A0A3B3V3Z8_9TELE Loading...

Transmembrane protein 98

AlphaFold DB , UniProt , Accession A0A3B3V3Z8, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 224 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
1M66.3Low88.4Confident188 Ų18899.8 Ų99.893%0.92657%0.573SS**  0-31.10-172.3177.5-78.500109.9T3 V4M1-T3 PolarHBondContact O-N 3.11Å; M1-V4 PolarHBondContact O-N 2.73Å
2E82.1Confident88.9Confident143 Ų143101.5 Ų101.567%0.66858%0.577SS**Hα-helixtrans-60.7-35.9179.9-62.798.9147.700114.6V4 V5 I6E2-V4 VanDerWaalsContact C-N 3.32Å; E2-V4 PolarHBondContact O-N 2.55Å; E2-V5 PolarHBondContact O-N 2.97Å; E2-I6 VanDerWaalsContact O-CG1 3.3Å; E2-I6 WeakPolarHBondContact O-CG1 3.31Å; E2-I6 PolarHBondContact O-N 3.3Å
3T85.8Confident89.4Confident102 Ų10297.8 Ų97.863%0.62657%0.567SS**Hα-helixtrans-62.3-37.8-179.351.10000112.8M1 I6 V7M1-T3 PolarHBondContact O-N 3.11Å; T3-I6 PolarHBondContact O-N 3.3Å; T3-V7 VanDerWaalsContact O-CG2 3.28Å; T3-V7 WeakPolarHBondContact O-CG2 3.42Å; T3-V7 PolarHBondContact O-N 3.43Å; T3-V7 VanDerWaalsContact O-N 3.12Å
4V89.1Confident89.8Confident103 Ų10397.3 Ų97.362%0.62457%0.566SS**Hα-helixtrans-68.5-38.8178-178.50000110.9M1 E2 V7 A8M1-V4 PolarHBondContact O-N 2.73Å; E2-V4 VanDerWaalsContact C-N 3.32Å; E2-V4 PolarHBondContact O-N 2.55Å; V4-V7 PolarHBondContact O-N 3.1Å; V4-A8 WeakPolarHBondContact O-CB 3.31Å; V4-A8 PolarHBondContact O-N 2.9Å
5V90.6Very high90.3Very high78 Ų7897.1 Ų97.147%0.47356%0.561SS.*Hα-helixtrans-66.3-43.3177.7178.60000110.9E2 V7 A8 I9E2-V5 PolarHBondContact O-N 2.97Å; V5-V7 VanDerWaalsContact C-N 3.33Å; V5-V7 PolarHBondContact O-N 3.35Å; V5-A8 PolarHBondContact O-N 2.74Å; V5-I9 HydrophobicContact CG1-CD1 3.8Å; V5-I9 HydrophobicContact CG1-CG1 4.44Å; V5-I9 VanDerWaalsContact O-CG1 3.32Å; V5-I9 WeakPolarHBondContact O-CG1 3.31Å; V5-I9 PolarHBondContact O-N 3.39Å
6I90.6Very high90.6Very high117 Ų117100.3 Ų100.360%0.657%0.566SS**Hα-helixtrans-61.6-43.2177.5-67164.5000110.9E2 T3 G10E2-I6 VanDerWaalsContact O-CG1 3.3Å; E2-I6 WeakPolarHBondContact O-CG1 3.31Å; E2-I6 PolarHBondContact O-N 3.3Å; T3-I6 PolarHBondContact O-N 3.3Å; I6-G10 PolarHBondContact O-N 2.91Å
7V92.1Very high90.9Very high98 Ų98100.6 Ų100.659%0.59457%0.565SS**Hα-helixtrans-64.6-43177.3173.20000111.1T3 V4 V5 G10 V11T3-V7 VanDerWaalsContact O-CG2 3.28Å; T3-V7 WeakPolarHBondContact O-CG2 3.42Å; T3-V7 PolarHBondContact O-N 3.43Å; T3-V7 VanDerWaalsContact O-N 3.12Å; V4-V7 PolarHBondContact O-N 3.1Å; V5-V7 VanDerWaalsContact C-N 3.33Å; V5-V7 PolarHBondContact O-N 3.35Å; V7-G10 PolarHBondContact O-N 2.91Å; V7-V11 WeakPolarHBondContact O-CG2 3.42Å; V7-V11 PolarHBondContact O-N 3.28Å
8A92.7Very high91.1Very high50 Ų5098.4 Ų98.441%0.41356%0.562SS.*Hα-helixtrans-63.1-44.617900000112.6V4 V5 G10 V11 L12V4-A8 WeakPolarHBondContact O-CB 3.31Å; V4-A8 PolarHBondContact O-N 2.9Å; V5-A8 PolarHBondContact O-N 2.74Å; A8-G10 VanDerWaalsContact C-N 3.31Å; A8-G10 PolarHBondContact O-N 3.26Å; A8-V11 PolarHBondContact O-N 2.86Å; A8-L12 WeakPolarHBondContact O-CG 3.48Å; A8-L12 PolarHBondContact O-N 3.19Å
9I93.6Very high91.2Very high108 Ų10897.1 Ų97.155%0.55456%0.559SS**Hα-helixtrans-62.9-40.9176.7-66167.5000110.4V5 V11 L12 A13V5-I9 HydrophobicContact CG1-CD1 3.8Å; V5-I9 HydrophobicContact CG1-CG1 4.44Å; V5-I9 VanDerWaalsContact O-CG1 3.32Å; V5-I9 WeakPolarHBondContact O-CG1 3.31Å; V5-I9 PolarHBondContact O-N 3.39Å; I9-V11 PolarHBondContact O-N 3.22Å; I9-L12 PolarHBondContact O-N 2.89Å; I9-A13 VanDerWaalsContact O-CB 3.3Å; I9-A13 WeakPolarHBondContact O-CB 3.42Å; I9-A13 PolarHBondContact O-N 3.03Å
10G94.3Very high91.3Very high35 Ų3597.7 Ų97.736%0.36156%0.555SS.*Hα-helixtrans-58.7-47.2176.100000112.5I6 V7 A8 A13 T14I6-G10 PolarHBondContact O-N 2.91Å; V7-G10 PolarHBondContact O-N 2.91Å; A8-G10 VanDerWaalsContact C-N 3.31Å; A8-G10 PolarHBondContact O-N 3.26Å; G10-A13 PolarHBondContact O-N 2.92Å; G10-T14 VanDerWaalsContact O-CG2 3.32Å; G10-T14 WeakPolarHBondContact O-CG2 3.4Å; G10-T14 PolarHBondContact O-N 3.05Å; G10-T14 PolarHBondContact O-OG1 3.48Å
11V95.3Very high91.3Very high76 Ų7696.8 Ų96.846%0.46155%0.551SS.*Hα-helixtrans-65.7-40.4178.8175.20000111.9V7 A8 I9 T14 I15V7-V11 WeakPolarHBondContact O-CG2 3.42Å; V7-V11 PolarHBondContact O-N 3.28Å; A8-V11 PolarHBondContact O-N 2.86Å; I9-V11 PolarHBondContact O-N 3.22Å; V11-T14 PolarHBondContact O-N 3.36Å; V11-T14 PolarHBondContact O-OG1 3.26Å; V11-I15 HydrophobicContact CG1-CD1 3.83Å; V11-I15 VanDerWaalsContact O-CG1 3.28Å; V11-I15 WeakPolarHBondContact O-CG1 3.48Å; V11-I15 PolarHBondContact O-N 3.31Å; V11-I15 VanDerWaalsContact O-N 3.1Å
12L94.7Very high92.3Very high120 Ų12090.4 Ų90.463%0.62853%0.529SS*.Hα-helixtrans-66.2-41.2177-70.4173.3000111.7A8 I9 I15 F16A8-L12 WeakPolarHBondContact O-CG 3.48Å; A8-L12 PolarHBondContact O-N 3.19Å; I9-L12 PolarHBondContact O-N 2.89Å; L12-I15 PolarHBondContact O-N 2.99Å; L12-F16 VanDerWaalsContact O-CB 3.24Å; L12-F16 WeakPolarHBondContact O-CB 3.38Å; L12-F16 PolarHBondContact O-N 3.47Å
13A95.2Very high92.5Very high53 Ų5388.8 Ų88.844%0.43852%0.524SS..Hα-helixtrans-64.5-39.9177.900000112I9 G10 L17I9-A13 VanDerWaalsContact O-CB 3.3Å; I9-A13 WeakPolarHBondContact O-CB 3.42Å; I9-A13 PolarHBondContact O-N 3.03Å; G10-A13 PolarHBondContact O-N 2.92Å; A13-L17 VanDerWaalsContact O-CB 3.26Å; A13-L17 WeakPolarHBondContact O-CB 3.28Å; A13-L17 PolarHBondContact O-N 3.35Å
14T95.5Very high92.3Very high91 Ų9186.4 Ų86.456%0.55851%0.51SS*.Hα-helixtrans-68.7-43.1178.655.30000112G10 V11 L17 A18G10-T14 VanDerWaalsContact O-CG2 3.32Å; G10-T14 WeakPolarHBondContact O-CG2 3.4Å; G10-T14 PolarHBondContact O-N 3.05Å; G10-T14 PolarHBondContact O-OG1 3.48Å; V11-T14 PolarHBondContact O-N 3.36Å; V11-T14 PolarHBondContact O-OG1 3.26Å; T14-L17 PolarHBondContact O-N 3.07Å; T14-A18 VanDerWaalsContact O-CB 3.24Å; T14-A18 WeakPolarHBondContact O-CB 3.44Å; T14-A18 PolarHBondContact O-N 3.06Å
15I96.4Very high91.9Very high95 Ų9585.6 Ų85.649%0.48751%0.505SS..Hα-helixtrans-62.4-47.8175.6-65.8167.6000110V11 L12 L17 A18 S19V11-I15 HydrophobicContact CG1-CD1 3.83Å; V11-I15 VanDerWaalsContact O-CG1 3.28Å; V11-I15 WeakPolarHBondContact O-CG1 3.48Å; V11-I15 PolarHBondContact O-N 3.31Å; V11-I15 VanDerWaalsContact O-N 3.1Å; L12-I15 PolarHBondContact O-N 2.99Å; I15-L17 PolarHBondContact O-N 3.3Å; I15-A18 PolarHBondContact O-N 3.23Å; I15-S19 WeakPolarHBondContact O-CB 3.31Å; I15-S19 PolarHBondContact O-N 3.17Å; I15-S19 PolarHBondContact O-OG 3.04Å
16F96.1Very high91.2Very high148 Ų14886.1 Ų86.165%0.64951%0.508SS*.Hα-helixtrans-59.7-46.5179.4-178.1-96.6000111.9L12 S19 F20L12-F16 VanDerWaalsContact O-CB 3.24Å; L12-F16 WeakPolarHBondContact O-CB 3.38Å; L12-F16 PolarHBondContact O-N 3.47Å; F16-S19 PolarHBondContact O-N 3.47Å; F16-F20 VanDerWaalsContact O-CB 3.28Å; F16-F20 WeakPolarHBondContact O-CB 3.45Å; F16-F20 PolarHBondContact O-N 3.29Å
17L95.4Very high90.3Very high105 Ų10583 Ų8355%0.5550%0.496SS..Hα-helixtrans-66.7-39.8179.3-167.669.4000111.7A13 T14 I15 F20 V21A13-L17 VanDerWaalsContact O-CB 3.26Å; A13-L17 WeakPolarHBondContact O-CB 3.28Å; A13-L17 PolarHBondContact O-N 3.35Å; T14-L17 PolarHBondContact O-N 3.07Å; I15-L17 PolarHBondContact O-N 3.3Å; L17-F20 PolarHBondContact O-N 3.49Å; L17-V21 WeakPolarHBondContact O-CB 3.32Å; L17-V21 VanDerWaalsContact O-CG2 3.27Å; L17-V21 WeakPolarHBondContact O-CG2 3.31Å; L17-V21 PolarHBondContact O-N 3.13Å
18A93.3Very high89.3Confident62 Ų6286.3 Ų86.351%0.51250%0.498SS..Hα-helixtrans-63.4-45175.900000111.6T14 I15 V21 A22T14-A18 VanDerWaalsContact O-CB 3.24Å; T14-A18 WeakPolarHBondContact O-CB 3.44Å; T14-A18 PolarHBondContact O-N 3.06Å; I15-A18 PolarHBondContact O-N 3.23Å; A18-V21 PolarHBondContact O-N 3.13Å; A18-A22 WeakPolarHBondContact O-CB 3.28Å; A18-A22 PolarHBondContact O-N 2.65Å
19S93.8Very high87.8Confident72 Ų7289.3 Ų89.350%0.50350%0.503SS..Hα-helixtrans-63.2-40.6174.3-67.40000112I15 F16 A22 L23I15-S19 WeakPolarHBondContact O-CB 3.31Å; I15-S19 PolarHBondContact O-N 3.17Å; I15-S19 PolarHBondContact O-OG 3.04Å; F16-S19 PolarHBondContact O-N 3.47Å; S19-A22 PolarHBondContact O-N 3.03Å; S19-L23 WeakPolarHBondContact O-CB 3.14Å; S19-L23 PolarHBondContact O-N 3.36Å
20F93.5Very high86Confident110 Ų11093 Ų9348%0.48251%0.51SS..Hα-helixtrans-65.2-44.9177.1-177-101.8000111.8F16 L17 L23 V24F16-F20 VanDerWaalsContact O-CB 3.28Å; F16-F20 WeakPolarHBondContact O-CB 3.45Å; F16-F20 PolarHBondContact O-N 3.29Å; L17-F20 PolarHBondContact O-N 3.49Å; F20-L23 WeakPolarHBondContact O-CB 3.46Å; F20-L23 PolarHBondContact O-N 2.9Å; F20-V24 HydrophobicContact CD1-CG2 4.17Å; F20-V24 HydrophobicContact CE1-CG2 3.81Å; F20-V24 HydrophobicContact CE2-CG2 4.36Å; F20-V24 HydrophobicContact CZ-CG2 3.91Å; F20-V24 VanDerWaalsContact O-CG2 3.3Å; F20-V24 WeakPolarHBondContact O-CG2 3.29Å; F20-V24 PolarHBondContact O-N 2.82Å
21V90.8Very high84Confident78 Ų7897.9 Ų97.947%0.47352%0.518SS..Hα-helixtrans-64.2-43176.1171.50000110.8L17 A18 L23 V24 V25L17-V21 WeakPolarHBondContact O-CB 3.32Å; L17-V21 VanDerWaalsContact O-CG2 3.27Å; L17-V21 WeakPolarHBondContact O-CG2 3.31Å; L17-V21 PolarHBondContact O-N 3.13Å; A18-V21 PolarHBondContact O-N 3.13Å; V21-L23 VanDerWaalsContact C-N 3.32Å; V21-L23 PolarHBondContact O-N 2.94Å; V21-V24 PolarHBondContact O-N 2.82Å; V21-V25 HydrophobicContact CG1-CG2 4.35Å; V21-V25 WeakPolarHBondContact O-CB 3.3Å; V21-V25 VanDerWaalsContact O-CG2 3.29Å; V21-V25 WeakPolarHBondContact O-CG2 3.26Å; V21-V25 PolarHBondContact O-N 3.47Å
22A86.9Confident81.8Confident55 Ų5598 Ų9846%0.45552%0.521SS..Hα-helixtrans-60.6-43175.200000111.5A18 S19 V25 V26A18-A22 WeakPolarHBondContact O-CB 3.28Å; A18-A22 PolarHBondContact O-N 2.65Å; S19-A22 PolarHBondContact O-N 3.03Å; A22-V25 PolarHBondContact O-N 3.47Å; A22-V26 WeakPolarHBondContact O-CB 3.45Å; A22-V26 VanDerWaalsContact O-CG2 3.3Å; A22-V26 WeakPolarHBondContact O-CG2 3.36Å; A22-V26 PolarHBondContact O-N 2.86Å
23L86.2Confident79.5Confident108 Ų10897.3 Ų97.357%0.56552%0.515SS*.Hα-helixtrans-61.7-47.9174.6-165.9107.3000111S19 F20 V21 V25 V26 C27S19-L23 WeakPolarHBondContact O-CB 3.14Å; S19-L23 PolarHBondContact O-N 3.36Å; F20-L23 WeakPolarHBondContact O-CB 3.46Å; F20-L23 PolarHBondContact O-N 2.9Å; V21-L23 VanDerWaalsContact C-N 3.32Å; V21-L23 PolarHBondContact O-N 2.94Å; L23-V25 VanDerWaalsContact C-N 3.3Å; L23-V25 PolarHBondContact O-N 3.46Å; L23-V26 PolarHBondContact O-N 2.91Å; L23-C27 VanDerWaalsContact O-CB 3.3Å; L23-C27 WeakPolarHBondContact O-CB 3.47Å; L23-C27 PolarHBondContact O-N 3.21Å; L23-C27 PolarHBondContact O-SG 3.41Å
24V81.5Confident77.3Confident53 Ų5398.1 Ų98.132%0.32152%0.515SS..Hα-helixtrans-60.9-38.9176.9170.60000111.3F20 V21 R28F20-V24 HydrophobicContact CD1-CG2 4.17Å; F20-V24 HydrophobicContact CE1-CG2 3.81Å; F20-V24 HydrophobicContact CE2-CG2 4.36Å; F20-V24 HydrophobicContact CZ-CG2 3.91Å; F20-V24 VanDerWaalsContact O-CG2 3.3Å; F20-V24 WeakPolarHBondContact O-CG2 3.29Å; F20-V24 PolarHBondContact O-N 2.82Å; V21-V24 PolarHBondContact O-N 2.82Å; V24-R28 HydrophobicContact CG1-CG 4.21Å; V24-R28 VanDerWaalsContact O-CB 3.27Å; V24-R28 WeakPolarHBondContact O-CB 3.15Å; V24-R28 WeakPolarHBondContact O-CG 3.39Å; V24-R28 PolarHBondContact O-N 2.7Å
25V80.9Confident74.9Confident86 Ų86100 Ų10052%0.52152%0.518SS..Hα-helixtrans-67.8-43.6175.8170.30000110.8V21 A22 L23 R28 H29V21-V25 HydrophobicContact CG1-CG2 4.35Å; V21-V25 WeakPolarHBondContact O-CB 3.3Å; V21-V25 VanDerWaalsContact O-CG2 3.29Å; V21-V25 WeakPolarHBondContact O-CG2 3.26Å; V21-V25 PolarHBondContact O-N 3.47Å; A22-V25 PolarHBondContact O-N 3.47Å; L23-V25 VanDerWaalsContact C-N 3.3Å; L23-V25 PolarHBondContact O-N 3.46Å; V25-R28 PolarHBondContact O-N 2.9Å; V25-H29 WeakPolarHBondContact O-CA 3.47Å; V25-H29 WeakPolarHBondContact O-CB 3.39Å; V25-H29 PolarHBondContact O-N 3.45Å
26V76.6Confident72.1Confident89 Ų89102.3 Ų102.354%0.53953%0.531SS..Hα-helixtrans-65-41.8176.2171.10000110.8A22 L23 H29 R30A22-V26 WeakPolarHBondContact O-CB 3.45Å; A22-V26 VanDerWaalsContact O-CG2 3.3Å; A22-V26 WeakPolarHBondContact O-CG2 3.36Å; A22-V26 PolarHBondContact O-N 2.86Å; L23-V26 PolarHBondContact O-N 2.91Å; V26-H29 PolarHBondContact O-N 3.19Å; V26-R30 HydrophobicContact CG1-CG 4.27Å; V26-R30 WeakPolarHBondContact O-CB 3.33Å; V26-R30 WeakPolarHBondContact O-CG 3.36Å; V26-R30 PolarHBondContact O-N 2.94Å
27C70.6Confident69.7Low52 Ų52101.9 Ų101.935%0.35154%0.535SS..Hα-helixtrans-61.8-53.2173.1-68.40000110.1L23 H29 R30 Y31L23-C27 VanDerWaalsContact O-CB 3.3Å; L23-C27 WeakPolarHBondContact O-CB 3.47Å; L23-C27 PolarHBondContact O-N 3.21Å; L23-C27 PolarHBondContact O-SG 3.41Å; C27-H29 VanDerWaalsContact C-N 3.32Å; C27-H29 PolarHBondContact O-N 3.2Å; C27-R30 PolarHBondContact O-N 2.95Å; C27-Y31 HydrophobicContact CB-CD2 4.44Å; C27-Y31 WeakPolarHBondContact O-CB 3.4Å; C27-Y31 WeakPolarHBondContact O-CD2 3.47Å; C27-Y31 PolarHBondContact O-N 3.32Å
28R71.6Confident67.3Low167 Ų167101.6 Ų101.663%0.6353%0.533SS*.Hα-helixtrans-62.3-37.9178.1-72.1-175.578906.6112.7V24 V25 C32V24-R28 HydrophobicContact CG1-CG 4.21Å; V24-R28 VanDerWaalsContact O-CB 3.27Å; V24-R28 WeakPolarHBondContact O-CB 3.15Å; V24-R28 WeakPolarHBondContact O-CG 3.39Å; V24-R28 PolarHBondContact O-N 2.7Å; V25-R28 PolarHBondContact O-N 2.9Å; R28-C32 WeakPolarHBondContact O-CA 3.36Å; R28-C32 WeakPolarHBondContact O-CB 3.39Å; R28-C32 PolarHBondContact O-N 2.82Å; R28-C32 PolarHBondContact O-SG 3.5Å
29H61.6Low64.6Low113 Ų113105.6 Ų105.652%0.52354%0.541SS..Hα-helixtrans-67.5-45.5176.3-172.1-97.5000110.2V25 V26 C27 Y31 H33V25-H29 WeakPolarHBondContact O-CA 3.47Å; V25-H29 WeakPolarHBondContact O-CB 3.39Å; V25-H29 PolarHBondContact O-N 3.45Å; V26-H29 PolarHBondContact O-N 3.19Å; C27-H29 VanDerWaalsContact C-N 3.32Å; C27-H29 PolarHBondContact O-N 3.2Å; H29-Y31 PolarHBondContact O-N 3.19Å; H29-H33 AromaticContact CE1-CD2 3.61Å; H29-H33 AromaticContact NE2-CD2 3.55Å; H29-H33 WeakPolarHBondContact O-CB 3.38Å; H29-H33 PolarHBondContact O-N 2.95Å
30R56.1Low62Low186 Ų186109.7 Ų109.770%0.70255%0.552SS**Hα-helixtrans-68.4-33.6176.5-71.8-74.5-170.8155.11.4113.3V26 C27V26-R30 HydrophobicContact CG1-CG 4.27Å; V26-R30 WeakPolarHBondContact O-CB 3.33Å; V26-R30 WeakPolarHBondContact O-CG 3.36Å; V26-R30 PolarHBondContact O-N 2.94Å; C27-R30 PolarHBondContact O-N 2.95Å
31Y52.1Low59.3Low137 Ų137109.8 Ų109.854%0.53755%0.552SS.*Hα-helixtrans-88.8-28.8-176.8-81.6-108.9000113.8C27 H29 P34 I84C27-Y31 HydrophobicContact CB-CD2 4.44Å; C27-Y31 WeakPolarHBondContact O-CB 3.4Å; C27-Y31 WeakPolarHBondContact O-CD2 3.47Å; C27-Y31 PolarHBondContact O-N 3.32Å; H29-Y31 PolarHBondContact O-N 3.19Å; Y31-P34 VanDerWaalsContact C-CD 3.44Å; Y31-P34 WeakPolarHBondContact O-CD 3.36Å; Y31-P34 WeakPolarHBondContact O-CG 3.43Å; Y31-I84 HydrophobicContact CE1-CG2 3.61Å; Y31-I84 VanDerWaalsContact OH-CG2 3.26Å; Y31-I84 WeakPolarHBondContact OH-CG2 3.32Å
32C49Very low56.5Low77 Ų77112 Ų11252%0.5256%0.561SS.*Hα-helixtrans-99.4-13.6177.9-58.30000113.5R28R28-C32 WeakPolarHBondContact O-CA 3.36Å; R28-C32 WeakPolarHBondContact O-CB 3.39Å; R28-C32 PolarHBondContact O-N 2.82Å; R28-C32 PolarHBondContact O-SG 3.5Å
33H46.6Very low53.8Low107 Ų107113.4 Ų113.450%0.49557%0.568SS.*G310 helixtrans-79-9.4174.2-160.1-44.5000116.1H29 H35H29-H33 AromaticContact CE1-CD2 3.61Å; H29-H33 AromaticContact NE2-CD2 3.55Å; H29-H33 WeakPolarHBondContact O-CB 3.38Å; H29-H33 PolarHBondContact O-N 2.95Å; H33-H35 PolarHBondContact O-N 2.86Å
34P48.4Very low51.4Low69 Ų69116.3 Ų116.345%0.44858%0.576SS.*G310 helixtrans-71.4-9.5172.728.6-27.6000112.3Y31 L38Y31-P34 VanDerWaalsContact C-CD 3.44Å; Y31-P34 WeakPolarHBondContact O-CD 3.36Å; Y31-P34 WeakPolarHBondContact O-CG 3.43Å; P34-L38 WeakPolarHBondContact O-CD1 3.49Å; P34-L38 VanDerWaalsContact O-CG 3.23Å; P34-L38 WeakPolarHBondContact O-CG 3.38Å
35H45.3Very low49.1Very low130 Ų130119 Ų11960%0.60260%0.595SS**G310 helixtrans-85.3-22.6-175.3-86.3-76.7000116.3H33 L38H33-H35 PolarHBondContact O-N 2.86Å; H35-L38 PolarHBondContact O-N 3.37Å
36D38.7Very low46.8Very low145 Ų145120.7 Ų120.778%0.77561%0.606SS**THydrogen-bonded Turntrans-84.6-20.2-173.5-104.3-7.5000114.3
37L45Very low44.9Very low139 Ų139122 Ų12273%0.72861%0.614SS**THydrogen-bonded Turntrans-85.4-16.8167.7-89.2165.6000112.7
38L44Very low43Very low98 Ų98126.3 Ų126.351%0.51363%0.633SS.*G310 helixtrans-77.9-26.7-179.9-79.2173.7000113.2P34 H35 H40 F41 D42P34-L38 WeakPolarHBondContact O-CD1 3.49Å; P34-L38 VanDerWaalsContact O-CG 3.23Å; P34-L38 WeakPolarHBondContact O-CG 3.38Å; H35-L38 PolarHBondContact O-N 3.37Å; L38-H40 PolarHBondContact O-N 3.35Å; L38-F41 PolarHBondContact O-N 3.4Å; L38-D42 PolarHBondContact O-N 2.89Å
39H36.7Very low41.4Very low146 Ų146125.8 Ų125.868%0.67664%0.642SS**G310 helixtrans-73.1-13.6-178.7-156.2-75.7000113.6
40H38.9Very low40.1Very low158 Ų158128 Ų12873%0.73166%0.656SS**G310 helixtrans-84.1-24.3176-158.560.8000113.2L38L38-H40 PolarHBondContact O-N 3.35Å
41F37.7Very low39.1Very low112 Ų112122.4 Ų122.449%0.49166%0.656SS.*THydrogen-bonded Turntrans-91.5-18.5179.2-84.6-82.3000114L38 S43L38-F41 PolarHBondContact O-N 3.4Å; F41-S43 VanDerWaalsContact C-N 3.33Å
42D32.2Very low38.2Very low124 Ų124120.6 Ų120.666%0.66367%0.67SS**  trans-88.410.1177.7-146.9-75.2000113.8L38 K44L38-D42 PolarHBondContact O-N 2.89Å; D42-K44 PolarHBondContact O-N 3.41Å
43S30.5Very low37.3Very low86 Ų86125.5 Ų125.560%0.60169%0.687SS**  trans-73.282169.2-72.10000109.7F41 P45F41-S43 VanDerWaalsContact C-N 3.33Å; S43-P45 WeakPolarHBondContact O-CD 3.25Å
44K35.7Very low36.8Very low168 Ų168129 Ų12973%0.7370%0.704SS**  trans-39.7118.3158.6-87.3166.8166.8152.60109.1D42 T46D42-K44 PolarHBondContact O-N 3.41Å; K44-T46 VanDerWaalsContact C-N 3.27Å; K44-T46 PolarHBondContact O-N 2.95Å; K44-T46 VanDerWaalsContact O-N 3.13Å
45P33.5Very low35.9Very low109 Ų109131.5 Ų131.571%0.70872%0.717SS**  trans-73.3100.1145.429.9-21.7000104.6S43 V47S43-P45 WeakPolarHBondContact O-CD 3.25Å; P45-V47 PolarHBondContact O-N 3.01Å
46T31.8Very low35.2Very low123 Ų123133.8 Ų133.876%0.75573%0.729SS**  trans-52.597.915441.20000106.5K44 D48K44-T46 VanDerWaalsContact C-N 3.27Å; K44-T46 PolarHBondContact O-N 2.95Å; K44-T46 VanDerWaalsContact O-N 3.13Å; T46-D48 PolarHBondContact O-N 2.95Å
47V37Very low34.6Very low117 Ų117132.8 Ų132.871%0.70973%0.733SS**  trans-67.594.8169.7175.70000105.1P45 L49P45-V47 PolarHBondContact O-N 3.01Å; V47-L49 PolarHBondContact O-N 3.33Å; V47-L49 VanDerWaalsContact O-N 3.1Å
48D30.4Very low33.8Very low142 Ų142134.8 Ų134.876%0.75974%0.738SS**  trans-61.2110.3169.9-150.52.3000106.7T46 I50T46-D48 PolarHBondContact O-N 2.95Å; D48-I50 VanDerWaalsContact C-N 3.32Å; D48-I50 PolarHBondContact O-N 3.49Å
49L37.2Very low33.3Very low156 Ų156135 Ų13582%0.81775%0.746SS**  trans-61.692.3175.2-109.272.9000108.1V47 G51V47-L49 PolarHBondContact O-N 3.33Å; V47-L49 VanDerWaalsContact O-N 3.1Å; L49-G51 VanDerWaalsContact C-N 3.28Å; L49-G51 PolarHBondContact O-N 3.12Å
50I35.7Very low33Very low160 Ų160133.2 Ų133.282%0.82175%0.75SS**  trans-75.993.1160.1-76.4161.6000107.1D48D48-I50 VanDerWaalsContact C-N 3.32Å; D48-I50 PolarHBondContact O-N 3.49Å
51G34.2Very low32.7Very low68 Ų68134 Ų13470%0.70175%0.754SS**  trans-68.6129.5160.100000110.2L49L49-G51 VanDerWaalsContact C-N 3.28Å; L49-G51 PolarHBondContact O-N 3.12Å
52A33.3Very low32.7Very low99 Ų99135.2 Ų135.282%0.81877%0.765SS**  trans154.8101.3140.200000108.7
53M30.4Very low32.7Very low179 Ų179137.8 Ų137.888%0.88277%0.773SS**  177.5113.7116.3-171.4159.3177.600109.2
54E37Very low33.4Very low182 Ų182138.5 Ų138.585%0.8577%0.769SS**  trans-56134.4167.4-65.2173.297.900111
55T27.8Very low33.5Very low120 Ų120137.6 Ų137.674%0.73677%0.773SS**  trans-159.8107.9132.3-3.80000110.3
56Q30.6Very low33.8Very low179 Ų179139.4 Ų139.484%0.83678%0.776SS**  trans30.1112141.6-66.3174.2-21.400117.5
57S26.6Very low34.4Very low124 Ų124135.6 Ų135.687%0.86775%0.753SS**  169105117.4-66.90000110.4
58E27.3Very low34.9Very low180 Ų180134.5 Ų134.584%0.84175%0.746SS**  trans-69.3167.4153.5-65.4-85.496.600109.2
59P35.4Very low35.8Very low103 Ų103129.2 Ų129.267%0.66972%0.717SS**  cis-132.1154.2-14.132-13.3000112.7
60S29.6Very low36.4Very low109 Ų109123.7 Ų123.776%0.76269%0.69SS**  trans-140.194.8146-163.80000107.4L62S60-L62 PolarHBondContact O-N 2.98Å
61E31.6Very low36.9Very low175 Ų175118.8 Ų118.882%0.81867%0.666SS**  trans-51.5103.1161.7-70.7176.1108.300108.7
62L37.9Very low37.7Very low137 Ų137120 Ų12072%0.71766%0.661SS**  trans-118.194.7151-73.3173.7000104.5S60 L64S60-L62 PolarHBondContact O-N 2.98Å; L62-L64 VanDerWaalsContact C-N 3.28Å; L62-L64 HydrophobicContact CB-CD1 3.84Å; L62-L64 PolarHBondContact O-N 3.42Å
63E33.9Very low38.4Very low177 Ų177121.2 Ų121.283%0.82765%0.65SS**  trans-52.795.8164.7-86.5176.8102.200108.4D65E63-D65 VanDerWaalsContact C-N 3.27Å
64L43.3Very low39.6Very low102 Ų102113.3 Ų113.353%0.53461%0.611SS.*  trans-98.830163.1-93.789.3000110.2L62 D66 V67 I129L62-L64 VanDerWaalsContact C-N 3.28Å; L62-L64 HydrophobicContact CB-CD1 3.84Å; L62-L64 PolarHBondContact O-N 3.42Å; L64-D66 PolarHBondContact O-N 3.24Å; L64-V67 HydrophobicContact CB-CG2 4.32Å; L64-V67 HydrophobicContact CD2-CG2 4.07Å; L64-V67 HydrophobicContact CG-CG2 4.23Å; L64-I129 HydrophobicContact CD2-CD1 4.38Å
65D39.3Very low40.4Very low149 Ų149109.6 Ų109.680%0.79759%0.594SS**THydrogen-bonded Turntrans-64.9-7.4-174.6-165.152.7000114E63E63-D65 VanDerWaalsContact C-N 3.27Å
66D40Very low41.6Very low147 Ų147106 Ų10679%0.78658%0.576SS**THydrogen-bonded Turntrans-126.722.1-172.5-145.914.4000114.4L64 V68L64-D66 PolarHBondContact O-N 3.24Å; D66-V68 PolarHBondContact O-N 3.27Å
67V44Very low42.7Very low42 Ų42100.2 Ų100.226%0.25555%0.55SS..  trans-96.370.2170.4-139.10000109.9L64 I69 I129L64-V67 HydrophobicContact CB-CG2 4.32Å; L64-V67 HydrophobicContact CD2-CG2 4.07Å; L64-V67 HydrophobicContact CG-CG2 4.23Å; V67-I69 HydrophobicContact CB-CD1 4.11Å; V67-I69 HydrophobicContact CB-CG1 3.79Å; V67-I69 HydrophobicContact CG1-CD1 3.67Å; V67-I69 HydrophobicContact CG1-CG1 3.16Å; V67-I69 PolarHBondContact O-N 3.48Å; V67-I129 HydrophobicContact CG1-CG2 4.25Å
68V46.4Very low44.2Very low95 Ų9595.2 Ų95.258%0.57651%0.513SS*.  trans-67.378.2157.2-179.50000106.7D66 T70D66-V68 PolarHBondContact O-N 3.27Å; V68-T70 WeakPolarHBondContact CG1-O 3.34Å; V68-T70 PolarHBondContact O-N 3.26Å
69I49.7Very low45.4Very low30 Ų3093.8 Ų93.815%0.15451%0.507CS..  trans-67.3-26.6-175.5-66.3171.6000110.6V67 V109 A132 S136V67-I69 HydrophobicContact CB-CD1 4.11Å; V67-I69 HydrophobicContact CB-CG1 3.79Å; V67-I69 HydrophobicContact CG1-CD1 3.67Å; V67-I69 HydrophobicContact CG1-CG1 3.16Å; V67-I69 PolarHBondContact O-N 3.48Å; I69-V109 HydrophobicContact CD1-CG1 3.44Å; I69-V109 VanDerWaalsContact CD1-CG1 3.44Å; I69-V109 HydrophobicContact CD1-CG2 4.49Å; I69-V109 HydrophobicContact CG2-CG1 4.48Å; I69-V109 HydrophobicContact CG2-CG2 4.03Å; I69-A132 HydrophobicContact CG2-CB 4.02Å; I69-S136 PolarHBondContact O-OG 2.88Å
70T49.6Very low46.2Very low41 Ų4193.3 Ų93.325%0.25250%0.499SS..SBendtrans-125.3120.7174.644.20000107.5V68 P72 H102V68-T70 WeakPolarHBondContact CG1-O 3.34Å; V68-T70 PolarHBondContact O-N 3.26Å; T70-P72 VanDerWaalsContact O-CD 3.28Å; T70-P72 WeakPolarHBondContact O-CD 3.22Å; T70-H102 WeakPolarHBondContact CB-NE2 3.42Å; T70-H102 WeakPolarHBondContact CG2-NE2 3.3Å
71N45.9Very low47.1Very low57 Ų5795.6 Ų95.631%0.30550%0.497SS..  trans-63118.8176.3177.4-11.1000108H73 I74N71-H73 PolarHBondContact O-N 3.4Å; N71-H73 WeakPolarHBondContact OD1-CB 3.45Å; N71-H73 PolarHBondContact OD1-N 2.73Å; N71-I74 HydrophobicContact CB-CD1 3.81Å; N71-I74 HydrophobicContact CB-CG1 3.95Å; N71-I74 WeakPolarHBondContact O-CB 3.26Å; N71-I74 WeakPolarHBondContact O-CG1 3.34Å; N71-I74 PolarHBondContact O-N 2.93Å
72P51.1Low48.2Very low93 Ų9394 Ų9460%0.60449%0.494SS*.THydrogen-bonded Turntrans-62.7-11.2-177.923.8-32.9000113.4T70T70-P72 VanDerWaalsContact O-CD 3.28Å; T70-P72 WeakPolarHBondContact O-CD 3.22Å
73H49Very low49.1Very low125 Ų12589.6 Ų89.658%0.57947%0.468SS*.Hα-helixtrans-80.4-11.8172.1-75.3-76000114.5N71 E75 A76 I77N71-H73 PolarHBondContact O-N 3.4Å; N71-H73 WeakPolarHBondContact OD1-CB 3.45Å; N71-H73 PolarHBondContact OD1-N 2.73Å; H73-E75 VanDerWaalsContact C-N 3.32Å; H73-E75 PolarHBondContact O-N 2.97Å; H73-A76 PolarHBondContact O-N 3.48Å; H73-I77 HydrophobicContact CB-CD1 4.42Å; H73-I77 WeakPolarHBondContact O-CB 3.46Å; H73-I77 WeakPolarHBondContact O-CD1 3.38Å; H73-I77 WeakPolarHBondContact O-CG1 3.25Å; H73-I77 PolarHBondContact O-N 2.92Å
74I55.2Low49.9Very low12 Ų1285.2 Ų85.26%0.06245%0.45CS..Hα-helixtrans-65.8-39.4-179.5-64.4163.6000110.3N71 I77 L78 V139N71-I74 HydrophobicContact CB-CD1 3.81Å; N71-I74 HydrophobicContact CB-CG1 3.95Å; N71-I74 WeakPolarHBondContact O-CB 3.26Å; N71-I74 WeakPolarHBondContact O-CG1 3.34Å; N71-I74 PolarHBondContact O-N 2.93Å; I74-I77 PolarHBondContact O-N 3.01Å; I74-L78 HydrophobicContact CG2-CD1 3.42Å; I74-L78 VanDerWaalsContact CG2-CD1 3.42Å; I74-L78 HydrophobicContact CG2-CG 4.09Å; I74-L78 VanDerWaalsContact O-CB 3.3Å; I74-L78 WeakPolarHBondContact O-CB 3.13Å; I74-L78 WeakPolarHBondContact O-CD1 3.32Å; I74-L78 WeakPolarHBondContact O-CG 3.32Å; I74-L78 PolarHBondContact O-N 3.05Å; I74-V139 HydrophobicContact CD1-CG1 4.18Å; I74-V139 HydrophobicContact CG1-CG1 4.4Å; I74-V139 HydrophobicContact CG2-CG1 4.47Å
75E53.2Low50.4Low105 Ų10589.4 Ų89.449%0.49147%0.466SS..Hα-helixtrans-61.7-46.3176-65.3-174.4169.300111.3H73 I77 L78 E79 H102H73-E75 VanDerWaalsContact C-N 3.32Å; H73-E75 PolarHBondContact O-N 2.97Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 2.93Å; E75-L78 CarbonylContact O-C 3.56Å; E75-L78 PolarHBondContact O-N 3.16Å; E75-E79 WeakPolarHBondContact O-CB 3.12Å; E75-E79 VanDerWaalsContact O-CG 3.3Å; E75-E79 WeakPolarHBondContact O-CG 3.38Å; E75-E79 PolarHBondContact O-N 3.38Å; E75-H102 IonicContact OE1-CE1 3.93Å
76A53.6Low51.2Low44 Ų4484.9 Ų84.936%0.36444%0.442SS..Hα-helixtrans-63.1-36.5176.100000112.9H73 N80H73-A76 PolarHBondContact O-N 3.48Å; A76-N80 PolarHBondContact O-N 3.49Å; A76-N80 PolarHBondContact O-ND2 3.13Å
77I55Low51.9Low57 Ų5783.3 Ų83.329%0.29245%0.45SS..Hα-helixtrans-69-40.2176.3-67.3164.9000110.4H73 I74 E75 E79 W83 V143H73-I77 HydrophobicContact CB-CD1 4.42Å; H73-I77 WeakPolarHBondContact O-CB 3.46Å; H73-I77 WeakPolarHBondContact O-CD1 3.38Å; H73-I77 WeakPolarHBondContact O-CG1 3.25Å; H73-I77 PolarHBondContact O-N 2.92Å; I74-I77 PolarHBondContact O-N 3.01Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 2.93Å; I77-E79 VanDerWaalsContact C-N 3.32Å; I77-E79 PolarHBondContact O-N 3.35Å; I77-W83 HydrophobicContact CG2-CH2 4.1Å; I77-W83 HydrophobicContact CG2-CZ2 3.57Å; I77-W83 PolarHBondContact O-NE1 3.49Å; I77-V143 HydrophobicContact CG2-CG1 4.28Å
78L56.3Low52.8Low19 Ų1984.7 Ų84.710%0.09946%0.462CS..Hα-helixtrans-76.1-13.8178.7-70.2166.3000114.2I74 E75 I95 L98 K99I74-L78 HydrophobicContact CG2-CD1 3.42Å; I74-L78 VanDerWaalsContact CG2-CD1 3.42Å; I74-L78 HydrophobicContact CG2-CG 4.09Å; I74-L78 VanDerWaalsContact O-CB 3.3Å; I74-L78 WeakPolarHBondContact O-CB 3.13Å; I74-L78 WeakPolarHBondContact O-CD1 3.32Å; I74-L78 WeakPolarHBondContact O-CG 3.32Å; I74-L78 PolarHBondContact O-N 3.05Å; E75-L78 CarbonylContact O-C 3.56Å; E75-L78 PolarHBondContact O-N 3.16Å; L78-I95 HydrophobicContact CD2-CB 4.38Å; L78-I95 HydrophobicContact CD2-CG1 4.46Å; L78-I95 HydrophobicContact CD2-CG2 3.85Å; L78-L98 HydrophobicContact CD2-CB 3.84Å; L78-L98 HydrophobicContact CD2-CD1 4.09Å; L78-K99 HydrophobicContact CD1-CG 3.96Å; L78-K99 HydrophobicContact CD2-CG 4.24Å
79E54.5Low54.2Low151 Ų15181.5 Ų81.571%0.70645%0.448SS*.Hα-helixtrans-95.9-18.1176.7-79.6-176.1166.300114.1E75 I77 E81E75-E79 WeakPolarHBondContact O-CB 3.12Å; E75-E79 VanDerWaalsContact O-CG 3.3Å; E75-E79 WeakPolarHBondContact O-CG 3.38Å; E75-E79 PolarHBondContact O-N 3.38Å; I77-E79 VanDerWaalsContact C-N 3.32Å; I77-E79 PolarHBondContact O-N 3.35Å; E79-E81 PolarHBondContact O-N 3.07Å
80N50.6Low55.7Low93 Ų9380.6 Ų80.650%0.49744%0.443SS..  trans-64.2137.5177.3-83.2-63.2000110.5A76 D82 W83A76-N80 PolarHBondContact O-N 3.49Å; A76-N80 PolarHBondContact O-ND2 3.13Å; N80-D82 VanDerWaalsContact C-N 3.31Å; N80-D82 PolarHBondContact O-N 2.92Å; N80-W83 PolarHBondContact O-NE1 2.96Å
81E50.2Low57.2Low157 Ų15778.9 Ų78.973%0.73443%0.432SS*.G310 helixtrans-84.5-0.4-177.4-72.2-173.5130.900113.5E79 W83 I84E79-E81 PolarHBondContact O-N 3.07Å; E81-W83 PolarHBondContact O-N 3.43Å; E81-I84 HydrophobicContact CB-CD1 4.03Å; E81-I84 HydrophobicContact CG-CD1 4.37Å; E81-I84 WeakPolarHBondContact O-CB 3.37Å; E81-I84 VanDerWaalsContact O-CD1 3.3Å; E81-I84 WeakPolarHBondContact O-CD1 3.4Å; E81-I84 WeakPolarHBondContact O-CG1 3.47Å
82D52.8Low59Low141 Ų14179.7 Ų79.775%0.75444%0.443SS*.G310 helixtrans-74.8-5.1-172.8-65.7-29.1000114.4N80 I84N80-D82 VanDerWaalsContact C-N 3.31Å; N80-D82 PolarHBondContact O-N 2.92Å; D82-I84 VanDerWaalsContact C-N 3.29Å; D82-I84 PolarHBondContact O-N 2.95Å
83W58.2Low60.7Low45 Ų4577.4 Ų77.417%0.1742%0.424CS..G310 helixtrans-86.20.2-179.5-4991.1000113.5I77 N80 E81 V91 I95 V143 M146 Y147I77-W83 HydrophobicContact CG2-CH2 4.1Å; I77-W83 HydrophobicContact CG2-CZ2 3.57Å; I77-W83 PolarHBondContact O-NE1 3.49Å; N80-W83 PolarHBondContact O-NE1 2.96Å; E81-W83 PolarHBondContact O-N 3.43Å; W83-V91 HydrophobicContact CB-CG1 3.54Å; W83-V91 HydrophobicContact CE3-CG1 4.18Å; W83-V91 HydrophobicContact CG-CG1 4.36Å; W83-V91 WeakPolarHBondContact O-CG1 3.31Å; W83-I95 HydrophobicContact CB-CD1 3.76Å; W83-I95 HydrophobicContact CD2-CD1 4.49Å; W83-I95 HydrophobicContact CG-CD1 3.92Å; W83-V143 HydrophobicContact CH2-CG1 4.01Å; W83-M146 HydrophobicContact CD2-CE 4.46Å; W83-M146 HydrophobicContact CE3-CB 4.47Å; W83-M146 HydrophobicContact CE3-CE 3.71Å; W83-M146 HydrophobicContact CZ3-CB 4.04Å; W83-M146 HydrophobicContact CZ3-CE 3.9Å; W83-Y147 HydrophobicContact CH2-CE1 4.33Å; W83-Y147 HydrophobicContact CH2-CE2 4.26Å; W83-Y147 AromaticContact CH2-CZ 3.82Å; W83-Y147 HydrophobicContact CZ3-CE1 4.49Å
84I51.1Low62.5Low85 Ų8571.5 Ų71.544%0.43640%0.397SS..G310 helixtrans-83.7-9-167.6-65.5175.1000113.3Y31 E81 D82 D86Y31-I84 HydrophobicContact CE1-CG2 3.61Å; Y31-I84 VanDerWaalsContact OH-CG2 3.26Å; Y31-I84 WeakPolarHBondContact OH-CG2 3.32Å; E81-I84 HydrophobicContact CB-CD1 4.03Å; E81-I84 HydrophobicContact CG-CD1 4.37Å; E81-I84 WeakPolarHBondContact O-CB 3.37Å; E81-I84 VanDerWaalsContact O-CD1 3.3Å; E81-I84 WeakPolarHBondContact O-CD1 3.4Å; E81-I84 WeakPolarHBondContact O-CG1 3.47Å; D82-I84 VanDerWaalsContact C-N 3.29Å; D82-I84 PolarHBondContact O-N 2.95Å; I84-D86 PolarHBondContact O-N 3.3Å
85E52.3Low64Low189 Ų18972.1 Ų72.188%0.88340%0.4SS*.G310 helixtrans-80.60.3-177.8-60.5-165164.600114.7A87E85-A87 PolarHBondContact O-N 3.42Å; E85-A87 VanDerWaalsContact O-N 3.09Å
86D56.9Low65.6Low54 Ų5468.7 Ų68.729%0.28939%0.387SS..  trans-73.1100.5179.9-111.624.5000111.9I84 S88 G89 V91I84-D86 PolarHBondContact O-N 3.3Å; D86-S88 PolarHBondContact O-N 3.47Å; D86-G89 PolarHBondContact O-N 3.14Å; D86-V91 HydrophobicContact CB-CB 4.14Å; D86-V91 HydrophobicContact CB-CG2 4.48Å; D86-V91 VanDerWaalsContact OD2-CB 3.26Å; D86-V91 WeakPolarHBondContact OD2-CB 3.45Å; D86-V91 WeakPolarHBondContact OD2-CG2 3.49Å
87A54.6Low67.2Low115 Ų11566.6 Ų66.695%0.9537%0.37SS*.THydrogen-bonded Turntrans-58.4-19.2176.700000114E85E85-A87 PolarHBondContact O-N 3.42Å; E85-A87 VanDerWaalsContact O-N 3.09Å
88S63.3Low68.8Low71 Ų7164.1 Ų64.150%0.49736%0.357SS..THydrogen-bonded Turntrans-83.6-19.8178.568.40000113.7D86 L90D86-S88 PolarHBondContact O-N 3.47Å; S88-L90 PolarHBondContact O-N 2.62Å; S88-L90 PolarHBondContact OG-N 3.3Å
89G74.6Confident70.1Confident28 Ų2867.7 Ų67.729%0.28937%0.372SS..  trans69.50.9-171.500000115.1D86 V91 S92 H93D86-G89 PolarHBondContact O-N 3.14Å; G89-V91 PolarHBondContact O-N 3.21Å; G89-S92 WeakPolarHBondContact O-CB 3.5Å; G89-S92 PolarHBondContact O-N 3.45Å; G89-S92 VanDerWaalsContact O-N 3.14Å; G89-H93 PolarHBondContact O-CD2 2.82Å; G89-H93 PolarHBondContact O-N 2.96Å
90L81.2Confident71.7Confident11 Ų1162 Ų626%0.05835%0.347CS..Hα-helixtrans-63.2-41.9-174.3-72.4170.9000113.1S88 S92 H93 C94 L150 P152 L155 L200 A203S88-L90 PolarHBondContact O-N 2.62Å; S88-L90 PolarHBondContact OG-N 3.3Å; L90-S92 VanDerWaalsContact C-N 3.26Å; L90-S92 PolarHBondContact O-N 2.96Å; L90-H93 PolarHBondContact O-N 3.3Å; L90-H93 VanDerWaalsContact O-N 3.15Å; L90-C94 PolarHBondContact O-N 2.83Å; L90-C94 PolarHBondContact O-SG 3.44Å; L90-L150 HydrophobicContact CD1-CD2 3.9Å; L90-P152 HydrophobicContact CD1-CB 4.41Å; L90-P152 HydrophobicContact CD1-CG 4.25Å; L90-L155 HydrophobicContact CB-CD2 4.43Å; L90-L200 HydrophobicContact CD2-CD1 4.48Å; L90-A203 HydrophobicContact CD1-CB 3.81Å; L90-A203 HydrophobicContact CD2-CB 3.47Å; L90-A203 VanDerWaalsContact CD2-CB 3.47Å; L90-A203 HydrophobicContact CG-CB 4.2Å
91V82.3Confident73.4Confident4 Ų457.7 Ų57.72%0.02432%0.323CS..Hα-helixtrans-60.2-36.5176159.10000112W83 D86 G89 C94 I95 M146 L150W83-V91 HydrophobicContact CB-CG1 3.54Å; W83-V91 HydrophobicContact CE3-CG1 4.18Å; W83-V91 HydrophobicContact CG-CG1 4.36Å; W83-V91 WeakPolarHBondContact O-CG1 3.31Å; D86-V91 HydrophobicContact CB-CB 4.14Å; D86-V91 HydrophobicContact CB-CG2 4.48Å; D86-V91 VanDerWaalsContact OD2-CB 3.26Å; D86-V91 WeakPolarHBondContact OD2-CB 3.45Å; D86-V91 WeakPolarHBondContact OD2-CG2 3.49Å; G89-V91 PolarHBondContact O-N 3.21Å; V91-C94 WeakPolarHBondContact O-CB 3.05Å; V91-C94 PolarHBondContact O-N 3.34Å; V91-I95 HydrophobicContact CG1-CD1 3.95Å; V91-I95 VanDerWaalsContact O-CG1 3.26Å; V91-I95 WeakPolarHBondContact O-CG1 3.03Å; V91-I95 PolarHBondContact O-N 2.93Å; V91-M146 HydrophobicContact CB-CE 4.31Å; V91-M146 HydrophobicContact CG1-CE 3.68Å; V91-M146 HydrophobicContact CG2-CB 4.16Å; V91-M146 HydrophobicContact CG2-CE 4.26Å; V91-M146 HydrophobicContact CG2-CG 4.33Å; V91-L150 HydrophobicContact CG2-CD1 3.6Å
92S83.4Confident75.2Confident75 Ų7551.1 Ų51.152%0.52429%0.293SS..Hα-helixtrans-62.6-44.1174.2-179.80000112G89 L90 C94 I95 S96G89-S92 WeakPolarHBondContact O-CB 3.5Å; G89-S92 PolarHBondContact O-N 3.45Å; G89-S92 VanDerWaalsContact O-N 3.14Å; L90-S92 VanDerWaalsContact C-N 3.26Å; L90-S92 PolarHBondContact O-N 2.96Å; S92-C94 VanDerWaalsContact C-N 3.33Å; S92-C94 PolarHBondContact O-N 2.83Å; S92-I95 PolarHBondContact O-N 2.99Å; S92-S96 PolarHBondContact O-N 2.89Å; S92-S96 VanDerWaalsContact O-N 3.13Å; S92-S96 PolarHBondContact O-OG 3.01Å
93H85.8Confident76.6Confident44 Ų4447.3 Ų47.320%0.20427%0.274CS..Hα-helixtrans-63.5-38.3174.8-76.5-94.4000111.9G89 L90 S96 I97 H196 L200G89-H93 PolarHBondContact O-CD2 2.82Å; G89-H93 PolarHBondContact O-N 2.96Å; L90-H93 PolarHBondContact O-N 3.3Å; L90-H93 VanDerWaalsContact O-N 3.15Å; H93-S96 PolarHBondContact O-N 3.1Å; H93-I97 WeakPolarHBondContact O-CG1 3.38Å; H93-I97 PolarHBondContact O-N 3.41Å; H93-H196 HydrophobicContact CB-CB 4.44Å; H93-H196 AromaticContact CE1-ND1 3.76Å; H93-H196 AromaticContact CG-ND1 3.89Å; H93-H196 AromaticContact ND1-CG 3.92Å; H93-H196 AromaticContact ND1-ND1 3.06Å; H93-H196 PolarHBondContact ND1-ND1 3.36Å; H93-L200 HydrophobicContact CB-CD1 3.58Å
94C87.6Confident78Confident1 Ų145.3 Ų45.31%0.00727%0.267CS..Hα-helixtrans-64.9-43176.1-64.20000112.5L90 V91 S92 S96 I97 L98 M146 L155L90-C94 PolarHBondContact O-N 2.83Å; L90-C94 PolarHBondContact O-SG 3.44Å; V91-C94 WeakPolarHBondContact O-CB 3.05Å; V91-C94 PolarHBondContact O-N 3.34Å; S92-C94 VanDerWaalsContact C-N 3.33Å; S92-C94 PolarHBondContact O-N 2.83Å; C94-S96 VanDerWaalsContact C-N 3.29Å; C94-S96 PolarHBondContact O-N 3.03Å; C94-I97 PolarHBondContact O-N 3.32Å; C94-L98 WeakPolarHBondContact O-CB 3.25Å; C94-L98 VanDerWaalsContact O-CG 3.29Å; C94-L98 WeakPolarHBondContact O-CG 3.21Å; C94-L98 PolarHBondContact O-N 3.13Å; C94-M146 HydrophobicContact CB-CE 4.06Å; C94-M146 HydrophobicContact CB-CG 4.18Å; C94-M146 HydrophobicContact CB-SD 3.8Å; C94-L155 VanDerWaalsContact SG-CD2 3.51Å
95I85.9Confident79.7Confident25 Ų2541.4 Ų41.413%0.12825%0.247CC..Hα-helixtrans-59.3-42.6175.8-70.1167.3000110.5L78 W83 V91 S92 L98 K99 M146L78-I95 HydrophobicContact CD2-CB 4.38Å; L78-I95 HydrophobicContact CD2-CG1 4.46Å; L78-I95 HydrophobicContact CD2-CG2 3.85Å; W83-I95 HydrophobicContact CB-CD1 3.76Å; W83-I95 HydrophobicContact CD2-CD1 4.49Å; W83-I95 HydrophobicContact CG-CD1 3.92Å; V91-I95 HydrophobicContact CG1-CD1 3.95Å; V91-I95 VanDerWaalsContact O-CG1 3.26Å; V91-I95 WeakPolarHBondContact O-CG1 3.03Å; V91-I95 PolarHBondContact O-N 2.93Å; S92-I95 PolarHBondContact O-N 2.99Å; I95-L98 PolarHBondContact O-N 3.44Å; I95-K99 HydrophobicContact CG2-CD 4.21Å; I95-K99 WeakPolarHBondContact O-CG 3.45Å; I95-K99 PolarHBondContact O-N 3.42Å; I95-M146 HydrophobicContact CD1-CE 4.26Å; I95-M146 HydrophobicContact CG1-CE 3.67Å
96S86.6Confident81.2Confident33 Ų3336.7 Ų36.723%0.23123%0.225CC..Hα-helixtrans-62.4-44.6175.6-61.90000112.1S92 H93 C94 L98 K99 I100 H196S92-S96 PolarHBondContact O-N 2.89Å; S92-S96 VanDerWaalsContact O-N 3.13Å; S92-S96 PolarHBondContact O-OG 3.01Å; H93-S96 PolarHBondContact O-N 3.1Å; C94-S96 VanDerWaalsContact C-N 3.29Å; C94-S96 PolarHBondContact O-N 3.03Å; S96-L98 VanDerWaalsContact C-N 3.35Å; S96-L98 PolarHBondContact O-N 2.92Å; S96-K99 PolarHBondContact O-N 3.32Å; S96-I100 WeakPolarHBondContact O-CD1 3.45Å; S96-I100 VanDerWaalsContact O-CG1 3.25Å; S96-I100 WeakPolarHBondContact O-CG1 3.41Å; S96-I100 PolarHBondContact O-N 3.26Å; S96-H196 WeakPolarHBondContact CB-NE2 3.45Å
97I88.6Confident82.4Confident1 Ų138.1 Ų38.11%0.00523%0.229CC..Hα-helixtrans-59.2-46.9175.2-66.7160.1000110.6H93 C94 K99 I100 C101 H196 M197 L200H93-I97 WeakPolarHBondContact O-CG1 3.38Å; H93-I97 PolarHBondContact O-N 3.41Å; C94-I97 PolarHBondContact O-N 3.32Å; I97-K99 PolarHBondContact O-N 2.79Å; I97-I100 PolarHBondContact O-N 2.95Å; I97-C101 VanDerWaalsContact O-CB 3.31Å; I97-C101 WeakPolarHBondContact O-CB 3.31Å; I97-C101 PolarHBondContact O-N 3.46Å; I97-C101 PolarHBondContact O-SG 2.78Å; I97-H196 HydrophobicContact CD1-CB 3.81Å; I97-H196 HydrophobicContact CG1-CB 3.52Å; I97-M197 HydrophobicContact CD1-CG 4.15Å; I97-M197 HydrophobicContact CD1-SD 3.71Å; I97-L200 HydrophobicContact CD1-CD1 4.06Å; I97-L200 HydrophobicContact CD1-CD2 3.86Å
98L87.6Confident83.7Confident4 Ų432.7 Ų32.72%0.02118%0.184CC..Hα-helixtrans-59.3-45.5178.3-72.4176.8000111.7L78 C94 I95 S96 C101 H102 V139 V142 V143 M146 L162L78-L98 HydrophobicContact CD2-CB 3.84Å; L78-L98 HydrophobicContact CD2-CD1 4.09Å; C94-L98 WeakPolarHBondContact O-CB 3.25Å; C94-L98 VanDerWaalsContact O-CG 3.29Å; C94-L98 WeakPolarHBondContact O-CG 3.21Å; C94-L98 PolarHBondContact O-N 3.13Å; I95-L98 PolarHBondContact O-N 3.44Å; S96-L98 VanDerWaalsContact C-N 3.35Å; S96-L98 PolarHBondContact O-N 2.92Å; L98-C101 PolarHBondContact O-N 3.25Å; L98-H102 VanDerWaalsContact O-CB 3.31Å; L98-H102 WeakPolarHBondContact O-CB 3.35Å; L98-H102 PolarHBondContact O-N 2.87Å; L98-V139 HydrophobicContact CD2-CB 4.3Å; L98-V139 HydrophobicContact CD2-CG1 3.92Å; L98-V139 HydrophobicContact CD2-CG2 4.18Å; L98-V142 HydrophobicContact CD1-CG1 4.21Å; L98-V142 HydrophobicContact CD2-CB 4.08Å; L98-V142 HydrophobicContact CD2-CG1 3.86Å; L98-V142 HydrophobicContact CG-CG1 4.12Å; L98-V143 HydrophobicContact CD1-CG2 3.65Å; L98-M146 HydrophobicContact CD1-SD 3.96Å; L98-L162 HydrophobicContact CD2-CD2 3.62Å
99K85Confident84.5Confident95 Ų9530 Ų3041%0.41316%0.164SC..Hα-helixtrans-61.1-49176.7-76.6178.9178.6-179.80111.9L78 I95 S96 I97 C101 H102 T103L78-K99 HydrophobicContact CD1-CG 3.96Å; L78-K99 HydrophobicContact CD2-CG 4.24Å; I95-K99 HydrophobicContact CG2-CD 4.21Å; I95-K99 WeakPolarHBondContact O-CG 3.45Å; I95-K99 PolarHBondContact O-N 3.42Å; S96-K99 PolarHBondContact O-N 3.32Å; I97-K99 PolarHBondContact O-N 2.79Å; K99-C101 VanDerWaalsContact C-N 3.35Å; K99-C101 PolarHBondContact O-N 3.35Å; K99-H102 PolarHBondContact O-N 3.33Å; K99-T103 PolarHBondContact O-N 3.22Å; K99-T103 PolarHBondContact O-OG1 3.49Å
100I86.6Confident84.7Confident32 Ų3231.3 Ų31.316%0.16417%0.172CC..Hα-helixtrans-60.9-46.4179-65.3163.2000110.4S96 I97 H102 L104 S189 A192 A193S96-I100 WeakPolarHBondContact O-CD1 3.45Å; S96-I100 VanDerWaalsContact O-CG1 3.25Å; S96-I100 WeakPolarHBondContact O-CG1 3.41Å; S96-I100 PolarHBondContact O-N 3.26Å; I97-I100 PolarHBondContact O-N 2.95Å; I100-H102 VanDerWaalsContact C-N 3.33Å; I100-H102 PolarHBondContact O-N 2.96Å; I100-L104 WeakPolarHBondContact O-CB 3.4Å; I100-L104 PolarHBondContact O-N 3.06Å; I100-S189 VanDerWaalsContact CG2-O 3.22Å; I100-S189 WeakPolarHBondContact CG2-O 3.28Å; I100-A192 HydrophobicContact CD1-CB 4Å; I100-A193 HydrophobicContact CB-CB 4.47Å; I100-A193 HydrophobicContact CD1-CB 4.34Å; I100-A193 HydrophobicContact CG2-CB 3.99Å
101C87.8Confident84.4Confident1 Ų133.3 Ų33.31%0.00718%0.182CC..Hα-helixtrans-61.5-41.1178.3-71.50000112.2I97 L98 K99 T105 L162 V166I97-C101 VanDerWaalsContact O-CB 3.31Å; I97-C101 WeakPolarHBondContact O-CB 3.31Å; I97-C101 PolarHBondContact O-N 3.46Å; I97-C101 PolarHBondContact O-SG 2.78Å; L98-C101 PolarHBondContact O-N 3.25Å; K99-C101 VanDerWaalsContact C-N 3.35Å; K99-C101 PolarHBondContact O-N 3.35Å; C101-T105 VanDerWaalsContact O-CB 3.25Å; C101-T105 WeakPolarHBondContact O-CB 3.44Å; C101-T105 PolarHBondContact O-N 2.79Å; C101-T105 PolarHBondContact O-OG1 3.06Å; C101-L162 HydrophobicContact CB-CD2 4.17Å; C101-L162 HydrophobicContact CB-CG 4.35Å; C101-V166 HydrophobicContact CB-CG2 3.88Å
102H86Confident83.9Confident20 Ų2033.8 Ų33.89%0.09319%0.185CC..Hα-helixtrans-62.4-57.8176.6179.4-93.3000111.3T70 E75 L98 K99 I100 L104 T105 E106T70-H102 WeakPolarHBondContact CB-NE2 3.42Å; T70-H102 WeakPolarHBondContact CG2-NE2 3.3Å; E75-H102 IonicContact OE1-CE1 3.93Å; L98-H102 VanDerWaalsContact O-CB 3.31Å; L98-H102 WeakPolarHBondContact O-CB 3.35Å; L98-H102 PolarHBondContact O-N 2.87Å; K99-H102 PolarHBondContact O-N 3.33Å; I100-H102 VanDerWaalsContact C-N 3.33Å; I100-H102 PolarHBondContact O-N 2.96Å; H102-L104 VanDerWaalsContact C-N 3.3Å; H102-L104 PolarHBondContact O-N 3.41Å; H102-T105 WeakPolarHBondContact O-CB 3.33Å; H102-T105 PolarHBondContact O-N 2.95Å; H102-T105 VanDerWaalsContact O-N 3.14Å; H102-E106 IonicContact CE1-OE2 3.65Å; H102-E106 IonicContact ND1-OE2 2.69Å; H102-E106 WeakPolarHBondContact O-CB 3.31Å; H102-E106 PolarHBondContact O-N 3.42Å
103T83.8Confident83.1Confident60 Ų6037.2 Ų37.237%0.36820%0.195SC..Hα-helixtrans-59.3-41-179.7-590000111.8K99 K107K99-T103 PolarHBondContact O-N 3.22Å; K99-T103 PolarHBondContact O-OG1 3.49Å; T103-K107 HydrophobicContact CG2-CD 3.95Å; T103-K107 HydrophobicContact CG2-CG 4.41Å; T103-K107 WeakPolarHBondContact O-CB 3.42Å; T103-K107 VanDerWaalsContact O-CG 3.25Å; T103-K107 WeakPolarHBondContact O-CG 3.5Å; T103-K107 PolarHBondContact O-N 3.09Å
104L86Confident81.9Confident3 Ų338.4 Ų38.42%0.01622%0.218CC..Hα-helixtrans-64-45.9177.3-179.755.1000111.1I100 H102 K107 L108 V166 V170 W185 I186 L190I100-L104 WeakPolarHBondContact O-CB 3.4Å; I100-L104 PolarHBondContact O-N 3.06Å; H102-L104 VanDerWaalsContact C-N 3.3Å; H102-L104 PolarHBondContact O-N 3.41Å; L104-K107 PolarHBondContact O-N 3.3Å; L104-L108 HydrophobicContact CD1-CD1 3.93Å; L104-L108 HydrophobicContact CD1-CG 4.12Å; L104-L108 HydrophobicContact CG-CD1 3.89Å; L104-L108 WeakPolarHBondContact O-CB 3.25Å; L104-L108 WeakPolarHBondContact O-CD1 3.46Å; L104-L108 WeakPolarHBondContact O-CG 3.23Å; L104-L108 PolarHBondContact O-N 2.92Å; L104-V166 HydrophobicContact CB-CG1 4.33Å; L104-V166 HydrophobicContact CD2-CG1 3.55Å; L104-V166 HydrophobicContact CG-CG1 3.9Å; L104-V170 HydrophobicContact CD1-CG2 4.38Å; L104-V170 HydrophobicContact CD2-CG2 4.18Å; L104-V170 HydrophobicContact CG-CG2 4.39Å; L104-W185 HydrophobicContact CD1-CE3 4.32Å; L104-W185 HydrophobicContact CD1-CH2 3.98Å; L104-W185 HydrophobicContact CD1-CZ3 3.43Å; L104-W185 VanDerWaalsContact CD1-CZ3 3.43Å; L104-I186 HydrophobicContact CD1-CG1 4.22Å; L104-I186 HydrophobicContact CD1-CG2 4.38Å; L104-L190 HydrophobicContact CD2-CD2 3.65Å; L104-L190 HydrophobicContact CD2-CG 3.96Å
105T87.6Confident80.4Confident3 Ų340.6 Ų40.62%0.01823%0.234CC..Hα-helixtrans-60.7-47.8177.2-610000111.5C101 H102 L108 V109 I135 L169C101-T105 VanDerWaalsContact O-CB 3.25Å; C101-T105 WeakPolarHBondContact O-CB 3.44Å; C101-T105 PolarHBondContact O-N 2.79Å; C101-T105 PolarHBondContact O-OG1 3.06Å; H102-T105 WeakPolarHBondContact O-CB 3.33Å; H102-T105 PolarHBondContact O-N 2.95Å; H102-T105 VanDerWaalsContact O-N 3.14Å; T105-L108 PolarHBondContact O-N 3.34Å; T105-V109 HydrophobicContact CG2-CG2 4.44Å; T105-V109 WeakPolarHBondContact O-CB 3.48Å; T105-V109 VanDerWaalsContact O-CG2 3.23Å; T105-V109 WeakPolarHBondContact O-CG2 3.25Å; T105-V109 PolarHBondContact O-N 3.29Å; T105-I135 HydrophobicContact CG2-CD1 3.63Å; T105-I135 WeakPolarHBondContact OG1-CD1 3.19Å; T105-L169 HydrophobicContact CG2-CD2 3.76Å
106E84.1Confident78.7Confident91 Ų9143.5 Ų43.543%0.42527%0.27SS..Hα-helixtrans-60.2-48.5179.2-171.9-174.5175.800111.4H102 L108 V109 A110H102-E106 IonicContact CE1-OE2 3.65Å; H102-E106 IonicContact ND1-OE2 2.69Å; H102-E106 WeakPolarHBondContact O-CB 3.31Å; H102-E106 PolarHBondContact O-N 3.42Å; E106-L108 VanDerWaalsContact C-N 3.35Å; E106-L108 PolarHBondContact O-N 2.85Å; E106-V109 PolarHBondContact O-N 3.43Å; E106-A110 WeakPolarHBondContact O-CB 3.5Å; E106-A110 PolarHBondContact O-N 3.27Å
107K82.3Confident76.9Confident84 Ų8445.2 Ų45.237%0.36529%0.287SS..Hα-helixtrans-63.2-39.8177.7-70.3-179.475.5155.40112.1T103 L104 M111 W185T103-K107 HydrophobicContact CG2-CD 3.95Å; T103-K107 HydrophobicContact CG2-CG 4.41Å; T103-K107 WeakPolarHBondContact O-CB 3.42Å; T103-K107 VanDerWaalsContact O-CG 3.25Å; T103-K107 WeakPolarHBondContact O-CG 3.5Å; T103-K107 PolarHBondContact O-N 3.09Å; L104-K107 PolarHBondContact O-N 3.3Å; K107-M111 WeakPolarHBondContact O-CE 3.41Å; K107-M111 VanDerWaalsContact O-CG 3.3Å; K107-M111 WeakPolarHBondContact O-CG 3.35Å; K107-M111 PolarHBondContact O-N 3.4Å; K107-W185 HydrophobicContact CB-CH2 3.53Å; K107-W185 HydrophobicContact CB-CZ2 4.31Å; K107-W185 HydrophobicContact CB-CZ3 4.02Å; K107-W185 HydrophobicContact CD-CH2 4.21Å; K107-W185 HydrophobicContact CD-CZ3 4Å; K107-W185 HydrophobicContact CG-CH2 4.47Å
108L81.8Confident75.2Confident0 Ų054.4 Ų54.40%033%0.326CS..Hα-helixtrans-62-45.1176.5-72.5164.3000111.8L104 T105 E106 M111 T112 L169 V170 T173 I186L104-L108 HydrophobicContact CD1-CD1 3.93Å; L104-L108 HydrophobicContact CD1-CG 4.12Å; L104-L108 HydrophobicContact CG-CD1 3.89Å; L104-L108 WeakPolarHBondContact O-CB 3.25Å; L104-L108 WeakPolarHBondContact O-CD1 3.46Å; L104-L108 WeakPolarHBondContact O-CG 3.23Å; L104-L108 PolarHBondContact O-N 2.92Å; T105-L108 PolarHBondContact O-N 3.34Å; E106-L108 VanDerWaalsContact C-N 3.35Å; E106-L108 PolarHBondContact O-N 2.85Å; L108-M111 HydrophobicContact CB-CE 4.47Å; L108-M111 HydrophobicContact CD2-CE 3.75Å; L108-M111 HydrophobicContact CG-CE 4.31Å; L108-M111 PolarHBondContact O-N 3.41Å; L108-T112 WeakPolarHBondContact O-CG2 3.39Å; L108-T112 PolarHBondContact O-N 3.06Å; L108-L169 HydrophobicContact CB-CD2 4.39Å; L108-L169 HydrophobicContact CD1-CD2 4.11Å; L108-L169 HydrophobicContact CD1-CG 4.12Å; L108-V170 HydrophobicContact CD1-CB 4.37Å; L108-V170 HydrophobicContact CD1-CG2 3.46Å; L108-V170 VanDerWaalsContact CD1-CG2 3.46Å; L108-V170 HydrophobicContact CD2-CG2 4.22Å; L108-V170 HydrophobicContact CG-CG2 4.45Å; L108-T173 HydrophobicContact CB-CG2 4.44Å; L108-T173 HydrophobicContact CD2-CG2 3.92Å; L108-I186 HydrophobicContact CD2-CD1 3.95Å
109V80.4Confident73.6Confident14 Ų1455.7 Ų55.79%0.08533%0.334CS..Hα-helixtrans-68.1-44.8178.7170.40000110.7I69 T105 E106 M111 T112 M113 A132I69-V109 HydrophobicContact CD1-CG1 3.44Å; I69-V109 VanDerWaalsContact CD1-CG1 3.44Å; I69-V109 HydrophobicContact CD1-CG2 4.49Å; I69-V109 HydrophobicContact CG2-CG1 4.48Å; I69-V109 HydrophobicContact CG2-CG2 4.03Å; T105-V109 HydrophobicContact CG2-CG2 4.44Å; T105-V109 WeakPolarHBondContact O-CB 3.48Å; T105-V109 VanDerWaalsContact O-CG2 3.23Å; T105-V109 WeakPolarHBondContact O-CG2 3.25Å; T105-V109 PolarHBondContact O-N 3.29Å; E106-V109 PolarHBondContact O-N 3.43Å; V109-M111 VanDerWaalsContact C-N 3.27Å; V109-M111 PolarHBondContact O-N 3.01Å; V109-T112 WeakPolarHBondContact O-CA 3.01Å; V109-T112 WeakPolarHBondContact O-CB 3.33Å; V109-T112 PolarHBondContact O-N 3.44Å; V109-T112 PolarHBondContact O-OG1 2.9Å; V109-M113 HydrophobicContact CG1-SD 4.28Å; V109-M113 PolarHBondContact O-N 3.44Å; V109-M113 VanDerWaalsContact O-N 3.14Å; V109-A132 HydrophobicContact CG2-CB 4.24Å
110A78.1Confident72.1Confident56 Ų5658 Ų5846%0.46334%0.344SS..Hα-helixtrans-57.9-39.7175.900000112E106 T112 M113 G114E106-A110 WeakPolarHBondContact O-CB 3.5Å; E106-A110 PolarHBondContact O-N 3.27Å; A110-T112 VanDerWaalsContact C-N 3.29Å; A110-T112 PolarHBondContact O-N 3.15Å; A110-M113 PolarHBondContact O-N 3.43Å; A110-G114 PolarHBondContact O-N 3.15Å
111M75.3Confident70.8Confident53 Ų5359.2 Ų59.226%0.26136%0.359SS..Hα-helixtrans-63.3-34.7173.6-75-176.2-63.100112.8K107 L108 V109 M113 S115 M179 Q183 W185K107-M111 WeakPolarHBondContact O-CE 3.41Å; K107-M111 VanDerWaalsContact O-CG 3.3Å; K107-M111 WeakPolarHBondContact O-CG 3.35Å; K107-M111 PolarHBondContact O-N 3.4Å; L108-M111 HydrophobicContact CB-CE 4.47Å; L108-M111 HydrophobicContact CD2-CE 3.75Å; L108-M111 HydrophobicContact CG-CE 4.31Å; L108-M111 PolarHBondContact O-N 3.41Å; V109-M111 VanDerWaalsContact C-N 3.27Å; V109-M111 PolarHBondContact O-N 3.01Å; M111-M113 VanDerWaalsContact C-N 3.27Å; M111-M113 PolarHBondContact O-N 3.45Å; M111-S115 VanDerWaalsContact O-CB 3.26Å; M111-S115 WeakPolarHBondContact O-CB 3.34Å; M111-S115 PolarHBondContact O-N 2.69Å; M111-M179 HydrophobicContact CE-CE 3.29Å; M111-M179 HydrophobicContact SD-CE 3.36Å; M111-M179 WeakPolarHBondContact SD-CE 3.5Å; M111-Q183 PolarHBondContact SD-NE2 3.49Å; M111-W185 HydrophobicContact CE-CH2 3.78Å; M111-W185 HydrophobicContact CE-CZ2 3.44Å; M111-W185 VanDerWaalsContact CE-CZ2 3.44Å; M111-W185 HydrophobicContact SD-CZ2 3.87Å
112T71.8Confident69.5Low15 Ų1564.5 Ų64.59%0.09239%0.394CS..Hα-helixtrans-70.4-25.3177.670.80000112.7L108 V109 A110 I128 T173L108-T112 WeakPolarHBondContact O-CG2 3.39Å; L108-T112 PolarHBondContact O-N 3.06Å; V109-T112 WeakPolarHBondContact O-CA 3.01Å; V109-T112 WeakPolarHBondContact O-CB 3.33Å; V109-T112 PolarHBondContact O-N 3.44Å; V109-T112 PolarHBondContact O-OG1 2.9Å; A110-T112 VanDerWaalsContact C-N 3.29Å; A110-T112 PolarHBondContact O-N 3.15Å; T112-I128 HydrophobicContact CG2-CD1 3.82Å; T112-I128 HydrophobicContact CG2-CG2 3.98Å; T112-T173 HydrophobicContact CG2-CG2 3.71Å
113M67.2Low68.5Low147 Ų14766.5 Ų66.572%0.72441%0.413SS*.Hα-helixtrans-92.6-37.2178.4-62.8179.97100113.3V109 A110 M111V109-M113 HydrophobicContact CG1-SD 4.28Å; V109-M113 PolarHBondContact O-N 3.44Å; V109-M113 VanDerWaalsContact O-N 3.14Å; A110-M113 PolarHBondContact O-N 3.43Å; M111-M113 VanDerWaalsContact C-N 3.27Å; M111-M113 PolarHBondContact O-N 3.45Å
114G59Low67.9Low68 Ų6864.4 Ų64.470%0.70140%0.401SS*.Hα-helixtrans-84.8-16.4-177.200000114.8A110 G116A110-G114 PolarHBondContact O-N 3.15Å; G114-G116 VanDerWaalsContact C-N 3.32Å; G114-G116 PolarHBondContact O-N 3.38Å
115S56.2Low67.5Low47 Ų4767 Ų6733%0.32942%0.415SS..  trans-77.184.1173.5-170.50000110M111 A117M111-S115 VanDerWaalsContact O-CB 3.26Å; M111-S115 WeakPolarHBondContact O-CB 3.34Å; M111-S115 PolarHBondContact O-N 2.69Å; S115-A117 PolarHBondContact O-N 2.96Å; S115-A117 PolarHBondContact OG-O 3.48Å
116G52Low67.1Low87 Ų8769.7 Ų69.790%0.89743%0.434SS*.  trans-58.2-1.4165.500000114G114G114-G116 VanDerWaalsContact C-N 3.32Å; G114-G116 PolarHBondContact O-N 3.38Å
117A47.4Very low67Low69 Ų6969.8 Ų69.857%0.5744%0.437SS*.SBendtrans-97.898.617200000110.9S115 V119S115-A117 PolarHBondContact O-N 2.96Å; S115-A117 PolarHBondContact OG-O 3.48Å; A117-V119 PolarHBondContact O-N 3.14Å
118K53.3Low67Low193 Ų19366 Ų6684%0.83942%0.421SS*.  trans58.651.2141.3-146-179.5-171.1-179.60116.4K120K118-K120 PolarHBondContact O-N 2.97Å
119V54.9Low67.1Low31 Ų3168.2 Ų68.219%0.18843%0.432CS..  trans-58127.9161.7-178.80000108.5A117 A121 S124 L125A117-V119 PolarHBondContact O-N 3.14Å; V119-A121 VanDerWaalsContact C-N 3.34Å; V119-A121 PolarHBondContact O-N 2.88Å; V119-S124 VanDerWaalsContact CG1-OG 3.29Å; V119-S124 WeakPolarHBondContact CG1-OG 3.45Å; V119-L125 HydrophobicContact CB-CD1 4.5Å; V119-L125 HydrophobicContact CB-CD2 4.35Å; V119-L125 HydrophobicContact CB-CG 4.32Å; V119-L125 HydrophobicContact CG1-CD1 4.27Å; V119-L125 HydrophobicContact CG1-CD2 3.74Å; V119-L125 HydrophobicContact CG1-CG 3.62Å; V119-L125 HydrophobicContact CG2-CD2 4.1Å
120K53.4Low67.3Low143 Ų14370.9 Ų70.962%0.62245%0.449SS*.SBendtrans-7392.8-174.6-156.3176.1-174.1171.10108.8K118 S124K118-K120 PolarHBondContact O-N 2.97Å; K120-S124 WeakPolarHBondContact O-CB 3.27Å; K120-S124 PolarHBondContact O-OG 3.32Å
121A57.8Low67.7Low58 Ų5868.8 Ų68.848%0.47943%0.43SS..Hα-helixtrans67145.8177.400000115.4V119 A123 S124V119-A121 VanDerWaalsContact C-N 3.34Å; V119-A121 PolarHBondContact O-N 2.88Å; A121-A123 PolarHBondContact O-N 3.44Å; A121-S124 PolarHBondContact O-N 3.38Å; A121-S124 VanDerWaalsContact O-N 3.13Å; A121-S124 PolarHBondContact O-OG 2.78Å
122P61.6Low68.2Low113 Ų11366.3 Ų66.373%0.73442%0.418SS*.Hα-helixtrans-58.4-20.4178.423.4-34.5000113.9L125 S126P122-L125 PolarHBondContact O-N 2.94Å; P122-S126 PolarHBondContact O-N 2.87Å
123A64.3Low68.8Low61 Ų6171.4 Ų71.450%0.50444%0.439SS..Hα-helixtrans-64.5-38.417600000113.1A121 L125 S126 D127A121-A123 PolarHBondContact O-N 3.44Å; A123-L125 VanDerWaalsContact C-N 3.35Å; A123-L125 PolarHBondContact O-N 3.27Å; A123-S126 PolarHBondContact O-N 2.89Å; A123-S126 VanDerWaalsContact O-N 3.17Å; A123-S126 PolarHBondContact O-OG 3.18Å; A123-D127 PolarHBondContact O-N 2.83Å; A123-D127 VanDerWaalsContact O-N 3.13Å
124S71.2Confident69.6Low17 Ų1771.4 Ų71.412%0.11943%0.431CS..Hα-helixtrans-70.9-31.4-179.461.10000112.6V119 K120 A121 S126 D127 I128V119-S124 VanDerWaalsContact CG1-OG 3.29Å; V119-S124 WeakPolarHBondContact CG1-OG 3.45Å; K120-S124 WeakPolarHBondContact O-CB 3.27Å; K120-S124 PolarHBondContact O-OG 3.32Å; A121-S124 PolarHBondContact O-N 3.38Å; A121-S124 VanDerWaalsContact O-N 3.13Å; A121-S124 PolarHBondContact O-OG 2.78Å; S124-S126 VanDerWaalsContact C-N 3.34Å; S124-D127 PolarHBondContact O-N 3.47Å; S124-I128 WeakPolarHBondContact O-CD1 3.24Å; S124-I128 VanDerWaalsContact O-CG1 3.28Å; S124-I128 WeakPolarHBondContact O-CG1 3.36Å; S124-I128 PolarHBondContact O-N 3.26Å; S124-I128 VanDerWaalsContact O-N 3.07Å
125L77.3Confident71Confident58 Ų5868.5 Ų68.530%0.30440%0.399SS..Hα-helixtrans-63.6-40.7169.9-70.7175.2000111.5V119 P122 A123 D127 I128 I129V119-L125 HydrophobicContact CB-CD1 4.5Å; V119-L125 HydrophobicContact CB-CD2 4.35Å; V119-L125 HydrophobicContact CB-CG 4.32Å; V119-L125 HydrophobicContact CG1-CD1 4.27Å; V119-L125 HydrophobicContact CG1-CD2 3.74Å; V119-L125 HydrophobicContact CG1-CG 3.62Å; V119-L125 HydrophobicContact CG2-CD2 4.1Å; P122-L125 PolarHBondContact O-N 2.94Å; A123-L125 VanDerWaalsContact C-N 3.35Å; A123-L125 PolarHBondContact O-N 3.27Å; L125-D127 VanDerWaalsContact C-N 3.28Å; L125-D127 PolarHBondContact O-N 3.34Å; L125-I128 HydrophobicContact CD2-CD1 4.29Å; L125-I128 PolarHBondContact O-N 2.92Å; L125-I129 WeakPolarHBondContact O-CD1 3.29Å; L125-I129 VanDerWaalsContact O-CG1 3.25Å; L125-I129 WeakPolarHBondContact O-CG1 3.46Å; L125-I129 PolarHBondContact O-N 3.39Å
126S78.8Confident72.4Confident59 Ų5967.7 Ų67.741%0.41339%0.393SS..Hα-helixtrans-63.8-34.7177.2760000112.6P122 A123 S124 T130P122-S126 PolarHBondContact O-N 2.87Å; A123-S126 PolarHBondContact O-N 2.89Å; A123-S126 VanDerWaalsContact O-N 3.17Å; A123-S126 PolarHBondContact O-OG 3.18Å; S124-S126 VanDerWaalsContact C-N 3.34Å; S126-T130 WeakPolarHBondContact O-CB 3.37Å; S126-T130 PolarHBondContact O-N 2.81Å; S126-T130 PolarHBondContact O-OG1 3.38Å
127D82.9Confident74Confident92 Ų9266.5 Ų66.549%0.49237%0.37SS..Hα-helixtrans-67.5-45.2174.4-67.4-27.9000111.3A123 S124 L125 I129 T130 V131 V172A123-D127 PolarHBondContact O-N 2.83Å; A123-D127 VanDerWaalsContact O-N 3.13Å; S124-D127 PolarHBondContact O-N 3.47Å; L125-D127 VanDerWaalsContact C-N 3.28Å; L125-D127 PolarHBondContact O-N 3.34Å; D127-I129 PolarHBondContact O-N 3.37Å; D127-T130 PolarHBondContact O-N 3.36Å; D127-V131 WeakPolarHBondContact O-CG2 3.48Å; D127-V131 PolarHBondContact O-N 2.7Å; D127-V172 HydrophobicContact CB-CG1 4.29Å
128I83.1Confident75.9Confident4 Ų467 Ų672%0.02136%0.357CS..Hα-helixtrans-58.1-49.2175.7-66.5161.2000110.5T112 S124 L125 T130 V131 A132 L169 V172 A176T112-I128 HydrophobicContact CG2-CD1 3.82Å; T112-I128 HydrophobicContact CG2-CG2 3.98Å; S124-I128 WeakPolarHBondContact O-CD1 3.24Å; S124-I128 VanDerWaalsContact O-CG1 3.28Å; S124-I128 WeakPolarHBondContact O-CG1 3.36Å; S124-I128 PolarHBondContact O-N 3.26Å; S124-I128 VanDerWaalsContact O-N 3.07Å; L125-I128 HydrophobicContact CD2-CD1 4.29Å; L125-I128 PolarHBondContact O-N 2.92Å; I128-T130 VanDerWaalsContact C-N 3.32Å; I128-T130 PolarHBondContact O-N 2.95Å; I128-V131 PolarHBondContact O-N 3.2Å; I128-A132 WeakPolarHBondContact O-CB 3.45Å; I128-A132 PolarHBondContact O-N 3.47Å; I128-L169 HydrophobicContact CG2-CD1 3.93Å; I128-V172 HydrophobicContact CG1-CG1 3.71Å; I128-A176 HydrophobicContact CD1-CB 3.52Å; I128-A176 HydrophobicContact CG1-CB 4.32Å
129I82.8Confident77.5Confident47 Ų4758.2 Ų58.224%0.24132%0.32CS..Hα-helixtrans-60.7-43.3179.1-67.1163.8000110.5L64 V67 L125 D127 V131 A132 K133L64-I129 HydrophobicContact CD2-CD1 4.38Å; V67-I129 HydrophobicContact CG1-CG2 4.25Å; L125-I129 WeakPolarHBondContact O-CD1 3.29Å; L125-I129 VanDerWaalsContact O-CG1 3.25Å; L125-I129 WeakPolarHBondContact O-CG1 3.46Å; L125-I129 PolarHBondContact O-N 3.39Å; D127-I129 PolarHBondContact O-N 3.37Å; I129-V131 VanDerWaalsContact C-N 3.31Å; I129-V131 PolarHBondContact O-N 2.96Å; I129-A132 PolarHBondContact O-N 3.36Å; I129-K133 HydrophobicContact CG2-CD 4.14Å; I129-K133 HydrophobicContact CG2-CG 4.4Å; I129-K133 WeakPolarHBondContact O-CB 3.4Å; I129-K133 VanDerWaalsContact O-CG 3.31Å; I129-K133 WeakPolarHBondContact O-CG 3.24Å; I129-K133 PolarHBondContact O-N 3.39Å
130T85.5Confident79Confident70 Ų7060.1 Ų60.143%0.42933%0.329SS..Hα-helixtrans-63.9-37.7179.8-58.50000111.9S126 D127 I128 R134S126-T130 WeakPolarHBondContact O-CB 3.37Å; S126-T130 PolarHBondContact O-N 2.81Å; S126-T130 PolarHBondContact O-OG1 3.38Å; D127-T130 PolarHBondContact O-N 3.36Å; I128-T130 VanDerWaalsContact C-N 3.32Å; I128-T130 PolarHBondContact O-N 2.95Å; T130-R134 WeakPolarHBondContact O-CG 3.42Å
131V85.9Confident80.7Confident13 Ų1356 Ų568%0.07931%0.314CS..Hα-helixtrans-71.7-44.4175.71760000111D127 I128 I129 K133 R134 H168 L169 V172D127-V131 WeakPolarHBondContact O-CG2 3.48Å; D127-V131 PolarHBondContact O-N 2.7Å; I128-V131 PolarHBondContact O-N 3.2Å; I129-V131 VanDerWaalsContact C-N 3.31Å; I129-V131 PolarHBondContact O-N 2.96Å; V131-K133 VanDerWaalsContact C-N 3.33Å; V131-K133 PolarHBondContact O-N 2.93Å; V131-R134 WeakPolarHBondContact O-CB 3.31Å; V131-R134 PolarHBondContact O-N 3.04Å; V131-H168 WeakPolarHBondContact CG1-ND1 3.08Å; V131-H168 VanDerWaalsContact CG2-CE1 3.47Å; V131-H168 WeakPolarHBondContact CG2-CE1 3.16Å; V131-L169 HydrophobicContact CB-CD1 4.23Å; V131-L169 HydrophobicContact CG1-CB 3.88Å; V131-L169 HydrophobicContact CG1-CD1 4.06Å; V131-V172 HydrophobicContact CG2-CG2 4.44Å
132A85.1Confident82.1Confident0 Ų053.3 Ų53.30%029%0.291CS..Hα-helixtrans-60.2-41.4178.400000111.9I69 V109 I128 I129 R134 I135 L169I69-A132 HydrophobicContact CG2-CB 4.02Å; V109-A132 HydrophobicContact CG2-CB 4.24Å; I128-A132 WeakPolarHBondContact O-CB 3.45Å; I128-A132 PolarHBondContact O-N 3.47Å; I129-A132 PolarHBondContact O-N 3.36Å; A132-R134 PolarHBondContact O-N 3.5Å; A132-R134 VanDerWaalsContact O-N 3.09Å; A132-I135 VanDerWaalsContact O-CB 3.3Å; A132-I135 WeakPolarHBondContact O-CB 3.4Å; A132-I135 PolarHBondContact O-N 3.05Å; A132-L169 HydrophobicContact CB-CD1 4.21Å; A132-L169 HydrophobicContact CB-CD2 4.35Å
133K84.7Confident83.3Confident122 Ų12248.9 Ų48.953%0.5326%0.262SS..THydrogen-bonded Turntrans-59.2-22.5175.3-77.4-179176.4-171.70114.2I129 V131 I135 P137I129-K133 HydrophobicContact CG2-CD 4.14Å; I129-K133 HydrophobicContact CG2-CG 4.4Å; I129-K133 WeakPolarHBondContact O-CB 3.4Å; I129-K133 VanDerWaalsContact O-CG 3.31Å; I129-K133 WeakPolarHBondContact O-CG 3.24Å; I129-K133 PolarHBondContact O-N 3.39Å; V131-K133 VanDerWaalsContact C-N 3.33Å; V131-K133 PolarHBondContact O-N 2.93Å; K133-I135 VanDerWaalsContact C-N 3.31Å; K133-P137 VanDerWaalsContact O-CD 3.24Å; K133-P137 WeakPolarHBondContact O-CD 3.49Å
134R85.1Confident84.3Confident147 Ų14753.8 Ų53.856%0.55527%0.267SS*.THydrogen-bonded Turntrans-83-7.2177-66.2173.9176.4-177.4-0.2113T130 V131 A132 P137 R138T130-R134 WeakPolarHBondContact O-CG 3.42Å; V131-R134 WeakPolarHBondContact O-CB 3.31Å; V131-R134 PolarHBondContact O-N 3.04Å; A132-R134 PolarHBondContact O-N 3.5Å; A132-R134 VanDerWaalsContact O-N 3.09Å; R134-P137 WeakPolarHBondContact O-CG 2.86Å; R134-R138 WeakPolarHBondContact O-CD 3.13Å; R134-R138 VanDerWaalsContact O-CG 3.24Å; R134-R138 WeakPolarHBondContact O-CG 3.23Å; R134-R138 PolarHBondContact O-NE 2.91Å
135I87.9Confident85Confident8 Ų853.5 Ų53.54%0.04127%0.265CS..Hα-helixtrans-79.3-44.8-178.6-61.8176.5000110.2T105 A132 K133 R138 V139 L162 V166 L169T105-I135 HydrophobicContact CG2-CD1 3.63Å; T105-I135 WeakPolarHBondContact OG1-CD1 3.19Å; A132-I135 VanDerWaalsContact O-CB 3.3Å; A132-I135 WeakPolarHBondContact O-CB 3.4Å; A132-I135 PolarHBondContact O-N 3.05Å; K133-I135 VanDerWaalsContact C-N 3.31Å; I135-R138 WeakPolarHBondContact O-CA 3.17Å; I135-R138 WeakPolarHBondContact O-CB 3.46Å; I135-R138 PolarHBondContact O-N 3.07Å; I135-V139 HydrophobicContact CG2-CG2 4.22Å; I135-V139 PolarHBondContact O-N 2.98Å; I135-L162 HydrophobicContact CG2-CD1 3.9Å; I135-V166 HydrophobicContact CD1-CG2 4.23Å; I135-V166 HydrophobicContact CG2-CG2 4.29Å; I135-L169 HydrophobicContact CD1-CB 4.19Å; I135-L169 HydrophobicContact CD1-CD2 3.48Å; I135-L169 VanDerWaalsContact CD1-CD2 3.48Å; I135-L169 HydrophobicContact CD1-CG 4.41Å
136S84.5Confident85.1Confident29 Ų2951.1 Ų51.120%0.20325%0.253CS..Hα-helixtrans-51.8-52.8177.5-45.90000113.9I69 R138 V139 D140I69-S136 PolarHBondContact O-OG 2.88Å; S136-R138 PolarHBondContact O-N 3.28Å; S136-R138 VanDerWaalsContact O-N 3.16Å; S136-V139 WeakPolarHBondContact O-CB 3.08Å; S136-V139 PolarHBondContact O-N 3.16Å; S136-V139 VanDerWaalsContact O-N 3.12Å; S136-D140 PolarHBondContact O-N 3.23Å
137P85.8Confident85.2Confident62 Ų6254.5 Ų54.540%0.40326%0.257SS..Hα-helixtrans-63.8-24.5178.124.7-34.5000113.2K133 R134 D141K133-P137 VanDerWaalsContact O-CD 3.24Å; K133-P137 WeakPolarHBondContact O-CD 3.49Å; R134-P137 WeakPolarHBondContact O-CG 2.86Å; P137-D141 VanDerWaalsContact O-CB 3.29Å; P137-D141 WeakPolarHBondContact O-CB 3.35Å; P137-D141 PolarHBondContact O-N 2.95Å
138R87.9Confident84.8Confident80 Ų8055.5 Ų55.530%0.30227%0.269SS..Hα-helixtrans-78.1-35.7176.3-67.1172.5-177.2-87.213.1112.2R134 I135 S136 D141 V142 A161 L162 S165R134-R138 WeakPolarHBondContact O-CD 3.13Å; R134-R138 VanDerWaalsContact O-CG 3.24Å; R134-R138 WeakPolarHBondContact O-CG 3.23Å; R134-R138 PolarHBondContact O-NE 2.91Å; I135-R138 WeakPolarHBondContact O-CA 3.17Å; I135-R138 WeakPolarHBondContact O-CB 3.46Å; I135-R138 PolarHBondContact O-N 3.07Å; S136-R138 PolarHBondContact O-N 3.28Å; S136-R138 VanDerWaalsContact O-N 3.16Å; R138-D141 WeakPolarHBondContact O-CB 3.16Å; R138-D141 PolarHBondContact O-N 3.49Å; R138-V142 WeakPolarHBondContact O-CG2 3.31Å; R138-V142 PolarHBondContact O-N 2.89Å; R138-V142 VanDerWaalsContact O-N 3.08Å; R138-A161 PolarHBondContact NH1-O 3.39Å; R138-L162 HydrophobicContact CB-CB 4.26Å; R138-L162 HydrophobicContact CB-CD1 3.8Å; R138-S165 VanDerWaalsContact CD-CB 3.48Å; R138-S165 WeakPolarHBondContact CD-OG 3.3Å; R138-S165 PolarHBondContact NE-OG 3.12Å; R138-S165 PolarHBondContact NH2-OG 3.08Å
139V87.7Confident84.3Confident9 Ų961.4 Ų61.46%0.05531%0.308CS..Hα-helixtrans-61.7-48.7169.7167.70000109.6I74 L98 I135 S136 D141 V142 V143 L162I74-V139 HydrophobicContact CD1-CG1 4.18Å; I74-V139 HydrophobicContact CG1-CG1 4.4Å; I74-V139 HydrophobicContact CG2-CG1 4.47Å; L98-V139 HydrophobicContact CD2-CB 4.3Å; L98-V139 HydrophobicContact CD2-CG1 3.92Å; L98-V139 HydrophobicContact CD2-CG2 4.18Å; I135-V139 HydrophobicContact CG2-CG2 4.22Å; I135-V139 PolarHBondContact O-N 2.98Å; S136-V139 WeakPolarHBondContact O-CB 3.08Å; S136-V139 PolarHBondContact O-N 3.16Å; S136-V139 VanDerWaalsContact O-N 3.12Å; V139-D141 PolarHBondContact O-N 3.41Å; V139-V142 PolarHBondContact O-N 3.36Å; V139-V142 VanDerWaalsContact O-N 3.1Å; V139-V143 HydrophobicContact CG1-CG2 4.32Å; V139-V143 WeakPolarHBondContact O-CG2 3.41Å; V139-V143 PolarHBondContact O-N 3.2Å; V139-L162 HydrophobicContact CG2-CD1 3.77Å; V139-L162 HydrophobicContact CG2-CD2 4.11Å
140D85.9Confident84.1Confident71 Ų7161.4 Ų61.438%0.3831%0.308SS..Hα-helixtrans-58.4-38.5176.9-64.9-35.9000112S136 R144S136-D140 PolarHBondContact O-N 3.23Å; D140-R144 WeakPolarHBondContact O-CB 3.32Å; D140-R144 PolarHBondContact O-N 3.46Å
141D88.5Confident84Confident57 Ų5761.6 Ų61.631%0.30531%0.306SS..Hα-helixtrans-64.8-38.9177.3-88.6-18.2000112.9P137 R138 V139 S145 R158P137-D141 VanDerWaalsContact O-CB 3.29Å; P137-D141 WeakPolarHBondContact O-CB 3.35Å; P137-D141 PolarHBondContact O-N 2.95Å; R138-D141 WeakPolarHBondContact O-CB 3.16Å; R138-D141 PolarHBondContact O-N 3.49Å; V139-D141 PolarHBondContact O-N 3.41Å; D141-S145 PolarHBondContact O-N 3.38Å; D141-S145 PolarHBondContact O-OG 3.41Å; D141-R158 PolarHBondContact O-NH1 3.05Å; D141-R158 IonicContact OD1-CZ 2.91Å; D141-R158 IonicContact OD1-NH1 3.05Å; D141-R158 PolarHBondContact OD1-NH1 3.26Å; D141-R158 IonicContact OD2-NH1 3.54Å
142V88Confident84Confident1 Ų162.1 Ų62.11%0.00631%0.31CS..Hα-helixtrans-70.5-48.3175.7170.10000110.6L98 R138 V139 R144 S145 M146 R158 A159 L162L98-V142 HydrophobicContact CD1-CG1 4.21Å; L98-V142 HydrophobicContact CD2-CB 4.08Å; L98-V142 HydrophobicContact CD2-CG1 3.86Å; L98-V142 HydrophobicContact CG-CG1 4.12Å; R138-V142 WeakPolarHBondContact O-CG2 3.31Å; R138-V142 PolarHBondContact O-N 2.89Å; R138-V142 VanDerWaalsContact O-N 3.08Å; V139-V142 PolarHBondContact O-N 3.36Å; V139-V142 VanDerWaalsContact O-N 3.1Å; V142-R144 VanDerWaalsContact C-N 3.26Å; V142-R144 PolarHBondContact O-N 3.01Å; V142-S145 WeakPolarHBondContact CA-OG 3.39Å; V142-S145 PolarHBondContact O-N 3.33Å; V142-S145 PolarHBondContact O-OG 3.34Å; V142-M146 HydrophobicContact CG1-SD 4.26Å; V142-M146 WeakPolarHBondContact O-CG 3.31Å; V142-M146 PolarHBondContact O-N 3.3Å; V142-M146 VanDerWaalsContact O-N 3.14Å; V142-R158 HydrophobicContact CG2-CB 3.93Å; V142-A159 HydrophobicContact CG2-CB 4.49Å; V142-L162 HydrophobicContact CG2-CB 4.24Å; V142-L162 HydrophobicContact CG2-CD2 4.21Å
143V86.3Confident84.2Confident20 Ų2065.8 Ų65.812%0.12133%0.328CS..Hα-helixtrans-58.4-41.4176.8173.60000110.4I77 W83 L98 V139 S145 M146 Y147I77-V143 HydrophobicContact CG2-CG1 4.28Å; W83-V143 HydrophobicContact CH2-CG1 4.01Å; L98-V143 HydrophobicContact CD1-CG2 3.65Å; V139-V143 HydrophobicContact CG1-CG2 4.32Å; V139-V143 WeakPolarHBondContact O-CG2 3.41Å; V139-V143 PolarHBondContact O-N 3.2Å; V143-S145 VanDerWaalsContact C-N 3.32Å; V143-S145 PolarHBondContact O-N 3.04Å; V143-M146 WeakPolarHBondContact O-CB 3.29Å; V143-M146 PolarHBondContact O-N 3.13Å; V143-M146 VanDerWaalsContact O-N 3.14Å; V143-Y147 HydrophobicContact CG1-CE2 4.02Å; V143-Y147 VanDerWaalsContact O-CD2 3.24Å; V143-Y147 WeakPolarHBondContact O-CD2 3.21Å
144R85.1Confident84.5Confident164 Ų16463.6 Ų63.662%0.61932%0.322SS*.Hα-helixtrans-61.1-38.7175.5-177.5172.6-78.5108.7-0.9112.6D140 V142 M146 Y147D140-R144 WeakPolarHBondContact O-CB 3.32Å; D140-R144 PolarHBondContact O-N 3.46Å; V142-R144 VanDerWaalsContact C-N 3.26Å; V142-R144 PolarHBondContact O-N 3.01Å; R144-M146 VanDerWaalsContact C-N 3.27Å; R144-M146 PolarHBondContact O-N 2.87Å; R144-Y147 PolarHBondContact O-N 3.37Å
145S85.5Confident84.8Confident11 Ų1156.6 Ų56.68%0.07730%0.296CS..Hα-helixtrans-75.3-11.7177.251.60000114.6D141 V142 V143 Y147 L155D141-S145 PolarHBondContact O-N 3.38Å; D141-S145 PolarHBondContact O-OG 3.41Å; V142-S145 WeakPolarHBondContact CA-OG 3.39Å; V142-S145 PolarHBondContact O-N 3.33Å; V142-S145 PolarHBondContact O-OG 3.34Å; V143-S145 VanDerWaalsContact C-N 3.32Å; V143-S145 PolarHBondContact O-N 3.04Å; S145-Y147 VanDerWaalsContact C-N 3.35Å; S145-L155 VanDerWaalsContact OG-CD1 3.31Å; S145-L155 WeakPolarHBondContact OG-CD1 3.26Å
146M81Confident85Confident8 Ų857.6 Ų57.64%0.03930%0.301CS..Hα-helixtrans-79.8-17.9173.6-67.1163.565.500112.5W83 V91 C94 I95 L98 V142 V143 R144 L155W83-M146 HydrophobicContact CD2-CE 4.46Å; W83-M146 HydrophobicContact CE3-CB 4.47Å; W83-M146 HydrophobicContact CE3-CE 3.71Å; W83-M146 HydrophobicContact CZ3-CB 4.04Å; W83-M146 HydrophobicContact CZ3-CE 3.9Å; V91-M146 HydrophobicContact CB-CE 4.31Å; V91-M146 HydrophobicContact CG1-CE 3.68Å; V91-M146 HydrophobicContact CG2-CB 4.16Å; V91-M146 HydrophobicContact CG2-CE 4.26Å; V91-M146 HydrophobicContact CG2-CG 4.33Å; C94-M146 HydrophobicContact CB-CE 4.06Å; C94-M146 HydrophobicContact CB-CG 4.18Å; C94-M146 HydrophobicContact CB-SD 3.8Å; I95-M146 HydrophobicContact CD1-CE 4.26Å; I95-M146 HydrophobicContact CG1-CE 3.67Å; L98-M146 HydrophobicContact CD1-SD 3.96Å; V142-M146 HydrophobicContact CG1-SD 4.26Å; V142-M146 WeakPolarHBondContact O-CG 3.31Å; V142-M146 PolarHBondContact O-N 3.3Å; V142-M146 VanDerWaalsContact O-N 3.14Å; V143-M146 WeakPolarHBondContact O-CB 3.29Å; V143-M146 PolarHBondContact O-N 3.13Å; V143-M146 VanDerWaalsContact O-N 3.14Å; R144-M146 VanDerWaalsContact C-N 3.27Å; R144-M146 PolarHBondContact O-N 2.87Å; M146-L155 HydrophobicContact CG-CD1 3.88Å
147Y80.4Confident85.5Confident130 Ų13058.8 Ų58.851%0.5131%0.313SS..SBendtrans-75.5138.6176.7-71.3-78.2000111.6W83 V143 R144 S145W83-Y147 HydrophobicContact CH2-CE1 4.33Å; W83-Y147 HydrophobicContact CH2-CE2 4.26Å; W83-Y147 AromaticContact CH2-CZ 3.82Å; W83-Y147 HydrophobicContact CZ3-CE1 4.49Å; V143-Y147 HydrophobicContact CG1-CE2 4.02Å; V143-Y147 VanDerWaalsContact O-CD2 3.24Å; V143-Y147 WeakPolarHBondContact O-CD2 3.21Å; R144-Y147 PolarHBondContact O-N 3.37Å; S145-Y147 VanDerWaalsContact C-N 3.35Å
148P73.3Confident85.8Confident113 Ų11359.6 Ų59.673%0.73431%0.308SS*.SBendtrans-58.1145.7178.5-26.934.9000114
149P74.3Confident86.1Confident128 Ų12855.8 Ų55.883%0.83129%0.293SS*.SBendcis-73.7129.6-3.430.3-33.8000112.1D151P149-D151 PolarHBondContact O-N 3.28Å
150L77Confident86.4Confident46 Ų4658.4 Ų58.424%0.24131%0.31CS..PPolyproline II helixtrans-78.6120.4-178.6-170.4145.1000109.9L90 V91 P152 L155L90-L150 HydrophobicContact CD1-CD2 3.9Å; V91-L150 HydrophobicContact CG2-CD1 3.6Å; L150-P152 HydrophobicContact CD2-CG 4.17Å; L150-L155 HydrophobicContact CD1-CD2 4.1Å; L150-L155 HydrophobicContact CD2-CD2 4.03Å; L150-L155 HydrophobicContact CG-CD2 4.18Å
151D84.6Confident86.9Confident74 Ų7456.6 Ų56.640%0.39631%0.305SS..  trans-105.5107.9175177.40.9000109.3P149 I153 L154 L155P149-D151 PolarHBondContact O-N 3.28Å; D151-I153 PolarHBondContact O-N 3.34Å; D151-I153 PolarHBondContact OD1-N 2.82Å; D151-L154 HydrophobicContact CB-CB 3.91Å; D151-L154 PolarHBondContact O-N 3.32Å; D151-L155 VanDerWaalsContact O-CB 3.31Å; D151-L155 WeakPolarHBondContact O-CB 3.45Å; D151-L155 PolarHBondContact O-N 2.92Å
152P85.9Confident87.1Confident25 Ų2553.9 Ų53.916%0.16229%0.29CS..Hα-helixtrans-59.4-31.8-178.2-24.935.4000113.7L90 L150 D156 A203L90-P152 HydrophobicContact CD1-CB 4.41Å; L90-P152 HydrophobicContact CD1-CG 4.25Å; L150-P152 HydrophobicContact CD2-CG 4.17Å; P152-D156 WeakPolarHBondContact O-CB 3.49Å; P152-D156 PolarHBondContact O-N 3.46Å; P152-A203 HydrophobicContact CB-CB 4.29Å
153I89.6Confident87.4Confident76 Ų7654.7 Ų54.739%0.3929%0.294SS..Hα-helixtrans-71.6-46-180-57.4177.5000109.9D151 L155 A157 A204 S207 E208D151-I153 PolarHBondContact O-N 3.34Å; D151-I153 PolarHBondContact OD1-N 2.82Å; I153-L155 VanDerWaalsContact C-N 3.32Å; I153-A157 WeakPolarHBondContact O-CB 3.41Å; I153-A157 PolarHBondContact O-N 3.19Å; I153-A204 HydrophobicContact CG1-CB 4.28Å; I153-S207 WeakPolarHBondContact CG1-OG 3.26Å; I153-E208 HydrophobicContact CD1-CG 4.49Å
154L90.6Very high87.8Confident76 Ų7659.6 Ų59.640%0.39832%0.319SS..Hα-helixtrans-63.6-41.6176.5-178.561.1000111.1D151 A157 R158D151-L154 HydrophobicContact CB-CB 3.91Å; D151-L154 PolarHBondContact O-N 3.32Å; L154-A157 PolarHBondContact O-N 3.06Å; L154-R158 HydrophobicContact CD1-CG 4.03Å; L154-R158 HydrophobicContact CG-CG 4.21Å; L154-R158 WeakPolarHBondContact O-CB 3.35Å; L154-R158 WeakPolarHBondContact O-CG 3.35Å; L154-R158 PolarHBondContact O-N 3.16Å
155L90.9Very high88.2Confident1 Ų152.3 Ų52.31%0.00529%0.293CS..Hα-helixtrans-63.9-46.1179.5-17160.6000111.7L90 C94 S145 M146 L150 D151 I153 A157 R158 A159 L200L90-L155 HydrophobicContact CB-CD2 4.43Å; C94-L155 VanDerWaalsContact SG-CD2 3.51Å; S145-L155 VanDerWaalsContact OG-CD1 3.31Å; S145-L155 WeakPolarHBondContact OG-CD1 3.26Å; M146-L155 HydrophobicContact CG-CD1 3.88Å; L150-L155 HydrophobicContact CD1-CD2 4.1Å; L150-L155 HydrophobicContact CD2-CD2 4.03Å; L150-L155 HydrophobicContact CG-CD2 4.18Å; D151-L155 VanDerWaalsContact O-CB 3.31Å; D151-L155 WeakPolarHBondContact O-CB 3.45Å; D151-L155 PolarHBondContact O-N 2.92Å; I153-L155 VanDerWaalsContact C-N 3.32Å; L155-A157 PolarHBondContact O-N 2.84Å; L155-R158 PolarHBondContact O-N 3.38Å; L155-A159 VanDerWaalsContact O-CB 3.27Å; L155-A159 WeakPolarHBondContact O-CB 3.3Å; L155-A159 PolarHBondContact O-N 3.49Å; L155-L200 HydrophobicContact CG-CD2 4.4Å
156D92.9Very high88.6Confident28 Ų2851.8 Ų51.815%0.1529%0.29CS..Hα-helixtrans-59.5-45.3173.8179.256.3000111.9P152 R158 A159 T160 M197 L200 A204P152-D156 WeakPolarHBondContact O-CB 3.49Å; P152-D156 PolarHBondContact O-N 3.46Å; D156-R158 PolarHBondContact O-N 2.98Å; D156-A159 PolarHBondContact O-N 3.04Å; D156-T160 VanDerWaalsContact O-CB 3.25Å; D156-T160 WeakPolarHBondContact O-CB 3.36Å; D156-T160 PolarHBondContact O-N 2.92Å; D156-T160 PolarHBondContact O-OG1 3.27Å; D156-M197 WeakPolarHBondContact OD1-CE 3.17Å; D156-L200 HydrophobicContact CB-CB 4.47Å; D156-A204 HydrophobicContact CB-CB 3.93Å
157A94.1Very high89.1Confident54 Ų5453 Ų5345%0.44630%0.299SS..Hα-helixtrans-62.7-43.7178.200000112.4I153 L154 L155 A161I153-A157 WeakPolarHBondContact O-CB 3.41Å; I153-A157 PolarHBondContact O-N 3.19Å; L154-A157 PolarHBondContact O-N 3.06Å; L155-A157 PolarHBondContact O-N 2.84Å; A157-A161 WeakPolarHBondContact O-CB 3.32Å; A157-A161 PolarHBondContact O-N 2.68Å
158R93.4Very high89.7Confident79 Ų7951.1 Ų51.130%0.29829%0.294SS..Hα-helixtrans-67.7-44.7179.8-67.4-97174.9154.4-19111.2D141 V142 L154 L155 D156 A161 L162D141-R158 PolarHBondContact O-NH1 3.05Å; D141-R158 IonicContact OD1-CZ 2.91Å; D141-R158 IonicContact OD1-NH1 3.05Å; D141-R158 PolarHBondContact OD1-NH1 3.26Å; D141-R158 IonicContact OD2-NH1 3.54Å; V142-R158 HydrophobicContact CG2-CB 3.93Å; L154-R158 HydrophobicContact CD1-CG 4.03Å; L154-R158 HydrophobicContact CG-CG 4.21Å; L154-R158 WeakPolarHBondContact O-CB 3.35Å; L154-R158 WeakPolarHBondContact O-CG 3.35Å; L154-R158 PolarHBondContact O-N 3.16Å; L155-R158 PolarHBondContact O-N 3.38Å; D156-R158 PolarHBondContact O-N 2.98Å; R158-A161 PolarHBondContact O-N 3.31Å; R158-L162 PolarHBondContact O-N 2.71Å
159A93.1Very high90.5Very high0 Ų045.7 Ų45.70%026%0.259CS..Hα-helixtrans-66.7-40.7177.900000112V142 L155 D156 A161 L162 L163 M197 L200V142-A159 HydrophobicContact CG2-CB 4.49Å; L155-A159 VanDerWaalsContact O-CB 3.27Å; L155-A159 WeakPolarHBondContact O-CB 3.3Å; L155-A159 PolarHBondContact O-N 3.49Å; D156-A159 PolarHBondContact O-N 3.04Å; A159-A161 VanDerWaalsContact C-N 3.32Å; A159-A161 PolarHBondContact O-N 2.69Å; A159-L162 WeakPolarHBondContact O-CB 3.44Å; A159-L162 PolarHBondContact O-N 3.27Å; A159-L163 PolarHBondContact O-N 3.33Å; A159-M197 HydrophobicContact CB-CE 4.06Å; A159-M197 HydrophobicContact CB-SD 3.56Å; A159-M197 VanDerWaalsContact CB-SD 3.56Å; A159-L200 HydrophobicContact CB-CD2 3.61Å
160T95Very high91.3Very high65 Ų6539.8 Ų39.840%0.39922%0.221SC..Hα-helixtrans-58.8-44.6172.8-62.80000111.1D156 L162 L163 L164 M197D156-T160 VanDerWaalsContact O-CB 3.25Å; D156-T160 WeakPolarHBondContact O-CB 3.36Å; D156-T160 PolarHBondContact O-N 2.92Å; D156-T160 PolarHBondContact O-OG1 3.27Å; T160-L162 VanDerWaalsContact C-N 3.31Å; T160-L162 PolarHBondContact O-N 3.04Å; T160-L163 PolarHBondContact O-N 3.14Å; T160-L164 WeakPolarHBondContact O-CB 3.18Å; T160-L164 PolarHBondContact O-N 2.86Å; T160-M197 WeakPolarHBondContact OG1-CE 3.24Å
161A94.8Very high91.8Very high33 Ų3343 Ų4327%0.27324%0.238SC..Hα-helixtrans-65-34.6179.700000112.7R138 A157 R158 A159 S165R138-A161 PolarHBondContact NH1-O 3.39Å; A157-A161 WeakPolarHBondContact O-CB 3.32Å; A157-A161 PolarHBondContact O-N 2.68Å; R158-A161 PolarHBondContact O-N 3.31Å; A159-A161 VanDerWaalsContact C-N 3.32Å; A159-A161 PolarHBondContact O-N 2.69Å; A161-S165 PolarHBondContact O-N 3.25Å; A161-S165 PolarHBondContact O-OG 3.15Å
162L94.2Very high92Very high0 Ų040.8 Ų40.80%023%0.227CC..Hα-helixtrans-64.9-53.6171.7174.863.2000111L98 C101 I135 R138 V139 V142 R158 A159 T160 L164 S165 V166L98-L162 HydrophobicContact CD2-CD2 3.62Å; C101-L162 HydrophobicContact CB-CD2 4.17Å; C101-L162 HydrophobicContact CB-CG 4.35Å; I135-L162 HydrophobicContact CG2-CD1 3.9Å; R138-L162 HydrophobicContact CB-CB 4.26Å; R138-L162 HydrophobicContact CB-CD1 3.8Å; V139-L162 HydrophobicContact CG2-CD1 3.77Å; V139-L162 HydrophobicContact CG2-CD2 4.11Å; V142-L162 HydrophobicContact CG2-CB 4.24Å; V142-L162 HydrophobicContact CG2-CD2 4.21Å; R158-L162 PolarHBondContact O-N 2.71Å; A159-L162 WeakPolarHBondContact O-CB 3.44Å; A159-L162 PolarHBondContact O-N 3.27Å; T160-L162 VanDerWaalsContact C-N 3.31Å; T160-L162 PolarHBondContact O-N 3.04Å; L162-L164 VanDerWaalsContact C-N 3.3Å; L162-L164 PolarHBondContact O-N 2.96Å; L162-S165 WeakPolarHBondContact O-CA 3.21Å; L162-S165 WeakPolarHBondContact O-CB 3.34Å; L162-S165 PolarHBondContact O-N 3.42Å; L162-V166 HydrophobicContact CD1-CG2 4.28Å; L162-V166 PolarHBondContact O-N 3.2Å
163L94.3Very high91.9Very high17 Ų1739.6 Ų39.69%0.08922%0.219CC..Hα-helixtrans-60-39.7-178-176.460.8000112.3A159 T160 S165 V166 S167 L190 A193 E194 M197A159-L163 PolarHBondContact O-N 3.33Å; T160-L163 PolarHBondContact O-N 3.14Å; L163-S165 PolarHBondContact O-N 3.1Å; L163-V166 PolarHBondContact O-N 3.25Å; L163-S167 WeakPolarHBondContact O-CB 3.28Å; L163-S167 PolarHBondContact O-N 3.02Å; L163-S167 PolarHBondContact O-OG 3.28Å; L163-L190 HydrophobicContact CD1-CD2 4.03Å; L163-A193 HydrophobicContact CD1-CB 3.76Å; L163-E194 HydrophobicContact CD2-CG 3.98Å; L163-M197 HydrophobicContact CD2-CG 3.83Å
164L94.6Very high91.7Very high124 Ų12439.5 Ų39.565%0.64921%0.214SC*.Hα-helixtrans-59.6-38174-167.292.5000111.7T160 L162 S167 H168T160-L164 WeakPolarHBondContact O-CB 3.18Å; T160-L164 PolarHBondContact O-N 2.86Å; L162-L164 VanDerWaalsContact C-N 3.3Å; L162-L164 PolarHBondContact O-N 2.96Å; L164-S167 PolarHBondContact O-N 3.24Å; L164-H168 WeakPolarHBondContact O-CB 3.34Å; L164-H168 PolarHBondContact O-N 3.14Å
165S93.3Very high91.3Very high10 Ų1041.9 Ų41.97%0.0723%0.227CC..Hα-helixtrans-74.5-37.1-178.1-58.30000112.3R138 A161 L162 L163 H168 L169R138-S165 VanDerWaalsContact CD-CB 3.48Å; R138-S165 WeakPolarHBondContact CD-OG 3.3Å; R138-S165 PolarHBondContact NE-OG 3.12Å; R138-S165 PolarHBondContact NH2-OG 3.08Å; A161-S165 PolarHBondContact O-N 3.25Å; A161-S165 PolarHBondContact O-OG 3.15Å; L162-S165 WeakPolarHBondContact O-CA 3.21Å; L162-S165 WeakPolarHBondContact O-CB 3.34Å; L162-S165 PolarHBondContact O-N 3.42Å; L163-S165 PolarHBondContact O-N 3.1Å; S165-H168 PolarHBondContact O-N 2.9Å; S165-L169 PolarHBondContact O-N 3.36Å
166V92.4Very high90.8Very high0 Ų042 Ų420%023%0.228CC..Hα-helixtrans-67.2-41.8171.7178.30000110.6C101 L104 I135 L162 L163 H168 L169 V170C101-V166 HydrophobicContact CB-CG2 3.88Å; L104-V166 HydrophobicContact CB-CG1 4.33Å; L104-V166 HydrophobicContact CD2-CG1 3.55Å; L104-V166 HydrophobicContact CG-CG1 3.9Å; I135-V166 HydrophobicContact CD1-CG2 4.23Å; I135-V166 HydrophobicContact CG2-CG2 4.29Å; L162-V166 HydrophobicContact CD1-CG2 4.28Å; L162-V166 PolarHBondContact O-N 3.2Å; L163-V166 PolarHBondContact O-N 3.25Å; V166-H168 VanDerWaalsContact C-N 3.3Å; V166-H168 PolarHBondContact O-N 2.88Å; V166-L169 WeakPolarHBondContact O-CB 3.3Å; V166-L169 PolarHBondContact O-N 2.98Å; V166-L169 VanDerWaalsContact O-N 3.12Å; V166-V170 WeakPolarHBondContact O-CG2 3.29Å; V166-V170 PolarHBondContact O-N 3Å
167S93.1Very high89.8Confident33 Ų3341.7 Ų41.723%0.23123%0.228CC..Hα-helixtrans-61-40173.9-59.10000111.7L163 L164 V170 L171L163-S167 WeakPolarHBondContact O-CB 3.28Å; L163-S167 PolarHBondContact O-N 3.02Å; L163-S167 PolarHBondContact O-OG 3.28Å; L164-S167 PolarHBondContact O-N 3.24Å; S167-V170 WeakPolarHBondContact O-CB 3.48Å; S167-V170 PolarHBondContact O-N 2.91Å; S167-L171 WeakPolarHBondContact O-CG 3.47Å; S167-L171 PolarHBondContact O-N 3.04Å
168H92.8Very high88.7Confident91 Ų9144.8 Ų44.842%0.42123%0.233SC..Hα-helixtrans-64.1-41.3173.3-177.5-108.4000111.9V131 L164 S165 V166 V170 L171 V172V131-H168 WeakPolarHBondContact CG1-ND1 3.08Å; V131-H168 VanDerWaalsContact CG2-CE1 3.47Å; V131-H168 WeakPolarHBondContact CG2-CE1 3.16Å; L164-H168 WeakPolarHBondContact O-CB 3.34Å; L164-H168 PolarHBondContact O-N 3.14Å; S165-H168 PolarHBondContact O-N 2.9Å; V166-H168 VanDerWaalsContact C-N 3.3Å; V166-H168 PolarHBondContact O-N 2.88Å; H168-V170 VanDerWaalsContact C-N 3.34Å; H168-V170 PolarHBondContact O-N 3.27Å; H168-L171 PolarHBondContact O-N 2.94Å; H168-V172 WeakPolarHBondContact O-CG2 3.1Å; H168-V172 PolarHBondContact O-N 2.85Å
169L90.1Very high87.5Confident0 Ų043.1 Ų43.10%023%0.229CC..Hα-helixtrans-58.8-45.5173-178.163.8000111.4T105 L108 I128 V131 A132 I135 S165 V166 L171 V172 T173T105-L169 HydrophobicContact CG2-CD2 3.76Å; L108-L169 HydrophobicContact CB-CD2 4.39Å; L108-L169 HydrophobicContact CD1-CD2 4.11Å; L108-L169 HydrophobicContact CD1-CG 4.12Å; I128-L169 HydrophobicContact CG2-CD1 3.93Å; V131-L169 HydrophobicContact CB-CD1 4.23Å; V131-L169 HydrophobicContact CG1-CB 3.88Å; V131-L169 HydrophobicContact CG1-CD1 4.06Å; A132-L169 HydrophobicContact CB-CD1 4.21Å; A132-L169 HydrophobicContact CB-CD2 4.35Å; I135-L169 HydrophobicContact CD1-CB 4.19Å; I135-L169 HydrophobicContact CD1-CD2 3.48Å; I135-L169 VanDerWaalsContact CD1-CD2 3.48Å; I135-L169 HydrophobicContact CD1-CG 4.41Å; S165-L169 PolarHBondContact O-N 3.36Å; V166-L169 WeakPolarHBondContact O-CB 3.3Å; V166-L169 PolarHBondContact O-N 2.98Å; V166-L169 VanDerWaalsContact O-N 3.12Å; L169-L171 VanDerWaalsContact C-N 3.3Å; L169-L171 PolarHBondContact O-N 2.91Å; L169-V172 PolarHBondContact O-N 2.74Å; L169-T173 VanDerWaalsContact O-CB 3.32Å; L169-T173 WeakPolarHBondContact O-CB 3.42Å; L169-T173 PolarHBondContact O-N 2.8Å; L169-T173 PolarHBondContact O-OG1 3.19Å
170V90.1Very high85.7Confident3 Ų349.1 Ų49.12%0.01827%0.271CS..Hα-helixtrans-54-47.4174.9168.50000111.1L104 L108 V166 S167 H168 T173 R174 I186 L190L104-V170 HydrophobicContact CD1-CG2 4.38Å; L104-V170 HydrophobicContact CD2-CG2 4.18Å; L104-V170 HydrophobicContact CG-CG2 4.39Å; L108-V170 HydrophobicContact CD1-CB 4.37Å; L108-V170 HydrophobicContact CD1-CG2 3.46Å; L108-V170 VanDerWaalsContact CD1-CG2 3.46Å; L108-V170 HydrophobicContact CD2-CG2 4.22Å; L108-V170 HydrophobicContact CG-CG2 4.45Å; V166-V170 WeakPolarHBondContact O-CG2 3.29Å; V166-V170 PolarHBondContact O-N 3Å; S167-V170 WeakPolarHBondContact O-CB 3.48Å; S167-V170 PolarHBondContact O-N 2.91Å; H168-V170 VanDerWaalsContact C-N 3.34Å; H168-V170 PolarHBondContact O-N 3.27Å; V170-T173 PolarHBondContact O-N 3.49Å; V170-R174 HydrophobicContact CG1-CG 4.39Å; V170-R174 VanDerWaalsContact O-CB 3.31Å; V170-R174 WeakPolarHBondContact O-CB 2.94Å; V170-R174 WeakPolarHBondContact O-CG 3.42Å; V170-R174 PolarHBondContact O-N 2.73Å; V170-I186 HydrophobicContact CB-CG2 4.43Å; V170-I186 HydrophobicContact CG1-CG2 3.57Å; V170-I186 HydrophobicContact CG2-CG2 3.89Å; V170-L190 HydrophobicContact CG2-CD1 4.38Å
171L89.1Confident84.1Confident114 Ų11448.6 Ų48.660%0.59728%0.278SS*.Hα-helixtrans-63.8-46.9-179.3-70.6172.2000112.2S167 H168 L169 T173 R174 N175S167-L171 WeakPolarHBondContact O-CG 3.47Å; S167-L171 PolarHBondContact O-N 3.04Å; H168-L171 PolarHBondContact O-N 2.94Å; L169-L171 VanDerWaalsContact C-N 3.3Å; L169-L171 PolarHBondContact O-N 2.91Å; L171-T173 VanDerWaalsContact C-N 3.34Å; L171-R174 PolarHBondContact O-N 3.32Å; L171-N175 VanDerWaalsContact O-CB 3.31Å; L171-N175 WeakPolarHBondContact O-CB 3.39Å; L171-N175 PolarHBondContact O-N 3.23Å
172V87.6Confident82.4Confident27 Ų2751.6 Ų51.616%0.16430%0.297CS..Hα-helixtrans-64.5-41.7179.4177.70000110.5D127 I128 V131 H168 L169 N175 A176D127-V172 HydrophobicContact CB-CG1 4.29Å; I128-V172 HydrophobicContact CG1-CG1 3.71Å; V131-V172 HydrophobicContact CG2-CG2 4.44Å; H168-V172 WeakPolarHBondContact O-CG2 3.1Å; H168-V172 PolarHBondContact O-N 2.85Å; L169-V172 PolarHBondContact O-N 2.74Å; V172-N175 PolarHBondContact O-N 3.34Å; V172-A176 VanDerWaalsContact O-CB 3.31Å; V172-A176 WeakPolarHBondContact O-CB 3.16Å; V172-A176 PolarHBondContact O-N 2.77Å
173T84Confident81.4Confident0 Ų053 Ų530%030%0.304CS..Hα-helixtrans-65.8-45.8176.3-62.90000112.1L108 T112 L169 V170 L171 N175 A176 C177 M179L108-T173 HydrophobicContact CB-CG2 4.44Å; L108-T173 HydrophobicContact CD2-CG2 3.92Å; T112-T173 HydrophobicContact CG2-CG2 3.71Å; L169-T173 VanDerWaalsContact O-CB 3.32Å; L169-T173 WeakPolarHBondContact O-CB 3.42Å; L169-T173 PolarHBondContact O-N 2.8Å; L169-T173 PolarHBondContact O-OG1 3.19Å; V170-T173 PolarHBondContact O-N 3.49Å; L171-T173 VanDerWaalsContact C-N 3.34Å; T173-N175 VanDerWaalsContact C-N 3.28Å; T173-N175 PolarHBondContact O-N 2.75Å; T173-A176 PolarHBondContact O-N 2.82Å; T173-C177 VanDerWaalsContact O-CB 3.31Å; T173-C177 WeakPolarHBondContact O-CB 3.24Å; T173-C177 PolarHBondContact O-N 3.42Å; T173-M179 HydrophobicContact CG2-CE 4.4Å; T173-M179 HydrophobicContact CG2-SD 4.36Å
174R84.8Confident80.7Confident74 Ų7457.1 Ų57.128%0.27933%0.326SS..Hα-helixtrans-56.6-43.8174.8-84.7-178.8167.6170.9-2.7111.2V170 L171 H178 M179 D187V170-R174 HydrophobicContact CG1-CG 4.39Å; V170-R174 VanDerWaalsContact O-CB 3.31Å; V170-R174 WeakPolarHBondContact O-CB 2.94Å; V170-R174 WeakPolarHBondContact O-CG 3.42Å; V170-R174 PolarHBondContact O-N 2.73Å; L171-R174 PolarHBondContact O-N 3.32Å; R174-H178 PolarHBondContact O-N 3.41Å; R174-M179 HydrophobicContact CB-SD 4.14Å; R174-M179 HydrophobicContact CG-CB 4.32Å; R174-M179 HydrophobicContact CG-CG 4.32Å; R174-M179 HydrophobicContact CG-SD 3.42Å; R174-M179 WeakPolarHBondContact CG-SD 3.44Å; R174-D187 IonicContact CZ-OD1 3.93Å; R174-D187 IonicContact CZ-OD2 3.65Å; R174-D187 IonicContact NH1-OD1 3.1Å; R174-D187 PolarHBondContact NH1-OD1 2.75Å; R174-D187 VanDerWaalsContact NH1-OD1 3.1Å; R174-D187 IonicContact NH1-OD2 3.96Å; R174-D187 VanDerWaalsContact NH2-CG 3.34Å; R174-D187 IonicContact NH2-OD1 3.81Å; R174-D187 PolarHBondContact NH2-OD1 3.48Å; R174-D187 IonicContact NH2-OD2 3.64Å; R174-D187 PolarHBondContact NH2-OD2 3.49Å
175N83.6Confident80.2Confident127 Ų12754 Ų5468%0.67931%0.306SS*.Hα-helixtrans-67.2-43178.7-179.464.3000112.9L171 V172 T173L171-N175 VanDerWaalsContact O-CB 3.31Å; L171-N175 WeakPolarHBondContact O-CB 3.39Å; L171-N175 PolarHBondContact O-N 3.23Å; V172-N175 PolarHBondContact O-N 3.34Å; T173-N175 VanDerWaalsContact C-N 3.28Å; T173-N175 PolarHBondContact O-N 2.75Å
176A78.6Confident80Confident3 Ų353.6 Ų53.63%0.02530%0.302CS..Hα-helixtrans-75.4-36.3-176.800000113.6I128 V172 T173I128-A176 HydrophobicContact CD1-CB 3.52Å; I128-A176 HydrophobicContact CG1-CB 4.32Å; V172-A176 VanDerWaalsContact O-CB 3.31Å; V172-A176 WeakPolarHBondContact O-CB 3.16Å; V172-A176 PolarHBondContact O-N 2.77Å; T173-A176 PolarHBondContact O-N 2.82Å
177C73.7Confident79.8Confident22 Ų2256.8 Ų56.815%0.14932%0.32CS..Hα-helixtrans-94.60.8-174.5-63.60000113.9T173 M179T173-C177 VanDerWaalsContact O-CB 3.31Å; T173-C177 WeakPolarHBondContact O-CB 3.24Å; T173-C177 PolarHBondContact O-N 3.42Å; C177-M179 HydrophobicContact CB-CG 4.05Å; C177-M179 PolarHBondContact O-N 3.45Å
178H70.1Confident79.7Confident119 Ų11961 Ų6155%0.55134%0.336SS*.THydrogen-bonded Turntrans45.949.5-175.7-76.2-73.1000111.9R174 S180R174-H178 PolarHBondContact O-N 3.41Å; H178-S180 VanDerWaalsContact C-N 3.32Å; H178-S180 PolarHBondContact O-N 3.46Å
179M69.1Low79.5Confident43 Ų4357.4 Ų57.421%0.21232%0.321CS..  trans-58.395.9-179.1-62.9-179.4119.800109.1M111 T173 R174 C177 G181 Q183 I186M111-M179 HydrophobicContact CE-CE 3.29Å; M111-M179 HydrophobicContact SD-CE 3.36Å; M111-M179 WeakPolarHBondContact SD-CE 3.5Å; T173-M179 HydrophobicContact CG2-CE 4.4Å; T173-M179 HydrophobicContact CG2-SD 4.36Å; R174-M179 HydrophobicContact CB-SD 4.14Å; R174-M179 HydrophobicContact CG-CB 4.32Å; R174-M179 HydrophobicContact CG-CG 4.32Å; R174-M179 HydrophobicContact CG-SD 3.42Å; R174-M179 WeakPolarHBondContact CG-SD 3.44Å; C177-M179 HydrophobicContact CB-CG 4.05Å; C177-M179 PolarHBondContact O-N 3.45Å; M179-G181 PolarHBondContact O-N 3.43Å; M179-Q183 VanDerWaalsContact CE-NE2 3.25Å; M179-Q183 PolarHBondContact SD-OE1 3.14Å; M179-I186 HydrophobicContact CE-CD1 4.17Å; M179-I186 HydrophobicContact SD-CD1 4.29Å
180S54.1Low79.6Confident127 Ų12758.5 Ų58.589%0.88833%0.326SS*.  trans-9480.3-174.5176.20000108.3H178H178-S180 VanDerWaalsContact C-N 3.32Å; H178-S180 PolarHBondContact O-N 3.46Å
181G62.1Low79.6Confident53 Ų5363.3 Ų63.355%0.54635%0.349SS..SBendtrans169.4155.8177.100000111.9M179 Q183M179-G181 PolarHBondContact O-N 3.43Å; G181-Q183 PolarHBondContact O-N 3.39Å; G181-Q183 VanDerWaalsContact O-N 3.11Å
182S59.2Low79.6Confident96 Ų9659.6 Ų59.667%0.67133%0.334SS*.  trans-67.1107.7166.1-162.30000107.1D184S182-D184 VanDerWaalsContact CB-OD1 3.31Å; S182-D184 WeakPolarHBondContact CB-OD1 3.26Å; S182-D184 PolarHBondContact O-N 3.18Å; S182-D184 PolarHBondContact OG-OD1 3.04Å
183Q72.7Confident79.7Confident29 Ų2958.4 Ų58.414%0.13633%0.327CS..  trans-94.469.3-178.3-159.8157.4-25.600108.5M111 M179 G181 W185 I186M111-Q183 PolarHBondContact SD-NE2 3.49Å; M179-Q183 VanDerWaalsContact CE-NE2 3.25Å; M179-Q183 PolarHBondContact SD-OE1 3.14Å; G181-Q183 PolarHBondContact O-N 3.39Å; G181-Q183 VanDerWaalsContact O-N 3.11Å; Q183-W185 HydrophobicContact CG-CG 4.35Å; Q183-W185 HydrophobicContact CG-CZ2 4.48Å; Q183-W185 PolarHBondContact O-N 3.09Å; Q183-I186 HydrophobicContact CB-CD1 4.05Å; Q183-I186 HydrophobicContact CB-CG1 4.38Å; Q183-I186 HydrophobicContact CG-CB 4.48Å; Q183-I186 HydrophobicContact CG-CD1 3.67Å; Q183-I186 HydrophobicContact CG-CG1 3.86Å; Q183-I186 VanDerWaalsContact NE2-CD1 3.35Å; Q183-I186 WeakPolarHBondContact O-CB 3.21Å; Q183-I186 PolarHBondContact O-N 3.3Å
184D80.1Confident80.1Confident105 Ų10563 Ų6356%0.56135%0.348SS*.Hα-helixtrans-54.8-30.4-168.9-59.7-24.2000112.3S182 I186 D187 Q188S182-D184 VanDerWaalsContact CB-OD1 3.31Å; S182-D184 WeakPolarHBondContact CB-OD1 3.26Å; S182-D184 PolarHBondContact O-N 3.18Å; S182-D184 PolarHBondContact OG-OD1 3.04Å; D184-I186 PolarHBondContact O-N 2.97Å; D184-D187 PolarHBondContact O-N 2.97Å; D184-Q188 WeakPolarHBondContact O-CB 3.46Å; D184-Q188 PolarHBondContact O-N 3.34Å
185W84.7Confident80.5Confident59 Ų5963.8 Ų63.822%0.22336%0.358CS..Hα-helixtrans-68.9-31.8177.874.9-100.3000113.7L104 K107 M111 Q183 S189L104-W185 HydrophobicContact CD1-CE3 4.32Å; L104-W185 HydrophobicContact CD1-CH2 3.98Å; L104-W185 HydrophobicContact CD1-CZ3 3.43Å; L104-W185 VanDerWaalsContact CD1-CZ3 3.43Å; K107-W185 HydrophobicContact CB-CH2 3.53Å; K107-W185 HydrophobicContact CB-CZ2 4.31Å; K107-W185 HydrophobicContact CB-CZ3 4.02Å; K107-W185 HydrophobicContact CD-CH2 4.21Å; K107-W185 HydrophobicContact CD-CZ3 4Å; K107-W185 HydrophobicContact CG-CH2 4.47Å; M111-W185 HydrophobicContact CE-CH2 3.78Å; M111-W185 HydrophobicContact CE-CZ2 3.44Å; M111-W185 VanDerWaalsContact CE-CZ2 3.44Å; M111-W185 HydrophobicContact SD-CZ2 3.87Å; Q183-W185 HydrophobicContact CG-CG 4.35Å; Q183-W185 HydrophobicContact CG-CZ2 4.48Å; Q183-W185 PolarHBondContact O-N 3.09Å; W185-S189 VanDerWaalsContact O-CB 3.26Å; W185-S189 WeakPolarHBondContact O-CB 3.3Å; W185-S189 PolarHBondContact O-N 2.77Å; W185-S189 PolarHBondContact O-OG 3.49Å
186I88.4Confident80.8Confident0 Ų060.1 Ų60.10%034%0.337CS..Hα-helixtrans-67.3-50.5175.5-72.3175.2000108.3L104 L108 V170 M179 Q183 D184 Q188 S189 L190L104-I186 HydrophobicContact CD1-CG1 4.22Å; L104-I186 HydrophobicContact CD1-CG2 4.38Å; L108-I186 HydrophobicContact CD2-CD1 3.95Å; V170-I186 HydrophobicContact CB-CG2 4.43Å; V170-I186 HydrophobicContact CG1-CG2 3.57Å; V170-I186 HydrophobicContact CG2-CG2 3.89Å; M179-I186 HydrophobicContact CE-CD1 4.17Å; M179-I186 HydrophobicContact SD-CD1 4.29Å; Q183-I186 HydrophobicContact CB-CD1 4.05Å; Q183-I186 HydrophobicContact CB-CG1 4.38Å; Q183-I186 HydrophobicContact CG-CB 4.48Å; Q183-I186 HydrophobicContact CG-CD1 3.67Å; Q183-I186 HydrophobicContact CG-CG1 3.86Å; Q183-I186 VanDerWaalsContact NE2-CD1 3.35Å; Q183-I186 WeakPolarHBondContact O-CB 3.21Å; Q183-I186 PolarHBondContact O-N 3.3Å; D184-I186 PolarHBondContact O-N 2.97Å; I186-Q188 VanDerWaalsContact C-N 3.31Å; I186-Q188 PolarHBondContact O-N 3.49Å; I186-S189 PolarHBondContact O-N 3.5Å; I186-L190 HydrophobicContact CG2-CD1 4.15Å; I186-L190 WeakPolarHBondContact O-CG 3.49Å; I186-L190 PolarHBondContact O-N 3.2Å
187D88.9Confident81.4Confident68 Ų6860.8 Ų60.836%0.36434%0.34SS..Hα-helixtrans-67.2-36.5-176.8-56.9-47.6000110.2R174 D184 L190 H191R174-D187 IonicContact CZ-OD1 3.93Å; R174-D187 IonicContact CZ-OD2 3.65Å; R174-D187 IonicContact NH1-OD1 3.1Å; R174-D187 PolarHBondContact NH1-OD1 2.75Å; R174-D187 VanDerWaalsContact NH1-OD1 3.1Å; R174-D187 IonicContact NH1-OD2 3.96Å; R174-D187 VanDerWaalsContact NH2-CG 3.34Å; R174-D187 IonicContact NH2-OD1 3.81Å; R174-D187 PolarHBondContact NH2-OD1 3.48Å; R174-D187 IonicContact NH2-OD2 3.64Å; R174-D187 PolarHBondContact NH2-OD2 3.49Å; D184-D187 PolarHBondContact O-N 2.97Å; D187-L190 PolarHBondContact O-N 3.37Å; D187-H191 VanDerWaalsContact O-CB 3.28Å; D187-H191 WeakPolarHBondContact O-CB 3.35Å; D187-H191 PolarHBondContact O-N 3.36Å
188Q89.4Confident82.3Confident122 Ų12263.4 Ų63.457%0.5736%0.355SS*.Hα-helixtrans-65.1-38.8172.4-174170.53700112.8D184 I186 H191 A192D184-Q188 WeakPolarHBondContact O-CB 3.46Å; D184-Q188 PolarHBondContact O-N 3.34Å; I186-Q188 VanDerWaalsContact C-N 3.31Å; I186-Q188 PolarHBondContact O-N 3.49Å; Q188-H191 PolarHBondContact O-N 3.5Å; Q188-A192 WeakPolarHBondContact O-CB 3.3Å; Q188-A192 PolarHBondContact O-N 3.1Å
189S89.2Confident83.2Confident15 Ų1560 Ų6011%0.10534%0.342CS..Hα-helixtrans-68-44.3177.1-62.90000111I100 W185 I186 A192 A193I100-S189 VanDerWaalsContact CG2-O 3.22Å; I100-S189 WeakPolarHBondContact CG2-O 3.28Å; W185-S189 VanDerWaalsContact O-CB 3.26Å; W185-S189 WeakPolarHBondContact O-CB 3.3Å; W185-S189 PolarHBondContact O-N 2.77Å; W185-S189 PolarHBondContact O-OG 3.49Å; I186-S189 PolarHBondContact O-N 3.5Å; S189-A192 PolarHBondContact O-N 3.18Å; S189-A193 PolarHBondContact O-N 3.4Å; S189-A193 VanDerWaalsContact O-N 3.07Å
190L91.1Very high84.2Confident22 Ų2258 Ų5812%0.11533%0.333CS..Hα-helixtrans-61.4-44.6174.3-71.7174.4000111.3L104 L163 V170 I186 D187 A192 A193 E194L104-L190 HydrophobicContact CD2-CD2 3.65Å; L104-L190 HydrophobicContact CD2-CG 3.96Å; L163-L190 HydrophobicContact CD1-CD2 4.03Å; V170-L190 HydrophobicContact CG2-CD1 4.38Å; I186-L190 HydrophobicContact CG2-CD1 4.15Å; I186-L190 WeakPolarHBondContact O-CG 3.49Å; I186-L190 PolarHBondContact O-N 3.2Å; D187-L190 PolarHBondContact O-N 3.37Å; L190-A192 PolarHBondContact O-N 2.87Å; L190-A193 WeakPolarHBondContact O-CB 3.42Å; L190-A193 PolarHBondContact O-N 3.45Å; L190-A193 VanDerWaalsContact O-N 3.16Å; L190-E194 WeakPolarHBondContact O-CG 3.24Å; L190-E194 PolarHBondContact O-N 3.3Å
191H91.9Very high86Confident105 Ų10559.8 Ų59.849%0.48632%0.32SS..Hα-helixtrans-63.2-42.6178.5-167.854.6000112.6D187 Q188 A193 E194 D195D187-H191 VanDerWaalsContact O-CB 3.28Å; D187-H191 WeakPolarHBondContact O-CB 3.35Å; D187-H191 PolarHBondContact O-N 3.36Å; Q188-H191 PolarHBondContact O-N 3.5Å; H191-A193 VanDerWaalsContact C-N 3.27Å; H191-A193 PolarHBondContact O-N 2.91Å; H191-E194 IonicContact ND1-OE2 3.68Å; H191-E194 WeakPolarHBondContact O-CB 3.3Å; H191-E194 PolarHBondContact O-N 3.29Å; H191-E194 VanDerWaalsContact O-N 3.13Å; H191-D195 PolarHBondContact O-N 2.83Å
192A87.9Confident87.3Confident36 Ų3662.9 Ų62.930%0.29832%0.32SS..Hα-helixtrans-61-36.8174.500000112.2I100 Q188 S189 L190 H196I100-A192 HydrophobicContact CD1-CB 4Å; Q188-A192 WeakPolarHBondContact O-CB 3.3Å; Q188-A192 PolarHBondContact O-N 3.1Å; S189-A192 PolarHBondContact O-N 3.18Å; L190-A192 PolarHBondContact O-N 2.87Å; A192-H196 PolarHBondContact O-CD2 3.27Å; A192-H196 PolarHBondContact O-N 3.34Å
193A89.6Confident88.6Confident1 Ų159.4 Ų59.41%0.00830%0.297CS..Hα-helixtrans-67.9-40.717400000111.8I100 L163 S189 L190 H191 D195 H196 M197I100-A193 HydrophobicContact CB-CB 4.47Å; I100-A193 HydrophobicContact CD1-CB 4.34Å; I100-A193 HydrophobicContact CG2-CB 3.99Å; L163-A193 HydrophobicContact CD1-CB 3.76Å; S189-A193 PolarHBondContact O-N 3.4Å; S189-A193 VanDerWaalsContact O-N 3.07Å; L190-A193 WeakPolarHBondContact O-CB 3.42Å; L190-A193 PolarHBondContact O-N 3.45Å; L190-A193 VanDerWaalsContact O-N 3.16Å; H191-A193 VanDerWaalsContact C-N 3.27Å; H191-A193 PolarHBondContact O-N 2.91Å; A193-D195 VanDerWaalsContact C-N 3.34Å; A193-D195 PolarHBondContact O-N 2.83Å; A193-H196 PolarHBondContact O-N 3.44Å; A193-M197 WeakPolarHBondContact O-CG 3.38Å; A193-M197 PolarHBondContact O-N 2.91Å
194E93.4Very high89.3Confident96 Ų9658.4 Ų58.445%0.44929%0.294SS..Hα-helixtrans-60.9-39.4175.3-71.6173.9166.800112.3L163 L190 H191 H196 M197 V198L163-E194 HydrophobicContact CD2-CG 3.98Å; L190-E194 WeakPolarHBondContact O-CG 3.24Å; L190-E194 PolarHBondContact O-N 3.3Å; H191-E194 IonicContact ND1-OE2 3.68Å; H191-E194 WeakPolarHBondContact O-CB 3.3Å; H191-E194 PolarHBondContact O-N 3.29Å; H191-E194 VanDerWaalsContact O-N 3.13Å; E194-H196 VanDerWaalsContact C-N 3.3Å; E194-H196 PolarHBondContact O-N 2.88Å; E194-M197 WeakPolarHBondContact O-CA 3.21Å; E194-M197 WeakPolarHBondContact O-CB 3.27Å; E194-M197 PolarHBondContact O-N 3.46Å; E194-V198 PolarHBondContact O-N 3.44Å
195D92.5Very high89.7Confident92 Ų9258.5 Ų58.549%0.49229%0.294SS..Hα-helixtrans-59.7-41.3176.2-76.1-18.7000111.8H191 A193H191-D195 PolarHBondContact O-N 2.83Å; A193-D195 VanDerWaalsContact C-N 3.34Å; A193-D195 PolarHBondContact O-N 2.83Å
196H89.8Confident89.7Confident50 Ų5059.9 Ų59.923%0.23132%0.318CS..Hα-helixtrans-69.5-34.9173.7-69.6-66.9000112.1H93 S96 I97 A192 A193 E194 V198 V199 L200H93-H196 HydrophobicContact CB-CB 4.44Å; H93-H196 AromaticContact CE1-ND1 3.76Å; H93-H196 AromaticContact CG-ND1 3.89Å; H93-H196 AromaticContact ND1-CG 3.92Å; H93-H196 AromaticContact ND1-ND1 3.06Å; H93-H196 PolarHBondContact ND1-ND1 3.36Å; S96-H196 WeakPolarHBondContact CB-NE2 3.45Å; I97-H196 HydrophobicContact CD1-CB 3.81Å; I97-H196 HydrophobicContact CG1-CB 3.52Å; A192-H196 PolarHBondContact O-CD2 3.27Å; A192-H196 PolarHBondContact O-N 3.34Å; A193-H196 PolarHBondContact O-N 3.44Å; E194-H196 VanDerWaalsContact C-N 3.3Å; E194-H196 PolarHBondContact O-N 2.88Å; H196-V198 VanDerWaalsContact C-N 3.31Å; H196-V198 PolarHBondContact O-N 3.37Å; H196-V199 PolarHBondContact O-N 3.47Å; H196-L200 WeakPolarHBondContact O-CD1 3.27Å; H196-L200 PolarHBondContact O-N 3.17Å
197M91.6Very high89.3Confident16 Ų1661.9 Ų61.98%0.07933%0.332CS..Hα-helixtrans-63.2-33.3176.3-73.7-64.9-50.900113I97 D156 A159 T160 L163 A193 E194 V199 L200 R201I97-M197 HydrophobicContact CD1-CG 4.15Å; I97-M197 HydrophobicContact CD1-SD 3.71Å; D156-M197 WeakPolarHBondContact OD1-CE 3.17Å; A159-M197 HydrophobicContact CB-CE 4.06Å; A159-M197 HydrophobicContact CB-SD 3.56Å; A159-M197 VanDerWaalsContact CB-SD 3.56Å; T160-M197 WeakPolarHBondContact OG1-CE 3.24Å; L163-M197 HydrophobicContact CD2-CG 3.83Å; A193-M197 WeakPolarHBondContact O-CG 3.38Å; A193-M197 PolarHBondContact O-N 2.91Å; E194-M197 WeakPolarHBondContact O-CA 3.21Å; E194-M197 WeakPolarHBondContact O-CB 3.27Å; E194-M197 PolarHBondContact O-N 3.46Å; M197-V199 VanDerWaalsContact C-N 3.26Å; M197-V199 PolarHBondContact O-N 2.86Å; M197-L200 PolarHBondContact O-N 3.01Å; M197-L200 HydrophobicContact SD-CD2 4.29Å; M197-R201 WeakPolarHBondContact O-CB 3.4Å; M197-R201 PolarHBondContact O-N 2.91Å
198V92.8Very high88.6Confident78 Ų7864.9 Ų64.947%0.47334%0.343SS..Hα-helixtrans-57.5-42.5176.41720000110.9E194 H196 R201 E202E194-V198 PolarHBondContact O-N 3.44Å; H196-V198 VanDerWaalsContact C-N 3.31Å; H196-V198 PolarHBondContact O-N 3.37Å; V198-R201 WeakPolarHBondContact O-CB 3.28Å; V198-R201 PolarHBondContact O-N 2.91Å; V198-E202 WeakPolarHBondContact O-CG 3.32Å; V198-E202 PolarHBondContact O-N 3.48Å
199V89.5Confident87.1Confident47 Ų4764.3 Ų64.329%0.28535%0.35SS..Hα-helixtrans-66.9-40.9179.5-1790000111.8H196 M197 R201 E202 A203H196-V199 PolarHBondContact O-N 3.47Å; M197-V199 VanDerWaalsContact C-N 3.26Å; M197-V199 PolarHBondContact O-N 2.86Å; V199-R201 VanDerWaalsContact C-N 3.3Å; V199-R201 PolarHBondContact O-N 2.9Å; V199-E202 PolarHBondContact O-N 3.29Å; V199-A203 PolarHBondContact O-N 3.03Å; V199-A203 VanDerWaalsContact O-N 3.07Å
200L88.9Confident85.1Confident2 Ų272.1 Ų72.11%0.0139%0.385CS..Hα-helixtrans-60.2-43.8174-90.364.4000110.9L90 H93 I97 L155 D156 A159 H196 M197 A203 A204L90-L200 HydrophobicContact CD2-CD1 4.48Å; H93-L200 HydrophobicContact CB-CD1 3.58Å; I97-L200 HydrophobicContact CD1-CD1 4.06Å; I97-L200 HydrophobicContact CD1-CD2 3.86Å; L155-L200 HydrophobicContact CG-CD2 4.4Å; D156-L200 HydrophobicContact CB-CB 4.47Å; A159-L200 HydrophobicContact CB-CD2 3.61Å; H196-L200 WeakPolarHBondContact O-CD1 3.27Å; H196-L200 PolarHBondContact O-N 3.17Å; M197-L200 PolarHBondContact O-N 3.01Å; M197-L200 HydrophobicContact SD-CD2 4.29Å; L200-A203 PolarHBondContact O-N 3.49Å; L200-A204 WeakPolarHBondContact O-CB 3.26Å; L200-A204 PolarHBondContact O-N 3.27Å
201R91.3Very high83Confident163 Ų16382.3 Ų82.362%0.61542%0.422SS*.Hα-helixtrans-65.6-41.3179.8-168.2175.5-163.1165.17112.6M197 V198 V199 A203 A204 L205M197-R201 WeakPolarHBondContact O-CB 3.4Å; M197-R201 PolarHBondContact O-N 2.91Å; V198-R201 WeakPolarHBondContact O-CB 3.28Å; V198-R201 PolarHBondContact O-N 2.91Å; V199-R201 VanDerWaalsContact C-N 3.3Å; V199-R201 PolarHBondContact O-N 2.9Å; R201-A203 VanDerWaalsContact C-N 3.31Å; R201-A203 PolarHBondContact O-N 3.39Å; R201-A204 PolarHBondContact O-N 2.91Å; R201-L205 VanDerWaalsContact O-CG 3.31Å; R201-L205 WeakPolarHBondContact O-CG 3.44Å; R201-L205 PolarHBondContact O-N 2.98Å
202E89.9Confident80.8Confident119 Ų11984 Ų8456%0.55643%0.434SS*.Hα-helixtrans-60.9-42.1174.3-75.4179.8172.100111.4V198 V199 L205 A206V198-E202 WeakPolarHBondContact O-CG 3.32Å; V198-E202 PolarHBondContact O-N 3.48Å; V199-E202 PolarHBondContact O-N 3.29Å; E202-L205 PolarHBondContact O-N 3.45Å; E202-A206 WeakPolarHBondContact O-CB 3.32Å; E202-A206 PolarHBondContact O-N 3.44Å
203A86.8Confident78.9Confident22 Ų2289.6 Ų89.618%0.18246%0.458CS..Hα-helixtrans-68.2-37.7176.100000113L90 P152 V199 L200 R201 A206 S207L90-A203 HydrophobicContact CD1-CB 3.81Å; L90-A203 HydrophobicContact CD2-CB 3.47Å; L90-A203 VanDerWaalsContact CD2-CB 3.47Å; L90-A203 HydrophobicContact CG-CB 4.2Å; P152-A203 HydrophobicContact CB-CB 4.29Å; V199-A203 PolarHBondContact O-N 3.03Å; V199-A203 VanDerWaalsContact O-N 3.07Å; L200-A203 PolarHBondContact O-N 3.49Å; R201-A203 VanDerWaalsContact C-N 3.31Å; R201-A203 PolarHBondContact O-N 3.39Å; A203-A206 PolarHBondContact O-N 3.45Å; A203-S207 WeakPolarHBondContact O-CB 3.28Å; A203-S207 PolarHBondContact O-N 3.32Å; A203-S207 PolarHBondContact O-OG 3.36Å
204A88.1Confident76.9Confident8 Ų895.9 Ų95.97%0.06650%0.498CS..Hα-helixtrans-59.5-46.7172.300000111.4I153 D156 L200 R201 S207 E208I153-A204 HydrophobicContact CG1-CB 4.28Å; D156-A204 HydrophobicContact CB-CB 3.93Å; L200-A204 WeakPolarHBondContact O-CB 3.26Å; L200-A204 PolarHBondContact O-N 3.27Å; R201-A204 PolarHBondContact O-N 2.91Å; A204-S207 PolarHBondContact O-N 3.02Å; A204-S207 PolarHBondContact O-OG 3.27Å; A204-E208 PolarHBondContact O-N 3.12Å
205L87.9Confident74.8Confident108 Ų10894.8 Ų94.857%0.56551%0.512SS*.Hα-helixtrans-63.9-40.6176.5-69.9171.6000112.6R201 E202 S207 E208R201-L205 VanDerWaalsContact O-CG 3.31Å; R201-L205 WeakPolarHBondContact O-CG 3.44Å; R201-L205 PolarHBondContact O-N 2.98Å; E202-L205 PolarHBondContact O-N 3.45Å; L205-S207 PolarHBondContact O-N 2.97Å; L205-E208 PolarHBondContact O-N 3.22Å
206A85.7Confident72.7Confident87 Ų8794.6 Ų94.672%0.71952%0.524SS*.Hα-helixtrans-68.4-23.4176.900000113.1E202 A203E202-A206 WeakPolarHBondContact O-CB 3.32Å; E202-A206 PolarHBondContact O-N 3.44Å; A203-A206 PolarHBondContact O-N 3.45Å
207S79.3Confident70.6Confident43 Ų4399.8 Ų99.830%0.30155%0.553SS.*THydrogen-bonded Turntrans-85.2-9.3178.274.30000114I153 A203 A204 L205 P209I153-S207 WeakPolarHBondContact CG1-OG 3.26Å; A203-S207 WeakPolarHBondContact O-CB 3.28Å; A203-S207 PolarHBondContact O-N 3.32Å; A203-S207 PolarHBondContact O-OG 3.36Å; A204-S207 PolarHBondContact O-N 3.02Å; A204-S207 PolarHBondContact O-OG 3.27Å; L205-S207 PolarHBondContact O-N 2.97Å; S207-P209 WeakPolarHBondContact O-CD 3.3Å; S207-P209 VanDerWaalsContact O-N 3.15Å
208E74.6Confident68.5Low130 Ų130104 Ų10461%0.60759%0.591SS**SBendtrans-61.6119.3174.5-68.7-149.3116.200108.9I153 A204 L205 E210I153-E208 HydrophobicContact CD1-CG 4.49Å; A204-E208 PolarHBondContact O-N 3.12Å; L205-E208 PolarHBondContact O-N 3.22Å; E208-E210 PolarHBondContact O-N 3.5Å; E208-E210 VanDerWaalsContact O-N 3.16Å
209P58.4Low66.3Low110 Ų110109.5 Ų109.571%0.71461%0.611SS**  trans-61.5126.3173.625.1-30.5000106.8S207 R211S207-P209 WeakPolarHBondContact O-CD 3.3Å; S207-P209 VanDerWaalsContact O-N 3.15Å; P209-R211 PolarHBondContact O-N 3.04Å
210E46.4Very low64.3Low179 Ų179118.5 Ų118.584%0.83664%0.64SS**  trans-41110.6163-109.8-177139.500106.3E208 I212E208-E210 PolarHBondContact O-N 3.5Å; E208-E210 VanDerWaalsContact O-N 3.16Å; E210-I212 PolarHBondContact O-N 3.38Å
211R47.6Very low62.3Low236 Ų236127.6 Ų127.689%0.89168%0.682SS**  trans-69.379.9177.4-159.1-176.3-162.5164.75.4105P209 L213P209-R211 PolarHBondContact O-N 3.04Å; R211-L213 VanDerWaalsContact C-N 3.33Å; R211-L213 PolarHBondContact O-N 3.39Å
212I44.9Very low60.1Low142 Ų142129.2 Ų129.273%0.72870%0.697SS**  trans-52.9105.9170.4-64.8172.9000104E210 P214E210-I212 PolarHBondContact O-N 3.38Å; I212-P214 WeakPolarHBondContact O-CD 3.3Å; I212-P214 VanDerWaalsContact O-N 3.09Å
213L47.3Very low58.2Low153 Ų153127.7 Ų127.780%0.80171%0.705SS**  trans-56.8113.4171.7-89.8113.5000107.1R211 G215R211-L213 VanDerWaalsContact C-N 3.33Å; R211-L213 PolarHBondContact O-N 3.39Å; L213-G215 VanDerWaalsContact C-N 3.32Å; L213-G215 PolarHBondContact O-N 2.99Å
214P48.5Very low56.2Low133 Ų133138 Ų13886%0.86475%0.754SS**SBendtrans-81.388.9168.530.5-21.2000106I212I212-P214 WeakPolarHBondContact O-CD 3.3Å; I212-P214 VanDerWaalsContact O-N 3.09Å
215G49.7Very low54.6Low72 Ų72144.5 Ų144.574%0.74279%0.789SS**  trans179.823.9-175.200000120L213L213-G215 VanDerWaalsContact C-N 3.32Å; L213-G215 PolarHBondContact O-N 2.99Å
216A47.1Very low52.8Low88 Ų88146.4 Ų146.473%0.72780%0.801SS**SBendtrans-128-9.7175.100000116.1
217D45.8Very low51Low159 Ų159149.7 Ų149.785%0.8581%0.805SS**SBendtrans-106.76.5-172.9-64.6-38.2000115.3
218A47.9Very low49.3Very low106 Ų106156 Ų15688%0.87684%0.835SS**SBendtrans-93.49.4-178.200000115.4
219Q46.1Very low47.8Very low193 Ų193157.6 Ų157.690%0.90285%0.849SS**SBendtrans-120.911.3-176.6-158138.2-81.900115.5
220R48Very low47.1Very low235 Ų235160.8 Ų160.889%0.88786%0.858SS**SBendtrans-108.24.1-177.8-138.1176.7168.8167.1-3.4115.8
221E46.9Very low47.1Very low193 Ų193159.5 Ų159.590%0.90286%0.86SS**SBendtrans-119.429.8-174.3-133.5171.5102.700114.3
222Q45.6Very low47.1Very low198 Ų198153.6 Ų153.693%0.92586%0.857SS**SBendtrans-125.917.7168.4-77.5-171.4-13.500113.7
223A49.4Very low47.2Very low87 Ų87154.6 Ų154.672%0.71987%0.868SS**  trans-133.966.5173.100000110.5
224I44.5Very low47.2Very low238 Ų238154.7 Ų154.7100%1.22187%0.874SS**  trans-150.60145.1-77.3120.2000107

Retrieved 224 of 224 residues in 425.2 ms (Link to these results)