A0A061I1T1_CRIGR Loading...

Transmembrane protein

AlphaFold DB , UniProt , Accession A0A061I1T1, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Tmem225, Length 230 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
1M42.5Very low70Confident206 Ų20692.7 Ų92.7100%1.01548%0.475SS*.  0103.80-162.5175.6-167.200107.1H3 R170M1-H3 PolarHBondContact O-N 3.38Å; M1-R170 PolarHBondContact SD-NH2 3.43Å
2I44.3Very low71.6Confident152 Ų15287.2 Ų87.278%0.77945%0.453SS*.  trans-73.9115.4-174.8-62169.9000107.7I4I2-I4 HydrophobicContact CG2-CG1 3.83Å; I2-I4 PolarHBondContact O-N 3.39Å; I2-I4 VanDerWaalsContact O-N 3.12Å
3H53.9Low73Confident171 Ų17180.5 Ų80.579%0.79242%0.419SS*.  trans-83.588177.9-149.3-14.3000108.5M1M1-H3 PolarHBondContact O-N 3.38Å
4I61.3Low74.4Confident93 Ų9377.4 Ų77.448%0.47741%0.405SS..  trans-73.7124.2176.1-54.5174.8000107.6I2 I9I2-I4 HydrophobicContact CG2-CG1 3.83Å; I2-I4 PolarHBondContact O-N 3.39Å; I2-I4 VanDerWaalsContact O-N 3.12Å; I4-I9 HydrophobicContact CB-CD1 4.33Å; I4-I9 HydrophobicContact CB-CG1 4.41Å; I4-I9 HydrophobicContact CG2-CD1 4.1Å; I4-I9 HydrophobicContact CG2-CG1 3.64Å
5P72.4Confident75.6Confident76 Ų7679.9 Ų79.949%0.49442%0.417SS..  trans-68139.9-179.924.2-28.3000110.2R7 S8 I9P5-R7 PolarHBondContact O-N 3.13Å; P5-S8 WeakPolarHBondContact CG-OG 3.48Å; P5-S8 WeakPolarHBondContact O-CB 3.42Å; P5-S8 PolarHBondContact O-N 3.17Å; P5-I9 PolarHBondContact O-N 2.93Å
6N75.3Confident76.5Confident51 Ų5178.5 Ų78.527%0.27341%0.407SS..Hα-helixtrans-54.7-32.4-174.9-166.630.4000112.9I9 L10 Q94 Q161N6-I9 PolarHBondContact O-N 3.48Å; N6-L10 PolarHBondContact O-N 3.12Å; N6-Q94 PolarHBondContact ND2-OE1 3.48Å; N6-Q161 PolarHBondContact O-NE2 3.25Å; N6-Q161 VanDerWaalsContact O-NE2 3.16Å; N6-Q161 WeakPolarHBondContact OD1-CG 3.28Å; N6-Q161 PolarHBondContact OD1-NE2 3.31Å
7R79.5Confident77.5Confident161 Ų16174 Ų7461%0.60838%0.384SS*.Hα-helixtrans-65.4-35.7177.4-170.7173.4179.3175-0.2113.3P5 L10 A11P5-R7 PolarHBondContact O-N 3.13Å; R7-L10 PolarHBondContact O-N 2.81Å; R7-A11 WeakPolarHBondContact O-CB 3.41Å; R7-A11 PolarHBondContact O-N 3.12Å
8S84.1Confident78.4Confident65 Ų6572.2 Ų72.246%0.45538%0.379SS..Hα-helixtrans-69.2-37.9176.9-63.50000111.7P5 A11 A12P5-S8 WeakPolarHBondContact CG-OG 3.48Å; P5-S8 WeakPolarHBondContact O-CB 3.42Å; P5-S8 PolarHBondContact O-N 3.17Å; S8-A11 PolarHBondContact O-N 2.98Å; S8-A12 WeakPolarHBondContact O-CB 3.43Å; S8-A12 PolarHBondContact O-N 3.48Å
9I83.5Confident79.2Confident9 Ų969.5 Ų69.55%0.04637%0.37CS..Hα-helixtrans-68.4-39.9176-54.2172000110.3I4 P5 N6 A12 N13 F157 Q161I4-I9 HydrophobicContact CB-CD1 4.33Å; I4-I9 HydrophobicContact CB-CG1 4.41Å; I4-I9 HydrophobicContact CG2-CD1 4.1Å; I4-I9 HydrophobicContact CG2-CG1 3.64Å; P5-I9 PolarHBondContact O-N 2.93Å; N6-I9 PolarHBondContact O-N 3.48Å; I9-A12 PolarHBondContact O-N 2.94Å; I9-N13 PolarHBondContact O-N 3.16Å; I9-F157 HydrophobicContact CG2-CB 3.82Å; I9-F157 HydrophobicContact CG2-CD1 4.08Å; I9-F157 HydrophobicContact CG2-CG 4.2Å; I9-Q161 HydrophobicContact CB-CG 3.91Å; I9-Q161 HydrophobicContact CD1-CG 4.1Å; I9-Q161 VanDerWaalsContact CG2-CD 3.5Å; I9-Q161 HydrophobicContact CG2-CG 3.51Å
10L86.3Confident79.9Confident3 Ų366 Ų662%0.01635%0.351CS..Hα-helixtrans-64.8-42.6176.4-17162.5000112N6 R7 A12 N13 V14 I84 Q87 F88 Q161N6-L10 PolarHBondContact O-N 3.12Å; R7-L10 PolarHBondContact O-N 2.81Å; L10-A12 VanDerWaalsContact C-N 3.33Å; L10-A12 PolarHBondContact O-N 3.44Å; L10-N13 WeakPolarHBondContact O-CB 3.36Å; L10-N13 PolarHBondContact O-N 3.03Å; L10-V14 WeakPolarHBondContact O-CG2 3.48Å; L10-V14 PolarHBondContact O-N 3.26Å; L10-V14 VanDerWaalsContact O-N 3.08Å; L10-I84 HydrophobicContact CD1-CG2 4.26Å; L10-Q87 HydrophobicContact CD1-CB 4.19Å; L10-Q87 HydrophobicContact CD2-CB 4.45Å; L10-F88 HydrophobicContact CD2-CB 4.21Å; L10-F88 HydrophobicContact CD2-CD2 4.28Å; L10-F88 HydrophobicContact CG-CB 4.32Å; L10-F88 HydrophobicContact CG-CD2 4.2Å; L10-Q161 VanDerWaalsContact N-NE2 3.19Å
11A86.7Confident80.5Confident33 Ų3364 Ų6427%0.27334%0.34SS..Hα-helixtrans-61.4-42.2174.200000111.8R7 S8 N13 V14 I15 F88R7-A11 WeakPolarHBondContact O-CB 3.41Å; R7-A11 PolarHBondContact O-N 3.12Å; S8-A11 PolarHBondContact O-N 2.98Å; A11-N13 VanDerWaalsContact C-N 3.34Å; A11-N13 PolarHBondContact O-N 3.37Å; A11-V14 PolarHBondContact O-N 3.36Å; A11-I15 WeakPolarHBondContact O-CG1 3.39Å; A11-I15 PolarHBondContact O-N 2.8Å; A11-I15 VanDerWaalsContact O-N 3.11Å; A11-F88 HydrophobicContact CB-CE2 4.07Å
12A89.1Confident83Confident26 Ų2658.4 Ų58.422%0.21532%0.317CS..Hα-helixtrans-61-43174.800000111.6S8 I9 L10 V14 I15 F16S8-A12 WeakPolarHBondContact O-CB 3.43Å; S8-A12 PolarHBondContact O-N 3.48Å; I9-A12 PolarHBondContact O-N 2.94Å; L10-A12 VanDerWaalsContact C-N 3.33Å; L10-A12 PolarHBondContact O-N 3.44Å; A12-V14 VanDerWaalsContact C-N 3.34Å; A12-V14 PolarHBondContact O-N 3.04Å; A12-I15 PolarHBondContact O-N 3.28Å; A12-I15 VanDerWaalsContact O-N 3.14Å; A12-F16 HydrophobicContact CB-CD2 4.24Å; A12-F16 HydrophobicContact CB-CE2 3.95Å; A12-F16 WeakPolarHBondContact O-CD2 3.01Å; A12-F16 WeakPolarHBondContact O-CG 3.39Å; A12-F16 PolarHBondContact O-N 3.04Å
13N90.2Very high85.2Confident1 Ų152.8 Ų52.81%0.00529%0.288CS..Hα-helixtrans-60.6-39.8176.3-75.6-19.3000113.1I9 L10 A11 I15 F16 S17 I84 F157 C158 Q161I9-N13 PolarHBondContact O-N 3.16Å; L10-N13 WeakPolarHBondContact O-CB 3.36Å; L10-N13 PolarHBondContact O-N 3.03Å; A11-N13 VanDerWaalsContact C-N 3.34Å; A11-N13 PolarHBondContact O-N 3.37Å; N13-I15 VanDerWaalsContact C-N 3.35Å; N13-F16 PolarHBondContact O-N 2.87Å; N13-S17 WeakPolarHBondContact O-CB 3.46Å; N13-S17 PolarHBondContact O-N 3.14Å; N13-I84 HydrophobicContact CB-CG2 4.1Å; N13-F157 WeakPolarHBondContact OD1-CB 3.47Å; N13-C158 PolarHBondContact ND2-SG 3.49Å; N13-Q161 PolarHBondContact ND2-OE1 2.98Å
14V92.1Very high86.9Confident36 Ų3644.8 Ų44.822%0.21825%0.251CS..Hα-helixtrans-61.4-45.4173.7175.50000110.6L10 A11 A12 S17 S18 I84 F88L10-V14 WeakPolarHBondContact O-CG2 3.48Å; L10-V14 PolarHBondContact O-N 3.26Å; L10-V14 VanDerWaalsContact O-N 3.08Å; A11-V14 PolarHBondContact O-N 3.36Å; A12-V14 VanDerWaalsContact C-N 3.34Å; A12-V14 PolarHBondContact O-N 3.04Å; V14-S17 PolarHBondContact O-N 3.47Å; V14-S18 VanDerWaalsContact O-CB 3.3Å; V14-S18 WeakPolarHBondContact O-CB 3.5Å; V14-S18 PolarHBondContact O-N 3.4Å; V14-S18 PolarHBondContact O-OG 3.42Å; V14-I84 HydrophobicContact CG2-CG2 3.63Å; V14-F88 HydrophobicContact CG2-CB 4.04Å; V14-F88 HydrophobicContact CG2-CD2 4.41Å; V14-F88 HydrophobicContact CG2-CG 4.26Å
15I92.6Very high88.2Confident115 Ų11543 Ų4359%0.5925%0.245SC*.Hα-helixtrans-64.3-45.3179.6-65.6166.6000110.8A11 A12 N13 S18 G19A11-I15 WeakPolarHBondContact O-CG1 3.39Å; A11-I15 PolarHBondContact O-N 2.8Å; A11-I15 VanDerWaalsContact O-N 3.11Å; A12-I15 PolarHBondContact O-N 3.28Å; A12-I15 VanDerWaalsContact O-N 3.14Å; N13-I15 VanDerWaalsContact C-N 3.35Å; I15-S18 PolarHBondContact O-OG 3.36Å; I15-S18 VanDerWaalsContact O-OG 3.04Å; I15-G19 PolarHBondContact O-N 3.13Å
16F90.9Very high89Confident58 Ų5842.1 Ų42.125%0.25424%0.238SC..Hα-helixtrans-67.2-42.3178.8-69.5-54.9000112.4A12 N13 G19 A20 F150 C154 F157A12-F16 HydrophobicContact CB-CD2 4.24Å; A12-F16 HydrophobicContact CB-CE2 3.95Å; A12-F16 WeakPolarHBondContact O-CD2 3.01Å; A12-F16 WeakPolarHBondContact O-CG 3.39Å; A12-F16 PolarHBondContact O-N 3.04Å; N13-F16 PolarHBondContact O-N 2.87Å; F16-G19 PolarHBondContact O-N 2.85Å; F16-A20 WeakPolarHBondContact O-CB 3.47Å; F16-A20 PolarHBondContact O-N 3.08Å; F16-F150 AromaticContact CD1-CD1 3.78Å; F16-F150 HydrophobicContact CD1-CD1 3.78Å; F16-F150 HydrophobicContact CD1-CE1 4.19Å; F16-F150 HydrophobicContact CD1-CG 4.37Å; F16-F150 HydrophobicContact CE1-CD1 4.27Å; F16-F150 HydrophobicContact CE1-CE1 4.35Å; F16-C154 HydrophobicContact CB-CB 4.49Å; F16-F157 HydrophobicContact CD2-CD2 4.02Å; F16-F157 AromaticContact CD2-CE2 3.91Å; F16-F157 HydrophobicContact CD2-CE2 3.91Å; F16-F157 AromaticContact CE2-CD2 3.94Å; F16-F157 HydrophobicContact CE2-CD2 3.94Å; F16-F157 AromaticContact CE2-CE2 3.37Å; F16-F157 HydrophobicContact CE2-CE2 3.37Å; F16-F157 HydrophobicContact CE2-CZ 4.27Å; F16-F157 HydrophobicContact CZ-CE2 4.17Å
17S92.9Very high89.4Confident2 Ų239.8 Ų39.81%0.01423%0.226CC..Hα-helixtrans-66.5-44.6178.9-176.40000112N13 V14 A20 I21 N81N13-S17 WeakPolarHBondContact O-CB 3.46Å; N13-S17 PolarHBondContact O-N 3.14Å; V14-S17 PolarHBondContact O-N 3.47Å; S17-A20 PolarHBondContact O-N 3.11Å; S17-I21 PolarHBondContact O-N 3.01Å; S17-N81 WeakPolarHBondContact OG-CA 3.47Å; S17-N81 WeakPolarHBondContact OG-CB 3.4Å
18S93.3Very high89.6Confident42 Ų4235.2 Ų35.229%0.29421%0.213SC..Hα-helixtrans-65-42.1174.457.80000112.1V14 I15 A20 I21 V22V14-S18 VanDerWaalsContact O-CB 3.3Å; V14-S18 WeakPolarHBondContact O-CB 3.5Å; V14-S18 PolarHBondContact O-N 3.4Å; V14-S18 PolarHBondContact O-OG 3.42Å; I15-S18 PolarHBondContact O-OG 3.36Å; I15-S18 VanDerWaalsContact O-OG 3.04Å; S18-A20 VanDerWaalsContact C-N 3.34Å; S18-A20 PolarHBondContact O-N 3.09Å; S18-I21 PolarHBondContact O-N 2.95Å; S18-V22 WeakPolarHBondContact O-CG2 3.07Å; S18-V22 PolarHBondContact O-N 3.3Å
19G93.4Very high89.5Confident20 Ų2037.7 Ų37.721%0.20622%0.22CC..Hα-helixtrans-58.7-42.517400000112.7I15 F16 I21 V22 M23I15-G19 PolarHBondContact O-N 3.13Å; F16-G19 PolarHBondContact O-N 2.85Å; G19-I21 PolarHBondContact O-N 3.47Å; G19-V22 PolarHBondContact O-N 3.41Å; G19-M23 VanDerWaalsContact O-CG 3.26Å; G19-M23 WeakPolarHBondContact O-CG 3.41Å; G19-M23 PolarHBondContact O-N 3.3Å
20A93.1Very high89.3Confident0 Ų041.1 Ų41.10%024%0.237CC..Hα-helixtrans-59.8-44.6175.800000111.9F16 S17 S18 M23 M24 F150 L151F16-A20 WeakPolarHBondContact O-CB 3.47Å; F16-A20 PolarHBondContact O-N 3.08Å; S17-A20 PolarHBondContact O-N 3.11Å; S18-A20 VanDerWaalsContact C-N 3.34Å; S18-A20 PolarHBondContact O-N 3.09Å; A20-M23 PolarHBondContact O-N 2.94Å; A20-M24 VanDerWaalsContact O-CG 3.29Å; A20-M24 WeakPolarHBondContact O-CG 3.1Å; A20-M24 PolarHBondContact O-N 3.39Å; A20-F150 HydrophobicContact CB-CB 3.99Å; A20-L151 HydrophobicContact CB-CD2 4.01Å; A20-L151 HydrophobicContact CB-CG 3.91Å
21I93.6Very high88.6Confident24 Ų2446.1 Ų46.112%0.12326%0.26CS..Hα-helixtrans-62.5-47.3177.3-67162.8000110.7S17 S18 G19 M23 M24 V25 I78 N81S17-I21 PolarHBondContact O-N 3.01Å; S18-I21 PolarHBondContact O-N 2.95Å; G19-I21 PolarHBondContact O-N 3.47Å; I21-M23 VanDerWaalsContact C-N 3.28Å; I21-M23 PolarHBondContact O-N 3.49Å; I21-M24 PolarHBondContact O-N 3.46Å; I21-M24 VanDerWaalsContact O-N 3.16Å; I21-V25 HydrophobicContact CG2-CG2 4.13Å; I21-V25 VanDerWaalsContact O-CG2 3.31Å; I21-V25 WeakPolarHBondContact O-CG2 3.49Å; I21-V25 PolarHBondContact O-N 3.48Å; I21-I78 HydrophobicContact CD1-CG1 4.28Å; I21-I78 HydrophobicContact CG2-CG1 4.5Å; I21-N81 HydrophobicContact CD1-CB 3.47Å; I21-N81 VanDerWaalsContact CD1-CB 3.47Å; I21-N81 VanDerWaalsContact CD1-ND2 3.35Å; I21-N81 WeakPolarHBondContact CD1-ND2 3.4Å
22V93.8Very high88Confident88 Ų8847.9 Ų47.953%0.53327%0.265SS..Hα-helixtrans-57.1-45.6178.3172.20000110.4S18 G19 M24 V25 V26S18-V22 WeakPolarHBondContact O-CG2 3.07Å; S18-V22 PolarHBondContact O-N 3.3Å; G19-V22 PolarHBondContact O-N 3.41Å; V22-M24 VanDerWaalsContact C-N 3.34Å; V22-M24 PolarHBondContact O-N 3.23Å; V22-V25 PolarHBondContact O-N 3.24Å; V22-V26 HydrophobicContact CG1-CG2 4.4Å; V22-V26 VanDerWaalsContact O-CG2 3.3Å; V22-V26 WeakPolarHBondContact O-CG2 3.39Å; V22-V26 PolarHBondContact O-N 3.48Å
23M91.1Very high87.4Confident34 Ų3446.9 Ų46.917%0.16726%0.255CS..Hα-helixtrans-65.7-35.7179.2-67-58-107.300113G19 A20 I21 G27 T143 L146 A147 F150G19-M23 VanDerWaalsContact O-CG 3.26Å; G19-M23 WeakPolarHBondContact O-CG 3.41Å; G19-M23 PolarHBondContact O-N 3.3Å; A20-M23 PolarHBondContact O-N 2.94Å; I21-M23 VanDerWaalsContact C-N 3.28Å; I21-M23 PolarHBondContact O-N 3.49Å; M23-G27 PolarHBondContact O-N 3.31Å; M23-T143 HydrophobicContact CE-CG2 3.89Å; M23-T143 HydrophobicContact SD-CG2 4.38Å; M23-L146 HydrophobicContact CE-CB 4.19Å; M23-L146 HydrophobicContact CE-CD2 3.41Å; M23-L146 VanDerWaalsContact CE-CD2 3.41Å; M23-L146 HydrophobicContact CE-CG 4.05Å; M23-A147 HydrophobicContact CB-CB 3.9Å; M23-F150 HydrophobicContact CG-CE2 4.33Å
24M89.3Confident86.8Confident3 Ų346.8 Ų46.82%0.01526%0.255CS..Hα-helixtrans-68.8-40.2173.5-70.4-179.766.600112.2A20 I21 V22 G27 L28 S73 L74 M113 A147A20-M24 VanDerWaalsContact O-CG 3.29Å; A20-M24 WeakPolarHBondContact O-CG 3.1Å; A20-M24 PolarHBondContact O-N 3.39Å; I21-M24 PolarHBondContact O-N 3.46Å; I21-M24 VanDerWaalsContact O-N 3.16Å; V22-M24 VanDerWaalsContact C-N 3.34Å; V22-M24 PolarHBondContact O-N 3.23Å; M24-G27 WeakPolarHBondContact O-CA 3.39Å; M24-G27 PolarHBondContact O-N 3.43Å; M24-L28 PolarHBondContact O-N 3.17Å; M24-S73 WeakPolarHBondContact CE-OG 3.34Å; M24-L74 HydrophobicContact CB-CD1 3.82Å; M24-L74 HydrophobicContact CE-CB 3.81Å; M24-L74 HydrophobicContact CE-CD1 4.14Å; M24-L74 HydrophobicContact SD-CD1 4.5Å; M24-M113 HydrophobicContact CE-CE 3.71Å; M24-M113 HydrophobicContact CE-CG 4.09Å; M24-M113 HydrophobicContact CE-SD 3.51Å; M24-M113 VanDerWaalsContact CE-SD 3.51Å; M24-M113 HydrophobicContact CG-CE 4.09Å; M24-M113 HydrophobicContact SD-CE 4.21Å; M24-M113 HydrophobicContact SD-CG 4.49Å; M24-M113 HydrophobicContact SD-SD 4.47Å; M24-A147 HydrophobicContact CG-CB 3.85Å
25V90.1Very high86Confident56 Ų5647.4 Ų47.434%0.33926%0.256SS..Hα-helixtrans-67.3-42.1177171.50000111.3I21 V22 G27 L28 I29 L74I21-V25 HydrophobicContact CG2-CG2 4.13Å; I21-V25 VanDerWaalsContact O-CG2 3.31Å; I21-V25 WeakPolarHBondContact O-CG2 3.49Å; I21-V25 PolarHBondContact O-N 3.48Å; V22-V25 PolarHBondContact O-N 3.24Å; V25-G27 VanDerWaalsContact C-N 3.25Å; V25-G27 PolarHBondContact O-N 3.29Å; V25-L28 WeakPolarHBondContact O-CB 3.44Å; V25-L28 PolarHBondContact O-N 2.96Å; V25-I29 HydrophobicContact CG1-CD1 3.84Å; V25-I29 HydrophobicContact CG1-CG1 4.43Å; V25-I29 WeakPolarHBondContact O-CG1 3.43Å; V25-I29 PolarHBondContact O-N 2.98Å; V25-L74 HydrophobicContact CG2-CD1 4.24Å
26V88.4Confident84.9Confident58 Ų5842.5 Ų42.535%0.35223%0.231SC..Hα-helixtrans-57.9-43.3171.5169.70000110.1V22 L28 I29 M30V22-V26 HydrophobicContact CG1-CG2 4.4Å; V22-V26 VanDerWaalsContact O-CG2 3.3Å; V22-V26 WeakPolarHBondContact O-CG2 3.39Å; V22-V26 PolarHBondContact O-N 3.48Å; V26-L28 VanDerWaalsContact C-N 3.31Å; V26-L28 PolarHBondContact O-N 2.97Å; V26-I29 PolarHBondContact O-N 3.23Å; V26-M30 HydrophobicContact CG1-CG 4.32Å; V26-M30 WeakPolarHBondContact O-CB 3.39Å; V26-M30 WeakPolarHBondContact O-CG 3.26Å; V26-M30 PolarHBondContact O-N 2.98Å; V26-M30 VanDerWaalsContact O-N 3.12Å
27G83.7Confident84Confident2 Ų243.2 Ų43.22%0.02124%0.236CC..Hα-helixtrans-57.7-42.1172.900000113M23 M24 V25 W33M23-G27 PolarHBondContact O-N 3.31Å; M24-G27 WeakPolarHBondContact O-CA 3.39Å; M24-G27 PolarHBondContact O-N 3.43Å; V25-G27 VanDerWaalsContact C-N 3.25Å; V25-G27 PolarHBondContact O-N 3.29Å; G27-W33 VanDerWaalsContact O-CE2 3.3Å; G27-W33 WeakPolarHBondContact O-CZ2 3.3Å; G27-W33 PolarHBondContact O-NE1 3.44Å
28L82.8Confident82.7Confident65 Ų6544 Ų4434%0.3424%0.241SC..Hα-helixtrans-66.4-43.4-179.5-173.8155.1000112.7M24 V25 V26 M30 W50 L74M24-L28 PolarHBondContact O-N 3.17Å; V25-L28 WeakPolarHBondContact O-CB 3.44Å; V25-L28 PolarHBondContact O-N 2.96Å; V26-L28 VanDerWaalsContact C-N 3.31Å; V26-L28 PolarHBondContact O-N 2.97Å; L28-M30 VanDerWaalsContact C-N 3.32Å; L28-W50 HydrophobicContact CB-CD2 4.01Å; L28-W50 HydrophobicContact CB-CE3 4.12Å; L28-W50 HydrophobicContact CB-CG 4.38Å; L28-W50 HydrophobicContact CB-CZ3 4.42Å; L28-W50 HydrophobicContact CD1-CD2 4.41Å; L28-W50 HydrophobicContact CD1-CE3 3.68Å; L28-W50 HydrophobicContact CD1-CH2 4.39Å; L28-W50 HydrophobicContact CD1-CZ3 3.69Å; L28-W50 HydrophobicContact CG-CD2 4.02Å; L28-W50 HydrophobicContact CG-CE3 3.75Å; L28-W50 HydrophobicContact CG-CG 4.39Å; L28-W50 HydrophobicContact CG-CZ3 4.21Å; L28-L74 HydrophobicContact CD1-CD2 4.07Å
29I82.2Confident81.2Confident116 Ų11647.2 Ų47.260%0.59525%0.25SS*.Hα-helixtrans-71-31.5-178.2-64.6167.5000111.2V25 V26 E31V25-I29 HydrophobicContact CG1-CD1 3.84Å; V25-I29 HydrophobicContact CG1-CG1 4.43Å; V25-I29 WeakPolarHBondContact O-CG1 3.43Å; V25-I29 PolarHBondContact O-N 2.98Å; V26-I29 PolarHBondContact O-N 3.23Å; I29-E31 PolarHBondContact O-N 3.47Å
30M80.6Confident79.5Confident82 Ų8255.4 Ų55.440%0.40429%0.285SS..  trans-75.5118.7-176.9-70-68.7-95.300111.2V26 L28 N32 W33 S48 V140V26-M30 HydrophobicContact CG1-CG 4.32Å; V26-M30 WeakPolarHBondContact O-CB 3.39Å; V26-M30 WeakPolarHBondContact O-CG 3.26Å; V26-M30 PolarHBondContact O-N 2.98Å; V26-M30 VanDerWaalsContact O-N 3.12Å; L28-M30 VanDerWaalsContact C-N 3.32Å; M30-N32 VanDerWaalsContact C-N 3.29Å; M30-W33 PolarHBondContact O-NE1 3.39Å; M30-W33 VanDerWaalsContact O-NE1 3.08Å; M30-S48 PolarHBondContact O-OG 3.47Å; M30-V140 HydrophobicContact CB-CB 4.45Å; M30-V140 HydrophobicContact CB-CG1 3.78Å; M30-V140 HydrophobicContact CB-CG2 3.77Å; M30-V140 HydrophobicContact CE-CG2 3.87Å; M30-V140 HydrophobicContact CG-CG1 4.36Å; M30-V140 HydrophobicContact CG-CG2 4.04Å
31E70.1Confident77.9Confident108 Ų10863.9 Ų63.951%0.50532%0.317SS..SBendtrans-81.8-13.9179.4-45.8-154.514400112.5I29 W33 H47 S48 L51I29-E31 PolarHBondContact O-N 3.47Å; E31-W33 PolarHBondContact O-N 3.14Å; E31-H47 CarbonylContact O-C 3.58Å; E31-S48 WeakPolarHBondContact O-CB 3.35Å; E31-L51 HydrophobicContact CB-CD1 3.41Å; E31-L51 VanDerWaalsContact CB-CD1 3.41Å; E31-L51 HydrophobicContact CG-CD1 3.51Å
32N74.2Confident76.1Confident70 Ų7072.8 Ų72.837%0.37436%0.355SS..  trans-106.155.6-166.2-51.9-25.3000111.5M30 T46 K138M30-N32 VanDerWaalsContact C-N 3.29Å; N32-T46 HydrophobicContact CB-CG2 4.26Å; N32-K138 VanDerWaalsContact O-CB 3.27Å; N32-K138 WeakPolarHBondContact O-CB 3.3Å; N32-K138 VanDerWaalsContact O-CG 3.29Å; N32-K138 WeakPolarHBondContact O-CG 3.38Å
33W77.9Confident74.6Confident4 Ų473.6 Ų73.62%0.01536%0.356CS..SBendtrans-72.6-44.1179.9-77.655.4000111.7G27 M30 E31 H47 S48 P49 W50 M70 K138 V140 V141 A144G27-W33 VanDerWaalsContact O-CE2 3.3Å; G27-W33 WeakPolarHBondContact O-CZ2 3.3Å; G27-W33 PolarHBondContact O-NE1 3.44Å; M30-W33 PolarHBondContact O-NE1 3.39Å; M30-W33 VanDerWaalsContact O-NE1 3.08Å; E31-W33 PolarHBondContact O-N 3.14Å; W33-H47 WeakPolarHBondContact CB-O 3.21Å; W33-H47 PolarHBondContact N-O 3.05Å; W33-S48 VanDerWaalsContact CD1-OG 3.28Å; W33-S48 PolarHBondContact NE1-OG 3.36Å; W33-P49 HydrophobicContact CD2-CG 3.78Å; W33-P49 HydrophobicContact CE3-CG 3.71Å; W33-P49 VanDerWaalsContact CG-CD 3.49Å; W33-P49 HydrophobicContact CG-CG 4.3Å; W33-P49 HydrophobicContact CH2-CG 4.45Å; W33-P49 HydrophobicContact CZ2-CG 4.49Å; W33-P49 HydrophobicContact CZ3-CG 4.06Å; W33-W50 AromaticContact CE2-CD1 3.64Å; W33-W50 AromaticContact CE2-NE1 3.64Å; W33-W50 AromaticContact CH2-NE1 3.6Å; W33-W50 AromaticContact CZ2-CD1 3.56Å; W33-W50 AromaticContact CZ2-NE1 3.02Å; W33-W50 AromaticContact NE1-CD1 3.66Å; W33-M70 HydrophobicContact CH2-CE 3.78Å; W33-M70 HydrophobicContact CZ3-CE 4.19Å; W33-K138 WeakPolarHBondContact O-CB 3.38Å; W33-K138 PolarHBondContact O-N 3.26Å; W33-V140 HydrophobicContact CD2-CG1 3.97Å; W33-V140 VanDerWaalsContact CE2-CG1 3.49Å; W33-V140 HydrophobicContact CG-CB 4.46Å; W33-V140 HydrophobicContact CG-CG1 4.14Å; W33-V140 HydrophobicContact CZ2-CG1 3.87Å; W33-V141 HydrophobicContact CE3-CG2 3.81Å; W33-V141 HydrophobicContact CZ3-CG2 4.34Å; W33-A144 HydrophobicContact CH2-CB 3.78Å; W33-A144 HydrophobicContact CZ3-CB 4.11Å
34V76.2Confident73.4Confident0 Ų079.5 Ų79.50%038%0.381CS..EExtended strand (participates in β ladder)trans-136.5134.7-178.3-179.80000109.3L36 T46 H47 Y120 L124 Y135V34-L36 HydrophobicContact CG1-CD2 4.13Å; V34-L36 HydrophobicContact CG1-CG 4.39Å; V34-T46 WeakPolarHBondContact O-CA 3.45Å; V34-H47 PolarHBondContact N-O 3.4Å; V34-H47 VanDerWaalsContact N-O 3.13Å; V34-H47 PolarHBondContact O-N 2.78Å; V34-Y120 HydrophobicContact CG2-CE1 4.1Å; V34-L124 HydrophobicContact CG1-CD2 4.46Å; V34-L124 HydrophobicContact CG2-CD1 3.83Å; V34-Y135 HydrophobicContact CG1-CD2 3.75Å; V34-Y135 HydrophobicContact CG1-CG 4.14Å
35E75.3Confident72.4Confident49 Ų4981.5 Ų81.523%0.22939%0.393CS..EExtended strand (participates in β ladder)trans-90.6121.3165-76.4175.2172.600108.8T46 Y135 K136 K138E35-T46 HydrophobicContact CG-CG2 4.25Å; E35-Y135 CarbonylContact O-C 3.43Å; E35-Y135 WeakPolarHBondContact O-CA 3.45Å; E35-K136 HydrophobicContact CB-CB 4.4Å; E35-K136 PolarHBondContact N-O 3.13Å; E35-K136 PolarHBondContact O-N 2.95Å; E35-K138 WeakPolarHBondContact OE1-CE 3.49Å; E35-K138 IonicContact OE1-NZ 2.66Å; E35-K138 PolarHBondContact OE1-NZ 3.08Å; E35-K138 WeakPolarHBondContact OE2-CE 3.4Å; E35-K138 IonicContact OE2-NZ 3.23Å; E35-K138 PolarHBondContact OE2-NZ 2.88Å
36L70.1Confident71.4Confident12 Ų1282 Ų826%0.06340%0.397CS..EExtended strand (participates in β ladder)trans-98.7134.4177.3-63.5165000109.3V34 P38 T45 H47 L124 F132V34-L36 HydrophobicContact CG1-CD2 4.13Å; V34-L36 HydrophobicContact CG1-CG 4.39Å; L36-P38 WeakPolarHBondContact O-CD 3.36Å; L36-T45 PolarHBondContact N-O 3.24Å; L36-T45 PolarHBondContact O-N 3.22Å; L36-H47 HydrophobicContact CD1-CB 3.64Å; L36-H47 HydrophobicContact CG-CB 4.4Å; L36-L124 HydrophobicContact CD2-CD2 4.27Å; L36-F132 HydrophobicContact CB-CD1 3.95Å; L36-F132 HydrophobicContact CB-CE1 3.82Å; L36-F132 HydrophobicContact CB-CZ 4.45Å; L36-F132 HydrophobicContact CD1-CE1 3.95Å; L36-F132 HydrophobicContact CD1-CZ 3.8Å; L36-F132 HydrophobicContact CD2-CD1 4.21Å; L36-F132 HydrophobicContact CD2-CD2 4.12Å; L36-F132 HydrophobicContact CD2-CE1 4.11Å; L36-F132 HydrophobicContact CD2-CE2 4.02Å; L36-F132 HydrophobicContact CD2-CG 4.22Å; L36-F132 HydrophobicContact CD2-CZ 4.01Å; L36-F132 HydrophobicContact CG-CE1 4.18Å; L36-F132 HydrophobicContact CG-CZ 4.32Å
37I71Confident70.7Confident72 Ų7280 Ų8037%0.36938%0.384SS..EExtended strand (participates in β ladder)trans-10997.9172.8-56.5173.1000107.7I133 S134I37-I133 PolarHBondContact O-N 3.43Å; I37-S134 PolarHBondContact N-O 3.19Å; I37-S134 VanDerWaalsContact N-O 3.14Å
38P67.4Low70.2Confident19 Ų1980 Ų8012%0.12338%0.383CS..EExtended strand (participates in β ladder)trans-71.7148.4-176.819.1-18000112.4L36 M40 R41 F132L36-P38 WeakPolarHBondContact O-CD 3.36Å; P38-M40 VanDerWaalsContact C-N 3.31Å; P38-M40 PolarHBondContact O-N 3.36Å; P38-R41 HydrophobicContact CG-CB 4.06Å; P38-R41 WeakPolarHBondContact CG-O 3.17Å; P38-F132 HydrophobicContact CB-CD1 4.27Å
39K61.7Low69.5Low110 Ų11077 Ų7748%0.47837%0.367SS..SBendtrans-65.4-32.3177.3-78.7174179.2166.10113L129 Y131 F132 I133K39-L129 PolarHBondContact NZ-O 3.44Å; K39-Y131 PolarHBondContact N-O 3.27Å; K39-F132 VanDerWaalsContact CE-O 3.26Å; K39-F132 WeakPolarHBondContact CE-O 3.3Å; K39-I133 HydrophobicContact CB-CG1 4.31Å; K39-I133 HydrophobicContact CG-CD1 4.28Å; K39-I133 HydrophobicContact CG-CG1 3.45Å; K39-I133 VanDerWaalsContact CG-CG1 3.45Å
40M57.9Low68.9Low191 Ų19172 Ų7294%0.94134%0.341SS*.SBendtrans-106.4-14.6-168.8-64.4-65-172.800114.9P38P38-M40 VanDerWaalsContact C-N 3.31Å; P38-M40 PolarHBondContact O-N 3.36Å
41R59.1Low68.2Low179 Ų17971 Ų7168%0.67534%0.337SS*.  trans-127.3133.2-176.2-144.3176.5-173.6165.43.5109.2P38 D43P38-R41 HydrophobicContact CG-CB 4.06Å; P38-R41 WeakPolarHBondContact CG-O 3.17Å; R41-D43 PolarHBondContact O-N 2.99Å
42K56.3Low67.4Low210 Ų21067.8 Ų67.891%0.91333%0.334SS*.SBendtrans-75.9-13.4-179-75.9-1771781780113.5
43D61.2Low66.2Low106 Ų10670.2 Ų70.257%0.56736%0.355SS*.SBendtrans-82.8127.9-178.6-57.1-36.4000111R41R41-D43 PolarHBondContact O-N 2.99Å
44K66.3Low65Low158 Ų15872.1 Ų72.169%0.68737%0.368SS*.  trans-70.5130175.5-62.8174.1-176.6172.80108.8
45T69Low64Low44 Ų4475.8 Ų75.827%0.2739%0.392SS..EExtended strand (participates in β ladder)trans-110.1132.5175.153.50000110.1L36L36-T45 PolarHBondContact N-O 3.24Å; L36-T45 PolarHBondContact O-N 3.22Å
46T68.4Low62.9Low68 Ų6879 Ų7942%0.41743%0.426SS..EExtended strand (participates in β ladder)trans-85.2144.7169.147.80000109.3N32 V34 E35N32-T46 HydrophobicContact CB-CG2 4.26Å; V34-T46 WeakPolarHBondContact O-CA 3.45Å; E35-T46 HydrophobicContact CG-CG2 4.25Å
47H73.1Confident62.3Low15 Ų1582.3 Ų82.37%0.06944%0.444CS..EExtended strand (participates in β ladder)trans-136.1140177.8-179.8-116.5000110E31 W33 V34 L36 C54 W58 Y120E31-H47 CarbonylContact O-C 3.58Å; W33-H47 WeakPolarHBondContact CB-O 3.21Å; W33-H47 PolarHBondContact N-O 3.05Å; V34-H47 PolarHBondContact N-O 3.4Å; V34-H47 VanDerWaalsContact N-O 3.13Å; V34-H47 PolarHBondContact O-N 2.78Å; L36-H47 HydrophobicContact CD1-CB 3.64Å; L36-H47 HydrophobicContact CG-CB 4.4Å; H47-C54 PolarHBondContact CD2-SG 3.33Å; H47-C54 PolarHBondContact NE2-SG 3.43Å; H47-W58 AromaticContact CE1-CZ3 3.99Å; H47-Y120 AromaticContact CE1-CE2 3.74Å; H47-Y120 AromaticContact ND1-CE2 3.9Å; H47-Y120 AromaticContact ND1-CZ 3.89Å; H47-Y120 PolarHBondContact ND1-OH 3Å
48S72.7Confident61.8Low2 Ų280.7 Ų80.71%0.01443%0.433CS..  trans-128.2136.8174.71770000109.7M30 E31 W33 W50 L51M30-S48 PolarHBondContact O-OG 3.47Å; E31-S48 WeakPolarHBondContact O-CB 3.35Å; W33-S48 VanDerWaalsContact CD1-OG 3.28Å; W33-S48 PolarHBondContact NE1-OG 3.36Å; S48-W50 PolarHBondContact O-N 3.46Å; S48-W50 VanDerWaalsContact O-N 3.16Å; S48-W50 PolarHBondContact OG-N 2.97Å; S48-L51 PolarHBondContact O-N 3.45Å
49P69.4Low61.5Low1 Ų183.6 Ų83.61%0.00645%0.452CS..THydrogen-bonded Turntrans-64.5-13.7173.724.5-28.9000113.6W33 I66 M70 Y120W33-P49 HydrophobicContact CD2-CG 3.78Å; W33-P49 HydrophobicContact CE3-CG 3.71Å; W33-P49 VanDerWaalsContact CG-CD 3.49Å; W33-P49 HydrophobicContact CG-CG 4.3Å; W33-P49 HydrophobicContact CH2-CG 4.45Å; W33-P49 HydrophobicContact CZ2-CG 4.49Å; W33-P49 HydrophobicContact CZ3-CG 4.06Å; P49-I66 HydrophobicContact CB-CG2 4.41Å; P49-M70 HydrophobicContact CB-SD 4.1Å; P49-M70 HydrophobicContact CG-CE 4.44Å; P49-M70 HydrophobicContact CG-SD 4.22Å; P49-Y120 HydrophobicContact CB-CD2 3.81Å; P49-Y120 HydrophobicContact CB-CE2 3.69Å; P49-Y120 HydrophobicContact CB-CG 4.36Å; P49-Y120 HydrophobicContact CG-CD2 4.43Å; P49-Y120 HydrophobicContact CG-CE1 4.32Å; P49-Y120 HydrophobicContact CG-CE2 4.16Å
50W69.1Low61.7Low13 Ų1385.8 Ų85.85%0.04946%0.464CS..THydrogen-bonded Turntrans-91.9-26.8-176.8-6295.1000114L28 W33 S48 R67 M70 L71L28-W50 HydrophobicContact CB-CD2 4.01Å; L28-W50 HydrophobicContact CB-CE3 4.12Å; L28-W50 HydrophobicContact CB-CG 4.38Å; L28-W50 HydrophobicContact CB-CZ3 4.42Å; L28-W50 HydrophobicContact CD1-CD2 4.41Å; L28-W50 HydrophobicContact CD1-CE3 3.68Å; L28-W50 HydrophobicContact CD1-CH2 4.39Å; L28-W50 HydrophobicContact CD1-CZ3 3.69Å; L28-W50 HydrophobicContact CG-CD2 4.02Å; L28-W50 HydrophobicContact CG-CE3 3.75Å; L28-W50 HydrophobicContact CG-CG 4.39Å; L28-W50 HydrophobicContact CG-CZ3 4.21Å; W33-W50 AromaticContact CE2-CD1 3.64Å; W33-W50 AromaticContact CE2-NE1 3.64Å; W33-W50 AromaticContact CH2-NE1 3.6Å; W33-W50 AromaticContact CZ2-CD1 3.56Å; W33-W50 AromaticContact CZ2-NE1 3.02Å; W33-W50 AromaticContact NE1-CD1 3.66Å; S48-W50 PolarHBondContact O-N 3.46Å; S48-W50 VanDerWaalsContact O-N 3.16Å; S48-W50 PolarHBondContact OG-N 2.97Å; W50-R67 PolarHBondContact O-NE 3.47Å; W50-M70 HydrophobicContact CE3-CB 4.44Å; W50-M70 HydrophobicContact CH2-CB 3.45Å; W50-M70 VanDerWaalsContact CH2-CB 3.45Å; W50-M70 WeakPolarHBondContact CH2-O 3.49Å; W50-M70 HydrophobicContact CZ2-CB 3.78Å; W50-M70 HydrophobicContact CZ2-CE 3.56Å; W50-M70 HydrophobicContact CZ2-CG 4.4Å; W50-M70 HydrophobicContact CZ2-SD 4.12Å; W50-M70 HydrophobicContact CZ3-CB 3.79Å; W50-L71 HydrophobicContact CZ3-CD2 4.12Å; W50-L71 HydrophobicContact CZ3-CG 4.23Å
51L65.2Low62.1Low59 Ų5983 Ų8331%0.30945%0.453SS..  trans-85.5128-177.6-72.9161.5000110.2E31 S48 C53E31-L51 HydrophobicContact CB-CD1 3.41Å; E31-L51 VanDerWaalsContact CB-CD1 3.41Å; E31-L51 HydrophobicContact CG-CD1 3.51Å; S48-L51 PolarHBondContact O-N 3.45Å; L51-C53 VanDerWaalsContact C-N 3.25Å; L51-C53 PolarHBondContact O-N 3.22Å
52G53.2Low62.5Low42 Ų4275.7 Ų75.743%0.43343%0.429SS..SBendtrans-74.2-14.4175.400000113.8C54G52-C54 PolarHBondContact O-N 3Å
53C49Very low63.5Low121 Ų12166.3 Ų66.382%0.81839%0.389SS*.  trans-88.791.8177.3-76.40000110.1L51L51-C53 VanDerWaalsContact C-N 3.25Å; L51-C53 PolarHBondContact O-N 3.22Å
54C54.4Low64.6Low43 Ų4368.4 Ų68.429%0.29139%0.393SS..  trans-91.9149.8160.5-73.20000110H47 G52H47-C54 PolarHBondContact CD2-SG 3.33Å; H47-C54 PolarHBondContact NE2-SG 3.43Å; G52-C54 PolarHBondContact O-N 3Å
55P54.6Low65.5Low77 Ų7765.3 Ų65.350%0.538%0.383SS..  trans-59.1152.8154.68.43.3000108L57P55-L57 PolarHBondContact O-N 2.73Å
56A52.7Low66.3Low116 Ų11663.2 Ų63.296%0.95937%0.37SS*.THydrogen-bonded Turntrans-56.813.4-172.900000117.5
57L55.9Low67.2Low82 Ų8264.8 Ų64.843%0.42937%0.368SS..THydrogen-bonded Turntrans-88.7-10.1-172.4-143.579.9000114.3P55 Y131 F132P55-L57 PolarHBondContact O-N 2.73Å; L57-Y131 HydrophobicContact CD2-CG 4.43Å; L57-Y131 HydrophobicContact CG-CD1 4.23Å; L57-Y131 HydrophobicContact CG-CG 4.43Å; L57-F132 HydrophobicContact CD2-CE1 3.54Å; L57-F132 HydrophobicContact CD2-CE2 4.47Å; L57-F132 HydrophobicContact CD2-CZ 3.53Å
58W62Low67.9Low38 Ų3867 Ų6714%0.14439%0.385CS..SBendtrans-127.5140.4-174.2-117.943.2000113.4H47 E60 L63 Y120 K123 L124H47-W58 AromaticContact CE1-CZ3 3.99Å; W58-E60 PolarHBondContact O-N 2.92Å; W58-L63 HydrophobicContact CE3-CD1 3.64Å; W58-L63 HydrophobicContact CZ3-CD1 3.36Å; W58-Y120 HydrophobicContact CH2-CD2 4.45Å; W58-Y120 HydrophobicContact CH2-CE2 4.43Å; W58-K123 HydrophobicContact CH2-CB 3.45Å; W58-K123 VanDerWaalsContact CH2-CB 3.45Å; W58-K123 HydrophobicContact CH2-CD 4.28Å; W58-K123 HydrophobicContact CZ2-CB 3.7Å; W58-K123 HydrophobicContact CZ3-CB 4.4Å; W58-K123 HydrophobicContact CZ3-CD 4.5Å; W58-L124 HydrophobicContact CZ2-CD2 4.4Å
59P61.2Low68.7Low81 Ų8168.3 Ų68.353%0.52639%0.392SS..  trans-70.5118.518026-31.1000111.5D61 S62P59-D61 PolarHBondContact O-N 3.21Å; P59-S62 WeakPolarHBondContact O-CB 3.49Å; P59-S62 PolarHBondContact O-N 3.37Å; P59-S62 PolarHBondContact O-OG 3.5Å; P59-S62 VanDerWaalsContact O-OG 3.11Å
60E64.4Low69.7Low156 Ų15668.3 Ų68.373%0.72939%0.392SS*.Hα-helixtrans-61.7-42.6-170.1-139.3171.2-16300113.1W58 S62 L63 K64W58-E60 PolarHBondContact O-N 2.92Å; E60-S62 PolarHBondContact O-N 2.81Å; E60-S62 VanDerWaalsContact O-N 3.13Å; E60-L63 PolarHBondContact O-N 3.38Å; E60-K64 PolarHBondContact O-N 2.9Å
61D67.1Low70.7Confident133 Ų13370.7 Ų70.771%0.71141%0.405SS*.Hα-helixtrans-57.2-34179.9-65.9-39.7000112.7P59P59-D61 PolarHBondContact O-N 3.21Å
62S67.9Low71.9Confident24 Ų2472.9 Ų72.917%0.16842%0.415CS..Hα-helixtrans-78.1-35.5-173.2106.70000110.8P59 E60 K123P59-S62 WeakPolarHBondContact O-CB 3.49Å; P59-S62 PolarHBondContact O-N 3.37Å; P59-S62 PolarHBondContact O-OG 3.5Å; P59-S62 VanDerWaalsContact O-OG 3.11Å; E60-S62 PolarHBondContact O-N 2.81Å; E60-S62 VanDerWaalsContact O-N 3.13Å; S62-K123 PolarHBondContact O-NZ 3.29Å; S62-K123 PolarHBondContact OG-NZ 3.46Å
63L76.9Confident73.8Confident13 Ų1370.9 Ų70.97%0.06839%0.394CS..Hα-helixtrans-74.1-34.7175.7-161.882.5000110.7W58 E60 I65 I66 R67W58-L63 HydrophobicContact CE3-CD1 3.64Å; W58-L63 HydrophobicContact CZ3-CD1 3.36Å; E60-L63 PolarHBondContact O-N 3.38Å; L63-I65 VanDerWaalsContact C-N 3.31Å; L63-I65 PolarHBondContact O-N 3.34Å; L63-I66 PolarHBondContact O-N 3.43Å; L63-I66 VanDerWaalsContact O-N 3.15Å; L63-R67 WeakPolarHBondContact O-CB 3.36Å; L63-R67 PolarHBondContact O-N 3.25Å
64K83.3Confident75.9Confident151 Ų15165.9 Ų65.966%0.65736%0.36SS*.Hα-helixtrans-56.1-41.6178.2-170.9177-179.21780112.8E60 S68E60-K64 PolarHBondContact O-N 2.9Å; K64-S68 VanDerWaalsContact O-CB 3.27Å; K64-S68 WeakPolarHBondContact O-CB 3.35Å; K64-S68 PolarHBondContact O-N 2.93Å
65I85.4Confident77.7Confident92 Ų9267.7 Ų67.747%0.47237%0.366SS..Hα-helixtrans-63.5-47177.2-63.7169.4000111L63 S68 L69 M119L63-I65 VanDerWaalsContact C-N 3.31Å; L63-I65 PolarHBondContact O-N 3.34Å; I65-S68 WeakPolarHBondContact O-CB 3.49Å; I65-S68 PolarHBondContact O-N 3.02Å; I65-L69 HydrophobicContact CG2-CD1 4.05Å; I65-L69 WeakPolarHBondContact O-CG 3.32Å; I65-L69 PolarHBondContact O-N 3.26Å; I65-M119 HydrophobicContact CG2-CE 4.34Å; I65-M119 HydrophobicContact CG2-SD 4.42Å
66I86.7Confident79.6Confident0 Ų065.5 Ų65.50%035%0.35CS..Hα-helixtrans-61.9-48.4179.8-65.1168.5000109.8P49 L63 S68 L69 M70 M119 Y120 K123P49-I66 HydrophobicContact CB-CG2 4.41Å; L63-I66 PolarHBondContact O-N 3.43Å; L63-I66 VanDerWaalsContact O-N 3.15Å; I66-S68 VanDerWaalsContact C-N 3.31Å; I66-S68 PolarHBondContact O-N 3.5Å; I66-L69 PolarHBondContact O-N 3.27Å; I66-M70 HydrophobicContact CG2-CG 4.43Å; I66-M70 HydrophobicContact CG2-SD 3.96Å; I66-M70 VanDerWaalsContact O-CG 3.31Å; I66-M70 WeakPolarHBondContact O-CG 3.38Å; I66-M70 PolarHBondContact O-N 2.86Å; I66-M119 HydrophobicContact CD1-CB 4.46Å; I66-M119 HydrophobicContact CD1-CG 4.17Å; I66-M119 HydrophobicContact CD1-SD 4.27Å; I66-M119 HydrophobicContact CG1-CB 4.35Å; I66-M119 HydrophobicContact CG1-CG 4.11Å; I66-M119 HydrophobicContact CG1-SD 3.63Å; I66-Y120 HydrophobicContact CD1-CD2 4.42Å; I66-K123 HydrophobicContact CD1-CD 3.87Å
67R86.5Confident81.5Confident102 Ų10260 Ų6039%0.38531%0.305SS..Hα-helixtrans-58.8-43176.9-177.6177.3175.5-177.10.4111.8W50 L63 M70 L71W50-R67 PolarHBondContact O-NE 3.47Å; L63-R67 WeakPolarHBondContact O-CB 3.36Å; L63-R67 PolarHBondContact O-N 3.25Å; R67-M70 PolarHBondContact O-N 3.45Å; R67-L71 HydrophobicContact CG-CD1 4Å; R67-L71 WeakPolarHBondContact O-CB 3.21Å; R67-L71 WeakPolarHBondContact O-CG 3.3Å; R67-L71 PolarHBondContact O-N 3.1Å
68S87.7Confident83.3Confident60 Ų6060 Ų6042%0.4230%0.304SS..Hα-helixtrans-60.3-47.5177-171.90000111.4K64 I65 I66 M70 L71 M72K64-S68 VanDerWaalsContact O-CB 3.27Å; K64-S68 WeakPolarHBondContact O-CB 3.35Å; K64-S68 PolarHBondContact O-N 2.93Å; I65-S68 WeakPolarHBondContact O-CB 3.49Å; I65-S68 PolarHBondContact O-N 3.02Å; I66-S68 VanDerWaalsContact C-N 3.31Å; I66-S68 PolarHBondContact O-N 3.5Å; S68-M70 VanDerWaalsContact C-N 3.35Å; S68-M70 PolarHBondContact O-N 2.83Å; S68-L71 PolarHBondContact O-N 2.9Å; S68-M72 WeakPolarHBondContact O-CB 3.29Å; S68-M72 WeakPolarHBondContact O-CG 2.96Å; S68-M72 PolarHBondContact O-N 3.12Å
69L90.4Very high84.8Confident31 Ų3165.4 Ų65.416%0.16233%0.326CS..Hα-helixtrans-60.7-42.2177.5-71.3166.8000112.4I65 I66 M72 S73 L112 Y115 A116I65-L69 HydrophobicContact CG2-CD1 4.05Å; I65-L69 WeakPolarHBondContact O-CG 3.32Å; I65-L69 PolarHBondContact O-N 3.26Å; I66-L69 PolarHBondContact O-N 3.27Å; L69-M72 PolarHBondContact O-N 3.01Å; L69-S73 PolarHBondContact O-N 2.89Å; L69-S73 PolarHBondContact O-OG 2.84Å; L69-L112 HydrophobicContact CD2-CD2 4.26Å; L69-Y115 HydrophobicContact CD1-CD1 3.85Å; L69-Y115 HydrophobicContact CD1-CE1 3.82Å; L69-A116 HydrophobicContact CB-CB 4.04Å
70M89.4Confident86.3Confident1 Ų161.6 Ų61.61%0.00530%0.301CS..Hα-helixtrans-70.5-32.9178.2-63.318093.700112.9W33 P49 W50 I66 R67 S68 S73 L74 M113 A116 I117W33-M70 HydrophobicContact CH2-CE 3.78Å; W33-M70 HydrophobicContact CZ3-CE 4.19Å; P49-M70 HydrophobicContact CB-SD 4.1Å; P49-M70 HydrophobicContact CG-CE 4.44Å; P49-M70 HydrophobicContact CG-SD 4.22Å; W50-M70 HydrophobicContact CE3-CB 4.44Å; W50-M70 HydrophobicContact CH2-CB 3.45Å; W50-M70 VanDerWaalsContact CH2-CB 3.45Å; W50-M70 WeakPolarHBondContact CH2-O 3.49Å; W50-M70 HydrophobicContact CZ2-CB 3.78Å; W50-M70 HydrophobicContact CZ2-CE 3.56Å; W50-M70 HydrophobicContact CZ2-CG 4.4Å; W50-M70 HydrophobicContact CZ2-SD 4.12Å; W50-M70 HydrophobicContact CZ3-CB 3.79Å; I66-M70 HydrophobicContact CG2-CG 4.43Å; I66-M70 HydrophobicContact CG2-SD 3.96Å; I66-M70 VanDerWaalsContact O-CG 3.31Å; I66-M70 WeakPolarHBondContact O-CG 3.38Å; I66-M70 PolarHBondContact O-N 2.86Å; R67-M70 PolarHBondContact O-N 3.45Å; S68-M70 VanDerWaalsContact C-N 3.35Å; S68-M70 PolarHBondContact O-N 2.83Å; M70-S73 WeakPolarHBondContact CA-OG 3.34Å; M70-S73 PolarHBondContact O-OG 3.38Å; M70-L74 PolarHBondContact O-N 3.29Å; M70-L74 VanDerWaalsContact O-N 3.16Å; M70-M113 HydrophobicContact CE-CE 4.37Å; M70-M113 HydrophobicContact CG-SD 4.45Å; M70-A116 HydrophobicContact CG-CB 3.67Å; M70-I117 HydrophobicContact CE-CG1 4.46Å
71L90.4Very high87.7Confident62 Ų6256 Ų5633%0.32528%0.276SS..Hα-helixtrans-71.1-41.8172.2-77.5168.3000111.4W50 R67 S68 S73 L74 N75W50-L71 HydrophobicContact CZ3-CD2 4.12Å; W50-L71 HydrophobicContact CZ3-CG 4.23Å; R67-L71 HydrophobicContact CG-CD1 4Å; R67-L71 WeakPolarHBondContact O-CB 3.21Å; R67-L71 WeakPolarHBondContact O-CG 3.3Å; R67-L71 PolarHBondContact O-N 3.1Å; S68-L71 PolarHBondContact O-N 2.9Å; L71-S73 VanDerWaalsContact C-N 3.35Å; L71-S73 PolarHBondContact O-N 3.28Å; L71-L74 PolarHBondContact O-N 2.94Å; L71-N75 PolarHBondContact O-N 2.88Å; L71-N75 PolarHBondContact O-ND2 3.11Å
72M91.8Very high88.9Confident105 Ų10554.6 Ų54.652%0.51727%0.268SS..Hα-helixtrans-60.8-45.1176.3-75.7-167.677.100111.3S68 L69 L74 N75 I76S68-M72 WeakPolarHBondContact O-CB 3.29Å; S68-M72 WeakPolarHBondContact O-CG 2.96Å; S68-M72 PolarHBondContact O-N 3.12Å; L69-M72 PolarHBondContact O-N 3.01Å; M72-L74 VanDerWaalsContact C-N 3.33Å; M72-L74 PolarHBondContact O-N 3.47Å; M72-N75 PolarHBondContact O-N 3.39Å; M72-I76 VanDerWaalsContact O-CG1 3.27Å; M72-I76 WeakPolarHBondContact O-CG1 3.49Å; M72-I76 PolarHBondContact O-N 3.14Å
73S92.5Very high89.9Confident0 Ų055.4 Ų55.40%027%0.27CS..Hα-helixtrans-65.1-35.2177.359.80000112.9M24 L69 M70 L71 S77 T109 M113M24-S73 WeakPolarHBondContact CE-OG 3.34Å; L69-S73 PolarHBondContact O-N 2.89Å; L69-S73 PolarHBondContact O-OG 2.84Å; M70-S73 WeakPolarHBondContact CA-OG 3.34Å; M70-S73 PolarHBondContact O-OG 3.38Å; L71-S73 VanDerWaalsContact C-N 3.35Å; L71-S73 PolarHBondContact O-N 3.28Å; S73-S77 VanDerWaalsContact O-CB 3.3Å; S73-S77 WeakPolarHBondContact O-CB 3.28Å; S73-S77 PolarHBondContact O-N 2.9Å; S73-S77 PolarHBondContact O-OG 3.43Å; S73-T109 VanDerWaalsContact O-CG2 3.29Å; S73-T109 WeakPolarHBondContact O-CG2 3.42Å; S73-M113 WeakPolarHBondContact OG-CG 3.36Å; S73-M113 PolarHBondContact OG-SD 3.39Å
74L92.4Very high90.5Very high17 Ų1754.8 Ų54.89%0.08927%0.267CS..Hα-helixtrans-62.6-47.2173-177.267.3000110.8M24 V25 L28 M70 L71 M72 S77 I78M24-L74 HydrophobicContact CB-CD1 3.82Å; M24-L74 HydrophobicContact CE-CB 3.81Å; M24-L74 HydrophobicContact CE-CD1 4.14Å; M24-L74 HydrophobicContact SD-CD1 4.5Å; V25-L74 HydrophobicContact CG2-CD1 4.24Å; L28-L74 HydrophobicContact CD1-CD2 4.07Å; M70-L74 PolarHBondContact O-N 3.29Å; M70-L74 VanDerWaalsContact O-N 3.16Å; L71-L74 PolarHBondContact O-N 2.94Å; M72-L74 VanDerWaalsContact C-N 3.33Å; M72-L74 PolarHBondContact O-N 3.47Å; L74-S77 WeakPolarHBondContact O-CB 3.36Å; L74-S77 PolarHBondContact O-N 3.32Å; L74-I78 HydrophobicContact CG-CD1 4.21Å; L74-I78 WeakPolarHBondContact O-CG1 3.21Å; L74-I78 PolarHBondContact O-N 3.26Å
75N93.1Very high90.8Very high80 Ų8048.8 Ų48.843%0.42825%0.247SC..Hα-helixtrans-60.7-47.9177.7-78.3-70.6000111.8L71 M72 S77 I78 Y79L71-N75 PolarHBondContact O-N 2.88Å; L71-N75 PolarHBondContact O-ND2 3.11Å; M72-N75 PolarHBondContact O-N 3.39Å; N75-S77 VanDerWaalsContact C-N 3.26Å; N75-S77 PolarHBondContact O-N 3.1Å; N75-I78 PolarHBondContact O-N 2.95Å; N75-Y79 WeakPolarHBondContact O-CD2 3.49Å; N75-Y79 PolarHBondContact O-N 3.03Å
76I93.2Very high91Very high32 Ų3247.2 Ų47.216%0.16424%0.24CC..Hα-helixtrans-61.2-39.7177.4-61.2163.3000110.2M72 I78 Y79 L80 L105 F108 T109 L112M72-I76 VanDerWaalsContact O-CG1 3.27Å; M72-I76 WeakPolarHBondContact O-CG1 3.49Å; M72-I76 PolarHBondContact O-N 3.14Å; I76-I78 VanDerWaalsContact C-N 3.35Å; I76-I78 PolarHBondContact O-N 3.39Å; I76-Y79 PolarHBondContact O-N 3.21Å; I76-L80 HydrophobicContact CG2-CD1 3.97Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CB 3.18Å; I76-L80 WeakPolarHBondContact O-CG 3.49Å; I76-L80 PolarHBondContact O-N 3.45Å; I76-L105 HydrophobicContact CG2-CD2 4.33Å; I76-F108 HydrophobicContact CD1-CE1 4.36Å; I76-T109 HydrophobicContact CB-CG2 4.37Å; I76-T109 WeakPolarHBondContact CG2-OG1 3.48Å; I76-L112 HydrophobicContact CD1-CD1 4.16Å
77S93.8Very high90.9Very high0 Ų047.3 Ų47.30%024%0.24CC..Hα-helixtrans-61.8-40.3176.4-62.50000112.4S73 L74 N75 L80 N81 T109S73-S77 VanDerWaalsContact O-CB 3.3Å; S73-S77 WeakPolarHBondContact O-CB 3.28Å; S73-S77 PolarHBondContact O-N 2.9Å; S73-S77 PolarHBondContact O-OG 3.43Å; L74-S77 WeakPolarHBondContact O-CB 3.36Å; L74-S77 PolarHBondContact O-N 3.32Å; N75-S77 VanDerWaalsContact C-N 3.26Å; N75-S77 PolarHBondContact O-N 3.1Å; S77-L80 WeakPolarHBondContact O-CB 3.31Å; S77-L80 PolarHBondContact O-N 3.48Å; S77-N81 WeakPolarHBondContact O-CB 3.35Å; S77-N81 PolarHBondContact O-N 3.45Å; S77-T109 WeakPolarHBondContact OG-CG2 3.33Å
78I93.6Very high90.9Very high82 Ų8246.4 Ų46.442%0.42124%0.239SC..Hα-helixtrans-63.5-46.4175.4-68164.3000110.8I21 L74 N75 I76 L80 N81 L82I21-I78 HydrophobicContact CD1-CG1 4.28Å; I21-I78 HydrophobicContact CG2-CG1 4.5Å; L74-I78 HydrophobicContact CG-CD1 4.21Å; L74-I78 WeakPolarHBondContact O-CG1 3.21Å; L74-I78 PolarHBondContact O-N 3.26Å; N75-I78 PolarHBondContact O-N 2.95Å; I76-I78 VanDerWaalsContact C-N 3.35Å; I76-I78 PolarHBondContact O-N 3.39Å; I78-L80 VanDerWaalsContact C-N 3.34Å; I78-L80 PolarHBondContact O-N 3.31Å; I78-N81 PolarHBondContact O-N 2.96Å; I78-L82 PolarHBondContact O-N 3.02Å
79Y92.7Very high90.8Very high151 Ų15147.3 Ų47.359%0.59224%0.242SC*.Hα-helixtrans-62.5-41175.7-71.2-62.3000112.2N75 I76 L82 I83N75-Y79 WeakPolarHBondContact O-CD2 3.49Å; N75-Y79 PolarHBondContact O-N 3.03Å; I76-Y79 PolarHBondContact O-N 3.21Å; Y79-L82 PolarHBondContact O-N 3.3Å; Y79-I83 VanDerWaalsContact O-CG1 3.28Å; Y79-I83 WeakPolarHBondContact O-CG1 3.44Å; Y79-I83 PolarHBondContact O-N 3.03Å
80L92.4Very high90.3Very high2 Ų252.7 Ų52.71%0.0126%0.262CS..Hα-helixtrans-59.1-48.8174.9-81.8167.1000111.5I76 S77 I78 L82 I83 I84 I102 L105I76-L80 HydrophobicContact CG2-CD1 3.97Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CB 3.18Å; I76-L80 WeakPolarHBondContact O-CG 3.49Å; I76-L80 PolarHBondContact O-N 3.45Å; S77-L80 WeakPolarHBondContact O-CB 3.31Å; S77-L80 PolarHBondContact O-N 3.48Å; I78-L80 VanDerWaalsContact C-N 3.34Å; I78-L80 PolarHBondContact O-N 3.31Å; L80-L82 VanDerWaalsContact C-N 3.3Å; L80-L82 PolarHBondContact O-N 2.98Å; L80-I83 PolarHBondContact O-N 2.98Å; L80-I84 WeakPolarHBondContact O-CG1 3.45Å; L80-I84 PolarHBondContact O-N 3.43Å; L80-I102 HydrophobicContact CD2-CG2 4.09Å; L80-L105 HydrophobicContact CD1-CB 4.03Å; L80-L105 HydrophobicContact CD2-CB 3.4Å; L80-L105 HydrophobicContact CD2-CD1 3.87Å; L80-L105 HydrophobicContact CD2-CG 4.32Å; L80-L105 HydrophobicContact CG-CB 4.02Å; L80-L105 HydrophobicContact CG-CD1 4.49Å
81N93.8Very high89.8Confident38 Ų3860 Ų6020%0.20330%0.297CS..Hα-helixtrans-60.6-41.6177.8-172.28.2000111.4S17 I21 S77 I78 I84 G85S17-N81 WeakPolarHBondContact OG-CA 3.47Å; S17-N81 WeakPolarHBondContact OG-CB 3.4Å; I21-N81 HydrophobicContact CD1-CB 3.47Å; I21-N81 VanDerWaalsContact CD1-CB 3.47Å; I21-N81 VanDerWaalsContact CD1-ND2 3.35Å; I21-N81 WeakPolarHBondContact CD1-ND2 3.4Å; S77-N81 WeakPolarHBondContact O-CB 3.35Å; S77-N81 PolarHBondContact O-N 3.45Å; I78-N81 PolarHBondContact O-N 2.96Å; N81-I84 PolarHBondContact O-N 3.22Å; N81-G85 PolarHBondContact O-N 3.23Å
82L92.6Very high89.3Confident104 Ų10459.8 Ų59.855%0.54530%0.296SS..Hα-helixtrans-60.1-48.3175.5-179.564.9000111.9I78 Y79 L80 I84 G85 L86I78-L82 PolarHBondContact O-N 3.02Å; Y79-L82 PolarHBondContact O-N 3.3Å; L80-L82 VanDerWaalsContact C-N 3.3Å; L80-L82 PolarHBondContact O-N 2.98Å; L82-I84 PolarHBondContact O-N 3.16Å; L82-G85 PolarHBondContact O-N 3.05Å; L82-L86 HydrophobicContact CD1-CD1 4.38Å; L82-L86 HydrophobicContact CD1-CG 4.44Å; L82-L86 HydrophobicContact CG-CD1 4.16Å; L82-L86 VanDerWaalsContact O-CG 3.31Å; L82-L86 WeakPolarHBondContact O-CG 3.21Å; L82-L86 PolarHBondContact O-N 3.26Å
83I90Very high88.5Confident40 Ų4058.1 Ų58.121%0.20530%0.295CS..Hα-helixtrans-61.5-45179.1-66165.4000110.5Y79 L80 G85 L86 Q87 V98 F101 I102Y79-I83 VanDerWaalsContact O-CG1 3.28Å; Y79-I83 WeakPolarHBondContact O-CG1 3.44Å; Y79-I83 PolarHBondContact O-N 3.03Å; L80-I83 PolarHBondContact O-N 2.98Å; I83-G85 VanDerWaalsContact C-N 3.34Å; I83-G85 PolarHBondContact O-N 3.35Å; I83-L86 PolarHBondContact O-N 2.84Å; I83-Q87 WeakPolarHBondContact O-CG 3.47Å; I83-Q87 PolarHBondContact O-N 2.87Å; I83-V98 HydrophobicContact CG2-CG1 4.41Å; I83-F101 HydrophobicContact CD1-CE1 4.39Å; I83-I102 HydrophobicContact CG2-CD1 3.72Å; I83-I102 HydrophobicContact CG2-CG1 3.81Å
84I90.1Very high87.6Confident1 Ų161.3 Ų61.31%0.00531%0.31CS..Hα-helixtrans-64.3-40.9178.2-63.8166.3000110.4L10 N13 V14 L80 N81 L82 Q87 F88 I102L10-I84 HydrophobicContact CD1-CG2 4.26Å; N13-I84 HydrophobicContact CB-CG2 4.1Å; V14-I84 HydrophobicContact CG2-CG2 3.63Å; L80-I84 WeakPolarHBondContact O-CG1 3.45Å; L80-I84 PolarHBondContact O-N 3.43Å; N81-I84 PolarHBondContact O-N 3.22Å; L82-I84 PolarHBondContact O-N 3.16Å; I84-Q87 WeakPolarHBondContact O-CB 3.32Å; I84-Q87 PolarHBondContact O-N 2.95Å; I84-F88 PolarHBondContact O-N 3.41Å; I84-I102 HydrophobicContact CD1-CG2 3.8Å; I84-I102 HydrophobicContact CG1-CD1 4.22Å; I84-I102 HydrophobicContact CG1-CG2 3.72Å
85G89Confident87Confident24 Ų2464.7 Ų64.725%0.24733%0.328CS..Hα-helixtrans-61.1-43.7175.200000112.5N81 L82 I83 Q87 F88 T89N81-G85 PolarHBondContact O-N 3.23Å; L82-G85 PolarHBondContact O-N 3.05Å; I83-G85 VanDerWaalsContact C-N 3.34Å; I83-G85 PolarHBondContact O-N 3.35Å; G85-Q87 VanDerWaalsContact C-N 3.32Å; G85-Q87 PolarHBondContact O-N 3.33Å; G85-F88 WeakPolarHBondContact O-CB 3.47Å; G85-F88 PolarHBondContact O-N 3.29Å; G85-F88 VanDerWaalsContact O-N 3.09Å; G85-T89 PolarHBondContact O-N 2.93Å; G85-T89 PolarHBondContact O-OG1 3.38Å
86L88.5Confident86.4Confident60 Ų6065.1 Ų65.131%0.31433%0.326SS..Hα-helixtrans-65.6-32.8175.8-70.6170.9000112.8L82 I83 T89 Y90 M91 I92L82-L86 HydrophobicContact CD1-CD1 4.38Å; L82-L86 HydrophobicContact CD1-CG 4.44Å; L82-L86 HydrophobicContact CG-CD1 4.16Å; L82-L86 VanDerWaalsContact O-CG 3.31Å; L82-L86 WeakPolarHBondContact O-CG 3.21Å; L82-L86 PolarHBondContact O-N 3.26Å; I83-L86 PolarHBondContact O-N 2.84Å; L86-T89 PolarHBondContact O-OG1 2.95Å; L86-Y90 PolarHBondContact O-N 3.25Å; L86-M91 HydrophobicContact CD2-CB 4.05Å; L86-M91 HydrophobicContact CD2-CG 4.5Å; L86-M91 PolarHBondContact O-N 3.41Å; L86-I92 HydrophobicContact CB-CB 4.43Å; L86-I92 HydrophobicContact CB-CD1 3.59Å; L86-I92 HydrophobicContact CB-CG1 3.89Å; L86-I92 HydrophobicContact CD1-CD1 3.71Å; L86-I92 HydrophobicContact CD1-CG1 4.46Å; L86-I92 HydrophobicContact CG-CD1 4.29Å; L86-I92 PolarHBondContact O-N 2.99Å
87Q85.9Confident85.8Confident2 Ų268.4 Ų68.41%0.00935%0.351CS..Hα-helixtrans-68-36.4170.2-73.8-166.4-26.400112.2L10 I83 I84 G85 Y90 I92 H99 I102L10-Q87 HydrophobicContact CD1-CB 4.19Å; L10-Q87 HydrophobicContact CD2-CB 4.45Å; I83-Q87 WeakPolarHBondContact O-CG 3.47Å; I83-Q87 PolarHBondContact O-N 2.87Å; I84-Q87 WeakPolarHBondContact O-CB 3.32Å; I84-Q87 PolarHBondContact O-N 2.95Å; G85-Q87 VanDerWaalsContact C-N 3.32Å; G85-Q87 PolarHBondContact O-N 3.33Å; Q87-Y90 PolarHBondContact O-N 3.1Å; Q87-I92 HydrophobicContact CG-CB 4.4Å; Q87-I92 HydrophobicContact CG-CG2 4.24Å; Q87-H99 PolarHBondContact OE1-CE1 2.97Å; Q87-I102 HydrophobicContact CG-CD1 4.49Å; Q87-I102 VanDerWaalsContact OE1-CD1 3.29Å
88F85.1Confident85.4Confident82 Ų8270 Ų7036%0.3636%0.36SS..Hα-helixtrans-67.6-36.6178.2-178.1-98.2000112.3L10 A11 V14 I84 G85 Y90L10-F88 HydrophobicContact CD2-CB 4.21Å; L10-F88 HydrophobicContact CD2-CD2 4.28Å; L10-F88 HydrophobicContact CG-CB 4.32Å; L10-F88 HydrophobicContact CG-CD2 4.2Å; A11-F88 HydrophobicContact CB-CE2 4.07Å; V14-F88 HydrophobicContact CG2-CB 4.04Å; V14-F88 HydrophobicContact CG2-CD2 4.41Å; V14-F88 HydrophobicContact CG2-CG 4.26Å; I84-F88 PolarHBondContact O-N 3.41Å; G85-F88 WeakPolarHBondContact O-CB 3.47Å; G85-F88 PolarHBondContact O-N 3.29Å; G85-F88 VanDerWaalsContact O-N 3.09Å; F88-Y90 PolarHBondContact O-N 3.33Å
89T86.6Confident85Confident80 Ų8066.2 Ų66.249%0.49134%0.341SS..THydrogen-bonded Turntrans-82.86.1175.660.90000113.9G85 L86 M91G85-T89 PolarHBondContact O-N 2.93Å; G85-T89 PolarHBondContact O-OG1 3.38Å; L86-T89 PolarHBondContact O-OG1 2.95Å; T89-M91 PolarHBondContact O-N 3.47Å; T89-M91 VanDerWaalsContact O-N 3.13Å; T89-M91 WeakPolarHBondContact OG1-CG 3.44Å
90Y79.4Confident84.7Confident144 Ų14462.5 Ų62.557%0.56533%0.331SS*.THydrogen-bonded Turntrans57.619.5-176-58.5-80.6000114.9L86 Q87 F88L86-Y90 PolarHBondContact O-N 3.25Å; Q87-Y90 PolarHBondContact O-N 3.1Å; F88-Y90 PolarHBondContact O-N 3.33Å
91M78.8Confident84.6Confident153 Ų15367.7 Ų67.775%0.75435%0.354SS*.SBendtrans-75.1-30.2175.5-74-78.1158.600111.6L86 T89L86-M91 HydrophobicContact CD2-CB 4.05Å; L86-M91 HydrophobicContact CD2-CG 4.5Å; L86-M91 PolarHBondContact O-N 3.41Å; T89-M91 PolarHBondContact O-N 3.47Å; T89-M91 VanDerWaalsContact O-N 3.13Å; T89-M91 WeakPolarHBondContact OG1-CG 3.44Å
92I79.8Confident84.4Confident58 Ų5865.9 Ų65.930%0.29734%0.344SS..SBendtrans-109138.9173.4-70177.2000109.5L86 Q87L86-I92 HydrophobicContact CB-CB 4.43Å; L86-I92 HydrophobicContact CB-CD1 3.59Å; L86-I92 HydrophobicContact CB-CG1 3.89Å; L86-I92 HydrophobicContact CD1-CD1 3.71Å; L86-I92 HydrophobicContact CD1-CG1 4.46Å; L86-I92 HydrophobicContact CG-CD1 4.29Å; L86-I92 PolarHBondContact O-N 2.99Å; Q87-I92 HydrophobicContact CG-CB 4.4Å; Q87-I92 HydrophobicContact CG-CG2 4.24Å
93S74.5Confident84.3Confident70 Ų7061 Ų6149%0.4932%0.318SS..  trans-67.7140.1178.381.60000112N95S93-N95 PolarHBondContact O-N 3.27Å; S93-N95 PolarHBondContact OG-ND2 3.2Å; S93-N95 VanDerWaalsContact OG-ND2 3.1Å; S93-N95 PolarHBondContact OG-OD1 2.8Å
94Q74.3Confident84.4Confident68 Ų6865.2 Ų65.232%0.31834%0.335SS..  trans-80.267-179.1-66.3-175.5-4.600111.4N6N6-Q94 PolarHBondContact ND2-OE1 3.48Å
95N79.1Confident84.5Confident88 Ų8866.8 Ų66.847%0.47134%0.343SS..  trans-85.4146.9178.7-65-4.4000111.1S93 C97 V98 H99S93-N95 PolarHBondContact O-N 3.27Å; S93-N95 PolarHBondContact OG-ND2 3.2Å; S93-N95 VanDerWaalsContact OG-ND2 3.1Å; S93-N95 PolarHBondContact OG-OD1 2.8Å; N95-C97 VanDerWaalsContact C-N 3.29Å; N95-C97 PolarHBondContact O-N 3.22Å; N95-V98 HydrophobicContact CB-CG2 4.06Å; N95-V98 PolarHBondContact O-N 2.91Å; N95-H99 PolarHBondContact O-N 3.38Å
96K80.8Confident84.6Confident89 Ų8965.7 Ų65.739%0.38733%0.332SS..Hα-helixtrans-55.1-43.6177-65.1-178.4-179-179.20112.6V98 H99 L100 T165 C166K96-V98 PolarHBondContact O-N 3.16Å; K96-H99 PolarHBondContact O-N 2.9Å; K96-L100 PolarHBondContact O-N 3.3Å; K96-T165 WeakPolarHBondContact CE-O 3.39Å; K96-T165 PolarHBondContact NZ-O 3.45Å; K96-C166 PolarHBondContact NZ-SG 3.41Å
97C81.1Confident84.8Confident101 Ų10165.9 Ų65.968%0.68233%0.331SS*.Hα-helixtrans-59.5-35.5178.2-590000112.3N95 L100 F101N95-C97 VanDerWaalsContact C-N 3.29Å; N95-C97 PolarHBondContact O-N 3.22Å; C97-L100 PolarHBondContact O-N 3.37Å; C97-F101 WeakPolarHBondContact O-CB 3.22Å; C97-F101 PolarHBondContact O-N 3.38Å
98V84.8Confident85.1Confident33 Ų3370.3 Ų70.320%0.235%0.35CS..Hα-helixtrans-72.6-40.9180-172.70000110.4I83 N95 K96 L100 F101 I102I83-V98 HydrophobicContact CG2-CG1 4.41Å; N95-V98 HydrophobicContact CB-CG2 4.06Å; N95-V98 PolarHBondContact O-N 2.91Å; K96-V98 PolarHBondContact O-N 3.16Å; V98-L100 PolarHBondContact O-N 3.29Å; V98-F101 PolarHBondContact O-N 2.85Å; V98-I102 HydrophobicContact CG1-CD1 3.89Å; V98-I102 HydrophobicContact CG1-CG1 4.34Å; V98-I102 WeakPolarHBondContact O-CB 3.13Å; V98-I102 WeakPolarHBondContact O-CD1 3.42Å; V98-I102 WeakPolarHBondContact O-CG1 3.41Å; V98-I102 PolarHBondContact O-N 3.1Å
99H85.7Confident85.5Confident2 Ų266.4 Ų66.41%0.00933%0.333CS..Hα-helixtrans-62.7-40.9173.5-71.5-58000112.7Q87 N95 K96 G103 C162Q87-H99 PolarHBondContact OE1-CE1 2.97Å; N95-H99 PolarHBondContact O-N 3.38Å; K96-H99 PolarHBondContact O-N 2.9Å; H99-G103 PolarHBondContact O-N 3.36Å; H99-C162 HydrophobicContact CB-CB 4.45Å
100L87Confident85.8Confident73 Ų7362.6 Ų62.638%0.38231%0.31SS..Hα-helixtrans-64.6-42174.1-72.9173.9000112K96 C97 V98 G103 F104 F159 C162K96-L100 PolarHBondContact O-N 3.3Å; C97-L100 PolarHBondContact O-N 3.37Å; V98-L100 PolarHBondContact O-N 3.29Å; L100-G103 PolarHBondContact O-N 3.5Å; L100-F104 VanDerWaalsContact O-CB 3.31Å; L100-F104 WeakPolarHBondContact O-CB 3.4Å; L100-F104 PolarHBondContact O-N 2.97Å; L100-F159 HydrophobicContact CD2-CD1 3.84Å; L100-F159 HydrophobicContact CD2-CE1 3.56Å; L100-C162 HydrophobicContact CD2-CB 4.31Å; L100-C162 HydrophobicContact CG-CB 4.5Å
101F88.9Confident86.5Confident112 Ų11259.4 Ų59.449%0.49131%0.307SS..Hα-helixtrans-63.8-46.4178.1179.3-107.2000112.1I83 C97 V98 F104 L105I83-F101 HydrophobicContact CD1-CE1 4.39Å; C97-F101 WeakPolarHBondContact O-CB 3.22Å; C97-F101 PolarHBondContact O-N 3.38Å; V98-F101 PolarHBondContact O-N 2.85Å; F101-F104 PolarHBondContact O-N 2.95Å; F101-L105 HydrophobicContact CD1-CD1 3.8Å; F101-L105 HydrophobicContact CD2-CD1 4.49Å; F101-L105 HydrophobicContact CE1-CD1 3.25Å; F101-L105 HydrophobicContact CE1-CG 4.24Å; F101-L105 HydrophobicContact CE2-CD1 4.01Å; F101-L105 HydrophobicContact CE2-CG 4.21Å; F101-L105 HydrophobicContact CG-CD1 4.4Å; F101-L105 HydrophobicContact CZ-CD1 3.38Å; F101-L105 HydrophobicContact CZ-CG 4.07Å; F101-L105 WeakPolarHBondContact O-CB 3.28Å; F101-L105 WeakPolarHBondContact O-CG 3.31Å; F101-L105 PolarHBondContact O-N 3.25Å
102I90.2Very high87.1Confident0 Ų053.5 Ų53.50%028%0.279CS..Hα-helixtrans-60.4-47.4175.1-67.2164.4000110.2L80 I83 I84 Q87 V98 F104 L105 S106 C158L80-I102 HydrophobicContact CD2-CG2 4.09Å; I83-I102 HydrophobicContact CG2-CD1 3.72Å; I83-I102 HydrophobicContact CG2-CG1 3.81Å; I84-I102 HydrophobicContact CD1-CG2 3.8Å; I84-I102 HydrophobicContact CG1-CD1 4.22Å; I84-I102 HydrophobicContact CG1-CG2 3.72Å; Q87-I102 HydrophobicContact CG-CD1 4.49Å; Q87-I102 VanDerWaalsContact OE1-CD1 3.29Å; V98-I102 HydrophobicContact CG1-CD1 3.89Å; V98-I102 HydrophobicContact CG1-CG1 4.34Å; V98-I102 WeakPolarHBondContact O-CB 3.13Å; V98-I102 WeakPolarHBondContact O-CD1 3.42Å; V98-I102 WeakPolarHBondContact O-CG1 3.41Å; V98-I102 PolarHBondContact O-N 3.1Å; I102-F104 PolarHBondContact O-N 3.22Å; I102-L105 PolarHBondContact O-N 3Å; I102-S106 WeakPolarHBondContact O-CB 3.31Å; I102-S106 PolarHBondContact O-N 3.37Å; I102-C158 VanDerWaalsContact CG2-SG 3.6Å
103G90.9Very high87.7Confident0 Ų050.9 Ų50.90%027%0.265CS..Hα-helixtrans-60.8-45.7178.400000112.2H99 L100 S106 F107H99-G103 PolarHBondContact O-N 3.36Å; L100-G103 PolarHBondContact O-N 3.5Å; G103-S106 PolarHBondContact O-N 3.02Å; G103-S106 PolarHBondContact O-OG 2.88Å; G103-F107 VanDerWaalsContact O-CD2 3.28Å; G103-F107 WeakPolarHBondContact O-CD2 3.4Å; G103-F107 PolarHBondContact O-N 3.43Å
104F90.9Very high88.5Confident130 Ų13052.7 Ų52.757%0.5726%0.264SS*.Hα-helixtrans-59.3-48.8175.7175.2-98.6000111.9L100 F101 I102 S106 F107 F108L100-F104 VanDerWaalsContact O-CB 3.31Å; L100-F104 WeakPolarHBondContact O-CB 3.4Å; L100-F104 PolarHBondContact O-N 2.97Å; F101-F104 PolarHBondContact O-N 2.95Å; I102-F104 PolarHBondContact O-N 3.22Å; F104-S106 VanDerWaalsContact C-N 3.33Å; F104-S106 PolarHBondContact O-N 2.93Å; F104-F107 PolarHBondContact O-N 3.33Å; F104-F108 VanDerWaalsContact O-CB 3.3Å; F104-F108 WeakPolarHBondContact O-CB 2.96Å; F104-F108 PolarHBondContact O-N 3.34Å
105L92.3Very high89.4Confident33 Ų3355.7 Ų55.717%0.17327%0.274CS..Hα-helixtrans-62-39.7178.4-80.5177.9000112.2I76 L80 F101 I102 F108 T109I76-L105 HydrophobicContact CG2-CD2 4.33Å; L80-L105 HydrophobicContact CD1-CB 4.03Å; L80-L105 HydrophobicContact CD2-CB 3.4Å; L80-L105 HydrophobicContact CD2-CD1 3.87Å; L80-L105 HydrophobicContact CD2-CG 4.32Å; L80-L105 HydrophobicContact CG-CB 4.02Å; L80-L105 HydrophobicContact CG-CD1 4.49Å; F101-L105 HydrophobicContact CD1-CD1 3.8Å; F101-L105 HydrophobicContact CD2-CD1 4.49Å; F101-L105 HydrophobicContact CE1-CD1 3.25Å; F101-L105 HydrophobicContact CE1-CG 4.24Å; F101-L105 HydrophobicContact CE2-CD1 4.01Å; F101-L105 HydrophobicContact CE2-CG 4.21Å; F101-L105 HydrophobicContact CG-CD1 4.4Å; F101-L105 HydrophobicContact CZ-CD1 3.38Å; F101-L105 HydrophobicContact CZ-CG 4.07Å; F101-L105 WeakPolarHBondContact O-CB 3.28Å; F101-L105 WeakPolarHBondContact O-CG 3.31Å; F101-L105 PolarHBondContact O-N 3.25Å; I102-L105 PolarHBondContact O-N 3Å; L105-F108 PolarHBondContact O-N 3.33Å; L105-T109 WeakPolarHBondContact O-CB 3.27Å; L105-T109 PolarHBondContact O-N 2.88Å; L105-T109 PolarHBondContact O-OG1 3.29Å
106S92.8Very high89.9Confident1 Ų151.5 Ų51.51%0.00725%0.251CS..Hα-helixtrans-68.3-40.8179.776.50000111.6I102 G103 F104 T109 G110 L151 G155I102-S106 WeakPolarHBondContact O-CB 3.31Å; I102-S106 PolarHBondContact O-N 3.37Å; G103-S106 PolarHBondContact O-N 3.02Å; G103-S106 PolarHBondContact O-OG 2.88Å; F104-S106 VanDerWaalsContact C-N 3.33Å; F104-S106 PolarHBondContact O-N 2.93Å; S106-T109 PolarHBondContact O-N 3.44Å; S106-G110 PolarHBondContact O-N 2.98Å; S106-L151 PolarHBondContact OG-O 3.43Å; S106-G155 WeakPolarHBondContact OG-CA 3.39Å; S106-G155 PolarHBondContact OG-N 2.91Å; S106-G155 VanDerWaalsContact OG-N 3.14Å
107F92.4Very high90.3Very high65 Ų6547.4 Ų47.429%0.28523%0.234SC..Hα-helixtrans-62.4-48.6172.2-90.7-74.9000111.8G103 F104 T109 G110 C111 L152 I156 F159G103-F107 VanDerWaalsContact O-CD2 3.28Å; G103-F107 WeakPolarHBondContact O-CD2 3.4Å; G103-F107 PolarHBondContact O-N 3.43Å; F104-F107 PolarHBondContact O-N 3.33Å; F107-T109 VanDerWaalsContact C-N 3.28Å; F107-T109 PolarHBondContact O-N 2.9Å; F107-G110 PolarHBondContact O-N 2.87Å; F107-C111 PolarHBondContact O-N 3.49Å; F107-C111 PolarHBondContact O-SG 3.29Å; F107-C111 VanDerWaalsContact O-SG 3.34Å; F107-L152 HydrophobicContact CD1-CD2 3.46Å; F107-L152 VanDerWaalsContact CD1-CD2 3.46Å; F107-L152 HydrophobicContact CE1-CD2 3.71Å; F107-L152 HydrophobicContact CG-CD2 4.42Å; F107-I156 HydrophobicContact CE2-CG1 4.39Å; F107-I156 HydrophobicContact CZ-CG1 3.76Å; F107-F159 HydrophobicContact CD2-CD2 4.3Å; F107-F159 AromaticContact CD2-CE2 3.73Å; F107-F159 HydrophobicContact CD2-CE2 3.73Å; F107-F159 AromaticContact CE2-CD2 3.75Å; F107-F159 HydrophobicContact CE2-CD2 3.75Å; F107-F159 AromaticContact CE2-CE2 3.59Å; F107-F159 HydrophobicContact CE2-CE2 3.59Å
108F92.2Very high90.7Very high94 Ų9444.9 Ų44.941%0.41222%0.215SC..Hα-helixtrans-56.7-44.7177.9-179.2-108.6000111.3I76 F104 L105 C111 L112I76-F108 HydrophobicContact CD1-CE1 4.36Å; F104-F108 VanDerWaalsContact O-CB 3.3Å; F104-F108 WeakPolarHBondContact O-CB 2.96Å; F104-F108 PolarHBondContact O-N 3.34Å; L105-F108 PolarHBondContact O-N 3.33Å; F108-C111 PolarHBondContact O-N 3.49Å; F108-L112 HydrophobicContact CD1-CD1 3.8Å; F108-L112 HydrophobicContact CD1-CG 4.4Å; F108-L112 HydrophobicContact CE1-CD1 3.34Å; F108-L112 HydrophobicContact CE1-CG 4.08Å; F108-L112 HydrophobicContact CE2-CD1 4.48Å; F108-L112 HydrophobicContact CE2-CG 4.39Å; F108-L112 HydrophobicContact CZ-CD1 3.72Å; F108-L112 HydrophobicContact CZ-CD2 4.22Å; F108-L112 HydrophobicContact CZ-CG 4.06Å; F108-L112 WeakPolarHBondContact O-CG 3.29Å; F108-L112 PolarHBondContact O-N 3.4Å
109T93.6Very high90.8Very high0 Ų045.3 Ų45.30%022%0.215CC..Hα-helixtrans-65-42.2177.7-530000112.3S73 I76 S77 L105 S106 F107 L112 M113 L151S73-T109 VanDerWaalsContact O-CG2 3.29Å; S73-T109 WeakPolarHBondContact O-CG2 3.42Å; I76-T109 HydrophobicContact CB-CG2 4.37Å; I76-T109 WeakPolarHBondContact CG2-OG1 3.48Å; S77-T109 WeakPolarHBondContact OG-CG2 3.33Å; L105-T109 WeakPolarHBondContact O-CB 3.27Å; L105-T109 PolarHBondContact O-N 2.88Å; L105-T109 PolarHBondContact O-OG1 3.29Å; S106-T109 PolarHBondContact O-N 3.44Å; F107-T109 VanDerWaalsContact C-N 3.28Å; F107-T109 PolarHBondContact O-N 2.9Å; T109-L112 PolarHBondContact O-N 3.38Å; T109-M113 PolarHBondContact O-N 2.83Å; T109-L151 HydrophobicContact CG2-CD1 3.98Å
110G93.2Very high90.8Very high1 Ų145.4 Ų45.41%0.0122%0.216CC..Hα-helixtrans-61.1-43.8174.600000112.5S106 F107 M113 F114S106-G110 PolarHBondContact O-N 2.98Å; F107-G110 PolarHBondContact O-N 2.87Å; G110-M113 PolarHBondContact O-N 3.3Å; G110-F114 WeakPolarHBondContact O-CB 3.48Å; G110-F114 PolarHBondContact O-N 3.23Å
111C92.4Very high90.7Very high76 Ų7643.7 Ų43.751%0.51421%0.206SC..Hα-helixtrans-64.6-43175.9-69.90000112.3F107 F108 M113 F114 Y115F107-C111 PolarHBondContact O-N 3.49Å; F107-C111 PolarHBondContact O-SG 3.29Å; F107-C111 VanDerWaalsContact O-SG 3.34Å; F108-C111 PolarHBondContact O-N 3.49Å; C111-M113 VanDerWaalsContact C-N 3.33Å; C111-M113 PolarHBondContact O-N 3.12Å; C111-F114 PolarHBondContact O-N 2.66Å; C111-Y115 WeakPolarHBondContact O-CB 3.42Å; C111-Y115 PolarHBondContact O-N 3.23Å
112L92.5Very high90.5Very high30 Ų3044.6 Ų44.616%0.15721%0.211CC..Hα-helixtrans-59.7-43.8174.9-76.9177.5000111.7L69 I76 F108 T109 Y115 A116L69-L112 HydrophobicContact CD2-CD2 4.26Å; I76-L112 HydrophobicContact CD1-CD1 4.16Å; F108-L112 HydrophobicContact CD1-CD1 3.8Å; F108-L112 HydrophobicContact CD1-CG 4.4Å; F108-L112 HydrophobicContact CE1-CD1 3.34Å; F108-L112 HydrophobicContact CE1-CG 4.08Å; F108-L112 HydrophobicContact CE2-CD1 4.48Å; F108-L112 HydrophobicContact CE2-CG 4.39Å; F108-L112 HydrophobicContact CZ-CD1 3.72Å; F108-L112 HydrophobicContact CZ-CD2 4.22Å; F108-L112 HydrophobicContact CZ-CG 4.06Å; F108-L112 WeakPolarHBondContact O-CG 3.29Å; F108-L112 PolarHBondContact O-N 3.4Å; T109-L112 PolarHBondContact O-N 3.38Å; L112-Y115 PolarHBondContact O-N 3.5Å; L112-A116 WeakPolarHBondContact O-CB 3.08Å; L112-A116 PolarHBondContact O-N 3.46Å
113M91.6Very high90.1Very high2 Ų246.3 Ų46.31%0.0122%0.219CC..Hα-helixtrans-63-45.2175.9-82.3-63.5-74.700112.1M24 M70 S73 T109 G110 C111 Y115 A116 I117 I148M24-M113 HydrophobicContact CE-CE 3.71Å; M24-M113 HydrophobicContact CE-CG 4.09Å; M24-M113 HydrophobicContact CE-SD 3.51Å; M24-M113 VanDerWaalsContact CE-SD 3.51Å; M24-M113 HydrophobicContact CG-CE 4.09Å; M24-M113 HydrophobicContact SD-CE 4.21Å; M24-M113 HydrophobicContact SD-CG 4.49Å; M24-M113 HydrophobicContact SD-SD 4.47Å; M70-M113 HydrophobicContact CE-CE 4.37Å; M70-M113 HydrophobicContact CG-SD 4.45Å; S73-M113 WeakPolarHBondContact OG-CG 3.36Å; S73-M113 PolarHBondContact OG-SD 3.39Å; T109-M113 PolarHBondContact O-N 2.83Å; G110-M113 PolarHBondContact O-N 3.3Å; C111-M113 VanDerWaalsContact C-N 3.33Å; C111-M113 PolarHBondContact O-N 3.12Å; M113-Y115 VanDerWaalsContact C-N 3.33Å; M113-Y115 PolarHBondContact O-N 2.98Å; M113-A116 PolarHBondContact O-N 3.46Å; M113-I117 WeakPolarHBondContact O-CG1 3.45Å; M113-I117 PolarHBondContact O-N 3.05Å; M113-I148 HydrophobicContact CB-CD1 4.06Å; M113-I148 HydrophobicContact CB-CG1 3.67Å
114F92.3Very high89.5Confident108 Ų10846.4 Ų46.447%0.47422%0.219SC..Hα-helixtrans-61.2-43.3176.8-176.9-103.5000111.8G110 C111 I117 T118 I148G110-F114 WeakPolarHBondContact O-CB 3.48Å; G110-F114 PolarHBondContact O-N 3.23Å; C111-F114 PolarHBondContact O-N 2.66Å; F114-I117 PolarHBondContact O-N 2.75Å; F114-T118 HydrophobicContact CD1-CG2 4.17Å; F114-T118 HydrophobicContact CD2-CG2 4.39Å; F114-T118 HydrophobicContact CE1-CG2 3.75Å; F114-T118 HydrophobicContact CE2-CG2 4Å; F114-T118 HydrophobicContact CG-CG2 4.47Å; F114-T118 HydrophobicContact CZ-CG2 3.66Å; F114-T118 WeakPolarHBondContact O-CB 3.44Å; F114-T118 WeakPolarHBondContact O-CG2 3.33Å; F114-T118 PolarHBondContact O-N 3.42Å; F114-T118 PolarHBondContact O-OG1 2.97Å; F114-I148 HydrophobicContact CB-CD1 4.04Å; F114-I148 HydrophobicContact CD2-CD1 4.38Å
115Y91.9Very high89Confident132 Ų13244.4 Ų44.452%0.51821%0.214SC..Hα-helixtrans-61.1-45175.4179.6-104.9000112.1L69 C111 L112 M113 I117 T118 M119L69-Y115 HydrophobicContact CD1-CD1 3.85Å; L69-Y115 HydrophobicContact CD1-CE1 3.82Å; C111-Y115 WeakPolarHBondContact O-CB 3.42Å; C111-Y115 PolarHBondContact O-N 3.23Å; L112-Y115 PolarHBondContact O-N 3.5Å; M113-Y115 VanDerWaalsContact C-N 3.33Å; M113-Y115 PolarHBondContact O-N 2.98Å; Y115-I117 PolarHBondContact O-N 3.47Å; Y115-T118 WeakPolarHBondContact CA-OG1 3.29Å; Y115-T118 PolarHBondContact O-N 2.92Å; Y115-T118 PolarHBondContact O-OG1 3.46Å; Y115-M119 HydrophobicContact CE1-SD 4.39Å; Y115-M119 VanDerWaalsContact O-CB 3.26Å; Y115-M119 WeakPolarHBondContact O-CB 3.3Å; Y115-M119 PolarHBondContact O-N 3.17Å
116A90.6Very high88.3Confident0 Ų048.5 Ų48.50%023%0.231CC..Hα-helixtrans-61.3-43.5177.900000112.4L69 M70 L112 M113 Y120L69-A116 HydrophobicContact CB-CB 4.04Å; M70-A116 HydrophobicContact CG-CB 3.67Å; L112-A116 WeakPolarHBondContact O-CB 3.08Å; L112-A116 PolarHBondContact O-N 3.46Å; M113-A116 PolarHBondContact O-N 3.46Å; A116-Y120 WeakPolarHBondContact O-CB 3.07Å; A116-Y120 PolarHBondContact O-N 3.08Å
117I89.4Confident87.4Confident2 Ų248.6 Ų48.61%0.0123%0.232CC..Hα-helixtrans-68.2-43.9179.3-66.7173.9000111.4M70 M113 F114 Y115 M119 Y120 H121 A144 Y145 I148M70-I117 HydrophobicContact CE-CG1 4.46Å; M113-I117 WeakPolarHBondContact O-CG1 3.45Å; M113-I117 PolarHBondContact O-N 3.05Å; F114-I117 PolarHBondContact O-N 2.75Å; Y115-I117 PolarHBondContact O-N 3.47Å; I117-M119 VanDerWaalsContact C-N 3.35Å; I117-Y120 WeakPolarHBondContact O-CB 3.34Å; I117-Y120 PolarHBondContact O-N 3.29Å; I117-H121 PolarHBondContact O-CD2 3.44Å; I117-H121 VanDerWaalsContact O-CD2 3.26Å; I117-H121 PolarHBondContact O-N 2.92Å; I117-A144 HydrophobicContact CD1-CB 3.56Å; I117-Y145 HydrophobicContact CG2-CE1 4.05Å; I117-I148 HydrophobicContact CD1-CD1 3.62Å
118T88.8Confident86.4Confident49 Ų4948.3 Ų48.330%0.30123%0.232SC..Hα-helixtrans-64.5-40.4177.149.60000111.8F114 Y115 Y120 H121 H122F114-T118 HydrophobicContact CD1-CG2 4.17Å; F114-T118 HydrophobicContact CD2-CG2 4.39Å; F114-T118 HydrophobicContact CE1-CG2 3.75Å; F114-T118 HydrophobicContact CE2-CG2 4Å; F114-T118 HydrophobicContact CG-CG2 4.47Å; F114-T118 HydrophobicContact CZ-CG2 3.66Å; F114-T118 WeakPolarHBondContact O-CB 3.44Å; F114-T118 WeakPolarHBondContact O-CG2 3.33Å; F114-T118 PolarHBondContact O-N 3.42Å; F114-T118 PolarHBondContact O-OG1 2.97Å; Y115-T118 WeakPolarHBondContact CA-OG1 3.29Å; Y115-T118 PolarHBondContact O-N 2.92Å; Y115-T118 PolarHBondContact O-OG1 3.46Å; T118-Y120 VanDerWaalsContact C-N 3.3Å; T118-Y120 PolarHBondContact O-N 3.3Å; T118-H121 PolarHBondContact O-N 2.76Å; T118-H122 WeakPolarHBondContact O-CB 3.43Å; T118-H122 PolarHBondContact O-N 3.23Å
119M87.3Confident85.2Confident41 Ų4150.3 Ų50.320%0.20225%0.246CC..Hα-helixtrans-61.1-40.9173.3-166.6-171.5-169.300111.3I65 I66 Y115 I117 H122 K123I65-M119 HydrophobicContact CG2-CE 4.34Å; I65-M119 HydrophobicContact CG2-SD 4.42Å; I66-M119 HydrophobicContact CD1-CB 4.46Å; I66-M119 HydrophobicContact CD1-CG 4.17Å; I66-M119 HydrophobicContact CD1-SD 4.27Å; I66-M119 HydrophobicContact CG1-CB 4.35Å; I66-M119 HydrophobicContact CG1-CG 4.11Å; I66-M119 HydrophobicContact CG1-SD 3.63Å; Y115-M119 HydrophobicContact CE1-SD 4.39Å; Y115-M119 VanDerWaalsContact O-CB 3.26Å; Y115-M119 WeakPolarHBondContact O-CB 3.3Å; Y115-M119 PolarHBondContact O-N 3.17Å; I117-M119 VanDerWaalsContact C-N 3.35Å; M119-H122 PolarHBondContact O-N 3.23Å; M119-K123 WeakPolarHBondContact O-CG 3.48Å; M119-K123 PolarHBondContact O-N 3.06Å; M119-K123 VanDerWaalsContact O-N 3.07Å
120Y85.6Confident84.1Confident4 Ų455.4 Ų55.42%0.01627%0.27CS..Hα-helixtrans-61.8-48.5174.6-179.1-111000112.2V34 H47 P49 W58 I66 A116 I117 T118 H122 K123 L124V34-Y120 HydrophobicContact CG2-CE1 4.1Å; H47-Y120 AromaticContact CE1-CE2 3.74Å; H47-Y120 AromaticContact ND1-CE2 3.9Å; H47-Y120 AromaticContact ND1-CZ 3.89Å; H47-Y120 PolarHBondContact ND1-OH 3Å; P49-Y120 HydrophobicContact CB-CD2 3.81Å; P49-Y120 HydrophobicContact CB-CE2 3.69Å; P49-Y120 HydrophobicContact CB-CG 4.36Å; P49-Y120 HydrophobicContact CG-CD2 4.43Å; P49-Y120 HydrophobicContact CG-CE1 4.32Å; P49-Y120 HydrophobicContact CG-CE2 4.16Å; W58-Y120 HydrophobicContact CH2-CD2 4.45Å; W58-Y120 HydrophobicContact CH2-CE2 4.43Å; I66-Y120 HydrophobicContact CD1-CD2 4.42Å; A116-Y120 WeakPolarHBondContact O-CB 3.07Å; A116-Y120 PolarHBondContact O-N 3.08Å; I117-Y120 WeakPolarHBondContact O-CB 3.34Å; I117-Y120 PolarHBondContact O-N 3.29Å; T118-Y120 VanDerWaalsContact C-N 3.3Å; T118-Y120 PolarHBondContact O-N 3.3Å; Y120-H122 PolarHBondContact O-N 3.37Å; Y120-K123 PolarHBondContact O-N 2.97Å; Y120-L124 HydrophobicContact CD1-CD1 3.76Å; Y120-L124 HydrophobicContact CD1-CG 4.45Å; Y120-L124 HydrophobicContact CE1-CD1 3.4Å; Y120-L124 HydrophobicContact CE1-CG 4.17Å; Y120-L124 HydrophobicContact CE2-CG 4.49Å; Y120-L124 HydrophobicContact CG-CD1 4.48Å; Y120-L124 WeakPolarHBondContact O-CG 3.33Å; Y120-L124 PolarHBondContact O-N 2.94Å
121H84.6Confident82.7Confident37 Ų3760.3 Ų60.317%0.17129%0.289CS..Hα-helixtrans-62.5-41.7176.5-81.7-65.9000113.2I117 T118 K123 L124 N125I117-H121 PolarHBondContact O-CD2 3.44Å; I117-H121 VanDerWaalsContact O-CD2 3.26Å; I117-H121 PolarHBondContact O-N 2.92Å; T118-H121 PolarHBondContact O-N 2.76Å; H121-K123 VanDerWaalsContact C-N 3.26Å; H121-K123 PolarHBondContact O-N 2.92Å; H121-L124 PolarHBondContact O-N 3.3Å; H121-N125 PolarHBondContact O-N 2.92Å
122H85.5Confident81.5Confident131 Ų13157.1 Ų57.161%0.60627%0.266SS*.Hα-helixtrans-59-42.3176.4-17773.1000111.1T118 M119 Y120 N125 K126T118-H122 WeakPolarHBondContact O-CB 3.43Å; T118-H122 PolarHBondContact O-N 3.23Å; M119-H122 PolarHBondContact O-N 3.23Å; Y120-H122 PolarHBondContact O-N 3.37Å; H122-N125 PolarHBondContact O-N 3.46Å; H122-K126 PolarHBondContact O-N 3.19Å
123K80.4Confident80.2Confident36 Ų3660.9 Ų60.916%0.15729%0.285CS..Hα-helixtrans-69.8-37.5176.2-71.9-172.4-174.9-176.80113.5W58 S62 I66 M119 Y120 H121 N125 K126 G127W58-K123 HydrophobicContact CH2-CB 3.45Å; W58-K123 VanDerWaalsContact CH2-CB 3.45Å; W58-K123 HydrophobicContact CH2-CD 4.28Å; W58-K123 HydrophobicContact CZ2-CB 3.7Å; W58-K123 HydrophobicContact CZ3-CB 4.4Å; W58-K123 HydrophobicContact CZ3-CD 4.5Å; S62-K123 PolarHBondContact O-NZ 3.29Å; S62-K123 PolarHBondContact OG-NZ 3.46Å; I66-K123 HydrophobicContact CD1-CD 3.87Å; M119-K123 WeakPolarHBondContact O-CG 3.48Å; M119-K123 PolarHBondContact O-N 3.06Å; M119-K123 VanDerWaalsContact O-N 3.07Å; Y120-K123 PolarHBondContact O-N 2.97Å; H121-K123 VanDerWaalsContact C-N 3.26Å; H121-K123 PolarHBondContact O-N 2.92Å; K123-N125 VanDerWaalsContact C-N 3.28Å; K123-N125 PolarHBondContact O-N 3.16Å; K123-K126 PolarHBondContact O-N 3.26Å; K123-G127 PolarHBondContact O-N 3.03Å
124L78.5Confident79.1Confident3 Ų363.3 Ų63.32%0.01630%0.303CS..Hα-helixtrans-59.1-43.2172.2-74.6171.4000111.1V34 L36 W58 Y120 H121 G127 Q128 Y135V34-L124 HydrophobicContact CG1-CD2 4.46Å; V34-L124 HydrophobicContact CG2-CD1 3.83Å; L36-L124 HydrophobicContact CD2-CD2 4.27Å; W58-L124 HydrophobicContact CZ2-CD2 4.4Å; Y120-L124 HydrophobicContact CD1-CD1 3.76Å; Y120-L124 HydrophobicContact CD1-CG 4.45Å; Y120-L124 HydrophobicContact CE1-CD1 3.4Å; Y120-L124 HydrophobicContact CE1-CG 4.17Å; Y120-L124 HydrophobicContact CE2-CG 4.49Å; Y120-L124 HydrophobicContact CG-CD1 4.48Å; Y120-L124 WeakPolarHBondContact O-CG 3.33Å; Y120-L124 PolarHBondContact O-N 2.94Å; H121-L124 PolarHBondContact O-N 3.3Å; L124-G127 PolarHBondContact O-N 3.37Å; L124-Q128 PolarHBondContact O-N 3.39Å; L124-Y135 HydrophobicContact CB-CE1 4.35Å; L124-Y135 HydrophobicContact CD1-CE2 4.37Å
125N80.8Confident78.2Confident87 Ų8760.8 Ų60.847%0.46529%0.29SS..Hα-helixtrans-65.7-42.8178.2-161.426.3000111.9H121 H122 K123 Q128 L129H121-N125 PolarHBondContact O-N 2.92Å; H122-N125 PolarHBondContact O-N 3.46Å; K123-N125 VanDerWaalsContact C-N 3.28Å; K123-N125 PolarHBondContact O-N 3.16Å; N125-Q128 WeakPolarHBondContact O-CB 3.37Å; N125-Q128 PolarHBondContact O-N 3.35Å; N125-L129 PolarHBondContact O-N 2.99Å
126K78.8Confident77.5Confident119 Ų11960.9 Ų60.952%0.51729%0.294SS..Hα-helixtrans-62-43.7173.5-170.5178.6178.8-178.10111.7H122 K123 Q128 L129 E130H122-K126 PolarHBondContact O-N 3.19Å; K123-K126 PolarHBondContact O-N 3.26Å; K126-Q128 VanDerWaalsContact C-N 3.28Å; K126-Q128 PolarHBondContact O-N 2.89Å; K126-L129 PolarHBondContact O-N 3.35Å; K126-E130 PolarHBondContact O-N 2.89Å
127G71.8Confident76.9Confident4 Ų463.8 Ų63.84%0.04131%0.311CS..Hα-helixtrans-64.5-30176.400000113.3K123 L124 E130 Y131 F132K123-G127 PolarHBondContact O-N 3.03Å; L124-G127 PolarHBondContact O-N 3.37Å; G127-E130 PolarHBondContact O-N 2.67Å; G127-Y131 PolarHBondContact O-N 3.34Å; G127-F132 VanDerWaalsContact O-CD2 3.29Å; G127-F132 WeakPolarHBondContact O-CD2 3.46Å; G127-F132 PolarHBondContact O-N 2.86Å
128Q72Confident76.6Confident58 Ų5867 Ų6727%0.27133%0.325SS..Hα-helixtrans-65-39.1174.3-173.9-178.6-17.200111.8L124 N125 K126 E130 I133 Y135L124-Q128 PolarHBondContact O-N 3.39Å; N125-Q128 WeakPolarHBondContact O-CB 3.37Å; N125-Q128 PolarHBondContact O-N 3.35Å; K126-Q128 VanDerWaalsContact C-N 3.28Å; K126-Q128 PolarHBondContact O-N 2.89Å; Q128-E130 VanDerWaalsContact C-N 3.32Å; Q128-E130 PolarHBondContact O-N 2.91Å; Q128-I133 PolarHBondContact NE2-O 2.86Å; Q128-Y135 HydrophobicContact CB-CD1 4.42Å; Q128-Y135 VanDerWaalsContact OE1-CD1 3.3Å
129L67.5Low76.2Confident136 Ų13673.3 Ų73.371%0.71234%0.344SS*.Hα-helixtrans-63.1-41.3177.6-66.8166.7000111.4K39 N125 K126K39-L129 PolarHBondContact NZ-O 3.44Å; N125-L129 PolarHBondContact O-N 2.99Å; K126-L129 PolarHBondContact O-N 3.35Å
130E69.8Low76Confident108 Ų10871.7 Ų71.751%0.50534%0.336SS..Hα-helixtrans-88.5-42.7-174.2-71.5172.2-163.200114K126 G127 Q128K126-E130 PolarHBondContact O-N 2.89Å; G127-E130 PolarHBondContact O-N 2.67Å; Q128-E130 VanDerWaalsContact C-N 3.32Å; Q128-E130 PolarHBondContact O-N 2.91Å
131Y64Low75.9Confident103 Ų10371.8 Ų71.840%0.40434%0.337SS..THydrogen-bonded Turntrans-124.2-21.9-163.3-56.1-79000116.4K39 L57 G127K39-Y131 PolarHBondContact N-O 3.27Å; L57-Y131 HydrophobicContact CD2-CG 4.43Å; L57-Y131 HydrophobicContact CG-CD1 4.23Å; L57-Y131 HydrophobicContact CG-CG 4.43Å; G127-Y131 PolarHBondContact O-N 3.34Å
132F67.8Low75.9Confident10 Ų1075.3 Ų75.34%0.04435%0.352CS..EExtended strand (participates in β ladder)trans-123.4157.5-171.2-50.8-76.3000113.6L36 P38 K39 L57 G127L36-F132 HydrophobicContact CB-CD1 3.95Å; L36-F132 HydrophobicContact CB-CE1 3.82Å; L36-F132 HydrophobicContact CB-CZ 4.45Å; L36-F132 HydrophobicContact CD1-CE1 3.95Å; L36-F132 HydrophobicContact CD1-CZ 3.8Å; L36-F132 HydrophobicContact CD2-CD1 4.21Å; L36-F132 HydrophobicContact CD2-CD2 4.12Å; L36-F132 HydrophobicContact CD2-CE1 4.11Å; L36-F132 HydrophobicContact CD2-CE2 4.02Å; L36-F132 HydrophobicContact CD2-CG 4.22Å; L36-F132 HydrophobicContact CD2-CZ 4.01Å; L36-F132 HydrophobicContact CG-CE1 4.18Å; L36-F132 HydrophobicContact CG-CZ 4.32Å; P38-F132 HydrophobicContact CB-CD1 4.27Å; K39-F132 VanDerWaalsContact CE-O 3.26Å; K39-F132 WeakPolarHBondContact CE-O 3.3Å; L57-F132 HydrophobicContact CD2-CE1 3.54Å; L57-F132 HydrophobicContact CD2-CE2 4.47Å; L57-F132 HydrophobicContact CD2-CZ 3.53Å; G127-F132 VanDerWaalsContact O-CD2 3.29Å; G127-F132 WeakPolarHBondContact O-CD2 3.46Å; G127-F132 PolarHBondContact O-N 2.86Å
133I64.5Low76Confident108 Ų10869.2 Ų69.255%0.55432%0.324SS*.EExtended strand (participates in β ladder)trans-84.4-45172.9-61.8176.2000109.9I37 K39 Q128I37-I133 PolarHBondContact O-N 3.43Å; K39-I133 HydrophobicContact CB-CG1 4.31Å; K39-I133 HydrophobicContact CG-CD1 4.28Å; K39-I133 HydrophobicContact CG-CG1 3.45Å; K39-I133 VanDerWaalsContact CG-CG1 3.45Å; Q128-I133 PolarHBondContact NE2-O 2.86Å
134S69Low76.4Confident54 Ų5467.6 Ų67.638%0.37832%0.318SS..EExtended strand (participates in β ladder)trans-158.7155.6-179-173.40000109.5I37I37-S134 PolarHBondContact N-O 3.19Å; I37-S134 VanDerWaalsContact N-O 3.14Å
135Y72.8Confident77Confident54 Ų5471.9 Ų71.921%0.21233%0.334CS..EExtended strand (participates in β ladder)trans-126.7145.1170.472.4-92.5000110V34 E35 L124 Q128V34-Y135 HydrophobicContact CG1-CD2 3.75Å; V34-Y135 HydrophobicContact CG1-CG 4.14Å; E35-Y135 CarbonylContact O-C 3.43Å; E35-Y135 WeakPolarHBondContact O-CA 3.45Å; L124-Y135 HydrophobicContact CB-CE1 4.35Å; L124-Y135 HydrophobicContact CD1-CE2 4.37Å; Q128-Y135 HydrophobicContact CB-CD1 4.42Å; Q128-Y135 VanDerWaalsContact OE1-CD1 3.3Å
136K77.7Confident77.5Confident134 Ų13470.2 Ų70.258%0.58333%0.325SS*.EExtended strand (participates in β ladder)trans-115.9117.7178.3-169178.7-177.8176.30110.3E35E35-K136 HydrophobicContact CB-CB 4.4Å; E35-K136 PolarHBondContact N-O 3.13Å; E35-K136 PolarHBondContact O-N 2.95Å
137T77.9Confident78.1Confident61 Ų6164.6 Ų64.637%0.37430%0.301SS..EExtended strand (participates in β ladder)trans-73.7134.8176.2-48.20000110.8V141T137-V141 HydrophobicContact CG2-CB 3.63Å; T137-V141 HydrophobicContact CG2-CG1 4.09Å; T137-V141 HydrophobicContact CG2-CG2 3.4Å
138K83.8Confident79.1Confident70 Ų7065 Ų6530%0.30430%0.302SS..  trans-95.5169.8175.9-66.5-71.1-170.8173.10112N32 W33 E35 V140 V141N32-K138 VanDerWaalsContact O-CB 3.27Å; N32-K138 WeakPolarHBondContact O-CB 3.3Å; N32-K138 VanDerWaalsContact O-CG 3.29Å; N32-K138 WeakPolarHBondContact O-CG 3.38Å; W33-K138 WeakPolarHBondContact O-CB 3.38Å; W33-K138 PolarHBondContact O-N 3.26Å; E35-K138 WeakPolarHBondContact OE1-CE 3.49Å; E35-K138 IonicContact OE1-NZ 2.66Å; E35-K138 PolarHBondContact OE1-NZ 3.08Å; E35-K138 WeakPolarHBondContact OE2-CE 3.4Å; E35-K138 IonicContact OE2-NZ 3.23Å; E35-K138 PolarHBondContact OE2-NZ 2.88Å; K138-V140 PolarHBondContact O-N 3.49Å; K138-V140 VanDerWaalsContact O-N 3.1Å; K138-V141 PolarHBondContact O-N 3.16Å
139W81Confident80.2Confident181 Ų18164.2 Ų64.269%0.68631%0.305SS*.THydrogen-bonded Turntrans-61.7-17.6-179.9-165.274.1000113.9V141 F142 T143W139-V141 PolarHBondContact O-N 2.78Å; W139-F142 AromaticContact CE2-CD1 3.85Å; W139-F142 AromaticContact CZ2-CD1 3.99Å; W139-F142 HydrophobicContact CZ2-CD1 3.99Å; W139-F142 HydrophobicContact CZ2-CE1 4.33Å; W139-F142 AromaticContact NE1-CD1 3.67Å; W139-F142 WeakPolarHBondContact O-CA 3.49Å; W139-F142 WeakPolarHBondContact O-CB 3.4Å; W139-F142 PolarHBondContact O-N 2.99Å; W139-T143 HydrophobicContact CE3-CG2 3.97Å; W139-T143 HydrophobicContact CH2-CG2 4.23Å; W139-T143 HydrophobicContact CZ3-CG2 3.74Å; W139-T143 PolarHBondContact O-N 3.26Å
140V82.3Confident81.4Confident8 Ų860.2 Ų60.25%0.04828%0.282CS..Hα-helixtrans-60.9-31.8176-171.90000112.1M30 W33 K138 F142 T143 A144M30-V140 HydrophobicContact CB-CB 4.45Å; M30-V140 HydrophobicContact CB-CG1 3.78Å; M30-V140 HydrophobicContact CB-CG2 3.77Å; M30-V140 HydrophobicContact CE-CG2 3.87Å; M30-V140 HydrophobicContact CG-CG1 4.36Å; M30-V140 HydrophobicContact CG-CG2 4.04Å; W33-V140 HydrophobicContact CD2-CG1 3.97Å; W33-V140 VanDerWaalsContact CE2-CG1 3.49Å; W33-V140 HydrophobicContact CG-CB 4.46Å; W33-V140 HydrophobicContact CG-CG1 4.14Å; W33-V140 HydrophobicContact CZ2-CG1 3.87Å; K138-V140 PolarHBondContact O-N 3.49Å; K138-V140 VanDerWaalsContact O-N 3.1Å; V140-F142 PolarHBondContact O-N 2.84Å; V140-T143 PolarHBondContact O-N 3.42Å; V140-T143 PolarHBondContact O-OG1 3Å; V140-A144 PolarHBondContact O-N 3.29Å
141V83.1Confident82.5Confident6 Ų655.1 Ų55.14%0.03626%0.259CS..Hα-helixtrans-67-31.2175.6178.60000111.3W33 T137 K138 W139 T143 A144 Y145W33-V141 HydrophobicContact CE3-CG2 3.81Å; W33-V141 HydrophobicContact CZ3-CG2 4.34Å; T137-V141 HydrophobicContact CG2-CB 3.63Å; T137-V141 HydrophobicContact CG2-CG1 4.09Å; T137-V141 HydrophobicContact CG2-CG2 3.4Å; K138-V141 PolarHBondContact O-N 3.16Å; W139-V141 PolarHBondContact O-N 2.78Å; V141-T143 VanDerWaalsContact C-N 3.34Å; V141-T143 PolarHBondContact O-N 3.37Å; V141-A144 PolarHBondContact O-N 2.89Å; V141-Y145 HydrophobicContact CG1-CD2 3.9Å; V141-Y145 HydrophobicContact CG1-CE2 3.45Å; V141-Y145 VanDerWaalsContact CG1-CE2 3.45Å; V141-Y145 WeakPolarHBondContact O-CD2 3.33Å; V141-Y145 PolarHBondContact O-N 3.04Å; V141-Y145 VanDerWaalsContact O-N 3.16Å
142F85.6Confident83.8Confident111 Ų11152.9 Ų52.949%0.48725%0.253SS..Hα-helixtrans-65.2-37174.9-178.6-98.6000111.9W139 V140 A144 Y145 L146W139-F142 AromaticContact CE2-CD1 3.85Å; W139-F142 AromaticContact CZ2-CD1 3.99Å; W139-F142 HydrophobicContact CZ2-CD1 3.99Å; W139-F142 HydrophobicContact CZ2-CE1 4.33Å; W139-F142 AromaticContact NE1-CD1 3.67Å; W139-F142 WeakPolarHBondContact O-CA 3.49Å; W139-F142 WeakPolarHBondContact O-CB 3.4Å; W139-F142 PolarHBondContact O-N 2.99Å; V140-F142 PolarHBondContact O-N 2.84Å; F142-A144 VanDerWaalsContact C-N 3.28Å; F142-A144 PolarHBondContact O-N 3.21Å; F142-Y145 PolarHBondContact O-N 3.26Å; F142-L146 HydrophobicContact CE1-CD2 4.22Å; F142-L146 WeakPolarHBondContact O-CB 3.47Å; F142-L146 PolarHBondContact O-N 2.9Å
143T87.3Confident84.9Confident2 Ų254.6 Ų54.61%0.01227%0.265CS..Hα-helixtrans-65.6-34.717770.10000111.7M23 W139 V140 V141 L146 A147M23-T143 HydrophobicContact CE-CG2 3.89Å; M23-T143 HydrophobicContact SD-CG2 4.38Å; W139-T143 HydrophobicContact CE3-CG2 3.97Å; W139-T143 HydrophobicContact CH2-CG2 4.23Å; W139-T143 HydrophobicContact CZ3-CG2 3.74Å; W139-T143 PolarHBondContact O-N 3.26Å; V140-T143 PolarHBondContact O-N 3.42Å; V140-T143 PolarHBondContact O-OG1 3Å; V141-T143 VanDerWaalsContact C-N 3.34Å; V141-T143 PolarHBondContact O-N 3.37Å; T143-L146 PolarHBondContact O-N 2.97Å; T143-A147 WeakPolarHBondContact O-CB 3.31Å; T143-A147 PolarHBondContact O-N 3.44Å
144A88.1Confident86.2Confident3 Ų349.6 Ų49.63%0.02524%0.239CC..Hα-helixtrans-67.4-41175.500000112.4W33 I117 V140 V141 F142 A147 I148W33-A144 HydrophobicContact CH2-CB 3.78Å; W33-A144 HydrophobicContact CZ3-CB 4.11Å; I117-A144 HydrophobicContact CD1-CB 3.56Å; V140-A144 PolarHBondContact O-N 3.29Å; V141-A144 PolarHBondContact O-N 2.89Å; F142-A144 VanDerWaalsContact C-N 3.28Å; F142-A144 PolarHBondContact O-N 3.21Å; A144-A147 WeakPolarHBondContact O-CB 3.44Å; A144-A147 PolarHBondContact O-N 3.39Å; A144-I148 WeakPolarHBondContact O-CG1 3.4Å; A144-I148 PolarHBondContact O-N 3.43Å; A144-I148 VanDerWaalsContact O-N 3.1Å
145Y90.6Very high87.1Confident92 Ų9247 Ų4736%0.36122%0.221SC..Hα-helixtrans-65.8-38.4172.6-73.6-60.8000112.6I117 V141 F142 A147 I148 A149I117-Y145 HydrophobicContact CG2-CE1 4.05Å; V141-Y145 HydrophobicContact CG1-CD2 3.9Å; V141-Y145 HydrophobicContact CG1-CE2 3.45Å; V141-Y145 VanDerWaalsContact CG1-CE2 3.45Å; V141-Y145 WeakPolarHBondContact O-CD2 3.33Å; V141-Y145 PolarHBondContact O-N 3.04Å; V141-Y145 VanDerWaalsContact O-N 3.16Å; F142-Y145 PolarHBondContact O-N 3.26Å; Y145-A147 VanDerWaalsContact C-N 3.32Å; Y145-I148 HydrophobicContact CD1-CD1 4.28Å; Y145-I148 WeakPolarHBondContact O-CB 3.27Å; Y145-I148 PolarHBondContact O-N 2.85Å; Y145-A149 PolarHBondContact O-N 2.91Å
146L91.9Very high87.9Confident53 Ų5348.5 Ų48.528%0.27723%0.232SC..Hα-helixtrans-66.1-36.4175.8-172.153.9000111.6M23 F142 T143 A149 F150M23-L146 HydrophobicContact CE-CB 4.19Å; M23-L146 HydrophobicContact CE-CD2 3.41Å; M23-L146 VanDerWaalsContact CE-CD2 3.41Å; M23-L146 HydrophobicContact CE-CG 4.05Å; F142-L146 HydrophobicContact CE1-CD2 4.22Å; F142-L146 WeakPolarHBondContact O-CB 3.47Å; F142-L146 PolarHBondContact O-N 2.9Å; T143-L146 PolarHBondContact O-N 2.97Å; L146-A149 WeakPolarHBondContact O-CB 3.43Å; L146-A149 PolarHBondContact O-N 3.31Å; L146-F150 HydrophobicContact CD1-CD1 4.43Å; L146-F150 HydrophobicContact CD1-CE1 3.84Å; L146-F150 HydrophobicContact CD1-CE2 4.27Å; L146-F150 HydrophobicContact CD1-CZ 3.76Å; L146-F150 HydrophobicContact CD2-CE2 4.37Å; L146-F150 HydrophobicContact CD2-CZ 4.19Å; L146-F150 HydrophobicContact CG-CD2 4.42Å; L146-F150 HydrophobicContact CG-CE1 4.32Å; L146-F150 HydrophobicContact CG-CE2 3.83Å; L146-F150 HydrophobicContact CG-CZ 3.77Å; L146-F150 WeakPolarHBondContact O-CG 3.49Å; L146-F150 PolarHBondContact O-N 3.21Å
147A92.3Very high88.4Confident0 Ų045.2 Ų45.20%022%0.218CC..Hα-helixtrans-61.6-42.9171.500000112.2M23 M24 T143 A144 Y145 A149 F150 L151M23-A147 HydrophobicContact CB-CB 3.9Å; M24-A147 HydrophobicContact CG-CB 3.85Å; T143-A147 WeakPolarHBondContact O-CB 3.31Å; T143-A147 PolarHBondContact O-N 3.44Å; A144-A147 WeakPolarHBondContact O-CB 3.44Å; A144-A147 PolarHBondContact O-N 3.39Å; Y145-A147 VanDerWaalsContact C-N 3.32Å; A147-A149 VanDerWaalsContact C-N 3.34Å; A147-A149 PolarHBondContact O-N 2.93Å; A147-F150 PolarHBondContact O-N 2.85Å; A147-L151 WeakPolarHBondContact O-CG 3.38Å; A147-L151 PolarHBondContact O-N 2.92Å
148I93.1Very high88.7Confident13 Ų1342.4 Ų42.47%0.06720%0.2CC..Hα-helixtrans-59.8-47.1174-67.7163.7000110.2M113 F114 I117 A144 Y145 F150 L151 L152M113-I148 HydrophobicContact CB-CD1 4.06Å; M113-I148 HydrophobicContact CB-CG1 3.67Å; F114-I148 HydrophobicContact CB-CD1 4.04Å; F114-I148 HydrophobicContact CD2-CD1 4.38Å; I117-I148 HydrophobicContact CD1-CD1 3.62Å; A144-I148 WeakPolarHBondContact O-CG1 3.4Å; A144-I148 PolarHBondContact O-N 3.43Å; A144-I148 VanDerWaalsContact O-N 3.1Å; Y145-I148 HydrophobicContact CD1-CD1 4.28Å; Y145-I148 WeakPolarHBondContact O-CB 3.27Å; Y145-I148 PolarHBondContact O-N 2.85Å; I148-F150 VanDerWaalsContact C-N 3.31Å; I148-F150 PolarHBondContact O-N 2.9Å; I148-L151 PolarHBondContact O-N 2.85Å; I148-L152 HydrophobicContact CG2-CD1 3.91Å; I148-L152 HydrophobicContact CG2-CG 4.26Å; I148-L152 WeakPolarHBondContact O-CG 3.38Å; I148-L152 PolarHBondContact O-N 2.97Å
149A94.1Very high88.7Confident41 Ų4143.2 Ų43.234%0.33920%0.204SC..Hα-helixtrans-57.6-45.2177.900000111.4Y145 L146 A147 L151 L152 T153Y145-A149 PolarHBondContact O-N 2.91Å; L146-A149 WeakPolarHBondContact O-CB 3.43Å; L146-A149 PolarHBondContact O-N 3.31Å; A147-A149 VanDerWaalsContact C-N 3.34Å; A147-A149 PolarHBondContact O-N 2.93Å; A149-L151 PolarHBondContact O-N 3.39Å; A149-L152 PolarHBondContact O-N 2.94Å; A149-T153 WeakPolarHBondContact O-CG2 3.35Å; A149-T153 PolarHBondContact O-N 3.38Å; A149-T153 PolarHBondContact O-OG1 3.44Å; A149-T153 VanDerWaalsContact O-OG1 3.12Å
150F93Very high88.8Confident52 Ų5237.8 Ų37.823%0.22819%0.187CC..Hα-helixtrans-61.3-42.9176.8-68.4-24.8000113.2F16 A20 M23 L146 A147 I148 T153 C154F16-F150 AromaticContact CD1-CD1 3.78Å; F16-F150 HydrophobicContact CD1-CD1 3.78Å; F16-F150 HydrophobicContact CD1-CE1 4.19Å; F16-F150 HydrophobicContact CD1-CG 4.37Å; F16-F150 HydrophobicContact CE1-CD1 4.27Å; F16-F150 HydrophobicContact CE1-CE1 4.35Å; A20-F150 HydrophobicContact CB-CB 3.99Å; M23-F150 HydrophobicContact CG-CE2 4.33Å; L146-F150 HydrophobicContact CD1-CD1 4.43Å; L146-F150 HydrophobicContact CD1-CE1 3.84Å; L146-F150 HydrophobicContact CD1-CE2 4.27Å; L146-F150 HydrophobicContact CD1-CZ 3.76Å; L146-F150 HydrophobicContact CD2-CE2 4.37Å; L146-F150 HydrophobicContact CD2-CZ 4.19Å; L146-F150 HydrophobicContact CG-CD2 4.42Å; L146-F150 HydrophobicContact CG-CE1 4.32Å; L146-F150 HydrophobicContact CG-CE2 3.83Å; L146-F150 HydrophobicContact CG-CZ 3.77Å; L146-F150 WeakPolarHBondContact O-CG 3.49Å; L146-F150 PolarHBondContact O-N 3.21Å; A147-F150 PolarHBondContact O-N 2.85Å; I148-F150 VanDerWaalsContact C-N 3.31Å; I148-F150 PolarHBondContact O-N 2.9Å; F150-T153 WeakPolarHBondContact CA-OG1 3.33Å; F150-T153 PolarHBondContact O-N 2.86Å; F150-T153 PolarHBondContact O-OG1 3.47Å; F150-C154 WeakPolarHBondContact O-CB 3.45Å; F150-C154 PolarHBondContact O-N 3.4Å
151L91.9Very high88.7Confident2 Ų237.4 Ų37.41%0.0119%0.185CC..Hα-helixtrans-63.2-41.5176.6-71.4169.2000112.4A20 S106 T109 A147 I148 A149 C154 G155A20-L151 HydrophobicContact CB-CD2 4.01Å; A20-L151 HydrophobicContact CB-CG 3.91Å; S106-L151 PolarHBondContact OG-O 3.43Å; T109-L151 HydrophobicContact CG2-CD1 3.98Å; A147-L151 WeakPolarHBondContact O-CG 3.38Å; A147-L151 PolarHBondContact O-N 2.92Å; I148-L151 PolarHBondContact O-N 2.85Å; A149-L151 PolarHBondContact O-N 3.39Å; L151-C154 PolarHBondContact O-N 3.45Å; L151-G155 PolarHBondContact O-N 3.23Å; L151-G155 VanDerWaalsContact O-N 3.1Å
152L91.9Very high88.4Confident56 Ų5637.8 Ų37.829%0.29319%0.188SC..Hα-helixtrans-67.1-44.4176.3-65.6177.1000111.3F107 I148 A149 C154 G155 I156F107-L152 HydrophobicContact CD1-CD2 3.46Å; F107-L152 VanDerWaalsContact CD1-CD2 3.46Å; F107-L152 HydrophobicContact CE1-CD2 3.71Å; F107-L152 HydrophobicContact CG-CD2 4.42Å; I148-L152 HydrophobicContact CG2-CD1 3.91Å; I148-L152 HydrophobicContact CG2-CG 4.26Å; I148-L152 WeakPolarHBondContact O-CG 3.38Å; I148-L152 PolarHBondContact O-N 2.97Å; A149-L152 PolarHBondContact O-N 2.94Å; L152-C154 VanDerWaalsContact C-N 3.32Å; L152-C154 PolarHBondContact O-N 3.03Å; L152-G155 PolarHBondContact O-N 3.39Å; L152-G155 VanDerWaalsContact O-N 3.11Å; L152-I156 WeakPolarHBondContact O-CG1 3.38Å; L152-I156 PolarHBondContact O-N 2.92Å
153T91.4Very high87.9Confident46 Ų4637.1 Ų37.128%0.28219%0.193SC..Hα-helixtrans-62.6-39.5176.853.70000112A149 F150 G155 I156 F157A149-T153 WeakPolarHBondContact O-CG2 3.35Å; A149-T153 PolarHBondContact O-N 3.38Å; A149-T153 PolarHBondContact O-OG1 3.44Å; A149-T153 VanDerWaalsContact O-OG1 3.12Å; F150-T153 WeakPolarHBondContact CA-OG1 3.33Å; F150-T153 PolarHBondContact O-N 2.86Å; F150-T153 PolarHBondContact O-OG1 3.47Å; T153-G155 VanDerWaalsContact C-N 3.27Å; T153-G155 PolarHBondContact O-N 3.15Å; T153-I156 PolarHBondContact O-N 3.43Å; T153-F157 WeakPolarHBondContact O-CD2 3.39Å; T153-F157 PolarHBondContact O-N 3.29Å
154C90.9Very high86.9Confident2 Ų241.3 Ų41.31%0.01422%0.216CC..Hα-helixtrans-59.2-41.6173.9-171.70000110.9F16 F150 L151 L152 F157 C158F16-C154 HydrophobicContact CB-CB 4.49Å; F150-C154 WeakPolarHBondContact O-CB 3.45Å; F150-C154 PolarHBondContact O-N 3.4Å; L151-C154 PolarHBondContact O-N 3.45Å; L152-C154 VanDerWaalsContact C-N 3.32Å; L152-C154 PolarHBondContact O-N 3.03Å; C154-F157 PolarHBondContact O-N 3.14Å; C154-C158 PolarHBondContact O-N 3.43Å; C154-C158 PolarHBondContact O-SG 3.25Å
155G89Confident85.5Confident0 Ų044.1 Ų44.10%023%0.233CC..Hα-helixtrans-62-48.1175.700000112.8S106 L151 L152 T153 F157 C158 F159S106-G155 WeakPolarHBondContact OG-CA 3.39Å; S106-G155 PolarHBondContact OG-N 2.91Å; S106-G155 VanDerWaalsContact OG-N 3.14Å; L151-G155 PolarHBondContact O-N 3.23Å; L151-G155 VanDerWaalsContact O-N 3.1Å; L152-G155 PolarHBondContact O-N 3.39Å; L152-G155 VanDerWaalsContact O-N 3.11Å; T153-G155 VanDerWaalsContact C-N 3.27Å; T153-G155 PolarHBondContact O-N 3.15Å; G155-F157 VanDerWaalsContact C-N 3.34Å; G155-F157 PolarHBondContact O-N 2.96Å; G155-C158 WeakPolarHBondContact O-CB 3.43Å; G155-C158 PolarHBondContact O-N 2.88Å; G155-F159 WeakPolarHBondContact O-CD2 3.48Å; G155-F159 PolarHBondContact O-N 3.32Å
156I88.5Confident83.6Confident85 Ų8542.3 Ų42.344%0.43623%0.232SC..Hα-helixtrans-58.7-46.2178.3-64.8166.8000110.7F107 L152 T153 C158 F159 I160F107-I156 HydrophobicContact CE2-CG1 4.39Å; F107-I156 HydrophobicContact CZ-CG1 3.76Å; L152-I156 WeakPolarHBondContact O-CG1 3.38Å; L152-I156 PolarHBondContact O-N 2.92Å; T153-I156 PolarHBondContact O-N 3.43Å; I156-C158 PolarHBondContact O-N 3.39Å; I156-F159 PolarHBondContact O-N 3.32Å; I156-I160 HydrophobicContact CG2-CD1 3.85Å; I156-I160 HydrophobicContact CG2-CG1 4.45Å; I156-I160 WeakPolarHBondContact O-CG1 3.37Å; I156-I160 PolarHBondContact O-N 2.91Å
157F87.9Confident81.4Confident66 Ų6642.6 Ų42.629%0.28924%0.243SC..Hα-helixtrans-63-39.2177.9-76.6-51.3000112.7I9 N13 F16 T153 C154 G155 F159 I160 Q161I9-F157 HydrophobicContact CG2-CB 3.82Å; I9-F157 HydrophobicContact CG2-CD1 4.08Å; I9-F157 HydrophobicContact CG2-CG 4.2Å; N13-F157 WeakPolarHBondContact OD1-CB 3.47Å; F16-F157 HydrophobicContact CD2-CD2 4.02Å; F16-F157 AromaticContact CD2-CE2 3.91Å; F16-F157 HydrophobicContact CD2-CE2 3.91Å; F16-F157 AromaticContact CE2-CD2 3.94Å; F16-F157 HydrophobicContact CE2-CD2 3.94Å; F16-F157 AromaticContact CE2-CE2 3.37Å; F16-F157 HydrophobicContact CE2-CE2 3.37Å; F16-F157 HydrophobicContact CE2-CZ 4.27Å; F16-F157 HydrophobicContact CZ-CE2 4.17Å; T153-F157 WeakPolarHBondContact O-CD2 3.39Å; T153-F157 PolarHBondContact O-N 3.29Å; C154-F157 PolarHBondContact O-N 3.14Å; G155-F157 VanDerWaalsContact C-N 3.34Å; G155-F157 PolarHBondContact O-N 2.96Å; F157-F159 VanDerWaalsContact C-N 3.34Å; F157-F159 PolarHBondContact O-N 3.27Å; F157-I160 HydrophobicContact CD1-CD1 4.28Å; F157-I160 PolarHBondContact O-N 3.35Å; F157-Q161 WeakPolarHBondContact O-CG 3.26Å; F157-Q161 PolarHBondContact O-N 2.87Å
158C85.6Confident79Confident1 Ų147.6 Ų47.61%0.00728%0.277CS..Hα-helixtrans-61.6-39.6172.8-71.50000112.5N13 I102 C154 G155 I156 Q161 C162N13-C158 PolarHBondContact ND2-SG 3.49Å; I102-C158 VanDerWaalsContact CG2-SG 3.6Å; C154-C158 PolarHBondContact O-N 3.43Å; C154-C158 PolarHBondContact O-SG 3.25Å; G155-C158 WeakPolarHBondContact O-CB 3.43Å; G155-C158 PolarHBondContact O-N 2.88Å; I156-C158 PolarHBondContact O-N 3.39Å; C158-Q161 PolarHBondContact O-N 2.81Å; C158-C162 PolarHBondContact O-N 3.48Å
159F83.4Confident76.6Confident88 Ų8855.1 Ų55.139%0.38631%0.313SS..Hα-helixtrans-64.9-42.3174.2-82.8-72.3000112.5L100 F107 G155 I156 F157 Q161 C162 T163L100-F159 HydrophobicContact CD2-CD1 3.84Å; L100-F159 HydrophobicContact CD2-CE1 3.56Å; F107-F159 HydrophobicContact CD2-CD2 4.3Å; F107-F159 AromaticContact CD2-CE2 3.73Å; F107-F159 HydrophobicContact CD2-CE2 3.73Å; F107-F159 AromaticContact CE2-CD2 3.75Å; F107-F159 HydrophobicContact CE2-CD2 3.75Å; F107-F159 AromaticContact CE2-CE2 3.59Å; F107-F159 HydrophobicContact CE2-CE2 3.59Å; G155-F159 WeakPolarHBondContact O-CD2 3.48Å; G155-F159 PolarHBondContact O-N 3.32Å; I156-F159 PolarHBondContact O-N 3.32Å; F157-F159 VanDerWaalsContact C-N 3.34Å; F157-F159 PolarHBondContact O-N 3.27Å; F159-Q161 VanDerWaalsContact C-N 3.32Å; F159-Q161 PolarHBondContact O-N 3.23Å; F159-C162 WeakPolarHBondContact O-CB 3.34Å; F159-C162 PolarHBondContact O-N 3.44Å; F159-C162 VanDerWaalsContact O-N 3.14Å; F159-T163 PolarHBondContact O-N 3.49Å; F159-T163 PolarHBondContact O-OG1 3.23Å
160I83.1Confident73.9Confident66 Ų6660.9 Ų60.934%0.33833%0.327SS..Hα-helixtrans-60.7-41.6176.3-67.3166.8000110.7I156 F157 C162 T163 N164I156-I160 HydrophobicContact CG2-CD1 3.85Å; I156-I160 HydrophobicContact CG2-CG1 4.45Å; I156-I160 WeakPolarHBondContact O-CG1 3.37Å; I156-I160 PolarHBondContact O-N 2.91Å; F157-I160 HydrophobicContact CD1-CD1 4.28Å; F157-I160 PolarHBondContact O-N 3.35Å; I160-C162 VanDerWaalsContact C-N 3.33Å; I160-C162 PolarHBondContact O-N 3.07Å; I160-T163 WeakPolarHBondContact CA-OG1 3.27Å; I160-T163 PolarHBondContact O-N 3.44Å; I160-T163 PolarHBondContact O-OG1 3.46Å; I160-N164 WeakPolarHBondContact CG2-ND2 3.29Å; I160-N164 PolarHBondContact O-N 2.98Å; I160-N164 PolarHBondContact O-ND2 3.28Å
161Q80.3Confident71.2Confident0 Ų067.3 Ų67.30%036%0.355CS..Hα-helixtrans-62.6-39.5174.5-72.1179.7-49.500112.2N6 I9 L10 N13 F157 C158 F159 T163 T165N6-Q161 PolarHBondContact O-NE2 3.25Å; N6-Q161 VanDerWaalsContact O-NE2 3.16Å; N6-Q161 WeakPolarHBondContact OD1-CG 3.28Å; N6-Q161 PolarHBondContact OD1-NE2 3.31Å; I9-Q161 HydrophobicContact CB-CG 3.91Å; I9-Q161 HydrophobicContact CD1-CG 4.1Å; I9-Q161 VanDerWaalsContact CG2-CD 3.5Å; I9-Q161 HydrophobicContact CG2-CG 3.51Å; L10-Q161 VanDerWaalsContact N-NE2 3.19Å; N13-Q161 PolarHBondContact ND2-OE1 2.98Å; F157-Q161 WeakPolarHBondContact O-CG 3.26Å; F157-Q161 PolarHBondContact O-N 2.87Å; C158-Q161 PolarHBondContact O-N 2.81Å; F159-Q161 VanDerWaalsContact C-N 3.32Å; F159-Q161 PolarHBondContact O-N 3.23Å; Q161-T163 VanDerWaalsContact C-N 3.32Å; Q161-T163 PolarHBondContact O-N 3.38Å; Q161-T165 PolarHBondContact O-N 2.65Å; Q161-T165 PolarHBondContact O-OG1 3.18Å
162C76.8Confident68.4Low15 Ų1572.5 Ų72.510%0.10139%0.39CS..Hα-helixtrans-64.9-34.5175.1-169.90000112.6H99 L100 C158 F159 I160 T165H99-C162 HydrophobicContact CB-CB 4.45Å; L100-C162 HydrophobicContact CD2-CB 4.31Å; L100-C162 HydrophobicContact CG-CB 4.5Å; C158-C162 PolarHBondContact O-N 3.48Å; F159-C162 WeakPolarHBondContact O-CB 3.34Å; F159-C162 PolarHBondContact O-N 3.44Å; F159-C162 VanDerWaalsContact O-N 3.14Å; I160-C162 VanDerWaalsContact C-N 3.33Å; I160-C162 PolarHBondContact O-N 3.07Å; C162-T165 PolarHBondContact O-OG1 3.46Å; C162-T165 VanDerWaalsContact O-OG1 3.08Å
163T74.2Confident65.8Low96 Ų9676.3 Ų76.359%0.58941%0.409SS*.Hα-helixtrans-76.4-39.5178.30.80000112.2F159 I160 Q161 T165 C166F159-T163 PolarHBondContact O-N 3.49Å; F159-T163 PolarHBondContact O-OG1 3.23Å; I160-T163 WeakPolarHBondContact CA-OG1 3.27Å; I160-T163 PolarHBondContact O-N 3.44Å; I160-T163 PolarHBondContact O-OG1 3.46Å; Q161-T163 VanDerWaalsContact C-N 3.32Å; Q161-T163 PolarHBondContact O-N 3.38Å; T163-T165 VanDerWaalsContact C-N 3.32Å; T163-T165 PolarHBondContact O-N 3.15Å; T163-C166 WeakPolarHBondContact O-CA 3.26Å; T163-C166 VanDerWaalsContact O-CB 3.3Å; T163-C166 WeakPolarHBondContact O-CB 3.44Å; T163-C166 PolarHBondContact O-N 3.11Å
164N66.9Low63.1Low91 Ų9179.6 Ų79.649%0.48743%0.431SS..Hα-helixtrans-66.9-32.5178.9-74-34000112.8I160 C166 A167I160-N164 WeakPolarHBondContact CG2-ND2 3.29Å; I160-N164 PolarHBondContact O-N 2.98Å; I160-N164 PolarHBondContact O-ND2 3.28Å; N164-C166 PolarHBondContact O-N 3.36Å; N164-A167 PolarHBondContact O-N 3.47Å
165T58.7Low60.3Low62 Ų6288 Ų8838%0.3847%0.47SS..THydrogen-bonded Turntrans-74.8-5.1171.248.50000113.4K96 Q161 C162 T163K96-T165 WeakPolarHBondContact CE-O 3.39Å; K96-T165 PolarHBondContact NZ-O 3.45Å; Q161-T165 PolarHBondContact O-N 2.65Å; Q161-T165 PolarHBondContact O-OG1 3.18Å; C162-T165 PolarHBondContact O-OG1 3.46Å; C162-T165 VanDerWaalsContact O-OG1 3.08Å; T163-T165 VanDerWaalsContact C-N 3.32Å; T163-T165 PolarHBondContact O-N 3.15Å
166C50.1Low57.7Low53 Ų5399.1 Ų99.136%0.35851%0.512SS..THydrogen-bonded Turntrans-92.419.3171.7-80.30000113.9K96 T163 N164 C168 M169K96-C166 PolarHBondContact NZ-SG 3.41Å; T163-C166 WeakPolarHBondContact O-CA 3.26Å; T163-C166 VanDerWaalsContact O-CB 3.3Å; T163-C166 WeakPolarHBondContact O-CB 3.44Å; T163-C166 PolarHBondContact O-N 3.11Å; N164-C166 PolarHBondContact O-N 3.36Å; C166-C168 PolarHBondContact O-N 3.45Å; C166-M169 PolarHBondContact O-N 3.26Å
167A46.3Very low55.4Low60 Ų60104 Ų10450%0.49653%0.533SS..G310 helixtrans-61.19.4171.700000115.3N164 M169 R170N164-A167 PolarHBondContact O-N 3.47Å; A167-M169 PolarHBondContact O-N 3.06Å; A167-R170 PolarHBondContact O-N 3.13Å
168C42.6Very low52.7Low105 Ų105106 Ų10671%0.70956%0.555SS**G310 helixtrans-67-13.4164.2-154.50000112.7C166 R170C166-C168 PolarHBondContact O-N 3.45Å; C168-R170 VanDerWaalsContact C-N 3.33Å
169M41.1Very low50.3Low170 Ų170112.8 Ų112.884%0.83760%0.597SS**G310 helixtrans-82.6-1171.3-75.5-121.3-77.100114.6C166 A167C166-M169 PolarHBondContact O-N 3.26Å; A167-M169 PolarHBondContact O-N 3.06Å
170R38.8Very low48.3Very low163 Ų163112.1 Ų112.162%0.61561%0.614SS**G310 helixtrans-84.1-4.9174.5-84.9-171.3175.3173.4-0.5114.7M1 A167 C168 C172M1-R170 PolarHBondContact SD-NH2 3.43Å; A167-R170 PolarHBondContact O-N 3.13Å; C168-R170 VanDerWaalsContact C-N 3.33Å; R170-C172 VanDerWaalsContact C-N 3.34Å
171F36.7Very low45.7Very low187 Ų187120.2 Ų120.282%0.8264%0.64SS**G310 helixtrans-85-1.4175.9-87.2-79.8000114.5
172C32.3Very low43.9Very low111 Ų111132 Ų13275%0.7569%0.685SS**  trans-108.944.6178.1-64.40000112.8R170R170-C172 VanDerWaalsContact C-N 3.34Å
173I36.3Very low41.9Very low136 Ų136139.1 Ų139.170%0.69772%0.721SS**SBendtrans-102.7110.9158.2-59.1176.7000105.4H175I173-H175 PolarHBondContact O-N 3.43Å; I173-H175 VanDerWaalsContact O-N 3.13Å
174P34.7Very low40Very low115 Ų115140.1 Ų140.175%0.74773%0.732SS**  trans-61123.7173.126-30000106.9R176P174-R176 VanDerWaalsContact C-N 3.34Å; P174-R176 PolarHBondContact O-N 2.8Å
175H33Very low38.8Very low179 Ų179139.3 Ų139.383%0.82975%0.745SS**  trans-56.599.1177.5-157.2-59.4000107.7I173 E177I173-H175 PolarHBondContact O-N 3.43Å; I173-H175 VanDerWaalsContact O-N 3.13Å; H175-E177 PolarHBondContact O-N 2.96Å
176R33.7Very low37.7Very low232 Ų232141.5 Ų141.588%0.87576%0.763SS**  trans-62.8123.7174.3-162.1175.5-178.8176.20.1106.3P174 S178P174-R176 VanDerWaalsContact C-N 3.34Å; P174-R176 PolarHBondContact O-N 2.8Å; R176-S178 PolarHBondContact O-N 2.69Å; R176-S178 VanDerWaalsContact O-N 3.12Å
177E41.1Very low37.2Very low189 Ų189144.4 Ų144.488%0.88378%0.784SS**  trans-48.8116.8171.9-68.3173.8147.100109.2H175H175-E177 PolarHBondContact O-N 2.96Å
178S31.1Very low36.7Very low106 Ų106149.2 Ų149.274%0.74180%0.8SS**  trans-124.9101.6159.278.40000108.1R176R176-S178 PolarHBondContact O-N 2.69Å; R176-S178 VanDerWaalsContact O-N 3.12Å
179T35.3Very low36.6Very low145 Ų145152.5 Ų152.589%0.8980%0.804SS**  trans-27.9133.2163.7-28.40000114.3
180G41Very low36.4Very low73 Ų73150.7 Ų150.775%0.75380%0.803SS**  trans9882.7141.100000118.3
181R29.8Very low36.3Very low236 Ų236150.2 Ų150.289%0.89181%0.811SS**  trans-150.4104.5137.5-145.4169177.5178.9-2111L183R181-L183 PolarHBondContact O-N 3.33Å
182R40.6Very low36.6Very low249 Ų249146.1 Ų146.194%0.9481%0.805SS**  trans-54.5125.8168.8-80.6-179.4172.8-177.3-2.2109.4
183L35.2Very low37Very low163 Ų163148.8 Ų148.885%0.85381%0.811SS**  trans-133.4109.1158.1-90.5159.1000109R181R181-L183 PolarHBondContact O-N 3.33Å
184S35.7Very low37.2Very low117 Ų117148.3 Ų148.382%0.81882%0.817SS**  trans5.6126.2160.2-1530000119
185G41.3Very low37.3Very low74 Ų74151.8 Ų151.876%0.76382%0.823SS**  trans-78150.9171.400000113.9
186S34.7Very low37.5Very low109 Ų109153.7 Ų153.776%0.76282%0.823SS**  trans-157103.7148.958.90000109.9
187S39.9Very low37.6Very low113 Ų113148.1 Ų148.179%0.7982%0.815SS**  trans15.9109.9153.2600000120
188I35.9Very low37.4Very low161 Ų161146.2 Ų146.283%0.82682%0.817SS**  trans-96.1111.3150.3-63.7172.8000106.5V190I188-V190 PolarHBondContact O-N 3.45Å
189Q39.7Very low38.1Very low174 Ų174150.6 Ų150.681%0.81382%0.822SS**  trans-77.7113.3169.5-89.8-179.9-13.700109.1
190V36.5Very low38.2Very low132 Ų132150 Ų15080%0.882%0.821SS**  trans-83108166.9178.30000107I188 S192I188-V190 PolarHBondContact O-N 3.45Å; V190-S192 PolarHBondContact O-N 3.22Å
191I37.3Very low38.1Very low153 Ų153157.9 Ų157.979%0.78583%0.828SS**  trans-81.1115.1171.2-62.3168.5000107.1
192S42.4Very low38.5Very low101 Ų101151.8 Ų151.871%0.70682%0.821SS**PPolyproline II helixtrans-70143.5174.742.40000111.7V190V190-S192 PolarHBondContact O-N 3.22Å
193L40.8Very low38.5Very low167 Ų167146.5 Ų146.587%0.87481%0.81SS**PPolyproline II helixtrans-65.4140.7171.2-91.184.6000110.9
194P41.8Very low38.5Very low127 Ų127144.5 Ų144.583%0.82581%0.805SS**PPolyproline II helixtrans-83.1154.6164.922.4-11.8000112.6
195E36.6Very low38.5Very low187 Ų187146.9 Ų146.987%0.87480%0.803SS**PPolyproline II helixtrans-86139.6-167.9-161171.5-174.400113.4
196R36.6Very low38.2Very low219 Ų219149.5 Ų149.583%0.82680%0.803SS**  trans19134.9161.5-93.1-173.9166.5170.5-3.2123.3
197T36.8Very low38Very low115 Ų115152.6 Ų152.671%0.70681%0.806SS**  trans80.2116.1134.952.80000121.3
198T36.6Very low37.7Very low150 Ų150153 Ų15392%0.9281%0.808SS**  -167139.4123.8190000110.8
199K45.5Very low37.7Very low197 Ų197151.2 Ų151.286%0.85780%0.804SS**PPolyproline II helixtrans-61.4152.1-174.7-72.9174.9174178.20113.4
200P38.2Very low37.9Very low132 Ų132148.2 Ų148.286%0.85780%0.8SS**PPolyproline II helixtrans-75.1129.7174.830.5-31.2000111.1
201R37.6Very low37.6Very low240 Ų240147.3 Ų147.391%0.90680%0.8SS**PPolyproline II helixtrans-86.2128.4166.4-80-175175.2178.6-0.9109.5
202S38.3Very low37.4Very low107 Ų107148.9 Ų148.975%0.74880%0.801SS**PPolyproline II helixtrans-48.8133.3168.3164.50000112.1
203I41.1Very low37.1Very low138 Ų138151.3 Ų151.371%0.70881%0.806SS**  trans-102.8101.8172.7-61.9172.2000107.6H205I203-H205 WeakPolarHBondContact CG2-CD2 3.43Å
204V34.9Very low36.6Very low122 Ų122147 Ų14774%0.73980%0.802SS**  trans-87.8113161.21750000106.7
205H35.8Very low36.1Very low167 Ų167150.4 Ų150.477%0.77381%0.807SS**  trans-98.9112.7169.6-95.8-62.4000109.9I203I203-H205 WeakPolarHBondContact CG2-CD2 3.43Å
206V36Very low36.1Very low128 Ų128147.3 Ų147.378%0.77680%0.801SS**  trans-77.6136.8165.9173.80000109
207H29.9Very low36Very low175 Ų175144.9 Ų144.981%0.8180%0.804SS**  trans-68.4139.5180-79.2-48.8000113.9
208S34.6Very low36.2Very low120 Ų120147.4 Ų147.484%0.83981%0.805SS**  trans-151.1134.6135.553.50000110.5
209V34.8Very low36.5Very low124 Ų124145.8 Ų145.875%0.75280%0.8SS**  trans-129.7157.7178.6166.80000103.5
210P43.6Very low36.3Very low111 Ų111144.5 Ų144.572%0.72180%0.797SS**  cis-13616913.116.910.2000115.7
211S30.6Very low36.6Very low113 Ų113145 Ų14579%0.7980%0.797SS**  177.6135.7112.958.20000113.8
212K32.4Very low36.8Very low186 Ų186141.9 Ų141.981%0.80979%0.793SS**  trans65.297.2158.9-83.5-176.7164.2178.30121.1
213D36Very low37.1Very low152 Ų152141.6 Ų141.681%0.81380%0.796SS**  61.8112.8125.6-54.2-23.5000120.4
214G31.6Very low37.1Very low77 Ų77145.4 Ų145.479%0.79480%0.802SS**  116.983125.400000119.2
215Q31.9Very low37.5Very low199 Ų199151 Ų15193%0.9381%0.81SS**  trans84.1110.2141.8-144.1166.810.200119.8
216V36.2Very low38.5Very low122 Ų122147.5 Ų147.574%0.73980%0.8SS**  trans-81.5126.8-178.9172.70000111.5K218V216-K218 HydrophobicContact CG1-CG 4.17Å; V216-K218 PolarHBondContact O-N 3.28Å
217N34.6Very low39.3Very low168 Ų168147.5 Ų147.590%0.89880%0.801SS**  trans-80.3103.3171.2-142.6-1.3000109.3
218K40.4Very low40.6Very low167 Ų167150.7 Ų150.773%0.72681%0.806SS**  trans-95.6114.7174.1-78.5-179.2177.3175.60109.8V216V216-K218 HydrophobicContact CG1-CG 4.17Å; V216-K218 PolarHBondContact O-N 3.28Å
219S41.8Very low41.1Very low116 Ų116149.3 Ų149.381%0.81180%0.802SS**  trans-92.1105.5163.657.50000110.1
220H41.7Very low41.2Very low171 Ų171155.5 Ų155.579%0.79283%0.829SS**  trans-69.3116.8169.4-87.4-94.4000110.5
221V45.2Very low41.1Very low143 Ų143157.7 Ų157.787%0.86783%0.834SS**  trans-95.5113.2160.8179.30000107.8
222Q41.7Very low41.6Very low174 Ų174160.1 Ų160.181%0.81384%0.837SS**  trans-85111.1-170.3-168.9175.12.700110.8
223A43.5Very low42.2Very low100 Ų100158.6 Ų158.683%0.82684%0.838SS**  trans-86.2113.9167.500000109.5
224R41.8Very low42.5Very low219 Ų219159 Ų15983%0.82684%0.84SS**  trans-98.4102178-160.6-179.3-160.6-177.15.5110V226R224-V226 HydrophobicContact CG-CG2 4.14Å
225R44.1Very low43.2Very low239 Ų239164.1 Ų164.190%0.90284%0.843SS**  trans-89130.9159.4-75.8-173.3-158.7-164.45.6108.3
226V56.5Low44Very low94 Ų94161.8 Ų161.857%0.5784%0.837SS**  trans-117.1112.2170.1-175.10000107.1R224 W228R224-V226 HydrophobicContact CG-CG2 4.14Å; V226-W228 HydrophobicContact CG1-CZ2 4.44Å
227T53.6Low44.5Very low128 Ų128164.6 Ų164.679%0.78584%0.844SS**  trans-93.1129.2168.4430000108.2
228W56.6Low45.3Very low241 Ų241164.4 Ų164.491%0.91384%0.84SS**  trans-103.4119.5162.9-66100.3000108V226V226-W228 HydrophobicContact CG1-CZ2 4.44Å
229A45.3Very low45.7Very low92 Ų92164.2 Ų164.276%0.7685%0.849SS**  trans-136.8116.5165.500000107.4
230L36.4Very low46Very low253 Ų253168.5 Ų168.5100%1.32585%0.853SS**  -156.60127.7-135.2105.8000108.5

Retrieved 230 of 230 residues in 223.5 ms (Link to these results)

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