A0A077ZDP7_TRITR Loading...

Glycos transf 4 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZDP7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 257 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
1M58.7Low78.7Confident196 Ų19680.9 Ų80.997%0.96642%0.423SS*.  0-53.40-75.9-179.3156.100112.6V3 F4 G5M1-V3 PolarHBondContact O-N 3.01Å; M1-F4 PolarHBondContact O-N 3.34Å; M1-F4 VanDerWaalsContact O-N 3.08Å; M1-G5 PolarHBondContact O-N 2.98Å
2M69.3Low79.8Confident44 Ų4478 Ų7822%0.21741%0.407CS..Hα-helixtrans-53.9-45.4-179-54.1-167.878.700114.3F4 G5 K6 L7 T31 L32 L122M2-F4 PolarHBondContact O-N 3.16Å; M2-G5 PolarHBondContact O-N 3.22Å; M2-K6 WeakPolarHBondContact O-CA 3.48Å; M2-K6 PolarHBondContact O-N 3.26Å; M2-L7 WeakPolarHBondContact CE-O 3.43Å; M2-L7 PolarHBondContact O-N 3.04Å; M2-L7 VanDerWaalsContact O-N 3.13Å; M2-T31 HydrophobicContact CE-CG2 3.2Å; M2-T31 HydrophobicContact SD-CG2 4.45Å; M2-L32 HydrophobicContact SD-CD2 4.28Å; M2-L122 HydrophobicContact CE-CD1 4.3Å
3V68.6Low80.8Confident95 Ų9572 Ų7258%0.57638%0.376SS*.Hα-helixtrans-61.4-44.6176.41780000111.6M1 K6 Y28M1-V3 PolarHBondContact O-N 3.01Å; V3-K6 PolarHBondContact O-N 2.99Å; V3-Y28 HydrophobicContact CG2-CD1 4.45Å; V3-Y28 HydrophobicContact CG2-CE1 3.97Å
4F71.5Confident81.7Confident190 Ų19073.8 Ų73.883%0.83338%0.376SS*.Hα-helixtrans-70-39.5180-72-74.9000112.7M1 M2 K6M1-F4 PolarHBondContact O-N 3.34Å; M1-F4 VanDerWaalsContact O-N 3.08Å; M2-F4 PolarHBondContact O-N 3.16Å; F4-K6 VanDerWaalsContact C-N 3.26Å; F4-K6 PolarHBondContact O-N 3.12Å
5G70.4Confident82.5Confident58 Ų5870.7 Ų70.760%0.59836%0.361SS*.Hα-helixtrans-80.1-4.1176.700000114M1 M2 L7M1-G5 PolarHBondContact O-N 2.98Å; M2-G5 PolarHBondContact O-N 3.22Å; G5-L7 PolarHBondContact O-N 3.48Å
6K77.4Confident83.1Confident168 Ų16874.7 Ų74.773%0.7338%0.375SS*.THydrogen-bonded Turntrans48.928.4-171.7-60.7-178.9180177.20113.3M2 V3 F4 Y8M2-K6 WeakPolarHBondContact O-CA 3.48Å; M2-K6 PolarHBondContact O-N 3.26Å; V3-K6 PolarHBondContact O-N 2.99Å; F4-K6 VanDerWaalsContact C-N 3.26Å; F4-K6 PolarHBondContact O-N 3.12Å; K6-Y8 PolarHBondContact O-N 3.08Å
7L83.7Confident83.5Confident26 Ų2672.2 Ų72.214%0.13637%0.373CS..  trans-96.691.6-176.9-165.9129.4000108.3M2 G5 W119 L122 E123M2-L7 WeakPolarHBondContact CE-O 3.43Å; M2-L7 PolarHBondContact O-N 3.04Å; M2-L7 VanDerWaalsContact O-N 3.13Å; G5-L7 PolarHBondContact O-N 3.48Å; L7-W119 HydrophobicContact CD1-CH2 4.49Å; L7-W119 HydrophobicContact CD1-CZ2 4.3Å; L7-W119 HydrophobicContact CD2-CE3 4.1Å; L7-W119 HydrophobicContact CD2-CH2 4.07Å; L7-W119 HydrophobicContact CD2-CZ2 4.46Å; L7-W119 HydrophobicContact CD2-CZ3 3.87Å; L7-L122 HydrophobicContact CD2-CB 3.76Å; L7-L122 HydrophobicContact CD2-CD1 4.34Å; L7-L122 HydrophobicContact CG-CB 4.47Å; L7-E123 HydrophobicContact CD1-CB 3.89Å; L7-E123 HydrophobicContact CD1-CG 4.08Å
8Y89.9Confident83.7Confident54 Ų5473.9 Ų73.921%0.21239%0.392CS..SBendtrans-148.6158.4176.670.9-79.9000109.3K6 S10 Y28 T31K6-Y8 PolarHBondContact O-N 3.08Å; Y8-S10 VanDerWaalsContact C-N 3.31Å; Y8-S10 PolarHBondContact O-N 3.21Å; Y8-Y28 AromaticContact CD1-CE1 3.86Å; Y8-Y28 HydrophobicContact CD1-CE1 3.86Å; Y8-Y28 AromaticContact CD1-CZ 3.98Å; Y8-Y28 HydrophobicContact CE1-CE1 4.46Å; Y8-Y28 HydrophobicContact CG-CD1 4.15Å; Y8-Y28 AromaticContact CG-CE1 3.9Å; Y8-Y28 HydrophobicContact CG-CE1 3.9Å; Y8-T31 WeakPolarHBondContact CA-OG1 3.17Å
9L91.2Very high84.1Confident18 Ų1880.9 Ų80.99%0.09441%0.413CS..  trans-63.291.3170.9-68.4175.5000109.2L23 G27 L30 T31 A34 L122 Q126L9-L23 HydrophobicContact CB-CD1 4.1Å; L9-L23 WeakPolarHBondContact O-CD1 3.33Å; L9-G27 WeakPolarHBondContact O-CA 3.24Å; L9-L30 HydrophobicContact CD1-CD2 4.21Å; L9-L30 HydrophobicContact CD1-CG 4.04Å; L9-T31 WeakPolarHBondContact CB-OG1 3.42Å; L9-T31 HydrophobicContact CG-CG2 4.35Å; L9-T31 PolarHBondContact N-OG1 3.35Å; L9-A34 HydrophobicContact CD1-CB 3.86Å; L9-L122 HydrophobicContact CD1-CD2 4.3Å; L9-L122 HydrophobicContact CD2-CD2 3.46Å; L9-L122 VanDerWaalsContact CD2-CD2 3.46Å; L9-L122 HydrophobicContact CG-CD2 3.56Å; L9-Q126 HydrophobicContact CD2-CG 4.44Å
10S91.3Very high84.5Confident37 Ų3781.3 Ų81.326%0.25941%0.413SS..  trans-81.7-29.9175.565.80000111.5Y8 V22 L23 Q126Y8-S10 VanDerWaalsContact C-N 3.31Å; Y8-S10 PolarHBondContact O-N 3.21Å; S10-V22 WeakPolarHBondContact O-CA 3.2Å; S10-L23 PolarHBondContact O-N 2.93Å; S10-Q126 PolarHBondContact OG-OE1 3.49Å; S10-Q126 VanDerWaalsContact OG-OE1 3.06Å
11S93.2Very high84.9Confident4 Ų480.6 Ų80.63%0.02841%0.409CS..BIsolated β-bridgetrans-141.8144.5-177.9-177.30000111G13 E20 M21 Q126S11-G13 VanDerWaalsContact C-N 3.31Å; S11-G13 PolarHBondContact OG-N 3Å; S11-E20 WeakPolarHBondContact CB-OE1 3.49Å; S11-E20 WeakPolarHBondContact OG-CG 3.45Å; S11-E20 PolarHBondContact OG-OE1 3.39Å; S11-M21 WeakPolarHBondContact CA-O 3.38Å; S11-Q126 PolarHBondContact O-NE2 3.26Å
12L92.9Very high86.6Confident46 Ų4676 Ų7624%0.24139%0.392CS..  trans-92.45.5167.2-63.9-178.6000112.5I15 M21 L23 L30L12-I15 HydrophobicContact CB-CD1 3.99Å; L12-I15 HydrophobicContact CB-CG1 4.48Å; L12-I15 HydrophobicContact CD1-CD1 4.14Å; L12-I15 WeakPolarHBondContact O-CG2 3.34Å; L12-M21 HydrophobicContact CB-CB 4.3Å; L12-M21 HydrophobicContact CB-CG 4.42Å; L12-M21 HydrophobicContact CD1-CG 4.45Å; L12-M21 HydrophobicContact CD1-SD 3.96Å; L12-M21 PolarHBondContact N-O 2.94Å; L12-L23 HydrophobicContact CD1-CD1 4.47Å; L12-L23 HydrophobicContact CD1-CD2 4.04Å; L12-L23 HydrophobicContact CD2-CD1 4Å; L12-L23 HydrophobicContact CG-CD1 3.87Å; L12-L23 HydrophobicContact CG-CD2 4.09Å; L12-L23 HydrophobicContact CG-CG 4.18Å; L12-L30 HydrophobicContact CD1-CD2 4.25Å; L12-L30 HydrophobicContact CD2-CD2 3.8Å; L12-L30 HydrophobicContact CG-CD2 4.39Å
13G92.9Very high87.7Confident0 Ų075.2 Ų75.20%039%0.388CS..  trans77.8-159.8-175.900000112.7S11 I15 M21 E210S11-G13 VanDerWaalsContact C-N 3.31Å; S11-G13 PolarHBondContact OG-N 3Å; G13-I15 VanDerWaalsContact C-N 3.28Å; G13-I15 PolarHBondContact O-N 2.97Å; G13-I15 VanDerWaalsContact O-N 3.12Å; G13-M21 PolarHBondContact O-N 3.01Å; G13-E210 VanDerWaalsContact CA-OE2 3.28Å; G13-E210 WeakPolarHBondContact CA-OE2 3.34Å
14Y93.5Very high88.7Confident97 Ų9772 Ų7238%0.3837%0.374SS..SBendtrans-9154.8-171.8-65.3-88.8000111.9F16 S18 E20 E210 W211Y14-F16 VanDerWaalsContact C-N 3.31Å; Y14-F16 PolarHBondContact O-N 3.32Å; Y14-S18 WeakPolarHBondContact CD1-O 3.32Å; Y14-S18 WeakPolarHBondContact CE1-O 3.41Å; Y14-E20 HydrophobicContact CD1-CB 4.11Å; Y14-E20 HydrophobicContact CE1-CB 3.72Å; Y14-E210 WeakPolarHBondContact CD2-OE1 3.34Å; Y14-E210 PolarHBondContact N-OE2 3.26Å; Y14-W211 PolarHBondContact O-N 3.15Å
15I92.7Very high89.5Confident27 Ų2768.3 Ų68.314%0.13837%0.369CS..  trans-77.2-14.7-175.460.2167.2000114L12 G13 M21 V135 W211 L214L12-I15 HydrophobicContact CB-CD1 3.99Å; L12-I15 HydrophobicContact CB-CG1 4.48Å; L12-I15 HydrophobicContact CD1-CD1 4.14Å; L12-I15 WeakPolarHBondContact O-CG2 3.34Å; G13-I15 VanDerWaalsContact C-N 3.28Å; G13-I15 PolarHBondContact O-N 2.97Å; G13-I15 VanDerWaalsContact O-N 3.12Å; I15-M21 HydrophobicContact CD1-CB 4.37Å; I15-M21 HydrophobicContact CD1-SD 3.73Å; I15-M21 HydrophobicContact CG1-CB 4.08Å; I15-M21 HydrophobicContact CG1-SD 4.34Å; I15-V135 HydrophobicContact CG2-CG2 3.55Å; I15-W211 VanDerWaalsContact O-CB 3.29Å; I15-W211 WeakPolarHBondContact O-CB 3.26Å; I15-L214 HydrophobicContact CB-CD2 3.72Å; I15-L214 HydrophobicContact CG2-CD2 3.8Å
16F92.3Very high90.5Very high135 Ų13571.2 Ų71.259%0.59237%0.365SS*.BIsolated β-bridgetrans-118.464.9176.4-68.6-73.2000111.2Y14 S18 W19 M21Y14-F16 VanDerWaalsContact C-N 3.31Å; Y14-F16 PolarHBondContact O-N 3.32Å; F16-S18 PolarHBondContact O-N 3.39Å; F16-W19 PolarHBondContact O-N 3.46Å; F16-M21 HydrophobicContact CD2-CE 3.59Å; F16-M21 HydrophobicContact CD2-SD 4.26Å; F16-M21 HydrophobicContact CE2-CE 3.28Å; F16-M21 HydrophobicContact CE2-SD 3.85Å; F16-M21 HydrophobicContact CZ-CE 4.38Å
17G90.1Very high91.3Very high33 Ų3363.2 Ų63.234%0.3433%0.33SS..THydrogen-bonded Turntrans73-125.1179.800000111.5
18S87.9Confident91.7Very high103 Ų10365.8 Ų65.872%0.7234%0.339SS*.THydrogen-bonded Turntrans-89.50.7178.254.90000113.9Y14 F16Y14-S18 WeakPolarHBondContact CD1-O 3.32Å; Y14-S18 WeakPolarHBondContact CE1-O 3.41Å; F16-S18 PolarHBondContact O-N 3.39Å
19W91.4Very high91.9Very high206 Ų20669.4 Ų69.478%0.7836%0.356SS*.BIsolated β-bridgetrans-90.3119.6-180-76.756.1000110.6F16 M21F16-W19 PolarHBondContact O-N 3.46Å; W19-M21 PolarHBondContact O-N 3.49Å
20E91.1Very high92Very high88 Ų8870.4 Ų70.441%0.41136%0.361SS..  trans-71.2124.7171.8-170.6-177.8-18000110S11 Y14 V22S11-E20 WeakPolarHBondContact CB-OE1 3.49Å; S11-E20 WeakPolarHBondContact OG-CG 3.45Å; S11-E20 PolarHBondContact OG-OE1 3.39Å; Y14-E20 HydrophobicContact CD1-CB 4.11Å; Y14-E20 HydrophobicContact CE1-CB 3.72Å; E20-V22 HydrophobicContact CG-CG2 4.2Å; E20-V22 PolarHBondContact O-N 3.28Å; E20-V22 VanDerWaalsContact O-N 3.17Å
21M93.8Very high92.2Very high67 Ų6768.6 Ų68.633%0.3335%0.349SS..  trans-85.888.8177.4179.1163.7-90.700111.1S11 L12 G13 I15 F16 W19 L23S11-M21 WeakPolarHBondContact CA-O 3.38Å; L12-M21 HydrophobicContact CB-CB 4.3Å; L12-M21 HydrophobicContact CB-CG 4.42Å; L12-M21 HydrophobicContact CD1-CG 4.45Å; L12-M21 HydrophobicContact CD1-SD 3.96Å; L12-M21 PolarHBondContact N-O 2.94Å; G13-M21 PolarHBondContact O-N 3.01Å; I15-M21 HydrophobicContact CD1-CB 4.37Å; I15-M21 HydrophobicContact CD1-SD 3.73Å; I15-M21 HydrophobicContact CG1-CB 4.08Å; I15-M21 HydrophobicContact CG1-SD 4.34Å; F16-M21 HydrophobicContact CD2-CE 3.59Å; F16-M21 HydrophobicContact CD2-SD 4.26Å; F16-M21 HydrophobicContact CE2-CE 3.28Å; F16-M21 HydrophobicContact CE2-SD 3.85Å; F16-M21 HydrophobicContact CZ-CE 4.38Å; W19-M21 PolarHBondContact O-N 3.49Å; M21-L23 HydrophobicContact CG-CD2 4.37Å
22V93.7Very high92.2Very high100 Ų10073.7 Ų73.761%0.60638%0.375SS*.BIsolated β-bridgetrans-80.4127.7174.2-176.60000110.6S10 E20S10-V22 WeakPolarHBondContact O-CA 3.2Å; E20-V22 HydrophobicContact CG-CG2 4.2Å; E20-V22 PolarHBondContact O-N 3.28Å; E20-V22 VanDerWaalsContact O-N 3.17Å
23L92.1Very high92.3Very high28 Ų2876.6 Ų76.615%0.14739%0.386CS..  trans-92-20.8-173.6-63.2174.6000114.1L9 S10 L12 M21 F26 L30L9-L23 HydrophobicContact CB-CD1 4.1Å; L9-L23 WeakPolarHBondContact O-CD1 3.33Å; S10-L23 PolarHBondContact O-N 2.93Å; L12-L23 HydrophobicContact CD1-CD1 4.47Å; L12-L23 HydrophobicContact CD1-CD2 4.04Å; L12-L23 HydrophobicContact CD2-CD1 4Å; L12-L23 HydrophobicContact CG-CD1 3.87Å; L12-L23 HydrophobicContact CG-CD2 4.09Å; L12-L23 HydrophobicContact CG-CG 4.18Å; M21-L23 HydrophobicContact CG-CD2 4.37Å; L23-F26 WeakPolarHBondContact O-CB 3.33Å; L23-F26 PolarHBondContact O-N 2.86Å; L23-L30 HydrophobicContact CD1-CB 4.48Å; L23-L30 HydrophobicContact CD1-CD2 3.44Å; L23-L30 VanDerWaalsContact CD1-CD2 3.44Å; L23-L30 HydrophobicContact CD2-CD2 4.43Å
24G89.8Confident92.5Very high26 Ų2677.7 Ų77.727%0.26840%0.395SS..THydrogen-bonded Turntrans55.6-141.5-174.700000112.4F26 G27G24-F26 PolarHBondContact O-N 3.41Å; G24-G27 PolarHBondContact O-N 3.49Å
25P88.5Confident92.6Very high113 Ų11374.3 Ų74.373%0.73438%0.384SS*.THydrogen-bonded Turntrans-61.1-25.3-178.9-23.934.3000114.7G27 Y28P25-G27 PolarHBondContact O-N 3.16Å; P25-Y28 WeakPolarHBondContact O-CD2 3.5Å; P25-Y28 PolarHBondContact O-N 3.16Å
26F91.9Very high92.7Very high119 Ų11977.3 Ų77.352%0.52239%0.394SS..Hα-helixtrans-63.8-22.1175.2-174.1-107.3000112.1L23 G24 Y28 F29 L30L23-F26 WeakPolarHBondContact O-CB 3.33Å; L23-F26 PolarHBondContact O-N 2.86Å; G24-F26 PolarHBondContact O-N 3.41Å; F26-Y28 PolarHBondContact O-N 2.69Å; F26-F29 HydrophobicContact CD2-CB 4.39Å; F26-F29 HydrophobicContact CD2-CD1 4.47Å; F26-F29 HydrophobicContact CE2-CB 4.35Å; F26-F29 AromaticContact CE2-CD1 3.64Å; F26-F29 HydrophobicContact CE2-CD1 3.64Å; F26-F29 HydrophobicContact CE2-CE1 4.34Å; F26-F29 HydrophobicContact CE2-CG 4.24Å; F26-F29 AromaticContact CZ-CD1 3.73Å; F26-F29 HydrophobicContact CZ-CD1 3.73Å; F26-F29 HydrophobicContact CZ-CE1 4.26Å; F26-F29 PolarHBondContact O-N 3.49Å; F26-F29 VanDerWaalsContact O-N 3.09Å; F26-L30 HydrophobicContact CE1-CB 4.47Å; F26-L30 PolarHBondContact O-N 3.1Å; F26-L30 VanDerWaalsContact O-N 3.12Å
27G92.9Very high92.9Very high0 Ų071.2 Ų71.20%037%0.369CS..Hα-helixtrans-52-36.1173.800000114L9 G24 P25 F29 L30 T31L9-G27 WeakPolarHBondContact O-CA 3.24Å; G24-G27 PolarHBondContact O-N 3.49Å; P25-G27 PolarHBondContact O-N 3.16Å; G27-F29 PolarHBondContact O-N 2.69Å; G27-L30 PolarHBondContact O-N 3.34Å; G27-T31 WeakPolarHBondContact O-CB 3.22Å; G27-T31 PolarHBondContact O-N 2.7Å; G27-T31 PolarHBondContact O-OG1 3.38Å
28Y92.2Very high93.2Very high81 Ų8169.8 Ų69.832%0.31835%0.353SS..Hα-helixtrans-62.2-46.1176.8-69.1-71.9000112.4V3 Y8 P25 F26 T31 L32V3-Y28 HydrophobicContact CG2-CD1 4.45Å; V3-Y28 HydrophobicContact CG2-CE1 3.97Å; Y8-Y28 AromaticContact CD1-CE1 3.86Å; Y8-Y28 HydrophobicContact CD1-CE1 3.86Å; Y8-Y28 AromaticContact CD1-CZ 3.98Å; Y8-Y28 HydrophobicContact CE1-CE1 4.46Å; Y8-Y28 HydrophobicContact CG-CD1 4.15Å; Y8-Y28 AromaticContact CG-CE1 3.9Å; Y8-Y28 HydrophobicContact CG-CE1 3.9Å; P25-Y28 WeakPolarHBondContact O-CD2 3.5Å; P25-Y28 PolarHBondContact O-N 3.16Å; F26-Y28 PolarHBondContact O-N 2.69Å; Y28-T31 PolarHBondContact O-N 2.92Å; Y28-L32 WeakPolarHBondContact O-CG 3.45Å; Y28-L32 PolarHBondContact O-N 2.93Å
29F93.5Very high93.6Very high129 Ų12966.4 Ų66.457%0.56633%0.327SS*.Hα-helixtrans-62.8-47.8178.4175.7-95.4000110.7F26 G27 T31 L32 F33F26-F29 HydrophobicContact CD2-CB 4.39Å; F26-F29 HydrophobicContact CD2-CD1 4.47Å; F26-F29 HydrophobicContact CE2-CB 4.35Å; F26-F29 AromaticContact CE2-CD1 3.64Å; F26-F29 HydrophobicContact CE2-CD1 3.64Å; F26-F29 HydrophobicContact CE2-CE1 4.34Å; F26-F29 HydrophobicContact CE2-CG 4.24Å; F26-F29 AromaticContact CZ-CD1 3.73Å; F26-F29 HydrophobicContact CZ-CD1 3.73Å; F26-F29 HydrophobicContact CZ-CE1 4.26Å; F26-F29 PolarHBondContact O-N 3.49Å; F26-F29 VanDerWaalsContact O-N 3.09Å; G27-F29 PolarHBondContact O-N 2.69Å; F29-T31 PolarHBondContact O-N 3.38Å; F29-L32 PolarHBondContact O-N 3.21Å; F29-F33 PolarHBondContact O-N 3.21Å
30L94.3Very high93.8Very high39 Ų3958.3 Ų58.320%0.20430%0.299CS..Hα-helixtrans-63.6-34.2179.3-16965.3000111.9L9 L12 L23 F26 G27 F33 A34L9-L30 HydrophobicContact CD1-CD2 4.21Å; L9-L30 HydrophobicContact CD1-CG 4.04Å; L12-L30 HydrophobicContact CD1-CD2 4.25Å; L12-L30 HydrophobicContact CD2-CD2 3.8Å; L12-L30 HydrophobicContact CG-CD2 4.39Å; L23-L30 HydrophobicContact CD1-CB 4.48Å; L23-L30 HydrophobicContact CD1-CD2 3.44Å; L23-L30 VanDerWaalsContact CD1-CD2 3.44Å; L23-L30 HydrophobicContact CD2-CD2 4.43Å; F26-L30 HydrophobicContact CE1-CB 4.47Å; F26-L30 PolarHBondContact O-N 3.1Å; F26-L30 VanDerWaalsContact O-N 3.12Å; G27-L30 PolarHBondContact O-N 3.34Å; L30-F33 HydrophobicContact CD1-CD1 4.46Å; L30-F33 WeakPolarHBondContact O-CB 3.45Å; L30-F33 PolarHBondContact O-N 3.13Å; L30-A34 WeakPolarHBondContact O-CB 3.36Å; L30-A34 PolarHBondContact O-N 3.35Å
31T95Very high94Very high0 Ų054.1 Ų54.10%028%0.279CS..Hα-helixtrans-66.2-45.1176.7-48.30000111.8M2 Y8 L9 G27 Y28 F29 F33 A34 V35 L122M2-T31 HydrophobicContact CE-CG2 3.2Å; M2-T31 HydrophobicContact SD-CG2 4.45Å; Y8-T31 WeakPolarHBondContact CA-OG1 3.17Å; L9-T31 WeakPolarHBondContact CB-OG1 3.42Å; L9-T31 HydrophobicContact CG-CG2 4.35Å; L9-T31 PolarHBondContact N-OG1 3.35Å; G27-T31 WeakPolarHBondContact O-CB 3.22Å; G27-T31 PolarHBondContact O-N 2.7Å; G27-T31 PolarHBondContact O-OG1 3.38Å; Y28-T31 PolarHBondContact O-N 2.92Å; F29-T31 PolarHBondContact O-N 3.38Å; T31-F33 PolarHBondContact O-N 3.4Å; T31-A34 PolarHBondContact O-N 3.21Å; T31-A34 VanDerWaalsContact O-N 3.15Å; T31-V35 HydrophobicContact CG2-CG2 4.37Å; T31-V35 WeakPolarHBondContact O-CG2 3.41Å; T31-V35 PolarHBondContact O-N 3.26Å; T31-L122 HydrophobicContact CG2-CD1 3.55Å; T31-L122 HydrophobicContact CG2-CD2 3.74Å; T31-L122 HydrophobicContact CG2-CG 4.31Å
32L94.3Very high94.2Very high111 Ų11151 Ų5158%0.58126%0.264SS*.Hα-helixtrans-58.7-41.9174.9-68.8175.8000111.1M2 Y28 F29 W36M2-L32 HydrophobicContact SD-CD2 4.28Å; Y28-L32 WeakPolarHBondContact O-CG 3.45Å; Y28-L32 PolarHBondContact O-N 2.93Å; F29-L32 PolarHBondContact O-N 3.21Å; L32-W36 VanDerWaalsContact O-CB 3.27Å; L32-W36 WeakPolarHBondContact O-CB 3.44Å; L32-W36 PolarHBondContact O-N 3.42Å
33F94.7Very high94.2Very high107 Ų10748.3 Ų48.347%0.46925%0.246SC..Hα-helixtrans-62.4-44.7174.7-177.9-96.7000112F29 L30 T31 W36 A37F29-F33 PolarHBondContact O-N 3.21Å; L30-F33 HydrophobicContact CD1-CD1 4.46Å; L30-F33 WeakPolarHBondContact O-CB 3.45Å; L30-F33 PolarHBondContact O-N 3.13Å; T31-F33 PolarHBondContact O-N 3.4Å; F33-W36 AromaticContact CD2-CE3 3.97Å; F33-W36 HydrophobicContact CD2-CE3 3.97Å; F33-W36 HydrophobicContact CD2-CZ3 4.06Å; F33-W36 AromaticContact CE2-CE3 3.93Å; F33-W36 HydrophobicContact CE2-CE3 3.93Å; F33-W36 AromaticContact CE2-CZ3 3.54Å; F33-W36 HydrophobicContact CE2-CZ3 3.54Å; F33-W36 HydrophobicContact CZ-CZ3 4.11Å; F33-W36 PolarHBondContact O-N 3.06Å; F33-A37 WeakPolarHBondContact O-CB 3.44Å; F33-A37 PolarHBondContact O-N 3.41Å
34A96.2Very high94.1Very high23 Ų2348.4 Ų48.419%0.1925%0.246CC..Hα-helixtrans-64.5-43.6179.100000112.4L9 L30 T31 A37 A38L9-A34 HydrophobicContact CD1-CB 3.86Å; L30-A34 WeakPolarHBondContact O-CB 3.36Å; L30-A34 PolarHBondContact O-N 3.35Å; T31-A34 PolarHBondContact O-N 3.21Å; T31-A34 VanDerWaalsContact O-N 3.15Å; A34-A37 PolarHBondContact O-N 2.94Å; A34-A38 WeakPolarHBondContact O-CB 3.44Å; A34-A38 PolarHBondContact O-N 3.42Å
35V96.1Very high94.2Very high25 Ų2547.2 Ų47.215%0.15223%0.234CC..Hα-helixtrans-60.8-50.4175.1172.30000110.4T31 A37 A38 I39 F115 I118 L122T31-V35 HydrophobicContact CG2-CG2 4.37Å; T31-V35 WeakPolarHBondContact O-CG2 3.41Å; T31-V35 PolarHBondContact O-N 3.26Å; V35-A37 VanDerWaalsContact C-N 3.34Å; V35-A37 PolarHBondContact O-N 3.09Å; V35-A38 PolarHBondContact O-N 3.39Å; V35-I39 HydrophobicContact CG1-CD1 3.75Å; V35-I39 WeakPolarHBondContact O-CB 3.2Å; V35-I39 VanDerWaalsContact O-CG1 3.29Å; V35-I39 WeakPolarHBondContact O-CG1 3.34Å; V35-I39 PolarHBondContact O-N 3.28Å; V35-F115 HydrophobicContact CG1-CD2 4.4Å; V35-I118 HydrophobicContact CB-CG2 4.44Å; V35-I118 HydrophobicContact CG1-CG2 4.28Å; V35-I118 HydrophobicContact CG2-CG1 4.24Å; V35-I118 HydrophobicContact CG2-CG2 4.25Å; V35-L122 HydrophobicContact CG2-CD1 3.61Å
36W94.8Very high94.2Very high91 Ų9144 Ų4435%0.34521%0.211SC..Hα-helixtrans-58.6-46.6177168.382.6000111.7L32 F33 N40 M152 F163L32-W36 VanDerWaalsContact O-CB 3.27Å; L32-W36 WeakPolarHBondContact O-CB 3.44Å; L32-W36 PolarHBondContact O-N 3.42Å; F33-W36 AromaticContact CD2-CE3 3.97Å; F33-W36 HydrophobicContact CD2-CE3 3.97Å; F33-W36 HydrophobicContact CD2-CZ3 4.06Å; F33-W36 AromaticContact CE2-CE3 3.93Å; F33-W36 HydrophobicContact CE2-CE3 3.93Å; F33-W36 AromaticContact CE2-CZ3 3.54Å; F33-W36 HydrophobicContact CE2-CZ3 3.54Å; F33-W36 HydrophobicContact CZ-CZ3 4.11Å; F33-W36 PolarHBondContact O-N 3.06Å; W36-N40 VanDerWaalsContact CD1-ND2 3.3Å; W36-N40 PolarHBondContact NE1-ND2 3.48Å; W36-N40 VanDerWaalsContact NE1-ND2 3.19Å; W36-N40 WeakPolarHBondContact O-CB 3.4Å; W36-N40 PolarHBondContact O-N 3.02Å; W36-N40 PolarHBondContact O-ND2 3.08Å; W36-M152 HydrophobicContact CH2-CE 3.62Å; W36-M152 HydrophobicContact CZ2-CE 4.3Å; W36-F163 AromaticContact CZ2-CE1 3.82Å; W36-F163 HydrophobicContact CZ2-CE1 3.82Å; W36-F163 AromaticContact CZ2-CZ 3.82Å; W36-F163 HydrophobicContact CZ2-CZ 3.82Å
37A95.8Very high94.1Very high7 Ų740.3 Ų40.36%0.05821%0.206CC..Hα-helixtrans-62.5-46.1-179.800000111.6F33 A34 V35 N40 A41 M148F33-A37 WeakPolarHBondContact O-CB 3.44Å; F33-A37 PolarHBondContact O-N 3.41Å; A34-A37 PolarHBondContact O-N 2.94Å; V35-A37 VanDerWaalsContact C-N 3.34Å; V35-A37 PolarHBondContact O-N 3.09Å; A37-N40 PolarHBondContact O-N 3.44Å; A37-A41 VanDerWaalsContact O-CB 3.24Å; A37-A41 WeakPolarHBondContact O-CB 3.48Å; A37-A41 PolarHBondContact O-N 3.1Å; A37-M148 HydrophobicContact CB-CE 3.91Å
38A96.9Very high94.1Very high2 Ų241 Ų412%0.01721%0.21CC..Hα-helixtrans-65-45.5179.800000112A34 V35 N40 A41 F42 I118A34-A38 WeakPolarHBondContact O-CB 3.44Å; A34-A38 PolarHBondContact O-N 3.42Å; V35-A38 PolarHBondContact O-N 3.39Å; A38-N40 VanDerWaalsContact C-N 3.33Å; A38-N40 PolarHBondContact O-N 3.35Å; A38-A41 WeakPolarHBondContact O-CB 3.38Å; A38-A41 PolarHBondContact O-N 3.29Å; A38-F42 WeakPolarHBondContact O-CD2 3.43Å; A38-F42 PolarHBondContact O-N 2.93Å; A38-I118 HydrophobicContact CB-CB 3.55Å; A38-I118 HydrophobicContact CB-CD1 4.01Å; A38-I118 HydrophobicContact CB-CG1 3.73Å; A38-I118 HydrophobicContact CB-CG2 4.1Å
39I96.7Very high94.2Very high33 Ų3339.5 Ų39.517%0.16921%0.207CC..Hα-helixtrans-56.5-49.7176-71.5168.5000110.7V35 A41 F42 N43 T111 F115V35-I39 HydrophobicContact CG1-CD1 3.75Å; V35-I39 WeakPolarHBondContact O-CB 3.2Å; V35-I39 VanDerWaalsContact O-CG1 3.29Å; V35-I39 WeakPolarHBondContact O-CG1 3.34Å; V35-I39 PolarHBondContact O-N 3.28Å; I39-A41 VanDerWaalsContact C-N 3.31Å; I39-A41 PolarHBondContact O-N 3.4Å; I39-F42 PolarHBondContact O-N 3.06Å; I39-N43 WeakPolarHBondContact O-CB 3.34Å; I39-N43 PolarHBondContact O-N 3.02Å; I39-T111 HydrophobicContact CG2-CG2 3.77Å; I39-F115 HydrophobicContact CD1-CB 4.16Å; I39-F115 HydrophobicContact CD1-CD2 4.22Å; I39-F115 HydrophobicContact CG1-CB 4.13Å
40N94.5Very high94.3Very high36 Ų3633.3 Ų33.319%0.19318%0.18CC..Hα-helixtrans-66.5-34.5179.8-79.3-87.1000112W36 A37 A38 N43 M44 M148W36-N40 VanDerWaalsContact CD1-ND2 3.3Å; W36-N40 PolarHBondContact NE1-ND2 3.48Å; W36-N40 VanDerWaalsContact NE1-ND2 3.19Å; W36-N40 WeakPolarHBondContact O-CB 3.4Å; W36-N40 PolarHBondContact O-N 3.02Å; W36-N40 PolarHBondContact O-ND2 3.08Å; A37-N40 PolarHBondContact O-N 3.44Å; A38-N40 VanDerWaalsContact C-N 3.33Å; A38-N40 PolarHBondContact O-N 3.35Å; N40-N43 PolarHBondContact O-N 3.43Å; N40-M44 WeakPolarHBondContact O-CB 3.44Å; N40-M44 VanDerWaalsContact O-CG 3.26Å; N40-M44 WeakPolarHBondContact O-CG 3.34Å; N40-M44 PolarHBondContact O-N 3Å; N40-M148 HydrophobicContact CB-SD 3.88Å
41A96.2Very high94.4Very high0 Ų031.5 Ų31.50%017%0.17CC..Hα-helixtrans-62-46.6177.200000111.8A37 A38 I39 M44 V45 P144 M148A37-A41 VanDerWaalsContact O-CB 3.24Å; A37-A41 WeakPolarHBondContact O-CB 3.48Å; A37-A41 PolarHBondContact O-N 3.1Å; A38-A41 WeakPolarHBondContact O-CB 3.38Å; A38-A41 PolarHBondContact O-N 3.29Å; I39-A41 VanDerWaalsContact C-N 3.31Å; I39-A41 PolarHBondContact O-N 3.4Å; A41-M44 PolarHBondContact O-N 3.03Å; A41-V45 PolarHBondContact O-N 3.14Å; A41-P144 HydrophobicContact CB-CB 3.91Å; A41-M148 HydrophobicContact CB-CB 4.04Å; A41-M148 HydrophobicContact CB-CE 4.37Å; A41-M148 HydrophobicContact CB-CG 4.48Å; A41-M148 HydrophobicContact CB-SD 3.79Å; A41-M148 PolarHBondContact N-SD 3.48Å; A41-M148 VanDerWaalsContact N-SD 3.42Å
42F97.1Very high94.5Very high0 Ų031.5 Ų31.50%017%0.17CC..Hα-helixtrans-67.6-41.5176.1-82.8-89.7000112A38 I39 M44 V45 L52 I113 V117 I141 P144A38-F42 WeakPolarHBondContact O-CD2 3.43Å; A38-F42 PolarHBondContact O-N 2.93Å; I39-F42 PolarHBondContact O-N 3.06Å; F42-M44 PolarHBondContact O-N 3.49Å; F42-V45 WeakPolarHBondContact O-CG2 3.17Å; F42-V45 PolarHBondContact O-N 3.09Å; F42-L52 HydrophobicContact CB-CD1 4.13Å; F42-L52 HydrophobicContact CD1-CD1 3.79Å; F42-L52 HydrophobicContact CG-CD1 4.47Å; F42-L52 VanDerWaalsContact O-CD1 3.3Å; F42-L52 WeakPolarHBondContact O-CD1 3.48Å; F42-I113 HydrophobicContact CD1-CG2 3.84Å; F42-I113 HydrophobicContact CE1-CG2 4.14Å; F42-I113 HydrophobicContact CG-CG2 4.48Å; F42-V117 HydrophobicContact CE1-CG2 4.44Å; F42-V117 HydrophobicContact CE2-CB 4.13Å; F42-V117 HydrophobicContact CE2-CG1 3.93Å; F42-V117 HydrophobicContact CE2-CG2 4.39Å; F42-V117 HydrophobicContact CZ-CB 4.19Å; F42-V117 HydrophobicContact CZ-CG1 3.96Å; F42-V117 HydrophobicContact CZ-CG2 3.98Å; F42-I141 HydrophobicContact CE2-CB 4.35Å; F42-I141 HydrophobicContact CE2-CG2 3.87Å; F42-I141 HydrophobicContact CZ-CG2 3.98Å; F42-P144 HydrophobicContact CE1-CG 4.33Å; F42-P144 HydrophobicContact CE2-CG 4.5Å; F42-P144 HydrophobicContact CZ-CG 4.25Å
43N94.1Very high94.7Very high44 Ų4426.2 Ų26.224%0.23514%0.143CC..Hα-helixtrans-61.7-42.4175.2-178.9-101.5000112.2I39 N40 V45 D46 D107 S110I39-N43 WeakPolarHBondContact O-CB 3.34Å; I39-N43 PolarHBondContact O-N 3.02Å; N40-N43 PolarHBondContact O-N 3.43Å; N43-V45 PolarHBondContact O-N 3.21Å; N43-D46 WeakPolarHBondContact O-CB 3.37Å; N43-D46 PolarHBondContact O-N 3.4Å; N43-D107 PolarHBondContact ND2-OD1 3.44Å; N43-S110 PolarHBondContact ND2-OG 2.9Å
44M91.1Very high94.9Very high30 Ų3021.4 Ų21.415%0.14812%0.123CC..Hα-helixtrans-68.2-28.4-177.6-83.1-174.165.800114.5N40 A41 F42 D46 M148 I151 H169N40-M44 WeakPolarHBondContact O-CB 3.44Å; N40-M44 VanDerWaalsContact O-CG 3.26Å; N40-M44 WeakPolarHBondContact O-CG 3.34Å; N40-M44 PolarHBondContact O-N 3Å; A41-M44 PolarHBondContact O-N 3.03Å; F42-M44 PolarHBondContact O-N 3.49Å; M44-D46 VanDerWaalsContact C-N 3.33Å; M44-M148 HydrophobicContact CE-CG 4.47Å; M44-M148 HydrophobicContact SD-CB 4.36Å; M44-M148 HydrophobicContact SD-CG 3.7Å; M44-I151 HydrophobicContact CE-CB 4Å; M44-I151 HydrophobicContact CE-CD1 4.19Å; M44-I151 HydrophobicContact CE-CG2 3.7Å; M44-H169 PolarHBondContact O-CE1 3.38Å; M44-H169 PolarHBondContact O-ND1 3.5Å
45V91.5Very high95Very high1 Ų120.4 Ų20.41%0.00611%0.114CC..Hα-helixtrans-81-12.8177.5-660000113.5A41 F42 N43 G47 L51 L52 L55 P144 D147A41-V45 PolarHBondContact O-N 3.14Å; F42-V45 WeakPolarHBondContact O-CG2 3.17Å; F42-V45 PolarHBondContact O-N 3.09Å; N43-V45 PolarHBondContact O-N 3.21Å; V45-G47 PolarHBondContact O-N 3.38Å; V45-L51 WeakPolarHBondContact O-CD2 3.43Å; V45-L52 HydrophobicContact CG2-CD1 4.14Å; V45-L55 HydrophobicContact CB-CD1 4.06Å; V45-L55 HydrophobicContact CG1-CD1 4.35Å; V45-L55 HydrophobicContact CG2-CD1 3.85Å; V45-P144 HydrophobicContact CG1-CB 4.32Å; V45-D147 HydrophobicContact CG1-CB 4.33Å
46D89.4Confident95.1Very high47 Ų4719.2 Ų19.225%0.25111%0.107SC..  trans-73.866.6178.5-165.622.9000112.5N43 M44 L52N43-D46 WeakPolarHBondContact O-CB 3.37Å; N43-D46 PolarHBondContact O-N 3.4Å; M44-D46 VanDerWaalsContact C-N 3.33Å; D46-L52 HydrophobicContact CB-CB 4.07Å; D46-L52 HydrophobicContact CB-CD2 3.91Å; D46-L52 HydrophobicContact CB-CG 4.44Å
47G88.8Confident95.2Very high41 Ų4115.9 Ų15.942%0.42310%0.097SC..  trans-119.5-10.5-176.900000115.3V45V45-G47 PolarHBondContact O-N 3.38Å
48I93.7Very high95.4Very high15 Ų1516.5 Ų16.58%0.07710%0.101CC..SBendtrans-142.8155178.159160.5000111.7G50 L51 H171 M175 S181 A184 F185I48-G50 PolarHBondContact O-N 3.03Å; I48-L51 HydrophobicContact CD1-CB 4.03Å; I48-L51 HydrophobicContact CD1-CD2 4.01Å; I48-L51 HydrophobicContact CG1-CB 3.53Å; I48-L51 HydrophobicContact CG1-CD2 3.65Å; I48-L51 HydrophobicContact CG1-CG 4.21Å; I48-L51 PolarHBondContact O-N 2.83Å; I48-H171 HydrophobicContact CD1-CB 3.8Å; I48-H171 HydrophobicContact CG1-CB 3.99Å; I48-H171 HydrophobicContact CG2-CB 4.22Å; I48-M175 HydrophobicContact CG2-CE 3.52Å; I48-M175 HydrophobicContact CG2-SD 4.04Å; I48-S181 WeakPolarHBondContact CB-OG 3.3Å; I48-A184 HydrophobicContact CD1-CB 3.95Å; I48-F185 HydrophobicContact CD1-CB 4.05Å
49D94.3Very high95.5Very high48 Ų4816.5 Ų16.526%0.25710%0.1SC..THydrogen-bonded Turntrans-55.9128.2179.8-57-27.2000112.3L51 N93 L94 K102D49-L51 VanDerWaalsContact C-N 3.27Å; D49-L51 PolarHBondContact O-N 3.09Å; D49-N93 WeakPolarHBondContact CA-OD1 3.48Å; D49-L94 HydrophobicContact CB-CD2 4.32Å; D49-K102 VanDerWaalsContact OD1-CE 3.24Å; D49-K102 WeakPolarHBondContact OD1-CE 3.22Å; D49-K102 IonicContact OD1-NZ 3.53Å; D49-K102 PolarHBondContact OD1-NZ 3.27Å; D49-K102 IonicContact OD2-NZ 2.7Å; D49-K102 PolarHBondContact OD2-NZ 3.05Å
50G95.5Very high95.6Very high0 Ų015 Ų150%09%0.092CC..THydrogen-bonded Turntrans85.5-19.8175.300000114.4I48 G53 G54 N93 F185I48-G50 PolarHBondContact O-N 3.03Å; G50-G53 PolarHBondContact O-N 2.94Å; G50-G54 PolarHBondContact O-N 2.79Å; G50-N93 PolarHBondContact N-OD1 3.45Å; G50-F185 WeakPolarHBondContact O-CE2 3.43Å
51L96.7Very high95.8Very high1 Ų114.6 Ų14.61%0.0059%0.094CC..Hα-helixtrans-66.1-51.5-166.5178.362.9000113.8V45 I48 D49 G53 G54 L55 H171 F185 I188V45-L51 WeakPolarHBondContact O-CD2 3.43Å; I48-L51 HydrophobicContact CD1-CB 4.03Å; I48-L51 HydrophobicContact CD1-CD2 4.01Å; I48-L51 HydrophobicContact CG1-CB 3.53Å; I48-L51 HydrophobicContact CG1-CD2 3.65Å; I48-L51 HydrophobicContact CG1-CG 4.21Å; I48-L51 PolarHBondContact O-N 2.83Å; D49-L51 VanDerWaalsContact C-N 3.27Å; D49-L51 PolarHBondContact O-N 3.09Å; L51-G53 VanDerWaalsContact C-N 3.32Å; L51-G53 PolarHBondContact O-N 3.24Å; L51-G54 PolarHBondContact O-N 3.38Å; L51-L55 HydrophobicContact CD1-CD1 3.82Å; L51-L55 HydrophobicContact CD1-CG 3.91Å; L51-L55 HydrophobicContact CG-CD1 3.98Å; L51-L55 HydrophobicContact CG-CG 4.42Å; L51-L55 WeakPolarHBondContact O-CB 3.5Å; L51-L55 WeakPolarHBondContact O-CG 3.41Å; L51-L55 PolarHBondContact O-N 3Å; L51-H171 HydrophobicContact CD2-CB 4Å; L51-F185 HydrophobicContact CB-CD2 4.35Å; L51-F185 HydrophobicContact CD1-CD2 4.46Å; L51-I188 HydrophobicContact CD1-CB 3.78Å; L51-I188 HydrophobicContact CD1-CD1 4.19Å; L51-I188 HydrophobicContact CD1-CG2 3.65Å; L51-I188 HydrophobicContact CD2-CD1 4.04Å
52L96.7Very high95.9Very high0 Ų014.7 Ų14.70%010%0.095CC..Hα-helixtrans-58.5-48.3178.1176.567.2000110.9F42 V45 D46 G54 L55 S56 M105 S110F42-L52 HydrophobicContact CB-CD1 4.13Å; F42-L52 HydrophobicContact CD1-CD1 3.79Å; F42-L52 HydrophobicContact CG-CD1 4.47Å; F42-L52 VanDerWaalsContact O-CD1 3.3Å; F42-L52 WeakPolarHBondContact O-CD1 3.48Å; V45-L52 HydrophobicContact CG2-CD1 4.14Å; D46-L52 HydrophobicContact CB-CB 4.07Å; D46-L52 HydrophobicContact CB-CD2 3.91Å; D46-L52 HydrophobicContact CB-CG 4.44Å; L52-G54 PolarHBondContact O-N 3.49Å; L52-L55 PolarHBondContact O-N 2.85Å; L52-S56 WeakPolarHBondContact O-CB 3.39Å; L52-S56 PolarHBondContact O-N 2.71Å; L52-S56 PolarHBondContact O-OG 3.38Å; L52-M105 HydrophobicContact CD2-CB 3.95Å; L52-M105 HydrophobicContact CD2-CE 3.58Å; L52-M105 HydrophobicContact CD2-CG 3.52Å; L52-M105 HydrophobicContact CD2-SD 4.33Å; L52-M105 HydrophobicContact CG-CE 4.19Å; L52-S110 VanDerWaalsContact CD2-CB 3.4Å
53G97.7Very high95.9Very high0 Ų014.7 Ų14.70%010%0.095CC..Hα-helixtrans-58.7-46.1178.800000112G50 L51 S56 C57 I90G50-G53 PolarHBondContact O-N 2.94Å; L51-G53 VanDerWaalsContact C-N 3.32Å; L51-G53 PolarHBondContact O-N 3.24Å; G53-S56 WeakPolarHBondContact O-CB 3.34Å; G53-S56 PolarHBondContact O-N 2.92Å; G53-C57 PolarHBondContact O-N 3.14Å; G53-C57 PolarHBondContact O-SG 3.08Å; G53-C57 VanDerWaalsContact O-SG 3.36Å; G53-I90 VanDerWaalsContact C-CD1 3.47Å
54G98.2Very high96.1Very high5 Ų512.6 Ų12.65%0.0528%0.084CC..Hα-helixtrans-63.8-43.1177.700000113.5G50 L51 L52 S56 C57 V58G50-G54 PolarHBondContact O-N 2.79Å; L51-G54 PolarHBondContact O-N 3.38Å; L52-G54 PolarHBondContact O-N 3.49Å; G54-S56 VanDerWaalsContact C-N 3.3Å; G54-S56 PolarHBondContact O-N 2.88Å; G54-C57 PolarHBondContact O-N 3.15Å; G54-V58 WeakPolarHBondContact O-CG2 3.37Å; G54-V58 PolarHBondContact O-N 3.08Å
55L98.3Very high96.5Very high2 Ų214.6 Ų14.61%0.019%0.094CC..Hα-helixtrans-63.6-38.1175.1-69.2178.4000111.7V45 L51 L52 V58 S59 I143 P144 I188 A192V45-L55 HydrophobicContact CB-CD1 4.06Å; V45-L55 HydrophobicContact CG1-CD1 4.35Å; V45-L55 HydrophobicContact CG2-CD1 3.85Å; L51-L55 HydrophobicContact CD1-CD1 3.82Å; L51-L55 HydrophobicContact CD1-CG 3.91Å; L51-L55 HydrophobicContact CG-CD1 3.98Å; L51-L55 HydrophobicContact CG-CG 4.42Å; L51-L55 WeakPolarHBondContact O-CB 3.5Å; L51-L55 WeakPolarHBondContact O-CG 3.41Å; L51-L55 PolarHBondContact O-N 3Å; L52-L55 PolarHBondContact O-N 2.85Å; L55-V58 PolarHBondContact O-N 3.32Å; L55-S59 PolarHBondContact O-N 3.32Å; L55-S59 PolarHBondContact O-OG 2.99Å; L55-I143 HydrophobicContact CD1-CG2 4.32Å; L55-I143 HydrophobicContact CD2-CB 4.4Å; L55-I143 HydrophobicContact CD2-CG2 4.23Å; L55-P144 HydrophobicContact CD1-CG 4.22Å; L55-I188 HydrophobicContact CD2-CG2 4.3Å; L55-A192 HydrophobicContact CD2-CB 3.31Å
56S98.3Very high96.8Very high0 Ų015.2 Ų15.20%010%0.097CC..Hα-helixtrans-63.4-45.7175.2-49.90000111.2L52 G53 G54 V58 S59 F60 I113L52-S56 WeakPolarHBondContact O-CB 3.39Å; L52-S56 PolarHBondContact O-N 2.71Å; L52-S56 PolarHBondContact O-OG 3.38Å; G53-S56 WeakPolarHBondContact O-CB 3.34Å; G53-S56 PolarHBondContact O-N 2.92Å; G54-S56 VanDerWaalsContact C-N 3.3Å; G54-S56 PolarHBondContact O-N 2.88Å; S56-V58 VanDerWaalsContact C-N 3.29Å; S56-V58 PolarHBondContact O-N 3.5Å; S56-S59 PolarHBondContact O-N 3.19Å; S56-F60 WeakPolarHBondContact O-CD2 3.1Å; S56-F60 PolarHBondContact O-N 3.12Å; S56-I113 WeakPolarHBondContact OG-CG2 3.48Å
57C98.7Very high97.2Very high21 Ų2113 Ų1314%0.1429%0.085CC..Hα-helixtrans-59.6-40.3175.2-72.50000112G53 G54 A61G53-C57 PolarHBondContact O-N 3.14Å; G53-C57 PolarHBondContact O-SG 3.08Å; G53-C57 VanDerWaalsContact O-SG 3.36Å; G54-C57 PolarHBondContact O-N 3.15Å; C57-A61 WeakPolarHBondContact O-CB 3.26Å; C57-A61 PolarHBondContact O-N 3.06Å
58V98.7Very high97.6Very high21 Ų2117.4 Ų17.413%0.1279%0.089CC..Hα-helixtrans-61.3-49.3174.6168.70000111G54 L55 S56 A61 A62 T189 A192 A193 A196G54-V58 WeakPolarHBondContact O-CG2 3.37Å; G54-V58 PolarHBondContact O-N 3.08Å; L55-V58 PolarHBondContact O-N 3.32Å; S56-V58 VanDerWaalsContact C-N 3.29Å; S56-V58 PolarHBondContact O-N 3.5Å; V58-A61 PolarHBondContact O-N 3.41Å; V58-A62 WeakPolarHBondContact O-CB 3.32Å; V58-A62 PolarHBondContact O-N 2.94Å; V58-T189 HydrophobicContact CG2-CG2 3.87Å; V58-A192 HydrophobicContact CG1-CB 4.18Å; V58-A193 HydrophobicContact CG1-CB 4.45Å; V58-A193 HydrophobicContact CG2-CB 4.04Å; V58-A196 HydrophobicContact CG1-CB 3.74Å
59S98.7Very high97.6Very high2 Ų222.9 Ų22.91%0.01411%0.113CC..Hα-helixtrans-63.5-47.8-179.4-61.60000111.9L55 S56 A61 A62 I63 I140L55-S59 PolarHBondContact O-N 3.32Å; L55-S59 PolarHBondContact O-OG 2.99Å; S56-S59 PolarHBondContact O-N 3.19Å; S59-A61 VanDerWaalsContact C-N 3.34Å; S59-A61 PolarHBondContact O-N 3.02Å; S59-A62 PolarHBondContact O-N 3.39Å; S59-I63 WeakPolarHBondContact O-CD1 2.96Å; S59-I63 VanDerWaalsContact O-CG1 3.24Å; S59-I63 WeakPolarHBondContact O-CG1 3.2Å; S59-I63 PolarHBondContact O-N 2.92Å; S59-I140 PolarHBondContact OG-O 2.87Å
60F98.7Very high97.6Very high0 Ų024.5 Ų24.50%012%0.121CC..Hα-helixtrans-64.7-36.3176.5-72.1-57.7000112.7S56 G64 C79 M82 I83 I86 I113 T116 V117 I120S56-F60 WeakPolarHBondContact O-CD2 3.1Å; S56-F60 PolarHBondContact O-N 3.12Å; F60-G64 WeakPolarHBondContact O-CA 3.45Å; F60-G64 PolarHBondContact O-N 3.5Å; F60-C79 HydrophobicContact CB-CB 4.29Å; F60-C79 HydrophobicContact CD1-CB 4.34Å; F60-C79 WeakPolarHBondContact O-CB 3.36Å; F60-M82 HydrophobicContact CD1-CB 4.15Å; F60-M82 HydrophobicContact CD1-CG 4.46Å; F60-M82 HydrophobicContact CD2-CB 3.87Å; F60-M82 HydrophobicContact CE1-CB 4.13Å; F60-M82 HydrophobicContact CE1-CG 4.08Å; F60-M82 HydrophobicContact CE2-CB 3.86Å; F60-M82 HydrophobicContact CE2-CE 4.18Å; F60-M82 HydrophobicContact CE2-CG 4.41Å; F60-M82 HydrophobicContact CG-CB 4.04Å; F60-M82 HydrophobicContact CZ-CB 3.99Å; F60-M82 HydrophobicContact CZ-CE 3.9Å; F60-M82 HydrophobicContact CZ-CG 4.06Å; F60-I83 HydrophobicContact CB-CD1 4.02Å; F60-I83 HydrophobicContact CB-CG1 3.69Å; F60-I86 HydrophobicContact CD2-CD1 3.88Å; F60-I86 HydrophobicContact CE2-CD1 3.74Å; F60-I113 HydrophobicContact CE2-CD1 4.12Å; F60-T116 HydrophobicContact CE1-CG2 3.97Å; F60-T116 HydrophobicContact CZ-CG2 3.98Å; F60-V117 HydrophobicContact CD1-CG2 4.45Å; F60-V117 HydrophobicContact CE1-CG2 3.83Å; F60-V117 HydrophobicContact CE2-CG2 4.04Å; F60-V117 HydrophobicContact CZ-CG2 3.59Å; F60-I120 HydrophobicContact CE1-CD1 4.07Å
61A98.7Very high97.5Very high28 Ų2826.9 Ų26.923%0.23115%0.146CC..Hα-helixtrans-66-44177.200000110.9C57 V58 S59 G64 M65 I83C57-A61 WeakPolarHBondContact O-CB 3.26Å; C57-A61 PolarHBondContact O-N 3.06Å; V58-A61 PolarHBondContact O-N 3.41Å; S59-A61 VanDerWaalsContact C-N 3.34Å; S59-A61 PolarHBondContact O-N 3.02Å; A61-G64 PolarHBondContact O-N 3.43Å; A61-M65 WeakPolarHBondContact O-CB 3.49Å; A61-M65 WeakPolarHBondContact O-CE 3.2Å; A61-M65 VanDerWaalsContact O-CG 3.23Å; A61-M65 WeakPolarHBondContact O-CG 3.47Å; A61-M65 PolarHBondContact O-N 2.78Å; A61-I83 HydrophobicContact CB-CD1 3.85Å
62A98.7Very high97.4Very high3 Ų329.9 Ų29.93%0.02516%0.16CC..Hα-helixtrans-62.9-48.8178.400000111.9V58 S59 M65 I66 I140 A196 V200V58-A62 WeakPolarHBondContact O-CB 3.32Å; V58-A62 PolarHBondContact O-N 2.94Å; S59-A62 PolarHBondContact O-N 3.39Å; A62-M65 PolarHBondContact O-N 3.44Å; A62-I66 WeakPolarHBondContact O-CG1 3.36Å; A62-I66 PolarHBondContact O-N 2.9Å; A62-I66 VanDerWaalsContact O-N 3.16Å; A62-I140 HydrophobicContact CB-CG1 4.02Å; A62-I140 HydrophobicContact CB-CG2 4.29Å; A62-A196 HydrophobicContact CB-CB 3.99Å; A62-V200 HydrophobicContact CB-CG2 3.7Å
63I98.5Very high97.3Very high0 Ų032.8 Ų32.80%018%0.178CC..Hα-helixtrans-60.6-50.5176-63.7165.8000110S59 M65 I66 L67 V117 I120 L121 I132 I140S59-I63 WeakPolarHBondContact O-CD1 2.96Å; S59-I63 VanDerWaalsContact O-CG1 3.24Å; S59-I63 WeakPolarHBondContact O-CG1 3.2Å; S59-I63 PolarHBondContact O-N 2.92Å; I63-M65 VanDerWaalsContact C-N 3.33Å; I63-M65 PolarHBondContact O-N 3.34Å; I63-I66 PolarHBondContact O-N 3.24Å; I63-L67 HydrophobicContact CG2-CD1 3.55Å; I63-L67 HydrophobicContact CG2-CG 4.19Å; I63-L67 WeakPolarHBondContact O-CB 3.26Å; I63-L67 VanDerWaalsContact O-CG 3.25Å; I63-L67 WeakPolarHBondContact O-CG 3.27Å; I63-L67 PolarHBondContact O-N 3.02Å; I63-V117 HydrophobicContact CD1-CG1 4.27Å; I63-I120 HydrophobicContact CG2-CG2 3.64Å; I63-L121 HydrophobicContact CD1-CD1 4.5Å; I63-L121 HydrophobicContact CD1-CD2 3.74Å; I63-L121 HydrophobicContact CD1-CG 3.88Å; I63-L121 HydrophobicContact CG1-CD2 3.82Å; I63-I132 HydrophobicContact CG1-CD1 4.47Å; I63-I132 HydrophobicContact CG2-CD1 4.1Å; I63-I140 HydrophobicContact CD1-CG2 4.03Å; I63-I140 HydrophobicContact CG1-CD1 3.9Å; I63-I140 HydrophobicContact CG1-CG2 3.77Å
64G98.3Very high97.2Very high0 Ų037 Ų370%021%0.207CC..Hα-helixtrans-59.9-39.3-178.700000113.2F60 A61 W68 A76F60-G64 WeakPolarHBondContact O-CA 3.45Å; F60-G64 PolarHBondContact O-N 3.5Å; A61-G64 PolarHBondContact O-N 3.43Å; G64-W68 VanDerWaalsContact O-CB 3.22Å; G64-W68 WeakPolarHBondContact O-CB 3.19Å; G64-W68 PolarHBondContact O-N 3.14Å; G64-A76 WeakPolarHBondContact O-CB 3.39Å
65M98.1Very high97.1Very high72 Ų7238.2 Ų38.236%0.35521%0.212SC..Hα-helixtrans-64.3-48.6175.2-77.2-175.4-63.400112A61 A62 I63 L67 W68 F69 V200A61-M65 WeakPolarHBondContact O-CB 3.49Å; A61-M65 WeakPolarHBondContact O-CE 3.2Å; A61-M65 VanDerWaalsContact O-CG 3.23Å; A61-M65 WeakPolarHBondContact O-CG 3.47Å; A61-M65 PolarHBondContact O-N 2.78Å; A62-M65 PolarHBondContact O-N 3.44Å; I63-M65 VanDerWaalsContact C-N 3.33Å; I63-M65 PolarHBondContact O-N 3.34Å; M65-L67 VanDerWaalsContact C-N 3.34Å; M65-L67 PolarHBondContact O-N 3.45Å; M65-W68 PolarHBondContact O-N 3.28Å; M65-F69 HydrophobicContact CB-CE2 4.43Å; M65-F69 WeakPolarHBondContact O-CD2 3.47Å; M65-F69 PolarHBondContact O-N 2.89Å; M65-V200 HydrophobicContact CE-CG2 4.46Å
66I97.7Very high97Very high13 Ų1338.1 Ų38.17%0.06721%0.212CC..Hα-helixtrans-60.6-47.5179.6-62.4164.8000110A62 I63 W68 F69 D70 P131 I132 T136 I140 V200 E203A62-I66 WeakPolarHBondContact O-CG1 3.36Å; A62-I66 PolarHBondContact O-N 2.9Å; A62-I66 VanDerWaalsContact O-N 3.16Å; I63-I66 PolarHBondContact O-N 3.24Å; I66-W68 VanDerWaalsContact C-N 3.3Å; I66-W68 PolarHBondContact O-N 2.9Å; I66-F69 PolarHBondContact O-N 3.18Å; I66-D70 WeakPolarHBondContact O-CB 3.46Å; I66-D70 PolarHBondContact O-N 2.98Å; I66-P131 VanDerWaalsContact CG2-O 3.31Å; I66-P131 WeakPolarHBondContact CG2-O 3.39Å; I66-I132 HydrophobicContact CB-CD1 4.41Å; I66-I132 HydrophobicContact CB-CG1 4.22Å; I66-I132 HydrophobicContact CD1-CD1 4.25Å; I66-I132 HydrophobicContact CD1-CG1 4.16Å; I66-I132 HydrophobicContact CG2-CD1 4.45Å; I66-I132 HydrophobicContact CG2-CG1 3.74Å; I66-T136 HydrophobicContact CD1-CG2 3.93Å; I66-I140 HydrophobicContact CD1-CD1 4.04Å; I66-V200 HydrophobicContact CD1-CB 4.47Å; I66-V200 HydrophobicContact CD1-CG2 3.92Å; I66-V200 HydrophobicContact CG1-CB 4.31Å; I66-V200 HydrophobicContact CG1-CG1 4.05Å; I66-V200 HydrophobicContact CG1-CG2 3.99Å; I66-E203 HydrophobicContact CD1-CB 4.49Å; I66-E203 HydrophobicContact CG2-CG 4.16Å
67L97.3Very high97Very high0 Ų042.9 Ų42.90%024%0.236CC..Hα-helixtrans-64.1-34.4179.3-65.3174.2000113.2I63 M65 G71 Q72 L75 A76 I120 T124 P131I63-L67 HydrophobicContact CG2-CD1 3.55Å; I63-L67 HydrophobicContact CG2-CG 4.19Å; I63-L67 WeakPolarHBondContact O-CB 3.26Å; I63-L67 VanDerWaalsContact O-CG 3.25Å; I63-L67 WeakPolarHBondContact O-CG 3.27Å; I63-L67 PolarHBondContact O-N 3.02Å; M65-L67 VanDerWaalsContact C-N 3.34Å; M65-L67 PolarHBondContact O-N 3.45Å; L67-G71 PolarHBondContact O-N 3.37Å; L67-G71 VanDerWaalsContact O-N 3.17Å; L67-Q72 HydrophobicContact CB-CB 4.26Å; L67-Q72 HydrophobicContact CD2-CB 4.12Å; L67-Q72 CarbonylContact O-C 3.54Å; L67-Q72 WeakPolarHBondContact O-CA 3.46Å; L67-Q72 PolarHBondContact O-N 3.14Å; L67-L75 HydrophobicContact CD1-CB 3.69Å; L67-A76 HydrophobicContact CB-CB 3.9Å; L67-I120 HydrophobicContact CD1-CG2 4.42Å; L67-T124 HydrophobicContact CD1-CG2 4.07Å; L67-T124 HydrophobicContact CD2-CG2 3.55Å; L67-T124 HydrophobicContact CG-CG2 4.37Å; L67-P131 HydrophobicContact CD2-CB 4.02Å; L67-P131 HydrophobicContact CD2-CG 3.48Å; L67-P131 VanDerWaalsContact CD2-CG 3.48Å
68W97.2Very high96.9Very high134 Ų13450.2 Ų50.251%0.50826%0.261SS..Hα-helixtrans-64.6-44.3175.1-173.9-88.4000111.3G64 M65 I66 G71 T73 A76 I77 F80G64-W68 VanDerWaalsContact O-CB 3.22Å; G64-W68 WeakPolarHBondContact O-CB 3.19Å; G64-W68 PolarHBondContact O-N 3.14Å; M65-W68 PolarHBondContact O-N 3.28Å; I66-W68 VanDerWaalsContact C-N 3.3Å; I66-W68 PolarHBondContact O-N 2.9Å; W68-G71 PolarHBondContact O-N 2.93Å; W68-T73 HydrophobicContact CE3-CG2 4.34Å; W68-T73 HydrophobicContact CZ3-CG2 4.33Å; W68-A76 HydrophobicContact CB-CB 4.08Å; W68-A76 HydrophobicContact CE3-CB 4.05Å; W68-I77 HydrophobicContact CZ3-CG1 4.43Å; W68-F80 HydrophobicContact CE3-CE2 4.22Å
69F94.8Very high96.9Very high131 Ų13149.2 Ų49.258%0.57526%0.255SS*.Hα-helixtrans-71.3-31.5178.4-69.1-56.1000113.4M65 I66 G71 Y204M65-F69 HydrophobicContact CB-CE2 4.43Å; M65-F69 WeakPolarHBondContact O-CD2 3.47Å; M65-F69 PolarHBondContact O-N 2.89Å; I66-F69 PolarHBondContact O-N 3.18Å; F69-G71 PolarHBondContact O-N 3.4Å; F69-Y204 HydrophobicContact CB-CD2 4.42Å; F69-Y204 HydrophobicContact CD1-CE2 4.43Å; F69-Y204 HydrophobicContact CD2-CD2 4.42Å; F69-Y204 HydrophobicContact CG-CD2 4.35Å; F69-Y204 HydrophobicContact CG-CE2 4.33Å
70D94Very high96.9Very high81 Ų8152.8 Ų52.843%0.43327%0.27SS..Hα-helixtrans-71.6-16.3172.7-172.272.3000113I66 Q72 P131I66-D70 WeakPolarHBondContact O-CB 3.46Å; I66-D70 PolarHBondContact O-N 2.98Å; D70-Q72 WeakPolarHBondContact OD2-CG 3.3Å; D70-Q72 PolarHBondContact OD2-NE2 3.3Å; D70-P131 HydrophobicContact CB-CB 3.82Å; D70-P131 WeakPolarHBondContact OD2-CB 3.42Å
71G94.6Very high96.9Very high50 Ų5055.1 Ų55.152%0.51529%0.29SS..THydrogen-bonded Turntrans91.82.6-178.400000114.4L67 W68 F69 T73L67-G71 PolarHBondContact O-N 3.37Å; L67-G71 VanDerWaalsContact O-N 3.17Å; W68-G71 PolarHBondContact O-N 2.93Å; F69-G71 PolarHBondContact O-N 3.4Å; G71-T73 PolarHBondContact O-N 3.39Å
72Q94Very high96.8Very high64 Ų6455.8 Ų55.830%0.29929%0.288SS..  trans-77.459172.1-67.4-174.344.400111.9L67 D70 S74 L75 A76 P131L67-Q72 HydrophobicContact CB-CB 4.26Å; L67-Q72 HydrophobicContact CD2-CB 4.12Å; L67-Q72 CarbonylContact O-C 3.54Å; L67-Q72 WeakPolarHBondContact O-CA 3.46Å; L67-Q72 PolarHBondContact O-N 3.14Å; D70-Q72 WeakPolarHBondContact OD2-CG 3.3Å; D70-Q72 PolarHBondContact OD2-NE2 3.3Å; Q72-S74 VanDerWaalsContact C-N 3.26Å; Q72-S74 PolarHBondContact O-N 3.24Å; Q72-L75 PolarHBondContact O-N 3.42Å; Q72-A76 PolarHBondContact O-N 2.82Å; Q72-P131 VanDerWaalsContact NE2-CD 3.33Å; Q72-P131 VanDerWaalsContact NE2-CG 3.28Å
73T95.1Very high96.8Very high62 Ų6257 Ų5738%0.3829%0.294SS..Hα-helixtrans-59.1-33.9-172.754.90000113.2W68 G71 A76 I77W68-T73 HydrophobicContact CE3-CG2 4.34Å; W68-T73 HydrophobicContact CZ3-CG2 4.33Å; G71-T73 PolarHBondContact O-N 3.39Å; T73-A76 PolarHBondContact O-N 3.26Å; T73-I77 WeakPolarHBondContact O-CB 3.48Å; T73-I77 WeakPolarHBondContact O-CD1 3.39Å; T73-I77 WeakPolarHBondContact O-CG1 3.16Å; T73-I77 PolarHBondContact O-N 3.34Å
74S95.4Very high96.8Very high87 Ų8760 Ų6061%0.60832%0.318SS*.Hα-helixtrans-61-51.1178.2-54.70000112.3Q72 I77 W78Q72-S74 VanDerWaalsContact C-N 3.26Å; Q72-S74 PolarHBondContact O-N 3.24Å; S74-I77 PolarHBondContact O-N 2.7Å; S74-W78 PolarHBondContact O-N 3.36Å
75L94.7Very high96.8Very high32 Ų3263.3 Ų63.317%0.16835%0.346CS..Hα-helixtrans-70.9-32.6178-71.4177.1000112.1L67 Q72 W78 C79 T124L67-L75 HydrophobicContact CD1-CB 3.69Å; Q72-L75 PolarHBondContact O-N 3.42Å; L75-W78 WeakPolarHBondContact O-CB 3.39Å; L75-W78 PolarHBondContact O-N 3.49Å; L75-C79 PolarHBondContact O-N 3.19Å; L75-C79 VanDerWaalsContact O-N 3.08Å; L75-C79 PolarHBondContact O-SG 3.05Å; L75-C79 VanDerWaalsContact O-SG 3.33Å; L75-T124 HydrophobicContact CD1-CG2 3.93Å
76A97.7Very high96.8Very high0 Ų060.4 Ų60.40%033%0.332CS..Hα-helixtrans-60.5-45.4172.700000111.7G64 L67 W68 Q72 T73 W78 C79 F80G64-A76 WeakPolarHBondContact O-CB 3.39Å; L67-A76 HydrophobicContact CB-CB 3.9Å; W68-A76 HydrophobicContact CB-CB 4.08Å; W68-A76 HydrophobicContact CE3-CB 4.05Å; Q72-A76 PolarHBondContact O-N 2.82Å; T73-A76 PolarHBondContact O-N 3.26Å; A76-W78 VanDerWaalsContact C-N 3.3Å; A76-W78 PolarHBondContact O-N 3.29Å; A76-C79 WeakPolarHBondContact O-CB 3.36Å; A76-C79 PolarHBondContact O-N 3.18Å; A76-C79 VanDerWaalsContact O-N 3.11Å; A76-F80 HydrophobicContact CB-CE2 4.19Å; A76-F80 WeakPolarHBondContact O-CD2 3.3Å; A76-F80 PolarHBondContact O-N 3.41Å
77I97.9Very high96.7Very high99 Ų9964 Ų6451%0.50835%0.351SS..Hα-helixtrans-61-39.9176.2-70.8164000110.8W68 T73 S74 C79 F80 A81W68-I77 HydrophobicContact CZ3-CG1 4.43Å; T73-I77 WeakPolarHBondContact O-CB 3.48Å; T73-I77 WeakPolarHBondContact O-CD1 3.39Å; T73-I77 WeakPolarHBondContact O-CG1 3.16Å; T73-I77 PolarHBondContact O-N 3.34Å; S74-I77 PolarHBondContact O-N 2.7Å; I77-C79 VanDerWaalsContact C-N 3.33Å; I77-C79 PolarHBondContact O-N 2.84Å; I77-F80 PolarHBondContact O-N 3.42Å; I77-A81 VanDerWaalsContact O-CB 3.28Å; I77-A81 WeakPolarHBondContact O-CB 3.3Å; I77-A81 PolarHBondContact O-N 3.46Å
78W96.7Very high96.7Very high176 Ų17667.4 Ų67.467%0.66737%0.373SS*.Hα-helixtrans-58.6-43.8173.4-81.8108.1000112.3S74 L75 A76 A81 M82S74-W78 PolarHBondContact O-N 3.36Å; L75-W78 WeakPolarHBondContact O-CB 3.39Å; L75-W78 PolarHBondContact O-N 3.49Å; A76-W78 VanDerWaalsContact C-N 3.3Å; A76-W78 PolarHBondContact O-N 3.29Å; W78-A81 PolarHBondContact O-N 2.9Å; W78-M82 WeakPolarHBondContact O-CG 3.18Å; W78-M82 PolarHBondContact O-N 2.98Å
79C98.3Very high96.7Very high0 Ų062.3 Ų62.30%035%0.354CS..Hα-helixtrans-61.5-45.8176.2-64.60000111.7F60 L75 A76 I77 A81 M82 I83F60-C79 HydrophobicContact CB-CB 4.29Å; F60-C79 HydrophobicContact CD1-CB 4.34Å; F60-C79 WeakPolarHBondContact O-CB 3.36Å; L75-C79 PolarHBondContact O-N 3.19Å; L75-C79 VanDerWaalsContact O-N 3.08Å; L75-C79 PolarHBondContact O-SG 3.05Å; L75-C79 VanDerWaalsContact O-SG 3.33Å; A76-C79 WeakPolarHBondContact O-CB 3.36Å; A76-C79 PolarHBondContact O-N 3.18Å; A76-C79 VanDerWaalsContact O-N 3.11Å; I77-C79 VanDerWaalsContact C-N 3.33Å; I77-C79 PolarHBondContact O-N 2.84Å; C79-A81 PolarHBondContact O-N 3.43Å; C79-M82 WeakPolarHBondContact O-CB 3.32Å; C79-M82 PolarHBondContact O-N 3.4Å; C79-I83 WeakPolarHBondContact O-CG1 3.37Å; C79-I83 PolarHBondContact O-N 2.8Å; C79-I83 VanDerWaalsContact O-N 3.1Å
80F98.4Very high96.8Very high77 Ų7757 Ų5734%0.33833%0.331SS..Hα-helixtrans-68.3-33.3178.1-61.6-51.4000112.9W68 A76 I77 I83 A84W68-F80 HydrophobicContact CE3-CE2 4.22Å; A76-F80 HydrophobicContact CB-CE2 4.19Å; A76-F80 WeakPolarHBondContact O-CD2 3.3Å; A76-F80 PolarHBondContact O-N 3.41Å; I77-F80 PolarHBondContact O-N 3.42Å; F80-I83 HydrophobicContact CD1-CD1 4.1Å; F80-I83 WeakPolarHBondContact O-CB 3.25Å; F80-I83 PolarHBondContact O-N 2.9Å; F80-A84 PolarHBondContact O-N 3.49Å
81A98.2Very high96.9Very high49 Ų4957.4 Ų57.441%0.40533%0.332SS..Hα-helixtrans-64.9-40.3172.600000111.5I77 W78 C79 I83 A84 A85I77-A81 VanDerWaalsContact O-CB 3.28Å; I77-A81 WeakPolarHBondContact O-CB 3.3Å; I77-A81 PolarHBondContact O-N 3.46Å; W78-A81 PolarHBondContact O-N 2.9Å; C79-A81 PolarHBondContact O-N 3.43Å; A81-I83 VanDerWaalsContact C-N 3.33Å; A81-I83 PolarHBondContact O-N 2.83Å; A81-A84 PolarHBondContact O-N 3.41Å; A81-A85 WeakPolarHBondContact O-CB 3.4Å; A81-A85 PolarHBondContact O-N 2.68Å
82M98.1Very high97Very high42 Ų4257.3 Ų57.321%0.20732%0.319CS..Hα-helixtrans-61.1-42172.8-69.5-62.2-69.100111.3F60 W78 C79 A85 I86 I113 T116F60-M82 HydrophobicContact CD1-CB 4.15Å; F60-M82 HydrophobicContact CD1-CG 4.46Å; F60-M82 HydrophobicContact CD2-CB 3.87Å; F60-M82 HydrophobicContact CE1-CB 4.13Å; F60-M82 HydrophobicContact CE1-CG 4.08Å; F60-M82 HydrophobicContact CE2-CB 3.86Å; F60-M82 HydrophobicContact CE2-CE 4.18Å; F60-M82 HydrophobicContact CE2-CG 4.41Å; F60-M82 HydrophobicContact CG-CB 4.04Å; F60-M82 HydrophobicContact CZ-CB 3.99Å; F60-M82 HydrophobicContact CZ-CE 3.9Å; F60-M82 HydrophobicContact CZ-CG 4.06Å; W78-M82 WeakPolarHBondContact O-CG 3.18Å; W78-M82 PolarHBondContact O-N 2.98Å; C79-M82 WeakPolarHBondContact O-CB 3.32Å; C79-M82 PolarHBondContact O-N 3.4Å; M82-A85 PolarHBondContact O-N 2.74Å; M82-I86 WeakPolarHBondContact O-CB 3.47Å; M82-I86 VanDerWaalsContact O-CD1 3.3Å; M82-I86 WeakPolarHBondContact O-CD1 3.43Å; M82-I86 WeakPolarHBondContact O-CG1 3.45Å; M82-I86 PolarHBondContact O-N 3.03Å; M82-I113 HydrophobicContact CE-CD1 3.75Å; M82-T116 HydrophobicContact CE-CG2 4.16Å
83I98.6Very high97.1Very high29 Ų2954.4 Ų54.415%0.14931%0.306CS..Hα-helixtrans-60.1-48.5173.8-63.6172.3000110.6F60 A61 C79 F80 A81 A85 I86 L87F60-I83 HydrophobicContact CB-CD1 4.02Å; F60-I83 HydrophobicContact CB-CG1 3.69Å; A61-I83 HydrophobicContact CB-CD1 3.85Å; C79-I83 WeakPolarHBondContact O-CG1 3.37Å; C79-I83 PolarHBondContact O-N 2.8Å; C79-I83 VanDerWaalsContact O-N 3.1Å; F80-I83 HydrophobicContact CD1-CD1 4.1Å; F80-I83 WeakPolarHBondContact O-CB 3.25Å; F80-I83 PolarHBondContact O-N 2.9Å; A81-I83 VanDerWaalsContact C-N 3.33Å; A81-I83 PolarHBondContact O-N 2.83Å; I83-A85 PolarHBondContact O-N 3.26Å; I83-I86 PolarHBondContact O-N 3.35Å; I83-I86 VanDerWaalsContact O-N 3.08Å; I83-L87 HydrophobicContact CG2-CD1 4.2Å; I83-L87 HydrophobicContact CG2-CG 4.23Å; I83-L87 WeakPolarHBondContact O-CG 3.43Å; I83-L87 PolarHBondContact O-N 3.06Å
84A98.5Very high97.1Very high61 Ų6152.8 Ų52.850%0.50429%0.294SS..Hα-helixtrans-58.3-37.1178.700000112.3F80 A81 P88F80-A84 PolarHBondContact O-N 3.49Å; A81-A84 PolarHBondContact O-N 3.41Å; A84-P88 WeakPolarHBondContact O-CD 3.44Å
85A97.2Very high97Very high71 Ų7149.4 Ų49.459%0.58727%0.273SS*.Hα-helixtrans-72.4-32.8175.500000113.4A81 M82 I83A81-A85 WeakPolarHBondContact O-CB 3.4Å; A81-A85 PolarHBondContact O-N 2.68Å; M82-A85 PolarHBondContact O-N 2.74Å; I83-A85 PolarHBondContact O-N 3.26Å
86I97.7Very high96.9Very high10 Ų1052.5 Ų52.55%0.05129%0.289CS..Hα-helixtrans-79.7-29.9-178.6-68.6163.1000112.1F60 M82 I83 Y89 I90 I113F60-I86 HydrophobicContact CD2-CD1 3.88Å; F60-I86 HydrophobicContact CE2-CD1 3.74Å; M82-I86 WeakPolarHBondContact O-CB 3.47Å; M82-I86 VanDerWaalsContact O-CD1 3.3Å; M82-I86 WeakPolarHBondContact O-CD1 3.43Å; M82-I86 WeakPolarHBondContact O-CG1 3.45Å; M82-I86 PolarHBondContact O-N 3.03Å; I83-I86 PolarHBondContact O-N 3.35Å; I83-I86 VanDerWaalsContact O-N 3.08Å; I86-Y89 HydrophobicContact CG2-CD1 4.37Å; I86-Y89 WeakPolarHBondContact O-CA 3.33Å; I86-Y89 VanDerWaalsContact O-CB 3.31Å; I86-Y89 WeakPolarHBondContact O-CB 3.29Å; I86-Y89 PolarHBondContact O-N 2.97Å; I86-Y89 VanDerWaalsContact O-N 3.07Å; I86-I90 HydrophobicContact CG2-CD1 3.77Å; I86-I90 HydrophobicContact CG2-CG1 3.91Å; I86-I90 PolarHBondContact O-N 2.88Å; I86-I113 HydrophobicContact CD1-CD1 3.75Å; I86-I113 HydrophobicContact CG1-CD1 4.26Å
87L97.2Very high96.6Very high89 Ų8957.8 Ų57.847%0.46632%0.316SS..Hα-helixtrans-56.9-48.8-177.2-78.1173.6000113.6I83 Y89 I90 M91I83-L87 HydrophobicContact CG2-CD1 4.2Å; I83-L87 HydrophobicContact CG2-CG 4.23Å; I83-L87 WeakPolarHBondContact O-CG 3.43Å; I83-L87 PolarHBondContact O-N 3.06Å; L87-Y89 VanDerWaalsContact C-N 3.28Å; L87-Y89 PolarHBondContact O-N 3.49Å; L87-I90 PolarHBondContact O-N 2.91Å; L87-M91 WeakPolarHBondContact O-CG 3.36Å; L87-M91 PolarHBondContact O-N 3.01Å; L87-M91 VanDerWaalsContact O-N 3.09Å
88P96.8Very high96.2Very high71 Ų7154.6 Ų54.646%0.46131%0.308SS..Hα-helixtrans-57.2-40.6173.3-25.734.1000112.8A84 M91 L92A84-P88 WeakPolarHBondContact O-CD 3.44Å; P88-M91 PolarHBondContact O-N 3.36Å; P88-L92 VanDerWaalsContact O-CG 3.32Å; P88-L92 WeakPolarHBondContact O-CG 3.15Å; P88-L92 PolarHBondContact O-N 2.72Å
89Y96.1Very high95.8Very high28 Ų2857.2 Ų57.211%0.1132%0.318CS..Hα-helixtrans-59.4-48.1175.3160.3-100.7000111.5I86 L87 M91 L92 N93 V103 M105I86-Y89 HydrophobicContact CG2-CD1 4.37Å; I86-Y89 WeakPolarHBondContact O-CA 3.33Å; I86-Y89 VanDerWaalsContact O-CB 3.31Å; I86-Y89 WeakPolarHBondContact O-CB 3.29Å; I86-Y89 PolarHBondContact O-N 2.97Å; I86-Y89 VanDerWaalsContact O-N 3.07Å; L87-Y89 VanDerWaalsContact C-N 3.28Å; L87-Y89 PolarHBondContact O-N 3.49Å; Y89-M91 VanDerWaalsContact C-N 3.3Å; Y89-M91 PolarHBondContact O-N 3.33Å; Y89-L92 PolarHBondContact O-N 3.37Å; Y89-N93 HydrophobicContact CD2-CB 4.35Å; Y89-N93 HydrophobicContact CE1-CB 4.43Å; Y89-N93 HydrophobicContact CE2-CB 3.8Å; Y89-N93 WeakPolarHBondContact O-CB 3.41Å; Y89-N93 PolarHBondContact O-N 2.81Å; Y89-V103 HydrophobicContact CD2-CG1 4.27Å; Y89-M105 HydrophobicContact CD1-SD 4.37Å; Y89-M105 HydrophobicContact CE1-SD 4.06Å; Y89-M105 HydrophobicContact CE2-CB 4.1Å; Y89-M105 HydrophobicContact CE2-SD 4.25Å; Y89-M105 WeakPolarHBondContact OH-CB 3.48Å; Y89-M105 PolarHBondContact OH-N 2.76Å
90I96.6Very high95.5Very high18 Ų1867.6 Ų67.69%0.09236%0.357CS..Hα-helixtrans-57.8-44.5178.4-66.8170.6000110.6G53 I86 L87 L92 N93 L94G53-I90 VanDerWaalsContact C-CD1 3.47Å; I86-I90 HydrophobicContact CG2-CD1 3.77Å; I86-I90 HydrophobicContact CG2-CG1 3.91Å; I86-I90 PolarHBondContact O-N 2.88Å; L87-I90 PolarHBondContact O-N 2.91Å; I90-L92 PolarHBondContact O-N 2.96Å; I90-N93 PolarHBondContact O-N 3.1Å; I90-L94 HydrophobicContact CG2-CD1 3.73Å; I90-L94 HydrophobicContact CG2-CG 4.25Å; I90-L94 WeakPolarHBondContact O-CB 3.18Å; I90-L94 VanDerWaalsContact O-CG 3.28Å; I90-L94 WeakPolarHBondContact O-CG 3.34Å; I90-L94 PolarHBondContact O-N 2.96Å
91M96.6Very high95.2Very high91 Ų9170 Ų7045%0.44837%0.365SS..Hα-helixtrans-62.3-44.9-179.7-66.1-178.672.500112.3L87 P88 Y89 G95 I96L87-M91 WeakPolarHBondContact O-CG 3.36Å; L87-M91 PolarHBondContact O-N 3.01Å; L87-M91 VanDerWaalsContact O-N 3.09Å; P88-M91 PolarHBondContact O-N 3.36Å; Y89-M91 VanDerWaalsContact C-N 3.3Å; Y89-M91 PolarHBondContact O-N 3.33Å; M91-G95 PolarHBondContact O-N 3.27Å; M91-I96 HydrophobicContact CB-CD1 4.13Å; M91-I96 HydrophobicContact CE-CG2 4.46Å; M91-I96 HydrophobicContact CG-CD1 4.14Å; M91-I96 WeakPolarHBondContact O-CB 3.4Å; M91-I96 WeakPolarHBondContact O-CG1 3.4Å; M91-I96 PolarHBondContact O-N 3.49Å
92L96.6Very high95Very high47 Ų4770.6 Ų70.625%0.24636%0.358CS..Hα-helixtrans-67.4-42.5177.2-66.6175.3000111.4P88 Y89 I90 L94 G95 L97 K102 V103P88-L92 VanDerWaalsContact O-CG 3.32Å; P88-L92 WeakPolarHBondContact O-CG 3.15Å; P88-L92 PolarHBondContact O-N 2.72Å; Y89-L92 PolarHBondContact O-N 3.37Å; I90-L92 PolarHBondContact O-N 2.96Å; L92-L94 PolarHBondContact O-N 3.33Å; L92-G95 WeakPolarHBondContact O-CA 3.16Å; L92-G95 PolarHBondContact O-N 3.26Å; L92-L97 HydrophobicContact CD2-CB 4.4Å; L92-L97 HydrophobicContact CD2-CD1 3.76Å; L92-L97 HydrophobicContact CD2-CG 4.36Å; L92-K102 WeakPolarHBondContact O-CA 3.47Å; L92-V103 HydrophobicContact CB-CB 4.23Å; L92-V103 HydrophobicContact CB-CG2 4.13Å; L92-V103 HydrophobicContact CD1-CG2 3.95Å
93N95.8Very high94.8Very high4 Ų471.7 Ų71.72%0.02137%0.367CS..Hα-helixtrans-67.5-35.8-179.5-175.5-110000112.5D49 G50 Y89 I90 G95 K102 V103D49-N93 WeakPolarHBondContact CA-OD1 3.48Å; G50-N93 PolarHBondContact N-OD1 3.45Å; Y89-N93 HydrophobicContact CD2-CB 4.35Å; Y89-N93 HydrophobicContact CE1-CB 4.43Å; Y89-N93 HydrophobicContact CE2-CB 3.8Å; Y89-N93 WeakPolarHBondContact O-CB 3.41Å; Y89-N93 PolarHBondContact O-N 2.81Å; I90-N93 PolarHBondContact O-N 3.1Å; N93-G95 PolarHBondContact O-N 3.29Å; N93-K102 VanDerWaalsContact O-CE 3.22Å; N93-K102 WeakPolarHBondContact O-CE 3.24Å; N93-V103 WeakPolarHBondContact CA-O 3.13Å; N93-V103 VanDerWaalsContact CB-O 3.3Å; N93-V103 WeakPolarHBondContact CB-O 3.32Å; N93-V103 PolarHBondContact ND2-O 3Å
94L95.5Very high94.5Very high27 Ų2776.8 Ų76.814%0.14139%0.389CS..THydrogen-bonded Turntrans-70.8-9.4170.6-71.3174.7000113.5D49 I90 L92 I96 R182 F185D49-L94 HydrophobicContact CB-CD2 4.32Å; I90-L94 HydrophobicContact CG2-CD1 3.73Å; I90-L94 HydrophobicContact CG2-CG 4.25Å; I90-L94 WeakPolarHBondContact O-CB 3.18Å; I90-L94 VanDerWaalsContact O-CG 3.28Å; I90-L94 WeakPolarHBondContact O-CG 3.34Å; I90-L94 PolarHBondContact O-N 2.96Å; L92-L94 PolarHBondContact O-N 3.33Å; L94-I96 HydrophobicContact CB-CD1 4.4Å; L94-I96 HydrophobicContact CB-CG1 4.02Å; L94-I96 HydrophobicContact CD1-CD1 4.43Å; L94-R182 PolarHBondContact O-NH2 2.99Å; L94-F185 HydrophobicContact CD1-CE1 4.01Å; L94-F185 HydrophobicContact CD2-CD1 4.11Å; L94-F185 HydrophobicContact CD2-CE1 4.26Å
95G93.6Very high94.2Very high16 Ų1675.6 Ų75.617%0.16537%0.373CS..THydrogen-bonded Turntrans7130.8-179.500000113.3M91 L92 N93 L97 G98M91-G95 PolarHBondContact O-N 3.27Å; L92-G95 WeakPolarHBondContact O-CA 3.16Å; L92-G95 PolarHBondContact O-N 3.26Å; N93-G95 PolarHBondContact O-N 3.29Å; G95-L97 VanDerWaalsContact C-N 3.33Å; G95-L97 PolarHBondContact O-N 3Å; G95-G98 PolarHBondContact O-N 3.47Å
96I92.5Very high93.9Very high97 Ų9774 Ų7450%0.49736%0.363SS..THydrogen-bonded Turntrans-62.9-40.8-177.9-63.2-179.6000110.9M91 L94 G98M91-I96 HydrophobicContact CB-CD1 4.13Å; M91-I96 HydrophobicContact CE-CG2 4.46Å; M91-I96 HydrophobicContact CG-CD1 4.14Å; M91-I96 WeakPolarHBondContact O-CB 3.4Å; M91-I96 WeakPolarHBondContact O-CG1 3.4Å; M91-I96 PolarHBondContact O-N 3.49Å; L94-I96 HydrophobicContact CB-CD1 4.4Å; L94-I96 HydrophobicContact CB-CG1 4.02Å; L94-I96 HydrophobicContact CD1-CD1 4.43Å; I96-G98 PolarHBondContact O-N 3.46Å
97L92.2Very high93.6Very high111 Ų11179 Ų7958%0.58139%0.39SS*.THydrogen-bonded Turntrans-81.810.3175.5-60.6-177.4000113.3L92 G95 Y101L92-L97 HydrophobicContact CD2-CB 4.4Å; L92-L97 HydrophobicContact CD2-CD1 3.76Å; L92-L97 HydrophobicContact CD2-CG 4.36Å; G95-L97 VanDerWaalsContact C-N 3.33Å; G95-L97 PolarHBondContact O-N 3Å; L97-Y101 HydrophobicContact CB-CD2 4.41Å; L97-Y101 VanDerWaalsContact O-CD2 3.25Å; L97-Y101 WeakPolarHBondContact O-CD2 3.47Å
98G89.5Confident93.4Very high32 Ų3278.8 Ų78.833%0.3340%0.401SS..  trans99.5154.2-177.400000113.4G95 I96 R100 Y101G95-G98 PolarHBondContact O-N 3.47Å; I96-G98 PolarHBondContact O-N 3.46Å; G98-R100 PolarHBondContact O-N 2.91Å; G98-R100 VanDerWaalsContact O-N 3.13Å; G98-Y101 PolarHBondContact O-N 3.21Å
99R88.6Confident93.3Very high232 Ų23276.3 Ų76.388%0.87539%0.388SS*.G310 helixtrans-62.2-23.5-173.7-69.1-175.8179175.11.1114.1Y101 K102R99-Y101 VanDerWaalsContact C-N 3.28Å; R99-Y101 PolarHBondContact O-N 2.85Å; R99-K102 WeakPolarHBondContact O-CB 3.24Å; R99-K102 PolarHBondContact O-N 3.38Å
100R92Very high93.3Very high217 Ų21775 Ų7582%0.81938%0.383SS*.G310 helixtrans-63.4-32.5178.8-176.8-179.3179.9-173.61.6112.8G98G98-R100 PolarHBondContact O-N 2.91Å; G98-R100 VanDerWaalsContact O-N 3.13Å
101Y92.1Very high93.3Very high128 Ų12876.8 Ų76.850%0.50240%0.395SS..G310 helixtrans-101.515.4-176.9-52.3-78.1000112.2L97 G98 R99 V103L97-Y101 HydrophobicContact CB-CD2 4.41Å; L97-Y101 VanDerWaalsContact O-CD2 3.25Å; L97-Y101 WeakPolarHBondContact O-CD2 3.47Å; G98-Y101 PolarHBondContact O-N 3.21Å; R99-Y101 VanDerWaalsContact C-N 3.28Å; R99-Y101 PolarHBondContact O-N 2.85Å; Y101-V103 PolarHBondContact O-N 2.84Å
102K93.5Very high93.3Very high61 Ų6177.3 Ų77.327%0.26540%0.399SS..  trans-67.8121.8-177.2-173.9174.9176.1-179.40110D49 L92 N93 R99 F104D49-K102 VanDerWaalsContact OD1-CE 3.24Å; D49-K102 WeakPolarHBondContact OD1-CE 3.22Å; D49-K102 IonicContact OD1-NZ 3.53Å; D49-K102 PolarHBondContact OD1-NZ 3.27Å; D49-K102 IonicContact OD2-NZ 2.7Å; D49-K102 PolarHBondContact OD2-NZ 3.05Å; L92-K102 WeakPolarHBondContact O-CA 3.47Å; N93-K102 VanDerWaalsContact O-CE 3.22Å; N93-K102 WeakPolarHBondContact O-CE 3.24Å; R99-K102 WeakPolarHBondContact O-CB 3.24Å; R99-K102 PolarHBondContact O-N 3.38Å; K102-F104 HydrophobicContact CD-CE1 4.28Å; K102-F104 HydrophobicContact CD-CE2 4.34Å; K102-F104 HydrophobicContact CD-CZ 3.82Å; K102-F104 VanDerWaalsContact CE-CE1 3.42Å; K102-F104 VanDerWaalsContact CE-CZ 3.46Å; K102-F104 HydrophobicContact CG-CE2 4.29Å; K102-F104 HydrophobicContact CG-CZ 4.21Å
103V94.1Very high93.3Very high66 Ų6675.5 Ų75.540%0.439%0.39SS..  trans-105.9143176.3179.50000109Y89 L92 N93 Y101Y89-V103 HydrophobicContact CD2-CG1 4.27Å; L92-V103 HydrophobicContact CB-CB 4.23Å; L92-V103 HydrophobicContact CB-CG2 4.13Å; L92-V103 HydrophobicContact CD1-CG2 3.95Å; N93-V103 WeakPolarHBondContact CA-O 3.13Å; N93-V103 VanDerWaalsContact CB-O 3.3Å; N93-V103 WeakPolarHBondContact CB-O 3.32Å; N93-V103 PolarHBondContact ND2-O 3Å; Y101-V103 PolarHBondContact O-N 2.84Å
104F92.5Very high93.4Very high136 Ų13675.3 Ų75.360%0.59639%0.388SS*.  trans-112.3145.7174.2-62.4-87.5000109.3K102K102-F104 HydrophobicContact CD-CE1 4.28Å; K102-F104 HydrophobicContact CD-CE2 4.34Å; K102-F104 HydrophobicContact CD-CZ 3.82Å; K102-F104 VanDerWaalsContact CE-CE1 3.42Å; K102-F104 VanDerWaalsContact CE-CZ 3.46Å; K102-F104 HydrophobicContact CG-CE2 4.29Å; K102-F104 HydrophobicContact CG-CZ 4.21Å
105M91Very high93.5Very high36 Ų3678.2 Ų78.218%0.17740%0.4CS..  trans-63.8-45.7-179.1-168.274.4128.200111.9L52 Y89 I113L52-M105 HydrophobicContact CD2-CB 3.95Å; L52-M105 HydrophobicContact CD2-CE 3.58Å; L52-M105 HydrophobicContact CD2-CG 3.52Å; L52-M105 HydrophobicContact CD2-SD 4.33Å; L52-M105 HydrophobicContact CG-CE 4.19Å; Y89-M105 HydrophobicContact CD1-SD 4.37Å; Y89-M105 HydrophobicContact CE1-SD 4.06Å; Y89-M105 HydrophobicContact CE2-CB 4.1Å; Y89-M105 HydrophobicContact CE2-SD 4.25Å; Y89-M105 WeakPolarHBondContact OH-CB 3.48Å; Y89-M105 PolarHBondContact OH-N 2.76Å; M105-I113 HydrophobicContact CE-CB 4.35Å; M105-I113 HydrophobicContact CE-CD1 4.27Å; M105-I113 HydrophobicContact CE-CG1 3.32Å
106G91Very high93.6Very high37 Ų3778.9 Ų78.938%0.38140%0.401SS..Hα-helixtrans67.9171.2-169.700000113.2A108 G109 S110G106-A108 VanDerWaalsContact C-N 3.31Å; G106-A108 PolarHBondContact O-N 3.48Å; G106-G109 PolarHBondContact O-N 2.93Å; G106-S110 PolarHBondContact O-N 2.93Å; G106-S110 VanDerWaalsContact O-N 3.1Å; G106-S110 PolarHBondContact O-OG 3.01Å
107D91.5Very high93.9Very high115 Ų11574.3 Ų74.362%0.61538%0.378SS*.Hα-helixtrans-63.8-36.3-177.2-67.3-34.6000112.7N43 S110 T111N43-D107 PolarHBondContact ND2-OD1 3.44Å; D107-S110 WeakPolarHBondContact CA-OG 3.12Å; D107-S110 PolarHBondContact O-OG 2.83Å; D107-S110 VanDerWaalsContact O-OG 3.1Å; D107-T111 WeakPolarHBondContact O-CB 3.37Å; D107-T111 PolarHBondContact O-N 2.94Å; D107-T111 PolarHBondContact O-OG1 3.47Å
108A93.6Very high94.1Very high85 Ų8569.7 Ų69.770%0.70235%0.353SS*.Hα-helixtrans-62.5-45.9178.400000111.7G106 L112G106-A108 VanDerWaalsContact C-N 3.31Å; G106-A108 PolarHBondContact O-N 3.48Å; A108-L112 WeakPolarHBondContact O-CB 3.37Å; A108-L112 PolarHBondContact O-N 3.07Å
109G94.2Very high94.4Very high18 Ų1872.5 Ų72.519%0.18635%0.354CS..Hα-helixtrans-69.1-42.4179.500000112.3G106 L112 I113G106-G109 PolarHBondContact O-N 2.93Å; G109-L112 PolarHBondContact O-N 3.05Å; G109-I113 WeakPolarHBondContact O-CG1 3.33Å; G109-I113 PolarHBondContact O-N 2.97Å
110S95.9Very high94.7Very high0 Ų062 Ų620%032%0.315CS..Hα-helixtrans-66.3-38.5178.260.60000112.9N43 L52 G106 D107 G114N43-S110 PolarHBondContact ND2-OG 2.9Å; L52-S110 VanDerWaalsContact CD2-CB 3.4Å; G106-S110 PolarHBondContact O-N 2.93Å; G106-S110 VanDerWaalsContact O-N 3.1Å; G106-S110 PolarHBondContact O-OG 3.01Å; D107-S110 WeakPolarHBondContact CA-OG 3.12Å; D107-S110 PolarHBondContact O-OG 2.83Å; D107-S110 VanDerWaalsContact O-OG 3.1Å; S110-G114 PolarHBondContact O-N 3.39Å
111T96.3Very high94.9Very high56 Ų5651.8 Ų51.834%0.34428%0.277SS..Hα-helixtrans-63.9-45.1173.8-610000111.4I39 D107 G114 F115I39-T111 HydrophobicContact CG2-CG2 3.77Å; D107-T111 WeakPolarHBondContact O-CB 3.37Å; D107-T111 PolarHBondContact O-N 2.94Å; D107-T111 PolarHBondContact O-OG1 3.47Å; T111-G114 PolarHBondContact O-N 3.38Å; T111-F115 VanDerWaalsContact O-CB 3.3Å; T111-F115 WeakPolarHBondContact O-CB 3.19Å; T111-F115 PolarHBondContact O-N 3.48Å
112L96.7Very high95Very high102 Ų10245.8 Ų45.853%0.53425%0.254SS..Hα-helixtrans-59.7-49.1177.3177.863.4000111.3A108 G109 G114 F115 T116A108-L112 WeakPolarHBondContact O-CB 3.37Å; A108-L112 PolarHBondContact O-N 3.07Å; G109-L112 PolarHBondContact O-N 3.05Å; L112-G114 PolarHBondContact O-N 2.99Å; L112-F115 PolarHBondContact O-N 3.12Å; L112-T116 WeakPolarHBondContact O-CB 3.28Å; L112-T116 PolarHBondContact O-N 3.03Å; L112-T116 PolarHBondContact O-OG1 3.33Å
113I97.7Very high95Very high9 Ų946.7 Ų46.75%0.04626%0.259CS..Hα-helixtrans-58.6-50.2176.6-71.3-54.9000111.5F42 S56 F60 M82 I86 M105 G109 F115 T116 V117F42-I113 HydrophobicContact CD1-CG2 3.84Å; F42-I113 HydrophobicContact CE1-CG2 4.14Å; F42-I113 HydrophobicContact CG-CG2 4.48Å; S56-I113 WeakPolarHBondContact OG-CG2 3.48Å; F60-I113 HydrophobicContact CE2-CD1 4.12Å; M82-I113 HydrophobicContact CE-CD1 3.75Å; I86-I113 HydrophobicContact CD1-CD1 3.75Å; I86-I113 HydrophobicContact CG1-CD1 4.26Å; M105-I113 HydrophobicContact CE-CB 4.35Å; M105-I113 HydrophobicContact CE-CD1 4.27Å; M105-I113 HydrophobicContact CE-CG1 3.32Å; G109-I113 WeakPolarHBondContact O-CG1 3.33Å; G109-I113 PolarHBondContact O-N 2.97Å; I113-F115 VanDerWaalsContact C-N 3.27Å; I113-F115 PolarHBondContact O-N 3.42Å; I113-T116 PolarHBondContact O-N 3.47Å; I113-V117 HydrophobicContact CG2-CG2 4.4Å; I113-V117 WeakPolarHBondContact O-CG2 3.35Å; I113-V117 PolarHBondContact O-N 2.99Å
114G97.6Very high95Very high0 Ų043.5 Ų43.50%024%0.239CC..Hα-helixtrans-59.2-41.6-179.700000111.8S110 T111 L112 I118S110-G114 PolarHBondContact O-N 3.39Å; T111-G114 PolarHBondContact O-N 3.38Å; L112-G114 PolarHBondContact O-N 2.99Å; G114-I118 VanDerWaalsContact O-CG2 3.32Å; G114-I118 WeakPolarHBondContact O-CG2 3.29Å; G114-I118 PolarHBondContact O-N 3.49Å; G114-I118 VanDerWaalsContact O-N 3.08Å
115F96.8Very high95.1Very high89 Ų8937.3 Ų37.339%0.3921%0.213SC..Hα-helixtrans-63.7-46.7174.6177.2-100.3000112.3V35 I39 T111 L112 I113 V117 I118 W119V35-F115 HydrophobicContact CG1-CD2 4.4Å; I39-F115 HydrophobicContact CD1-CB 4.16Å; I39-F115 HydrophobicContact CD1-CD2 4.22Å; I39-F115 HydrophobicContact CG1-CB 4.13Å; T111-F115 VanDerWaalsContact O-CB 3.3Å; T111-F115 WeakPolarHBondContact O-CB 3.19Å; T111-F115 PolarHBondContact O-N 3.48Å; L112-F115 PolarHBondContact O-N 3.12Å; I113-F115 VanDerWaalsContact C-N 3.27Å; I113-F115 PolarHBondContact O-N 3.42Å; F115-V117 PolarHBondContact O-N 3.37Å; F115-I118 WeakPolarHBondContact O-CG2 3.32Å; F115-I118 PolarHBondContact O-N 3.38Å; F115-W119 HydrophobicContact CZ-CE3 4.05Å; F115-W119 WeakPolarHBondContact O-CB 3.32Å; F115-W119 PolarHBondContact O-N 2.86Å
116T97Very high95.1Very high29 Ų2936.8 Ų36.818%0.17821%0.21CC..Hα-helixtrans-63.2-42.9179.2-57.10000111.5F60 M82 L112 I113 W119 I120F60-T116 HydrophobicContact CE1-CG2 3.97Å; F60-T116 HydrophobicContact CZ-CG2 3.98Å; M82-T116 HydrophobicContact CE-CG2 4.16Å; L112-T116 WeakPolarHBondContact O-CB 3.28Å; L112-T116 PolarHBondContact O-N 3.03Å; L112-T116 PolarHBondContact O-OG1 3.33Å; I113-T116 PolarHBondContact O-N 3.47Å; T116-W119 PolarHBondContact O-N 2.81Å; T116-I120 HydrophobicContact CG2-CD1 4Å; T116-I120 WeakPolarHBondContact O-CG1 3.47Å; T116-I120 PolarHBondContact O-N 3.03Å
117V98.2Very high94.7Very high1 Ų137.3 Ų37.31%0.00622%0.215CC..Hα-helixtrans-62-50.7177.7171.50000110.7F42 F60 I63 I113 F115 W119 I120 L121 I141F42-V117 HydrophobicContact CE1-CG2 4.44Å; F42-V117 HydrophobicContact CE2-CB 4.13Å; F42-V117 HydrophobicContact CE2-CG1 3.93Å; F42-V117 HydrophobicContact CE2-CG2 4.39Å; F42-V117 HydrophobicContact CZ-CB 4.19Å; F42-V117 HydrophobicContact CZ-CG1 3.96Å; F42-V117 HydrophobicContact CZ-CG2 3.98Å; F60-V117 HydrophobicContact CD1-CG2 4.45Å; F60-V117 HydrophobicContact CE1-CG2 3.83Å; F60-V117 HydrophobicContact CE2-CG2 4.04Å; F60-V117 HydrophobicContact CZ-CG2 3.59Å; I63-V117 HydrophobicContact CD1-CG1 4.27Å; I113-V117 HydrophobicContact CG2-CG2 4.4Å; I113-V117 WeakPolarHBondContact O-CG2 3.35Å; I113-V117 PolarHBondContact O-N 2.99Å; F115-V117 PolarHBondContact O-N 3.37Å; V117-W119 VanDerWaalsContact C-N 3.33Å; V117-W119 PolarHBondContact O-N 3.15Å; V117-I120 PolarHBondContact O-N 3.33Å; V117-L121 HydrophobicContact CG1-CD1 3.9Å; V117-L121 HydrophobicContact CG1-CG 4.48Å; V117-L121 WeakPolarHBondContact O-CB 3.42Å; V117-L121 VanDerWaalsContact O-CG 3.3Å; V117-L121 WeakPolarHBondContact O-CG 3.46Å; V117-L121 PolarHBondContact O-N 3.26Å; V117-I141 HydrophobicContact CG1-CG2 3.6Å
118I96.8Very high93.9Very high14 Ų1442.2 Ų42.27%0.07223%0.231CC..Hα-helixtrans-68.7-33-179.2-166.655.2000112.4V35 A38 G114 F115 L121 L122V35-I118 HydrophobicContact CB-CG2 4.44Å; V35-I118 HydrophobicContact CG1-CG2 4.28Å; V35-I118 HydrophobicContact CG2-CG1 4.24Å; V35-I118 HydrophobicContact CG2-CG2 4.25Å; A38-I118 HydrophobicContact CB-CB 3.55Å; A38-I118 HydrophobicContact CB-CD1 4.01Å; A38-I118 HydrophobicContact CB-CG1 3.73Å; A38-I118 HydrophobicContact CB-CG2 4.1Å; G114-I118 VanDerWaalsContact O-CG2 3.32Å; G114-I118 WeakPolarHBondContact O-CG2 3.29Å; G114-I118 PolarHBondContact O-N 3.49Å; G114-I118 VanDerWaalsContact O-N 3.08Å; F115-I118 WeakPolarHBondContact O-CG2 3.32Å; F115-I118 PolarHBondContact O-N 3.38Å; I118-L121 HydrophobicContact CD1-CB 4.45Å; I118-L121 PolarHBondContact O-N 2.81Å; I118-L122 HydrophobicContact CD1-CG 4.37Å; I118-L122 HydrophobicContact CG1-CD1 4.23Å; I118-L122 HydrophobicContact CG1-CG 4.29Å; I118-L122 WeakPolarHBondContact O-CB 3.36Å; I118-L122 VanDerWaalsContact O-CG 3.23Å; I118-L122 WeakPolarHBondContact O-CG 3.5Å; I118-L122 PolarHBondContact O-N 3.44Å
119W94.8Very high93.2Very high92 Ų9243.9 Ų43.935%0.34823%0.232SC..Hα-helixtrans-59.3-52.7174.4176.2-87000111.2L7 F115 T116 V117 L121 L122 E123L7-W119 HydrophobicContact CD1-CH2 4.49Å; L7-W119 HydrophobicContact CD1-CZ2 4.3Å; L7-W119 HydrophobicContact CD2-CE3 4.1Å; L7-W119 HydrophobicContact CD2-CH2 4.07Å; L7-W119 HydrophobicContact CD2-CZ2 4.46Å; L7-W119 HydrophobicContact CD2-CZ3 3.87Å; F115-W119 HydrophobicContact CZ-CE3 4.05Å; F115-W119 WeakPolarHBondContact O-CB 3.32Å; F115-W119 PolarHBondContact O-N 2.86Å; T116-W119 PolarHBondContact O-N 2.81Å; V117-W119 VanDerWaalsContact C-N 3.33Å; V117-W119 PolarHBondContact O-N 3.15Å; W119-L121 VanDerWaalsContact C-N 3.32Å; W119-L121 PolarHBondContact O-N 2.86Å; W119-L122 PolarHBondContact O-N 3.41Å; W119-E123 PolarHBondContact NE1-OE2 3.43Å; W119-E123 PolarHBondContact O-N 3.3Å
120I95.5Very high92.9Very high10 Ų1045 Ų455%0.05123%0.232CC..Hα-helixtrans-63.4-41.2179.5-62.2170.2000110.1F60 I63 L67 T116 V117 L122 E123 T124F60-I120 HydrophobicContact CE1-CD1 4.07Å; I63-I120 HydrophobicContact CG2-CG2 3.64Å; L67-I120 HydrophobicContact CD1-CG2 4.42Å; T116-I120 HydrophobicContact CG2-CD1 4Å; T116-I120 WeakPolarHBondContact O-CG1 3.47Å; T116-I120 PolarHBondContact O-N 3.03Å; V117-I120 PolarHBondContact O-N 3.33Å; I120-L122 PolarHBondContact O-N 2.92Å; I120-E123 PolarHBondContact O-N 3.06Å; I120-T124 HydrophobicContact CG2-CG2 4.03Å; I120-T124 WeakPolarHBondContact O-CB 3.36Å; I120-T124 VanDerWaalsContact O-CG2 3.24Å; I120-T124 WeakPolarHBondContact O-CG2 3.31Å; I120-T124 PolarHBondContact O-N 3.41Å; I120-T124 PolarHBondContact O-OG1 2.6Å
121L96.6Very high92.6Very high3 Ų345.5 Ų45.52%0.01624%0.236CC..Hα-helixtrans-61.8-40.9175.6-71.8173.8000112.2I63 V117 I118 W119 E123 T124 T125 I132 A137 I140 I141I63-L121 HydrophobicContact CD1-CD1 4.5Å; I63-L121 HydrophobicContact CD1-CD2 3.74Å; I63-L121 HydrophobicContact CD1-CG 3.88Å; I63-L121 HydrophobicContact CG1-CD2 3.82Å; V117-L121 HydrophobicContact CG1-CD1 3.9Å; V117-L121 HydrophobicContact CG1-CG 4.48Å; V117-L121 WeakPolarHBondContact O-CB 3.42Å; V117-L121 VanDerWaalsContact O-CG 3.3Å; V117-L121 WeakPolarHBondContact O-CG 3.46Å; V117-L121 PolarHBondContact O-N 3.26Å; I118-L121 HydrophobicContact CD1-CB 4.45Å; I118-L121 PolarHBondContact O-N 2.81Å; W119-L121 VanDerWaalsContact C-N 3.32Å; W119-L121 PolarHBondContact O-N 2.86Å; L121-E123 VanDerWaalsContact C-N 3.32Å; L121-E123 PolarHBondContact O-N 3.33Å; L121-T124 WeakPolarHBondContact CA-OG1 3.45Å; L121-T124 PolarHBondContact O-N 3.43Å; L121-T125 VanDerWaalsContact O-CB 3.22Å; L121-T125 WeakPolarHBondContact O-CB 3.32Å; L121-T125 WeakPolarHBondContact O-CG2 3.48Å; L121-T125 PolarHBondContact O-N 3.43Å; L121-T125 PolarHBondContact O-OG1 3.5Å; L121-I132 HydrophobicContact CD2-CD1 4.44Å; L121-A137 HydrophobicContact CD1-CB 4.25Å; L121-A137 HydrophobicContact CD2-CB 3.91Å; L121-A137 HydrophobicContact CG-CB 4.47Å; L121-I140 HydrophobicContact CD2-CD1 4.02Å; L121-I140 HydrophobicContact CD2-CG2 4.49Å; L121-I141 HydrophobicContact CD1-CG2 3.96Å
122L94.4Very high92.6Very high3 Ų342.8 Ų42.82%0.01622%0.219CC..Hα-helixtrans-65.6-36.8176.2-73.6172.5000112.3M2 L7 L9 T31 V35 I118 W119 I120 Q126M2-L122 HydrophobicContact CE-CD1 4.3Å; L7-L122 HydrophobicContact CD2-CB 3.76Å; L7-L122 HydrophobicContact CD2-CD1 4.34Å; L7-L122 HydrophobicContact CG-CB 4.47Å; L9-L122 HydrophobicContact CD1-CD2 4.3Å; L9-L122 HydrophobicContact CD2-CD2 3.46Å; L9-L122 VanDerWaalsContact CD2-CD2 3.46Å; L9-L122 HydrophobicContact CG-CD2 3.56Å; T31-L122 HydrophobicContact CG2-CD1 3.55Å; T31-L122 HydrophobicContact CG2-CD2 3.74Å; T31-L122 HydrophobicContact CG2-CG 4.31Å; V35-L122 HydrophobicContact CG2-CD1 3.61Å; I118-L122 HydrophobicContact CD1-CG 4.37Å; I118-L122 HydrophobicContact CG1-CD1 4.23Å; I118-L122 HydrophobicContact CG1-CG 4.29Å; I118-L122 WeakPolarHBondContact O-CB 3.36Å; I118-L122 VanDerWaalsContact O-CG 3.23Å; I118-L122 WeakPolarHBondContact O-CG 3.5Å; I118-L122 PolarHBondContact O-N 3.44Å; W119-L122 PolarHBondContact O-N 3.41Å; I120-L122 PolarHBondContact O-N 2.92Å; L122-Q126 WeakPolarHBondContact O-CB 3.44Å; L122-Q126 WeakPolarHBondContact O-CG 3.4Å
123E92.2Very high92.5Very high79 Ų7938.1 Ų38.137%0.36920%0.195SC..Hα-helixtrans-68.2-37.4176.1-167.9173.1164.700112.2L7 W119 I120 L121L7-E123 HydrophobicContact CD1-CB 3.89Å; L7-E123 HydrophobicContact CD1-CG 4.08Å; W119-E123 PolarHBondContact NE1-OE2 3.43Å; W119-E123 PolarHBondContact O-N 3.3Å; I120-E123 PolarHBondContact O-N 3.06Å; L121-E123 VanDerWaalsContact C-N 3.32Å; L121-E123 PolarHBondContact O-N 3.33Å
124T94.1Very high92.4Very high0 Ų038.4 Ų38.40%020%0.198CC..Hα-helixtrans-98.5-6.4-170.356.70000114.2L67 L75 I120 L121 P131 I132L67-T124 HydrophobicContact CD1-CG2 4.07Å; L67-T124 HydrophobicContact CD2-CG2 3.55Å; L67-T124 HydrophobicContact CG-CG2 4.37Å; L75-T124 HydrophobicContact CD1-CG2 3.93Å; I120-T124 HydrophobicContact CG2-CG2 4.03Å; I120-T124 WeakPolarHBondContact O-CB 3.36Å; I120-T124 VanDerWaalsContact O-CG2 3.24Å; I120-T124 WeakPolarHBondContact O-CG2 3.31Å; I120-T124 PolarHBondContact O-N 3.41Å; I120-T124 PolarHBondContact O-OG1 2.6Å; L121-T124 WeakPolarHBondContact CA-OG1 3.45Å; L121-T124 PolarHBondContact O-N 3.43Å; T124-P131 HydrophobicContact CG2-CG 4.37Å; T124-P131 WeakPolarHBondContact O-CD 3.35Å; T124-P131 WeakPolarHBondContact O-CG 3Å; T124-I132 PolarHBondContact O-N 2.87Å; T124-I132 VanDerWaalsContact O-N 3.13Å
125T94.5Very high92.3Very high5 Ų538.5 Ų38.53%0.03120%0.198CC..SBendtrans-105-4.3175.861.50000114.2L121 H130 I132 A137L121-T125 VanDerWaalsContact O-CB 3.22Å; L121-T125 WeakPolarHBondContact O-CB 3.32Å; L121-T125 WeakPolarHBondContact O-CG2 3.48Å; L121-T125 PolarHBondContact O-N 3.43Å; L121-T125 PolarHBondContact O-OG1 3.5Å; T125-H130 VanDerWaalsContact C-CB 3.49Å; T125-H130 PolarHBondContact O-CD2 3.38Å; T125-H130 VanDerWaalsContact O-CD2 3.28Å; T125-I132 WeakPolarHBondContact CA-O 3.37Å; T125-I132 WeakPolarHBondContact CB-O 3.24Å; T125-I132 HydrophobicContact CG2-CB 3.98Å; T125-I132 HydrophobicContact CG2-CG2 3.9Å; T125-I132 WeakPolarHBondContact CG2-O 3.39Å; T125-A137 HydrophobicContact CG2-CB 3.88Å
126Q91.4Very high92.3Very high26 Ų2634.4 Ų34.412%0.12118%0.18CC..SBendtrans-120.7151.1-173.9-55.7-59.4-56.300110.4L9 S10 S11 L122L9-Q126 HydrophobicContact CD2-CG 4.44Å; S10-Q126 PolarHBondContact OG-OE1 3.49Å; S10-Q126 VanDerWaalsContact OG-OE1 3.06Å; S11-Q126 PolarHBondContact O-NE2 3.26Å; L122-Q126 WeakPolarHBondContact O-CB 3.44Å; L122-Q126 WeakPolarHBondContact O-CG 3.4Å
127G83.2Confident92.4Very high47 Ų4733.6 Ų33.649%0.48518%0.177SC..SBendtrans100.6169.3-173.800000112.9T129 H130G127-T129 PolarHBondContact O-N 3.31Å; G127-H130 PolarHBondContact O-CD2 2.97Å
128K73.7Confident92.4Very high218 Ų21836 Ų3695%0.94819%0.19SC*.THydrogen-bonded Turntrans-70.4-28.4-167.5-70.3-176.5176.6-178.90115
129T79.1Confident92.5Very high120 Ų12035.8 Ų35.874%0.73619%0.188SC*.THydrogen-bonded Turntrans-118.227.1-175.758.30000110.7G127G127-T129 PolarHBondContact O-N 3.31Å
130H88.2Confident92.6Very high41 Ų4131.6 Ų31.619%0.1917%0.172CC..  trans-53.3129.5-170.259.958.3000111T125 G127 I132T125-H130 VanDerWaalsContact C-CB 3.49Å; T125-H130 PolarHBondContact O-CD2 3.38Å; T125-H130 VanDerWaalsContact O-CD2 3.28Å; G127-H130 PolarHBondContact O-CD2 2.97Å; H130-I132 VanDerWaalsContact C-N 3.27Å; H130-I132 PolarHBondContact ND1-O 2.86Å; H130-I132 PolarHBondContact O-N 3.07Å
131P90.5Very high92.8Very high11 Ų1131.7 Ų31.77%0.07117%0.173CC..SBendtrans-71.3-20.8-175.126.4-38000114I66 L67 D70 Q72 T124I66-P131 VanDerWaalsContact CG2-O 3.31Å; I66-P131 WeakPolarHBondContact CG2-O 3.39Å; L67-P131 HydrophobicContact CD2-CB 4.02Å; L67-P131 HydrophobicContact CD2-CG 3.48Å; L67-P131 VanDerWaalsContact CD2-CG 3.48Å; D70-P131 HydrophobicContact CB-CB 3.82Å; D70-P131 WeakPolarHBondContact OD2-CB 3.42Å; Q72-P131 VanDerWaalsContact NE2-CD 3.33Å; Q72-P131 VanDerWaalsContact NE2-CG 3.28Å; T124-P131 HydrophobicContact CG2-CG 4.37Å; T124-P131 WeakPolarHBondContact O-CD 3.35Å; T124-P131 WeakPolarHBondContact O-CG 3Å
132I95.3Very high92.8Very high0 Ų031.6 Ų31.60%017%0.172CC..SBendtrans-123.5123.2-175.9-56.5-177000107.5I63 I66 L121 T124 T125 H130 T136 I140I63-I132 HydrophobicContact CG1-CD1 4.47Å; I63-I132 HydrophobicContact CG2-CD1 4.1Å; I66-I132 HydrophobicContact CB-CD1 4.41Å; I66-I132 HydrophobicContact CB-CG1 4.22Å; I66-I132 HydrophobicContact CD1-CD1 4.25Å; I66-I132 HydrophobicContact CD1-CG1 4.16Å; I66-I132 HydrophobicContact CG2-CD1 4.45Å; I66-I132 HydrophobicContact CG2-CG1 3.74Å; L121-I132 HydrophobicContact CD2-CD1 4.44Å; T124-I132 PolarHBondContact O-N 2.87Å; T124-I132 VanDerWaalsContact O-N 3.13Å; T125-I132 WeakPolarHBondContact CA-O 3.37Å; T125-I132 WeakPolarHBondContact CB-O 3.24Å; T125-I132 HydrophobicContact CG2-CB 3.98Å; T125-I132 HydrophobicContact CG2-CG2 3.9Å; T125-I132 WeakPolarHBondContact CG2-O 3.39Å; H130-I132 VanDerWaalsContact C-N 3.27Å; H130-I132 PolarHBondContact ND1-O 2.86Å; H130-I132 PolarHBondContact O-N 3.07Å; I132-T136 HydrophobicContact CG2-CG2 3.86Å; I132-I140 HydrophobicContact CD1-CD1 4.3Å; I132-I140 HydrophobicContact CG2-CD1 4.16Å
133S94.7Very high93Very high4 Ų431.7 Ų31.73%0.02817%0.173CC..  trans-65.1147.3171.263.60000111.4V135 T136 A137 E203S133-V135 PolarHBondContact O-N 3.21Å; S133-V135 VanDerWaalsContact O-N 3.09Å; S133-T136 PolarHBondContact O-N 3.31Å; S133-T136 WeakPolarHBondContact OG-CB 3.16Å; S133-T136 PolarHBondContact OG-N 3.08Å; S133-T136 PolarHBondContact OG-OG1 3.5Å; S133-A137 PolarHBondContact O-N 2.93Å; S133-A137 VanDerWaalsContact O-N 3.16Å; S133-E203 WeakPolarHBondContact CB-OE2 3.23Å; S133-E203 PolarHBondContact N-OE1 3.31Å; S133-E203 PolarHBondContact N-OE2 3.36Å; S133-E203 PolarHBondContact OG-OE2 2.9Å
134P95.2Very high93.2Very high15 Ų1528 Ų2810%0.09716%0.156CC..Hα-helixtrans-55.2-29175.3-27.735.9000113.6A137P134-A137 WeakPolarHBondContact O-CB 3.45Å
135V96.4Very high93.4Very high2 Ų229.4 Ų29.41%0.01216%0.163CC..Hα-helixtrans-71.7-43.1175-177.10000111.6I15 S133 A137 L138 E210 M213 L214I15-V135 HydrophobicContact CG2-CG2 3.55Å; S133-V135 PolarHBondContact O-N 3.21Å; S133-V135 VanDerWaalsContact O-N 3.09Å; V135-A137 PolarHBondContact O-N 3.35Å; V135-L138 VanDerWaalsContact O-CB 3.26Å; V135-L138 WeakPolarHBondContact O-CB 3.47Å; V135-L138 PolarHBondContact O-N 3.18Å; V135-E210 HydrophobicContact CG2-CB 4.1Å; V135-M213 HydrophobicContact CG1-CB 3.69Å; V135-L214 HydrophobicContact CG1-CB 3.98Å; V135-L214 HydrophobicContact CG2-CB 4.31Å
136T97.3Very high93.5Very high2 Ų229.3 Ų29.31%0.01216%0.162CC..Hα-helixtrans-59.1-34.3175.2-68.40000111.7I66 I132 S133 L138 W139 I140 E203I66-T136 HydrophobicContact CD1-CG2 3.93Å; I132-T136 HydrophobicContact CG2-CG2 3.86Å; S133-T136 PolarHBondContact O-N 3.31Å; S133-T136 WeakPolarHBondContact OG-CB 3.16Å; S133-T136 PolarHBondContact OG-N 3.08Å; S133-T136 PolarHBondContact OG-OG1 3.5Å; T136-L138 PolarHBondContact O-N 3.28Å; T136-W139 WeakPolarHBondContact O-CA 3.38Å; T136-W139 WeakPolarHBondContact O-CB 3.27Å; T136-W139 PolarHBondContact O-N 3.04Å; T136-I140 HydrophobicContact CG2-CD1 4.11Å; T136-I140 HydrophobicContact CG2-CG1 4.38Å; T136-I140 WeakPolarHBondContact O-CG1 3.4Å; T136-I140 PolarHBondContact O-N 2.97Å; T136-I140 VanDerWaalsContact O-N 3.07Å; T136-E203 WeakPolarHBondContact CB-OE2 3.16Å; T136-E203 HydrophobicContact CG2-CB 4.33Å; T136-E203 PolarHBondContact OG1-OE2 3.09Å
137A97.9Very high93.7Very high13 Ų1328 Ų2811%0.10716%0.156CC..Hα-helixtrans-56.2-36.817300000112.8L121 T125 S133 P134 V135 W139 I140 I141L121-A137 HydrophobicContact CD1-CB 4.25Å; L121-A137 HydrophobicContact CD2-CB 3.91Å; L121-A137 HydrophobicContact CG-CB 4.47Å; T125-A137 HydrophobicContact CG2-CB 3.88Å; S133-A137 PolarHBondContact O-N 2.93Å; S133-A137 VanDerWaalsContact O-N 3.16Å; P134-A137 WeakPolarHBondContact O-CB 3.45Å; V135-A137 PolarHBondContact O-N 3.35Å; A137-W139 VanDerWaalsContact C-N 3.32Å; A137-W139 PolarHBondContact O-N 3.07Å; A137-I140 PolarHBondContact O-N 2.84Å; A137-I141 WeakPolarHBondContact O-CG1 3.26Å; A137-I141 PolarHBondContact O-N 3.36Å
138L98Very high94.2Very high52 Ų5226 Ų2627%0.27213%0.134SC..Hα-helixtrans-63-38.3175.2-54.6178.5000111.9V135 T136 I141 A142 L145 L214 F217V135-L138 VanDerWaalsContact O-CB 3.26Å; V135-L138 WeakPolarHBondContact O-CB 3.47Å; V135-L138 PolarHBondContact O-N 3.18Å; T136-L138 PolarHBondContact O-N 3.28Å; L138-I141 CarbonylContact O-C 3.59Å; L138-A142 WeakPolarHBondContact O-CA 3.3Å; L138-A142 WeakPolarHBondContact O-CB 3.09Å; L138-A142 PolarHBondContact O-N 2.81Å; L138-L145 HydrophobicContact CD2-CD2 3.81Å; L138-L214 HydrophobicContact CD1-CD1 3.99Å; L138-F217 HydrophobicContact CB-CD1 4.33Å; L138-F217 HydrophobicContact CB-CD2 3.96Å; L138-F217 HydrophobicContact CB-CE1 4.14Å; L138-F217 HydrophobicContact CB-CE2 3.76Å; L138-F217 HydrophobicContact CB-CG 4.25Å; L138-F217 HydrophobicContact CB-CZ 3.86Å; L138-F217 HydrophobicContact CD1-CD1 4.11Å; L138-F217 HydrophobicContact CD1-CE1 4.22Å; L138-F217 VanDerWaalsContact O-CE2 3.27Å; L138-F217 WeakPolarHBondContact O-CE2 3.37Å
139W98.4Very high95.2Very high9 Ų918.3 Ų18.33%0.03411%0.105CC..Hα-helixtrans-68.7-36177.5-71.690.8000112.7T136 A137 I141 A142 L195 I198 M213 L216 F217T136-W139 WeakPolarHBondContact O-CA 3.38Å; T136-W139 WeakPolarHBondContact O-CB 3.27Å; T136-W139 PolarHBondContact O-N 3.04Å; A137-W139 VanDerWaalsContact C-N 3.32Å; A137-W139 PolarHBondContact O-N 3.07Å; W139-I141 PolarHBondContact O-N 3.35Å; W139-A142 WeakPolarHBondContact O-CB 3.34Å; W139-A142 PolarHBondContact O-N 3.36Å; W139-L195 HydrophobicContact CE3-CB 4.27Å; W139-L195 HydrophobicContact CE3-CD2 4.08Å; W139-L195 HydrophobicContact CZ3-CD2 3.67Å; W139-I198 HydrophobicContact CD2-CG2 4.4Å; W139-I198 HydrophobicContact CE3-CB 4.03Å; W139-I198 HydrophobicContact CE3-CG2 3.99Å; W139-I198 HydrophobicContact CH2-CG2 3.91Å; W139-I198 HydrophobicContact CZ2-CG2 4.32Å; W139-I198 HydrophobicContact CZ3-CB 3.98Å; W139-I198 HydrophobicContact CZ3-CD1 3.88Å; W139-I198 HydrophobicContact CZ3-CG2 3.73Å; W139-M213 HydrophobicContact CD2-CE 4.34Å; W139-M213 HydrophobicContact CG-CE 4.25Å; W139-M213 HydrophobicContact CZ2-CE 4.44Å; W139-M213 WeakPolarHBondContact CZ2-O 3.33Å; W139-M213 PolarHBondContact NE1-O 3.39Å; W139-L216 HydrophobicContact CH2-CB 4.09Å; W139-L216 HydrophobicContact CZ2-CB 3.71Å; W139-F217 HydrophobicContact CD2-CD2 4.13Å; W139-F217 HydrophobicContact CG-CD2 4.28Å; W139-F217 HydrophobicContact CZ2-CB 3.86Å; W139-F217 VanDerWaalsContact CZ2-N 3.3Å
140I98.6Very high95.8Very high4 Ų413.3 Ų13.32%0.0218%0.076CC..Hα-helixtrans-65.1-38.8179.4-69.3172.7000112.1S59 A62 I63 I66 L121 I132 T136 A137S59-I140 PolarHBondContact OG-O 2.87Å; A62-I140 HydrophobicContact CB-CG1 4.02Å; A62-I140 HydrophobicContact CB-CG2 4.29Å; I63-I140 HydrophobicContact CD1-CG2 4.03Å; I63-I140 HydrophobicContact CG1-CD1 3.9Å; I63-I140 HydrophobicContact CG1-CG2 3.77Å; I66-I140 HydrophobicContact CD1-CD1 4.04Å; L121-I140 HydrophobicContact CD2-CD1 4.02Å; L121-I140 HydrophobicContact CD2-CG2 4.49Å; I132-I140 HydrophobicContact CD1-CD1 4.3Å; I132-I140 HydrophobicContact CG2-CD1 4.16Å; T136-I140 HydrophobicContact CG2-CD1 4.11Å; T136-I140 HydrophobicContact CG2-CG1 4.38Å; T136-I140 WeakPolarHBondContact O-CG1 3.4Å; T136-I140 PolarHBondContact O-N 2.97Å; T136-I140 VanDerWaalsContact O-N 3.07Å; A137-I140 PolarHBondContact O-N 2.84Å
141I98.2Very high95.9Very high11 Ų1111.4 Ų11.46%0.0567%0.067CC..THydrogen-bonded Turntrans-108.723.6178.765.1166.9000112.6F42 V117 L121 A137 L138 W139 I143 P144 L145F42-I141 HydrophobicContact CE2-CB 4.35Å; F42-I141 HydrophobicContact CE2-CG2 3.87Å; F42-I141 HydrophobicContact CZ-CG2 3.98Å; V117-I141 HydrophobicContact CG1-CG2 3.6Å; L121-I141 HydrophobicContact CD1-CG2 3.96Å; A137-I141 WeakPolarHBondContact O-CG1 3.26Å; A137-I141 PolarHBondContact O-N 3.36Å; L138-I141 CarbonylContact O-C 3.59Å; W139-I141 PolarHBondContact O-N 3.35Å; I141-I143 PolarHBondContact O-N 2.89Å; I141-P144 VanDerWaalsContact O-CD 3.3Å; I141-P144 WeakPolarHBondContact O-CD 3.48Å; I141-L145 HydrophobicContact CG1-CB 4.41Å; I141-L145 VanDerWaalsContact O-CB 3.26Å; I141-L145 WeakPolarHBondContact O-CB 3.33Å; I141-L145 PolarHBondContact O-N 2.79Å
142A98.3Very high95.9Very high1 Ų112.3 Ų12.31%0.0087%0.071CC..Hα-helixtrans-54.7-49.9-168.200000113.3L138 W139 L145 M146 L195 F217L138-A142 WeakPolarHBondContact O-CA 3.3Å; L138-A142 WeakPolarHBondContact O-CB 3.09Å; L138-A142 PolarHBondContact O-N 2.81Å; W139-A142 WeakPolarHBondContact O-CB 3.34Å; W139-A142 PolarHBondContact O-N 3.36Å; A142-L145 PolarHBondContact O-N 3.29Å; A142-M146 HydrophobicContact CB-CE 3.44Å; A142-M146 VanDerWaalsContact CB-CE 3.44Å; A142-M146 WeakPolarHBondContact O-CB 3.49Å; A142-M146 WeakPolarHBondContact O-CE 3.43Å; A142-M146 WeakPolarHBondContact O-CG 3.38Å; A142-M146 PolarHBondContact O-N 2.89Å; A142-L195 HydrophobicContact CB-CB 4.06Å; A142-L195 HydrophobicContact CB-CD1 3.97Å; A142-F217 HydrophobicContact CB-CE2 3.97Å
143I97.6Very high95.7Very high5 Ų518.3 Ų18.33%0.02610%0.095CC..Hα-helixtrans-66.7-52.5-177.5-67.6-62.1000112.4L55 I141 L145 M146 D147 I188 A192 L195 Y224L55-I143 HydrophobicContact CD1-CG2 4.32Å; L55-I143 HydrophobicContact CD2-CB 4.4Å; L55-I143 HydrophobicContact CD2-CG2 4.23Å; I141-I143 PolarHBondContact O-N 2.89Å; I143-L145 VanDerWaalsContact C-N 3.31Å; I143-L145 PolarHBondContact O-N 3.27Å; I143-M146 PolarHBondContact O-N 3.36Å; I143-D147 WeakPolarHBondContact O-CB 3.41Å; I143-D147 PolarHBondContact O-N 2.95Å; I143-I188 HydrophobicContact CG2-CG2 3.68Å; I143-A192 HydrophobicContact CB-CB 4.13Å; I143-A192 HydrophobicContact CG1-CB 3.71Å; I143-L195 HydrophobicContact CD1-CD1 3.57Å; I143-L195 HydrophobicContact CG1-CD1 3.88Å; I143-Y224 HydrophobicContact CD1-CD2 4.41Å; I143-Y224 HydrophobicContact CD1-CE2 4.15Å
144P97.5Very high95.3Very high2 Ų220 Ų201%0.01310%0.1CC..Hα-helixtrans-52-48.4172.8-2731.8000113A41 F42 V45 L55 I141 M148A41-P144 HydrophobicContact CB-CB 3.91Å; F42-P144 HydrophobicContact CE1-CG 4.33Å; F42-P144 HydrophobicContact CE2-CG 4.5Å; F42-P144 HydrophobicContact CZ-CG 4.25Å; V45-P144 HydrophobicContact CG1-CB 4.32Å; L55-P144 HydrophobicContact CD1-CG 4.22Å; I141-P144 VanDerWaalsContact O-CD 3.3Å; I141-P144 WeakPolarHBondContact O-CD 3.48Å; P144-M148 WeakPolarHBondContact O-CB 3.36Å; P144-M148 PolarHBondContact O-N 3.43Å
145L97.4Very high94.9Very high30 Ų3019.7 Ų19.716%0.15710%0.097CC..Hα-helixtrans-64.6-48.5-177.3-177.362.2000111.7L138 I141 A142 I143 M148 V149 F217L138-L145 HydrophobicContact CD2-CD2 3.81Å; I141-L145 HydrophobicContact CG1-CB 4.41Å; I141-L145 VanDerWaalsContact O-CB 3.26Å; I141-L145 WeakPolarHBondContact O-CB 3.33Å; I141-L145 PolarHBondContact O-N 2.79Å; A142-L145 PolarHBondContact O-N 3.29Å; I143-L145 VanDerWaalsContact C-N 3.31Å; I143-L145 PolarHBondContact O-N 3.27Å; L145-M148 HydrophobicContact CD1-CE 4.13Å; L145-M148 PolarHBondContact O-N 3.5Å; L145-V149 HydrophobicContact CD1-CG2 4.21Å; L145-V149 VanDerWaalsContact O-CG2 3.29Å; L145-V149 WeakPolarHBondContact O-CG2 3.38Å; L145-V149 PolarHBondContact O-N 3.31Å; L145-F217 HydrophobicContact CD2-CZ 4.11Å
146M97Very high94.6Very high2 Ų224.6 Ų24.61%0.0112%0.123CC..Hα-helixtrans-60.7-46.8178.3-78.9-172.3-113.100112.5A142 I143 A150 L195 F217 F221 Y224A142-M146 HydrophobicContact CB-CE 3.44Å; A142-M146 VanDerWaalsContact CB-CE 3.44Å; A142-M146 WeakPolarHBondContact O-CB 3.49Å; A142-M146 WeakPolarHBondContact O-CE 3.43Å; A142-M146 WeakPolarHBondContact O-CG 3.38Å; A142-M146 PolarHBondContact O-N 2.89Å; I143-M146 PolarHBondContact O-N 3.36Å; M146-A150 WeakPolarHBondContact O-CB 3.02Å; M146-A150 PolarHBondContact O-N 3.41Å; M146-L195 HydrophobicContact CE-CD1 3.72Å; M146-F217 HydrophobicContact CE-CE2 4.09Å; M146-F217 HydrophobicContact CG-CZ 4.49Å; M146-F221 HydrophobicContact CB-CD2 4.32Å; M146-F221 HydrophobicContact CG-CB 4.41Å; M146-F221 HydrophobicContact CG-CD2 3.62Å; M146-F221 HydrophobicContact CG-CE2 4.28Å; M146-F221 HydrophobicContact CG-CG 4.42Å; M146-F221 HydrophobicContact SD-CB 4.36Å; M146-Y224 HydrophobicContact CB-CD1 3.87Å; M146-Y224 HydrophobicContact CB-CD2 4.49Å; M146-Y224 HydrophobicContact CB-CE1 3.92Å; M146-Y224 HydrophobicContact CB-CG 4.18Å; M146-Y224 HydrophobicContact SD-CD1 4.43Å; M146-Y224 HydrophobicContact SD-CD2 4.21Å; M146-Y224 HydrophobicContact SD-CG 3.9Å
147D95Very high94.1Very high0 Ų033.3 Ų33.30%016%0.156CC..Hα-helixtrans-62.5-48-179.6-166.660.6000110.1V45 I143 A150 I151 H169 I170 Y224V45-D147 HydrophobicContact CG1-CB 4.33Å; I143-D147 WeakPolarHBondContact O-CB 3.41Å; I143-D147 PolarHBondContact O-N 2.95Å; D147-A150 PolarHBondContact O-N 3.33Å; D147-I151 WeakPolarHBondContact O-CB 3.47Å; D147-I151 WeakPolarHBondContact O-CD1 3.41Å; D147-I151 WeakPolarHBondContact O-CG1 3.23Å; D147-I151 PolarHBondContact O-N 3.01Å; D147-I151 WeakPolarHBondContact OD2-CD1 3.3Å; D147-H169 IonicContact OD2-CE1 2.69Å; D147-H169 IonicContact OD2-CG 3.57Å; D147-H169 IonicContact OD2-ND1 3.54Å; D147-H169 PolarHBondContact OD2-ND1 3.08Å; D147-I170 PolarHBondContact OD1-N 2.89Å; D147-Y224 WeakPolarHBondContact CA-OH 3.46Å; D147-Y224 WeakPolarHBondContact CB-OH 3.34Å; D147-Y224 PolarHBondContact OD1-OH 3.45Å
148M94.6Very high93.6Very high5 Ų538.1 Ų38.13%0.02517%0.174CC..Hα-helixtrans-56.8-55.4177.5-178.6-168.67300111.7A37 N40 A41 M44 P144 L145 A150 I151 M152A37-M148 HydrophobicContact CB-CE 3.91Å; N40-M148 HydrophobicContact CB-SD 3.88Å; A41-M148 HydrophobicContact CB-CB 4.04Å; A41-M148 HydrophobicContact CB-CE 4.37Å; A41-M148 HydrophobicContact CB-CG 4.48Å; A41-M148 HydrophobicContact CB-SD 3.79Å; A41-M148 PolarHBondContact N-SD 3.48Å; A41-M148 VanDerWaalsContact N-SD 3.42Å; M44-M148 HydrophobicContact CE-CG 4.47Å; M44-M148 HydrophobicContact SD-CB 4.36Å; M44-M148 HydrophobicContact SD-CG 3.7Å; P144-M148 WeakPolarHBondContact O-CB 3.36Å; P144-M148 PolarHBondContact O-N 3.43Å; L145-M148 HydrophobicContact CD1-CE 4.13Å; L145-M148 PolarHBondContact O-N 3.5Å; M148-A150 PolarHBondContact O-N 2.99Å; M148-I151 PolarHBondContact O-N 2.74Å; M148-M152 HydrophobicContact CE-SD 4.45Å; M148-M152 HydrophobicContact CG-CG 4.33Å; M148-M152 HydrophobicContact CG-SD 3.72Å; M148-M152 WeakPolarHBondContact O-CB 3.49Å; M148-M152 VanDerWaalsContact O-CG 3.32Å; M148-M152 WeakPolarHBondContact O-CG 3.14Å; M148-M152 PolarHBondContact O-N 3.31Å; M148-M152 HydrophobicContact SD-SD 4.18Å
149V93.9Very high93.1Very high55 Ų5539.2 Ų39.233%0.33320%0.198SC..Hα-helixtrans-62.9-43.6-176.8176.60000110.9L145 I151 M152 Y153 F221L145-V149 HydrophobicContact CD1-CG2 4.21Å; L145-V149 VanDerWaalsContact O-CG2 3.29Å; L145-V149 WeakPolarHBondContact O-CG2 3.38Å; L145-V149 PolarHBondContact O-N 3.31Å; V149-I151 VanDerWaalsContact C-N 3.28Å; V149-I151 PolarHBondContact O-N 3.19Å; V149-M152 PolarHBondContact O-N 2.89Å; V149-Y153 WeakPolarHBondContact O-CB 3.13Å; V149-Y153 PolarHBondContact O-N 3.46Å; V149-F221 HydrophobicContact CB-CE2 3.88Å; V149-F221 HydrophobicContact CB-CZ 4.1Å; V149-F221 HydrophobicContact CG1-CE2 3.83Å; V149-F221 HydrophobicContact CG1-CZ 3.6Å
150A92.2Very high92.5Very high16 Ų1642.2 Ų42.213%0.13221%0.213CC..Hα-helixtrans-61.3-37.4179.200000112.4M146 D147 M148 R154 Y224 I228M146-A150 WeakPolarHBondContact O-CB 3.02Å; M146-A150 PolarHBondContact O-N 3.41Å; D147-A150 PolarHBondContact O-N 3.33Å; M148-A150 PolarHBondContact O-N 2.99Å; A150-R154 VanDerWaalsContact O-CB 3.3Å; A150-R154 WeakPolarHBondContact O-CB 3.42Å; A150-R154 PolarHBondContact O-N 3.27Å; A150-R154 VanDerWaalsContact O-N 3.12Å; A150-Y224 HydrophobicContact CB-CE1 4.21Å; A150-I228 HydrophobicContact CB-CD1 4.46Å
151I90Very high91.7Very high0 Ų045.1 Ų45.10%023%0.234CC..Hα-helixtrans-74.4-48.8179.1-67.2171.7000111.1M44 D147 M148 V149 Y153 R154 R155 H169M44-I151 HydrophobicContact CE-CB 4Å; M44-I151 HydrophobicContact CE-CD1 4.19Å; M44-I151 HydrophobicContact CE-CG2 3.7Å; D147-I151 WeakPolarHBondContact O-CB 3.47Å; D147-I151 WeakPolarHBondContact O-CD1 3.41Å; D147-I151 WeakPolarHBondContact O-CG1 3.23Å; D147-I151 PolarHBondContact O-N 3.01Å; D147-I151 WeakPolarHBondContact OD2-CD1 3.3Å; M148-I151 PolarHBondContact O-N 2.74Å; V149-I151 VanDerWaalsContact C-N 3.28Å; V149-I151 PolarHBondContact O-N 3.19Å; I151-Y153 VanDerWaalsContact C-N 3.31Å; I151-Y153 PolarHBondContact O-N 3.09Å; I151-R154 PolarHBondContact O-N 3.3Å; I151-R154 VanDerWaalsContact O-N 3.16Å; I151-R155 HydrophobicContact CG2-CG 4.34Å; I151-R155 VanDerWaalsContact CG2-CZ 3.43Å; I151-R155 VanDerWaalsContact O-CG 3.32Å; I151-R155 WeakPolarHBondContact O-CG 3.46Å; I151-R155 PolarHBondContact O-N 3Å; I151-H169 HydrophobicContact CD1-CB 4.06Å; I151-H169 WeakPolarHBondContact CD1-CE1 3.11Å; I151-H169 VanDerWaalsContact CD1-CG 3.41Å; I151-H169 WeakPolarHBondContact CD1-ND1 3.5Å
152M90.8Very high90.6Very high30 Ų3046 Ų4615%0.14824%0.24CC..Hα-helixtrans-57.9-46177.2-70179.576.900110.8W36 M148 V149 R154 R155 L156 P162W36-M152 HydrophobicContact CH2-CE 3.62Å; W36-M152 HydrophobicContact CZ2-CE 4.3Å; M148-M152 HydrophobicContact CE-SD 4.45Å; M148-M152 HydrophobicContact CG-CG 4.33Å; M148-M152 HydrophobicContact CG-SD 3.72Å; M148-M152 WeakPolarHBondContact O-CB 3.49Å; M148-M152 VanDerWaalsContact O-CG 3.32Å; M148-M152 WeakPolarHBondContact O-CG 3.14Å; M148-M152 PolarHBondContact O-N 3.31Å; M148-M152 HydrophobicContact SD-SD 4.18Å; V149-M152 PolarHBondContact O-N 2.89Å; M152-R154 VanDerWaalsContact C-N 3.34Å; M152-R154 PolarHBondContact O-N 2.99Å; M152-R155 WeakPolarHBondContact O-CB 3.3Å; M152-R155 PolarHBondContact O-N 3.36Å; M152-R155 VanDerWaalsContact O-N 3.16Å; M152-L156 WeakPolarHBondContact O-CG 3.37Å; M152-L156 PolarHBondContact O-N 3.19Å; M152-P162 HydrophobicContact CE-CB 3.84Å; M152-P162 HydrophobicContact CG-CB 4.43Å
153Y90.4Very high89.4Confident127 Ų12752.2 Ų52.250%0.49827%0.267SS..Hα-helixtrans-57.9-44.8175.7-177.1-108.9000112.7V149 I151 L156 R157V149-Y153 WeakPolarHBondContact O-CB 3.13Å; V149-Y153 PolarHBondContact O-N 3.46Å; I151-Y153 VanDerWaalsContact C-N 3.31Å; I151-Y153 PolarHBondContact O-N 3.09Å; Y153-L156 PolarHBondContact O-N 3.28Å; Y153-R157 HydrophobicContact CE1-CG 4.3Å; Y153-R157 PolarHBondContact O-N 3.21Å; Y153-R157 PolarHBondContact OH-NE 2.85Å; Y153-R157 PolarHBondContact OH-NH2 2.98Å
154R87Confident88.1Confident38 Ų3853.5 Ų53.514%0.14328%0.277CS..Hα-helixtrans-65.4-37.7177.1-177.6-175.965.3-133.4-4.4112.2A150 I151 M152 K158 D166 Q168A150-R154 VanDerWaalsContact O-CB 3.3Å; A150-R154 WeakPolarHBondContact O-CB 3.42Å; A150-R154 PolarHBondContact O-N 3.27Å; A150-R154 VanDerWaalsContact O-N 3.12Å; I151-R154 PolarHBondContact O-N 3.3Å; I151-R154 VanDerWaalsContact O-N 3.16Å; M152-R154 VanDerWaalsContact C-N 3.34Å; M152-R154 PolarHBondContact O-N 2.99Å; R154-K158 WeakPolarHBondContact O-CG 3.17Å; R154-K158 PolarHBondContact O-N 2.79Å; R154-D166 IonicContact CZ-OD2 3.98Å; R154-D166 IonicContact NE-OD2 3.85Å; R154-D166 IonicContact NH2-OD2 2.69Å; R154-D166 PolarHBondContact NH2-OD2 3.29Å; R154-Q168 VanDerWaalsContact CD-OE1 3.26Å; R154-Q168 VanDerWaalsContact CZ-OE1 3.23Å; R154-Q168 PolarHBondContact NH1-O 3.28Å; R154-Q168 VanDerWaalsContact NH1-O 3.14Å; R154-Q168 PolarHBondContact NH2-O 3.29Å
155R87Confident86.6Confident10 Ų1059.8 Ų59.84%0.03832%0.317CS..Hα-helixtrans-64.2-49.1176.7-72.3174.4-178.7167.40.6110.4I151 M152 R157 K158 G159 M160 P162 S164 D166I151-R155 HydrophobicContact CG2-CG 4.34Å; I151-R155 VanDerWaalsContact CG2-CZ 3.43Å; I151-R155 VanDerWaalsContact O-CG 3.32Å; I151-R155 WeakPolarHBondContact O-CG 3.46Å; I151-R155 PolarHBondContact O-N 3Å; M152-R155 WeakPolarHBondContact O-CB 3.3Å; M152-R155 PolarHBondContact O-N 3.36Å; M152-R155 VanDerWaalsContact O-N 3.16Å; R155-R157 VanDerWaalsContact C-N 3.35Å; R155-R157 PolarHBondContact O-N 2.59Å; R155-K158 CarbonylContact O-C 3.56Å; R155-K158 WeakPolarHBondContact O-CA 3.08Å; R155-K158 PolarHBondContact O-N 3.45Å; R155-G159 PolarHBondContact O-N 3.44Å; R155-M160 CarbonylContact C-O 3.51Å; R155-M160 HydrophobicContact CB-CB 4.42Å; R155-M160 HydrophobicContact CB-CE 4.32Å; R155-M160 HydrophobicContact CG-CE 4.02Å; R155-M160 PolarHBondContact O-N 2.85Å; R155-P162 WeakPolarHBondContact CD-O 3.33Å; R155-P162 PolarHBondContact NH1-O 2.88Å; R155-S164 PolarHBondContact NE-O 3.35Å; R155-S164 VanDerWaalsContact NE-O 3.12Å; R155-S164 PolarHBondContact NH1-O 2.97Å; R155-S164 PolarHBondContact NH2-O 3.06Å; R155-D166 IonicContact NE-OD2 2.78Å
156L88.9Confident85.3Confident105 Ų10559.8 Ų59.855%0.5532%0.318SS..Hα-helixtrans-58.6-44176.8-68.7172.2000112M152 Y153 K158 G159 P162M152-L156 WeakPolarHBondContact O-CG 3.37Å; M152-L156 PolarHBondContact O-N 3.19Å; Y153-L156 PolarHBondContact O-N 3.28Å; L156-K158 PolarHBondContact O-N 2.85Å; L156-K158 VanDerWaalsContact O-N 3.15Å; L156-G159 PolarHBondContact O-N 3.41Å; L156-P162 HydrophobicContact CD2-CB 4.46Å; L156-P162 HydrophobicContact CD2-CG 4.3Å
157R88.4Confident84Confident185 Ų18568.3 Ų68.370%0.69835%0.35SS*.THydrogen-bonded Turntrans-62.9-18.5174.9-81.4-169.7168.1-137.64114.8Y153 R155Y153-R157 HydrophobicContact CE1-CG 4.3Å; Y153-R157 PolarHBondContact O-N 3.21Å; Y153-R157 PolarHBondContact OH-NE 2.85Å; Y153-R157 PolarHBondContact OH-NH2 2.98Å; R155-R157 VanDerWaalsContact C-N 3.35Å; R155-R157 PolarHBondContact O-N 2.59Å
158K87.3Confident83.2Confident114 Ų11471 Ų7150%0.49636%0.362SS..THydrogen-bonded Turntrans-98.36.5175.5-69.9178.3179.6179.70112.6R154 R155 L156 M160R154-K158 WeakPolarHBondContact O-CG 3.17Å; R154-K158 PolarHBondContact O-N 2.79Å; R155-K158 CarbonylContact O-C 3.56Å; R155-K158 WeakPolarHBondContact O-CA 3.08Å; R155-K158 PolarHBondContact O-N 3.45Å; L156-K158 PolarHBondContact O-N 2.85Å; L156-K158 VanDerWaalsContact O-N 3.15Å; K158-M160 HydrophobicContact CB-CE 4.12Å; K158-M160 HydrophobicContact CB-CG 4.03Å; K158-M160 HydrophobicContact CB-SD 4.39Å; K158-M160 HydrophobicContact CD-CE 3.83Å; K158-M160 PolarHBondContact O-N 3.44Å
159G87.4Confident82.7Confident75 Ų7571.4 Ų71.477%0.77336%0.364SS*.THydrogen-bonded Turntrans6617.3-174.500000113.5R155 L156R155-G159 PolarHBondContact O-N 3.44Å; L156-G159 PolarHBondContact O-N 3.41Å
160M84.2Confident82.4Confident72 Ų7270.1 Ų70.136%0.35536%0.355SS..  trans-92.4151.1177.4-58.2-174.6-47.700109.9R155 K158R155-M160 CarbonylContact C-O 3.51Å; R155-M160 HydrophobicContact CB-CB 4.42Å; R155-M160 HydrophobicContact CB-CE 4.32Å; R155-M160 HydrophobicContact CG-CE 4.02Å; R155-M160 PolarHBondContact O-N 2.85Å; K158-M160 HydrophobicContact CB-CE 4.12Å; K158-M160 HydrophobicContact CB-CG 4.03Å; K158-M160 HydrophobicContact CB-SD 4.39Å; K158-M160 HydrophobicContact CD-CE 3.83Å; K158-M160 PolarHBondContact O-N 3.44Å
161S82.7Confident82.1Confident65 Ų6569.4 Ų69.446%0.45535%0.349SS..  trans-56136.6171.9172.50000110.5F163 S164S161-F163 PolarHBondContact O-N 2.99Å; S161-F163 VanDerWaalsContact O-N 3.08Å; S161-F163 PolarHBondContact OG-N 3.48Å; S161-S164 PolarHBondContact O-N 3.42Å; S161-S164 PolarHBondContact O-OG 3.08Å
162P74.8Confident81.9Confident29 Ų2971.8 Ų71.819%0.18836%0.36CS..THydrogen-bonded Turntrans-59.6-19.5175.121.6-30.2000113.1M152 R155 L156M152-P162 HydrophobicContact CE-CB 3.84Å; M152-P162 HydrophobicContact CG-CB 4.43Å; R155-P162 WeakPolarHBondContact CD-O 3.33Å; R155-P162 PolarHBondContact NH1-O 2.88Å; L156-P162 HydrophobicContact CD2-CB 4.46Å; L156-P162 HydrophobicContact CD2-CG 4.3Å
163F73.1Confident81.8Confident131 Ų13171.4 Ų71.458%0.57536%0.358SS*.THydrogen-bonded Turntrans-98.8-1.2-177.9-53.8-73.4000114.4W36 S161W36-F163 AromaticContact CZ2-CE1 3.82Å; W36-F163 HydrophobicContact CZ2-CE1 3.82Å; W36-F163 AromaticContact CZ2-CZ 3.82Å; W36-F163 HydrophobicContact CZ2-CZ 3.82Å; S161-F163 PolarHBondContact O-N 2.99Å; S161-F163 VanDerWaalsContact O-N 3.08Å; S161-F163 PolarHBondContact OG-N 3.48Å
164S69.5Low81.6Confident33 Ų3367 Ų6723%0.23134%0.343CS..SBendtrans-67.8140.7178.362.80000111.3R155 S161 D166R155-S164 PolarHBondContact NE-O 3.35Å; R155-S164 VanDerWaalsContact NE-O 3.12Å; R155-S164 PolarHBondContact NH1-O 2.97Å; R155-S164 PolarHBondContact NH2-O 3.06Å; S161-S164 PolarHBondContact O-N 3.42Å; S161-S164 PolarHBondContact O-OG 3.08Å; S164-D166 PolarHBondContact O-N 3.21Å
165P67.1Low81.7Confident133 Ų13367.8 Ų67.886%0.86435%0.349SS*.  trans-55.6138.5176.5-22.231.2000112.1
166D69Low81.7Confident31 Ų3172.2 Ų72.217%0.16637%0.366CS..  trans-137.5147.5177-162-9.3000110.9R154 R155 S164 Q168 H169R154-D166 IonicContact CZ-OD2 3.98Å; R154-D166 IonicContact NE-OD2 3.85Å; R154-D166 IonicContact NH2-OD2 2.69Å; R154-D166 PolarHBondContact NH2-OD2 3.29Å; R155-D166 IonicContact NE-OD2 2.78Å; S164-D166 PolarHBondContact O-N 3.21Å; D166-Q168 WeakPolarHBondContact OD1-CB 3.32Å; D166-Q168 WeakPolarHBondContact OD1-CG 3.48Å; D166-Q168 PolarHBondContact OD1-N 2.95Å; D166-H169 PolarHBondContact O-CD2 3.47Å
167R70.1Confident81.5Confident181 Ų18167.8 Ų67.868%0.68334%0.344SS*.SBendtrans-106.935-180-63.5-172-179.8-1730.4111.9H172 R176R167-H172 WeakPolarHBondContact O-CB 3.45Å; R167-R176 VanDerWaalsContact O-CZ 3.28Å; R167-R176 PolarHBondContact O-NH1 2.88Å; R167-R176 PolarHBondContact O-NH2 2.9Å; R167-R176 VanDerWaalsContact O-NH2 3.16Å
168Q77.9Confident81.4Confident55 Ų5560.9 Ų60.926%0.25733%0.331SS..  trans-129.822.9-172-68.8-169.24.500112.4R154 D166R154-Q168 VanDerWaalsContact CD-OE1 3.26Å; R154-Q168 VanDerWaalsContact CZ-OE1 3.23Å; R154-Q168 PolarHBondContact NH1-O 3.28Å; R154-Q168 VanDerWaalsContact NH1-O 3.14Å; R154-Q168 PolarHBondContact NH2-O 3.29Å; D166-Q168 WeakPolarHBondContact OD1-CB 3.32Å; D166-Q168 WeakPolarHBondContact OD1-CG 3.48Å; D166-Q168 PolarHBondContact OD1-N 2.95Å
169H85.4Confident81.5Confident15 Ų1559.6 Ų59.67%0.06933%0.325CS..SBendtrans-62.5155.1161.1-66.5-92.3000111.1M44 D147 I151 D166 H171 H172 L173M44-H169 PolarHBondContact O-CE1 3.38Å; M44-H169 PolarHBondContact O-ND1 3.5Å; D147-H169 IonicContact OD2-CE1 2.69Å; D147-H169 IonicContact OD2-CG 3.57Å; D147-H169 IonicContact OD2-ND1 3.54Å; D147-H169 PolarHBondContact OD2-ND1 3.08Å; I151-H169 HydrophobicContact CD1-CB 4.06Å; I151-H169 WeakPolarHBondContact CD1-CE1 3.11Å; I151-H169 VanDerWaalsContact CD1-CG 3.41Å; I151-H169 WeakPolarHBondContact CD1-ND1 3.5Å; D166-H169 PolarHBondContact O-CD2 3.47Å; H169-H171 WeakPolarHBondContact CB-CE1 3.48Å; H169-H171 AromaticContact CG-CE1 3.69Å; H169-H171 PolarHBondContact O-N 2.92Å; H169-H172 PolarHBondContact O-N 3.23Å; H169-L173 WeakPolarHBondContact O-CG 3.45Å; H169-L173 PolarHBondContact O-N 3.3Å
170I86.7Confident81.8Confident27 Ų2759.6 Ų59.614%0.13831%0.311CS..Hα-helixtrans-51.1-42179.4-175.9165.3000113D147 H172 L173 I174 I188 Y224D147-I170 PolarHBondContact OD1-N 2.89Å; I170-H172 PolarHBondContact O-N 3.46Å; I170-L173 PolarHBondContact O-N 2.94Å; I170-L173 VanDerWaalsContact O-N 3.15Å; I170-I174 HydrophobicContact CD1-CD1 4.37Å; I170-I174 HydrophobicContact CG1-CD1 3.81Å; I170-I174 HydrophobicContact CG1-CG1 4.31Å; I170-I174 WeakPolarHBondContact O-CG1 3.33Å; I170-I174 PolarHBondContact O-N 2.81Å; I170-I188 HydrophobicContact CD1-CG1 4.38Å; I170-I188 HydrophobicContact CG1-CD1 4.43Å; I170-I188 HydrophobicContact CG1-CG1 4.3Å; I170-I188 HydrophobicContact CG2-CD1 3.95Å; I170-I188 HydrophobicContact CG2-CG1 4.33Å; I170-Y224 WeakPolarHBondContact CB-OH 3.43Å; I170-Y224 HydrophobicContact CD1-CD2 4.47Å; I170-Y224 HydrophobicContact CD1-CE2 3.54Å
171H85.9Confident82.3Confident2 Ų257.8 Ų57.81%0.00931%0.305CS..Hα-helixtrans-63.1-4017959.7-102.4000112.4I48 L51 H169 L173 I174 M175 I188I48-H171 HydrophobicContact CD1-CB 3.8Å; I48-H171 HydrophobicContact CG1-CB 3.99Å; I48-H171 HydrophobicContact CG2-CB 4.22Å; L51-H171 HydrophobicContact CD2-CB 4Å; H169-H171 WeakPolarHBondContact CB-CE1 3.48Å; H169-H171 AromaticContact CG-CE1 3.69Å; H169-H171 PolarHBondContact O-N 2.92Å; H171-L173 VanDerWaalsContact C-N 3.35Å; H171-L173 PolarHBondContact O-N 3.35Å; H171-I174 PolarHBondContact O-N 3.23Å; H171-M175 WeakPolarHBondContact O-CB 3.3Å; H171-M175 WeakPolarHBondContact O-CG 3.31Å; H171-M175 PolarHBondContact O-N 2.89Å; H171-I188 HydrophobicContact CB-CD1 3.64Å
172H87.3Confident82.8Confident50 Ų5061.8 Ų61.823%0.23131%0.31CS..Hα-helixtrans-67.6-35.9175-72.5-45.4000112.3R167 H169 I170 R176R167-H172 WeakPolarHBondContact O-CB 3.45Å; H169-H172 PolarHBondContact O-N 3.23Å; I170-H172 PolarHBondContact O-N 3.46Å; H172-R176 WeakPolarHBondContact O-CB 3.27Å; H172-R176 WeakPolarHBondContact O-CG 3.35Å; H172-R176 PolarHBondContact O-N 3.47Å
173L87.2Confident83.8Confident21 Ų2164.7 Ų64.711%0.1132%0.321CS..Hα-helixtrans-67.1-43.9177.6-65172.1000111.5H169 I170 H171 R176 A177 I228 A231H169-L173 WeakPolarHBondContact O-CG 3.45Å; H169-L173 PolarHBondContact O-N 3.3Å; I170-L173 PolarHBondContact O-N 2.94Å; I170-L173 VanDerWaalsContact O-N 3.15Å; H171-L173 VanDerWaalsContact C-N 3.35Å; H171-L173 PolarHBondContact O-N 3.35Å; L173-R176 PolarHBondContact O-N 3.48Å; L173-A177 PolarHBondContact O-N 3.45Å; L173-A177 VanDerWaalsContact O-N 3.08Å; L173-I228 HydrophobicContact CD1-CB 4.15Å; L173-I228 HydrophobicContact CD1-CD1 4.43Å; L173-I228 HydrophobicContact CD1-CG1 3.95Å; L173-I228 HydrophobicContact CD1-CG2 3.76Å; L173-A231 HydrophobicContact CB-CB 4.19Å; L173-A231 HydrophobicContact CD1-CB 4.32Å
174I86.6Confident84.9Confident34 Ų3458.5 Ų58.517%0.17429%0.294CS..Hα-helixtrans-62.5-46.4175.7-67.4171.5000110.3I170 H171 R176 A177 F179 A184 L187 I188I170-I174 HydrophobicContact CD1-CD1 4.37Å; I170-I174 HydrophobicContact CG1-CD1 3.81Å; I170-I174 HydrophobicContact CG1-CG1 4.31Å; I170-I174 WeakPolarHBondContact O-CG1 3.33Å; I170-I174 PolarHBondContact O-N 2.81Å; H171-I174 PolarHBondContact O-N 3.23Å; I174-R176 VanDerWaalsContact C-N 3.34Å; I174-R176 PolarHBondContact O-N 3.34Å; I174-A177 WeakPolarHBondContact O-CB 3.35Å; I174-A177 PolarHBondContact O-N 3.2Å; I174-A177 VanDerWaalsContact O-N 3.08Å; I174-F179 HydrophobicContact CG2-CB 3.69Å; I174-F179 HydrophobicContact CG2-CD2 3.81Å; I174-F179 HydrophobicContact CG2-CG 3.84Å; I174-F179 WeakPolarHBondContact O-CD2 3.32Å; I174-A184 HydrophobicContact CB-CB 4.1Å; I174-A184 HydrophobicContact CG2-CB 3.69Å; I174-L187 HydrophobicContact CG2-CD1 4.3Å; I174-I188 HydrophobicContact CD1-CD1 4Å; I174-I188 HydrophobicContact CD1-CG1 3.65Å
175M89.3Confident86.2Confident55 Ų5558.3 Ų58.327%0.27129%0.289SS..Hα-helixtrans-63.6-37.5177-70.8-170.6-64.200112.8I48 H171 A177 G178 F179 A184I48-M175 HydrophobicContact CG2-CE 3.52Å; I48-M175 HydrophobicContact CG2-SD 4.04Å; H171-M175 WeakPolarHBondContact O-CB 3.3Å; H171-M175 WeakPolarHBondContact O-CG 3.31Å; H171-M175 PolarHBondContact O-N 2.89Å; M175-A177 PolarHBondContact O-N 3.07Å; M175-G178 WeakPolarHBondContact O-CA 3.19Å; M175-G178 PolarHBondContact O-N 3.48Å; M175-F179 WeakPolarHBondContact CA-O 3.37Å; M175-A184 HydrophobicContact CG-CB 4.15Å
176R86.6Confident87.6Confident104 Ų10455.3 Ų55.339%0.39227%0.268SS..Hα-helixtrans-65.5-25.9174.5-76.5172.7-178.4-175.42.5113.2R167 H172 L173 I174 G178 K239R167-R176 VanDerWaalsContact O-CZ 3.28Å; R167-R176 PolarHBondContact O-NH1 2.88Å; R167-R176 PolarHBondContact O-NH2 2.9Å; R167-R176 VanDerWaalsContact O-NH2 3.16Å; H172-R176 WeakPolarHBondContact O-CB 3.27Å; H172-R176 WeakPolarHBondContact O-CG 3.35Å; H172-R176 PolarHBondContact O-N 3.47Å; L173-R176 PolarHBondContact O-N 3.48Å; I174-R176 VanDerWaalsContact C-N 3.34Å; I174-R176 PolarHBondContact O-N 3.34Å; R176-G178 PolarHBondContact O-N 2.89Å; R176-K239 VanDerWaalsContact O-CE 3.26Å; R176-K239 WeakPolarHBondContact O-CE 3.04Å; R176-K239 PolarHBondContact O-NZ 3.25Å
177A84.1Confident88.9Confident11 Ų1157.7 Ų57.79%0.09128%0.281CS..THydrogen-bonded Turntrans-72-8.3170.300000113.3L173 I174 M175 F179 A235L173-A177 PolarHBondContact O-N 3.45Å; L173-A177 VanDerWaalsContact O-N 3.08Å; I174-A177 WeakPolarHBondContact O-CB 3.35Å; I174-A177 PolarHBondContact O-N 3.2Å; I174-A177 VanDerWaalsContact O-N 3.08Å; M175-A177 PolarHBondContact O-N 3.07Å; A177-F179 HydrophobicContact CB-CD2 4.14Å; A177-F179 HydrophobicContact CB-CE2 4.31Å; A177-A235 HydrophobicContact CB-CB 3.79Å
178G87.3Confident90.2Very high41 Ų4149.2 Ų49.242%0.42325%0.249SC..THydrogen-bonded Turntrans101.216.9173.300000114.4M175 R176M175-G178 WeakPolarHBondContact O-CA 3.19Å; M175-G178 PolarHBondContact O-N 3.48Å; R176-G178 PolarHBondContact O-N 2.89Å
179F89.1Confident91.2Very high86 Ų8647.6 Ų47.638%0.37724%0.243SC..  trans-82.8154.2167.5-67.3-91.9000110.3I174 M175 A177 Q183 L187I174-F179 HydrophobicContact CG2-CB 3.69Å; I174-F179 HydrophobicContact CG2-CD2 3.81Å; I174-F179 HydrophobicContact CG2-CG 3.84Å; I174-F179 WeakPolarHBondContact O-CD2 3.32Å; M175-F179 WeakPolarHBondContact CA-O 3.37Å; A177-F179 HydrophobicContact CB-CD2 4.14Å; A177-F179 HydrophobicContact CB-CE2 4.31Å; F179-Q183 VanDerWaalsContact CA-OE1 3.32Å; F179-Q183 HydrophobicContact CB-CB 4.08Å; F179-Q183 HydrophobicContact CD1-CB 4.09Å; F179-L187 HydrophobicContact CD1-CD1 4.03Å; F179-L187 HydrophobicContact CE1-CD1 4.01Å
180T94.2Very high91.8Very high76 Ų7651.8 Ų51.847%0.46627%0.265SS..  trans-77.2163.4172.569.20000111.1R182 Q183 A184T180-R182 VanDerWaalsContact C-N 3.3Å; T180-R182 PolarHBondContact O-N 3.29Å; T180-Q183 PolarHBondContact O-N 3.29Å; T180-Q183 VanDerWaalsContact O-N 3.14Å; T180-Q183 WeakPolarHBondContact OG1-CG 3.5Å; T180-Q183 PolarHBondContact OG1-N 3.47Å; T180-A184 PolarHBondContact O-N 3.45Å
181S93.7Very high92.4Very high34 Ų3452.4 Ų52.424%0.23827%0.274CS..Hα-helixtrans-53.8-46.3174.4-179.50000111.9I48 Q183 A184 F185I48-S181 WeakPolarHBondContact CB-OG 3.3Å; S181-Q183 PolarHBondContact O-N 2.91Å; S181-A184 WeakPolarHBondContact O-CB 3.42Å; S181-A184 PolarHBondContact O-N 3.31Å; S181-F185 PolarHBondContact O-N 3.49Å
182R94.7Very high93Very high149 Ų14952.7 Ų52.756%0.56228%0.277SS*.Hα-helixtrans-62.1-39.3176.8-67.4-176.6177.5179.4-4.2112.9L94 T180 F185 V186L94-R182 PolarHBondContact O-NH2 2.99Å; T180-R182 VanDerWaalsContact C-N 3.3Å; T180-R182 PolarHBondContact O-N 3.29Å; R182-F185 WeakPolarHBondContact O-CB 3.26Å; R182-F185 PolarHBondContact O-N 3.5Å; R182-V186 WeakPolarHBondContact O-CG2 3.41Å; R182-V186 PolarHBondContact O-N 3.32Å
183Q95.6Very high93.5Very high90 Ų9051.8 Ų51.842%0.42128%0.278SS..Hα-helixtrans-66.3-41.1175.4-73.7169.9-21.500111.6F179 T180 S181 V186 L187F179-Q183 VanDerWaalsContact CA-OE1 3.32Å; F179-Q183 HydrophobicContact CB-CB 4.08Å; F179-Q183 HydrophobicContact CD1-CB 4.09Å; T180-Q183 PolarHBondContact O-N 3.29Å; T180-Q183 VanDerWaalsContact O-N 3.14Å; T180-Q183 WeakPolarHBondContact OG1-CG 3.5Å; T180-Q183 PolarHBondContact OG1-N 3.47Å; S181-Q183 PolarHBondContact O-N 2.91Å; Q183-V186 PolarHBondContact O-N 3.04Å; Q183-L187 WeakPolarHBondContact O-CB 3.24Å; Q183-L187 VanDerWaalsContact O-CG 3.23Å; Q183-L187 WeakPolarHBondContact O-CG 3.1Å; Q183-L187 PolarHBondContact O-N 3.43Å
184A95.4Very high94Very high0 Ų056.6 Ų56.60%030%0.303CS..Hα-helixtrans-62.4-45.8175.100000111.4I48 I174 M175 T180 S181 V186 L187 I188I48-A184 HydrophobicContact CD1-CB 3.95Å; I174-A184 HydrophobicContact CB-CB 4.1Å; I174-A184 HydrophobicContact CG2-CB 3.69Å; M175-A184 HydrophobicContact CG-CB 4.15Å; T180-A184 PolarHBondContact O-N 3.45Å; S181-A184 WeakPolarHBondContact O-CB 3.42Å; S181-A184 PolarHBondContact O-N 3.31Å; A184-V186 PolarHBondContact O-N 2.99Å; A184-L187 PolarHBondContact O-N 3.24Å; A184-I188 HydrophobicContact CB-CD1 4.44Å; A184-I188 WeakPolarHBondContact O-CB 3.4Å; A184-I188 WeakPolarHBondContact O-CD1 3.22Å; A184-I188 WeakPolarHBondContact O-CG1 3.44Å; A184-I188 PolarHBondContact O-N 3.29Å
185F96.6Very high94.6Very high29 Ų2956.4 Ų56.413%0.12730%0.302CS..Hα-helixtrans-51.1-56.3173.6158.1-123.3000111.9I48 G50 L51 L94 S181 R182 L187 I188 T189I48-F185 HydrophobicContact CD1-CB 4.05Å; G50-F185 WeakPolarHBondContact O-CE2 3.43Å; L51-F185 HydrophobicContact CB-CD2 4.35Å; L51-F185 HydrophobicContact CD1-CD2 4.46Å; L94-F185 HydrophobicContact CD1-CE1 4.01Å; L94-F185 HydrophobicContact CD2-CD1 4.11Å; L94-F185 HydrophobicContact CD2-CE1 4.26Å; S181-F185 PolarHBondContact O-N 3.49Å; R182-F185 WeakPolarHBondContact O-CB 3.26Å; R182-F185 PolarHBondContact O-N 3.5Å; F185-L187 PolarHBondContact O-N 3.07Å; F185-I188 PolarHBondContact O-N 2.85Å; F185-T189 WeakPolarHBondContact CD2-OG1 3.34Å; F185-T189 VanDerWaalsContact CE2-OG1 3.24Å; F185-T189 WeakPolarHBondContact CE2-OG1 3.43Å; F185-T189 WeakPolarHBondContact O-CB 3.5Å; F185-T189 PolarHBondContact O-N 2.83Å; F185-T189 PolarHBondContact O-OG1 3.21Å
186V97.8Very high95Very high71 Ų7153.9 Ų53.943%0.4329%0.291SS..Hα-helixtrans-61.1-47.3-178.6172.60000111.3R182 Q183 A184 I188 T189 L190R182-V186 WeakPolarHBondContact O-CG2 3.41Å; R182-V186 PolarHBondContact O-N 3.32Å; Q183-V186 PolarHBondContact O-N 3.04Å; A184-V186 PolarHBondContact O-N 2.99Å; V186-I188 PolarHBondContact O-N 3.37Å; V186-T189 PolarHBondContact O-N 2.95Å; V186-L190 HydrophobicContact CG1-CD1 3.76Å; V186-L190 HydrophobicContact CG1-CG 4.24Å; V186-L190 WeakPolarHBondContact O-CB 3.39Å; V186-L190 VanDerWaalsContact O-CG 3.27Å; V186-L190 WeakPolarHBondContact O-CG 3.5Å; V186-L190 PolarHBondContact O-N 3.16Å
187L96.4Very high95.6Very high81 Ų8151.5 Ų51.542%0.42429%0.29SS..Hα-helixtrans-61.3-44.6-179.2-73171.4000112.5I174 F179 Q183 A184 F185 A191I174-L187 HydrophobicContact CG2-CD1 4.3Å; F179-L187 HydrophobicContact CD1-CD1 4.03Å; F179-L187 HydrophobicContact CE1-CD1 4.01Å; Q183-L187 WeakPolarHBondContact O-CB 3.24Å; Q183-L187 VanDerWaalsContact O-CG 3.23Å; Q183-L187 WeakPolarHBondContact O-CG 3.1Å; Q183-L187 PolarHBondContact O-N 3.43Å; A184-L187 PolarHBondContact O-N 3.24Å; F185-L187 PolarHBondContact O-N 3.07Å; L187-A191 WeakPolarHBondContact O-CB 3.24Å; L187-A191 PolarHBondContact O-N 3.31Å
188I97.2Very high96.3Very high2 Ų254.6 Ų54.61%0.0130%0.304CS..Hα-helixtrans-69.3-40.6-179.2-63.2162.3000110.3L51 L55 I143 I170 H171 I174 A184 F185 V186 A191 A192L51-I188 HydrophobicContact CD1-CB 3.78Å; L51-I188 HydrophobicContact CD1-CD1 4.19Å; L51-I188 HydrophobicContact CD1-CG2 3.65Å; L51-I188 HydrophobicContact CD2-CD1 4.04Å; L55-I188 HydrophobicContact CD2-CG2 4.3Å; I143-I188 HydrophobicContact CG2-CG2 3.68Å; I170-I188 HydrophobicContact CD1-CG1 4.38Å; I170-I188 HydrophobicContact CG1-CD1 4.43Å; I170-I188 HydrophobicContact CG1-CG1 4.3Å; I170-I188 HydrophobicContact CG2-CD1 3.95Å; I170-I188 HydrophobicContact CG2-CG1 4.33Å; H171-I188 HydrophobicContact CB-CD1 3.64Å; I174-I188 HydrophobicContact CD1-CD1 4Å; I174-I188 HydrophobicContact CD1-CG1 3.65Å; A184-I188 HydrophobicContact CB-CD1 4.44Å; A184-I188 WeakPolarHBondContact O-CB 3.4Å; A184-I188 WeakPolarHBondContact O-CD1 3.22Å; A184-I188 WeakPolarHBondContact O-CG1 3.44Å; A184-I188 PolarHBondContact O-N 3.29Å; F185-I188 PolarHBondContact O-N 2.85Å; V186-I188 PolarHBondContact O-N 3.37Å; I188-A191 PolarHBondContact O-N 2.85Å; I188-A192 WeakPolarHBondContact O-CB 3.18Å; I188-A192 PolarHBondContact O-N 3.35Å
189T98.3Very high96.7Very high22 Ų2252.6 Ų52.614%0.13528%0.284CS..Hα-helixtrans-67.5-40.5179.6-52.40000111.2V58 F185 V186 A192 A193V58-T189 HydrophobicContact CG2-CG2 3.87Å; F185-T189 WeakPolarHBondContact CD2-OG1 3.34Å; F185-T189 VanDerWaalsContact CE2-OG1 3.24Å; F185-T189 WeakPolarHBondContact CE2-OG1 3.43Å; F185-T189 WeakPolarHBondContact O-CB 3.5Å; F185-T189 PolarHBondContact O-N 2.83Å; F185-T189 PolarHBondContact O-OG1 3.21Å; V186-T189 PolarHBondContact O-N 2.95Å; T189-A192 PolarHBondContact O-N 3.35Å; T189-A193 WeakPolarHBondContact O-CB 3.46Å; T189-A193 PolarHBondContact O-N 3.23Å
190L98.3Very high97.1Very high103 Ų10349.2 Ų49.254%0.53927%0.27SS..Hα-helixtrans-64.3-41.3173.3-72.6175.5000112V186 A192 A193 L194V186-L190 HydrophobicContact CG1-CD1 3.76Å; V186-L190 HydrophobicContact CG1-CG 4.24Å; V186-L190 WeakPolarHBondContact O-CB 3.39Å; V186-L190 VanDerWaalsContact O-CG 3.27Å; V186-L190 WeakPolarHBondContact O-CG 3.5Å; V186-L190 PolarHBondContact O-N 3.16Å; L190-A192 VanDerWaalsContact C-N 3.33Å; L190-A192 PolarHBondContact O-N 3.45Å; L190-A193 PolarHBondContact O-N 3Å; L190-L194 WeakPolarHBondContact O-CG 3.33Å; L190-L194 PolarHBondContact O-N 2.95Å
191A97.9Very high97.3Very high39 Ų3951 Ų5132%0.32228%0.276SS..Hα-helixtrans-62.8-40.8174.700000111.8L187 I188 L194 L195L187-A191 WeakPolarHBondContact O-CB 3.24Å; L187-A191 PolarHBondContact O-N 3.31Å; I188-A191 PolarHBondContact O-N 2.85Å; A191-L194 PolarHBondContact O-N 3.36Å; A191-L195 WeakPolarHBondContact O-CG 3.38Å; A191-L195 PolarHBondContact O-N 3.06Å; A191-L195 VanDerWaalsContact O-N 3.07Å
192A98.6Very high97.3Very high8 Ų850 Ų507%0.06627%0.27CS..Hα-helixtrans-62.9-44.8173.800000111.6L55 V58 I143 I188 T189 L190 L194 L195 A196L55-A192 HydrophobicContact CD2-CB 3.31Å; V58-A192 HydrophobicContact CG1-CB 4.18Å; I143-A192 HydrophobicContact CB-CB 4.13Å; I143-A192 HydrophobicContact CG1-CB 3.71Å; I188-A192 WeakPolarHBondContact O-CB 3.18Å; I188-A192 PolarHBondContact O-N 3.35Å; T189-A192 PolarHBondContact O-N 3.35Å; L190-A192 VanDerWaalsContact C-N 3.33Å; L190-A192 PolarHBondContact O-N 3.45Å; A192-L194 PolarHBondContact O-N 3.4Å; A192-L195 PolarHBondContact O-N 2.87Å; A192-A196 WeakPolarHBondContact O-CB 3.45Å; A192-A196 PolarHBondContact O-N 2.92Å
193A98.7Very high97.3Very high32 Ų3244.3 Ų44.326%0.26425%0.249SC..Hα-helixtrans-59.9-44.9177.300000111.4V58 T189 L190 L195 A196 S197V58-A193 HydrophobicContact CG1-CB 4.45Å; V58-A193 HydrophobicContact CG2-CB 4.04Å; T189-A193 WeakPolarHBondContact O-CB 3.46Å; T189-A193 PolarHBondContact O-N 3.23Å; L190-A193 PolarHBondContact O-N 3Å; A193-L195 PolarHBondContact O-N 2.64Å; A193-A196 PolarHBondContact O-N 3.36Å; A193-S197 WeakPolarHBondContact O-CB 3.38Å; A193-S197 PolarHBondContact O-N 3.48Å; A193-S197 PolarHBondContact O-OG 3.43Å
194L98.6Very high97.2Very high122 Ų12247.2 Ų47.264%0.63926%0.258SS*.Hα-helixtrans-59.7-46.2176.1-72171.2000112.2L190 A191 A192 S197 I198L190-L194 WeakPolarHBondContact O-CG 3.33Å; L190-L194 PolarHBondContact O-N 2.95Å; A191-L194 PolarHBondContact O-N 3.36Å; A192-L194 PolarHBondContact O-N 3.4Å; L194-S197 PolarHBondContact O-N 2.85Å; L194-I198 WeakPolarHBondContact O-CG1 3.36Å; L194-I198 PolarHBondContact O-N 2.64Å; L194-I198 VanDerWaalsContact O-N 3.09Å
195L98.6Very high97Very high29 Ų2950.2 Ų50.215%0.15228%0.279CS..Hα-helixtrans-65-44.5177.8-69.2168.3000111.7W139 A142 I143 M146 A191 A192 A193 S197 I198 G199 A220W139-L195 HydrophobicContact CE3-CB 4.27Å; W139-L195 HydrophobicContact CE3-CD2 4.08Å; W139-L195 HydrophobicContact CZ3-CD2 3.67Å; A142-L195 HydrophobicContact CB-CB 4.06Å; A142-L195 HydrophobicContact CB-CD1 3.97Å; I143-L195 HydrophobicContact CD1-CD1 3.57Å; I143-L195 HydrophobicContact CG1-CD1 3.88Å; M146-L195 HydrophobicContact CE-CD1 3.72Å; A191-L195 WeakPolarHBondContact O-CG 3.38Å; A191-L195 PolarHBondContact O-N 3.06Å; A191-L195 VanDerWaalsContact O-N 3.07Å; A192-L195 PolarHBondContact O-N 2.87Å; A193-L195 PolarHBondContact O-N 2.64Å; L195-S197 VanDerWaalsContact C-N 3.33Å; L195-S197 PolarHBondContact O-N 3.19Å; L195-I198 WeakPolarHBondContact O-CB 3.28Å; L195-I198 PolarHBondContact O-N 2.92Å; L195-G199 PolarHBondContact O-N 3.46Å; L195-A220 HydrophobicContact CD2-CB 4.48Å
196A98.6Very high96.6Very high3 Ų356.1 Ų56.13%0.02531%0.306CS..Hα-helixtrans-63.4-40.2177.100000111.4V58 A62 A192 A193 I198 G199 V200V58-A196 HydrophobicContact CG1-CB 3.74Å; A62-A196 HydrophobicContact CB-CB 3.99Å; A192-A196 WeakPolarHBondContact O-CB 3.45Å; A192-A196 PolarHBondContact O-N 2.92Å; A193-A196 PolarHBondContact O-N 3.36Å; A196-I198 VanDerWaalsContact C-N 3.32Å; A196-I198 PolarHBondContact O-N 3.26Å; A196-G199 WeakPolarHBondContact O-CA 3.33Å; A196-G199 PolarHBondContact O-N 2.81Å; A196-G199 VanDerWaalsContact O-N 3.12Å; A196-V200 WeakPolarHBondContact O-CG2 3.47Å; A196-V200 PolarHBondContact O-N 3.4Å
197S98.3Very high96.3Very high54 Ų5461.1 Ų61.138%0.37832%0.323SS..Hα-helixtrans-61.7-35.9174.6-66.70000112.7A193 L194 L195 G199 V200 L201A193-S197 WeakPolarHBondContact O-CB 3.38Å; A193-S197 PolarHBondContact O-N 3.48Å; A193-S197 PolarHBondContact O-OG 3.43Å; L194-S197 PolarHBondContact O-N 2.85Å; L195-S197 VanDerWaalsContact C-N 3.33Å; L195-S197 PolarHBondContact O-N 3.19Å; S197-G199 VanDerWaalsContact C-N 3.33Å; S197-V200 PolarHBondContact O-N 3.03Å; S197-L201 VanDerWaalsContact O-CB 3.28Å; S197-L201 WeakPolarHBondContact O-CB 3.39Å; S197-L201 WeakPolarHBondContact O-CG 3.5Å; S197-L201 PolarHBondContact O-N 2.99Å
198I97.8Very high96.2Very high75 Ų7559.6 Ų59.639%0.38532%0.317SS..Hα-helixtrans-60.1-46.2172.6-67.4164.1000110.1W139 L194 L195 A196 A202 M213W139-I198 HydrophobicContact CD2-CG2 4.4Å; W139-I198 HydrophobicContact CE3-CB 4.03Å; W139-I198 HydrophobicContact CE3-CG2 3.99Å; W139-I198 HydrophobicContact CH2-CG2 3.91Å; W139-I198 HydrophobicContact CZ2-CG2 4.32Å; W139-I198 HydrophobicContact CZ3-CB 3.98Å; W139-I198 HydrophobicContact CZ3-CD1 3.88Å; W139-I198 HydrophobicContact CZ3-CG2 3.73Å; L194-I198 WeakPolarHBondContact O-CG1 3.36Å; L194-I198 PolarHBondContact O-N 2.64Å; L194-I198 VanDerWaalsContact O-N 3.09Å; L195-I198 WeakPolarHBondContact O-CB 3.28Å; L195-I198 PolarHBondContact O-N 2.92Å; A196-I198 VanDerWaalsContact C-N 3.32Å; A196-I198 PolarHBondContact O-N 3.26Å; I198-A202 VanDerWaalsContact O-CB 3.26Å; I198-A202 WeakPolarHBondContact O-CB 3.38Å; I198-A202 PolarHBondContact O-N 3.28Å; I198-M213 HydrophobicContact CG2-CE 4.33Å
199G97.3Very high96Very high0 Ų062.5 Ų62.50%034%0.336CS..Hα-helixtrans-58.9-51.8174.700000112.9L195 A196 S197 L201 A202 E203L195-G199 PolarHBondContact O-N 3.46Å; A196-G199 WeakPolarHBondContact O-CA 3.33Å; A196-G199 PolarHBondContact O-N 2.81Å; A196-G199 VanDerWaalsContact O-N 3.12Å; S197-G199 VanDerWaalsContact C-N 3.33Å; G199-L201 PolarHBondContact O-N 3.33Å; G199-A202 PolarHBondContact O-N 2.95Å; G199-E203 WeakPolarHBondContact O-CB 3.48Å; G199-E203 PolarHBondContact O-N 3.1Å
200V97.6Very high95.9Very high15 Ų1563 Ų639%0.09134%0.337CS..Hα-helixtrans-60.6-44.5-179.4174.80000111.8A62 M65 I66 A196 S197 E203 Y204A62-V200 HydrophobicContact CB-CG2 3.7Å; M65-V200 HydrophobicContact CE-CG2 4.46Å; I66-V200 HydrophobicContact CD1-CB 4.47Å; I66-V200 HydrophobicContact CD1-CG2 3.92Å; I66-V200 HydrophobicContact CG1-CB 4.31Å; I66-V200 HydrophobicContact CG1-CG1 4.05Å; I66-V200 HydrophobicContact CG1-CG2 3.99Å; A196-V200 WeakPolarHBondContact O-CG2 3.47Å; A196-V200 PolarHBondContact O-N 3.4Å; S197-V200 PolarHBondContact O-N 3.03Å; V200-E203 PolarHBondContact O-N 3.49Å; V200-Y204 WeakPolarHBondContact O-CB 3.29Å; V200-Y204 PolarHBondContact O-N 3.13Å
201L97Very high95.8Very high113 Ų11363.6 Ų63.659%0.59233%0.331SS*.Hα-helixtrans-68.6-37.7179.7-70.9170.9000112.1S197 G199 S205S197-L201 VanDerWaalsContact O-CB 3.28Å; S197-L201 WeakPolarHBondContact O-CB 3.39Å; S197-L201 WeakPolarHBondContact O-CG 3.5Å; S197-L201 PolarHBondContact O-N 2.99Å; G199-L201 PolarHBondContact O-N 3.33Å; L201-S205 VanDerWaalsContact O-CB 3.26Å; L201-S205 WeakPolarHBondContact O-CB 3.46Å; L201-S205 PolarHBondContact O-N 3.11Å; L201-S205 PolarHBondContact O-OG 3.44Å
202A94.9Very high95.7Very high12 Ų1263.6 Ų63.610%0.09933%0.327CS..Hα-helixtrans-64.4-43.9175.200000111.4I198 G199 S205 H206 M213I198-A202 VanDerWaalsContact O-CB 3.26Å; I198-A202 WeakPolarHBondContact O-CB 3.38Å; I198-A202 PolarHBondContact O-N 3.28Å; G199-A202 PolarHBondContact O-N 2.95Å; A202-S205 PolarHBondContact O-OG 3.01Å; A202-H206 PolarHBondContact O-N 3.27Å; A202-M213 HydrophobicContact CB-CE 3.25Å; A202-M213 HydrophobicContact CB-CG 4.17Å; A202-M213 HydrophobicContact CB-SD 3.4Å; A202-M213 WeakPolarHBondContact CB-SD 3.33Å
203E94Very high95.6Very high30 Ų3063.5 Ų63.514%0.1433%0.326CS..Hα-helixtrans-62.9-46.7176.5-159.269.4-133.500111.1I66 S133 T136 G199 V200 H206I66-E203 HydrophobicContact CD1-CB 4.49Å; I66-E203 HydrophobicContact CG2-CG 4.16Å; S133-E203 WeakPolarHBondContact CB-OE2 3.23Å; S133-E203 PolarHBondContact N-OE1 3.31Å; S133-E203 PolarHBondContact N-OE2 3.36Å; S133-E203 PolarHBondContact OG-OE2 2.9Å; T136-E203 WeakPolarHBondContact CB-OE2 3.16Å; T136-E203 HydrophobicContact CG2-CB 4.33Å; T136-E203 PolarHBondContact OG1-OE2 3.09Å; G199-E203 WeakPolarHBondContact O-CB 3.48Å; G199-E203 PolarHBondContact O-N 3.1Å; V200-E203 PolarHBondContact O-N 3.49Å; E203-H206 PolarHBondContact O-CE1 3.28Å; E203-H206 PolarHBondContact O-N 3.08Å; E203-H206 PolarHBondContact O-ND1 2.92Å; E203-H206 PolarHBondContact O-NE2 2.79Å
204Y93.3Very high95.6Very high152 Ų15263.8 Ų63.860%0.59632%0.323SS*.Hα-helixtrans-67.1-38.1-179.8-179.3-101.1000113.8F69 V200 H206F69-Y204 HydrophobicContact CB-CD2 4.42Å; F69-Y204 HydrophobicContact CD1-CE2 4.43Å; F69-Y204 HydrophobicContact CD2-CD2 4.42Å; F69-Y204 HydrophobicContact CG-CD2 4.35Å; F69-Y204 HydrophobicContact CG-CE2 4.33Å; V200-Y204 WeakPolarHBondContact O-CB 3.29Å; V200-Y204 PolarHBondContact O-N 3.13Å; Y204-H206 PolarHBondContact O-CD2 3.34Å
205S92.1Very high95.5Very high63 Ų6361.4 Ų61.444%0.44131%0.313SS..Hα-helixtrans-78.4-20.6-177.760.60000113.4L201 A202 F207L201-S205 VanDerWaalsContact O-CB 3.26Å; L201-S205 WeakPolarHBondContact O-CB 3.46Å; L201-S205 PolarHBondContact O-N 3.11Å; L201-S205 PolarHBondContact O-OG 3.44Å; A202-S205 PolarHBondContact O-OG 3.01Å; S205-F207 PolarHBondContact O-N 3.46Å
206H87.7Confident95.5Very high153 Ų15363.6 Ų63.671%0.70832%0.324SS*.  trans51.711.5-173.7-57.4-74.4000115A202 E203 Y204A202-H206 PolarHBondContact O-N 3.27Å; E203-H206 PolarHBondContact O-CE1 3.28Å; E203-H206 PolarHBondContact O-N 3.08Å; E203-H206 PolarHBondContact O-ND1 2.92Å; E203-H206 PolarHBondContact O-NE2 2.79Å; Y204-H206 PolarHBondContact O-CD2 3.34Å
207F91Very high95.5Very high176 Ų17664 Ų6477%0.77233%0.325SS*.  trans-85.1-30.1-172.8-177.5-101.6000112.4S205 P209S205-F207 PolarHBondContact O-N 3.46Å; F207-P209 WeakPolarHBondContact O-CD 3.32Å
208V93.7Very high95.4Very high49 Ų4965.1 Ų65.130%0.29733%0.327SS..SBendtrans-98.4117.9-175-171.50000109.4V212 M213V208-V212 HydrophobicContact CG1-CB 3.88Å; V208-V212 HydrophobicContact CG1-CG1 3.82Å; V208-M213 HydrophobicContact CB-CG 4.26Å; V208-M213 HydrophobicContact CB-SD 4.33Å; V208-M213 HydrophobicContact CG1-CG 3.74Å; V208-M213 HydrophobicContact CG1-SD 3.89Å
209P94.8Very high95.4Very high63 Ų6366.5 Ų66.541%0.40934%0.335SS..  trans-62.6150.2176.5-22.433.1000112.8F207 W211 V212 M213F207-P209 WeakPolarHBondContact O-CD 3.32Å; P209-W211 VanDerWaalsContact C-N 3.35Å; P209-W211 HydrophobicContact CB-CG 4.5Å; P209-W211 PolarHBondContact O-N 2.99Å; P209-V212 HydrophobicContact CB-CG2 4.25Å; P209-V212 HydrophobicContact CG-CG2 4.26Å; P209-V212 WeakPolarHBondContact O-CB 3.43Å; P209-V212 PolarHBondContact O-N 3.33Å; P209-M213 PolarHBondContact O-N 3.44Å; P209-M213 VanDerWaalsContact O-N 3.08Å
210E94.9Very high95.5Very high33 Ų3367.6 Ų67.615%0.15434%0.344CS..Hα-helixtrans-57.6-41.4-178-69.9-177.1-139.400113.7G13 Y14 V135 V212 M213 L214G13-E210 VanDerWaalsContact CA-OE2 3.28Å; G13-E210 WeakPolarHBondContact CA-OE2 3.34Å; Y14-E210 WeakPolarHBondContact CD2-OE1 3.34Å; Y14-E210 PolarHBondContact N-OE2 3.26Å; V135-E210 HydrophobicContact CG2-CB 4.1Å; E210-V212 VanDerWaalsContact C-N 3.27Å; E210-V212 PolarHBondContact O-N 3.2Å; E210-M213 CarbonylContact O-C 3.58Å; E210-M213 WeakPolarHBondContact O-CB 3.28Å; E210-M213 PolarHBondContact O-N 3.19Å; E210-M213 VanDerWaalsContact O-N 3.15Å; E210-L214 PolarHBondContact O-N 2.83Å
211W96.1Very high95.4Very high114 Ų11469 Ų6943%0.43235%0.349SS..Hα-helixtrans-62.2-34.1177.169.1-93.5000112.5Y14 I15 P209 L214 V215Y14-W211 PolarHBondContact O-N 3.15Å; I15-W211 VanDerWaalsContact O-CB 3.29Å; I15-W211 WeakPolarHBondContact O-CB 3.26Å; P209-W211 VanDerWaalsContact C-N 3.35Å; P209-W211 HydrophobicContact CB-CG 4.5Å; P209-W211 PolarHBondContact O-N 2.99Å; W211-L214 PolarHBondContact O-N 3.15Å; W211-V215 WeakPolarHBondContact O-CG2 3.33Å; W211-V215 PolarHBondContact O-N 3.34Å
212V96.6Very high95.3Very high39 Ų3970.2 Ų70.224%0.23635%0.35CS..Hα-helixtrans-68.2-44.8174.4-179.50000109.5V208 P209 E210 L214 V215 L216V208-V212 HydrophobicContact CG1-CB 3.88Å; V208-V212 HydrophobicContact CG1-CG1 3.82Å; P209-V212 HydrophobicContact CB-CG2 4.25Å; P209-V212 HydrophobicContact CG-CG2 4.26Å; P209-V212 WeakPolarHBondContact O-CB 3.43Å; P209-V212 PolarHBondContact O-N 3.33Å; E210-V212 VanDerWaalsContact C-N 3.27Å; E210-V212 PolarHBondContact O-N 3.2Å; V212-L214 PolarHBondContact O-N 2.87Å; V212-V215 PolarHBondContact O-N 3.19Å; V212-L216 HydrophobicContact CG1-CD1 4.14Å; V212-L216 HydrophobicContact CG1-CG 4.35Å; V212-L216 WeakPolarHBondContact O-CB 3.19Å; V212-L216 WeakPolarHBondContact O-CG 3.49Å; V212-L216 PolarHBondContact O-N 3.45Å
213M96.9Very high95.3Very high7 Ų774.8 Ų74.83%0.03437%0.372CS..Hα-helixtrans-58.6-37174.9-73.4-65.3-73.800112.1V135 W139 I198 A202 V208 P209 E210 F217V135-M213 HydrophobicContact CG1-CB 3.69Å; W139-M213 HydrophobicContact CD2-CE 4.34Å; W139-M213 HydrophobicContact CG-CE 4.25Å; W139-M213 HydrophobicContact CZ2-CE 4.44Å; W139-M213 WeakPolarHBondContact CZ2-O 3.33Å; W139-M213 PolarHBondContact NE1-O 3.39Å; I198-M213 HydrophobicContact CG2-CE 4.33Å; A202-M213 HydrophobicContact CB-CE 3.25Å; A202-M213 HydrophobicContact CB-CG 4.17Å; A202-M213 HydrophobicContact CB-SD 3.4Å; A202-M213 WeakPolarHBondContact CB-SD 3.33Å; V208-M213 HydrophobicContact CB-CG 4.26Å; V208-M213 HydrophobicContact CB-SD 4.33Å; V208-M213 HydrophobicContact CG1-CG 3.74Å; V208-M213 HydrophobicContact CG1-SD 3.89Å; P209-M213 PolarHBondContact O-N 3.44Å; P209-M213 VanDerWaalsContact O-N 3.08Å; E210-M213 CarbonylContact O-C 3.58Å; E210-M213 WeakPolarHBondContact O-CB 3.28Å; E210-M213 PolarHBondContact O-N 3.19Å; E210-M213 VanDerWaalsContact O-N 3.15Å; M213-F217 WeakPolarHBondContact O-CB 3.18Å; M213-F217 PolarHBondContact O-N 3.41Å
214L97.5Very high95.3Very high37 Ų3774.5 Ų74.519%0.19437%0.369CS..Hα-helixtrans-68.5-45.5176.1-179.562.6000111.1I15 V135 L138 E210 W211 V212 L216 F217 L218I15-L214 HydrophobicContact CB-CD2 3.72Å; I15-L214 HydrophobicContact CG2-CD2 3.8Å; V135-L214 HydrophobicContact CG1-CB 3.98Å; V135-L214 HydrophobicContact CG2-CB 4.31Å; L138-L214 HydrophobicContact CD1-CD1 3.99Å; E210-L214 PolarHBondContact O-N 2.83Å; W211-L214 PolarHBondContact O-N 3.15Å; V212-L214 PolarHBondContact O-N 2.87Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 3.21Å; L214-F217 WeakPolarHBondContact O-CB 3.48Å; L214-F217 PolarHBondContact O-N 3.09Å; L214-L218 HydrophobicContact CD1-CG 4.46Å; L214-L218 HydrophobicContact CG-CD1 4.35Å; L214-L218 VanDerWaalsContact O-CG 3.31Å; L214-L218 WeakPolarHBondContact O-CG 3.48Å; L214-L218 PolarHBondContact O-N 3.46Å
215V97.4Very high95.2Very high72 Ų7268.4 Ų68.444%0.43635%0.353SS..Hα-helixtrans-59.6-45.3175.7170.30000110.7W211 V212 F217 L218 L219W211-V215 WeakPolarHBondContact O-CG2 3.33Å; W211-V215 PolarHBondContact O-N 3.34Å; V212-V215 PolarHBondContact O-N 3.19Å; V215-F217 VanDerWaalsContact C-N 3.33Å; V215-F217 PolarHBondContact O-N 3.26Å; V215-L218 PolarHBondContact O-N 3.42Å; V215-L219 HydrophobicContact CG1-CD1 4.21Å; V215-L219 HydrophobicContact CG1-CG 4.5Å; V215-L219 WeakPolarHBondContact O-CG 3.08Å; V215-L219 PolarHBondContact O-N 3.49Å
216L97.7Very high95Very high75 Ų7571.5 Ų71.539%0.39336%0.356SS..Hα-helixtrans-61.8-40.2176.2-70.8176.5000111.9W139 V212 L214 L219 A220W139-L216 HydrophobicContact CH2-CB 4.09Å; W139-L216 HydrophobicContact CZ2-CB 3.71Å; V212-L216 HydrophobicContact CG1-CD1 4.14Å; V212-L216 HydrophobicContact CG1-CG 4.35Å; V212-L216 WeakPolarHBondContact O-CB 3.19Å; V212-L216 WeakPolarHBondContact O-CG 3.49Å; V212-L216 PolarHBondContact O-N 3.45Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 3.21Å; L216-L219 HydrophobicContact CD2-CD1 4.49Å; L216-L219 PolarHBondContact O-N 2.97Å; L216-A220 WeakPolarHBondContact O-CB 3.19Å; L216-A220 PolarHBondContact O-N 3.09Å
217F98.2Very high95Very high11 Ų1167.5 Ų67.55%0.04835%0.345CS..Hα-helixtrans-62.6-45175.2-179.8-95.2000111.2L138 W139 A142 L145 M146 M213 L214 V215 L219 A220 F221L138-F217 HydrophobicContact CB-CD1 4.33Å; L138-F217 HydrophobicContact CB-CD2 3.96Å; L138-F217 HydrophobicContact CB-CE1 4.14Å; L138-F217 HydrophobicContact CB-CE2 3.76Å; L138-F217 HydrophobicContact CB-CG 4.25Å; L138-F217 HydrophobicContact CB-CZ 3.86Å; L138-F217 HydrophobicContact CD1-CD1 4.11Å; L138-F217 HydrophobicContact CD1-CE1 4.22Å; L138-F217 VanDerWaalsContact O-CE2 3.27Å; L138-F217 WeakPolarHBondContact O-CE2 3.37Å; W139-F217 HydrophobicContact CD2-CD2 4.13Å; W139-F217 HydrophobicContact CG-CD2 4.28Å; W139-F217 HydrophobicContact CZ2-CB 3.86Å; W139-F217 VanDerWaalsContact CZ2-N 3.3Å; A142-F217 HydrophobicContact CB-CE2 3.97Å; L145-F217 HydrophobicContact CD2-CZ 4.11Å; M146-F217 HydrophobicContact CE-CE2 4.09Å; M146-F217 HydrophobicContact CG-CZ 4.49Å; M213-F217 WeakPolarHBondContact O-CB 3.18Å; M213-F217 PolarHBondContact O-N 3.41Å; L214-F217 WeakPolarHBondContact O-CB 3.48Å; L214-F217 PolarHBondContact O-N 3.09Å; V215-F217 VanDerWaalsContact C-N 3.33Å; V215-F217 PolarHBondContact O-N 3.26Å; F217-L219 VanDerWaalsContact C-N 3.34Å; F217-L219 PolarHBondContact O-N 3.17Å; F217-A220 WeakPolarHBondContact O-CB 3.47Å; F217-A220 PolarHBondContact O-N 2.82Å; F217-F221 WeakPolarHBondContact O-CB 3.4Å; F217-F221 PolarHBondContact O-N 2.91Å
218L97.9Very high94.7Very high78 Ų7860.3 Ų60.341%0.40831%0.314SS..Hα-helixtrans-63.1-40.5176.8-68.3174.5000111.5L214 V215 F221 F222L214-L218 HydrophobicContact CD1-CG 4.46Å; L214-L218 HydrophobicContact CG-CD1 4.35Å; L214-L218 VanDerWaalsContact O-CG 3.31Å; L214-L218 WeakPolarHBondContact O-CG 3.48Å; L214-L218 PolarHBondContact O-N 3.46Å; V215-L218 PolarHBondContact O-N 3.42Å; L218-F221 WeakPolarHBondContact O-CB 3.42Å; L218-F221 PolarHBondContact O-N 3.19Å; L218-F222 HydrophobicContact CB-CE2 4.42Å; L218-F222 WeakPolarHBondContact O-CD2 3.25Å; L218-F222 PolarHBondContact O-N 2.62Å
219L97.9Very high94.2Very high104 Ų10466.3 Ų66.355%0.54534%0.336SS..Hα-helixtrans-62.1-44.5173.6-70.9173.8000111.5V215 L216 F217 F221 F222 L223V215-L219 HydrophobicContact CG1-CD1 4.21Å; V215-L219 HydrophobicContact CG1-CG 4.5Å; V215-L219 WeakPolarHBondContact O-CG 3.08Å; V215-L219 PolarHBondContact O-N 3.49Å; L216-L219 HydrophobicContact CD2-CD1 4.49Å; L216-L219 PolarHBondContact O-N 2.97Å; F217-L219 VanDerWaalsContact C-N 3.34Å; F217-L219 PolarHBondContact O-N 3.17Å; L219-F221 VanDerWaalsContact C-N 3.33Å; L219-F221 PolarHBondContact O-N 3.12Å; L219-F222 PolarHBondContact O-N 2.92Å; L219-L223 VanDerWaalsContact O-CB 3.3Å; L219-L223 WeakPolarHBondContact O-CB 3.18Å; L219-L223 PolarHBondContact O-N 2.89Å
220A97.7Very high93.7Very high23 Ų2368.1 Ų68.119%0.1933%0.334CS..Hα-helixtrans-61.4-41.5174.400000111.6L195 L216 F217 L223 Y224L195-A220 HydrophobicContact CD2-CB 4.48Å; L216-A220 WeakPolarHBondContact O-CB 3.19Å; L216-A220 PolarHBondContact O-N 3.09Å; F217-A220 WeakPolarHBondContact O-CB 3.47Å; F217-A220 PolarHBondContact O-N 2.82Å; A220-L223 PolarHBondContact O-N 3.42Å; A220-Y224 VanDerWaalsContact O-CB 3.24Å; A220-Y224 WeakPolarHBondContact O-CB 3.23Å; A220-Y224 PolarHBondContact O-N 2.97Å
221F96.8Very high92.9Very high45 Ų4567.6 Ų67.620%0.19734%0.336CS..Hα-helixtrans-59.2-48.3174.9179.1-83.1000111.9M146 V149 F217 L218 L219 Y224 G225M146-F221 HydrophobicContact CB-CD2 4.32Å; M146-F221 HydrophobicContact CG-CB 4.41Å; M146-F221 HydrophobicContact CG-CD2 3.62Å; M146-F221 HydrophobicContact CG-CE2 4.28Å; M146-F221 HydrophobicContact CG-CG 4.42Å; M146-F221 HydrophobicContact SD-CB 4.36Å; V149-F221 HydrophobicContact CB-CE2 3.88Å; V149-F221 HydrophobicContact CB-CZ 4.1Å; V149-F221 HydrophobicContact CG1-CE2 3.83Å; V149-F221 HydrophobicContact CG1-CZ 3.6Å; F217-F221 WeakPolarHBondContact O-CB 3.4Å; F217-F221 PolarHBondContact O-N 2.91Å; L218-F221 WeakPolarHBondContact O-CB 3.42Å; L218-F221 PolarHBondContact O-N 3.19Å; L219-F221 VanDerWaalsContact C-N 3.33Å; L219-F221 PolarHBondContact O-N 3.12Å; F221-Y224 WeakPolarHBondContact O-CB 3.11Å; F221-Y224 PolarHBondContact O-N 2.82Å; F221-G225 PolarHBondContact O-N 2.68Å
222F95.4Very high91.7Very high139 Ų13969.3 Ų69.361%0.6134%0.342SS*.Hα-helixtrans-68.6-38.1178.2-72.6-60.4000112.3L218 L219 Y224 G225 Y226L218-F222 HydrophobicContact CB-CE2 4.42Å; L218-F222 WeakPolarHBondContact O-CD2 3.25Å; L218-F222 PolarHBondContact O-N 2.62Å; L219-F222 PolarHBondContact O-N 2.92Å; F222-Y224 VanDerWaalsContact C-N 3.34Å; F222-G225 PolarHBondContact O-N 3Å; F222-Y226 WeakPolarHBondContact O-CB 3.39Å; F222-Y226 PolarHBondContact O-N 3.03Å
223L93.9Very high90.6Very high108 Ų10872.9 Ų72.957%0.56536%0.355SS*.Hα-helixtrans-61.3-44.5173.3178.961.7000110.9L219 A220 Y226 C227L219-L223 VanDerWaalsContact O-CB 3.3Å; L219-L223 WeakPolarHBondContact O-CB 3.18Å; L219-L223 PolarHBondContact O-N 2.89Å; A220-L223 PolarHBondContact O-N 3.42Å; L223-Y226 WeakPolarHBondContact O-CB 3.45Å; L223-Y226 PolarHBondContact O-N 3.05Å; L223-C227 WeakPolarHBondContact O-CB 3.48Å; L223-C227 PolarHBondContact O-N 3.32Å; L223-C227 PolarHBondContact O-SG 3.12Å
224Y93.3Very high89.5Confident23 Ų2376.1 Ų76.19%0.0938%0.375CS..Hα-helixtrans-58.3-50174.5177.5-87.9000111.4I143 M146 D147 A150 I170 A220 F221 F222 Y226 C227 I228I143-Y224 HydrophobicContact CD1-CD2 4.41Å; I143-Y224 HydrophobicContact CD1-CE2 4.15Å; M146-Y224 HydrophobicContact CB-CD1 3.87Å; M146-Y224 HydrophobicContact CB-CD2 4.49Å; M146-Y224 HydrophobicContact CB-CE1 3.92Å; M146-Y224 HydrophobicContact CB-CG 4.18Å; M146-Y224 HydrophobicContact SD-CD1 4.43Å; M146-Y224 HydrophobicContact SD-CD2 4.21Å; M146-Y224 HydrophobicContact SD-CG 3.9Å; D147-Y224 WeakPolarHBondContact CA-OH 3.46Å; D147-Y224 WeakPolarHBondContact CB-OH 3.34Å; D147-Y224 PolarHBondContact OD1-OH 3.45Å; A150-Y224 HydrophobicContact CB-CE1 4.21Å; I170-Y224 WeakPolarHBondContact CB-OH 3.43Å; I170-Y224 HydrophobicContact CD1-CD2 4.47Å; I170-Y224 HydrophobicContact CD1-CE2 3.54Å; A220-Y224 VanDerWaalsContact O-CB 3.24Å; A220-Y224 WeakPolarHBondContact O-CB 3.23Å; A220-Y224 PolarHBondContact O-N 2.97Å; F221-Y224 WeakPolarHBondContact O-CB 3.11Å; F221-Y224 PolarHBondContact O-N 2.82Å; F222-Y224 VanDerWaalsContact C-N 3.34Å; Y224-Y226 VanDerWaalsContact C-N 3.32Å; Y224-Y226 PolarHBondContact O-N 3.41Å; Y224-C227 WeakPolarHBondContact O-CB 3.22Å; Y224-C227 PolarHBondContact O-N 3.16Å; Y224-I228 HydrophobicContact CD1-CD1 3.94Å; Y224-I228 HydrophobicContact CD1-CG1 4.43Å; Y224-I228 HydrophobicContact CE1-CD1 3.19Å; Y224-I228 HydrophobicContact CE1-CG1 4.05Å; Y224-I228 PolarHBondContact O-N 3.46Å
225G91.1Very high88.3Confident25 Ų2574.7 Ų74.726%0.25837%0.368SS..Hα-helixtrans-60.2-39.4176.300000113F221 F222 I228 K229F221-G225 PolarHBondContact O-N 2.68Å; F222-G225 PolarHBondContact O-N 3Å; G225-I228 PolarHBondContact O-N 3.28Å; G225-K229 WeakPolarHBondContact O-CB 3.45Å; G225-K229 PolarHBondContact O-N 3.24Å
226Y88.3Confident87.2Confident128 Ų12876.2 Ų76.250%0.50237%0.366SS..Hα-helixtrans-63.5-46.5174.4179.9-100000111.8F222 L223 Y224 I228 K229 R230F222-Y226 WeakPolarHBondContact O-CB 3.39Å; F222-Y226 PolarHBondContact O-N 3.03Å; L223-Y226 WeakPolarHBondContact O-CB 3.45Å; L223-Y226 PolarHBondContact O-N 3.05Å; Y224-Y226 VanDerWaalsContact C-N 3.32Å; Y224-Y226 PolarHBondContact O-N 3.41Å; Y226-I228 PolarHBondContact O-N 3.13Å; Y226-K229 PolarHBondContact O-N 3.35Å; Y226-R230 HydrophobicContact CD1-CG 4.42Å; Y226-R230 HydrophobicContact CD2-CG 4.42Å; Y226-R230 HydrophobicContact CE1-CG 4Å; Y226-R230 HydrophobicContact CE2-CG 3.98Å; Y226-R230 WeakPolarHBondContact O-CB 3.2Å; Y226-R230 WeakPolarHBondContact O-CG 3.44Å; Y226-R230 PolarHBondContact O-N 2.9Å; Y226-R230 PolarHBondContact OH-NE 3.38Å
227C87.5Confident86.3Confident69 Ų6979.1 Ų79.147%0.46638%0.376SS..Hα-helixtrans-58.1-46.4175.3-75.60000111.4L223 Y224 K229 R230 A231L223-C227 WeakPolarHBondContact O-CB 3.48Å; L223-C227 PolarHBondContact O-N 3.32Å; L223-C227 PolarHBondContact O-SG 3.12Å; Y224-C227 WeakPolarHBondContact O-CB 3.22Å; Y224-C227 PolarHBondContact O-N 3.16Å; C227-K229 PolarHBondContact O-N 2.87Å; C227-R230 CarbonylContact O-C 3.52Å; C227-R230 PolarHBondContact O-N 3.47Å; C227-A231 WeakPolarHBondContact O-CA 3.39Å; C227-A231 WeakPolarHBondContact O-CB 3.4Å; C227-A231 PolarHBondContact O-N 3.27Å
228I86Confident85.2Confident24 Ų2481 Ų8112%0.12339%0.386CS..Hα-helixtrans-58.3-48.5175-77.9-170.6000111.6A150 L173 Y224 G225 Y226 R230 A231A150-I228 HydrophobicContact CB-CD1 4.46Å; L173-I228 HydrophobicContact CD1-CB 4.15Å; L173-I228 HydrophobicContact CD1-CD1 4.43Å; L173-I228 HydrophobicContact CD1-CG1 3.95Å; L173-I228 HydrophobicContact CD1-CG2 3.76Å; Y224-I228 HydrophobicContact CD1-CD1 3.94Å; Y224-I228 HydrophobicContact CD1-CG1 4.43Å; Y224-I228 HydrophobicContact CE1-CD1 3.19Å; Y224-I228 HydrophobicContact CE1-CG1 4.05Å; Y224-I228 PolarHBondContact O-N 3.46Å; G225-I228 PolarHBondContact O-N 3.28Å; Y226-I228 PolarHBondContact O-N 3.13Å; I228-R230 VanDerWaalsContact C-N 3.27Å; I228-R230 PolarHBondContact O-N 3.06Å; I228-A231 WeakPolarHBondContact O-CB 3.08Å; I228-A231 PolarHBondContact O-N 2.97Å
229K83.3Confident84.2Confident175 Ų17583.1 Ų83.176%0.76139%0.392SS*.Hα-helixtrans-63.1-34.5-179.1-171.5177.6-179179.40112G225 Y226 C227G225-K229 WeakPolarHBondContact O-CB 3.45Å; G225-K229 PolarHBondContact O-N 3.24Å; Y226-K229 PolarHBondContact O-N 3.35Å; C227-K229 PolarHBondContact O-N 2.87Å
230R82.9Confident83.4Confident101 Ų10186 Ų8638%0.38140%0.395SS..Hα-helixtrans-89.5-13.4179.1-68.7-73.1-174.3160.6-2.5113.6Y226 C227 I228 W232 K233 V234Y226-R230 HydrophobicContact CD1-CG 4.42Å; Y226-R230 HydrophobicContact CD2-CG 4.42Å; Y226-R230 HydrophobicContact CE1-CG 4Å; Y226-R230 HydrophobicContact CE2-CG 3.98Å; Y226-R230 WeakPolarHBondContact O-CB 3.2Å; Y226-R230 WeakPolarHBondContact O-CG 3.44Å; Y226-R230 PolarHBondContact O-N 2.9Å; Y226-R230 PolarHBondContact OH-NE 3.38Å; C227-R230 CarbonylContact O-C 3.52Å; C227-R230 PolarHBondContact O-N 3.47Å; I228-R230 VanDerWaalsContact C-N 3.27Å; I228-R230 PolarHBondContact O-N 3.06Å; R230-W232 PolarHBondContact O-N 3.4Å; R230-K233 VanDerWaalsContact NH1-NZ 3.11Å; R230-K233 WeakPolarHBondContact O-CA 3.39Å; R230-K233 WeakPolarHBondContact O-CB 3.48Å; R230-K233 PolarHBondContact O-N 3.45Å; R230-V234 PolarHBondContact O-N 3.3Å
231A78.2Confident82.6Confident22 Ų2287.7 Ų87.718%0.18240%0.403CS..Hα-helixtrans-52.8-35.8-176.800000112.1L173 C227 I228 V234 A235L173-A231 HydrophobicContact CB-CB 4.19Å; L173-A231 HydrophobicContact CD1-CB 4.32Å; C227-A231 WeakPolarHBondContact O-CA 3.39Å; C227-A231 WeakPolarHBondContact O-CB 3.4Å; C227-A231 PolarHBondContact O-N 3.27Å; I228-A231 WeakPolarHBondContact O-CB 3.08Å; I228-A231 PolarHBondContact O-N 2.97Å; A231-V234 PolarHBondContact O-N 3.08Å; A231-A235 WeakPolarHBondContact O-CB 3.48Å; A231-A235 PolarHBondContact O-N 2.88Å
232W71.5Confident81.7Confident151 Ų15191.4 Ų91.457%0.57242%0.419SS*.Hα-helixtrans-69.5-34.4176.9-157.773.5000113.7R230 R236R230-W232 PolarHBondContact O-N 3.4Å; W232-R236 HydrophobicContact CD2-CG 4.45Å; W232-R236 VanDerWaalsContact CE3-CZ 3.42Å; W232-R236 HydrophobicContact CZ2-CG 4.49Å; W232-R236 VanDerWaalsContact CZ3-NH2 3.32Å; W232-R236 WeakPolarHBondContact O-CB 3.19Å; W232-R236 WeakPolarHBondContact O-CG 3.31Å; W232-R236 PolarHBondContact O-N 3.4Å; W232-R236 VanDerWaalsContact O-N 3.09Å
233K73.8Confident81Confident113 Ų11393.7 Ų93.749%0.49142%0.424SS..Hα-helixtrans-68.2-43.5172.7-66.8-172.4-177.7-175.90110.4R230 R236 F237R230-K233 VanDerWaalsContact NH1-NZ 3.11Å; R230-K233 WeakPolarHBondContact O-CA 3.39Å; R230-K233 WeakPolarHBondContact O-CB 3.48Å; R230-K233 PolarHBondContact O-N 3.45Å; K233-R236 PolarHBondContact O-N 3.4Å; K233-F237 WeakPolarHBondContact O-CB 3.26Å; K233-F237 PolarHBondContact O-N 3.17Å
234V73Confident80.4Confident76 Ų7697.1 Ų97.146%0.46143%0.429SS..Hα-helixtrans-63.4-47.6177.3179.20000111.1R230 A231 R236 F237 I238R230-V234 PolarHBondContact O-N 3.3Å; A231-V234 PolarHBondContact O-N 3.08Å; V234-R236 VanDerWaalsContact C-N 3.35Å; V234-R236 PolarHBondContact O-N 2.96Å; V234-F237 WeakPolarHBondContact O-CB 3.49Å; V234-F237 PolarHBondContact O-N 3.3Å; V234-F237 VanDerWaalsContact O-N 3.09Å; V234-I238 HydrophobicContact CG1-CD1 3.83Å; V234-I238 HydrophobicContact CG1-CG1 4.34Å; V234-I238 WeakPolarHBondContact O-CG1 3.28Å; V234-I238 PolarHBondContact O-N 3.02Å
235A73.3Confident79.8Confident6 Ų6101.1 Ų101.15%0.0545%0.451CS..Hα-helixtrans-57.5-44.7176.100000112.3A177 A231 F237 I238 K239A177-A235 HydrophobicContact CB-CB 3.79Å; A231-A235 WeakPolarHBondContact O-CB 3.48Å; A231-A235 PolarHBondContact O-N 2.88Å; A235-F237 VanDerWaalsContact C-N 3.34Å; A235-I238 PolarHBondContact O-N 3.3Å; A235-K239 WeakPolarHBondContact O-CB 3.37Å; A235-K239 WeakPolarHBondContact O-CG 3.49Å; A235-K239 PolarHBondContact O-N 3.44Å
236R74.6Confident79.2Confident104 Ų104109.5 Ų109.539%0.39248%0.475SS..Hα-helixtrans-63.7-39.6175-76.8-167.9-63.3169.5-2.9112.1W232 K233 V234 R240W232-R236 HydrophobicContact CD2-CG 4.45Å; W232-R236 VanDerWaalsContact CE3-CZ 3.42Å; W232-R236 HydrophobicContact CZ2-CG 4.49Å; W232-R236 VanDerWaalsContact CZ3-NH2 3.32Å; W232-R236 WeakPolarHBondContact O-CB 3.19Å; W232-R236 WeakPolarHBondContact O-CG 3.31Å; W232-R236 PolarHBondContact O-N 3.4Å; W232-R236 VanDerWaalsContact O-N 3.09Å; K233-R236 PolarHBondContact O-N 3.4Å; V234-R236 VanDerWaalsContact C-N 3.35Å; V234-R236 PolarHBondContact O-N 2.96Å; R236-R240 WeakPolarHBondContact O-CG 3.48Å; R236-R240 PolarHBondContact O-N 2.99Å
237F77.2Confident78.7Confident137 Ų137112.4 Ų112.460%0.60149%0.485SS*.Hα-helixtrans-63.5-50.2176.4-179.8-101.8000111.6K233 V234 A235 K239 R240 V241K233-F237 WeakPolarHBondContact O-CB 3.26Å; K233-F237 PolarHBondContact O-N 3.17Å; V234-F237 WeakPolarHBondContact O-CB 3.49Å; V234-F237 PolarHBondContact O-N 3.3Å; V234-F237 VanDerWaalsContact O-N 3.09Å; A235-F237 VanDerWaalsContact C-N 3.34Å; F237-K239 VanDerWaalsContact C-N 3.32Å; F237-K239 PolarHBondContact O-N 3.31Å; F237-R240 WeakPolarHBondContact O-CB 3.4Å; F237-R240 PolarHBondContact O-N 3.44Å; F237-V241 HydrophobicContact CD1-CG2 4.26Å; F237-V241 HydrophobicContact CE1-CG2 3.87Å; F237-V241 HydrophobicContact CE2-CG2 4.21Å; F237-V241 HydrophobicContact CZ-CG2 3.84Å; F237-V241 WeakPolarHBondContact O-CG2 3.47Å; F237-V241 PolarHBondContact O-N 2.93Å
238I76.8Confident78.1Confident49 Ų49114.8 Ų114.825%0.25149%0.494SS..Hα-helixtrans-57.4-44.8177.1-67170.5000110.9V234 A235 R240 V241 K242V234-I238 HydrophobicContact CG1-CD1 3.83Å; V234-I238 HydrophobicContact CG1-CG1 4.34Å; V234-I238 WeakPolarHBondContact O-CG1 3.28Å; V234-I238 PolarHBondContact O-N 3.02Å; A235-I238 PolarHBondContact O-N 3.3Å; I238-R240 VanDerWaalsContact C-N 3.35Å; I238-R240 PolarHBondContact O-N 2.88Å; I238-V241 PolarHBondContact O-N 3.07Å; I238-K242 HydrophobicContact CG2-CD 4.39Å; I238-K242 PolarHBondContact O-N 3.35Å
239K76.4Confident77.4Confident123 Ų123124.6 Ų124.654%0.53553%0.529SS..Hα-helixtrans-61.2-40.9176-76-177.4179.9-179.10112.3R176 A235 F237 R243R176-K239 VanDerWaalsContact O-CE 3.26Å; R176-K239 WeakPolarHBondContact O-CE 3.04Å; R176-K239 PolarHBondContact O-NZ 3.25Å; A235-K239 WeakPolarHBondContact O-CB 3.37Å; A235-K239 WeakPolarHBondContact O-CG 3.49Å; A235-K239 PolarHBondContact O-N 3.44Å; F237-K239 VanDerWaalsContact C-N 3.32Å; F237-K239 PolarHBondContact O-N 3.31Å; K239-R243 WeakPolarHBondContact O-CB 3.48Å; K239-R243 PolarHBondContact O-N 3.46Å
240R79.6Confident76.3Confident166 Ų166119.6 Ų119.663%0.62653%0.527SS*.Hα-helixtrans-63.9-42.6175.7-76.1176.9179.1-172.3-1111.8R236 F237 I238 R243 R244R236-R240 WeakPolarHBondContact O-CG 3.48Å; R236-R240 PolarHBondContact O-N 2.99Å; F237-R240 WeakPolarHBondContact O-CB 3.4Å; F237-R240 PolarHBondContact O-N 3.44Å; I238-R240 VanDerWaalsContact C-N 3.35Å; I238-R240 PolarHBondContact O-N 2.88Å; R240-R243 PolarHBondContact O-N 2.91Å; R240-R244 PolarHBondContact O-N 3.26Å; R240-R244 VanDerWaalsContact O-N 3.1Å
241V82Confident74.9Confident58 Ų58117.4 Ų117.435%0.35254%0.535SS..Hα-helixtrans-65.1-48.7177.6174.90000111.1F237 I238 R243 R244 L245F237-V241 HydrophobicContact CD1-CG2 4.26Å; F237-V241 HydrophobicContact CE1-CG2 3.87Å; F237-V241 HydrophobicContact CE2-CG2 4.21Å; F237-V241 HydrophobicContact CZ-CG2 3.84Å; F237-V241 WeakPolarHBondContact O-CG2 3.47Å; F237-V241 PolarHBondContact O-N 2.93Å; I238-V241 PolarHBondContact O-N 3.07Å; V241-R243 VanDerWaalsContact C-N 3.28Å; V241-R243 PolarHBondContact O-N 3.37Å; V241-R244 PolarHBondContact O-N 2.8Å; V241-R244 VanDerWaalsContact O-N 3.08Å; V241-L245 HydrophobicContact CG1-CD1 4.26Å; V241-L245 PolarHBondContact O-N 3.39Å
242K78.6Confident73.5Confident122 Ų122121.6 Ų121.653%0.5356%0.563SS.*Hα-helixtrans-56.8-40175.3-78.2-174.3176.3-179.40112.2I238 L245 R246I238-K242 HydrophobicContact CG2-CD 4.39Å; I238-K242 PolarHBondContact O-N 3.35Å; K242-L245 PolarHBondContact O-N 3.2Å; K242-R246 PolarHBondContact O-N 3.06Å
243R79.3Confident72.7Confident187 Ų187119.5 Ų119.571%0.70657%0.57SS**Hα-helixtrans-64.3-39.3176.4-165.917779.3177.66.6112.4K239 R240 V241 R247K239-R243 WeakPolarHBondContact O-CB 3.48Å; K239-R243 PolarHBondContact O-N 3.46Å; R240-R243 PolarHBondContact O-N 2.91Å; V241-R243 VanDerWaalsContact C-N 3.28Å; V241-R243 PolarHBondContact O-N 3.37Å; R243-R247 PolarHBondContact O-N 3.17Å; R243-R247 VanDerWaalsContact O-N 3.14Å
244R81.3Confident71.7Confident181 Ų181121.1 Ų121.168%0.68358%0.583SS**Hα-helixtrans-65.4-45.6175.7-74-179.4177.1-174.2-2.4111.6R240 V241 R246 R247 N248R240-R244 PolarHBondContact O-N 3.26Å; R240-R244 VanDerWaalsContact O-N 3.1Å; V241-R244 PolarHBondContact O-N 2.8Å; V241-R244 VanDerWaalsContact O-N 3.08Å; R244-R246 VanDerWaalsContact C-N 3.34Å; R244-R246 PolarHBondContact O-N 3.2Å; R244-R247 PolarHBondContact O-N 3.27Å; R244-N248 PolarHBondContact O-N 3.49Å; R244-N248 PolarHBondContact O-OD1 2.93Å
245L81.4Confident70.9Confident106 Ų106125.5 Ų125.556%0.55560%0.603SS**Hα-helixtrans-61.6-40.4177.3-68.7173.9000112.3V241 K242 R247 N248 R249V241-L245 HydrophobicContact CG1-CD1 4.26Å; V241-L245 PolarHBondContact O-N 3.39Å; K242-L245 PolarHBondContact O-N 3.2Å; L245-R247 PolarHBondContact O-N 2.86Å; L245-N248 PolarHBondContact O-N 2.78Å; L245-R249 PolarHBondContact O-N 2.89Å; L245-R249 VanDerWaalsContact O-N 3.09Å
246R79.2Confident70Confident202 Ų202131 Ų13176%0.76264%0.637SS**Hα-helixtrans-64.6-38.7176.1-16317679.8-175.87.5112.3K242 R244 R249 G250K242-R246 PolarHBondContact O-N 3.06Å; R244-R246 VanDerWaalsContact C-N 3.34Å; R244-R246 PolarHBondContact O-N 3.2Å; R246-R249 PolarHBondContact O-N 3.46Å; R246-G250 PolarHBondContact O-N 3.14Å
247R76.9Confident69Low189 Ų189139.3 Ų139.371%0.71368%0.676SS**Hα-helixtrans-64.8-40.1176.2-168.6177.371172.86.6111.9R243 R244 L245 R249 G250R243-R247 PolarHBondContact O-N 3.17Å; R243-R247 VanDerWaalsContact O-N 3.14Å; R244-R247 PolarHBondContact O-N 3.27Å; L245-R247 PolarHBondContact O-N 2.86Å; R247-R249 VanDerWaalsContact C-N 3.34Å; R247-G250 PolarHBondContact O-N 2.87Å
248N76Confident68.5Low119 Ų119139.4 Ų139.464%0.63668%0.679SS**Hα-helixtrans-70-30.8178.4-69.39.6000112.5R244 L245R244-N248 PolarHBondContact O-N 3.49Å; R244-N248 PolarHBondContact O-OD1 2.93Å; L245-N248 PolarHBondContact O-N 2.78Å
249R70Confident68.1Low230 Ų230144.2 Ų144.287%0.86870%0.702SS**Hα-helixtrans-75.1-25.7175.2-77.7-175.2171179.6-3.5114.2L245 R246 R247 G251L245-R249 PolarHBondContact O-N 2.89Å; L245-R249 VanDerWaalsContact O-N 3.09Å; R246-R249 PolarHBondContact O-N 3.46Å; R247-R249 VanDerWaalsContact C-N 3.34Å; R249-G251 VanDerWaalsContact C-N 3.29Å; R249-G251 PolarHBondContact O-N 3.2Å
250G60Low67.6Low70 Ų70145.3 Ų145.372%0.72271%0.711SS**THydrogen-bonded Turntrans-867.4178.800000114.7R246 R247R246-G250 PolarHBondContact O-N 3.14Å; R247-G250 PolarHBondContact O-N 2.87Å
251G53.9Low66.9Low54 Ų54144.1 Ų144.156%0.55772%0.716SS**  trans-102.123-16900000116.4R249 P253R249-G251 VanDerWaalsContact C-N 3.29Å; R249-G251 PolarHBondContact O-N 3.2Å; G251-P253 WeakPolarHBondContact O-CD 3.26Å
252S50Low66Low110 Ų110149.5 Ų149.577%0.76974%0.739SS**  trans-96.994.3161.8-82.50000108.7N254S252-N254 PolarHBondContact O-N 3.37Å
253P54.2Low65.2Low108 Ų108151.3 Ų151.370%0.70175%0.753SS**  trans-65.9119.2162.26.86.7000106.7G251 L255G251-P253 WeakPolarHBondContact O-CD 3.26Å; P253-L255 PolarHBondContact O-N 3.25Å
254N52.9Low64.2Low146 Ų146148.8 Ų148.878%0.78176%0.756SS**  trans-54.3107.5163.3-82.8-22.3000107.7S252 T256S252-N254 PolarHBondContact O-N 3.37Å; N254-T256 PolarHBondContact O-N 3.42Å
255L56.8Low62.8Low168 Ų168146.3 Ų146.388%0.8876%0.762SS**  trans-75.775.3165.8-67.6172000107.5P253P253-L255 PolarHBondContact O-N 3.25Å
256T52.6Low61.3Low123 Ų123149.7 Ų149.776%0.75578%0.779SS**  trans-8998.6160.446.50000107N254N254-T256 PolarHBondContact O-N 3.42Å
257K53.4Low59.7Low277 Ų277144.9 Ų144.9100%1.20478%0.781SS**  trans-68.40147.2-77.3-174.5175.6-177.30108.6

Retrieved 257 of 257 residues in 332.1 ms (Link to these results)