A0A087Y3T6_POEFO Loading...

Solute carrier family 15 member 5

Proton oligopeptide cotransporter.

AlphaFold DB , UniProt , Accession A0A087Y3T6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 541 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
1S66.1Low76.6Confident139 Ų13987.7 Ų87.797%0.97243%0.43SS*.  0-70.30-172.70000112.5K3 K4 L5S1-K3 PolarHBondContact O-N 3.07Å; S1-K4 PolarHBondContact O-N 3.36Å; S1-L5 PolarHBondContact O-N 3.42Å
2R69.5Low77.1Confident225 Ų22583.3 Ų83.385%0.84941%0.41SS*.Hα-helixtrans-58.4-43.2-176.4-69-176178.4178.91.3116.6K4 L5 Q6R2-K4 VanDerWaalsContact C-N 3.28Å; R2-K4 PolarHBondContact O-N 3.33Å; R2-L5 PolarHBondContact O-N 3.1Å; R2-Q6 PolarHBondContact O-N 3.05Å
3K69.6Low78.1Confident157 Ų15781.5 Ų81.568%0.68340%0.402SS*.Hα-helixtrans-64.3-26.4-177.6-74.2-175.9179.9178.70114.2S1 V7 K209S1-K3 PolarHBondContact O-N 3.07Å; K3-V7 WeakPolarHBondContact O-CG2 3.48Å; K3-K209 PolarHBondContact O-NZ 3.31Å; K3-K209 VanDerWaalsContact O-NZ 3.1Å
4K71.5Confident78.9Confident109 Ų10975.7 Ų75.747%0.47437%0.374SS..Hα-helixtrans-81-44.3176.4-75.1-172.7175.1-174.60110.9S1 R2 Q6 V7 V8 S148S1-K4 PolarHBondContact O-N 3.36Å; R2-K4 VanDerWaalsContact C-N 3.28Å; R2-K4 PolarHBondContact O-N 3.33Å; K4-Q6 VanDerWaalsContact C-N 3.27Å; K4-Q6 PolarHBondContact O-N 3.22Å; K4-V7 WeakPolarHBondContact O-CB 3.41Å; K4-V7 PolarHBondContact O-N 3.09Å; K4-V8 WeakPolarHBondContact O-CG2 3.21Å; K4-V8 PolarHBondContact O-N 3.3Å; K4-S148 PolarHBondContact NZ-OG 3.35Å
5L76.5Confident79.3Confident94 Ų9470.9 Ų70.949%0.49235%0.35SS..Hα-helixtrans-56.7-42.8175-177.264.9000111.7S1 R2 V7 V8 I9S1-L5 PolarHBondContact O-N 3.42Å; R2-L5 PolarHBondContact O-N 3.1Å; L5-V7 VanDerWaalsContact C-N 3.31Å; L5-V7 PolarHBondContact O-N 3.48Å; L5-V8 PolarHBondContact O-N 3.15Å; L5-I9 HydrophobicContact CD1-CD1 4.3Å; L5-I9 HydrophobicContact CD1-CG1 4.5Å; L5-I9 HydrophobicContact CG-CD1 3.9Å; L5-I9 HydrophobicContact CG-CG1 4.49Å; L5-I9 WeakPolarHBondContact O-CG1 3.21Å; L5-I9 PolarHBondContact O-N 3.24Å
6Q79.6Confident79.8Confident86 Ų8668.5 Ų68.540%0.40234%0.338SS..Hα-helixtrans-58-41175.2-170.9-174.611.400112.7R2 K4 I9 C10R2-Q6 PolarHBondContact O-N 3.05Å; K4-Q6 VanDerWaalsContact C-N 3.27Å; K4-Q6 PolarHBondContact O-N 3.22Å; Q6-I9 PolarHBondContact O-N 2.95Å; Q6-C10 WeakPolarHBondContact O-CB 3.47Å; Q6-C10 PolarHBondContact O-N 3.27Å; Q6-C10 PolarHBondContact O-SG 3.27Å
7V78.9Confident80.5Confident22 Ų2265.1 Ų65.113%0.13332%0.323CS..Hα-helixtrans-65.1-45.2177.3170.50000110.1K3 K4 L5 I9 C10 V11 M206 K209K3-V7 WeakPolarHBondContact O-CG2 3.48Å; K4-V7 WeakPolarHBondContact O-CB 3.41Å; K4-V7 PolarHBondContact O-N 3.09Å; L5-V7 VanDerWaalsContact C-N 3.31Å; L5-V7 PolarHBondContact O-N 3.48Å; V7-I9 PolarHBondContact O-N 3.33Å; V7-C10 PolarHBondContact O-N 3.07Å; V7-V11 WeakPolarHBondContact O-CG2 3.43Å; V7-V11 PolarHBondContact O-N 3.13Å; V7-M206 HydrophobicContact CB-CE 4.39Å; V7-M206 HydrophobicContact CG1-CE 3.56Å; V7-K209 HydrophobicContact CG2-CB 4.12Å; V7-K209 HydrophobicContact CG2-CD 3.43Å; V7-K209 VanDerWaalsContact CG2-CD 3.43Å; V7-K209 HydrophobicContact CG2-CG 4.44Å
8V78.4Confident81Confident11 Ų1161.5 Ų61.57%0.06731%0.305CS..Hα-helixtrans-60.8-45.5178.3175.10000111.2K4 L5 C10 V11 L12 L146 F157K4-V8 WeakPolarHBondContact O-CG2 3.21Å; K4-V8 PolarHBondContact O-N 3.3Å; L5-V8 PolarHBondContact O-N 3.15Å; V8-C10 PolarHBondContact O-N 3.04Å; V8-V11 PolarHBondContact O-N 3.45Å; V8-L12 HydrophobicContact CG1-CD1 4.29Å; V8-L12 WeakPolarHBondContact O-CB 3.14Å; V8-L12 WeakPolarHBondContact O-CG 3.18Å; V8-L12 PolarHBondContact O-N 3.3Å; V8-L146 HydrophobicContact CG1-CD2 4.12Å; V8-L146 HydrophobicContact CG2-CD2 3.66Å; V8-L146 HydrophobicContact CG2-CG 4.29Å; V8-F157 HydrophobicContact CG1-CD2 4.37Å; V8-F157 HydrophobicContact CG1-CE2 3.41Å; V8-F157 VanDerWaalsContact CG1-CE2 3.41Å; V8-F157 HydrophobicContact CG1-CZ 3.87Å
9I83.8Confident81.4Confident94 Ų9461.3 Ų61.348%0.48230%0.3SS..Hα-helixtrans-61.5-44.7177.4-67.8167.4000110.9L5 Q6 V7 L12 L13L5-I9 HydrophobicContact CD1-CD1 4.3Å; L5-I9 HydrophobicContact CD1-CG1 4.5Å; L5-I9 HydrophobicContact CG-CD1 3.9Å; L5-I9 HydrophobicContact CG-CG1 4.49Å; L5-I9 WeakPolarHBondContact O-CG1 3.21Å; L5-I9 PolarHBondContact O-N 3.24Å; Q6-I9 PolarHBondContact O-N 2.95Å; V7-I9 PolarHBondContact O-N 3.33Å; I9-L12 PolarHBondContact O-N 3.22Å; I9-L13 WeakPolarHBondContact O-CB 3.45Å; I9-L13 PolarHBondContact O-N 3.41Å
10C85.4Confident81.8Confident12 Ų1260.3 Ų60.38%0.08129%0.294CS..Hα-helixtrans-65.7-38.6177.6-67.50000112.3Q6 V7 V8 L13 V14 A202 M206Q6-C10 WeakPolarHBondContact O-CB 3.47Å; Q6-C10 PolarHBondContact O-N 3.27Å; Q6-C10 PolarHBondContact O-SG 3.27Å; V7-C10 PolarHBondContact O-N 3.07Å; V8-C10 PolarHBondContact O-N 3.04Å; C10-L13 PolarHBondContact O-N 3.33Å; C10-V14 VanDerWaalsContact O-CG2 3.23Å; C10-V14 WeakPolarHBondContact O-CG2 3.49Å; C10-V14 PolarHBondContact O-N 3.35Å; C10-A202 HydrophobicContact CB-CB 4.43Å; C10-M206 HydrophobicContact CB-CE 4.47Å; C10-M206 HydrophobicContact CB-CG 3.49Å; C10-M206 VanDerWaalsContact CB-CG 3.49Å; C10-M206 HydrophobicContact CB-SD 3.27Å; C10-M206 WeakPolarHBondContact CB-SD 3.34Å
11V83Confident82.2Confident16 Ų1657.4 Ų57.410%0.09728%0.28CS..Hα-helixtrans-59.7-49.2172.9171.40000110.7V7 V8 L13 V14 E15 L138 M206V7-V11 WeakPolarHBondContact O-CG2 3.43Å; V7-V11 PolarHBondContact O-N 3.13Å; V8-V11 PolarHBondContact O-N 3.45Å; V11-L13 VanDerWaalsContact C-N 3.32Å; V11-L13 PolarHBondContact O-N 3.24Å; V11-V14 PolarHBondContact O-N 2.92Å; V11-E15 PolarHBondContact O-N 3.36Å; V11-L138 HydrophobicContact CG1-CD2 4.49Å; V11-L138 HydrophobicContact CG1-CG 4.18Å; V11-L138 HydrophobicContact CG2-CD1 4.21Å; V11-M206 HydrophobicContact CB-CE 4.46Å; V11-M206 HydrophobicContact CG2-CE 3.28Å; V11-M206 HydrophobicContact CG2-SD 4.18Å
12L83Confident83.5Confident35 Ų3551.6 Ų51.618%0.18324%0.238CC..Hα-helixtrans-58.9-45.9179.2-76.1178.1000111.1V8 I9 V14 E15 L16 F157 F161V8-L12 HydrophobicContact CG1-CD1 4.29Å; V8-L12 WeakPolarHBondContact O-CB 3.14Å; V8-L12 WeakPolarHBondContact O-CG 3.18Å; V8-L12 PolarHBondContact O-N 3.3Å; I9-L12 PolarHBondContact O-N 3.22Å; L12-V14 PolarHBondContact O-N 3.2Å; L12-E15 PolarHBondContact O-N 3.06Å; L12-L16 VanDerWaalsContact O-CG 3.23Å; L12-L16 WeakPolarHBondContact O-CG 3.31Å; L12-L16 PolarHBondContact O-N 3.28Å; L12-F157 HydrophobicContact CD1-CE2 3.71Å; L12-F157 HydrophobicContact CD1-CZ 4.03Å; L12-F157 HydrophobicContact CD2-CE1 4.48Å; L12-F157 HydrophobicContact CD2-CE2 4.15Å; L12-F157 HydrophobicContact CD2-CZ 3.62Å; L12-F157 HydrophobicContact CG-CE2 4.14Å; L12-F157 HydrophobicContact CG-CZ 3.93Å; L12-F161 HydrophobicContact CD2-CD2 3.37Å; L12-F161 HydrophobicContact CD2-CE2 3.86Å; L12-F161 HydrophobicContact CD2-CG 4.43Å
13L89.7Confident84.5Confident60 Ų6042.9 Ų42.931%0.31421%0.206SC..Hα-helixtrans-59.3-46.7178.3-179.161.3000111.5I9 C10 V11 E15 L16 C17 L198 A202I9-L13 WeakPolarHBondContact O-CB 3.45Å; I9-L13 PolarHBondContact O-N 3.41Å; C10-L13 PolarHBondContact O-N 3.33Å; V11-L13 VanDerWaalsContact C-N 3.32Å; V11-L13 PolarHBondContact O-N 3.24Å; L13-E15 VanDerWaalsContact C-N 3.34Å; L13-E15 PolarHBondContact O-N 3.01Å; L13-L16 PolarHBondContact O-N 3.49Å; L13-C17 WeakPolarHBondContact O-CB 3.42Å; L13-C17 PolarHBondContact O-N 3.34Å; L13-C17 PolarHBondContact O-SG 3.5Å; L13-C17 VanDerWaalsContact O-SG 3.32Å; L13-L198 HydrophobicContact CD1-CD2 4.06Å; L13-L198 HydrophobicContact CD2-CD1 4.36Å; L13-L198 HydrophobicContact CD2-CD2 4.42Å; L13-L198 HydrophobicContact CD2-CG 4.19Å; L13-A202 HydrophobicContact CD2-CB 4.16Å
14V89.6Confident85.4Confident0 Ų035.4 Ų35.40%017%0.173CC..Hα-helixtrans-62.7-42.7178.5174.30000111.3C10 V11 L12 C17 E18 I134 L138 A199 A202 I203C10-V14 VanDerWaalsContact O-CG2 3.23Å; C10-V14 WeakPolarHBondContact O-CG2 3.49Å; C10-V14 PolarHBondContact O-N 3.35Å; V11-V14 PolarHBondContact O-N 2.92Å; L12-V14 PolarHBondContact O-N 3.2Å; V14-C17 PolarHBondContact O-N 3.07Å; V14-E18 VanDerWaalsContact O-CB 3.25Å; V14-E18 WeakPolarHBondContact O-CB 3.33Å; V14-E18 PolarHBondContact O-N 3.35Å; V14-I134 HydrophobicContact CG1-CG2 3.97Å; V14-L138 HydrophobicContact CB-CD2 3.6Å; V14-L138 HydrophobicContact CG1-CD2 3.24Å; V14-L138 HydrophobicContact CG2-CD2 4.45Å; V14-A199 HydrophobicContact CG1-CB 4.26Å; V14-A199 HydrophobicContact CG2-CB 4.44Å; V14-A202 HydrophobicContact CG2-CB 3.54Å; V14-I203 HydrophobicContact CG1-CD1 3.99Å; V14-I203 HydrophobicContact CG1-CG1 4.02Å; V14-I203 HydrophobicContact CG2-CD1 4.5Å; V14-I203 HydrophobicContact CG2-CG1 3.74Å
15E84.4Confident86.3Confident4 Ų430.7 Ų30.72%0.01915%0.153CC..Hα-helixtrans-61.7-44.4176.2-173.577-159.600111.2V11 L12 L13 E18 R19 C139 F161V11-E15 PolarHBondContact O-N 3.36Å; L12-E15 PolarHBondContact O-N 3.06Å; L13-E15 VanDerWaalsContact C-N 3.34Å; L13-E15 PolarHBondContact O-N 3.01Å; E15-E18 PolarHBondContact O-N 2.88Å; E15-R19 HydrophobicContact CG-CG 4.46Å; E15-R19 WeakPolarHBondContact O-CB 3.34Å; E15-R19 VanDerWaalsContact O-CG 3.23Å; E15-R19 WeakPolarHBondContact O-CG 3.49Å; E15-R19 PolarHBondContact O-N 3.07Å; E15-R19 IonicContact OE1-CZ 2.63Å; E15-R19 VanDerWaalsContact OE1-CZ 3.25Å; E15-R19 IonicContact OE1-NE 2.92Å; E15-R19 PolarHBondContact OE1-NE 3.01Å; E15-R19 VanDerWaalsContact OE1-NE 3.15Å; E15-R19 IonicContact OE1-NH2 3.22Å; E15-R19 PolarHBondContact OE1-NH2 3Å; E15-C139 PolarHBondContact OE2-SG 3.48Å; E15-F161 HydrophobicContact CB-CE2 4.32Å; E15-F161 HydrophobicContact CG-CE2 3.76Å; E15-F161 HydrophobicContact CG-CZ 3.73Å
16L88.3Confident87.1Confident32 Ų3226.5 Ų26.517%0.16813%0.132CC..Hα-helixtrans-64.2-44.8178-67167.1000111.8L12 L13 E18 R19 F20 L164 N168L12-L16 VanDerWaalsContact O-CG 3.23Å; L12-L16 WeakPolarHBondContact O-CG 3.31Å; L12-L16 PolarHBondContact O-N 3.28Å; L13-L16 PolarHBondContact O-N 3.49Å; L16-E18 VanDerWaalsContact C-N 3.32Å; L16-E18 PolarHBondContact O-N 3.2Å; L16-R19 PolarHBondContact O-N 2.91Å; L16-F20 WeakPolarHBondContact O-CB 3.3Å; L16-F20 PolarHBondContact O-N 3.5Å; L16-L164 HydrophobicContact CD1-CD2 3.55Å; L16-L164 HydrophobicContact CD1-CG 4.08Å; L16-L164 HydrophobicContact CD2-CD2 3.9Å; L16-L164 HydrophobicContact CD2-CG 3.69Å; L16-L164 HydrophobicContact CG-CD2 4.21Å; L16-L164 HydrophobicContact CG-CG 4.49Å; L16-N168 HydrophobicContact CD2-CB 4.18Å
17C91.3Very high87.5Confident10 Ų1022.5 Ų22.57%0.06811%0.113CC..Hα-helixtrans-62.3-40177.3-74.60000112.1L13 V14 T21 S195 A199L13-C17 WeakPolarHBondContact O-CB 3.42Å; L13-C17 PolarHBondContact O-N 3.34Å; L13-C17 PolarHBondContact O-SG 3.5Å; L13-C17 VanDerWaalsContact O-SG 3.32Å; V14-C17 PolarHBondContact O-N 3.07Å; C17-T21 WeakPolarHBondContact O-CB 3.27Å; C17-T21 PolarHBondContact O-N 3.1Å; C17-T21 PolarHBondContact O-OG1 3.02Å; C17-S195 WeakPolarHBondContact CA-OG 3.08Å; C17-S195 WeakPolarHBondContact CB-O 3.31Å; C17-S195 VanDerWaalsContact CB-OG 3.28Å; C17-S195 WeakPolarHBondContact CB-OG 3.3Å; C17-S195 PolarHBondContact O-OG 3.13Å; C17-A199 HydrophobicContact CB-CB 3.83Å
18E89.6Confident87.9Confident1 Ų121.6 Ų21.61%0.00511%0.108CC..Hα-helixtrans-63.9-50.9175.2-179-74.4122.300110.9V14 E15 L16 F20 T21 F22 I131 R135V14-E18 VanDerWaalsContact O-CB 3.25Å; V14-E18 WeakPolarHBondContact O-CB 3.33Å; V14-E18 PolarHBondContact O-N 3.35Å; E15-E18 PolarHBondContact O-N 2.88Å; L16-E18 VanDerWaalsContact C-N 3.32Å; L16-E18 PolarHBondContact O-N 3.2Å; E18-F20 VanDerWaalsContact C-N 3.31Å; E18-F20 PolarHBondContact O-N 3.2Å; E18-T21 WeakPolarHBondContact O-CB 3.38Å; E18-T21 PolarHBondContact O-N 3.04Å; E18-T21 VanDerWaalsContact O-N 3.16Å; E18-F22 PolarHBondContact O-N 3.35Å; E18-I131 HydrophobicContact CG-CG1 4.37Å; E18-I131 HydrophobicContact CG-CG2 4.44Å; E18-I131 WeakPolarHBondContact OE1-CG2 3.38Å; E18-R135 IonicContact OE1-CZ 2.89Å; E18-R135 VanDerWaalsContact OE1-CZ 3.22Å; E18-R135 IonicContact OE1-NE 3.76Å; E18-R135 PolarHBondContact OE1-NE 3.45Å; E18-R135 VanDerWaalsContact OE1-NE 3.13Å; E18-R135 IonicContact OE1-NH2 3.74Å; E18-R135 PolarHBondContact OE1-NH2 2.9Å; E18-R135 IonicContact OE2-CZ 2.68Å; E18-R135 IonicContact OE2-NE 3.92Å; E18-R135 PolarHBondContact OE2-NE 2.67Å; E18-R135 IonicContact OE2-NH2 3.13Å; E18-R135 PolarHBondContact OE2-NH2 3.14Å
19R87.8Confident88.5Confident58 Ų5821.4 Ų21.422%0.21911%0.106CC..Hα-helixtrans-61.2-41.9179.1-68.3-67.8158.5128.410.1112.5E15 L16 T21 F22 F23 V165E15-R19 HydrophobicContact CG-CG 4.46Å; E15-R19 WeakPolarHBondContact O-CB 3.34Å; E15-R19 VanDerWaalsContact O-CG 3.23Å; E15-R19 WeakPolarHBondContact O-CG 3.49Å; E15-R19 PolarHBondContact O-N 3.07Å; E15-R19 IonicContact OE1-CZ 2.63Å; E15-R19 VanDerWaalsContact OE1-CZ 3.25Å; E15-R19 IonicContact OE1-NE 2.92Å; E15-R19 PolarHBondContact OE1-NE 3.01Å; E15-R19 VanDerWaalsContact OE1-NE 3.15Å; E15-R19 IonicContact OE1-NH2 3.22Å; E15-R19 PolarHBondContact OE1-NH2 3Å; L16-R19 PolarHBondContact O-N 2.91Å; R19-T21 VanDerWaalsContact C-N 3.3Å; R19-T21 PolarHBondContact O-N 3.33Å; R19-F22 PolarHBondContact O-N 3.19Å; R19-F23 HydrophobicContact CB-CD2 4.39Å; R19-F23 HydrophobicContact CB-CE2 4.35Å; R19-F23 WeakPolarHBondContact O-CD2 3.47Å; R19-F23 PolarHBondContact O-N 3.41Å; R19-V165 HydrophobicContact CG-CG1 4.46Å
20F90Very high89Confident40 Ų4017 Ų1718%0.1758%0.083CC..Hα-helixtrans-57.2-45.9175.5-177.7-85.2000111.5L16 E18 G24 N168 V172 I176 I191L16-F20 WeakPolarHBondContact O-CB 3.3Å; L16-F20 PolarHBondContact O-N 3.5Å; E18-F20 VanDerWaalsContact C-N 3.31Å; E18-F20 PolarHBondContact O-N 3.2Å; F20-G24 PolarHBondContact O-N 3.37Å; F20-N168 PolarHBondContact N-OD1 2.87Å; F20-V172 HydrophobicContact CB-CG2 4.24Å; F20-V172 HydrophobicContact CD2-CG2 3.46Å; F20-V172 VanDerWaalsContact CD2-CG2 3.46Å; F20-V172 HydrophobicContact CE2-CG2 4.06Å; F20-V172 HydrophobicContact CG-CG2 3.86Å; F20-I176 HydrophobicContact CD1-CD1 4.05Å; F20-I176 HydrophobicContact CD2-CD1 3.92Å; F20-I176 HydrophobicContact CE1-CD1 3.47Å; F20-I176 VanDerWaalsContact CE1-CD1 3.47Å; F20-I176 HydrophobicContact CE2-CD1 3.32Å; F20-I176 HydrophobicContact CE2-CG1 4.25Å; F20-I176 HydrophobicContact CG-CD1 4.27Å; F20-I176 HydrophobicContact CZ-CD1 3.06Å; F20-I176 HydrophobicContact CZ-CG1 4Å; F20-I191 HydrophobicContact CE1-CG2 3.46Å; F20-I191 VanDerWaalsContact CE1-CG2 3.46Å; F20-I191 HydrophobicContact CZ-CG2 3.58Å
21T91.1Very high89.2Confident0 Ų016.6 Ų16.60%08%0.08CC..Hα-helixtrans-64.7-47.8176.9-57.70000111.5C17 E18 R19 F23 G24 I25 H83 T87 P192 V196C17-T21 WeakPolarHBondContact O-CB 3.27Å; C17-T21 PolarHBondContact O-N 3.1Å; C17-T21 PolarHBondContact O-OG1 3.02Å; E18-T21 WeakPolarHBondContact O-CB 3.38Å; E18-T21 PolarHBondContact O-N 3.04Å; E18-T21 VanDerWaalsContact O-N 3.16Å; R19-T21 VanDerWaalsContact C-N 3.3Å; R19-T21 PolarHBondContact O-N 3.33Å; T21-F23 PolarHBondContact O-N 2.88Å; T21-G24 PolarHBondContact O-N 3.46Å; T21-I25 HydrophobicContact CG2-CD1 4Å; T21-I25 VanDerWaalsContact O-CG1 3.31Å; T21-I25 WeakPolarHBondContact O-CG1 3.37Å; T21-I25 PolarHBondContact O-N 3.33Å; T21-H83 WeakPolarHBondContact CG2-NE2 3.25Å; T21-T87 HydrophobicContact CG2-CG2 3.5Å; T21-P192 HydrophobicContact CG2-CB 4.05Å; T21-V196 HydrophobicContact CG2-CG2 3.89Å
22F92Very high89.5Confident18 Ų1816.3 Ų16.38%0.0798%0.078CC..Hα-helixtrans-57.2-52.1178.2172.6-99.7000111.9E18 R19 G24 I25 V26 F51 I52 I131E18-F22 PolarHBondContact O-N 3.35Å; R19-F22 PolarHBondContact O-N 3.19Å; F22-G24 VanDerWaalsContact C-N 3.35Å; F22-G24 PolarHBondContact O-N 3.32Å; F22-I25 PolarHBondContact O-N 2.85Å; F22-V26 HydrophobicContact CD2-CG2 4.37Å; F22-V26 HydrophobicContact CE1-CG2 4.21Å; F22-V26 HydrophobicContact CE2-CG2 3.98Å; F22-V26 HydrophobicContact CZ-CG2 3.9Å; F22-V26 VanDerWaalsContact O-CG2 3.29Å; F22-V26 WeakPolarHBondContact O-CG2 3.3Å; F22-V26 PolarHBondContact O-N 3.06Å; F22-F51 HydrophobicContact CD2-CE1 4.02Å; F22-F51 HydrophobicContact CD2-CZ 4.47Å; F22-F51 HydrophobicContact CE2-CE1 4.12Å; F22-I52 HydrophobicContact CZ-CG1 4.34Å; F22-I52 HydrophobicContact CZ-CG2 4.34Å; F22-I131 HydrophobicContact CB-CD1 4.18Å; F22-I131 HydrophobicContact CD2-CD1 4.24Å; F22-I131 HydrophobicContact CD2-CG2 4.47Å
23F90.1Very high89.9Confident41 Ų4114.6 Ų14.618%0.187%0.069CC..Hα-helixtrans-67.8-34.6179.8-70.4-56.7000112.3R19 T21 I25 V26 C27 V172 F173R19-F23 HydrophobicContact CB-CD2 4.39Å; R19-F23 HydrophobicContact CB-CE2 4.35Å; R19-F23 WeakPolarHBondContact O-CD2 3.47Å; R19-F23 PolarHBondContact O-N 3.41Å; T21-F23 PolarHBondContact O-N 2.88Å; F23-I25 VanDerWaalsContact C-N 3.35Å; F23-I25 PolarHBondContact O-N 3.33Å; F23-V26 PolarHBondContact O-N 3.07Å; F23-C27 VanDerWaalsContact O-CB 3.28Å; F23-C27 WeakPolarHBondContact O-CB 3.36Å; F23-C27 PolarHBondContact O-N 2.91Å; F23-C27 PolarHBondContact O-SG 3.47Å; F23-V172 HydrophobicContact CB-CB 4.23Å; F23-V172 HydrophobicContact CB-CG1 3.62Å; F23-F173 HydrophobicContact CB-CZ 4.31Å; F23-F173 AromaticContact CD1-CE2 4Å; F23-F173 HydrophobicContact CD1-CE2 4Å; F23-F173 AromaticContact CD1-CZ 3.68Å; F23-F173 HydrophobicContact CD1-CZ 3.68Å; F23-F173 HydrophobicContact CE1-CE2 4.45Å; F23-F173 HydrophobicContact CE1-CZ 4.36Å; F23-F173 HydrophobicContact CG-CE2 4.37Å; F23-F173 HydrophobicContact CG-CZ 4.26Å
24G89.7Confident89.9Confident0 Ų012.6 Ų12.60%06%0.059CC..Hα-helixtrans-64.7-36.8177.200000113.2F20 T21 F22 C27 N28F20-G24 PolarHBondContact O-N 3.37Å; T21-G24 PolarHBondContact O-N 3.46Å; F22-G24 VanDerWaalsContact C-N 3.35Å; F22-G24 PolarHBondContact O-N 3.32Å; G24-C27 PolarHBondContact O-SG 2.68Å; G24-C27 VanDerWaalsContact O-SG 3.33Å; G24-N28 PolarHBondContact O-ND2 3.3Å
25I91Very high89.7Confident10 Ų1013.5 Ų13.55%0.0517%0.065CC..Hα-helixtrans-69.2-52.1172.5-65.5168.1000109.9T21 F22 F23 C27 N28 M29 F51 T87 L90 L124T21-I25 HydrophobicContact CG2-CD1 4Å; T21-I25 VanDerWaalsContact O-CG1 3.31Å; T21-I25 WeakPolarHBondContact O-CG1 3.37Å; T21-I25 PolarHBondContact O-N 3.33Å; F22-I25 PolarHBondContact O-N 2.85Å; F23-I25 VanDerWaalsContact C-N 3.35Å; F23-I25 PolarHBondContact O-N 3.33Å; I25-C27 VanDerWaalsContact C-N 3.32Å; I25-C27 PolarHBondContact O-N 2.9Å; I25-N28 PolarHBondContact O-N 2.89Å; I25-M29 HydrophobicContact CG2-CE 3.47Å; I25-M29 VanDerWaalsContact CG2-CE 3.47Å; I25-M29 WeakPolarHBondContact O-CB 3.29Å; I25-M29 PolarHBondContact O-N 3.32Å; I25-F51 HydrophobicContact CB-CE1 4.08Å; I25-F51 HydrophobicContact CB-CZ 4.28Å; I25-F51 HydrophobicContact CD1-CZ 3.98Å; I25-F51 HydrophobicContact CG2-CD1 4.1Å; I25-F51 HydrophobicContact CG2-CE1 3.61Å; I25-F51 HydrophobicContact CG2-CE2 4.47Å; I25-F51 HydrophobicContact CG2-CZ 3.82Å; I25-T87 HydrophobicContact CD1-CG2 4.29Å; I25-L90 HydrophobicContact CD1-CD1 3.71Å; I25-L90 HydrophobicContact CG1-CD1 3.7Å; I25-L90 HydrophobicContact CG2-CD1 4.38Å; I25-L124 HydrophobicContact CG2-CD2 4.13Å
26V91.7Very high89.6Confident7 Ų717 Ų174%0.0428%0.08CC..Hα-helixtrans-60.3-39.9-175.7168.40000112.5F22 F23 N28 N48 F51 I52 P292F22-V26 HydrophobicContact CD2-CG2 4.37Å; F22-V26 HydrophobicContact CE1-CG2 4.21Å; F22-V26 HydrophobicContact CE2-CG2 3.98Å; F22-V26 HydrophobicContact CZ-CG2 3.9Å; F22-V26 VanDerWaalsContact O-CG2 3.29Å; F22-V26 WeakPolarHBondContact O-CG2 3.3Å; F22-V26 PolarHBondContact O-N 3.06Å; F23-V26 PolarHBondContact O-N 3.07Å; V26-N28 VanDerWaalsContact C-N 3.31Å; V26-N28 PolarHBondContact O-N 2.93Å; V26-N48 PolarHBondContact O-ND2 3.46Å; V26-F51 HydrophobicContact CG2-CD1 3.97Å; V26-F51 HydrophobicContact CG2-CE1 3.93Å; V26-I52 HydrophobicContact CG1-CD1 3.81Å; V26-I52 HydrophobicContact CG1-CG1 4.22Å; V26-I52 HydrophobicContact CG2-CD1 4.2Å; V26-I52 HydrophobicContact CG2-CG1 3.65Å; V26-P292 HydrophobicContact CG1-CB 3.97Å
27C87.8Confident89.5Confident1 Ų116.7 Ų16.71%0.0078%0.078CC..Hα-helixtrans-73-21.9-175.371.20000113.8F23 G24 I25 F173 Y296F23-C27 VanDerWaalsContact O-CB 3.28Å; F23-C27 WeakPolarHBondContact O-CB 3.36Å; F23-C27 PolarHBondContact O-N 2.91Å; F23-C27 PolarHBondContact O-SG 3.47Å; G24-C27 PolarHBondContact O-SG 2.68Å; G24-C27 VanDerWaalsContact O-SG 3.33Å; I25-C27 VanDerWaalsContact C-N 3.32Å; I25-C27 PolarHBondContact O-N 2.9Å; C27-F173 HydrophobicContact CB-CD1 3.48Å; C27-F173 VanDerWaalsContact CB-CD1 3.48Å; C27-F173 HydrophobicContact CB-CE1 3.45Å; C27-F173 VanDerWaalsContact CB-CE1 3.45Å; C27-Y296 WeakPolarHBondContact O-CE2 3.24Å; C27-Y296 PolarHBondContact O-OH 2.91Å
28N88.3Confident89.3Confident4 Ų418.9 Ų18.92%0.02110%0.102CC..Hα-helixtrans-111.6-8.1179.1-68.6-75.1000114G24 I25 V26 I30 L31 F32 Q180G24-N28 PolarHBondContact O-ND2 3.3Å; I25-N28 PolarHBondContact O-N 2.89Å; V26-N28 VanDerWaalsContact C-N 3.31Å; V26-N28 PolarHBondContact O-N 2.93Å; N28-I30 VanDerWaalsContact C-N 3.31Å; N28-I30 PolarHBondContact O-N 3.11Å; N28-L31 PolarHBondContact O-N 3.44Å; N28-F32 VanDerWaalsContact O-CB 3.31Å; N28-F32 WeakPolarHBondContact O-CB 3.42Å; N28-F32 PolarHBondContact O-N 3Å; N28-Q180 PolarHBondContact ND2-NE2 3.46Å; N28-Q180 PolarHBondContact ND2-OE1 3.43Å; N28-Q180 WeakPolarHBondContact OD1-CB 3.3Å
29M91.5Very high89.3Confident7 Ų719.8 Ų19.83%0.03411%0.105CC..Hα-helixtrans-49.2-51-176.7-173.272.578.100112.5I25 F32 C33 V47 N48 F51 F120 L124I25-M29 HydrophobicContact CG2-CE 3.47Å; I25-M29 VanDerWaalsContact CG2-CE 3.47Å; I25-M29 WeakPolarHBondContact O-CB 3.29Å; I25-M29 PolarHBondContact O-N 3.32Å; M29-F32 PolarHBondContact O-N 3.44Å; M29-C33 WeakPolarHBondContact O-CB 3.42Å; M29-C33 PolarHBondContact O-N 3.42Å; M29-C33 PolarHBondContact O-SG 3.29Å; M29-V47 HydrophobicContact SD-CG1 4.22Å; M29-N48 HydrophobicContact CB-CB 4.06Å; M29-N48 VanDerWaalsContact CB-OD1 3.3Å; M29-N48 WeakPolarHBondContact CB-OD1 3.28Å; M29-N48 HydrophobicContact CG-CB 3.72Å; M29-F51 HydrophobicContact CE-CB 4.01Å; M29-F51 HydrophobicContact CE-CD1 4Å; M29-F51 HydrophobicContact CE-CG 3.92Å; M29-F120 HydrophobicContact SD-CE2 4.18Å; M29-F120 HydrophobicContact SD-CZ 3.63Å; M29-L124 HydrophobicContact CE-CD1 3.84Å; M29-L124 HydrophobicContact CE-CD2 3.38Å; M29-L124 HydrophobicContact CE-CG 4.27Å; M29-L124 HydrophobicContact SD-CD1 3.96Å; M29-L124 HydrophobicContact SD-CD2 4.15Å
30I93.1Very high89.5Confident0 Ų020.7 Ų20.70%012%0.115CC..Hα-helixtrans-66.9-47.9-176.5-68.7177.5000110.5N28 F32 C33 T34 A44 N48 P292 Y296 I297N28-I30 VanDerWaalsContact C-N 3.31Å; N28-I30 PolarHBondContact O-N 3.11Å; I30-F32 VanDerWaalsContact C-N 3.29Å; I30-F32 PolarHBondContact O-N 2.83Å; I30-C33 PolarHBondContact O-N 3.34Å; I30-T34 HydrophobicContact CG2-CG2 4.22Å; I30-T34 WeakPolarHBondContact O-CG2 3.34Å; I30-T34 PolarHBondContact O-N 3.24Å; I30-T34 PolarHBondContact O-OG1 3.39Å; I30-A44 HydrophobicContact CG1-CB 4.5Å; I30-A44 HydrophobicContact CG2-CB 4.29Å; I30-N48 HydrophobicContact CG1-CB 4.2Å; I30-P292 WeakPolarHBondContact CD1-O 3.44Å; I30-Y296 HydrophobicContact CB-CD1 3.65Å; I30-Y296 HydrophobicContact CB-CE1 3.66Å; I30-Y296 HydrophobicContact CB-CG 4.49Å; I30-Y296 HydrophobicContact CD1-CD1 3.91Å; I30-Y296 HydrophobicContact CD1-CG 4.08Å; I30-Y296 HydrophobicContact CG1-CD1 4.33Å; I30-Y296 HydrophobicContact CG2-CD1 3.64Å; I30-Y296 HydrophobicContact CG2-CE1 3.79Å; I30-I297 HydrophobicContact CD1-CG1 4.27Å; I30-I297 HydrophobicContact CG2-CD1 4.41Å; I30-I297 HydrophobicContact CG2-CG1 3.89Å
31L90.3Very high89.6Confident4 Ų419.3 Ų19.32%0.02111%0.109CC..Hα-helixtrans-59-42178.3-178.767.9000111.5N28 T34 V35 Q181 Y296 M300 I313 L383N28-L31 PolarHBondContact O-N 3.44Å; L31-T34 PolarHBondContact O-OG1 3.35Å; L31-V35 HydrophobicContact CD1-CB 4.48Å; L31-V35 HydrophobicContact CD1-CG2 3.64Å; L31-V35 HydrophobicContact CG-CG2 4.46Å; L31-V35 VanDerWaalsContact O-CB 3.22Å; L31-V35 WeakPolarHBondContact O-CB 3.45Å; L31-V35 WeakPolarHBondContact O-CG2 3.49Å; L31-V35 PolarHBondContact O-N 3.09Å; L31-Q181 HydrophobicContact CD2-CB 4.25Å; L31-Q181 HydrophobicContact CD2-CG 4.16Å; L31-Y296 HydrophobicContact CB-CE1 4.48Å; L31-Y296 WeakPolarHBondContact CB-OH 3.28Å; L31-M300 HydrophobicContact CD1-SD 4.21Å; L31-I313 HydrophobicContact CD1-CD1 4.28Å; L31-L383 HydrophobicContact CD1-CB 4.26Å
32F88.6Confident89.7Confident10 Ų1019.5 Ų19.54%0.04411%0.111CC..Iπ-helixtrans-64.7-49.4177.3-176.5-105.9000111.8N28 M29 I30 T34 K36 L37 V93 A94 F120 F189N28-F32 VanDerWaalsContact O-CB 3.31Å; N28-F32 WeakPolarHBondContact O-CB 3.42Å; N28-F32 PolarHBondContact O-N 3Å; M29-F32 PolarHBondContact O-N 3.44Å; I30-F32 VanDerWaalsContact C-N 3.29Å; I30-F32 PolarHBondContact O-N 2.83Å; F32-T34 PolarHBondContact O-N 3.22Å; F32-K36 HydrophobicContact CD2-CB 3.84Å; F32-K36 HydrophobicContact CD2-CG 3.81Å; F32-K36 HydrophobicContact CE2-CB 3.84Å; F32-K36 HydrophobicContact CE2-CG 3.99Å; F32-K36 HydrophobicContact CZ-CB 4.49Å; F32-K36 WeakPolarHBondContact O-CA 3.5Å; F32-K36 VanDerWaalsContact O-CB 3.3Å; F32-K36 WeakPolarHBondContact O-CB 3.39Å; F32-K36 PolarHBondContact O-N 2.96Å; F32-L37 HydrophobicContact CD1-CD1 4.07Å; F32-L37 HydrophobicContact CD1-CG 4.2Å; F32-L37 HydrophobicContact CE1-CD1 3.78Å; F32-L37 HydrophobicContact CE1-CD2 4.15Å; F32-L37 HydrophobicContact CE1-CG 3.84Å; F32-L37 HydrophobicContact CZ-CD2 4.37Å; F32-L37 HydrophobicContact CZ-CG 4.42Å; F32-L37 PolarHBondContact O-N 3.15Å; F32-L37 VanDerWaalsContact O-N 3.1Å; F32-V93 HydrophobicContact CE1-CG1 3.97Å; F32-V93 HydrophobicContact CZ-CB 4.39Å; F32-V93 HydrophobicContact CZ-CG1 3.78Å; F32-A94 HydrophobicContact CE2-CB 3.67Å; F32-A94 HydrophobicContact CZ-CB 4.06Å; F32-F120 AromaticContact CD1-CE2 3.83Å; F32-F120 HydrophobicContact CD1-CE2 3.83Å; F32-F120 HydrophobicContact CD1-CZ 4.3Å; F32-F120 AromaticContact CE1-CD2 3.96Å; F32-F120 HydrophobicContact CE1-CD2 3.96Å; F32-F120 AromaticContact CE1-CE2 3.74Å; F32-F120 HydrophobicContact CE1-CE2 3.74Å; F32-F189 HydrophobicContact CB-CZ 4.06Å; F32-F189 HydrophobicContact CD2-CE1 4.13Å; F32-F189 AromaticContact CD2-CE2 3.75Å; F32-F189 HydrophobicContact CD2-CE2 3.75Å; F32-F189 AromaticContact CD2-CZ 3.31Å; F32-F189 HydrophobicContact CD2-CZ 3.31Å; F32-F189 HydrophobicContact CE2-CE2 4.04Å; F32-F189 AromaticContact CE2-CZ 3.9Å; F32-F189 HydrophobicContact CE2-CZ 3.9Å; F32-F189 HydrophobicContact CG-CE1 4.34Å; F32-F189 AromaticContact CG-CZ 3.81Å; F32-F189 HydrophobicContact CG-CZ 3.81Å
33C91.6Very high89.8Confident0 Ų021.5 Ų21.50%012%0.122CC..Iπ-helixtrans-59.6-45.2178.1-73.90000111.9M29 I30 L37 G38 Y39 A44 F120M29-C33 WeakPolarHBondContact O-CB 3.42Å; M29-C33 PolarHBondContact O-N 3.42Å; M29-C33 PolarHBondContact O-SG 3.29Å; I30-C33 PolarHBondContact O-N 3.34Å; C33-L37 CarbonylContact O-C 3.48Å; C33-L37 WeakPolarHBondContact O-CB 3.38Å; C33-L37 PolarHBondContact O-N 3.19Å; C33-G38 PolarHBondContact O-N 2.61Å; C33-Y39 HydrophobicContact CB-CD2 3.88Å; C33-Y39 HydrophobicContact CB-CG 4.28Å; C33-Y39 WeakPolarHBondContact O-CB 3.42Å; C33-Y39 PolarHBondContact O-N 3.43Å; C33-A44 HydrophobicContact CB-CB 3.55Å; C33-F120 VanDerWaalsContact SG-CZ 3.59Å
34T90.3Very high90Very high17 Ų1719.5 Ų19.510%0.10411%0.113CC..Iπ-helixtrans-79.8-39.8-17558.80000113.2I30 L31 F32 A44I30-T34 HydrophobicContact CG2-CG2 4.22Å; I30-T34 WeakPolarHBondContact O-CG2 3.34Å; I30-T34 PolarHBondContact O-N 3.24Å; I30-T34 PolarHBondContact O-OG1 3.39Å; L31-T34 PolarHBondContact O-OG1 3.35Å; F32-T34 PolarHBondContact O-N 3.22Å; T34-A44 HydrophobicContact CG2-CB 3.72Å
35V85.8Confident90.3Very high20 Ų2019.5 Ų19.512%0.12111%0.113CC..Iπ-helixtrans-89.4-40.7-175.1179.20000112.4L31 K386 L388L31-V35 HydrophobicContact CD1-CB 4.48Å; L31-V35 HydrophobicContact CD1-CG2 3.64Å; L31-V35 HydrophobicContact CG-CG2 4.46Å; L31-V35 VanDerWaalsContact O-CB 3.22Å; L31-V35 WeakPolarHBondContact O-CB 3.45Å; L31-V35 WeakPolarHBondContact O-CG2 3.49Å; L31-V35 PolarHBondContact O-N 3.09Å; V35-K386 HydrophobicContact CG1-CB 3.67Å; V35-K386 HydrophobicContact CG1-CD 3.95Å; V35-K386 HydrophobicContact CG1-CG 4.47Å; V35-L388 HydrophobicContact CG2-CD1 4.45Å
36K82.6Confident90.6Very high78 Ų7819.9 Ų19.934%0.33912%0.116SC..Iπ-helixtrans-95.3-45.6-176.6-62.8-65.7-174.6-1750113.2F32F32-K36 HydrophobicContact CD2-CB 3.84Å; F32-K36 HydrophobicContact CD2-CG 3.81Å; F32-K36 HydrophobicContact CE2-CB 3.84Å; F32-K36 HydrophobicContact CE2-CG 3.99Å; F32-K36 HydrophobicContact CZ-CB 4.49Å; F32-K36 WeakPolarHBondContact O-CA 3.5Å; F32-K36 VanDerWaalsContact O-CB 3.3Å; F32-K36 WeakPolarHBondContact O-CB 3.39Å; F32-K36 PolarHBondContact O-N 2.96Å
37L85.6Confident90.8Very high25 Ų2520.1 Ų20.113%0.13112%0.117CC..SBendtrans-88.4-9.1-179.3-57.9-179.7000113.6F32 C33 Y39 V93 Q116 F120F32-L37 HydrophobicContact CD1-CD1 4.07Å; F32-L37 HydrophobicContact CD1-CG 4.2Å; F32-L37 HydrophobicContact CE1-CD1 3.78Å; F32-L37 HydrophobicContact CE1-CD2 4.15Å; F32-L37 HydrophobicContact CE1-CG 3.84Å; F32-L37 HydrophobicContact CZ-CD2 4.37Å; F32-L37 HydrophobicContact CZ-CG 4.42Å; F32-L37 PolarHBondContact O-N 3.15Å; F32-L37 VanDerWaalsContact O-N 3.1Å; C33-L37 CarbonylContact O-C 3.48Å; C33-L37 WeakPolarHBondContact O-CB 3.38Å; C33-L37 PolarHBondContact O-N 3.19Å; L37-Y39 VanDerWaalsContact C-N 3.27Å; L37-Y39 HydrophobicContact CB-CD1 3.86Å; L37-Y39 HydrophobicContact CB-CE1 3.92Å; L37-Y39 HydrophobicContact CB-CG 4.26Å; L37-Y39 HydrophobicContact CD1-CE1 4.47Å; L37-Y39 HydrophobicContact CD1-CE2 4.17Å; L37-Y39 PolarHBondContact O-N 2.88Å; L37-V93 HydrophobicContact CD2-CG1 4.1Å; L37-Q116 HydrophobicContact CD2-CG 4.15Å; L37-F120 HydrophobicContact CD1-CD1 3.83Å; L37-F120 HydrophobicContact CD1-CD2 4.24Å; L37-F120 HydrophobicContact CD1-CE1 3.83Å; L37-F120 HydrophobicContact CD1-CE2 4.26Å; L37-F120 HydrophobicContact CD1-CG 4.02Å; L37-F120 HydrophobicContact CD1-CZ 4.03Å
38G86.4Confident91.3Very high55 Ų5520 Ų2057%0.56712%0.117SC*.  trans67.723.2179.900000114.3C33C33-G38 PolarHBondContact O-N 2.61Å
39Y90.9Very high91.7Very high20 Ų2019.9 Ų19.98%0.07812%0.116CC..  trans-73.2149.5178.5-72.13.9000112.2C33 L37 L43 Q117 F120 Y121C33-Y39 HydrophobicContact CB-CD2 3.88Å; C33-Y39 HydrophobicContact CB-CG 4.28Å; C33-Y39 WeakPolarHBondContact O-CB 3.42Å; C33-Y39 PolarHBondContact O-N 3.43Å; L37-Y39 VanDerWaalsContact C-N 3.27Å; L37-Y39 HydrophobicContact CB-CD1 3.86Å; L37-Y39 HydrophobicContact CB-CE1 3.92Å; L37-Y39 HydrophobicContact CB-CG 4.26Å; L37-Y39 HydrophobicContact CD1-CE1 4.47Å; L37-Y39 HydrophobicContact CD1-CE2 4.17Å; L37-Y39 PolarHBondContact O-N 2.88Å; Y39-L43 HydrophobicContact CD1-CD2 4.11Å; Y39-L43 HydrophobicContact CD2-CD2 3.64Å; Y39-L43 HydrophobicContact CD2-CG 3.82Å; Y39-L43 HydrophobicContact CE1-CD2 4.37Å; Y39-L43 HydrophobicContact CE2-CD2 3.95Å; Y39-L43 HydrophobicContact CE2-CG 4.27Å; Y39-L43 HydrophobicContact CG-CD2 3.73Å; Y39-L43 HydrophobicContact CG-CG 4.26Å; Y39-Q117 HydrophobicContact CE1-CG 4.48Å; Y39-Q117 WeakPolarHBondContact OH-CG 3.28Å; Y39-F120 HydrophobicContact CE2-CE1 4.34Å; Y39-Y121 WeakPolarHBondContact CE2-OH 3.46Å; Y39-Y121 PolarHBondContact OH-OH 3.43Å
40D91.4Very high92Very high77 Ų7721.9 Ų21.941%0.41213%0.13SC..  trans-60150.7167.6-67.1-21.1000111.8V42 L43 A44 N468D40-V42 PolarHBondContact O-N 2.66Å; D40-L43 HydrophobicContact CB-CB 4.42Å; D40-L43 PolarHBondContact O-N 3.29Å; D40-A44 WeakPolarHBondContact O-CB 3.46Å; D40-A44 PolarHBondContact O-N 3.41Å; D40-N468 WeakPolarHBondContact CA-OD1 3.27Å; D40-N468 WeakPolarHBondContact CB-OD1 3.45Å; D40-N468 PolarHBondContact OD1-ND2 2.97Å; D40-N468 PolarHBondContact OD1-OD1 3.25Å
41N91.9Very high92.2Very high11 Ų1122.3 Ų22.36%0.05913%0.132CC..Hα-helixtrans-54.7-40.4176.8-82.4-18.7000111.8A45 I297 Y466 P467 N468 L470N41-A45 VanDerWaalsContact O-CB 3.32Å; N41-A45 WeakPolarHBondContact O-CB 3.38Å; N41-A45 PolarHBondContact O-N 3.3Å; N41-I297 HydrophobicContact CB-CD1 3.8Å; N41-Y466 HydrophobicContact CB-CD1 4.38Å; N41-Y466 HydrophobicContact CB-CE1 4.21Å; N41-P467 WeakPolarHBondContact CB-O 3.01Å; N41-P467 PolarHBondContact ND2-O 3.11Å; N41-N468 PolarHBondContact N-OD1 2.97Å; N41-N468 WeakPolarHBondContact ND2-CA 3.27Å; N41-N468 PolarHBondContact ND2-O 3.26Å; N41-L470 WeakPolarHBondContact ND2-CD1 3.5Å
42V92.9Very high92.5Very high5 Ų523 Ų233%0.0314%0.135CC..Hα-helixtrans-59.6-49.9177.2-175.50000110.5D40 T46 I451 H455 Y466D40-V42 PolarHBondContact O-N 2.66Å; V42-T46 VanDerWaalsContact O-CB 3.3Å; V42-T46 WeakPolarHBondContact O-CB 3.46Å; V42-T46 PolarHBondContact O-N 2.87Å; V42-T46 PolarHBondContact O-OG1 2.94Å; V42-I451 HydrophobicContact CG1-CG2 3.78Å; V42-H455 HydrophobicContact CG1-CB 3.94Å; V42-H455 HydrophobicContact CG2-CB 4.35Å; V42-Y466 HydrophobicContact CB-CD1 4.24Å; V42-Y466 HydrophobicContact CG2-CD1 3.65Å; V42-Y466 HydrophobicContact CG2-CG 4.21Å; V42-Y466 WeakPolarHBondContact CG2-O 3.4Å
43L93.9Very high92.8Very high59 Ų5922.5 Ų22.531%0.30913%0.133SC..Hα-helixtrans-68.2-46.2-177-176.560.9000110.1Y39 D40 A45 T46 V47Y39-L43 HydrophobicContact CD1-CD2 4.11Å; Y39-L43 HydrophobicContact CD2-CD2 3.64Å; Y39-L43 HydrophobicContact CD2-CG 3.82Å; Y39-L43 HydrophobicContact CE1-CD2 4.37Å; Y39-L43 HydrophobicContact CE2-CD2 3.95Å; Y39-L43 HydrophobicContact CE2-CG 4.27Å; Y39-L43 HydrophobicContact CG-CD2 3.73Å; Y39-L43 HydrophobicContact CG-CG 4.26Å; D40-L43 HydrophobicContact CB-CB 4.42Å; D40-L43 PolarHBondContact O-N 3.29Å; L43-A45 PolarHBondContact O-N 3.48Å; L43-T46 WeakPolarHBondContact O-CB 3.36Å; L43-T46 PolarHBondContact O-N 3.33Å; L43-V47 HydrophobicContact CD1-CG2 4.23Å; L43-V47 HydrophobicContact CG-CG2 4.43Å; L43-V47 VanDerWaalsContact O-CG2 3.3Å; L43-V47 WeakPolarHBondContact O-CG2 3.41Å; L43-V47 PolarHBondContact O-N 3Å
44A95.4Very high93Very high0 Ų023.8 Ų23.80%014%0.144CC..Hα-helixtrans-56.6-47.4177.200000112.5I30 C33 T34 D40 V47 N48I30-A44 HydrophobicContact CG1-CB 4.5Å; I30-A44 HydrophobicContact CG2-CB 4.29Å; C33-A44 HydrophobicContact CB-CB 3.55Å; T34-A44 HydrophobicContact CG2-CB 3.72Å; D40-A44 WeakPolarHBondContact O-CB 3.46Å; D40-A44 PolarHBondContact O-N 3.41Å; A44-V47 PolarHBondContact O-N 3.24Å; A44-N48 PolarHBondContact O-N 3.49Å; A44-N48 VanDerWaalsContact O-N 3.08Å
45A95.9Very high93.2Very high0 Ų023 Ų230%014%0.139CC..Hα-helixtrans-63.7-44.3175.600000112.1N41 L43 V47 N48 L49 I297 I451 Y466N41-A45 VanDerWaalsContact O-CB 3.32Å; N41-A45 WeakPolarHBondContact O-CB 3.38Å; N41-A45 PolarHBondContact O-N 3.3Å; L43-A45 PolarHBondContact O-N 3.48Å; A45-V47 PolarHBondContact O-N 3.15Å; A45-N48 PolarHBondContact O-N 3.3Å; A45-L49 WeakPolarHBondContact O-CG 3.49Å; A45-L49 PolarHBondContact O-N 3.46Å; A45-I297 HydrophobicContact CB-CD1 4.25Å; A45-I451 HydrophobicContact CB-CD1 4.22Å; A45-Y466 HydrophobicContact CB-CE1 3.99Å; A45-Y466 WeakPolarHBondContact CB-OH 3.39Å
46T96.4Very high93.4Very high18 Ų1823.4 Ų23.411%0.1114%0.141CC..Hα-helixtrans-58.5-47.7177.7-59.90000111.1V42 L43 N48 L49 C50 A448 Q452V42-T46 VanDerWaalsContact O-CB 3.3Å; V42-T46 WeakPolarHBondContact O-CB 3.46Å; V42-T46 PolarHBondContact O-N 2.87Å; V42-T46 PolarHBondContact O-OG1 2.94Å; L43-T46 WeakPolarHBondContact O-CB 3.36Å; L43-T46 PolarHBondContact O-N 3.33Å; T46-N48 PolarHBondContact O-N 3.42Å; T46-L49 PolarHBondContact O-N 3.29Å; T46-C50 WeakPolarHBondContact O-CB 3.23Å; T46-C50 PolarHBondContact O-N 3.45Å; T46-C50 PolarHBondContact O-SG 3.48Å; T46-A448 HydrophobicContact CG2-CB 4.08Å; T46-Q452 HydrophobicContact CG2-CG 3.97Å; T46-Q452 PolarHBondContact OG1-NE2 3.29Å
47V96.8Very high93.8Very high11 Ų1121.1 Ų21.17%0.06713%0.133CC..Hα-helixtrans-60.9-44.5178.3173.20000111M29 L43 A44 A45 L49 C50 F51 F120 Y121 L124M29-V47 HydrophobicContact SD-CG1 4.22Å; L43-V47 HydrophobicContact CD1-CG2 4.23Å; L43-V47 HydrophobicContact CG-CG2 4.43Å; L43-V47 VanDerWaalsContact O-CG2 3.3Å; L43-V47 WeakPolarHBondContact O-CG2 3.41Å; L43-V47 PolarHBondContact O-N 3Å; A44-V47 PolarHBondContact O-N 3.24Å; A45-V47 PolarHBondContact O-N 3.15Å; V47-L49 PolarHBondContact O-N 3.49Å; V47-C50 PolarHBondContact O-N 3.01Å; V47-F51 WeakPolarHBondContact O-CB 3.47Å; V47-F51 PolarHBondContact O-N 3.16Å; V47-F120 HydrophobicContact CG1-CE1 4.03Å; V47-F120 HydrophobicContact CG1-CZ 4.37Å; V47-Y121 HydrophobicContact CG1-CE1 4.19Å; V47-Y121 HydrophobicContact CG2-CE1 3.72Å; V47-L124 HydrophobicContact CG1-CD1 3.65Å
48N97.2Very high94.1Very high0 Ų020.4 Ų20.40%013%0.129CC..Hα-helixtrans-62.1-45.5178.3-159.123000111.9V26 M29 I30 A44 A45 T46 F51 I52 P292V26-N48 PolarHBondContact O-ND2 3.46Å; M29-N48 HydrophobicContact CB-CB 4.06Å; M29-N48 VanDerWaalsContact CB-OD1 3.3Å; M29-N48 WeakPolarHBondContact CB-OD1 3.28Å; M29-N48 HydrophobicContact CG-CB 3.72Å; I30-N48 HydrophobicContact CG1-CB 4.2Å; A44-N48 PolarHBondContact O-N 3.49Å; A44-N48 VanDerWaalsContact O-N 3.08Å; A45-N48 PolarHBondContact O-N 3.3Å; T46-N48 PolarHBondContact O-N 3.42Å; N48-F51 PolarHBondContact O-N 3.07Å; N48-I52 VanDerWaalsContact O-CG1 3.27Å; N48-I52 WeakPolarHBondContact O-CG1 3.46Å; N48-I52 PolarHBondContact O-N 3.4Å; N48-P292 PolarHBondContact ND2-O 3.27Å
49L97.2Very high94.3Very high0 Ų018.7 Ų18.70%011%0.109CC..Hα-helixtrans-65.4-39.2177.7-68.2-171.2000112.7A45 T46 V47 I52 G53 T289 P292 A448 I451A45-L49 WeakPolarHBondContact O-CG 3.49Å; A45-L49 PolarHBondContact O-N 3.46Å; T46-L49 PolarHBondContact O-N 3.29Å; V47-L49 PolarHBondContact O-N 3.49Å; L49-I52 PolarHBondContact O-N 3.34Å; L49-G53 PolarHBondContact O-N 3Å; L49-T289 HydrophobicContact CD2-CG2 4.2Å; L49-P292 HydrophobicContact CD2-CG 4.44Å; L49-A448 HydrophobicContact CB-CB 3.95Å; L49-A448 HydrophobicContact CD1-CB 4.45Å; L49-I451 HydrophobicContact CD1-CD1 3.7Å
50C97.6Very high94.2Very high50 Ų5018.1 Ų18.134%0.33811%0.107SC..Hα-helixtrans-62.3-43173.4-75.90000111.7T46 V47 G53 A54 L445T46-C50 WeakPolarHBondContact O-CB 3.23Å; T46-C50 PolarHBondContact O-N 3.45Å; T46-C50 PolarHBondContact O-SG 3.48Å; V47-C50 PolarHBondContact O-N 3.01Å; C50-G53 PolarHBondContact O-N 2.96Å; C50-A54 WeakPolarHBondContact O-CB 3.4Å; C50-A54 PolarHBondContact O-N 3.19Å; C50-L445 HydrophobicContact CB-CD2 4.5Å
51F97.4Very high94.1Very high8 Ų819.5 Ų19.54%0.03511%0.114CC..Hα-helixtrans-63.2-46.4176.2175.5-102.5000112.3F22 I25 V26 M29 V47 N48 S55 L124 A127 A128 I131F22-F51 HydrophobicContact CD2-CE1 4.02Å; F22-F51 HydrophobicContact CD2-CZ 4.47Å; F22-F51 HydrophobicContact CE2-CE1 4.12Å; I25-F51 HydrophobicContact CB-CE1 4.08Å; I25-F51 HydrophobicContact CB-CZ 4.28Å; I25-F51 HydrophobicContact CD1-CZ 3.98Å; I25-F51 HydrophobicContact CG2-CD1 4.1Å; I25-F51 HydrophobicContact CG2-CE1 3.61Å; I25-F51 HydrophobicContact CG2-CE2 4.47Å; I25-F51 HydrophobicContact CG2-CZ 3.82Å; V26-F51 HydrophobicContact CG2-CD1 3.97Å; V26-F51 HydrophobicContact CG2-CE1 3.93Å; M29-F51 HydrophobicContact CE-CB 4.01Å; M29-F51 HydrophobicContact CE-CD1 4Å; M29-F51 HydrophobicContact CE-CG 3.92Å; V47-F51 WeakPolarHBondContact O-CB 3.47Å; V47-F51 PolarHBondContact O-N 3.16Å; N48-F51 PolarHBondContact O-N 3.07Å; F51-S55 VanDerWaalsContact O-CB 3.27Å; F51-S55 WeakPolarHBondContact O-CB 3.04Å; F51-S55 PolarHBondContact O-N 3.22Å; F51-S55 PolarHBondContact O-OG 3.33Å; F51-L124 HydrophobicContact CD2-CB 4.17Å; F51-L124 HydrophobicContact CD2-CD2 3.94Å; F51-L124 HydrophobicContact CE2-CD2 4.18Å; F51-L124 HydrophobicContact CG-CD2 4.45Å; F51-A127 HydrophobicContact CE2-CB 4.18Å; F51-A128 HydrophobicContact CD2-CB 4.09Å; F51-A128 HydrophobicContact CE2-CB 4Å; F51-I131 HydrophobicContact CZ-CD1 4Å
52I96.4Very high93.9Very high18 Ų1819.9 Ų19.99%0.09212%0.116CC..Hα-helixtrans-62.1-45.8176.5-64.9164.7000110.5F22 V26 N48 L49 S55 T56 P292F22-I52 HydrophobicContact CZ-CG1 4.34Å; F22-I52 HydrophobicContact CZ-CG2 4.34Å; V26-I52 HydrophobicContact CG1-CD1 3.81Å; V26-I52 HydrophobicContact CG1-CG1 4.22Å; V26-I52 HydrophobicContact CG2-CD1 4.2Å; V26-I52 HydrophobicContact CG2-CG1 3.65Å; N48-I52 VanDerWaalsContact O-CG1 3.27Å; N48-I52 WeakPolarHBondContact O-CG1 3.46Å; N48-I52 PolarHBondContact O-N 3.4Å; L49-I52 PolarHBondContact O-N 3.34Å; I52-S55 PolarHBondContact O-N 3.04Å; I52-T56 WeakPolarHBondContact O-CB 3.26Å; I52-T56 PolarHBondContact O-N 2.88Å; I52-T56 PolarHBondContact O-OG1 3.45Å; I52-P292 HydrophobicContact CD1-CB 3.83Å; I52-P292 HydrophobicContact CD1-CG 3.67Å
53G95.5Very high93.5Very high0 Ų020.3 Ų20.30%012%0.121CC..Hα-helixtrans-60.5-52.2177.900000111.9L49 C50 S55 T56 L57L49-G53 PolarHBondContact O-N 3Å; C50-G53 PolarHBondContact O-N 2.96Å; G53-S55 PolarHBondContact O-N 2.86Å; G53-T56 PolarHBondContact O-N 3.42Å; G53-T56 VanDerWaalsContact O-N 3.1Å; G53-L57 VanDerWaalsContact O-CG 3.31Å; G53-L57 WeakPolarHBondContact O-CG 3.45Å; G53-L57 PolarHBondContact O-N 3.07Å
54A95.6Very high93Very high27 Ų2721.5 Ų21.522%0.22312%0.121CC..Hα-helixtrans-58.1-46.6177.100000111.7C50 T56 L57 T58 A128C50-A54 WeakPolarHBondContact O-CB 3.4Å; C50-A54 PolarHBondContact O-N 3.19Å; A54-T56 PolarHBondContact O-N 3.16Å; A54-L57 PolarHBondContact O-N 3.49Å; A54-T58 VanDerWaalsContact O-CB 3.27Å; A54-T58 WeakPolarHBondContact O-CB 3.5Å; A54-T58 PolarHBondContact O-N 3.47Å; A54-T58 PolarHBondContact O-OG1 3.17Å; A54-A128 HydrophobicContact CB-CB 4.07Å
55S93.5Very high92.5Very high0 Ų024.7 Ų24.70%014%0.135CC..Hα-helixtrans-63-26.5178.1-60.10000113.1F51 I52 G53 P59 A128F51-S55 VanDerWaalsContact O-CB 3.27Å; F51-S55 WeakPolarHBondContact O-CB 3.04Å; F51-S55 PolarHBondContact O-N 3.22Å; F51-S55 PolarHBondContact O-OG 3.33Å; I52-S55 PolarHBondContact O-N 3.04Å; G53-S55 PolarHBondContact O-N 2.86Å; S55-P59 WeakPolarHBondContact O-CD 3.3Å; S55-A128 WeakPolarHBondContact OG-CB 3.46Å
56T90.9Very high91.9Very high29 Ų2924.8 Ų24.818%0.17814%0.137CC..Hα-helixtrans-86-34.1177.7-55.10000112.6I52 G53 A54 P59 T437I52-T56 WeakPolarHBondContact O-CB 3.26Å; I52-T56 PolarHBondContact O-N 2.88Å; I52-T56 PolarHBondContact O-OG1 3.45Å; G53-T56 PolarHBondContact O-N 3.42Å; G53-T56 VanDerWaalsContact O-N 3.1Å; A54-T56 PolarHBondContact O-N 3.16Å; T56-P59 WeakPolarHBondContact O-CD 3.29Å; T56-T437 HydrophobicContact CG2-CG2 4.08Å; T56-T437 WeakPolarHBondContact O-CG2 3.25Å
57L91.4Very high91.1Very high31 Ų3129.3 Ų29.316%0.16216%0.157CC..Hα-helixtrans-76.8-39178-70.1174.2000112.5G53 A54 P59 V60 L61 L438 L445G53-L57 VanDerWaalsContact O-CG 3.31Å; G53-L57 WeakPolarHBondContact O-CG 3.45Å; G53-L57 PolarHBondContact O-N 3.07Å; A54-L57 PolarHBondContact O-N 3.49Å; L57-P59 VanDerWaalsContact C-CD 3.45Å; L57-V60 PolarHBondContact O-N 3.04Å; L57-V60 VanDerWaalsContact O-N 3.08Å; L57-L61 PolarHBondContact O-N 3.18Å; L57-L438 HydrophobicContact CD2-CB 4.44Å; L57-L438 HydrophobicContact CD2-CD2 3.56Å; L57-L445 HydrophobicContact CD1-CD1 3.54Å; L57-L445 HydrophobicContact CD1-CG 4.34Å
58T92.3Very high90.2Very high9 Ų932.3 Ų32.36%0.05518%0.175CC..Hα-helixtrans-58.7-36.7-171.6-58.20000114.5A54 V60 L61 I62 L129A54-T58 VanDerWaalsContact O-CB 3.27Å; A54-T58 WeakPolarHBondContact O-CB 3.5Å; A54-T58 PolarHBondContact O-N 3.47Å; A54-T58 PolarHBondContact O-OG1 3.17Å; T58-V60 PolarHBondContact O-N 2.78Å; T58-V60 VanDerWaalsContact O-N 3.16Å; T58-L61 PolarHBondContact O-N 2.82Å; T58-L61 VanDerWaalsContact O-N 3.08Å; T58-I62 HydrophobicContact CG2-CB 4.35Å; T58-I62 HydrophobicContact CG2-CD1 3.21Å; T58-I62 HydrophobicContact CG2-CG1 3.46Å; T58-I62 VanDerWaalsContact CG2-CG1 3.46Å; T58-I62 PolarHBondContact O-N 3.34Å; T58-L129 HydrophobicContact CG2-CD2 3.68Å
59P90.1Very high89.2Confident20 Ų2036.3 Ų36.313%0.1320%0.202CC..Hα-helixtrans-53.3-36.9175.2-2527.8000114.3S55 T56 L57 G63 G132 R135 A136S55-P59 WeakPolarHBondContact O-CD 3.3Å; T56-P59 WeakPolarHBondContact O-CD 3.29Å; L57-P59 VanDerWaalsContact C-CD 3.45Å; P59-G63 WeakPolarHBondContact O-CA 3.46Å; P59-G63 PolarHBondContact O-N 3.49Å; P59-G132 VanDerWaalsContact CA-O 3.3Å; P59-G132 WeakPolarHBondContact CA-O 3.21Å; P59-G132 WeakPolarHBondContact CB-O 3.43Å; P59-G132 WeakPolarHBondContact CG-O 3.41Å; P59-R135 HydrophobicContact CG-CB 4.31Å; P59-A136 HydrophobicContact CB-CB 4.18Å; P59-A136 WeakPolarHBondContact O-CB 3.28Å
60V88.1Confident88.1Confident8 Ų840.3 Ų40.35%0.04822%0.223CC..Hα-helixtrans-70.6-44.3178.8-1760000110.4L57 T58 W64 L220 H434 T437 L438L57-V60 PolarHBondContact O-N 3.04Å; L57-V60 VanDerWaalsContact O-N 3.08Å; T58-V60 PolarHBondContact O-N 2.78Å; T58-V60 VanDerWaalsContact O-N 3.16Å; V60-W64 WeakPolarHBondContact O-CB 3.39Å; V60-W64 PolarHBondContact O-N 3.41Å; V60-W64 VanDerWaalsContact O-N 3.1Å; V60-L220 HydrophobicContact CG1-CD1 3.91Å; V60-H434 HydrophobicContact CG1-CB 3.92Å; V60-H434 HydrophobicContact CG2-CB 4.31Å; V60-T437 HydrophobicContact CG2-CG2 4.11Å; V60-L438 HydrophobicContact CB-CD2 4.1Å; V60-L438 HydrophobicContact CB-CG 4.41Å; V60-L438 HydrophobicContact CG1-CD1 4.23Å; V60-L438 HydrophobicContact CG1-CD2 4.16Å; V60-L438 HydrophobicContact CG1-CG 4.16Å; V60-L438 HydrophobicContact CG2-CD2 4.24Å; V60-L438 HydrophobicContact CG2-CG 4.24Å
61L88.8Confident87.2Confident105 Ų10539.6 Ų39.655%0.5522%0.224SC..Hα-helixtrans-67.7-49-179-61.2176.8000112.1L57 T58 W64 F65L57-L61 PolarHBondContact O-N 3.18Å; T58-L61 PolarHBondContact O-N 2.82Å; T58-L61 VanDerWaalsContact O-N 3.08Å; L61-W64 PolarHBondContact O-N 2.79Å; L61-F65 WeakPolarHBondContact O-CB 3.08Å; L61-F65 PolarHBondContact O-N 3.46Å
62I88.9Confident86.3Confident20 Ų2041 Ų4110%0.10323%0.229CC..Hα-helixtrans-71.1-37.2179.6-67.4-175.7000111T58 W64 F65 A66 V75 L129 I137T58-I62 HydrophobicContact CG2-CB 4.35Å; T58-I62 HydrophobicContact CG2-CD1 3.21Å; T58-I62 HydrophobicContact CG2-CG1 3.46Å; T58-I62 VanDerWaalsContact CG2-CG1 3.46Å; T58-I62 PolarHBondContact O-N 3.34Å; I62-W64 VanDerWaalsContact C-N 3.31Å; I62-W64 PolarHBondContact O-N 3.33Å; I62-F65 PolarHBondContact O-N 3.01Å; I62-A66 VanDerWaalsContact O-CB 3.28Å; I62-A66 WeakPolarHBondContact O-CB 3.16Å; I62-A66 PolarHBondContact O-N 3.19Å; I62-V75 HydrophobicContact CG2-CG1 3.42Å; I62-V75 VanDerWaalsContact CG2-CG1 3.42Å; I62-L129 HydrophobicContact CD1-CB 4.49Å; I62-L129 HydrophobicContact CD1-CD2 4.41Å; I62-L129 WeakPolarHBondContact CD1-O 3.23Å; I62-I137 HydrophobicContact CG2-CD1 4.45Å
63G83.8Confident85.7Confident14 Ų1443 Ų4314%0.14424%0.242CC..Hα-helixtrans-57-46.7173.900000111.5P59 A66 E67P59-G63 WeakPolarHBondContact O-CA 3.46Å; P59-G63 PolarHBondContact O-N 3.49Å; G63-A66 PolarHBondContact O-N 3.37Å; G63-E67 WeakPolarHBondContact O-CG 3.47Å; G63-E67 PolarHBondContact O-N 2.89Å
64W83.3Confident85.3Confident83 Ų8350 Ų5031%0.31427%0.273SS..Hα-helixtrans-61.1-48.8172.8168.178.2000112.4V60 L61 I62 A66 E67 T68 L221V60-W64 WeakPolarHBondContact O-CB 3.39Å; V60-W64 PolarHBondContact O-N 3.41Å; V60-W64 VanDerWaalsContact O-N 3.1Å; L61-W64 PolarHBondContact O-N 2.79Å; I62-W64 VanDerWaalsContact C-N 3.31Å; I62-W64 PolarHBondContact O-N 3.33Å; W64-A66 VanDerWaalsContact C-N 3.26Å; W64-A66 PolarHBondContact O-N 3.32Å; W64-E67 WeakPolarHBondContact O-CB 3.43Å; W64-E67 PolarHBondContact O-N 3.38Å; W64-T68 HydrophobicContact CZ2-CG2 4.37Å; W64-T68 PolarHBondContact O-N 3.31Å; W64-T68 VanDerWaalsContact O-N 3.11Å; W64-T68 PolarHBondContact O-OG1 3.41Å; W64-L221 HydrophobicContact CZ2-CD2 4.43Å
65F85.3Confident85Confident67 Ų6748.9 Ų48.929%0.29426%0.263SS..Hα-helixtrans-59.2-36.6179.5-179.9-107.7000113L61 I62 E67 C69 L70 V75L61-F65 WeakPolarHBondContact O-CB 3.08Å; L61-F65 PolarHBondContact O-N 3.46Å; I62-F65 PolarHBondContact O-N 3.01Å; F65-E67 VanDerWaalsContact C-N 3.28Å; F65-E67 PolarHBondContact O-N 2.83Å; F65-C69 HydrophobicContact CD2-CB 4.07Å; F65-C69 HydrophobicContact CE2-CB 3.86Å; F65-C69 HydrophobicContact CZ-CB 4.36Å; F65-C69 PolarHBondContact O-N 2.92Å; F65-L70 HydrophobicContact CE1-CB 4.5Å; F65-L70 HydrophobicContact CE1-CD1 3.49Å; F65-L70 VanDerWaalsContact CE1-CD1 3.49Å; F65-L70 HydrophobicContact CE2-CD1 4.1Å; F65-L70 HydrophobicContact CZ-CD1 3.17Å; F65-V75 HydrophobicContact CD1-CG1 4.38Å; F65-V75 HydrophobicContact CD1-CG2 3.98Å; F65-V75 HydrophobicContact CE1-CG2 4.12Å
66A83.4Confident84.8Confident3 Ų348.9 Ų48.93%0.02526%0.263CS..Iπ-helixtrans-67.9-26.517600000113.3I62 G63 W64 G71 R72 V75 I137I62-A66 VanDerWaalsContact O-CB 3.28Å; I62-A66 WeakPolarHBondContact O-CB 3.16Å; I62-A66 PolarHBondContact O-N 3.19Å; G63-A66 PolarHBondContact O-N 3.37Å; W64-A66 VanDerWaalsContact C-N 3.26Å; W64-A66 PolarHBondContact O-N 3.32Å; A66-G71 CarbonylContact O-C 3.56Å; A66-G71 VanDerWaalsContact O-CA 3.31Å; A66-G71 WeakPolarHBondContact O-CA 3.41Å; A66-G71 PolarHBondContact O-N 2.96Å; A66-R72 HydrophobicContact CB-CG 4.06Å; A66-V75 HydrophobicContact CB-CB 4.03Å; A66-V75 HydrophobicContact CB-CG1 4.12Å; A66-V75 HydrophobicContact CB-CG2 4.05Å; A66-I137 HydrophobicContact CB-CD1 4.12Å; A66-I137 HydrophobicContact CB-CG1 4.3Å
67E79.3Confident84.7Confident113 Ų11350.9 Ų50.953%0.52827%0.268SS..Iπ-helixtrans-84.6-31.7177.7-70.7-177.1166.400113.2G63 W64 F65 R72G63-E67 WeakPolarHBondContact O-CG 3.47Å; G63-E67 PolarHBondContact O-N 2.89Å; W64-E67 WeakPolarHBondContact O-CB 3.43Å; W64-E67 PolarHBondContact O-N 3.38Å; F65-E67 VanDerWaalsContact C-N 3.28Å; F65-E67 PolarHBondContact O-N 2.83Å; E67-R72 IonicContact OE1-CZ 3.77Å; E67-R72 IonicContact OE1-NH2 2.68Å; E67-R72 PolarHBondContact OE1-NH2 3.1Å
68T78.1Confident84.8Confident74 Ų7453.4 Ų53.445%0.45428%0.281SS..Iπ-helixtrans-96-37.3-173.453.20000114.4W64W64-T68 HydrophobicContact CZ2-CG2 4.37Å; W64-T68 PolarHBondContact O-N 3.31Å; W64-T68 VanDerWaalsContact O-N 3.11Å; W64-T68 PolarHBondContact O-OG1 3.41Å
69C75.9Confident84.9Confident84 Ų8453.1 Ų53.157%0.56828%0.279SS*.Iπ-helixtrans-113-70.2-165.6-62.30000113.9F65F65-C69 HydrophobicContact CD2-CB 4.07Å; F65-C69 HydrophobicContact CE2-CB 3.86Å; F65-C69 HydrophobicContact CZ-CB 4.36Å; F65-C69 PolarHBondContact O-N 2.92Å
70L74.7Confident85Confident83 Ų8352.2 Ų52.244%0.43527%0.274SS..Iπ-helixtrans-103-9.9-162.2-91.6117.2000115.4F65 K74 V75F65-L70 HydrophobicContact CE1-CB 4.5Å; F65-L70 HydrophobicContact CE1-CD1 3.49Å; F65-L70 VanDerWaalsContact CE1-CD1 3.49Å; F65-L70 HydrophobicContact CE2-CD1 4.1Å; F65-L70 HydrophobicContact CZ-CD1 3.17Å; L70-K74 WeakPolarHBondContact O-CD 3.44Å; L70-V75 HydrophobicContact CB-CG2 3.71Å
71G78.4Confident85.3Confident36 Ų3657.7 Ų57.737%0.37130%0.297SS..  trans78.1145.4-173.500000113.3A66 T73 K74 V75A66-G71 CarbonylContact O-C 3.56Å; A66-G71 VanDerWaalsContact O-CA 3.31Å; A66-G71 WeakPolarHBondContact O-CA 3.41Å; A66-G71 PolarHBondContact O-N 2.96Å; G71-T73 PolarHBondContact O-N 2.82Å; G71-K74 PolarHBondContact O-N 3.1Å; G71-V75 WeakPolarHBondContact O-CG2 3.46Å; G71-V75 PolarHBondContact O-N 3.14Å
72R79.4Confident85.6Confident38 Ų3854.9 Ų54.914%0.14328%0.282CS..Hα-helixtrans-57.9-42-169.1-66.7179.4175.2-144.92.5114.8A66 E67 V75 L76 I137A66-R72 HydrophobicContact CB-CG 4.06Å; E67-R72 IonicContact OE1-CZ 3.77Å; E67-R72 IonicContact OE1-NH2 2.68Å; E67-R72 PolarHBondContact OE1-NH2 3.1Å; R72-V75 PolarHBondContact O-N 3.16Å; R72-L76 WeakPolarHBondContact O-CB 3.41Å; R72-L76 PolarHBondContact O-N 3.14Å; R72-I137 HydrophobicContact CB-CG2 4.06Å
73T82.4Confident85.8Confident58 Ų5854 Ų5436%0.35628%0.278SS..Hα-helixtrans-67.6-40-176.9-45.60000112.4G71 L76 Y77G71-T73 PolarHBondContact O-N 2.82Å; T73-L76 PolarHBondContact O-N 3.44Å; T73-Y77 HydrophobicContact CG2-CD2 4.27Å; T73-Y77 HydrophobicContact CG2-CE2 3.9Å; T73-Y77 WeakPolarHBondContact O-CD2 3.43Å; T73-Y77 PolarHBondContact O-N 3.43Å
74K86.9Confident86.3Confident149 Ų14956.1 Ų56.165%0.64828%0.283SS*.Hα-helixtrans-67.7-43.9177.8-65.1-173.1-174.8175.10111L70 G71 L76 Y77 L78L70-K74 WeakPolarHBondContact O-CD 3.44Å; G71-K74 PolarHBondContact O-N 3.1Å; K74-L76 VanDerWaalsContact C-N 3.31Å; K74-L76 PolarHBondContact O-N 2.83Å; K74-Y77 PolarHBondContact O-N 3.47Å; K74-L78 PolarHBondContact O-N 3.39Å
75V90.3Very high86.8Confident3 Ų353.9 Ų53.92%0.01828%0.278CS..Hα-helixtrans-64.2-37.5177.61800000111.3I62 F65 A66 L70 G71 R72 Y77 L78 C79 I137I62-V75 HydrophobicContact CG2-CG1 3.42Å; I62-V75 VanDerWaalsContact CG2-CG1 3.42Å; F65-V75 HydrophobicContact CD1-CG1 4.38Å; F65-V75 HydrophobicContact CD1-CG2 3.98Å; F65-V75 HydrophobicContact CE1-CG2 4.12Å; A66-V75 HydrophobicContact CB-CB 4.03Å; A66-V75 HydrophobicContact CB-CG1 4.12Å; A66-V75 HydrophobicContact CB-CG2 4.05Å; L70-V75 HydrophobicContact CB-CG2 3.71Å; G71-V75 WeakPolarHBondContact O-CG2 3.46Å; G71-V75 PolarHBondContact O-N 3.14Å; R72-V75 PolarHBondContact O-N 3.16Å; V75-Y77 PolarHBondContact O-N 2.92Å; V75-L78 PolarHBondContact O-N 3.02Å; V75-C79 WeakPolarHBondContact O-CB 3.22Å; V75-C79 PolarHBondContact O-N 3.05Å; V75-C79 PolarHBondContact O-SG 3.04Å; V75-I137 HydrophobicContact CB-CD1 3.79Å; V75-I137 HydrophobicContact CG1-CD1 3.6Å
76L89.1Confident87.2Confident0 Ų050.7 Ų50.70%026%0.264CS..Hα-helixtrans-58-48.2175.1179.565.8000111.8R72 T73 K74 C79 A80 I134 I137 M141 I203 L210R72-L76 WeakPolarHBondContact O-CB 3.41Å; R72-L76 PolarHBondContact O-N 3.14Å; T73-L76 PolarHBondContact O-N 3.44Å; K74-L76 VanDerWaalsContact C-N 3.31Å; K74-L76 PolarHBondContact O-N 2.83Å; L76-C79 PolarHBondContact O-N 3.26Å; L76-A80 VanDerWaalsContact O-CB 3.28Å; L76-A80 WeakPolarHBondContact O-CB 3.38Å; L76-A80 PolarHBondContact O-N 3.16Å; L76-I134 HydrophobicContact CD1-CG1 4.34Å; L76-I137 HydrophobicContact CB-CD1 4.24Å; L76-I137 HydrophobicContact CB-CG2 4.04Å; L76-I137 HydrophobicContact CD1-CB 4.38Å; L76-I137 HydrophobicContact CD1-CG2 4.31Å; L76-M141 HydrophobicContact CD2-CE 4.12Å; L76-I203 HydrophobicContact CD2-CG2 4.14Å; L76-I203 HydrophobicContact CG-CG2 4.48Å; L76-L210 HydrophobicContact CD2-CD1 4.09Å
77Y89.9Confident87.6Confident71 Ų7150.6 Ų50.628%0.27826%0.264SS..Hα-helixtrans-66-39.2178.7-77.1-65000112.8T73 K74 V75 C79 A80 F81 I203 R207T73-Y77 HydrophobicContact CG2-CD2 4.27Å; T73-Y77 HydrophobicContact CG2-CE2 3.9Å; T73-Y77 WeakPolarHBondContact O-CD2 3.43Å; T73-Y77 PolarHBondContact O-N 3.43Å; K74-Y77 PolarHBondContact O-N 3.47Å; V75-Y77 PolarHBondContact O-N 2.92Å; Y77-C79 VanDerWaalsContact C-N 3.35Å; Y77-A80 PolarHBondContact O-N 2.94Å; Y77-F81 WeakPolarHBondContact O-CB 3.3Å; Y77-F81 PolarHBondContact O-N 3.08Å; Y77-I203 HydrophobicContact CD1-CG2 4.5Å; Y77-I203 HydrophobicContact CE1-CG2 3.92Å; Y77-R207 WeakPolarHBondContact OH-CB 3.31Å; Y77-R207 WeakPolarHBondContact OH-CD 3.32Å; Y77-R207 WeakPolarHBondContact OH-CG 3.35Å
78L92.9Very high88.2Confident84 Ų8446.5 Ų46.544%0.4425%0.249SC..Hα-helixtrans-60.2-45.9174178.963.7000111.1K74 V75 F81 L82K74-L78 PolarHBondContact O-N 3.39Å; V75-L78 PolarHBondContact O-N 3.02Å; L78-F81 PolarHBondContact O-N 3.15Å; L78-L82 HydrophobicContact CG-CD1 4.33Å; L78-L82 WeakPolarHBondContact O-CG 3.45Å; L78-L82 PolarHBondContact O-N 2.87Å
79C93.7Very high88.8Confident3 Ų345 Ų452%0.0224%0.237CC..Hα-helixtrans-67.6-38.3178.8-61.80000111.8V75 L76 Y77 F81 L82 H83 G130V75-C79 WeakPolarHBondContact O-CB 3.22Å; V75-C79 PolarHBondContact O-N 3.05Å; V75-C79 PolarHBondContact O-SG 3.04Å; L76-C79 PolarHBondContact O-N 3.26Å; Y77-C79 VanDerWaalsContact C-N 3.35Å; C79-F81 VanDerWaalsContact C-N 3.33Å; C79-F81 PolarHBondContact O-N 3.17Å; C79-L82 PolarHBondContact O-N 3.07Å; C79-H83 WeakPolarHBondContact O-CB 3.33Å; C79-H83 PolarHBondContact O-N 3.5Å; C79-G130 WeakPolarHBondContact O-CA 3.3Å
80A92.5Very high89.3Confident1 Ų141.5 Ų41.51%0.00821%0.213CC..Hα-helixtrans-63-41175.200000111.6L76 Y77 H83 F84 L200 I203L76-A80 VanDerWaalsContact O-CB 3.28Å; L76-A80 WeakPolarHBondContact O-CB 3.38Å; L76-A80 PolarHBondContact O-N 3.16Å; Y77-A80 PolarHBondContact O-N 2.94Å; A80-H83 PolarHBondContact O-N 3.32Å; A80-F84 PolarHBondContact O-N 3.44Å; A80-L200 HydrophobicContact CB-CD2 3.61Å; A80-I203 HydrophobicContact CB-CD1 4.04Å
81F93.8Very high89.9Confident123 Ų12337.9 Ų37.954%0.53919%0.194SC..Hα-helixtrans-63.7-46.6172.3176.7-102.8000112.1Y77 L78 C79 H83 F84 V85Y77-F81 WeakPolarHBondContact O-CB 3.3Å; Y77-F81 PolarHBondContact O-N 3.08Å; L78-F81 PolarHBondContact O-N 3.15Å; C79-F81 VanDerWaalsContact C-N 3.33Å; C79-F81 PolarHBondContact O-N 3.17Å; F81-H83 VanDerWaalsContact C-N 3.28Å; F81-H83 PolarHBondContact O-N 3.31Å; F81-F84 WeakPolarHBondContact O-CB 3.06Å; F81-F84 PolarHBondContact O-N 2.73Å; F81-V85 HydrophobicContact CD1-CG2 4.24Å; F81-V85 HydrophobicContact CD2-CG2 4.28Å; F81-V85 HydrophobicContact CE1-CG2 3.77Å; F81-V85 HydrophobicContact CE2-CG2 3.82Å; F81-V85 HydrophobicContact CG-CG2 4.48Å; F81-V85 HydrophobicContact CZ-CG2 3.55Å; F81-V85 WeakPolarHBondContact O-CG2 3.43Å; F81-V85 PolarHBondContact O-N 3.06Å
82L95.6Very high90.2Very high46 Ų4640 Ų4024%0.24120%0.2CC..Hα-helixtrans-60.2-38.5175.7-72173.4000112.1L78 C79 G86 A126 L129L78-L82 HydrophobicContact CG-CD1 4.33Å; L78-L82 WeakPolarHBondContact O-CG 3.45Å; L78-L82 PolarHBondContact O-N 2.87Å; C79-L82 PolarHBondContact O-N 3.07Å; L82-G86 PolarHBondContact O-N 2.93Å; L82-A126 CarbonylContact C-O 3.46Å; L82-A126 HydrophobicContact CD2-CB 4.48Å; L82-A126 CarbonylContact O-C 3.54Å; L82-L129 HydrophobicContact CD1-CB 4.19Å; L82-L129 HydrophobicContact CD1-CD1 4.49Å
83H94Very high90.5Very high2 Ų238.3 Ų38.31%0.00919%0.194CC..Hα-helixtrans-62.4-46.3175.3-163170.7000111T21 C79 A80 F81 G86 T87 I131 I134 V196T21-H83 WeakPolarHBondContact CG2-NE2 3.25Å; C79-H83 WeakPolarHBondContact O-CB 3.33Å; C79-H83 PolarHBondContact O-N 3.5Å; A80-H83 PolarHBondContact O-N 3.32Å; F81-H83 VanDerWaalsContact C-N 3.28Å; F81-H83 PolarHBondContact O-N 3.31Å; H83-G86 PolarHBondContact O-N 2.75Å; H83-T87 WeakPolarHBondContact O-CB 3.03Å; H83-T87 WeakPolarHBondContact O-CG2 3.48Å; H83-T87 PolarHBondContact O-N 2.82Å; H83-T87 PolarHBondContact O-OG1 3.1Å; H83-I131 WeakPolarHBondContact NE2-CG1 3.21Å; H83-I134 HydrophobicContact CB-CD1 4.16Å; H83-I134 VanDerWaalsContact ND1-CD1 3.3Å; H83-I134 WeakPolarHBondContact ND1-CD1 3.47Å; H83-V196 HydrophobicContact CB-CG1 4.44Å; H83-V196 WeakPolarHBondContact NE2-CG2 3.49Å
84F94Very high90.4Very high58 Ų5836 Ų3625%0.25418%0.181SC..Hα-helixtrans-61.7-49.6176.9175.7-95.4000112.2A80 F81 G86 T87 A88 F193 V196 L197 L200A80-F84 PolarHBondContact O-N 3.44Å; F81-F84 WeakPolarHBondContact O-CB 3.06Å; F81-F84 PolarHBondContact O-N 2.73Å; F84-G86 PolarHBondContact O-N 2.73Å; F84-T87 PolarHBondContact O-N 3.45Å; F84-T87 PolarHBondContact O-OG1 3.17Å; F84-A88 WeakPolarHBondContact O-CB 3.34Å; F84-A88 PolarHBondContact O-N 3.01Å; F84-F193 AromaticContact CD2-CE2 3.96Å; F84-F193 HydrophobicContact CD2-CE2 3.96Å; F84-F193 HydrophobicContact CE2-CD2 4.29Å; F84-F193 AromaticContact CE2-CE2 3.3Å; F84-F193 HydrophobicContact CE2-CE2 3.3Å; F84-F193 AromaticContact CE2-CZ 3.65Å; F84-F193 HydrophobicContact CE2-CZ 3.65Å; F84-F193 AromaticContact CZ-CE2 3.67Å; F84-F193 HydrophobicContact CZ-CE2 3.67Å; F84-F193 AromaticContact CZ-CZ 3.93Å; F84-F193 HydrophobicContact CZ-CZ 3.93Å; F84-V196 HydrophobicContact CB-CG1 4.09Å; F84-L197 HydrophobicContact CE2-CD1 4.42Å; F84-L200 HydrophobicContact CB-CD1 3.84Å; F84-L200 HydrophobicContact CD2-CD1 3.64Å; F84-L200 HydrophobicContact CE2-CD1 4.44Å; F84-L200 HydrophobicContact CG-CD1 3.87Å
85V94.3Very high89.6Confident36 Ų3632 Ų3222%0.21816%0.164CC..Hα-helixtrans-60.9-48.3178172.80000110.7F81 T87 A88 M89F81-V85 HydrophobicContact CD1-CG2 4.24Å; F81-V85 HydrophobicContact CD2-CG2 4.28Å; F81-V85 HydrophobicContact CE1-CG2 3.77Å; F81-V85 HydrophobicContact CE2-CG2 3.82Å; F81-V85 HydrophobicContact CG-CG2 4.48Å; F81-V85 HydrophobicContact CZ-CG2 3.55Å; F81-V85 WeakPolarHBondContact O-CG2 3.43Å; F81-V85 PolarHBondContact O-N 3.06Å; V85-T87 VanDerWaalsContact C-N 3.32Å; V85-T87 PolarHBondContact O-N 2.92Å; V85-A88 PolarHBondContact O-N 2.83Å; V85-M89 HydrophobicContact CG1-CE 3.69Å; V85-M89 HydrophobicContact CG1-SD 4.07Å; V85-M89 VanDerWaalsContact O-CG 3.29Å; V85-M89 WeakPolarHBondContact O-CG 2.97Å; V85-M89 PolarHBondContact O-N 3.03Å
86G93.6Very high88.4Confident0 Ų034.2 Ų34.20%018%0.178CC..Hα-helixtrans-61.4-39.7-178.500000113.2L82 H83 F84 G123L82-G86 PolarHBondContact O-N 2.93Å; H83-G86 PolarHBondContact O-N 2.75Å; F84-G86 PolarHBondContact O-N 2.73Å; G86-G123 WeakPolarHBondContact CA-O 3.14Å
87T91.3Very high86.7Confident1 Ų136.7 Ų36.71%0.00619%0.189CC..Hα-helixtrans-79.4-26.4177.652.20000113.7T21 I25 H83 F84 V85 P91 A127 V196T21-T87 HydrophobicContact CG2-CG2 3.5Å; I25-T87 HydrophobicContact CD1-CG2 4.29Å; H83-T87 WeakPolarHBondContact O-CB 3.03Å; H83-T87 WeakPolarHBondContact O-CG2 3.48Å; H83-T87 PolarHBondContact O-N 2.82Å; H83-T87 PolarHBondContact O-OG1 3.1Å; F84-T87 PolarHBondContact O-N 3.45Å; F84-T87 PolarHBondContact O-OG1 3.17Å; V85-T87 VanDerWaalsContact C-N 3.32Å; V85-T87 PolarHBondContact O-N 2.92Å; T87-P91 WeakPolarHBondContact O-CD 3.29Å; T87-A127 HydrophobicContact CG2-CB 4.48Å; T87-V196 HydrophobicContact CG2-CG2 4Å
88A91.3Very high84.7Confident26 Ų2639.9 Ų39.922%0.21521%0.206CC..Hα-helixtrans-69.6-33.7171.900000112.1F84 V85 L90 P91 V92 F193F84-A88 WeakPolarHBondContact O-CB 3.34Å; F84-A88 PolarHBondContact O-N 3.01Å; V85-A88 PolarHBondContact O-N 2.83Å; A88-L90 VanDerWaalsContact C-N 3.33Å; A88-L90 PolarHBondContact O-N 3.43Å; A88-P91 WeakPolarHBondContact O-CD 3.09Å; A88-V92 WeakPolarHBondContact O-CG2 2.78Å; A88-F193 HydrophobicContact CB-CD2 3.88Å; A88-F193 HydrophobicContact CB-CE2 3.73Å
89M91Very high82.5Confident42 Ų4241.9 Ų41.921%0.20722%0.217CC..Hα-helixtrans-65.8-32.5177.6-72.6176.1166.300112.6V85 V92 V93 L119 V122V85-M89 HydrophobicContact CG1-CE 3.69Å; V85-M89 HydrophobicContact CG1-SD 4.07Å; V85-M89 VanDerWaalsContact O-CG 3.29Å; V85-M89 WeakPolarHBondContact O-CG 2.97Å; V85-M89 PolarHBondContact O-N 3.03Å; M89-V92 WeakPolarHBondContact O-CB 3.32Å; M89-V92 PolarHBondContact O-N 3.47Å; M89-V92 VanDerWaalsContact O-N 3.14Å; M89-V93 VanDerWaalsContact O-CG2 3.3Å; M89-V93 WeakPolarHBondContact O-CG2 3.22Å; M89-V93 PolarHBondContact O-N 3.45Å; M89-L119 HydrophobicContact CB-CD1 4.18Å; M89-L119 HydrophobicContact CB-CG 4.24Å; M89-L119 HydrophobicContact CE-CD1 3.81Å; M89-L119 HydrophobicContact CG-CD1 3.69Å; M89-L119 HydrophobicContact CG-CG 4.3Å; M89-L119 HydrophobicContact SD-CD1 3.81Å; M89-V122 HydrophobicContact CE-CG1 4.26Å; M89-V122 HydrophobicContact SD-CG1 4.09Å
90L87.1Confident80.1Confident11 Ų1149.3 Ų49.36%0.05825%0.25CC..Hα-helixtrans-64.4-48.2-177.5-62.4177.4000113.5I25 A88 V92 V93 A94 F120 L124I25-L90 HydrophobicContact CD1-CD1 3.71Å; I25-L90 HydrophobicContact CG1-CD1 3.7Å; I25-L90 HydrophobicContact CG2-CD1 4.38Å; A88-L90 VanDerWaalsContact C-N 3.33Å; A88-L90 PolarHBondContact O-N 3.43Å; L90-V92 VanDerWaalsContact C-N 3.31Å; L90-V92 PolarHBondContact O-N 2.83Å; L90-V93 PolarHBondContact O-N 2.98Å; L90-A94 WeakPolarHBondContact O-CB 3.37Å; L90-A94 PolarHBondContact O-N 3.48Å; L90-A94 VanDerWaalsContact O-N 3.1Å; L90-F120 HydrophobicContact CD2-CD2 4.03Å; L90-F120 HydrophobicContact CD2-CE2 4.16Å; L90-L124 HydrophobicContact CD2-CD2 3.97Å; L90-L124 HydrophobicContact CD2-CG 4.42Å
91P86.4Confident77.8Confident8 Ų858.3 Ų58.35%0.05229%0.285CS..Hα-helixtrans-55.6-42.1167-26.533000112.8T87 A88 V93 A94 F95 F189 L190 F193T87-P91 WeakPolarHBondContact O-CD 3.29Å; A88-P91 WeakPolarHBondContact O-CD 3.09Å; P91-V93 VanDerWaalsContact C-N 3.25Å; P91-V93 PolarHBondContact O-N 3.16Å; P91-A94 CarbonylContact O-C 3.55Å; P91-A94 WeakPolarHBondContact O-CA 3.24Å; P91-A94 PolarHBondContact O-N 3.06Å; P91-F95 HydrophobicContact CB-CD2 3.83Å; P91-F95 HydrophobicContact CB-CE2 3.98Å; P91-F95 WeakPolarHBondContact O-CB 3.24Å; P91-F95 VanDerWaalsContact O-CD2 3.3Å; P91-F95 WeakPolarHBondContact O-CD2 3.27Å; P91-F95 PolarHBondContact O-N 3.42Å; P91-F189 HydrophobicContact CB-CB 4.4Å; P91-F189 HydrophobicContact CG-CB 4.07Å; P91-F189 WeakPolarHBondContact CG-O 3.44Å; P91-L190 HydrophobicContact CB-CD2 4.07Å; P91-L190 HydrophobicContact CG-CD2 4.22Å; P91-F193 HydrophobicContact CG-CB 4.42Å
92V85.9Confident75.4Confident79 Ų7958 Ų5848%0.47929%0.288SS..Hα-helixtrans-61.8-36.3-179.7177.40000111.6A88 M89 L90 A94 L119A88-V92 WeakPolarHBondContact O-CG2 2.78Å; M89-V92 WeakPolarHBondContact O-CB 3.32Å; M89-V92 PolarHBondContact O-N 3.47Å; M89-V92 VanDerWaalsContact O-N 3.14Å; L90-V92 VanDerWaalsContact C-N 3.31Å; L90-V92 PolarHBondContact O-N 2.83Å; V92-A94 VanDerWaalsContact C-N 3.28Å; V92-A94 PolarHBondContact O-N 3.35Å; V92-L119 HydrophobicContact CB-CD2 4.13Å; V92-L119 HydrophobicContact CG1-CD2 3.63Å
93V85.1Confident72.8Confident4 Ų462.4 Ų62.42%0.02431%0.311CS..Hα-helixtrans-71-24.2173.5-179.70000111.9F32 L37 M89 L90 P91 Q116 L119 F120F32-V93 HydrophobicContact CE1-CG1 3.97Å; F32-V93 HydrophobicContact CZ-CB 4.39Å; F32-V93 HydrophobicContact CZ-CG1 3.78Å; L37-V93 HydrophobicContact CD2-CG1 4.1Å; M89-V93 VanDerWaalsContact O-CG2 3.3Å; M89-V93 WeakPolarHBondContact O-CG2 3.22Å; M89-V93 PolarHBondContact O-N 3.45Å; L90-V93 PolarHBondContact O-N 2.98Å; P91-V93 VanDerWaalsContact C-N 3.25Å; P91-V93 PolarHBondContact O-N 3.16Å; V93-Q116 HydrophobicContact CG1-CG 3.74Å; V93-Q116 PolarHBondContact O-NE2 3.03Å; V93-L119 HydrophobicContact CG2-CB 3.97Å; V93-L119 HydrophobicContact CG2-CD2 3.76Å; V93-L119 HydrophobicContact CG2-CG 3.79Å; V93-F120 HydrophobicContact CG1-CB 4.12Å; V93-F120 HydrophobicContact CG1-CD2 4.3Å; V93-F120 HydrophobicContact CG2-CB 4.23Å
94A79.4Confident70.6Confident10 Ų1069.2 Ų69.28%0.08335%0.353CS..Hα-helixtrans-100.2-28.8-174.600000115.6F32 L90 P91 V92 N186 F189F32-A94 HydrophobicContact CE2-CB 3.67Å; F32-A94 HydrophobicContact CZ-CB 4.06Å; L90-A94 WeakPolarHBondContact O-CB 3.37Å; L90-A94 PolarHBondContact O-N 3.48Å; L90-A94 VanDerWaalsContact O-N 3.1Å; P91-A94 CarbonylContact O-C 3.55Å; P91-A94 WeakPolarHBondContact O-CA 3.24Å; P91-A94 PolarHBondContact O-N 3.06Å; V92-A94 VanDerWaalsContact C-N 3.28Å; V92-A94 PolarHBondContact O-N 3.35Å; A94-N186 PolarHBondContact O-ND2 3.45Å; A94-N186 PolarHBondContact O-OD1 3.32Å; A94-F189 HydrophobicContact CB-CB 4.4Å; A94-F189 HydrophobicContact CB-CD2 3.55Å; A94-F189 HydrophobicContact CB-CE2 3.96Å; A94-F189 HydrophobicContact CB-CG 3.96Å
95F71Confident68.1Low65 Ų6573.9 Ų73.929%0.28538%0.375SS..SBendtrans-73147.4178.8-92.5-95.6000110.7P91 N186 L187 L190P91-F95 HydrophobicContact CB-CD2 3.83Å; P91-F95 HydrophobicContact CB-CE2 3.98Å; P91-F95 WeakPolarHBondContact O-CB 3.24Å; P91-F95 VanDerWaalsContact O-CD2 3.3Å; P91-F95 WeakPolarHBondContact O-CD2 3.27Å; P91-F95 PolarHBondContact O-N 3.42Å; F95-N186 WeakPolarHBondContact CE2-O 3.28Å; F95-L187 HydrophobicContact CE1-CD2 3.72Å; F95-L187 HydrophobicContact CZ-CD2 3.57Å; F95-L190 HydrophobicContact CE2-CD1 4Å; F95-L190 HydrophobicContact CE2-CD2 3.78Å; F95-L190 HydrophobicContact CE2-CG 3.6Å; F95-L190 HydrophobicContact CZ-CD1 3.5Å; F95-L190 HydrophobicContact CZ-CD2 4.08Å; F95-L190 HydrophobicContact CZ-CG 3.66Å
96P64.6Low65.7Low49 Ų4979.4 Ų79.432%0.31840%0.398SS..  trans-68.6139.8-141.127.6-34.5000113.7F100P96-F100 HydrophobicContact CG-CD2 4.28Å
97F53.1Low63.2Low52 Ų5287 Ų8723%0.22844%0.436CS..SBendtrans-109.2-3.8159-62.3-54.3000113H109 K110 L111F97-H109 WeakPolarHBondContact CD1-O 3.21Å; F97-H109 WeakPolarHBondContact CE1-O 3.46Å; F97-K110 HydrophobicContact CB-CG 4.37Å; F97-L111 HydrophobicContact CE1-CB 3.99Å; F97-L111 HydrophobicContact CE1-CD1 3.97Å; F97-L111 HydrophobicContact CE2-CB 3.86Å; F97-L111 HydrophobicContact CZ-CB 3.56Å; F97-L111 HydrophobicContact CZ-CD1 3.82Å; F97-L111 HydrophobicContact CZ-CD2 4.09Å; F97-L111 HydrophobicContact CZ-CG 4.02Å
98E49.3Very low61.1Low137 Ų13791.7 Ų91.764%0.6446%0.464SS*.SBendtrans-125.8114.1171.1-61.2-163.1150.900107.4K110E98-K110 IonicContact OE1-NZ 3.42Å; E98-K110 PolarHBondContact OE1-NZ 3Å
99D46.3Very low59.3Low127 Ų12797.6 Ų97.668%0.67949%0.487SS*.  trans72.679.9166.7-50.9-25.4000119.3
100F42.3Very low57.8Low159 Ų159101.1 Ų101.170%0.69750%0.502SS*.  trans-104.9107.1149.7-148.8-82.2000108.6P96 I102P96-F100 HydrophobicContact CG-CD2 4.28Å; F100-I102 HydrophobicContact CD1-CD1 3.47Å; F100-I102 VanDerWaalsContact CD1-CD1 3.47Å; F100-I102 HydrophobicContact CD1-CG1 3.56Å; F100-I102 HydrophobicContact CE1-CD1 3.25Å; F100-I102 HydrophobicContact CE1-CG1 3.45Å; F100-I102 VanDerWaalsContact CE1-CG1 3.45Å; F100-I102 HydrophobicContact CZ-CD1 4.42Å; F100-I102 PolarHBondContact O-N 3.45Å
101Y45.6Very low57Low190 Ų190102.9 Ų102.975%0.74551%0.511SS*.  trans-80.899.9171.2-87.3-93.5000109.2
102I41.7Very low56.7Low117 Ų117107.4 Ų107.460%0.654%0.535SS*.  trans-120.2115.4154.9-68.9160.2000106.1F100F100-I102 HydrophobicContact CD1-CD1 3.47Å; F100-I102 VanDerWaalsContact CD1-CD1 3.47Å; F100-I102 HydrophobicContact CD1-CG1 3.56Å; F100-I102 HydrophobicContact CE1-CD1 3.25Å; F100-I102 HydrophobicContact CE1-CG1 3.45Å; F100-I102 VanDerWaalsContact CE1-CG1 3.45Å; F100-I102 HydrophobicContact CZ-CD1 4.42Å; F100-I102 PolarHBondContact O-N 3.45Å
103D41.3Very low56.5Low138 Ų138107.7 Ų107.774%0.73854%0.538SS*.THydrogen-bonded Turntrans39.694.6167.5-83.7-19.9000117.5H105D103-H105 PolarHBondContact O-N 3.23Å
104T47.4Very low56.6Low144 Ų144113.2 Ų113.288%0.88357%0.566SS**THydrogen-bonded Turntrans48.40155.535.20000120
105H42.9Very low56.9Low157 Ų157117.7 Ų117.773%0.72759%0.585SS**  trans-124.4111.2-178.5-81-60.5000110.1D103 M107D103-H105 PolarHBondContact O-N 3.23Å; H105-M107 PolarHBondContact O-N 2.81Å
106H43.7Very low57.7Low151 Ų151116.4 Ų116.470%0.69958%0.58SS**  trans-67.194.4171.9-79.5-71.9000110.6T108H106-T108 PolarHBondContact O-N 3.15Å
107M41.2Very low58.8Low161 Ų161118.1 Ų118.179%0.79358%0.584SS**  trans-93.484.8164.5-71.6-72.2-8000108.7H105 H109H105-M107 PolarHBondContact O-N 2.81Å; M107-H109 PolarHBondContact O-N 3.36Å
108T47.6Very low60.7Low98 Ų98120.4 Ų120.460%0.60160%0.597SS**  trans-75.589171.647.40000109.6H106 K110H106-T108 PolarHBondContact O-N 3.15Å; T108-K110 PolarHBondContact O-N 3.42Å
109H51.5Low62.7Low150 Ų150115.7 Ų115.769%0.69458%0.577SS**  trans-79.354170.7-126.1-59.9000110.4F97 M107 L111F97-H109 WeakPolarHBondContact CD1-O 3.21Å; F97-H109 WeakPolarHBondContact CE1-O 3.46Å; M107-H109 PolarHBondContact O-N 3.36Å; H109-L111 PolarHBondContact O-N 3.3Å; H109-L111 VanDerWaalsContact O-N 3.12Å
110K60.9Low64.9Low117 Ų117109.8 Ų109.851%0.50955%0.545SS..  trans-64.7114.1178.8-71.1-169172.8-158.50108.7F97 E98 T108F97-K110 HydrophobicContact CB-CG 4.37Å; E98-K110 IonicContact OE1-NZ 3.42Å; E98-K110 PolarHBondContact OE1-NZ 3Å; T108-K110 PolarHBondContact O-N 3.42Å
111L69.3Low67.5Low47 Ų47106.4 Ų106.425%0.24653%0.528CS..  trans-61.1137.2164.4-119.268.1000107.7F97 H109 E115 L119F97-L111 HydrophobicContact CE1-CB 3.99Å; F97-L111 HydrophobicContact CE1-CD1 3.97Å; F97-L111 HydrophobicContact CE2-CB 3.86Å; F97-L111 HydrophobicContact CZ-CB 3.56Å; F97-L111 HydrophobicContact CZ-CD1 3.82Å; F97-L111 HydrophobicContact CZ-CD2 4.09Å; F97-L111 HydrophobicContact CZ-CG 4.02Å; H109-L111 PolarHBondContact O-N 3.3Å; H109-L111 VanDerWaalsContact O-N 3.12Å; L111-E115 HydrophobicContact CD2-CB 4.34Å; L111-E115 HydrophobicContact CG-CB 4.24Å; L111-L119 HydrophobicContact CD2-CD2 4.28Å
112D80.9Confident69.8Low104 Ų104100.8 Ų100.856%0.55651%0.514SS*.  trans-59.8141.1173.9-89-29.5000109.4I114 E115 Q116D112-I114 PolarHBondContact O-N 3.32Å; D112-E115 HydrophobicContact CB-CB 4.43Å; D112-E115 HydrophobicContact CB-CG 4.04Å; D112-E115 WeakPolarHBondContact O-CA 3.11Å; D112-E115 WeakPolarHBondContact O-CB 3.16Å; D112-E115 PolarHBondContact O-N 3.43Å; D112-Q116 PolarHBondContact O-N 3.28Å
113P81.9Confident72.4Confident85 Ų8595.2 Ų95.255%0.55249%0.485SS*.Hα-helixtrans-52.9-34.2-178.8-28.334.2000113Q117P113-Q117 WeakPolarHBondContact O-CB 3.36Å; P113-Q117 WeakPolarHBondContact O-CG 3.23Å; P113-Q117 PolarHBondContact O-N 2.99Å
114I85.8Confident75Confident120 Ų12089.1 Ų89.162%0.61545%0.452SS*.Hα-helixtrans-66-46176.4-61.3173.2000110.8D112 Q117 I118D112-I114 PolarHBondContact O-N 3.32Å; I114-Q117 PolarHBondContact O-N 2.89Å; I114-I118 HydrophobicContact CG2-CD1 3.84Å; I114-I118 VanDerWaalsContact O-CG1 3.26Å; I114-I118 WeakPolarHBondContact O-CG1 3.18Å; I114-I118 PolarHBondContact O-N 2.91Å
115E86.7Confident77.3Confident104 Ų10487.4 Ų87.449%0.48644%0.437SS..Hα-helixtrans-64.4-42178-62.8-175153.400111.4L111 D112 Q117 I118 L119L111-E115 HydrophobicContact CD2-CB 4.34Å; L111-E115 HydrophobicContact CG-CB 4.24Å; D112-E115 HydrophobicContact CB-CB 4.43Å; D112-E115 HydrophobicContact CB-CG 4.04Å; D112-E115 WeakPolarHBondContact O-CA 3.11Å; D112-E115 WeakPolarHBondContact O-CB 3.16Å; D112-E115 PolarHBondContact O-N 3.43Å; E115-Q117 VanDerWaalsContact C-N 3.34Å; E115-Q117 PolarHBondContact O-N 3.47Å; E115-I118 PolarHBondContact O-N 3.29Å; E115-L119 WeakPolarHBondContact O-CB 3.4Å; E115-L119 PolarHBondContact O-N 3.07Å
116Q87Confident79.8Confident38 Ų3880.4 Ų80.418%0.17841%0.406CS..Hα-helixtrans-60.1-43.9175.9-170-178.322.400111.4L37 V93 D112 F120L37-Q116 HydrophobicContact CD2-CG 4.15Å; V93-Q116 HydrophobicContact CG1-CG 3.74Å; V93-Q116 PolarHBondContact O-NE2 3.03Å; D112-Q116 PolarHBondContact O-N 3.28Å; Q116-F120 VanDerWaalsContact O-CB 3.31Å; Q116-F120 WeakPolarHBondContact O-CB 3.34Å; Q116-F120 PolarHBondContact O-N 3.1Å
117Q89Confident82.3Confident84 Ų8473.2 Ų73.239%0.39337%0.373SS..Hα-helixtrans-65-45.5176.5-72.8-1790.200112Y39 P113 I114 E115 L119 F120 Y121Y39-Q117 HydrophobicContact CE1-CG 4.48Å; Y39-Q117 WeakPolarHBondContact OH-CG 3.28Å; P113-Q117 WeakPolarHBondContact O-CB 3.36Å; P113-Q117 WeakPolarHBondContact O-CG 3.23Å; P113-Q117 PolarHBondContact O-N 2.99Å; I114-Q117 PolarHBondContact O-N 2.89Å; E115-Q117 VanDerWaalsContact C-N 3.34Å; E115-Q117 PolarHBondContact O-N 3.47Å; Q117-L119 VanDerWaalsContact C-N 3.35Å; Q117-L119 PolarHBondContact O-N 3.2Å; Q117-F120 PolarHBondContact O-N 3.47Å; Q117-Y121 WeakPolarHBondContact O-CD2 3.5Å; Q117-Y121 PolarHBondContact O-N 3.4Å
118I91.6Very high84.9Confident100 Ų10065.6 Ų65.651%0.51334%0.336SS..Hα-helixtrans-59.3-48.7177.5-69.7166000109.9I114 E115 F120 Y121 V122I114-I118 HydrophobicContact CG2-CD1 3.84Å; I114-I118 VanDerWaalsContact O-CG1 3.26Å; I114-I118 WeakPolarHBondContact O-CG1 3.18Å; I114-I118 PolarHBondContact O-N 2.91Å; E115-I118 PolarHBondContact O-N 3.29Å; I118-F120 VanDerWaalsContact C-N 3.3Å; I118-F120 PolarHBondContact O-N 2.88Å; I118-Y121 PolarHBondContact O-N 2.81Å; I118-V122 HydrophobicContact CG2-CG2 4.12Å; I118-V122 VanDerWaalsContact O-CB 3.3Å; I118-V122 WeakPolarHBondContact O-CB 3.23Å; I118-V122 VanDerWaalsContact O-CG2 3.22Å; I118-V122 WeakPolarHBondContact O-CG2 3.17Å; I118-V122 PolarHBondContact O-N 3.41Å
119L92.3Very high87.1Confident39 Ų3963.7 Ų63.720%0.20432%0.322CS..Hα-helixtrans-61.5-40.5-179.7-169.764.3000111.7M89 V92 V93 L111 E115 Q117 G123M89-L119 HydrophobicContact CB-CD1 4.18Å; M89-L119 HydrophobicContact CB-CG 4.24Å; M89-L119 HydrophobicContact CE-CD1 3.81Å; M89-L119 HydrophobicContact CG-CD1 3.69Å; M89-L119 HydrophobicContact CG-CG 4.3Å; M89-L119 HydrophobicContact SD-CD1 3.81Å; V92-L119 HydrophobicContact CB-CD2 4.13Å; V92-L119 HydrophobicContact CG1-CD2 3.63Å; V93-L119 HydrophobicContact CG2-CB 3.97Å; V93-L119 HydrophobicContact CG2-CD2 3.76Å; V93-L119 HydrophobicContact CG2-CG 3.79Å; L111-L119 HydrophobicContact CD2-CD2 4.28Å; E115-L119 WeakPolarHBondContact O-CB 3.4Å; E115-L119 PolarHBondContact O-N 3.07Å; Q117-L119 VanDerWaalsContact C-N 3.35Å; Q117-L119 PolarHBondContact O-N 3.2Å; L119-G123 PolarHBondContact O-N 3.21Å
120F93.1Very high89.2Confident2 Ų256.5 Ų56.51%0.00929%0.288CS..Hα-helixtrans-62-52.3176.2179.7-115.7000112.3M29 F32 C33 L37 Y39 V47 L90 V93 Q116 Q117 I118 G123 L124M29-F120 HydrophobicContact SD-CE2 4.18Å; M29-F120 HydrophobicContact SD-CZ 3.63Å; F32-F120 AromaticContact CD1-CE2 3.83Å; F32-F120 HydrophobicContact CD1-CE2 3.83Å; F32-F120 HydrophobicContact CD1-CZ 4.3Å; F32-F120 AromaticContact CE1-CD2 3.96Å; F32-F120 HydrophobicContact CE1-CD2 3.96Å; F32-F120 AromaticContact CE1-CE2 3.74Å; F32-F120 HydrophobicContact CE1-CE2 3.74Å; C33-F120 VanDerWaalsContact SG-CZ 3.59Å; L37-F120 HydrophobicContact CD1-CD1 3.83Å; L37-F120 HydrophobicContact CD1-CD2 4.24Å; L37-F120 HydrophobicContact CD1-CE1 3.83Å; L37-F120 HydrophobicContact CD1-CE2 4.26Å; L37-F120 HydrophobicContact CD1-CG 4.02Å; L37-F120 HydrophobicContact CD1-CZ 4.03Å; Y39-F120 HydrophobicContact CE2-CE1 4.34Å; V47-F120 HydrophobicContact CG1-CE1 4.03Å; V47-F120 HydrophobicContact CG1-CZ 4.37Å; L90-F120 HydrophobicContact CD2-CD2 4.03Å; L90-F120 HydrophobicContact CD2-CE2 4.16Å; V93-F120 HydrophobicContact CG1-CB 4.12Å; V93-F120 HydrophobicContact CG1-CD2 4.3Å; V93-F120 HydrophobicContact CG2-CB 4.23Å; Q116-F120 VanDerWaalsContact O-CB 3.31Å; Q116-F120 WeakPolarHBondContact O-CB 3.34Å; Q116-F120 PolarHBondContact O-N 3.1Å; Q117-F120 PolarHBondContact O-N 3.47Å; I118-F120 VanDerWaalsContact C-N 3.3Å; I118-F120 PolarHBondContact O-N 2.88Å; F120-G123 PolarHBondContact O-N 3.1Å; F120-L124 HydrophobicContact CD1-CD1 4.19Å; F120-L124 HydrophobicContact CD2-CD1 4.44Å; F120-L124 HydrophobicContact CD2-CG 4.46Å; F120-L124 HydrophobicContact CE1-CD1 3.69Å; F120-L124 HydrophobicContact CE2-CD1 3.95Å; F120-L124 HydrophobicContact CE2-CD2 4.47Å; F120-L124 HydrophobicContact CE2-CG 4.21Å; F120-L124 HydrophobicContact CZ-CD1 3.57Å; F120-L124 HydrophobicContact CZ-CG 4.33Å; F120-L124 WeakPolarHBondContact O-CG 3.46Å; F120-L124 PolarHBondContact O-N 3.45Å
121Y95.1Very high90.6Very high88 Ų8851 Ų5135%0.34526%0.264SS..Hα-helixtrans-68.5-39.7-178.7-73.8-63.1000113.1Y39 V47 Q117 I118 G123 L124 L125Y39-Y121 WeakPolarHBondContact CE2-OH 3.46Å; Y39-Y121 PolarHBondContact OH-OH 3.43Å; V47-Y121 HydrophobicContact CG1-CE1 4.19Å; V47-Y121 HydrophobicContact CG2-CE1 3.72Å; Q117-Y121 WeakPolarHBondContact O-CD2 3.5Å; Q117-Y121 PolarHBondContact O-N 3.4Å; I118-Y121 PolarHBondContact O-N 2.81Å; Y121-G123 VanDerWaalsContact C-N 3.32Å; Y121-L124 PolarHBondContact O-N 3.07Å; Y121-L125 WeakPolarHBondContact O-CB 3.43Å; Y121-L125 PolarHBondContact O-N 3.15Å
122V95.5Very high91.5Very high73 Ų7348.7 Ų48.744%0.44225%0.253SS..Hα-helixtrans-63.1-42.6174171.70000110.2M89 I118 L125 A126M89-V122 HydrophobicContact CE-CG1 4.26Å; M89-V122 HydrophobicContact SD-CG1 4.09Å; I118-V122 HydrophobicContact CG2-CG2 4.12Å; I118-V122 VanDerWaalsContact O-CB 3.3Å; I118-V122 WeakPolarHBondContact O-CB 3.23Å; I118-V122 VanDerWaalsContact O-CG2 3.22Å; I118-V122 WeakPolarHBondContact O-CG2 3.17Å; I118-V122 PolarHBondContact O-N 3.41Å; V122-L125 PolarHBondContact O-N 3.48Å; V122-A126 VanDerWaalsContact O-CB 3.3Å; V122-A126 WeakPolarHBondContact O-CB 3.3Å; V122-A126 PolarHBondContact O-N 2.9Å
123G95.1Very high91.8Very high0 Ų043.8 Ų43.80%023%0.226CC..Hα-helixtrans-60.3-47.617600000112.5G86 L119 F120 Y121 L125 A126 A127G86-G123 WeakPolarHBondContact CA-O 3.14Å; L119-G123 PolarHBondContact O-N 3.21Å; F120-G123 PolarHBondContact O-N 3.1Å; Y121-G123 VanDerWaalsContact C-N 3.32Å; G123-L125 PolarHBondContact O-N 2.9Å; G123-A126 PolarHBondContact O-N 3.37Å; G123-A127 VanDerWaalsContact O-CB 3.29Å; G123-A127 WeakPolarHBondContact O-CB 3.25Å; G123-A127 PolarHBondContact O-N 3.21Å
124L95.6Very high92.1Very high10 Ų1039.9 Ų39.95%0.05220%0.2CC..Hα-helixtrans-62.7-42.6176.9-72.3-177.4000112.9I25 M29 V47 F51 L90 F120 Y121 A127 A128I25-L124 HydrophobicContact CG2-CD2 4.13Å; M29-L124 HydrophobicContact CE-CD1 3.84Å; M29-L124 HydrophobicContact CE-CD2 3.38Å; M29-L124 HydrophobicContact CE-CG 4.27Å; M29-L124 HydrophobicContact SD-CD1 3.96Å; M29-L124 HydrophobicContact SD-CD2 4.15Å; V47-L124 HydrophobicContact CG1-CD1 3.65Å; F51-L124 HydrophobicContact CD2-CB 4.17Å; F51-L124 HydrophobicContact CD2-CD2 3.94Å; F51-L124 HydrophobicContact CE2-CD2 4.18Å; F51-L124 HydrophobicContact CG-CD2 4.45Å; L90-L124 HydrophobicContact CD2-CD2 3.97Å; L90-L124 HydrophobicContact CD2-CG 4.42Å; F120-L124 HydrophobicContact CD1-CD1 4.19Å; F120-L124 HydrophobicContact CD2-CD1 4.44Å; F120-L124 HydrophobicContact CD2-CG 4.46Å; F120-L124 HydrophobicContact CE1-CD1 3.69Å; F120-L124 HydrophobicContact CE2-CD1 3.95Å; F120-L124 HydrophobicContact CE2-CD2 4.47Å; F120-L124 HydrophobicContact CE2-CG 4.21Å; F120-L124 HydrophobicContact CZ-CD1 3.57Å; F120-L124 HydrophobicContact CZ-CG 4.33Å; F120-L124 WeakPolarHBondContact O-CG 3.46Å; F120-L124 PolarHBondContact O-N 3.45Å; Y121-L124 PolarHBondContact O-N 3.07Å; L124-A127 PolarHBondContact O-N 2.78Å; L124-A128 WeakPolarHBondContact O-CB 3.14Å; L124-A128 PolarHBondContact O-N 2.86Å
125L96.1Very high92.1Very high107 Ų10735.6 Ų35.656%0.5618%0.177SC*.Hα-helixtrans-64.8-46.9177.2-179.162.1000111Y121 V122 G123 A127 A128 L129Y121-L125 WeakPolarHBondContact O-CB 3.43Å; Y121-L125 PolarHBondContact O-N 3.15Å; V122-L125 PolarHBondContact O-N 3.48Å; G123-L125 PolarHBondContact O-N 2.9Å; L125-A127 VanDerWaalsContact C-N 3.33Å; L125-A127 PolarHBondContact O-N 3.46Å; L125-A128 PolarHBondContact O-N 3.24Å; L125-L129 HydrophobicContact CD1-CD1 4.46Å; L125-L129 HydrophobicContact CD1-CG 4.36Å; L125-L129 HydrophobicContact CG-CD1 4.28Å; L125-L129 WeakPolarHBondContact O-CB 3.47Å; L125-L129 VanDerWaalsContact O-CG 3.29Å; L125-L129 WeakPolarHBondContact O-CG 3.4Å; L125-L129 PolarHBondContact O-N 2.71Å
126A96.6Very high92Very high10 Ų1031.4 Ų31.48%0.08316%0.16CC..Hα-helixtrans-60.7-42.417700000111.7L82 V122 G123 L129 G130L82-A126 CarbonylContact C-O 3.46Å; L82-A126 HydrophobicContact CD2-CB 4.48Å; L82-A126 CarbonylContact O-C 3.54Å; V122-A126 VanDerWaalsContact O-CB 3.3Å; V122-A126 WeakPolarHBondContact O-CB 3.3Å; V122-A126 PolarHBondContact O-N 2.9Å; G123-A126 PolarHBondContact O-N 3.37Å; A126-L129 PolarHBondContact O-N 2.71Å; A126-G130 PolarHBondContact O-N 2.9Å
127A95.1Very high91.7Very high0 Ų029.7 Ų29.70%015%0.152CC..Hα-helixtrans-63.5-46.9175.600000111.8F51 T87 G123 L124 L125 L129 G130 I131F51-A127 HydrophobicContact CE2-CB 4.18Å; T87-A127 HydrophobicContact CG2-CB 4.48Å; G123-A127 VanDerWaalsContact O-CB 3.29Å; G123-A127 WeakPolarHBondContact O-CB 3.25Å; G123-A127 PolarHBondContact O-N 3.21Å; L124-A127 PolarHBondContact O-N 2.78Å; L125-A127 VanDerWaalsContact C-N 3.33Å; L125-A127 PolarHBondContact O-N 3.46Å; A127-L129 VanDerWaalsContact C-N 3.31Å; A127-L129 PolarHBondContact O-N 3.42Å; A127-G130 PolarHBondContact O-N 3.49Å; A127-I131 WeakPolarHBondContact O-CB 3.48Å; A127-I131 WeakPolarHBondContact O-CD1 3.4Å; A127-I131 VanDerWaalsContact O-CG1 3.28Å; A127-I131 WeakPolarHBondContact O-CG1 3.35Å; A127-I131 PolarHBondContact O-N 3.4Å
128A95.4Very high91.2Very high2 Ų225.8 Ų25.82%0.01713%0.134CC..Hα-helixtrans-60.8-40.4177.200000111.9F51 A54 S55 L124 L125 G132F51-A128 HydrophobicContact CD2-CB 4.09Å; F51-A128 HydrophobicContact CE2-CB 4Å; A54-A128 HydrophobicContact CB-CB 4.07Å; S55-A128 WeakPolarHBondContact OG-CB 3.46Å; L124-A128 WeakPolarHBondContact O-CB 3.14Å; L124-A128 PolarHBondContact O-N 2.86Å; L125-A128 PolarHBondContact O-N 3.24Å; A128-G132 PolarHBondContact O-N 3.18Å
129L95.3Very high90.3Very high57 Ų5723.2 Ų23.230%0.29812%0.124SC..Hα-helixtrans-64.7-45.4175.2-69.1177000112.2T58 I62 L82 L125 A126 A127 G132 G133T58-L129 HydrophobicContact CG2-CD2 3.68Å; I62-L129 HydrophobicContact CD1-CB 4.49Å; I62-L129 HydrophobicContact CD1-CD2 4.41Å; I62-L129 WeakPolarHBondContact CD1-O 3.23Å; L82-L129 HydrophobicContact CD1-CB 4.19Å; L82-L129 HydrophobicContact CD1-CD1 4.49Å; L125-L129 HydrophobicContact CD1-CD1 4.46Å; L125-L129 HydrophobicContact CD1-CG 4.36Å; L125-L129 HydrophobicContact CG-CD1 4.28Å; L125-L129 WeakPolarHBondContact O-CB 3.47Å; L125-L129 VanDerWaalsContact O-CG 3.29Å; L125-L129 WeakPolarHBondContact O-CG 3.4Å; L125-L129 PolarHBondContact O-N 2.71Å; A126-L129 PolarHBondContact O-N 2.71Å; A127-L129 VanDerWaalsContact C-N 3.31Å; A127-L129 PolarHBondContact O-N 3.42Å; L129-G132 PolarHBondContact O-N 3.36Å; L129-G133 PolarHBondContact O-N 2.98Å
130G94.2Very high89.1Confident0 Ų024 Ų240%013%0.131CC..Hα-helixtrans-63.6-50.417900000113.2C79 A126 A127 G132 G133 I134C79-G130 WeakPolarHBondContact O-CA 3.3Å; A126-G130 PolarHBondContact O-N 2.9Å; A127-G130 PolarHBondContact O-N 3.49Å; G130-G132 VanDerWaalsContact C-N 3.34Å; G130-G132 PolarHBondContact O-N 3.5Å; G130-G133 PolarHBondContact O-N 3.12Å; G130-I134 VanDerWaalsContact O-CG1 3.29Å; G130-I134 WeakPolarHBondContact O-CG1 3.38Å; G130-I134 PolarHBondContact O-N 3.11Å
131I91.4Very high87.9Confident0 Ų024.6 Ų24.60%014%0.135CC..Hα-helixtrans-54.3-51.4174.1-74.9164.4000110.3E18 F22 F51 H83 A127 G133 I134 R135E18-I131 HydrophobicContact CG-CG1 4.37Å; E18-I131 HydrophobicContact CG-CG2 4.44Å; E18-I131 WeakPolarHBondContact OE1-CG2 3.38Å; F22-I131 HydrophobicContact CB-CD1 4.18Å; F22-I131 HydrophobicContact CD2-CD1 4.24Å; F22-I131 HydrophobicContact CD2-CG2 4.47Å; F51-I131 HydrophobicContact CZ-CD1 4Å; H83-I131 WeakPolarHBondContact NE2-CG1 3.21Å; A127-I131 WeakPolarHBondContact O-CB 3.48Å; A127-I131 WeakPolarHBondContact O-CD1 3.4Å; A127-I131 VanDerWaalsContact O-CG1 3.28Å; A127-I131 WeakPolarHBondContact O-CG1 3.35Å; A127-I131 PolarHBondContact O-N 3.4Å; I131-G133 PolarHBondContact O-N 3.42Å; I131-I134 PolarHBondContact O-N 2.7Å; I131-R135 WeakPolarHBondContact O-CG 3.39Å; I131-R135 PolarHBondContact O-N 3.46Å; I131-R135 VanDerWaalsContact O-N 3.12Å
132G87.7Confident86.4Confident0 Ų020.8 Ų20.80%012%0.122CC..Hα-helixtrans-61.6-44.4-176.900000112.8P59 A128 L129 G130 R135 A136P59-G132 VanDerWaalsContact CA-O 3.3Å; P59-G132 WeakPolarHBondContact CA-O 3.21Å; P59-G132 WeakPolarHBondContact CB-O 3.43Å; P59-G132 WeakPolarHBondContact CG-O 3.41Å; A128-G132 PolarHBondContact O-N 3.18Å; L129-G132 PolarHBondContact O-N 3.36Å; G130-G132 VanDerWaalsContact C-N 3.34Å; G130-G132 PolarHBondContact O-N 3.5Å; G132-R135 PolarHBondContact O-N 3.45Å; G132-A136 WeakPolarHBondContact O-CB 3.32Å; G132-A136 PolarHBondContact O-N 2.88Å
133G88.1Confident85Confident0 Ų019.2 Ų19.20%012%0.117CC..Hα-helixtrans-70-38.1-178.900000114.2L129 G130 I131 A136 I137L129-G133 PolarHBondContact O-N 2.98Å; G130-G133 PolarHBondContact O-N 3.12Å; I131-G133 PolarHBondContact O-N 3.42Å; G133-A136 PolarHBondContact O-N 3.26Å; G133-I137 PolarHBondContact O-N 2.76Å
134I88.4Confident83.6Confident3 Ų325.1 Ų25.12%0.01514%0.14CC..Hα-helixtrans-59.7-49172.5-68.3166.9000109.4V14 L76 H83 G130 I131 A136 I137 L138V14-I134 HydrophobicContact CG1-CG2 3.97Å; L76-I134 HydrophobicContact CD1-CG1 4.34Å; H83-I134 HydrophobicContact CB-CD1 4.16Å; H83-I134 VanDerWaalsContact ND1-CD1 3.3Å; H83-I134 WeakPolarHBondContact ND1-CD1 3.47Å; G130-I134 VanDerWaalsContact O-CG1 3.29Å; G130-I134 WeakPolarHBondContact O-CG1 3.38Å; G130-I134 PolarHBondContact O-N 3.11Å; I131-I134 PolarHBondContact O-N 2.7Å; I134-A136 PolarHBondContact O-N 3.02Å; I134-I137 PolarHBondContact O-N 2.85Å; I134-L138 HydrophobicContact CG2-CB 4.19Å; I134-L138 HydrophobicContact CG2-CD2 3.98Å; I134-L138 WeakPolarHBondContact O-CA 3.29Å; I134-L138 WeakPolarHBondContact O-CB 3.18Å; I134-L138 PolarHBondContact O-N 2.86Å
135R85Confident82.1Confident30 Ų3026.1 Ų26.111%0.11315%0.148CC..Hα-helixtrans-60.4-42.7177.7-69.8177.5-176.7172.76112.8E18 P59 I131 G132 I137 C139E18-R135 IonicContact OE1-CZ 2.89Å; E18-R135 VanDerWaalsContact OE1-CZ 3.22Å; E18-R135 IonicContact OE1-NE 3.76Å; E18-R135 PolarHBondContact OE1-NE 3.45Å; E18-R135 VanDerWaalsContact OE1-NE 3.13Å; E18-R135 IonicContact OE1-NH2 3.74Å; E18-R135 PolarHBondContact OE1-NH2 2.9Å; E18-R135 IonicContact OE2-CZ 2.68Å; E18-R135 IonicContact OE2-NE 3.92Å; E18-R135 PolarHBondContact OE2-NE 2.67Å; E18-R135 IonicContact OE2-NH2 3.13Å; E18-R135 PolarHBondContact OE2-NH2 3.14Å; P59-R135 HydrophobicContact CG-CB 4.31Å; I131-R135 WeakPolarHBondContact O-CG 3.39Å; I131-R135 PolarHBondContact O-N 3.46Å; I131-R135 VanDerWaalsContact O-N 3.12Å; G132-R135 PolarHBondContact O-N 3.45Å; R135-I137 VanDerWaalsContact C-N 3.27Å; R135-I137 PolarHBondContact O-N 3.4Å; R135-C139 PolarHBondContact O-N 2.84Å; R135-C139 PolarHBondContact O-SG 3.45Å
136A83.6Confident80.6Confident17 Ų1721.5 Ų21.514%0.1412%0.124CC..Hα-helixtrans-59.9-37.8-179.300000113.5P59 G132 G133 I134 P140P59-A136 HydrophobicContact CB-CB 4.18Å; P59-A136 WeakPolarHBondContact O-CB 3.28Å; G132-A136 WeakPolarHBondContact O-CB 3.32Å; G132-A136 PolarHBondContact O-N 2.88Å; G133-A136 PolarHBondContact O-N 3.26Å; I134-A136 PolarHBondContact O-N 3.02Å; A136-P140 WeakPolarHBondContact O-CD 3.21Å; A136-P140 WeakPolarHBondContact O-CG 3.43Å
137I81.6Confident79.1Confident2 Ų227.5 Ų27.51%0.0115%0.15CC..Hα-helixtrans-100.5-46.1-169.9-64.5162.9000110.2I62 A66 R72 V75 L76 G133 I134 R135 M141I62-I137 HydrophobicContact CG2-CD1 4.45Å; A66-I137 HydrophobicContact CB-CD1 4.12Å; A66-I137 HydrophobicContact CB-CG1 4.3Å; R72-I137 HydrophobicContact CB-CG2 4.06Å; V75-I137 HydrophobicContact CB-CD1 3.79Å; V75-I137 HydrophobicContact CG1-CD1 3.6Å; L76-I137 HydrophobicContact CB-CD1 4.24Å; L76-I137 HydrophobicContact CB-CG2 4.04Å; L76-I137 HydrophobicContact CD1-CB 4.38Å; L76-I137 HydrophobicContact CD1-CG2 4.31Å; G133-I137 PolarHBondContact O-N 2.76Å; I134-I137 PolarHBondContact O-N 2.85Å; R135-I137 VanDerWaalsContact C-N 3.27Å; R135-I137 PolarHBondContact O-N 3.4Å; I137-M141 HydrophobicContact CG2-CE 3.44Å; I137-M141 VanDerWaalsContact CG2-CE 3.44Å; I137-M141 HydrophobicContact CG2-SD 4.04Å; I137-M141 WeakPolarHBondContact O-CE 3.48Å; I137-M141 VanDerWaalsContact O-CG 3.24Å; I137-M141 WeakPolarHBondContact O-CG 3.5Å; I137-M141 PolarHBondContact O-N 3.23Å
138L77.9Confident77.8Confident2 Ų231.1 Ų31.11%0.0118%0.175CC..Hα-helixtrans-74.5-45.2-171.2-166.469.8000113.4V11 V14 I134 M141 G142V11-L138 HydrophobicContact CG1-CD2 4.49Å; V11-L138 HydrophobicContact CG1-CG 4.18Å; V11-L138 HydrophobicContact CG2-CD1 4.21Å; V14-L138 HydrophobicContact CB-CD2 3.6Å; V14-L138 HydrophobicContact CG1-CD2 3.24Å; V14-L138 HydrophobicContact CG2-CD2 4.45Å; I134-L138 HydrophobicContact CG2-CB 4.19Å; I134-L138 HydrophobicContact CG2-CD2 3.98Å; I134-L138 WeakPolarHBondContact O-CA 3.29Å; I134-L138 WeakPolarHBondContact O-CB 3.18Å; I134-L138 PolarHBondContact O-N 2.86Å; L138-M141 HydrophobicContact CD1-CE 4.07Å; L138-M141 PolarHBondContact O-N 2.97Å; L138-M141 VanDerWaalsContact O-N 3.16Å; L138-G142 PolarHBondContact O-N 2.9Å
139C72.5Confident76.5Confident46 Ų4634.7 Ų34.731%0.31119%0.189SC..Hα-helixtrans-60.2-45.9-177.5-43.50000112.1E15 R135 M141 G142 A143E15-C139 PolarHBondContact OE2-SG 3.48Å; R135-C139 PolarHBondContact O-N 2.84Å; R135-C139 PolarHBondContact O-SG 3.45Å; C139-M141 VanDerWaalsContact C-N 3.34Å; C139-M141 PolarHBondContact O-N 3.46Å; C139-G142 PolarHBondContact O-N 2.99Å; C139-A143 PolarHBondContact O-N 3.38Å
140P68.9Low75.5Confident54 Ų5437.5 Ų37.535%0.35120%0.204SC..Hα-helixtrans-64-35.9175.9-2435.6000113.5A136 A143 Y144A136-P140 WeakPolarHBondContact O-CD 3.21Å; A136-P140 WeakPolarHBondContact O-CG 3.43Å; P140-A143 PolarHBondContact O-N 3.32Å; P140-Y144 PolarHBondContact O-N 3.05Å
141M66.8Low74Confident16 Ų1640.3 Ų40.38%0.07922%0.217CC..Hα-helixtrans-68.1-39.2176.9-72.3-172.3-5100112L76 I137 L138 C139 Y144 S145 L210 Y212L76-M141 HydrophobicContact CD2-CE 4.12Å; I137-M141 HydrophobicContact CG2-CE 3.44Å; I137-M141 VanDerWaalsContact CG2-CE 3.44Å; I137-M141 HydrophobicContact CG2-SD 4.04Å; I137-M141 WeakPolarHBondContact O-CE 3.48Å; I137-M141 VanDerWaalsContact O-CG 3.24Å; I137-M141 WeakPolarHBondContact O-CG 3.5Å; I137-M141 PolarHBondContact O-N 3.23Å; L138-M141 HydrophobicContact CD1-CE 4.07Å; L138-M141 PolarHBondContact O-N 2.97Å; L138-M141 VanDerWaalsContact O-N 3.16Å; C139-M141 VanDerWaalsContact C-N 3.34Å; C139-M141 PolarHBondContact O-N 3.46Å; M141-Y144 PolarHBondContact O-N 3.4Å; M141-S145 PolarHBondContact O-N 3.18Å; M141-S145 VanDerWaalsContact O-N 3.1Å; M141-L210 HydrophobicContact CE-CD2 3.69Å; M141-L210 HydrophobicContact SD-CD2 4.05Å; M141-Y212 HydrophobicContact CG-CD1 4.46Å; M141-Y212 HydrophobicContact CG-CG 4.17Å
142G64.6Low72.8Confident7 Ų743.9 Ų43.97%0.07223%0.234CC..Hα-helixtrans-57.1-51.6171.900000111.6L138 C139 Y144 S145 L146L138-G142 PolarHBondContact O-N 2.9Å; C139-G142 PolarHBondContact O-N 2.99Å; G142-Y144 VanDerWaalsContact C-N 3.31Å; G142-Y144 PolarHBondContact O-N 2.88Å; G142-S145 PolarHBondContact O-N 3Å; G142-S145 PolarHBondContact O-OG 3.26Å; G142-L146 WeakPolarHBondContact O-CG 3.16Å; G142-L146 PolarHBondContact O-N 3.04Å
143A64.4Low71.8Confident41 Ų4148.7 Ų48.734%0.33926%0.256SS..Hα-helixtrans-60-38.3177.900000112.9C139 P140 L146 Q147 F158C139-A143 PolarHBondContact O-N 3.38Å; P140-A143 PolarHBondContact O-N 3.32Å; A143-L146 PolarHBondContact O-N 3.43Å; A143-Q147 PolarHBondContact O-N 3.47Å; A143-F158 HydrophobicContact CB-CZ 4.25Å
144Y65.8Low70.8Confident123 Ų12350.8 Ų50.848%0.48227%0.267SS..Hα-helixtrans-65.4-39.8177.2-174.6-103.3000112.8P140 M141 G142 L146 Q147 Y212P140-Y144 PolarHBondContact O-N 3.05Å; M141-Y144 PolarHBondContact O-N 3.4Å; G142-Y144 VanDerWaalsContact C-N 3.31Å; G142-Y144 PolarHBondContact O-N 2.88Å; Y144-L146 PolarHBondContact O-N 3.47Å; Y144-L146 VanDerWaalsContact O-N 3.14Å; Y144-Q147 VanDerWaalsContact CD2-OE1 3.24Å; Y144-Q147 VanDerWaalsContact CE2-OE1 3.3Å; Y144-Q147 VanDerWaalsContact O-CB 3.29Å; Y144-Q147 WeakPolarHBondContact O-CB 3.3Å; Y144-Q147 PolarHBondContact O-N 3.49Å; Y144-Y212 AromaticContact CD1-CD2 3.63Å; Y144-Y212 HydrophobicContact CD1-CD2 3.63Å; Y144-Y212 AromaticContact CD1-CE2 3.99Å; Y144-Y212 HydrophobicContact CD1-CE2 3.99Å; Y144-Y212 HydrophobicContact CD2-CD2 4.07Å; Y144-Y212 AromaticContact CD2-CE2 3.53Å; Y144-Y212 HydrophobicContact CD2-CE2 3.53Å; Y144-Y212 HydrophobicContact CE1-CD2 4.13Å; Y144-Y212 HydrophobicContact CE1-CE2 4.47Å; Y144-Y212 HydrophobicContact CE2-CE2 4.06Å; Y144-Y212 AromaticContact CG-CD2 3.58Å; Y144-Y212 HydrophobicContact CG-CD2 3.58Å; Y144-Y212 AromaticContact CG-CE2 3.46Å; Y144-Y212 HydrophobicContact CG-CE2 3.46Å; Y144-Y212 VanDerWaalsContact CG-CE2 3.46Å
145S65Low69.5Low32 Ų3252 Ų5222%0.22427%0.273CS..Hα-helixtrans-60.9-23.9176.5770000112.8M141 G142M141-S145 PolarHBondContact O-N 3.18Å; M141-S145 VanDerWaalsContact O-N 3.1Å; G142-S145 PolarHBondContact O-N 3Å; G142-S145 PolarHBondContact O-OG 3.26Å
146L65.3Low68.6Low10 Ų1052.7 Ų52.75%0.05228%0.283CS..THydrogen-bonded Turntrans-91.6-7.1179.7-62.9165000113.2V8 G142 A143 Y144 S148 Y149 L154 F157V8-L146 HydrophobicContact CG1-CD2 4.12Å; V8-L146 HydrophobicContact CG2-CD2 3.66Å; V8-L146 HydrophobicContact CG2-CG 4.29Å; G142-L146 WeakPolarHBondContact O-CG 3.16Å; G142-L146 PolarHBondContact O-N 3.04Å; A143-L146 PolarHBondContact O-N 3.43Å; Y144-L146 PolarHBondContact O-N 3.47Å; Y144-L146 VanDerWaalsContact O-N 3.14Å; L146-S148 PolarHBondContact O-N 3.2Å; L146-S148 VanDerWaalsContact O-N 3.15Å; L146-Y149 HydrophobicContact CD2-CD2 4.15Å; L146-Y149 HydrophobicContact CD2-CE2 4.19Å; L146-Y149 WeakPolarHBondContact O-CB 3.42Å; L146-Y149 PolarHBondContact O-N 3.42Å; L146-L154 HydrophobicContact CB-CD1 3.51Å; L146-L154 HydrophobicContact CD1-CD1 4.36Å; L146-F157 HydrophobicContact CD1-CD1 3.53Å; L146-F157 HydrophobicContact CD1-CD2 4.44Å; L146-F157 HydrophobicContact CD1-CE1 3.26Å; L146-F157 HydrophobicContact CD1-CE2 4.2Å; L146-F157 HydrophobicContact CD1-CG 4.13Å; L146-F157 HydrophobicContact CD1-CZ 3.62Å
147Q64.5Low68Low136 Ų13654.1 Ų54.164%0.63629%0.286SS*.THydrogen-bonded Turntrans-66.5-18.8-176.9-162.1173.113.200113.5A143 Y144 Y149A143-Q147 PolarHBondContact O-N 3.47Å; Y144-Q147 VanDerWaalsContact CD2-OE1 3.24Å; Y144-Q147 VanDerWaalsContact CE2-OE1 3.3Å; Y144-Q147 VanDerWaalsContact O-CB 3.29Å; Y144-Q147 WeakPolarHBondContact O-CB 3.3Å; Y144-Q147 PolarHBondContact O-N 3.49Å; Q147-Y149 VanDerWaalsContact C-N 3.31Å
148S68.4Low67.4Low75 Ų7557.9 Ų57.952%0.52430%0.302SS..THydrogen-bonded Turntrans-81.8-4.817463.80000114.3K4 L146K4-S148 PolarHBondContact NZ-OG 3.35Å; L146-S148 PolarHBondContact O-N 3.2Å; L146-S148 VanDerWaalsContact O-N 3.15Å
149Y68.2Low67.1Low77 Ų7761.7 Ų61.730%0.30232%0.323SS..SBendtrans-89.1155.4179.3-72.8-97.5000111.3L146 Q147L146-Y149 HydrophobicContact CD2-CD2 4.15Å; L146-Y149 HydrophobicContact CD2-CE2 4.19Å; L146-Y149 WeakPolarHBondContact O-CB 3.42Å; L146-Y149 PolarHBondContact O-N 3.42Å; Q147-Y149 VanDerWaalsContact C-N 3.31Å
150N73.8Confident67.2Low117 Ų11768.4 Ų68.463%0.62634%0.342SS*.  trans-60.4145.7174-71.2-9.9000109.7H152 Q153 L154N150-H152 VanDerWaalsContact C-N 3.27Å; N150-H152 PolarHBondContact O-N 3.27Å; N150-Q153 HydrophobicContact CB-CG 4.49Å; N150-Q153 WeakPolarHBondContact O-CB 3.29Å; N150-Q153 PolarHBondContact O-N 2.89Å; N150-L154 PolarHBondContact O-N 3.19Å
151Q61.9Low67.4Low58 Ų5868.4 Ų68.427%0.27134%0.337SS..Hα-helixtrans-58.7-38.6-175.5-173.1-155.3-34.100112.9Q153 L154 L155 Q521Q151-Q153 VanDerWaalsContact C-N 3.33Å; Q151-Q153 PolarHBondContact O-N 2.63Å; Q151-L154 WeakPolarHBondContact O-CB 3.42Å; Q151-L154 PolarHBondContact O-N 3.08Å; Q151-L155 HydrophobicContact CG-CD1 4.09Å; Q151-L155 VanDerWaalsContact O-CG 3.23Å; Q151-L155 WeakPolarHBondContact O-CG 3.45Å; Q151-L155 PolarHBondContact O-N 2.89Å; Q151-Q521 VanDerWaalsContact NE2-CA 3.34Å; Q151-Q521 PolarHBondContact NE2-O 3.39Å; Q151-Q521 VanDerWaalsContact OE1-OE1 3.07Å
152H66.6Low67.7Low76 Ų7671.7 Ų71.735%0.35235%0.349SS..Hα-helixtrans-58.7-44.9175.3174.7-113.9000112N150 L154 L155 S156 F528N150-H152 VanDerWaalsContact C-N 3.27Å; N150-H152 PolarHBondContact O-N 3.27Å; H152-L154 VanDerWaalsContact C-N 3.34Å; H152-L154 PolarHBondContact O-N 3.16Å; H152-L155 PolarHBondContact O-N 3.48Å; H152-S156 PolarHBondContact O-N 3.08Å; H152-F528 HydrophobicContact CB-CE2 4.48Å; H152-F528 AromaticContact CD2-CD1 3.27Å; H152-F528 WeakPolarHBondContact CD2-CD1 3.45Å; H152-F528 AromaticContact CD2-CD2 3.24Å; H152-F528 WeakPolarHBondContact CD2-CD2 3.18Å; H152-F528 AromaticContact CD2-CE1 3.37Å; H152-F528 WeakPolarHBondContact CD2-CE1 3.27Å; H152-F528 AromaticContact CD2-CE2 3.22Å; H152-F528 WeakPolarHBondContact CD2-CE2 3.3Å; H152-F528 AromaticContact CD2-CG 3.28Å; H152-F528 WeakPolarHBondContact CD2-CG 3.44Å; H152-F528 AromaticContact CD2-CZ 3.32Å; H152-F528 WeakPolarHBondContact CD2-CZ 3.3Å; H152-F528 AromaticContact CE1-CD1 3.93Å; H152-F528 AromaticContact CE1-CE1 3.29Å; H152-F528 WeakPolarHBondContact CE1-CE1 3.29Å; H152-F528 AromaticContact CE1-CE2 3.91Å; H152-F528 AromaticContact CE1-CZ 3.24Å; H152-F528 WeakPolarHBondContact CE1-CZ 3.46Å; H152-F528 AromaticContact CG-CD2 3.92Å; H152-F528 AromaticContact CG-CE2 3.56Å; H152-F528 AromaticContact CG-CZ 3.74Å; H152-F528 AromaticContact ND1-CE2 3.95Å; H152-F528 AromaticContact ND1-CZ 3.67Å; H152-F528 AromaticContact NE2-CD1 2.97Å; H152-F528 WeakPolarHBondContact NE2-CD1 3.41Å; H152-F528 AromaticContact NE2-CD2 3.81Å; H152-F528 AromaticContact NE2-CE1 2.78Å; H152-F528 WeakPolarHBondContact NE2-CE1 3.27Å; H152-F528 AromaticContact NE2-CE2 3.58Å; H152-F528 AromaticContact NE2-CG 3.56Å; H152-F528 AromaticContact NE2-CZ 3.09Å; H152-F528 WeakPolarHBondContact NE2-CZ 3.43Å
153Q66.9Low68.3Low100 Ų10077 Ų7747%0.46737%0.366SS..Hα-helixtrans-66-36.7177.4-66.9173.8-19.700112.2N150 Q151 F157N150-Q153 HydrophobicContact CB-CG 4.49Å; N150-Q153 WeakPolarHBondContact O-CB 3.29Å; N150-Q153 PolarHBondContact O-N 2.89Å; Q151-Q153 VanDerWaalsContact C-N 3.33Å; Q151-Q153 PolarHBondContact O-N 2.63Å; Q153-F157 WeakPolarHBondContact O-CB 3.22Å; Q153-F157 PolarHBondContact O-N 3.11Å
154L65.9Low69.2Low45 Ų4578.4 Ų78.424%0.23637%0.368CS..Hα-helixtrans-64.1-41176.6-174.568.8000111.7L146 N150 Q151 H152 F157 F158L146-L154 HydrophobicContact CB-CD1 3.51Å; L146-L154 HydrophobicContact CD1-CD1 4.36Å; N150-L154 PolarHBondContact O-N 3.19Å; Q151-L154 WeakPolarHBondContact O-CB 3.42Å; Q151-L154 PolarHBondContact O-N 3.08Å; H152-L154 VanDerWaalsContact C-N 3.34Å; H152-L154 PolarHBondContact O-N 3.16Å; L154-F157 WeakPolarHBondContact O-CB 3.4Å; L154-F157 PolarHBondContact O-N 3.06Å; L154-F158 HydrophobicContact CD1-CD2 4.16Å; L154-F158 HydrophobicContact CD1-CE2 3.53Å; L154-F158 HydrophobicContact CD1-CZ 4.29Å; L154-F158 HydrophobicContact CD2-CE2 4.21Å; L154-F158 HydrophobicContact CG-CD2 3.95Å; L154-F158 HydrophobicContact CG-CE2 3.63Å; L154-F158 WeakPolarHBondContact O-CD2 3.41Å; L154-F158 PolarHBondContact O-N 3.43Å
155L61.6Low69.7Low27 Ų2773.5 Ų73.514%0.14135%0.351CS..Hα-helixtrans-69.4-46.7179.2-69.2168000112Q151 H152 F157 F158 N159 A525Q151-L155 HydrophobicContact CG-CD1 4.09Å; Q151-L155 VanDerWaalsContact O-CG 3.23Å; Q151-L155 WeakPolarHBondContact O-CG 3.45Å; Q151-L155 PolarHBondContact O-N 2.89Å; H152-L155 PolarHBondContact O-N 3.48Å; L155-F157 VanDerWaalsContact C-N 3.26Å; L155-F157 PolarHBondContact O-N 2.86Å; L155-F158 PolarHBondContact O-N 3.07Å; L155-F158 VanDerWaalsContact O-N 3.16Å; L155-N159 PolarHBondContact O-N 2.9Å; L155-A525 HydrophobicContact CD1-CB 3.57Å; L155-A525 HydrophobicContact CD2-CB 3.3Å; L155-A525 HydrophobicContact CG-CB 3.97Å
156S67.3Low70.5Confident45 Ų4572.7 Ų72.732%0.31534%0.344SS..Hα-helixtrans-55.9-43.5172.8-176.70000111.3H152 F158 N159 W160H152-S156 PolarHBondContact O-N 3.08Å; S156-F158 PolarHBondContact O-N 3.17Å; S156-N159 PolarHBondContact O-N 3.36Å; S156-W160 VanDerWaalsContact O-CD1 3.26Å; S156-W160 PolarHBondContact O-N 3.23Å
157F70.4Confident71.4Confident48 Ų4877 Ų7721%0.21137%0.366CS..Hα-helixtrans-58.4-48.1175.1175.7-87.6000112.7V8 L12 L146 Q153 L154 L155 N159 W160 F161V8-F157 HydrophobicContact CG1-CD2 4.37Å; V8-F157 HydrophobicContact CG1-CE2 3.41Å; V8-F157 VanDerWaalsContact CG1-CE2 3.41Å; V8-F157 HydrophobicContact CG1-CZ 3.87Å; L12-F157 HydrophobicContact CD1-CE2 3.71Å; L12-F157 HydrophobicContact CD1-CZ 4.03Å; L12-F157 HydrophobicContact CD2-CE1 4.48Å; L12-F157 HydrophobicContact CD2-CE2 4.15Å; L12-F157 HydrophobicContact CD2-CZ 3.62Å; L12-F157 HydrophobicContact CG-CE2 4.14Å; L12-F157 HydrophobicContact CG-CZ 3.93Å; L146-F157 HydrophobicContact CD1-CD1 3.53Å; L146-F157 HydrophobicContact CD1-CD2 4.44Å; L146-F157 HydrophobicContact CD1-CE1 3.26Å; L146-F157 HydrophobicContact CD1-CE2 4.2Å; L146-F157 HydrophobicContact CD1-CG 4.13Å; L146-F157 HydrophobicContact CD1-CZ 3.62Å; Q153-F157 WeakPolarHBondContact O-CB 3.22Å; Q153-F157 PolarHBondContact O-N 3.11Å; L154-F157 WeakPolarHBondContact O-CB 3.4Å; L154-F157 PolarHBondContact O-N 3.06Å; L155-F157 VanDerWaalsContact C-N 3.26Å; L155-F157 PolarHBondContact O-N 2.86Å; F157-N159 VanDerWaalsContact C-N 3.33Å; F157-N159 PolarHBondContact O-N 2.88Å; F157-W160 PolarHBondContact O-N 3.09Å; F157-F161 WeakPolarHBondContact O-CB 3.46Å; F157-F161 PolarHBondContact O-N 3.35Å
158F69.7Low72.4Confident80 Ų8071.6 Ų71.635%0.35134%0.342SS..Hα-helixtrans-67.9-32.4-179.9-77.4-61000113A143 L154 L155 S156 F161 Y162A143-F158 HydrophobicContact CB-CZ 4.25Å; L154-F158 HydrophobicContact CD1-CD2 4.16Å; L154-F158 HydrophobicContact CD1-CE2 3.53Å; L154-F158 HydrophobicContact CD1-CZ 4.29Å; L154-F158 HydrophobicContact CD2-CE2 4.21Å; L154-F158 HydrophobicContact CG-CD2 3.95Å; L154-F158 HydrophobicContact CG-CE2 3.63Å; L154-F158 WeakPolarHBondContact O-CD2 3.41Å; L154-F158 PolarHBondContact O-N 3.43Å; L155-F158 PolarHBondContact O-N 3.07Å; L155-F158 VanDerWaalsContact O-N 3.16Å; S156-F158 PolarHBondContact O-N 3.17Å; F158-F161 PolarHBondContact O-N 2.78Å; F158-Y162 WeakPolarHBondContact O-CB 3.35Å; F158-Y162 PolarHBondContact O-N 2.92Å
159N70.9Confident73.2Confident82 Ų8268.2 Ų68.244%0.43932%0.318SS..Hα-helixtrans-66.5-48.6173.6-73.9-7.2000111.4L155 S156 F157 F161 Y162 W163L155-N159 PolarHBondContact O-N 2.9Å; S156-N159 PolarHBondContact O-N 3.36Å; F157-N159 VanDerWaalsContact C-N 3.33Å; F157-N159 PolarHBondContact O-N 2.88Å; N159-F161 VanDerWaalsContact C-N 3.31Å; N159-F161 PolarHBondContact O-N 2.63Å; N159-Y162 WeakPolarHBondContact O-CB 3.46Å; N159-Y162 PolarHBondContact O-N 3.22Å; N159-W163 PolarHBondContact O-N 3.21Å
160W73.9Confident74.1Confident188 Ų18865.7 Ų65.771%0.71231%0.311SS*.Hα-helixtrans-61.2-41.1174.4-84.5109.2000112.2S156 F157 Y162 W163 L164S156-W160 VanDerWaalsContact O-CD1 3.26Å; S156-W160 PolarHBondContact O-N 3.23Å; F157-W160 PolarHBondContact O-N 3.09Å; W160-Y162 VanDerWaalsContact C-N 3.34Å; W160-Y162 PolarHBondContact O-N 3.17Å; W160-W163 PolarHBondContact O-N 2.85Å; W160-L164 VanDerWaalsContact O-CB 3.23Å; W160-L164 WeakPolarHBondContact O-CB 3.44Å; W160-L164 PolarHBondContact O-N 3.41Å
161F73.6Confident74.9Confident54 Ų5463.9 Ų63.924%0.23730%0.304CS..Hα-helixtrans-58.4-45.9174.5174.9-104.3000111.8L12 E15 F157 F158 N159 L164 V165L12-F161 HydrophobicContact CD2-CD2 3.37Å; L12-F161 HydrophobicContact CD2-CE2 3.86Å; L12-F161 HydrophobicContact CD2-CG 4.43Å; E15-F161 HydrophobicContact CB-CE2 4.32Å; E15-F161 HydrophobicContact CG-CE2 3.76Å; E15-F161 HydrophobicContact CG-CZ 3.73Å; F157-F161 WeakPolarHBondContact O-CB 3.46Å; F157-F161 PolarHBondContact O-N 3.35Å; F158-F161 PolarHBondContact O-N 2.78Å; N159-F161 VanDerWaalsContact C-N 3.31Å; N159-F161 PolarHBondContact O-N 2.63Å; F161-L164 PolarHBondContact O-N 3.45Å; F161-V165 HydrophobicContact CD2-CG2 4.36Å; F161-V165 HydrophobicContact CE1-CG2 4.21Å; F161-V165 HydrophobicContact CE2-CG2 4Å; F161-V165 HydrophobicContact CZ-CG2 3.92Å; F161-V165 WeakPolarHBondContact O-CG2 3.37Å; F161-V165 PolarHBondContact O-N 3.44Å
162Y73.3Confident76Confident85 Ų8561.1 Ų61.133%0.33329%0.291SS..Hα-helixtrans-61.5-47177.3179.8-97000112.2F158 N159 W160 L164 V165 N166 L324F158-Y162 WeakPolarHBondContact O-CB 3.35Å; F158-Y162 PolarHBondContact O-N 2.92Å; N159-Y162 WeakPolarHBondContact O-CB 3.46Å; N159-Y162 PolarHBondContact O-N 3.22Å; W160-Y162 VanDerWaalsContact C-N 3.34Å; W160-Y162 PolarHBondContact O-N 3.17Å; Y162-L164 VanDerWaalsContact C-N 3.33Å; Y162-L164 PolarHBondContact O-N 2.85Å; Y162-V165 PolarHBondContact O-N 3.42Å; Y162-N166 WeakPolarHBondContact CE1-ND2 3.3Å; Y162-N166 PolarHBondContact O-N 3.03Å; Y162-N166 PolarHBondContact O-ND2 3.12Å; Y162-L324 VanDerWaalsContact OH-CD1 3.25Å; Y162-L324 WeakPolarHBondContact OH-CD1 3.45Å; Y162-L324 VanDerWaalsContact OH-CG 3.24Å; Y162-L324 WeakPolarHBondContact OH-CG 3.19Å
163W77.6Confident77Confident118 Ų11858.1 Ų58.145%0.44728%0.277SS..Hα-helixtrans-59.4-44.4174.9-89.5100.6000112N159 W160 V165 N166 L167 L325N159-W163 PolarHBondContact O-N 3.21Å; W160-W163 PolarHBondContact O-N 2.85Å; W163-V165 PolarHBondContact O-N 3.49Å; W163-N166 PolarHBondContact O-N 3.3Å; W163-L167 WeakPolarHBondContact O-CB 3.43Å; W163-L167 PolarHBondContact O-N 2.81Å; W163-L325 HydrophobicContact CD2-CD2 4.2Å; W163-L325 HydrophobicContact CE3-CD2 3.64Å; W163-L325 HydrophobicContact CH2-CB 4.13Å; W163-L325 HydrophobicContact CH2-CD2 4.17Å; W163-L325 HydrophobicContact CZ3-CB 4.15Å; W163-L325 HydrophobicContact CZ3-CD1 4.19Å; W163-L325 HydrophobicContact CZ3-CD2 3.63Å; W163-L325 HydrophobicContact CZ3-CG 4.21Å
164L81.9Confident78Confident71 Ų7157 Ų5737%0.37227%0.274SS..Hα-helixtrans-65-39.3-178.3-169.566.5000112.4L16 W160 F161 Y162 N168L16-L164 HydrophobicContact CD1-CD2 3.55Å; L16-L164 HydrophobicContact CD1-CG 4.08Å; L16-L164 HydrophobicContact CD2-CD2 3.9Å; L16-L164 HydrophobicContact CD2-CG 3.69Å; L16-L164 HydrophobicContact CG-CD2 4.21Å; L16-L164 HydrophobicContact CG-CG 4.49Å; W160-L164 VanDerWaalsContact O-CB 3.23Å; W160-L164 WeakPolarHBondContact O-CB 3.44Å; W160-L164 PolarHBondContact O-N 3.41Å; F161-L164 PolarHBondContact O-N 3.45Å; Y162-L164 VanDerWaalsContact C-N 3.33Å; Y162-L164 PolarHBondContact O-N 2.85Å; L164-N168 VanDerWaalsContact O-CB 3.24Å; L164-N168 WeakPolarHBondContact O-CB 3.24Å; L164-N168 PolarHBondContact O-N 3.08Å
165V76.8Confident79Confident19 Ų1956.5 Ų56.512%0.11528%0.279CS..Hα-helixtrans-65.8-39.7176.3169.70000111.6R19 F161 Y162 W163 N168 S169R19-V165 HydrophobicContact CG-CG1 4.46Å; F161-V165 HydrophobicContact CD2-CG2 4.36Å; F161-V165 HydrophobicContact CE1-CG2 4.21Å; F161-V165 HydrophobicContact CE2-CG2 4Å; F161-V165 HydrophobicContact CZ-CG2 3.92Å; F161-V165 WeakPolarHBondContact O-CG2 3.37Å; F161-V165 PolarHBondContact O-N 3.44Å; Y162-V165 PolarHBondContact O-N 3.42Å; W163-V165 PolarHBondContact O-N 3.49Å; V165-N168 WeakPolarHBondContact O-CB 3.45Å; V165-N168 PolarHBondContact O-N 3.31Å; V165-S169 PolarHBondContact O-N 3.36Å; V165-S169 VanDerWaalsContact O-N 3.12Å
166N80.9Confident80.1Confident15 Ų1555.6 Ų55.68%0.0827%0.274CS..Hα-helixtrans-74.5-36.4177.3-74.4-72.9000112.4Y162 W163 N168 S169 T170 I321 L325Y162-N166 WeakPolarHBondContact CE1-ND2 3.3Å; Y162-N166 PolarHBondContact O-N 3.03Å; Y162-N166 PolarHBondContact O-ND2 3.12Å; W163-N166 PolarHBondContact O-N 3.3Å; N166-N168 VanDerWaalsContact C-N 3.3Å; N166-N168 PolarHBondContact O-N 3.42Å; N166-S169 PolarHBondContact O-N 2.72Å; N166-S169 PolarHBondContact O-OG 3.01Å; N166-T170 PolarHBondContact O-N 3.48Å; N166-T170 PolarHBondContact O-OG1 2.83Å; N166-I321 HydrophobicContact CB-CG2 4.37Å; N166-L325 HydrophobicContact CB-CD1 4.21Å; N166-L325 HydrophobicContact CB-CD2 3.33Å; N166-L325 HydrophobicContact CB-CG 3.96Å
167L85.1Confident80.9Confident100 Ų10053.5 Ų53.552%0.52426%0.26SS..Hα-helixtrans-62.6-41.1171.5-178.165.1000110.9W163 S169 T170 V171W163-L167 WeakPolarHBondContact O-CB 3.43Å; W163-L167 PolarHBondContact O-N 2.81Å; L167-S169 PolarHBondContact O-N 2.93Å; L167-T170 WeakPolarHBondContact O-CB 3.12Å; L167-T170 PolarHBondContact O-N 3.07Å; L167-V171 WeakPolarHBondContact O-CG2 3.23Å; L167-V171 PolarHBondContact O-N 3.28Å
168N86.3Confident81.7Confident23 Ų2355 Ų5512%0.12327%0.265CS..Hα-helixtrans-57.8-46.4174.9176.3-94.5000111.8L16 F20 L164 V165 N166 T170 V171 V172L16-N168 HydrophobicContact CD2-CB 4.18Å; F20-N168 PolarHBondContact N-OD1 2.87Å; L164-N168 VanDerWaalsContact O-CB 3.24Å; L164-N168 WeakPolarHBondContact O-CB 3.24Å; L164-N168 PolarHBondContact O-N 3.08Å; V165-N168 WeakPolarHBondContact O-CB 3.45Å; V165-N168 PolarHBondContact O-N 3.31Å; N166-N168 VanDerWaalsContact C-N 3.3Å; N166-N168 PolarHBondContact O-N 3.42Å; N168-T170 PolarHBondContact O-N 2.88Å; N168-V171 PolarHBondContact O-N 3.43Å; N168-V172 VanDerWaalsContact O-CG2 3.23Å; N168-V172 WeakPolarHBondContact O-CG2 3.49Å; N168-V172 PolarHBondContact O-N 3.41Å
169S84.3Confident82.5Confident4 Ų454 Ų543%0.02826%0.263CS..Hα-helixtrans-64-39.7177.365.20000111.9V165 N166 L167 V171 V172 F173 I321V165-S169 PolarHBondContact O-N 3.36Å; V165-S169 VanDerWaalsContact O-N 3.12Å; N166-S169 PolarHBondContact O-N 2.72Å; N166-S169 PolarHBondContact O-OG 3.01Å; L167-S169 PolarHBondContact O-N 2.93Å; S169-V171 PolarHBondContact O-N 3.32Å; S169-V172 PolarHBondContact O-N 2.87Å; S169-F173 WeakPolarHBondContact O-CB 3.32Å; S169-F173 WeakPolarHBondContact O-CD2 3.42Å; S169-F173 WeakPolarHBondContact O-CG 3.3Å; S169-F173 PolarHBondContact O-N 3.5Å; S169-I321 WeakPolarHBondContact OG-CD1 3.23Å
170T87.6Confident82.9Confident25 Ų2550.3 Ų50.315%0.15324%0.243CC..Hα-helixtrans-58.7-46.2173.2-600000112.4N166 L167 N168 V172 F173 L174 V318N166-T170 PolarHBondContact O-N 3.48Å; N166-T170 PolarHBondContact O-OG1 2.83Å; L167-T170 WeakPolarHBondContact O-CB 3.12Å; L167-T170 PolarHBondContact O-N 3.07Å; N168-T170 PolarHBondContact O-N 2.88Å; T170-V172 VanDerWaalsContact C-N 3.32Å; T170-V172 PolarHBondContact O-N 3.46Å; T170-F173 PolarHBondContact O-N 3.45Å; T170-L174 HydrophobicContact CG2-CD1 3.83Å; T170-L174 HydrophobicContact CG2-CG 4.46Å; T170-L174 WeakPolarHBondContact O-CB 3.33Å; T170-L174 WeakPolarHBondContact O-CG 3.33Å; T170-L174 PolarHBondContact O-N 3.48Å; T170-V318 HydrophobicContact CG2-CG1 3.82Å; T170-V318 HydrophobicContact CG2-CG2 4.38Å
171V89.4Confident83.4Confident78 Ų7841.6 Ų41.647%0.47321%0.21SC..Hα-helixtrans-61.2-41.7177.5171.30000111.2L167 N168 S169 G175L167-V171 WeakPolarHBondContact O-CG2 3.23Å; L167-V171 PolarHBondContact O-N 3.28Å; N168-V171 PolarHBondContact O-N 3.43Å; S169-V171 PolarHBondContact O-N 3.32Å; V171-G175 WeakPolarHBondContact O-CA 3.19Å; V171-G175 PolarHBondContact O-N 3.01Å
172V86.9Confident83.6Confident0 Ų041 Ų410%021%0.212CC..Iπ-helixtrans-63.8-48.9177.8169.70000111.4F20 F23 N168 S169 T170 L174 I176 A177F20-V172 HydrophobicContact CB-CG2 4.24Å; F20-V172 HydrophobicContact CD2-CG2 3.46Å; F20-V172 VanDerWaalsContact CD2-CG2 3.46Å; F20-V172 HydrophobicContact CE2-CG2 4.06Å; F20-V172 HydrophobicContact CG-CG2 3.86Å; F23-V172 HydrophobicContact CB-CB 4.23Å; F23-V172 HydrophobicContact CB-CG1 3.62Å; N168-V172 VanDerWaalsContact O-CG2 3.23Å; N168-V172 WeakPolarHBondContact O-CG2 3.49Å; N168-V172 PolarHBondContact O-N 3.41Å; S169-V172 PolarHBondContact O-N 2.87Å; T170-V172 VanDerWaalsContact C-N 3.32Å; T170-V172 PolarHBondContact O-N 3.46Å; V172-L174 PolarHBondContact O-N 2.96Å; V172-I176 HydrophobicContact CB-CD1 3.99Å; V172-I176 HydrophobicContact CG1-CD1 3.97Å; V172-I176 HydrophobicContact CG2-CD1 3.68Å; V172-I176 WeakPolarHBondContact O-CB 3.35Å; V172-I176 PolarHBondContact O-N 3.23Å; V172-A177 PolarHBondContact O-N 3.32Å; V172-A177 VanDerWaalsContact O-N 3.1Å
173F86.9Confident83.4Confident13 Ų1341.7 Ų41.76%0.05723%0.225CC..Iπ-helixtrans-71.8-25.3-176.1-74.5-53.6000114.1F23 C27 S169 T170 A177 G314 A315 N317 V318 I321F23-F173 HydrophobicContact CB-CZ 4.31Å; F23-F173 AromaticContact CD1-CE2 4Å; F23-F173 HydrophobicContact CD1-CE2 4Å; F23-F173 AromaticContact CD1-CZ 3.68Å; F23-F173 HydrophobicContact CD1-CZ 3.68Å; F23-F173 HydrophobicContact CE1-CE2 4.45Å; F23-F173 HydrophobicContact CE1-CZ 4.36Å; F23-F173 HydrophobicContact CG-CE2 4.37Å; F23-F173 HydrophobicContact CG-CZ 4.26Å; C27-F173 HydrophobicContact CB-CD1 3.48Å; C27-F173 VanDerWaalsContact CB-CD1 3.48Å; C27-F173 HydrophobicContact CB-CE1 3.45Å; C27-F173 VanDerWaalsContact CB-CE1 3.45Å; S169-F173 WeakPolarHBondContact O-CB 3.32Å; S169-F173 WeakPolarHBondContact O-CD2 3.42Å; S169-F173 WeakPolarHBondContact O-CG 3.3Å; S169-F173 PolarHBondContact O-N 3.5Å; T170-F173 PolarHBondContact O-N 3.45Å; F173-A177 VanDerWaalsContact O-CB 3.28Å; F173-A177 WeakPolarHBondContact O-CB 3.46Å; F173-G314 WeakPolarHBondContact CB-O 3.43Å; F173-G314 CarbonylContact O-C 3.56Å; F173-G314 VanDerWaalsContact O-C 3.23Å; F173-G314 WeakPolarHBondContact O-CA 3.45Å; F173-A315 PolarHBondContact O-N 3.37Å; F173-N317 HydrophobicContact CD1-CB 3.91Å; F173-N317 WeakPolarHBondContact CD1-ND2 3.48Å; F173-N317 HydrophobicContact CD2-CB 4.06Å; F173-N317 HydrophobicContact CE1-CB 3.98Å; F173-N317 WeakPolarHBondContact CE1-ND2 3.08Å; F173-N317 HydrophobicContact CE2-CB 4.15Å; F173-N317 HydrophobicContact CG-CB 3.97Å; F173-N317 HydrophobicContact CZ-CB 4.12Å; F173-V318 HydrophobicContact CB-CG2 3.7Å; F173-I321 HydrophobicContact CD2-CD1 3.6Å; F173-I321 HydrophobicContact CE2-CD1 3.7Å
174L88.8Confident82.8Confident77 Ų7737.1 Ų37.140%0.40321%0.212SC..Iπ-helixtrans-91.6-56174-66.9175.9000112.1T170 V172 Y178 A315 V318T170-L174 HydrophobicContact CG2-CD1 3.83Å; T170-L174 HydrophobicContact CG2-CG 4.46Å; T170-L174 WeakPolarHBondContact O-CB 3.33Å; T170-L174 WeakPolarHBondContact O-CG 3.33Å; T170-L174 PolarHBondContact O-N 3.48Å; V172-L174 PolarHBondContact O-N 2.96Å; L174-Y178 WeakPolarHBondContact O-CB 3.4Å; L174-Y178 PolarHBondContact O-N 3.32Å; L174-A315 HydrophobicContact CD2-CB 3.69Å; L174-V318 HydrophobicContact CD1-CG2 4.42Å; L174-V318 HydrophobicContact CD2-CG2 3.89Å; L174-V318 HydrophobicContact CG-CG2 3.78Å
175G85.9Confident82.2Confident34 Ų3436.2 Ų36.235%0.35121%0.206SC..Iπ-helixtrans-77-58.8-171.100000112.5V171 Y178 I179V171-G175 WeakPolarHBondContact O-CA 3.19Å; V171-G175 PolarHBondContact O-N 3.01Å; G175-Y178 WeakPolarHBondContact O-CB 3.28Å; G175-Y178 PolarHBondContact O-N 2.95Å; G175-I179 WeakPolarHBondContact O-CG1 3.39Å; G175-I179 PolarHBondContact O-N 2.94Å
176I83.8Confident81.8Confident8 Ų837.2 Ų37.24%0.04121%0.211CC..Iπ-helixtrans-70.3-42.4-172.3-49.2174.6000110.7F20 V172 Y178 I179 Q180 I191F20-I176 HydrophobicContact CD1-CD1 4.05Å; F20-I176 HydrophobicContact CD2-CD1 3.92Å; F20-I176 HydrophobicContact CE1-CD1 3.47Å; F20-I176 VanDerWaalsContact CE1-CD1 3.47Å; F20-I176 HydrophobicContact CE2-CD1 3.32Å; F20-I176 HydrophobicContact CE2-CG1 4.25Å; F20-I176 HydrophobicContact CG-CD1 4.27Å; F20-I176 HydrophobicContact CZ-CD1 3.06Å; F20-I176 HydrophobicContact CZ-CG1 4Å; V172-I176 HydrophobicContact CB-CD1 3.99Å; V172-I176 HydrophobicContact CG1-CD1 3.97Å; V172-I176 HydrophobicContact CG2-CD1 3.68Å; V172-I176 WeakPolarHBondContact O-CB 3.35Å; V172-I176 PolarHBondContact O-N 3.23Å; I176-Y178 PolarHBondContact O-N 3.26Å; I176-I179 PolarHBondContact O-N 3.31Å; I176-I179 VanDerWaalsContact O-N 3.13Å; I176-Q180 HydrophobicContact CG2-CG 4.36Å; I176-Q180 WeakPolarHBondContact O-CB 3.4Å; I176-Q180 WeakPolarHBondContact O-CG 3.41Å; I176-Q180 PolarHBondContact O-N 2.86Å; I176-Q180 PolarHBondContact O-OE1 2.98Å; I176-I191 HydrophobicContact CD1-CG2 4.14Å; I176-I191 HydrophobicContact CG1-CG2 4.39Å; I176-I191 HydrophobicContact CG2-CD1 4.34Å; I176-I191 HydrophobicContact CG2-CG2 4.19Å
177A85.2Confident81.3Confident1 Ų141.2 Ų41.21%0.00823%0.232CC..Hα-helixtrans-58.3-38.8174.100000111.5V172 F173 Q180 Q181 P312V172-A177 PolarHBondContact O-N 3.32Å; V172-A177 VanDerWaalsContact O-N 3.1Å; F173-A177 VanDerWaalsContact O-CB 3.28Å; F173-A177 WeakPolarHBondContact O-CB 3.46Å; A177-Q180 PolarHBondContact O-N 3.37Å; A177-Q181 WeakPolarHBondContact O-CB 3.47Å; A177-Q181 PolarHBondContact O-N 2.93Å; A177-P312 HydrophobicContact CB-CB 3.92Å
178Y87.4Confident80.7Confident80 Ų8036.5 Ų36.531%0.31421%0.207SC..Hα-helixtrans-64.7-45.1174.4-179.3-100.8000112.2L174 G175 I176 Q180 Q181 S182 V183 L309 L310L174-Y178 WeakPolarHBondContact O-CB 3.4Å; L174-Y178 PolarHBondContact O-N 3.32Å; G175-Y178 WeakPolarHBondContact O-CB 3.28Å; G175-Y178 PolarHBondContact O-N 2.95Å; I176-Y178 PolarHBondContact O-N 3.26Å; Y178-Q180 VanDerWaalsContact C-N 3.34Å; Y178-Q180 PolarHBondContact O-N 3.33Å; Y178-Q181 PolarHBondContact O-N 2.96Å; Y178-S182 WeakPolarHBondContact CD2-OG 3.42Å; Y178-S182 WeakPolarHBondContact CE1-OG 3.36Å; Y178-S182 VanDerWaalsContact CE2-OG 3.31Å; Y178-S182 WeakPolarHBondContact CE2-OG 3.16Å; Y178-S182 VanDerWaalsContact CZ-OG 3.3Å; Y178-S182 PolarHBondContact O-N 2.89Å; Y178-S182 PolarHBondContact O-OG 3.33Å; Y178-V183 HydrophobicContact CD1-CG2 4.07Å; Y178-V183 HydrophobicContact CE1-CG2 3.62Å; Y178-L309 HydrophobicContact CE2-CD2 4.41Å; Y178-L310 WeakPolarHBondContact CE2-O 3.31Å
179I85.4Confident80.1Confident60 Ų6036.5 Ų36.531%0.30821%0.206SC..Iπ-helixtrans-60-45.8176.9-66.5166.1000110.6G175 I176 V183 A184 I191G175-I179 WeakPolarHBondContact O-CG1 3.39Å; G175-I179 PolarHBondContact O-N 2.94Å; I176-I179 PolarHBondContact O-N 3.31Å; I176-I179 VanDerWaalsContact O-N 3.13Å; I179-V183 PolarHBondContact O-N 3.36Å; I179-A184 HydrophobicContact CG2-CB 4.28Å; I179-A184 CarbonylContact O-C 3.52Å; I179-A184 PolarHBondContact O-N 2.81Å; I179-I191 HydrophobicContact CD1-CD1 4.11Å; I179-I191 HydrophobicContact CG2-CD1 4.01Å
180Q80.9Confident80.1Confident4 Ų439.4 Ų39.42%0.01922%0.221CC..Iπ-helixtrans-70.1-31.9-179.6-74.6170.9-73.900112.9N28 I176 A177 Y178N28-Q180 PolarHBondContact ND2-NE2 3.46Å; N28-Q180 PolarHBondContact ND2-OE1 3.43Å; N28-Q180 WeakPolarHBondContact OD1-CB 3.3Å; I176-Q180 HydrophobicContact CG2-CG 4.36Å; I176-Q180 WeakPolarHBondContact O-CB 3.4Å; I176-Q180 WeakPolarHBondContact O-CG 3.41Å; I176-Q180 PolarHBondContact O-N 2.86Å; I176-Q180 PolarHBondContact O-OE1 2.98Å; A177-Q180 PolarHBondContact O-N 3.37Å; Y178-Q180 VanDerWaalsContact C-N 3.34Å; Y178-Q180 PolarHBondContact O-N 3.33Å
181Q83.8Confident80Confident4 Ų440.3 Ų40.32%0.01922%0.224CC..Iπ-helixtrans-82.9-37.5-179.2-175.1178.7-52.500113.5L31 A177 Y178 L311 P312 L383 S384L31-Q181 HydrophobicContact CD2-CB 4.25Å; L31-Q181 HydrophobicContact CD2-CG 4.16Å; A177-Q181 WeakPolarHBondContact O-CB 3.47Å; A177-Q181 PolarHBondContact O-N 2.93Å; Y178-Q181 PolarHBondContact O-N 2.96Å; Q181-L311 PolarHBondContact NE2-O 2.96Å; Q181-P312 VanDerWaalsContact OE1-CA 3.3Å; Q181-L383 HydrophobicContact CG-CD2 3.72Å; Q181-L383 VanDerWaalsContact NE2-CD2 3.29Å; Q181-S384 PolarHBondContact O-N 2.83Å
182S77.4Confident79.7Confident42 Ų4236.8 Ų36.829%0.29420%0.203SC..Iπ-helixtrans-122.5-51-165.866.70000115Y178Y178-S182 WeakPolarHBondContact CD2-OG 3.42Å; Y178-S182 WeakPolarHBondContact CE1-OG 3.36Å; Y178-S182 VanDerWaalsContact CE2-OG 3.31Å; Y178-S182 WeakPolarHBondContact CE2-OG 3.16Å; Y178-S182 VanDerWaalsContact CZ-OG 3.3Å; Y178-S182 PolarHBondContact O-N 2.89Å; Y178-S182 PolarHBondContact O-OG 3.33Å
183V69.1Low79.8Confident100 Ų10039.2 Ų39.261%0.60621%0.214SC*.Iπ-helixtrans-84.2-47.9-168.5-1780000112.4Y178 I179Y178-V183 HydrophobicContact CD1-CG2 4.07Å; Y178-V183 HydrophobicContact CE1-CG2 3.62Å; I179-V183 PolarHBondContact O-N 3.36Å
184A65.5Low79.9Confident21 Ų2142.3 Ų42.317%0.17423%0.234CC..  trans-150.485.4-170.900000111.3I179 N186 L187 G188I179-A184 HydrophobicContact CG2-CB 4.28Å; I179-A184 CarbonylContact O-C 3.52Å; I179-A184 PolarHBondContact O-N 2.81Å; A184-N186 PolarHBondContact O-N 3.2Å; A184-L187 HydrophobicContact CB-CB 3.82Å; A184-L187 HydrophobicContact CB-CD1 4.1Å; A184-L187 HydrophobicContact CB-CG 4.29Å; A184-G188 PolarHBondContact O-N 3.39Å
185Q69.6Low79.9Confident53 Ų5339.2 Ų39.225%0.24822%0.219CC..THydrogen-bonded Turntrans-56.1-49.9-171-59.2168.513.900112.8F189 S384 G385Q185-F189 WeakPolarHBondContact O-CD2 3.3Å; Q185-F189 WeakPolarHBondContact O-CE2 3.42Å; Q185-S384 VanDerWaalsContact CD-O 3.27Å; Q185-S384 WeakPolarHBondContact CG-OG 2.88Å; Q185-S384 PolarHBondContact NE2-O 2.96Å; Q185-S384 PolarHBondContact OE1-O 3.41Å; Q185-G385 VanDerWaalsContact NE2-CA 3.35Å
186N68.6Low80.2Confident39 Ų3937.7 Ų37.721%0.20920%0.203CC..THydrogen-bonded Turntrans-89.1-36.5-175.5-57.6-12.9000111.4A94 F95 A184 G188 F189A94-N186 PolarHBondContact O-ND2 3.45Å; A94-N186 PolarHBondContact O-OD1 3.32Å; F95-N186 WeakPolarHBondContact CE2-O 3.28Å; A184-N186 PolarHBondContact O-N 3.2Å; N186-G188 VanDerWaalsContact C-N 3.27Å; N186-G188 PolarHBondContact O-N 2.74Å; N186-F189 PolarHBondContact O-N 3.44Å
187L70Confident80.5Confident100 Ų10041.1 Ų41.152%0.52422%0.22SC..G310 helixtrans-67.2-28.2178.5-57176.8000112.3F95 A184 F189 L190F95-L187 HydrophobicContact CE1-CD2 3.72Å; F95-L187 HydrophobicContact CZ-CD2 3.57Å; A184-L187 HydrophobicContact CB-CB 3.82Å; A184-L187 HydrophobicContact CB-CD1 4.1Å; A184-L187 HydrophobicContact CB-CG 4.29Å; L187-F189 PolarHBondContact O-N 3.16Å; L187-L190 HydrophobicContact CD2-CD1 4.31Å; L187-L190 VanDerWaalsContact O-CB 3.31Å; L187-L190 WeakPolarHBondContact O-CB 3.31Å; L187-L190 PolarHBondContact O-N 3.06Å
188G72.1Confident80.8Confident0 Ų044.9 Ų44.90%024%0.24CC..G310 helixtrans-61.9-22.917800000113.7A184 N186 L190 I191 P192A184-G188 PolarHBondContact O-N 3.39Å; N186-G188 VanDerWaalsContact C-N 3.27Å; N186-G188 PolarHBondContact O-N 2.74Å; G188-L190 VanDerWaalsContact C-N 3.32Å; G188-I191 WeakPolarHBondContact O-CB 3.5Å; G188-I191 PolarHBondContact O-N 3.4Å; G188-P192 VanDerWaalsContact O-CD 3.3Å; G188-P192 WeakPolarHBondContact O-CD 3.05Å
189F74.3Confident81Confident24 Ų2441.3 Ų41.311%0.10523%0.227CC..G310 helixtrans-74.1-18.8172.8-68.5-82.3000113.4F32 P91 A94 Q185 N186 L187 I191 P192F32-F189 HydrophobicContact CB-CZ 4.06Å; F32-F189 HydrophobicContact CD2-CE1 4.13Å; F32-F189 AromaticContact CD2-CE2 3.75Å; F32-F189 HydrophobicContact CD2-CE2 3.75Å; F32-F189 AromaticContact CD2-CZ 3.31Å; F32-F189 HydrophobicContact CD2-CZ 3.31Å; F32-F189 HydrophobicContact CE2-CE2 4.04Å; F32-F189 AromaticContact CE2-CZ 3.9Å; F32-F189 HydrophobicContact CE2-CZ 3.9Å; F32-F189 HydrophobicContact CG-CE1 4.34Å; F32-F189 AromaticContact CG-CZ 3.81Å; F32-F189 HydrophobicContact CG-CZ 3.81Å; P91-F189 HydrophobicContact CB-CB 4.4Å; P91-F189 HydrophobicContact CG-CB 4.07Å; P91-F189 WeakPolarHBondContact CG-O 3.44Å; A94-F189 HydrophobicContact CB-CB 4.4Å; A94-F189 HydrophobicContact CB-CD2 3.55Å; A94-F189 HydrophobicContact CB-CE2 3.96Å; A94-F189 HydrophobicContact CB-CG 3.96Å; Q185-F189 WeakPolarHBondContact O-CD2 3.3Å; Q185-F189 WeakPolarHBondContact O-CE2 3.42Å; N186-F189 PolarHBondContact O-N 3.44Å; L187-F189 PolarHBondContact O-N 3.16Å; F189-I191 VanDerWaalsContact C-N 3.26Å; F189-I191 PolarHBondContact O-N 2.91Å; F189-P192 WeakPolarHBondContact O-CD 3.2Å
190L83.6Confident81.2Confident64 Ų6440.7 Ų40.734%0.33522%0.224SC..Hα-helixtrans-70.7-22.6172.8-67176.3000112.6P91 F95 L187 G188 F193 T194P91-L190 HydrophobicContact CB-CD2 4.07Å; P91-L190 HydrophobicContact CG-CD2 4.22Å; F95-L190 HydrophobicContact CE2-CD1 4Å; F95-L190 HydrophobicContact CE2-CD2 3.78Å; F95-L190 HydrophobicContact CE2-CG 3.6Å; F95-L190 HydrophobicContact CZ-CD1 3.5Å; F95-L190 HydrophobicContact CZ-CD2 4.08Å; F95-L190 HydrophobicContact CZ-CG 3.66Å; L187-L190 HydrophobicContact CD2-CD1 4.31Å; L187-L190 VanDerWaalsContact O-CB 3.31Å; L187-L190 WeakPolarHBondContact O-CB 3.31Å; L187-L190 PolarHBondContact O-N 3.06Å; G188-L190 VanDerWaalsContact C-N 3.32Å; L190-F193 WeakPolarHBondContact O-CB 3.31Å; L190-F193 PolarHBondContact O-N 3.3Å; L190-T194 WeakPolarHBondContact O-CG2 3.44Å; L190-T194 PolarHBondContact O-N 3.44Å; L190-T194 PolarHBondContact O-OG1 3.3Å
191I85.1Confident81.7Confident44 Ų4444.7 Ų44.723%0.22625%0.245CC..Hα-helixtrans-64.9-48.2-177.3-65.5168.7000111.3F20 I176 I179 G188 F189 F193 T194 S195F20-I191 HydrophobicContact CE1-CG2 3.46Å; F20-I191 VanDerWaalsContact CE1-CG2 3.46Å; F20-I191 HydrophobicContact CZ-CG2 3.58Å; I176-I191 HydrophobicContact CD1-CG2 4.14Å; I176-I191 HydrophobicContact CG1-CG2 4.39Å; I176-I191 HydrophobicContact CG2-CD1 4.34Å; I176-I191 HydrophobicContact CG2-CG2 4.19Å; I179-I191 HydrophobicContact CD1-CD1 4.11Å; I179-I191 HydrophobicContact CG2-CD1 4.01Å; G188-I191 WeakPolarHBondContact O-CB 3.5Å; G188-I191 PolarHBondContact O-N 3.4Å; F189-I191 VanDerWaalsContact C-N 3.26Å; F189-I191 PolarHBondContact O-N 2.91Å; I191-F193 VanDerWaalsContact C-N 3.31Å; I191-F193 PolarHBondContact O-N 2.89Å; I191-T194 PolarHBondContact O-N 3.14Å; I191-T194 PolarHBondContact O-OG1 2.7Å; I191-S195 PolarHBondContact O-N 3.01Å; I191-S195 VanDerWaalsContact O-N 3.15Å
192P84.6Confident81.9Confident5 Ų544.6 Ų44.63%0.03225%0.245CC..Hα-helixtrans-56.5-40.4168.5-27.333000113.8T21 G188 F189 S195 V196T21-P192 HydrophobicContact CG2-CB 4.05Å; G188-P192 VanDerWaalsContact O-CD 3.3Å; G188-P192 WeakPolarHBondContact O-CD 3.05Å; F189-P192 WeakPolarHBondContact O-CD 3.2Å; P192-S195 WeakPolarHBondContact O-CB 3.34Å; P192-S195 PolarHBondContact O-N 3.49Å; P192-V196 PolarHBondContact O-N 2.84Å; P192-V196 VanDerWaalsContact O-N 3.1Å
193F87.4Confident82.4Confident51 Ų5142.8 Ų42.822%0.22423%0.232CC..Hα-helixtrans-63.7-46179.7171.7-101.5000112.7F84 A88 P91 L190 I191 S195 V196 L197F84-F193 AromaticContact CD2-CE2 3.96Å; F84-F193 HydrophobicContact CD2-CE2 3.96Å; F84-F193 HydrophobicContact CE2-CD2 4.29Å; F84-F193 AromaticContact CE2-CE2 3.3Å; F84-F193 HydrophobicContact CE2-CE2 3.3Å; F84-F193 AromaticContact CE2-CZ 3.65Å; F84-F193 HydrophobicContact CE2-CZ 3.65Å; F84-F193 AromaticContact CZ-CE2 3.67Å; F84-F193 HydrophobicContact CZ-CE2 3.67Å; F84-F193 AromaticContact CZ-CZ 3.93Å; F84-F193 HydrophobicContact CZ-CZ 3.93Å; A88-F193 HydrophobicContact CB-CD2 3.88Å; A88-F193 HydrophobicContact CB-CE2 3.73Å; P91-F193 HydrophobicContact CG-CB 4.42Å; L190-F193 WeakPolarHBondContact O-CB 3.31Å; L190-F193 PolarHBondContact O-N 3.3Å; I191-F193 VanDerWaalsContact C-N 3.31Å; I191-F193 PolarHBondContact O-N 2.89Å; F193-S195 VanDerWaalsContact C-N 3.3Å; F193-S195 PolarHBondContact O-N 2.68Å; F193-V196 PolarHBondContact O-N 2.63Å; F193-L197 PolarHBondContact O-N 3.23Å
194T88.8Confident83.2Confident78 Ų7843.7 Ų43.748%0.47923%0.229SC..Hα-helixtrans-65.2-35.517857.80000111.6L190 I191 L197 L198L190-T194 WeakPolarHBondContact O-CG2 3.44Å; L190-T194 PolarHBondContact O-N 3.44Å; L190-T194 PolarHBondContact O-OG1 3.3Å; I191-T194 PolarHBondContact O-N 3.14Å; I191-T194 PolarHBondContact O-OG1 2.7Å; T194-L197 PolarHBondContact O-N 2.91Å; T194-L198 PolarHBondContact O-N 3.35Å; T194-L198 VanDerWaalsContact O-N 3.07Å
195S90.1Very high84.1Confident12 Ų1247.8 Ų47.88%0.08425%0.246CC..Hα-helixtrans-60.2-44172.8-177.40000112.2C17 I191 P192 F193 L198 A199C17-S195 WeakPolarHBondContact CA-OG 3.08Å; C17-S195 WeakPolarHBondContact CB-O 3.31Å; C17-S195 VanDerWaalsContact CB-OG 3.28Å; C17-S195 WeakPolarHBondContact CB-OG 3.3Å; C17-S195 PolarHBondContact O-OG 3.13Å; I191-S195 PolarHBondContact O-N 3.01Å; I191-S195 VanDerWaalsContact O-N 3.15Å; P192-S195 WeakPolarHBondContact O-CB 3.34Å; P192-S195 PolarHBondContact O-N 3.49Å; F193-S195 VanDerWaalsContact C-N 3.3Å; F193-S195 PolarHBondContact O-N 2.68Å; S195-L198 WeakPolarHBondContact O-CB 3.46Å; S195-L198 PolarHBondContact O-N 3.03Å; S195-A199 PolarHBondContact O-N 3.23Å
196V90.8Very high84.6Confident2 Ų245.5 Ų45.51%0.01224%0.235CC..Hα-helixtrans-67.2-37.1176.5175.40000112T21 H83 F84 T87 P192 F193 L198 A199 L200T21-V196 HydrophobicContact CG2-CG2 3.89Å; H83-V196 HydrophobicContact CB-CG1 4.44Å; H83-V196 WeakPolarHBondContact NE2-CG2 3.49Å; F84-V196 HydrophobicContact CB-CG1 4.09Å; T87-V196 HydrophobicContact CG2-CG2 4Å; P192-V196 PolarHBondContact O-N 2.84Å; P192-V196 VanDerWaalsContact O-N 3.1Å; F193-V196 PolarHBondContact O-N 2.63Å; V196-L198 VanDerWaalsContact C-N 3.3Å; V196-L198 PolarHBondContact O-N 2.91Å; V196-A199 WeakPolarHBondContact O-CB 3.27Å; V196-A199 PolarHBondContact O-N 3.07Å; V196-A199 VanDerWaalsContact O-N 3.16Å; V196-L200 HydrophobicContact CG1-CG 4.48Å; V196-L200 WeakPolarHBondContact O-CG 3.4Å; V196-L200 PolarHBondContact O-N 3.28Å
197L91.3Very high84.9Confident79 Ų7951.2 Ų51.241%0.41425%0.254SS..Hα-helixtrans-59.8-42.9174.4-175.364.9000111.3F84 F193 T194 A199 L200 I201F84-L197 HydrophobicContact CE2-CD1 4.42Å; F193-L197 PolarHBondContact O-N 3.23Å; T194-L197 PolarHBondContact O-N 2.91Å; L197-A199 VanDerWaalsContact C-N 3.35Å; L197-A199 PolarHBondContact O-N 3.49Å; L197-L200 WeakPolarHBondContact O-CB 3.29Å; L197-L200 PolarHBondContact O-N 3.46Å; L197-I201 HydrophobicContact CG-CD1 4.37Å; L197-I201 WeakPolarHBondContact O-CG1 3.49Å; L197-I201 PolarHBondContact O-N 3.1Å
198L91.8Very high84.8Confident81 Ų8151.5 Ų51.542%0.42426%0.264SS..Hα-helixtrans-62.6-41.5174.5-17660.3000111.9L13 T194 S195 V196 L200 I201 A202L13-L198 HydrophobicContact CD1-CD2 4.06Å; L13-L198 HydrophobicContact CD2-CD1 4.36Å; L13-L198 HydrophobicContact CD2-CD2 4.42Å; L13-L198 HydrophobicContact CD2-CG 4.19Å; T194-L198 PolarHBondContact O-N 3.35Å; T194-L198 VanDerWaalsContact O-N 3.07Å; S195-L198 WeakPolarHBondContact O-CB 3.46Å; S195-L198 PolarHBondContact O-N 3.03Å; V196-L198 VanDerWaalsContact C-N 3.3Å; V196-L198 PolarHBondContact O-N 2.91Å; L198-L200 PolarHBondContact O-N 3.3Å; L198-I201 PolarHBondContact O-N 3.5Å; L198-A202 PolarHBondContact O-N 3.1Å
199A90.5Very high84.4Confident4 Ų455.1 Ų55.13%0.03328%0.28CS..Hα-helixtrans-61.2-42.1174.500000112.2V14 C17 S195 V196 L197 I201 A202 I203V14-A199 HydrophobicContact CG1-CB 4.26Å; V14-A199 HydrophobicContact CG2-CB 4.44Å; C17-A199 HydrophobicContact CB-CB 3.83Å; S195-A199 PolarHBondContact O-N 3.23Å; V196-A199 WeakPolarHBondContact O-CB 3.27Å; V196-A199 PolarHBondContact O-N 3.07Å; V196-A199 VanDerWaalsContact O-N 3.16Å; L197-A199 VanDerWaalsContact C-N 3.35Å; L197-A199 PolarHBondContact O-N 3.49Å; A199-I201 PolarHBondContact O-N 3.39Å; A199-A202 PolarHBondContact O-N 3.47Å; A199-I203 VanDerWaalsContact O-CG1 3.3Å; A199-I203 WeakPolarHBondContact O-CG1 3.42Å; A199-I203 PolarHBondContact O-N 3.13Å
200L90.8Very high83.9Confident48 Ų4854.7 Ų54.725%0.25128%0.279SS..Hα-helixtrans-61.1-44.8176.2-74.1-177.3000112.1A80 F84 V196 L197 L198 A202 I203 H204A80-L200 HydrophobicContact CB-CD2 3.61Å; F84-L200 HydrophobicContact CB-CD1 3.84Å; F84-L200 HydrophobicContact CD2-CD1 3.64Å; F84-L200 HydrophobicContact CE2-CD1 4.44Å; F84-L200 HydrophobicContact CG-CD1 3.87Å; V196-L200 HydrophobicContact CG1-CG 4.48Å; V196-L200 WeakPolarHBondContact O-CG 3.4Å; V196-L200 PolarHBondContact O-N 3.28Å; L197-L200 WeakPolarHBondContact O-CB 3.29Å; L197-L200 PolarHBondContact O-N 3.46Å; L198-L200 PolarHBondContact O-N 3.3Å; L200-A202 VanDerWaalsContact C-N 3.32Å; L200-A202 PolarHBondContact O-N 3.43Å; L200-I203 PolarHBondContact O-N 2.89Å; L200-H204 WeakPolarHBondContact O-CB 3.46Å; L200-H204 PolarHBondContact O-N 2.98Å
201I89.8Confident82.5Confident87 Ų8757.8 Ų57.845%0.44630%0.3SS..Hα-helixtrans-59.9-46.4176.6-66164.4000109.6L197 L198 A199 I203 H204 M205L197-I201 HydrophobicContact CG-CD1 4.37Å; L197-I201 WeakPolarHBondContact O-CG1 3.49Å; L197-I201 PolarHBondContact O-N 3.1Å; L198-I201 PolarHBondContact O-N 3.5Å; A199-I201 PolarHBondContact O-N 3.39Å; I201-I203 PolarHBondContact O-N 2.79Å; I201-H204 WeakPolarHBondContact O-CB 3.37Å; I201-H204 PolarHBondContact O-N 3.04Å; I201-M205 HydrophobicContact CG2-CG 4.49Å; I201-M205 HydrophobicContact CG2-SD 4.2Å; I201-M205 VanDerWaalsContact O-CG 3.31Å; I201-M205 WeakPolarHBondContact O-CG 3.37Å; I201-M205 PolarHBondContact O-N 3.23Å
202A89.2Confident81.2Confident3 Ų358.8 Ų58.83%0.02530%0.302CS..Hα-helixtrans-62.8-43.2178.300000112.7C10 L13 V14 L198 A199 L200 H204 M205 M206C10-A202 HydrophobicContact CB-CB 4.43Å; L13-A202 HydrophobicContact CD2-CB 4.16Å; V14-A202 HydrophobicContact CG2-CB 3.54Å; L198-A202 PolarHBondContact O-N 3.1Å; A199-A202 PolarHBondContact O-N 3.47Å; L200-A202 VanDerWaalsContact C-N 3.32Å; L200-A202 PolarHBondContact O-N 3.43Å; A202-H204 VanDerWaalsContact C-N 3.31Å; A202-H204 PolarHBondContact O-N 2.92Å; A202-M205 PolarHBondContact O-N 3.26Å; A202-M206 VanDerWaalsContact O-CG 3.3Å; A202-M206 WeakPolarHBondContact O-CG 3.2Å; A202-M206 PolarHBondContact O-N 3.24Å
203I87.1Confident79.8Confident4 Ų467.9 Ų67.92%0.02134%0.341CS..Hα-helixtrans-61.4-41.6174.2-67.7168.6000110.6V14 L76 Y77 A80 A199 L200 I201 M206 R207V14-I203 HydrophobicContact CG1-CD1 3.99Å; V14-I203 HydrophobicContact CG1-CG1 4.02Å; V14-I203 HydrophobicContact CG2-CD1 4.5Å; V14-I203 HydrophobicContact CG2-CG1 3.74Å; L76-I203 HydrophobicContact CD2-CG2 4.14Å; L76-I203 HydrophobicContact CG-CG2 4.48Å; Y77-I203 HydrophobicContact CD1-CG2 4.5Å; Y77-I203 HydrophobicContact CE1-CG2 3.92Å; A80-I203 HydrophobicContact CB-CD1 4.04Å; A199-I203 VanDerWaalsContact O-CG1 3.3Å; A199-I203 WeakPolarHBondContact O-CG1 3.42Å; A199-I203 PolarHBondContact O-N 3.13Å; L200-I203 PolarHBondContact O-N 2.89Å; I201-I203 PolarHBondContact O-N 2.79Å; I203-M206 PolarHBondContact O-N 2.72Å; I203-R207 PolarHBondContact O-N 3.27Å
204H86.5Confident78.3Confident119 Ų11967.9 Ų67.955%0.55135%0.346SS*.Hα-helixtrans-63.6-44.6178.2-171.888.4000111.9L200 I201 A202 M206 R207L200-H204 WeakPolarHBondContact O-CB 3.46Å; L200-H204 PolarHBondContact O-N 2.98Å; I201-H204 WeakPolarHBondContact O-CB 3.37Å; I201-H204 PolarHBondContact O-N 3.04Å; A202-H204 VanDerWaalsContact C-N 3.31Å; A202-H204 PolarHBondContact O-N 2.92Å; H204-M206 PolarHBondContact O-N 2.78Å; H204-M206 VanDerWaalsContact O-N 3.15Å; H204-R207 WeakPolarHBondContact O-CB 3.37Å; H204-R207 PolarHBondContact O-N 3.03Å
205M84.6Confident76.4Confident107 Ų10773.9 Ų73.953%0.52737%0.365SS..Hα-helixtrans-59-26.6175.8-70.9177.473.200113I201 A202I201-M205 HydrophobicContact CG2-CG 4.49Å; I201-M205 HydrophobicContact CG2-SD 4.2Å; I201-M205 VanDerWaalsContact O-CG 3.31Å; I201-M205 WeakPolarHBondContact O-CG 3.37Å; I201-M205 PolarHBondContact O-N 3.23Å; A202-M205 PolarHBondContact O-N 3.26Å
206M78.9Confident74.6Confident4 Ų485.8 Ų85.82%0.0241%0.408CS..Hα-helixtrans-87.9-8.9179.4-68.117673.200114.5V7 C10 V11 A202 I203 H204 S208 K209 L210V7-M206 HydrophobicContact CB-CE 4.39Å; V7-M206 HydrophobicContact CG1-CE 3.56Å; C10-M206 HydrophobicContact CB-CE 4.47Å; C10-M206 HydrophobicContact CB-CG 3.49Å; C10-M206 VanDerWaalsContact CB-CG 3.49Å; C10-M206 HydrophobicContact CB-SD 3.27Å; C10-M206 WeakPolarHBondContact CB-SD 3.34Å; V11-M206 HydrophobicContact CB-CE 4.46Å; V11-M206 HydrophobicContact CG2-CE 3.28Å; V11-M206 HydrophobicContact CG2-SD 4.18Å; A202-M206 VanDerWaalsContact O-CG 3.3Å; A202-M206 WeakPolarHBondContact O-CG 3.2Å; A202-M206 PolarHBondContact O-N 3.24Å; I203-M206 PolarHBondContact O-N 2.72Å; H204-M206 PolarHBondContact O-N 2.78Å; H204-M206 VanDerWaalsContact O-N 3.15Å; M206-S208 VanDerWaalsContact C-N 3.31Å; M206-S208 PolarHBondContact O-N 2.97Å; M206-S208 VanDerWaalsContact O-N 3.09Å; M206-K209 PolarHBondContact O-N 3.12Å; M206-L210 HydrophobicContact CB-CD1 4.16Å; M206-L210 HydrophobicContact CB-CG 4.25Å; M206-L210 HydrophobicContact CE-CD2 4.17Å; M206-L210 WeakPolarHBondContact O-CG 3.46Å; M206-L210 PolarHBondContact O-N 2.75Å
207R76.1Confident72.6Confident160 Ų16088.4 Ų88.460%0.60444%0.436SS*.G310 helixtrans-45.8-48-168.9-178.5170.2-179.5-167.71.2114.6Y77 I203 H204 K209Y77-R207 WeakPolarHBondContact OH-CB 3.31Å; Y77-R207 WeakPolarHBondContact OH-CD 3.32Å; Y77-R207 WeakPolarHBondContact OH-CG 3.35Å; I203-R207 PolarHBondContact O-N 3.27Å; H204-R207 WeakPolarHBondContact O-CB 3.37Å; H204-R207 PolarHBondContact O-N 3.03Å; R207-K209 PolarHBondContact O-N 2.98Å
208S66.6Low71Confident105 Ų10586.8 Ų86.873%0.73444%0.439SS*.G310 helixtrans-73.3-10.3-174.158.80000114.4M206M206-S208 VanDerWaalsContact C-N 3.31Å; M206-S208 PolarHBondContact O-N 2.97Å; M206-S208 VanDerWaalsContact O-N 3.09Å
209K65.5Low69.8Low77 Ų7784.7 Ų84.734%0.33543%0.431SS..G310 helixtrans-114.60.1-174.8-61.6178.3-175.1166.60113.4K3 V7 M206 R207 T211K3-K209 PolarHBondContact O-NZ 3.31Å; K3-K209 VanDerWaalsContact O-NZ 3.1Å; V7-K209 HydrophobicContact CG2-CB 4.12Å; V7-K209 HydrophobicContact CG2-CD 3.43Å; V7-K209 VanDerWaalsContact CG2-CD 3.43Å; V7-K209 HydrophobicContact CG2-CG 4.44Å; M206-K209 PolarHBondContact O-N 3.12Å; R207-K209 PolarHBondContact O-N 2.98Å; K209-T211 VanDerWaalsContact C-N 3.31Å; K209-T211 PolarHBondContact O-N 3.39Å; K209-T211 VanDerWaalsContact O-N 3.13Å
210L62.3Low68.8Low15 Ų1585.6 Ų85.68%0.07944%0.435CS..  trans-85.762.1-179.9-69.8165.9000111.5L76 M141 M206L76-L210 HydrophobicContact CD2-CD1 4.09Å; M141-L210 HydrophobicContact CE-CD2 3.69Å; M141-L210 HydrophobicContact SD-CD2 4.05Å; M206-L210 HydrophobicContact CB-CD1 4.16Å; M206-L210 HydrophobicContact CB-CG 4.25Å; M206-L210 HydrophobicContact CE-CD2 4.17Å; M206-L210 WeakPolarHBondContact O-CG 3.46Å; M206-L210 PolarHBondContact O-N 2.75Å
211T55.3Low67.9Low129 Ų12988.2 Ų88.279%0.79145%0.449SS*.  trans-109.794.4170.451.10000109.9K209K209-T211 VanDerWaalsContact C-N 3.31Å; K209-T211 PolarHBondContact O-N 3.39Å; K209-T211 VanDerWaalsContact O-N 3.13Å
212Y57Low67Low64 Ų6486.7 Ų86.725%0.25144%0.443SS..  trans-112.7118.1171.8179.1-102.2000109.5M141 Y144 P214M141-Y212 HydrophobicContact CG-CD1 4.46Å; M141-Y212 HydrophobicContact CG-CG 4.17Å; Y144-Y212 AromaticContact CD1-CD2 3.63Å; Y144-Y212 HydrophobicContact CD1-CD2 3.63Å; Y144-Y212 AromaticContact CD1-CE2 3.99Å; Y144-Y212 HydrophobicContact CD1-CE2 3.99Å; Y144-Y212 HydrophobicContact CD2-CD2 4.07Å; Y144-Y212 AromaticContact CD2-CE2 3.53Å; Y144-Y212 HydrophobicContact CD2-CE2 3.53Å; Y144-Y212 HydrophobicContact CE1-CD2 4.13Å; Y144-Y212 HydrophobicContact CE1-CE2 4.47Å; Y144-Y212 HydrophobicContact CE2-CE2 4.06Å; Y144-Y212 AromaticContact CG-CD2 3.58Å; Y144-Y212 HydrophobicContact CG-CD2 3.58Å; Y144-Y212 AromaticContact CG-CE2 3.46Å; Y144-Y212 HydrophobicContact CG-CE2 3.46Å; Y144-Y212 VanDerWaalsContact CG-CE2 3.46Å; Y212-P214 HydrophobicContact CD1-CB 4.43Å; Y212-P214 HydrophobicContact CD1-CG 4.3Å; Y212-P214 HydrophobicContact CE1-CB 3.56Å; Y212-P214 HydrophobicContact CE1-CG 3.85Å
213K55.1Low66.4Low197 Ų19786.8 Ų86.886%0.85744%0.444SS*.  trans-107.7102169.8-74.1-172.2178.9-178.40108.4
214P56.3Low65.8Low50 Ų5090 Ų9033%0.32546%0.46SS..  trans-64.4149.4174.521.1-25.9000111.2Y212Y212-P214 HydrophobicContact CD1-CB 4.43Å; Y212-P214 HydrophobicContact CD1-CG 4.3Å; Y212-P214 HydrophobicContact CE1-CB 3.56Å; Y212-P214 HydrophobicContact CE1-CG 3.85Å
215K49.9Very low65.2Low205 Ų20585.1 Ų85.189%0.89144%0.442SS*.  trans-67.3128.9158.3-69.9-176.2177-176.20107.6G217K215-G217 PolarHBondContact O-N 2.89Å
216R50.9Low64.8Low261 Ų26180 Ų8099%0.98542%0.417SS*.  trans-64.496.3174-78.5179.8173.2169.1-3.2109.2
217G48.8Very low64.7Low57 Ų5780.8 Ų80.859%0.58842%0.42SS*.  trans-95157.5163.100000109.7K215K215-G217 PolarHBondContact O-N 2.89Å
218G57.3Low64.7Low46 Ų4678.7 Ų78.747%0.47442%0.421SS..  trans-43.8144.6-169.300000115.6
219S67.6Low65.1Low37 Ų3775.5 Ų75.526%0.25940%0.395SS..  trans-84134.9-173.9170.60000111.9L221 T222 T223S219-L221 PolarHBondContact O-N 2.9Å; S219-L221 VanDerWaalsContact O-N 3.14Å; S219-L221 PolarHBondContact OG-N 3.32Å; S219-T222 PolarHBondContact N-OG1 3.48Å; S219-T222 PolarHBondContact O-N 3.36Å; S219-T222 PolarHBondContact O-OG1 2.91Å; S219-T223 PolarHBondContact O-N 3.26Å; S219-T223 VanDerWaalsContact O-N 3.16Å
220L69.9Low65.4Low22 Ų2271.8 Ų71.812%0.11538%0.379CS..Hα-helixtrans-48.1-40.1171.6-83.4164.1000112.6V60 T222 T223 L224 I431 H434 F435V60-L220 HydrophobicContact CG1-CD1 3.91Å; L220-T222 VanDerWaalsContact C-N 3.34Å; L220-T222 PolarHBondContact O-N 2.99Å; L220-T223 PolarHBondContact O-N 2.9Å; L220-L224 PolarHBondContact O-N 2.87Å; L220-I431 HydrophobicContact CD2-CB 4.32Å; L220-I431 HydrophobicContact CD2-CG1 4.31Å; L220-I431 HydrophobicContact CD2-CG2 3.85Å; L220-I431 HydrophobicContact CG-CG1 4.5Å; L220-H434 HydrophobicContact CD1-CB 4.21Å; L220-H434 HydrophobicContact CD2-CB 3.89Å; L220-F435 HydrophobicContact CD2-CE2 4.36Å
221L71.5Confident66Low104 Ų10477 Ų7755%0.54540%0.401SS..Hα-helixtrans-65.3-37.6178.9-17074.8000111.9W64 S219 T223 G225W64-L221 HydrophobicContact CZ2-CD2 4.43Å; S219-L221 PolarHBondContact O-N 2.9Å; S219-L221 VanDerWaalsContact O-N 3.14Å; S219-L221 PolarHBondContact OG-N 3.32Å; L221-T223 VanDerWaalsContact C-N 3.34Å; L221-G225 WeakPolarHBondContact O-CA 3.28Å; L221-G225 PolarHBondContact O-N 2.96Å
222T70.5Confident66.9Low55 Ų5576.8 Ų76.834%0.33739%0.389SS..Hα-helixtrans-69.1-35.1176.961.10000111.3S219 L220 V226 H264S219-T222 PolarHBondContact N-OG1 3.48Å; S219-T222 PolarHBondContact O-N 3.36Å; S219-T222 PolarHBondContact O-OG1 2.91Å; L220-T222 VanDerWaalsContact C-N 3.34Å; L220-T222 PolarHBondContact O-N 2.99Å; T222-V226 WeakPolarHBondContact O-CG2 3.31Å; T222-V226 PolarHBondContact O-N 3.37Å; T222-H264 VanDerWaalsContact C-NE2 3.27Å; T222-H264 WeakPolarHBondContact CB-NE2 3.21Å; T222-H264 PolarHBondContact O-NE2 3.03Å; T222-H264 VanDerWaalsContact O-NE2 3.08Å; T222-H264 PolarHBondContact OG1-CE1 2.95Å; T222-H264 VanDerWaalsContact OG1-CE1 3.24Å; T222-H264 PolarHBondContact OG1-NE2 3.43Å
223T76.3Confident67.3Low5 Ų577.4 Ų77.43%0.03140%0.395CS..Hα-helixtrans-68.2-47174.3-610000111.4S219 L220 L221 G225 V226 F227 V268 L271 I431 F435S219-T223 PolarHBondContact O-N 3.26Å; S219-T223 VanDerWaalsContact O-N 3.16Å; L220-T223 PolarHBondContact O-N 2.9Å; L221-T223 VanDerWaalsContact C-N 3.34Å; T223-G225 VanDerWaalsContact C-N 3.3Å; T223-G225 PolarHBondContact O-N 3.19Å; T223-V226 PolarHBondContact O-N 2.83Å; T223-F227 HydrophobicContact CG2-CD2 4.1Å; T223-F227 HydrophobicContact CG2-CE2 3.86Å; T223-F227 WeakPolarHBondContact O-CD2 3.26Å; T223-F227 PolarHBondContact O-N 3.03Å; T223-V268 HydrophobicContact CG2-CG2 3.91Å; T223-L271 HydrophobicContact CG2-CD2 3.75Å; T223-I431 HydrophobicContact CG2-CG2 4.1Å; T223-F435 HydrophobicContact CG2-CE2 4.09Å; T223-F435 HydrophobicContact CG2-CZ 4.49Å
224L74Confident67.8Low71 Ų7170.9 Ų70.937%0.37237%0.374SS..Hα-helixtrans-61.4-38.5173.3-76.6168.7000112.1L220 V226 F227 L228 F435L220-L224 PolarHBondContact O-N 2.87Å; L224-V226 PolarHBondContact O-N 3.46Å; L224-F227 WeakPolarHBondContact O-CB 3.45Å; L224-F227 PolarHBondContact O-N 2.96Å; L224-L228 WeakPolarHBondContact O-CB 3.28Å; L224-L228 WeakPolarHBondContact O-CG 3.47Å; L224-L228 PolarHBondContact O-N 2.81Å; L224-F435 HydrophobicContact CD2-CE1 3.89Å; L224-F435 HydrophobicContact CD2-CZ 3.74Å; L224-F435 HydrophobicContact CG-CZ 4.07Å
225G73.9Confident68.2Low16 Ų1672.4 Ų72.417%0.16539%0.385CS..Hα-helixtrans-62.8-39.4177.100000112.7L221 T223 N229 Y260L221-G225 WeakPolarHBondContact O-CA 3.28Å; L221-G225 PolarHBondContact O-N 2.96Å; T223-G225 VanDerWaalsContact C-N 3.3Å; T223-G225 PolarHBondContact O-N 3.19Å; G225-N229 WeakPolarHBondContact O-CB 3.31Å; G225-N229 PolarHBondContact O-N 3.44Å; G225-Y260 VanDerWaalsContact C-CZ 3.49Å; G225-Y260 VanDerWaalsContact CA-OH 3.3Å; G225-Y260 WeakPolarHBondContact CA-OH 3.39Å; G225-Y260 PolarHBondContact O-OH 3.36Å; G225-Y260 VanDerWaalsContact O-OH 3.06Å
226V77.1Confident68.8Low0 Ų068.3 Ų68.30%037%0.372CS..Hα-helixtrans-61.5-50.6171.4174.30000109.8T222 T223 L224 L228 N229 S230 L249 A252 Y260 H264 V265 V268T222-V226 WeakPolarHBondContact O-CG2 3.31Å; T222-V226 PolarHBondContact O-N 3.37Å; T223-V226 PolarHBondContact O-N 2.83Å; L224-V226 PolarHBondContact O-N 3.46Å; V226-L228 PolarHBondContact O-N 3.27Å; V226-N229 PolarHBondContact O-N 2.89Å; V226-S230 VanDerWaalsContact O-CB 3.32Å; V226-S230 WeakPolarHBondContact O-CB 3.09Å; V226-S230 PolarHBondContact O-N 2.94Å; V226-S230 PolarHBondContact O-OG 3.43Å; V226-L249 HydrophobicContact CG1-CD2 4.33Å; V226-A252 HydrophobicContact CG1-CB 4.17Å; V226-Y260 HydrophobicContact CB-CD2 4.3Å; V226-Y260 HydrophobicContact CB-CE2 4.35Å; V226-Y260 HydrophobicContact CG2-CD1 3.58Å; V226-Y260 HydrophobicContact CG2-CD2 3.65Å; V226-Y260 HydrophobicContact CG2-CE1 3.9Å; V226-Y260 HydrophobicContact CG2-CE2 3.96Å; V226-Y260 HydrophobicContact CG2-CG 3.45Å; V226-Y260 VanDerWaalsContact CG2-CG 3.45Å; V226-H264 WeakPolarHBondContact CG2-CD2 3.27Å; V226-V265 HydrophobicContact CG1-CG2 4.31Å; V226-V268 HydrophobicContact CB-CG1 4.38Å; V226-V268 HydrophobicContact CB-CG2 3.9Å; V226-V268 HydrophobicContact CG1-CB 3.99Å; V226-V268 HydrophobicContact CG1-CG1 3.88Å; V226-V268 HydrophobicContact CG1-CG2 3.89Å; V226-V268 HydrophobicContact CG2-CG2 4.12Å
227F76.1Confident68.9Low20 Ų2064 Ų649%0.08836%0.356CS..Hα-helixtrans-56.1-51.9179.6-83.3-65.4000112.6T223 L224 N229 S230 F231 W248 L249 V268 L271 T272 F275T223-F227 HydrophobicContact CG2-CD2 4.1Å; T223-F227 HydrophobicContact CG2-CE2 3.86Å; T223-F227 WeakPolarHBondContact O-CD2 3.26Å; T223-F227 PolarHBondContact O-N 3.03Å; L224-F227 WeakPolarHBondContact O-CB 3.45Å; L224-F227 PolarHBondContact O-N 2.96Å; F227-N229 PolarHBondContact O-N 3.32Å; F227-S230 PolarHBondContact O-N 3.22Å; F227-F231 VanDerWaalsContact O-CB 3.24Å; F227-F231 WeakPolarHBondContact O-CB 3.47Å; F227-F231 PolarHBondContact O-N 3.4Å; F227-W248 HydrophobicContact CD1-CH2 4.07Å; F227-L249 HydrophobicContact CD1-CD2 4.39Å; F227-L249 HydrophobicContact CE1-CD2 4.43Å; F227-V268 HydrophobicContact CD1-CG1 3.95Å; F227-V268 HydrophobicContact CD2-CG1 3.81Å; F227-V268 HydrophobicContact CE1-CG1 3.58Å; F227-V268 HydrophobicContact CE2-CG1 3.43Å; F227-V268 VanDerWaalsContact CE2-CG1 3.43Å; F227-V268 HydrophobicContact CG-CG1 4.05Å; F227-V268 HydrophobicContact CZ-CG1 3.29Å; F227-L271 HydrophobicContact CE2-CD2 4.15Å; F227-T272 HydrophobicContact CE1-CG2 4.13Å; F227-T272 WeakPolarHBondContact CE1-OG1 3.29Å; F227-T272 VanDerWaalsContact CZ-OG1 3.31Å; F227-T272 WeakPolarHBondContact CZ-OG1 3.25Å; F227-F275 AromaticContact CD1-CE2 3.93Å; F227-F275 HydrophobicContact CD1-CE2 3.93Å; F227-F275 HydrophobicContact CD2-CE2 4.26Å; F227-F275 HydrophobicContact CD2-CZ 4.17Å; F227-F275 HydrophobicContact CE1-CD2 4.09Å; F227-F275 AromaticContact CE1-CE2 3.27Å; F227-F275 HydrophobicContact CE1-CE2 3.27Å; F227-F275 AromaticContact CE1-CZ 3.93Å; F227-F275 HydrophobicContact CE1-CZ 3.93Å; F227-F275 AromaticContact CE2-CE2 3.65Å; F227-F275 HydrophobicContact CE2-CE2 3.65Å; F227-F275 AromaticContact CE2-CZ 3.38Å; F227-F275 HydrophobicContact CE2-CZ 3.38Å; F227-F275 HydrophobicContact CG-CE2 4.39Å; F227-F275 HydrophobicContact CZ-CD2 4.12Å; F227-F275 HydrophobicContact CZ-CE1 4.34Å; F227-F275 AromaticContact CZ-CE2 3.1Å; F227-F275 HydrophobicContact CZ-CE2 3.1Å; F227-F275 AromaticContact CZ-CZ 3.25Å; F227-F275 HydrophobicContact CZ-CZ 3.25Å
228L77.2Confident69.2Low117 Ų11770.8 Ų70.861%0.61337%0.372SS*.Hα-helixtrans-64.4-40.3-179.4-72.3170.4000111.5L224 V226 F231 K232L224-L228 WeakPolarHBondContact O-CB 3.28Å; L224-L228 WeakPolarHBondContact O-CG 3.47Å; L224-L228 PolarHBondContact O-N 2.81Å; V226-L228 PolarHBondContact O-N 3.27Å; L228-F231 PolarHBondContact O-N 3.49Å; L228-K232 WeakPolarHBondContact O-CB 3.13Å; L228-K232 PolarHBondContact O-N 2.93Å
229N74.9Confident68.4Low37 Ų3777.9 Ų77.920%0.19838%0.384CS..Hα-helixtrans-68.7-44.8178.6-162.931.8000111.2G225 V226 F227 F231 K232 M233 Y260G225-N229 WeakPolarHBondContact O-CB 3.31Å; G225-N229 PolarHBondContact O-N 3.44Å; V226-N229 PolarHBondContact O-N 2.89Å; F227-N229 PolarHBondContact O-N 3.32Å; N229-F231 VanDerWaalsContact C-N 3.31Å; N229-F231 PolarHBondContact O-N 3.1Å; N229-K232 PolarHBondContact O-N 3.12Å; N229-M233 WeakPolarHBondContact O-CB 3.29Å; N229-M233 PolarHBondContact O-N 2.85Å; N229-Y260 HydrophobicContact CB-CE2 3.85Å
230S70.6Confident67.8Low0 Ų085 Ų850%041%0.413CS..Hα-helixtrans-60.3-40173.6-63.50000111.8V226 F227 M233 C234 W248 A252V226-S230 VanDerWaalsContact O-CB 3.32Å; V226-S230 WeakPolarHBondContact O-CB 3.09Å; V226-S230 PolarHBondContact O-N 2.94Å; V226-S230 PolarHBondContact O-OG 3.43Å; F227-S230 PolarHBondContact O-N 3.22Å; S230-M233 PolarHBondContact O-N 3.46Å; S230-C234 WeakPolarHBondContact O-CB 3.45Å; S230-C234 PolarHBondContact O-N 3.34Å; S230-W248 VanDerWaalsContact CB-CE3 3.48Å; S230-A252 WeakPolarHBondContact OG-CB 3.48Å
231F74.9Confident66.6Low125 Ų12592.2 Ų92.255%0.54845%0.451SS..Hα-helixtrans-70.3-46.1179.4-177.4-101000111F227 L228 N229 M233 C234 C235 W248F227-F231 VanDerWaalsContact O-CB 3.24Å; F227-F231 WeakPolarHBondContact O-CB 3.47Å; F227-F231 PolarHBondContact O-N 3.4Å; L228-F231 PolarHBondContact O-N 3.49Å; N229-F231 VanDerWaalsContact C-N 3.31Å; N229-F231 PolarHBondContact O-N 3.1Å; F231-M233 VanDerWaalsContact C-N 3.29Å; F231-M233 PolarHBondContact O-N 3.3Å; F231-C234 CarbonylContact O-C 3.38Å; F231-C234 WeakPolarHBondContact O-CA 3.4Å; F231-C234 VanDerWaalsContact O-CB 3.29Å; F231-C234 WeakPolarHBondContact O-CB 3.4Å; F231-C234 PolarHBondContact O-N 3.47Å; F231-C235 WeakPolarHBondContact CE1-SG 3.37Å; F231-C235 WeakPolarHBondContact CZ-SG 3.31Å; F231-C235 PolarHBondContact O-N 3Å; F231-C235 PolarHBondContact O-SG 3.43Å; F231-C235 VanDerWaalsContact O-SG 3.41Å; F231-W248 HydrophobicContact CB-CZ3 4.29Å
232K74.8Confident65.6Low124 Ų12493.6 Ų93.654%0.53947%0.469SS..Hα-helixtrans-56.4-43.2173.2-178.8175.8-178.5-178.10111.2L228 N229 C234 C235 L236L228-K232 WeakPolarHBondContact O-CB 3.13Å; L228-K232 PolarHBondContact O-N 2.93Å; N229-K232 PolarHBondContact O-N 3.12Å; K232-C234 VanDerWaalsContact C-N 3.28Å; K232-C234 PolarHBondContact O-N 3.41Å; K232-C235 PolarHBondContact O-N 2.84Å; K232-L236 HydrophobicContact CD-CD1 3.99Å; K232-L236 HydrophobicContact CG-CD1 3.38Å; K232-L236 HydrophobicContact CG-CG 4.05Å; K232-L236 VanDerWaalsContact O-CB 3.23Å; K232-L236 WeakPolarHBondContact O-CB 3.41Å; K232-L236 WeakPolarHBondContact O-CG 3.47Å; K232-L236 PolarHBondContact O-N 2.98Å
233M66.5Low64.5Low76 Ų7694 Ų9437%0.37448%0.484SS..Hα-helixtrans-64.6-32.1175.1-147.887.4127.700112.2N229 S230 F231 R251N229-M233 WeakPolarHBondContact O-CB 3.29Å; N229-M233 PolarHBondContact O-N 2.85Å; S230-M233 PolarHBondContact O-N 3.46Å; F231-M233 VanDerWaalsContact C-N 3.29Å; F231-M233 PolarHBondContact O-N 3.3Å; M233-R251 HydrophobicContact CG-CB 4.33Å
234C64.2Low63.4Low61 Ų61101.8 Ų101.841%0.41253%0.526SS..Hα-helixtrans-74.3-37.2175.3-164.80000112.5S230 F231 K232S230-C234 WeakPolarHBondContact O-CB 3.45Å; S230-C234 PolarHBondContact O-N 3.34Å; F231-C234 CarbonylContact O-C 3.38Å; F231-C234 WeakPolarHBondContact O-CA 3.4Å; F231-C234 VanDerWaalsContact O-CB 3.29Å; F231-C234 WeakPolarHBondContact O-CB 3.4Å; F231-C234 PolarHBondContact O-N 3.47Å; K232-C234 VanDerWaalsContact C-N 3.28Å; K232-C234 PolarHBondContact O-N 3.41Å
235C65.7Low62.4Low81 Ų81100.7 Ų100.755%0.54753%0.527SS..Hα-helixtrans-85.9-28.1-177.2-660000113.8F231 K232F231-C235 WeakPolarHBondContact CE1-SG 3.37Å; F231-C235 WeakPolarHBondContact CZ-SG 3.31Å; F231-C235 PolarHBondContact O-N 3Å; F231-C235 PolarHBondContact O-SG 3.43Å; F231-C235 VanDerWaalsContact O-SG 3.41Å; K232-C235 PolarHBondContact O-N 2.84Å
236L61.9Low61.8Low120 Ų120106.9 Ų106.963%0.62856%0.561SS**Hα-helixtrans-87.7-13.5-170.8-79179.1000116.6K232K232-L236 HydrophobicContact CD-CD1 3.99Å; K232-L236 HydrophobicContact CG-CD1 3.38Å; K232-L236 HydrophobicContact CG-CG 4.05Å; K232-L236 VanDerWaalsContact O-CB 3.23Å; K232-L236 WeakPolarHBondContact O-CB 3.41Å; K232-L236 WeakPolarHBondContact O-CG 3.47Å; K232-L236 PolarHBondContact O-N 2.98Å
237R54Low61.4Low170 Ų170108.6 Ų108.664%0.64257%0.573SS**  trans-161.5121.3171.4-126.3171.8-179.3169.1-0.7117.1R239R237-R239 HydrophobicContact CG-CB 4.07Å
238H54.6Low61.4Low199 Ų199111.8 Ų111.892%0.92159%0.585SS**  trans-75.794.6141-149.364.4000106.7
239R41.2Very low61.5Low195 Ų195106.3 Ų106.374%0.73656%0.556SS**  trans-168.9115.8159.3-107.4176.6-165.6-169.64.8110.5R237R237-R239 HydrophobicContact CG-CB 4.07Å
240H54.6Low61.7Low188 Ų188105.3 Ų105.387%0.8755%0.551SS**  trans11.4113.1157.3-102-19.9000118.4
241L44.2Very low61.9Low172 Ų172109.7 Ų109.790%0.90157%0.567SS**  -165.4146.6108.7-127.174.8000110.4
242S50.2Low61.9Low133 Ų133103.8 Ų103.893%0.9354%0.542SS*.  trans-49.9137.6-173.3-126.40000115.5
243G48.5Very low62.2Low64 Ų6499 Ų9966%0.6652%0.521SS*.  trans161.1121.6163.900000111.9A245G243-A245 PolarHBondContact O-N 3.29Å
244D51.6Low62.6Low169 Ų169100.5 Ų100.590%0.90453%0.527SS*.  trans-60.259.3178.9-85.8-35.3000114.1V246D244-V246 PolarHBondContact O-N 3.26Å; D244-V246 VanDerWaalsContact O-N 3.08Å
245A53.2Low62.9Low47 Ų47103.2 Ų103.239%0.38854%0.537SS..  trans-78.194.7172.900000109.8G243 S247 D250G243-A245 PolarHBondContact O-N 3.29Å; A245-S247 PolarHBondContact O-N 3.48Å; A245-S247 VanDerWaalsContact O-N 3.12Å; A245-D250 HydrophobicContact CB-CB 4.11Å
246V62Low63Low146 Ų146103.5 Ų103.589%0.88553%0.533SS*.SBendtrans-58.2-22.9-177.9-174.80000113.2D244D244-V246 PolarHBondContact O-N 3.26Å; D244-V246 VanDerWaalsContact O-N 3.08Å
247S68.6Low63.2Low36 Ų36101 Ų10125%0.25254%0.536SS..SBendtrans-131143176.2-171.20000113A245 L249 D250A245-S247 PolarHBondContact O-N 3.48Å; A245-S247 VanDerWaalsContact O-N 3.12Å; S247-L249 PolarHBondContact O-N 2.96Å; S247-L249 VanDerWaalsContact O-N 3.07Å; S247-D250 VanDerWaalsContact CB-OD2 3.31Å; S247-D250 WeakPolarHBondContact CB-OD2 3.41Å; S247-D250 PolarHBondContact N-OD2 3.34Å; S247-D250 VanDerWaalsContact O-CB 3.3Å; S247-D250 WeakPolarHBondContact O-CB 3.44Å; S247-D250 PolarHBondContact O-N 3.25Å
248W75.3Confident64.2Low87 Ų8793.5 Ų93.533%0.3351%0.513SS..G310 helixtrans-56.7-26.817668.3-85.7000113.7F227 S230 F231 T272F227-W248 HydrophobicContact CD1-CH2 4.07Å; S230-W248 VanDerWaalsContact CB-CE3 3.48Å; F231-W248 HydrophobicContact CB-CZ3 4.29Å; W248-T272 HydrophobicContact CZ2-CG2 4.4Å
249L79.1Confident65.4Low3 Ų393.8 Ų93.82%0.01651%0.505CS..G310 helixtrans-71.1-27176.3-79.8149.6000112.9V226 F227 S247 R251 A252 V265 V268 K269 T272V226-L249 HydrophobicContact CG1-CD2 4.33Å; F227-L249 HydrophobicContact CD1-CD2 4.39Å; F227-L249 HydrophobicContact CE1-CD2 4.43Å; S247-L249 PolarHBondContact O-N 2.96Å; S247-L249 VanDerWaalsContact O-N 3.07Å; L249-R251 PolarHBondContact O-N 3.12Å; L249-R251 VanDerWaalsContact O-N 3.12Å; L249-A252 PolarHBondContact O-N 3.48Å; L249-V265 HydrophobicContact CB-CG1 4.37Å; L249-V265 VanDerWaalsContact O-CG1 3.25Å; L249-V265 WeakPolarHBondContact O-CG1 3.42Å; L249-V268 HydrophobicContact CD2-CG1 3.76Å; L249-K269 HydrophobicContact CB-CD 4.47Å; L249-K269 HydrophobicContact CB-CG 3.73Å; L249-K269 HydrophobicContact CD1-CB 4.43Å; L249-K269 HydrophobicContact CD1-CG 3.74Å; L249-K269 HydrophobicContact CG-CG 4.29Å; L249-T272 HydrophobicContact CD1-CG2 4.23Å; L249-T272 WeakPolarHBondContact CD1-OG1 3.17Å
250D79.4Confident67.3Low16 Ų1686.9 Ų86.99%0.08648%0.48CS..G310 helixtrans-59.7-25.9178.3-77.3-57.7000112.5A245 S247 A252 K253 N256 K269A245-D250 HydrophobicContact CB-CB 4.11Å; S247-D250 VanDerWaalsContact CB-OD2 3.31Å; S247-D250 WeakPolarHBondContact CB-OD2 3.41Å; S247-D250 PolarHBondContact N-OD2 3.34Å; S247-D250 VanDerWaalsContact O-CB 3.3Å; S247-D250 WeakPolarHBondContact O-CB 3.44Å; S247-D250 PolarHBondContact O-N 3.25Å; D250-A252 PolarHBondContact O-N 3.49Å; D250-K253 WeakPolarHBondContact O-CB 3.23Å; D250-K253 WeakPolarHBondContact O-CG 3.24Å; D250-K253 PolarHBondContact O-N 2.89Å; D250-K253 VanDerWaalsContact O-N 3.1Å; D250-K253 WeakPolarHBondContact OD1-CE 3.45Å; D250-K253 IonicContact OD1-NZ 2.73Å; D250-K253 PolarHBondContact OD1-NZ 3.2Å; D250-N256 PolarHBondContact O-ND2 3.48Å; D250-K269 VanDerWaalsContact OD1-CE 3.3Å; D250-K269 WeakPolarHBondContact OD1-CE 3.42Å; D250-K269 IonicContact OD1-NZ 3.15Å; D250-K269 PolarHBondContact OD1-NZ 3.44Å; D250-K269 WeakPolarHBondContact OD2-CE 3.32Å; D250-K269 IonicContact OD2-NZ 2.71Å; D250-K269 PolarHBondContact OD2-NZ 3.3Å
251R74.4Confident68.7Low91 Ų9180.1 Ų80.134%0.34345%0.454SS..G310 helixtrans-66-13.2176.5-64-171.9-86.6-160.5-6.3114.2M233 L249M233-R251 HydrophobicContact CG-CB 4.33Å; L249-R251 PolarHBondContact O-N 3.12Å; L249-R251 VanDerWaalsContact O-N 3.12Å
252A76.9Confident70.5Confident1 Ų176.2 Ų76.21%0.00843%0.431CS..G310 helixtrans-89.7-7.717400000114.2V226 S230 L249 D250 G258 R259 Y260 V265V226-A252 HydrophobicContact CG1-CB 4.17Å; S230-A252 WeakPolarHBondContact OG-CB 3.48Å; L249-A252 PolarHBondContact O-N 3.48Å; D250-A252 PolarHBondContact O-N 3.49Å; A252-G258 WeakPolarHBondContact O-CA 3.24Å; A252-R259 PolarHBondContact O-N 3.36Å; A252-Y260 HydrophobicContact CB-CD2 4.23Å; A252-Y260 PolarHBondContact O-N 2.9Å; A252-V265 HydrophobicContact CB-CG2 4.17Å
253K79.5Confident71.9Confident25 Ų2574.7 Ų74.711%0.10942%0.416CS..BIsolated β-bridgetrans-67.4138.5177.2-66.9179.9170.5172.90110.5D250 N255 N256 G257 G258 Y260 E262 V265 E266D250-K253 WeakPolarHBondContact O-CB 3.23Å; D250-K253 WeakPolarHBondContact O-CG 3.24Å; D250-K253 PolarHBondContact O-N 2.89Å; D250-K253 VanDerWaalsContact O-N 3.1Å; D250-K253 WeakPolarHBondContact OD1-CE 3.45Å; D250-K253 IonicContact OD1-NZ 2.73Å; D250-K253 PolarHBondContact OD1-NZ 3.2Å; K253-N255 PolarHBondContact O-N 3.31Å; K253-N256 HydrophobicContact CB-CB 4.42Å; K253-N256 CarbonylContact O-C 3.53Å; K253-N256 WeakPolarHBondContact O-CA 3.44Å; K253-N256 PolarHBondContact O-N 3.19Å; K253-G257 PolarHBondContact O-N 2.81Å; K253-G258 VanDerWaalsContact O-CA 3.27Å; K253-G258 WeakPolarHBondContact O-CA 3.38Å; K253-G258 PolarHBondContact O-N 3.06Å; K253-Y260 CarbonylContact C-O 3.52Å; K253-Y260 WeakPolarHBondContact CA-O 3.29Å; K253-E262 HydrophobicContact CD-CG 4.31Å; K253-V265 HydrophobicContact CG-CB 3.81Å; K253-V265 HydrophobicContact CG-CG1 3.83Å; K253-V265 HydrophobicContact CG-CG2 3.84Å; K253-E266 WeakPolarHBondContact CE-OE1 3.25Å; K253-E266 IonicContact NZ-OE1 2.73Å; K253-E266 PolarHBondContact NZ-OE1 2.83Å
254E74.8Confident73.4Confident107 Ų10773 Ų7350%0.539%0.391SS..G310 helixtrans-50.4-42.8171.6-81.7163.5-155.200112.1N256 G257 G258 Y260 S261E254-N256 PolarHBondContact O-N 3.31Å; E254-N256 VanDerWaalsContact O-N 3.11Å; E254-G257 PolarHBondContact O-N 3.19Å; E254-G258 WeakPolarHBondContact CA-O 3.46Å; E254-Y260 PolarHBondContact N-O 3.37Å; E254-S261 PolarHBondContact OE1-N 2.61Å
255N71.4Confident74.8Confident117 Ų11765 Ų6563%0.62635%0.348SS*.G310 helixtrans-63-18.9178-70.2-8.6000114.1K253 E262K253-N255 PolarHBondContact O-N 3.31Å; N255-E262 PolarHBondContact ND2-OE1 3.3Å
256N66.6Low76.3Confident87 Ų8766.4 Ų66.447%0.46535%0.347SS..G310 helixtrans-107.121.8175.6-65.5-31.3000112.3D250 K253 E254D250-N256 PolarHBondContact O-ND2 3.48Å; K253-N256 HydrophobicContact CB-CB 4.42Å; K253-N256 CarbonylContact O-C 3.53Å; K253-N256 WeakPolarHBondContact O-CA 3.44Å; K253-N256 PolarHBondContact O-N 3.19Å; E254-N256 PolarHBondContact O-N 3.31Å; E254-N256 VanDerWaalsContact O-N 3.11Å
257G67.1Low77.3Confident67 Ų6760.9 Ų60.969%0.69131%0.312SS*.THydrogen-bonded Turntrans80.413.5-178.700000114.8K253 E254K253-G257 PolarHBondContact O-N 2.81Å; E254-G257 PolarHBondContact O-N 3.19Å
258G74.8Confident77.9Confident14 Ų1459.2 Ų59.214%0.14430%0.301CS..  trans-84.8-175.5175.200000114A252 K253 E254A252-G258 WeakPolarHBondContact O-CA 3.24Å; K253-G258 VanDerWaalsContact O-CA 3.27Å; K253-G258 WeakPolarHBondContact O-CA 3.38Å; K253-G258 PolarHBondContact O-N 3.06Å; E254-G258 WeakPolarHBondContact CA-O 3.46Å
259R79.3Confident78.3Confident204 Ų20456.6 Ų56.677%0.7729%0.292SS*.SBendtrans-108.92.5-176.1-67.3-174.3-179.9-175.2-1.4114.3A252A252-R259 PolarHBondContact O-N 3.36Å
260Y81.6Confident78.6Confident50 Ų5058.4 Ų58.420%0.19630%0.303CS..BIsolated β-bridgetrans-126.2138.1-170.5-58.7-78.4000111.5G225 V226 N229 A252 K253 E254 H264G225-Y260 VanDerWaalsContact C-CZ 3.49Å; G225-Y260 VanDerWaalsContact CA-OH 3.3Å; G225-Y260 WeakPolarHBondContact CA-OH 3.39Å; G225-Y260 PolarHBondContact O-OH 3.36Å; G225-Y260 VanDerWaalsContact O-OH 3.06Å; V226-Y260 HydrophobicContact CB-CD2 4.3Å; V226-Y260 HydrophobicContact CB-CE2 4.35Å; V226-Y260 HydrophobicContact CG2-CD1 3.58Å; V226-Y260 HydrophobicContact CG2-CD2 3.65Å; V226-Y260 HydrophobicContact CG2-CE1 3.9Å; V226-Y260 HydrophobicContact CG2-CE2 3.96Å; V226-Y260 HydrophobicContact CG2-CG 3.45Å; V226-Y260 VanDerWaalsContact CG2-CG 3.45Å; N229-Y260 HydrophobicContact CB-CE2 3.85Å; A252-Y260 HydrophobicContact CB-CD2 4.23Å; A252-Y260 PolarHBondContact O-N 2.9Å; K253-Y260 CarbonylContact C-O 3.52Å; K253-Y260 WeakPolarHBondContact CA-O 3.29Å; E254-Y260 PolarHBondContact N-O 3.37Å; Y260-H264 AromaticContact CD1-CD2 3.97Å
261S83.5Confident78.8Confident47 Ų4757.9 Ų57.933%0.32930%0.3SS..  trans-54.7150.4173.166.50000112.9E254 T263 H264 V265E254-S261 PolarHBondContact OE1-N 2.61Å; S261-T263 VanDerWaalsContact C-N 3.32Å; S261-T263 PolarHBondContact O-N 3.49Å; S261-T263 PolarHBondContact OG-OG1 2.98Å; S261-H264 PolarHBondContact O-N 3.34Å; S261-H264 VanDerWaalsContact O-N 3.15Å; S261-H264 WeakPolarHBondContact OG-CB 3.39Å; S261-V265 PolarHBondContact O-N 3.38Å; S261-V265 VanDerWaalsContact O-N 3.09Å
262E82.7Confident79.4Confident90 Ų9055 Ų5542%0.42129%0.292SS..Hα-helixtrans-58.9-42.6-178.5-59-165.6136.800112.8K253 N255 H264 V265 E266K253-E262 HydrophobicContact CD-CG 4.31Å; N255-E262 PolarHBondContact ND2-OE1 3.3Å; E262-H264 PolarHBondContact O-N 3.18Å; E262-V265 PolarHBondContact O-N 2.93Å; E262-V265 VanDerWaalsContact O-N 3.17Å; E262-E266 WeakPolarHBondContact O-CG 3.41Å; E262-E266 PolarHBondContact O-N 2.95Å
263T80.5Confident79.8Confident101 Ų10159.1 Ų59.162%0.6231%0.31SS*.Hα-helixtrans-59.5-39.3179.258.40000111.2S261 N267S261-T263 VanDerWaalsContact C-N 3.32Å; S261-T263 PolarHBondContact O-N 3.49Å; S261-T263 PolarHBondContact OG-OG1 2.98Å; T263-N267 WeakPolarHBondContact O-CB 3.46Å; T263-N267 PolarHBondContact O-N 3.3Å; T263-N267 PolarHBondContact O-ND2 3.41Å
264H79.1Confident80.2Confident29 Ų2958 Ų5813%0.13431%0.305CS..Hα-helixtrans-69.6-41.6177.8-163.862.4000111.5T222 V226 Y260 S261 E262 N267 V268T222-H264 VanDerWaalsContact C-NE2 3.27Å; T222-H264 WeakPolarHBondContact CB-NE2 3.21Å; T222-H264 PolarHBondContact O-NE2 3.03Å; T222-H264 VanDerWaalsContact O-NE2 3.08Å; T222-H264 PolarHBondContact OG1-CE1 2.95Å; T222-H264 VanDerWaalsContact OG1-CE1 3.24Å; T222-H264 PolarHBondContact OG1-NE2 3.43Å; V226-H264 WeakPolarHBondContact CG2-CD2 3.27Å; Y260-H264 AromaticContact CD1-CD2 3.97Å; S261-H264 PolarHBondContact O-N 3.34Å; S261-H264 VanDerWaalsContact O-N 3.15Å; S261-H264 WeakPolarHBondContact OG-CB 3.39Å; E262-H264 PolarHBondContact O-N 3.18Å; H264-N267 WeakPolarHBondContact O-CB 3.5Å; H264-N267 PolarHBondContact O-N 3.33Å; H264-V268 VanDerWaalsContact O-CG2 3.3Å; H264-V268 WeakPolarHBondContact O-CG2 2.86Å; H264-V268 PolarHBondContact O-N 3.37Å
265V82Confident81Confident0 Ų055.8 Ų55.80%029%0.294CS..Hα-helixtrans-65.6-41175.9177.90000112.1V226 L249 A252 K253 S261 E262 V268 K269V226-V265 HydrophobicContact CG1-CG2 4.31Å; L249-V265 HydrophobicContact CB-CG1 4.37Å; L249-V265 VanDerWaalsContact O-CG1 3.25Å; L249-V265 WeakPolarHBondContact O-CG1 3.42Å; A252-V265 HydrophobicContact CB-CG2 4.17Å; K253-V265 HydrophobicContact CG-CB 3.81Å; K253-V265 HydrophobicContact CG-CG1 3.83Å; K253-V265 HydrophobicContact CG-CG2 3.84Å; S261-V265 PolarHBondContact O-N 3.38Å; S261-V265 VanDerWaalsContact O-N 3.09Å; E262-V265 PolarHBondContact O-N 2.93Å; E262-V265 VanDerWaalsContact O-N 3.17Å; V265-V268 PolarHBondContact O-N 2.89Å; V265-K269 WeakPolarHBondContact O-CG 3.47Å; V265-K269 PolarHBondContact O-N 3.4Å
266E83.6Confident82Confident76 Ų7652.4 Ų52.436%0.35528%0.278SS..Hα-helixtrans-64.6-41176-69.7-54.714200111.9K253 E262 V268 K269 V270K253-E266 WeakPolarHBondContact CE-OE1 3.25Å; K253-E266 IonicContact NZ-OE1 2.73Å; K253-E266 PolarHBondContact NZ-OE1 2.83Å; E262-E266 WeakPolarHBondContact O-CG 3.41Å; E262-E266 PolarHBondContact O-N 2.95Å; E266-V268 VanDerWaalsContact C-N 3.28Å; E266-V268 PolarHBondContact O-N 3.39Å; E266-K269 WeakPolarHBondContact O-CB 3.22Å; E266-K269 PolarHBondContact O-N 2.98Å; E266-K269 VanDerWaalsContact O-N 3.17Å; E266-K269 IonicContact OE1-NZ 3.25Å; E266-K269 PolarHBondContact OE1-NZ 3.29Å; E266-K269 WeakPolarHBondContact OE2-CD 3.34Å; E266-K269 IonicContact OE2-NZ 2.92Å; E266-V270 WeakPolarHBondContact O-CG2 3.46Å; E266-V270 PolarHBondContact O-N 3.47Å
267N82.6Confident83.2Confident31 Ų3148.2 Ų48.217%0.16626%0.256CS..Hα-helixtrans-56.2-44.5172-74.5-25.8000111.9T263 H264 V270 L271 H427 I428T263-N267 WeakPolarHBondContact O-CB 3.46Å; T263-N267 PolarHBondContact O-N 3.3Å; T263-N267 PolarHBondContact O-ND2 3.41Å; H264-N267 WeakPolarHBondContact O-CB 3.5Å; H264-N267 PolarHBondContact O-N 3.33Å; N267-V270 PolarHBondContact O-N 3.26Å; N267-L271 PolarHBondContact O-N 3.49Å; N267-H427 VanDerWaalsContact CG-NE2 3.28Å; N267-H427 PolarHBondContact ND2-NE2 2.88Å; N267-H427 VanDerWaalsContact ND2-NE2 3.16Å; N267-H427 PolarHBondContact OD1-NE2 3.39Å; N267-I428 HydrophobicContact CB-CD1 3.93Å; N267-I428 HydrophobicContact CB-CG2 4.11Å; N267-I428 WeakPolarHBondContact O-CD1 3.34Å
268V82.6Confident84.5Confident1 Ų145.4 Ų45.41%0.00623%0.225CC..Hα-helixtrans-64.6-42.8176.5174.90000111.4T223 V226 F227 L249 H264 V265 E266 V270 L271 T272T223-V268 HydrophobicContact CG2-CG2 3.91Å; V226-V268 HydrophobicContact CB-CG1 4.38Å; V226-V268 HydrophobicContact CB-CG2 3.9Å; V226-V268 HydrophobicContact CG1-CB 3.99Å; V226-V268 HydrophobicContact CG1-CG1 3.88Å; V226-V268 HydrophobicContact CG1-CG2 3.89Å; V226-V268 HydrophobicContact CG2-CG2 4.12Å; F227-V268 HydrophobicContact CD1-CG1 3.95Å; F227-V268 HydrophobicContact CD2-CG1 3.81Å; F227-V268 HydrophobicContact CE1-CG1 3.58Å; F227-V268 HydrophobicContact CE2-CG1 3.43Å; F227-V268 VanDerWaalsContact CE2-CG1 3.43Å; F227-V268 HydrophobicContact CG-CG1 4.05Å; F227-V268 HydrophobicContact CZ-CG1 3.29Å; L249-V268 HydrophobicContact CD2-CG1 3.76Å; H264-V268 VanDerWaalsContact O-CG2 3.3Å; H264-V268 WeakPolarHBondContact O-CG2 2.86Å; H264-V268 PolarHBondContact O-N 3.37Å; V265-V268 PolarHBondContact O-N 2.89Å; E266-V268 VanDerWaalsContact C-N 3.28Å; E266-V268 PolarHBondContact O-N 3.39Å; V268-V270 VanDerWaalsContact C-N 3.32Å; V268-V270 PolarHBondContact O-N 3.19Å; V268-L271 WeakPolarHBondContact O-CB 3.41Å; V268-L271 PolarHBondContact O-N 3.42Å; V268-L271 VanDerWaalsContact O-N 3.09Å; V268-T272 PolarHBondContact O-N 2.87Å; V268-T272 PolarHBondContact O-OG1 2.88Å
269K83.9Confident85.4Confident32 Ų3246.4 Ų46.414%0.13924%0.235CC..Hα-helixtrans-58-40.9176.4-75.7174.1175.7-176.90113.2L249 D250 V265 E266 L271 T272L249-K269 HydrophobicContact CB-CD 4.47Å; L249-K269 HydrophobicContact CB-CG 3.73Å; L249-K269 HydrophobicContact CD1-CB 4.43Å; L249-K269 HydrophobicContact CD1-CG 3.74Å; L249-K269 HydrophobicContact CG-CG 4.29Å; D250-K269 VanDerWaalsContact OD1-CE 3.3Å; D250-K269 WeakPolarHBondContact OD1-CE 3.42Å; D250-K269 IonicContact OD1-NZ 3.15Å; D250-K269 PolarHBondContact OD1-NZ 3.44Å; D250-K269 WeakPolarHBondContact OD2-CE 3.32Å; D250-K269 IonicContact OD2-NZ 2.71Å; D250-K269 PolarHBondContact OD2-NZ 3.3Å; V265-K269 WeakPolarHBondContact O-CG 3.47Å; V265-K269 PolarHBondContact O-N 3.4Å; E266-K269 WeakPolarHBondContact O-CB 3.22Å; E266-K269 PolarHBondContact O-N 2.98Å; E266-K269 VanDerWaalsContact O-N 3.17Å; E266-K269 IonicContact OE1-NZ 3.25Å; E266-K269 PolarHBondContact OE1-NZ 3.29Å; E266-K269 WeakPolarHBondContact OE2-CD 3.34Å; E266-K269 IonicContact OE2-NZ 2.92Å; K269-L271 VanDerWaalsContact C-N 3.33Å; K269-T272 PolarHBondContact O-N 2.76Å
270V83.4Confident86.2Confident41 Ų4137.5 Ų37.525%0.24820%0.203CC..Hα-helixtrans-63.4-43.3176.1-177.10000110.1E266 N267 V268 T272 K273 L423 I424E266-V270 WeakPolarHBondContact O-CG2 3.46Å; E266-V270 PolarHBondContact O-N 3.47Å; N267-V270 PolarHBondContact O-N 3.26Å; V268-V270 VanDerWaalsContact C-N 3.32Å; V268-V270 PolarHBondContact O-N 3.19Å; V270-T272 PolarHBondContact O-N 2.96Å; V270-K273 WeakPolarHBondContact O-CB 3.5Å; V270-K273 PolarHBondContact O-N 3.46Å; V270-L423 WeakPolarHBondContact CG1-O 3.42Å; V270-I424 HydrophobicContact CG1-CD1 4.04Å
271L85.3Confident86.9Confident4 Ų435.1 Ų35.12%0.02119%0.193CC..Hα-helixtrans-63-40.3177-178.361.9000113T223 F227 N267 V268 K269 K273 L274 F275 I424 I431 F435T223-L271 HydrophobicContact CG2-CD2 3.75Å; F227-L271 HydrophobicContact CE2-CD2 4.15Å; N267-L271 PolarHBondContact O-N 3.49Å; V268-L271 WeakPolarHBondContact O-CB 3.41Å; V268-L271 PolarHBondContact O-N 3.42Å; V268-L271 VanDerWaalsContact O-N 3.09Å; K269-L271 VanDerWaalsContact C-N 3.33Å; L271-K273 PolarHBondContact O-N 3.28Å; L271-K273 VanDerWaalsContact O-N 3.1Å; L271-L274 WeakPolarHBondContact O-CB 3.44Å; L271-L274 PolarHBondContact O-N 3.13Å; L271-F275 HydrophobicContact CD1-CE1 4.49Å; L271-F275 HydrophobicContact CD2-CE1 4.49Å; L271-F275 HydrophobicContact CG-CE1 4.04Å; L271-F275 HydrophobicContact CG-CZ 4.4Å; L271-I424 HydrophobicContact CB-CD1 4.33Å; L271-I424 HydrophobicContact CD1-CD1 4.09Å; L271-I431 HydrophobicContact CD2-CG2 3.98Å; L271-F435 HydrophobicContact CD1-CD2 4.49Å; L271-F435 HydrophobicContact CD2-CD2 3.78Å; L271-F435 HydrophobicContact CD2-CE2 3.69Å
272T85.5Confident87.5Confident31 Ų3135.4 Ų35.419%0.1919%0.191CC..Hα-helixtrans-56.5-29.2177.8-46.40000112.6F227 W248 L249 V268 K269 V270 L274 F275F227-T272 HydrophobicContact CE1-CG2 4.13Å; F227-T272 WeakPolarHBondContact CE1-OG1 3.29Å; F227-T272 VanDerWaalsContact CZ-OG1 3.31Å; F227-T272 WeakPolarHBondContact CZ-OG1 3.25Å; W248-T272 HydrophobicContact CZ2-CG2 4.4Å; L249-T272 HydrophobicContact CD1-CG2 4.23Å; L249-T272 WeakPolarHBondContact CD1-OG1 3.17Å; V268-T272 PolarHBondContact O-N 2.87Å; V268-T272 PolarHBondContact O-OG1 2.88Å; K269-T272 PolarHBondContact O-N 2.76Å; V270-T272 PolarHBondContact O-N 2.96Å; T272-L274 PolarHBondContact O-N 2.86Å; T272-F275 HydrophobicContact CG2-CD2 4.22Å; T272-F275 PolarHBondContact O-N 3.14Å
273K86.1Confident88.2Confident87 Ų8732.5 Ų32.538%0.37818%0.178SC..THydrogen-bonded Turntrans-63.7-22.4177-61.3178-178.8176.90112.5V270 L271 Y500V270-K273 WeakPolarHBondContact O-CB 3.5Å; V270-K273 PolarHBondContact O-N 3.46Å; L271-K273 PolarHBondContact O-N 3.28Å; L271-K273 VanDerWaalsContact O-N 3.1Å; K273-Y500 WeakPolarHBondContact O-CE1 3.26Å; K273-Y500 PolarHBondContact O-OH 2.68Å
274L88.9Confident89Confident1 Ų127.7 Ų27.71%0.00515%0.148CC..THydrogen-bonded Turntrans-91.1-13.5177.9-62.2-173.7000114L271 T272 L277 Y278 I419 L423 I424 Y500L271-L274 WeakPolarHBondContact O-CB 3.44Å; L271-L274 PolarHBondContact O-N 3.13Å; T272-L274 PolarHBondContact O-N 2.86Å; L274-L277 HydrophobicContact CD2-CD2 4.41Å; L274-L277 WeakPolarHBondContact O-CA 3.4Å; L274-L277 WeakPolarHBondContact O-CB 3.35Å; L274-L277 PolarHBondContact O-N 3.28Å; L274-L277 VanDerWaalsContact O-N 3.08Å; L274-Y278 HydrophobicContact CB-CD2 4.4Å; L274-Y278 HydrophobicContact CB-CE1 4.29Å; L274-Y278 HydrophobicContact CB-CE2 3.87Å; L274-Y278 VanDerWaalsContact CD1-OH 3.28Å; L274-Y278 WeakPolarHBondContact CD1-OH 3.49Å; L274-Y278 PolarHBondContact O-N 3.42Å; L274-I419 HydrophobicContact CD2-CG2 4.1Å; L274-L423 HydrophobicContact CD2-CB 4.34Å; L274-L423 HydrophobicContact CD2-CD1 3.77Å; L274-I424 HydrophobicContact CD1-CD1 3.65Å; L274-I424 HydrophobicContact CD1-CG1 3.46Å; L274-I424 VanDerWaalsContact CD1-CG1 3.46Å; L274-I424 HydrophobicContact CG-CD1 4.31Å; L274-Y500 HydrophobicContact CD2-CD1 4.49Å; L274-Y500 HydrophobicContact CD2-CE1 4.02Å
275F90.5Very high89.9Confident62 Ų6227.6 Ų27.627%0.27215%0.147SC..Hα-helixtrans-60.6-38.4-179.2-72.6-9.3000114.7F227 L271 T272 L277 Y278 G279 F435F227-F275 AromaticContact CD1-CE2 3.93Å; F227-F275 HydrophobicContact CD1-CE2 3.93Å; F227-F275 HydrophobicContact CD2-CE2 4.26Å; F227-F275 HydrophobicContact CD2-CZ 4.17Å; F227-F275 HydrophobicContact CE1-CD2 4.09Å; F227-F275 AromaticContact CE1-CE2 3.27Å; F227-F275 HydrophobicContact CE1-CE2 3.27Å; F227-F275 AromaticContact CE1-CZ 3.93Å; F227-F275 HydrophobicContact CE1-CZ 3.93Å; F227-F275 AromaticContact CE2-CE2 3.65Å; F227-F275 HydrophobicContact CE2-CE2 3.65Å; F227-F275 AromaticContact CE2-CZ 3.38Å; F227-F275 HydrophobicContact CE2-CZ 3.38Å; F227-F275 HydrophobicContact CG-CE2 4.39Å; F227-F275 HydrophobicContact CZ-CD2 4.12Å; F227-F275 HydrophobicContact CZ-CE1 4.34Å; F227-F275 AromaticContact CZ-CE2 3.1Å; F227-F275 HydrophobicContact CZ-CE2 3.1Å; F227-F275 AromaticContact CZ-CZ 3.25Å; F227-F275 HydrophobicContact CZ-CZ 3.25Å; L271-F275 HydrophobicContact CD1-CE1 4.49Å; L271-F275 HydrophobicContact CD2-CE1 4.49Å; L271-F275 HydrophobicContact CG-CE1 4.04Å; L271-F275 HydrophobicContact CG-CZ 4.4Å; T272-F275 HydrophobicContact CG2-CD2 4.22Å; T272-F275 PolarHBondContact O-N 3.14Å; F275-L277 VanDerWaalsContact C-N 3.3Å; F275-L277 PolarHBondContact O-N 3.19Å; F275-Y278 HydrophobicContact CD1-CD2 4.06Å; F275-Y278 PolarHBondContact O-N 3.25Å; F275-G279 PolarHBondContact O-N 3.44Å; F275-F435 HydrophobicContact CE1-CD1 4Å; F275-F435 HydrophobicContact CE1-CE1 4.28Å; F275-F435 HydrophobicContact CE1-CG 4.14Å; F275-F435 HydrophobicContact CZ-CD1 4.3Å; F275-F435 HydrophobicContact CZ-CE1 4.11Å; F275-F435 HydrophobicContact CZ-CZ 4.36Å
276P92.1Very high90.6Very high45 Ų4527.6 Ų27.629%0.29215%0.147SC..Hα-helixtrans-59.5-41.2172.2-24.734.8000112.5L280 L496P276-L280 WeakPolarHBondContact O-CG 3.02Å; P276-L280 PolarHBondContact O-N 3.34Å; P276-L280 VanDerWaalsContact O-N 3.17Å; P276-L496 HydrophobicContact CB-CD1 4.25Å
277L92.4Very high91.3Very high0 Ų024 Ų240%013%0.13CC..Hα-helixtrans-59.5-49.8174167.768.9000110.9L274 F275 L280 Q281 I352 I419 F493 Y500L274-L277 HydrophobicContact CD2-CD2 4.41Å; L274-L277 WeakPolarHBondContact O-CA 3.4Å; L274-L277 WeakPolarHBondContact O-CB 3.35Å; L274-L277 PolarHBondContact O-N 3.28Å; L274-L277 VanDerWaalsContact O-N 3.08Å; F275-L277 VanDerWaalsContact C-N 3.3Å; F275-L277 PolarHBondContact O-N 3.19Å; L277-L280 PolarHBondContact O-N 3.43Å; L277-Q281 WeakPolarHBondContact O-CG 3.27Å; L277-Q281 PolarHBondContact O-N 3.49Å; L277-Q281 PolarHBondContact O-NE2 3.36Å; L277-I352 HydrophobicContact CD1-CD1 4.01Å; L277-I419 HydrophobicContact CD2-CB 4.27Å; L277-I419 HydrophobicContact CD2-CG2 3.85Å; L277-F493 HydrophobicContact CD1-CD2 4.4Å; L277-F493 HydrophobicContact CD1-CE2 3.39Å; L277-F493 HydrophobicContact CD1-CZ 3.86Å; L277-Y500 HydrophobicContact CB-CE1 4.41Å; L277-Y500 HydrophobicContact CB-CE2 4.08Å; L277-Y500 PolarHBondContact N-OH 3.4Å
278Y93.9Very high91.9Very high8 Ų822.9 Ų22.93%0.03113%0.125CC..Hα-helixtrans-67.4-36.2-178.6-60-20.6000113.3L274 F275 Q281 S420 S432 F435 L436L274-Y278 HydrophobicContact CB-CD2 4.4Å; L274-Y278 HydrophobicContact CB-CE1 4.29Å; L274-Y278 HydrophobicContact CB-CE2 3.87Å; L274-Y278 VanDerWaalsContact CD1-OH 3.28Å; L274-Y278 WeakPolarHBondContact CD1-OH 3.49Å; L274-Y278 PolarHBondContact O-N 3.42Å; F275-Y278 HydrophobicContact CD1-CD2 4.06Å; F275-Y278 PolarHBondContact O-N 3.25Å; Y278-Q281 WeakPolarHBondContact O-CB 3.44Å; Y278-Q281 PolarHBondContact O-N 3.23Å; Y278-Q281 VanDerWaalsContact O-N 3.15Å; Y278-S420 WeakPolarHBondContact CE1-OG 3.34Å; Y278-S420 WeakPolarHBondContact OH-CB 3.32Å; Y278-S420 PolarHBondContact OH-OG 3.39Å; Y278-S432 PolarHBondContact OH-O 2.9Å; Y278-S432 PolarHBondContact OH-OG 3.39Å; Y278-F435 HydrophobicContact CD2-CB 4.07Å; Y278-F435 HydrophobicContact CE2-CB 3.91Å; Y278-L436 HydrophobicContact CD1-CB 4.46Å; Y278-L436 HydrophobicContact CD1-CD1 3.73Å; Y278-L436 HydrophobicContact CE1-CB 4.04Å; Y278-L436 HydrophobicContact CE1-CD1 3.78Å; Y278-L436 HydrophobicContact CE1-CG 4.39Å
279G94.9Very high92.4Very high35 Ų3523.2 Ų23.236%0.36113%0.126SC..Hα-helixtrans-61.7-43.1175.700000111.9F275 Q281 L282F275-G279 PolarHBondContact O-N 3.44Å; G279-Q281 PolarHBondContact O-N 2.91Å; G279-L282 VanDerWaalsContact O-CB 3.25Å; G279-L282 WeakPolarHBondContact O-CB 3.3Å; G279-L282 WeakPolarHBondContact O-CG 3.36Å; G279-L282 PolarHBondContact O-N 2.83Å
280L95.6Very high93Very high17 Ų1721.7 Ų21.79%0.08912%0.12CC..Hα-helixtrans-71.5-16.1176.8-63.6170.6000113.3P276 L277 L282 N489 L492 F493 L496P276-L280 WeakPolarHBondContact O-CG 3.02Å; P276-L280 PolarHBondContact O-N 3.34Å; P276-L280 VanDerWaalsContact O-N 3.17Å; L277-L280 PolarHBondContact O-N 3.43Å; L280-L282 VanDerWaalsContact C-N 3.31Å; L280-N489 WeakPolarHBondContact CD2-OD1 3.47Å; L280-N489 PolarHBondContact O-ND2 3.19Å; L280-L492 HydrophobicContact CD1-CG 4.29Å; L280-L492 HydrophobicContact CD2-CD2 3.66Å; L280-L492 HydrophobicContact CD2-CG 4.08Å; L280-F493 HydrophobicContact CB-CD2 4.48Å; L280-F493 HydrophobicContact CD1-CB 3.9Å; L280-F493 HydrophobicContact CD1-CD2 3.83Å; L280-F493 HydrophobicContact CD1-CG 4.37Å; L280-L496 HydrophobicContact CD1-CD1 3.65Å
281Q95.4Very high93.5Very high0 Ų020.3 Ų20.30%011%0.111CC..Hα-helixtrans-75.2-18.6169.5-59.4-40.1-47.500113.2L277 Y278 G279 R285 H356 C416 Y440L277-Q281 WeakPolarHBondContact O-CG 3.27Å; L277-Q281 PolarHBondContact O-N 3.49Å; L277-Q281 PolarHBondContact O-NE2 3.36Å; Y278-Q281 WeakPolarHBondContact O-CB 3.44Å; Y278-Q281 PolarHBondContact O-N 3.23Å; Y278-Q281 VanDerWaalsContact O-N 3.15Å; G279-Q281 PolarHBondContact O-N 2.91Å; Q281-R285 VanDerWaalsContact O-CB 3.25Å; Q281-R285 WeakPolarHBondContact O-CB 3.1Å; Q281-R285 PolarHBondContact O-N 2.89Å; Q281-H356 PolarHBondContact NE2-NE2 3.44Å; Q281-H356 PolarHBondContact OE1-NE2 2.86Å; Q281-C416 VanDerWaalsContact CD-SG 3.53Å; Q281-Y440 HydrophobicContact CB-CE1 4.3Å
282L97Very high93.9Very high53 Ų5320.9 Ų20.928%0.27712%0.115SC..Hα-helixtrans-61.4-54.3177.7-68.5165.5000110.6G279 L280 R285 V286 S439 L446G279-L282 VanDerWaalsContact O-CB 3.25Å; G279-L282 WeakPolarHBondContact O-CB 3.3Å; G279-L282 WeakPolarHBondContact O-CG 3.36Å; G279-L282 PolarHBondContact O-N 2.83Å; L280-L282 VanDerWaalsContact C-N 3.31Å; L282-R285 WeakPolarHBondContact O-CB 3.49Å; L282-R285 PolarHBondContact O-N 3.34Å; L282-R285 VanDerWaalsContact O-N 3.14Å; L282-V286 WeakPolarHBondContact O-CG2 3.27Å; L282-V286 PolarHBondContact O-N 3.29Å; L282-S439 VanDerWaalsContact CD2-O 3.22Å; L282-S439 WeakPolarHBondContact CD2-O 3.19Å; L282-L446 HydrophobicContact CB-CD2 3.95Å
283L97.5Very high94.4Very high29 Ų2919.4 Ų19.415%0.15211%0.106CC..Hα-helixtrans-69.2-35.9-178.9-178.456.1000112.4R285 V286 C287 L482 L485 M486 N489L283-R285 VanDerWaalsContact C-N 3.28Å; L283-R285 PolarHBondContact O-N 3.46Å; L283-V286 HydrophobicContact CD1-CB 4.33Å; L283-V286 WeakPolarHBondContact O-CB 3.03Å; L283-V286 PolarHBondContact O-N 3.24Å; L283-C287 PolarHBondContact O-N 2.98Å; L283-C287 PolarHBondContact O-SG 3.39Å; L283-L482 HydrophobicContact CD1-CD1 3.96Å; L283-L485 HydrophobicContact CD1-CB 4.22Å; L283-L485 HydrophobicContact CD2-CB 3.91Å; L283-M486 HydrophobicContact CG-SD 4.45Å; L283-N489 HydrophobicContact CD2-CB 3.7Å; L283-N489 HydrophobicContact CG-CB 4.38Å
284Y97.6Very high94.8Very high0 Ų015.3 Ų15.30%09%0.088CC..Hα-helixtrans-57.4-44.3169.2169.7-103000111.5V286 C287 V288 H356 A359 G408 E409 V412 M486Y284-V286 VanDerWaalsContact C-N 3.33Å; Y284-V286 PolarHBondContact O-N 3.45Å; Y284-C287 WeakPolarHBondContact O-CB 3.45Å; Y284-C287 PolarHBondContact O-N 3.22Å; Y284-C287 VanDerWaalsContact O-N 3.12Å; Y284-V288 HydrophobicContact CD1-CG2 4.34Å; Y284-V288 HydrophobicContact CE1-CG2 3.71Å; Y284-V288 HydrophobicContact CE2-CG2 4Å; Y284-V288 VanDerWaalsContact CZ-CG2 3.5Å; Y284-V288 PolarHBondContact O-N 3.3Å; Y284-H356 WeakPolarHBondContact CB-NE2 3.44Å; Y284-H356 AromaticContact CD2-CD2 3.43Å; Y284-H356 VanDerWaalsContact CD2-CD2 3.43Å; Y284-H356 WeakPolarHBondContact CD2-CD2 3.43Å; Y284-H356 AromaticContact CD2-NE2 3.81Å; Y284-H356 AromaticContact CG-CD2 3.7Å; Y284-H356 AromaticContact CG-NE2 3.55Å; Y284-A359 HydrophobicContact CD2-CB 3.91Å; Y284-A359 HydrophobicContact CE2-CB 3.82Å; Y284-G408 PolarHBondContact OH-O 3.12Å; Y284-G408 VanDerWaalsContact OH-O 3.08Å; Y284-E409 WeakPolarHBondContact OH-CA 3.28Å; Y284-E409 PolarHBondContact OH-N 3.44Å; Y284-V412 HydrophobicContact CD1-CG1 3.86Å; Y284-V412 HydrophobicContact CE1-CB 3.82Å; Y284-V412 HydrophobicContact CE1-CG1 3.53Å; Y284-V412 HydrophobicContact CE1-CG2 4.2Å; Y284-V412 HydrophobicContact CE2-CB 4.39Å; Y284-V412 HydrophobicContact CE2-CG2 3.88Å; Y284-M486 HydrophobicContact CD2-CE 3.89Å; Y284-M486 HydrophobicContact CG-CE 4.47Å
285R96.6Very high95.1Very high26 Ų2615.2 Ų15.210%0.0989%0.088CC..Hα-helixtrans-65.3-35176.9-177.262.766.4-176.4-0.3112Q281 L282 L283 C287 V288 T289 E409 Y440Q281-R285 VanDerWaalsContact O-CB 3.25Å; Q281-R285 WeakPolarHBondContact O-CB 3.1Å; Q281-R285 PolarHBondContact O-N 2.89Å; L282-R285 WeakPolarHBondContact O-CB 3.49Å; L282-R285 PolarHBondContact O-N 3.34Å; L282-R285 VanDerWaalsContact O-N 3.14Å; L283-R285 VanDerWaalsContact C-N 3.28Å; L283-R285 PolarHBondContact O-N 3.46Å; R285-C287 PolarHBondContact O-N 2.81Å; R285-V288 PolarHBondContact O-N 3.25Å; R285-T289 HydrophobicContact CG-CG2 4.25Å; R285-T289 WeakPolarHBondContact O-CB 3.41Å; R285-T289 VanDerWaalsContact O-CG2 3.3Å; R285-T289 WeakPolarHBondContact O-CG2 3.48Å; R285-T289 PolarHBondContact O-N 3.29Å; R285-T289 PolarHBondContact O-OG1 3.15Å; R285-E409 IonicContact CZ-OE1 2.84Å; R285-E409 IonicContact NH1-OE1 3.46Å; R285-E409 PolarHBondContact NH1-OE1 2.87Å; R285-Y440 WeakPolarHBondContact CG-O 3.49Å
286V97.9Very high95.3Very high0 Ų012.4 Ų12.40%08%0.075CC..Hα-helixtrans-55.6-41.1171.3176.50000111.5L282 L283 Y284 T289 Q290 G443 L446 I450 L482L282-V286 WeakPolarHBondContact O-CG2 3.27Å; L282-V286 PolarHBondContact O-N 3.29Å; L283-V286 HydrophobicContact CD1-CB 4.33Å; L283-V286 WeakPolarHBondContact O-CB 3.03Å; L283-V286 PolarHBondContact O-N 3.24Å; Y284-V286 VanDerWaalsContact C-N 3.33Å; Y284-V286 PolarHBondContact O-N 3.45Å; V286-T289 WeakPolarHBondContact CA-OG1 3.22Å; V286-T289 PolarHBondContact O-N 2.82Å; V286-T289 PolarHBondContact O-OG1 3.23Å; V286-Q290 PolarHBondContact O-NE2 2.83Å; V286-Q290 VanDerWaalsContact O-NE2 3.1Å; V286-G443 WeakPolarHBondContact CG2-O 3.38Å; V286-L446 HydrophobicContact CG2-CB 4.11Å; V286-L446 HydrophobicContact CG2-CD2 4Å; V286-L446 HydrophobicContact CG2-CG 3.94Å; V286-I450 HydrophobicContact CG1-CD1 4.16Å; V286-I450 HydrophobicContact CG2-CD1 4.2Å; V286-L482 HydrophobicContact CB-CD1 4.42Å; V286-L482 HydrophobicContact CG1-CD1 3.7Å; V286-L482 HydrophobicContact CG1-CD2 4.33Å
287C97.8Very high95.4Very high0 Ų010.3 Ų10.30%06%0.062CC..Hα-helixtrans-67.9-45.8176.1-59.20000111.9L283 Y284 R285 T289 Q290 A359 V363 L405L283-C287 PolarHBondContact O-N 2.98Å; L283-C287 PolarHBondContact O-SG 3.39Å; Y284-C287 WeakPolarHBondContact O-CB 3.45Å; Y284-C287 PolarHBondContact O-N 3.22Å; Y284-C287 VanDerWaalsContact O-N 3.12Å; R285-C287 PolarHBondContact O-N 2.81Å; C287-T289 PolarHBondContact O-N 3.08Å; C287-Q290 VanDerWaalsContact O-CB 3.25Å; C287-Q290 WeakPolarHBondContact O-CB 3.43Å; C287-Q290 VanDerWaalsContact O-CG 3.3Å; C287-Q290 WeakPolarHBondContact O-CG 3.48Å; C287-Q290 PolarHBondContact O-N 2.92Å; C287-A359 HydrophobicContact CB-CB 4.16Å; C287-V363 HydrophobicContact CB-CG2 4Å; C287-L405 WeakPolarHBondContact O-CD2 3.33Å
288V94.8Very high95.6Very high9 Ų910.3 Ų10.36%0.0556%0.062CC..Hα-helixtrans-58.6-39.9176.21750000111.3Y284 R285 Q290 I291 L405Y284-V288 HydrophobicContact CD1-CG2 4.34Å; Y284-V288 HydrophobicContact CE1-CG2 3.71Å; Y284-V288 HydrophobicContact CE2-CG2 4Å; Y284-V288 VanDerWaalsContact CZ-CG2 3.5Å; Y284-V288 PolarHBondContact O-N 3.3Å; R285-V288 PolarHBondContact O-N 3.25Å; V288-Q290 PolarHBondContact O-N 3.04Å; V288-Q290 VanDerWaalsContact O-N 3.08Å; V288-I291 PolarHBondContact O-N 2.81Å; V288-L405 HydrophobicContact CB-CD1 4.46Å; V288-L405 HydrophobicContact CG2-CD1 3.89Å; V288-L405 HydrophobicContact CG2-CG 4.39Å
289T93.6Very high95.6Very high7 Ų710 Ų104%0.0436%0.06CC..THydrogen-bonded Turntrans-71.20.117955.90000114.4L49 R285 V286 C287 I291 P292 S293 C444L49-T289 HydrophobicContact CD2-CG2 4.2Å; R285-T289 HydrophobicContact CG-CG2 4.25Å; R285-T289 WeakPolarHBondContact O-CB 3.41Å; R285-T289 VanDerWaalsContact O-CG2 3.3Å; R285-T289 WeakPolarHBondContact O-CG2 3.48Å; R285-T289 PolarHBondContact O-N 3.29Å; R285-T289 PolarHBondContact O-OG1 3.15Å; V286-T289 WeakPolarHBondContact CA-OG1 3.22Å; V286-T289 PolarHBondContact O-N 2.82Å; V286-T289 PolarHBondContact O-OG1 3.23Å; C287-T289 PolarHBondContact O-N 3.08Å; T289-I291 VanDerWaalsContact C-N 3.27Å; T289-I291 PolarHBondContact O-N 3.21Å; T289-P292 VanDerWaalsContact O-CD 3.28Å; T289-P292 WeakPolarHBondContact O-CD 3.33Å; T289-P292 WeakPolarHBondContact O-CG 3.35Å; T289-S293 WeakPolarHBondContact O-CB 3.32Å; T289-S293 PolarHBondContact O-N 3.28Å; T289-S293 PolarHBondContact O-OG 2.93Å; T289-C444 HydrophobicContact CG2-CB 4.28Å; T289-C444 VanDerWaalsContact CG2-SG 3.57Å
290Q96Very high95.5Very high0 Ų08.7 Ų8.70%05%0.045CC..THydrogen-bonded Turntrans-66.3-29.1168.5-63.3-49.6-52.200112.6V286 C287 V288 S293 G294 Y295 L482V286-Q290 PolarHBondContact O-NE2 2.83Å; V286-Q290 VanDerWaalsContact O-NE2 3.1Å; C287-Q290 VanDerWaalsContact O-CB 3.25Å; C287-Q290 WeakPolarHBondContact O-CB 3.43Å; C287-Q290 VanDerWaalsContact O-CG 3.3Å; C287-Q290 WeakPolarHBondContact O-CG 3.48Å; C287-Q290 PolarHBondContact O-N 2.92Å; V288-Q290 PolarHBondContact O-N 3.04Å; V288-Q290 VanDerWaalsContact O-N 3.08Å; Q290-S293 WeakPolarHBondContact CA-OG 3.45Å; Q290-S293 CarbonylContact O-C 3.59Å; Q290-S293 PolarHBondContact O-N 3.44Å; Q290-G294 PolarHBondContact O-N 3Å; Q290-Y295 HydrophobicContact CB-CD1 3.8Å; Q290-Y295 HydrophobicContact CB-CD2 4.28Å; Q290-Y295 HydrophobicContact CB-CE1 3.7Å; Q290-Y295 HydrophobicContact CB-CE2 4.23Å; Q290-Y295 HydrophobicContact CB-CG 4.08Å; Q290-Y295 HydrophobicContact CG-CE1 4.43Å; Q290-Y295 VanDerWaalsContact O-CB 3.31Å; Q290-Y295 WeakPolarHBondContact O-CB 3.14Å; Q290-Y295 PolarHBondContact O-N 3.49Å; Q290-L482 HydrophobicContact CG-CD2 3.6Å
291I94.4Very high95.4Very high13 Ų138.9 Ų8.97%0.0675%0.046CC..THydrogen-bonded Turntrans-51.9-59.3174.7-71.7162.2000111.2V288 T289 S293 Y295 Y296 N317 Y402 L405V288-I291 PolarHBondContact O-N 2.81Å; T289-I291 VanDerWaalsContact C-N 3.27Å; T289-I291 PolarHBondContact O-N 3.21Å; I291-S293 PolarHBondContact O-N 3.4Å; I291-Y295 HydrophobicContact CG1-CD2 4.05Å; I291-Y296 WeakPolarHBondContact O-CB 3.26Å; I291-Y296 PolarHBondContact O-N 2.98Å; I291-N317 HydrophobicContact CG2-CB 4.4Å; I291-N317 VanDerWaalsContact CG2-OD1 3.24Å; I291-N317 WeakPolarHBondContact CG2-OD1 3.4Å; I291-Y402 HydrophobicContact CB-CE1 4.47Å; I291-Y402 HydrophobicContact CG1-CD1 4.09Å; I291-Y402 HydrophobicContact CG1-CE1 4.24Å; I291-Y402 HydrophobicContact CG2-CD1 4.35Å; I291-Y402 HydrophobicContact CG2-CE1 4Å; I291-L405 HydrophobicContact CD1-CB 4.21Å; I291-L405 HydrophobicContact CD1-CD2 3.57Å; I291-L405 HydrophobicContact CD1-CG 3.91Å; I291-L405 HydrophobicContact CG1-CD2 3.6Å; I291-L405 HydrophobicContact CG1-CG 4.47Å
292P93.8Very high95.4Very high16 Ų168.9 Ų8.910%0.1045%0.046CC..THydrogen-bonded Turntrans-82.313.5177.735.3-40.4000114.2V26 I30 N48 L49 I52 T289V26-P292 HydrophobicContact CG1-CB 3.97Å; I30-P292 WeakPolarHBondContact CD1-O 3.44Å; N48-P292 PolarHBondContact ND2-O 3.27Å; L49-P292 HydrophobicContact CD2-CG 4.44Å; I52-P292 HydrophobicContact CD1-CB 3.83Å; I52-P292 HydrophobicContact CD1-CG 3.67Å; T289-P292 VanDerWaalsContact O-CD 3.28Å; T289-P292 WeakPolarHBondContact O-CD 3.33Å; T289-P292 WeakPolarHBondContact O-CG 3.35Å
293S94.9Very high95.2Very high0 Ų08.1 Ų8.10%04%0.042CC..THydrogen-bonded Turntrans-134.5-99.8178.763.40000112.4T289 Q290 I291 Y295 Y296 I297T289-S293 WeakPolarHBondContact O-CB 3.32Å; T289-S293 PolarHBondContact O-N 3.28Å; T289-S293 PolarHBondContact O-OG 2.93Å; Q290-S293 WeakPolarHBondContact CA-OG 3.45Å; Q290-S293 CarbonylContact O-C 3.59Å; Q290-S293 PolarHBondContact O-N 3.44Å; I291-S293 PolarHBondContact O-N 3.4Å; S293-Y295 VanDerWaalsContact C-N 3.34Å; S293-Y295 PolarHBondContact O-N 3.15Å; S293-Y296 WeakPolarHBondContact O-CB 3.13Å; S293-Y296 PolarHBondContact O-N 3.25Å; S293-Y296 VanDerWaalsContact O-N 3.12Å; S293-I297 WeakPolarHBondContact O-CG1 3.49Å; S293-I297 PolarHBondContact O-N 2.93Å
294G94.5Very high95Very high0 Ų06.7 Ų6.70%04%0.035CC..Hα-helixtrans-57.2-42.6-175.500000113.7Q290 Y296 I297 Q298 Y466Q290-G294 PolarHBondContact O-N 3Å; G294-Y296 VanDerWaalsContact C-N 3.34Å; G294-I297 PolarHBondContact O-N 3.44Å; G294-Q298 WeakPolarHBondContact O-CB 3.46Å; G294-Q298 PolarHBondContact O-N 3.05Å; G294-Y466 PolarHBondContact N-OH 3.49Å
295Y96Very high94.6Very high0 Ų010.8 Ų10.80%05%0.054CC..Hα-helixtrans-71.3-32.5179.3-62.5-2.9000112Q290 I291 S293 Q298 A299 S362 V363 A366 Q401 Y402 L405 F479Q290-Y295 HydrophobicContact CB-CD1 3.8Å; Q290-Y295 HydrophobicContact CB-CD2 4.28Å; Q290-Y295 HydrophobicContact CB-CE1 3.7Å; Q290-Y295 HydrophobicContact CB-CE2 4.23Å; Q290-Y295 HydrophobicContact CB-CG 4.08Å; Q290-Y295 HydrophobicContact CG-CE1 4.43Å; Q290-Y295 VanDerWaalsContact O-CB 3.31Å; Q290-Y295 WeakPolarHBondContact O-CB 3.14Å; Q290-Y295 PolarHBondContact O-N 3.49Å; I291-Y295 HydrophobicContact CG1-CD2 4.05Å; S293-Y295 VanDerWaalsContact C-N 3.34Å; S293-Y295 PolarHBondContact O-N 3.15Å; Y295-Q298 PolarHBondContact O-N 2.85Å; Y295-A299 WeakPolarHBondContact O-CB 3.46Å; Y295-A299 PolarHBondContact O-N 3.37Å; Y295-S362 VanDerWaalsContact OH-C 3.27Å; Y295-S362 PolarHBondContact OH-O 3.26Å; Y295-S362 PolarHBondContact OH-OG 3.43Å; Y295-V363 VanDerWaalsContact OH-CA 3.31Å; Y295-V363 WeakPolarHBondContact OH-CA 3.28Å; Y295-V363 PolarHBondContact OH-N 3.48Å; Y295-A366 HydrophobicContact CD1-CB 4.09Å; Y295-A366 HydrophobicContact CE1-CB 3.31Å; Y295-Q401 HydrophobicContact CD2-CG 3.83Å; Y295-Q401 HydrophobicContact CE1-CG 4.37Å; Y295-Q401 HydrophobicContact CE2-CB 4.1Å; Y295-Q401 HydrophobicContact CE2-CG 3.6Å; Y295-Q401 HydrophobicContact CG-CG 4.3Å; Y295-Y402 VanDerWaalsContact CB-OH 3.3Å; Y295-Y402 WeakPolarHBondContact CB-OH 3.42Å; Y295-Y402 HydrophobicContact CD2-CD2 4.33Å; Y295-Y402 HydrophobicContact CD2-CE2 4.14Å; Y295-Y402 HydrophobicContact CG-CE2 4.34Å; Y295-Y402 PolarHBondContact O-OH 2.91Å; Y295-L405 HydrophobicContact CD2-CD2 4.43Å; Y295-L405 HydrophobicContact CE2-CD2 3.74Å; Y295-F479 AromaticContact CD1-CE1 3.91Å; Y295-F479 HydrophobicContact CD1-CE1 3.91Å; Y295-F479 AromaticContact CD1-CZ 3.87Å; Y295-F479 HydrophobicContact CD1-CZ 3.87Å; Y295-F479 HydrophobicContact CE1-CD1 4.33Å; Y295-F479 AromaticContact CE1-CE1 3.84Å; Y295-F479 HydrophobicContact CE1-CE1 3.84Å; Y295-F479 HydrophobicContact CE1-CZ 4.12Å
296Y95.1Very high94.1Very high3 Ų313.2 Ų13.21%0.0127%0.068CC..Hα-helixtrans-62.3-47.3173.3-173.1-78.9000110.4C27 I30 L31 I291 S293 G294 Q298 A299 M300 I313C27-Y296 WeakPolarHBondContact O-CE2 3.24Å; C27-Y296 PolarHBondContact O-OH 2.91Å; I30-Y296 HydrophobicContact CB-CD1 3.65Å; I30-Y296 HydrophobicContact CB-CE1 3.66Å; I30-Y296 HydrophobicContact CB-CG 4.49Å; I30-Y296 HydrophobicContact CD1-CD1 3.91Å; I30-Y296 HydrophobicContact CD1-CG 4.08Å; I30-Y296 HydrophobicContact CG1-CD1 4.33Å; I30-Y296 HydrophobicContact CG2-CD1 3.64Å; I30-Y296 HydrophobicContact CG2-CE1 3.79Å; L31-Y296 HydrophobicContact CB-CE1 4.48Å; L31-Y296 WeakPolarHBondContact CB-OH 3.28Å; I291-Y296 WeakPolarHBondContact O-CB 3.26Å; I291-Y296 PolarHBondContact O-N 2.98Å; S293-Y296 WeakPolarHBondContact O-CB 3.13Å; S293-Y296 PolarHBondContact O-N 3.25Å; S293-Y296 VanDerWaalsContact O-N 3.12Å; G294-Y296 VanDerWaalsContact C-N 3.34Å; Y296-Q298 VanDerWaalsContact C-N 3.34Å; Y296-A299 PolarHBondContact O-N 3.07Å; Y296-M300 HydrophobicContact CE1-SD 4.38Å; Y296-M300 WeakPolarHBondContact O-CB 3.43Å; Y296-M300 PolarHBondContact O-N 3.29Å; Y296-I313 HydrophobicContact CD1-CG2 4.12Å; Y296-I313 HydrophobicContact CD2-CG2 3.62Å; Y296-I313 HydrophobicContact CE1-CD1 4.04Å; Y296-I313 HydrophobicContact CE1-CG2 3.9Å; Y296-I313 HydrophobicContact CE2-CB 3.95Å; Y296-I313 HydrophobicContact CE2-CG2 3.39Å; Y296-I313 HydrophobicContact CG-CG2 3.98Å; Y296-I313 WeakPolarHBondContact OH-CD1 3.42Å
297I94.2Very high93.4Very high1 Ų121.1 Ų21.11%0.00511%0.111CC..Hα-helixtrans-66.1-40.1179.4-63.4179.8000110.8I30 N41 A45 S293 G294 M300 N301 Y466 L470I30-I297 HydrophobicContact CD1-CG1 4.27Å; I30-I297 HydrophobicContact CG2-CD1 4.41Å; I30-I297 HydrophobicContact CG2-CG1 3.89Å; N41-I297 HydrophobicContact CB-CD1 3.8Å; A45-I297 HydrophobicContact CB-CD1 4.25Å; S293-I297 WeakPolarHBondContact O-CG1 3.49Å; S293-I297 PolarHBondContact O-N 2.93Å; G294-I297 PolarHBondContact O-N 3.44Å; I297-M300 PolarHBondContact O-N 2.97Å; I297-N301 PolarHBondContact O-N 3.13Å; I297-N301 VanDerWaalsContact O-N 3.1Å; I297-N301 PolarHBondContact O-ND2 3.21Å; I297-Y466 HydrophobicContact CD1-CE1 3.59Å; I297-Y466 WeakPolarHBondContact CD1-OH 3.44Å; I297-L470 HydrophobicContact CG2-CD1 3.4Å; I297-L470 VanDerWaalsContact CG2-CD1 3.4Å; I297-L470 HydrophobicContact CG2-CD2 3.83Å; I297-L470 HydrophobicContact CG2-CG 4.27Å
298Q95.1Very high92.6Very high0 Ų024.7 Ų24.70%015%0.147CC..Hα-helixtrans-59.1-46.6173.7-170.8173.727.200111.5G294 Y295 Y296 N301 S302 A366 E370 L398G294-Q298 WeakPolarHBondContact O-CB 3.46Å; G294-Q298 PolarHBondContact O-N 3.05Å; Y295-Q298 PolarHBondContact O-N 2.85Å; Y296-Q298 VanDerWaalsContact C-N 3.34Å; Q298-N301 CarbonylContact O-C 3.29Å; Q298-N301 PolarHBondContact O-N 3.21Å; Q298-S302 PolarHBondContact O-N 2.83Å; Q298-S302 PolarHBondContact O-OG 3.47Å; Q298-A366 PolarHBondContact NE2-O 3.19Å; Q298-E370 WeakPolarHBondContact CG-OE2 3.3Å; Q298-E370 PolarHBondContact NE2-OE2 2.92Å; Q298-L398 HydrophobicContact CG-CD1 4.15Å; Q298-L398 HydrophobicContact CG-CD2 3.77Å
299A94.9Very high92.1Very high0 Ų029 Ų290%017%0.17CC..Hα-helixtrans-65.9-39.717700000112.9Y295 Y296 N301 S302 I313 M316 L398Y295-A299 WeakPolarHBondContact O-CB 3.46Å; Y295-A299 PolarHBondContact O-N 3.37Å; Y296-A299 PolarHBondContact O-N 3.07Å; A299-N301 PolarHBondContact O-N 3.41Å; A299-S302 PolarHBondContact O-N 2.85Å; A299-S302 VanDerWaalsContact O-N 3.16Å; A299-I313 HydrophobicContact CB-CG2 4.07Å; A299-M316 HydrophobicContact CB-CG 3.99Å; A299-L398 HydrophobicContact CB-CD1 3.88Å
300M93.1Very high91.8Very high8 Ų829.9 Ų29.94%0.03917%0.174CC..Hα-helixtrans-60.2-29.3174.9-175.3179.176.800112.4L31 Y296 I297 I313 L383L31-M300 HydrophobicContact CD1-SD 4.21Å; Y296-M300 HydrophobicContact CE1-SD 4.38Å; Y296-M300 WeakPolarHBondContact O-CB 3.43Å; Y296-M300 PolarHBondContact O-N 3.29Å; I297-M300 PolarHBondContact O-N 2.97Å; M300-I313 HydrophobicContact CB-CD1 3.9Å; M300-I313 HydrophobicContact CB-CG1 4.43Å; M300-I313 HydrophobicContact CG-CD1 3.8Å; M300-L383 HydrophobicContact CG-CD1 3.99Å
301N93.8Very high91.6Very high22 Ų2231.1 Ų31.112%0.11818%0.18CC..THydrogen-bonded Turntrans-102.117.7179.2-70.8-91.1000113.5I297 Q298 A299 R373 S391 L470I297-N301 PolarHBondContact O-N 3.13Å; I297-N301 VanDerWaalsContact O-N 3.1Å; I297-N301 PolarHBondContact O-ND2 3.21Å; Q298-N301 CarbonylContact O-C 3.29Å; Q298-N301 PolarHBondContact O-N 3.21Å; A299-N301 PolarHBondContact O-N 3.41Å; N301-R373 PolarHBondContact O-NH1 3.32Å; N301-S391 PolarHBondContact O-N 3.36Å; N301-L470 HydrophobicContact CB-CB 4.17Å; N301-L470 HydrophobicContact CB-CD2 3.81Å
302S94.3Very high91.4Very high0 Ų030.9 Ų30.90%018%0.18CC..EExtended strand (participates in β ladder)trans-111.2164.5169.8-76.60000110.1Q298 A299 L304 R373 S391Q298-S302 PolarHBondContact O-N 2.83Å; Q298-S302 PolarHBondContact O-OG 3.47Å; A299-S302 PolarHBondContact O-N 2.85Å; A299-S302 VanDerWaalsContact O-N 3.16Å; S302-L304 PolarHBondContact O-N 2.91Å; S302-R373 VanDerWaalsContact OG-CD 3.31Å; S302-R373 WeakPolarHBondContact OG-CD 3.24Å; S302-S391 CarbonylContact C-O 3.5Å
303N93.9Very high91.3Very high36 Ų3630.1 Ų30.119%0.19318%0.175CC..EExtended strand (participates in β ladder)trans-69.9116.4176.8-174.51000110.4H305 S391 S392 M393 C395N303-H305 WeakPolarHBondContact OD1-CB 3.09Å; N303-H305 PolarHBondContact OD1-N 3.47Å; N303-S391 PolarHBondContact N-O 3Å; N303-S392 WeakPolarHBondContact CB-O 3.33Å; N303-S392 PolarHBondContact ND2-O 3.38Å; N303-M393 WeakPolarHBondContact CB-O 3.31Å; N303-M393 PolarHBondContact N-O 3.1Å; N303-C395 PolarHBondContact O-N 3.08Å
304L92.8Very high90.9Very high0 Ų030.2 Ų30.20%018%0.175CC..  trans-93.7-4.7179.3-64.2171.6000112.6S302 L306 L310 L311 I313 L383 C395S302-L304 PolarHBondContact O-N 2.91Å; L304-L306 PolarHBondContact O-N 3.18Å; L304-L310 HydrophobicContact CB-CD1 3.8Å; L304-L311 VanDerWaalsContact O-CB 3.31Å; L304-L311 WeakPolarHBondContact O-CB 3.12Å; L304-L311 PolarHBondContact O-N 3.26Å; L304-I313 HydrophobicContact CD1-CG1 3.67Å; L304-I313 HydrophobicContact CD2-CG1 4.44Å; L304-L383 HydrophobicContact CD1-CD1 4.24Å; L304-L383 HydrophobicContact CD1-CD2 3.9Å; L304-C395 HydrophobicContact CD2-CB 3.94Å
305H89.9Confident90.7Very high86 Ų8630.6 Ų30.640%0.39818%0.179SC..EExtended strand (participates in β ladder)trans-74122.3177-73.2-85.6000111.1N303N303-H305 WeakPolarHBondContact OD1-CB 3.09Å; N303-H305 PolarHBondContact OD1-N 3.47Å
306L85.4Confident90.5Very high76 Ų7630.6 Ų30.640%0.39818%0.179SC..EExtended strand (participates in β ladder)trans-122.9113.8170.5-175.578.7000108.9L304 G308 L309 F396L304-L306 PolarHBondContact O-N 3.18Å; L306-G308 PolarHBondContact O-N 3.02Å; L306-G308 VanDerWaalsContact O-N 3.11Å; L306-L309 PolarHBondContact N-O 3.49Å; L306-L309 PolarHBondContact O-N 3.46Å; L306-F396 HydrophobicContact CB-CE2 4.01Å; L306-F396 HydrophobicContact CD1-CD2 4.01Å; L306-F396 HydrophobicContact CD1-CE2 3.49Å; L306-F396 VanDerWaalsContact CD1-CE2 3.49Å; L306-F396 HydrophobicContact CD1-CZ 4.25Å; L306-F396 HydrophobicContact CD2-CE2 3.91Å; L306-F396 HydrophobicContact CD2-CZ 3.86Å; L306-F396 HydrophobicContact CG-CE2 3.98Å; L306-F396 HydrophobicContact CG-CZ 4.43Å
307N83.4Confident90.2Very high167 Ų16730.7 Ų30.789%0.89318%0.179SC*.THydrogen-bonded Turntrans49.638.5176.1-61.3-12.2000114.1
308G79.9Confident89.9Confident75 Ų7531.3 Ų31.377%0.77318%0.183SC*.THydrogen-bonded Turntrans88.6-7.9-178.700000115.4L306L306-G308 PolarHBondContact O-N 3.02Å; L306-G308 VanDerWaalsContact O-N 3.11Å
309L85.2Confident89.7Confident100 Ų10032.6 Ų32.652%0.52419%0.19SC..EExtended strand (participates in β ladder)trans-102.1133177.3-159.5137.9000111Y178 L306 L311Y178-L309 HydrophobicContact CE2-CD2 4.41Å; L306-L309 PolarHBondContact N-O 3.49Å; L306-L309 PolarHBondContact O-N 3.46Å; L309-L311 PolarHBondContact O-N 2.67Å
310L88.1Confident89.3Confident25 Ų2533.2 Ų33.213%0.13119%0.194CC..EExtended strand (participates in β ladder)trans-82.5109.9176.7-175.173000109.8Y178 L304 Q381 L383Y178-L310 WeakPolarHBondContact CE2-O 3.31Å; L304-L310 HydrophobicContact CB-CD1 3.8Å; L310-Q381 HydrophobicContact CD1-CG 4.15Å; L310-L383 HydrophobicContact CD2-CD2 4.27Å
311L90.9Very high89Confident26 Ų2633.6 Ų33.614%0.13620%0.196CC..  trans-69.7137.2178.7-155.685.5000110.4Q181 L304 L309 A315 F396Q181-L311 PolarHBondContact NE2-O 2.96Å; L304-L311 VanDerWaalsContact O-CB 3.31Å; L304-L311 WeakPolarHBondContact O-CB 3.12Å; L304-L311 PolarHBondContact O-N 3.26Å; L309-L311 PolarHBondContact O-N 2.67Å; L311-A315 HydrophobicContact CD1-CB 4.2Å; L311-A315 HydrophobicContact CD2-CB 3.5Å; L311-A315 VanDerWaalsContact CD2-CB 3.5Å; L311-A315 HydrophobicContact CG-CB 3.62Å; L311-F396 HydrophobicContact CD1-CZ 4.05Å; L311-F396 HydrophobicContact CD2-CE1 4.21Å; L311-F396 HydrophobicContact CD2-CE2 4.33Å; L311-F396 HydrophobicContact CD2-CZ 3.72Å; L311-F396 HydrophobicContact CG-CZ 4.5Å
312P90.7Very high88.6Confident8 Ų836.6 Ų36.65%0.05221%0.212CC..  trans-67143.2169.628.2-33.6000110.3A177 Q181 G314 A315A177-P312 HydrophobicContact CB-CB 3.92Å; Q181-P312 VanDerWaalsContact OE1-CA 3.3Å; P312-G314 PolarHBondContact O-N 3.47Å; P312-G314 VanDerWaalsContact O-N 3.15Å; P312-A315 HydrophobicContact CG-CB 4.03Å; P312-A315 VanDerWaalsContact O-CB 3.22Å; P312-A315 WeakPolarHBondContact O-CB 3.22Å; P312-A315 PolarHBondContact O-N 2.84Å
313I90.8Very high88.1Confident0 Ų037.3 Ų37.30%022%0.216CC..THydrogen-bonded Turntrans-56.1-35.5175.2-58.3154.4000110.1L31 Y296 A299 M300 L304 A315 M316 L383L31-I313 HydrophobicContact CD1-CD1 4.28Å; Y296-I313 HydrophobicContact CD1-CG2 4.12Å; Y296-I313 HydrophobicContact CD2-CG2 3.62Å; Y296-I313 HydrophobicContact CE1-CD1 4.04Å; Y296-I313 HydrophobicContact CE1-CG2 3.9Å; Y296-I313 HydrophobicContact CE2-CB 3.95Å; Y296-I313 HydrophobicContact CE2-CG2 3.39Å; Y296-I313 HydrophobicContact CG-CG2 3.98Å; Y296-I313 WeakPolarHBondContact OH-CD1 3.42Å; A299-I313 HydrophobicContact CB-CG2 4.07Å; M300-I313 HydrophobicContact CB-CD1 3.9Å; M300-I313 HydrophobicContact CB-CG1 4.43Å; M300-I313 HydrophobicContact CG-CD1 3.8Å; L304-I313 HydrophobicContact CD1-CG1 3.67Å; L304-I313 HydrophobicContact CD2-CG1 4.44Å; I313-A315 PolarHBondContact O-N 3.26Å; I313-M316 WeakPolarHBondContact O-CB 3.45Å; I313-M316 PolarHBondContact O-N 2.89Å; I313-M316 VanDerWaalsContact O-N 3.1Å; I313-L383 HydrophobicContact CD1-CD1 4.36Å
314G87.1Confident87.2Confident1 Ų137 Ų371%0.0122%0.215CC..Hα-helixtrans-56.3-26.8174.300000114.7F173 P312 M316 N317F173-G314 WeakPolarHBondContact CB-O 3.43Å; F173-G314 CarbonylContact O-C 3.56Å; F173-G314 VanDerWaalsContact O-C 3.23Å; F173-G314 WeakPolarHBondContact O-CA 3.45Å; P312-G314 PolarHBondContact O-N 3.47Å; P312-G314 VanDerWaalsContact O-N 3.15Å; G314-M316 PolarHBondContact O-N 3.32Å; G314-M316 VanDerWaalsContact O-N 3.17Å; G314-N317 VanDerWaalsContact O-CB 3.3Å; G314-N317 WeakPolarHBondContact O-CB 3.3Å; G314-N317 PolarHBondContact O-N 3.04Å
315A90Very high86.5Confident9 Ų937.8 Ų37.87%0.07422%0.219CC..Hα-helixtrans-59.3-29.9176.500000112.4F173 L174 L311 P312 I313 N317 V318F173-A315 PolarHBondContact O-N 3.37Å; L174-A315 HydrophobicContact CD2-CB 3.69Å; L311-A315 HydrophobicContact CD1-CB 4.2Å; L311-A315 HydrophobicContact CD2-CB 3.5Å; L311-A315 VanDerWaalsContact CD2-CB 3.5Å; L311-A315 HydrophobicContact CG-CB 3.62Å; P312-A315 HydrophobicContact CG-CB 4.03Å; P312-A315 VanDerWaalsContact O-CB 3.22Å; P312-A315 WeakPolarHBondContact O-CB 3.22Å; P312-A315 PolarHBondContact O-N 2.84Å; I313-A315 PolarHBondContact O-N 3.26Å; A315-N317 VanDerWaalsContact C-N 3.27Å; A315-N317 PolarHBondContact O-N 3.33Å; A315-V318 VanDerWaalsContact O-CB 3.31Å; A315-V318 WeakPolarHBondContact O-CB 3.33Å; A315-V318 PolarHBondContact O-N 3.18Å; A315-V318 VanDerWaalsContact O-N 3.16Å
316M91Very high86.1Confident0 Ų039 Ų390%023%0.228CC..Hα-helixtrans-64-33.7174.8-60.5-54.9-61.400111.8A299 I313 G314 V318 I319 C395 L398 Y402A299-M316 HydrophobicContact CB-CG 3.99Å; I313-M316 WeakPolarHBondContact O-CB 3.45Å; I313-M316 PolarHBondContact O-N 2.89Å; I313-M316 VanDerWaalsContact O-N 3.1Å; G314-M316 PolarHBondContact O-N 3.32Å; G314-M316 VanDerWaalsContact O-N 3.17Å; M316-V318 VanDerWaalsContact C-N 3.28Å; M316-V318 PolarHBondContact O-N 3.03Å; M316-I319 HydrophobicContact CE-CD1 3.89Å; M316-I319 WeakPolarHBondContact O-CB 3.3Å; M316-I319 PolarHBondContact O-N 3.44Å; M316-I319 HydrophobicContact SD-CD1 4.01Å; M316-C395 WeakPolarHBondContact CE-O 3.38Å; M316-C395 HydrophobicContact SD-CB 4.13Å; M316-L398 HydrophobicContact CE-CB 3.85Å; M316-Y402 HydrophobicContact CB-CD1 4.4Å; M316-Y402 HydrophobicContact CB-CE1 3.81Å; M316-Y402 HydrophobicContact CB-CE2 4.11Å; M316-Y402 HydrophobicContact CE-CD2 4.14Å; M316-Y402 HydrophobicContact CE-CE2 4.09Å; M316-Y402 WeakPolarHBondContact O-CD1 3.34Å; M316-Y402 WeakPolarHBondContact O-CE1 3.5Å
317N89Confident85.7Confident4 Ų436.9 Ų36.92%0.02122%0.216CC..Hα-helixtrans-66.1-32176-62.6-13.8000111.9F173 I291 G314 A315 I319 S320 I321F173-N317 HydrophobicContact CD1-CB 3.91Å; F173-N317 WeakPolarHBondContact CD1-ND2 3.48Å; F173-N317 HydrophobicContact CD2-CB 4.06Å; F173-N317 HydrophobicContact CE1-CB 3.98Å; F173-N317 WeakPolarHBondContact CE1-ND2 3.08Å; F173-N317 HydrophobicContact CE2-CB 4.15Å; F173-N317 HydrophobicContact CG-CB 3.97Å; F173-N317 HydrophobicContact CZ-CB 4.12Å; I291-N317 HydrophobicContact CG2-CB 4.4Å; I291-N317 VanDerWaalsContact CG2-OD1 3.24Å; I291-N317 WeakPolarHBondContact CG2-OD1 3.4Å; G314-N317 VanDerWaalsContact O-CB 3.3Å; G314-N317 WeakPolarHBondContact O-CB 3.3Å; G314-N317 PolarHBondContact O-N 3.04Å; A315-N317 VanDerWaalsContact C-N 3.27Å; A315-N317 PolarHBondContact O-N 3.33Å; N317-I319 VanDerWaalsContact C-N 3.25Å; N317-I319 PolarHBondContact O-N 3.02Å; N317-S320 PolarHBondContact O-N 3.25Å; N317-S320 VanDerWaalsContact O-N 3.08Å; N317-S320 PolarHBondContact O-OG 2.92Å; N317-I321 PolarHBondContact O-N 3.39Å
318V89.5Confident85Confident14 Ų1431 Ų319%0.08519%0.191CC..Hα-helixtrans-61.9-37.2177.3-178.70000111.1T170 F173 L174 A315 M316 S320 I321 L322T170-V318 HydrophobicContact CG2-CG1 3.82Å; T170-V318 HydrophobicContact CG2-CG2 4.38Å; F173-V318 HydrophobicContact CB-CG2 3.7Å; L174-V318 HydrophobicContact CD1-CG2 4.42Å; L174-V318 HydrophobicContact CD2-CG2 3.89Å; L174-V318 HydrophobicContact CG-CG2 3.78Å; A315-V318 VanDerWaalsContact O-CB 3.31Å; A315-V318 WeakPolarHBondContact O-CB 3.33Å; A315-V318 PolarHBondContact O-N 3.18Å; A315-V318 VanDerWaalsContact O-N 3.16Å; M316-V318 VanDerWaalsContact C-N 3.28Å; M316-V318 PolarHBondContact O-N 3.03Å; V318-S320 PolarHBondContact O-N 3.2Å; V318-I321 WeakPolarHBondContact O-CB 3.49Å; V318-I321 PolarHBondContact O-N 2.82Å; V318-L322 PolarHBondContact O-N 3.24Å
319I90.6Very high84.4Confident28 Ų2830.4 Ų30.414%0.14417%0.173CC..Hα-helixtrans-58.4-34176.8-61.4176.6000111.1M316 N317 P323 A399 I403M316-I319 HydrophobicContact CE-CD1 3.89Å; M316-I319 WeakPolarHBondContact O-CB 3.3Å; M316-I319 PolarHBondContact O-N 3.44Å; M316-I319 HydrophobicContact SD-CD1 4.01Å; N317-I319 VanDerWaalsContact C-N 3.25Å; N317-I319 PolarHBondContact O-N 3.02Å; I319-P323 WeakPolarHBondContact O-CD 3.48Å; I319-A399 HydrophobicContact CD1-CB 4.01Å; I319-A399 HydrophobicContact CG2-CB 4.18Å; I319-I403 HydrophobicContact CG2-CD1 4.13Å; I319-I403 HydrophobicContact CG2-CG1 3.47Å; I319-I403 VanDerWaalsContact CG2-CG1 3.47Å
320S86.9Confident83.8Confident12 Ų1230 Ų308%0.08417%0.172CC..Hα-helixtrans-76.7-24.2175.474.70000113.9N317 V318 Y402 G406N317-S320 PolarHBondContact O-N 3.25Å; N317-S320 VanDerWaalsContact O-N 3.08Å; N317-S320 PolarHBondContact O-OG 2.92Å; V318-S320 PolarHBondContact O-N 3.2Å; S320-Y402 WeakPolarHBondContact CB-O 3.3Å; S320-G406 WeakPolarHBondContact O-CA 3.41Å
321I84.9Confident82.8Confident16 Ų1631.9 Ų31.98%0.08218%0.181CC..Hα-helixtrans-79.5-31.9178.4-65.4161.9000111.2N166 S169 F173 N317 V318 L324 L325N166-I321 HydrophobicContact CB-CG2 4.37Å; S169-I321 WeakPolarHBondContact OG-CD1 3.23Å; F173-I321 HydrophobicContact CD2-CD1 3.6Å; F173-I321 HydrophobicContact CE2-CD1 3.7Å; N317-I321 PolarHBondContact O-N 3.39Å; V318-I321 WeakPolarHBondContact O-CB 3.49Å; V318-I321 PolarHBondContact O-N 2.82Å; I321-L324 WeakPolarHBondContact O-CA 3.45Å; I321-L324 VanDerWaalsContact O-CB 3.3Å; I321-L324 WeakPolarHBondContact O-CB 3.37Å; I321-L324 PolarHBondContact O-N 3.31Å; I321-L325 HydrophobicContact CG2-CD1 3.95Å; I321-L325 HydrophobicContact CG2-CG 4.14Å; I321-L325 PolarHBondContact O-N 2.92Å
322L85.9Confident81.6Confident86 Ų8632.7 Ų32.745%0.4518%0.183SC..Hα-helixtrans-57-49.3-178.6-73.2173.8000113.1V318 L324 L325 L326V318-L322 PolarHBondContact O-N 3.24Å; L322-L324 PolarHBondContact O-N 3.24Å; L322-L325 PolarHBondContact O-N 2.72Å; L322-L326 WeakPolarHBondContact O-CB 3.4Å; L322-L326 VanDerWaalsContact O-CG 3.29Å; L322-L326 WeakPolarHBondContact O-CG 3.3Å; L322-L326 PolarHBondContact O-N 3.26Å
323P83.9Confident80.5Confident15 Ų1538.8 Ų38.810%0.09721%0.209CC..Hα-helixtrans-57.9-37173.2-25.733.7000113.2I319 L325 L326 L327 I403 V407I319-P323 WeakPolarHBondContact O-CD 3.48Å; P323-L325 VanDerWaalsContact C-N 3.33Å; P323-L325 PolarHBondContact O-N 3.05Å; P323-L326 PolarHBondContact O-N 3.3Å; P323-L327 WeakPolarHBondContact O-CA 3.46Å; P323-L327 WeakPolarHBondContact O-CB 3.33Å; P323-L327 PolarHBondContact O-N 3.05Å; P323-I403 HydrophobicContact CG-CB 4.47Å; P323-I403 HydrophobicContact CG-CG2 4Å; P323-V407 HydrophobicContact CB-CG2 3.66Å; P323-V407 HydrophobicContact CG-CG2 4.19Å
324L75.4Confident79.4Confident29 Ų2941.2 Ų41.215%0.15222%0.224CC..Hα-helixtrans-62.8-41.4177.8-178.765.8000111.9Y162 I321 L322 A410Y162-L324 VanDerWaalsContact OH-CD1 3.25Å; Y162-L324 WeakPolarHBondContact OH-CD1 3.45Å; Y162-L324 VanDerWaalsContact OH-CG 3.24Å; Y162-L324 WeakPolarHBondContact OH-CG 3.19Å; I321-L324 WeakPolarHBondContact O-CA 3.45Å; I321-L324 VanDerWaalsContact O-CB 3.3Å; I321-L324 WeakPolarHBondContact O-CB 3.37Å; I321-L324 PolarHBondContact O-N 3.31Å; L322-L324 PolarHBondContact O-N 3.24Å; L324-A410 HydrophobicContact CB-CB 4.39Å; L324-A410 VanDerWaalsContact CD1-CA 3.48Å; L324-A410 HydrophobicContact CD1-CB 3.62Å
325L77.8Confident78.4Confident16 Ų1643.2 Ų43.28%0.08424%0.236CC..Hα-helixtrans-71-39.7176.9-75.1175.9000113.3W163 N166 I321 L322 P323 P329W163-L325 HydrophobicContact CD2-CD2 4.2Å; W163-L325 HydrophobicContact CE3-CD2 3.64Å; W163-L325 HydrophobicContact CH2-CB 4.13Å; W163-L325 HydrophobicContact CH2-CD2 4.17Å; W163-L325 HydrophobicContact CZ3-CB 4.15Å; W163-L325 HydrophobicContact CZ3-CD1 4.19Å; W163-L325 HydrophobicContact CZ3-CD2 3.63Å; W163-L325 HydrophobicContact CZ3-CG 4.21Å; N166-L325 HydrophobicContact CB-CD1 4.21Å; N166-L325 HydrophobicContact CB-CD2 3.33Å; N166-L325 HydrophobicContact CB-CG 3.96Å; I321-L325 HydrophobicContact CG2-CD1 3.95Å; I321-L325 HydrophobicContact CG2-CG 4.14Å; I321-L325 PolarHBondContact O-N 2.92Å; L322-L325 PolarHBondContact O-N 2.72Å; P323-L325 VanDerWaalsContact C-N 3.33Å; P323-L325 PolarHBondContact O-N 3.05Å; L325-P329 WeakPolarHBondContact O-CD 3.41Å
326L81.8Confident77.4Confident113 Ų11344.5 Ų44.559%0.59224%0.243SC*.Hα-helixtrans-82.9-36.4-176-65.7173.6000112.6L322 P323 P329 L330L322-L326 WeakPolarHBondContact O-CB 3.4Å; L322-L326 VanDerWaalsContact O-CG 3.29Å; L322-L326 WeakPolarHBondContact O-CG 3.3Å; L322-L326 PolarHBondContact O-N 3.26Å; P323-L326 PolarHBondContact O-N 3.3Å; L326-P329 VanDerWaalsContact O-CD 3.27Å; L326-P329 WeakPolarHBondContact O-CD 3.44Å; L326-P329 VanDerWaalsContact O-CG 3.3Å; L326-P329 WeakPolarHBondContact O-CG 3.33Å; L326-L330 WeakPolarHBondContact O-CB 3.43Å; L326-L330 PolarHBondContact O-N 3.49Å
327L76Confident76.4Confident30 Ų3050.6 Ų50.616%0.15727%0.267CS..Hα-helixtrans-77.2-26.2-174.9-165.160.5000111.8P323 L330 M331 V407 A410 L411P323-L327 WeakPolarHBondContact O-CA 3.46Å; P323-L327 WeakPolarHBondContact O-CB 3.33Å; P323-L327 PolarHBondContact O-N 3.05Å; L327-L330 HydrophobicContact CD1-CB 4.48Å; L327-L330 HydrophobicContact CD1-CD2 3.92Å; L327-L330 PolarHBondContact O-N 3.44Å; L327-M331 HydrophobicContact CD1-CG 3.95Å; L327-M331 HydrophobicContact CD1-SD 4.34Å; L327-M331 HydrophobicContact CG-CG 3.78Å; L327-M331 VanDerWaalsContact O-CB 3.22Å; L327-M331 WeakPolarHBondContact O-CB 3.45Å; L327-M331 WeakPolarHBondContact O-CG 3.43Å; L327-M331 PolarHBondContact O-N 3.43Å; L327-V407 HydrophobicContact CD2-CG1 3.97Å; L327-A410 HydrophobicContact CB-CB 4.22Å; L327-A410 HydrophobicContact CD2-CB 3.9Å; L327-L411 HydrophobicContact CD2-CD2 3.71Å; L327-L411 HydrophobicContact CD2-CG 3.88Å; L327-L411 HydrophobicContact CG-CD2 4.45Å
328A68.7Low75.4Confident45 Ų4554.3 Ų54.337%0.37228%0.283SS..Hα-helixtrans-57.6-57.7173.700000112.9L330 M331 E332A328-L330 VanDerWaalsContact C-N 3.33Å; A328-L330 PolarHBondContact O-N 2.9Å; A328-M331 PolarHBondContact O-N 2.7Å; A328-E332 PolarHBondContact O-N 2.89Å
329P68.5Low74.4Confident61 Ų6158 Ų5840%0.39630%0.302SS..Hα-helixtrans-67.4-32.6176.526.8-34.2000112.4L325 L326 E332 F333L325-P329 WeakPolarHBondContact O-CD 3.41Å; L326-P329 VanDerWaalsContact O-CD 3.27Å; L326-P329 WeakPolarHBondContact O-CD 3.44Å; L326-P329 VanDerWaalsContact O-CG 3.3Å; L326-P329 WeakPolarHBondContact O-CG 3.33Å; P329-E332 PolarHBondContact O-N 2.92Å; P329-F333 PolarHBondContact O-N 3.1Å
330L72.9Confident73.5Confident93 Ų9361.7 Ų61.749%0.48733%0.33SS..Hα-helixtrans-66.6-43.4177.9-171.6148.3000112.1L326 L327 A328 E332 F333 V334L326-L330 WeakPolarHBondContact O-CB 3.43Å; L326-L330 PolarHBondContact O-N 3.49Å; L327-L330 HydrophobicContact CD1-CB 4.48Å; L327-L330 HydrophobicContact CD1-CD2 3.92Å; L327-L330 PolarHBondContact O-N 3.44Å; A328-L330 VanDerWaalsContact C-N 3.33Å; A328-L330 PolarHBondContact O-N 2.9Å; L330-E332 VanDerWaalsContact C-N 3.27Å; L330-E332 PolarHBondContact O-N 3.29Å; L330-F333 PolarHBondContact O-N 2.86Å; L330-V334 HydrophobicContact CD2-CG2 3.78Å; L330-V334 HydrophobicContact CG-CG2 4.47Å; L330-V334 WeakPolarHBondContact O-CB 3.25Å; L330-V334 VanDerWaalsContact O-CG2 3.28Å; L330-V334 WeakPolarHBondContact O-CG2 3.4Å; L330-V334 PolarHBondContact O-N 3.48Å
331M67Low72.7Confident64 Ų6465.6 Ų65.632%0.31535%0.348SS..Hα-helixtrans-65.6-33.4177.6-75-65.3-62.500111.7L327 A328 T335 L411L327-M331 HydrophobicContact CD1-CG 3.95Å; L327-M331 HydrophobicContact CD1-SD 4.34Å; L327-M331 HydrophobicContact CG-CG 3.78Å; L327-M331 VanDerWaalsContact O-CB 3.22Å; L327-M331 WeakPolarHBondContact O-CB 3.45Å; L327-M331 WeakPolarHBondContact O-CG 3.43Å; L327-M331 PolarHBondContact O-N 3.43Å; A328-M331 PolarHBondContact O-N 2.7Å; M331-T335 VanDerWaalsContact O-CB 3.26Å; M331-T335 WeakPolarHBondContact O-CB 3.35Å; M331-T335 PolarHBondContact O-N 3.37Å; M331-T335 PolarHBondContact O-OG1 3.41Å; M331-L411 HydrophobicContact CE-CD2 4.18Å; M331-L411 HydrophobicContact CG-CD2 4.35Å; M331-L411 HydrophobicContact SD-CD2 4.05Å
332E65.1Low72.1Confident42 Ų4273.8 Ų73.820%0.19639%0.386CS..Hα-helixtrans-63.4-51.2171.6176.3160.5-153.600110.9A328 P329 L330 V334 T335 T336 L526A328-E332 PolarHBondContact O-N 2.89Å; P329-E332 PolarHBondContact O-N 2.92Å; L330-E332 VanDerWaalsContact C-N 3.27Å; L330-E332 PolarHBondContact O-N 3.29Å; E332-V334 PolarHBondContact O-N 3.24Å; E332-T335 PolarHBondContact O-N 2.85Å; E332-T335 VanDerWaalsContact O-N 3.15Å; E332-T336 PolarHBondContact O-N 3.19Å; E332-T336 PolarHBondContact O-OG1 3.34Å; E332-L526 HydrophobicContact CB-CD2 3.98Å; E332-L526 HydrophobicContact CG-CD2 3.76Å; E332-L526 WeakPolarHBondContact OE1-CA 3.44Å
333F67.7Low71Confident136 Ų13675.2 Ų75.260%0.59639%0.389SS*.Hα-helixtrans-58.9-44.8176.4178.9-97.6000113.2P329 L330 T335 T336 Y337P329-F333 PolarHBondContact O-N 3.1Å; L330-F333 PolarHBondContact O-N 2.86Å; F333-T335 VanDerWaalsContact C-N 3.32Å; F333-T335 PolarHBondContact O-N 3.03Å; F333-T336 PolarHBondContact O-N 3.04Å; F333-T336 PolarHBondContact O-OG1 3.42Å; F333-Y337 VanDerWaalsContact O-CB 3.23Å; F333-Y337 WeakPolarHBondContact O-CB 3.24Å; F333-Y337 PolarHBondContact O-N 3.03Å
334V68.1Low70.1Confident51 Ų5180.5 Ų80.531%0.30942%0.421SS..Hα-helixtrans-63.4-41.6176.7171.10000110.1L330 E332 Y337 F338L330-V334 HydrophobicContact CD2-CG2 3.78Å; L330-V334 HydrophobicContact CG-CG2 4.47Å; L330-V334 WeakPolarHBondContact O-CB 3.25Å; L330-V334 VanDerWaalsContact O-CG2 3.28Å; L330-V334 WeakPolarHBondContact O-CG2 3.4Å; L330-V334 PolarHBondContact O-N 3.48Å; E332-V334 PolarHBondContact O-N 3.24Å; V334-Y337 PolarHBondContact O-N 2.84Å; V334-F338 HydrophobicContact CG1-CD2 3.72Å; V334-F338 HydrophobicContact CG1-CE2 3.67Å; V334-F338 WeakPolarHBondContact O-CD2 3.3Å; V334-F338 PolarHBondContact O-N 3.08Å
335T65.6Low69.7Low43 Ų4381.9 Ų81.926%0.26443%0.431SS..Hα-helixtrans-66.3-43.8-179.8-59.10000112M331 E332 F333 F338 L339 P345M331-T335 VanDerWaalsContact O-CB 3.26Å; M331-T335 WeakPolarHBondContact O-CB 3.35Å; M331-T335 PolarHBondContact O-N 3.37Å; M331-T335 PolarHBondContact O-OG1 3.41Å; E332-T335 PolarHBondContact O-N 2.85Å; E332-T335 VanDerWaalsContact O-N 3.15Å; F333-T335 VanDerWaalsContact C-N 3.32Å; F333-T335 PolarHBondContact O-N 3.03Å; T335-F338 PolarHBondContact O-N 3.42Å; T335-L339 HydrophobicContact CG2-CD1 4.17Å; T335-L339 VanDerWaalsContact O-CG 3.27Å; T335-L339 WeakPolarHBondContact O-CG 3.48Å; T335-L339 PolarHBondContact O-N 2.92Å; T335-P345 HydrophobicContact CG2-CB 4.07Å
336T68.6Low69.5Low36 Ų3685.9 Ų85.922%0.22145%0.452CS..Hα-helixtrans-64.6-42.2176.453.80000111.2E332 F333 F338 L339 S340E332-T336 PolarHBondContact O-N 3.19Å; E332-T336 PolarHBondContact O-OG1 3.34Å; F333-T336 PolarHBondContact O-N 3.04Å; F333-T336 PolarHBondContact O-OG1 3.42Å; T336-F338 PolarHBondContact O-N 3.25Å; T336-L339 PolarHBondContact O-N 3.09Å; T336-S340 WeakPolarHBondContact O-CB 3.5Å; T336-S340 PolarHBondContact O-N 3.37Å
337Y71Confident69.5Low128 Ų12881.4 Ų81.450%0.50243%0.432SS..Hα-helixtrans-59.1-47.6174.6-178.8-98.3000112.5F333 V334 L339 S340 M341F333-Y337 VanDerWaalsContact O-CB 3.23Å; F333-Y337 WeakPolarHBondContact O-CB 3.24Å; F333-Y337 PolarHBondContact O-N 3.03Å; V334-Y337 PolarHBondContact O-N 2.84Å; Y337-L339 VanDerWaalsContact C-N 3.32Å; Y337-L339 PolarHBondContact O-N 3.5Å; Y337-S340 WeakPolarHBondContact O-CB 3.28Å; Y337-S340 PolarHBondContact O-N 3.18Å; Y337-M341 HydrophobicContact CD1-CG 4.41Å; Y337-M341 HydrophobicContact CE1-CG 4.03Å; Y337-M341 HydrophobicContact CE1-SD 3.69Å; Y337-M341 WeakPolarHBondContact O-CG 3.44Å; Y337-M341 PolarHBondContact O-N 2.95Å; Y337-M341 PolarHBondContact OH-SD 3.04Å
338F66.8Low69.8Low82 Ų8281.2 Ų81.236%0.3643%0.433SS..Hα-helixtrans-61.7-40.3177.2-91.1-107.6000112.2V334 T335 T336 M341 E342 K343V334-F338 HydrophobicContact CG1-CD2 3.72Å; V334-F338 HydrophobicContact CG1-CE2 3.67Å; V334-F338 WeakPolarHBondContact O-CD2 3.3Å; V334-F338 PolarHBondContact O-N 3.08Å; T335-F338 PolarHBondContact O-N 3.42Å; T336-F338 PolarHBondContact O-N 3.25Å; F338-M341 CarbonylContact O-C 3.51Å; F338-M341 PolarHBondContact O-N 3.41Å; F338-E342 PolarHBondContact O-N 3.47Å; F338-K343 HydrophobicContact CB-CB 4.42Å; F338-K343 HydrophobicContact CD1-CB 3.72Å; F338-K343 HydrophobicContact CD1-CD 4.21Å; F338-K343 HydrophobicContact CE1-CB 4.5Å; F338-K343 HydrophobicContact CE1-CD 4.32Å; F338-K343 HydrophobicContact CG-CB 4.46Å; F338-K343 PolarHBondContact O-N 3.28Å
339L70.3Confident70.7Confident93 Ų9379.3 Ų79.349%0.48742%0.417SS..Hα-helixtrans-65.2-39175.3-71.8169.3000112T335 T336 Y337 M341 E342 P345T335-L339 HydrophobicContact CG2-CD1 4.17Å; T335-L339 VanDerWaalsContact O-CG 3.27Å; T335-L339 WeakPolarHBondContact O-CG 3.48Å; T335-L339 PolarHBondContact O-N 2.92Å; T336-L339 PolarHBondContact O-N 3.09Å; Y337-L339 VanDerWaalsContact C-N 3.32Å; Y337-L339 PolarHBondContact O-N 3.5Å; L339-M341 PolarHBondContact O-N 2.86Å; L339-E342 PolarHBondContact O-N 3.47Å; L339-P345 HydrophobicContact CD2-CG 4.47Å
340S70.8Confident71.7Confident104 Ų10482.7 Ų82.773%0.72742%0.421SS*.Hα-helixtrans-64.6-26173.6-174.60000112.5T336 Y337 E342T336-S340 WeakPolarHBondContact O-CB 3.5Å; T336-S340 PolarHBondContact O-N 3.37Å; Y337-S340 WeakPolarHBondContact O-CB 3.28Å; Y337-S340 PolarHBondContact O-N 3.18Å; S340-E342 VanDerWaalsContact C-N 3.31Å
341M69.9Low72.5Confident94 Ų9478.8 Ų78.846%0.46340%0.401SS..THydrogen-bonded Turntrans-9011.9173.5-61.7-142.188.800113.5Y337 F338 L339 K343Y337-M341 HydrophobicContact CD1-CG 4.41Å; Y337-M341 HydrophobicContact CE1-CG 4.03Å; Y337-M341 HydrophobicContact CE1-SD 3.69Å; Y337-M341 WeakPolarHBondContact O-CG 3.44Å; Y337-M341 PolarHBondContact O-N 2.95Å; Y337-M341 PolarHBondContact OH-SD 3.04Å; F338-M341 CarbonylContact O-C 3.51Å; F338-M341 PolarHBondContact O-N 3.41Å; L339-M341 PolarHBondContact O-N 2.86Å; M341-K343 HydrophobicContact CB-CD 4.34Å; M341-K343 HydrophobicContact CB-CG 4.25Å; M341-K343 PolarHBondContact O-N 3.34Å
342E71.4Confident73.7Confident188 Ų18875.7 Ų75.788%0.87939%0.386SS*.THydrogen-bonded Turntrans54.617.7-173.5-58.5-172159.900114.5F338 L339 S340F338-E342 PolarHBondContact O-N 3.47Å; L339-E342 PolarHBondContact O-N 3.47Å; S340-E342 VanDerWaalsContact C-N 3.31Å
343K63.8Low75.1Confident116 Ų11674.1 Ų74.150%0.50438%0.379SS..PPolyproline II helixtrans-86.2143.2177-69.4178.9-178.5172.50109.9F338 M341F338-K343 HydrophobicContact CB-CB 4.42Å; F338-K343 HydrophobicContact CD1-CB 3.72Å; F338-K343 HydrophobicContact CD1-CD 4.21Å; F338-K343 HydrophobicContact CE1-CB 4.5Å; F338-K343 HydrophobicContact CE1-CD 4.32Å; F338-K343 HydrophobicContact CG-CB 4.46Å; F338-K343 PolarHBondContact O-N 3.28Å; M341-K343 HydrophobicContact CB-CD 4.34Å; M341-K343 HydrophobicContact CB-CG 4.25Å; M341-K343 PolarHBondContact O-N 3.34Å
344T64.5Low76.3Confident126 Ų12672 Ų7277%0.77337%0.374SS*.PPolyproline II helixtrans-71.2128.1174.951.50000109.9
345P68.1Low77.6Confident58 Ų5869.5 Ų69.538%0.37736%0.359SS..PPolyproline II helixtrans-64.9156.217628.1-34.5000110.3T335 L339 A347T335-P345 HydrophobicContact CG2-CB 4.07Å; L339-P345 HydrophobicContact CD2-CG 4.47Å; P345-A347 PolarHBondContact O-N 2.95Å
346L73.3Confident79.2Confident100 Ų10067.5 Ų67.552%0.52435%0.346SS..PPolyproline II helixtrans-59.9128.5-177.1-148.477.6000110.4R350 V351L346-R350 HydrophobicContact CD2-CB 4.11Å; L346-R350 HydrophobicContact CG-CB 4.1Å; L346-V351 HydrophobicContact CB-CG2 4.12Å; L346-V351 HydrophobicContact CD2-CG2 3.91Å; L346-V351 HydrophobicContact CG-CG2 4.41Å
347A81.7Confident80.5Confident20 Ų2067.5 Ų67.517%0.16535%0.35CS..PPolyproline II helixtrans-57.3136.3-179.900000110.5P345 A349 R350 V351 M501P345-A347 PolarHBondContact O-N 2.95Å; A347-A349 PolarHBondContact O-N 2.82Å; A347-R350 HydrophobicContact CB-CG 4.31Å; A347-R350 WeakPolarHBondContact O-CA 3.34Å; A347-R350 WeakPolarHBondContact O-CB 3.48Å; A347-R350 PolarHBondContact O-N 2.92Å; A347-V351 PolarHBondContact O-N 3.14Å; A347-M501 HydrophobicContact CB-CG 4.27Å; A347-M501 HydrophobicContact CB-SD 4.25Å
348P82.4Confident81.8Confident26 Ų2662.3 Ų62.317%0.16933%0.333CS..Hα-helixtrans-54.6-32.9-177.4-28.835.6000113.5R350 V351 I352 L418 I419P348-R350 PolarHBondContact O-N 3.29Å; P348-V351 WeakPolarHBondContact O-CB 3.46Å; P348-V351 PolarHBondContact O-N 3.02Å; P348-I352 WeakPolarHBondContact O-CG1 3.25Å; P348-I352 PolarHBondContact O-N 3.19Å; P348-L418 HydrophobicContact CB-CD2 4.31Å; P348-L418 HydrophobicContact CG-CD2 3.7Å; P348-L418 HydrophobicContact CG-CG 4.43Å; P348-I419 HydrophobicContact CB-CD1 4.13Å; P348-I419 HydrophobicContact CB-CG1 3.84Å
349A88.1Confident83.3Confident4 Ų458.4 Ų58.43%0.03332%0.315CS..Hα-helixtrans-64.7-37175.200000112.5A347 I352 T353 I419 F493A347-A349 PolarHBondContact O-N 2.82Å; A349-I352 PolarHBondContact O-N 3.43Å; A349-T353 PolarHBondContact O-N 3.26Å; A349-T353 VanDerWaalsContact O-N 3.17Å; A349-T353 PolarHBondContact O-OG1 3.31Å; A349-T353 VanDerWaalsContact O-OG1 3.07Å; A349-I419 HydrophobicContact CB-CD1 4.27Å; A349-F493 VanDerWaalsContact O-CE1 3.32Å; A349-F493 WeakPolarHBondContact O-CE1 3.4Å
350R88.9Confident84.6Confident132 Ų13254.4 Ų54.450%0.49830%0.296SS..Hα-helixtrans-69.2-36.9174.9-65.6-177.3-174-179.31.6111.7L346 A347 P348 I352 T353 L354L346-R350 HydrophobicContact CD2-CB 4.11Å; L346-R350 HydrophobicContact CG-CB 4.1Å; A347-R350 HydrophobicContact CB-CG 4.31Å; A347-R350 WeakPolarHBondContact O-CA 3.34Å; A347-R350 WeakPolarHBondContact O-CB 3.48Å; A347-R350 PolarHBondContact O-N 2.92Å; P348-R350 PolarHBondContact O-N 3.29Å; R350-I352 VanDerWaalsContact C-N 3.32Å; R350-I352 PolarHBondContact O-N 3.06Å; R350-T353 WeakPolarHBondContact O-CB 3.29Å; R350-T353 PolarHBondContact O-N 3.41Å; R350-L354 PolarHBondContact O-N 2.99Å
351V88.8Confident85.9Confident11 Ų1152.8 Ų52.87%0.06728%0.281CS..Hα-helixtrans-61.4-41.4175.5179.30000111.1L346 A347 P348 L354 G355 L411 S415L346-V351 HydrophobicContact CB-CG2 4.12Å; L346-V351 HydrophobicContact CD2-CG2 3.91Å; L346-V351 HydrophobicContact CG-CG2 4.41Å; A347-V351 PolarHBondContact O-N 3.14Å; P348-V351 WeakPolarHBondContact O-CB 3.46Å; P348-V351 PolarHBondContact O-N 3.02Å; V351-L354 PolarHBondContact O-N 2.87Å; V351-G355 PolarHBondContact O-N 3.45Å; V351-L411 HydrophobicContact CG1-CB 3.76Å; V351-L411 HydrophobicContact CG1-CD2 3.86Å; V351-L411 HydrophobicContact CG1-CG 4.3Å; V351-S415 WeakPolarHBondContact CG1-OG 3.32Å
352I92.3Very high87.3Confident0 Ų048.3 Ų48.30%026%0.259CS..Hα-helixtrans-62.6-44.4174.2-65.1165000110.8L277 P348 A349 R350 L354 G355 H356 V412 S415 I419 F493L277-I352 HydrophobicContact CD1-CD1 4.01Å; P348-I352 WeakPolarHBondContact O-CG1 3.25Å; P348-I352 PolarHBondContact O-N 3.19Å; A349-I352 PolarHBondContact O-N 3.43Å; R350-I352 VanDerWaalsContact C-N 3.32Å; R350-I352 PolarHBondContact O-N 3.06Å; I352-L354 VanDerWaalsContact C-N 3.3Å; I352-L354 PolarHBondContact O-N 3.01Å; I352-G355 PolarHBondContact O-N 3.22Å; I352-H356 WeakPolarHBondContact O-CB 3.43Å; I352-H356 PolarHBondContact O-CD2 3.33Å; I352-H356 PolarHBondContact O-N 3.42Å; I352-V412 HydrophobicContact CG2-CG1 4.26Å; I352-V412 HydrophobicContact CG2-CG2 4.44Å; I352-S415 VanDerWaalsContact CG1-CB 3.48Å; I352-I419 HydrophobicContact CD1-CD1 3.52Å; I352-F493 HydrophobicContact CB-CD1 4.45Å; I352-F493 HydrophobicContact CB-CE1 3.52Å; I352-F493 HydrophobicContact CB-CZ 3.79Å; I352-F493 HydrophobicContact CD1-CZ 4.05Å; I352-F493 HydrophobicContact CG2-CD1 3.88Å; I352-F493 HydrophobicContact CG2-CE1 3.29Å; I352-F493 HydrophobicContact CG2-CE2 4.23Å; I352-F493 HydrophobicContact CG2-CZ 3.49Å; I352-F493 VanDerWaalsContact CG2-CZ 3.49Å
353T94.6Very high88.6Confident8 Ų839.3 Ų39.35%0.04922%0.217CC..Hα-helixtrans-60.4-40.2177.7-51.30000112A349 R350 H356 A357 T490 F493 W494A349-T353 PolarHBondContact O-N 3.26Å; A349-T353 VanDerWaalsContact O-N 3.17Å; A349-T353 PolarHBondContact O-OG1 3.31Å; A349-T353 VanDerWaalsContact O-OG1 3.07Å; R350-T353 WeakPolarHBondContact O-CB 3.29Å; R350-T353 PolarHBondContact O-N 3.41Å; T353-H356 PolarHBondContact O-N 2.88Å; T353-A357 PolarHBondContact O-N 2.89Å; T353-T490 HydrophobicContact CG2-CG2 4.09Å; T353-F493 VanDerWaalsContact OG1-CD1 3.32Å; T353-F493 WeakPolarHBondContact OG1-CD1 3.48Å; T353-F493 WeakPolarHBondContact OG1-CE1 3.23Å; T353-W494 HydrophobicContact CG2-CB 4.01Å; T353-W494 HydrophobicContact CG2-CD2 4.13Å; T353-W494 HydrophobicContact CG2-CE3 3.46Å; T353-W494 VanDerWaalsContact CG2-CE3 3.46Å; T353-W494 HydrophobicContact CG2-CG 4.41Å; T353-W494 HydrophobicContact CG2-CZ3 4.23Å
354L94.3Very high90.2Very high91 Ų9137.4 Ų37.448%0.47621%0.212SC..Hα-helixtrans-62.8-46.9175.4-179.661.3000111.4R350 V351 I352 H356 A357 C358 L411R350-L354 PolarHBondContact O-N 2.99Å; V351-L354 PolarHBondContact O-N 2.87Å; I352-L354 VanDerWaalsContact C-N 3.3Å; I352-L354 PolarHBondContact O-N 3.01Å; L354-H356 VanDerWaalsContact C-N 3.31Å; L354-H356 PolarHBondContact O-N 3.41Å; L354-A357 WeakPolarHBondContact O-CB 3.33Å; L354-A357 PolarHBondContact O-N 3.41Å; L354-A357 VanDerWaalsContact O-N 3.16Å; L354-C358 PolarHBondContact O-N 3.33Å; L354-C358 PolarHBondContact O-SG 3.17Å; L354-L411 HydrophobicContact CD2-CD1 3.96Å; L354-L411 HydrophobicContact CG-CD1 4.06Å
355G95.4Very high91.8Very high0 Ų032.5 Ų32.50%018%0.182CC..Hα-helixtrans-67.2-30.7177.700000113.6V351 I352 C358 A359V351-G355 PolarHBondContact O-N 3.45Å; I352-G355 PolarHBondContact O-N 3.22Å; G355-C358 PolarHBondContact O-N 3.02Å; G355-A359 PolarHBondContact O-N 3.1Å
356H97.6Very high93.3Very high0 Ų029.8 Ų29.80%016%0.164CC..Hα-helixtrans-64.6-42169.8-82.5-153.1000111.7Q281 Y284 I352 T353 L354 A359 A360 M486 N489 T490Q281-H356 PolarHBondContact NE2-NE2 3.44Å; Q281-H356 PolarHBondContact OE1-NE2 2.86Å; Y284-H356 WeakPolarHBondContact CB-NE2 3.44Å; Y284-H356 AromaticContact CD2-CD2 3.43Å; Y284-H356 VanDerWaalsContact CD2-CD2 3.43Å; Y284-H356 WeakPolarHBondContact CD2-CD2 3.43Å; Y284-H356 AromaticContact CD2-NE2 3.81Å; Y284-H356 AromaticContact CG-CD2 3.7Å; Y284-H356 AromaticContact CG-NE2 3.55Å; I352-H356 WeakPolarHBondContact O-CB 3.43Å; I352-H356 PolarHBondContact O-CD2 3.33Å; I352-H356 PolarHBondContact O-N 3.42Å; T353-H356 PolarHBondContact O-N 2.88Å; L354-H356 VanDerWaalsContact C-N 3.31Å; L354-H356 PolarHBondContact O-N 3.41Å; H356-A359 PolarHBondContact O-N 3.27Å; H356-A360 PolarHBondContact O-N 3.46Å; H356-M486 HydrophobicContact CB-CE 3.4Å; H356-M486 VanDerWaalsContact CB-CE 3.4Å; H356-M486 WeakPolarHBondContact O-CE 3.28Å; H356-N489 PolarHBondContact CE1-ND2 2.86Å; H356-N489 PolarHBondContact ND1-ND2 3.23Å; H356-T490 HydrophobicContact CB-CG2 3.96Å; H356-T490 PolarHBondContact O-OG1 2.67Å
357A97.8Very high94.4Very high37 Ų3725 Ų2531%0.30614%0.139SC..Hα-helixtrans-62.9-42.6173.300000111.7T353 L354 A359 A360 V361 T490T353-A357 PolarHBondContact O-N 2.89Å; L354-A357 WeakPolarHBondContact O-CB 3.33Å; L354-A357 PolarHBondContact O-N 3.41Å; L354-A357 VanDerWaalsContact O-N 3.16Å; A357-A359 VanDerWaalsContact C-N 3.29Å; A357-A359 PolarHBondContact O-N 3.45Å; A357-A360 PolarHBondContact O-N 2.94Å; A357-A360 VanDerWaalsContact O-N 3.16Å; A357-V361 WeakPolarHBondContact O-CG2 3.23Å; A357-V361 PolarHBondContact O-N 3.43Å; A357-T490 HydrophobicContact CB-CG2 4.26Å
358C97.4Very high95.2Very high19 Ų1928.6 Ų28.613%0.12816%0.155CC..Hα-helixtrans-57.6-40.8173.7-65.90000112.1L354 G355 V361 S362 L404L354-C358 PolarHBondContact O-N 3.33Å; L354-C358 PolarHBondContact O-SG 3.17Å; G355-C358 PolarHBondContact O-N 3.02Å; C358-V361 PolarHBondContact O-N 3.46Å; C358-S362 VanDerWaalsContact O-CB 3.28Å; C358-S362 WeakPolarHBondContact O-CB 3.46Å; C358-S362 PolarHBondContact O-N 2.85Å; C358-L404 WeakPolarHBondContact CB-O 3.37Å
359A97.8Very high95.9Very high0 Ų028.5 Ų28.50%015%0.154CC..Hα-helixtrans-66.3-41.2175.400000112.5Y284 C287 G355 H356 A357 S362 V363 L405 M486Y284-A359 HydrophobicContact CD2-CB 3.91Å; Y284-A359 HydrophobicContact CE2-CB 3.82Å; C287-A359 HydrophobicContact CB-CB 4.16Å; G355-A359 PolarHBondContact O-N 3.1Å; H356-A359 PolarHBondContact O-N 3.27Å; A357-A359 VanDerWaalsContact C-N 3.29Å; A357-A359 PolarHBondContact O-N 3.45Å; A359-S362 PolarHBondContact O-N 3.46Å; A359-V363 WeakPolarHBondContact O-CG2 3.37Å; A359-V363 PolarHBondContact O-N 2.84Å; A359-V363 VanDerWaalsContact O-N 3.11Å; A359-L405 HydrophobicContact CB-CD1 3.92Å; A359-M486 HydrophobicContact CB-CE 4.31Å; A359-M486 HydrophobicContact CB-CG 4.29Å
360A98.4Very high96.3Very high9 Ų928.3 Ų28.37%0.07415%0.152CC..Hα-helixtrans-61.3-45.1175.600000111.8H356 A357 L364 M486H356-A360 PolarHBondContact O-N 3.46Å; A357-A360 PolarHBondContact O-N 2.94Å; A357-A360 VanDerWaalsContact O-N 3.16Å; A360-L364 WeakPolarHBondContact O-CB 3.31Å; A360-L364 PolarHBondContact O-N 3.44Å; A360-M486 HydrophobicContact CB-CB 4.13Å; A360-M486 HydrophobicContact CB-CG 3.89Å
361V98.6Very high96.5Very high69 Ų6925.9 Ų25.942%0.41815%0.149SC..Hα-helixtrans-67.4-40.4177.3179.80000111.2A357 C358 V363 L364 V365 L404A357-V361 WeakPolarHBondContact O-CG2 3.23Å; A357-V361 PolarHBondContact O-N 3.43Å; C358-V361 PolarHBondContact O-N 3.46Å; V361-V363 PolarHBondContact O-N 2.92Å; V361-L364 PolarHBondContact O-N 3.18Å; V361-V365 HydrophobicContact CG1-CG2 4.16Å; V361-V365 WeakPolarHBondContact O-CB 3.48Å; V361-V365 VanDerWaalsContact O-CG2 3.27Å; V361-V365 WeakPolarHBondContact O-CG2 3.35Å; V361-V365 PolarHBondContact O-N 2.89Å; V361-L404 HydrophobicContact CB-CD1 4.36Å; V361-L404 HydrophobicContact CG1-CD1 3.79Å
362S98.4Very high96.8Very high0 Ų029.9 Ų29.90%017%0.167CC..Hα-helixtrans-54.6-52.4176.2170.60000111.4Y295 C358 A359 L364 V365 A366 Q401Y295-S362 VanDerWaalsContact OH-C 3.27Å; Y295-S362 PolarHBondContact OH-O 3.26Å; Y295-S362 PolarHBondContact OH-OG 3.43Å; C358-S362 VanDerWaalsContact O-CB 3.28Å; C358-S362 WeakPolarHBondContact O-CB 3.46Å; C358-S362 PolarHBondContact O-N 2.85Å; A359-S362 PolarHBondContact O-N 3.46Å; S362-L364 PolarHBondContact O-N 3.01Å; S362-V365 PolarHBondContact O-N 3.36Å; S362-A366 PolarHBondContact O-N 2.98Å; S362-Q401 PolarHBondContact OG-O 3.42Å
363V98.1Very high97Very high0 Ų030 Ų300%017%0.167CC..Hα-helixtrans-70.5-34.1-177.6-176.40000111.3C287 Y295 A359 V361 A366 G367 F479 L482 A483C287-V363 HydrophobicContact CB-CG2 4Å; Y295-V363 VanDerWaalsContact OH-CA 3.31Å; Y295-V363 WeakPolarHBondContact OH-CA 3.28Å; Y295-V363 PolarHBondContact OH-N 3.48Å; A359-V363 WeakPolarHBondContact O-CG2 3.37Å; A359-V363 PolarHBondContact O-N 2.84Å; A359-V363 VanDerWaalsContact O-N 3.11Å; V361-V363 PolarHBondContact O-N 2.92Å; V363-A366 PolarHBondContact O-N 2.7Å; V363-G367 PolarHBondContact O-N 2.91Å; V363-G367 VanDerWaalsContact O-N 3.14Å; V363-F479 HydrophobicContact CG1-CB 4.03Å; V363-F479 HydrophobicContact CG1-CD1 4.15Å; V363-F479 HydrophobicContact CG1-CG 4.49Å; V363-F479 WeakPolarHBondContact CG1-O 3.17Å; V363-L482 HydrophobicContact CG1-CB 3.84Å; V363-L482 HydrophobicContact CG1-CD2 3.93Å; V363-L482 HydrophobicContact CG1-CG 3.97Å; V363-L482 HydrophobicContact CG2-CD2 4.16Å; V363-L482 HydrophobicContact CG2-CG 4.45Å; V363-A483 HydrophobicContact CB-CB 4.39Å; V363-A483 HydrophobicContact CG1-CB 4.33Å
364L98.5Very high96.9Very high76 Ų7631.6 Ų31.640%0.39817%0.173SC..Hα-helixtrans-60.5-47.8171.8178.364.1000111.5A360 V361 S362 A366 G367 L368 F480 A483A360-L364 WeakPolarHBondContact O-CB 3.31Å; A360-L364 PolarHBondContact O-N 3.44Å; V361-L364 PolarHBondContact O-N 3.18Å; S362-L364 PolarHBondContact O-N 3.01Å; L364-A366 VanDerWaalsContact C-N 3.3Å; L364-A366 PolarHBondContact O-N 3.34Å; L364-G367 PolarHBondContact O-N 3.41Å; L364-L368 PolarHBondContact O-N 3.39Å; L364-L368 VanDerWaalsContact O-N 3.09Å; L364-F480 HydrophobicContact CD1-CD1 3.93Å; L364-F480 HydrophobicContact CD1-CE1 3.98Å; L364-A483 HydrophobicContact CB-CB 4.04Å
365V98.4Very high96.8Very high23 Ų2331.2 Ų31.214%0.13918%0.183CC..Hα-helixtrans-59.2-42.6175.9168.50000110.3V361 S362 G367 L368 V369 L400 Q401 L404V361-V365 HydrophobicContact CG1-CG2 4.16Å; V361-V365 WeakPolarHBondContact O-CB 3.48Å; V361-V365 VanDerWaalsContact O-CG2 3.27Å; V361-V365 WeakPolarHBondContact O-CG2 3.35Å; V361-V365 PolarHBondContact O-N 2.89Å; S362-V365 PolarHBondContact O-N 3.36Å; V365-G367 VanDerWaalsContact C-N 3.28Å; V365-G367 PolarHBondContact O-N 3.16Å; V365-L368 PolarHBondContact O-N 3.36Å; V365-L368 VanDerWaalsContact O-N 3.13Å; V365-V369 HydrophobicContact CG1-CG2 3.86Å; V365-V369 WeakPolarHBondContact O-CB 3.22Å; V365-V369 VanDerWaalsContact O-CG2 3.26Å; V365-V369 WeakPolarHBondContact O-CG2 3.02Å; V365-V369 PolarHBondContact O-N 2.95Å; V365-L400 HydrophobicContact CG1-CB 4.4Å; V365-L400 HydrophobicContact CG1-CD2 4.06Å; V365-L400 HydrophobicContact CG1-CG 4.27Å; V365-L400 HydrophobicContact CG2-CD2 4.3Å; V365-Q401 HydrophobicContact CG1-CB 4.26Å; V365-L404 HydrophobicContact CG2-CD1 4.36Å
366A97.9Very high96.7Very high0 Ų033.5 Ų33.50%019%0.194CC..Hα-helixtrans-58.8-39.1177.200000113Y295 Q298 S362 V363 L364 E370 Q401 F479Y295-A366 HydrophobicContact CD1-CB 4.09Å; Y295-A366 HydrophobicContact CE1-CB 3.31Å; Q298-A366 PolarHBondContact NE2-O 3.19Å; S362-A366 PolarHBondContact O-N 2.98Å; V363-A366 PolarHBondContact O-N 2.7Å; L364-A366 VanDerWaalsContact C-N 3.3Å; L364-A366 PolarHBondContact O-N 3.34Å; A366-E370 VanDerWaalsContact O-CB 3.3Å; A366-E370 WeakPolarHBondContact O-CB 3.45Å; A366-E370 PolarHBondContact O-N 3.46Å; A366-Q401 VanDerWaalsContact CA-OE1 3.25Å; A366-Q401 HydrophobicContact CB-CB 4.3Å; A366-Q401 HydrophobicContact CB-CG 4.37Å; A366-F479 HydrophobicContact CB-CD1 4.38Å; A366-F479 HydrophobicContact CB-CD2 3.86Å; A366-F479 HydrophobicContact CB-CE2 4.04Å; A366-F479 HydrophobicContact CB-CG 4.04Å; A366-F479 HydrophobicContact CB-CZ 4.4Å
367G97.1Very high96.6Very high0 Ų037.6 Ų37.60%022%0.22CC..Hα-helixtrans-64.7-44.2173.200000113.4V363 L364 V365 E370 L371 E476V363-G367 PolarHBondContact O-N 2.91Å; V363-G367 VanDerWaalsContact O-N 3.14Å; L364-G367 PolarHBondContact O-N 3.41Å; V365-G367 VanDerWaalsContact C-N 3.28Å; V365-G367 PolarHBondContact O-N 3.16Å; G367-E370 PolarHBondContact O-N 3.06Å; G367-L371 PolarHBondContact O-N 3.43Å; G367-E476 WeakPolarHBondContact O-CB 3.28Å
368L97.6Very high96.4Very high96 Ų9639.7 Ų39.750%0.50323%0.226SC..Hα-helixtrans-66-42.3177.6-65.7175.1000112.2L364 V365 E370 L371 H372 F480L364-L368 PolarHBondContact O-N 3.39Å; L364-L368 VanDerWaalsContact O-N 3.09Å; V365-L368 PolarHBondContact O-N 3.36Å; V365-L368 VanDerWaalsContact O-N 3.13Å; L368-E370 VanDerWaalsContact C-N 3.29Å; L368-E370 PolarHBondContact O-N 3.3Å; L368-L371 WeakPolarHBondContact O-CB 3.31Å; L368-L371 PolarHBondContact O-N 2.8Å; L368-H372 PolarHBondContact O-N 3.25Å; L368-F480 HydrophobicContact CD2-CE1 4.15Å; L368-F480 HydrophobicContact CD2-CZ 4.1Å; L368-F480 HydrophobicContact CG-CE1 4.27Å
369V97.2Very high96.2Very high23 Ų2341.9 Ų41.914%0.13924%0.239CC..Hα-helixtrans-69.6-30.8178.6177.80000110.8V365 H372 R373 M393 L398V365-V369 HydrophobicContact CG1-CG2 3.86Å; V365-V369 WeakPolarHBondContact O-CB 3.22Å; V365-V369 VanDerWaalsContact O-CG2 3.26Å; V365-V369 WeakPolarHBondContact O-CG2 3.02Å; V365-V369 PolarHBondContact O-N 2.95Å; V369-H372 CarbonylContact O-C 3.58Å; V369-H372 WeakPolarHBondContact O-CB 2.93Å; V369-H372 PolarHBondContact O-N 3.23Å; V369-R373 WeakPolarHBondContact O-CB 3.15Å; V369-R373 PolarHBondContact O-N 3.17Å; V369-M393 HydrophobicContact CG1-CE 3.31Å; V369-M393 HydrophobicContact CG1-SD 4.37Å; V369-L398 HydrophobicContact CG1-CD2 3.56Å
370E96.5Very high95.9Very high0 Ų048.1 Ų48.10%027%0.268CS..Hα-helixtrans-64.6-41173.1-176.658.4-167.400112.6Q298 A366 G367 L368 H372 R373 K374 L475 E476Q298-E370 WeakPolarHBondContact CG-OE2 3.3Å; Q298-E370 PolarHBondContact NE2-OE2 2.92Å; A366-E370 VanDerWaalsContact O-CB 3.3Å; A366-E370 WeakPolarHBondContact O-CB 3.45Å; A366-E370 PolarHBondContact O-N 3.46Å; G367-E370 PolarHBondContact O-N 3.06Å; L368-E370 VanDerWaalsContact C-N 3.29Å; L368-E370 PolarHBondContact O-N 3.3Å; E370-H372 VanDerWaalsContact C-N 3.26Å; E370-H372 PolarHBondContact O-N 3.04Å; E370-R373 PolarHBondContact O-N 2.9Å; E370-R373 IonicContact OE1-CZ 3.44Å; E370-R373 IonicContact OE1-NE 2.76Å; E370-R373 PolarHBondContact OE1-NE 3.1Å; E370-R373 IonicContact OE1-NH2 3.26Å; E370-R373 PolarHBondContact OE1-NH2 3.38Å; E370-R373 IonicContact OE2-CZ 2.69Å; E370-R373 IonicContact OE2-NE 3.5Å; E370-R373 PolarHBondContact OE2-NE 2.77Å; E370-R373 IonicContact OE2-NH2 3.31Å; E370-K374 HydrophobicContact CG-CD 4.48Å; E370-K374 WeakPolarHBondContact O-CG 3.41Å; E370-K374 PolarHBondContact O-N 3.17Å; E370-L475 HydrophobicContact CG-CB 4.18Å; E370-E476 HydrophobicContact CB-CB 4.01Å; E370-E476 HydrophobicContact CG-CB 4.03Å
371L94.9Very high95.5Very high82 Ų8247.9 Ų47.943%0.42927%0.265SS..Hα-helixtrans-58.2-41.7171.2-70172.2000111.5G367 L368 A375 E476 F480G367-L371 PolarHBondContact O-N 3.43Å; L368-L371 WeakPolarHBondContact O-CB 3.31Å; L368-L371 PolarHBondContact O-N 2.8Å; L371-A375 PolarHBondContact O-N 3.08Å; L371-E476 HydrophobicContact CD2-CB 4.32Å; L371-E476 HydrophobicContact CD2-CG 3.67Å; L371-E476 HydrophobicContact CG-CB 4.16Å; L371-E476 HydrophobicContact CG-CG 4.03Å; L371-F480 HydrophobicContact CD1-CE2 4.13Å; L371-F480 HydrophobicContact CD1-CZ 3.97Å
372H94.9Very high94.9Very high95 Ų9548.5 Ų48.544%0.4427%0.269SS..Hα-helixtrans-68.2-39.3177.4-16861.4000112.8L368 V369 E370 K374 A375 H376L368-H372 PolarHBondContact O-N 3.25Å; V369-H372 CarbonylContact O-C 3.58Å; V369-H372 WeakPolarHBondContact O-CB 2.93Å; V369-H372 PolarHBondContact O-N 3.23Å; E370-H372 VanDerWaalsContact C-N 3.26Å; E370-H372 PolarHBondContact O-N 3.04Å; H372-K374 VanDerWaalsContact C-N 3.33Å; H372-K374 PolarHBondContact O-N 3.35Å; H372-A375 WeakPolarHBondContact O-CB 3.42Å; H372-A375 PolarHBondContact O-N 3.21Å; H372-H376 AromaticContact CD2-CE1 3.78Å; H372-H376 AromaticContact CE1-CE1 3.76Å; H372-H376 AromaticContact NE2-CE1 3.43Å; H372-H376 PolarHBondContact NE2-CE1 3.11Å; H372-H376 PolarHBondContact O-ND1 3.38Å
373R95.9Very high94.2Very high2 Ų248.5 Ų48.51%0.00827%0.269CS..Hα-helixtrans-62.2-40177.4-167-165.866.37016.7111.7N301 S302 V369 E370 A375 H376 S391 M393 L470N301-R373 PolarHBondContact O-NH1 3.32Å; S302-R373 VanDerWaalsContact OG-CD 3.31Å; S302-R373 WeakPolarHBondContact OG-CD 3.24Å; V369-R373 WeakPolarHBondContact O-CB 3.15Å; V369-R373 PolarHBondContact O-N 3.17Å; E370-R373 PolarHBondContact O-N 2.9Å; E370-R373 IonicContact OE1-CZ 3.44Å; E370-R373 IonicContact OE1-NE 2.76Å; E370-R373 PolarHBondContact OE1-NE 3.1Å; E370-R373 IonicContact OE1-NH2 3.26Å; E370-R373 PolarHBondContact OE1-NH2 3.38Å; E370-R373 IonicContact OE2-CZ 2.69Å; E370-R373 IonicContact OE2-NE 3.5Å; E370-R373 PolarHBondContact OE2-NE 2.77Å; E370-R373 IonicContact OE2-NH2 3.31Å; R373-A375 VanDerWaalsContact C-N 3.29Å; R373-A375 PolarHBondContact O-N 3.15Å; R373-H376 PolarHBondContact O-N 3.19Å; R373-S391 PolarHBondContact O-OG 3.27Å; R373-M393 WeakPolarHBondContact CA-SD 3.3Å; R373-M393 HydrophobicContact CB-SD 3.5Å; R373-M393 WeakPolarHBondContact CB-SD 3.47Å; R373-M393 HydrophobicContact CG-CB 4.28Å; R373-M393 HydrophobicContact CG-SD 3.78Å; R373-L470 PolarHBondContact NH2-O 2.92Å
374K92.2Very high93.2Very high42 Ų4249 Ų4918%0.18327%0.273CS..Hα-helixtrans-67.5-27.7177.8-70.3173.476-175.70113.2E370 H372 H376 H471 G473 N474 E476E370-K374 HydrophobicContact CG-CD 4.48Å; E370-K374 WeakPolarHBondContact O-CG 3.41Å; E370-K374 PolarHBondContact O-N 3.17Å; H372-K374 VanDerWaalsContact C-N 3.33Å; H372-K374 PolarHBondContact O-N 3.35Å; K374-H376 PolarHBondContact O-N 2.93Å; K374-H471 WeakPolarHBondContact CE-O 3.34Å; K374-H471 PolarHBondContact O-CE1 2.88Å; K374-G473 WeakPolarHBondContact CE-O 3.18Å; K374-G473 PolarHBondContact NZ-O 3.22Å; K374-N474 PolarHBondContact NZ-OD1 3.32Å; K374-E476 IonicContact NZ-OE1 2.78Å; K374-E476 PolarHBondContact NZ-OE1 2.64Å; K374-E476 IonicContact NZ-OE2 3.67Å
375A93Very high92.1Very high82 Ų8248.4 Ų48.468%0.67829%0.285SS*.THydrogen-bonded Turntrans-73.2-14.6178.100000113.8L371 H372 R373L371-A375 PolarHBondContact O-N 3.08Å; H372-A375 WeakPolarHBondContact O-CB 3.42Å; H372-A375 PolarHBondContact O-N 3.21Å; R373-A375 VanDerWaalsContact C-N 3.29Å; R373-A375 PolarHBondContact O-N 3.15Å
376H93.1Very high91.3Very high48 Ų4851.9 Ų51.922%0.22230%0.298CS..SBendtrans-85.5148.6178.8-76.677.5000111.9H372 R373 K374 S391 M393H372-H376 AromaticContact CD2-CE1 3.78Å; H372-H376 AromaticContact CE1-CE1 3.76Å; H372-H376 AromaticContact NE2-CE1 3.43Å; H372-H376 PolarHBondContact NE2-CE1 3.11Å; H372-H376 PolarHBondContact O-ND1 3.38Å; R373-H376 PolarHBondContact O-N 3.19Å; K374-H376 PolarHBondContact O-N 2.93Å; H376-S391 WeakPolarHBondContact CB-OG 3.49Å; H376-M393 HydrophobicContact CB-CB 4.26Å
377P94.1Very high90.7Very high87 Ų8755.7 Ų55.757%0.56532%0.321SS*.PPolyproline II helixtrans-66.6156.617828.7-35.8000112S392P377-S392 WeakPolarHBondContact CD-OG 3.19Å; P377-S392 WeakPolarHBondContact O-CB 3.06Å; P377-S392 PolarHBondContact O-N 3.26Å; P377-S392 PolarHBondContact O-OG 2.9Å
378L94.3Very high90.3Very high80 Ų8057.4 Ų57.442%0.41933%0.33SS..EExtended strand (participates in β ladder)trans-80.2142.8176.2-64.5172000111.4V390 H471L378-V390 CarbonylContact C-O 3.49Å; L378-V390 VanDerWaalsContact CA-O 3.28Å; L378-V390 WeakPolarHBondContact CA-O 3.44Å; L378-H471 HydrophobicContact CD2-CB 4.23Å
379V93.3Very high89.9Confident65 Ų6558.4 Ų58.439%0.39433%0.332SS..EExtended strand (participates in β ladder)trans-132.9146.6177.3178.70000108.4V390V379-V390 PolarHBondContact N-O 2.87Å; V379-V390 PolarHBondContact O-N 3.01Å
380E91.6Very high89.6Confident132 Ų13257.3 Ų57.362%0.61733%0.326SS*.EExtended strand (participates in β ladder)trans-76.8131.4175.5-67.3-177.3173.600111V387 H389E380-V387 HydrophobicContact CB-CG1 4.05Å; E380-V387 HydrophobicContact CG-CG1 4.19Å; E380-H389 IonicContact OE1-CE1 3.44Å; E380-H389 PolarHBondContact OE1-CE1 3.29Å
381Q89.6Confident89.5Confident3 Ų357.3 Ų57.31%0.01433%0.326CS..EExtended strand (participates in β ladder)trans-137.3129.1176-175.5177.1-91.700109.8L310 L383 L388 V390L310-Q381 HydrophobicContact CD1-CG 4.15Å; Q381-L383 HydrophobicContact CG-CG 4.37Å; Q381-L388 PolarHBondContact N-O 3.33Å; Q381-L388 PolarHBondContact O-N 3.12Å; Q381-V390 HydrophobicContact CB-CG1 4.35Å; Q381-V390 HydrophobicContact CB-CG2 3.58Å; Q381-V390 HydrophobicContact CG-CG2 4.45Å
382T86.5Confident89.4Confident83 Ų8354.8 Ų54.851%0.50932%0.315SS..EExtended strand (participates in β ladder)trans-87.7118.1176.853.40000110.8K386 V387T382-K386 CarbonylContact C-O 3.57Å; T382-K386 WeakPolarHBondContact CA-O 3.3Å; T382-V387 HydrophobicContact CG2-CG2 3.97Å
383L83.9Confident89.4Confident0 Ų050.3 Ų50.30%029%0.294CS..EExtended strand (participates in β ladder)trans-123.4124.5174.6-70.1178.9000110.1L31 Q181 M300 L304 L310 I313 Q381 G385 K386 L388L31-L383 HydrophobicContact CD1-CB 4.26Å; Q181-L383 HydrophobicContact CG-CD2 3.72Å; Q181-L383 VanDerWaalsContact NE2-CD2 3.29Å; M300-L383 HydrophobicContact CG-CD1 3.99Å; L304-L383 HydrophobicContact CD1-CD1 4.24Å; L304-L383 HydrophobicContact CD1-CD2 3.9Å; L310-L383 HydrophobicContact CD2-CD2 4.27Å; I313-L383 HydrophobicContact CD1-CD1 4.36Å; Q381-L383 HydrophobicContact CG-CG 4.37Å; L383-G385 PolarHBondContact O-N 3.38Å; L383-G385 VanDerWaalsContact O-N 3.12Å; L383-K386 PolarHBondContact N-O 3.27Å; L383-K386 PolarHBondContact O-N 3.48Å; L383-L388 HydrophobicContact CB-CD1 4.04Å; L383-L388 HydrophobicContact CD1-CD1 3.91Å; L383-L388 HydrophobicContact CG-CD1 4.37Å
384S77.1Confident89.3Confident11 Ų1152.6 Ų52.68%0.07731%0.309CS..THydrogen-bonded Turntrans47.841.5-178.3-155.30000112.9Q181 Q185 K386Q181-S384 PolarHBondContact O-N 2.83Å; Q185-S384 VanDerWaalsContact CD-O 3.27Å; Q185-S384 WeakPolarHBondContact CG-OG 2.88Å; Q185-S384 PolarHBondContact NE2-O 2.96Å; Q185-S384 PolarHBondContact OE1-O 3.41Å; S384-K386 VanDerWaalsContact C-N 3.26Å; S384-K386 PolarHBondContact O-N 3.25Å
385G74.8Confident89.4Confident63 Ų6350.6 Ų50.665%0.64930%0.301SS*.THydrogen-bonded Turntrans81.2-3.6175.800000115Q185 L383Q185-G385 VanDerWaalsContact NE2-CA 3.35Å; L383-G385 PolarHBondContact O-N 3.38Å; L383-G385 VanDerWaalsContact O-N 3.12Å
386K81.8Confident89.2Confident96 Ų9650.5 Ų50.542%0.41729%0.285SS..EExtended strand (participates in β ladder)trans-102.9131.7176.5-171.5173.2-178.2175.40110.3V35 T382 L383 S384 L388V35-K386 HydrophobicContact CG1-CB 3.67Å; V35-K386 HydrophobicContact CG1-CD 3.95Å; V35-K386 HydrophobicContact CG1-CG 4.47Å; T382-K386 CarbonylContact C-O 3.57Å; T382-K386 WeakPolarHBondContact CA-O 3.3Å; L383-K386 PolarHBondContact N-O 3.27Å; L383-K386 PolarHBondContact O-N 3.48Å; S384-K386 VanDerWaalsContact C-N 3.26Å; S384-K386 PolarHBondContact O-N 3.25Å; K386-L388 HydrophobicContact CD-CD2 4.17Å; K386-L388 HydrophobicContact CG-CD2 4.22Å
387V86.4Confident89.3Confident80 Ų8052.2 Ų52.249%0.48529%0.293SS..EExtended strand (participates in β ladder)trans-75.9124.8171.1-173.80000108.2E380 T382E380-V387 HydrophobicContact CB-CG1 4.05Å; E380-V387 HydrophobicContact CG-CG1 4.19Å; T382-V387 HydrophobicContact CG2-CG2 3.97Å
388L86.9Confident89.3Confident36 Ų3648.1 Ų48.119%0.18827%0.266CS..EExtended strand (participates in β ladder)trans-120.4141.3176.4-63174.1000109.3V35 Q381 L383 K386 V390V35-L388 HydrophobicContact CG2-CD1 4.45Å; Q381-L388 PolarHBondContact N-O 3.33Å; Q381-L388 PolarHBondContact O-N 3.12Å; L383-L388 HydrophobicContact CB-CD1 4.04Å; L383-L388 HydrophobicContact CD1-CD1 3.91Å; L383-L388 HydrophobicContact CG-CD1 4.37Å; K386-L388 HydrophobicContact CD-CD2 4.17Å; K386-L388 HydrophobicContact CG-CD2 4.22Å; L388-V390 HydrophobicContact CB-CG1 4.13Å
389H89.8Confident89.4Confident116 Ų11645.2 Ų45.254%0.53725%0.254SS..EExtended strand (participates in β ladder)trans-87.9109170.9-64.6-71.2000109.1E380E380-H389 IonicContact OE1-CE1 3.44Å; E380-H389 PolarHBondContact OE1-CE1 3.29Å
390V92.1Very high89.5Confident1 Ų146.6 Ų46.61%0.00626%0.259CS..EExtended strand (participates in β ladder)trans-117160.7-175.8-58.30000110.7L378 V379 Q381 L388L378-V390 CarbonylContact C-O 3.49Å; L378-V390 VanDerWaalsContact CA-O 3.28Å; L378-V390 WeakPolarHBondContact CA-O 3.44Å; V379-V390 PolarHBondContact N-O 2.87Å; V379-V390 PolarHBondContact O-N 3.01Å; Q381-V390 HydrophobicContact CB-CG1 4.35Å; Q381-V390 HydrophobicContact CB-CG2 3.58Å; Q381-V390 HydrophobicContact CG-CG2 4.45Å; L388-V390 HydrophobicContact CB-CG1 4.13Å
391S93.8Very high89.8Confident0 Ų040.3 Ų40.30%023%0.229CC..EExtended strand (participates in β ladder)trans-67.9140.6175.5172.70000111.1N301 S302 N303 R373 H376 M393N301-S391 PolarHBondContact O-N 3.36Å; S302-S391 CarbonylContact C-O 3.5Å; N303-S391 PolarHBondContact N-O 3Å; R373-S391 PolarHBondContact O-OG 3.27Å; H376-S391 WeakPolarHBondContact CB-OG 3.49Å; S391-M393 PolarHBondContact O-N 3.21Å; S391-M393 VanDerWaalsContact O-N 3.16Å; S391-M393 WeakPolarHBondContact OG-CB 3.43Å; S391-M393 PolarHBondContact OG-N 3.06Å
392S93.5Very high90.1Very high29 Ų2940.2 Ų40.220%0.20323%0.229CC..EExtended strand (participates in β ladder)trans-65.5-13.3176.371.10000113.9N303 P377N303-S392 WeakPolarHBondContact CB-O 3.33Å; N303-S392 PolarHBondContact ND2-O 3.38Å; P377-S392 WeakPolarHBondContact CD-OG 3.19Å; P377-S392 WeakPolarHBondContact O-CB 3.06Å; P377-S392 PolarHBondContact O-N 3.26Å; P377-S392 PolarHBondContact O-OG 2.9Å
393M94.9Very high90.5Very high0 Ų039.6 Ų39.60%022%0.222CC..EExtended strand (participates in β ladder)trans-59.4125.9178.2-176.1-171141.900111.1N303 V369 R373 H376 S391 C395 Q397 L398N303-M393 WeakPolarHBondContact CB-O 3.31Å; N303-M393 PolarHBondContact N-O 3.1Å; V369-M393 HydrophobicContact CG1-CE 3.31Å; V369-M393 HydrophobicContact CG1-SD 4.37Å; R373-M393 WeakPolarHBondContact CA-SD 3.3Å; R373-M393 HydrophobicContact CB-SD 3.5Å; R373-M393 WeakPolarHBondContact CB-SD 3.47Å; R373-M393 HydrophobicContact CG-CB 4.28Å; R373-M393 HydrophobicContact CG-SD 3.78Å; H376-M393 HydrophobicContact CB-CB 4.26Å; S391-M393 PolarHBondContact O-N 3.21Å; S391-M393 VanDerWaalsContact O-N 3.16Å; S391-M393 WeakPolarHBondContact OG-CB 3.43Å; S391-M393 PolarHBondContact OG-N 3.06Å; M393-C395 PolarHBondContact O-N 2.97Å; M393-Q397 HydrophobicContact CE-CB 3.36Å; M393-Q397 HydrophobicContact CE-CG 4.35Å; M393-Q397 VanDerWaalsContact CE-OE1 3.28Å; M393-L398 HydrophobicContact CE-CD2 4.03Å; M393-L398 HydrophobicContact CE-CG 4.39Å
394P93.4Very high91.1Very high50 Ų5041.2 Ų41.233%0.32523%0.23SC..EExtended strand (participates in β ladder)trans-66.8134.5-179.326-32.6000111.6F396 Q397P394-F396 PolarHBondContact O-N 3.41Å; P394-F396 VanDerWaalsContact O-N 3.09Å; P394-Q397 HydrophobicContact CG-CG 4.12Å; P394-Q397 PolarHBondContact O-N 3.05Å; P394-Q397 VanDerWaalsContact O-N 3.11Å
395C92.8Very high91.9Very high1 Ų140.7 Ų40.71%0.00723%0.227CC..G310 helixtrans-57.4-26.6-177.6610000114.2N303 L304 M316 M393 Q397 L398N303-C395 PolarHBondContact O-N 3.08Å; L304-C395 HydrophobicContact CD2-CB 3.94Å; M316-C395 WeakPolarHBondContact CE-O 3.38Å; M316-C395 HydrophobicContact SD-CB 4.13Å; M393-C395 PolarHBondContact O-N 2.97Å; C395-Q397 PolarHBondContact O-N 3.03Å; C395-L398 WeakPolarHBondContact O-CB 3.47Å; C395-L398 WeakPolarHBondContact O-CG 3.24Å; C395-L398 PolarHBondContact O-N 3.24Å
396F90.4Very high92.7Very high80 Ų8037.7 Ų37.735%0.35120%0.196SC..G310 helixtrans-62.5-23.2177.6-66.6-76.5000114.2L306 L311 P394 L398 A399L306-F396 HydrophobicContact CB-CE2 4.01Å; L306-F396 HydrophobicContact CD1-CD2 4.01Å; L306-F396 HydrophobicContact CD1-CE2 3.49Å; L306-F396 VanDerWaalsContact CD1-CE2 3.49Å; L306-F396 HydrophobicContact CD1-CZ 4.25Å; L306-F396 HydrophobicContact CD2-CE2 3.91Å; L306-F396 HydrophobicContact CD2-CZ 3.86Å; L306-F396 HydrophobicContact CG-CE2 3.98Å; L306-F396 HydrophobicContact CG-CZ 4.43Å; L311-F396 HydrophobicContact CD1-CZ 4.05Å; L311-F396 HydrophobicContact CD2-CE1 4.21Å; L311-F396 HydrophobicContact CD2-CE2 4.33Å; L311-F396 HydrophobicContact CD2-CZ 3.72Å; L311-F396 HydrophobicContact CG-CZ 4.5Å; P394-F396 PolarHBondContact O-N 3.41Å; P394-F396 VanDerWaalsContact O-N 3.09Å; F396-L398 PolarHBondContact O-N 3.33Å; F396-A399 WeakPolarHBondContact O-CB 3.26Å; F396-A399 PolarHBondContact O-N 3.43Å
397Q93.9Very high93.1Very high84 Ų8435 Ų3539%0.39319%0.187SC..G310 helixtrans-65.3-18.8173-72-179.69.500112.3M393 P394 C395 A399M393-Q397 HydrophobicContact CE-CB 3.36Å; M393-Q397 HydrophobicContact CE-CG 4.35Å; M393-Q397 VanDerWaalsContact CE-OE1 3.28Å; P394-Q397 HydrophobicContact CG-CG 4.12Å; P394-Q397 PolarHBondContact O-N 3.05Å; P394-Q397 VanDerWaalsContact O-N 3.11Å; C395-Q397 PolarHBondContact O-N 3.03Å; Q397-A399 VanDerWaalsContact C-N 3.26Å; Q397-A399 PolarHBondContact O-N 3.2Å
398L95.4Very high93.4Very high0 Ų031.1 Ų31.10%016%0.164CC..G310 helixtrans-75.6-11.9171.1-52.9172.3000112.3Q298 A299 M316 V369 M393 C395 F396 L400 Q401 Y402Q298-L398 HydrophobicContact CG-CD1 4.15Å; Q298-L398 HydrophobicContact CG-CD2 3.77Å; A299-L398 HydrophobicContact CB-CD1 3.88Å; M316-L398 HydrophobicContact CE-CB 3.85Å; V369-L398 HydrophobicContact CG1-CD2 3.56Å; M393-L398 HydrophobicContact CE-CD2 4.03Å; M393-L398 HydrophobicContact CE-CG 4.39Å; C395-L398 WeakPolarHBondContact O-CB 3.47Å; C395-L398 WeakPolarHBondContact O-CG 3.24Å; C395-L398 PolarHBondContact O-N 3.24Å; F396-L398 PolarHBondContact O-N 3.33Å; L398-L400 VanDerWaalsContact C-N 3.25Å; L398-L400 PolarHBondContact O-N 2.82Å; L398-L400 VanDerWaalsContact O-N 3.1Å; L398-Q401 VanDerWaalsContact O-CG 3.26Å; L398-Q401 WeakPolarHBondContact O-CG 3.47Å; L398-Q401 PolarHBondContact O-N 3.48Å; L398-Y402 HydrophobicContact CB-CD2 4.49Å; L398-Y402 HydrophobicContact CB-CE2 4.3Å; L398-Y402 WeakPolarHBondContact O-CD2 3.32Å
399A95.1Very high93.5Very high20 Ų2031.8 Ų31.817%0.16517%0.166CC..Hα-helixtrans-54.5-37.6-170.600000113.8I319 F396 Q397 Q401 Y402 I403I319-A399 HydrophobicContact CD1-CB 4.01Å; I319-A399 HydrophobicContact CG2-CB 4.18Å; F396-A399 WeakPolarHBondContact O-CB 3.26Å; F396-A399 PolarHBondContact O-N 3.43Å; Q397-A399 VanDerWaalsContact C-N 3.26Å; Q397-A399 PolarHBondContact O-N 3.2Å; A399-Q401 VanDerWaalsContact C-N 3.32Å; A399-Q401 PolarHBondContact O-N 2.96Å; A399-Y402 PolarHBondContact O-N 3.21Å; A399-Y402 VanDerWaalsContact O-N 3.11Å; A399-I403 WeakPolarHBondContact O-CG1 3.22Å; A399-I403 PolarHBondContact O-N 2.64Å
400L96.3Very high93.3Very high94 Ų9427 Ų2749%0.49215%0.146SC..Hα-helixtrans-58.3-42.6-176.9-178.659.5000112.4V365 L398 Y402 I403 L404V365-L400 HydrophobicContact CG1-CB 4.4Å; V365-L400 HydrophobicContact CG1-CD2 4.06Å; V365-L400 HydrophobicContact CG1-CG 4.27Å; V365-L400 HydrophobicContact CG2-CD2 4.3Å; L398-L400 VanDerWaalsContact C-N 3.25Å; L398-L400 PolarHBondContact O-N 2.82Å; L398-L400 VanDerWaalsContact O-N 3.1Å; L400-Y402 VanDerWaalsContact C-N 3.31Å; L400-Y402 PolarHBondContact O-N 2.91Å; L400-I403 PolarHBondContact O-N 3.12Å; L400-L404 HydrophobicContact CD1-CD1 4.11Å; L400-L404 HydrophobicContact CD1-CG 4.11Å; L400-L404 HydrophobicContact CG-CD1 4.01Å; L400-L404 HydrophobicContact CG-CG 4.46Å; L400-L404 WeakPolarHBondContact O-CB 3.47Å; L400-L404 VanDerWaalsContact O-CG 3.3Å; L400-L404 WeakPolarHBondContact O-CG 3.47Å; L400-L404 PolarHBondContact O-N 3.03Å
401Q97.1Very high93.1Very high0 Ų027.5 Ų27.50%015%0.149CC..Hα-helixtrans-67.3-34.3-179.881.7-156.431.900111.4Y295 S362 V365 A366 L398 A399 L405Y295-Q401 HydrophobicContact CD2-CG 3.83Å; Y295-Q401 HydrophobicContact CE1-CG 4.37Å; Y295-Q401 HydrophobicContact CE2-CB 4.1Å; Y295-Q401 HydrophobicContact CE2-CG 3.6Å; Y295-Q401 HydrophobicContact CG-CG 4.3Å; S362-Q401 PolarHBondContact OG-O 3.42Å; V365-Q401 HydrophobicContact CG1-CB 4.26Å; A366-Q401 VanDerWaalsContact CA-OE1 3.25Å; A366-Q401 HydrophobicContact CB-CB 4.3Å; A366-Q401 HydrophobicContact CB-CG 4.37Å; L398-Q401 VanDerWaalsContact O-CG 3.26Å; L398-Q401 WeakPolarHBondContact O-CG 3.47Å; L398-Q401 PolarHBondContact O-N 3.48Å; A399-Q401 VanDerWaalsContact C-N 3.32Å; A399-Q401 PolarHBondContact O-N 2.96Å; Q401-L405 WeakPolarHBondContact O-CB 3.12Å; Q401-L405 PolarHBondContact O-N 3.06Å
402Y95.4Very high93Very high0 Ų027.5 Ų27.50%015%0.149CC..Hα-helixtrans-70.3-44.3175.3-77.6-100000111.8I291 Y295 M316 S320 L398 A399 L400 L405 G406I291-Y402 HydrophobicContact CB-CE1 4.47Å; I291-Y402 HydrophobicContact CG1-CD1 4.09Å; I291-Y402 HydrophobicContact CG1-CE1 4.24Å; I291-Y402 HydrophobicContact CG2-CD1 4.35Å; I291-Y402 HydrophobicContact CG2-CE1 4Å; Y295-Y402 VanDerWaalsContact CB-OH 3.3Å; Y295-Y402 WeakPolarHBondContact CB-OH 3.42Å; Y295-Y402 HydrophobicContact CD2-CD2 4.33Å; Y295-Y402 HydrophobicContact CD2-CE2 4.14Å; Y295-Y402 HydrophobicContact CG-CE2 4.34Å; Y295-Y402 PolarHBondContact O-OH 2.91Å; M316-Y402 HydrophobicContact CB-CD1 4.4Å; M316-Y402 HydrophobicContact CB-CE1 3.81Å; M316-Y402 HydrophobicContact CB-CE2 4.11Å; M316-Y402 HydrophobicContact CE-CD2 4.14Å; M316-Y402 HydrophobicContact CE-CE2 4.09Å; M316-Y402 WeakPolarHBondContact O-CD1 3.34Å; M316-Y402 WeakPolarHBondContact O-CE1 3.5Å; S320-Y402 WeakPolarHBondContact CB-O 3.3Å; L398-Y402 HydrophobicContact CB-CD2 4.49Å; L398-Y402 HydrophobicContact CB-CE2 4.3Å; L398-Y402 WeakPolarHBondContact O-CD2 3.32Å; A399-Y402 PolarHBondContact O-N 3.21Å; A399-Y402 VanDerWaalsContact O-N 3.11Å; L400-Y402 VanDerWaalsContact C-N 3.31Å; L400-Y402 PolarHBondContact O-N 2.91Å; Y402-L405 PolarHBondContact O-N 2.96Å; Y402-G406 PolarHBondContact O-N 3.25Å
403I95.5Very high92.6Very high70 Ų7028 Ų2836%0.35915%0.151SC..Hα-helixtrans-60.5-50.2178.1-67.4170.6000110.4I319 P323 A399 L400 L405 G406 V407I319-I403 HydrophobicContact CG2-CD1 4.13Å; I319-I403 HydrophobicContact CG2-CG1 3.47Å; I319-I403 VanDerWaalsContact CG2-CG1 3.47Å; P323-I403 HydrophobicContact CG-CB 4.47Å; P323-I403 HydrophobicContact CG-CG2 4Å; A399-I403 WeakPolarHBondContact O-CG1 3.22Å; A399-I403 PolarHBondContact O-N 2.64Å; L400-I403 PolarHBondContact O-N 3.12Å; I403-L405 VanDerWaalsContact C-N 3.27Å; I403-L405 PolarHBondContact O-N 3.32Å; I403-G406 PolarHBondContact O-N 2.82Å; I403-V407 HydrophobicContact CG2-CG2 4.39Å; I403-V407 WeakPolarHBondContact O-CG2 3.49Å; I403-V407 PolarHBondContact O-N 3.04Å
404L96.2Very high92Very high35 Ų3531.6 Ų31.618%0.18317%0.174CC..Hα-helixtrans-58.6-40.7-179-75171.1000112.1C358 V361 V365 L400 G408C358-L404 WeakPolarHBondContact CB-O 3.37Å; V361-L404 HydrophobicContact CB-CD1 4.36Å; V361-L404 HydrophobicContact CG1-CD1 3.79Å; V365-L404 HydrophobicContact CG2-CD1 4.36Å; L400-L404 HydrophobicContact CD1-CD1 4.11Å; L400-L404 HydrophobicContact CD1-CG 4.11Å; L400-L404 HydrophobicContact CG-CD1 4.01Å; L400-L404 HydrophobicContact CG-CG 4.46Å; L400-L404 WeakPolarHBondContact O-CB 3.47Å; L400-L404 VanDerWaalsContact O-CG 3.3Å; L400-L404 WeakPolarHBondContact O-CG 3.47Å; L400-L404 PolarHBondContact O-N 3.03Å; L404-G408 PolarHBondContact O-N 3.04Å
405L93.9Very high91.6Very high0 Ų029.8 Ų29.80%016%0.163CC..Hα-helixtrans-72.6-37.6179.4-161.854.2000111.9C287 V288 I291 Y295 A359 Q401 Y402 I403 G408 E409C287-L405 WeakPolarHBondContact O-CD2 3.33Å; V288-L405 HydrophobicContact CB-CD1 4.46Å; V288-L405 HydrophobicContact CG2-CD1 3.89Å; V288-L405 HydrophobicContact CG2-CG 4.39Å; I291-L405 HydrophobicContact CD1-CB 4.21Å; I291-L405 HydrophobicContact CD1-CD2 3.57Å; I291-L405 HydrophobicContact CD1-CG 3.91Å; I291-L405 HydrophobicContact CG1-CD2 3.6Å; I291-L405 HydrophobicContact CG1-CG 4.47Å; Y295-L405 HydrophobicContact CD2-CD2 4.43Å; Y295-L405 HydrophobicContact CE2-CD2 3.74Å; A359-L405 HydrophobicContact CB-CD1 3.92Å; Q401-L405 WeakPolarHBondContact O-CB 3.12Å; Q401-L405 PolarHBondContact O-N 3.06Å; Y402-L405 PolarHBondContact O-N 2.96Å; I403-L405 VanDerWaalsContact C-N 3.27Å; I403-L405 PolarHBondContact O-N 3.32Å; L405-G408 PolarHBondContact O-N 3.48Å; L405-E409 PolarHBondContact O-N 3.49Å
406G91.3Very high91.3Very high0 Ų029.8 Ų29.80%016%0.163CC..Hα-helixtrans-60.5-45.3171.700000113.1S320 Y402 I403 G408 E409 A410S320-G406 WeakPolarHBondContact O-CA 3.41Å; Y402-G406 PolarHBondContact O-N 3.25Å; I403-G406 PolarHBondContact O-N 2.82Å; G406-G408 VanDerWaalsContact C-N 3.33Å; G406-G408 PolarHBondContact O-N 3.19Å; G406-E409 PolarHBondContact O-N 3.08Å; G406-A410 WeakPolarHBondContact O-CB 3.3Å; G406-A410 PolarHBondContact O-N 3.38Å
407V91.9Very high90.9Very high38 Ų3827.2 Ų27.223%0.2316%0.156CC..Hα-helixtrans-58.4-47171.4170.90000110.1P323 L327 I403 E409 A410 L411P323-V407 HydrophobicContact CB-CG2 3.66Å; P323-V407 HydrophobicContact CG-CG2 4.19Å; L327-V407 HydrophobicContact CD2-CG1 3.97Å; I403-V407 HydrophobicContact CG2-CG2 4.39Å; I403-V407 WeakPolarHBondContact O-CG2 3.49Å; I403-V407 PolarHBondContact O-N 3.04Å; V407-E409 VanDerWaalsContact C-N 3.33Å; V407-E409 PolarHBondContact O-N 3.5Å; V407-A410 PolarHBondContact O-N 3.07Å; V407-L411 HydrophobicContact CG1-CD1 3.97Å; V407-L411 HydrophobicContact CG1-CG 4.45Å; V407-L411 VanDerWaalsContact O-CG 3.3Å; V407-L411 WeakPolarHBondContact O-CG 3.47Å; V407-L411 PolarHBondContact O-N 3.32Å; V407-L411 VanDerWaalsContact O-N 3.11Å
408G92.4Very high90.3Very high0 Ų026.4 Ų26.40%015%0.154CC..Hα-helixtrans-55.3-47.1176.800000112.5Y284 L404 L405 G406 L411 V412Y284-G408 PolarHBondContact OH-O 3.12Å; Y284-G408 VanDerWaalsContact OH-O 3.08Å; L404-G408 PolarHBondContact O-N 3.04Å; L405-G408 PolarHBondContact O-N 3.48Å; G406-G408 VanDerWaalsContact C-N 3.33Å; G406-G408 PolarHBondContact O-N 3.19Å; G408-L411 PolarHBondContact O-N 3.17Å; G408-V412 WeakPolarHBondContact O-CB 3.38Å; G408-V412 VanDerWaalsContact O-CG2 3.26Å; G408-V412 WeakPolarHBondContact O-CG2 3.5Å; G408-V412 PolarHBondContact O-N 3.06Å
409E88.9Confident89.7Confident49 Ų4926.8 Ų26.823%0.22916%0.156CC..Hα-helixtrans-65.8-39.3-178.6-174.4156.9-144.300112.7Y284 R285 L405 G406 V407 L411 T413Y284-E409 WeakPolarHBondContact OH-CA 3.28Å; Y284-E409 PolarHBondContact OH-N 3.44Å; R285-E409 IonicContact CZ-OE1 2.84Å; R285-E409 IonicContact NH1-OE1 3.46Å; R285-E409 PolarHBondContact NH1-OE1 2.87Å; L405-E409 PolarHBondContact O-N 3.49Å; G406-E409 PolarHBondContact O-N 3.08Å; V407-E409 VanDerWaalsContact C-N 3.33Å; V407-E409 PolarHBondContact O-N 3.5Å; E409-L411 VanDerWaalsContact C-N 3.27Å; E409-L411 PolarHBondContact O-N 2.62Å; E409-T413 PolarHBondContact O-N 3.43Å; E409-T413 PolarHBondContact O-OG1 2.98Å
410A86Confident89.1Confident16 Ų1625.9 Ų25.913%0.13215%0.148CC..Hα-helixtrans-62.2-32.5174.900000113.1L324 L327 G406 V407 P414L324-A410 HydrophobicContact CB-CB 4.39Å; L324-A410 VanDerWaalsContact CD1-CA 3.48Å; L324-A410 HydrophobicContact CD1-CB 3.62Å; L327-A410 HydrophobicContact CB-CB 4.22Å; L327-A410 HydrophobicContact CD2-CB 3.9Å; G406-A410 WeakPolarHBondContact O-CB 3.3Å; G406-A410 PolarHBondContact O-N 3.38Å; V407-A410 PolarHBondContact O-N 3.07Å; A410-P414 VanDerWaalsContact O-CD 3.24Å; A410-P414 WeakPolarHBondContact O-CD 3.4Å; A410-P414 WeakPolarHBondContact O-CG 3.47Å
411L87.4Confident88.1Confident11 Ų1124.3 Ų24.36%0.05814%0.138CC..Hα-helixtrans-85.4-45179.5-66.2179000113L327 M331 V351 L354 V407 G408 E409 S415L327-L411 HydrophobicContact CD2-CD2 3.71Å; L327-L411 HydrophobicContact CD2-CG 3.88Å; L327-L411 HydrophobicContact CG-CD2 4.45Å; M331-L411 HydrophobicContact CE-CD2 4.18Å; M331-L411 HydrophobicContact CG-CD2 4.35Å; M331-L411 HydrophobicContact SD-CD2 4.05Å; V351-L411 HydrophobicContact CG1-CB 3.76Å; V351-L411 HydrophobicContact CG1-CD2 3.86Å; V351-L411 HydrophobicContact CG1-CG 4.3Å; L354-L411 HydrophobicContact CD2-CD1 3.96Å; L354-L411 HydrophobicContact CG-CD1 4.06Å; V407-L411 HydrophobicContact CG1-CD1 3.97Å; V407-L411 HydrophobicContact CG1-CG 4.45Å; V407-L411 VanDerWaalsContact O-CG 3.3Å; V407-L411 WeakPolarHBondContact O-CG 3.47Å; V407-L411 PolarHBondContact O-N 3.32Å; V407-L411 VanDerWaalsContact O-N 3.11Å; G408-L411 PolarHBondContact O-N 3.17Å; E409-L411 VanDerWaalsContact C-N 3.27Å; E409-L411 PolarHBondContact O-N 2.62Å; L411-S415 WeakPolarHBondContact O-CB 3.25Å; L411-S415 PolarHBondContact O-OG 2.93Å
412V90.4Very high87.2Confident0 Ų029.2 Ų29.20%016%0.161CC..Hα-helixtrans-78.2-46.8-169173.50000112.1Y284 I352 G408 S415 C416Y284-V412 HydrophobicContact CD1-CG1 3.86Å; Y284-V412 HydrophobicContact CE1-CB 3.82Å; Y284-V412 HydrophobicContact CE1-CG1 3.53Å; Y284-V412 HydrophobicContact CE1-CG2 4.2Å; Y284-V412 HydrophobicContact CE2-CB 4.39Å; Y284-V412 HydrophobicContact CE2-CG2 3.88Å; I352-V412 HydrophobicContact CG2-CG1 4.26Å; I352-V412 HydrophobicContact CG2-CG2 4.44Å; G408-V412 WeakPolarHBondContact O-CB 3.38Å; G408-V412 VanDerWaalsContact O-CG2 3.26Å; G408-V412 WeakPolarHBondContact O-CG2 3.5Å; G408-V412 PolarHBondContact O-N 3.06Å; V412-S415 PolarHBondContact O-N 3.21Å; V412-C416 WeakPolarHBondContact O-CB 3.43Å; V412-C416 PolarHBondContact O-N 3.19Å; V412-C416 PolarHBondContact O-SG 3.22Å
413T85.3Confident86.5Confident41 Ų4131 Ų3125%0.25217%0.17SC..Hα-helixtrans-63.6-51-171.5-59.10000112.1E409 S415 C416 A417 Y440E409-T413 PolarHBondContact O-N 3.43Å; E409-T413 PolarHBondContact O-OG1 2.98Å; T413-S415 VanDerWaalsContact C-N 3.31Å; T413-S415 PolarHBondContact O-N 2.87Å; T413-C416 PolarHBondContact O-N 3.44Å; T413-A417 PolarHBondContact O-N 3.47Å; T413-Y440 HydrophobicContact CG2-CE2 4.2Å
414P82.5Confident85.8Confident74 Ų7427.8 Ų27.848%0.48115%0.154SC..Hα-helixtrans-62.8-38.2176.6-22.536.2000112.4A410 A417 L418A410-P414 VanDerWaalsContact O-CD 3.24Å; A410-P414 WeakPolarHBondContact O-CD 3.4Å; A410-P414 WeakPolarHBondContact O-CG 3.47Å; P414-A417 PolarHBondContact O-N 3.41Å; P414-L418 WeakPolarHBondContact O-CB 3.5Å; P414-L418 PolarHBondContact O-N 3.1Å
415S84.9Confident84.9Confident13 Ų1328.3 Ų28.39%0.09116%0.159CC..Hα-helixtrans-67.6-40.1-179.5-62.80000112.7V351 I352 L411 V412 T413 L418 I419V351-S415 WeakPolarHBondContact CG1-OG 3.32Å; I352-S415 VanDerWaalsContact CG1-CB 3.48Å; L411-S415 WeakPolarHBondContact O-CB 3.25Å; L411-S415 PolarHBondContact O-OG 2.93Å; V412-S415 PolarHBondContact O-N 3.21Å; T413-S415 VanDerWaalsContact C-N 3.31Å; T413-S415 PolarHBondContact O-N 2.87Å; S415-L418 PolarHBondContact O-N 3.45Å; S415-I419 WeakPolarHBondContact O-CG1 3.32Å; S415-I419 PolarHBondContact O-N 3.35Å
416C86.2Confident83.8Confident0 Ų031.8 Ų31.80%018%0.183CC..Hα-helixtrans-63.5-42.6175-72.50000111.7Q281 V412 T413 S420 L436Q281-C416 VanDerWaalsContact CD-SG 3.53Å; V412-C416 WeakPolarHBondContact O-CB 3.43Å; V412-C416 PolarHBondContact O-N 3.19Å; V412-C416 PolarHBondContact O-SG 3.22Å; T413-C416 PolarHBondContact O-N 3.44Å; C416-S420 WeakPolarHBondContact O-CB 3.12Å; C416-S420 PolarHBondContact O-N 2.74Å; C416-S420 VanDerWaalsContact O-N 3.14Å; C416-S420 PolarHBondContact O-OG 3.15Å; C416-L436 HydrophobicContact CB-CD1 4.12Å; C416-L436 HydrophobicContact CB-CD2 4.23Å
417A82.6Confident82.9Confident26 Ų2637 Ų3722%0.21521%0.207CC..Hα-helixtrans-60.3-51173.300000109.8T413 P414 I419 S420 F421 L436T413-A417 PolarHBondContact O-N 3.47Å; P414-A417 PolarHBondContact O-N 3.41Å; A417-I419 PolarHBondContact O-N 3.39Å; A417-S420 CarbonylContact O-C 3.5Å; A417-S420 WeakPolarHBondContact O-CA 3.31Å; A417-S420 VanDerWaalsContact O-CB 3.31Å; A417-S420 WeakPolarHBondContact O-CB 3.4Å; A417-S420 PolarHBondContact O-N 2.84Å; A417-F421 HydrophobicContact CB-CD2 4.43Å; A417-F421 WeakPolarHBondContact O-CD2 3.37Å; A417-F421 PolarHBondContact O-N 3.4Å; A417-L436 HydrophobicContact CB-CD2 4.49Å
418L81.2Confident82.3Confident68 Ų6835.8 Ų35.836%0.35620%0.2SC..Hα-helixtrans-56.8-45.8-178.3-176.762.1000113.2P348 P414 S415 S420 F421 Q422P348-L418 HydrophobicContact CB-CD2 4.31Å; P348-L418 HydrophobicContact CG-CD2 3.7Å; P348-L418 HydrophobicContact CG-CG 4.43Å; P414-L418 WeakPolarHBondContact O-CB 3.5Å; P414-L418 PolarHBondContact O-N 3.1Å; S415-L418 PolarHBondContact O-N 3.45Å; L418-S420 VanDerWaalsContact C-N 3.31Å; L418-S420 PolarHBondContact O-N 2.83Å; L418-F421 PolarHBondContact O-N 3.07Å; L418-Q422 HydrophobicContact CD1-CG 4.27Å; L418-Q422 WeakPolarHBondContact O-CG 3.36Å; L418-Q422 PolarHBondContact O-N 2.96Å
419I83.4Confident81.6Confident8 Ų837.8 Ų37.84%0.04121%0.207CC..Hα-helixtrans-60.5-43.4175.7-68.3176.3000110.7L274 L277 P348 A349 I352 S415 A417 F421 Q422 L423 Y500L274-I419 HydrophobicContact CD2-CG2 4.1Å; L277-I419 HydrophobicContact CD2-CB 4.27Å; L277-I419 HydrophobicContact CD2-CG2 3.85Å; P348-I419 HydrophobicContact CB-CD1 4.13Å; P348-I419 HydrophobicContact CB-CG1 3.84Å; A349-I419 HydrophobicContact CB-CD1 4.27Å; I352-I419 HydrophobicContact CD1-CD1 3.52Å; S415-I419 WeakPolarHBondContact O-CG1 3.32Å; S415-I419 PolarHBondContact O-N 3.35Å; A417-I419 PolarHBondContact O-N 3.39Å; I419-F421 VanDerWaalsContact C-N 3.33Å; I419-F421 PolarHBondContact O-N 3.32Å; I419-Q422 PolarHBondContact O-N 3.46Å; I419-L423 HydrophobicContact CG2-CD1 3.65Å; I419-L423 HydrophobicContact CG2-CG 4.29Å; I419-L423 WeakPolarHBondContact O-CB 3.41Å; I419-L423 WeakPolarHBondContact O-CG 3.44Å; I419-L423 PolarHBondContact O-N 3Å; I419-Y500 HydrophobicContact CG2-CD1 4.3Å
420S81.7Confident81.1Confident0 Ų037.4 Ų37.40%022%0.216CC..Hα-helixtrans-61.7-42.4177.3-55.70000111.3Y278 C416 A417 L418 I424Y278-S420 WeakPolarHBondContact CE1-OG 3.34Å; Y278-S420 WeakPolarHBondContact OH-CB 3.32Å; Y278-S420 PolarHBondContact OH-OG 3.39Å; C416-S420 WeakPolarHBondContact O-CB 3.12Å; C416-S420 PolarHBondContact O-N 2.74Å; C416-S420 VanDerWaalsContact O-N 3.14Å; C416-S420 PolarHBondContact O-OG 3.15Å; A417-S420 CarbonylContact O-C 3.5Å; A417-S420 WeakPolarHBondContact O-CA 3.31Å; A417-S420 VanDerWaalsContact O-CB 3.31Å; A417-S420 WeakPolarHBondContact O-CB 3.4Å; A417-S420 PolarHBondContact O-N 2.84Å; L418-S420 VanDerWaalsContact C-N 3.31Å; L418-S420 PolarHBondContact O-N 2.83Å; S420-I424 WeakPolarHBondContact O-CB 3.5Å; S420-I424 WeakPolarHBondContact O-CG1 3.15Å; S420-I424 PolarHBondContact O-N 3.09Å
421F76.2Confident80.9Confident61 Ų6137.2 Ų37.227%0.26821%0.213SC..Hα-helixtrans-63.2-44.2175.5-87.5-85.6000112.3A417 L418 I419 R429 L433A417-F421 HydrophobicContact CB-CD2 4.43Å; A417-F421 WeakPolarHBondContact O-CD2 3.37Å; A417-F421 PolarHBondContact O-N 3.4Å; L418-F421 PolarHBondContact O-N 3.07Å; I419-F421 VanDerWaalsContact C-N 3.33Å; I419-F421 PolarHBondContact O-N 3.32Å; F421-R429 HydrophobicContact CD1-CG 3.88Å; F421-R429 HydrophobicContact CE1-CG 4.05Å; F421-R429 HydrophobicContact CG-CG 4.46Å; F421-R429 PolarHBondContact O-NE 3.41Å; F421-R429 VanDerWaalsContact O-NE 3.11Å; F421-R429 PolarHBondContact O-NH2 3.48Å; F421-L433 HydrophobicContact CD2-CD2 4.27Å; F421-L433 HydrophobicContact CE1-CD1 4.4Å; F421-L433 HydrophobicContact CE2-CD1 3.79Å; F421-L433 HydrophobicContact CE2-CD2 3.78Å; F421-L433 HydrophobicContact CE2-CG 4.33Å; F421-L433 HydrophobicContact CZ-CD1 3.56Å; F421-L433 HydrophobicContact CZ-CD2 4.42Å
422Q78.3Confident80.8Confident103 Ų10336.7 Ų36.748%0.48121%0.21SC..Hα-helixtrans-71.9-38.1-175.1-73.3177-4.600113.3L418 I419L418-Q422 HydrophobicContact CD1-CG 4.27Å; L418-Q422 WeakPolarHBondContact O-CG 3.36Å; L418-Q422 PolarHBondContact O-N 2.96Å; I419-Q422 PolarHBondContact O-N 3.46Å
423L80.4Confident80.5Confident38 Ų3839 Ų3920%0.19922%0.222CC..Hα-helixtrans-89.6-17-173.2-62.7-177.5000113.8V270 L274 I419 Y500 L503V270-L423 WeakPolarHBondContact CG1-O 3.42Å; L274-L423 HydrophobicContact CD2-CB 4.34Å; L274-L423 HydrophobicContact CD2-CD1 3.77Å; I419-L423 HydrophobicContact CG2-CD1 3.65Å; I419-L423 HydrophobicContact CG2-CG 4.29Å; I419-L423 WeakPolarHBondContact O-CB 3.41Å; I419-L423 WeakPolarHBondContact O-CG 3.44Å; I419-L423 PolarHBondContact O-N 3Å; L423-Y500 HydrophobicContact CD1-CD1 3.88Å; L423-L503 HydrophobicContact CD1-CB 4.47Å; L423-L503 HydrophobicContact CD1-CD1 4.38Å; L423-L503 HydrophobicContact CD2-CB 3.68Å
424I80.4Confident80.5Confident3 Ų340.4 Ų40.42%0.01523%0.226CC..SBendtrans-104.8129-174.2-60.1-74.6000110.9V270 L271 L274 S420 I428 R429V270-I424 HydrophobicContact CG1-CD1 4.04Å; L271-I424 HydrophobicContact CB-CD1 4.33Å; L271-I424 HydrophobicContact CD1-CD1 4.09Å; L274-I424 HydrophobicContact CD1-CD1 3.65Å; L274-I424 HydrophobicContact CD1-CG1 3.46Å; L274-I424 VanDerWaalsContact CD1-CG1 3.46Å; L274-I424 HydrophobicContact CG-CD1 4.31Å; S420-I424 WeakPolarHBondContact O-CB 3.5Å; S420-I424 WeakPolarHBondContact O-CG1 3.15Å; S420-I424 PolarHBondContact O-N 3.09Å; I424-I428 HydrophobicContact CG2-CB 4.3Å; I424-I428 HydrophobicContact CG2-CD1 3.76Å; I424-I428 HydrophobicContact CG2-CG1 3.58Å; I424-R429 HydrophobicContact CG2-CB 4.27Å
425P77.3Confident80.9Confident46 Ų4638.1 Ų38.130%0.29921%0.208SC..  trans-52.4148.2171.7-27.333.7000113.3H427 I428 R429P425-H427 WeakPolarHBondContact CB-CE1 3.17Å; P425-H427 WeakPolarHBondContact CB-ND1 3.4Å; P425-H427 PolarHBondContact O-N 3.48Å; P425-H427 VanDerWaalsContact O-N 3.1Å; P425-I428 HydrophobicContact CB-CG1 4.07Å; P425-I428 HydrophobicContact CG-CD1 4.31Å; P425-I428 HydrophobicContact CG-CG1 4.29Å; P425-I428 PolarHBondContact O-N 3.27Å; P425-I428 VanDerWaalsContact O-N 3.14Å; P425-R429 PolarHBondContact O-N 2.81Å
426S71.5Confident81Confident72 Ų7237.8 Ų37.850%0.50321%0.206SC..THydrogen-bonded Turntrans-57.4-31.9-171.861.30000114.5
427H72.8Confident81Confident109 Ų10940.1 Ų40.151%0.50522%0.22SC..THydrogen-bonded Turntrans-77.6-20.9-17861.4-74000114.7N267 P425N267-H427 VanDerWaalsContact CG-NE2 3.28Å; N267-H427 PolarHBondContact ND2-NE2 2.88Å; N267-H427 VanDerWaalsContact ND2-NE2 3.16Å; N267-H427 PolarHBondContact OD1-NE2 3.39Å; P425-H427 WeakPolarHBondContact CB-CE1 3.17Å; P425-H427 WeakPolarHBondContact CB-ND1 3.4Å; P425-H427 PolarHBondContact O-N 3.48Å; P425-H427 VanDerWaalsContact O-N 3.1Å
428I79Confident81.4Confident13 Ų1341.1 Ų41.17%0.06722%0.222CC..THydrogen-bonded Turntrans-113.95.1179.349.6153.2000113.4N267 I424 P425 G430 I431 S432N267-I428 HydrophobicContact CB-CD1 3.93Å; N267-I428 HydrophobicContact CB-CG2 4.11Å; N267-I428 WeakPolarHBondContact O-CD1 3.34Å; I424-I428 HydrophobicContact CG2-CB 4.3Å; I424-I428 HydrophobicContact CG2-CD1 3.76Å; I424-I428 HydrophobicContact CG2-CG1 3.58Å; P425-I428 HydrophobicContact CB-CG1 4.07Å; P425-I428 HydrophobicContact CG-CD1 4.31Å; P425-I428 HydrophobicContact CG-CG1 4.29Å; P425-I428 PolarHBondContact O-N 3.27Å; P425-I428 VanDerWaalsContact O-N 3.14Å; I428-G430 PolarHBondContact O-N 3.43Å; I428-I431 HydrophobicContact CB-CD1 4.5Å; I428-I431 HydrophobicContact CG2-CD1 4.18Å; I428-I431 WeakPolarHBondContact O-CB 3.39Å; I428-I431 PolarHBondContact O-N 3.02Å; I428-S432 PolarHBondContact O-N 3.38Å; I428-S432 VanDerWaalsContact O-N 3.11Å
429R77.5Confident81.9Confident42 Ų4238.4 Ų38.416%0.15821%0.208CC..Hα-helixtrans-63-38.6-178.8-163.7176.7-101.9-178.34.3113.1F421 I424 P425 I431 S432 L433F421-R429 HydrophobicContact CD1-CG 3.88Å; F421-R429 HydrophobicContact CE1-CG 4.05Å; F421-R429 HydrophobicContact CG-CG 4.46Å; F421-R429 PolarHBondContact O-NE 3.41Å; F421-R429 VanDerWaalsContact O-NE 3.11Å; F421-R429 PolarHBondContact O-NH2 3.48Å; I424-R429 HydrophobicContact CG2-CB 4.27Å; P425-R429 PolarHBondContact O-N 2.81Å; R429-I431 VanDerWaalsContact C-N 3.34Å; R429-I431 PolarHBondContact O-N 3Å; R429-S432 WeakPolarHBondContact O-CB 3.26Å; R429-S432 PolarHBondContact O-N 2.88Å; R429-L433 WeakPolarHBondContact O-CG 3.42Å; R429-L433 PolarHBondContact O-N 2.88Å
430G77.7Confident82.3Confident41 Ų4139.2 Ų39.242%0.42321%0.211SC..Hα-helixtrans-60.8-42.3174.400000112.4I428 S432 L433 H434I428-G430 PolarHBondContact O-N 3.43Å; G430-S432 PolarHBondContact O-N 2.9Å; G430-L433 PolarHBondContact O-N 2.84Å; G430-H434 PolarHBondContact O-CD2 2.97Å; G430-H434 PolarHBondContact O-N 3.28Å
431I83.1Confident82.8Confident13 Ų1339.2 Ų39.27%0.06721%0.211CC..Hα-helixtrans-61.1-45.4175.8-66.4164.3000110.7L220 T223 L271 I428 R429 L433 H434 F435L220-I431 HydrophobicContact CD2-CB 4.32Å; L220-I431 HydrophobicContact CD2-CG1 4.31Å; L220-I431 HydrophobicContact CD2-CG2 3.85Å; L220-I431 HydrophobicContact CG-CG1 4.5Å; T223-I431 HydrophobicContact CG2-CG2 4.1Å; L271-I431 HydrophobicContact CD2-CG2 3.98Å; I428-I431 HydrophobicContact CB-CD1 4.5Å; I428-I431 HydrophobicContact CG2-CD1 4.18Å; I428-I431 WeakPolarHBondContact O-CB 3.39Å; I428-I431 PolarHBondContact O-N 3.02Å; R429-I431 VanDerWaalsContact C-N 3.34Å; R429-I431 PolarHBondContact O-N 3Å; I431-L433 VanDerWaalsContact C-N 3.34Å; I431-L433 PolarHBondContact O-N 3.35Å; I431-H434 WeakPolarHBondContact O-CB 3.38Å; I431-H434 PolarHBondContact O-N 3.28Å; I431-F435 HydrophobicContact CG2-CD2 3.9Å; I431-F435 HydrophobicContact CG2-CE2 3.72Å; I431-F435 VanDerWaalsContact O-CD2 3.29Å; I431-F435 WeakPolarHBondContact O-CD2 3.33Å; I431-F435 PolarHBondContact O-N 3.32Å
432S84.4Confident83.7Confident0 Ų037.3 Ų37.30%021%0.208CC..Hα-helixtrans-58.3-43.4176166.80000112.6Y278 I428 R429 G430 H434 F435 L436Y278-S432 PolarHBondContact OH-O 2.9Å; Y278-S432 PolarHBondContact OH-OG 3.39Å; I428-S432 PolarHBondContact O-N 3.38Å; I428-S432 VanDerWaalsContact O-N 3.11Å; R429-S432 WeakPolarHBondContact O-CB 3.26Å; R429-S432 PolarHBondContact O-N 2.88Å; G430-S432 PolarHBondContact O-N 2.9Å; S432-H434 VanDerWaalsContact C-N 3.34Å; S432-H434 PolarHBondContact O-N 2.91Å; S432-F435 PolarHBondContact O-N 3.48Å; S432-L436 PolarHBondContact O-N 2.63Å
433L83.8Confident84.6Confident48 Ų4832.4 Ų32.425%0.25119%0.185SC..Hα-helixtrans-66.4-35.3176.6-66.2173.2000112.4F421 R429 G430 I431 F435 L436 T437F421-L433 HydrophobicContact CD2-CD2 4.27Å; F421-L433 HydrophobicContact CE1-CD1 4.4Å; F421-L433 HydrophobicContact CE2-CD1 3.79Å; F421-L433 HydrophobicContact CE2-CD2 3.78Å; F421-L433 HydrophobicContact CE2-CG 4.33Å; F421-L433 HydrophobicContact CZ-CD1 3.56Å; F421-L433 HydrophobicContact CZ-CD2 4.42Å; R429-L433 WeakPolarHBondContact O-CG 3.42Å; R429-L433 PolarHBondContact O-N 2.88Å; G430-L433 PolarHBondContact O-N 2.84Å; I431-L433 VanDerWaalsContact C-N 3.34Å; I431-L433 PolarHBondContact O-N 3.35Å; L433-F435 VanDerWaalsContact C-N 3.35Å; L433-L436 HydrophobicContact CD2-CD2 4.49Å; L433-L436 WeakPolarHBondContact O-CB 3.08Å; L433-L436 PolarHBondContact O-N 3.16Å; L433-T437 PolarHBondContact O-N 3.32Å; L433-T437 PolarHBondContact O-OG1 2.94Å; L433-T437 VanDerWaalsContact O-OG1 3.13Å
434H86.5Confident85.3Confident71 Ų7130.8 Ų30.833%0.32918%0.177SC..Hα-helixtrans-61.5-42.2171.6-71.5-55.8000112V60 L220 G430 I431 S432 L436 T437 L438V60-H434 HydrophobicContact CG1-CB 3.92Å; V60-H434 HydrophobicContact CG2-CB 4.31Å; L220-H434 HydrophobicContact CD1-CB 4.21Å; L220-H434 HydrophobicContact CD2-CB 3.89Å; G430-H434 PolarHBondContact O-CD2 2.97Å; G430-H434 PolarHBondContact O-N 3.28Å; I431-H434 WeakPolarHBondContact O-CB 3.38Å; I431-H434 PolarHBondContact O-N 3.28Å; S432-H434 VanDerWaalsContact C-N 3.34Å; S432-H434 PolarHBondContact O-N 2.91Å; H434-L436 VanDerWaalsContact C-N 3.32Å; H434-L436 PolarHBondContact O-N 2.8Å; H434-T437 PolarHBondContact O-N 3.16Å; H434-L438 WeakPolarHBondContact O-CB 3.31Å; H434-L438 VanDerWaalsContact O-CG 3.28Å; H434-L438 WeakPolarHBondContact O-CG 3.38Å; H434-L438 PolarHBondContact O-N 3.36Å
435F89.4Confident86.1Confident25 Ų2534 Ų3411%0.1119%0.194CC..Hα-helixtrans-63.4-36.8174-82.7-76.2000112.9L220 T223 L224 L271 F275 Y278 I431 S432 L433 L438 S439L220-F435 HydrophobicContact CD2-CE2 4.36Å; T223-F435 HydrophobicContact CG2-CE2 4.09Å; T223-F435 HydrophobicContact CG2-CZ 4.49Å; L224-F435 HydrophobicContact CD2-CE1 3.89Å; L224-F435 HydrophobicContact CD2-CZ 3.74Å; L224-F435 HydrophobicContact CG-CZ 4.07Å; L271-F435 HydrophobicContact CD1-CD2 4.49Å; L271-F435 HydrophobicContact CD2-CD2 3.78Å; L271-F435 HydrophobicContact CD2-CE2 3.69Å; F275-F435 HydrophobicContact CE1-CD1 4Å; F275-F435 HydrophobicContact CE1-CE1 4.28Å; F275-F435 HydrophobicContact CE1-CG 4.14Å; F275-F435 HydrophobicContact CZ-CD1 4.3Å; F275-F435 HydrophobicContact CZ-CE1 4.11Å; F275-F435 HydrophobicContact CZ-CZ 4.36Å; Y278-F435 HydrophobicContact CD2-CB 4.07Å; Y278-F435 HydrophobicContact CE2-CB 3.91Å; I431-F435 HydrophobicContact CG2-CD2 3.9Å; I431-F435 HydrophobicContact CG2-CE2 3.72Å; I431-F435 VanDerWaalsContact O-CD2 3.29Å; I431-F435 WeakPolarHBondContact O-CD2 3.33Å; I431-F435 PolarHBondContact O-N 3.32Å; S432-F435 PolarHBondContact O-N 3.48Å; L433-F435 VanDerWaalsContact C-N 3.35Å; F435-L438 HydrophobicContact CD1-CD1 4.32Å; F435-L438 PolarHBondContact O-N 3.41Å; F435-S439 PolarHBondContact O-N 3.28Å
436L88.2Confident87.1Confident7 Ų734.6 Ų34.64%0.03719%0.194CC..Hα-helixtrans-65.1-42.2173-178.861.8000111.8Y278 C416 A417 S432 L433 H434 L438 S439 Y440Y278-L436 HydrophobicContact CD1-CB 4.46Å; Y278-L436 HydrophobicContact CD1-CD1 3.73Å; Y278-L436 HydrophobicContact CE1-CB 4.04Å; Y278-L436 HydrophobicContact CE1-CD1 3.78Å; Y278-L436 HydrophobicContact CE1-CG 4.39Å; C416-L436 HydrophobicContact CB-CD1 4.12Å; C416-L436 HydrophobicContact CB-CD2 4.23Å; A417-L436 HydrophobicContact CB-CD2 4.49Å; S432-L436 PolarHBondContact O-N 2.63Å; L433-L436 HydrophobicContact CD2-CD2 4.49Å; L433-L436 WeakPolarHBondContact O-CB 3.08Å; L433-L436 PolarHBondContact O-N 3.16Å; H434-L436 VanDerWaalsContact C-N 3.32Å; H434-L436 PolarHBondContact O-N 2.8Å; L436-L438 VanDerWaalsContact C-N 3.34Å; L436-S439 PolarHBondContact O-N 3.49Å; L436-S439 PolarHBondContact O-OG 2.85Å; L436-Y440 HydrophobicContact CD1-CE1 3.84Å; L436-Y440 HydrophobicContact CD1-CE2 4.37Å; L436-Y440 HydrophobicContact CG-CE1 4.42Å; L436-Y440 HydrophobicContact CG-CE2 4.08Å; L436-Y440 PolarHBondContact O-N 2.91Å; L436-Y440 VanDerWaalsContact O-N 3.13Å
437T86.4Confident88.2Confident48 Ų4831.2 Ų31.229%0.29417%0.171SC..Hα-helixtrans-64.7-39.3173.9-56.50000111.8T56 V60 L433 H434 S439 Y440 G441T56-T437 HydrophobicContact CG2-CG2 4.08Å; T56-T437 WeakPolarHBondContact O-CG2 3.25Å; V60-T437 HydrophobicContact CG2-CG2 4.11Å; L433-T437 PolarHBondContact O-N 3.32Å; L433-T437 PolarHBondContact O-OG1 2.94Å; L433-T437 VanDerWaalsContact O-OG1 3.13Å; H434-T437 PolarHBondContact O-N 3.16Å; T437-S439 VanDerWaalsContact C-N 3.3Å; T437-S439 PolarHBondContact O-N 3.42Å; T437-Y440 PolarHBondContact O-N 3.4Å; T437-G441 PolarHBondContact O-N 2.84Å
438L91.1Very high89.4Confident48 Ų4826.2 Ų26.225%0.25115%0.148SC..Hα-helixtrans-61.5-38.2174.4-73.2173.3000111.7L57 V60 H434 F435 L436 G442L57-L438 HydrophobicContact CD2-CB 4.44Å; L57-L438 HydrophobicContact CD2-CD2 3.56Å; V60-L438 HydrophobicContact CB-CD2 4.1Å; V60-L438 HydrophobicContact CB-CG 4.41Å; V60-L438 HydrophobicContact CG1-CD1 4.23Å; V60-L438 HydrophobicContact CG1-CD2 4.16Å; V60-L438 HydrophobicContact CG1-CG 4.16Å; V60-L438 HydrophobicContact CG2-CD2 4.24Å; V60-L438 HydrophobicContact CG2-CG 4.24Å; H434-L438 WeakPolarHBondContact O-CB 3.31Å; H434-L438 VanDerWaalsContact O-CG 3.28Å; H434-L438 WeakPolarHBondContact O-CG 3.38Å; H434-L438 PolarHBondContact O-N 3.36Å; F435-L438 HydrophobicContact CD1-CD1 4.32Å; F435-L438 PolarHBondContact O-N 3.41Å; L436-L438 VanDerWaalsContact C-N 3.34Å; L438-G442 WeakPolarHBondContact O-CA 3.37Å; L438-G442 PolarHBondContact O-N 3.16Å
439S91.7Very high90.2Very high10 Ų1031.5 Ų31.57%0.0717%0.171CC..Hα-helixtrans-68.7-33.9175.374.90000112.2L282 F435 L436 T437 G443L282-S439 VanDerWaalsContact CD2-O 3.22Å; L282-S439 WeakPolarHBondContact CD2-O 3.19Å; F435-S439 PolarHBondContact O-N 3.28Å; L436-S439 PolarHBondContact O-N 3.49Å; L436-S439 PolarHBondContact O-OG 2.85Å; T437-S439 VanDerWaalsContact C-N 3.3Å; T437-S439 PolarHBondContact O-N 3.42Å; S439-G443 PolarHBondContact O-N 3.37Å
440Y91.3Very high91Very high25 Ų2530.6 Ų30.610%0.09817%0.169CC..Hα-helixtrans-66.4-49.2172.5-62.7-19.6000112.2Q281 R285 T413 L436 T437 G442 G443 C444Q281-Y440 HydrophobicContact CB-CE1 4.3Å; R285-Y440 WeakPolarHBondContact CG-O 3.49Å; T413-Y440 HydrophobicContact CG2-CE2 4.2Å; L436-Y440 HydrophobicContact CD1-CE1 3.84Å; L436-Y440 HydrophobicContact CD1-CE2 4.37Å; L436-Y440 HydrophobicContact CG-CE1 4.42Å; L436-Y440 HydrophobicContact CG-CE2 4.08Å; L436-Y440 PolarHBondContact O-N 2.91Å; L436-Y440 VanDerWaalsContact O-N 3.13Å; T437-Y440 PolarHBondContact O-N 3.4Å; Y440-G442 VanDerWaalsContact C-N 3.35Å; Y440-G442 PolarHBondContact O-N 3Å; Y440-G443 PolarHBondContact O-N 3.36Å; Y440-C444 PolarHBondContact O-N 3.32Å; Y440-C444 PolarHBondContact O-SG 2.87Å; Y440-C444 VanDerWaalsContact O-SG 3.39Å
441G92.1Very high91.8Very high0 Ų028.7 Ų28.70%015%0.149CC..Hα-helixtrans-63.5-40.7177.200000112.8T437 G443 C444 L445T437-G441 PolarHBondContact O-N 2.84Å; G441-G443 VanDerWaalsContact C-N 3.31Å; G441-G443 PolarHBondContact O-N 3.24Å; G441-C444 WeakPolarHBondContact O-CB 3.35Å; G441-C444 PolarHBondContact O-N 3.26Å; G441-L445 PolarHBondContact O-N 3.49Å
442G95.3Very high92.2Very high21 Ų2131.4 Ų31.422%0.21616%0.162CC..Hα-helixtrans-64.3-33.3174.800000113L438 Y440 L445 L446L438-G442 WeakPolarHBondContact O-CA 3.37Å; L438-G442 PolarHBondContact O-N 3.16Å; Y440-G442 VanDerWaalsContact C-N 3.35Å; Y440-G442 PolarHBondContact O-N 3Å; G442-L445 PolarHBondContact O-N 3.4Å; G442-L446 WeakPolarHBondContact O-CB 3.35Å; G442-L446 PolarHBondContact O-N 3.11Å
443G96.3Very high92.5Very high0 Ų035.1 Ų35.10%018%0.181CC..Hα-helixtrans-64.1-37.4174.100000112.9V286 S439 Y440 G441 L446 G447V286-G443 WeakPolarHBondContact CG2-O 3.38Å; S439-G443 PolarHBondContact O-N 3.37Å; Y440-G443 PolarHBondContact O-N 3.36Å; G441-G443 VanDerWaalsContact C-N 3.31Å; G441-G443 PolarHBondContact O-N 3.24Å; G443-L446 PolarHBondContact O-N 2.94Å; G443-G447 PolarHBondContact O-N 3.48Å
444C96.1Very high92.8Very high4 Ų433.6 Ų33.63%0.02717%0.174CC..Hα-helixtrans-64.4-44.4173.8-56.30000111.8T289 Y440 G441 G447 A448T289-C444 HydrophobicContact CG2-CB 4.28Å; T289-C444 VanDerWaalsContact CG2-SG 3.57Å; Y440-C444 PolarHBondContact O-N 3.32Å; Y440-C444 PolarHBondContact O-SG 2.87Å; Y440-C444 VanDerWaalsContact O-SG 3.39Å; G441-C444 WeakPolarHBondContact O-CB 3.35Å; G441-C444 PolarHBondContact O-N 3.26Å; C444-G447 PolarHBondContact O-N 2.96Å; C444-A448 PolarHBondContact O-N 2.99Å
445L97Very high92.8Very high70 Ų7033.4 Ų33.437%0.36617%0.173SC..Hα-helixtrans-66.4-37.5176.1-62.6-176.6000112.1C50 L57 G441 G442 G447 A448 F449C50-L445 HydrophobicContact CB-CD2 4.5Å; L57-L445 HydrophobicContact CD1-CD1 3.54Å; L57-L445 HydrophobicContact CD1-CG 4.34Å; G441-L445 PolarHBondContact O-N 3.49Å; G442-L445 PolarHBondContact O-N 3.4Å; L445-G447 VanDerWaalsContact C-N 3.27Å; L445-G447 PolarHBondContact O-N 2.89Å; L445-A448 WeakPolarHBondContact O-CB 3.43Å; L445-A448 PolarHBondContact O-N 3.3Å; L445-F449 WeakPolarHBondContact O-CB 3.33Å; L445-F449 PolarHBondContact O-N 3.47Å
446L97.4Very high92.6Very high59 Ų5940.2 Ų40.231%0.30920%0.203SC..Hα-helixtrans-62.1-38.1172.4-179.163000110.9L282 V286 G442 G443 F449 I450L282-L446 HydrophobicContact CB-CD2 3.95Å; V286-L446 HydrophobicContact CG2-CB 4.11Å; V286-L446 HydrophobicContact CG2-CD2 4Å; V286-L446 HydrophobicContact CG2-CG 3.94Å; G442-L446 WeakPolarHBondContact O-CB 3.35Å; G442-L446 PolarHBondContact O-N 3.11Å; G443-L446 PolarHBondContact O-N 2.94Å; L446-F449 HydrophobicContact CD1-CD1 4.31Å; L446-F449 PolarHBondContact O-N 2.72Å; L446-I450 HydrophobicContact CD1-CD1 4.25Å; L446-I450 HydrophobicContact CD1-CG1 4.34Å; L446-I450 HydrophobicContact CG-CD1 3.96Å; L446-I450 HydrophobicContact CG-CG1 4.46Å; L446-I450 WeakPolarHBondContact O-CB 3.3Å; L446-I450 VanDerWaalsContact O-CG1 3.28Å; L446-I450 WeakPolarHBondContact O-CG1 3.31Å; L446-I450 PolarHBondContact O-N 2.85Å
447G96.1Very high92.5Very high1 Ų144.3 Ų44.31%0.0123%0.231CC..Hα-helixtrans-63-46.8174.700000112.2G443 C444 L445 F449 I450 I451G443-G447 PolarHBondContact O-N 3.48Å; C444-G447 PolarHBondContact O-N 2.96Å; L445-G447 VanDerWaalsContact C-N 3.27Å; L445-G447 PolarHBondContact O-N 2.89Å; G447-F449 VanDerWaalsContact C-N 3.31Å; G447-F449 PolarHBondContact O-N 3.22Å; G447-I450 PolarHBondContact O-N 2.86Å; G447-I451 WeakPolarHBondContact O-CG1 3.31Å; G447-I451 PolarHBondContact O-N 3Å
448A96.5Very high92.1Very high4 Ų442.9 Ų42.93%0.03322%0.223CC..Hα-helixtrans-57.3-44.8173.200000111.7T46 L49 C444 L445 I451 Q452T46-A448 HydrophobicContact CG2-CB 4.08Å; L49-A448 HydrophobicContact CB-CB 3.95Å; L49-A448 HydrophobicContact CD1-CB 4.45Å; C444-A448 PolarHBondContact O-N 2.99Å; L445-A448 WeakPolarHBondContact O-CB 3.43Å; L445-A448 PolarHBondContact O-N 3.3Å; A448-I451 PolarHBondContact O-N 3.45Å; A448-Q452 WeakPolarHBondContact O-CG 3.28Å; A448-Q452 PolarHBondContact O-N 3.43Å; A448-Q452 VanDerWaalsContact O-N 3.1Å
449F96.3Very high90.8Very high124 Ų12442 Ų4254%0.54423%0.226SC..Hα-helixtrans-62.4-45176.4175.7-100.8000112.6L445 L446 G447 I451 Q452 L453L445-F449 WeakPolarHBondContact O-CB 3.33Å; L445-F449 PolarHBondContact O-N 3.47Å; L446-F449 HydrophobicContact CD1-CD1 4.31Å; L446-F449 PolarHBondContact O-N 2.72Å; G447-F449 VanDerWaalsContact C-N 3.31Å; G447-F449 PolarHBondContact O-N 3.22Å; F449-I451 PolarHBondContact O-N 3.36Å; F449-Q452 PolarHBondContact O-N 3.31Å; F449-L453 HydrophobicContact CE1-CB 4.5Å; F449-L453 HydrophobicContact CE1-CD2 3.98Å; F449-L453 HydrophobicContact CZ-CD2 4.32Å; F449-L453 VanDerWaalsContact O-CB 3.25Å; F449-L453 WeakPolarHBondContact O-CB 3.37Å; F449-L453 PolarHBondContact O-N 3Å
450I94.8Very high88.9Confident24 Ų2447.2 Ų47.212%0.12327%0.269CS..Hα-helixtrans-63.1-41.5178.6-71.5168.5000110.9V286 L446 G447 L453 V454 F478V286-I450 HydrophobicContact CG1-CD1 4.16Å; V286-I450 HydrophobicContact CG2-CD1 4.2Å; L446-I450 HydrophobicContact CD1-CD1 4.25Å; L446-I450 HydrophobicContact CD1-CG1 4.34Å; L446-I450 HydrophobicContact CG-CD1 3.96Å; L446-I450 HydrophobicContact CG-CG1 4.46Å; L446-I450 WeakPolarHBondContact O-CB 3.3Å; L446-I450 VanDerWaalsContact O-CG1 3.28Å; L446-I450 WeakPolarHBondContact O-CG1 3.31Å; L446-I450 PolarHBondContact O-N 2.85Å; G447-I450 PolarHBondContact O-N 2.86Å; I450-L453 PolarHBondContact O-N 3.43Å; I450-V454 HydrophobicContact CG2-CG2 4.2Å; I450-V454 WeakPolarHBondContact O-CB 3.44Å; I450-V454 VanDerWaalsContact O-CG2 3.26Å; I450-V454 WeakPolarHBondContact O-CG2 3.41Å; I450-V454 PolarHBondContact O-N 3.43Å; I450-F478 HydrophobicContact CG2-CE2 4.09Å
451I93.1Very high86.7Confident0 Ų056 Ų560%031%0.308CS..Hα-helixtrans-58.6-50175.8-72172.5000110.5V42 A45 L49 G447 A448 F449 V454 H455 Y466 F478V42-I451 HydrophobicContact CG1-CG2 3.78Å; A45-I451 HydrophobicContact CB-CD1 4.22Å; L49-I451 HydrophobicContact CD1-CD1 3.7Å; G447-I451 WeakPolarHBondContact O-CG1 3.31Å; G447-I451 PolarHBondContact O-N 3Å; A448-I451 PolarHBondContact O-N 3.45Å; F449-I451 PolarHBondContact O-N 3.36Å; I451-V454 PolarHBondContact O-N 3.12Å; I451-H455 WeakPolarHBondContact O-CB 3.41Å; I451-H455 PolarHBondContact O-N 3.3Å; I451-Y466 HydrophobicContact CD1-CE2 3.96Å; I451-Y466 HydrophobicContact CG1-CD2 4.3Å; I451-Y466 HydrophobicContact CG1-CE2 4.03Å; I451-Y466 HydrophobicContact CG2-CD1 4.42Å; I451-Y466 HydrophobicContact CG2-CD2 4.11Å; I451-Y466 HydrophobicContact CG2-CE2 4.24Å; I451-Y466 HydrophobicContact CG2-CG 4.19Å; I451-F478 HydrophobicContact CG1-CE2 3.98Å; I451-F478 HydrophobicContact CG1-CZ 3.73Å
452Q92.2Very high84.7Confident71 Ų7160.6 Ų60.633%0.33234%0.336SS..Hα-helixtrans-63.7-42.5178.6-71-68.1-20.800112.5T46 A448 F449 H455 F456T46-Q452 HydrophobicContact CG2-CG 3.97Å; T46-Q452 PolarHBondContact OG1-NE2 3.29Å; A448-Q452 WeakPolarHBondContact O-CG 3.28Å; A448-Q452 PolarHBondContact O-N 3.43Å; A448-Q452 VanDerWaalsContact O-N 3.1Å; F449-Q452 PolarHBondContact O-N 3.31Å; Q452-H455 PolarHBondContact O-N 3.48Å; Q452-F456 WeakPolarHBondContact O-CB 3.4Å; Q452-F456 PolarHBondContact O-N 2.7Å
453L91.8Very high82.8Confident78 Ų7860.7 Ų60.741%0.40834%0.337SS..Hα-helixtrans-62.6-47.3178.3-179.366.9000111.2F449 I450 F456 C457F449-L453 HydrophobicContact CE1-CB 4.5Å; F449-L453 HydrophobicContact CE1-CD2 3.98Å; F449-L453 HydrophobicContact CZ-CD2 4.32Å; F449-L453 VanDerWaalsContact O-CB 3.25Å; F449-L453 WeakPolarHBondContact O-CB 3.37Å; F449-L453 PolarHBondContact O-N 3Å; I450-L453 PolarHBondContact O-N 3.43Å; L453-F456 PolarHBondContact O-N 3.31Å; L453-C457 WeakPolarHBondContact O-CB 3.42Å; L453-C457 PolarHBondContact O-N 2.88Å; L453-C457 PolarHBondContact O-SG 3.3Å
454V89.8Confident81.4Confident15 Ų1563.1 Ų63.19%0.09135%0.35CS..Hα-helixtrans-64.9-41.8178.8170.80000110.8I450 I451 S458 F465 F478 L481I450-V454 HydrophobicContact CG2-CG2 4.2Å; I450-V454 WeakPolarHBondContact O-CB 3.44Å; I450-V454 VanDerWaalsContact O-CG2 3.26Å; I450-V454 WeakPolarHBondContact O-CG2 3.41Å; I450-V454 PolarHBondContact O-N 3.43Å; I451-V454 PolarHBondContact O-N 3.12Å; V454-S458 VanDerWaalsContact O-CB 3.27Å; V454-S458 WeakPolarHBondContact O-CB 3.5Å; V454-S458 PolarHBondContact O-N 3.03Å; V454-S458 PolarHBondContact O-OG 2.9Å; V454-F465 HydrophobicContact CG1-CB 3.48Å; V454-F465 VanDerWaalsContact CG1-CB 3.48Å; V454-F465 HydrophobicContact CG1-CD2 3.9Å; V454-F465 HydrophobicContact CG1-CG 4.08Å; V454-F478 HydrophobicContact CB-CD2 4.34Å; V454-F478 HydrophobicContact CG1-CD2 4.14Å; V454-F478 HydrophobicContact CG2-CD2 4.29Å; V454-L481 HydrophobicContact CG2-CD2 3.65Å
455H86.1Confident80.5Confident68 Ų6865.5 Ų65.532%0.31536%0.36SS..Hα-helixtrans-58.9-47.4174.5178.3-104.7000111.5V42 I451 Q452 S458V42-H455 HydrophobicContact CG1-CB 3.94Å; V42-H455 HydrophobicContact CG2-CB 4.35Å; I451-H455 WeakPolarHBondContact O-CB 3.41Å; I451-H455 PolarHBondContact O-N 3.3Å; Q452-H455 PolarHBondContact O-N 3.48Å; H455-S458 PolarHBondContact O-N 3.07Å
456F85.9Confident79.8Confident167 Ų16762.3 Ų62.373%0.73234%0.343SS*.Hα-helixtrans-63.6-48.9178.1-178.8-98.8000112.6Q452 L453 S458 G459Q452-F456 WeakPolarHBondContact O-CB 3.4Å; Q452-F456 PolarHBondContact O-N 2.7Å; L453-F456 PolarHBondContact O-N 3.31Å; F456-S458 VanDerWaalsContact C-N 3.26Å; F456-S458 PolarHBondContact O-N 3.45Å; F456-G459 PolarHBondContact O-N 2.67Å
457C85.4Confident79.1Confident94 Ų9459.9 Ų59.964%0.63533%0.331SS*.Hα-helixtrans-67.2-24.5-179-70.40000113.4L453 G459L453-C457 WeakPolarHBondContact O-CB 3.42Å; L453-C457 PolarHBondContact O-N 2.88Å; L453-C457 PolarHBondContact O-SG 3.3Å; C457-G459 PolarHBondContact O-N 2.83Å
458S78.2Confident78.5Confident17 Ų1763.8 Ų63.812%0.11935%0.352CS..THydrogen-bonded Turntrans-76.1-8.5179.3-590000113.6V454 H455 F456 T462V454-S458 VanDerWaalsContact O-CB 3.27Å; V454-S458 WeakPolarHBondContact O-CB 3.5Å; V454-S458 PolarHBondContact O-N 3.03Å; V454-S458 PolarHBondContact O-OG 2.9Å; H455-S458 PolarHBondContact O-N 3.07Å; F456-S458 VanDerWaalsContact C-N 3.26Å; F456-S458 PolarHBondContact O-N 3.45Å; S458-T462 CarbonylContact O-C 3.28Å; S458-T462 VanDerWaalsContact O-C 3.28Å; S458-T462 PolarHBondContact O-OG1 2.99Å
459G63.1Low77.9Confident31 Ų3166.3 Ų66.332%0.3237%0.369SS..  trans72.8146.4169.700000115.9F456 C457 K461 T462 G463F456-G459 PolarHBondContact O-N 2.67Å; C457-G459 PolarHBondContact O-N 2.83Å; G459-K461 PolarHBondContact O-N 3.31Å; G459-T462 CarbonylContact O-C 3.4Å; G459-T462 PolarHBondContact O-N 3.33Å; G459-G463 VanDerWaalsContact O-CA 3.23Å; G459-G463 WeakPolarHBondContact O-CA 3.42Å; G459-G463 PolarHBondContact O-N 3.29Å
460A51.4Low77.4Confident118 Ų11860.5 Ų60.598%0.97534%0.344SS*.THydrogen-bonded Turntrans-62.1-17.1-17600000115.7
461K46.1Very low76.9Confident210 Ų21062.3 Ų62.391%0.91335%0.352SS*.THydrogen-bonded Turntrans-92.4-15175.5-72.7-176177.21800113.8G459G459-K461 PolarHBondContact O-N 3.31Å
462T50.7Low76.3Confident96 Ų9667.6 Ų67.659%0.58938%0.38SS*.THydrogen-bonded Turntrans-141.522.1-174.645.80000112.7S458 G459 N464S458-T462 CarbonylContact O-C 3.28Å; S458-T462 VanDerWaalsContact O-C 3.28Å; S458-T462 PolarHBondContact O-OG1 2.99Å; G459-T462 CarbonylContact O-C 3.4Å; G459-T462 PolarHBondContact O-N 3.33Å; T462-N464 WeakPolarHBondContact O-CB 3.49Å; T462-N464 PolarHBondContact O-N 2.89Å
463G53.7Low75.9Confident23 Ų2364.2 Ų64.224%0.23736%0.364CS..  trans-6453.5-173.700000114G459G459-G463 VanDerWaalsContact O-CA 3.23Å; G459-G463 WeakPolarHBondContact O-CA 3.42Å; G459-G463 PolarHBondContact O-N 3.29Å
464N68.4Low75.7Confident52 Ų5261.7 Ų61.728%0.27835%0.351SS..  trans-101.1-15.9-163.3-94.815.6000112T462 Y466 P467 D472 N474T462-N464 WeakPolarHBondContact O-CB 3.49Å; T462-N464 PolarHBondContact O-N 2.89Å; N464-Y466 PolarHBondContact O-N 3.11Å; N464-P467 WeakPolarHBondContact O-CD 3.42Å; N464-D472 PolarHBondContact ND2-O 3.02Å; N464-N474 HydrophobicContact CB-CB 3.93Å; N464-N474 WeakPolarHBondContact CB-ND2 3.28Å; N464-N474 PolarHBondContact ND2-ND2 3.4Å; N464-N474 CarbonylContact O-C 3.37Å; N464-N474 VanDerWaalsContact O-C 3.29Å; N464-N474 VanDerWaalsContact O-CA 3.31Å; N464-N474 WeakPolarHBondContact O-CA 3.21Å; N464-N474 PolarHBondContact O-N 2.87Å
465F77.2Confident75.9Confident54 Ų5461 Ų6124%0.23735%0.347CS..SBendtrans-71.2-21.6-171.1-78.746.1000112.6V454 N474 L475 R477 F478V454-F465 HydrophobicContact CG1-CB 3.48Å; V454-F465 VanDerWaalsContact CG1-CB 3.48Å; V454-F465 HydrophobicContact CG1-CD2 3.9Å; V454-F465 HydrophobicContact CG1-CG 4.08Å; F465-N474 WeakPolarHBondContact CA-O 3.05Å; F465-L475 WeakPolarHBondContact O-CA 3.48Å; F465-R477 HydrophobicContact CD1-CB 4.2Å; F465-R477 HydrophobicContact CD2-CB 3.6Å; F465-R477 HydrophobicContact CE1-CB 4.12Å; F465-R477 HydrophobicContact CE1-CG 4.37Å; F465-R477 HydrophobicContact CE2-CB 3.5Å; F465-R477 VanDerWaalsContact CE2-CB 3.5Å; F465-R477 HydrophobicContact CE2-CG 4.41Å; F465-R477 HydrophobicContact CG-CB 3.97Å; F465-R477 HydrophobicContact CZ-CB 3.77Å; F465-R477 HydrophobicContact CZ-CG 4.22Å; F465-F478 HydrophobicContact CB-CB 4.48Å; F465-F478 VanDerWaalsContact O-CB 3.23Å; F465-F478 WeakPolarHBondContact O-CB 3.43Å
466Y82.1Confident76.2Confident3 Ų358.4 Ų58.41%0.01234%0.335CS..SBendtrans-141.176.4171.5-152.1-73.7000109N41 V42 A45 G294 I297 I451 N464 L475 F478N41-Y466 HydrophobicContact CB-CD1 4.38Å; N41-Y466 HydrophobicContact CB-CE1 4.21Å; V42-Y466 HydrophobicContact CB-CD1 4.24Å; V42-Y466 HydrophobicContact CG2-CD1 3.65Å; V42-Y466 HydrophobicContact CG2-CG 4.21Å; V42-Y466 WeakPolarHBondContact CG2-O 3.4Å; A45-Y466 HydrophobicContact CB-CE1 3.99Å; A45-Y466 WeakPolarHBondContact CB-OH 3.39Å; G294-Y466 PolarHBondContact N-OH 3.49Å; I297-Y466 HydrophobicContact CD1-CE1 3.59Å; I297-Y466 WeakPolarHBondContact CD1-OH 3.44Å; I451-Y466 HydrophobicContact CD1-CE2 3.96Å; I451-Y466 HydrophobicContact CG1-CD2 4.3Å; I451-Y466 HydrophobicContact CG1-CE2 4.03Å; I451-Y466 HydrophobicContact CG2-CD1 4.42Å; I451-Y466 HydrophobicContact CG2-CD2 4.11Å; I451-Y466 HydrophobicContact CG2-CE2 4.24Å; I451-Y466 HydrophobicContact CG2-CG 4.19Å; N464-Y466 PolarHBondContact O-N 3.11Å; Y466-L475 HydrophobicContact CD2-CD1 3.85Å; Y466-L475 HydrophobicContact CE2-CD1 4.07Å; Y466-L475 HydrophobicContact CG-CD1 4.3Å; Y466-F478 HydrophobicContact CD2-CD1 4.27Å; Y466-F478 HydrophobicContact CD2-CD2 4.44Å; Y466-F478 HydrophobicContact CD2-CE1 4.4Å; Y466-F478 HydrophobicContact CD2-CG 4.3Å; Y466-F478 HydrophobicContact CE2-CD1 4.42Å; Y466-F478 HydrophobicContact CE2-CE1 4.24Å
467P82.8Confident76.6Confident8 Ų856.2 Ų56.25%0.05232%0.322CS..  trans-88.1160.3-163.638.2-38.7000112.4N41 N464 S469 L470N41-P467 WeakPolarHBondContact CB-O 3.01Å; N41-P467 PolarHBondContact ND2-O 3.11Å; N464-P467 WeakPolarHBondContact O-CD 3.42Å; P467-S469 WeakPolarHBondContact CB-O 3.33Å; P467-S469 WeakPolarHBondContact CG-O 3.37Å; P467-L470 HydrophobicContact CG-CD1 4.24Å
468N83.4Confident77Confident83 Ų8351.8 Ų51.844%0.44429%0.292SS..SBendtrans-74.3-46.2168.1-72-24.5000112D40 N41D40-N468 WeakPolarHBondContact CA-OD1 3.27Å; D40-N468 WeakPolarHBondContact CB-OD1 3.45Å; D40-N468 PolarHBondContact OD1-ND2 2.97Å; D40-N468 PolarHBondContact OD1-OD1 3.25Å; N41-N468 PolarHBondContact N-OD1 2.97Å; N41-N468 WeakPolarHBondContact ND2-CA 3.27Å; N41-N468 PolarHBondContact ND2-O 3.26Å
469S83.9Confident77.8Confident56 Ų5651 Ų5139%0.39229%0.286SS..SBendtrans-87108.9167.5177.90000109.2P467 H471 D472 G473P467-S469 WeakPolarHBondContact CB-O 3.33Å; P467-S469 WeakPolarHBondContact CG-O 3.37Å; S469-H471 VanDerWaalsContact C-N 3.26Å; S469-H471 PolarHBondContact O-N 2.93Å; S469-D472 PolarHBondContact OG-OD2 2.95Å; S469-G473 PolarHBondContact O-N 3.49Å; S469-G473 VanDerWaalsContact O-N 3.12Å
470L85.4Confident79.5Confident3 Ų352.7 Ų52.72%0.01629%0.285CS..THydrogen-bonded Turntrans-71-21.8179.5-111.475.7000113.1N41 I297 N301 R373 P467 L475N41-L470 WeakPolarHBondContact ND2-CD1 3.5Å; I297-L470 HydrophobicContact CG2-CD1 3.4Å; I297-L470 VanDerWaalsContact CG2-CD1 3.4Å; I297-L470 HydrophobicContact CG2-CD2 3.83Å; I297-L470 HydrophobicContact CG2-CG 4.27Å; N301-L470 HydrophobicContact CB-CB 4.17Å; N301-L470 HydrophobicContact CB-CD2 3.81Å; R373-L470 PolarHBondContact NH2-O 2.92Å; P467-L470 HydrophobicContact CG-CD1 4.24Å; L470-L475 HydrophobicContact CD2-CD2 3.83Å; L470-L475 HydrophobicContact CG-CD2 4.17Å
471H83.9Confident81.6Confident62 Ų6250.2 Ų50.229%0.28726%0.255SS..THydrogen-bonded Turntrans-74-42.4179.1-169.871.6000111.7K374 L378 S469K374-H471 WeakPolarHBondContact CE-O 3.34Å; K374-H471 PolarHBondContact O-CE1 2.88Å; L378-H471 HydrophobicContact CD2-CB 4.23Å; S469-H471 VanDerWaalsContact C-N 3.26Å; S469-H471 PolarHBondContact O-N 2.93Å
472D79.9Confident84Confident110 Ų11040.3 Ų40.359%0.58821%0.212SC*.THydrogen-bonded Turntrans-91.6-18-175.2-49.9-56.3000113.3N464 S469N464-D472 PolarHBondContact ND2-O 3.02Å; S469-D472 PolarHBondContact OG-OD2 2.95Å
473G84.8Confident86.2Confident1 Ų136 Ų361%0.0119%0.186CC..SBendtrans-92.3177.8178.600000114K374 S469K374-G473 WeakPolarHBondContact CE-O 3.18Å; K374-G473 PolarHBondContact NZ-O 3.22Å; S469-G473 PolarHBondContact O-N 3.49Å; S469-G473 VanDerWaalsContact O-N 3.12Å
474N88.6Confident88.4Confident25 Ų2537.6 Ų37.613%0.13419%0.193CC..  trans-118.954-168.7-59.7-36.2000112.5K374 N464 F465 E476 R477K374-N474 PolarHBondContact NZ-OD1 3.32Å; N464-N474 HydrophobicContact CB-CB 3.93Å; N464-N474 WeakPolarHBondContact CB-ND2 3.28Å; N464-N474 PolarHBondContact ND2-ND2 3.4Å; N464-N474 CarbonylContact O-C 3.37Å; N464-N474 VanDerWaalsContact O-C 3.29Å; N464-N474 VanDerWaalsContact O-CA 3.31Å; N464-N474 WeakPolarHBondContact O-CA 3.21Å; N464-N474 PolarHBondContact O-N 2.87Å; F465-N474 WeakPolarHBondContact CA-O 3.05Å; N474-E476 WeakPolarHBondContact CA-OE1 3.44Å; N474-E476 VanDerWaalsContact CA-OE2 3.23Å; N474-E476 WeakPolarHBondContact CA-OE2 3.3Å; N474-E476 WeakPolarHBondContact CB-OE1 3.38Å; N474-E476 PolarHBondContact O-N 3.11Å; N474-E476 PolarHBondContact OD1-OE1 2.93Å; N474-R477 HydrophobicContact CB-CG 3.96Å; N474-R477 WeakPolarHBondContact O-CB 3.26Å; N474-R477 PolarHBondContact O-N 3.2Å
475L91.9Very high89.8Confident1 Ų138 Ų381%0.00520%0.195CC..Hα-helixtrans-59-28.7179-175.465.1000112.3E370 F465 Y466 L470 R477 F478 F479E370-L475 HydrophobicContact CG-CB 4.18Å; F465-L475 WeakPolarHBondContact O-CA 3.48Å; Y466-L475 HydrophobicContact CD2-CD1 3.85Å; Y466-L475 HydrophobicContact CE2-CD1 4.07Å; Y466-L475 HydrophobicContact CG-CD1 4.3Å; L470-L475 HydrophobicContact CD2-CD2 3.83Å; L470-L475 HydrophobicContact CG-CD2 4.17Å; L475-R477 PolarHBondContact O-N 3.11Å; L475-F478 HydrophobicContact CD1-CD1 4.43Å; L475-F478 WeakPolarHBondContact O-CB 3.45Å; L475-F478 PolarHBondContact O-N 3.09Å; L475-F478 VanDerWaalsContact O-N 3.14Å; L475-F479 HydrophobicContact CD1-CZ 4.45Å; L475-F479 HydrophobicContact CD2-CE2 3.89Å; L475-F479 HydrophobicContact CD2-CZ 3.99Å; L475-F479 HydrophobicContact CG-CD2 4.36Å; L475-F479 HydrophobicContact CG-CE2 3.79Å; L475-F479 HydrophobicContact CG-CZ 4.02Å; L475-F479 PolarHBondContact O-N 3.1Å
476E94.3Very high90.7Very high12 Ų1235.4 Ų35.46%0.05618%0.184CC..Hα-helixtrans-57.1-34175.268.7-78.717800112.8G367 E370 L371 K374 N474 F478 F479 F480G367-E476 WeakPolarHBondContact O-CB 3.28Å; E370-E476 HydrophobicContact CB-CB 4.01Å; E370-E476 HydrophobicContact CG-CB 4.03Å; L371-E476 HydrophobicContact CD2-CB 4.32Å; L371-E476 HydrophobicContact CD2-CG 3.67Å; L371-E476 HydrophobicContact CG-CB 4.16Å; L371-E476 HydrophobicContact CG-CG 4.03Å; K374-E476 IonicContact NZ-OE1 2.78Å; K374-E476 PolarHBondContact NZ-OE1 2.64Å; K374-E476 IonicContact NZ-OE2 3.67Å; N474-E476 WeakPolarHBondContact CA-OE1 3.44Å; N474-E476 VanDerWaalsContact CA-OE2 3.23Å; N474-E476 WeakPolarHBondContact CA-OE2 3.3Å; N474-E476 WeakPolarHBondContact CB-OE1 3.38Å; N474-E476 PolarHBondContact O-N 3.11Å; N474-E476 PolarHBondContact OD1-OE1 2.93Å; E476-F478 VanDerWaalsContact C-N 3.34Å; E476-F478 PolarHBondContact O-N 3.32Å; E476-F479 PolarHBondContact O-N 3.43Å; E476-F480 HydrophobicContact CB-CD2 4.44Å; E476-F480 HydrophobicContact CB-CE2 3.97Å; E476-F480 HydrophobicContact CG-CE2 4.08Å; E476-F480 WeakPolarHBondContact O-CD2 3.31Å; E476-F480 WeakPolarHBondContact O-CG 3.3Å; E476-F480 PolarHBondContact O-N 2.87Å
477R92.7Very high91.5Very high121 Ų12138.4 Ų38.446%0.45720%0.203SC..Hα-helixtrans-70-34.9-179-63.4-178.2-175.1-169.60.1111.5F465 N474 L475 F480 L481F465-R477 HydrophobicContact CD1-CB 4.2Å; F465-R477 HydrophobicContact CD2-CB 3.6Å; F465-R477 HydrophobicContact CE1-CB 4.12Å; F465-R477 HydrophobicContact CE1-CG 4.37Å; F465-R477 HydrophobicContact CE2-CB 3.5Å; F465-R477 VanDerWaalsContact CE2-CB 3.5Å; F465-R477 HydrophobicContact CE2-CG 4.41Å; F465-R477 HydrophobicContact CG-CB 3.97Å; F465-R477 HydrophobicContact CZ-CB 3.77Å; F465-R477 HydrophobicContact CZ-CG 4.22Å; N474-R477 HydrophobicContact CB-CG 3.96Å; N474-R477 WeakPolarHBondContact O-CB 3.26Å; N474-R477 PolarHBondContact O-N 3.2Å; L475-R477 PolarHBondContact O-N 3.11Å; R477-F480 PolarHBondContact O-N 3.29Å; R477-L481 WeakPolarHBondContact O-CB 3.38Å; R477-L481 PolarHBondContact O-N 3.47Å
478F93.9Very high92.2Very high1 Ų143.2 Ų43.20%0.00423%0.227CC..Hα-helixtrans-64.5-42.8172.1172.7-95.3000111.1I450 I451 V454 F465 Y466 L475 E476 L481 L482I450-F478 HydrophobicContact CG2-CE2 4.09Å; I451-F478 HydrophobicContact CG1-CE2 3.98Å; I451-F478 HydrophobicContact CG1-CZ 3.73Å; V454-F478 HydrophobicContact CB-CD2 4.34Å; V454-F478 HydrophobicContact CG1-CD2 4.14Å; V454-F478 HydrophobicContact CG2-CD2 4.29Å; F465-F478 HydrophobicContact CB-CB 4.48Å; F465-F478 VanDerWaalsContact O-CB 3.23Å; F465-F478 WeakPolarHBondContact O-CB 3.43Å; Y466-F478 HydrophobicContact CD2-CD1 4.27Å; Y466-F478 HydrophobicContact CD2-CD2 4.44Å; Y466-F478 HydrophobicContact CD2-CE1 4.4Å; Y466-F478 HydrophobicContact CD2-CG 4.3Å; Y466-F478 HydrophobicContact CE2-CD1 4.42Å; Y466-F478 HydrophobicContact CE2-CE1 4.24Å; L475-F478 HydrophobicContact CD1-CD1 4.43Å; L475-F478 WeakPolarHBondContact O-CB 3.45Å; L475-F478 PolarHBondContact O-N 3.09Å; L475-F478 VanDerWaalsContact O-N 3.14Å; E476-F478 VanDerWaalsContact C-N 3.34Å; E476-F478 PolarHBondContact O-N 3.32Å; F478-L481 WeakPolarHBondContact O-CB 3.32Å; F478-L481 PolarHBondContact O-N 3.21Å; F478-L482 PolarHBondContact O-N 2.95Å
479F96.6Very high92.9Very high0 Ų039.8 Ų39.80%021%0.209CC..Hα-helixtrans-64.3-44.6174.9-66.1-38000112.2Y295 V363 A366 L475 E476 L481 L482 A483Y295-F479 AromaticContact CD1-CE1 3.91Å; Y295-F479 HydrophobicContact CD1-CE1 3.91Å; Y295-F479 AromaticContact CD1-CZ 3.87Å; Y295-F479 HydrophobicContact CD1-CZ 3.87Å; Y295-F479 HydrophobicContact CE1-CD1 4.33Å; Y295-F479 AromaticContact CE1-CE1 3.84Å; Y295-F479 HydrophobicContact CE1-CE1 3.84Å; Y295-F479 HydrophobicContact CE1-CZ 4.12Å; V363-F479 HydrophobicContact CG1-CB 4.03Å; V363-F479 HydrophobicContact CG1-CD1 4.15Å; V363-F479 HydrophobicContact CG1-CG 4.49Å; V363-F479 WeakPolarHBondContact CG1-O 3.17Å; A366-F479 HydrophobicContact CB-CD1 4.38Å; A366-F479 HydrophobicContact CB-CD2 3.86Å; A366-F479 HydrophobicContact CB-CE2 4.04Å; A366-F479 HydrophobicContact CB-CG 4.04Å; A366-F479 HydrophobicContact CB-CZ 4.4Å; L475-F479 HydrophobicContact CD1-CZ 4.45Å; L475-F479 HydrophobicContact CD2-CE2 3.89Å; L475-F479 HydrophobicContact CD2-CZ 3.99Å; L475-F479 HydrophobicContact CG-CD2 4.36Å; L475-F479 HydrophobicContact CG-CE2 3.79Å; L475-F479 HydrophobicContact CG-CZ 4.02Å; L475-F479 PolarHBondContact O-N 3.1Å; E476-F479 PolarHBondContact O-N 3.43Å; F479-L481 VanDerWaalsContact C-N 3.33Å; F479-L481 PolarHBondContact O-N 2.87Å; F479-L482 PolarHBondContact O-N 2.84Å; F479-A483 WeakPolarHBondContact O-CB 3.44Å; F479-A483 PolarHBondContact O-N 2.96Å
480F96.9Very high93.6Very high67 Ų6737.9 Ų37.929%0.29419%0.194SC..Hα-helixtrans-62.4-38.7175.8-64.1-43.2000112.9L364 L368 L371 E476 R477 A483 S484L364-F480 HydrophobicContact CD1-CD1 3.93Å; L364-F480 HydrophobicContact CD1-CE1 3.98Å; L368-F480 HydrophobicContact CD2-CE1 4.15Å; L368-F480 HydrophobicContact CD2-CZ 4.1Å; L368-F480 HydrophobicContact CG-CE1 4.27Å; L371-F480 HydrophobicContact CD1-CE2 4.13Å; L371-F480 HydrophobicContact CD1-CZ 3.97Å; E476-F480 HydrophobicContact CB-CD2 4.44Å; E476-F480 HydrophobicContact CB-CE2 3.97Å; E476-F480 HydrophobicContact CG-CE2 4.08Å; E476-F480 WeakPolarHBondContact O-CD2 3.31Å; E476-F480 WeakPolarHBondContact O-CG 3.3Å; E476-F480 PolarHBondContact O-N 2.87Å; R477-F480 PolarHBondContact O-N 3.29Å; F480-A483 PolarHBondContact O-N 2.84Å; F480-S484 WeakPolarHBondContact O-CB 3.36Å; F480-S484 PolarHBondContact O-N 3.32Å
481L95.6Very high94.1Very high66 Ų6642.5 Ų42.535%0.34622%0.219SC..Hα-helixtrans-58-50.7172.6175.966.9000110.5V454 R477 F478 F479 A483 S484 L485V454-L481 HydrophobicContact CG2-CD2 3.65Å; R477-L481 WeakPolarHBondContact O-CB 3.38Å; R477-L481 PolarHBondContact O-N 3.47Å; F478-L481 WeakPolarHBondContact O-CB 3.32Å; F478-L481 PolarHBondContact O-N 3.21Å; F479-L481 VanDerWaalsContact C-N 3.33Å; F479-L481 PolarHBondContact O-N 2.87Å; L481-A483 PolarHBondContact O-N 3.35Å; L481-S484 PolarHBondContact O-N 3.19Å; L481-S484 PolarHBondContact O-OG 3.27Å; L481-L485 HydrophobicContact CD1-CD1 4.48Å; L481-L485 HydrophobicContact CG-CD1 4.3Å; L481-L485 WeakPolarHBondContact O-CG 3.39Å; L481-L485 PolarHBondContact O-N 3.14Å
482L96.8Very high94.7Very high3 Ų343.5 Ų43.52%0.01623%0.226CC..Hα-helixtrans-66.7-36.6-178.8-176.963.3000112.4L283 V286 Q290 V363 F478 F479 S484 L485 M486L283-L482 HydrophobicContact CD1-CD1 3.96Å; V286-L482 HydrophobicContact CB-CD1 4.42Å; V286-L482 HydrophobicContact CG1-CD1 3.7Å; V286-L482 HydrophobicContact CG1-CD2 4.33Å; Q290-L482 HydrophobicContact CG-CD2 3.6Å; V363-L482 HydrophobicContact CG1-CB 3.84Å; V363-L482 HydrophobicContact CG1-CD2 3.93Å; V363-L482 HydrophobicContact CG1-CG 3.97Å; V363-L482 HydrophobicContact CG2-CD2 4.16Å; V363-L482 HydrophobicContact CG2-CG 4.45Å; F478-L482 PolarHBondContact O-N 2.95Å; F479-L482 PolarHBondContact O-N 2.84Å; L482-S484 VanDerWaalsContact C-N 3.35Å; L482-S484 PolarHBondContact O-N 3Å; L482-L485 PolarHBondContact O-N 3.24Å; L482-M486 VanDerWaalsContact O-CB 3.28Å; L482-M486 WeakPolarHBondContact O-CB 3.43Å; L482-M486 PolarHBondContact O-N 3.1Å
483A98.3Very high95.4Very high6 Ų638.2 Ų38.25%0.0520%0.198CC..Hα-helixtrans-62.2-40.7173.100000112V363 L364 F479 F480 L481 M486 T487V363-A483 HydrophobicContact CB-CB 4.39Å; V363-A483 HydrophobicContact CG1-CB 4.33Å; L364-A483 HydrophobicContact CB-CB 4.04Å; F479-A483 WeakPolarHBondContact O-CB 3.44Å; F479-A483 PolarHBondContact O-N 2.96Å; F480-A483 PolarHBondContact O-N 2.84Å; L481-A483 PolarHBondContact O-N 3.35Å; A483-M486 PolarHBondContact O-N 3.31Å; A483-T487 WeakPolarHBondContact O-CB 3.12Å; A483-T487 PolarHBondContact O-N 2.85Å; A483-T487 PolarHBondContact O-OG1 3.43Å
484S98Very high95.8Very high55 Ų5544.8 Ų44.839%0.38522%0.222SC..Hα-helixtrans-64.4-46.4176.577.20000111.7F480 L481 L482 M486 T487 I488F480-S484 WeakPolarHBondContact O-CB 3.36Å; F480-S484 PolarHBondContact O-N 3.32Å; L481-S484 PolarHBondContact O-N 3.19Å; L481-S484 PolarHBondContact O-OG 3.27Å; L482-S484 VanDerWaalsContact C-N 3.35Å; L482-S484 PolarHBondContact O-N 3Å; S484-M486 PolarHBondContact O-N 2.93Å; S484-T487 PolarHBondContact O-N 3.5Å; S484-I488 WeakPolarHBondContact O-CG1 3.34Å; S484-I488 PolarHBondContact O-N 3.12Å; S484-I488 VanDerWaalsContact O-N 3.07Å
485L97.8Very high96Very high60 Ų6052.9 Ų52.931%0.31425%0.251SS..Hα-helixtrans-60.9-45.4175.8-69.3174.4000110.8L283 L481 L482 T487 I488 N489L283-L485 HydrophobicContact CD1-CB 4.22Å; L283-L485 HydrophobicContact CD2-CB 3.91Å; L481-L485 HydrophobicContact CD1-CD1 4.48Å; L481-L485 HydrophobicContact CG-CD1 4.3Å; L481-L485 WeakPolarHBondContact O-CG 3.39Å; L481-L485 PolarHBondContact O-N 3.14Å; L482-L485 PolarHBondContact O-N 3.24Å; L485-T487 VanDerWaalsContact C-N 3.33Å; L485-T487 PolarHBondContact O-N 3.29Å; L485-I488 PolarHBondContact O-N 2.94Å; L485-N489 WeakPolarHBondContact O-CB 3.32Å; L485-N489 PolarHBondContact O-N 3.44Å
486M98.1Very high95.9Very high0 Ų055.4 Ų55.40%026%0.264CS..Hα-helixtrans-67.7-33.2-179.5-168.258.6-149.700112.3L283 Y284 H356 A359 A360 L482 A483 S484 N489 T490L283-M486 HydrophobicContact CG-SD 4.45Å; Y284-M486 HydrophobicContact CD2-CE 3.89Å; Y284-M486 HydrophobicContact CG-CE 4.47Å; H356-M486 HydrophobicContact CB-CE 3.4Å; H356-M486 VanDerWaalsContact CB-CE 3.4Å; H356-M486 WeakPolarHBondContact O-CE 3.28Å; A359-M486 HydrophobicContact CB-CE 4.31Å; A359-M486 HydrophobicContact CB-CG 4.29Å; A360-M486 HydrophobicContact CB-CB 4.13Å; A360-M486 HydrophobicContact CB-CG 3.89Å; L482-M486 VanDerWaalsContact O-CB 3.28Å; L482-M486 WeakPolarHBondContact O-CB 3.43Å; L482-M486 PolarHBondContact O-N 3.1Å; A483-M486 PolarHBondContact O-N 3.31Å; S484-M486 PolarHBondContact O-N 2.93Å; M486-N489 WeakPolarHBondContact O-CB 3.31Å; M486-N489 PolarHBondContact O-N 3.29Å; M486-N489 HydrophobicContact SD-CB 4.2Å; M486-T490 WeakPolarHBondContact O-CB 3.23Å; M486-T490 PolarHBondContact O-N 3.5Å; M486-T490 PolarHBondContact O-OG1 2.82Å
487T98.3Very high95.5Very high67 Ų6755.1 Ų55.141%0.41126%0.263SS..Hα-helixtrans-64.5-46.7173.6-58.90000110.7A483 S484 L485 N489 T490 L491A483-T487 WeakPolarHBondContact O-CB 3.12Å; A483-T487 PolarHBondContact O-N 2.85Å; A483-T487 PolarHBondContact O-OG1 3.43Å; S484-T487 PolarHBondContact O-N 3.5Å; L485-T487 VanDerWaalsContact C-N 3.33Å; L485-T487 PolarHBondContact O-N 3.29Å; T487-N489 VanDerWaalsContact C-N 3.32Å; T487-N489 PolarHBondContact O-N 3.04Å; T487-T490 PolarHBondContact O-N 3.23Å; T487-L491 HydrophobicContact CG2-CD1 4.46Å; T487-L491 WeakPolarHBondContact O-CG 3.38Å; T487-L491 PolarHBondContact O-N 3.44Å
488I98.1Very high95.1Very high109 Ų10955.3 Ų55.356%0.55927%0.265SS*.Hα-helixtrans-60.2-43.7174.5-64.9166.6000110.4S484 L485 T490 L491 L492S484-I488 WeakPolarHBondContact O-CG1 3.34Å; S484-I488 PolarHBondContact O-N 3.12Å; S484-I488 VanDerWaalsContact O-N 3.07Å; L485-I488 PolarHBondContact O-N 2.94Å; I488-T490 VanDerWaalsContact C-N 3.33Å; I488-T490 PolarHBondContact O-N 3.49Å; I488-L491 PolarHBondContact O-N 3.46Å; I488-L492 WeakPolarHBondContact O-CB 3.38Å; I488-L492 PolarHBondContact O-N 3.21Å
489N97.7Very high94.6Very high11 Ų1160.6 Ų60.66%0.05929%0.285CS..Hα-helixtrans-58.5-44176.4-165.572.4000112L280 L283 H356 L485 M486 T487 L492 F493L280-N489 WeakPolarHBondContact CD2-OD1 3.47Å; L280-N489 PolarHBondContact O-ND2 3.19Å; L283-N489 HydrophobicContact CD2-CB 3.7Å; L283-N489 HydrophobicContact CG-CB 4.38Å; H356-N489 PolarHBondContact CE1-ND2 2.86Å; H356-N489 PolarHBondContact ND1-ND2 3.23Å; L485-N489 WeakPolarHBondContact O-CB 3.32Å; L485-N489 PolarHBondContact O-N 3.44Å; M486-N489 WeakPolarHBondContact O-CB 3.31Å; M486-N489 PolarHBondContact O-N 3.29Å; M486-N489 HydrophobicContact SD-CB 4.2Å; T487-N489 VanDerWaalsContact C-N 3.32Å; T487-N489 PolarHBondContact O-N 3.04Å; N489-L492 PolarHBondContact O-N 3.21Å; N489-F493 WeakPolarHBondContact O-CB 3.5Å; N489-F493 PolarHBondContact O-N 3.14Å
490T97.1Very high93.8Very high15 Ų1560.9 Ų60.99%0.09229%0.286CS..Hα-helixtrans-64.1-44.5178.8-54.90000111T353 H356 A357 M486 T487 I488 F493 W494T353-T490 HydrophobicContact CG2-CG2 4.09Å; H356-T490 HydrophobicContact CB-CG2 3.96Å; H356-T490 PolarHBondContact O-OG1 2.67Å; A357-T490 HydrophobicContact CB-CG2 4.26Å; M486-T490 WeakPolarHBondContact O-CB 3.23Å; M486-T490 PolarHBondContact O-N 3.5Å; M486-T490 PolarHBondContact O-OG1 2.82Å; T487-T490 PolarHBondContact O-N 3.23Å; I488-T490 VanDerWaalsContact C-N 3.33Å; I488-T490 PolarHBondContact O-N 3.49Å; T490-F493 PolarHBondContact O-N 3.39Å; T490-W494 WeakPolarHBondContact O-CB 3.41Å; T490-W494 PolarHBondContact O-N 2.95Å
491L96.6Very high92.6Very high101 Ų10159.4 Ų59.453%0.52928%0.281SS..Hα-helixtrans-65.5-40.6177.2-68.2173.7000112T487 I488 W494 R495T487-L491 HydrophobicContact CG2-CD1 4.46Å; T487-L491 WeakPolarHBondContact O-CG 3.38Å; T487-L491 PolarHBondContact O-N 3.44Å; I488-L491 PolarHBondContact O-N 3.46Å; L491-W494 PolarHBondContact O-N 2.66Å; L491-R495 WeakPolarHBondContact O-CG 3.49Å; L491-R495 PolarHBondContact O-N 3.41Å; L491-R495 VanDerWaalsContact O-N 3.12Å
492L96.1Very high91Very high82 Ų8261.1 Ų61.143%0.42929%0.29SS..Hα-helixtrans-64.3-45175.5179.757000111.1L280 I488 N489 R495 L496L280-L492 HydrophobicContact CD1-CG 4.29Å; L280-L492 HydrophobicContact CD2-CD2 3.66Å; L280-L492 HydrophobicContact CD2-CG 4.08Å; I488-L492 WeakPolarHBondContact O-CB 3.38Å; I488-L492 PolarHBondContact O-N 3.21Å; N489-L492 PolarHBondContact O-N 3.21Å; L492-R495 PolarHBondContact O-N 3.26Å; L492-L496 HydrophobicContact CD1-CD1 4.27Å; L492-L496 HydrophobicContact CG-CD1 4.27Å; L492-L496 WeakPolarHBondContact O-CG 3.28Å; L492-L496 PolarHBondContact O-N 3.06Å
493F95.1Very high89.1Confident0 Ų063.2 Ų63.20%030%0.301CS..Hα-helixtrans-64-42.2176.4-175.5-103.3000111.8L277 L280 A349 I352 T353 N489 T490 R495 L496 S497L277-F493 HydrophobicContact CD1-CD2 4.4Å; L277-F493 HydrophobicContact CD1-CE2 3.39Å; L277-F493 HydrophobicContact CD1-CZ 3.86Å; L280-F493 HydrophobicContact CB-CD2 4.48Å; L280-F493 HydrophobicContact CD1-CB 3.9Å; L280-F493 HydrophobicContact CD1-CD2 3.83Å; L280-F493 HydrophobicContact CD1-CG 4.37Å; A349-F493 VanDerWaalsContact O-CE1 3.32Å; A349-F493 WeakPolarHBondContact O-CE1 3.4Å; I352-F493 HydrophobicContact CB-CD1 4.45Å; I352-F493 HydrophobicContact CB-CE1 3.52Å; I352-F493 HydrophobicContact CB-CZ 3.79Å; I352-F493 HydrophobicContact CD1-CZ 4.05Å; I352-F493 HydrophobicContact CG2-CD1 3.88Å; I352-F493 HydrophobicContact CG2-CE1 3.29Å; I352-F493 HydrophobicContact CG2-CE2 4.23Å; I352-F493 HydrophobicContact CG2-CZ 3.49Å; I352-F493 VanDerWaalsContact CG2-CZ 3.49Å; T353-F493 VanDerWaalsContact OG1-CD1 3.32Å; T353-F493 WeakPolarHBondContact OG1-CD1 3.48Å; T353-F493 WeakPolarHBondContact OG1-CE1 3.23Å; N489-F493 WeakPolarHBondContact O-CB 3.5Å; N489-F493 PolarHBondContact O-N 3.14Å; T490-F493 PolarHBondContact O-N 3.39Å; F493-R495 VanDerWaalsContact C-N 3.31Å; F493-R495 PolarHBondContact O-N 3.18Å; F493-L496 CarbonylContact O-C 3.43Å; F493-L496 PolarHBondContact O-N 2.75Å; F493-L496 VanDerWaalsContact O-N 3.09Å; F493-S497 WeakPolarHBondContact O-CB 3.45Å; F493-S497 PolarHBondContact O-N 3.23Å
494W93.4Very high86.8Confident139 Ų13965.4 Ų65.453%0.52732%0.316SS..Hα-helixtrans-52.9-49.8174.1-177.9-58.6000110.8T353 T490 L491 L496 S497 Y498T353-W494 HydrophobicContact CG2-CB 4.01Å; T353-W494 HydrophobicContact CG2-CD2 4.13Å; T353-W494 HydrophobicContact CG2-CE3 3.46Å; T353-W494 VanDerWaalsContact CG2-CE3 3.46Å; T353-W494 HydrophobicContact CG2-CG 4.41Å; T353-W494 HydrophobicContact CG2-CZ3 4.23Å; T490-W494 WeakPolarHBondContact O-CB 3.41Å; T490-W494 PolarHBondContact O-N 2.95Å; L491-W494 PolarHBondContact O-N 2.66Å; W494-L496 VanDerWaalsContact C-N 3.31Å; W494-L496 PolarHBondContact O-N 3.38Å; W494-S497 VanDerWaalsContact O-CB 3.31Å; W494-S497 WeakPolarHBondContact O-CB 3.33Å; W494-S497 PolarHBondContact O-N 2.63Å; W494-S497 VanDerWaalsContact O-N 3.15Å; W494-S497 PolarHBondContact O-OG 3.07Å; W494-Y498 AromaticContact NE1-CE2 3.96Å
495R92.2Very high84.3Confident195 Ų19568.2 Ų68.274%0.73633%0.33SS*.Hα-helixtrans-60.8-40.4178.3-70.2177.2-178-176.41.2112L491 L492 F493 S497 Y498L491-R495 WeakPolarHBondContact O-CG 3.49Å; L491-R495 PolarHBondContact O-N 3.41Å; L491-R495 VanDerWaalsContact O-N 3.12Å; L492-R495 PolarHBondContact O-N 3.26Å; F493-R495 VanDerWaalsContact C-N 3.31Å; F493-R495 PolarHBondContact O-N 3.18Å; R495-S497 VanDerWaalsContact C-N 3.33Å; R495-Y498 WeakPolarHBondContact O-CD2 3.37Å
496L90.1Very high81.5Confident53 Ų5372.9 Ų72.928%0.27735%0.35SS..Hα-helixtrans-75.7-20.4177.9-66.9172.8000113.3P276 L280 L492 F493 W494 Y498 R499 Y500P276-L496 HydrophobicContact CB-CD1 4.25Å; L280-L496 HydrophobicContact CD1-CD1 3.65Å; L492-L496 HydrophobicContact CD1-CD1 4.27Å; L492-L496 HydrophobicContact CG-CD1 4.27Å; L492-L496 WeakPolarHBondContact O-CG 3.28Å; L492-L496 PolarHBondContact O-N 3.06Å; F493-L496 CarbonylContact O-C 3.43Å; F493-L496 PolarHBondContact O-N 2.75Å; F493-L496 VanDerWaalsContact O-N 3.09Å; W494-L496 VanDerWaalsContact C-N 3.31Å; W494-L496 PolarHBondContact O-N 3.38Å; L496-Y498 PolarHBondContact O-N 2.95Å; L496-R499 VanDerWaalsContact O-CB 3.24Å; L496-R499 WeakPolarHBondContact O-CB 3.4Å; L496-R499 PolarHBondContact O-N 2.66Å; L496-Y500 WeakPolarHBondContact O-CD2 3.5Å
497S87.2Confident78.8Confident7 Ų776.1 Ų76.15%0.04938%0.384CS..Hα-helixtrans-60.4-32.1-176.877.80000112.3F493 W494 R495 R499 Y500 M501F493-S497 WeakPolarHBondContact O-CB 3.45Å; F493-S497 PolarHBondContact O-N 3.23Å; W494-S497 VanDerWaalsContact O-CB 3.31Å; W494-S497 WeakPolarHBondContact O-CB 3.33Å; W494-S497 PolarHBondContact O-N 2.63Å; W494-S497 VanDerWaalsContact O-N 3.15Å; W494-S497 PolarHBondContact O-OG 3.07Å; R495-S497 VanDerWaalsContact C-N 3.33Å; S497-R499 PolarHBondContact O-N 2.77Å; S497-Y500 PolarHBondContact O-N 3.04Å; S497-M501 PolarHBondContact O-N 3.33Å
498Y84Confident75.8Confident124 Ų12481.4 Ų81.449%0.48640%0.401SS..Hα-helixtrans-56.9-35.9175.2-69.9-74.6000112.5W494 R495 L496 Y500 M501 N502W494-Y498 AromaticContact NE1-CE2 3.96Å; R495-Y498 WeakPolarHBondContact O-CD2 3.37Å; L496-Y498 PolarHBondContact O-N 2.95Å; Y498-Y500 VanDerWaalsContact C-N 3.33Å; Y498-Y500 PolarHBondContact O-N 3.38Å; Y498-M501 HydrophobicContact CD1-CE 3.75Å; Y498-M501 HydrophobicContact CE1-CE 4.1Å; Y498-M501 PolarHBondContact O-N 3.16Å; Y498-N502 PolarHBondContact O-N 3.46Å; Y498-N502 VanDerWaalsContact O-N 3.09Å
499R82.5Confident73.3Confident113 Ų11381.6 Ų81.643%0.42641%0.409SS..Hα-helixtrans-62.4-42.1176.6-172-177.2-177.5178.13.2111.5L496 S497 L503L496-R499 VanDerWaalsContact O-CB 3.24Å; L496-R499 WeakPolarHBondContact O-CB 3.4Å; L496-R499 PolarHBondContact O-N 2.66Å; S497-R499 PolarHBondContact O-N 2.77Å; R499-L503 HydrophobicContact CG-CD1 4.23Å; R499-L503 VanDerWaalsContact O-CD1 3.29Å; R499-L503 WeakPolarHBondContact O-CD1 3.27Å; R499-L503 VanDerWaalsContact O-CG 3.25Å; R499-L503 WeakPolarHBondContact O-CG 3.4Å; R499-L503 PolarHBondContact O-N 2.87Å
500Y80Confident70.1Confident6 Ų689 Ų892%0.02445%0.448CS..Hα-helixtrans-78.9-29.5-178.1-59.8-66.5000112.2K273 L274 L277 I419 L423 L496 S497 Y498 S504K273-Y500 WeakPolarHBondContact O-CE1 3.26Å; K273-Y500 PolarHBondContact O-OH 2.68Å; L274-Y500 HydrophobicContact CD2-CD1 4.49Å; L274-Y500 HydrophobicContact CD2-CE1 4.02Å; L277-Y500 HydrophobicContact CB-CE1 4.41Å; L277-Y500 HydrophobicContact CB-CE2 4.08Å; L277-Y500 PolarHBondContact N-OH 3.4Å; I419-Y500 HydrophobicContact CG2-CD1 4.3Å; L423-Y500 HydrophobicContact CD1-CD1 3.88Å; L496-Y500 WeakPolarHBondContact O-CD2 3.5Å; S497-Y500 PolarHBondContact O-N 3.04Å; Y498-Y500 VanDerWaalsContact C-N 3.33Å; Y498-Y500 PolarHBondContact O-N 3.38Å; Y500-S504 PolarHBondContact O-N 3.04Å
501M72.5Confident66.9Low36 Ų3693.4 Ų93.418%0.17748%0.48CS..Hα-helixtrans-65.9-47.8174.1-163.9163.264.800111.2A347 S497 Y498 L503 S504 V505A347-M501 HydrophobicContact CB-CG 4.27Å; A347-M501 HydrophobicContact CB-SD 4.25Å; S497-M501 PolarHBondContact O-N 3.33Å; Y498-M501 HydrophobicContact CD1-CE 3.75Å; Y498-M501 HydrophobicContact CE1-CE 4.1Å; Y498-M501 PolarHBondContact O-N 3.16Å; M501-L503 PolarHBondContact O-N 2.77Å; M501-S504 PolarHBondContact O-N 3.03Å; M501-S504 PolarHBondContact O-OG 3.31Å; M501-V505 PolarHBondContact O-N 3.46Å
502N61Low64.4Low101 Ų10194.4 Ų94.454%0.5450%0.495SS..Hα-helixtrans-65.1-38.6179.4-69.7-6.9000112.8Y498 S504 V505 Q506Y498-N502 PolarHBondContact O-N 3.46Å; Y498-N502 VanDerWaalsContact O-N 3.09Å; N502-S504 VanDerWaalsContact C-N 3.3Å; N502-S504 PolarHBondContact O-N 2.69Å; N502-V505 PolarHBondContact O-N 3.25Å; N502-Q506 PolarHBondContact O-N 2.77Å
503L56.9Low61.5Low48 Ų4894.2 Ų94.225%0.25150%0.501SS..Hα-helixtrans-66.4-30.4177.5-74.4165.4000112.9L423 R499 M501 V505L423-L503 HydrophobicContact CD1-CB 4.47Å; L423-L503 HydrophobicContact CD1-CD1 4.38Å; L423-L503 HydrophobicContact CD2-CB 3.68Å; R499-L503 HydrophobicContact CG-CD1 4.23Å; R499-L503 VanDerWaalsContact O-CD1 3.29Å; R499-L503 WeakPolarHBondContact O-CD1 3.27Å; R499-L503 VanDerWaalsContact O-CG 3.25Å; R499-L503 WeakPolarHBondContact O-CG 3.4Å; R499-L503 PolarHBondContact O-N 2.87Å; M501-L503 PolarHBondContact O-N 2.77Å; L503-V505 VanDerWaalsContact C-N 3.31Å
504S50.3Low58.7Low52 Ų5298 Ų9836%0.36453%0.527SS..Hα-helixtrans-71.9-24.9175730000113.3Y500 M501 N502Y500-S504 PolarHBondContact O-N 3.04Å; M501-S504 PolarHBondContact O-N 3.03Å; M501-S504 PolarHBondContact O-OG 3.31Å; N502-S504 VanDerWaalsContact C-N 3.3Å; N502-S504 PolarHBondContact O-N 2.69Å
505V45.6Very low56Low113 Ų11394.9 Ų94.969%0.68552%0.52SS*.Hα-helixtrans-85.7-34.1-179175.80000112.2M501 N502 L503 G507M501-V505 PolarHBondContact O-N 3.46Å; N502-V505 PolarHBondContact O-N 3.25Å; L503-V505 VanDerWaalsContact C-N 3.31Å; V505-G507 VanDerWaalsContact C-N 3.25Å; V505-G507 PolarHBondContact O-N 2.79Å
506Q38Very low53.3Low158 Ų15888.7 Ų88.774%0.73851%0.507SS*.SBendtrans-73.8-5.3178-82.7178-26.600115N502 K508N502-Q506 PolarHBondContact O-N 2.77Å; Q506-K508 VanDerWaalsContact C-N 3.31Å; Q506-K508 PolarHBondContact O-N 3.33Å
507G41.8Very low51Low68 Ų6892.5 Ų92.570%0.70152%0.523SS*.  trans-79.115.9-175.300000117.5V505V505-G507 VanDerWaalsContact C-N 3.25Å; V505-G507 PolarHBondContact O-N 2.79Å
508K36.5Very low48.7Very low178 Ų17898.5 Ų98.577%0.77455%0.549SS*.  trans-141.2144.4167.1-80.9-174.4172.4-172.40108.8Q506Q506-K508 VanDerWaalsContact C-N 3.31Å; Q506-K508 PolarHBondContact O-N 3.33Å
509P45.4Very low46.6Very low113 Ų11395.9 Ų95.973%0.73454%0.543SS*.  cis-127.6152.98.637.7-21.7000114.6
510L29.7Very low44.5Very low167 Ų16795.6 Ų95.687%0.87455%0.549SS*.SBendtrans-178.2123.9140-120.589000111.5
511S31Very low42.6Very low108 Ų10899.1 Ų99.176%0.75557%0.566SS**  trans60.4111.9170.272.40000118.3S513S511-S513 PolarHBondContact O-N 3.23Å; S511-S513 VanDerWaalsContact O-N 3.17Å
512S43.3Very low41.1Very low121 Ų121104.1 Ų104.185%0.84658%0.584SS**  trans-55.5105.1167.4470000112.2
513S35.2Very low39.7Very low79 Ų79105.8 Ų105.855%0.55259%0.586SS**  trans-106.7147.4161.962.10000109.2S511 L515 S516S511-S513 PolarHBondContact O-N 3.23Å; S511-S513 VanDerWaalsContact O-N 3.17Å; S513-L515 PolarHBondContact O-N 3.38Å; S513-S516 VanDerWaalsContact O-CB 3.26Å; S513-S516 WeakPolarHBondContact O-CB 3.37Å; S513-S516 PolarHBondContact O-N 3.49Å
514S36.8Very low38.6Very low80 Ų80105.2 Ų105.256%0.55959%0.588SS**Hα-helixtrans-61.7-1.2-170.971.90000115.9K518S514-K518 WeakPolarHBondContact O-CG 3.42Å; S514-K518 PolarHBondContact O-N 2.81Å
515L36.8Very low37.8Very low72 Ų72103.6 Ų103.638%0.37758%0.578SS.*Hα-helixtrans-78.7-30.1166-166.777.6000112.5S513 E517 K518 L519S513-L515 PolarHBondContact O-N 3.38Å; L515-E517 VanDerWaalsContact C-N 3.32Å; L515-K518 CarbonylContact O-C 3.58Å; L515-K518 PolarHBondContact O-N 3.19Å; L515-L519 HydrophobicContact CD2-CD1 4.36Å; L515-L519 HydrophobicContact CG-CD1 4.21Å; L515-L519 WeakPolarHBondContact O-CB 3.44Å; L515-L519 PolarHBondContact O-N 3.13Å
516S35.4Very low37.2Very low66 Ų66102.2 Ų102.246%0.46257%0.566SS.*Hα-helixtrans-63.6-39.4169.5-170.90000110.4S513 L519 L520S513-S516 VanDerWaalsContact O-CB 3.26Å; S513-S516 WeakPolarHBondContact O-CB 3.37Å; S513-S516 PolarHBondContact O-N 3.49Å; S516-L519 PolarHBondContact O-N 3.37Å; S516-L520 WeakPolarHBondContact O-CB 3.43Å; S516-L520 PolarHBondContact O-N 3.09Å
517E40.2Very low36.7Very low132 Ų132102.2 Ų102.262%0.61756%0.56SS**Hα-helixtrans-61.2-44.5168.1-76.7176.1148.200111.5L515 L519 L520 Q521L515-E517 VanDerWaalsContact C-N 3.32Å; E517-L519 PolarHBondContact O-N 3.18Å; E517-L520 PolarHBondContact O-N 2.7Å; E517-Q521 WeakPolarHBondContact O-CB 3.12Å; E517-Q521 WeakPolarHBondContact O-CG 3.23Å; E517-Q521 PolarHBondContact O-N 2.64Å
518K40.7Very low36.4Very low134 Ų134104.3 Ų104.358%0.58355%0.55SS*.Hα-helixtrans-70-25.4178.2-71.5-172.7179.7-171.60115S514 L515 Q521 Y522S514-K518 WeakPolarHBondContact O-CG 3.42Å; S514-K518 PolarHBondContact O-N 2.81Å; L515-K518 CarbonylContact O-C 3.58Å; L515-K518 PolarHBondContact O-N 3.19Å; K518-Q521 VanDerWaalsContact O-CB 3.3Å; K518-Q521 WeakPolarHBondContact O-CB 3.11Å; K518-Y522 PolarHBondContact O-N 3.24Å; K518-Y522 VanDerWaalsContact O-N 3.07Å
519L39.3Very low36.1Very low68 Ų68104.7 Ų104.736%0.35655%0.547SS..Hα-helixtrans-86.4-32.3174.2-91.9155.4000112.1L515 S516 E517 Q521 Y522 K523L515-L519 HydrophobicContact CD2-CD1 4.36Å; L515-L519 HydrophobicContact CG-CD1 4.21Å; L515-L519 WeakPolarHBondContact O-CB 3.44Å; L515-L519 PolarHBondContact O-N 3.13Å; S516-L519 PolarHBondContact O-N 3.37Å; E517-L519 PolarHBondContact O-N 3.18Å; L519-Q521 PolarHBondContact O-N 3.37Å; L519-Y522 CarbonylContact O-C 3.23Å; L519-Y522 PolarHBondContact O-N 3.26Å; L519-K523 WeakPolarHBondContact O-CB 3.4Å; L519-K523 PolarHBondContact O-N 3.43Å
520L38.6Very low35.1Very low108 Ų108104.7 Ų104.757%0.56554%0.541SS*.Hα-helixtrans-66.7-26.8167-151.3146.3000110.4S516 E517 K523 A524S516-L520 WeakPolarHBondContact O-CB 3.43Å; S516-L520 PolarHBondContact O-N 3.09Å; E517-L520 PolarHBondContact O-N 2.7Å; L520-K523 CarbonylContact O-C 3.5Å; L520-K523 WeakPolarHBondContact O-CA 3.45Å; L520-K523 VanDerWaalsContact O-CB 3.28Å; L520-K523 WeakPolarHBondContact O-CB 3.45Å; L520-K523 PolarHBondContact O-N 3.43Å; L520-A524 WeakPolarHBondContact O-CB 3.41Å; L520-A524 PolarHBondContact O-N 2.92Å
521Q39.8Very low34.9Very low80 Ų80102.7 Ų102.737%0.37454%0.536SS..Hα-helixtrans-71.7-38.9167.6-86.5179.7-10.200113.5Q151 E517 K518 L519 K523 A524 A525Q151-Q521 VanDerWaalsContact NE2-CA 3.34Å; Q151-Q521 PolarHBondContact NE2-O 3.39Å; Q151-Q521 VanDerWaalsContact OE1-OE1 3.07Å; E517-Q521 WeakPolarHBondContact O-CB 3.12Å; E517-Q521 WeakPolarHBondContact O-CG 3.23Å; E517-Q521 PolarHBondContact O-N 2.64Å; K518-Q521 VanDerWaalsContact O-CB 3.3Å; K518-Q521 WeakPolarHBondContact O-CB 3.11Å; L519-Q521 PolarHBondContact O-N 3.37Å; Q521-K523 PolarHBondContact O-N 3.44Å; Q521-A524 CarbonylContact O-C 3.42Å; Q521-A524 WeakPolarHBondContact O-CA 3.4Å; Q521-A524 WeakPolarHBondContact O-CB 3.4Å; Q521-A524 PolarHBondContact O-N 3.37Å; Q521-A524 VanDerWaalsContact O-N 3.1Å; Q521-A525 PolarHBondContact O-N 3.34Å
522Y39.8Very low35Very low141 Ų141103.4 Ų103.455%0.55354%0.536SS*.Hα-helixtrans-68.3-27.1166.3-158.2-91.5000112.1K518 L519 A524 A525K518-Y522 PolarHBondContact O-N 3.24Å; K518-Y522 VanDerWaalsContact O-N 3.07Å; L519-Y522 CarbonylContact O-C 3.23Å; L519-Y522 PolarHBondContact O-N 3.26Å; Y522-A524 VanDerWaalsContact C-N 3.29Å; Y522-A525 WeakPolarHBondContact O-CB 3.49Å; Y522-A525 PolarHBondContact O-N 3.23Å
523K33.4Very low34.2Very low136 Ų136105.2 Ų105.259%0.59153%0.531SS*.Hα-helixtrans-74.4-20.5170-147.7175.6-176.5-178.10112.4L519 L520 Q521L519-K523 WeakPolarHBondContact O-CB 3.4Å; L519-K523 PolarHBondContact O-N 3.43Å; L520-K523 CarbonylContact O-C 3.5Å; L520-K523 WeakPolarHBondContact O-CA 3.45Å; L520-K523 VanDerWaalsContact O-CB 3.28Å; L520-K523 WeakPolarHBondContact O-CB 3.45Å; L520-K523 PolarHBondContact O-N 3.43Å; Q521-K523 PolarHBondContact O-N 3.44Å
524A33Very low33.8Very low36 Ų36110 Ų11030%0.29854%0.544SS..Hα-helixtrans-90.3-10.9170.100000113.1L520 Q521 Y522 L526 R527 F528L520-A524 WeakPolarHBondContact O-CB 3.41Å; L520-A524 PolarHBondContact O-N 2.92Å; Q521-A524 CarbonylContact O-C 3.42Å; Q521-A524 WeakPolarHBondContact O-CA 3.4Å; Q521-A524 WeakPolarHBondContact O-CB 3.4Å; Q521-A524 PolarHBondContact O-N 3.37Å; Q521-A524 VanDerWaalsContact O-N 3.1Å; Y522-A524 VanDerWaalsContact C-N 3.29Å; A524-L526 PolarHBondContact O-N 3.46Å; A524-R527 HydrophobicContact CB-CB 4.47Å; A524-R527 CarbonylContact O-C 3.47Å; A524-R527 PolarHBondContact O-N 3.39Å; A524-F528 PolarHBondContact O-N 3.43Å
525A34.3Very low33.2Very low18 Ų18113.7 Ų113.715%0.14956%0.557CS.*THydrogen-bonded Turntrans-63.6-17.8165.100000113.6L155 Q521 Y522L155-A525 HydrophobicContact CD1-CB 3.57Å; L155-A525 HydrophobicContact CD2-CB 3.3Å; L155-A525 HydrophobicContact CG-CB 3.97Å; Q521-A525 PolarHBondContact O-N 3.34Å; Y522-A525 WeakPolarHBondContact O-CB 3.49Å; Y522-A525 PolarHBondContact O-N 3.23Å
526L32.3Very low33Very low83 Ų83115.1 Ų115.144%0.43557%0.573SS.*THydrogen-bonded Turntrans-104.37.5169.3-84.7142.6000112.7E332 A524E332-L526 HydrophobicContact CB-CD2 3.98Å; E332-L526 HydrophobicContact CG-CD2 3.76Å; E332-L526 WeakPolarHBondContact OE1-CA 3.44Å; A524-L526 PolarHBondContact O-N 3.46Å
527R27.8Very low32.8Very low158 Ų158117.2 Ų117.260%0.59658%0.583SS**SBendtrans-117.611.6174-69.6-170.2-173.3174.6-2.9113.5A524 Y529A524-R527 HydrophobicContact CB-CB 4.47Å; A524-R527 CarbonylContact O-C 3.47Å; A524-R527 PolarHBondContact O-N 3.39Å; R527-Y529 VanDerWaalsContact C-N 3.3Å; R527-Y529 PolarHBondContact O-N 3.35Å
528F34.8Very low32.3Very low113 Ų113117.6 Ų117.650%0.49659%0.589SS.*THydrogen-bonded Turntrans-9330.6178-156.8-88.8000113.3H152 A524H152-F528 HydrophobicContact CB-CE2 4.48Å; H152-F528 AromaticContact CD2-CD1 3.27Å; H152-F528 WeakPolarHBondContact CD2-CD1 3.45Å; H152-F528 AromaticContact CD2-CD2 3.24Å; H152-F528 WeakPolarHBondContact CD2-CD2 3.18Å; H152-F528 AromaticContact CD2-CE1 3.37Å; H152-F528 WeakPolarHBondContact CD2-CE1 3.27Å; H152-F528 AromaticContact CD2-CE2 3.22Å; H152-F528 WeakPolarHBondContact CD2-CE2 3.3Å; H152-F528 AromaticContact CD2-CG 3.28Å; H152-F528 WeakPolarHBondContact CD2-CG 3.44Å; H152-F528 AromaticContact CD2-CZ 3.32Å; H152-F528 WeakPolarHBondContact CD2-CZ 3.3Å; H152-F528 AromaticContact CE1-CD1 3.93Å; H152-F528 AromaticContact CE1-CE1 3.29Å; H152-F528 WeakPolarHBondContact CE1-CE1 3.29Å; H152-F528 AromaticContact CE1-CE2 3.91Å; H152-F528 AromaticContact CE1-CZ 3.24Å; H152-F528 WeakPolarHBondContact CE1-CZ 3.46Å; H152-F528 AromaticContact CG-CD2 3.92Å; H152-F528 AromaticContact CG-CE2 3.56Å; H152-F528 AromaticContact CG-CZ 3.74Å; H152-F528 AromaticContact ND1-CE2 3.95Å; H152-F528 AromaticContact ND1-CZ 3.67Å; H152-F528 AromaticContact NE2-CD1 2.97Å; H152-F528 WeakPolarHBondContact NE2-CD1 3.41Å; H152-F528 AromaticContact NE2-CD2 3.81Å; H152-F528 AromaticContact NE2-CE1 2.78Å; H152-F528 WeakPolarHBondContact NE2-CE1 3.27Å; H152-F528 AromaticContact NE2-CE2 3.58Å; H152-F528 AromaticContact NE2-CG 3.56Å; H152-F528 AromaticContact NE2-CZ 3.09Å; H152-F528 WeakPolarHBondContact NE2-CZ 3.43Å; A524-F528 PolarHBondContact O-N 3.43Å
529Y31.3Very low31.6Very low185 Ų185116.6 Ų116.673%0.72560%0.6SS**THydrogen-bonded Turntrans-118.51.3159.5-96.8-77000113R527R527-Y529 VanDerWaalsContact C-N 3.3Å; R527-Y529 PolarHBondContact O-N 3.35Å
530D23.9Very low31.2Very low113 Ų113120.7 Ų120.760%0.60463%0.627SS**SBendtrans-94.38.2-169.4-97.1-9.6000116.4
531T26Very low30.6Very low126 Ų126126.7 Ų126.777%0.77366%0.658SS**  trans-145.661.4170.749.60000113
532V32.2Very low30.2Very low123 Ų123129.1 Ų129.175%0.74567%0.673SS**SBendtrans-91.9-15.3158.3174.60000112.4
533E25.9Very low29.7Very low158 Ų158128.4 Ų128.474%0.73868%0.679SS**SBendtrans-142.84.8-161.9-118.9169.9176.600119.9
534H26.5Very low29.4Very low180 Ų180128 Ų12883%0.83368%0.684SS**SBendtrans-123.172.6176.8-77.6-47.2000113.3
535L25.7Very low29.2Very low157 Ų157133.4 Ų133.482%0.82271%0.707SS**  trans-166.539.4143.9-103.4148.7000111T537L535-T537 VanDerWaalsContact C-N 3.32Å
536S32.8Very low28.9Very low103 Ų103140.6 Ų140.672%0.7274%0.741SS**SBendtrans-8911.2165.759.60000113.8
537T29.9Very low28.7Very low110 Ų110144.5 Ų144.568%0.67576%0.762SS**SBendtrans-160.693.9172.244.10000109.3L535L535-T537 VanDerWaalsContact C-N 3.32Å
538D29.7Very low28.8Very low139 Ų139143.5 Ų143.574%0.74377%0.774SS**SBend169.6124.3126.8-81.3-14.8000111
539S26.6Very low28.3Very low114 Ų114145.8 Ų145.880%0.79780%0.795SS**SBendtrans86.366.1169.371.90000120.5
540V29.9Very low28Very low154 Ų154142.6 Ų142.693%0.93380%0.801SS**  -147.285116.5-179.10000107.6
541L27.4Very low28.4Very low234 Ų234145.3 Ų145.3100%1.22582%0.819SS**  -122.90128.3-149.8153.3000105.2

Retrieved 541 of 541 residues in 509.1 ms (Link to these results)

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