F188-F253 HydrophobicContact CG-CD2 3.21Å; F188-F253 HydrophobicContact CG-CE1 4.25Å; F188-F253 AromaticContact CG-CE2 3.62Å; F188-F253 HydrophobicContact CG-CE2 3.62Å; F188-F253 AromaticContact CG-CG 3.37Å; F188-F253 HydrophobicContact CG-CG 3.37Å; F188-F253 HydrophobicContact CG-CZ 4.13Å; F188-F253 HydrophobicContact CZ-CB 4.42Å; F188-F253 HydrophobicContact CZ-CD2 4.17Å; Y189-F253 PolarHBondContact OH-O 2.92Å; W249-F253 HydrophobicContact CB-CD2 4.15Å; W249-F253 HydrophobicContact CB-CE2 4.32Å; W249-F253 AromaticContact CD2-CE2 3.98Å; W249-F253 HydrophobicContact CD2-CE2 3.98Å; W249-F253 AromaticContact CE3-CD2 3.79Å; W249-F253 HydrophobicContact CE3-CD2 3.79Å; W249-F253 AromaticContact CE3-CE2 3.28Å; W249-F253 HydrophobicContact CE3-CE2 3.28Å; W249-F253 HydrophobicContact CE3-CZ 4.24Å; W249-F253 HydrophobicContact CG-CE2 4.45Å; W249-F253 AromaticContact CZ3-CE2 3.89Å; W249-F253 HydrophobicContact CZ3-CE2 3.89Å; W249-F253 HydrophobicContact CZ3-CZ 4.44Å; W249-F253 WeakPolarHBondContact O-CD2 3.38Å; W249-F253 PolarHBondContact O-N 3.1Å; F253-T257 VanDerWaalsContact O-CB 3.3Å; F253-T257 WeakPolarHBondContact O-CB 3.42Å; F253-T257 PolarHBondContact O-N 3.36Å; F253-T257 PolarHBondContact O-OG1 3.42Å
254S93.6Very high88Confident32 Ų3252.4 Ų52.422%0.22426%0.264CS..Hα-helixtrans-66.6-44.1171.8-57.40000111.3Y189 F250 P251 Y252 C258Y189-S254 WeakPolarHBondContact OH-CA 3.44Å; Y189-S254 PolarHBondContact OH-N 3.15Å; F250-S254 WeakPolarHBondContact CE1-OG 3.38Å; F250-S254 VanDerWaalsContact O-CB 3.3Å; F250-S254 WeakPolarHBondContact O-CB 3.42Å; F250-S254 PolarHBondContact O-N 2.94Å; F250-S254 PolarHBondContact O-OG 3.47Å; P251-S254 PolarHBondContact O-N 2.76Å; Y252-S254 VanDerWaalsContact C-N 3.3Å; Y252-S254 PolarHBondContact O-N 3.11Å; S254-C258 VanDerWaalsContact O-CB 3.32Å; S254-C258 WeakPolarHBondContact O-CB 3.28Å; S254-C258 PolarHBondContact O-N 2.95Å; S254-C258 PolarHBondContact O-SG 3.16Å
255Y91.3Very high86.3Confident27 Ų2754.9 Ų54.911%0.10628%0.278CS..Hα-helixtrans-60.4-51.2173.1174.2-89000111.4P251 Y252 T257 C258 M259 P267 L271 H272 V275P251-Y255 WeakPolarHBondContact O-CB 3.46Å; P251-Y255 PolarHBondContact O-N 2.94Å; Y252-Y255 WeakPolarHBondContact O-CB 3.25Å; Y252-Y255 PolarHBondContact O-N 3.46Å; Y252-Y255 VanDerWaalsContact O-N 3.16Å; Y255-T257 VanDerWaalsContact C-N 3.32Å; Y255-T257 PolarHBondContact O-N 3.3Å; Y255-C258 PolarHBondContact O-N 2.94Å; Y255-M259 HydrophobicContact CD1-CG 4.15Å; Y255-M259 HydrophobicContact CD2-CG 4.36Å; Y255-M259 HydrophobicContact CE1-CG 3.72Å; Y255-M259 HydrophobicContact CE2-CG 3.98Å; Y255-M259 HydrophobicContact CE2-SD 4.34Å; Y255-M259 HydrophobicContact CG-CG 4.44Å; Y255-M259 WeakPolarHBondContact O-CB 3.19Å; Y255-M259 WeakPolarHBondContact O-CG 3.34Å; Y255-M259 PolarHBondContact O-N 3.35Å; Y255-P267 HydrophobicContact CE2-CB 3.81Å; Y255-P267 HydrophobicContact CE2-CG 4.24Å; Y255-P267 WeakPolarHBondContact OH-CB 3.26Å; Y255-P267 WeakPolarHBondContact OH-CG 3.48Å; Y255-L271 HydrophobicContact CD2-CD2 3.91Å; Y255-L271 HydrophobicContact CD2-CG 4.05Å; Y255-L271 HydrophobicContact CE2-CD2 4.04Å; Y255-L271 HydrophobicContact CE2-CG 4.15Å; Y255-H272 HydrophobicContact CE1-CB 4.03Å; Y255-H272 AromaticContact CE1-CD2 3.54Å; Y255-V275 HydrophobicContact CD1-CG2 4.14Å; Y255-V275 HydrophobicContact CG-CG2 3.99Å
256F90.2Very high84.7Confident4 Ų462.7 Ų62.72%0.01832%0.32CS..Hα-helixtrans-53.2-47.5178.2-175.7-86.7000111.3F173 W175 V180 Y183 A184 Y252 M259 G260F173-F256 HydrophobicContact CD1-CE2 4.09Å; F173-F256 HydrophobicContact CD1-CZ 4.43Å; F173-F256 HydrophobicContact CE1-CE2 4.21Å; F173-F256 HydrophobicContact CE1-CZ 4.1Å; W175-F256 HydrophobicContact CE3-CD2 4.17Å; W175-F256 AromaticContact CE3-CE2 3.99Å; W175-F256 HydrophobicContact CE3-CE2 3.99Å; W175-F256 HydrophobicContact CE3-CZ 4.32Å; W175-F256 HydrophobicContact CH2-CB 4.33Å; W175-F256 AromaticContact CH2-CD2 3.28Å; W175-F256 HydrophobicContact CH2-CD2 3.28Å; W175-F256 AromaticContact CH2-CE2 3.66Å; W175-F256 HydrophobicContact CH2-CE2 3.66Å; W175-F256 HydrophobicContact CH2-CG 4Å; W175-F256 HydrophobicContact CZ3-CB 4.03Å; W175-F256 HydrophobicContact CZ3-CD1 4.1Å; W175-F256 AromaticContact CZ3-CD2 3.02Å; W175-F256 HydrophobicContact CZ3-CD2 3.02Å; W175-F256 HydrophobicContact CZ3-CE1 4.29Å; W175-F256 AromaticContact CZ3-CE2 3.19Å; W175-F256 HydrophobicContact CZ3-CE2 3.19Å; W175-F256 AromaticContact CZ3-CG 3.46Å; W175-F256 HydrophobicContact CZ3-CG 3.46Å; W175-F256 VanDerWaalsContact CZ3-CG 3.46Å; W175-F256 AromaticContact CZ3-CZ 3.85Å; W175-F256 HydrophobicContact CZ3-CZ 3.85Å; W175-F256 WeakPolarHBondContact CZ3-O 3.36Å; V180-F256 HydrophobicContact CB-CE1 3.93Å; V180-F256 HydrophobicContact CB-CZ 4.41Å; V180-F256 HydrophobicContact CG1-CD1 3.67Å; V180-F256 HydrophobicContact CG1-CE1 3.47Å; V180-F256 VanDerWaalsContact CG1-CE1 3.47Å; V180-F256 HydrophobicContact CG1-CZ 4.28Å; V180-F256 WeakPolarHBondContact CG1-O 3.35Å; V180-F256 HydrophobicContact CG2-CE1 3.96Å; V180-F256 HydrophobicContact CG2-CZ 3.95Å; Y183-F256 AromaticContact CD1-CE1 3.68Å; Y183-F256 HydrophobicContact CD1-CE1 3.68Å; Y183-F256 AromaticContact CD1-CZ 3.84Å; Y183-F256 HydrophobicContact CD1-CZ 3.84Å; Y183-F256 HydrophobicContact CE1-CE1 4.37Å; Y183-F256 HydrophobicContact CE1-CZ 4.32Å; A184-F256 HydrophobicContact CB-CD1 4.13Å; A184-F256 HydrophobicContact CB-CE1 4.41Å; Y252-F256 HydrophobicContact CE1-CB 4.35Å; Y252-F256 HydrophobicContact CE1-CD2 4.12Å; Y252-F256 HydrophobicContact CE1-CG 4.48Å; Y252-F256 VanDerWaalsContact O-CB 3.29Å; Y252-F256 WeakPolarHBondContact O-CB 3.5Å; Y252-F256 PolarHBondContact O-N 3.46Å; F256-M259 PolarHBondContact O-N 3.25Å; F256-G260 PolarHBondContact O-N 3.15Å
257T91.9Very high82.9Confident19 Ų1961.7 Ų61.712%0.11732%0.317CS..Hα-helixtrans-68.3-44.4178.9-54.90000112.2L181 A184 Y189 F253 Y255 M259 G260 V261L181-T257 HydrophobicContact CD2-CG2 4.02Å; A184-T257 WeakPolarHBondContact CB-OG1 3.3Å; Y189-T257 WeakPolarHBondContact CE2-OG1 3.34Å; Y189-T257 PolarHBondContact OH-OG1 3.18Å; F253-T257 VanDerWaalsContact O-CB 3.3Å; F253-T257 WeakPolarHBondContact O-CB 3.42Å; F253-T257 PolarHBondContact O-N 3.36Å; F253-T257 PolarHBondContact O-OG1 3.42Å; Y255-T257 VanDerWaalsContact C-N 3.32Å; Y255-T257 PolarHBondContact O-N 3.3Å; T257-M259 VanDerWaalsContact C-N 3.27Å; T257-M259 PolarHBondContact O-N 2.95Å; T257-G260 PolarHBondContact O-N 3.1Å; T257-V261 WeakPolarHBondContact O-CG2 3.13Å; T257-V261 PolarHBondContact O-N 2.84Å; T257-V261 VanDerWaalsContact O-N 3.1Å
258C89.1Confident81.7Confident72 Ų7260.5 Ų60.549%0.48632%0.316SS..Hα-helixtrans-60-40.6176.8-77.50000111.7S254 Y255 V261 K262S254-C258 VanDerWaalsContact O-CB 3.32Å; S254-C258 WeakPolarHBondContact O-CB 3.28Å; S254-C258 PolarHBondContact O-N 2.95Å; S254-C258 PolarHBondContact O-SG 3.16Å; Y255-C258 PolarHBondContact O-N 2.94Å; C258-V261 PolarHBondContact O-N 3.12Å; C258-K262 WeakPolarHBondContact O-CB 3.4Å; C258-K262 PolarHBondContact O-N 2.88Å
259M83.6Confident80.6Confident29 Ų2965.2 Ų65.214%0.14334%0.342CS..Hα-helixtrans-67.8-38.5177.6-72.6-50.5-54.200112.5W175 Y255 F256 T257 V261 P267W175-M259 HydrophobicContact CD2-CB 4.42Å; W175-M259 HydrophobicContact CE3-CB 4.29Å; W175-M259 HydrophobicContact CZ3-CB 4.29Å; Y255-M259 HydrophobicContact CD1-CG 4.15Å; Y255-M259 HydrophobicContact CD2-CG 4.36Å; Y255-M259 HydrophobicContact CE1-CG 3.72Å; Y255-M259 HydrophobicContact CE2-CG 3.98Å; Y255-M259 HydrophobicContact CE2-SD 4.34Å; Y255-M259 HydrophobicContact CG-CG 4.44Å; Y255-M259 WeakPolarHBondContact O-CB 3.19Å; Y255-M259 WeakPolarHBondContact O-CG 3.34Å; Y255-M259 PolarHBondContact O-N 3.35Å; F256-M259 PolarHBondContact O-N 3.25Å; T257-M259 VanDerWaalsContact C-N 3.27Å; T257-M259 PolarHBondContact O-N 2.95Å; M259-V261 VanDerWaalsContact C-N 3.29Å; M259-V261 PolarHBondContact O-N 3.36Å; M259-P267 VanDerWaalsContact CE-CD 3.42Å; M259-P267 HydrophobicContact CE-CG 3.57Å; M259-P267 HydrophobicContact SD-CB 3.89Å; M259-P267 HydrophobicContact SD-CG 3.54Å; M259-P267 VanDerWaalsContact SD-CG 3.54Å
260G83.6Confident80.1Confident0 Ų069.7 Ų69.70%037%0.37CS..Hα-helixtrans-75.4-8.9174.400000115.3N177 F256 T257N177-G260 WeakPolarHBondContact CA-O 3.47Å; N177-G260 WeakPolarHBondContact CB-O 3.29Å; N177-G260 PolarHBondContact OD1-O 3.25Å; F256-G260 PolarHBondContact O-N 3.15Å; T257-G260 PolarHBondContact O-N 3.1Å
261V84.6Confident79.8Confident86 Ų8669.2 Ų69.252%0.52137%0.371SS..Hα-helixtrans-104-31.8175.9177.10000111.9L181 T257 C258 M259 E263L181-V261 HydrophobicContact CD1-CG2 4.45Å; L181-V261 HydrophobicContact CD2-CG2 3.78Å; L181-V261 HydrophobicContact CG-CG2 4.33Å; T257-V261 WeakPolarHBondContact O-CG2 3.13Å; T257-V261 PolarHBondContact O-N 2.84Å; T257-V261 VanDerWaalsContact O-N 3.1Å; C258-V261 PolarHBondContact O-N 3.12Å; M259-V261 VanDerWaalsContact C-N 3.29Å; M259-V261 PolarHBondContact O-N 3.36Å; V261-E263 PolarHBondContact O-N 3.1Å
262K79.7Confident79.4Confident129 Ų12969 Ų6956%0.56137%0.366SS*.SBendtrans-87.6104.6178.3-69.7-172.5178.5-175.40110.5C258 K264 T265C258-K262 WeakPolarHBondContact O-CB 3.4Å; C258-K262 PolarHBondContact O-N 2.88Å; K262-K264 PolarHBondContact O-N 2.64Å; K262-T265 HydrophobicContact CD-CG2 4.46Å
263E60.6Low79.2Confident151 Ų15168.7 Ų68.771%0.70637%0.367SS*.THydrogen-bonded Turntrans-59.9123.2162.5-78.9-176.4174.400109.6V261V261-E263 PolarHBondContact O-N 3.1Å
264K55.2Low79.1Confident199 Ų19972.9 Ų72.987%0.86539%0.393SS*.THydrogen-bonded Turntrans68.748.8165.6-52.3176.6-177.7175.10117.3K262K262-K264 PolarHBondContact O-N 2.64Å
265T56Low79.1Confident65 Ų6571.9 Ų71.940%0.39939%0.385SS..  trans-105.9132.5153.250.70000109.6K262 P267K262-T265 HydrophobicContact CD-CG2 4.46Å; T265-P267 VanDerWaalsContact C-CD 3.5Å; T265-P267 WeakPolarHBondContact O-CD 3.35Å
266N56.3Low79.2Confident167 Ų16771.1 Ų71.189%0.89338%0.383SS*.  trans-85.791.8166.5-73.1-24.6000107.6
267P56.7Low79.5Confident32 Ų3271.5 Ų71.521%0.20839%0.385CS..  trans-63.2151.6175.729.9-38.9000109.5Y255 M259 T265 N269Y255-P267 HydrophobicContact CE2-CB 3.81Å; Y255-P267 HydrophobicContact CE2-CG 4.24Å; Y255-P267 WeakPolarHBondContact OH-CB 3.26Å; Y255-P267 WeakPolarHBondContact OH-CG 3.48Å; M259-P267 VanDerWaalsContact CE-CD 3.42Å; M259-P267 HydrophobicContact CE-CG 3.57Å; M259-P267 HydrophobicContact SD-CB 3.89Å; M259-P267 HydrophobicContact SD-CG 3.54Å; M259-P267 VanDerWaalsContact SD-CG 3.54Å; T265-P267 VanDerWaalsContact C-CD 3.5Å; T265-P267 WeakPolarHBondContact O-CD 3.35Å; P267-N269 PolarHBondContact O-N 3.04Å
268P69.8Low79.7Confident86 Ų8673.1 Ų73.156%0.55839%0.392SS*.  trans-59.9125.6172-1628.2000109.1T270 L271P268-T270 PolarHBondContact O-N 3.45Å; P268-L271 WeakPolarHBondContact O-CB 3.49Å; P268-L271 PolarHBondContact O-N 2.86Å
269N73.8Confident80Confident102 Ų10269.7 Ų69.755%0.54537%0.369SS..Hα-helixtrans-50.3-34.8175.5-71.4-17.1000111.8P267 L271 H272 S273P267-N269 PolarHBondContact O-N 3.04Å; N269-L271 VanDerWaalsContact C-N 3.31Å; N269-L271 PolarHBondContact O-N 3.11Å; N269-H272 WeakPolarHBondContact O-CB 3.22Å; N269-H272 PolarHBondContact O-N 2.91Å; N269-S273 PolarHBondContact O-N 3.19Å; N269-S273 PolarHBondContact O-OG 2.85Å
270T84.9Confident80.7Confident99 Ų9968.3 Ų68.361%0.60736%0.362SS*.Hα-helixtrans-57.2-39.4175.5-460000113.3P268 V274P268-T270 PolarHBondContact O-N 3.45Å; T270-V274 HydrophobicContact CG2-CG2 4.46Å; T270-V274 WeakPolarHBondContact O-CB 3.45Å; T270-V274 VanDerWaalsContact O-CG2 3.25Å; T270-V274 WeakPolarHBondContact O-CG2 3.23Å; T270-V274 PolarHBondContact O-N 3.46Å
271L88.3Confident81.3Confident84 Ų8470.5 Ų70.544%0.4437%0.374SS..Hα-helixtrans-67.3-45.6-179.3-179.960.6000110.3Y255 P268 N269 V274 V275Y255-L271 HydrophobicContact CD2-CD2 3.91Å; Y255-L271 HydrophobicContact CD2-CG 4.05Å; Y255-L271 HydrophobicContact CE2-CD2 4.04Å; Y255-L271 HydrophobicContact CE2-CG 4.15Å; P268-L271 WeakPolarHBondContact O-CB 3.49Å; P268-L271 PolarHBondContact O-N 2.86Å; N269-L271 VanDerWaalsContact C-N 3.31Å; N269-L271 PolarHBondContact O-N 3.11Å; L271-V274 PolarHBondContact O-N 3.39Å; L271-V275 HydrophobicContact CD1-CG1 4.16Å; L271-V275 WeakPolarHBondContact O-CG2 3.47Å; L271-V275 PolarHBondContact O-N 3.45Å
272H88.3Confident81.7Confident40 Ų4066.5 Ų66.519%0.18535%0.349CS..Hα-helixtrans-55.5-52.1175.1177.5-116.5000111.2Y255 N269 V274 V275 L276Y255-H272 HydrophobicContact CE1-CB 4.03Å; Y255-H272 AromaticContact CE1-CD2 3.54Å; N269-H272 WeakPolarHBondContact O-CB 3.22Å; N269-H272 PolarHBondContact O-N 2.91Å; H272-V274 VanDerWaalsContact C-N 3.35Å; H272-V274 PolarHBondContact O-N 2.85Å; H272-V275 VanDerWaalsContact O-CG2 3.3Å; H272-V275 WeakPolarHBondContact O-CG2 3.28Å; H272-V275 PolarHBondContact O-N 3.11Å; H272-L276 WeakPolarHBondContact O-CB 3.36Å; H272-L276 PolarHBondContact O-N 3.27Å
273S90.4Very high82.4Confident18 Ų1860.4 Ų60.413%0.12632%0.323CS..Hα-helixtrans-56.2-47.7177.8-61.60000111.8E66 N269 V275 L276 W277E66-S273 VanDerWaalsContact CD-OG 3.28Å; E66-S273 VanDerWaalsContact OE1-CB 3.24Å; E66-S273 WeakPolarHBondContact OE1-CB 3.21Å; E66-S273 PolarHBondContact OE1-OG 3.21Å; E66-S273 WeakPolarHBondContact OE2-CB 3.42Å; E66-S273 PolarHBondContact OE2-OG 3.42Å; N269-S273 PolarHBondContact O-N 3.19Å; N269-S273 PolarHBondContact O-OG 2.85Å; S273-V275 PolarHBondContact O-N 3.16Å; S273-L276 PolarHBondContact O-N 3.02Å; S273-W277 WeakPolarHBondContact O-CB 3.41Å; S273-W277 PolarHBondContact O-N 3.02Å
274V92.8Very high84.1Confident89 Ų8953.6 Ų53.654%0.53929%0.292SS..Hα-helixtrans-61.2-47.4-179.4168.60000111.6T270 L271 H272 L278T270-V274 HydrophobicContact CG2-CG2 4.46Å; T270-V274 WeakPolarHBondContact O-CB 3.45Å; T270-V274 VanDerWaalsContact O-CG2 3.25Å; T270-V274 WeakPolarHBondContact O-CG2 3.23Å; T270-V274 PolarHBondContact O-N 3.46Å; L271-V274 PolarHBondContact O-N 3.39Å; H272-V274 VanDerWaalsContact C-N 3.35Å; H272-V274 PolarHBondContact O-N 2.85Å; V274-L278 VanDerWaalsContact O-CB 3.25Å; V274-L278 WeakPolarHBondContact O-CB 3.31Å; V274-L278 PolarHBondContact O-N 3.05Å
275V94.9Very high86Confident11 Ų1146.9 Ų46.97%0.06727%0.265CS..Hα-helixtrans-71.2-33.8-178.6-61.10000112.3P251 Y252 Y255 L271 H272 S273 G279P251-V275 HydrophobicContact CB-CB 4.38Å; P251-V275 HydrophobicContact CB-CG1 3.96Å; Y252-V275 HydrophobicContact CD2-CG2 3.99Å; Y255-V275 HydrophobicContact CD1-CG2 4.14Å; Y255-V275 HydrophobicContact CG-CG2 3.99Å; L271-V275 HydrophobicContact CD1-CG1 4.16Å; L271-V275 WeakPolarHBondContact O-CG2 3.47Å; L271-V275 PolarHBondContact O-N 3.45Å; H272-V275 VanDerWaalsContact O-CG2 3.3Å; H272-V275 WeakPolarHBondContact O-CG2 3.28Å; H272-V275 PolarHBondContact O-N 3.11Å; S273-V275 PolarHBondContact O-N 3.16Å; V275-G279 PolarHBondContact O-N 3.14Å
276L93.8Very high87.6Confident12 Ų1243.9 Ų43.96%0.06325%0.246CC..Hα-helixtrans-65.7-50.7177.4-178.865.8000111.1Y252 H272 S273 L278 G279 Y280Y252-L276 HydrophobicContact CD2-CB 4.26Å; Y252-L276 HydrophobicContact CD2-CD1 4.11Å; Y252-L276 HydrophobicContact CE2-CB 4.29Å; Y252-L276 HydrophobicContact CE2-CD1 3.61Å; H272-L276 WeakPolarHBondContact O-CB 3.36Å; H272-L276 PolarHBondContact O-N 3.27Å; S273-L276 PolarHBondContact O-N 3.02Å; L276-L278 VanDerWaalsContact C-N 3.29Å; L276-L278 PolarHBondContact O-N 2.95Å; L276-G279 WeakPolarHBondContact O-CA 3.42Å; L276-G279 PolarHBondContact O-N 3.39Å; L276-Y280 HydrophobicContact CD1-CE1 4.14Å; L276-Y280 HydrophobicContact CD1-CE2 4.12Å; L276-Y280 HydrophobicContact CD2-CE2 4.06Å; L276-Y280 HydrophobicContact CG-CD2 4.37Å; L276-Y280 HydrophobicContact CG-CE2 3.67Å; L276-Y280 PolarHBondContact O-N 2.94Å
277W95.8Very high89.4Confident12 Ų1236.2 Ų36.25%0.04521%0.206CC..Hα-helixtrans-66.5-32178.4-79.486.9000112.6F11 L12 V15 A63 E66 S273 G279 Y280 L281F11-W277 HydrophobicContact CE1-CE3 4.3Å; L12-W277 HydrophobicContact CB-CH2 4.09Å; L12-W277 HydrophobicContact CB-CZ3 4.36Å; L12-W277 HydrophobicContact CD2-CD2 3.57Å; L12-W277 HydrophobicContact CD2-CE3 3.69Å; L12-W277 HydrophobicContact CD2-CG 4.42Å; L12-W277 HydrophobicContact CD2-CH2 3.4Å; L12-W277 VanDerWaalsContact CD2-CH2 3.4Å; L12-W277 HydrophobicContact CD2-CZ2 3.28Å; L12-W277 HydrophobicContact CD2-CZ3 3.6Å; L12-W277 HydrophobicContact CG-CH2 4.27Å; L12-W277 HydrophobicContact CG-CZ2 4.37Å; V15-W277 HydrophobicContact CB-CE3 4.48Å; V15-W277 HydrophobicContact CB-CZ3 4.1Å; V15-W277 HydrophobicContact CG1-CE3 4.2Å; V15-W277 HydrophobicContact CG1-CZ3 3.94Å; A63-W277 HydrophobicContact CB-CH2 4.13Å; A63-W277 HydrophobicContact CB-CZ2 4.26Å; E66-W277 HydrophobicContact CG-CZ2 4.18Å; E66-W277 PolarHBondContact OE1-NE1 3.05Å; S273-W277 WeakPolarHBondContact O-CB 3.41Å; S273-W277 PolarHBondContact O-N 3.02Å; W277-G279 VanDerWaalsContact C-N 3.3Å; W277-Y280 HydrophobicContact CD2-CD2 4.06Å; W277-Y280 HydrophobicContact CE3-CD2 4.18Å; W277-Y280 HydrophobicContact CG-CD2 4.41Å; W277-Y280 PolarHBondContact O-N 3.29Å; W277-L281 WeakPolarHBondContact O-CG 3.48Å; W277-L281 PolarHBondContact O-N 2.64Å
278L96.6Very high91.2Very high52 Ų5239.3 Ų39.327%0.27222%0.22SC..Hα-helixtrans-62.6-38.2169.8-178.957.4000111.8C248 P251 V274 L276 L281C248-L278 VanDerWaalsContact CB-O 3.25Å; C248-L278 WeakPolarHBondContact CB-O 3.4Å; C248-L278 CarbonylContact O-C 3.42Å; P251-L278 HydrophobicContact CB-CD2 4.31Å; P251-L278 HydrophobicContact CG-CD2 3.89Å; V274-L278 VanDerWaalsContact O-CB 3.25Å; V274-L278 WeakPolarHBondContact O-CB 3.31Å; V274-L278 PolarHBondContact O-N 3.05Å; L276-L278 VanDerWaalsContact C-N 3.29Å; L276-L278 PolarHBondContact O-N 2.95Å; L278-L281 HydrophobicContact CD1-CD1 4.37Å; L278-L281 PolarHBondContact O-N 3.4Å
279G95.7Very high92.2Very high0 Ų036.2 Ų36.20%020%0.198CC..Hα-helixtrans-60.1-48.2170.800000112.5C248 V275 L276 W277 L281 N282C248-G279 WeakPolarHBondContact O-CA 3.27Å; C248-G279 PolarHBondContact O-N 3.44Å; V275-G279 PolarHBondContact O-N 3.14Å; L276-G279 WeakPolarHBondContact O-CA 3.42Å; L276-G279 PolarHBondContact O-N 3.39Å; W277-G279 VanDerWaalsContact C-N 3.3Å; G279-L281 VanDerWaalsContact C-N 3.29Å; G279-L281 PolarHBondContact O-N 3.16Å; G279-N282 WeakPolarHBondContact O-CB 3.25Å; G279-N282 PolarHBondContact O-N 3.42Å; G279-N282 VanDerWaalsContact O-N 3.08Å
280Y96.8Very high92.8Very high0 Ų032.5 Ų32.50%018%0.177CC..Hα-helixtrans-62.2-32.1178.1-63.5-31.4000113.8L54 L59 S62 D86 L276 W277 N282 S283L54-Y280 HydrophobicContact CD1-CE1 4.33Å; L54-Y280 HydrophobicContact CD2-CD1 4.12Å; L59-Y280 HydrophobicContact CD2-CD1 3.85Å; L59-Y280 HydrophobicContact CD2-CD2 3.43Å; L59-Y280 VanDerWaalsContact CD2-CD2 3.43Å; L59-Y280 HydrophobicContact CD2-CE1 4.22Å; L59-Y280 HydrophobicContact CD2-CE2 3.83Å; L59-Y280 HydrophobicContact CD2-CG 3.43Å; L59-Y280 VanDerWaalsContact CD2-CG 3.43Å; S62-Y280 WeakPolarHBondContact OG-CE2 3.33Å; D86-Y280 VanDerWaalsContact CG-OH 3.31Å; D86-Y280 WeakPolarHBondContact OD1-CE1 3.29Å; D86-Y280 PolarHBondContact OD1-OH 2.66Å; D86-Y280 PolarHBondContact OD2-OH 3.26Å; L276-Y280 HydrophobicContact CD1-CE1 4.14Å; L276-Y280 HydrophobicContact CD1-CE2 4.12Å; L276-Y280 HydrophobicContact CD2-CE2 4.06Å; L276-Y280 HydrophobicContact CG-CD2 4.37Å; L276-Y280 HydrophobicContact CG-CE2 3.67Å; L276-Y280 PolarHBondContact O-N 2.94Å; W277-Y280 HydrophobicContact CD2-CD2 4.06Å; W277-Y280 HydrophobicContact CE3-CD2 4.18Å; W277-Y280 HydrophobicContact CG-CD2 4.41Å; W277-Y280 PolarHBondContact O-N 3.29Å; Y280-N282 PolarHBondContact O-N 3.44Å; Y280-N282 VanDerWaalsContact O-N 3.1Å; Y280-S283 WeakPolarHBondContact O-CB 3.45Å; Y280-S283 PolarHBondContact O-N 3.18Å
281L96Very high93.1Very high47 Ų4728.7 Ų28.725%0.24615%0.154CC..Hα-helixtrans-58.9-22.7175.2-75.3174.6000112.9V15 W277 L278 G279 S283 T284 L285V15-L281 HydrophobicContact CG1-CD2 4.22Å; V15-L281 HydrophobicContact CG2-CD2 3.78Å; W277-L281 WeakPolarHBondContact O-CG 3.48Å; W277-L281 PolarHBondContact O-N 2.64Å; L278-L281 HydrophobicContact CD1-CD1 4.37Å; L278-L281 PolarHBondContact O-N 3.4Å; G279-L281 VanDerWaalsContact C-N 3.29Å; G279-L281 PolarHBondContact O-N 3.16Å; L281-S283 VanDerWaalsContact C-N 3.27Å; L281-S283 PolarHBondContact O-N 3.19Å; L281-T284 WeakPolarHBondContact O-CB 3.46Å; L281-T284 PolarHBondContact O-N 3.03Å; L281-T284 VanDerWaalsContact O-N 3.08Å; L281-L285 WeakPolarHBondContact O-CB 3.39Å; L281-L285 VanDerWaalsContact O-CG 3.26Å; L281-L285 WeakPolarHBondContact O-CG 3.29Å; L281-L285 PolarHBondContact O-N 3.09Å
282N94.2Very high93Very high1 Ų126.9 Ų26.91%0.00515%0.151CC..Hα-helixtrans-53.9-45.7172.3-175.263.5000111.8C248 W249 G279 Y280 T284 L285 N286C248-N282 HydrophobicContact CB-CB 3.68Å; W249-N282 PolarHBondContact NE1-ND2 3.34Å; G279-N282 WeakPolarHBondContact O-CB 3.25Å; G279-N282 PolarHBondContact O-N 3.42Å; G279-N282 VanDerWaalsContact O-N 3.08Å; Y280-N282 PolarHBondContact O-N 3.44Å; Y280-N282 VanDerWaalsContact O-N 3.1Å; N282-T284 VanDerWaalsContact C-N 3.29Å; N282-T284 PolarHBondContact O-N 3.26Å; N282-L285 PolarHBondContact O-N 3.03Å; N282-N286 PolarHBondContact O-N 2.92Å; N282-N286 VanDerWaalsContact O-N 3.17Å; N282-N286 PolarHBondContact O-ND2 3.21Å
283S94.8Very high92.5Very high1 Ų128.4 Ų28.41%0.00716%0.157CC..Hα-helixtrans-68.5-27.9179.2-61.90000112.4N23 D51 L54 Y280 L281 P287N23-S283 PolarHBondContact ND2-O 3.23Å; D51-S283 VanDerWaalsContact CG-CB 3.43Å; D51-S283 VanDerWaalsContact CG-OG 3.25Å; D51-S283 WeakPolarHBondContact OD1-CB 3.48Å; D51-S283 PolarHBondContact OD1-OG 3.16Å; L54-S283 WeakPolarHBondContact CD2-OG 3.42Å; Y280-S283 WeakPolarHBondContact O-CB 3.45Å; Y280-S283 PolarHBondContact O-N 3.18Å; L281-S283 VanDerWaalsContact C-N 3.27Å; L281-S283 PolarHBondContact O-N 3.19Å; S283-P287 WeakPolarHBondContact O-CD 3.38Å
284T95.6Very high92.2Very high9 Ų930.2 Ų30.26%0.05517%0.165CC..Hα-helixtrans-75.3-36.9172.8-42.10000112.3L18 T19 L281 N282L18-T284 HydrophobicContact CB-CG2 3.54Å; L18-T284 HydrophobicContact CD1-CG2 4.36Å; T19-T284 PolarHBondContact OG1-OG1 2.75Å; L281-T284 WeakPolarHBondContact O-CB 3.46Å; L281-T284 PolarHBondContact O-N 3.03Å; L281-T284 VanDerWaalsContact O-N 3.08Å; N282-T284 VanDerWaalsContact C-N 3.29Å; N282-T284 PolarHBondContact O-N 3.26Å
285L94.6Very high91.9Very high58 Ų5835.5 Ų35.530%0.30418%0.176SC..Hα-helixtrans-73.4-32.8-177.3-71.4172.8000112.5A244 L281 N282 I288 L289A244-L285 HydrophobicContact CB-CD1 4.32Å; L281-L285 WeakPolarHBondContact O-CB 3.39Å; L281-L285 VanDerWaalsContact O-CG 3.26Å; L281-L285 WeakPolarHBondContact O-CG 3.29Å; L281-L285 PolarHBondContact O-N 3.09Å; N282-L285 PolarHBondContact O-N 3.03Å; L285-I288 WeakPolarHBondContact O-CA 3.4Å; L285-I288 WeakPolarHBondContact O-CB 3.48Å; L285-I288 PolarHBondContact O-N 3.5Å; L285-L289 HydrophobicContact CB-CD1 4.06Å; L285-L289 HydrophobicContact CB-CG 4.42Å; L285-L289 VanDerWaalsContact O-CG 3.3Å; L285-L289 WeakPolarHBondContact O-CG 3.49Å; L285-L289 PolarHBondContact O-N 3.45Å
286N90.9Very high91.6Very high1 Ų137.1 Ų37.11%0.00518%0.184CC..Hα-helixtrans-48-55.8-178.9-77.7-26.1000113.2D51 N282 I288 L289 Y290D51-N286 PolarHBondContact OD2-ND2 3.12Å; N282-N286 PolarHBondContact O-N 2.92Å; N282-N286 VanDerWaalsContact O-N 3.17Å; N282-N286 PolarHBondContact O-ND2 3.21Å; N286-I288 PolarHBondContact O-N 3.3Å; N286-I288 VanDerWaalsContact O-N 3.17Å; N286-L289 PolarHBondContact O-N 2.97Å; N286-Y290 HydrophobicContact CB-CE2 4.27Å; N286-Y290 VanDerWaalsContact O-CD2 3.26Å; N286-Y290 WeakPolarHBondContact O-CD2 2.95Å; N286-Y290 VanDerWaalsContact O-CG 3.3Å; N286-Y290 PolarHBondContact O-N 3.25Å
287P93.4Very high91.4Very high6 Ų636.7 Ų36.74%0.03918%0.182CC..Hα-helixtrans-57.9-24.5174.7-28.134.1000116.4G22 N23 V26 S283 P291 Y301G22-P287 WeakPolarHBondContact O-CB 3.06Å; N23-P287 HydrophobicContact CB-CG 4.43Å; N23-P287 WeakPolarHBondContact OD1-CG 3.36Å; V26-P287 HydrophobicContact CG2-CB 3.95Å; V26-P287 HydrophobicContact CG2-CG 3.92Å; S283-P287 WeakPolarHBondContact O-CD 3.38Å; P287-P291 WeakPolarHBondContact O-CD 3.4Å; P287-P291 WeakPolarHBondContact O-CG 3.44Å; P287-Y301 VanDerWaalsContact O-CE2 3.3Å; P287-Y301 WeakPolarHBondContact O-CE2 3.38Å; P287-Y301 PolarHBondContact O-OH 2.92Å
288I93.3Very high91.2Very high98 Ų9841.9 Ų41.950%0.50320%0.201SC..Hα-helixtrans-85.1-42.8179.9-58.2172.7000109.9L285 N286 Y290 P291 A292L285-I288 WeakPolarHBondContact O-CA 3.4Å; L285-I288 WeakPolarHBondContact O-CB 3.48Å; L285-I288 PolarHBondContact O-N 3.5Å; N286-I288 PolarHBondContact O-N 3.3Å; N286-I288 VanDerWaalsContact O-N 3.17Å; I288-Y290 PolarHBondContact O-N 2.73Å; I288-P291 VanDerWaalsContact O-CD 3.26Å; I288-P291 WeakPolarHBondContact O-CD 3.04Å; I288-P291 WeakPolarHBondContact O-CG 3.49Å; I288-A292 VanDerWaalsContact O-CB 3.26Å; I288-A292 WeakPolarHBondContact O-CB 3.13Å; I288-A292 PolarHBondContact O-N 3.42Å
289L90.7Very high91Very high21 Ų2145.4 Ų45.411%0.1121%0.211CC..Hα-helixtrans-65.3-37.9-178.4-66.7171000111.8V241 A244 L285 N286 A292 F293V241-L289 HydrophobicContact CG2-CB 4.11Å; V241-L289 HydrophobicContact CG2-CD1 4.29Å; A244-L289 HydrophobicContact CB-CD1 3.65Å; L285-L289 HydrophobicContact CB-CD1 4.06Å; L285-L289 HydrophobicContact CB-CG 4.42Å; L285-L289 VanDerWaalsContact O-CG 3.3Å; L285-L289 WeakPolarHBondContact O-CG 3.49Å; L285-L289 PolarHBondContact O-N 3.45Å; N286-L289 PolarHBondContact O-N 2.97Å; L289-A292 PolarHBondContact O-N 3.32Å; L289-F293 HydrophobicContact CD2-CD2 4.32Å; L289-F293 HydrophobicContact CD2-CE2 3.78Å; L289-F293 VanDerWaalsContact O-CD2 3.26Å; L289-F293 WeakPolarHBondContact O-CD2 3.41Å; L289-F293 PolarHBondContact O-N 2.78Å
290Y88.3Confident90.7Very high23 Ų2345.5 Ų45.59%0.0921%0.211CC..Hα-helixtrans-58.5-56.3179.7-57.3-31.8000113.9V26 V44 L47 N286 I288 F293 N294 F297V26-Y290 HydrophobicContact CG1-CD2 4.29Å; V26-Y290 HydrophobicContact CG1-CE2 4.14Å; V26-Y290 HydrophobicContact CG2-CD2 3.9Å; V26-Y290 HydrophobicContact CG2-CE2 4.01Å; V44-Y290 HydrophobicContact CG1-CD2 4.18Å; V44-Y290 HydrophobicContact CG1-CE2 3.63Å; L47-Y290 WeakPolarHBondContact CD2-OH 3.33Å; N286-Y290 HydrophobicContact CB-CE2 4.27Å; N286-Y290 VanDerWaalsContact O-CD2 3.26Å; N286-Y290 WeakPolarHBondContact O-CD2 2.95Å; N286-Y290 VanDerWaalsContact O-CG 3.3Å; N286-Y290 PolarHBondContact O-N 3.25Å; I288-Y290 PolarHBondContact O-N 2.73Å; Y290-F293 PolarHBondContact O-N 3.07Å; Y290-N294 WeakPolarHBondContact O-CA 3.2Å; Y290-N294 WeakPolarHBondContact O-CB 3.25Å; Y290-N294 PolarHBondContact O-N 3.01Å; Y290-F297 HydrophobicContact CD2-CE1 4.46Å
291P89.5Confident90.6Very high20 Ų2046.3 Ų46.313%0.1321%0.214CC..Hα-helixtrans-70.8-29.1177.330.4-38000113.1P287 I288 F293 R298 Y301P287-P291 WeakPolarHBondContact O-CD 3.4Å; P287-P291 WeakPolarHBondContact O-CG 3.44Å; I288-P291 VanDerWaalsContact O-CD 3.26Å; I288-P291 WeakPolarHBondContact O-CD 3.04Å; I288-P291 WeakPolarHBondContact O-CG 3.49Å; P291-F293 PolarHBondContact O-N 3.04Å; P291-R298 HydrophobicContact CB-CB 4.11Å; P291-R298 HydrophobicContact CB-CG 4.45Å; P291-R298 WeakPolarHBondContact O-CB 3.46Å; P291-R298 PolarHBondContact O-NE 2.93Å; P291-R298 PolarHBondContact O-NH2 3.01Å; P291-Y301 HydrophobicContact CB-CD2 4.02Å; P291-Y301 HydrophobicContact CB-CE2 4.41Å; P291-Y301 HydrophobicContact CB-CG 4.36Å; P291-Y301 HydrophobicContact CG-CD2 3.74Å; P291-Y301 HydrophobicContact CG-CE2 3.74Å
292A86.4Confident90.3Very high45 Ų4545.1 Ų45.137%0.37221%0.213SC..Hα-helixtrans-58.2-30.8176.800000111.9I288 L289 R298I288-A292 VanDerWaalsContact O-CB 3.26Å; I288-A292 WeakPolarHBondContact O-CB 3.13Å; I288-A292 PolarHBondContact O-N 3.42Å; L289-A292 PolarHBondContact O-N 3.32Å; A292-R298 VanDerWaalsContact C-NH2 3.29Å; A292-R298 PolarHBondContact O-NH2 3.32Å
293F78.4Confident90.1Very high72 Ų7249.8 Ų49.832%0.31624%0.235SC..Hα-helixtrans-127.3-18.1-171-62-65.6000115.1T237 A240 L289 Y290 P291T237-F293 HydrophobicContact CG2-CB 3.15Å; T237-F293 HydrophobicContact CG2-CG 4.15Å; T237-F293 WeakPolarHBondContact OG1-CB 3.29Å; T237-F293 PolarHBondContact OG1-O 3.39Å; A240-F293 HydrophobicContact CB-CD2 4.25Å; A240-F293 HydrophobicContact CB-CE1 4.43Å; A240-F293 HydrophobicContact CB-CE2 3.68Å; A240-F293 HydrophobicContact CB-CZ 3.79Å; L289-F293 HydrophobicContact CD2-CD2 4.32Å; L289-F293 HydrophobicContact CD2-CE2 3.78Å; L289-F293 VanDerWaalsContact O-CD2 3.26Å; L289-F293 WeakPolarHBondContact O-CD2 3.41Å; L289-F293 PolarHBondContact O-N 2.78Å; Y290-F293 PolarHBondContact O-N 3.07Å; P291-F293 PolarHBondContact O-N 3.04Å
294N84.3Confident89.8Confident57 Ų5752.6 Ų52.631%0.30525%0.25SC..  trans-110.1116.1174-172.5-34.1000111.7Y290 D296 F297 R298Y290-N294 WeakPolarHBondContact O-CA 3.2Å; Y290-N294 WeakPolarHBondContact O-CB 3.25Å; Y290-N294 PolarHBondContact O-N 3.01Å; N294-D296 VanDerWaalsContact C-N 3.3Å; N294-D296 PolarHBondContact O-N 2.97Å; N294-D296 WeakPolarHBondContact OD1-CB 3.45Å; N294-D296 PolarHBondContact OD1-N 3.39Å; N294-F297 HydrophobicContact CB-CB 4.23Å; N294-F297 HydrophobicContact CB-CD2 4.02Å; N294-F297 PolarHBondContact O-N 2.88Å; N294-F297 PolarHBondContact OD1-N 3.43Å; N294-R298 PolarHBondContact O-N 3.19Å
295R86Confident89.5Confident200 Ų20057.8 Ų57.876%0.75528%0.277SS*.Hα-helixtrans-63.1-32.8-178.1-66.7-179.574177.94.1113.2R298 R299R295-R298 PolarHBondContact O-N 3.04Å; R295-R299 WeakPolarHBondContact O-CB 3.3Å; R295-R299 PolarHBondContact O-N 3Å
296D88.5Confident89.1Confident44 Ų4464.5 Ų64.524%0.23530%0.298CS..Hα-helixtrans-71-40.8179.9-69.5-35.4000110.8L36 R38 N294 R299 A300L36-D296 HydrophobicContact CD2-CB 3.7Å; L36-D296 HydrophobicContact CG-CB 4.46Å; R38-D296 IonicContact NH2-OD2 2.77Å; N294-D296 VanDerWaalsContact C-N 3.3Å; N294-D296 PolarHBondContact O-N 2.97Å; N294-D296 WeakPolarHBondContact OD1-CB 3.45Å; N294-D296 PolarHBondContact OD1-N 3.39Å; D296-R299 PolarHBondContact O-N 2.77Å; D296-A300 WeakPolarHBondContact O-CB 3.43Å; D296-A300 PolarHBondContact O-N 2.99Å
297F90.3Very high87.5Confident4 Ų470.5 Ų70.52%0.01834%0.339CS..Hα-helixtrans-63.1-46.7170.8-88.6-79.6000111.7V26 A29 V30 L36 V44 Y290 N294 R299 A300 Y301V26-F297 HydrophobicContact CG1-CE1 4.28Å; A29-F297 HydrophobicContact CB-CD1 4.47Å; V30-F297 HydrophobicContact CG2-CE1 3.82Å; V30-F297 HydrophobicContact CG2-CZ 3.78Å; L36-F297 HydrophobicContact CD1-CD1 3.93Å; L36-F297 HydrophobicContact CD1-CE1 3.92Å; L36-F297 HydrophobicContact CD1-CG 4.23Å; L36-F297 HydrophobicContact CD1-CZ 4.23Å; L36-F297 HydrophobicContact CD2-CD2 3.75Å; L36-F297 HydrophobicContact CD2-CE2 3.74Å; L36-F297 HydrophobicContact CD2-CG 4.2Å; L36-F297 HydrophobicContact CD2-CZ 4.17Å; V44-F297 HydrophobicContact CG1-CZ 3.84Å; Y290-F297 HydrophobicContact CD2-CE1 4.46Å; N294-F297 HydrophobicContact CB-CB 4.23Å; N294-F297 HydrophobicContact CB-CD2 4.02Å; N294-F297 PolarHBondContact O-N 2.88Å; N294-F297 PolarHBondContact OD1-N 3.43Å; F297-R299 VanDerWaalsContact C-N 3.26Å; F297-R299 PolarHBondContact O-N 3.37Å; F297-A300 PolarHBondContact O-N 2.72Å; F297-Y301 AromaticContact CD1-CE1 3.99Å; F297-Y301 HydrophobicContact CD1-CE1 3.99Å; F297-Y301 WeakPolarHBondContact O-CB 3.41Å; F297-Y301 WeakPolarHBondContact O-CD1 3.3Å; F297-Y301 PolarHBondContact O-N 3.29Å
298R91.9Very high85.7Confident121 Ų12181 Ų8146%0.45738%0.378SS..Hα-helixtrans-56.4-41.8177-166.3-179.1-52.1177.23.8112.5P291 A292 N294 R295 G302P291-R298 HydrophobicContact CB-CB 4.11Å; P291-R298 HydrophobicContact CB-CG 4.45Å; P291-R298 WeakPolarHBondContact O-CB 3.46Å; P291-R298 PolarHBondContact O-NE 2.93Å; P291-R298 PolarHBondContact O-NH2 3.01Å; A292-R298 VanDerWaalsContact C-NH2 3.29Å; A292-R298 PolarHBondContact O-NH2 3.32Å; N294-R298 PolarHBondContact O-N 3.19Å; R295-R298 PolarHBondContact O-N 3.04Å; R298-G302 PolarHBondContact O-N 3.16Å
299R90.8Very high83.4Confident126 Ų12679.1 Ų79.148%0.47538%0.383SS..Hα-helixtrans-68.8-45178-171.8177.4-175.7143.85.6111.5R35 R295 D296 F297 Y301 G302 E303R35-R299 VanDerWaalsContact CZ-CZ 3.43Å; R295-R299 WeakPolarHBondContact O-CB 3.3Å; R295-R299 PolarHBondContact O-N 3Å; D296-R299 PolarHBondContact O-N 2.77Å; F297-R299 VanDerWaalsContact C-N 3.26Å; F297-R299 PolarHBondContact O-N 3.37Å; R299-Y301 VanDerWaalsContact C-N 3.33Å; R299-Y301 PolarHBondContact O-N 3.45Å; R299-G302 PolarHBondContact O-N 3.48Å; R299-E303 HydrophobicContact CG-CG 4.49Å; R299-E303 WeakPolarHBondContact CG-OE1 3.43Å; R299-E303 IonicContact NE-OE1 2.73Å; R299-E303 PolarHBondContact NE-OE1 3.1Å; R299-E303 VanDerWaalsContact NE-OE1 3.09Å; R299-E303 WeakPolarHBondContact O-CB 3.06Å; R299-E303 WeakPolarHBondContact O-CG 3.15Å; R299-E303 PolarHBondContact O-N 2.74Å
300A90.9Very high81.3Confident1 Ų184.5 Ų84.51%0.00842%0.422CS..Hα-helixtrans-60.2-44.2176.700000111.4A29 L36 D296 F297 E303 L304A29-A300 HydrophobicContact CB-CB 3.89Å; L36-A300 HydrophobicContact CD1-CB 3.82Å; D296-A300 WeakPolarHBondContact O-CB 3.43Å; D296-A300 PolarHBondContact O-N 2.99Å; F297-A300 PolarHBondContact O-N 2.72Å; A300-E303 PolarHBondContact O-N 3.27Å; A300-L304 WeakPolarHBondContact O-CG 3.35Å; A300-L304 PolarHBondContact O-N 3.39Å
301Y93.3Very high79.1Confident17 Ų1788.2 Ų88.27%0.06745%0.451CS..Hα-helixtrans-62.7-45.8175.7-82.433.9000111.2L25 V26 A29 P287 P291 F297 R299 E303 L304 L305L25-Y301 HydrophobicContact CD2-CD1 4.33Å; L25-Y301 HydrophobicContact CD2-CD2 3.45Å; L25-Y301 VanDerWaalsContact CD2-CD2 3.45Å; L25-Y301 HydrophobicContact CD2-CE1 4.33Å; L25-Y301 HydrophobicContact CD2-CE2 3.45Å; L25-Y301 VanDerWaalsContact CD2-CE2 3.45Å; L25-Y301 HydrophobicContact CD2-CG 3.91Å; L25-Y301 HydrophobicContact CG-CD1 4.08Å; L25-Y301 HydrophobicContact CG-CD2 4.07Å; L25-Y301 HydrophobicContact CG-CE1 3.89Å; L25-Y301 HydrophobicContact CG-CE2 3.89Å; L25-Y301 HydrophobicContact CG-CG 4.16Å; V26-Y301 WeakPolarHBondContact CG2-OH 3.44Å; A29-Y301 HydrophobicContact CB-CD1 3.74Å; A29-Y301 HydrophobicContact CB-CE1 3.59Å; P287-Y301 VanDerWaalsContact O-CE2 3.3Å; P287-Y301 WeakPolarHBondContact O-CE2 3.38Å; P287-Y301 PolarHBondContact O-OH 2.92Å; P291-Y301 HydrophobicContact CB-CD2 4.02Å; P291-Y301 HydrophobicContact CB-CE2 4.41Å; P291-Y301 HydrophobicContact CB-CG 4.36Å; P291-Y301 HydrophobicContact CG-CD2 3.74Å; P291-Y301 HydrophobicContact CG-CE2 3.74Å; F297-Y301 AromaticContact CD1-CE1 3.99Å; F297-Y301 HydrophobicContact CD1-CE1 3.99Å; F297-Y301 WeakPolarHBondContact O-CB 3.41Å; F297-Y301 WeakPolarHBondContact O-CD1 3.3Å; F297-Y301 PolarHBondContact O-N 3.29Å; R299-Y301 VanDerWaalsContact C-N 3.33Å; R299-Y301 PolarHBondContact O-N 3.45Å; Y301-E303 VanDerWaalsContact C-N 3.28Å; Y301-E303 PolarHBondContact O-N 3.01Å; Y301-L304 PolarHBondContact O-N 3.45Å; Y301-L304 VanDerWaalsContact O-N 3.15Å; Y301-L305 WeakPolarHBondContact O-CB 3.42Å; Y301-L305 WeakPolarHBondContact O-CG 3.38Å; Y301-L305 PolarHBondContact O-N 3.43Å
302G91.1Very high76.9Confident22 Ų2298.5 Ų98.523%0.22749%0.487CS..Hα-helixtrans-62.5-33.8176.400000113.3R298 R299 R306R298-G302 PolarHBondContact O-N 3.16Å; R299-G302 PolarHBondContact O-N 3.48Å; G302-R306 WeakPolarHBondContact O-CB 3.34Å; G302-R306 WeakPolarHBondContact O-CD 3.49Å; G302-R306 WeakPolarHBondContact O-CG 3.19Å; G302-R306 PolarHBondContact O-N 2.87Å; G302-R306 VanDerWaalsContact O-N 3.13Å
303E89.4Confident74.8Confident99 Ų99107.3 Ų107.346%0.46351%0.511SS..Hα-helixtrans-72.4-30174.6-74.2173.3-171.700112.4R299 A300 Y301R299-E303 HydrophobicContact CG-CG 4.49Å; R299-E303 WeakPolarHBondContact CG-OE1 3.43Å; R299-E303 IonicContact NE-OE1 2.73Å; R299-E303 PolarHBondContact NE-OE1 3.1Å; R299-E303 VanDerWaalsContact NE-OE1 3.09Å; R299-E303 WeakPolarHBondContact O-CB 3.06Å; R299-E303 WeakPolarHBondContact O-CG 3.15Å; R299-E303 PolarHBondContact O-N 2.74Å; A300-E303 PolarHBondContact O-N 3.27Å; Y301-E303 VanDerWaalsContact C-N 3.28Å; Y301-E303 PolarHBondContact O-N 3.01Å
304L89.1Confident72.9Confident60 Ų60108.9 Ų108.931%0.31453%0.527SS..Hα-helixtrans-82.4-41.2177.2-69172.5000113.2L25 L28 A29 L32 A300 Y301L25-L304 HydrophobicContact CD1-CB 4.02Å; L25-L304 HydrophobicContact CD1-CD1 3.71Å; L28-L304 HydrophobicContact CB-CD1 3.99Å; A29-L304 HydrophobicContact CB-CD1 4.08Å; L32-L304 HydrophobicContact CD1-CD2 3.66Å; A300-L304 WeakPolarHBondContact O-CG 3.35Å; A300-L304 PolarHBondContact O-N 3.39Å; Y301-L304 PolarHBondContact O-N 3.45Å; Y301-L304 VanDerWaalsContact O-N 3.15Å
305L88.4Confident71Confident119 Ų119112.8 Ų112.862%0.62355%0.547SS*.Hα-helixtrans-83-25.3-176.2-66175000113.1L25 Y301 C307L25-L305 HydrophobicContact CD2-CD1 4.22Å; L25-L305 HydrophobicContact CD2-CD2 4.3Å; L25-L305 HydrophobicContact CD2-CG 4.38Å; Y301-L305 WeakPolarHBondContact O-CB 3.42Å; Y301-L305 WeakPolarHBondContact O-CG 3.38Å; Y301-L305 PolarHBondContact O-N 3.43Å; L305-C307 VanDerWaalsContact C-N 3.31Å; L305-C307 PolarHBondContact O-N 3.35Å
306R85.8Confident68.7Low199 Ų199109.4 Ų109.475%0.75154%0.539SS*.SBendtrans-73.595.8166.8-71173.9176.8164.2-2.7106.6G302 R308G302-R306 WeakPolarHBondContact O-CB 3.34Å; G302-R306 WeakPolarHBondContact O-CD 3.49Å; G302-R306 WeakPolarHBondContact O-CG 3.19Å; G302-R306 PolarHBondContact O-N 2.87Å; G302-R306 VanDerWaalsContact O-N 3.13Å; R306-R308 PolarHBondContact O-N 3.43Å
307C57.2Low66.5Low127 Ų127111.9 Ų111.986%0.85855%0.552SS**  trans-59.571.1160.5-66.50000108.7L305 G309L305-C307 VanDerWaalsContact C-N 3.31Å; L305-C307 PolarHBondContact O-N 3.35Å; C307-G309 VanDerWaalsContact C-N 3.32Å; C307-G309 PolarHBondContact O-N 2.93Å
308R55.6Low64.1Low226 Ų226114.4 Ų114.485%0.85357%0.568SS**  trans-73.199.7174-148.4178.3-175.7-166.7-1.2104.4R306 S310R306-R308 PolarHBondContact O-N 3.43Å; R308-S310 PolarHBondContact O-N 3.27Å
309G45.3Very low61.8Low59 Ų59116.1 Ų116.161%0.60858%0.581SS**  trans-41.3135.9171.200000109.4C307 S311C307-G309 VanDerWaalsContact C-N 3.32Å; C307-G309 PolarHBondContact O-N 2.93Å; G309-S311 VanDerWaalsContact C-N 3.34Å; G309-S311 PolarHBondContact O-N 2.99Å
310S47.6Very low59.7Low133 Ų133114.4 Ų114.493%0.9358%0.584SS**SBendtrans-32.390.7-178.9-168.50000112.6R308R308-S310 PolarHBondContact O-N 3.27Å
311S41.5Very low57.5Low101 Ų101115.4 Ų115.471%0.70659%0.59SS**  trans-125.383.5165.9-169.10000106.2G309 R313G309-S311 VanDerWaalsContact C-N 3.34Å; G309-S311 PolarHBondContact O-N 2.99Å; S311-R313 VanDerWaalsContact C-N 3.32Å; S311-R313 PolarHBondContact O-N 3.14Å
312R43.2Very low55.3Low236 Ų236117.9 Ų117.989%0.89160%0.604SS**SBendtrans25.960.4159.5-69.9-178.9-180178.90.3115.6
313R42.5Very low52.9Low231 Ų231123.1 Ų123.187%0.87262%0.618SS**  -101.496.4121.9-75.4-177.3-173.7168.72.5104S311 L315S311-R313 VanDerWaalsContact C-N 3.32Å; S311-R313 PolarHBondContact O-N 3.14Å; R313-L315 VanDerWaalsContact C-N 3.25Å; R313-L315 PolarHBondContact O-N 3.47Å
314T38.2Very low50.8Low105 Ų105124 Ų12464%0.64462%0.621SS**  trans-44110153.8-45.90000104.2Q316T314-Q316 HydrophobicContact CG2-CB 4.22Å; T314-Q316 HydrophobicContact CG2-CG 3.36Å; T314-Q316 PolarHBondContact O-N 2.91Å
315L45.3Very low49.2Very low138 Ų138123.9 Ų123.972%0.72362%0.616SS**  trans-64.972.3156.5-164.989.5000102.5R313 L317R313-L315 VanDerWaalsContact C-N 3.25Å; R313-L315 PolarHBondContact O-N 3.47Å; L315-L317 HydrophobicContact CD2-CD1 4.41Å; L315-L317 PolarHBondContact O-N 3.08Å
316Q36.6Very low47.3Very low129 Ų129122.3 Ų122.360%0.60361%0.607SS**  trans-62.895.5163.4-84.8-149.9-8.400101.3T314 T318T314-Q316 HydrophobicContact CG2-CB 4.22Å; T314-Q316 HydrophobicContact CG2-CG 3.36Å; T314-Q316 PolarHBondContact O-N 2.91Å; Q316-T318 HydrophobicContact CB-CG2 4.13Å; Q316-T318 PolarHBondContact O-N 3.41Å; Q316-T318 PolarHBondContact O-OG1 3.34Å; Q316-T318 VanDerWaalsContact OE1-CG2 3.3Å
317L42.2Very low45.4Very low96 Ų96115 Ų11550%0.50359%0.585SS.*  trans-57.955.6149.2-14681.7000106.5L315 H319 L322L315-L317 HydrophobicContact CD2-CD1 4.41Å; L315-L317 PolarHBondContact O-N 3.08Å; L317-H319 PolarHBondContact O-N 3.28Å; L317-L322 HydrophobicContact CD1-CD1 4.31Å; L317-L322 HydrophobicContact CD2-CD1 4.13Å; L317-L322 HydrophobicContact CG-CD1 4.22Å
318T40.7Very low45.1Very low57 Ų57111.9 Ų111.935%0.3556%0.557SS.*  trans-54130.816624.90000103.9Q316 V320 T321 L322Q316-T318 HydrophobicContact CB-CG2 4.13Å; Q316-T318 PolarHBondContact O-N 3.41Å; Q316-T318 PolarHBondContact O-OG1 3.34Å; Q316-T318 VanDerWaalsContact OE1-CG2 3.3Å; T318-V320 CarbonylContact O-C 3.58Å; T318-V320 PolarHBondContact O-N 3.42Å; T318-T321 PolarHBondContact O-N 2.85Å; T318-T321 PolarHBondContact OG1-OG1 3.26Å; T318-L322 PolarHBondContact O-N 3.34Å
319H43.6Very low44.9Very low158 Ų158107.9 Ų107.973%0.73155%0.546SS*.Hα-helixtrans-41.5-30.2178.3-161.1-112.3000112.1L317 Y323L317-H319 PolarHBondContact O-N 3.28Å; H319-Y323 WeakPolarHBondContact O-CA 3.47Å; H319-Y323 WeakPolarHBondContact O-CB 3.03Å; H319-Y323 PolarHBondContact O-N 2.96Å
320V45.6Very low44.8Very low89 Ų89109.7 Ų109.754%0.53954%0.537SS..Hα-helixtrans-64.5-36.9174-174.80000115.4T318 K324T318-V320 CarbonylContact O-C 3.58Å; T318-V320 PolarHBondContact O-N 3.42Å; V320-K324 WeakPolarHBondContact O-CB 3.34Å; V320-K324 WeakPolarHBondContact O-CG 3.29Å; V320-K324 PolarHBondContact O-N 3.35Å
321T45.3Very low44.8Very low22 Ų22107.9 Ų107.914%0.13552%0.517CS..Hα-helixtrans-79.5-37.6179.5-550000111.5R34 T318 R325R34-T321 PolarHBondContact NH2-OG1 2.99Å; R34-T321 VanDerWaalsContact NH2-OG1 3.14Å; T318-T321 PolarHBondContact O-N 2.85Å; T318-T321 PolarHBondContact OG1-OG1 3.26Å; T321-R325 WeakPolarHBondContact O-CB 3.44Å; T321-R325 VanDerWaalsContact O-CG 3.25Å; T321-R325 WeakPolarHBondContact O-CG 3.34Å; T321-R325 PolarHBondContact O-N 2.91Å
322L46.1Very low45.1Very low70 Ų70106.5 Ų106.537%0.36650%0.498SS..Hα-helixtrans-66.9-41.5168.3-159.683.8000110.3L317 T318 R325 L326L317-L322 HydrophobicContact CD1-CD1 4.31Å; L317-L322 HydrophobicContact CD2-CD1 4.13Å; L317-L322 HydrophobicContact CG-CD1 4.22Å; T318-L322 PolarHBondContact O-N 3.34Å; L322-R325 PolarHBondContact O-N 3.23Å; L322-L326 HydrophobicContact CD2-CD1 3.97Å; L322-L326 HydrophobicContact CG-CD1 3.9Å; L322-L326 HydrophobicContact CG-CG 4.49Å; L322-L326 WeakPolarHBondContact O-CB 3.36Å; L322-L326 WeakPolarHBondContact O-CD1 3.43Å; L322-L326 WeakPolarHBondContact O-CG 3.47Å; L322-L326 PolarHBondContact O-N 2.77Å
323Y42Very low44.8Very low131 Ų131103.9 Ų103.951%0.51449%0.488SS..Hα-helixtrans-58.8-48.6174.6-176.4-100.1000111.2H319 L326 T327H319-Y323 WeakPolarHBondContact O-CA 3.47Å; H319-Y323 WeakPolarHBondContact O-CB 3.03Å; H319-Y323 PolarHBondContact O-N 2.96Å; Y323-L326 CarbonylContact O-C 3.26Å; Y323-L326 VanDerWaalsContact O-C 3.26Å; Y323-L326 WeakPolarHBondContact O-CA 3.24Å; Y323-L326 WeakPolarHBondContact O-CB 3.41Å; Y323-L326 PolarHBondContact O-N 3.38Å; Y323-T327 WeakPolarHBondContact O-CB 3.01Å; Y323-T327 PolarHBondContact O-N 2.87Å; Y323-T327 PolarHBondContact O-OG1 3.01Å
324K45.6Very low44.8Very low119 Ų11997.1 Ų97.152%0.51747%0.473SS..Hα-helixtrans-66.9-37175.9-78.2-176.6177.3-178.30114V320 L326 T327 F328V320-K324 WeakPolarHBondContact O-CB 3.34Å; V320-K324 WeakPolarHBondContact O-CG 3.29Å; V320-K324 PolarHBondContact O-N 3.35Å; K324-L326 VanDerWaalsContact C-N 3.34Å; K324-T327 WeakPolarHBondContact CA-OG1 3.37Å; K324-T327 PolarHBondContact O-N 3.39Å; K324-T327 VanDerWaalsContact O-N 3.1Å; K324-F328 PolarHBondContact O-N 2.98Å
325R54Low44.8Very low57 Ų5793.5 Ų93.522%0.21545%0.451CS..Hα-helixtrans-61.7-44.3170.4-78.6176.8177.2-1750.7110.7L32 W37 T321 L322 T327 F329L32-R325 PolarHBondContact O-NH2 3.05Å; W37-R325 HydrophobicContact CH2-CG 3.69Å; W37-R325 HydrophobicContact CZ2-CG 3.68Å; T321-R325 WeakPolarHBondContact O-CB 3.44Å; T321-R325 VanDerWaalsContact O-CG 3.25Å; T321-R325 WeakPolarHBondContact O-CG 3.34Å; T321-R325 PolarHBondContact O-N 2.91Å; L322-R325 PolarHBondContact O-N 3.23Å; R325-T327 VanDerWaalsContact C-N 3.31Å; R325-T327 PolarHBondContact O-N 3.46Å; R325-F329 WeakPolarHBondContact O-CD2 3.28Å; R325-F329 PolarHBondContact O-N 3.22Å
326L48.8Very low44.6Very low85 Ų8594.1 Ų94.145%0.44545%0.451SS..Hα-helixtrans-71-19.6171.1-71.8163.6000112.4L322 Y323 K324 F329 K330L322-L326 HydrophobicContact CD2-CD1 3.97Å; L322-L326 HydrophobicContact CG-CD1 3.9Å; L322-L326 HydrophobicContact CG-CG 4.49Å; L322-L326 WeakPolarHBondContact O-CB 3.36Å; L322-L326 WeakPolarHBondContact O-CD1 3.43Å; L322-L326 WeakPolarHBondContact O-CG 3.47Å; L322-L326 PolarHBondContact O-N 2.77Å; Y323-L326 CarbonylContact O-C 3.26Å; Y323-L326 VanDerWaalsContact O-C 3.26Å; Y323-L326 WeakPolarHBondContact O-CA 3.24Å; Y323-L326 WeakPolarHBondContact O-CB 3.41Å; Y323-L326 PolarHBondContact O-N 3.38Å; K324-L326 VanDerWaalsContact C-N 3.34Å; L326-F329 CarbonylContact O-C 3.46Å; L326-K330 WeakPolarHBondContact O-CA 3.35Å; L326-K330 WeakPolarHBondContact O-CB 3.3Å; L326-K330 WeakPolarHBondContact O-CG 3.48Å; L326-K330 PolarHBondContact O-N 3.31Å
327T46.7Very low44.5Very low47 Ų4792.9 Ų92.929%0.28845%0.448SS..Hα-helixtrans-78.7-37.3175.2-45.60000110.8Y323 K324 R325 F329 K330 L331Y323-T327 WeakPolarHBondContact O-CB 3.01Å; Y323-T327 PolarHBondContact O-N 2.87Å; Y323-T327 PolarHBondContact O-OG1 3.01Å; K324-T327 WeakPolarHBondContact CA-OG1 3.37Å; K324-T327 PolarHBondContact O-N 3.39Å; K324-T327 VanDerWaalsContact O-N 3.1Å; R325-T327 VanDerWaalsContact C-N 3.31Å; R325-T327 PolarHBondContact O-N 3.46Å; T327-F329 VanDerWaalsContact C-N 3.26Å; T327-F329 PolarHBondContact O-N 3.3Å; T327-K330 CarbonylContact O-C 3.34Å; T327-K330 PolarHBondContact O-N 3.34Å; T327-L331 WeakPolarHBondContact O-CB 3.32Å; T327-L331 WeakPolarHBondContact O-CG 3.49Å; T327-L331 PolarHBondContact O-N 3.42Å
328F51.7Low44Very low61 Ų6190.5 Ų90.527%0.26844%0.439SS..Hα-helixtrans-58.7-41.7168.9-173.6-99.3000110.7C42 K324 F332C42-F328 VanDerWaalsContact SG-CZ 3.6Å; K324-F328 PolarHBondContact O-N 2.98Å; F328-F332 VanDerWaalsContact O-CD2 3.3Å; F328-F332 WeakPolarHBondContact O-CD2 3.32Å
329F50.1Low44.1Very low142 Ų14295.8 Ų95.862%0.62346%0.457SS*.Hα-helixtrans-79.8-26172.1-78.7-81.5000114.6R325 L326 T327 F332 R333R325-F329 WeakPolarHBondContact O-CD2 3.28Å; R325-F329 PolarHBondContact O-N 3.22Å; L326-F329 CarbonylContact O-C 3.46Å; T327-F329 VanDerWaalsContact C-N 3.26Å; T327-F329 PolarHBondContact O-N 3.3Å; F329-F332 VanDerWaalsContact O-CB 3.25Å; F329-F332 WeakPolarHBondContact O-CB 3.38Å; F329-F332 PolarHBondContact O-N 2.89Å; F329-R333 PolarHBondContact O-N 3.34Å
330K43.3Very low43.9Very low96 Ų9696.2 Ų96.242%0.41746%0.457SS..Hα-helixtrans-79.2-23.9174.5-84.3174.3173-178.50111L326 T327 F332 R333 V334L326-K330 WeakPolarHBondContact O-CA 3.35Å; L326-K330 WeakPolarHBondContact O-CB 3.3Å; L326-K330 WeakPolarHBondContact O-CG 3.48Å; L326-K330 PolarHBondContact O-N 3.31Å; T327-K330 CarbonylContact O-C 3.34Å; T327-K330 PolarHBondContact O-N 3.34Å; K330-F332 PolarHBondContact O-N 3.21Å; K330-R333 CarbonylContact O-C 3.52Å; K330-R333 WeakPolarHBondContact O-CA 3.44Å; K330-R333 PolarHBondContact O-N 2.96Å; K330-V334 WeakPolarHBondContact O-CB 3.43Å; K330-V334 WeakPolarHBondContact O-CG2 3.34Å; K330-V334 PolarHBondContact O-N 3.25Å
331L47Very low43.4Very low96 Ų9695.6 Ų95.650%0.50346%0.457SS..Hα-helixtrans-59.4-30.8164.9-91.5155.4000110.9T327 S335T327-L331 WeakPolarHBondContact O-CB 3.32Å; T327-L331 WeakPolarHBondContact O-CG 3.49Å; T327-L331 PolarHBondContact O-N 3.42Å; L331-S335 PolarHBondContact O-N 3.02Å
332F47.8Very low43.2Very low72 Ų7298.4 Ų98.432%0.31647%0.474SS..Hα-helixtrans-68.9-37.9168.2-75.7-119.8000112L124 F328 F329 K330L124-F332 HydrophobicContact CD1-CD1 3.64Å; L124-F332 HydrophobicContact CD1-CE1 3.46Å; L124-F332 VanDerWaalsContact CD1-CE1 3.46Å; L124-F332 HydrophobicContact CD2-CD1 3.75Å; L124-F332 HydrophobicContact CD2-CE1 4.25Å; L124-F332 HydrophobicContact CD2-CG 4.34Å; L124-F332 HydrophobicContact CG-CD1 4.24Å; L124-F332 HydrophobicContact CG-CE1 4.28Å; F328-F332 VanDerWaalsContact O-CD2 3.3Å; F328-F332 WeakPolarHBondContact O-CD2 3.32Å; F329-F332 VanDerWaalsContact O-CB 3.25Å; F329-F332 WeakPolarHBondContact O-CB 3.38Å; F329-F332 PolarHBondContact O-N 2.89Å; K330-F332 PolarHBondContact O-N 3.21Å
333R38.5Very low42.9Very low180 Ų18097.9 Ų97.968%0.67948%0.48SS*.Hα-helixtrans-77.5-37.3179.4-162.7179.3-97.2-178.6-5.1113.8F329 K330 S335 Q336 N337F329-R333 PolarHBondContact O-N 3.34Å; K330-R333 CarbonylContact O-C 3.52Å; K330-R333 WeakPolarHBondContact O-CA 3.44Å; K330-R333 PolarHBondContact O-N 2.96Å; R333-S335 VanDerWaalsContact C-N 3.3Å; R333-S335 PolarHBondContact O-N 3.24Å; R333-Q336 PolarHBondContact O-N 2.94Å; R333-N337 PolarHBondContact O-N 3.18Å
334V41Very low42.7Very low90 Ų9094.2 Ų94.255%0.54548%0.477SS..Hα-helixtrans-69.7-27.8179172.50000111.5K330 Q336 N337 S338K330-V334 WeakPolarHBondContact O-CB 3.43Å; K330-V334 WeakPolarHBondContact O-CG2 3.34Å; K330-V334 PolarHBondContact O-N 3.25Å; V334-Q336 VanDerWaalsContact C-N 3.25Å; V334-Q336 PolarHBondContact O-N 3.41Å; V334-N337 PolarHBondContact O-N 3.25Å; V334-S338 PolarHBondContact O-N 3.46Å
335S38.4Very low42.6Very low28 Ų2892.9 Ų92.920%0.19648%0.479CS..Hα-helixtrans-69.3-19.4173.1-166.40000114R121 L331 R333R121-S335 WeakPolarHBondContact CG-OG 3.33Å; R121-S335 PolarHBondContact NE-OG 2.92Å; L331-S335 PolarHBondContact O-N 3.02Å; R333-S335 VanDerWaalsContact C-N 3.3Å; R333-S335 PolarHBondContact O-N 3.24Å
336Q41.2Very low42Very low152 Ų15296.9 Ų96.971%0.7150%0.501SS*.Hα-helixtrans-84.6-37.9169.3-82.1-172.5-14.200111.9R333 V334 K339R333-Q336 PolarHBondContact O-N 2.94Å; V334-Q336 VanDerWaalsContact C-N 3.25Å; V334-Q336 PolarHBondContact O-N 3.41Å; Q336-K339 PolarHBondContact O-N 2.97Å
337N34.8Very low41.8Very low102 Ų10297 Ų9755%0.54551%0.505SS..Hα-helixtrans-74.9-26.2-179.4-82.70000114.5R333 V334 K339 K340 S341R333-N337 PolarHBondContact O-N 3.18Å; V334-N337 PolarHBondContact O-N 3.25Å; N337-K339 PolarHBondContact O-N 3.47Å; N337-K340 PolarHBondContact O-N 3.26Å; N337-S341 PolarHBondContact O-N 3.07Å
338S32.3Very low41.7Very low46 Ų46101.7 Ų101.732%0.32252%0.524SS..Hα-helixtrans-62.8-24.7175.3-177.60000112.7V334 T342V334-S338 PolarHBondContact O-N 3.46Å; S338-T342 PolarHBondContact O-N 3.4Å; S338-T342 PolarHBondContact O-OG1 2.96Å
339K42.7Very low41Very low168 Ų168108.2 Ų108.273%0.7355%0.547SS*.Hα-helixtrans-81.6-27.1176.5-74.1-173175.3-172.80113.4Q336 N337 A343Q336-K339 PolarHBondContact O-N 2.97Å; N337-K339 PolarHBondContact O-N 3.47Å; K339-A343 PolarHBondContact O-N 3.42Å
340K39Very low40.6Very low167 Ų167109 Ų10973%0.72655%0.552SS**Hα-helixtrans-72.9-33.9173.9-75.4-171.1174.9-173.70112N337 A344N337-K340 PolarHBondContact O-N 3.26Å; K340-A344 WeakPolarHBondContact O-CB 3.49Å; K340-A344 PolarHBondContact O-N 3.48Å
341S36Very low40.6Very low76 Ų76112.9 Ų112.953%0.53157%0.569SS.*Hα-helixtrans-75.5-35.8179.6-156.40000113.1N337 V345N337-S341 PolarHBondContact O-N 3.07Å; S341-V345 WeakPolarHBondContact O-CB 3.09Å; S341-V345 WeakPolarHBondContact O-CG2 3.5Å; S341-V345 PolarHBondContact O-N 2.96Å; S341-V345 VanDerWaalsContact O-N 3.1Å
342T39.6Very low40.4Very low81 Ų81112.4 Ų112.450%0.49757%0.574SS.*Hα-helixtrans-77-31.6179.8-34.80000112.4S338 M346S338-T342 PolarHBondContact O-N 3.4Å; S338-T342 PolarHBondContact O-OG1 2.96Å; T342-M346 WeakPolarHBondContact O-CG 3.25Å; T342-M346 PolarHBondContact O-N 3.15Å
343A40.6Very low40Very low60 Ų60115.4 Ų115.450%0.49659%0.593SS.*Hα-helixtrans-71.4-37.5173.300000112.4K339 V347K339-A343 PolarHBondContact O-N 3.42Å; A343-V347 WeakPolarHBondContact O-CG2 2.9Å; A343-V347 PolarHBondContact O-N 2.65Å
344A37.6Very low40Very low53 Ų53112.2 Ų112.244%0.43860%0.595SS.*Hα-helixtrans-68.4-38.217500000112.4K340 V347 E348K340-A344 WeakPolarHBondContact O-CB 3.49Å; K340-A344 PolarHBondContact O-N 3.48Å; A344-V347 PolarHBondContact O-N 3.06Å; A344-E348 PolarHBondContact O-N 3.33Å
345V43.4Very low40.1Very low92 Ų92113.1 Ų113.156%0.55860%0.604SS**Hα-helixtrans-73.8-26.8179.7172.70000112.9S341 R349S341-V345 WeakPolarHBondContact O-CB 3.09Å; S341-V345 WeakPolarHBondContact O-CG2 3.5Å; S341-V345 PolarHBondContact O-N 2.96Å; S341-V345 VanDerWaalsContact O-N 3.1Å; V345-R349 PolarHBondContact O-N 3.2Å
346M40.9Very low40.3Very low140 Ų140120.2 Ų120.269%0.6963%0.634SS**Hα-helixtrans-77.1-32.6174.3-73.5-176.579.500112.9T342T342-M346 WeakPolarHBondContact O-CG 3.25Å; T342-M346 PolarHBondContact O-N 3.15Å
347V46.2Very low40.2Very low87 Ų87122.5 Ų122.553%0.52765%0.645SS.*Hα-helixtrans-74.2-29.7176.7174.10000112.3A343 A344A343-V347 WeakPolarHBondContact O-CG2 2.9Å; A343-V347 PolarHBondContact O-N 2.65Å; A344-V347 PolarHBondContact O-N 3.06Å
348E43.4Very low40.5Very low147 Ų147127.4 Ų127.469%0.68766%0.656SS**Hα-helixtrans-77.3-31.1178.6-153.4120.4-147.800112.4A344 K351A344-E348 PolarHBondContact O-N 3.33Å; E348-K351 PolarHBondContact O-N 3.28Å
349R37Very low40.9Very low197 Ų197133.6 Ų133.674%0.74368%0.679SS**Hα-helixtrans-76.1-21.6179.7-151.4177.3-164.4-168.12.4113.6V345 S352V345-R349 PolarHBondContact O-N 3.2Å; R349-S352 PolarHBondContact O-OG 2.88Å
350E41.9Very low40.3Very low159 Ų159131.5 Ų131.574%0.74368%0.684SS**SBendtrans-82-16.8175.8-154.3168.6-163.400112.3
351K43.1Very low40.1Very low177 Ų177127.8 Ų127.877%0.7769%0.685SS**SBendtrans-93.8-8.4175.5-71.4-176.3177.9-178.30114.4E348E348-K351 PolarHBondContact O-N 3.28Å
352S43.7Very low40.3Very low86 Ų86131.3 Ų131.360%0.60170%0.698SS**SBendtrans-109.814.5-175.668.60000114.2R349R349-S352 PolarHBondContact O-OG 2.88Å
353L39.8Very low40Very low136 Ų136134.1 Ų134.171%0.71271%0.71SS**  trans-84.3125.1173.8-81.1152.2000109.6
354P38.5Very low39.8Very low112 Ų112135.6 Ų135.673%0.72772%0.717SS**  trans-63.2141.7174.4-12.225000110.8E356P354-E356 VanDerWaalsContact C-N 3.32Å; P354-E356 PolarHBondContact O-N 3.26Å
355C41.3Very low40.1Very low109 Ų109148.2 Ų148.274%0.73675%0.753SS**SBendtrans-76.978178.1-1600000109.6
356E42.8Very low39.9Very low178 Ų178151.1 Ų151.183%0.83276%0.763SS**  trans-146.724.7177.3-135.9-178.1171.600116.2P354P354-E356 VanDerWaalsContact C-N 3.32Å; P354-E356 PolarHBondContact O-N 3.26Å
357E39.8Very low39.9Very low199 Ų199151.6 Ų151.693%0.9377%0.767SS**  trans-140.851.5166.1-74.6-172.8166.100111.4
358R41.9Very low39.5Very low205 Ų205155.2 Ų155.277%0.77478%0.78SS**  trans-102.3107.6160-105.3-174.9-82.8-129.7-2.3108.1
359H38.8Very low39.3Very low176 Ų176155.7 Ų155.782%0.81579%0.786SS**  trans82.5113.8166.3-68.847.7000118.3
360C32Very low39.4Very low124 Ų124153.1 Ų153.184%0.83879%0.788SS**  165.6112.3121.5-89.30000106.7
361A34.5Very low39.3Very low89 Ų89152.7 Ų152.774%0.73679%0.791SS**  116.4115.777.100000107.8
362D38.8Very low39Very low150 Ų150151 Ų15180%0.80279%0.793SS**  trans26.5149.7142-70.6-32.7000123.8
363D34.5Very low38.6Very low141 Ų141156 Ų15675%0.75481%0.807SS**  trans95.1110.4144.3-68.7-25.1000122.2
364S36.5Very low38.5Very low91 Ų91157.7 Ų157.764%0.63682%0.815SS**  80.2104.9125.374.90000119.9
365W43Very low38.5Very low318 Ų318161.8 Ų161.8100%1.20582%0.823SS**  166.5095.1-89.398.5000110.4

Retrieved 365 of 365 residues in 173.3 ms (Link to these results)

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