A0A077Z3M5_TRITR Loading...

G-protein coupled receptors family 1 profile domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z3M5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 320 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
1M51.9Low56.1Low223 Ų223105.1 Ų105.1100%1.09960%0.6SS**  021.50-77.9167.6100.800113.5
2N55.2Low56.5Low137 Ų137102.8 Ų102.873%0.73359%0.59SS**  trans-103.9-5.6-178.7-81.95.5000115.4
3S55.7Low56.4Low86 Ų86102.1 Ų102.160%0.60158%0.582SS**Hα-helixtrans-72.3-37.9-178.751.70000113V5 Q6 D7S3-V5 VanDerWaalsContact C-N 3.34Å; S3-V5 PolarHBondContact O-N 3.35Å; S3-Q6 PolarHBondContact O-N 3.29Å; S3-D7 PolarHBondContact O-N 3.48Å; S3-D7 VanDerWaalsContact O-N 3.11Å
4S57.7Low56.6Low68 Ų68102.2 Ų102.248%0.47658%0.579SS.*Hα-helixtrans-67.9-27.7-174.855.70000114.6N8S4-N8 WeakPolarHBondContact O-CB 3.37Å; S4-N8 VanDerWaalsContact O-CG 3.31Å; S4-N8 PolarHBondContact O-N 3.18Å; S4-N8 PolarHBondContact O-ND2 3.49Å
5V54.9Low56.9Low97 Ų97102 Ų10259%0.58858%0.575SS**Hα-helixtrans-75.8-37.1177.8-179.70000110.7S3 N8 V9S3-V5 VanDerWaalsContact C-N 3.34Å; S3-V5 PolarHBondContact O-N 3.35Å; V5-N8 PolarHBondContact O-N 2.79Å; V5-V9 WeakPolarHBondContact O-CG2 3.3Å; V5-V9 PolarHBondContact O-N 2.91Å; V5-V9 VanDerWaalsContact O-N 3.16Å
6Q53.9Low57.3Low149 Ų149100.8 Ų100.870%0.69657%0.566SS**Hα-helixtrans-72.5-37179.9-136.1164.5-13.700111.4S3 V9 A10S3-Q6 PolarHBondContact O-N 3.29Å; Q6-V9 PolarHBondContact O-N 3.4Å; Q6-A10 WeakPolarHBondContact O-CB 3.36Å; Q6-A10 PolarHBondContact O-N 3.21Å
7D54.1Low57.6Low106 Ų106101.7 Ų101.757%0.56756%0.563SS**Hα-helixtrans-65.8-37.4174.2-69.9-25.3000112.2S3 A10 S11S3-D7 PolarHBondContact O-N 3.48Å; S3-D7 VanDerWaalsContact O-N 3.11Å; D7-A10 PolarHBondContact O-N 3.07Å; D7-S11 WeakPolarHBondContact O-CB 3.42Å; D7-S11 PolarHBondContact O-N 2.99Å; D7-S11 PolarHBondContact O-OG 3.24Å
8N58.8Low57.8Low103 Ų103103.4 Ų103.455%0.55157%0.566SS**Hα-helixtrans-70.4-35.8176.7-77.9-13000113.1S4 V5 S11 T12S4-N8 WeakPolarHBondContact O-CB 3.37Å; S4-N8 VanDerWaalsContact O-CG 3.31Å; S4-N8 PolarHBondContact O-N 3.18Å; S4-N8 PolarHBondContact O-ND2 3.49Å; V5-N8 PolarHBondContact O-N 2.79Å; N8-S11 WeakPolarHBondContact CA-OG 3.35Å; N8-S11 PolarHBondContact O-OG 3.31Å; N8-T12 WeakPolarHBondContact O-CB 3.27Å; N8-T12 PolarHBondContact O-N 3.01Å; N8-T12 VanDerWaalsContact O-N 3.07Å; N8-T12 PolarHBondContact O-OG1 3.13Å
9V59Low57.9Low88 Ų88104.9 Ų104.953%0.53357%0.568SS.*Hα-helixtrans-70.9-41.2174.61760000110.4V5 Q6 T12 L13V5-V9 WeakPolarHBondContact O-CG2 3.3Å; V5-V9 PolarHBondContact O-N 2.91Å; V5-V9 VanDerWaalsContact O-N 3.16Å; Q6-V9 PolarHBondContact O-N 3.4Å; V9-T12 PolarHBondContact O-N 3.01Å; V9-L13 WeakPolarHBondContact O-CB 3.35Å; V9-L13 PolarHBondContact O-N 2.97Å
10A57Low58.3Low51 Ų51104.3 Ų104.342%0.42156%0.564SS.*Hα-helixtrans-63-43.5176.500000112Q6 D7 L13 L14Q6-A10 WeakPolarHBondContact O-CB 3.36Å; Q6-A10 PolarHBondContact O-N 3.21Å; D7-A10 PolarHBondContact O-N 3.07Å; A10-L13 PolarHBondContact O-N 2.84Å; A10-L14 WeakPolarHBondContact O-CB 3.44Å; A10-L14 VanDerWaalsContact O-CG 3.25Å; A10-L14 WeakPolarHBondContact O-CG 3.48Å; A10-L14 PolarHBondContact O-N 2.69Å
11S59.4Low58.7Low48 Ų48104.6 Ų104.634%0.33656%0.564SS.*Hα-helixtrans-65.7-44.1177.464.80000112.2D7 N8 L13 L14 I15D7-S11 WeakPolarHBondContact O-CB 3.42Å; D7-S11 PolarHBondContact O-N 2.99Å; D7-S11 PolarHBondContact O-OG 3.24Å; N8-S11 WeakPolarHBondContact CA-OG 3.35Å; N8-S11 PolarHBondContact O-OG 3.31Å; S11-L13 VanDerWaalsContact C-N 3.31Å; S11-L13 PolarHBondContact O-N 2.96Å; S11-L14 PolarHBondContact O-N 3.44Å; S11-I15 WeakPolarHBondContact O-CD1 3.33Å; S11-I15 WeakPolarHBondContact O-CG1 3.44Å; S11-I15 PolarHBondContact O-N 3.02Å
12T60Low59.2Low78 Ų7899 Ų9948%0.47953%0.533SS..Hα-helixtrans-63.7-37.8177-47.80000111.7N8 V9 I15 N16N8-T12 WeakPolarHBondContact O-CB 3.27Å; N8-T12 PolarHBondContact O-N 3.01Å; N8-T12 VanDerWaalsContact O-N 3.07Å; N8-T12 PolarHBondContact O-OG1 3.13Å; V9-T12 PolarHBondContact O-N 3.01Å; T12-I15 PolarHBondContact O-N 3.45Å; T12-N16 WeakPolarHBondContact O-CB 3.46Å; T12-N16 PolarHBondContact O-N 3.19Å
13L56Low59.6Low93 Ų9395.5 Ų95.549%0.48752%0.52SS..Hα-helixtrans-74.1-30.7179.3-151.7143.8000112V9 A10 S11 K17V9-L13 WeakPolarHBondContact O-CB 3.35Å; V9-L13 PolarHBondContact O-N 2.97Å; A10-L13 PolarHBondContact O-N 2.84Å; S11-L13 VanDerWaalsContact C-N 3.31Å; S11-L13 PolarHBondContact O-N 2.96Å; L13-K17 HydrophobicContact CD2-CD 4.26Å; L13-K17 WeakPolarHBondContact O-CB 3.34Å; L13-K17 WeakPolarHBondContact O-CG 3.39Å; L13-K17 PolarHBondContact O-N 3.09Å; L13-K17 VanDerWaalsContact O-N 3.08Å
14L58.9Low60.4Low104 Ų10496.7 Ų96.755%0.54552%0.516SS..Hα-helixtrans-69.1-45.8169.7-75169000111.6A10 S11 N16 K17 E18A10-L14 WeakPolarHBondContact O-CB 3.44Å; A10-L14 VanDerWaalsContact O-CG 3.25Å; A10-L14 WeakPolarHBondContact O-CG 3.48Å; A10-L14 PolarHBondContact O-N 2.69Å; S11-L14 PolarHBondContact O-N 3.44Å; L14-N16 PolarHBondContact O-N 2.96Å; L14-K17 WeakPolarHBondContact O-CB 3.32Å; L14-K17 PolarHBondContact O-N 3.25Å; L14-K17 VanDerWaalsContact O-N 3.13Å; L14-E18 WeakPolarHBondContact O-CG 3.17Å; L14-E18 PolarHBondContact O-N 3.43Å
15I61.7Low60.9Low99 Ų9998.3 Ų98.351%0.50852%0.515SS..Hα-helixtrans-59.2-46.5176.2-67.7162.5000110.6S11 T12 K17 E18 E19S11-I15 WeakPolarHBondContact O-CD1 3.33Å; S11-I15 WeakPolarHBondContact O-CG1 3.44Å; S11-I15 PolarHBondContact O-N 3.02Å; T12-I15 PolarHBondContact O-N 3.45Å; I15-K17 VanDerWaalsContact C-N 3.32Å; I15-K17 PolarHBondContact O-N 3.18Å; I15-E18 PolarHBondContact O-N 3.42Å; I15-E19 WeakPolarHBondContact O-CB 3.47Å; I15-E19 PolarHBondContact O-N 2.94Å
16N62.9Low61.5Low82 Ų8294.8 Ų94.844%0.43950%0.496SS..Hα-helixtrans-62.6-37.9176.2-79.3-7.4000112.2T12 L14 I20T12-N16 WeakPolarHBondContact O-CB 3.46Å; T12-N16 PolarHBondContact O-N 3.19Å; L14-N16 PolarHBondContact O-N 2.96Å; N16-I20 WeakPolarHBondContact O-CB 3.47Å; N16-I20 VanDerWaalsContact O-CD1 3.31Å; N16-I20 WeakPolarHBondContact O-CD1 3.4Å; N16-I20 WeakPolarHBondContact O-CG1 2.96Å; N16-I20 PolarHBondContact O-N 3.32Å
17K62Low62.3Low117 Ų11792.7 Ų92.751%0.50949%0.486SS..Hα-helixtrans-66.3-43.1175.6-83179.4177.1-1800111.8L13 L14 I15 I20 I21L13-K17 HydrophobicContact CD2-CD 4.26Å; L13-K17 WeakPolarHBondContact O-CB 3.34Å; L13-K17 WeakPolarHBondContact O-CG 3.39Å; L13-K17 PolarHBondContact O-N 3.09Å; L13-K17 VanDerWaalsContact O-N 3.08Å; L14-K17 WeakPolarHBondContact O-CB 3.32Å; L14-K17 PolarHBondContact O-N 3.25Å; L14-K17 VanDerWaalsContact O-N 3.13Å; I15-K17 VanDerWaalsContact C-N 3.32Å; I15-K17 PolarHBondContact O-N 3.18Å; K17-I20 PolarHBondContact O-N 3.11Å; K17-I21 WeakPolarHBondContact O-CB 3Å; K17-I21 WeakPolarHBondContact O-CD1 3.29Å; K17-I21 WeakPolarHBondContact O-CG1 3.36Å; K17-I21 PolarHBondContact O-N 3.47Å
18E61.1Low63.4Low133 Ų13392.2 Ų92.262%0.62148%0.483SS*.Hα-helixtrans-62.5-43.2177.1-73.9-18017500111.4L14 I15 I21 F22L14-E18 WeakPolarHBondContact O-CG 3.17Å; L14-E18 PolarHBondContact O-N 3.43Å; I15-E18 PolarHBondContact O-N 3.42Å; E18-I21 PolarHBondContact O-N 3.34Å; E18-F22 VanDerWaalsContact O-CB 3.3Å; E18-F22 WeakPolarHBondContact O-CB 3.44Å; E18-F22 PolarHBondContact O-N 2.91Å
19E60.5Low64Low131 Ų13188.2 Ų88.261%0.61246%0.462SS*.Hα-helixtrans-64.6-40.2176.4-168.9177.1-17500112.3I15 F22 S23I15-E19 WeakPolarHBondContact O-CB 3.47Å; I15-E19 PolarHBondContact O-N 2.94Å; E19-F22 PolarHBondContact O-N 2.83Å; E19-S23 WeakPolarHBondContact O-CB 3.27Å; E19-S23 PolarHBondContact O-N 3.28Å; E19-S23 PolarHBondContact O-OG 3.49Å
20I66.1Low64.8Low93 Ų9385.4 Ų85.448%0.47744%0.443SS..Hα-helixtrans-65.1-44.5174.3-68.7164.2000110.9N16 K17 S23 Q24N16-I20 WeakPolarHBondContact O-CB 3.47Å; N16-I20 VanDerWaalsContact O-CD1 3.31Å; N16-I20 WeakPolarHBondContact O-CD1 3.4Å; N16-I20 WeakPolarHBondContact O-CG1 2.96Å; N16-I20 PolarHBondContact O-N 3.32Å; K17-I20 PolarHBondContact O-N 3.11Å; I20-S23 WeakPolarHBondContact CA-OG 3.26Å; I20-S23 PolarHBondContact O-N 2.98Å; I20-S23 PolarHBondContact O-OG 3.45Å; I20-Q24 WeakPolarHBondContact O-CB 3.38Å; I20-Q24 VanDerWaalsContact O-CG 3.32Å; I20-Q24 WeakPolarHBondContact O-CG 3.42Å; I20-Q24 PolarHBondContact O-N 3.2Å
21I66Low66Low110 Ų11086.4 Ų86.456%0.56444%0.444SS*.Hα-helixtrans-64.1-44.1178.4-69.4163.8000110.2K17 E18 Q24 F25K17-I21 WeakPolarHBondContact O-CB 3Å; K17-I21 WeakPolarHBondContact O-CD1 3.29Å; K17-I21 WeakPolarHBondContact O-CG1 3.36Å; K17-I21 PolarHBondContact O-N 3.47Å; E18-I21 PolarHBondContact O-N 3.34Å; I21-Q24 PolarHBondContact O-N 3.47Å; I21-F25 VanDerWaalsContact O-CB 3.3Å; I21-F25 WeakPolarHBondContact O-CB 3.45Å; I21-F25 PolarHBondContact O-N 3.46Å
22F63Low66.9Low105 Ų10588 Ų8846%0.46145%0.448SS..Hα-helixtrans-65.7-41.9179.7-170.3-97.5000111.9E18 E19 F25 A26E18-F22 VanDerWaalsContact O-CB 3.3Å; E18-F22 WeakPolarHBondContact O-CB 3.44Å; E18-F22 PolarHBondContact O-N 2.91Å; E19-F22 PolarHBondContact O-N 2.83Å; F22-F25 PolarHBondContact O-N 3.38Å; F22-A26 VanDerWaalsContact O-CB 3.32Å; F22-A26 WeakPolarHBondContact O-CB 2.91Å; F22-A26 PolarHBondContact O-N 3.09Å
23S64.1Low67.8Low64 Ų6485.1 Ų85.145%0.44843%0.428SS..Hα-helixtrans-65.3-41.7176.358.70000112.4E19 I20 A26 Q27E19-S23 WeakPolarHBondContact O-CB 3.27Å; E19-S23 PolarHBondContact O-N 3.28Å; E19-S23 PolarHBondContact O-OG 3.49Å; I20-S23 WeakPolarHBondContact CA-OG 3.26Å; I20-S23 PolarHBondContact O-N 2.98Å; I20-S23 PolarHBondContact O-OG 3.45Å; S23-A26 PolarHBondContact O-N 3.47Å; S23-Q27 WeakPolarHBondContact O-CB 3.31Å; S23-Q27 PolarHBondContact O-N 3.39Å
24Q70.9Confident69.1Low112 Ų11281.1 Ų81.152%0.52341%0.408SS..Hα-helixtrans-63-44.2173.2-74.2-177.9-4.900111.8I20 I21 Q27 I28I20-Q24 WeakPolarHBondContact O-CB 3.38Å; I20-Q24 VanDerWaalsContact O-CG 3.32Å; I20-Q24 WeakPolarHBondContact O-CG 3.42Å; I20-Q24 PolarHBondContact O-N 3.2Å; I21-Q24 PolarHBondContact O-N 3.47Å; Q24-Q27 PolarHBondContact O-N 2.84Å; Q24-I28 VanDerWaalsContact O-CG1 3.28Å; Q24-I28 WeakPolarHBondContact O-CG1 3.33Å; Q24-I28 PolarHBondContact O-N 3.48Å
25F69.1Low70.4Confident101 Ų10180 Ų8044%0.44341%0.406SS..Hα-helixtrans-61.9-45176.6-179.9-102.1000111.9I21 F22 Q27 I28 C29I21-F25 VanDerWaalsContact O-CB 3.3Å; I21-F25 WeakPolarHBondContact O-CB 3.45Å; I21-F25 PolarHBondContact O-N 3.46Å; F22-F25 PolarHBondContact O-N 3.38Å; F25-Q27 VanDerWaalsContact C-N 3.32Å; F25-Q27 PolarHBondContact O-N 2.71Å; F25-I28 PolarHBondContact O-N 3.42Å; F25-C29 WeakPolarHBondContact O-CB 3.36Å; F25-C29 PolarHBondContact O-N 2.9Å; F25-C29 PolarHBondContact O-SG 3.44Å; F25-C29 VanDerWaalsContact O-SG 3.37Å
26A67Low71.4Confident23 Ų2377.2 Ų77.219%0.1939%0.394CS..Hα-helixtrans-60.4-42.4175.700000111.6F22 S23 C29 H30F22-A26 VanDerWaalsContact O-CB 3.32Å; F22-A26 WeakPolarHBondContact O-CB 2.91Å; F22-A26 PolarHBondContact O-N 3.09Å; S23-A26 PolarHBondContact O-N 3.47Å; A26-C29 WeakPolarHBondContact O-CB 2.97Å; A26-C29 PolarHBondContact O-N 2.99Å; A26-H30 PolarHBondContact O-CD2 2.99Å; A26-H30 PolarHBondContact O-N 2.84Å
27Q71.5Confident72.4Confident106 Ų10673.3 Ų73.350%0.49537%0.373SS..Hα-helixtrans-63-46.3176.4-168.6178.91300111.7S23 Q24 F25 C29 H30 V31S23-Q27 WeakPolarHBondContact O-CB 3.31Å; S23-Q27 PolarHBondContact O-N 3.39Å; Q24-Q27 PolarHBondContact O-N 2.84Å; F25-Q27 VanDerWaalsContact C-N 3.32Å; F25-Q27 PolarHBondContact O-N 2.71Å; Q27-C29 VanDerWaalsContact C-N 3.31Å; Q27-C29 PolarHBondContact O-N 3.48Å; Q27-H30 WeakPolarHBondContact O-CB 3.26Å; Q27-H30 PolarHBondContact O-N 2.71Å; Q27-H30 VanDerWaalsContact O-N 3.14Å; Q27-V31 WeakPolarHBondContact O-CG2 3.47Å; Q27-V31 PolarHBondContact O-N 3.44Å
28I76.5Confident73.6Confident96 Ų9672.3 Ų72.349%0.49237%0.366SS..Hα-helixtrans-57.8-45.7175-69.5165.2000110.2Q24 F25 H30 V31 I32Q24-I28 VanDerWaalsContact O-CG1 3.28Å; Q24-I28 WeakPolarHBondContact O-CG1 3.33Å; Q24-I28 PolarHBondContact O-N 3.48Å; F25-I28 PolarHBondContact O-N 3.42Å; I28-H30 VanDerWaalsContact C-N 3.31Å; I28-H30 PolarHBondContact O-N 2.71Å; I28-V31 PolarHBondContact O-N 3.38Å; I28-I32 HydrophobicContact CG2-CD1 3.71Å; I28-I32 HydrophobicContact CG2-CG1 4.34Å; I28-I32 WeakPolarHBondContact O-CG1 3.35Å; I28-I32 PolarHBondContact O-N 3.45Å
29C72.5Confident74.7Confident18 Ų1869.3 Ų69.312%0.12236%0.357CS..Hα-helixtrans-60.5-38.2177.1-77.30000112.7F25 A26 Q27 R33F25-C29 WeakPolarHBondContact O-CB 3.36Å; F25-C29 PolarHBondContact O-N 2.9Å; F25-C29 PolarHBondContact O-SG 3.44Å; F25-C29 VanDerWaalsContact O-SG 3.37Å; A26-C29 WeakPolarHBondContact O-CB 2.97Å; A26-C29 PolarHBondContact O-N 2.99Å; Q27-C29 VanDerWaalsContact C-N 3.31Å; Q27-C29 PolarHBondContact O-N 3.48Å; C29-R33 WeakPolarHBondContact O-CB 3.24Å; C29-R33 WeakPolarHBondContact O-CG 3.39Å; C29-R33 PolarHBondContact O-N 3.09Å; C29-R33 PolarHBondContact O-NE 2.97Å
30H75.3Confident75.8Confident29 Ų2963 Ų6313%0.13433%0.328CS..Hα-helixtrans-66.9-42.7174.5-79.9-62.2000112.4A26 Q27 I28 R33 A34 S83 A87A26-H30 PolarHBondContact O-CD2 2.99Å; A26-H30 PolarHBondContact O-N 2.84Å; Q27-H30 WeakPolarHBondContact O-CB 3.26Å; Q27-H30 PolarHBondContact O-N 2.71Å; Q27-H30 VanDerWaalsContact O-N 3.14Å; I28-H30 VanDerWaalsContact C-N 3.31Å; I28-H30 PolarHBondContact O-N 2.71Å; H30-R33 PolarHBondContact CE1-NH1 2.92Å; H30-R33 VanDerWaalsContact CE1-NH1 3.33Å; H30-R33 PolarHBondContact ND1-NH1 3.12Å; H30-R33 PolarHBondContact O-N 3.44Å; H30-A34 WeakPolarHBondContact O-CB 3.47Å; H30-A34 PolarHBondContact O-N 3Å; H30-S83 WeakPolarHBondContact O-CB 3.29Å; H30-A87 HydrophobicContact CB-CB 4.13Å
31V80.9Confident76.7Confident73 Ų7361.2 Ų61.244%0.44232%0.319SS..Hα-helixtrans-63.4-43.2176.9173.60000111.3Q27 I28 A34 T35 A87Q27-V31 WeakPolarHBondContact O-CG2 3.47Å; Q27-V31 PolarHBondContact O-N 3.44Å; I28-V31 PolarHBondContact O-N 3.38Å; V31-A34 PolarHBondContact O-N 2.9Å; V31-T35 WeakPolarHBondContact O-CB 3.45Å; V31-T35 PolarHBondContact O-N 3.42Å; V31-T35 PolarHBondContact O-OG1 3.46Å; V31-A87 HydrophobicContact CG2-CB 4.28Å
32I79.1Confident77.7Confident80 Ų8061.8 Ų61.841%0.4132%0.322SS..Hα-helixtrans-61.8-49.4175.6-67.6169.5000110I28 A34 T35 V36 L278I28-I32 HydrophobicContact CG2-CD1 3.71Å; I28-I32 HydrophobicContact CG2-CG1 4.34Å; I28-I32 WeakPolarHBondContact O-CG1 3.35Å; I28-I32 PolarHBondContact O-N 3.45Å; I32-A34 VanDerWaalsContact C-N 3.3Å; I32-A34 PolarHBondContact O-N 2.82Å; I32-T35 PolarHBondContact O-N 2.81Å; I32-V36 HydrophobicContact CG2-CG2 4.12Å; I32-V36 VanDerWaalsContact O-CG2 3.27Å; I32-V36 WeakPolarHBondContact O-CG2 3.48Å; I32-V36 PolarHBondContact O-N 3.29Å; I32-L278 HydrophobicContact CG2-CD2 4.22Å
33R79.6Confident78.6Confident19 Ų1958.1 Ų58.17%0.07231%0.309CS..Hα-helixtrans-56.6-43.8177.4-82.9-179-91.8150.4-7.5112.3C29 H30 G37 L278C29-R33 WeakPolarHBondContact O-CB 3.24Å; C29-R33 WeakPolarHBondContact O-CG 3.39Å; C29-R33 PolarHBondContact O-N 3.09Å; C29-R33 PolarHBondContact O-NE 2.97Å; H30-R33 PolarHBondContact CE1-NH1 2.92Å; H30-R33 VanDerWaalsContact CE1-NH1 3.33Å; H30-R33 PolarHBondContact ND1-NH1 3.12Å; H30-R33 PolarHBondContact O-N 3.44Å; R33-G37 PolarHBondContact O-N 2.91Å; R33-L278 HydrophobicContact CG-CD2 3.45Å; R33-L278 VanDerWaalsContact CG-CD2 3.45Å; R33-L278 HydrophobicContact CG-CG 4.29Å
34A82.3Confident79.6Confident8 Ų855.6 Ų55.67%0.06629%0.291CS..Hα-helixtrans-60.6-52.617600000111.5H30 V31 I32 V36 G37 Y38 T84H30-A34 WeakPolarHBondContact O-CB 3.47Å; H30-A34 PolarHBondContact O-N 3Å; V31-A34 PolarHBondContact O-N 2.9Å; I32-A34 VanDerWaalsContact C-N 3.3Å; I32-A34 PolarHBondContact O-N 2.82Å; A34-V36 PolarHBondContact O-N 3.03Å; A34-G37 PolarHBondContact O-N 3Å; A34-Y38 HydrophobicContact CB-CD2 4.42Å; A34-Y38 HydrophobicContact CB-CE2 4.16Å; A34-Y38 WeakPolarHBondContact O-CD2 3.29Å; A34-Y38 PolarHBondContact O-N 3.48Å; A34-T84 WeakPolarHBondContact CB-OG1 3.5Å
35T85.5Confident80.4Confident82 Ų8256 Ų5650%0.50329%0.291SS..Hα-helixtrans-60.1-48.1-177.1-53.70000112V31 I32 G37 T39V31-T35 WeakPolarHBondContact O-CB 3.45Å; V31-T35 PolarHBondContact O-N 3.42Å; V31-T35 PolarHBondContact O-OG1 3.46Å; I32-T35 PolarHBondContact O-N 2.81Å; T35-G37 VanDerWaalsContact C-N 3.34Å; T35-G37 PolarHBondContact O-N 3.32Å; T35-T39 PolarHBondContact O-N 3Å; T35-T39 PolarHBondContact O-OG1 3.14Å
36V83.6Confident81.2Confident40 Ų4057.4 Ų57.424%0.24229%0.294CS..Hα-helixtrans-66.4-38.7179.6-176.40000110.4I32 A34 T39 A40 V281 V285I32-V36 HydrophobicContact CG2-CG2 4.12Å; I32-V36 VanDerWaalsContact O-CG2 3.27Å; I32-V36 WeakPolarHBondContact O-CG2 3.48Å; I32-V36 PolarHBondContact O-N 3.29Å; A34-V36 PolarHBondContact O-N 3.03Å; V36-T39 WeakPolarHBondContact O-CB 3.32Å; V36-T39 PolarHBondContact O-N 3.34Å; V36-A40 PolarHBondContact O-N 3.49Å; V36-V281 HydrophobicContact CB-CG1 3.65Å; V36-V281 HydrophobicContact CG1-CB 4.28Å; V36-V281 HydrophobicContact CG1-CG1 3.54Å; V36-V285 HydrophobicContact CG1-CG2 3.58Å; V36-V285 WeakPolarHBondContact O-CG2 3.41Å
37G84Confident81.9Confident0 Ų056.3 Ų56.30%029%0.286CS..Hα-helixtrans-70.5-37.3179.600000113.8R33 A34 T35 T39 A40 L41 V281R33-G37 PolarHBondContact O-N 2.91Å; A34-G37 PolarHBondContact O-N 3Å; T35-G37 VanDerWaalsContact C-N 3.34Å; T35-G37 PolarHBondContact O-N 3.32Å; G37-T39 VanDerWaalsContact C-N 3.33Å; G37-A40 WeakPolarHBondContact O-CB 3.21Å; G37-A40 PolarHBondContact O-N 3.3Å; G37-L41 PolarHBondContact O-N 3.43Å; G37-L41 VanDerWaalsContact O-N 3.09Å; G37-V281 VanDerWaalsContact CA-CG1 3.44Å
38Y86.4Confident82.6Confident96 Ų9653.6 Ų53.638%0.37627%0.274SS..Hα-helixtrans-67.2-34.1170.7-69.4-55.8000112.3A34 A40 L41 I42 A80 T84A34-Y38 HydrophobicContact CB-CD2 4.42Å; A34-Y38 HydrophobicContact CB-CE2 4.16Å; A34-Y38 WeakPolarHBondContact O-CD2 3.29Å; A34-Y38 PolarHBondContact O-N 3.48Å; Y38-A40 VanDerWaalsContact C-N 3.34Å; Y38-L41 VanDerWaalsContact O-CB 3.28Å; Y38-L41 WeakPolarHBondContact O-CB 3.3Å; Y38-L41 PolarHBondContact O-N 3.11Å; Y38-I42 PolarHBondContact O-N 3.37Å; Y38-A80 HydrophobicContact CD2-CB 4.42Å; Y38-A80 HydrophobicContact CE1-CB 4.41Å; Y38-A80 HydrophobicContact CE2-CB 4.29Å; Y38-T84 WeakPolarHBondContact CE2-OG1 3.36Å; Y38-T84 PolarHBondContact OH-OG1 3.42Å
39T85.8Confident83.2Confident69 Ų6951.6 Ų51.642%0.42327%0.272SS..Hα-helixtrans-65.2-40.2172.7-54.50000111.1T35 V36 G37 L41 I42 S43T35-T39 PolarHBondContact O-N 3Å; T35-T39 PolarHBondContact O-OG1 3.14Å; V36-T39 WeakPolarHBondContact O-CB 3.32Å; V36-T39 PolarHBondContact O-N 3.34Å; G37-T39 VanDerWaalsContact C-N 3.33Å; T39-L41 VanDerWaalsContact C-N 3.3Å; T39-L41 PolarHBondContact O-N 3.27Å; T39-I42 PolarHBondContact O-N 3.46Å; T39-S43 PolarHBondContact O-N 3.24Å
40A83.1Confident83.8Confident0 Ų051.7 Ų51.70%027%0.271CS..Hα-helixtrans-61.4-37175.400000112.6V36 G37 Y38 I42 S43 T44 A76 A284 V285V36-A40 PolarHBondContact O-N 3.49Å; G37-A40 WeakPolarHBondContact O-CB 3.21Å; G37-A40 PolarHBondContact O-N 3.3Å; Y38-A40 VanDerWaalsContact C-N 3.34Å; A40-I42 PolarHBondContact O-N 3.21Å; A40-S43 PolarHBondContact O-N 3.24Å; A40-S43 PolarHBondContact O-OG 2.91Å; A40-T44 WeakPolarHBondContact O-CB 3.4Å; A40-T44 PolarHBondContact O-N 2.79Å; A40-T44 PolarHBondContact O-OG1 2.8Å; A40-A76 HydrophobicContact CB-CB 4.14Å; A40-A284 HydrophobicContact CB-CB 3.59Å; A40-V285 HydrophobicContact CB-CG2 3.77Å
41L85.2Confident84.3Confident55 Ų5551.4 Ų51.429%0.28827%0.27SS..Hα-helixtrans-55.6-50.9174.4-176.491.6000111.1G37 Y38 T39 S43 T44 F45 V77G37-L41 PolarHBondContact O-N 3.43Å; G37-L41 VanDerWaalsContact O-N 3.09Å; Y38-L41 VanDerWaalsContact O-CB 3.28Å; Y38-L41 WeakPolarHBondContact O-CB 3.3Å; Y38-L41 PolarHBondContact O-N 3.11Å; T39-L41 VanDerWaalsContact C-N 3.3Å; T39-L41 PolarHBondContact O-N 3.27Å; L41-S43 VanDerWaalsContact C-N 3.34Å; L41-S43 PolarHBondContact O-N 3.45Å; L41-T44 PolarHBondContact O-N 3.08Å; L41-F45 HydrophobicContact CD1-CD2 4.02Å; L41-F45 HydrophobicContact CD1-CE2 3.38Å; L41-F45 HydrophobicContact CD1-CZ 4.12Å; L41-F45 HydrophobicContact CD2-CD2 4.14Å; L41-F45 HydrophobicContact CD2-CE2 3.83Å; L41-F45 HydrophobicContact CG-CD2 3.6Å; L41-F45 HydrophobicContact CG-CE2 3.43Å; L41-F45 VanDerWaalsContact CG-CE2 3.43Å; L41-F45 WeakPolarHBondContact O-CD2 3.22Å; L41-F45 PolarHBondContact O-N 2.9Å; L41-V77 HydrophobicContact CB-CG2 3.74Å; L41-V77 HydrophobicContact CD1-CB 4.26Å; L41-V77 HydrophobicContact CD1-CG1 4.1Å; L41-V77 HydrophobicContact CD1-CG2 3.21Å; L41-V77 HydrophobicContact CG-CG2 4.05Å
42I86.1Confident84.6Confident122 Ų12252.6 Ų52.663%0.62627%0.272SS*.Hα-helixtrans-59.3-48.3-178.5-61.9170.2000110Y38 T39 A40 T44 F45 Y46Y38-I42 PolarHBondContact O-N 3.37Å; T39-I42 PolarHBondContact O-N 3.46Å; A40-I42 PolarHBondContact O-N 3.21Å; I42-T44 VanDerWaalsContact C-N 3.34Å; I42-T44 PolarHBondContact O-N 3.26Å; I42-F45 PolarHBondContact O-N 2.84Å; I42-Y46 WeakPolarHBondContact O-CB 3.26Å; I42-Y46 PolarHBondContact O-N 3.05Å
43S82.9Confident85.1Confident28 Ų2855.9 Ų55.920%0.19628%0.284CS..Hα-helixtrans-63.3-39.5179.671.50000112.8T39 A40 L41 Y47T39-S43 PolarHBondContact O-N 3.24Å; A40-S43 PolarHBondContact O-N 3.24Å; A40-S43 PolarHBondContact O-OG 2.91Å; L41-S43 VanDerWaalsContact C-N 3.34Å; L41-S43 PolarHBondContact O-N 3.45Å; S43-Y47 PolarHBondContact O-N 2.93Å; S43-Y47 VanDerWaalsContact O-N 3.11Å
44T84.9Confident85.2Confident11 Ų1156.5 Ų56.57%0.06729%0.287CS..Hα-helixtrans-66.2-46.8177.8-60.50000111.1A40 L41 I42 Y47 L48 V70A40-T44 WeakPolarHBondContact O-CB 3.4Å; A40-T44 PolarHBondContact O-N 2.79Å; A40-T44 PolarHBondContact O-OG1 2.8Å; L41-T44 PolarHBondContact O-N 3.08Å; I42-T44 VanDerWaalsContact C-N 3.34Å; I42-T44 PolarHBondContact O-N 3.26Å; T44-Y47 PolarHBondContact O-N 3.34Å; T44-L48 WeakPolarHBondContact O-CB 3.47Å; T44-L48 PolarHBondContact O-N 3.32Å; T44-V70 HydrophobicContact CG2-CG2 4.3Å
45F87.3Confident85.2Confident121 Ų12166.4 Ų66.453%0.53132%0.323SS..Hα-helixtrans-64.3-40.9177.4-82.8-53.6000112.5L41 I42 Y47 L48 A49L41-F45 HydrophobicContact CD1-CD2 4.02Å; L41-F45 HydrophobicContact CD1-CE2 3.38Å; L41-F45 HydrophobicContact CD1-CZ 4.12Å; L41-F45 HydrophobicContact CD2-CD2 4.14Å; L41-F45 HydrophobicContact CD2-CE2 3.83Å; L41-F45 HydrophobicContact CG-CD2 3.6Å; L41-F45 HydrophobicContact CG-CE2 3.43Å; L41-F45 VanDerWaalsContact CG-CE2 3.43Å; L41-F45 WeakPolarHBondContact O-CD2 3.22Å; L41-F45 PolarHBondContact O-N 2.9Å; I42-F45 PolarHBondContact O-N 2.84Å; F45-Y47 VanDerWaalsContact C-N 3.34Å; F45-Y47 PolarHBondContact O-N 3.08Å; F45-L48 PolarHBondContact O-N 2.9Å; F45-A49 VanDerWaalsContact O-CB 3.26Å; F45-A49 WeakPolarHBondContact O-CB 3.12Å; F45-A49 PolarHBondContact O-N 2.88Å
46Y85.6Confident84.9Confident129 Ų12969.8 Ų69.851%0.50633%0.333SS..Hα-helixtrans-59.2-46.7176.4-178.4-107000111.5I42 A49 L50 M292I42-Y46 WeakPolarHBondContact O-CB 3.26Å; I42-Y46 PolarHBondContact O-N 3.05Å; Y46-A49 PolarHBondContact O-N 3.27Å; Y46-L50 HydrophobicContact CD1-CD1 3.94Å; Y46-L50 HydrophobicContact CE1-CD1 3.47Å; Y46-L50 VanDerWaalsContact CE1-CD1 3.47Å; Y46-L50 HydrophobicContact CE1-CG 4.45Å; Y46-L50 HydrophobicContact CE2-CD1 4.43Å; Y46-L50 WeakPolarHBondContact O-CG 3.23Å; Y46-L50 PolarHBondContact O-N 3.07Å; Y46-M292 HydrophobicContact CD1-CE 4.2Å; Y46-M292 HydrophobicContact CD1-SD 4.42Å; Y46-M292 HydrophobicContact CE1-CE 3.72Å; Y46-M292 HydrophobicContact CE1-SD 4.3Å
47Y81.8Confident84.7Confident1 Ų168 Ų680%0.00432%0.322CS..Hα-helixtrans-64.8-43.6176.8-167.1-83.5000112.4S43 T44 F45 A49 L50 F51 V65 C66 L69 M292 F298S43-Y47 PolarHBondContact O-N 2.93Å; S43-Y47 VanDerWaalsContact O-N 3.11Å; T44-Y47 PolarHBondContact O-N 3.34Å; F45-Y47 VanDerWaalsContact C-N 3.34Å; F45-Y47 PolarHBondContact O-N 3.08Å; Y47-A49 VanDerWaalsContact C-N 3.34Å; Y47-A49 PolarHBondContact O-N 3.03Å; Y47-L50 PolarHBondContact O-N 3.06Å; Y47-F51 WeakPolarHBondContact O-CB 3.3Å; Y47-F51 PolarHBondContact O-N 3.36Å; Y47-V65 HydrophobicContact CE1-CG1 4.28Å; Y47-V65 VanDerWaalsContact OH-CG1 3.31Å; Y47-V65 WeakPolarHBondContact OH-CG1 3.38Å; Y47-C66 HydrophobicContact CE1-CB 4.16Å; Y47-L69 HydrophobicContact CD1-CD1 3.44Å; Y47-L69 VanDerWaalsContact CD1-CD1 3.44Å; Y47-L69 HydrophobicContact CD2-CD1 3.7Å; Y47-L69 HydrophobicContact CE1-CD1 3.67Å; Y47-L69 HydrophobicContact CE2-CD1 3.92Å; Y47-L69 HydrophobicContact CG-CD1 3.44Å; Y47-L69 VanDerWaalsContact CG-CD1 3.44Å; Y47-M292 HydrophobicContact CD2-CE 4.5Å; Y47-M292 HydrophobicContact CD2-CG 3.73Å; Y47-M292 HydrophobicContact CD2-SD 4.22Å; Y47-M292 HydrophobicContact CE2-CG 3.81Å; Y47-F298 HydrophobicContact CD1-CZ 4.34Å; Y47-F298 AromaticContact CD2-CE1 3.99Å; Y47-F298 HydrophobicContact CD2-CE1 3.99Å; Y47-F298 AromaticContact CD2-CZ 3.98Å; Y47-F298 HydrophobicContact CD2-CZ 3.98Å; Y47-F298 HydrophobicContact CE1-CE2 4.19Å; Y47-F298 AromaticContact CE1-CZ 3.74Å; Y47-F298 HydrophobicContact CE1-CZ 3.74Å; Y47-F298 HydrophobicContact CE2-CD1 4.23Å; Y47-F298 HydrophobicContact CE2-CD2 4.25Å; Y47-F298 AromaticContact CE2-CE1 3.63Å; Y47-F298 HydrophobicContact CE2-CE1 3.63Å; Y47-F298 AromaticContact CE2-CE2 3.69Å; Y47-F298 HydrophobicContact CE2-CE2 3.69Å; Y47-F298 HydrophobicContact CE2-CG 4.49Å; Y47-F298 AromaticContact CE2-CZ 3.31Å; Y47-F298 HydrophobicContact CE2-CZ 3.31Å; Y47-F298 HydrophobicContact CG-CZ 4.47Å; Y47-F298 AromaticContact CZ-CE2 3.37Å; Y47-F298 AromaticContact CZ-CZ 3.19Å; Y47-F298 WeakPolarHBondContact OH-CE2 3.5Å; Y47-F298 WeakPolarHBondContact OH-CZ 3.48Å
48L87.5Confident84.6Confident48 Ų4874.4 Ų74.425%0.25135%0.346SS..Hα-helixtrans-60.6-44.1177.2-179.160.3000111.1T44 F45 L50 F51 I52 C66 V70T44-L48 WeakPolarHBondContact O-CB 3.47Å; T44-L48 PolarHBondContact O-N 3.32Å; F45-L48 PolarHBondContact O-N 2.9Å; L48-L50 PolarHBondContact O-N 3.24Å; L48-F51 PolarHBondContact O-N 3.21Å; L48-I52 HydrophobicContact CD1-CD1 3.86Å; L48-I52 HydrophobicContact CD1-CG1 4.21Å; L48-I52 HydrophobicContact CG-CD1 3.82Å; L48-I52 WeakPolarHBondContact O-CB 3.37Å; L48-I52 VanDerWaalsContact O-CG1 3.26Å; L48-I52 WeakPolarHBondContact O-CG1 3.27Å; L48-I52 PolarHBondContact O-N 2.88Å; L48-C66 VanDerWaalsContact CD1-SG 3.59Å; L48-V70 HydrophobicContact CD1-CG2 4.13Å; L48-V70 HydrophobicContact CD2-CG2 4.26Å
49A87.7Confident84.4Confident54 Ų5472.2 Ų72.245%0.44634%0.343SS..Hα-helixtrans-60.7-44.4176.300000111.5F45 Y46 Y47 I52 K53F45-A49 VanDerWaalsContact O-CB 3.26Å; F45-A49 WeakPolarHBondContact O-CB 3.12Å; F45-A49 PolarHBondContact O-N 2.88Å; Y46-A49 PolarHBondContact O-N 3.27Å; Y47-A49 VanDerWaalsContact C-N 3.34Å; Y47-A49 PolarHBondContact O-N 3.03Å; A49-I52 PolarHBondContact O-N 3.23Å; A49-K53 WeakPolarHBondContact O-CB 3.24Å; A49-K53 PolarHBondContact O-N 3.14Å
50L84.8Confident84.3Confident21 Ų2172.4 Ų72.411%0.1134%0.338CS..Hα-helixtrans-62.4-45.1175.4-73.3171.8000112.2Y46 Y47 L48 I52 K53 H54 L57 M292 F298Y46-L50 HydrophobicContact CD1-CD1 3.94Å; Y46-L50 HydrophobicContact CE1-CD1 3.47Å; Y46-L50 VanDerWaalsContact CE1-CD1 3.47Å; Y46-L50 HydrophobicContact CE1-CG 4.45Å; Y46-L50 HydrophobicContact CE2-CD1 4.43Å; Y46-L50 WeakPolarHBondContact O-CG 3.23Å; Y46-L50 PolarHBondContact O-N 3.07Å; Y47-L50 PolarHBondContact O-N 3.06Å; L48-L50 PolarHBondContact O-N 3.24Å; L50-I52 PolarHBondContact O-N 3.47Å; L50-K53 PolarHBondContact O-N 2.94Å; L50-H54 PolarHBondContact O-CD2 2.99Å; L50-H54 PolarHBondContact O-N 3.27Å; L50-L57 HydrophobicContact CB-CD1 4.35Å; L50-M292 HydrophobicContact CD1-CE 3.33Å; L50-F298 HydrophobicContact CB-CE1 4.15Å; L50-F298 HydrophobicContact CD1-CE1 4.29Å
51F85.6Confident84.2Confident23 Ų2374.1 Ų74.110%0.10135%0.347CS..Hα-helixtrans-61.2-42.5177.8177.3-98000112.2Y47 L48 L57 R58 N62 W63 C66Y47-F51 WeakPolarHBondContact O-CB 3.3Å; Y47-F51 PolarHBondContact O-N 3.36Å; L48-F51 PolarHBondContact O-N 3.21Å; F51-L57 HydrophobicContact CD2-CB 4.43Å; F51-L57 WeakPolarHBondContact CE2-O 3.27Å; F51-R58 HydrophobicContact CZ-CG 4.44Å; F51-N62 HydrophobicContact CD2-CB 4.26Å; F51-N62 HydrophobicContact CE2-CB 4.06Å; F51-W63 HydrophobicContact CE2-CB 4.28Å; F51-W63 HydrophobicContact CZ-CB 3.91Å; F51-W63 HydrophobicContact CZ-CG 4.41Å; F51-C66 HydrophobicContact CD1-CB 4.33Å; F51-C66 HydrophobicContact CD2-CB 4.31Å; F51-C66 HydrophobicContact CG-CB 4.2Å
52I87.9Confident84.1Confident97 Ų9771.5 Ų71.550%0.49733%0.333SS..Hα-helixtrans-68.7-47.1177-67.1169.2000110.2L48 A49 L50 H54 R58L48-I52 HydrophobicContact CD1-CD1 3.86Å; L48-I52 HydrophobicContact CD1-CG1 4.21Å; L48-I52 HydrophobicContact CG-CD1 3.82Å; L48-I52 WeakPolarHBondContact O-CB 3.37Å; L48-I52 VanDerWaalsContact O-CG1 3.26Å; L48-I52 WeakPolarHBondContact O-CG1 3.27Å; L48-I52 PolarHBondContact O-N 2.88Å; A49-I52 PolarHBondContact O-N 3.23Å; L50-I52 PolarHBondContact O-N 3.47Å; I52-H54 PolarHBondContact O-N 2.78Å; I52-R58 PolarHBondContact O-NE 3.43Å; I52-R58 PolarHBondContact O-NH2 3.09Å
53K89Confident84.2Confident150 Ų15067.2 Ų67.265%0.65231%0.309SS*.Hα-helixtrans-65.3-39.7-175.2-172.4179.2-178.6-174.30112.7A49 L50A49-K53 WeakPolarHBondContact O-CB 3.24Å; A49-K53 PolarHBondContact O-N 3.14Å; L50-K53 PolarHBondContact O-N 2.94Å
54H82.6Confident84.3Confident31 Ų3165.9 Ų65.914%0.14430%0.3CS..  trans-103.5110-171.7-68-76.3000113.1L50 I52 Q56 L57 L301 Y305L50-H54 PolarHBondContact O-CD2 2.99Å; L50-H54 PolarHBondContact O-N 3.27Å; I52-H54 PolarHBondContact O-N 2.78Å; H54-Q56 PolarHBondContact O-N 3.25Å; H54-L57 HydrophobicContact CB-CB 4.38Å; H54-L57 HydrophobicContact CB-CD1 3.93Å; H54-L57 HydrophobicContact CB-CG 3.93Å; H54-L57 WeakPolarHBondContact O-CB 3.35Å; H54-L57 PolarHBondContact O-N 2.91Å; H54-L301 HydrophobicContact CB-CD2 4.41Å; H54-Y305 AromaticContact CE1-CE2 3.72Å; H54-Y305 AromaticContact CE1-CZ 3.73Å; H54-Y305 PolarHBondContact CE1-OH 3.49Å; H54-Y305 AromaticContact NE2-CE2 3.59Å; H54-Y305 AromaticContact NE2-CZ 3.66Å; H54-Y305 PolarHBondContact NE2-OH 2.99Å
55R82.2Confident84.3Confident216 Ų21665.5 Ų65.582%0.81530%0.297SS*.G310 helixtrans-55.6-35.9177-172.2177.6177.8176.9-0.5113.2L57 R58R55-L57 PolarHBondContact O-N 2.91Å; R55-R58 WeakPolarHBondContact O-CB 3.3Å; R55-R58 PolarHBondContact O-N 2.7Å; R55-R58 VanDerWaalsContact O-N 3.09Å
56Q80Confident84.3Confident154 Ų15460 Ų6072%0.7227%0.274SS*.G310 helixtrans-61.5-27.1178.3-65.5177.6-600112.9H54 R58H54-Q56 PolarHBondContact O-N 3.25Å; Q56-R58 VanDerWaalsContact C-N 3.34Å
57L78.9Confident84.4Confident2 Ų255 Ų551%0.0126%0.256CS..G310 helixtrans-82.4-10.7178.5-64.1-178.8000112.9L50 F51 H54 R55 T59 N62 D297 F298 L301L50-L57 HydrophobicContact CB-CD1 4.35Å; F51-L57 HydrophobicContact CD2-CB 4.43Å; F51-L57 WeakPolarHBondContact CE2-O 3.27Å; H54-L57 HydrophobicContact CB-CB 4.38Å; H54-L57 HydrophobicContact CB-CD1 3.93Å; H54-L57 HydrophobicContact CB-CG 3.93Å; H54-L57 WeakPolarHBondContact O-CB 3.35Å; H54-L57 PolarHBondContact O-N 2.91Å; R55-L57 PolarHBondContact O-N 2.91Å; L57-T59 PolarHBondContact O-N 3.4Å; L57-N62 WeakPolarHBondContact O-CB 3.41Å; L57-N62 PolarHBondContact O-ND2 3.5Å; L57-D297 HydrophobicContact CD2-CB 3.81Å; L57-F298 HydrophobicContact CD1-CD1 4.02Å; L57-F298 HydrophobicContact CD1-CE1 3.47Å; L57-F298 VanDerWaalsContact CD1-CE1 3.47Å; L57-F298 HydrophobicContact CD1-CE2 4.02Å; L57-F298 HydrophobicContact CD1-CZ 3.47Å; L57-F298 VanDerWaalsContact CD1-CZ 3.47Å; L57-F298 HydrophobicContact CD2-CD1 4.37Å; L57-F298 HydrophobicContact CD2-CD2 3.79Å; L57-F298 HydrophobicContact CD2-CE1 4.4Å; L57-F298 HydrophobicContact CD2-CE2 3.79Å; L57-F298 HydrophobicContact CD2-CG 4.09Å; L57-F298 HydrophobicContact CD2-CZ 4.13Å; L57-F298 HydrophobicContact CG-CE2 4.36Å; L57-F298 HydrophobicContact CG-CZ 4.28Å; L57-L301 HydrophobicContact CD1-CD2 3.86Å; L57-L301 HydrophobicContact CG-CD2 4.42Å
58R82.4Confident84.7Confident134 Ų13455.2 Ų55.251%0.50626%0.257SS..  trans-79.249.2-175.1-58.6-177.2-172.9175.20.9113.2F51 I52 R55 Q56F51-R58 HydrophobicContact CZ-CG 4.44Å; I52-R58 PolarHBondContact O-NE 3.43Å; I52-R58 PolarHBondContact O-NH2 3.09Å; R55-R58 WeakPolarHBondContact O-CB 3.3Å; R55-R58 PolarHBondContact O-N 2.7Å; R55-R58 VanDerWaalsContact O-N 3.09Å; Q56-R58 VanDerWaalsContact C-N 3.34Å
59T82Confident84.7Confident51 Ų5153 Ų5331%0.31325%0.246SC..  trans-88.3159.5174.371.80000110.8L57 L61 N62 W63L57-T59 PolarHBondContact O-N 3.4Å; T59-L61 PolarHBondContact O-N 3.36Å; T59-N62 PolarHBondContact O-N 3.29Å; T59-N62 WeakPolarHBondContact OG1-CB 3.47Å; T59-N62 PolarHBondContact OG1-N 2.66Å; T59-N62 PolarHBondContact OG1-ND2 2.65Å; T59-N62 VanDerWaalsContact OG1-ND2 3.08Å; T59-W63 WeakPolarHBondContact O-CB 3.09Å; T59-W63 PolarHBondContact O-N 2.95Å
60K84.1Confident84.7Confident73 Ų7352.2 Ų52.232%0.31724%0.235SC..Hα-helixtrans-55.9-40.1178-58.7177.2-169.7179.40112.1A64 T123 E135 L138 L143K60-A64 PolarHBondContact O-N 2.9Å; K60-T123 HydrophobicContact CB-CG2 4.14Å; K60-E135 PolarHBondContact NZ-O 3.19Å; K60-L138 VanDerWaalsContact CD-O 3.29Å; K60-L138 WeakPolarHBondContact CD-O 3.43Å; K60-L138 WeakPolarHBondContact CE-O 3.44Å; K60-L138 PolarHBondContact NZ-O 3.46Å; K60-L143 HydrophobicContact CB-CD1 4.14Å; K60-L143 HydrophobicContact CG-CD1 4.46Å
61L80.7Confident84.9Confident35 Ų3551.7 Ų51.718%0.18323%0.233CC..Hα-helixtrans-67.8-49.8178.8175.466.7000111.8T59 W63 A64 V65 R124T59-L61 PolarHBondContact O-N 3.36Å; L61-W63 PolarHBondContact O-N 2.93Å; L61-A64 WeakPolarHBondContact O-CB 3.41Å; L61-A64 PolarHBondContact O-N 3.44Å; L61-A64 VanDerWaalsContact O-N 3.09Å; L61-V65 WeakPolarHBondContact O-CG2 3.45Å; L61-V65 PolarHBondContact O-N 2.88Å; L61-R124 HydrophobicContact CD1-CG 4.33Å
62N83.3Confident84.9Confident0 Ų050.6 Ų50.60%023%0.229CC..Hα-helixtrans-66.1-31.6-179.6-67.1-18.6000111F51 L57 T59 V65 C66 D297F51-N62 HydrophobicContact CD2-CB 4.26Å; F51-N62 HydrophobicContact CE2-CB 4.06Å; L57-N62 WeakPolarHBondContact O-CB 3.41Å; L57-N62 PolarHBondContact O-ND2 3.5Å; T59-N62 PolarHBondContact O-N 3.29Å; T59-N62 WeakPolarHBondContact OG1-CB 3.47Å; T59-N62 PolarHBondContact OG1-N 2.66Å; T59-N62 PolarHBondContact OG1-ND2 2.65Å; T59-N62 VanDerWaalsContact OG1-ND2 3.08Å; N62-V65 PolarHBondContact O-N 2.92Å; N62-C66 VanDerWaalsContact O-CB 3.24Å; N62-C66 WeakPolarHBondContact O-CB 3.33Å; N62-C66 PolarHBondContact O-N 2.71Å; N62-D297 PolarHBondContact ND2-OD2 3.49Å
63W87.5Confident84.9Confident33 Ų3346.1 Ų46.113%0.12521%0.206CC..Hα-helixtrans-62.8-44.9169.5178.888.1000111.8F51 T59 L61 V65 C66 N67 L140 L143 I144 R147F51-W63 HydrophobicContact CE2-CB 4.28Å; F51-W63 HydrophobicContact CZ-CB 3.91Å; F51-W63 HydrophobicContact CZ-CG 4.41Å; T59-W63 WeakPolarHBondContact O-CB 3.09Å; T59-W63 PolarHBondContact O-N 2.95Å; L61-W63 PolarHBondContact O-N 2.93Å; W63-V65 VanDerWaalsContact C-N 3.32Å; W63-V65 PolarHBondContact O-N 3.43Å; W63-C66 PolarHBondContact O-N 2.9Å; W63-N67 WeakPolarHBondContact O-CB 3.43Å; W63-N67 PolarHBondContact O-N 2.84Å; W63-L140 HydrophobicContact CB-CD1 3.62Å; W63-L140 HydrophobicContact CD2-CD1 3.87Å; W63-L140 HydrophobicContact CE3-CD1 4.46Å; W63-L140 HydrophobicContact CG-CD1 3.45Å; W63-L140 VanDerWaalsContact CG-CD1 3.45Å; W63-L143 HydrophobicContact CE3-CB 4.12Å; W63-L143 HydrophobicContact CE3-CD1 4.27Å; W63-L143 HydrophobicContact CH2-CB 3.96Å; W63-L143 WeakPolarHBondContact CH2-O 3.33Å; W63-L143 HydrophobicContact CZ3-CB 3.66Å; W63-L143 HydrophobicContact CZ3-CD1 4.38Å; W63-L143 HydrophobicContact CZ3-CG 4.42Å; W63-I144 HydrophobicContact CZ2-CB 4.36Å; W63-I144 HydrophobicContact CZ2-CG1 3.65Å; W63-R147 HydrophobicContact CH2-CB 3.92Å; W63-R147 HydrophobicContact CH2-CG 4.42Å; W63-R147 HydrophobicContact CZ2-CB 4.34Å
64A85Confident84.9Confident0 Ų043.4 Ų43.40%020%0.198CC..Hα-helixtrans-63.5-38.4176.900000112.1K60 L61 L68 M120K60-A64 PolarHBondContact O-N 2.9Å; L61-A64 WeakPolarHBondContact O-CB 3.41Å; L61-A64 PolarHBondContact O-N 3.44Å; L61-A64 VanDerWaalsContact O-N 3.09Å; A64-L68 PolarHBondContact O-N 3.4Å; A64-M120 HydrophobicContact CB-CB 4.05Å; A64-M120 HydrophobicContact CB-CG 4.23Å
65V83.8Confident85.1Confident2 Ų242.3 Ų42.31%0.01219%0.193CC..Hα-helixtrans-64.7-47.2172.61770000110.7Y47 L61 N62 W63 N67 L68 L69 M120 F291Y47-V65 HydrophobicContact CE1-CG1 4.28Å; Y47-V65 VanDerWaalsContact OH-CG1 3.31Å; Y47-V65 WeakPolarHBondContact OH-CG1 3.38Å; L61-V65 WeakPolarHBondContact O-CG2 3.45Å; L61-V65 PolarHBondContact O-N 2.88Å; N62-V65 PolarHBondContact O-N 2.92Å; W63-V65 VanDerWaalsContact C-N 3.32Å; W63-V65 PolarHBondContact O-N 3.43Å; V65-N67 VanDerWaalsContact C-N 3.32Å; V65-N67 PolarHBondContact O-N 3.38Å; V65-L68 WeakPolarHBondContact O-CB 3.47Å; V65-L68 PolarHBondContact O-N 3.44Å; V65-L68 VanDerWaalsContact O-N 3.17Å; V65-L69 HydrophobicContact CG1-CD1 4.11Å; V65-L69 HydrophobicContact CG1-CG 4.3Å; V65-L69 WeakPolarHBondContact O-CG 3.42Å; V65-L69 PolarHBondContact O-N 3.25Å; V65-M120 VanDerWaalsContact CA-CE 3.48Å; V65-M120 HydrophobicContact CB-CE 4.08Å; V65-M120 HydrophobicContact CG2-CE 3.59Å; V65-M120 HydrophobicContact CG2-SD 4.23Å; V65-F291 HydrophobicContact CG1-CB 3.93Å; V65-F291 HydrophobicContact CG1-CD1 3.83Å; V65-F291 HydrophobicContact CG1-CD2 3.72Å; V65-F291 HydrophobicContact CG1-CE1 4.25Å; V65-F291 HydrophobicContact CG1-CE2 4.12Å; V65-F291 HydrophobicContact CG1-CG 3.56Å; V65-F291 HydrophobicContact CG1-CZ 4.39Å; V65-F291 HydrophobicContact CG2-CD1 3.91Å; V65-F291 HydrophobicContact CG2-CE1 3.79Å; V65-F291 HydrophobicContact CG2-CG 4.48Å; V65-F291 HydrophobicContact CG2-CZ 4.25Å
66C87.2Confident85.3Confident7 Ų732 Ų325%0.04716%0.155CC..Hα-helixtrans-59.3-43.5177.1-168.70000111.5Y47 L48 F51 N62 W63 L68 L69 V70Y47-C66 HydrophobicContact CE1-CB 4.16Å; L48-C66 VanDerWaalsContact CD1-SG 3.59Å; F51-C66 HydrophobicContact CD1-CB 4.33Å; F51-C66 HydrophobicContact CD2-CB 4.31Å; F51-C66 HydrophobicContact CG-CB 4.2Å; N62-C66 VanDerWaalsContact O-CB 3.24Å; N62-C66 WeakPolarHBondContact O-CB 3.33Å; N62-C66 PolarHBondContact O-N 2.71Å; W63-C66 PolarHBondContact O-N 2.9Å; C66-L68 VanDerWaalsContact C-N 3.33Å; C66-L68 PolarHBondContact O-N 3.41Å; C66-L69 PolarHBondContact O-N 3.27Å; C66-V70 WeakPolarHBondContact O-CB 3.37Å; C66-V70 VanDerWaalsContact O-CG2 3.27Å; C66-V70 WeakPolarHBondContact O-CG2 3.35Å; C66-V70 PolarHBondContact O-N 3.45Å
67N89.3Confident85.7Confident23 Ų2326 Ų2612%0.12313%0.128CC..Hα-helixtrans-62.6-38.9176.9179.754.4000111.9W63 V65 S71 S116 R147W63-N67 WeakPolarHBondContact O-CB 3.43Å; W63-N67 PolarHBondContact O-N 2.84Å; V65-N67 VanDerWaalsContact C-N 3.32Å; V65-N67 PolarHBondContact O-N 3.38Å; N67-S71 VanDerWaalsContact O-CB 3.28Å; N67-S71 WeakPolarHBondContact O-CB 3.45Å; N67-S71 PolarHBondContact O-N 3.09Å; N67-S71 PolarHBondContact O-OG 3.39Å; N67-S116 PolarHBondContact ND2-OG 3.33Å; N67-R147 PolarHBondContact ND2-NE 3.24Å; N67-R147 PolarHBondContact OD1-NE 2.9Å; N67-R147 VanDerWaalsContact OD1-NE 3.11Å
68L87.3Confident86Confident5 Ų527.2 Ų27.23%0.02614%0.136CC..Hα-helixtrans-63.9-47.9172.8176.562.5000111.9A64 V65 C66 S71 N72 P113 S116 V117 M120 F258 L287 F291A64-L68 PolarHBondContact O-N 3.4Å; V65-L68 WeakPolarHBondContact O-CB 3.47Å; V65-L68 PolarHBondContact O-N 3.44Å; V65-L68 VanDerWaalsContact O-N 3.17Å; C66-L68 VanDerWaalsContact C-N 3.33Å; C66-L68 PolarHBondContact O-N 3.41Å; L68-S71 PolarHBondContact O-N 3.17Å; L68-N72 WeakPolarHBondContact CD1-ND2 3.42Å; L68-N72 WeakPolarHBondContact O-CB 3.38Å; L68-N72 PolarHBondContact O-N 3.4Å; L68-N72 PolarHBondContact O-ND2 2.93Å; L68-P113 HydrophobicContact CD1-CB 4.44Å; L68-P113 WeakPolarHBondContact CD1-O 3.39Å; L68-S116 VanDerWaalsContact CA-CB 3.47Å; L68-V117 HydrophobicContact CD1-CG2 3.64Å; L68-V117 HydrophobicContact CD2-CG2 4.12Å; L68-M120 HydrophobicContact CB-CE 4Å; L68-M120 HydrophobicContact CD2-CE 3.61Å; L68-M120 HydrophobicContact CG-CE 4.46Å; L68-F258 HydrophobicContact CD1-CZ 4.34Å; L68-L287 HydrophobicContact CD2-CD1 3.95Å; L68-L287 HydrophobicContact CG-CD1 4.18Å; L68-F291 HydrophobicContact CD2-CE2 4.16Å; L68-F291 HydrophobicContact CD2-CZ 4.49Å
69L86.5Confident86.1Confident3 Ų321.7 Ų21.72%0.01612%0.116CC..Hα-helixtrans-63.1-44.9179.8-67.5-178.7000111.5Y47 V65 C66 N72 G73 L287 P288Y47-L69 HydrophobicContact CD1-CD1 3.44Å; Y47-L69 VanDerWaalsContact CD1-CD1 3.44Å; Y47-L69 HydrophobicContact CD2-CD1 3.7Å; Y47-L69 HydrophobicContact CE1-CD1 3.67Å; Y47-L69 HydrophobicContact CE2-CD1 3.92Å; Y47-L69 HydrophobicContact CG-CD1 3.44Å; Y47-L69 VanDerWaalsContact CG-CD1 3.44Å; V65-L69 HydrophobicContact CG1-CD1 4.11Å; V65-L69 HydrophobicContact CG1-CG 4.3Å; V65-L69 WeakPolarHBondContact O-CG 3.42Å; V65-L69 PolarHBondContact O-N 3.25Å; C66-L69 PolarHBondContact O-N 3.27Å; L69-N72 PolarHBondContact O-N 3.43Å; L69-G73 WeakPolarHBondContact O-CA 3.4Å; L69-G73 PolarHBondContact O-N 3.36Å; L69-L287 HydrophobicContact CD2-CB 3.63Å; L69-P288 HydrophobicContact CD1-CB 4.28Å; L69-P288 HydrophobicContact CD1-CG 4.48Å; L69-P288 HydrophobicContact CD2-CB 4.29Å; L69-P288 HydrophobicContact CD2-CG 3.76Å
70V88.9Confident86.2Confident37 Ų3719.2 Ų19.222%0.22410%0.101CC..Hα-helixtrans-63.2-45.1176.4171.80000111.1T44 L48 C66 N72 G73 L74T44-V70 HydrophobicContact CG2-CG2 4.3Å; L48-V70 HydrophobicContact CD1-CG2 4.13Å; L48-V70 HydrophobicContact CD2-CG2 4.26Å; C66-V70 WeakPolarHBondContact O-CB 3.37Å; C66-V70 VanDerWaalsContact O-CG2 3.27Å; C66-V70 WeakPolarHBondContact O-CG2 3.35Å; C66-V70 PolarHBondContact O-N 3.45Å; V70-N72 PolarHBondContact O-N 3.32Å; V70-G73 PolarHBondContact O-N 2.82Å; V70-L74 HydrophobicContact CG1-CD1 3.83Å; V70-L74 HydrophobicContact CG1-CG 4.28Å; V70-L74 WeakPolarHBondContact O-CB 3.38Å; V70-L74 VanDerWaalsContact O-CG 3.27Å; V70-L74 WeakPolarHBondContact O-CG 3.13Å; V70-L74 PolarHBondContact O-N 3.11Å
71S88.8Confident86.3Confident9 Ų918.4 Ų18.46%0.06310%0.102CC..Hα-helixtrans-64.1-42.6179.6-57.90000112.1N67 L68 L75 S116 R147N67-S71 VanDerWaalsContact O-CB 3.28Å; N67-S71 WeakPolarHBondContact O-CB 3.45Å; N67-S71 PolarHBondContact O-N 3.09Å; N67-S71 PolarHBondContact O-OG 3.39Å; L68-S71 PolarHBondContact O-N 3.17Å; S71-L75 PolarHBondContact O-N 2.89Å; S71-S116 PolarHBondContact OG-OG 2.95Å; S71-R147 PolarHBondContact OG-NH2 2.97Å
72N86.1Confident86.4Confident1 Ų118.5 Ų18.51%0.00510%0.101CC..Hα-helixtrans-66.9-43.7174.6-84.4-36.3000112.3L68 L69 V70 L75 A76 P113 A284 L287L68-N72 WeakPolarHBondContact CD1-ND2 3.42Å; L68-N72 WeakPolarHBondContact O-CB 3.38Å; L68-N72 PolarHBondContact O-N 3.4Å; L68-N72 PolarHBondContact O-ND2 2.93Å; L69-N72 PolarHBondContact O-N 3.43Å; V70-N72 PolarHBondContact O-N 3.32Å; N72-L75 PolarHBondContact O-N 3.34Å; N72-A76 WeakPolarHBondContact O-CB 3.27Å; N72-A76 PolarHBondContact O-N 2.81Å; N72-P113 WeakPolarHBondContact OD1-CB 3.23Å; N72-P113 WeakPolarHBondContact OD1-CG 3.31Å; N72-A284 HydrophobicContact CB-CB 4.08Å; N72-L287 WeakPolarHBondContact ND2-CD1 3.41Å
73G86.5Confident86.2Confident3 Ų318.5 Ų18.53%0.03110%0.101CC..Hα-helixtrans-61.5-46.117900000111.6L69 V70 L75 A76 V77L69-G73 WeakPolarHBondContact O-CA 3.4Å; L69-G73 PolarHBondContact O-N 3.36Å; V70-G73 PolarHBondContact O-N 2.82Å; G73-L75 PolarHBondContact O-N 2.9Å; G73-A76 PolarHBondContact O-N 3.06Å; G73-V77 WeakPolarHBondContact O-CB 3.31Å; G73-V77 WeakPolarHBondContact O-CG2 3.26Å; G73-V77 PolarHBondContact O-N 2.89Å
74L89.8Confident86Confident92 Ų9218.7 Ų18.748%0.48211%0.106SC..Hα-helixtrans-60.4-45.5176.1-73.7171.6000112V70 V77 V78 L109V70-L74 HydrophobicContact CG1-CD1 3.83Å; V70-L74 HydrophobicContact CG1-CG 4.28Å; V70-L74 WeakPolarHBondContact O-CB 3.38Å; V70-L74 VanDerWaalsContact O-CG 3.27Å; V70-L74 WeakPolarHBondContact O-CG 3.13Å; V70-L74 PolarHBondContact O-N 3.11Å; L74-V77 PolarHBondContact O-N 3.39Å; L74-V78 PolarHBondContact O-N 2.81Å; L74-V78 VanDerWaalsContact O-N 3.08Å; L74-L109 HydrophobicContact CB-CD2 4.43Å
75L87.7Confident85.9Confident8 Ų821.6 Ų21.64%0.04212%0.121CC..Hα-helixtrans-60.4-48.2175.917761.9000111.6S71 N72 G73 V77 V78 I79 I106 L109 P113 P280S71-L75 PolarHBondContact O-N 2.89Å; N72-L75 PolarHBondContact O-N 3.34Å; G73-L75 PolarHBondContact O-N 2.9Å; L75-V77 VanDerWaalsContact C-N 3.25Å; L75-V77 PolarHBondContact O-N 2.99Å; L75-V78 PolarHBondContact O-N 3.14Å; L75-I79 HydrophobicContact CD1-CD1 3.94Å; L75-I79 HydrophobicContact CD1-CG1 4.31Å; L75-I79 HydrophobicContact CG-CD1 3.9Å; L75-I79 WeakPolarHBondContact O-CG1 3.28Å; L75-I79 PolarHBondContact O-N 2.91Å; L75-I106 HydrophobicContact CD1-CG2 4.44Å; L75-L109 HydrophobicContact CB-CB 4.2Å; L75-L109 HydrophobicContact CD1-CB 3.83Å; L75-P113 HydrophobicContact CD2-CG 4.04Å; L75-P280 HydrophobicContact CD2-CB 3.89Å; L75-P280 HydrophobicContact CD2-CG 4.43Å; L75-P280 HydrophobicContact CG-CB 4.48Å
76A85.7Confident85.4Confident0 Ų024.2 Ų24.20%013%0.132CC..Hα-helixtrans-60-36.5179.400000112.2A40 N72 G73 I79 A80 V281 A284A40-A76 HydrophobicContact CB-CB 4.14Å; N72-A76 WeakPolarHBondContact O-CB 3.27Å; N72-A76 PolarHBondContact O-N 2.81Å; G73-A76 PolarHBondContact O-N 3.06Å; A76-I79 PolarHBondContact O-N 2.74Å; A76-A80 VanDerWaalsContact O-CB 3.31Å; A76-A80 WeakPolarHBondContact O-CB 3.33Å; A76-A80 PolarHBondContact O-N 3.39Å; A76-V281 HydrophobicContact CB-CG1 4.36Å; A76-A284 HydrophobicContact CB-CB 3.82Å
77V87.2Confident84.8Confident27 Ų2725 Ų2516%0.16414%0.139CC..Hα-helixtrans-70.3-43178.8171.60000111.7L41 G73 L74 L75 I79 A80 V81L41-V77 HydrophobicContact CB-CG2 3.74Å; L41-V77 HydrophobicContact CD1-CB 4.26Å; L41-V77 HydrophobicContact CD1-CG1 4.1Å; L41-V77 HydrophobicContact CD1-CG2 3.21Å; L41-V77 HydrophobicContact CG-CG2 4.05Å; G73-V77 WeakPolarHBondContact O-CB 3.31Å; G73-V77 WeakPolarHBondContact O-CG2 3.26Å; G73-V77 PolarHBondContact O-N 2.89Å; L74-V77 PolarHBondContact O-N 3.39Å; L75-V77 VanDerWaalsContact C-N 3.25Å; L75-V77 PolarHBondContact O-N 2.99Å; V77-I79 VanDerWaalsContact C-N 3.32Å; V77-I79 PolarHBondContact O-N 3.25Å; V77-A80 WeakPolarHBondContact O-CB 3.3Å; V77-A80 PolarHBondContact O-N 3.15Å; V77-V81 WeakPolarHBondContact O-CG2 3.07Å; V77-V81 PolarHBondContact O-N 3.38Å
78V86.9Confident84.4Confident29 Ų2930.4 Ų30.418%0.17617%0.167CC..Hα-helixtrans-64.1-41.4175.2173.20000110.8L74 L75 A80 V81 F82 V105 I106 L109L74-V78 PolarHBondContact O-N 2.81Å; L74-V78 VanDerWaalsContact O-N 3.08Å; L75-V78 PolarHBondContact O-N 3.14Å; V78-A80 VanDerWaalsContact C-N 3.3Å; V78-A80 PolarHBondContact O-N 3.34Å; V78-V81 PolarHBondContact O-N 3.31Å; V78-F82 WeakPolarHBondContact O-CB 3.34Å; V78-F82 PolarHBondContact O-N 3.38Å; V78-V105 HydrophobicContact CB-CG1 4.49Å; V78-V105 HydrophobicContact CG1-CG1 3.83Å; V78-V105 HydrophobicContact CG2-CG1 3.98Å; V78-I106 HydrophobicContact CG1-CG1 3.73Å; V78-L109 HydrophobicContact CB-CD1 3.99Å; V78-L109 HydrophobicContact CG2-CD1 3.41Å; V78-L109 VanDerWaalsContact CG2-CD1 3.41Å
79I83.3Confident83.8Confident17 Ų1733.8 Ų33.89%0.08719%0.185CC..Hα-helixtrans-61.8-39.3173.8-67.6170000111L75 A76 V77 S83 P280 V281L75-I79 HydrophobicContact CD1-CD1 3.94Å; L75-I79 HydrophobicContact CD1-CG1 4.31Å; L75-I79 HydrophobicContact CG-CD1 3.9Å; L75-I79 WeakPolarHBondContact O-CG1 3.28Å; L75-I79 PolarHBondContact O-N 2.91Å; A76-I79 PolarHBondContact O-N 2.74Å; V77-I79 VanDerWaalsContact C-N 3.32Å; V77-I79 PolarHBondContact O-N 3.25Å; I79-S83 VanDerWaalsContact O-CB 3.28Å; I79-S83 WeakPolarHBondContact O-CB 3.29Å; I79-S83 PolarHBondContact O-N 3.12Å; I79-S83 PolarHBondContact O-OG 3.14Å; I79-P280 HydrophobicContact CD1-CB 4.4Å; I79-V281 HydrophobicContact CG2-CG2 4Å
80A84.4Confident82.9Confident0 Ų037.9 Ų37.90%021%0.211CC..Hα-helixtrans-66.4-44.917700000112.4Y38 A76 V77 V78 S83 T84Y38-A80 HydrophobicContact CD2-CB 4.42Å; Y38-A80 HydrophobicContact CE1-CB 4.41Å; Y38-A80 HydrophobicContact CE2-CB 4.29Å; A76-A80 VanDerWaalsContact O-CB 3.31Å; A76-A80 WeakPolarHBondContact O-CB 3.33Å; A76-A80 PolarHBondContact O-N 3.39Å; V77-A80 WeakPolarHBondContact O-CB 3.3Å; V77-A80 PolarHBondContact O-N 3.15Å; V78-A80 VanDerWaalsContact C-N 3.3Å; V78-A80 PolarHBondContact O-N 3.34Å; A80-S83 PolarHBondContact O-N 2.89Å; A80-T84 WeakPolarHBondContact O-CB 3.28Å; A80-T84 PolarHBondContact O-N 2.95Å; A80-T84 PolarHBondContact O-OG1 2.99Å
81V86.6Confident81.9Confident56 Ų5641.5 Ų41.534%0.33923%0.229SC..Hα-helixtrans-61.3-47.8175.61710000110.1V77 V78 S83 T84 L85V77-V81 WeakPolarHBondContact O-CG2 3.07Å; V77-V81 PolarHBondContact O-N 3.38Å; V78-V81 PolarHBondContact O-N 3.31Å; V81-S83 VanDerWaalsContact C-N 3.32Å; V81-S83 PolarHBondContact O-N 3.05Å; V81-T84 PolarHBondContact O-N 3.38Å; V81-L85 HydrophobicContact CG1-CD1 4.18Å; V81-L85 WeakPolarHBondContact O-CG 3.37Å; V81-L85 PolarHBondContact O-N 3.32Å
82F81.6Confident80.6Confident37 Ų3742 Ų4216%0.16223%0.233CC..Hα-helixtrans-57.4-45.8175.8178.8-91.8000111.8V78 T84 L85 K86 L93 F102 I106V78-F82 WeakPolarHBondContact O-CB 3.34Å; V78-F82 PolarHBondContact O-N 3.38Å; F82-T84 VanDerWaalsContact C-N 3.34Å; F82-T84 PolarHBondContact O-N 3.25Å; F82-L85 PolarHBondContact O-N 2.82Å; F82-K86 HydrophobicContact CE1-CG 4.09Å; F82-K86 HydrophobicContact CZ-CG 4.15Å; F82-K86 PolarHBondContact O-N 3.25Å; F82-L93 HydrophobicContact CD2-CD1 3.29Å; F82-L93 HydrophobicContact CE2-CD1 3.25Å; F82-L93 HydrophobicContact CG-CD1 4.38Å; F82-L93 HydrophobicContact CZ-CD1 4.3Å; F82-F102 HydrophobicContact CD2-CB 4.41Å; F82-F102 HydrophobicContact CD2-CD1 4.19Å; F82-F102 HydrophobicContact CD2-CG 4.38Å; F82-I106 HydrophobicContact CB-CD1 4.5Å; F82-I106 HydrophobicContact CD2-CD1 4.33Å; F82-I106 HydrophobicContact CG-CD1 4.31Å
83S79.8Confident79.6Confident0 Ų043.2 Ų43.20%024%0.24CC..Hα-helixtrans-67.8-34.8179.6-58.80000112.4H30 I79 A80 V81 K86 A87H30-S83 WeakPolarHBondContact O-CB 3.29Å; I79-S83 VanDerWaalsContact O-CB 3.28Å; I79-S83 WeakPolarHBondContact O-CB 3.29Å; I79-S83 PolarHBondContact O-N 3.12Å; I79-S83 PolarHBondContact O-OG 3.14Å; A80-S83 PolarHBondContact O-N 2.89Å; V81-S83 VanDerWaalsContact C-N 3.32Å; V81-S83 PolarHBondContact O-N 3.05Å; S83-K86 PolarHBondContact O-N 2.95Å; S83-A87 VanDerWaalsContact O-CB 3.23Å; S83-A87 WeakPolarHBondContact O-CB 3.38Å; S83-A87 PolarHBondContact O-N 2.93Å
84T84.3Confident78.5Confident36 Ų3646.9 Ų46.922%0.22126%0.264CS..Hα-helixtrans-66.7-45175.4-56.60000110.8A34 Y38 A80 V81 F82 K86 A87 I88A34-T84 WeakPolarHBondContact CB-OG1 3.5Å; Y38-T84 WeakPolarHBondContact CE2-OG1 3.36Å; Y38-T84 PolarHBondContact OH-OG1 3.42Å; A80-T84 WeakPolarHBondContact O-CB 3.28Å; A80-T84 PolarHBondContact O-N 2.95Å; A80-T84 PolarHBondContact O-OG1 2.99Å; V81-T84 PolarHBondContact O-N 3.38Å; F82-T84 VanDerWaalsContact C-N 3.34Å; F82-T84 PolarHBondContact O-N 3.25Å; T84-K86 PolarHBondContact O-N 2.94Å; T84-A87 PolarHBondContact O-N 3.3Å; T84-I88 HydrophobicContact CG2-CD1 3.8Å; T84-I88 HydrophobicContact CG2-CG1 4.44Å; T84-I88 VanDerWaalsContact O-CG1 3.31Å; T84-I88 WeakPolarHBondContact O-CG1 3.12Å; T84-I88 PolarHBondContact O-N 2.84Å
85L81.7Confident77.5Confident62 Ų6245.3 Ų45.333%0.32526%0.26SS..Hα-helixtrans-58.2-48.6175.6-70.2172.5000110.8V81 F82 A87 I88 N89 S92 L93 F102V81-L85 HydrophobicContact CG1-CD1 4.18Å; V81-L85 WeakPolarHBondContact O-CG 3.37Å; V81-L85 PolarHBondContact O-N 3.32Å; F82-L85 PolarHBondContact O-N 2.82Å; L85-A87 VanDerWaalsContact C-N 3.33Å; L85-A87 PolarHBondContact O-N 2.78Å; L85-I88 PolarHBondContact O-N 3.07Å; L85-N89 PolarHBondContact O-N 3.27Å; L85-S92 PolarHBondContact O-OG 3.49Å; L85-L93 HydrophobicContact CD1-CD1 4.47Å; L85-L93 HydrophobicContact CD1-CD2 4.33Å; L85-F102 HydrophobicContact CD1-CE1 4.39Å; L85-F102 HydrophobicContact CD1-CZ 3.84Å
86K74Confident76.5Confident57 Ų5748 Ų4825%0.24827%0.272CS..Hα-helixtrans-65.5-31.6177.3-78.7-71.3-179.5-173.80113.8F82 S83 T84 N89 P90 S92F82-K86 HydrophobicContact CE1-CG 4.09Å; F82-K86 HydrophobicContact CZ-CG 4.15Å; F82-K86 PolarHBondContact O-N 3.25Å; S83-K86 PolarHBondContact O-N 2.95Å; T84-K86 PolarHBondContact O-N 2.94Å; K86-N89 CarbonylContact O-C 3.57Å; K86-P90 WeakPolarHBondContact CD-O 3.3Å; K86-P90 PolarHBondContact NZ-O 3.4Å; K86-S92 VanDerWaalsContact CE-O 3.23Å; K86-S92 WeakPolarHBondContact CE-O 3.45Å; K86-S92 PolarHBondContact N-OG 3.09Å; K86-S92 PolarHBondContact NZ-O 3.14Å
87A74.3Confident76Confident23 Ų2357.7 Ų57.719%0.1931%0.308CS..Hα-helixtrans-73.8-34.8176.500000113.1H30 V31 S83 T84 L85H30-A87 HydrophobicContact CB-CB 4.13Å; V31-A87 HydrophobicContact CG2-CB 4.28Å; S83-A87 VanDerWaalsContact O-CB 3.23Å; S83-A87 WeakPolarHBondContact O-CB 3.38Å; S83-A87 PolarHBondContact O-N 2.93Å; T84-A87 PolarHBondContact O-N 3.3Å; L85-A87 VanDerWaalsContact C-N 3.33Å; L85-A87 PolarHBondContact O-N 2.78Å
88I80.5Confident75.3Confident136 Ų13658.5 Ų58.570%0.69732%0.315SS*.Hα-helixtrans-76.7-46178.5-67.4168000110.6T84 L85T84-I88 HydrophobicContact CG2-CD1 3.8Å; T84-I88 HydrophobicContact CG2-CG1 4.44Å; T84-I88 VanDerWaalsContact O-CG1 3.31Å; T84-I88 WeakPolarHBondContact O-CG1 3.12Å; T84-I88 PolarHBondContact O-N 2.84Å; L85-I88 PolarHBondContact O-N 3.07Å
89N75.2Confident74.6Confident77 Ų7757.5 Ų57.541%0.41231%0.309SS..  trans-139.4111.1178.9-176.5-8.9000108.7L85 K86 D91 S92L85-N89 PolarHBondContact O-N 3.27Å; K86-N89 CarbonylContact O-C 3.57Å; N89-D91 PolarHBondContact O-N 3.23Å; N89-D91 WeakPolarHBondContact OD1-CB 3.27Å; N89-D91 PolarHBondContact OD1-N 3.37Å; N89-S92 WeakPolarHBondContact O-CB 3.38Å; N89-S92 PolarHBondContact O-N 3.4Å; N89-S92 PolarHBondContact O-OG 2.81Å
90P68.5Low74.2Confident88 Ų8858.7 Ų58.757%0.57132%0.316SS*.THydrogen-bonded Turntrans-60.5-29.3179.224.6-32.9000112K86 S92K86-P90 WeakPolarHBondContact CD-O 3.3Å; K86-P90 PolarHBondContact NZ-O 3.4Å; P90-S92 VanDerWaalsContact C-N 3.25Å; P90-S92 PolarHBondContact O-N 3.32Å
91D68Low74Confident113 Ų11361.4 Ų61.460%0.60434%0.335SS*.THydrogen-bonded Turntrans-82.81176.2-59.1-39000113.4N89 L93 C94N89-D91 PolarHBondContact O-N 3.23Å; N89-D91 WeakPolarHBondContact OD1-CB 3.27Å; N89-D91 PolarHBondContact OD1-N 3.37Å; D91-L93 PolarHBondContact O-N 2.78Å; D91-C94 VanDerWaalsContact C-SG 3.56Å; D91-C94 WeakPolarHBondContact CA-SG 3.37Å; D91-C94 WeakPolarHBondContact O-CB 3.28Å; D91-C94 PolarHBondContact O-N 3.35Å; D91-C94 PolarHBondContact O-SG 2.87Å
92S61.5Low73.6Confident20 Ų2061.3 Ų61.314%0.1433%0.33CS..THydrogen-bonded Turntrans-60141.9167.567.50000109.5L85 K86 N89 P90 C94L85-S92 PolarHBondContact O-OG 3.49Å; K86-S92 VanDerWaalsContact CE-O 3.23Å; K86-S92 WeakPolarHBondContact CE-O 3.45Å; K86-S92 PolarHBondContact N-OG 3.09Å; K86-S92 PolarHBondContact NZ-O 3.14Å; N89-S92 WeakPolarHBondContact O-CB 3.38Å; N89-S92 PolarHBondContact O-N 3.4Å; N89-S92 PolarHBondContact O-OG 2.81Å; P90-S92 VanDerWaalsContact C-N 3.25Å; P90-S92 PolarHBondContact O-N 3.32Å; S92-C94 VanDerWaalsContact C-N 3.26Å; S92-C94 PolarHBondContact O-N 2.93Å
93L64.6Low73.4Confident27 Ų2759.7 Ų59.714%0.14132%0.323CS..THydrogen-bonded Turntrans69.115-179.2-45.7174.3000115.1F82 L85 D91 S95 F102F82-L93 HydrophobicContact CD2-CD1 3.29Å; F82-L93 HydrophobicContact CE2-CD1 3.25Å; F82-L93 HydrophobicContact CG-CD1 4.38Å; F82-L93 HydrophobicContact CZ-CD1 4.3Å; L85-L93 HydrophobicContact CD1-CD1 4.47Å; L85-L93 HydrophobicContact CD1-CD2 4.33Å; D91-L93 PolarHBondContact O-N 2.78Å; L93-S95 PolarHBondContact O-N 3.28Å; L93-F102 HydrophobicContact CD1-CD2 4.08Å; L93-F102 HydrophobicContact CD1-CE2 4.31Å; L93-F102 HydrophobicContact CD1-CG 4.27Å; L93-F102 HydrophobicContact CD2-CD2 3.42Å; L93-F102 VanDerWaalsContact CD2-CD2 3.42Å; L93-F102 HydrophobicContact CD2-CE2 3.23Å; L93-F102 HydrophobicContact CD2-CG 4.39Å; L93-F102 HydrophobicContact CD2-CZ 4.07Å; L93-F102 HydrophobicContact CG-CD2 4.36Å; L93-F102 HydrophobicContact CG-CE2 4.41Å
94C62.2Low73.7Confident80 Ų8063.4 Ų63.454%0.54134%0.337SS..  trans-64.6-18.6173-74.80000113.9D91 S92 F96D91-C94 VanDerWaalsContact C-SG 3.56Å; D91-C94 WeakPolarHBondContact CA-SG 3.37Å; D91-C94 WeakPolarHBondContact O-CB 3.28Å; D91-C94 PolarHBondContact O-N 3.35Å; D91-C94 PolarHBondContact O-SG 2.87Å; S92-C94 VanDerWaalsContact C-N 3.26Å; S92-C94 PolarHBondContact O-N 2.93Å; C94-F96 PolarHBondContact O-N 3.47Å
95S69.7Low73.8Confident58 Ų5864 Ų6441%0.40634%0.341SS..SBendtrans-69.8130.8173.1100.20000110.4L93 R97 S98 C99L93-S95 PolarHBondContact O-N 3.28Å; S95-R97 PolarHBondContact O-N 2.78Å; S95-S98 PolarHBondContact O-N 3.41Å; S95-S98 VanDerWaalsContact OG-CB 3.24Å; S95-S98 WeakPolarHBondContact OG-CB 3.39Å; S95-S98 PolarHBondContact OG-N 3.36Å; S95-S98 VanDerWaalsContact OG-N 3.09Å; S95-S98 PolarHBondContact OG-OG 2.91Å; S95-C99 PolarHBondContact O-N 3.5Å
96F67.5Low73.8Confident64 Ų6461.5 Ų61.528%0.28133%0.327SS..Hα-helixtrans-51.5-42.9178.7-179.1-105.5000112.4C94 C99 L100 A169 M179C94-F96 PolarHBondContact O-N 3.47Å; F96-C99 PolarHBondContact O-N 3.49Å; F96-L100 HydrophobicContact CE1-CD1 3.95Å; F96-L100 HydrophobicContact CZ-CD1 3.94Å; F96-L100 VanDerWaalsContact O-CB 3.32Å; F96-L100 WeakPolarHBondContact O-CB 3.42Å; F96-L100 PolarHBondContact O-N 3.18Å; F96-A169 HydrophobicContact CE2-CB 3.6Å; F96-A169 HydrophobicContact CZ-CB 4.09Å; F96-M179 HydrophobicContact CE2-CE 4.24Å
97R75Confident74.1Confident204 Ų20458.8 Ų58.877%0.7732%0.316SS*.Hα-helixtrans-65-41.8179.2-173.1177.6-178.5-178.61.3112.3S95 S101S95-R97 PolarHBondContact O-N 2.78Å; R97-S101 WeakPolarHBondContact O-CB 3.48Å; R97-S101 PolarHBondContact O-N 3.05Å; R97-S101 PolarHBondContact O-OG 2.95Å
98S71.4Confident74.8Confident45 Ų4559.6 Ų59.632%0.31532%0.315SS..Hα-helixtrans-63.9-49.2176.1-62.80000110.2S95 L100 S101 F102S95-S98 PolarHBondContact O-N 3.41Å; S95-S98 VanDerWaalsContact OG-CB 3.24Å; S95-S98 WeakPolarHBondContact OG-CB 3.39Å; S95-S98 PolarHBondContact OG-N 3.36Å; S95-S98 VanDerWaalsContact OG-N 3.09Å; S95-S98 PolarHBondContact OG-OG 2.91Å; S98-L100 PolarHBondContact O-N 2.93Å; S98-S101 PolarHBondContact O-N 3.39Å; S98-F102 VanDerWaalsContact O-CD2 3.3Å; S98-F102 WeakPolarHBondContact O-CD2 3.27Å; S98-F102 PolarHBondContact O-N 3.32Å
99C72.2Confident75.2Confident7 Ų754.6 Ų54.65%0.04729%0.289CS..Hα-helixtrans-58.3-47.7177.7-176.80000111.8S95 F96 S101 F102 T103 C174S95-C99 PolarHBondContact O-N 3.5Å; F96-C99 PolarHBondContact O-N 3.49Å; C99-S101 VanDerWaalsContact C-N 3.32Å; C99-S101 PolarHBondContact O-N 2.85Å; C99-F102 PolarHBondContact O-N 3.15Å; C99-T103 WeakPolarHBondContact O-CB 3.4Å; C99-T103 PolarHBondContact O-N 2.75Å; C99-T103 PolarHBondContact O-OG1 2.9Å; C99-C174 HydrophobicContact CB-CB 3.76Å; C99-C174 WeakPolarHBondContact SG-CB 3.35Å; C99-C174 PolarHBondContact SG-O 3.38Å
100L74.5Confident75.5Confident43 Ų4352.3 Ų52.323%0.22528%0.28CS..Hα-helixtrans-60.3-41.8179.4-167.2140.4000112.1F96 S98 W104 L162 A166 M179F96-L100 HydrophobicContact CE1-CD1 3.95Å; F96-L100 HydrophobicContact CZ-CD1 3.94Å; F96-L100 VanDerWaalsContact O-CB 3.32Å; F96-L100 WeakPolarHBondContact O-CB 3.42Å; F96-L100 PolarHBondContact O-N 3.18Å; S98-L100 PolarHBondContact O-N 2.93Å; L100-W104 WeakPolarHBondContact O-CB 2.95Å; L100-W104 PolarHBondContact O-N 3.49Å; L100-L162 HydrophobicContact CD2-CD2 4.24Å; L100-L162 HydrophobicContact CG-CD2 4.15Å; L100-L162 VanDerWaalsContact O-CD2 3.31Å; L100-L162 WeakPolarHBondContact O-CD2 3.28Å; L100-A166 HydrophobicContact CD1-CB 3.79Å; L100-M179 HydrophobicContact CB-CE 3.93Å; L100-M179 HydrophobicContact CD1-CE 3.89Å; L100-M179 HydrophobicContact CG-CE 4.02Å
101S81.2Confident76.3Confident57 Ų5748.2 Ų48.240%0.39925%0.253SS..Hα-helixtrans-65.7-45177.7-55.10000111.8R97 S98 C99 W104 V105R97-S101 WeakPolarHBondContact O-CB 3.48Å; R97-S101 PolarHBondContact O-N 3.05Å; R97-S101 PolarHBondContact O-OG 2.95Å; S98-S101 PolarHBondContact O-N 3.39Å; C99-S101 VanDerWaalsContact C-N 3.32Å; C99-S101 PolarHBondContact O-N 2.85Å; S101-W104 WeakPolarHBondContact O-CB 3.44Å; S101-W104 PolarHBondContact O-N 3.36Å; S101-V105 WeakPolarHBondContact O-CG2 3.31Å; S101-V105 PolarHBondContact O-N 3.32Å
102F78.9Confident77.1Confident54 Ų5443.1 Ų43.124%0.23723%0.227CC..Hα-helixtrans-66.5-41.3178-88.3-81.2000112.2F82 L85 L93 S98 C99 W104 V105 I106F82-F102 HydrophobicContact CD2-CB 4.41Å; F82-F102 HydrophobicContact CD2-CD1 4.19Å; F82-F102 HydrophobicContact CD2-CG 4.38Å; L85-F102 HydrophobicContact CD1-CE1 4.39Å; L85-F102 HydrophobicContact CD1-CZ 3.84Å; L93-F102 HydrophobicContact CD1-CD2 4.08Å; L93-F102 HydrophobicContact CD1-CE2 4.31Å; L93-F102 HydrophobicContact CD1-CG 4.27Å; L93-F102 HydrophobicContact CD2-CD2 3.42Å; L93-F102 VanDerWaalsContact CD2-CD2 3.42Å; L93-F102 HydrophobicContact CD2-CE2 3.23Å; L93-F102 HydrophobicContact CD2-CG 4.39Å; L93-F102 HydrophobicContact CD2-CZ 4.07Å; L93-F102 HydrophobicContact CG-CD2 4.36Å; L93-F102 HydrophobicContact CG-CE2 4.41Å; S98-F102 VanDerWaalsContact O-CD2 3.3Å; S98-F102 WeakPolarHBondContact O-CD2 3.27Å; S98-F102 PolarHBondContact O-N 3.32Å; C99-F102 PolarHBondContact O-N 3.15Å; F102-W104 VanDerWaalsContact C-N 3.27Å; F102-W104 PolarHBondContact O-N 3.03Å; F102-V105 PolarHBondContact O-N 3.34Å; F102-I106 WeakPolarHBondContact O-CG1 3.39Å; F102-I106 PolarHBondContact O-N 2.97Å
103T76.7Confident78.2Confident3 Ų342.3 Ų42.32%0.01822%0.221CC..Hα-helixtrans-60.4-39.8173.6-62.60000111.1C99 T107 L162 Y176 M179C99-T103 WeakPolarHBondContact O-CB 3.4Å; C99-T103 PolarHBondContact O-N 2.75Å; C99-T103 PolarHBondContact O-OG1 2.9Å; T103-T107 WeakPolarHBondContact O-CB 3.3Å; T103-T107 PolarHBondContact O-N 3.14Å; T103-T107 PolarHBondContact O-OG1 2.74Å; T103-L162 HydrophobicContact CG2-CD2 4.3Å; T103-Y176 HydrophobicContact CG2-CD2 3.72Å; T103-Y176 HydrophobicContact CG2-CE2 4.19Å; T103-M179 HydrophobicContact CG2-CB 3.68Å; T103-M179 HydrophobicContact CG2-CG 4.23Å; T103-M179 HydrophobicContact CG2-SD 3.59Å; T103-M179 VanDerWaalsContact CG2-SD 3.59Å
104W85.2Confident79.1Confident77 Ų7741.3 Ų41.329%0.29222%0.216SC..Hα-helixtrans-58.7-51.3175.1-169.293.4000110.4L100 S101 F102 T107 F108 A155 T158 S159 L162L100-W104 WeakPolarHBondContact O-CB 2.95Å; L100-W104 PolarHBondContact O-N 3.49Å; S101-W104 WeakPolarHBondContact O-CB 3.44Å; S101-W104 PolarHBondContact O-N 3.36Å; F102-W104 VanDerWaalsContact C-N 3.27Å; F102-W104 PolarHBondContact O-N 3.03Å; W104-T107 PolarHBondContact O-N 2.97Å; W104-F108 HydrophobicContact CE3-CB 4.28Å; W104-F108 HydrophobicContact CH2-CB 4.34Å; W104-F108 HydrophobicContact CH2-CD1 4.21Å; W104-F108 HydrophobicContact CH2-CD2 4.3Å; W104-F108 HydrophobicContact CH2-CG 4.03Å; W104-F108 HydrophobicContact CZ3-CB 4.14Å; W104-F108 HydrophobicContact CZ3-CD1 4.04Å; W104-F108 HydrophobicContact CZ3-CG 4.09Å; W104-F108 WeakPolarHBondContact O-CB 3.29Å; W104-F108 PolarHBondContact O-N 2.96Å; W104-A155 HydrophobicContact CZ2-CB 4.35Å; W104-T158 HydrophobicContact CD2-CG2 4.25Å; W104-T158 HydrophobicContact CG-CG2 4.02Å; W104-T158 WeakPolarHBondContact O-CG2 3.39Å; W104-S159 PolarHBondContact NE1-OG 3.11Å; W104-S159 VanDerWaalsContact NE1-OG 3.1Å; W104-L162 HydrophobicContact CB-CD2 3.52Å; W104-L162 HydrophobicContact CG-CD2 4.15Å
105V87.4Confident80.2Confident50 Ų5038.9 Ų38.930%0.30320%0.196SC..Hα-helixtrans-63.6-46.7-177.1178.90000111.3V78 S101 F102 F108 L109V78-V105 HydrophobicContact CB-CG1 4.49Å; V78-V105 HydrophobicContact CG1-CG1 3.83Å; V78-V105 HydrophobicContact CG2-CG1 3.98Å; S101-V105 WeakPolarHBondContact O-CG2 3.31Å; S101-V105 PolarHBondContact O-N 3.32Å; F102-V105 PolarHBondContact O-N 3.34Å; V105-F108 PolarHBondContact O-N 3.29Å; V105-L109 HydrophobicContact CG1-CD1 3.76Å; V105-L109 HydrophobicContact CG1-CG 4.29Å; V105-L109 WeakPolarHBondContact O-CB 3.46Å; V105-L109 VanDerWaalsContact O-CG 3.26Å; V105-L109 WeakPolarHBondContact O-CG 3.4Å; V105-L109 PolarHBondContact O-N 2.89Å
106I82.1Confident81.1Confident8 Ų836.1 Ų36.14%0.04118%0.177CC..Hα-helixtrans-64.1-45.6-179.9-64.7170000110.2L75 V78 F82 F102 L109 S110 Y176L75-I106 HydrophobicContact CD1-CG2 4.44Å; V78-I106 HydrophobicContact CG1-CG1 3.73Å; F82-I106 HydrophobicContact CB-CD1 4.5Å; F82-I106 HydrophobicContact CD2-CD1 4.33Å; F82-I106 HydrophobicContact CG-CD1 4.31Å; F102-I106 WeakPolarHBondContact O-CG1 3.39Å; F102-I106 PolarHBondContact O-N 2.97Å; I106-L109 PolarHBondContact O-N 3.38Å; I106-S110 VanDerWaalsContact O-CB 3.31Å; I106-S110 WeakPolarHBondContact O-CB 3.38Å; I106-S110 PolarHBondContact O-N 3.25Å; I106-Y176 HydrophobicContact CB-CD2 4.38Å; I106-Y176 HydrophobicContact CB-CE2 3.95Å; I106-Y176 HydrophobicContact CG2-CD1 4.36Å; I106-Y176 HydrophobicContact CG2-CD2 4.3Å; I106-Y176 HydrophobicContact CG2-CE1 3.79Å; I106-Y176 HydrophobicContact CG2-CE2 3.64Å
107T80.2Confident81.8Confident0 Ų035.2 Ų35.20%018%0.176CC..Hα-helixtrans-61.2-48.2178.6-54.80000110.9T103 W104 L109 S110 F111 T158 L180T103-T107 WeakPolarHBondContact O-CB 3.3Å; T103-T107 PolarHBondContact O-N 3.14Å; T103-T107 PolarHBondContact O-OG1 2.74Å; W104-T107 PolarHBondContact O-N 2.97Å; T107-L109 PolarHBondContact O-N 2.83Å; T107-S110 WeakPolarHBondContact O-CB 3.45Å; T107-S110 PolarHBondContact O-N 3.49Å; T107-S110 PolarHBondContact O-OG 2.9Å; T107-F111 HydrophobicContact CG2-CE2 3.93Å; T107-F111 HydrophobicContact CG2-CZ 4.06Å; T107-F111 WeakPolarHBondContact O-CD2 3.4Å; T107-T158 HydrophobicContact CG2-CG2 3.94Å; T107-L180 HydrophobicContact CG2-CD2 4.15Å
108F88.5Confident82.1Confident41 Ų4126.1 Ų26.118%0.1814%0.144CC..Hα-helixtrans-58-49.4177.9171.1-111.6000112W104 V105 S110 F111 I151 D154 A155 T158W104-F108 HydrophobicContact CE3-CB 4.28Å; W104-F108 HydrophobicContact CH2-CB 4.34Å; W104-F108 HydrophobicContact CH2-CD1 4.21Å; W104-F108 HydrophobicContact CH2-CD2 4.3Å; W104-F108 HydrophobicContact CH2-CG 4.03Å; W104-F108 HydrophobicContact CZ3-CB 4.14Å; W104-F108 HydrophobicContact CZ3-CD1 4.04Å; W104-F108 HydrophobicContact CZ3-CG 4.09Å; W104-F108 WeakPolarHBondContact O-CB 3.29Å; W104-F108 PolarHBondContact O-N 2.96Å; V105-F108 PolarHBondContact O-N 3.29Å; F108-S110 VanDerWaalsContact C-N 3.27Å; F108-S110 PolarHBondContact O-N 3.48Å; F108-F111 PolarHBondContact O-N 3.48Å; F108-I151 HydrophobicContact CE2-CG2 4.3Å; F108-I151 WeakPolarHBondContact CE2-O 3.33Å; F108-I151 HydrophobicContact CZ-CG2 3.84Å; F108-D154 HydrophobicContact CD2-CB 3.96Å; F108-D154 HydrophobicContact CE2-CB 3.88Å; F108-A155 HydrophobicContact CD2-CB 4.2Å; F108-A155 HydrophobicContact CE2-CB 3.76Å; F108-T158 WeakPolarHBondContact CA-OG1 3.23Å; F108-T158 HydrophobicContact CB-CG2 4Å
109L88.6Confident82.8Confident30 Ų3024.3 Ų24.316%0.15713%0.131CC..Hα-helixtrans-69.4-25.4-180-67.4178.2000112.7L74 L75 V78 V105 I106 T107 F111 G112 P113L74-L109 HydrophobicContact CB-CD2 4.43Å; L75-L109 HydrophobicContact CB-CB 4.2Å; L75-L109 HydrophobicContact CD1-CB 3.83Å; V78-L109 HydrophobicContact CB-CD1 3.99Å; V78-L109 HydrophobicContact CG2-CD1 3.41Å; V78-L109 VanDerWaalsContact CG2-CD1 3.41Å; V105-L109 HydrophobicContact CG1-CD1 3.76Å; V105-L109 HydrophobicContact CG1-CG 4.29Å; V105-L109 WeakPolarHBondContact O-CB 3.46Å; V105-L109 VanDerWaalsContact O-CG 3.26Å; V105-L109 WeakPolarHBondContact O-CG 3.4Å; V105-L109 PolarHBondContact O-N 2.89Å; I106-L109 PolarHBondContact O-N 3.38Å; T107-L109 PolarHBondContact O-N 2.83Å; L109-F111 VanDerWaalsContact C-N 3.27Å; L109-F111 PolarHBondContact O-N 2.86Å; L109-G112 PolarHBondContact O-N 3.29Å; L109-P113 WeakPolarHBondContact O-CD 3.47Å
110S82.7Confident83.4Confident30 Ų3025.2 Ų25.221%0.2114%0.135CC..Hα-helixtrans-64.3-29.7178.979.50000113.4I106 T107 F108I106-S110 VanDerWaalsContact O-CB 3.31Å; I106-S110 WeakPolarHBondContact O-CB 3.38Å; I106-S110 PolarHBondContact O-N 3.25Å; T107-S110 WeakPolarHBondContact O-CB 3.45Å; T107-S110 PolarHBondContact O-N 3.49Å; T107-S110 PolarHBondContact O-OG 2.9Å; F108-S110 VanDerWaalsContact C-N 3.27Å; F108-S110 PolarHBondContact O-N 3.48Å
111F83.9Confident83.7Confident2 Ų224 Ų241%0.00913%0.131CC..Hα-helixtrans-74-32.3177-60.7-49.2000112.3T107 F108 L109 S114 W115 D154 T158 I161 H186 Y189 I193T107-F111 HydrophobicContact CG2-CE2 3.93Å; T107-F111 HydrophobicContact CG2-CZ 4.06Å; T107-F111 WeakPolarHBondContact O-CD2 3.4Å; F108-F111 PolarHBondContact O-N 3.48Å; L109-F111 VanDerWaalsContact C-N 3.27Å; L109-F111 PolarHBondContact O-N 2.86Å; F111-S114 WeakPolarHBondContact O-CB 3.22Å; F111-S114 PolarHBondContact O-N 3.4Å; F111-W115 PolarHBondContact O-N 3.46Å; F111-W115 VanDerWaalsContact O-N 3.1Å; F111-D154 HydrophobicContact CB-CB 4.45Å; F111-D154 HydrophobicContact CD2-CB 4.39Å; F111-T158 WeakPolarHBondContact CE2-OG1 3.14Å; F111-I161 HydrophobicContact CE2-CD1 4.31Å; F111-I161 HydrophobicContact CZ-CD1 4.01Å; F111-H186 AromaticContact CE1-CE1 3.97Å; F111-H186 AromaticContact CZ-CE1 3.87Å; F111-H186 AromaticContact CZ-ND1 3.73Å; F111-Y189 HydrophobicContact CD1-CD1 4.19Å; F111-Y189 HydrophobicContact CD1-CE1 4.06Å; F111-Y189 HydrophobicContact CD2-CD1 4.49Å; F111-Y189 HydrophobicContact CD2-CE1 4.02Å; F111-Y189 AromaticContact CE1-CD1 3.73Å; F111-Y189 HydrophobicContact CE1-CD1 3.73Å; F111-Y189 HydrophobicContact CE1-CE1 4.04Å; F111-Y189 HydrophobicContact CE2-CD1 4.05Å; F111-Y189 AromaticContact CE2-CE1 3.99Å; F111-Y189 HydrophobicContact CE2-CE1 3.99Å; F111-Y189 HydrophobicContact CG-CE1 4.06Å; F111-Y189 AromaticContact CZ-CD1 3.65Å; F111-Y189 HydrophobicContact CZ-CD1 3.65Å; F111-Y189 HydrophobicContact CZ-CE1 4Å; F111-I193 HydrophobicContact CD1-CD1 3.6Å; F111-I193 HydrophobicContact CE1-CD1 4.14Å; F111-I193 HydrophobicContact CG-CD1 4.32Å
112G85.9Confident83.8Confident5 Ų523.4 Ų23.45%0.05213%0.13CC..Hα-helixtrans-52.1-52.2-174.500000115.1L109 S114 W115 S116L109-G112 PolarHBondContact O-N 3.29Å; G112-S114 VanDerWaalsContact C-N 3.26Å; G112-S114 PolarHBondContact O-N 3.32Å; G112-W115 PolarHBondContact O-N 2.85Å; G112-S116 WeakPolarHBondContact O-CB 3.36Å; G112-S116 PolarHBondContact O-N 3.3Å; G112-S116 PolarHBondContact O-OG 3.36Å
113P84.4Confident84Confident3 Ų321.4 Ų21.42%0.01912%0.122CC..Hα-helixtrans-55.1-41.4175.3-32.238.3000114L68 N72 L75 L109 S116 V117 F258L68-P113 HydrophobicContact CD1-CB 4.44Å; L68-P113 WeakPolarHBondContact CD1-O 3.39Å; N72-P113 WeakPolarHBondContact OD1-CB 3.23Å; N72-P113 WeakPolarHBondContact OD1-CG 3.31Å; L75-P113 HydrophobicContact CD2-CG 4.04Å; L109-P113 WeakPolarHBondContact O-CD 3.47Å; P113-S116 WeakPolarHBondContact O-CB 3.4Å; P113-S116 PolarHBondContact O-N 2.97Å; P113-S116 VanDerWaalsContact O-N 3.14Å; P113-V117 WeakPolarHBondContact O-CG2 3.47Å; P113-V117 PolarHBondContact O-N 2.92Å; P113-F258 HydrophobicContact CB-CE1 3.8Å; P113-F258 HydrophobicContact CB-CZ 4.46Å
114S82.5Confident84.2Confident6 Ų625.3 Ų25.34%0.04214%0.137CC..Hα-helixtrans-67.9-47.3-174-49.80000110.4F111 G112 S116 V117 A118 L197 R262F111-S114 WeakPolarHBondContact O-CB 3.22Å; F111-S114 PolarHBondContact O-N 3.4Å; G112-S114 VanDerWaalsContact C-N 3.26Å; G112-S114 PolarHBondContact O-N 3.32Å; S114-S116 VanDerWaalsContact C-N 3.27Å; S114-S116 PolarHBondContact O-N 3.31Å; S114-V117 PolarHBondContact O-N 2.87Å; S114-A118 PolarHBondContact O-N 3.29Å; S114-L197 WeakPolarHBondContact O-CD2 3.38Å; S114-R262 PolarHBondContact OG-NH2 2.97Å
115W86.3Confident83.8Confident30 Ų3022.2 Ų22.211%0.11413%0.127CC..Hα-helixtrans-62.5-34.6171.4-74.8120.5000113.1F111 G112 A118 L119 I150 D154 Y189 I193 L196F111-W115 PolarHBondContact O-N 3.46Å; F111-W115 VanDerWaalsContact O-N 3.1Å; G112-W115 PolarHBondContact O-N 2.85Å; W115-A118 HydrophobicContact CE3-CB 4.41Å; W115-A118 PolarHBondContact O-N 2.81Å; W115-L119 WeakPolarHBondContact O-CB 3.31Å; W115-L119 VanDerWaalsContact O-CG 3.31Å; W115-L119 WeakPolarHBondContact O-CG 3.48Å; W115-L119 PolarHBondContact O-N 3.28Å; W115-I150 HydrophobicContact CB-CG2 3.71Å; W115-I150 VanDerWaalsContact CD1-CG2 3.41Å; W115-I150 HydrophobicContact CD2-CD1 4.45Å; W115-I150 HydrophobicContact CD2-CG2 3.61Å; W115-I150 HydrophobicContact CE3-CD1 4.07Å; W115-I150 HydrophobicContact CE3-CG1 4.47Å; W115-I150 HydrophobicContact CE3-CG2 4.29Å; W115-I150 HydrophobicContact CG-CG2 3.31Å; W115-D154 VanDerWaalsContact CD1-OD1 3.22Å; W115-D154 VanDerWaalsContact CD1-OD2 3.26Å; W115-D154 PolarHBondContact NE1-OD1 2.83Å; W115-Y189 PolarHBondContact NE1-OH 3.42Å; W115-I193 HydrophobicContact CZ2-CG1 3.96Å; W115-L196 HydrophobicContact CH2-CD1 3.59Å; W115-L196 HydrophobicContact CZ3-CD1 3.87Å
116S87.6Confident83.5Confident0 Ų020.9 Ų20.90%012%0.119CC..Hα-helixtrans-67-38.8177.5-58.50000112.2N67 L68 S71 G112 P113 S114 M120N67-S116 PolarHBondContact ND2-OG 3.33Å; L68-S116 VanDerWaalsContact CA-CB 3.47Å; S71-S116 PolarHBondContact OG-OG 2.95Å; G112-S116 WeakPolarHBondContact O-CB 3.36Å; G112-S116 PolarHBondContact O-N 3.3Å; G112-S116 PolarHBondContact O-OG 3.36Å; P113-S116 WeakPolarHBondContact O-CB 3.4Å; P113-S116 PolarHBondContact O-N 2.97Å; P113-S116 VanDerWaalsContact O-N 3.14Å; S114-S116 VanDerWaalsContact C-N 3.27Å; S114-S116 PolarHBondContact O-N 3.31Å; S116-M120 WeakPolarHBondContact O-CB 3.03Å; S116-M120 PolarHBondContact O-N 2.91Å
117V82.7Confident83.4Confident44 Ų4424.3 Ų24.327%0.26714%0.135SC..Hα-helixtrans-64-44.8170.7175.80000110.6L68 P113 S114 L119 M120 A121 L197 F258L68-V117 HydrophobicContact CD1-CG2 3.64Å; L68-V117 HydrophobicContact CD2-CG2 4.12Å; P113-V117 WeakPolarHBondContact O-CG2 3.47Å; P113-V117 PolarHBondContact O-N 2.92Å; S114-V117 PolarHBondContact O-N 2.87Å; V117-L119 PolarHBondContact O-N 3.15Å; V117-M120 PolarHBondContact O-N 3.03Å; V117-A121 WeakPolarHBondContact O-CB 3.41Å; V117-A121 PolarHBondContact O-N 3.44Å; V117-L197 HydrophobicContact CB-CD2 3.89Å; V117-L197 HydrophobicContact CG1-CD2 3.73Å; V117-F258 HydrophobicContact CG2-CE2 4.07Å; V117-F258 HydrophobicContact CG2-CZ 4.04Å
118A82.4Confident83.2Confident13 Ų1326.4 Ų26.411%0.10714%0.143CC..Hα-helixtrans-60.4-45.817800000112S114 W115 M120 A121 A122 L197S114-A118 PolarHBondContact O-N 3.29Å; W115-A118 HydrophobicContact CE3-CB 4.41Å; W115-A118 PolarHBondContact O-N 2.81Å; A118-M120 PolarHBondContact O-N 2.91Å; A118-A121 PolarHBondContact O-N 3.49Å; A118-A122 WeakPolarHBondContact O-CB 3.37Å; A118-A122 PolarHBondContact O-N 2.99Å; A118-L197 HydrophobicContact CB-CD2 3.86Å
119L85.9Confident82.7Confident8 Ų825.9 Ų25.94%0.04214%0.144CC..Hα-helixtrans-63-40.3175.7-75.5171.4000112.1W115 V117 A122 T123 L146 R147 I150W115-L119 WeakPolarHBondContact O-CB 3.31Å; W115-L119 VanDerWaalsContact O-CG 3.31Å; W115-L119 WeakPolarHBondContact O-CG 3.48Å; W115-L119 PolarHBondContact O-N 3.28Å; V117-L119 PolarHBondContact O-N 3.15Å; L119-A122 PolarHBondContact O-N 3.32Å; L119-T123 WeakPolarHBondContact O-CB 3.37Å; L119-T123 PolarHBondContact O-N 3.23Å; L119-T123 PolarHBondContact O-OG1 3.46Å; L119-L146 HydrophobicContact CD2-CD2 3.51Å; L119-L146 HydrophobicContact CD2-CG 4.07Å; L119-R147 HydrophobicContact CD1-CB 4.28Å; L119-I150 HydrophobicContact CD1-CD1 4.04Å; L119-I150 HydrophobicContact CD2-CD1 4.08Å; L119-I150 HydrophobicContact CG-CD1 4.17Å
120M84.7Confident81.9Confident25 Ų2529.1 Ų29.112%0.12316%0.162CC..Hα-helixtrans-63.3-45.3175.2-174.7-174.6-59.100111.2A64 V65 L68 S116 V117 A118 T123 R124 F291A64-M120 HydrophobicContact CB-CB 4.05Å; A64-M120 HydrophobicContact CB-CG 4.23Å; V65-M120 VanDerWaalsContact CA-CE 3.48Å; V65-M120 HydrophobicContact CB-CE 4.08Å; V65-M120 HydrophobicContact CG2-CE 3.59Å; V65-M120 HydrophobicContact CG2-SD 4.23Å; L68-M120 HydrophobicContact CB-CE 4Å; L68-M120 HydrophobicContact CD2-CE 3.61Å; L68-M120 HydrophobicContact CG-CE 4.46Å; S116-M120 WeakPolarHBondContact O-CB 3.03Å; S116-M120 PolarHBondContact O-N 2.91Å; V117-M120 PolarHBondContact O-N 3.03Å; A118-M120 PolarHBondContact O-N 2.91Å; M120-T123 PolarHBondContact O-N 3.39Å; M120-R124 WeakPolarHBondContact O-CG 3.31Å; M120-R124 PolarHBondContact O-N 2.93Å; M120-F291 HydrophobicContact CE-CZ 3.99Å; M120-F291 HydrophobicContact SD-CE1 4.33Å; M120-F291 HydrophobicContact SD-CZ 3.99Å
121A80.6Confident81.7Confident17 Ų1730.6 Ų30.614%0.1417%0.169CC..Hα-helixtrans-62-47.8176.300000111V117 A118 T123 R124 A125 A200 V204V117-A121 WeakPolarHBondContact O-CB 3.41Å; V117-A121 PolarHBondContact O-N 3.44Å; A118-A121 PolarHBondContact O-N 3.49Å; A121-T123 VanDerWaalsContact C-N 3.35Å; A121-T123 PolarHBondContact O-N 2.97Å; A121-R124 CarbonylContact O-C 3.44Å; A121-R124 WeakPolarHBondContact O-CB 3.34Å; A121-R124 PolarHBondContact O-N 3.2Å; A121-R124 VanDerWaalsContact O-N 3.12Å; A121-A125 WeakPolarHBondContact O-CB 3.33Å; A121-A125 PolarHBondContact O-N 2.88Å; A121-A200 HydrophobicContact CB-CB 3.76Å; A121-V204 HydrophobicContact CB-CG2 4Å; A121-V204 WeakPolarHBondContact O-CG2 3.41Å
122A82.3Confident81.3Confident46 Ų4634.5 Ų34.538%0.3820%0.195SC..Hα-helixtrans-58.2-45.1175.900000112.1A118 L119 R124 A125 V126A118-A122 WeakPolarHBondContact O-CB 3.37Å; A118-A122 PolarHBondContact O-N 2.99Å; L119-A122 PolarHBondContact O-N 3.32Å; A122-R124 VanDerWaalsContact C-N 3.28Å; A122-R124 PolarHBondContact O-N 3.39Å; A122-A125 WeakPolarHBondContact O-CB 3.06Å; A122-A125 PolarHBondContact O-N 2.87Å; A122-A125 VanDerWaalsContact O-N 3.14Å; A122-V126 WeakPolarHBondContact O-CG2 3.34Å; A122-V126 PolarHBondContact O-N 3.31Å
123T83.5Confident80.8Confident11 Ų1138.5 Ų38.57%0.06722%0.219CC..Hα-helixtrans-60.2-39.6176.7-56.80000111.5K60 L119 M120 A121 H127 L138K60-T123 HydrophobicContact CB-CG2 4.14Å; L119-T123 WeakPolarHBondContact O-CB 3.37Å; L119-T123 PolarHBondContact O-N 3.23Å; L119-T123 PolarHBondContact O-OG1 3.46Å; M120-T123 PolarHBondContact O-N 3.39Å; A121-T123 VanDerWaalsContact C-N 3.35Å; A121-T123 PolarHBondContact O-N 2.97Å; T123-H127 PolarHBondContact O-N 3.23Å; T123-H127 VanDerWaalsContact O-N 3.15Å; T123-L138 HydrophobicContact CG2-CD2 4.13Å
124R80.5Confident80.4Confident86 Ų8641.7 Ų41.733%0.32524%0.235SC..Hα-helixtrans-68.7-40.3174.6-73.3-68.1-161.6178.21.7112.5L61 M120 A121 A122 H127 Y128 V204L61-R124 HydrophobicContact CD1-CG 4.33Å; M120-R124 WeakPolarHBondContact O-CG 3.31Å; M120-R124 PolarHBondContact O-N 2.93Å; A121-R124 CarbonylContact O-C 3.44Å; A121-R124 WeakPolarHBondContact O-CB 3.34Å; A121-R124 PolarHBondContact O-N 3.2Å; A121-R124 VanDerWaalsContact O-N 3.12Å; A122-R124 VanDerWaalsContact C-N 3.28Å; A122-R124 PolarHBondContact O-N 3.39Å; R124-H127 PolarHBondContact O-N 3Å; R124-Y128 HydrophobicContact CB-CD2 4.45Å; R124-Y128 HydrophobicContact CB-CE2 4.18Å; R124-Y128 WeakPolarHBondContact O-CD2 3.02Å; R124-Y128 PolarHBondContact O-N 2.86Å; R124-V204 HydrophobicContact CB-CG1 4.28Å; R124-V204 HydrophobicContact CB-CG2 4.09Å
125A78.1Confident80Confident12 Ų1244.3 Ų44.310%0.09925%0.247CC..Hα-helixtrans-60.6-48.2177.900000110.6A121 A122 H127 Y128 S129 V204 L207A121-A125 WeakPolarHBondContact O-CB 3.33Å; A121-A125 PolarHBondContact O-N 2.88Å; A122-A125 WeakPolarHBondContact O-CB 3.06Å; A122-A125 PolarHBondContact O-N 2.87Å; A122-A125 VanDerWaalsContact O-N 3.14Å; A125-H127 VanDerWaalsContact C-N 3.3Å; A125-H127 PolarHBondContact O-N 3.24Å; A125-Y128 CarbonylContact O-C 3.57Å; A125-Y128 PolarHBondContact O-N 2.98Å; A125-S129 PolarHBondContact O-N 2.93Å; A125-V204 HydrophobicContact CB-CG2 3.84Å; A125-L207 HydrophobicContact CB-CD1 3.82Å; A125-L207 WeakPolarHBondContact O-CD1 3.46Å
126V81.1Confident79.5Confident22 Ų2250 Ų5013%0.13328%0.275CS..Hα-helixtrans-58.1-43.2174.8172.80000111.2A122 Y128 S129 L134 E135 L138A122-V126 WeakPolarHBondContact O-CG2 3.34Å; A122-V126 PolarHBondContact O-N 3.31Å; V126-Y128 VanDerWaalsContact C-N 3.3Å; V126-Y128 PolarHBondContact O-N 2.85Å; V126-S129 PolarHBondContact O-N 3.38Å; V126-S129 PolarHBondContact O-OG 2.91Å; V126-L134 HydrophobicContact CB-CD2 4.26Å; V126-L134 HydrophobicContact CB-CG 4.43Å; V126-L134 HydrophobicContact CG1-CB 4.19Å; V126-L134 HydrophobicContact CG1-CD2 4.01Å; V126-L134 HydrophobicContact CG1-CG 3.76Å; V126-L134 HydrophobicContact CG2-CD2 3.77Å; V126-L134 HydrophobicContact CG2-CG 3.98Å; V126-E135 HydrophobicContact CG1-CG 4.13Å; V126-L138 HydrophobicContact CB-CD2 3.98Å; V126-L138 HydrophobicContact CG1-CB 4.28Å; V126-L138 HydrophobicContact CG1-CD2 4.03Å; V126-L138 HydrophobicContact CG2-CD2 4.08Å
127H79.4Confident79Confident80 Ų8055.8 Ų55.837%0.3731%0.305SS..Hα-helixtrans-65-32.8176.2-174.757.8000113.4T123 R124 A125 E135 R211T123-H127 PolarHBondContact O-N 3.23Å; T123-H127 VanDerWaalsContact O-N 3.15Å; R124-H127 PolarHBondContact O-N 3Å; A125-H127 VanDerWaalsContact C-N 3.3Å; A125-H127 PolarHBondContact O-N 3.24Å; H127-E135 WeakPolarHBondContact CA-OE1 3.26Å; H127-E135 IonicContact CE1-OE1 2.93Å; H127-E135 IonicContact CG-OE1 3.96Å; H127-E135 IonicContact ND1-OE1 3.83Å; H127-E135 PolarHBondContact ND1-OE1 3.34Å; H127-R211 PolarHBondContact CD2-NH1 3.33Å; H127-R211 PolarHBondContact NE2-NH1 3.26Å; H127-R211 PolarHBondContact O-NH1 3.36Å
128Y75.1Confident78.9Confident44 Ų4455 Ų5517%0.17330%0.299CS..Hα-helixtrans-81.3-21.2177.3-67.3-47.5000113.7R124 A125 V126 N130 V204 R208 R211R124-Y128 HydrophobicContact CB-CD2 4.45Å; R124-Y128 HydrophobicContact CB-CE2 4.18Å; R124-Y128 WeakPolarHBondContact O-CD2 3.02Å; R124-Y128 PolarHBondContact O-N 2.86Å; A125-Y128 CarbonylContact O-C 3.57Å; A125-Y128 PolarHBondContact O-N 2.98Å; V126-Y128 VanDerWaalsContact C-N 3.3Å; V126-Y128 PolarHBondContact O-N 2.85Å; Y128-N130 PolarHBondContact O-N 2.85Å; Y128-V204 HydrophobicContact CD2-CG1 4.06Å; Y128-V204 HydrophobicContact CE2-CG1 3.86Å; Y128-R208 HydrophobicContact CD1-CB 4.49Å; Y128-R208 HydrophobicContact CD2-CB 3.94Å; Y128-R208 HydrophobicContact CE1-CG 4.27Å; Y128-R208 HydrophobicContact CE2-CB 4.05Å; Y128-R208 HydrophobicContact CE2-CG 4.27Å; Y128-R208 HydrophobicContact CG-CB 4.19Å; Y128-R211 WeakPolarHBondContact O-CD 3.17Å
129S78.5Confident79Confident29 Ų2956.6 Ų56.620%0.20331%0.309CS..Hα-helixtrans-68.7-21.9177.373.10000112.7A125 V126 V131A125-S129 PolarHBondContact O-N 2.93Å; V126-S129 PolarHBondContact O-N 3.38Å; V126-S129 PolarHBondContact O-OG 2.91Å; S129-V131 PolarHBondContact O-N 3.19Å
130N72.8Confident78.9Confident98 Ų9859 Ų5952%0.52432%0.322SS..THydrogen-bonded Turntrans55.829.4-179.1-156.241.9000112.9Y128 P132Y128-N130 PolarHBondContact O-N 2.85Å; N130-P132 WeakPolarHBondContact O-CD 3.05Å
131V78.3Confident79Confident61 Ų6167.9 Ų67.937%0.3735%0.354SS..  trans-93.8106.8177.1179.70000107.9S129 T133 L134 E135S129-V131 PolarHBondContact O-N 3.19Å; V131-T133 VanDerWaalsContact C-N 3.27Å; V131-T133 VanDerWaalsContact CG1-OG1 3.26Å; V131-T133 WeakPolarHBondContact CG1-OG1 3.4Å; V131-T133 PolarHBondContact O-N 3.49Å; V131-L134 HydrophobicContact CB-CB 4Å; V131-L134 HydrophobicContact CG1-CB 4.01Å; V131-L134 PolarHBondContact O-N 3.28Å; V131-E135 PolarHBondContact O-N 2.96Å
132P74.1Confident79.4Confident85 Ų8571 Ų7155%0.55237%0.368SS*.Hα-helixtrans-60.4-36.6-171.8-2434.2000113N130 L134 E135 Q136N130-P132 WeakPolarHBondContact O-CD 3.05Å; P132-L134 VanDerWaalsContact C-N 3.33Å; P132-L134 PolarHBondContact O-N 3.08Å; P132-E135 PolarHBondContact O-N 3.32Å; P132-Q136 WeakPolarHBondContact O-CB 3.05Å; P132-Q136 VanDerWaalsContact O-CG 3.29Å; P132-Q136 WeakPolarHBondContact O-CG 3.36Å; P132-Q136 PolarHBondContact O-N 3.47Å
133T76.3Confident79.7Confident88 Ų8869 Ų6954%0.5435%0.351SS..Hα-helixtrans-62.5-40.7177.452.90000111.5V131 Q136 L137V131-T133 VanDerWaalsContact C-N 3.27Å; V131-T133 VanDerWaalsContact CG1-OG1 3.26Å; V131-T133 WeakPolarHBondContact CG1-OG1 3.4Å; V131-T133 PolarHBondContact O-N 3.49Å; T133-Q136 PolarHBondContact O-N 2.84Å; T133-L137 WeakPolarHBondContact O-CB 3.44Å; T133-L137 VanDerWaalsContact O-CG 3.22Å; T133-L137 WeakPolarHBondContact O-CG 3.43Å; T133-L137 PolarHBondContact O-N 2.89Å
134L76Confident79.9Confident71 Ų7172.4 Ų72.437%0.37237%0.368SS..Hα-helixtrans-71-37.5178.3-162.666000111.7V126 V131 P132 L138V126-L134 HydrophobicContact CB-CD2 4.26Å; V126-L134 HydrophobicContact CB-CG 4.43Å; V126-L134 HydrophobicContact CG1-CB 4.19Å; V126-L134 HydrophobicContact CG1-CD2 4.01Å; V126-L134 HydrophobicContact CG1-CG 3.76Å; V126-L134 HydrophobicContact CG2-CD2 3.77Å; V126-L134 HydrophobicContact CG2-CG 3.98Å; V131-L134 HydrophobicContact CB-CB 4Å; V131-L134 HydrophobicContact CG1-CB 4.01Å; V131-L134 PolarHBondContact O-N 3.28Å; P132-L134 VanDerWaalsContact C-N 3.33Å; P132-L134 PolarHBondContact O-N 3.08Å; L134-L138 WeakPolarHBondContact O-CB 3.25Å; L134-L138 PolarHBondContact O-N 3.48Å
135E73.8Confident80.5Confident60 Ų6071.7 Ų71.728%0.2837%0.373SS..Hα-helixtrans-66.1-36.4173.4-72.4-160.4149.300112.5K60 V126 H127 V131 P132K60-E135 PolarHBondContact NZ-O 3.19Å; V126-E135 HydrophobicContact CG1-CG 4.13Å; H127-E135 WeakPolarHBondContact CA-OE1 3.26Å; H127-E135 IonicContact CE1-OE1 2.93Å; H127-E135 IonicContact CG-OE1 3.96Å; H127-E135 IonicContact ND1-OE1 3.83Å; H127-E135 PolarHBondContact ND1-OE1 3.34Å; V131-E135 PolarHBondContact O-N 2.96Å; P132-E135 PolarHBondContact O-N 3.32Å
136Q75.2Confident81.1Confident151 Ų15174.7 Ų74.771%0.70639%0.387SS*.Hα-helixtrans-68.9-45.2175.2-75.5174.3-600111.7P132 T133 L138P132-Q136 WeakPolarHBondContact O-CB 3.05Å; P132-Q136 VanDerWaalsContact O-CG 3.29Å; P132-Q136 WeakPolarHBondContact O-CG 3.36Å; P132-Q136 PolarHBondContact O-N 3.47Å; T133-Q136 PolarHBondContact O-N 2.84Å; Q136-L138 VanDerWaalsContact C-N 3.32Å; Q136-L138 PolarHBondContact O-N 3.31Å
137L77.5Confident81.6Confident120 Ų12074.5 Ų74.563%0.62838%0.384SS*.Hα-helixtrans-60.5-41.6176.7-75.6167.6000111.8T133 S139 L142T133-L137 WeakPolarHBondContact O-CB 3.44Å; T133-L137 VanDerWaalsContact O-CG 3.22Å; T133-L137 WeakPolarHBondContact O-CG 3.43Å; T133-L137 PolarHBondContact O-N 2.89Å; L137-S139 PolarHBondContact O-N 3.36Å; L137-L142 WeakPolarHBondContact O-CD2 3.23Å
138L80.3Confident82.3Confident28 Ų2873.4 Ų73.415%0.14739%0.389CS..SBendtrans-75.363.4177.9-162.676.6000111.5K60 T123 V126 L134 Q136 L143K60-L138 VanDerWaalsContact CD-O 3.29Å; K60-L138 WeakPolarHBondContact CD-O 3.43Å; K60-L138 WeakPolarHBondContact CE-O 3.44Å; K60-L138 PolarHBondContact NZ-O 3.46Å; T123-L138 HydrophobicContact CG2-CD2 4.13Å; V126-L138 HydrophobicContact CB-CD2 3.98Å; V126-L138 HydrophobicContact CG1-CB 4.28Å; V126-L138 HydrophobicContact CG1-CD2 4.03Å; V126-L138 HydrophobicContact CG2-CD2 4.08Å; L134-L138 WeakPolarHBondContact O-CB 3.25Å; L134-L138 PolarHBondContact O-N 3.48Å; Q136-L138 VanDerWaalsContact C-N 3.32Å; Q136-L138 PolarHBondContact O-N 3.31Å; L138-L143 HydrophobicContact CD1-CD2 3.76Å; L138-L143 HydrophobicContact CD1-CG 4.11Å; L138-L143 HydrophobicContact CD2-CD2 4.45Å; L138-L143 HydrophobicContact CG-CD1 4.34Å; L138-L143 HydrophobicContact CG-CD2 4.17Å; L138-L143 HydrophobicContact CG-CG 4.15Å
139S84.4Confident83.1Confident46 Ų4677.9 Ų77.932%0.32241%0.409SS..  trans-70.8156.4173.172.10000111.1L137 R141 L142 L143L137-S139 PolarHBondContact O-N 3.36Å; S139-R141 PolarHBondContact O-N 3.23Å; S139-L142 PolarHBondContact O-N 3.03Å; S139-L142 VanDerWaalsContact O-N 3.14Å; S139-L142 PolarHBondContact OG-N 3.49Å; S139-L142 VanDerWaalsContact OG-N 3.12Å; S139-L143 PolarHBondContact O-N 3.49Å; S139-L143 VanDerWaalsContact O-N 3.09Å
140L83.9Confident83.8Confident60 Ų6077.2 Ų77.231%0.31440%0.403SS..Hα-helixtrans-57.8-35.3173.7-176.566.3000111.5W63 L143 I144W63-L140 HydrophobicContact CB-CD1 3.62Å; W63-L140 HydrophobicContact CD2-CD1 3.87Å; W63-L140 HydrophobicContact CE3-CD1 4.46Å; W63-L140 HydrophobicContact CG-CD1 3.45Å; W63-L140 VanDerWaalsContact CG-CD1 3.45Å; L140-L143 PolarHBondContact O-N 3.2Å; L140-I144 HydrophobicContact CG-CD1 4.12Å; L140-I144 VanDerWaalsContact O-CG1 3.3Å; L140-I144 WeakPolarHBondContact O-CG1 3.49Å; L140-I144 PolarHBondContact O-N 3.35Å
141R87Confident84.7Confident210 Ų21075.9 Ų75.979%0.79240%0.395SS*.Hα-helixtrans-62.3-46.2175.8-67.6-177.7179.9175.6-0.8111.4S139 L143 I144 V145S139-R141 PolarHBondContact O-N 3.23Å; R141-L143 VanDerWaalsContact C-N 3.32Å; R141-L143 PolarHBondContact O-N 2.98Å; R141-I144 PolarHBondContact O-N 3.28Å; R141-V145 VanDerWaalsContact O-CG2 3.32Å; R141-V145 WeakPolarHBondContact O-CG2 3.41Å; R141-V145 PolarHBondContact O-N 3.33Å
142L88.8Confident85.4Confident83 Ų8377.8 Ų77.844%0.43540%0.403SS..Hα-helixtrans-61.3-41.7177.4-176.265.5000111.5L137 S139 I144 V145 L146L137-L142 WeakPolarHBondContact O-CD2 3.23Å; S139-L142 PolarHBondContact O-N 3.03Å; S139-L142 VanDerWaalsContact O-N 3.14Å; S139-L142 PolarHBondContact OG-N 3.49Å; S139-L142 VanDerWaalsContact OG-N 3.12Å; L142-I144 PolarHBondContact O-N 3.46Å; L142-V145 PolarHBondContact O-N 2.86Å; L142-L146 VanDerWaalsContact O-CB 3.31Å; L142-L146 WeakPolarHBondContact O-CB 3.49Å; L142-L146 PolarHBondContact O-N 3.48Å
143L88.9Confident86.3Confident3 Ų377.3 Ų77.32%0.01640%0.395CS..Hα-helixtrans-61.3-41.7176-75.5172.7000112.5K60 W63 L138 S139 L140 R141 R147K60-L143 HydrophobicContact CB-CD1 4.14Å; K60-L143 HydrophobicContact CG-CD1 4.46Å; W63-L143 HydrophobicContact CE3-CB 4.12Å; W63-L143 HydrophobicContact CE3-CD1 4.27Å; W63-L143 HydrophobicContact CH2-CB 3.96Å; W63-L143 WeakPolarHBondContact CH2-O 3.33Å; W63-L143 HydrophobicContact CZ3-CB 3.66Å; W63-L143 HydrophobicContact CZ3-CD1 4.38Å; W63-L143 HydrophobicContact CZ3-CG 4.42Å; L138-L143 HydrophobicContact CD1-CD2 3.76Å; L138-L143 HydrophobicContact CD1-CG 4.11Å; L138-L143 HydrophobicContact CD2-CD2 4.45Å; L138-L143 HydrophobicContact CG-CD1 4.34Å; L138-L143 HydrophobicContact CG-CD2 4.17Å; L138-L143 HydrophobicContact CG-CG 4.15Å; S139-L143 PolarHBondContact O-N 3.49Å; S139-L143 VanDerWaalsContact O-N 3.09Å; L140-L143 PolarHBondContact O-N 3.2Å; R141-L143 VanDerWaalsContact C-N 3.32Å; R141-L143 PolarHBondContact O-N 2.98Å; L143-R147 WeakPolarHBondContact O-CB 3.49Å; L143-R147 PolarHBondContact O-N 3.24Å
144I88.4Confident87Confident83 Ų8373.2 Ų73.243%0.42637%0.37SS..Hα-helixtrans-63.9-46176-68.5164.2000110.7W63 L140 R141 L142 R147 A148W63-I144 HydrophobicContact CZ2-CB 4.36Å; W63-I144 HydrophobicContact CZ2-CG1 3.65Å; L140-I144 HydrophobicContact CG-CD1 4.12Å; L140-I144 VanDerWaalsContact O-CG1 3.3Å; L140-I144 WeakPolarHBondContact O-CG1 3.49Å; L140-I144 PolarHBondContact O-N 3.35Å; R141-I144 PolarHBondContact O-N 3.28Å; L142-I144 PolarHBondContact O-N 3.46Å; I144-R147 PolarHBondContact O-N 3.39Å; I144-A148 PolarHBondContact O-N 3.01Å
145V92.3Very high87.8Confident71 Ų7171 Ų7143%0.4336%0.362SS..Hα-helixtrans-61.5-46.6177.61700000110.9R141 L142 R147 A148 F149R141-V145 VanDerWaalsContact O-CG2 3.32Å; R141-V145 WeakPolarHBondContact O-CG2 3.41Å; R141-V145 PolarHBondContact O-N 3.33Å; L142-V145 PolarHBondContact O-N 2.86Å; V145-R147 VanDerWaalsContact C-N 3.29Å; V145-R147 PolarHBondContact O-N 2.92Å; V145-A148 WeakPolarHBondContact O-CB 3.34Å; V145-A148 PolarHBondContact O-N 3.43Å; V145-A148 VanDerWaalsContact O-N 3.14Å; V145-F149 HydrophobicContact CG1-CD2 3.71Å; V145-F149 HydrophobicContact CG1-CE2 3.4Å; V145-F149 VanDerWaalsContact O-CD2 3.23Å; V145-F149 WeakPolarHBondContact O-CD2 3.5Å; V145-F149 PolarHBondContact O-N 2.84Å
146L90.9Very high88.6Confident75 Ų7572.3 Ų72.339%0.39337%0.37SS..Hα-helixtrans-59.6-41176.2-178.262.1000111.5L119 L142 F149 I150L119-L146 HydrophobicContact CD2-CD2 3.51Å; L119-L146 HydrophobicContact CD2-CG 4.07Å; L142-L146 VanDerWaalsContact O-CB 3.31Å; L142-L146 WeakPolarHBondContact O-CB 3.49Å; L142-L146 PolarHBondContact O-N 3.48Å; L146-F149 PolarHBondContact O-N 3.45Å; L146-I150 HydrophobicContact CD1-CD1 4.41Å; L146-I150 HydrophobicContact CG-CD1 4.05Å; L146-I150 VanDerWaalsContact O-CG1 3.29Å; L146-I150 WeakPolarHBondContact O-CG1 3.27Å; L146-I150 PolarHBondContact O-N 3.1Å
147R92.3Very high89.2Confident19 Ų1966.8 Ų66.87%0.07235%0.345CS..Hα-helixtrans-64.1-40.4175.5-178.157.6174.8141.91111.9W63 N67 S71 L119 L143 I144 V145 I150 I151 D154W63-R147 HydrophobicContact CH2-CB 3.92Å; W63-R147 HydrophobicContact CH2-CG 4.42Å; W63-R147 HydrophobicContact CZ2-CB 4.34Å; N67-R147 PolarHBondContact ND2-NE 3.24Å; N67-R147 PolarHBondContact OD1-NE 2.9Å; N67-R147 VanDerWaalsContact OD1-NE 3.11Å; S71-R147 PolarHBondContact OG-NH2 2.97Å; L119-R147 HydrophobicContact CD1-CB 4.28Å; L143-R147 WeakPolarHBondContact O-CB 3.49Å; L143-R147 PolarHBondContact O-N 3.24Å; I144-R147 PolarHBondContact O-N 3.39Å; V145-R147 VanDerWaalsContact C-N 3.29Å; V145-R147 PolarHBondContact O-N 2.92Å; R147-I150 PolarHBondContact O-N 3.47Å; R147-I151 HydrophobicContact CG-CD1 3.95Å; R147-I151 HydrophobicContact CG-CG1 4.48Å; R147-I151 VanDerWaalsContact O-CG1 3.23Å; R147-I151 WeakPolarHBondContact O-CG1 3.28Å; R147-I151 PolarHBondContact O-N 2.7Å; R147-D154 IonicContact NH1-OD2 3.83Å
148A93.2Very high89.6Confident57 Ų5761.1 Ų61.147%0.47132%0.315SS..Hα-helixtrans-62.4-43.3175.600000111.9I144 V145 I151 L152I144-A148 PolarHBondContact O-N 3.01Å; V145-A148 WeakPolarHBondContact O-CB 3.34Å; V145-A148 PolarHBondContact O-N 3.43Å; V145-A148 VanDerWaalsContact O-N 3.14Å; A148-I151 PolarHBondContact O-N 2.99Å; A148-L152 PolarHBondContact O-N 3.37Å
149F93.1Very high89.9Confident138 Ų13862.3 Ų62.361%0.60533%0.326SS*.Hα-helixtrans-61.9-42.9174.1-78.4-63000112.7V145 L146 L152 L153V145-F149 HydrophobicContact CG1-CD2 3.71Å; V145-F149 HydrophobicContact CG1-CE2 3.4Å; V145-F149 VanDerWaalsContact O-CD2 3.23Å; V145-F149 WeakPolarHBondContact O-CD2 3.5Å; V145-F149 PolarHBondContact O-N 2.84Å; L146-F149 PolarHBondContact O-N 3.45Å; F149-L152 PolarHBondContact O-N 3.38Å; F149-L153 PolarHBondContact O-N 2.79Å
150I92.2Very high89.9Confident15 Ų1564.1 Ų64.18%0.07733%0.331CS..Hα-helixtrans-61.3-45175.6-71.7165.9000110.9W115 L119 L146 R147 L152 L153 D154W115-I150 HydrophobicContact CB-CG2 3.71Å; W115-I150 VanDerWaalsContact CD1-CG2 3.41Å; W115-I150 HydrophobicContact CD2-CD1 4.45Å; W115-I150 HydrophobicContact CD2-CG2 3.61Å; W115-I150 HydrophobicContact CE3-CD1 4.07Å; W115-I150 HydrophobicContact CE3-CG1 4.47Å; W115-I150 HydrophobicContact CE3-CG2 4.29Å; W115-I150 HydrophobicContact CG-CG2 3.31Å; L119-I150 HydrophobicContact CD1-CD1 4.04Å; L119-I150 HydrophobicContact CD2-CD1 4.08Å; L119-I150 HydrophobicContact CG-CD1 4.17Å; L146-I150 HydrophobicContact CD1-CD1 4.41Å; L146-I150 HydrophobicContact CG-CD1 4.05Å; L146-I150 VanDerWaalsContact O-CG1 3.29Å; L146-I150 WeakPolarHBondContact O-CG1 3.27Å; L146-I150 PolarHBondContact O-N 3.1Å; R147-I150 PolarHBondContact O-N 3.47Å; I150-L152 VanDerWaalsContact C-N 3.3Å; I150-L152 PolarHBondContact O-N 2.9Å; I150-L153 WeakPolarHBondContact O-CB 3.44Å; I150-L153 PolarHBondContact O-N 2.87Å; I150-D154 WeakPolarHBondContact O-CB 3.31Å; I150-D154 VanDerWaalsContact O-CG 3.29Å; I150-D154 PolarHBondContact O-N 3.2Å
151I92.2Very high89.7Confident69 Ų6961.3 Ų61.335%0.35432%0.317SS..Hα-helixtrans-60.4-42.2177.6-71.5167.4000110.7F108 R147 A148 D154 A155F108-I151 HydrophobicContact CE2-CG2 4.3Å; F108-I151 WeakPolarHBondContact CE2-O 3.33Å; F108-I151 HydrophobicContact CZ-CG2 3.84Å; R147-I151 HydrophobicContact CG-CD1 3.95Å; R147-I151 HydrophobicContact CG-CG1 4.48Å; R147-I151 VanDerWaalsContact O-CG1 3.23Å; R147-I151 WeakPolarHBondContact O-CG1 3.28Å; R147-I151 PolarHBondContact O-N 2.7Å; A148-I151 PolarHBondContact O-N 2.99Å; I151-D154 PolarHBondContact O-N 3.24Å; I151-A155 PolarHBondContact O-N 2.79Å
152L93.7Very high89.2Confident102 Ų10251.7 Ų51.753%0.53428%0.281SS..Hα-helixtrans-63.2-43.8176.1-178.962.2000111.5A148 F149 I150 A155 I156A148-L152 PolarHBondContact O-N 3.37Å; F149-L152 PolarHBondContact O-N 3.38Å; I150-L152 VanDerWaalsContact C-N 3.3Å; I150-L152 PolarHBondContact O-N 2.9Å; L152-A155 WeakPolarHBondContact O-CB 3.33Å; L152-A155 PolarHBondContact O-N 2.94Å; L152-I156 HydrophobicContact CD1-CD1 4.46Å; L152-I156 HydrophobicContact CG-CD1 4.16Å; L152-I156 WeakPolarHBondContact O-CG1 3.4Å; L152-I156 PolarHBondContact O-N 2.82Å
153L92.2Very high88.6Confident75 Ų7556.7 Ų56.739%0.39330%0.295SS..Hα-helixtrans-61.6-44.5175.5-178.565.2000111.6F149 I150 A155 I156 M157 Y189F149-L153 PolarHBondContact O-N 2.79Å; I150-L153 WeakPolarHBondContact O-CB 3.44Å; I150-L153 PolarHBondContact O-N 2.87Å; L153-A155 VanDerWaalsContact C-N 3.26Å; L153-A155 PolarHBondContact O-N 3.22Å; L153-I156 PolarHBondContact O-N 3.39Å; L153-M157 HydrophobicContact CD1-CG 4.11Å; L153-M157 HydrophobicContact CG-CG 4.3Å; L153-M157 WeakPolarHBondContact O-CB 3.48Å; L153-M157 WeakPolarHBondContact O-CG 3.43Å; L153-M157 PolarHBondContact O-N 3.35Å; L153-Y189 HydrophobicContact CD2-CE2 4.5Å
154D91.4Very high87.7Confident2 Ų258.4 Ų58.41%0.01131%0.314CS..Hα-helixtrans-57.6-41.5175.8-72.7-24.6000110.4F108 F111 W115 R147 I150 I151 T158 Y189F108-D154 HydrophobicContact CD2-CB 3.96Å; F108-D154 HydrophobicContact CE2-CB 3.88Å; F111-D154 HydrophobicContact CB-CB 4.45Å; F111-D154 HydrophobicContact CD2-CB 4.39Å; W115-D154 VanDerWaalsContact CD1-OD1 3.22Å; W115-D154 VanDerWaalsContact CD1-OD2 3.26Å; W115-D154 PolarHBondContact NE1-OD1 2.83Å; R147-D154 IonicContact NH1-OD2 3.83Å; I150-D154 WeakPolarHBondContact O-CB 3.31Å; I150-D154 VanDerWaalsContact O-CG 3.29Å; I150-D154 PolarHBondContact O-N 3.2Å; I151-D154 PolarHBondContact O-N 3.24Å; D154-T158 WeakPolarHBondContact O-CB 3.16Å; D154-T158 PolarHBondContact O-N 2.72Å; D154-T158 PolarHBondContact O-OG1 3.29Å; D154-Y189 PolarHBondContact OD1-OH 3Å
155A91.6Very high86.6Confident24 Ų2455.5 Ų55.520%0.19830%0.298CS..Hα-helixtrans-66.6-42.8178.200000112.3W104 F108 I151 L152 L153 S159W104-A155 HydrophobicContact CZ2-CB 4.35Å; F108-A155 HydrophobicContact CD2-CB 4.2Å; F108-A155 HydrophobicContact CE2-CB 3.76Å; I151-A155 PolarHBondContact O-N 2.79Å; L152-A155 WeakPolarHBondContact O-CB 3.33Å; L152-A155 PolarHBondContact O-N 2.94Å; L153-A155 VanDerWaalsContact C-N 3.26Å; L153-A155 PolarHBondContact O-N 3.22Å; A155-S159 WeakPolarHBondContact O-CB 3.26Å; A155-S159 PolarHBondContact O-N 2.9Å; A155-S159 PolarHBondContact O-OG 3.33Å
156I91.1Very high85Confident87 Ų8754.2 Ų54.245%0.44630%0.295SS..Hα-helixtrans-63-51.8176.1-66.1165.1000109.8L152 L153 T158 S159 L160L152-I156 HydrophobicContact CD1-CD1 4.46Å; L152-I156 HydrophobicContact CG-CD1 4.16Å; L152-I156 WeakPolarHBondContact O-CG1 3.4Å; L152-I156 PolarHBondContact O-N 2.82Å; L153-I156 PolarHBondContact O-N 3.39Å; I156-T158 PolarHBondContact O-N 3.23Å; I156-S159 PolarHBondContact O-N 2.87Å; I156-L160 HydrophobicContact CG2-CD1 4.1Å; I156-L160 WeakPolarHBondContact O-CG 3.36Å; I156-L160 PolarHBondContact O-N 3Å
157M87.7Confident83.2Confident36 Ų3654.9 Ų54.918%0.17731%0.311CS..Hα-helixtrans-62.7-42.2-178.8-69.3-58.5-71.500111.8L153 S159 L160 I161 I185 Y189L153-M157 HydrophobicContact CD1-CG 4.11Å; L153-M157 HydrophobicContact CG-CG 4.3Å; L153-M157 WeakPolarHBondContact O-CB 3.48Å; L153-M157 WeakPolarHBondContact O-CG 3.43Å; L153-M157 PolarHBondContact O-N 3.35Å; M157-S159 VanDerWaalsContact C-N 3.31Å; M157-S159 PolarHBondContact O-N 3.35Å; M157-L160 PolarHBondContact O-N 2.84Å; M157-L160 HydrophobicContact SD-CD1 4.23Å; M157-I161 WeakPolarHBondContact O-CB 3.12Å; M157-I161 WeakPolarHBondContact O-CD1 3.36Å; M157-I161 WeakPolarHBondContact O-CG1 3.2Å; M157-I161 PolarHBondContact O-N 3.35Å; M157-I185 HydrophobicContact CE-CG2 3.7Å; M157-Y189 HydrophobicContact CB-CD1 4.21Å; M157-Y189 HydrophobicContact CB-CE1 4.03Å; M157-Y189 HydrophobicContact CB-CE2 4.4Å; M157-Y189 HydrophobicContact CB-CG 4.46Å; M157-Y189 HydrophobicContact CE-CD2 3.54Å; M157-Y189 HydrophobicContact CE-CE2 4.2Å; M157-Y189 HydrophobicContact CE-CG 3.78Å; M157-Y189 HydrophobicContact CG-CD2 4.02Å; M157-Y189 HydrophobicContact CG-CE1 4.25Å; M157-Y189 HydrophobicContact CG-CE2 3.73Å; M157-Y189 HydrophobicContact CG-CG 4.4Å; M157-Y189 HydrophobicContact SD-CD2 4.48Å
158T86.4Confident81.2Confident0 Ų060.3 Ų60.30%034%0.341CS..Hα-helixtrans-61.5-42.6175.6-56.40000111.2W104 T107 F108 F111 D154 I156 L160 I161 L162W104-T158 HydrophobicContact CD2-CG2 4.25Å; W104-T158 HydrophobicContact CG-CG2 4.02Å; W104-T158 WeakPolarHBondContact O-CG2 3.39Å; T107-T158 HydrophobicContact CG2-CG2 3.94Å; F108-T158 WeakPolarHBondContact CA-OG1 3.23Å; F108-T158 HydrophobicContact CB-CG2 4Å; F111-T158 WeakPolarHBondContact CE2-OG1 3.14Å; D154-T158 WeakPolarHBondContact O-CB 3.16Å; D154-T158 PolarHBondContact O-N 2.72Å; D154-T158 PolarHBondContact O-OG1 3.29Å; I156-T158 PolarHBondContact O-N 3.23Å; T158-L160 PolarHBondContact O-N 3.48Å; T158-I161 PolarHBondContact O-N 2.81Å; T158-L162 HydrophobicContact CG2-CD1 3.79Å; T158-L162 WeakPolarHBondContact O-CD1 3.43Å; T158-L162 PolarHBondContact O-N 3.3Å
159S86.3Confident79.3Confident54 Ų5459.2 Ų59.238%0.37833%0.332SS..Hα-helixtrans-64.1-39.6177.3-56.20000111.9W104 A155 I156 M157 L162 Y163W104-S159 PolarHBondContact NE1-OG 3.11Å; W104-S159 VanDerWaalsContact NE1-OG 3.1Å; A155-S159 WeakPolarHBondContact O-CB 3.26Å; A155-S159 PolarHBondContact O-N 2.9Å; A155-S159 PolarHBondContact O-OG 3.33Å; I156-S159 PolarHBondContact O-N 2.87Å; M157-S159 VanDerWaalsContact C-N 3.31Å; M157-S159 PolarHBondContact O-N 3.35Å; S159-L162 PolarHBondContact O-N 3.32Å; S159-Y163 WeakPolarHBondContact O-CB 3.14Å; S159-Y163 PolarHBondContact O-N 3.48Å
160L84.2Confident77.2Confident83 Ų8355.8 Ų55.844%0.43533%0.329SS..Hα-helixtrans-65.7-43.3174.3-69.7172.5000112.5I156 M157 T158 L162 Y163 G164 I185I156-L160 HydrophobicContact CG2-CD1 4.1Å; I156-L160 WeakPolarHBondContact O-CG 3.36Å; I156-L160 PolarHBondContact O-N 3Å; M157-L160 PolarHBondContact O-N 2.84Å; M157-L160 HydrophobicContact SD-CD1 4.23Å; T158-L160 PolarHBondContact O-N 3.48Å; L160-L162 VanDerWaalsContact C-N 3.31Å; L160-L162 PolarHBondContact O-N 2.82Å; L160-Y163 PolarHBondContact O-N 2.89Å; L160-G164 PolarHBondContact O-N 3.09Å; L160-G164 VanDerWaalsContact O-N 3.17Å; L160-I185 HydrophobicContact CB-CD1 4.49Å
161I79.3Confident75.2Confident2 Ų259.6 Ų59.61%0.0136%0.355CS..Hα-helixtrans-57.1-47.1176.7-71.4162000110.1F111 M157 T158 K165 I185 H186F111-I161 HydrophobicContact CE2-CD1 4.31Å; F111-I161 HydrophobicContact CZ-CD1 4.01Å; M157-I161 WeakPolarHBondContact O-CB 3.12Å; M157-I161 WeakPolarHBondContact O-CD1 3.36Å; M157-I161 WeakPolarHBondContact O-CG1 3.2Å; M157-I161 PolarHBondContact O-N 3.35Å; T158-I161 PolarHBondContact O-N 2.81Å; I161-K165 WeakPolarHBondContact O-CG 3.34Å; I161-I185 HydrophobicContact CG1-CB 4.12Å; I161-I185 HydrophobicContact CG1-CG2 3.79Å; I161-H186 HydrophobicContact CD1-CB 3.93Å; I161-H186 HydrophobicContact CG1-CB 4.07Å; I161-H186 HydrophobicContact CG2-CB 4.06Å
162L77.6Confident72.8Confident8 Ų861.3 Ų61.34%0.04237%0.369CS..Hα-helixtrans-77.1-34.6-178.6-86.884.1000113L100 T103 W104 T158 S159 L160 G164 K165 A166L100-L162 HydrophobicContact CD2-CD2 4.24Å; L100-L162 HydrophobicContact CG-CD2 4.15Å; L100-L162 VanDerWaalsContact O-CD2 3.31Å; L100-L162 WeakPolarHBondContact O-CD2 3.28Å; T103-L162 HydrophobicContact CG2-CD2 4.3Å; W104-L162 HydrophobicContact CB-CD2 3.52Å; W104-L162 HydrophobicContact CG-CD2 4.15Å; T158-L162 HydrophobicContact CG2-CD1 3.79Å; T158-L162 WeakPolarHBondContact O-CD1 3.43Å; T158-L162 PolarHBondContact O-N 3.3Å; S159-L162 PolarHBondContact O-N 3.32Å; L160-L162 VanDerWaalsContact C-N 3.31Å; L160-L162 PolarHBondContact O-N 2.82Å; L162-G164 VanDerWaalsContact C-N 3.31Å; L162-G164 PolarHBondContact O-N 3.49Å; L162-K165 CarbonylContact O-C 3.59Å; L162-K165 PolarHBondContact O-N 3.45Å; L162-A166 WeakPolarHBondContact O-CB 3.45Å; L162-A166 PolarHBondContact O-N 2.92Å
163Y76.8Confident70.5Confident187 Ų18762.8 Ų62.873%0.73337%0.372SS*.Hα-helixtrans-58.5-44.7176.4-178.8-97.1000111.3S159 L160 K165S159-Y163 WeakPolarHBondContact O-CB 3.14Å; S159-Y163 PolarHBondContact O-N 3.48Å; L160-Y163 PolarHBondContact O-N 2.89Å; Y163-K165 PolarHBondContact O-N 3.38Å
164G68.1Low68.3Low39 Ų3960.6 Ų60.640%0.40236%0.363SS..Hα-helixtrans-62.3-22.7175.900000114L160 L162 L168L160-G164 PolarHBondContact O-N 3.09Å; L160-G164 VanDerWaalsContact O-N 3.17Å; L162-G164 VanDerWaalsContact C-N 3.31Å; L162-G164 PolarHBondContact O-N 3.49Å; G164-L168 WeakPolarHBondContact O-CD1 3.34Å
165K65.4Low66.5Low23 Ų2363.9 Ų63.910%0.138%0.383CS..Hα-helixtrans-99.5-30-176.8-71.4-67-164.4175.30114.1I161 L162 Y163 A167 L168 A169 M179 A182I161-K165 WeakPolarHBondContact O-CG 3.34Å; L162-K165 CarbonylContact O-C 3.59Å; L162-K165 PolarHBondContact O-N 3.45Å; Y163-K165 PolarHBondContact O-N 3.38Å; K165-A167 PolarHBondContact O-N 2.86Å; K165-L168 HydrophobicContact CD-CD1 4.4Å; K165-L168 PolarHBondContact O-N 3.26Å; K165-A169 PolarHBondContact O-N 3.38Å; K165-A169 VanDerWaalsContact O-N 3.08Å; K165-M179 WeakPolarHBondContact CE-O 3.34Å; K165-M179 WeakPolarHBondContact CG-O 3.32Å; K165-A182 WeakPolarHBondContact CE-O 3.28Å; K165-A182 PolarHBondContact NZ-O 2.69Å; K165-A182 VanDerWaalsContact NZ-O 3.15Å
166A59.3Low64.6Low43 Ų4364.4 Ų64.436%0.35538%0.38SS..Hα-helixtrans-56.1-31.3173.100000111.6L100 L162 L168L100-A166 HydrophobicContact CD1-CB 3.79Å; L162-A166 WeakPolarHBondContact O-CB 3.45Å; L162-A166 PolarHBondContact O-N 2.92Å; A166-L168 VanDerWaalsContact C-N 3.32Å
167A53.4Low62.7Low90 Ų9062.1 Ų62.174%0.74437%0.368SS*.THydrogen-bonded Turntrans-74.3-16.4175.700000114.5K165K165-A167 PolarHBondContact O-N 2.86Å
168L50.5Low60.8Low133 Ų13364.7 Ų64.770%0.69638%0.382SS*.THydrogen-bonded Turntrans-113.3-17.1-171.5-72164000113.7G164 K165 A166 A170G164-L168 WeakPolarHBondContact O-CD1 3.34Å; K165-L168 HydrophobicContact CD-CD1 4.4Å; K165-L168 PolarHBondContact O-N 3.26Å; A166-L168 VanDerWaalsContact C-N 3.32Å; L168-A170 PolarHBondContact O-N 3.4Å
169A52.9Low59.1Low34 Ų3465.1 Ų65.128%0.28138%0.384SS..  trans-85.7112.5-170.900000111.7F96 K165F96-A169 HydrophobicContact CE2-CB 3.6Å; F96-A169 HydrophobicContact CZ-CB 4.09Å; K165-A169 PolarHBondContact O-N 3.38Å; K165-A169 VanDerWaalsContact O-N 3.08Å
170A49.9Very low57.6Low66 Ų6662.8 Ų62.855%0.54537%0.367SS..  trans-63.9142.1162.800000109.7L168 T172L168-A170 PolarHBondContact O-N 3.4Å; A170-T172 PolarHBondContact O-N 2.9Å
171P48.8Very low56.2Low94 Ų9462.2 Ų62.261%0.6136%0.362SS*.THydrogen-bonded Turntrans-64.9-7.9-17122.1-32.1000115.3
172T42.4Very low55.1Low106 Ų10665.5 Ų65.565%0.6539%0.389SS*.THydrogen-bonded Turntrans-97.7-11.6-164.851.70000116A170A170-T172 PolarHBondContact O-N 2.9Å
173H44.7Very low54.6Low132 Ų13265.6 Ų65.661%0.61139%0.391SS*.  trans-132.132.9-175.9-68.7-72.9000114.2T175 L178H173-T175 PolarHBondContact O-N 3.44Å; H173-L178 HydrophobicContact CB-CD1 4.49Å; H173-L178 HydrophobicContact CB-CD2 4.15Å
174C46.8Very low54.4Low30 Ų3060 Ų6020%0.20338%0.38CS..  trans-72.286.2-176.4-110.90000112C99C99-C174 HydrophobicContact CB-CB 3.76Å; C99-C174 WeakPolarHBondContact SG-CB 3.35Å; C99-C174 PolarHBondContact SG-O 3.38Å
175T53.6Low54.8Low70 Ų7061 Ų6143%0.42938%0.375SS..  trans-100.8150161.560.40000109.1H173 Q177 L178 M179H173-T175 PolarHBondContact O-N 3.44Å; T175-Q177 PolarHBondContact O-N 3.24Å; T175-Q177 WeakPolarHBondContact OG1-CB 3.33Å; T175-L178 PolarHBondContact O-N 2.87Å; T175-L178 PolarHBondContact OG1-N 3.19Å; T175-M179 PolarHBondContact O-N 2.98Å
176Y51.1Low55.2Low36 Ų3660.6 Ų60.614%0.14137%0.373CS..Hα-helixtrans-52.3-27.4171.1172.2-121.4000111.6T103 I106 L180 W273T103-Y176 HydrophobicContact CG2-CD2 3.72Å; T103-Y176 HydrophobicContact CG2-CE2 4.19Å; I106-Y176 HydrophobicContact CB-CD2 4.38Å; I106-Y176 HydrophobicContact CB-CE2 3.95Å; I106-Y176 HydrophobicContact CG2-CD1 4.36Å; I106-Y176 HydrophobicContact CG2-CD2 4.3Å; I106-Y176 HydrophobicContact CG2-CE1 3.79Å; I106-Y176 HydrophobicContact CG2-CE2 3.64Å; Y176-L180 HydrophobicContact CD2-CD1 4.29Å; Y176-L180 HydrophobicContact CE1-CD1 4.07Å; Y176-L180 HydrophobicContact CE2-CD1 3.55Å; Y176-L180 HydrophobicContact CE2-CG 4.21Å; Y176-L180 WeakPolarHBondContact OH-CD1 3.35Å; Y176-W273 AromaticContact CD1-CH2 3.5Å; Y176-W273 HydrophobicContact CD1-CH2 3.5Å; Y176-W273 VanDerWaalsContact CD1-CH2 3.5Å; Y176-W273 AromaticContact CD1-CZ2 3.22Å; Y176-W273 HydrophobicContact CD1-CZ2 3.22Å; Y176-W273 HydrophobicContact CE1-CH2 4.23Å; Y176-W273 AromaticContact CE1-CZ2 3.59Å; Y176-W273 HydrophobicContact CE1-CZ2 3.59Å; Y176-W273 HydrophobicContact CG-CH2 4.37Å; Y176-W273 HydrophobicContact CG-CZ2 4.19Å
177Q51.3Low55.9Low38 Ų3862.5 Ų62.518%0.17838%0.376CS..Hα-helixtrans-60.6-56.8172.6-137.4-169.9-62.900112.1T175 M179 L180 E181 W273T175-Q177 PolarHBondContact O-N 3.24Å; T175-Q177 WeakPolarHBondContact OG1-CB 3.33Å; Q177-M179 VanDerWaalsContact C-N 3.28Å; Q177-M179 PolarHBondContact O-N 2.99Å; Q177-L180 PolarHBondContact O-N 2.86Å; Q177-E181 WeakPolarHBondContact CG-OE1 3.48Å; Q177-E181 PolarHBondContact NE2-OE1 2.88Å; Q177-E181 VanDerWaalsContact O-CG 3.27Å; Q177-E181 WeakPolarHBondContact O-CG 3.44Å; Q177-E181 PolarHBondContact O-N 2.64Å; Q177-E181 VanDerWaalsContact O-N 3.16Å; Q177-W273 HydrophobicContact CB-CH2 4.44Å; Q177-W273 HydrophobicContact CB-CZ2 4.36Å; Q177-W273 HydrophobicContact CG-CD2 4.07Å; Q177-W273 HydrophobicContact CG-CE3 4.35Å; Q177-W273 HydrophobicContact CG-CG 4.42Å; Q177-W273 HydrophobicContact CG-CH2 4.48Å; Q177-W273 HydrophobicContact CG-CZ2 4.22Å
178L48.8Very low57.3Low91 Ų9163.1 Ų63.148%0.47637%0.366SS..Hα-helixtrans-62.3-31.1-175.8-115.7101.1000114H173 T175 E181H173-L178 HydrophobicContact CB-CD1 4.49Å; H173-L178 HydrophobicContact CB-CD2 4.15Å; T175-L178 PolarHBondContact O-N 2.87Å; T175-L178 PolarHBondContact OG1-N 3.19Å; L178-E181 WeakPolarHBondContact CA-OE2 3.34Å
179M50.2Low58.8Low9 Ų957.3 Ų57.34%0.04434%0.335CS..Hα-helixtrans-73.3-31.3-179.4-83.2-169.1167.600112.7F96 L100 T103 K165 T175 Q177F96-M179 HydrophobicContact CE2-CE 4.24Å; L100-M179 HydrophobicContact CB-CE 3.93Å; L100-M179 HydrophobicContact CD1-CE 3.89Å; L100-M179 HydrophobicContact CG-CE 4.02Å; T103-M179 HydrophobicContact CG2-CB 3.68Å; T103-M179 HydrophobicContact CG2-CG 4.23Å; T103-M179 HydrophobicContact CG2-SD 3.59Å; T103-M179 VanDerWaalsContact CG2-SD 3.59Å; K165-M179 WeakPolarHBondContact CE-O 3.34Å; K165-M179 WeakPolarHBondContact CG-O 3.32Å; T175-M179 PolarHBondContact O-N 2.98Å; Q177-M179 VanDerWaalsContact C-N 3.28Å; Q177-M179 PolarHBondContact O-N 2.99Å
180L54.7Low59.9Low5 Ų556.1 Ų56.13%0.02632%0.324CS..Hα-helixtrans-84.5-35.5178.2-68.8172.9000112T107 Y176 Q177 A182 S183 F265T107-L180 HydrophobicContact CG2-CD2 4.15Å; Y176-L180 HydrophobicContact CD2-CD1 4.29Å; Y176-L180 HydrophobicContact CE1-CD1 4.07Å; Y176-L180 HydrophobicContact CE2-CD1 3.55Å; Y176-L180 HydrophobicContact CE2-CG 4.21Å; Y176-L180 WeakPolarHBondContact OH-CD1 3.35Å; Q177-L180 PolarHBondContact O-N 2.86Å; L180-A182 PolarHBondContact O-N 3.37Å; L180-S183 PolarHBondContact O-N 3.41Å; L180-F265 HydrophobicContact CB-CD2 4.19Å; L180-F265 HydrophobicContact CB-CE2 3.38Å; L180-F265 HydrophobicContact CB-CZ 4.05Å; L180-F265 VanDerWaalsContact O-CZ 3.24Å; L180-F265 WeakPolarHBondContact O-CZ 3.31Å
181E54.8Low61.3Low71 Ų7157 Ų5733%0.33232%0.319SS..THydrogen-bonded Turntrans-51.7-5.3-169.8-87.8167.7-170.300118Q177 L178Q177-E181 WeakPolarHBondContact CG-OE1 3.48Å; Q177-E181 PolarHBondContact NE2-OE1 2.88Å; Q177-E181 VanDerWaalsContact O-CG 3.27Å; Q177-E181 WeakPolarHBondContact O-CG 3.44Å; Q177-E181 PolarHBondContact O-N 2.64Å; Q177-E181 VanDerWaalsContact O-N 3.16Å; L178-E181 WeakPolarHBondContact CA-OE2 3.34Å
182A56.3Low63Low70 Ų7056.3 Ų56.358%0.57931%0.309SS*.THydrogen-bonded Turntrans-153.635.5172.400000114.7K165 L180K165-A182 WeakPolarHBondContact CE-O 3.28Å; K165-A182 PolarHBondContact NZ-O 2.69Å; K165-A182 VanDerWaalsContact NZ-O 3.15Å; L180-A182 PolarHBondContact O-N 3.37Å
183S66.5Low64.9Low10 Ų1051.4 Ų51.47%0.0728%0.279CS..  trans-95.7106.9172.6-176.20000110.8L180 I185 H186 M187L180-S183 PolarHBondContact O-N 3.41Å; S183-I185 PolarHBondContact O-N 2.9Å; S183-H186 WeakPolarHBondContact O-CB 3.39Å; S183-H186 PolarHBondContact O-N 3.06Å; S183-H186 VanDerWaalsContact O-N 3.07Å; S183-H186 PolarHBondContact OG-N 3.21Å; S183-M187 PolarHBondContact O-N 2.91Å
184S72.6Confident66.4Low71 Ų7147 Ų4750%0.49726%0.259SS..Hα-helixtrans-56.1-36.3172.555.50000111.9M187 I188S184-M187 PolarHBondContact O-N 2.89Å; S184-I188 WeakPolarHBondContact O-CB 3.45Å; S184-I188 VanDerWaalsContact O-CG1 3.25Å; S184-I188 WeakPolarHBondContact O-CG1 3.36Å; S184-I188 PolarHBondContact O-N 3.44Å
185I77Confident68.2Low60 Ų6050.3 Ų50.331%0.30828%0.275SS..Hα-helixtrans-62.2-46175.8-56.6176.9000110.3M157 L160 I161 S183 M187 I188 Y189M157-I185 HydrophobicContact CE-CG2 3.7Å; L160-I185 HydrophobicContact CB-CD1 4.49Å; I161-I185 HydrophobicContact CG1-CB 4.12Å; I161-I185 HydrophobicContact CG1-CG2 3.79Å; S183-I185 PolarHBondContact O-N 2.9Å; I185-M187 VanDerWaalsContact C-N 3.34Å; I185-M187 PolarHBondContact O-N 3.43Å; I185-I188 PolarHBondContact O-N 3.37Å; I185-Y189 WeakPolarHBondContact O-CB 3.37Å; I185-Y189 PolarHBondContact O-N 3.27Å
186H74.4Confident69.4Low14 Ų1450.7 Ų50.77%0.06527%0.274CS..Hα-helixtrans-62.3-42.3177.5-175.672.2000111.8F111 I161 S183 T190 F265F111-H186 AromaticContact CE1-CE1 3.97Å; F111-H186 AromaticContact CZ-CE1 3.87Å; F111-H186 AromaticContact CZ-ND1 3.73Å; I161-H186 HydrophobicContact CD1-CB 3.93Å; I161-H186 HydrophobicContact CG1-CB 4.07Å; I161-H186 HydrophobicContact CG2-CB 4.06Å; S183-H186 WeakPolarHBondContact O-CB 3.39Å; S183-H186 PolarHBondContact O-N 3.06Å; S183-H186 VanDerWaalsContact O-N 3.07Å; S183-H186 PolarHBondContact OG-N 3.21Å; H186-T190 PolarHBondContact NE2-OG1 2.87Å; H186-T190 WeakPolarHBondContact O-CB 3.23Å; H186-T190 PolarHBondContact O-N 3.41Å; H186-T190 PolarHBondContact O-OG1 3.22Å; H186-F265 AromaticContact CD2-CE1 3.79Å; H186-F265 AromaticContact CD2-CZ 3.81Å
187M73.3Confident70.9Confident82 Ų8251 Ų5140%0.40428%0.277SS..Hα-helixtrans-62-50.6177-70.9-168-6800112.1S183 S184 I185 Y189 T190 L191 F265S183-M187 PolarHBondContact O-N 2.91Å; S184-M187 PolarHBondContact O-N 2.89Å; I185-M187 VanDerWaalsContact C-N 3.34Å; I185-M187 PolarHBondContact O-N 3.43Å; M187-Y189 VanDerWaalsContact C-N 3.35Å; M187-Y189 PolarHBondContact O-N 2.93Å; M187-T190 PolarHBondContact O-N 3.46Å; M187-L191 VanDerWaalsContact O-CB 3.3Å; M187-L191 WeakPolarHBondContact O-CB 3.37Å; M187-L191 PolarHBondContact O-N 3.46Å; M187-F265 HydrophobicContact CG-CE1 4.08Å
188I81.8Confident72.3Confident104 Ų10453.9 Ų53.953%0.53329%0.294SS..Hα-helixtrans-61-46.7179.6-68165.3000110S184 I185 L191 I192S184-I188 WeakPolarHBondContact O-CB 3.45Å; S184-I188 VanDerWaalsContact O-CG1 3.25Å; S184-I188 WeakPolarHBondContact O-CG1 3.36Å; S184-I188 PolarHBondContact O-N 3.44Å; I185-I188 PolarHBondContact O-N 3.37Å; I188-L191 PolarHBondContact O-N 3.2Å; I188-I192 HydrophobicContact CG2-CD1 3.87Å; I188-I192 VanDerWaalsContact O-CG1 3.28Å; I188-I192 WeakPolarHBondContact O-CG1 3.38Å; I188-I192 PolarHBondContact O-N 3.37Å
189Y82Confident73.8Confident11 Ų1151.9 Ų51.94%0.04329%0.29CS..Hα-helixtrans-65-43.4-178.7-167.5-119.6000112.1F111 W115 L153 D154 M157 I185 M187 L191 I192 I193F111-Y189 HydrophobicContact CD1-CD1 4.19Å; F111-Y189 HydrophobicContact CD1-CE1 4.06Å; F111-Y189 HydrophobicContact CD2-CD1 4.49Å; F111-Y189 HydrophobicContact CD2-CE1 4.02Å; F111-Y189 AromaticContact CE1-CD1 3.73Å; F111-Y189 HydrophobicContact CE1-CD1 3.73Å; F111-Y189 HydrophobicContact CE1-CE1 4.04Å; F111-Y189 HydrophobicContact CE2-CD1 4.05Å; F111-Y189 AromaticContact CE2-CE1 3.99Å; F111-Y189 HydrophobicContact CE2-CE1 3.99Å; F111-Y189 HydrophobicContact CG-CE1 4.06Å; F111-Y189 AromaticContact CZ-CD1 3.65Å; F111-Y189 HydrophobicContact CZ-CD1 3.65Å; F111-Y189 HydrophobicContact CZ-CE1 4Å; W115-Y189 PolarHBondContact NE1-OH 3.42Å; L153-Y189 HydrophobicContact CD2-CE2 4.5Å; D154-Y189 PolarHBondContact OD1-OH 3Å; M157-Y189 HydrophobicContact CB-CD1 4.21Å; M157-Y189 HydrophobicContact CB-CE1 4.03Å; M157-Y189 HydrophobicContact CB-CE2 4.4Å; M157-Y189 HydrophobicContact CB-CG 4.46Å; M157-Y189 HydrophobicContact CE-CD2 3.54Å; M157-Y189 HydrophobicContact CE-CE2 4.2Å; M157-Y189 HydrophobicContact CE-CG 3.78Å; M157-Y189 HydrophobicContact CG-CD2 4.02Å; M157-Y189 HydrophobicContact CG-CE1 4.25Å; M157-Y189 HydrophobicContact CG-CE2 3.73Å; M157-Y189 HydrophobicContact CG-CG 4.4Å; M157-Y189 HydrophobicContact SD-CD2 4.48Å; I185-Y189 WeakPolarHBondContact O-CB 3.37Å; I185-Y189 PolarHBondContact O-N 3.27Å; M187-Y189 VanDerWaalsContact C-N 3.35Å; M187-Y189 PolarHBondContact O-N 2.93Å; Y189-L191 VanDerWaalsContact C-N 3.35Å; Y189-L191 PolarHBondContact O-N 3.04Å; Y189-I192 PolarHBondContact O-N 2.91Å; Y189-I193 HydrophobicContact CD1-CD1 3.9Å; Y189-I193 HydrophobicContact CE1-CD1 3.68Å; Y189-I193 WeakPolarHBondContact O-CG1 3.44Å; Y189-I193 PolarHBondContact O-N 3.45Å
190T77.2Confident75.1Confident8 Ų852.3 Ų52.35%0.04930%0.295CS..Hα-helixtrans-62.7-42.5175.7-62.20000111.3H186 M187 I193 I194 R262H186-T190 PolarHBondContact NE2-OG1 2.87Å; H186-T190 WeakPolarHBondContact O-CB 3.23Å; H186-T190 PolarHBondContact O-N 3.41Å; H186-T190 PolarHBondContact O-OG1 3.22Å; M187-T190 PolarHBondContact O-N 3.46Å; T190-I193 PolarHBondContact O-N 2.91Å; T190-I194 HydrophobicContact CG2-CD1 4.24Å; T190-I194 WeakPolarHBondContact O-CG1 3.43Å; T190-I194 PolarHBondContact O-N 2.88Å; T190-R262 HydrophobicContact CG2-CB 4.48Å; T190-R262 HydrophobicContact CG2-CG 4.15Å
191L80.1Confident76Confident86 Ų8653.4 Ų53.445%0.4531%0.307SS..Hα-helixtrans-60.5-45.7176-177.865.7000111.6M187 I188 Y189 I193 I194 L195M187-L191 VanDerWaalsContact O-CB 3.3Å; M187-L191 WeakPolarHBondContact O-CB 3.37Å; M187-L191 PolarHBondContact O-N 3.46Å; I188-L191 PolarHBondContact O-N 3.2Å; Y189-L191 VanDerWaalsContact C-N 3.35Å; Y189-L191 PolarHBondContact O-N 3.04Å; L191-I193 VanDerWaalsContact C-N 3.29Å; L191-I193 PolarHBondContact O-N 3.32Å; L191-I194 PolarHBondContact O-N 3.47Å; L191-I194 VanDerWaalsContact O-N 3.13Å; L191-L195 HydrophobicContact CD1-CG 4.45Å; L191-L195 HydrophobicContact CG-CD1 4.15Å; L191-L195 HydrophobicContact CG-CG 4.47Å; L191-L195 WeakPolarHBondContact O-CG 3.4Å; L191-L195 PolarHBondContact O-N 2.65Å
192I84.4Confident77.4Confident79 Ų7955 Ų5541%0.40532%0.317SS..Hα-helixtrans-56-45.7174.8-70.1165000110.4I188 Y189 I194 L195 L196I188-I192 HydrophobicContact CG2-CD1 3.87Å; I188-I192 VanDerWaalsContact O-CG1 3.28Å; I188-I192 WeakPolarHBondContact O-CG1 3.38Å; I188-I192 PolarHBondContact O-N 3.37Å; Y189-I192 PolarHBondContact O-N 2.91Å; I192-I194 PolarHBondContact O-N 3.13Å; I192-L195 PolarHBondContact O-N 2.87Å; I192-L196 HydrophobicContact CG2-CD1 3.85Å; I192-L196 HydrophobicContact CG2-CG 4.36Å; I192-L196 WeakPolarHBondContact O-CB 3.36Å; I192-L196 VanDerWaalsContact O-CG 3.3Å; I192-L196 WeakPolarHBondContact O-CG 3.2Å; I192-L196 PolarHBondContact O-N 3.44Å
193I80.6Confident78.5Confident2 Ų254.3 Ų54.31%0.0131%0.308CS..Hα-helixtrans-63.2-41.9177.9-63.8166.4000111.2F111 W115 Y189 T190 L191 L196 L197F111-I193 HydrophobicContact CD1-CD1 3.6Å; F111-I193 HydrophobicContact CE1-CD1 4.14Å; F111-I193 HydrophobicContact CG-CD1 4.32Å; W115-I193 HydrophobicContact CZ2-CG1 3.96Å; Y189-I193 HydrophobicContact CD1-CD1 3.9Å; Y189-I193 HydrophobicContact CE1-CD1 3.68Å; Y189-I193 WeakPolarHBondContact O-CG1 3.44Å; Y189-I193 PolarHBondContact O-N 3.45Å; T190-I193 PolarHBondContact O-N 2.91Å; L191-I193 VanDerWaalsContact C-N 3.29Å; L191-I193 PolarHBondContact O-N 3.32Å; I193-L196 PolarHBondContact O-N 2.71Å; I193-L197 HydrophobicContact CG2-CD1 3.97Å; I193-L197 HydrophobicContact CG2-CG 4.37Å; I193-L197 WeakPolarHBondContact O-CB 3.43Å; I193-L197 VanDerWaalsContact O-CG 3.28Å; I193-L197 WeakPolarHBondContact O-CG 3.31Å; I193-L197 PolarHBondContact O-N 2.86Å
194I77.9Confident79Confident40 Ų4055 Ų5521%0.20531%0.312CS..Hα-helixtrans-60.1-48.9176-66.1172.1000110.3T190 L191 I192 L196 L197 L198 R262T190-I194 HydrophobicContact CG2-CD1 4.24Å; T190-I194 WeakPolarHBondContact O-CG1 3.43Å; T190-I194 PolarHBondContact O-N 2.88Å; L191-I194 PolarHBondContact O-N 3.47Å; L191-I194 VanDerWaalsContact O-N 3.13Å; I192-I194 PolarHBondContact O-N 3.13Å; I194-L196 VanDerWaalsContact C-N 3.34Å; I194-L196 PolarHBondContact O-N 2.92Å; I194-L197 WeakPolarHBondContact O-CB 3.3Å; I194-L197 PolarHBondContact O-N 2.86Å; I194-L198 HydrophobicContact CG2-CD1 3.99Å; I194-L198 HydrophobicContact CG2-CG 4.37Å; I194-L198 WeakPolarHBondContact O-CG 3.48Å; I194-L198 PolarHBondContact O-N 3.1Å; I194-R262 HydrophobicContact CD1-CB 4.48Å
195L83.5Confident79.2Confident100 Ų10056.3 Ų56.352%0.52431%0.313SS..Hα-helixtrans-62-42.2-179.4-69.2173.7000111.6L191 I192 L198 A199L191-L195 HydrophobicContact CD1-CG 4.45Å; L191-L195 HydrophobicContact CG-CD1 4.15Å; L191-L195 HydrophobicContact CG-CG 4.47Å; L191-L195 WeakPolarHBondContact O-CG 3.4Å; L191-L195 PolarHBondContact O-N 2.65Å; I192-L195 PolarHBondContact O-N 2.87Å; L195-L198 PolarHBondContact O-N 2.9Å; L195-A199 VanDerWaalsContact O-CB 3.31Å; L195-A199 WeakPolarHBondContact O-CB 3.44Å; L195-A199 PolarHBondContact O-N 2.97Å
196L80Confident79.4Confident78 Ų7857.5 Ų57.541%0.40832%0.323SS..Hα-helixtrans-64.3-40.2175.2-73.2172.9000112.2W115 I192 I193 I194 A199 A200W115-L196 HydrophobicContact CH2-CD1 3.59Å; W115-L196 HydrophobicContact CZ3-CD1 3.87Å; I192-L196 HydrophobicContact CG2-CD1 3.85Å; I192-L196 HydrophobicContact CG2-CG 4.36Å; I192-L196 WeakPolarHBondContact O-CB 3.36Å; I192-L196 VanDerWaalsContact O-CG 3.3Å; I192-L196 WeakPolarHBondContact O-CG 3.2Å; I192-L196 PolarHBondContact O-N 3.44Å; I193-L196 PolarHBondContact O-N 2.71Å; I194-L196 VanDerWaalsContact C-N 3.34Å; I194-L196 PolarHBondContact O-N 2.92Å; L196-A199 PolarHBondContact O-N 3.17Å; L196-A200 VanDerWaalsContact O-CB 3.25Å; L196-A200 WeakPolarHBondContact O-CB 3.41Å; L196-A200 PolarHBondContact O-N 3Å
197L81.1Confident79.7Confident41 Ų4159 Ų5922%0.21533%0.331CS..Hα-helixtrans-62.9-44.9175-80.4170.5000111.9S114 V117 A118 I193 I194 A200 G201S114-L197 WeakPolarHBondContact O-CD2 3.38Å; V117-L197 HydrophobicContact CB-CD2 3.89Å; V117-L197 HydrophobicContact CG1-CD2 3.73Å; A118-L197 HydrophobicContact CB-CD2 3.86Å; I193-L197 HydrophobicContact CG2-CD1 3.97Å; I193-L197 HydrophobicContact CG2-CG 4.37Å; I193-L197 WeakPolarHBondContact O-CB 3.43Å; I193-L197 VanDerWaalsContact O-CG 3.28Å; I193-L197 WeakPolarHBondContact O-CG 3.31Å; I193-L197 PolarHBondContact O-N 2.86Å; I194-L197 WeakPolarHBondContact O-CB 3.3Å; I194-L197 PolarHBondContact O-N 2.86Å; L197-A200 PolarHBondContact O-N 2.92Å; L197-G201 PolarHBondContact O-N 3.24Å
198L80.5Confident79.9Confident100 Ų10059.8 Ų59.852%0.52433%0.33SS..Hα-helixtrans-62.9-47.9176-71.7173.7000110.9I194 L195 A200 G201 I202I194-L198 HydrophobicContact CG2-CD1 3.99Å; I194-L198 HydrophobicContact CG2-CG 4.37Å; I194-L198 WeakPolarHBondContact O-CG 3.48Å; I194-L198 PolarHBondContact O-N 3.1Å; L195-L198 PolarHBondContact O-N 2.9Å; L198-A200 VanDerWaalsContact C-N 3.35Å; L198-A200 PolarHBondContact O-N 3.2Å; L198-G201 PolarHBondContact O-N 2.95Å; L198-I202 WeakPolarHBondContact O-CB 3.33Å; L198-I202 VanDerWaalsContact O-CG1 3.23Å; L198-I202 WeakPolarHBondContact O-CG1 3.21Å; L198-I202 PolarHBondContact O-N 3.24Å
199A81.8Confident79.6Confident49 Ų4957.4 Ų57.441%0.40532%0.32SS..Hα-helixtrans-59.6-44.4177.700000111.8L195 L196 S203L195-A199 VanDerWaalsContact O-CB 3.31Å; L195-A199 WeakPolarHBondContact O-CB 3.44Å; L195-A199 PolarHBondContact O-N 2.97Å; L196-A199 PolarHBondContact O-N 3.17Å; A199-S203 VanDerWaalsContact O-CB 3.23Å; A199-S203 WeakPolarHBondContact O-CB 3.35Å; A199-S203 PolarHBondContact O-N 3.35Å; A199-S203 PolarHBondContact O-OG 3.37Å
200A75.9Confident79.5Confident17 Ų1762.6 Ų62.614%0.1434%0.343CS..Hα-helixtrans-65.1-43.5176.500000111.6A121 L196 L197 L198 S203 V204A121-A200 HydrophobicContact CB-CB 3.76Å; L196-A200 VanDerWaalsContact O-CB 3.25Å; L196-A200 WeakPolarHBondContact O-CB 3.41Å; L196-A200 PolarHBondContact O-N 3Å; L197-A200 PolarHBondContact O-N 2.92Å; L198-A200 VanDerWaalsContact C-N 3.35Å; L198-A200 PolarHBondContact O-N 3.2Å; A200-S203 PolarHBondContact O-N 3.14Å; A200-V204 VanDerWaalsContact O-CG2 3.28Å; A200-V204 WeakPolarHBondContact O-CG2 3.49Å; A200-V204 PolarHBondContact O-N 2.96Å
201G74.8Confident79.3Confident28 Ų2864.4 Ų64.429%0.28935%0.349SS..Hα-helixtrans-61.8-49.1177.200000112.8L197 L198 S203 V204 L205L197-G201 PolarHBondContact O-N 3.24Å; L198-G201 PolarHBondContact O-N 2.95Å; G201-S203 VanDerWaalsContact C-N 3.34Å; G201-S203 PolarHBondContact O-N 3.41Å; G201-V204 PolarHBondContact O-N 3.22Å; G201-L205 WeakPolarHBondContact O-CG 3.37Å; G201-L205 PolarHBondContact O-N 3.44Å
202I83.2Confident78.9Confident104 Ų10463.6 Ų63.653%0.53334%0.34SS..Hα-helixtrans-61-44.9176.3-66.8165.7000110L198 V204 L205 T206L198-I202 WeakPolarHBondContact O-CB 3.33Å; L198-I202 VanDerWaalsContact O-CG1 3.23Å; L198-I202 WeakPolarHBondContact O-CG1 3.21Å; L198-I202 PolarHBondContact O-N 3.24Å; I202-V204 VanDerWaalsContact C-N 3.35Å; I202-V204 PolarHBondContact O-N 2.86Å; I202-L205 PolarHBondContact O-N 3.46Å; I202-T206 WeakPolarHBondContact O-CB 3.33Å; I202-T206 PolarHBondContact O-N 2.72Å; I202-T206 PolarHBondContact O-OG1 2.97Å
203S79.1Confident78.6Confident56 Ų5668.5 Ų68.539%0.39235%0.353SS..Hα-helixtrans-58.8-44.9178.2-63.30000112.1A199 A200 G201 L205 T206 L207A199-S203 VanDerWaalsContact O-CB 3.23Å; A199-S203 WeakPolarHBondContact O-CB 3.35Å; A199-S203 PolarHBondContact O-N 3.35Å; A199-S203 PolarHBondContact O-OG 3.37Å; A200-S203 PolarHBondContact O-N 3.14Å; G201-S203 VanDerWaalsContact C-N 3.34Å; G201-S203 PolarHBondContact O-N 3.41Å; S203-L205 PolarHBondContact O-N 3.49Å; S203-T206 PolarHBondContact O-N 3.33Å; S203-L207 VanDerWaalsContact O-CB 3.3Å; S203-L207 WeakPolarHBondContact O-CB 3.23Å; S203-L207 VanDerWaalsContact O-CG 3.27Å; S203-L207 WeakPolarHBondContact O-CG 3.33Å; S203-L207 PolarHBondContact O-N 2.95Å
204V77.5Confident78.3Confident24 Ų2472.6 Ų72.615%0.14537%0.372CS..Hα-helixtrans-60.1-45.8175.9170.90000111.3A121 R124 A125 Y128 A200 G201 I202 R208A121-V204 HydrophobicContact CB-CG2 4Å; A121-V204 WeakPolarHBondContact O-CG2 3.41Å; R124-V204 HydrophobicContact CB-CG1 4.28Å; R124-V204 HydrophobicContact CB-CG2 4.09Å; A125-V204 HydrophobicContact CB-CG2 3.84Å; Y128-V204 HydrophobicContact CD2-CG1 4.06Å; Y128-V204 HydrophobicContact CE2-CG1 3.86Å; A200-V204 VanDerWaalsContact O-CG2 3.28Å; A200-V204 WeakPolarHBondContact O-CG2 3.49Å; A200-V204 PolarHBondContact O-N 2.96Å; G201-V204 PolarHBondContact O-N 3.22Å; I202-V204 VanDerWaalsContact C-N 3.35Å; I202-V204 PolarHBondContact O-N 2.86Å; V204-R208 WeakPolarHBondContact O-CB 3.28Å; V204-R208 PolarHBondContact O-N 3.2Å
205L77.3Confident78.1Confident100 Ų10075.2 Ų75.252%0.52439%0.385SS..Hα-helixtrans-63-49.8179.5-71.6171.2000111.1G201 I202 S203 L207 R208 V209G201-L205 WeakPolarHBondContact O-CG 3.37Å; G201-L205 PolarHBondContact O-N 3.44Å; I202-L205 PolarHBondContact O-N 3.46Å; S203-L205 PolarHBondContact O-N 3.49Å; L205-L207 PolarHBondContact O-N 2.77Å; L205-R208 PolarHBondContact O-N 3.06Å; L205-V209 VanDerWaalsContact O-CG2 3.3Å; L205-V209 WeakPolarHBondContact O-CG2 3.35Å; L205-V209 PolarHBondContact O-N 3.32Å
206T81.3Confident77.5Confident85 Ų8573.8 Ų73.852%0.52138%0.377SS..Hα-helixtrans-60.5-47.7179.7-59.10000111.5I202 S203 R208 V209 K210I202-T206 WeakPolarHBondContact O-CB 3.33Å; I202-T206 PolarHBondContact O-N 2.72Å; I202-T206 PolarHBondContact O-OG1 2.97Å; S203-T206 PolarHBondContact O-N 3.33Å; T206-R208 PolarHBondContact O-N 3.33Å; T206-V209 PolarHBondContact O-N 3.31Å; T206-K210 WeakPolarHBondContact O-CB 3.19Å; T206-K210 PolarHBondContact O-N 2.91Å
207L79.7Confident77.3Confident44 Ų4472.7 Ų72.723%0.2338%0.38CS..Hα-helixtrans-66.8-37.9179.1-71.5169.9000112.2A125 S203 L205 K210 R211A125-L207 HydrophobicContact CB-CD1 3.82Å; A125-L207 WeakPolarHBondContact O-CD1 3.46Å; S203-L207 VanDerWaalsContact O-CB 3.3Å; S203-L207 WeakPolarHBondContact O-CB 3.23Å; S203-L207 VanDerWaalsContact O-CG 3.27Å; S203-L207 WeakPolarHBondContact O-CG 3.33Å; S203-L207 PolarHBondContact O-N 2.95Å; L205-L207 PolarHBondContact O-N 2.77Å; L207-K210 PolarHBondContact O-N 2.83Å; L207-R211 WeakPolarHBondContact O-CB 3.45Å; L207-R211 PolarHBondContact O-N 3.11Å
208R77.5Confident76.8Confident99 Ų9975.9 Ų75.937%0.37440%0.397SS..Hα-helixtrans-63.4-43.7174.4-176.4-178.7-179.4-168.5-0.6111.5Y128 V204 L205 T206 R212Y128-R208 HydrophobicContact CD1-CB 4.49Å; Y128-R208 HydrophobicContact CD2-CB 3.94Å; Y128-R208 HydrophobicContact CE1-CG 4.27Å; Y128-R208 HydrophobicContact CE2-CB 4.05Å; Y128-R208 HydrophobicContact CE2-CG 4.27Å; Y128-R208 HydrophobicContact CG-CB 4.19Å; V204-R208 WeakPolarHBondContact O-CB 3.28Å; V204-R208 PolarHBondContact O-N 3.2Å; L205-R208 PolarHBondContact O-N 3.06Å; T206-R208 PolarHBondContact O-N 3.33Å; R208-R212 VanDerWaalsContact O-CB 3.24Å; R208-R212 WeakPolarHBondContact O-CB 3.44Å; R208-R212 PolarHBondContact O-N 3.39Å
209V75.6Confident75.9Confident55 Ų5577.2 Ų77.233%0.33340%0.402SS..Hα-helixtrans-63.3-45.1175.5171.10000110.2L205 T206 R212 R213L205-V209 VanDerWaalsContact O-CG2 3.3Å; L205-V209 WeakPolarHBondContact O-CG2 3.35Å; L205-V209 PolarHBondContact O-N 3.32Å; T206-V209 PolarHBondContact O-N 3.31Å; V209-R212 PolarHBondContact O-N 2.92Å; V209-R213 WeakPolarHBondContact O-CG 3.28Å; V209-R213 PolarHBondContact O-N 3.32Å
210K79.9Confident74.7Confident120 Ų12080.6 Ų80.652%0.52241%0.413SS..Hα-helixtrans-59.3-51.9176.6-174.5179.4179.31800111.9T206 L207 R212 R213 Q214T206-K210 WeakPolarHBondContact O-CB 3.19Å; T206-K210 PolarHBondContact O-N 2.91Å; L207-K210 PolarHBondContact O-N 2.83Å; K210-R212 VanDerWaalsContact C-N 3.27Å; K210-R212 PolarHBondContact O-N 2.67Å; K210-R213 WeakPolarHBondContact O-CB 3.14Å; K210-R213 PolarHBondContact O-N 2.95Å; K210-R213 VanDerWaalsContact O-N 3.11Å; K210-Q214 WeakPolarHBondContact O-CG 3.31Å; K210-Q214 PolarHBondContact O-N 2.8Å
211R74Confident73.6Confident46 Ų4685.5 Ų85.517%0.17444%0.436CS..Hα-helixtrans-58.8-40.5177.8-173.7175.7-176-173.7-5.7111.6H127 Y128 L207 Q214 M215H127-R211 PolarHBondContact CD2-NH1 3.33Å; H127-R211 PolarHBondContact NE2-NH1 3.26Å; H127-R211 PolarHBondContact O-NH1 3.36Å; Y128-R211 WeakPolarHBondContact O-CD 3.17Å; L207-R211 WeakPolarHBondContact O-CB 3.45Å; L207-R211 PolarHBondContact O-N 3.11Å; R211-Q214 PolarHBondContact O-N 3.26Å; R211-M215 HydrophobicContact CG-CE 3.84Å; R211-M215 HydrophobicContact CG-SD 4.49Å; R211-M215 VanDerWaalsContact NE-CE 3.33Å; R211-M215 WeakPolarHBondContact O-CG 3.39Å; R211-M215 PolarHBondContact O-N 3.09Å
212R70.9Confident72.2Confident69 Ų6989.8 Ų89.826%0.2646%0.459SS..Hα-helixtrans-65.3-42176.1-176.6176.7174.8-177.2-4.3112.1R208 V209 K210 Q214 M215 L216 P238R208-R212 VanDerWaalsContact O-CB 3.24Å; R208-R212 WeakPolarHBondContact O-CB 3.44Å; R208-R212 PolarHBondContact O-N 3.39Å; V209-R212 PolarHBondContact O-N 2.92Å; K210-R212 VanDerWaalsContact C-N 3.27Å; K210-R212 PolarHBondContact O-N 2.67Å; R212-Q214 VanDerWaalsContact C-N 3.33Å; R212-M215 PolarHBondContact O-N 3.03Å; R212-L216 HydrophobicContact CG-CD1 4.24Å; R212-L216 VanDerWaalsContact O-CG 3.3Å; R212-L216 WeakPolarHBondContact O-CG 3.39Å; R212-L216 PolarHBondContact O-N 2.98Å; R212-P238 PolarHBondContact NH2-O 2.88Å
213R77.9Confident70.5Confident182 Ų18294 Ų9469%0.68747%0.473SS*.Hα-helixtrans-62.1-41.8174.4-73.7178.7-178.1-177.50.9111.2V209 K210 L216 A217V209-R213 WeakPolarHBondContact O-CG 3.28Å; V209-R213 PolarHBondContact O-N 3.32Å; K210-R213 WeakPolarHBondContact O-CB 3.14Å; K210-R213 PolarHBondContact O-N 2.95Å; K210-R213 VanDerWaalsContact O-N 3.11Å; R213-L216 PolarHBondContact O-N 3.41Å; R213-A217 WeakPolarHBondContact O-CB 3.42Å; R213-A217 PolarHBondContact O-N 3.26Å
214Q75.7Confident68.6Low87 Ų8796.9 Ų96.941%0.40749%0.491SS..Hα-helixtrans-61.1-49.7174.5-71.9173-32.900111.5K210 R211 R212 L216 A217 D218K210-Q214 WeakPolarHBondContact O-CG 3.31Å; K210-Q214 PolarHBondContact O-N 2.8Å; R211-Q214 PolarHBondContact O-N 3.26Å; R212-Q214 VanDerWaalsContact C-N 3.33Å; Q214-L216 VanDerWaalsContact C-N 3.28Å; Q214-L216 PolarHBondContact O-N 2.93Å; Q214-A217 WeakPolarHBondContact O-CB 3.42Å; Q214-A217 PolarHBondContact O-N 3.47Å; Q214-A217 VanDerWaalsContact O-N 3.08Å; Q214-D218 VanDerWaalsContact O-CG 3.24Å; Q214-D218 PolarHBondContact O-N 2.8Å
215M72.1Confident66.9Low96 Ų96101 Ų10147%0.47352%0.521SS..Hα-helixtrans-58.1-38.6176.3-72.9174.1178.400113R211 R212 M219R211-M215 HydrophobicContact CG-CE 3.84Å; R211-M215 HydrophobicContact CG-SD 4.49Å; R211-M215 VanDerWaalsContact NE-CE 3.33Å; R211-M215 WeakPolarHBondContact O-CG 3.39Å; R211-M215 PolarHBondContact O-N 3.09Å; R212-M215 PolarHBondContact O-N 3.03Å; M215-M219 VanDerWaalsContact O-CG 3.32Å; M215-M219 WeakPolarHBondContact O-CG 3.3Å; M215-M219 PolarHBondContact O-N 3.42Å; M215-M219 VanDerWaalsContact O-N 3.09Å
216L72.3Confident65.2Low69 Ų69101.1 Ų101.136%0.36153%0.53SS..Hα-helixtrans-70-38.4176.2-70.9169000111.9R212 R213 Q214 M219 N220R212-L216 HydrophobicContact CG-CD1 4.24Å; R212-L216 VanDerWaalsContact O-CG 3.3Å; R212-L216 WeakPolarHBondContact O-CG 3.39Å; R212-L216 PolarHBondContact O-N 2.98Å; R213-L216 PolarHBondContact O-N 3.41Å; Q214-L216 VanDerWaalsContact C-N 3.28Å; Q214-L216 PolarHBondContact O-N 2.93Å; L216-M219 PolarHBondContact O-N 3.05Å; L216-N220 PolarHBondContact O-N 3.41Å; L216-N220 PolarHBondContact O-ND2 3.36Å
217A76.1Confident63.3Low56 Ų56105 Ų10546%0.46355%0.547SS..Hα-helixtrans-64.4-4117400000111.5R213 Q214 M219 N220 L221R213-A217 WeakPolarHBondContact O-CB 3.42Å; R213-A217 PolarHBondContact O-N 3.26Å; Q214-A217 WeakPolarHBondContact O-CB 3.42Å; Q214-A217 PolarHBondContact O-N 3.47Å; Q214-A217 VanDerWaalsContact O-N 3.08Å; A217-M219 VanDerWaalsContact C-N 3.31Å; A217-M219 PolarHBondContact O-N 2.85Å; A217-N220 PolarHBondContact O-N 3.27Å; A217-N220 VanDerWaalsContact O-N 3.14Å; A217-L221 PolarHBondContact O-N 3Å
218D69.4Low61.5Low108 Ų108106 Ų10658%0.57856%0.559SS**Hα-helixtrans-65.2-33.3176.8-65-21.7000112.3Q214 N220 L221Q214-D218 VanDerWaalsContact O-CG 3.24Å; Q214-D218 PolarHBondContact O-N 2.8Å; D218-N220 VanDerWaalsContact C-N 3.32Å; D218-L221 PolarHBondContact O-N 2.94Å
219M62.5Low59.9Low128 Ų128105.7 Ų105.763%0.63158%0.577SS**Hα-helixtrans-71.4-25.3174.1-74.2-178.778.600113.3M215 L216 A217 L221M215-M219 VanDerWaalsContact O-CG 3.32Å; M215-M219 WeakPolarHBondContact O-CG 3.3Å; M215-M219 PolarHBondContact O-N 3.42Å; M215-M219 VanDerWaalsContact O-N 3.09Å; L216-M219 PolarHBondContact O-N 3.05Å; A217-M219 VanDerWaalsContact C-N 3.31Å; A217-M219 PolarHBondContact O-N 2.85Å; M219-L221 VanDerWaalsContact C-N 3.32Å
220N56.9Low58.3Low120 Ų120111.9 Ų111.964%0.64260%0.602SS**THydrogen-bonded Turntrans-85.4-1.4178.3-71.2-18.4000113.1L216 A217 D218 P222L216-N220 PolarHBondContact O-N 3.41Å; L216-N220 PolarHBondContact O-ND2 3.36Å; A217-N220 PolarHBondContact O-N 3.27Å; A217-N220 VanDerWaalsContact O-N 3.14Å; D218-N220 VanDerWaalsContact C-N 3.32Å; N220-P222 WeakPolarHBondContact O-CD 3.38Å
221L51Low56.4Low119 Ų119115.6 Ų115.662%0.62361%0.613SS**SBendtrans-65.7120.5167.5-92.1124.4000108.5A217 D218 M219 K223A217-L221 PolarHBondContact O-N 3Å; D218-L221 PolarHBondContact O-N 2.94Å; M219-L221 VanDerWaalsContact C-N 3.32Å; L221-K223 PolarHBondContact O-N 2.89Å
222P46.6Very low54.8Low118 Ų118119.2 Ų119.277%0.76664%0.635SS**  trans-59.4113.3178.622.7-30.3000108N220 P224N220-P222 WeakPolarHBondContact O-CD 3.38Å; P222-P224 WeakPolarHBondContact O-CD 3.35Å
223K47.2Very low53.3Low192 Ų192122.3 Ų122.384%0.83566%0.661SS**  trans-55.9124.3163.7-83.5-176.2176.4178.90106.5L221 S225L221-K223 PolarHBondContact O-N 2.89Å; K223-S225 PolarHBondContact O-N 3.02Å
224P39.2Very low51.3Low117 Ų117120.6 Ų120.676%0.7667%0.666SS**SBendtrans-65.6127.2172.528.4-29.5000106.6P222P222-P224 WeakPolarHBondContact O-CD 3.35Å
225S41.7Very low49.5Very low110 Ų110122.6 Ų122.677%0.76968%0.675SS**SBendtrans83.6138166.580.20000119.6K223K223-S225 PolarHBondContact O-N 3.02Å
226S40.9Very low47.9Very low103 Ų103122.8 Ų122.872%0.7269%0.686SS**  trans84.289.8171.975.50000118.3
227N41.8Very low46.3Very low166 Ų166126 Ų12689%0.88870%0.702SS**  trans4285.9130.6-62.6-3.5000117.4
228S42.6Very low44.7Very low67 Ų67126.3 Ų126.347%0.46970%0.699SS.*  trans-177.773.5140.444.90000110.8E230 R231S228-E230 PolarHBondContact O-N 2.69Å; S228-E230 VanDerWaalsContact O-N 3.11Å; S228-R231 PolarHBondContact O-N 3.48Å
229A43.6Very low43.4Very low92 Ų92122.9 Ų122.976%0.7669%0.686SS**THydrogen-bonded Turntrans-61.5-12.7170.700000112.9
230E41.7Very low42.5Very low184 Ų184121.5 Ų121.586%0.8668%0.681SS**THydrogen-bonded Turntrans-88.5-5.7176.4-71.8179.2151.500114.7S228S228-E230 PolarHBondContact O-N 2.69Å; S228-E230 VanDerWaalsContact O-N 3.11Å
231R41.3Very low41.7Very low199 Ų199119.7 Ų119.775%0.75167%0.67SS**SBendtrans-97.7-2.4178.5-90-175.9173.6170.1-0.1115.3S228S228-R231 PolarHBondContact O-N 3.48Å
232L39.3Very low41.4Very low122 Ų122122.2 Ų122.264%0.63968%0.676SS**SBendtrans-91.7-12.4-176.6-90.3141.6000114.2
233V40.3Very low41.5Very low133 Ų133123.4 Ų123.481%0.80667%0.669SS**SBendtrans-88.7-15-177.9-177.70000113
234D35.5Very low41.9Very low146 Ų146119.2 Ų119.278%0.78165%0.651SS**  trans-99.46.9179.9-94.8-22.4000115.3S236D234-S236 PolarHBondContact O-N 2.82Å
235Q36.6Very low42.7Very low129 Ų129118 Ų11860%0.60364%0.643SS**  trans-79.370.6175-76-168.7-3.900111.4I237Q235-I237 PolarHBondContact O-N 2.87Å
236S39.4Very low43.5Very low101 Ų101118.6 Ų118.671%0.70664%0.635SS**  trans-45.6125.2163.555.70000110.1D234 P238D234-S236 PolarHBondContact O-N 2.82Å; S236-P238 WeakPolarHBondContact O-CD 3.24Å; S236-P238 VanDerWaalsContact O-N 3.08Å
237I39.2Very low44.5Very low137 Ų137117.3 Ų117.370%0.70362%0.62SS**  trans-38.6119171.9-61164.1000107.8Q235 A239Q235-I237 PolarHBondContact O-N 2.87Å; I237-A239 PolarHBondContact O-N 3.47Å
238P42.5Very low45.1Very low61 Ų61115.2 Ų115.240%0.39661%0.606SS.*  trans-70.493.2177.424.4-29000107R212 S236 N240R212-P238 PolarHBondContact NH2-O 2.88Å; S236-P238 WeakPolarHBondContact O-CD 3.24Å; S236-P238 VanDerWaalsContact O-N 3.08Å; P238-N240 PolarHBondContact O-N 3.31Å
239A41.1Very low46.1Very low36 Ų36114.7 Ų114.730%0.29861%0.606SS.*  trans-67.241.9179.100000111.8I237 M241 F242 K243I237-A239 PolarHBondContact O-N 3.47Å; A239-M241 PolarHBondContact O-N 3.31Å; A239-M241 VanDerWaalsContact O-N 3.07Å; A239-F242 HydrophobicContact CB-CB 4.31Å; A239-F242 CarbonylContact O-C 3.54Å; A239-F242 WeakPolarHBondContact O-CA 3.31Å; A239-F242 PolarHBondContact O-N 3.4Å; A239-K243 PolarHBondContact O-N 2.93Å
240N44.6Very low47.1Very low100 Ų100111.3 Ų111.354%0.53558%0.575SS.*THydrogen-bonded Turntrans-65.1-16-171.3-93.3-9.5000114.4P238 K243P238-N240 PolarHBondContact O-N 3.31Å; N240-K243 WeakPolarHBondContact OD1-CD 3.47Å
241M39.7Very low48.2Very low82 Ų82104 Ų10440%0.40455%0.549SS..THydrogen-bonded Turntrans-76.9-31.5167.8-76.6-165.3-69.200112.3A239A239-M241 PolarHBondContact O-N 3.31Å; A239-M241 VanDerWaalsContact O-N 3.07Å
242F45.2Very low49.4Very low172 Ų17299.4 Ų99.475%0.75454%0.539SS*.THydrogen-bonded Turntrans-86-21.6172.1-67.1-76.5000113.4A239 K244 P245A239-F242 HydrophobicContact CB-CB 4.31Å; A239-F242 CarbonylContact O-C 3.54Å; A239-F242 WeakPolarHBondContact O-CA 3.31Å; A239-F242 PolarHBondContact O-N 3.4Å; F242-K244 PolarHBondContact O-N 2.73Å; F242-P245 WeakPolarHBondContact O-CD 3.39Å
243K48Very low50.8Low143 Ų14397.6 Ų97.662%0.62253%0.529SS*.SBendtrans-73.5-8.2177.3-71.9-176.1170.6-176.30114.1A239 N240A239-K243 PolarHBondContact O-N 2.93Å; N240-K243 WeakPolarHBondContact OD1-CD 3.47Å
244K56.2Low52.2Low103 Ų10392.7 Ų92.745%0.44850%0.498SS..  trans-131.264174.2-65.7-170.2179.9-177.10110.6F242 M246 L247F242-K244 PolarHBondContact O-N 2.73Å; K244-M246 PolarHBondContact O-N 3.49Å; K244-M246 VanDerWaalsContact O-N 3.14Å; K244-L247 HydrophobicContact CB-CB 4.14Å; K244-L247 PolarHBondContact O-N 3.43Å
245P56.4Low53.8Low91 Ų9189.9 Ų89.959%0.59149%0.486SS*.Hα-helixtrans-56.8-33-179.626.1-33.4000110.9F242 L247 M248 A249F242-P245 WeakPolarHBondContact O-CD 3.39Å; P245-L247 VanDerWaalsContact C-N 3.3Å; P245-L247 PolarHBondContact O-N 3.01Å; P245-M248 PolarHBondContact O-N 3.33Å; P245-M248 VanDerWaalsContact O-N 3.15Å; P245-A249 WeakPolarHBondContact O-CB 3.21Å; P245-A249 PolarHBondContact O-N 3.48Å
246M57.8Low55.3Low124 Ų12488.9 Ų88.961%0.61148%0.484SS*.Hα-helixtrans-57-37.7174.9-163.8-179.8-17400113.2K244 I250 Y294K244-M246 PolarHBondContact O-N 3.49Å; K244-M246 VanDerWaalsContact O-N 3.14Å; M246-I250 HydrophobicContact CG-CD1 4.03Å; M246-I250 WeakPolarHBondContact O-CB 3.36Å; M246-I250 WeakPolarHBondContact O-CD1 3.43Å; M246-I250 WeakPolarHBondContact O-CG1 3.19Å; M246-I250 PolarHBondContact O-N 3.44Å; M246-Y294 PolarHBondContact SD-OH 3.18Å
247L61.5Low56.8Low75 Ų7585.3 Ų85.339%0.39346%0.458SS..Hα-helixtrans-72.3-34.2179.9-157.691000111.7K244 P245 G251 Y294K244-L247 HydrophobicContact CB-CB 4.14Å; K244-L247 PolarHBondContact O-N 3.43Å; P245-L247 VanDerWaalsContact C-N 3.3Å; P245-L247 PolarHBondContact O-N 3.01Å; L247-G251 PolarHBondContact O-N 2.89Å; L247-Y294 HydrophobicContact CD1-CD1 3.7Å; L247-Y294 HydrophobicContact CD1-CD2 3.83Å; L247-Y294 HydrophobicContact CD1-CE1 3.86Å; L247-Y294 HydrophobicContact CD1-CE2 3.98Å; L247-Y294 HydrophobicContact CD1-CG 3.68Å
248M55.8Low58.1Low122 Ų12280.9 Ų80.960%0.60143%0.433SS*.Hα-helixtrans-72.1-42.2175.5-172.7167.4167.400110.8P245 G251 L252P245-M248 PolarHBondContact O-N 3.33Å; P245-M248 VanDerWaalsContact O-N 3.15Å; M248-G251 PolarHBondContact O-N 2.83Å; M248-L252 HydrophobicContact CG-CD1 4.43Å; M248-L252 WeakPolarHBondContact O-CG 3.21Å; M248-L252 PolarHBondContact O-N 2.89Å
249A61.8Low59.2Low56 Ų5680.4 Ų80.446%0.46343%0.429SS..Hα-helixtrans-60.1-45.517300000111.8P245 G251 L252 L253P245-A249 WeakPolarHBondContact O-CB 3.21Å; P245-A249 PolarHBondContact O-N 3.48Å; A249-G251 VanDerWaalsContact C-N 3.33Å; A249-G251 PolarHBondContact O-N 3.4Å; A249-L252 PolarHBondContact O-N 3.26Å; A249-L253 VanDerWaalsContact O-CB 3.28Å; A249-L253 WeakPolarHBondContact O-CB 3.28Å; A249-L253 PolarHBondContact O-N 2.91Å
250I66.1Low60.5Low22 Ų2281.5 Ų81.511%0.11343%0.43CS..Hα-helixtrans-59.6-44.9173.4-72.4162.8000110.7M246 L253 L254 I290 Y294M246-I250 HydrophobicContact CG-CD1 4.03Å; M246-I250 WeakPolarHBondContact O-CB 3.36Å; M246-I250 WeakPolarHBondContact O-CD1 3.43Å; M246-I250 WeakPolarHBondContact O-CG1 3.19Å; M246-I250 PolarHBondContact O-N 3.44Å; I250-L253 PolarHBondContact O-N 3.47Å; I250-L254 HydrophobicContact CG2-CD1 3.8Å; I250-L254 HydrophobicContact CG2-CG 4.31Å; I250-L254 WeakPolarHBondContact O-CB 3.3Å; I250-L254 WeakPolarHBondContact O-CG 3.32Å; I250-L254 PolarHBondContact O-N 3.46Å; I250-I290 HydrophobicContact CD1-CD1 3.98Å; I250-I290 HydrophobicContact CD1-CG1 4.42Å; I250-I290 HydrophobicContact CD1-CG2 4.28Å; I250-I290 HydrophobicContact CG1-CD1 4.04Å; I250-I290 HydrophobicContact CG2-CD1 3.7Å; I250-I290 HydrophobicContact CG2-CG2 4.03Å; I250-Y294 HydrophobicContact CD1-CE2 3.78Å
251G64.1Low61.5Low31 Ų3178.2 Ų78.232%0.3241%0.414SS..Hα-helixtrans-60.4-46.5177.800000112.5L247 M248 A249 L254 V255L247-G251 PolarHBondContact O-N 2.89Å; M248-G251 PolarHBondContact O-N 2.83Å; A249-G251 VanDerWaalsContact C-N 3.33Å; A249-G251 PolarHBondContact O-N 3.4Å; G251-L254 PolarHBondContact O-N 3.17Å; G251-V255 VanDerWaalsContact O-CG2 3.31Å; G251-V255 WeakPolarHBondContact O-CG2 3.19Å; G251-V255 PolarHBondContact O-N 3.31Å
252L65.6Low62.7Low101 Ų10175.9 Ų75.953%0.52940%0.401SS..Hα-helixtrans-63.5-45.1176.2-72.2171.1000111.8M248 A249 L254 V255 L256M248-L252 HydrophobicContact CG-CD1 4.43Å; M248-L252 WeakPolarHBondContact O-CG 3.21Å; M248-L252 PolarHBondContact O-N 2.89Å; A249-L252 PolarHBondContact O-N 3.26Å; L252-L254 VanDerWaalsContact C-N 3.33Å; L252-L254 PolarHBondContact O-N 2.91Å; L252-V255 PolarHBondContact O-N 2.94Å; L252-L256 WeakPolarHBondContact O-CB 3.49Å; L252-L256 WeakPolarHBondContact O-CG 3.21Å; L252-L256 PolarHBondContact O-N 3.42Å
253L69.3Low63.7Low85 Ų8571.1 Ų71.145%0.44539%0.386SS..Hα-helixtrans-59.7-43.9176179.662.7000111.2A249 I250 L256 L257A249-L253 VanDerWaalsContact O-CB 3.28Å; A249-L253 WeakPolarHBondContact O-CB 3.28Å; A249-L253 PolarHBondContact O-N 2.91Å; I250-L253 PolarHBondContact O-N 3.47Å; L253-L256 PolarHBondContact O-N 3.3Å; L253-L257 HydrophobicContact CD1-CD1 4.04Å; L253-L257 HydrophobicContact CD1-CG 4.13Å; L253-L257 HydrophobicContact CG-CD1 3.84Å; L253-L257 HydrophobicContact CG-CG 4.35Å; L253-L257 WeakPolarHBondContact O-CB 3.4Å; L253-L257 WeakPolarHBondContact O-CG 3.43Å; L253-L257 PolarHBondContact O-N 3.1Å
254L69.6Low64.4Low29 Ų2964.4 Ų64.415%0.15236%0.357CS..Hα-helixtrans-64.2-44.1176.5-72.7170.7000111.7I250 G251 L252 L256 L257 F258 I283 L287I250-L254 HydrophobicContact CG2-CD1 3.8Å; I250-L254 HydrophobicContact CG2-CG 4.31Å; I250-L254 WeakPolarHBondContact O-CB 3.3Å; I250-L254 WeakPolarHBondContact O-CG 3.32Å; I250-L254 PolarHBondContact O-N 3.46Å; G251-L254 PolarHBondContact O-N 3.17Å; L252-L254 VanDerWaalsContact C-N 3.33Å; L252-L254 PolarHBondContact O-N 2.91Å; L254-L256 VanDerWaalsContact C-N 3.34Å; L254-L256 PolarHBondContact O-N 3.43Å; L254-L257 PolarHBondContact O-N 3.37Å; L254-F258 WeakPolarHBondContact O-CB 3.18Å; L254-F258 WeakPolarHBondContact O-CD2 3.28Å; L254-F258 PolarHBondContact O-N 3.29Å; L254-I283 HydrophobicContact CD2-CG1 4.37Å; L254-I283 HydrophobicContact CD2-CG2 4.43Å; L254-L287 HydrophobicContact CD1-CD2 3.52Å; L254-L287 HydrophobicContact CD2-CD2 3.44Å; L254-L287 VanDerWaalsContact CD2-CD2 3.44Å; L254-L287 HydrophobicContact CD2-CG 3.95Å; L254-L287 HydrophobicContact CG-CD2 4.12Å
255V68.8Low64.6Low87 Ų8761.2 Ų61.253%0.52734%0.343SS..Hα-helixtrans-58.3-49.1175.4170.20000110.1G251 L252 L257 F258 T259G251-V255 VanDerWaalsContact O-CG2 3.31Å; G251-V255 WeakPolarHBondContact O-CG2 3.19Å; G251-V255 PolarHBondContact O-N 3.31Å; L252-V255 PolarHBondContact O-N 2.94Å; V255-L257 PolarHBondContact O-N 3.48Å; V255-F258 PolarHBondContact O-N 3.32Å; V255-T259 HydrophobicContact CG1-CG2 4.24Å; V255-T259 WeakPolarHBondContact O-CB 3.41Å; V255-T259 WeakPolarHBondContact O-CG2 3.47Å; V255-T259 PolarHBondContact O-N 3.11Å; V255-T259 PolarHBondContact O-OG1 2.84Å
256L67.9Low64.8Low108 Ų10862.1 Ų62.157%0.56534%0.338SS*.Hα-helixtrans-58.5-47.8176.8-73.3167.3000111.7L252 L253 L254 F258 T259 L260L252-L256 WeakPolarHBondContact O-CB 3.49Å; L252-L256 WeakPolarHBondContact O-CG 3.21Å; L252-L256 PolarHBondContact O-N 3.42Å; L253-L256 PolarHBondContact O-N 3.3Å; L254-L256 VanDerWaalsContact C-N 3.34Å; L254-L256 PolarHBondContact O-N 3.43Å; L256-F258 VanDerWaalsContact C-N 3.29Å; L256-F258 PolarHBondContact O-N 3.37Å; L256-T259 WeakPolarHBondContact CA-OG1 3.44Å; L256-T259 PolarHBondContact O-N 3.45Å; L256-T259 PolarHBondContact O-OG1 3.01Å; L256-T259 VanDerWaalsContact O-OG1 3.11Å; L256-L260 WeakPolarHBondContact O-CB 3.41Å; L256-L260 PolarHBondContact O-N 2.8Å
257L70.8Confident65.1Low27 Ų2761 Ų6114%0.14133%0.334CS..Hα-helixtrans-65.5-30.8179.6-70.3170.2000112.7L253 L254 V255 P261 C279 I283L253-L257 HydrophobicContact CD1-CD1 4.04Å; L253-L257 HydrophobicContact CD1-CG 4.13Å; L253-L257 HydrophobicContact CG-CD1 3.84Å; L253-L257 HydrophobicContact CG-CG 4.35Å; L253-L257 WeakPolarHBondContact O-CB 3.4Å; L253-L257 WeakPolarHBondContact O-CG 3.43Å; L253-L257 PolarHBondContact O-N 3.1Å; L254-L257 PolarHBondContact O-N 3.37Å; V255-L257 PolarHBondContact O-N 3.48Å; L257-P261 WeakPolarHBondContact O-CD 3.46Å; L257-C279 HydrophobicContact CB-CB 4.28Å; L257-C279 HydrophobicContact CD2-CB 3.98Å; L257-C279 VanDerWaalsContact O-CB 3.26Å; L257-C279 WeakPolarHBondContact O-CB 3.18Å; L257-I283 HydrophobicContact CB-CD1 3.49Å; L257-I283 VanDerWaalsContact CB-CD1 3.49Å; L257-I283 HydrophobicContact CB-CG1 3.67Å; L257-I283 HydrophobicContact CD1-CG1 3.93Å; L257-I283 HydrophobicContact CG-CG1 4.42Å
258F66.8Low65.3Low43 Ų4363.1 Ų63.119%0.18935%0.345CS..Hα-helixtrans-78.9-33.1174.7-84.8-65.6000112.9L68 P113 V117 L254 V255 L256 I283L68-F258 HydrophobicContact CD1-CZ 4.34Å; P113-F258 HydrophobicContact CB-CE1 3.8Å; P113-F258 HydrophobicContact CB-CZ 4.46Å; V117-F258 HydrophobicContact CG2-CE2 4.07Å; V117-F258 HydrophobicContact CG2-CZ 4.04Å; L254-F258 WeakPolarHBondContact O-CB 3.18Å; L254-F258 WeakPolarHBondContact O-CD2 3.28Å; L254-F258 PolarHBondContact O-N 3.29Å; V255-F258 PolarHBondContact O-N 3.32Å; L256-F258 VanDerWaalsContact C-N 3.29Å; L256-F258 PolarHBondContact O-N 3.37Å; F258-I283 HydrophobicContact CD1-CD1 3.98Å; F258-I283 HydrophobicContact CD2-CD1 4.07Å; F258-I283 HydrophobicContact CE1-CD1 4.02Å; F258-I283 HydrophobicContact CE1-CG2 4.4Å; F258-I283 HydrophobicContact CE2-CD1 4.11Å; F258-I283 HydrophobicContact CE2-CG2 4.07Å; F258-I283 HydrophobicContact CG-CD1 4Å; F258-I283 HydrophobicContact CZ-CD1 4.09Å; F258-I283 HydrophobicContact CZ-CG2 3.73Å
259T66.4Low65.6Low52 Ų5259.3 Ų59.332%0.31933%0.33SS..Hα-helixtrans-81.1-32.9179.354.80000112V255 L256 R262 V263V255-T259 HydrophobicContact CG1-CG2 4.24Å; V255-T259 WeakPolarHBondContact O-CB 3.41Å; V255-T259 WeakPolarHBondContact O-CG2 3.47Å; V255-T259 PolarHBondContact O-N 3.11Å; V255-T259 PolarHBondContact O-OG1 2.84Å; L256-T259 WeakPolarHBondContact CA-OG1 3.44Å; L256-T259 PolarHBondContact O-N 3.45Å; L256-T259 PolarHBondContact O-OG1 3.01Å; L256-T259 VanDerWaalsContact O-OG1 3.11Å; T259-R262 CarbonylContact O-C 3.59Å; T259-R262 WeakPolarHBondContact O-CA 3.49Å; T259-R262 WeakPolarHBondContact O-CB 3.49Å; T259-R262 PolarHBondContact O-N 3.21Å; T259-V263 WeakPolarHBondContact O-CG2 3.23Å; T259-V263 PolarHBondContact O-N 2.94Å
260L68.5Low65.5Low58 Ų5859.8 Ų59.830%0.30433%0.327SS..Hα-helixtrans-57.6-43.9-172.9-162.3154.1000113.4L256 R262 V263 A264 S276L256-L260 WeakPolarHBondContact O-CB 3.41Å; L256-L260 PolarHBondContact O-N 2.8Å; L260-R262 VanDerWaalsContact C-N 3.26Å; L260-R262 PolarHBondContact O-N 2.91Å; L260-V263 PolarHBondContact O-N 3.36Å; L260-A264 WeakPolarHBondContact O-CB 3.44Å; L260-A264 PolarHBondContact O-N 3.21Å; L260-S276 VanDerWaalsContact CD2-CB 3.44Å
261P65.5Low65.4Low32 Ų3262.7 Ų62.721%0.20834%0.341CS..Hα-helixtrans-60.9-34.9173.2-21.932.8000113.8L257 F265 C279L257-P261 WeakPolarHBondContact O-CD 3.46Å; P261-F265 WeakPolarHBondContact O-CB 3.42Å; P261-F265 PolarHBondContact O-N 2.7Å; P261-F265 VanDerWaalsContact O-N 3.16Å; P261-C279 HydrophobicContact CG-CB 3.99Å
262R65.4Low65.2Low32 Ų3264.4 Ų64.412%0.12134%0.342CS..Hα-helixtrans-75.8-38.8179.5-60172.8173.1-138.3-11.6111.1S114 T190 I194 T259 L260 F265 F266S114-R262 PolarHBondContact OG-NH2 2.97Å; T190-R262 HydrophobicContact CG2-CB 4.48Å; T190-R262 HydrophobicContact CG2-CG 4.15Å; I194-R262 HydrophobicContact CD1-CB 4.48Å; T259-R262 CarbonylContact O-C 3.59Å; T259-R262 WeakPolarHBondContact O-CA 3.49Å; T259-R262 WeakPolarHBondContact O-CB 3.49Å; T259-R262 PolarHBondContact O-N 3.21Å; L260-R262 VanDerWaalsContact C-N 3.26Å; L260-R262 PolarHBondContact O-N 2.91Å; R262-F265 WeakPolarHBondContact O-CB 3.46Å; R262-F265 PolarHBondContact O-N 3.16Å; R262-F266 WeakPolarHBondContact O-CD2 3.49Å; R262-F266 PolarHBondContact O-N 2.91Å
263V65.4Low65.1Low72 Ų7261.6 Ų61.644%0.43632%0.324SS..Hα-helixtrans-71.8-41.8176.9175.10000110.9T259 L260 F265 F266 I267T259-V263 WeakPolarHBondContact O-CG2 3.23Å; T259-V263 PolarHBondContact O-N 2.94Å; L260-V263 PolarHBondContact O-N 3.36Å; V263-F265 PolarHBondContact O-N 3.47Å; V263-F266 WeakPolarHBondContact O-CA 3.43Å; V263-F266 WeakPolarHBondContact O-CB 3.19Å; V263-F266 PolarHBondContact O-N 3.42Å; V263-I267 HydrophobicContact CG1-CD1 3.67Å; V263-I267 HydrophobicContact CG1-CG1 4.33Å; V263-I267 WeakPolarHBondContact O-CG1 3.4Å; V263-I267 PolarHBondContact O-N 2.96Å
264A63Low64.7Low3 Ų359.2 Ų59.23%0.02531%0.311CS..Hα-helixtrans-57.7-38.6173.600000111.1L260 F266 I267 D268 L272L260-A264 WeakPolarHBondContact O-CB 3.44Å; L260-A264 PolarHBondContact O-N 3.21Å; A264-F266 VanDerWaalsContact C-N 3.31Å; A264-F266 PolarHBondContact O-N 2.77Å; A264-I267 PolarHBondContact O-N 2.93Å; A264-D268 PolarHBondContact O-N 3.32Å; A264-L272 HydrophobicContact CB-CB 4.05Å
265F59.9Low64.5Low35 Ų3562.5 Ų62.515%0.15433%0.328CS..Hα-helixtrans-62.5-32.6172.5-177.8-97.6000113.6L180 H186 M187 P261 R262 V263L180-F265 HydrophobicContact CB-CD2 4.19Å; L180-F265 HydrophobicContact CB-CE2 3.38Å; L180-F265 HydrophobicContact CB-CZ 4.05Å; L180-F265 VanDerWaalsContact O-CZ 3.24Å; L180-F265 WeakPolarHBondContact O-CZ 3.31Å; H186-F265 AromaticContact CD2-CE1 3.79Å; H186-F265 AromaticContact CD2-CZ 3.81Å; M187-F265 HydrophobicContact CG-CE1 4.08Å; P261-F265 WeakPolarHBondContact O-CB 3.42Å; P261-F265 PolarHBondContact O-N 2.7Å; P261-F265 VanDerWaalsContact O-N 3.16Å; R262-F265 WeakPolarHBondContact O-CB 3.46Å; R262-F265 PolarHBondContact O-N 3.16Å; V263-F265 PolarHBondContact O-N 3.47Å
266F61.3Low64.3Low111 Ų11158.5 Ų58.549%0.48730%0.304SS..Hα-helixtrans-78-28.9176-80.7-72.4000114R262 V263 A264R262-F266 WeakPolarHBondContact O-CD2 3.49Å; R262-F266 PolarHBondContact O-N 2.91Å; V263-F266 WeakPolarHBondContact O-CA 3.43Å; V263-F266 WeakPolarHBondContact O-CB 3.19Å; V263-F266 PolarHBondContact O-N 3.42Å; A264-F266 VanDerWaalsContact C-N 3.31Å; A264-F266 PolarHBondContact O-N 2.77Å
267I64.9Low64.1Low101 Ų10154.2 Ų54.252%0.51828%0.282SS..Hα-helixtrans-85.6-12.5-174.9-64.6172.7000111.8V263 A264 C269 L272V263-I267 HydrophobicContact CG1-CD1 3.67Å; V263-I267 HydrophobicContact CG1-CG1 4.33Å; V263-I267 WeakPolarHBondContact O-CG1 3.4Å; V263-I267 PolarHBondContact O-N 2.96Å; A264-I267 PolarHBondContact O-N 2.93Å; I267-C269 VanDerWaalsContact C-N 3.26Å; I267-C269 HydrophobicContact CG2-CB 4.02Å; I267-C269 PolarHBondContact O-N 2.78Å; I267-L272 HydrophobicContact CG2-CD1 4.32Å
268D64Low64Low118 Ų11855.1 Ų55.163%0.63129%0.287SS*.THydrogen-bonded Turntrans55.140.9-179-158.919.3000112.8A264A264-D268 PolarHBondContact O-N 3.32Å
269C62.3Low64.3Low42 Ų4253.4 Ų53.428%0.28428%0.28SS..  trans-110113.4179.6177.30000110.4I267 E271 L272 W273I267-C269 VanDerWaalsContact C-N 3.26Å; I267-C269 HydrophobicContact CG2-CB 4.02Å; I267-C269 PolarHBondContact O-N 2.78Å; C269-E271 VanDerWaalsContact C-N 3.35Å; C269-E271 PolarHBondContact O-N 3.3Å; C269-L272 HydrophobicContact CB-CB 3.92Å; C269-L272 HydrophobicContact CB-CD1 3.78Å; C269-L272 HydrophobicContact CB-CG 4.36Å; C269-L272 PolarHBondContact O-N 3.06Å; C269-W273 WeakPolarHBondContact O-CB 3.07Å; C269-W273 PolarHBondContact O-N 2.94Å
270T60.7Low64.3Low67 Ų6752 Ų5241%0.41127%0.272SS..Hα-helixtrans-54.7-45.6-179.648.50000112.7W273 Q274T270-W273 WeakPolarHBondContact O-CB 3.37Å; T270-W273 PolarHBondContact O-N 3.11Å; T270-Q274 WeakPolarHBondContact O-CG 3.24Å; T270-Q274 PolarHBondContact O-N 3.37Å
271E62.5Low64.4Low83 Ų8349.3 Ų49.339%0.38826%0.257SS..Hα-helixtrans-66-46.3-178.5-60.9-52.7134.800111.8C269 W273 Q274 I275C269-E271 VanDerWaalsContact C-N 3.35Å; C269-E271 PolarHBondContact O-N 3.3Å; E271-W273 PolarHBondContact O-N 3.32Å; E271-Q274 PolarHBondContact O-N 3.25Å; E271-I275 WeakPolarHBondContact O-CG1 3.41Å; E271-I275 PolarHBondContact O-N 3.27Å; E271-I275 VanDerWaalsContact O-N 3.1Å
272L61.7Low64.9Low66 Ų6650 Ų5035%0.34626%0.261SS..Hα-helixtrans-59.9-38.3173.4-92.2157.9000110.9A264 I267 C269 I275 S276A264-L272 HydrophobicContact CB-CB 4.05Å; I267-L272 HydrophobicContact CG2-CD1 4.32Å; C269-L272 HydrophobicContact CB-CB 3.92Å; C269-L272 HydrophobicContact CB-CD1 3.78Å; C269-L272 HydrophobicContact CB-CG 4.36Å; C269-L272 PolarHBondContact O-N 3.06Å; L272-I275 PolarHBondContact O-N 3.05Å; L272-S276 WeakPolarHBondContact O-CB 3.41Å; L272-S276 PolarHBondContact O-N 3.42Å
273W62Low65.4Low43 Ų4348.6 Ų48.616%0.16326%0.256CS..Hα-helixtrans-65.4-47.2178.4-168.892000111.7Y176 Q177 C269 T270 E271 I275 S276 T277Y176-W273 AromaticContact CD1-CH2 3.5Å; Y176-W273 HydrophobicContact CD1-CH2 3.5Å; Y176-W273 VanDerWaalsContact CD1-CH2 3.5Å; Y176-W273 AromaticContact CD1-CZ2 3.22Å; Y176-W273 HydrophobicContact CD1-CZ2 3.22Å; Y176-W273 HydrophobicContact CE1-CH2 4.23Å; Y176-W273 AromaticContact CE1-CZ2 3.59Å; Y176-W273 HydrophobicContact CE1-CZ2 3.59Å; Y176-W273 HydrophobicContact CG-CH2 4.37Å; Y176-W273 HydrophobicContact CG-CZ2 4.19Å; Q177-W273 HydrophobicContact CB-CH2 4.44Å; Q177-W273 HydrophobicContact CB-CZ2 4.36Å; Q177-W273 HydrophobicContact CG-CD2 4.07Å; Q177-W273 HydrophobicContact CG-CE3 4.35Å; Q177-W273 HydrophobicContact CG-CG 4.42Å; Q177-W273 HydrophobicContact CG-CH2 4.48Å; Q177-W273 HydrophobicContact CG-CZ2 4.22Å; C269-W273 WeakPolarHBondContact O-CB 3.07Å; C269-W273 PolarHBondContact O-N 2.94Å; T270-W273 WeakPolarHBondContact O-CB 3.37Å; T270-W273 PolarHBondContact O-N 3.11Å; E271-W273 PolarHBondContact O-N 3.32Å; W273-I275 VanDerWaalsContact C-N 3.32Å; W273-I275 PolarHBondContact O-N 3.05Å; W273-S276 WeakPolarHBondContact CA-OG 3.25Å; W273-S276 CarbonylContact O-C 3.51Å; W273-S276 WeakPolarHBondContact O-CA 3.43Å; W273-S276 WeakPolarHBondContact O-CB 3.46Å; W273-S276 PolarHBondContact O-N 3.31Å; W273-S276 PolarHBondContact O-OG 3.2Å; W273-T277 HydrophobicContact CD2-CG2 4.01Å; W273-T277 HydrophobicContact CE3-CG2 3.79Å; W273-T277 HydrophobicContact CH2-CG2 3.99Å; W273-T277 HydrophobicContact CZ2-CG2 4.17Å; W273-T277 HydrophobicContact CZ3-CG2 3.77Å; W273-T277 WeakPolarHBondContact O-CG2 3.48Å; W273-T277 PolarHBondContact O-N 2.76Å
274Q61.6Low65.6Low35 Ų3545.2 Ų45.216%0.16424%0.235CC..Hα-helixtrans-56.4-46.5175.9-70.1-173.511.300111.8T270 E271 S276 T277T270-Q274 WeakPolarHBondContact O-CG 3.24Å; T270-Q274 PolarHBondContact O-N 3.37Å; E271-Q274 PolarHBondContact O-N 3.25Å; Q274-S276 VanDerWaalsContact C-N 3.3Å; Q274-S276 PolarHBondContact O-N 3.44Å; Q274-T277 PolarHBondContact O-N 3.22Å; Q274-T277 PolarHBondContact O-OG1 3.31Å
275I64.8Low66.2Low98 Ų9847 Ų4750%0.50325%0.246SC..Hα-helixtrans-62.5-41.3175-64.1168.5000110.3E271 L272 W273 T277 L278E271-I275 WeakPolarHBondContact O-CG1 3.41Å; E271-I275 PolarHBondContact O-N 3.27Å; E271-I275 VanDerWaalsContact O-N 3.1Å; L272-I275 PolarHBondContact O-N 3.05Å; W273-I275 VanDerWaalsContact C-N 3.32Å; W273-I275 PolarHBondContact O-N 3.05Å; I275-T277 VanDerWaalsContact C-N 3.29Å; I275-T277 PolarHBondContact O-N 3.46Å; I275-L278 VanDerWaalsContact O-CB 3.28Å; I275-L278 WeakPolarHBondContact O-CB 3.5Å; I275-L278 PolarHBondContact O-N 3.33Å
276S64.5Low67.1Low3 Ų348.4 Ų48.42%0.02125%0.254CS..Hα-helixtrans-65.3-31-179.385.10000113.4L260 L272 W273 Q274 L278 C279 P280L260-S276 VanDerWaalsContact CD2-CB 3.44Å; L272-S276 WeakPolarHBondContact O-CB 3.41Å; L272-S276 PolarHBondContact O-N 3.42Å; W273-S276 WeakPolarHBondContact CA-OG 3.25Å; W273-S276 CarbonylContact O-C 3.51Å; W273-S276 WeakPolarHBondContact O-CA 3.43Å; W273-S276 WeakPolarHBondContact O-CB 3.46Å; W273-S276 PolarHBondContact O-N 3.31Å; W273-S276 PolarHBondContact O-OG 3.2Å; Q274-S276 VanDerWaalsContact C-N 3.3Å; Q274-S276 PolarHBondContact O-N 3.44Å; S276-L278 PolarHBondContact O-N 3.06Å; S276-C279 VanDerWaalsContact O-CB 3.31Å; S276-C279 WeakPolarHBondContact O-CB 3.5Å; S276-C279 PolarHBondContact O-N 3.07Å; S276-P280 WeakPolarHBondContact O-CD 3.49Å
277T64.5Low67.8Low17 Ų1743.2 Ų43.210%0.10423%0.232CC..Hα-helixtrans-65.8-18.9175.365.50000112.8W273 Q274 I275W273-T277 HydrophobicContact CD2-CG2 4.01Å; W273-T277 HydrophobicContact CE3-CG2 3.79Å; W273-T277 HydrophobicContact CH2-CG2 3.99Å; W273-T277 HydrophobicContact CZ2-CG2 4.17Å; W273-T277 HydrophobicContact CZ3-CG2 3.77Å; W273-T277 WeakPolarHBondContact O-CG2 3.48Å; W273-T277 PolarHBondContact O-N 2.76Å; Q274-T277 PolarHBondContact O-N 3.22Å; Q274-T277 PolarHBondContact O-OG1 3.31Å; I275-T277 VanDerWaalsContact C-N 3.29Å; I275-T277 PolarHBondContact O-N 3.46Å
278L68.9Low68.2Low47 Ų4738.5 Ų38.525%0.24621%0.208CC..Hα-helixtrans-74.3-29.2170.8-66.6162.8000111.9I32 R33 I275 S276 V281 V282I32-L278 HydrophobicContact CG2-CD2 4.22Å; R33-L278 HydrophobicContact CG-CD2 3.45Å; R33-L278 VanDerWaalsContact CG-CD2 3.45Å; R33-L278 HydrophobicContact CG-CG 4.29Å; I275-L278 VanDerWaalsContact O-CB 3.28Å; I275-L278 WeakPolarHBondContact O-CB 3.5Å; I275-L278 PolarHBondContact O-N 3.33Å; S276-L278 PolarHBondContact O-N 3.06Å; L278-V281 WeakPolarHBondContact O-CB 3.32Å; L278-V281 PolarHBondContact O-N 3.28Å; L278-V281 VanDerWaalsContact O-N 3.09Å; L278-V282 WeakPolarHBondContact O-CG2 3.44Å; L278-V282 PolarHBondContact O-N 2.81Å
279C72.1Confident68.7Low7 Ų736.3 Ų36.35%0.04720%0.2CC..Hα-helixtrans-57.7-49.1-173-60.40000113.2L257 P261 S276 V281 V282 I283L257-C279 HydrophobicContact CB-CB 4.28Å; L257-C279 HydrophobicContact CD2-CB 3.98Å; L257-C279 VanDerWaalsContact O-CB 3.26Å; L257-C279 WeakPolarHBondContact O-CB 3.18Å; P261-C279 HydrophobicContact CG-CB 3.99Å; S276-C279 VanDerWaalsContact O-CB 3.31Å; S276-C279 WeakPolarHBondContact O-CB 3.5Å; S276-C279 PolarHBondContact O-N 3.07Å; C279-V281 VanDerWaalsContact C-N 3.25Å; C279-V281 PolarHBondContact O-N 2.92Å; C279-V282 PolarHBondContact O-N 3.18Å; C279-I283 WeakPolarHBondContact O-CB 3.41Å; C279-I283 WeakPolarHBondContact O-CD1 3.3Å; C279-I283 WeakPolarHBondContact O-CG1 3.33Å; C279-I283 PolarHBondContact O-N 2.99Å
280P67.5Low69.3Low23 Ų2335.9 Ų35.915%0.14920%0.195CC..Hα-helixtrans-59.2-37.4176.7-23.633.5000113L75 I79 S276 A284L75-P280 HydrophobicContact CD2-CB 3.89Å; L75-P280 HydrophobicContact CD2-CG 4.43Å; L75-P280 HydrophobicContact CG-CB 4.48Å; I79-P280 HydrophobicContact CD1-CB 4.4Å; S276-P280 WeakPolarHBondContact O-CD 3.49Å; P280-A284 WeakPolarHBondContact O-CB 3.32Å; P280-A284 PolarHBondContact O-N 3.43Å
281V69.7Low69.9Low0 Ų034.5 Ų34.50%018%0.183CC..Hα-helixtrans-69.6-44.9-178.6-1620000110.4V36 G37 A76 I79 L278 C279 A284 V285V36-V281 HydrophobicContact CB-CG1 3.65Å; V36-V281 HydrophobicContact CG1-CB 4.28Å; V36-V281 HydrophobicContact CG1-CG1 3.54Å; G37-V281 VanDerWaalsContact CA-CG1 3.44Å; A76-V281 HydrophobicContact CB-CG1 4.36Å; I79-V281 HydrophobicContact CG2-CG2 4Å; L278-V281 WeakPolarHBondContact O-CB 3.32Å; L278-V281 PolarHBondContact O-N 3.28Å; L278-V281 VanDerWaalsContact O-N 3.09Å; C279-V281 VanDerWaalsContact C-N 3.25Å; C279-V281 PolarHBondContact O-N 2.92Å; V281-A284 PolarHBondContact O-N 2.9Å; V281-V285 PolarHBondContact O-N 2.94Å
282V75.8Confident70.1Confident48 Ų4832.3 Ų32.329%0.29117%0.173SC..Hα-helixtrans-64.7-43.3175.9172.50000111.2L278 C279 A284 V285 I286L278-V282 WeakPolarHBondContact O-CG2 3.44Å; L278-V282 PolarHBondContact O-N 2.81Å; C279-V282 PolarHBondContact O-N 3.18Å; V282-A284 VanDerWaalsContact C-N 3.28Å; V282-A284 PolarHBondContact O-N 3.02Å; V282-V285 PolarHBondContact O-N 3.42Å; V282-I286 HydrophobicContact CG1-CD1 3.49Å; V282-I286 VanDerWaalsContact CG1-CD1 3.49Å; V282-I286 HydrophobicContact CG1-CG1 4.28Å; V282-I286 WeakPolarHBondContact O-CB 3.42Å; V282-I286 WeakPolarHBondContact O-CG1 3.27Å; V282-I286 PolarHBondContact O-N 3.36Å
283I76Confident70.5Confident1 Ų136.7 Ų36.71%0.00519%0.186CC..Hα-helixtrans-56.3-45.4173.9-73.7164.2000110.3L254 L257 F258 C279 V285 I286 L287L254-I283 HydrophobicContact CD2-CG1 4.37Å; L254-I283 HydrophobicContact CD2-CG2 4.43Å; L257-I283 HydrophobicContact CB-CD1 3.49Å; L257-I283 VanDerWaalsContact CB-CD1 3.49Å; L257-I283 HydrophobicContact CB-CG1 3.67Å; L257-I283 HydrophobicContact CD1-CG1 3.93Å; L257-I283 HydrophobicContact CG-CG1 4.42Å; F258-I283 HydrophobicContact CD1-CD1 3.98Å; F258-I283 HydrophobicContact CD2-CD1 4.07Å; F258-I283 HydrophobicContact CE1-CD1 4.02Å; F258-I283 HydrophobicContact CE1-CG2 4.4Å; F258-I283 HydrophobicContact CE2-CD1 4.11Å; F258-I283 HydrophobicContact CE2-CG2 4.07Å; F258-I283 HydrophobicContact CG-CD1 4Å; F258-I283 HydrophobicContact CZ-CD1 4.09Å; F258-I283 HydrophobicContact CZ-CG2 3.73Å; C279-I283 WeakPolarHBondContact O-CB 3.41Å; C279-I283 WeakPolarHBondContact O-CD1 3.3Å; C279-I283 WeakPolarHBondContact O-CG1 3.33Å; C279-I283 PolarHBondContact O-N 2.99Å; I283-V285 VanDerWaalsContact C-N 3.27Å; I283-V285 PolarHBondContact O-N 3.47Å; I283-I286 PolarHBondContact O-N 2.87Å; I283-L287 HydrophobicContact CG2-CD1 3.33Å; I283-L287 HydrophobicContact CG2-CG 3.76Å; I283-L287 VanDerWaalsContact O-CB 3.28Å; I283-L287 WeakPolarHBondContact O-CB 3.37Å; I283-L287 VanDerWaalsContact O-CG 3.29Å; I283-L287 WeakPolarHBondContact O-CG 3.31Å; I283-L287 PolarHBondContact O-N 2.89Å
284A70.8Confident70.9Confident1 Ų136.9 Ų36.91%0.00819%0.187CC..Hα-helixtrans-64.1-30.5-177.600000112.9A40 N72 A76 P280 V281 V282 P288A40-A284 HydrophobicContact CB-CB 3.59Å; N72-A284 HydrophobicContact CB-CB 4.08Å; A76-A284 HydrophobicContact CB-CB 3.82Å; P280-A284 WeakPolarHBondContact O-CB 3.32Å; P280-A284 PolarHBondContact O-N 3.43Å; V281-A284 PolarHBondContact O-N 2.9Å; V282-A284 VanDerWaalsContact C-N 3.28Å; V282-A284 PolarHBondContact O-N 3.02Å; A284-P288 WeakPolarHBondContact O-CD 3.38Å; A284-P288 VanDerWaalsContact O-CG 3.3Å; A284-P288 WeakPolarHBondContact O-CG 3.43Å
285V74.5Confident71.3Confident42 Ų4236 Ų3626%0.25518%0.184SC..Hα-helixtrans-79.7-41.1175175.70000112.3V36 A40 V281 V282 I283 P289V36-V285 HydrophobicContact CG1-CG2 3.58Å; V36-V285 WeakPolarHBondContact O-CG2 3.41Å; A40-V285 HydrophobicContact CB-CG2 3.77Å; V281-V285 PolarHBondContact O-N 2.94Å; V282-V285 PolarHBondContact O-N 3.42Å; I283-V285 VanDerWaalsContact C-N 3.27Å; I283-V285 PolarHBondContact O-N 3.47Å; V285-P289 WeakPolarHBondContact O-CD 3.16Å
286I78.7Confident71.7Confident63 Ų6338.3 Ų38.332%0.32319%0.191SC..Hα-helixtrans-81.3-33.7-171.4-68.7178.2000112.2V282 I283 P289 I290V282-I286 HydrophobicContact CG1-CD1 3.49Å; V282-I286 VanDerWaalsContact CG1-CD1 3.49Å; V282-I286 HydrophobicContact CG1-CG1 4.28Å; V282-I286 WeakPolarHBondContact O-CB 3.42Å; V282-I286 WeakPolarHBondContact O-CG1 3.27Å; V282-I286 PolarHBondContact O-N 3.36Å; I283-I286 PolarHBondContact O-N 2.87Å; I286-P289 VanDerWaalsContact O-CD 3.27Å; I286-P289 WeakPolarHBondContact O-CD 3.43Å; I286-P289 VanDerWaalsContact O-CG 3.31Å; I286-P289 WeakPolarHBondContact O-CG 3.18Å; I286-I290 HydrophobicContact CG2-CD1 3.3Å; I286-I290 HydrophobicContact CG2-CG1 4.09Å; I286-I290 VanDerWaalsContact O-CG1 3.26Å; I286-I290 WeakPolarHBondContact O-CG1 3.48Å; I286-I290 PolarHBondContact O-N 3.34Å
287L76.6Confident72Confident2 Ų241 Ų411%0.0121%0.205CC..Hα-helixtrans-62.5-48.6-176.6-80.5-177.7000114.6L68 L69 N72 L254 I283 I290 F291L68-L287 HydrophobicContact CD2-CD1 3.95Å; L68-L287 HydrophobicContact CG-CD1 4.18Å; L69-L287 HydrophobicContact CD2-CB 3.63Å; N72-L287 WeakPolarHBondContact ND2-CD1 3.41Å; L254-L287 HydrophobicContact CD1-CD2 3.52Å; L254-L287 HydrophobicContact CD2-CD2 3.44Å; L254-L287 VanDerWaalsContact CD2-CD2 3.44Å; L254-L287 HydrophobicContact CD2-CG 3.95Å; L254-L287 HydrophobicContact CG-CD2 4.12Å; I283-L287 HydrophobicContact CG2-CD1 3.33Å; I283-L287 HydrophobicContact CG2-CG 3.76Å; I283-L287 VanDerWaalsContact O-CB 3.28Å; I283-L287 WeakPolarHBondContact O-CB 3.37Å; I283-L287 VanDerWaalsContact O-CG 3.29Å; I283-L287 WeakPolarHBondContact O-CG 3.31Å; I283-L287 PolarHBondContact O-N 2.89Å; L287-I290 PolarHBondContact O-N 2.85Å; L287-F291 HydrophobicContact CB-CD2 4.3Å; L287-F291 HydrophobicContact CB-CE2 4.45Å; L287-F291 HydrophobicContact CD2-CD2 4.22Å; L287-F291 HydrophobicContact CD2-CE2 3.75Å; L287-F291 VanDerWaalsContact O-CD2 3.29Å; L287-F291 WeakPolarHBondContact O-CD2 3.38Å; L287-F291 PolarHBondContact O-N 3.26Å
288P73.8Confident72.2Confident3 Ų340.4 Ų40.42%0.01920%0.201CC..Hα-helixtrans-53.6-55.2-179.6-17.322.3000113.6L69 A284 I290 F291 M292L69-P288 HydrophobicContact CD1-CB 4.28Å; L69-P288 HydrophobicContact CD1-CG 4.48Å; L69-P288 HydrophobicContact CD2-CB 4.29Å; L69-P288 HydrophobicContact CD2-CG 3.76Å; A284-P288 WeakPolarHBondContact O-CD 3.38Å; A284-P288 VanDerWaalsContact O-CG 3.3Å; A284-P288 WeakPolarHBondContact O-CG 3.43Å; P288-I290 VanDerWaalsContact C-N 3.32Å; P288-I290 PolarHBondContact O-N 3.34Å; P288-F291 PolarHBondContact O-N 3.38Å; P288-M292 VanDerWaalsContact O-CG 3.27Å; P288-M292 WeakPolarHBondContact O-CG 3.3Å; P288-M292 PolarHBondContact O-N 2.74Å
289P73.2Confident72.5Confident72 Ų7242.4 Ų42.447%0.46821%0.205SC..Hα-helixtrans-63.7-37.6-17824.1-33000112.2V285 I286 F291 M292 Y293V285-P289 WeakPolarHBondContact O-CD 3.16Å; I286-P289 VanDerWaalsContact O-CD 3.27Å; I286-P289 WeakPolarHBondContact O-CD 3.43Å; I286-P289 VanDerWaalsContact O-CG 3.31Å; I286-P289 WeakPolarHBondContact O-CG 3.18Å; P289-F291 PolarHBondContact O-N 3.34Å; P289-M292 PolarHBondContact O-N 3.34Å; P289-Y293 VanDerWaalsContact O-CB 3.3Å; P289-Y293 WeakPolarHBondContact O-CB 3.33Å; P289-Y293 PolarHBondContact O-N 3.43Å
290I76.4Confident72.7Confident32 Ų3246.8 Ų46.816%0.16423%0.228CC..Hα-helixtrans-59.8-49174.8-70.9-178.6000110.5I250 I286 L287 P288 Y293 Y294I250-I290 HydrophobicContact CD1-CD1 3.98Å; I250-I290 HydrophobicContact CD1-CG1 4.42Å; I250-I290 HydrophobicContact CD1-CG2 4.28Å; I250-I290 HydrophobicContact CG1-CD1 4.04Å; I250-I290 HydrophobicContact CG2-CD1 3.7Å; I250-I290 HydrophobicContact CG2-CG2 4.03Å; I286-I290 HydrophobicContact CG2-CD1 3.3Å; I286-I290 HydrophobicContact CG2-CG1 4.09Å; I286-I290 VanDerWaalsContact O-CG1 3.26Å; I286-I290 WeakPolarHBondContact O-CG1 3.48Å; I286-I290 PolarHBondContact O-N 3.34Å; L287-I290 PolarHBondContact O-N 2.85Å; P288-I290 VanDerWaalsContact C-N 3.32Å; P288-I290 PolarHBondContact O-N 3.34Å; I290-Y293 PolarHBondContact O-N 3.17Å; I290-Y294 HydrophobicContact CG2-CD2 3.79Å; I290-Y294 HydrophobicContact CG2-CE2 4.13Å; I290-Y294 VanDerWaalsContact O-CD2 3.23Å; I290-Y294 WeakPolarHBondContact O-CD2 3.12Å; I290-Y294 PolarHBondContact O-N 3.08Å
291F71.9Confident73.1Confident38 Ų3846.4 Ų46.417%0.16722%0.224CC..Hα-helixtrans-66.5-39.7-179.8-85.1-65.1000112.5V65 L68 M120 L287 P288 P289 Y293 Y294 T295V65-F291 HydrophobicContact CG1-CB 3.93Å; V65-F291 HydrophobicContact CG1-CD1 3.83Å; V65-F291 HydrophobicContact CG1-CD2 3.72Å; V65-F291 HydrophobicContact CG1-CE1 4.25Å; V65-F291 HydrophobicContact CG1-CE2 4.12Å; V65-F291 HydrophobicContact CG1-CG 3.56Å; V65-F291 HydrophobicContact CG1-CZ 4.39Å; V65-F291 HydrophobicContact CG2-CD1 3.91Å; V65-F291 HydrophobicContact CG2-CE1 3.79Å; V65-F291 HydrophobicContact CG2-CG 4.48Å; V65-F291 HydrophobicContact CG2-CZ 4.25Å; L68-F291 HydrophobicContact CD2-CE2 4.16Å; L68-F291 HydrophobicContact CD2-CZ 4.49Å; M120-F291 HydrophobicContact CE-CZ 3.99Å; M120-F291 HydrophobicContact SD-CE1 4.33Å; M120-F291 HydrophobicContact SD-CZ 3.99Å; L287-F291 HydrophobicContact CB-CD2 4.3Å; L287-F291 HydrophobicContact CB-CE2 4.45Å; L287-F291 HydrophobicContact CD2-CD2 4.22Å; L287-F291 HydrophobicContact CD2-CE2 3.75Å; L287-F291 VanDerWaalsContact O-CD2 3.29Å; L287-F291 WeakPolarHBondContact O-CD2 3.38Å; L287-F291 PolarHBondContact O-N 3.26Å; P288-F291 PolarHBondContact O-N 3.38Å; P289-F291 PolarHBondContact O-N 3.34Å; F291-Y293 VanDerWaalsContact C-N 3.28Å; F291-Y293 PolarHBondContact O-N 3.21Å; F291-Y294 PolarHBondContact O-N 2.91Å; F291-T295 WeakPolarHBondContact O-CB 3.49Å; F291-T295 PolarHBondContact O-N 3.15Å; F291-T295 PolarHBondContact O-OG1 3.16Å
292M68Low73.3Confident38 Ų3850.8 Ų50.819%0.18725%0.247CC..Hα-helixtrans-61.3-40.4175.1-68.1-173.598.300111.3Y46 Y47 L50 P288 P289 F298Y46-M292 HydrophobicContact CD1-CE 4.2Å; Y46-M292 HydrophobicContact CD1-SD 4.42Å; Y46-M292 HydrophobicContact CE1-CE 3.72Å; Y46-M292 HydrophobicContact CE1-SD 4.3Å; Y47-M292 HydrophobicContact CD2-CE 4.5Å; Y47-M292 HydrophobicContact CD2-CG 3.73Å; Y47-M292 HydrophobicContact CD2-SD 4.22Å; Y47-M292 HydrophobicContact CE2-CG 3.81Å; L50-M292 HydrophobicContact CD1-CE 3.33Å; P288-M292 VanDerWaalsContact O-CG 3.27Å; P288-M292 WeakPolarHBondContact O-CG 3.3Å; P288-M292 PolarHBondContact O-N 2.74Å; P289-M292 PolarHBondContact O-N 3.34Å; M292-F298 HydrophobicContact CE-CD1 3.94Å; M292-F298 HydrophobicContact CE-CE1 4.21Å; M292-F298 HydrophobicContact CG-CD1 4.33Å
293Y70.3Confident73.4Confident157 Ų15755.5 Ų55.562%0.61626%0.264SS*.Hα-helixtrans-72.1-38.7179.6-173.1-102.2000113.2P289 I290 F291 R299P289-Y293 VanDerWaalsContact O-CB 3.3Å; P289-Y293 WeakPolarHBondContact O-CB 3.33Å; P289-Y293 PolarHBondContact O-N 3.43Å; I290-Y293 PolarHBondContact O-N 3.17Å; F291-Y293 VanDerWaalsContact C-N 3.28Å; F291-Y293 PolarHBondContact O-N 3.21Å; Y293-R299 WeakPolarHBondContact O-CD 3.21Å; Y293-R299 VanDerWaalsContact O-CG 3.27Å; Y293-R299 WeakPolarHBondContact O-CG 3.42Å; Y293-R299 PolarHBondContact O-NE 2.99Å
294Y69.8Low73.4Confident47 Ų4757.8 Ų57.818%0.18428%0.28CS..Hα-helixtrans-91.4-24.8-176-72.7-69.5000114.4M246 L247 I250 I290 F291 K296 R299M246-Y294 PolarHBondContact SD-OH 3.18Å; L247-Y294 HydrophobicContact CD1-CD1 3.7Å; L247-Y294 HydrophobicContact CD1-CD2 3.83Å; L247-Y294 HydrophobicContact CD1-CE1 3.86Å; L247-Y294 HydrophobicContact CD1-CE2 3.98Å; L247-Y294 HydrophobicContact CD1-CG 3.68Å; I250-Y294 HydrophobicContact CD1-CE2 3.78Å; I290-Y294 HydrophobicContact CG2-CD2 3.79Å; I290-Y294 HydrophobicContact CG2-CE2 4.13Å; I290-Y294 VanDerWaalsContact O-CD2 3.23Å; I290-Y294 WeakPolarHBondContact O-CD2 3.12Å; I290-Y294 PolarHBondContact O-N 3.08Å; F291-Y294 PolarHBondContact O-N 2.91Å; Y294-K296 PolarHBondContact O-N 3.32Å; Y294-R299 PolarHBondContact O-NH2 2.94Å
295T69.1Low73.5Confident17 Ų1761.6 Ų61.610%0.10430%0.295CS..  trans-74.1124.6-179.3-52.30000110.4F291 D297 F298 R299F291-T295 WeakPolarHBondContact O-CB 3.49Å; F291-T295 PolarHBondContact O-N 3.15Å; F291-T295 PolarHBondContact O-OG1 3.16Å; T295-D297 VanDerWaalsContact C-N 3.35Å; T295-D297 PolarHBondContact O-N 2.88Å; T295-F298 HydrophobicContact CG2-CD2 4.03Å; T295-R299 PolarHBondContact O-N 2.84Å; T295-R299 VanDerWaalsContact O-N 3.09Å
296K73.3Confident73.5Confident146 Ų14665 Ų6564%0.63531%0.31SS*.Hα-helixtrans-60.7-44.3-175.6-172.3-179.4176-174.20111.3Y294 F298 R299 L300Y294-K296 PolarHBondContact O-N 3.32Å; K296-F298 PolarHBondContact O-N 3.38Å; K296-R299 PolarHBondContact O-N 2.99Å; K296-L300 HydrophobicContact CG-CD1 4.01Å; K296-L300 HydrophobicContact CG-CG 4.36Å; K296-L300 WeakPolarHBondContact O-CG 3.44Å; K296-L300 PolarHBondContact O-N 3.41Å
297D71.5Confident73.2Confident60 Ų6072 Ų7232%0.32133%0.332SS..Hα-helixtrans-62.8-45.9-176.2-51.3-21.2000111.6L57 N62 T295 L300 L301L57-D297 HydrophobicContact CD2-CB 3.81Å; N62-D297 PolarHBondContact ND2-OD2 3.49Å; T295-D297 VanDerWaalsContact C-N 3.35Å; T295-D297 PolarHBondContact O-N 2.88Å; D297-L300 PolarHBondContact O-N 3.08Å; D297-L301 WeakPolarHBondContact O-CB 3.25Å; D297-L301 PolarHBondContact O-N 3.13Å
298F68.6Low72.6Confident5 Ų578.1 Ų78.12%0.02237%0.366CS..Hα-helixtrans-64.3-42.4175.9-85.9-87.1000112.4Y47 L50 L57 M292 T295 K296 L300 L301 L302Y47-F298 HydrophobicContact CD1-CZ 4.34Å; Y47-F298 AromaticContact CD2-CE1 3.99Å; Y47-F298 HydrophobicContact CD2-CE1 3.99Å; Y47-F298 AromaticContact CD2-CZ 3.98Å; Y47-F298 HydrophobicContact CD2-CZ 3.98Å; Y47-F298 HydrophobicContact CE1-CE2 4.19Å; Y47-F298 AromaticContact CE1-CZ 3.74Å; Y47-F298 HydrophobicContact CE1-CZ 3.74Å; Y47-F298 HydrophobicContact CE2-CD1 4.23Å; Y47-F298 HydrophobicContact CE2-CD2 4.25Å; Y47-F298 AromaticContact CE2-CE1 3.63Å; Y47-F298 HydrophobicContact CE2-CE1 3.63Å; Y47-F298 AromaticContact CE2-CE2 3.69Å; Y47-F298 HydrophobicContact CE2-CE2 3.69Å; Y47-F298 HydrophobicContact CE2-CG 4.49Å; Y47-F298 AromaticContact CE2-CZ 3.31Å; Y47-F298 HydrophobicContact CE2-CZ 3.31Å; Y47-F298 HydrophobicContact CG-CZ 4.47Å; Y47-F298 AromaticContact CZ-CE2 3.37Å; Y47-F298 AromaticContact CZ-CZ 3.19Å; Y47-F298 WeakPolarHBondContact OH-CE2 3.5Å; Y47-F298 WeakPolarHBondContact OH-CZ 3.48Å; L50-F298 HydrophobicContact CB-CE1 4.15Å; L50-F298 HydrophobicContact CD1-CE1 4.29Å; L57-F298 HydrophobicContact CD1-CD1 4.02Å; L57-F298 HydrophobicContact CD1-CE1 3.47Å; L57-F298 VanDerWaalsContact CD1-CE1 3.47Å; L57-F298 HydrophobicContact CD1-CE2 4.02Å; L57-F298 HydrophobicContact CD1-CZ 3.47Å; L57-F298 VanDerWaalsContact CD1-CZ 3.47Å; L57-F298 HydrophobicContact CD2-CD1 4.37Å; L57-F298 HydrophobicContact CD2-CD2 3.79Å; L57-F298 HydrophobicContact CD2-CE1 4.4Å; L57-F298 HydrophobicContact CD2-CE2 3.79Å; L57-F298 HydrophobicContact CD2-CG 4.09Å; L57-F298 HydrophobicContact CD2-CZ 4.13Å; L57-F298 HydrophobicContact CG-CE2 4.36Å; L57-F298 HydrophobicContact CG-CZ 4.28Å; M292-F298 HydrophobicContact CE-CD1 3.94Å; M292-F298 HydrophobicContact CE-CE1 4.21Å; M292-F298 HydrophobicContact CG-CD1 4.33Å; T295-F298 HydrophobicContact CG2-CD2 4.03Å; K296-F298 PolarHBondContact O-N 3.38Å; F298-L300 VanDerWaalsContact C-N 3.34Å; F298-L300 PolarHBondContact O-N 3.4Å; F298-L301 PolarHBondContact O-N 2.89Å; F298-L302 WeakPolarHBondContact O-CB 3.41Å; F298-L302 PolarHBondContact O-N 3.26Å
299R74.7Confident71.9Confident89 Ų8984.3 Ų84.334%0.33640%0.399SS..Hα-helixtrans-61.8-41.3175.4-83.3-171.2-75.8176.21.3112.8Y293 Y294 T295 K296 K303Y293-R299 WeakPolarHBondContact O-CD 3.21Å; Y293-R299 VanDerWaalsContact O-CG 3.27Å; Y293-R299 WeakPolarHBondContact O-CG 3.42Å; Y293-R299 PolarHBondContact O-NE 2.99Å; Y294-R299 PolarHBondContact O-NH2 2.94Å; T295-R299 PolarHBondContact O-N 2.84Å; T295-R299 VanDerWaalsContact O-N 3.09Å; K296-R299 PolarHBondContact O-N 2.99Å; R299-K303 WeakPolarHBondContact O-CB 3.4Å; R299-K303 VanDerWaalsContact O-CG 3.27Å; R299-K303 WeakPolarHBondContact O-CG 3.46Å; R299-K303 PolarHBondContact O-N 3.45Å
300L77.1Confident70.4Confident99 Ų9983.3 Ų83.352%0.51840%0.396SS..Hα-helixtrans-65.7-42.2177.9-71.8174.8000110.8K296 D297 F298 K303 S304K296-L300 HydrophobicContact CG-CD1 4.01Å; K296-L300 HydrophobicContact CG-CG 4.36Å; K296-L300 WeakPolarHBondContact O-CG 3.44Å; K296-L300 PolarHBondContact O-N 3.41Å; D297-L300 PolarHBondContact O-N 3.08Å; F298-L300 VanDerWaalsContact C-N 3.34Å; F298-L300 PolarHBondContact O-N 3.4Å; L300-K303 PolarHBondContact O-N 2.94Å; L300-S304 PolarHBondContact O-N 3.27Å; L300-S304 PolarHBondContact O-OG 3.4Å
301L75.5Confident68.6Low15 Ų1586.8 Ų86.88%0.07942%0.421CS..Hα-helixtrans-62.6-47175.1-168.781.3000111.9H54 L57 D297 F298 K303 S304 Y305H54-L301 HydrophobicContact CB-CD2 4.41Å; L57-L301 HydrophobicContact CD1-CD2 3.86Å; L57-L301 HydrophobicContact CG-CD2 4.42Å; D297-L301 WeakPolarHBondContact O-CB 3.25Å; D297-L301 PolarHBondContact O-N 3.13Å; F298-L301 PolarHBondContact O-N 2.89Å; L301-K303 VanDerWaalsContact C-N 3.32Å; L301-K303 PolarHBondContact O-N 2.93Å; L301-S304 WeakPolarHBondContact CA-OG 3.22Å; L301-S304 PolarHBondContact O-N 3.41Å; L301-S304 VanDerWaalsContact O-N 3.13Å; L301-S304 PolarHBondContact O-OG 3.48Å; L301-Y305 HydrophobicContact CD1-CE2 4.26Å; L301-Y305 HydrophobicContact CD2-CE2 4.16Å; L301-Y305 HydrophobicContact CG-CD2 4.06Å; L301-Y305 HydrophobicContact CG-CE2 3.93Å; L301-Y305 WeakPolarHBondContact O-CD2 3.4Å; L301-Y305 PolarHBondContact O-N 3.07Å
302L73.3Confident67.1Low91 Ų9190.3 Ų90.348%0.47645%0.45SS..Hα-helixtrans-61.8-42.2178.6-168.972.6000111F298 S304 Y305 I306F298-L302 WeakPolarHBondContact O-CB 3.41Å; F298-L302 PolarHBondContact O-N 3.26Å; L302-S304 VanDerWaalsContact C-N 3.33Å; L302-S304 PolarHBondContact O-N 2.97Å; L302-Y305 PolarHBondContact O-N 2.88Å; L302-I306 HydrophobicContact CG-CD1 4.1Å; L302-I306 WeakPolarHBondContact O-CG1 3.4Å; L302-I306 PolarHBondContact O-N 3.49Å
303K77.5Confident65.7Low147 Ų14795.1 Ų95.164%0.63948%0.477SS*.Hα-helixtrans-61.7-38.7173.8-77.8-176.5176.9-163.10112.4R299 L300 L301 R307R299-K303 WeakPolarHBondContact O-CB 3.4Å; R299-K303 VanDerWaalsContact O-CG 3.27Å; R299-K303 WeakPolarHBondContact O-CG 3.46Å; R299-K303 PolarHBondContact O-N 3.45Å; L300-K303 PolarHBondContact O-N 2.94Å; L301-K303 VanDerWaalsContact C-N 3.32Å; L301-K303 PolarHBondContact O-N 2.93Å; K303-R307 VanDerWaalsContact O-CB 3.3Å; K303-R307 WeakPolarHBondContact O-CB 3.38Å; K303-R307 PolarHBondContact O-N 3.43Å
304S77.8Confident64.2Low50 Ų5095.9 Ų95.935%0.3549%0.491SS..Hα-helixtrans-68.2-37.3176.858.60000112.8L300 L301 L302 R307 N308L300-S304 PolarHBondContact O-N 3.27Å; L300-S304 PolarHBondContact O-OG 3.4Å; L301-S304 WeakPolarHBondContact CA-OG 3.22Å; L301-S304 PolarHBondContact O-N 3.41Å; L301-S304 VanDerWaalsContact O-N 3.13Å; L301-S304 PolarHBondContact O-OG 3.48Å; L302-S304 VanDerWaalsContact C-N 3.33Å; L302-S304 PolarHBondContact O-N 2.97Å; S304-R307 PolarHBondContact O-N 3.16Å; S304-N308 WeakPolarHBondContact O-CB 3.44Å; S304-N308 PolarHBondContact O-N 2.65Å; S304-N308 PolarHBondContact O-ND2 3.01Å
305Y71.2Confident62.6Low80 Ų8096.8 Ų96.831%0.31451%0.514SS..Hα-helixtrans-65.2-49.7175-87.1-74.2000111.3H54 L301 L302 R307 N308 D309H54-Y305 AromaticContact CE1-CE2 3.72Å; H54-Y305 AromaticContact CE1-CZ 3.73Å; H54-Y305 PolarHBondContact CE1-OH 3.49Å; H54-Y305 AromaticContact NE2-CE2 3.59Å; H54-Y305 AromaticContact NE2-CZ 3.66Å; H54-Y305 PolarHBondContact NE2-OH 2.99Å; L301-Y305 HydrophobicContact CD1-CE2 4.26Å; L301-Y305 HydrophobicContact CD2-CE2 4.16Å; L301-Y305 HydrophobicContact CG-CD2 4.06Å; L301-Y305 HydrophobicContact CG-CE2 3.93Å; L301-Y305 WeakPolarHBondContact O-CD2 3.4Å; L301-Y305 PolarHBondContact O-N 3.07Å; L302-Y305 PolarHBondContact O-N 2.88Å; Y305-R307 PolarHBondContact O-N 3.15Å; Y305-N308 PolarHBondContact O-N 2.92Å; Y305-D309 PolarHBondContact O-N 3.48Å
306I74.9Confident61.1Low114 Ų114102.5 Ų102.559%0.58555%0.549SS*.Hα-helixtrans-58.4-36.1177.1-65166.5000111.3L302 A310L302-I306 HydrophobicContact CG-CD1 4.1Å; L302-I306 WeakPolarHBondContact O-CG1 3.4Å; L302-I306 PolarHBondContact O-N 3.49Å; I306-A310 WeakPolarHBondContact O-CB 3.5Å; I306-A310 PolarHBondContact O-N 3.26Å
307R73.4Confident59.4Low209 Ų20999.9 Ų99.979%0.78956%0.555SS**Hα-helixtrans-73.9-31.4178.5-163.2178-162-176.74.3113.3K303 S304 Y305K303-R307 VanDerWaalsContact O-CB 3.3Å; K303-R307 WeakPolarHBondContact O-CB 3.38Å; K303-R307 PolarHBondContact O-N 3.43Å; S304-R307 PolarHBondContact O-N 3.16Å; Y305-R307 PolarHBondContact O-N 3.15Å
308N64Low57.8Low132 Ų132103.7 Ų103.771%0.70658%0.579SS**Hα-helixtrans-86.7-23.9-179.1-70.2-8.3000112.9S304 Y305S304-N308 WeakPolarHBondContact O-CB 3.44Å; S304-N308 PolarHBondContact O-N 2.65Å; S304-N308 PolarHBondContact O-ND2 3.01Å; Y305-N308 PolarHBondContact O-N 2.92Å
309D59.1Low56.3Low133 Ų133113.2 Ų113.271%0.71162%0.621SS**SBendtrans-89.5-5.4170.7-69.3-31.7000112.6Y305Y305-D309 PolarHBondContact O-N 3.48Å
310A40.9Very low54.5Low51 Ų51121.8 Ų121.842%0.42167%0.665SS.*SBendtrans-73.7127.2168.500000108.8I306 S312I306-A310 WeakPolarHBondContact O-CB 3.5Å; I306-A310 PolarHBondContact O-N 3.26Å; A310-S312 PolarHBondContact O-N 3.11Å
311P38.3Very low53.3Low105 Ų105122.9 Ų122.968%0.68267%0.672SS**  trans-55.9134.3173.123.1-30.7000108.5D313P311-D313 PolarHBondContact O-N 3.32Å
312S41.6Very low52.2Low111 Ų111128.6 Ų128.678%0.77670%0.703SS**SBendtrans-64.419.5-177.346.40000115.1A310 L314 G315A310-S312 PolarHBondContact O-N 3.11Å; S312-L314 VanDerWaalsContact C-N 3.33Å; S312-L314 PolarHBondContact O-N 3.27Å; S312-G315 PolarHBondContact O-N 3.42Å
313D38.3Very low51Low139 Ų139130.7 Ų130.774%0.74372%0.716SS**THydrogen-bonded Turntrans-88.213.3-172.8-73.7-20.7000114.8P311P311-D313 PolarHBondContact O-N 3.32Å
314L38.3Very low49.5Very low174 Ų174129.7 Ų129.791%0.91172%0.72SS**THydrogen-bonded Turntrans-101.923.2162.9-99.593.9000113.2S312S312-L314 VanDerWaalsContact C-N 3.33Å; S312-L314 PolarHBondContact O-N 3.27Å
315G36.3Very low47.7Very low65 Ų65134.7 Ų134.767%0.6774%0.744SS**SBendtrans-83.41.5-175.900000117.7S312S312-G315 PolarHBondContact O-N 3.42Å
316T36.9Very low46.1Very low138 Ų138138.3 Ų138.385%0.84777%0.772SS**SBendtrans-133.92.9-170.243.90000117.2
317A37.6Very low44.1Very low91 Ų91140.1 Ų140.175%0.75279%0.786SS**SBendtrans-95.1-1.6-169.600000117.6
318V38.8Very low41.8Very low139 Ų139134.8 Ų134.884%0.84279%0.785SS**  trans-140.479.7178.4-167.90000111.6
319K36.7Very low39.9Very low205 Ų205135 Ų13589%0.89179%0.792SS**  trans-135.890.2150.4-83.3-169.7178-1790107.8
320Q36.6Very low38.2Very low269 Ų269135.2 Ų135.2100%1.25780%0.799SS**  trans-133.50143.8-79.1-169.4-17.600106.6

Retrieved 320 of 320 residues in 226.9 ms (Link to these results)

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