G4VA47_SCHMA Loading...

Putative rhodopsin-like orphan GPCR

AlphaFold DB , UniProt , Accession G4VA47, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 460 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
1M52Low76.1Confident215 Ų215104.2 Ų104.2100%1.05950%0.502SS*.  0127.10-83.4178.1-171.200107.2Y3M1-Y3 PolarHBondContact O-N 3.01Å
2E65.1Low76.9Confident192 Ų192104.6 Ų104.690%0.89750%0.503SS*.  trans-78.2115.2174.4-164.3170.2-170.700108K4E2-K4 PolarHBondContact O-N 3.09Å
3Y66.6Low77.6Confident119 Ų119102.1 Ų102.147%0.46749%0.485SS..  trans-76.3109.7178.4-70.2-81.8000108.8M1 I5 L304 Q308M1-Y3 PolarHBondContact O-N 3.01Å; Y3-I5 PolarHBondContact O-N 3.32Å; Y3-L304 HydrophobicContact CD1-CD2 3.32Å; Y3-L304 HydrophobicContact CE1-CD2 3.85Å; Y3-L304 HydrophobicContact CG-CD2 3.95Å; Y3-Q308 HydrophobicContact CD1-CB 4.32Å; Y3-Q308 HydrophobicContact CD1-CG 4.07Å
4K71.6Confident78.2Confident173 Ų17396.9 Ų96.975%0.75246%0.459SS*.  trans-6297.7159.4-74.4-173.7178.5179.70109.8E2 Q308E2-K4 PolarHBondContact O-N 3.09Å; K4-Q308 PolarHBondContact O-OE1 3.28Å; K4-Q308 VanDerWaalsContact O-OE1 3.1Å
5I75.4Confident78.5Confident115 Ų11599.6 Ų99.659%0.5948%0.477SS*.BIsolated β-bridgetrans-72.8128.9173.8-60.6173.9000108.2Y3 Y303Y3-I5 PolarHBondContact O-N 3.32Å; I5-Y303 CarbonylContact C-O 3.58Å; I5-Y303 WeakPolarHBondContact CA-O 3.24Å
6S77.1Confident78.4Confident27 Ų27101 Ų10119%0.18949%0.488CS..  trans-82.314516957.40000110.6I8 R13 Y303S6-I8 PolarHBondContact O-N 3.05Å; S6-I8 PolarHBondContact OG-O 3.14Å; S6-R13 PolarHBondContact OG-NH1 3.26Å; S6-Y303 PolarHBondContact N-O 2.67Å; S6-Y303 WeakPolarHBondContact O-CD1 3.27Å; S6-Y303 PolarHBondContact OG-O 2.77Å; S6-Y303 VanDerWaalsContact OG-O 3.05Å
7N83.9Confident78.4Confident162 Ų16297.4 Ų97.487%0.86648%0.476SS*.SBendtrans-70.8-10174.6-68.3-13000113.6
8I86.1Confident78.5Confident77 Ų7797.1 Ų97.140%0.39548%0.476SS..SBendtrans-117.6137.4-173.6-61.5176.1000108S6 E12 R13S6-I8 PolarHBondContact O-N 3.05Å; S6-I8 PolarHBondContact OG-O 3.14Å; I8-E12 HydrophobicContact CG2-CB 3.55Å; I8-E12 HydrophobicContact CG2-CG 3.57Å; I8-R13 HydrophobicContact CB-CG 4.21Å; I8-R13 HydrophobicContact CG2-CG 3.72Å
9S87.1Confident78.5Confident19 Ų1995.7 Ų95.713%0.13347%0.471CS..  trans-67.2154.9177.170.50000111.3W11 E12 R13 E302S9-W11 PolarHBondContact O-N 3Å; S9-E12 PolarHBondContact O-N 3.16Å; S9-E12 WeakPolarHBondContact OG-CB 3.21Å; S9-E12 PolarHBondContact OG-N 3.08Å; S9-R13 WeakPolarHBondContact O-CG 3.1Å; S9-R13 PolarHBondContact O-N 3.19Å; S9-E302 CarbonylContact C-O 3.56Å; S9-E302 WeakPolarHBondContact CA-O 3.38Å
10V86.5Confident78.8Confident0 Ų094.6 Ų94.60%047%0.466CS..Hα-helixtrans-52.2-45.2174.3-176.80000110.5E12 R13 Y14 L21 E302 I309 W315V10-E12 VanDerWaalsContact C-N 3.35Å; V10-E12 PolarHBondContact O-N 3.31Å; V10-R13 PolarHBondContact O-N 2.82Å; V10-Y14 HydrophobicContact CG1-CD2 3.98Å; V10-Y14 HydrophobicContact CG1-CE2 4.13Å; V10-Y14 VanDerWaalsContact O-CD2 3.27Å; V10-Y14 WeakPolarHBondContact O-CD2 3.39Å; V10-Y14 PolarHBondContact O-N 2.86Å; V10-L21 HydrophobicContact CG1-CD1 3.32Å; V10-L21 HydrophobicContact CG1-CD2 4.32Å; V10-L21 HydrophobicContact CG1-CG 4.46Å; V10-E302 WeakPolarHBondContact CG2-O 3.48Å; V10-E302 PolarHBondContact N-O 3.44Å; V10-I309 HydrophobicContact CB-CD1 4.4Å; V10-I309 HydrophobicContact CG1-CD1 4.07Å; V10-I309 HydrophobicContact CG2-CD1 3.39Å; V10-I309 HydrophobicContact CG2-CG1 4.45Å; V10-W315 HydrophobicContact CB-CH2 4.44Å; V10-W315 HydrophobicContact CB-CZ2 4.29Å; V10-W315 HydrophobicContact CG1-CH2 4.46Å; V10-W315 HydrophobicContact CG2-CH2 4.38Å; V10-W315 HydrophobicContact CG2-CZ2 3.77Å
11W85.3Confident79.2Confident47 Ų4790 Ų9018%0.17844%0.444CS..Hα-helixtrans-57.7-48-179.7-55.5113.9000111.7S9 R13 Y14 N15 N16 D18 L21 T299 E302 W315S9-W11 PolarHBondContact O-N 3Å; W11-R13 PolarHBondContact O-N 2.58Å; W11-Y14 CarbonylContact O-C 3.59Å; W11-Y14 VanDerWaalsContact O-C 3.32Å; W11-Y14 PolarHBondContact O-N 2.91Å; W11-Y14 VanDerWaalsContact O-N 3.11Å; W11-N15 PolarHBondContact O-N 3.19Å; W11-N16 WeakPolarHBondContact O-CA 3.49Å; W11-N16 PolarHBondContact O-N 3.43Å; W11-D18 WeakPolarHBondContact CZ3-OD1 3.17Å; W11-L21 HydrophobicContact CE3-CD2 3.9Å; W11-L21 HydrophobicContact CH2-CD2 3.66Å; W11-L21 HydrophobicContact CZ2-CD2 4.46Å; W11-L21 HydrophobicContact CZ3-CD2 3.32Å; W11-T299 HydrophobicContact CZ2-CG2 4.43Å; W11-E302 PolarHBondContact NE1-OE1 2.65Å; W11-W315 HydrophobicContact CZ2-CH2 4.29Å
12E85.7Confident80.9Confident109 Ų10980.6 Ų80.651%0.50940%0.397SS..Hα-helixtrans-67.1-36.3179.8-173.9177.6-172.300112.2I8 S9 V10 Y14 N15I8-E12 HydrophobicContact CG2-CB 3.55Å; I8-E12 HydrophobicContact CG2-CG 3.57Å; S9-E12 PolarHBondContact O-N 3.16Å; S9-E12 WeakPolarHBondContact OG-CB 3.21Å; S9-E12 PolarHBondContact OG-N 3.08Å; V10-E12 VanDerWaalsContact C-N 3.35Å; V10-E12 PolarHBondContact O-N 3.31Å; E12-Y14 PolarHBondContact O-N 3.12Å; E12-N15 PolarHBondContact O-N 2.95Å
13R85.7Confident81.9Confident72 Ų7277.6 Ų77.627%0.27238%0.381SS..Hα-helixtrans-59.6-29.4172.7-69.1-161.3-56.3-108.58113.1S6 I8 S9 V10 W11 L304 D306S6-R13 PolarHBondContact OG-NH1 3.26Å; I8-R13 HydrophobicContact CB-CG 4.21Å; I8-R13 HydrophobicContact CG2-CG 3.72Å; S9-R13 WeakPolarHBondContact O-CG 3.1Å; S9-R13 PolarHBondContact O-N 3.19Å; V10-R13 PolarHBondContact O-N 2.82Å; W11-R13 PolarHBondContact O-N 2.58Å; R13-L304 VanDerWaalsContact CZ-O 3.23Å; R13-L304 PolarHBondContact NH1-O 3.06Å; R13-L304 PolarHBondContact NH2-O 3.49Å; R13-D306 IonicContact CZ-OD1 3.5Å; R13-D306 IonicContact NE-OD1 2.73Å; R13-D306 PolarHBondContact NE-OD1 3.2Å; R13-D306 IonicContact NH2-OD1 3.41Å; R13-D306 PolarHBondContact NH2-OD1 2.91Å
14Y86.9Confident82.9Confident29 Ų2974.3 Ų74.311%0.11437%0.373CS..THydrogen-bonded Turntrans-104.327.2177.6-68.8-81.6000112.4V10 W11 E12 N16 S17 L20 L21 T24 F25 D306V10-Y14 HydrophobicContact CG1-CD2 3.98Å; V10-Y14 HydrophobicContact CG1-CE2 4.13Å; V10-Y14 VanDerWaalsContact O-CD2 3.27Å; V10-Y14 WeakPolarHBondContact O-CD2 3.39Å; V10-Y14 PolarHBondContact O-N 2.86Å; W11-Y14 CarbonylContact O-C 3.59Å; W11-Y14 VanDerWaalsContact O-C 3.32Å; W11-Y14 PolarHBondContact O-N 2.91Å; W11-Y14 VanDerWaalsContact O-N 3.11Å; E12-Y14 PolarHBondContact O-N 3.12Å; Y14-N16 VanDerWaalsContact C-N 3.26Å; Y14-N16 PolarHBondContact O-N 3.37Å; Y14-S17 VanDerWaalsContact O-CB 3.26Å; Y14-S17 WeakPolarHBondContact O-CB 3.48Å; Y14-S17 PolarHBondContact O-N 3.49Å; Y14-L20 HydrophobicContact CD1-CB 3.93Å; Y14-L21 HydrophobicContact CD2-CB 4.48Å; Y14-L21 HydrophobicContact CD2-CD1 3.65Å; Y14-L21 HydrophobicContact CE2-CD1 3.77Å; Y14-L21 HydrophobicContact CG-CB 4.39Å; Y14-L21 HydrophobicContact CG-CD1 4.34Å; Y14-T24 HydrophobicContact CE1-CG2 4.37Å; Y14-T24 WeakPolarHBondContact CE1-OG1 3.27Å; Y14-T24 WeakPolarHBondContact OH-CG2 3.34Å; Y14-F25 AromaticContact CE2-CE2 3.91Å; Y14-F25 HydrophobicContact CE2-CE2 3.91Å; Y14-F25 AromaticContact CZ-CE2 3.95Å; Y14-D306 PolarHBondContact OH-OD2 3.19Å
15N82.2Confident83.8Confident138 Ų13867.4 Ų67.474%0.73834%0.344SS*.THydrogen-bonded Turntrans54.834.7178-68.1-15.8000114.3W11 E12 S17W11-N15 PolarHBondContact O-N 3.19Å; E12-N15 PolarHBondContact O-N 2.95Å; N15-S17 PolarHBondContact O-N 3.4Å; N15-S17 VanDerWaalsContact O-N 3.12Å
16N77.2Confident84.5Confident122 Ų12262 Ų6265%0.65232%0.316SS*.THydrogen-bonded Turntrans55.524.5-173-56.5-42.7000113.4W11 Y14W11-N16 WeakPolarHBondContact O-CA 3.49Å; W11-N16 PolarHBondContact O-N 3.43Å; Y14-N16 VanDerWaalsContact C-N 3.26Å; Y14-N16 PolarHBondContact O-N 3.37Å
17S77.5Confident85Confident39 Ų3964 Ų6427%0.27333%0.328SS..  trans-100.3106.8179.3-171.70000110.8Y14 N15 L19 L20 L21Y14-S17 VanDerWaalsContact O-CB 3.26Å; Y14-S17 WeakPolarHBondContact O-CB 3.48Å; Y14-S17 PolarHBondContact O-N 3.49Å; N15-S17 PolarHBondContact O-N 3.4Å; N15-S17 VanDerWaalsContact O-N 3.12Å; S17-L19 PolarHBondContact O-N 3.13Å; S17-L20 PolarHBondContact O-N 2.78Å; S17-L21 PolarHBondContact O-N 2.82Å
18D80.8Confident85.2Confident92 Ų9260.3 Ų60.349%0.49231%0.305SS..Hα-helixtrans-51.4-39.9170.8-70-13.5000111.7W11 L20 L21 F22W11-D18 WeakPolarHBondContact CZ3-OD1 3.17Å; D18-L20 PolarHBondContact O-N 3.21Å; D18-L21 WeakPolarHBondContact O-CB 3.31Å; D18-L21 PolarHBondContact O-N 2.93Å; D18-F22 HydrophobicContact CB-CD2 4.19Å; D18-F22 HydrophobicContact CB-CE2 3.97Å; D18-F22 WeakPolarHBondContact O-CD2 3.37Å; D18-F22 PolarHBondContact O-N 2.98Å
19L79.1Confident85.3Confident71 Ų7156.8 Ų56.837%0.37229%0.287SS..Hα-helixtrans-61.7-45-177.6-176.368.9000112.3S17 L21 F22 K23S17-L19 PolarHBondContact O-N 3.13Å; L19-L21 VanDerWaalsContact C-N 3.34Å; L19-F22 PolarHBondContact O-N 3.24Å; L19-K23 VanDerWaalsContact O-CB 3.24Å; L19-K23 WeakPolarHBondContact O-CB 3.37Å; L19-K23 PolarHBondContact O-N 3.16Å
20L83.7Confident85.1Confident73 Ų7357.4 Ų57.438%0.38229%0.29SS..Hα-helixtrans-68.3-37.6-179.9-68178.2000111.5Y14 S17 D18 T24Y14-L20 HydrophobicContact CD1-CB 3.93Å; S17-L20 PolarHBondContact O-N 2.78Å; D18-L20 PolarHBondContact O-N 3.21Å; L20-T24 PolarHBondContact O-N 3.05Å; L20-T24 PolarHBondContact O-OG1 2.75Å
21L87.1Confident85.1Confident0 Ų063 Ų630%032%0.319CS..Hα-helixtrans-60.3-53.8174.2-177.666000111V10 W11 Y14 S17 D18 L19 K23 T24 F25 W315 F319V10-L21 HydrophobicContact CG1-CD1 3.32Å; V10-L21 HydrophobicContact CG1-CD2 4.32Å; V10-L21 HydrophobicContact CG1-CG 4.46Å; W11-L21 HydrophobicContact CE3-CD2 3.9Å; W11-L21 HydrophobicContact CH2-CD2 3.66Å; W11-L21 HydrophobicContact CZ2-CD2 4.46Å; W11-L21 HydrophobicContact CZ3-CD2 3.32Å; Y14-L21 HydrophobicContact CD2-CB 4.48Å; Y14-L21 HydrophobicContact CD2-CD1 3.65Å; Y14-L21 HydrophobicContact CE2-CD1 3.77Å; Y14-L21 HydrophobicContact CG-CB 4.39Å; Y14-L21 HydrophobicContact CG-CD1 4.34Å; S17-L21 PolarHBondContact O-N 2.82Å; D18-L21 WeakPolarHBondContact O-CB 3.31Å; D18-L21 PolarHBondContact O-N 2.93Å; L19-L21 VanDerWaalsContact C-N 3.34Å; L21-K23 VanDerWaalsContact C-N 3.34Å; L21-K23 PolarHBondContact O-N 3.18Å; L21-T24 PolarHBondContact O-N 3.41Å; L21-T24 VanDerWaalsContact O-N 3.1Å; L21-F25 HydrophobicContact CD1-CD2 3.53Å; L21-F25 HydrophobicContact CD1-CE2 3.51Å; L21-F25 HydrophobicContact CG-CD2 4.27Å; L21-F25 WeakPolarHBondContact O-CD2 3.27Å; L21-F25 PolarHBondContact O-N 3.18Å; L21-F25 VanDerWaalsContact O-N 3.09Å; L21-W315 HydrophobicContact CD2-CZ3 4.37Å; L21-F319 HydrophobicContact CG-CE1 4.39Å
22F87.8Confident85.3Confident17 Ų1762.8 Ų62.88%0.07532%0.323CS..Hα-helixtrans-66.8-34-179-68.7-57.6000112.8D18 L19 T24 A26 L29 Y318 F319 F322D18-F22 HydrophobicContact CB-CD2 4.19Å; D18-F22 HydrophobicContact CB-CE2 3.97Å; D18-F22 WeakPolarHBondContact O-CD2 3.37Å; D18-F22 PolarHBondContact O-N 2.98Å; L19-F22 PolarHBondContact O-N 3.24Å; F22-T24 PolarHBondContact O-N 3.47Å; F22-A26 CarbonylContact O-C 3.45Å; F22-A26 VanDerWaalsContact O-CA 3.23Å; F22-A26 WeakPolarHBondContact O-CA 3.5Å; F22-A26 PolarHBondContact O-N 3.26Å; F22-L29 HydrophobicContact CB-CD1 4.5Å; F22-L29 HydrophobicContact CD1-CD1 4.3Å; F22-Y318 HydrophobicContact CE1-CE1 4.21Å; F22-Y318 HydrophobicContact CZ-CE1 4.24Å; F22-F319 AromaticContact CD1-CD1 4Å; F22-F319 HydrophobicContact CD1-CD1 4Å; F22-F319 HydrophobicContact CD1-CE1 4.07Å; F22-F319 AromaticContact CE1-CD1 3.89Å; F22-F319 HydrophobicContact CE1-CD1 3.89Å; F22-F319 HydrophobicContact CE1-CE1 4Å; F22-F322 AromaticContact CD1-CD1 3.68Å; F22-F322 HydrophobicContact CD1-CD1 3.68Å; F22-F322 AromaticContact CD1-CE1 3.74Å; F22-F322 HydrophobicContact CD1-CE1 3.74Å; F22-F322 HydrophobicContact CD1-CG 4.39Å; F22-F322 HydrophobicContact CD1-CZ 4.49Å; F22-F322 HydrophobicContact CD2-CD1 4.47Å; F22-F322 AromaticContact CD2-CE1 3.74Å; F22-F322 HydrophobicContact CD2-CE1 3.74Å; F22-F322 AromaticContact CD2-CZ 3.87Å; F22-F322 HydrophobicContact CD2-CZ 3.87Å; F22-F322 HydrophobicContact CE1-CB 4.22Å; F22-F322 AromaticContact CE1-CD1 3.34Å; F22-F322 HydrophobicContact CE1-CD1 3.34Å; F22-F322 HydrophobicContact CE1-CD2 4.08Å; F22-F322 AromaticContact CE1-CE1 3.59Å; F22-F322 HydrophobicContact CE1-CE1 3.59Å; F22-F322 HydrophobicContact CE1-CE2 4.29Å; F22-F322 AromaticContact CE1-CG 3.6Å; F22-F322 HydrophobicContact CE1-CG 3.6Å; F22-F322 HydrophobicContact CE1-CZ 4.07Å; F22-F322 HydrophobicContact CE2-CD1 4.21Å; F22-F322 HydrophobicContact CE2-CD2 4.37Å; F22-F322 AromaticContact CE2-CE1 3.61Å; F22-F322 HydrophobicContact CE2-CE1 3.61Å; F22-F322 AromaticContact CE2-CE2 3.81Å; F22-F322 HydrophobicContact CE2-CE2 3.81Å; F22-F322 AromaticContact CE2-CZ 3.39Å; F22-F322 HydrophobicContact CE2-CZ 3.39Å; F22-F322 HydrophobicContact CG-CD1 4.25Å; F22-F322 AromaticContact CG-CE1 3.83Å; F22-F322 HydrophobicContact CG-CE1 3.83Å; F22-F322 HydrophobicContact CG-CZ 4.42Å; F22-F322 AromaticContact CZ-CD1 3.65Å; F22-F322 HydrophobicContact CZ-CD1 3.65Å; F22-F322 AromaticContact CZ-CD2 3.68Å; F22-F322 HydrophobicContact CZ-CD2 3.68Å; F22-F322 AromaticContact CZ-CE1 3.54Å; F22-F322 HydrophobicContact CZ-CE1 3.54Å; F22-F322 AromaticContact CZ-CE2 3.58Å; F22-F322 HydrophobicContact CZ-CE2 3.58Å; F22-F322 AromaticContact CZ-CG 3.71Å; F22-F322 HydrophobicContact CZ-CG 3.71Å; F22-F322 AromaticContact CZ-CZ 3.51Å; F22-F322 HydrophobicContact CZ-CZ 3.51Å
23K86.7Confident85.3Confident129 Ų12961.2 Ų61.256%0.56132%0.316SS*.Hα-helixtrans-59.7-32173.4-173.6177.8179.9-175.40112.1L19 L21 T30L19-K23 VanDerWaalsContact O-CB 3.24Å; L19-K23 WeakPolarHBondContact O-CB 3.37Å; L19-K23 PolarHBondContact O-N 3.16Å; L21-K23 VanDerWaalsContact C-N 3.34Å; L21-K23 PolarHBondContact O-N 3.18Å; K23-T30 HydrophobicContact CB-CG2 4.36Å; K23-T30 HydrophobicContact CG-CG2 4.4Å
24T87.9Confident85.3Confident49 Ų4964.5 Ų64.530%0.30133%0.328SS..Hα-helixtrans-85.1-43.2-176.4-53.90000112.8Y14 L20 L21 F22Y14-T24 HydrophobicContact CE1-CG2 4.37Å; Y14-T24 WeakPolarHBondContact CE1-OG1 3.27Å; Y14-T24 WeakPolarHBondContact OH-CG2 3.34Å; L20-T24 PolarHBondContact O-N 3.05Å; L20-T24 PolarHBondContact O-OG1 2.75Å; L21-T24 PolarHBondContact O-N 3.41Å; L21-T24 VanDerWaalsContact O-N 3.1Å; F22-T24 PolarHBondContact O-N 3.47Å
25F90.3Very high85.5Confident29 Ų2965.1 Ų65.113%0.12734%0.339CS..Hα-helixtrans-98.9-20-175.5-65.8-77.9000114.5Y14 L21 D306 I309 R310 F319Y14-F25 AromaticContact CE2-CE2 3.91Å; Y14-F25 HydrophobicContact CE2-CE2 3.91Å; Y14-F25 AromaticContact CZ-CE2 3.95Å; L21-F25 HydrophobicContact CD1-CD2 3.53Å; L21-F25 HydrophobicContact CD1-CE2 3.51Å; L21-F25 HydrophobicContact CG-CD2 4.27Å; L21-F25 WeakPolarHBondContact O-CD2 3.27Å; L21-F25 PolarHBondContact O-N 3.18Å; L21-F25 VanDerWaalsContact O-N 3.09Å; F25-D306 HydrophobicContact CZ-CB 4Å; F25-I309 HydrophobicContact CD1-CG2 3.74Å; F25-I309 HydrophobicContact CE1-CB 3.75Å; F25-I309 HydrophobicContact CE1-CG2 3.34Å; F25-I309 HydrophobicContact CE2-CG2 4.2Å; F25-I309 HydrophobicContact CG-CG2 4.32Å; F25-I309 HydrophobicContact CZ-CB 3.94Å; F25-I309 HydrophobicContact CZ-CD1 4.04Å; F25-I309 HydrophobicContact CZ-CG2 3.61Å; F25-R310 HydrophobicContact CD1-CG 3.99Å; F25-R310 HydrophobicContact CE1-CG 3.85Å; F25-F319 HydrophobicContact CB-CD1 4.29Å; F25-F319 HydrophobicContact CB-CD2 3.93Å; F25-F319 HydrophobicContact CB-CE1 3.86Å; F25-F319 HydrophobicContact CB-CE2 3.45Å; F25-F319 VanDerWaalsContact CB-CE2 3.45Å; F25-F319 HydrophobicContact CB-CG 4.34Å; F25-F319 HydrophobicContact CB-CZ 3.41Å; F25-F319 VanDerWaalsContact CB-CZ 3.41Å; F25-F319 HydrophobicContact CD1-CE2 4.04Å; F25-F319 HydrophobicContact CD1-CZ 4.37Å; F25-F319 HydrophobicContact CD2-CE2 4.24Å; F25-F319 AromaticContact CD2-CZ 3.74Å; F25-F319 HydrophobicContact CD2-CZ 3.74Å; F25-F319 HydrophobicContact CG-CE1 4.43Å; F25-F319 AromaticContact CG-CE2 3.66Å; F25-F319 HydrophobicContact CG-CE2 3.66Å; F25-F319 AromaticContact CG-CZ 3.59Å; F25-F319 HydrophobicContact CG-CZ 3.59Å
26A89.6Confident85.9Confident0 Ų059.2 Ų59.20%031%0.308CS..  trans-139.958.1-177.800000111.8F22 H28 L29F22-A26 CarbonylContact O-C 3.45Å; F22-A26 VanDerWaalsContact O-CA 3.23Å; F22-A26 WeakPolarHBondContact O-CA 3.5Å; F22-A26 PolarHBondContact O-N 3.26Å; A26-H28 PolarHBondContact O-N 3.49Å; A26-H28 VanDerWaalsContact O-N 3.1Å; A26-L29 HydrophobicContact CB-CD1 3.51Å; A26-L29 HydrophobicContact CB-CG 3.9Å; A26-L29 WeakPolarHBondContact O-CB 3.36Å; A26-L29 WeakPolarHBondContact O-CG 3.45Å; A26-L29 PolarHBondContact O-N 3.22Å
27P87.2Confident86.6Confident69 Ų6953.9 Ų53.945%0.44828%0.279SS..Hα-helixtrans-60.7-26.1-173.725.1-35.3000113.4L29 T30P27-L29 PolarHBondContact O-N 3.05Å; P27-T30 PolarHBondContact O-N 3.25Å; P27-T30 PolarHBondContact O-OG1 3.06Å
28H88.6Confident87.3Confident85 Ų8554.5 Ų54.539%0.39428%0.282SS..Hα-helixtrans-58.5-27.6175.357.7-79.1000112.9A26 I31 V32 T323A26-H28 PolarHBondContact O-N 3.49Å; A26-H28 VanDerWaalsContact O-N 3.1Å; H28-I31 PolarHBondContact O-N 3.26Å; H28-V32 WeakPolarHBondContact O-CG2 3.26Å; H28-V32 PolarHBondContact O-N 3.21Å; H28-V32 VanDerWaalsContact O-N 3.08Å; H28-T323 WeakPolarHBondContact NE2-CG2 3.33Å; H28-T323 PolarHBondContact NE2-OG1 2.89Å
29L87.4Confident87.9Confident3 Ų355.2 Ų55.22%0.01629%0.285CS..Hα-helixtrans-64.6-41.5177.6-61.2178.6000112.1F22 A26 P27 I31 V32 E33 F322 T323 V326F22-L29 HydrophobicContact CB-CD1 4.5Å; F22-L29 HydrophobicContact CD1-CD1 4.3Å; A26-L29 HydrophobicContact CB-CD1 3.51Å; A26-L29 HydrophobicContact CB-CG 3.9Å; A26-L29 WeakPolarHBondContact O-CB 3.36Å; A26-L29 WeakPolarHBondContact O-CG 3.45Å; A26-L29 PolarHBondContact O-N 3.22Å; P27-L29 PolarHBondContact O-N 3.05Å; L29-I31 PolarHBondContact O-N 3.31Å; L29-V32 PolarHBondContact O-N 3.12Å; L29-V32 VanDerWaalsContact O-N 3.12Å; L29-E33 WeakPolarHBondContact O-CG 3.4Å; L29-E33 PolarHBondContact O-N 2.94Å; L29-F322 HydrophobicContact CD1-CD1 3.5Å; L29-F322 HydrophobicContact CD1-CE1 3.7Å; L29-T323 HydrophobicContact CD2-CG2 3.76Å; L29-V326 HydrophobicContact CD2-CB 4.23Å; L29-V326 HydrophobicContact CD2-CG1 4.32Å; L29-V326 HydrophobicContact CD2-CG2 4.45Å
30T83.7Confident88.7Confident32 Ų3255.2 Ų55.220%0.19628%0.28CS..Hα-helixtrans-62.4-33.8179.267.60000111.9K23 P27 R34K23-T30 HydrophobicContact CB-CG2 4.36Å; K23-T30 HydrophobicContact CG-CG2 4.4Å; P27-T30 PolarHBondContact O-N 3.25Å; P27-T30 PolarHBondContact O-OG1 3.06Å; T30-R34 VanDerWaalsContact O-CB 3.32Å; T30-R34 WeakPolarHBondContact O-CB 3.33Å; T30-R34 WeakPolarHBondContact O-CD 3.37Å; T30-R34 WeakPolarHBondContact O-CG 3.49Å; T30-R34 PolarHBondContact O-N 2.76Å
31I87.5Confident89.2Confident117 Ų11752.2 Ų52.260%0.627%0.266SS*.Hα-helixtrans-70.7-45.8175.8-59.1173.3000110H28 L29 R34 A35H28-I31 PolarHBondContact O-N 3.26Å; L29-I31 PolarHBondContact O-N 3.31Å; I31-R34 PolarHBondContact O-N 3.08Å; I31-A35 VanDerWaalsContact O-CB 3.32Å; I31-A35 WeakPolarHBondContact O-CB 3.48Å; I31-A35 PolarHBondContact O-N 3.36Å
32V88.8Confident89.5Confident43 Ų4358.2 Ų58.226%0.26130%0.297SS..Hα-helixtrans-60.2-49.6178.6170.70000110.8H28 L29 R34 A35 N36 L327H28-V32 WeakPolarHBondContact O-CG2 3.26Å; H28-V32 PolarHBondContact O-N 3.21Å; H28-V32 VanDerWaalsContact O-N 3.08Å; L29-V32 PolarHBondContact O-N 3.12Å; L29-V32 VanDerWaalsContact O-N 3.12Å; V32-R34 VanDerWaalsContact C-N 3.33Å; V32-R34 PolarHBondContact O-N 3.11Å; V32-A35 PolarHBondContact O-N 3.32Å; V32-N36 WeakPolarHBondContact O-CB 3.03Å; V32-N36 PolarHBondContact O-N 2.76Å; V32-L327 HydrophobicContact CG1-CD2 3.97Å; V32-L327 HydrophobicContact CG2-CD2 4.45Å
33E84.7Confident89.8Confident76 Ų7661.7 Ų61.736%0.35532%0.316SS..Hα-helixtrans-60.6-41.7179.8-71.8176.5165.100112.1L29 V326L29-E33 WeakPolarHBondContact O-CG 3.4Å; L29-E33 PolarHBondContact O-N 2.94Å; E33-V326 HydrophobicContact CG-CG1 4.16Å
34R87.3Confident90.2Very high141 Ų14155.5 Ų55.553%0.53229%0.289SS..Hα-helixtrans-69.3-35.2177.1-74.5174.8173.2-166.5-4.8113.5T30 I31 V32 P38 Y90 A94T30-R34 VanDerWaalsContact O-CB 3.32Å; T30-R34 WeakPolarHBondContact O-CB 3.33Å; T30-R34 WeakPolarHBondContact O-CD 3.37Å; T30-R34 WeakPolarHBondContact O-CG 3.49Å; T30-R34 PolarHBondContact O-N 2.76Å; I31-R34 PolarHBondContact O-N 3.08Å; V32-R34 VanDerWaalsContact C-N 3.33Å; V32-R34 PolarHBondContact O-N 3.11Å; R34-P38 VanDerWaalsContact O-CD 3.28Å; R34-P38 WeakPolarHBondContact O-CD 3.04Å; R34-Y90 WeakPolarHBondContact CA-OH 3.47Å; R34-Y90 PolarHBondContact O-OH 3.04Å; R34-A94 HydrophobicContact CG-CB 4.21Å; R34-A94 PolarHBondContact NE-O 3.44Å; R34-A94 PolarHBondContact NH2-O 3.18Å
35A90.3Very high90.6Very high43 Ų4356 Ų5636%0.35529%0.287SS..Hα-helixtrans-81.2-32.9179.400000112.4I31 V32 F37 P38 L39I31-A35 VanDerWaalsContact O-CB 3.32Å; I31-A35 WeakPolarHBondContact O-CB 3.48Å; I31-A35 PolarHBondContact O-N 3.36Å; V32-A35 PolarHBondContact O-N 3.32Å; A35-F37 PolarHBondContact O-N 2.8Å; A35-P38 WeakPolarHBondContact O-CD 3.45Å; A35-L39 HydrophobicContact CB-CD1 4.33Å; A35-L39 WeakPolarHBondContact O-CD1 3.38Å; A35-L39 WeakPolarHBondContact O-CG 3.01Å; A35-L39 PolarHBondContact O-N 3.33Å
36N90.8Very high90.9Very high14 Ų1456.9 Ų56.98%0.07530%0.295CS..Hα-helixtrans-62.8-49.9-168.3-178.167.3000112.9V32 L39 W40 C330 M333V32-N36 WeakPolarHBondContact O-CB 3.03Å; V32-N36 PolarHBondContact O-N 2.76Å; N36-L39 PolarHBondContact O-N 2.03Å; N36-W40 PolarHBondContact O-N 2.85Å; N36-W40 PolarHBondContact OD1-NE1 3.45Å; N36-C330 HydrophobicContact CB-CB 4.49Å; N36-C330 WeakPolarHBondContact OD1-CB 3.38Å; N36-M333 WeakPolarHBondContact ND2-CE 3.29Å
37F91.4Very high91.2Very high9 Ų957 Ų574%0.03930%0.297CS..Hα-helixtrans-63.1-51-176.4177.5-95.8000113A35 L39 W40 A41 F83 H86 L87 Y90A35-F37 PolarHBondContact O-N 2.8Å; F37-L39 VanDerWaalsContact C-N 3.31Å; F37-L39 PolarHBondContact O-N 3.11Å; F37-W40 PolarHBondContact O-N 2.86Å; F37-A41 HydrophobicContact CD1-CB 4.49Å; F37-A41 HydrophobicContact CE1-CB 4.11Å; F37-A41 HydrophobicContact CZ-CB 4.25Å; F37-A41 VanDerWaalsContact O-CB 3.24Å; F37-A41 WeakPolarHBondContact O-CB 3.32Å; F37-A41 PolarHBondContact O-N 3.13Å; F37-F83 AromaticContact CE2-CD1 3.9Å; F37-F83 HydrophobicContact CE2-CD1 3.9Å; F37-F83 HydrophobicContact CZ-CD1 4.36Å; F37-H86 AromaticContact CD2-CD2 3.34Å; F37-H86 WeakPolarHBondContact CD2-CD2 3.36Å; F37-H86 HydrophobicContact CE2-CB 4.1Å; F37-H86 AromaticContact CE2-CD2 3.54Å; F37-L87 HydrophobicContact CE1-CB 4.07Å; F37-L87 HydrophobicContact CE1-CD1 3.63Å; F37-L87 HydrophobicContact CE1-CG 4.46Å; F37-L87 HydrophobicContact CZ-CB 3.78Å; F37-L87 HydrophobicContact CZ-CD1 4.24Å; F37-Y90 HydrophobicContact CB-CD1 4.47Å; F37-Y90 HydrophobicContact CB-CD2 3.71Å; F37-Y90 HydrophobicContact CB-CE2 3.97Å; F37-Y90 HydrophobicContact CB-CG 3.99Å; F37-Y90 AromaticContact CD1-CD1 3.67Å; F37-Y90 HydrophobicContact CD1-CD1 3.67Å; F37-Y90 HydrophobicContact CD1-CD2 4.37Å; F37-Y90 HydrophobicContact CD1-CE1 4.15Å; F37-Y90 AromaticContact CD1-CG 3.8Å; F37-Y90 HydrophobicContact CD1-CG 3.8Å; F37-Y90 HydrophobicContact CE1-CD1 4.32Å; F37-Y90 HydrophobicContact CG-CD1 4.29Å; F37-Y90 HydrophobicContact CG-CD2 4.19Å; F37-Y90 AromaticContact CG-CG 3.96Å; F37-Y90 HydrophobicContact CG-CG 3.96Å
38P93.3Very high91.6Very high53 Ų5353.9 Ų53.934%0.34428%0.277SS..Hα-helixtrans-56.3-41.4176.8-26.935000113.9R34 A35 W40 A41 I42 Y90R34-P38 VanDerWaalsContact O-CD 3.28Å; R34-P38 WeakPolarHBondContact O-CD 3.04Å; A35-P38 WeakPolarHBondContact O-CD 3.45Å; P38-W40 PolarHBondContact O-N 2.69Å; P38-A41 PolarHBondContact O-N 2.98Å; P38-I42 WeakPolarHBondContact O-CG1 2.97Å; P38-I42 PolarHBondContact O-N 3.28Å; P38-I42 VanDerWaalsContact O-N 3.13Å; P38-Y90 HydrophobicContact CG-CE1 4.46Å
39L93.2Very high92Very high107 Ų10753.3 Ų53.356%0.5628%0.276SS*.Hα-helixtrans-58.6-46.5179.1-73.5171.1000111.7A35 N36 F37A35-L39 HydrophobicContact CB-CD1 4.33Å; A35-L39 WeakPolarHBondContact O-CD1 3.38Å; A35-L39 WeakPolarHBondContact O-CG 3.01Å; A35-L39 PolarHBondContact O-N 3.33Å; N36-L39 PolarHBondContact O-N 2.03Å; F37-L39 VanDerWaalsContact C-N 3.31Å; F37-L39 PolarHBondContact O-N 3.11Å
40W94.5Very high92.4Very high71 Ų7156 Ų5627%0.26929%0.287SS..Hα-helixtrans-78.4-30.3179.2-63.1116.3000113.1N36 F37 P38 I42 L43 G44 F83 T334 A337N36-W40 PolarHBondContact O-N 2.85Å; N36-W40 PolarHBondContact OD1-NE1 3.45Å; F37-W40 PolarHBondContact O-N 2.86Å; P38-W40 PolarHBondContact O-N 2.69Å; W40-I42 VanDerWaalsContact C-N 3.33Å; W40-I42 PolarHBondContact O-N 3.06Å; W40-L43 HydrophobicContact CE3-CD1 4.35Å; W40-L43 HydrophobicContact CZ3-CD1 4.24Å; W40-L43 PolarHBondContact O-N 3Å; W40-G44 WeakPolarHBondContact O-CA 3.13Å; W40-G44 PolarHBondContact O-N 2.97Å; W40-F83 HydrophobicContact CB-CE1 4.35Å; W40-T334 HydrophobicContact CD2-CG2 3.7Å; W40-T334 HydrophobicContact CE3-CG2 3.96Å; W40-T334 HydrophobicContact CG-CG2 4.48Å; W40-T334 HydrophobicContact CH2-CG2 3.42Å; W40-T334 VanDerWaalsContact CH2-CG2 3.42Å; W40-T334 HydrophobicContact CZ2-CG2 3.13Å; W40-T334 HydrophobicContact CZ3-CG2 3.82Å; W40-A337 HydrophobicContact CB-CB 4.4Å; W40-A337 HydrophobicContact CE3-CB 4Å
41A94.2Very high93Very high10 Ų1054.6 Ų54.68%0.08328%0.279CS..Hα-helixtrans-61.9-39.7176.400000112F37 P38 L43 G44 F45 F83F37-A41 HydrophobicContact CD1-CB 4.49Å; F37-A41 HydrophobicContact CE1-CB 4.11Å; F37-A41 HydrophobicContact CZ-CB 4.25Å; F37-A41 VanDerWaalsContact O-CB 3.24Å; F37-A41 WeakPolarHBondContact O-CB 3.32Å; F37-A41 PolarHBondContact O-N 3.13Å; P38-A41 PolarHBondContact O-N 2.98Å; A41-L43 PolarHBondContact O-N 3.07Å; A41-G44 PolarHBondContact O-N 2.91Å; A41-F45 HydrophobicContact CB-CD2 3.88Å; A41-F45 HydrophobicContact CB-CE2 3.9Å; A41-F45 WeakPolarHBondContact O-CD2 3.04Å; A41-F45 PolarHBondContact O-N 3.37Å; A41-F83 HydrophobicContact CB-CD1 4.43Å
42I94.9Very high93.4Very high126 Ų12650.7 Ų50.765%0.64626%0.259SS*.Hα-helixtrans-58.9-35.6177.3-69.8164.6000111.7P38 W40 P46P38-I42 WeakPolarHBondContact O-CG1 2.97Å; P38-I42 PolarHBondContact O-N 3.28Å; P38-I42 VanDerWaalsContact O-N 3.13Å; W40-I42 VanDerWaalsContact C-N 3.33Å; W40-I42 PolarHBondContact O-N 3.06Å; I42-P46 WeakPolarHBondContact O-CD 3.35Å; I42-P46 WeakPolarHBondContact O-CG 3.24Å
43L94.1Very high93.7Very high89 Ų8952.2 Ų52.247%0.46627%0.265SS..Hα-helixtrans-87.1-37.7175.7-67.9175.8000112.3W40 A41 G47 A337W40-L43 HydrophobicContact CE3-CD1 4.35Å; W40-L43 HydrophobicContact CZ3-CD1 4.24Å; W40-L43 PolarHBondContact O-N 3Å; A41-L43 PolarHBondContact O-N 3.07Å; L43-G47 WeakPolarHBondContact O-CA 3.12Å; L43-G47 PolarHBondContact O-N 3.06Å; L43-A337 HydrophobicContact CB-CB 4.3Å
44G95.2Very high94.2Very high0 Ų048.6 Ų48.60%025%0.248CC..Hα-helixtrans-72.1-47.2-170.600000113.9W40 A41 S48 F83W40-G44 WeakPolarHBondContact O-CA 3.13Å; W40-G44 PolarHBondContact O-N 2.97Å; A41-G44 PolarHBondContact O-N 2.91Å; G44-S48 WeakPolarHBondContact O-CB 3.34Å; G44-S48 PolarHBondContact O-N 2.79Å; G44-S48 PolarHBondContact O-OG 2.79Å; G44-F83 VanDerWaalsContact CA-CE2 3.41Å
45F96.4Very high94.4Very high58 Ų5842.4 Ų42.425%0.25423%0.225SC..Hα-helixtrans-59.8-61.3178.1-81-68.2000112.4A41 G47 S48 I49 L80 F83 I84A41-F45 HydrophobicContact CB-CD2 3.88Å; A41-F45 HydrophobicContact CB-CE2 3.9Å; A41-F45 WeakPolarHBondContact O-CD2 3.04Å; A41-F45 PolarHBondContact O-N 3.37Å; F45-G47 VanDerWaalsContact C-N 3.33Å; F45-G47 PolarHBondContact O-N 3.31Å; F45-S48 PolarHBondContact O-N 3.1Å; F45-I49 VanDerWaalsContact O-CG1 3.3Å; F45-I49 WeakPolarHBondContact O-CG1 3.38Å; F45-I49 PolarHBondContact O-N 3.21Å; F45-I49 VanDerWaalsContact O-N 3.11Å; F45-L80 HydrophobicContact CD1-CD1 3.72Å; F45-L80 HydrophobicContact CE1-CD1 4.23Å; F45-F83 HydrophobicContact CD1-CB 4.12Å; F45-F83 HydrophobicContact CD2-CB 4.37Å; F45-F83 HydrophobicContact CE1-CB 3.63Å; F45-F83 HydrophobicContact CE2-CB 3.91Å; F45-F83 HydrophobicContact CG-CB 4.46Å; F45-F83 HydrophobicContact CZ-CB 3.52Å; F45-I84 HydrophobicContact CE1-CG1 3.91Å
46P96.3Very high94.5Very high48 Ų4843 Ų4331%0.31223%0.226SC..Hα-helixtrans-64.7-39.2179.825.3-33.3000111.5I42 S48 I49 F50I42-P46 WeakPolarHBondContact O-CD 3.35Å; I42-P46 WeakPolarHBondContact O-CG 3.24Å; P46-S48 PolarHBondContact O-N 3.1Å; P46-I49 PolarHBondContact O-N 2.73Å; P46-F50 HydrophobicContact CB-CD2 4.32Å; P46-F50 HydrophobicContact CB-CE2 3.91Å; P46-F50 HydrophobicContact CB-CZ 4.48Å; P46-F50 WeakPolarHBondContact O-CB 3.21Å; P46-F50 WeakPolarHBondContact O-CD2 3.12Å; P46-F50 WeakPolarHBondContact O-CG 3.48Å; P46-F50 PolarHBondContact O-N 2.72Å
47G95.8Very high94.5Very high3 Ų343.1 Ų43.13%0.03123%0.228CC..Hα-helixtrans-60.1-42.7178.900000113L43 F45 S51 F340L43-G47 WeakPolarHBondContact O-CA 3.12Å; L43-G47 PolarHBondContact O-N 3.06Å; F45-G47 VanDerWaalsContact C-N 3.33Å; F45-G47 PolarHBondContact O-N 3.31Å; G47-S51 VanDerWaalsContact O-CB 3.26Å; G47-S51 WeakPolarHBondContact O-CB 3.46Å; G47-S51 PolarHBondContact O-N 2.85Å; G47-S51 PolarHBondContact O-OG 3.42Å; G47-F340 VanDerWaalsContact CA-CB 3.45Å; G47-F340 VanDerWaalsContact CA-CG 3.49Å; G47-F340 WeakPolarHBondContact O-CB 3.27Å
48S96.1Very high94.3Very high4 Ų450.8 Ų50.83%0.02826%0.257CS..Hα-helixtrans-67.8-45177.5-58.90000111.3G44 F45 P46 F50 S51 I52 D79G44-S48 WeakPolarHBondContact O-CB 3.34Å; G44-S48 PolarHBondContact O-N 2.79Å; G44-S48 PolarHBondContact O-OG 2.79Å; F45-S48 PolarHBondContact O-N 3.1Å; P46-S48 PolarHBondContact O-N 3.1Å; S48-F50 PolarHBondContact O-N 3.41Å; S48-S51 WeakPolarHBondContact O-CB 3.42Å; S48-S51 PolarHBondContact O-N 2.87Å; S48-I52 VanDerWaalsContact O-CG1 3.25Å; S48-I52 WeakPolarHBondContact O-CG1 3.32Å; S48-I52 PolarHBondContact O-N 3.13Å; S48-D79 WeakPolarHBondContact OG-CB 3.46Å
49I96.9Very high93.9Very high73 Ų7350.2 Ų50.237%0.37425%0.253SS..Hα-helixtrans-58.9-50.5176.7-67.6166.6000110.8F45 P46 S51 I52 I53 L80F45-I49 VanDerWaalsContact O-CG1 3.3Å; F45-I49 WeakPolarHBondContact O-CG1 3.38Å; F45-I49 PolarHBondContact O-N 3.21Å; F45-I49 VanDerWaalsContact O-N 3.11Å; P46-I49 PolarHBondContact O-N 2.73Å; I49-S51 VanDerWaalsContact C-N 3.3Å; I49-S51 PolarHBondContact O-N 3.35Å; I49-I52 PolarHBondContact O-N 3.14Å; I49-I53 HydrophobicContact CG2-CD1 3.78Å; I49-I53 WeakPolarHBondContact O-CG1 3.25Å; I49-I53 PolarHBondContact O-N 3.27Å; I49-L80 HydrophobicContact CG1-CD1 4.13Å; I49-L80 HydrophobicContact CG1-CD2 4.23Å
50F95.9Very high93.4Very high58 Ų5845.1 Ų45.125%0.25423%0.226SC..Hα-helixtrans-62.5-38.8178-64.3-33.8000112.1P46 S48 I53 V54 F340 F354 F358P46-F50 HydrophobicContact CB-CD2 4.32Å; P46-F50 HydrophobicContact CB-CE2 3.91Å; P46-F50 HydrophobicContact CB-CZ 4.48Å; P46-F50 WeakPolarHBondContact O-CB 3.21Å; P46-F50 WeakPolarHBondContact O-CD2 3.12Å; P46-F50 WeakPolarHBondContact O-CG 3.48Å; P46-F50 PolarHBondContact O-N 2.72Å; S48-F50 PolarHBondContact O-N 3.41Å; F50-I53 PolarHBondContact O-N 3.28Å; F50-V54 WeakPolarHBondContact O-CB 3.48Å; F50-V54 VanDerWaalsContact O-CG2 3.25Å; F50-V54 WeakPolarHBondContact O-CG2 3.45Å; F50-V54 PolarHBondContact O-N 3.32Å; F50-F340 HydrophobicContact CB-CD2 4.01Å; F50-F340 HydrophobicContact CB-CE2 3.56Å; F50-F340 HydrophobicContact CB-CZ 4.17Å; F50-F340 HydrophobicContact CD2-CE1 4.3Å; F50-F340 HydrophobicContact CD2-CE2 4.08Å; F50-F340 AromaticContact CD2-CZ 3.8Å; F50-F340 HydrophobicContact CD2-CZ 3.8Å; F50-F340 HydrophobicContact CG-CE2 4.28Å; F50-F340 HydrophobicContact CG-CZ 4.42Å; F50-F354 HydrophobicContact CB-CE2 4.1Å; F50-F354 HydrophobicContact CD1-CE2 4.36Å; F50-F354 AromaticContact CD2-CE2 3.99Å; F50-F354 HydrophobicContact CD2-CE2 3.99Å; F50-F354 AromaticContact CG-CE2 3.91Å; F50-F354 HydrophobicContact CG-CE2 3.91Å; F50-F358 HydrophobicContact CD1-CE1 4.11Å; F50-F358 AromaticContact CD1-CE2 3.81Å; F50-F358 HydrophobicContact CD1-CE2 3.81Å; F50-F358 AromaticContact CD1-CZ 3.33Å; F50-F358 HydrophobicContact CD1-CZ 3.33Å; F50-F358 AromaticContact CE1-CE1 3.68Å; F50-F358 HydrophobicContact CE1-CE1 3.68Å; F50-F358 HydrophobicContact CE1-CE2 4.15Å; F50-F358 AromaticContact CE1-CZ 3.4Å; F50-F358 HydrophobicContact CE1-CZ 3.4Å; F50-F358 VanDerWaalsContact CE1-CZ 3.4Å; F50-F358 HydrophobicContact CG-CE2 4.46Å; F50-F358 HydrophobicContact CG-CZ 4.37Å; F50-F358 HydrophobicContact CZ-CZ 4.48Å
51S95.1Very high92.8Very high3 Ų345.9 Ų45.92%0.02123%0.229CC..Hα-helixtrans-60.4-46.8175-63.10000111.5G47 S48 I49 W55 Y343G47-S51 VanDerWaalsContact O-CB 3.26Å; G47-S51 WeakPolarHBondContact O-CB 3.46Å; G47-S51 PolarHBondContact O-N 2.85Å; G47-S51 PolarHBondContact O-OG 3.42Å; S48-S51 WeakPolarHBondContact O-CB 3.42Å; S48-S51 PolarHBondContact O-N 2.87Å; I49-S51 VanDerWaalsContact C-N 3.3Å; I49-S51 PolarHBondContact O-N 3.35Å; S51-W55 VanDerWaalsContact O-CB 3.29Å; S51-W55 WeakPolarHBondContact O-CB 3.25Å; S51-W55 PolarHBondContact O-N 2.67Å; S51-Y343 WeakPolarHBondContact OG-CD2 3.34Å
52I96.2Very high92Very high35 Ų3555 Ų5518%0.17926%0.262CS..Hα-helixtrans-59.4-49.6177.2-64.7160.4000110.6S48 I49 S56 V77 L80S48-I52 VanDerWaalsContact O-CG1 3.25Å; S48-I52 WeakPolarHBondContact O-CG1 3.32Å; S48-I52 PolarHBondContact O-N 3.13Å; I49-I52 PolarHBondContact O-N 3.14Å; I52-S56 WeakPolarHBondContact O-CB 3.14Å; I52-S56 PolarHBondContact O-N 2.96Å; I52-S56 PolarHBondContact O-OG 3.23Å; I52-V77 HydrophobicContact CD1-CB 4.48Å; I52-V77 HydrophobicContact CD1-CG2 3.87Å; I52-V77 HydrophobicContact CG1-CG2 4.01Å; I52-V77 HydrophobicContact CG2-CG2 4.45Å; I52-L80 HydrophobicContact CD1-CB 4.39Å; I52-L80 HydrophobicContact CD1-CD2 4.05Å
53I95.5Very high90.6Very high75 Ų7551.7 Ų51.739%0.38526%0.258SS..Hα-helixtrans-61.2-50.9-177.6-68.1168.9000110.8I49 F50 S56 S57 I357I49-I53 HydrophobicContact CG2-CD1 3.78Å; I49-I53 WeakPolarHBondContact O-CG1 3.25Å; I49-I53 PolarHBondContact O-N 3.27Å; F50-I53 PolarHBondContact O-N 3.28Å; I53-S56 PolarHBondContact O-N 2.86Å; I53-S57 PolarHBondContact O-N 2.88Å; I53-I357 HydrophobicContact CG2-CD1 4.24Å; I53-I357 HydrophobicContact CG2-CG2 4.49Å
54V94.1Very high89.5Confident0 Ų048.9 Ų48.90%025%0.25CS..Hα-helixtrans-66.1-47.8-176.4175.20000110.6F50 S56 S57 M60 F350 E353 F354 I357F50-V54 WeakPolarHBondContact O-CB 3.48Å; F50-V54 VanDerWaalsContact O-CG2 3.25Å; F50-V54 WeakPolarHBondContact O-CG2 3.45Å; F50-V54 PolarHBondContact O-N 3.32Å; V54-S56 VanDerWaalsContact C-N 3.33Å; V54-S56 PolarHBondContact O-N 3.35Å; V54-S57 WeakPolarHBondContact O-CB 3.49Å; V54-S57 PolarHBondContact O-N 3.23Å; V54-S57 PolarHBondContact O-OG 3.21Å; V54-M60 HydrophobicContact CG1-CG 4.44Å; V54-M60 WeakPolarHBondContact O-CG 3.19Å; V54-F350 HydrophobicContact CB-CD2 4.02Å; V54-F350 HydrophobicContact CB-CE2 3.55Å; V54-F350 HydrophobicContact CB-CZ 3.99Å; V54-F350 HydrophobicContact CG1-CD2 3.36Å; V54-F350 HydrophobicContact CG1-CE2 3.45Å; V54-F350 VanDerWaalsContact CG1-CE2 3.45Å; V54-F350 HydrophobicContact CG1-CG 3.93Å; V54-F350 HydrophobicContact CG1-CZ 4.09Å; V54-F350 HydrophobicContact CG2-CE2 4.26Å; V54-F350 HydrophobicContact CG2-CZ 4.2Å; V54-E353 HydrophobicContact CG1-CB 3.87Å; V54-F354 HydrophobicContact CG2-CB 4.13Å; V54-F354 HydrophobicContact CG2-CD2 4.04Å; V54-I357 HydrophobicContact CG2-CD1 4.29Å
55W92.6Very high88.5Confident12 Ų1249.8 Ų49.85%0.04526%0.257CS..Hα-helixtrans-68.3-30.4-178.8-74.5119.2000113.4S51 S57 M60 A69 Q72 A73 T272 Y343 F350S51-W55 VanDerWaalsContact O-CB 3.29Å; S51-W55 WeakPolarHBondContact O-CB 3.25Å; S51-W55 PolarHBondContact O-N 2.67Å; W55-S57 PolarHBondContact O-N 3.05Å; W55-M60 HydrophobicContact CE3-CB 4.38Å; W55-M60 HydrophobicContact CE3-CG 4.13Å; W55-M60 HydrophobicContact CE3-SD 3.78Å; W55-M60 HydrophobicContact CH2-SD 4.44Å; W55-M60 HydrophobicContact CZ3-SD 3.63Å; W55-A69 HydrophobicContact CE3-CB 4.14Å; W55-Q72 HydrophobicContact CB-CB 4.46Å; W55-Q72 HydrophobicContact CD2-CB 3.82Å; W55-Q72 HydrophobicContact CD2-CG 4.47Å; W55-Q72 HydrophobicContact CE3-CB 4.38Å; W55-Q72 HydrophobicContact CG-CB 3.84Å; W55-Q72 HydrophobicContact CZ2-CG 4.44Å; W55-A73 HydrophobicContact CB-CB 3.97Å; W55-T272 HydrophobicContact CZ2-CG2 4.47Å; W55-Y343 HydrophobicContact CZ2-CD1 4.45Å; W55-Y343 HydrophobicContact CZ2-CG 4.42Å; W55-Y343 AromaticContact NE1-CD2 3.35Å; W55-Y343 AromaticContact NE1-CE2 3.4Å; W55-Y343 AromaticContact NE1-CG 3.9Å; W55-Y343 AromaticContact NE1-CZ 3.97Å; W55-F350 AromaticContact CD1-CE2 3.77Å; W55-F350 HydrophobicContact CD2-CD2 4.21Å; W55-F350 HydrophobicContact CD2-CE2 4.5Å; W55-F350 AromaticContact CE2-CD2 3.63Å; W55-F350 AromaticContact CE2-CE2 3.97Å; W55-F350 HydrophobicContact CG-CE2 4.38Å; W55-F350 AromaticContact CZ2-CD2 3.9Å; W55-F350 HydrophobicContact CZ2-CD2 3.9Å; W55-F350 AromaticContact NE1-CD2 3.62Å; W55-F350 AromaticContact NE1-CE2 3.46Å
56S92Very high87.9Confident54 Ų5448.1 Ų48.138%0.37825%0.254SS..Hα-helixtrans-74.2-15.4176-60.50000113.5I52 I53 V54 R61I52-S56 WeakPolarHBondContact O-CB 3.14Å; I52-S56 PolarHBondContact O-N 2.96Å; I52-S56 PolarHBondContact O-OG 3.23Å; I53-S56 PolarHBondContact O-N 2.86Å; V54-S56 VanDerWaalsContact C-N 3.33Å; V54-S56 PolarHBondContact O-N 3.35Å; S56-R61 PolarHBondContact O-NE 3.41Å; S56-R61 PolarHBondContact O-NH2 3.18Å
57S90.7Very high87.4Confident17 Ų1746 Ų4612%0.11924%0.24CC..SBendtrans-58.1147.8-178.875.50000112.6I53 V54 W55 M60 R61I53-S57 PolarHBondContact O-N 2.88Å; V54-S57 WeakPolarHBondContact O-CB 3.49Å; V54-S57 PolarHBondContact O-N 3.23Å; V54-S57 PolarHBondContact O-OG 3.21Å; W55-S57 PolarHBondContact O-N 3.05Å; S57-M60 PolarHBondContact O-N 3.24Å; S57-M60 WeakPolarHBondContact OG-CG 3.28Å; S57-R61 PolarHBondContact O-N 3.05Å
58R86.8Confident86.8Confident171 Ų17145.9 Ų45.965%0.64524%0.239SC*.Hα-helixtrans-59.9-41.5179.2-69.1-179.2178.8-174.8-0.4112.8M60 R61 R62R58-M60 VanDerWaalsContact C-N 3.34Å; R58-M60 PolarHBondContact O-N 3.13Å; R58-R61 PolarHBondContact O-N 3.13Å; R58-R62 PolarHBondContact O-N 3.03Å; R58-R62 VanDerWaalsContact O-N 3.1Å
59P84.6Confident86.5Confident40 Ų4045.8 Ų45.826%0.2624%0.239SC..Hα-helixtrans-64.4-35.6178.7-25.738.1000113.3R61 R62 G63 Q349 E353P59-R61 PolarHBondContact O-N 3.08Å; P59-R62 PolarHBondContact O-N 3.41Å; P59-G63 PolarHBondContact O-N 2.86Å; P59-Q349 PolarHBondContact O-NE2 3.13Å; P59-E353 HydrophobicContact CB-CG 4.34Å; P59-E353 VanDerWaalsContact CB-OE1 3.22Å; P59-E353 WeakPolarHBondContact CB-OE1 3.49Å
60M83.2Confident86.3Confident1 Ų142.8 Ų42.81%0.00522%0.224CC..Hα-helixtrans-59.9-45.8173.7-81.3-62.1129.800112.1V54 W55 S57 R58 R62 G64 A69 Q349 E353V54-M60 HydrophobicContact CG1-CG 4.44Å; V54-M60 WeakPolarHBondContact O-CG 3.19Å; W55-M60 HydrophobicContact CE3-CB 4.38Å; W55-M60 HydrophobicContact CE3-CG 4.13Å; W55-M60 HydrophobicContact CE3-SD 3.78Å; W55-M60 HydrophobicContact CH2-SD 4.44Å; W55-M60 HydrophobicContact CZ3-SD 3.63Å; S57-M60 PolarHBondContact O-N 3.24Å; S57-M60 WeakPolarHBondContact OG-CG 3.28Å; R58-M60 VanDerWaalsContact C-N 3.34Å; R58-M60 PolarHBondContact O-N 3.13Å; M60-R62 PolarHBondContact O-N 3.27Å; M60-G64 PolarHBondContact O-N 3.44Å; M60-A69 HydrophobicContact CB-CB 4.4Å; M60-Q349 HydrophobicContact CE-CB 3.68Å; M60-Q349 VanDerWaalsContact CE-CD 3.5Å; M60-Q349 HydrophobicContact CE-CG 3.31Å; M60-Q349 WeakPolarHBondContact CE-O 3.49Å; M60-Q349 HydrophobicContact SD-CG 4.29Å; M60-E353 HydrophobicContact CE-CB 3.81Å; M60-E353 HydrophobicContact CE-CG 3.21Å; M60-E353 HydrophobicContact CG-CG 4.36Å
61R82.7Confident86.1Confident87 Ų8740.1 Ų40.133%0.32821%0.212SC..Hα-helixtrans-69.9-28.5-178.9-68.9-176.6-71.5174.3-6.2114.3S56 S57 R58 P59 A66 A69S56-R61 PolarHBondContact O-NE 3.41Å; S56-R61 PolarHBondContact O-NH2 3.18Å; S57-R61 PolarHBondContact O-N 3.05Å; R58-R61 PolarHBondContact O-N 3.13Å; P59-R61 PolarHBondContact O-N 3.08Å; R61-A66 WeakPolarHBondContact O-CA 3.25Å; R61-A66 WeakPolarHBondContact O-CB 3.29Å; R61-A69 HydrophobicContact CG-CB 4.06Å
62R76.6Confident85.9Confident202 Ų20240.1 Ų40.176%0.76221%0.212SC*.Hα-helixtrans-94.6-36.4-178.5-71.1-176.8176.2152-3.1113.8R58 P59 M60R58-R62 PolarHBondContact O-N 3.03Å; R58-R62 VanDerWaalsContact O-N 3.1Å; P59-R62 PolarHBondContact O-N 3.41Å; M60-R62 PolarHBondContact O-N 3.27Å
63G66.4Low85.8Confident55 Ų5539 Ų3957%0.56721%0.207SC*.Hα-helixtrans-81.1-25.6-177.900000113.8P59P59-G63 PolarHBondContact O-N 2.86Å
64G69.6Low85.7Confident30 Ų3036.4 Ų36.431%0.30920%0.196SC..SBendtrans-113.3-158175.700000112.8M60 A66M60-G64 PolarHBondContact O-N 3.44Å; G64-A66 PolarHBondContact O-N 2.97Å
65S76.2Confident85.7Confident19 Ų1936.5 Ų36.513%0.13320%0.197CC..  trans-76.4121.4165.8167.60000110.2A67 A68 A69 R131 S148S65-A67 PolarHBondContact O-N 3.09Å; S65-A67 PolarHBondContact OG-N 3.26Å; S65-A68 WeakPolarHBondContact O-CB 3.49Å; S65-A68 PolarHBondContact O-N 2.95Å; S65-A68 PolarHBondContact OG-N 2.9Å; S65-A69 PolarHBondContact O-N 2.83Å; S65-A69 VanDerWaalsContact O-N 3.07Å; S65-R131 VanDerWaalsContact CB-CZ 3.46Å; S65-R131 PolarHBondContact OG-NH2 2.83Å; S65-S148 PolarHBondContact OG-OG 3.03Å
66A82.5Confident85.9Confident24 Ų2436 Ų3620%0.19820%0.195CC..Hα-helixtrans-55.8-39.7174.200000112.3R61 G64 V70R61-A66 WeakPolarHBondContact O-CA 3.25Å; R61-A66 WeakPolarHBondContact O-CB 3.29Å; G64-A66 PolarHBondContact O-N 2.97Å; A66-V70 WeakPolarHBondContact O-CG2 3.06Å; A66-V70 PolarHBondContact O-N 3.39Å
67A85.2Confident86.1Confident2 Ų236.7 Ų36.72%0.01720%0.197CC..Hα-helixtrans-68.1-42.5178.600000111.6S65 A69 V70 Y71 A153S65-A67 PolarHBondContact O-N 3.09Å; S65-A67 PolarHBondContact OG-N 3.26Å; A67-A69 PolarHBondContact O-N 3.49Å; A67-V70 PolarHBondContact O-N 2.86Å; A67-V70 VanDerWaalsContact O-N 3.16Å; A67-Y71 HydrophobicContact CB-CE2 4.14Å; A67-Y71 WeakPolarHBondContact O-CD2 3.33Å; A67-Y71 PolarHBondContact O-N 3.36Å; A67-A153 HydrophobicContact CB-CB 4.2Å
68A84.9Confident86.4Confident2 Ų236.3 Ų36.32%0.01719%0.194CC..Hα-helixtrans-59.4-46177.700000112.1S65 V70 Y71 Q72 F127S65-A68 WeakPolarHBondContact O-CB 3.49Å; S65-A68 PolarHBondContact O-N 2.95Å; S65-A68 PolarHBondContact OG-N 2.9Å; A68-V70 PolarHBondContact O-N 3Å; A68-Y71 PolarHBondContact O-N 3.26Å; A68-Q72 WeakPolarHBondContact O-CB 3.38Å; A68-Q72 VanDerWaalsContact O-CG 3.25Å; A68-Q72 WeakPolarHBondContact O-CG 3.43Å; A68-Q72 PolarHBondContact O-N 3.38Å; A68-F127 HydrophobicContact CB-CD2 4.42Å; A68-F127 HydrophobicContact CB-CE2 3.44Å; A68-F127 VanDerWaalsContact CB-CE2 3.44Å; A68-F127 HydrophobicContact CB-CZ 4.05Å
69A89.1Confident86.8Confident2 Ų228.3 Ų28.32%0.01716%0.164CC..Hα-helixtrans-60.2-36.617800000112W55 M60 R61 S65 A67 A73W55-A69 HydrophobicContact CE3-CB 4.14Å; M60-A69 HydrophobicContact CB-CB 4.4Å; R61-A69 HydrophobicContact CG-CB 4.06Å; S65-A69 PolarHBondContact O-N 2.83Å; S65-A69 VanDerWaalsContact O-N 3.07Å; A67-A69 PolarHBondContact O-N 3.49Å; A69-A73 WeakPolarHBondContact O-CB 3.32Å; A69-A73 PolarHBondContact O-N 3.44Å
70V91.7Very high87.4Confident9 Ų928.2 Ų28.26%0.05516%0.161CC..Hα-helixtrans-70.7-47.3178.3176.80000111.1A66 A67 A68 Q72 A73 S74 L150 A153 F154 I157A66-V70 WeakPolarHBondContact O-CG2 3.06Å; A66-V70 PolarHBondContact O-N 3.39Å; A67-V70 PolarHBondContact O-N 2.86Å; A67-V70 VanDerWaalsContact O-N 3.16Å; A68-V70 PolarHBondContact O-N 3Å; V70-Q72 PolarHBondContact O-N 3.32Å; V70-A73 PolarHBondContact O-N 2.87Å; V70-S74 WeakPolarHBondContact O-CB 3.49Å; V70-S74 PolarHBondContact O-N 2.87Å; V70-S74 PolarHBondContact O-OG 3.23Å; V70-S74 VanDerWaalsContact O-OG 3.1Å; V70-L150 HydrophobicContact CB-CD1 4.4Å; V70-L150 HydrophobicContact CG2-CD1 3.11Å; V70-A153 HydrophobicContact CB-CB 4.29Å; V70-A153 HydrophobicContact CG1-CB 4.13Å; V70-F154 HydrophobicContact CG1-CD1 4.2Å; V70-F154 HydrophobicContact CG1-CE1 3.9Å; V70-F154 HydrophobicContact CG1-CE2 4.44Å; V70-F154 HydrophobicContact CG1-CZ 4.04Å; V70-I157 HydrophobicContact CG1-CD1 3.7Å
71Y91.5Very high88.1Confident2 Ų230.5 Ų30.51%0.00818%0.176CC..Hα-helixtrans-59.2-38.6175.9-68.2-58.4000111.9A67 A68 S74 L75 T126 F127 E130 A153 I157A67-Y71 HydrophobicContact CB-CE2 4.14Å; A67-Y71 WeakPolarHBondContact O-CD2 3.33Å; A67-Y71 PolarHBondContact O-N 3.36Å; A68-Y71 PolarHBondContact O-N 3.26Å; Y71-S74 PolarHBondContact O-N 3.22Å; Y71-L75 WeakPolarHBondContact O-CB 3.15Å; Y71-L75 WeakPolarHBondContact O-CG 3.25Å; Y71-L75 PolarHBondContact O-N 3.13Å; Y71-T126 HydrophobicContact CD1-CG2 4.47Å; Y71-T126 HydrophobicContact CE1-CG2 3.69Å; Y71-F127 HydrophobicContact CD2-CB 4.45Å; Y71-F127 AromaticContact CD2-CD2 3.93Å; Y71-F127 HydrophobicContact CD2-CD2 3.93Å; Y71-F127 HydrophobicContact CG-CB 4.31Å; Y71-F127 HydrophobicContact CG-CD2 4.35Å; Y71-E130 HydrophobicContact CE2-CB 4.24Å; Y71-E130 HydrophobicContact CE2-CG 4.11Å; Y71-A153 HydrophobicContact CE1-CB 4.49Å; Y71-A153 HydrophobicContact CE2-CB 4.35Å; Y71-I157 HydrophobicContact CD1-CD1 3.88Å; Y71-I157 HydrophobicContact CD1-CG1 3.82Å; Y71-I157 HydrophobicContact CE1-CD1 4.06Å; Y71-I157 HydrophobicContact CE1-CG1 3.75Å
72Q91.4Very high88.7Confident4 Ų426.7 Ų26.72%0.01916%0.162CC..Hα-helixtrans-70.4-40177.1-68.8-66.54.200113.2W55 A68 V70 S74 L75 G76 F127 Y343W55-Q72 HydrophobicContact CB-CB 4.46Å; W55-Q72 HydrophobicContact CD2-CB 3.82Å; W55-Q72 HydrophobicContact CD2-CG 4.47Å; W55-Q72 HydrophobicContact CE3-CB 4.38Å; W55-Q72 HydrophobicContact CG-CB 3.84Å; W55-Q72 HydrophobicContact CZ2-CG 4.44Å; A68-Q72 WeakPolarHBondContact O-CB 3.38Å; A68-Q72 VanDerWaalsContact O-CG 3.25Å; A68-Q72 WeakPolarHBondContact O-CG 3.43Å; A68-Q72 PolarHBondContact O-N 3.38Å; V70-Q72 PolarHBondContact O-N 3.32Å; Q72-S74 VanDerWaalsContact C-N 3.34Å; Q72-L75 PolarHBondContact O-N 3.3Å; Q72-G76 PolarHBondContact O-N 3.11Å; Q72-F127 HydrophobicContact CG-CE1 4.33Å; Q72-F127 HydrophobicContact CG-CZ 4.4Å; Q72-Y343 PolarHBondContact OE1-OH 2.88Å
73A94.2Very high89.6Confident11 Ų1117.2 Ų17.29%0.09113%0.126CC..Hα-helixtrans-62.7-43.5172.400000110.9W55 A69 V70 G76 V77W55-A73 HydrophobicContact CB-CB 3.97Å; A69-A73 WeakPolarHBondContact O-CB 3.32Å; A69-A73 PolarHBondContact O-N 3.44Å; V70-A73 PolarHBondContact O-N 2.87Å; A73-G76 PolarHBondContact O-N 3.06Å; A73-G76 VanDerWaalsContact O-N 3.16Å; A73-V77 PolarHBondContact O-N 3.44Å
74S94.8Very high91Very high20 Ų2018.5 Ų18.514%0.1412%0.119CC..Hα-helixtrans-63.5-41.7175.9-64.70000112.5V70 Y71 Q72 G76 V77 V78 I157V70-S74 WeakPolarHBondContact O-CB 3.49Å; V70-S74 PolarHBondContact O-N 2.87Å; V70-S74 PolarHBondContact O-OG 3.23Å; V70-S74 VanDerWaalsContact O-OG 3.1Å; Y71-S74 PolarHBondContact O-N 3.22Å; Q72-S74 VanDerWaalsContact C-N 3.34Å; S74-G76 VanDerWaalsContact C-N 3.28Å; S74-G76 PolarHBondContact O-N 2.97Å; S74-V77 WeakPolarHBondContact O-CB 3.44Å; S74-V77 PolarHBondContact O-N 3.49Å; S74-V77 VanDerWaalsContact O-N 3.1Å; S74-V78 WeakPolarHBondContact O-CG2 3.41Å; S74-V78 PolarHBondContact O-N 3.25Å; S74-I157 WeakPolarHBondContact OG-CD1 3.42Å
75L94Very high92.2Very high3 Ų318.6 Ų18.62%0.01611%0.112CC..Hα-helixtrans-57.9-42.8171.5-81.6169000111.3Y71 Q72 V77 V78 D79 L123Y71-L75 WeakPolarHBondContact O-CB 3.15Å; Y71-L75 WeakPolarHBondContact O-CG 3.25Å; Y71-L75 PolarHBondContact O-N 3.13Å; Q72-L75 PolarHBondContact O-N 3.3Å; L75-V77 VanDerWaalsContact C-N 3.29Å; L75-V77 PolarHBondContact O-N 2.68Å; L75-V78 WeakPolarHBondContact O-CB 3.46Å; L75-V78 PolarHBondContact O-N 3.37Å; L75-V78 VanDerWaalsContact O-N 3.14Å; L75-D79 PolarHBondContact O-N 3.31Å; L75-D79 VanDerWaalsContact O-OD2 3.13Å; L75-L123 HydrophobicContact CD2-CB 3.58Å; L75-L123 HydrophobicContact CD2-CD1 4.16Å; L75-L123 HydrophobicContact CG-CB 3.98Å; L75-L123 HydrophobicContact CG-CD1 4.37Å
76G95.7Very high93Very high1 Ų119 Ų191%0.0111%0.112CC..Hα-helixtrans-60.7-35.8174.500000113.4Q72 A73 S74 L80Q72-G76 PolarHBondContact O-N 3.11Å; A73-G76 PolarHBondContact O-N 3.06Å; A73-G76 VanDerWaalsContact O-N 3.16Å; S74-G76 VanDerWaalsContact C-N 3.28Å; S74-G76 PolarHBondContact O-N 2.97Å; G76-L80 WeakPolarHBondContact O-CB 3.43Å; G76-L80 PolarHBondContact O-N 2.82Å
77V96.8Very high93.5Very high69 Ų6920.9 Ų20.942%0.41812%0.119SC..Hα-helixtrans-65.1-44.8173175.20000110.8I52 A73 S74 L75 D79 L80 C81I52-V77 HydrophobicContact CD1-CB 4.48Å; I52-V77 HydrophobicContact CD1-CG2 3.87Å; I52-V77 HydrophobicContact CG1-CG2 4.01Å; I52-V77 HydrophobicContact CG2-CG2 4.45Å; A73-V77 PolarHBondContact O-N 3.44Å; S74-V77 WeakPolarHBondContact O-CB 3.44Å; S74-V77 PolarHBondContact O-N 3.49Å; S74-V77 VanDerWaalsContact O-N 3.1Å; L75-V77 VanDerWaalsContact C-N 3.29Å; L75-V77 PolarHBondContact O-N 2.68Å; V77-D79 VanDerWaalsContact C-N 3.33Å; V77-D79 PolarHBondContact O-N 3.31Å; V77-L80 PolarHBondContact O-N 2.71Å; V77-C81 WeakPolarHBondContact O-CB 3.18Å; V77-C81 PolarHBondContact O-N 3.48Å; V77-C81 PolarHBondContact O-SG 3.42Å
78V96.7Very high93.9Very high9 Ų923.4 Ų23.46%0.05513%0.132CC..Hα-helixtrans-60.9-43.4177.3176.40000111.2S74 L75 C81 F82 I116 L119 L123S74-V78 WeakPolarHBondContact O-CG2 3.41Å; S74-V78 PolarHBondContact O-N 3.25Å; L75-V78 WeakPolarHBondContact O-CB 3.46Å; L75-V78 PolarHBondContact O-N 3.37Å; L75-V78 VanDerWaalsContact O-N 3.14Å; V78-C81 PolarHBondContact O-N 3.03Å; V78-F82 WeakPolarHBondContact O-CB 2.96Å; V78-F82 PolarHBondContact O-N 3.1Å; V78-I116 HydrophobicContact CG1-CG2 3.87Å; V78-L119 HydrophobicContact CG1-CB 4.32Å; V78-L119 HydrophobicContact CG2-CB 4.41Å; V78-L119 HydrophobicContact CG2-CD2 3.43Å; V78-L119 VanDerWaalsContact CG2-CD2 3.43Å; V78-L119 HydrophobicContact CG2-CG 3.78Å; V78-L123 HydrophobicContact CG2-CD1 3.72Å
79D95.7Very high94.1Very high3 Ų328 Ų282%0.01615%0.149CC..Hα-helixtrans-63.8-41.8177.8-58.3-25.6000111.5S48 L75 V77 F82 F83 Y336 K339S48-D79 WeakPolarHBondContact OG-CB 3.46Å; L75-D79 PolarHBondContact O-N 3.31Å; L75-D79 VanDerWaalsContact O-OD2 3.13Å; V77-D79 VanDerWaalsContact C-N 3.33Å; V77-D79 PolarHBondContact O-N 3.31Å; D79-F82 WeakPolarHBondContact O-CB 3.37Å; D79-F82 PolarHBondContact O-N 3.09Å; D79-F83 WeakPolarHBondContact O-CD2 3.3Å; D79-F83 PolarHBondContact O-N 3.3Å; D79-F83 VanDerWaalsContact O-N 3.14Å; D79-Y336 HydrophobicContact CB-CD1 4.41Å; D79-Y336 WeakPolarHBondContact OD1-CD1 3.3Å; D79-K339 IonicContact OD1-NZ 3.35Å; D79-K339 PolarHBondContact OD1-NZ 3.16Å; D79-K339 VanDerWaalsContact OD2-CD 3.25Å; D79-K339 WeakPolarHBondContact OD2-CD 3.18Å; D79-K339 WeakPolarHBondContact OD2-CE 3.42Å; D79-K339 IonicContact OD2-NZ 3.38Å; D79-K339 PolarHBondContact OD2-NZ 2.98Å
80L97Very high94.1Very high37 Ų3728.9 Ų28.919%0.19415%0.152CC..Hα-helixtrans-63.3-46.2175-177.962.4000111.5F45 I49 I52 G76 V77 F82 F83 I84F45-L80 HydrophobicContact CD1-CD1 3.72Å; F45-L80 HydrophobicContact CE1-CD1 4.23Å; I49-L80 HydrophobicContact CG1-CD1 4.13Å; I49-L80 HydrophobicContact CG1-CD2 4.23Å; I52-L80 HydrophobicContact CD1-CB 4.39Å; I52-L80 HydrophobicContact CD1-CD2 4.05Å; G76-L80 WeakPolarHBondContact O-CB 3.43Å; G76-L80 PolarHBondContact O-N 2.82Å; V77-L80 PolarHBondContact O-N 2.71Å; L80-F82 VanDerWaalsContact C-N 3.27Å; L80-F82 PolarHBondContact O-N 3.45Å; L80-F83 PolarHBondContact O-N 3.24Å; L80-I84 HydrophobicContact CG-CD1 4.18Å; L80-I84 WeakPolarHBondContact O-CG1 3.24Å; L80-I84 PolarHBondContact O-N 3.39Å; L80-I84 VanDerWaalsContact O-N 3.13Å
81C96.8Very high94.1Very high49 Ų4930.8 Ų30.833%0.33116%0.161SC..Hα-helixtrans-60.4-38.7175.4-70.50000111.5V77 V78 I84 I85 I116V77-C81 WeakPolarHBondContact O-CB 3.18Å; V77-C81 PolarHBondContact O-N 3.48Å; V77-C81 PolarHBondContact O-SG 3.42Å; V78-C81 PolarHBondContact O-N 3.03Å; C81-I84 PolarHBondContact O-N 2.94Å; C81-I85 WeakPolarHBondContact O-CB 3.23Å; C81-I85 WeakPolarHBondContact O-CG1 3.35Å; C81-I85 PolarHBondContact O-N 3.5Å; C81-I116 HydrophobicContact CB-CD1 3.77Å; C81-I116 HydrophobicContact CB-CG1 4.26Å
82F96.2Very high93.9Very high7 Ų732.6 Ų32.63%0.03117%0.17CC..Hα-helixtrans-56.8-51.8174.9175.5-96.2000110.8V78 D79 L80 I84 I85 H86 I116 Q117 M333 Y336V78-F82 WeakPolarHBondContact O-CB 2.96Å; V78-F82 PolarHBondContact O-N 3.1Å; D79-F82 WeakPolarHBondContact O-CB 3.37Å; D79-F82 PolarHBondContact O-N 3.09Å; L80-F82 VanDerWaalsContact C-N 3.27Å; L80-F82 PolarHBondContact O-N 3.45Å; F82-I84 VanDerWaalsContact C-N 3.32Å; F82-I84 PolarHBondContact O-N 2.87Å; F82-I85 PolarHBondContact O-N 2.92Å; F82-H86 HydrophobicContact CE1-CB 4.2Å; F82-H86 HydrophobicContact CE2-CB 4.32Å; F82-H86 AromaticContact CE2-ND1 3.94Å; F82-H86 HydrophobicContact CZ-CB 4.1Å; F82-H86 AromaticContact CZ-CG 3.86Å; F82-H86 AromaticContact CZ-ND1 3.66Å; F82-H86 WeakPolarHBondContact O-CA 3.48Å; F82-H86 WeakPolarHBondContact O-CB 3.16Å; F82-H86 PolarHBondContact O-N 3.28Å; F82-I116 HydrophobicContact CB-CG2 3.63Å; F82-I116 HydrophobicContact CD2-CG2 4.25Å; F82-I116 HydrophobicContact CG-CG2 4.46Å; F82-Q117 HydrophobicContact CD2-CG 4.48Å; F82-Q117 HydrophobicContact CE2-CG 4.33Å; F82-M333 HydrophobicContact CZ-CG 4.45Å; F82-Y336 HydrophobicContact CB-CD1 3.95Å; F82-Y336 HydrophobicContact CB-CE1 4.06Å; F82-Y336 HydrophobicContact CB-CG 4.34Å; F82-Y336 AromaticContact CD1-CD1 3.98Å; F82-Y336 HydrophobicContact CD1-CD1 3.98Å; F82-Y336 AromaticContact CD1-CD2 3.43Å; F82-Y336 HydrophobicContact CD1-CD2 3.43Å; F82-Y336 VanDerWaalsContact CD1-CD2 3.43Å; F82-Y336 HydrophobicContact CD1-CE1 4.37Å; F82-Y336 AromaticContact CD1-CE2 3.85Å; F82-Y336 HydrophobicContact CD1-CE2 3.85Å; F82-Y336 AromaticContact CD1-CG 3.49Å; F82-Y336 HydrophobicContact CD1-CG 3.49Å; F82-Y336 VanDerWaalsContact CD1-CG 3.49Å; F82-Y336 HydrophobicContact CD2-CD1 4.44Å; F82-Y336 HydrophobicContact CD2-CD2 4.16Å; F82-Y336 HydrophobicContact CD2-CE1 4.03Å; F82-Y336 AromaticContact CD2-CE2 3.68Å; F82-Y336 HydrophobicContact CD2-CE2 3.68Å; F82-Y336 AromaticContact CD2-CZ 3.63Å; F82-Y336 AromaticContact CE1-CD2 3.32Å; F82-Y336 HydrophobicContact CE1-CD2 3.32Å; F82-Y336 AromaticContact CE1-CE2 3.67Å; F82-Y336 HydrophobicContact CE1-CE2 3.67Å; F82-Y336 AromaticContact CE1-CG 3.88Å; F82-Y336 HydrophobicContact CE1-CG 3.88Å; F82-Y336 HydrophobicContact CE2-CD2 4.06Å; F82-Y336 AromaticContact CE2-CE2 3.49Å; F82-Y336 HydrophobicContact CE2-CE2 3.49Å; F82-Y336 VanDerWaalsContact CE2-CE2 3.49Å; F82-Y336 AromaticContact CE2-CZ 3.85Å; F82-Y336 AromaticContact CG-CD1 3.85Å; F82-Y336 HydrophobicContact CG-CD1 3.85Å; F82-Y336 AromaticContact CG-CD2 3.87Å; F82-Y336 HydrophobicContact CG-CD2 3.87Å; F82-Y336 AromaticContact CG-CE1 3.88Å; F82-Y336 HydrophobicContact CG-CE1 3.88Å; F82-Y336 AromaticContact CG-CE2 3.86Å; F82-Y336 HydrophobicContact CG-CE2 3.86Å; F82-Y336 AromaticContact CG-CG 3.85Å; F82-Y336 HydrophobicContact CG-CG 3.85Å; F82-Y336 AromaticContact CG-CZ 3.88Å; F82-Y336 AromaticContact CZ-CD2 3.65Å; F82-Y336 HydrophobicContact CZ-CD2 3.65Å; F82-Y336 AromaticContact CZ-CE2 3.49Å; F82-Y336 HydrophobicContact CZ-CE2 3.49Å; F82-Y336 VanDerWaalsContact CZ-CE2 3.49Å
83F95.8Very high93.5Very high3 Ų334.8 Ų34.81%0.01318%0.184CC..Hα-helixtrans-62.9-37179.7-74.4-68.9000113.2F37 W40 A41 G44 F45 D79 L80 L87 A337F37-F83 AromaticContact CE2-CD1 3.9Å; F37-F83 HydrophobicContact CE2-CD1 3.9Å; F37-F83 HydrophobicContact CZ-CD1 4.36Å; W40-F83 HydrophobicContact CB-CE1 4.35Å; A41-F83 HydrophobicContact CB-CD1 4.43Å; G44-F83 VanDerWaalsContact CA-CE2 3.41Å; F45-F83 HydrophobicContact CD1-CB 4.12Å; F45-F83 HydrophobicContact CD2-CB 4.37Å; F45-F83 HydrophobicContact CE1-CB 3.63Å; F45-F83 HydrophobicContact CE2-CB 3.91Å; F45-F83 HydrophobicContact CG-CB 4.46Å; F45-F83 HydrophobicContact CZ-CB 3.52Å; D79-F83 WeakPolarHBondContact O-CD2 3.3Å; D79-F83 PolarHBondContact O-N 3.3Å; D79-F83 VanDerWaalsContact O-N 3.14Å; L80-F83 PolarHBondContact O-N 3.24Å; F83-L87 VanDerWaalsContact O-CB 3.27Å; F83-L87 WeakPolarHBondContact O-CB 3.26Å; F83-L87 PolarHBondContact O-N 2.84Å; F83-A337 HydrophobicContact CZ-CB 3.95Å
84I95.3Very high93Very high82 Ų8235 Ų3542%0.42119%0.185SC..Hα-helixtrans-65.2-48.9177.2-65.2168.7000110.9F45 L80 C81 F82 L87 N88F45-I84 HydrophobicContact CE1-CG1 3.91Å; L80-I84 HydrophobicContact CG-CD1 4.18Å; L80-I84 WeakPolarHBondContact O-CG1 3.24Å; L80-I84 PolarHBondContact O-N 3.39Å; L80-I84 VanDerWaalsContact O-N 3.13Å; C81-I84 PolarHBondContact O-N 2.94Å; F82-I84 VanDerWaalsContact C-N 3.32Å; F82-I84 PolarHBondContact O-N 2.87Å; I84-L87 WeakPolarHBondContact O-CB 3.46Å; I84-N88 PolarHBondContact O-ND2 3.25Å
85I94.5Very high92.5Very high32 Ų3241.5 Ų41.516%0.16421%0.207CC..Hα-helixtrans-71.6-44-177.7-65-61000110.6C81 F82 L87 N88 W89 F109 I112 N113 I116C81-I85 WeakPolarHBondContact O-CB 3.23Å; C81-I85 WeakPolarHBondContact O-CG1 3.35Å; C81-I85 PolarHBondContact O-N 3.5Å; F82-I85 PolarHBondContact O-N 2.92Å; I85-L87 VanDerWaalsContact C-N 3.25Å; I85-L87 PolarHBondContact O-N 3.36Å; I85-N88 WeakPolarHBondContact O-CB 3.38Å; I85-N88 PolarHBondContact O-N 2.88Å; I85-W89 PolarHBondContact O-N 2.87Å; I85-F109 HydrophobicContact CG2-CD2 4.25Å; I85-F109 HydrophobicContact CG2-CE2 3.5Å; I85-F109 VanDerWaalsContact CG2-CE2 3.5Å; I85-F109 HydrophobicContact CG2-CZ 3.83Å; I85-F109 WeakPolarHBondContact O-CE2 3.46Å; I85-I112 HydrophobicContact CD1-CG2 3.78Å; I85-I112 HydrophobicContact CG1-CG2 3.81Å; I85-I112 HydrophobicContact CG2-CG2 4.35Å; I85-N113 HydrophobicContact CG2-CB 4.08Å; I85-I116 HydrophobicContact CB-CD1 4.05Å; I85-I116 HydrophobicContact CG1-CD1 3.59Å
86H93.2Very high91.9Very high29 Ų2947.6 Ų47.613%0.13424%0.235CC..Hα-helixtrans-66.3-26.5178.8-162.991.1000112.6F37 F82 N88 W89 Y90F37-H86 AromaticContact CD2-CD2 3.34Å; F37-H86 WeakPolarHBondContact CD2-CD2 3.36Å; F37-H86 HydrophobicContact CE2-CB 4.1Å; F37-H86 AromaticContact CE2-CD2 3.54Å; F82-H86 HydrophobicContact CE1-CB 4.2Å; F82-H86 HydrophobicContact CE2-CB 4.32Å; F82-H86 AromaticContact CE2-ND1 3.94Å; F82-H86 HydrophobicContact CZ-CB 4.1Å; F82-H86 AromaticContact CZ-CG 3.86Å; F82-H86 AromaticContact CZ-ND1 3.66Å; F82-H86 WeakPolarHBondContact O-CA 3.48Å; F82-H86 WeakPolarHBondContact O-CB 3.16Å; F82-H86 PolarHBondContact O-N 3.28Å; H86-N88 VanDerWaalsContact C-N 3.29Å; H86-N88 PolarHBondContact O-N 2.9Å; H86-W89 AromaticContact CE1-CD1 3.89Å; H86-W89 PolarHBondContact O-N 2.85Å; H86-Y90 VanDerWaalsContact O-CB 3.26Å; H86-Y90 WeakPolarHBondContact O-CB 3.42Å; H86-Y90 PolarHBondContact O-N 3.23Å
87L93.6Very high91.3Very high63 Ų6351.6 Ų51.633%0.3326%0.256SS..Hα-helixtrans-58.2-41.6169.9174.664.6000111.5F37 F83 I84 I85 Y90 L91F37-L87 HydrophobicContact CE1-CB 4.07Å; F37-L87 HydrophobicContact CE1-CD1 3.63Å; F37-L87 HydrophobicContact CE1-CG 4.46Å; F37-L87 HydrophobicContact CZ-CB 3.78Å; F37-L87 HydrophobicContact CZ-CD1 4.24Å; F83-L87 VanDerWaalsContact O-CB 3.27Å; F83-L87 WeakPolarHBondContact O-CB 3.26Å; F83-L87 PolarHBondContact O-N 2.84Å; I84-L87 WeakPolarHBondContact O-CB 3.46Å; I85-L87 VanDerWaalsContact C-N 3.25Å; I85-L87 PolarHBondContact O-N 3.36Å; L87-Y90 PolarHBondContact O-N 3.31Å; L87-L91 HydrophobicContact CD1-CD1 4.19Å; L87-L91 HydrophobicContact CD1-CG 4.17Å; L87-L91 HydrophobicContact CG-CD1 4.11Å; L87-L91 HydrophobicContact CG-CG 4.49Å; L87-L91 WeakPolarHBondContact O-CB 3.27Å; L87-L91 VanDerWaalsContact O-CG 3.28Å; L87-L91 WeakPolarHBondContact O-CG 3.35Å; L87-L91 PolarHBondContact O-N 3.43Å
88N92.2Very high90.6Very high54 Ų5450.1 Ų50.129%0.28925%0.254SS..Hα-helixtrans-66.6-43.2179-67.7-84000111.3I84 I85 H86 Y90 L91 H92 L100 F109I84-N88 PolarHBondContact O-ND2 3.25Å; I85-N88 WeakPolarHBondContact O-CB 3.38Å; I85-N88 PolarHBondContact O-N 2.88Å; H86-N88 VanDerWaalsContact C-N 3.29Å; H86-N88 PolarHBondContact O-N 2.9Å; N88-Y90 VanDerWaalsContact C-N 3.34Å; N88-Y90 PolarHBondContact O-N 3.35Å; N88-L91 PolarHBondContact O-N 2.8Å; N88-H92 WeakPolarHBondContact O-CB 3.23Å; N88-H92 PolarHBondContact O-N 2.84Å; N88-L100 HydrophobicContact CB-CD1 4.39Å; N88-F109 HydrophobicContact CB-CE2 4.06Å
89W90.3Very high90.1Very high99 Ų9951.9 Ų51.938%0.37527%0.265SS..Hα-helixtrans-58.7-45.5171.9177.4-103.9000112.3I85 H86 H92 V93 L100 F109I85-W89 PolarHBondContact O-N 2.87Å; H86-W89 AromaticContact CE1-CD1 3.89Å; H86-W89 PolarHBondContact O-N 2.85Å; W89-H92 PolarHBondContact O-N 3.34Å; W89-V93 HydrophobicContact CD2-CG2 3.86Å; W89-V93 HydrophobicContact CE3-CG2 4.21Å; W89-V93 HydrophobicContact CG-CG2 4.45Å; W89-V93 HydrophobicContact CH2-CG2 3.98Å; W89-V93 HydrophobicContact CZ2-CG2 3.6Å; W89-V93 HydrophobicContact CZ3-CG2 4.27Å; W89-V93 PolarHBondContact O-N 3.08Å; W89-L100 HydrophobicContact CE3-CD2 4.14Å; W89-L100 HydrophobicContact CZ3-CD2 4.46Å; W89-F109 HydrophobicContact CB-CE1 4.18Å; W89-F109 HydrophobicContact CB-CZ 3.66Å; W89-F109 HydrophobicContact CD2-CE1 4.43Å; W89-F109 AromaticContact CE3-CE1 3.74Å; W89-F109 HydrophobicContact CE3-CE1 3.74Å; W89-F109 HydrophobicContact CE3-CZ 4.38Å
90Y89.8Confident89.7Confident21 Ų2152 Ų528%0.08227%0.265CS..Hα-helixtrans-62.5-44.3179.6174.5-103.3000112.1R34 F37 P38 H86 L87 N88 H92 A94 W95R34-Y90 WeakPolarHBondContact CA-OH 3.47Å; R34-Y90 PolarHBondContact O-OH 3.04Å; F37-Y90 HydrophobicContact CB-CD1 4.47Å; F37-Y90 HydrophobicContact CB-CD2 3.71Å; F37-Y90 HydrophobicContact CB-CE2 3.97Å; F37-Y90 HydrophobicContact CB-CG 3.99Å; F37-Y90 AromaticContact CD1-CD1 3.67Å; F37-Y90 HydrophobicContact CD1-CD1 3.67Å; F37-Y90 HydrophobicContact CD1-CD2 4.37Å; F37-Y90 HydrophobicContact CD1-CE1 4.15Å; F37-Y90 AromaticContact CD1-CG 3.8Å; F37-Y90 HydrophobicContact CD1-CG 3.8Å; F37-Y90 HydrophobicContact CE1-CD1 4.32Å; F37-Y90 HydrophobicContact CG-CD1 4.29Å; F37-Y90 HydrophobicContact CG-CD2 4.19Å; F37-Y90 AromaticContact CG-CG 3.96Å; F37-Y90 HydrophobicContact CG-CG 3.96Å; P38-Y90 HydrophobicContact CG-CE1 4.46Å; H86-Y90 VanDerWaalsContact O-CB 3.26Å; H86-Y90 WeakPolarHBondContact O-CB 3.42Å; H86-Y90 PolarHBondContact O-N 3.23Å; L87-Y90 PolarHBondContact O-N 3.31Å; N88-Y90 VanDerWaalsContact C-N 3.34Å; N88-Y90 PolarHBondContact O-N 3.35Å; Y90-H92 VanDerWaalsContact C-N 3.26Å; Y90-H92 PolarHBondContact O-N 3.42Å; Y90-A94 HydrophobicContact CD2-CB 3.74Å; Y90-A94 HydrophobicContact CE2-CB 3.42Å; Y90-A94 VanDerWaalsContact CE2-CB 3.42Å; Y90-A94 HydrophobicContact CG-CB 4.45Å; Y90-A94 VanDerWaalsContact O-CB 3.23Å; Y90-A94 WeakPolarHBondContact O-CB 3.18Å; Y90-A94 PolarHBondContact O-N 2.88Å; Y90-W95 AromaticContact CE1-CD1 3.66Å; Y90-W95 AromaticContact CE1-NE1 3.4Å; Y90-W95 AromaticContact CZ-CD1 3.93Å; Y90-W95 AromaticContact CZ-NE1 3.55Å; Y90-W95 PolarHBondContact OH-NE1 3.48Å
91L90Very high89.2Confident48 Ų4852 Ų5225%0.25127%0.265SS..Hα-helixtrans-62.1-36.5174.6-70.6171.2000111.6L87 N88 W95 Q96 L97 V99L87-L91 HydrophobicContact CD1-CD1 4.19Å; L87-L91 HydrophobicContact CD1-CG 4.17Å; L87-L91 HydrophobicContact CG-CD1 4.11Å; L87-L91 HydrophobicContact CG-CG 4.49Å; L87-L91 WeakPolarHBondContact O-CB 3.27Å; L87-L91 VanDerWaalsContact O-CG 3.28Å; L87-L91 WeakPolarHBondContact O-CG 3.35Å; L87-L91 PolarHBondContact O-N 3.43Å; N88-L91 PolarHBondContact O-N 2.8Å; L91-W95 CarbonylContact O-C 3.32Å; L91-W95 WeakPolarHBondContact O-CA 3.28Å; L91-W95 VanDerWaalsContact O-CB 3.28Å; L91-W95 WeakPolarHBondContact O-CB 3.5Å; L91-W95 PolarHBondContact O-N 3.33Å; L91-Q96 PolarHBondContact O-N 2.83Å; L91-L97 HydrophobicContact CB-CD1 4.07Å; L91-L97 HydrophobicContact CD2-CD1 3.79Å; L91-L97 HydrophobicContact CG-CD1 4.43Å; L91-L97 PolarHBondContact O-N 2.69Å; L91-L97 VanDerWaalsContact O-N 3.13Å; L91-V99 HydrophobicContact CB-CG2 4.3Å
92H87Confident88.9Confident40 Ų4054.4 Ų54.419%0.18527%0.272CS..Hα-helixtrans-72-50.3177.8-174.969.2000113.3N88 W89 Y90 Q96 L97 L100 D101N88-H92 WeakPolarHBondContact O-CB 3.23Å; N88-H92 PolarHBondContact O-N 2.84Å; W89-H92 PolarHBondContact O-N 3.34Å; Y90-H92 VanDerWaalsContact C-N 3.26Å; Y90-H92 PolarHBondContact O-N 3.42Å; H92-Q96 WeakPolarHBondContact O-CA 3.49Å; H92-Q96 PolarHBondContact O-N 3.42Å; H92-Q96 VanDerWaalsContact O-N 3.08Å; H92-L97 VanDerWaalsContact CA-O 3.25Å; H92-L97 WeakPolarHBondContact CA-O 3.41Å; H92-L97 PolarHBondContact ND1-O 2.9Å; H92-L97 VanDerWaalsContact ND1-O 3.13Å; H92-L100 HydrophobicContact CB-CD1 3.58Å; H92-D101 IonicContact CE1-OD1 3.04Å; H92-D101 IonicContact CE1-OD2 3.96Å
93V84Confident88.4Confident51 Ų5157.4 Ų57.431%0.30929%0.292SS..Hα-helixtrans-79-50.1-175.8177.70000112.3W89 Q96W89-V93 HydrophobicContact CD2-CG2 3.86Å; W89-V93 HydrophobicContact CE3-CG2 4.21Å; W89-V93 HydrophobicContact CG-CG2 4.45Å; W89-V93 HydrophobicContact CH2-CG2 3.98Å; W89-V93 HydrophobicContact CZ2-CG2 3.6Å; W89-V93 HydrophobicContact CZ3-CG2 4.27Å; W89-V93 PolarHBondContact O-N 3.08Å; V93-Q96 PolarHBondContact O-NE2 2.88Å
94A83.2Confident88.1Confident14 Ų1462.3 Ų62.312%0.11632%0.322CS..Hα-helixtrans-80.9-32.9-171.700000113R34 Y90R34-A94 HydrophobicContact CG-CB 4.21Å; R34-A94 PolarHBondContact NE-O 3.44Å; R34-A94 PolarHBondContact NH2-O 3.18Å; Y90-A94 HydrophobicContact CD2-CB 3.74Å; Y90-A94 HydrophobicContact CE2-CB 3.42Å; Y90-A94 VanDerWaalsContact CE2-CB 3.42Å; Y90-A94 HydrophobicContact CG-CB 4.45Å; Y90-A94 VanDerWaalsContact O-CB 3.23Å; Y90-A94 WeakPolarHBondContact O-CB 3.18Å; Y90-A94 PolarHBondContact O-N 2.88Å
95W84Confident87.9Confident158 Ų15862 Ų6260%0.59832%0.32SS*.Hα-helixtrans-106.7-4.8-178.4-6880.4000114.1Y90 L91 L97Y90-W95 AromaticContact CE1-CD1 3.66Å; Y90-W95 AromaticContact CE1-NE1 3.4Å; Y90-W95 AromaticContact CZ-CD1 3.93Å; Y90-W95 AromaticContact CZ-NE1 3.55Å; Y90-W95 PolarHBondContact OH-NE1 3.48Å; L91-W95 CarbonylContact O-C 3.32Å; L91-W95 WeakPolarHBondContact O-CA 3.28Å; L91-W95 VanDerWaalsContact O-CB 3.28Å; L91-W95 WeakPolarHBondContact O-CB 3.5Å; L91-W95 PolarHBondContact O-N 3.33Å; W95-L97 HydrophobicContact CB-CD1 3.86Å; W95-L97 HydrophobicContact CB-CG 4.1Å; W95-L97 PolarHBondContact O-N 3.01Å; W95-L97 VanDerWaalsContact O-N 3.13Å
96Q81.2Confident87.8Confident131 Ų13160.5 Ų60.561%0.61231%0.312SS*.  trans55.829.8178.1-59.1-69.1-41.400112.4L91 H92 V93L91-Q96 PolarHBondContact O-N 2.83Å; H92-Q96 WeakPolarHBondContact O-CA 3.49Å; H92-Q96 PolarHBondContact O-N 3.42Å; H92-Q96 VanDerWaalsContact O-N 3.08Å; V93-Q96 PolarHBondContact O-NE2 2.88Å
97L83.4Confident87.7Confident85 Ų8562.5 Ų62.545%0.44532%0.322SS..  trans-81.1120.3170.9-67.6160.1000106.6L91 H92 W95 V99L91-L97 HydrophobicContact CB-CD1 4.07Å; L91-L97 HydrophobicContact CD2-CD1 3.79Å; L91-L97 HydrophobicContact CG-CD1 4.43Å; L91-L97 PolarHBondContact O-N 2.69Å; L91-L97 VanDerWaalsContact O-N 3.13Å; H92-L97 VanDerWaalsContact CA-O 3.25Å; H92-L97 WeakPolarHBondContact CA-O 3.41Å; H92-L97 PolarHBondContact ND1-O 2.9Å; H92-L97 VanDerWaalsContact ND1-O 3.13Å; W95-L97 HydrophobicContact CB-CD1 3.86Å; W95-L97 HydrophobicContact CB-CG 4.1Å; W95-L97 PolarHBondContact O-N 3.01Å; W95-L97 VanDerWaalsContact O-N 3.13Å; L97-V99 HydrophobicContact CB-CG2 3.75Å; L97-V99 PolarHBondContact O-N 3.14Å
98G83.4Confident87.7Confident37 Ų3762.4 Ų62.438%0.38132%0.324SS..  trans-66.840.5-18000000115.3L100 D101G98-L100 PolarHBondContact O-N 2.97Å; G98-D101 WeakPolarHBondContact CA-OD2 3.5Å; G98-D101 PolarHBondContact O-N 3.47Å; G98-D101 VanDerWaalsContact O-N 3.13Å
99V86.5Confident87.8Confident46 Ų4660.5 Ų60.528%0.27931%0.313SS..THydrogen-bonded Turntrans-62.8-28.9-176.4-173.80000111.7L91 L97L91-V99 HydrophobicContact CB-CG2 4.3Å; L97-V99 HydrophobicContact CB-CG2 3.75Å; L97-V99 PolarHBondContact O-N 3.14Å
100L86Confident87.9Confident6 Ų656.3 Ų56.33%0.03130%0.299CS..THydrogen-bonded Turntrans-90.1-8.9178.5-83.876.8000113.3N88 W89 H92 G98 H102 I105 C106 F109N88-L100 HydrophobicContact CB-CD1 4.39Å; W89-L100 HydrophobicContact CE3-CD2 4.14Å; W89-L100 HydrophobicContact CZ3-CD2 4.46Å; H92-L100 HydrophobicContact CB-CD1 3.58Å; G98-L100 PolarHBondContact O-N 2.97Å; L100-H102 PolarHBondContact O-N 3.35Å; L100-I105 HydrophobicContact CG-CG2 4.49Å; L100-C106 PolarHBondContact O-N 3.26Å; L100-F109 HydrophobicContact CD2-CB 4.25Å; L100-F109 HydrophobicContact CD2-CD1 3.35Å; L100-F109 HydrophobicContact CD2-CD2 4.24Å; L100-F109 HydrophobicContact CD2-CE1 3.78Å; L100-F109 HydrophobicContact CD2-CG 3.65Å; L100-F109 HydrophobicContact CD2-CZ 4.42Å; L100-F109 HydrophobicContact CG-CB 4.5Å; L100-F109 HydrophobicContact CG-CD1 4.27Å; L100-F109 HydrophobicContact CG-CD2 4.35Å; L100-F109 HydrophobicContact CG-CG 4.09Å
101D87Confident88.2Confident36 Ų3656.1 Ų56.119%0.19330%0.3CS..  trans-81.649-174.7-63.2-49.2000112.6H92 G98 Y177 C182H92-D101 IonicContact CE1-OD1 3.04Å; H92-D101 IonicContact CE1-OD2 3.96Å; G98-D101 WeakPolarHBondContact CA-OD2 3.5Å; G98-D101 PolarHBondContact O-N 3.47Å; G98-D101 VanDerWaalsContact O-N 3.13Å; D101-Y177 VanDerWaalsContact O-CE2 3.27Å; D101-Y177 WeakPolarHBondContact O-CE2 3.34Å; D101-C182 PolarHBondContact OD1-N 3.41Å
102H89.5Confident88.4Confident101 Ų10156.8 Ų56.847%0.46830%0.303SS..SBendtrans-126.5142.7173.9-67.3-63.6000110L100 V104 I105 C106L100-H102 PolarHBondContact O-N 3.35Å; H102-V104 VanDerWaalsContact C-N 3.34Å; H102-V104 PolarHBondContact O-N 3.48Å; H102-I105 HydrophobicContact CB-CB 4.09Å; H102-I105 HydrophobicContact CB-CD1 4.04Å; H102-I105 HydrophobicContact CB-CG1 4.08Å; H102-I105 PolarHBondContact O-N 3.01Å; H102-I105 VanDerWaalsContact O-N 3.11Å; H102-C106 VanDerWaalsContact O-CB 3.32Å; H102-C106 WeakPolarHBondContact O-CB 3.44Å; H102-C106 PolarHBondContact O-N 2.91Å
103P85.8Confident88.8Confident69 Ų6955.8 Ų55.845%0.44830%0.299SS..Hα-helixtrans-56.4-42.5-168.619-32.2000113.9Y177P103-Y177 HydrophobicContact CB-CD1 3.82Å; P103-Y177 HydrophobicContact CB-CE1 4.33Å; P103-Y177 HydrophobicContact CB-CG 4.11Å
104V90.2Very high89.3Confident107 Ų10755.5 Ų55.565%0.64829%0.293SS*.Hα-helixtrans-80.8-36.3179.6-179.30000112H102 T108H102-V104 VanDerWaalsContact C-N 3.34Å; H102-V104 PolarHBondContact O-N 3.48Å; V104-T108 WeakPolarHBondContact O-CB 3.26Å; V104-T108 PolarHBondContact O-N 2.89Å; V104-T108 VanDerWaalsContact O-N 3.08Å; V104-T108 PolarHBondContact O-OG1 2.84Å
105I92Very high90Very high75 Ų7555.6 Ų55.639%0.38529%0.291SS..Hα-helixtrans-71.7-42.3-175.9-59.1-179.2000109.9L100 H102 E107 T108 F109L100-I105 HydrophobicContact CG-CG2 4.49Å; H102-I105 HydrophobicContact CB-CB 4.09Å; H102-I105 HydrophobicContact CB-CD1 4.04Å; H102-I105 HydrophobicContact CB-CG1 4.08Å; H102-I105 PolarHBondContact O-N 3.01Å; H102-I105 VanDerWaalsContact O-N 3.11Å; I105-E107 VanDerWaalsContact C-N 3.32Å; I105-E107 PolarHBondContact O-N 3.3Å; I105-T108 PolarHBondContact O-N 2.94Å; I105-F109 HydrophobicContact CG2-CB 4.26Å; I105-F109 WeakPolarHBondContact O-CA 3.28Å; I105-F109 WeakPolarHBondContact O-CB 3.26Å; I105-F109 PolarHBondContact O-N 3.19Å
106C91Very high90.5Very high0 Ų048.7 Ų48.70%027%0.266CS..Hα-helixtrans-54.1-45.9178.5173.90000112.6L100 H102 P110 C182L100-C106 PolarHBondContact O-N 3.26Å; H102-C106 VanDerWaalsContact O-CB 3.32Å; H102-C106 WeakPolarHBondContact O-CB 3.44Å; H102-C106 PolarHBondContact O-N 2.91Å; C106-P110 WeakPolarHBondContact O-CD 3.35Å; C106-P110 WeakPolarHBondContact O-CG 3.06Å; C106-C182 WeakPolarHBondContact CA-SG 3.33Å; C106-C182 HydrophobicContact CB-CB 3.68Å; C106-C182 WeakPolarHBondContact CB-SG 3.14Å; C106-C182 WeakPolarHBondContact SG-CA 3.21Å; C106-C182 WeakPolarHBondContact SG-CB 3.38Å; C106-C182 CovalentContact SG-SG 2.03Å; C106-C182 PolarHBondContact SG-SG 3.32Å
107E91.6Very high91.2Very high71 Ų7144.5 Ų44.533%0.33225%0.246SC..Hα-helixtrans-81-36.1-177.8-61.1-175.3-161.700112.6I105 R185I105-E107 VanDerWaalsContact C-N 3.32Å; I105-E107 PolarHBondContact O-N 3.3Å; E107-R185 IonicContact OE2-NH2 3.88Å
108T93.1Very high91.7Very high61 Ų6140.5 Ų40.537%0.37423%0.225SC..Hα-helixtrans-83.4-31-174.9-50.80000112.4V104 I105 V111 I112V104-T108 WeakPolarHBondContact O-CB 3.26Å; V104-T108 PolarHBondContact O-N 2.89Å; V104-T108 VanDerWaalsContact O-N 3.08Å; V104-T108 PolarHBondContact O-OG1 2.84Å; I105-T108 PolarHBondContact O-N 2.94Å; T108-V111 WeakPolarHBondContact O-CB 3.44Å; T108-V111 PolarHBondContact O-N 3.45Å; T108-I112 HydrophobicContact CG2-CD1 3.74Å; T108-I112 HydrophobicContact CG2-CG1 4.11Å; T108-I112 PolarHBondContact O-N 3.35Å
109F94.3Very high92.3Very high15 Ų1539.3 Ų39.37%0.06621%0.21CC..Hα-helixtrans-58.6-50.1-176.5174.8-84.8000112.7I85 N88 W89 L100 I105 V111 I112 N113I85-F109 HydrophobicContact CG2-CD2 4.25Å; I85-F109 HydrophobicContact CG2-CE2 3.5Å; I85-F109 VanDerWaalsContact CG2-CE2 3.5Å; I85-F109 HydrophobicContact CG2-CZ 3.83Å; I85-F109 WeakPolarHBondContact O-CE2 3.46Å; N88-F109 HydrophobicContact CB-CE2 4.06Å; W89-F109 HydrophobicContact CB-CE1 4.18Å; W89-F109 HydrophobicContact CB-CZ 3.66Å; W89-F109 HydrophobicContact CD2-CE1 4.43Å; W89-F109 AromaticContact CE3-CE1 3.74Å; W89-F109 HydrophobicContact CE3-CE1 3.74Å; W89-F109 HydrophobicContact CE3-CZ 4.38Å; L100-F109 HydrophobicContact CD2-CB 4.25Å; L100-F109 HydrophobicContact CD2-CD1 3.35Å; L100-F109 HydrophobicContact CD2-CD2 4.24Å; L100-F109 HydrophobicContact CD2-CE1 3.78Å; L100-F109 HydrophobicContact CD2-CG 3.65Å; L100-F109 HydrophobicContact CD2-CZ 4.42Å; L100-F109 HydrophobicContact CG-CB 4.5Å; L100-F109 HydrophobicContact CG-CD1 4.27Å; L100-F109 HydrophobicContact CG-CD2 4.35Å; L100-F109 HydrophobicContact CG-CG 4.09Å; I105-F109 HydrophobicContact CG2-CB 4.26Å; I105-F109 WeakPolarHBondContact O-CA 3.28Å; I105-F109 WeakPolarHBondContact O-CB 3.26Å; I105-F109 PolarHBondContact O-N 3.19Å; F109-V111 VanDerWaalsContact C-N 3.3Å; F109-V111 PolarHBondContact O-N 3.47Å; F109-I112 PolarHBondContact O-N 2.89Å; F109-N113 HydrophobicContact CD1-CB 4.49Å; F109-N113 HydrophobicContact CE1-CB 3.98Å; F109-N113 HydrophobicContact CZ-CB 4.13Å; F109-N113 VanDerWaalsContact O-CB 3.27Å; F109-N113 WeakPolarHBondContact O-CB 3.41Å; F109-N113 PolarHBondContact O-N 2.91Å
110P92.9Very high92.7Very high10 Ų1037.1 Ų37.17%0.06520%0.197CC..Hα-helixtrans-56.8-43.4176.5-24.834.3000111.9C106 I112 N113 Y114 Q171 Y175C106-P110 WeakPolarHBondContact O-CD 3.35Å; C106-P110 WeakPolarHBondContact O-CG 3.06Å; P110-I112 PolarHBondContact O-N 3.01Å; P110-N113 PolarHBondContact O-N 3.34Å; P110-Y114 WeakPolarHBondContact O-CB 3.33Å; P110-Y114 VanDerWaalsContact O-CD2 3.26Å; P110-Y114 WeakPolarHBondContact O-CD2 3.46Å; P110-Y114 PolarHBondContact O-N 3.34Å; P110-Q171 HydrophobicContact CB-CB 4.11Å; P110-Y175 HydrophobicContact CB-CD2 3.84Å; P110-Y175 HydrophobicContact CB-CE2 3.93Å; P110-Y175 HydrophobicContact CG-CD2 3.44Å; P110-Y175 VanDerWaalsContact CG-CD2 3.44Å; P110-Y175 HydrophobicContact CG-CE2 3.82Å; P110-Y175 HydrophobicContact CG-CG 3.87Å
111V95.4Very high93Very high17 Ų1736.9 Ų36.910%0.10320%0.196CC..Hα-helixtrans-58.8-48.4178.6179.10000111.2T108 F109 L115 L165 A168 Q171 A172T108-V111 WeakPolarHBondContact O-CB 3.44Å; T108-V111 PolarHBondContact O-N 3.45Å; F109-V111 VanDerWaalsContact C-N 3.3Å; F109-V111 PolarHBondContact O-N 3.47Å; V111-L115 WeakPolarHBondContact O-CB 3.19Å; V111-L115 PolarHBondContact O-N 2.88Å; V111-L165 HydrophobicContact CG1-CD1 4.21Å; V111-A168 HydrophobicContact CG1-CB 4.37Å; V111-Q171 HydrophobicContact CG2-CB 4.34Å; V111-A172 HydrophobicContact CG2-CB 3.65Å
112I95.9Very high93.4Very high63 Ų6335.2 Ų35.232%0.32319%0.187SC..Hα-helixtrans-66.2-42.9179.2-64.8174.5000110.8I85 T108 F109 P110 L115 I116I85-I112 HydrophobicContact CD1-CG2 3.78Å; I85-I112 HydrophobicContact CG1-CG2 3.81Å; I85-I112 HydrophobicContact CG2-CG2 4.35Å; T108-I112 HydrophobicContact CG2-CD1 3.74Å; T108-I112 HydrophobicContact CG2-CG1 4.11Å; T108-I112 PolarHBondContact O-N 3.35Å; F109-I112 PolarHBondContact O-N 2.89Å; P110-I112 PolarHBondContact O-N 3.01Å; I112-L115 WeakPolarHBondContact O-CB 3.16Å; I112-L115 PolarHBondContact O-N 3.28Å; I112-I116 HydrophobicContact CG2-CD1 3.87Å; I112-I116 WeakPolarHBondContact O-CG1 3.47Å; I112-I116 PolarHBondContact O-N 3.18Å; I112-I116 VanDerWaalsContact O-N 3.08Å
113N94.8Very high93.6Very high19 Ų1930.5 Ų30.510%0.10217%0.165CC..Hα-helixtrans-61.2-46.4-179.8-17548.8000111.6I85 F109 P110 Q117I85-N113 HydrophobicContact CG2-CB 4.08Å; F109-N113 HydrophobicContact CD1-CB 4.49Å; F109-N113 HydrophobicContact CE1-CB 3.98Å; F109-N113 HydrophobicContact CZ-CB 4.13Å; F109-N113 VanDerWaalsContact O-CB 3.27Å; F109-N113 WeakPolarHBondContact O-CB 3.41Å; F109-N113 PolarHBondContact O-N 2.91Å; P110-N113 PolarHBondContact O-N 3.34Å; N113-Q117 PolarHBondContact ND2-NE2 3.28Å; N113-Q117 VanDerWaalsContact ND2-NE2 3.14Å; N113-Q117 WeakPolarHBondContact O-CG 2.99Å; N113-Q117 PolarHBondContact O-N 3.2Å; N113-Q117 PolarHBondContact O-NE2 3.38Å; N113-Q117 PolarHBondContact OD1-NE2 3.04Å
114Y94.7Very high93.8Very high45 Ų4527.6 Ų27.618%0.17615%0.147CC..Hα-helixtrans-70.9-37.7176.3-83.5-78.9000112.6P110 I116 Q117 Y118 Q171P110-Y114 WeakPolarHBondContact O-CB 3.33Å; P110-Y114 VanDerWaalsContact O-CD2 3.26Å; P110-Y114 WeakPolarHBondContact O-CD2 3.46Å; P110-Y114 PolarHBondContact O-N 3.34Å; Y114-I116 VanDerWaalsContact C-N 3.32Å; Y114-I116 PolarHBondContact O-N 3.05Å; Y114-Q117 PolarHBondContact O-N 3.49Å; Y114-Y118 AromaticContact CD1-CE1 3.87Å; Y114-Y118 HydrophobicContact CD1-CE1 3.87Å; Y114-Y118 HydrophobicContact CD1-CE2 4.38Å; Y114-Y118 AromaticContact CD1-CZ 3.66Å; Y114-Y118 WeakPolarHBondContact CD1-OH 3.2Å; Y114-Y118 WeakPolarHBondContact O-CB 3.29Å; Y114-Y118 PolarHBondContact O-N 2.81Å; Y114-Q171 HydrophobicContact CD2-CB 4.3Å; Y114-Q171 HydrophobicContact CD2-CG 3.62Å; Y114-Q171 HydrophobicContact CE2-CG 4.13Å; Y114-Q171 HydrophobicContact CG-CG 3.97Å
115L97Very high94Very high15 Ų1524.5 Ų24.58%0.07912%0.124CC..Hα-helixtrans-53.4-49.7174.3166.363.3000111.3V111 I112 Y118 L119 F161 C164 L165 A168V111-L115 WeakPolarHBondContact O-CB 3.19Å; V111-L115 PolarHBondContact O-N 2.88Å; I112-L115 WeakPolarHBondContact O-CB 3.16Å; I112-L115 PolarHBondContact O-N 3.28Å; L115-Y118 PolarHBondContact O-N 3.4Å; L115-L119 WeakPolarHBondContact O-CB 3.4Å; L115-L119 PolarHBondContact O-N 2.88Å; L115-F161 HydrophobicContact CD1-CD2 4.37Å; L115-F161 HydrophobicContact CD1-CE2 4.26Å; L115-F161 HydrophobicContact CD2-CE2 3.81Å; L115-F161 HydrophobicContact CD2-CZ 3.94Å; L115-F161 HydrophobicContact CG-CE2 4.4Å; L115-C164 HydrophobicContact CD1-CB 3.72Å; L115-L165 HydrophobicContact CD1-CB 4.07Å; L115-L165 HydrophobicContact CD2-CD1 4.08Å; L115-A168 HydrophobicContact CB-CB 4.07Å
116I96Very high93.9Very high13 Ų1321.1 Ų21.17%0.06711%0.108CC..Hα-helixtrans-64.4-44.5-179.2-68.1165.5000110.7V78 C81 F82 I85 I112 Y114 Y118 L119 S120V78-I116 HydrophobicContact CG1-CG2 3.87Å; C81-I116 HydrophobicContact CB-CD1 3.77Å; C81-I116 HydrophobicContact CB-CG1 4.26Å; F82-I116 HydrophobicContact CB-CG2 3.63Å; F82-I116 HydrophobicContact CD2-CG2 4.25Å; F82-I116 HydrophobicContact CG-CG2 4.46Å; I85-I116 HydrophobicContact CB-CD1 4.05Å; I85-I116 HydrophobicContact CG1-CD1 3.59Å; I112-I116 HydrophobicContact CG2-CD1 3.87Å; I112-I116 WeakPolarHBondContact O-CG1 3.47Å; I112-I116 PolarHBondContact O-N 3.18Å; I112-I116 VanDerWaalsContact O-N 3.08Å; Y114-I116 VanDerWaalsContact C-N 3.32Å; Y114-I116 PolarHBondContact O-N 3.05Å; I116-Y118 VanDerWaalsContact C-N 3.33Å; I116-Y118 PolarHBondContact O-N 2.87Å; I116-L119 PolarHBondContact O-N 3.39Å; I116-S120 PolarHBondContact O-N 3.35Å
117Q94Very high93.8Very high44 Ų4421.3 Ų21.321%0.20611%0.108CC..Hα-helixtrans-63.7-36.4178.2-72.3-179.775.300112.8F82 N113 Y114 P121 F211F82-Q117 HydrophobicContact CD2-CG 4.48Å; F82-Q117 HydrophobicContact CE2-CG 4.33Å; N113-Q117 PolarHBondContact ND2-NE2 3.28Å; N113-Q117 VanDerWaalsContact ND2-NE2 3.14Å; N113-Q117 WeakPolarHBondContact O-CG 2.99Å; N113-Q117 PolarHBondContact O-N 3.2Å; N113-Q117 PolarHBondContact O-NE2 3.38Å; N113-Q117 PolarHBondContact OD1-NE2 3.04Å; Y114-Q117 PolarHBondContact O-N 3.49Å; Q117-P121 WeakPolarHBondContact O-CD 3.35Å; Q117-F211 HydrophobicContact CB-CZ 4.42Å
118Y95.5Very high93.7Very high0 Ų018 Ų180%09%0.093CC..Hα-helixtrans-75.2-34.2175.4-65.8-13.8000112Y114 L115 I116 S120 P121 T122 A168 T206 Y210 F211Y114-Y118 AromaticContact CD1-CE1 3.87Å; Y114-Y118 HydrophobicContact CD1-CE1 3.87Å; Y114-Y118 HydrophobicContact CD1-CE2 4.38Å; Y114-Y118 AromaticContact CD1-CZ 3.66Å; Y114-Y118 WeakPolarHBondContact CD1-OH 3.2Å; Y114-Y118 WeakPolarHBondContact O-CB 3.29Å; Y114-Y118 PolarHBondContact O-N 2.81Å; L115-Y118 PolarHBondContact O-N 3.4Å; I116-Y118 VanDerWaalsContact C-N 3.33Å; I116-Y118 PolarHBondContact O-N 2.87Å; Y118-S120 PolarHBondContact O-N 3.48Å; Y118-P121 WeakPolarHBondContact O-CD 3.38Å; Y118-P121 WeakPolarHBondContact O-CG 3.47Å; Y118-T122 WeakPolarHBondContact O-CB 3.44Å; Y118-T122 PolarHBondContact O-N 2.88Å; Y118-T122 PolarHBondContact O-OG1 2.83Å; Y118-A168 HydrophobicContact CD2-CB 4.21Å; Y118-A168 HydrophobicContact CE2-CB 4.33Å; Y118-T206 PolarHBondContact OH-OG1 3.16Å; Y118-T206 VanDerWaalsContact OH-OG1 3.13Å; Y118-Y210 HydrophobicContact CD1-CD1 4.38Å; Y118-Y210 AromaticContact CD1-CD2 3.47Å; Y118-Y210 HydrophobicContact CD1-CD2 3.47Å; Y118-Y210 VanDerWaalsContact CD1-CD2 3.47Å; Y118-Y210 HydrophobicContact CD1-CE2 4.02Å; Y118-Y210 AromaticContact CD1-CG 3.69Å; Y118-Y210 HydrophobicContact CD1-CG 3.69Å; Y118-Y210 AromaticContact CD2-CD2 3.91Å; Y118-Y210 HydrophobicContact CD2-CD2 3.91Å; Y118-Y210 AromaticContact CD2-CE2 3.57Å; Y118-Y210 HydrophobicContact CD2-CE2 3.57Å; Y118-Y210 AromaticContact CE1-CD2 3.73Å; Y118-Y210 HydrophobicContact CE1-CD2 3.73Å; Y118-Y210 HydrophobicContact CE1-CE2 4.35Å; Y118-Y210 HydrophobicContact CE1-CG 4.28Å; Y118-Y210 HydrophobicContact CE2-CD2 4.14Å; Y118-Y210 AromaticContact CE2-CE2 3.93Å; Y118-Y210 HydrophobicContact CE2-CE2 3.93Å; Y118-Y210 HydrophobicContact CG-CD1 4.23Å; Y118-Y210 AromaticContact CG-CD2 3.57Å; Y118-Y210 HydrophobicContact CG-CD2 3.57Å; Y118-Y210 HydrophobicContact CG-CE1 4.28Å; Y118-Y210 AromaticContact CG-CE2 3.62Å; Y118-Y210 HydrophobicContact CG-CE2 3.62Å; Y118-Y210 AromaticContact CG-CG 3.91Å; Y118-Y210 HydrophobicContact CG-CG 3.91Å; Y118-Y210 AromaticContact CG-CZ 3.98Å; Y118-F211 HydrophobicContact CD1-CE2 4.36Å; Y118-F211 HydrophobicContact CD1-CZ 4.33Å; Y118-F211 AromaticContact CE1-CE2 3.97Å; Y118-F211 HydrophobicContact CE1-CE2 3.97Å; Y118-F211 HydrophobicContact CE1-CZ 4.32Å
119L95.7Very high93.6Very high13 Ų1317.5 Ų17.57%0.0689%0.088CC..Hα-helixtrans-68.4-33.7-178.7-169.159.8000112.5V78 L115 I116 T122 L123 F161V78-L119 HydrophobicContact CG1-CB 4.32Å; V78-L119 HydrophobicContact CG2-CB 4.41Å; V78-L119 HydrophobicContact CG2-CD2 3.43Å; V78-L119 VanDerWaalsContact CG2-CD2 3.43Å; V78-L119 HydrophobicContact CG2-CG 3.78Å; L115-L119 WeakPolarHBondContact O-CB 3.4Å; L115-L119 PolarHBondContact O-N 2.88Å; I116-L119 PolarHBondContact O-N 3.39Å; L119-T122 PolarHBondContact O-N 3.46Å; L119-L123 HydrophobicContact CD1-CD1 4.13Å; L119-L123 HydrophobicContact CD1-CD2 4.31Å; L119-L123 HydrophobicContact CD1-CG 3.87Å; L119-L123 HydrophobicContact CD2-CD1 4.44Å; L119-L123 HydrophobicContact CG-CD1 3.82Å; L119-L123 HydrophobicContact CG-CG 4.02Å; L119-L123 WeakPolarHBondContact O-CB 3.32Å; L119-L123 VanDerWaalsContact O-CG 3.3Å; L119-L123 WeakPolarHBondContact O-CG 3.4Å; L119-L123 PolarHBondContact O-N 2.93Å; L119-F161 HydrophobicContact CD2-CD2 3.98Å
120S93.7Very high93.2Very high0 Ų017.1 Ų17.10%09%0.086CC..Hα-helixtrans-56.6-62177.5-179.80000113.8I116 Y118 T122 L123 A124 H335I116-S120 PolarHBondContact O-N 3.35Å; Y118-S120 PolarHBondContact O-N 3.48Å; S120-T122 VanDerWaalsContact C-N 3.27Å; S120-T122 PolarHBondContact O-N 3.38Å; S120-L123 PolarHBondContact O-N 3.38Å; S120-A124 WeakPolarHBondContact O-CB 3.4Å; S120-A124 PolarHBondContact O-N 3.38Å; S120-H335 PolarHBondContact OG-NE2 3.36Å
121P92.8Very high92.8Very high1 Ų117.9 Ų17.91%0.0069%0.088CC..Hα-helixtrans-65-31.617826.6-34.1000112Q117 Y118 A124 F125 L280Q117-P121 WeakPolarHBondContact O-CD 3.35Å; Y118-P121 WeakPolarHBondContact O-CD 3.38Å; Y118-P121 WeakPolarHBondContact O-CG 3.47Å; P121-A124 PolarHBondContact O-N 2.83Å; P121-F125 WeakPolarHBondContact O-CB 3.32Å; P121-F125 PolarHBondContact O-N 3.44Å; P121-L280 HydrophobicContact CB-CD2 4.47Å
122T95Very high92.4Very high1 Ų119.4 Ų19.41%0.0069%0.092CC..Hα-helixtrans-67-43.2178.8-61.20000112.7Y118 L119 S120 F125 T126 M160 Y210Y118-T122 WeakPolarHBondContact O-CB 3.44Å; Y118-T122 PolarHBondContact O-N 2.88Å; Y118-T122 PolarHBondContact O-OG1 2.83Å; L119-T122 PolarHBondContact O-N 3.46Å; S120-T122 VanDerWaalsContact C-N 3.27Å; S120-T122 PolarHBondContact O-N 3.38Å; T122-F125 PolarHBondContact O-N 2.97Å; T122-T126 WeakPolarHBondContact O-CB 3.46Å; T122-T126 PolarHBondContact O-N 3.5Å; T122-T126 PolarHBondContact O-OG1 3.28Å; T122-M160 HydrophobicContact CG2-CB 3.89Å; T122-M160 HydrophobicContact CG2-CE 3.08Å; T122-M160 HydrophobicContact CG2-CG 4.1Å; T122-M160 HydrophobicContact CG2-SD 4.42Å; T122-Y210 WeakPolarHBondContact OG1-CD1 3.37Å; T122-Y210 WeakPolarHBondContact OG1-CE1 3.46Å
123L93.8Very high92Very high1 Ų118.3 Ų18.31%0.0059%0.086CC..Hα-helixtrans-69-38174-74.1179.5000111.2L75 V78 L119 S120 F125 T126 F127 I157L75-L123 HydrophobicContact CD2-CB 3.58Å; L75-L123 HydrophobicContact CD2-CD1 4.16Å; L75-L123 HydrophobicContact CG-CB 3.98Å; L75-L123 HydrophobicContact CG-CD1 4.37Å; V78-L123 HydrophobicContact CG2-CD1 3.72Å; L119-L123 HydrophobicContact CD1-CD1 4.13Å; L119-L123 HydrophobicContact CD1-CD2 4.31Å; L119-L123 HydrophobicContact CD1-CG 3.87Å; L119-L123 HydrophobicContact CD2-CD1 4.44Å; L119-L123 HydrophobicContact CG-CD1 3.82Å; L119-L123 HydrophobicContact CG-CG 4.02Å; L119-L123 WeakPolarHBondContact O-CB 3.32Å; L119-L123 VanDerWaalsContact O-CG 3.3Å; L119-L123 WeakPolarHBondContact O-CG 3.4Å; L119-L123 PolarHBondContact O-N 2.93Å; S120-L123 PolarHBondContact O-N 3.38Å; L123-F125 VanDerWaalsContact C-N 3.34Å; L123-F125 PolarHBondContact O-N 3.33Å; L123-T126 PolarHBondContact O-N 3.14Å; L123-F127 VanDerWaalsContact O-CB 3.27Å; L123-F127 WeakPolarHBondContact O-CB 3.27Å; L123-F127 PolarHBondContact O-N 2.88Å; L123-I157 HydrophobicContact CD2-CG1 4Å; L123-I157 HydrophobicContact CD2-CG2 4.4Å
124A91.5Very high91.4Very high8 Ų818.9 Ų18.97%0.0669%0.094CC..Hα-helixtrans-61.6-42.2173.800000111.9S120 P121 F127 T128 L280S120-A124 WeakPolarHBondContact O-CB 3.4Å; S120-A124 PolarHBondContact O-N 3.38Å; P121-A124 PolarHBondContact O-N 2.83Å; A124-F127 PolarHBondContact O-N 3Å; A124-T128 WeakPolarHBondContact O-CG2 3.26Å; A124-T128 PolarHBondContact O-N 3.1Å; A124-T128 PolarHBondContact O-OG1 3.18Å; A124-T128 VanDerWaalsContact O-OG1 3.07Å; A124-L280 HydrophobicContact CB-CD1 3.72Å; A124-L280 HydrophobicContact CB-CD2 4.39Å
125F92.8Very high90.8Very high42 Ų4219.1 Ų19.118%0.18410%0.098CC..Hα-helixtrans-61.6-50.3172.3168.9-105.8000112P121 T122 L123 F127 T128 L129 L214 T217 C218 L221P121-F125 WeakPolarHBondContact O-CB 3.32Å; P121-F125 PolarHBondContact O-N 3.44Å; T122-F125 PolarHBondContact O-N 2.97Å; L123-F125 VanDerWaalsContact C-N 3.34Å; L123-F125 PolarHBondContact O-N 3.33Å; F125-F127 PolarHBondContact O-N 3.23Å; F125-T128 WeakPolarHBondContact CA-OG1 3.42Å; F125-T128 PolarHBondContact O-N 3.36Å; F125-T128 PolarHBondContact O-OG1 2.85Å; F125-L129 HydrophobicContact CE1-CD2 4.09Å; F125-L129 HydrophobicContact CE2-CB 4.46Å; F125-L129 HydrophobicContact CZ-CB 4.42Å; F125-L129 HydrophobicContact CZ-CD2 3.89Å; F125-L129 VanDerWaalsContact O-CB 3.3Å; F125-L129 WeakPolarHBondContact O-CB 3.34Å; F125-L129 PolarHBondContact O-N 3.12Å; F125-L214 HydrophobicContact CB-CD2 4.02Å; F125-L214 HydrophobicContact CD1-CD2 3.93Å; F125-L214 HydrophobicContact CD2-CD2 4.15Å; F125-L214 HydrophobicContact CE1-CD2 4.47Å; F125-L214 HydrophobicContact CG-CD2 3.74Å; F125-T217 HydrophobicContact CD2-CG2 4.17Å; F125-T217 HydrophobicContact CE2-CG2 3.61Å; F125-C218 WeakPolarHBondContact CA-SG 3.19Å; F125-L221 HydrophobicContact CD2-CD1 4.26Å; F125-L221 HydrophobicContact CE2-CD1 3.93Å
126T91.5Very high90.2Very high5 Ų519.8 Ų19.83%0.03110%0.103CC..Hα-helixtrans-58.5-41.1179.6-56.60000110.8Y71 T122 L123 E130 M146Y71-T126 HydrophobicContact CD1-CG2 4.47Å; Y71-T126 HydrophobicContact CE1-CG2 3.69Å; T122-T126 WeakPolarHBondContact O-CB 3.46Å; T122-T126 PolarHBondContact O-N 3.5Å; T122-T126 PolarHBondContact O-OG1 3.28Å; L123-T126 PolarHBondContact O-N 3.14Å; T126-E130 WeakPolarHBondContact O-CB 3.45Å; T126-E130 PolarHBondContact O-N 3.17Å; T126-M146 HydrophobicContact CG2-CE 3.6Å; T126-M146 WeakPolarHBondContact O-CE 3.34Å
127F88.4Confident89.5Confident4 Ų422.8 Ų22.82%0.01812%0.117CC..Hα-helixtrans-67.4-44.9177.3179.6-133000112.7A68 Y71 Q72 L123 A124 F125 E130 R131 L273A68-F127 HydrophobicContact CB-CD2 4.42Å; A68-F127 HydrophobicContact CB-CE2 3.44Å; A68-F127 VanDerWaalsContact CB-CE2 3.44Å; A68-F127 HydrophobicContact CB-CZ 4.05Å; Y71-F127 HydrophobicContact CD2-CB 4.45Å; Y71-F127 AromaticContact CD2-CD2 3.93Å; Y71-F127 HydrophobicContact CD2-CD2 3.93Å; Y71-F127 HydrophobicContact CG-CB 4.31Å; Y71-F127 HydrophobicContact CG-CD2 4.35Å; Q72-F127 HydrophobicContact CG-CE1 4.33Å; Q72-F127 HydrophobicContact CG-CZ 4.4Å; L123-F127 VanDerWaalsContact O-CB 3.27Å; L123-F127 WeakPolarHBondContact O-CB 3.27Å; L123-F127 PolarHBondContact O-N 2.88Å; A124-F127 PolarHBondContact O-N 3Å; F125-F127 PolarHBondContact O-N 3.23Å; F127-E130 PolarHBondContact O-N 3.29Å; F127-R131 HydrophobicContact CD2-CG 3.93Å; F127-R131 HydrophobicContact CE2-CG 3.56Å; F127-R131 HydrophobicContact CZ-CG 4.08Å; F127-R131 WeakPolarHBondContact O-CB 3.05Å; F127-R131 WeakPolarHBondContact O-CG 3.49Å; F127-R131 PolarHBondContact O-N 3.2Å; F127-R131 VanDerWaalsContact O-N 3.13Å; F127-L273 HydrophobicContact CD1-CD1 3.18Å; F127-L273 HydrophobicContact CD1-CG 4.24Å; F127-L273 HydrophobicContact CE1-CB 3.54Å; F127-L273 HydrophobicContact CE1-CD1 3Å; F127-L273 HydrophobicContact CE1-CD2 3.97Å; F127-L273 HydrophobicContact CE1-CG 3.61Å; F127-L273 HydrophobicContact CG-CD1 4.15Å; F127-L273 HydrophobicContact CZ-CB 3.82Å; F127-L273 HydrophobicContact CZ-CD1 3.87Å; F127-L273 HydrophobicContact CZ-CD2 3.96Å; F127-L273 HydrophobicContact CZ-CG 4.06Å
128T90Very high88.6Confident1 Ų124 Ų241%0.00613%0.129CC..Hα-helixtrans-64.3-41.2176.451.60000112A124 F125 R131 Y132 C218 L273A124-T128 WeakPolarHBondContact O-CG2 3.26Å; A124-T128 PolarHBondContact O-N 3.1Å; A124-T128 PolarHBondContact O-OG1 3.18Å; A124-T128 VanDerWaalsContact O-OG1 3.07Å; F125-T128 WeakPolarHBondContact CA-OG1 3.42Å; F125-T128 PolarHBondContact O-N 3.36Å; F125-T128 PolarHBondContact O-OG1 2.85Å; T128-R131 PolarHBondContact O-N 3Å; T128-Y132 WeakPolarHBondContact O-CB 3.27Å; T128-Y132 PolarHBondContact O-N 3.24Å; T128-C218 HydrophobicContact CG2-CB 4.49Å; T128-L273 HydrophobicContact CG2-CD1 3.74Å
129L89.8Confident87.7Confident50 Ų5032.3 Ų32.326%0.26217%0.165SC..Hα-helixtrans-61.8-46.7176.1179.562.2000111.8F125 R131 Y132 L133 L221F125-L129 HydrophobicContact CE1-CD2 4.09Å; F125-L129 HydrophobicContact CE2-CB 4.46Å; F125-L129 HydrophobicContact CZ-CB 4.42Å; F125-L129 HydrophobicContact CZ-CD2 3.89Å; F125-L129 VanDerWaalsContact O-CB 3.3Å; F125-L129 WeakPolarHBondContact O-CB 3.34Å; F125-L129 PolarHBondContact O-N 3.12Å; L129-R131 PolarHBondContact O-N 3.27Å; L129-Y132 PolarHBondContact O-N 3.31Å; L129-L133 HydrophobicContact CD1-CD1 4.36Å; L129-L133 HydrophobicContact CD1-CG 4.33Å; L129-L133 HydrophobicContact CG-CD1 4.26Å; L129-L133 VanDerWaalsContact O-CG 3.32Å; L129-L133 WeakPolarHBondContact O-CG 3.24Å; L129-L133 PolarHBondContact O-N 2.7Å; L129-L221 HydrophobicContact CB-CD1 4.18Å; L129-L221 HydrophobicContact CD1-CD1 4.3Å
130E87.3Confident86.5Confident7 Ų740.5 Ų40.53%0.03320%0.195CC..Hα-helixtrans-58.6-40.6177.4-168.9-92.8155.600111.7Y71 T126 F127 L133 A134 M146Y71-E130 HydrophobicContact CE2-CB 4.24Å; Y71-E130 HydrophobicContact CE2-CG 4.11Å; T126-E130 WeakPolarHBondContact O-CB 3.45Å; T126-E130 PolarHBondContact O-N 3.17Å; F127-E130 PolarHBondContact O-N 3.29Å; E130-L133 PolarHBondContact O-N 3.35Å; E130-A134 WeakPolarHBondContact O-CB 3.31Å; E130-A134 PolarHBondContact O-N 3.23Å; E130-M146 VanDerWaalsContact CA-SD 3.6Å; E130-M146 HydrophobicContact CB-CE 3.51Å; E130-M146 HydrophobicContact CB-CG 4.33Å; E130-M146 HydrophobicContact CB-SD 3.7Å; E130-M146 HydrophobicContact CG-CE 4.05Å; E130-M146 HydrophobicContact CG-CG 3.9Å; E130-M146 HydrophobicContact CG-SD 3.94Å
131R83.8Confident85Confident27 Ų2741.5 Ų41.510%0.10220%0.202CC..Hα-helixtrans-71.8-41.8-179.3-66.3-81.3118.8-148-15.5111.6S65 F127 T128 L129 L133 A134 I135 L273S65-R131 VanDerWaalsContact CB-CZ 3.46Å; S65-R131 PolarHBondContact OG-NH2 2.83Å; F127-R131 HydrophobicContact CD2-CG 3.93Å; F127-R131 HydrophobicContact CE2-CG 3.56Å; F127-R131 HydrophobicContact CZ-CG 4.08Å; F127-R131 WeakPolarHBondContact O-CB 3.05Å; F127-R131 WeakPolarHBondContact O-CG 3.49Å; F127-R131 PolarHBondContact O-N 3.2Å; F127-R131 VanDerWaalsContact O-N 3.13Å; T128-R131 PolarHBondContact O-N 3Å; L129-R131 PolarHBondContact O-N 3.27Å; R131-L133 VanDerWaalsContact C-N 3.35Å; R131-A134 PolarHBondContact O-N 2.78Å; R131-I135 WeakPolarHBondContact O-CB 3.41Å; R131-I135 WeakPolarHBondContact O-CG1 3.28Å; R131-I135 PolarHBondContact O-N 3.29Å; R131-L273 HydrophobicContact CB-CD2 3.58Å; R131-L273 HydrophobicContact CG-CD2 3.41Å; R131-L273 VanDerWaalsContact CG-CD2 3.41Å
132Y86.9Confident83.6Confident49 Ų4947.5 Ų47.519%0.19223%0.23CC..Hα-helixtrans-56.4-49.2171.5169.4-98.1000111.1T128 L129 A134 I135 C136 L221 L224 V225T128-Y132 WeakPolarHBondContact O-CB 3.27Å; T128-Y132 PolarHBondContact O-N 3.24Å; L129-Y132 PolarHBondContact O-N 3.31Å; Y132-A134 PolarHBondContact O-N 3.41Å; Y132-I135 PolarHBondContact O-N 3.31Å; Y132-C136 HydrophobicContact CD2-CB 4.25Å; Y132-C136 WeakPolarHBondContact CD2-SG 3.37Å; Y132-C136 HydrophobicContact CE2-CB 3.91Å; Y132-C136 WeakPolarHBondContact CE2-SG 3.31Å; Y132-C136 VanDerWaalsContact O-CB 3.3Å; Y132-C136 WeakPolarHBondContact O-CB 3.37Å; Y132-C136 PolarHBondContact O-N 2.93Å; Y132-C136 PolarHBondContact O-SG 2.78Å; Y132-L221 HydrophobicContact CD1-CD2 3.88Å; Y132-L221 HydrophobicContact CD2-CD2 4.05Å; Y132-L221 HydrophobicContact CE1-CD2 4.34Å; Y132-L221 HydrophobicContact CE2-CD2 4.5Å; Y132-L221 HydrophobicContact CG-CD2 3.72Å; Y132-L224 HydrophobicContact CD2-CB 4.09Å; Y132-L224 HydrophobicContact CD2-CD1 4.44Å; Y132-L224 HydrophobicContact CE2-CB 3.81Å; Y132-L224 HydrophobicContact CE2-CD1 3.72Å; Y132-L224 HydrophobicContact CE2-CG 4.41Å; Y132-V225 HydrophobicContact CD2-CG2 4.22Å
133L87.1Confident81.8Confident39 Ų3958.7 Ų58.720%0.20427%0.272CS..Hα-helixtrans-63.7-40.3178.2-68.6175.6000112.2L129 E130 R131 I135 H137 M146L129-L133 HydrophobicContact CD1-CD1 4.36Å; L129-L133 HydrophobicContact CD1-CG 4.33Å; L129-L133 HydrophobicContact CG-CD1 4.26Å; L129-L133 VanDerWaalsContact O-CG 3.32Å; L129-L133 WeakPolarHBondContact O-CG 3.24Å; L129-L133 PolarHBondContact O-N 2.7Å; E130-L133 PolarHBondContact O-N 3.35Å; R131-L133 VanDerWaalsContact C-N 3.35Å; L133-I135 VanDerWaalsContact C-N 3.34Å; L133-I135 PolarHBondContact O-N 2.98Å; L133-H137 CarbonylContact O-C 3.02Å; L133-H137 WeakPolarHBondContact O-CA 3.26Å; L133-H137 PolarHBondContact O-N 3.36Å; L133-H137 VanDerWaalsContact O-O 3.04Å; L133-M146 HydrophobicContact CD1-SD 3.91Å
134A82.4Confident80.3Confident32 Ų3260.8 Ų60.826%0.26429%0.287SS..Hα-helixtrans-65.2-35.517800000113E130 R131 Y132E130-A134 WeakPolarHBondContact O-CB 3.31Å; E130-A134 PolarHBondContact O-N 3.23Å; R131-A134 PolarHBondContact O-N 2.78Å; Y132-A134 PolarHBondContact O-N 3.41Å
135I82.2Confident78.7Confident49 Ų4965.3 Ų65.325%0.25131%0.313SS..Hα-helixtrans-88.2-49.9-176.8-66.4169.7000111.6R131 Y132 L133 V225 V228 T270R131-I135 WeakPolarHBondContact O-CB 3.41Å; R131-I135 WeakPolarHBondContact O-CG1 3.28Å; R131-I135 PolarHBondContact O-N 3.29Å; Y132-I135 PolarHBondContact O-N 3.31Å; L133-I135 VanDerWaalsContact C-N 3.34Å; L133-I135 PolarHBondContact O-N 2.98Å; I135-V225 HydrophobicContact CD1-CG1 3.77Å; I135-V228 HydrophobicContact CG2-CB 4.25Å; I135-V228 HydrophobicContact CG2-CG1 3.73Å; I135-T270 HydrophobicContact CD1-CG2 4.2Å
136C83.4Confident77.2Confident29 Ų2964 Ų6420%0.19631%0.308CS..Hα-helixtrans-81.8-28.8-173.7-55.60000112.5Y132Y132-C136 HydrophobicContact CD2-CB 4.25Å; Y132-C136 WeakPolarHBondContact CD2-SG 3.37Å; Y132-C136 HydrophobicContact CE2-CB 3.91Å; Y132-C136 WeakPolarHBondContact CE2-SG 3.31Å; Y132-C136 VanDerWaalsContact O-CB 3.3Å; Y132-C136 WeakPolarHBondContact O-CB 3.37Å; Y132-C136 PolarHBondContact O-N 2.93Å; Y132-C136 PolarHBondContact O-SG 2.78Å
137H82.2Confident75.8Confident77 Ų7770.2 Ų70.236%0.35633%0.331SS..  trans-132.865.3-177.7-60.7-63000112.4L133 F139 R140 S141L133-H137 CarbonylContact O-C 3.02Å; L133-H137 WeakPolarHBondContact O-CA 3.26Å; L133-H137 PolarHBondContact O-N 3.36Å; L133-H137 VanDerWaalsContact O-O 3.04Å; H137-F139 VanDerWaalsContact C-N 3.3Å; H137-F139 PolarHBondContact O-N 3.4Å; H137-R140 HydrophobicContact CB-CB 3.9Å; H137-R140 PolarHBondContact O-N 2.91Å; H137-S141 WeakPolarHBondContact O-CB 3.27Å; H137-S141 PolarHBondContact O-N 2.7Å; H137-S141 PolarHBondContact O-OG 3.13Å
138P74.9Confident74.6Confident69 Ų6972.9 Ų72.945%0.44835%0.35SS..Hα-helixtrans-58.5-36.9-17523.3-34.4000113.5S141 Q142P138-S141 WeakPolarHBondContact CA-OG 3.48Å; P138-S141 PolarHBondContact O-OG 3.42Å; P138-Q142 PolarHBondContact O-N 3.14Å
139F76.2Confident73.9Confident174 Ų17475.5 Ų75.576%0.76337%0.366SS*.Hα-helixtrans-78.3-35.3178.8-60.9-63.8000113.2H137H137-F139 VanDerWaalsContact C-N 3.3Å; H137-F139 PolarHBondContact O-N 3.4Å
140R70Confident73.5Confident186 Ų18675.9 Ų75.970%0.70237%0.368SS*.Hα-helixtrans-73.1-36.9177-165.5176.5176.4164.8-0.9111.1H137 Q142 R143 S144H137-R140 HydrophobicContact CB-CB 3.9Å; H137-R140 PolarHBondContact O-N 2.91Å; R140-Q142 VanDerWaalsContact C-N 3.29Å; R140-Q142 PolarHBondContact O-N 3.37Å; R140-R143 CarbonylContact O-C 3.59Å; R140-R143 PolarHBondContact O-N 2.92Å; R140-R143 VanDerWaalsContact O-N 3.13Å; R140-S144 WeakPolarHBondContact O-CB 3.38Å; R140-S144 PolarHBondContact O-N 2.96Å
141S63.5Low73.5Confident21 Ų2183.9 Ų83.915%0.14740%0.403CS..Hα-helixtrans-65.2-31.3175.858.90000112.6H137 P138 R143H137-S141 WeakPolarHBondContact O-CB 3.27Å; H137-S141 PolarHBondContact O-N 2.7Å; H137-S141 PolarHBondContact O-OG 3.13Å; P138-S141 WeakPolarHBondContact CA-OG 3.48Å; P138-S141 PolarHBondContact O-OG 3.42Å; S141-R143 VanDerWaalsContact C-N 3.25Å; S141-R143 PolarHBondContact O-N 3.13Å
142Q63.5Low73.6Confident127 Ų12783.5 Ų83.559%0.59340%0.404SS*.Hα-helixtrans-65.9-28.6173.5-166.4175.11.200113P138 R140P138-Q142 PolarHBondContact O-N 3.14Å; R140-Q142 VanDerWaalsContact C-N 3.29Å; R140-Q142 PolarHBondContact O-N 3.37Å
143R57.6Low73.6Confident236 Ų23681.2 Ų81.289%0.89140%0.395SS*.Hα-helixtrans-94.5-25.5178.6-157.6175.9-153.1159.34.8113.6R140 S141R140-R143 CarbonylContact O-C 3.59Å; R140-R143 PolarHBondContact O-N 2.92Å; R140-R143 VanDerWaalsContact O-N 3.13Å; S141-R143 VanDerWaalsContact C-N 3.25Å; S141-R143 PolarHBondContact O-N 3.13Å
144S61Low73.8Confident45 Ų4584.7 Ų84.732%0.31541%0.409SS..SBendtrans-62.2149.6179.6-179.40000111.7R140 M146 R147R140-S144 WeakPolarHBondContact O-CB 3.38Å; R140-S144 PolarHBondContact O-N 2.96Å; S144-M146 PolarHBondContact O-N 3.28Å; S144-M146 VanDerWaalsContact O-N 3.15Å; S144-M146 PolarHBondContact OG-N 3.24Å; S144-R147 PolarHBondContact O-N 2.84Å; S144-R147 VanDerWaalsContact O-N 3.14Å
145V58Low74.3Confident102 Ų10289.4 Ų89.462%0.61842%0.423SS*.SBendtrans-52.6-32.7169.2-178.80000110.5R147 S152 F156V145-R147 PolarHBondContact O-N 3.46Å; V145-S152 PolarHBondContact O-OG 2.97Å; V145-F156 HydrophobicContact CB-CE2 4.43Å; V145-F156 HydrophobicContact CB-CZ 4.24Å; V145-F156 HydrophobicContact CG1-CE2 3.88Å; V145-F156 HydrophobicContact CG1-CZ 3.91Å
146M61.4Low74.7Confident16 Ų1689.3 Ų89.38%0.07942%0.421CS..SBendtrans-75.344.8172.9-152.9176.6-146.600112.4T126 E130 L133 S144 F156T126-M146 HydrophobicContact CG2-CE 3.6Å; T126-M146 WeakPolarHBondContact O-CE 3.34Å; E130-M146 VanDerWaalsContact CA-SD 3.6Å; E130-M146 HydrophobicContact CB-CE 3.51Å; E130-M146 HydrophobicContact CB-CG 4.33Å; E130-M146 HydrophobicContact CB-SD 3.7Å; E130-M146 HydrophobicContact CG-CE 4.05Å; E130-M146 HydrophobicContact CG-CG 3.9Å; E130-M146 HydrophobicContact CG-SD 3.94Å; L133-M146 HydrophobicContact CD1-SD 3.91Å; S144-M146 PolarHBondContact O-N 3.28Å; S144-M146 VanDerWaalsContact O-N 3.15Å; S144-M146 PolarHBondContact OG-N 3.24Å; M146-F156 HydrophobicContact CB-CE2 4.01Å; M146-F156 HydrophobicContact CB-CZ 4.15Å; M146-F156 HydrophobicContact CG-CD2 4.49Å; M146-F156 HydrophobicContact CG-CE2 4.15Å; M146-F156 HydrophobicContact CG-CZ 4.43Å
147R61.4Low75.2Confident135 Ų13589 Ų8951%0.50942%0.417SS..  trans-62.2141.7170.1-170.6-179.1173.7103.3-5.7108.3S144 V145 T149S144-R147 PolarHBondContact O-N 2.84Å; S144-R147 VanDerWaalsContact O-N 3.14Å; V145-R147 PolarHBondContact O-N 3.46Å; R147-T149 VanDerWaalsContact CD-OG1 3.29Å; R147-T149 WeakPolarHBondContact CD-OG1 3.24Å; R147-T149 WeakPolarHBondContact CG-OG1 3.5Å; R147-T149 PolarHBondContact NE-OG1 2.87Å; R147-T149 PolarHBondContact O-N 3.42Å
148S63.7Low75.9Confident60 Ų6087.9 Ų87.942%0.4242%0.421SS..SBendtrans-66.941.8173.1177.50000113.3S65S65-S148 PolarHBondContact OG-OG 3.03Å
149T76.1Confident76.8Confident56 Ų5688.6 Ų88.634%0.34442%0.421SS..  trans-102.9139.5174.6-52.40000108.9R147 K151 S152 A153R147-T149 VanDerWaalsContact CD-OG1 3.29Å; R147-T149 WeakPolarHBondContact CD-OG1 3.24Å; R147-T149 WeakPolarHBondContact CG-OG1 3.5Å; R147-T149 PolarHBondContact NE-OG1 2.87Å; R147-T149 PolarHBondContact O-N 3.42Å; T149-K151 VanDerWaalsContact C-N 3.26Å; T149-K151 PolarHBondContact O-N 3.44Å; T149-S152 PolarHBondContact O-N 3.12Å; T149-A153 PolarHBondContact O-N 2.93Å
150L81.7Confident77.7Confident57 Ų5782 Ų8230%0.29839%0.393SS..Hα-helixtrans-48.4-45.5177.9-177.458.7000113.1V70 S152 A153 F154V70-L150 HydrophobicContact CB-CD1 4.4Å; V70-L150 HydrophobicContact CG2-CD1 3.11Å; L150-S152 PolarHBondContact O-N 2.96Å; L150-A153 PolarHBondContact O-N 3.36Å; L150-F154 HydrophobicContact CD1-CD2 3.93Å; L150-F154 HydrophobicContact CD1-CE2 3.34Å; L150-F154 HydrophobicContact CD1-CZ 4.12Å; L150-F154 HydrophobicContact CD2-CE2 4.37Å; L150-F154 HydrophobicContact CG-CD2 4.02Å; L150-F154 HydrophobicContact CG-CE2 3.66Å; L150-F154 WeakPolarHBondContact O-CD2 3.41Å; L150-F154 PolarHBondContact O-N 2.88Å
151K85.9Confident79Confident176 Ų17677.3 Ų77.377%0.76538%0.377SS*.Hα-helixtrans-62.9-37.5179.7-64.1-172.6178.4-173.70113.4T149 K155T149-K151 VanDerWaalsContact C-N 3.26Å; T149-K151 PolarHBondContact O-N 3.44Å; K151-K155 PolarHBondContact O-N 3.22Å; K151-K155 VanDerWaalsContact O-N 3.13Å
152S86Confident80.6Confident18 Ų1880.3 Ų80.313%0.12640%0.395CS..Hα-helixtrans-69.8-44.3179179.30000110.6V145 T149 L150 F154 K155 F156V145-S152 PolarHBondContact O-OG 2.97Å; T149-S152 PolarHBondContact O-N 3.12Å; L150-S152 PolarHBondContact O-N 2.96Å; S152-F154 VanDerWaalsContact C-N 3.34Å; S152-F154 PolarHBondContact O-N 3.38Å; S152-K155 WeakPolarHBondContact O-CB 3.42Å; S152-K155 PolarHBondContact O-N 3.44Å; S152-F156 WeakPolarHBondContact O-CD2 3.26Å; S152-F156 PolarHBondContact O-N 3.06Å; S152-F156 WeakPolarHBondContact OG-CE2 3.49Å
153A88.3Confident82.2Confident1 Ų178.5 Ų78.51%0.00839%0.385CS..Hα-helixtrans-55.9-47.3176.600000111.9A67 V70 Y71 T149 L150 K155 F156 I157A67-A153 HydrophobicContact CB-CB 4.2Å; V70-A153 HydrophobicContact CB-CB 4.29Å; V70-A153 HydrophobicContact CG1-CB 4.13Å; Y71-A153 HydrophobicContact CE1-CB 4.49Å; Y71-A153 HydrophobicContact CE2-CB 4.35Å; T149-A153 PolarHBondContact O-N 2.93Å; L150-A153 PolarHBondContact O-N 3.36Å; A153-K155 VanDerWaalsContact C-N 3.34Å; A153-K155 PolarHBondContact O-N 2.95Å; A153-F156 PolarHBondContact O-N 3.33Å; A153-I157 WeakPolarHBondContact O-CD1 3.34Å; A153-I157 VanDerWaalsContact O-CG1 3.29Å; A153-I157 WeakPolarHBondContact O-CG1 3.45Å; A153-I157 PolarHBondContact O-N 2.88Å
154F91.4Very high84.1Confident112 Ų11267.3 Ų67.349%0.49134%0.343SS..Hα-helixtrans-61.2-40.1175.3-76.8-60.9000113.2V70 L150 S152 I157 A158V70-F154 HydrophobicContact CG1-CD1 4.2Å; V70-F154 HydrophobicContact CG1-CE1 3.9Å; V70-F154 HydrophobicContact CG1-CE2 4.44Å; V70-F154 HydrophobicContact CG1-CZ 4.04Å; L150-F154 HydrophobicContact CD1-CD2 3.93Å; L150-F154 HydrophobicContact CD1-CE2 3.34Å; L150-F154 HydrophobicContact CD1-CZ 4.12Å; L150-F154 HydrophobicContact CD2-CE2 4.37Å; L150-F154 HydrophobicContact CG-CD2 4.02Å; L150-F154 HydrophobicContact CG-CE2 3.66Å; L150-F154 WeakPolarHBondContact O-CD2 3.41Å; L150-F154 PolarHBondContact O-N 2.88Å; S152-F154 VanDerWaalsContact C-N 3.34Å; S152-F154 PolarHBondContact O-N 3.38Å; F154-I157 PolarHBondContact O-N 3.37Å; F154-A158 WeakPolarHBondContact O-CB 3.43Å; F154-A158 PolarHBondContact O-N 3.44Å
155K91.5Very high85.8Confident131 Ų13168.3 Ų68.357%0.5735%0.345SS*.Hα-helixtrans-60.9-44.9175.5-174-179.9179.31790111.6K151 S152 A153 A158 I159K151-K155 PolarHBondContact O-N 3.22Å; K151-K155 VanDerWaalsContact O-N 3.13Å; S152-K155 WeakPolarHBondContact O-CB 3.42Å; S152-K155 PolarHBondContact O-N 3.44Å; A153-K155 VanDerWaalsContact C-N 3.34Å; A153-K155 PolarHBondContact O-N 2.95Å; K155-A158 PolarHBondContact O-N 3.28Å; K155-I159 HydrophobicContact CG-CD1 4.06Å; K155-I159 VanDerWaalsContact O-CG1 3.29Å; K155-I159 WeakPolarHBondContact O-CG1 3.35Å; K155-I159 PolarHBondContact O-N 3.2Å
156F91.2Very high87.6Confident47 Ų4767.1 Ų67.121%0.20634%0.337CS..Hα-helixtrans-65-43.7176.9-85-79000112V145 M146 S152 A153 A158 I159 M160V145-F156 HydrophobicContact CB-CE2 4.43Å; V145-F156 HydrophobicContact CB-CZ 4.24Å; V145-F156 HydrophobicContact CG1-CE2 3.88Å; V145-F156 HydrophobicContact CG1-CZ 3.91Å; M146-F156 HydrophobicContact CB-CE2 4.01Å; M146-F156 HydrophobicContact CB-CZ 4.15Å; M146-F156 HydrophobicContact CG-CD2 4.49Å; M146-F156 HydrophobicContact CG-CE2 4.15Å; M146-F156 HydrophobicContact CG-CZ 4.43Å; S152-F156 WeakPolarHBondContact O-CD2 3.26Å; S152-F156 PolarHBondContact O-N 3.06Å; S152-F156 WeakPolarHBondContact OG-CE2 3.49Å; A153-F156 PolarHBondContact O-N 3.33Å; F156-A158 VanDerWaalsContact C-N 3.29Å; F156-A158 PolarHBondContact O-N 2.92Å; F156-I159 PolarHBondContact O-N 3.07Å; F156-M160 WeakPolarHBondContact O-CG 3.28Å; F156-M160 PolarHBondContact O-N 3.23Å
157I94.3Very high89.2Confident23 Ų2366.9 Ų66.912%0.11834%0.337CS..Hα-helixtrans-58.1-44175.8-68.5158.4000110.6V70 Y71 S74 L123 A153 F154 M160 F161V70-I157 HydrophobicContact CG1-CD1 3.7Å; Y71-I157 HydrophobicContact CD1-CD1 3.88Å; Y71-I157 HydrophobicContact CD1-CG1 3.82Å; Y71-I157 HydrophobicContact CE1-CD1 4.06Å; Y71-I157 HydrophobicContact CE1-CG1 3.75Å; S74-I157 WeakPolarHBondContact OG-CD1 3.42Å; L123-I157 HydrophobicContact CD2-CG1 4Å; L123-I157 HydrophobicContact CD2-CG2 4.4Å; A153-I157 WeakPolarHBondContact O-CD1 3.34Å; A153-I157 VanDerWaalsContact O-CG1 3.29Å; A153-I157 WeakPolarHBondContact O-CG1 3.45Å; A153-I157 PolarHBondContact O-N 2.88Å; F154-I157 PolarHBondContact O-N 3.37Å; I157-M160 PolarHBondContact O-N 2.91Å; I157-F161 VanDerWaalsContact O-CB 3.27Å; I157-F161 WeakPolarHBondContact O-CB 3.41Å; I157-F161 PolarHBondContact O-N 2.94Å
158A95.4Very high90.8Very high53 Ų5360.5 Ų60.544%0.43831%0.313SS..Hα-helixtrans-63.3-42.3176.800000112.4F154 K155 F156 F161 V162F154-A158 WeakPolarHBondContact O-CB 3.43Å; F154-A158 PolarHBondContact O-N 3.44Å; K155-A158 PolarHBondContact O-N 3.28Å; F156-A158 VanDerWaalsContact C-N 3.29Å; F156-A158 PolarHBondContact O-N 2.92Å; A158-F161 PolarHBondContact O-N 3.38Å; A158-V162 WeakPolarHBondContact O-CG2 3.43Å; A158-V162 PolarHBondContact O-N 3.19Å
159I95.3Very high92.3Very high85 Ų8560.4 Ų60.444%0.43631%0.312SS..Hα-helixtrans-62.1-47.1175.8-68.6164.4000110.8K155 F156 F161 V162 F163K155-I159 HydrophobicContact CG-CD1 4.06Å; K155-I159 VanDerWaalsContact O-CG1 3.29Å; K155-I159 WeakPolarHBondContact O-CG1 3.35Å; K155-I159 PolarHBondContact O-N 3.2Å; F156-I159 PolarHBondContact O-N 3.07Å; I159-F161 VanDerWaalsContact C-N 3.33Å; I159-F161 PolarHBondContact O-N 3.45Å; I159-V162 PolarHBondContact O-N 2.98Å; I159-F163 WeakPolarHBondContact O-CB 3.32Å; I159-F163 PolarHBondContact O-N 3Å
160M94.9Very high93Very high35 Ų3560 Ų6017%0.17231%0.31CS..Hα-helixtrans-66.2-36.6178.8-61.9-41.9-70.900111.8T122 F156 I157 F163 C164T122-M160 HydrophobicContact CG2-CB 3.89Å; T122-M160 HydrophobicContact CG2-CE 3.08Å; T122-M160 HydrophobicContact CG2-CG 4.1Å; T122-M160 HydrophobicContact CG2-SD 4.42Å; F156-M160 WeakPolarHBondContact O-CG 3.28Å; F156-M160 PolarHBondContact O-N 3.23Å; I157-M160 PolarHBondContact O-N 2.91Å; M160-F163 HydrophobicContact CE-CD1 4.49Å; M160-F163 PolarHBondContact O-N 2.63Å; M160-C164 WeakPolarHBondContact O-CB 3.36Å; M160-C164 PolarHBondContact O-N 3.2Å; M160-C164 PolarHBondContact O-SG 2.78Å; M160-C164 VanDerWaalsContact O-SG 3.33Å
161F97.2Very high93.5Very high87 Ų8757.3 Ų57.338%0.38230%0.296SS..Hα-helixtrans-60.7-49.3174.1177.7-90.1000111.4L115 L119 I157 A158 I159 F163 C164 L165L115-F161 HydrophobicContact CD1-CD2 4.37Å; L115-F161 HydrophobicContact CD1-CE2 4.26Å; L115-F161 HydrophobicContact CD2-CE2 3.81Å; L115-F161 HydrophobicContact CD2-CZ 3.94Å; L115-F161 HydrophobicContact CG-CE2 4.4Å; L119-F161 HydrophobicContact CD2-CD2 3.98Å; I157-F161 VanDerWaalsContact O-CB 3.27Å; I157-F161 WeakPolarHBondContact O-CB 3.41Å; I157-F161 PolarHBondContact O-N 2.94Å; A158-F161 PolarHBondContact O-N 3.38Å; I159-F161 VanDerWaalsContact C-N 3.33Å; I159-F161 PolarHBondContact O-N 3.45Å; F161-F163 VanDerWaalsContact C-N 3.33Å; F161-F163 PolarHBondContact O-N 3.42Å; F161-C164 PolarHBondContact O-N 2.85Å; F161-L165 HydrophobicContact CE1-CD2 4.19Å; F161-L165 VanDerWaalsContact O-CB 3.3Å; F161-L165 WeakPolarHBondContact O-CB 3.32Å; F161-L165 PolarHBondContact O-N 3.26Å
162V97.5Very high93.6Very high84 Ų8450.5 Ų50.551%0.50927%0.272SS..Hα-helixtrans-61.5-43.2177172.70000110.6A158 I159 L165 T166A158-V162 WeakPolarHBondContact O-CG2 3.43Å; A158-V162 PolarHBondContact O-N 3.19Å; I159-V162 PolarHBondContact O-N 2.98Å; V162-L165 PolarHBondContact O-N 3.1Å; V162-T166 HydrophobicContact CG1-CG2 4.43Å; V162-T166 WeakPolarHBondContact O-CG2 3.3Å; V162-T166 PolarHBondContact O-N 3.03Å; V162-T166 PolarHBondContact O-OG1 3.44Å
163F96.5Very high93.7Very high90 Ų9054.1 Ų54.140%0.39529%0.286SS..Hα-helixtrans-59.4-50.5176.3179.7-106.2000112.1I159 M160 F161 L165 T166 T167 L209 Y210I159-F163 WeakPolarHBondContact O-CB 3.32Å; I159-F163 PolarHBondContact O-N 3Å; M160-F163 HydrophobicContact CE-CD1 4.49Å; M160-F163 PolarHBondContact O-N 2.63Å; F161-F163 VanDerWaalsContact C-N 3.33Å; F161-F163 PolarHBondContact O-N 3.42Å; F163-L165 VanDerWaalsContact C-N 3.28Å; F163-L165 PolarHBondContact O-N 3.32Å; F163-T166 PolarHBondContact O-N 3.34Å; F163-T166 PolarHBondContact O-OG1 3.29Å; F163-T167 HydrophobicContact CE1-CG2 4.48Å; F163-T167 HydrophobicContact CE2-CG2 4.37Å; F163-T167 HydrophobicContact CZ-CG2 4.22Å; F163-T167 PolarHBondContact O-N 3.47Å; F163-T167 PolarHBondContact O-OG1 3.48Å; F163-L209 HydrophobicContact CZ-CD2 4.44Å; F163-Y210 WeakPolarHBondContact CE1-OH 3.2Å
164C97.5Very high93.7Very high0 Ų054.2 Ų54.20%029%0.286CS..Hα-helixtrans-63.4-33.2176.2-67.30000112.8L115 M160 F161 T167 A168L115-C164 HydrophobicContact CD1-CB 3.72Å; M160-C164 WeakPolarHBondContact O-CB 3.36Å; M160-C164 PolarHBondContact O-N 3.2Å; M160-C164 PolarHBondContact O-SG 2.78Å; M160-C164 VanDerWaalsContact O-SG 3.33Å; F161-C164 PolarHBondContact O-N 2.85Å; C164-T167 WeakPolarHBondContact CA-OG1 3.38Å; C164-T167 PolarHBondContact O-N 3.14Å; C164-T167 PolarHBondContact O-OG1 3.25Å; C164-A168 WeakPolarHBondContact O-CB 3.47Å; C164-A168 PolarHBondContact O-N 3.06Å
165L96.7Very high93.6Very high67 Ų6751.5 Ų51.535%0.35127%0.273SS..Hα-helixtrans-68-43.2176178.363.4000110.9V111 L115 F161 V162 F163 T167 A168 S169V111-L165 HydrophobicContact CG1-CD1 4.21Å; L115-L165 HydrophobicContact CD1-CB 4.07Å; L115-L165 HydrophobicContact CD2-CD1 4.08Å; F161-L165 HydrophobicContact CE1-CD2 4.19Å; F161-L165 VanDerWaalsContact O-CB 3.3Å; F161-L165 WeakPolarHBondContact O-CB 3.32Å; F161-L165 PolarHBondContact O-N 3.26Å; V162-L165 PolarHBondContact O-N 3.1Å; F163-L165 VanDerWaalsContact C-N 3.28Å; F163-L165 PolarHBondContact O-N 3.32Å; L165-T167 VanDerWaalsContact C-N 3.31Å; L165-T167 PolarHBondContact O-N 2.93Å; L165-A168 PolarHBondContact O-N 3.13Å; L165-S169 WeakPolarHBondContact O-CB 3.43Å; L165-S169 PolarHBondContact O-N 3.42Å
166T95.7Very high93.4Very high76 Ų7645.8 Ų45.847%0.46625%0.25SS..Hα-helixtrans-61.6-41.3175.955.10000111.4V162 F163 S169V162-T166 HydrophobicContact CG1-CG2 4.43Å; V162-T166 WeakPolarHBondContact O-CG2 3.3Å; V162-T166 PolarHBondContact O-N 3.03Å; V162-T166 PolarHBondContact O-OG1 3.44Å; F163-T166 PolarHBondContact O-N 3.34Å; F163-T166 PolarHBondContact O-OG1 3.29Å; T166-S169 PolarHBondContact O-N 3.49Å; T166-S169 PolarHBondContact O-OG 2.86Å
167T95.2Very high93.3Very high12 Ų1247.4 Ų47.47%0.07426%0.255CS..Hα-helixtrans-72.9-35.6179.655.90000113.1F163 C164 L165 W202 Y210F163-T167 HydrophobicContact CE1-CG2 4.48Å; F163-T167 HydrophobicContact CE2-CG2 4.37Å; F163-T167 HydrophobicContact CZ-CG2 4.22Å; F163-T167 PolarHBondContact O-N 3.47Å; F163-T167 PolarHBondContact O-OG1 3.48Å; C164-T167 WeakPolarHBondContact CA-OG1 3.38Å; C164-T167 PolarHBondContact O-N 3.14Å; C164-T167 PolarHBondContact O-OG1 3.25Å; L165-T167 VanDerWaalsContact C-N 3.31Å; L165-T167 PolarHBondContact O-N 2.93Å; T167-W202 HydrophobicContact CG2-CZ2 4.45Å; T167-W202 PolarHBondContact O-NE1 3.33Å; T167-Y210 PolarHBondContact OG1-OH 3.38Å
168A95.2Very high92.9Very high0 Ų049.9 Ų49.90%027%0.269CS..Hα-helixtrans-74.1-26.1175.800000113.2V111 L115 Y118 C164 L165 V170 Q171V111-A168 HydrophobicContact CG1-CB 4.37Å; L115-A168 HydrophobicContact CB-CB 4.07Å; Y118-A168 HydrophobicContact CD2-CB 4.21Å; Y118-A168 HydrophobicContact CE2-CB 4.33Å; C164-A168 WeakPolarHBondContact O-CB 3.47Å; C164-A168 PolarHBondContact O-N 3.06Å; L165-A168 PolarHBondContact O-N 3.13Å; A168-V170 PolarHBondContact O-N 3.38Å; A168-V170 VanDerWaalsContact O-N 3.13Å; A168-Q171 VanDerWaalsContact O-CB 3.25Å; A168-Q171 WeakPolarHBondContact O-CB 2.94Å; A168-Q171 WeakPolarHBondContact O-CG 3.42Å; A168-Q171 PolarHBondContact O-N 2.87Å
169S93.9Very high92.4Very high58 Ų5855.5 Ų55.541%0.40629%0.292SS..Hα-helixtrans-59.1-27.4-177.370.10000113.8L165 T166 Q171 A172L165-S169 WeakPolarHBondContact O-CB 3.43Å; L165-S169 PolarHBondContact O-N 3.42Å; T166-S169 PolarHBondContact O-N 3.49Å; T166-S169 PolarHBondContact O-OG 2.86Å; S169-Q171 PolarHBondContact O-N 2.85Å; S169-Q171 VanDerWaalsContact O-N 3.14Å; S169-A172 WeakPolarHBondContact O-CB 3.29Å; S169-A172 PolarHBondContact O-N 2.94Å
170V92.1Very high91.8Very high48 Ų4853.1 Ų53.129%0.29129%0.288SS..G310 helixtrans-59.3-25.5175.4-179.80000111.9A168 A172 F173 W202A168-V170 PolarHBondContact O-N 3.38Å; A168-V170 VanDerWaalsContact O-N 3.13Å; V170-A172 PolarHBondContact O-N 2.93Å; V170-F173 WeakPolarHBondContact O-CB 3.4Å; V170-F173 PolarHBondContact O-N 3.25Å; V170-W202 HydrophobicContact CB-CG 4.48Å; V170-W202 HydrophobicContact CB-CZ2 4.45Å; V170-W202 HydrophobicContact CG1-CD2 4.31Å; V170-W202 HydrophobicContact CG1-CG 3.96Å; V170-W202 HydrophobicContact CG2-CD2 4.21Å; V170-W202 HydrophobicContact CG2-CH2 4.34Å; V170-W202 HydrophobicContact CG2-CZ2 3.62Å
171Q91.1Very high91.4Very high1 Ų155 Ų551%0.00530%0.301CS..G310 helixtrans-65.5-23.3177.4-59.9-64.1-15.900113.1P110 V111 Y114 A168 S169 F173 V174P110-Q171 HydrophobicContact CB-CB 4.11Å; V111-Q171 HydrophobicContact CG2-CB 4.34Å; Y114-Q171 HydrophobicContact CD2-CB 4.3Å; Y114-Q171 HydrophobicContact CD2-CG 3.62Å; Y114-Q171 HydrophobicContact CE2-CG 4.13Å; Y114-Q171 HydrophobicContact CG-CG 3.97Å; A168-Q171 VanDerWaalsContact O-CB 3.25Å; A168-Q171 WeakPolarHBondContact O-CB 2.94Å; A168-Q171 WeakPolarHBondContact O-CG 3.42Å; A168-Q171 PolarHBondContact O-N 2.87Å; S169-Q171 PolarHBondContact O-N 2.85Å; S169-Q171 VanDerWaalsContact O-N 3.14Å; Q171-F173 PolarHBondContact O-N 3.4Å; Q171-V174 PolarHBondContact O-N 2.98Å; Q171-V174 VanDerWaalsContact O-N 3.16Å
172A89.6Confident90.9Very high32 Ų3252.1 Ų52.126%0.26429%0.292SS..G310 helixtrans-66-23173.100000112.8V111 S169 V170 V174V111-A172 HydrophobicContact CG2-CB 3.65Å; S169-A172 WeakPolarHBondContact O-CB 3.29Å; S169-A172 PolarHBondContact O-N 2.94Å; V170-A172 PolarHBondContact O-N 2.93Å; A172-V174 VanDerWaalsContact C-N 3.27Å; A172-V174 PolarHBondContact O-N 3.14Å
173F87.6Confident90.4Very high95 Ų9550.7 Ų50.742%0.41728%0.283SS..G310 helixtrans-73.8-20.7176.3-178-98.1000112.4V170 Q171 R185 V188V170-F173 WeakPolarHBondContact O-CB 3.4Å; V170-F173 PolarHBondContact O-N 3.25Å; Q171-F173 PolarHBondContact O-N 3.4Å; F173-R185 WeakPolarHBondContact O-CD 3.37Å; F173-R185 PolarHBondContact O-NE 3.08Å; F173-V188 HydrophobicContact CE1-CG2 4.35Å
174V88.3Confident89.9Confident2 Ų248.8 Ų48.81%0.01228%0.279CS..THydrogen-bonded Turntrans-84.6-37.9-171.9178.10000111.9Q171 A172 T184 R185 V188 Y199Q171-V174 PolarHBondContact O-N 2.98Å; Q171-V174 VanDerWaalsContact O-N 3.16Å; A172-V174 VanDerWaalsContact C-N 3.27Å; A172-V174 PolarHBondContact O-N 3.14Å; V174-T184 HydrophobicContact CG1-CG2 4.23Å; V174-T184 WeakPolarHBondContact O-CA 3.48Å; V174-R185 PolarHBondContact O-N 3.14Å; V174-V188 HydrophobicContact CG1-CG1 4.23Å; V174-Y199 HydrophobicContact CG1-CD2 4.37Å; V174-Y199 HydrophobicContact CG1-CE2 4.12Å; V174-Y199 HydrophobicContact CG2-CD2 3.34Å; V174-Y199 HydrophobicContact CG2-CE2 3.66Å; V174-Y199 HydrophobicContact CG2-CG 4.15Å
175Y88.1Confident89.4Confident56 Ų5652.2 Ų52.222%0.2229%0.292CS..EExtended strand (participates in β ladder)trans-100.7145.1-175.5-65.1-88.6000110.7P110 T184 R185P110-Y175 HydrophobicContact CB-CD2 3.84Å; P110-Y175 HydrophobicContact CB-CE2 3.93Å; P110-Y175 HydrophobicContact CG-CD2 3.44Å; P110-Y175 VanDerWaalsContact CG-CD2 3.44Å; P110-Y175 HydrophobicContact CG-CE2 3.82Å; P110-Y175 HydrophobicContact CG-CG 3.87Å; Y175-T184 HydrophobicContact CD1-CG2 4.39Å; Y175-T184 HydrophobicContact CE1-CG2 4.09Å; Y175-R185 PolarHBondContact O-NE 2.89Å
176A88.5Confident88.7Confident11 Ų1153.4 Ų53.49%0.09130%0.304CS..EExtended strand (participates in β ladder)trans-144.8147.7171.300000110.5N178 T183 R185A176-N178 PolarHBondContact O-N 3.28Å; A176-T183 PolarHBondContact N-O 2.88Å; A176-T183 PolarHBondContact O-N 3.46Å; A176-R185 HydrophobicContact CB-CG 3.52Å
177Y88.2Confident88.1Confident80 Ų8052 Ų5231%0.31430%0.296SS..EExtended strand (participates in β ladder)trans-86.2110.7173.4-177.1-105000110.2D101 P103 G180D101-Y177 VanDerWaalsContact O-CE2 3.27Å; D101-Y177 WeakPolarHBondContact O-CE2 3.34Å; P103-Y177 HydrophobicContact CB-CD1 3.82Å; P103-Y177 HydrophobicContact CB-CE1 4.33Å; P103-Y177 HydrophobicContact CB-CG 4.11Å; Y177-G180 WeakPolarHBondContact OH-CA 3.07Å
178N85.8Confident87.6Confident76 Ų7651.9 Ų51.941%0.40630%0.296SS..EExtended strand (participates in β ladder)trans-126.5131.1179.4-72.9-38.4000109.9A176 G180 V181A176-N178 PolarHBondContact O-N 3.28Å; N178-G180 PolarHBondContact O-N 3.37Å; N178-G180 VanDerWaalsContact O-N 3.09Å; N178-V181 PolarHBondContact N-O 3.02Å; N178-V181 VanDerWaalsContact N-O 3.12Å; N178-V181 PolarHBondContact O-N 3.1Å; N178-V181 VanDerWaalsContact O-O 3.05Å
179N85.3Confident87Confident171 Ų17157.4 Ų57.491%0.91432%0.322SS*.THydrogen-bonded Turntrans50.735.5172.5-61.3-21.9000115.6
180G84.1Confident86.5Confident35 Ų3558.2 Ų58.236%0.36132%0.322SS..THydrogen-bonded Turntrans90.6-4.7178.200000115.3Y177 N178Y177-G180 WeakPolarHBondContact OH-CA 3.07Å; N178-G180 PolarHBondContact O-N 3.37Å; N178-G180 VanDerWaalsContact O-N 3.09Å
181V85.8Confident86.1Confident74 Ų7460.1 Ų60.145%0.44834%0.335SS..EExtended strand (participates in β ladder)trans-125.4140.1-175.5-174.20000110.6N178 T183N178-V181 PolarHBondContact N-O 3.02Å; N178-V181 VanDerWaalsContact N-O 3.12Å; N178-V181 PolarHBondContact O-N 3.1Å; N178-V181 VanDerWaalsContact O-O 3.05Å; V181-T183 HydrophobicContact CB-CG2 4.26Å; V181-T183 HydrophobicContact CG1-CG2 3.9Å; V181-T183 PolarHBondContact O-N 3Å
182C86.7Confident85.9Confident27 Ų2767.1 Ų67.118%0.18237%0.372CS..EExtended strand (participates in β ladder)trans-75.5109.5170.4-170.20000110.2D101 C106D101-C182 PolarHBondContact OD1-N 3.41Å; C106-C182 WeakPolarHBondContact CA-SG 3.33Å; C106-C182 HydrophobicContact CB-CB 3.68Å; C106-C182 WeakPolarHBondContact CB-SG 3.14Å; C106-C182 WeakPolarHBondContact SG-CA 3.21Å; C106-C182 WeakPolarHBondContact SG-CB 3.38Å; C106-C182 CovalentContact SG-SG 2.03Å; C106-C182 PolarHBondContact SG-SG 3.32Å
183T86.1Confident85.8Confident53 Ų5366.8 Ų66.833%0.32537%0.368SS..EExtended strand (participates in β ladder)trans-127162.6-177.552.40000111.2A176 V181A176-T183 PolarHBondContact N-O 2.88Å; A176-T183 PolarHBondContact O-N 3.46Å; V181-T183 HydrophobicContact CB-CG2 4.26Å; V181-T183 HydrophobicContact CG1-CG2 3.9Å; V181-T183 PolarHBondContact O-N 3Å
184T86.5Confident85.9Confident50 Ų5068.8 Ų68.831%0.30738%0.382SS..EExtended strand (participates in β ladder)trans-68.2144.3170.232.10000110.2V174 Y175 E189V174-T184 HydrophobicContact CG1-CG2 4.23Å; V174-T184 WeakPolarHBondContact O-CA 3.48Å; Y175-T184 HydrophobicContact CD1-CG2 4.39Å; Y175-T184 HydrophobicContact CE1-CG2 4.09Å; T184-E189 WeakPolarHBondContact CB-OE1 3.16Å; T184-E189 PolarHBondContact OG1-OE1 3.49Å
185R86.8Confident85.8Confident73 Ų7369.1 Ų69.128%0.27539%0.385SS..  trans-66.3140.3176.1-68.3-166.8-166.6-158-7.5109.5E107 F173 V174 Y175 A176 S187 V188E107-R185 IonicContact OE2-NH2 3.88Å; F173-R185 WeakPolarHBondContact O-CD 3.37Å; F173-R185 PolarHBondContact O-NE 3.08Å; V174-R185 PolarHBondContact O-N 3.14Å; Y175-R185 PolarHBondContact O-NE 2.89Å; A176-R185 HydrophobicContact CB-CG 3.52Å; R185-S187 PolarHBondContact O-N 2.84Å; R185-S187 VanDerWaalsContact O-N 3.08Å; R185-V188 HydrophobicContact CB-CG2 4.49Å; R185-V188 PolarHBondContact O-N 3.25Å
186P82.7Confident85.9Confident92 Ų9270 Ų7060%0.59739%0.39SS*.Hα-helixtrans-59.8-27.8-179.423-33.5000112.6V188 E189 D190P186-V188 PolarHBondContact O-N 3.32Å; P186-V188 VanDerWaalsContact O-N 3.16Å; P186-E189 PolarHBondContact O-N 3.28Å; P186-D190 PolarHBondContact O-N 3.22Å
187S83.1Confident85.9Confident45 Ų4572.3 Ų72.332%0.31541%0.406SS..Hα-helixtrans-66.9-8.117460.90000114.8R185 S193 G195 F196R185-S187 PolarHBondContact O-N 2.84Å; R185-S187 VanDerWaalsContact O-N 3.08Å; S187-S193 PolarHBondContact O-OG 3.33Å; S187-G195 CarbonylContact O-C 3.32Å; S187-G195 WeakPolarHBondContact O-CA 3.42Å; S187-F196 PolarHBondContact O-N 3.07Å; S187-F196 VanDerWaalsContact O-N 3.13Å
188V84.9Confident86Confident10 Ų1073.6 Ų73.66%0.06142%0.418CS..Hα-helixtrans-108.9-13.3176.3-174.80000110.9F173 V174 R185 P186 F196 Y199F173-V188 HydrophobicContact CE1-CG2 4.35Å; V174-V188 HydrophobicContact CG1-CG1 4.23Å; R185-V188 HydrophobicContact CB-CG2 4.49Å; R185-V188 PolarHBondContact O-N 3.25Å; P186-V188 PolarHBondContact O-N 3.32Å; P186-V188 VanDerWaalsContact O-N 3.16Å; V188-F196 VanDerWaalsContact O-CD2 3.31Å; V188-F196 WeakPolarHBondContact O-CD2 3.42Å; V188-Y199 HydrophobicContact CG1-CD1 3.45Å; V188-Y199 VanDerWaalsContact CG1-CD1 3.45Å; V188-Y199 HydrophobicContact CG1-CE1 4.12Å; V188-Y199 HydrophobicContact CG1-CG 3.67Å
189E81.3Confident86.2Confident116 Ų11672.9 Ų72.954%0.54241%0.409SS..Hα-helixtrans-88.4-33.8177.7-68.3174.4-172.400111.9T184 P186 P191T184-E189 WeakPolarHBondContact CB-OE1 3.16Å; T184-E189 PolarHBondContact OG1-OE1 3.49Å; P186-E189 PolarHBondContact O-N 3.28Å; E189-P191 VanDerWaalsContact O-CD 3.27Å; E189-P191 WeakPolarHBondContact O-CD 3.48Å
190D84.7Confident86.4Confident76 Ų7667.6 Ų67.641%0.40638%0.383SS..  trans-73.9114.5179179.78.4000111.2P186 N192 S193 F196P186-D190 PolarHBondContact O-N 3.22Å; D190-N192 PolarHBondContact O-N 3.41Å; D190-N192 VanDerWaalsContact O-N 3.14Å; D190-N192 PolarHBondContact OD1-N 3.27Å; D190-S193 WeakPolarHBondContact O-CB 3.44Å; D190-S193 PolarHBondContact O-N 2.91Å; D190-S193 PolarHBondContact O-OG 3.13Å; D190-F196 WeakPolarHBondContact O-CB 3.38Å
191P83.6Confident86.7Confident87 Ų8770.2 Ų70.257%0.56539%0.389SS*.THydrogen-bonded Turntrans-62.2-21.4-179.726.1-35.3000113.7E189 F196E189-P191 VanDerWaalsContact O-CD 3.27Å; E189-P191 WeakPolarHBondContact O-CD 3.48Å; P191-F196 HydrophobicContact CB-CD1 4.41Å; P191-F196 HydrophobicContact CB-CE1 4.37Å
192N86.2Confident87.1Confident148 Ų14870.7 Ų70.779%0.79138%0.383SS*.THydrogen-bonded Turntrans-86.1-10.3179.1-60.6-49.6000113.2D190D190-N192 PolarHBondContact O-N 3.41Å; D190-N192 VanDerWaalsContact O-N 3.14Å; D190-N192 PolarHBondContact OD1-N 3.27Å
193S87.9Confident87.2Confident25 Ų2570.6 Ų70.618%0.17538%0.382CS..SBendtrans-79.6150.6-177.5730000112.2S187 D190 G195 F196 S197S187-S193 PolarHBondContact O-OG 3.33Å; D190-S193 WeakPolarHBondContact O-CB 3.44Å; D190-S193 PolarHBondContact O-N 2.91Å; D190-S193 PolarHBondContact O-OG 3.13Å; S193-G195 PolarHBondContact O-N 2.92Å; S193-F196 PolarHBondContact O-N 3.43Å; S193-F196 PolarHBondContact OG-N 2.73Å; S193-S197 PolarHBondContact O-N 3.17Å
194I88.7Confident87.5Confident138 Ų13874.6 Ų74.671%0.70840%0.395SS*.Hα-helixtrans-62.2-32.6174-61.5169000110.5S197 L198I194-S197 PolarHBondContact O-N 3.5Å; I194-L198 HydrophobicContact CG2-CD1 3.92Å; I194-L198 HydrophobicContact CG2-CG 4.15Å; I194-L198 WeakPolarHBondContact O-CB 3.19Å; I194-L198 WeakPolarHBondContact O-CG 3.41Å; I194-L198 PolarHBondContact O-N 2.87Å
195G87.2Confident87.8Confident8 Ų877.1 Ų77.18%0.08241%0.405CS..Hα-helixtrans-64.5-41.8-179.700000113S187 S193 L198 Y199S187-G195 CarbonylContact O-C 3.32Å; S187-G195 WeakPolarHBondContact O-CA 3.42Å; S193-G195 PolarHBondContact O-N 2.92Å; G195-L198 PolarHBondContact O-N 3.22Å; G195-Y199 WeakPolarHBondContact O-CB 3.24Å; G195-Y199 PolarHBondContact O-N 3.49Å
196F89.1Confident88.1Confident75 Ų7573.9 Ų73.933%0.32939%0.393SS..Hα-helixtrans-60.1-47173.9175.8-97.1000112.3S187 V188 D190 P191 S193 Y199 T200S187-F196 PolarHBondContact O-N 3.07Å; S187-F196 VanDerWaalsContact O-N 3.13Å; V188-F196 VanDerWaalsContact O-CD2 3.31Å; V188-F196 WeakPolarHBondContact O-CD2 3.42Å; D190-F196 WeakPolarHBondContact O-CB 3.38Å; P191-F196 HydrophobicContact CB-CD1 4.41Å; P191-F196 HydrophobicContact CB-CE1 4.37Å; S193-F196 PolarHBondContact O-N 3.43Å; S193-F196 PolarHBondContact OG-N 2.73Å; F196-Y199 PolarHBondContact O-N 2.94Å; F196-T200 WeakPolarHBondContact O-CB 3.33Å; F196-T200 PolarHBondContact O-N 3.49Å; F196-T200 PolarHBondContact O-OG1 3.08Å; F196-T200 VanDerWaalsContact O-OG1 3.07Å
197S89.6Confident88.5Confident59 Ų5972.6 Ų72.641%0.41338%0.38SS..Hα-helixtrans-63.1-44.4178.8-1730000112S193 I194 N201S193-S197 PolarHBondContact O-N 3.17Å; I194-S197 PolarHBondContact O-N 3.5Å; S197-N201 VanDerWaalsContact O-CB 3.24Å; S197-N201 WeakPolarHBondContact O-CB 3.31Å; S197-N201 VanDerWaalsContact O-CG 3.28Å; S197-N201 PolarHBondContact O-N 3.3Å; S197-N201 PolarHBondContact O-ND2 2.87Å; S197-N201 PolarHBondContact OG-ND2 2.86Å
198L90.6Very high88.9Confident108 Ų10872.2 Ų72.257%0.56538%0.377SS*.Hα-helixtrans-60.4-48.3175.4-74.1174.9000111.5I194 G195 W202I194-L198 HydrophobicContact CG2-CD1 3.92Å; I194-L198 HydrophobicContact CG2-CG 4.15Å; I194-L198 WeakPolarHBondContact O-CB 3.19Å; I194-L198 WeakPolarHBondContact O-CG 3.41Å; I194-L198 PolarHBondContact O-N 2.87Å; G195-L198 PolarHBondContact O-N 3.22Å; L198-W202 WeakPolarHBondContact O-CB 3.38Å; L198-W202 PolarHBondContact O-N 2.65Å
199Y89Confident89.3Confident60 Ų6074.7 Ų74.724%0.23539%0.389CS..Hα-helixtrans-62.6-46.6-179.7169.8-114.3000112.4V174 V188 G195 F196 W202 T203V174-Y199 HydrophobicContact CG1-CD2 4.37Å; V174-Y199 HydrophobicContact CG1-CE2 4.12Å; V174-Y199 HydrophobicContact CG2-CD2 3.34Å; V174-Y199 HydrophobicContact CG2-CE2 3.66Å; V174-Y199 HydrophobicContact CG2-CG 4.15Å; V188-Y199 HydrophobicContact CG1-CD1 3.45Å; V188-Y199 VanDerWaalsContact CG1-CD1 3.45Å; V188-Y199 HydrophobicContact CG1-CE1 4.12Å; V188-Y199 HydrophobicContact CG1-CG 3.67Å; G195-Y199 WeakPolarHBondContact O-CB 3.24Å; G195-Y199 PolarHBondContact O-N 3.49Å; F196-Y199 PolarHBondContact O-N 2.94Å; Y199-W202 PolarHBondContact O-N 3.15Å; Y199-T203 WeakPolarHBondContact CD2-OG1 3.36Å; Y199-T203 VanDerWaalsContact CE2-OG1 3.25Å; Y199-T203 WeakPolarHBondContact CE2-OG1 3.44Å; Y199-T203 WeakPolarHBondContact O-CB 3.32Å; Y199-T203 PolarHBondContact O-N 3.39Å; Y199-T203 PolarHBondContact O-OG1 2.95Å
200T89Confident89.9Confident60 Ų6069.2 Ų69.237%0.36836%0.364SS..Hα-helixtrans-67.7-45.9-177.1-64.70000111.1F196 F204F196-T200 WeakPolarHBondContact O-CB 3.33Å; F196-T200 PolarHBondContact O-N 3.49Å; F196-T200 PolarHBondContact O-OG1 3.08Å; F196-T200 VanDerWaalsContact O-OG1 3.07Å; T200-F204 VanDerWaalsContact O-CB 3.29Å; T200-F204 WeakPolarHBondContact O-CB 3.09Å; T200-F204 PolarHBondContact O-N 3.36Å
201N91.6Very high90.2Very high90 Ų9066.7 Ų66.748%0.48135%0.349SS..Hα-helixtrans-66.3-42.6177.2-71.5-40.7000111.6S197 F204 I205S197-N201 VanDerWaalsContact O-CB 3.24Å; S197-N201 WeakPolarHBondContact O-CB 3.31Å; S197-N201 VanDerWaalsContact O-CG 3.28Å; S197-N201 PolarHBondContact O-N 3.3Å; S197-N201 PolarHBondContact O-ND2 2.87Å; S197-N201 PolarHBondContact OG-ND2 2.86Å; N201-F204 PolarHBondContact O-N 2.92Å; N201-I205 WeakPolarHBondContact O-CD1 3.43Å; N201-I205 VanDerWaalsContact O-CG1 3.25Å; N201-I205 WeakPolarHBondContact O-CG1 3.23Å; N201-I205 PolarHBondContact O-N 2.82Å
202W93.4Very high90.4Very high85 Ų8567.7 Ų67.732%0.32235%0.345SS..Hα-helixtrans-62.8-50.2178.3-175.9-98.8000111.9T167 V170 L198 Y199 F204 I205 T206T167-W202 HydrophobicContact CG2-CZ2 4.45Å; T167-W202 PolarHBondContact O-NE1 3.33Å; V170-W202 HydrophobicContact CB-CG 4.48Å; V170-W202 HydrophobicContact CB-CZ2 4.45Å; V170-W202 HydrophobicContact CG1-CD2 4.31Å; V170-W202 HydrophobicContact CG1-CG 3.96Å; V170-W202 HydrophobicContact CG2-CD2 4.21Å; V170-W202 HydrophobicContact CG2-CH2 4.34Å; V170-W202 HydrophobicContact CG2-CZ2 3.62Å; L198-W202 WeakPolarHBondContact O-CB 3.38Å; L198-W202 PolarHBondContact O-N 2.65Å; Y199-W202 PolarHBondContact O-N 3.15Å; W202-F204 VanDerWaalsContact C-N 3.28Å; W202-F204 PolarHBondContact O-N 3.5Å; W202-I205 PolarHBondContact O-N 3.36Å; W202-I205 VanDerWaalsContact O-N 3.09Å; W202-T206 HydrophobicContact CD2-CG2 4.33Å; W202-T206 HydrophobicContact CG-CG2 4.47Å; W202-T206 HydrophobicContact CZ2-CG2 4.14Å; W202-T206 PolarHBondContact O-N 2.81Å; W202-T206 PolarHBondContact O-OG1 3.15Å
203T90.1Very high90.8Very high25 Ų2563.3 Ų63.315%0.15333%0.326CS..Hα-helixtrans-59.1-42.7177.1-59.30000110.2Y199 I205 T206 E207Y199-T203 WeakPolarHBondContact CD2-OG1 3.36Å; Y199-T203 VanDerWaalsContact CE2-OG1 3.25Å; Y199-T203 WeakPolarHBondContact CE2-OG1 3.44Å; Y199-T203 WeakPolarHBondContact O-CB 3.32Å; Y199-T203 PolarHBondContact O-N 3.39Å; Y199-T203 PolarHBondContact O-OG1 2.95Å; T203-I205 VanDerWaalsContact C-N 3.34Å; T203-I205 PolarHBondContact O-N 3.04Å; T203-T206 PolarHBondContact O-N 2.9Å; T203-T206 PolarHBondContact O-OG1 2.77Å; T203-E207 HydrophobicContact CG2-CG 3.8Å; T203-E207 WeakPolarHBondContact O-CB 3.27Å; T203-E207 WeakPolarHBondContact O-CG 3.44Å; T203-E207 PolarHBondContact O-N 2.87Å
204F90.8Very high91Very high137 Ų13763.1 Ų63.160%0.60132%0.322SS*.Hα-helixtrans-59.2-43.9175.1-178.9-98.3000112.6T200 N201 W202 S208T200-F204 VanDerWaalsContact O-CB 3.29Å; T200-F204 WeakPolarHBondContact O-CB 3.09Å; T200-F204 PolarHBondContact O-N 3.36Å; N201-F204 PolarHBondContact O-N 2.92Å; W202-F204 VanDerWaalsContact C-N 3.28Å; W202-F204 PolarHBondContact O-N 3.5Å; F204-S208 WeakPolarHBondContact O-CB 3.25Å; F204-S208 PolarHBondContact O-N 3.45Å; F204-S208 PolarHBondContact O-OG 3.47Å
205I93.6Very high91.2Very high103 Ų10356.6 Ų56.653%0.52829%0.289SS..Hα-helixtrans-65.2-49.2178.7-69.1164.1000111.1N201 W202 T203 S208 L209N201-I205 WeakPolarHBondContact O-CD1 3.43Å; N201-I205 VanDerWaalsContact O-CG1 3.25Å; N201-I205 WeakPolarHBondContact O-CG1 3.23Å; N201-I205 PolarHBondContact O-N 2.82Å; W202-I205 PolarHBondContact O-N 3.36Å; W202-I205 VanDerWaalsContact O-N 3.09Å; T203-I205 VanDerWaalsContact C-N 3.34Å; T203-I205 PolarHBondContact O-N 3.04Å; I205-S208 PolarHBondContact O-N 2.52Å; I205-L209 WeakPolarHBondContact O-CB 3.29Å; I205-L209 PolarHBondContact O-N 3.4Å
206T93.3Very high91.4Very high4 Ų459.1 Ų59.13%0.02530%0.3CS..Hα-helixtrans-68.1-43.6-177.756.10000111.6Y118 W202 T203 S208 L209 Y210Y118-T206 PolarHBondContact OH-OG1 3.16Å; Y118-T206 VanDerWaalsContact OH-OG1 3.13Å; W202-T206 HydrophobicContact CD2-CG2 4.33Å; W202-T206 HydrophobicContact CG-CG2 4.47Å; W202-T206 HydrophobicContact CZ2-CG2 4.14Å; W202-T206 PolarHBondContact O-N 2.81Å; W202-T206 PolarHBondContact O-OG1 3.15Å; T203-T206 PolarHBondContact O-N 2.9Å; T203-T206 PolarHBondContact O-OG1 2.77Å; T206-S208 VanDerWaalsContact C-N 3.34Å; T206-S208 PolarHBondContact O-N 3.21Å; T206-L209 PolarHBondContact O-N 3.12Å; T206-Y210 WeakPolarHBondContact O-CD2 3.37Å; T206-Y210 PolarHBondContact O-N 2.74Å
207E90.9Very high91.6Very high65 Ų6558.4 Ų58.430%0.30430%0.302SS..Hα-helixtrans-62.1-43.2177.3-67.5-65.412900111T203 L209 F211T203-E207 HydrophobicContact CG2-CG 3.8Å; T203-E207 WeakPolarHBondContact O-CB 3.27Å; T203-E207 WeakPolarHBondContact O-CG 3.44Å; T203-E207 PolarHBondContact O-N 2.87Å; E207-L209 VanDerWaalsContact C-N 3.34Å; E207-L209 PolarHBondContact O-N 3.26Å; E207-F211 HydrophobicContact CB-CD2 4.39Å; E207-F211 WeakPolarHBondContact O-CB 3.43Å; E207-F211 PolarHBondContact O-N 3.44Å; E207-F211 WeakPolarHBondContact OE1-CE2 3.49Å; E207-F211 WeakPolarHBondContact OE2-CD2 3.39Å; E207-F211 WeakPolarHBondContact OE2-CE2 3.4Å
208S91.4Very high91.7Very high37 Ų3755.7 Ų55.726%0.25928%0.283SS..Iπ-helixtrans-61.9-42.3174.3-61.80000111.6F204 I205 T206 F212 C213F204-S208 WeakPolarHBondContact O-CB 3.25Å; F204-S208 PolarHBondContact O-N 3.45Å; F204-S208 PolarHBondContact O-OG 3.47Å; I205-S208 PolarHBondContact O-N 2.52Å; T206-S208 VanDerWaalsContact C-N 3.34Å; T206-S208 PolarHBondContact O-N 3.21Å; S208-F212 WeakPolarHBondContact O-CA 3.48Å; S208-F212 VanDerWaalsContact O-CB 3.27Å; S208-F212 WeakPolarHBondContact O-CB 3.43Å; S208-F212 PolarHBondContact O-N 3.19Å; S208-C213 PolarHBondContact O-N 3.37Å; S208-C213 PolarHBondContact O-SG 3.43Å; S208-C213 VanDerWaalsContact O-SG 3.42Å
209L93.6Very high91.8Very high62 Ų6253.1 Ų53.133%0.32527%0.269SS..Iπ-helixtrans-65.1-55.3179.8179.362.1000111.9F163 I205 T206 E207 C213 L214F163-L209 HydrophobicContact CZ-CD2 4.44Å; I205-L209 WeakPolarHBondContact O-CB 3.29Å; I205-L209 PolarHBondContact O-N 3.4Å; T206-L209 PolarHBondContact O-N 3.12Å; E207-L209 VanDerWaalsContact C-N 3.34Å; E207-L209 PolarHBondContact O-N 3.26Å; L209-C213 HydrophobicContact CD1-CB 4.42Å; L209-L214 WeakPolarHBondContact O-CG 3.48Å; L209-L214 PolarHBondContact O-N 2.87Å
210Y93.5Very high92.1Very high1 Ų153.8 Ų53.80%0.00428%0.279CS..Iπ-helixtrans-81.2-33.8-169.4-69.6-70.9000113.8Y118 T122 F163 T167 T206 L214 P215Y118-Y210 HydrophobicContact CD1-CD1 4.38Å; Y118-Y210 AromaticContact CD1-CD2 3.47Å; Y118-Y210 HydrophobicContact CD1-CD2 3.47Å; Y118-Y210 VanDerWaalsContact CD1-CD2 3.47Å; Y118-Y210 HydrophobicContact CD1-CE2 4.02Å; Y118-Y210 AromaticContact CD1-CG 3.69Å; Y118-Y210 HydrophobicContact CD1-CG 3.69Å; Y118-Y210 AromaticContact CD2-CD2 3.91Å; Y118-Y210 HydrophobicContact CD2-CD2 3.91Å; Y118-Y210 AromaticContact CD2-CE2 3.57Å; Y118-Y210 HydrophobicContact CD2-CE2 3.57Å; Y118-Y210 AromaticContact CE1-CD2 3.73Å; Y118-Y210 HydrophobicContact CE1-CD2 3.73Å; Y118-Y210 HydrophobicContact CE1-CE2 4.35Å; Y118-Y210 HydrophobicContact CE1-CG 4.28Å; Y118-Y210 HydrophobicContact CE2-CD2 4.14Å; Y118-Y210 AromaticContact CE2-CE2 3.93Å; Y118-Y210 HydrophobicContact CE2-CE2 3.93Å; Y118-Y210 HydrophobicContact CG-CD1 4.23Å; Y118-Y210 AromaticContact CG-CD2 3.57Å; Y118-Y210 HydrophobicContact CG-CD2 3.57Å; Y118-Y210 HydrophobicContact CG-CE1 4.28Å; Y118-Y210 AromaticContact CG-CE2 3.62Å; Y118-Y210 HydrophobicContact CG-CE2 3.62Å; Y118-Y210 AromaticContact CG-CG 3.91Å; Y118-Y210 HydrophobicContact CG-CG 3.91Å; Y118-Y210 AromaticContact CG-CZ 3.98Å; T122-Y210 WeakPolarHBondContact OG1-CD1 3.37Å; T122-Y210 WeakPolarHBondContact OG1-CE1 3.46Å; F163-Y210 WeakPolarHBondContact CE1-OH 3.2Å; T167-Y210 PolarHBondContact OG1-OH 3.38Å; T206-Y210 WeakPolarHBondContact O-CD2 3.37Å; T206-Y210 PolarHBondContact O-N 2.74Å; Y210-L214 HydrophobicContact CD1-CD1 3.65Å; Y210-L214 HydrophobicContact CE1-CD1 4.2Å; Y210-P215 VanDerWaalsContact O-CD 3.28Å; Y210-P215 WeakPolarHBondContact O-CD 3.33Å
211F90.3Very high92.3Very high24 Ų2451.6 Ų51.611%0.10527%0.266CS..Iπ-helixtrans-106.4-9.9-174-57.9-64.5000114.1Q117 Y118 E207 H284Q117-F211 HydrophobicContact CB-CZ 4.42Å; Y118-F211 HydrophobicContact CD1-CE2 4.36Å; Y118-F211 HydrophobicContact CD1-CZ 4.33Å; Y118-F211 AromaticContact CE1-CE2 3.97Å; Y118-F211 HydrophobicContact CE1-CE2 3.97Å; Y118-F211 HydrophobicContact CE1-CZ 4.32Å; E207-F211 HydrophobicContact CB-CD2 4.39Å; E207-F211 WeakPolarHBondContact O-CB 3.43Å; E207-F211 PolarHBondContact O-N 3.44Å; E207-F211 WeakPolarHBondContact OE1-CE2 3.49Å; E207-F211 WeakPolarHBondContact OE2-CD2 3.39Å; E207-F211 WeakPolarHBondContact OE2-CE2 3.4Å; F211-H284 AromaticContact CD1-CE1 3.83Å; F211-H284 AromaticContact CD1-ND1 3.26Å; F211-H284 VanDerWaalsContact CD1-ND1 3.26Å; F211-H284 WeakPolarHBondContact CD1-ND1 3.27Å; F211-H284 AromaticContact CE1-CE1 3.71Å; F211-H284 AromaticContact CE1-ND1 3.55Å
212F89.8Confident92.3Very high107 Ų10747.4 Ų47.447%0.46924%0.243SC..Iπ-helixtrans-119.8-62.9175.5-170-101.9000112.4S208 L214 P215 I216 L285S208-F212 WeakPolarHBondContact O-CA 3.48Å; S208-F212 VanDerWaalsContact O-CB 3.27Å; S208-F212 WeakPolarHBondContact O-CB 3.43Å; S208-F212 PolarHBondContact O-N 3.19Å; F212-L214 PolarHBondContact O-N 3.21Å; F212-P215 WeakPolarHBondContact O-CD 3.43Å; F212-I216 HydrophobicContact CD1-CD1 3.75Å; F212-I216 HydrophobicContact CD2-CD1 3.88Å; F212-I216 HydrophobicContact CE1-CD1 3.45Å; F212-I216 VanDerWaalsContact CE1-CD1 3.45Å; F212-I216 HydrophobicContact CE2-CD1 3.6Å; F212-I216 HydrophobicContact CG-CD1 3.95Å; F212-I216 HydrophobicContact CZ-CD1 3.37Å; F212-I216 WeakPolarHBondContact O-CB 3.27Å; F212-I216 VanDerWaalsContact O-CG1 3.27Å; F212-I216 WeakPolarHBondContact O-CG1 3.47Å; F212-I216 PolarHBondContact O-N 2.67Å; F212-L285 HydrophobicContact CD2-CD1 4.33Å; F212-L285 HydrophobicContact CE2-CD1 4.38Å
213C92.7Very high92.2Very high57 Ų5748 Ų4839%0.38525%0.251SS..Iπ-helixtrans-62.9-47.8-175.1-64.10000112.9S208 L209 I216 T217S208-C213 PolarHBondContact O-N 3.37Å; S208-C213 PolarHBondContact O-SG 3.43Å; S208-C213 VanDerWaalsContact O-SG 3.42Å; L209-C213 HydrophobicContact CD1-CB 4.42Å; C213-I216 PolarHBondContact O-N 3.36Å; C213-T217 WeakPolarHBondContact O-CB 3.43Å; C213-T217 PolarHBondContact O-N 3.03Å; C213-T217 PolarHBondContact O-OG1 3.39Å
214L93.4Very high92.3Very high20 Ų2050.5 Ų50.511%0.10526%0.263CS..Hα-helixtrans-64-49.3179.8-74.3-177.2000112.5F125 L209 Y210 F212 I216 T217 C218F125-L214 HydrophobicContact CB-CD2 4.02Å; F125-L214 HydrophobicContact CD1-CD2 3.93Å; F125-L214 HydrophobicContact CD2-CD2 4.15Å; F125-L214 HydrophobicContact CE1-CD2 4.47Å; F125-L214 HydrophobicContact CG-CD2 3.74Å; L209-L214 WeakPolarHBondContact O-CG 3.48Å; L209-L214 PolarHBondContact O-N 2.87Å; Y210-L214 HydrophobicContact CD1-CD1 3.65Å; Y210-L214 HydrophobicContact CE1-CD1 4.2Å; F212-L214 PolarHBondContact O-N 3.21Å; L214-I216 PolarHBondContact O-N 2.77Å; L214-T217 PolarHBondContact O-N 3.13Å; L214-C218 PolarHBondContact O-N 3.17Å; L214-C218 PolarHBondContact O-SG 3.45Å
215P91.6Very high92.3Very high2 Ų244 Ų441%0.01324%0.235CC..Hα-helixtrans-58.3-42.6174.8-30.338.4000113.8Y210 F212 T217 C218 L219 I281 H284Y210-P215 VanDerWaalsContact O-CD 3.28Å; Y210-P215 WeakPolarHBondContact O-CD 3.33Å; F212-P215 WeakPolarHBondContact O-CD 3.43Å; P215-T217 VanDerWaalsContact C-N 3.34Å; P215-T217 PolarHBondContact O-N 3.11Å; P215-C218 WeakPolarHBondContact O-CB 3.19Å; P215-C218 PolarHBondContact O-N 2.86Å; P215-L219 WeakPolarHBondContact O-CB 3.43Å; P215-L219 PolarHBondContact O-N 3.24Å; P215-I281 HydrophobicContact CB-CG1 4.25Å; P215-H284 HydrophobicContact CG-CB 4.15Å
216I92Very high92.1Very high61 Ų6141.1 Ų41.131%0.31322%0.22SC..Hα-helixtrans-64.1-41.8176.7-69.3171.3000110.7F212 C213 L214 C218 L219 V220F212-I216 HydrophobicContact CD1-CD1 3.75Å; F212-I216 HydrophobicContact CD2-CD1 3.88Å; F212-I216 HydrophobicContact CE1-CD1 3.45Å; F212-I216 VanDerWaalsContact CE1-CD1 3.45Å; F212-I216 HydrophobicContact CE2-CD1 3.6Å; F212-I216 HydrophobicContact CG-CD1 3.95Å; F212-I216 HydrophobicContact CZ-CD1 3.37Å; F212-I216 WeakPolarHBondContact O-CB 3.27Å; F212-I216 VanDerWaalsContact O-CG1 3.27Å; F212-I216 WeakPolarHBondContact O-CG1 3.47Å; F212-I216 PolarHBondContact O-N 2.67Å; C213-I216 PolarHBondContact O-N 3.36Å; L214-I216 PolarHBondContact O-N 2.77Å; I216-C218 VanDerWaalsContact C-N 3.35Å; I216-C218 PolarHBondContact O-N 3.19Å; I216-L219 WeakPolarHBondContact O-CB 3.47Å; I216-L219 PolarHBondContact O-N 2.92Å; I216-L219 VanDerWaalsContact O-N 3.15Å; I216-V220 WeakPolarHBondContact O-CG2 3.48Å; I216-V220 PolarHBondContact O-N 3.2Å
217T93.4Very high92Very high60 Ų6042.9 Ų42.937%0.36824%0.239SC..Hα-helixtrans-64.1-42.1176.7-52.80000111F125 C213 L214 P215 L219 V220 L221F125-T217 HydrophobicContact CD2-CG2 4.17Å; F125-T217 HydrophobicContact CE2-CG2 3.61Å; C213-T217 WeakPolarHBondContact O-CB 3.43Å; C213-T217 PolarHBondContact O-N 3.03Å; C213-T217 PolarHBondContact O-OG1 3.39Å; L214-T217 PolarHBondContact O-N 3.13Å; P215-T217 VanDerWaalsContact C-N 3.34Å; P215-T217 PolarHBondContact O-N 3.11Å; T217-L219 VanDerWaalsContact C-N 3.29Å; T217-L219 PolarHBondContact O-N 3.35Å; T217-V220 PolarHBondContact O-N 2.78Å; T217-L221 HydrophobicContact CG2-CD1 4.25Å; T217-L221 HydrophobicContact CG2-CG 4.46Å; T217-L221 WeakPolarHBondContact O-CB 3.42Å; T217-L221 VanDerWaalsContact O-CG 3.27Å; T217-L221 WeakPolarHBondContact O-CG 3.24Å; T217-L221 PolarHBondContact O-N 2.97Å
218C92.9Very high91.8Very high1 Ų141.9 Ų41.91%0.00724%0.237CC..Hα-helixtrans-58.3-41.7172.5-66.60000111.7F125 T128 L214 P215 I216 L221 N222 I281F125-C218 WeakPolarHBondContact CA-SG 3.19Å; T128-C218 HydrophobicContact CG2-CB 4.49Å; L214-C218 PolarHBondContact O-N 3.17Å; L214-C218 PolarHBondContact O-SG 3.45Å; P215-C218 WeakPolarHBondContact O-CB 3.19Å; P215-C218 PolarHBondContact O-N 2.86Å; I216-C218 VanDerWaalsContact C-N 3.35Å; I216-C218 PolarHBondContact O-N 3.19Å; C218-L221 PolarHBondContact O-N 3.42Å; C218-N222 VanDerWaalsContact O-CB 3.28Å; C218-N222 WeakPolarHBondContact O-CB 3.36Å; C218-N222 PolarHBondContact O-N 3.1Å; C218-N222 PolarHBondContact O-ND2 2.84Å; C218-I281 HydrophobicContact CB-CD1 3.93Å; C218-I281 HydrophobicContact CB-CG1 4.26Å
219L92.1Very high91.6Very high54 Ų5442 Ų4228%0.28324%0.235SC..Hα-helixtrans-60.7-49.8177.7-177.363.8000111.1P215 I216 T217 L221 N222 I223 F278 I281P215-L219 WeakPolarHBondContact O-CB 3.43Å; P215-L219 PolarHBondContact O-N 3.24Å; I216-L219 WeakPolarHBondContact O-CB 3.47Å; I216-L219 PolarHBondContact O-N 2.92Å; I216-L219 VanDerWaalsContact O-N 3.15Å; T217-L219 VanDerWaalsContact C-N 3.29Å; T217-L219 PolarHBondContact O-N 3.35Å; L219-L221 PolarHBondContact O-N 3.25Å; L219-N222 PolarHBondContact O-N 3.32Å; L219-I223 HydrophobicContact CD1-CD1 4.31Å; L219-I223 HydrophobicContact CG-CD1 4.04Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.29Å; L219-I223 PolarHBondContact O-N 2.71Å; L219-F278 HydrophobicContact CD1-CD1 4.02Å; L219-F278 HydrophobicContact CD1-CE1 3.53Å; L219-I281 HydrophobicContact CB-CD1 3.91Å; L219-I281 HydrophobicContact CD1-CD1 4.28Å
220V94Very high91.3Very high74 Ų7447.8 Ų47.845%0.44825%0.252SS..Hα-helixtrans-59.7-48.1177.8173.90000110.6I216 T217 N222 I223 L224I216-V220 WeakPolarHBondContact O-CG2 3.48Å; I216-V220 PolarHBondContact O-N 3.2Å; T217-V220 PolarHBondContact O-N 2.78Å; V220-N222 VanDerWaalsContact C-N 3.33Å; V220-N222 PolarHBondContact O-N 3.16Å; V220-I223 PolarHBondContact O-N 2.97Å; V220-L224 HydrophobicContact CG1-CD1 4.26Å; V220-L224 WeakPolarHBondContact O-CG 3.38Å; V220-L224 PolarHBondContact O-N 3.01Å
221L93.4Very high91Very high15 Ų1553.9 Ų53.98%0.07928%0.281CS..Hα-helixtrans-60.3-42177.9-68.8175000111.9F125 L129 Y132 T217 C218 L219 L224 V225F125-L221 HydrophobicContact CD2-CD1 4.26Å; F125-L221 HydrophobicContact CE2-CD1 3.93Å; L129-L221 HydrophobicContact CB-CD1 4.18Å; L129-L221 HydrophobicContact CD1-CD1 4.3Å; Y132-L221 HydrophobicContact CD1-CD2 3.88Å; Y132-L221 HydrophobicContact CD2-CD2 4.05Å; Y132-L221 HydrophobicContact CE1-CD2 4.34Å; Y132-L221 HydrophobicContact CE2-CD2 4.5Å; Y132-L221 HydrophobicContact CG-CD2 3.72Å; T217-L221 HydrophobicContact CG2-CD1 4.25Å; T217-L221 HydrophobicContact CG2-CG 4.46Å; T217-L221 WeakPolarHBondContact O-CB 3.42Å; T217-L221 VanDerWaalsContact O-CG 3.27Å; T217-L221 WeakPolarHBondContact O-CG 3.24Å; T217-L221 PolarHBondContact O-N 2.97Å; C218-L221 PolarHBondContact O-N 3.42Å; L219-L221 PolarHBondContact O-N 3.25Å; L221-L224 PolarHBondContact O-N 2.91Å; L221-V225 WeakPolarHBondContact O-CB 3.35Å; L221-V225 VanDerWaalsContact O-CG2 3.29Å; L221-V225 WeakPolarHBondContact O-CG2 3.13Å; L221-V225 PolarHBondContact O-N 3.45Å
222N91.7Very high90.7Very high1 Ų155 Ų551%0.00529%0.291CS..Hα-helixtrans-63.9-41.5176.7-79.2-21.7000112.6C218 L219 V220 V225 I226 L274 S277 F278C218-N222 VanDerWaalsContact O-CB 3.28Å; C218-N222 WeakPolarHBondContact O-CB 3.36Å; C218-N222 PolarHBondContact O-N 3.1Å; C218-N222 PolarHBondContact O-ND2 2.84Å; L219-N222 PolarHBondContact O-N 3.32Å; V220-N222 VanDerWaalsContact C-N 3.33Å; V220-N222 PolarHBondContact O-N 3.16Å; N222-V225 PolarHBondContact O-N 3.22Å; N222-I226 VanDerWaalsContact O-CG1 3.26Å; N222-I226 WeakPolarHBondContact O-CG1 3.42Å; N222-I226 PolarHBondContact O-N 3.41Å; N222-L274 HydrophobicContact CB-CD2 3.71Å; N222-S277 VanDerWaalsContact ND2-CB 3.31Å; N222-S277 WeakPolarHBondContact ND2-CB 3.41Å; N222-S277 PolarHBondContact ND2-OG 2.73Å; N222-S277 PolarHBondContact OD1-OG 3.43Å; N222-F278 HydrophobicContact CB-CE2 4.43Å; N222-F278 HydrophobicContact CB-CZ 4.12Å
223I91.9Very high90.4Very high97 Ų9753.9 Ų53.950%0.49729%0.29SS..Hα-helixtrans-61.1-45.5175.4-69.3165.2000110.3L219 V220 I226 G227L219-I223 HydrophobicContact CD1-CD1 4.31Å; L219-I223 HydrophobicContact CG-CD1 4.04Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.29Å; L219-I223 PolarHBondContact O-N 2.71Å; V220-I223 PolarHBondContact O-N 2.97Å; I223-I226 PolarHBondContact O-N 3.23Å; I223-G227 PolarHBondContact O-N 3.39Å
224L92.4Very high90Very high78 Ų7858 Ų5841%0.40830%0.301SS..Hα-helixtrans-62.5-44.4176.7-65.8175000111.9Y132 V220 L221 I226 G227 V228Y132-L224 HydrophobicContact CD2-CB 4.09Å; Y132-L224 HydrophobicContact CD2-CD1 4.44Å; Y132-L224 HydrophobicContact CE2-CB 3.81Å; Y132-L224 HydrophobicContact CE2-CD1 3.72Å; Y132-L224 HydrophobicContact CE2-CG 4.41Å; V220-L224 HydrophobicContact CG1-CD1 4.26Å; V220-L224 WeakPolarHBondContact O-CG 3.38Å; V220-L224 PolarHBondContact O-N 3.01Å; L221-L224 PolarHBondContact O-N 2.91Å; L224-I226 VanDerWaalsContact C-N 3.31Å; L224-I226 PolarHBondContact O-N 3.33Å; L224-G227 PolarHBondContact O-N 3.11Å; L224-V228 PolarHBondContact O-N 2.71Å
225V90.3Very high89.6Confident1 Ų160 Ų601%0.00632%0.317CS..Hα-helixtrans-58.6-43.2175.5166.30000111.1Y132 I135 L221 N222 L229 T270Y132-V225 HydrophobicContact CD2-CG2 4.22Å; I135-V225 HydrophobicContact CD1-CG1 3.77Å; L221-V225 WeakPolarHBondContact O-CB 3.35Å; L221-V225 VanDerWaalsContact O-CG2 3.29Å; L221-V225 WeakPolarHBondContact O-CG2 3.13Å; L221-V225 PolarHBondContact O-N 3.45Å; N222-V225 PolarHBondContact O-N 3.22Å; V225-L229 WeakPolarHBondContact O-CB 3.21Å; V225-L229 PolarHBondContact O-N 3.49Å; V225-T270 HydrophobicContact CG1-CG2 3.86Å
226I90Very high89.2Confident43 Ų4365.6 Ų65.622%0.22134%0.341CS..Hα-helixtrans-63-44.5176.1-69.8164000110.9N222 I223 L224 L229 R230 L274 F278N222-I226 VanDerWaalsContact O-CG1 3.26Å; N222-I226 WeakPolarHBondContact O-CG1 3.42Å; N222-I226 PolarHBondContact O-N 3.41Å; I223-I226 PolarHBondContact O-N 3.23Å; L224-I226 VanDerWaalsContact C-N 3.31Å; L224-I226 PolarHBondContact O-N 3.33Å; I226-L229 PolarHBondContact O-N 3.25Å; I226-R230 HydrophobicContact CG2-CG 4.29Å; I226-R230 WeakPolarHBondContact O-CB 3.4Å; I226-R230 VanDerWaalsContact O-CG 3.31Å; I226-R230 WeakPolarHBondContact O-CG 3.12Å; I226-R230 PolarHBondContact O-N 2.87Å; I226-L274 HydrophobicContact CD1-CD1 4.19Å; I226-L274 HydrophobicContact CD1-CD2 4.05Å; I226-L274 HydrophobicContact CG1-CD1 3.64Å; I226-L274 HydrophobicContact CG1-CD2 3.93Å; I226-L274 HydrophobicContact CG1-CG 4.46Å; I226-F278 HydrophobicContact CD1-CE2 3.85Å; I226-F278 HydrophobicContact CD1-CZ 3.84Å
227G90.3Very high88.6Confident40 Ų4071 Ų7141%0.41236%0.358SS..Hα-helixtrans-57.2-51178.700000112.2I223 L224 R230 Q231I223-G227 PolarHBondContact O-N 3.39Å; L224-G227 PolarHBondContact O-N 3.11Å; G227-R230 PolarHBondContact O-N 2.86Å; G227-Q231 PolarHBondContact O-N 3.42Å
228V87.9Confident88Confident45 Ų4572 Ų7227%0.27336%0.36SS..Hα-helixtrans-67-39178.6176.80000111.6I135 L224 R230 Q231 S232I135-V228 HydrophobicContact CG2-CB 4.25Å; I135-V228 HydrophobicContact CG2-CG1 3.73Å; L224-V228 PolarHBondContact O-N 2.71Å; V228-R230 PolarHBondContact O-N 3.21Å; V228-Q231 PolarHBondContact O-N 2.99Å; V228-S232 PolarHBondContact O-N 2.97Å
229L86.1Confident87.3Confident40 Ų4076.3 Ų76.321%0.20939%0.387CS..Hα-helixtrans-61.9-44.5176.1-177.462000111.2V225 I226 S232 I233 T270V225-L229 WeakPolarHBondContact O-CB 3.21Å; V225-L229 PolarHBondContact O-N 3.49Å; I226-L229 PolarHBondContact O-N 3.25Å; L229-S232 PolarHBondContact O-N 3.28Å; L229-S232 PolarHBondContact O-OG 3Å; L229-I233 HydrophobicContact CG-CD1 4.3Å; L229-I233 WeakPolarHBondContact O-CG1 3.49Å; L229-I233 PolarHBondContact O-N 3.41Å; L229-I233 VanDerWaalsContact O-N 3.12Å; L229-T270 HydrophobicContact CD2-CG2 4.23Å
230R87.6Confident86.4Confident183 Ų18378.9 Ų78.969%0.69140%0.4SS*.Hα-helixtrans-61.6-43.5175.5-75.5178.6175.9-161.3-0.1111.6I226 G227 V228 S232 I233 K234I226-R230 HydrophobicContact CG2-CG 4.29Å; I226-R230 WeakPolarHBondContact O-CB 3.4Å; I226-R230 VanDerWaalsContact O-CG 3.31Å; I226-R230 WeakPolarHBondContact O-CG 3.12Å; I226-R230 PolarHBondContact O-N 2.87Å; G227-R230 PolarHBondContact O-N 2.86Å; V228-R230 PolarHBondContact O-N 3.21Å; R230-S232 VanDerWaalsContact C-N 3.35Å; R230-S232 PolarHBondContact O-N 3.15Å; R230-I233 PolarHBondContact O-N 2.94Å; R230-K234 PolarHBondContact O-N 3.48Å
231Q87.8Confident85.5Confident128 Ų12879 Ų7960%0.59840%0.398SS*.Hα-helixtrans-61.1-43.8176.3-169.8178.117.100111.4G227 V228 I233 K234 S235G227-Q231 PolarHBondContact O-N 3.42Å; V228-Q231 PolarHBondContact O-N 2.99Å; Q231-I233 VanDerWaalsContact C-N 3.27Å; Q231-I233 PolarHBondContact O-N 3.32Å; Q231-K234 PolarHBondContact O-N 2.96Å; Q231-S235 PolarHBondContact O-N 3.4Å; Q231-S235 PolarHBondContact O-OG 3.32Å
232S83.8Confident84.5Confident47 Ų4782.4 Ų82.433%0.32942%0.419SS..Hα-helixtrans-61.8-34.2177.880.90000112.9V228 L229 R230 K236V228-S232 PolarHBondContact O-N 2.97Å; L229-S232 PolarHBondContact O-N 3.28Å; L229-S232 PolarHBondContact O-OG 3Å; R230-S232 VanDerWaalsContact C-N 3.35Å; R230-S232 PolarHBondContact O-N 3.15Å; S232-K236 WeakPolarHBondContact O-CB 3.25Å; S232-K236 VanDerWaalsContact O-CG 3.3Å; S232-K236 WeakPolarHBondContact O-CG 3.46Å; S232-K236 PolarHBondContact O-N 2.88Å; S232-K236 VanDerWaalsContact O-N 3.16Å
233I82.7Confident83.4Confident85 Ų8587 Ų8744%0.43645%0.447SS..Hα-helixtrans-71.6-45.2175.9-66.3165000110.3L229 R230 Q231 K236 R237L229-I233 HydrophobicContact CG-CD1 4.3Å; L229-I233 WeakPolarHBondContact O-CG1 3.49Å; L229-I233 PolarHBondContact O-N 3.41Å; L229-I233 VanDerWaalsContact O-N 3.12Å; R230-I233 PolarHBondContact O-N 2.94Å; Q231-I233 VanDerWaalsContact C-N 3.27Å; Q231-I233 PolarHBondContact O-N 3.32Å; I233-K236 PolarHBondContact O-N 2.84Å; I233-R237 WeakPolarHBondContact O-CB 3.3Å; I233-R237 PolarHBondContact O-N 3.22Å
234K85.5Confident82.2Confident142 Ų14285.7 Ų85.762%0.61744%0.444SS*.Hα-helixtrans-60.4-46178-172177.6179-178.80111.1R230 Q231 K236 R237 N238R230-K234 PolarHBondContact O-N 3.48Å; Q231-K234 PolarHBondContact O-N 2.96Å; K234-K236 PolarHBondContact O-N 2.86Å; K234-R237 PolarHBondContact O-N 3.48Å; K234-N238 VanDerWaalsContact O-CG 3.32Å; K234-N238 PolarHBondContact O-N 3.29Å; K234-N238 PolarHBondContact O-OD1 2.81Å
235S85Confident81Confident64 Ų6487.2 Ų87.245%0.44846%0.456SS..Hα-helixtrans-60.9-45.2176.7-600000112Q231 R237 N238 T239Q231-S235 PolarHBondContact O-N 3.4Å; Q231-S235 PolarHBondContact O-OG 3.32Å; S235-R237 PolarHBondContact O-N 3.22Å; S235-N238 PolarHBondContact O-N 2.92Å; S235-T239 PolarHBondContact O-N 3.32Å; S235-T239 PolarHBondContact O-OG1 3.44Å
236K81.5Confident79.8Confident118 Ų11893.5 Ų93.551%0.51349%0.49SS..Hα-helixtrans-61.7-40.4176.2-77.2176.7179.5177.70112.9S232 I233 K234 L240 S263S232-K236 WeakPolarHBondContact O-CB 3.25Å; S232-K236 VanDerWaalsContact O-CG 3.3Å; S232-K236 WeakPolarHBondContact O-CG 3.46Å; S232-K236 PolarHBondContact O-N 2.88Å; S232-K236 VanDerWaalsContact O-N 3.16Å; I233-K236 PolarHBondContact O-N 2.84Å; K234-K236 PolarHBondContact O-N 2.86Å; K236-L240 WeakPolarHBondContact O-CB 3.17Å; K236-L240 PolarHBondContact O-N 3.07Å; K236-L240 VanDerWaalsContact O-N 3.08Å; K236-S263 PolarHBondContact NZ-OG 2.85Å
237R80.1Confident78.1Confident176 Ų17694 Ų9466%0.66451%0.506SS*.Hα-helixtrans-65.1-44.1177.1177.9176.2144143.9-3111I233 K234 S235 L240 I241I233-R237 WeakPolarHBondContact O-CB 3.3Å; I233-R237 PolarHBondContact O-N 3.22Å; K234-R237 PolarHBondContact O-N 3.48Å; S235-R237 PolarHBondContact O-N 3.22Å; R237-L240 PolarHBondContact O-N 3.29Å; R237-I241 HydrophobicContact CG-CD1 3.84Å; R237-I241 VanDerWaalsContact O-CG1 3.29Å; R237-I241 WeakPolarHBondContact O-CG1 3.19Å; R237-I241 PolarHBondContact O-N 3.19Å
238N80.9Confident76.3Confident79 Ų7999.9 Ų99.942%0.42253%0.528SS..Hα-helixtrans-63.8-43.3178.2-70.1-2.3000111.7K234 S235 L240 I241 V242K234-N238 VanDerWaalsContact O-CG 3.32Å; K234-N238 PolarHBondContact O-N 3.29Å; K234-N238 PolarHBondContact O-OD1 2.81Å; S235-N238 PolarHBondContact O-N 2.92Å; N238-L240 VanDerWaalsContact C-N 3.35Å; N238-L240 PolarHBondContact O-N 3.26Å; N238-I241 PolarHBondContact O-N 3.35Å; N238-V242 WeakPolarHBondContact O-CG2 2.99Å; N238-V242 PolarHBondContact O-N 2.87Å
239T77.7Confident74.5Confident92 Ų92102.4 Ų102.456%0.56455%0.547SS*.Hα-helixtrans-59.7-44174.6-52.60000111.7S235 I241 V242 T243S235-T239 PolarHBondContact O-N 3.32Å; S235-T239 PolarHBondContact O-OG1 3.44Å; T239-I241 PolarHBondContact O-N 3.28Å; T239-V242 PolarHBondContact O-N 2.9Å; T239-T243 PolarHBondContact O-N 2.9Å; T239-T243 PolarHBondContact O-OG1 3.14Å
240L74.4Confident72.8Confident108 Ų108108.6 Ų108.657%0.56558%0.581SS**Hα-helixtrans-65.8-37.3179.6-169.1149.5000112.6K236 R237 N238 T244K236-L240 WeakPolarHBondContact O-CB 3.17Å; K236-L240 PolarHBondContact O-N 3.07Å; K236-L240 VanDerWaalsContact O-N 3.08Å; R237-L240 PolarHBondContact O-N 3.29Å; N238-L240 VanDerWaalsContact C-N 3.35Å; N238-L240 PolarHBondContact O-N 3.26Å; L240-T244 PolarHBondContact O-N 3.38Å; L240-T244 VanDerWaalsContact O-N 3.13Å; L240-T244 PolarHBondContact O-OG1 3.45Å
241I74.8Confident71Confident76 Ų76106.2 Ų106.239%0.3958%0.581SS.*Hα-helixtrans-65.7-47.1175.1-67.1166.8000110.2R237 N238 T239 T243 T244 V245R237-I241 HydrophobicContact CG-CD1 3.84Å; R237-I241 VanDerWaalsContact O-CG1 3.29Å; R237-I241 WeakPolarHBondContact O-CG1 3.19Å; R237-I241 PolarHBondContact O-N 3.19Å; N238-I241 PolarHBondContact O-N 3.35Å; T239-I241 PolarHBondContact O-N 3.28Å; I241-T243 PolarHBondContact O-N 3.48Å; I241-T244 PolarHBondContact O-N 2.94Å; I241-V245 HydrophobicContact CG2-CG2 4.27Å; I241-V245 WeakPolarHBondContact O-CG2 3.36Å; I241-V245 PolarHBondContact O-N 3.32Å
242V72.7Confident69.2Low87 Ų87108.5 Ų108.553%0.52760%0.597SS.*Hα-helixtrans-60.8-41.7178173.50000111.8N238 T239 T244 V245 N246N238-V242 WeakPolarHBondContact O-CG2 2.99Å; N238-V242 PolarHBondContact O-N 2.87Å; T239-V242 PolarHBondContact O-N 2.9Å; V242-T244 PolarHBondContact O-N 3.3Å; V242-V245 PolarHBondContact O-N 3.49Å; V242-N246 PolarHBondContact O-N 2.63Å
243T68.9Low67.3Low97 Ų97111 Ų11160%0.59561%0.613SS**Hα-helixtrans-64.8-28.1174.9-51.10000112.8T239 I241T239-T243 PolarHBondContact O-N 2.9Å; T239-T243 PolarHBondContact O-OG1 3.14Å; I241-T243 PolarHBondContact O-N 3.48Å
244T66.8Low65.4Low70 Ų70114.2 Ų114.243%0.42963%0.631SS.*Hα-helixtrans-82.9-33.8-180-52.60000112.1L240 I241 V242L240-T244 PolarHBondContact O-N 3.38Å; L240-T244 VanDerWaalsContact O-N 3.13Å; L240-T244 PolarHBondContact O-OG1 3.45Å; I241-T244 PolarHBondContact O-N 2.94Å; V242-T244 PolarHBondContact O-N 3.3Å
245V67.4Low63.5Low110 Ų110116.9 Ų116.967%0.66764%0.637SS**Hα-helixtrans-78.4-34.2-178.9176.70000112.5I241 V242 G247I241-V245 HydrophobicContact CG2-CG2 4.27Å; I241-V245 WeakPolarHBondContact O-CG2 3.36Å; I241-V245 PolarHBondContact O-N 3.32Å; V242-V245 PolarHBondContact O-N 3.49Å; V245-G247 VanDerWaalsContact C-N 3.28Å; V245-G247 PolarHBondContact O-N 2.98Å
246N63.8Low61.5Low133 Ų133120.5 Ų120.571%0.71165%0.652SS**SBendtrans-82.8-3.3176.9-71.14.1000113.6V242 N248V242-N246 PolarHBondContact O-N 2.63Å; N246-N248 VanDerWaalsContact C-N 3.31Å; N246-N248 PolarHBondContact O-N 3.13Å
247G54.6Low59.8Low55 Ų55123.5 Ų123.557%0.56767%0.668SS**  trans-81.868.3-18000000112.7V245 S249V245-G247 VanDerWaalsContact C-N 3.28Å; V245-G247 PolarHBondContact O-N 2.98Å; G247-S249 PolarHBondContact O-N 2.91Å
248N53.1Low58.1Low162 Ų162122.8 Ų122.887%0.86668%0.675SS**  trans-85.279172.6-14749.4000109.7N246N246-N248 VanDerWaalsContact C-N 3.31Å; N246-N248 PolarHBondContact O-N 3.13Å
249S49.5Very low56.5Low98 Ų98123.5 Ų123.569%0.68569%0.686SS**SBendtrans170.5123.5155.453.40000112.2G247 I251G247-S249 PolarHBondContact O-N 2.91Å; S249-I251 PolarHBondContact O-N 3.45Å; S249-I251 VanDerWaalsContact O-N 3.11Å
250N50.8Low54.7Low170 Ų170124.4 Ų124.491%0.90968%0.684SS**  trans-17.998159.9-62.7-20.5000115.9
251I49.9Very low53.2Low134 Ų134124.4 Ų124.469%0.68769%0.691SS**  trans-136.9101154.9-55.6-179.3000108.3S249 C253S249-I251 PolarHBondContact O-N 3.45Å; S249-I251 VanDerWaalsContact O-N 3.11Å; I251-C253 VanDerWaalsContact C-N 3.26Å; I251-C253 HydrophobicContact CG2-CB 3.91Å; I251-C253 PolarHBondContact O-N 3.38Å
252N48.7Very low51.9Low175 Ų175126.9 Ų126.994%0.93670%0.704SS**  trans-55.492.2153.3-81.8-22.4000108.1
253C44.6Very low51Low99 Ų99125.1 Ų125.167%0.66970%0.695SS**  trans-136.1118.7163.1-102.90000108.8I251 R255I251-C253 VanDerWaalsContact C-N 3.26Å; I251-C253 HydrophobicContact CG2-CB 3.91Å; I251-C253 PolarHBondContact O-N 3.38Å; C253-R255 PolarHBondContact O-N 3.46Å
254D43Very low50.3Low154 Ų154127.7 Ų127.782%0.82470%0.698SS**  trans-18.594.9162.3-78.3-54.7000113.7N256D254-N256 PolarHBondContact O-N 3.46Å
255R45.7Very low49.8Very low197 Ų197125.5 Ų125.574%0.74369%0.689SS**  trans-81.416176.9-143.1175-174.2171.30.5112.3C253C253-R255 PolarHBondContact O-N 3.46Å
256N43.5Very low49.5Very low141 Ų141123 Ų12375%0.75468%0.68SS**  trans-90.8121.2174.6-77.9-21000109.6D254D254-N256 PolarHBondContact O-N 3.46Å
257Q45.9Very low49.6Very low181 Ų181124.3 Ų124.385%0.84668%0.675SS**SBendtrans105.118.6156-60-169.7-9.100123.1
258I44.5Very low50.4Low160 Ų160122.8 Ų122.882%0.82166%0.655SS**  trans-122.529.4161.1-37.1178.4000113.1Q260I258-Q260 PolarHBondContact O-N 3.35Å
259S45.9Very low51.3Low94 Ų94115.8 Ų115.866%0.65762%0.619SS**SBendtrans-81.870.2159.738.90000110.3
260Q40.4Very low52.6Low111 Ų111111.5 Ų111.552%0.51959%0.589SS.*  trans17.997.7154.9-70.5-88.8-20.300116I258 I262 S263I258-Q260 PolarHBondContact O-N 3.35Å; Q260-I262 PolarHBondContact O-N 3.48Å; Q260-I262 VanDerWaalsContact O-N 3.14Å; Q260-S263 PolarHBondContact O-N 3.34Å
261P43.7Very low54.2Low109 Ų109107.9 Ų107.971%0.70857%0.569SS**Hα-helixtrans-59-26.1176.821.9-32.1000113.3S263 K264 G265P261-S263 PolarHBondContact O-N 2.69Å; P261-K264 PolarHBondContact O-N 2.85Å; P261-K264 VanDerWaalsContact O-N 3.14Å; P261-G265 PolarHBondContact O-N 3.04Å
262I47.6Very low55.9Low128 Ų128101.6 Ų101.666%0.65654%0.537SS*.Hα-helixtrans-56.5-37.2-179.4-58.2174.5000111.7Q260 A266Q260-I262 PolarHBondContact O-N 3.48Å; Q260-I262 VanDerWaalsContact O-N 3.14Å; I262-A266 WeakPolarHBondContact O-CB 3.35Å; I262-A266 PolarHBondContact O-N 2.97Å
263S52.4Low57.4Low50 Ų5093.4 Ų93.435%0.3549%0.493SS..Hα-helixtrans-73.1-30.2-178.4-175.40000113.4K236 Q260 P261 R267K236-S263 PolarHBondContact NZ-OG 2.85Å; Q260-S263 PolarHBondContact O-N 3.34Å; P261-S263 PolarHBondContact O-N 2.69Å; S263-R267 WeakPolarHBondContact O-CB 3.12Å; S263-R267 PolarHBondContact O-N 3.21Å
264K54.5Low59.5Low151 Ų15189.4 Ų89.466%0.65747%0.465SS*.Hα-helixtrans-78.4-43.4-177.2-70.1-177.7-178.5174.10111P261 R267 S268P261-K264 PolarHBondContact O-N 2.85Å; P261-K264 VanDerWaalsContact O-N 3.14Å; K264-R267 PolarHBondContact O-N 3.18Å; K264-S268 PolarHBondContact O-N 3.44Å; K264-S268 VanDerWaalsContact O-N 3.09Å
265G56.9Low61.7Low23 Ų2384.3 Ų84.324%0.23744%0.441CS..Hα-helixtrans-63.5-46.8177.300000112.7P261 R267 S268 S269P261-G265 PolarHBondContact O-N 3.04Å; G265-R267 VanDerWaalsContact C-N 3.3Å; G265-R267 PolarHBondContact O-N 3.16Å; G265-S268 PolarHBondContact O-N 2.99Å; G265-S269 PolarHBondContact O-N 3.31Å
266A60.5Low63.7Low57 Ų5775.4 Ų75.447%0.47141%0.408SS..Hα-helixtrans-59.6-39.217600000112.5I262 T270I262-A266 WeakPolarHBondContact O-CB 3.35Å; I262-A266 PolarHBondContact O-N 2.97Å; A266-T270 WeakPolarHBondContact O-CB 3.19Å; A266-T270 PolarHBondContact O-N 2.98Å; A266-T270 PolarHBondContact O-OG1 2.81Å
267R67.2Low65.9Low162 Ų16268.9 Ų68.961%0.61137%0.374SS*.Hα-helixtrans-66.9-43.5178-164.4-178.395.1173.68.2112.4S263 K264 G265 T270 L271S263-R267 WeakPolarHBondContact O-CB 3.12Å; S263-R267 PolarHBondContact O-N 3.21Å; K264-R267 PolarHBondContact O-N 3.18Å; G265-R267 VanDerWaalsContact C-N 3.3Å; G265-R267 PolarHBondContact O-N 3.16Å; R267-T270 PolarHBondContact O-N 3.33Å; R267-L271 WeakPolarHBondContact O-CB 3.42Å; R267-L271 PolarHBondContact O-N 3.24Å
268S69.8Low68Low22 Ų2263.3 Ų63.315%0.15435%0.347CS..Hα-helixtrans-64-44.7178.7-163.20000111.2K264 G265 T270 L271 T272 T346 K348K264-S268 PolarHBondContact O-N 3.44Å; K264-S268 VanDerWaalsContact O-N 3.09Å; G265-S268 PolarHBondContact O-N 2.99Å; S268-T270 VanDerWaalsContact C-N 3.35Å; S268-T270 PolarHBondContact O-N 3.07Å; S268-L271 PolarHBondContact O-N 3.24Å; S268-T272 PolarHBondContact O-N 2.96Å; S268-T272 PolarHBondContact O-OG1 2.76Å; S268-T272 VanDerWaalsContact O-OG1 3.14Å; S268-T346 PolarHBondContact OG-O 2.69Å; S268-K348 PolarHBondContact OG-N 3.16Å
269S71.7Confident70.3Confident15 Ų1558.1 Ų58.111%0.10532%0.317CS..Hα-helixtrans-62.6-41.2176.9177.30000112.1G265 T272 L273G265-S269 PolarHBondContact O-N 3.31Å; S269-T272 PolarHBondContact O-N 3.29Å; S269-L273 WeakPolarHBondContact O-CB 3.5Å; S269-L273 PolarHBondContact O-N 3.36Å
270T78.1Confident72.4Confident8 Ų853.9 Ų53.95%0.04929%0.287CS..Hα-helixtrans-65.8-39.7177-520000111.7I135 V225 L229 A266 R267 S268 L273 L274I135-T270 HydrophobicContact CD1-CG2 4.2Å; V225-T270 HydrophobicContact CG1-CG2 3.86Å; L229-T270 HydrophobicContact CD2-CG2 4.23Å; A266-T270 WeakPolarHBondContact O-CB 3.19Å; A266-T270 PolarHBondContact O-N 2.98Å; A266-T270 PolarHBondContact O-OG1 2.81Å; R267-T270 PolarHBondContact O-N 3.33Å; S268-T270 VanDerWaalsContact C-N 3.35Å; S268-T270 PolarHBondContact O-N 3.07Å; T270-L273 WeakPolarHBondContact O-CB 3.41Å; T270-L273 PolarHBondContact O-N 3.34Å; T270-L274 HydrophobicContact CG2-CD1 4.17Å; T270-L274 HydrophobicContact CG2-CG 4.42Å; T270-L274 WeakPolarHBondContact O-CB 3.43Å; T270-L274 VanDerWaalsContact O-CG 3.29Å; T270-L274 WeakPolarHBondContact O-CG 3.42Å; T270-L274 PolarHBondContact O-N 2.65Å
271L83.9Confident74.7Confident94 Ų9449 Ų4949%0.49227%0.265SS..Hα-helixtrans-63.3-47.1176.6178.364.9000111.8R267 S268 L273 L274 C275R267-L271 WeakPolarHBondContact O-CB 3.42Å; R267-L271 PolarHBondContact O-N 3.24Å; S268-L271 PolarHBondContact O-N 3.24Å; L271-L273 VanDerWaalsContact C-N 3.28Å; L271-L273 PolarHBondContact O-N 3.42Å; L271-L274 PolarHBondContact O-N 3.19Å; L271-C275 WeakPolarHBondContact O-CB 3.32Å; L271-C275 PolarHBondContact O-N 2.7Å
272T85.4Confident77Confident2 Ų248.1 Ų48.11%0.01225%0.253CS..Hα-helixtrans-57.9-44.4176.7-61.80000111.6W55 S268 S269 C275 T276 Y343 T346 S347W55-T272 HydrophobicContact CZ2-CG2 4.47Å; S268-T272 PolarHBondContact O-N 2.96Å; S268-T272 PolarHBondContact O-OG1 2.76Å; S268-T272 VanDerWaalsContact O-OG1 3.14Å; S269-T272 PolarHBondContact O-N 3.29Å; T272-C275 PolarHBondContact O-N 2.92Å; T272-T276 WeakPolarHBondContact O-CB 3.3Å; T272-T276 PolarHBondContact O-N 3.4Å; T272-T276 PolarHBondContact O-OG1 2.93Å; T272-Y343 HydrophobicContact CG2-CD1 3.46Å; T272-Y343 VanDerWaalsContact CG2-CD1 3.46Å; T272-Y343 HydrophobicContact CG2-CE1 3.95Å; T272-Y343 HydrophobicContact CG2-CG 4.49Å; T272-T346 WeakPolarHBondContact CA-OG1 3.27Å; T272-T346 VanDerWaalsContact CB-OG1 3.3Å; T272-T346 WeakPolarHBondContact CB-OG1 3.48Å; T272-T346 WeakPolarHBondContact CG2-OG1 3.32Å; T272-T346 WeakPolarHBondContact OG1-CB 3.12Å; T272-T346 PolarHBondContact OG1-OG1 3.25Å; T272-S347 WeakPolarHBondContact OG1-CB 3.01Å; T272-S347 PolarHBondContact OG1-N 3.33Å
273L81.5Confident79.1Confident3 Ų342 Ų422%0.01622%0.222CC..Hα-helixtrans-57.9-53.7174.1160.260.8000111.7F127 T128 R131 S269 T270 L271 C275 T276 S277F127-L273 HydrophobicContact CD1-CD1 3.18Å; F127-L273 HydrophobicContact CD1-CG 4.24Å; F127-L273 HydrophobicContact CE1-CB 3.54Å; F127-L273 HydrophobicContact CE1-CD1 3Å; F127-L273 HydrophobicContact CE1-CD2 3.97Å; F127-L273 HydrophobicContact CE1-CG 3.61Å; F127-L273 HydrophobicContact CG-CD1 4.15Å; F127-L273 HydrophobicContact CZ-CB 3.82Å; F127-L273 HydrophobicContact CZ-CD1 3.87Å; F127-L273 HydrophobicContact CZ-CD2 3.96Å; F127-L273 HydrophobicContact CZ-CG 4.06Å; T128-L273 HydrophobicContact CG2-CD1 3.74Å; R131-L273 HydrophobicContact CB-CD2 3.58Å; R131-L273 HydrophobicContact CG-CD2 3.41Å; R131-L273 VanDerWaalsContact CG-CD2 3.41Å; S269-L273 WeakPolarHBondContact O-CB 3.5Å; S269-L273 PolarHBondContact O-N 3.36Å; T270-L273 WeakPolarHBondContact O-CB 3.41Å; T270-L273 PolarHBondContact O-N 3.34Å; L271-L273 VanDerWaalsContact C-N 3.28Å; L271-L273 PolarHBondContact O-N 3.42Å; L273-C275 VanDerWaalsContact C-N 3.3Å; L273-C275 PolarHBondContact O-N 3.49Å; L273-T276 PolarHBondContact O-N 3.4Å; L273-S277 WeakPolarHBondContact O-CB 3.28Å; L273-S277 PolarHBondContact O-N 3.24Å; L273-S277 PolarHBondContact O-OG 3.4Å
274L87.8Confident80.9Confident15 Ų1540.1 Ų40.18%0.07921%0.208CC..Hα-helixtrans-57.2-48.1-177.6-74.3170.8000109.7N222 I226 T270 L271 T276 S277 F278N222-L274 HydrophobicContact CB-CD2 3.71Å; I226-L274 HydrophobicContact CD1-CD1 4.19Å; I226-L274 HydrophobicContact CD1-CD2 4.05Å; I226-L274 HydrophobicContact CG1-CD1 3.64Å; I226-L274 HydrophobicContact CG1-CD2 3.93Å; I226-L274 HydrophobicContact CG1-CG 4.46Å; T270-L274 HydrophobicContact CG2-CD1 4.17Å; T270-L274 HydrophobicContact CG2-CG 4.42Å; T270-L274 WeakPolarHBondContact O-CB 3.43Å; T270-L274 VanDerWaalsContact O-CG 3.29Å; T270-L274 WeakPolarHBondContact O-CG 3.42Å; T270-L274 PolarHBondContact O-N 2.65Å; L271-L274 PolarHBondContact O-N 3.19Å; L274-T276 PolarHBondContact O-N 2.97Å; L274-S277 WeakPolarHBondContact CA-OG 3.24Å; L274-S277 PolarHBondContact O-N 2.94Å; L274-S277 PolarHBondContact O-OG 3.27Å; L274-F278 HydrophobicContact CB-CD2 4.23Å; L274-F278 HydrophobicContact CB-CE2 4.17Å; L274-F278 HydrophobicContact CD2-CE2 4.1Å; L274-F278 WeakPolarHBondContact O-CB 3.11Å; L274-F278 WeakPolarHBondContact O-CD2 3.48Å; L274-F278 PolarHBondContact O-N 2.85Å
275C89.4Confident82.6Confident48 Ų4835.4 Ų35.432%0.32419%0.189SC..Hα-helixtrans-59.6-47178.2-172.90000112.4L271 T272 L273 S277 Y279 I342 T346L271-C275 WeakPolarHBondContact O-CB 3.32Å; L271-C275 PolarHBondContact O-N 2.7Å; T272-C275 PolarHBondContact O-N 2.92Å; L273-C275 VanDerWaalsContact C-N 3.3Å; L273-C275 PolarHBondContact O-N 3.49Å; C275-S277 PolarHBondContact O-N 3.49Å; C275-Y279 VanDerWaalsContact O-CB 3.32Å; C275-Y279 WeakPolarHBondContact O-CB 3.28Å; C275-Y279 PolarHBondContact O-N 3.13Å; C275-I342 HydrophobicContact CB-CG2 4.07Å; C275-T346 HydrophobicContact CB-CG2 3.94Å
276T87.2Confident84.2Confident9 Ų936.1 Ų36.16%0.05519%0.19CC..Hα-helixtrans-62.9-43.3179.5-520000111.7T272 L273 L274 Y279 L280 K339 Y343T272-T276 WeakPolarHBondContact O-CB 3.3Å; T272-T276 PolarHBondContact O-N 3.4Å; T272-T276 PolarHBondContact O-OG1 2.93Å; L273-T276 PolarHBondContact O-N 3.4Å; L274-T276 PolarHBondContact O-N 2.97Å; T276-Y279 PolarHBondContact O-N 3.27Å; T276-L280 WeakPolarHBondContact O-CB 3.36Å; T276-L280 PolarHBondContact O-N 3.29Å; T276-K339 HydrophobicContact CG2-CD 4.05Å; T276-K339 HydrophobicContact CG2-CG 4.11Å; T276-Y343 HydrophobicContact CG2-CE1 4.34Å; T276-Y343 WeakPolarHBondContact OG1-CE1 3.39Å
277S89Confident85.7Confident5 Ų535 Ų354%0.03518%0.178CC..Hα-helixtrans-74.4-39.6-178.246.30000112.3N222 L273 L274 C275 Y279 L280 I281N222-S277 VanDerWaalsContact ND2-CB 3.31Å; N222-S277 WeakPolarHBondContact ND2-CB 3.41Å; N222-S277 PolarHBondContact ND2-OG 2.73Å; N222-S277 PolarHBondContact OD1-OG 3.43Å; L273-S277 WeakPolarHBondContact O-CB 3.28Å; L273-S277 PolarHBondContact O-N 3.24Å; L273-S277 PolarHBondContact O-OG 3.4Å; L274-S277 WeakPolarHBondContact CA-OG 3.24Å; L274-S277 PolarHBondContact O-N 2.94Å; L274-S277 PolarHBondContact O-OG 3.27Å; C275-S277 PolarHBondContact O-N 3.49Å; S277-Y279 VanDerWaalsContact C-N 3.31Å; S277-Y279 PolarHBondContact O-N 3.43Å; S277-L280 PolarHBondContact O-N 3.01Å; S277-I281 WeakPolarHBondContact O-CB 3.05Å; S277-I281 VanDerWaalsContact O-CD1 3.24Å; S277-I281 WeakPolarHBondContact O-CD1 3.43Å; S277-I281 WeakPolarHBondContact O-CG1 3.46Å; S277-I281 PolarHBondContact O-N 3.43Å
278F91Very high86.7Confident63 Ų6328.3 Ų28.328%0.27616%0.157SC..Hα-helixtrans-60.3-41.8170.3-80.2-63.7000112.1L219 N222 I226 L274 I281 I282L219-F278 HydrophobicContact CD1-CD1 4.02Å; L219-F278 HydrophobicContact CD1-CE1 3.53Å; N222-F278 HydrophobicContact CB-CE2 4.43Å; N222-F278 HydrophobicContact CB-CZ 4.12Å; I226-F278 HydrophobicContact CD1-CE2 3.85Å; I226-F278 HydrophobicContact CD1-CZ 3.84Å; L274-F278 HydrophobicContact CB-CD2 4.23Å; L274-F278 HydrophobicContact CB-CE2 4.17Å; L274-F278 HydrophobicContact CD2-CE2 4.1Å; L274-F278 WeakPolarHBondContact O-CB 3.11Å; L274-F278 WeakPolarHBondContact O-CD2 3.48Å; L274-F278 PolarHBondContact O-N 2.85Å; F278-I281 PolarHBondContact O-N 3.18Å; F278-I282 VanDerWaalsContact O-CG1 3.28Å; F278-I282 WeakPolarHBondContact O-CG1 3.34Å; F278-I282 PolarHBondContact O-N 3.22Å
279Y92.6Very high87.7Confident51 Ų5131.4 Ų31.420%0.217%0.171CC..Hα-helixtrans-61.6-47.3177.7-170.9-108.8000111.9C275 T276 S277 I281 I282 A283 F331 T334 H335 A338 I342C275-Y279 VanDerWaalsContact O-CB 3.32Å; C275-Y279 WeakPolarHBondContact O-CB 3.28Å; C275-Y279 PolarHBondContact O-N 3.13Å; T276-Y279 PolarHBondContact O-N 3.27Å; S277-Y279 VanDerWaalsContact C-N 3.31Å; S277-Y279 PolarHBondContact O-N 3.43Å; Y279-I281 VanDerWaalsContact C-N 3.34Å; Y279-I281 PolarHBondContact O-N 3Å; Y279-I282 PolarHBondContact O-N 3.06Å; Y279-A283 WeakPolarHBondContact O-CB 3.45Å; Y279-A283 PolarHBondContact O-N 3.45Å; Y279-F331 HydrophobicContact CE2-CZ 4.23Å; Y279-T334 WeakPolarHBondContact OH-CB 3.22Å; Y279-T334 PolarHBondContact OH-OG1 3.18Å; Y279-H335 HydrophobicContact CD1-CB 4.04Å; Y279-H335 HydrophobicContact CE1-CB 3.99Å; Y279-A338 HydrophobicContact CD1-CB 4.34Å; Y279-A338 HydrophobicContact CE1-CB 3.47Å; Y279-A338 VanDerWaalsContact CE1-CB 3.47Å; Y279-A338 WeakPolarHBondContact OH-CB 3.44Å; Y279-I342 HydrophobicContact CD1-CD1 3.97Å; Y279-I342 HydrophobicContact CD2-CD1 4.49Å; Y279-I342 HydrophobicContact CE1-CD1 4.48Å; Y279-I342 HydrophobicContact CG-CD1 3.94Å
280L89.5Confident88.6Confident5 Ų531.1 Ų31.13%0.02617%0.17CC..Hα-helixtrans-58.2-44.9174.4-175.8149.2000111.5P121 A124 T276 S277 I282 A283 H284P121-L280 HydrophobicContact CB-CD2 4.47Å; A124-L280 HydrophobicContact CB-CD1 3.72Å; A124-L280 HydrophobicContact CB-CD2 4.39Å; T276-L280 WeakPolarHBondContact O-CB 3.36Å; T276-L280 PolarHBondContact O-N 3.29Å; S277-L280 PolarHBondContact O-N 3.01Å; L280-I282 PolarHBondContact O-N 3.48Å; L280-A283 PolarHBondContact O-N 3.45Å; L280-H284 VanDerWaalsContact CD2-CD2 3.4Å; L280-H284 WeakPolarHBondContact CD2-CD2 3.29Å; L280-H284 VanDerWaalsContact CG-CD2 3.48Å; L280-H284 WeakPolarHBondContact CG-CD2 3.32Å; L280-H284 PolarHBondContact O-CD2 3.48Å; L280-H284 PolarHBondContact O-N 3.31Å
281I89.7Confident89.1Confident9 Ų932.7 Ų32.75%0.04618%0.179CC..Hα-helixtrans-61-46.9178.2-67.5157.4000110.9P215 C218 L219 S277 F278 Y279 A283 L285P215-I281 HydrophobicContact CB-CG1 4.25Å; C218-I281 HydrophobicContact CB-CD1 3.93Å; C218-I281 HydrophobicContact CB-CG1 4.26Å; L219-I281 HydrophobicContact CB-CD1 3.91Å; L219-I281 HydrophobicContact CD1-CD1 4.28Å; S277-I281 WeakPolarHBondContact O-CB 3.05Å; S277-I281 VanDerWaalsContact O-CD1 3.24Å; S277-I281 WeakPolarHBondContact O-CD1 3.43Å; S277-I281 WeakPolarHBondContact O-CG1 3.46Å; S277-I281 PolarHBondContact O-N 3.43Å; F278-I281 PolarHBondContact O-N 3.18Å; Y279-I281 VanDerWaalsContact C-N 3.34Å; Y279-I281 PolarHBondContact O-N 3Å; I281-A283 VanDerWaalsContact C-N 3.34Å; I281-A283 PolarHBondContact O-N 2.82Å; I281-L285 WeakPolarHBondContact O-CB 3.41Å; I281-L285 PolarHBondContact O-N 2.8Å
282I92Very high89.2Confident91 Ų9132.5 Ų32.547%0.46718%0.182SC..Hα-helixtrans-61.3-45.8178.7-68.1165.5000110.1F278 Y279 L280 S286 F331F278-I282 VanDerWaalsContact O-CG1 3.28Å; F278-I282 WeakPolarHBondContact O-CG1 3.34Å; F278-I282 PolarHBondContact O-N 3.22Å; Y279-I282 PolarHBondContact O-N 3.06Å; L280-I282 PolarHBondContact O-N 3.48Å; I282-S286 VanDerWaalsContact O-CB 3.25Å; I282-S286 WeakPolarHBondContact O-CB 3.06Å; I282-S286 PolarHBondContact O-N 2.93Å; I282-S286 VanDerWaalsContact O-N 3.08Å; I282-S286 PolarHBondContact O-OG 3.31Å; I282-F331 HydrophobicContact CG2-CE1 4.18Å
283A92.1Very high89.4Confident0 Ų036.2 Ų36.20%020%0.2CC..Hα-helixtrans-58.5-54.3178.200000112.1Y279 L280 I281 V287 A332 H335Y279-A283 WeakPolarHBondContact O-CB 3.45Å; Y279-A283 PolarHBondContact O-N 3.45Å; L280-A283 PolarHBondContact O-N 3.45Å; I281-A283 VanDerWaalsContact C-N 3.34Å; I281-A283 PolarHBondContact O-N 2.82Å; A283-V287 PolarHBondContact O-N 2.92Å; A283-A332 HydrophobicContact CB-CB 4.36Å; A283-H335 HydrophobicContact CB-CB 4.01Å
284H89.3Confident89.7Confident10 Ų1037.5 Ų37.55%0.04621%0.207CC..Hα-helixtrans-71.4-41.4-176.8-70.8-71.9000113.4F211 P215 L280 S286 V287 A288 H335F211-H284 AromaticContact CD1-CE1 3.83Å; F211-H284 AromaticContact CD1-ND1 3.26Å; F211-H284 VanDerWaalsContact CD1-ND1 3.26Å; F211-H284 WeakPolarHBondContact CD1-ND1 3.27Å; F211-H284 AromaticContact CE1-CE1 3.71Å; F211-H284 AromaticContact CE1-ND1 3.55Å; P215-H284 HydrophobicContact CG-CB 4.15Å; L280-H284 VanDerWaalsContact CD2-CD2 3.4Å; L280-H284 WeakPolarHBondContact CD2-CD2 3.29Å; L280-H284 VanDerWaalsContact CG-CD2 3.48Å; L280-H284 WeakPolarHBondContact CG-CD2 3.32Å; L280-H284 PolarHBondContact O-CD2 3.48Å; L280-H284 PolarHBondContact O-N 3.31Å; H284-S286 VanDerWaalsContact C-N 3.27Å; H284-S286 PolarHBondContact O-N 3.46Å; H284-V287 PolarHBondContact O-N 2.89Å; H284-A288 PolarHBondContact O-N 2.63Å; H284-H335 AromaticContact CE1-CE1 3.66Å; H284-H335 AromaticContact CE1-NE2 3.99Å; H284-H335 AromaticContact NE2-CE1 3.62Å; H284-H335 AromaticContact NE2-NE2 3.58Å
285L89.5Confident89.5Confident52 Ų5244.4 Ų44.427%0.27224%0.236SC..Hα-helixtrans-64.6-36.6-179.9-173.964000111F212 I281 V287 A288 I289F212-L285 HydrophobicContact CD2-CD1 4.33Å; F212-L285 HydrophobicContact CE2-CD1 4.38Å; I281-L285 WeakPolarHBondContact O-CB 3.41Å; I281-L285 PolarHBondContact O-N 2.8Å; L285-V287 VanDerWaalsContact C-N 3.35Å; L285-V287 PolarHBondContact O-N 3.37Å; L285-A288 PolarHBondContact O-N 3.16Å; L285-I289 HydrophobicContact CD1-CD1 4.24Å; L285-I289 HydrophobicContact CD1-CG1 4.38Å; L285-I289 HydrophobicContact CD2-CD1 4.45Å; L285-I289 HydrophobicContact CG-CD1 3.84Å; L285-I289 HydrophobicContact CG-CG1 4.4Å; L285-I289 WeakPolarHBondContact O-CB 3.43Å; L285-I289 VanDerWaalsContact O-CG1 3.23Å; L285-I289 WeakPolarHBondContact O-CG1 3.25Å; L285-I289 PolarHBondContact O-N 2.91Å
286S92.2Very high89.5Confident37 Ų3752.4 Ų52.426%0.25926%0.259SS..Hα-helixtrans-61.7-43.2175.7-58.20000111.5I282 H284 A290I282-S286 VanDerWaalsContact O-CB 3.25Å; I282-S286 WeakPolarHBondContact O-CB 3.06Å; I282-S286 PolarHBondContact O-N 2.93Å; I282-S286 VanDerWaalsContact O-N 3.08Å; I282-S286 PolarHBondContact O-OG 3.31Å; H284-S286 VanDerWaalsContact C-N 3.27Å; H284-S286 PolarHBondContact O-N 3.46Å; S286-A290 WeakPolarHBondContact O-CB 3.39Å; S286-A290 PolarHBondContact O-N 3.25Å
287V90.9Very high89.5Confident34 Ų3454 Ų5421%0.20627%0.267CS..Hα-helixtrans-65.2-47.2176175.50000111.2A283 H284 L285 I289 A290 V291 I328 E329 A332A283-V287 PolarHBondContact O-N 2.92Å; H284-V287 PolarHBondContact O-N 2.89Å; L285-V287 VanDerWaalsContact C-N 3.35Å; L285-V287 PolarHBondContact O-N 3.37Å; V287-I289 VanDerWaalsContact C-N 3.31Å; V287-I289 PolarHBondContact O-N 2.98Å; V287-A290 PolarHBondContact O-N 3.21Å; V287-A290 VanDerWaalsContact O-N 3.12Å; V287-V291 HydrophobicContact CG1-CG2 4.24Å; V287-V291 WeakPolarHBondContact O-CG2 3.42Å; V287-V291 PolarHBondContact O-N 3.38Å; V287-I328 HydrophobicContact CG2-CG2 3.98Å; V287-E329 HydrophobicContact CG1-CG 4.38Å; V287-E329 HydrophobicContact CG2-CG 4.44Å; V287-A332 HydrophobicContact CG2-CB 3.23Å
288A88.8Confident89.3Confident21 Ų2158.9 Ų58.917%0.17430%0.299CS..Hα-helixtrans-57.9-45.2179.600000111.5H284 L285 V291 V292H284-A288 PolarHBondContact O-N 2.63Å; L285-A288 PolarHBondContact O-N 3.16Å; A288-V291 PolarHBondContact O-N 2.83Å; A288-V292 VanDerWaalsContact O-CG2 3.31Å; A288-V292 WeakPolarHBondContact O-CG2 3.44Å; A288-V292 PolarHBondContact O-N 3.49Å
289I89.7Confident88.9Confident87 Ų8758.7 Ų58.745%0.44630%0.303SS..Hα-helixtrans-62.2-45.9175.4-68.5168.2000110.7L285 V287 V291 V292 I293L285-I289 HydrophobicContact CD1-CD1 4.24Å; L285-I289 HydrophobicContact CD1-CG1 4.38Å; L285-I289 HydrophobicContact CD2-CD1 4.45Å; L285-I289 HydrophobicContact CG-CD1 3.84Å; L285-I289 HydrophobicContact CG-CG1 4.4Å; L285-I289 WeakPolarHBondContact O-CB 3.43Å; L285-I289 VanDerWaalsContact O-CG1 3.23Å; L285-I289 WeakPolarHBondContact O-CG1 3.25Å; L285-I289 PolarHBondContact O-N 2.91Å; V287-I289 VanDerWaalsContact C-N 3.31Å; V287-I289 PolarHBondContact O-N 2.98Å; I289-V291 VanDerWaalsContact C-N 3.34Å; I289-V291 PolarHBondContact O-N 2.93Å; I289-V292 PolarHBondContact O-N 3.44Å; I289-I293 HydrophobicContact CG2-CD1 3.64Å; I289-I293 HydrophobicContact CG2-CG1 4.32Å; I289-I293 VanDerWaalsContact O-CG1 3.31Å; I289-I293 WeakPolarHBondContact O-CG1 3.47Å; I289-I293 PolarHBondContact O-N 3.35Å
290A91.4Very high88.5Confident10 Ų1056.7 Ų56.78%0.08330%0.298CS..Hα-helixtrans-61-41.3179.600000112.4S286 V287 H294 R325 I328S286-A290 WeakPolarHBondContact O-CB 3.39Å; S286-A290 PolarHBondContact O-N 3.25Å; V287-A290 PolarHBondContact O-N 3.21Å; V287-A290 VanDerWaalsContact O-N 3.12Å; A290-H294 VanDerWaalsContact O-CB 3.26Å; A290-H294 WeakPolarHBondContact O-CB 3.36Å; A290-H294 PolarHBondContact O-N 3.36Å; A290-R325 HydrophobicContact CB-CB 4.45Å; A290-R325 HydrophobicContact CB-CG 4.23Å; A290-I328 HydrophobicContact CB-CD1 3.89Å; A290-I328 HydrophobicContact CB-CG2 4.25Å
291V87.3Confident88.4Confident40 Ų4060.2 Ų60.224%0.24232%0.316CS..Hα-helixtrans-65.6-43.8176.5170.90000111.2V287 A288 I289 H294 K295V287-V291 HydrophobicContact CG1-CG2 4.24Å; V287-V291 WeakPolarHBondContact O-CG2 3.42Å; V287-V291 PolarHBondContact O-N 3.38Å; A288-V291 PolarHBondContact O-N 2.83Å; I289-V291 VanDerWaalsContact C-N 3.34Å; I289-V291 PolarHBondContact O-N 2.93Å; V291-H294 PolarHBondContact O-N 2.66Å; V291-K295 HydrophobicContact CG1-CD 4.44Å; V291-K295 WeakPolarHBondContact O-CG 3.25Å; V291-K295 PolarHBondContact O-N 3.03Å
292V87.6Confident88.3Confident91 Ų9162.5 Ų62.555%0.55233%0.327SS*.Hα-helixtrans-63.4-44.2177.9170.50000111.2A288 I289 K295 R296A288-V292 VanDerWaalsContact O-CG2 3.31Å; A288-V292 WeakPolarHBondContact O-CG2 3.44Å; A288-V292 PolarHBondContact O-N 3.49Å; I289-V292 PolarHBondContact O-N 3.44Å; V292-K295 PolarHBondContact O-N 3.42Å; V292-R296 WeakPolarHBondContact O-CG 3.46Å; V292-R296 PolarHBondContact O-N 2.7Å
293I89.5Confident88.2Confident79 Ų7963.4 Ų63.441%0.40533%0.325SS..Hα-helixtrans-62.5-47.4176.7-68.7170.8000109.9I289 K295 R296 L297I289-I293 HydrophobicContact CG2-CD1 3.64Å; I289-I293 HydrophobicContact CG2-CG1 4.32Å; I289-I293 VanDerWaalsContact O-CG1 3.31Å; I289-I293 WeakPolarHBondContact O-CG1 3.47Å; I289-I293 PolarHBondContact O-N 3.35Å; I293-K295 VanDerWaalsContact C-N 3.33Å; I293-K295 PolarHBondContact O-N 3.47Å; I293-R296 PolarHBondContact O-N 2.94Å; I293-L297 HydrophobicContact CG2-CD1 4.33Å; I293-L297 HydrophobicContact CG2-CG 4.47Å; I293-L297 PolarHBondContact O-N 2.96Å
294H86.9Confident88.1Confident31 Ų3163.5 Ų63.514%0.14433%0.326CS..Hα-helixtrans-59-42.1-179.2179.171000112.6A290 V291 R296 L297 Y318 F322 R325A290-H294 VanDerWaalsContact O-CB 3.26Å; A290-H294 WeakPolarHBondContact O-CB 3.36Å; A290-H294 PolarHBondContact O-N 3.36Å; V291-H294 PolarHBondContact O-N 2.66Å; H294-R296 PolarHBondContact O-N 3.47Å; H294-R296 VanDerWaalsContact O-N 3.14Å; H294-L297 PolarHBondContact O-N 3.3Å; H294-Y318 AromaticContact CE1-CE2 3.69Å; H294-Y318 AromaticContact CE1-CZ 3.81Å; H294-F322 AromaticContact CE1-CD2 3.84Å; H294-R325 PolarHBondContact CD2-NH1 2.95Å; H294-R325 PolarHBondContact NE2-NH1 3.14Å
295K84.1Confident88Confident159 Ų15964.6 Ų64.669%0.69134%0.335SS*.THydrogen-bonded Turntrans-63.6-16.5175.5-74.4-175.2177.6-172.30114.3V291 V292 I293V291-K295 HydrophobicContact CG1-CD 4.44Å; V291-K295 WeakPolarHBondContact O-CG 3.25Å; V291-K295 PolarHBondContact O-N 3.03Å; V292-K295 PolarHBondContact O-N 3.42Å; I293-K295 VanDerWaalsContact C-N 3.33Å; I293-K295 PolarHBondContact O-N 3.47Å
296R88.4Confident88Confident216 Ų21664.7 Ų64.782%0.81534%0.335SS*.THydrogen-bonded Turntrans-100.7-8.8179.7-64.7-66.7-172.6170.90.8113.2V292 I293 H294V292-R296 WeakPolarHBondContact O-CG 3.46Å; V292-R296 PolarHBondContact O-N 2.7Å; I293-R296 PolarHBondContact O-N 2.94Å; H294-R296 PolarHBondContact O-N 3.47Å; H294-R296 VanDerWaalsContact O-N 3.14Å
297L86.9Confident87.9Confident43 Ų4370.2 Ų70.223%0.22536%0.357CS..SBendtrans-79.1126.4179.1-72.2169.1000109.6I293 H294 F321I293-L297 HydrophobicContact CG2-CD1 4.33Å; I293-L297 HydrophobicContact CG2-CG 4.47Å; I293-L297 PolarHBondContact O-N 2.96Å; H294-L297 PolarHBondContact O-N 3.3Å; L297-F321 HydrophobicContact CD1-CB 3.39Å; L297-F321 HydrophobicContact CD1-CD1 4.04Å; L297-F321 HydrophobicContact CD1-CD2 3.59Å; L297-F321 HydrophobicContact CD1-CE2 4.35Å; L297-F321 HydrophobicContact CD1-CG 3.41Å; L297-F321 VanDerWaalsContact CD1-CG 3.41Å; L297-F321 HydrophobicContact CD2-CD2 3.97Å; L297-F321 HydrophobicContact CD2-CE2 4.02Å; L297-F321 HydrophobicContact CG-CD2 4.47Å
298P85.1Confident87.8Confident107 Ų10770.1 Ų70.170%0.69535%0.354SS*.PPolyproline II helixtrans-65.8138.3170.828.5-32.7000109.4
299T83.7Confident87.9Confident60 Ų6069.1 Ų69.137%0.36835%0.346SS..PPolyproline II helixtrans-66.3150.5162.946.40000108.9W11 Y318W11-T299 HydrophobicContact CZ2-CG2 4.43Å; T299-Y318 HydrophobicContact CG2-CD2 4.31Å; T299-Y318 HydrophobicContact CG2-CE2 3.94Å
300G84.5Confident87.9Confident9 Ų971.8 Ų71.89%0.09335%0.351CS..PPolyproline II helixtrans-65.5173.4170.400000110.8E302G300-E302 PolarHBondContact O-N 3.1Å; G300-E302 VanDerWaalsContact O-N 3.1Å
301N86.6Confident87.9Confident78 Ų7877.7 Ų77.742%0.41738%0.381SS..PPolyproline II helixtrans-57.7120.4176.7177.40.7000110.4Y303 L304 W315N301-Y303 PolarHBondContact O-N 2.91Å; N301-Y303 PolarHBondContact OD1-N 3.49Å; N301-L304 HydrophobicContact CB-CD1 3.95Å; N301-L304 HydrophobicContact CB-CG 3.86Å; N301-L304 WeakPolarHBondContact O-CG 3.31Å; N301-W315 PolarHBondContact O-NE1 3.4Å
302E87.9Confident88.1Confident58 Ų5876.7 Ų76.727%0.27137%0.374SS..THydrogen-bonded Turntrans-74.9-9.5-173-57.8-170.6162.200113.9S9 V10 W11 G300S9-E302 CarbonylContact C-O 3.56Å; S9-E302 WeakPolarHBondContact CA-O 3.38Å; V10-E302 WeakPolarHBondContact CG2-O 3.48Å; V10-E302 PolarHBondContact N-O 3.44Å; W11-E302 PolarHBondContact NE1-OE1 2.65Å; G300-E302 PolarHBondContact O-N 3.1Å; G300-E302 VanDerWaalsContact O-N 3.1Å
303Y90.6Very high88.3Confident109 Ų10976.5 Ų76.543%0.42738%0.375SS..THydrogen-bonded Turntrans-105.512.9-178-56.6-80.1000112.9I5 S6 N301I5-Y303 CarbonylContact C-O 3.58Å; I5-Y303 WeakPolarHBondContact CA-O 3.24Å; S6-Y303 PolarHBondContact N-O 2.67Å; S6-Y303 WeakPolarHBondContact O-CD1 3.27Å; S6-Y303 PolarHBondContact OG-O 2.77Å; S6-Y303 VanDerWaalsContact OG-O 3.05Å; N301-Y303 PolarHBondContact O-N 2.91Å; N301-Y303 PolarHBondContact OD1-N 3.49Å
304L88.7Confident88.4Confident3 Ų374.1 Ų74.12%0.01637%0.37CS..BIsolated β-bridgetrans-74.5148174.8-68.2178.2000110.9Y3 R13 N301 Q308 I309 D312Y3-L304 HydrophobicContact CD1-CD2 3.32Å; Y3-L304 HydrophobicContact CE1-CD2 3.85Å; Y3-L304 HydrophobicContact CG-CD2 3.95Å; R13-L304 VanDerWaalsContact CZ-O 3.23Å; R13-L304 PolarHBondContact NH1-O 3.06Å; R13-L304 PolarHBondContact NH2-O 3.49Å; N301-L304 HydrophobicContact CB-CD1 3.95Å; N301-L304 HydrophobicContact CB-CG 3.86Å; N301-L304 WeakPolarHBondContact O-CG 3.31Å; L304-Q308 HydrophobicContact CB-CB 4.08Å; L304-Q308 HydrophobicContact CD2-CB 4.31Å; L304-I309 HydrophobicContact CB-CG1 3.78Å; L304-D312 HydrophobicContact CD1-CB 3.91Å
305S88.6Confident88.7Confident33 Ų3372.7 Ų72.723%0.23136%0.363CS..  trans-68.7160.1170.876.40000111.6E307 Q308 I309S305-E307 PolarHBondContact O-N 2.9Å; S305-Q308 WeakPolarHBondContact O-CA 3.14Å; S305-Q308 WeakPolarHBondContact O-CB 3.19Å; S305-Q308 PolarHBondContact O-N 3.46Å; S305-Q308 VanDerWaalsContact OG-CD 3.26Å; S305-Q308 VanDerWaalsContact OG-CG 3.32Å; S305-Q308 WeakPolarHBondContact OG-CG 3.48Å; S305-Q308 PolarHBondContact OG-N 3.29Å; S305-Q308 PolarHBondContact OG-OE1 2.84Å; S305-I309 WeakPolarHBondContact O-CG1 3.25Å; S305-I309 PolarHBondContact O-N 3.33Å
306D89.3Confident89Confident53 Ų5367.4 Ų67.428%0.28335%0.345SS..Hα-helixtrans-60.5-33.4-178.4-70.60.8000113.3R13 Y14 F25 R310R13-D306 IonicContact CZ-OD1 3.5Å; R13-D306 IonicContact NE-OD1 2.73Å; R13-D306 PolarHBondContact NE-OD1 3.2Å; R13-D306 IonicContact NH2-OD1 3.41Å; R13-D306 PolarHBondContact NH2-OD1 2.91Å; Y14-D306 PolarHBondContact OH-OD2 3.19Å; F25-D306 HydrophobicContact CZ-CB 4Å; D306-R310 WeakPolarHBondContact O-CG 3.29Å; D306-R310 PolarHBondContact O-N 3.33Å
307E88.4Confident89.2Confident154 Ų15460.1 Ų60.172%0.7232%0.324SS*.Hα-helixtrans-68.2-35.6174-64.5-177.8170.100112.1S305 N311S305-E307 PolarHBondContact O-N 2.9Å; E307-N311 PolarHBondContact O-ND2 3.31Å; E307-N311 VanDerWaalsContact O-ND2 3.11Å
308Q90.3Very high89.5Confident31 Ų3159.1 Ų59.115%0.14532%0.317CS..Hα-helixtrans-74.3-39.3177.1-70.3163.1-5.300111.5Y3 K4 L304 S305 R310 N311 D312Y3-Q308 HydrophobicContact CD1-CB 4.32Å; Y3-Q308 HydrophobicContact CD1-CG 4.07Å; K4-Q308 PolarHBondContact O-OE1 3.28Å; K4-Q308 VanDerWaalsContact O-OE1 3.1Å; L304-Q308 HydrophobicContact CB-CB 4.08Å; L304-Q308 HydrophobicContact CD2-CB 4.31Å; S305-Q308 WeakPolarHBondContact O-CA 3.14Å; S305-Q308 WeakPolarHBondContact O-CB 3.19Å; S305-Q308 PolarHBondContact O-N 3.46Å; S305-Q308 VanDerWaalsContact OG-CD 3.26Å; S305-Q308 VanDerWaalsContact OG-CG 3.32Å; S305-Q308 WeakPolarHBondContact OG-CG 3.48Å; S305-Q308 PolarHBondContact OG-N 3.29Å; S305-Q308 PolarHBondContact OG-OE1 2.84Å; Q308-R310 PolarHBondContact O-N 3.41Å; Q308-N311 CarbonylContact O-C 3.45Å; Q308-N311 PolarHBondContact O-N 3.1Å; Q308-D312 WeakPolarHBondContact O-CB 3.26Å; Q308-D312 PolarHBondContact O-N 3.48Å
309I91.1Very high89.8Confident0 Ų054.7 Ų54.70%029%0.287CS..Hα-helixtrans-57.4-39.6176.2-70.1168000111.1V10 F25 L304 S305 N311 D312 W315 F319V10-I309 HydrophobicContact CB-CD1 4.4Å; V10-I309 HydrophobicContact CG1-CD1 4.07Å; V10-I309 HydrophobicContact CG2-CD1 3.39Å; V10-I309 HydrophobicContact CG2-CG1 4.45Å; F25-I309 HydrophobicContact CD1-CG2 3.74Å; F25-I309 HydrophobicContact CE1-CB 3.75Å; F25-I309 HydrophobicContact CE1-CG2 3.34Å; F25-I309 HydrophobicContact CE2-CG2 4.2Å; F25-I309 HydrophobicContact CG-CG2 4.32Å; F25-I309 HydrophobicContact CZ-CB 3.94Å; F25-I309 HydrophobicContact CZ-CD1 4.04Å; F25-I309 HydrophobicContact CZ-CG2 3.61Å; L304-I309 HydrophobicContact CB-CG1 3.78Å; S305-I309 WeakPolarHBondContact O-CG1 3.25Å; S305-I309 PolarHBondContact O-N 3.33Å; I309-N311 PolarHBondContact O-N 3.45Å; I309-D312 PolarHBondContact O-N 3.32Å; I309-W315 HydrophobicContact CB-CG 4.4Å; I309-W315 HydrophobicContact CG1-CG 4.35Å; I309-W315 HydrophobicContact CG2-CB 3.83Å; I309-W315 HydrophobicContact CG2-CD2 4.03Å; I309-W315 HydrophobicContact CG2-CG 3.7Å; I309-F319 HydrophobicContact CG2-CE2 3.84Å; I309-F319 HydrophobicContact CG2-CZ 4.34Å
310R90Very high90.2Very high144 Ų14460.6 Ų60.654%0.54330%0.303SS..Hα-helixtrans-61.4-30176.6-71.9176.1-171.1-101.9-4.5113.1F25 D306 Q308 T316F25-R310 HydrophobicContact CD1-CG 3.99Å; F25-R310 HydrophobicContact CE1-CG 3.85Å; D306-R310 WeakPolarHBondContact O-CG 3.29Å; D306-R310 PolarHBondContact O-N 3.33Å; Q308-R310 PolarHBondContact O-N 3.41Å; R310-T316 WeakPolarHBondContact O-CG2 3.38Å
311N90.8Very high90.5Very high133 Ų13364.4 Ų64.471%0.71132%0.317SS*.Hα-helixtrans-102.3-8.6-177.6-64.7-45.7000113.1E307 Q308 I309E307-N311 PolarHBondContact O-ND2 3.31Å; E307-N311 VanDerWaalsContact O-ND2 3.11Å; Q308-N311 CarbonylContact O-C 3.45Å; Q308-N311 PolarHBondContact O-N 3.1Å; I309-N311 PolarHBondContact O-N 3.45Å
312D91.9Very high90.7Very high20 Ų2062 Ų6211%0.10730%0.303CS..  trans-76126.9-177-17975.3000111.2L304 Q308 I309 G314 W315 T316L304-D312 HydrophobicContact CD1-CB 3.91Å; Q308-D312 WeakPolarHBondContact O-CB 3.26Å; Q308-D312 PolarHBondContact O-N 3.48Å; I309-D312 PolarHBondContact O-N 3.32Å; D312-G314 VanDerWaalsContact C-N 3.28Å; D312-G314 PolarHBondContact O-N 2.67Å; D312-G314 VanDerWaalsContact OD2-CA 3.28Å; D312-G314 WeakPolarHBondContact OD2-CA 3.3Å; D312-G314 PolarHBondContact OD2-N 3.42Å; D312-W315 HydrophobicContact CB-CB 4.28Å; D312-W315 PolarHBondContact OD2-N 3.46Å; D312-T316 WeakPolarHBondContact O-CB 3.48Å; D312-T316 VanDerWaalsContact O-CG2 3.26Å; D312-T316 WeakPolarHBondContact O-CG2 3.36Å; D312-T316 PolarHBondContact O-N 3.4Å; D312-T316 PolarHBondContact O-OG1 2.83Å
313P91.5Very high90.9Very high86 Ų8660.3 Ų60.356%0.55830%0.296SS*.Hα-helixtrans-65.6-29.3-17925-33.7000113.1T316 T317P313-T316 VanDerWaalsContact CA-OG1 3.31Å; P313-T316 WeakPolarHBondContact CA-OG1 3.36Å; P313-T316 PolarHBondContact O-OG1 2.98Å; P313-T317 VanDerWaalsContact O-CB 3.24Å; P313-T317 WeakPolarHBondContact O-CB 3.3Å; P313-T317 PolarHBondContact O-N 2.8Å; P313-T317 VanDerWaalsContact O-N 3.13Å; P313-T317 PolarHBondContact O-OG1 3.31Å
314G91.5Very high91Very high30 Ų3058.7 Ų58.731%0.30930%0.298SS..Hα-helixtrans-68.6-53.1177.700000111.6D312 T317 Y318D312-G314 VanDerWaalsContact C-N 3.28Å; D312-G314 PolarHBondContact O-N 2.67Å; D312-G314 VanDerWaalsContact OD2-CA 3.28Å; D312-G314 WeakPolarHBondContact OD2-CA 3.3Å; D312-G314 PolarHBondContact OD2-N 3.42Å; G314-T317 PolarHBondContact O-N 3.26Å; G314-Y318 WeakPolarHBondContact O-CB 3.41Å; G314-Y318 PolarHBondContact O-N 2.9Å
315W92.8Very high91.1Very high0 Ų061.4 Ų61.40%031%0.308CS..Hα-helixtrans-63.1-43.6177.4-81.8108.8000113.3V10 W11 L21 N301 I309 D312 T317 Y318 F319V10-W315 HydrophobicContact CB-CH2 4.44Å; V10-W315 HydrophobicContact CB-CZ2 4.29Å; V10-W315 HydrophobicContact CG1-CH2 4.46Å; V10-W315 HydrophobicContact CG2-CH2 4.38Å; V10-W315 HydrophobicContact CG2-CZ2 3.77Å; W11-W315 HydrophobicContact CZ2-CH2 4.29Å; L21-W315 HydrophobicContact CD2-CZ3 4.37Å; N301-W315 PolarHBondContact O-NE1 3.4Å; I309-W315 HydrophobicContact CB-CG 4.4Å; I309-W315 HydrophobicContact CG1-CG 4.35Å; I309-W315 HydrophobicContact CG2-CB 3.83Å; I309-W315 HydrophobicContact CG2-CD2 4.03Å; I309-W315 HydrophobicContact CG2-CG 3.7Å; D312-W315 HydrophobicContact CB-CB 4.28Å; D312-W315 PolarHBondContact OD2-N 3.46Å; W315-T317 VanDerWaalsContact C-N 3.28Å; W315-T317 PolarHBondContact O-N 2.95Å; W315-Y318 HydrophobicContact CE3-CD1 4.1Å; W315-Y318 HydrophobicContact CZ3-CD1 4.02Å; W315-Y318 HydrophobicContact CZ3-CE1 4.26Å; W315-Y318 WeakPolarHBondContact O-CB 3.29Å; W315-Y318 PolarHBondContact O-N 3.44Å; W315-F319 HydrophobicContact CB-CD2 4.42Å; W315-F319 HydrophobicContact CB-CE2 4.07Å; W315-F319 HydrophobicContact CD2-CE2 4.44Å; W315-F319 HydrophobicContact CD2-CZ 4.5Å; W315-F319 HydrophobicContact CE3-CE1 4.21Å; W315-F319 AromaticContact CE3-CE2 3.81Å; W315-F319 HydrophobicContact CE3-CE2 3.81Å; W315-F319 AromaticContact CE3-CZ 3.57Å; W315-F319 HydrophobicContact CE3-CZ 3.57Å; W315-F319 HydrophobicContact CZ3-CE1 4.38Å; W315-F319 HydrophobicContact CZ3-CZ 4.01Å; W315-F319 WeakPolarHBondContact O-CD2 3.42Å; W315-F319 WeakPolarHBondContact O-CG 3.37Å; W315-F319 PolarHBondContact O-N 3.29Å
316T91.4Very high91.3Very high49 Ų4960 Ų6030%0.30130%0.298SS..Hα-helixtrans-62.5-37.317752.80000112R310 D312 P313 R320R310-T316 WeakPolarHBondContact O-CG2 3.38Å; D312-T316 WeakPolarHBondContact O-CB 3.48Å; D312-T316 VanDerWaalsContact O-CG2 3.26Å; D312-T316 WeakPolarHBondContact O-CG2 3.36Å; D312-T316 PolarHBondContact O-N 3.4Å; D312-T316 PolarHBondContact O-OG1 2.83Å; P313-T316 VanDerWaalsContact CA-OG1 3.31Å; P313-T316 WeakPolarHBondContact CA-OG1 3.36Å; P313-T316 PolarHBondContact O-OG1 2.98Å; T316-R320 WeakPolarHBondContact O-CB 3.31Å; T316-R320 VanDerWaalsContact O-CG 3.24Å; T316-R320 WeakPolarHBondContact O-CG 3.34Å; T316-R320 PolarHBondContact O-N 2.96Å
317T92Very high91.4Very high63 Ų6361.6 Ų61.639%0.38731%0.306SS..Hα-helixtrans-65.4-46.3173.1-61.90000111.1P313 G314 W315 F319 R320 F321P313-T317 VanDerWaalsContact O-CB 3.24Å; P313-T317 WeakPolarHBondContact O-CB 3.3Å; P313-T317 PolarHBondContact O-N 2.8Å; P313-T317 VanDerWaalsContact O-N 3.13Å; P313-T317 PolarHBondContact O-OG1 3.31Å; G314-T317 PolarHBondContact O-N 3.26Å; W315-T317 VanDerWaalsContact C-N 3.28Å; W315-T317 PolarHBondContact O-N 2.95Å; T317-F319 PolarHBondContact O-N 3.38Å; T317-R320 PolarHBondContact O-N 3.3Å; T317-F321 HydrophobicContact CG2-CD2 3.58Å; T317-F321 HydrophobicContact CG2-CE2 3.5Å; T317-F321 VanDerWaalsContact CG2-CE2 3.5Å; T317-F321 VanDerWaalsContact O-CD2 3.26Å; T317-F321 WeakPolarHBondContact O-CD2 3.49Å; T317-F321 PolarHBondContact O-N 3Å
318Y91.9Very high91.7Very high21 Ų2156.3 Ų56.38%0.08228%0.282CS..Hα-helixtrans-56.8-50.4176.2-179.8-96.4000112.1F22 H294 T299 G314 W315 R320 F321 F322F22-Y318 HydrophobicContact CE1-CE1 4.21Å; F22-Y318 HydrophobicContact CZ-CE1 4.24Å; H294-Y318 AromaticContact CE1-CE2 3.69Å; H294-Y318 AromaticContact CE1-CZ 3.81Å; T299-Y318 HydrophobicContact CG2-CD2 4.31Å; T299-Y318 HydrophobicContact CG2-CE2 3.94Å; G314-Y318 WeakPolarHBondContact O-CB 3.41Å; G314-Y318 PolarHBondContact O-N 2.9Å; W315-Y318 HydrophobicContact CE3-CD1 4.1Å; W315-Y318 HydrophobicContact CZ3-CD1 4.02Å; W315-Y318 HydrophobicContact CZ3-CE1 4.26Å; W315-Y318 WeakPolarHBondContact O-CB 3.29Å; W315-Y318 PolarHBondContact O-N 3.44Å; Y318-R320 VanDerWaalsContact C-N 3.34Å; Y318-R320 PolarHBondContact O-N 2.72Å; Y318-F321 PolarHBondContact O-N 3.41Å; Y318-F322 WeakPolarHBondContact O-CB 3.48Å; Y318-F322 PolarHBondContact O-N 3.24Å
319F92.5Very high91.7Very high15 Ų1557.8 Ų57.87%0.06629%0.289CS..Hα-helixtrans-63.8-36.5178.5-67.2-51000113L21 F22 F25 I309 W315 T317 T323L21-F319 HydrophobicContact CG-CE1 4.39Å; F22-F319 AromaticContact CD1-CD1 4Å; F22-F319 HydrophobicContact CD1-CD1 4Å; F22-F319 HydrophobicContact CD1-CE1 4.07Å; F22-F319 AromaticContact CE1-CD1 3.89Å; F22-F319 HydrophobicContact CE1-CD1 3.89Å; F22-F319 HydrophobicContact CE1-CE1 4Å; F25-F319 HydrophobicContact CB-CD1 4.29Å; F25-F319 HydrophobicContact CB-CD2 3.93Å; F25-F319 HydrophobicContact CB-CE1 3.86Å; F25-F319 HydrophobicContact CB-CE2 3.45Å; F25-F319 VanDerWaalsContact CB-CE2 3.45Å; F25-F319 HydrophobicContact CB-CG 4.34Å; F25-F319 HydrophobicContact CB-CZ 3.41Å; F25-F319 VanDerWaalsContact CB-CZ 3.41Å; F25-F319 HydrophobicContact CD1-CE2 4.04Å; F25-F319 HydrophobicContact CD1-CZ 4.37Å; F25-F319 HydrophobicContact CD2-CE2 4.24Å; F25-F319 AromaticContact CD2-CZ 3.74Å; F25-F319 HydrophobicContact CD2-CZ 3.74Å; F25-F319 HydrophobicContact CG-CE1 4.43Å; F25-F319 AromaticContact CG-CE2 3.66Å; F25-F319 HydrophobicContact CG-CE2 3.66Å; F25-F319 AromaticContact CG-CZ 3.59Å; F25-F319 HydrophobicContact CG-CZ 3.59Å; I309-F319 HydrophobicContact CG2-CE2 3.84Å; I309-F319 HydrophobicContact CG2-CZ 4.34Å; W315-F319 HydrophobicContact CB-CD2 4.42Å; W315-F319 HydrophobicContact CB-CE2 4.07Å; W315-F319 HydrophobicContact CD2-CE2 4.44Å; W315-F319 HydrophobicContact CD2-CZ 4.5Å; W315-F319 HydrophobicContact CE3-CE1 4.21Å; W315-F319 AromaticContact CE3-CE2 3.81Å; W315-F319 HydrophobicContact CE3-CE2 3.81Å; W315-F319 AromaticContact CE3-CZ 3.57Å; W315-F319 HydrophobicContact CE3-CZ 3.57Å; W315-F319 HydrophobicContact CZ3-CE1 4.38Å; W315-F319 HydrophobicContact CZ3-CZ 4.01Å; W315-F319 WeakPolarHBondContact O-CD2 3.42Å; W315-F319 WeakPolarHBondContact O-CG 3.37Å; W315-F319 PolarHBondContact O-N 3.29Å; T317-F319 PolarHBondContact O-N 3.38Å; F319-T323 WeakPolarHBondContact O-CB 3.49Å; F319-T323 PolarHBondContact O-N 3.35Å; F319-T323 PolarHBondContact O-OG1 3.35Å
320R91.6Very high91.8Very high184 Ų18458.3 Ų58.369%0.69429%0.293SS*.Hα-helixtrans-64.2-47.3174.1-78.3175.7176.2-169.71111.7T316 T317 Y318 T323 V324T316-R320 WeakPolarHBondContact O-CB 3.31Å; T316-R320 VanDerWaalsContact O-CG 3.24Å; T316-R320 WeakPolarHBondContact O-CG 3.34Å; T316-R320 PolarHBondContact O-N 2.96Å; T317-R320 PolarHBondContact O-N 3.3Å; Y318-R320 VanDerWaalsContact C-N 3.34Å; Y318-R320 PolarHBondContact O-N 2.72Å; R320-T323 WeakPolarHBondContact O-CB 3.44Å; R320-T323 PolarHBondContact O-N 3.28Å; R320-V324 WeakPolarHBondContact O-CG2 3.01Å; R320-V324 PolarHBondContact O-N 2.92Å
321F91.7Very high91.9Very high89 Ų8955.4 Ų55.439%0.3928%0.284SS..Hα-helixtrans-65-40.7177.4-85.3-69.6000112.4L297 T317 Y318 T323 V324 R325L297-F321 HydrophobicContact CD1-CB 3.39Å; L297-F321 HydrophobicContact CD1-CD1 4.04Å; L297-F321 HydrophobicContact CD1-CD2 3.59Å; L297-F321 HydrophobicContact CD1-CE2 4.35Å; L297-F321 HydrophobicContact CD1-CG 3.41Å; L297-F321 VanDerWaalsContact CD1-CG 3.41Å; L297-F321 HydrophobicContact CD2-CD2 3.97Å; L297-F321 HydrophobicContact CD2-CE2 4.02Å; L297-F321 HydrophobicContact CG-CD2 4.47Å; T317-F321 HydrophobicContact CG2-CD2 3.58Å; T317-F321 HydrophobicContact CG2-CE2 3.5Å; T317-F321 VanDerWaalsContact CG2-CE2 3.5Å; T317-F321 VanDerWaalsContact O-CD2 3.26Å; T317-F321 WeakPolarHBondContact O-CD2 3.49Å; T317-F321 PolarHBondContact O-N 3Å; Y318-F321 PolarHBondContact O-N 3.41Å; F321-T323 VanDerWaalsContact C-N 3.29Å; F321-T323 PolarHBondContact O-N 3.41Å; F321-V324 PolarHBondContact O-N 3.18Å; F321-R325 WeakPolarHBondContact O-CB 3.33Å; F321-R325 PolarHBondContact O-N 2.94Å
322F90.9Very high92Very high27 Ų2749.6 Ų49.612%0.11826%0.255CS..Hα-helixtrans-60-42173.7-172.5-97.3000111.2F22 L29 H294 Y318 V324 R325 V326F22-F322 AromaticContact CD1-CD1 3.68Å; F22-F322 HydrophobicContact CD1-CD1 3.68Å; F22-F322 AromaticContact CD1-CE1 3.74Å; F22-F322 HydrophobicContact CD1-CE1 3.74Å; F22-F322 HydrophobicContact CD1-CG 4.39Å; F22-F322 HydrophobicContact CD1-CZ 4.49Å; F22-F322 HydrophobicContact CD2-CD1 4.47Å; F22-F322 AromaticContact CD2-CE1 3.74Å; F22-F322 HydrophobicContact CD2-CE1 3.74Å; F22-F322 AromaticContact CD2-CZ 3.87Å; F22-F322 HydrophobicContact CD2-CZ 3.87Å; F22-F322 HydrophobicContact CE1-CB 4.22Å; F22-F322 AromaticContact CE1-CD1 3.34Å; F22-F322 HydrophobicContact CE1-CD1 3.34Å; F22-F322 HydrophobicContact CE1-CD2 4.08Å; F22-F322 AromaticContact CE1-CE1 3.59Å; F22-F322 HydrophobicContact CE1-CE1 3.59Å; F22-F322 HydrophobicContact CE1-CE2 4.29Å; F22-F322 AromaticContact CE1-CG 3.6Å; F22-F322 HydrophobicContact CE1-CG 3.6Å; F22-F322 HydrophobicContact CE1-CZ 4.07Å; F22-F322 HydrophobicContact CE2-CD1 4.21Å; F22-F322 HydrophobicContact CE2-CD2 4.37Å; F22-F322 AromaticContact CE2-CE1 3.61Å; F22-F322 HydrophobicContact CE2-CE1 3.61Å; F22-F322 AromaticContact CE2-CE2 3.81Å; F22-F322 HydrophobicContact CE2-CE2 3.81Å; F22-F322 AromaticContact CE2-CZ 3.39Å; F22-F322 HydrophobicContact CE2-CZ 3.39Å; F22-F322 HydrophobicContact CG-CD1 4.25Å; F22-F322 AromaticContact CG-CE1 3.83Å; F22-F322 HydrophobicContact CG-CE1 3.83Å; F22-F322 HydrophobicContact CG-CZ 4.42Å; F22-F322 AromaticContact CZ-CD1 3.65Å; F22-F322 HydrophobicContact CZ-CD1 3.65Å; F22-F322 AromaticContact CZ-CD2 3.68Å; F22-F322 HydrophobicContact CZ-CD2 3.68Å; F22-F322 AromaticContact CZ-CE1 3.54Å; F22-F322 HydrophobicContact CZ-CE1 3.54Å; F22-F322 AromaticContact CZ-CE2 3.58Å; F22-F322 HydrophobicContact CZ-CE2 3.58Å; F22-F322 AromaticContact CZ-CG 3.71Å; F22-F322 HydrophobicContact CZ-CG 3.71Å; F22-F322 AromaticContact CZ-CZ 3.51Å; F22-F322 HydrophobicContact CZ-CZ 3.51Å; L29-F322 HydrophobicContact CD1-CD1 3.5Å; L29-F322 HydrophobicContact CD1-CE1 3.7Å; H294-F322 AromaticContact CE1-CD2 3.84Å; Y318-F322 WeakPolarHBondContact O-CB 3.48Å; Y318-F322 PolarHBondContact O-N 3.24Å; F322-V324 PolarHBondContact O-N 2.71Å; F322-R325 WeakPolarHBondContact O-CB 3.48Å; F322-R325 PolarHBondContact O-N 3.47Å; F322-V326 HydrophobicContact CD1-CG2 4.08Å; F322-V326 HydrophobicContact CE1-CG2 3.69Å; F322-V326 HydrophobicContact CZ-CG2 4.04Å; F322-V326 WeakPolarHBondContact O-CG2 3.38Å; F322-V326 PolarHBondContact O-N 3.26Å
323T91.5Very high92Very high22 Ų2250.7 Ų50.714%0.13526%0.26CS..Hα-helixtrans-58.7-47173.7-590000112.2H28 L29 F319 R320 F321 R325 V326 L327H28-T323 WeakPolarHBondContact NE2-CG2 3.33Å; H28-T323 PolarHBondContact NE2-OG1 2.89Å; L29-T323 HydrophobicContact CD2-CG2 3.76Å; F319-T323 WeakPolarHBondContact O-CB 3.49Å; F319-T323 PolarHBondContact O-N 3.35Å; F319-T323 PolarHBondContact O-OG1 3.35Å; R320-T323 WeakPolarHBondContact O-CB 3.44Å; R320-T323 PolarHBondContact O-N 3.28Å; F321-T323 VanDerWaalsContact C-N 3.29Å; F321-T323 PolarHBondContact O-N 3.41Å; T323-R325 VanDerWaalsContact C-N 3.31Å; T323-R325 PolarHBondContact O-N 3.4Å; T323-V326 PolarHBondContact O-N 3.42Å; T323-L327 HydrophobicContact CG2-CD1 4.2Å; T323-L327 WeakPolarHBondContact O-CG 3.3Å; T323-L327 PolarHBondContact O-N 3.23Å
324V92.5Very high92.1Very high76 Ų7646.7 Ų46.746%0.46123%0.234SC..Hα-helixtrans-61.3-41.7177172.30000111R320 F321 F322 L327 I328R320-V324 WeakPolarHBondContact O-CG2 3.01Å; R320-V324 PolarHBondContact O-N 2.92Å; F321-V324 PolarHBondContact O-N 3.18Å; F322-V324 PolarHBondContact O-N 2.71Å; V324-L327 PolarHBondContact O-N 3.4Å; V324-I328 HydrophobicContact CG1-CD1 3.83Å; V324-I328 HydrophobicContact CG1-CG1 4.43Å; V324-I328 VanDerWaalsContact O-CG1 3.29Å; V324-I328 WeakPolarHBondContact O-CG1 3.44Å; V324-I328 PolarHBondContact O-N 3.01Å
325R92Very high92.2Very high59 Ų5945.4 Ų45.422%0.22322%0.22CC..Hα-helixtrans-59.4-49.7175.9176.4-173.4163.8-169.9-7111.6A290 H294 F321 F322 T323 L327 I328 E329A290-R325 HydrophobicContact CB-CB 4.45Å; A290-R325 HydrophobicContact CB-CG 4.23Å; H294-R325 PolarHBondContact CD2-NH1 2.95Å; H294-R325 PolarHBondContact NE2-NH1 3.14Å; F321-R325 WeakPolarHBondContact O-CB 3.33Å; F321-R325 PolarHBondContact O-N 2.94Å; F322-R325 WeakPolarHBondContact O-CB 3.48Å; F322-R325 PolarHBondContact O-N 3.47Å; T323-R325 VanDerWaalsContact C-N 3.31Å; T323-R325 PolarHBondContact O-N 3.4Å; R325-L327 VanDerWaalsContact C-N 3.29Å; R325-L327 PolarHBondContact O-N 3.06Å; R325-I328 WeakPolarHBondContact O-CB 3.44Å; R325-I328 PolarHBondContact O-N 3.05Å; R325-I328 VanDerWaalsContact O-N 3.07Å; R325-E329 IonicContact CZ-OE1 2.81Å; R325-E329 IonicContact NE-OE1 2.77Å; R325-E329 PolarHBondContact NE-OE1 3.32Å; R325-E329 IonicContact NH2-OE1 2.67Å; R325-E329 PolarHBondContact NH2-OE1 2.98Å; R325-E329 WeakPolarHBondContact O-CG 3.35Å; R325-E329 PolarHBondContact O-N 3.31Å
326V91.1Very high92.3Very high5 Ų545.9 Ų45.93%0.0322%0.222CC..Hα-helixtrans-59.3-41.2177.8171.30000110.9L29 E33 F322 T323 I328 E329 C330L29-V326 HydrophobicContact CD2-CB 4.23Å; L29-V326 HydrophobicContact CD2-CG1 4.32Å; L29-V326 HydrophobicContact CD2-CG2 4.45Å; E33-V326 HydrophobicContact CG-CG1 4.16Å; F322-V326 HydrophobicContact CD1-CG2 4.08Å; F322-V326 HydrophobicContact CE1-CG2 3.69Å; F322-V326 HydrophobicContact CZ-CG2 4.04Å; F322-V326 WeakPolarHBondContact O-CG2 3.38Å; F322-V326 PolarHBondContact O-N 3.26Å; T323-V326 PolarHBondContact O-N 3.42Å; V326-I328 VanDerWaalsContact C-N 3.34Å; V326-I328 PolarHBondContact O-N 3.04Å; V326-E329 PolarHBondContact O-N 3.33Å; V326-C330 WeakPolarHBondContact O-CB 3.44Å; V326-C330 PolarHBondContact O-N 3.27Å; V326-C330 PolarHBondContact O-SG 3.43Å
327L92.8Very high92.4Very high85 Ų8543.6 Ų43.645%0.44521%0.208SC..Hα-helixtrans-64.3-37.2175.2-69.7172.7000112.6V32 T323 V324 R325 C330 F331V32-L327 HydrophobicContact CG1-CD2 3.97Å; V32-L327 HydrophobicContact CG2-CD2 4.45Å; T323-L327 HydrophobicContact CG2-CD1 4.2Å; T323-L327 WeakPolarHBondContact O-CG 3.3Å; T323-L327 PolarHBondContact O-N 3.23Å; V324-L327 PolarHBondContact O-N 3.4Å; R325-L327 VanDerWaalsContact C-N 3.29Å; R325-L327 PolarHBondContact O-N 3.06Å; L327-C330 WeakPolarHBondContact O-CB 3.2Å; L327-C330 PolarHBondContact O-N 3.4Å; L327-F331 WeakPolarHBondContact O-CB 3.49Å; L327-F331 PolarHBondContact O-N 3.05Å
328I93.8Very high92.5Very high44 Ų4441.3 Ų41.323%0.22620%0.195CC..Hα-helixtrans-67.3-40.5174.5-70.7167.6000111V287 A290 V324 R325 V326 F331 A332V287-I328 HydrophobicContact CG2-CG2 3.98Å; A290-I328 HydrophobicContact CB-CD1 3.89Å; A290-I328 HydrophobicContact CB-CG2 4.25Å; V324-I328 HydrophobicContact CG1-CD1 3.83Å; V324-I328 HydrophobicContact CG1-CG1 4.43Å; V324-I328 VanDerWaalsContact O-CG1 3.29Å; V324-I328 WeakPolarHBondContact O-CG1 3.44Å; V324-I328 PolarHBondContact O-N 3.01Å; R325-I328 WeakPolarHBondContact O-CB 3.44Å; R325-I328 PolarHBondContact O-N 3.05Å; R325-I328 VanDerWaalsContact O-N 3.07Å; V326-I328 VanDerWaalsContact C-N 3.34Å; V326-I328 PolarHBondContact O-N 3.04Å; I328-F331 CarbonylContact O-C 3.12Å; I328-F331 WeakPolarHBondContact O-CB 3.43Å; I328-F331 PolarHBondContact O-N 2.74Å; I328-A332 WeakPolarHBondContact O-CB 3.39Å; I328-A332 PolarHBondContact O-N 3.46Å
329E91.3Very high92.5Very high61 Ų6140.6 Ų40.629%0.28519%0.193SC..Hα-helixtrans-64.8-40.6174.6-71.1174.8-174.500111.2V287 R325 V326 F331 A332 M333V287-E329 HydrophobicContact CG1-CG 4.38Å; V287-E329 HydrophobicContact CG2-CG 4.44Å; R325-E329 IonicContact CZ-OE1 2.81Å; R325-E329 IonicContact NE-OE1 2.77Å; R325-E329 PolarHBondContact NE-OE1 3.32Å; R325-E329 IonicContact NH2-OE1 2.67Å; R325-E329 PolarHBondContact NH2-OE1 2.98Å; R325-E329 WeakPolarHBondContact O-CG 3.35Å; R325-E329 PolarHBondContact O-N 3.31Å; V326-E329 PolarHBondContact O-N 3.33Å; E329-F331 PolarHBondContact O-N 3.02Å; E329-A332 PolarHBondContact O-N 3.2Å; E329-A332 VanDerWaalsContact O-N 3.1Å; E329-M333 PolarHBondContact O-N 3.1Å
330C92Very high92.6Very high12 Ų1241.3 Ų41.38%0.08120%0.196CC..Hα-helixtrans-57.9-47.1170.3-69.90000111.7N36 V326 L327 A332 M333N36-C330 HydrophobicContact CB-CB 4.49Å; N36-C330 WeakPolarHBondContact OD1-CB 3.38Å; V326-C330 WeakPolarHBondContact O-CB 3.44Å; V326-C330 PolarHBondContact O-N 3.27Å; V326-C330 PolarHBondContact O-SG 3.43Å; L327-C330 WeakPolarHBondContact O-CB 3.2Å; L327-C330 PolarHBondContact O-N 3.4Å; C330-A332 VanDerWaalsContact C-N 3.3Å; C330-A332 PolarHBondContact O-N 3.34Å; C330-M333 PolarHBondContact O-N 2.93Å
331F93Very high92.7Very high83 Ų8335.4 Ų35.436%0.36418%0.181SC..Hα-helixtrans-62.6-36.2173.4175.6-98.5000111.9Y279 I282 L327 I328 E329 M333 T334Y279-F331 HydrophobicContact CE2-CZ 4.23Å; I282-F331 HydrophobicContact CG2-CE1 4.18Å; L327-F331 WeakPolarHBondContact O-CB 3.49Å; L327-F331 PolarHBondContact O-N 3.05Å; I328-F331 CarbonylContact O-C 3.12Å; I328-F331 WeakPolarHBondContact O-CB 3.43Å; I328-F331 PolarHBondContact O-N 2.74Å; E329-F331 PolarHBondContact O-N 3.02Å; F331-M333 PolarHBondContact O-N 2.75Å; F331-T334 VanDerWaalsContact O-CB 3.27Å; F331-T334 WeakPolarHBondContact O-CB 3.46Å; F331-T334 WeakPolarHBondContact O-CG2 3.16Å; F331-T334 PolarHBondContact O-N 3.36Å; F331-T334 PolarHBondContact O-OG1 2.82Å
332A93Very high92.8Very high11 Ų1132.1 Ų32.19%0.09117%0.168CC..Hα-helixtrans-69.5-34.4-179.700000112.6A283 V287 I328 E329 C330 T334 H335A283-A332 HydrophobicContact CB-CB 4.36Å; V287-A332 HydrophobicContact CG2-CB 3.23Å; I328-A332 WeakPolarHBondContact O-CB 3.39Å; I328-A332 PolarHBondContact O-N 3.46Å; E329-A332 PolarHBondContact O-N 3.2Å; E329-A332 VanDerWaalsContact O-N 3.1Å; C330-A332 VanDerWaalsContact C-N 3.3Å; C330-A332 PolarHBondContact O-N 3.34Å; A332-T334 PolarHBondContact O-N 2.9Å; A332-T334 VanDerWaalsContact O-N 3.15Å; A332-H335 PolarHBondContact O-N 2.93Å; A332-H335 VanDerWaalsContact O-N 3.16Å; A332-H335 PolarHBondContact O-ND1 2.86Å
333M91.7Very high92.9Very high42 Ų4230.8 Ų30.821%0.20716%0.162CC..Hα-helixtrans-58.5-26173.8-74.7-170.1-107.800113.1N36 F82 E329 C330 F331 H335 Y336N36-M333 WeakPolarHBondContact ND2-CE 3.29Å; F82-M333 HydrophobicContact CZ-CG 4.45Å; E329-M333 PolarHBondContact O-N 3.1Å; C330-M333 PolarHBondContact O-N 2.93Å; F331-M333 PolarHBondContact O-N 2.75Å; M333-H335 PolarHBondContact O-N 3.47Å; M333-H335 VanDerWaalsContact O-N 3.11Å; M333-Y336 PolarHBondContact O-N 3.12Å; M333-Y336 VanDerWaalsContact O-N 3.13Å
334T94.1Very high92.9Very high2 Ų232.1 Ų32.11%0.01217%0.168CC..Hα-helixtrans-60.6-22.6178.7710000113.3W40 Y279 F331 A332 Y336 A337 A338W40-T334 HydrophobicContact CD2-CG2 3.7Å; W40-T334 HydrophobicContact CE3-CG2 3.96Å; W40-T334 HydrophobicContact CG-CG2 4.48Å; W40-T334 HydrophobicContact CH2-CG2 3.42Å; W40-T334 VanDerWaalsContact CH2-CG2 3.42Å; W40-T334 HydrophobicContact CZ2-CG2 3.13Å; W40-T334 HydrophobicContact CZ3-CG2 3.82Å; Y279-T334 WeakPolarHBondContact OH-CB 3.22Å; Y279-T334 PolarHBondContact OH-OG1 3.18Å; F331-T334 VanDerWaalsContact O-CB 3.27Å; F331-T334 WeakPolarHBondContact O-CB 3.46Å; F331-T334 WeakPolarHBondContact O-CG2 3.16Å; F331-T334 PolarHBondContact O-N 3.36Å; F331-T334 PolarHBondContact O-OG1 2.82Å; A332-T334 PolarHBondContact O-N 2.9Å; A332-T334 VanDerWaalsContact O-N 3.15Å; T334-Y336 PolarHBondContact O-N 3.3Å; T334-A337 PolarHBondContact O-N 2.99Å; T334-A338 VanDerWaalsContact O-CB 3.29Å; T334-A338 WeakPolarHBondContact O-CB 3.24Å; T334-A338 PolarHBondContact O-N 3.34Å
335H93.3Very high92.9Very high4 Ų432 Ų322%0.01917%0.174CC..Hα-helixtrans-63-22.4176.893.6-91.2000114.1S120 Y279 A283 H284 A332 M333 K339S120-H335 PolarHBondContact OG-NE2 3.36Å; Y279-H335 HydrophobicContact CD1-CB 4.04Å; Y279-H335 HydrophobicContact CE1-CB 3.99Å; A283-H335 HydrophobicContact CB-CB 4.01Å; H284-H335 AromaticContact CE1-CE1 3.66Å; H284-H335 AromaticContact CE1-NE2 3.99Å; H284-H335 AromaticContact NE2-CE1 3.62Å; H284-H335 AromaticContact NE2-NE2 3.58Å; A332-H335 PolarHBondContact O-N 2.93Å; A332-H335 VanDerWaalsContact O-N 3.16Å; A332-H335 PolarHBondContact O-ND1 2.86Å; M333-H335 PolarHBondContact O-N 3.47Å; M333-H335 VanDerWaalsContact O-N 3.11Å; H335-K339 VanDerWaalsContact O-CE 3.24Å; H335-K339 WeakPolarHBondContact O-CE 3.29Å; H335-K339 WeakPolarHBondContact O-CG 3.45Å
336Y93.5Very high92.8Very high9 Ų930.3 Ų30.34%0.03517%0.171CC..Hα-helixtrans-79.6-27.1172.2-61.7-74.1000112.3D79 F82 M333 T334D79-Y336 HydrophobicContact CB-CD1 4.41Å; D79-Y336 WeakPolarHBondContact OD1-CD1 3.3Å; F82-Y336 HydrophobicContact CB-CD1 3.95Å; F82-Y336 HydrophobicContact CB-CE1 4.06Å; F82-Y336 HydrophobicContact CB-CG 4.34Å; F82-Y336 AromaticContact CD1-CD1 3.98Å; F82-Y336 HydrophobicContact CD1-CD1 3.98Å; F82-Y336 AromaticContact CD1-CD2 3.43Å; F82-Y336 HydrophobicContact CD1-CD2 3.43Å; F82-Y336 VanDerWaalsContact CD1-CD2 3.43Å; F82-Y336 HydrophobicContact CD1-CE1 4.37Å; F82-Y336 AromaticContact CD1-CE2 3.85Å; F82-Y336 HydrophobicContact CD1-CE2 3.85Å; F82-Y336 AromaticContact CD1-CG 3.49Å; F82-Y336 HydrophobicContact CD1-CG 3.49Å; F82-Y336 VanDerWaalsContact CD1-CG 3.49Å; F82-Y336 HydrophobicContact CD2-CD1 4.44Å; F82-Y336 HydrophobicContact CD2-CD2 4.16Å; F82-Y336 HydrophobicContact CD2-CE1 4.03Å; F82-Y336 AromaticContact CD2-CE2 3.68Å; F82-Y336 HydrophobicContact CD2-CE2 3.68Å; F82-Y336 AromaticContact CD2-CZ 3.63Å; F82-Y336 AromaticContact CE1-CD2 3.32Å; F82-Y336 HydrophobicContact CE1-CD2 3.32Å; F82-Y336 AromaticContact CE1-CE2 3.67Å; F82-Y336 HydrophobicContact CE1-CE2 3.67Å; F82-Y336 AromaticContact CE1-CG 3.88Å; F82-Y336 HydrophobicContact CE1-CG 3.88Å; F82-Y336 HydrophobicContact CE2-CD2 4.06Å; F82-Y336 AromaticContact CE2-CE2 3.49Å; F82-Y336 HydrophobicContact CE2-CE2 3.49Å; F82-Y336 VanDerWaalsContact CE2-CE2 3.49Å; F82-Y336 AromaticContact CE2-CZ 3.85Å; F82-Y336 AromaticContact CG-CD1 3.85Å; F82-Y336 HydrophobicContact CG-CD1 3.85Å; F82-Y336 AromaticContact CG-CD2 3.87Å; F82-Y336 HydrophobicContact CG-CD2 3.87Å; F82-Y336 AromaticContact CG-CE1 3.88Å; F82-Y336 HydrophobicContact CG-CE1 3.88Å; F82-Y336 AromaticContact CG-CE2 3.86Å; F82-Y336 HydrophobicContact CG-CE2 3.86Å; F82-Y336 AromaticContact CG-CG 3.85Å; F82-Y336 HydrophobicContact CG-CG 3.85Å; F82-Y336 AromaticContact CG-CZ 3.88Å; F82-Y336 AromaticContact CZ-CD2 3.65Å; F82-Y336 HydrophobicContact CZ-CD2 3.65Å; F82-Y336 AromaticContact CZ-CE2 3.49Å; F82-Y336 HydrophobicContact CZ-CE2 3.49Å; F82-Y336 VanDerWaalsContact CZ-CE2 3.49Å; M333-Y336 PolarHBondContact O-N 3.12Å; M333-Y336 VanDerWaalsContact O-N 3.13Å; T334-Y336 PolarHBondContact O-N 3.3Å
337A94.8Very high92.7Very high2 Ų230.1 Ų30.12%0.01717%0.17CC..Hα-helixtrans-96.1-38.1-178.300000114.1W40 L43 F83 T334 K339W40-A337 HydrophobicContact CB-CB 4.4Å; W40-A337 HydrophobicContact CE3-CB 4Å; L43-A337 HydrophobicContact CB-CB 4.3Å; F83-A337 HydrophobicContact CZ-CB 3.95Å; T334-A337 PolarHBondContact O-N 2.99Å; A337-K339 VanDerWaalsContact C-N 3.25Å; A337-K339 PolarHBondContact O-N 3.33Å
338A93.7Very high92.5Very high15 Ų1533.4 Ų33.412%0.12418%0.181CC..THydrogen-bonded Turntrans-74.6-12.1-168.300000114Y279 T334 F340 P341 I342Y279-A338 HydrophobicContact CD1-CB 4.34Å; Y279-A338 HydrophobicContact CE1-CB 3.47Å; Y279-A338 VanDerWaalsContact CE1-CB 3.47Å; Y279-A338 WeakPolarHBondContact OH-CB 3.44Å; T334-A338 VanDerWaalsContact O-CB 3.29Å; T334-A338 WeakPolarHBondContact O-CB 3.24Å; T334-A338 PolarHBondContact O-N 3.34Å; A338-F340 VanDerWaalsContact C-N 3.3Å; A338-F340 PolarHBondContact O-N 3.28Å; A338-P341 VanDerWaalsContact O-CD 3.27Å; A338-P341 WeakPolarHBondContact O-CD 3.44Å; A338-I342 HydrophobicContact CB-CD1 4.25Å; A338-I342 WeakPolarHBondContact O-CB 3.41Å; A338-I342 WeakPolarHBondContact O-CD1 3.36Å; A338-I342 WeakPolarHBondContact O-CG1 3.38Å; A338-I342 PolarHBondContact O-N 2.73Å
339K92.2Very high92.1Very high5 Ų533.6 Ų33.62%0.02218%0.181CC..Hα-helixtrans-58.5-41.6-179.7-65.5-168.2-159.6154.50112.2D79 T276 H335 A337 I342 Y343D79-K339 IonicContact OD1-NZ 3.35Å; D79-K339 PolarHBondContact OD1-NZ 3.16Å; D79-K339 VanDerWaalsContact OD2-CD 3.25Å; D79-K339 WeakPolarHBondContact OD2-CD 3.18Å; D79-K339 WeakPolarHBondContact OD2-CE 3.42Å; D79-K339 IonicContact OD2-NZ 3.38Å; D79-K339 PolarHBondContact OD2-NZ 2.98Å; T276-K339 HydrophobicContact CG2-CD 4.05Å; T276-K339 HydrophobicContact CG2-CG 4.11Å; H335-K339 VanDerWaalsContact O-CE 3.24Å; H335-K339 WeakPolarHBondContact O-CE 3.29Å; H335-K339 WeakPolarHBondContact O-CG 3.45Å; A337-K339 VanDerWaalsContact C-N 3.25Å; A337-K339 PolarHBondContact O-N 3.33Å; K339-I342 CarbonylContact O-C 3.47Å; K339-I342 WeakPolarHBondContact O-CB 3.48Å; K339-I342 PolarHBondContact O-N 2.9Å; K339-Y343 HydrophobicContact CB-CE1 4.29Å; K339-Y343 HydrophobicContact CB-CE2 3.92Å; K339-Y343 WeakPolarHBondContact CD-OH 3.26Å; K339-Y343 VanDerWaalsContact O-CD1 3.24Å; K339-Y343 WeakPolarHBondContact O-CD1 3.45Å; K339-Y343 VanDerWaalsContact O-CD2 3.31Å; K339-Y343 WeakPolarHBondContact O-CD2 3.04Å; K339-Y343 PolarHBondContact O-N 3.29Å
340F94.1Very high92.1Very high30 Ų3030.7 Ų30.713%0.13217%0.167CC..Hα-helixtrans-63.1-52179.1173.2-105.1000113G47 F50 A338 I342 Y343 L344 F350 F354G47-F340 VanDerWaalsContact CA-CB 3.45Å; G47-F340 VanDerWaalsContact CA-CG 3.49Å; G47-F340 WeakPolarHBondContact O-CB 3.27Å; F50-F340 HydrophobicContact CB-CD2 4.01Å; F50-F340 HydrophobicContact CB-CE2 3.56Å; F50-F340 HydrophobicContact CB-CZ 4.17Å; F50-F340 HydrophobicContact CD2-CE1 4.3Å; F50-F340 HydrophobicContact CD2-CE2 4.08Å; F50-F340 AromaticContact CD2-CZ 3.8Å; F50-F340 HydrophobicContact CD2-CZ 3.8Å; F50-F340 HydrophobicContact CG-CE2 4.28Å; F50-F340 HydrophobicContact CG-CZ 4.42Å; A338-F340 VanDerWaalsContact C-N 3.3Å; A338-F340 PolarHBondContact O-N 3.28Å; F340-I342 VanDerWaalsContact C-N 3.27Å; F340-I342 PolarHBondContact O-N 3.09Å; F340-Y343 WeakPolarHBondContact O-CB 3.37Å; F340-Y343 PolarHBondContact O-N 3.34Å; F340-Y343 VanDerWaalsContact O-N 3.1Å; F340-L344 HydrophobicContact CD1-CD1 4.16Å; F340-L344 HydrophobicContact CE1-CD1 3.52Å; F340-L344 HydrophobicContact CE1-CG 4.35Å; F340-L344 HydrophobicContact CE2-CD1 4.21Å; F340-L344 HydrophobicContact CE2-CD2 4.49Å; F340-L344 HydrophobicContact CE2-CG 4.23Å; F340-L344 HydrophobicContact CZ-CD1 3.56Å; F340-L344 HydrophobicContact CZ-CD2 4.39Å; F340-L344 HydrophobicContact CZ-CG 4.07Å; F340-L344 PolarHBondContact O-N 3.41Å; F340-F350 AromaticContact CD2-CE1 3.98Å; F340-F350 HydrophobicContact CD2-CE1 3.98Å; F340-F350 AromaticContact CD2-CZ 3.87Å; F340-F350 HydrophobicContact CD2-CZ 3.87Å; F340-F350 AromaticContact CE2-CE1 3.81Å; F340-F350 HydrophobicContact CE2-CE1 3.81Å; F340-F350 AromaticContact CE2-CZ 3.95Å; F340-F350 HydrophobicContact CE2-CZ 3.95Å; F340-F354 HydrophobicContact CE2-CD2 4.14Å; F340-F354 AromaticContact CE2-CE2 3.97Å; F340-F354 HydrophobicContact CE2-CE2 3.97Å; F340-F354 HydrophobicContact CZ-CD2 4.3Å; F340-F354 AromaticContact CZ-CE2 3.77Å; F340-F354 HydrophobicContact CZ-CE2 3.77Å; F340-F354 HydrophobicContact CZ-CZ 4.07Å
341P94.1Very high92.1Very high60 Ų6034.8 Ų34.839%0.3918%0.181SC..Hα-helixtrans-53.4-42.1169.6-27.932.9000113.5A338 Y343 L344 A345A338-P341 VanDerWaalsContact O-CD 3.27Å; A338-P341 WeakPolarHBondContact O-CD 3.44Å; P341-Y343 VanDerWaalsContact C-N 3.34Å; P341-Y343 PolarHBondContact O-N 3.14Å; P341-L344 PolarHBondContact O-N 3.22Å; P341-A345 WeakPolarHBondContact O-CB 3.5Å; P341-A345 PolarHBondContact O-N 3.32Å
342I93.8Very high92Very high20 Ų2037.1 Ų37.110%0.10319%0.192CC..Hα-helixtrans-60.9-42.8176.4-70.7165.7000110.8C275 Y279 A338 K339 F340 A345 T346C275-I342 HydrophobicContact CB-CG2 4.07Å; Y279-I342 HydrophobicContact CD1-CD1 3.97Å; Y279-I342 HydrophobicContact CD2-CD1 4.49Å; Y279-I342 HydrophobicContact CE1-CD1 4.48Å; Y279-I342 HydrophobicContact CG-CD1 3.94Å; A338-I342 HydrophobicContact CB-CD1 4.25Å; A338-I342 WeakPolarHBondContact O-CB 3.41Å; A338-I342 WeakPolarHBondContact O-CD1 3.36Å; A338-I342 WeakPolarHBondContact O-CG1 3.38Å; A338-I342 PolarHBondContact O-N 2.73Å; K339-I342 CarbonylContact O-C 3.47Å; K339-I342 WeakPolarHBondContact O-CB 3.48Å; K339-I342 PolarHBondContact O-N 2.9Å; F340-I342 VanDerWaalsContact C-N 3.27Å; F340-I342 PolarHBondContact O-N 3.09Å; I342-A345 PolarHBondContact O-N 3.28Å; I342-T346 HydrophobicContact CG2-CG2 4.24Å; I342-T346 WeakPolarHBondContact O-CB 3.29Å; I342-T346 WeakPolarHBondContact O-CG2 3.42Å; I342-T346 PolarHBondContact O-N 3.36Å; I342-T346 PolarHBondContact O-OG1 3.37Å
343Y92.7Very high91.9Very high0 Ų037.2 Ų37.20%019%0.191CC..Hα-helixtrans-64.2-43177.8-60.3-21.2000111.7S51 W55 Q72 T272 T276 K339 F340 P341 A345 S347 F350S51-Y343 WeakPolarHBondContact OG-CD2 3.34Å; W55-Y343 HydrophobicContact CZ2-CD1 4.45Å; W55-Y343 HydrophobicContact CZ2-CG 4.42Å; W55-Y343 AromaticContact NE1-CD2 3.35Å; W55-Y343 AromaticContact NE1-CE2 3.4Å; W55-Y343 AromaticContact NE1-CG 3.9Å; W55-Y343 AromaticContact NE1-CZ 3.97Å; Q72-Y343 PolarHBondContact OE1-OH 2.88Å; T272-Y343 HydrophobicContact CG2-CD1 3.46Å; T272-Y343 VanDerWaalsContact CG2-CD1 3.46Å; T272-Y343 HydrophobicContact CG2-CE1 3.95Å; T272-Y343 HydrophobicContact CG2-CG 4.49Å; T276-Y343 HydrophobicContact CG2-CE1 4.34Å; T276-Y343 WeakPolarHBondContact OG1-CE1 3.39Å; K339-Y343 HydrophobicContact CB-CE1 4.29Å; K339-Y343 HydrophobicContact CB-CE2 3.92Å; K339-Y343 WeakPolarHBondContact CD-OH 3.26Å; K339-Y343 VanDerWaalsContact O-CD1 3.24Å; K339-Y343 WeakPolarHBondContact O-CD1 3.45Å; K339-Y343 VanDerWaalsContact O-CD2 3.31Å; K339-Y343 WeakPolarHBondContact O-CD2 3.04Å; K339-Y343 PolarHBondContact O-N 3.29Å; F340-Y343 WeakPolarHBondContact O-CB 3.37Å; F340-Y343 PolarHBondContact O-N 3.34Å; F340-Y343 VanDerWaalsContact O-N 3.1Å; P341-Y343 VanDerWaalsContact C-N 3.34Å; P341-Y343 PolarHBondContact O-N 3.14Å; Y343-A345 PolarHBondContact O-N 3.35Å; Y343-S347 WeakPolarHBondContact O-CB 3.27Å; Y343-S347 PolarHBondContact O-N 3.14Å; Y343-F350 AromaticContact CD2-CE2 3.97Å; Y343-F350 HydrophobicContact CD2-CE2 3.97Å; Y343-F350 HydrophobicContact CD2-CZ 4.11Å; Y343-F350 HydrophobicContact CG-CE2 4.38Å
344L92.7Very high91.9Very high49 Ų4937.4 Ų37.426%0.25719%0.191SC..Hα-helixtrans-61.6-42.1173.8-71.5176000111.7F340 P341 F350 R351 F354F340-L344 HydrophobicContact CD1-CD1 4.16Å; F340-L344 HydrophobicContact CE1-CD1 3.52Å; F340-L344 HydrophobicContact CE1-CG 4.35Å; F340-L344 HydrophobicContact CE2-CD1 4.21Å; F340-L344 HydrophobicContact CE2-CD2 4.49Å; F340-L344 HydrophobicContact CE2-CG 4.23Å; F340-L344 HydrophobicContact CZ-CD1 3.56Å; F340-L344 HydrophobicContact CZ-CD2 4.39Å; F340-L344 HydrophobicContact CZ-CG 4.07Å; F340-L344 PolarHBondContact O-N 3.41Å; P341-L344 PolarHBondContact O-N 3.22Å; L344-F350 HydrophobicContact CD2-CD1 3.98Å; L344-F350 HydrophobicContact CD2-CE1 3.89Å; L344-F350 HydrophobicContact CG-CD1 4.45Å; L344-F350 HydrophobicContact CG-CE1 4.16Å; L344-R351 HydrophobicContact CD2-CG 4.1Å; L344-R351 WeakPolarHBondContact O-CD 3.31Å; L344-R351 WeakPolarHBondContact O-CG 3.34Å; L344-R351 PolarHBondContact O-NH1 3.47Å; L344-F354 HydrophobicContact CD2-CD1 4.32Å; L344-F354 HydrophobicContact CD2-CG 4.37Å
345A92.1Very high91.9Very high73 Ų7339.4 Ų39.460%0.60320%0.204SC*.Hα-helixtrans-69.3-44.6-179.300000112.5P341 I342 Y343 R351P341-A345 WeakPolarHBondContact O-CB 3.5Å; P341-A345 PolarHBondContact O-N 3.32Å; I342-A345 PolarHBondContact O-N 3.28Å; Y343-A345 PolarHBondContact O-N 3.35Å; A345-R351 PolarHBondContact O-NH1 3.39Å
346T90Very high91.8Very high24 Ų2444.7 Ų44.715%0.14722%0.224CC..Hα-helixtrans-96.6-28.9-165.960.50000114.7S268 T272 C275 I342S268-T346 PolarHBondContact OG-O 2.69Å; T272-T346 WeakPolarHBondContact CA-OG1 3.27Å; T272-T346 VanDerWaalsContact CB-OG1 3.3Å; T272-T346 WeakPolarHBondContact CB-OG1 3.48Å; T272-T346 WeakPolarHBondContact CG2-OG1 3.32Å; T272-T346 WeakPolarHBondContact OG1-CB 3.12Å; T272-T346 PolarHBondContact OG1-OG1 3.25Å; C275-T346 HydrophobicContact CB-CG2 3.94Å; I342-T346 HydrophobicContact CG2-CG2 4.24Å; I342-T346 WeakPolarHBondContact O-CB 3.29Å; I342-T346 WeakPolarHBondContact O-CG2 3.42Å; I342-T346 PolarHBondContact O-N 3.36Å; I342-T346 PolarHBondContact O-OG1 3.37Å
347S88.5Confident91.6Very high2 Ų246.5 Ų46.51%0.01423%0.234CC..  trans-106.8107.1-174.7-179.20000112.1T272 Y343 Q349 F350 R351T272-S347 WeakPolarHBondContact OG1-CB 3.01Å; T272-S347 PolarHBondContact OG1-N 3.33Å; Y343-S347 WeakPolarHBondContact O-CB 3.27Å; Y343-S347 PolarHBondContact O-N 3.14Å; S347-Q349 VanDerWaalsContact C-N 3.26Å; S347-Q349 PolarHBondContact O-N 3.2Å; S347-F350 VanDerWaalsContact CB-CB 3.46Å; S347-F350 PolarHBondContact O-N 3.24Å; S347-F350 VanDerWaalsContact OG-CB 3.27Å; S347-F350 WeakPolarHBondContact OG-CB 3.36Å; S347-F350 PolarHBondContact OG-N 3.27Å; S347-R351 PolarHBondContact O-N 3.3Å; S347-R351 VanDerWaalsContact O-N 3.1Å
348K87.6Confident91.3Very high153 Ų15349.2 Ų49.267%0.66525%0.245SC*.Hα-helixtrans-61.7-38.1173.4-69.5-171.1178-1700112S268 H352S268-K348 PolarHBondContact OG-N 3.16Å; K348-H352 PolarHBondContact O-N 3.16Å
349Q86.9Confident90.7Very high48 Ų4854.2 Ų54.222%0.22427%0.266CS..Hα-helixtrans-66.2-43.6179.8-154.2-163.9-26.500109.9P59 M60 S347 H352 E353P59-Q349 PolarHBondContact O-NE2 3.13Å; M60-Q349 HydrophobicContact CE-CB 3.68Å; M60-Q349 VanDerWaalsContact CE-CD 3.5Å; M60-Q349 HydrophobicContact CE-CG 3.31Å; M60-Q349 WeakPolarHBondContact CE-O 3.49Å; M60-Q349 HydrophobicContact SD-CG 4.29Å; S347-Q349 VanDerWaalsContact C-N 3.26Å; S347-Q349 PolarHBondContact O-N 3.2Å; Q349-H352 PolarHBondContact O-N 2.96Å; Q349-E353 PolarHBondContact O-N 3.31Å
350F90.3Very high89.2Confident0 Ų058.6 Ų58.60%030%0.296CS..Hα-helixtrans-60.8-47.2177.9-175.1-87.9000111V54 W55 F340 Y343 L344 S347 H352 E353 F354V54-F350 HydrophobicContact CB-CD2 4.02Å; V54-F350 HydrophobicContact CB-CE2 3.55Å; V54-F350 HydrophobicContact CB-CZ 3.99Å; V54-F350 HydrophobicContact CG1-CD2 3.36Å; V54-F350 HydrophobicContact CG1-CE2 3.45Å; V54-F350 VanDerWaalsContact CG1-CE2 3.45Å; V54-F350 HydrophobicContact CG1-CG 3.93Å; V54-F350 HydrophobicContact CG1-CZ 4.09Å; V54-F350 HydrophobicContact CG2-CE2 4.26Å; V54-F350 HydrophobicContact CG2-CZ 4.2Å; W55-F350 AromaticContact CD1-CE2 3.77Å; W55-F350 HydrophobicContact CD2-CD2 4.21Å; W55-F350 HydrophobicContact CD2-CE2 4.5Å; W55-F350 AromaticContact CE2-CD2 3.63Å; W55-F350 AromaticContact CE2-CE2 3.97Å; W55-F350 HydrophobicContact CG-CE2 4.38Å; W55-F350 AromaticContact CZ2-CD2 3.9Å; W55-F350 HydrophobicContact CZ2-CD2 3.9Å; W55-F350 AromaticContact NE1-CD2 3.62Å; W55-F350 AromaticContact NE1-CE2 3.46Å; F340-F350 AromaticContact CD2-CE1 3.98Å; F340-F350 HydrophobicContact CD2-CE1 3.98Å; F340-F350 AromaticContact CD2-CZ 3.87Å; F340-F350 HydrophobicContact CD2-CZ 3.87Å; F340-F350 AromaticContact CE2-CE1 3.81Å; F340-F350 HydrophobicContact CE2-CE1 3.81Å; F340-F350 AromaticContact CE2-CZ 3.95Å; F340-F350 HydrophobicContact CE2-CZ 3.95Å; Y343-F350 AromaticContact CD2-CE2 3.97Å; Y343-F350 HydrophobicContact CD2-CE2 3.97Å; Y343-F350 HydrophobicContact CD2-CZ 4.11Å; Y343-F350 HydrophobicContact CG-CE2 4.38Å; L344-F350 HydrophobicContact CD2-CD1 3.98Å; L344-F350 HydrophobicContact CD2-CE1 3.89Å; L344-F350 HydrophobicContact CG-CD1 4.45Å; L344-F350 HydrophobicContact CG-CE1 4.16Å; S347-F350 VanDerWaalsContact CB-CB 3.46Å; S347-F350 PolarHBondContact O-N 3.24Å; S347-F350 VanDerWaalsContact OG-CB 3.27Å; S347-F350 WeakPolarHBondContact OG-CB 3.36Å; S347-F350 PolarHBondContact OG-N 3.27Å; F350-H352 VanDerWaalsContact C-N 3.33Å; F350-H352 PolarHBondContact O-N 3.47Å; F350-E353 PolarHBondContact O-N 2.9Å; F350-F354 VanDerWaalsContact O-CB 3.29Å; F350-F354 WeakPolarHBondContact O-CB 3.2Å; F350-F354 PolarHBondContact O-N 2.88Å
351R92.5Very high87.1Confident99 Ų9962.2 Ų62.237%0.37432%0.324SS..Hα-helixtrans-57.4-44.9175-72-163.2-67-115.613112.6L344 A345 S347 F354 C355L344-R351 HydrophobicContact CD2-CG 4.1Å; L344-R351 WeakPolarHBondContact O-CD 3.31Å; L344-R351 WeakPolarHBondContact O-CG 3.34Å; L344-R351 PolarHBondContact O-NH1 3.47Å; A345-R351 PolarHBondContact O-NH1 3.39Å; S347-R351 PolarHBondContact O-N 3.3Å; S347-R351 VanDerWaalsContact O-N 3.1Å; R351-F354 PolarHBondContact O-N 3.32Å; R351-C355 WeakPolarHBondContact O-CB 3.34Å; R351-C355 PolarHBondContact O-N 3.31Å; R351-C355 PolarHBondContact O-SG 3.43Å; R351-C355 VanDerWaalsContact O-SG 3.34Å
352H90.2Very high84.7Confident131 Ų13165 Ų6561%0.60634%0.344SS*.Hα-helixtrans-64.3-43.8-179.3-172.272.2000111.7K348 Q349 F350 C355 R356K348-H352 PolarHBondContact O-N 3.16Å; Q349-H352 PolarHBondContact O-N 2.96Å; F350-H352 VanDerWaalsContact C-N 3.33Å; F350-H352 PolarHBondContact O-N 3.47Å; H352-C355 PolarHBondContact O-N 3.21Å; H352-R356 VanDerWaalsContact O-CB 3.29Å; H352-R356 WeakPolarHBondContact O-CB 3.42Å; H352-R356 PolarHBondContact O-N 3.04Å
353E90.6Very high82.5Confident14 Ų1472.5 Ų72.57%0.06537%0.371CS..Hα-helixtrans-67.9-39.1176.1-73.7-56.4137.100112.8V54 P59 M60 Q349 F350 R356 I357V54-E353 HydrophobicContact CG1-CB 3.87Å; P59-E353 HydrophobicContact CB-CG 4.34Å; P59-E353 VanDerWaalsContact CB-OE1 3.22Å; P59-E353 WeakPolarHBondContact CB-OE1 3.49Å; M60-E353 HydrophobicContact CE-CB 3.81Å; M60-E353 HydrophobicContact CE-CG 3.21Å; M60-E353 HydrophobicContact CG-CG 4.36Å; Q349-E353 PolarHBondContact O-N 3.31Å; F350-E353 PolarHBondContact O-N 2.9Å; E353-R356 PolarHBondContact O-N 3.39Å; E353-R356 IonicContact OE1-NE 3.36Å; E353-R356 PolarHBondContact OE1-NE 3.41Å; E353-R356 IonicContact OE2-CZ 3.12Å; E353-R356 IonicContact OE2-NE 2.8Å; E353-R356 PolarHBondContact OE2-NE 3.03Å; E353-R356 IonicContact OE2-NH2 2.67Å; E353-R356 PolarHBondContact OE2-NH2 3.48Å; E353-I357 WeakPolarHBondContact O-CB 3.34Å; E353-I357 VanDerWaalsContact O-CG1 3.24Å; E353-I357 WeakPolarHBondContact O-CG1 3.41Å; E353-I357 PolarHBondContact O-N 3.39Å
354F93.1Very high80Confident45 Ų4580.1 Ų80.120%0.19741%0.412CS..Hα-helixtrans-58.6-51.4173.3-179-95.3000110.6F50 V54 F340 L344 F350 R351 R356 I357 F358F50-F354 HydrophobicContact CB-CE2 4.1Å; F50-F354 HydrophobicContact CD1-CE2 4.36Å; F50-F354 AromaticContact CD2-CE2 3.99Å; F50-F354 HydrophobicContact CD2-CE2 3.99Å; F50-F354 AromaticContact CG-CE2 3.91Å; F50-F354 HydrophobicContact CG-CE2 3.91Å; V54-F354 HydrophobicContact CG2-CB 4.13Å; V54-F354 HydrophobicContact CG2-CD2 4.04Å; F340-F354 HydrophobicContact CE2-CD2 4.14Å; F340-F354 AromaticContact CE2-CE2 3.97Å; F340-F354 HydrophobicContact CE2-CE2 3.97Å; F340-F354 HydrophobicContact CZ-CD2 4.3Å; F340-F354 AromaticContact CZ-CE2 3.77Å; F340-F354 HydrophobicContact CZ-CE2 3.77Å; F340-F354 HydrophobicContact CZ-CZ 4.07Å; L344-F354 HydrophobicContact CD2-CD1 4.32Å; L344-F354 HydrophobicContact CD2-CG 4.37Å; F350-F354 VanDerWaalsContact O-CB 3.29Å; F350-F354 WeakPolarHBondContact O-CB 3.2Å; F350-F354 PolarHBondContact O-N 2.88Å; R351-F354 PolarHBondContact O-N 3.32Å; F354-R356 VanDerWaalsContact C-N 3.34Å; F354-R356 PolarHBondContact O-N 2.98Å; F354-I357 PolarHBondContact O-N 3.28Å; F354-F358 HydrophobicContact CD1-CD2 4.46Å; F354-F358 AromaticContact CD2-CD2 3.56Å; F354-F358 HydrophobicContact CD2-CD2 3.56Å; F354-F358 AromaticContact CD2-CE2 3.65Å; F354-F358 HydrophobicContact CD2-CE2 3.65Å; F354-F358 HydrophobicContact CE1-CD2 4.38Å; F354-F358 AromaticContact CE2-CD2 3.45Å; F354-F358 HydrophobicContact CE2-CD2 3.45Å; F354-F358 VanDerWaalsContact CE2-CD2 3.45Å; F354-F358 AromaticContact CE2-CE2 3.52Å; F354-F358 HydrophobicContact CE2-CE2 3.52Å; F354-F358 HydrophobicContact CE2-CG 4.39Å; F354-F358 HydrophobicContact CE2-CZ 4.49Å; F354-F358 HydrophobicContact CG-CD2 4.08Å; F354-F358 AromaticContact CZ-CD2 3.89Å; F354-F358 HydrophobicContact CZ-CD2 3.89Å; F354-F358 HydrophobicContact CZ-CE2 4.34Å; F354-F358 HydrophobicContact CZ-CG 4.46Å; F354-F358 VanDerWaalsContact O-CD2 3.3Å; F354-F358 WeakPolarHBondContact O-CD2 3.49Å; F354-F358 PolarHBondContact O-N 2.93Å
355C93Very high77.3Confident44 Ų4484.6 Ų84.630%0.29743%0.431SS..Hα-helixtrans-60-42.8174.6-70.90000111.8R351 H352 I357 F358 Q359R351-C355 WeakPolarHBondContact O-CB 3.34Å; R351-C355 PolarHBondContact O-N 3.31Å; R351-C355 PolarHBondContact O-SG 3.43Å; R351-C355 VanDerWaalsContact O-SG 3.34Å; H352-C355 PolarHBondContact O-N 3.21Å; C355-I357 VanDerWaalsContact C-N 3.33Å; C355-I357 PolarHBondContact O-N 2.95Å; C355-F358 PolarHBondContact O-N 3.22Å; C355-Q359 HydrophobicContact CB-CG 4.15Å; C355-Q359 WeakPolarHBondContact O-CA 3.48Å; C355-Q359 WeakPolarHBondContact O-CB 3.3Å; C355-Q359 WeakPolarHBondContact O-CG 3.46Å; C355-Q359 PolarHBondContact O-N 3.28Å
356R91Very high75.1Confident116 Ų11685.7 Ų85.744%0.43844%0.435SS..Hα-helixtrans-60.7-42.3179-171.6178.773.49613112.2H352 E353 F354 C360H352-R356 VanDerWaalsContact O-CB 3.29Å; H352-R356 WeakPolarHBondContact O-CB 3.42Å; H352-R356 PolarHBondContact O-N 3.04Å; E353-R356 PolarHBondContact O-N 3.39Å; E353-R356 IonicContact OE1-NE 3.36Å; E353-R356 PolarHBondContact OE1-NE 3.41Å; E353-R356 IonicContact OE2-CZ 3.12Å; E353-R356 IonicContact OE2-NE 2.8Å; E353-R356 PolarHBondContact OE2-NE 3.03Å; E353-R356 IonicContact OE2-NH2 2.67Å; E353-R356 PolarHBondContact OE2-NH2 3.48Å; F354-R356 VanDerWaalsContact C-N 3.34Å; F354-R356 PolarHBondContact O-N 2.98Å; R356-C360 PolarHBondContact O-SG 3.46Å
357I90.5Very high72.9Confident47 Ų4794.1 Ų94.124%0.24147%0.465CS..Hα-helixtrans-71.2-46.6-179.5-67.4166.9000110.5I53 V54 E353 F354 C355I53-I357 HydrophobicContact CG2-CD1 4.24Å; I53-I357 HydrophobicContact CG2-CG2 4.49Å; V54-I357 HydrophobicContact CG2-CD1 4.29Å; E353-I357 WeakPolarHBondContact O-CB 3.34Å; E353-I357 VanDerWaalsContact O-CG1 3.24Å; E353-I357 WeakPolarHBondContact O-CG1 3.41Å; E353-I357 PolarHBondContact O-N 3.39Å; F354-I357 PolarHBondContact O-N 3.28Å; C355-I357 VanDerWaalsContact C-N 3.33Å; C355-I357 PolarHBondContact O-N 2.95Å
358F88.4Confident70.6Confident58 Ų58101.6 Ų101.625%0.25450%0.504SS..Hα-helixtrans-93.9-23.8-171.2-67.8-75.2000114.7F50 F354 C355 C361F50-F358 HydrophobicContact CD1-CE1 4.11Å; F50-F358 AromaticContact CD1-CE2 3.81Å; F50-F358 HydrophobicContact CD1-CE2 3.81Å; F50-F358 AromaticContact CD1-CZ 3.33Å; F50-F358 HydrophobicContact CD1-CZ 3.33Å; F50-F358 AromaticContact CE1-CE1 3.68Å; F50-F358 HydrophobicContact CE1-CE1 3.68Å; F50-F358 HydrophobicContact CE1-CE2 4.15Å; F50-F358 AromaticContact CE1-CZ 3.4Å; F50-F358 HydrophobicContact CE1-CZ 3.4Å; F50-F358 VanDerWaalsContact CE1-CZ 3.4Å; F50-F358 HydrophobicContact CG-CE2 4.46Å; F50-F358 HydrophobicContact CG-CZ 4.37Å; F50-F358 HydrophobicContact CZ-CZ 4.48Å; F354-F358 HydrophobicContact CD1-CD2 4.46Å; F354-F358 AromaticContact CD2-CD2 3.56Å; F354-F358 HydrophobicContact CD2-CD2 3.56Å; F354-F358 AromaticContact CD2-CE2 3.65Å; F354-F358 HydrophobicContact CD2-CE2 3.65Å; F354-F358 HydrophobicContact CE1-CD2 4.38Å; F354-F358 AromaticContact CE2-CD2 3.45Å; F354-F358 HydrophobicContact CE2-CD2 3.45Å; F354-F358 VanDerWaalsContact CE2-CD2 3.45Å; F354-F358 AromaticContact CE2-CE2 3.52Å; F354-F358 HydrophobicContact CE2-CE2 3.52Å; F354-F358 HydrophobicContact CE2-CG 4.39Å; F354-F358 HydrophobicContact CE2-CZ 4.49Å; F354-F358 HydrophobicContact CG-CD2 4.08Å; F354-F358 AromaticContact CZ-CD2 3.89Å; F354-F358 HydrophobicContact CZ-CD2 3.89Å; F354-F358 HydrophobicContact CZ-CE2 4.34Å; F354-F358 HydrophobicContact CZ-CG 4.46Å; F354-F358 VanDerWaalsContact O-CD2 3.3Å; F354-F358 WeakPolarHBondContact O-CD2 3.49Å; F354-F358 PolarHBondContact O-N 2.93Å; C355-F358 PolarHBondContact O-N 3.22Å; F358-C361 WeakPolarHBondContact O-CB 3.34Å; F358-C361 PolarHBondContact O-N 2.77Å
359Q81.5Confident68.3Low121 Ų121100.3 Ų100.357%0.56551%0.514SS*.Hα-helixtrans-76.7-24172.8-63.5177.4-17.300112.2C355 C361 C362 R363C355-Q359 HydrophobicContact CB-CG 4.15Å; C355-Q359 WeakPolarHBondContact O-CA 3.48Å; C355-Q359 WeakPolarHBondContact O-CB 3.3Å; C355-Q359 WeakPolarHBondContact O-CG 3.46Å; C355-Q359 PolarHBondContact O-N 3.28Å; Q359-C361 PolarHBondContact O-N 3.08Å; Q359-C362 PolarHBondContact O-N 3.33Å; Q359-R363 WeakPolarHBondContact O-CB 3.48Å; Q359-R363 PolarHBondContact O-N 2.95Å
360C59Low66Low96 Ų96108.6 Ų108.665%0.64954%0.543SS*.Hα-helixtrans-64.3-25.8167.9-83.40000112.4R356R356-C360 PolarHBondContact O-SG 3.46Å
361C50.8Low63.8Low106 Ų106115.8 Ų115.872%0.71658%0.582SS**Hα-helixtrans-75.3-24174.9-64.80000113.5F358 Q359F358-C361 WeakPolarHBondContact O-CB 3.34Å; F358-C361 PolarHBondContact O-N 2.77Å; Q359-C361 PolarHBondContact O-N 3.08Å
362C44.1Very low61.3Low120 Ų120116.8 Ų116.881%0.81160%0.599SS**Hα-helixtrans-105.1-13.5179.8-60.90000114Q359Q359-C362 PolarHBondContact O-N 3.33Å
363R47.7Very low58.7Low177 Ų177118.5 Ų118.567%0.66861%0.613SS**  trans-109.271.4-179.9-163.1172.4164.6179.4-4111Q359 Q365Q359-R363 WeakPolarHBondContact O-CB 3.48Å; Q359-R363 PolarHBondContact O-N 2.95Å; R363-Q365 PolarHBondContact O-N 3.32Å
364N40.5Very low56.2Low160 Ų160122.5 Ų122.586%0.85665%0.648SS**  trans-60.287.8146.5-96.5-14.2000108
365Q35.9Very low53.4Low143 Ų143128.2 Ų128.267%0.66868%0.681SS**  trans-172.787.8152.9-110.1161.5-7.400110.8R363 Y367R363-Q365 PolarHBondContact O-N 3.32Å; Q365-Y367 PolarHBondContact O-N 2.99Å
366S45.4Very low50.7Low96 Ų96134 Ų13467%0.67171%0.706SS**  42.466.5123.760.40000117.8
367Y44.5Very low47.9Very low201 Ų201135 Ų13579%0.78872%0.72SS**SBendtrans-148.36.6157.1-83.9-66.6000116.8Q365Q365-Y367 PolarHBondContact O-N 2.99Å
368L39.7Very low45.3Very low159 Ų159142.3 Ų142.383%0.83275%0.752SS**SBendtrans-136.630.3178.3-122.1106.6000116R370L368-R370 VanDerWaalsContact C-N 3.32Å
369S38.9Very low42.6Very low125 Ų125144.1 Ų144.187%0.87477%0.772SS**SBendtrans-95.327.7158.8-66.30000112.2
370R39.5Very low40.2Very low222 Ų222144.5 Ų144.584%0.83878%0.783SS**SBendtrans-107.3-10.3179.8-162.4165.5161.6146.1-0.8116L368L368-R370 VanDerWaalsContact C-N 3.32Å
371D43.3Very low38.9Very low152 Ų152147.7 Ų147.781%0.81379%0.788SS**SBendtrans-119.730.1-178-74.2-16000114.8
372T39.4Very low38Very low120 Ų120150.9 Ų150.974%0.73680%0.797SS**SBendtrans-135.911.9172.6-4.60000117.6
373D35.3Very low37.6Very low167 Ų167153.5 Ų153.589%0.89380%0.798SS**SBendtrans-131.952.1173.4-73.8-39.4000112.3
374A38.1Very low36.8Very low97 Ų97153.3 Ų153.380%0.80281%0.81SS**SBendtrans-141.552.1164.700000110.1
375D35.7Very low36.3Very low165 Ų165149 Ų14988%0.88280%0.803SS**SBendtrans-15756.2166-117.2-7.2000110.5
376M35.7Very low36.2Very low167 Ų167151.9 Ų151.982%0.82381%0.814SS**SBendtrans-147.7130.8149.2-85.6-142.777.200109.3
377D32.8Very low35.4Very low137 Ų137159 Ų15973%0.73383%0.826SS**  trans76.381.6167.3-58-16.3000119
378Q35Very low35Very low199 Ų199153.9 Ų153.993%0.9382%0.819SS**  -157.594.1120.4-114.317221.100112.2
379S31.6Very low34.7Very low96 Ų96152.2 Ų152.267%0.67182%0.816SS**  trans-67.4150150.651.40000110.5
380T31.7Very low34.3Very low130 Ų130156.5 Ų156.580%0.79881%0.814SS**  trans70.893.416464.70000118.8
381H32.1Very low33.9Very low163 Ų163154 Ų15476%0.75582%0.815SS**  -162.8116117.1-147.8-94.3000111.1Q383H381-Q383 PolarHBondContact O-N 3.32Å
382L31.6Very low33.4Very low173 Ų173152.4 Ų152.491%0.90682%0.815SS**  trans-65.2119.5163-86.7136.7000108.3
383Q34.8Very low32.9Very low175 Ų175153.8 Ų153.882%0.81882%0.818SS**  trans-144.8118.9153-123.3177.2700111.8H381H381-Q383 PolarHBondContact O-N 3.32Å
384N31.3Very low32.5Very low172 Ų172150.6 Ų150.692%0.9281%0.809SS**  trans-46.8141.8161.7-88.8-32.9000112.1
385G30.5Very low32.1Very low70 Ų70154.2 Ų154.272%0.72281%0.806SS**  trans122.6129.7139.400000116.4
386K33.4Very low32Very low204 Ų204154.3 Ų154.389%0.88780%0.801SS**  trans85.784.2159-60.8-178.6179.8177.60117.6
387R29.4Very low31.7Very low245 Ų245150.7 Ų150.793%0.92579%0.793SS**  26.998.8113-150.4179.8-161.5-177.74.4114.9
388S35.1Very low31.6Very low93 Ų93151.4 Ų151.465%0.6580%0.795SS**  trans-119.3108.3157.2-179.70000108.9Y390S388-Y390 PolarHBondContact O-N 3.44Å
389T32.7Very low31.3Very low124 Ų124148.4 Ų148.476%0.76179%0.786SS**  trans-70.3102.9168.411.10000108.7
390Y31.8Very low31.4Very low215 Ų215150.3 Ų150.384%0.84379%0.793SS**  trans-93.5103.7162.5-101.4-89.8000109S388S388-Y390 PolarHBondContact O-N 3.44Å
391M29.9Very low31.2Very low171 Ų171150.3 Ų150.384%0.84279%0.793SS**  trans-70.8123.1163-68.6-169.27700108.5
392S33.9Very low30.9Very low117 Ų117147.3 Ų147.382%0.81879%0.789SS**  trans-123.6105.5163.2-170.90000108.7
393N28.1Very low30.9Very low150 Ų150147.5 Ų147.580%0.80278%0.783SS**  trans-52.5126.1164-86.7-22.7000110.3
394S28.3Very low30.6Very low100 Ų100144.8 Ų144.870%0.69978%0.779SS**  -170.9139.2125.7710000111.9
395K28.4Very low30.4Very low172 Ų172141.5 Ų141.575%0.74877%0.769SS**  trans105.4133.5149.8-62.5-178.5-179-179.80119.2
396H33.7Very low30.6Very low167 Ų167148.3 Ų148.377%0.77378%0.779SS**  trans78.6142.8158-61-56.2000116.8
397S30Very low30.5Very low92 Ų92144.2 Ų144.264%0.64377%0.771SS**  cis-179.3134.5-23.449.30000104
398L30.9Very low30.3Very low151 Ų151141.6 Ų141.679%0.79177%0.769SS**  trans38.9107.2148.4-77.7142.5000119.7
399N27.8Very low30.4Very low137 Ų137147.1 Ų147.173%0.73378%0.782SS**  40.2111.7120.1-65.9-6.9000119.6
400T33.4Very low30.1Very low135 Ų135150.5 Ų150.583%0.82879%0.786SS**  178.5101.412016.70000107.1
401V28.6Very low30.3Very low130 Ų130147.9 Ų147.979%0.78879%0.786SS**  57.4114.589.7-178.70000114.4
402C25.2Very low30.1Very low101 Ų101149.8 Ų149.868%0.68278%0.784SS**  trans101.8123.1146.3-1060000120.9
403K31Very low29.8Very low176 Ų176150.4 Ų150.477%0.76578%0.778SS**  trans8690.3140.5-74.1171.6-178.1-176.30116.6
404T29.8Very low30Very low119 Ų119149.5 Ų149.573%0.7378%0.783SS**  85.5104.28650.90000113.1
405S27.2Very low29.9Very low103 Ų103149.4 Ų149.472%0.7279%0.788SS**  trans44.6105.1133.460.50000118.2
406F32.9Very low30Very low212 Ų212147.9 Ų147.993%0.9379%0.793SS**  trans-127.8135139.2-116.8-90.4000110.1
407T31.9Very low29.8Very low118 Ų118145.6 Ų145.672%0.72480%0.796SS**  trans-81.1152-166.332.20000113.1
408Q26.6Very low29.6Very low190 Ų190151.2 Ų151.289%0.88881%0.809SS**  trans9.5122.8150.8-71.9-174-27.600118.3
409K35.6Very low29.6Very low209 Ų209149.7 Ų149.791%0.90981%0.811SS**  trans-148.9134130-128.3172.6-175.6176.10112.8
410K26.2Very low29.9Very low195 Ų195148.4 Ų148.485%0.84881%0.813SS**  trans-96125.3-173.7173.5-174.8-178-179.60108.6
411L37.2Very low29.8Very low160 Ų160148.4 Ų148.484%0.83881%0.813SS**  trans-163.695.4164-101.1135.9000105
412R25.5Very low29.8Very low212 Ų212149.6 Ų149.680%0.882%0.815SS**  58.8114.672.9-162.8170-171.6-168.45.4113.3
413N26.9Very low30.2Very low130 Ų130153.3 Ų153.370%0.69582%0.822SS**  trans80.8104.9160.5-62.7-6000118.7
414S32.6Very low30.3Very low130 Ų130152.2 Ų152.291%0.90982%0.824SS**  -161.4108.1116.7-780000108.7
415A27.4Very low30.6Very low98 Ų98154.9 Ų154.981%0.8183%0.833SS**  trans-99.1114.4172.900000107.9
416V30.3Very low31.1Very low141 Ų141157.2 Ų157.286%0.85584%0.837SS**  trans-156.799.4146.4-176.70000106.5
417S28.8Very low31.4Very low119 Ų119152.8 Ų152.883%0.83283%0.83SS**  trans-136.7104.5162.7510000109.2S419S417-S419 PolarHBondContact O-N 3Å
418F26.5Very low31.7Very low210 Ų210153.9 Ų153.992%0.92184%0.836SS**  trans-63.1119.1161.9-120.5-104.1000107.5
419S31.1Very low32.4Very low119 Ų119154.4 Ų154.483%0.83284%0.836SS**  trans-117.8118164.371.10000109.7S417S417-S419 PolarHBondContact O-N 3Å
420S33.9Very low32.5Very low110 Ų110152.4 Ų152.477%0.76983%0.833SS**  trans-73.9147.2-178.850.90000112
421T31.1Very low33Very low134 Ų134154.7 Ų154.782%0.82284%0.837SS**  trans-42.1134.2173.3290000116.3E423T421-E423 PolarHBondContact O-N 3.31Å
422N28.7Very low32.9Very low155 Ų155158.4 Ų158.483%0.82984%0.839SS**  trans-53.5121.1160.2-93.3-32.2000111.3
423E32.4Very low33.9Very low180 Ų180159.9 Ų159.984%0.84185%0.845SS**  trans-118.2124.4153.5-77.6-154.5152.600110.4T421 L425T421-E423 PolarHBondContact O-N 3.31Å; E423-L425 PolarHBondContact O-N 2.98Å
424N32.9Very low34.5Very low152 Ų152159.4 Ų159.481%0.81385%0.849SS**  trans-69.9109.7-178.1-66.9-46.6000110.5L426N424-L426 PolarHBondContact O-N 3.47Å
425L36.9Very low35.1Very low175 Ų175158.6 Ų158.692%0.91684%0.843SS**  trans-83.4106.6172.3-87.5155000110.8E423E423-L425 PolarHBondContact O-N 2.98Å
426L38.1Very low35.6Very low153 Ų153160.3 Ų160.380%0.80185%0.846SS**PPolyproline II helixtrans-59.2151.2167.7-85.3147.9000112.3N424 T428N424-L426 PolarHBondContact O-N 3.47Å; L426-T428 PolarHBondContact O-N 2.98Å
427P38.7Very low35.9Very low119 Ų119157 Ų15777%0.77384%0.841SS**PPolyproline II helixtrans-77.5119.6-167.829.8-32.3000112.6K429P427-K429 PolarHBondContact O-N 3.2Å
428T38.4Very low36.5Very low141 Ų141159.3 Ų159.387%0.86584%0.843SS**PPolyproline II helixtrans-68.5119.4177.432.60000112.9L426L426-T428 PolarHBondContact O-N 2.98Å
429K40.3Very low37.6Very low200 Ų200153.4 Ų153.487%0.8783%0.827SS**PPolyproline II helixtrans-55.8145167.8-75.3177.8176.5175.70112.3P427 R431P427-K429 PolarHBondContact O-N 3.2Å; K429-R431 PolarHBondContact O-N 3.49Å
430I38.3Very low38.9Very low167 Ų167158.1 Ų158.186%0.85683%0.827SS**  trans-44.9121.2-179-66.3161.2000112.6R432I430-R432 PolarHBondContact O-N 3.2Å
431R35.9Very low40.7Very low244 Ų244155.4 Ų155.492%0.92181%0.806SS**  trans-60.9110.3176.9-89.6179.6174.5164.50.6111.7K429K429-R431 PolarHBondContact O-N 3.49Å
432R36.7Very low42.7Very low237 Ų237153 Ų15389%0.89479%0.791SS**PPolyproline II helixtrans-86.4134.1156.5-75.4-172.8176.4-173.20.4109.6I430I430-R432 PolarHBondContact O-N 3.2Å
433R46.7Very low44.8Very low243 Ų243150.9 Ų150.992%0.91778%0.779SS**PPolyproline II helixtrans-72.6124.3179.2-156.8179.9-164.8-172.44.7109
434P38.9Very low47Very low120 Ų120143.5 Ų143.578%0.77975%0.751SS**PPolyproline II helixtrans-67.8143.6-178.423.6-30.2000111.8
435S44.6Very low49.1Very low113 Ų113144 Ų14479%0.7976%0.76SS**PPolyproline II helixtrans-58.1139.7-179.2-52.20000111.7G437S435-G437 PolarHBondContact O-N 3.45Å
436P37.8Very low51.1Low135 Ų135141.1 Ų141.188%0.87775%0.745SS**SBendtrans-74.3119.6-176.728.9-30.5000110
437G37.5Very low52.9Low72 Ų72136 Ų13674%0.74273%0.729SS**SBendtrans173.9-33.7170.200000118.5S435S435-G437 PolarHBondContact O-N 3.45Å
438L40.7Very low54.8Low167 Ų167136.8 Ų136.887%0.87472%0.723SS**SBendtrans-145.3124.9-170.6-137.669000113.2
439S49.6Very low56.5Low85 Ų85138.4 Ų138.459%0.59471%0.713SS**  trans68.3100.717776.30000116.8
440R58.9Low58.1Low218 Ų218133 Ų13382%0.82370%0.697SS**  trans-79.3119.1161.3-82.4-179.1169.1173.7-3.3108.4V452R440-V452 PolarHBondContact O-N 3.46Å; R440-V452 VanDerWaalsContact O-N 3.16Å
441T70.7Confident59.8Low53 Ų53132.2 Ų132.233%0.32569%0.687SS.*EExtended strand (participates in β ladder)trans-93.1135.7163.357.80000109.2V450 K451T441-V450 WeakPolarHBondContact CA-O 3.43Å; T441-K451 HydrophobicContact CG2-CG 3.9Å
442V74.9Confident61.5Low84 Ų84124.6 Ų124.651%0.50967%0.667SS.*EExtended strand (participates in β ladder)trans-115.3148.3175-166.40000107.9G444 R449 V450 V452V442-G444 PolarHBondContact O-N 3.34Å; V442-R449 CarbonylContact O-C 3.53Å; V442-R449 WeakPolarHBondContact O-CA 3.29Å; V442-V450 PolarHBondContact N-O 3.33Å; V442-V450 PolarHBondContact O-N 3.13Å; V442-V452 HydrophobicContact CB-CG2 4.35Å; V442-V452 HydrophobicContact CG2-CG2 3.43Å; V442-V452 VanDerWaalsContact CG2-CG2 3.43Å
443L71.7Confident62.4Low110 Ų110122.4 Ų122.458%0.57666%0.664SS**EExtended strand (participates in β ladder)trans-72.2125.8172.9-8596.4000109.3R449L443-R449 HydrophobicContact CD1-CG 4.47Å; L443-R449 HydrophobicContact CG-CG 4.33Å
444G78.4Confident63Low25 Ų25115.7 Ų115.726%0.25865%0.654SS.*  trans-72.9171.9168.100000111.9V442 D446 G447 Q448V442-G444 PolarHBondContact O-N 3.34Å; G444-D446 PolarHBondContact O-N 2.98Å; G444-G447 PolarHBondContact O-N 3.03Å; G444-Q448 PolarHBondContact N-O 3.36Å
445V77.4Confident62.9Low164 Ų164117.3 Ų117.399%0.99466%0.657SS**THydrogen-bonded Turntrans-64.4-25.4-177.8-173.40000111.9G447V445-G447 VanDerWaalsContact C-N 3.28Å
446D78.9Confident63.3Low113 Ų113117.1 Ų117.160%0.60465%0.651SS**THydrogen-bonded Turntrans-83.32.6173.760.8-15.8000113.7G444 Q448G444-D446 PolarHBondContact O-N 2.98Å; D446-Q448 PolarHBondContact O-N 2.78Å; D446-Q448 PolarHBondContact OD1-N 3.41Å
447G77Confident63.4Low46 Ų46116.4 Ų116.447%0.47465%0.649SS.*SBendtrans77.6-1.1-176.700000114.4G444 V445G444-G447 PolarHBondContact O-N 3.03Å; V445-G447 VanDerWaalsContact C-N 3.28Å
448Q78.3Confident63.8Low135 Ų135120.3 Ų120.363%0.63165%0.652SS**  trans-81.8144.7177-65-157.94.200111.7G444 D446 V450G444-Q448 PolarHBondContact N-O 3.36Å; D446-Q448 PolarHBondContact O-N 2.78Å; D446-Q448 PolarHBondContact OD1-N 3.41Å; Q448-V450 PolarHBondContact O-N 2.93Å
449R74.1Confident64Low175 Ų175117.7 Ų117.766%0.6665%0.647SS**EExtended strand (participates in β ladder)trans-81.6106.4178.7-78.1-175.1177.2-136.90.9110.7V442 L443V442-R449 CarbonylContact O-C 3.53Å; V442-R449 WeakPolarHBondContact O-CA 3.29Å; L443-R449 HydrophobicContact CD1-CG 4.47Å; L443-R449 HydrophobicContact CG-CG 4.33Å
450V72.5Confident64.3Low87 Ų87123.8 Ų123.853%0.52768%0.681SS.*EExtended strand (participates in β ladder)trans-94.2135177-173.10000110.1T441 V442 Q448T441-V450 WeakPolarHBondContact CA-O 3.43Å; V442-V450 PolarHBondContact N-O 3.33Å; V442-V450 PolarHBondContact O-N 3.13Å; Q448-V450 PolarHBondContact O-N 2.93Å
451K74.8Confident64.6Low150 Ų150119.1 Ų119.165%0.65267%0.674SS**EExtended strand (participates in β ladder)trans-72.7124.4174.4-78.3-179.5178.2176.90109.7T441 K453T441-K451 HydrophobicContact CG2-CG 3.9Å; K451-K453 PolarHBondContact O-N 3.04Å
452V72.7Confident64.3Low84 Ų84122.6 Ų122.651%0.50969%0.692SS.*  trans-74108.1172.5-178.20000108.1R440 V442 S454R440-V452 PolarHBondContact O-N 3.46Å; R440-V452 VanDerWaalsContact O-N 3.16Å; V442-V452 HydrophobicContact CB-CG2 4.35Å; V442-V452 HydrophobicContact CG2-CG2 3.43Å; V442-V452 VanDerWaalsContact CG2-CG2 3.43Å; V452-S454 PolarHBondContact O-N 3.26Å
453K55.5Low63.7Low191 Ų191124.7 Ų124.783%0.8370%0.702SS**  trans-69.6108.6166.9-75.3-175.8178179.90107.7K451 N455K451-K453 PolarHBondContact O-N 3.04Å; K453-N455 PolarHBondContact O-N 2.93Å
454S57.5Low63.2Low102 Ų102125.6 Ų125.671%0.71371%0.709SS**  trans-79.6100.8167.554.80000108.2V452 V456V452-S454 PolarHBondContact O-N 3.26Å; S454-V456 PolarHBondContact O-N 3.47Å
455N38Very low62.3Low155 Ų155131.9 Ų131.983%0.82974%0.738SS**  trans-73.284.3165-75.5-4.3000107.8K453K453-N455 PolarHBondContact O-N 2.93Å
456V51.9Low61.3Low109 Ų109129.7 Ų129.766%0.66172%0.721SS**  trans-123.692.6160.6-178.30000105.6S454 L458S454-V456 PolarHBondContact O-N 3.47Å; V456-L458 HydrophobicContact CG1-CD1 4.4Å; V456-L458 PolarHBondContact O-N 3.11Å
457S40.9Very low60Low119 Ų119130.9 Ų130.983%0.83273%0.729SS**  trans-69.9102.4164.948.50000107.5
458L45.2Very low58.7Low155 Ų155137.5 Ų137.581%0.81275%0.748SS**  trans-83.2103.6160.4-93.9140.1000106.6V456V456-L458 HydrophobicContact CG1-CD1 4.4Å; V456-L458 PolarHBondContact O-N 3.11Å
459S44.8Very low57.1Low111 Ų111137.7 Ų137.778%0.77676%0.758SS**  trans-69.5133.2157.648.60000108.1
460V57.4Low55.6Low214 Ų214134.3 Ų134.3100%1.29777%0.767SS**  trans-60.20-176.7175.80000111.9

Retrieved 460 of 460 residues in 556.7 ms (Link to these results)

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