A0A096N8F0_PAPAN Loading...

Olfactory receptor family 4 subfamily D member 5

AlphaFold DB , UniProt , Accession A0A096N8F0, Species PAPAN (Papio anubis, Olive baboon), Gene OR4D5, Length 318 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
1M35Very low53.3Low242 Ų242122.1 Ų122.1100%1.19269%0.685SS**  097.10-83.4162.1164.300107.1
2N31.7Very low55.8Low159 Ų159112.2 Ų112.285%0.8563%0.629SS**  trans-84133.5170.7-75.2-14.2000107.4A4N2-A4 PolarHBondContact O-N 3.41Å
3P38.3Very low58Low118 Ų118107.4 Ų107.477%0.76660%0.604SS**  trans-68.4106.3172.528.9-28.9000106.6N5P3-N5 PolarHBondContact O-N 3.09Å; P3-N5 VanDerWaalsContact O-N 3.11Å
4A44.8Very low59.9Low73 Ų7399.7 Ų99.760%0.60356%0.561SS**  trans-64.2114.1167.700000106.7N2 H6N2-A4 PolarHBondContact O-N 3.41Å; A4-H6 VanDerWaalsContact C-N 3.32Å; A4-H6 PolarHBondContact O-N 2.74Å
5N42Very low61.4Low157 Ų15796.6 Ų96.684%0.8454%0.542SS*.  trans-56.9100164.4-81.5-25.1000107.2P3 S7P3-N5 PolarHBondContact O-N 3.09Å; P3-N5 VanDerWaalsContact O-N 3.11Å; N5-S7 PolarHBondContact O-N 2.92Å
6H49Very low62.6Low157 Ų15791.2 Ų91.273%0.72752%0.515SS*.  trans-7082.5170.3-74.7-72.2000108.1A4 Q8A4-H6 VanDerWaalsContact C-N 3.32Å; A4-H6 PolarHBondContact O-N 2.74Å; H6-Q8 PolarHBondContact O-N 3.44Å; H6-Q8 VanDerWaalsContact O-N 3.17Å
7S55.3Low63.6Low95 Ų9588 Ų8866%0.66450%0.496SS*.  trans-64113.8166.353.80000107.8N5 V9N5-S7 PolarHBondContact O-N 2.92Å; S7-V9 PolarHBondContact O-N 3.09Å
8Q61.6Low64.6Low181 Ų18184.3 Ų84.385%0.84648%0.477SS*.  trans-62.3120.8175.8-155.2176.826.500108.5H6 T10H6-Q8 PolarHBondContact O-N 3.44Å; H6-Q8 VanDerWaalsContact O-N 3.17Å; Q8-T10 PolarHBondContact O-N 3.36Å
9V70Confident65.3Low24 Ų2486.7 Ų86.715%0.14548%0.484CS..  trans-59.8122.4179.1175.60000109.1S7 G11 F12 F168S7-V9 PolarHBondContact O-N 3.09Å; V9-G11 VanDerWaalsContact CG1-O 3.3Å; V9-G11 WeakPolarHBondContact CG1-O 3.47Å; V9-F12 HydrophobicContact CG1-CD1 4.3Å; V9-F12 HydrophobicContact CG1-CE1 3.85Å; V9-F12 HydrophobicContact CG1-CZ 4.12Å; V9-F168 HydrophobicContact CB-CB 4.4Å; V9-F168 HydrophobicContact CG2-CB 3.81Å
10T77.1Confident66.4Low122 Ų12286.2 Ų86.275%0.74848%0.482SS*.  trans-91.8-22.9-175.955.90000112.6Q8 F94Q8-T10 PolarHBondContact O-N 3.36Å; T10-F94 PolarHBondContact O-N 3.05Å; T10-F94 VanDerWaalsContact O-N 3.16Å
11G81Confident67.2Low15 Ų1590.2 Ų90.216%0.15549%0.49CS..EExtended strand (participates in β ladder)trans-172.2177.5178.900000113V9 I92V9-G11 VanDerWaalsContact CG1-O 3.3Å; V9-G11 WeakPolarHBondContact CG1-O 3.47Å; G11-I92 CarbonylContact C-O 3.45Å; G11-I92 WeakPolarHBondContact CA-O 3.45Å
12F84.1Confident69.8Low3 Ų386.1 Ų86.11%0.01347%0.468CS..EExtended strand (participates in β ladder)trans-128.8154.1-179.6-55.6-76.8000111V9 T91 I92 F94 C97 D172 L174 L184 L187V9-F12 HydrophobicContact CG1-CD1 4.3Å; V9-F12 HydrophobicContact CG1-CE1 3.85Å; V9-F12 HydrophobicContact CG1-CZ 4.12Å; F12-T91 CarbonylContact O-C 3.37Å; F12-T91 VanDerWaalsContact O-CA 3.29Å; F12-T91 WeakPolarHBondContact O-CA 3.22Å; F12-I92 HydrophobicContact CB-CG2 3.95Å; F12-I92 HydrophobicContact CD2-CG2 4.49Å; F12-I92 PolarHBondContact N-O 3.19Å; F12-I92 PolarHBondContact O-N 3.06Å; F12-F94 AromaticContact CE2-CD2 3.6Å; F12-F94 HydrophobicContact CE2-CD2 3.6Å; F12-F94 HydrophobicContact CE2-CE2 4.32Å; F12-F94 AromaticContact CZ-CD2 3.8Å; F12-F94 HydrophobicContact CZ-CD2 3.8Å; F12-F94 HydrophobicContact CZ-CE2 4.26Å; F12-C97 HydrophobicContact CD2-CB 3.94Å; F12-C97 HydrophobicContact CE2-CB 4.11Å; F12-D172 CarbonylContact C-O 3.42Å; F12-D172 WeakPolarHBondContact CA-O 3.25Å; F12-L174 HydrophobicContact CB-CD1 3.67Å; F12-L174 HydrophobicContact CB-CG 4.15Å; F12-L174 HydrophobicContact CD1-CD1 4.32Å; F12-L174 HydrophobicContact CD1-CG 4.4Å; F12-L174 HydrophobicContact CD2-CD1 4.26Å; F12-L174 HydrophobicContact CG-CD1 3.85Å; F12-L174 HydrophobicContact CG-CG 4.36Å; F12-L184 HydrophobicContact CD2-CD2 4.48Å; F12-L184 HydrophobicContact CE1-CD2 4.26Å; F12-L184 HydrophobicContact CE2-CD2 3.89Å; F12-L184 HydrophobicContact CZ-CD2 3.77Å; F12-L187 HydrophobicContact CD1-CD2 3.67Å; F12-L187 HydrophobicContact CE1-CD2 3.66Å
13V84.3Confident72.4Confident50 Ų5082.2 Ų82.230%0.30345%0.447SS..EExtended strand (participates in β ladder)trans-105.4115.3174.1-175.60000108.2P90 T91 D172 E173 L174V13-P90 CarbonylContact C-O 3.58Å; V13-P90 WeakPolarHBondContact CA-O 3.47Å; V13-P90 HydrophobicContact CG1-CG 3.95Å; V13-T91 HydrophobicContact CG2-CG2 4.27Å; V13-D172 PolarHBondContact N-O 3.29Å; V13-E173 HydrophobicContact CB-CG 4.31Å; V13-E173 CarbonylContact O-C 3.57Å; V13-E173 WeakPolarHBondContact O-CA 3.42Å; V13-L174 PolarHBondContact O-N 2.83Å
14L84.4Confident74.7Confident0 Ų078.1 Ų78.10%042%0.416CS..EExtended strand (participates in β ladder)trans-82.5118.2175.6-65.5164000109.2G16 R80 P90 I92 L174 N176L14-G16 PolarHBondContact O-N 3.44Å; L14-G16 VanDerWaalsContact O-N 3.11Å; L14-R80 HydrophobicContact CD1-CG 4.22Å; L14-P90 HydrophobicContact CB-CB 4.18Å; L14-P90 PolarHBondContact N-O 3.41Å; L14-P90 WeakPolarHBondContact O-CB 3.46Å; L14-P90 WeakPolarHBondContact O-CG 3.47Å; L14-I92 HydrophobicContact CD1-CB 4.39Å; L14-I92 HydrophobicContact CD1-CG2 4.2Å; L14-I92 HydrophobicContact CG-CG2 4.23Å; L14-L174 HydrophobicContact CD2-CB 4.04Å; L14-L174 HydrophobicContact CD2-CD1 4.04Å; L14-N176 WeakPolarHBondContact CB-O 3.36Å
15L81.7Confident76.8Confident53 Ų5377.8 Ų77.828%0.27741%0.407SS..  trans-66.3-15.9-179.7-78.5159.8000113.2Q19 L174 D175 N176L15-Q19 PolarHBondContact O-NE2 3.01Å; L15-L174 PolarHBondContact N-O 2.97Å; L15-D175 HydrophobicContact CD1-CB 3.86Å; L15-N176 PolarHBondContact N-O 3.34Å
16G81.5Confident79Confident10 Ų1076 Ų7610%0.10339%0.392CS..  trans64-158.8176.600000113.2L14 N176 K269L14-G16 PolarHBondContact O-N 3.44Å; L14-G16 VanDerWaalsContact O-N 3.11Å; G16-N176 PolarHBondContact N-O 2.91Å; G16-K269 WeakPolarHBondContact O-CE 3.22Å; G16-K269 PolarHBondContact O-NZ 2.99Å
17L80.3Confident80.9Confident37 Ų3771 Ų7119%0.19437%0.368CS..SBendtrans-92.9-34.3-174.8-68176.6000114.3F27 F31 M81 F177 V273L17-F27 HydrophobicContact CB-CD2 4.04Å; L17-F27 HydrophobicContact CB-CE2 4.26Å; L17-F31 HydrophobicContact CD1-CD2 3.86Å; L17-F31 HydrophobicContact CD1-CE2 3.18Å; L17-F31 HydrophobicContact CD1-CZ 3.7Å; L17-M81 HydrophobicContact CD1-CG 4.37Å; L17-M81 HydrophobicContact CD1-SD 3.71Å; L17-M81 HydrophobicContact CG-SD 4.45Å; L17-F177 HydrophobicContact CD2-CD1 3.8Å; L17-F177 HydrophobicContact CD2-CE1 4.24Å; L17-F177 HydrophobicContact CG-CD1 4.29Å; L17-V273 HydrophobicContact CD1-CG2 4.4Å; L17-V273 HydrophobicContact CD2-CG2 3.88Å
18S81Confident82.6Confident22 Ų2269.1 Ų69.115%0.15435%0.348CS..  trans-159.6147.9177.6-179.70000110.9V20 L23 R24S18-V20 PolarHBondContact OG-N 3.24Å; S18-V20 VanDerWaalsContact OG-N 3.16Å; S18-L23 WeakPolarHBondContact OG-CB 3.39Å; S18-L23 WeakPolarHBondContact OG-CD1 3.47Å; S18-R24 WeakPolarHBondContact O-CD 3.38Å; S18-R24 WeakPolarHBondContact O-CG 3.49Å
19Q78.1Confident84Confident130 Ų13064.6 Ų64.661%0.60733%0.333SS*.SBendtrans-94.9-11.1174.7-61.6-61.3-30.700112.4L15L15-Q19 PolarHBondContact O-NE2 3.01Å
20V86.3Confident84.9Confident76 Ų7666.1 Ų66.146%0.46134%0.342SS..SBendtrans-80.8124.3179.3-1780000109.6S18 E22 L23 R24S18-V20 PolarHBondContact OG-N 3.24Å; S18-V20 VanDerWaalsContact OG-N 3.16Å; V20-E22 HydrophobicContact CG1-CB 4.45Å; V20-E22 PolarHBondContact O-N 2.91Å; V20-L23 HydrophobicContact CB-CB 4.22Å; V20-L23 HydrophobicContact CB-CD1 4.05Å; V20-L23 HydrophobicContact CB-CG 4.21Å; V20-L23 HydrophobicContact CG1-CG 4.39Å; V20-L23 HydrophobicContact CG2-CD1 4.32Å; V20-L23 PolarHBondContact O-N 3.46Å; V20-L23 VanDerWaalsContact O-N 3.15Å; V20-R24 WeakPolarHBondContact O-CG 3.44Å; V20-R24 PolarHBondContact O-N 3.15Å
21W84.5Confident85.6Confident171 Ų17161 Ų6165%0.64831%0.309SS*.Hα-helixtrans-52.5-48.3-176.6175-103.7000113.5L23 R24 V25W21-L23 VanDerWaalsContact C-N 3.33Å; W21-L23 PolarHBondContact O-N 3.35Å; W21-R24 WeakPolarHBondContact O-CB 3.49Å; W21-R24 PolarHBondContact O-N 3.48Å; W21-R24 VanDerWaalsContact O-N 3.11Å; W21-V25 HydrophobicContact CD2-CG2 4.31Å; W21-V25 HydrophobicContact CZ2-CG2 3.99Å; W21-V25 WeakPolarHBondContact O-CG2 3.41Å; W21-V25 PolarHBondContact O-N 2.92Å
22E88.6Confident86.1Confident155 Ų15562.3 Ų62.372%0.72432%0.316SS*.Hα-helixtrans-59.4-43.6-179.8-63.9170.3178.500111.9V20 V25 F26V20-E22 HydrophobicContact CG1-CB 4.45Å; V20-E22 PolarHBondContact O-N 2.91Å; E22-V25 PolarHBondContact O-N 3.03Å; E22-F26 WeakPolarHBondContact O-CB 3.48Å; E22-F26 PolarHBondContact O-N 3.37Å
23L86.4Confident86.4Confident77 Ų7764.8 Ų64.840%0.40334%0.337SS..Hα-helixtrans-68.5-35.3176.3-68.4178.2000111.9S18 V20 W21 F26 F27S18-L23 WeakPolarHBondContact OG-CB 3.39Å; S18-L23 WeakPolarHBondContact OG-CD1 3.47Å; V20-L23 HydrophobicContact CB-CB 4.22Å; V20-L23 HydrophobicContact CB-CD1 4.05Å; V20-L23 HydrophobicContact CB-CG 4.21Å; V20-L23 HydrophobicContact CG1-CG 4.39Å; V20-L23 HydrophobicContact CG2-CD1 4.32Å; V20-L23 PolarHBondContact O-N 3.46Å; V20-L23 VanDerWaalsContact O-N 3.15Å; W21-L23 VanDerWaalsContact C-N 3.33Å; W21-L23 PolarHBondContact O-N 3.35Å; L23-F26 PolarHBondContact O-N 3.01Å; L23-F27 HydrophobicContact CB-CD2 4.38Å; L23-F27 HydrophobicContact CB-CE2 4.17Å; L23-F27 VanDerWaalsContact O-CB 3.31Å; L23-F27 WeakPolarHBondContact O-CB 3.47Å; L23-F27 WeakPolarHBondContact O-CD2 3.24Å; L23-F27 VanDerWaalsContact O-CG 3.25Å; L23-F27 WeakPolarHBondContact O-CG 3.49Å; L23-F27 PolarHBondContact O-N 2.9Å
24R87.5Confident86.7Confident33 Ų3363.9 Ų63.913%0.12533%0.33CS..Hα-helixtrans-63.3-44.5175.7-74.8176.253.7-169.7-8.9111.8S18 V20 W21 F27 F28 L85 L86 G88S18-R24 WeakPolarHBondContact O-CD 3.38Å; S18-R24 WeakPolarHBondContact O-CG 3.49Å; V20-R24 WeakPolarHBondContact O-CG 3.44Å; V20-R24 PolarHBondContact O-N 3.15Å; W21-R24 WeakPolarHBondContact O-CB 3.49Å; W21-R24 PolarHBondContact O-N 3.48Å; W21-R24 VanDerWaalsContact O-N 3.11Å; R24-F27 PolarHBondContact O-N 3.46Å; R24-F28 VanDerWaalsContact O-CB 3.25Å; R24-F28 WeakPolarHBondContact O-CB 3.46Å; R24-F28 PolarHBondContact O-N 2.92Å; R24-L85 HydrophobicContact CB-CD2 4.24Å; R24-L85 HydrophobicContact CG-CD2 4.12Å; R24-L85 PolarHBondContact NE-O 3.03Å; R24-L85 PolarHBondContact NH2-O 3.3Å; R24-L86 PolarHBondContact NH2-O 3.29Å; R24-G88 VanDerWaalsContact CZ-CA 3.5Å; R24-G88 VanDerWaalsContact NH1-CA 3.34Å
25V87.4Confident87Confident66 Ų6666.5 Ų66.540%0.434%0.34SS..Hα-helixtrans-63.2-46.9175.91760000110.4W21 E22 F27 F28 T29W21-V25 HydrophobicContact CD2-CG2 4.31Å; W21-V25 HydrophobicContact CZ2-CG2 3.99Å; W21-V25 WeakPolarHBondContact O-CG2 3.41Å; W21-V25 PolarHBondContact O-N 2.92Å; E22-V25 PolarHBondContact O-N 3.03Å; V25-F27 PolarHBondContact O-N 3.31Å; V25-F28 PolarHBondContact O-N 3.18Å; V25-T29 PolarHBondContact O-N 3.47Å; V25-T29 PolarHBondContact O-OG1 3.39Å; V25-T29 VanDerWaalsContact O-OG1 3.09Å
26F89.8Confident87.4Confident120 Ų12070.3 Ų70.353%0.52636%0.355SS..Hα-helixtrans-57.2-51.4176.5173.8-100.6000112.1E22 L23 F28 T29 V30E22-F26 WeakPolarHBondContact O-CB 3.48Å; E22-F26 PolarHBondContact O-N 3.37Å; L23-F26 PolarHBondContact O-N 3.01Å; F26-F28 VanDerWaalsContact C-N 3.35Å; F26-F28 PolarHBondContact O-N 2.93Å; F26-T29 PolarHBondContact O-N 2.84Å; F26-V30 HydrophobicContact CD2-CG2 4.35Å; F26-V30 HydrophobicContact CE1-CG2 4.17Å; F26-V30 HydrophobicContact CE2-CG2 3.94Å; F26-V30 HydrophobicContact CZ-CG2 3.84Å; F26-V30 WeakPolarHBondContact O-CG2 3.49Å; F26-V30 PolarHBondContact O-N 2.99Å
27F89.2Confident87.8Confident52 Ų5275.3 Ų75.323%0.22838%0.377CS..Hα-helixtrans-61.8-42.7177.8-72.1-36000111.6L17 L23 R24 V25 T29 V30 F31 L85L17-F27 HydrophobicContact CB-CD2 4.04Å; L17-F27 HydrophobicContact CB-CE2 4.26Å; L23-F27 HydrophobicContact CB-CD2 4.38Å; L23-F27 HydrophobicContact CB-CE2 4.17Å; L23-F27 VanDerWaalsContact O-CB 3.31Å; L23-F27 WeakPolarHBondContact O-CB 3.47Å; L23-F27 WeakPolarHBondContact O-CD2 3.24Å; L23-F27 VanDerWaalsContact O-CG 3.25Å; L23-F27 WeakPolarHBondContact O-CG 3.49Å; L23-F27 PolarHBondContact O-N 2.9Å; R24-F27 PolarHBondContact O-N 3.46Å; V25-F27 PolarHBondContact O-N 3.31Å; F27-T29 VanDerWaalsContact C-N 3.33Å; F27-T29 PolarHBondContact O-N 3.26Å; F27-V30 PolarHBondContact O-N 3.29Å; F27-F31 HydrophobicContact CB-CD2 3.76Å; F27-F31 HydrophobicContact CB-CE2 3.73Å; F27-F31 AromaticContact CD1-CE2 3.75Å; F27-F31 HydrophobicContact CD1-CE2 3.75Å; F27-F31 HydrophobicContact CG-CD2 4.44Å; F27-F31 AromaticContact CG-CE2 3.9Å; F27-F31 HydrophobicContact CG-CE2 3.9Å; F27-F31 VanDerWaalsContact O-CB 3.3Å; F27-F31 WeakPolarHBondContact O-CB 3.5Å; F27-F31 WeakPolarHBondContact O-CD2 3.28Å; F27-F31 WeakPolarHBondContact O-CG 3.43Å; F27-F31 PolarHBondContact O-N 3.27Å; F27-L85 HydrophobicContact CB-CD1 4.04Å; F27-L85 HydrophobicContact CB-CD2 4.05Å
28F90.3Very high88.2Confident54 Ų5473.6 Ų73.624%0.23737%0.368CS..Hα-helixtrans-56-48.6176.2174.5-99.7000111.4R24 V25 F26 S32 L82 L85 L86R24-F28 VanDerWaalsContact O-CB 3.25Å; R24-F28 WeakPolarHBondContact O-CB 3.46Å; R24-F28 PolarHBondContact O-N 2.92Å; V25-F28 PolarHBondContact O-N 3.18Å; F26-F28 VanDerWaalsContact C-N 3.35Å; F26-F28 PolarHBondContact O-N 2.93Å; F28-S32 WeakPolarHBondContact O-CB 3.1Å; F28-S32 PolarHBondContact O-N 3.02Å; F28-L82 HydrophobicContact CD2-CB 4.29Å; F28-L82 HydrophobicContact CD2-CD2 3.75Å; F28-L82 HydrophobicContact CE2-CB 4.16Å; F28-L82 HydrophobicContact CE2-CD2 4.05Å; F28-L85 HydrophobicContact CB-CB 4.17Å; F28-L85 HydrophobicContact CB-CD1 4.46Å; F28-L85 HydrophobicContact CD2-CB 4.49Å; F28-L86 HydrophobicContact CD1-CD2 4.04Å; F28-L86 HydrophobicContact CD2-CD1 4.07Å; F28-L86 HydrophobicContact CD2-CD2 3.82Å; F28-L86 HydrophobicContact CD2-CG 3.56Å; F28-L86 HydrophobicContact CE1-CD2 3.91Å; F28-L86 HydrophobicContact CE1-CG 4.5Å; F28-L86 HydrophobicContact CE2-CD1 3.33Å; F28-L86 HydrophobicContact CE2-CD2 3.69Å; F28-L86 HydrophobicContact CE2-CG 3.36Å; F28-L86 HydrophobicContact CG-CD2 4Å; F28-L86 HydrophobicContact CG-CG 4.23Å; F28-L86 HydrophobicContact CZ-CD1 3.68Å; F28-L86 HydrophobicContact CZ-CD2 3.73Å; F28-L86 HydrophobicContact CZ-CG 3.88Å
29T90.2Very high88.7Confident87 Ų8773.8 Ų73.853%0.53437%0.368SS..Hα-helixtrans-60.7-48.8178.5-55.80000111.8V25 F26 F27 A33V25-T29 PolarHBondContact O-N 3.47Å; V25-T29 PolarHBondContact O-OG1 3.39Å; V25-T29 VanDerWaalsContact O-OG1 3.09Å; F26-T29 PolarHBondContact O-N 2.84Å; F27-T29 VanDerWaalsContact C-N 3.33Å; F27-T29 PolarHBondContact O-N 3.26Å; T29-A33 PolarHBondContact O-N 2.94Å; T29-A33 VanDerWaalsContact O-N 3.12Å
30V90.4Very high89.3Confident55 Ų5570.7 Ų70.733%0.33336%0.358SS..Hα-helixtrans-66.1-48.9-177.5175.20000111.3F26 F27 S32 A33 M34F26-V30 HydrophobicContact CD2-CG2 4.35Å; F26-V30 HydrophobicContact CE1-CG2 4.17Å; F26-V30 HydrophobicContact CE2-CG2 3.94Å; F26-V30 HydrophobicContact CZ-CG2 3.84Å; F26-V30 WeakPolarHBondContact O-CG2 3.49Å; F26-V30 PolarHBondContact O-N 2.99Å; F27-V30 PolarHBondContact O-N 3.29Å; V30-S32 PolarHBondContact O-N 3.49Å; V30-A33 PolarHBondContact O-N 2.72Å; V30-M34 HydrophobicContact CG1-CE 3.8Å; V30-M34 HydrophobicContact CG1-SD 4.42Å; V30-M34 WeakPolarHBondContact O-CG 3.19Å; V30-M34 PolarHBondContact O-N 3.31Å
31F90.4Very high89.4Confident14 Ų1468 Ų686%0.06135%0.345CS..Hα-helixtrans-68.8-33.5-179.5-70.4-60.4000113L17 F27 M34 Y35 M81 L82 L85 V273 I277L17-F31 HydrophobicContact CD1-CD2 3.86Å; L17-F31 HydrophobicContact CD1-CE2 3.18Å; L17-F31 HydrophobicContact CD1-CZ 3.7Å; F27-F31 HydrophobicContact CB-CD2 3.76Å; F27-F31 HydrophobicContact CB-CE2 3.73Å; F27-F31 AromaticContact CD1-CE2 3.75Å; F27-F31 HydrophobicContact CD1-CE2 3.75Å; F27-F31 HydrophobicContact CG-CD2 4.44Å; F27-F31 AromaticContact CG-CE2 3.9Å; F27-F31 HydrophobicContact CG-CE2 3.9Å; F27-F31 VanDerWaalsContact O-CB 3.3Å; F27-F31 WeakPolarHBondContact O-CB 3.5Å; F27-F31 WeakPolarHBondContact O-CD2 3.28Å; F27-F31 WeakPolarHBondContact O-CG 3.43Å; F27-F31 PolarHBondContact O-N 3.27Å; F31-M34 HydrophobicContact CD1-CE 3.12Å; F31-M34 HydrophobicContact CE1-CE 3.33Å; F31-M34 HydrophobicContact CG-CE 4.06Å; F31-M34 HydrophobicContact CZ-CE 4.4Å; F31-M34 PolarHBondContact O-N 3.43Å; F31-Y35 VanDerWaalsContact O-CB 3.32Å; F31-Y35 WeakPolarHBondContact O-CB 3.47Å; F31-Y35 PolarHBondContact O-N 2.94Å; F31-M81 HydrophobicContact CB-CE 3.42Å; F31-M81 VanDerWaalsContact CB-CE 3.42Å; F31-M81 HydrophobicContact CD1-CE 3.68Å; F31-M81 HydrophobicContact CD2-CE 3.78Å; F31-M81 HydrophobicContact CD2-SD 4.3Å; F31-M81 HydrophobicContact CE1-CE 4.45Å; F31-M81 HydrophobicContact CG-CE 3.33Å; F31-M81 HydrophobicContact CG-SD 4.33Å; F31-L82 HydrophobicContact CB-CD2 3.83Å; F31-L85 HydrophobicContact CD2-CD1 4.15Å; F31-V273 HydrophobicContact CE1-CG1 3.51Å; F31-V273 HydrophobicContact CE1-CG2 4.31Å; F31-V273 HydrophobicContact CZ-CG1 3.84Å; F31-V273 HydrophobicContact CZ-CG2 4.12Å; F31-I277 HydrophobicContact CD1-CD1 3.71Å; F31-I277 HydrophobicContact CD1-CG2 4.17Å; F31-I277 HydrophobicContact CE1-CD1 4.11Å; F31-I277 HydrophobicContact CG-CD1 4.49Å
32S91.3Very high89.7Confident43 Ų4359.8 Ų59.830%0.30131%0.314SS..Hα-helixtrans-64-44.8174.4-175.90000110.8F28 V30 M34 Y35 F36F28-S32 WeakPolarHBondContact O-CB 3.1Å; F28-S32 PolarHBondContact O-N 3.02Å; V30-S32 PolarHBondContact O-N 3.49Å; S32-M34 PolarHBondContact O-N 3.16Å; S32-Y35 PolarHBondContact O-N 2.72Å; S32-F36 WeakPolarHBondContact O-CB 3.41Å; S32-F36 PolarHBondContact O-N 3.07Å
33A90.9Very high89.8Confident56 Ų5655.6 Ų55.646%0.46330%0.296SS..Hα-helixtrans-61-45.9175.100000111.9T29 V30 Y35 F36 M37T29-A33 PolarHBondContact O-N 2.94Å; T29-A33 VanDerWaalsContact O-N 3.12Å; V30-A33 PolarHBondContact O-N 2.72Å; A33-Y35 PolarHBondContact O-N 3.47Å; A33-F36 PolarHBondContact O-N 2.95Å; A33-M37 VanDerWaalsContact O-CG 3.29Å; A33-M37 WeakPolarHBondContact O-CG 3.36Å; A33-M37 PolarHBondContact O-N 3.07Å
34M89.6Confident89.9Confident30 Ų3055 Ų5515%0.14829%0.293CS..Hα-helixtrans-63.8-40.9177.6-67-169.3-65.100112.3V30 F31 S32 M37 T38 I277 M281V30-M34 HydrophobicContact CG1-CE 3.8Å; V30-M34 HydrophobicContact CG1-SD 4.42Å; V30-M34 WeakPolarHBondContact O-CG 3.19Å; V30-M34 PolarHBondContact O-N 3.31Å; F31-M34 HydrophobicContact CD1-CE 3.12Å; F31-M34 HydrophobicContact CE1-CE 3.33Å; F31-M34 HydrophobicContact CG-CE 4.06Å; F31-M34 HydrophobicContact CZ-CE 4.4Å; F31-M34 PolarHBondContact O-N 3.43Å; S32-M34 PolarHBondContact O-N 3.16Å; M34-M37 PolarHBondContact O-N 3.29Å; M34-T38 WeakPolarHBondContact O-CB 3.14Å; M34-T38 PolarHBondContact O-N 3.41Å; M34-T38 PolarHBondContact O-OG1 3.26Å; M34-I277 HydrophobicContact CB-CG2 4.07Å; M34-I277 HydrophobicContact CE-CG2 4.06Å; M34-M281 HydrophobicContact CB-SD 3.82Å; M34-M281 HydrophobicContact CG-SD 3.54Å; M34-M281 VanDerWaalsContact CG-SD 3.54Å; M34-M281 HydrophobicContact SD-SD 4.01Å
35Y91.5Very high89.9Confident55 Ų5553.6 Ų53.622%0.21629%0.288CS..Hα-helixtrans-61.6-47.9175.5176.8-117.7000111.2F31 S32 A33 M37 T38 V39 S75 A78 P79 L82F31-Y35 VanDerWaalsContact O-CB 3.32Å; F31-Y35 WeakPolarHBondContact O-CB 3.47Å; F31-Y35 PolarHBondContact O-N 2.94Å; S32-Y35 PolarHBondContact O-N 2.72Å; A33-Y35 PolarHBondContact O-N 3.47Å; Y35-M37 PolarHBondContact O-N 3.07Å; Y35-T38 WeakPolarHBondContact O-CB 3.45Å; Y35-T38 PolarHBondContact O-N 2.99Å; Y35-T38 VanDerWaalsContact O-N 3.13Å; Y35-V39 HydrophobicContact CD1-CG2 4.44Å; Y35-V39 HydrophobicContact CD2-CG2 3.99Å; Y35-V39 HydrophobicContact CE1-CG2 4.02Å; Y35-V39 HydrophobicContact CE2-CG2 3.51Å; Y35-V39 HydrophobicContact CG-CG2 4.43Å; Y35-V39 WeakPolarHBondContact O-CG2 3.44Å; Y35-V39 PolarHBondContact O-N 2.97Å; Y35-S75 PolarHBondContact OH-OG 2.97Å; Y35-A78 HydrophobicContact CD2-CB 3.67Å; Y35-A78 HydrophobicContact CE2-CB 4.26Å; Y35-A78 HydrophobicContact CG-CB 4.11Å; Y35-P79 HydrophobicContact CE2-CG 4.5Å; Y35-L82 HydrophobicContact CD1-CD1 4.26Å; Y35-L82 HydrophobicContact CG-CD1 4.5Å
36F90.8Very high90Very high133 Ų13352.1 Ų52.158%0.58328%0.279SS*.Hα-helixtrans-59.4-45.5177.3-175.1-99.1000112S32 A33 T38 V39 V40S32-F36 WeakPolarHBondContact O-CB 3.41Å; S32-F36 PolarHBondContact O-N 3.07Å; A33-F36 PolarHBondContact O-N 2.95Å; F36-T38 VanDerWaalsContact C-N 3.29Å; F36-T38 PolarHBondContact O-N 2.92Å; F36-V39 PolarHBondContact O-N 3.33Å; F36-V40 HydrophobicContact CD1-CG2 4.09Å; F36-V40 HydrophobicContact CD2-CG2 4.27Å; F36-V40 HydrophobicContact CE1-CG2 3.69Å; F36-V40 HydrophobicContact CE2-CG2 3.89Å; F36-V40 HydrophobicContact CG-CG2 4.37Å; F36-V40 HydrophobicContact CZ-CG2 3.59Å; F36-V40 WeakPolarHBondContact O-CB 3.36Å; F36-V40 WeakPolarHBondContact O-CG2 3.33Å; F36-V40 PolarHBondContact O-N 3.21Å
37M88.6Confident89.9Confident115 Ų11549.6 Ų49.657%0.56727%0.273SS*.Hα-helixtrans-60.8-39.3175.7-71.2-58-63.500112.2A33 M34 Y35 G41 M281A33-M37 VanDerWaalsContact O-CG 3.29Å; A33-M37 WeakPolarHBondContact O-CG 3.36Å; A33-M37 PolarHBondContact O-N 3.07Å; M34-M37 PolarHBondContact O-N 3.29Å; Y35-M37 PolarHBondContact O-N 3.07Å; M37-G41 WeakPolarHBondContact O-CA 3.4Å; M37-G41 PolarHBondContact O-N 3.39Å; M37-M281 HydrophobicContact CB-CG 4.27Å
38T89.9Confident89.7Confident1 Ų147.3 Ų47.31%0.00626%0.263CS..Hα-helixtrans-64-48.9176.6-56.80000111.1M34 Y35 F36 N42 S74 P280 M281M34-T38 WeakPolarHBondContact O-CB 3.14Å; M34-T38 PolarHBondContact O-N 3.41Å; M34-T38 PolarHBondContact O-OG1 3.26Å; Y35-T38 WeakPolarHBondContact O-CB 3.45Å; Y35-T38 PolarHBondContact O-N 2.99Å; Y35-T38 VanDerWaalsContact O-N 3.13Å; F36-T38 VanDerWaalsContact C-N 3.29Å; F36-T38 PolarHBondContact O-N 2.92Å; T38-N42 WeakPolarHBondContact CG2-ND2 3.3Å; T38-N42 VanDerWaalsContact O-CB 3.28Å; T38-N42 WeakPolarHBondContact O-CB 3.26Å; T38-N42 PolarHBondContact O-N 3.04Å; T38-N42 PolarHBondContact O-ND2 3.28Å; T38-S74 WeakPolarHBondContact CG2-OG 3.04Å; T38-P280 HydrophobicContact CG2-CB 3.81Å; T38-M281 VanDerWaalsContact OG1-CA 3.29Å; T38-M281 WeakPolarHBondContact OG1-CA 3.47Å; T38-M281 VanDerWaalsContact OG1-CB 3.3Å; T38-M281 WeakPolarHBondContact OG1-CB 3.38Å
39V91.1Very high89.4Confident26 Ų2645.3 Ų45.316%0.15826%0.256CS..Hα-helixtrans-61.7-54.1179.8171.70000110.4Y35 F36 L43 F71Y35-V39 HydrophobicContact CD1-CG2 4.44Å; Y35-V39 HydrophobicContact CD2-CG2 3.99Å; Y35-V39 HydrophobicContact CE1-CG2 4.02Å; Y35-V39 HydrophobicContact CE2-CG2 3.51Å; Y35-V39 HydrophobicContact CG-CG2 4.43Å; Y35-V39 WeakPolarHBondContact O-CG2 3.44Å; Y35-V39 PolarHBondContact O-N 2.97Å; F36-V39 PolarHBondContact O-N 3.33Å; V39-L43 HydrophobicContact CG1-CD1 3.67Å; V39-L43 HydrophobicContact CG1-CG 4.43Å; V39-L43 VanDerWaalsContact O-CB 3.26Å; V39-L43 WeakPolarHBondContact O-CB 3.07Å; V39-L43 WeakPolarHBondContact O-CG 3.43Å; V39-L43 PolarHBondContact O-N 3.41Å; V39-F71 HydrophobicContact CB-CD2 4.33Å; V39-F71 HydrophobicContact CG1-CD2 4.08Å; V39-F71 HydrophobicContact CG1-CE2 3.97Å; V39-F71 HydrophobicContact CG2-CD2 3.99Å; V39-F71 HydrophobicContact CG2-CE2 4.1Å
40V89.6Confident89.1Confident66 Ų6645.6 Ų45.640%0.426%0.257SS..Hα-helixtrans-63.6-46.8-177.6173.40000111.1F36 L44F36-V40 HydrophobicContact CD1-CG2 4.09Å; F36-V40 HydrophobicContact CD2-CG2 4.27Å; F36-V40 HydrophobicContact CE1-CG2 3.69Å; F36-V40 HydrophobicContact CE2-CG2 3.89Å; F36-V40 HydrophobicContact CG-CG2 4.37Å; F36-V40 HydrophobicContact CZ-CG2 3.59Å; F36-V40 WeakPolarHBondContact O-CB 3.36Å; F36-V40 WeakPolarHBondContact O-CG2 3.33Å; F36-V40 PolarHBondContact O-N 3.21Å; V40-L44 WeakPolarHBondContact O-CB 3.48Å; V40-L44 PolarHBondContact O-N 3.26Å
41G88.4Confident88.7Confident18 Ų1845.9 Ų45.919%0.18626%0.262CS..Hα-helixtrans-61.9-48.5-177.800000112.5M37 I45M37-G41 WeakPolarHBondContact O-CA 3.4Å; M37-G41 PolarHBondContact O-N 3.39Å; G41-I45 WeakPolarHBondContact O-CG1 3.41Å; G41-I45 PolarHBondContact O-N 2.9Å
42N91.1Very high88.1Confident0 Ų046 Ų460%026%0.263CS..Hα-helixtrans-73.5-40.7-177.3-75-67.8000112.8T38 L44 I45 V46 S67 F71 P280T38-N42 WeakPolarHBondContact CG2-ND2 3.3Å; T38-N42 VanDerWaalsContact O-CB 3.28Å; T38-N42 WeakPolarHBondContact O-CB 3.26Å; T38-N42 PolarHBondContact O-N 3.04Å; T38-N42 PolarHBondContact O-ND2 3.28Å; N42-L44 VanDerWaalsContact C-N 3.31Å; N42-L44 PolarHBondContact O-N 3.24Å; N42-I45 WeakPolarHBondContact O-CB 3.42Å; N42-I45 PolarHBondContact O-N 3.38Å; N42-V46 WeakPolarHBondContact O-CG2 3.3Å; N42-V46 PolarHBondContact O-N 2.93Å; N42-V46 VanDerWaalsContact O-N 3.1Å; N42-S67 WeakPolarHBondContact CB-O 3.3Å; N42-S67 WeakPolarHBondContact OD1-CA 2.95Å; N42-F71 HydrophobicContact CB-CB 4.33Å; N42-P280 PolarHBondContact ND2-O 3.36Å
43L91.1Very high87.5Confident66 Ų6648.2 Ų48.235%0.34628%0.277SS..Hα-helixtrans-64.9-36.5175.5-68.7178.3000111.9V39 I45 V46 V47 F71V39-L43 HydrophobicContact CG1-CD1 3.67Å; V39-L43 HydrophobicContact CG1-CG 4.43Å; V39-L43 VanDerWaalsContact O-CB 3.26Å; V39-L43 WeakPolarHBondContact O-CB 3.07Å; V39-L43 WeakPolarHBondContact O-CG 3.43Å; V39-L43 PolarHBondContact O-N 3.41Å; L43-I45 VanDerWaalsContact C-N 3.28Å; L43-I45 PolarHBondContact O-N 2.55Å; L43-V46 PolarHBondContact O-N 3.44Å; L43-V47 WeakPolarHBondContact O-CG2 3.29Å; L43-V47 PolarHBondContact O-N 2.95Å; L43-F71 HydrophobicContact CD1-CD2 4.3Å; L43-F71 HydrophobicContact CD1-CE2 4.25Å; L43-F71 HydrophobicContact CD2-CD1 4.16Å; L43-F71 HydrophobicContact CD2-CD2 4.23Å; L43-F71 HydrophobicContact CD2-CG 4.01Å; L43-F71 HydrophobicContact CG-CD2 4.16Å; L43-F71 HydrophobicContact CG-CG 4.35Å
44L88.6Confident86.7Confident64 Ų6452.8 Ų52.834%0.33529%0.288SS..Hα-helixtrans-61-39.5174.9-17861000111.5V40 N42 V47 I48 M298 L301V40-L44 WeakPolarHBondContact O-CB 3.48Å; V40-L44 PolarHBondContact O-N 3.26Å; N42-L44 VanDerWaalsContact C-N 3.31Å; N42-L44 PolarHBondContact O-N 3.24Å; L44-V47 PolarHBondContact O-N 3.16Å; L44-I48 HydrophobicContact CD1-CD1 4.03Å; L44-I48 HydrophobicContact CD1-CG1 4.36Å; L44-I48 HydrophobicContact CG-CD1 3.75Å; L44-I48 WeakPolarHBondContact O-CB 3.45Å; L44-I48 VanDerWaalsContact O-CD1 3.3Å; L44-I48 WeakPolarHBondContact O-CD1 3.47Å; L44-I48 WeakPolarHBondContact O-CG1 3.21Å; L44-I48 PolarHBondContact O-N 3.47Å; L44-M298 HydrophobicContact CD2-CE 3.86Å; L44-L301 HydrophobicContact CD1-CD2 4.31Å
45I87.6Confident85.9Confident5 Ų551.6 Ų51.63%0.02628%0.282CS..Hα-helixtrans-63.1-47175.2-66165.5000110.9G41 N42 L43 V47 I48 V49 L63 S67 P284 T288G41-I45 WeakPolarHBondContact O-CG1 3.41Å; G41-I45 PolarHBondContact O-N 2.9Å; N42-I45 WeakPolarHBondContact O-CB 3.42Å; N42-I45 PolarHBondContact O-N 3.38Å; L43-I45 VanDerWaalsContact C-N 3.28Å; L43-I45 PolarHBondContact O-N 2.55Å; I45-V47 VanDerWaalsContact C-N 3.3Å; I45-V47 PolarHBondContact O-N 2.87Å; I45-I48 PolarHBondContact O-N 2.98Å; I45-I48 VanDerWaalsContact O-N 3.16Å; I45-V49 HydrophobicContact CG2-CG2 4.1Å; I45-V49 WeakPolarHBondContact O-CB 3.42Å; I45-V49 WeakPolarHBondContact O-CG2 3.45Å; I45-V49 PolarHBondContact O-N 3.05Å; I45-L63 HydrophobicContact CG2-CD2 4.34Å; I45-L63 HydrophobicContact CG2-CG 4.13Å; I45-S67 VanDerWaalsContact CG2-OG 3.23Å; I45-S67 WeakPolarHBondContact CG2-OG 3.34Å; I45-P284 HydrophobicContact CD1-CB 3.81Å; I45-P284 HydrophobicContact CD1-CG 4.03Å; I45-T288 HydrophobicContact CD1-CG2 3.37Å; I45-T288 HydrophobicContact CG1-CG2 3.49Å; I45-T288 VanDerWaalsContact CG1-CG2 3.49Å
46V89.9Confident85.2Confident35 Ų3553.4 Ų53.421%0.21229%0.292CS..Hα-helixtrans-55.6-47.8177174.40000110.4N42 L43 I48 T50 G64 F68N42-V46 WeakPolarHBondContact O-CG2 3.3Å; N42-V46 PolarHBondContact O-N 2.93Å; N42-V46 VanDerWaalsContact O-N 3.1Å; L43-V46 PolarHBondContact O-N 3.44Å; V46-I48 PolarHBondContact O-N 3.05Å; V46-T50 WeakPolarHBondContact O-CB 3.43Å; V46-T50 VanDerWaalsContact O-CG2 3.3Å; V46-T50 WeakPolarHBondContact O-CG2 3.25Å; V46-T50 PolarHBondContact O-N 3.45Å; V46-T50 PolarHBondContact O-OG1 2.9Å; V46-G64 WeakPolarHBondContact CG2-O 3.46Å; V46-F68 HydrophobicContact CG2-CB 4.07Å
47V87.3Confident84.7Confident66 Ų6650.2 Ų50.240%0.428%0.284SS..Hα-helixtrans-61.1-44.4177.4171.10000111.6L43 L44 I45 T50 S51L43-V47 WeakPolarHBondContact O-CG2 3.29Å; L43-V47 PolarHBondContact O-N 2.95Å; L44-V47 PolarHBondContact O-N 3.16Å; I45-V47 VanDerWaalsContact C-N 3.3Å; I45-V47 PolarHBondContact O-N 2.87Å; V47-T50 WeakPolarHBondContact CA-OG1 3.44Å; V47-T50 PolarHBondContact O-N 3.34Å; V47-T50 PolarHBondContact O-OG1 3.32Å; V47-T50 VanDerWaalsContact O-OG1 3.07Å; V47-S51 WeakPolarHBondContact O-CB 3.37Å; V47-S51 PolarHBondContact O-N 2.9Å; V47-S51 PolarHBondContact O-OG 3.41Å
48I84.4Confident84.4Confident4 Ų445.3 Ų45.32%0.02126%0.261CS..Hα-helixtrans-64.8-47.4-178.8-72.2160000111.6L44 I45 V46 T50 S51 D52 L55 A297 M298L44-I48 HydrophobicContact CD1-CD1 4.03Å; L44-I48 HydrophobicContact CD1-CG1 4.36Å; L44-I48 HydrophobicContact CG-CD1 3.75Å; L44-I48 WeakPolarHBondContact O-CB 3.45Å; L44-I48 VanDerWaalsContact O-CD1 3.3Å; L44-I48 WeakPolarHBondContact O-CD1 3.47Å; L44-I48 WeakPolarHBondContact O-CG1 3.21Å; L44-I48 PolarHBondContact O-N 3.47Å; I45-I48 PolarHBondContact O-N 2.98Å; I45-I48 VanDerWaalsContact O-N 3.16Å; V46-I48 PolarHBondContact O-N 3.05Å; I48-T50 VanDerWaalsContact C-N 3.29Å; I48-T50 PolarHBondContact O-N 3.09Å; I48-S51 PolarHBondContact O-N 2.89Å; I48-D52 PolarHBondContact O-N 3.42Å; I48-D52 VanDerWaalsContact O-N 3.07Å; I48-L55 HydrophobicContact CG2-CD1 3.47Å; I48-L55 VanDerWaalsContact CG2-CD1 3.47Å; I48-A297 HydrophobicContact CG2-CB 3.76Å; I48-M298 HydrophobicContact CD1-CB 4.41Å; I48-M298 HydrophobicContact CD1-CG 3.33Å; I48-M298 HydrophobicContact CD1-SD 4.44Å; I48-M298 HydrophobicContact CG1-CG 4.49Å
49V84.6Confident84.1Confident12 Ų1247.2 Ų47.27%0.07327%0.27CS..Hα-helixtrans-63.4-38.1-179.3169.30000111.1I45 H56 Y60I45-V49 HydrophobicContact CG2-CG2 4.1Å; I45-V49 WeakPolarHBondContact O-CB 3.42Å; I45-V49 WeakPolarHBondContact O-CG2 3.45Å; I45-V49 PolarHBondContact O-N 3.05Å; V49-H56 PolarHBondContact O-CD2 3.13Å; V49-H56 PolarHBondContact O-NE2 2.87Å; V49-Y60 VanDerWaalsContact CG1-O 3.3Å; V49-Y60 WeakPolarHBondContact CG1-O 3.28Å
50T84.5Confident83.8Confident93 Ų9346.3 Ų46.357%0.57126%0.264SS*.Hα-helixtrans-79.7-22.8179.651.90000113.7V46 V47 I48V46-T50 WeakPolarHBondContact O-CB 3.43Å; V46-T50 VanDerWaalsContact O-CG2 3.3Å; V46-T50 WeakPolarHBondContact O-CG2 3.25Å; V46-T50 PolarHBondContact O-N 3.45Å; V46-T50 PolarHBondContact O-OG1 2.9Å; V47-T50 WeakPolarHBondContact CA-OG1 3.44Å; V47-T50 PolarHBondContact O-N 3.34Å; V47-T50 PolarHBondContact O-OG1 3.32Å; V47-T50 VanDerWaalsContact O-OG1 3.07Å; I48-T50 VanDerWaalsContact C-N 3.29Å; I48-T50 PolarHBondContact O-N 3.09Å
51S80.9Confident83.6Confident61 Ų6147.2 Ų47.243%0.42726%0.263SS..Hα-helixtrans-98.7-20.5-174.3-57.80000114.6V47 I48 P53V47-S51 WeakPolarHBondContact O-CB 3.37Å; V47-S51 PolarHBondContact O-N 2.9Å; V47-S51 PolarHBondContact O-OG 3.41Å; I48-S51 PolarHBondContact O-N 2.89Å; S51-P53 WeakPolarHBondContact O-CD 3.45Å
52D78.9Confident83.6Confident16 Ų1646.4 Ų46.49%0.08625%0.254CS..  trans-106.8109.5176.7-156.7-38.2000111.9I48 H54 L55 H56 K300I48-D52 PolarHBondContact O-N 3.42Å; I48-D52 VanDerWaalsContact O-N 3.07Å; D52-H54 PolarHBondContact O-N 2.83Å; D52-H54 VanDerWaalsContact O-N 3.07Å; D52-H54 WeakPolarHBondContact OD1-CB 3.48Å; D52-H54 IonicContact OD1-CG 3.88Å; D52-H54 PolarHBondContact OD1-N 2.54Å; D52-H54 IonicContact OD1-ND1 2.64Å; D52-H54 PolarHBondContact OD1-ND1 3.43Å; D52-L55 HydrophobicContact CB-CD1 4.18Å; D52-L55 HydrophobicContact CB-CG 4.28Å; D52-L55 PolarHBondContact O-N 2.97Å; D52-H56 PolarHBondContact O-CD2 3.39Å; D52-K300 IonicContact OD1-NZ 3.65Å; D52-K300 IonicContact OD2-NZ 2.93Å; D52-K300 PolarHBondContact OD2-NZ 3.46Å
53P77.3Confident83.4Confident91 Ų9146.5 Ų46.559%0.59125%0.254SS*.G310 helixtrans-56.7-25.1176.8-26.134.4000114.5S51 L55 H56S51-P53 WeakPolarHBondContact O-CD 3.45Å; P53-L55 PolarHBondContact O-N 3.32Å; P53-H56 WeakPolarHBondContact O-CB 3.34Å; P53-H56 PolarHBondContact O-N 3.31Å; P53-H56 VanDerWaalsContact O-N 3.16Å
54H74Confident83.4Confident151 Ų15143.8 Ų43.870%0.69924%0.242SC*.G310 helixtrans-69.1-18.2177.2-62.478.5000112.5D52D52-H54 PolarHBondContact O-N 2.83Å; D52-H54 VanDerWaalsContact O-N 3.07Å; D52-H54 WeakPolarHBondContact OD1-CB 3.48Å; D52-H54 IonicContact OD1-CG 3.88Å; D52-H54 PolarHBondContact OD1-N 2.54Å; D52-H54 IonicContact OD1-ND1 2.64Å; D52-H54 PolarHBondContact OD1-ND1 3.43Å
55L74.8Confident83.5Confident6 Ų642.3 Ų42.33%0.03124%0.235CC..G310 helixtrans-97.29.7176-61.2176.4000112.1I48 D52 P53 T57 Y60 E293 A297I48-L55 HydrophobicContact CG2-CD1 3.47Å; I48-L55 VanDerWaalsContact CG2-CD1 3.47Å; D52-L55 HydrophobicContact CB-CD1 4.18Å; D52-L55 HydrophobicContact CB-CG 4.28Å; D52-L55 PolarHBondContact O-N 2.97Å; P53-L55 PolarHBondContact O-N 3.32Å; L55-T57 PolarHBondContact O-N 3.29Å; L55-Y60 HydrophobicContact CB-CD2 4.01Å; L55-Y60 HydrophobicContact CB-CG 4.14Å; L55-Y60 HydrophobicContact CD2-CD1 4.25Å; L55-Y60 HydrophobicContact CD2-CD2 3.67Å; L55-Y60 HydrophobicContact CD2-CE1 4.05Å; L55-Y60 HydrophobicContact CD2-CE2 3.45Å; L55-Y60 VanDerWaalsContact CD2-CE2 3.45Å; L55-Y60 HydrophobicContact CD2-CG 4.11Å; L55-Y60 HydrophobicContact CG-CD2 4.45Å; L55-Y60 WeakPolarHBondContact O-CB 3.23Å; L55-E293 HydrophobicContact CD2-CB 4.26Å; L55-A297 HydrophobicContact CD1-CB 3.66Å
56H76.7Confident83.7Confident92 Ų9242.1 Ų42.143%0.42623%0.234SC..  trans-78.839.8177.2-68.6-173000113.1V49 D52 P53 Q138V49-H56 PolarHBondContact O-CD2 3.13Å; V49-H56 PolarHBondContact O-NE2 2.87Å; D52-H56 PolarHBondContact O-CD2 3.39Å; P53-H56 WeakPolarHBondContact O-CB 3.34Å; P53-H56 PolarHBondContact O-N 3.31Å; P53-H56 VanDerWaalsContact O-N 3.16Å; H56-Q138 PolarHBondContact O-NE2 3.15Å
57T80.1Confident83.8Confident67 Ų6740.6 Ų40.641%0.41122%0.224SC..SBendtrans-89.8159.9171.5740000110.5L55 M59 Y60 F61L55-T57 PolarHBondContact O-N 3.29Å; T57-M59 VanDerWaalsContact C-N 3.32Å; T57-M59 PolarHBondContact O-N 3.48Å; T57-Y60 HydrophobicContact CG2-CD2 4.36Å; T57-Y60 PolarHBondContact O-N 3.08Å; T57-Y60 WeakPolarHBondContact OG1-CD2 3.49Å; T57-F61 PolarHBondContact O-N 3.1Å
58T82.5Confident84.1Confident12 Ų1241.3 Ų41.37%0.07422%0.223CC..Hα-helixtrans-51-49.6179.2-52.60000112.2Y60 F61 L62 M136 C141T58-Y60 VanDerWaalsContact C-N 3.35Å; T58-Y60 PolarHBondContact O-N 3Å; T58-F61 WeakPolarHBondContact O-CB 3.43Å; T58-F61 PolarHBondContact O-N 2.78Å; T58-L62 HydrophobicContact CG2-CD1 4.19Å; T58-L62 WeakPolarHBondContact O-CG 3.36Å; T58-L62 PolarHBondContact O-N 3.26Å; T58-M136 HydrophobicContact CG2-CG 3.74Å; T58-M136 HydrophobicContact CG2-SD 4.11Å; T58-C141 HydrophobicContact CG2-CB 3.84Å
59M83.5Confident84.5Confident40 Ų4041.1 Ų41.120%0.19722%0.222CC..Hα-helixtrans-61.7-40.7-177.8-179.6-178.2153.300112.5T57 L62 L63T57-M59 VanDerWaalsContact C-N 3.32Å; T57-M59 PolarHBondContact O-N 3.48Å; M59-L62 PolarHBondContact O-N 3.29Å; M59-L63 WeakPolarHBondContact O-CB 3.46Å; M59-L63 PolarHBondContact O-N 2.98Å
60Y83.5Confident84.8Confident8 Ų840.6 Ų40.63%0.03122%0.218CC..Hα-helixtrans-73.9-34.9179.2-73.3-54.7000112.2V49 L55 T57 T58 L62 L63 G64 N291 E293 V294V49-Y60 VanDerWaalsContact CG1-O 3.3Å; V49-Y60 WeakPolarHBondContact CG1-O 3.28Å; L55-Y60 HydrophobicContact CB-CD2 4.01Å; L55-Y60 HydrophobicContact CB-CG 4.14Å; L55-Y60 HydrophobicContact CD2-CD1 4.25Å; L55-Y60 HydrophobicContact CD2-CD2 3.67Å; L55-Y60 HydrophobicContact CD2-CE1 4.05Å; L55-Y60 HydrophobicContact CD2-CE2 3.45Å; L55-Y60 VanDerWaalsContact CD2-CE2 3.45Å; L55-Y60 HydrophobicContact CD2-CG 4.11Å; L55-Y60 HydrophobicContact CG-CD2 4.45Å; L55-Y60 WeakPolarHBondContact O-CB 3.23Å; T57-Y60 HydrophobicContact CG2-CD2 4.36Å; T57-Y60 PolarHBondContact O-N 3.08Å; T57-Y60 WeakPolarHBondContact OG1-CD2 3.49Å; T58-Y60 VanDerWaalsContact C-N 3.35Å; T58-Y60 PolarHBondContact O-N 3Å; Y60-L62 VanDerWaalsContact C-N 3.34Å; Y60-L62 PolarHBondContact O-N 2.86Å; Y60-L63 HydrophobicContact CD1-CD2 4.18Å; Y60-L63 PolarHBondContact O-N 3.32Å; Y60-G64 PolarHBondContact O-N 2.84Å; Y60-N291 PolarHBondContact OH-ND2 3.02Å; Y60-N291 PolarHBondContact OH-OD1 2.98Å; Y60-E293 WeakPolarHBondContact CE2-OE2 3.39Å; Y60-E293 WeakPolarHBondContact OH-CB 3.41Å; Y60-E293 PolarHBondContact OH-OE2 3.07Å; Y60-V294 HydrophobicContact CD1-CG2 4.32Å; Y60-V294 HydrophobicContact CE1-CG2 3.6Å
61F86.2Confident85.2Confident85 Ų8538.6 Ų38.637%0.37320%0.202SC..Hα-helixtrans-58.3-46.1169.6174.4-96000111.4T57 T58 L63 G64 N65 C141T57-F61 PolarHBondContact O-N 3.1Å; T58-F61 WeakPolarHBondContact O-CB 3.43Å; T58-F61 PolarHBondContact O-N 2.78Å; F61-L63 VanDerWaalsContact C-N 3.34Å; F61-L63 PolarHBondContact O-N 3.13Å; F61-G64 PolarHBondContact O-N 2.92Å; F61-N65 WeakPolarHBondContact CZ-ND2 3.49Å; F61-N65 PolarHBondContact O-N 3.21Å; F61-N65 VanDerWaalsContact O-N 3.13Å; F61-N65 PolarHBondContact O-ND2 3.28Å; F61-C141 VanDerWaalsContact CD1-SG 3.51Å
62L88.2Confident85.8Confident1 Ų137 Ų371%0.00519%0.19CC..Hα-helixtrans-62.2-41.3174.5-65.8170000111.6T58 M59 Y60 N65 L66 L114 V117 M118 D121 C141T58-L62 HydrophobicContact CG2-CD1 4.19Å; T58-L62 WeakPolarHBondContact O-CG 3.36Å; T58-L62 PolarHBondContact O-N 3.26Å; M59-L62 PolarHBondContact O-N 3.29Å; Y60-L62 VanDerWaalsContact C-N 3.34Å; Y60-L62 PolarHBondContact O-N 2.86Å; L62-N65 PolarHBondContact O-N 2.92Å; L62-L66 WeakPolarHBondContact O-CB 3.34Å; L62-L66 PolarHBondContact O-N 2.97Å; L62-L114 HydrophobicContact CB-CD1 4.44Å; L62-L114 HydrophobicContact CD2-CD1 3.44Å; L62-L114 VanDerWaalsContact CD2-CD1 3.44Å; L62-V117 HydrophobicContact CD1-CG1 4.16Å; L62-V117 HydrophobicContact CD2-CG1 3.86Å; L62-M118 HydrophobicContact CB-CG 3.68Å; L62-M118 HydrophobicContact CB-SD 4.23Å; L62-M118 HydrophobicContact CD1-CG 3.82Å; L62-M118 HydrophobicContact CG-CG 4.25Å; L62-D121 HydrophobicContact CD1-CB 4.23Å; L62-C141 WeakPolarHBondContact CD2-SG 3.13Å
63L87.9Confident86.4Confident2 Ų236.8 Ų36.81%0.0119%0.188CC..Hα-helixtrans-64-39.9177.3-178.963.2000112.8I45 M59 Y60 F61 L66 S67 Y287I45-L63 HydrophobicContact CG2-CD2 4.34Å; I45-L63 HydrophobicContact CG2-CG 4.13Å; M59-L63 WeakPolarHBondContact O-CB 3.46Å; M59-L63 PolarHBondContact O-N 2.98Å; Y60-L63 HydrophobicContact CD1-CD2 4.18Å; Y60-L63 PolarHBondContact O-N 3.32Å; F61-L63 VanDerWaalsContact C-N 3.34Å; F61-L63 PolarHBondContact O-N 3.13Å; L63-L66 PolarHBondContact O-N 3.37Å; L63-S67 WeakPolarHBondContact O-CB 3.43Å; L63-S67 PolarHBondContact O-N 3.36Å; L63-S67 PolarHBondContact O-OG 3.5Å; L63-Y287 HydrophobicContact CD1-CD1 3.96Å; L63-Y287 HydrophobicContact CD1-CD2 3.78Å; L63-Y287 HydrophobicContact CD1-CE2 4.42Å; L63-Y287 HydrophobicContact CD1-CG 3.52Å
64G89.7Confident87Confident9 Ų932.6 Ų32.69%0.09316%0.161CC..Hα-helixtrans-61.2-45.6174.600000111.4V46 Y60 F61 S67 F68V46-G64 WeakPolarHBondContact CG2-O 3.46Å; Y60-G64 PolarHBondContact O-N 2.84Å; F61-G64 PolarHBondContact O-N 2.92Å; G64-S67 PolarHBondContact O-N 3.36Å; G64-F68 PolarHBondContact O-N 3.37Å
65N92.1Very high87.8Confident33 Ų3327 Ų2718%0.17614%0.139CC..Hα-helixtrans-62.7-44174.5-78.4-86000112F61 L62 S67 F68 L69 L114 M145F61-N65 WeakPolarHBondContact CZ-ND2 3.49Å; F61-N65 PolarHBondContact O-N 3.21Å; F61-N65 VanDerWaalsContact O-N 3.13Å; F61-N65 PolarHBondContact O-ND2 3.28Å; L62-N65 PolarHBondContact O-N 2.92Å; N65-S67 VanDerWaalsContact C-N 3.32Å; N65-S67 PolarHBondContact O-N 3.49Å; N65-F68 PolarHBondContact O-N 3.2Å; N65-L69 VanDerWaalsContact O-CG 3.27Å; N65-L69 WeakPolarHBondContact O-CG 3.43Å; N65-L69 PolarHBondContact O-N 3.32Å; N65-L114 HydrophobicContact CB-CD2 3.98Å; N65-M145 HydrophobicContact CB-CE 4.21Å; N65-M145 HydrophobicContact CB-SD 4.02Å
66L90.6Very high88.6Confident1 Ų128.2 Ų28.21%0.00515%0.145CC..Hα-helixtrans-59.6-44.2177.4-177.864.9000111.3L62 L63 L69 D70 K111 L114 L115 M118 Y287L62-L66 WeakPolarHBondContact O-CB 3.34Å; L62-L66 PolarHBondContact O-N 2.97Å; L63-L66 PolarHBondContact O-N 3.37Å; L66-L69 PolarHBondContact O-N 2.85Å; L66-D70 PolarHBondContact O-N 2.61Å; L66-K111 HydrophobicContact CD1-CG 4.48Å; L66-L114 HydrophobicContact CB-CD2 3.8Å; L66-L114 HydrophobicContact CD1-CD2 4.25Å; L66-L115 HydrophobicContact CD1-CD2 4.35Å; L66-L115 HydrophobicContact CD2-CD2 4.17Å; L66-M118 HydrophobicContact CB-SD 4.45Å; L66-M118 HydrophobicContact CD2-CE 4.33Å; L66-M118 HydrophobicContact CD2-SD 3.93Å; L66-Y287 HydrophobicContact CD2-CD2 4.41Å; L66-Y287 HydrophobicContact CD2-CE2 3.65Å
67S91.7Very high89.1Confident2 Ų223.9 Ų23.91%0.01413%0.125CC..Hα-helixtrans-63.8-42.7178.3-53.70000111.3N42 I45 L63 G64 N65 L69 D70 F71N42-S67 WeakPolarHBondContact CB-O 3.3Å; N42-S67 WeakPolarHBondContact OD1-CA 2.95Å; I45-S67 VanDerWaalsContact CG2-OG 3.23Å; I45-S67 WeakPolarHBondContact CG2-OG 3.34Å; L63-S67 WeakPolarHBondContact O-CB 3.43Å; L63-S67 PolarHBondContact O-N 3.36Å; L63-S67 PolarHBondContact O-OG 3.5Å; G64-S67 PolarHBondContact O-N 3.36Å; N65-S67 VanDerWaalsContact C-N 3.32Å; N65-S67 PolarHBondContact O-N 3.49Å; S67-L69 VanDerWaalsContact C-N 3.33Å; S67-L69 PolarHBondContact O-N 2.98Å; S67-D70 PolarHBondContact O-N 3.49Å; S67-F71 PolarHBondContact O-N 2.88Å
68F93.3Very high89.5Confident82 Ų8220.8 Ų20.836%0.3611%0.106SC..Hα-helixtrans-59.7-43.7173.6176-106.7000111.9V46 G64 N65 D70 F71 C72 W149V46-F68 HydrophobicContact CG2-CB 4.07Å; G64-F68 PolarHBondContact O-N 3.37Å; N65-F68 PolarHBondContact O-N 3.2Å; F68-D70 PolarHBondContact O-N 3.44Å; F68-F71 HydrophobicContact CD2-CD1 4.46Å; F68-F71 HydrophobicContact CE2-CD1 4.5Å; F68-F71 WeakPolarHBondContact O-CB 3.46Å; F68-F71 PolarHBondContact O-N 3.25Å; F68-C72 VanDerWaalsContact CZ-SG 3.6Å; F68-C72 PolarHBondContact O-N 3.43Å; F68-C72 PolarHBondContact O-SG 2.91Å; F68-C72 VanDerWaalsContact O-SG 3.35Å; F68-W149 HydrophobicContact CE1-CH2 4.33Å
69L93.4Very high89.7Confident0 Ų022.2 Ų22.20%012%0.116CC..Hα-helixtrans-65.6-37.4177.1-65.9166.8000112.3N65 L66 S67 C72 Y73 I107 I110 K111 L114 M145 W149N65-L69 VanDerWaalsContact O-CG 3.27Å; N65-L69 WeakPolarHBondContact O-CG 3.43Å; N65-L69 PolarHBondContact O-N 3.32Å; L66-L69 PolarHBondContact O-N 2.85Å; S67-L69 VanDerWaalsContact C-N 3.33Å; S67-L69 PolarHBondContact O-N 2.98Å; L69-C72 PolarHBondContact O-N 3.44Å; L69-Y73 WeakPolarHBondContact O-CB 3.44Å; L69-Y73 PolarHBondContact O-N 3.28Å; L69-I107 HydrophobicContact CB-CG2 4.17Å; L69-I107 HydrophobicContact CD2-CD1 4.02Å; L69-I107 HydrophobicContact CD2-CG2 4.06Å; L69-I107 WeakPolarHBondContact O-CG2 3.46Å; L69-I110 HydrophobicContact CD1-CB 4.19Å; L69-I110 HydrophobicContact CD1-CG2 3.51Å; L69-I110 HydrophobicContact CD2-CB 4.16Å; L69-I110 HydrophobicContact CD2-CD1 4.27Å; L69-I110 HydrophobicContact CD2-CG2 3.91Å; L69-I110 HydrophobicContact CG-CG2 4.37Å; L69-K111 HydrophobicContact CB-CD 4.01Å; L69-K111 HydrophobicContact CB-CG 3.56Å; L69-K111 HydrophobicContact CD1-CG 3.91Å; L69-K111 HydrophobicContact CG-CG 4.3Å; L69-L114 HydrophobicContact CD1-CD2 3.68Å; L69-M145 HydrophobicContact CD1-CE 4.3Å; L69-W149 HydrophobicContact CD2-CH2 4.29Å; L69-W149 HydrophobicContact CD2-CZ2 4.32Å
70D91.4Very high89.9Confident0 Ų022.8 Ų22.80%012%0.116CC..Hα-helixtrans-63.7-40.3174.6-76.9-37.2000112.8L66 S67 F68 Y73 S74 K111 P280 N283L66-D70 PolarHBondContact O-N 2.61Å; S67-D70 PolarHBondContact O-N 3.49Å; F68-D70 PolarHBondContact O-N 3.44Å; D70-Y73 PolarHBondContact O-N 2.99Å; D70-S74 WeakPolarHBondContact O-CB 3.36Å; D70-S74 PolarHBondContact O-N 3.42Å; D70-S74 PolarHBondContact O-OG 3.22Å; D70-K111 WeakPolarHBondContact OD1-CE 3.49Å; D70-K111 IonicContact OD1-NZ 2.9Å; D70-K111 PolarHBondContact OD1-NZ 3.39Å; D70-P280 HydrophobicContact CB-CB 4.12Å; D70-N283 PolarHBondContact OD2-ND2 3.17Å
71F92.7Very high90.1Very high52 Ų5222.5 Ų22.523%0.22812%0.115CC..Hα-helixtrans-59.9-49.6171.8160.5-102.2000111.4V39 N42 L43 S67 F68 S74 S75V39-F71 HydrophobicContact CB-CD2 4.33Å; V39-F71 HydrophobicContact CG1-CD2 4.08Å; V39-F71 HydrophobicContact CG1-CE2 3.97Å; V39-F71 HydrophobicContact CG2-CD2 3.99Å; V39-F71 HydrophobicContact CG2-CE2 4.1Å; N42-F71 HydrophobicContact CB-CB 4.33Å; L43-F71 HydrophobicContact CD1-CD2 4.3Å; L43-F71 HydrophobicContact CD1-CE2 4.25Å; L43-F71 HydrophobicContact CD2-CD1 4.16Å; L43-F71 HydrophobicContact CD2-CD2 4.23Å; L43-F71 HydrophobicContact CD2-CG 4.01Å; L43-F71 HydrophobicContact CG-CD2 4.16Å; L43-F71 HydrophobicContact CG-CG 4.35Å; S67-F71 PolarHBondContact O-N 2.88Å; F68-F71 HydrophobicContact CD2-CD1 4.46Å; F68-F71 HydrophobicContact CE2-CD1 4.5Å; F68-F71 WeakPolarHBondContact O-CB 3.46Å; F68-F71 PolarHBondContact O-N 3.25Å; F71-S74 PolarHBondContact O-OG 3.26Å; F71-S75 WeakPolarHBondContact O-CB 3.47Å; F71-S75 PolarHBondContact O-N 3.02Å; F71-S75 PolarHBondContact O-OG 2.99Å
72C93.9Very high90.3Very high26 Ų2619.2 Ų19.218%0.17610%0.101CC..Hα-helixtrans-61.9-45.6177.8-69.10000111.4F68 L69 S74 S75 I76 I107F68-C72 VanDerWaalsContact CZ-SG 3.6Å; F68-C72 PolarHBondContact O-N 3.43Å; F68-C72 PolarHBondContact O-SG 2.91Å; F68-C72 VanDerWaalsContact O-SG 3.35Å; L69-C72 PolarHBondContact O-N 3.44Å; C72-S74 PolarHBondContact O-N 3.27Å; C72-S75 PolarHBondContact O-N 3.28Å; C72-S75 VanDerWaalsContact O-N 3.16Å; C72-I76 WeakPolarHBondContact O-CD1 3.3Å; C72-I76 VanDerWaalsContact O-CG1 3.31Å; C72-I76 WeakPolarHBondContact O-CG1 3.45Å; C72-I76 PolarHBondContact O-N 3.02Å; C72-I107 HydrophobicContact CB-CD1 4.22Å; C72-I107 HydrophobicContact CB-CG1 4.26Å; C72-I107 HydrophobicContact CB-CG2 4.27Å
73Y90.6Very high90.3Very high13 Ų1324.2 Ų24.25%0.05113%0.127CC..Hα-helixtrans-61.6-46.4-177-163.7-112000112.7L69 D70 S75 I76 T77 F104 I107 K111 Y275 T276 P280L69-Y73 WeakPolarHBondContact O-CB 3.44Å; L69-Y73 PolarHBondContact O-N 3.28Å; D70-Y73 PolarHBondContact O-N 2.99Å; Y73-S75 VanDerWaalsContact C-N 3.32Å; Y73-S75 PolarHBondContact O-N 3.05Å; Y73-I76 PolarHBondContact O-N 3.09Å; Y73-T77 PolarHBondContact O-OG1 3.49Å; Y73-F104 HydrophobicContact CD2-CD2 4.47Å; Y73-F104 HydrophobicContact CE1-CE2 4.15Å; Y73-F104 AromaticContact CE2-CD2 3.67Å; Y73-F104 HydrophobicContact CE2-CD2 3.67Å; Y73-F104 AromaticContact CE2-CE2 3.64Å; Y73-F104 HydrophobicContact CE2-CE2 3.64Å; Y73-F104 HydrophobicContact CE2-CG 4.29Å; Y73-F104 HydrophobicContact CE2-CZ 4.23Å; Y73-F104 WeakPolarHBondContact CE2-O 3.42Å; Y73-F104 AromaticContact CZ-CD2 3.9Å; Y73-F104 AromaticContact CZ-CE2 3.35Å; Y73-F104 AromaticContact CZ-CZ 3.76Å; Y73-F104 WeakPolarHBondContact OH-CE2 3.49Å; Y73-F104 WeakPolarHBondContact OH-CZ 3.37Å; Y73-I107 HydrophobicContact CD2-CB 4.11Å; Y73-I107 HydrophobicContact CD2-CG2 3.86Å; Y73-I107 HydrophobicContact CG-CG2 4.3Å; Y73-K111 HydrophobicContact CG-CD 4.29Å; Y73-Y275 HydrophobicContact CE1-CD2 4.47Å; Y73-Y275 VanDerWaalsContact OH-CE2 3.22Å; Y73-Y275 WeakPolarHBondContact OH-CE2 3.3Å; Y73-T276 HydrophobicContact CE1-CG2 4.26Å; Y73-P280 HydrophobicContact CD1-CG 4.28Å
74S90.1Very high90.2Very high2 Ų224.8 Ų24.81%0.01413%0.13CC..Hα-helixtrans-65.3-36.6174.957.20000111.9T38 D70 F71 C72 I76 T77 A78T38-S74 WeakPolarHBondContact CG2-OG 3.04Å; D70-S74 WeakPolarHBondContact O-CB 3.36Å; D70-S74 PolarHBondContact O-N 3.42Å; D70-S74 PolarHBondContact O-OG 3.22Å; F71-S74 PolarHBondContact O-OG 3.26Å; C72-S74 PolarHBondContact O-N 3.27Å; S74-I76 VanDerWaalsContact C-N 3.27Å; S74-I76 PolarHBondContact O-N 2.76Å; S74-T77 PolarHBondContact O-N 3.12Å; S74-A78 WeakPolarHBondContact O-CB 3.4Å; S74-A78 PolarHBondContact O-N 3.41Å
75S91.9Very high90Very high35 Ų3524.8 Ų24.825%0.24513%0.128CC..Hα-helixtrans-72.9-14.8179.1-590000114.3Y35 F71 C72 Y73 P79Y35-S75 PolarHBondContact OH-OG 2.97Å; F71-S75 WeakPolarHBondContact O-CB 3.47Å; F71-S75 PolarHBondContact O-N 3.02Å; F71-S75 PolarHBondContact O-OG 2.99Å; C72-S75 PolarHBondContact O-N 3.28Å; C72-S75 VanDerWaalsContact O-N 3.16Å; Y73-S75 VanDerWaalsContact C-N 3.32Å; Y73-S75 PolarHBondContact O-N 3.05Å; S75-P79 VanDerWaalsContact O-CD 3.23Å; S75-P79 WeakPolarHBondContact O-CD 3.36Å; S75-P79 VanDerWaalsContact O-CG 3.27Å; S75-P79 WeakPolarHBondContact O-CG 3.42Å
76I91.1Very high89.6Confident31 Ų3127.7 Ų27.716%0.15914%0.143CC..Hα-helixtrans-77.3-36.3173-69.4154.5000111.3C72 Y73 S74 Q100 F103 F104 I107C72-I76 WeakPolarHBondContact O-CD1 3.3Å; C72-I76 VanDerWaalsContact O-CG1 3.31Å; C72-I76 WeakPolarHBondContact O-CG1 3.45Å; C72-I76 PolarHBondContact O-N 3.02Å; Y73-I76 PolarHBondContact O-N 3.09Å; S74-I76 VanDerWaalsContact C-N 3.27Å; S74-I76 PolarHBondContact O-N 2.76Å; I76-Q100 HydrophobicContact CG2-CG 3.9Å; I76-F103 HydrophobicContact CD1-CB 3.62Å; I76-F103 WeakPolarHBondContact CD1-O 3.29Å; I76-F103 HydrophobicContact CG1-CB 3.89Å; I76-F103 HydrophobicContact CG2-CB 4.37Å; I76-F104 HydrophobicContact CG2-CB 4.29Å; I76-I107 HydrophobicContact CD1-CB 4.22Å; I76-I107 HydrophobicContact CD1-CG1 3.76Å
77T85.9Confident89.1Confident0 Ų031.3 Ų31.30%017%0.168CC..Hα-helixtrans-107.4-43.6-17053.20000113.2Y73 S74 R80 M81 F104 Y178Y73-T77 PolarHBondContact O-OG1 3.49Å; S74-T77 PolarHBondContact O-N 3.12Å; T77-R80 PolarHBondContact O-N 3.49Å; T77-M81 PolarHBondContact O-N 3.35Å; T77-M81 VanDerWaalsContact O-N 3.16Å; T77-F104 HydrophobicContact CG2-CD2 3.71Å; T77-F104 HydrophobicContact CG2-CE2 3.77Å; T77-Y178 HydrophobicContact CG2-CD2 4.33Å; T77-Y178 HydrophobicContact CG2-CG 4.25Å
78A88.7Confident88.1Confident2 Ų232.9 Ų32.92%0.01719%0.185CC..Hα-helixtrans-67.4-43.4-172.300000113.9Y35 S74 R80 M81 L82Y35-A78 HydrophobicContact CD2-CB 3.67Å; Y35-A78 HydrophobicContact CE2-CB 4.26Å; Y35-A78 HydrophobicContact CG-CB 4.11Å; S74-A78 WeakPolarHBondContact O-CB 3.4Å; S74-A78 PolarHBondContact O-N 3.41Å; A78-R80 VanDerWaalsContact C-N 3.29Å; A78-R80 PolarHBondContact O-N 3.02Å; A78-M81 PolarHBondContact O-N 3.37Å; A78-L82 WeakPolarHBondContact O-CB 3.5Å; A78-L82 VanDerWaalsContact O-CG 3.23Å; A78-L82 WeakPolarHBondContact O-CG 3.28Å; A78-L82 PolarHBondContact O-N 2.92Å
79P88.2Confident87.1Confident43 Ų4333.6 Ų33.628%0.27919%0.193SC..Hα-helixtrans-60.1-40.8179.5-26.737.5000112.4Y35 S75 L82 L83Y35-P79 HydrophobicContact CE2-CG 4.5Å; S75-P79 VanDerWaalsContact O-CD 3.23Å; S75-P79 WeakPolarHBondContact O-CD 3.36Å; S75-P79 VanDerWaalsContact O-CG 3.27Å; S75-P79 WeakPolarHBondContact O-CG 3.42Å; P79-L82 PolarHBondContact O-N 3.34Å; P79-L83 WeakPolarHBondContact O-CB 3.43Å; P79-L83 VanDerWaalsContact O-CG 3.27Å; P79-L83 WeakPolarHBondContact O-CG 3.42Å; P79-L83 PolarHBondContact O-N 3.32Å
80R87.1Confident86.3Confident52 Ų5234.6 Ų34.620%0.19620%0.199CC..Hα-helixtrans-61.5-51.8176.6-179.369-150.9-155.27.4111.1L14 T77 A78 L82 L83 D84 T91L14-R80 HydrophobicContact CD1-CG 4.22Å; T77-R80 PolarHBondContact O-N 3.49Å; A78-R80 VanDerWaalsContact C-N 3.29Å; A78-R80 PolarHBondContact O-N 3.02Å; R80-L82 VanDerWaalsContact C-N 3.3Å; R80-L82 PolarHBondContact O-N 3.42Å; R80-L83 WeakPolarHBondContact O-CB 3.42Å; R80-L83 PolarHBondContact O-N 2.74Å; R80-D84 IonicContact CZ-OD1 2.88Å; R80-D84 IonicContact NE-OD1 3.84Å; R80-D84 PolarHBondContact NE-OD1 3.29Å; R80-D84 VanDerWaalsContact NE-OD1 3.11Å; R80-D84 IonicContact NE-OD2 3.4Å; R80-D84 PolarHBondContact NE-OD2 2.9Å; R80-D84 IonicContact NH2-OD1 3.11Å; R80-D84 PolarHBondContact NH2-OD1 3.21Å; R80-D84 IonicContact NH2-OD2 3.24Å; R80-D84 VanDerWaalsContact O-CG 3.25Å; R80-D84 PolarHBondContact O-N 3.17Å; R80-T91 PolarHBondContact NH1-O 3.37Å; R80-T91 VanDerWaalsContact NH1-O 3.08Å; R80-T91 PolarHBondContact NH2-O 2.96Å
81M88.1Confident86Confident2 Ų238.1 Ų38.11%0.0122%0.221CC..Hα-helixtrans-57.6-42.4177.2-177.1-171.968.700112.4L17 F31 T77 A78 D84 L85 F177 I277L17-M81 HydrophobicContact CD1-CG 4.37Å; L17-M81 HydrophobicContact CD1-SD 3.71Å; L17-M81 HydrophobicContact CG-SD 4.45Å; F31-M81 HydrophobicContact CB-CE 3.42Å; F31-M81 VanDerWaalsContact CB-CE 3.42Å; F31-M81 HydrophobicContact CD1-CE 3.68Å; F31-M81 HydrophobicContact CD2-CE 3.78Å; F31-M81 HydrophobicContact CD2-SD 4.3Å; F31-M81 HydrophobicContact CE1-CE 4.45Å; F31-M81 HydrophobicContact CG-CE 3.33Å; F31-M81 HydrophobicContact CG-SD 4.33Å; T77-M81 PolarHBondContact O-N 3.35Å; T77-M81 VanDerWaalsContact O-N 3.16Å; A78-M81 PolarHBondContact O-N 3.37Å; M81-D84 PolarHBondContact O-N 2.99Å; M81-L85 HydrophobicContact CG-CD1 4.17Å; M81-L85 WeakPolarHBondContact O-CB 3.39Å; M81-L85 VanDerWaalsContact O-CG 3.24Å; M81-L85 WeakPolarHBondContact O-CG 3.33Å; M81-L85 PolarHBondContact O-N 3.37Å; M81-F177 HydrophobicContact CB-CB 4.21Å; M81-F177 HydrophobicContact CB-CD2 3.81Å; M81-F177 HydrophobicContact CB-CG 4.32Å; M81-F177 HydrophobicContact CG-CB 3.87Å; M81-F177 HydrophobicContact CG-CD2 3.86Å; M81-F177 HydrophobicContact CG-CG 3.96Å; M81-F177 HydrophobicContact SD-CB 4.47Å; M81-F177 HydrophobicContact SD-CD1 4.42Å; M81-F177 HydrophobicContact SD-CD2 3.71Å; M81-F177 HydrophobicContact SD-CE2 3.97Å; M81-F177 HydrophobicContact SD-CG 3.94Å; M81-F177 HydrophobicContact SD-CZ 4.45Å; M81-I277 HydrophobicContact CE-CD1 3.2Å; M81-I277 HydrophobicContact SD-CD1 3.7Å
82L89.9Confident85.7Confident16 Ų1636.1 Ų36.18%0.08421%0.212CC..Hα-helixtrans-65.9-39.9178.4-70.6172.7000112F28 F31 Y35 A78 P79 R80 L85 L86F28-L82 HydrophobicContact CD2-CB 4.29Å; F28-L82 HydrophobicContact CD2-CD2 3.75Å; F28-L82 HydrophobicContact CE2-CB 4.16Å; F28-L82 HydrophobicContact CE2-CD2 4.05Å; F31-L82 HydrophobicContact CB-CD2 3.83Å; Y35-L82 HydrophobicContact CD1-CD1 4.26Å; Y35-L82 HydrophobicContact CG-CD1 4.5Å; A78-L82 WeakPolarHBondContact O-CB 3.5Å; A78-L82 VanDerWaalsContact O-CG 3.23Å; A78-L82 WeakPolarHBondContact O-CG 3.28Å; A78-L82 PolarHBondContact O-N 2.92Å; P79-L82 PolarHBondContact O-N 3.34Å; R80-L82 VanDerWaalsContact C-N 3.3Å; R80-L82 PolarHBondContact O-N 3.42Å; L82-L85 PolarHBondContact O-N 3.49Å; L82-L86 WeakPolarHBondContact O-CG 3.48Å; L82-L86 PolarHBondContact O-N 2.95Å; L82-L86 VanDerWaalsContact O-N 3.1Å
83L87.4Confident85.5Confident106 Ų10638.2 Ų38.256%0.55523%0.227SC*.Hα-helixtrans-63.6-44.4174-74170.2000111.4P79 R80 L85 L86 S87P79-L83 WeakPolarHBondContact O-CB 3.43Å; P79-L83 VanDerWaalsContact O-CG 3.27Å; P79-L83 WeakPolarHBondContact O-CG 3.42Å; P79-L83 PolarHBondContact O-N 3.32Å; R80-L83 WeakPolarHBondContact O-CB 3.42Å; R80-L83 PolarHBondContact O-N 2.74Å; L83-L85 VanDerWaalsContact C-N 3.31Å; L83-L85 PolarHBondContact O-N 3.13Å; L83-L86 PolarHBondContact O-N 3.12Å; L83-L86 VanDerWaalsContact O-N 3.15Å; L83-S87 WeakPolarHBondContact O-CB 3.28Å; L83-S87 PolarHBondContact O-N 3.4Å; L83-S87 PolarHBondContact O-OG 2.91Å; L83-S87 VanDerWaalsContact O-OG 3.04Å
84D86Confident85.3Confident13 Ų1340.3 Ų40.37%0.0724%0.237CC..Hα-helixtrans-63.6-38.7178.6-64.7-25.1000111R80 M81 L86 G88 P90R80-D84 IonicContact CZ-OD1 2.88Å; R80-D84 IonicContact NE-OD1 3.84Å; R80-D84 PolarHBondContact NE-OD1 3.29Å; R80-D84 VanDerWaalsContact NE-OD1 3.11Å; R80-D84 IonicContact NE-OD2 3.4Å; R80-D84 PolarHBondContact NE-OD2 2.9Å; R80-D84 IonicContact NH2-OD1 3.11Å; R80-D84 PolarHBondContact NH2-OD1 3.21Å; R80-D84 IonicContact NH2-OD2 3.24Å; R80-D84 VanDerWaalsContact O-CG 3.25Å; R80-D84 PolarHBondContact O-N 3.17Å; M81-D84 PolarHBondContact O-N 2.99Å; D84-L86 VanDerWaalsContact C-N 3.33Å; D84-L86 PolarHBondContact O-N 2.83Å; D84-G88 PolarHBondContact O-N 3.32Å; D84-P90 HydrophobicContact CB-CB 4.05Å; D84-P90 WeakPolarHBondContact OD1-CA 3.34Å
85L85.8Confident85.1Confident10 Ų1042 Ų425%0.05226%0.255CS..Hα-helixtrans-64.8-32.7174.3-72.2167.7000112.9R24 F27 F28 F31 M81 L82 L83R24-L85 HydrophobicContact CB-CD2 4.24Å; R24-L85 HydrophobicContact CG-CD2 4.12Å; R24-L85 PolarHBondContact NE-O 3.03Å; R24-L85 PolarHBondContact NH2-O 3.3Å; F27-L85 HydrophobicContact CB-CD1 4.04Å; F27-L85 HydrophobicContact CB-CD2 4.05Å; F28-L85 HydrophobicContact CB-CB 4.17Å; F28-L85 HydrophobicContact CB-CD1 4.46Å; F28-L85 HydrophobicContact CD2-CB 4.49Å; F31-L85 HydrophobicContact CD2-CD1 4.15Å; M81-L85 HydrophobicContact CG-CD1 4.17Å; M81-L85 WeakPolarHBondContact O-CB 3.39Å; M81-L85 VanDerWaalsContact O-CG 3.24Å; M81-L85 WeakPolarHBondContact O-CG 3.33Å; M81-L85 PolarHBondContact O-N 3.37Å; L82-L85 PolarHBondContact O-N 3.49Å; L83-L85 VanDerWaalsContact C-N 3.31Å; L83-L85 PolarHBondContact O-N 3.13Å
86L84.5Confident85Confident94 Ų9441.6 Ų41.649%0.49226%0.256SS..Hα-helixtrans-82.2-55178-76173.6000113.3R24 F28 L82 L83 D84R24-L86 PolarHBondContact NH2-O 3.29Å; F28-L86 HydrophobicContact CD1-CD2 4.04Å; F28-L86 HydrophobicContact CD2-CD1 4.07Å; F28-L86 HydrophobicContact CD2-CD2 3.82Å; F28-L86 HydrophobicContact CD2-CG 3.56Å; F28-L86 HydrophobicContact CE1-CD2 3.91Å; F28-L86 HydrophobicContact CE1-CG 4.5Å; F28-L86 HydrophobicContact CE2-CD1 3.33Å; F28-L86 HydrophobicContact CE2-CD2 3.69Å; F28-L86 HydrophobicContact CE2-CG 3.36Å; F28-L86 HydrophobicContact CG-CD2 4Å; F28-L86 HydrophobicContact CG-CG 4.23Å; F28-L86 HydrophobicContact CZ-CD1 3.68Å; F28-L86 HydrophobicContact CZ-CD2 3.73Å; F28-L86 HydrophobicContact CZ-CG 3.88Å; L82-L86 WeakPolarHBondContact O-CG 3.48Å; L82-L86 PolarHBondContact O-N 2.95Å; L82-L86 VanDerWaalsContact O-N 3.1Å; L83-L86 PolarHBondContact O-N 3.12Å; L83-L86 VanDerWaalsContact O-N 3.15Å; D84-L86 VanDerWaalsContact C-N 3.33Å; D84-L86 PolarHBondContact O-N 2.83Å
87S80.3Confident84.9Confident76 Ų7640.2 Ų40.253%0.53125%0.249SC..Hα-helixtrans-77.2-27.7-168.471.20000112.8L83 N89L83-S87 WeakPolarHBondContact O-CB 3.28Å; L83-S87 PolarHBondContact O-N 3.4Å; L83-S87 PolarHBondContact O-OG 2.91Å; L83-S87 VanDerWaalsContact O-OG 3.04Å; S87-N89 PolarHBondContact O-N 3.1Å; S87-N89 PolarHBondContact OG-N 3.38Å; S87-N89 VanDerWaalsContact OG-N 3.16Å
88G69.4Low85.2Confident36 Ų3641.2 Ų41.237%0.37125%0.254SS..SBendtrans66.211-173.100000113.6R24 D84 P90R24-G88 VanDerWaalsContact CZ-CA 3.5Å; R24-G88 VanDerWaalsContact NH1-CA 3.34Å; D84-G88 PolarHBondContact O-N 3.32Å; G88-P90 WeakPolarHBondContact O-CD 3.47Å
89N71.9Confident85.3Confident97 Ų9744.8 Ų44.852%0.51928%0.276SS..  trans-117.684.2176.3-172.62.8000109.5S87 T91S87-N89 PolarHBondContact O-N 3.1Å; S87-N89 PolarHBondContact OG-N 3.38Å; S87-N89 VanDerWaalsContact OG-N 3.16Å; N89-T91 PolarHBondContact O-N 3.17Å; N89-T91 WeakPolarHBondContact OD1-CG2 3.34Å; N89-T91 PolarHBondContact OD1-OG1 2.95Å
90P77.7Confident85.6Confident21 Ų2143.6 Ų43.614%0.13627%0.267CS..  trans-88.646.1-167.838.7-38.3000112.4V13 L14 D84 G88V13-P90 CarbonylContact C-O 3.58Å; V13-P90 WeakPolarHBondContact CA-O 3.47Å; V13-P90 HydrophobicContact CG1-CG 3.95Å; L14-P90 HydrophobicContact CB-CB 4.18Å; L14-P90 PolarHBondContact N-O 3.41Å; L14-P90 WeakPolarHBondContact O-CB 3.46Å; L14-P90 WeakPolarHBondContact O-CG 3.47Å; D84-P90 HydrophobicContact CB-CB 4.05Å; D84-P90 WeakPolarHBondContact OD1-CA 3.34Å; G88-P90 WeakPolarHBondContact O-CD 3.47Å
91T84.1Confident85.8Confident73 Ų7341.1 Ų41.145%0.44826%0.257SS..EExtended strand (participates in β ladder)trans-91.7130.6-178.956.30000112.2F12 V13 R80 N89F12-T91 CarbonylContact O-C 3.37Å; F12-T91 VanDerWaalsContact O-CA 3.29Å; F12-T91 WeakPolarHBondContact O-CA 3.22Å; V13-T91 HydrophobicContact CG2-CG2 4.27Å; R80-T91 PolarHBondContact NH1-O 3.37Å; R80-T91 VanDerWaalsContact NH1-O 3.08Å; R80-T91 PolarHBondContact NH2-O 2.96Å; N89-T91 PolarHBondContact O-N 3.17Å; N89-T91 WeakPolarHBondContact OD1-CG2 3.34Å; N89-T91 PolarHBondContact OD1-OG1 2.95Å
92I87.1Confident86.1Confident10 Ų1043.1 Ų43.15%0.05127%0.266CS..EExtended strand (participates in β ladder)trans-120.6135.8173.8-169.1165.7000109.5G11 F12 L14 C97G11-I92 CarbonylContact C-O 3.45Å; G11-I92 WeakPolarHBondContact CA-O 3.45Å; F12-I92 HydrophobicContact CB-CG2 3.95Å; F12-I92 HydrophobicContact CD2-CG2 4.49Å; F12-I92 PolarHBondContact N-O 3.19Å; F12-I92 PolarHBondContact O-N 3.06Å; L14-I92 HydrophobicContact CD1-CB 4.39Å; L14-I92 HydrophobicContact CD1-CG2 4.2Å; L14-I92 HydrophobicContact CG-CG2 4.23Å; I92-C97 HydrophobicContact CD1-CB 4.29Å; I92-C97 HydrophobicContact CG1-CB 4.38Å; I92-C97 HydrophobicContact CG2-CB 4.25Å
93S89.7Confident86.3Confident70 Ų7046.8 Ų46.849%0.4928%0.282SS..EExtended strand (participates in β ladder)trans-68.3156.2174.365.20000110.8G95 G96 C97S93-G95 VanDerWaalsContact C-N 3.28Å; S93-G95 PolarHBondContact O-N 3.48Å; S93-G96 PolarHBondContact O-N 2.85Å; S93-G96 VanDerWaalsContact O-N 3.09Å; S93-G96 PolarHBondContact OG-N 2.91Å; S93-G96 VanDerWaalsContact OG-N 3.07Å; S93-C97 WeakPolarHBondContact O-CB 3.27Å; S93-C97 PolarHBondContact O-N 2.97Å
94F85.8Confident86.5Confident57 Ų5742 Ų4225%0.2526%0.256CS..Hα-helixtrans-54-46.3175.5-179.7-104.5000111.9T10 F12 G96 C97 L98 F168T10-F94 PolarHBondContact O-N 3.05Å; T10-F94 VanDerWaalsContact O-N 3.16Å; F12-F94 AromaticContact CE2-CD2 3.6Å; F12-F94 HydrophobicContact CE2-CD2 3.6Å; F12-F94 HydrophobicContact CE2-CE2 4.32Å; F12-F94 AromaticContact CZ-CD2 3.8Å; F12-F94 HydrophobicContact CZ-CD2 3.8Å; F12-F94 HydrophobicContact CZ-CE2 4.26Å; F94-G96 PolarHBondContact O-N 2.99Å; F94-C97 WeakPolarHBondContact O-CB 3.47Å; F94-C97 PolarHBondContact O-N 3.41Å; F94-L98 HydrophobicContact CD1-CD1 3.88Å; F94-L98 HydrophobicContact CE1-CD1 3.33Å; F94-L98 HydrophobicContact CE1-CG 4.19Å; F94-L98 HydrophobicContact CE2-CD1 4.42Å; F94-L98 HydrophobicContact CZ-CD1 3.64Å; F94-L98 HydrophobicContact CZ-CD2 4.41Å; F94-L98 HydrophobicContact CZ-CG 4.17Å; F94-L98 WeakPolarHBondContact O-CG 3.33Å; F94-L98 PolarHBondContact O-N 2.96Å; F94-F168 AromaticContact CE2-CD2 3.81Å; F94-F168 HydrophobicContact CE2-CD2 3.81Å; F94-F168 AromaticContact CE2-CE2 3.58Å; F94-F168 HydrophobicContact CE2-CE2 3.58Å; F94-F168 HydrophobicContact CE2-CZ 4.4Å; F94-F168 HydrophobicContact CZ-CD2 4.4Å; F94-F168 HydrophobicContact CZ-CE2 4.03Å
95G87.3Confident86.7Confident39 Ų3941.7 Ų41.740%0.40225%0.254SS..Hα-helixtrans-63.7-37.8176.200000113.7S93 T99S93-G95 VanDerWaalsContact C-N 3.28Å; S93-G95 PolarHBondContact O-N 3.48Å; G95-T99 WeakPolarHBondContact O-CB 3.39Å; G95-T99 PolarHBondContact O-N 3.34Å; G95-T99 PolarHBondContact O-OG1 3.03Å
96G89.4Confident87.2Confident26 Ų2642.6 Ų42.627%0.26826%0.258SS..Hα-helixtrans-64.4-41.3173.800000112.1S93 F94 T99 Q100S93-G96 PolarHBondContact O-N 2.85Å; S93-G96 VanDerWaalsContact O-N 3.09Å; S93-G96 PolarHBondContact OG-N 2.91Å; S93-G96 VanDerWaalsContact OG-N 3.07Å; F94-G96 PolarHBondContact O-N 2.99Å; G96-T99 PolarHBondContact O-N 3.02Å; G96-Q100 WeakPolarHBondContact O-CB 3.32Å; G96-Q100 PolarHBondContact O-N 3.01Å
97C89.8Confident87.6Confident1 Ų138.5 Ų38.51%0.00724%0.237CC..Hα-helixtrans-63.3-45.5177.1-169.60000111.9F12 I92 S93 F94 Q100 L101 C179F12-C97 HydrophobicContact CD2-CB 3.94Å; F12-C97 HydrophobicContact CE2-CB 4.11Å; I92-C97 HydrophobicContact CD1-CB 4.29Å; I92-C97 HydrophobicContact CG1-CB 4.38Å; I92-C97 HydrophobicContact CG2-CB 4.25Å; S93-C97 WeakPolarHBondContact O-CB 3.27Å; S93-C97 PolarHBondContact O-N 2.97Å; F94-C97 WeakPolarHBondContact O-CB 3.47Å; F94-C97 PolarHBondContact O-N 3.41Å; C97-Q100 PolarHBondContact O-N 3.48Å; C97-L101 VanDerWaalsContact O-CB 3.31Å; C97-L101 WeakPolarHBondContact O-CB 3.34Å; C97-L101 PolarHBondContact O-N 3.35Å; C97-C179 WeakPolarHBondContact CA-SG 3.24Å; C97-C179 HydrophobicContact CB-CB 4.03Å; C97-C179 WeakPolarHBondContact CB-SG 3.37Å; C97-C179 WeakPolarHBondContact SG-CB 3.16Å; C97-C179 CovalentContact SG-SG 2.03Å; C97-C179 PolarHBondContact SG-SG 3.23Å
98L90.9Very high88.1Confident22 Ų2235.5 Ų35.512%0.11522%0.217CC..Hα-helixtrans-65.6-38.2175.8-69.6177.6000112.9F94 L101 F102 T163 I164F94-L98 HydrophobicContact CD1-CD1 3.88Å; F94-L98 HydrophobicContact CE1-CD1 3.33Å; F94-L98 HydrophobicContact CE1-CG 4.19Å; F94-L98 HydrophobicContact CE2-CD1 4.42Å; F94-L98 HydrophobicContact CZ-CD1 3.64Å; F94-L98 HydrophobicContact CZ-CD2 4.41Å; F94-L98 HydrophobicContact CZ-CG 4.17Å; F94-L98 WeakPolarHBondContact O-CG 3.33Å; F94-L98 PolarHBondContact O-N 2.96Å; L98-L101 WeakPolarHBondContact O-CB 3.47Å; L98-L101 PolarHBondContact O-N 3Å; L98-F102 WeakPolarHBondContact O-CB 3.35Å; L98-F102 PolarHBondContact O-N 3.5Å; L98-T163 HydrophobicContact CD2-CG2 3.99Å; L98-I164 HydrophobicContact CD1-CD1 3.82Å; L98-I164 HydrophobicContact CD1-CG1 3.58Å; L98-I164 HydrophobicContact CD2-CG1 3.89Å; L98-I164 HydrophobicContact CG-CG1 4.39Å
99T92Very high89.1Confident76 Ų7634 Ų3447%0.46620%0.202SC..Hα-helixtrans-65.5-44.5176.7-62.40000110.5G95 G96 L101 F102 F103G95-T99 WeakPolarHBondContact O-CB 3.39Å; G95-T99 PolarHBondContact O-N 3.34Å; G95-T99 PolarHBondContact O-OG1 3.03Å; G96-T99 PolarHBondContact O-N 3.02Å; T99-L101 VanDerWaalsContact C-N 3.35Å; T99-F102 WeakPolarHBondContact O-CB 3.49Å; T99-F102 PolarHBondContact O-N 3.28Å; T99-F103 HydrophobicContact CG2-CD2 3.77Å; T99-F103 HydrophobicContact CG2-CE2 3.68Å; T99-F103 VanDerWaalsContact O-CD2 3.24Å; T99-F103 WeakPolarHBondContact O-CD2 3.47Å; T99-F103 PolarHBondContact O-N 3.21Å
100Q92.7Very high90.1Very high18 Ų1829.4 Ų29.48%0.08418%0.177CC..Hα-helixtrans-62.1-44.1175.3-170.8176.8-46.900111.2I76 G96 C97 F102 F103 F104I76-Q100 HydrophobicContact CG2-CG 3.9Å; G96-Q100 WeakPolarHBondContact O-CB 3.32Å; G96-Q100 PolarHBondContact O-N 3.01Å; C97-Q100 PolarHBondContact O-N 3.48Å; Q100-F102 VanDerWaalsContact C-N 3.34Å; Q100-F102 PolarHBondContact O-N 2.88Å; Q100-F103 PolarHBondContact O-N 2.93Å; Q100-F104 WeakPolarHBondContact O-CB 3.44Å; Q100-F104 PolarHBondContact O-N 2.67Å
101L91.6Very high90.6Very high0 Ų028.8 Ų28.80%017%0.173CC..Hα-helixtrans-58.5-44.8176-174.373000112.2C97 L98 T99 H105 V160 T163 V181 L184C97-L101 VanDerWaalsContact O-CB 3.31Å; C97-L101 WeakPolarHBondContact O-CB 3.34Å; C97-L101 PolarHBondContact O-N 3.35Å; L98-L101 WeakPolarHBondContact O-CB 3.47Å; L98-L101 PolarHBondContact O-N 3Å; T99-L101 VanDerWaalsContact C-N 3.35Å; L101-H105 PolarHBondContact O-N 3.24Å; L101-H105 PolarHBondContact O-ND1 3.33Å; L101-V160 HydrophobicContact CD2-CG2 4.4Å; L101-T163 HydrophobicContact CD2-CG2 3.97Å; L101-V181 HydrophobicContact CD1-CG2 3.73Å; L101-V181 HydrophobicContact CD2-CG2 4.14Å; L101-V181 HydrophobicContact CG-CG2 4.38Å; L101-L184 HydrophobicContact CD2-CD1 4.22Å
102F94.1Very high90.8Very high44 Ų4426.4 Ų26.419%0.19316%0.157CC..Hα-helixtrans-58.9-59.5177175.7-93.7000110.5L98 T99 Q100 F104 H105 F106 F153 S156 I157 V160L98-F102 WeakPolarHBondContact O-CB 3.35Å; L98-F102 PolarHBondContact O-N 3.5Å; T99-F102 WeakPolarHBondContact O-CB 3.49Å; T99-F102 PolarHBondContact O-N 3.28Å; Q100-F102 VanDerWaalsContact C-N 3.34Å; Q100-F102 PolarHBondContact O-N 2.88Å; F102-F104 PolarHBondContact O-N 3.41Å; F102-H105 PolarHBondContact O-N 3.39Å; F102-F106 HydrophobicContact CE1-CB 4.42Å; F102-F106 HydrophobicContact CE1-CD1 4.27Å; F102-F106 HydrophobicContact CE1-CG 4.47Å; F102-F106 WeakPolarHBondContact O-CB 3.5Å; F102-F106 PolarHBondContact O-N 3.4Å; F102-F153 HydrophobicContact CE2-CD2 4.3Å; F102-F153 HydrophobicContact CE2-CE2 4.2Å; F102-F153 AromaticContact CZ-CD2 3.86Å; F102-F153 HydrophobicContact CZ-CD2 3.86Å; F102-F153 AromaticContact CZ-CE2 3.8Å; F102-F153 HydrophobicContact CZ-CE2 3.8Å; F102-S156 VanDerWaalsContact CA-OG 3.27Å; F102-S156 WeakPolarHBondContact CA-OG 3.39Å; F102-S156 WeakPolarHBondContact CD2-OG 3.34Å; F102-S156 PolarHBondContact O-OG 3.45Å; F102-I157 HydrophobicContact CE2-CG1 4.22Å; F102-V160 HydrophobicContact CB-CG2 3.83Å; F102-V160 HydrophobicContact CD2-CG2 4.15Å
103F94.9Very high90.8Very high94 Ų9428.6 Ų28.641%0.41217%0.166SC..Hα-helixtrans-62.5-34.6-176.8-77.1-67000112.2I76 T99 Q100 F106 I107I76-F103 HydrophobicContact CD1-CB 3.62Å; I76-F103 WeakPolarHBondContact CD1-O 3.29Å; I76-F103 HydrophobicContact CG1-CB 3.89Å; I76-F103 HydrophobicContact CG2-CB 4.37Å; T99-F103 HydrophobicContact CG2-CD2 3.77Å; T99-F103 HydrophobicContact CG2-CE2 3.68Å; T99-F103 VanDerWaalsContact O-CD2 3.24Å; T99-F103 WeakPolarHBondContact O-CD2 3.47Å; T99-F103 PolarHBondContact O-N 3.21Å; Q100-F103 PolarHBondContact O-N 2.93Å; F103-F106 HydrophobicContact CD1-CD1 4.39Å; F103-I107 WeakPolarHBondContact O-CB 3.43Å; F103-I107 VanDerWaalsContact O-CG1 3.32Å; F103-I107 WeakPolarHBondContact O-CG1 3Å; F103-I107 PolarHBondContact O-N 3.21Å
104F91.4Very high90.9Very high4 Ų425.3 Ų25.32%0.01814%0.143CC..Hα-helixtrans-60.4-52.5176.1-173.5-102.6000112.3Y73 I76 T77 Q100 F102 G108 Y178 Y275 T276Y73-F104 HydrophobicContact CD2-CD2 4.47Å; Y73-F104 HydrophobicContact CE1-CE2 4.15Å; Y73-F104 AromaticContact CE2-CD2 3.67Å; Y73-F104 HydrophobicContact CE2-CD2 3.67Å; Y73-F104 AromaticContact CE2-CE2 3.64Å; Y73-F104 HydrophobicContact CE2-CE2 3.64Å; Y73-F104 HydrophobicContact CE2-CG 4.29Å; Y73-F104 HydrophobicContact CE2-CZ 4.23Å; Y73-F104 WeakPolarHBondContact CE2-O 3.42Å; Y73-F104 AromaticContact CZ-CD2 3.9Å; Y73-F104 AromaticContact CZ-CE2 3.35Å; Y73-F104 AromaticContact CZ-CZ 3.76Å; Y73-F104 WeakPolarHBondContact OH-CE2 3.49Å; Y73-F104 WeakPolarHBondContact OH-CZ 3.37Å; I76-F104 HydrophobicContact CG2-CB 4.29Å; T77-F104 HydrophobicContact CG2-CD2 3.71Å; T77-F104 HydrophobicContact CG2-CE2 3.77Å; Q100-F104 WeakPolarHBondContact O-CB 3.44Å; Q100-F104 PolarHBondContact O-N 2.67Å; F102-F104 PolarHBondContact O-N 3.41Å; F104-G108 WeakPolarHBondContact O-CA 3.3Å; F104-G108 PolarHBondContact O-N 2.87Å; F104-Y178 AromaticContact CE1-CE2 3.97Å; F104-Y178 HydrophobicContact CE1-CE2 3.97Å; F104-Y178 HydrophobicContact CE2-CD2 4.29Å; F104-Y178 HydrophobicContact CE2-CE2 4.05Å; F104-Y178 HydrophobicContact CZ-CD2 4.34Å; F104-Y178 AromaticContact CZ-CE2 3.67Å; F104-Y178 HydrophobicContact CZ-CE2 3.67Å; F104-Y275 HydrophobicContact CE1-CE2 4.5Å; F104-Y275 HydrophobicContact CE2-CE2 4.47Å; F104-Y275 AromaticContact CZ-CE2 3.67Å; F104-Y275 HydrophobicContact CZ-CE2 3.67Å; F104-Y275 AromaticContact CZ-CZ 3.85Å; F104-Y275 VanDerWaalsContact CZ-OH 3.27Å; F104-Y275 WeakPolarHBondContact CZ-OH 2.85Å; F104-T276 HydrophobicContact CE2-CG2 3.79Å; F104-T276 HydrophobicContact CZ-CG2 3.98Å
105H91.3Very high90.8Very high8 Ų822.6 Ų22.64%0.03713%0.131CC..Hα-helixtrans-71.8-33.8179-76.182.6000112.6L101 F102 G109 H155 Q159 D180L101-H105 PolarHBondContact O-N 3.24Å; L101-H105 PolarHBondContact O-ND1 3.33Å; F102-H105 PolarHBondContact O-N 3.39Å; H105-G109 WeakPolarHBondContact O-CA 3.38Å; H105-G109 PolarHBondContact O-N 3.33Å; H105-H155 AromaticContact CD2-NE2 3.68Å; H105-Q159 HydrophobicContact CB-CG 4.4Å; H105-D180 IonicContact CE1-OD1 2.65Å; H105-D180 PolarHBondContact CE1-OD1 2.96Å; H105-D180 VanDerWaalsContact CE1-OD1 3.29Å; H105-D180 IonicContact NE2-OD1 3.29Å
106F94.7Very high90.7Very high28 Ų2822.4 Ų22.412%0.12312%0.122CC..Hα-helixtrans-61.6-58.2176.8179-137.1000110.9F102 F103 G109 I110 W149 F153F102-F106 HydrophobicContact CE1-CB 4.42Å; F102-F106 HydrophobicContact CE1-CD1 4.27Å; F102-F106 HydrophobicContact CE1-CG 4.47Å; F102-F106 WeakPolarHBondContact O-CB 3.5Å; F102-F106 PolarHBondContact O-N 3.4Å; F103-F106 HydrophobicContact CD1-CD1 4.39Å; F106-G109 PolarHBondContact O-N 3.02Å; F106-I110 HydrophobicContact CD1-CD1 4.49Å; F106-I110 HydrophobicContact CD2-CD1 3.84Å; F106-I110 HydrophobicContact CD2-CG1 4.38Å; F106-I110 HydrophobicContact CE1-CD1 4.29Å; F106-I110 HydrophobicContact CE2-CD1 3.61Å; F106-I110 HydrophobicContact CE2-CG1 4.32Å; F106-I110 HydrophobicContact CG-CD1 4.3Å; F106-I110 HydrophobicContact CZ-CD1 3.88Å; F106-I110 WeakPolarHBondContact O-CD1 3.38Å; F106-I110 WeakPolarHBondContact O-CG1 3.36Å; F106-I110 PolarHBondContact O-N 2.94Å; F106-I110 VanDerWaalsContact O-N 3.08Å; F106-W149 HydrophobicContact CE1-CE3 4.14Å; F106-W149 AromaticContact CE1-CZ3 3.8Å; F106-W149 HydrophobicContact CE1-CZ3 3.8Å; F106-W149 HydrophobicContact CE2-CE3 4.06Å; F106-W149 HydrophobicContact CE2-CZ3 4.5Å; F106-W149 AromaticContact CZ-CE3 3.46Å; F106-W149 HydrophobicContact CZ-CE3 3.46Å; F106-W149 VanDerWaalsContact CZ-CE3 3.46Å; F106-W149 AromaticContact CZ-CZ3 3.62Å; F106-W149 HydrophobicContact CZ-CZ3 3.62Å; F106-F153 HydrophobicContact CD2-CB 4.12Å; F106-F153 HydrophobicContact CE2-CB 3.7Å; F106-F153 HydrophobicContact CE2-CD2 4.28Å
107I94.1Very high90.6Very high9 Ų921.9 Ų21.95%0.04611%0.114CC..Hα-helixtrans-66.9-40.3-179.8-59.9-58.3000110.9L69 C72 Y73 I76 F103 I110 K111L69-I107 HydrophobicContact CB-CG2 4.17Å; L69-I107 HydrophobicContact CD2-CD1 4.02Å; L69-I107 HydrophobicContact CD2-CG2 4.06Å; L69-I107 WeakPolarHBondContact O-CG2 3.46Å; C72-I107 HydrophobicContact CB-CD1 4.22Å; C72-I107 HydrophobicContact CB-CG1 4.26Å; C72-I107 HydrophobicContact CB-CG2 4.27Å; Y73-I107 HydrophobicContact CD2-CB 4.11Å; Y73-I107 HydrophobicContact CD2-CG2 3.86Å; Y73-I107 HydrophobicContact CG-CG2 4.3Å; I76-I107 HydrophobicContact CD1-CB 4.22Å; I76-I107 HydrophobicContact CD1-CG1 3.76Å; F103-I107 WeakPolarHBondContact O-CB 3.43Å; F103-I107 VanDerWaalsContact O-CG1 3.32Å; F103-I107 WeakPolarHBondContact O-CG1 3Å; F103-I107 PolarHBondContact O-N 3.21Å; I107-I110 HydrophobicContact CD1-CD1 4.39Å; I107-I110 PolarHBondContact O-N 2.83Å; I107-K111 HydrophobicContact CG2-CD 4.2Å; I107-K111 VanDerWaalsContact O-CG 3.3Å; I107-K111 WeakPolarHBondContact O-CG 3.42Å; I107-K111 PolarHBondContact O-N 3.3Å
108G89.8Confident90.5Very high12 Ų1221.9 Ų21.912%0.12411%0.114CC..Hα-helixtrans-59.6-45.6175.800000112.9F104 K111 I112F104-G108 WeakPolarHBondContact O-CA 3.3Å; F104-G108 PolarHBondContact O-N 2.87Å; G108-K111 WeakPolarHBondContact O-CB 3.43Å; G108-K111 PolarHBondContact O-N 3.2Å; G108-I112 WeakPolarHBondContact O-CG1 3.32Å; G108-I112 PolarHBondContact O-N 2.92Å
109G90.4Very high90Very high5 Ų521 Ų215%0.05211%0.109CC..Hα-helixtrans-62.2-46.717700000112.3H105 F106 K111 I112 F113H105-G109 WeakPolarHBondContact O-CA 3.38Å; H105-G109 PolarHBondContact O-N 3.33Å; F106-G109 PolarHBondContact O-N 3.02Å; G109-K111 VanDerWaalsContact C-N 3.29Å; G109-K111 PolarHBondContact O-N 2.89Å; G109-I112 PolarHBondContact O-N 2.92Å; G109-F113 WeakPolarHBondContact O-CD2 3.33Å; G109-F113 WeakPolarHBondContact O-CG 3.48Å; G109-F113 PolarHBondContact O-N 3.35Å
110I93Very high89.6Confident0 Ų022.4 Ų22.40%011%0.107CC..Hα-helixtrans-58.5-44.2175.9-60162.2000110.3L69 F106 I107 I112 F113 L114 M145 W149L69-I110 HydrophobicContact CD1-CB 4.19Å; L69-I110 HydrophobicContact CD1-CG2 3.51Å; L69-I110 HydrophobicContact CD2-CB 4.16Å; L69-I110 HydrophobicContact CD2-CD1 4.27Å; L69-I110 HydrophobicContact CD2-CG2 3.91Å; L69-I110 HydrophobicContact CG-CG2 4.37Å; F106-I110 HydrophobicContact CD1-CD1 4.49Å; F106-I110 HydrophobicContact CD2-CD1 3.84Å; F106-I110 HydrophobicContact CD2-CG1 4.38Å; F106-I110 HydrophobicContact CE1-CD1 4.29Å; F106-I110 HydrophobicContact CE2-CD1 3.61Å; F106-I110 HydrophobicContact CE2-CG1 4.32Å; F106-I110 HydrophobicContact CG-CD1 4.3Å; F106-I110 HydrophobicContact CZ-CD1 3.88Å; F106-I110 WeakPolarHBondContact O-CD1 3.38Å; F106-I110 WeakPolarHBondContact O-CG1 3.36Å; F106-I110 PolarHBondContact O-N 2.94Å; F106-I110 VanDerWaalsContact O-N 3.08Å; I107-I110 HydrophobicContact CD1-CD1 4.39Å; I107-I110 PolarHBondContact O-N 2.83Å; I110-I112 PolarHBondContact O-N 3.45Å; I110-F113 PolarHBondContact O-N 3.26Å; I110-L114 WeakPolarHBondContact O-CB 3.45Å; I110-L114 PolarHBondContact O-N 3.47Å; I110-M145 HydrophobicContact CG2-CE 3.58Å; I110-W149 HydrophobicContact CD1-CD2 3.72Å; I110-W149 HydrophobicContact CD1-CE3 3.26Å; I110-W149 HydrophobicContact CD1-CG 4.41Å; I110-W149 HydrophobicContact CD1-CH2 4.14Å; I110-W149 HydrophobicContact CD1-CZ3 3.5Å; I110-W149 VanDerWaalsContact CD1-CZ3 3.5Å; I110-W149 HydrophobicContact CG1-CE3 4.39Å
111K89.4Confident89.3Confident9 Ų921.8 Ų21.84%0.03910%0.104CC..Hα-helixtrans-59.2-44.9178.2-76.1176.157170.80112.1L66 L69 D70 Y73 I107 G108 G109 L114 L115L66-K111 HydrophobicContact CD1-CG 4.48Å; L69-K111 HydrophobicContact CB-CD 4.01Å; L69-K111 HydrophobicContact CB-CG 3.56Å; L69-K111 HydrophobicContact CD1-CG 3.91Å; L69-K111 HydrophobicContact CG-CG 4.3Å; D70-K111 WeakPolarHBondContact OD1-CE 3.49Å; D70-K111 IonicContact OD1-NZ 2.9Å; D70-K111 PolarHBondContact OD1-NZ 3.39Å; Y73-K111 HydrophobicContact CG-CD 4.29Å; I107-K111 HydrophobicContact CG2-CD 4.2Å; I107-K111 VanDerWaalsContact O-CG 3.3Å; I107-K111 WeakPolarHBondContact O-CG 3.42Å; I107-K111 PolarHBondContact O-N 3.3Å; G108-K111 WeakPolarHBondContact O-CB 3.43Å; G108-K111 PolarHBondContact O-N 3.2Å; G109-K111 VanDerWaalsContact C-N 3.29Å; G109-K111 PolarHBondContact O-N 2.89Å; K111-L114 PolarHBondContact O-N 2.95Å; K111-L115 VanDerWaalsContact O-CG 3.28Å; K111-L115 WeakPolarHBondContact O-CG 3.23Å; K111-L115 PolarHBondContact O-N 3.04Å
112I86.9Confident88.7Confident23 Ų2322.6 Ų22.612%0.11811%0.107CC..Hα-helixtrans-61.5-48.4178.6-71.9172.2000110.5G108 G109 I110 L114 L115 T116 C210 F251G108-I112 WeakPolarHBondContact O-CG1 3.32Å; G108-I112 PolarHBondContact O-N 2.92Å; G109-I112 PolarHBondContact O-N 2.92Å; I110-I112 PolarHBondContact O-N 3.45Å; I112-L114 VanDerWaalsContact C-N 3.34Å; I112-L114 PolarHBondContact O-N 2.88Å; I112-L115 PolarHBondContact O-N 3.44Å; I112-T116 PolarHBondContact O-N 2.99Å; I112-T116 PolarHBondContact O-OG1 3.02Å; I112-C210 HydrophobicContact CG2-CB 4.16Å; I112-F251 HydrophobicContact CG1-CZ 4.43Å; I112-F251 HydrophobicContact CG2-CE1 4.13Å; I112-F251 HydrophobicContact CG2-CZ 3.91Å
113F88.8Confident88Confident56 Ų5624.9 Ų24.925%0.24612%0.115CC..Hα-helixtrans-63.6-40.4177.7-61.7-41.4000112.2G109 I110 L115 T116 V117 V206G109-F113 WeakPolarHBondContact O-CD2 3.33Å; G109-F113 WeakPolarHBondContact O-CG 3.48Å; G109-F113 PolarHBondContact O-N 3.35Å; I110-F113 PolarHBondContact O-N 3.26Å; F113-L115 PolarHBondContact O-N 3.24Å; F113-T116 WeakPolarHBondContact O-CB 3.16Å; F113-T116 PolarHBondContact O-N 3.39Å; F113-V117 WeakPolarHBondContact O-CG2 3.24Å; F113-V117 PolarHBondContact O-N 3.42Å; F113-V206 HydrophobicContact CE1-CG1 4.11Å
114L89.9Confident87.4Confident0 Ų020.5 Ų20.50%010%0.096CC..Hα-helixtrans-62.7-41.8177.8-174.761000112.3L62 N65 L66 L69 I110 K111 I112 T116 V117 M118 M145L62-L114 HydrophobicContact CB-CD1 4.44Å; L62-L114 HydrophobicContact CD2-CD1 3.44Å; L62-L114 VanDerWaalsContact CD2-CD1 3.44Å; N65-L114 HydrophobicContact CB-CD2 3.98Å; L66-L114 HydrophobicContact CB-CD2 3.8Å; L66-L114 HydrophobicContact CD1-CD2 4.25Å; L69-L114 HydrophobicContact CD1-CD2 3.68Å; I110-L114 WeakPolarHBondContact O-CB 3.45Å; I110-L114 PolarHBondContact O-N 3.47Å; K111-L114 PolarHBondContact O-N 2.95Å; I112-L114 VanDerWaalsContact C-N 3.34Å; I112-L114 PolarHBondContact O-N 2.88Å; L114-T116 VanDerWaalsContact C-N 3.28Å; L114-T116 PolarHBondContact O-N 3.46Å; L114-V117 WeakPolarHBondContact O-CB 3.43Å; L114-V117 PolarHBondContact O-N 3.48Å; L114-M118 HydrophobicContact CG-SD 4.48Å; L114-M118 WeakPolarHBondContact O-CG 3.39Å; L114-M118 PolarHBondContact O-N 3.28Å; L114-M145 HydrophobicContact CD1-SD 3.61Å; L114-M145 HydrophobicContact CD2-CE 4.49Å; L114-M145 HydrophobicContact CD2-SD 4.43Å
115L85.1Confident86.9Confident0 Ų022.1 Ų22.10%011%0.11CC..Hα-helixtrans-62.6-36.6175.7-72.3166.9000112L66 K111 I112 F113 M118 A119 V246 I250 F251L66-L115 HydrophobicContact CD1-CD2 4.35Å; L66-L115 HydrophobicContact CD2-CD2 4.17Å; K111-L115 VanDerWaalsContact O-CG 3.28Å; K111-L115 WeakPolarHBondContact O-CG 3.23Å; K111-L115 PolarHBondContact O-N 3.04Å; I112-L115 PolarHBondContact O-N 3.44Å; F113-L115 PolarHBondContact O-N 3.24Å; L115-M118 PolarHBondContact O-N 2.86Å; L115-A119 PolarHBondContact O-N 3.29Å; L115-V246 HydrophobicContact CD2-CG1 4.29Å; L115-I250 HydrophobicContact CD1-CD1 3.55Å; L115-I250 HydrophobicContact CD1-CG2 4.23Å; L115-F251 HydrophobicContact CD1-CE2 4.05Å
116T83.9Confident86.1Confident35 Ų3523.6 Ų23.622%0.21512%0.118CC..Hα-helixtrans-64.7-43.9173.2-58.30000111.1I112 F113 L114 M118 A119 Y120 V213I112-T116 PolarHBondContact O-N 2.99Å; I112-T116 PolarHBondContact O-OG1 3.02Å; F113-T116 WeakPolarHBondContact O-CB 3.16Å; F113-T116 PolarHBondContact O-N 3.39Å; L114-T116 VanDerWaalsContact C-N 3.28Å; L114-T116 PolarHBondContact O-N 3.46Å; T116-M118 PolarHBondContact O-N 3.29Å; T116-A119 PolarHBondContact O-N 3.27Å; T116-Y120 PolarHBondContact O-N 3.15Å; T116-V213 HydrophobicContact CG2-CG1 4.37Å
117V87.9Confident85.2Confident15 Ų1523.7 Ų23.79%0.09112%0.122CC..Hα-helixtrans-61.4-43.2174.9173.30000111.4L62 F113 L114 A119 Y120 D121 L144L62-V117 HydrophobicContact CD1-CG1 4.16Å; L62-V117 HydrophobicContact CD2-CG1 3.86Å; F113-V117 WeakPolarHBondContact O-CG2 3.24Å; F113-V117 PolarHBondContact O-N 3.42Å; L114-V117 WeakPolarHBondContact O-CB 3.43Å; L114-V117 PolarHBondContact O-N 3.48Å; V117-A119 VanDerWaalsContact C-N 3.32Å; V117-A119 PolarHBondContact O-N 3.45Å; V117-Y120 PolarHBondContact O-N 3.1Å; V117-D121 WeakPolarHBondContact O-CB 3.3Å; V117-D121 PolarHBondContact O-N 2.89Å; V117-L144 HydrophobicContact CG1-CB 4.14Å; V117-L144 HydrophobicContact CG1-CD1 3.93Å; V117-L144 HydrophobicContact CG2-CB 4.06Å; V117-L144 HydrophobicContact CG2-CD1 4.47Å
118M87.1Confident84.6Confident2 Ų227.9 Ų27.91%0.0114%0.141CC..Hα-helixtrans-62.9-35.9177-72.6179.373.900112.9L62 L66 L114 L115 T116 R122 Y287L62-M118 HydrophobicContact CB-CG 3.68Å; L62-M118 HydrophobicContact CB-SD 4.23Å; L62-M118 HydrophobicContact CD1-CG 3.82Å; L62-M118 HydrophobicContact CG-CG 4.25Å; L66-M118 HydrophobicContact CB-SD 4.45Å; L66-M118 HydrophobicContact CD2-CE 4.33Å; L66-M118 HydrophobicContact CD2-SD 3.93Å; L114-M118 HydrophobicContact CG-SD 4.48Å; L114-M118 WeakPolarHBondContact O-CG 3.39Å; L114-M118 PolarHBondContact O-N 3.28Å; L115-M118 PolarHBondContact O-N 2.86Å; T116-M118 PolarHBondContact O-N 3.29Å; M118-R122 WeakPolarHBondContact O-CG 3.43Å; M118-R122 PolarHBondContact O-N 3.49Å; M118-Y287 HydrophobicContact CE-CE1 4.16Å
119A81.2Confident84.1Confident2 Ų231.5 Ų31.52%0.01716%0.163CC..Hα-helixtrans-73.6-37174.700000112.6L115 T116 V117 R122 Y123 L214 Y218L115-A119 PolarHBondContact O-N 3.29Å; T116-A119 PolarHBondContact O-N 3.27Å; V117-A119 VanDerWaalsContact C-N 3.32Å; V117-A119 PolarHBondContact O-N 3.45Å; A119-R122 PolarHBondContact O-N 2.86Å; A119-Y123 WeakPolarHBondContact O-CB 3.27Å; A119-Y123 PolarHBondContact O-N 3.04Å; A119-L214 HydrophobicContact CB-CD2 3.1Å; A119-L214 HydrophobicContact CB-CG 4.48Å; A119-Y218 HydrophobicContact CB-CE2 4.27Å
120Y83.8Confident83.8Confident107 Ų10738.8 Ų38.842%0.4220%0.199SC..Hα-helixtrans-62.3-45.1172.7-179.3-105.8000111.5T116 V117 R122 Y123 V124 M136T116-Y120 PolarHBondContact O-N 3.15Å; V117-Y120 PolarHBondContact O-N 3.1Å; Y120-R122 PolarHBondContact O-N 2.82Å; Y120-Y123 WeakPolarHBondContact O-CB 3.49Å; Y120-Y123 PolarHBondContact O-N 3.18Å; Y120-Y123 VanDerWaalsContact O-N 3.17Å; Y120-V124 HydrophobicContact CD1-CG2 4.3Å; Y120-V124 HydrophobicContact CD2-CG2 4.29Å; Y120-V124 HydrophobicContact CE1-CG2 3.84Å; Y120-V124 HydrophobicContact CE2-CG2 3.83Å; Y120-V124 WeakPolarHBondContact O-CG2 3.27Å; Y120-V124 PolarHBondContact O-N 3.35Å; Y120-M136 HydrophobicContact CD1-CE 3.7Å; Y120-M136 HydrophobicContact CE1-CE 4.13Å
121D85.4Confident83.5Confident5 Ų543.8 Ų43.83%0.02722%0.223CC..Hα-helixtrans-50.9-52.9172.6175.268.3000111.6L62 V117 Y123 V124 A125 Y132 M136L62-D121 HydrophobicContact CD1-CB 4.23Å; V117-D121 WeakPolarHBondContact O-CB 3.3Å; V117-D121 PolarHBondContact O-N 2.89Å; D121-Y123 VanDerWaalsContact C-N 3.34Å; D121-Y123 PolarHBondContact O-N 2.94Å; D121-V124 PolarHBondContact O-N 2.82Å; D121-A125 WeakPolarHBondContact O-CB 3.23Å; D121-A125 PolarHBondContact O-N 3.38Å; D121-Y132 WeakPolarHBondContact OD1-CE2 3.34Å; D121-Y132 PolarHBondContact OD1-OH 2.95Å; D121-M136 HydrophobicContact CB-CE 3.87Å; D121-M136 WeakPolarHBondContact OD1-CG 3.49Å
122R79.3Confident83.3Confident17 Ų1745.7 Ų45.76%0.06423%0.23CC..Hα-helixtrans-63.4-38.7179.1-72.2172.3175.6-88.37112.9M118 A119 Y120 I126 Y218 L221 T239M118-R122 WeakPolarHBondContact O-CG 3.43Å; M118-R122 PolarHBondContact O-N 3.49Å; A119-R122 PolarHBondContact O-N 2.86Å; Y120-R122 PolarHBondContact O-N 2.82Å; R122-I126 PolarHBondContact O-N 3.44Å; R122-Y218 VanDerWaalsContact CD-OH 3.22Å; R122-Y218 WeakPolarHBondContact CD-OH 3.35Å; R122-L221 HydrophobicContact CB-CD1 4.36Å; R122-T239 PolarHBondContact NH1-O 3.32Å
123Y79.6Confident83.2Confident92 Ų9249.5 Ų49.536%0.36126%0.255SS..Hα-helixtrans-61.7-50.7176.2171.2-96000110.8A119 Y120 D121 A125 I126 S127 A220A119-Y123 WeakPolarHBondContact O-CB 3.27Å; A119-Y123 PolarHBondContact O-N 3.04Å; Y120-Y123 WeakPolarHBondContact O-CB 3.49Å; Y120-Y123 PolarHBondContact O-N 3.18Å; Y120-Y123 VanDerWaalsContact O-N 3.17Å; D121-Y123 VanDerWaalsContact C-N 3.34Å; D121-Y123 PolarHBondContact O-N 2.94Å; Y123-A125 PolarHBondContact O-N 3.44Å; Y123-I126 PolarHBondContact O-N 3.27Å; Y123-S127 VanDerWaalsContact O-CB 3.24Å; Y123-S127 WeakPolarHBondContact O-CB 3.47Å; Y123-S127 PolarHBondContact O-N 3.17Å; Y123-S127 PolarHBondContact O-OG 2.87Å; Y123-A220 HydrophobicContact CE2-CB 4.45Å
124V82.1Confident83.1Confident2 Ų253 Ų531%0.01228%0.275CS..Hα-helixtrans-64.3-41.6179.5179.40000111.1Y120 D121 I126 Q128 Y132 I135Y120-V124 HydrophobicContact CD1-CG2 4.3Å; Y120-V124 HydrophobicContact CD2-CG2 4.29Å; Y120-V124 HydrophobicContact CE1-CG2 3.84Å; Y120-V124 HydrophobicContact CE2-CG2 3.83Å; Y120-V124 WeakPolarHBondContact O-CG2 3.27Å; Y120-V124 PolarHBondContact O-N 3.35Å; D121-V124 PolarHBondContact O-N 2.82Å; V124-I126 PolarHBondContact O-N 3.33Å; V124-Q128 CarbonylContact O-C 3.57Å; V124-Q128 PolarHBondContact O-N 3.25Å; V124-Y132 HydrophobicContact CB-CD2 4.36Å; V124-Y132 HydrophobicContact CG1-CD2 4.02Å; V124-I135 HydrophobicContact CG1-CB 3.9Å; V124-I135 HydrophobicContact CG1-CD1 3.88Å; V124-I135 HydrophobicContact CG1-CG2 3.75Å; V124-I135 HydrophobicContact CG2-CG2 4.18Å
125A81.8Confident82.9Confident37 Ų3755.5 Ų55.531%0.30629%0.288SS..Hα-helixtrans-57.2-34178.300000113.1D121 Y123 Y132D121-A125 WeakPolarHBondContact O-CB 3.23Å; D121-A125 PolarHBondContact O-N 3.38Å; Y123-A125 PolarHBondContact O-N 3.44Å; A125-Y132 VanDerWaalsContact CA-CD2 3.4Å; A125-Y132 HydrophobicContact CB-CD2 3.72Å; A125-Y132 HydrophobicContact CB-CE2 3.69Å; A125-Y132 HydrophobicContact CB-CG 4.46Å
126I74.5Confident83Confident40 Ų4055.6 Ų55.621%0.20529%0.288CS..Hα-helixtrans-96.3-39.1-176.9-67.4176.6000112.2R122 Y123 V124 L221R122-I126 PolarHBondContact O-N 3.44Å; Y123-I126 PolarHBondContact O-N 3.27Å; V124-I126 PolarHBondContact O-N 3.33Å; I126-L221 HydrophobicContact CB-CG 4.3Å; I126-L221 HydrophobicContact CD1-CD1 3.86Å; I126-L221 HydrophobicContact CD1-CD2 3.51Å; I126-L221 HydrophobicContact CD1-CG 3.67Å; I126-L221 HydrophobicContact CG2-CG 4.19Å
127S75.7Confident83.1Confident30 Ų3056.7 Ų56.721%0.2129%0.293CS..Hα-helixtrans-77.1-32.3-177.860.60000113.1Y123Y123-S127 VanDerWaalsContact O-CB 3.24Å; Y123-S127 WeakPolarHBondContact O-CB 3.47Å; Y123-S127 PolarHBondContact O-N 3.17Å; Y123-S127 PolarHBondContact O-OG 2.87Å
128Q80.5Confident82.9Confident96 Ų9661.9 Ų61.945%0.44932%0.316SS..  trans-137.758.9-174.4-62.7-168.3-40.100112V124 L130 H131 Y132 I135V124-Q128 CarbonylContact O-C 3.57Å; V124-Q128 PolarHBondContact O-N 3.25Å; Q128-L130 VanDerWaalsContact C-N 3.26Å; Q128-L130 PolarHBondContact O-N 3.26Å; Q128-L130 VanDerWaalsContact O-N 3.17Å; Q128-H131 CarbonylContact O-C 3.47Å; Q128-H131 PolarHBondContact O-N 3.25Å; Q128-Y132 PolarHBondContact O-N 3.05Å; Q128-I135 HydrophobicContact CB-CD1 4.47Å
129P79.4Confident83Confident89 Ų8966.6 Ų66.658%0.57835%0.345SS*.G310 helixtrans-58.7-35.4-173.423.4-34.1000113.3H131 Y132P129-H131 VanDerWaalsContact C-N 3.31Å; P129-H131 PolarHBondContact O-N 3.32Å; P129-Y132 PolarHBondContact O-N 3.44Å
130L84.9Confident83.4Confident157 Ų15768.8 Ų68.882%0.82236%0.358SS*.G310 helixtrans-69.2-24.6179-74162.2000113.8Q128Q128-L130 VanDerWaalsContact C-N 3.26Å; Q128-L130 PolarHBondContact O-N 3.26Å; Q128-L130 VanDerWaalsContact O-N 3.17Å
131H86.9Confident83.7Confident106 Ų10663.7 Ų63.749%0.49134%0.338SS..G310 helixtrans-110.12.1-179.3-66.384000112.4Q128 P129 T133 L134 I135Q128-H131 CarbonylContact O-C 3.47Å; Q128-H131 PolarHBondContact O-N 3.25Å; P129-H131 VanDerWaalsContact C-N 3.31Å; P129-H131 PolarHBondContact O-N 3.32Å; H131-T133 VanDerWaalsContact C-N 3.34Å; H131-T133 PolarHBondContact O-N 2.89Å; H131-L134 WeakPolarHBondContact O-CB 3.19Å; H131-L134 PolarHBondContact O-N 3.22Å; H131-I135 HydrophobicContact CB-CD1 3.93Å; H131-I135 HydrophobicContact CB-CG1 4.44Å; H131-I135 WeakPolarHBondContact O-CG1 3.19Å; H131-I135 PolarHBondContact O-N 2.89Å
132Y85.1Confident83.8Confident49 Ų4965.8 Ų65.819%0.19236%0.356CS..Hα-helixtrans-54.2-48.2-173.7172.5-101.7000112.3D121 V124 A125 Q128 P129 L134 I135 M136D121-Y132 WeakPolarHBondContact OD1-CE2 3.34Å; D121-Y132 PolarHBondContact OD1-OH 2.95Å; V124-Y132 HydrophobicContact CB-CD2 4.36Å; V124-Y132 HydrophobicContact CG1-CD2 4.02Å; A125-Y132 VanDerWaalsContact CA-CD2 3.4Å; A125-Y132 HydrophobicContact CB-CD2 3.72Å; A125-Y132 HydrophobicContact CB-CE2 3.69Å; A125-Y132 HydrophobicContact CB-CG 4.46Å; Q128-Y132 PolarHBondContact O-N 3.05Å; P129-Y132 PolarHBondContact O-N 3.44Å; Y132-L134 PolarHBondContact O-N 3.36Å; Y132-I135 PolarHBondContact O-N 3.35Å; Y132-M136 HydrophobicContact CD2-CB 4.18Å; Y132-M136 HydrophobicContact CE2-CB 3.77Å; Y132-M136 HydrophobicContact CE2-CG 4.1Å; Y132-M136 WeakPolarHBondContact O-CA 3.23Å; Y132-M136 PolarHBondContact O-N 3.48Å
133T84.5Confident84.5Confident103 Ų10370.5 Ų70.563%0.63238%0.382SS*.Hα-helixtrans-68.8-20.9-17852.90000113.7H131H131-T133 VanDerWaalsContact C-N 3.34Å; H131-T133 PolarHBondContact O-N 2.89Å
134L86.6Confident85.1Confident130 Ų13068.8 Ų68.868%0.68138%0.379SS*.Hα-helixtrans-81.1-38.8174.9-64.2172.4000111.1H131 Y132H131-L134 WeakPolarHBondContact O-CB 3.19Å; H131-L134 PolarHBondContact O-N 3.22Å; Y132-L134 PolarHBondContact O-N 3.36Å
135I85.6Confident85.6Confident51 Ų5169 Ų6926%0.26238%0.38SS..Hα-helixtrans-81.9-44.5-177.6-62.5167.2000111.2V124 Q128 H131 Y132V124-I135 HydrophobicContact CG1-CB 3.9Å; V124-I135 HydrophobicContact CG1-CD1 3.88Å; V124-I135 HydrophobicContact CG1-CG2 3.75Å; V124-I135 HydrophobicContact CG2-CG2 4.18Å; Q128-I135 HydrophobicContact CB-CD1 4.47Å; H131-I135 HydrophobicContact CB-CD1 3.93Å; H131-I135 HydrophobicContact CB-CG1 4.44Å; H131-I135 WeakPolarHBondContact O-CG1 3.19Å; H131-I135 PolarHBondContact O-N 2.89Å; Y132-I135 PolarHBondContact O-N 3.35Å
136M86.3Confident86.2Confident3 Ų369.8 Ų69.82%0.01539%0.386CS..SBendtrans-124106.5-175-169.164.693.800110.2T58 Y120 D121 Y132 V140 L144T58-M136 HydrophobicContact CG2-CG 3.74Å; T58-M136 HydrophobicContact CG2-SD 4.11Å; Y120-M136 HydrophobicContact CD1-CE 3.7Å; Y120-M136 HydrophobicContact CE1-CE 4.13Å; D121-M136 HydrophobicContact CB-CE 3.87Å; D121-M136 WeakPolarHBondContact OD1-CG 3.49Å; Y132-M136 HydrophobicContact CD2-CB 4.18Å; Y132-M136 HydrophobicContact CE2-CB 3.77Å; Y132-M136 HydrophobicContact CE2-CG 4.1Å; Y132-M136 WeakPolarHBondContact O-CA 3.23Å; Y132-M136 PolarHBondContact O-N 3.48Å; M136-V140 HydrophobicContact SD-CG1 4.18Å; M136-L144 HydrophobicContact CE-CD1 4.13Å; M136-L144 HydrophobicContact SD-CD1 4.36Å
137N86.9Confident87.1Confident57 Ų5770.7 Ų70.731%0.30540%0.399SS..  trans-132.6175.7174.463.149.9000110.1T139 V140 C141N137-T139 VanDerWaalsContact C-N 3.27Å; N137-T139 PolarHBondContact O-N 3.36Å; N137-T139 WeakPolarHBondContact OD1-CB 3.37Å; N137-T139 PolarHBondContact OD1-N 3.34Å; N137-V140 PolarHBondContact O-N 3.31Å; N137-V140 PolarHBondContact OD1-N 2.85Å; N137-C141 WeakPolarHBondContact O-CB 3.28Å; N137-C141 PolarHBondContact O-N 3.09Å
138Q83.3Confident88Confident124 Ų12469.5 Ų69.558%0.57939%0.391SS*.Hα-helixtrans-59.3-35.7-176.7-70.9-174-12.600113.1H56 C141 A142H56-Q138 PolarHBondContact O-NE2 3.15Å; Q138-C141 PolarHBondContact O-N 3.32Å; Q138-A142 WeakPolarHBondContact O-CB 3.44Å; Q138-A142 PolarHBondContact O-N 3.16Å
139T89Confident88.7Confident102 Ų10268.9 Ų68.963%0.62639%0.385SS*.Hα-helixtrans-67-48.1178.4-51.60000111.4N137 C141 A142 L143N137-T139 VanDerWaalsContact C-N 3.27Å; N137-T139 PolarHBondContact O-N 3.36Å; N137-T139 WeakPolarHBondContact OD1-CB 3.37Å; N137-T139 PolarHBondContact OD1-N 3.34Å; T139-C141 VanDerWaalsContact C-N 3.29Å; T139-C141 PolarHBondContact O-N 3.49Å; T139-A142 PolarHBondContact O-N 3.07Å; T139-L143 HydrophobicContact CG2-CD1 4.4Å; T139-L143 WeakPolarHBondContact O-CG 3.14Å; T139-L143 PolarHBondContact O-N 3.49Å
140V90.2Very high89.4Confident48 Ų4868.8 Ų68.829%0.29138%0.382SS..Hα-helixtrans-60.8-43.3175.9175.30000110.2M136 N137 A142 L143 L144M136-V140 HydrophobicContact SD-CG1 4.18Å; N137-V140 PolarHBondContact O-N 3.31Å; N137-V140 PolarHBondContact OD1-N 2.85Å; V140-A142 VanDerWaalsContact C-N 3.34Å; V140-A142 PolarHBondContact O-N 3.36Å; V140-L143 PolarHBondContact O-N 3.34Å; V140-L144 HydrophobicContact CG1-CD1 3.95Å; V140-L144 HydrophobicContact CG1-CG 4.32Å; V140-L144 WeakPolarHBondContact O-CB 3.42Å; V140-L144 WeakPolarHBondContact O-CG 3.32Å; V140-L144 PolarHBondContact O-N 2.64Å
141C89.2Confident89.7Confident0 Ų062.3 Ų62.30%035%0.353CS..Hα-helixtrans-61.3-41.4177.2-168.30000112.6T58 F61 L62 N137 Q138 T139 L144 M145T58-C141 HydrophobicContact CG2-CB 3.84Å; F61-C141 VanDerWaalsContact CD1-SG 3.51Å; L62-C141 WeakPolarHBondContact CD2-SG 3.13Å; N137-C141 WeakPolarHBondContact O-CB 3.28Å; N137-C141 PolarHBondContact O-N 3.09Å; Q138-C141 PolarHBondContact O-N 3.32Å; T139-C141 VanDerWaalsContact C-N 3.29Å; T139-C141 PolarHBondContact O-N 3.49Å; C141-L144 PolarHBondContact O-N 3.29Å; C141-M145 WeakPolarHBondContact O-CB 3.4Å; C141-M145 PolarHBondContact O-N 2.84Å
142A89.3Confident89.9Confident48 Ų4857.2 Ų57.240%0.39733%0.33SS..Hα-helixtrans-65.7-40.5176.100000111.8Q138 T139 V140 M145 A146Q138-A142 WeakPolarHBondContact O-CB 3.44Å; Q138-A142 PolarHBondContact O-N 3.16Å; T139-A142 PolarHBondContact O-N 3.07Å; V140-A142 VanDerWaalsContact C-N 3.34Å; V140-A142 PolarHBondContact O-N 3.36Å; A142-M145 PolarHBondContact O-N 2.91Å; A142-A146 WeakPolarHBondContact O-CB 3.18Å; A142-A146 PolarHBondContact O-N 3.35Å
143L93.8Very high90.4Very high117 Ų11759.5 Ų59.561%0.61334%0.341SS*.Hα-helixtrans-63.8-45174.9-73.3167.8000112T139 V140 M145 A146 A147T139-L143 HydrophobicContact CG2-CD1 4.4Å; T139-L143 WeakPolarHBondContact O-CG 3.14Å; T139-L143 PolarHBondContact O-N 3.49Å; V140-L143 PolarHBondContact O-N 3.34Å; L143-M145 VanDerWaalsContact C-N 3.3Å; L143-M145 PolarHBondContact O-N 3.41Å; L143-A146 PolarHBondContact O-N 3.06Å; L143-A147 WeakPolarHBondContact O-CB 3.43Å; L143-A147 PolarHBondContact O-N 3.49Å
144L92.2Very high90.7Very high55 Ų5559.2 Ų59.229%0.28834%0.335SS..Hα-helixtrans-63.5-37.1175.7-70.8173.6000111.8V117 M136 V140 C141 A147 S148V117-L144 HydrophobicContact CG1-CB 4.14Å; V117-L144 HydrophobicContact CG1-CD1 3.93Å; V117-L144 HydrophobicContact CG2-CB 4.06Å; V117-L144 HydrophobicContact CG2-CD1 4.47Å; M136-L144 HydrophobicContact CE-CD1 4.13Å; M136-L144 HydrophobicContact SD-CD1 4.36Å; V140-L144 HydrophobicContact CG1-CD1 3.95Å; V140-L144 HydrophobicContact CG1-CG 4.32Å; V140-L144 WeakPolarHBondContact O-CB 3.42Å; V140-L144 WeakPolarHBondContact O-CG 3.32Å; V140-L144 PolarHBondContact O-N 2.64Å; C141-L144 PolarHBondContact O-N 3.29Å; L144-A147 PolarHBondContact O-N 2.89Å; L144-S148 WeakPolarHBondContact O-CB 3.3Å; L144-S148 PolarHBondContact O-N 3.36Å; L144-S148 PolarHBondContact O-OG 3.41Å
145M92.4Very high90.8Very high8 Ų854.1 Ų54.14%0.03931%0.307CS..Hα-helixtrans-63.8-48.9173.2-169.366.2-145.100110.7N65 L69 I110 L114 C141 A142 L143 A147 S148 W149N65-M145 HydrophobicContact CB-CE 4.21Å; N65-M145 HydrophobicContact CB-SD 4.02Å; L69-M145 HydrophobicContact CD1-CE 4.3Å; I110-M145 HydrophobicContact CG2-CE 3.58Å; L114-M145 HydrophobicContact CD1-SD 3.61Å; L114-M145 HydrophobicContact CD2-CE 4.49Å; L114-M145 HydrophobicContact CD2-SD 4.43Å; C141-M145 WeakPolarHBondContact O-CB 3.4Å; C141-M145 PolarHBondContact O-N 2.84Å; A142-M145 PolarHBondContact O-N 2.91Å; L143-M145 VanDerWaalsContact C-N 3.3Å; L143-M145 PolarHBondContact O-N 3.41Å; M145-A147 VanDerWaalsContact C-N 3.31Å; M145-A147 PolarHBondContact O-N 3.39Å; M145-S148 WeakPolarHBondContact O-CA 3.31Å; M145-S148 VanDerWaalsContact O-CB 3.32Å; M145-S148 WeakPolarHBondContact O-CB 3.35Å; M145-S148 PolarHBondContact O-N 2.88Å; M145-W149 HydrophobicContact CE-CG 4.47Å; M145-W149 HydrophobicContact CE-CZ2 4.43Å; M145-W149 PolarHBondContact O-N 2.9Å
146A93.9Very high91.1Very high52 Ų5251.7 Ų51.743%0.4330%0.295SS..Hα-helixtrans-58.9-42.3177.100000112A142 L143 S148 W149 V150A142-A146 WeakPolarHBondContact O-CB 3.18Å; A142-A146 PolarHBondContact O-N 3.35Å; L143-A146 PolarHBondContact O-N 3.06Å; A146-S148 VanDerWaalsContact C-N 3.31Å; A146-S148 PolarHBondContact O-N 2.96Å; A146-W149 WeakPolarHBondContact O-CB 3.46Å; A146-W149 PolarHBondContact O-N 3.19Å; A146-V150 WeakPolarHBondContact O-CG2 3.37Å; A146-V150 PolarHBondContact O-N 3.36Å
147A94.3Very high91.4Very high59 Ų5955.2 Ų55.249%0.48831%0.313SS..Hα-helixtrans-61.6-38.5173.700000112.1L143 L144 M145 V150 G151L143-A147 WeakPolarHBondContact O-CB 3.43Å; L143-A147 PolarHBondContact O-N 3.49Å; L144-A147 PolarHBondContact O-N 2.89Å; M145-A147 VanDerWaalsContact C-N 3.31Å; M145-A147 PolarHBondContact O-N 3.39Å; A147-V150 PolarHBondContact O-N 3.46Å; A147-G151 PolarHBondContact O-N 2.8Å
148S93.2Very high91.5Very high6 Ų655.2 Ų55.24%0.04232%0.315CS..Hα-helixtrans-64.4-40.6175.3-57.70000112L144 M145 A146 G152L144-S148 WeakPolarHBondContact O-CB 3.3Å; L144-S148 PolarHBondContact O-N 3.36Å; L144-S148 PolarHBondContact O-OG 3.41Å; M145-S148 WeakPolarHBondContact O-CA 3.31Å; M145-S148 VanDerWaalsContact O-CB 3.32Å; M145-S148 WeakPolarHBondContact O-CB 3.35Å; M145-S148 PolarHBondContact O-N 2.88Å; A146-S148 VanDerWaalsContact C-N 3.31Å; A146-S148 PolarHBondContact O-N 2.96Å; S148-G152 PolarHBondContact O-N 3.21Å
149W95.1Very high91.6Very high82 Ų8249.3 Ų49.331%0.31129%0.288SS..Hα-helixtrans-60.6-50.3172.6-78.6101.7000112F68 L69 F106 I110 M145 A146 G152 F153F68-W149 HydrophobicContact CE1-CH2 4.33Å; L69-W149 HydrophobicContact CD2-CH2 4.29Å; L69-W149 HydrophobicContact CD2-CZ2 4.32Å; F106-W149 HydrophobicContact CE1-CE3 4.14Å; F106-W149 AromaticContact CE1-CZ3 3.8Å; F106-W149 HydrophobicContact CE1-CZ3 3.8Å; F106-W149 HydrophobicContact CE2-CE3 4.06Å; F106-W149 HydrophobicContact CE2-CZ3 4.5Å; F106-W149 AromaticContact CZ-CE3 3.46Å; F106-W149 HydrophobicContact CZ-CE3 3.46Å; F106-W149 VanDerWaalsContact CZ-CE3 3.46Å; F106-W149 AromaticContact CZ-CZ3 3.62Å; F106-W149 HydrophobicContact CZ-CZ3 3.62Å; I110-W149 HydrophobicContact CD1-CD2 3.72Å; I110-W149 HydrophobicContact CD1-CE3 3.26Å; I110-W149 HydrophobicContact CD1-CG 4.41Å; I110-W149 HydrophobicContact CD1-CH2 4.14Å; I110-W149 HydrophobicContact CD1-CZ3 3.5Å; I110-W149 VanDerWaalsContact CD1-CZ3 3.5Å; I110-W149 HydrophobicContact CG1-CE3 4.39Å; M145-W149 HydrophobicContact CE-CG 4.47Å; M145-W149 HydrophobicContact CE-CZ2 4.43Å; M145-W149 PolarHBondContact O-N 2.9Å; A146-W149 WeakPolarHBondContact O-CB 3.46Å; A146-W149 PolarHBondContact O-N 3.19Å; W149-G152 PolarHBondContact O-N 3.43Å; W149-F153 WeakPolarHBondContact O-CB 3.28Å; W149-F153 PolarHBondContact O-N 3.03Å
150V95.8Very high91.6Very high87 Ų8745.6 Ų45.653%0.52726%0.264SS..Hα-helixtrans-62.4-45.5178.6173.50000111.1A146 A147 G152 F153 I154A146-V150 WeakPolarHBondContact O-CG2 3.37Å; A146-V150 PolarHBondContact O-N 3.36Å; A147-V150 PolarHBondContact O-N 3.46Å; V150-G152 PolarHBondContact O-N 2.89Å; V150-F153 WeakPolarHBondContact O-CB 3.24Å; V150-F153 PolarHBondContact O-N 2.66Å; V150-I154 HydrophobicContact CG1-CD1 3.83Å; V150-I154 HydrophobicContact CG1-CG1 4.46Å; V150-I154 WeakPolarHBondContact O-CG1 3.32Å; V150-I154 PolarHBondContact O-N 2.82Å
151G91Very high91.5Very high21 Ų2145.3 Ų45.322%0.21627%0.267CS..Hα-helixtrans-60.6-45.5177.700000112.3A147 F153 I154 H155A147-G151 PolarHBondContact O-N 2.8Å; G151-F153 VanDerWaalsContact C-N 3.3Å; G151-F153 PolarHBondContact O-N 3.49Å; G151-I154 PolarHBondContact O-N 3.42Å; G151-H155 VanDerWaalsContact O-CB 3.26Å; G151-H155 WeakPolarHBondContact O-CB 3.46Å; G151-H155 PolarHBondContact O-N 3.28Å
152G91.3Very high91.3Very high0 Ų046.5 Ų46.50%027%0.274CS..Hα-helixtrans-61.9-38.4175.700000112.2S148 W149 V150 H155 S156S148-G152 PolarHBondContact O-N 3.21Å; W149-G152 PolarHBondContact O-N 3.43Å; V150-G152 PolarHBondContact O-N 2.89Å; G152-H155 PolarHBondContact O-N 3.17Å; G152-S156 WeakPolarHBondContact O-CB 3.4Å; G152-S156 PolarHBondContact O-N 3.42Å
153F93.9Very high91Very high96 Ų9644.3 Ų44.342%0.42126%0.255SS..Hα-helixtrans-65.1-49.4178-177.5-103.4000111.6F102 F106 W149 V150 G151 H155 S156 I157F102-F153 HydrophobicContact CE2-CD2 4.3Å; F102-F153 HydrophobicContact CE2-CE2 4.2Å; F102-F153 AromaticContact CZ-CD2 3.86Å; F102-F153 HydrophobicContact CZ-CD2 3.86Å; F102-F153 AromaticContact CZ-CE2 3.8Å; F102-F153 HydrophobicContact CZ-CE2 3.8Å; F106-F153 HydrophobicContact CD2-CB 4.12Å; F106-F153 HydrophobicContact CE2-CB 3.7Å; F106-F153 HydrophobicContact CE2-CD2 4.28Å; W149-F153 WeakPolarHBondContact O-CB 3.28Å; W149-F153 PolarHBondContact O-N 3.03Å; V150-F153 WeakPolarHBondContact O-CB 3.24Å; V150-F153 PolarHBondContact O-N 2.66Å; G151-F153 VanDerWaalsContact C-N 3.3Å; G151-F153 PolarHBondContact O-N 3.49Å; F153-H155 VanDerWaalsContact C-N 3.33Å; F153-H155 PolarHBondContact O-N 2.96Å; F153-S156 PolarHBondContact O-N 3.42Å; F153-I157 HydrophobicContact CD1-CD1 3.85Å; F153-I157 HydrophobicContact CE1-CD1 3.22Å; F153-I157 HydrophobicContact CE1-CG1 4.22Å; F153-I157 HydrophobicContact CE2-CD1 4.16Å; F153-I157 HydrophobicContact CZ-CD1 3.41Å; F153-I157 VanDerWaalsContact CZ-CD1 3.41Å; F153-I157 HydrophobicContact CZ-CG1 4.26Å; F153-I157 PolarHBondContact O-N 2.98Å
154I91.5Very high90.6Very high97 Ų9743 Ų4350%0.49725%0.248SC..Hα-helixtrans-58.6-48.2176.2-66.9167.8000109.8V150 G151 S156 I157 V158V150-I154 HydrophobicContact CG1-CD1 3.83Å; V150-I154 HydrophobicContact CG1-CG1 4.46Å; V150-I154 WeakPolarHBondContact O-CG1 3.32Å; V150-I154 PolarHBondContact O-N 2.82Å; G151-I154 PolarHBondContact O-N 3.42Å; I154-S156 VanDerWaalsContact C-N 3.3Å; I154-S156 PolarHBondContact O-N 3.18Å; I154-I157 PolarHBondContact O-N 2.98Å; I154-V158 WeakPolarHBondContact O-CG2 3.24Å; I154-V158 PolarHBondContact O-N 2.85Å
155H89.6Confident90Very high23 Ų2347.8 Ų47.811%0.10627%0.269CS..Hα-helixtrans-54.7-47.8177.3178.878.3000111.4H105 G151 G152 F153 V158 Q159 N202 N203H105-H155 AromaticContact CD2-NE2 3.68Å; G151-H155 VanDerWaalsContact O-CB 3.26Å; G151-H155 WeakPolarHBondContact O-CB 3.46Å; G151-H155 PolarHBondContact O-N 3.28Å; G152-H155 PolarHBondContact O-N 3.17Å; F153-H155 VanDerWaalsContact C-N 3.33Å; F153-H155 PolarHBondContact O-N 2.96Å; H155-V158 PolarHBondContact O-N 3.46Å; H155-Q159 WeakPolarHBondContact O-CG 3.21Å; H155-Q159 PolarHBondContact O-N 3.24Å; H155-Q159 VanDerWaalsContact O-N 3.14Å; H155-N202 PolarHBondContact CE1-ND2 3.35Å; H155-N202 VanDerWaalsContact CE1-ND2 3.33Å; H155-N202 PolarHBondContact ND1-ND2 3.36Å; H155-N203 PolarHBondContact CE1-OD1 2.86Å; H155-N203 PolarHBondContact NE2-OD1 3.49Å
156S91.6Very high89.4Confident0 Ų048.1 Ų48.10%027%0.271CS..Hα-helixtrans-66.1-39.6179.3-172.10000113.7F102 G152 F153 I154 V158 Q159 V160F102-S156 VanDerWaalsContact CA-OG 3.27Å; F102-S156 WeakPolarHBondContact CA-OG 3.39Å; F102-S156 WeakPolarHBondContact CD2-OG 3.34Å; F102-S156 PolarHBondContact O-OG 3.45Å; G152-S156 WeakPolarHBondContact O-CB 3.4Å; G152-S156 PolarHBondContact O-N 3.42Å; F153-S156 PolarHBondContact O-N 3.42Å; I154-S156 VanDerWaalsContact C-N 3.3Å; I154-S156 PolarHBondContact O-N 3.18Å; S156-V158 VanDerWaalsContact C-N 3.33Å; S156-Q159 PolarHBondContact O-N 2.93Å; S156-V160 WeakPolarHBondContact O-CG2 3.44Å; S156-V160 PolarHBondContact O-N 3.39Å
157I91.8Very high88.8Confident77 Ų7748.3 Ų48.340%0.39527%0.267SS..Hα-helixtrans-62.6-44.1176.7-76.3-175.5000110.3F102 F153 I154 Q159 V160 A161F102-I157 HydrophobicContact CE2-CG1 4.22Å; F153-I157 HydrophobicContact CD1-CD1 3.85Å; F153-I157 HydrophobicContact CE1-CD1 3.22Å; F153-I157 HydrophobicContact CE1-CG1 4.22Å; F153-I157 HydrophobicContact CE2-CD1 4.16Å; F153-I157 HydrophobicContact CZ-CD1 3.41Å; F153-I157 VanDerWaalsContact CZ-CD1 3.41Å; F153-I157 HydrophobicContact CZ-CG1 4.26Å; F153-I157 PolarHBondContact O-N 2.98Å; I154-I157 PolarHBondContact O-N 2.98Å; I157-Q159 VanDerWaalsContact C-N 3.29Å; I157-Q159 PolarHBondContact O-N 2.92Å; I157-V160 PolarHBondContact O-N 3.24Å; I157-A161 VanDerWaalsContact O-CB 3.24Å; I157-A161 WeakPolarHBondContact O-CB 3.22Å; I157-A161 PolarHBondContact O-N 2.91Å
158V88.8Confident88.1Confident58 Ų5846.6 Ų46.635%0.35225%0.249SC..Hα-helixtrans-57.6-46.7177.2171.70000109.9I154 H155 S156 V160 A161 L162I154-V158 WeakPolarHBondContact O-CG2 3.24Å; I154-V158 PolarHBondContact O-N 2.85Å; H155-V158 PolarHBondContact O-N 3.46Å; S156-V158 VanDerWaalsContact C-N 3.33Å; V158-V160 PolarHBondContact O-N 2.8Å; V158-A161 PolarHBondContact O-N 3.43Å; V158-L162 HydrophobicContact CG1-CD1 3.79Å; V158-L162 HydrophobicContact CG1-CG 4.29Å; V158-L162 WeakPolarHBondContact O-CB 3.39Å; V158-L162 WeakPolarHBondContact O-CG 3.41Å; V158-L162 PolarHBondContact O-N 2.94Å
159Q86.9Confident87.2Confident0 Ų049.4 Ų49.40%027%0.268CS..Hα-helixtrans-61.1-44.6178.9-64.4-67-1.800112.7H105 H155 S156 I157 T163 V181 N202 N203H105-Q159 HydrophobicContact CB-CG 4.4Å; H155-Q159 WeakPolarHBondContact O-CG 3.21Å; H155-Q159 PolarHBondContact O-N 3.24Å; H155-Q159 VanDerWaalsContact O-N 3.14Å; S156-Q159 PolarHBondContact O-N 2.93Å; I157-Q159 VanDerWaalsContact C-N 3.29Å; I157-Q159 PolarHBondContact O-N 2.92Å; Q159-T163 WeakPolarHBondContact O-CB 3.45Å; Q159-T163 PolarHBondContact O-N 3.4Å; Q159-T163 PolarHBondContact O-OG1 3.32Å; Q159-V181 HydrophobicContact CB-CG2 4.44Å; Q159-N202 PolarHBondContact NE2-ND2 2.97Å; Q159-N202 VanDerWaalsContact NE2-ND2 3.14Å; Q159-N203 VanDerWaalsContact NE2-CG 3.31Å; Q159-N203 PolarHBondContact NE2-ND2 3.32Å; Q159-N203 PolarHBondContact NE2-OD1 3.36Å
160V89Confident85.8Confident23 Ų2346.7 Ų46.714%0.13927%0.266CS..Hα-helixtrans-68-44.3178.7171.70000111.6L101 F102 S156 I157 V158 L162 T163 I164L101-V160 HydrophobicContact CD2-CG2 4.4Å; F102-V160 HydrophobicContact CB-CG2 3.83Å; F102-V160 HydrophobicContact CD2-CG2 4.15Å; S156-V160 WeakPolarHBondContact O-CG2 3.44Å; S156-V160 PolarHBondContact O-N 3.39Å; I157-V160 PolarHBondContact O-N 3.24Å; V158-V160 PolarHBondContact O-N 2.8Å; V160-L162 VanDerWaalsContact C-N 3.34Å; V160-L162 PolarHBondContact O-N 3.48Å; V160-T163 PolarHBondContact O-N 2.97Å; V160-T163 VanDerWaalsContact O-N 3.12Å; V160-I164 HydrophobicContact CG1-CD1 3.55Å; V160-I164 HydrophobicContact CG1-CG1 4.13Å; V160-I164 WeakPolarHBondContact O-CG1 3.48Å; V160-I164 PolarHBondContact O-N 3Å
161A87.4Confident84.3Confident43 Ų4347.3 Ų47.336%0.35527%0.271SS..Hα-helixtrans-61.3-44-179.900000111.4I157 V158 T163 Q165I157-A161 VanDerWaalsContact O-CB 3.24Å; I157-A161 WeakPolarHBondContact O-CB 3.22Å; I157-A161 PolarHBondContact O-N 2.91Å; V158-A161 PolarHBondContact O-N 3.43Å; A161-T163 VanDerWaalsContact C-N 3.3Å; A161-T163 PolarHBondContact O-N 2.82Å; A161-Q165 VanDerWaalsContact O-CG 3.32Å; A161-Q165 WeakPolarHBondContact O-CG 3.49Å; A161-Q165 PolarHBondContact O-N 3.11Å
162L84.4Confident83.5Confident25 Ų2549.8 Ų49.813%0.13128%0.28CS..Hα-helixtrans-63.9-35.8175-70.6177.7000112.3V158 V160 L195 L198 M199V158-L162 HydrophobicContact CG1-CD1 3.79Å; V158-L162 HydrophobicContact CG1-CG 4.29Å; V158-L162 WeakPolarHBondContact O-CB 3.39Å; V158-L162 WeakPolarHBondContact O-CG 3.41Å; V158-L162 PolarHBondContact O-N 2.94Å; V160-L162 VanDerWaalsContact C-N 3.34Å; V160-L162 PolarHBondContact O-N 3.48Å; L162-L195 HydrophobicContact CB-CD1 3.79Å; L162-L195 HydrophobicContact CD1-CD1 4.24Å; L162-L195 HydrophobicContact CD2-CD1 3.71Å; L162-L195 HydrophobicContact CG-CD1 4.11Å; L162-L198 HydrophobicContact CD1-CD2 3.66Å; L162-L198 HydrophobicContact CD1-CG 4.24Å; L162-L198 HydrophobicContact CD2-CD2 3.62Å; L162-L198 HydrophobicContact CG-CD2 4.3Å; L162-M199 HydrophobicContact CB-CE 3.6Å; L162-M199 HydrophobicContact CD1-CE 4.11Å; L162-M199 HydrophobicContact CD1-CG 4.25Å
163T83.9Confident82.9Confident1 Ų155 Ų551%0.00630%0.304CS..Hα-helixtrans-74.6-40.9179.8-58.10000112.5L98 L101 Q159 V160 A161 Q165 L166 F168 L184L98-T163 HydrophobicContact CD2-CG2 3.99Å; L101-T163 HydrophobicContact CD2-CG2 3.97Å; Q159-T163 WeakPolarHBondContact O-CB 3.45Å; Q159-T163 PolarHBondContact O-N 3.4Å; Q159-T163 PolarHBondContact O-OG1 3.32Å; V160-T163 PolarHBondContact O-N 2.97Å; V160-T163 VanDerWaalsContact O-N 3.12Å; A161-T163 VanDerWaalsContact C-N 3.3Å; A161-T163 PolarHBondContact O-N 2.82Å; T163-Q165 PolarHBondContact O-N 3.46Å; T163-L166 WeakPolarHBondContact O-CB 3.45Å; T163-L166 PolarHBondContact O-N 3.03Å; T163-F168 HydrophobicContact CG2-CZ 4.07Å; T163-F168 WeakPolarHBondContact O-CE2 3.48Å; T163-F168 WeakPolarHBondContact O-CZ 3.13Å; T163-L184 HydrophobicContact CG2-CB 4.29Å; T163-L184 HydrophobicContact CG2-CD1 3.57Å
164I84.3Confident82.3Confident91 Ų9150.5 Ų50.547%0.46728%0.284SS..Hα-helixtrans-65.6-29.1-179.3-72.9173.8000112L98 V160 L166L98-I164 HydrophobicContact CD1-CD1 3.82Å; L98-I164 HydrophobicContact CD1-CG1 3.58Å; L98-I164 HydrophobicContact CD2-CG1 3.89Å; L98-I164 HydrophobicContact CG-CG1 4.39Å; V160-I164 HydrophobicContact CG1-CD1 3.55Å; V160-I164 HydrophobicContact CG1-CG1 4.13Å; V160-I164 WeakPolarHBondContact O-CG1 3.48Å; V160-I164 PolarHBondContact O-N 3Å; I164-L166 PolarHBondContact O-N 2.92Å
165Q80.9Confident81.8Confident154 Ų15449.6 Ų49.672%0.7228%0.28SS*.THydrogen-bonded Turntrans-73.6-10179.3-71.1176.6700113.5A161 T163A161-Q165 VanDerWaalsContact O-CG 3.32Å; A161-Q165 WeakPolarHBondContact O-CG 3.49Å; A161-Q165 PolarHBondContact O-N 3.11Å; T163-Q165 PolarHBondContact O-N 3.46Å
166L79.8Confident81.4Confident15 Ų1548.8 Ų48.88%0.07928%0.277CS..SBendtrans-74.8130.3-179.7-74.9171.5000111.8T163 I164 F168 I185 A188 T192 L195T163-L166 WeakPolarHBondContact O-CB 3.45Å; T163-L166 PolarHBondContact O-N 3.03Å; I164-L166 PolarHBondContact O-N 2.92Å; L166-F168 HydrophobicContact CB-CE1 4.05Å; L166-F168 HydrophobicContact CB-CE2 3.97Å; L166-F168 HydrophobicContact CB-CZ 3.7Å; L166-F168 HydrophobicContact CD1-CE1 4.23Å; L166-F168 HydrophobicContact CD1-CZ 4.15Å; L166-F168 VanDerWaalsContact O-CD2 3.23Å; L166-F168 WeakPolarHBondContact O-CD2 3.42Å; L166-F168 WeakPolarHBondContact O-CE2 3.42Å; L166-F168 PolarHBondContact O-N 3.38Å; L166-F168 VanDerWaalsContact O-N 3.14Å; L166-I185 HydrophobicContact CD1-CG1 3.81Å; L166-A188 HydrophobicContact CB-CB 4.28Å; L166-A188 HydrophobicContact CD1-CB 4.47Å; L166-A188 HydrophobicContact CD2-CB 3.84Å; L166-A188 HydrophobicContact CG-CB 4.44Å; L166-T192 HydrophobicContact CD2-CG2 4.04Å; L166-L195 HydrophobicContact CD1-CD2 3.62Å; L166-L195 HydrophobicContact CD2-CD2 3.42Å; L166-L195 VanDerWaalsContact CD2-CD2 3.42Å; L166-L195 HydrophobicContact CG-CD2 3.6Å
167P79.6Confident80.9Confident56 Ų5648.8 Ų48.836%0.36428%0.277SS..  trans-76.1101.3169.630.2-31.6000109.4A188 C189 T190P167-A188 CarbonylContact O-C 3.58Å; P167-A188 WeakPolarHBondContact O-CA 3.41Å; P167-C189 PolarHBondContact O-N 2.91Å; P167-T190 HydrophobicContact CG-CG2 3.8Å
168F79.8Confident80.4Confident24 Ų2445.2 Ų45.211%0.10526%0.259CS..BIsolated β-bridgetrans-81.1122.8174.7-57.9-76.7000110.7V9 F94 T163 L166 L184 L187V9-F168 HydrophobicContact CB-CB 4.4Å; V9-F168 HydrophobicContact CG2-CB 3.81Å; F94-F168 AromaticContact CE2-CD2 3.81Å; F94-F168 HydrophobicContact CE2-CD2 3.81Å; F94-F168 AromaticContact CE2-CE2 3.58Å; F94-F168 HydrophobicContact CE2-CE2 3.58Å; F94-F168 HydrophobicContact CE2-CZ 4.4Å; F94-F168 HydrophobicContact CZ-CD2 4.4Å; F94-F168 HydrophobicContact CZ-CE2 4.03Å; T163-F168 HydrophobicContact CG2-CZ 4.07Å; T163-F168 WeakPolarHBondContact O-CE2 3.48Å; T163-F168 WeakPolarHBondContact O-CZ 3.13Å; L166-F168 HydrophobicContact CB-CE1 4.05Å; L166-F168 HydrophobicContact CB-CE2 3.97Å; L166-F168 HydrophobicContact CB-CZ 3.7Å; L166-F168 HydrophobicContact CD1-CE1 4.23Å; L166-F168 HydrophobicContact CD1-CZ 4.15Å; L166-F168 VanDerWaalsContact O-CD2 3.23Å; L166-F168 WeakPolarHBondContact O-CD2 3.42Å; L166-F168 WeakPolarHBondContact O-CE2 3.42Å; L166-F168 PolarHBondContact O-N 3.38Å; L166-F168 VanDerWaalsContact O-N 3.14Å; F168-L184 HydrophobicContact CE1-CB 4.1Å; F168-L184 HydrophobicContact CE1-CD2 4.34Å; F168-L184 WeakPolarHBondContact CE1-O 3.33Å; F168-L184 HydrophobicContact CZ-CB 4.49Å; F168-L187 HydrophobicContact CD1-CB 4.18Å
169C74.3Confident80.3Confident64 Ų6442.5 Ų42.543%0.43224%0.242SC..  trans-154.614.6169.726.80000113.3L187 C189C169-L187 PolarHBondContact N-O 3.15Å; C169-C189 WeakPolarHBondContact CA-SG 3.33Å; C169-C189 HydrophobicContact CB-CB 4.37Å; C169-C189 WeakPolarHBondContact CB-SG 3.32Å; C169-C189 PolarHBondContact N-SG 2.95Å; C169-C189 WeakPolarHBondContact SG-CB 3.42Å; C169-C189 CovalentContact SG-SG 2.01Å; C169-C189 PolarHBondContact SG-SG 3.37Å
170G66.4Low80.1Confident26 Ų2642.5 Ų42.527%0.26824%0.242SC..SBendtrans-70.2177.8163.500000112.5L187G170-L187 PolarHBondContact N-O 3.49Å
171P64.3Low79.7Confident99 Ų9941.4 Ų41.464%0.64324%0.236SC*.  trans-58.1146.6172.626.5-33.4000110.1E173 L187P171-E173 PolarHBondContact O-N 2.84Å; P171-L187 WeakPolarHBondContact O-CD2 3.29Å; P171-L187 WeakPolarHBondContact O-CG 3.25Å
172D74.3Confident79.2Confident74 Ų7440 Ų4040%0.39622%0.223SC..SBendtrans-70.113.5-177.1-63.1-27.1000113F12 V13F12-D172 CarbonylContact C-O 3.42Å; F12-D172 WeakPolarHBondContact CA-O 3.25Å; V13-D172 PolarHBondContact N-O 3.29Å
173E79.1Confident78.9Confident109 Ų10939.7 Ų39.751%0.50922%0.221SC..EExtended strand (participates in β ladder)trans-97.8127.9-172.2-63.8-177.2-174.400113.2V13 P171V13-E173 HydrophobicContact CB-CG 4.31Å; V13-E173 CarbonylContact O-C 3.57Å; V13-E173 WeakPolarHBondContact O-CA 3.42Å; P171-E173 PolarHBondContact O-N 2.84Å
174L79.9Confident78.7Confident1 Ų139.7 Ų39.71%0.00522%0.221CC..EExtended strand (participates in β ladder)trans-111121.1174.7-69170.7000109.9F12 V13 L14 L15 N176 Q183 L184 L187F12-L174 HydrophobicContact CB-CD1 3.67Å; F12-L174 HydrophobicContact CB-CG 4.15Å; F12-L174 HydrophobicContact CD1-CD1 4.32Å; F12-L174 HydrophobicContact CD1-CG 4.4Å; F12-L174 HydrophobicContact CD2-CD1 4.26Å; F12-L174 HydrophobicContact CG-CD1 3.85Å; F12-L174 HydrophobicContact CG-CG 4.36Å; V13-L174 PolarHBondContact O-N 2.83Å; L14-L174 HydrophobicContact CD2-CB 4.04Å; L14-L174 HydrophobicContact CD2-CD1 4.04Å; L15-L174 PolarHBondContact N-O 2.97Å; L174-N176 PolarHBondContact O-N 2.77Å; L174-Q183 HydrophobicContact CD2-CB 3.7Å; L174-L184 HydrophobicContact CD1-CD2 4.26Å; L174-L184 HydrophobicContact CD2-CD2 4.11Å; L174-L187 HydrophobicContact CD2-CD1 3.67Å; L174-L187 HydrophobicContact CD2-CD2 4.07Å; L174-L187 HydrophobicContact CG-CD2 4.47Å
175D80.8Confident78.4Confident78 Ų7835.5 Ų35.542%0.41720%0.199SC..SBendtrans-78.752.2-178.5-166.930.9000113.9L15 K269L15-D175 HydrophobicContact CD1-CB 3.86Å; D175-K269 WeakPolarHBondContact O-CE 3.49Å; D175-K269 WeakPolarHBondContact OD1-CE 3.31Å; D175-K269 IonicContact OD1-NZ 3.51Å; D175-K269 PolarHBondContact OD1-NZ 3.02Å
176N81.4Confident78.2Confident6 Ų632.1 Ų32.13%0.03218%0.182CC..SBendtrans-159179.4173.7-145.7-21.8000111.4L14 L15 G16 L174 Y178 Q183 S272L14-N176 WeakPolarHBondContact CB-O 3.36Å; L15-N176 PolarHBondContact N-O 3.34Å; G16-N176 PolarHBondContact N-O 2.91Å; L174-N176 PolarHBondContact O-N 2.77Å; N176-Y178 WeakPolarHBondContact ND2-CE1 3.48Å; N176-Q183 HydrophobicContact CB-CG 4.44Å; N176-Q183 PolarHBondContact ND2-NE2 3.4Å; N176-S272 PolarHBondContact ND2-OG 2.94Å
177F80.9Confident78.1Confident1 Ų132 Ų320%0.00418%0.182CC..SBendtrans-97.31.8177.462.1-91.7000113.8L17 M81 V273L17-F177 HydrophobicContact CD2-CD1 3.8Å; L17-F177 HydrophobicContact CD2-CE1 4.24Å; L17-F177 HydrophobicContact CG-CD1 4.29Å; M81-F177 HydrophobicContact CB-CB 4.21Å; M81-F177 HydrophobicContact CB-CD2 3.81Å; M81-F177 HydrophobicContact CB-CG 4.32Å; M81-F177 HydrophobicContact CG-CB 3.87Å; M81-F177 HydrophobicContact CG-CD2 3.86Å; M81-F177 HydrophobicContact CG-CG 3.96Å; M81-F177 HydrophobicContact SD-CB 4.47Å; M81-F177 HydrophobicContact SD-CD1 4.42Å; M81-F177 HydrophobicContact SD-CD2 3.71Å; M81-F177 HydrophobicContact SD-CE2 3.97Å; M81-F177 HydrophobicContact SD-CG 3.94Å; M81-F177 HydrophobicContact SD-CZ 4.45Å; F177-V273 HydrophobicContact CE1-CG2 3.74Å; F177-V273 HydrophobicContact CZ-CG2 4.1Å
178Y82.6Confident78.3Confident2 Ų230.3 Ų30.31%0.00817%0.172CC..SBendtrans-151.4150.8-178.975.3-81.4000110.4T77 F104 N176 D180 Q183 S272 Y275T77-Y178 HydrophobicContact CG2-CD2 4.33Å; T77-Y178 HydrophobicContact CG2-CG 4.25Å; F104-Y178 AromaticContact CE1-CE2 3.97Å; F104-Y178 HydrophobicContact CE1-CE2 3.97Å; F104-Y178 HydrophobicContact CE2-CD2 4.29Å; F104-Y178 HydrophobicContact CE2-CE2 4.05Å; F104-Y178 HydrophobicContact CZ-CD2 4.34Å; F104-Y178 AromaticContact CZ-CE2 3.67Å; F104-Y178 HydrophobicContact CZ-CE2 3.67Å; N176-Y178 WeakPolarHBondContact ND2-CE1 3.48Å; Y178-D180 HydrophobicContact CD2-CB 4.17Å; Y178-D180 HydrophobicContact CE2-CB 3.55Å; Y178-D180 PolarHBondContact OH-OD2 3.2Å; Y178-Q183 PolarHBondContact O-NE2 3.01Å; Y178-Q183 VanDerWaalsContact O-NE2 3.1Å; Y178-Q183 PolarHBondContact O-OE1 3.16Å; Y178-S272 WeakPolarHBondContact CE1-OG 3.4Å; Y178-S272 PolarHBondContact OH-OG 2.9Å; Y178-Y275 PolarHBondContact OH-OH 3.49Å
179C85.6Confident78.3Confident0 Ų032.6 Ų32.60%019%0.19CC..  trans-73.5125.6176.6-78.80000111.8C97C97-C179 WeakPolarHBondContact CA-SG 3.24Å; C97-C179 HydrophobicContact CB-CB 4.03Å; C97-C179 WeakPolarHBondContact CB-SG 3.37Å; C97-C179 WeakPolarHBondContact SG-CB 3.16Å; C97-C179 CovalentContact SG-SG 2.03Å; C97-C179 PolarHBondContact SG-SG 3.23Å
180D83.9Confident78.5Confident1 Ų133.3 Ų33.31%0.00519%0.193CC..  trans-144.8155.7176-156.7-3.7000111.2H105 Y178 Q183 L184 Y258H105-D180 IonicContact CE1-OD1 2.65Å; H105-D180 PolarHBondContact CE1-OD1 2.96Å; H105-D180 VanDerWaalsContact CE1-OD1 3.29Å; H105-D180 IonicContact NE2-OD1 3.29Å; Y178-D180 HydrophobicContact CD2-CB 4.17Å; Y178-D180 HydrophobicContact CE2-CB 3.55Å; Y178-D180 PolarHBondContact OH-OD2 3.2Å; D180-Q183 PolarHBondContact O-N 2.92Å; D180-Q183 VanDerWaalsContact O-N 3.16Å; D180-L184 PolarHBondContact O-N 3.07Å; D180-L184 VanDerWaalsContact O-N 3.16Å; D180-Y258 PolarHBondContact OD1-OH 3.39Å; D180-Y258 PolarHBondContact OD2-OH 3.33Å
181V80.3Confident79.1Confident0 Ų038.3 Ų38.30%021%0.213CC..Hα-helixtrans-54.7-48.5-177171.50000113.3L101 Q159 Q183 L184 I185 M199L101-V181 HydrophobicContact CD1-CG2 3.73Å; L101-V181 HydrophobicContact CD2-CG2 4.14Å; L101-V181 HydrophobicContact CG-CG2 4.38Å; Q159-V181 HydrophobicContact CB-CG2 4.44Å; V181-Q183 PolarHBondContact O-N 3.38Å; V181-Q183 VanDerWaalsContact O-N 3.09Å; V181-L184 PolarHBondContact O-N 3Å; V181-I185 HydrophobicContact CG1-CD1 3.96Å; V181-I185 PolarHBondContact O-N 3.09Å; V181-I185 VanDerWaalsContact O-N 3.07Å; V181-M199 HydrophobicContact CB-SD 4.5Å; V181-M199 HydrophobicContact CG1-CE 3.36Å; V181-M199 HydrophobicContact CG1-CG 4.16Å; V181-M199 HydrophobicContact CG1-SD 3.05Å; V181-M199 WeakPolarHBondContact CG1-SD 3.41Å; V181-M199 HydrophobicContact CG2-CE 4.43Å
182P76.3Confident79.8Confident14 Ų1434.5 Ų34.59%0.09119%0.188CC..Hα-helixtrans-62.6-21.7-177.7-24.136.1000114K186 I257 Y258 F262P182-K186 WeakPolarHBondContact O-CE 3.37Å; P182-I257 HydrophobicContact CG-CG2 4.35Å; P182-Y258 HydrophobicContact CG-CD1 4.35Å; P182-Y258 HydrophobicContact CG-CE1 4.04Å; P182-F262 HydrophobicContact CB-CB 4.19Å; P182-F262 HydrophobicContact CB-CD1 3.67Å; P182-F262 HydrophobicContact CB-CD2 4.42Å; P182-F262 HydrophobicContact CB-CE1 4.14Å; P182-F262 HydrophobicContact CB-CG 3.85Å; P182-F262 HydrophobicContact CG-CD1 3.92Å; P182-F262 HydrophobicContact CG-CE1 3.87Å; P182-F262 HydrophobicContact CG-CG 4.45Å; P182-F262 HydrophobicContact CG-CZ 4.36Å
183Q78.2Confident80.1Confident17 Ų1737.3 Ų37.38%0.07920%0.197CC..Hα-helixtrans-85.9-45.1178.6-56.1167.344.500110.1L174 N176 Y178 D180 V181 I185 K186 L187L174-Q183 HydrophobicContact CD2-CB 3.7Å; N176-Q183 HydrophobicContact CB-CG 4.44Å; N176-Q183 PolarHBondContact ND2-NE2 3.4Å; Y178-Q183 PolarHBondContact O-NE2 3.01Å; Y178-Q183 VanDerWaalsContact O-NE2 3.1Å; Y178-Q183 PolarHBondContact O-OE1 3.16Å; D180-Q183 PolarHBondContact O-N 2.92Å; D180-Q183 VanDerWaalsContact O-N 3.16Å; V181-Q183 PolarHBondContact O-N 3.38Å; V181-Q183 VanDerWaalsContact O-N 3.09Å; Q183-I185 VanDerWaalsContact C-N 3.32Å; Q183-I185 PolarHBondContact O-N 3.02Å; Q183-K186 WeakPolarHBondContact O-CB 3.35Å; Q183-K186 PolarHBondContact O-N 2.6Å; Q183-L187 WeakPolarHBondContact O-CD1 3.45Å
184L80.3Confident80Confident2 Ų237.4 Ų37.41%0.0121%0.205CC..Hα-helixtrans-62-39.1180-70.9170.4000112.3F12 L101 T163 F168 L174 D180 V181 K186 L187F12-L184 HydrophobicContact CD2-CD2 4.48Å; F12-L184 HydrophobicContact CE1-CD2 4.26Å; F12-L184 HydrophobicContact CE2-CD2 3.89Å; F12-L184 HydrophobicContact CZ-CD2 3.77Å; L101-L184 HydrophobicContact CD2-CD1 4.22Å; T163-L184 HydrophobicContact CG2-CB 4.29Å; T163-L184 HydrophobicContact CG2-CD1 3.57Å; F168-L184 HydrophobicContact CE1-CB 4.1Å; F168-L184 HydrophobicContact CE1-CD2 4.34Å; F168-L184 WeakPolarHBondContact CE1-O 3.33Å; F168-L184 HydrophobicContact CZ-CB 4.49Å; L174-L184 HydrophobicContact CD1-CD2 4.26Å; L174-L184 HydrophobicContact CD2-CD2 4.11Å; D180-L184 PolarHBondContact O-N 3.07Å; D180-L184 VanDerWaalsContact O-N 3.16Å; V181-L184 PolarHBondContact O-N 3Å; L184-K186 PolarHBondContact O-N 3.47Å; L184-L187 PolarHBondContact O-N 3.26Å
185I78.2Confident79.9Confident3 Ų338.6 Ų38.62%0.01521%0.211CC..G310 helixtrans-56.6-36.1177.3-83.5176.3000112.8L166 V181 Q183 L187 A188 T192 L195 E196 M199 F262L166-I185 HydrophobicContact CD1-CG1 3.81Å; V181-I185 HydrophobicContact CG1-CD1 3.96Å; V181-I185 PolarHBondContact O-N 3.09Å; V181-I185 VanDerWaalsContact O-N 3.07Å; Q183-I185 VanDerWaalsContact C-N 3.32Å; Q183-I185 PolarHBondContact O-N 3.02Å; I185-L187 PolarHBondContact O-N 3.44Å; I185-A188 WeakPolarHBondContact O-CB 3.22Å; I185-A188 PolarHBondContact O-N 3.2Å; I185-A188 VanDerWaalsContact O-N 3.17Å; I185-T192 HydrophobicContact CG2-CG2 3.92Å; I185-L195 HydrophobicContact CD1-CD2 3.98Å; I185-L195 HydrophobicContact CD1-CG 4.17Å; I185-L195 HydrophobicContact CG1-CD2 4.06Å; I185-E196 HydrophobicContact CD1-CG 4.34Å; I185-E196 HydrophobicContact CG2-CG 3.91Å; I185-E196 WeakPolarHBondContact CG2-OE1 3.43Å; I185-M199 HydrophobicContact CD1-CE 4.17Å; I185-M199 HydrophobicContact CD1-SD 3.22Å; I185-M199 WeakPolarHBondContact CD1-SD 3.49Å; I185-M199 HydrophobicContact CG1-SD 4.39Å; I185-F262 HydrophobicContact CB-CD2 4.44Å; I185-F262 HydrophobicContact CD1-CD2 3.72Å; I185-F262 HydrophobicContact CD1-CE2 3.59Å; I185-F262 HydrophobicContact CG2-CD2 4.26Å
186K77Confident79.8Confident82 Ų8236.9 Ų36.936%0.35720%0.201SC..G310 helixtrans-67.3-20-179-66.8171.7-178.31610113.3P182 Q183 L184 F262 R263 T264P182-K186 WeakPolarHBondContact O-CE 3.37Å; Q183-K186 WeakPolarHBondContact O-CB 3.35Å; Q183-K186 PolarHBondContact O-N 2.6Å; L184-K186 PolarHBondContact O-N 3.47Å; K186-F262 WeakPolarHBondContact CE-O 3.36Å; K186-R263 VanDerWaalsContact NZ-C 3.33Å; K186-R263 PolarHBondContact NZ-O 3.07Å; K186-T264 HydrophobicContact CD-CG2 4.13Å; K186-T264 VanDerWaalsContact NZ-N 3.16Å
187L77.5Confident79.6Confident14 Ų1441.3 Ų41.37%0.07322%0.224CC..G310 helixtrans-91.1-3.7180-77.173.2000112.3F12 F168 C169 G170 P171 L174 Q183 L184 I185F12-L187 HydrophobicContact CD1-CD2 3.67Å; F12-L187 HydrophobicContact CE1-CD2 3.66Å; F168-L187 HydrophobicContact CD1-CB 4.18Å; C169-L187 PolarHBondContact N-O 3.15Å; G170-L187 PolarHBondContact N-O 3.49Å; P171-L187 WeakPolarHBondContact O-CD2 3.29Å; P171-L187 WeakPolarHBondContact O-CG 3.25Å; L174-L187 HydrophobicContact CD2-CD1 3.67Å; L174-L187 HydrophobicContact CD2-CD2 4.07Å; L174-L187 HydrophobicContact CG-CD2 4.47Å; Q183-L187 WeakPolarHBondContact O-CD1 3.45Å; L184-L187 PolarHBondContact O-N 3.26Å; I185-L187 PolarHBondContact O-N 3.44Å
188A82.3Confident79.3Confident19 Ų1945.3 Ų45.316%0.15725%0.245CC..BIsolated β-bridgetrans-76.2146.1179.400000112L166 P167 I185 T192L166-A188 HydrophobicContact CB-CB 4.28Å; L166-A188 HydrophobicContact CD1-CB 4.47Å; L166-A188 HydrophobicContact CD2-CB 3.84Å; L166-A188 HydrophobicContact CG-CB 4.44Å; P167-A188 CarbonylContact O-C 3.58Å; P167-A188 WeakPolarHBondContact O-CA 3.41Å; I185-A188 WeakPolarHBondContact O-CB 3.22Å; I185-A188 PolarHBondContact O-N 3.2Å; I185-A188 VanDerWaalsContact O-N 3.17Å; A188-T192 HydrophobicContact CB-CG2 3.73Å
189C80.1Confident79Confident73 Ų7345.2 Ų45.249%0.49325%0.245SC..SBendtrans-93.710.8-178.7-65.10000114.7P167 C169P167-C189 PolarHBondContact O-N 2.91Å; C169-C189 WeakPolarHBondContact CA-SG 3.33Å; C169-C189 HydrophobicContact CB-CB 4.37Å; C169-C189 WeakPolarHBondContact CB-SG 3.32Å; C169-C189 PolarHBondContact N-SG 2.95Å; C169-C189 WeakPolarHBondContact SG-CB 3.42Å; C169-C189 CovalentContact SG-SG 2.01Å; C169-C189 PolarHBondContact SG-SG 3.37Å
190T80.1Confident78.5Confident79 Ų7946.9 Ų46.949%0.48526%0.255SS..SBendtrans-122.9167.2-177.4-164.20000110.2P167 T192P167-T190 HydrophobicContact CG-CG2 3.8Å; T190-T192 PolarHBondContact O-N 3.46Å; T190-T192 VanDerWaalsContact O-N 3.12Å
191D78.1Confident78Confident130 Ų13049.6 Ų49.670%0.69527%0.274SS*.  trans-65.9112.6171.6-176.85.8000109.3F193D191-F193 VanDerWaalsContact OD1-CB 3.23Å; D191-F193 WeakPolarHBondContact OD1-CB 3.33Å; D191-F193 PolarHBondContact OD1-N 2.82Å
192T80.1Confident77.8Confident19 Ų1951.8 Ų51.812%0.11729%0.285CS..  trans-90.8-0.4-177.853.80000112.9L166 I185 A188 T190 V194 L195 E196L166-T192 HydrophobicContact CD2-CG2 4.04Å; I185-T192 HydrophobicContact CG2-CG2 3.92Å; A188-T192 HydrophobicContact CB-CG2 3.73Å; T190-T192 PolarHBondContact O-N 3.46Å; T190-T192 VanDerWaalsContact O-N 3.12Å; T192-V194 VanDerWaalsContact C-N 3.3Å; T192-V194 PolarHBondContact O-N 3.28Å; T192-V194 VanDerWaalsContact O-N 3.13Å; T192-L195 CarbonylContact O-C 3.57Å; T192-L195 WeakPolarHBondContact O-CA 3.18Å; T192-L195 WeakPolarHBondContact O-CB 3.47Å; T192-L195 PolarHBondContact O-N 3.44Å; T192-E196 WeakPolarHBondContact O-CG 3.29Å; T192-E196 PolarHBondContact O-N 3.16Å; T192-E196 PolarHBondContact OG1-OE1 3.23Å
193F80.3Confident77.8Confident133 Ų13351.5 Ų51.558%0.58328%0.283SS*.Hα-helixtrans-50.3-44.8-172.7179.2-100.4000114.1D191 L195 E196 L197D191-F193 VanDerWaalsContact OD1-CB 3.23Å; D191-F193 WeakPolarHBondContact OD1-CB 3.33Å; D191-F193 PolarHBondContact OD1-N 2.82Å; F193-L195 VanDerWaalsContact C-N 3.33Å; F193-L195 PolarHBondContact O-N 3.01Å; F193-E196 PolarHBondContact O-N 3.48Å; F193-L197 WeakPolarHBondContact O-CB 3.24Å; F193-L197 PolarHBondContact O-N 3.24Å
194V77.3Confident77.6Confident112 Ų11251.1 Ų51.168%0.67928%0.284SS*.Hα-helixtrans-65.2-39178.5178.30000111.5T192 L197 L198T192-V194 VanDerWaalsContact C-N 3.3Å; T192-V194 PolarHBondContact O-N 3.28Å; T192-V194 VanDerWaalsContact O-N 3.13Å; V194-L197 PolarHBondContact O-N 2.81Å; V194-L198 WeakPolarHBondContact O-CB 3.05Å; V194-L198 PolarHBondContact O-N 2.83Å
195L76.7Confident77.3Confident25 Ų2555.6 Ų55.613%0.13131%0.307CS..Hα-helixtrans-70.9-42.9178.9-164.866.4000111.4L162 L166 I185 T192 F193 L197 L198 M199L162-L195 HydrophobicContact CB-CD1 3.79Å; L162-L195 HydrophobicContact CD1-CD1 4.24Å; L162-L195 HydrophobicContact CD2-CD1 3.71Å; L162-L195 HydrophobicContact CG-CD1 4.11Å; L166-L195 HydrophobicContact CD1-CD2 3.62Å; L166-L195 HydrophobicContact CD2-CD2 3.42Å; L166-L195 VanDerWaalsContact CD2-CD2 3.42Å; L166-L195 HydrophobicContact CG-CD2 3.6Å; I185-L195 HydrophobicContact CD1-CD2 3.98Å; I185-L195 HydrophobicContact CD1-CG 4.17Å; I185-L195 HydrophobicContact CG1-CD2 4.06Å; T192-L195 CarbonylContact O-C 3.57Å; T192-L195 WeakPolarHBondContact O-CA 3.18Å; T192-L195 WeakPolarHBondContact O-CB 3.47Å; T192-L195 PolarHBondContact O-N 3.44Å; F193-L195 VanDerWaalsContact C-N 3.33Å; F193-L195 PolarHBondContact O-N 3.01Å; L195-L197 VanDerWaalsContact C-N 3.32Å; L195-L197 PolarHBondContact O-N 2.88Å; L195-L198 PolarHBondContact O-N 3.11Å; L195-M199 HydrophobicContact CD1-CE 4.06Å; L195-M199 HydrophobicContact CD1-SD 4.46Å; L195-M199 HydrophobicContact CD2-CE 4.01Å; L195-M199 HydrophobicContact CD2-SD 4.34Å; L195-M199 HydrophobicContact CG-CE 3.84Å; L195-M199 HydrophobicContact CG-SD 3.84Å; L195-M199 WeakPolarHBondContact O-CB 3.12Å; L195-M199 VanDerWaalsContact O-CG 3.31Å; L195-M199 WeakPolarHBondContact O-CG 2.95Å; L195-M199 PolarHBondContact O-N 2.74Å
196E77.9Confident77Confident42 Ų4257.4 Ų57.420%0.19632%0.318CS..Hα-helixtrans-57-47.9172.6-64.2-165.4179.100110.6I185 T192 F193 L198 M199 V200 F262I185-E196 HydrophobicContact CD1-CG 4.34Å; I185-E196 HydrophobicContact CG2-CG 3.91Å; I185-E196 WeakPolarHBondContact CG2-OE1 3.43Å; T192-E196 WeakPolarHBondContact O-CG 3.29Å; T192-E196 PolarHBondContact O-N 3.16Å; T192-E196 PolarHBondContact OG1-OE1 3.23Å; F193-E196 PolarHBondContact O-N 3.48Å; E196-L198 PolarHBondContact O-N 3.01Å; E196-M199 PolarHBondContact O-N 3.33Å; E196-V200 WeakPolarHBondContact O-CB 3.45Å; E196-V200 VanDerWaalsContact O-CG2 3.25Å; E196-V200 WeakPolarHBondContact O-CG2 3.49Å; E196-V200 PolarHBondContact O-N 2.93Å; E196-F262 HydrophobicContact CB-CD2 4.1Å; E196-F262 HydrophobicContact CB-CE2 4.19Å; E196-F262 HydrophobicContact CG-CD2 3.68Å; E196-F262 HydrophobicContact CG-CE2 4.16Å
197L77.3Confident76.8Confident99 Ų9953.8 Ų53.852%0.51830%0.303SS..Hα-helixtrans-61.6-43.7177.6-176.864.4000111.7F193 V194 L195 M199 S201F193-L197 WeakPolarHBondContact O-CB 3.24Å; F193-L197 PolarHBondContact O-N 3.24Å; V194-L197 PolarHBondContact O-N 2.81Å; L195-L197 VanDerWaalsContact C-N 3.32Å; L195-L197 PolarHBondContact O-N 2.88Å; L197-M199 VanDerWaalsContact C-N 3.32Å; L197-M199 PolarHBondContact O-N 3.47Å; L197-S201 WeakPolarHBondContact O-CB 3.34Å; L197-S201 PolarHBondContact O-N 2.86Å; L197-S201 PolarHBondContact O-OG 3.29Å
198L76.5Confident76.7Confident86 Ų8656.8 Ų56.845%0.4532%0.319SS..Hα-helixtrans-63.3-39178.5-174.464.2000111.6L162 V194 L195 E196 N202L162-L198 HydrophobicContact CD1-CD2 3.66Å; L162-L198 HydrophobicContact CD1-CG 4.24Å; L162-L198 HydrophobicContact CD2-CD2 3.62Å; L162-L198 HydrophobicContact CG-CD2 4.3Å; V194-L198 WeakPolarHBondContact O-CB 3.05Å; V194-L198 PolarHBondContact O-N 2.83Å; L195-L198 PolarHBondContact O-N 3.11Å; E196-L198 PolarHBondContact O-N 3.01Å; L198-N202 VanDerWaalsContact O-CB 3.23Å; L198-N202 WeakPolarHBondContact O-CB 3.49Å; L198-N202 PolarHBondContact O-N 3.33Å
199M74.4Confident76.4Confident0 Ų060.9 Ų60.90%034%0.336CS..Hα-helixtrans-79.6-39.3-178.4-72.7165.4163.400113.2L162 V181 I185 L195 E196 L197 S201 N202 N203 F262L162-M199 HydrophobicContact CB-CE 3.6Å; L162-M199 HydrophobicContact CD1-CE 4.11Å; L162-M199 HydrophobicContact CD1-CG 4.25Å; V181-M199 HydrophobicContact CB-SD 4.5Å; V181-M199 HydrophobicContact CG1-CE 3.36Å; V181-M199 HydrophobicContact CG1-CG 4.16Å; V181-M199 HydrophobicContact CG1-SD 3.05Å; V181-M199 WeakPolarHBondContact CG1-SD 3.41Å; V181-M199 HydrophobicContact CG2-CE 4.43Å; I185-M199 HydrophobicContact CD1-CE 4.17Å; I185-M199 HydrophobicContact CD1-SD 3.22Å; I185-M199 WeakPolarHBondContact CD1-SD 3.49Å; I185-M199 HydrophobicContact CG1-SD 4.39Å; L195-M199 HydrophobicContact CD1-CE 4.06Å; L195-M199 HydrophobicContact CD1-SD 4.46Å; L195-M199 HydrophobicContact CD2-CE 4.01Å; L195-M199 HydrophobicContact CD2-SD 4.34Å; L195-M199 HydrophobicContact CG-CE 3.84Å; L195-M199 HydrophobicContact CG-SD 3.84Å; L195-M199 WeakPolarHBondContact O-CB 3.12Å; L195-M199 VanDerWaalsContact O-CG 3.31Å; L195-M199 WeakPolarHBondContact O-CG 2.95Å; L195-M199 PolarHBondContact O-N 2.74Å; E196-M199 PolarHBondContact O-N 3.33Å; L197-M199 VanDerWaalsContact C-N 3.32Å; L197-M199 PolarHBondContact O-N 3.47Å; M199-S201 VanDerWaalsContact C-N 3.27Å; M199-N202 PolarHBondContact O-N 3.41Å; M199-N203 VanDerWaalsContact O-CB 3.3Å; M199-N203 WeakPolarHBondContact O-CB 3.34Å; M199-N203 PolarHBondContact O-N 2.96Å; M199-F262 HydrophobicContact CB-CE2 4.02Å; M199-F262 HydrophobicContact CB-CZ 3.88Å; M199-F262 HydrophobicContact SD-CE2 4.26Å
200V76.9Confident76.1Confident35 Ų3558.1 Ų58.121%0.21232%0.317CS..Iπ-helixtrans-62.1-40.3169.3170.40000109.6E196 G204 F262E196-V200 WeakPolarHBondContact O-CB 3.45Å; E196-V200 VanDerWaalsContact O-CG2 3.25Å; E196-V200 WeakPolarHBondContact O-CG2 3.49Å; E196-V200 PolarHBondContact O-N 2.93Å; V200-G204 WeakPolarHBondContact O-CA 3.38Å; V200-G204 PolarHBondContact O-N 2.97Å; V200-F262 HydrophobicContact CG2-CE1 3.85Å; V200-F262 HydrophobicContact CG2-CZ 3.85Å
201S73.1Confident75.9Confident58 Ų5856.5 Ų56.541%0.40630%0.303SS..Iπ-helixtrans-65.3-47.6174.3-60.10000111.2L197 M199 L205L197-S201 WeakPolarHBondContact O-CB 3.34Å; L197-S201 PolarHBondContact O-N 2.86Å; L197-S201 PolarHBondContact O-OG 3.29Å; M199-S201 VanDerWaalsContact C-N 3.27Å; S201-L205 WeakPolarHBondContact O-CA 3.37Å; S201-L205 WeakPolarHBondContact O-CB 3.1Å; S201-L205 PolarHBondContact O-N 3.08Å
202N75.9Confident75.9Confident46 Ų4654.6 Ų54.625%0.24629%0.293CS..Iπ-helixtrans-67.1-54-178.2-17353.2000112.3H155 Q159 L198 M199 V206H155-N202 PolarHBondContact CE1-ND2 3.35Å; H155-N202 VanDerWaalsContact CE1-ND2 3.33Å; H155-N202 PolarHBondContact ND1-ND2 3.36Å; Q159-N202 PolarHBondContact NE2-ND2 2.97Å; Q159-N202 VanDerWaalsContact NE2-ND2 3.14Å; L198-N202 VanDerWaalsContact O-CB 3.23Å; L198-N202 WeakPolarHBondContact O-CB 3.49Å; L198-N202 PolarHBondContact O-N 3.33Å; M199-N202 PolarHBondContact O-N 3.41Å; N202-V206 VanDerWaalsContact O-CB 3.26Å; N202-V206 WeakPolarHBondContact O-CB 3.33Å; N202-V206 WeakPolarHBondContact O-CG2 3.27Å; N202-V206 PolarHBondContact O-N 3.28Å
203N75.1Confident75.5Confident8 Ų857.4 Ų57.44%0.04331%0.31CS..Iπ-helixtrans-74.4-46.9-178.6-71.5-39.5000111.9H155 Q159 M199 T207 Y258H155-N203 PolarHBondContact CE1-OD1 2.86Å; H155-N203 PolarHBondContact NE2-OD1 3.49Å; Q159-N203 VanDerWaalsContact NE2-CG 3.31Å; Q159-N203 PolarHBondContact NE2-ND2 3.32Å; Q159-N203 PolarHBondContact NE2-OD1 3.36Å; M199-N203 VanDerWaalsContact O-CB 3.3Å; M199-N203 WeakPolarHBondContact O-CB 3.34Å; M199-N203 PolarHBondContact O-N 2.96Å; N203-T207 WeakPolarHBondContact O-CB 3.5Å; N203-T207 PolarHBondContact O-N 3.03Å; N203-T207 PolarHBondContact O-OG1 3.45Å; N203-Y258 HydrophobicContact CB-CD1 4Å; N203-Y258 HydrophobicContact CB-CD2 4.46Å; N203-Y258 HydrophobicContact CB-CG 3.81Å
204G74Confident75.2Confident9 Ų951.1 Ų51.19%0.09328%0.282CS..Iπ-helixtrans-66.9-45.2-17800000112.5V200 T207 L208V200-G204 WeakPolarHBondContact O-CA 3.38Å; V200-G204 PolarHBondContact O-N 2.97Å; G204-T207 PolarHBondContact O-N 3.5Å; G204-L208 WeakPolarHBondContact O-CB 3.46Å; G204-L208 PolarHBondContact O-N 2.96Å
205L74.3Confident75Confident96 Ų9650 Ų5050%0.50327%0.272SS..Hα-helixtrans-66.8-45.7178.5-170.166.3000111.3S201 T207 L208 M209S201-L205 WeakPolarHBondContact O-CA 3.37Å; S201-L205 WeakPolarHBondContact O-CB 3.1Å; S201-L205 PolarHBondContact O-N 3.08Å; L205-T207 VanDerWaalsContact C-N 3.33Å; L205-T207 PolarHBondContact O-N 3.21Å; L205-L208 PolarHBondContact O-N 3.44Å; L205-M209 HydrophobicContact CD1-CE 3.63Å; L205-M209 HydrophobicContact CD1-CG 4.09Å; L205-M209 HydrophobicContact CG-CE 4.36Å; L205-M209 HydrophobicContact CG-CG 4.11Å; L205-M209 WeakPolarHBondContact O-CB 3.46Å; L205-M209 WeakPolarHBondContact O-CG 3.44Å; L205-M209 PolarHBondContact O-N 3.47Å
206V72.1Confident74.9Confident41 Ų4150.9 Ų50.925%0.24829%0.287CS..Hα-helixtrans-60.9-45.4178.5170.60000110.5F113 N202 C210F113-V206 HydrophobicContact CE1-CG1 4.11Å; N202-V206 VanDerWaalsContact O-CB 3.26Å; N202-V206 WeakPolarHBondContact O-CB 3.33Å; N202-V206 WeakPolarHBondContact O-CG2 3.27Å; N202-V206 PolarHBondContact O-N 3.28Å; V206-C210 WeakPolarHBondContact O-CB 3.15Å; V206-C210 PolarHBondContact O-N 3.38Å; V206-C210 PolarHBondContact O-SG 2.9Å
207T73.8Confident74.6Confident5 Ų549.9 Ų49.93%0.03129%0.285CS..Hα-helixtrans-65.4-45.2179.3-570000111.3N203 G204 L205 F211 F251 C254 I255N203-T207 WeakPolarHBondContact O-CB 3.5Å; N203-T207 PolarHBondContact O-N 3.03Å; N203-T207 PolarHBondContact O-OG1 3.45Å; G204-T207 PolarHBondContact O-N 3.5Å; L205-T207 VanDerWaalsContact C-N 3.33Å; L205-T207 PolarHBondContact O-N 3.21Å; T207-F211 VanDerWaalsContact O-CB 3.32Å; T207-F211 WeakPolarHBondContact O-CB 3.07Å; T207-F211 PolarHBondContact O-N 3.05Å; T207-F251 HydrophobicContact CG2-CD1 3.53Å; T207-F251 HydrophobicContact CG2-CE1 4.05Å; T207-F251 WeakPolarHBondContact O-CD1 3.26Å; T207-F251 WeakPolarHBondContact O-CE1 3.49Å; T207-C254 HydrophobicContact CG2-CB 3.78Å; T207-I255 HydrophobicContact CG2-CD1 4.45Å; T207-I255 HydrophobicContact CG2-CG1 3.63Å
208L75.1Confident74.4Confident77 Ų7745.6 Ų45.640%0.40326%0.261SS..Hα-helixtrans-65.9-45.3179.3-177.964.7000111.7G204 L205 C210 F211 L212G204-L208 WeakPolarHBondContact O-CB 3.46Å; G204-L208 PolarHBondContact O-N 2.96Å; L205-L208 PolarHBondContact O-N 3.44Å; L208-C210 PolarHBondContact O-N 3.4Å; L208-F211 PolarHBondContact O-N 2.86Å; L208-L212 HydrophobicContact CD1-CD1 4.32Å; L208-L212 HydrophobicContact CD1-CG 4.27Å; L208-L212 HydrophobicContact CG-CD1 4.06Å; L208-L212 HydrophobicContact CG-CG 4.4Å; L208-L212 WeakPolarHBondContact O-CB 3.18Å; L208-L212 VanDerWaalsContact O-CG 3.31Å; L208-L212 WeakPolarHBondContact O-CG 3.49Å; L208-L212 PolarHBondContact O-N 3.07Å
209M75.1Confident74.1Confident105 Ų10545 Ų4552%0.51726%0.262SS..Hα-helixtrans-60.8-46.7178.1-73.2-65-177.200110.9L205 F211 L212 V213L205-M209 HydrophobicContact CD1-CE 3.63Å; L205-M209 HydrophobicContact CD1-CG 4.09Å; L205-M209 HydrophobicContact CG-CE 4.36Å; L205-M209 HydrophobicContact CG-CG 4.11Å; L205-M209 WeakPolarHBondContact O-CB 3.46Å; L205-M209 WeakPolarHBondContact O-CG 3.44Å; L205-M209 PolarHBondContact O-N 3.47Å; M209-F211 PolarHBondContact O-N 3.38Å; M209-L212 PolarHBondContact O-N 3.45Å; M209-V213 WeakPolarHBondContact O-CB 3.36Å; M209-V213 VanDerWaalsContact O-CG2 3.28Å; M209-V213 WeakPolarHBondContact O-CG2 3.26Å; M209-V213 PolarHBondContact O-N 3.39Å
210C74.1Confident73.9Confident15 Ų1547 Ų4710%0.10128%0.278CS..Hα-helixtrans-61.6-43.9175.1-69.30000111.2I112 V206 L208 L212 V213 L214 F251I112-C210 HydrophobicContact CG2-CB 4.16Å; V206-C210 WeakPolarHBondContact O-CB 3.15Å; V206-C210 PolarHBondContact O-N 3.38Å; V206-C210 PolarHBondContact O-SG 2.9Å; L208-C210 PolarHBondContact O-N 3.4Å; C210-L212 PolarHBondContact O-N 3.09Å; C210-V213 PolarHBondContact O-N 3.36Å; C210-L214 WeakPolarHBondContact O-CB 3.37Å; C210-L214 WeakPolarHBondContact O-CD1 3.46Å; C210-L214 WeakPolarHBondContact O-CG 3.46Å; C210-L214 PolarHBondContact O-N 2.8Å; C210-F251 HydrophobicContact CB-CE1 3.44Å; C210-F251 VanDerWaalsContact CB-CE1 3.44Å; C210-F251 HydrophobicContact CB-CZ 3.66Å
211F77Confident73.6Confident45 Ų4545.6 Ų45.620%0.19727%0.269CS..Hα-helixtrans-61-42.3177.4-177.7-104.4000112.8T207 L208 M209 L214 L215 V247 F251 I255T207-F211 VanDerWaalsContact O-CB 3.32Å; T207-F211 WeakPolarHBondContact O-CB 3.07Å; T207-F211 PolarHBondContact O-N 3.05Å; L208-F211 PolarHBondContact O-N 2.86Å; M209-F211 PolarHBondContact O-N 3.38Å; F211-L214 WeakPolarHBondContact O-CB 3.45Å; F211-L214 PolarHBondContact O-N 3.45Å; F211-L215 HydrophobicContact CE1-CD2 4.43Å; F211-L215 WeakPolarHBondContact O-CB 3.44Å; F211-L215 PolarHBondContact O-N 2.89Å; F211-V247 HydrophobicContact CD2-CG1 4.37Å; F211-F251 HydrophobicContact CB-CB 4.41Å; F211-F251 HydrophobicContact CB-CD1 3.86Å; F211-F251 HydrophobicContact CB-CG 4.3Å; F211-F251 HydrophobicContact CD2-CB 3.66Å; F211-F251 HydrophobicContact CD2-CG 4.14Å; F211-F251 HydrophobicContact CE2-CB 4.4Å; F211-F251 HydrophobicContact CG-CB 4.4Å; F211-I255 HydrophobicContact CB-CD1 4.23Å; F211-I255 HydrophobicContact CD1-CD1 4.27Å; F211-I255 HydrophobicContact CG-CD1 4.11Å
212L76.2Confident73.6Confident91 Ų9146.1 Ų46.148%0.47627%0.267SS..Hα-helixtrans-68.3-42.2178.1-71.2175.1000112L208 M209 C210 L214 L215 G216L208-L212 HydrophobicContact CD1-CD1 4.32Å; L208-L212 HydrophobicContact CD1-CG 4.27Å; L208-L212 HydrophobicContact CG-CD1 4.06Å; L208-L212 HydrophobicContact CG-CG 4.4Å; L208-L212 WeakPolarHBondContact O-CB 3.18Å; L208-L212 VanDerWaalsContact O-CG 3.31Å; L208-L212 WeakPolarHBondContact O-CG 3.49Å; L208-L212 PolarHBondContact O-N 3.07Å; M209-L212 PolarHBondContact O-N 3.45Å; C210-L212 PolarHBondContact O-N 3.09Å; L212-L214 VanDerWaalsContact C-N 3.3Å; L212-L214 PolarHBondContact O-N 3.04Å; L212-L215 PolarHBondContact O-N 3.39Å; L212-G216 PolarHBondContact O-N 2.89Å
213V73.3Confident73.6Confident78 Ų7848 Ų4847%0.47328%0.28SS..Hα-helixtrans-58.5-46.6173.1169.40000109.7T116 M209 C210 G216 S217T116-V213 HydrophobicContact CG2-CG1 4.37Å; M209-V213 WeakPolarHBondContact O-CB 3.36Å; M209-V213 VanDerWaalsContact O-CG2 3.28Å; M209-V213 WeakPolarHBondContact O-CG2 3.26Å; M209-V213 PolarHBondContact O-N 3.39Å; C210-V213 PolarHBondContact O-N 3.36Å; V213-G216 PolarHBondContact O-N 2.97Å; V213-S217 WeakPolarHBondContact O-CB 2.99Å; V213-S217 PolarHBondContact O-N 2.87Å; V213-S217 PolarHBondContact O-OG 2.9Å; V213-S217 VanDerWaalsContact O-OG 3.05Å
214L72.4Confident73.4Confident1 Ų151.3 Ų51.31%0.00530%0.296CS..Hα-helixtrans-59.9-50.3177.3-70.9166.4000111.6A119 C210 F211 L212 G216 S217 Y218 V247 F251A119-L214 HydrophobicContact CB-CD2 3.1Å; A119-L214 HydrophobicContact CB-CG 4.48Å; C210-L214 WeakPolarHBondContact O-CB 3.37Å; C210-L214 WeakPolarHBondContact O-CD1 3.46Å; C210-L214 WeakPolarHBondContact O-CG 3.46Å; C210-L214 PolarHBondContact O-N 2.8Å; F211-L214 WeakPolarHBondContact O-CB 3.45Å; F211-L214 PolarHBondContact O-N 3.45Å; L212-L214 VanDerWaalsContact C-N 3.3Å; L212-L214 PolarHBondContact O-N 3.04Å; L214-G216 VanDerWaalsContact C-N 3.34Å; L214-G216 PolarHBondContact O-N 3.45Å; L214-S217 PolarHBondContact O-N 3.34Å; L214-Y218 WeakPolarHBondContact O-CB 3.49Å; L214-Y218 WeakPolarHBondContact O-CD2 3.43Å; L214-Y218 PolarHBondContact O-N 2.82Å; L214-V247 HydrophobicContact CB-CG1 4.12Å; L214-V247 HydrophobicContact CD1-CB 4.4Å; L214-V247 HydrophobicContact CD1-CG1 3.57Å; L214-V247 HydrophobicContact CD1-CG2 3.9Å; L214-V247 HydrophobicContact CD2-CG2 4.19Å; L214-V247 HydrophobicContact CG-CG1 4.35Å; L214-F251 HydrophobicContact CD1-CD2 4.03Å; L214-F251 HydrophobicContact CD1-CE1 4.45Å; L214-F251 HydrophobicContact CD1-CE2 3.42Å; L214-F251 VanDerWaalsContact CD1-CE2 3.42Å; L214-F251 HydrophobicContact CD1-CZ 3.66Å
215L75Confident73.3Confident89 Ų8951.2 Ų51.247%0.46629%0.294SS..Hα-helixtrans-62.5-42-180-170.967.2000111.7F211 L212 Y218 T219F211-L215 HydrophobicContact CE1-CD2 4.43Å; F211-L215 WeakPolarHBondContact O-CB 3.44Å; F211-L215 PolarHBondContact O-N 2.89Å; L212-L215 PolarHBondContact O-N 3.39Å; L215-Y218 PolarHBondContact O-N 3.24Å; L215-T219 VanDerWaalsContact O-CB 3.31Å; L215-T219 WeakPolarHBondContact O-CB 3.39Å; L215-T219 PolarHBondContact O-N 2.78Å; L215-T219 PolarHBondContact O-OG1 3.4Å
216G73.3Confident73.2Confident42 Ų4256.5 Ų56.543%0.43331%0.307SS..Hα-helixtrans-62.4-50.3176.100000112.1L212 V213 L214 Y218 T219 A220L212-G216 PolarHBondContact O-N 2.89Å; V213-G216 PolarHBondContact O-N 2.97Å; L214-G216 VanDerWaalsContact C-N 3.34Å; L214-G216 PolarHBondContact O-N 3.45Å; G216-Y218 VanDerWaalsContact C-N 3.34Å; G216-Y218 PolarHBondContact O-N 3.05Å; G216-T219 PolarHBondContact O-N 3.08Å; G216-A220 WeakPolarHBondContact O-CB 3.04Å; G216-A220 PolarHBondContact O-N 2.82Å
217S72.3Confident73.1Confident22 Ų2259.2 Ų59.215%0.15433%0.328CS..Hα-helixtrans-57.5-45.8176-65.60000111.5V213 L214 A220 L221V213-S217 WeakPolarHBondContact O-CB 2.99Å; V213-S217 PolarHBondContact O-N 2.87Å; V213-S217 PolarHBondContact O-OG 2.9Å; V213-S217 VanDerWaalsContact O-OG 3.05Å; L214-S217 PolarHBondContact O-N 3.34Å; S217-A220 PolarHBondContact O-N 3.04Å; S217-L221 WeakPolarHBondContact O-CB 3.19Å; S217-L221 PolarHBondContact O-N 3.25Å
218Y71.9Confident73Confident8 Ų863.6 Ų63.63%0.03135%0.348CS..Hα-helixtrans-69.8-36.3179.3-85-68.1000113.4A119 R122 L214 L215 G216 L221 L222 C240 H243 I244A119-Y218 HydrophobicContact CB-CE2 4.27Å; R122-Y218 VanDerWaalsContact CD-OH 3.22Å; R122-Y218 WeakPolarHBondContact CD-OH 3.35Å; L214-Y218 WeakPolarHBondContact O-CB 3.49Å; L214-Y218 WeakPolarHBondContact O-CD2 3.43Å; L214-Y218 PolarHBondContact O-N 2.82Å; L215-Y218 PolarHBondContact O-N 3.24Å; G216-Y218 VanDerWaalsContact C-N 3.34Å; G216-Y218 PolarHBondContact O-N 3.05Å; Y218-L221 PolarHBondContact O-N 2.92Å; Y218-L222 WeakPolarHBondContact O-CB 3.5Å; Y218-L222 VanDerWaalsContact O-CG 3.29Å; Y218-L222 WeakPolarHBondContact O-CG 3.26Å; Y218-L222 PolarHBondContact O-N 3.22Å; Y218-C240 HydrophobicContact CD1-CB 4.25Å; Y218-C240 HydrophobicContact CE1-CB 3.96Å; Y218-H243 AromaticContact CE2-ND1 3.44Å; Y218-H243 WeakPolarHBondContact CE2-ND1 3.02Å; Y218-H243 AromaticContact CZ-CG 3.82Å; Y218-H243 AromaticContact CZ-ND1 3.45Å; Y218-H243 WeakPolarHBondContact OH-CB 3.35Å; Y218-H243 PolarHBondContact OH-ND1 2.03Å; Y218-I244 HydrophobicContact CD1-CD1 3.67Å; Y218-I244 HydrophobicContact CD1-CG1 3.58Å; Y218-I244 HydrophobicContact CD2-CG1 3.86Å; Y218-I244 HydrophobicContact CE1-CD1 4.38Å; Y218-I244 HydrophobicContact CE1-CG1 3.98Å; Y218-I244 HydrophobicContact CE2-CG1 4.25Å; Y218-I244 HydrophobicContact CG-CD1 3.84Å; Y218-I244 HydrophobicContact CG-CG1 3.55Å
219T71.9Confident72.9Confident75 Ų7563.7 Ų63.746%0.4636%0.355SS..Hα-helixtrans-64.2-47.4175.7-57.10000110.3L215 G216 L221 L222 V223L215-T219 VanDerWaalsContact O-CB 3.31Å; L215-T219 WeakPolarHBondContact O-CB 3.39Å; L215-T219 PolarHBondContact O-N 2.78Å; L215-T219 PolarHBondContact O-OG1 3.4Å; G216-T219 PolarHBondContact O-N 3.08Å; T219-L221 VanDerWaalsContact C-N 3.27Å; T219-L221 PolarHBondContact O-N 2.91Å; T219-L222 PolarHBondContact O-N 3.43Å; T219-V223 VanDerWaalsContact O-CG2 3.29Å; T219-V223 WeakPolarHBondContact O-CG2 3.35Å; T219-V223 PolarHBondContact O-N 3.49Å
220A69.9Low72.7Confident41 Ų4168.9 Ų68.934%0.33937%0.368SS..Hα-helixtrans-58.9-41.2175.200000111.7Y123 G216 S217 V223 M224Y123-A220 HydrophobicContact CE2-CB 4.45Å; G216-A220 WeakPolarHBondContact O-CB 3.04Å; G216-A220 PolarHBondContact O-N 2.82Å; S217-A220 PolarHBondContact O-N 3.04Å; A220-V223 PolarHBondContact O-N 2.91Å; A220-M224 WeakPolarHBondContact O-CB 3.33Å; A220-M224 VanDerWaalsContact O-CG 3.24Å; A220-M224 WeakPolarHBondContact O-CG 3.31Å; A220-M224 PolarHBondContact O-N 3.49Å
221L70.2Confident72.5Confident5 Ų574.6 Ų74.63%0.02639%0.394CS..Hα-helixtrans-69.1-40.1-179.3-162.6156.6000111.8R122 I126 S217 Y218 T219 M224 L225 C240R122-L221 HydrophobicContact CB-CD1 4.36Å; I126-L221 HydrophobicContact CB-CG 4.3Å; I126-L221 HydrophobicContact CD1-CD1 3.86Å; I126-L221 HydrophobicContact CD1-CD2 3.51Å; I126-L221 HydrophobicContact CD1-CG 3.67Å; I126-L221 HydrophobicContact CG2-CG 4.19Å; S217-L221 WeakPolarHBondContact O-CB 3.19Å; S217-L221 PolarHBondContact O-N 3.25Å; Y218-L221 PolarHBondContact O-N 2.92Å; T219-L221 VanDerWaalsContact C-N 3.27Å; T219-L221 PolarHBondContact O-N 2.91Å; L221-M224 PolarHBondContact O-N 3.23Å; L221-L225 HydrophobicContact CD2-CD1 3.69Å; L221-L225 HydrophobicContact CD2-CG 4.31Å; L221-L225 WeakPolarHBondContact O-CB 3.34Å; L221-L225 VanDerWaalsContact O-CG 3.28Å; L221-L225 WeakPolarHBondContact O-CG 3.29Å; L221-L225 PolarHBondContact O-N 3.46Å; L221-C240 HydrophobicContact CD2-CB 4.44Å; L221-C240 WeakPolarHBondContact CD2-SG 3.22Å
222L73.5Confident72Confident69 Ų6973.6 Ų73.636%0.36140%0.396SS..Hα-helixtrans-65.3-38172.5-74.1173.2000112.2Y218 T219 L225 R226 L237Y218-L222 WeakPolarHBondContact O-CB 3.5Å; Y218-L222 VanDerWaalsContact O-CG 3.29Å; Y218-L222 WeakPolarHBondContact O-CG 3.26Å; Y218-L222 PolarHBondContact O-N 3.22Å; T219-L222 PolarHBondContact O-N 3.43Å; L222-L225 PolarHBondContact O-N 3.21Å; L222-R226 PolarHBondContact O-N 2.96Å; L222-L237 HydrophobicContact CD2-CD1 4.01Å
223V76Confident71.7Confident86 Ų8675 Ų7552%0.52140%0.395SS..Hα-helixtrans-64.6-46.7174.5170.50000110.5T219 A220 L225 R226T219-V223 VanDerWaalsContact O-CG2 3.29Å; T219-V223 WeakPolarHBondContact O-CG2 3.35Å; T219-V223 PolarHBondContact O-N 3.49Å; A220-V223 PolarHBondContact O-N 2.91Å; V223-L225 VanDerWaalsContact C-N 3.31Å; V223-L225 PolarHBondContact O-N 3.43Å; V223-R226 WeakPolarHBondContact O-CB 3.45Å; V223-R226 PolarHBondContact O-N 3.16Å; V223-R226 VanDerWaalsContact O-N 3.09Å
224M70.4Confident71.4Confident78 Ų7875.4 Ų75.438%0.38440%0.402SS..Hα-helixtrans-61.8-35.9175.9-73.9-78.9-77.200112.7A220 L221 R226 S227A220-M224 WeakPolarHBondContact O-CB 3.33Å; A220-M224 VanDerWaalsContact O-CG 3.24Å; A220-M224 WeakPolarHBondContact O-CG 3.31Å; A220-M224 PolarHBondContact O-N 3.49Å; L221-M224 PolarHBondContact O-N 3.23Å; M224-R226 PolarHBondContact O-N 3.39Å; M224-S227 PolarHBondContact O-N 3Å; M224-S227 PolarHBondContact O-OG 2.9Å
225L71.9Confident71.1Confident7 Ų782.7 Ų82.74%0.03743%0.433CS..Hα-helixtrans-70.2-16.5176.3-76.7172.8000113.6L221 L222 V223 S227 H228 A236L221-L225 HydrophobicContact CD2-CD1 3.69Å; L221-L225 HydrophobicContact CD2-CG 4.31Å; L221-L225 WeakPolarHBondContact O-CB 3.34Å; L221-L225 VanDerWaalsContact O-CG 3.28Å; L221-L225 WeakPolarHBondContact O-CG 3.29Å; L221-L225 PolarHBondContact O-N 3.46Å; L222-L225 PolarHBondContact O-N 3.21Å; V223-L225 VanDerWaalsContact C-N 3.31Å; V223-L225 PolarHBondContact O-N 3.43Å; L225-S227 VanDerWaalsContact C-N 3.31Å; L225-H228 PolarHBondContact O-N 3.05Å; L225-A236 HydrophobicContact CD1-CB 4Å; L225-A236 HydrophobicContact CD2-CB 3.61Å; L225-A236 HydrophobicContact CG-CB 4.48Å
226R72.4Confident70.7Confident206 Ų20679.3 Ų79.378%0.77742%0.418SS*.Hα-helixtrans-70.3-27.3174-70.1-178.8-179.3-178.20.6112.6L222 V223 M224L222-R226 PolarHBondContact O-N 2.96Å; V223-R226 WeakPolarHBondContact O-CB 3.45Å; V223-R226 PolarHBondContact O-N 3.16Å; V223-R226 VanDerWaalsContact O-N 3.09Å; M224-R226 PolarHBondContact O-N 3.39Å
227S70.1Confident70.6Confident98 Ų9881.4 Ų81.469%0.68542%0.419SS*.SBendtrans-88.8-6.8177.961.70000113.6M224 L225M224-S227 PolarHBondContact O-N 3Å; M224-S227 PolarHBondContact O-OG 2.9Å; L225-S227 VanDerWaalsContact C-N 3.31Å
228H71.8Confident70.4Confident97 Ų9783.2 Ų83.245%0.44943%0.43SS..SBendtrans-80.8157.6178-94.158.1000113.4L225L225-H228 PolarHBondContact O-N 3.05Å
229S72.2Confident70.2Confident79 Ų7985.1 Ų85.155%0.55244%0.443SS*.  trans-57.7152.9174.279.20000111.7E231 G232 R233S229-E231 PolarHBondContact O-N 3.11Å; S229-E231 VanDerWaalsContact O-N 3.09Å; S229-G232 PolarHBondContact O-N 3.24Å; S229-G232 VanDerWaalsContact O-N 3.08Å; S229-G232 PolarHBondContact OG-N 2.92Å; S229-R233 PolarHBondContact O-N 3.34Å
230R71.2Confident70.1Confident214 Ų21481.7 Ų81.781%0.80842%0.421SS*.Hα-helixtrans-54.7-32.4-179.6-168.5176.7171.5-174.9-2.3112.4S234R230-S234 WeakPolarHBondContact O-CB 3.43Å; R230-S234 PolarHBondContact O-N 3.49Å; R230-S234 VanDerWaalsContact O-N 3.13Å
231E69.8Low70.1Confident136 Ų13682.1 Ų82.164%0.63643%0.425SS*.Hα-helixtrans-75.3-43.1178-165.8170.9176.900112.9S229 R233 S234 K235S229-E231 PolarHBondContact O-N 3.11Å; S229-E231 VanDerWaalsContact O-N 3.09Å; E231-R233 VanDerWaalsContact C-N 3.34Å; E231-R233 PolarHBondContact O-N 2.9Å; E231-S234 PolarHBondContact O-N 2.82Å; E231-K235 PolarHBondContact O-N 3.07Å
232G66.6Low70.1Confident24 Ų2482.3 Ų82.325%0.24743%0.427CS..Hα-helixtrans-61.8-41.8173.500000112.2S229 S234 K235 A236S229-G232 PolarHBondContact O-N 3.24Å; S229-G232 VanDerWaalsContact O-N 3.08Å; S229-G232 PolarHBondContact OG-N 2.92Å; G232-S234 PolarHBondContact O-N 3.42Å; G232-K235 PolarHBondContact O-N 3.3Å; G232-A236 PolarHBondContact O-N 3.42Å; G232-A236 VanDerWaalsContact O-N 3.15Å
233R69Low70Confident120 Ų12079 Ų7945%0.45341%0.41SS..Hα-helixtrans-61.9-43.7175.4-169.6176.470.5-179.23.4112.4S229 E231 K235 A236 L237S229-R233 PolarHBondContact O-N 3.34Å; E231-R233 VanDerWaalsContact C-N 3.34Å; E231-R233 PolarHBondContact O-N 2.9Å; R233-K235 PolarHBondContact O-N 3.41Å; R233-A236 PolarHBondContact O-N 2.79Å; R233-L237 WeakPolarHBondContact O-CB 3.39Å; R233-L237 PolarHBondContact O-N 2.77Å
234S67.2Low69.9Low87 Ų8777.5 Ų77.561%0.60840%0.398SS*.Hα-helixtrans-65.3-25.6-179.5-171.40000113.5R230 E231 G232 P238R230-S234 WeakPolarHBondContact O-CB 3.43Å; R230-S234 PolarHBondContact O-N 3.49Å; R230-S234 VanDerWaalsContact O-N 3.13Å; E231-S234 PolarHBondContact O-N 2.82Å; G232-S234 PolarHBondContact O-N 3.42Å; S234-P238 WeakPolarHBondContact O-CD 3.19Å
235K66.6Low70Confident154 Ų15475.7 Ų75.767%0.6740%0.396SS*.Hα-helixtrans-85.5-36.6176.8-74.1-178.9-179.5171.60112.9E231 G232 R233E231-K235 PolarHBondContact O-N 3.07Å; G232-K235 PolarHBondContact O-N 3.3Å; R233-K235 PolarHBondContact O-N 3.41Å
236A67.1Low70.1Confident18 Ų1875.4 Ų75.415%0.14939%0.394CS..Hα-helixtrans-87.2-33-174.500000114.6L225 G232 R233 T239 C240L225-A236 HydrophobicContact CD1-CB 4Å; L225-A236 HydrophobicContact CD2-CB 3.61Å; L225-A236 HydrophobicContact CG-CB 4.48Å; G232-A236 PolarHBondContact O-N 3.42Å; G232-A236 VanDerWaalsContact O-N 3.15Å; R233-A236 PolarHBondContact O-N 2.79Å; A236-T239 PolarHBondContact O-N 3.19Å; A236-T239 PolarHBondContact O-OG1 3.22Å; A236-C240 PolarHBondContact O-N 3.47Å; A236-C240 PolarHBondContact O-SG 3.1Å
237L70Confident70.1Confident85 Ų8565.9 Ų65.945%0.44536%0.359SS..Hα-helixtrans-59-43.6-176.8-154.984.2000113.8L222 R233 T239 C240 A241L222-L237 HydrophobicContact CD2-CD1 4.01Å; R233-L237 WeakPolarHBondContact O-CB 3.39Å; R233-L237 PolarHBondContact O-N 2.77Å; L237-T239 VanDerWaalsContact C-N 3.34Å; L237-T239 PolarHBondContact O-N 3.22Å; L237-C240 PolarHBondContact O-N 2.84Å; L237-A241 WeakPolarHBondContact O-CB 3.21Å; L237-A241 PolarHBondContact O-N 3Å
238P68.4Low70.3Confident60 Ų6064 Ų6439%0.3934%0.344SS..Hα-helixtrans-64.8-36.4-178.2-21.934.3000113.3S234 S242S234-P238 WeakPolarHBondContact O-CD 3.19Å; P238-S242 PolarHBondContact O-N 3.34Å; P238-S242 VanDerWaalsContact O-N 3.1Å; P238-S242 PolarHBondContact O-OG 2.84Å
239T68.8Low70.5Confident49 Ų4962 Ų6230%0.30134%0.335SS..Hα-helixtrans-77.5-28.4-179.258.50000112.4R122 A236 L237 S242 H243R122-T239 PolarHBondContact NH1-O 3.32Å; A236-T239 PolarHBondContact O-N 3.19Å; A236-T239 PolarHBondContact O-OG1 3.22Å; L237-T239 VanDerWaalsContact C-N 3.34Å; L237-T239 PolarHBondContact O-N 3.22Å; T239-S242 WeakPolarHBondContact CA-OG 3.44Å; T239-S242 PolarHBondContact O-OG 2.7Å; T239-H243 PolarHBondContact O-N 3.35Å
240C69.9Low70.6Confident2 Ų258.9 Ų58.91%0.01431%0.312CS..Hα-helixtrans-73-45.5171.5-620000111.1Y218 L221 A236 L237 S242 H243 I244Y218-C240 HydrophobicContact CD1-CB 4.25Å; Y218-C240 HydrophobicContact CE1-CB 3.96Å; L221-C240 HydrophobicContact CD2-CB 4.44Å; L221-C240 WeakPolarHBondContact CD2-SG 3.22Å; A236-C240 PolarHBondContact O-N 3.47Å; A236-C240 PolarHBondContact O-SG 3.1Å; L237-C240 PolarHBondContact O-N 2.84Å; C240-S242 VanDerWaalsContact C-N 3.3Å; C240-S242 PolarHBondContact O-N 3.35Å; C240-H243 PolarHBondContact O-N 2.76Å; C240-I244 VanDerWaalsContact O-CG1 3.3Å; C240-I244 WeakPolarHBondContact O-CG1 3.27Å; C240-I244 PolarHBondContact O-N 2.91Å
241A70.1Confident70.7Confident50 Ų5048.7 Ų48.741%0.41327%0.274SS..Hα-helixtrans-60.2-39177.600000112.2L237 A245L237-A241 WeakPolarHBondContact O-CB 3.21Å; L237-A241 PolarHBondContact O-N 3Å; A241-A245 WeakPolarHBondContact O-CB 3.16Å; A241-A245 PolarHBondContact O-N 3.29Å
242S69.1Low71.2Confident9 Ų945.9 Ų45.96%0.06327%0.266CS..Hα-helixtrans-63.9-43.6176.157.90000112.3P238 T239 C240 A245 V246 I286P238-S242 PolarHBondContact O-N 3.34Å; P238-S242 VanDerWaalsContact O-N 3.1Å; P238-S242 PolarHBondContact O-OG 2.84Å; T239-S242 WeakPolarHBondContact CA-OG 3.44Å; T239-S242 PolarHBondContact O-OG 2.7Å; C240-S242 VanDerWaalsContact C-N 3.3Å; C240-S242 PolarHBondContact O-N 3.35Å; S242-A245 PolarHBondContact O-N 2.66Å; S242-V246 WeakPolarHBondContact O-CG2 3.37Å; S242-V246 PolarHBondContact O-N 3.21Å; S242-I286 WeakPolarHBondContact O-CG2 2.89Å
243H71.9Confident71.9Confident0 Ų045 Ų450%026%0.256CS..Hα-helixtrans-72-37179.4-168.7-72.7000112Y218 T239 C240 A245 V246 V247 Y287Y218-H243 AromaticContact CE2-ND1 3.44Å; Y218-H243 WeakPolarHBondContact CE2-ND1 3.02Å; Y218-H243 AromaticContact CZ-CG 3.82Å; Y218-H243 AromaticContact CZ-ND1 3.45Å; Y218-H243 WeakPolarHBondContact OH-CB 3.35Å; Y218-H243 PolarHBondContact OH-ND1 2.03Å; T239-H243 PolarHBondContact O-N 3.35Å; C240-H243 PolarHBondContact O-N 2.76Å; H243-A245 VanDerWaalsContact C-N 3.31Å; H243-A245 PolarHBondContact O-N 2.9Å; H243-V246 PolarHBondContact O-N 3.47Å; H243-V247 VanDerWaalsContact CE1-CG2 3.49Å; H243-V247 WeakPolarHBondContact CE1-CG2 2.95Å; H243-V247 WeakPolarHBondContact ND1-CG2 3.43Å; H243-V247 WeakPolarHBondContact O-CB 3.31Å; H243-V247 VanDerWaalsContact O-CG2 3.23Å; H243-V247 WeakPolarHBondContact O-CG2 3.13Å; H243-V247 PolarHBondContact O-N 2.78Å; H243-Y287 PolarHBondContact CD2-OH 2.81Å; H243-Y287 VanDerWaalsContact CD2-OH 3.29Å
244I72.7Confident72.3Confident55 Ų5539.9 Ų39.928%0.28224%0.238SC..Hα-helixtrans-58.4-46.5171-68.6167.3000109.7Y218 C240 V246 V247 T248Y218-I244 HydrophobicContact CD1-CD1 3.67Å; Y218-I244 HydrophobicContact CD1-CG1 3.58Å; Y218-I244 HydrophobicContact CD2-CG1 3.86Å; Y218-I244 HydrophobicContact CE1-CD1 4.38Å; Y218-I244 HydrophobicContact CE1-CG1 3.98Å; Y218-I244 HydrophobicContact CE2-CG1 4.25Å; Y218-I244 HydrophobicContact CG-CD1 3.84Å; Y218-I244 HydrophobicContact CG-CG1 3.55Å; C240-I244 VanDerWaalsContact O-CG1 3.3Å; C240-I244 WeakPolarHBondContact O-CG1 3.27Å; C240-I244 PolarHBondContact O-N 2.91Å; I244-V246 PolarHBondContact O-N 3.38Å; I244-V247 PolarHBondContact O-N 3.39Å; I244-T248 WeakPolarHBondContact O-CB 3.36Å; I244-T248 PolarHBondContact O-N 2.83Å; I244-T248 PolarHBondContact O-OG1 3.32Å
245A74.3Confident72.8Confident40 Ų4037.9 Ų37.933%0.33122%0.22SC..Hα-helixtrans-59-46.6178.200000112.3A241 S242 H243 T248 L249A241-A245 WeakPolarHBondContact O-CB 3.16Å; A241-A245 PolarHBondContact O-N 3.29Å; S242-A245 PolarHBondContact O-N 2.66Å; H243-A245 VanDerWaalsContact C-N 3.31Å; H243-A245 PolarHBondContact O-N 2.9Å; A245-T248 PolarHBondContact O-N 3.44Å; A245-L249 WeakPolarHBondContact O-CB 3.41Å; A245-L249 VanDerWaalsContact O-CG 3.22Å; A245-L249 WeakPolarHBondContact O-CG 3.47Å; A245-L249 PolarHBondContact O-N 3Å
246V72.9Confident73.5Confident0 Ų034.7 Ų34.70%021%0.205CC..Hα-helixtrans-61.9-46.4176.6172.10000111.3L115 S242 H243 I244 T248 L249 I250 N283 I286 Y287L115-V246 HydrophobicContact CD2-CG1 4.29Å; S242-V246 WeakPolarHBondContact O-CG2 3.37Å; S242-V246 PolarHBondContact O-N 3.21Å; H243-V246 PolarHBondContact O-N 3.47Å; I244-V246 PolarHBondContact O-N 3.38Å; V246-T248 VanDerWaalsContact C-N 3.35Å; V246-T248 PolarHBondContact O-N 3.34Å; V246-L249 PolarHBondContact O-N 3.23Å; V246-I250 HydrophobicContact CG1-CD1 3.69Å; V246-I250 HydrophobicContact CG1-CG1 4.44Å; V246-I250 WeakPolarHBondContact O-CG1 3.41Å; V246-I250 PolarHBondContact O-N 3.04Å; V246-N283 WeakPolarHBondContact CG1-OD1 3.33Å; V246-N283 VanDerWaalsContact CG2-OD1 3.24Å; V246-N283 WeakPolarHBondContact CG2-OD1 3.32Å; V246-I286 HydrophobicContact CG2-CB 3.91Å; V246-I286 HydrophobicContact CG2-CD1 3.69Å; V246-I286 HydrophobicContact CG2-CG1 4.39Å; V246-I286 HydrophobicContact CG2-CG2 3.48Å; V246-I286 VanDerWaalsContact CG2-CG2 3.48Å; V246-Y287 HydrophobicContact CB-CE2 4.26Å; V246-Y287 HydrophobicContact CG1-CE2 4.02Å; V246-Y287 HydrophobicContact CG2-CD2 4.36Å; V246-Y287 HydrophobicContact CG2-CE2 3.68Å
247V72.3Confident73.8Confident6 Ų634.6 Ų34.64%0.03620%0.201CC..Hα-helixtrans-58.9-48177.6163.90000110.4F211 L214 H243 I244 L249 I250 F251F211-V247 HydrophobicContact CD2-CG1 4.37Å; L214-V247 HydrophobicContact CB-CG1 4.12Å; L214-V247 HydrophobicContact CD1-CB 4.4Å; L214-V247 HydrophobicContact CD1-CG1 3.57Å; L214-V247 HydrophobicContact CD1-CG2 3.9Å; L214-V247 HydrophobicContact CD2-CG2 4.19Å; L214-V247 HydrophobicContact CG-CG1 4.35Å; H243-V247 VanDerWaalsContact CE1-CG2 3.49Å; H243-V247 WeakPolarHBondContact CE1-CG2 2.95Å; H243-V247 WeakPolarHBondContact ND1-CG2 3.43Å; H243-V247 WeakPolarHBondContact O-CB 3.31Å; H243-V247 VanDerWaalsContact O-CG2 3.23Å; H243-V247 WeakPolarHBondContact O-CG2 3.13Å; H243-V247 PolarHBondContact O-N 2.78Å; I244-V247 PolarHBondContact O-N 3.39Å; V247-L249 PolarHBondContact O-N 2.87Å; V247-I250 PolarHBondContact O-N 3.26Å; V247-F251 HydrophobicContact CB-CD2 4.44Å; V247-F251 HydrophobicContact CG1-CD2 3.78Å; V247-F251 HydrophobicContact CG1-CE2 4.31Å; V247-F251 HydrophobicContact CG1-CG 4.46Å; V247-F251 WeakPolarHBondContact O-CB 3.32Å; V247-F251 VanDerWaalsContact O-CD2 3.32Å; V247-F251 WeakPolarHBondContact O-CD2 3.28Å; V247-F251 PolarHBondContact O-N 2.94Å
248T74.9Confident74Confident60 Ų6031.1 Ų31.137%0.36818%0.183SC..Hα-helixtrans-61.9-43.2178-55.60000111.5I244 A245 V246 I250 V252I244-T248 WeakPolarHBondContact O-CB 3.36Å; I244-T248 PolarHBondContact O-N 2.83Å; I244-T248 PolarHBondContact O-OG1 3.32Å; A245-T248 PolarHBondContact O-N 3.44Å; V246-T248 VanDerWaalsContact C-N 3.35Å; V246-T248 PolarHBondContact O-N 3.34Å; T248-I250 PolarHBondContact O-N 2.84Å; T248-V252 HydrophobicContact CG2-CG2 3.67Å; T248-V252 VanDerWaalsContact O-CB 3.26Å; T248-V252 WeakPolarHBondContact O-CB 3.41Å; T248-V252 WeakPolarHBondContact O-CG2 3.47Å; T248-V252 PolarHBondContact O-N 3.16Å
249L76.3Confident74.2Confident53 Ų5331 Ų3128%0.27719%0.187SC..Hα-helixtrans-66.6-20.9178.8-73.6171.3000114.1A245 V246 V247 P253 T279 L282 I286A245-L249 WeakPolarHBondContact O-CB 3.41Å; A245-L249 VanDerWaalsContact O-CG 3.22Å; A245-L249 WeakPolarHBondContact O-CG 3.47Å; A245-L249 PolarHBondContact O-N 3Å; V246-L249 PolarHBondContact O-N 3.23Å; V247-L249 PolarHBondContact O-N 2.87Å; L249-P253 WeakPolarHBondContact O-CD 3.31Å; L249-P253 WeakPolarHBondContact O-CG 3.47Å; L249-T279 HydrophobicContact CB-CG2 4.03Å; L249-T279 PolarHBondContact O-OG1 3.01Å; L249-L282 HydrophobicContact CD1-CD1 4.28Å; L249-I286 HydrophobicContact CD1-CD1 4Å
250I73.1Confident74.4Confident14 Ų1430.9 Ų30.97%0.07218%0.181CC..Hα-helixtrans-94.8-52.2176.5-66.6174.8000110.5L115 V246 V247 T248 P253 C254 T279L115-I250 HydrophobicContact CD1-CD1 3.55Å; L115-I250 HydrophobicContact CD1-CG2 4.23Å; V246-I250 HydrophobicContact CG1-CD1 3.69Å; V246-I250 HydrophobicContact CG1-CG1 4.44Å; V246-I250 WeakPolarHBondContact O-CG1 3.41Å; V246-I250 PolarHBondContact O-N 3.04Å; V247-I250 PolarHBondContact O-N 3.26Å; T248-I250 PolarHBondContact O-N 2.84Å; I250-P253 WeakPolarHBondContact O-CD 3.24Å; I250-C254 PolarHBondContact O-N 2.97Å; I250-C254 PolarHBondContact O-SG 3.44Å; I250-T279 HydrophobicContact CD1-CG2 4.1Å; I250-T279 HydrophobicContact CG1-CG2 3.38Å
251F74.5Confident74.3Confident1 Ų134.8 Ų34.80%0.00421%0.206CC..Hα-helixtrans-75.6-35.7-170.7-80.3-92.4000113.3I112 L115 T207 C210 F211 L214 V247 C254 I255I112-F251 HydrophobicContact CG1-CZ 4.43Å; I112-F251 HydrophobicContact CG2-CE1 4.13Å; I112-F251 HydrophobicContact CG2-CZ 3.91Å; L115-F251 HydrophobicContact CD1-CE2 4.05Å; T207-F251 HydrophobicContact CG2-CD1 3.53Å; T207-F251 HydrophobicContact CG2-CE1 4.05Å; T207-F251 WeakPolarHBondContact O-CD1 3.26Å; T207-F251 WeakPolarHBondContact O-CE1 3.49Å; C210-F251 HydrophobicContact CB-CE1 3.44Å; C210-F251 VanDerWaalsContact CB-CE1 3.44Å; C210-F251 HydrophobicContact CB-CZ 3.66Å; F211-F251 HydrophobicContact CB-CB 4.41Å; F211-F251 HydrophobicContact CB-CD1 3.86Å; F211-F251 HydrophobicContact CB-CG 4.3Å; F211-F251 HydrophobicContact CD2-CB 3.66Å; F211-F251 HydrophobicContact CD2-CG 4.14Å; F211-F251 HydrophobicContact CE2-CB 4.4Å; F211-F251 HydrophobicContact CG-CB 4.4Å; L214-F251 HydrophobicContact CD1-CD2 4.03Å; L214-F251 HydrophobicContact CD1-CE1 4.45Å; L214-F251 HydrophobicContact CD1-CE2 3.42Å; L214-F251 VanDerWaalsContact CD1-CE2 3.42Å; L214-F251 HydrophobicContact CD1-CZ 3.66Å; V247-F251 HydrophobicContact CB-CD2 4.44Å; V247-F251 HydrophobicContact CG1-CD2 3.78Å; V247-F251 HydrophobicContact CG1-CE2 4.31Å; V247-F251 HydrophobicContact CG1-CG 4.46Å; V247-F251 WeakPolarHBondContact O-CB 3.32Å; V247-F251 VanDerWaalsContact O-CD2 3.32Å; V247-F251 WeakPolarHBondContact O-CD2 3.28Å; V247-F251 PolarHBondContact O-N 2.94Å; F251-C254 PolarHBondContact O-N 3.45Å; F251-I255 WeakPolarHBondContact O-CB 3.32Å; F251-I255 WeakPolarHBondContact O-CG1 3.08Å; F251-I255 PolarHBondContact O-N 3.03Å
252V79.8Confident74.3Confident76 Ų7632.9 Ų32.946%0.46119%0.188SC..Hα-helixtrans-63.9-48.4-179.41730000111.7T248 C254 I255 Y256T248-V252 HydrophobicContact CG2-CG2 3.67Å; T248-V252 VanDerWaalsContact O-CB 3.26Å; T248-V252 WeakPolarHBondContact O-CB 3.41Å; T248-V252 WeakPolarHBondContact O-CG2 3.47Å; T248-V252 PolarHBondContact O-N 3.16Å; V252-C254 PolarHBondContact O-N 3.19Å; V252-I255 PolarHBondContact O-N 3.28Å; V252-Y256 WeakPolarHBondContact O-CB 3.45Å; V252-Y256 PolarHBondContact O-N 3.33Å
253P80.6Confident74.3Confident7 Ų741.3 Ų41.35%0.04522%0.219CC..Hα-helixtrans-59.3-41.8172.3-2938.8000113.9L249 I250 Y256 I257 V271 L274 Y275L249-P253 WeakPolarHBondContact O-CD 3.31Å; L249-P253 WeakPolarHBondContact O-CG 3.47Å; I250-P253 WeakPolarHBondContact O-CD 3.24Å; P253-Y256 WeakPolarHBondContact O-CB 3.45Å; P253-Y256 PolarHBondContact O-N 3.33Å; P253-I257 PolarHBondContact O-N 3.14Å; P253-V271 HydrophobicContact CB-CG1 3.7Å; P253-L274 HydrophobicContact CG-CD2 4.06Å; P253-Y275 HydrophobicContact CB-CD1 4.09Å; P253-Y275 HydrophobicContact CB-CG 4.12Å
254C77.6Confident74.1Confident11 Ų1145.4 Ų45.47%0.07424%0.244CC..Hα-helixtrans-63.7-44178.2-70.30000111.9T207 I250 F251 V252 Y256 I257 Y258T207-C254 HydrophobicContact CG2-CB 3.78Å; I250-C254 PolarHBondContact O-N 2.97Å; I250-C254 PolarHBondContact O-SG 3.44Å; F251-C254 PolarHBondContact O-N 3.45Å; V252-C254 PolarHBondContact O-N 3.19Å; C254-Y256 VanDerWaalsContact C-N 3.32Å; C254-Y256 PolarHBondContact O-N 3.01Å; C254-I257 PolarHBondContact O-N 3.41Å; C254-Y258 HydrophobicContact CB-CD2 4.31Å; C254-Y258 WeakPolarHBondContact O-CB 3.36Å; C254-Y258 VanDerWaalsContact O-CD2 3.24Å; C254-Y258 WeakPolarHBondContact O-CD2 3.36Å; C254-Y258 PolarHBondContact O-N 3.36Å
255I78.2Confident74.1Confident46 Ų4646.5 Ų46.524%0.23625%0.247CC..Hα-helixtrans-61.8-43.8174.9-68166.8000109.8T207 F211 F251 V252 I257 A259T207-I255 HydrophobicContact CG2-CD1 4.45Å; T207-I255 HydrophobicContact CG2-CG1 3.63Å; F211-I255 HydrophobicContact CB-CD1 4.23Å; F211-I255 HydrophobicContact CD1-CD1 4.27Å; F211-I255 HydrophobicContact CG-CD1 4.11Å; F251-I255 WeakPolarHBondContact O-CB 3.32Å; F251-I255 WeakPolarHBondContact O-CG1 3.08Å; F251-I255 PolarHBondContact O-N 3.03Å; V252-I255 PolarHBondContact O-N 3.28Å; I255-I257 VanDerWaalsContact C-N 3.33Å; I255-I257 PolarHBondContact O-N 3.24Å; I255-A259 HydrophobicContact CG2-CB 3.92Å; I255-A259 WeakPolarHBondContact O-CA 2.94Å; I255-A259 WeakPolarHBondContact O-CB 3.1Å; I255-A259 PolarHBondContact O-N 3.02Å
256Y79.9Confident73.9Confident86 Ų8650.7 Ų50.734%0.33727%0.271SS..Hα-helixtrans-56.8-46.7177.4-178.1-92.6000111.5V252 P253 C254 R260 V271V252-Y256 WeakPolarHBondContact O-CB 3.45Å; V252-Y256 PolarHBondContact O-N 3.33Å; P253-Y256 WeakPolarHBondContact O-CB 3.45Å; P253-Y256 PolarHBondContact O-N 3.33Å; C254-Y256 VanDerWaalsContact C-N 3.32Å; C254-Y256 PolarHBondContact O-N 3.01Å; Y256-R260 WeakPolarHBondContact O-CD 3.39Å; Y256-R260 VanDerWaalsContact O-CG 3.31Å; Y256-R260 WeakPolarHBondContact O-CG 3.47Å; Y256-R260 PolarHBondContact OH-NH1 3.01Å; Y256-V271 HydrophobicContact CD1-CB 4.28Å; Y256-V271 HydrophobicContact CD1-CG1 4Å; Y256-V271 HydrophobicContact CD1-CG2 3.88Å; Y256-V271 HydrophobicContact CE1-CG2 3.88Å
257I74.6Confident74.1Confident16 Ų1656.2 Ų56.28%0.08230%0.298CS..Hα-helixtrans-75.8-40.9-176.7-69.2174.1000112.4P182 P253 C254 I255 V271 Y275P182-I257 HydrophobicContact CG-CG2 4.35Å; P253-I257 PolarHBondContact O-N 3.14Å; C254-I257 PolarHBondContact O-N 3.41Å; I255-I257 VanDerWaalsContact C-N 3.33Å; I255-I257 PolarHBondContact O-N 3.24Å; I257-V271 HydrophobicContact CD1-CB 4.46Å; I257-V271 HydrophobicContact CD1-CG1 3.83Å; I257-V271 HydrophobicContact CG1-CG1 4.02Å; I257-Y275 HydrophobicContact CD1-CD1 3.89Å; I257-Y275 HydrophobicContact CD1-CE1 3.23Å
258Y73.6Confident74.4Confident13 Ų1357.4 Ų57.45%0.05130%0.304CS..Hα-helixtrans-103.4-11-167-62.1-64.8000115.3D180 P182 N203 C254D180-Y258 PolarHBondContact OD1-OH 3.39Å; D180-Y258 PolarHBondContact OD2-OH 3.33Å; P182-Y258 HydrophobicContact CG-CD1 4.35Å; P182-Y258 HydrophobicContact CG-CE1 4.04Å; N203-Y258 HydrophobicContact CB-CD1 4Å; N203-Y258 HydrophobicContact CB-CD2 4.46Å; N203-Y258 HydrophobicContact CB-CG 3.81Å; C254-Y258 HydrophobicContact CB-CD2 4.31Å; C254-Y258 WeakPolarHBondContact O-CB 3.36Å; C254-Y258 VanDerWaalsContact O-CD2 3.24Å; C254-Y258 WeakPolarHBondContact O-CD2 3.36Å; C254-Y258 PolarHBondContact O-N 3.36Å
259A72.6Confident74.7Confident57 Ų5756.8 Ų56.847%0.47130%0.296SS..SBendtrans-97.46177.800000113.7I255I255-A259 HydrophobicContact CG2-CB 3.92Å; I255-A259 WeakPolarHBondContact O-CA 2.94Å; I255-A259 WeakPolarHBondContact O-CB 3.1Å; I255-A259 PolarHBondContact O-N 3.02Å
260R73.6Confident74.9Confident46 Ų4657 Ų5717%0.17431%0.306CS..SBendtrans-115.2156.717969.5-170.5-63.2-18030.8110.9Y256 D268Y256-R260 WeakPolarHBondContact O-CD 3.39Å; Y256-R260 VanDerWaalsContact O-CG 3.31Å; Y256-R260 WeakPolarHBondContact O-CG 3.47Å; Y256-R260 PolarHBondContact OH-NH1 3.01Å; R260-D268 IonicContact NH1-OD1 3.08Å; R260-D268 PolarHBondContact NH1-OD1 2.86Å; R260-D268 VanDerWaalsContact NH1-OD1 3.08Å
261P67.9Low75.2Confident84 Ų8457.5 Ų57.555%0.54531%0.309SS..  trans-55.6142.6167.9-20.431.5000110.2R263P261-R263 PolarHBondContact O-N 2.92Å
262F70.4Confident75.7Confident10 Ų1057.5 Ų57.54%0.04431%0.31CS..SBendtrans-74.460.6-175.2-58.8-31.1000112.1P182 I185 K186 E196 M199 V200P182-F262 HydrophobicContact CB-CB 4.19Å; P182-F262 HydrophobicContact CB-CD1 3.67Å; P182-F262 HydrophobicContact CB-CD2 4.42Å; P182-F262 HydrophobicContact CB-CE1 4.14Å; P182-F262 HydrophobicContact CB-CG 3.85Å; P182-F262 HydrophobicContact CG-CD1 3.92Å; P182-F262 HydrophobicContact CG-CE1 3.87Å; P182-F262 HydrophobicContact CG-CG 4.45Å; P182-F262 HydrophobicContact CG-CZ 4.36Å; I185-F262 HydrophobicContact CB-CD2 4.44Å; I185-F262 HydrophobicContact CD1-CD2 3.72Å; I185-F262 HydrophobicContact CD1-CE2 3.59Å; I185-F262 HydrophobicContact CG2-CD2 4.26Å; K186-F262 WeakPolarHBondContact CE-O 3.36Å; E196-F262 HydrophobicContact CB-CD2 4.1Å; E196-F262 HydrophobicContact CB-CE2 4.19Å; E196-F262 HydrophobicContact CG-CD2 3.68Å; E196-F262 HydrophobicContact CG-CE2 4.16Å; M199-F262 HydrophobicContact CB-CE2 4.02Å; M199-F262 HydrophobicContact CB-CZ 3.88Å; M199-F262 HydrophobicContact SD-CE2 4.26Å; V200-F262 HydrophobicContact CG2-CE1 3.85Å; V200-F262 HydrophobicContact CG2-CZ 3.85Å
263R68.9Low75.8Confident186 Ų18654.9 Ų54.970%0.70229%0.294SS*.  trans-92.2152.1167.5-60.6-171.4178.6-166.1-0.5109.6K186 P261 F265K186-R263 VanDerWaalsContact NZ-C 3.33Å; K186-R263 PolarHBondContact NZ-O 3.07Å; P261-R263 PolarHBondContact O-N 2.92Å; R263-F265 HydrophobicContact CB-CD2 4.3Å; R263-F265 HydrophobicContact CB-CE2 3.56Å; R263-F265 HydrophobicContact CB-CZ 4.05Å; R263-F265 WeakPolarHBondContact O-CD2 3.24Å
264T67.4Low75.8Confident86 Ų8657.8 Ų57.853%0.52831%0.309SS..  trans-74.7132.4173.137.90000109.3K186K186-T264 HydrophobicContact CD-CG2 4.13Å; K186-T264 VanDerWaalsContact NZ-N 3.16Å
265F72.4Confident75.9Confident78 Ų7857.7 Ų57.734%0.34231%0.307SS..  trans-126.3149.1171.1-66.1-96.5000111.2R263 M267 D268R263-F265 HydrophobicContact CB-CD2 4.3Å; R263-F265 HydrophobicContact CB-CE2 3.56Å; R263-F265 HydrophobicContact CB-CZ 4.05Å; R263-F265 WeakPolarHBondContact O-CD2 3.24Å; F265-M267 PolarHBondContact O-N 3.28Å; F265-D268 PolarHBondContact N-OD2 3.16Å; F265-D268 WeakPolarHBondContact O-CB 3.09Å; F265-D268 PolarHBondContact O-N 3.49Å
266P70.6Confident76.2Confident129 Ų12955.5 Ų55.584%0.83830%0.296SS*.THydrogen-bonded Turntrans-57.8-27-174.9-24.132.7000114
267M76.7Confident76.3Confident116 Ų11651.6 Ų51.657%0.57128%0.28SS*.THydrogen-bonded Turntrans-88.8-8.2-177.5-67.2-60.3-172.400114F265 K269 A270 V271F265-M267 PolarHBondContact O-N 3.28Å; M267-K269 VanDerWaalsContact C-N 3.31Å; M267-K269 PolarHBondContact O-N 2.87Å; M267-A270 PolarHBondContact O-N 2.81Å; M267-V271 HydrophobicContact CB-CG2 4.45Å; M267-V271 WeakPolarHBondContact O-CG2 3.38Å; M267-V271 PolarHBondContact O-N 2.86Å
268D78.9Confident76.8Confident31 Ų3152.4 Ų52.417%0.16629%0.286CS..Hα-helixtrans-59.1-42.1-172.6-69-17.6000111.6R260 F265 A270 V271 S272R260-D268 IonicContact NH1-OD1 3.08Å; R260-D268 PolarHBondContact NH1-OD1 2.86Å; R260-D268 VanDerWaalsContact NH1-OD1 3.08Å; F265-D268 PolarHBondContact N-OD2 3.16Å; F265-D268 WeakPolarHBondContact O-CB 3.09Å; F265-D268 PolarHBondContact O-N 3.49Å; D268-A270 PolarHBondContact O-N 2.68Å; D268-V271 PolarHBondContact O-N 3.33Å; D268-S272 WeakPolarHBondContact O-CB 3.15Å; D268-S272 PolarHBondContact O-N 2.98Å; D268-S272 PolarHBondContact O-OG 2.65Å
269K81.3Confident77.2Confident47 Ų4751.9 Ų51.920%0.20428%0.284CS..Hα-helixtrans-63-41.9175-67.6-174.2-175.8-178.30112.9G16 D175 M267 S272 V273G16-K269 WeakPolarHBondContact O-CE 3.22Å; G16-K269 PolarHBondContact O-NZ 2.99Å; D175-K269 WeakPolarHBondContact O-CE 3.49Å; D175-K269 WeakPolarHBondContact OD1-CE 3.31Å; D175-K269 IonicContact OD1-NZ 3.51Å; D175-K269 PolarHBondContact OD1-NZ 3.02Å; M267-K269 VanDerWaalsContact C-N 3.31Å; M267-K269 PolarHBondContact O-N 2.87Å; K269-S272 WeakPolarHBondContact O-CB 3.12Å; K269-S272 PolarHBondContact O-N 3.39Å; K269-V273 WeakPolarHBondContact O-CG2 3.46Å; K269-V273 PolarHBondContact O-N 3.4Å
270A80.2Confident77.6Confident58 Ų5849.2 Ų49.248%0.47926%0.262SS..Hα-helixtrans-67.4-41.9179.700000111.2M267 D268 S272 V273 L274M267-A270 PolarHBondContact O-N 2.81Å; D268-A270 PolarHBondContact O-N 2.68Å; A270-S272 VanDerWaalsContact C-N 3.35Å; A270-V273 PolarHBondContact O-N 2.94Å; A270-L274 PolarHBondContact O-N 2.89Å
271V80.3Confident78.2Confident23 Ų2349.4 Ų49.414%0.13927%0.265CS..Hα-helixtrans-63.4-44.3173.7178.60000109.6P253 Y256 I257 M267 D268 V273 L274 Y275P253-V271 HydrophobicContact CB-CG1 3.7Å; Y256-V271 HydrophobicContact CD1-CB 4.28Å; Y256-V271 HydrophobicContact CD1-CG1 4Å; Y256-V271 HydrophobicContact CD1-CG2 3.88Å; Y256-V271 HydrophobicContact CE1-CG2 3.88Å; I257-V271 HydrophobicContact CD1-CB 4.46Å; I257-V271 HydrophobicContact CD1-CG1 3.83Å; I257-V271 HydrophobicContact CG1-CG1 4.02Å; M267-V271 HydrophobicContact CB-CG2 4.45Å; M267-V271 WeakPolarHBondContact O-CG2 3.38Å; M267-V271 PolarHBondContact O-N 2.86Å; D268-V271 PolarHBondContact O-N 3.33Å; V271-V273 PolarHBondContact O-N 3.16Å; V271-L274 VanDerWaalsContact O-CB 3.31Å; V271-L274 WeakPolarHBondContact O-CB 3.05Å; V271-L274 PolarHBondContact O-N 3.21Å; V271-Y275 WeakPolarHBondContact O-CD1 3.3Å; V271-Y275 PolarHBondContact O-N 3.09Å; V271-Y275 VanDerWaalsContact O-N 3.07Å
272S83.5Confident78.8Confident2 Ų248.1 Ų48.11%0.01425%0.254CS..Hα-helixtrans-53.8-49.2173.3-75.70000113.6N176 Y178 D268 K269 A270 L274 Y275 T276N176-S272 PolarHBondContact ND2-OG 2.94Å; Y178-S272 WeakPolarHBondContact CE1-OG 3.4Å; Y178-S272 PolarHBondContact OH-OG 2.9Å; D268-S272 WeakPolarHBondContact O-CB 3.15Å; D268-S272 PolarHBondContact O-N 2.98Å; D268-S272 PolarHBondContact O-OG 2.65Å; K269-S272 WeakPolarHBondContact O-CB 3.12Å; K269-S272 PolarHBondContact O-N 3.39Å; A270-S272 VanDerWaalsContact C-N 3.35Å; S272-L274 VanDerWaalsContact C-N 3.29Å; S272-L274 PolarHBondContact O-N 3.16Å; S272-Y275 VanDerWaalsContact CA-CE1 3.43Å; S272-Y275 PolarHBondContact O-N 3.48Å; S272-T276 WeakPolarHBondContact O-CB 3.06Å; S272-T276 WeakPolarHBondContact O-CG2 3.31Å; S272-T276 PolarHBondContact O-N 3.26Å; S272-T276 PolarHBondContact O-OG1 2.83Å
273V82.1Confident79.1Confident20 Ų2047.7 Ų47.712%0.12125%0.252CS..Hα-helixtrans-58.8-43174.8166.40000111.4L17 F31 F177 K269 A270 V271 I277 V278L17-V273 HydrophobicContact CD1-CG2 4.4Å; L17-V273 HydrophobicContact CD2-CG2 3.88Å; F31-V273 HydrophobicContact CE1-CG1 3.51Å; F31-V273 HydrophobicContact CE1-CG2 4.31Å; F31-V273 HydrophobicContact CZ-CG1 3.84Å; F31-V273 HydrophobicContact CZ-CG2 4.12Å; F177-V273 HydrophobicContact CE1-CG2 3.74Å; F177-V273 HydrophobicContact CZ-CG2 4.1Å; K269-V273 WeakPolarHBondContact O-CG2 3.46Å; K269-V273 PolarHBondContact O-N 3.4Å; A270-V273 PolarHBondContact O-N 2.94Å; V271-V273 PolarHBondContact O-N 3.16Å; V273-I277 WeakPolarHBondContact O-CB 3.47Å; V273-I277 PolarHBondContact O-N 3.49Å; V273-V278 HydrophobicContact CG1-CG2 4.27Å; V273-V278 PolarHBondContact O-N 3.23Å
274L81.4Confident79.4Confident69 Ų6939.5 Ų39.536%0.36122%0.223SC..Iπ-helixtrans-58.2-52.9-179.2-175.969.1000111.4P253 A270 V271 S272 V278 T279P253-L274 HydrophobicContact CG-CD2 4.06Å; A270-L274 PolarHBondContact O-N 2.89Å; V271-L274 VanDerWaalsContact O-CB 3.31Å; V271-L274 WeakPolarHBondContact O-CB 3.05Å; V271-L274 PolarHBondContact O-N 3.21Å; S272-L274 VanDerWaalsContact C-N 3.29Å; S272-L274 PolarHBondContact O-N 3.16Å; L274-V278 HydrophobicContact CD1-CB 4.08Å; L274-V278 HydrophobicContact CD1-CG1 4.09Å; L274-V278 HydrophobicContact CD1-CG2 4.49Å; L274-V278 WeakPolarHBondContact O-CB 3.21Å; L274-V278 PolarHBondContact O-N 2.71Å; L274-T279 PolarHBondContact O-N 2.99Å; L274-T279 PolarHBondContact O-OG1 2.81Å; L274-T279 VanDerWaalsContact O-OG1 3.09Å
275Y79.5Confident79.6Confident9 Ų937.2 Ų37.24%0.03521%0.213CC..Iπ-helixtrans-84.4-25.5-173.284.8-93.2000114.4Y73 F104 Y178 P253 I257 V271 S272Y73-Y275 HydrophobicContact CE1-CD2 4.47Å; Y73-Y275 VanDerWaalsContact OH-CE2 3.22Å; Y73-Y275 WeakPolarHBondContact OH-CE2 3.3Å; F104-Y275 HydrophobicContact CE1-CE2 4.5Å; F104-Y275 HydrophobicContact CE2-CE2 4.47Å; F104-Y275 AromaticContact CZ-CE2 3.67Å; F104-Y275 HydrophobicContact CZ-CE2 3.67Å; F104-Y275 AromaticContact CZ-CZ 3.85Å; F104-Y275 VanDerWaalsContact CZ-OH 3.27Å; F104-Y275 WeakPolarHBondContact CZ-OH 2.85Å; Y178-Y275 PolarHBondContact OH-OH 3.49Å; P253-Y275 HydrophobicContact CB-CD1 4.09Å; P253-Y275 HydrophobicContact CB-CG 4.12Å; I257-Y275 HydrophobicContact CD1-CD1 3.89Å; I257-Y275 HydrophobicContact CD1-CE1 3.23Å; V271-Y275 WeakPolarHBondContact O-CD1 3.3Å; V271-Y275 PolarHBondContact O-N 3.09Å; V271-Y275 VanDerWaalsContact O-N 3.07Å; S272-Y275 VanDerWaalsContact CA-CE1 3.43Å; S272-Y275 PolarHBondContact O-N 3.48Å
276T83.5Confident79.6Confident0 Ų034.9 Ų34.90%020%0.204CC..Iπ-helixtrans-89.3-26.8-179.462.70000113.8Y73 F104 S272Y73-T276 HydrophobicContact CE1-CG2 4.26Å; F104-T276 HydrophobicContact CE2-CG2 3.79Å; F104-T276 HydrophobicContact CZ-CG2 3.98Å; S272-T276 WeakPolarHBondContact O-CB 3.06Å; S272-T276 WeakPolarHBondContact O-CG2 3.31Å; S272-T276 PolarHBondContact O-N 3.26Å; S272-T276 PolarHBondContact O-OG1 2.83Å
277I83.9Confident79.3Confident3 Ų329.3 Ų29.32%0.01517%0.166CC..Iπ-helixtrans-121.1-53.8-175.6-54.7-169.6000112F31 M34 M81 V273 P280 M281F31-I277 HydrophobicContact CD1-CD1 3.71Å; F31-I277 HydrophobicContact CD1-CG2 4.17Å; F31-I277 HydrophobicContact CE1-CD1 4.11Å; F31-I277 HydrophobicContact CG-CD1 4.49Å; M34-I277 HydrophobicContact CB-CG2 4.07Å; M34-I277 HydrophobicContact CE-CG2 4.06Å; M81-I277 HydrophobicContact CE-CD1 3.2Å; M81-I277 HydrophobicContact SD-CD1 3.7Å; V273-I277 WeakPolarHBondContact O-CB 3.47Å; V273-I277 PolarHBondContact O-N 3.49Å; I277-P280 WeakPolarHBondContact O-CD 3.13Å; I277-M281 WeakPolarHBondContact O-CB 3.38Å; I277-M281 PolarHBondContact O-N 3.38Å
278V83.8Confident78.7Confident34 Ų3424.3 Ų24.321%0.20614%0.142CC..Iπ-helixtrans-68.4-44.5-173.1-179.50000110.9V273 L274 M281 L282V273-V278 HydrophobicContact CG1-CG2 4.27Å; V273-V278 PolarHBondContact O-N 3.23Å; L274-V278 HydrophobicContact CD1-CB 4.08Å; L274-V278 HydrophobicContact CD1-CG1 4.09Å; L274-V278 HydrophobicContact CD1-CG2 4.49Å; L274-V278 WeakPolarHBondContact O-CB 3.21Å; L274-V278 PolarHBondContact O-N 2.71Å; V278-M281 WeakPolarHBondContact O-CB 3.4Å; V278-M281 PolarHBondContact O-N 3.14Å; V278-L282 HydrophobicContact CG1-CD1 3.79Å; V278-L282 HydrophobicContact CG1-CG 4.23Å; V278-L282 WeakPolarHBondContact O-CG 3.36Å; V278-L282 PolarHBondContact O-N 3Å
279T81.8Confident77.6Confident2 Ų228.4 Ų28.41%0.01216%0.163CC..Hα-helixtrans-63.3-48.9-178-60.20000113.2L249 I250 L274 M281 L282 N283L249-T279 HydrophobicContact CB-CG2 4.03Å; L249-T279 PolarHBondContact O-OG1 3.01Å; I250-T279 HydrophobicContact CD1-CG2 4.1Å; I250-T279 HydrophobicContact CG1-CG2 3.38Å; L274-T279 PolarHBondContact O-N 2.99Å; L274-T279 PolarHBondContact O-OG1 2.81Å; L274-T279 VanDerWaalsContact O-OG1 3.09Å; T279-M281 VanDerWaalsContact C-N 3.27Å; T279-M281 PolarHBondContact O-N 3.32Å; T279-L282 PolarHBondContact O-N 2.79Å; T279-L282 VanDerWaalsContact O-N 3.17Å; T279-N283 PolarHBondContact O-N 2.81Å; T279-N283 VanDerWaalsContact O-N 3.12Å
280P82.3Confident76.4Confident0 Ų034.9 Ų34.90%019%0.186CC..Hα-helixtrans-58.9-34.2173.3-27.637.2000114.2T38 N42 D70 Y73 I277 P284T38-P280 HydrophobicContact CG2-CB 3.81Å; N42-P280 PolarHBondContact ND2-O 3.36Å; D70-P280 HydrophobicContact CB-CB 4.12Å; Y73-P280 HydrophobicContact CD1-CG 4.28Å; I277-P280 WeakPolarHBondContact O-CD 3.13Å; P280-P284 VanDerWaalsContact O-CD 3.28Å; P280-P284 WeakPolarHBondContact O-CD 3.32Å
281M85Confident75.6Confident50 Ų5033.3 Ų33.325%0.24617%0.17CC..Hα-helixtrans-67.3-38.9176.1-174.1-157.369.300112M34 M37 T38 I277 V278 T279 N283 P284M34-M281 HydrophobicContact CB-SD 3.82Å; M34-M281 HydrophobicContact CG-SD 3.54Å; M34-M281 VanDerWaalsContact CG-SD 3.54Å; M34-M281 HydrophobicContact SD-SD 4.01Å; M37-M281 HydrophobicContact CB-CG 4.27Å; T38-M281 VanDerWaalsContact OG1-CA 3.29Å; T38-M281 WeakPolarHBondContact OG1-CA 3.47Å; T38-M281 VanDerWaalsContact OG1-CB 3.3Å; T38-M281 WeakPolarHBondContact OG1-CB 3.38Å; I277-M281 WeakPolarHBondContact O-CB 3.38Å; I277-M281 PolarHBondContact O-N 3.38Å; V278-M281 WeakPolarHBondContact O-CB 3.4Å; V278-M281 PolarHBondContact O-N 3.14Å; T279-M281 VanDerWaalsContact C-N 3.27Å; T279-M281 PolarHBondContact O-N 3.32Å; M281-N283 VanDerWaalsContact C-N 3.35Å; M281-P284 WeakPolarHBondContact O-CD 3.21Å
282L80.2Confident74.8Confident57 Ų5740.2 Ų40.230%0.29820%0.198SC..Hα-helixtrans-75.8-22.5-180-68.5175.1000112.7L249 V278 T279 A285 I286L249-L282 HydrophobicContact CD1-CD1 4.28Å; V278-L282 HydrophobicContact CG1-CD1 3.79Å; V278-L282 HydrophobicContact CG1-CG 4.23Å; V278-L282 WeakPolarHBondContact O-CG 3.36Å; V278-L282 PolarHBondContact O-N 3Å; T279-L282 PolarHBondContact O-N 2.79Å; T279-L282 VanDerWaalsContact O-N 3.17Å; L282-A285 WeakPolarHBondContact O-CB 3.48Å; L282-A285 PolarHBondContact O-N 3.12Å; L282-I286 HydrophobicContact CB-CD1 3.85Å; L282-I286 HydrophobicContact CB-CG1 4.44Å; L282-I286 VanDerWaalsContact O-CG1 3.28Å; L282-I286 WeakPolarHBondContact O-CG1 2.77Å; L282-I286 PolarHBondContact O-N 3.44Å
283N78.4Confident73.7Confident2 Ų245 Ų451%0.01122%0.22CC..Hα-helixtrans-56-47.7-175.4-108.2-2.7000113.9D70 V246 T279 M281 A285 I286 Y287D70-N283 PolarHBondContact OD2-ND2 3.17Å; V246-N283 WeakPolarHBondContact CG1-OD1 3.33Å; V246-N283 VanDerWaalsContact CG2-OD1 3.24Å; V246-N283 WeakPolarHBondContact CG2-OD1 3.32Å; T279-N283 PolarHBondContact O-N 2.81Å; T279-N283 VanDerWaalsContact O-N 3.12Å; M281-N283 VanDerWaalsContact C-N 3.35Å; N283-A285 VanDerWaalsContact C-N 3.33Å; N283-A285 PolarHBondContact O-N 3.06Å; N283-I286 PolarHBondContact O-N 2.99Å; N283-Y287 WeakPolarHBondContact O-CD2 3.16Å; N283-Y287 PolarHBondContact O-N 3.21Å; N283-Y287 WeakPolarHBondContact OD1-CE2 3.31Å
284P74.1Confident72.7Confident13 Ų1344.2 Ų44.28%0.08422%0.215CC..Hα-helixtrans-54.8-45.9172-29.435.6000113I45 P280 M281 I286 T288I45-P284 HydrophobicContact CD1-CB 3.81Å; I45-P284 HydrophobicContact CD1-CG 4.03Å; P280-P284 VanDerWaalsContact O-CD 3.28Å; P280-P284 WeakPolarHBondContact O-CD 3.32Å; M281-P284 WeakPolarHBondContact O-CD 3.21Å; P284-I286 VanDerWaalsContact C-N 3.34Å; P284-I286 PolarHBondContact O-N 3.33Å; P284-T288 WeakPolarHBondContact O-CA 3.23Å; P284-T288 VanDerWaalsContact O-CB 3.25Å; P284-T288 WeakPolarHBondContact O-CB 3.08Å; P284-T288 WeakPolarHBondContact O-CG2 3.45Å; P284-T288 PolarHBondContact O-N 2.86Å; P284-T288 PolarHBondContact O-OG1 3.41Å
285A72Confident72Confident39 Ų3943.4 Ų43.432%0.32221%0.211SC..Hα-helixtrans-64.1-39.7179.400000112.3L282 N283 L289L282-A285 WeakPolarHBondContact O-CB 3.48Å; L282-A285 PolarHBondContact O-N 3.12Å; N283-A285 VanDerWaalsContact C-N 3.33Å; N283-A285 PolarHBondContact O-N 3.06Å; A285-L289 HydrophobicContact CB-CD1 3.77Å; A285-L289 WeakPolarHBondContact O-CB 3.18Å; A285-L289 PolarHBondContact O-N 3.45Å
286I71.6Confident71.6Confident29 Ų2948.6 Ų48.615%0.14924%0.237CC..Hα-helixtrans-72.2-40.4-177.5-61.8163.9000111.4S242 V246 L249 L282 N283 P284S242-I286 WeakPolarHBondContact O-CG2 2.89Å; V246-I286 HydrophobicContact CG2-CB 3.91Å; V246-I286 HydrophobicContact CG2-CD1 3.69Å; V246-I286 HydrophobicContact CG2-CG1 4.39Å; V246-I286 HydrophobicContact CG2-CG2 3.48Å; V246-I286 VanDerWaalsContact CG2-CG2 3.48Å; L249-I286 HydrophobicContact CD1-CD1 4Å; L282-I286 HydrophobicContact CB-CD1 3.85Å; L282-I286 HydrophobicContact CB-CG1 4.44Å; L282-I286 VanDerWaalsContact O-CG1 3.28Å; L282-I286 WeakPolarHBondContact O-CG1 2.77Å; L282-I286 PolarHBondContact O-N 3.44Å; N283-I286 PolarHBondContact O-N 2.99Å; P284-I286 VanDerWaalsContact C-N 3.34Å; P284-I286 PolarHBondContact O-N 3.33Å
287Y65.9Low70.9Confident12 Ų1249 Ų495%0.04724%0.24CC..Hα-helixtrans-89.6-30.7-177.8-74.7-68.3000114.9L63 L66 M118 H243 V246 N283 N291L63-Y287 HydrophobicContact CD1-CD1 3.96Å; L63-Y287 HydrophobicContact CD1-CD2 3.78Å; L63-Y287 HydrophobicContact CD1-CE2 4.42Å; L63-Y287 HydrophobicContact CD1-CG 3.52Å; L66-Y287 HydrophobicContact CD2-CD2 4.41Å; L66-Y287 HydrophobicContact CD2-CE2 3.65Å; M118-Y287 HydrophobicContact CE-CE1 4.16Å; H243-Y287 PolarHBondContact CD2-OH 2.81Å; H243-Y287 VanDerWaalsContact CD2-OH 3.29Å; V246-Y287 HydrophobicContact CB-CE2 4.26Å; V246-Y287 HydrophobicContact CG1-CE2 4.02Å; V246-Y287 HydrophobicContact CG2-CD2 4.36Å; V246-Y287 HydrophobicContact CG2-CE2 3.68Å; N283-Y287 WeakPolarHBondContact O-CD2 3.16Å; N283-Y287 PolarHBondContact O-N 3.21Å; N283-Y287 WeakPolarHBondContact OD1-CE2 3.31Å; Y287-N291 WeakPolarHBondContact O-CB 3.41Å
288T63.9Low70.3Confident10 Ų1051.2 Ų51.26%0.06125%0.251CS..THydrogen-bonded Turntrans-102-47.5-17369.90000114.5I45 P284 R290 N291 V294I45-T288 HydrophobicContact CD1-CG2 3.37Å; I45-T288 HydrophobicContact CG1-CG2 3.49Å; I45-T288 VanDerWaalsContact CG1-CG2 3.49Å; P284-T288 WeakPolarHBondContact O-CA 3.23Å; P284-T288 VanDerWaalsContact O-CB 3.25Å; P284-T288 WeakPolarHBondContact O-CB 3.08Å; P284-T288 WeakPolarHBondContact O-CG2 3.45Å; P284-T288 PolarHBondContact O-N 2.86Å; P284-T288 PolarHBondContact O-OG1 3.41Å; T288-R290 PolarHBondContact O-N 3.01Å; T288-N291 PolarHBondContact O-N 2.82Å; T288-V294 HydrophobicContact CG2-CG1 3.79Å
289L54.7Low69.9Low118 Ų11855.2 Ų55.262%0.61827%0.266SS*.THydrogen-bonded Turntrans-66.8-14.6-174.2-65.8174.8000113.1A285 I295A285-L289 HydrophobicContact CB-CD1 3.77Å; A285-L289 WeakPolarHBondContact O-CB 3.18Å; A285-L289 PolarHBondContact O-N 3.45Å; L289-I295 WeakPolarHBondContact O-CD1 3.23Å
290R55.6Low69.6Low182 Ų18258.2 Ų58.269%0.68728%0.278SS*.THydrogen-bonded Turntrans-102.1-11.3174.2-69.1-173.1170.5-157.8-1.6113.8T288T288-R290 PolarHBondContact O-N 3.01Å
291N63.5Low69.1Low25 Ų2560.9 Ų60.913%0.13429%0.292CS..  trans-97.7110.4-178.4-168.4-30000111Y60 Y287 T288 E293 V294 I295Y60-N291 PolarHBondContact OH-ND2 3.02Å; Y60-N291 PolarHBondContact OH-OD1 2.98Å; Y287-N291 WeakPolarHBondContact O-CB 3.41Å; T288-N291 PolarHBondContact O-N 2.82Å; N291-E293 PolarHBondContact O-N 3.08Å; N291-E293 WeakPolarHBondContact OD1-CB 3.47Å; N291-E293 PolarHBondContact OD1-N 3.48Å; N291-V294 HydrophobicContact CB-CB 4.3Å; N291-V294 HydrophobicContact CB-CG2 4.05Å; N291-V294 PolarHBondContact O-N 3.23Å; N291-I295 WeakPolarHBondContact O-CG1 3.48Å; N291-I295 PolarHBondContact O-N 3.22Å
292K63.5Low68.7Low169 Ų16966.9 Ų66.974%0.73531%0.312SS*.Hα-helixtrans-58.3-35.2-179.1-67.7-175.7179.3-178.90112.4I295 M296K292-I295 PolarHBondContact O-N 2.86Å; K292-M296 WeakPolarHBondContact O-CB 3.22Å; K292-M296 VanDerWaalsContact O-CG 3.24Å; K292-M296 WeakPolarHBondContact O-CG 3.31Å; K292-M296 PolarHBondContact O-N 3.2Å
293E60.6Low68.4Low102 Ų10271.8 Ų71.848%0.47733%0.327SS..Hα-helixtrans-69.3-43.4-178.4-61.3-178.916700111.3L55 Y60 N291 M296 A297L55-E293 HydrophobicContact CD2-CB 4.26Å; Y60-E293 WeakPolarHBondContact CE2-OE2 3.39Å; Y60-E293 WeakPolarHBondContact OH-CB 3.41Å; Y60-E293 PolarHBondContact OH-OE2 3.07Å; N291-E293 PolarHBondContact O-N 3.08Å; N291-E293 WeakPolarHBondContact OD1-CB 3.47Å; N291-E293 PolarHBondContact OD1-N 3.48Å; E293-M296 HydrophobicContact CG-CE 4.41Å; E293-M296 PolarHBondContact O-N 3.4Å; E293-A297 WeakPolarHBondContact O-CB 3.25Å; E293-A297 PolarHBondContact O-N 3.25Å
294V62Low68.1Low3 Ų378.4 Ų78.42%0.01835%0.352CS..Hα-helixtrans-65.6-42.7175.3-177.10000110.9Y60 T288 N291 M296 A297 M298Y60-V294 HydrophobicContact CD1-CG2 4.32Å; Y60-V294 HydrophobicContact CE1-CG2 3.6Å; T288-V294 HydrophobicContact CG2-CG1 3.79Å; N291-V294 HydrophobicContact CB-CB 4.3Å; N291-V294 HydrophobicContact CB-CG2 4.05Å; N291-V294 PolarHBondContact O-N 3.23Å; V294-M296 VanDerWaalsContact C-N 3.31Å; V294-M296 PolarHBondContact O-N 3.07Å; V294-A297 PolarHBondContact O-N 3.14Å; V294-M298 HydrophobicContact CG1-CG 4.45Å; V294-M298 HydrophobicContact CG1-SD 4.42Å; V294-M298 WeakPolarHBondContact O-CB 3.39Å; V294-M298 VanDerWaalsContact O-CG 3.28Å; V294-M298 WeakPolarHBondContact O-CG 3.38Å; V294-M298 PolarHBondContact O-N 3.47Å
295I66.9Low67.7Low52 Ų5283.9 Ų83.927%0.26737%0.374SS..Hα-helixtrans-60.7-40.6175.6-68.9162.3000111.4L289 N291 K292 M298 K299L289-I295 WeakPolarHBondContact O-CD1 3.23Å; N291-I295 WeakPolarHBondContact O-CG1 3.48Å; N291-I295 PolarHBondContact O-N 3.22Å; K292-I295 PolarHBondContact O-N 2.86Å; I295-M298 WeakPolarHBondContact O-CB 3.33Å; I295-M298 PolarHBondContact O-N 3.25Å; I295-K299 HydrophobicContact CG2-CD 4.49Å; I295-K299 WeakPolarHBondContact O-CG 3.14Å; I295-K299 PolarHBondContact O-N 2.9Å
296M70.2Confident67.4Low119 Ų11989.4 Ų89.459%0.58639%0.391SS*.Hα-helixtrans-66.6-43.2177.1-75.5-173.7-59.600111.7K292 E293 V294 K299 K300K292-M296 WeakPolarHBondContact O-CB 3.22Å; K292-M296 VanDerWaalsContact O-CG 3.24Å; K292-M296 WeakPolarHBondContact O-CG 3.31Å; K292-M296 PolarHBondContact O-N 3.2Å; E293-M296 HydrophobicContact CG-CE 4.41Å; E293-M296 PolarHBondContact O-N 3.4Å; V294-M296 VanDerWaalsContact C-N 3.31Å; V294-M296 PolarHBondContact O-N 3.07Å; M296-K299 PolarHBondContact O-N 2.81Å; M296-K300 PolarHBondContact O-N 3.28Å
297A69.1Low67Low8 Ų893.9 Ų93.97%0.06642%0.415CS..Hα-helixtrans-62.3-41.7174.900000111.9I48 L55 E293 V294 K299 K300 L301I48-A297 HydrophobicContact CG2-CB 3.76Å; L55-A297 HydrophobicContact CD1-CB 3.66Å; E293-A297 WeakPolarHBondContact O-CB 3.25Å; E293-A297 PolarHBondContact O-N 3.25Å; V294-A297 PolarHBondContact O-N 3.14Å; A297-K299 PolarHBondContact O-N 3.46Å; A297-K300 WeakPolarHBondContact O-CB 3.38Å; A297-K300 PolarHBondContact O-N 2.68Å; A297-L301 PolarHBondContact O-N 2.81Å
298M72.1Confident66.5Low49 Ų49100.6 Ų100.624%0.24145%0.451CS..Hα-helixtrans-56-50.2172.2-74.6176.680.800111.6L44 I48 V294 I295 K300 L301 W302L44-M298 HydrophobicContact CD2-CE 3.86Å; I48-M298 HydrophobicContact CD1-CB 4.41Å; I48-M298 HydrophobicContact CD1-CG 3.33Å; I48-M298 HydrophobicContact CD1-SD 4.44Å; I48-M298 HydrophobicContact CG1-CG 4.49Å; V294-M298 HydrophobicContact CG1-CG 4.45Å; V294-M298 HydrophobicContact CG1-SD 4.42Å; V294-M298 WeakPolarHBondContact O-CB 3.39Å; V294-M298 VanDerWaalsContact O-CG 3.28Å; V294-M298 WeakPolarHBondContact O-CG 3.38Å; V294-M298 PolarHBondContact O-N 3.47Å; I295-M298 WeakPolarHBondContact O-CB 3.33Å; I295-M298 PolarHBondContact O-N 3.25Å; M298-K300 VanDerWaalsContact C-N 3.25Å; M298-K300 PolarHBondContact O-N 2.84Å; M298-L301 PolarHBondContact O-N 3.17Å; M298-W302 WeakPolarHBondContact O-CB 2.87Å; M298-W302 PolarHBondContact O-N 3.4Å
299K73.9Confident66.1Low119 Ų119105.9 Ų105.952%0.51748%0.478SS..Hα-helixtrans-61.5-33.6178.6-74.5179.3-179.6-177.90112.5I295 M296 A297 R303I295-K299 HydrophobicContact CG2-CD 4.49Å; I295-K299 WeakPolarHBondContact O-CG 3.14Å; I295-K299 PolarHBondContact O-N 2.9Å; M296-K299 PolarHBondContact O-N 2.81Å; A297-K299 PolarHBondContact O-N 3.46Å; K299-R303 WeakPolarHBondContact O-CG 3.23Å; K299-R303 PolarHBondContact O-N 2.73Å; K299-R303 VanDerWaalsContact O-N 3.15Å; K299-R303 PolarHBondContact O-NE 3.17Å
300K75.1Confident65.5Low65 Ų65102.3 Ų102.328%0.28347%0.469SS..Hα-helixtrans-71.6-44.9177.4-176.2-177.9171-166.50111.4D52 M296 A297 M298 W302 R303 R304D52-K300 IonicContact OD1-NZ 3.65Å; D52-K300 IonicContact OD2-NZ 2.93Å; D52-K300 PolarHBondContact OD2-NZ 3.46Å; M296-K300 PolarHBondContact O-N 3.28Å; A297-K300 WeakPolarHBondContact O-CB 3.38Å; A297-K300 PolarHBondContact O-N 2.68Å; M298-K300 VanDerWaalsContact C-N 3.25Å; M298-K300 PolarHBondContact O-N 2.84Å; K300-W302 VanDerWaalsContact C-N 3.33Å; K300-W302 PolarHBondContact O-N 2.93Å; K300-R303 PolarHBondContact O-N 2.98Å; K300-R304 WeakPolarHBondContact O-CG 3.37Å; K300-R304 PolarHBondContact O-N 3.22Å
301L72.6Confident65.1Low56 Ų5699 Ų9929%0.29347%0.472SS..Hα-helixtrans-61.5-42.7175.1-164.5100000111.2L44 A297 M298 R303 R304 K305L44-L301 HydrophobicContact CD1-CD2 4.31Å; A297-L301 PolarHBondContact O-N 2.81Å; M298-L301 PolarHBondContact O-N 3.17Å; L301-R303 VanDerWaalsContact C-N 3.35Å; L301-R303 PolarHBondContact O-N 3.34Å; L301-R304 PolarHBondContact O-N 2.01Å; L301-K305 WeakPolarHBondContact O-CB 3.34Å; L301-K305 PolarHBondContact O-N 3.24Å
302W76.1Confident64.3Low175 Ų175106.1 Ų106.166%0.66351%0.509SS*.Hα-helixtrans-66-36.7179.4-127.3-15000112.9M298 K300 K306M298-W302 WeakPolarHBondContact O-CB 2.87Å; M298-W302 PolarHBondContact O-N 3.4Å; K300-W302 VanDerWaalsContact C-N 3.33Å; K300-W302 PolarHBondContact O-N 2.93Å; W302-K306 WeakPolarHBondContact O-CG 3.34Å; W302-K306 PolarHBondContact O-N 3.46Å
303R74.9Confident63.4Low160 Ų160106.6 Ų106.660%0.60451%0.513SS*.Hα-helixtrans-63.6-52.2172.7-80.5-174.1-95.3-1503.6111.1K299 K300 L301 K305 K306 D307K299-R303 WeakPolarHBondContact O-CG 3.23Å; K299-R303 PolarHBondContact O-N 2.73Å; K299-R303 VanDerWaalsContact O-N 3.15Å; K299-R303 PolarHBondContact O-NE 3.17Å; K300-R303 PolarHBondContact O-N 2.98Å; L301-R303 VanDerWaalsContact C-N 3.35Å; L301-R303 PolarHBondContact O-N 3.34Å; R303-K305 VanDerWaalsContact C-N 3.28Å; R303-K305 PolarHBondContact O-N 3.31Å; R303-K306 WeakPolarHBondContact O-CA 3.4Å; R303-K306 WeakPolarHBondContact O-CB 3.36Å; R303-K306 PolarHBondContact O-N 2.83Å; R303-D307 PolarHBondContact O-N 3.48Å; R303-D307 VanDerWaalsContact O-OD2 3.09Å
304R72Confident62.7Low141 Ų141107.8 Ų107.853%0.53253%0.531SS..Hα-helixtrans-56.1-39.9176-71.9178.1174.8-176.2-5.1113.1K300 L301 D307 L308K300-R304 WeakPolarHBondContact O-CG 3.37Å; K300-R304 PolarHBondContact O-N 3.22Å; L301-R304 PolarHBondContact O-N 2.01Å; R304-D307 PolarHBondContact O-N 2.92Å; R304-L308 WeakPolarHBondContact O-CD1 2.91Å; R304-L308 PolarHBondContact O-N 2.88Å
305K64.8Low61.7Low129 Ų129118.8 Ų118.856%0.56157%0.572SS**Hα-helixtrans-67.2-38.4175.8-172177.5-179.6179.70112.2L301 R303 D307 L308 I309L301-K305 WeakPolarHBondContact O-CB 3.34Å; L301-K305 PolarHBondContact O-N 3.24Å; R303-K305 VanDerWaalsContact C-N 3.28Å; R303-K305 PolarHBondContact O-N 3.31Å; K305-D307 VanDerWaalsContact C-N 3.32Å; K305-L308 PolarHBondContact O-N 2.87Å; K305-I309 HydrophobicContact CD-CD1 4.24Å; K305-I309 HydrophobicContact CG-CD1 3.63Å; K305-I309 HydrophobicContact CG-CG1 4.45Å; K305-I309 WeakPolarHBondContact O-CB 3.41Å; K305-I309 WeakPolarHBondContact O-CG1 3.23Å; K305-I309 PolarHBondContact O-N 3.13Å
306K66.7Low60.8Low154 Ų154122 Ų12267%0.6760%0.597SS**Hα-helixtrans-64.5-38172.7-79.6-175176.4-172.10111.7W302 R303 I309 G310W302-K306 WeakPolarHBondContact O-CG 3.34Å; W302-K306 PolarHBondContact O-N 3.46Å; R303-K306 WeakPolarHBondContact O-CA 3.4Å; R303-K306 WeakPolarHBondContact O-CB 3.36Å; R303-K306 PolarHBondContact O-N 2.83Å; K306-I309 CarbonylContact O-C 3.48Å; K306-I309 PolarHBondContact O-N 3.49Å; K306-G310 PolarHBondContact O-N 2.86Å; K306-G310 VanDerWaalsContact O-N 3.09Å
307D62.3Low59.8Low123 Ų123124.2 Ų124.266%0.65861%0.61SS**Hα-helixtrans-68.9-35.3178-55.6-31.1000111.6R303 R304 K305R303-D307 PolarHBondContact O-N 3.48Å; R303-D307 VanDerWaalsContact O-OD2 3.09Å; R304-D307 PolarHBondContact O-N 2.92Å; K305-D307 VanDerWaalsContact C-N 3.32Å
308L56.4Low59.4Low154 Ų154133.1 Ų133.181%0.80667%0.668SS**Hα-helixtrans-73.8-22.9172.9-100.5113.4000114.3R304 K305R304-L308 WeakPolarHBondContact O-CD1 2.91Å; R304-L308 PolarHBondContact O-N 2.88Å; K305-L308 PolarHBondContact O-N 2.87Å
309I55.6Low58.7Low121 Ų121137.4 Ų137.462%0.62169%0.689SS**THydrogen-bonded Turntrans-102.113.9178.4-57.4169.3000110.3K305 K306K305-I309 HydrophobicContact CD-CD1 4.24Å; K305-I309 HydrophobicContact CG-CD1 3.63Å; K305-I309 HydrophobicContact CG-CG1 4.45Å; K305-I309 WeakPolarHBondContact O-CB 3.41Å; K305-I309 WeakPolarHBondContact O-CG1 3.23Å; K305-I309 PolarHBondContact O-N 3.13Å; K306-I309 CarbonylContact O-C 3.48Å; K306-I309 PolarHBondContact O-N 3.49Å
310G42.2Very low57.9Low42 Ų42138.3 Ų138.343%0.43370%0.698SS.*  trans-53.1146.4174.100000111.7K306 L312K306-G310 PolarHBondContact O-N 2.86Å; K306-G310 VanDerWaalsContact O-N 3.09Å; G310-L312 PolarHBondContact O-N 2.89Å
311P46.8Very low57Low114 Ų114142.4 Ų142.474%0.7472%0.721SS**  trans-57.8138.2-167.125-33.1000110.6E313P311-E313 PolarHBondContact O-N 3.12Å
312L47.2Very low56.1Low174 Ų174147.5 Ų147.591%0.91175%0.746SS**  trans-56.888.7165-89.3128.5000108.5G310 C314G310-L312 PolarHBondContact O-N 2.89Å; L312-C314 PolarHBondContact O-N 2.99Å; L312-C314 VanDerWaalsContact O-N 3.09Å
313E43.9Very low54.8Low179 Ų179145.8 Ų145.884%0.83675%0.751SS**  trans-69.5101.8164.3-94.5175.3153.900107.2P311 R315P311-E313 PolarHBondContact O-N 3.12Å; E313-R315 PolarHBondContact O-N 3.11Å
314C46.5Very low53.5Low126 Ų126144.8 Ų144.885%0.85176%0.761SS**  trans-56.4100.3163.8-76.50000108.6L312L312-C314 PolarHBondContact O-N 2.99Å; L312-C314 VanDerWaalsContact O-N 3.09Å
315R40.3Very low52.2Low234 Ų234145.1 Ų145.188%0.88378%0.778SS**PPolyproline II helixtrans-70.5124.1168.5-131.6-175.1-113.6-149.6-1.9107.9E313 L317E313-R315 PolarHBondContact O-N 3.11Å; R315-L317 PolarHBondContact O-N 3.03Å
316P48.8Very low51.2Low120 Ų120146.3 Ų146.378%0.77979%0.794SS**PPolyproline II helixtrans-66.8130.2169.32.89.9000108.2
317L49.3Very low49.9Very low165 Ų165145.7 Ų145.786%0.86481%0.805SS**PPolyproline II helixtrans-68.3141.2170.8-87.3131.9000109.7R315R315-L317 PolarHBondContact O-N 3.03Å
318P59.5Low48.8Very low196 Ų196147.7 Ų147.7100%1.27382%0.818SS**  trans-69.50-179.229.6-34.8000113.8

Retrieved 318 of 318 residues in 126.7 ms (Link to these results)

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